USER MOD reduce.3.24.130724 H: found=0, std=0, add=1361, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1362 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 96 GLN : amide:sc= 0.634 K(o=2.6,f=-2.1!) USER MOD Set 1.2: A 99 GLN : amide:sc= 0.882 K(o=2.6,f=-2.3) USER MOD Set 1.3: A 161 TYR OH : rot 120:sc= 1.07 USER MOD Set 2.1: A 152 LYS NZ :NH3+ -107:sc= 0.016 (180deg=-3.15!) USER MOD Set 2.2: A 154 SER OG : rot -139:sc= 1.62 USER MOD Set 3.1: A 148 THR OG1 : rot 90:sc= 0.385 USER MOD Set 3.2: A 150 THR OG1 : rot 180:sc= 0.361 USER MOD Set 4.1: A 107 ASN : amide:sc= 0.619 K(o=0.11,f=-1.8) USER MOD Set 4.2: A 109 HIS : no HE2:sc= 0.213 K(o=0.11,f=-4.7!) USER MOD Set 4.3: A 147 SER OG : rot -160:sc= -0.718 USER MOD Set 5.1: A 73 TYR OH : rot 73:sc= 0.602 USER MOD Set 5.2: A 168 CYS SG : rot 145:sc= 0.873 USER MOD Set 6.1: A 20 SER OG : rot -140:sc= 0.292 USER MOD Set 6.2: A 31 LYS NZ :NH3+ -172:sc= 0.874 (180deg=-0.0701) USER MOD Single : A 9 LYS NZ :NH3+ -153:sc= 1.4 (180deg=0.651) USER MOD Single : A 15 ASN : amide:sc= -1.29 K(o=-1.3,f=-6!) USER MOD Single : A 21 HIS : no HE2:sc= -6.89! C(o=-6.9!,f=-4.7!) USER MOD Single : A 25 HIS : no HD1:sc= -0.132 X(o=-0.13,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -1.18 K(o=-1.2,f=-2.2!) USER MOD Single : A 29 TYR OH : rot 180:sc= -1.47 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl -137:sc= -0.098 (180deg=-2.08!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot -50:sc= -1.84! USER MOD Single : A 54 ASN : amide:sc= -1.32! C(o=-1.3!,f=-4.1!) USER MOD Single : A 58 GLN : amide:sc= -1.65 K(o=-1.6,f=-0.23) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -1.49 K(o=-1.5,f=-3.5!) USER MOD Single : A 63 THR OG1 : rot 89:sc= 1.07 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.0228 X(o=-0.023,f=-0.027) USER MOD Single : A 70 SER OG : rot 180:sc= -0.31 USER MOD Single : A 78 LYS NZ :NH3+ 172:sc= 1.01 (180deg=0.971) USER MOD Single : A 83 TYR OH : rot 39:sc= -1.9! USER MOD Single : A 88 LYS NZ :NH3+ -126:sc= -3.71! (180deg=-6.13!) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= -0.0505 USER MOD Single : A 98 GLN : amide:sc= 0.945 K(o=0.94,f=-0.15) USER MOD Single : A 100 LYS NZ :NH3+ 145:sc= -1.35! (180deg=-4.78!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.0188 USER MOD Single : A 113 LYS NZ :NH3+ 176:sc= 0.86 (180deg=0.612) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=-0.0092) USER MOD Single : A 124 SER OG : rot 100:sc= 0.899 USER MOD Single : A 125 THR OG1 : rot -65:sc= 0.119 USER MOD Single : A 127 HIS : no HD1:sc= -0.238 K(o=-0.24,f=-4.8!) USER MOD Single : A 134 SER OG : rot 180:sc= -2.43! USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 SER OG : rot 180:sc= -0.531 USER MOD Single : A 143 GLN : amide:sc= 0.121 K(o=0.12,f=-4.1!) USER MOD Single : A 159 LYS NZ :NH3+ -175:sc= 1.16 (180deg=0.92) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 164 ASN : amide:sc= 0.559 K(o=0.56,f=-5.5!) USER MOD Single : A 166 LYS NZ :NH3+ 148:sc= 0.901 (180deg=-0.055!) USER MOD Single : A 173 MET CE :methyl -125:sc= -5.24! (180deg=-7.36!) USER MOD Single : A 174 LYS NZ :NH3+ 138:sc= 0.0263 (180deg=-0.00331) USER MOD Single : A 176 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 5 -11.037 15.453 3.380 1.00 1.48 N ATOM 2 CA GLY A 5 -11.924 14.667 4.209 1.00 1.01 C ATOM 3 C GLY A 5 -11.588 13.199 4.127 1.00 0.78 C ATOM 4 O GLY A 5 -12.380 12.342 4.507 1.00 0.75 O ATOM 0 HA2 GLY A 5 -11.852 15.002 5.244 1.00 1.01 H new ATOM 0 HA3 GLY A 5 -12.956 14.825 3.894 1.00 1.01 H new ATOM 8 N LEU A 6 -10.390 12.920 3.639 1.00 0.72 N ATOM 9 CA LEU A 6 -9.902 11.563 3.488 1.00 0.55 C ATOM 10 C LEU A 6 -9.950 10.818 4.821 1.00 0.42 C ATOM 11 O LEU A 6 -10.181 9.605 4.871 1.00 0.36 O ATOM 12 CB LEU A 6 -8.467 11.616 2.967 1.00 0.53 C ATOM 13 CG LEU A 6 -7.867 10.273 2.586 1.00 0.44 C ATOM 14 CD1 LEU A 6 -8.702 9.628 1.500 1.00 0.52 C ATOM 15 CD2 LEU A 6 -6.422 10.441 2.143 1.00 0.47 C ATOM 0 H LEU A 6 -9.727 13.634 3.336 1.00 0.72 H new ATOM 0 HA LEU A 6 -10.536 11.027 2.782 1.00 0.55 H new ATOM 0 HB2 LEU A 6 -8.438 12.269 2.095 1.00 0.53 H new ATOM 0 HB3 LEU A 6 -7.837 12.074 3.730 1.00 0.53 H new ATOM 0 HG LEU A 6 -7.871 9.619 3.458 1.00 0.44 H new ATOM 0 HD11 LEU A 6 -8.268 8.665 1.230 1.00 0.52 H new ATOM 0 HD12 LEU A 6 -9.719 9.478 1.863 1.00 0.52 H new ATOM 0 HD13 LEU A 6 -8.722 10.275 0.623 1.00 0.52 H new ATOM 0 HD21 LEU A 6 -6.009 9.469 1.874 1.00 0.47 H new ATOM 0 HD22 LEU A 6 -6.381 11.104 1.279 1.00 0.47 H new ATOM 0 HD23 LEU A 6 -5.839 10.870 2.958 1.00 0.47 H new ATOM 27 N ALA A 7 -9.756 11.577 5.892 1.00 0.44 N ATOM 28 CA ALA A 7 -9.732 11.043 7.246 1.00 0.41 C ATOM 29 C ALA A 7 -10.996 10.259 7.588 1.00 0.39 C ATOM 30 O ALA A 7 -10.926 9.195 8.199 1.00 0.44 O ATOM 31 CB ALA A 7 -9.544 12.178 8.243 1.00 0.53 C ATOM 0 H ALA A 7 -9.610 12.585 5.845 1.00 0.44 H new ATOM 0 HA ALA A 7 -8.895 10.348 7.305 1.00 0.41 H new ATOM 0 HB1 ALA A 7 -9.527 11.774 9.255 1.00 0.53 H new ATOM 0 HB2 ALA A 7 -8.603 12.689 8.040 1.00 0.53 H new ATOM 0 HB3 ALA A 7 -10.368 12.885 8.149 1.00 0.53 H new ATOM 37 N ASP A 8 -12.152 10.783 7.208 1.00 0.41 N ATOM 38 CA ASP A 8 -13.409 10.172 7.617 1.00 0.48 C ATOM 39 C ASP A 8 -13.841 9.047 6.673 1.00 0.44 C ATOM 40 O ASP A 8 -14.663 8.212 7.051 1.00 0.60 O ATOM 41 CB ASP A 8 -14.520 11.225 7.777 1.00 0.61 C ATOM 42 CG ASP A 8 -15.234 11.583 6.487 1.00 1.30 C ATOM 43 OD1 ASP A 8 -14.723 12.431 5.735 1.00 2.18 O ATOM 44 OD2 ASP A 8 -16.339 11.047 6.243 1.00 1.44 O ATOM 0 H ASP A 8 -12.247 11.616 6.627 1.00 0.41 H new ATOM 0 HA ASP A 8 -13.236 9.718 8.593 1.00 0.48 H new ATOM 0 HB2 ASP A 8 -15.254 10.856 8.494 1.00 0.61 H new ATOM 0 HB3 ASP A 8 -14.087 12.131 8.202 1.00 0.61 H new ATOM 49 N LYS A 9 -13.280 8.995 5.459 1.00 0.33 N ATOM 50 CA LYS A 9 -13.690 7.962 4.501 1.00 0.34 C ATOM 51 C LYS A 9 -12.815 6.720 4.614 1.00 0.29 C ATOM 52 O LYS A 9 -13.170 5.669 4.085 1.00 0.36 O ATOM 53 CB LYS A 9 -13.646 8.442 3.040 1.00 0.44 C ATOM 54 CG LYS A 9 -13.976 9.908 2.827 1.00 0.65 C ATOM 55 CD LYS A 9 -15.432 10.220 3.127 1.00 0.86 C ATOM 56 CE LYS A 9 -15.802 11.617 2.654 1.00 1.24 C ATOM 57 NZ LYS A 9 -14.789 12.624 3.063 1.00 1.79 N ATOM 0 H LYS A 9 -12.561 9.636 5.123 1.00 0.33 H new ATOM 0 HA LYS A 9 -14.722 7.727 4.761 1.00 0.34 H new ATOM 0 HB2 LYS A 9 -12.650 8.250 2.642 1.00 0.44 H new ATOM 0 HB3 LYS A 9 -14.344 7.841 2.457 1.00 0.44 H new ATOM 0 HG2 LYS A 9 -13.337 10.519 3.465 1.00 0.65 H new ATOM 0 HG3 LYS A 9 -13.753 10.182 1.796 1.00 0.65 H new ATOM 0 HD2 LYS A 9 -16.072 9.486 2.638 1.00 0.86 H new ATOM 0 HD3 LYS A 9 -15.612 10.136 4.199 1.00 0.86 H new ATOM 0 HE2 LYS A 9 -15.899 11.619 1.568 1.00 1.24 H new ATOM 0 HE3 LYS A 9 -16.774 11.893 3.062 1.00 1.24 H new ATOM 0 HZ1 LYS A 9 -15.242 13.556 3.149 1.00 1.79 H new ATOM 0 HZ2 LYS A 9 -14.379 12.352 3.979 1.00 1.79 H new ATOM 0 HZ3 LYS A 9 -14.036 12.670 2.347 1.00 1.79 H new ATOM 71 N VAL A 10 -11.654 6.838 5.257 1.00 0.26 N ATOM 72 CA VAL A 10 -10.776 5.683 5.427 1.00 0.24 C ATOM 73 C VAL A 10 -11.510 4.526 6.100 1.00 0.23 C ATOM 74 O VAL A 10 -12.159 4.689 7.134 1.00 0.30 O ATOM 75 CB VAL A 10 -9.495 6.027 6.223 1.00 0.28 C ATOM 76 CG1 VAL A 10 -9.808 6.402 7.661 1.00 0.33 C ATOM 77 CG2 VAL A 10 -8.503 4.872 6.168 1.00 0.28 C ATOM 0 H VAL A 10 -11.304 7.706 5.662 1.00 0.26 H new ATOM 0 HA VAL A 10 -10.473 5.378 4.425 1.00 0.24 H new ATOM 0 HB VAL A 10 -9.040 6.898 5.752 1.00 0.28 H new ATOM 0 HG11 VAL A 10 -8.882 6.636 8.186 1.00 0.33 H new ATOM 0 HG12 VAL A 10 -10.464 7.273 7.676 1.00 0.33 H new ATOM 0 HG13 VAL A 10 -10.304 5.566 8.155 1.00 0.33 H new ATOM 0 HG21 VAL A 10 -7.609 5.133 6.734 1.00 0.28 H new ATOM 0 HG22 VAL A 10 -8.958 3.981 6.600 1.00 0.28 H new ATOM 0 HG23 VAL A 10 -8.232 4.675 5.131 1.00 0.28 H new ATOM 87 N ILE A 11 -11.424 3.365 5.479 1.00 0.24 N ATOM 88 CA ILE A 11 -12.043 2.162 6.009 1.00 0.29 C ATOM 89 C ILE A 11 -11.021 1.354 6.784 1.00 0.26 C ATOM 90 O ILE A 11 -11.345 0.699 7.780 1.00 0.28 O ATOM 91 CB ILE A 11 -12.679 1.288 4.881 1.00 0.38 C ATOM 92 CG1 ILE A 11 -12.642 -0.214 5.224 1.00 0.53 C ATOM 93 CG2 ILE A 11 -11.994 1.533 3.546 1.00 0.92 C ATOM 94 CD1 ILE A 11 -13.541 -1.054 4.342 1.00 0.62 C ATOM 0 H ILE A 11 -10.927 3.228 4.599 1.00 0.24 H new ATOM 0 HA ILE A 11 -12.848 2.469 6.677 1.00 0.29 H new ATOM 0 HB ILE A 11 -13.724 1.589 4.802 1.00 0.38 H new ATOM 0 HG12 ILE A 11 -11.617 -0.575 5.134 1.00 0.53 H new ATOM 0 HG13 ILE A 11 -12.937 -0.349 6.265 1.00 0.53 H new ATOM 0 HG21 ILE A 11 -12.457 0.911 2.780 1.00 0.92 H new ATOM 0 HG22 ILE A 11 -12.096 2.583 3.272 1.00 0.92 H new ATOM 0 HG23 ILE A 11 -10.937 1.280 3.628 1.00 0.92 H new ATOM 0 HD11 ILE A 11 -13.466 -2.100 4.638 1.00 0.62 H new ATOM 0 HD12 ILE A 11 -14.573 -0.719 4.450 1.00 0.62 H new ATOM 0 HD13 ILE A 11 -13.232 -0.948 3.302 1.00 0.62 H new ATOM 106 N TRP A 12 -9.776 1.447 6.346 1.00 0.23 N ATOM 107 CA TRP A 12 -8.736 0.573 6.836 1.00 0.21 C ATOM 108 C TRP A 12 -7.385 1.031 6.283 1.00 0.21 C ATOM 109 O TRP A 12 -7.265 1.328 5.101 1.00 0.25 O ATOM 110 CB TRP A 12 -9.092 -0.842 6.371 1.00 0.23 C ATOM 111 CG TRP A 12 -8.187 -1.933 6.821 1.00 0.25 C ATOM 112 CD1 TRP A 12 -8.348 -2.760 7.893 1.00 0.31 C ATOM 113 CD2 TRP A 12 -7.001 -2.347 6.162 1.00 0.26 C ATOM 114 NE1 TRP A 12 -7.320 -3.670 7.937 1.00 0.33 N ATOM 115 CE2 TRP A 12 -6.474 -3.428 6.883 1.00 0.29 C ATOM 116 CE3 TRP A 12 -6.332 -1.893 5.029 1.00 0.30 C ATOM 117 CZ2 TRP A 12 -5.304 -4.068 6.494 1.00 0.33 C ATOM 118 CZ3 TRP A 12 -5.180 -2.528 4.647 1.00 0.36 C ATOM 119 CH2 TRP A 12 -4.675 -3.603 5.377 1.00 0.36 C ATOM 0 H TRP A 12 -9.465 2.124 5.649 1.00 0.23 H new ATOM 0 HA TRP A 12 -8.661 0.594 7.923 1.00 0.21 H new ATOM 0 HB2 TRP A 12 -10.101 -1.071 6.715 1.00 0.23 H new ATOM 0 HB3 TRP A 12 -9.118 -0.847 5.281 1.00 0.23 H new ATOM 0 HD1 TRP A 12 -9.162 -2.707 8.601 1.00 0.31 H new ATOM 0 HE1 TRP A 12 -7.204 -4.403 8.636 1.00 0.33 H new ATOM 0 HE3 TRP A 12 -6.714 -1.057 4.462 1.00 0.30 H new ATOM 0 HZ2 TRP A 12 -4.908 -4.902 7.055 1.00 0.33 H new ATOM 0 HZ3 TRP A 12 -4.654 -2.190 3.766 1.00 0.36 H new ATOM 0 HH2 TRP A 12 -3.763 -4.079 5.050 1.00 0.36 H new ATOM 130 N ALA A 13 -6.382 1.133 7.131 1.00 0.23 N ATOM 131 CA ALA A 13 -5.067 1.558 6.681 1.00 0.23 C ATOM 132 C ALA A 13 -3.982 0.969 7.557 1.00 0.25 C ATOM 133 O ALA A 13 -4.128 0.908 8.776 1.00 0.26 O ATOM 134 CB ALA A 13 -4.976 3.076 6.679 1.00 0.25 C ATOM 0 H ALA A 13 -6.448 0.930 8.128 1.00 0.23 H new ATOM 0 HA ALA A 13 -4.920 1.195 5.664 1.00 0.23 H new ATOM 0 HB1 ALA A 13 -3.986 3.381 6.340 1.00 0.25 H new ATOM 0 HB2 ALA A 13 -5.731 3.485 6.008 1.00 0.25 H new ATOM 0 HB3 ALA A 13 -5.146 3.452 7.688 1.00 0.25 H new ATOM 140 N VAL A 14 -2.905 0.508 6.943 1.00 0.27 N ATOM 141 CA VAL A 14 -1.776 0.005 7.695 1.00 0.27 C ATOM 142 C VAL A 14 -0.450 0.241 6.986 1.00 0.26 C ATOM 143 O VAL A 14 -0.314 0.071 5.764 1.00 0.33 O ATOM 144 CB VAL A 14 -1.911 -1.496 8.034 1.00 0.33 C ATOM 145 CG1 VAL A 14 -2.046 -2.351 6.794 1.00 0.70 C ATOM 146 CG2 VAL A 14 -0.722 -1.960 8.846 1.00 0.79 C ATOM 0 H VAL A 14 -2.792 0.473 5.930 1.00 0.27 H new ATOM 0 HA VAL A 14 -1.780 0.574 8.625 1.00 0.27 H new ATOM 0 HB VAL A 14 -2.823 -1.612 8.619 1.00 0.33 H new ATOM 0 HG11 VAL A 14 -2.138 -3.398 7.082 1.00 0.70 H new ATOM 0 HG12 VAL A 14 -2.933 -2.048 6.238 1.00 0.70 H new ATOM 0 HG13 VAL A 14 -1.164 -2.224 6.166 1.00 0.70 H new ATOM 0 HG21 VAL A 14 -0.831 -3.020 9.078 1.00 0.79 H new ATOM 0 HG22 VAL A 14 0.192 -1.806 8.273 1.00 0.79 H new ATOM 0 HG23 VAL A 14 -0.670 -1.389 9.773 1.00 0.79 H new ATOM 156 N ASN A 15 0.531 0.625 7.779 1.00 0.26 N ATOM 157 CA ASN A 15 1.898 0.628 7.321 1.00 0.28 C ATOM 158 C ASN A 15 2.549 -0.639 7.818 1.00 0.28 C ATOM 159 O ASN A 15 2.806 -0.786 9.015 1.00 0.34 O ATOM 160 CB ASN A 15 2.688 1.865 7.792 1.00 0.32 C ATOM 161 CG ASN A 15 4.193 1.681 7.628 1.00 0.50 C ATOM 162 OD1 ASN A 15 4.881 1.288 8.567 1.00 1.49 O ATOM 163 ND2 ASN A 15 4.714 1.955 6.445 1.00 0.83 N ATOM 0 H ASN A 15 0.403 0.938 8.741 1.00 0.26 H new ATOM 0 HA ASN A 15 1.903 0.673 6.232 1.00 0.28 H new ATOM 0 HB2 ASN A 15 2.366 2.738 7.224 1.00 0.32 H new ATOM 0 HB3 ASN A 15 2.459 2.064 8.839 1.00 0.32 H new ATOM 0 HD21 ASN A 15 5.716 1.842 6.290 1.00 0.83 H new ATOM 0 HD22 ASN A 15 4.114 2.279 5.686 1.00 0.83 H new ATOM 170 N ALA A 16 2.726 -1.592 6.917 1.00 0.33 N ATOM 171 CA ALA A 16 3.473 -2.779 7.237 1.00 0.39 C ATOM 172 C ALA A 16 4.907 -2.378 7.471 1.00 0.37 C ATOM 173 O ALA A 16 5.710 -2.310 6.526 1.00 0.38 O ATOM 174 CB ALA A 16 3.373 -3.827 6.142 1.00 0.48 C ATOM 0 H ALA A 16 2.361 -1.560 5.965 1.00 0.33 H new ATOM 0 HA ALA A 16 3.056 -3.236 8.134 1.00 0.39 H new ATOM 0 HB1 ALA A 16 3.952 -4.706 6.426 1.00 0.48 H new ATOM 0 HB2 ALA A 16 2.329 -4.109 6.003 1.00 0.48 H new ATOM 0 HB3 ALA A 16 3.766 -3.419 5.211 1.00 0.48 H new ATOM 180 N GLY A 17 5.179 -2.050 8.727 1.00 0.40 N ATOM 181 CA GLY A 17 6.476 -1.596 9.132 1.00 0.45 C ATOM 182 C GLY A 17 6.526 -1.265 10.607 1.00 0.49 C ATOM 183 O GLY A 17 7.502 -1.579 11.284 1.00 0.76 O ATOM 0 H GLY A 17 4.497 -2.096 9.484 1.00 0.40 H new ATOM 0 HA2 GLY A 17 7.215 -2.365 8.908 1.00 0.45 H new ATOM 0 HA3 GLY A 17 6.748 -0.713 8.553 1.00 0.45 H new ATOM 187 N GLY A 18 5.480 -0.625 11.108 1.00 0.57 N ATOM 188 CA GLY A 18 5.485 -0.191 12.492 1.00 0.66 C ATOM 189 C GLY A 18 4.118 -0.281 13.145 1.00 0.57 C ATOM 190 O GLY A 18 3.248 -1.025 12.684 1.00 0.74 O ATOM 0 H GLY A 18 4.633 -0.399 10.587 1.00 0.57 H new ATOM 0 HA2 GLY A 18 6.192 -0.800 13.056 1.00 0.66 H new ATOM 0 HA3 GLY A 18 5.839 0.839 12.543 1.00 0.66 H new ATOM 194 N GLU A 19 3.920 0.495 14.206 1.00 0.53 N ATOM 195 CA GLU A 19 2.684 0.447 14.965 1.00 0.50 C ATOM 196 C GLU A 19 1.967 1.798 14.956 1.00 0.45 C ATOM 197 O GLU A 19 2.520 2.799 15.404 1.00 0.64 O ATOM 198 CB GLU A 19 2.966 0.025 16.412 1.00 0.69 C ATOM 199 CG GLU A 19 3.530 -1.382 16.552 1.00 1.27 C ATOM 200 CD GLU A 19 3.775 -1.772 17.998 1.00 1.45 C ATOM 201 OE1 GLU A 19 2.809 -2.166 18.687 1.00 1.77 O ATOM 202 OE2 GLU A 19 4.937 -1.702 18.454 1.00 1.75 O ATOM 0 H GLU A 19 4.604 1.165 14.557 1.00 0.53 H new ATOM 0 HA GLU A 19 2.034 -0.288 14.490 1.00 0.50 H new ATOM 0 HB2 GLU A 19 3.668 0.732 16.855 1.00 0.69 H new ATOM 0 HB3 GLU A 19 2.041 0.093 16.985 1.00 0.69 H new ATOM 0 HG2 GLU A 19 2.839 -2.093 16.100 1.00 1.27 H new ATOM 0 HG3 GLU A 19 4.466 -1.451 15.997 1.00 1.27 H new ATOM 209 N SER A 20 0.737 1.778 14.429 1.00 0.42 N ATOM 210 CA SER A 20 -0.223 2.903 14.452 1.00 0.42 C ATOM 211 C SER A 20 0.364 4.314 14.235 1.00 0.38 C ATOM 212 O SER A 20 1.068 4.853 15.089 1.00 0.44 O ATOM 213 CB SER A 20 -1.019 2.869 15.755 1.00 0.59 C ATOM 214 OG SER A 20 -1.805 1.689 15.835 1.00 1.29 O ATOM 0 H SER A 20 0.364 0.954 13.958 1.00 0.42 H new ATOM 0 HA SER A 20 -0.858 2.739 13.581 1.00 0.42 H new ATOM 0 HB2 SER A 20 -0.337 2.916 16.604 1.00 0.59 H new ATOM 0 HB3 SER A 20 -1.664 3.746 15.816 1.00 0.59 H new ATOM 0 HG SER A 20 -2.681 1.905 16.218 1.00 1.29 H new ATOM 220 N HIS A 21 0.021 4.934 13.102 1.00 0.34 N ATOM 221 CA HIS A 21 0.354 6.343 12.868 1.00 0.33 C ATOM 222 C HIS A 21 -0.726 7.039 12.055 1.00 0.32 C ATOM 223 O HIS A 21 -1.138 6.561 11.002 1.00 0.32 O ATOM 224 CB HIS A 21 1.719 6.490 12.183 1.00 0.35 C ATOM 225 CG HIS A 21 1.881 7.726 11.341 1.00 0.35 C ATOM 226 ND1 HIS A 21 2.322 8.941 11.826 1.00 0.41 N ATOM 227 CD2 HIS A 21 1.651 7.921 10.019 1.00 0.40 C ATOM 228 CE1 HIS A 21 2.353 9.818 10.839 1.00 0.42 C ATOM 229 NE2 HIS A 21 1.952 9.222 9.738 1.00 0.41 N ATOM 0 H HIS A 21 -0.484 4.486 12.337 1.00 0.34 H new ATOM 0 HA HIS A 21 0.411 6.826 13.843 1.00 0.33 H new ATOM 0 HB2 HIS A 21 2.495 6.487 12.949 1.00 0.35 H new ATOM 0 HB3 HIS A 21 1.888 5.616 11.554 1.00 0.35 H new ATOM 0 HD1 HIS A 21 2.583 9.131 12.794 1.00 0.41 H new ATOM 0 HD2 HIS A 21 1.295 7.182 9.317 1.00 0.40 H new ATOM 0 HE1 HIS A 21 2.657 10.851 10.922 1.00 0.42 H new ATOM 238 N VAL A 22 -1.154 8.180 12.557 1.00 0.41 N ATOM 239 CA VAL A 22 -2.088 9.040 11.855 1.00 0.40 C ATOM 240 C VAL A 22 -1.323 9.991 10.944 1.00 0.40 C ATOM 241 O VAL A 22 -0.537 10.817 11.413 1.00 0.48 O ATOM 242 CB VAL A 22 -2.944 9.870 12.831 1.00 0.49 C ATOM 243 CG1 VAL A 22 -3.967 10.708 12.077 1.00 0.84 C ATOM 244 CG2 VAL A 22 -3.631 8.975 13.843 1.00 1.01 C ATOM 0 H VAL A 22 -0.863 8.539 13.466 1.00 0.41 H new ATOM 0 HA VAL A 22 -2.751 8.400 11.272 1.00 0.40 H new ATOM 0 HB VAL A 22 -2.279 10.545 13.369 1.00 0.49 H new ATOM 0 HG11 VAL A 22 -4.559 11.285 12.787 1.00 0.84 H new ATOM 0 HG12 VAL A 22 -3.452 11.387 11.398 1.00 0.84 H new ATOM 0 HG13 VAL A 22 -4.624 10.053 11.505 1.00 0.84 H new ATOM 0 HG21 VAL A 22 -4.229 9.584 14.521 1.00 1.01 H new ATOM 0 HG22 VAL A 22 -4.278 8.268 13.324 1.00 1.01 H new ATOM 0 HG23 VAL A 22 -2.880 8.428 14.414 1.00 1.01 H new ATOM 254 N ASP A 23 -1.535 9.856 9.650 1.00 0.37 N ATOM 255 CA ASP A 23 -0.872 10.702 8.670 1.00 0.42 C ATOM 256 C ASP A 23 -1.617 12.020 8.541 1.00 0.36 C ATOM 257 O ASP A 23 -2.768 12.126 8.959 1.00 0.33 O ATOM 258 CB ASP A 23 -0.792 9.970 7.327 1.00 0.51 C ATOM 259 CG ASP A 23 -1.375 10.744 6.164 1.00 0.55 C ATOM 260 OD1 ASP A 23 -0.666 11.606 5.613 1.00 0.75 O ATOM 261 OD2 ASP A 23 -2.538 10.490 5.798 1.00 0.77 O ATOM 0 H ASP A 23 -2.166 9.163 9.247 1.00 0.37 H new ATOM 0 HA ASP A 23 0.144 10.920 8.997 1.00 0.42 H new ATOM 0 HB2 ASP A 23 0.252 9.743 7.111 1.00 0.51 H new ATOM 0 HB3 ASP A 23 -1.314 9.017 7.413 1.00 0.51 H new ATOM 266 N VAL A 24 -0.948 13.001 7.928 1.00 0.38 N ATOM 267 CA VAL A 24 -1.415 14.385 7.874 1.00 0.37 C ATOM 268 C VAL A 24 -2.738 14.507 7.127 1.00 0.38 C ATOM 269 O VAL A 24 -3.437 15.514 7.241 1.00 0.49 O ATOM 270 CB VAL A 24 -0.368 15.304 7.200 1.00 0.42 C ATOM 271 CG1 VAL A 24 0.962 15.226 7.928 1.00 0.59 C ATOM 272 CG2 VAL A 24 -0.186 14.945 5.731 1.00 0.62 C ATOM 0 H VAL A 24 -0.059 12.853 7.451 1.00 0.38 H new ATOM 0 HA VAL A 24 -1.564 14.702 8.906 1.00 0.37 H new ATOM 0 HB VAL A 24 -0.739 16.327 7.257 1.00 0.42 H new ATOM 0 HG11 VAL A 24 1.684 15.879 7.438 1.00 0.59 H new ATOM 0 HG12 VAL A 24 0.830 15.543 8.963 1.00 0.59 H new ATOM 0 HG13 VAL A 24 1.329 14.200 7.907 1.00 0.59 H new ATOM 0 HG21 VAL A 24 0.555 15.607 5.284 1.00 0.62 H new ATOM 0 HG22 VAL A 24 0.153 13.912 5.648 1.00 0.62 H new ATOM 0 HG23 VAL A 24 -1.136 15.058 5.208 1.00 0.62 H new ATOM 282 N HIS A 25 -3.070 13.479 6.361 1.00 0.37 N ATOM 283 CA HIS A 25 -4.333 13.423 5.642 1.00 0.43 C ATOM 284 C HIS A 25 -5.427 12.885 6.554 1.00 0.40 C ATOM 285 O HIS A 25 -6.592 12.785 6.166 1.00 0.51 O ATOM 286 CB HIS A 25 -4.195 12.538 4.405 1.00 0.53 C ATOM 287 CG HIS A 25 -3.125 12.990 3.461 1.00 0.61 C ATOM 288 ND1 HIS A 25 -3.126 14.226 2.858 1.00 0.73 N ATOM 289 CD2 HIS A 25 -1.996 12.374 3.048 1.00 0.72 C ATOM 290 CE1 HIS A 25 -2.045 14.348 2.112 1.00 0.86 C ATOM 291 NE2 HIS A 25 -1.335 13.238 2.210 1.00 0.86 N ATOM 0 H HIS A 25 -2.474 12.663 6.221 1.00 0.37 H new ATOM 0 HA HIS A 25 -4.603 14.430 5.323 1.00 0.43 H new ATOM 0 HB2 HIS A 25 -3.981 11.517 4.721 1.00 0.53 H new ATOM 0 HB3 HIS A 25 -5.148 12.515 3.877 1.00 0.53 H new ATOM 0 HD2 HIS A 25 -1.672 11.382 3.326 1.00 0.72 H new ATOM 0 HE1 HIS A 25 -1.784 15.212 1.519 1.00 0.86 H new ATOM 0 HE2 HIS A 25 -0.447 13.054 1.743 1.00 0.86 H new ATOM 300 N GLY A 26 -5.029 12.545 7.772 1.00 0.32 N ATOM 301 CA GLY A 26 -5.946 12.002 8.747 1.00 0.33 C ATOM 302 C GLY A 26 -6.083 10.504 8.615 1.00 0.30 C ATOM 303 O GLY A 26 -7.100 9.928 9.002 1.00 0.33 O ATOM 0 H GLY A 26 -4.069 12.639 8.104 1.00 0.32 H new ATOM 0 HA2 GLY A 26 -5.598 12.248 9.750 1.00 0.33 H new ATOM 0 HA3 GLY A 26 -6.924 12.468 8.626 1.00 0.33 H new ATOM 307 N ILE A 27 -5.052 9.862 8.083 1.00 0.26 N ATOM 308 CA ILE A 27 -5.127 8.432 7.814 1.00 0.24 C ATOM 309 C ILE A 27 -4.347 7.635 8.854 1.00 0.26 C ATOM 310 O ILE A 27 -3.124 7.717 8.938 1.00 0.28 O ATOM 311 CB ILE A 27 -4.665 8.085 6.380 1.00 0.24 C ATOM 312 CG1 ILE A 27 -5.646 8.673 5.367 1.00 0.26 C ATOM 313 CG2 ILE A 27 -4.581 6.582 6.178 1.00 0.27 C ATOM 314 CD1 ILE A 27 -7.073 8.265 5.630 1.00 0.31 C ATOM 0 H ILE A 27 -4.166 10.300 7.832 1.00 0.26 H new ATOM 0 HA ILE A 27 -6.176 8.147 7.888 1.00 0.24 H new ATOM 0 HB ILE A 27 -3.673 8.511 6.233 1.00 0.24 H new ATOM 0 HG12 ILE A 27 -5.574 9.760 5.388 1.00 0.26 H new ATOM 0 HG13 ILE A 27 -5.361 8.354 4.365 1.00 0.26 H new ATOM 0 HG21 ILE A 27 -4.254 6.369 5.160 1.00 0.27 H new ATOM 0 HG22 ILE A 27 -3.867 6.159 6.885 1.00 0.27 H new ATOM 0 HG23 ILE A 27 -5.562 6.137 6.344 1.00 0.27 H new ATOM 0 HD11 ILE A 27 -7.724 8.713 4.879 1.00 0.31 H new ATOM 0 HD12 ILE A 27 -7.156 7.179 5.581 1.00 0.31 H new ATOM 0 HD13 ILE A 27 -7.373 8.608 6.620 1.00 0.31 H new ATOM 326 N HIS A 28 -5.078 6.867 9.647 1.00 0.31 N ATOM 327 CA HIS A 28 -4.514 6.149 10.782 1.00 0.33 C ATOM 328 C HIS A 28 -4.105 4.733 10.380 1.00 0.33 C ATOM 329 O HIS A 28 -4.959 3.893 10.101 1.00 0.39 O ATOM 330 CB HIS A 28 -5.566 6.106 11.896 1.00 0.40 C ATOM 331 CG HIS A 28 -5.087 5.593 13.222 1.00 0.49 C ATOM 332 ND1 HIS A 28 -5.225 6.314 14.384 1.00 0.60 N ATOM 333 CD2 HIS A 28 -4.510 4.423 13.578 1.00 0.80 C ATOM 334 CE1 HIS A 28 -4.750 5.617 15.393 1.00 0.66 C ATOM 335 NE2 HIS A 28 -4.312 4.460 14.938 1.00 0.78 N ATOM 0 H HIS A 28 -6.080 6.723 9.523 1.00 0.31 H new ATOM 0 HA HIS A 28 -3.619 6.662 11.133 1.00 0.33 H new ATOM 0 HB2 HIS A 28 -5.961 7.112 12.037 1.00 0.40 H new ATOM 0 HB3 HIS A 28 -6.396 5.482 11.564 1.00 0.40 H new ATOM 0 HD2 HIS A 28 -4.252 3.610 12.916 1.00 0.80 H new ATOM 0 HE1 HIS A 28 -4.723 5.939 16.423 1.00 0.66 H new ATOM 0 HE2 HIS A 28 -3.896 3.717 15.500 1.00 0.78 H new ATOM 344 N TYR A 29 -2.801 4.472 10.347 1.00 0.32 N ATOM 345 CA TYR A 29 -2.305 3.152 9.996 1.00 0.35 C ATOM 346 C TYR A 29 -2.264 2.251 11.224 1.00 0.40 C ATOM 347 O TYR A 29 -2.027 2.720 12.333 1.00 0.44 O ATOM 348 CB TYR A 29 -0.946 3.275 9.279 1.00 0.42 C ATOM 349 CG TYR A 29 0.338 3.066 10.082 1.00 0.65 C ATOM 350 CD1 TYR A 29 0.552 1.870 10.744 1.00 0.80 C ATOM 351 CD2 TYR A 29 1.293 4.061 10.236 1.00 0.98 C ATOM 352 CE1 TYR A 29 1.671 1.667 11.525 1.00 1.17 C ATOM 353 CE2 TYR A 29 2.424 3.860 11.007 1.00 1.30 C ATOM 354 CZ TYR A 29 2.746 2.714 11.438 1.00 1.39 C ATOM 355 OH TYR A 29 3.717 2.442 12.425 1.00 1.75 O ATOM 0 H TYR A 29 -2.075 5.156 10.559 1.00 0.32 H new ATOM 0 HA TYR A 29 -2.988 2.674 9.294 1.00 0.35 H new ATOM 0 HB2 TYR A 29 -0.941 2.558 8.458 1.00 0.42 H new ATOM 0 HB3 TYR A 29 -0.898 4.269 8.834 1.00 0.42 H new ATOM 0 HD1 TYR A 29 -0.174 1.077 10.647 1.00 0.80 H new ATOM 0 HD2 TYR A 29 1.150 5.012 9.744 1.00 0.98 H new ATOM 0 HE1 TYR A 29 1.769 0.802 12.165 1.00 1.17 H new ATOM 0 HE2 TYR A 29 3.051 4.706 11.248 1.00 1.30 H new ATOM 0 HH TYR A 29 4.426 3.117 12.381 1.00 1.75 H new ATOM 365 N ARG A 30 -2.534 0.966 11.013 1.00 0.50 N ATOM 366 CA ARG A 30 -2.617 -0.008 12.095 1.00 0.64 C ATOM 367 C ARG A 30 -1.292 -0.742 12.297 1.00 0.76 C ATOM 368 O ARG A 30 -0.382 -0.645 11.484 1.00 1.46 O ATOM 369 CB ARG A 30 -3.745 -0.995 11.806 1.00 0.83 C ATOM 370 CG ARG A 30 -5.075 -0.295 11.583 1.00 0.73 C ATOM 371 CD ARG A 30 -6.196 -1.262 11.257 1.00 0.93 C ATOM 372 NE ARG A 30 -7.398 -0.551 10.820 1.00 1.52 N ATOM 373 CZ ARG A 30 -8.641 -0.988 11.006 1.00 2.17 C ATOM 374 NH1 ARG A 30 -8.870 -2.093 11.704 1.00 2.48 N ATOM 375 NH2 ARG A 30 -9.668 -0.294 10.525 1.00 2.94 N ATOM 0 H ARG A 30 -2.701 0.571 10.087 1.00 0.50 H new ATOM 0 HA ARG A 30 -2.832 0.524 13.022 1.00 0.64 H new ATOM 0 HB2 ARG A 30 -3.494 -1.584 10.924 1.00 0.83 H new ATOM 0 HB3 ARG A 30 -3.838 -1.692 12.639 1.00 0.83 H new ATOM 0 HG2 ARG A 30 -5.337 0.272 12.477 1.00 0.73 H new ATOM 0 HG3 ARG A 30 -4.971 0.423 10.769 1.00 0.73 H new ATOM 0 HD2 ARG A 30 -5.872 -1.948 10.475 1.00 0.93 H new ATOM 0 HD3 ARG A 30 -6.426 -1.865 12.135 1.00 0.93 H new ATOM 0 HE ARG A 30 -7.275 0.341 10.340 1.00 1.52 H new ATOM 0 HH11 ARG A 30 -8.090 -2.615 12.103 1.00 2.48 H new ATOM 0 HH12 ARG A 30 -9.826 -2.420 11.841 1.00 2.48 H new ATOM 0 HH21 ARG A 30 -9.503 0.573 10.014 1.00 2.94 H new ATOM 0 HH22 ARG A 30 -10.621 -0.629 10.667 1.00 2.94 H new ATOM 389 N LYS A 31 -1.212 -1.494 13.379 1.00 0.59 N ATOM 390 CA LYS A 31 0.048 -2.076 13.838 1.00 0.67 C ATOM 391 C LYS A 31 0.380 -3.399 13.151 1.00 0.86 C ATOM 392 O LYS A 31 0.097 -4.474 13.686 1.00 1.37 O ATOM 393 CB LYS A 31 0.011 -2.289 15.346 1.00 0.99 C ATOM 394 CG LYS A 31 -0.194 -1.019 16.143 1.00 1.25 C ATOM 395 CD LYS A 31 -0.270 -1.312 17.631 1.00 1.61 C ATOM 396 CE LYS A 31 -0.512 -0.051 18.442 1.00 2.18 C ATOM 397 NZ LYS A 31 -1.878 0.492 18.225 1.00 2.78 N ATOM 0 H LYS A 31 -2.013 -1.722 13.967 1.00 0.59 H new ATOM 0 HA LYS A 31 0.830 -1.365 13.574 1.00 0.67 H new ATOM 0 HB2 LYS A 31 -0.790 -2.988 15.584 1.00 0.99 H new ATOM 0 HB3 LYS A 31 0.945 -2.756 15.660 1.00 0.99 H new ATOM 0 HG2 LYS A 31 0.625 -0.327 15.947 1.00 1.25 H new ATOM 0 HG3 LYS A 31 -1.111 -0.527 15.819 1.00 1.25 H new ATOM 0 HD2 LYS A 31 -1.072 -2.026 17.821 1.00 1.61 H new ATOM 0 HD3 LYS A 31 0.658 -1.781 17.957 1.00 1.61 H new ATOM 0 HE2 LYS A 31 -0.371 -0.267 19.501 1.00 2.18 H new ATOM 0 HE3 LYS A 31 0.226 0.703 18.170 1.00 2.18 H new ATOM 0 HZ1 LYS A 31 -1.960 1.421 18.686 1.00 2.78 H new ATOM 0 HZ2 LYS A 31 -2.053 0.595 17.205 1.00 2.78 H new ATOM 0 HZ3 LYS A 31 -2.579 -0.159 18.632 1.00 2.78 H new ATOM 411 N ASP A 32 0.955 -3.274 11.957 1.00 0.75 N ATOM 412 CA ASP A 32 1.598 -4.376 11.213 1.00 1.00 C ATOM 413 C ASP A 32 0.856 -5.737 11.298 1.00 0.93 C ATOM 414 O ASP A 32 1.470 -6.795 11.351 1.00 1.29 O ATOM 415 CB ASP A 32 3.068 -4.481 11.679 1.00 1.58 C ATOM 416 CG ASP A 32 3.330 -5.409 12.863 1.00 1.92 C ATOM 417 OD1 ASP A 32 2.889 -5.069 13.985 1.00 2.41 O ATOM 418 OD2 ASP A 32 3.910 -6.499 12.669 1.00 2.36 O ATOM 0 H ASP A 32 0.992 -2.384 11.460 1.00 0.75 H new ATOM 0 HA ASP A 32 1.551 -4.131 10.152 1.00 1.00 H new ATOM 0 HB2 ASP A 32 3.672 -4.819 10.837 1.00 1.58 H new ATOM 0 HB3 ASP A 32 3.418 -3.482 11.941 1.00 1.58 H new ATOM 423 N PRO A 33 -0.473 -5.727 11.117 1.00 0.72 N ATOM 424 CA PRO A 33 -1.363 -6.801 11.535 1.00 0.89 C ATOM 425 C PRO A 33 -1.692 -7.797 10.422 1.00 1.04 C ATOM 426 O PRO A 33 -2.858 -8.109 10.177 1.00 1.87 O ATOM 427 CB PRO A 33 -2.600 -5.998 11.913 1.00 0.99 C ATOM 428 CG PRO A 33 -2.642 -4.910 10.886 1.00 0.86 C ATOM 429 CD PRO A 33 -1.220 -4.695 10.420 1.00 0.69 C ATOM 0 HA PRO A 33 -0.937 -7.428 12.318 1.00 0.89 H new ATOM 0 HB2 PRO A 33 -3.500 -6.612 11.884 1.00 0.99 H new ATOM 0 HB3 PRO A 33 -2.522 -5.594 12.922 1.00 0.99 H new ATOM 0 HG2 PRO A 33 -3.284 -5.191 10.051 1.00 0.86 H new ATOM 0 HG3 PRO A 33 -3.053 -3.994 11.310 1.00 0.86 H new ATOM 0 HD2 PRO A 33 -1.133 -4.798 9.338 1.00 0.69 H new ATOM 0 HD3 PRO A 33 -0.861 -3.698 10.675 1.00 0.69 H new ATOM 437 N LEU A 34 -0.666 -8.290 9.754 1.00 0.93 N ATOM 438 CA LEU A 34 -0.856 -9.218 8.640 1.00 1.04 C ATOM 439 C LEU A 34 -1.071 -10.655 9.100 1.00 1.44 C ATOM 440 O LEU A 34 -2.191 -11.069 9.397 1.00 1.99 O ATOM 441 CB LEU A 34 0.322 -9.174 7.662 1.00 0.94 C ATOM 442 CG LEU A 34 0.383 -7.952 6.748 1.00 1.11 C ATOM 443 CD1 LEU A 34 0.668 -6.691 7.537 1.00 1.93 C ATOM 444 CD2 LEU A 34 1.433 -8.153 5.678 1.00 1.40 C ATOM 0 H LEU A 34 0.308 -8.068 9.958 1.00 0.93 H new ATOM 0 HA LEU A 34 -1.761 -8.884 8.132 1.00 1.04 H new ATOM 0 HB2 LEU A 34 1.248 -9.222 8.236 1.00 0.94 H new ATOM 0 HB3 LEU A 34 0.286 -10.068 7.040 1.00 0.94 H new ATOM 0 HG LEU A 34 -0.591 -7.836 6.272 1.00 1.11 H new ATOM 0 HD11 LEU A 34 0.705 -5.838 6.859 1.00 1.93 H new ATOM 0 HD12 LEU A 34 -0.122 -6.536 8.272 1.00 1.93 H new ATOM 0 HD13 LEU A 34 1.626 -6.790 8.048 1.00 1.93 H new ATOM 0 HD21 LEU A 34 1.467 -7.275 5.032 1.00 1.40 H new ATOM 0 HD22 LEU A 34 2.407 -8.297 6.146 1.00 1.40 H new ATOM 0 HD23 LEU A 34 1.183 -9.031 5.083 1.00 1.40 H new ATOM 456 N GLU A 35 0.014 -11.405 9.185 1.00 1.59 N ATOM 457 CA GLU A 35 -0.080 -12.854 9.353 1.00 2.32 C ATOM 458 C GLU A 35 -0.048 -13.266 10.819 1.00 2.08 C ATOM 459 O GLU A 35 0.730 -14.131 11.216 1.00 2.59 O ATOM 460 CB GLU A 35 1.051 -13.536 8.583 1.00 3.27 C ATOM 461 CG GLU A 35 0.925 -13.393 7.077 1.00 3.88 C ATOM 462 CD GLU A 35 -0.266 -14.147 6.525 1.00 4.71 C ATOM 463 OE1 GLU A 35 -1.382 -13.590 6.521 1.00 5.06 O ATOM 464 OE2 GLU A 35 -0.089 -15.310 6.103 1.00 5.31 O ATOM 0 H GLU A 35 0.966 -11.043 9.141 1.00 1.59 H new ATOM 0 HA GLU A 35 -1.042 -13.174 8.952 1.00 2.32 H new ATOM 0 HB2 GLU A 35 2.004 -13.114 8.902 1.00 3.27 H new ATOM 0 HB3 GLU A 35 1.069 -14.595 8.840 1.00 3.27 H new ATOM 0 HG2 GLU A 35 0.834 -12.337 6.821 1.00 3.88 H new ATOM 0 HG3 GLU A 35 1.835 -13.759 6.602 1.00 3.88 H new ATOM 471 N GLY A 36 -0.890 -12.638 11.624 1.00 1.92 N ATOM 472 CA GLY A 36 -0.942 -12.964 13.037 1.00 2.13 C ATOM 473 C GLY A 36 0.142 -12.250 13.809 1.00 2.00 C ATOM 474 O GLY A 36 0.220 -12.346 15.034 1.00 2.64 O ATOM 0 H GLY A 36 -1.539 -11.909 11.327 1.00 1.92 H new ATOM 0 HA2 GLY A 36 -1.917 -12.690 13.439 1.00 2.13 H new ATOM 0 HA3 GLY A 36 -0.834 -14.041 13.167 1.00 2.13 H new ATOM 478 N ARG A 37 0.977 -11.527 13.079 1.00 1.78 N ATOM 479 CA ARG A 37 2.038 -10.738 13.667 1.00 2.68 C ATOM 480 C ARG A 37 1.498 -9.365 14.017 1.00 2.85 C ATOM 481 O ARG A 37 1.808 -8.395 13.354 1.00 3.72 O ATOM 482 CB ARG A 37 3.219 -10.570 12.700 1.00 3.59 C ATOM 483 CG ARG A 37 4.030 -11.829 12.421 1.00 3.76 C ATOM 484 CD ARG A 37 3.383 -12.711 11.363 1.00 3.79 C ATOM 485 NE ARG A 37 4.378 -13.495 10.622 1.00 4.42 N ATOM 486 CZ ARG A 37 4.219 -14.769 10.249 1.00 4.86 C ATOM 487 NH1 ARG A 37 3.115 -15.431 10.570 1.00 4.81 N ATOM 488 NH2 ARG A 37 5.167 -15.380 9.546 1.00 5.64 N ATOM 0 H ARG A 37 0.935 -11.473 12.061 1.00 1.78 H new ATOM 0 HA ARG A 37 2.392 -11.257 14.557 1.00 2.68 H new ATOM 0 HB2 ARG A 37 2.838 -10.189 11.753 1.00 3.59 H new ATOM 0 HB3 ARG A 37 3.889 -9.810 13.103 1.00 3.59 H new ATOM 0 HG2 ARG A 37 5.031 -11.548 12.094 1.00 3.76 H new ATOM 0 HG3 ARG A 37 4.144 -12.397 13.344 1.00 3.76 H new ATOM 0 HD2 ARG A 37 2.670 -13.385 11.838 1.00 3.79 H new ATOM 0 HD3 ARG A 37 2.819 -12.090 10.667 1.00 3.79 H new ATOM 0 HE ARG A 37 5.254 -13.035 10.374 1.00 4.42 H new ATOM 0 HH11 ARG A 37 2.380 -14.968 11.105 1.00 4.81 H new ATOM 0 HH12 ARG A 37 3.001 -16.403 10.282 1.00 4.81 H new ATOM 0 HH21 ARG A 37 6.017 -14.877 9.291 1.00 5.64 H new ATOM 0 HH22 ARG A 37 5.045 -16.352 9.262 1.00 5.64 H new ATOM 502 N VAL A 38 0.691 -9.286 15.049 1.00 2.35 N ATOM 503 CA VAL A 38 0.071 -8.019 15.406 1.00 2.65 C ATOM 504 C VAL A 38 0.785 -7.404 16.597 1.00 2.33 C ATOM 505 O VAL A 38 0.807 -7.977 17.690 1.00 2.45 O ATOM 506 CB VAL A 38 -1.425 -8.196 15.742 1.00 3.31 C ATOM 507 CG1 VAL A 38 -2.079 -6.853 16.028 1.00 3.96 C ATOM 508 CG2 VAL A 38 -2.150 -8.914 14.614 1.00 3.90 C ATOM 0 H VAL A 38 0.447 -10.070 15.654 1.00 2.35 H new ATOM 0 HA VAL A 38 0.154 -7.357 14.544 1.00 2.65 H new ATOM 0 HB VAL A 38 -1.498 -8.809 16.641 1.00 3.31 H new ATOM 0 HG11 VAL A 38 -3.133 -7.004 16.262 1.00 3.96 H new ATOM 0 HG12 VAL A 38 -1.583 -6.380 16.876 1.00 3.96 H new ATOM 0 HG13 VAL A 38 -1.990 -6.211 15.151 1.00 3.96 H new ATOM 0 HG21 VAL A 38 -3.203 -9.028 14.872 1.00 3.90 H new ATOM 0 HG22 VAL A 38 -2.062 -8.332 13.697 1.00 3.90 H new ATOM 0 HG23 VAL A 38 -1.705 -9.898 14.463 1.00 3.90 H new ATOM 518 N GLY A 39 1.378 -6.244 16.372 1.00 2.49 N ATOM 519 CA GLY A 39 2.141 -5.591 17.407 1.00 2.46 C ATOM 520 C GLY A 39 3.583 -6.038 17.389 1.00 2.14 C ATOM 521 O GLY A 39 4.228 -6.141 18.436 1.00 2.56 O ATOM 0 H GLY A 39 1.343 -5.742 15.485 1.00 2.49 H new ATOM 0 HA2 GLY A 39 2.091 -4.511 17.272 1.00 2.46 H new ATOM 0 HA3 GLY A 39 1.702 -5.811 18.380 1.00 2.46 H new ATOM 525 N ARG A 40 4.091 -6.313 16.198 1.00 2.03 N ATOM 526 CA ARG A 40 5.463 -6.754 16.037 1.00 2.30 C ATOM 527 C ARG A 40 6.332 -5.571 15.639 1.00 2.00 C ATOM 528 O ARG A 40 7.415 -5.365 16.190 1.00 2.54 O ATOM 529 CB ARG A 40 5.547 -7.855 14.972 1.00 3.17 C ATOM 530 CG ARG A 40 6.952 -8.398 14.735 1.00 3.67 C ATOM 531 CD ARG A 40 7.350 -9.439 15.772 1.00 4.46 C ATOM 532 NE ARG A 40 7.453 -8.887 17.124 1.00 4.84 N ATOM 533 CZ ARG A 40 7.672 -9.626 18.210 1.00 5.53 C ATOM 534 NH1 ARG A 40 7.780 -10.948 18.109 1.00 5.88 N ATOM 535 NH2 ARG A 40 7.768 -9.039 19.397 1.00 6.20 N ATOM 0 H ARG A 40 3.568 -6.237 15.325 1.00 2.03 H new ATOM 0 HA ARG A 40 5.821 -7.162 16.982 1.00 2.30 H new ATOM 0 HB2 ARG A 40 4.897 -8.679 15.267 1.00 3.17 H new ATOM 0 HB3 ARG A 40 5.159 -7.464 14.032 1.00 3.17 H new ATOM 0 HG2 ARG A 40 7.006 -8.840 13.740 1.00 3.67 H new ATOM 0 HG3 ARG A 40 7.666 -7.575 14.757 1.00 3.67 H new ATOM 0 HD2 ARG A 40 6.617 -10.246 15.769 1.00 4.46 H new ATOM 0 HD3 ARG A 40 8.307 -9.877 15.490 1.00 4.46 H new ATOM 0 HE ARG A 40 7.351 -7.879 17.241 1.00 4.84 H new ATOM 0 HH11 ARG A 40 7.695 -11.398 17.198 1.00 5.88 H new ATOM 0 HH12 ARG A 40 7.948 -11.511 18.943 1.00 5.88 H new ATOM 0 HH21 ARG A 40 7.674 -8.026 19.474 1.00 6.20 H new ATOM 0 HH22 ARG A 40 7.936 -9.601 20.232 1.00 6.20 H new ATOM 549 N ALA A 41 5.807 -4.789 14.696 1.00 1.69 N ATOM 550 CA ALA A 41 6.472 -3.608 14.153 1.00 1.44 C ATOM 551 C ALA A 41 7.823 -3.944 13.531 1.00 1.34 C ATOM 552 O ALA A 41 7.915 -4.138 12.320 1.00 2.00 O ATOM 553 CB ALA A 41 6.617 -2.516 15.208 1.00 1.63 C ATOM 0 H ALA A 41 4.891 -4.963 14.282 1.00 1.69 H new ATOM 0 HA ALA A 41 5.833 -3.227 13.356 1.00 1.44 H new ATOM 0 HB1 ALA A 41 7.116 -1.651 14.770 1.00 1.63 H new ATOM 0 HB2 ALA A 41 5.630 -2.223 15.566 1.00 1.63 H new ATOM 0 HB3 ALA A 41 7.209 -2.893 16.042 1.00 1.63 H new ATOM 559 N SER A 42 8.853 -4.052 14.372 1.00 1.46 N ATOM 560 CA SER A 42 10.225 -4.163 13.904 1.00 1.66 C ATOM 561 C SER A 42 10.582 -2.947 13.058 1.00 1.61 C ATOM 562 O SER A 42 10.849 -3.054 11.862 1.00 1.90 O ATOM 563 CB SER A 42 10.440 -5.463 13.121 1.00 1.97 C ATOM 564 OG SER A 42 10.348 -6.592 13.976 1.00 2.52 O ATOM 0 H SER A 42 8.756 -4.064 15.387 1.00 1.46 H new ATOM 0 HA SER A 42 10.887 -4.194 14.769 1.00 1.66 H new ATOM 0 HB2 SER A 42 9.696 -5.541 12.328 1.00 1.97 H new ATOM 0 HB3 SER A 42 11.418 -5.445 12.640 1.00 1.97 H new ATOM 0 HG SER A 42 10.487 -7.410 13.454 1.00 2.52 H new ATOM 570 N ASP A 43 10.570 -1.787 13.704 1.00 1.58 N ATOM 571 CA ASP A 43 10.868 -0.517 13.048 1.00 1.62 C ATOM 572 C ASP A 43 12.356 -0.381 12.750 1.00 2.03 C ATOM 573 O ASP A 43 13.041 0.504 13.264 1.00 2.27 O ATOM 574 CB ASP A 43 10.387 0.651 13.917 1.00 1.71 C ATOM 575 CG ASP A 43 10.887 0.571 15.351 1.00 2.08 C ATOM 576 OD1 ASP A 43 10.442 -0.335 16.091 1.00 2.17 O ATOM 577 OD2 ASP A 43 11.716 1.414 15.754 1.00 2.52 O ATOM 0 H ASP A 43 10.354 -1.699 14.697 1.00 1.58 H new ATOM 0 HA ASP A 43 10.336 -0.495 12.097 1.00 1.62 H new ATOM 0 HB2 ASP A 43 10.722 1.589 13.473 1.00 1.71 H new ATOM 0 HB3 ASP A 43 9.297 0.670 13.919 1.00 1.71 H new ATOM 582 N TYR A 44 12.852 -1.267 11.909 1.00 2.47 N ATOM 583 CA TYR A 44 14.231 -1.209 11.473 1.00 2.99 C ATOM 584 C TYR A 44 14.293 -0.837 10.001 1.00 2.89 C ATOM 585 O TYR A 44 15.318 -0.990 9.341 1.00 3.07 O ATOM 586 CB TYR A 44 14.949 -2.525 11.766 1.00 3.71 C ATOM 587 CG TYR A 44 15.137 -2.745 13.249 1.00 4.28 C ATOM 588 CD1 TYR A 44 16.219 -2.199 13.927 1.00 4.67 C ATOM 589 CD2 TYR A 44 14.242 -3.528 13.962 1.00 4.82 C ATOM 590 CE1 TYR A 44 16.397 -2.427 15.280 1.00 5.49 C ATOM 591 CE2 TYR A 44 14.416 -3.762 15.311 1.00 5.71 C ATOM 592 CZ TYR A 44 15.474 -3.088 15.986 1.00 6.00 C ATOM 593 OH TYR A 44 15.672 -3.455 17.306 1.00 7.02 O ATOM 0 H TYR A 44 12.316 -2.039 11.513 1.00 2.47 H new ATOM 0 HA TYR A 44 14.753 -0.434 12.034 1.00 2.99 H new ATOM 0 HB2 TYR A 44 14.377 -3.352 11.346 1.00 3.71 H new ATOM 0 HB3 TYR A 44 15.921 -2.526 11.273 1.00 3.71 H new ATOM 0 HD1 TYR A 44 16.931 -1.588 13.391 1.00 4.67 H new ATOM 0 HD2 TYR A 44 13.394 -3.962 13.453 1.00 4.82 H new ATOM 0 HE1 TYR A 44 17.290 -2.068 15.770 1.00 5.49 H new ATOM 0 HE2 TYR A 44 13.765 -4.440 15.843 1.00 5.71 H new ATOM 0 HH TYR A 44 14.879 -3.926 17.637 1.00 7.02 H new ATOM 603 N GLY A 45 13.169 -0.336 9.507 1.00 2.99 N ATOM 604 CA GLY A 45 13.118 0.227 8.176 1.00 3.06 C ATOM 605 C GLY A 45 13.190 1.737 8.219 1.00 2.42 C ATOM 606 O GLY A 45 13.047 2.407 7.198 1.00 2.68 O ATOM 0 H GLY A 45 12.283 -0.311 10.012 1.00 2.99 H new ATOM 0 HA2 GLY A 45 13.944 -0.163 7.581 1.00 3.06 H new ATOM 0 HA3 GLY A 45 12.197 -0.082 7.682 1.00 3.06 H new ATOM 610 N MET A 46 13.441 2.276 9.411 1.00 1.93 N ATOM 611 CA MET A 46 13.525 3.723 9.601 1.00 1.65 C ATOM 612 C MET A 46 14.820 4.233 8.987 1.00 1.66 C ATOM 613 O MET A 46 15.021 5.434 8.808 1.00 2.25 O ATOM 614 CB MET A 46 13.479 4.092 11.092 1.00 1.79 C ATOM 615 CG MET A 46 12.446 3.314 11.892 1.00 1.56 C ATOM 616 SD MET A 46 10.762 3.540 11.293 1.00 2.17 S ATOM 617 CE MET A 46 10.333 5.103 12.048 1.00 2.35 C ATOM 0 H MET A 46 13.590 1.732 10.261 1.00 1.93 H new ATOM 0 HA MET A 46 12.669 4.187 9.112 1.00 1.65 H new ATOM 0 HB2 MET A 46 14.464 3.922 11.528 1.00 1.79 H new ATOM 0 HB3 MET A 46 13.268 5.157 11.185 1.00 1.79 H new ATOM 0 HG2 MET A 46 12.696 2.254 11.861 1.00 1.56 H new ATOM 0 HG3 MET A 46 12.497 3.623 12.936 1.00 1.56 H new ATOM 0 HE1 MET A 46 9.320 5.049 12.447 1.00 2.35 H new ATOM 0 HE2 MET A 46 11.030 5.320 12.857 1.00 2.35 H new ATOM 0 HE3 MET A 46 10.387 5.895 11.301 1.00 2.35 H new ATOM 627 N LYS A 47 15.693 3.290 8.666 1.00 1.57 N ATOM 628 CA LYS A 47 16.956 3.582 8.011 1.00 1.68 C ATOM 629 C LYS A 47 16.767 3.709 6.503 1.00 1.61 C ATOM 630 O LYS A 47 17.723 3.955 5.764 1.00 2.34 O ATOM 631 CB LYS A 47 17.960 2.474 8.325 1.00 2.02 C ATOM 632 CG LYS A 47 17.430 1.085 8.002 1.00 2.44 C ATOM 633 CD LYS A 47 18.465 0.003 8.253 1.00 3.01 C ATOM 634 CE LYS A 47 19.611 0.086 7.260 1.00 3.44 C ATOM 635 NZ LYS A 47 20.549 -1.058 7.396 1.00 4.25 N ATOM 0 H LYS A 47 15.544 2.299 8.854 1.00 1.57 H new ATOM 0 HA LYS A 47 17.335 4.533 8.386 1.00 1.68 H new ATOM 0 HB2 LYS A 47 18.875 2.649 7.759 1.00 2.02 H new ATOM 0 HB3 LYS A 47 18.225 2.520 9.381 1.00 2.02 H new ATOM 0 HG2 LYS A 47 16.545 0.886 8.607 1.00 2.44 H new ATOM 0 HG3 LYS A 47 17.117 1.051 6.958 1.00 2.44 H new ATOM 0 HD2 LYS A 47 18.854 0.098 9.267 1.00 3.01 H new ATOM 0 HD3 LYS A 47 17.992 -0.977 8.183 1.00 3.01 H new ATOM 0 HE2 LYS A 47 19.211 0.109 6.246 1.00 3.44 H new ATOM 0 HE3 LYS A 47 20.154 1.019 7.410 1.00 3.44 H new ATOM 0 HZ1 LYS A 47 21.316 -0.963 6.700 1.00 4.25 H new ATOM 0 HZ2 LYS A 47 20.951 -1.065 8.355 1.00 4.25 H new ATOM 0 HZ3 LYS A 47 20.038 -1.948 7.228 1.00 4.25 H new ATOM 649 N LEU A 48 15.531 3.524 6.054 1.00 1.41 N ATOM 650 CA LEU A 48 15.181 3.701 4.652 1.00 1.31 C ATOM 651 C LEU A 48 14.157 4.824 4.516 1.00 1.01 C ATOM 652 O LEU A 48 12.957 4.575 4.426 1.00 1.02 O ATOM 653 CB LEU A 48 14.618 2.401 4.068 1.00 1.59 C ATOM 654 CG LEU A 48 15.589 1.219 4.032 1.00 2.10 C ATOM 655 CD1 LEU A 48 14.881 -0.030 3.538 1.00 2.56 C ATOM 656 CD2 LEU A 48 16.788 1.534 3.150 1.00 2.55 C ATOM 0 H LEU A 48 14.749 3.249 6.648 1.00 1.41 H new ATOM 0 HA LEU A 48 16.081 3.965 4.096 1.00 1.31 H new ATOM 0 HB2 LEU A 48 13.742 2.112 4.649 1.00 1.59 H new ATOM 0 HB3 LEU A 48 14.275 2.598 3.052 1.00 1.59 H new ATOM 0 HG LEU A 48 15.948 1.039 5.045 1.00 2.10 H new ATOM 0 HD11 LEU A 48 15.584 -0.863 3.518 1.00 2.56 H new ATOM 0 HD12 LEU A 48 14.055 -0.269 4.208 1.00 2.56 H new ATOM 0 HD13 LEU A 48 14.495 0.144 2.534 1.00 2.56 H new ATOM 0 HD21 LEU A 48 17.466 0.680 3.139 1.00 2.55 H new ATOM 0 HD22 LEU A 48 16.449 1.742 2.135 1.00 2.55 H new ATOM 0 HD23 LEU A 48 17.310 2.406 3.544 1.00 2.55 H new ATOM 668 N PRO A 49 14.615 6.083 4.547 1.00 1.03 N ATOM 669 CA PRO A 49 13.734 7.246 4.433 1.00 1.05 C ATOM 670 C PRO A 49 13.150 7.393 3.032 1.00 0.81 C ATOM 671 O PRO A 49 13.881 7.377 2.042 1.00 0.91 O ATOM 672 CB PRO A 49 14.647 8.443 4.744 1.00 1.47 C ATOM 673 CG PRO A 49 15.918 7.862 5.269 1.00 1.69 C ATOM 674 CD PRO A 49 16.020 6.478 4.704 1.00 1.37 C ATOM 0 HA PRO A 49 12.879 7.162 5.104 1.00 1.05 H new ATOM 0 HB2 PRO A 49 14.830 9.038 3.849 1.00 1.47 H new ATOM 0 HB3 PRO A 49 14.187 9.105 5.478 1.00 1.47 H new ATOM 0 HG2 PRO A 49 16.774 8.467 4.969 1.00 1.69 H new ATOM 0 HG3 PRO A 49 15.912 7.836 6.359 1.00 1.69 H new ATOM 0 HD2 PRO A 49 16.551 6.468 3.752 1.00 1.37 H new ATOM 0 HD3 PRO A 49 16.556 5.806 5.375 1.00 1.37 H new ATOM 682 N ILE A 50 11.833 7.529 2.949 1.00 0.66 N ATOM 683 CA ILE A 50 11.193 7.781 1.671 1.00 0.48 C ATOM 684 C ILE A 50 11.290 9.268 1.327 1.00 0.70 C ATOM 685 O ILE A 50 10.647 10.118 1.945 1.00 1.59 O ATOM 686 CB ILE A 50 9.725 7.266 1.633 1.00 0.38 C ATOM 687 CG1 ILE A 50 9.699 5.812 1.179 1.00 0.42 C ATOM 688 CG2 ILE A 50 8.872 8.085 0.679 1.00 0.42 C ATOM 689 CD1 ILE A 50 10.343 4.850 2.140 1.00 0.51 C ATOM 0 H ILE A 50 11.196 7.469 3.743 1.00 0.66 H new ATOM 0 HA ILE A 50 11.725 7.214 0.906 1.00 0.48 H new ATOM 0 HB ILE A 50 9.318 7.360 2.640 1.00 0.38 H new ATOM 0 HG12 ILE A 50 8.663 5.511 1.022 1.00 0.42 H new ATOM 0 HG13 ILE A 50 10.202 5.736 0.215 1.00 0.42 H new ATOM 0 HG21 ILE A 50 7.853 7.697 0.678 1.00 0.42 H new ATOM 0 HG22 ILE A 50 8.864 9.126 1.001 1.00 0.42 H new ATOM 0 HG23 ILE A 50 9.286 8.020 -0.327 1.00 0.42 H new ATOM 0 HD11 ILE A 50 10.280 3.838 1.739 1.00 0.51 H new ATOM 0 HD12 ILE A 50 11.390 5.121 2.279 1.00 0.51 H new ATOM 0 HD13 ILE A 50 9.826 4.893 3.099 1.00 0.51 H new ATOM 701 N LEU A 51 12.131 9.560 0.339 1.00 0.60 N ATOM 702 CA LEU A 51 12.464 10.933 -0.041 1.00 0.60 C ATOM 703 C LEU A 51 11.272 11.701 -0.600 1.00 0.62 C ATOM 704 O LEU A 51 11.293 12.930 -0.657 1.00 0.90 O ATOM 705 CB LEU A 51 13.591 10.936 -1.083 1.00 0.66 C ATOM 706 CG LEU A 51 15.015 10.680 -0.559 1.00 0.92 C ATOM 707 CD1 LEU A 51 15.346 11.600 0.606 1.00 1.51 C ATOM 708 CD2 LEU A 51 15.198 9.221 -0.164 1.00 1.91 C ATOM 0 H LEU A 51 12.603 8.851 -0.223 1.00 0.60 H new ATOM 0 HA LEU A 51 12.784 11.436 0.872 1.00 0.60 H new ATOM 0 HB2 LEU A 51 13.363 10.179 -1.833 1.00 0.66 H new ATOM 0 HB3 LEU A 51 13.583 11.901 -1.591 1.00 0.66 H new ATOM 0 HG LEU A 51 15.710 10.901 -1.369 1.00 0.92 H new ATOM 0 HD11 LEU A 51 16.358 11.396 0.955 1.00 1.51 H new ATOM 0 HD12 LEU A 51 15.277 12.638 0.281 1.00 1.51 H new ATOM 0 HD13 LEU A 51 14.640 11.426 1.418 1.00 1.51 H new ATOM 0 HD21 LEU A 51 16.213 9.068 0.203 1.00 1.91 H new ATOM 0 HD22 LEU A 51 14.486 8.964 0.621 1.00 1.91 H new ATOM 0 HD23 LEU A 51 15.026 8.585 -1.032 1.00 1.91 H new ATOM 720 N ARG A 52 10.239 10.993 -1.022 1.00 0.56 N ATOM 721 CA ARG A 52 9.107 11.647 -1.657 1.00 0.60 C ATOM 722 C ARG A 52 8.020 12.015 -0.649 1.00 0.59 C ATOM 723 O ARG A 52 7.078 12.734 -0.981 1.00 0.83 O ATOM 724 CB ARG A 52 8.510 10.766 -2.751 1.00 0.70 C ATOM 725 CG ARG A 52 8.966 11.109 -4.164 1.00 0.93 C ATOM 726 CD ARG A 52 10.466 10.946 -4.343 1.00 1.14 C ATOM 727 NE ARG A 52 10.788 10.343 -5.633 1.00 1.80 N ATOM 728 CZ ARG A 52 11.991 10.371 -6.207 1.00 2.47 C ATOM 729 NH1 ARG A 52 12.989 11.053 -5.652 1.00 2.72 N ATOM 730 NH2 ARG A 52 12.191 9.723 -7.347 1.00 3.17 N ATOM 0 H ARG A 52 10.160 9.980 -0.939 1.00 0.56 H new ATOM 0 HA ARG A 52 9.486 12.567 -2.102 1.00 0.60 H new ATOM 0 HB2 ARG A 52 8.767 9.727 -2.543 1.00 0.70 H new ATOM 0 HB3 ARG A 52 7.423 10.841 -2.706 1.00 0.70 H new ATOM 0 HG2 ARG A 52 8.446 10.469 -4.876 1.00 0.93 H new ATOM 0 HG3 ARG A 52 8.685 12.137 -4.395 1.00 0.93 H new ATOM 0 HD2 ARG A 52 10.951 11.919 -4.264 1.00 1.14 H new ATOM 0 HD3 ARG A 52 10.864 10.325 -3.540 1.00 1.14 H new ATOM 0 HE ARG A 52 10.037 9.865 -6.132 1.00 1.80 H new ATOM 0 HH11 ARG A 52 12.837 11.560 -4.780 1.00 2.72 H new ATOM 0 HH12 ARG A 52 13.906 11.069 -6.098 1.00 2.72 H new ATOM 0 HH21 ARG A 52 11.426 9.206 -7.781 1.00 3.17 H new ATOM 0 HH22 ARG A 52 13.110 9.742 -7.790 1.00 3.17 H new ATOM 744 N SER A 53 8.149 11.529 0.575 1.00 0.49 N ATOM 745 CA SER A 53 7.106 11.690 1.559 1.00 0.47 C ATOM 746 C SER A 53 7.494 12.682 2.662 1.00 0.46 C ATOM 747 O SER A 53 8.672 12.977 2.872 1.00 0.54 O ATOM 748 CB SER A 53 6.766 10.313 2.121 1.00 0.47 C ATOM 749 OG SER A 53 6.135 9.526 1.128 1.00 0.97 O ATOM 0 H SER A 53 8.969 11.020 0.905 1.00 0.49 H new ATOM 0 HA SER A 53 6.224 12.120 1.084 1.00 0.47 H new ATOM 0 HB2 SER A 53 7.674 9.818 2.466 1.00 0.47 H new ATOM 0 HB3 SER A 53 6.110 10.416 2.986 1.00 0.47 H new ATOM 0 HG SER A 53 5.401 10.035 0.724 1.00 0.97 H new ATOM 755 N ASN A 54 6.475 13.194 3.352 1.00 0.46 N ATOM 756 CA ASN A 54 6.635 14.211 4.394 1.00 0.48 C ATOM 757 C ASN A 54 6.817 13.523 5.746 1.00 0.44 C ATOM 758 O ASN A 54 6.176 12.522 5.992 1.00 0.42 O ATOM 759 CB ASN A 54 5.399 15.135 4.370 1.00 0.60 C ATOM 760 CG ASN A 54 5.031 15.737 5.716 1.00 0.92 C ATOM 761 OD1 ASN A 54 5.529 16.798 6.098 1.00 1.92 O ATOM 762 ND2 ASN A 54 4.112 15.084 6.414 1.00 0.75 N ATOM 0 H ASN A 54 5.506 12.913 3.203 1.00 0.46 H new ATOM 0 HA ASN A 54 7.520 14.822 4.217 1.00 0.48 H new ATOM 0 HB2 ASN A 54 5.581 15.944 3.663 1.00 0.60 H new ATOM 0 HB3 ASN A 54 4.546 14.569 3.995 1.00 0.60 H new ATOM 0 HD21 ASN A 54 3.789 15.457 7.307 1.00 0.75 H new ATOM 0 HD22 ASN A 54 3.728 14.209 6.058 1.00 0.75 H new ATOM 769 N PRO A 55 7.663 14.069 6.647 1.00 0.47 N ATOM 770 CA PRO A 55 8.175 13.357 7.837 1.00 0.49 C ATOM 771 C PRO A 55 7.176 12.418 8.539 1.00 0.45 C ATOM 772 O PRO A 55 7.504 11.250 8.796 1.00 0.46 O ATOM 773 CB PRO A 55 8.545 14.510 8.761 1.00 0.57 C ATOM 774 CG PRO A 55 9.008 15.589 7.844 1.00 0.70 C ATOM 775 CD PRO A 55 8.220 15.436 6.566 1.00 0.53 C ATOM 0 HA PRO A 55 8.984 12.681 7.560 1.00 0.49 H new ATOM 0 HB2 PRO A 55 7.690 14.833 9.354 1.00 0.57 H new ATOM 0 HB3 PRO A 55 9.328 14.221 9.462 1.00 0.57 H new ATOM 0 HG2 PRO A 55 8.842 16.571 8.286 1.00 0.70 H new ATOM 0 HG3 PRO A 55 10.078 15.502 7.653 1.00 0.70 H new ATOM 0 HD2 PRO A 55 7.431 16.184 6.492 1.00 0.53 H new ATOM 0 HD3 PRO A 55 8.856 15.556 5.689 1.00 0.53 H new ATOM 783 N GLU A 56 5.963 12.892 8.819 1.00 0.47 N ATOM 784 CA GLU A 56 4.980 12.063 9.510 1.00 0.49 C ATOM 785 C GLU A 56 4.616 10.876 8.644 1.00 0.40 C ATOM 786 O GLU A 56 4.743 9.704 9.033 1.00 0.39 O ATOM 787 CB GLU A 56 3.706 12.864 9.801 1.00 0.62 C ATOM 788 CG GLU A 56 3.819 13.814 10.974 1.00 0.78 C ATOM 789 CD GLU A 56 4.051 13.085 12.277 1.00 1.73 C ATOM 790 OE1 GLU A 56 3.070 12.577 12.858 1.00 2.71 O ATOM 791 OE2 GLU A 56 5.211 13.009 12.727 1.00 2.02 O ATOM 0 H GLU A 56 5.642 13.831 8.582 1.00 0.47 H new ATOM 0 HA GLU A 56 5.418 11.726 10.450 1.00 0.49 H new ATOM 0 HB2 GLU A 56 3.439 13.435 8.911 1.00 0.62 H new ATOM 0 HB3 GLU A 56 2.889 12.168 9.990 1.00 0.62 H new ATOM 0 HG2 GLU A 56 4.639 14.510 10.798 1.00 0.78 H new ATOM 0 HG3 GLU A 56 2.908 14.407 11.048 1.00 0.78 H new ATOM 798 N ASP A 57 4.202 11.187 7.441 1.00 0.40 N ATOM 799 CA ASP A 57 3.738 10.181 6.529 1.00 0.38 C ATOM 800 C ASP A 57 4.913 9.438 5.909 1.00 0.35 C ATOM 801 O ASP A 57 4.747 8.358 5.372 1.00 0.38 O ATOM 802 CB ASP A 57 2.825 10.798 5.472 1.00 0.47 C ATOM 803 CG ASP A 57 3.473 11.893 4.652 1.00 0.92 C ATOM 804 OD1 ASP A 57 4.209 11.585 3.693 1.00 1.36 O ATOM 805 OD2 ASP A 57 3.227 13.076 4.957 1.00 1.63 O ATOM 0 H ASP A 57 4.178 12.138 7.072 1.00 0.40 H new ATOM 0 HA ASP A 57 3.148 9.449 7.080 1.00 0.38 H new ATOM 0 HB2 ASP A 57 2.483 10.011 4.800 1.00 0.47 H new ATOM 0 HB3 ASP A 57 1.941 11.203 5.964 1.00 0.47 H new ATOM 810 N GLN A 58 6.106 10.008 6.026 1.00 0.34 N ATOM 811 CA GLN A 58 7.324 9.329 5.627 1.00 0.36 C ATOM 812 C GLN A 58 7.456 8.031 6.396 1.00 0.34 C ATOM 813 O GLN A 58 7.649 6.991 5.801 1.00 0.35 O ATOM 814 CB GLN A 58 8.550 10.214 5.862 1.00 0.42 C ATOM 815 CG GLN A 58 9.859 9.574 5.423 1.00 0.51 C ATOM 816 CD GLN A 58 11.066 10.456 5.689 1.00 0.89 C ATOM 817 OE1 GLN A 58 12.047 10.421 4.949 1.00 1.52 O ATOM 818 NE2 GLN A 58 11.014 11.232 6.760 1.00 1.58 N ATOM 0 H GLN A 58 6.252 10.947 6.398 1.00 0.34 H new ATOM 0 HA GLN A 58 7.269 9.113 4.560 1.00 0.36 H new ATOM 0 HB2 GLN A 58 8.417 11.154 5.326 1.00 0.42 H new ATOM 0 HB3 GLN A 58 8.613 10.458 6.922 1.00 0.42 H new ATOM 0 HG2 GLN A 58 9.987 8.625 5.944 1.00 0.51 H new ATOM 0 HG3 GLN A 58 9.808 9.348 4.358 1.00 0.51 H new ATOM 0 HE21 GLN A 58 10.181 11.233 7.349 1.00 1.58 H new ATOM 0 HE22 GLN A 58 11.806 11.829 6.996 1.00 1.58 H new ATOM 827 N VAL A 59 7.320 8.093 7.719 1.00 0.35 N ATOM 828 CA VAL A 59 7.283 6.876 8.536 1.00 0.37 C ATOM 829 C VAL A 59 6.189 5.952 8.035 1.00 0.32 C ATOM 830 O VAL A 59 6.406 4.760 7.814 1.00 0.37 O ATOM 831 CB VAL A 59 7.005 7.168 10.022 1.00 0.45 C ATOM 832 CG1 VAL A 59 6.888 5.872 10.805 1.00 1.08 C ATOM 833 CG2 VAL A 59 8.086 8.045 10.607 1.00 1.27 C ATOM 0 H VAL A 59 7.234 8.962 8.246 1.00 0.35 H new ATOM 0 HA VAL A 59 8.267 6.415 8.449 1.00 0.37 H new ATOM 0 HB VAL A 59 6.058 7.702 10.094 1.00 0.45 H new ATOM 0 HG11 VAL A 59 6.692 6.097 11.853 1.00 1.08 H new ATOM 0 HG12 VAL A 59 6.069 5.276 10.402 1.00 1.08 H new ATOM 0 HG13 VAL A 59 7.819 5.312 10.722 1.00 1.08 H new ATOM 0 HG21 VAL A 59 7.869 8.238 11.658 1.00 1.27 H new ATOM 0 HG22 VAL A 59 9.049 7.541 10.522 1.00 1.27 H new ATOM 0 HG23 VAL A 59 8.122 8.990 10.064 1.00 1.27 H new ATOM 843 N LEU A 60 5.019 6.536 7.832 1.00 0.30 N ATOM 844 CA LEU A 60 3.867 5.809 7.313 1.00 0.31 C ATOM 845 C LEU A 60 4.181 5.151 5.969 1.00 0.33 C ATOM 846 O LEU A 60 3.505 4.219 5.545 1.00 0.41 O ATOM 847 CB LEU A 60 2.693 6.771 7.151 1.00 0.34 C ATOM 848 CG LEU A 60 1.481 6.195 6.433 1.00 0.56 C ATOM 849 CD1 LEU A 60 0.931 5.030 7.202 1.00 1.12 C ATOM 850 CD2 LEU A 60 0.413 7.244 6.263 1.00 1.18 C ATOM 0 H LEU A 60 4.839 7.522 8.021 1.00 0.30 H new ATOM 0 HA LEU A 60 3.612 5.022 8.022 1.00 0.31 H new ATOM 0 HB2 LEU A 60 2.383 7.111 8.139 1.00 0.34 H new ATOM 0 HB3 LEU A 60 3.036 7.650 6.605 1.00 0.34 H new ATOM 0 HG LEU A 60 1.797 5.857 5.446 1.00 0.56 H new ATOM 0 HD11 LEU A 60 0.064 4.626 6.679 1.00 1.12 H new ATOM 0 HD12 LEU A 60 1.695 4.258 7.289 1.00 1.12 H new ATOM 0 HD13 LEU A 60 0.633 5.359 8.198 1.00 1.12 H new ATOM 0 HD21 LEU A 60 -0.444 6.811 5.747 1.00 1.18 H new ATOM 0 HD22 LEU A 60 0.101 7.608 7.242 1.00 1.18 H new ATOM 0 HD23 LEU A 60 0.808 8.073 5.676 1.00 1.18 H new ATOM 862 N TYR A 61 5.215 5.635 5.316 1.00 0.35 N ATOM 863 CA TYR A 61 5.548 5.202 3.975 1.00 0.40 C ATOM 864 C TYR A 61 6.953 4.593 3.908 1.00 0.45 C ATOM 865 O TYR A 61 7.421 4.250 2.833 1.00 0.56 O ATOM 866 CB TYR A 61 5.449 6.381 2.990 1.00 0.42 C ATOM 867 CG TYR A 61 4.059 7.001 2.851 1.00 0.47 C ATOM 868 CD1 TYR A 61 2.920 6.248 3.100 1.00 0.59 C ATOM 869 CD2 TYR A 61 3.883 8.328 2.484 1.00 0.82 C ATOM 870 CE1 TYR A 61 1.655 6.791 2.989 1.00 0.64 C ATOM 871 CE2 TYR A 61 2.620 8.882 2.369 1.00 0.99 C ATOM 872 CZ TYR A 61 1.535 8.157 2.574 1.00 0.78 C ATOM 873 OH TYR A 61 0.247 8.650 2.517 1.00 0.96 O ATOM 0 H TYR A 61 5.848 6.338 5.698 1.00 0.35 H new ATOM 0 HA TYR A 61 4.830 4.431 3.695 1.00 0.40 H new ATOM 0 HB2 TYR A 61 6.145 7.157 3.307 1.00 0.42 H new ATOM 0 HB3 TYR A 61 5.777 6.041 2.008 1.00 0.42 H new ATOM 0 HD1 TYR A 61 3.025 5.212 3.388 1.00 0.59 H new ATOM 0 HD2 TYR A 61 4.750 8.941 2.284 1.00 0.82 H new ATOM 0 HE1 TYR A 61 0.778 6.201 3.210 1.00 0.64 H new ATOM 0 HE2 TYR A 61 2.520 9.925 2.107 1.00 0.99 H new ATOM 0 HH TYR A 61 0.267 9.586 2.226 1.00 0.96 H new ATOM 883 N GLN A 62 7.621 4.437 5.043 1.00 0.43 N ATOM 884 CA GLN A 62 9.037 4.047 5.034 1.00 0.58 C ATOM 885 C GLN A 62 9.285 2.746 5.777 1.00 0.73 C ATOM 886 O GLN A 62 10.114 1.935 5.376 1.00 1.49 O ATOM 887 CB GLN A 62 9.882 5.172 5.644 1.00 0.63 C ATOM 888 CG GLN A 62 10.509 4.848 6.989 1.00 0.99 C ATOM 889 CD GLN A 62 11.272 6.016 7.567 1.00 1.18 C ATOM 890 OE1 GLN A 62 10.720 6.835 8.300 1.00 1.97 O ATOM 891 NE2 GLN A 62 12.546 6.108 7.231 1.00 1.13 N ATOM 0 H GLN A 62 7.219 4.570 5.971 1.00 0.43 H new ATOM 0 HA GLN A 62 9.327 3.882 3.996 1.00 0.58 H new ATOM 0 HB2 GLN A 62 10.676 5.430 4.943 1.00 0.63 H new ATOM 0 HB3 GLN A 62 9.255 6.057 5.756 1.00 0.63 H new ATOM 0 HG2 GLN A 62 9.728 4.547 7.687 1.00 0.99 H new ATOM 0 HG3 GLN A 62 11.182 3.998 6.877 1.00 0.99 H new ATOM 0 HE21 GLN A 62 12.964 5.406 6.620 1.00 1.13 H new ATOM 0 HE22 GLN A 62 13.112 6.881 7.582 1.00 1.13 H new ATOM 900 N THR A 63 8.579 2.576 6.865 1.00 0.44 N ATOM 901 CA THR A 63 8.776 1.430 7.735 1.00 0.48 C ATOM 902 C THR A 63 8.337 0.134 7.027 1.00 0.61 C ATOM 903 O THR A 63 7.321 0.131 6.327 1.00 1.27 O ATOM 904 CB THR A 63 8.002 1.668 9.035 1.00 0.50 C ATOM 905 OG1 THR A 63 7.902 3.077 9.268 1.00 0.89 O ATOM 906 CG2 THR A 63 8.712 1.034 10.213 1.00 0.89 C ATOM 0 H THR A 63 7.853 3.221 7.178 1.00 0.44 H new ATOM 0 HA THR A 63 9.833 1.312 7.974 1.00 0.48 H new ATOM 0 HB THR A 63 7.014 1.220 8.935 1.00 0.50 H new ATOM 0 HG1 THR A 63 7.097 3.425 8.830 1.00 0.89 H new ATOM 0 HG21 THR A 63 8.142 1.218 11.123 1.00 0.89 H new ATOM 0 HG22 THR A 63 8.799 -0.040 10.050 1.00 0.89 H new ATOM 0 HG23 THR A 63 9.707 1.468 10.314 1.00 0.89 H new ATOM 914 N GLU A 64 9.106 -0.959 7.195 1.00 0.53 N ATOM 915 CA GLU A 64 8.938 -2.151 6.344 1.00 0.53 C ATOM 916 C GLU A 64 8.641 -3.462 7.098 1.00 0.58 C ATOM 917 O GLU A 64 8.422 -4.496 6.462 1.00 0.99 O ATOM 918 CB GLU A 64 10.173 -2.330 5.451 1.00 0.67 C ATOM 919 CG GLU A 64 11.504 -2.012 6.120 1.00 1.00 C ATOM 920 CD GLU A 64 11.893 -3.004 7.194 1.00 1.42 C ATOM 921 OE1 GLU A 64 12.526 -4.024 6.858 1.00 1.78 O ATOM 922 OE2 GLU A 64 11.551 -2.769 8.374 1.00 1.96 O ATOM 0 H GLU A 64 9.838 -1.041 7.900 1.00 0.53 H new ATOM 0 HA GLU A 64 8.046 -1.956 5.749 1.00 0.53 H new ATOM 0 HB2 GLU A 64 10.199 -3.360 5.096 1.00 0.67 H new ATOM 0 HB3 GLU A 64 10.063 -1.693 4.573 1.00 0.67 H new ATOM 0 HG2 GLU A 64 12.286 -1.986 5.361 1.00 1.00 H new ATOM 0 HG3 GLU A 64 11.452 -1.016 6.559 1.00 1.00 H new ATOM 929 N ARG A 65 8.643 -3.428 8.428 1.00 0.85 N ATOM 930 CA ARG A 65 8.308 -4.605 9.248 1.00 0.96 C ATOM 931 C ARG A 65 9.390 -5.675 9.187 1.00 1.17 C ATOM 932 O ARG A 65 10.268 -5.748 10.046 1.00 2.02 O ATOM 933 CB ARG A 65 6.978 -5.261 8.826 1.00 0.96 C ATOM 934 CG ARG A 65 5.790 -4.964 9.723 1.00 1.17 C ATOM 935 CD ARG A 65 4.670 -5.993 9.530 1.00 1.09 C ATOM 936 NE ARG A 65 4.996 -7.278 10.148 1.00 1.70 N ATOM 937 CZ ARG A 65 5.565 -8.309 9.523 1.00 2.50 C ATOM 938 NH1 ARG A 65 5.905 -8.214 8.241 1.00 2.93 N ATOM 939 NH2 ARG A 65 5.807 -9.431 10.189 1.00 3.35 N ATOM 0 H ARG A 65 8.874 -2.596 8.970 1.00 0.85 H new ATOM 0 HA ARG A 65 8.220 -4.221 10.264 1.00 0.96 H new ATOM 0 HB2 ARG A 65 6.737 -4.936 7.814 1.00 0.96 H new ATOM 0 HB3 ARG A 65 7.121 -6.341 8.788 1.00 0.96 H new ATOM 0 HG2 ARG A 65 6.110 -4.964 10.765 1.00 1.17 H new ATOM 0 HG3 ARG A 65 5.410 -3.966 9.507 1.00 1.17 H new ATOM 0 HD2 ARG A 65 3.745 -5.608 9.960 1.00 1.09 H new ATOM 0 HD3 ARG A 65 4.490 -6.138 8.465 1.00 1.09 H new ATOM 0 HE ARG A 65 4.770 -7.395 11.136 1.00 1.70 H new ATOM 0 HH11 ARG A 65 5.731 -7.349 7.730 1.00 2.93 H new ATOM 0 HH12 ARG A 65 6.340 -9.007 7.769 1.00 2.93 H new ATOM 0 HH21 ARG A 65 5.558 -9.502 11.176 1.00 3.35 H new ATOM 0 HH22 ARG A 65 6.242 -10.222 9.714 1.00 3.35 H new ATOM 953 N TYR A 66 9.322 -6.489 8.139 1.00 1.04 N ATOM 954 CA TYR A 66 10.073 -7.730 8.067 1.00 1.21 C ATOM 955 C TYR A 66 9.687 -8.466 6.790 1.00 1.23 C ATOM 956 O TYR A 66 8.534 -8.882 6.643 1.00 1.84 O ATOM 957 CB TYR A 66 9.725 -8.592 9.291 1.00 1.67 C ATOM 958 CG TYR A 66 10.657 -9.754 9.564 1.00 2.01 C ATOM 959 CD1 TYR A 66 10.415 -11.001 8.999 1.00 2.73 C ATOM 960 CD2 TYR A 66 11.795 -9.598 10.346 1.00 2.29 C ATOM 961 CE1 TYR A 66 11.281 -12.058 9.204 1.00 3.58 C ATOM 962 CE2 TYR A 66 12.663 -10.652 10.563 1.00 3.11 C ATOM 963 CZ TYR A 66 12.334 -11.897 10.144 1.00 3.72 C ATOM 964 OH TYR A 66 13.273 -12.929 10.179 1.00 4.71 O ATOM 0 H TYR A 66 8.745 -6.304 7.319 1.00 1.04 H new ATOM 0 HA TYR A 66 11.144 -7.527 8.059 1.00 1.21 H new ATOM 0 HB2 TYR A 66 9.708 -7.950 10.171 1.00 1.67 H new ATOM 0 HB3 TYR A 66 8.716 -8.983 9.162 1.00 1.67 H new ATOM 0 HD1 TYR A 66 9.535 -11.146 8.390 1.00 2.73 H new ATOM 0 HD2 TYR A 66 12.005 -8.637 10.792 1.00 2.29 H new ATOM 0 HE1 TYR A 66 11.160 -12.985 8.662 1.00 3.58 H new ATOM 0 HE2 TYR A 66 13.603 -10.482 11.067 1.00 3.11 H new ATOM 0 HH TYR A 66 13.955 -12.728 10.853 1.00 4.71 H new ATOM 974 N ASN A 67 10.627 -8.610 5.860 1.00 1.36 N ATOM 975 CA ASN A 67 10.344 -9.307 4.607 1.00 1.73 C ATOM 976 C ASN A 67 10.037 -10.770 4.909 1.00 1.33 C ATOM 977 O ASN A 67 10.720 -11.406 5.714 1.00 1.73 O ATOM 978 CB ASN A 67 11.511 -9.171 3.611 1.00 2.80 C ATOM 979 CG ASN A 67 12.724 -10.009 3.969 1.00 3.74 C ATOM 980 OD1 ASN A 67 13.541 -9.617 4.802 1.00 4.33 O ATOM 981 ND2 ASN A 67 12.871 -11.149 3.307 1.00 4.38 N ATOM 0 H ASN A 67 11.581 -8.258 5.947 1.00 1.36 H new ATOM 0 HA ASN A 67 9.475 -8.850 4.133 1.00 1.73 H new ATOM 0 HB2 ASN A 67 11.164 -9.457 2.618 1.00 2.80 H new ATOM 0 HB3 ASN A 67 11.808 -8.124 3.555 1.00 2.80 H new ATOM 0 HD21 ASN A 67 13.685 -11.738 3.480 1.00 4.38 H new ATOM 0 HD22 ASN A 67 12.170 -11.437 2.625 1.00 4.38 H new ATOM 988 N GLU A 68 8.998 -11.297 4.286 1.00 1.25 N ATOM 989 CA GLU A 68 8.476 -12.596 4.681 1.00 1.47 C ATOM 990 C GLU A 68 8.016 -13.408 3.475 1.00 1.24 C ATOM 991 O GLU A 68 8.707 -14.322 3.025 1.00 1.43 O ATOM 992 CB GLU A 68 7.303 -12.395 5.654 1.00 2.17 C ATOM 993 CG GLU A 68 6.727 -13.684 6.222 1.00 2.67 C ATOM 994 CD GLU A 68 7.642 -14.343 7.229 1.00 3.24 C ATOM 995 OE1 GLU A 68 8.600 -15.024 6.807 1.00 3.64 O ATOM 996 OE2 GLU A 68 7.414 -14.178 8.445 1.00 3.70 O ATOM 0 H GLU A 68 8.503 -10.853 3.513 1.00 1.25 H new ATOM 0 HA GLU A 68 9.276 -13.153 5.168 1.00 1.47 H new ATOM 0 HB2 GLU A 68 7.636 -11.766 6.479 1.00 2.17 H new ATOM 0 HB3 GLU A 68 6.510 -11.853 5.140 1.00 2.17 H new ATOM 0 HG2 GLU A 68 5.768 -13.470 6.695 1.00 2.67 H new ATOM 0 HG3 GLU A 68 6.532 -14.380 5.406 1.00 2.67 H new ATOM 1003 N ASP A 69 6.854 -13.050 2.960 1.00 1.13 N ATOM 1004 CA ASP A 69 6.186 -13.816 1.920 1.00 0.98 C ATOM 1005 C ASP A 69 5.013 -12.988 1.428 1.00 0.97 C ATOM 1006 O ASP A 69 5.005 -11.781 1.658 1.00 1.66 O ATOM 1007 CB ASP A 69 5.718 -15.170 2.473 1.00 1.44 C ATOM 1008 CG ASP A 69 5.367 -16.173 1.390 1.00 1.51 C ATOM 1009 OD1 ASP A 69 6.271 -16.900 0.925 1.00 2.20 O ATOM 1010 OD2 ASP A 69 4.185 -16.246 1.004 1.00 1.63 O ATOM 0 H ASP A 69 6.344 -12.216 3.252 1.00 1.13 H new ATOM 0 HA ASP A 69 6.866 -14.026 1.094 1.00 0.98 H new ATOM 0 HB2 ASP A 69 6.503 -15.587 3.104 1.00 1.44 H new ATOM 0 HB3 ASP A 69 4.847 -15.013 3.109 1.00 1.44 H new ATOM 1015 N SER A 70 4.055 -13.603 0.744 1.00 0.78 N ATOM 1016 CA SER A 70 2.853 -12.905 0.305 1.00 0.76 C ATOM 1017 C SER A 70 2.254 -12.123 1.471 1.00 0.82 C ATOM 1018 O SER A 70 1.656 -12.698 2.382 1.00 1.01 O ATOM 1019 CB SER A 70 1.829 -13.906 -0.248 1.00 0.96 C ATOM 1020 OG SER A 70 0.702 -13.240 -0.794 1.00 1.41 O ATOM 0 H SER A 70 4.088 -14.588 0.481 1.00 0.78 H new ATOM 0 HA SER A 70 3.118 -12.208 -0.490 1.00 0.76 H new ATOM 0 HB2 SER A 70 2.297 -14.522 -1.015 1.00 0.96 H new ATOM 0 HB3 SER A 70 1.507 -14.578 0.548 1.00 0.96 H new ATOM 0 HG SER A 70 0.067 -13.901 -1.140 1.00 1.41 H new ATOM 1026 N PHE A 71 2.446 -10.813 1.446 1.00 0.78 N ATOM 1027 CA PHE A 71 1.976 -9.954 2.509 1.00 0.94 C ATOM 1028 C PHE A 71 0.493 -9.744 2.331 1.00 0.58 C ATOM 1029 O PHE A 71 0.059 -9.072 1.393 1.00 0.79 O ATOM 1030 CB PHE A 71 2.712 -8.611 2.506 1.00 1.57 C ATOM 1031 CG PHE A 71 4.151 -8.685 2.946 1.00 1.10 C ATOM 1032 CD1 PHE A 71 4.471 -8.830 4.286 1.00 1.10 C ATOM 1033 CD2 PHE A 71 5.182 -8.590 2.026 1.00 1.38 C ATOM 1034 CE1 PHE A 71 5.789 -8.880 4.699 1.00 1.29 C ATOM 1035 CE2 PHE A 71 6.501 -8.638 2.433 1.00 1.18 C ATOM 1036 CZ PHE A 71 6.805 -8.783 3.770 1.00 1.02 C ATOM 0 H PHE A 71 2.929 -10.324 0.692 1.00 0.78 H new ATOM 0 HA PHE A 71 2.175 -10.428 3.470 1.00 0.94 H new ATOM 0 HB2 PHE A 71 2.674 -8.193 1.500 1.00 1.57 H new ATOM 0 HB3 PHE A 71 2.181 -7.919 3.159 1.00 1.57 H new ATOM 0 HD1 PHE A 71 3.680 -8.905 5.018 1.00 1.10 H new ATOM 0 HD2 PHE A 71 4.952 -8.477 0.977 1.00 1.38 H new ATOM 0 HE1 PHE A 71 6.023 -8.995 5.747 1.00 1.29 H new ATOM 0 HE2 PHE A 71 7.294 -8.562 1.704 1.00 1.18 H new ATOM 0 HZ PHE A 71 7.836 -8.821 4.090 1.00 1.02 H new ATOM 1046 N GLY A 72 -0.271 -10.351 3.211 1.00 0.46 N ATOM 1047 CA GLY A 72 -1.693 -10.376 3.048 1.00 0.78 C ATOM 1048 C GLY A 72 -2.421 -9.513 4.046 1.00 0.58 C ATOM 1049 O GLY A 72 -2.005 -9.383 5.199 1.00 0.74 O ATOM 0 H GLY A 72 0.074 -10.831 4.042 1.00 0.46 H new ATOM 0 HA2 GLY A 72 -1.942 -10.044 2.040 1.00 0.78 H new ATOM 0 HA3 GLY A 72 -2.045 -11.403 3.141 1.00 0.78 H new ATOM 1053 N TYR A 73 -3.504 -8.911 3.589 1.00 0.39 N ATOM 1054 CA TYR A 73 -4.310 -8.039 4.419 1.00 0.36 C ATOM 1055 C TYR A 73 -5.785 -8.388 4.283 1.00 0.34 C ATOM 1056 O TYR A 73 -6.310 -8.493 3.174 1.00 0.43 O ATOM 1057 CB TYR A 73 -4.102 -6.584 4.011 1.00 0.51 C ATOM 1058 CG TYR A 73 -2.655 -6.139 3.998 1.00 0.58 C ATOM 1059 CD1 TYR A 73 -1.856 -6.333 2.882 1.00 0.78 C ATOM 1060 CD2 TYR A 73 -2.086 -5.540 5.111 1.00 0.72 C ATOM 1061 CE1 TYR A 73 -0.534 -5.940 2.879 1.00 0.97 C ATOM 1062 CE2 TYR A 73 -0.769 -5.146 5.115 1.00 0.89 C ATOM 1063 CZ TYR A 73 -0.012 -5.300 3.952 1.00 0.99 C ATOM 1064 OH TYR A 73 1.318 -4.953 3.998 1.00 1.21 O ATOM 0 H TYR A 73 -3.848 -9.013 2.634 1.00 0.39 H new ATOM 0 HA TYR A 73 -4.002 -8.176 5.456 1.00 0.36 H new ATOM 0 HB2 TYR A 73 -4.525 -6.434 3.017 1.00 0.51 H new ATOM 0 HB3 TYR A 73 -4.660 -5.944 4.695 1.00 0.51 H new ATOM 0 HD1 TYR A 73 -2.275 -6.799 2.002 1.00 0.78 H new ATOM 0 HD2 TYR A 73 -2.689 -5.380 5.992 1.00 0.72 H new ATOM 0 HE1 TYR A 73 0.086 -6.143 2.019 1.00 0.97 H new ATOM 0 HE2 TYR A 73 -0.326 -4.723 6.005 1.00 0.89 H new ATOM 0 HH TYR A 73 1.481 -4.201 3.391 1.00 1.21 H new ATOM 1074 N ASP A 74 -6.443 -8.567 5.411 1.00 0.35 N ATOM 1075 CA ASP A 74 -7.871 -8.842 5.430 1.00 0.39 C ATOM 1076 C ASP A 74 -8.623 -7.559 5.766 1.00 0.34 C ATOM 1077 O ASP A 74 -8.626 -7.120 6.915 1.00 0.44 O ATOM 1078 CB ASP A 74 -8.176 -9.930 6.468 1.00 0.57 C ATOM 1079 CG ASP A 74 -9.612 -10.420 6.457 1.00 1.58 C ATOM 1080 OD1 ASP A 74 -10.520 -9.640 6.796 1.00 1.92 O ATOM 1081 OD2 ASP A 74 -9.829 -11.603 6.129 1.00 2.47 O ATOM 0 H ASP A 74 -6.010 -8.527 6.334 1.00 0.35 H new ATOM 0 HA ASP A 74 -8.192 -9.198 4.451 1.00 0.39 H new ATOM 0 HB2 ASP A 74 -7.514 -10.778 6.293 1.00 0.57 H new ATOM 0 HB3 ASP A 74 -7.944 -9.544 7.461 1.00 0.57 H new ATOM 1086 N ILE A 75 -9.200 -6.929 4.748 1.00 0.28 N ATOM 1087 CA ILE A 75 -10.045 -5.758 4.952 1.00 0.27 C ATOM 1088 C ILE A 75 -11.497 -6.167 4.835 1.00 0.27 C ATOM 1089 O ILE A 75 -12.063 -6.154 3.742 1.00 0.26 O ATOM 1090 CB ILE A 75 -9.794 -4.671 3.893 1.00 0.25 C ATOM 1091 CG1 ILE A 75 -8.315 -4.405 3.732 1.00 0.28 C ATOM 1092 CG2 ILE A 75 -10.503 -3.385 4.272 1.00 0.29 C ATOM 1093 CD1 ILE A 75 -7.948 -4.042 2.321 1.00 0.38 C ATOM 0 H ILE A 75 -9.098 -7.210 3.773 1.00 0.28 H new ATOM 0 HA ILE A 75 -9.809 -5.359 5.938 1.00 0.27 H new ATOM 0 HB ILE A 75 -10.191 -5.033 2.944 1.00 0.25 H new ATOM 0 HG12 ILE A 75 -8.019 -3.597 4.401 1.00 0.28 H new ATOM 0 HG13 ILE A 75 -7.755 -5.290 4.034 1.00 0.28 H new ATOM 0 HG21 ILE A 75 -10.314 -2.628 3.511 1.00 0.29 H new ATOM 0 HG22 ILE A 75 -11.575 -3.568 4.343 1.00 0.29 H new ATOM 0 HG23 ILE A 75 -10.130 -3.034 5.234 1.00 0.29 H new ATOM 0 HD11 ILE A 75 -6.875 -3.861 2.259 1.00 0.38 H new ATOM 0 HD12 ILE A 75 -8.217 -4.860 1.653 1.00 0.38 H new ATOM 0 HD13 ILE A 75 -8.486 -3.141 2.026 1.00 0.38 H new ATOM 1105 N PRO A 76 -12.124 -6.556 5.937 1.00 0.32 N ATOM 1106 CA PRO A 76 -13.501 -7.005 5.901 1.00 0.35 C ATOM 1107 C PRO A 76 -14.454 -5.876 5.521 1.00 0.34 C ATOM 1108 O PRO A 76 -14.602 -4.893 6.250 1.00 0.41 O ATOM 1109 CB PRO A 76 -13.766 -7.486 7.327 1.00 0.45 C ATOM 1110 CG PRO A 76 -12.747 -6.790 8.167 1.00 0.59 C ATOM 1111 CD PRO A 76 -11.547 -6.612 7.287 1.00 0.41 C ATOM 0 HA PRO A 76 -13.662 -7.781 5.153 1.00 0.35 H new ATOM 0 HB2 PRO A 76 -14.778 -7.236 7.646 1.00 0.45 H new ATOM 0 HB3 PRO A 76 -13.667 -8.569 7.403 1.00 0.45 H new ATOM 0 HG2 PRO A 76 -13.121 -5.828 8.519 1.00 0.59 H new ATOM 0 HG3 PRO A 76 -12.500 -7.378 9.051 1.00 0.59 H new ATOM 0 HD2 PRO A 76 -11.002 -5.700 7.530 1.00 0.41 H new ATOM 0 HD3 PRO A 76 -10.846 -7.440 7.391 1.00 0.41 H new ATOM 1119 N ILE A 77 -15.118 -6.035 4.389 1.00 0.31 N ATOM 1120 CA ILE A 77 -15.938 -4.974 3.828 1.00 0.30 C ATOM 1121 C ILE A 77 -17.418 -5.319 3.918 1.00 0.36 C ATOM 1122 O ILE A 77 -17.808 -6.464 3.709 1.00 0.40 O ATOM 1123 CB ILE A 77 -15.565 -4.722 2.353 1.00 0.26 C ATOM 1124 CG1 ILE A 77 -14.137 -4.189 2.244 1.00 0.28 C ATOM 1125 CG2 ILE A 77 -16.544 -3.757 1.696 1.00 0.30 C ATOM 1126 CD1 ILE A 77 -13.732 -3.828 0.831 1.00 0.49 C ATOM 0 H ILE A 77 -15.105 -6.893 3.838 1.00 0.31 H new ATOM 0 HA ILE A 77 -15.749 -4.072 4.410 1.00 0.30 H new ATOM 0 HB ILE A 77 -15.623 -5.674 1.825 1.00 0.26 H new ATOM 0 HG12 ILE A 77 -14.037 -3.308 2.878 1.00 0.28 H new ATOM 0 HG13 ILE A 77 -13.447 -4.939 2.630 1.00 0.28 H new ATOM 0 HG21 ILE A 77 -16.256 -3.598 0.657 1.00 0.30 H new ATOM 0 HG22 ILE A 77 -17.549 -4.177 1.734 1.00 0.30 H new ATOM 0 HG23 ILE A 77 -16.528 -2.805 2.227 1.00 0.30 H new ATOM 0 HD11 ILE A 77 -12.707 -3.457 0.830 1.00 0.49 H new ATOM 0 HD12 ILE A 77 -13.799 -4.712 0.196 1.00 0.49 H new ATOM 0 HD13 ILE A 77 -14.398 -3.055 0.448 1.00 0.49 H new ATOM 1138 N LYS A 78 -18.237 -4.325 4.247 1.00 0.44 N ATOM 1139 CA LYS A 78 -19.682 -4.500 4.233 1.00 0.54 C ATOM 1140 C LYS A 78 -20.344 -3.321 3.520 1.00 0.55 C ATOM 1141 O LYS A 78 -21.548 -3.106 3.649 1.00 0.71 O ATOM 1142 CB LYS A 78 -20.259 -4.617 5.656 1.00 0.71 C ATOM 1143 CG LYS A 78 -19.291 -5.126 6.718 1.00 1.23 C ATOM 1144 CD LYS A 78 -18.503 -3.982 7.339 1.00 1.82 C ATOM 1145 CE LYS A 78 -17.696 -4.436 8.546 1.00 2.66 C ATOM 1146 NZ LYS A 78 -16.585 -5.350 8.172 1.00 3.32 N ATOM 0 H LYS A 78 -17.925 -3.395 4.525 1.00 0.44 H new ATOM 0 HA LYS A 78 -19.892 -5.428 3.701 1.00 0.54 H new ATOM 0 HB2 LYS A 78 -20.624 -3.637 5.963 1.00 0.71 H new ATOM 0 HB3 LYS A 78 -21.121 -5.284 5.626 1.00 0.71 H new ATOM 0 HG2 LYS A 78 -19.844 -5.654 7.495 1.00 1.23 H new ATOM 0 HG3 LYS A 78 -18.603 -5.845 6.272 1.00 1.23 H new ATOM 0 HD2 LYS A 78 -17.832 -3.557 6.593 1.00 1.82 H new ATOM 0 HD3 LYS A 78 -19.189 -3.190 7.639 1.00 1.82 H new ATOM 0 HE2 LYS A 78 -17.289 -3.563 9.057 1.00 2.66 H new ATOM 0 HE3 LYS A 78 -18.356 -4.940 9.252 1.00 2.66 H new ATOM 0 HZ1 LYS A 78 -15.984 -5.524 9.003 1.00 3.32 H new ATOM 0 HZ2 LYS A 78 -16.977 -6.252 7.833 1.00 3.32 H new ATOM 0 HZ3 LYS A 78 -16.016 -4.914 7.418 1.00 3.32 H new ATOM 1160 N GLU A 79 -19.555 -2.555 2.768 1.00 0.46 N ATOM 1161 CA GLU A 79 -20.053 -1.335 2.149 1.00 0.47 C ATOM 1162 C GLU A 79 -19.726 -1.308 0.662 1.00 0.36 C ATOM 1163 O GLU A 79 -18.809 -1.993 0.210 1.00 0.39 O ATOM 1164 CB GLU A 79 -19.432 -0.118 2.838 1.00 0.60 C ATOM 1165 CG GLU A 79 -19.926 0.108 4.254 1.00 1.02 C ATOM 1166 CD GLU A 79 -21.300 0.732 4.284 1.00 1.41 C ATOM 1167 OE1 GLU A 79 -22.291 -0.019 4.206 1.00 2.16 O ATOM 1168 OE2 GLU A 79 -21.398 1.970 4.403 1.00 1.87 O ATOM 0 H GLU A 79 -18.574 -2.759 2.575 1.00 0.46 H new ATOM 0 HA GLU A 79 -21.137 -1.307 2.263 1.00 0.47 H new ATOM 0 HB2 GLU A 79 -18.349 -0.237 2.857 1.00 0.60 H new ATOM 0 HB3 GLU A 79 -19.644 0.771 2.244 1.00 0.60 H new ATOM 0 HG2 GLU A 79 -19.949 -0.843 4.786 1.00 1.02 H new ATOM 0 HG3 GLU A 79 -19.224 0.752 4.784 1.00 1.02 H new ATOM 1175 N GLU A 80 -20.480 -0.517 -0.085 1.00 0.38 N ATOM 1176 CA GLU A 80 -20.236 -0.341 -1.508 1.00 0.34 C ATOM 1177 C GLU A 80 -19.747 1.077 -1.792 1.00 0.35 C ATOM 1178 O GLU A 80 -19.767 1.938 -0.909 1.00 0.52 O ATOM 1179 CB GLU A 80 -21.505 -0.650 -2.308 1.00 0.42 C ATOM 1180 CG GLU A 80 -21.786 -2.136 -2.446 1.00 0.71 C ATOM 1181 CD GLU A 80 -23.264 -2.463 -2.394 1.00 0.84 C ATOM 1182 OE1 GLU A 80 -23.971 -2.220 -3.393 1.00 0.90 O ATOM 1183 OE2 GLU A 80 -23.726 -2.979 -1.354 1.00 1.20 O ATOM 0 H GLU A 80 -21.272 0.017 0.274 1.00 0.38 H new ATOM 0 HA GLU A 80 -19.458 -1.038 -1.819 1.00 0.34 H new ATOM 0 HB2 GLU A 80 -22.356 -0.171 -1.824 1.00 0.42 H new ATOM 0 HB3 GLU A 80 -21.415 -0.211 -3.302 1.00 0.42 H new ATOM 0 HG2 GLU A 80 -21.373 -2.493 -3.390 1.00 0.71 H new ATOM 0 HG3 GLU A 80 -21.272 -2.674 -1.649 1.00 0.71 H new ATOM 1190 N GLY A 81 -19.307 1.305 -3.019 1.00 0.30 N ATOM 1191 CA GLY A 81 -18.731 2.583 -3.393 1.00 0.28 C ATOM 1192 C GLY A 81 -17.433 2.379 -4.138 1.00 0.24 C ATOM 1193 O GLY A 81 -17.169 1.272 -4.616 1.00 0.28 O ATOM 0 H GLY A 81 -19.339 0.619 -3.773 1.00 0.30 H new ATOM 0 HA2 GLY A 81 -19.433 3.136 -4.017 1.00 0.28 H new ATOM 0 HA3 GLY A 81 -18.555 3.184 -2.501 1.00 0.28 H new ATOM 1197 N GLU A 82 -16.613 3.415 -4.249 1.00 0.22 N ATOM 1198 CA GLU A 82 -15.314 3.251 -4.885 1.00 0.23 C ATOM 1199 C GLU A 82 -14.228 3.180 -3.827 1.00 0.22 C ATOM 1200 O GLU A 82 -13.926 4.171 -3.181 1.00 0.26 O ATOM 1201 CB GLU A 82 -15.017 4.401 -5.853 1.00 0.29 C ATOM 1202 CG GLU A 82 -16.070 4.586 -6.933 1.00 0.42 C ATOM 1203 CD GLU A 82 -15.635 5.545 -8.025 1.00 1.11 C ATOM 1204 OE1 GLU A 82 -14.795 6.428 -7.757 1.00 1.30 O ATOM 1205 OE2 GLU A 82 -16.129 5.410 -9.168 1.00 1.96 O ATOM 0 H GLU A 82 -16.817 4.357 -3.915 1.00 0.22 H new ATOM 0 HA GLU A 82 -15.333 2.323 -5.456 1.00 0.23 H new ATOM 0 HB2 GLU A 82 -14.927 5.327 -5.285 1.00 0.29 H new ATOM 0 HB3 GLU A 82 -14.052 4.223 -6.327 1.00 0.29 H new ATOM 0 HG2 GLU A 82 -16.301 3.618 -7.378 1.00 0.42 H new ATOM 0 HG3 GLU A 82 -16.989 4.955 -6.478 1.00 0.42 H new ATOM 1212 N TYR A 83 -13.612 2.027 -3.664 1.00 0.21 N ATOM 1213 CA TYR A 83 -12.578 1.902 -2.655 1.00 0.22 C ATOM 1214 C TYR A 83 -11.252 2.150 -3.303 1.00 0.22 C ATOM 1215 O TYR A 83 -10.885 1.484 -4.259 1.00 0.22 O ATOM 1216 CB TYR A 83 -12.566 0.509 -2.026 1.00 0.25 C ATOM 1217 CG TYR A 83 -13.714 0.240 -1.096 1.00 0.27 C ATOM 1218 CD1 TYR A 83 -14.928 -0.204 -1.588 1.00 0.59 C ATOM 1219 CD2 TYR A 83 -13.591 0.433 0.268 1.00 0.67 C ATOM 1220 CE1 TYR A 83 -15.986 -0.446 -0.750 1.00 0.60 C ATOM 1221 CE2 TYR A 83 -14.644 0.192 1.113 1.00 0.71 C ATOM 1222 CZ TYR A 83 -15.812 -0.261 0.632 1.00 0.39 C ATOM 1223 OH TYR A 83 -16.891 -0.485 1.440 1.00 0.44 O ATOM 0 H TYR A 83 -13.802 1.181 -4.202 1.00 0.21 H new ATOM 0 HA TYR A 83 -12.777 2.627 -1.866 1.00 0.22 H new ATOM 0 HB2 TYR A 83 -12.576 -0.236 -2.822 1.00 0.25 H new ATOM 0 HB3 TYR A 83 -11.632 0.378 -1.479 1.00 0.25 H new ATOM 0 HD1 TYR A 83 -15.045 -0.363 -2.650 1.00 0.59 H new ATOM 0 HD2 TYR A 83 -12.652 0.779 0.674 1.00 0.67 H new ATOM 0 HE1 TYR A 83 -16.936 -0.773 -1.145 1.00 0.60 H new ATOM 0 HE2 TYR A 83 -14.532 0.368 2.173 1.00 0.71 H new ATOM 0 HH TYR A 83 -17.389 -1.263 1.113 1.00 0.44 H new ATOM 1233 N VAL A 84 -10.526 3.100 -2.777 1.00 0.22 N ATOM 1234 CA VAL A 84 -9.289 3.492 -3.397 1.00 0.22 C ATOM 1235 C VAL A 84 -8.123 3.143 -2.505 1.00 0.23 C ATOM 1236 O VAL A 84 -7.899 3.761 -1.461 1.00 0.24 O ATOM 1237 CB VAL A 84 -9.295 4.988 -3.771 1.00 0.22 C ATOM 1238 CG1 VAL A 84 -7.961 5.409 -4.374 1.00 0.26 C ATOM 1239 CG2 VAL A 84 -10.424 5.246 -4.743 1.00 0.25 C ATOM 0 H VAL A 84 -10.766 3.613 -1.929 1.00 0.22 H new ATOM 0 HA VAL A 84 -9.180 2.935 -4.328 1.00 0.22 H new ATOM 0 HB VAL A 84 -9.446 5.581 -2.869 1.00 0.22 H new ATOM 0 HG11 VAL A 84 -7.995 6.468 -4.628 1.00 0.26 H new ATOM 0 HG12 VAL A 84 -7.164 5.234 -3.652 1.00 0.26 H new ATOM 0 HG13 VAL A 84 -7.769 4.826 -5.275 1.00 0.26 H new ATOM 0 HG21 VAL A 84 -10.437 6.302 -5.014 1.00 0.25 H new ATOM 0 HG22 VAL A 84 -10.277 4.643 -5.639 1.00 0.25 H new ATOM 0 HG23 VAL A 84 -11.373 4.979 -4.278 1.00 0.25 H new ATOM 1249 N LEU A 85 -7.412 2.107 -2.910 1.00 0.25 N ATOM 1250 CA LEU A 85 -6.248 1.658 -2.189 1.00 0.30 C ATOM 1251 C LEU A 85 -5.038 2.419 -2.679 1.00 0.29 C ATOM 1252 O LEU A 85 -4.535 2.164 -3.767 1.00 0.31 O ATOM 1253 CB LEU A 85 -6.015 0.153 -2.385 1.00 0.40 C ATOM 1254 CG LEU A 85 -7.104 -0.781 -1.844 1.00 0.92 C ATOM 1255 CD1 LEU A 85 -8.334 -0.780 -2.740 1.00 1.56 C ATOM 1256 CD2 LEU A 85 -6.558 -2.190 -1.704 1.00 1.13 C ATOM 0 H LEU A 85 -7.628 1.560 -3.743 1.00 0.25 H new ATOM 0 HA LEU A 85 -6.409 1.842 -1.127 1.00 0.30 H new ATOM 0 HB2 LEU A 85 -5.899 -0.039 -3.452 1.00 0.40 H new ATOM 0 HB3 LEU A 85 -5.071 -0.111 -1.909 1.00 0.40 H new ATOM 0 HG LEU A 85 -7.406 -0.413 -0.863 1.00 0.92 H new ATOM 0 HD11 LEU A 85 -9.086 -1.453 -2.327 1.00 1.56 H new ATOM 0 HD12 LEU A 85 -8.742 0.229 -2.797 1.00 1.56 H new ATOM 0 HD13 LEU A 85 -8.057 -1.116 -3.739 1.00 1.56 H new ATOM 0 HD21 LEU A 85 -7.339 -2.846 -1.319 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -6.228 -2.551 -2.678 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -5.714 -2.186 -1.014 1.00 1.13 H new ATOM 1268 N VAL A 86 -4.595 3.366 -1.890 1.00 0.31 N ATOM 1269 CA VAL A 86 -3.371 4.071 -2.183 1.00 0.34 C ATOM 1270 C VAL A 86 -2.312 3.576 -1.222 1.00 0.32 C ATOM 1271 O VAL A 86 -2.324 3.916 -0.039 1.00 0.32 O ATOM 1272 CB VAL A 86 -3.530 5.601 -2.045 1.00 0.41 C ATOM 1273 CG1 VAL A 86 -2.236 6.315 -2.419 1.00 1.05 C ATOM 1274 CG2 VAL A 86 -4.683 6.098 -2.903 1.00 1.14 C ATOM 0 H VAL A 86 -5.065 3.668 -1.037 1.00 0.31 H new ATOM 0 HA VAL A 86 -3.090 3.876 -3.218 1.00 0.34 H new ATOM 0 HB VAL A 86 -3.754 5.828 -1.003 1.00 0.41 H new ATOM 0 HG11 VAL A 86 -2.371 7.392 -2.314 1.00 1.05 H new ATOM 0 HG12 VAL A 86 -1.434 5.984 -1.759 1.00 1.05 H new ATOM 0 HG13 VAL A 86 -1.976 6.080 -3.451 1.00 1.05 H new ATOM 0 HG21 VAL A 86 -4.779 7.178 -2.793 1.00 1.14 H new ATOM 0 HG22 VAL A 86 -4.490 5.856 -3.948 1.00 1.14 H new ATOM 0 HG23 VAL A 86 -5.608 5.617 -2.584 1.00 1.14 H new ATOM 1284 N LEU A 87 -1.430 2.732 -1.705 1.00 0.33 N ATOM 1285 CA LEU A 87 -0.419 2.171 -0.843 1.00 0.32 C ATOM 1286 C LEU A 87 0.954 2.618 -1.290 1.00 0.28 C ATOM 1287 O LEU A 87 1.294 2.539 -2.472 1.00 0.29 O ATOM 1288 CB LEU A 87 -0.503 0.633 -0.803 1.00 0.42 C ATOM 1289 CG LEU A 87 -0.386 -0.108 -2.136 1.00 0.57 C ATOM 1290 CD1 LEU A 87 0.157 -1.506 -1.899 1.00 1.37 C ATOM 1291 CD2 LEU A 87 -1.741 -0.202 -2.822 1.00 1.44 C ATOM 0 H LEU A 87 -1.392 2.423 -2.676 1.00 0.33 H new ATOM 0 HA LEU A 87 -0.597 2.536 0.168 1.00 0.32 H new ATOM 0 HB2 LEU A 87 0.285 0.269 -0.144 1.00 0.42 H new ATOM 0 HB3 LEU A 87 -1.454 0.358 -0.346 1.00 0.42 H new ATOM 0 HG LEU A 87 0.295 0.448 -2.780 1.00 0.57 H new ATOM 0 HD11 LEU A 87 0.239 -2.031 -2.851 1.00 1.37 H new ATOM 0 HD12 LEU A 87 1.141 -1.440 -1.435 1.00 1.37 H new ATOM 0 HD13 LEU A 87 -0.519 -2.052 -1.241 1.00 1.37 H new ATOM 0 HD21 LEU A 87 -1.634 -0.733 -3.768 1.00 1.44 H new ATOM 0 HD22 LEU A 87 -2.437 -0.742 -2.180 1.00 1.44 H new ATOM 0 HD23 LEU A 87 -2.124 0.801 -3.010 1.00 1.44 H new ATOM 1303 N LYS A 88 1.749 3.078 -0.343 1.00 0.28 N ATOM 1304 CA LYS A 88 3.104 3.492 -0.665 1.00 0.28 C ATOM 1305 C LYS A 88 4.019 2.283 -0.611 1.00 0.28 C ATOM 1306 O LYS A 88 4.180 1.645 0.429 1.00 0.39 O ATOM 1307 CB LYS A 88 3.614 4.574 0.291 1.00 0.35 C ATOM 1308 CG LYS A 88 4.598 5.575 -0.318 1.00 0.67 C ATOM 1309 CD LYS A 88 5.733 4.924 -1.089 1.00 1.91 C ATOM 1310 CE LYS A 88 6.870 4.497 -0.181 1.00 2.70 C ATOM 1311 NZ LYS A 88 6.513 3.322 0.648 1.00 3.73 N ATOM 0 H LYS A 88 1.488 3.174 0.638 1.00 0.28 H new ATOM 0 HA LYS A 88 3.100 3.919 -1.668 1.00 0.28 H new ATOM 0 HB2 LYS A 88 2.757 5.124 0.681 1.00 0.35 H new ATOM 0 HB3 LYS A 88 4.095 4.088 1.140 1.00 0.35 H new ATOM 0 HG2 LYS A 88 4.055 6.245 -0.985 1.00 0.67 H new ATOM 0 HG3 LYS A 88 5.017 6.189 0.479 1.00 0.67 H new ATOM 0 HD2 LYS A 88 5.354 4.055 -1.627 1.00 1.91 H new ATOM 0 HD3 LYS A 88 6.110 5.622 -1.837 1.00 1.91 H new ATOM 0 HE2 LYS A 88 7.746 4.261 -0.785 1.00 2.70 H new ATOM 0 HE3 LYS A 88 7.145 5.328 0.469 1.00 2.70 H new ATOM 0 HZ1 LYS A 88 6.681 3.541 1.651 1.00 3.73 H new ATOM 0 HZ2 LYS A 88 5.509 3.090 0.507 1.00 3.73 H new ATOM 0 HZ3 LYS A 88 7.098 2.509 0.368 1.00 3.73 H new ATOM 1325 N PHE A 89 4.637 2.006 -1.727 1.00 0.27 N ATOM 1326 CA PHE A 89 5.544 0.890 -1.872 1.00 0.28 C ATOM 1327 C PHE A 89 6.986 1.378 -1.928 1.00 0.28 C ATOM 1328 O PHE A 89 7.275 2.412 -2.525 1.00 0.29 O ATOM 1329 CB PHE A 89 5.221 0.154 -3.164 1.00 0.32 C ATOM 1330 CG PHE A 89 4.479 -1.126 -2.973 1.00 0.32 C ATOM 1331 CD1 PHE A 89 4.795 -1.972 -1.927 1.00 0.37 C ATOM 1332 CD2 PHE A 89 3.480 -1.490 -3.854 1.00 0.37 C ATOM 1333 CE1 PHE A 89 4.125 -3.163 -1.758 1.00 0.44 C ATOM 1334 CE2 PHE A 89 2.810 -2.685 -3.697 1.00 0.42 C ATOM 1335 CZ PHE A 89 3.132 -3.524 -2.649 1.00 0.45 C ATOM 0 H PHE A 89 4.525 2.557 -2.578 1.00 0.27 H new ATOM 0 HA PHE A 89 5.428 0.226 -1.015 1.00 0.28 H new ATOM 0 HB2 PHE A 89 4.631 0.810 -3.804 1.00 0.32 H new ATOM 0 HB3 PHE A 89 6.152 -0.054 -3.692 1.00 0.32 H new ATOM 0 HD1 PHE A 89 5.576 -1.696 -1.234 1.00 0.37 H new ATOM 0 HD2 PHE A 89 3.221 -0.834 -4.672 1.00 0.37 H new ATOM 0 HE1 PHE A 89 4.375 -3.813 -0.932 1.00 0.44 H new ATOM 0 HE2 PHE A 89 2.034 -2.964 -4.394 1.00 0.42 H new ATOM 0 HZ PHE A 89 2.609 -4.461 -2.526 1.00 0.45 H new ATOM 1345 N ALA A 90 7.874 0.646 -1.286 1.00 0.32 N ATOM 1346 CA ALA A 90 9.304 0.939 -1.333 1.00 0.36 C ATOM 1347 C ALA A 90 10.087 -0.365 -1.193 1.00 0.42 C ATOM 1348 O ALA A 90 9.638 -1.274 -0.494 1.00 0.51 O ATOM 1349 CB ALA A 90 9.694 1.910 -0.229 1.00 0.44 C ATOM 0 H ALA A 90 7.633 -0.166 -0.718 1.00 0.32 H new ATOM 0 HA ALA A 90 9.540 1.407 -2.289 1.00 0.36 H new ATOM 0 HB1 ALA A 90 10.763 2.113 -0.284 1.00 0.44 H new ATOM 0 HB2 ALA A 90 9.141 2.841 -0.351 1.00 0.44 H new ATOM 0 HB3 ALA A 90 9.457 1.472 0.741 1.00 0.44 H new ATOM 1355 N GLU A 91 11.236 -0.469 -1.850 1.00 0.59 N ATOM 1356 CA GLU A 91 12.019 -1.700 -1.796 1.00 0.75 C ATOM 1357 C GLU A 91 13.407 -1.441 -1.217 1.00 1.10 C ATOM 1358 O GLU A 91 13.722 -0.311 -0.836 1.00 1.80 O ATOM 1359 CB GLU A 91 12.139 -2.339 -3.179 1.00 1.45 C ATOM 1360 CG GLU A 91 12.882 -1.484 -4.187 1.00 1.95 C ATOM 1361 CD GLU A 91 13.326 -2.290 -5.383 1.00 2.17 C ATOM 1362 OE1 GLU A 91 14.389 -2.941 -5.298 1.00 2.62 O ATOM 1363 OE2 GLU A 91 12.609 -2.299 -6.411 1.00 2.51 O ATOM 0 H GLU A 91 11.643 0.273 -2.420 1.00 0.59 H new ATOM 0 HA GLU A 91 11.492 -2.393 -1.140 1.00 0.75 H new ATOM 0 HB2 GLU A 91 12.650 -3.297 -3.083 1.00 1.45 H new ATOM 0 HB3 GLU A 91 11.139 -2.547 -3.560 1.00 1.45 H new ATOM 0 HG2 GLU A 91 12.239 -0.668 -4.517 1.00 1.95 H new ATOM 0 HG3 GLU A 91 13.751 -1.032 -3.710 1.00 1.95 H new ATOM 1370 N VAL A 92 14.236 -2.481 -1.157 1.00 1.37 N ATOM 1371 CA VAL A 92 15.547 -2.363 -0.537 1.00 2.09 C ATOM 1372 C VAL A 92 16.585 -1.729 -1.490 1.00 1.99 C ATOM 1373 O VAL A 92 17.002 -0.594 -1.256 1.00 2.61 O ATOM 1374 CB VAL A 92 16.026 -3.725 0.043 1.00 2.95 C ATOM 1375 CG1 VAL A 92 16.247 -4.779 -1.034 1.00 3.64 C ATOM 1376 CG2 VAL A 92 17.272 -3.542 0.891 1.00 3.77 C ATOM 0 H VAL A 92 14.023 -3.407 -1.528 1.00 1.37 H new ATOM 0 HA VAL A 92 15.448 -1.677 0.304 1.00 2.09 H new ATOM 0 HB VAL A 92 15.223 -4.096 0.680 1.00 2.95 H new ATOM 0 HG11 VAL A 92 16.580 -5.708 -0.571 1.00 3.64 H new ATOM 0 HG12 VAL A 92 15.313 -4.954 -1.568 1.00 3.64 H new ATOM 0 HG13 VAL A 92 17.006 -4.430 -1.734 1.00 3.64 H new ATOM 0 HG21 VAL A 92 17.588 -4.507 1.286 1.00 3.77 H new ATOM 0 HG22 VAL A 92 18.070 -3.121 0.279 1.00 3.77 H new ATOM 0 HG23 VAL A 92 17.053 -2.866 1.718 1.00 3.77 H new ATOM 1386 N TYR A 93 16.986 -2.431 -2.560 1.00 1.71 N ATOM 1387 CA TYR A 93 17.947 -1.875 -3.525 1.00 1.99 C ATOM 1388 C TYR A 93 18.191 -2.810 -4.717 1.00 1.66 C ATOM 1389 O TYR A 93 19.245 -2.734 -5.351 1.00 1.98 O ATOM 1390 CB TYR A 93 19.300 -1.545 -2.853 1.00 2.71 C ATOM 1391 CG TYR A 93 20.023 -2.728 -2.228 1.00 3.21 C ATOM 1392 CD1 TYR A 93 20.777 -3.605 -3.001 1.00 3.71 C ATOM 1393 CD2 TYR A 93 19.960 -2.959 -0.861 1.00 3.58 C ATOM 1394 CE1 TYR A 93 21.438 -4.674 -2.431 1.00 4.48 C ATOM 1395 CE2 TYR A 93 20.621 -4.027 -0.282 1.00 4.35 C ATOM 1396 CZ TYR A 93 21.358 -4.881 -1.071 1.00 4.77 C ATOM 1397 OH TYR A 93 22.016 -5.947 -0.502 1.00 5.68 O ATOM 0 H TYR A 93 16.664 -3.374 -2.778 1.00 1.71 H new ATOM 0 HA TYR A 93 17.495 -0.956 -3.898 1.00 1.99 H new ATOM 0 HB2 TYR A 93 19.955 -1.092 -3.597 1.00 2.71 H new ATOM 0 HB3 TYR A 93 19.129 -0.795 -2.080 1.00 2.71 H new ATOM 0 HD1 TYR A 93 20.846 -3.446 -4.067 1.00 3.71 H new ATOM 0 HD2 TYR A 93 19.384 -2.292 -0.237 1.00 3.58 H new ATOM 0 HE1 TYR A 93 22.016 -5.346 -3.048 1.00 4.48 H new ATOM 0 HE2 TYR A 93 20.559 -4.190 0.784 1.00 4.35 H new ATOM 0 HH TYR A 93 21.859 -5.950 0.465 1.00 5.68 H new ATOM 1407 N PHE A 94 17.231 -3.672 -5.042 1.00 1.60 N ATOM 1408 CA PHE A 94 17.430 -4.637 -6.128 1.00 1.62 C ATOM 1409 C PHE A 94 17.471 -3.925 -7.478 1.00 1.50 C ATOM 1410 O PHE A 94 16.435 -3.546 -8.031 1.00 1.99 O ATOM 1411 CB PHE A 94 16.344 -5.713 -6.126 1.00 2.15 C ATOM 1412 CG PHE A 94 16.434 -6.664 -4.970 1.00 2.79 C ATOM 1413 CD1 PHE A 94 17.620 -7.319 -4.689 1.00 3.28 C ATOM 1414 CD2 PHE A 94 15.330 -6.914 -4.176 1.00 3.42 C ATOM 1415 CE1 PHE A 94 17.705 -8.203 -3.632 1.00 4.15 C ATOM 1416 CE2 PHE A 94 15.408 -7.797 -3.119 1.00 4.37 C ATOM 1417 CZ PHE A 94 16.598 -8.443 -2.846 1.00 4.65 C ATOM 0 H PHE A 94 16.323 -3.726 -4.581 1.00 1.60 H new ATOM 0 HA PHE A 94 18.388 -5.129 -5.962 1.00 1.62 H new ATOM 0 HB2 PHE A 94 15.367 -5.230 -6.111 1.00 2.15 H new ATOM 0 HB3 PHE A 94 16.405 -6.279 -7.055 1.00 2.15 H new ATOM 0 HD1 PHE A 94 18.489 -7.137 -5.304 1.00 3.28 H new ATOM 0 HD2 PHE A 94 14.397 -6.413 -4.386 1.00 3.42 H new ATOM 0 HE1 PHE A 94 18.637 -8.706 -3.421 1.00 4.15 H new ATOM 0 HE2 PHE A 94 14.539 -7.983 -2.505 1.00 4.37 H new ATOM 0 HZ PHE A 94 16.661 -9.134 -2.019 1.00 4.65 H new ATOM 1427 N ALA A 95 18.674 -3.775 -8.010 1.00 1.26 N ATOM 1428 CA ALA A 95 18.916 -2.909 -9.153 1.00 1.24 C ATOM 1429 C ALA A 95 18.807 -3.635 -10.494 1.00 1.19 C ATOM 1430 O ALA A 95 19.798 -3.795 -11.206 1.00 1.37 O ATOM 1431 CB ALA A 95 20.283 -2.260 -9.018 1.00 1.39 C ATOM 0 H ALA A 95 19.508 -4.249 -7.663 1.00 1.26 H new ATOM 0 HA ALA A 95 18.134 -2.150 -9.150 1.00 1.24 H new ATOM 0 HB1 ALA A 95 20.464 -1.611 -9.875 1.00 1.39 H new ATOM 0 HB2 ALA A 95 20.317 -1.670 -8.102 1.00 1.39 H new ATOM 0 HB3 ALA A 95 21.051 -3.033 -8.980 1.00 1.39 H new ATOM 1437 N GLN A 96 17.601 -4.064 -10.832 1.00 1.05 N ATOM 1438 CA GLN A 96 17.309 -4.545 -12.177 1.00 1.05 C ATOM 1439 C GLN A 96 15.833 -4.323 -12.493 1.00 0.91 C ATOM 1440 O GLN A 96 14.970 -4.491 -11.627 1.00 0.88 O ATOM 1441 CB GLN A 96 17.699 -6.024 -12.370 1.00 1.21 C ATOM 1442 CG GLN A 96 16.849 -7.034 -11.607 1.00 1.54 C ATOM 1443 CD GLN A 96 17.464 -7.475 -10.291 1.00 2.09 C ATOM 1444 OE1 GLN A 96 18.170 -6.716 -9.629 1.00 2.63 O ATOM 1445 NE2 GLN A 96 17.219 -8.721 -9.918 1.00 2.75 N ATOM 0 H GLN A 96 16.806 -4.090 -10.193 1.00 1.05 H new ATOM 0 HA GLN A 96 17.918 -3.972 -12.876 1.00 1.05 H new ATOM 0 HB2 GLN A 96 17.645 -6.260 -13.433 1.00 1.21 H new ATOM 0 HB3 GLN A 96 18.739 -6.149 -12.068 1.00 1.21 H new ATOM 0 HG2 GLN A 96 15.869 -6.598 -11.412 1.00 1.54 H new ATOM 0 HG3 GLN A 96 16.689 -7.910 -12.235 1.00 1.54 H new ATOM 0 HE21 GLN A 96 16.628 -9.319 -10.495 1.00 2.75 H new ATOM 0 HE22 GLN A 96 17.621 -9.083 -9.053 1.00 2.75 H new ATOM 1454 N SER A 97 15.553 -3.927 -13.725 1.00 0.94 N ATOM 1455 CA SER A 97 14.198 -3.589 -14.137 1.00 0.92 C ATOM 1456 C SER A 97 13.607 -4.688 -15.019 1.00 0.95 C ATOM 1457 O SER A 97 14.351 -5.420 -15.678 1.00 1.17 O ATOM 1458 CB SER A 97 14.216 -2.264 -14.900 1.00 1.04 C ATOM 1459 OG SER A 97 14.864 -1.255 -14.143 1.00 1.40 O ATOM 0 H SER A 97 16.251 -3.831 -14.462 1.00 0.94 H new ATOM 0 HA SER A 97 13.575 -3.494 -13.248 1.00 0.92 H new ATOM 0 HB2 SER A 97 14.728 -2.395 -15.853 1.00 1.04 H new ATOM 0 HB3 SER A 97 13.195 -1.956 -15.126 1.00 1.04 H new ATOM 0 HG SER A 97 14.866 -0.416 -14.650 1.00 1.40 H new ATOM 1465 N GLN A 98 12.275 -4.799 -15.017 1.00 0.89 N ATOM 1466 CA GLN A 98 11.553 -5.771 -15.845 1.00 0.97 C ATOM 1467 C GLN A 98 12.134 -7.178 -15.707 1.00 1.04 C ATOM 1468 O GLN A 98 12.326 -7.894 -16.691 1.00 1.44 O ATOM 1469 CB GLN A 98 11.558 -5.324 -17.310 1.00 1.14 C ATOM 1470 CG GLN A 98 10.709 -4.087 -17.573 1.00 1.77 C ATOM 1471 CD GLN A 98 9.225 -4.350 -17.399 1.00 1.94 C ATOM 1472 OE1 GLN A 98 8.542 -4.741 -18.344 1.00 2.33 O ATOM 1473 NE2 GLN A 98 8.710 -4.136 -16.198 1.00 2.38 N ATOM 0 H GLN A 98 11.666 -4.217 -14.441 1.00 0.89 H new ATOM 0 HA GLN A 98 10.523 -5.811 -15.490 1.00 0.97 H new ATOM 0 HB2 GLN A 98 12.584 -5.122 -17.616 1.00 1.14 H new ATOM 0 HB3 GLN A 98 11.195 -6.142 -17.932 1.00 1.14 H new ATOM 0 HG2 GLN A 98 11.015 -3.290 -16.895 1.00 1.77 H new ATOM 0 HG3 GLN A 98 10.895 -3.732 -18.587 1.00 1.77 H new ATOM 0 HE21 GLN A 98 9.307 -3.812 -15.437 1.00 2.38 H new ATOM 0 HE22 GLN A 98 7.716 -4.296 -16.033 1.00 2.38 H new ATOM 1482 N GLN A 99 12.390 -7.569 -14.472 1.00 1.05 N ATOM 1483 CA GLN A 99 13.004 -8.853 -14.174 1.00 1.16 C ATOM 1484 C GLN A 99 12.401 -9.378 -12.879 1.00 1.02 C ATOM 1485 O GLN A 99 11.732 -10.411 -12.849 1.00 1.16 O ATOM 1486 CB GLN A 99 14.525 -8.658 -14.044 1.00 1.35 C ATOM 1487 CG GLN A 99 15.370 -9.932 -14.044 1.00 1.82 C ATOM 1488 CD GLN A 99 15.183 -10.789 -12.808 1.00 2.26 C ATOM 1489 OE1 GLN A 99 15.800 -10.542 -11.770 1.00 2.73 O ATOM 1490 NE2 GLN A 99 14.375 -11.827 -12.924 1.00 2.89 N ATOM 0 H GLN A 99 12.179 -7.007 -13.647 1.00 1.05 H new ATOM 0 HA GLN A 99 12.819 -9.576 -14.968 1.00 1.16 H new ATOM 0 HB2 GLN A 99 14.861 -8.024 -14.865 1.00 1.35 H new ATOM 0 HB3 GLN A 99 14.723 -8.115 -13.120 1.00 1.35 H new ATOM 0 HG2 GLN A 99 15.120 -10.523 -14.926 1.00 1.82 H new ATOM 0 HG3 GLN A 99 16.422 -9.659 -14.130 1.00 1.82 H new ATOM 0 HE21 GLN A 99 13.883 -11.995 -13.802 1.00 2.89 H new ATOM 0 HE22 GLN A 99 14.243 -12.461 -12.136 1.00 2.89 H new ATOM 1499 N LYS A 100 12.625 -8.628 -11.821 1.00 0.87 N ATOM 1500 CA LYS A 100 12.049 -8.917 -10.519 1.00 0.84 C ATOM 1501 C LYS A 100 10.648 -8.333 -10.432 1.00 0.66 C ATOM 1502 O LYS A 100 10.467 -7.205 -9.974 1.00 0.63 O ATOM 1503 CB LYS A 100 12.931 -8.319 -9.425 1.00 1.00 C ATOM 1504 CG LYS A 100 13.833 -7.214 -9.946 1.00 1.33 C ATOM 1505 CD LYS A 100 14.338 -6.311 -8.844 1.00 1.75 C ATOM 1506 CE LYS A 100 13.264 -5.342 -8.387 1.00 2.23 C ATOM 1507 NZ LYS A 100 13.827 -4.300 -7.499 1.00 2.79 N ATOM 0 H LYS A 100 13.214 -7.796 -11.837 1.00 0.87 H new ATOM 0 HA LYS A 100 11.991 -9.997 -10.383 1.00 0.84 H new ATOM 0 HB2 LYS A 100 12.300 -7.924 -8.629 1.00 1.00 H new ATOM 0 HB3 LYS A 100 13.543 -9.106 -8.985 1.00 1.00 H new ATOM 0 HG2 LYS A 100 14.682 -7.657 -10.466 1.00 1.33 H new ATOM 0 HG3 LYS A 100 13.287 -6.618 -10.678 1.00 1.33 H new ATOM 0 HD2 LYS A 100 14.668 -6.915 -7.999 1.00 1.75 H new ATOM 0 HD3 LYS A 100 15.206 -5.754 -9.197 1.00 1.75 H new ATOM 0 HE2 LYS A 100 12.801 -4.873 -9.255 1.00 2.23 H new ATOM 0 HE3 LYS A 100 12.479 -5.886 -7.862 1.00 2.23 H new ATOM 0 HZ1 LYS A 100 13.334 -3.399 -7.665 1.00 2.79 H new ATOM 0 HZ2 LYS A 100 13.702 -4.585 -6.507 1.00 2.79 H new ATOM 0 HZ3 LYS A 100 14.840 -4.182 -7.701 1.00 2.79 H new ATOM 1521 N VAL A 101 9.666 -9.097 -10.878 1.00 0.62 N ATOM 1522 CA VAL A 101 8.294 -8.623 -10.910 1.00 0.51 C ATOM 1523 C VAL A 101 7.444 -9.339 -9.866 1.00 0.49 C ATOM 1524 O VAL A 101 7.390 -10.568 -9.818 1.00 0.64 O ATOM 1525 CB VAL A 101 7.669 -8.780 -12.314 1.00 0.60 C ATOM 1526 CG1 VAL A 101 8.305 -7.795 -13.286 1.00 1.22 C ATOM 1527 CG2 VAL A 101 7.828 -10.204 -12.829 1.00 1.20 C ATOM 0 H VAL A 101 9.794 -10.048 -11.223 1.00 0.62 H new ATOM 0 HA VAL A 101 8.314 -7.560 -10.671 1.00 0.51 H new ATOM 0 HB VAL A 101 6.603 -8.565 -12.236 1.00 0.60 H new ATOM 0 HG11 VAL A 101 7.856 -7.916 -14.272 1.00 1.22 H new ATOM 0 HG12 VAL A 101 8.139 -6.777 -12.933 1.00 1.22 H new ATOM 0 HG13 VAL A 101 9.376 -7.986 -13.349 1.00 1.22 H new ATOM 0 HG21 VAL A 101 7.379 -10.285 -13.819 1.00 1.20 H new ATOM 0 HG22 VAL A 101 8.887 -10.453 -12.890 1.00 1.20 H new ATOM 0 HG23 VAL A 101 7.332 -10.895 -12.148 1.00 1.20 H new ATOM 1537 N PHE A 102 6.815 -8.547 -9.013 1.00 0.43 N ATOM 1538 CA PHE A 102 5.982 -9.059 -7.932 1.00 0.43 C ATOM 1539 C PHE A 102 4.520 -9.064 -8.337 1.00 0.35 C ATOM 1540 O PHE A 102 4.145 -8.414 -9.315 1.00 0.34 O ATOM 1541 CB PHE A 102 6.138 -8.161 -6.713 1.00 0.47 C ATOM 1542 CG PHE A 102 7.570 -7.944 -6.303 1.00 0.63 C ATOM 1543 CD1 PHE A 102 8.389 -9.018 -6.000 1.00 0.80 C ATOM 1544 CD2 PHE A 102 8.100 -6.665 -6.234 1.00 0.76 C ATOM 1545 CE1 PHE A 102 9.708 -8.822 -5.634 1.00 0.97 C ATOM 1546 CE2 PHE A 102 9.418 -6.462 -5.870 1.00 0.91 C ATOM 1547 CZ PHE A 102 10.223 -7.544 -5.570 1.00 0.99 C ATOM 0 H PHE A 102 6.866 -7.529 -9.049 1.00 0.43 H new ATOM 0 HA PHE A 102 6.297 -10.078 -7.706 1.00 0.43 H new ATOM 0 HB2 PHE A 102 5.679 -7.195 -6.923 1.00 0.47 H new ATOM 0 HB3 PHE A 102 5.592 -8.599 -5.877 1.00 0.47 H new ATOM 0 HD1 PHE A 102 7.993 -10.022 -6.050 1.00 0.80 H new ATOM 0 HD2 PHE A 102 7.475 -5.816 -6.468 1.00 0.76 H new ATOM 0 HE1 PHE A 102 10.335 -9.669 -5.398 1.00 0.97 H new ATOM 0 HE2 PHE A 102 9.818 -5.460 -5.820 1.00 0.91 H new ATOM 0 HZ PHE A 102 11.253 -7.389 -5.286 1.00 0.99 H new ATOM 1557 N ASP A 103 3.686 -9.769 -7.582 1.00 0.35 N ATOM 1558 CA ASP A 103 2.252 -9.707 -7.835 1.00 0.34 C ATOM 1559 C ASP A 103 1.574 -8.893 -6.757 1.00 0.33 C ATOM 1560 O ASP A 103 1.867 -9.050 -5.584 1.00 0.40 O ATOM 1561 CB ASP A 103 1.561 -11.074 -7.876 1.00 0.45 C ATOM 1562 CG ASP A 103 2.471 -12.284 -7.956 1.00 0.86 C ATOM 1563 OD1 ASP A 103 3.465 -12.216 -8.708 1.00 1.46 O ATOM 1564 OD2 ASP A 103 2.235 -13.278 -7.243 1.00 1.53 O ATOM 0 H ASP A 103 3.967 -10.374 -6.810 1.00 0.35 H new ATOM 0 HA ASP A 103 2.155 -9.253 -8.821 1.00 0.34 H new ATOM 0 HB2 ASP A 103 0.941 -11.171 -6.985 1.00 0.45 H new ATOM 0 HB3 ASP A 103 0.890 -11.093 -8.735 1.00 0.45 H new ATOM 1569 N VAL A 104 0.659 -8.044 -7.170 1.00 0.30 N ATOM 1570 CA VAL A 104 -0.149 -7.258 -6.257 1.00 0.31 C ATOM 1571 C VAL A 104 -1.624 -7.558 -6.495 1.00 0.28 C ATOM 1572 O VAL A 104 -2.138 -7.351 -7.600 1.00 0.30 O ATOM 1573 CB VAL A 104 0.143 -5.750 -6.431 1.00 0.36 C ATOM 1574 CG1 VAL A 104 -1.093 -4.901 -6.188 1.00 0.45 C ATOM 1575 CG2 VAL A 104 1.256 -5.328 -5.493 1.00 0.63 C ATOM 0 H VAL A 104 0.452 -7.877 -8.155 1.00 0.30 H new ATOM 0 HA VAL A 104 0.104 -7.528 -5.232 1.00 0.31 H new ATOM 0 HB VAL A 104 0.454 -5.590 -7.463 1.00 0.36 H new ATOM 0 HG11 VAL A 104 -0.843 -3.848 -6.321 1.00 0.45 H new ATOM 0 HG12 VAL A 104 -1.872 -5.181 -6.897 1.00 0.45 H new ATOM 0 HG13 VAL A 104 -1.452 -5.063 -5.172 1.00 0.45 H new ATOM 0 HG21 VAL A 104 1.456 -4.264 -5.621 1.00 0.63 H new ATOM 0 HG22 VAL A 104 0.956 -5.519 -4.463 1.00 0.63 H new ATOM 0 HG23 VAL A 104 2.158 -5.897 -5.719 1.00 0.63 H new ATOM 1585 N ARG A 105 -2.296 -8.068 -5.467 1.00 0.28 N ATOM 1586 CA ARG A 105 -3.675 -8.518 -5.608 1.00 0.26 C ATOM 1587 C ARG A 105 -4.605 -7.774 -4.654 1.00 0.28 C ATOM 1588 O ARG A 105 -4.258 -7.513 -3.504 1.00 0.39 O ATOM 1589 CB ARG A 105 -3.760 -10.025 -5.352 1.00 0.37 C ATOM 1590 CG ARG A 105 -2.608 -10.788 -5.975 1.00 0.64 C ATOM 1591 CD ARG A 105 -2.688 -12.282 -5.721 1.00 0.57 C ATOM 1592 NE ARG A 105 -1.465 -12.951 -6.167 1.00 1.11 N ATOM 1593 CZ ARG A 105 -1.439 -14.080 -6.876 1.00 1.36 C ATOM 1594 NH1 ARG A 105 -2.567 -14.690 -7.211 1.00 1.37 N ATOM 1595 NH2 ARG A 105 -0.276 -14.592 -7.271 1.00 1.95 N ATOM 0 H ARG A 105 -1.908 -8.179 -4.530 1.00 0.28 H new ATOM 0 HA ARG A 105 -3.997 -8.303 -6.627 1.00 0.26 H new ATOM 0 HB2 ARG A 105 -3.773 -10.207 -4.277 1.00 0.37 H new ATOM 0 HB3 ARG A 105 -4.701 -10.405 -5.751 1.00 0.37 H new ATOM 0 HG2 ARG A 105 -2.597 -10.607 -7.050 1.00 0.64 H new ATOM 0 HG3 ARG A 105 -1.668 -10.406 -5.577 1.00 0.64 H new ATOM 0 HD2 ARG A 105 -2.842 -12.467 -4.658 1.00 0.57 H new ATOM 0 HD3 ARG A 105 -3.548 -12.699 -6.245 1.00 0.57 H new ATOM 0 HE ARG A 105 -0.572 -12.525 -5.919 1.00 1.11 H new ATOM 0 HH11 ARG A 105 -3.464 -14.296 -6.926 1.00 1.37 H new ATOM 0 HH12 ARG A 105 -2.538 -15.553 -7.754 1.00 1.37 H new ATOM 0 HH21 ARG A 105 0.596 -14.121 -7.031 1.00 1.95 H new ATOM 0 HH22 ARG A 105 -0.257 -15.456 -7.813 1.00 1.95 H new ATOM 1609 N VAL A 106 -5.779 -7.430 -5.163 1.00 0.28 N ATOM 1610 CA VAL A 106 -6.812 -6.750 -4.400 1.00 0.31 C ATOM 1611 C VAL A 106 -8.088 -7.582 -4.419 1.00 0.28 C ATOM 1612 O VAL A 106 -8.815 -7.582 -5.407 1.00 0.34 O ATOM 1613 CB VAL A 106 -7.100 -5.351 -4.986 1.00 0.39 C ATOM 1614 CG1 VAL A 106 -8.193 -4.634 -4.213 1.00 1.44 C ATOM 1615 CG2 VAL A 106 -5.830 -4.514 -5.021 1.00 1.41 C ATOM 0 H VAL A 106 -6.043 -7.618 -6.130 1.00 0.28 H new ATOM 0 HA VAL A 106 -6.462 -6.629 -3.375 1.00 0.31 H new ATOM 0 HB VAL A 106 -7.456 -5.488 -6.007 1.00 0.39 H new ATOM 0 HG11 VAL A 106 -8.368 -3.653 -4.655 1.00 1.44 H new ATOM 0 HG12 VAL A 106 -9.112 -5.219 -4.254 1.00 1.44 H new ATOM 0 HG13 VAL A 106 -7.885 -4.514 -3.174 1.00 1.44 H new ATOM 0 HG21 VAL A 106 -6.053 -3.532 -5.437 1.00 1.41 H new ATOM 0 HG22 VAL A 106 -5.442 -4.400 -4.009 1.00 1.41 H new ATOM 0 HG23 VAL A 106 -5.084 -5.010 -5.642 1.00 1.41 H new ATOM 1625 N ASN A 107 -8.326 -8.318 -3.338 1.00 0.28 N ATOM 1626 CA ASN A 107 -9.451 -9.253 -3.259 1.00 0.28 C ATOM 1627 C ASN A 107 -9.257 -10.342 -4.312 1.00 0.29 C ATOM 1628 O ASN A 107 -10.166 -10.716 -5.049 1.00 0.38 O ATOM 1629 CB ASN A 107 -10.797 -8.510 -3.413 1.00 0.30 C ATOM 1630 CG ASN A 107 -12.019 -9.421 -3.400 1.00 0.96 C ATOM 1631 OD1 ASN A 107 -12.590 -9.727 -4.445 1.00 1.57 O ATOM 1632 ND2 ASN A 107 -12.433 -9.863 -2.223 1.00 1.65 N ATOM 0 H ASN A 107 -7.751 -8.286 -2.496 1.00 0.28 H new ATOM 0 HA ASN A 107 -9.479 -9.726 -2.277 1.00 0.28 H new ATOM 0 HB2 ASN A 107 -10.892 -7.782 -2.607 1.00 0.30 H new ATOM 0 HB3 ASN A 107 -10.785 -7.950 -4.348 1.00 0.30 H new ATOM 0 HD21 ASN A 107 -13.247 -10.475 -2.166 1.00 1.65 H new ATOM 0 HD22 ASN A 107 -11.938 -9.591 -1.373 1.00 1.65 H new ATOM 1639 N GLY A 108 -8.025 -10.822 -4.399 1.00 0.29 N ATOM 1640 CA GLY A 108 -7.704 -11.865 -5.343 1.00 0.35 C ATOM 1641 C GLY A 108 -7.416 -11.330 -6.729 1.00 0.32 C ATOM 1642 O GLY A 108 -7.025 -12.076 -7.623 1.00 0.42 O ATOM 0 H GLY A 108 -7.241 -10.504 -3.829 1.00 0.29 H new ATOM 0 HA2 GLY A 108 -6.837 -12.419 -4.985 1.00 0.35 H new ATOM 0 HA3 GLY A 108 -8.534 -12.570 -5.395 1.00 0.35 H new ATOM 1646 N HIS A 109 -7.604 -10.036 -6.902 1.00 0.26 N ATOM 1647 CA HIS A 109 -7.476 -9.407 -8.204 1.00 0.27 C ATOM 1648 C HIS A 109 -6.063 -8.884 -8.425 1.00 0.23 C ATOM 1649 O HIS A 109 -5.678 -7.878 -7.839 1.00 0.24 O ATOM 1650 CB HIS A 109 -8.472 -8.256 -8.310 1.00 0.33 C ATOM 1651 CG HIS A 109 -9.905 -8.689 -8.373 1.00 0.44 C ATOM 1652 ND1 HIS A 109 -10.529 -9.046 -9.544 1.00 0.57 N ATOM 1653 CD2 HIS A 109 -10.836 -8.820 -7.401 1.00 0.53 C ATOM 1654 CE1 HIS A 109 -11.781 -9.375 -9.293 1.00 0.68 C ATOM 1655 NE2 HIS A 109 -11.995 -9.248 -7.996 1.00 0.65 N ATOM 0 H HIS A 109 -7.849 -9.393 -6.149 1.00 0.26 H new ATOM 0 HA HIS A 109 -7.686 -10.153 -8.970 1.00 0.27 H new ATOM 0 HB2 HIS A 109 -8.341 -7.596 -7.452 1.00 0.33 H new ATOM 0 HB3 HIS A 109 -8.241 -7.671 -9.200 1.00 0.33 H new ATOM 0 HD1 HIS A 109 -10.091 -9.055 -10.465 1.00 0.57 H new ATOM 0 HD2 HIS A 109 -10.693 -8.624 -6.349 1.00 0.53 H new ATOM 0 HE1 HIS A 109 -12.509 -9.694 -10.025 1.00 0.68 H new ATOM 1664 N THR A 110 -5.295 -9.559 -9.270 1.00 0.27 N ATOM 1665 CA THR A 110 -3.937 -9.124 -9.568 1.00 0.30 C ATOM 1666 C THR A 110 -3.933 -7.843 -10.393 1.00 0.30 C ATOM 1667 O THR A 110 -3.931 -7.882 -11.624 1.00 0.48 O ATOM 1668 CB THR A 110 -3.131 -10.209 -10.308 1.00 0.40 C ATOM 1669 OG1 THR A 110 -3.953 -10.879 -11.273 1.00 0.77 O ATOM 1670 CG2 THR A 110 -2.558 -11.217 -9.332 1.00 0.61 C ATOM 0 H THR A 110 -5.587 -10.405 -9.759 1.00 0.27 H new ATOM 0 HA THR A 110 -3.459 -8.934 -8.607 1.00 0.30 H new ATOM 0 HB THR A 110 -2.307 -9.718 -10.826 1.00 0.40 H new ATOM 0 HG1 THR A 110 -3.424 -11.563 -11.734 1.00 0.77 H new ATOM 0 HG21 THR A 110 -1.994 -11.972 -9.879 1.00 0.61 H new ATOM 0 HG22 THR A 110 -1.898 -10.708 -8.629 1.00 0.61 H new ATOM 0 HG23 THR A 110 -3.370 -11.696 -8.785 1.00 0.61 H new ATOM 1678 N VAL A 111 -3.946 -6.712 -9.704 1.00 0.26 N ATOM 1679 CA VAL A 111 -3.886 -5.418 -10.362 1.00 0.29 C ATOM 1680 C VAL A 111 -2.513 -5.219 -10.982 1.00 0.29 C ATOM 1681 O VAL A 111 -2.385 -4.913 -12.167 1.00 0.38 O ATOM 1682 CB VAL A 111 -4.168 -4.266 -9.377 1.00 0.32 C ATOM 1683 CG1 VAL A 111 -4.237 -2.931 -10.107 1.00 0.93 C ATOM 1684 CG2 VAL A 111 -5.449 -4.528 -8.602 1.00 0.94 C ATOM 0 H VAL A 111 -3.998 -6.665 -8.686 1.00 0.26 H new ATOM 0 HA VAL A 111 -4.654 -5.404 -11.135 1.00 0.29 H new ATOM 0 HB VAL A 111 -3.344 -4.216 -8.666 1.00 0.32 H new ATOM 0 HG11 VAL A 111 -4.437 -2.134 -9.390 1.00 0.93 H new ATOM 0 HG12 VAL A 111 -3.287 -2.740 -10.606 1.00 0.93 H new ATOM 0 HG13 VAL A 111 -5.036 -2.962 -10.847 1.00 0.93 H new ATOM 0 HG21 VAL A 111 -5.632 -3.704 -7.912 1.00 0.94 H new ATOM 0 HG22 VAL A 111 -6.284 -4.611 -9.297 1.00 0.94 H new ATOM 0 HG23 VAL A 111 -5.351 -5.457 -8.040 1.00 0.94 H new ATOM 1694 N VAL A 112 -1.480 -5.422 -10.179 1.00 0.27 N ATOM 1695 CA VAL A 112 -0.121 -5.269 -10.663 1.00 0.28 C ATOM 1696 C VAL A 112 0.643 -6.571 -10.497 1.00 0.28 C ATOM 1697 O VAL A 112 1.286 -6.795 -9.480 1.00 0.27 O ATOM 1698 CB VAL A 112 0.624 -4.139 -9.916 1.00 0.29 C ATOM 1699 CG1 VAL A 112 1.998 -3.896 -10.528 1.00 0.35 C ATOM 1700 CG2 VAL A 112 -0.198 -2.860 -9.920 1.00 0.33 C ATOM 0 H VAL A 112 -1.557 -5.691 -9.198 1.00 0.27 H new ATOM 0 HA VAL A 112 -0.176 -5.005 -11.719 1.00 0.28 H new ATOM 0 HB VAL A 112 0.765 -4.453 -8.882 1.00 0.29 H new ATOM 0 HG11 VAL A 112 2.502 -3.097 -9.985 1.00 0.35 H new ATOM 0 HG12 VAL A 112 2.591 -4.808 -10.464 1.00 0.35 H new ATOM 0 HG13 VAL A 112 1.885 -3.609 -11.573 1.00 0.35 H new ATOM 0 HG21 VAL A 112 0.344 -2.077 -9.389 1.00 0.33 H new ATOM 0 HG22 VAL A 112 -0.376 -2.545 -10.948 1.00 0.33 H new ATOM 0 HG23 VAL A 112 -1.153 -3.039 -9.425 1.00 0.33 H new ATOM 1710 N LYS A 113 0.578 -7.427 -11.498 1.00 0.33 N ATOM 1711 CA LYS A 113 1.375 -8.638 -11.492 1.00 0.37 C ATOM 1712 C LYS A 113 2.551 -8.415 -12.423 1.00 0.41 C ATOM 1713 O LYS A 113 2.583 -8.914 -13.552 1.00 0.68 O ATOM 1714 CB LYS A 113 0.540 -9.845 -11.931 1.00 0.44 C ATOM 1715 CG LYS A 113 1.089 -11.206 -11.491 1.00 1.24 C ATOM 1716 CD LYS A 113 2.576 -11.367 -11.789 1.00 2.09 C ATOM 1717 CE LYS A 113 2.969 -12.821 -11.972 1.00 3.07 C ATOM 1718 NZ LYS A 113 2.627 -13.662 -10.794 1.00 4.01 N ATOM 0 H LYS A 113 -0.014 -7.308 -12.320 1.00 0.33 H new ATOM 0 HA LYS A 113 1.731 -8.855 -10.485 1.00 0.37 H new ATOM 0 HB2 LYS A 113 -0.470 -9.732 -11.536 1.00 0.44 H new ATOM 0 HB3 LYS A 113 0.460 -9.836 -13.018 1.00 0.44 H new ATOM 0 HG2 LYS A 113 0.922 -11.332 -10.421 1.00 1.24 H new ATOM 0 HG3 LYS A 113 0.534 -11.997 -11.996 1.00 1.24 H new ATOM 0 HD2 LYS A 113 2.827 -10.808 -12.691 1.00 2.09 H new ATOM 0 HD3 LYS A 113 3.157 -10.935 -10.974 1.00 2.09 H new ATOM 0 HE2 LYS A 113 2.469 -13.220 -12.855 1.00 3.07 H new ATOM 0 HE3 LYS A 113 4.041 -12.882 -12.158 1.00 3.07 H new ATOM 0 HZ1 LYS A 113 2.855 -14.656 -10.999 1.00 4.01 H new ATOM 0 HZ2 LYS A 113 3.175 -13.344 -9.970 1.00 4.01 H new ATOM 0 HZ3 LYS A 113 1.611 -13.575 -10.589 1.00 4.01 H new ATOM 1732 N ASP A 114 3.506 -7.665 -11.910 1.00 0.39 N ATOM 1733 CA ASP A 114 4.659 -7.196 -12.672 1.00 0.45 C ATOM 1734 C ASP A 114 5.368 -6.096 -11.900 1.00 0.38 C ATOM 1735 O ASP A 114 6.036 -5.249 -12.487 1.00 0.45 O ATOM 1736 CB ASP A 114 4.248 -6.658 -14.057 1.00 0.63 C ATOM 1737 CG ASP A 114 3.309 -5.459 -13.997 1.00 1.33 C ATOM 1738 OD1 ASP A 114 2.124 -5.637 -13.636 1.00 1.52 O ATOM 1739 OD2 ASP A 114 3.758 -4.321 -14.264 1.00 1.96 O ATOM 0 H ASP A 114 3.508 -7.357 -10.938 1.00 0.39 H new ATOM 0 HA ASP A 114 5.326 -8.045 -12.821 1.00 0.45 H new ATOM 0 HB2 ASP A 114 5.145 -6.378 -14.609 1.00 0.63 H new ATOM 0 HB3 ASP A 114 3.765 -7.458 -14.619 1.00 0.63 H new ATOM 1744 N LEU A 115 5.241 -6.119 -10.578 1.00 0.33 N ATOM 1745 CA LEU A 115 5.746 -5.027 -9.763 1.00 0.34 C ATOM 1746 C LEU A 115 7.269 -5.040 -9.693 1.00 0.37 C ATOM 1747 O LEU A 115 7.861 -5.831 -8.965 1.00 0.47 O ATOM 1748 CB LEU A 115 5.142 -5.047 -8.356 1.00 0.38 C ATOM 1749 CG LEU A 115 4.612 -3.696 -7.871 1.00 0.45 C ATOM 1750 CD1 LEU A 115 4.379 -3.736 -6.379 1.00 1.18 C ATOM 1751 CD2 LEU A 115 5.559 -2.562 -8.234 1.00 1.07 C ATOM 0 H LEU A 115 4.797 -6.874 -10.055 1.00 0.33 H new ATOM 0 HA LEU A 115 5.438 -4.100 -10.247 1.00 0.34 H new ATOM 0 HB2 LEU A 115 4.327 -5.771 -8.335 1.00 0.38 H new ATOM 0 HB3 LEU A 115 5.899 -5.398 -7.655 1.00 0.38 H new ATOM 0 HG LEU A 115 3.664 -3.505 -8.374 1.00 0.45 H new ATOM 0 HD11 LEU A 115 4.002 -2.770 -6.044 1.00 1.18 H new ATOM 0 HD12 LEU A 115 3.649 -4.511 -6.145 1.00 1.18 H new ATOM 0 HD13 LEU A 115 5.317 -3.956 -5.870 1.00 1.18 H new ATOM 0 HD21 LEU A 115 5.151 -1.618 -7.874 1.00 1.07 H new ATOM 0 HD22 LEU A 115 6.530 -2.737 -7.772 1.00 1.07 H new ATOM 0 HD23 LEU A 115 5.675 -2.518 -9.317 1.00 1.07 H new ATOM 1763 N ASP A 116 7.890 -4.176 -10.478 1.00 0.39 N ATOM 1764 CA ASP A 116 9.327 -3.966 -10.417 1.00 0.44 C ATOM 1765 C ASP A 116 9.621 -2.516 -10.022 1.00 0.43 C ATOM 1766 O ASP A 116 9.817 -1.630 -10.861 1.00 0.48 O ATOM 1767 CB ASP A 116 10.000 -4.351 -11.746 1.00 0.53 C ATOM 1768 CG ASP A 116 9.453 -3.617 -12.960 1.00 1.28 C ATOM 1769 OD1 ASP A 116 8.307 -3.120 -12.910 1.00 1.93 O ATOM 1770 OD2 ASP A 116 10.175 -3.547 -13.974 1.00 1.83 O ATOM 0 H ASP A 116 7.414 -3.602 -11.174 1.00 0.39 H new ATOM 0 HA ASP A 116 9.751 -4.617 -9.653 1.00 0.44 H new ATOM 0 HB2 ASP A 116 11.069 -4.154 -11.669 1.00 0.53 H new ATOM 0 HB3 ASP A 116 9.883 -5.424 -11.901 1.00 0.53 H new ATOM 1775 N ILE A 117 9.640 -2.287 -8.714 1.00 0.44 N ATOM 1776 CA ILE A 117 9.746 -0.947 -8.143 1.00 0.46 C ATOM 1777 C ILE A 117 10.961 -0.183 -8.682 1.00 0.48 C ATOM 1778 O ILE A 117 10.883 1.025 -8.921 1.00 0.51 O ATOM 1779 CB ILE A 117 9.811 -1.011 -6.601 1.00 0.52 C ATOM 1780 CG1 ILE A 117 8.603 -1.781 -6.057 1.00 0.56 C ATOM 1781 CG2 ILE A 117 9.866 0.387 -6.002 1.00 0.58 C ATOM 1782 CD1 ILE A 117 8.612 -1.956 -4.553 1.00 0.82 C ATOM 0 H ILE A 117 9.582 -3.028 -8.016 1.00 0.44 H new ATOM 0 HA ILE A 117 8.849 -0.405 -8.444 1.00 0.46 H new ATOM 0 HB ILE A 117 10.722 -1.536 -6.315 1.00 0.52 H new ATOM 0 HG12 ILE A 117 7.691 -1.258 -6.346 1.00 0.56 H new ATOM 0 HG13 ILE A 117 8.570 -2.764 -6.527 1.00 0.56 H new ATOM 0 HG21 ILE A 117 9.911 0.316 -4.915 1.00 0.58 H new ATOM 0 HG22 ILE A 117 10.752 0.905 -6.369 1.00 0.58 H new ATOM 0 HG23 ILE A 117 8.974 0.943 -6.292 1.00 0.58 H new ATOM 0 HD11 ILE A 117 7.725 -2.510 -4.246 1.00 0.82 H new ATOM 0 HD12 ILE A 117 9.505 -2.506 -4.256 1.00 0.82 H new ATOM 0 HD13 ILE A 117 8.613 -0.977 -4.073 1.00 0.82 H new ATOM 1794 N PHE A 118 12.067 -0.891 -8.886 1.00 0.54 N ATOM 1795 CA PHE A 118 13.300 -0.282 -9.388 1.00 0.62 C ATOM 1796 C PHE A 118 13.083 0.392 -10.745 1.00 0.65 C ATOM 1797 O PHE A 118 13.627 1.463 -11.008 1.00 0.74 O ATOM 1798 CB PHE A 118 14.412 -1.330 -9.499 1.00 0.70 C ATOM 1799 CG PHE A 118 15.734 -0.755 -9.925 1.00 0.81 C ATOM 1800 CD1 PHE A 118 16.530 -0.066 -9.024 1.00 0.89 C ATOM 1801 CD2 PHE A 118 16.182 -0.911 -11.226 1.00 0.92 C ATOM 1802 CE1 PHE A 118 17.748 0.457 -9.411 1.00 1.02 C ATOM 1803 CE2 PHE A 118 17.401 -0.389 -11.620 1.00 1.06 C ATOM 1804 CZ PHE A 118 18.172 0.321 -10.712 1.00 1.08 C ATOM 0 H PHE A 118 12.137 -1.893 -8.711 1.00 0.54 H new ATOM 0 HA PHE A 118 13.600 0.484 -8.673 1.00 0.62 H new ATOM 0 HB2 PHE A 118 14.533 -1.824 -8.535 1.00 0.70 H new ATOM 0 HB3 PHE A 118 14.110 -2.095 -10.214 1.00 0.70 H new ATOM 0 HD1 PHE A 118 16.193 0.064 -8.006 1.00 0.89 H new ATOM 0 HD2 PHE A 118 15.574 -1.446 -11.940 1.00 0.92 H new ATOM 0 HE1 PHE A 118 18.367 0.973 -8.692 1.00 1.02 H new ATOM 0 HE2 PHE A 118 17.751 -0.534 -12.631 1.00 1.06 H new ATOM 0 HZ PHE A 118 19.104 0.767 -11.026 1.00 1.08 H new ATOM 1814 N ASP A 119 12.283 -0.230 -11.597 1.00 0.61 N ATOM 1815 CA ASP A 119 11.965 0.346 -12.901 1.00 0.68 C ATOM 1816 C ASP A 119 11.072 1.563 -12.739 1.00 0.69 C ATOM 1817 O ASP A 119 11.177 2.538 -13.484 1.00 0.81 O ATOM 1818 CB ASP A 119 11.265 -0.685 -13.788 1.00 0.68 C ATOM 1819 CG ASP A 119 10.667 -0.071 -15.042 1.00 0.82 C ATOM 1820 OD1 ASP A 119 11.406 0.120 -16.034 1.00 0.96 O ATOM 1821 OD2 ASP A 119 9.452 0.233 -15.043 1.00 0.89 O ATOM 0 H ASP A 119 11.842 -1.131 -11.413 1.00 0.61 H new ATOM 0 HA ASP A 119 12.899 0.647 -13.375 1.00 0.68 H new ATOM 0 HB2 ASP A 119 11.979 -1.458 -14.072 1.00 0.68 H new ATOM 0 HB3 ASP A 119 10.476 -1.174 -13.216 1.00 0.68 H new ATOM 1826 N ARG A 120 10.211 1.509 -11.736 1.00 0.61 N ATOM 1827 CA ARG A 120 9.201 2.535 -11.547 1.00 0.66 C ATOM 1828 C ARG A 120 9.816 3.816 -11.001 1.00 0.75 C ATOM 1829 O ARG A 120 9.604 4.897 -11.549 1.00 0.97 O ATOM 1830 CB ARG A 120 8.116 2.032 -10.595 1.00 0.63 C ATOM 1831 CG ARG A 120 7.631 0.632 -10.924 1.00 0.59 C ATOM 1832 CD ARG A 120 7.074 0.541 -12.335 1.00 0.72 C ATOM 1833 NE ARG A 120 6.872 -0.846 -12.739 1.00 1.02 N ATOM 1834 CZ ARG A 120 5.704 -1.371 -13.099 1.00 1.31 C ATOM 1835 NH1 ARG A 120 4.604 -0.623 -13.142 1.00 1.69 N ATOM 1836 NH2 ARG A 120 5.648 -2.654 -13.421 1.00 1.65 N ATOM 0 H ARG A 120 10.192 0.764 -11.040 1.00 0.61 H new ATOM 0 HA ARG A 120 8.757 2.756 -12.517 1.00 0.66 H new ATOM 0 HB2 ARG A 120 8.502 2.045 -9.576 1.00 0.63 H new ATOM 0 HB3 ARG A 120 7.270 2.718 -10.624 1.00 0.63 H new ATOM 0 HG2 ARG A 120 8.455 -0.073 -10.813 1.00 0.59 H new ATOM 0 HG3 ARG A 120 6.861 0.338 -10.210 1.00 0.59 H new ATOM 0 HD2 ARG A 120 6.128 1.079 -12.390 1.00 0.72 H new ATOM 0 HD3 ARG A 120 7.758 1.028 -13.030 1.00 0.72 H new ATOM 0 HE ARG A 120 7.687 -1.459 -12.746 1.00 1.02 H new ATOM 0 HH11 ARG A 120 4.650 0.366 -12.897 1.00 1.69 H new ATOM 0 HH12 ARG A 120 3.715 -1.039 -13.420 1.00 1.69 H new ATOM 0 HH21 ARG A 120 6.493 -3.225 -13.391 1.00 1.65 H new ATOM 0 HH22 ARG A 120 4.760 -3.072 -13.699 1.00 1.65 H new ATOM 1850 N VAL A 121 10.581 3.692 -9.922 1.00 0.65 N ATOM 1851 CA VAL A 121 11.146 4.869 -9.260 1.00 0.75 C ATOM 1852 C VAL A 121 12.674 4.919 -9.325 1.00 0.80 C ATOM 1853 O VAL A 121 13.260 6.000 -9.335 1.00 0.95 O ATOM 1854 CB VAL A 121 10.700 4.968 -7.783 1.00 0.79 C ATOM 1855 CG1 VAL A 121 9.212 5.255 -7.697 1.00 1.42 C ATOM 1856 CG2 VAL A 121 11.036 3.694 -7.020 1.00 1.49 C ATOM 0 H VAL A 121 10.824 2.801 -9.489 1.00 0.65 H new ATOM 0 HA VAL A 121 10.755 5.722 -9.815 1.00 0.75 H new ATOM 0 HB VAL A 121 11.245 5.792 -7.323 1.00 0.79 H new ATOM 0 HG11 VAL A 121 8.914 5.322 -6.651 1.00 1.42 H new ATOM 0 HG12 VAL A 121 8.994 6.199 -8.197 1.00 1.42 H new ATOM 0 HG13 VAL A 121 8.658 4.451 -8.181 1.00 1.42 H new ATOM 0 HG21 VAL A 121 10.710 3.793 -5.985 1.00 1.49 H new ATOM 0 HG22 VAL A 121 10.526 2.848 -7.481 1.00 1.49 H new ATOM 0 HG23 VAL A 121 12.113 3.527 -7.047 1.00 1.49 H new ATOM 1866 N GLY A 122 13.320 3.761 -9.375 1.00 0.76 N ATOM 1867 CA GLY A 122 14.772 3.726 -9.378 1.00 0.89 C ATOM 1868 C GLY A 122 15.344 3.797 -7.978 1.00 1.00 C ATOM 1869 O GLY A 122 15.816 2.794 -7.439 1.00 1.40 O ATOM 0 H GLY A 122 12.868 2.848 -9.413 1.00 0.76 H new ATOM 0 HA2 GLY A 122 15.112 2.810 -9.862 1.00 0.89 H new ATOM 0 HA3 GLY A 122 15.154 4.559 -9.968 1.00 0.89 H new ATOM 1873 N HIS A 123 15.289 4.980 -7.381 1.00 1.10 N ATOM 1874 CA HIS A 123 15.758 5.177 -6.012 1.00 1.36 C ATOM 1875 C HIS A 123 14.735 4.644 -5.024 1.00 1.08 C ATOM 1876 O HIS A 123 13.538 4.628 -5.316 1.00 1.41 O ATOM 1877 CB HIS A 123 15.988 6.662 -5.727 1.00 2.01 C ATOM 1878 CG HIS A 123 17.267 7.210 -6.270 1.00 2.61 C ATOM 1879 ND1 HIS A 123 18.293 7.635 -5.463 1.00 3.35 N ATOM 1880 CD2 HIS A 123 17.669 7.436 -7.538 1.00 3.26 C ATOM 1881 CE1 HIS A 123 19.271 8.103 -6.210 1.00 4.11 C ATOM 1882 NE2 HIS A 123 18.920 7.996 -7.477 1.00 4.08 N ATOM 0 H HIS A 123 14.923 5.823 -7.824 1.00 1.10 H new ATOM 0 HA HIS A 123 16.698 4.637 -5.900 1.00 1.36 H new ATOM 0 HB2 HIS A 123 15.158 7.231 -6.145 1.00 2.01 H new ATOM 0 HB3 HIS A 123 15.970 6.818 -4.648 1.00 2.01 H new ATOM 0 HD2 HIS A 123 17.109 7.217 -8.435 1.00 3.26 H new ATOM 0 HE1 HIS A 123 20.204 8.507 -5.846 1.00 4.11 H new ATOM 0 HE2 HIS A 123 19.484 8.282 -8.277 1.00 4.08 H new ATOM 1891 N SER A 124 15.206 4.208 -3.861 1.00 1.19 N ATOM 1892 CA SER A 124 14.322 3.775 -2.788 1.00 1.00 C ATOM 1893 C SER A 124 13.558 4.982 -2.226 1.00 1.02 C ATOM 1894 O SER A 124 13.926 5.565 -1.203 1.00 1.97 O ATOM 1895 CB SER A 124 15.127 3.067 -1.689 1.00 1.06 C ATOM 1896 OG SER A 124 14.278 2.463 -0.724 1.00 1.72 O ATOM 0 H SER A 124 16.199 4.145 -3.638 1.00 1.19 H new ATOM 0 HA SER A 124 13.597 3.063 -3.183 1.00 1.00 H new ATOM 0 HB2 SER A 124 15.766 2.307 -2.138 1.00 1.06 H new ATOM 0 HB3 SER A 124 15.783 3.786 -1.198 1.00 1.06 H new ATOM 0 HG SER A 124 14.196 1.505 -0.914 1.00 1.72 H new ATOM 1902 N THR A 125 12.512 5.361 -2.939 1.00 0.66 N ATOM 1903 CA THR A 125 11.701 6.514 -2.600 1.00 0.53 C ATOM 1904 C THR A 125 10.241 6.085 -2.489 1.00 0.48 C ATOM 1905 O THR A 125 9.948 5.026 -1.932 1.00 0.60 O ATOM 1906 CB THR A 125 11.874 7.619 -3.661 1.00 0.60 C ATOM 1907 OG1 THR A 125 11.596 7.098 -4.966 1.00 0.81 O ATOM 1908 CG2 THR A 125 13.289 8.178 -3.633 1.00 0.85 C ATOM 0 H THR A 125 12.200 4.871 -3.778 1.00 0.66 H new ATOM 0 HA THR A 125 12.023 6.920 -1.641 1.00 0.53 H new ATOM 0 HB THR A 125 11.173 8.421 -3.431 1.00 0.60 H new ATOM 0 HG1 THR A 125 12.264 6.419 -5.196 1.00 0.81 H new ATOM 0 HG21 THR A 125 13.388 8.956 -4.390 1.00 0.85 H new ATOM 0 HG22 THR A 125 13.494 8.601 -2.649 1.00 0.85 H new ATOM 0 HG23 THR A 125 14.000 7.378 -3.840 1.00 0.85 H new ATOM 1916 N ALA A 126 9.328 6.879 -3.012 1.00 0.44 N ATOM 1917 CA ALA A 126 7.921 6.541 -2.923 1.00 0.45 C ATOM 1918 C ALA A 126 7.398 5.980 -4.242 1.00 0.40 C ATOM 1919 O ALA A 126 7.414 6.659 -5.268 1.00 0.50 O ATOM 1920 CB ALA A 126 7.109 7.753 -2.500 1.00 0.57 C ATOM 0 H ALA A 126 9.531 7.753 -3.498 1.00 0.44 H new ATOM 0 HA ALA A 126 7.812 5.765 -2.166 1.00 0.45 H new ATOM 0 HB1 ALA A 126 6.055 7.481 -2.438 1.00 0.57 H new ATOM 0 HB2 ALA A 126 7.452 8.099 -1.525 1.00 0.57 H new ATOM 0 HB3 ALA A 126 7.236 8.550 -3.233 1.00 0.57 H new ATOM 1926 N HIS A 127 6.970 4.724 -4.218 1.00 0.33 N ATOM 1927 CA HIS A 127 6.259 4.139 -5.345 1.00 0.32 C ATOM 1928 C HIS A 127 4.829 3.863 -4.927 1.00 0.34 C ATOM 1929 O HIS A 127 4.572 2.912 -4.215 1.00 0.55 O ATOM 1930 CB HIS A 127 6.902 2.826 -5.798 1.00 0.34 C ATOM 1931 CG HIS A 127 6.169 2.207 -6.950 1.00 0.38 C ATOM 1932 ND1 HIS A 127 5.839 2.904 -8.089 1.00 0.44 N ATOM 1933 CD2 HIS A 127 5.633 0.977 -7.100 1.00 0.48 C ATOM 1934 CE1 HIS A 127 5.130 2.131 -8.885 1.00 0.50 C ATOM 1935 NE2 HIS A 127 4.983 0.953 -8.309 1.00 0.51 N ATOM 0 H HIS A 127 7.104 4.091 -3.429 1.00 0.33 H new ATOM 0 HA HIS A 127 6.298 4.842 -6.177 1.00 0.32 H new ATOM 0 HB2 HIS A 127 7.937 3.010 -6.084 1.00 0.34 H new ATOM 0 HB3 HIS A 127 6.922 2.126 -4.963 1.00 0.34 H new ATOM 0 HD2 HIS A 127 5.703 0.160 -6.397 1.00 0.48 H new ATOM 0 HE1 HIS A 127 4.734 2.414 -9.849 1.00 0.50 H new ATOM 0 HE2 HIS A 127 4.473 0.159 -8.696 1.00 0.51 H new ATOM 1944 N ASP A 128 3.900 4.646 -5.405 1.00 0.38 N ATOM 1945 CA ASP A 128 2.550 4.586 -4.879 1.00 0.47 C ATOM 1946 C ASP A 128 1.614 3.881 -5.839 1.00 0.46 C ATOM 1947 O ASP A 128 1.409 4.330 -6.968 1.00 0.61 O ATOM 1948 CB ASP A 128 2.028 5.995 -4.579 1.00 0.66 C ATOM 1949 CG ASP A 128 2.854 6.711 -3.530 1.00 0.99 C ATOM 1950 OD1 ASP A 128 2.575 6.530 -2.322 1.00 1.36 O ATOM 1951 OD2 ASP A 128 3.774 7.458 -3.910 1.00 1.64 O ATOM 0 H ASP A 128 4.043 5.328 -6.150 1.00 0.38 H new ATOM 0 HA ASP A 128 2.582 4.013 -3.953 1.00 0.47 H new ATOM 0 HB2 ASP A 128 2.027 6.581 -5.498 1.00 0.66 H new ATOM 0 HB3 ASP A 128 0.994 5.931 -4.241 1.00 0.66 H new ATOM 1956 N GLU A 129 1.070 2.761 -5.391 1.00 0.40 N ATOM 1957 CA GLU A 129 0.062 2.048 -6.153 1.00 0.41 C ATOM 1958 C GLU A 129 -1.319 2.573 -5.787 1.00 0.33 C ATOM 1959 O GLU A 129 -1.778 2.407 -4.658 1.00 0.39 O ATOM 1960 CB GLU A 129 0.137 0.541 -5.892 1.00 0.53 C ATOM 1961 CG GLU A 129 1.388 -0.118 -6.451 1.00 0.97 C ATOM 1962 CD GLU A 129 1.512 0.039 -7.955 1.00 0.72 C ATOM 1963 OE1 GLU A 129 0.476 0.255 -8.619 1.00 1.12 O ATOM 1964 OE2 GLU A 129 2.639 -0.069 -8.481 1.00 0.75 O ATOM 0 H GLU A 129 1.312 2.326 -4.500 1.00 0.40 H new ATOM 0 HA GLU A 129 0.247 2.216 -7.214 1.00 0.41 H new ATOM 0 HB2 GLU A 129 0.095 0.366 -4.817 1.00 0.53 H new ATOM 0 HB3 GLU A 129 -0.740 0.062 -6.328 1.00 0.53 H new ATOM 0 HG2 GLU A 129 2.266 0.314 -5.971 1.00 0.97 H new ATOM 0 HG3 GLU A 129 1.377 -1.179 -6.200 1.00 0.97 H new ATOM 1971 N ILE A 130 -1.956 3.239 -6.734 1.00 0.28 N ATOM 1972 CA ILE A 130 -3.296 3.763 -6.526 1.00 0.24 C ATOM 1973 C ILE A 130 -4.306 2.868 -7.236 1.00 0.25 C ATOM 1974 O ILE A 130 -4.359 2.829 -8.468 1.00 0.31 O ATOM 1975 CB ILE A 130 -3.420 5.209 -7.054 1.00 0.29 C ATOM 1976 CG1 ILE A 130 -2.336 6.088 -6.427 1.00 0.39 C ATOM 1977 CG2 ILE A 130 -4.805 5.768 -6.755 1.00 0.31 C ATOM 1978 CD1 ILE A 130 -2.279 7.487 -6.998 1.00 0.74 C ATOM 0 H ILE A 130 -1.566 3.430 -7.657 1.00 0.28 H new ATOM 0 HA ILE A 130 -3.498 3.775 -5.455 1.00 0.24 H new ATOM 0 HB ILE A 130 -3.283 5.203 -8.135 1.00 0.29 H new ATOM 0 HG12 ILE A 130 -2.509 6.151 -5.353 1.00 0.39 H new ATOM 0 HG13 ILE A 130 -1.367 5.609 -6.567 1.00 0.39 H new ATOM 0 HG21 ILE A 130 -4.875 6.788 -7.134 1.00 0.31 H new ATOM 0 HG22 ILE A 130 -5.560 5.148 -7.239 1.00 0.31 H new ATOM 0 HG23 ILE A 130 -4.972 5.769 -5.678 1.00 0.31 H new ATOM 0 HD11 ILE A 130 -1.487 8.050 -6.504 1.00 0.74 H new ATOM 0 HD12 ILE A 130 -2.075 7.435 -8.067 1.00 0.74 H new ATOM 0 HD13 ILE A 130 -3.234 7.986 -6.835 1.00 0.74 H new ATOM 1990 N ILE A 131 -5.096 2.147 -6.460 1.00 0.24 N ATOM 1991 CA ILE A 131 -6.002 1.151 -7.009 1.00 0.28 C ATOM 1992 C ILE A 131 -7.445 1.439 -6.605 1.00 0.25 C ATOM 1993 O ILE A 131 -7.877 1.068 -5.514 1.00 0.26 O ATOM 1994 CB ILE A 131 -5.614 -0.267 -6.535 1.00 0.35 C ATOM 1995 CG1 ILE A 131 -4.152 -0.562 -6.885 1.00 0.40 C ATOM 1996 CG2 ILE A 131 -6.536 -1.308 -7.159 1.00 0.40 C ATOM 1997 CD1 ILE A 131 -3.636 -1.867 -6.319 1.00 1.25 C ATOM 0 H ILE A 131 -5.129 2.232 -5.444 1.00 0.24 H new ATOM 0 HA ILE A 131 -5.920 1.202 -8.095 1.00 0.28 H new ATOM 0 HB ILE A 131 -5.727 -0.316 -5.452 1.00 0.35 H new ATOM 0 HG12 ILE A 131 -4.045 -0.581 -7.970 1.00 0.40 H new ATOM 0 HG13 ILE A 131 -3.529 0.253 -6.517 1.00 0.40 H new ATOM 0 HG21 ILE A 131 -6.249 -2.301 -6.815 1.00 0.40 H new ATOM 0 HG22 ILE A 131 -7.566 -1.105 -6.864 1.00 0.40 H new ATOM 0 HG23 ILE A 131 -6.454 -1.263 -8.245 1.00 0.40 H new ATOM 0 HD11 ILE A 131 -2.595 -2.004 -6.611 1.00 1.25 H new ATOM 0 HD12 ILE A 131 -3.709 -1.846 -5.232 1.00 1.25 H new ATOM 0 HD13 ILE A 131 -4.233 -2.693 -6.707 1.00 1.25 H new ATOM 2009 N PRO A 132 -8.197 2.145 -7.460 1.00 0.24 N ATOM 2010 CA PRO A 132 -9.626 2.359 -7.262 1.00 0.23 C ATOM 2011 C PRO A 132 -10.453 1.156 -7.715 1.00 0.23 C ATOM 2012 O PRO A 132 -10.379 0.735 -8.870 1.00 0.25 O ATOM 2013 CB PRO A 132 -9.937 3.585 -8.139 1.00 0.26 C ATOM 2014 CG PRO A 132 -8.620 4.044 -8.679 1.00 0.29 C ATOM 2015 CD PRO A 132 -7.724 2.840 -8.659 1.00 0.28 C ATOM 0 HA PRO A 132 -9.874 2.503 -6.211 1.00 0.23 H new ATOM 0 HB2 PRO A 132 -10.621 3.325 -8.946 1.00 0.26 H new ATOM 0 HB3 PRO A 132 -10.416 4.371 -7.556 1.00 0.26 H new ATOM 0 HG2 PRO A 132 -8.728 4.434 -9.691 1.00 0.29 H new ATOM 0 HG3 PRO A 132 -8.207 4.848 -8.070 1.00 0.29 H new ATOM 0 HD2 PRO A 132 -7.834 2.231 -9.556 1.00 0.28 H new ATOM 0 HD3 PRO A 132 -6.671 3.113 -8.587 1.00 0.28 H new ATOM 2023 N ILE A 133 -11.224 0.601 -6.792 1.00 0.21 N ATOM 2024 CA ILE A 133 -12.113 -0.508 -7.086 1.00 0.21 C ATOM 2025 C ILE A 133 -13.550 -0.015 -7.002 1.00 0.19 C ATOM 2026 O ILE A 133 -13.831 0.971 -6.321 1.00 0.26 O ATOM 2027 CB ILE A 133 -11.923 -1.692 -6.093 1.00 0.23 C ATOM 2028 CG1 ILE A 133 -12.879 -1.575 -4.902 1.00 0.25 C ATOM 2029 CG2 ILE A 133 -10.490 -1.746 -5.587 1.00 0.26 C ATOM 2030 CD1 ILE A 133 -12.698 -2.663 -3.864 1.00 0.27 C ATOM 0 H ILE A 133 -11.250 0.908 -5.820 1.00 0.21 H new ATOM 0 HA ILE A 133 -11.879 -0.874 -8.086 1.00 0.21 H new ATOM 0 HB ILE A 133 -12.148 -2.611 -6.635 1.00 0.23 H new ATOM 0 HG12 ILE A 133 -12.735 -0.605 -4.427 1.00 0.25 H new ATOM 0 HG13 ILE A 133 -13.905 -1.602 -5.268 1.00 0.25 H new ATOM 0 HG21 ILE A 133 -10.380 -2.581 -4.895 1.00 0.26 H new ATOM 0 HG22 ILE A 133 -9.812 -1.881 -6.429 1.00 0.26 H new ATOM 0 HG23 ILE A 133 -10.250 -0.815 -5.074 1.00 0.26 H new ATOM 0 HD11 ILE A 133 -13.410 -2.513 -3.052 1.00 0.27 H new ATOM 0 HD12 ILE A 133 -12.871 -3.636 -4.323 1.00 0.27 H new ATOM 0 HD13 ILE A 133 -11.683 -2.624 -3.469 1.00 0.27 H new ATOM 2042 N SER A 134 -14.451 -0.683 -7.686 1.00 0.19 N ATOM 2043 CA SER A 134 -15.849 -0.307 -7.632 1.00 0.21 C ATOM 2044 C SER A 134 -16.698 -1.456 -7.105 1.00 0.22 C ATOM 2045 O SER A 134 -16.899 -2.458 -7.791 1.00 0.25 O ATOM 2046 CB SER A 134 -16.316 0.136 -9.016 1.00 0.26 C ATOM 2047 OG SER A 134 -15.746 -0.674 -10.031 1.00 1.24 O ATOM 0 H SER A 134 -14.245 -1.484 -8.283 1.00 0.19 H new ATOM 0 HA SER A 134 -15.966 0.529 -6.942 1.00 0.21 H new ATOM 0 HB2 SER A 134 -17.403 0.082 -9.071 1.00 0.26 H new ATOM 0 HB3 SER A 134 -16.040 1.178 -9.180 1.00 0.26 H new ATOM 0 HG SER A 134 -16.062 -0.371 -10.908 1.00 1.24 H new ATOM 2053 N ILE A 135 -17.165 -1.320 -5.871 1.00 0.23 N ATOM 2054 CA ILE A 135 -18.057 -2.310 -5.289 1.00 0.25 C ATOM 2055 C ILE A 135 -19.484 -1.804 -5.362 1.00 0.29 C ATOM 2056 O ILE A 135 -19.795 -0.749 -4.817 1.00 0.34 O ATOM 2057 CB ILE A 135 -17.725 -2.624 -3.811 1.00 0.26 C ATOM 2058 CG1 ILE A 135 -16.297 -3.140 -3.674 1.00 0.28 C ATOM 2059 CG2 ILE A 135 -18.711 -3.640 -3.244 1.00 0.30 C ATOM 2060 CD1 ILE A 135 -15.948 -3.596 -2.272 1.00 0.32 C ATOM 0 H ILE A 135 -16.941 -0.537 -5.257 1.00 0.23 H new ATOM 0 HA ILE A 135 -17.929 -3.228 -5.862 1.00 0.25 H new ATOM 0 HB ILE A 135 -17.812 -1.699 -3.241 1.00 0.26 H new ATOM 0 HG12 ILE A 135 -16.152 -3.971 -4.364 1.00 0.28 H new ATOM 0 HG13 ILE A 135 -15.605 -2.353 -3.974 1.00 0.28 H new ATOM 0 HG21 ILE A 135 -18.461 -3.848 -2.204 1.00 0.30 H new ATOM 0 HG22 ILE A 135 -19.722 -3.237 -3.301 1.00 0.30 H new ATOM 0 HG23 ILE A 135 -18.656 -4.563 -3.822 1.00 0.30 H new ATOM 0 HD11 ILE A 135 -14.917 -3.950 -2.250 1.00 0.32 H new ATOM 0 HD12 ILE A 135 -16.060 -2.762 -1.580 1.00 0.32 H new ATOM 0 HD13 ILE A 135 -16.616 -4.405 -1.976 1.00 0.32 H new ATOM 2072 N LYS A 136 -20.332 -2.541 -6.054 1.00 0.31 N ATOM 2073 CA LYS A 136 -21.742 -2.201 -6.176 1.00 0.37 C ATOM 2074 C LYS A 136 -22.556 -3.462 -6.371 1.00 0.40 C ATOM 2075 O LYS A 136 -22.146 -4.363 -7.103 1.00 0.42 O ATOM 2076 CB LYS A 136 -21.990 -1.222 -7.329 1.00 0.46 C ATOM 2077 CG LYS A 136 -21.586 0.203 -6.998 1.00 0.66 C ATOM 2078 CD LYS A 136 -22.459 0.780 -5.889 1.00 1.28 C ATOM 2079 CE LYS A 136 -21.887 2.075 -5.325 1.00 1.51 C ATOM 2080 NZ LYS A 136 -21.872 3.175 -6.324 1.00 1.95 N ATOM 0 H LYS A 136 -20.066 -3.393 -6.548 1.00 0.31 H new ATOM 0 HA LYS A 136 -22.053 -1.707 -5.255 1.00 0.37 H new ATOM 0 HB2 LYS A 136 -21.436 -1.556 -8.206 1.00 0.46 H new ATOM 0 HB3 LYS A 136 -23.047 -1.241 -7.593 1.00 0.46 H new ATOM 0 HG2 LYS A 136 -20.541 0.225 -6.690 1.00 0.66 H new ATOM 0 HG3 LYS A 136 -21.669 0.824 -7.890 1.00 0.66 H new ATOM 0 HD2 LYS A 136 -23.461 0.965 -6.276 1.00 1.28 H new ATOM 0 HD3 LYS A 136 -22.557 0.048 -5.087 1.00 1.28 H new ATOM 0 HE2 LYS A 136 -22.476 2.382 -4.461 1.00 1.51 H new ATOM 0 HE3 LYS A 136 -20.872 1.896 -4.972 1.00 1.51 H new ATOM 0 HZ1 LYS A 136 -21.474 4.032 -5.890 1.00 1.95 H new ATOM 0 HZ2 LYS A 136 -21.289 2.896 -7.139 1.00 1.95 H new ATOM 0 HZ3 LYS A 136 -22.843 3.367 -6.643 1.00 1.95 H new ATOM 2094 N LYS A 137 -23.680 -3.534 -5.672 1.00 0.46 N ATOM 2095 CA LYS A 137 -24.594 -4.668 -5.759 1.00 0.54 C ATOM 2096 C LYS A 137 -23.932 -5.928 -5.219 1.00 0.48 C ATOM 2097 O LYS A 137 -24.323 -7.048 -5.553 1.00 0.54 O ATOM 2098 CB LYS A 137 -25.074 -4.894 -7.202 1.00 0.65 C ATOM 2099 CG LYS A 137 -25.693 -3.660 -7.849 1.00 0.81 C ATOM 2100 CD LYS A 137 -26.692 -2.983 -6.928 1.00 1.53 C ATOM 2101 CE LYS A 137 -27.774 -3.942 -6.469 1.00 2.40 C ATOM 2102 NZ LYS A 137 -28.631 -3.339 -5.416 1.00 3.13 N ATOM 0 H LYS A 137 -23.986 -2.806 -5.026 1.00 0.46 H new ATOM 0 HA LYS A 137 -25.467 -4.438 -5.148 1.00 0.54 H new ATOM 0 HB2 LYS A 137 -24.230 -5.225 -7.807 1.00 0.65 H new ATOM 0 HB3 LYS A 137 -25.806 -5.701 -7.208 1.00 0.65 H new ATOM 0 HG2 LYS A 137 -24.906 -2.954 -8.113 1.00 0.81 H new ATOM 0 HG3 LYS A 137 -26.189 -3.946 -8.777 1.00 0.81 H new ATOM 0 HD2 LYS A 137 -26.171 -2.580 -6.060 1.00 1.53 H new ATOM 0 HD3 LYS A 137 -27.149 -2.139 -7.445 1.00 1.53 H new ATOM 0 HE2 LYS A 137 -28.391 -4.229 -7.320 1.00 2.40 H new ATOM 0 HE3 LYS A 137 -27.314 -4.853 -6.087 1.00 2.40 H new ATOM 0 HZ1 LYS A 137 -29.359 -4.023 -5.127 1.00 3.13 H new ATOM 0 HZ2 LYS A 137 -28.046 -3.088 -4.594 1.00 3.13 H new ATOM 0 HZ3 LYS A 137 -29.089 -2.483 -5.789 1.00 3.13 H new ATOM 2116 N GLY A 138 -22.931 -5.735 -4.376 1.00 0.41 N ATOM 2117 CA GLY A 138 -22.198 -6.853 -3.828 1.00 0.40 C ATOM 2118 C GLY A 138 -21.157 -7.379 -4.793 1.00 0.37 C ATOM 2119 O GLY A 138 -20.571 -8.438 -4.570 1.00 0.39 O ATOM 0 H GLY A 138 -22.612 -4.819 -4.061 1.00 0.41 H new ATOM 0 HA2 GLY A 138 -21.712 -6.548 -2.901 1.00 0.40 H new ATOM 0 HA3 GLY A 138 -22.894 -7.653 -3.574 1.00 0.40 H new ATOM 2123 N LYS A 139 -20.930 -6.651 -5.879 1.00 0.37 N ATOM 2124 CA LYS A 139 -19.910 -7.035 -6.837 1.00 0.36 C ATOM 2125 C LYS A 139 -18.717 -6.105 -6.714 1.00 0.32 C ATOM 2126 O LYS A 139 -18.809 -5.058 -6.084 1.00 0.40 O ATOM 2127 CB LYS A 139 -20.446 -7.022 -8.270 1.00 0.44 C ATOM 2128 CG LYS A 139 -21.524 -8.062 -8.539 1.00 0.87 C ATOM 2129 CD LYS A 139 -21.861 -8.153 -10.023 1.00 1.14 C ATOM 2130 CE LYS A 139 -20.676 -8.661 -10.837 1.00 1.64 C ATOM 2131 NZ LYS A 139 -21.009 -8.818 -12.278 1.00 2.23 N ATOM 0 H LYS A 139 -21.436 -5.798 -6.115 1.00 0.37 H new ATOM 0 HA LYS A 139 -19.602 -8.056 -6.612 1.00 0.36 H new ATOM 0 HB2 LYS A 139 -20.848 -6.033 -8.487 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -19.617 -7.187 -8.958 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -21.188 -9.035 -8.182 1.00 0.87 H new ATOM 0 HG3 LYS A 139 -22.423 -7.809 -7.976 1.00 0.87 H new ATOM 0 HD2 LYS A 139 -22.712 -8.819 -10.163 1.00 1.14 H new ATOM 0 HD3 LYS A 139 -22.161 -7.171 -10.390 1.00 1.14 H new ATOM 0 HE2 LYS A 139 -19.842 -7.967 -10.732 1.00 1.64 H new ATOM 0 HE3 LYS A 139 -20.346 -9.619 -10.436 1.00 1.64 H new ATOM 0 HZ1 LYS A 139 -20.174 -9.165 -12.791 1.00 2.23 H new ATOM 0 HZ2 LYS A 139 -21.788 -9.500 -12.382 1.00 2.23 H new ATOM 0 HZ3 LYS A 139 -21.299 -7.899 -12.669 1.00 2.23 H new ATOM 2145 N LEU A 140 -17.609 -6.488 -7.318 1.00 0.33 N ATOM 2146 CA LEU A 140 -16.370 -5.754 -7.169 1.00 0.30 C ATOM 2147 C LEU A 140 -15.635 -5.710 -8.508 1.00 0.31 C ATOM 2148 O LEU A 140 -15.242 -6.748 -9.046 1.00 0.41 O ATOM 2149 CB LEU A 140 -15.516 -6.441 -6.090 1.00 0.32 C ATOM 2150 CG LEU A 140 -14.365 -5.620 -5.499 1.00 0.32 C ATOM 2151 CD1 LEU A 140 -13.893 -6.248 -4.198 1.00 0.39 C ATOM 2152 CD2 LEU A 140 -13.201 -5.522 -6.471 1.00 0.37 C ATOM 0 H LEU A 140 -17.543 -7.309 -7.920 1.00 0.33 H new ATOM 0 HA LEU A 140 -16.570 -4.728 -6.861 1.00 0.30 H new ATOM 0 HB2 LEU A 140 -16.174 -6.741 -5.275 1.00 0.32 H new ATOM 0 HB3 LEU A 140 -15.100 -7.354 -6.516 1.00 0.32 H new ATOM 0 HG LEU A 140 -14.735 -4.613 -5.306 1.00 0.32 H new ATOM 0 HD11 LEU A 140 -13.075 -5.658 -3.785 1.00 0.39 H new ATOM 0 HD12 LEU A 140 -14.718 -6.273 -3.486 1.00 0.39 H new ATOM 0 HD13 LEU A 140 -13.547 -7.264 -4.389 1.00 0.39 H new ATOM 0 HD21 LEU A 140 -12.401 -4.933 -6.022 1.00 0.37 H new ATOM 0 HD22 LEU A 140 -12.832 -6.522 -6.699 1.00 0.37 H new ATOM 0 HD23 LEU A 140 -13.534 -5.040 -7.390 1.00 0.37 H new ATOM 2164 N SER A 141 -15.470 -4.511 -9.047 1.00 0.28 N ATOM 2165 CA SER A 141 -14.777 -4.331 -10.318 1.00 0.31 C ATOM 2166 C SER A 141 -13.433 -3.632 -10.116 1.00 0.28 C ATOM 2167 O SER A 141 -13.353 -2.607 -9.434 1.00 0.36 O ATOM 2168 CB SER A 141 -15.646 -3.520 -11.279 1.00 0.39 C ATOM 2169 OG SER A 141 -16.906 -4.135 -11.483 1.00 1.19 O ATOM 0 H SER A 141 -15.807 -3.646 -8.625 1.00 0.28 H new ATOM 0 HA SER A 141 -14.590 -5.316 -10.745 1.00 0.31 H new ATOM 0 HB2 SER A 141 -15.790 -2.515 -10.881 1.00 0.39 H new ATOM 0 HB3 SER A 141 -15.132 -3.414 -12.235 1.00 0.39 H new ATOM 0 HG SER A 141 -17.439 -3.592 -12.101 1.00 1.19 H new ATOM 2175 N VAL A 142 -12.383 -4.195 -10.704 1.00 0.33 N ATOM 2176 CA VAL A 142 -11.042 -3.628 -10.605 1.00 0.35 C ATOM 2177 C VAL A 142 -10.400 -3.488 -11.984 1.00 0.43 C ATOM 2178 O VAL A 142 -10.068 -4.487 -12.624 1.00 0.48 O ATOM 2179 CB VAL A 142 -10.119 -4.489 -9.708 1.00 0.35 C ATOM 2180 CG1 VAL A 142 -8.688 -3.980 -9.756 1.00 0.92 C ATOM 2181 CG2 VAL A 142 -10.615 -4.497 -8.278 1.00 0.83 C ATOM 0 H VAL A 142 -12.435 -5.050 -11.258 1.00 0.33 H new ATOM 0 HA VAL A 142 -11.155 -2.643 -10.153 1.00 0.35 H new ATOM 0 HB VAL A 142 -10.140 -5.509 -10.092 1.00 0.35 H new ATOM 0 HG11 VAL A 142 -8.059 -4.601 -9.118 1.00 0.92 H new ATOM 0 HG12 VAL A 142 -8.320 -4.024 -10.781 1.00 0.92 H new ATOM 0 HG13 VAL A 142 -8.656 -2.949 -9.403 1.00 0.92 H new ATOM 0 HG21 VAL A 142 -9.951 -5.108 -7.666 1.00 0.83 H new ATOM 0 HG22 VAL A 142 -10.629 -3.478 -7.892 1.00 0.83 H new ATOM 0 HG23 VAL A 142 -11.623 -4.911 -8.245 1.00 0.83 H new ATOM 2191 N GLN A 143 -10.261 -2.239 -12.437 1.00 0.56 N ATOM 2192 CA GLN A 143 -9.551 -1.908 -13.681 1.00 0.70 C ATOM 2193 C GLN A 143 -10.028 -2.737 -14.868 1.00 0.82 C ATOM 2194 O GLN A 143 -9.237 -3.149 -15.717 1.00 1.45 O ATOM 2195 CB GLN A 143 -8.049 -2.084 -13.500 1.00 0.74 C ATOM 2196 CG GLN A 143 -7.354 -0.886 -12.859 1.00 0.83 C ATOM 2197 CD GLN A 143 -7.754 -0.653 -11.414 1.00 1.15 C ATOM 2198 OE1 GLN A 143 -7.124 -1.170 -10.495 1.00 1.88 O ATOM 2199 NE2 GLN A 143 -8.802 0.128 -11.202 1.00 1.11 N ATOM 0 H GLN A 143 -10.638 -1.425 -11.952 1.00 0.56 H new ATOM 0 HA GLN A 143 -9.776 -0.864 -13.901 1.00 0.70 H new ATOM 0 HB2 GLN A 143 -7.869 -2.966 -12.886 1.00 0.74 H new ATOM 0 HB3 GLN A 143 -7.597 -2.275 -14.473 1.00 0.74 H new ATOM 0 HG2 GLN A 143 -6.275 -1.033 -12.909 1.00 0.83 H new ATOM 0 HG3 GLN A 143 -7.581 0.008 -13.439 1.00 0.83 H new ATOM 0 HE21 GLN A 143 -9.300 0.539 -11.992 1.00 1.11 H new ATOM 0 HE22 GLN A 143 -9.112 0.318 -10.249 1.00 1.11 H new ATOM 2208 N GLY A 144 -11.316 -2.990 -14.908 1.00 0.86 N ATOM 2209 CA GLY A 144 -11.901 -3.679 -16.039 1.00 0.96 C ATOM 2210 C GLY A 144 -12.291 -5.102 -15.713 1.00 0.85 C ATOM 2211 O GLY A 144 -13.166 -5.675 -16.364 1.00 1.02 O ATOM 0 H GLY A 144 -11.977 -2.731 -14.176 1.00 0.86 H new ATOM 0 HA2 GLY A 144 -12.782 -3.133 -16.377 1.00 0.96 H new ATOM 0 HA3 GLY A 144 -11.191 -3.681 -16.866 1.00 0.96 H new ATOM 2215 N GLU A 145 -11.644 -5.681 -14.710 1.00 0.66 N ATOM 2216 CA GLU A 145 -11.979 -7.027 -14.284 1.00 0.65 C ATOM 2217 C GLU A 145 -13.137 -6.962 -13.303 1.00 0.52 C ATOM 2218 O GLU A 145 -12.997 -6.456 -12.187 1.00 0.55 O ATOM 2219 CB GLU A 145 -10.765 -7.721 -13.653 1.00 0.74 C ATOM 2220 CG GLU A 145 -11.019 -9.178 -13.292 1.00 1.06 C ATOM 2221 CD GLU A 145 -9.788 -9.870 -12.738 1.00 1.35 C ATOM 2222 OE1 GLU A 145 -9.215 -9.375 -11.743 1.00 1.95 O ATOM 2223 OE2 GLU A 145 -9.385 -10.906 -13.299 1.00 1.84 O ATOM 0 H GLU A 145 -10.890 -5.241 -14.182 1.00 0.66 H new ATOM 0 HA GLU A 145 -12.275 -7.616 -15.152 1.00 0.65 H new ATOM 0 HB2 GLU A 145 -9.925 -7.668 -14.346 1.00 0.74 H new ATOM 0 HB3 GLU A 145 -10.472 -7.178 -12.754 1.00 0.74 H new ATOM 0 HG2 GLU A 145 -11.822 -9.231 -12.556 1.00 1.06 H new ATOM 0 HG3 GLU A 145 -11.363 -9.712 -14.178 1.00 1.06 H new ATOM 2230 N VAL A 146 -14.278 -7.470 -13.728 1.00 0.59 N ATOM 2231 CA VAL A 146 -15.484 -7.407 -12.928 1.00 0.54 C ATOM 2232 C VAL A 146 -15.802 -8.771 -12.329 1.00 0.53 C ATOM 2233 O VAL A 146 -15.870 -9.781 -13.031 1.00 0.67 O ATOM 2234 CB VAL A 146 -16.687 -6.876 -13.754 1.00 0.64 C ATOM 2235 CG1 VAL A 146 -16.895 -7.692 -15.019 1.00 0.92 C ATOM 2236 CG2 VAL A 146 -17.959 -6.853 -12.917 1.00 0.92 C ATOM 0 H VAL A 146 -14.394 -7.934 -14.629 1.00 0.59 H new ATOM 0 HA VAL A 146 -15.306 -6.704 -12.114 1.00 0.54 H new ATOM 0 HB VAL A 146 -16.453 -5.853 -14.049 1.00 0.64 H new ATOM 0 HG11 VAL A 146 -17.745 -7.294 -15.573 1.00 0.92 H new ATOM 0 HG12 VAL A 146 -16.000 -7.638 -15.638 1.00 0.92 H new ATOM 0 HG13 VAL A 146 -17.090 -8.731 -14.754 1.00 0.92 H new ATOM 0 HG21 VAL A 146 -18.785 -6.477 -13.521 1.00 0.92 H new ATOM 0 HG22 VAL A 146 -18.189 -7.863 -12.576 1.00 0.92 H new ATOM 0 HG23 VAL A 146 -17.815 -6.203 -12.054 1.00 0.92 H new ATOM 2246 N SER A 147 -15.955 -8.795 -11.019 1.00 0.47 N ATOM 2247 CA SER A 147 -16.262 -10.015 -10.302 1.00 0.47 C ATOM 2248 C SER A 147 -17.188 -9.685 -9.140 1.00 0.48 C ATOM 2249 O SER A 147 -17.750 -8.592 -9.091 1.00 0.79 O ATOM 2250 CB SER A 147 -14.967 -10.655 -9.797 1.00 0.54 C ATOM 2251 OG SER A 147 -14.047 -10.854 -10.860 1.00 1.27 O ATOM 0 H SER A 147 -15.870 -7.971 -10.424 1.00 0.47 H new ATOM 0 HA SER A 147 -16.760 -10.724 -10.964 1.00 0.47 H new ATOM 0 HB2 SER A 147 -14.516 -10.018 -9.036 1.00 0.54 H new ATOM 0 HB3 SER A 147 -15.191 -11.610 -9.322 1.00 0.54 H new ATOM 0 HG SER A 147 -13.385 -11.528 -10.598 1.00 1.27 H new ATOM 2257 N THR A 148 -17.362 -10.611 -8.218 1.00 0.41 N ATOM 2258 CA THR A 148 -18.149 -10.338 -7.033 1.00 0.40 C ATOM 2259 C THR A 148 -17.253 -9.993 -5.857 1.00 0.39 C ATOM 2260 O THR A 148 -16.123 -10.475 -5.757 1.00 0.46 O ATOM 2261 CB THR A 148 -19.031 -11.538 -6.635 1.00 0.46 C ATOM 2262 OG1 THR A 148 -18.226 -12.709 -6.441 1.00 1.45 O ATOM 2263 CG2 THR A 148 -20.083 -11.821 -7.684 1.00 1.28 C ATOM 0 H THR A 148 -16.972 -11.552 -8.266 1.00 0.41 H new ATOM 0 HA THR A 148 -18.791 -9.492 -7.279 1.00 0.40 H new ATOM 0 HB THR A 148 -19.532 -11.281 -5.702 1.00 0.46 H new ATOM 0 HG1 THR A 148 -17.935 -12.755 -5.506 1.00 1.45 H new ATOM 0 HG21 THR A 148 -20.688 -12.673 -7.372 1.00 1.28 H new ATOM 0 HG22 THR A 148 -20.722 -10.946 -7.803 1.00 1.28 H new ATOM 0 HG23 THR A 148 -19.598 -12.048 -8.633 1.00 1.28 H new ATOM 2271 N PHE A 149 -17.751 -9.145 -4.979 1.00 0.35 N ATOM 2272 CA PHE A 149 -17.108 -8.938 -3.704 1.00 0.32 C ATOM 2273 C PHE A 149 -17.536 -10.063 -2.783 1.00 0.35 C ATOM 2274 O PHE A 149 -18.728 -10.262 -2.542 1.00 0.43 O ATOM 2275 CB PHE A 149 -17.477 -7.578 -3.107 1.00 0.30 C ATOM 2276 CG PHE A 149 -17.143 -7.478 -1.650 1.00 0.30 C ATOM 2277 CD1 PHE A 149 -15.831 -7.317 -1.232 1.00 0.34 C ATOM 2278 CD2 PHE A 149 -18.141 -7.580 -0.700 1.00 0.38 C ATOM 2279 CE1 PHE A 149 -15.528 -7.255 0.108 1.00 0.42 C ATOM 2280 CE2 PHE A 149 -17.841 -7.524 0.642 1.00 0.46 C ATOM 2281 CZ PHE A 149 -16.534 -7.362 1.045 1.00 0.47 C ATOM 0 H PHE A 149 -18.595 -8.592 -5.127 1.00 0.35 H new ATOM 0 HA PHE A 149 -16.025 -8.941 -3.831 1.00 0.32 H new ATOM 0 HB2 PHE A 149 -16.952 -6.792 -3.651 1.00 0.30 H new ATOM 0 HB3 PHE A 149 -18.544 -7.403 -3.244 1.00 0.30 H new ATOM 0 HD1 PHE A 149 -15.041 -7.240 -1.964 1.00 0.34 H new ATOM 0 HD2 PHE A 149 -19.167 -7.705 -1.014 1.00 0.38 H new ATOM 0 HE1 PHE A 149 -14.504 -7.123 0.426 1.00 0.42 H new ATOM 0 HE2 PHE A 149 -18.628 -7.607 1.377 1.00 0.46 H new ATOM 0 HZ PHE A 149 -16.296 -7.319 2.098 1.00 0.47 H new ATOM 2291 N THR A 150 -16.575 -10.809 -2.295 1.00 0.37 N ATOM 2292 CA THR A 150 -16.876 -11.972 -1.503 1.00 0.48 C ATOM 2293 C THR A 150 -16.066 -11.969 -0.207 1.00 0.43 C ATOM 2294 O THR A 150 -14.899 -12.361 -0.185 1.00 0.82 O ATOM 2295 CB THR A 150 -16.599 -13.252 -2.321 1.00 0.78 C ATOM 2296 OG1 THR A 150 -17.177 -13.131 -3.631 1.00 1.79 O ATOM 2297 CG2 THR A 150 -17.170 -14.479 -1.627 1.00 1.25 C ATOM 0 H THR A 150 -15.580 -10.631 -2.433 1.00 0.37 H new ATOM 0 HA THR A 150 -17.933 -11.950 -1.236 1.00 0.48 H new ATOM 0 HB THR A 150 -15.519 -13.372 -2.405 1.00 0.78 H new ATOM 0 HG1 THR A 150 -16.996 -13.946 -4.145 1.00 1.79 H new ATOM 0 HG21 THR A 150 -16.960 -15.366 -2.225 1.00 1.25 H new ATOM 0 HG22 THR A 150 -16.711 -14.587 -0.644 1.00 1.25 H new ATOM 0 HG23 THR A 150 -18.248 -14.364 -1.514 1.00 1.25 H new ATOM 2305 N GLY A 151 -16.689 -11.477 0.858 1.00 0.42 N ATOM 2306 CA GLY A 151 -16.086 -11.525 2.175 1.00 0.37 C ATOM 2307 C GLY A 151 -15.286 -10.292 2.524 1.00 0.32 C ATOM 2308 O GLY A 151 -15.790 -9.396 3.204 1.00 0.34 O ATOM 0 H GLY A 151 -17.611 -11.041 0.830 1.00 0.42 H new ATOM 0 HA2 GLY A 151 -16.871 -11.660 2.919 1.00 0.37 H new ATOM 0 HA3 GLY A 151 -15.436 -12.398 2.235 1.00 0.37 H new ATOM 2312 N LYS A 152 -14.044 -10.225 2.071 1.00 0.29 N ATOM 2313 CA LYS A 152 -13.181 -9.118 2.454 1.00 0.28 C ATOM 2314 C LYS A 152 -12.260 -8.731 1.319 1.00 0.27 C ATOM 2315 O LYS A 152 -12.003 -9.519 0.410 1.00 0.33 O ATOM 2316 CB LYS A 152 -12.364 -9.460 3.718 1.00 0.36 C ATOM 2317 CG LYS A 152 -10.975 -10.059 3.482 1.00 0.44 C ATOM 2318 CD LYS A 152 -11.034 -11.459 2.901 1.00 0.62 C ATOM 2319 CE LYS A 152 -9.845 -12.315 3.321 1.00 0.77 C ATOM 2320 NZ LYS A 152 -8.536 -11.635 3.117 1.00 1.23 N ATOM 0 H LYS A 152 -13.616 -10.911 1.449 1.00 0.29 H new ATOM 0 HA LYS A 152 -13.821 -8.266 2.683 1.00 0.28 H new ATOM 0 HB2 LYS A 152 -12.250 -8.551 4.309 1.00 0.36 H new ATOM 0 HB3 LYS A 152 -12.942 -10.161 4.320 1.00 0.36 H new ATOM 0 HG2 LYS A 152 -10.415 -9.413 2.806 1.00 0.44 H new ATOM 0 HG3 LYS A 152 -10.429 -10.084 4.425 1.00 0.44 H new ATOM 0 HD2 LYS A 152 -11.957 -11.943 3.220 1.00 0.62 H new ATOM 0 HD3 LYS A 152 -11.067 -11.397 1.813 1.00 0.62 H new ATOM 0 HE2 LYS A 152 -9.950 -12.581 4.373 1.00 0.77 H new ATOM 0 HE3 LYS A 152 -9.857 -13.246 2.754 1.00 0.77 H new ATOM 0 HZ1 LYS A 152 -8.045 -12.063 2.306 1.00 1.23 H new ATOM 0 HZ2 LYS A 152 -8.695 -10.624 2.932 1.00 1.23 H new ATOM 0 HZ3 LYS A 152 -7.952 -11.743 3.971 1.00 1.23 H new ATOM 2334 N LEU A 153 -11.768 -7.514 1.383 1.00 0.23 N ATOM 2335 CA LEU A 153 -10.808 -7.030 0.418 1.00 0.24 C ATOM 2336 C LEU A 153 -9.446 -7.557 0.837 1.00 0.26 C ATOM 2337 O LEU A 153 -8.981 -7.267 1.936 1.00 0.44 O ATOM 2338 CB LEU A 153 -10.830 -5.496 0.399 1.00 0.26 C ATOM 2339 CG LEU A 153 -10.243 -4.816 -0.841 1.00 0.35 C ATOM 2340 CD1 LEU A 153 -8.752 -5.074 -0.961 1.00 1.17 C ATOM 2341 CD2 LEU A 153 -10.971 -5.283 -2.089 1.00 1.16 C ATOM 0 H LEU A 153 -12.021 -6.836 2.102 1.00 0.23 H new ATOM 0 HA LEU A 153 -11.043 -7.374 -0.589 1.00 0.24 H new ATOM 0 HB2 LEU A 153 -11.864 -5.169 0.509 1.00 0.26 H new ATOM 0 HB3 LEU A 153 -10.287 -5.137 1.273 1.00 0.26 H new ATOM 0 HG LEU A 153 -10.382 -3.740 -0.735 1.00 0.35 H new ATOM 0 HD11 LEU A 153 -8.367 -4.577 -1.852 1.00 1.17 H new ATOM 0 HD12 LEU A 153 -8.243 -4.684 -0.080 1.00 1.17 H new ATOM 0 HD13 LEU A 153 -8.573 -6.147 -1.038 1.00 1.17 H new ATOM 0 HD21 LEU A 153 -10.545 -4.792 -2.964 1.00 1.16 H new ATOM 0 HD22 LEU A 153 -10.864 -6.363 -2.190 1.00 1.16 H new ATOM 0 HD23 LEU A 153 -12.028 -5.029 -2.010 1.00 1.16 H new ATOM 2353 N SER A 154 -8.818 -8.355 -0.010 1.00 0.24 N ATOM 2354 CA SER A 154 -7.607 -9.029 0.397 1.00 0.27 C ATOM 2355 C SER A 154 -6.429 -8.518 -0.408 1.00 0.30 C ATOM 2356 O SER A 154 -6.303 -8.813 -1.595 1.00 0.50 O ATOM 2357 CB SER A 154 -7.768 -10.538 0.218 1.00 0.38 C ATOM 2358 OG SER A 154 -6.820 -11.252 0.986 1.00 1.35 O ATOM 0 H SER A 154 -9.122 -8.547 -0.964 1.00 0.24 H new ATOM 0 HA SER A 154 -7.419 -8.821 1.450 1.00 0.27 H new ATOM 0 HB2 SER A 154 -8.775 -10.835 0.511 1.00 0.38 H new ATOM 0 HB3 SER A 154 -7.654 -10.795 -0.835 1.00 0.38 H new ATOM 0 HG SER A 154 -6.475 -12.005 0.462 1.00 1.35 H new ATOM 2364 N VAL A 155 -5.580 -7.737 0.229 1.00 0.26 N ATOM 2365 CA VAL A 155 -4.405 -7.215 -0.438 1.00 0.28 C ATOM 2366 C VAL A 155 -3.245 -8.153 -0.196 1.00 0.29 C ATOM 2367 O VAL A 155 -2.745 -8.253 0.915 1.00 0.38 O ATOM 2368 CB VAL A 155 -4.032 -5.804 0.054 1.00 0.34 C ATOM 2369 CG1 VAL A 155 -2.878 -5.237 -0.763 1.00 0.42 C ATOM 2370 CG2 VAL A 155 -5.237 -4.883 -0.004 1.00 0.39 C ATOM 0 H VAL A 155 -5.681 -7.451 1.203 1.00 0.26 H new ATOM 0 HA VAL A 155 -4.630 -7.142 -1.502 1.00 0.28 H new ATOM 0 HB VAL A 155 -3.708 -5.877 1.092 1.00 0.34 H new ATOM 0 HG11 VAL A 155 -2.630 -4.240 -0.399 1.00 0.42 H new ATOM 0 HG12 VAL A 155 -2.008 -5.886 -0.663 1.00 0.42 H new ATOM 0 HG13 VAL A 155 -3.169 -5.179 -1.812 1.00 0.42 H new ATOM 0 HG21 VAL A 155 -4.954 -3.891 0.347 1.00 0.39 H new ATOM 0 HG22 VAL A 155 -5.594 -4.816 -1.032 1.00 0.39 H new ATOM 0 HG23 VAL A 155 -6.029 -5.280 0.630 1.00 0.39 H new ATOM 2380 N GLU A 156 -2.854 -8.869 -1.226 1.00 0.32 N ATOM 2381 CA GLU A 156 -1.796 -9.846 -1.102 1.00 0.40 C ATOM 2382 C GLU A 156 -0.772 -9.648 -2.199 1.00 0.36 C ATOM 2383 O GLU A 156 -1.051 -9.902 -3.372 1.00 0.42 O ATOM 2384 CB GLU A 156 -2.382 -11.255 -1.172 1.00 0.61 C ATOM 2385 CG GLU A 156 -3.346 -11.559 -0.041 1.00 0.73 C ATOM 2386 CD GLU A 156 -4.229 -12.748 -0.333 1.00 1.41 C ATOM 2387 OE1 GLU A 156 -3.762 -13.889 -0.148 1.00 1.92 O ATOM 2388 OE2 GLU A 156 -5.391 -12.556 -0.738 1.00 1.98 O ATOM 0 H GLU A 156 -3.254 -8.793 -2.161 1.00 0.32 H new ATOM 0 HA GLU A 156 -1.302 -9.716 -0.139 1.00 0.40 H new ATOM 0 HB2 GLU A 156 -2.898 -11.380 -2.124 1.00 0.61 H new ATOM 0 HB3 GLU A 156 -1.569 -11.981 -1.153 1.00 0.61 H new ATOM 0 HG2 GLU A 156 -2.781 -11.747 0.872 1.00 0.73 H new ATOM 0 HG3 GLU A 156 -3.970 -10.685 0.144 1.00 0.73 H new ATOM 2395 N PHE A 157 0.399 -9.165 -1.833 1.00 0.41 N ATOM 2396 CA PHE A 157 1.473 -9.053 -2.799 1.00 0.43 C ATOM 2397 C PHE A 157 2.506 -10.144 -2.581 1.00 0.43 C ATOM 2398 O PHE A 157 3.164 -10.216 -1.539 1.00 0.51 O ATOM 2399 CB PHE A 157 2.103 -7.650 -2.839 1.00 0.55 C ATOM 2400 CG PHE A 157 2.285 -6.965 -1.519 1.00 0.88 C ATOM 2401 CD1 PHE A 157 1.219 -6.335 -0.901 1.00 1.46 C ATOM 2402 CD2 PHE A 157 3.510 -6.989 -0.874 1.00 1.19 C ATOM 2403 CE1 PHE A 157 1.375 -5.735 0.331 1.00 2.17 C ATOM 2404 CE2 PHE A 157 3.668 -6.395 0.360 1.00 1.85 C ATOM 2405 CZ PHE A 157 2.642 -5.630 0.886 1.00 2.32 C ATOM 0 H PHE A 157 0.629 -8.849 -0.891 1.00 0.41 H new ATOM 0 HA PHE A 157 1.034 -9.199 -3.786 1.00 0.43 H new ATOM 0 HB2 PHE A 157 3.077 -7.726 -3.322 1.00 0.55 H new ATOM 0 HB3 PHE A 157 1.483 -7.015 -3.471 1.00 0.55 H new ATOM 0 HD1 PHE A 157 0.255 -6.313 -1.388 1.00 1.46 H new ATOM 0 HD2 PHE A 157 4.351 -7.478 -1.343 1.00 1.19 H new ATOM 0 HE1 PHE A 157 0.516 -5.349 0.860 1.00 2.17 H new ATOM 0 HE2 PHE A 157 4.587 -6.526 0.913 1.00 1.85 H new ATOM 0 HZ PHE A 157 2.825 -4.962 1.715 1.00 2.32 H new ATOM 2415 N VAL A 158 2.616 -11.000 -3.585 1.00 0.44 N ATOM 2416 CA VAL A 158 3.422 -12.204 -3.505 1.00 0.48 C ATOM 2417 C VAL A 158 4.864 -11.924 -3.910 1.00 0.48 C ATOM 2418 O VAL A 158 5.128 -11.126 -4.823 1.00 0.47 O ATOM 2419 CB VAL A 158 2.834 -13.314 -4.403 1.00 0.52 C ATOM 2420 CG1 VAL A 158 3.640 -14.600 -4.302 1.00 0.62 C ATOM 2421 CG2 VAL A 158 1.375 -13.569 -4.048 1.00 0.59 C ATOM 0 H VAL A 158 2.146 -10.877 -4.482 1.00 0.44 H new ATOM 0 HA VAL A 158 3.410 -12.542 -2.469 1.00 0.48 H new ATOM 0 HB VAL A 158 2.889 -12.969 -5.436 1.00 0.52 H new ATOM 0 HG11 VAL A 158 3.197 -15.359 -4.947 1.00 0.62 H new ATOM 0 HG12 VAL A 158 4.667 -14.411 -4.616 1.00 0.62 H new ATOM 0 HG13 VAL A 158 3.635 -14.953 -3.271 1.00 0.62 H new ATOM 0 HG21 VAL A 158 0.976 -14.354 -4.690 1.00 0.59 H new ATOM 0 HG22 VAL A 158 1.303 -13.881 -3.006 1.00 0.59 H new ATOM 0 HG23 VAL A 158 0.800 -12.654 -4.193 1.00 0.59 H new ATOM 2431 N LYS A 159 5.781 -12.601 -3.215 1.00 0.58 N ATOM 2432 CA LYS A 159 7.212 -12.409 -3.390 1.00 0.66 C ATOM 2433 C LYS A 159 7.680 -12.900 -4.751 1.00 0.63 C ATOM 2434 O LYS A 159 7.284 -13.968 -5.215 1.00 0.77 O ATOM 2435 CB LYS A 159 7.982 -13.153 -2.288 1.00 0.93 C ATOM 2436 CG LYS A 159 7.847 -14.667 -2.355 1.00 1.36 C ATOM 2437 CD LYS A 159 8.658 -15.357 -1.272 1.00 1.66 C ATOM 2438 CE LYS A 159 8.647 -16.870 -1.444 1.00 1.99 C ATOM 2439 NZ LYS A 159 7.266 -17.418 -1.456 1.00 2.26 N ATOM 0 H LYS A 159 5.544 -13.301 -2.512 1.00 0.58 H new ATOM 0 HA LYS A 159 7.411 -11.339 -3.325 1.00 0.66 H new ATOM 0 HB2 LYS A 159 9.037 -12.889 -2.355 1.00 0.93 H new ATOM 0 HB3 LYS A 159 7.628 -12.809 -1.316 1.00 0.93 H new ATOM 0 HG2 LYS A 159 6.797 -14.943 -2.253 1.00 1.36 H new ATOM 0 HG3 LYS A 159 8.175 -15.018 -3.333 1.00 1.36 H new ATOM 0 HD2 LYS A 159 9.686 -14.994 -1.299 1.00 1.66 H new ATOM 0 HD3 LYS A 159 8.254 -15.098 -0.293 1.00 1.66 H new ATOM 0 HE2 LYS A 159 9.150 -17.133 -2.375 1.00 1.99 H new ATOM 0 HE3 LYS A 159 9.213 -17.331 -0.635 1.00 1.99 H new ATOM 0 HZ1 LYS A 159 7.305 -18.457 -1.490 1.00 2.26 H new ATOM 0 HZ2 LYS A 159 6.766 -17.118 -0.595 1.00 2.26 H new ATOM 0 HZ3 LYS A 159 6.759 -17.063 -2.292 1.00 2.26 H new ATOM 2453 N GLY A 160 8.520 -12.100 -5.388 1.00 0.75 N ATOM 2454 CA GLY A 160 9.138 -12.515 -6.625 1.00 0.91 C ATOM 2455 C GLY A 160 10.406 -13.298 -6.369 1.00 0.98 C ATOM 2456 O GLY A 160 10.720 -14.236 -7.096 1.00 1.45 O ATOM 0 H GLY A 160 8.784 -11.168 -5.068 1.00 0.75 H new ATOM 0 HA2 GLY A 160 8.439 -13.126 -7.196 1.00 0.91 H new ATOM 0 HA3 GLY A 160 9.365 -11.639 -7.233 1.00 0.91 H new ATOM 2460 N TYR A 161 11.133 -12.913 -5.318 1.00 1.01 N ATOM 2461 CA TYR A 161 12.365 -13.601 -4.943 1.00 1.21 C ATOM 2462 C TYR A 161 12.554 -13.634 -3.427 1.00 1.36 C ATOM 2463 O TYR A 161 11.967 -14.471 -2.743 1.00 2.24 O ATOM 2464 CB TYR A 161 13.584 -12.961 -5.617 1.00 1.55 C ATOM 2465 CG TYR A 161 13.641 -13.189 -7.109 1.00 1.94 C ATOM 2466 CD1 TYR A 161 13.879 -14.457 -7.622 1.00 2.07 C ATOM 2467 CD2 TYR A 161 13.442 -12.145 -8.002 1.00 2.65 C ATOM 2468 CE1 TYR A 161 13.921 -14.678 -8.983 1.00 2.73 C ATOM 2469 CE2 TYR A 161 13.480 -12.359 -9.365 1.00 3.41 C ATOM 2470 CZ TYR A 161 13.722 -13.627 -9.849 1.00 3.40 C ATOM 2471 OH TYR A 161 13.755 -13.846 -11.204 1.00 4.24 O ATOM 0 H TYR A 161 10.888 -12.129 -4.713 1.00 1.01 H new ATOM 0 HA TYR A 161 12.276 -14.629 -5.293 1.00 1.21 H new ATOM 0 HB2 TYR A 161 13.575 -11.889 -5.422 1.00 1.55 H new ATOM 0 HB3 TYR A 161 14.491 -13.360 -5.162 1.00 1.55 H new ATOM 0 HD1 TYR A 161 14.034 -15.284 -6.945 1.00 2.07 H new ATOM 0 HD2 TYR A 161 13.255 -11.151 -7.625 1.00 2.65 H new ATOM 0 HE1 TYR A 161 14.109 -15.670 -9.367 1.00 2.73 H new ATOM 0 HE2 TYR A 161 13.321 -11.538 -10.048 1.00 3.41 H new ATOM 0 HH TYR A 161 12.893 -13.596 -11.597 1.00 4.24 H new ATOM 2481 N TYR A 162 13.350 -12.707 -2.898 1.00 1.19 N ATOM 2482 CA TYR A 162 13.719 -12.740 -1.484 1.00 1.26 C ATOM 2483 C TYR A 162 13.097 -11.575 -0.725 1.00 1.24 C ATOM 2484 O TYR A 162 12.043 -11.726 -0.103 1.00 2.08 O ATOM 2485 CB TYR A 162 15.244 -12.716 -1.342 1.00 1.59 C ATOM 2486 CG TYR A 162 15.932 -13.787 -2.158 1.00 2.17 C ATOM 2487 CD1 TYR A 162 15.987 -15.098 -1.709 1.00 2.54 C ATOM 2488 CD2 TYR A 162 16.508 -13.488 -3.385 1.00 2.97 C ATOM 2489 CE1 TYR A 162 16.599 -16.082 -2.459 1.00 3.35 C ATOM 2490 CE2 TYR A 162 17.118 -14.469 -4.143 1.00 3.90 C ATOM 2491 CZ TYR A 162 17.161 -15.763 -3.675 1.00 3.99 C ATOM 2492 OH TYR A 162 17.760 -16.744 -4.433 1.00 4.98 O ATOM 0 H TYR A 162 13.750 -11.929 -3.423 1.00 1.19 H new ATOM 0 HA TYR A 162 13.334 -13.663 -1.051 1.00 1.26 H new ATOM 0 HB2 TYR A 162 15.616 -11.739 -1.649 1.00 1.59 H new ATOM 0 HB3 TYR A 162 15.507 -12.842 -0.292 1.00 1.59 H new ATOM 0 HD1 TYR A 162 15.544 -15.353 -0.758 1.00 2.54 H new ATOM 0 HD2 TYR A 162 16.479 -12.473 -3.753 1.00 2.97 H new ATOM 0 HE1 TYR A 162 16.637 -17.098 -2.094 1.00 3.35 H new ATOM 0 HE2 TYR A 162 17.559 -14.222 -5.098 1.00 3.90 H new ATOM 0 HH TYR A 162 18.105 -16.352 -5.262 1.00 4.98 H new ATOM 2502 N ASP A 163 13.745 -10.416 -0.779 1.00 1.09 N ATOM 2503 CA ASP A 163 13.207 -9.214 -0.155 1.00 1.04 C ATOM 2504 C ASP A 163 12.073 -8.681 -1.017 1.00 1.04 C ATOM 2505 O ASP A 163 12.276 -7.856 -1.908 1.00 1.79 O ATOM 2506 CB ASP A 163 14.303 -8.154 0.023 1.00 1.31 C ATOM 2507 CG ASP A 163 13.880 -6.976 0.893 1.00 2.02 C ATOM 2508 OD1 ASP A 163 14.010 -7.070 2.138 1.00 2.55 O ATOM 2509 OD2 ASP A 163 13.463 -5.941 0.338 1.00 2.64 O ATOM 0 H ASP A 163 14.641 -10.284 -1.248 1.00 1.09 H new ATOM 0 HA ASP A 163 12.826 -9.458 0.837 1.00 1.04 H new ATOM 0 HB2 ASP A 163 15.182 -8.623 0.465 1.00 1.31 H new ATOM 0 HB3 ASP A 163 14.599 -7.782 -0.958 1.00 1.31 H new ATOM 2514 N ASN A 164 10.891 -9.225 -0.789 1.00 0.87 N ATOM 2515 CA ASN A 164 9.705 -8.833 -1.527 1.00 0.88 C ATOM 2516 C ASN A 164 9.169 -7.522 -0.976 1.00 1.12 C ATOM 2517 O ASN A 164 9.502 -7.189 0.155 1.00 1.48 O ATOM 2518 CB ASN A 164 8.642 -9.940 -1.466 1.00 1.20 C ATOM 2519 CG ASN A 164 8.220 -10.328 -0.054 1.00 1.19 C ATOM 2520 OD1 ASN A 164 8.998 -10.262 0.897 1.00 2.06 O ATOM 2521 ND2 ASN A 164 6.981 -10.771 0.081 1.00 1.23 N ATOM 0 H ASN A 164 10.727 -9.949 -0.089 1.00 0.87 H new ATOM 0 HA ASN A 164 9.966 -8.685 -2.575 1.00 0.88 H new ATOM 0 HB2 ASN A 164 7.761 -9.613 -2.019 1.00 1.20 H new ATOM 0 HB3 ASN A 164 9.026 -10.825 -1.974 1.00 1.20 H new ATOM 0 HD21 ASN A 164 6.644 -11.071 0.996 1.00 1.23 H new ATOM 0 HD22 ASN A 164 6.363 -10.812 -0.729 1.00 1.23 H new ATOM 2528 N PRO A 165 8.313 -6.793 -1.751 1.00 1.68 N ATOM 2529 CA PRO A 165 7.902 -5.410 -1.476 1.00 2.10 C ATOM 2530 C PRO A 165 8.086 -4.982 -0.027 1.00 1.62 C ATOM 2531 O PRO A 165 7.183 -5.101 0.802 1.00 2.28 O ATOM 2532 CB PRO A 165 6.436 -5.451 -1.867 1.00 2.94 C ATOM 2533 CG PRO A 165 6.380 -6.399 -3.023 1.00 3.16 C ATOM 2534 CD PRO A 165 7.609 -7.284 -2.940 1.00 2.35 C ATOM 0 HA PRO A 165 8.503 -4.678 -2.016 1.00 2.10 H new ATOM 0 HB2 PRO A 165 5.815 -5.796 -1.041 1.00 2.94 H new ATOM 0 HB3 PRO A 165 6.073 -4.462 -2.147 1.00 2.94 H new ATOM 0 HG2 PRO A 165 5.471 -6.999 -2.984 1.00 3.16 H new ATOM 0 HG3 PRO A 165 6.362 -5.854 -3.967 1.00 3.16 H new ATOM 0 HD2 PRO A 165 7.339 -8.335 -2.840 1.00 2.35 H new ATOM 0 HD3 PRO A 165 8.226 -7.197 -3.835 1.00 2.35 H new ATOM 2542 N LYS A 166 9.293 -4.488 0.241 1.00 0.98 N ATOM 2543 CA LYS A 166 9.815 -4.368 1.590 1.00 0.66 C ATOM 2544 C LYS A 166 8.903 -3.561 2.494 1.00 0.59 C ATOM 2545 O LYS A 166 8.411 -4.074 3.496 1.00 0.75 O ATOM 2546 CB LYS A 166 11.212 -3.751 1.551 1.00 1.09 C ATOM 2547 CG LYS A 166 11.956 -3.890 2.861 1.00 1.74 C ATOM 2548 CD LYS A 166 13.432 -3.588 2.700 1.00 2.26 C ATOM 2549 CE LYS A 166 14.211 -4.050 3.914 1.00 2.74 C ATOM 2550 NZ LYS A 166 13.898 -5.465 4.256 1.00 3.18 N ATOM 0 H LYS A 166 9.936 -4.159 -0.480 1.00 0.98 H new ATOM 0 HA LYS A 166 9.870 -5.371 2.012 1.00 0.66 H new ATOM 0 HB2 LYS A 166 11.791 -4.225 0.759 1.00 1.09 H new ATOM 0 HB3 LYS A 166 11.130 -2.694 1.297 1.00 1.09 H new ATOM 0 HG2 LYS A 166 11.524 -3.214 3.599 1.00 1.74 H new ATOM 0 HG3 LYS A 166 11.831 -4.902 3.245 1.00 1.74 H new ATOM 0 HD2 LYS A 166 13.814 -4.083 1.807 1.00 2.26 H new ATOM 0 HD3 LYS A 166 13.575 -2.517 2.556 1.00 2.26 H new ATOM 0 HE2 LYS A 166 15.279 -3.948 3.723 1.00 2.74 H new ATOM 0 HE3 LYS A 166 13.977 -3.409 4.764 1.00 2.74 H new ATOM 0 HZ1 LYS A 166 14.739 -5.917 4.668 1.00 3.18 H new ATOM 0 HZ2 LYS A 166 13.119 -5.492 4.944 1.00 3.18 H new ATOM 0 HZ3 LYS A 166 13.617 -5.976 3.395 1.00 3.18 H new ATOM 2564 N VAL A 167 8.680 -2.304 2.151 1.00 0.49 N ATOM 2565 CA VAL A 167 7.836 -1.467 2.975 1.00 0.44 C ATOM 2566 C VAL A 167 6.472 -1.319 2.342 1.00 0.38 C ATOM 2567 O VAL A 167 6.354 -1.109 1.118 1.00 0.39 O ATOM 2568 CB VAL A 167 8.454 -0.067 3.249 1.00 0.53 C ATOM 2569 CG1 VAL A 167 9.960 -0.069 3.020 1.00 1.15 C ATOM 2570 CG2 VAL A 167 7.798 1.031 2.426 1.00 1.19 C ATOM 0 H VAL A 167 9.065 -1.850 1.323 1.00 0.49 H new ATOM 0 HA VAL A 167 7.743 -1.966 3.940 1.00 0.44 H new ATOM 0 HB VAL A 167 8.261 0.151 4.299 1.00 0.53 H new ATOM 0 HG11 VAL A 167 10.360 0.925 3.220 1.00 1.15 H new ATOM 0 HG12 VAL A 167 10.429 -0.790 3.689 1.00 1.15 H new ATOM 0 HG13 VAL A 167 10.170 -0.343 1.986 1.00 1.15 H new ATOM 0 HG21 VAL A 167 8.267 1.988 2.656 1.00 1.19 H new ATOM 0 HG22 VAL A 167 7.920 0.813 1.365 1.00 1.19 H new ATOM 0 HG23 VAL A 167 6.736 1.081 2.666 1.00 1.19 H new ATOM 2580 N CYS A 168 5.441 -1.424 3.166 1.00 0.38 N ATOM 2581 CA CYS A 168 4.099 -1.241 2.673 1.00 0.40 C ATOM 2582 C CYS A 168 3.378 -0.183 3.488 1.00 0.47 C ATOM 2583 O CYS A 168 3.458 -0.147 4.708 1.00 0.94 O ATOM 2584 CB CYS A 168 3.326 -2.554 2.680 1.00 0.48 C ATOM 2585 SG CYS A 168 1.681 -2.450 1.934 1.00 1.36 S ATOM 0 H CYS A 168 5.512 -1.632 4.162 1.00 0.38 H new ATOM 0 HA CYS A 168 4.159 -0.900 1.639 1.00 0.40 H new ATOM 0 HB2 CYS A 168 3.907 -3.307 2.148 1.00 0.48 H new ATOM 0 HB3 CYS A 168 3.225 -2.898 3.709 1.00 0.48 H new ATOM 0 HG CYS A 168 1.416 -3.560 1.312 1.00 1.36 H new ATOM 2591 N ALA A 169 2.704 0.680 2.782 1.00 0.29 N ATOM 2592 CA ALA A 169 2.001 1.816 3.348 1.00 0.28 C ATOM 2593 C ALA A 169 0.535 1.762 2.958 1.00 0.27 C ATOM 2594 O ALA A 169 -0.045 2.767 2.549 1.00 0.28 O ATOM 2595 CB ALA A 169 2.644 3.103 2.908 1.00 0.31 C ATOM 0 H ALA A 169 2.621 0.618 1.767 1.00 0.29 H new ATOM 0 HA ALA A 169 2.063 1.773 4.435 1.00 0.28 H new ATOM 0 HB1 ALA A 169 2.105 3.946 3.341 1.00 0.31 H new ATOM 0 HB2 ALA A 169 3.681 3.125 3.243 1.00 0.31 H new ATOM 0 HB3 ALA A 169 2.613 3.172 1.821 1.00 0.31 H new ATOM 2601 N LEU A 170 0.018 0.541 2.919 1.00 0.28 N ATOM 2602 CA LEU A 170 -1.299 0.240 2.377 1.00 0.32 C ATOM 2603 C LEU A 170 -2.414 1.010 3.077 1.00 0.32 C ATOM 2604 O LEU A 170 -2.716 0.774 4.241 1.00 0.52 O ATOM 2605 CB LEU A 170 -1.538 -1.269 2.476 1.00 0.48 C ATOM 2606 CG LEU A 170 -2.987 -1.743 2.338 1.00 0.39 C ATOM 2607 CD1 LEU A 170 -3.641 -1.206 1.077 1.00 0.66 C ATOM 2608 CD2 LEU A 170 -3.025 -3.253 2.325 1.00 0.69 C ATOM 0 H LEU A 170 0.511 -0.281 3.269 1.00 0.28 H new ATOM 0 HA LEU A 170 -1.319 0.559 1.335 1.00 0.32 H new ATOM 0 HB2 LEU A 170 -0.944 -1.760 1.705 1.00 0.48 H new ATOM 0 HB3 LEU A 170 -1.157 -1.612 3.438 1.00 0.48 H new ATOM 0 HG LEU A 170 -3.546 -1.360 3.191 1.00 0.39 H new ATOM 0 HD11 LEU A 170 -4.668 -1.566 1.018 1.00 0.66 H new ATOM 0 HD12 LEU A 170 -3.640 -0.116 1.102 1.00 0.66 H new ATOM 0 HD13 LEU A 170 -3.085 -1.549 0.204 1.00 0.66 H new ATOM 0 HD21 LEU A 170 -4.057 -3.590 2.227 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -2.440 -3.624 1.483 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -2.605 -3.636 3.255 1.00 0.69 H new ATOM 2620 N PHE A 171 -3.023 1.924 2.345 1.00 0.27 N ATOM 2621 CA PHE A 171 -4.150 2.687 2.842 1.00 0.27 C ATOM 2622 C PHE A 171 -5.368 2.492 1.928 1.00 0.27 C ATOM 2623 O PHE A 171 -5.303 2.772 0.732 1.00 0.34 O ATOM 2624 CB PHE A 171 -3.736 4.164 2.943 1.00 0.32 C ATOM 2625 CG PHE A 171 -4.802 5.144 2.562 1.00 0.29 C ATOM 2626 CD1 PHE A 171 -5.935 5.294 3.338 1.00 0.33 C ATOM 2627 CD2 PHE A 171 -4.665 5.912 1.419 1.00 0.38 C ATOM 2628 CE1 PHE A 171 -6.913 6.193 2.982 1.00 0.41 C ATOM 2629 CE2 PHE A 171 -5.641 6.813 1.057 1.00 0.48 C ATOM 2630 CZ PHE A 171 -6.765 6.953 1.839 1.00 0.47 C ATOM 0 H PHE A 171 -2.750 2.157 1.390 1.00 0.27 H new ATOM 0 HA PHE A 171 -4.438 2.338 3.834 1.00 0.27 H new ATOM 0 HB2 PHE A 171 -3.423 4.369 3.967 1.00 0.32 H new ATOM 0 HB3 PHE A 171 -2.867 4.327 2.305 1.00 0.32 H new ATOM 0 HD1 PHE A 171 -6.054 4.700 4.232 1.00 0.33 H new ATOM 0 HD2 PHE A 171 -3.783 5.803 0.805 1.00 0.38 H new ATOM 0 HE1 PHE A 171 -7.795 6.304 3.595 1.00 0.41 H new ATOM 0 HE2 PHE A 171 -5.525 7.408 0.163 1.00 0.48 H new ATOM 0 HZ PHE A 171 -7.533 7.659 1.558 1.00 0.47 H new ATOM 2640 N ILE A 172 -6.466 1.979 2.482 1.00 0.23 N ATOM 2641 CA ILE A 172 -7.702 1.852 1.718 1.00 0.23 C ATOM 2642 C ILE A 172 -8.772 2.787 2.279 1.00 0.23 C ATOM 2643 O ILE A 172 -8.999 2.861 3.493 1.00 0.24 O ATOM 2644 CB ILE A 172 -8.249 0.397 1.660 1.00 0.23 C ATOM 2645 CG1 ILE A 172 -9.424 0.317 0.678 1.00 0.26 C ATOM 2646 CG2 ILE A 172 -8.676 -0.106 3.028 1.00 0.21 C ATOM 2647 CD1 ILE A 172 -10.103 -1.038 0.654 1.00 0.30 C ATOM 0 H ILE A 172 -6.524 1.649 3.445 1.00 0.23 H new ATOM 0 HA ILE A 172 -7.457 2.135 0.694 1.00 0.23 H new ATOM 0 HB ILE A 172 -7.439 -0.245 1.314 1.00 0.23 H new ATOM 0 HG12 ILE A 172 -10.159 1.078 0.941 1.00 0.26 H new ATOM 0 HG13 ILE A 172 -9.066 0.553 -0.324 1.00 0.26 H new ATOM 0 HG21 ILE A 172 -9.051 -1.126 2.940 1.00 0.21 H new ATOM 0 HG22 ILE A 172 -7.821 -0.091 3.704 1.00 0.21 H new ATOM 0 HG23 ILE A 172 -9.462 0.537 3.423 1.00 0.21 H new ATOM 0 HD11 ILE A 172 -10.924 -1.021 -0.063 1.00 0.30 H new ATOM 0 HD12 ILE A 172 -9.382 -1.801 0.361 1.00 0.30 H new ATOM 0 HD13 ILE A 172 -10.492 -1.268 1.646 1.00 0.30 H new ATOM 2659 N MET A 173 -9.411 3.515 1.391 1.00 0.24 N ATOM 2660 CA MET A 173 -10.445 4.452 1.778 1.00 0.25 C ATOM 2661 C MET A 173 -11.708 4.172 0.975 1.00 0.27 C ATOM 2662 O MET A 173 -11.651 3.465 -0.033 1.00 0.31 O ATOM 2663 CB MET A 173 -9.939 5.872 1.558 1.00 0.28 C ATOM 2664 CG MET A 173 -9.621 6.197 0.112 1.00 0.33 C ATOM 2665 SD MET A 173 -11.084 6.712 -0.780 1.00 0.99 S ATOM 2666 CE MET A 173 -11.601 8.041 0.293 1.00 0.50 C ATOM 0 H MET A 173 -9.232 3.476 0.388 1.00 0.24 H new ATOM 0 HA MET A 173 -10.689 4.338 2.834 1.00 0.25 H new ATOM 0 HB2 MET A 173 -10.690 6.574 1.921 1.00 0.28 H new ATOM 0 HB3 MET A 173 -9.043 6.024 2.159 1.00 0.28 H new ATOM 0 HG2 MET A 173 -8.872 6.988 0.072 1.00 0.33 H new ATOM 0 HG3 MET A 173 -9.187 5.322 -0.372 1.00 0.33 H new ATOM 0 HE1 MET A 173 -12.631 7.875 0.608 1.00 0.50 H new ATOM 0 HE2 MET A 173 -10.954 8.073 1.170 1.00 0.50 H new ATOM 0 HE3 MET A 173 -11.534 8.988 -0.242 1.00 0.50 H new ATOM 2676 N LYS A 174 -12.844 4.704 1.410 1.00 0.30 N ATOM 2677 CA LYS A 174 -14.100 4.356 0.772 1.00 0.34 C ATOM 2678 C LYS A 174 -14.741 5.523 0.021 1.00 0.30 C ATOM 2679 O LYS A 174 -14.685 6.684 0.428 1.00 0.33 O ATOM 2680 CB LYS A 174 -15.106 3.807 1.790 1.00 0.50 C ATOM 2681 CG LYS A 174 -15.769 4.886 2.632 1.00 0.69 C ATOM 2682 CD LYS A 174 -16.971 4.362 3.398 1.00 0.77 C ATOM 2683 CE LYS A 174 -18.097 3.958 2.460 1.00 0.74 C ATOM 2684 NZ LYS A 174 -19.363 3.702 3.193 1.00 1.22 N ATOM 0 H LYS A 174 -12.919 5.363 2.185 1.00 0.30 H new ATOM 0 HA LYS A 174 -13.850 3.587 0.042 1.00 0.34 H new ATOM 0 HB2 LYS A 174 -15.876 3.246 1.261 1.00 0.50 H new ATOM 0 HB3 LYS A 174 -14.596 3.105 2.450 1.00 0.50 H new ATOM 0 HG2 LYS A 174 -15.042 5.293 3.335 1.00 0.69 H new ATOM 0 HG3 LYS A 174 -16.082 5.707 1.986 1.00 0.69 H new ATOM 0 HD2 LYS A 174 -16.673 3.504 4.001 1.00 0.77 H new ATOM 0 HD3 LYS A 174 -17.327 5.128 4.087 1.00 0.77 H new ATOM 0 HE2 LYS A 174 -18.257 4.746 1.724 1.00 0.74 H new ATOM 0 HE3 LYS A 174 -17.808 3.062 1.911 1.00 0.74 H new ATOM 0 HZ1 LYS A 174 -20.159 4.114 2.666 1.00 1.22 H new ATOM 0 HZ2 LYS A 174 -19.506 2.677 3.291 1.00 1.22 H new ATOM 0 HZ3 LYS A 174 -19.311 4.136 4.137 1.00 1.22 H new ATOM 2698 N GLY A 175 -15.317 5.161 -1.099 1.00 0.28 N ATOM 2699 CA GLY A 175 -16.298 5.966 -1.793 1.00 0.28 C ATOM 2700 C GLY A 175 -15.793 6.655 -3.047 1.00 0.28 C ATOM 2701 O GLY A 175 -16.558 6.760 -4.003 1.00 0.31 O ATOM 0 H GLY A 175 -15.113 4.278 -1.566 1.00 0.28 H new ATOM 0 HA2 GLY A 175 -17.143 5.331 -2.061 1.00 0.28 H new ATOM 0 HA3 GLY A 175 -16.674 6.725 -1.107 1.00 0.28 H new ATOM 2705 N THR A 176 -14.501 7.003 -3.108 1.00 0.27 N ATOM 2706 CA THR A 176 -13.952 7.729 -4.270 1.00 0.32 C ATOM 2707 C THR A 176 -12.451 7.960 -4.179 1.00 0.38 C ATOM 2708 O THR A 176 -11.900 8.087 -3.098 1.00 0.44 O ATOM 2709 CB THR A 176 -14.553 9.130 -4.417 1.00 0.43 C ATOM 2710 OG1 THR A 176 -14.980 9.627 -3.141 1.00 0.57 O ATOM 2711 CG2 THR A 176 -15.700 9.171 -5.414 1.00 0.68 C ATOM 0 H THR A 176 -13.820 6.798 -2.377 1.00 0.27 H new ATOM 0 HA THR A 176 -14.201 7.084 -5.113 1.00 0.32 H new ATOM 0 HB THR A 176 -13.767 9.775 -4.810 1.00 0.43 H new ATOM 0 HG1 THR A 176 -15.361 10.524 -3.250 1.00 0.57 H new ATOM 0 HG21 THR A 176 -16.089 10.187 -5.479 1.00 0.68 H new ATOM 0 HG22 THR A 176 -15.342 8.856 -6.394 1.00 0.68 H new ATOM 0 HG23 THR A 176 -16.493 8.499 -5.084 1.00 0.68 H new ATOM 2719 N ALA A 177 -11.813 8.078 -5.340 1.00 0.50 N ATOM 2720 CA ALA A 177 -10.428 8.537 -5.419 1.00 0.65 C ATOM 2721 C ALA A 177 -10.394 10.059 -5.424 1.00 0.68 C ATOM 2722 O ALA A 177 -9.351 10.676 -5.229 1.00 0.86 O ATOM 2723 CB ALA A 177 -9.750 7.997 -6.669 1.00 0.82 C ATOM 0 H ALA A 177 -12.235 7.861 -6.243 1.00 0.50 H new ATOM 0 HA ALA A 177 -9.887 8.164 -4.549 1.00 0.65 H new ATOM 0 HB1 ALA A 177 -8.720 8.352 -6.706 1.00 0.82 H new ATOM 0 HB2 ALA A 177 -9.758 6.907 -6.645 1.00 0.82 H new ATOM 0 HB3 ALA A 177 -10.286 8.344 -7.552 1.00 0.82 H new ATOM 2729 N ASP A 178 -11.559 10.643 -5.663 1.00 0.61 N ATOM 2730 CA ASP A 178 -11.700 12.087 -5.794 1.00 0.68 C ATOM 2731 C ASP A 178 -11.651 12.787 -4.438 1.00 0.67 C ATOM 2732 O ASP A 178 -11.240 13.941 -4.342 1.00 0.79 O ATOM 2733 CB ASP A 178 -13.017 12.403 -6.505 1.00 0.82 C ATOM 2734 CG ASP A 178 -13.217 13.882 -6.751 1.00 1.38 C ATOM 2735 OD1 ASP A 178 -12.394 14.481 -7.467 1.00 1.60 O ATOM 2736 OD2 ASP A 178 -14.183 14.456 -6.205 1.00 2.16 O ATOM 0 H ASP A 178 -12.434 10.130 -5.772 1.00 0.61 H new ATOM 0 HA ASP A 178 -10.862 12.461 -6.382 1.00 0.68 H new ATOM 0 HB2 ASP A 178 -13.044 11.875 -7.458 1.00 0.82 H new ATOM 0 HB3 ASP A 178 -13.846 12.025 -5.907 1.00 0.82 H new TER 2741 ASP A 178