USER MOD reduce.3.24.130724 H: found=0, std=0, add=944, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 946 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 34 TYR OH : rot 180:sc= 0.388 USER MOD Set 1.2: A 36 HIS : no HD1:sc= -7.19! C(o=-6.8!,f=-7.8!) USER MOD Set 2.1: A 32 SER OG : rot 162:sc= -0.0336 USER MOD Set 2.2: A 92 TYR OH : rot 29:sc= 0.41 USER MOD Set 3.1: A 26 SER OG : rot 49:sc= 0.601 USER MOD Set 3.2: A 29 LYS NZ :NH3+ -149:sc= 0.354 (180deg=0) USER MOD Set 4.1: A 18 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 22 HIS : no HE2:sc= -3.48! C(o=-3.5!,f=-8!) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot -51:sc= -0.0737 USER MOD Single : A 11 TYR OH : rot 30:sc= -2.95! USER MOD Single : A 12 ASN : amide:sc= -0.0459 X(o=-0.046,f=0) USER MOD Single : A 13 GLN : amide:sc= -5.35 X(o=-5.4,f=-5.6) USER MOD Single : A 14 ASN : amide:sc= -0.0071 K(o=-0.0071,f=-0.73) USER MOD Single : A 15 LYS NZ :NH3+ -118:sc= -0.029 (180deg=-1.27) USER MOD Single : A 19 ASN : amide:sc= -1.58 K(o=-1.6,f=-4.4!) USER MOD Single : A 20 SER OG : rot -64:sc= 0.362 USER MOD Single : A 21 HIS :FLIP no HD1:sc= -0.317 F(o=-1.2,f=-0.32) USER MOD Single : A 30 THR OG1 : rot -176:sc= 0.658 USER MOD Single : A 33 SER OG : rot 70:sc= 0.308 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= 0.225 K(o=0.22,f=-8.1!) USER MOD Single : A 42 TYR OH : rot -138:sc= -0.0374 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot -34:sc= 0.13 USER MOD Single : A 67 LYS NZ :NH3+ -110:sc= 0.0581 (180deg=0) USER MOD Single : A 68 HIS : no HD1:sc= -3.04 X(o=-3,f=-2.6) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= -1.55 K(o=-1.6,f=-4.6!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 HIS : no HD1:sc= -4.91 K(o=-4.9,f=-8.4!) USER MOD Single : A 79 TYR OH : rot 110:sc= -0.279 USER MOD Single : A 85 THR OG1 : rot -130:sc= -0.0984 USER MOD Single : A 90 HIS : no HD1:sc= -0.93 K(o=-0.93,f=-2.5) USER MOD Single : A 93 LYS NZ :NH3+ -159:sc= -0.323 (180deg=-0.844) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ -164:sc= -0.265 (180deg=-0.985) USER MOD Single : A 102 ASN :FLIP amide:sc= -0.544 F(o=-1.1,f=-0.54) USER MOD Single : A 110 TYR OH : rot 180:sc= -0.263 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 ASN : amide:sc= -0.611 X(o=-0.61,f=-1.1) USER MOD Single : A 115 LYS NZ :NH3+ -138:sc= -0.0425 (180deg=-0.209) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 136 HIS : +bothHN:sc= -3.53 K(o=-3.5,f=-7!) USER MOD ----------------------------------------------------------------- ATOM 13 N VAL A 2 4.186 1.026 -0.728 1.00 0.00 N ATOM 14 CA VAL A 2 5.176 2.105 -0.704 1.00 0.00 C ATOM 15 C VAL A 2 6.254 1.809 -1.738 1.00 0.00 C ATOM 16 O VAL A 2 6.533 0.650 -2.055 1.00 0.00 O ATOM 17 CB VAL A 2 5.728 2.258 0.717 1.00 0.00 C ATOM 18 CG1 VAL A 2 6.615 1.072 1.107 1.00 0.00 C ATOM 19 CG2 VAL A 2 6.459 3.589 0.879 1.00 0.00 C ATOM 0 HA VAL A 2 4.725 3.061 -0.971 1.00 0.00 H new ATOM 0 HB VAL A 2 4.882 2.261 1.404 1.00 0.00 H new ATOM 0 HG11 VAL A 2 6.989 1.215 2.121 1.00 0.00 H new ATOM 0 HG12 VAL A 2 6.033 0.152 1.061 1.00 0.00 H new ATOM 0 HG13 VAL A 2 7.456 1.004 0.417 1.00 0.00 H new ATOM 0 HG21 VAL A 2 6.841 3.673 1.896 1.00 0.00 H new ATOM 0 HG22 VAL A 2 7.289 3.636 0.174 1.00 0.00 H new ATOM 0 HG23 VAL A 2 5.769 4.409 0.682 1.00 0.00 H new ATOM 29 N THR A 3 6.821 2.851 -2.312 1.00 0.00 N ATOM 30 CA THR A 3 7.838 2.750 -3.346 1.00 0.00 C ATOM 31 C THR A 3 9.204 2.691 -2.709 1.00 0.00 C ATOM 32 O THR A 3 9.584 3.596 -1.988 1.00 0.00 O ATOM 33 CB THR A 3 7.690 3.936 -4.289 1.00 0.00 C ATOM 34 OG1 THR A 3 6.344 3.992 -4.673 1.00 0.00 O ATOM 35 CG2 THR A 3 8.451 3.707 -5.567 1.00 0.00 C ATOM 0 H THR A 3 6.584 3.813 -2.069 1.00 0.00 H new ATOM 0 HA THR A 3 7.715 1.836 -3.927 1.00 0.00 H new ATOM 0 HB THR A 3 8.050 4.832 -3.783 1.00 0.00 H new ATOM 0 HG1 THR A 3 6.209 4.748 -5.282 1.00 0.00 H new ATOM 0 HG21 THR A 3 8.329 4.569 -6.223 1.00 0.00 H new ATOM 0 HG22 THR A 3 9.509 3.570 -5.341 1.00 0.00 H new ATOM 0 HG23 THR A 3 8.068 2.816 -6.064 1.00 0.00 H new ATOM 43 N TRP A 4 9.892 1.571 -2.877 1.00 0.00 N ATOM 44 CA TRP A 4 11.210 1.367 -2.320 1.00 0.00 C ATOM 45 C TRP A 4 12.228 2.103 -3.170 1.00 0.00 C ATOM 46 O TRP A 4 12.100 2.137 -4.387 1.00 0.00 O ATOM 47 CB TRP A 4 11.463 -0.127 -2.242 1.00 0.00 C ATOM 48 CG TRP A 4 10.510 -0.898 -1.383 1.00 0.00 C ATOM 49 CD1 TRP A 4 9.175 -1.012 -1.565 1.00 0.00 C ATOM 50 CD2 TRP A 4 10.813 -1.661 -0.182 1.00 0.00 C ATOM 51 NE1 TRP A 4 8.636 -1.757 -0.534 1.00 0.00 N ATOM 52 CE2 TRP A 4 9.601 -2.192 0.339 1.00 0.00 C ATOM 53 CE3 TRP A 4 11.984 -1.927 0.546 1.00 0.00 C ATOM 54 CZ2 TRP A 4 9.557 -2.941 1.522 1.00 0.00 C ATOM 55 CZ3 TRP A 4 11.976 -2.733 1.692 1.00 0.00 C ATOM 56 CH2 TRP A 4 10.763 -3.250 2.177 1.00 0.00 C ATOM 0 H TRP A 4 9.543 0.774 -3.410 1.00 0.00 H new ATOM 0 HA TRP A 4 11.293 1.771 -1.311 1.00 0.00 H new ATOM 0 HB2 TRP A 4 11.428 -0.537 -3.251 1.00 0.00 H new ATOM 0 HB3 TRP A 4 12.474 -0.288 -1.867 1.00 0.00 H new ATOM 0 HD1 TRP A 4 8.618 -0.587 -2.387 1.00 0.00 H new ATOM 0 HE1 TRP A 4 7.641 -1.959 -0.434 1.00 0.00 H new ATOM 0 HE3 TRP A 4 12.918 -1.498 0.213 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 8.612 -3.276 1.925 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 12.901 -2.957 2.202 1.00 0.00 H new ATOM 0 HH2 TRP A 4 10.756 -3.884 3.051 1.00 0.00 H new ATOM 67 N THR A 5 13.230 2.690 -2.534 1.00 0.00 N ATOM 68 CA THR A 5 14.250 3.457 -3.238 1.00 0.00 C ATOM 69 C THR A 5 15.603 3.052 -2.720 1.00 0.00 C ATOM 70 O THR A 5 15.792 2.881 -1.519 1.00 0.00 O ATOM 71 CB THR A 5 13.985 4.961 -3.090 1.00 0.00 C ATOM 72 OG1 THR A 5 13.332 5.340 -4.249 1.00 0.00 O ATOM 73 CG2 THR A 5 15.230 5.833 -2.985 1.00 0.00 C ATOM 0 H THR A 5 13.360 2.650 -1.523 1.00 0.00 H new ATOM 0 HA THR A 5 14.219 3.243 -4.306 1.00 0.00 H new ATOM 0 HB THR A 5 13.430 5.104 -2.163 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.835 5.020 -5.027 1.00 0.00 H new ATOM 0 HG21 THR A 5 14.935 6.877 -2.884 1.00 0.00 H new ATOM 0 HG22 THR A 5 15.811 5.534 -2.113 1.00 0.00 H new ATOM 0 HG23 THR A 5 15.836 5.712 -3.883 1.00 0.00 H new ATOM 81 N CYS A 6 16.555 2.916 -3.634 1.00 0.00 N ATOM 82 CA CYS A 6 17.931 2.595 -3.290 1.00 0.00 C ATOM 83 C CYS A 6 18.907 3.564 -3.961 1.00 0.00 C ATOM 84 O CYS A 6 19.853 3.167 -4.639 1.00 0.00 O ATOM 85 CB CYS A 6 18.170 1.138 -3.649 1.00 0.00 C ATOM 86 SG CYS A 6 18.423 0.124 -2.183 1.00 0.00 S ATOM 0 H CYS A 6 16.393 3.026 -4.635 1.00 0.00 H new ATOM 0 HA CYS A 6 18.108 2.718 -2.222 1.00 0.00 H new ATOM 0 HB2 CYS A 6 17.318 0.757 -4.212 1.00 0.00 H new ATOM 0 HB3 CYS A 6 19.041 1.062 -4.299 1.00 0.00 H new ATOM 91 N GLY A 7 18.640 4.858 -3.818 1.00 0.00 N ATOM 92 CA GLY A 7 19.475 5.893 -4.418 1.00 0.00 C ATOM 93 C GLY A 7 18.638 7.050 -4.907 1.00 0.00 C ATOM 94 O GLY A 7 18.197 7.855 -4.104 1.00 0.00 O ATOM 0 H GLY A 7 17.846 5.217 -3.288 1.00 0.00 H new ATOM 0 HA2 GLY A 7 20.201 6.249 -3.687 1.00 0.00 H new ATOM 0 HA3 GLY A 7 20.040 5.472 -5.249 1.00 0.00 H new ATOM 98 N GLY A 8 18.360 7.081 -6.206 1.00 0.00 N ATOM 99 CA GLY A 8 17.523 8.108 -6.834 1.00 0.00 C ATOM 100 C GLY A 8 16.424 7.519 -7.701 1.00 0.00 C ATOM 101 O GLY A 8 15.745 8.252 -8.406 1.00 0.00 O ATOM 0 H GLY A 8 18.712 6.386 -6.865 1.00 0.00 H new ATOM 0 HA2 GLY A 8 17.075 8.730 -6.059 1.00 0.00 H new ATOM 0 HA3 GLY A 8 18.150 8.760 -7.442 1.00 0.00 H new ATOM 105 N LEU A 9 16.283 6.193 -7.699 1.00 0.00 N ATOM 106 CA LEU A 9 15.343 5.472 -8.539 1.00 0.00 C ATOM 107 C LEU A 9 14.302 4.870 -7.615 1.00 0.00 C ATOM 108 O LEU A 9 14.633 4.397 -6.521 1.00 0.00 O ATOM 109 CB LEU A 9 16.046 4.404 -9.398 1.00 0.00 C ATOM 110 CG LEU A 9 17.565 4.600 -9.619 1.00 0.00 C ATOM 111 CD1 LEU A 9 18.196 3.340 -10.189 1.00 0.00 C ATOM 112 CD2 LEU A 9 17.838 5.784 -10.544 1.00 0.00 C ATOM 0 H LEU A 9 16.835 5.582 -7.097 1.00 0.00 H new ATOM 0 HA LEU A 9 14.870 6.145 -9.254 1.00 0.00 H new ATOM 0 HB2 LEU A 9 15.890 3.431 -8.932 1.00 0.00 H new ATOM 0 HB3 LEU A 9 15.559 4.372 -10.373 1.00 0.00 H new ATOM 0 HG LEU A 9 18.014 4.809 -8.648 1.00 0.00 H new ATOM 0 HD11 LEU A 9 19.264 3.502 -10.336 1.00 0.00 H new ATOM 0 HD12 LEU A 9 18.047 2.512 -9.495 1.00 0.00 H new ATOM 0 HD13 LEU A 9 17.731 3.101 -11.145 1.00 0.00 H new ATOM 0 HD21 LEU A 9 18.913 5.898 -10.681 1.00 0.00 H new ATOM 0 HD22 LEU A 9 17.365 5.607 -11.510 1.00 0.00 H new ATOM 0 HD23 LEU A 9 17.430 6.693 -10.102 1.00 0.00 H new ATOM 124 N LEU A 10 13.051 4.936 -8.045 1.00 0.00 N ATOM 125 CA LEU A 10 11.926 4.410 -7.284 1.00 0.00 C ATOM 126 C LEU A 10 11.601 3.002 -7.766 1.00 0.00 C ATOM 127 O LEU A 10 11.977 2.619 -8.866 1.00 0.00 O ATOM 128 CB LEU A 10 10.739 5.382 -7.439 1.00 0.00 C ATOM 129 CG LEU A 10 10.599 6.356 -6.246 1.00 0.00 C ATOM 130 CD1 LEU A 10 11.825 7.255 -6.100 1.00 0.00 C ATOM 131 CD2 LEU A 10 9.340 7.214 -6.418 1.00 0.00 C ATOM 0 H LEU A 10 12.786 5.357 -8.935 1.00 0.00 H new ATOM 0 HA LEU A 10 12.164 4.334 -6.223 1.00 0.00 H new ATOM 0 HB2 LEU A 10 10.863 5.956 -8.357 1.00 0.00 H new ATOM 0 HB3 LEU A 10 9.818 4.809 -7.544 1.00 0.00 H new ATOM 0 HG LEU A 10 10.516 5.759 -5.338 1.00 0.00 H new ATOM 0 HD11 LEU A 10 11.687 7.924 -5.251 1.00 0.00 H new ATOM 0 HD12 LEU A 10 12.710 6.640 -5.937 1.00 0.00 H new ATOM 0 HD13 LEU A 10 11.955 7.844 -7.008 1.00 0.00 H new ATOM 0 HD21 LEU A 10 9.248 7.898 -5.574 1.00 0.00 H new ATOM 0 HD22 LEU A 10 9.413 7.787 -7.343 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.463 6.568 -6.460 1.00 0.00 H new ATOM 143 N TYR A 11 10.888 2.236 -6.951 1.00 0.00 N ATOM 144 CA TYR A 11 10.607 0.833 -7.213 1.00 0.00 C ATOM 145 C TYR A 11 9.305 0.444 -6.547 1.00 0.00 C ATOM 146 O TYR A 11 9.229 0.211 -5.334 1.00 0.00 O ATOM 147 CB TYR A 11 11.745 -0.044 -6.694 1.00 0.00 C ATOM 148 CG TYR A 11 13.091 0.251 -7.312 1.00 0.00 C ATOM 149 CD1 TYR A 11 13.282 -0.019 -8.679 1.00 0.00 C ATOM 150 CD2 TYR A 11 14.107 0.875 -6.555 1.00 0.00 C ATOM 151 CE1 TYR A 11 14.513 0.261 -9.283 1.00 0.00 C ATOM 152 CE2 TYR A 11 15.321 1.219 -7.171 1.00 0.00 C ATOM 153 CZ TYR A 11 15.521 0.866 -8.519 1.00 0.00 C ATOM 154 OH TYR A 11 16.746 0.967 -9.050 1.00 0.00 O ATOM 0 H TYR A 11 10.484 2.577 -6.079 1.00 0.00 H new ATOM 0 HA TYR A 11 10.520 0.684 -8.289 1.00 0.00 H new ATOM 0 HB2 TYR A 11 11.820 0.080 -5.614 1.00 0.00 H new ATOM 0 HB3 TYR A 11 11.495 -1.089 -6.878 1.00 0.00 H new ATOM 0 HD1 TYR A 11 12.478 -0.443 -9.263 1.00 0.00 H new ATOM 0 HD2 TYR A 11 13.951 1.087 -5.507 1.00 0.00 H new ATOM 0 HE1 TYR A 11 14.684 0.015 -10.321 1.00 0.00 H new ATOM 0 HE2 TYR A 11 16.087 1.745 -6.621 1.00 0.00 H new ATOM 0 HH TYR A 11 16.675 1.042 -10.025 1.00 0.00 H new ATOM 164 N ASN A 12 8.217 0.503 -7.313 1.00 0.00 N ATOM 165 CA ASN A 12 6.918 0.187 -6.764 1.00 0.00 C ATOM 166 C ASN A 12 6.983 -1.200 -6.181 1.00 0.00 C ATOM 167 O ASN A 12 7.221 -2.122 -6.947 1.00 0.00 O ATOM 168 CB ASN A 12 5.841 0.250 -7.855 1.00 0.00 C ATOM 169 CG ASN A 12 4.663 1.048 -7.370 1.00 0.00 C ATOM 170 OD1 ASN A 12 4.185 1.911 -8.059 1.00 0.00 O ATOM 171 ND2 ASN A 12 4.124 0.717 -6.221 1.00 0.00 N ATOM 0 H ASN A 12 8.217 0.763 -8.299 1.00 0.00 H new ATOM 0 HA ASN A 12 6.655 0.911 -5.993 1.00 0.00 H new ATOM 0 HB2 ASN A 12 6.252 0.704 -8.757 1.00 0.00 H new ATOM 0 HB3 ASN A 12 5.523 -0.758 -8.122 1.00 0.00 H new ATOM 0 HD21 ASN A 12 3.283 1.194 -5.896 1.00 0.00 H new ATOM 0 HD22 ASN A 12 4.546 -0.018 -5.653 1.00 0.00 H new ATOM 178 N GLN A 13 6.716 -1.343 -4.880 1.00 0.00 N ATOM 179 CA GLN A 13 6.769 -2.649 -4.251 1.00 0.00 C ATOM 180 C GLN A 13 5.983 -3.679 -5.020 1.00 0.00 C ATOM 181 O GLN A 13 6.501 -4.730 -5.301 1.00 0.00 O ATOM 182 CB GLN A 13 6.202 -2.607 -2.833 1.00 0.00 C ATOM 183 CG GLN A 13 6.216 -3.989 -2.145 1.00 0.00 C ATOM 184 CD GLN A 13 7.494 -4.747 -2.448 1.00 0.00 C ATOM 185 OE1 GLN A 13 7.507 -5.892 -2.834 1.00 0.00 O ATOM 186 NE2 GLN A 13 8.620 -4.075 -2.356 1.00 0.00 N ATOM 0 H GLN A 13 6.465 -0.577 -4.256 1.00 0.00 H new ATOM 0 HA GLN A 13 7.823 -2.926 -4.233 1.00 0.00 H new ATOM 0 HB2 GLN A 13 6.780 -1.902 -2.235 1.00 0.00 H new ATOM 0 HB3 GLN A 13 5.179 -2.232 -2.866 1.00 0.00 H new ATOM 0 HG2 GLN A 13 6.114 -3.861 -1.067 1.00 0.00 H new ATOM 0 HG3 GLN A 13 5.358 -4.572 -2.479 1.00 0.00 H new ATOM 0 HE21 GLN A 13 8.612 -3.108 -2.030 1.00 0.00 H new ATOM 0 HE22 GLN A 13 9.502 -4.520 -2.610 1.00 0.00 H new ATOM 195 N ASN A 14 4.791 -3.320 -5.480 1.00 0.00 N ATOM 196 CA ASN A 14 4.009 -4.202 -6.330 1.00 0.00 C ATOM 197 C ASN A 14 4.830 -4.783 -7.464 1.00 0.00 C ATOM 198 O ASN A 14 4.820 -5.963 -7.639 1.00 0.00 O ATOM 199 CB ASN A 14 2.884 -3.415 -6.984 1.00 0.00 C ATOM 200 CG ASN A 14 1.716 -4.311 -7.328 1.00 0.00 C ATOM 201 OD1 ASN A 14 1.839 -5.423 -7.794 1.00 0.00 O ATOM 202 ND2 ASN A 14 0.541 -3.770 -7.182 1.00 0.00 N ATOM 0 H ASN A 14 4.347 -2.424 -5.278 1.00 0.00 H new ATOM 0 HA ASN A 14 3.642 -5.003 -5.689 1.00 0.00 H new ATOM 0 HB2 ASN A 14 2.552 -2.623 -6.312 1.00 0.00 H new ATOM 0 HB3 ASN A 14 3.253 -2.932 -7.888 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -0.295 -4.283 -7.462 1.00 0.00 H new ATOM 0 HD22 ASN A 14 0.456 -2.833 -6.788 1.00 0.00 H new ATOM 209 N LYS A 15 5.585 -3.984 -8.217 1.00 0.00 N ATOM 210 CA LYS A 15 6.591 -4.486 -9.154 1.00 0.00 C ATOM 211 C LYS A 15 7.785 -5.166 -8.486 1.00 0.00 C ATOM 212 O LYS A 15 8.177 -6.206 -8.954 1.00 0.00 O ATOM 213 CB LYS A 15 7.063 -3.317 -10.010 1.00 0.00 C ATOM 214 CG LYS A 15 6.271 -3.289 -11.324 1.00 0.00 C ATOM 215 CD LYS A 15 5.708 -1.888 -11.579 1.00 0.00 C ATOM 216 CE LYS A 15 4.296 -1.756 -11.002 1.00 0.00 C ATOM 217 NZ LYS A 15 4.033 -0.356 -10.599 1.00 0.00 N ATOM 0 H LYS A 15 5.516 -2.967 -8.195 1.00 0.00 H new ATOM 0 HA LYS A 15 6.119 -5.263 -9.756 1.00 0.00 H new ATOM 0 HB2 LYS A 15 6.926 -2.380 -9.471 1.00 0.00 H new ATOM 0 HB3 LYS A 15 8.129 -3.412 -10.218 1.00 0.00 H new ATOM 0 HG2 LYS A 15 6.916 -3.584 -12.151 1.00 0.00 H new ATOM 0 HG3 LYS A 15 5.457 -4.013 -11.281 1.00 0.00 H new ATOM 0 HD2 LYS A 15 6.361 -1.141 -11.128 1.00 0.00 H new ATOM 0 HD3 LYS A 15 5.688 -1.689 -12.650 1.00 0.00 H new ATOM 0 HE2 LYS A 15 3.562 -2.072 -11.743 1.00 0.00 H new ATOM 0 HE3 LYS A 15 4.184 -2.416 -10.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 3.856 -0.317 -9.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 4.858 0.233 -10.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 3.199 0.001 -11.108 1.00 0.00 H new ATOM 231 N ALA A 16 8.298 -4.711 -7.366 1.00 0.00 N ATOM 232 CA ALA A 16 9.298 -5.472 -6.637 1.00 0.00 C ATOM 233 C ALA A 16 8.924 -6.936 -6.389 1.00 0.00 C ATOM 234 O ALA A 16 9.723 -7.818 -6.634 1.00 0.00 O ATOM 235 CB ALA A 16 9.584 -4.759 -5.345 1.00 0.00 C ATOM 0 H ALA A 16 8.043 -3.821 -6.937 1.00 0.00 H new ATOM 0 HA ALA A 16 10.190 -5.523 -7.261 1.00 0.00 H new ATOM 0 HB1 ALA A 16 10.333 -5.314 -4.781 1.00 0.00 H new ATOM 0 HB2 ALA A 16 9.958 -3.757 -5.557 1.00 0.00 H new ATOM 0 HB3 ALA A 16 8.668 -4.687 -4.758 1.00 0.00 H new ATOM 241 N GLU A 17 7.696 -7.223 -5.991 1.00 0.00 N ATOM 242 CA GLU A 17 7.224 -8.585 -5.804 1.00 0.00 C ATOM 243 C GLU A 17 6.658 -9.112 -7.107 1.00 0.00 C ATOM 244 O GLU A 17 6.935 -10.240 -7.431 1.00 0.00 O ATOM 245 CB GLU A 17 6.185 -8.657 -4.683 1.00 0.00 C ATOM 246 CG GLU A 17 5.157 -7.536 -4.779 1.00 0.00 C ATOM 247 CD GLU A 17 3.921 -7.793 -3.960 1.00 0.00 C ATOM 248 OE1 GLU A 17 3.987 -7.527 -2.742 1.00 0.00 O ATOM 249 OE2 GLU A 17 2.926 -8.228 -4.583 1.00 0.00 O ATOM 0 H GLU A 17 6.993 -6.512 -5.787 1.00 0.00 H new ATOM 0 HA GLU A 17 8.065 -9.212 -5.508 1.00 0.00 H new ATOM 0 HB2 GLU A 17 5.675 -9.620 -4.723 1.00 0.00 H new ATOM 0 HB3 GLU A 17 6.689 -8.604 -3.718 1.00 0.00 H new ATOM 0 HG2 GLU A 17 5.615 -6.603 -4.451 1.00 0.00 H new ATOM 0 HG3 GLU A 17 4.872 -7.402 -5.822 1.00 0.00 H new ATOM 256 N SER A 18 5.927 -8.332 -7.898 1.00 0.00 N ATOM 257 CA SER A 18 5.256 -8.730 -9.137 1.00 0.00 C ATOM 258 C SER A 18 6.270 -8.921 -10.229 1.00 0.00 C ATOM 259 O SER A 18 6.396 -10.033 -10.692 1.00 0.00 O ATOM 260 CB SER A 18 4.268 -7.703 -9.657 1.00 0.00 C ATOM 261 OG SER A 18 3.621 -8.171 -10.818 1.00 0.00 O ATOM 0 H SER A 18 5.777 -7.347 -7.681 1.00 0.00 H new ATOM 0 HA SER A 18 4.719 -9.645 -8.888 1.00 0.00 H new ATOM 0 HB2 SER A 18 3.528 -7.482 -8.888 1.00 0.00 H new ATOM 0 HB3 SER A 18 4.788 -6.771 -9.876 1.00 0.00 H new ATOM 0 HG SER A 18 2.988 -7.494 -11.135 1.00 0.00 H new ATOM 267 N ASN A 19 7.047 -7.906 -10.610 1.00 0.00 N ATOM 268 CA ASN A 19 8.197 -8.062 -11.491 1.00 0.00 C ATOM 269 C ASN A 19 9.016 -9.312 -11.199 1.00 0.00 C ATOM 270 O ASN A 19 9.383 -10.005 -12.137 1.00 0.00 O ATOM 271 CB ASN A 19 9.107 -6.831 -11.480 1.00 0.00 C ATOM 272 CG ASN A 19 9.926 -6.725 -12.730 1.00 0.00 C ATOM 273 OD1 ASN A 19 11.117 -6.536 -12.733 1.00 0.00 O ATOM 274 ND2 ASN A 19 9.286 -6.759 -13.857 1.00 0.00 N ATOM 0 H ASN A 19 6.891 -6.944 -10.310 1.00 0.00 H new ATOM 0 HA ASN A 19 7.771 -8.174 -12.488 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.500 -5.933 -11.368 1.00 0.00 H new ATOM 0 HB3 ASN A 19 9.770 -6.878 -10.616 1.00 0.00 H new ATOM 0 HD21 ASN A 19 9.790 -6.627 -14.734 1.00 0.00 H new ATOM 0 HD22 ASN A 19 8.279 -6.918 -13.867 1.00 0.00 H new ATOM 281 N SER A 20 9.173 -9.644 -9.916 1.00 0.00 N ATOM 282 CA SER A 20 9.804 -10.887 -9.487 1.00 0.00 C ATOM 283 C SER A 20 8.918 -12.122 -9.488 1.00 0.00 C ATOM 284 O SER A 20 9.401 -13.219 -9.696 1.00 0.00 O ATOM 285 CB SER A 20 10.319 -10.727 -8.073 1.00 0.00 C ATOM 286 OG SER A 20 9.651 -11.502 -7.081 1.00 0.00 O ATOM 0 H SER A 20 8.863 -9.053 -9.144 1.00 0.00 H new ATOM 0 HA SER A 20 10.586 -11.055 -10.228 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.377 -10.988 -8.060 1.00 0.00 H new ATOM 0 HB3 SER A 20 10.246 -9.675 -7.796 1.00 0.00 H new ATOM 0 HG SER A 20 8.718 -11.210 -7.011 1.00 0.00 H new ATOM 292 N HIS A 21 7.615 -11.992 -9.255 1.00 0.00 N ATOM 293 CA HIS A 21 6.635 -13.074 -9.265 1.00 0.00 C ATOM 294 C HIS A 21 6.789 -13.879 -10.544 1.00 0.00 C ATOM 295 O HIS A 21 6.595 -15.086 -10.522 1.00 0.00 O ATOM 296 CB HIS A 21 5.200 -12.524 -9.134 1.00 0.00 C ATOM 297 CG HIS A 21 4.667 -12.438 -7.728 1.00 0.00 C ATOM 298 ND1 HIS A 21 5.388 -12.377 -6.565 1.00 0.00 N flip ATOM 299 CD2 HIS A 21 3.325 -12.393 -7.414 1.00 0.00 C flip ATOM 300 CE1 HIS A 21 4.474 -12.289 -5.533 1.00 0.00 C flip ATOM 301 NE2 HIS A 21 3.233 -12.304 -6.069 1.00 0.00 N flip ATOM 0 H HIS A 21 7.194 -11.087 -9.044 1.00 0.00 H new ATOM 0 HA HIS A 21 6.815 -13.723 -8.408 1.00 0.00 H new ATOM 0 HB2 HIS A 21 5.168 -11.529 -9.578 1.00 0.00 H new ATOM 0 HB3 HIS A 21 4.532 -13.156 -9.720 1.00 0.00 H new ATOM 0 HD2 HIS A 21 2.502 -12.423 -8.112 1.00 0.00 H new ATOM 0 HE1 HIS A 21 4.710 -12.220 -4.481 1.00 0.00 H new ATOM 0 HE2 HIS A 21 2.362 -12.256 -5.540 1.00 0.00 H new ATOM 310 N HIS A 22 7.123 -13.208 -11.651 1.00 0.00 N ATOM 311 CA HIS A 22 7.374 -13.822 -12.931 1.00 0.00 C ATOM 312 C HIS A 22 8.708 -14.541 -12.962 1.00 0.00 C ATOM 313 O HIS A 22 8.746 -15.651 -13.472 1.00 0.00 O ATOM 314 CB HIS A 22 7.322 -12.780 -14.047 1.00 0.00 C ATOM 315 CG HIS A 22 6.589 -11.498 -13.755 1.00 0.00 C ATOM 316 ND1 HIS A 22 7.004 -10.277 -14.205 1.00 0.00 N ATOM 317 CD2 HIS A 22 5.452 -11.311 -13.021 1.00 0.00 C ATOM 318 CE1 HIS A 22 6.109 -9.360 -13.799 1.00 0.00 C ATOM 319 NE2 HIS A 22 5.147 -9.959 -13.066 1.00 0.00 N ATOM 0 H HIS A 22 7.226 -12.193 -11.667 1.00 0.00 H new ATOM 0 HA HIS A 22 6.590 -14.562 -13.091 1.00 0.00 H new ATOM 0 HB2 HIS A 22 8.346 -12.529 -14.323 1.00 0.00 H new ATOM 0 HB3 HIS A 22 6.861 -13.242 -14.920 1.00 0.00 H new ATOM 0 HD1 HIS A 22 7.845 -10.093 -14.753 1.00 0.00 H new ATOM 0 HD2 HIS A 22 4.893 -12.075 -12.501 1.00 0.00 H new ATOM 0 HE1 HIS A 22 6.153 -8.305 -14.025 1.00 0.00 H new ATOM 328 N ALA A 23 9.746 -13.915 -12.400 1.00 0.00 N ATOM 329 CA ALA A 23 11.042 -14.505 -12.189 1.00 0.00 C ATOM 330 C ALA A 23 10.972 -15.998 -11.815 1.00 0.00 C ATOM 331 O ALA A 23 10.226 -16.388 -10.908 1.00 0.00 O ATOM 332 CB ALA A 23 11.816 -13.749 -11.122 1.00 0.00 C ATOM 0 H ALA A 23 9.690 -12.950 -12.073 1.00 0.00 H new ATOM 0 HA ALA A 23 11.564 -14.431 -13.143 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.791 -14.215 -10.981 1.00 0.00 H new ATOM 0 HB2 ALA A 23 11.950 -12.713 -11.435 1.00 0.00 H new ATOM 0 HB3 ALA A 23 11.263 -13.776 -10.183 1.00 0.00 H new ATOM 338 N PRO A 24 11.741 -16.842 -12.505 1.00 0.00 N ATOM 339 CA PRO A 24 11.698 -18.269 -12.289 1.00 0.00 C ATOM 340 C PRO A 24 12.368 -18.583 -10.968 1.00 0.00 C ATOM 341 O PRO A 24 13.519 -18.209 -10.759 1.00 0.00 O ATOM 342 CB PRO A 24 12.414 -18.898 -13.477 1.00 0.00 C ATOM 343 CG PRO A 24 13.209 -17.772 -14.114 1.00 0.00 C ATOM 344 CD PRO A 24 12.706 -16.473 -13.511 1.00 0.00 C ATOM 0 HA PRO A 24 10.684 -18.665 -12.228 1.00 0.00 H new ATOM 0 HB2 PRO A 24 13.069 -19.708 -13.156 1.00 0.00 H new ATOM 0 HB3 PRO A 24 11.702 -19.324 -14.184 1.00 0.00 H new ATOM 0 HG2 PRO A 24 14.275 -17.898 -13.924 1.00 0.00 H new ATOM 0 HG3 PRO A 24 13.076 -17.771 -15.196 1.00 0.00 H new ATOM 0 HD2 PRO A 24 13.526 -15.904 -13.073 1.00 0.00 H new ATOM 0 HD3 PRO A 24 12.251 -15.841 -14.273 1.00 0.00 H new ATOM 352 N LEU A 25 11.640 -19.260 -10.077 1.00 0.00 N ATOM 353 CA LEU A 25 12.123 -19.672 -8.769 1.00 0.00 C ATOM 354 C LEU A 25 13.297 -20.625 -8.907 1.00 0.00 C ATOM 355 O LEU A 25 13.114 -21.822 -9.108 1.00 0.00 O ATOM 356 CB LEU A 25 10.959 -20.278 -7.956 1.00 0.00 C ATOM 357 CG LEU A 25 10.805 -19.699 -6.549 1.00 0.00 C ATOM 358 CD1 LEU A 25 10.929 -18.188 -6.555 1.00 0.00 C ATOM 359 CD2 LEU A 25 9.467 -20.124 -5.951 1.00 0.00 C ATOM 0 H LEU A 25 10.676 -19.541 -10.255 1.00 0.00 H new ATOM 0 HA LEU A 25 12.492 -18.804 -8.223 1.00 0.00 H new ATOM 0 HB2 LEU A 25 10.029 -20.123 -8.504 1.00 0.00 H new ATOM 0 HB3 LEU A 25 11.107 -21.355 -7.879 1.00 0.00 H new ATOM 0 HG LEU A 25 11.612 -20.093 -5.931 1.00 0.00 H new ATOM 0 HD11 LEU A 25 10.815 -17.810 -5.539 1.00 0.00 H new ATOM 0 HD12 LEU A 25 11.909 -17.905 -6.940 1.00 0.00 H new ATOM 0 HD13 LEU A 25 10.153 -17.762 -7.191 1.00 0.00 H new ATOM 0 HD21 LEU A 25 9.367 -19.707 -4.949 1.00 0.00 H new ATOM 0 HD22 LEU A 25 8.655 -19.758 -6.579 1.00 0.00 H new ATOM 0 HD23 LEU A 25 9.422 -21.212 -5.897 1.00 0.00 H new ATOM 371 N SER A 26 14.500 -20.076 -8.924 1.00 0.00 N ATOM 372 CA SER A 26 15.728 -20.835 -9.147 1.00 0.00 C ATOM 373 C SER A 26 16.922 -19.890 -9.107 1.00 0.00 C ATOM 374 O SER A 26 16.796 -18.705 -9.374 1.00 0.00 O ATOM 375 CB SER A 26 15.788 -21.455 -10.547 1.00 0.00 C ATOM 376 OG SER A 26 15.381 -22.806 -10.680 1.00 0.00 O ATOM 0 H SER A 26 14.658 -19.078 -8.782 1.00 0.00 H new ATOM 0 HA SER A 26 15.747 -21.606 -8.377 1.00 0.00 H new ATOM 0 HB2 SER A 26 15.169 -20.850 -11.210 1.00 0.00 H new ATOM 0 HB3 SER A 26 16.814 -21.375 -10.907 1.00 0.00 H new ATOM 0 HG SER A 26 14.517 -22.933 -10.235 1.00 0.00 H new ATOM 382 N ASP A 27 18.098 -20.412 -8.842 1.00 0.00 N ATOM 383 CA ASP A 27 19.308 -19.697 -8.440 1.00 0.00 C ATOM 384 C ASP A 27 20.110 -19.565 -9.707 1.00 0.00 C ATOM 385 O ASP A 27 20.845 -20.459 -10.090 1.00 0.00 O ATOM 386 CB ASP A 27 20.157 -20.377 -7.327 1.00 0.00 C ATOM 387 CG ASP A 27 19.482 -21.435 -6.486 1.00 0.00 C ATOM 388 OD1 ASP A 27 18.630 -22.137 -7.065 1.00 0.00 O ATOM 389 OD2 ASP A 27 19.893 -21.609 -5.320 1.00 0.00 O ATOM 0 H ASP A 27 18.255 -21.418 -8.903 1.00 0.00 H new ATOM 0 HA ASP A 27 19.024 -18.748 -7.985 1.00 0.00 H new ATOM 0 HB2 ASP A 27 21.031 -20.828 -7.798 1.00 0.00 H new ATOM 0 HB3 ASP A 27 20.522 -19.597 -6.658 1.00 0.00 H new ATOM 394 N GLY A 28 19.882 -18.488 -10.437 1.00 0.00 N ATOM 395 CA GLY A 28 20.557 -18.333 -11.710 1.00 0.00 C ATOM 396 C GLY A 28 20.163 -19.427 -12.703 1.00 0.00 C ATOM 397 O GLY A 28 20.927 -20.339 -12.991 1.00 0.00 O ATOM 0 H GLY A 28 19.253 -17.728 -10.179 1.00 0.00 H new ATOM 0 HA2 GLY A 28 20.317 -17.357 -12.131 1.00 0.00 H new ATOM 0 HA3 GLY A 28 21.636 -18.356 -11.554 1.00 0.00 H new ATOM 401 N LYS A 29 18.962 -19.324 -13.270 1.00 0.00 N ATOM 402 CA LYS A 29 18.466 -20.248 -14.304 1.00 0.00 C ATOM 403 C LYS A 29 17.732 -19.509 -15.421 1.00 0.00 C ATOM 404 O LYS A 29 16.757 -19.963 -16.010 1.00 0.00 O ATOM 405 CB LYS A 29 17.696 -21.363 -13.596 1.00 0.00 C ATOM 406 CG LYS A 29 16.953 -22.279 -14.579 1.00 0.00 C ATOM 407 CD LYS A 29 16.891 -23.729 -14.151 1.00 0.00 C ATOM 408 CE LYS A 29 15.454 -24.103 -13.801 1.00 0.00 C ATOM 409 NZ LYS A 29 15.460 -25.074 -12.686 1.00 0.00 N ATOM 0 H LYS A 29 18.295 -18.592 -13.026 1.00 0.00 H new ATOM 0 HA LYS A 29 19.279 -20.728 -14.849 1.00 0.00 H new ATOM 0 HB2 LYS A 29 18.389 -21.959 -13.002 1.00 0.00 H new ATOM 0 HB3 LYS A 29 16.980 -20.922 -12.903 1.00 0.00 H new ATOM 0 HG2 LYS A 29 15.937 -21.906 -14.708 1.00 0.00 H new ATOM 0 HG3 LYS A 29 17.440 -22.220 -15.552 1.00 0.00 H new ATOM 0 HD2 LYS A 29 17.259 -24.370 -14.952 1.00 0.00 H new ATOM 0 HD3 LYS A 29 17.539 -23.892 -13.290 1.00 0.00 H new ATOM 0 HE2 LYS A 29 14.892 -23.212 -13.520 1.00 0.00 H new ATOM 0 HE3 LYS A 29 14.956 -24.533 -14.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 14.640 -25.708 -12.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 16.336 -25.634 -12.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 15.409 -24.564 -11.781 1.00 0.00 H new ATOM 423 N THR A 30 18.121 -18.278 -15.645 1.00 0.00 N ATOM 424 CA THR A 30 17.375 -17.449 -16.575 1.00 0.00 C ATOM 425 C THR A 30 18.332 -17.106 -17.667 1.00 0.00 C ATOM 426 O THR A 30 19.533 -16.999 -17.409 1.00 0.00 O ATOM 427 CB THR A 30 16.826 -16.245 -15.850 1.00 0.00 C ATOM 428 OG1 THR A 30 17.852 -15.334 -15.699 1.00 0.00 O ATOM 429 CG2 THR A 30 16.249 -16.561 -14.469 1.00 0.00 C ATOM 0 H THR A 30 18.929 -17.831 -15.211 1.00 0.00 H new ATOM 0 HA THR A 30 16.507 -17.951 -17.002 1.00 0.00 H new ATOM 0 HB THR A 30 16.003 -15.856 -16.450 1.00 0.00 H new ATOM 0 HG1 THR A 30 17.535 -14.569 -15.175 1.00 0.00 H new ATOM 0 HG21 THR A 30 15.875 -15.645 -14.013 1.00 0.00 H new ATOM 0 HG22 THR A 30 15.432 -17.275 -14.571 1.00 0.00 H new ATOM 0 HG23 THR A 30 17.028 -16.989 -13.838 1.00 0.00 H new ATOM 437 N GLY A 31 17.823 -16.976 -18.888 1.00 0.00 N ATOM 438 CA GLY A 31 18.654 -16.662 -20.037 1.00 0.00 C ATOM 439 C GLY A 31 19.677 -15.593 -19.709 1.00 0.00 C ATOM 440 O GLY A 31 20.871 -15.772 -19.946 1.00 0.00 O ATOM 0 H GLY A 31 16.832 -17.085 -19.104 1.00 0.00 H new ATOM 0 HA2 GLY A 31 19.165 -17.564 -20.375 1.00 0.00 H new ATOM 0 HA3 GLY A 31 18.025 -16.324 -20.861 1.00 0.00 H new ATOM 444 N SER A 32 19.210 -14.460 -19.191 1.00 0.00 N ATOM 445 CA SER A 32 20.120 -13.432 -18.730 1.00 0.00 C ATOM 446 C SER A 32 20.961 -13.890 -17.566 1.00 0.00 C ATOM 447 O SER A 32 22.182 -13.792 -17.697 1.00 0.00 O ATOM 448 CB SER A 32 19.362 -12.159 -18.373 1.00 0.00 C ATOM 449 OG SER A 32 20.001 -11.448 -17.320 1.00 0.00 O ATOM 0 H SER A 32 18.220 -14.238 -19.084 1.00 0.00 H new ATOM 0 HA SER A 32 20.800 -13.218 -19.554 1.00 0.00 H new ATOM 0 HB2 SER A 32 19.289 -11.520 -19.253 1.00 0.00 H new ATOM 0 HB3 SER A 32 18.344 -12.412 -18.077 1.00 0.00 H new ATOM 0 HG SER A 32 19.677 -10.523 -17.306 1.00 0.00 H new ATOM 455 N SER A 33 20.331 -14.219 -16.434 1.00 0.00 N ATOM 456 CA SER A 33 20.922 -14.694 -15.180 1.00 0.00 C ATOM 457 C SER A 33 19.958 -14.544 -14.024 1.00 0.00 C ATOM 458 O SER A 33 19.611 -15.523 -13.382 1.00 0.00 O ATOM 459 CB SER A 33 22.177 -13.905 -14.823 1.00 0.00 C ATOM 460 OG SER A 33 23.330 -14.598 -15.219 1.00 0.00 O ATOM 0 H SER A 33 19.315 -14.155 -16.366 1.00 0.00 H new ATOM 0 HA SER A 33 21.165 -15.745 -15.339 1.00 0.00 H new ATOM 0 HB2 SER A 33 22.149 -12.929 -15.308 1.00 0.00 H new ATOM 0 HB3 SER A 33 22.206 -13.726 -13.748 1.00 0.00 H new ATOM 0 HG SER A 33 23.392 -14.598 -16.197 1.00 0.00 H new ATOM 466 N TYR A 34 19.527 -13.308 -13.767 1.00 0.00 N ATOM 467 CA TYR A 34 18.577 -12.977 -12.729 1.00 0.00 C ATOM 468 C TYR A 34 17.204 -13.660 -12.863 1.00 0.00 C ATOM 469 O TYR A 34 16.660 -13.684 -13.956 1.00 0.00 O ATOM 470 CB TYR A 34 18.337 -11.483 -12.732 1.00 0.00 C ATOM 471 CG TYR A 34 19.505 -10.708 -12.171 1.00 0.00 C ATOM 472 CD1 TYR A 34 19.646 -10.572 -10.778 1.00 0.00 C ATOM 473 CD2 TYR A 34 20.427 -10.089 -13.044 1.00 0.00 C ATOM 474 CE1 TYR A 34 20.677 -9.772 -10.283 1.00 0.00 C ATOM 475 CE2 TYR A 34 21.495 -9.325 -12.530 1.00 0.00 C ATOM 476 CZ TYR A 34 21.614 -9.152 -11.138 1.00 0.00 C ATOM 477 OH TYR A 34 22.671 -8.486 -10.598 1.00 0.00 O ATOM 0 H TYR A 34 19.844 -12.495 -14.295 1.00 0.00 H new ATOM 0 HA TYR A 34 19.028 -13.337 -11.804 1.00 0.00 H new ATOM 0 HB2 TYR A 34 18.142 -11.152 -13.752 1.00 0.00 H new ATOM 0 HB3 TYR A 34 17.444 -11.261 -12.148 1.00 0.00 H new ATOM 0 HD1 TYR A 34 18.969 -11.077 -10.104 1.00 0.00 H new ATOM 0 HD2 TYR A 34 20.313 -10.202 -14.112 1.00 0.00 H new ATOM 0 HE1 TYR A 34 20.760 -9.623 -9.217 1.00 0.00 H new ATOM 0 HE2 TYR A 34 22.215 -8.877 -13.198 1.00 0.00 H new ATOM 0 HH TYR A 34 23.226 -8.116 -11.316 1.00 0.00 H new ATOM 487 N PRO A 35 16.592 -14.091 -11.759 1.00 0.00 N ATOM 488 CA PRO A 35 17.143 -13.869 -10.452 1.00 0.00 C ATOM 489 C PRO A 35 18.290 -14.820 -10.127 1.00 0.00 C ATOM 490 O PRO A 35 18.544 -15.788 -10.826 1.00 0.00 O ATOM 491 CB PRO A 35 15.980 -14.035 -9.539 1.00 0.00 C ATOM 492 CG PRO A 35 14.928 -14.876 -10.226 1.00 0.00 C ATOM 493 CD PRO A 35 15.321 -14.795 -11.702 1.00 0.00 C ATOM 0 HA PRO A 35 17.601 -12.884 -10.359 1.00 0.00 H new ATOM 0 HB2 PRO A 35 16.296 -14.512 -8.611 1.00 0.00 H new ATOM 0 HB3 PRO A 35 15.569 -13.061 -9.273 1.00 0.00 H new ATOM 0 HG2 PRO A 35 14.935 -15.904 -9.864 1.00 0.00 H new ATOM 0 HG3 PRO A 35 13.925 -14.485 -10.055 1.00 0.00 H new ATOM 0 HD2 PRO A 35 15.411 -15.792 -12.134 1.00 0.00 H new ATOM 0 HD3 PRO A 35 14.560 -14.267 -12.276 1.00 0.00 H new ATOM 501 N HIS A 36 19.033 -14.539 -9.069 1.00 0.00 N ATOM 502 CA HIS A 36 20.133 -15.429 -8.667 1.00 0.00 C ATOM 503 C HIS A 36 20.175 -15.630 -7.175 1.00 0.00 C ATOM 504 O HIS A 36 19.392 -15.020 -6.491 1.00 0.00 O ATOM 505 CB HIS A 36 21.434 -14.913 -9.257 1.00 0.00 C ATOM 506 CG HIS A 36 21.833 -13.545 -8.795 1.00 0.00 C ATOM 507 ND1 HIS A 36 22.130 -12.482 -9.610 1.00 0.00 N ATOM 508 CD2 HIS A 36 22.038 -13.151 -7.517 1.00 0.00 C ATOM 509 CE1 HIS A 36 22.536 -11.468 -8.807 1.00 0.00 C ATOM 510 NE2 HIS A 36 22.447 -11.849 -7.528 1.00 0.00 N ATOM 0 H HIS A 36 18.906 -13.719 -8.476 1.00 0.00 H new ATOM 0 HA HIS A 36 19.965 -16.427 -9.072 1.00 0.00 H new ATOM 0 HB2 HIS A 36 22.232 -15.612 -9.009 1.00 0.00 H new ATOM 0 HB3 HIS A 36 21.346 -14.903 -10.343 1.00 0.00 H new ATOM 0 HD2 HIS A 36 21.901 -13.763 -6.638 1.00 0.00 H new ATOM 0 HE1 HIS A 36 22.878 -10.502 -9.147 1.00 0.00 H new ATOM 0 HE2 HIS A 36 22.648 -11.272 -6.711 1.00 0.00 H new ATOM 519 N TRP A 37 21.031 -16.488 -6.651 1.00 0.00 N ATOM 520 CA TRP A 37 21.190 -16.599 -5.198 1.00 0.00 C ATOM 521 C TRP A 37 22.000 -15.421 -4.650 1.00 0.00 C ATOM 522 O TRP A 37 23.057 -15.052 -5.177 1.00 0.00 O ATOM 523 CB TRP A 37 21.902 -17.903 -4.885 1.00 0.00 C ATOM 524 CG TRP A 37 22.499 -18.008 -3.530 1.00 0.00 C ATOM 525 CD1 TRP A 37 21.881 -17.892 -2.332 1.00 0.00 C ATOM 526 CD2 TRP A 37 23.880 -18.267 -3.230 1.00 0.00 C ATOM 527 NE1 TRP A 37 22.789 -18.034 -1.316 1.00 0.00 N ATOM 528 CE2 TRP A 37 24.033 -18.288 -1.813 1.00 0.00 C ATOM 529 CE3 TRP A 37 25.015 -18.486 -4.026 1.00 0.00 C ATOM 530 CZ2 TRP A 37 25.263 -18.506 -1.205 1.00 0.00 C ATOM 531 CZ3 TRP A 37 26.262 -18.732 -3.445 1.00 0.00 C ATOM 532 CH2 TRP A 37 26.363 -18.721 -2.046 1.00 0.00 C ATOM 0 H TRP A 37 21.624 -17.115 -7.195 1.00 0.00 H new ATOM 0 HA TRP A 37 20.208 -16.584 -4.726 1.00 0.00 H new ATOM 0 HB2 TRP A 37 21.193 -18.721 -5.013 1.00 0.00 H new ATOM 0 HB3 TRP A 37 22.693 -18.048 -5.621 1.00 0.00 H new ATOM 0 HD1 TRP A 37 20.825 -17.713 -2.196 1.00 0.00 H new ATOM 0 HE1 TRP A 37 22.565 -17.960 -0.324 1.00 0.00 H new ATOM 0 HE3 TRP A 37 24.923 -18.464 -5.102 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 25.367 -18.510 -0.130 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 27.129 -18.926 -4.060 1.00 0.00 H new ATOM 0 HH2 TRP A 37 27.331 -18.886 -1.597 1.00 0.00 H new ATOM 543 N PHE A 38 21.483 -14.826 -3.591 1.00 0.00 N ATOM 544 CA PHE A 38 22.031 -13.702 -2.899 1.00 0.00 C ATOM 545 C PHE A 38 22.773 -14.285 -1.728 1.00 0.00 C ATOM 546 O PHE A 38 22.208 -14.434 -0.642 1.00 0.00 O ATOM 547 CB PHE A 38 20.908 -12.802 -2.372 1.00 0.00 C ATOM 548 CG PHE A 38 21.399 -11.573 -1.651 1.00 0.00 C ATOM 549 CD1 PHE A 38 22.648 -10.993 -1.971 1.00 0.00 C ATOM 550 CD2 PHE A 38 20.594 -11.036 -0.636 1.00 0.00 C ATOM 551 CE1 PHE A 38 23.111 -9.895 -1.243 1.00 0.00 C ATOM 552 CE2 PHE A 38 21.050 -9.931 0.093 1.00 0.00 C ATOM 553 CZ PHE A 38 22.315 -9.380 -0.211 1.00 0.00 C ATOM 0 H PHE A 38 20.610 -15.147 -3.173 1.00 0.00 H new ATOM 0 HA PHE A 38 22.667 -13.103 -3.551 1.00 0.00 H new ATOM 0 HB2 PHE A 38 20.280 -12.494 -3.208 1.00 0.00 H new ATOM 0 HB3 PHE A 38 20.279 -13.381 -1.696 1.00 0.00 H new ATOM 0 HD1 PHE A 38 23.243 -11.398 -2.776 1.00 0.00 H new ATOM 0 HD2 PHE A 38 19.630 -11.471 -0.418 1.00 0.00 H new ATOM 0 HE1 PHE A 38 24.068 -9.450 -1.472 1.00 0.00 H new ATOM 0 HE2 PHE A 38 20.442 -9.505 0.878 1.00 0.00 H new ATOM 0 HZ PHE A 38 22.677 -8.542 0.366 1.00 0.00 H new ATOM 563 N THR A 39 24.048 -14.587 -1.961 1.00 0.00 N ATOM 564 CA THR A 39 25.006 -14.962 -0.934 1.00 0.00 C ATOM 565 C THR A 39 24.790 -14.139 0.306 1.00 0.00 C ATOM 566 O THR A 39 24.877 -14.695 1.369 1.00 0.00 O ATOM 567 CB THR A 39 26.448 -14.749 -1.431 1.00 0.00 C ATOM 568 OG1 THR A 39 26.516 -13.468 -2.028 1.00 0.00 O ATOM 569 CG2 THR A 39 26.830 -15.775 -2.481 1.00 0.00 C ATOM 0 H THR A 39 24.451 -14.576 -2.898 1.00 0.00 H new ATOM 0 HA THR A 39 24.857 -16.017 -0.705 1.00 0.00 H new ATOM 0 HB THR A 39 27.128 -14.846 -0.585 1.00 0.00 H new ATOM 0 HG1 THR A 39 27.427 -13.306 -2.352 1.00 0.00 H new ATOM 0 HG21 THR A 39 27.854 -15.595 -2.810 1.00 0.00 H new ATOM 0 HG22 THR A 39 26.756 -16.776 -2.056 1.00 0.00 H new ATOM 0 HG23 THR A 39 26.155 -15.692 -3.333 1.00 0.00 H new ATOM 577 N ASN A 40 24.421 -12.856 0.230 1.00 0.00 N ATOM 578 CA ASN A 40 24.123 -12.022 1.405 1.00 0.00 C ATOM 579 C ASN A 40 25.325 -12.018 2.365 1.00 0.00 C ATOM 580 O ASN A 40 25.215 -11.875 3.573 1.00 0.00 O ATOM 581 CB ASN A 40 22.784 -12.454 2.059 1.00 0.00 C ATOM 582 CG ASN A 40 22.360 -11.533 3.198 1.00 0.00 C ATOM 583 OD1 ASN A 40 22.803 -10.410 3.346 1.00 0.00 O ATOM 584 ND2 ASN A 40 21.424 -11.944 4.009 1.00 0.00 N ATOM 0 H ASN A 40 24.319 -12.360 -0.656 1.00 0.00 H new ATOM 0 HA ASN A 40 23.974 -10.986 1.101 1.00 0.00 H new ATOM 0 HB2 ASN A 40 22.002 -12.469 1.300 1.00 0.00 H new ATOM 0 HB3 ASN A 40 22.881 -13.472 2.437 1.00 0.00 H new ATOM 0 HD21 ASN A 40 21.081 -11.328 4.746 1.00 0.00 H new ATOM 0 HD22 ASN A 40 21.036 -12.882 3.906 1.00 0.00 H new ATOM 591 N GLY A 41 26.497 -12.322 1.818 1.00 0.00 N ATOM 592 CA GLY A 41 27.647 -12.599 2.613 1.00 0.00 C ATOM 593 C GLY A 41 28.015 -14.065 2.791 1.00 0.00 C ATOM 594 O GLY A 41 29.211 -14.339 2.780 1.00 0.00 O ATOM 0 H GLY A 41 26.658 -12.379 0.812 1.00 0.00 H new ATOM 0 HA2 GLY A 41 28.500 -12.085 2.169 1.00 0.00 H new ATOM 0 HA3 GLY A 41 27.491 -12.164 3.600 1.00 0.00 H new ATOM 598 N TYR A 42 27.044 -14.968 2.970 1.00 0.00 N ATOM 599 CA TYR A 42 27.215 -16.407 3.101 1.00 0.00 C ATOM 600 C TYR A 42 28.154 -16.937 2.027 1.00 0.00 C ATOM 601 O TYR A 42 28.271 -16.373 0.937 1.00 0.00 O ATOM 602 CB TYR A 42 25.852 -17.103 2.985 1.00 0.00 C ATOM 603 CG TYR A 42 24.884 -16.731 4.091 1.00 0.00 C ATOM 604 CD1 TYR A 42 25.127 -17.226 5.375 1.00 0.00 C ATOM 605 CD2 TYR A 42 23.741 -15.937 3.862 1.00 0.00 C ATOM 606 CE1 TYR A 42 24.249 -16.960 6.431 1.00 0.00 C ATOM 607 CE2 TYR A 42 22.853 -15.646 4.907 1.00 0.00 C ATOM 608 CZ TYR A 42 23.128 -16.163 6.182 1.00 0.00 C ATOM 609 OH TYR A 42 22.296 -15.982 7.204 1.00 0.00 O ATOM 0 H TYR A 42 26.064 -14.691 3.030 1.00 0.00 H new ATOM 0 HA TYR A 42 27.651 -16.617 4.078 1.00 0.00 H new ATOM 0 HB2 TYR A 42 25.406 -16.851 2.023 1.00 0.00 H new ATOM 0 HB3 TYR A 42 26.003 -18.182 2.994 1.00 0.00 H new ATOM 0 HD1 TYR A 42 26.008 -17.824 5.555 1.00 0.00 H new ATOM 0 HD2 TYR A 42 23.548 -15.550 2.872 1.00 0.00 H new ATOM 0 HE1 TYR A 42 24.433 -17.361 7.417 1.00 0.00 H new ATOM 0 HE2 TYR A 42 21.977 -15.038 4.735 1.00 0.00 H new ATOM 0 HH TYR A 42 21.371 -16.048 6.888 1.00 0.00 H new ATOM 619 N ASP A 43 28.820 -18.038 2.345 1.00 0.00 N ATOM 620 CA ASP A 43 29.733 -18.666 1.389 1.00 0.00 C ATOM 621 C ASP A 43 28.965 -19.539 0.403 1.00 0.00 C ATOM 622 O ASP A 43 29.298 -19.595 -0.774 1.00 0.00 O ATOM 623 CB ASP A 43 30.726 -19.556 2.141 1.00 0.00 C ATOM 624 CG ASP A 43 32.155 -19.012 2.092 1.00 0.00 C ATOM 625 OD1 ASP A 43 32.812 -19.177 1.044 1.00 0.00 O ATOM 626 OD2 ASP A 43 32.584 -18.434 3.118 1.00 0.00 O ATOM 0 H ASP A 43 28.750 -18.513 3.245 1.00 0.00 H new ATOM 0 HA ASP A 43 30.254 -17.877 0.847 1.00 0.00 H new ATOM 0 HB2 ASP A 43 30.411 -19.648 3.181 1.00 0.00 H new ATOM 0 HB3 ASP A 43 30.707 -20.558 1.712 1.00 0.00 H new ATOM 631 N GLY A 44 27.937 -20.236 0.892 1.00 0.00 N ATOM 632 CA GLY A 44 27.111 -21.151 0.115 1.00 0.00 C ATOM 633 C GLY A 44 25.921 -21.631 0.925 1.00 0.00 C ATOM 634 O GLY A 44 24.774 -21.358 0.582 1.00 0.00 O ATOM 0 H GLY A 44 27.651 -20.175 1.869 1.00 0.00 H new ATOM 0 HA2 GLY A 44 26.762 -20.653 -0.790 1.00 0.00 H new ATOM 0 HA3 GLY A 44 27.708 -22.006 -0.202 1.00 0.00 H new ATOM 638 N ASP A 45 26.198 -22.269 2.058 1.00 0.00 N ATOM 639 CA ASP A 45 25.153 -22.851 2.912 1.00 0.00 C ATOM 640 C ASP A 45 25.266 -22.323 4.319 1.00 0.00 C ATOM 641 O ASP A 45 24.359 -21.670 4.814 1.00 0.00 O ATOM 642 CB ASP A 45 25.286 -24.392 2.992 1.00 0.00 C ATOM 643 CG ASP A 45 24.049 -25.149 2.546 1.00 0.00 C ATOM 644 OD1 ASP A 45 23.709 -24.899 1.390 1.00 0.00 O ATOM 645 OD2 ASP A 45 23.438 -25.954 3.304 1.00 0.00 O ATOM 0 H ASP A 45 27.145 -22.400 2.414 1.00 0.00 H new ATOM 0 HA ASP A 45 24.196 -22.578 2.468 1.00 0.00 H new ATOM 0 HB2 ASP A 45 26.130 -24.705 2.378 1.00 0.00 H new ATOM 0 HB3 ASP A 45 25.519 -24.672 4.019 1.00 0.00 H new ATOM 650 N GLY A 46 26.383 -22.657 4.983 1.00 0.00 N ATOM 651 CA GLY A 46 26.700 -22.234 6.336 1.00 0.00 C ATOM 652 C GLY A 46 26.673 -20.720 6.453 1.00 0.00 C ATOM 653 O GLY A 46 26.358 -20.014 5.507 1.00 0.00 O ATOM 0 H GLY A 46 27.106 -23.247 4.572 1.00 0.00 H new ATOM 0 HA2 GLY A 46 25.985 -22.669 7.034 1.00 0.00 H new ATOM 0 HA3 GLY A 46 27.685 -22.606 6.616 1.00 0.00 H new ATOM 657 N LYS A 47 27.032 -20.207 7.626 1.00 0.00 N ATOM 658 CA LYS A 47 27.132 -18.763 7.821 1.00 0.00 C ATOM 659 C LYS A 47 28.102 -18.091 6.815 1.00 0.00 C ATOM 660 O LYS A 47 28.573 -18.644 5.824 1.00 0.00 O ATOM 661 CB LYS A 47 27.471 -18.464 9.284 1.00 0.00 C ATOM 662 CG LYS A 47 28.939 -18.831 9.583 1.00 0.00 C ATOM 663 CD LYS A 47 29.035 -20.164 10.330 1.00 0.00 C ATOM 664 CE LYS A 47 30.250 -20.966 9.849 1.00 0.00 C ATOM 665 NZ LYS A 47 29.915 -22.408 9.743 1.00 0.00 N ATOM 0 H LYS A 47 27.257 -20.764 8.450 1.00 0.00 H new ATOM 0 HA LYS A 47 26.162 -18.314 7.605 1.00 0.00 H new ATOM 0 HB2 LYS A 47 27.304 -17.408 9.494 1.00 0.00 H new ATOM 0 HB3 LYS A 47 26.808 -19.028 9.940 1.00 0.00 H new ATOM 0 HG2 LYS A 47 29.499 -18.893 8.650 1.00 0.00 H new ATOM 0 HG3 LYS A 47 29.400 -18.043 10.179 1.00 0.00 H new ATOM 0 HD2 LYS A 47 29.114 -19.982 11.402 1.00 0.00 H new ATOM 0 HD3 LYS A 47 28.125 -20.742 10.171 1.00 0.00 H new ATOM 0 HE2 LYS A 47 30.579 -20.591 8.880 1.00 0.00 H new ATOM 0 HE3 LYS A 47 31.080 -20.830 10.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 30.750 -22.935 9.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 29.623 -22.766 10.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 29.138 -22.535 9.064 1.00 0.00 H new ATOM 679 N LEU A 48 28.461 -16.870 7.110 1.00 0.00 N ATOM 680 CA LEU A 48 29.360 -16.132 6.255 1.00 0.00 C ATOM 681 C LEU A 48 30.798 -16.232 6.761 1.00 0.00 C ATOM 682 O LEU A 48 31.035 -16.713 7.877 1.00 0.00 O ATOM 683 CB LEU A 48 28.853 -14.698 6.137 1.00 0.00 C ATOM 684 CG LEU A 48 27.386 -14.464 6.519 1.00 0.00 C ATOM 685 CD1 LEU A 48 27.292 -14.262 8.030 1.00 0.00 C ATOM 686 CD2 LEU A 48 26.850 -13.256 5.800 1.00 0.00 C ATOM 0 H LEU A 48 28.146 -16.362 7.937 1.00 0.00 H new ATOM 0 HA LEU A 48 29.376 -16.562 5.254 1.00 0.00 H new ATOM 0 HB2 LEU A 48 29.476 -14.062 6.765 1.00 0.00 H new ATOM 0 HB3 LEU A 48 28.996 -14.368 5.108 1.00 0.00 H new ATOM 0 HG LEU A 48 26.790 -15.330 6.229 1.00 0.00 H new ATOM 0 HD11 LEU A 48 26.252 -14.095 8.311 1.00 0.00 H new ATOM 0 HD12 LEU A 48 27.667 -15.149 8.540 1.00 0.00 H new ATOM 0 HD13 LEU A 48 27.889 -13.397 8.319 1.00 0.00 H new ATOM 0 HD21 LEU A 48 25.808 -13.099 6.079 1.00 0.00 H new ATOM 0 HD22 LEU A 48 27.435 -12.379 6.076 1.00 0.00 H new ATOM 0 HD23 LEU A 48 26.918 -13.413 4.724 1.00 0.00 H new ATOM 698 N PRO A 49 31.763 -15.790 5.951 1.00 0.00 N ATOM 699 CA PRO A 49 33.150 -15.802 6.342 1.00 0.00 C ATOM 700 C PRO A 49 33.421 -14.737 7.398 1.00 0.00 C ATOM 701 O PRO A 49 32.706 -13.740 7.531 1.00 0.00 O ATOM 702 CB PRO A 49 33.938 -15.581 5.052 1.00 0.00 C ATOM 703 CG PRO A 49 32.951 -14.995 4.038 1.00 0.00 C ATOM 704 CD PRO A 49 31.568 -15.207 4.641 1.00 0.00 C ATOM 0 HA PRO A 49 33.447 -16.741 6.808 1.00 0.00 H new ATOM 0 HB2 PRO A 49 34.773 -14.901 5.219 1.00 0.00 H new ATOM 0 HB3 PRO A 49 34.358 -16.519 4.688 1.00 0.00 H new ATOM 0 HG2 PRO A 49 33.146 -13.936 3.868 1.00 0.00 H new ATOM 0 HG3 PRO A 49 33.038 -15.494 3.073 1.00 0.00 H new ATOM 0 HD2 PRO A 49 31.031 -14.262 4.716 1.00 0.00 H new ATOM 0 HD3 PRO A 49 30.969 -15.865 4.011 1.00 0.00 H new ATOM 712 N LYS A 50 34.497 -14.935 8.161 1.00 0.00 N ATOM 713 CA LYS A 50 34.940 -13.979 9.171 1.00 0.00 C ATOM 714 C LYS A 50 35.348 -12.660 8.508 1.00 0.00 C ATOM 715 O LYS A 50 36.460 -12.522 8.013 1.00 0.00 O ATOM 716 CB LYS A 50 36.028 -14.601 10.047 1.00 0.00 C ATOM 717 CG LYS A 50 36.913 -13.532 10.717 1.00 0.00 C ATOM 718 CD LYS A 50 37.569 -14.029 11.999 1.00 0.00 C ATOM 719 CE LYS A 50 39.092 -13.925 11.886 1.00 0.00 C ATOM 720 NZ LYS A 50 39.731 -14.741 12.941 1.00 0.00 N ATOM 0 H LYS A 50 35.086 -15.765 8.094 1.00 0.00 H new ATOM 0 HA LYS A 50 34.118 -13.735 9.844 1.00 0.00 H new ATOM 0 HB2 LYS A 50 35.565 -15.221 10.815 1.00 0.00 H new ATOM 0 HB3 LYS A 50 36.651 -15.258 9.440 1.00 0.00 H new ATOM 0 HG2 LYS A 50 37.687 -13.216 10.017 1.00 0.00 H new ATOM 0 HG3 LYS A 50 36.308 -12.654 10.941 1.00 0.00 H new ATOM 0 HD2 LYS A 50 37.219 -13.441 12.847 1.00 0.00 H new ATOM 0 HD3 LYS A 50 37.280 -15.063 12.187 1.00 0.00 H new ATOM 0 HE2 LYS A 50 39.417 -14.266 10.903 1.00 0.00 H new ATOM 0 HE3 LYS A 50 39.402 -12.884 11.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 40.765 -14.666 12.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 39.432 -14.396 13.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 39.446 -15.735 12.831 1.00 0.00 H new ATOM 734 N GLY A 51 34.440 -11.696 8.508 1.00 0.00 N ATOM 735 CA GLY A 51 34.660 -10.413 7.849 1.00 0.00 C ATOM 736 C GLY A 51 33.580 -10.106 6.825 1.00 0.00 C ATOM 737 O GLY A 51 33.877 -9.615 5.738 1.00 0.00 O ATOM 0 H GLY A 51 33.531 -11.778 8.963 1.00 0.00 H new ATOM 0 HA2 GLY A 51 34.686 -9.621 8.597 1.00 0.00 H new ATOM 0 HA3 GLY A 51 35.633 -10.420 7.358 1.00 0.00 H new ATOM 741 N ARG A 52 32.324 -10.422 7.146 1.00 0.00 N ATOM 742 CA ARG A 52 31.185 -10.123 6.288 1.00 0.00 C ATOM 743 C ARG A 52 30.057 -9.499 7.066 1.00 0.00 C ATOM 744 O ARG A 52 30.025 -9.612 8.284 1.00 0.00 O ATOM 745 CB ARG A 52 30.713 -11.414 5.632 1.00 0.00 C ATOM 746 CG ARG A 52 30.217 -11.108 4.217 1.00 0.00 C ATOM 747 CD ARG A 52 31.022 -11.857 3.154 1.00 0.00 C ATOM 748 NE ARG A 52 31.887 -10.964 2.384 1.00 0.00 N ATOM 749 CZ ARG A 52 32.432 -11.249 1.223 1.00 0.00 C ATOM 750 NH1 ARG A 52 32.246 -12.405 0.649 1.00 0.00 N ATOM 751 NH2 ARG A 52 33.166 -10.360 0.620 1.00 0.00 N ATOM 0 H ARG A 52 32.071 -10.895 8.014 1.00 0.00 H new ATOM 0 HA ARG A 52 31.497 -9.405 5.529 1.00 0.00 H new ATOM 0 HB2 ARG A 52 31.528 -12.137 5.596 1.00 0.00 H new ATOM 0 HB3 ARG A 52 29.914 -11.864 6.221 1.00 0.00 H new ATOM 0 HG2 ARG A 52 29.165 -11.381 4.134 1.00 0.00 H new ATOM 0 HG3 ARG A 52 30.283 -10.036 4.033 1.00 0.00 H new ATOM 0 HD2 ARG A 52 31.630 -12.624 3.634 1.00 0.00 H new ATOM 0 HD3 ARG A 52 30.338 -12.370 2.478 1.00 0.00 H new ATOM 0 HE ARG A 52 32.083 -10.045 2.781 1.00 0.00 H new ATOM 0 HH11 ARG A 52 31.666 -13.112 1.102 1.00 0.00 H new ATOM 0 HH12 ARG A 52 32.680 -12.602 -0.253 1.00 0.00 H new ATOM 0 HH21 ARG A 52 33.316 -9.447 1.049 1.00 0.00 H new ATOM 0 HH22 ARG A 52 33.591 -10.576 -0.281 1.00 0.00 H new ATOM 765 N THR A 53 29.148 -8.847 6.358 1.00 0.00 N ATOM 766 CA THR A 53 28.017 -8.165 6.981 1.00 0.00 C ATOM 767 C THR A 53 26.763 -8.372 6.133 1.00 0.00 C ATOM 768 O THR A 53 26.680 -7.793 5.048 1.00 0.00 O ATOM 769 CB THR A 53 28.360 -6.706 7.257 1.00 0.00 C ATOM 770 OG1 THR A 53 29.198 -6.671 8.384 1.00 0.00 O ATOM 771 CG2 THR A 53 27.142 -5.857 7.595 1.00 0.00 C ATOM 0 H THR A 53 29.170 -8.774 5.341 1.00 0.00 H new ATOM 0 HA THR A 53 27.799 -8.598 7.957 1.00 0.00 H new ATOM 0 HB THR A 53 28.819 -6.304 6.354 1.00 0.00 H new ATOM 0 HG1 THR A 53 29.437 -5.742 8.585 1.00 0.00 H new ATOM 0 HG21 THR A 53 27.455 -4.829 7.780 1.00 0.00 H new ATOM 0 HG22 THR A 53 26.441 -5.878 6.761 1.00 0.00 H new ATOM 0 HG23 THR A 53 26.657 -6.255 8.486 1.00 0.00 H new ATOM 779 N PRO A 54 25.865 -9.275 6.565 1.00 0.00 N ATOM 780 CA PRO A 54 24.622 -9.531 5.868 1.00 0.00 C ATOM 781 C PRO A 54 23.641 -8.373 6.034 1.00 0.00 C ATOM 782 O PRO A 54 23.850 -7.409 6.770 1.00 0.00 O ATOM 783 CB PRO A 54 24.063 -10.829 6.468 1.00 0.00 C ATOM 784 CG PRO A 54 24.765 -11.012 7.819 1.00 0.00 C ATOM 785 CD PRO A 54 25.942 -10.041 7.803 1.00 0.00 C ATOM 0 HA PRO A 54 24.784 -9.629 4.795 1.00 0.00 H new ATOM 0 HB2 PRO A 54 22.982 -10.765 6.596 1.00 0.00 H new ATOM 0 HB3 PRO A 54 24.256 -11.677 5.811 1.00 0.00 H new ATOM 0 HG2 PRO A 54 24.088 -10.794 8.645 1.00 0.00 H new ATOM 0 HG3 PRO A 54 25.106 -12.039 7.948 1.00 0.00 H new ATOM 0 HD2 PRO A 54 25.903 -9.377 8.667 1.00 0.00 H new ATOM 0 HD3 PRO A 54 26.886 -10.583 7.860 1.00 0.00 H new ATOM 793 N ILE A 55 22.510 -8.479 5.360 1.00 0.00 N ATOM 794 CA ILE A 55 21.486 -7.453 5.377 1.00 0.00 C ATOM 795 C ILE A 55 20.430 -7.872 6.380 1.00 0.00 C ATOM 796 O ILE A 55 19.967 -9.007 6.385 1.00 0.00 O ATOM 797 CB ILE A 55 20.923 -7.231 3.974 1.00 0.00 C ATOM 798 CG1 ILE A 55 22.060 -7.117 2.934 1.00 0.00 C ATOM 799 CG2 ILE A 55 20.112 -5.935 3.991 1.00 0.00 C ATOM 800 CD1 ILE A 55 21.578 -6.609 1.579 1.00 0.00 C ATOM 0 H ILE A 55 22.276 -9.286 4.782 1.00 0.00 H new ATOM 0 HA ILE A 55 21.897 -6.492 5.684 1.00 0.00 H new ATOM 0 HB ILE A 55 20.297 -8.078 3.694 1.00 0.00 H new ATOM 0 HG12 ILE A 55 22.828 -6.445 3.316 1.00 0.00 H new ATOM 0 HG13 ILE A 55 22.526 -8.094 2.805 1.00 0.00 H new ATOM 0 HG21 ILE A 55 19.698 -5.752 3.000 1.00 0.00 H new ATOM 0 HG22 ILE A 55 19.300 -6.023 4.713 1.00 0.00 H new ATOM 0 HG23 ILE A 55 20.759 -5.104 4.273 1.00 0.00 H new ATOM 0 HD11 ILE A 55 22.422 -6.550 0.891 1.00 0.00 H new ATOM 0 HD12 ILE A 55 20.830 -7.294 1.179 1.00 0.00 H new ATOM 0 HD13 ILE A 55 21.137 -5.619 1.697 1.00 0.00 H new ATOM 812 N LYS A 56 20.063 -6.959 7.272 1.00 0.00 N ATOM 813 CA LYS A 56 19.021 -7.221 8.254 1.00 0.00 C ATOM 814 C LYS A 56 17.681 -6.808 7.683 1.00 0.00 C ATOM 815 O LYS A 56 17.543 -5.690 7.203 1.00 0.00 O ATOM 816 CB LYS A 56 19.384 -6.500 9.554 1.00 0.00 C ATOM 817 CG LYS A 56 18.253 -6.629 10.587 1.00 0.00 C ATOM 818 CD LYS A 56 17.258 -5.454 10.483 1.00 0.00 C ATOM 819 CE LYS A 56 17.489 -4.446 11.612 1.00 0.00 C ATOM 820 NZ LYS A 56 18.022 -3.165 11.088 1.00 0.00 N ATOM 0 H LYS A 56 20.474 -6.028 7.334 1.00 0.00 H new ATOM 0 HA LYS A 56 18.943 -8.283 8.486 1.00 0.00 H new ATOM 0 HB2 LYS A 56 20.304 -6.919 9.962 1.00 0.00 H new ATOM 0 HB3 LYS A 56 19.576 -5.447 9.349 1.00 0.00 H new ATOM 0 HG2 LYS A 56 17.724 -7.570 10.434 1.00 0.00 H new ATOM 0 HG3 LYS A 56 18.677 -6.661 11.591 1.00 0.00 H new ATOM 0 HD2 LYS A 56 17.372 -4.959 9.518 1.00 0.00 H new ATOM 0 HD3 LYS A 56 16.236 -5.831 10.529 1.00 0.00 H new ATOM 0 HE2 LYS A 56 16.552 -4.265 12.138 1.00 0.00 H new ATOM 0 HE3 LYS A 56 18.187 -4.863 12.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 18.168 -2.502 11.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 18.928 -3.337 10.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 17.344 -2.757 10.413 1.00 0.00 H new ATOM 834 N PHE A 57 16.672 -7.649 7.858 1.00 0.00 N ATOM 835 CA PHE A 57 15.311 -7.410 7.373 1.00 0.00 C ATOM 836 C PHE A 57 14.341 -7.362 8.540 1.00 0.00 C ATOM 837 O PHE A 57 13.511 -6.465 8.624 1.00 0.00 O ATOM 838 CB PHE A 57 14.939 -8.532 6.405 1.00 0.00 C ATOM 839 CG PHE A 57 16.036 -8.854 5.409 1.00 0.00 C ATOM 840 CD1 PHE A 57 16.119 -8.129 4.202 1.00 0.00 C ATOM 841 CD2 PHE A 57 16.960 -9.887 5.686 1.00 0.00 C ATOM 842 CE1 PHE A 57 17.105 -8.464 3.252 1.00 0.00 C ATOM 843 CE2 PHE A 57 17.942 -10.216 4.736 1.00 0.00 C ATOM 844 CZ PHE A 57 18.016 -9.504 3.524 1.00 0.00 C ATOM 0 H PHE A 57 16.774 -8.536 8.351 1.00 0.00 H new ATOM 0 HA PHE A 57 15.259 -6.451 6.857 1.00 0.00 H new ATOM 0 HB2 PHE A 57 14.701 -9.430 6.975 1.00 0.00 H new ATOM 0 HB3 PHE A 57 14.037 -8.250 5.862 1.00 0.00 H new ATOM 0 HD1 PHE A 57 15.430 -7.321 4.006 1.00 0.00 H new ATOM 0 HD2 PHE A 57 16.912 -10.421 6.623 1.00 0.00 H new ATOM 0 HE1 PHE A 57 17.162 -7.925 2.318 1.00 0.00 H new ATOM 0 HE2 PHE A 57 18.640 -11.015 4.936 1.00 0.00 H new ATOM 0 HZ PHE A 57 18.775 -9.756 2.799 1.00 0.00 H new ATOM 854 N GLY A 58 14.478 -8.320 9.457 1.00 0.00 N ATOM 855 CA GLY A 58 13.584 -8.489 10.595 1.00 0.00 C ATOM 856 C GLY A 58 12.915 -9.856 10.615 1.00 0.00 C ATOM 857 O GLY A 58 12.153 -10.136 11.528 1.00 0.00 O ATOM 0 H GLY A 58 15.228 -9.011 9.426 1.00 0.00 H new ATOM 0 HA2 GLY A 58 14.147 -8.350 11.518 1.00 0.00 H new ATOM 0 HA3 GLY A 58 12.818 -7.714 10.569 1.00 0.00 H new ATOM 861 N LYS A 59 13.168 -10.698 9.609 1.00 0.00 N ATOM 862 CA LYS A 59 12.631 -12.056 9.538 1.00 0.00 C ATOM 863 C LYS A 59 13.723 -13.042 9.856 1.00 0.00 C ATOM 864 O LYS A 59 14.826 -12.892 9.343 1.00 0.00 O ATOM 865 CB LYS A 59 12.002 -12.274 8.156 1.00 0.00 C ATOM 866 CG LYS A 59 10.658 -11.525 8.092 1.00 0.00 C ATOM 867 CD LYS A 59 10.279 -11.201 6.644 1.00 0.00 C ATOM 868 CE LYS A 59 9.204 -10.112 6.580 1.00 0.00 C ATOM 869 NZ LYS A 59 7.854 -10.702 6.440 1.00 0.00 N ATOM 0 H LYS A 59 13.758 -10.452 8.814 1.00 0.00 H new ATOM 0 HA LYS A 59 11.844 -12.208 10.277 1.00 0.00 H new ATOM 0 HB2 LYS A 59 12.672 -11.912 7.376 1.00 0.00 H new ATOM 0 HB3 LYS A 59 11.849 -13.338 7.976 1.00 0.00 H new ATOM 0 HG2 LYS A 59 9.877 -12.133 8.549 1.00 0.00 H new ATOM 0 HG3 LYS A 59 10.724 -10.603 8.670 1.00 0.00 H new ATOM 0 HD2 LYS A 59 11.164 -10.873 6.099 1.00 0.00 H new ATOM 0 HD3 LYS A 59 9.916 -12.103 6.150 1.00 0.00 H new ATOM 0 HE2 LYS A 59 9.246 -9.502 7.483 1.00 0.00 H new ATOM 0 HE3 LYS A 59 9.403 -9.449 5.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 7.145 -9.942 6.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 7.810 -11.264 5.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 7.657 -11.315 7.256 1.00 0.00 H new ATOM 883 N SER A 60 13.377 -14.053 10.645 1.00 0.00 N ATOM 884 CA SER A 60 14.304 -15.133 10.975 1.00 0.00 C ATOM 885 C SER A 60 14.519 -16.070 9.786 1.00 0.00 C ATOM 886 O SER A 60 15.317 -16.986 9.855 1.00 0.00 O ATOM 887 CB SER A 60 13.776 -15.925 12.175 1.00 0.00 C ATOM 888 OG SER A 60 14.775 -16.745 12.736 1.00 0.00 O ATOM 0 H SER A 60 12.455 -14.149 11.071 1.00 0.00 H new ATOM 0 HA SER A 60 15.265 -14.685 11.227 1.00 0.00 H new ATOM 0 HB2 SER A 60 13.404 -15.235 12.932 1.00 0.00 H new ATOM 0 HB3 SER A 60 12.932 -16.540 11.863 1.00 0.00 H new ATOM 0 HG SER A 60 15.371 -17.066 12.027 1.00 0.00 H new ATOM 894 N ASP A 61 13.801 -15.864 8.679 1.00 0.00 N ATOM 895 CA ASP A 61 13.899 -16.666 7.467 1.00 0.00 C ATOM 896 C ASP A 61 14.964 -16.090 6.557 1.00 0.00 C ATOM 897 O ASP A 61 15.845 -16.816 6.115 1.00 0.00 O ATOM 898 CB ASP A 61 12.589 -16.634 6.683 1.00 0.00 C ATOM 899 CG ASP A 61 11.465 -17.389 7.372 1.00 0.00 C ATOM 900 OD1 ASP A 61 10.913 -16.815 8.339 1.00 0.00 O ATOM 901 OD2 ASP A 61 11.184 -18.518 6.912 1.00 0.00 O ATOM 0 H ASP A 61 13.117 -15.111 8.604 1.00 0.00 H new ATOM 0 HA ASP A 61 14.137 -17.686 7.769 1.00 0.00 H new ATOM 0 HB2 ASP A 61 12.286 -15.597 6.536 1.00 0.00 H new ATOM 0 HB3 ASP A 61 12.754 -17.062 5.694 1.00 0.00 H new ATOM 906 N CYS A 62 14.888 -14.777 6.298 1.00 0.00 N ATOM 907 CA CYS A 62 15.902 -14.084 5.521 1.00 0.00 C ATOM 908 C CYS A 62 17.213 -13.939 6.306 1.00 0.00 C ATOM 909 O CYS A 62 18.279 -13.724 5.738 1.00 0.00 O ATOM 910 CB CYS A 62 15.397 -12.699 5.112 1.00 0.00 C ATOM 911 SG CYS A 62 13.711 -12.603 4.477 1.00 0.00 S ATOM 0 H CYS A 62 14.127 -14.179 6.621 1.00 0.00 H new ATOM 0 HA CYS A 62 16.100 -14.682 4.631 1.00 0.00 H new ATOM 0 HB2 CYS A 62 15.472 -12.041 5.978 1.00 0.00 H new ATOM 0 HB3 CYS A 62 16.070 -12.303 4.351 1.00 0.00 H new ATOM 916 N ASP A 63 17.123 -14.006 7.631 1.00 0.00 N ATOM 917 CA ASP A 63 18.297 -14.012 8.491 1.00 0.00 C ATOM 918 C ASP A 63 18.928 -15.387 8.544 1.00 0.00 C ATOM 919 O ASP A 63 20.141 -15.476 8.590 1.00 0.00 O ATOM 920 CB ASP A 63 17.895 -13.646 9.911 1.00 0.00 C ATOM 921 CG ASP A 63 19.090 -13.659 10.875 1.00 0.00 C ATOM 922 OD1 ASP A 63 20.074 -12.935 10.601 1.00 0.00 O ATOM 923 OD2 ASP A 63 18.948 -14.310 11.933 1.00 0.00 O ATOM 0 H ASP A 63 16.238 -14.057 8.135 1.00 0.00 H new ATOM 0 HA ASP A 63 19.006 -13.293 8.081 1.00 0.00 H new ATOM 0 HB2 ASP A 63 17.439 -12.656 9.914 1.00 0.00 H new ATOM 0 HB3 ASP A 63 17.138 -14.346 10.264 1.00 0.00 H new ATOM 928 N ARG A 64 18.134 -16.465 8.516 1.00 0.00 N ATOM 929 CA ARG A 64 18.665 -17.818 8.547 1.00 0.00 C ATOM 930 C ARG A 64 19.734 -18.034 7.461 1.00 0.00 C ATOM 931 O ARG A 64 19.731 -17.398 6.401 1.00 0.00 O ATOM 932 CB ARG A 64 17.507 -18.824 8.424 1.00 0.00 C ATOM 933 CG ARG A 64 17.462 -19.527 7.071 1.00 0.00 C ATOM 934 CD ARG A 64 16.186 -20.288 6.852 1.00 0.00 C ATOM 935 NE ARG A 64 16.113 -21.467 7.747 1.00 0.00 N ATOM 936 CZ ARG A 64 15.127 -22.334 7.780 1.00 0.00 C ATOM 937 NH1 ARG A 64 14.138 -22.243 6.930 1.00 0.00 N ATOM 938 NH2 ARG A 64 15.174 -23.349 8.595 1.00 0.00 N ATOM 0 H ARG A 64 17.116 -16.417 8.472 1.00 0.00 H new ATOM 0 HA ARG A 64 19.166 -17.980 9.502 1.00 0.00 H new ATOM 0 HB2 ARG A 64 17.599 -19.572 9.212 1.00 0.00 H new ATOM 0 HB3 ARG A 64 16.563 -18.303 8.587 1.00 0.00 H new ATOM 0 HG2 ARG A 64 17.579 -18.788 6.279 1.00 0.00 H new ATOM 0 HG3 ARG A 64 18.306 -20.212 6.995 1.00 0.00 H new ATOM 0 HD2 ARG A 64 15.333 -19.635 7.034 1.00 0.00 H new ATOM 0 HD3 ARG A 64 16.124 -20.611 5.813 1.00 0.00 H new ATOM 0 HE ARG A 64 16.891 -21.617 8.389 1.00 0.00 H new ATOM 0 HH11 ARG A 64 14.129 -21.496 6.236 1.00 0.00 H new ATOM 0 HH12 ARG A 64 13.375 -22.919 6.961 1.00 0.00 H new ATOM 0 HH21 ARG A 64 15.978 -23.472 9.210 1.00 0.00 H new ATOM 0 HH22 ARG A 64 14.407 -24.020 8.618 1.00 0.00 H new ATOM 952 N PRO A 65 20.557 -19.070 7.638 1.00 0.00 N ATOM 953 CA PRO A 65 21.522 -19.419 6.624 1.00 0.00 C ATOM 954 C PRO A 65 20.896 -20.047 5.371 1.00 0.00 C ATOM 955 O PRO A 65 19.963 -20.837 5.497 1.00 0.00 O ATOM 956 CB PRO A 65 22.490 -20.366 7.309 1.00 0.00 C ATOM 957 CG PRO A 65 21.764 -20.889 8.555 1.00 0.00 C ATOM 958 CD PRO A 65 20.544 -20.001 8.745 1.00 0.00 C ATOM 0 HA PRO A 65 22.017 -18.526 6.243 1.00 0.00 H new ATOM 0 HB2 PRO A 65 22.767 -21.186 6.647 1.00 0.00 H new ATOM 0 HB3 PRO A 65 23.411 -19.851 7.582 1.00 0.00 H new ATOM 0 HG2 PRO A 65 21.470 -21.930 8.425 1.00 0.00 H new ATOM 0 HG3 PRO A 65 22.414 -20.848 9.429 1.00 0.00 H new ATOM 0 HD2 PRO A 65 19.628 -20.591 8.749 1.00 0.00 H new ATOM 0 HD3 PRO A 65 20.588 -19.475 9.699 1.00 0.00 H new ATOM 966 N PRO A 66 21.413 -19.781 4.165 1.00 0.00 N ATOM 967 CA PRO A 66 20.920 -20.343 2.930 1.00 0.00 C ATOM 968 C PRO A 66 21.291 -21.809 2.812 1.00 0.00 C ATOM 969 O PRO A 66 21.961 -22.406 3.643 1.00 0.00 O ATOM 970 CB PRO A 66 21.535 -19.501 1.816 1.00 0.00 C ATOM 971 CG PRO A 66 22.732 -18.786 2.433 1.00 0.00 C ATOM 972 CD PRO A 66 22.574 -18.965 3.936 1.00 0.00 C ATOM 0 HA PRO A 66 19.832 -20.315 2.878 1.00 0.00 H new ATOM 0 HB2 PRO A 66 21.845 -20.128 0.980 1.00 0.00 H new ATOM 0 HB3 PRO A 66 20.812 -18.784 1.426 1.00 0.00 H new ATOM 0 HG2 PRO A 66 23.671 -19.215 2.082 1.00 0.00 H new ATOM 0 HG3 PRO A 66 22.743 -17.730 2.161 1.00 0.00 H new ATOM 0 HD2 PRO A 66 23.461 -19.436 4.359 1.00 0.00 H new ATOM 0 HD3 PRO A 66 22.463 -17.998 4.426 1.00 0.00 H new ATOM 980 N LYS A 67 20.695 -22.460 1.830 1.00 0.00 N ATOM 981 CA LYS A 67 20.942 -23.870 1.617 1.00 0.00 C ATOM 982 C LYS A 67 21.310 -24.043 0.174 1.00 0.00 C ATOM 983 O LYS A 67 20.597 -24.779 -0.445 1.00 0.00 O ATOM 984 CB LYS A 67 19.781 -24.755 2.083 1.00 0.00 C ATOM 985 CG LYS A 67 20.081 -26.261 1.941 1.00 0.00 C ATOM 986 CD LYS A 67 20.213 -26.921 3.315 1.00 0.00 C ATOM 987 CE LYS A 67 20.370 -28.431 3.153 1.00 0.00 C ATOM 988 NZ LYS A 67 21.780 -28.769 2.838 1.00 0.00 N ATOM 0 H LYS A 67 20.041 -22.036 1.172 1.00 0.00 H new ATOM 0 HA LYS A 67 21.771 -24.211 2.237 1.00 0.00 H new ATOM 0 HB2 LYS A 67 19.556 -24.531 3.126 1.00 0.00 H new ATOM 0 HB3 LYS A 67 18.890 -24.511 1.505 1.00 0.00 H new ATOM 0 HG2 LYS A 67 19.283 -26.743 1.376 1.00 0.00 H new ATOM 0 HG3 LYS A 67 21.002 -26.401 1.375 1.00 0.00 H new ATOM 0 HD2 LYS A 67 21.074 -26.512 3.844 1.00 0.00 H new ATOM 0 HD3 LYS A 67 19.333 -26.701 3.920 1.00 0.00 H new ATOM 0 HE2 LYS A 67 20.063 -28.936 4.069 1.00 0.00 H new ATOM 0 HE3 LYS A 67 19.716 -28.789 2.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 21.847 -29.096 1.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 22.376 -27.926 2.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 22.107 -29.523 3.476 1.00 0.00 H new ATOM 1002 N HIS A 68 22.269 -23.313 -0.384 1.00 0.00 N ATOM 1003 CA HIS A 68 22.713 -23.546 -1.765 1.00 0.00 C ATOM 1004 C HIS A 68 23.592 -24.806 -1.936 1.00 0.00 C ATOM 1005 O HIS A 68 24.528 -25.077 -1.190 1.00 0.00 O ATOM 1006 CB HIS A 68 23.458 -22.278 -2.195 1.00 0.00 C ATOM 1007 CG HIS A 68 23.973 -22.274 -3.592 1.00 0.00 C ATOM 1008 ND1 HIS A 68 25.243 -22.665 -3.964 1.00 0.00 N ATOM 1009 CD2 HIS A 68 23.290 -21.853 -4.686 1.00 0.00 C ATOM 1010 CE1 HIS A 68 25.319 -22.484 -5.297 1.00 0.00 C ATOM 1011 NE2 HIS A 68 24.142 -22.006 -5.761 1.00 0.00 N ATOM 0 H HIS A 68 22.757 -22.555 0.093 1.00 0.00 H new ATOM 0 HA HIS A 68 21.847 -23.743 -2.397 1.00 0.00 H new ATOM 0 HB2 HIS A 68 22.789 -21.426 -2.071 1.00 0.00 H new ATOM 0 HB3 HIS A 68 24.298 -22.125 -1.517 1.00 0.00 H new ATOM 0 HD2 HIS A 68 22.279 -21.473 -4.711 1.00 0.00 H new ATOM 0 HE1 HIS A 68 26.189 -22.690 -5.903 1.00 0.00 H new ATOM 0 HE2 HIS A 68 23.922 -21.795 -6.735 1.00 0.00 H new ATOM 1020 N SER A 69 23.445 -25.488 -3.064 1.00 0.00 N ATOM 1021 CA SER A 69 24.223 -26.700 -3.353 1.00 0.00 C ATOM 1022 C SER A 69 24.880 -26.570 -4.709 1.00 0.00 C ATOM 1023 O SER A 69 26.005 -26.076 -4.799 1.00 0.00 O ATOM 1024 CB SER A 69 23.328 -27.939 -3.243 1.00 0.00 C ATOM 1025 OG SER A 69 23.505 -28.675 -2.048 1.00 0.00 O ATOM 0 H SER A 69 22.792 -25.226 -3.802 1.00 0.00 H new ATOM 0 HA SER A 69 25.018 -26.820 -2.618 1.00 0.00 H new ATOM 0 HB2 SER A 69 22.286 -27.629 -3.315 1.00 0.00 H new ATOM 0 HB3 SER A 69 23.525 -28.593 -4.092 1.00 0.00 H new ATOM 0 HG SER A 69 22.902 -29.447 -2.047 1.00 0.00 H new ATOM 1031 N LYS A 70 24.189 -27.035 -5.754 1.00 0.00 N ATOM 1032 CA LYS A 70 24.663 -26.970 -7.131 1.00 0.00 C ATOM 1033 C LYS A 70 24.736 -25.540 -7.615 1.00 0.00 C ATOM 1034 O LYS A 70 24.518 -24.624 -6.847 1.00 0.00 O ATOM 1035 CB LYS A 70 23.777 -27.863 -8.008 1.00 0.00 C ATOM 1036 CG LYS A 70 24.625 -29.022 -8.561 1.00 0.00 C ATOM 1037 CD LYS A 70 25.107 -28.734 -9.993 1.00 0.00 C ATOM 1038 CE LYS A 70 24.916 -29.964 -10.875 1.00 0.00 C ATOM 1039 NZ LYS A 70 24.929 -29.570 -12.304 1.00 0.00 N ATOM 0 H LYS A 70 23.272 -27.472 -5.661 1.00 0.00 H new ATOM 0 HA LYS A 70 25.682 -27.351 -7.194 1.00 0.00 H new ATOM 0 HB2 LYS A 70 22.942 -28.252 -7.426 1.00 0.00 H new ATOM 0 HB3 LYS A 70 23.352 -27.283 -8.827 1.00 0.00 H new ATOM 0 HG2 LYS A 70 25.485 -29.186 -7.912 1.00 0.00 H new ATOM 0 HG3 LYS A 70 24.038 -29.941 -8.551 1.00 0.00 H new ATOM 0 HD2 LYS A 70 24.553 -27.892 -10.408 1.00 0.00 H new ATOM 0 HD3 LYS A 70 26.159 -28.448 -9.979 1.00 0.00 H new ATOM 0 HE2 LYS A 70 25.708 -30.687 -10.681 1.00 0.00 H new ATOM 0 HE3 LYS A 70 23.972 -30.453 -10.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 24.798 -30.414 -12.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 24.158 -28.896 -12.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 25.840 -29.123 -12.533 1.00 0.00 H new ATOM 1053 N ASP A 71 25.054 -25.334 -8.886 1.00 0.00 N ATOM 1054 CA ASP A 71 25.007 -23.987 -9.474 1.00 0.00 C ATOM 1055 C ASP A 71 23.694 -23.233 -9.226 1.00 0.00 C ATOM 1056 O ASP A 71 23.720 -22.008 -9.124 1.00 0.00 O ATOM 1057 CB ASP A 71 25.273 -24.056 -10.981 1.00 0.00 C ATOM 1058 CG ASP A 71 24.332 -25.040 -11.716 1.00 0.00 C ATOM 1059 OD1 ASP A 71 23.133 -24.745 -11.877 1.00 0.00 O ATOM 1060 OD2 ASP A 71 24.791 -26.173 -12.024 1.00 0.00 O ATOM 0 H ASP A 71 25.345 -26.069 -9.530 1.00 0.00 H new ATOM 0 HA ASP A 71 25.789 -23.422 -8.966 1.00 0.00 H new ATOM 0 HB2 ASP A 71 25.157 -23.061 -11.411 1.00 0.00 H new ATOM 0 HB3 ASP A 71 26.307 -24.357 -11.149 1.00 0.00 H new ATOM 1065 N GLY A 72 22.607 -23.986 -9.043 1.00 0.00 N ATOM 1066 CA GLY A 72 21.281 -23.504 -8.756 1.00 0.00 C ATOM 1067 C GLY A 72 21.039 -23.757 -7.287 1.00 0.00 C ATOM 1068 O GLY A 72 21.790 -23.232 -6.491 1.00 0.00 O ATOM 0 H GLY A 72 22.646 -25.004 -9.097 1.00 0.00 H new ATOM 0 HA2 GLY A 72 21.197 -22.442 -8.985 1.00 0.00 H new ATOM 0 HA3 GLY A 72 20.540 -24.021 -9.366 1.00 0.00 H new ATOM 1072 N ASN A 73 20.046 -24.563 -6.943 1.00 0.00 N ATOM 1073 CA ASN A 73 19.497 -24.731 -5.603 1.00 0.00 C ATOM 1074 C ASN A 73 19.713 -26.216 -5.403 1.00 0.00 C ATOM 1075 O ASN A 73 20.845 -26.682 -5.227 1.00 0.00 O ATOM 1076 CB ASN A 73 17.989 -24.316 -5.523 1.00 0.00 C ATOM 1077 CG ASN A 73 17.153 -24.445 -6.802 1.00 0.00 C ATOM 1078 OD1 ASN A 73 17.407 -25.239 -7.699 1.00 0.00 O ATOM 1079 ND2 ASN A 73 16.051 -23.747 -6.896 1.00 0.00 N ATOM 0 H ASN A 73 19.574 -25.151 -7.629 1.00 0.00 H new ATOM 0 HA ASN A 73 19.958 -24.107 -4.838 1.00 0.00 H new ATOM 0 HB2 ASN A 73 17.515 -24.918 -4.748 1.00 0.00 H new ATOM 0 HB3 ASN A 73 17.942 -23.278 -5.193 1.00 0.00 H new ATOM 0 HD21 ASN A 73 15.434 -23.873 -7.699 1.00 0.00 H new ATOM 0 HD22 ASN A 73 15.808 -23.076 -6.167 1.00 0.00 H new ATOM 1086 N GLY A 74 18.639 -26.978 -5.603 1.00 0.00 N ATOM 1087 CA GLY A 74 18.574 -28.363 -5.218 1.00 0.00 C ATOM 1088 C GLY A 74 17.194 -28.791 -4.738 1.00 0.00 C ATOM 1089 O GLY A 74 16.208 -28.599 -5.441 1.00 0.00 O ATOM 0 H GLY A 74 17.785 -26.635 -6.043 1.00 0.00 H new ATOM 0 HA2 GLY A 74 18.864 -28.983 -6.066 1.00 0.00 H new ATOM 0 HA3 GLY A 74 19.300 -28.547 -4.426 1.00 0.00 H new ATOM 1093 N LYS A 75 17.130 -29.482 -3.592 1.00 0.00 N ATOM 1094 CA LYS A 75 15.870 -29.889 -2.959 1.00 0.00 C ATOM 1095 C LYS A 75 15.010 -28.692 -2.529 1.00 0.00 C ATOM 1096 O LYS A 75 14.302 -28.085 -3.319 1.00 0.00 O ATOM 1097 CB LYS A 75 16.175 -30.861 -1.799 1.00 0.00 C ATOM 1098 CG LYS A 75 16.429 -32.270 -2.344 1.00 0.00 C ATOM 1099 CD LYS A 75 15.909 -33.312 -1.349 1.00 0.00 C ATOM 1100 CE LYS A 75 16.119 -34.722 -1.908 1.00 0.00 C ATOM 1101 NZ LYS A 75 14.830 -35.336 -2.307 1.00 0.00 N ATOM 0 H LYS A 75 17.958 -29.776 -3.075 1.00 0.00 H new ATOM 0 HA LYS A 75 15.261 -30.413 -3.696 1.00 0.00 H new ATOM 0 HB2 LYS A 75 17.047 -30.515 -1.244 1.00 0.00 H new ATOM 0 HB3 LYS A 75 15.339 -30.879 -1.100 1.00 0.00 H new ATOM 0 HG2 LYS A 75 15.932 -32.393 -3.306 1.00 0.00 H new ATOM 0 HG3 LYS A 75 17.495 -32.417 -2.515 1.00 0.00 H new ATOM 0 HD2 LYS A 75 16.429 -33.208 -0.397 1.00 0.00 H new ATOM 0 HD3 LYS A 75 14.850 -33.143 -1.154 1.00 0.00 H new ATOM 0 HE2 LYS A 75 16.787 -34.680 -2.768 1.00 0.00 H new ATOM 0 HE3 LYS A 75 16.605 -35.345 -1.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 15.002 -36.291 -2.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 14.203 -35.397 -1.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 14.379 -34.752 -3.040 1.00 0.00 H new ATOM 1115 N THR A 76 14.982 -28.406 -1.233 1.00 0.00 N ATOM 1116 CA THR A 76 14.204 -27.303 -0.682 1.00 0.00 C ATOM 1117 C THR A 76 15.076 -26.103 -0.379 1.00 0.00 C ATOM 1118 O THR A 76 14.706 -25.299 0.468 1.00 0.00 O ATOM 1119 CB THR A 76 13.383 -27.776 0.522 1.00 0.00 C ATOM 1120 OG1 THR A 76 12.148 -27.127 0.462 1.00 0.00 O ATOM 1121 CG2 THR A 76 13.998 -27.521 1.907 1.00 0.00 C ATOM 0 H THR A 76 15.500 -28.935 -0.532 1.00 0.00 H new ATOM 0 HA THR A 76 13.493 -26.965 -1.436 1.00 0.00 H new ATOM 0 HB THR A 76 13.323 -28.861 0.438 1.00 0.00 H new ATOM 0 HG1 THR A 76 11.594 -27.408 1.220 1.00 0.00 H new ATOM 0 HG21 THR A 76 13.327 -27.898 2.678 1.00 0.00 H new ATOM 0 HG22 THR A 76 14.958 -28.033 1.979 1.00 0.00 H new ATOM 0 HG23 THR A 76 14.147 -26.450 2.048 1.00 0.00 H new ATOM 1129 N ASP A 77 16.241 -26.008 -1.002 1.00 0.00 N ATOM 1130 CA ASP A 77 17.248 -24.977 -0.790 1.00 0.00 C ATOM 1131 C ASP A 77 16.588 -23.684 -0.454 1.00 0.00 C ATOM 1132 O ASP A 77 15.974 -23.074 -1.295 1.00 0.00 O ATOM 1133 CB ASP A 77 18.093 -24.722 -2.033 1.00 0.00 C ATOM 1134 CG ASP A 77 18.734 -26.032 -2.458 1.00 0.00 C ATOM 1135 OD1 ASP A 77 17.964 -26.996 -2.659 1.00 0.00 O ATOM 1136 OD2 ASP A 77 19.964 -26.122 -2.564 1.00 0.00 O ATOM 0 H ASP A 77 16.526 -26.686 -1.709 1.00 0.00 H new ATOM 0 HA ASP A 77 17.885 -25.337 0.018 1.00 0.00 H new ATOM 0 HB2 ASP A 77 17.473 -24.325 -2.837 1.00 0.00 H new ATOM 0 HB3 ASP A 77 18.859 -23.976 -1.823 1.00 0.00 H new ATOM 1141 N HIS A 78 16.616 -23.264 0.796 1.00 0.00 N ATOM 1142 CA HIS A 78 15.920 -22.034 1.187 1.00 0.00 C ATOM 1143 C HIS A 78 16.791 -20.815 0.905 1.00 0.00 C ATOM 1144 O HIS A 78 16.649 -19.784 1.551 1.00 0.00 O ATOM 1145 CB HIS A 78 15.495 -22.134 2.653 1.00 0.00 C ATOM 1146 CG HIS A 78 16.600 -22.453 3.629 1.00 0.00 C ATOM 1147 ND1 HIS A 78 16.412 -22.862 4.928 1.00 0.00 N ATOM 1148 CD2 HIS A 78 17.937 -22.451 3.389 1.00 0.00 C ATOM 1149 CE1 HIS A 78 17.630 -23.059 5.479 1.00 0.00 C ATOM 1150 NE2 HIS A 78 18.570 -22.867 4.541 1.00 0.00 N ATOM 0 H HIS A 78 17.103 -23.741 1.555 1.00 0.00 H new ATOM 0 HA HIS A 78 15.016 -21.911 0.591 1.00 0.00 H new ATOM 0 HB2 HIS A 78 15.037 -21.189 2.946 1.00 0.00 H new ATOM 0 HB3 HIS A 78 14.726 -22.901 2.739 1.00 0.00 H new ATOM 0 HD2 HIS A 78 18.418 -22.173 2.463 1.00 0.00 H new ATOM 0 HE1 HIS A 78 17.817 -23.328 6.508 1.00 0.00 H new ATOM 0 HE2 HIS A 78 19.574 -23.004 4.659 1.00 0.00 H new ATOM 1159 N TYR A 79 17.819 -21.009 0.080 1.00 0.00 N ATOM 1160 CA TYR A 79 18.739 -19.995 -0.366 1.00 0.00 C ATOM 1161 C TYR A 79 18.002 -18.692 -0.694 1.00 0.00 C ATOM 1162 O TYR A 79 16.894 -18.681 -1.236 1.00 0.00 O ATOM 1163 CB TYR A 79 19.532 -20.528 -1.558 1.00 0.00 C ATOM 1164 CG TYR A 79 18.719 -20.404 -2.834 1.00 0.00 C ATOM 1165 CD1 TYR A 79 17.687 -21.311 -3.089 1.00 0.00 C ATOM 1166 CD2 TYR A 79 18.922 -19.346 -3.732 1.00 0.00 C ATOM 1167 CE1 TYR A 79 16.877 -21.207 -4.220 1.00 0.00 C ATOM 1168 CE2 TYR A 79 18.165 -19.259 -4.916 1.00 0.00 C ATOM 1169 CZ TYR A 79 17.112 -20.180 -5.131 1.00 0.00 C ATOM 1170 OH TYR A 79 16.333 -20.170 -6.231 1.00 0.00 O ATOM 0 H TYR A 79 18.033 -21.928 -0.308 1.00 0.00 H new ATOM 0 HA TYR A 79 19.441 -19.758 0.434 1.00 0.00 H new ATOM 0 HB2 TYR A 79 20.465 -19.974 -1.659 1.00 0.00 H new ATOM 0 HB3 TYR A 79 19.798 -21.572 -1.389 1.00 0.00 H new ATOM 0 HD1 TYR A 79 17.511 -22.116 -2.390 1.00 0.00 H new ATOM 0 HD2 TYR A 79 19.664 -18.593 -3.514 1.00 0.00 H new ATOM 0 HE1 TYR A 79 16.078 -21.914 -4.387 1.00 0.00 H new ATOM 0 HE2 TYR A 79 18.385 -18.499 -5.651 1.00 0.00 H new ATOM 0 HH TYR A 79 15.715 -19.410 -6.187 1.00 0.00 H new ATOM 1180 N LEU A 80 18.573 -17.580 -0.254 1.00 0.00 N ATOM 1181 CA LEU A 80 17.960 -16.296 -0.559 1.00 0.00 C ATOM 1182 C LEU A 80 18.277 -15.952 -1.991 1.00 0.00 C ATOM 1183 O LEU A 80 19.410 -16.093 -2.407 1.00 0.00 O ATOM 1184 CB LEU A 80 18.513 -15.252 0.413 1.00 0.00 C ATOM 1185 CG LEU A 80 17.595 -15.154 1.641 1.00 0.00 C ATOM 1186 CD1 LEU A 80 18.440 -15.221 2.898 1.00 0.00 C ATOM 1187 CD2 LEU A 80 16.798 -13.851 1.580 1.00 0.00 C ATOM 0 H LEU A 80 19.430 -17.538 0.297 1.00 0.00 H new ATOM 0 HA LEU A 80 16.877 -16.327 -0.444 1.00 0.00 H new ATOM 0 HB2 LEU A 80 19.522 -15.526 0.722 1.00 0.00 H new ATOM 0 HB3 LEU A 80 18.583 -14.282 -0.080 1.00 0.00 H new ATOM 0 HG LEU A 80 16.889 -15.984 1.652 1.00 0.00 H new ATOM 0 HD11 LEU A 80 17.795 -15.152 3.774 1.00 0.00 H new ATOM 0 HD12 LEU A 80 18.984 -16.165 2.921 1.00 0.00 H new ATOM 0 HD13 LEU A 80 19.150 -14.394 2.904 1.00 0.00 H new ATOM 0 HD21 LEU A 80 16.147 -13.782 2.451 1.00 0.00 H new ATOM 0 HD22 LEU A 80 17.485 -13.005 1.572 1.00 0.00 H new ATOM 0 HD23 LEU A 80 16.193 -13.836 0.673 1.00 0.00 H new ATOM 1199 N LEU A 81 17.313 -15.469 -2.747 1.00 0.00 N ATOM 1200 CA LEU A 81 17.533 -15.016 -4.108 1.00 0.00 C ATOM 1201 C LEU A 81 16.958 -13.626 -4.266 1.00 0.00 C ATOM 1202 O LEU A 81 15.994 -13.246 -3.610 1.00 0.00 O ATOM 1203 CB LEU A 81 16.911 -16.060 -5.036 1.00 0.00 C ATOM 1204 CG LEU A 81 16.591 -15.573 -6.459 1.00 0.00 C ATOM 1205 CD1 LEU A 81 16.936 -16.639 -7.478 1.00 0.00 C ATOM 1206 CD2 LEU A 81 15.141 -15.229 -6.569 1.00 0.00 C ATOM 0 H LEU A 81 16.347 -15.378 -2.433 1.00 0.00 H new ATOM 0 HA LEU A 81 18.589 -14.931 -4.363 1.00 0.00 H new ATOM 0 HB2 LEU A 81 17.590 -16.910 -5.106 1.00 0.00 H new ATOM 0 HB3 LEU A 81 15.991 -16.424 -4.580 1.00 0.00 H new ATOM 0 HG LEU A 81 17.191 -14.686 -6.660 1.00 0.00 H new ATOM 0 HD11 LEU A 81 16.702 -16.275 -8.479 1.00 0.00 H new ATOM 0 HD12 LEU A 81 17.999 -16.872 -7.416 1.00 0.00 H new ATOM 0 HD13 LEU A 81 16.355 -17.539 -7.274 1.00 0.00 H new ATOM 0 HD21 LEU A 81 14.924 -14.885 -7.580 1.00 0.00 H new ATOM 0 HD22 LEU A 81 14.540 -16.111 -6.349 1.00 0.00 H new ATOM 0 HD23 LEU A 81 14.899 -14.439 -5.858 1.00 0.00 H new ATOM 1218 N GLU A 82 17.534 -12.863 -5.174 1.00 0.00 N ATOM 1219 CA GLU A 82 17.111 -11.525 -5.494 1.00 0.00 C ATOM 1220 C GLU A 82 16.746 -11.376 -6.948 1.00 0.00 C ATOM 1221 O GLU A 82 17.249 -12.104 -7.806 1.00 0.00 O ATOM 1222 CB GLU A 82 18.253 -10.567 -5.206 1.00 0.00 C ATOM 1223 CG GLU A 82 19.477 -10.672 -6.082 1.00 0.00 C ATOM 1224 CD GLU A 82 20.504 -11.537 -5.427 1.00 0.00 C ATOM 1225 OE1 GLU A 82 20.262 -12.745 -5.423 1.00 0.00 O ATOM 1226 OE2 GLU A 82 21.600 -10.992 -5.135 1.00 0.00 O ATOM 0 H GLU A 82 18.335 -13.173 -5.724 1.00 0.00 H new ATOM 0 HA GLU A 82 16.231 -11.306 -4.889 1.00 0.00 H new ATOM 0 HB2 GLU A 82 17.869 -9.550 -5.283 1.00 0.00 H new ATOM 0 HB3 GLU A 82 18.564 -10.713 -4.172 1.00 0.00 H new ATOM 0 HG2 GLU A 82 19.205 -11.088 -7.052 1.00 0.00 H new ATOM 0 HG3 GLU A 82 19.889 -9.680 -6.265 1.00 0.00 H new ATOM 1233 N PHE A 83 16.031 -10.303 -7.269 1.00 0.00 N ATOM 1234 CA PHE A 83 15.572 -10.072 -8.633 1.00 0.00 C ATOM 1235 C PHE A 83 15.479 -8.591 -9.005 1.00 0.00 C ATOM 1236 O PHE A 83 14.887 -7.825 -8.247 1.00 0.00 O ATOM 1237 CB PHE A 83 14.189 -10.661 -8.768 1.00 0.00 C ATOM 1238 CG PHE A 83 13.661 -10.569 -10.165 1.00 0.00 C ATOM 1239 CD1 PHE A 83 14.101 -11.477 -11.140 1.00 0.00 C ATOM 1240 CD2 PHE A 83 12.762 -9.545 -10.503 1.00 0.00 C ATOM 1241 CE1 PHE A 83 13.601 -11.450 -12.442 1.00 0.00 C ATOM 1242 CE2 PHE A 83 12.285 -9.509 -11.812 1.00 0.00 C ATOM 1243 CZ PHE A 83 12.660 -10.470 -12.748 1.00 0.00 C ATOM 0 H PHE A 83 15.757 -9.580 -6.603 1.00 0.00 H new ATOM 0 HA PHE A 83 16.302 -10.534 -9.298 1.00 0.00 H new ATOM 0 HB2 PHE A 83 14.211 -11.706 -8.459 1.00 0.00 H new ATOM 0 HB3 PHE A 83 13.509 -10.143 -8.091 1.00 0.00 H new ATOM 0 HD1 PHE A 83 14.845 -12.214 -10.876 1.00 0.00 H new ATOM 0 HD2 PHE A 83 12.451 -8.811 -9.774 1.00 0.00 H new ATOM 0 HE1 PHE A 83 13.931 -12.162 -13.184 1.00 0.00 H new ATOM 0 HE2 PHE A 83 11.610 -8.719 -12.107 1.00 0.00 H new ATOM 0 HZ PHE A 83 12.212 -10.455 -13.731 1.00 0.00 H new ATOM 1253 N PRO A 84 16.064 -8.162 -10.128 1.00 0.00 N ATOM 1254 CA PRO A 84 16.101 -6.775 -10.524 1.00 0.00 C ATOM 1255 C PRO A 84 14.740 -6.308 -10.974 1.00 0.00 C ATOM 1256 O PRO A 84 14.271 -6.681 -12.043 1.00 0.00 O ATOM 1257 CB PRO A 84 17.127 -6.676 -11.628 1.00 0.00 C ATOM 1258 CG PRO A 84 17.330 -8.091 -12.160 1.00 0.00 C ATOM 1259 CD PRO A 84 16.672 -8.996 -11.129 1.00 0.00 C ATOM 0 HA PRO A 84 16.376 -6.128 -9.691 1.00 0.00 H new ATOM 0 HB2 PRO A 84 16.782 -6.010 -12.419 1.00 0.00 H new ATOM 0 HB3 PRO A 84 18.064 -6.265 -11.251 1.00 0.00 H new ATOM 0 HG2 PRO A 84 16.873 -8.213 -13.142 1.00 0.00 H new ATOM 0 HG3 PRO A 84 18.389 -8.323 -12.271 1.00 0.00 H new ATOM 0 HD2 PRO A 84 15.923 -9.631 -11.602 1.00 0.00 H new ATOM 0 HD3 PRO A 84 17.411 -9.658 -10.676 1.00 0.00 H new ATOM 1267 N THR A 85 14.145 -5.457 -10.147 1.00 0.00 N ATOM 1268 CA THR A 85 12.813 -4.922 -10.379 1.00 0.00 C ATOM 1269 C THR A 85 12.912 -3.477 -10.786 1.00 0.00 C ATOM 1270 O THR A 85 13.206 -2.616 -9.967 1.00 0.00 O ATOM 1271 CB THR A 85 11.907 -5.113 -9.162 1.00 0.00 C ATOM 1272 OG1 THR A 85 10.832 -4.216 -9.223 1.00 0.00 O ATOM 1273 CG2 THR A 85 12.637 -4.853 -7.835 1.00 0.00 C ATOM 0 H THR A 85 14.579 -5.117 -9.289 1.00 0.00 H new ATOM 0 HA THR A 85 12.350 -5.478 -11.194 1.00 0.00 H new ATOM 0 HB THR A 85 11.573 -6.150 -9.189 1.00 0.00 H new ATOM 0 HG1 THR A 85 10.750 -3.745 -8.367 1.00 0.00 H new ATOM 0 HG21 THR A 85 11.947 -5.003 -7.005 1.00 0.00 H new ATOM 0 HG22 THR A 85 13.475 -5.543 -7.739 1.00 0.00 H new ATOM 0 HG23 THR A 85 13.008 -3.828 -7.818 1.00 0.00 H new ATOM 1281 N PHE A 86 12.667 -3.188 -12.054 1.00 0.00 N ATOM 1282 CA PHE A 86 12.677 -1.823 -12.556 1.00 0.00 C ATOM 1283 C PHE A 86 11.375 -1.062 -12.248 1.00 0.00 C ATOM 1284 O PHE A 86 10.314 -1.664 -12.041 1.00 0.00 O ATOM 1285 CB PHE A 86 12.904 -1.888 -14.062 1.00 0.00 C ATOM 1286 CG PHE A 86 14.225 -2.499 -14.438 1.00 0.00 C ATOM 1287 CD1 PHE A 86 15.431 -1.836 -14.111 1.00 0.00 C ATOM 1288 CD2 PHE A 86 14.235 -3.736 -15.106 1.00 0.00 C ATOM 1289 CE1 PHE A 86 16.659 -2.403 -14.475 1.00 0.00 C ATOM 1290 CE2 PHE A 86 15.471 -4.288 -15.469 1.00 0.00 C ATOM 1291 CZ PHE A 86 16.655 -3.616 -15.165 1.00 0.00 C ATOM 0 H PHE A 86 12.456 -3.891 -12.763 1.00 0.00 H new ATOM 0 HA PHE A 86 13.473 -1.272 -12.055 1.00 0.00 H new ATOM 0 HB2 PHE A 86 12.101 -2.466 -14.519 1.00 0.00 H new ATOM 0 HB3 PHE A 86 12.847 -0.881 -14.475 1.00 0.00 H new ATOM 0 HD1 PHE A 86 15.405 -0.895 -13.582 1.00 0.00 H new ATOM 0 HD2 PHE A 86 13.312 -4.249 -15.334 1.00 0.00 H new ATOM 0 HE1 PHE A 86 17.589 -1.912 -14.227 1.00 0.00 H new ATOM 0 HE2 PHE A 86 15.507 -5.236 -15.985 1.00 0.00 H new ATOM 0 HZ PHE A 86 17.596 -4.047 -15.473 1.00 0.00 H new ATOM 1301 N PRO A 87 11.437 0.280 -12.294 1.00 0.00 N ATOM 1302 CA PRO A 87 10.278 1.111 -12.057 1.00 0.00 C ATOM 1303 C PRO A 87 9.343 1.149 -13.220 1.00 0.00 C ATOM 1304 O PRO A 87 8.145 1.101 -12.963 1.00 0.00 O ATOM 1305 CB PRO A 87 10.778 2.522 -11.837 1.00 0.00 C ATOM 1306 CG PRO A 87 12.223 2.547 -12.343 1.00 0.00 C ATOM 1307 CD PRO A 87 12.610 1.092 -12.586 1.00 0.00 C ATOM 0 HA PRO A 87 9.737 0.701 -11.204 1.00 0.00 H new ATOM 0 HB2 PRO A 87 10.164 3.242 -12.378 1.00 0.00 H new ATOM 0 HB3 PRO A 87 10.730 2.792 -10.782 1.00 0.00 H new ATOM 0 HG2 PRO A 87 12.305 3.131 -13.260 1.00 0.00 H new ATOM 0 HG3 PRO A 87 12.885 3.009 -11.611 1.00 0.00 H new ATOM 0 HD2 PRO A 87 12.932 0.947 -13.617 1.00 0.00 H new ATOM 0 HD3 PRO A 87 13.446 0.804 -11.948 1.00 0.00 H new ATOM 1315 N ASP A 88 9.879 1.182 -14.452 1.00 0.00 N ATOM 1316 CA ASP A 88 9.109 1.156 -15.709 1.00 0.00 C ATOM 1317 C ASP A 88 8.008 0.104 -15.651 1.00 0.00 C ATOM 1318 O ASP A 88 6.943 0.237 -16.236 1.00 0.00 O ATOM 1319 CB ASP A 88 10.017 0.795 -16.891 1.00 0.00 C ATOM 1320 CG ASP A 88 10.523 1.953 -17.731 1.00 0.00 C ATOM 1321 OD1 ASP A 88 10.357 3.123 -17.333 1.00 0.00 O ATOM 1322 OD2 ASP A 88 11.133 1.551 -18.747 1.00 0.00 O ATOM 0 H ASP A 88 10.886 1.229 -14.606 1.00 0.00 H new ATOM 0 HA ASP A 88 8.680 2.150 -15.840 1.00 0.00 H new ATOM 0 HB2 ASP A 88 10.879 0.250 -16.506 1.00 0.00 H new ATOM 0 HB3 ASP A 88 9.473 0.112 -17.543 1.00 0.00 H new ATOM 1327 N GLY A 89 8.271 -0.960 -14.895 1.00 0.00 N ATOM 1328 CA GLY A 89 7.331 -2.022 -14.665 1.00 0.00 C ATOM 1329 C GLY A 89 7.378 -3.019 -15.802 1.00 0.00 C ATOM 1330 O GLY A 89 6.553 -3.929 -15.850 1.00 0.00 O ATOM 0 H GLY A 89 9.164 -1.098 -14.422 1.00 0.00 H new ATOM 0 HA2 GLY A 89 7.560 -2.522 -13.724 1.00 0.00 H new ATOM 0 HA3 GLY A 89 6.325 -1.613 -14.572 1.00 0.00 H new ATOM 1334 N HIS A 90 8.337 -2.834 -16.715 1.00 0.00 N ATOM 1335 CA HIS A 90 8.523 -3.712 -17.839 1.00 0.00 C ATOM 1336 C HIS A 90 9.116 -5.009 -17.311 1.00 0.00 C ATOM 1337 O HIS A 90 10.007 -5.001 -16.455 1.00 0.00 O ATOM 1338 CB HIS A 90 9.347 -2.999 -18.927 1.00 0.00 C ATOM 1339 CG HIS A 90 10.806 -2.720 -18.617 1.00 0.00 C ATOM 1340 ND1 HIS A 90 11.389 -1.464 -18.584 1.00 0.00 N ATOM 1341 CD2 HIS A 90 11.780 -3.643 -18.341 1.00 0.00 C ATOM 1342 CE1 HIS A 90 12.685 -1.636 -18.243 1.00 0.00 C ATOM 1343 NE2 HIS A 90 12.946 -2.951 -18.070 1.00 0.00 N ATOM 0 H HIS A 90 9.002 -2.061 -16.681 1.00 0.00 H new ATOM 0 HA HIS A 90 7.588 -3.971 -18.335 1.00 0.00 H new ATOM 0 HB2 HIS A 90 9.303 -3.602 -19.834 1.00 0.00 H new ATOM 0 HB3 HIS A 90 8.861 -2.049 -19.151 1.00 0.00 H new ATOM 0 HD2 HIS A 90 11.659 -4.716 -18.336 1.00 0.00 H new ATOM 0 HE1 HIS A 90 13.406 -0.840 -18.126 1.00 0.00 H new ATOM 0 HE2 HIS A 90 13.839 -3.358 -17.791 1.00 0.00 H new ATOM 1352 N ASP A 91 8.593 -6.124 -17.795 1.00 0.00 N ATOM 1353 CA ASP A 91 9.096 -7.455 -17.483 1.00 0.00 C ATOM 1354 C ASP A 91 10.468 -7.604 -18.120 1.00 0.00 C ATOM 1355 O ASP A 91 10.563 -7.942 -19.295 1.00 0.00 O ATOM 1356 CB ASP A 91 8.142 -8.508 -18.058 1.00 0.00 C ATOM 1357 CG ASP A 91 8.521 -9.895 -17.567 1.00 0.00 C ATOM 1358 OD1 ASP A 91 8.492 -10.006 -16.323 1.00 0.00 O ATOM 1359 OD2 ASP A 91 8.752 -10.813 -18.372 1.00 0.00 O ATOM 0 H ASP A 91 7.793 -6.131 -18.427 1.00 0.00 H new ATOM 0 HA ASP A 91 9.166 -7.593 -16.404 1.00 0.00 H new ATOM 0 HB2 ASP A 91 7.118 -8.279 -17.763 1.00 0.00 H new ATOM 0 HB3 ASP A 91 8.174 -8.480 -19.147 1.00 0.00 H new ATOM 1364 N TYR A 92 11.513 -7.152 -17.424 1.00 0.00 N ATOM 1365 CA TYR A 92 12.886 -7.210 -17.893 1.00 0.00 C ATOM 1366 C TYR A 92 13.138 -8.503 -18.661 1.00 0.00 C ATOM 1367 O TYR A 92 12.617 -9.551 -18.337 1.00 0.00 O ATOM 1368 CB TYR A 92 13.771 -7.089 -16.658 1.00 0.00 C ATOM 1369 CG TYR A 92 15.228 -7.434 -16.890 1.00 0.00 C ATOM 1370 CD1 TYR A 92 15.894 -6.956 -18.037 1.00 0.00 C ATOM 1371 CD2 TYR A 92 15.916 -8.218 -15.946 1.00 0.00 C ATOM 1372 CE1 TYR A 92 17.223 -7.338 -18.269 1.00 0.00 C ATOM 1373 CE2 TYR A 92 17.254 -8.590 -16.177 1.00 0.00 C ATOM 1374 CZ TYR A 92 17.903 -8.156 -17.348 1.00 0.00 C ATOM 1375 OH TYR A 92 19.201 -8.471 -17.556 1.00 0.00 O ATOM 0 H TYR A 92 11.419 -6.728 -16.501 1.00 0.00 H new ATOM 0 HA TYR A 92 13.107 -6.402 -18.591 1.00 0.00 H new ATOM 0 HB2 TYR A 92 13.709 -6.068 -16.281 1.00 0.00 H new ATOM 0 HB3 TYR A 92 13.376 -7.741 -15.879 1.00 0.00 H new ATOM 0 HD1 TYR A 92 15.386 -6.302 -18.730 1.00 0.00 H new ATOM 0 HD2 TYR A 92 15.417 -8.535 -15.042 1.00 0.00 H new ATOM 0 HE1 TYR A 92 17.729 -7.002 -19.162 1.00 0.00 H new ATOM 0 HE2 TYR A 92 17.779 -9.204 -15.460 1.00 0.00 H new ATOM 0 HH TYR A 92 19.636 -7.751 -18.059 1.00 0.00 H new ATOM 1385 N LYS A 93 13.947 -8.469 -19.695 1.00 0.00 N ATOM 1386 CA LYS A 93 14.312 -9.688 -20.391 1.00 0.00 C ATOM 1387 C LYS A 93 15.329 -10.497 -19.581 1.00 0.00 C ATOM 1388 O LYS A 93 16.421 -10.792 -20.045 1.00 0.00 O ATOM 1389 CB LYS A 93 14.777 -9.299 -21.779 1.00 0.00 C ATOM 1390 CG LYS A 93 15.775 -8.129 -21.735 1.00 0.00 C ATOM 1391 CD LYS A 93 16.563 -8.092 -23.027 1.00 0.00 C ATOM 1392 CE LYS A 93 15.715 -7.858 -24.258 1.00 0.00 C ATOM 1393 NZ LYS A 93 15.620 -9.102 -25.052 1.00 0.00 N ATOM 0 H LYS A 93 14.364 -7.618 -20.073 1.00 0.00 H new ATOM 0 HA LYS A 93 13.461 -10.361 -20.500 1.00 0.00 H new ATOM 0 HB2 LYS A 93 15.244 -10.158 -22.261 1.00 0.00 H new ATOM 0 HB3 LYS A 93 13.916 -9.021 -22.387 1.00 0.00 H new ATOM 0 HG2 LYS A 93 15.243 -7.188 -21.593 1.00 0.00 H new ATOM 0 HG3 LYS A 93 16.450 -8.244 -20.887 1.00 0.00 H new ATOM 0 HD2 LYS A 93 17.314 -7.305 -22.960 1.00 0.00 H new ATOM 0 HD3 LYS A 93 17.099 -9.034 -23.141 1.00 0.00 H new ATOM 0 HE2 LYS A 93 14.719 -7.527 -23.965 1.00 0.00 H new ATOM 0 HE3 LYS A 93 16.150 -7.063 -24.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 15.360 -8.869 -26.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 16.538 -9.590 -25.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 14.895 -9.723 -24.640 1.00 0.00 H new ATOM 1407 N PHE A 94 14.983 -10.823 -18.346 1.00 0.00 N ATOM 1408 CA PHE A 94 15.779 -11.651 -17.476 1.00 0.00 C ATOM 1409 C PHE A 94 15.764 -13.098 -17.937 1.00 0.00 C ATOM 1410 O PHE A 94 16.703 -13.821 -17.660 1.00 0.00 O ATOM 1411 CB PHE A 94 15.231 -11.570 -16.060 1.00 0.00 C ATOM 1412 CG PHE A 94 13.755 -11.848 -15.923 1.00 0.00 C ATOM 1413 CD1 PHE A 94 13.270 -13.160 -15.802 1.00 0.00 C ATOM 1414 CD2 PHE A 94 12.859 -10.774 -15.954 1.00 0.00 C ATOM 1415 CE1 PHE A 94 11.881 -13.375 -15.718 1.00 0.00 C ATOM 1416 CE2 PHE A 94 11.477 -10.985 -15.923 1.00 0.00 C ATOM 1417 CZ PHE A 94 10.986 -12.289 -15.786 1.00 0.00 C ATOM 0 H PHE A 94 14.114 -10.506 -17.916 1.00 0.00 H new ATOM 0 HA PHE A 94 16.807 -11.289 -17.503 1.00 0.00 H new ATOM 0 HB2 PHE A 94 15.777 -12.278 -15.436 1.00 0.00 H new ATOM 0 HB3 PHE A 94 15.435 -10.574 -15.666 1.00 0.00 H new ATOM 0 HD1 PHE A 94 13.955 -13.995 -15.774 1.00 0.00 H new ATOM 0 HD2 PHE A 94 13.241 -9.765 -16.003 1.00 0.00 H new ATOM 0 HE1 PHE A 94 11.499 -14.378 -15.601 1.00 0.00 H new ATOM 0 HE2 PHE A 94 10.796 -10.151 -16.004 1.00 0.00 H new ATOM 0 HZ PHE A 94 9.921 -12.462 -15.732 1.00 0.00 H new ATOM 1427 N ASP A 95 14.740 -13.523 -18.671 1.00 0.00 N ATOM 1428 CA ASP A 95 14.627 -14.878 -19.209 1.00 0.00 C ATOM 1429 C ASP A 95 15.349 -14.980 -20.550 1.00 0.00 C ATOM 1430 O ASP A 95 15.871 -16.027 -20.902 1.00 0.00 O ATOM 1431 CB ASP A 95 13.141 -15.213 -19.379 1.00 0.00 C ATOM 1432 CG ASP A 95 12.908 -16.423 -20.295 1.00 0.00 C ATOM 1433 OD1 ASP A 95 12.948 -16.205 -21.530 1.00 0.00 O ATOM 1434 OD2 ASP A 95 12.734 -17.533 -19.748 1.00 0.00 O ATOM 0 H ASP A 95 13.950 -12.925 -18.914 1.00 0.00 H new ATOM 0 HA ASP A 95 15.090 -15.587 -18.522 1.00 0.00 H new ATOM 0 HB2 ASP A 95 12.704 -15.413 -18.401 1.00 0.00 H new ATOM 0 HB3 ASP A 95 12.622 -14.347 -19.789 1.00 0.00 H new ATOM 1439 N SER A 96 15.452 -13.875 -21.286 1.00 0.00 N ATOM 1440 CA SER A 96 16.093 -13.848 -22.587 1.00 0.00 C ATOM 1441 C SER A 96 17.570 -13.566 -22.390 1.00 0.00 C ATOM 1442 O SER A 96 17.973 -12.475 -22.000 1.00 0.00 O ATOM 1443 CB SER A 96 15.446 -12.781 -23.473 1.00 0.00 C ATOM 1444 OG SER A 96 14.721 -13.336 -24.545 1.00 0.00 O ATOM 0 H SER A 96 15.088 -12.970 -20.989 1.00 0.00 H new ATOM 0 HA SER A 96 15.971 -14.810 -23.085 1.00 0.00 H new ATOM 0 HB2 SER A 96 14.780 -12.166 -22.868 1.00 0.00 H new ATOM 0 HB3 SER A 96 16.220 -12.121 -23.865 1.00 0.00 H new ATOM 0 HG SER A 96 14.326 -12.616 -25.080 1.00 0.00 H new ATOM 1450 N LYS A 97 18.409 -14.561 -22.671 1.00 0.00 N ATOM 1451 CA LYS A 97 19.860 -14.397 -22.574 1.00 0.00 C ATOM 1452 C LYS A 97 20.339 -13.274 -23.465 1.00 0.00 C ATOM 1453 O LYS A 97 21.176 -12.456 -23.072 1.00 0.00 O ATOM 1454 CB LYS A 97 20.550 -15.747 -22.830 1.00 0.00 C ATOM 1455 CG LYS A 97 20.849 -16.027 -24.297 1.00 0.00 C ATOM 1456 CD LYS A 97 21.608 -17.322 -24.508 1.00 0.00 C ATOM 1457 CE LYS A 97 22.684 -17.113 -25.584 1.00 0.00 C ATOM 1458 NZ LYS A 97 23.742 -18.139 -25.440 1.00 0.00 N ATOM 0 H LYS A 97 18.110 -15.490 -22.968 1.00 0.00 H new ATOM 0 HA LYS A 97 20.137 -14.094 -21.564 1.00 0.00 H new ATOM 0 HB2 LYS A 97 21.484 -15.777 -22.268 1.00 0.00 H new ATOM 0 HB3 LYS A 97 19.918 -16.545 -22.441 1.00 0.00 H new ATOM 0 HG2 LYS A 97 19.912 -16.066 -24.852 1.00 0.00 H new ATOM 0 HG3 LYS A 97 21.429 -15.201 -24.708 1.00 0.00 H new ATOM 0 HD2 LYS A 97 22.069 -17.642 -23.574 1.00 0.00 H new ATOM 0 HD3 LYS A 97 20.922 -18.113 -24.812 1.00 0.00 H new ATOM 0 HE2 LYS A 97 22.237 -17.175 -26.576 1.00 0.00 H new ATOM 0 HE3 LYS A 97 23.116 -16.116 -25.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 24.468 -17.994 -26.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 24.177 -18.059 -24.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 23.325 -19.085 -25.550 1.00 0.00 H new ATOM 1472 N LYS A 98 19.889 -13.337 -24.721 1.00 0.00 N ATOM 1473 CA LYS A 98 20.281 -12.429 -25.762 1.00 0.00 C ATOM 1474 C LYS A 98 19.052 -12.033 -26.605 1.00 0.00 C ATOM 1475 O LYS A 98 18.379 -12.925 -27.117 1.00 0.00 O ATOM 1476 CB LYS A 98 21.466 -12.935 -26.592 1.00 0.00 C ATOM 1477 CG LYS A 98 22.739 -12.142 -26.218 1.00 0.00 C ATOM 1478 CD LYS A 98 23.837 -12.360 -27.267 1.00 0.00 C ATOM 1479 CE LYS A 98 24.748 -13.526 -26.868 1.00 0.00 C ATOM 1480 NZ LYS A 98 25.924 -13.036 -26.106 1.00 0.00 N ATOM 0 H LYS A 98 19.225 -14.045 -25.034 1.00 0.00 H new ATOM 0 HA LYS A 98 20.663 -11.521 -25.295 1.00 0.00 H new ATOM 0 HB2 LYS A 98 21.622 -13.998 -26.411 1.00 0.00 H new ATOM 0 HB3 LYS A 98 21.253 -12.820 -27.655 1.00 0.00 H new ATOM 0 HG2 LYS A 98 22.504 -11.080 -26.144 1.00 0.00 H new ATOM 0 HG3 LYS A 98 23.096 -12.458 -25.238 1.00 0.00 H new ATOM 0 HD2 LYS A 98 23.384 -12.562 -28.237 1.00 0.00 H new ATOM 0 HD3 LYS A 98 24.429 -11.451 -27.375 1.00 0.00 H new ATOM 0 HE2 LYS A 98 24.189 -14.241 -26.264 1.00 0.00 H new ATOM 0 HE3 LYS A 98 25.082 -14.055 -27.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 26.529 -13.841 -25.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 26.467 -12.372 -26.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 25.602 -12.551 -25.244 1.00 0.00 H new ATOM 1494 N PRO A 99 18.808 -10.717 -26.753 1.00 0.00 N ATOM 1495 CA PRO A 99 19.594 -9.682 -26.091 1.00 0.00 C ATOM 1496 C PRO A 99 19.340 -9.682 -24.591 1.00 0.00 C ATOM 1497 O PRO A 99 18.525 -10.462 -24.118 1.00 0.00 O ATOM 1498 CB PRO A 99 19.269 -8.373 -26.763 1.00 0.00 C ATOM 1499 CG PRO A 99 17.933 -8.621 -27.465 1.00 0.00 C ATOM 1500 CD PRO A 99 17.690 -10.142 -27.473 1.00 0.00 C ATOM 0 HA PRO A 99 20.664 -9.867 -26.191 1.00 0.00 H new ATOM 0 HB2 PRO A 99 19.191 -7.563 -26.037 1.00 0.00 H new ATOM 0 HB3 PRO A 99 20.044 -8.090 -27.475 1.00 0.00 H new ATOM 0 HG2 PRO A 99 17.125 -8.106 -26.945 1.00 0.00 H new ATOM 0 HG3 PRO A 99 17.956 -8.231 -28.483 1.00 0.00 H new ATOM 0 HD2 PRO A 99 16.744 -10.391 -26.992 1.00 0.00 H new ATOM 0 HD3 PRO A 99 17.640 -10.526 -28.492 1.00 0.00 H new ATOM 1508 N LYS A 100 20.045 -8.833 -23.861 1.00 0.00 N ATOM 1509 CA LYS A 100 19.900 -8.652 -22.422 1.00 0.00 C ATOM 1510 C LYS A 100 20.004 -7.174 -22.084 1.00 0.00 C ATOM 1511 O LYS A 100 21.008 -6.557 -22.422 1.00 0.00 O ATOM 1512 CB LYS A 100 20.917 -9.524 -21.702 1.00 0.00 C ATOM 1513 CG LYS A 100 21.316 -8.902 -20.355 1.00 0.00 C ATOM 1514 CD LYS A 100 21.683 -9.960 -19.336 1.00 0.00 C ATOM 1515 CE LYS A 100 23.161 -10.209 -19.132 1.00 0.00 C ATOM 1516 NZ LYS A 100 23.879 -10.023 -20.406 1.00 0.00 N ATOM 0 H LYS A 100 20.760 -8.229 -24.267 1.00 0.00 H new ATOM 0 HA LYS A 100 18.917 -8.975 -22.080 1.00 0.00 H new ATOM 0 HB2 LYS A 100 20.500 -10.518 -21.539 1.00 0.00 H new ATOM 0 HB3 LYS A 100 21.802 -9.649 -22.326 1.00 0.00 H new ATOM 0 HG2 LYS A 100 22.161 -8.229 -20.501 1.00 0.00 H new ATOM 0 HG3 LYS A 100 20.491 -8.300 -19.974 1.00 0.00 H new ATOM 0 HD2 LYS A 100 21.248 -9.677 -18.377 1.00 0.00 H new ATOM 0 HD3 LYS A 100 21.216 -10.899 -19.634 1.00 0.00 H new ATOM 0 HE2 LYS A 100 23.554 -9.525 -18.379 1.00 0.00 H new ATOM 0 HE3 LYS A 100 23.321 -11.220 -18.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 24.826 -10.448 -20.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 23.349 -10.482 -21.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 23.970 -9.007 -20.608 1.00 0.00 H new ATOM 1530 N GLU A 101 18.970 -6.658 -21.435 1.00 0.00 N ATOM 1531 CA GLU A 101 18.933 -5.269 -21.018 1.00 0.00 C ATOM 1532 C GLU A 101 19.727 -5.080 -19.733 1.00 0.00 C ATOM 1533 O GLU A 101 20.295 -6.031 -19.188 1.00 0.00 O ATOM 1534 CB GLU A 101 17.474 -4.795 -20.869 1.00 0.00 C ATOM 1535 CG GLU A 101 17.335 -3.396 -21.479 1.00 0.00 C ATOM 1536 CD GLU A 101 17.087 -3.493 -22.992 1.00 0.00 C ATOM 1537 OE1 GLU A 101 17.618 -4.442 -23.623 1.00 0.00 O ATOM 1538 OE2 GLU A 101 16.251 -2.702 -23.466 1.00 0.00 O ATOM 0 H GLU A 101 18.137 -7.191 -21.185 1.00 0.00 H new ATOM 0 HA GLU A 101 19.402 -4.652 -21.785 1.00 0.00 H new ATOM 0 HB2 GLU A 101 16.800 -5.491 -21.368 1.00 0.00 H new ATOM 0 HB3 GLU A 101 17.191 -4.776 -19.817 1.00 0.00 H new ATOM 0 HG2 GLU A 101 16.511 -2.865 -21.002 1.00 0.00 H new ATOM 0 HG3 GLU A 101 18.239 -2.818 -21.289 1.00 0.00 H new ATOM 1545 N ASN A 102 19.758 -3.844 -19.239 1.00 0.00 N ATOM 1546 CA ASN A 102 20.412 -3.530 -17.982 1.00 0.00 C ATOM 1547 C ASN A 102 20.034 -4.529 -16.871 1.00 0.00 C ATOM 1548 O ASN A 102 18.946 -5.097 -16.890 1.00 0.00 O ATOM 1549 CB ASN A 102 20.058 -2.096 -17.545 1.00 0.00 C ATOM 1550 CG ASN A 102 21.292 -1.240 -17.364 1.00 0.00 C ATOM 1551 OD1 ASN A 102 21.532 -0.773 -16.163 1.00 0.00 O flip ATOM 1552 ND2 ASN A 102 22.085 -1.050 -18.256 1.00 0.00 N flip ATOM 0 H ASN A 102 19.332 -3.040 -19.700 1.00 0.00 H new ATOM 0 HA ASN A 102 21.487 -3.607 -18.143 1.00 0.00 H new ATOM 0 HB2 ASN A 102 19.406 -1.640 -18.290 1.00 0.00 H new ATOM 0 HB3 ASN A 102 19.499 -2.129 -16.610 1.00 0.00 H new ATOM 0 HD21 ASN A 102 21.898 -1.413 -19.191 1.00 0.00 H new ATOM 0 HD22 ASN A 102 22.941 -0.526 -18.074 1.00 0.00 H new ATOM 1559 N PRO A 103 20.903 -4.729 -15.876 1.00 0.00 N ATOM 1560 CA PRO A 103 20.622 -5.629 -14.786 1.00 0.00 C ATOM 1561 C PRO A 103 19.639 -5.011 -13.828 1.00 0.00 C ATOM 1562 O PRO A 103 18.524 -5.473 -13.770 1.00 0.00 O ATOM 1563 CB PRO A 103 21.961 -5.916 -14.122 1.00 0.00 C ATOM 1564 CG PRO A 103 22.899 -4.796 -14.587 1.00 0.00 C ATOM 1565 CD PRO A 103 22.205 -4.118 -15.757 1.00 0.00 C ATOM 0 HA PRO A 103 20.161 -6.554 -15.132 1.00 0.00 H new ATOM 0 HB2 PRO A 103 21.867 -5.923 -13.036 1.00 0.00 H new ATOM 0 HB3 PRO A 103 22.342 -6.894 -14.415 1.00 0.00 H new ATOM 0 HG2 PRO A 103 23.086 -4.086 -13.781 1.00 0.00 H new ATOM 0 HG3 PRO A 103 23.866 -5.199 -14.889 1.00 0.00 H new ATOM 0 HD2 PRO A 103 22.115 -3.045 -15.585 1.00 0.00 H new ATOM 0 HD3 PRO A 103 22.779 -4.247 -16.675 1.00 0.00 H new ATOM 1573 N GLY A 104 20.035 -3.998 -13.068 1.00 0.00 N ATOM 1574 CA GLY A 104 19.169 -3.352 -12.087 1.00 0.00 C ATOM 1575 C GLY A 104 19.813 -3.348 -10.696 1.00 0.00 C ATOM 1576 O GLY A 104 20.328 -4.383 -10.257 1.00 0.00 O ATOM 0 H GLY A 104 20.972 -3.598 -13.114 1.00 0.00 H new ATOM 0 HA2 GLY A 104 18.963 -2.328 -12.398 1.00 0.00 H new ATOM 0 HA3 GLY A 104 18.211 -3.871 -12.046 1.00 0.00 H new ATOM 1580 N PRO A 105 19.861 -2.176 -10.044 1.00 0.00 N ATOM 1581 CA PRO A 105 20.447 -2.031 -8.726 1.00 0.00 C ATOM 1582 C PRO A 105 19.526 -2.605 -7.671 1.00 0.00 C ATOM 1583 O PRO A 105 19.867 -3.613 -7.061 1.00 0.00 O ATOM 1584 CB PRO A 105 20.689 -0.538 -8.516 1.00 0.00 C ATOM 1585 CG PRO A 105 19.831 0.159 -9.562 1.00 0.00 C ATOM 1586 CD PRO A 105 19.351 -0.907 -10.538 1.00 0.00 C ATOM 0 HA PRO A 105 21.386 -2.579 -8.644 1.00 0.00 H new ATOM 0 HB2 PRO A 105 20.407 -0.232 -7.509 1.00 0.00 H new ATOM 0 HB3 PRO A 105 21.743 -0.289 -8.642 1.00 0.00 H new ATOM 0 HG2 PRO A 105 18.984 0.660 -9.093 1.00 0.00 H new ATOM 0 HG3 PRO A 105 20.406 0.925 -10.082 1.00 0.00 H new ATOM 0 HD2 PRO A 105 18.262 -0.921 -10.593 1.00 0.00 H new ATOM 0 HD3 PRO A 105 19.719 -0.706 -11.544 1.00 0.00 H new ATOM 1594 N ALA A 106 18.390 -1.954 -7.426 1.00 0.00 N ATOM 1595 CA ALA A 106 17.424 -2.422 -6.451 1.00 0.00 C ATOM 1596 C ALA A 106 16.796 -3.722 -6.901 1.00 0.00 C ATOM 1597 O ALA A 106 16.385 -3.852 -8.059 1.00 0.00 O ATOM 1598 CB ALA A 106 16.360 -1.387 -6.284 1.00 0.00 C ATOM 0 H ALA A 106 18.120 -1.092 -7.899 1.00 0.00 H new ATOM 0 HA ALA A 106 17.934 -2.594 -5.503 1.00 0.00 H new ATOM 0 HB1 ALA A 106 15.629 -1.731 -5.552 1.00 0.00 H new ATOM 0 HB2 ALA A 106 16.809 -0.456 -5.938 1.00 0.00 H new ATOM 0 HB3 ALA A 106 15.864 -1.217 -7.240 1.00 0.00 H new ATOM 1604 N ARG A 107 16.738 -4.679 -5.983 1.00 0.00 N ATOM 1605 CA ARG A 107 16.199 -5.999 -6.265 1.00 0.00 C ATOM 1606 C ARG A 107 15.376 -6.492 -5.116 1.00 0.00 C ATOM 1607 O ARG A 107 15.674 -6.107 -3.999 1.00 0.00 O ATOM 1608 CB ARG A 107 17.341 -6.976 -6.552 1.00 0.00 C ATOM 1609 CG ARG A 107 18.223 -6.477 -7.692 1.00 0.00 C ATOM 1610 CD ARG A 107 18.813 -7.597 -8.525 1.00 0.00 C ATOM 1611 NE ARG A 107 20.241 -7.374 -8.693 1.00 0.00 N ATOM 1612 CZ ARG A 107 21.125 -7.358 -7.724 1.00 0.00 C ATOM 1613 NH1 ARG A 107 20.786 -7.480 -6.476 1.00 0.00 N ATOM 1614 NH2 ARG A 107 22.383 -7.295 -7.994 1.00 0.00 N ATOM 0 H ARG A 107 17.064 -4.560 -5.024 1.00 0.00 H new ATOM 0 HA ARG A 107 15.556 -5.931 -7.142 1.00 0.00 H new ATOM 0 HB2 ARG A 107 17.944 -7.108 -5.654 1.00 0.00 H new ATOM 0 HB3 ARG A 107 16.931 -7.953 -6.807 1.00 0.00 H new ATOM 0 HG2 ARG A 107 17.636 -5.823 -8.337 1.00 0.00 H new ATOM 0 HG3 ARG A 107 19.032 -5.875 -7.280 1.00 0.00 H new ATOM 0 HD2 ARG A 107 18.638 -8.557 -8.039 1.00 0.00 H new ATOM 0 HD3 ARG A 107 18.323 -7.638 -9.498 1.00 0.00 H new ATOM 0 HE ARG A 107 20.582 -7.217 -9.641 1.00 0.00 H new ATOM 0 HH11 ARG A 107 19.804 -7.593 -6.223 1.00 0.00 H new ATOM 0 HH12 ARG A 107 21.501 -7.463 -5.749 1.00 0.00 H new ATOM 0 HH21 ARG A 107 22.695 -7.257 -8.964 1.00 0.00 H new ATOM 0 HH22 ARG A 107 23.067 -7.283 -7.237 1.00 0.00 H new ATOM 1628 N VAL A 108 14.397 -7.341 -5.371 1.00 0.00 N ATOM 1629 CA VAL A 108 13.553 -7.916 -4.316 1.00 0.00 C ATOM 1630 C VAL A 108 14.163 -9.177 -3.736 1.00 0.00 C ATOM 1631 O VAL A 108 14.383 -10.154 -4.438 1.00 0.00 O ATOM 1632 CB VAL A 108 12.164 -8.180 -4.866 1.00 0.00 C ATOM 1633 CG1 VAL A 108 12.231 -8.994 -6.159 1.00 0.00 C ATOM 1634 CG2 VAL A 108 11.269 -8.853 -3.817 1.00 0.00 C ATOM 0 H VAL A 108 14.157 -7.657 -6.311 1.00 0.00 H new ATOM 0 HA VAL A 108 13.481 -7.198 -3.499 1.00 0.00 H new ATOM 0 HB VAL A 108 11.710 -7.219 -5.108 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.222 -9.169 -6.532 1.00 0.00 H new ATOM 0 HG12 VAL A 108 12.803 -8.444 -6.906 1.00 0.00 H new ATOM 0 HG13 VAL A 108 12.716 -9.950 -5.962 1.00 0.00 H new ATOM 0 HG21 VAL A 108 10.280 -9.029 -4.241 1.00 0.00 H new ATOM 0 HG22 VAL A 108 11.710 -9.804 -3.518 1.00 0.00 H new ATOM 0 HG23 VAL A 108 11.179 -8.205 -2.945 1.00 0.00 H new ATOM 1644 N ILE A 109 14.548 -9.137 -2.474 1.00 0.00 N ATOM 1645 CA ILE A 109 15.277 -10.249 -1.865 1.00 0.00 C ATOM 1646 C ILE A 109 14.260 -11.042 -1.113 1.00 0.00 C ATOM 1647 O ILE A 109 13.607 -10.496 -0.226 1.00 0.00 O ATOM 1648 CB ILE A 109 16.425 -9.742 -0.991 1.00 0.00 C ATOM 1649 CG1 ILE A 109 17.662 -9.458 -1.848 1.00 0.00 C ATOM 1650 CG2 ILE A 109 16.815 -10.762 0.080 1.00 0.00 C ATOM 1651 CD1 ILE A 109 17.336 -8.570 -3.049 1.00 0.00 C ATOM 0 H ILE A 109 14.372 -8.352 -1.847 1.00 0.00 H new ATOM 0 HA ILE A 109 15.761 -10.882 -2.609 1.00 0.00 H new ATOM 0 HB ILE A 109 16.075 -8.830 -0.508 1.00 0.00 H new ATOM 0 HG12 ILE A 109 18.424 -8.975 -1.236 1.00 0.00 H new ATOM 0 HG13 ILE A 109 18.085 -10.400 -2.198 1.00 0.00 H new ATOM 0 HG21 ILE A 109 17.634 -10.365 0.680 1.00 0.00 H new ATOM 0 HG22 ILE A 109 15.957 -10.961 0.723 1.00 0.00 H new ATOM 0 HG23 ILE A 109 17.132 -11.689 -0.398 1.00 0.00 H new ATOM 0 HD11 ILE A 109 18.242 -8.395 -3.628 1.00 0.00 H new ATOM 0 HD12 ILE A 109 16.594 -9.064 -3.676 1.00 0.00 H new ATOM 0 HD13 ILE A 109 16.939 -7.617 -2.700 1.00 0.00 H new ATOM 1663 N TYR A 110 14.085 -12.290 -1.510 1.00 0.00 N ATOM 1664 CA TYR A 110 13.125 -13.168 -0.898 1.00 0.00 C ATOM 1665 C TYR A 110 13.750 -14.550 -0.758 1.00 0.00 C ATOM 1666 O TYR A 110 14.602 -15.001 -1.527 1.00 0.00 O ATOM 1667 CB TYR A 110 11.868 -13.133 -1.767 1.00 0.00 C ATOM 1668 CG TYR A 110 12.081 -13.748 -3.147 1.00 0.00 C ATOM 1669 CD1 TYR A 110 12.315 -15.133 -3.298 1.00 0.00 C ATOM 1670 CD2 TYR A 110 12.060 -12.939 -4.297 1.00 0.00 C ATOM 1671 CE1 TYR A 110 12.476 -15.733 -4.553 1.00 0.00 C ATOM 1672 CE2 TYR A 110 12.192 -13.528 -5.567 1.00 0.00 C ATOM 1673 CZ TYR A 110 12.312 -14.925 -5.700 1.00 0.00 C ATOM 1674 OH TYR A 110 12.214 -15.457 -6.940 1.00 0.00 O ATOM 0 H TYR A 110 14.612 -12.718 -2.271 1.00 0.00 H new ATOM 0 HA TYR A 110 12.840 -12.863 0.109 1.00 0.00 H new ATOM 0 HB2 TYR A 110 11.066 -13.666 -1.257 1.00 0.00 H new ATOM 0 HB3 TYR A 110 11.541 -12.100 -1.882 1.00 0.00 H new ATOM 0 HD1 TYR A 110 12.372 -15.751 -2.414 1.00 0.00 H new ATOM 0 HD2 TYR A 110 11.943 -11.869 -4.205 1.00 0.00 H new ATOM 0 HE1 TYR A 110 12.718 -16.782 -4.641 1.00 0.00 H new ATOM 0 HE2 TYR A 110 12.201 -12.904 -6.448 1.00 0.00 H new ATOM 0 HH TYR A 110 12.105 -14.738 -7.597 1.00 0.00 H new ATOM 1684 N THR A 111 13.344 -15.236 0.287 1.00 0.00 N ATOM 1685 CA THR A 111 13.842 -16.590 0.517 1.00 0.00 C ATOM 1686 C THR A 111 13.028 -17.565 -0.307 1.00 0.00 C ATOM 1687 O THR A 111 11.949 -17.215 -0.773 1.00 0.00 O ATOM 1688 CB THR A 111 13.780 -16.899 2.010 1.00 0.00 C ATOM 1689 OG1 THR A 111 12.489 -17.266 2.335 1.00 0.00 O ATOM 1690 CG2 THR A 111 14.101 -15.685 2.886 1.00 0.00 C ATOM 0 H THR A 111 12.683 -14.894 0.984 1.00 0.00 H new ATOM 0 HA THR A 111 14.882 -16.681 0.204 1.00 0.00 H new ATOM 0 HB THR A 111 14.515 -17.683 2.194 1.00 0.00 H new ATOM 0 HG1 THR A 111 12.438 -17.469 3.292 1.00 0.00 H new ATOM 0 HG21 THR A 111 14.040 -15.968 3.937 1.00 0.00 H new ATOM 0 HG22 THR A 111 15.108 -15.331 2.663 1.00 0.00 H new ATOM 0 HG23 THR A 111 13.384 -14.890 2.683 1.00 0.00 H new ATOM 1698 N TYR A 112 13.520 -18.783 -0.467 1.00 0.00 N ATOM 1699 CA TYR A 112 12.814 -19.808 -1.208 1.00 0.00 C ATOM 1700 C TYR A 112 12.238 -20.887 -0.256 1.00 0.00 C ATOM 1701 O TYR A 112 12.805 -21.167 0.808 1.00 0.00 O ATOM 1702 CB TYR A 112 13.744 -20.328 -2.320 1.00 0.00 C ATOM 1703 CG TYR A 112 13.413 -21.702 -2.896 1.00 0.00 C ATOM 1704 CD1 TYR A 112 13.405 -22.843 -2.073 1.00 0.00 C ATOM 1705 CD2 TYR A 112 13.033 -21.849 -4.238 1.00 0.00 C ATOM 1706 CE1 TYR A 112 13.066 -24.108 -2.553 1.00 0.00 C ATOM 1707 CE2 TYR A 112 12.674 -23.118 -4.738 1.00 0.00 C ATOM 1708 CZ TYR A 112 12.712 -24.256 -3.902 1.00 0.00 C ATOM 1709 OH TYR A 112 12.316 -25.465 -4.359 1.00 0.00 O ATOM 0 H TYR A 112 14.417 -19.085 -0.087 1.00 0.00 H new ATOM 0 HA TYR A 112 11.930 -19.407 -1.704 1.00 0.00 H new ATOM 0 HB2 TYR A 112 13.738 -19.605 -3.136 1.00 0.00 H new ATOM 0 HB3 TYR A 112 14.761 -20.358 -1.928 1.00 0.00 H new ATOM 0 HD1 TYR A 112 13.671 -22.736 -1.032 1.00 0.00 H new ATOM 0 HD2 TYR A 112 13.015 -20.988 -4.890 1.00 0.00 H new ATOM 0 HE1 TYR A 112 13.076 -24.963 -1.894 1.00 0.00 H new ATOM 0 HE2 TYR A 112 12.368 -23.220 -5.769 1.00 0.00 H new ATOM 0 HH TYR A 112 12.105 -25.401 -5.314 1.00 0.00 H new ATOM 1719 N PRO A 113 11.164 -21.582 -0.686 1.00 0.00 N ATOM 1720 CA PRO A 113 10.437 -21.288 -1.916 1.00 0.00 C ATOM 1721 C PRO A 113 9.590 -20.066 -1.733 1.00 0.00 C ATOM 1722 O PRO A 113 9.668 -19.153 -2.549 1.00 0.00 O ATOM 1723 CB PRO A 113 9.603 -22.499 -2.270 1.00 0.00 C ATOM 1724 CG PRO A 113 9.551 -23.331 -0.983 1.00 0.00 C ATOM 1725 CD PRO A 113 10.649 -22.780 -0.051 1.00 0.00 C ATOM 0 HA PRO A 113 11.128 -21.080 -2.733 1.00 0.00 H new ATOM 0 HB2 PRO A 113 8.603 -22.209 -2.594 1.00 0.00 H new ATOM 0 HB3 PRO A 113 10.052 -23.063 -3.087 1.00 0.00 H new ATOM 0 HG2 PRO A 113 8.571 -23.255 -0.513 1.00 0.00 H new ATOM 0 HG3 PRO A 113 9.720 -24.386 -1.198 1.00 0.00 H new ATOM 0 HD2 PRO A 113 10.243 -22.553 0.935 1.00 0.00 H new ATOM 0 HD3 PRO A 113 11.441 -23.515 0.092 1.00 0.00 H new ATOM 1733 N ASN A 114 8.760 -20.072 -0.689 1.00 0.00 N ATOM 1734 CA ASN A 114 7.913 -18.948 -0.335 1.00 0.00 C ATOM 1735 C ASN A 114 8.734 -17.683 -0.395 1.00 0.00 C ATOM 1736 O ASN A 114 9.624 -17.558 0.427 1.00 0.00 O ATOM 1737 CB ASN A 114 7.375 -19.105 1.092 1.00 0.00 C ATOM 1738 CG ASN A 114 6.555 -17.889 1.496 1.00 0.00 C ATOM 1739 OD1 ASN A 114 6.034 -17.155 0.670 1.00 0.00 O ATOM 1740 ND2 ASN A 114 6.445 -17.643 2.775 1.00 0.00 N ATOM 0 H ASN A 114 8.661 -20.871 -0.062 1.00 0.00 H new ATOM 0 HA ASN A 114 7.076 -18.906 -1.032 1.00 0.00 H new ATOM 0 HB2 ASN A 114 6.760 -20.002 1.157 1.00 0.00 H new ATOM 0 HB3 ASN A 114 8.205 -19.237 1.786 1.00 0.00 H new ATOM 0 HD21 ASN A 114 5.919 -16.830 3.095 1.00 0.00 H new ATOM 0 HD22 ASN A 114 6.885 -18.264 3.454 1.00 0.00 H new ATOM 1747 N LYS A 115 8.462 -16.799 -1.356 1.00 0.00 N ATOM 1748 CA LYS A 115 9.159 -15.538 -1.551 1.00 0.00 C ATOM 1749 C LYS A 115 8.887 -14.637 -0.374 1.00 0.00 C ATOM 1750 O LYS A 115 8.002 -13.791 -0.452 1.00 0.00 O ATOM 1751 CB LYS A 115 8.711 -14.880 -2.866 1.00 0.00 C ATOM 1752 CG LYS A 115 9.467 -15.469 -4.042 1.00 0.00 C ATOM 1753 CD LYS A 115 8.638 -15.976 -5.185 1.00 0.00 C ATOM 1754 CE LYS A 115 8.093 -17.339 -4.761 1.00 0.00 C ATOM 1755 NZ LYS A 115 6.661 -17.236 -4.445 1.00 0.00 N ATOM 0 H LYS A 115 7.723 -16.952 -2.042 1.00 0.00 H new ATOM 0 HA LYS A 115 10.232 -15.717 -1.618 1.00 0.00 H new ATOM 0 HB2 LYS A 115 7.640 -15.026 -3.005 1.00 0.00 H new ATOM 0 HB3 LYS A 115 8.883 -13.805 -2.818 1.00 0.00 H new ATOM 0 HG2 LYS A 115 10.148 -14.709 -4.425 1.00 0.00 H new ATOM 0 HG3 LYS A 115 10.081 -16.291 -3.675 1.00 0.00 H new ATOM 0 HD2 LYS A 115 7.824 -15.286 -5.409 1.00 0.00 H new ATOM 0 HD3 LYS A 115 9.239 -16.064 -6.090 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.245 -18.065 -5.560 1.00 0.00 H new ATOM 0 HE3 LYS A 115 8.640 -17.703 -3.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 6.454 -17.787 -3.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 6.412 -16.239 -4.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 6.103 -17.609 -5.239 1.00 0.00 H new ATOM 1769 N VAL A 116 9.600 -14.879 0.721 1.00 0.00 N ATOM 1770 CA VAL A 116 9.401 -14.225 2.011 1.00 0.00 C ATOM 1771 C VAL A 116 10.005 -12.854 1.866 1.00 0.00 C ATOM 1772 O VAL A 116 11.137 -12.666 2.277 1.00 0.00 O ATOM 1773 CB VAL A 116 10.081 -14.994 3.167 1.00 0.00 C ATOM 1774 CG1 VAL A 116 9.869 -14.264 4.505 1.00 0.00 C ATOM 1775 CG2 VAL A 116 9.544 -16.427 3.285 1.00 0.00 C ATOM 0 H VAL A 116 10.359 -15.560 0.736 1.00 0.00 H new ATOM 0 HA VAL A 116 8.341 -14.188 2.263 1.00 0.00 H new ATOM 0 HB VAL A 116 11.146 -15.038 2.939 1.00 0.00 H new ATOM 0 HG11 VAL A 116 10.356 -14.822 5.305 1.00 0.00 H new ATOM 0 HG12 VAL A 116 10.299 -13.264 4.446 1.00 0.00 H new ATOM 0 HG13 VAL A 116 8.802 -14.188 4.713 1.00 0.00 H new ATOM 0 HG21 VAL A 116 10.045 -16.937 4.108 1.00 0.00 H new ATOM 0 HG22 VAL A 116 8.471 -16.399 3.475 1.00 0.00 H new ATOM 0 HG23 VAL A 116 9.734 -16.964 2.356 1.00 0.00 H new ATOM 1785 N PHE A 117 9.297 -11.967 1.165 1.00 0.00 N ATOM 1786 CA PHE A 117 9.677 -10.613 0.804 1.00 0.00 C ATOM 1787 C PHE A 117 10.440 -9.991 1.965 1.00 0.00 C ATOM 1788 O PHE A 117 9.861 -9.682 3.013 1.00 0.00 O ATOM 1789 CB PHE A 117 8.397 -9.841 0.501 1.00 0.00 C ATOM 1790 CG PHE A 117 8.649 -8.375 0.297 1.00 0.00 C ATOM 1791 CD1 PHE A 117 9.386 -7.958 -0.827 1.00 0.00 C ATOM 1792 CD2 PHE A 117 8.191 -7.451 1.259 1.00 0.00 C ATOM 1793 CE1 PHE A 117 9.675 -6.604 -0.991 1.00 0.00 C ATOM 1794 CE2 PHE A 117 8.440 -6.089 1.079 1.00 0.00 C ATOM 1795 CZ PHE A 117 9.202 -5.691 -0.031 1.00 0.00 C ATOM 0 H PHE A 117 8.370 -12.202 0.810 1.00 0.00 H new ATOM 0 HA PHE A 117 10.324 -10.594 -0.073 1.00 0.00 H new ATOM 0 HB2 PHE A 117 7.929 -10.254 -0.392 1.00 0.00 H new ATOM 0 HB3 PHE A 117 7.692 -9.975 1.321 1.00 0.00 H new ATOM 0 HD1 PHE A 117 9.724 -8.680 -1.556 1.00 0.00 H new ATOM 0 HD2 PHE A 117 7.651 -7.795 2.129 1.00 0.00 H new ATOM 0 HE1 PHE A 117 10.251 -6.263 -1.839 1.00 0.00 H new ATOM 0 HE2 PHE A 117 8.056 -5.359 1.777 1.00 0.00 H new ATOM 0 HZ PHE A 117 9.434 -4.643 -0.153 1.00 0.00 H new ATOM 1805 N CYS A 118 11.759 -9.945 1.835 1.00 0.00 N ATOM 1806 CA CYS A 118 12.595 -9.454 2.903 1.00 0.00 C ATOM 1807 C CYS A 118 12.662 -7.941 2.764 1.00 0.00 C ATOM 1808 O CYS A 118 12.535 -7.208 3.741 1.00 0.00 O ATOM 1809 CB CYS A 118 13.979 -10.094 2.835 1.00 0.00 C ATOM 1810 SG CYS A 118 14.048 -11.881 2.603 1.00 0.00 S ATOM 0 H CYS A 118 12.264 -10.242 1.000 1.00 0.00 H new ATOM 0 HA CYS A 118 12.182 -9.715 3.877 1.00 0.00 H new ATOM 0 HB2 CYS A 118 14.528 -9.626 2.018 1.00 0.00 H new ATOM 0 HB3 CYS A 118 14.509 -9.852 3.756 1.00 0.00 H new ATOM 1815 N GLY A 119 12.828 -7.469 1.529 1.00 0.00 N ATOM 1816 CA GLY A 119 12.895 -6.061 1.221 1.00 0.00 C ATOM 1817 C GLY A 119 13.628 -5.857 -0.081 1.00 0.00 C ATOM 1818 O GLY A 119 13.507 -6.650 -1.013 1.00 0.00 O ATOM 0 H GLY A 119 12.920 -8.071 0.711 1.00 0.00 H new ATOM 0 HA2 GLY A 119 11.889 -5.646 1.152 1.00 0.00 H new ATOM 0 HA3 GLY A 119 13.405 -5.528 2.023 1.00 0.00 H new ATOM 1822 N ILE A 120 14.347 -4.748 -0.176 1.00 0.00 N ATOM 1823 CA ILE A 120 15.004 -4.394 -1.427 1.00 0.00 C ATOM 1824 C ILE A 120 16.428 -4.088 -1.120 1.00 0.00 C ATOM 1825 O ILE A 120 16.682 -3.453 -0.117 1.00 0.00 O ATOM 1826 CB ILE A 120 14.308 -3.223 -2.116 1.00 0.00 C ATOM 1827 CG1 ILE A 120 12.782 -3.406 -2.166 1.00 0.00 C ATOM 1828 CG2 ILE A 120 14.878 -3.007 -3.530 1.00 0.00 C ATOM 1829 CD1 ILE A 120 12.225 -3.970 -3.441 1.00 0.00 C ATOM 0 H ILE A 120 14.490 -4.085 0.586 1.00 0.00 H new ATOM 0 HA ILE A 120 14.947 -5.227 -2.128 1.00 0.00 H new ATOM 0 HB ILE A 120 14.507 -2.332 -1.520 1.00 0.00 H new ATOM 0 HG12 ILE A 120 12.488 -4.059 -1.345 1.00 0.00 H new ATOM 0 HG13 ILE A 120 12.314 -2.438 -1.986 1.00 0.00 H new ATOM 0 HG21 ILE A 120 14.368 -2.168 -4.004 1.00 0.00 H new ATOM 0 HG22 ILE A 120 15.945 -2.793 -3.464 1.00 0.00 H new ATOM 0 HG23 ILE A 120 14.725 -3.907 -4.125 1.00 0.00 H new ATOM 0 HD11 ILE A 120 11.141 -4.054 -3.359 1.00 0.00 H new ATOM 0 HD12 ILE A 120 12.476 -3.310 -4.271 1.00 0.00 H new ATOM 0 HD13 ILE A 120 12.652 -4.957 -3.620 1.00 0.00 H new ATOM 1841 N ILE A 121 17.361 -4.514 -1.943 1.00 0.00 N ATOM 1842 CA ILE A 121 18.777 -4.296 -1.667 1.00 0.00 C ATOM 1843 C ILE A 121 19.392 -3.646 -2.877 1.00 0.00 C ATOM 1844 O ILE A 121 18.928 -3.884 -3.988 1.00 0.00 O ATOM 1845 CB ILE A 121 19.467 -5.612 -1.278 1.00 0.00 C ATOM 1846 CG1 ILE A 121 19.853 -6.426 -2.541 1.00 0.00 C ATOM 1847 CG2 ILE A 121 18.565 -6.436 -0.337 1.00 0.00 C ATOM 1848 CD1 ILE A 121 20.589 -7.720 -2.206 1.00 0.00 C ATOM 0 H ILE A 121 17.171 -5.014 -2.811 1.00 0.00 H new ATOM 0 HA ILE A 121 18.907 -3.632 -0.812 1.00 0.00 H new ATOM 0 HB ILE A 121 20.387 -5.375 -0.743 1.00 0.00 H new ATOM 0 HG12 ILE A 121 18.951 -6.662 -3.106 1.00 0.00 H new ATOM 0 HG13 ILE A 121 20.482 -5.812 -3.186 1.00 0.00 H new ATOM 0 HG21 ILE A 121 19.069 -7.365 -0.071 1.00 0.00 H new ATOM 0 HG22 ILE A 121 18.362 -5.862 0.567 1.00 0.00 H new ATOM 0 HG23 ILE A 121 17.626 -6.664 -0.841 1.00 0.00 H new ATOM 0 HD11 ILE A 121 20.834 -8.248 -3.127 1.00 0.00 H new ATOM 0 HD12 ILE A 121 21.507 -7.487 -1.666 1.00 0.00 H new ATOM 0 HD13 ILE A 121 19.953 -8.350 -1.585 1.00 0.00 H new ATOM 1860 N ALA A 122 20.458 -2.885 -2.691 1.00 0.00 N ATOM 1861 CA ALA A 122 21.188 -2.283 -3.797 1.00 0.00 C ATOM 1862 C ALA A 122 22.523 -1.736 -3.296 1.00 0.00 C ATOM 1863 O ALA A 122 22.722 -1.487 -2.103 1.00 0.00 O ATOM 1864 CB ALA A 122 20.346 -1.158 -4.375 1.00 0.00 C ATOM 0 H ALA A 122 20.842 -2.667 -1.772 1.00 0.00 H new ATOM 0 HA ALA A 122 21.386 -3.029 -4.567 1.00 0.00 H new ATOM 0 HB1 ALA A 122 20.878 -0.695 -5.206 1.00 0.00 H new ATOM 0 HB2 ALA A 122 19.397 -1.560 -4.731 1.00 0.00 H new ATOM 0 HB3 ALA A 122 20.158 -0.411 -3.604 1.00 0.00 H new ATOM 2011 N LYS A 132 23.252 -3.176 0.774 1.00 0.00 N ATOM 2012 CA LYS A 132 22.462 -2.810 1.951 1.00 0.00 C ATOM 2013 C LYS A 132 20.999 -2.829 1.593 1.00 0.00 C ATOM 2014 O LYS A 132 20.678 -2.949 0.413 1.00 0.00 O ATOM 2015 CB LYS A 132 22.916 -1.451 2.486 1.00 0.00 C ATOM 2016 CG LYS A 132 23.093 -0.380 1.395 1.00 0.00 C ATOM 2017 CD LYS A 132 23.927 0.783 1.930 1.00 0.00 C ATOM 2018 CE LYS A 132 23.023 1.919 2.425 1.00 0.00 C ATOM 2019 NZ LYS A 132 23.713 3.231 2.339 1.00 0.00 N ATOM 0 HA LYS A 132 22.618 -3.534 2.751 1.00 0.00 H new ATOM 0 HB2 LYS A 132 22.187 -1.096 3.215 1.00 0.00 H new ATOM 0 HB3 LYS A 132 23.861 -1.577 3.015 1.00 0.00 H new ATOM 0 HG2 LYS A 132 23.580 -0.816 0.523 1.00 0.00 H new ATOM 0 HG3 LYS A 132 22.118 -0.018 1.068 1.00 0.00 H new ATOM 0 HD2 LYS A 132 24.562 0.436 2.745 1.00 0.00 H new ATOM 0 HD3 LYS A 132 24.588 1.153 1.146 1.00 0.00 H new ATOM 0 HE2 LYS A 132 22.110 1.946 1.830 1.00 0.00 H new ATOM 0 HE3 LYS A 132 22.726 1.728 3.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 23.078 3.980 2.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 24.571 3.211 2.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 23.974 3.422 1.351 1.00 0.00 H new ATOM 2033 N LEU A 133 20.142 -2.723 2.598 1.00 0.00 N ATOM 2034 CA LEU A 133 18.703 -2.697 2.389 1.00 0.00 C ATOM 2035 C LEU A 133 18.302 -1.273 2.006 1.00 0.00 C ATOM 2036 O LEU A 133 18.851 -0.312 2.555 1.00 0.00 O ATOM 2037 CB LEU A 133 18.003 -3.190 3.669 1.00 0.00 C ATOM 2038 CG LEU A 133 16.577 -3.720 3.428 1.00 0.00 C ATOM 2039 CD1 LEU A 133 16.579 -5.061 2.691 1.00 0.00 C ATOM 2040 CD2 LEU A 133 15.870 -3.919 4.759 1.00 0.00 C ATOM 0 H LEU A 133 20.423 -2.653 3.576 1.00 0.00 H new ATOM 0 HA LEU A 133 18.399 -3.361 1.580 1.00 0.00 H new ATOM 0 HB2 LEU A 133 18.604 -3.980 4.120 1.00 0.00 H new ATOM 0 HB3 LEU A 133 17.961 -2.372 4.388 1.00 0.00 H new ATOM 0 HG LEU A 133 16.062 -2.981 2.815 1.00 0.00 H new ATOM 0 HD11 LEU A 133 15.552 -5.396 2.543 1.00 0.00 H new ATOM 0 HD12 LEU A 133 17.066 -4.943 1.723 1.00 0.00 H new ATOM 0 HD13 LEU A 133 17.120 -5.800 3.282 1.00 0.00 H new ATOM 0 HD21 LEU A 133 14.862 -4.294 4.583 1.00 0.00 H new ATOM 0 HD22 LEU A 133 16.425 -4.638 5.362 1.00 0.00 H new ATOM 0 HD23 LEU A 133 15.816 -2.968 5.288 1.00 0.00 H new ATOM 2052 N CYS A 134 17.397 -1.161 1.039 1.00 0.00 N ATOM 2053 CA CYS A 134 16.807 0.091 0.609 1.00 0.00 C ATOM 2054 C CYS A 134 16.043 0.762 1.752 1.00 0.00 C ATOM 2055 O CYS A 134 15.970 0.281 2.883 1.00 0.00 O ATOM 2056 CB CYS A 134 15.874 -0.174 -0.583 1.00 0.00 C ATOM 2057 SG CYS A 134 16.677 -0.845 -2.051 1.00 0.00 S ATOM 0 H CYS A 134 17.047 -1.967 0.521 1.00 0.00 H new ATOM 0 HA CYS A 134 17.603 0.771 0.304 1.00 0.00 H new ATOM 0 HB2 CYS A 134 15.094 -0.866 -0.266 1.00 0.00 H new ATOM 0 HB3 CYS A 134 15.381 0.760 -0.853 1.00 0.00 H new ATOM 2062 N SER A 135 15.408 1.877 1.443 1.00 0.00 N ATOM 2063 CA SER A 135 14.677 2.615 2.463 1.00 0.00 C ATOM 2064 C SER A 135 13.665 3.484 1.755 1.00 0.00 C ATOM 2065 O SER A 135 14.039 4.313 0.933 1.00 0.00 O ATOM 2066 CB SER A 135 15.682 3.388 3.338 1.00 0.00 C ATOM 2067 OG SER A 135 15.623 4.788 3.261 1.00 0.00 O ATOM 0 H SER A 135 15.381 2.289 0.510 1.00 0.00 H new ATOM 0 HA SER A 135 14.127 1.967 3.146 1.00 0.00 H new ATOM 0 HB2 SER A 135 15.528 3.095 4.377 1.00 0.00 H new ATOM 0 HB3 SER A 135 16.689 3.072 3.064 1.00 0.00 H new ATOM 0 HG SER A 135 16.299 5.177 3.854 1.00 0.00 H new ATOM 2073 N HIS A 136 12.398 3.173 1.947 1.00 0.00 N ATOM 2074 CA HIS A 136 11.306 3.988 1.445 1.00 0.00 C ATOM 2075 C HIS A 136 10.933 5.072 2.444 1.00 0.00 C ATOM 2076 O HIS A 136 10.436 4.623 3.505 1.00 0.00 O ATOM 2077 CB HIS A 136 10.120 3.078 1.136 1.00 0.00 C ATOM 2078 CG HIS A 136 9.938 1.912 2.071 1.00 0.00 C ATOM 2079 ND1 HIS A 136 10.054 1.971 3.436 1.00 0.00 N ATOM 2080 CD2 HIS A 136 9.693 0.625 1.709 1.00 0.00 C ATOM 2081 CE1 HIS A 136 9.875 0.717 3.908 1.00 0.00 C ATOM 2082 NE2 HIS A 136 9.633 -0.126 2.874 1.00 0.00 N ATOM 2083 OXT HIS A 136 11.107 6.255 2.115 1.00 0.00 O ATOM 0 H HIS A 136 12.094 2.344 2.458 1.00 0.00 H new ATOM 0 HA HIS A 136 11.615 4.496 0.531 1.00 0.00 H new ATOM 0 HB2 HIS A 136 9.210 3.678 1.150 1.00 0.00 H new ATOM 0 HB3 HIS A 136 10.233 2.694 0.122 1.00 0.00 H new ATOM 0 HD1 HIS A 136 10.241 2.806 3.992 1.00 0.00 H new ATOM 0 HD2 HIS A 136 9.568 0.256 0.702 1.00 0.00 H new ATOM 0 HE1 HIS A 136 9.918 0.431 4.948 1.00 0.00 H new ATOM 0 HE2 HIS A 136 9.442 -1.126 2.940 1.00 0.00 H new