USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1009 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 69 ASN : amide:sc= -0.005 K(o=-0.005,f=-2.2!) USER MOD Set 1.2: A 71 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 59 THR OG1 : rot 180:sc= 1.06 USER MOD Set 2.2: A 109 LYS NZ :NH3+ -136:sc= 1.17 (180deg=-0.919) USER MOD Set 3.1: A 16 THR OG1 : rot 52:sc= -0.0918 USER MOD Set 3.2: A 20 ASN : amide:sc= -0.195 X(o=-0.29,f=-0.077) USER MOD Set 4.1: A 17 SER OG : rot 109:sc= 0.67 USER MOD Set 4.2: A 98 MET CE :methyl 168:sc= -0.13 (180deg=-0.363) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0.0941 K(o=0.094,f=-1.4) USER MOD Single : A 13 THR OG1 : rot 85:sc= 1.2 USER MOD Single : A 26 ASN : amide:sc= -0.148 X(o=-0.15,f=-0.15) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.117 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -0.369 X(o=-0.37,f=0) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 ASN : amide:sc= 0.646 K(o=0.65,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 ASN : amide:sc= 0.948 K(o=0.95,f=-5.8!) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 162:sc= 1.04 (180deg=0.782) USER MOD Single : A 50 MET CE :methyl 164:sc= -1.34 (180deg=-2.77) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 102:sc= 1.3 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.142 USER MOD Single : A 61 LYS NZ :NH3+ 152:sc= 1.26 (180deg=1.09) USER MOD Single : A 64 LYS NZ :NH3+ -179:sc= -0.309 (180deg=-0.312) USER MOD Single : A 65 ASN : amide:sc= -1.06 K(o=-1.1,f=-2.4) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 MET CE :methyl 180:sc= -1.22 (180deg=-1.22) USER MOD Single : A 76 LYS NZ :NH3+ 131:sc= 1.25 (180deg=-0.0744) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 83 GLN : amide:sc= -0.138 X(o=-0.14,f=-0.21) USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot 54:sc= 0.727 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 ASN : amide:sc= -0.11 X(o=-0.11,f=-0.0011) USER MOD Single : A 105 SER OG : rot -90:sc= -0.452 USER MOD Single : A 107 GLN : amide:sc= -0.225 X(o=-0.22,f=0) USER MOD Single : A 112 SER OG : rot -112:sc= -0.141 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 49:sc= -0.0204 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.00289 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 100:sc= 0.532 USER MOD Single : A 121 GLN : amide:sc= -1.57 K(o=-1.6,f=-5.4!) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -23.445 15.678 -6.084 1.00 0.00 N ATOM 2 CA GLY A 1 -22.557 16.522 -5.280 1.00 0.00 C ATOM 3 C GLY A 1 -21.233 15.805 -5.065 1.00 0.00 C ATOM 4 O GLY A 1 -20.592 15.402 -6.031 1.00 0.00 O ATOM 0 H1 GLY A 1 -24.350 16.168 -6.231 1.00 0.00 H new ATOM 0 H2 GLY A 1 -23.002 15.486 -7.005 1.00 0.00 H new ATOM 0 H3 GLY A 1 -23.614 14.780 -5.587 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -22.389 17.474 -5.783 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -23.022 16.746 -4.320 1.00 0.00 H new ATOM 8 N ALA A 2 -20.814 15.662 -3.811 1.00 0.00 N ATOM 9 CA ALA A 2 -19.658 14.905 -3.369 1.00 0.00 C ATOM 10 C ALA A 2 -20.060 14.241 -2.051 1.00 0.00 C ATOM 11 O ALA A 2 -19.575 14.601 -0.971 1.00 0.00 O ATOM 12 CB ALA A 2 -18.438 15.825 -3.235 1.00 0.00 C ATOM 0 H ALA A 2 -21.306 16.100 -3.032 1.00 0.00 H new ATOM 0 HA ALA A 2 -19.364 14.139 -4.087 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -17.578 15.243 -2.903 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -18.217 16.279 -4.201 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -18.650 16.607 -2.506 1.00 0.00 H new ATOM 18 N GLU A 3 -21.009 13.312 -2.179 1.00 0.00 N ATOM 19 CA GLU A 3 -21.439 12.374 -1.150 1.00 0.00 C ATOM 20 C GLU A 3 -20.286 11.418 -0.806 1.00 0.00 C ATOM 21 O GLU A 3 -19.168 11.571 -1.294 1.00 0.00 O ATOM 22 CB GLU A 3 -22.664 11.584 -1.675 1.00 0.00 C ATOM 23 CG GLU A 3 -23.852 11.606 -0.702 1.00 0.00 C ATOM 24 CD GLU A 3 -24.603 12.944 -0.650 1.00 0.00 C ATOM 25 OE1 GLU A 3 -24.204 13.931 -1.309 1.00 0.00 O ATOM 26 OE2 GLU A 3 -25.627 13.006 0.070 1.00 0.00 O ATOM 0 H GLU A 3 -21.523 13.190 -3.051 1.00 0.00 H new ATOM 0 HA GLU A 3 -21.720 12.912 -0.245 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -22.977 12.002 -2.632 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -22.371 10.550 -1.860 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -24.553 10.821 -0.985 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -23.491 11.366 0.298 1.00 0.00 H new ATOM 33 N ALA A 4 -20.549 10.377 -0.017 1.00 0.00 N ATOM 34 CA ALA A 4 -19.623 9.262 0.120 1.00 0.00 C ATOM 35 C ALA A 4 -19.653 8.371 -1.129 1.00 0.00 C ATOM 36 O ALA A 4 -20.243 7.285 -1.080 1.00 0.00 O ATOM 37 CB ALA A 4 -20.009 8.474 1.380 1.00 0.00 C ATOM 0 H ALA A 4 -21.400 10.286 0.538 1.00 0.00 H new ATOM 0 HA ALA A 4 -18.602 9.631 0.218 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -19.329 7.632 1.505 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -19.943 9.126 2.251 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -21.029 8.104 1.280 1.00 0.00 H new ATOM 43 N LEU A 5 -19.040 8.777 -2.253 1.00 0.00 N ATOM 44 CA LEU A 5 -18.881 7.923 -3.403 1.00 0.00 C ATOM 45 C LEU A 5 -18.036 6.699 -3.054 1.00 0.00 C ATOM 46 O LEU A 5 -17.187 6.777 -2.158 1.00 0.00 O ATOM 47 CB LEU A 5 -18.201 8.711 -4.522 1.00 0.00 C ATOM 48 CG LEU A 5 -18.513 10.207 -4.539 1.00 0.00 C ATOM 49 CD1 LEU A 5 -20.007 10.532 -4.473 1.00 0.00 C ATOM 50 CD2 LEU A 5 -17.559 11.046 -3.692 1.00 0.00 C ATOM 0 H LEU A 5 -18.646 9.710 -2.373 1.00 0.00 H new ATOM 0 HA LEU A 5 -19.864 7.583 -3.729 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -17.122 8.581 -4.434 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -18.497 8.282 -5.480 1.00 0.00 H new ATOM 0 HG LEU A 5 -18.271 10.564 -5.540 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -20.145 11.613 -4.490 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -20.514 10.088 -5.330 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -20.427 10.127 -3.553 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -17.845 12.096 -3.755 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -17.609 10.717 -2.654 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -16.541 10.924 -4.062 1.00 0.00 H new ATOM 62 N PRO A 6 -18.218 5.594 -3.787 1.00 0.00 N ATOM 63 CA PRO A 6 -17.364 4.431 -3.684 1.00 0.00 C ATOM 64 C PRO A 6 -16.001 4.704 -4.327 1.00 0.00 C ATOM 65 O PRO A 6 -15.805 5.689 -5.038 1.00 0.00 O ATOM 66 CB PRO A 6 -18.135 3.328 -4.405 1.00 0.00 C ATOM 67 CG PRO A 6 -18.939 4.070 -5.471 1.00 0.00 C ATOM 68 CD PRO A 6 -19.113 5.488 -4.926 1.00 0.00 C ATOM 0 HA PRO A 6 -17.144 4.153 -2.653 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -17.461 2.597 -4.851 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -18.787 2.785 -3.721 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -18.414 4.077 -6.426 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -19.904 3.592 -5.641 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -18.867 6.230 -5.685 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -20.146 5.667 -4.628 1.00 0.00 H new ATOM 76 N LEU A 7 -15.060 3.799 -4.085 1.00 0.00 N ATOM 77 CA LEU A 7 -13.663 3.869 -4.492 1.00 0.00 C ATOM 78 C LEU A 7 -13.468 4.152 -5.987 1.00 0.00 C ATOM 79 O LEU A 7 -13.838 3.323 -6.816 1.00 0.00 O ATOM 80 CB LEU A 7 -13.033 2.528 -4.124 1.00 0.00 C ATOM 81 CG LEU A 7 -11.516 2.471 -4.266 1.00 0.00 C ATOM 82 CD1 LEU A 7 -10.839 3.370 -3.230 1.00 0.00 C ATOM 83 CD2 LEU A 7 -11.099 1.011 -4.091 1.00 0.00 C ATOM 0 H LEU A 7 -15.266 2.944 -3.567 1.00 0.00 H new ATOM 0 HA LEU A 7 -13.190 4.707 -3.979 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -13.296 2.290 -3.093 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -13.472 1.752 -4.752 1.00 0.00 H new ATOM 0 HG LEU A 7 -11.207 2.836 -5.245 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -9.757 3.313 -3.350 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -11.166 4.400 -3.373 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -11.110 3.038 -2.228 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -10.016 0.928 -4.186 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -11.405 0.661 -3.105 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -11.578 0.401 -4.857 1.00 0.00 H new ATOM 95 N TYR A 8 -12.818 5.268 -6.323 1.00 0.00 N ATOM 96 CA TYR A 8 -12.532 5.681 -7.699 1.00 0.00 C ATOM 97 C TYR A 8 -11.025 5.790 -7.992 1.00 0.00 C ATOM 98 O TYR A 8 -10.635 6.462 -8.946 1.00 0.00 O ATOM 99 CB TYR A 8 -13.303 6.971 -8.021 1.00 0.00 C ATOM 100 CG TYR A 8 -13.210 8.082 -6.991 1.00 0.00 C ATOM 101 CD1 TYR A 8 -12.065 8.897 -6.908 1.00 0.00 C ATOM 102 CD2 TYR A 8 -14.315 8.345 -6.162 1.00 0.00 C ATOM 103 CE1 TYR A 8 -12.030 9.980 -6.009 1.00 0.00 C ATOM 104 CE2 TYR A 8 -14.291 9.424 -5.266 1.00 0.00 C ATOM 105 CZ TYR A 8 -13.155 10.258 -5.201 1.00 0.00 C ATOM 106 OH TYR A 8 -13.173 11.338 -4.374 1.00 0.00 O ATOM 0 H TYR A 8 -12.467 5.927 -5.628 1.00 0.00 H new ATOM 0 HA TYR A 8 -12.884 4.898 -8.371 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -12.942 7.357 -8.975 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -14.354 6.717 -8.157 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -11.211 8.691 -7.536 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -15.188 7.712 -6.216 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -11.146 10.596 -5.937 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -15.140 9.616 -4.627 1.00 0.00 H new ATOM 0 HH TYR A 8 -14.028 11.370 -3.897 1.00 0.00 H new ATOM 116 N TYR A 9 -10.158 5.180 -7.180 1.00 0.00 N ATOM 117 CA TYR A 9 -8.709 5.234 -7.366 1.00 0.00 C ATOM 118 C TYR A 9 -8.076 4.025 -6.677 1.00 0.00 C ATOM 119 O TYR A 9 -8.582 3.615 -5.629 1.00 0.00 O ATOM 120 CB TYR A 9 -8.214 6.533 -6.722 1.00 0.00 C ATOM 121 CG TYR A 9 -6.766 6.883 -6.981 1.00 0.00 C ATOM 122 CD1 TYR A 9 -6.363 7.314 -8.256 1.00 0.00 C ATOM 123 CD2 TYR A 9 -5.836 6.841 -5.930 1.00 0.00 C ATOM 124 CE1 TYR A 9 -5.034 7.709 -8.483 1.00 0.00 C ATOM 125 CE2 TYR A 9 -4.517 7.269 -6.136 1.00 0.00 C ATOM 126 CZ TYR A 9 -4.109 7.708 -7.419 1.00 0.00 C ATOM 127 OH TYR A 9 -2.830 8.104 -7.645 1.00 0.00 O ATOM 0 H TYR A 9 -10.446 4.631 -6.370 1.00 0.00 H new ATOM 0 HA TYR A 9 -8.440 5.213 -8.422 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -8.836 7.354 -7.078 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -8.365 6.463 -5.645 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -7.078 7.342 -9.065 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -6.138 6.477 -4.959 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -4.721 8.013 -9.471 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -3.813 7.264 -5.317 1.00 0.00 H new ATOM 0 HH TYR A 9 -2.318 8.047 -6.811 1.00 0.00 H new ATOM 137 N LEU A 10 -6.947 3.496 -7.170 1.00 0.00 N ATOM 138 CA LEU A 10 -6.113 2.538 -6.436 1.00 0.00 C ATOM 139 C LEU A 10 -4.638 2.837 -6.639 1.00 0.00 C ATOM 140 O LEU A 10 -4.166 2.834 -7.777 1.00 0.00 O ATOM 141 CB LEU A 10 -6.461 1.078 -6.768 1.00 0.00 C ATOM 142 CG LEU A 10 -6.343 0.084 -5.585 1.00 0.00 C ATOM 143 CD1 LEU A 10 -5.315 0.331 -4.486 1.00 0.00 C ATOM 144 CD2 LEU A 10 -7.651 -0.108 -4.842 1.00 0.00 C ATOM 0 H LEU A 10 -6.586 3.724 -8.096 1.00 0.00 H new ATOM 0 HA LEU A 10 -6.333 2.663 -5.376 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -7.481 1.043 -7.150 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -5.807 0.740 -7.572 1.00 0.00 H new ATOM 0 HG LEU A 10 -6.005 -0.781 -6.156 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -5.377 -0.465 -3.744 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -4.315 0.346 -4.920 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -5.517 1.289 -4.007 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -7.505 -0.815 -4.025 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -7.984 0.848 -4.439 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -8.405 -0.496 -5.527 1.00 0.00 H new ATOM 156 N GLN A 11 -3.904 3.148 -5.564 1.00 0.00 N ATOM 157 CA GLN A 11 -2.484 3.440 -5.672 1.00 0.00 C ATOM 158 C GLN A 11 -1.725 3.217 -4.363 1.00 0.00 C ATOM 159 O GLN A 11 -2.060 3.828 -3.344 1.00 0.00 O ATOM 160 CB GLN A 11 -2.328 4.895 -6.107 1.00 0.00 C ATOM 161 CG GLN A 11 -1.005 5.130 -6.830 1.00 0.00 C ATOM 162 CD GLN A 11 -1.008 4.971 -8.347 1.00 0.00 C ATOM 163 OE1 GLN A 11 -0.088 5.457 -8.995 1.00 0.00 O ATOM 164 NE2 GLN A 11 -1.927 4.231 -8.942 1.00 0.00 N ATOM 0 H GLN A 11 -4.275 3.202 -4.616 1.00 0.00 H new ATOM 0 HA GLN A 11 -2.056 2.754 -6.402 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -3.154 5.169 -6.763 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -2.385 5.544 -5.233 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -0.665 6.139 -6.596 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -0.267 4.441 -6.419 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -2.690 3.830 -8.397 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -1.873 4.061 -9.946 1.00 0.00 H new ATOM 173 N ILE A 12 -0.647 2.429 -4.425 1.00 0.00 N ATOM 174 CA ILE A 12 0.238 2.133 -3.285 1.00 0.00 C ATOM 175 C ILE A 12 0.737 3.397 -2.577 1.00 0.00 C ATOM 176 O ILE A 12 0.764 3.385 -1.355 1.00 0.00 O ATOM 177 CB ILE A 12 1.423 1.237 -3.709 1.00 0.00 C ATOM 178 CG1 ILE A 12 0.951 -0.073 -4.388 1.00 0.00 C ATOM 179 CG2 ILE A 12 2.395 0.860 -2.547 1.00 0.00 C ATOM 180 CD1 ILE A 12 -0.111 -0.867 -3.610 1.00 0.00 C ATOM 0 H ILE A 12 -0.356 1.967 -5.287 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.367 1.584 -2.564 1.00 0.00 H new ATOM 0 HB ILE A 12 1.972 1.857 -4.418 1.00 0.00 H new ATOM 0 HG12 ILE A 12 0.551 0.170 -5.372 1.00 0.00 H new ATOM 0 HG13 ILE A 12 1.818 -0.714 -4.546 1.00 0.00 H new ATOM 0 HG21 ILE A 12 3.197 0.230 -2.933 1.00 0.00 H new ATOM 0 HG22 ILE A 12 2.821 1.768 -2.120 1.00 0.00 H new ATOM 0 HG23 ILE A 12 1.847 0.318 -1.776 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -0.375 -1.766 -4.168 1.00 0.00 H new ATOM 0 HD12 ILE A 12 0.287 -1.149 -2.635 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.000 -0.250 -3.474 1.00 0.00 H new ATOM 192 N THR A 13 1.044 4.483 -3.294 1.00 0.00 N ATOM 193 CA THR A 13 1.307 5.826 -2.761 1.00 0.00 C ATOM 194 C THR A 13 2.571 5.963 -1.891 1.00 0.00 C ATOM 195 O THR A 13 3.452 6.745 -2.252 1.00 0.00 O ATOM 196 CB THR A 13 0.014 6.384 -2.139 1.00 0.00 C ATOM 197 OG1 THR A 13 -0.986 6.374 -3.147 1.00 0.00 O ATOM 198 CG2 THR A 13 0.117 7.813 -1.605 1.00 0.00 C ATOM 0 H THR A 13 1.120 4.449 -4.311 1.00 0.00 H new ATOM 0 HA THR A 13 1.582 6.467 -3.599 1.00 0.00 H new ATOM 0 HB THR A 13 -0.214 5.750 -1.282 1.00 0.00 H new ATOM 0 HG1 THR A 13 -1.411 5.492 -3.177 1.00 0.00 H new ATOM 0 HG21 THR A 13 -0.843 8.115 -1.187 1.00 0.00 H new ATOM 0 HG22 THR A 13 0.880 7.857 -0.828 1.00 0.00 H new ATOM 0 HG23 THR A 13 0.387 8.487 -2.418 1.00 0.00 H new ATOM 206 N GLY A 14 2.728 5.219 -0.800 1.00 0.00 N ATOM 207 CA GLY A 14 3.989 5.110 -0.086 1.00 0.00 C ATOM 208 C GLY A 14 4.173 3.691 0.409 1.00 0.00 C ATOM 209 O GLY A 14 3.202 2.954 0.601 1.00 0.00 O ATOM 0 H GLY A 14 1.974 4.671 -0.386 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.815 5.387 -0.742 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.003 5.804 0.755 1.00 0.00 H new ATOM 213 N ILE A 15 5.423 3.315 0.626 1.00 0.00 N ATOM 214 CA ILE A 15 5.801 1.947 1.003 1.00 0.00 C ATOM 215 C ILE A 15 7.139 2.060 1.736 1.00 0.00 C ATOM 216 O ILE A 15 7.958 2.899 1.369 1.00 0.00 O ATOM 217 CB ILE A 15 5.962 1.070 -0.255 1.00 0.00 C ATOM 218 CG1 ILE A 15 6.006 -0.430 0.117 1.00 0.00 C ATOM 219 CG2 ILE A 15 7.160 1.458 -1.145 1.00 0.00 C ATOM 220 CD1 ILE A 15 5.436 -1.331 -0.986 1.00 0.00 C ATOM 0 H ILE A 15 6.217 3.951 0.547 1.00 0.00 H new ATOM 0 HA ILE A 15 5.038 1.485 1.630 1.00 0.00 H new ATOM 0 HB ILE A 15 5.076 1.259 -0.861 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.037 -0.720 0.320 1.00 0.00 H new ATOM 0 HG13 ILE A 15 5.443 -0.589 1.037 1.00 0.00 H new ATOM 0 HG21 ILE A 15 7.203 0.793 -2.008 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.043 2.487 -1.485 1.00 0.00 H new ATOM 0 HG23 ILE A 15 8.083 1.368 -0.572 1.00 0.00 H new ATOM 0 HD11 ILE A 15 5.492 -2.373 -0.670 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.396 -1.064 -1.172 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.014 -1.197 -1.900 1.00 0.00 H new ATOM 232 N THR A 16 7.417 1.183 2.686 1.00 0.00 N ATOM 233 CA THR A 16 8.686 1.091 3.386 1.00 0.00 C ATOM 234 C THR A 16 8.716 -0.234 4.168 1.00 0.00 C ATOM 235 O THR A 16 7.838 -1.082 3.980 1.00 0.00 O ATOM 236 CB THR A 16 8.860 2.353 4.236 1.00 0.00 C ATOM 237 OG1 THR A 16 10.159 2.395 4.763 1.00 0.00 O ATOM 238 CG2 THR A 16 7.870 2.502 5.401 1.00 0.00 C ATOM 0 H THR A 16 6.739 0.490 3.002 1.00 0.00 H new ATOM 0 HA THR A 16 9.543 1.060 2.713 1.00 0.00 H new ATOM 0 HB THR A 16 8.661 3.177 3.551 1.00 0.00 H new ATOM 0 HG1 THR A 16 10.809 2.270 4.041 1.00 0.00 H new ATOM 0 HG21 THR A 16 8.078 3.427 5.939 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.852 2.529 5.012 1.00 0.00 H new ATOM 0 HG23 THR A 16 7.977 1.656 6.079 1.00 0.00 H new ATOM 246 N SER A 17 9.695 -0.449 5.047 1.00 0.00 N ATOM 247 CA SER A 17 9.687 -1.572 5.973 1.00 0.00 C ATOM 248 C SER A 17 10.395 -1.223 7.285 1.00 0.00 C ATOM 249 O SER A 17 11.041 -0.178 7.410 1.00 0.00 O ATOM 250 CB SER A 17 10.308 -2.799 5.295 1.00 0.00 C ATOM 251 OG SER A 17 11.627 -2.560 4.871 1.00 0.00 O ATOM 0 H SER A 17 10.514 0.153 5.134 1.00 0.00 H new ATOM 0 HA SER A 17 8.655 -1.807 6.235 1.00 0.00 H new ATOM 0 HB2 SER A 17 10.298 -3.640 5.989 1.00 0.00 H new ATOM 0 HB3 SER A 17 9.699 -3.086 4.438 1.00 0.00 H new ATOM 0 HG SER A 17 12.249 -3.061 5.439 1.00 0.00 H new ATOM 257 N ASP A 18 10.287 -2.137 8.250 1.00 0.00 N ATOM 258 CA ASP A 18 10.950 -2.078 9.551 1.00 0.00 C ATOM 259 C ASP A 18 12.465 -1.925 9.394 1.00 0.00 C ATOM 260 O ASP A 18 13.069 -1.035 9.995 1.00 0.00 O ATOM 261 CB ASP A 18 10.578 -3.340 10.336 1.00 0.00 C ATOM 262 CG ASP A 18 11.097 -3.343 11.768 1.00 0.00 C ATOM 263 OD1 ASP A 18 10.740 -2.433 12.545 1.00 0.00 O ATOM 264 OD2 ASP A 18 11.714 -4.355 12.168 1.00 0.00 O ATOM 0 H ASP A 18 9.712 -2.972 8.141 1.00 0.00 H new ATOM 0 HA ASP A 18 10.613 -1.200 10.103 1.00 0.00 H new ATOM 0 HB2 ASP A 18 9.493 -3.441 10.352 1.00 0.00 H new ATOM 0 HB3 ASP A 18 10.972 -4.212 9.814 1.00 0.00 H new ATOM 269 N GLY A 19 13.072 -2.716 8.503 1.00 0.00 N ATOM 270 CA GLY A 19 14.491 -2.624 8.178 1.00 0.00 C ATOM 271 C GLY A 19 14.839 -1.530 7.157 1.00 0.00 C ATOM 272 O GLY A 19 15.929 -1.588 6.596 1.00 0.00 O ATOM 0 H GLY A 19 12.582 -3.445 7.984 1.00 0.00 H new ATOM 0 HA2 GLY A 19 15.050 -2.439 9.095 1.00 0.00 H new ATOM 0 HA3 GLY A 19 14.825 -3.586 7.790 1.00 0.00 H new ATOM 276 N ASN A 20 13.950 -0.572 6.854 1.00 0.00 N ATOM 277 CA ASN A 20 14.196 0.488 5.859 1.00 0.00 C ATOM 278 C ASN A 20 14.346 1.870 6.488 1.00 0.00 C ATOM 279 O ASN A 20 14.220 2.876 5.791 1.00 0.00 O ATOM 280 CB ASN A 20 13.048 0.556 4.839 1.00 0.00 C ATOM 281 CG ASN A 20 13.457 1.059 3.464 1.00 0.00 C ATOM 282 OD1 ASN A 20 12.781 1.904 2.888 1.00 0.00 O ATOM 283 ND2 ASN A 20 14.497 0.481 2.878 1.00 0.00 N ATOM 0 H ASN A 20 13.032 -0.509 7.295 1.00 0.00 H new ATOM 0 HA ASN A 20 15.134 0.222 5.372 1.00 0.00 H new ATOM 0 HB2 ASN A 20 12.613 -0.438 4.734 1.00 0.00 H new ATOM 0 HB3 ASN A 20 12.267 1.206 5.233 1.00 0.00 H new ATOM 0 HD21 ASN A 20 14.752 0.737 1.924 1.00 0.00 H new ATOM 0 HD22 ASN A 20 15.042 -0.219 3.381 1.00 0.00 H new ATOM 290 N ASP A 21 14.522 1.948 7.808 1.00 0.00 N ATOM 291 CA ASP A 21 14.552 3.206 8.564 1.00 0.00 C ATOM 292 C ASP A 21 13.160 3.864 8.557 1.00 0.00 C ATOM 293 O ASP A 21 13.024 5.070 8.769 1.00 0.00 O ATOM 294 CB ASP A 21 15.671 4.161 8.096 1.00 0.00 C ATOM 295 CG ASP A 21 16.988 3.470 7.729 1.00 0.00 C ATOM 296 OD1 ASP A 21 17.772 3.119 8.633 1.00 0.00 O ATOM 297 OD2 ASP A 21 17.251 3.300 6.511 1.00 0.00 O ATOM 0 H ASP A 21 14.650 1.124 8.395 1.00 0.00 H new ATOM 0 HA ASP A 21 14.803 2.968 9.598 1.00 0.00 H new ATOM 0 HB2 ASP A 21 15.315 4.719 7.230 1.00 0.00 H new ATOM 0 HB3 ASP A 21 15.865 4.887 8.886 1.00 0.00 H new ATOM 302 N PHE A 22 12.115 3.056 8.302 1.00 0.00 N ATOM 303 CA PHE A 22 10.716 3.456 8.164 1.00 0.00 C ATOM 304 C PHE A 22 10.532 4.533 7.078 1.00 0.00 C ATOM 305 O PHE A 22 9.553 5.278 7.131 1.00 0.00 O ATOM 306 CB PHE A 22 10.123 3.838 9.540 1.00 0.00 C ATOM 307 CG PHE A 22 9.916 2.710 10.545 1.00 0.00 C ATOM 308 CD1 PHE A 22 10.996 1.931 11.008 1.00 0.00 C ATOM 309 CD2 PHE A 22 8.623 2.463 11.058 1.00 0.00 C ATOM 310 CE1 PHE A 22 10.785 0.899 11.938 1.00 0.00 C ATOM 311 CE2 PHE A 22 8.415 1.439 12.002 1.00 0.00 C ATOM 312 CZ PHE A 22 9.495 0.649 12.432 1.00 0.00 C ATOM 0 H PHE A 22 12.239 2.051 8.181 1.00 0.00 H new ATOM 0 HA PHE A 22 10.139 2.602 7.809 1.00 0.00 H new ATOM 0 HB2 PHE A 22 10.777 4.581 9.996 1.00 0.00 H new ATOM 0 HB3 PHE A 22 9.161 4.321 9.371 1.00 0.00 H new ATOM 0 HD1 PHE A 22 11.994 2.129 10.645 1.00 0.00 H new ATOM 0 HD2 PHE A 22 7.789 3.063 10.724 1.00 0.00 H new ATOM 0 HE1 PHE A 22 11.617 0.297 12.273 1.00 0.00 H new ATOM 0 HE2 PHE A 22 7.425 1.261 12.396 1.00 0.00 H new ATOM 0 HZ PHE A 22 9.333 -0.149 13.141 1.00 0.00 H new ATOM 322 N ALA A 23 11.478 4.627 6.132 1.00 0.00 N ATOM 323 CA ALA A 23 11.543 5.579 5.034 1.00 0.00 C ATOM 324 C ALA A 23 10.418 5.354 4.012 1.00 0.00 C ATOM 325 O ALA A 23 10.607 4.605 3.050 1.00 0.00 O ATOM 326 CB ALA A 23 12.934 5.481 4.397 1.00 0.00 C ATOM 0 H ALA A 23 12.273 3.988 6.122 1.00 0.00 H new ATOM 0 HA ALA A 23 11.391 6.589 5.415 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.006 6.187 3.570 1.00 0.00 H new ATOM 0 HB2 ALA A 23 13.693 5.717 5.143 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.093 4.469 4.025 1.00 0.00 H new ATOM 332 N TRP A 24 9.258 5.970 4.247 1.00 0.00 N ATOM 333 CA TRP A 24 7.972 5.803 3.555 1.00 0.00 C ATOM 334 C TRP A 24 7.964 6.053 2.056 1.00 0.00 C ATOM 335 O TRP A 24 6.985 5.679 1.395 1.00 0.00 O ATOM 336 CB TRP A 24 6.978 6.764 4.217 1.00 0.00 C ATOM 337 CG TRP A 24 6.312 6.185 5.408 1.00 0.00 C ATOM 338 CD1 TRP A 24 6.457 6.557 6.695 1.00 0.00 C ATOM 339 CD2 TRP A 24 5.392 5.074 5.404 1.00 0.00 C ATOM 340 NE1 TRP A 24 5.660 5.757 7.491 1.00 0.00 N ATOM 341 CE2 TRP A 24 5.003 4.802 6.744 1.00 0.00 C ATOM 342 CE3 TRP A 24 4.896 4.240 4.386 1.00 0.00 C ATOM 343 CZ2 TRP A 24 4.141 3.747 7.064 1.00 0.00 C ATOM 344 CZ3 TRP A 24 4.015 3.201 4.692 1.00 0.00 C ATOM 345 CH2 TRP A 24 3.629 2.961 6.021 1.00 0.00 C ATOM 0 H TRP A 24 9.185 6.661 4.993 1.00 0.00 H new ATOM 0 HA TRP A 24 7.714 4.748 3.653 1.00 0.00 H new ATOM 0 HB2 TRP A 24 7.502 7.675 4.508 1.00 0.00 H new ATOM 0 HB3 TRP A 24 6.220 7.051 3.488 1.00 0.00 H new ATOM 0 HD1 TRP A 24 7.095 7.354 7.048 1.00 0.00 H new ATOM 0 HE1 TRP A 24 5.569 5.860 8.502 1.00 0.00 H new ATOM 0 HE3 TRP A 24 5.198 4.404 3.362 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 3.876 3.543 8.091 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 3.627 2.577 3.901 1.00 0.00 H new ATOM 0 HH2 TRP A 24 2.933 2.165 6.242 1.00 0.00 H new ATOM 356 N ASP A 25 9.013 6.691 1.544 1.00 0.00 N ATOM 357 CA ASP A 25 9.153 7.137 0.177 1.00 0.00 C ATOM 358 C ASP A 25 7.915 7.935 -0.286 1.00 0.00 C ATOM 359 O ASP A 25 7.055 8.311 0.524 1.00 0.00 O ATOM 360 CB ASP A 25 9.548 5.929 -0.677 1.00 0.00 C ATOM 361 CG ASP A 25 10.143 6.428 -1.995 1.00 0.00 C ATOM 362 OD1 ASP A 25 11.330 6.824 -1.999 1.00 0.00 O ATOM 363 OD2 ASP A 25 9.420 6.510 -3.013 1.00 0.00 O ATOM 0 H ASP A 25 9.830 6.919 2.111 1.00 0.00 H new ATOM 0 HA ASP A 25 9.956 7.865 0.066 1.00 0.00 H new ATOM 0 HB2 ASP A 25 10.273 5.312 -0.146 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.677 5.303 -0.870 1.00 0.00 H new ATOM 368 N ASN A 26 7.825 8.294 -1.566 1.00 0.00 N ATOM 369 CA ASN A 26 6.638 8.867 -2.174 1.00 0.00 C ATOM 370 C ASN A 26 6.560 8.348 -3.599 1.00 0.00 C ATOM 371 O ASN A 26 7.237 8.839 -4.510 1.00 0.00 O ATOM 372 CB ASN A 26 6.664 10.416 -2.204 1.00 0.00 C ATOM 373 CG ASN A 26 7.273 11.030 -0.967 1.00 0.00 C ATOM 374 OD1 ASN A 26 8.478 11.250 -0.903 1.00 0.00 O ATOM 375 ND2 ASN A 26 6.491 11.265 0.064 1.00 0.00 N ATOM 0 H ASN A 26 8.600 8.189 -2.221 1.00 0.00 H new ATOM 0 HA ASN A 26 5.773 8.576 -1.579 1.00 0.00 H new ATOM 0 HB2 ASN A 26 7.226 10.746 -3.078 1.00 0.00 H new ATOM 0 HB3 ASN A 26 5.646 10.787 -2.321 1.00 0.00 H new ATOM 0 HD21 ASN A 26 6.885 11.634 0.929 1.00 0.00 H new ATOM 0 HD22 ASN A 26 5.490 11.078 -0.002 1.00 0.00 H new ATOM 382 N LEU A 27 5.749 7.323 -3.802 1.00 0.00 N ATOM 383 CA LEU A 27 5.725 6.599 -5.054 1.00 0.00 C ATOM 384 C LEU A 27 5.047 7.459 -6.114 1.00 0.00 C ATOM 385 O LEU A 27 4.041 8.132 -5.853 1.00 0.00 O ATOM 386 CB LEU A 27 5.014 5.255 -4.872 1.00 0.00 C ATOM 387 CG LEU A 27 5.584 4.392 -3.732 1.00 0.00 C ATOM 388 CD1 LEU A 27 4.735 3.148 -3.491 1.00 0.00 C ATOM 389 CD2 LEU A 27 7.023 3.968 -4.008 1.00 0.00 C ATOM 0 H LEU A 27 5.093 6.973 -3.104 1.00 0.00 H new ATOM 0 HA LEU A 27 6.742 6.386 -5.383 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.957 5.438 -4.681 1.00 0.00 H new ATOM 0 HB3 LEU A 27 5.077 4.694 -5.804 1.00 0.00 H new ATOM 0 HG LEU A 27 5.565 5.016 -2.838 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.168 2.563 -2.679 1.00 0.00 H new ATOM 0 HD12 LEU A 27 3.721 3.446 -3.223 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.708 2.545 -4.398 1.00 0.00 H new ATOM 0 HD21 LEU A 27 7.389 3.361 -3.180 1.00 0.00 H new ATOM 0 HD22 LEU A 27 7.061 3.386 -4.929 1.00 0.00 H new ATOM 0 HD23 LEU A 27 7.650 4.854 -4.113 1.00 0.00 H new ATOM 401 N THR A 28 5.601 7.444 -7.320 1.00 0.00 N ATOM 402 CA THR A 28 5.119 8.239 -8.432 1.00 0.00 C ATOM 403 C THR A 28 3.757 7.717 -8.905 1.00 0.00 C ATOM 404 O THR A 28 3.436 6.534 -8.746 1.00 0.00 O ATOM 405 CB THR A 28 6.181 8.259 -9.559 1.00 0.00 C ATOM 406 OG1 THR A 28 7.339 7.505 -9.227 1.00 0.00 O ATOM 407 CG2 THR A 28 6.602 9.704 -9.796 1.00 0.00 C ATOM 0 H THR A 28 6.411 6.868 -7.552 1.00 0.00 H new ATOM 0 HA THR A 28 4.966 9.271 -8.115 1.00 0.00 H new ATOM 0 HB THR A 28 5.734 7.813 -10.447 1.00 0.00 H new ATOM 0 HG1 THR A 28 7.979 7.545 -9.968 1.00 0.00 H new ATOM 0 HG21 THR A 28 7.351 9.740 -10.587 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.733 10.292 -10.092 1.00 0.00 H new ATOM 0 HG23 THR A 28 7.024 10.115 -8.879 1.00 0.00 H new ATOM 415 N SER A 29 2.956 8.584 -9.521 1.00 0.00 N ATOM 416 CA SER A 29 1.585 8.287 -9.951 1.00 0.00 C ATOM 417 C SER A 29 1.505 7.312 -11.143 1.00 0.00 C ATOM 418 O SER A 29 0.422 7.066 -11.674 1.00 0.00 O ATOM 419 CB SER A 29 0.871 9.610 -10.252 1.00 0.00 C ATOM 420 OG SER A 29 1.077 10.556 -9.201 1.00 0.00 O ATOM 0 H SER A 29 3.246 9.537 -9.742 1.00 0.00 H new ATOM 0 HA SER A 29 1.083 7.765 -9.136 1.00 0.00 H new ATOM 0 HB2 SER A 29 1.240 10.020 -11.192 1.00 0.00 H new ATOM 0 HB3 SER A 29 -0.196 9.430 -10.380 1.00 0.00 H new ATOM 0 HG SER A 29 0.613 11.392 -9.418 1.00 0.00 H new ATOM 426 N SER A 30 2.636 6.763 -11.591 1.00 0.00 N ATOM 427 CA SER A 30 2.696 5.685 -12.567 1.00 0.00 C ATOM 428 C SER A 30 3.888 4.745 -12.304 1.00 0.00 C ATOM 429 O SER A 30 4.342 4.067 -13.224 1.00 0.00 O ATOM 430 CB SER A 30 2.672 6.295 -13.978 1.00 0.00 C ATOM 431 OG SER A 30 3.676 7.282 -14.179 1.00 0.00 O ATOM 0 H SER A 30 3.556 7.067 -11.274 1.00 0.00 H new ATOM 0 HA SER A 30 1.821 5.041 -12.474 1.00 0.00 H new ATOM 0 HB2 SER A 30 2.801 5.500 -14.713 1.00 0.00 H new ATOM 0 HB3 SER A 30 1.693 6.740 -14.158 1.00 0.00 H new ATOM 0 HG SER A 30 3.613 7.632 -15.092 1.00 0.00 H new ATOM 437 N GLN A 31 4.408 4.707 -11.063 1.00 0.00 N ATOM 438 CA GLN A 31 5.519 3.827 -10.680 1.00 0.00 C ATOM 439 C GLN A 31 5.174 2.364 -11.006 1.00 0.00 C ATOM 440 O GLN A 31 4.006 1.965 -10.968 1.00 0.00 O ATOM 441 CB GLN A 31 5.856 3.990 -9.177 1.00 0.00 C ATOM 442 CG GLN A 31 7.233 3.428 -8.780 1.00 0.00 C ATOM 443 CD GLN A 31 8.247 4.461 -8.305 1.00 0.00 C ATOM 444 OE1 GLN A 31 9.172 4.805 -9.038 1.00 0.00 O ATOM 445 NE2 GLN A 31 8.127 4.930 -7.072 1.00 0.00 N ATOM 0 H GLN A 31 4.066 5.289 -10.298 1.00 0.00 H new ATOM 0 HA GLN A 31 6.401 4.112 -11.254 1.00 0.00 H new ATOM 0 HB2 GLN A 31 5.819 5.049 -8.920 1.00 0.00 H new ATOM 0 HB3 GLN A 31 5.087 3.491 -8.587 1.00 0.00 H new ATOM 0 HG2 GLN A 31 7.092 2.692 -7.989 1.00 0.00 H new ATOM 0 HG3 GLN A 31 7.652 2.900 -9.636 1.00 0.00 H new ATOM 0 HE21 GLN A 31 7.350 4.628 -6.485 1.00 0.00 H new ATOM 0 HE22 GLN A 31 8.812 5.593 -6.710 1.00 0.00 H new ATOM 454 N THR A 32 6.203 1.561 -11.268 1.00 0.00 N ATOM 455 CA THR A 32 6.100 0.146 -11.594 1.00 0.00 C ATOM 456 C THR A 32 7.119 -0.705 -10.824 1.00 0.00 C ATOM 457 O THR A 32 7.055 -1.934 -10.871 1.00 0.00 O ATOM 458 CB THR A 32 6.270 -0.030 -13.110 1.00 0.00 C ATOM 459 OG1 THR A 32 7.554 0.399 -13.538 1.00 0.00 O ATOM 460 CG2 THR A 32 5.264 0.765 -13.936 1.00 0.00 C ATOM 0 H THR A 32 7.167 1.894 -11.258 1.00 0.00 H new ATOM 0 HA THR A 32 5.115 -0.207 -11.289 1.00 0.00 H new ATOM 0 HB THR A 32 6.118 -1.097 -13.274 1.00 0.00 H new ATOM 0 HG1 THR A 32 7.635 0.274 -14.507 1.00 0.00 H new ATOM 0 HG21 THR A 32 5.446 0.591 -14.997 1.00 0.00 H new ATOM 0 HG22 THR A 32 4.253 0.445 -13.684 1.00 0.00 H new ATOM 0 HG23 THR A 32 5.374 1.827 -13.719 1.00 0.00 H new ATOM 468 N LYS A 33 8.088 -0.091 -10.135 1.00 0.00 N ATOM 469 CA LYS A 33 9.074 -0.793 -9.319 1.00 0.00 C ATOM 470 C LYS A 33 9.386 0.094 -8.120 1.00 0.00 C ATOM 471 O LYS A 33 9.246 1.312 -8.212 1.00 0.00 O ATOM 472 CB LYS A 33 10.318 -1.149 -10.171 1.00 0.00 C ATOM 473 CG LYS A 33 11.098 -2.341 -9.583 1.00 0.00 C ATOM 474 CD LYS A 33 12.272 -1.975 -8.651 1.00 0.00 C ATOM 475 CE LYS A 33 13.620 -1.989 -9.388 1.00 0.00 C ATOM 476 NZ LYS A 33 14.715 -1.398 -8.578 1.00 0.00 N ATOM 0 H LYS A 33 8.207 0.922 -10.131 1.00 0.00 H new ATOM 0 HA LYS A 33 8.694 -1.746 -8.951 1.00 0.00 H new ATOM 0 HB2 LYS A 33 10.005 -1.386 -11.188 1.00 0.00 H new ATOM 0 HB3 LYS A 33 10.975 -0.281 -10.234 1.00 0.00 H new ATOM 0 HG2 LYS A 33 10.401 -2.971 -9.030 1.00 0.00 H new ATOM 0 HG3 LYS A 33 11.485 -2.941 -10.407 1.00 0.00 H new ATOM 0 HD2 LYS A 33 12.102 -0.986 -8.226 1.00 0.00 H new ATOM 0 HD3 LYS A 33 12.307 -2.678 -7.819 1.00 0.00 H new ATOM 0 HE2 LYS A 33 13.878 -3.016 -9.648 1.00 0.00 H new ATOM 0 HE3 LYS A 33 13.525 -1.437 -10.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 15.603 -1.431 -9.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 14.484 -0.410 -8.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 14.826 -1.939 -7.697 1.00 0.00 H new ATOM 490 N ALA A 34 9.734 -0.510 -6.988 1.00 0.00 N ATOM 491 CA ALA A 34 9.922 0.170 -5.724 1.00 0.00 C ATOM 492 C ALA A 34 11.076 1.167 -5.814 1.00 0.00 C ATOM 493 O ALA A 34 11.979 1.005 -6.641 1.00 0.00 O ATOM 494 CB ALA A 34 10.209 -0.879 -4.641 1.00 0.00 C ATOM 0 H ALA A 34 9.896 -1.515 -6.930 1.00 0.00 H new ATOM 0 HA ALA A 34 9.019 0.726 -5.472 1.00 0.00 H new ATOM 0 HB1 ALA A 34 10.353 -0.382 -3.682 1.00 0.00 H new ATOM 0 HB2 ALA A 34 9.367 -1.568 -4.570 1.00 0.00 H new ATOM 0 HB3 ALA A 34 11.111 -1.433 -4.901 1.00 0.00 H new ATOM 500 N PRO A 35 11.128 2.135 -4.891 1.00 0.00 N ATOM 501 CA PRO A 35 12.289 2.989 -4.720 1.00 0.00 C ATOM 502 C PRO A 35 13.512 2.197 -4.262 1.00 0.00 C ATOM 503 O PRO A 35 14.634 2.670 -4.460 1.00 0.00 O ATOM 504 CB PRO A 35 11.910 4.002 -3.635 1.00 0.00 C ATOM 505 CG PRO A 35 10.827 3.260 -2.852 1.00 0.00 C ATOM 506 CD PRO A 35 10.095 2.514 -3.950 1.00 0.00 C ATOM 0 HA PRO A 35 12.551 3.463 -5.666 1.00 0.00 H new ATOM 0 HB2 PRO A 35 12.762 4.259 -3.005 1.00 0.00 H new ATOM 0 HB3 PRO A 35 11.536 4.933 -4.062 1.00 0.00 H new ATOM 0 HG2 PRO A 35 11.252 2.582 -2.112 1.00 0.00 H new ATOM 0 HG3 PRO A 35 10.170 3.945 -2.317 1.00 0.00 H new ATOM 0 HD2 PRO A 35 9.578 1.639 -3.557 1.00 0.00 H new ATOM 0 HD3 PRO A 35 9.342 3.144 -4.422 1.00 0.00 H new ATOM 514 N ASN A 36 13.321 1.055 -3.580 1.00 0.00 N ATOM 515 CA ASN A 36 14.398 0.445 -2.827 1.00 0.00 C ATOM 516 C ASN A 36 14.175 -1.031 -2.554 1.00 0.00 C ATOM 517 O ASN A 36 13.051 -1.534 -2.580 1.00 0.00 O ATOM 518 CB ASN A 36 14.550 1.177 -1.479 1.00 0.00 C ATOM 519 CG ASN A 36 15.968 1.676 -1.300 1.00 0.00 C ATOM 520 OD1 ASN A 36 16.680 1.231 -0.406 1.00 0.00 O ATOM 521 ND2 ASN A 36 16.388 2.584 -2.160 1.00 0.00 N ATOM 0 H ASN A 36 12.436 0.550 -3.542 1.00 0.00 H new ATOM 0 HA ASN A 36 15.298 0.532 -3.435 1.00 0.00 H new ATOM 0 HB2 ASN A 36 13.855 2.016 -1.434 1.00 0.00 H new ATOM 0 HB3 ASN A 36 14.290 0.504 -0.662 1.00 0.00 H new ATOM 0 HD21 ASN A 36 17.340 2.944 -2.097 1.00 0.00 H new ATOM 0 HD22 ASN A 36 15.761 2.926 -2.888 1.00 0.00 H new ATOM 528 N VAL A 37 15.274 -1.677 -2.190 1.00 0.00 N ATOM 529 CA VAL A 37 15.376 -2.946 -1.499 1.00 0.00 C ATOM 530 C VAL A 37 15.071 -2.782 -0.007 1.00 0.00 C ATOM 531 O VAL A 37 15.926 -2.457 0.819 1.00 0.00 O ATOM 532 CB VAL A 37 16.686 -3.638 -1.902 1.00 0.00 C ATOM 533 CG1 VAL A 37 17.866 -2.728 -1.980 1.00 0.00 C ATOM 534 CG2 VAL A 37 17.022 -4.875 -1.090 1.00 0.00 C ATOM 0 H VAL A 37 16.196 -1.288 -2.390 1.00 0.00 H new ATOM 0 HA VAL A 37 14.604 -3.650 -1.809 1.00 0.00 H new ATOM 0 HB VAL A 37 16.470 -3.972 -2.917 1.00 0.00 H new ATOM 0 HG11 VAL A 37 18.748 -3.299 -2.271 1.00 0.00 H new ATOM 0 HG12 VAL A 37 17.677 -1.950 -2.720 1.00 0.00 H new ATOM 0 HG13 VAL A 37 18.036 -2.269 -1.006 1.00 0.00 H new ATOM 0 HG21 VAL A 37 17.962 -5.298 -1.443 1.00 0.00 H new ATOM 0 HG22 VAL A 37 17.118 -4.605 -0.038 1.00 0.00 H new ATOM 0 HG23 VAL A 37 16.227 -5.612 -1.204 1.00 0.00 H new ATOM 544 N LEU A 38 13.793 -2.964 0.301 1.00 0.00 N ATOM 545 CA LEU A 38 13.193 -2.954 1.629 1.00 0.00 C ATOM 546 C LEU A 38 13.708 -4.148 2.442 1.00 0.00 C ATOM 547 O LEU A 38 13.393 -5.291 2.116 1.00 0.00 O ATOM 548 CB LEU A 38 11.661 -3.019 1.472 1.00 0.00 C ATOM 549 CG LEU A 38 11.057 -1.934 0.565 1.00 0.00 C ATOM 550 CD1 LEU A 38 9.538 -2.092 0.534 1.00 0.00 C ATOM 551 CD2 LEU A 38 11.415 -0.513 1.008 1.00 0.00 C ATOM 0 H LEU A 38 13.097 -3.135 -0.425 1.00 0.00 H new ATOM 0 HA LEU A 38 13.464 -2.042 2.161 1.00 0.00 H new ATOM 0 HB2 LEU A 38 11.392 -3.997 1.073 1.00 0.00 H new ATOM 0 HB3 LEU A 38 11.205 -2.942 2.459 1.00 0.00 H new ATOM 0 HG LEU A 38 11.483 -2.072 -0.429 1.00 0.00 H new ATOM 0 HD11 LEU A 38 9.105 -1.325 -0.108 1.00 0.00 H new ATOM 0 HD12 LEU A 38 9.283 -3.077 0.144 1.00 0.00 H new ATOM 0 HD13 LEU A 38 9.141 -1.987 1.544 1.00 0.00 H new ATOM 0 HD21 LEU A 38 10.959 0.206 0.328 1.00 0.00 H new ATOM 0 HD22 LEU A 38 11.044 -0.342 2.018 1.00 0.00 H new ATOM 0 HD23 LEU A 38 12.498 -0.389 0.994 1.00 0.00 H new ATOM 563 N LYS A 39 14.510 -3.910 3.487 1.00 0.00 N ATOM 564 CA LYS A 39 15.000 -4.984 4.365 1.00 0.00 C ATOM 565 C LYS A 39 13.972 -5.317 5.454 1.00 0.00 C ATOM 566 O LYS A 39 13.033 -4.550 5.680 1.00 0.00 O ATOM 567 CB LYS A 39 16.343 -4.594 5.008 1.00 0.00 C ATOM 568 CG LYS A 39 17.357 -3.905 4.074 1.00 0.00 C ATOM 569 CD LYS A 39 18.536 -3.388 4.910 1.00 0.00 C ATOM 570 CE LYS A 39 19.358 -2.363 4.125 1.00 0.00 C ATOM 571 NZ LYS A 39 20.671 -2.094 4.732 1.00 0.00 N ATOM 0 H LYS A 39 14.836 -2.979 3.747 1.00 0.00 H new ATOM 0 HA LYS A 39 15.151 -5.871 3.750 1.00 0.00 H new ATOM 0 HB2 LYS A 39 16.143 -3.930 5.849 1.00 0.00 H new ATOM 0 HB3 LYS A 39 16.805 -5.494 5.415 1.00 0.00 H new ATOM 0 HG2 LYS A 39 17.710 -4.607 3.319 1.00 0.00 H new ATOM 0 HG3 LYS A 39 16.881 -3.080 3.544 1.00 0.00 H new ATOM 0 HD2 LYS A 39 18.164 -2.934 5.828 1.00 0.00 H new ATOM 0 HD3 LYS A 39 19.173 -4.223 5.202 1.00 0.00 H new ATOM 0 HE2 LYS A 39 19.502 -2.724 3.106 1.00 0.00 H new ATOM 0 HE3 LYS A 39 18.797 -1.431 4.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 21.182 -1.393 4.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 20.539 -1.723 5.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 21.221 -2.975 4.773 1.00 0.00 H new ATOM 585 N GLY A 40 14.164 -6.402 6.203 1.00 0.00 N ATOM 586 CA GLY A 40 13.180 -6.857 7.185 1.00 0.00 C ATOM 587 C GLY A 40 12.103 -7.705 6.501 1.00 0.00 C ATOM 588 O GLY A 40 12.240 -8.051 5.325 1.00 0.00 O ATOM 0 H GLY A 40 14.998 -6.986 6.148 1.00 0.00 H new ATOM 0 HA2 GLY A 40 13.674 -7.441 7.962 1.00 0.00 H new ATOM 0 HA3 GLY A 40 12.721 -5.999 7.675 1.00 0.00 H new ATOM 592 N ASN A 41 11.028 -8.052 7.212 1.00 0.00 N ATOM 593 CA ASN A 41 9.865 -8.728 6.617 1.00 0.00 C ATOM 594 C ASN A 41 8.595 -7.895 6.730 1.00 0.00 C ATOM 595 O ASN A 41 7.703 -8.050 5.898 1.00 0.00 O ATOM 596 CB ASN A 41 9.644 -10.099 7.268 1.00 0.00 C ATOM 597 CG ASN A 41 8.406 -10.824 6.736 1.00 0.00 C ATOM 598 OD1 ASN A 41 8.225 -10.998 5.534 1.00 0.00 O ATOM 599 ND2 ASN A 41 7.531 -11.279 7.618 1.00 0.00 N ATOM 0 H ASN A 41 10.936 -7.875 8.212 1.00 0.00 H new ATOM 0 HA ASN A 41 10.085 -8.860 5.558 1.00 0.00 H new ATOM 0 HB2 ASN A 41 10.523 -10.721 7.098 1.00 0.00 H new ATOM 0 HB3 ASN A 41 9.547 -9.971 8.346 1.00 0.00 H new ATOM 0 HD21 ASN A 41 6.700 -11.778 7.301 1.00 0.00 H new ATOM 0 HD22 ASN A 41 7.688 -11.131 8.615 1.00 0.00 H new ATOM 606 N LYS A 42 8.476 -7.023 7.739 1.00 0.00 N ATOM 607 CA LYS A 42 7.278 -6.207 7.912 1.00 0.00 C ATOM 608 C LYS A 42 7.321 -5.078 6.895 1.00 0.00 C ATOM 609 O LYS A 42 8.115 -4.146 7.019 1.00 0.00 O ATOM 610 CB LYS A 42 7.117 -5.708 9.356 1.00 0.00 C ATOM 611 CG LYS A 42 6.808 -6.882 10.307 1.00 0.00 C ATOM 612 CD LYS A 42 5.357 -7.389 10.216 1.00 0.00 C ATOM 613 CE LYS A 42 5.288 -8.865 10.617 1.00 0.00 C ATOM 614 NZ LYS A 42 3.903 -9.374 10.745 1.00 0.00 N ATOM 0 H LYS A 42 9.196 -6.868 8.445 1.00 0.00 H new ATOM 0 HA LYS A 42 6.391 -6.813 7.730 1.00 0.00 H new ATOM 0 HB2 LYS A 42 8.029 -5.205 9.676 1.00 0.00 H new ATOM 0 HB3 LYS A 42 6.314 -4.973 9.405 1.00 0.00 H new ATOM 0 HG2 LYS A 42 7.486 -7.706 10.084 1.00 0.00 H new ATOM 0 HG3 LYS A 42 7.011 -6.571 11.332 1.00 0.00 H new ATOM 0 HD2 LYS A 42 4.715 -6.797 10.868 1.00 0.00 H new ATOM 0 HD3 LYS A 42 4.983 -7.262 9.200 1.00 0.00 H new ATOM 0 HE2 LYS A 42 5.819 -9.461 9.875 1.00 0.00 H new ATOM 0 HE3 LYS A 42 5.807 -9.001 11.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 3.926 -10.377 11.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 3.399 -8.828 11.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 3.411 -9.274 9.834 1.00 0.00 H new ATOM 628 N LEU A 43 6.513 -5.235 5.857 1.00 0.00 N ATOM 629 CA LEU A 43 6.299 -4.335 4.743 1.00 0.00 C ATOM 630 C LEU A 43 5.211 -3.375 5.206 1.00 0.00 C ATOM 631 O LEU A 43 4.095 -3.795 5.535 1.00 0.00 O ATOM 632 CB LEU A 43 5.856 -5.157 3.508 1.00 0.00 C ATOM 633 CG LEU A 43 6.595 -4.795 2.215 1.00 0.00 C ATOM 634 CD1 LEU A 43 6.190 -5.753 1.090 1.00 0.00 C ATOM 635 CD2 LEU A 43 6.271 -3.374 1.772 1.00 0.00 C ATOM 0 H LEU A 43 5.940 -6.074 5.769 1.00 0.00 H new ATOM 0 HA LEU A 43 7.195 -3.786 4.453 1.00 0.00 H new ATOM 0 HB2 LEU A 43 6.009 -6.216 3.716 1.00 0.00 H new ATOM 0 HB3 LEU A 43 4.786 -5.013 3.354 1.00 0.00 H new ATOM 0 HG LEU A 43 7.663 -4.874 2.417 1.00 0.00 H new ATOM 0 HD11 LEU A 43 6.721 -5.486 0.176 1.00 0.00 H new ATOM 0 HD12 LEU A 43 6.444 -6.774 1.373 1.00 0.00 H new ATOM 0 HD13 LEU A 43 5.116 -5.681 0.920 1.00 0.00 H new ATOM 0 HD21 LEU A 43 6.811 -3.148 0.852 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.199 -3.283 1.596 1.00 0.00 H new ATOM 0 HD23 LEU A 43 6.571 -2.673 2.551 1.00 0.00 H new ATOM 647 N TYR A 44 5.528 -2.089 5.268 1.00 0.00 N ATOM 648 CA TYR A 44 4.597 -1.045 5.637 1.00 0.00 C ATOM 649 C TYR A 44 4.250 -0.298 4.364 1.00 0.00 C ATOM 650 O TYR A 44 5.126 0.086 3.611 1.00 0.00 O ATOM 651 CB TYR A 44 5.223 -0.131 6.693 1.00 0.00 C ATOM 652 CG TYR A 44 5.684 -0.832 7.958 1.00 0.00 C ATOM 653 CD1 TYR A 44 4.833 -1.732 8.632 1.00 0.00 C ATOM 654 CD2 TYR A 44 6.966 -0.565 8.469 1.00 0.00 C ATOM 655 CE1 TYR A 44 5.261 -2.372 9.808 1.00 0.00 C ATOM 656 CE2 TYR A 44 7.387 -1.180 9.664 1.00 0.00 C ATOM 657 CZ TYR A 44 6.540 -2.090 10.339 1.00 0.00 C ATOM 658 OH TYR A 44 6.943 -2.679 11.497 1.00 0.00 O ATOM 0 H TYR A 44 6.463 -1.740 5.057 1.00 0.00 H new ATOM 0 HA TYR A 44 3.689 -1.451 6.083 1.00 0.00 H new ATOM 0 HB2 TYR A 44 6.076 0.381 6.248 1.00 0.00 H new ATOM 0 HB3 TYR A 44 4.497 0.635 6.965 1.00 0.00 H new ATOM 0 HD1 TYR A 44 3.846 -1.931 8.242 1.00 0.00 H new ATOM 0 HD2 TYR A 44 7.627 0.110 7.946 1.00 0.00 H new ATOM 0 HE1 TYR A 44 4.613 -3.079 10.305 1.00 0.00 H new ATOM 0 HE2 TYR A 44 8.363 -0.955 10.068 1.00 0.00 H new ATOM 0 HH TYR A 44 7.848 -2.376 11.720 1.00 0.00 H new ATOM 668 N VAL A 45 2.975 -0.121 4.062 1.00 0.00 N ATOM 669 CA VAL A 45 2.512 0.493 2.818 1.00 0.00 C ATOM 670 C VAL A 45 1.346 1.370 3.246 1.00 0.00 C ATOM 671 O VAL A 45 0.651 1.035 4.217 1.00 0.00 O ATOM 672 CB VAL A 45 2.191 -0.620 1.841 1.00 0.00 C ATOM 673 CG1 VAL A 45 0.848 -1.175 1.890 1.00 0.00 C ATOM 674 CG2 VAL A 45 2.468 -0.273 0.398 1.00 0.00 C ATOM 0 H VAL A 45 2.215 -0.403 4.682 1.00 0.00 H new ATOM 0 HA VAL A 45 3.230 1.120 2.289 1.00 0.00 H new ATOM 0 HB VAL A 45 2.882 -1.381 2.203 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.752 -1.961 1.141 1.00 0.00 H new ATOM 0 HG12 VAL A 45 0.663 -1.592 2.880 1.00 0.00 H new ATOM 0 HG13 VAL A 45 0.122 -0.388 1.686 1.00 0.00 H new ATOM 0 HG21 VAL A 45 2.212 -1.122 -0.236 1.00 0.00 H new ATOM 0 HG22 VAL A 45 1.867 0.590 0.109 1.00 0.00 H new ATOM 0 HG23 VAL A 45 3.525 -0.036 0.277 1.00 0.00 H new ATOM 684 N LYS A 46 1.167 2.495 2.569 1.00 0.00 N ATOM 685 CA LYS A 46 0.234 3.549 2.927 1.00 0.00 C ATOM 686 C LYS A 46 -0.485 3.936 1.641 1.00 0.00 C ATOM 687 O LYS A 46 -0.059 4.866 0.959 1.00 0.00 O ATOM 688 CB LYS A 46 0.986 4.744 3.535 1.00 0.00 C ATOM 689 CG LYS A 46 -0.032 5.847 3.847 1.00 0.00 C ATOM 690 CD LYS A 46 0.369 7.196 3.260 1.00 0.00 C ATOM 691 CE LYS A 46 1.028 8.056 4.331 1.00 0.00 C ATOM 692 NZ LYS A 46 0.710 9.482 4.112 1.00 0.00 N ATOM 0 H LYS A 46 1.691 2.705 1.720 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.481 3.218 3.680 1.00 0.00 H new ATOM 0 HB2 LYS A 46 1.508 4.442 4.443 1.00 0.00 H new ATOM 0 HB3 LYS A 46 1.741 5.110 2.840 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -1.007 5.559 3.454 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -0.140 5.942 4.927 1.00 0.00 H new ATOM 0 HD2 LYS A 46 1.056 7.049 2.426 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -0.510 7.705 2.863 1.00 0.00 H new ATOM 0 HE2 LYS A 46 0.683 7.747 5.318 1.00 0.00 H new ATOM 0 HE3 LYS A 46 2.108 7.910 4.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 0.894 10.017 4.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 1.304 9.856 3.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -0.292 9.578 3.851 1.00 0.00 H new ATOM 706 N ALA A 47 -1.541 3.203 1.295 1.00 0.00 N ATOM 707 CA ALA A 47 -2.165 3.305 -0.013 1.00 0.00 C ATOM 708 C ALA A 47 -3.371 4.245 0.039 1.00 0.00 C ATOM 709 O ALA A 47 -4.117 4.267 1.026 1.00 0.00 O ATOM 710 CB ALA A 47 -2.457 1.893 -0.527 1.00 0.00 C ATOM 0 H ALA A 47 -1.984 2.525 1.915 1.00 0.00 H new ATOM 0 HA ALA A 47 -1.497 3.765 -0.741 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.926 1.953 -1.509 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -1.525 1.334 -0.604 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -3.129 1.385 0.165 1.00 0.00 H new ATOM 716 N ARG A 48 -3.550 5.047 -1.020 1.00 0.00 N ATOM 717 CA ARG A 48 -4.514 6.143 -1.050 1.00 0.00 C ATOM 718 C ARG A 48 -5.863 5.646 -1.572 1.00 0.00 C ATOM 719 O ARG A 48 -6.046 5.490 -2.785 1.00 0.00 O ATOM 720 CB ARG A 48 -3.926 7.264 -1.913 1.00 0.00 C ATOM 721 CG ARG A 48 -4.837 8.497 -2.027 1.00 0.00 C ATOM 722 CD ARG A 48 -4.217 9.735 -1.362 1.00 0.00 C ATOM 723 NE ARG A 48 -3.007 10.257 -2.010 1.00 0.00 N ATOM 724 CZ ARG A 48 -2.956 11.332 -2.805 1.00 0.00 C ATOM 725 NH1 ARG A 48 -4.036 11.832 -3.392 1.00 0.00 N ATOM 726 NH2 ARG A 48 -1.792 11.915 -3.011 1.00 0.00 N ATOM 0 H ARG A 48 -3.021 4.947 -1.887 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.698 6.533 -0.049 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -2.967 7.569 -1.493 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -3.728 6.876 -2.912 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -5.030 8.709 -3.079 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -5.800 8.280 -1.564 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -4.966 10.527 -1.337 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -3.978 9.490 -0.327 1.00 0.00 H new ATOM 0 HE ARG A 48 -2.133 9.759 -1.840 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -4.946 11.395 -3.244 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -3.957 12.653 -3.991 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -0.951 11.545 -2.568 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -1.732 12.736 -3.614 1.00 0.00 H new ATOM 740 N PHE A 49 -6.845 5.445 -0.692 1.00 0.00 N ATOM 741 CA PHE A 49 -8.185 5.001 -1.089 1.00 0.00 C ATOM 742 C PHE A 49 -9.093 6.208 -1.212 1.00 0.00 C ATOM 743 O PHE A 49 -9.641 6.678 -0.215 1.00 0.00 O ATOM 744 CB PHE A 49 -8.721 3.851 -0.230 1.00 0.00 C ATOM 745 CG PHE A 49 -7.872 2.587 -0.253 1.00 0.00 C ATOM 746 CD1 PHE A 49 -6.774 2.525 0.617 1.00 0.00 C ATOM 747 CD2 PHE A 49 -8.115 1.496 -1.125 1.00 0.00 C ATOM 748 CE1 PHE A 49 -5.974 1.379 0.682 1.00 0.00 C ATOM 749 CE2 PHE A 49 -7.314 0.342 -1.051 1.00 0.00 C ATOM 750 CZ PHE A 49 -6.251 0.276 -0.138 1.00 0.00 C ATOM 0 H PHE A 49 -6.736 5.584 0.313 1.00 0.00 H new ATOM 0 HA PHE A 49 -8.139 4.542 -2.077 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -8.807 4.195 0.801 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -9.727 3.602 -0.568 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -6.543 3.373 1.245 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -8.916 1.551 -1.847 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -5.140 1.344 1.367 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -7.518 -0.497 -1.700 1.00 0.00 H new ATOM 0 HZ PHE A 49 -5.650 -0.619 -0.067 1.00 0.00 H new ATOM 760 N MET A 50 -9.175 6.728 -2.444 1.00 0.00 N ATOM 761 CA MET A 50 -10.027 7.848 -2.813 1.00 0.00 C ATOM 762 C MET A 50 -11.435 7.295 -3.017 1.00 0.00 C ATOM 763 O MET A 50 -11.747 6.721 -4.062 1.00 0.00 O ATOM 764 CB MET A 50 -9.545 8.600 -4.074 1.00 0.00 C ATOM 765 CG MET A 50 -8.034 8.837 -4.177 1.00 0.00 C ATOM 766 SD MET A 50 -7.350 10.382 -3.507 1.00 0.00 S ATOM 767 CE MET A 50 -8.061 10.341 -1.858 1.00 0.00 C ATOM 0 H MET A 50 -8.632 6.365 -3.228 1.00 0.00 H new ATOM 0 HA MET A 50 -9.998 8.589 -2.014 1.00 0.00 H new ATOM 0 HB2 MET A 50 -9.866 8.040 -4.952 1.00 0.00 H new ATOM 0 HB3 MET A 50 -10.048 9.566 -4.111 1.00 0.00 H new ATOM 0 HG2 MET A 50 -7.534 8.008 -3.676 1.00 0.00 H new ATOM 0 HG3 MET A 50 -7.761 8.783 -5.231 1.00 0.00 H new ATOM 0 HE1 MET A 50 -7.534 11.047 -1.217 1.00 0.00 H new ATOM 0 HE2 MET A 50 -9.115 10.614 -1.909 1.00 0.00 H new ATOM 0 HE3 MET A 50 -7.966 9.336 -1.446 1.00 0.00 H new ATOM 777 N GLY A 51 -12.251 7.398 -1.978 1.00 0.00 N ATOM 778 CA GLY A 51 -13.626 6.911 -1.950 1.00 0.00 C ATOM 779 C GLY A 51 -13.808 5.797 -0.925 1.00 0.00 C ATOM 780 O GLY A 51 -12.833 5.224 -0.423 1.00 0.00 O ATOM 0 H GLY A 51 -11.967 7.837 -1.102 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -14.299 7.735 -1.715 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -13.903 6.545 -2.939 1.00 0.00 H new ATOM 784 N TYR A 52 -15.062 5.490 -0.597 1.00 0.00 N ATOM 785 CA TYR A 52 -15.416 4.484 0.396 1.00 0.00 C ATOM 786 C TYR A 52 -15.077 3.093 -0.135 1.00 0.00 C ATOM 787 O TYR A 52 -15.424 2.748 -1.265 1.00 0.00 O ATOM 788 CB TYR A 52 -16.907 4.595 0.767 1.00 0.00 C ATOM 789 CG TYR A 52 -17.149 5.086 2.179 1.00 0.00 C ATOM 790 CD1 TYR A 52 -17.190 4.179 3.255 1.00 0.00 C ATOM 791 CD2 TYR A 52 -17.331 6.458 2.419 1.00 0.00 C ATOM 792 CE1 TYR A 52 -17.436 4.644 4.561 1.00 0.00 C ATOM 793 CE2 TYR A 52 -17.606 6.930 3.712 1.00 0.00 C ATOM 794 CZ TYR A 52 -17.673 6.022 4.787 1.00 0.00 C ATOM 795 OH TYR A 52 -17.923 6.497 6.037 1.00 0.00 O ATOM 0 H TYR A 52 -15.872 5.942 -1.022 1.00 0.00 H new ATOM 0 HA TYR A 52 -14.837 4.655 1.304 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -17.397 5.272 0.067 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -17.376 3.618 0.646 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -17.033 3.125 3.078 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -17.259 7.158 1.599 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -17.444 3.951 5.389 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -17.766 7.985 3.882 1.00 0.00 H new ATOM 0 HH TYR A 52 -18.060 7.467 5.997 1.00 0.00 H new ATOM 805 N THR A 53 -14.422 2.286 0.700 1.00 0.00 N ATOM 806 CA THR A 53 -14.270 0.851 0.534 1.00 0.00 C ATOM 807 C THR A 53 -13.982 0.267 1.922 1.00 0.00 C ATOM 808 O THR A 53 -13.356 0.920 2.767 1.00 0.00 O ATOM 809 CB THR A 53 -13.182 0.543 -0.522 1.00 0.00 C ATOM 810 OG1 THR A 53 -13.008 -0.852 -0.691 1.00 0.00 O ATOM 811 CG2 THR A 53 -11.816 1.169 -0.206 1.00 0.00 C ATOM 0 H THR A 53 -13.966 2.634 1.543 1.00 0.00 H new ATOM 0 HA THR A 53 -15.174 0.382 0.146 1.00 0.00 H new ATOM 0 HB THR A 53 -13.552 0.996 -1.442 1.00 0.00 H new ATOM 0 HG1 THR A 53 -13.468 -1.143 -1.506 1.00 0.00 H new ATOM 0 HG21 THR A 53 -11.106 0.909 -0.991 1.00 0.00 H new ATOM 0 HG22 THR A 53 -11.916 2.253 -0.152 1.00 0.00 H new ATOM 0 HG23 THR A 53 -11.455 0.790 0.750 1.00 0.00 H new ATOM 819 N LYS A 54 -14.447 -0.967 2.143 1.00 0.00 N ATOM 820 CA LYS A 54 -14.138 -1.805 3.302 1.00 0.00 C ATOM 821 C LYS A 54 -14.005 -3.277 2.866 1.00 0.00 C ATOM 822 O LYS A 54 -14.375 -4.189 3.606 1.00 0.00 O ATOM 823 CB LYS A 54 -15.179 -1.566 4.428 1.00 0.00 C ATOM 824 CG LYS A 54 -14.774 -0.451 5.420 1.00 0.00 C ATOM 825 CD LYS A 54 -14.535 -0.982 6.846 1.00 0.00 C ATOM 826 CE LYS A 54 -13.758 0.036 7.693 1.00 0.00 C ATOM 827 NZ LYS A 54 -13.548 -0.399 9.091 1.00 0.00 N ATOM 0 H LYS A 54 -15.078 -1.428 1.487 1.00 0.00 H new ATOM 0 HA LYS A 54 -13.173 -1.528 3.726 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -16.137 -1.309 3.977 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -15.326 -2.495 4.979 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -13.867 0.037 5.062 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -15.556 0.308 5.446 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -15.491 -1.200 7.321 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -13.981 -1.920 6.800 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -12.789 0.220 7.228 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -14.296 0.984 7.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -13.018 0.333 9.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -14.469 -0.548 9.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -13.009 -1.288 9.101 1.00 0.00 H new ATOM 841 N LEU A 55 -13.514 -3.522 1.648 1.00 0.00 N ATOM 842 CA LEU A 55 -13.281 -4.836 1.061 1.00 0.00 C ATOM 843 C LEU A 55 -11.860 -4.859 0.484 1.00 0.00 C ATOM 844 O LEU A 55 -11.663 -5.030 -0.720 1.00 0.00 O ATOM 845 CB LEU A 55 -14.314 -5.148 -0.034 1.00 0.00 C ATOM 846 CG LEU A 55 -15.776 -5.363 0.406 1.00 0.00 C ATOM 847 CD1 LEU A 55 -16.572 -4.051 0.452 1.00 0.00 C ATOM 848 CD2 LEU A 55 -16.453 -6.299 -0.602 1.00 0.00 C ATOM 0 H LEU A 55 -13.256 -2.765 1.014 1.00 0.00 H new ATOM 0 HA LEU A 55 -13.387 -5.602 1.829 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -14.297 -4.331 -0.755 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -13.986 -6.044 -0.560 1.00 0.00 H new ATOM 0 HG LEU A 55 -15.763 -5.785 1.411 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -17.595 -4.257 0.767 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -16.105 -3.367 1.160 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -16.582 -3.597 -0.539 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -17.489 -6.463 -0.307 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -16.425 -5.847 -1.594 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -15.926 -7.253 -0.623 1.00 0.00 H new ATOM 860 N THR A 56 -10.857 -4.618 1.326 1.00 0.00 N ATOM 861 CA THR A 56 -9.450 -4.756 0.971 1.00 0.00 C ATOM 862 C THR A 56 -9.116 -6.242 0.842 1.00 0.00 C ATOM 863 O THR A 56 -9.482 -7.013 1.726 1.00 0.00 O ATOM 864 CB THR A 56 -8.558 -4.097 2.051 1.00 0.00 C ATOM 865 OG1 THR A 56 -9.276 -3.636 3.190 1.00 0.00 O ATOM 866 CG2 THR A 56 -7.825 -2.898 1.453 1.00 0.00 C ATOM 0 H THR A 56 -11.004 -4.317 2.289 1.00 0.00 H new ATOM 0 HA THR A 56 -9.261 -4.255 0.021 1.00 0.00 H new ATOM 0 HB THR A 56 -7.872 -4.877 2.381 1.00 0.00 H new ATOM 0 HG1 THR A 56 -8.652 -3.234 3.830 1.00 0.00 H new ATOM 0 HG21 THR A 56 -7.198 -2.437 2.216 1.00 0.00 H new ATOM 0 HG22 THR A 56 -7.201 -3.230 0.623 1.00 0.00 H new ATOM 0 HG23 THR A 56 -8.552 -2.170 1.092 1.00 0.00 H new ATOM 874 N VAL A 57 -8.373 -6.638 -0.190 1.00 0.00 N ATOM 875 CA VAL A 57 -7.897 -8.003 -0.404 1.00 0.00 C ATOM 876 C VAL A 57 -6.428 -7.899 -0.848 1.00 0.00 C ATOM 877 O VAL A 57 -5.992 -6.894 -1.418 1.00 0.00 O ATOM 878 CB VAL A 57 -8.800 -8.705 -1.458 1.00 0.00 C ATOM 879 CG1 VAL A 57 -8.397 -10.172 -1.708 1.00 0.00 C ATOM 880 CG2 VAL A 57 -10.295 -8.642 -1.095 1.00 0.00 C ATOM 0 H VAL A 57 -8.076 -5.996 -0.925 1.00 0.00 H new ATOM 0 HA VAL A 57 -7.951 -8.610 0.500 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.642 -8.142 -2.378 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.062 -10.610 -2.452 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -7.370 -10.210 -2.071 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.474 -10.734 -0.777 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -10.878 -9.147 -1.865 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -10.458 -9.134 -0.136 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.609 -7.601 -1.027 1.00 0.00 H new ATOM 890 N ILE A 58 -5.644 -8.942 -0.574 1.00 0.00 N ATOM 891 CA ILE A 58 -4.236 -9.071 -0.927 1.00 0.00 C ATOM 892 C ILE A 58 -4.075 -10.573 -1.196 1.00 0.00 C ATOM 893 O ILE A 58 -4.353 -11.354 -0.288 1.00 0.00 O ATOM 894 CB ILE A 58 -3.319 -8.586 0.230 1.00 0.00 C ATOM 895 CG1 ILE A 58 -3.761 -7.254 0.890 1.00 0.00 C ATOM 896 CG2 ILE A 58 -1.872 -8.473 -0.280 1.00 0.00 C ATOM 897 CD1 ILE A 58 -2.908 -6.838 2.095 1.00 0.00 C ATOM 0 H ILE A 58 -5.995 -9.759 -0.075 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.950 -8.461 -1.784 1.00 0.00 H new ATOM 0 HB ILE A 58 -3.398 -9.336 1.017 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -3.725 -6.461 0.143 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.799 -7.346 1.208 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.226 -8.133 0.530 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -1.532 -9.448 -0.630 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -1.831 -7.758 -1.102 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -3.282 -5.897 2.498 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -2.963 -7.609 2.863 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -1.872 -6.711 1.781 1.00 0.00 H new ATOM 909 N THR A 59 -3.734 -10.975 -2.423 1.00 0.00 N ATOM 910 CA THR A 59 -3.734 -12.370 -2.860 1.00 0.00 C ATOM 911 C THR A 59 -2.641 -13.183 -2.148 1.00 0.00 C ATOM 912 O THR A 59 -2.824 -14.364 -1.868 1.00 0.00 O ATOM 913 CB THR A 59 -3.546 -12.459 -4.395 1.00 0.00 C ATOM 914 OG1 THR A 59 -4.137 -11.358 -5.074 1.00 0.00 O ATOM 915 CG2 THR A 59 -4.168 -13.721 -4.995 1.00 0.00 C ATOM 0 H THR A 59 -3.445 -10.325 -3.154 1.00 0.00 H new ATOM 0 HA THR A 59 -4.701 -12.797 -2.594 1.00 0.00 H new ATOM 0 HB THR A 59 -2.465 -12.467 -4.534 1.00 0.00 H new ATOM 0 HG1 THR A 59 -3.993 -11.453 -6.039 1.00 0.00 H new ATOM 0 HG21 THR A 59 -4.006 -13.730 -6.073 1.00 0.00 H new ATOM 0 HG22 THR A 59 -3.704 -14.602 -4.551 1.00 0.00 H new ATOM 0 HG23 THR A 59 -5.238 -13.732 -4.789 1.00 0.00 H new ATOM 923 N GLY A 60 -1.494 -12.556 -1.880 1.00 0.00 N ATOM 924 CA GLY A 60 -0.346 -13.206 -1.276 1.00 0.00 C ATOM 925 C GLY A 60 0.186 -14.378 -2.093 1.00 0.00 C ATOM 926 O GLY A 60 -0.173 -14.576 -3.254 1.00 0.00 O ATOM 0 H GLY A 60 -1.342 -11.568 -2.082 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.450 -12.473 -1.145 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -0.620 -13.560 -0.282 1.00 0.00 H new ATOM 930 N LYS A 61 1.102 -15.119 -1.475 1.00 0.00 N ATOM 931 CA LYS A 61 1.772 -16.286 -1.974 1.00 0.00 C ATOM 932 C LYS A 61 0.783 -17.434 -2.077 1.00 0.00 C ATOM 933 O LYS A 61 0.521 -17.930 -3.172 1.00 0.00 O ATOM 934 CB LYS A 61 2.924 -16.461 -0.979 1.00 0.00 C ATOM 935 CG LYS A 61 3.638 -17.784 -1.078 1.00 0.00 C ATOM 936 CD LYS A 61 5.022 -17.793 -0.403 1.00 0.00 C ATOM 937 CE LYS A 61 5.990 -16.757 -0.992 1.00 0.00 C ATOM 938 NZ LYS A 61 7.351 -16.863 -0.429 1.00 0.00 N ATOM 0 H LYS A 61 1.411 -14.886 -0.531 1.00 0.00 H new ATOM 0 HA LYS A 61 2.171 -16.224 -2.986 1.00 0.00 H new ATOM 0 HB2 LYS A 61 3.647 -15.660 -1.134 1.00 0.00 H new ATOM 0 HB3 LYS A 61 2.534 -16.347 0.033 1.00 0.00 H new ATOM 0 HG2 LYS A 61 3.017 -18.557 -0.624 1.00 0.00 H new ATOM 0 HG3 LYS A 61 3.755 -18.046 -2.130 1.00 0.00 H new ATOM 0 HD2 LYS A 61 4.900 -17.602 0.663 1.00 0.00 H new ATOM 0 HD3 LYS A 61 5.460 -18.786 -0.501 1.00 0.00 H new ATOM 0 HE2 LYS A 61 6.038 -16.884 -2.073 1.00 0.00 H new ATOM 0 HE3 LYS A 61 5.601 -15.756 -0.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 8.043 -16.525 -1.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 7.417 -16.283 0.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 7.553 -17.856 -0.194 1.00 0.00 H new ATOM 952 N ASP A 62 0.139 -17.747 -0.960 1.00 0.00 N ATOM 953 CA ASP A 62 -0.842 -18.816 -0.833 1.00 0.00 C ATOM 954 C ASP A 62 -1.992 -18.680 -1.831 1.00 0.00 C ATOM 955 O ASP A 62 -2.584 -19.670 -2.261 1.00 0.00 O ATOM 956 CB ASP A 62 -1.392 -18.788 0.600 1.00 0.00 C ATOM 957 CG ASP A 62 -1.384 -20.162 1.246 1.00 0.00 C ATOM 958 OD1 ASP A 62 -0.313 -20.813 1.238 1.00 0.00 O ATOM 959 OD2 ASP A 62 -2.419 -20.529 1.850 1.00 0.00 O ATOM 0 H ASP A 62 0.291 -17.245 -0.086 1.00 0.00 H new ATOM 0 HA ASP A 62 -0.350 -19.764 -1.051 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -0.796 -18.102 1.202 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -2.411 -18.400 0.589 1.00 0.00 H new ATOM 964 N GLY A 63 -2.320 -17.445 -2.222 1.00 0.00 N ATOM 965 CA GLY A 63 -3.462 -17.130 -3.069 1.00 0.00 C ATOM 966 C GLY A 63 -4.705 -16.731 -2.271 1.00 0.00 C ATOM 967 O GLY A 63 -5.796 -16.631 -2.842 1.00 0.00 O ATOM 0 H GLY A 63 -1.783 -16.622 -1.949 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.194 -16.317 -3.744 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.697 -17.995 -3.689 1.00 0.00 H new ATOM 971 N LYS A 64 -4.586 -16.540 -0.955 1.00 0.00 N ATOM 972 CA LYS A 64 -5.700 -16.225 -0.077 1.00 0.00 C ATOM 973 C LYS A 64 -5.488 -14.869 0.572 1.00 0.00 C ATOM 974 O LYS A 64 -4.358 -14.394 0.681 1.00 0.00 O ATOM 975 CB LYS A 64 -5.964 -17.365 0.905 1.00 0.00 C ATOM 976 CG LYS A 64 -4.845 -17.586 1.925 1.00 0.00 C ATOM 977 CD LYS A 64 -5.379 -17.545 3.364 1.00 0.00 C ATOM 978 CE LYS A 64 -6.062 -18.830 3.862 1.00 0.00 C ATOM 979 NZ LYS A 64 -6.863 -19.547 2.842 1.00 0.00 N ATOM 0 H LYS A 64 -3.693 -16.603 -0.467 1.00 0.00 H new ATOM 0 HA LYS A 64 -6.617 -16.138 -0.660 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -6.892 -17.162 1.439 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -6.115 -18.286 0.343 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -4.368 -18.548 1.740 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -4.079 -16.821 1.798 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -4.550 -17.314 4.033 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -6.091 -16.723 3.444 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -5.297 -19.506 4.243 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -6.711 -18.578 4.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -7.298 -20.388 3.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -7.608 -18.918 2.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -6.245 -19.839 2.058 1.00 0.00 H new ATOM 993 N ASN A 65 -6.589 -14.272 1.015 1.00 0.00 N ATOM 994 CA ASN A 65 -6.673 -12.922 1.542 1.00 0.00 C ATOM 995 C ASN A 65 -5.739 -12.790 2.738 1.00 0.00 C ATOM 996 O ASN A 65 -6.111 -13.170 3.843 1.00 0.00 O ATOM 997 CB ASN A 65 -8.139 -12.651 1.936 1.00 0.00 C ATOM 998 CG ASN A 65 -8.513 -11.190 2.089 1.00 0.00 C ATOM 999 OD1 ASN A 65 -9.359 -10.690 1.370 1.00 0.00 O ATOM 1000 ND2 ASN A 65 -7.915 -10.469 3.013 1.00 0.00 N ATOM 0 H ASN A 65 -7.493 -14.745 1.014 1.00 0.00 H new ATOM 0 HA ASN A 65 -6.366 -12.188 0.797 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -8.788 -13.097 1.183 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -8.345 -13.161 2.877 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -8.159 -9.486 3.130 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -7.207 -10.893 3.612 1.00 0.00 H new ATOM 1007 N LEU A 66 -4.544 -12.227 2.562 1.00 0.00 N ATOM 1008 CA LEU A 66 -3.539 -12.150 3.626 1.00 0.00 C ATOM 1009 C LEU A 66 -4.054 -11.405 4.857 1.00 0.00 C ATOM 1010 O LEU A 66 -3.587 -11.678 5.962 1.00 0.00 O ATOM 1011 CB LEU A 66 -2.292 -11.421 3.101 1.00 0.00 C ATOM 1012 CG LEU A 66 -1.526 -12.163 1.995 1.00 0.00 C ATOM 1013 CD1 LEU A 66 -0.202 -11.418 1.785 1.00 0.00 C ATOM 1014 CD2 LEU A 66 -1.243 -13.626 2.363 1.00 0.00 C ATOM 0 H LEU A 66 -4.244 -11.812 1.680 1.00 0.00 H new ATOM 0 HA LEU A 66 -3.301 -13.172 3.921 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.593 -10.444 2.722 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -1.614 -11.244 3.936 1.00 0.00 H new ATOM 0 HG LEU A 66 -2.131 -12.180 1.089 1.00 0.00 H new ATOM 0 HD11 LEU A 66 0.375 -11.914 1.005 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.406 -10.390 1.487 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.368 -11.420 2.714 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.700 -14.107 1.550 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.643 -13.663 3.272 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.185 -14.148 2.529 1.00 0.00 H new ATOM 1026 N LEU A 67 -5.011 -10.490 4.689 1.00 0.00 N ATOM 1027 CA LEU A 67 -5.627 -9.771 5.803 1.00 0.00 C ATOM 1028 C LEU A 67 -6.578 -10.646 6.633 1.00 0.00 C ATOM 1029 O LEU A 67 -7.040 -10.193 7.678 1.00 0.00 O ATOM 1030 CB LEU A 67 -6.391 -8.543 5.253 1.00 0.00 C ATOM 1031 CG LEU A 67 -5.848 -7.154 5.621 1.00 0.00 C ATOM 1032 CD1 LEU A 67 -4.370 -7.017 5.279 1.00 0.00 C ATOM 1033 CD2 LEU A 67 -6.640 -6.079 4.862 1.00 0.00 C ATOM 0 H LEU A 67 -5.380 -10.227 3.775 1.00 0.00 H new ATOM 0 HA LEU A 67 -4.825 -9.460 6.472 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -6.414 -8.619 4.166 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -7.423 -8.605 5.599 1.00 0.00 H new ATOM 0 HG LEU A 67 -5.962 -7.026 6.697 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.024 -6.021 5.554 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.798 -7.765 5.829 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -4.229 -7.167 4.209 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -6.256 -5.093 5.122 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -6.534 -6.238 3.789 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -7.693 -6.142 5.136 1.00 0.00 H new ATOM 1045 N TYR A 68 -6.908 -11.855 6.167 1.00 0.00 N ATOM 1046 CA TYR A 68 -7.724 -12.840 6.864 1.00 0.00 C ATOM 1047 C TYR A 68 -7.005 -14.193 6.964 1.00 0.00 C ATOM 1048 O TYR A 68 -7.607 -15.218 7.284 1.00 0.00 O ATOM 1049 CB TYR A 68 -9.077 -12.938 6.155 1.00 0.00 C ATOM 1050 CG TYR A 68 -10.162 -13.534 7.021 1.00 0.00 C ATOM 1051 CD1 TYR A 68 -10.461 -12.950 8.266 1.00 0.00 C ATOM 1052 CD2 TYR A 68 -10.856 -14.680 6.602 1.00 0.00 C ATOM 1053 CE1 TYR A 68 -11.469 -13.479 9.078 1.00 0.00 C ATOM 1054 CE2 TYR A 68 -11.861 -15.224 7.413 1.00 0.00 C ATOM 1055 CZ TYR A 68 -12.180 -14.617 8.647 1.00 0.00 C ATOM 1056 OH TYR A 68 -13.205 -15.074 9.413 1.00 0.00 O ATOM 0 H TYR A 68 -6.597 -12.183 5.253 1.00 0.00 H new ATOM 0 HA TYR A 68 -7.894 -12.524 7.893 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -9.384 -11.943 5.833 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -8.965 -13.544 5.256 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -9.906 -12.085 8.598 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -10.616 -15.142 5.656 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -11.701 -13.019 10.027 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -12.392 -16.109 7.094 1.00 0.00 H new ATOM 0 HH TYR A 68 -13.603 -15.864 8.990 1.00 0.00 H new ATOM 1066 N ASN A 69 -5.707 -14.194 6.664 1.00 0.00 N ATOM 1067 CA ASN A 69 -4.764 -15.205 7.102 1.00 0.00 C ATOM 1068 C ASN A 69 -4.426 -14.848 8.550 1.00 0.00 C ATOM 1069 O ASN A 69 -5.075 -15.332 9.474 1.00 0.00 O ATOM 1070 CB ASN A 69 -3.561 -15.167 6.150 1.00 0.00 C ATOM 1071 CG ASN A 69 -2.358 -15.953 6.635 1.00 0.00 C ATOM 1072 OD1 ASN A 69 -1.412 -15.385 7.170 1.00 0.00 O ATOM 1073 ND2 ASN A 69 -2.312 -17.244 6.397 1.00 0.00 N ATOM 0 H ASN A 69 -5.276 -13.467 6.092 1.00 0.00 H new ATOM 0 HA ASN A 69 -5.143 -16.227 7.076 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -3.868 -15.557 5.179 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -3.265 -14.129 5.998 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -1.485 -17.781 6.658 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -3.103 -17.709 5.952 1.00 0.00 H new ATOM 1080 N GLY A 70 -3.540 -13.871 8.748 1.00 0.00 N ATOM 1081 CA GLY A 70 -3.254 -13.299 10.057 1.00 0.00 C ATOM 1082 C GLY A 70 -1.890 -12.626 10.144 1.00 0.00 C ATOM 1083 O GLY A 70 -1.631 -11.932 11.125 1.00 0.00 O ATOM 0 H GLY A 70 -2.997 -13.452 7.993 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -4.026 -12.570 10.302 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -3.310 -14.087 10.808 1.00 0.00 H new ATOM 1087 N THR A 71 -1.037 -12.790 9.132 1.00 0.00 N ATOM 1088 CA THR A 71 0.303 -12.209 9.121 1.00 0.00 C ATOM 1089 C THR A 71 0.261 -10.764 8.601 1.00 0.00 C ATOM 1090 O THR A 71 1.196 -10.004 8.858 1.00 0.00 O ATOM 1091 CB THR A 71 1.218 -13.148 8.313 1.00 0.00 C ATOM 1092 OG1 THR A 71 1.267 -14.393 8.986 1.00 0.00 O ATOM 1093 CG2 THR A 71 2.643 -12.639 8.089 1.00 0.00 C ATOM 0 H THR A 71 -1.258 -13.331 8.296 1.00 0.00 H new ATOM 0 HA THR A 71 0.715 -12.130 10.127 1.00 0.00 H new ATOM 0 HB THR A 71 0.783 -13.222 7.316 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.843 -15.011 8.489 1.00 0.00 H new ATOM 0 HG21 THR A 71 3.205 -13.373 7.511 1.00 0.00 H new ATOM 0 HG22 THR A 71 2.611 -11.695 7.545 1.00 0.00 H new ATOM 0 HG23 THR A 71 3.130 -12.486 9.052 1.00 0.00 H new ATOM 1101 N ALA A 72 -0.824 -10.363 7.915 1.00 0.00 N ATOM 1102 CA ALA A 72 -1.107 -8.985 7.586 1.00 0.00 C ATOM 1103 C ALA A 72 -2.417 -8.546 8.212 1.00 0.00 C ATOM 1104 O ALA A 72 -3.353 -9.334 8.345 1.00 0.00 O ATOM 1105 CB ALA A 72 -1.156 -8.822 6.065 1.00 0.00 C ATOM 0 H ALA A 72 -1.533 -11.013 7.574 1.00 0.00 H new ATOM 0 HA ALA A 72 -0.314 -8.353 7.986 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -1.370 -7.782 5.817 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -0.195 -9.107 5.637 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -1.939 -9.461 5.656 1.00 0.00 H new ATOM 1111 N LYS A 73 -2.504 -7.255 8.525 1.00 0.00 N ATOM 1112 CA LYS A 73 -3.690 -6.579 9.028 1.00 0.00 C ATOM 1113 C LYS A 73 -3.441 -5.076 8.896 1.00 0.00 C ATOM 1114 O LYS A 73 -2.285 -4.639 8.937 1.00 0.00 O ATOM 1115 CB LYS A 73 -3.906 -7.048 10.481 1.00 0.00 C ATOM 1116 CG LYS A 73 -4.864 -6.167 11.273 1.00 0.00 C ATOM 1117 CD LYS A 73 -5.131 -6.711 12.686 1.00 0.00 C ATOM 1118 CE LYS A 73 -6.009 -7.977 12.757 1.00 0.00 C ATOM 1119 NZ LYS A 73 -7.464 -7.700 12.831 1.00 0.00 N ATOM 0 H LYS A 73 -1.708 -6.624 8.429 1.00 0.00 H new ATOM 0 HA LYS A 73 -4.600 -6.811 8.474 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -4.289 -8.068 10.471 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -2.944 -7.074 10.992 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -4.451 -5.161 11.346 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -5.808 -6.086 10.734 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -4.173 -6.927 13.160 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -5.607 -5.927 13.274 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -5.811 -8.593 11.880 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -5.716 -8.561 13.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -7.987 -8.598 12.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -7.668 -7.138 13.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -7.760 -7.169 11.987 1.00 0.00 H new ATOM 1133 N MET A 74 -4.489 -4.266 8.717 1.00 0.00 N ATOM 1134 CA MET A 74 -4.356 -2.815 8.769 1.00 0.00 C ATOM 1135 C MET A 74 -4.382 -2.320 10.217 1.00 0.00 C ATOM 1136 O MET A 74 -5.150 -2.844 11.033 1.00 0.00 O ATOM 1137 CB MET A 74 -5.450 -2.159 7.928 1.00 0.00 C ATOM 1138 CG MET A 74 -6.826 -2.148 8.599 1.00 0.00 C ATOM 1139 SD MET A 74 -8.200 -1.463 7.635 1.00 0.00 S ATOM 1140 CE MET A 74 -7.328 -0.449 6.426 1.00 0.00 C ATOM 0 H MET A 74 -5.437 -4.595 8.535 1.00 0.00 H new ATOM 0 HA MET A 74 -3.392 -2.531 8.348 1.00 0.00 H new ATOM 0 HB2 MET A 74 -5.157 -1.133 7.705 1.00 0.00 H new ATOM 0 HB3 MET A 74 -5.525 -2.683 6.975 1.00 0.00 H new ATOM 0 HG2 MET A 74 -7.079 -3.173 8.871 1.00 0.00 H new ATOM 0 HG3 MET A 74 -6.747 -1.582 9.527 1.00 0.00 H new ATOM 0 HE1 MET A 74 -8.050 0.033 5.767 1.00 0.00 H new ATOM 0 HE2 MET A 74 -6.744 0.313 6.943 1.00 0.00 H new ATOM 0 HE3 MET A 74 -6.662 -1.078 5.836 1.00 0.00 H new ATOM 1150 N PHE A 75 -3.596 -1.282 10.511 1.00 0.00 N ATOM 1151 CA PHE A 75 -3.384 -0.803 11.875 1.00 0.00 C ATOM 1152 C PHE A 75 -3.410 0.720 12.017 1.00 0.00 C ATOM 1153 O PHE A 75 -3.312 1.202 13.141 1.00 0.00 O ATOM 1154 CB PHE A 75 -2.092 -1.417 12.437 1.00 0.00 C ATOM 1155 CG PHE A 75 -0.786 -0.955 11.811 1.00 0.00 C ATOM 1156 CD1 PHE A 75 -0.355 -1.488 10.578 1.00 0.00 C ATOM 1157 CD2 PHE A 75 0.036 -0.041 12.494 1.00 0.00 C ATOM 1158 CE1 PHE A 75 0.887 -1.112 10.039 1.00 0.00 C ATOM 1159 CE2 PHE A 75 1.285 0.324 11.963 1.00 0.00 C ATOM 1160 CZ PHE A 75 1.713 -0.217 10.737 1.00 0.00 C ATOM 0 H PHE A 75 -3.087 -0.749 9.805 1.00 0.00 H new ATOM 0 HA PHE A 75 -4.234 -1.139 12.470 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -2.051 -1.204 13.505 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -2.156 -2.500 12.330 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -0.982 -2.188 10.046 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -0.294 0.382 13.431 1.00 0.00 H new ATOM 0 HE1 PHE A 75 1.206 -1.512 9.088 1.00 0.00 H new ATOM 0 HE2 PHE A 75 1.916 1.020 12.496 1.00 0.00 H new ATOM 0 HZ PHE A 75 2.677 0.056 10.333 1.00 0.00 H new ATOM 1170 N LYS A 76 -3.583 1.488 10.935 1.00 0.00 N ATOM 1171 CA LYS A 76 -3.586 2.956 10.960 1.00 0.00 C ATOM 1172 C LYS A 76 -4.364 3.429 9.730 1.00 0.00 C ATOM 1173 O LYS A 76 -4.411 2.703 8.723 1.00 0.00 O ATOM 1174 CB LYS A 76 -2.114 3.421 11.013 1.00 0.00 C ATOM 1175 CG LYS A 76 -1.839 4.933 11.067 1.00 0.00 C ATOM 1176 CD LYS A 76 -0.356 5.158 11.424 1.00 0.00 C ATOM 1177 CE LYS A 76 0.296 6.412 10.839 1.00 0.00 C ATOM 1178 NZ LYS A 76 -0.337 7.679 11.256 1.00 0.00 N ATOM 0 H LYS A 76 -3.727 1.101 10.002 1.00 0.00 H new ATOM 0 HA LYS A 76 -4.080 3.387 11.830 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -1.651 2.965 11.888 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -1.605 3.019 10.137 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.069 5.393 10.106 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -2.482 5.407 11.809 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -0.267 5.200 12.510 1.00 0.00 H new ATOM 0 HD3 LYS A 76 0.212 4.289 11.091 1.00 0.00 H new ATOM 0 HE2 LYS A 76 1.346 6.431 11.131 1.00 0.00 H new ATOM 0 HE3 LYS A 76 0.269 6.347 9.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 0.395 8.341 11.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -0.844 8.096 10.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -1.008 7.494 12.029 1.00 0.00 H new ATOM 1192 N SER A 77 -5.043 4.571 9.790 1.00 0.00 N ATOM 1193 CA SER A 77 -5.872 5.053 8.690 1.00 0.00 C ATOM 1194 C SER A 77 -6.035 6.570 8.807 1.00 0.00 C ATOM 1195 O SER A 77 -6.961 7.047 9.466 1.00 0.00 O ATOM 1196 CB SER A 77 -7.190 4.251 8.631 1.00 0.00 C ATOM 1197 OG SER A 77 -7.786 4.004 9.895 1.00 0.00 O ATOM 0 H SER A 77 -5.034 5.188 10.602 1.00 0.00 H new ATOM 0 HA SER A 77 -5.395 4.881 7.725 1.00 0.00 H new ATOM 0 HB2 SER A 77 -7.902 4.792 8.007 1.00 0.00 H new ATOM 0 HB3 SER A 77 -6.998 3.296 8.141 1.00 0.00 H new ATOM 0 HG SER A 77 -8.614 3.494 9.772 1.00 0.00 H new ATOM 1203 N ASP A 78 -5.113 7.321 8.206 1.00 0.00 N ATOM 1204 CA ASP A 78 -5.093 8.784 8.265 1.00 0.00 C ATOM 1205 C ASP A 78 -6.152 9.321 7.303 1.00 0.00 C ATOM 1206 O ASP A 78 -6.378 8.752 6.234 1.00 0.00 O ATOM 1207 CB ASP A 78 -3.707 9.340 7.888 1.00 0.00 C ATOM 1208 CG ASP A 78 -2.760 9.433 9.090 1.00 0.00 C ATOM 1209 OD1 ASP A 78 -2.962 10.292 9.980 1.00 0.00 O ATOM 1210 OD2 ASP A 78 -1.764 8.671 9.137 1.00 0.00 O ATOM 0 H ASP A 78 -4.349 6.927 7.657 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.308 9.104 9.285 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -3.259 8.702 7.126 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -3.825 10.329 7.446 1.00 0.00 H new ATOM 1215 N ALA A 79 -6.808 10.418 7.668 1.00 0.00 N ATOM 1216 CA ALA A 79 -7.786 11.096 6.831 1.00 0.00 C ATOM 1217 C ALA A 79 -7.070 11.975 5.788 1.00 0.00 C ATOM 1218 O ALA A 79 -6.174 12.737 6.144 1.00 0.00 O ATOM 1219 CB ALA A 79 -8.691 11.903 7.767 1.00 0.00 C ATOM 0 H ALA A 79 -6.670 10.868 8.573 1.00 0.00 H new ATOM 0 HA ALA A 79 -8.395 10.392 6.263 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -9.443 12.430 7.180 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -9.184 11.229 8.467 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -8.091 12.625 8.320 1.00 0.00 H new ATOM 1225 N ILE A 80 -7.450 11.890 4.503 1.00 0.00 N ATOM 1226 CA ILE A 80 -6.853 12.708 3.440 1.00 0.00 C ATOM 1227 C ILE A 80 -7.836 13.814 3.108 1.00 0.00 C ATOM 1228 O ILE A 80 -8.955 13.541 2.658 1.00 0.00 O ATOM 1229 CB ILE A 80 -6.556 11.904 2.163 1.00 0.00 C ATOM 1230 CG1 ILE A 80 -5.642 10.702 2.432 1.00 0.00 C ATOM 1231 CG2 ILE A 80 -5.902 12.793 1.082 1.00 0.00 C ATOM 1232 CD1 ILE A 80 -5.993 9.601 1.434 1.00 0.00 C ATOM 0 H ILE A 80 -8.177 11.254 4.175 1.00 0.00 H new ATOM 0 HA ILE A 80 -5.900 13.096 3.800 1.00 0.00 H new ATOM 0 HB ILE A 80 -7.519 11.537 1.806 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -4.596 10.990 2.328 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -5.774 10.345 3.453 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -5.704 12.197 0.191 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -6.575 13.612 0.828 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -4.965 13.199 1.463 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -5.354 8.735 1.608 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -7.037 9.313 1.562 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -5.840 9.968 0.419 1.00 0.00 H new ATOM 1244 N LEU A 81 -7.412 15.055 3.306 1.00 0.00 N ATOM 1245 CA LEU A 81 -8.195 16.211 2.887 1.00 0.00 C ATOM 1246 C LEU A 81 -7.846 16.611 1.454 1.00 0.00 C ATOM 1247 O LEU A 81 -6.668 16.626 1.074 1.00 0.00 O ATOM 1248 CB LEU A 81 -7.981 17.417 3.801 1.00 0.00 C ATOM 1249 CG LEU A 81 -8.211 17.220 5.306 1.00 0.00 C ATOM 1250 CD1 LEU A 81 -8.221 18.596 5.982 1.00 0.00 C ATOM 1251 CD2 LEU A 81 -9.546 16.534 5.591 1.00 0.00 C ATOM 0 H LEU A 81 -6.527 15.288 3.756 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.242 15.913 2.947 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.958 17.767 3.661 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -8.641 18.216 3.462 1.00 0.00 H new ATOM 0 HG LEU A 81 -7.411 16.588 5.692 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -8.384 18.474 7.053 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -7.264 19.091 5.814 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -9.022 19.203 5.560 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.671 16.413 6.667 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -10.360 17.144 5.198 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.562 15.555 5.112 1.00 0.00 H new ATOM 1263 N GLY A 82 -8.855 17.010 0.677 1.00 0.00 N ATOM 1264 CA GLY A 82 -8.697 17.399 -0.720 1.00 0.00 C ATOM 1265 C GLY A 82 -8.827 18.905 -0.908 1.00 0.00 C ATOM 1266 O GLY A 82 -9.681 19.344 -1.680 1.00 0.00 O ATOM 0 H GLY A 82 -9.818 17.072 1.008 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -7.722 17.071 -1.080 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -9.448 16.891 -1.325 1.00 0.00 H new ATOM 1270 N GLN A 83 -7.993 19.680 -0.207 1.00 0.00 N ATOM 1271 CA GLN A 83 -7.857 21.144 -0.228 1.00 0.00 C ATOM 1272 C GLN A 83 -9.057 21.851 0.407 1.00 0.00 C ATOM 1273 O GLN A 83 -8.921 22.539 1.418 1.00 0.00 O ATOM 1274 CB GLN A 83 -7.484 21.689 -1.625 1.00 0.00 C ATOM 1275 CG GLN A 83 -6.276 21.007 -2.299 1.00 0.00 C ATOM 1276 CD GLN A 83 -5.175 20.595 -1.320 1.00 0.00 C ATOM 1277 OE1 GLN A 83 -4.630 21.397 -0.573 1.00 0.00 O ATOM 1278 NE2 GLN A 83 -4.875 19.308 -1.231 1.00 0.00 N ATOM 0 H GLN A 83 -7.335 19.262 0.450 1.00 0.00 H new ATOM 0 HA GLN A 83 -7.006 21.387 0.408 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -8.350 21.587 -2.280 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -7.275 22.755 -1.537 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -6.622 20.123 -2.835 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -5.855 21.685 -3.041 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -5.326 18.635 -1.851 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -4.193 18.990 -0.543 1.00 0.00 H new ATOM 1287 N ASN A 84 -10.261 21.617 -0.117 1.00 0.00 N ATOM 1288 CA ASN A 84 -11.537 22.141 0.378 1.00 0.00 C ATOM 1289 C ASN A 84 -11.966 21.525 1.717 1.00 0.00 C ATOM 1290 O ASN A 84 -13.160 21.523 2.013 1.00 0.00 O ATOM 1291 CB ASN A 84 -12.627 21.919 -0.699 1.00 0.00 C ATOM 1292 CG ASN A 84 -12.579 22.974 -1.776 1.00 0.00 C ATOM 1293 OD1 ASN A 84 -13.097 24.069 -1.596 1.00 0.00 O ATOM 1294 ND2 ASN A 84 -12.004 22.665 -2.919 1.00 0.00 N ATOM 0 H ASN A 84 -10.380 21.027 -0.940 1.00 0.00 H new ATOM 0 HA ASN A 84 -11.404 23.206 0.568 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -12.497 20.935 -1.149 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -13.610 21.926 -0.227 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -11.983 23.344 -3.679 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -11.579 21.746 -3.044 1.00 0.00 H new ATOM 1301 N LYS A 85 -11.049 20.949 2.506 1.00 0.00 N ATOM 1302 CA LYS A 85 -11.322 20.095 3.669 1.00 0.00 C ATOM 1303 C LYS A 85 -12.201 18.876 3.351 1.00 0.00 C ATOM 1304 O LYS A 85 -12.626 18.165 4.258 1.00 0.00 O ATOM 1305 CB LYS A 85 -11.899 20.916 4.835 1.00 0.00 C ATOM 1306 CG LYS A 85 -10.982 22.060 5.296 1.00 0.00 C ATOM 1307 CD LYS A 85 -11.553 22.698 6.579 1.00 0.00 C ATOM 1308 CE LYS A 85 -10.460 23.084 7.582 1.00 0.00 C ATOM 1309 NZ LYS A 85 -10.184 24.534 7.625 1.00 0.00 N ATOM 0 H LYS A 85 -10.050 21.072 2.343 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.358 19.688 3.974 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -12.861 21.331 4.535 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.088 20.251 5.678 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -9.977 21.681 5.483 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -10.898 22.811 4.511 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -12.128 23.585 6.314 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -12.244 22.000 7.051 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -10.756 22.749 8.576 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -9.542 22.555 7.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -9.436 24.725 8.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -9.872 24.856 6.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -11.049 25.044 7.896 1.00 0.00 H new ATOM 1323 N VAL A 86 -12.461 18.606 2.076 1.00 0.00 N ATOM 1324 CA VAL A 86 -13.272 17.484 1.626 1.00 0.00 C ATOM 1325 C VAL A 86 -12.562 16.174 1.984 1.00 0.00 C ATOM 1326 O VAL A 86 -11.353 16.066 1.759 1.00 0.00 O ATOM 1327 CB VAL A 86 -13.691 17.645 0.160 1.00 0.00 C ATOM 1328 CG1 VAL A 86 -12.476 17.951 -0.681 1.00 0.00 C ATOM 1329 CG2 VAL A 86 -14.482 16.448 -0.381 1.00 0.00 C ATOM 0 H VAL A 86 -12.104 19.176 1.309 1.00 0.00 H new ATOM 0 HA VAL A 86 -14.225 17.457 2.154 1.00 0.00 H new ATOM 0 HB VAL A 86 -14.383 18.485 0.103 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -12.774 18.065 -1.723 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -12.015 18.875 -0.332 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -11.760 17.134 -0.596 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -14.747 16.628 -1.423 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -13.872 15.547 -0.312 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -15.391 16.317 0.207 1.00 0.00 H new ATOM 1339 N VAL A 87 -13.290 15.197 2.528 1.00 0.00 N ATOM 1340 CA VAL A 87 -12.769 13.872 2.851 1.00 0.00 C ATOM 1341 C VAL A 87 -12.661 13.092 1.533 1.00 0.00 C ATOM 1342 O VAL A 87 -13.540 12.296 1.199 1.00 0.00 O ATOM 1343 CB VAL A 87 -13.697 13.153 3.868 1.00 0.00 C ATOM 1344 CG1 VAL A 87 -13.062 11.868 4.440 1.00 0.00 C ATOM 1345 CG2 VAL A 87 -14.108 14.048 5.046 1.00 0.00 C ATOM 0 H VAL A 87 -14.277 15.309 2.760 1.00 0.00 H new ATOM 0 HA VAL A 87 -11.789 13.942 3.322 1.00 0.00 H new ATOM 0 HB VAL A 87 -14.585 12.898 3.289 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -13.752 11.404 5.145 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -12.852 11.173 3.627 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -12.133 12.118 4.952 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -14.756 13.487 5.720 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -13.218 14.373 5.584 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -14.643 14.920 4.671 1.00 0.00 H new ATOM 1355 N ILE A 88 -11.621 13.343 0.733 1.00 0.00 N ATOM 1356 CA ILE A 88 -11.484 12.659 -0.555 1.00 0.00 C ATOM 1357 C ILE A 88 -11.184 11.174 -0.365 1.00 0.00 C ATOM 1358 O ILE A 88 -11.517 10.363 -1.230 1.00 0.00 O ATOM 1359 CB ILE A 88 -10.450 13.341 -1.474 1.00 0.00 C ATOM 1360 CG1 ILE A 88 -9.076 13.593 -0.813 1.00 0.00 C ATOM 1361 CG2 ILE A 88 -11.071 14.654 -1.954 1.00 0.00 C ATOM 1362 CD1 ILE A 88 -7.997 14.003 -1.829 1.00 0.00 C ATOM 0 H ILE A 88 -10.874 14.003 0.949 1.00 0.00 H new ATOM 0 HA ILE A 88 -12.446 12.738 -1.062 1.00 0.00 H new ATOM 0 HB ILE A 88 -10.232 12.666 -2.301 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -9.177 14.375 -0.060 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -8.756 12.690 -0.293 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -10.369 15.170 -2.609 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -11.990 14.443 -2.500 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -11.296 15.285 -1.095 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -7.053 14.167 -1.310 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -7.873 13.211 -2.567 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -8.300 14.922 -2.331 1.00 0.00 H new ATOM 1374 N GLY A 89 -10.577 10.797 0.754 1.00 0.00 N ATOM 1375 CA GLY A 89 -10.236 9.416 1.022 1.00 0.00 C ATOM 1376 C GLY A 89 -9.510 9.279 2.343 1.00 0.00 C ATOM 1377 O GLY A 89 -9.452 10.231 3.131 1.00 0.00 O ATOM 0 H GLY A 89 -10.310 11.443 1.497 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -11.143 8.811 1.038 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -9.609 9.031 0.218 1.00 0.00 H new ATOM 1381 N TRP A 90 -8.927 8.098 2.561 1.00 0.00 N ATOM 1382 CA TRP A 90 -8.133 7.805 3.736 1.00 0.00 C ATOM 1383 C TRP A 90 -6.884 7.052 3.284 1.00 0.00 C ATOM 1384 O TRP A 90 -6.956 6.175 2.416 1.00 0.00 O ATOM 1385 CB TRP A 90 -9.000 7.015 4.718 1.00 0.00 C ATOM 1386 CG TRP A 90 -10.298 7.677 5.064 1.00 0.00 C ATOM 1387 CD1 TRP A 90 -10.518 8.475 6.129 1.00 0.00 C ATOM 1388 CD2 TRP A 90 -11.548 7.655 4.306 1.00 0.00 C ATOM 1389 NE1 TRP A 90 -11.818 8.950 6.073 1.00 0.00 N ATOM 1390 CE2 TRP A 90 -12.516 8.428 5.005 1.00 0.00 C ATOM 1391 CE3 TRP A 90 -11.964 7.041 3.106 1.00 0.00 C ATOM 1392 CZ2 TRP A 90 -13.839 8.547 4.550 1.00 0.00 C ATOM 1393 CZ3 TRP A 90 -13.276 7.189 2.619 1.00 0.00 C ATOM 1394 CH2 TRP A 90 -14.218 7.936 3.342 1.00 0.00 C ATOM 0 H TRP A 90 -9.000 7.314 1.912 1.00 0.00 H new ATOM 0 HA TRP A 90 -7.802 8.705 4.255 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -9.208 6.033 4.292 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -8.433 6.851 5.635 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -9.798 8.706 6.900 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -12.213 9.609 6.744 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -11.259 6.443 2.548 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -14.562 9.106 5.126 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -13.559 6.726 1.685 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -15.228 8.041 2.973 1.00 0.00 H new ATOM 1405 N ASP A 91 -5.747 7.451 3.844 1.00 0.00 N ATOM 1406 CA ASP A 91 -4.429 6.859 3.676 1.00 0.00 C ATOM 1407 C ASP A 91 -4.463 5.634 4.588 1.00 0.00 C ATOM 1408 O ASP A 91 -4.221 5.744 5.792 1.00 0.00 O ATOM 1409 CB ASP A 91 -3.326 7.868 4.089 1.00 0.00 C ATOM 1410 CG ASP A 91 -2.763 8.758 2.977 1.00 0.00 C ATOM 1411 OD1 ASP A 91 -2.929 8.447 1.780 1.00 0.00 O ATOM 1412 OD2 ASP A 91 -2.042 9.727 3.329 1.00 0.00 O ATOM 0 H ASP A 91 -5.723 8.254 4.472 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.200 6.590 2.645 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -3.728 8.512 4.871 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -2.500 7.309 4.530 1.00 0.00 H new ATOM 1417 N LYS A 92 -4.909 4.484 4.067 1.00 0.00 N ATOM 1418 CA LYS A 92 -4.971 3.241 4.852 1.00 0.00 C ATOM 1419 C LYS A 92 -3.570 2.606 4.894 1.00 0.00 C ATOM 1420 O LYS A 92 -2.917 2.516 3.853 1.00 0.00 O ATOM 1421 CB LYS A 92 -5.946 2.221 4.241 1.00 0.00 C ATOM 1422 CG LYS A 92 -7.354 2.662 3.790 1.00 0.00 C ATOM 1423 CD LYS A 92 -8.445 2.799 4.860 1.00 0.00 C ATOM 1424 CE LYS A 92 -9.807 2.509 4.192 1.00 0.00 C ATOM 1425 NZ LYS A 92 -10.953 2.435 5.122 1.00 0.00 N ATOM 0 H LYS A 92 -5.233 4.387 3.105 1.00 0.00 H new ATOM 0 HA LYS A 92 -5.323 3.497 5.851 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -5.452 1.782 3.374 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -6.077 1.422 4.971 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -7.257 3.624 3.287 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -7.705 1.947 3.045 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -8.266 2.102 5.679 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -8.436 3.802 5.287 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -10.006 3.286 3.454 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -9.736 1.566 3.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -11.822 2.237 4.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -10.791 1.674 5.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -11.053 3.341 5.622 1.00 0.00 H new ATOM 1439 N TYR A 93 -3.150 2.092 6.053 1.00 0.00 N ATOM 1440 CA TYR A 93 -1.829 1.497 6.261 1.00 0.00 C ATOM 1441 C TYR A 93 -1.945 -0.021 6.441 1.00 0.00 C ATOM 1442 O TYR A 93 -2.873 -0.468 7.121 1.00 0.00 O ATOM 1443 CB TYR A 93 -1.204 2.110 7.518 1.00 0.00 C ATOM 1444 CG TYR A 93 -0.854 3.586 7.445 1.00 0.00 C ATOM 1445 CD1 TYR A 93 -1.862 4.566 7.431 1.00 0.00 C ATOM 1446 CD2 TYR A 93 0.491 3.994 7.427 1.00 0.00 C ATOM 1447 CE1 TYR A 93 -1.535 5.927 7.428 1.00 0.00 C ATOM 1448 CE2 TYR A 93 0.828 5.359 7.416 1.00 0.00 C ATOM 1449 CZ TYR A 93 -0.189 6.336 7.460 1.00 0.00 C ATOM 1450 OH TYR A 93 0.118 7.659 7.559 1.00 0.00 O ATOM 0 H TYR A 93 -3.732 2.078 6.890 1.00 0.00 H new ATOM 0 HA TYR A 93 -1.205 1.698 5.390 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -1.893 1.963 8.349 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -0.296 1.555 7.754 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -2.899 4.266 7.422 1.00 0.00 H new ATOM 0 HD2 TYR A 93 1.274 3.251 7.422 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -2.321 6.668 7.401 1.00 0.00 H new ATOM 0 HE2 TYR A 93 1.865 5.659 7.374 1.00 0.00 H new ATOM 0 HH TYR A 93 -0.342 8.045 8.333 1.00 0.00 H new ATOM 1460 N PHE A 94 -1.006 -0.820 5.905 1.00 0.00 N ATOM 1461 CA PHE A 94 -1.020 -2.287 6.001 1.00 0.00 C ATOM 1462 C PHE A 94 0.268 -2.805 6.616 1.00 0.00 C ATOM 1463 O PHE A 94 1.331 -2.313 6.237 1.00 0.00 O ATOM 1464 CB PHE A 94 -1.160 -2.899 4.602 1.00 0.00 C ATOM 1465 CG PHE A 94 -2.391 -2.363 3.907 1.00 0.00 C ATOM 1466 CD1 PHE A 94 -2.301 -1.184 3.146 1.00 0.00 C ATOM 1467 CD2 PHE A 94 -3.650 -2.933 4.175 1.00 0.00 C ATOM 1468 CE1 PHE A 94 -3.462 -0.570 2.663 1.00 0.00 C ATOM 1469 CE2 PHE A 94 -4.816 -2.327 3.679 1.00 0.00 C ATOM 1470 CZ PHE A 94 -4.720 -1.143 2.925 1.00 0.00 C ATOM 0 H PHE A 94 -0.206 -0.458 5.386 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.863 -2.570 6.631 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -0.274 -2.672 4.010 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -1.223 -3.984 4.679 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -1.334 -0.752 2.934 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -3.719 -3.837 4.762 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -3.392 0.343 2.090 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -5.782 -2.768 3.876 1.00 0.00 H new ATOM 0 HZ PHE A 94 -5.615 -0.672 2.546 1.00 0.00 H new ATOM 1480 N GLU A 95 0.178 -3.814 7.483 1.00 0.00 N ATOM 1481 CA GLU A 95 1.343 -4.538 7.985 1.00 0.00 C ATOM 1482 C GLU A 95 1.532 -5.831 7.187 1.00 0.00 C ATOM 1483 O GLU A 95 1.269 -6.901 7.711 1.00 0.00 O ATOM 1484 CB GLU A 95 1.086 -4.821 9.468 1.00 0.00 C ATOM 1485 CG GLU A 95 2.316 -5.335 10.223 1.00 0.00 C ATOM 1486 CD GLU A 95 2.168 -5.167 11.736 1.00 0.00 C ATOM 1487 OE1 GLU A 95 1.026 -5.007 12.222 1.00 0.00 O ATOM 1488 OE2 GLU A 95 3.211 -5.119 12.427 1.00 0.00 O ATOM 0 H GLU A 95 -0.709 -4.152 7.857 1.00 0.00 H new ATOM 0 HA GLU A 95 2.259 -3.958 7.872 1.00 0.00 H new ATOM 0 HB2 GLU A 95 0.733 -3.907 9.947 1.00 0.00 H new ATOM 0 HB3 GLU A 95 0.285 -5.556 9.554 1.00 0.00 H new ATOM 0 HG2 GLU A 95 2.472 -6.388 9.988 1.00 0.00 H new ATOM 0 HG3 GLU A 95 3.201 -4.798 9.883 1.00 0.00 H new ATOM 1495 N ILE A 96 1.869 -5.768 5.901 1.00 0.00 N ATOM 1496 CA ILE A 96 2.018 -6.992 5.106 1.00 0.00 C ATOM 1497 C ILE A 96 3.379 -7.651 5.401 1.00 0.00 C ATOM 1498 O ILE A 96 4.330 -6.941 5.705 1.00 0.00 O ATOM 1499 CB ILE A 96 1.802 -6.742 3.588 1.00 0.00 C ATOM 1500 CG1 ILE A 96 1.917 -5.264 3.146 1.00 0.00 C ATOM 1501 CG2 ILE A 96 0.413 -7.262 3.178 1.00 0.00 C ATOM 1502 CD1 ILE A 96 2.160 -5.105 1.645 1.00 0.00 C ATOM 0 H ILE A 96 2.042 -4.902 5.391 1.00 0.00 H new ATOM 0 HA ILE A 96 1.232 -7.686 5.404 1.00 0.00 H new ATOM 0 HB ILE A 96 2.610 -7.277 3.090 1.00 0.00 H new ATOM 0 HG12 ILE A 96 1.002 -4.737 3.418 1.00 0.00 H new ATOM 0 HG13 ILE A 96 2.732 -4.790 3.692 1.00 0.00 H new ATOM 0 HG21 ILE A 96 0.259 -7.088 2.113 1.00 0.00 H new ATOM 0 HG22 ILE A 96 0.349 -8.331 3.384 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -0.355 -6.737 3.746 1.00 0.00 H new ATOM 0 HD11 ILE A 96 2.231 -4.046 1.398 1.00 0.00 H new ATOM 0 HD12 ILE A 96 3.089 -5.605 1.372 1.00 0.00 H new ATOM 0 HD13 ILE A 96 1.333 -5.551 1.093 1.00 0.00 H new ATOM 1514 N PRO A 97 3.515 -8.985 5.283 1.00 0.00 N ATOM 1515 CA PRO A 97 4.820 -9.627 5.148 1.00 0.00 C ATOM 1516 C PRO A 97 5.387 -9.362 3.744 1.00 0.00 C ATOM 1517 O PRO A 97 4.642 -9.076 2.806 1.00 0.00 O ATOM 1518 CB PRO A 97 4.553 -11.121 5.339 1.00 0.00 C ATOM 1519 CG PRO A 97 3.132 -11.279 4.803 1.00 0.00 C ATOM 1520 CD PRO A 97 2.458 -9.980 5.228 1.00 0.00 C ATOM 0 HA PRO A 97 5.545 -9.249 5.869 1.00 0.00 H new ATOM 0 HB2 PRO A 97 5.265 -11.734 4.786 1.00 0.00 H new ATOM 0 HB3 PRO A 97 4.626 -11.415 6.386 1.00 0.00 H new ATOM 0 HG2 PRO A 97 3.121 -11.404 3.720 1.00 0.00 H new ATOM 0 HG3 PRO A 97 2.634 -12.150 5.229 1.00 0.00 H new ATOM 0 HD2 PRO A 97 1.685 -9.690 4.517 1.00 0.00 H new ATOM 0 HD3 PRO A 97 1.974 -10.090 6.198 1.00 0.00 H new ATOM 1528 N MET A 98 6.687 -9.579 3.569 1.00 0.00 N ATOM 1529 CA MET A 98 7.329 -9.779 2.270 1.00 0.00 C ATOM 1530 C MET A 98 7.335 -11.268 1.914 1.00 0.00 C ATOM 1531 O MET A 98 7.138 -11.656 0.762 1.00 0.00 O ATOM 1532 CB MET A 98 8.783 -9.295 2.324 1.00 0.00 C ATOM 1533 CG MET A 98 8.887 -7.792 2.566 1.00 0.00 C ATOM 1534 SD MET A 98 10.591 -7.256 2.790 1.00 0.00 S ATOM 1535 CE MET A 98 10.292 -5.751 3.741 1.00 0.00 C ATOM 0 H MET A 98 7.344 -9.622 4.348 1.00 0.00 H new ATOM 0 HA MET A 98 6.773 -9.215 1.521 1.00 0.00 H new ATOM 0 HB2 MET A 98 9.310 -9.825 3.117 1.00 0.00 H new ATOM 0 HB3 MET A 98 9.281 -9.545 1.387 1.00 0.00 H new ATOM 0 HG2 MET A 98 8.448 -7.259 1.723 1.00 0.00 H new ATOM 0 HG3 MET A 98 8.305 -7.527 3.449 1.00 0.00 H new ATOM 0 HE1 MET A 98 11.233 -5.390 4.156 1.00 0.00 H new ATOM 0 HE2 MET A 98 9.866 -4.988 3.090 1.00 0.00 H new ATOM 0 HE3 MET A 98 9.596 -5.965 4.552 1.00 0.00 H new ATOM 1545 N ASP A 99 7.578 -12.117 2.915 1.00 0.00 N ATOM 1546 CA ASP A 99 7.922 -13.530 2.744 1.00 0.00 C ATOM 1547 C ASP A 99 6.730 -14.395 2.324 1.00 0.00 C ATOM 1548 O ASP A 99 6.895 -15.548 1.932 1.00 0.00 O ATOM 1549 CB ASP A 99 8.503 -14.057 4.060 1.00 0.00 C ATOM 1550 CG ASP A 99 9.476 -15.207 3.830 1.00 0.00 C ATOM 1551 OD1 ASP A 99 9.057 -16.385 3.847 1.00 0.00 O ATOM 1552 OD2 ASP A 99 10.694 -14.920 3.733 1.00 0.00 O ATOM 0 H ASP A 99 7.540 -11.833 3.894 1.00 0.00 H new ATOM 0 HA ASP A 99 8.652 -13.595 1.937 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.014 -13.248 4.581 1.00 0.00 H new ATOM 0 HB3 ASP A 99 7.692 -14.391 4.707 1.00 0.00 H new ATOM 1557 N ALA A 100 5.517 -13.838 2.378 1.00 0.00 N ATOM 1558 CA ALA A 100 4.274 -14.493 1.989 1.00 0.00 C ATOM 1559 C ALA A 100 3.639 -13.779 0.788 1.00 0.00 C ATOM 1560 O ALA A 100 2.413 -13.766 0.644 1.00 0.00 O ATOM 1561 CB ALA A 100 3.333 -14.592 3.192 1.00 0.00 C ATOM 0 H ALA A 100 5.373 -12.883 2.707 1.00 0.00 H new ATOM 0 HA ALA A 100 4.485 -15.512 1.665 1.00 0.00 H new ATOM 0 HB1 ALA A 100 2.408 -15.083 2.891 1.00 0.00 H new ATOM 0 HB2 ALA A 100 3.811 -15.172 3.981 1.00 0.00 H new ATOM 0 HB3 ALA A 100 3.109 -13.592 3.562 1.00 0.00 H new ATOM 1567 N LEU A 101 4.458 -13.180 -0.081 1.00 0.00 N ATOM 1568 CA LEU A 101 4.006 -12.546 -1.312 1.00 0.00 C ATOM 1569 C LEU A 101 4.318 -13.420 -2.513 1.00 0.00 C ATOM 1570 O LEU A 101 5.193 -14.275 -2.476 1.00 0.00 O ATOM 1571 CB LEU A 101 4.655 -11.174 -1.494 1.00 0.00 C ATOM 1572 CG LEU A 101 4.303 -10.186 -0.374 1.00 0.00 C ATOM 1573 CD1 LEU A 101 5.036 -8.895 -0.704 1.00 0.00 C ATOM 1574 CD2 LEU A 101 2.792 -9.935 -0.244 1.00 0.00 C ATOM 0 H LEU A 101 5.467 -13.124 0.057 1.00 0.00 H new ATOM 0 HA LEU A 101 2.926 -12.416 -1.237 1.00 0.00 H new ATOM 0 HB2 LEU A 101 5.738 -11.294 -1.537 1.00 0.00 H new ATOM 0 HB3 LEU A 101 4.343 -10.755 -2.451 1.00 0.00 H new ATOM 0 HG LEU A 101 4.606 -10.597 0.589 1.00 0.00 H new ATOM 0 HD11 LEU A 101 4.823 -8.150 0.062 1.00 0.00 H new ATOM 0 HD12 LEU A 101 6.109 -9.084 -0.738 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.702 -8.525 -1.673 1.00 0.00 H new ATOM 0 HD21 LEU A 101 2.609 -9.228 0.565 1.00 0.00 H new ATOM 0 HD22 LEU A 101 2.410 -9.524 -1.178 1.00 0.00 H new ATOM 0 HD23 LEU A 101 2.284 -10.875 -0.026 1.00 0.00 H new ATOM 1586 N GLN A 102 3.546 -13.201 -3.571 1.00 0.00 N ATOM 1587 CA GLN A 102 3.400 -14.102 -4.700 1.00 0.00 C ATOM 1588 C GLN A 102 4.631 -14.162 -5.607 1.00 0.00 C ATOM 1589 O GLN A 102 4.786 -15.127 -6.352 1.00 0.00 O ATOM 1590 CB GLN A 102 2.168 -13.596 -5.456 1.00 0.00 C ATOM 1591 CG GLN A 102 1.599 -14.607 -6.441 1.00 0.00 C ATOM 1592 CD GLN A 102 0.364 -14.033 -7.130 1.00 0.00 C ATOM 1593 OE1 GLN A 102 0.452 -13.031 -7.840 1.00 0.00 O ATOM 1594 NE2 GLN A 102 -0.812 -14.574 -6.894 1.00 0.00 N ATOM 0 H GLN A 102 2.983 -12.356 -3.666 1.00 0.00 H new ATOM 0 HA GLN A 102 3.287 -15.129 -4.352 1.00 0.00 H new ATOM 0 HB2 GLN A 102 1.395 -13.328 -4.736 1.00 0.00 H new ATOM 0 HB3 GLN A 102 2.431 -12.685 -5.994 1.00 0.00 H new ATOM 0 HG2 GLN A 102 2.353 -14.865 -7.185 1.00 0.00 H new ATOM 0 HG3 GLN A 102 1.338 -15.528 -5.919 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -0.883 -15.404 -6.306 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -1.653 -14.163 -7.300 1.00 0.00 H new ATOM 1603 N ASP A 103 5.450 -13.117 -5.567 1.00 0.00 N ATOM 1604 CA ASP A 103 6.679 -12.885 -6.321 1.00 0.00 C ATOM 1605 C ASP A 103 7.424 -11.764 -5.572 1.00 0.00 C ATOM 1606 O ASP A 103 6.950 -11.322 -4.516 1.00 0.00 O ATOM 1607 CB ASP A 103 6.302 -12.442 -7.743 1.00 0.00 C ATOM 1608 CG ASP A 103 7.365 -12.711 -8.796 1.00 0.00 C ATOM 1609 OD1 ASP A 103 8.559 -12.435 -8.580 1.00 0.00 O ATOM 1610 OD2 ASP A 103 6.944 -13.059 -9.920 1.00 0.00 O ATOM 0 H ASP A 103 5.251 -12.334 -4.945 1.00 0.00 H new ATOM 0 HA ASP A 103 7.305 -13.774 -6.401 1.00 0.00 H new ATOM 0 HB2 ASP A 103 5.383 -12.951 -8.036 1.00 0.00 H new ATOM 0 HB3 ASP A 103 6.085 -11.374 -7.730 1.00 0.00 H new ATOM 1615 N ASN A 104 8.499 -11.206 -6.137 1.00 0.00 N ATOM 1616 CA ASN A 104 9.124 -9.966 -5.679 1.00 0.00 C ATOM 1617 C ASN A 104 8.215 -8.743 -5.837 1.00 0.00 C ATOM 1618 O ASN A 104 8.689 -7.642 -5.586 1.00 0.00 O ATOM 1619 CB ASN A 104 10.458 -9.693 -6.416 1.00 0.00 C ATOM 1620 CG ASN A 104 11.634 -10.548 -5.991 1.00 0.00 C ATOM 1621 OD1 ASN A 104 11.663 -11.759 -6.195 1.00 0.00 O ATOM 1622 ND2 ASN A 104 12.639 -9.915 -5.422 1.00 0.00 N ATOM 0 H ASN A 104 8.968 -11.616 -6.945 1.00 0.00 H new ATOM 0 HA ASN A 104 9.314 -10.117 -4.616 1.00 0.00 H new ATOM 0 HB2 ASN A 104 10.297 -9.836 -7.484 1.00 0.00 H new ATOM 0 HB3 ASN A 104 10.723 -8.646 -6.271 1.00 0.00 H new ATOM 0 HD21 ASN A 104 13.471 -10.431 -5.137 1.00 0.00 H new ATOM 0 HD22 ASN A 104 12.585 -8.908 -5.266 1.00 0.00 H new ATOM 1629 N SER A 105 6.945 -8.855 -6.244 1.00 0.00 N ATOM 1630 CA SER A 105 6.075 -7.687 -6.380 1.00 0.00 C ATOM 1631 C SER A 105 4.935 -7.718 -5.374 1.00 0.00 C ATOM 1632 O SER A 105 4.541 -8.776 -4.871 1.00 0.00 O ATOM 1633 CB SER A 105 5.636 -7.467 -7.839 1.00 0.00 C ATOM 1634 OG SER A 105 4.452 -8.166 -8.198 1.00 0.00 O ATOM 0 H SER A 105 6.500 -9.741 -6.484 1.00 0.00 H new ATOM 0 HA SER A 105 6.653 -6.799 -6.126 1.00 0.00 H new ATOM 0 HB2 SER A 105 5.480 -6.401 -8.004 1.00 0.00 H new ATOM 0 HB3 SER A 105 6.444 -7.777 -8.501 1.00 0.00 H new ATOM 0 HG SER A 105 4.687 -9.052 -8.544 1.00 0.00 H new ATOM 1640 N ILE A 106 4.381 -6.536 -5.127 1.00 0.00 N ATOM 1641 CA ILE A 106 3.214 -6.305 -4.310 1.00 0.00 C ATOM 1642 C ILE A 106 2.239 -5.443 -5.119 1.00 0.00 C ATOM 1643 O ILE A 106 2.638 -4.665 -5.988 1.00 0.00 O ATOM 1644 CB ILE A 106 3.653 -5.698 -2.955 1.00 0.00 C ATOM 1645 CG1 ILE A 106 2.468 -5.408 -2.017 1.00 0.00 C ATOM 1646 CG2 ILE A 106 4.471 -4.401 -3.094 1.00 0.00 C ATOM 1647 CD1 ILE A 106 1.680 -6.648 -1.583 1.00 0.00 C ATOM 0 H ILE A 106 4.761 -5.673 -5.516 1.00 0.00 H new ATOM 0 HA ILE A 106 2.686 -7.225 -4.057 1.00 0.00 H new ATOM 0 HB ILE A 106 4.287 -6.473 -2.523 1.00 0.00 H new ATOM 0 HG12 ILE A 106 2.842 -4.901 -1.127 1.00 0.00 H new ATOM 0 HG13 ILE A 106 1.788 -4.717 -2.515 1.00 0.00 H new ATOM 0 HG21 ILE A 106 4.743 -4.034 -2.104 1.00 0.00 H new ATOM 0 HG22 ILE A 106 5.376 -4.601 -3.668 1.00 0.00 H new ATOM 0 HG23 ILE A 106 3.874 -3.648 -3.608 1.00 0.00 H new ATOM 0 HD11 ILE A 106 0.865 -6.349 -0.924 1.00 0.00 H new ATOM 0 HD12 ILE A 106 1.272 -7.146 -2.463 1.00 0.00 H new ATOM 0 HD13 ILE A 106 2.342 -7.333 -1.053 1.00 0.00 H new ATOM 1659 N GLN A 107 0.952 -5.598 -4.818 1.00 0.00 N ATOM 1660 CA GLN A 107 -0.149 -4.738 -5.213 1.00 0.00 C ATOM 1661 C GLN A 107 -1.270 -4.970 -4.186 1.00 0.00 C ATOM 1662 O GLN A 107 -1.271 -6.001 -3.496 1.00 0.00 O ATOM 1663 CB GLN A 107 -0.604 -5.078 -6.646 1.00 0.00 C ATOM 1664 CG GLN A 107 -1.212 -6.481 -6.756 1.00 0.00 C ATOM 1665 CD GLN A 107 -1.686 -6.847 -8.151 1.00 0.00 C ATOM 1666 OE1 GLN A 107 -1.573 -8.004 -8.539 1.00 0.00 O ATOM 1667 NE2 GLN A 107 -2.329 -5.937 -8.861 1.00 0.00 N ATOM 0 H GLN A 107 0.634 -6.385 -4.252 1.00 0.00 H new ATOM 0 HA GLN A 107 0.141 -3.687 -5.224 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -1.338 -4.342 -6.974 1.00 0.00 H new ATOM 0 HB3 GLN A 107 0.248 -5.002 -7.321 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -0.471 -7.212 -6.433 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -2.054 -6.555 -6.068 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -2.408 -4.981 -8.514 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -2.747 -6.190 -9.756 1.00 0.00 H new ATOM 1676 N ILE A 108 -2.276 -4.099 -4.161 1.00 0.00 N ATOM 1677 CA ILE A 108 -3.517 -4.270 -3.405 1.00 0.00 C ATOM 1678 C ILE A 108 -4.651 -4.400 -4.425 1.00 0.00 C ATOM 1679 O ILE A 108 -4.500 -4.051 -5.597 1.00 0.00 O ATOM 1680 CB ILE A 108 -3.734 -3.105 -2.401 1.00 0.00 C ATOM 1681 CG1 ILE A 108 -2.493 -2.931 -1.501 1.00 0.00 C ATOM 1682 CG2 ILE A 108 -4.991 -3.333 -1.532 1.00 0.00 C ATOM 1683 CD1 ILE A 108 -2.587 -1.799 -0.474 1.00 0.00 C ATOM 0 H ILE A 108 -2.250 -3.224 -4.684 1.00 0.00 H new ATOM 0 HA ILE A 108 -3.480 -5.168 -2.789 1.00 0.00 H new ATOM 0 HB ILE A 108 -3.885 -2.194 -2.980 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -2.314 -3.867 -0.971 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -1.625 -2.753 -2.136 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -5.112 -2.499 -0.841 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -5.869 -3.403 -2.174 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -4.880 -4.259 -0.967 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -1.667 -1.759 0.109 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -2.731 -0.850 -0.991 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -3.430 -1.981 0.192 1.00 0.00 H new ATOM 1695 N LYS A 109 -5.801 -4.914 -4.001 1.00 0.00 N ATOM 1696 CA LYS A 109 -7.037 -4.879 -4.758 1.00 0.00 C ATOM 1697 C LYS A 109 -8.156 -4.604 -3.757 1.00 0.00 C ATOM 1698 O LYS A 109 -8.151 -5.177 -2.666 1.00 0.00 O ATOM 1699 CB LYS A 109 -7.189 -6.180 -5.571 1.00 0.00 C ATOM 1700 CG LYS A 109 -7.089 -7.487 -4.779 1.00 0.00 C ATOM 1701 CD LYS A 109 -5.932 -8.378 -5.243 1.00 0.00 C ATOM 1702 CE LYS A 109 -4.571 -7.700 -5.060 1.00 0.00 C ATOM 1703 NZ LYS A 109 -3.483 -8.645 -5.341 1.00 0.00 N ATOM 0 H LYS A 109 -5.896 -5.377 -3.097 1.00 0.00 H new ATOM 0 HA LYS A 109 -7.061 -4.087 -5.507 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -8.155 -6.158 -6.075 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -6.424 -6.190 -6.347 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -6.962 -7.256 -3.721 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -8.025 -8.037 -4.875 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -5.949 -9.313 -4.683 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -6.071 -8.633 -6.294 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -4.494 -6.840 -5.725 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -4.480 -7.324 -4.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -2.747 -8.553 -4.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -3.856 -9.616 -5.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -3.074 -8.436 -6.274 1.00 0.00 H new ATOM 1717 N ALA A 110 -9.041 -3.660 -4.060 1.00 0.00 N ATOM 1718 CA ALA A 110 -10.204 -3.371 -3.232 1.00 0.00 C ATOM 1719 C ALA A 110 -11.447 -3.212 -4.103 1.00 0.00 C ATOM 1720 O ALA A 110 -11.396 -2.582 -5.163 1.00 0.00 O ATOM 1721 CB ALA A 110 -9.943 -2.130 -2.371 1.00 0.00 C ATOM 0 H ALA A 110 -8.970 -3.072 -4.891 1.00 0.00 H new ATOM 0 HA ALA A 110 -10.384 -4.207 -2.557 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -10.819 -1.923 -1.756 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -9.082 -2.308 -1.727 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -9.743 -1.275 -3.017 1.00 0.00 H new ATOM 1727 N LEU A 111 -12.559 -3.781 -3.631 1.00 0.00 N ATOM 1728 CA LEU A 111 -13.868 -3.634 -4.261 1.00 0.00 C ATOM 1729 C LEU A 111 -14.284 -2.180 -4.100 1.00 0.00 C ATOM 1730 O LEU A 111 -14.124 -1.592 -3.026 1.00 0.00 O ATOM 1731 CB LEU A 111 -14.883 -4.577 -3.600 1.00 0.00 C ATOM 1732 CG LEU A 111 -16.131 -4.974 -4.411 1.00 0.00 C ATOM 1733 CD1 LEU A 111 -16.992 -3.852 -4.950 1.00 0.00 C ATOM 1734 CD2 LEU A 111 -15.866 -5.963 -5.537 1.00 0.00 C ATOM 0 H LEU A 111 -12.573 -4.362 -2.793 1.00 0.00 H new ATOM 0 HA LEU A 111 -13.826 -3.897 -5.318 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -14.359 -5.492 -3.323 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -15.220 -4.110 -2.674 1.00 0.00 H new ATOM 0 HG LEU A 111 -16.707 -5.458 -3.622 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -17.834 -4.272 -5.500 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -17.364 -3.248 -4.122 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -16.399 -3.227 -5.617 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -16.800 -6.185 -6.053 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -15.156 -5.530 -6.242 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -15.452 -6.883 -5.124 1.00 0.00 H new ATOM 1746 N SER A 112 -14.814 -1.623 -5.180 1.00 0.00 N ATOM 1747 CA SER A 112 -15.365 -0.280 -5.210 1.00 0.00 C ATOM 1748 C SER A 112 -16.808 -0.314 -4.728 1.00 0.00 C ATOM 1749 O SER A 112 -17.062 0.077 -3.587 1.00 0.00 O ATOM 1750 CB SER A 112 -15.185 0.323 -6.606 1.00 0.00 C ATOM 1751 OG SER A 112 -13.849 0.126 -7.028 1.00 0.00 O ATOM 0 H SER A 112 -14.873 -2.104 -6.077 1.00 0.00 H new ATOM 0 HA SER A 112 -14.828 0.378 -4.527 1.00 0.00 H new ATOM 0 HB2 SER A 112 -15.874 -0.145 -7.309 1.00 0.00 H new ATOM 0 HB3 SER A 112 -15.421 1.387 -6.589 1.00 0.00 H new ATOM 0 HG SER A 112 -13.391 0.991 -7.078 1.00 0.00 H new ATOM 1757 N SER A 113 -17.728 -0.849 -5.536 1.00 0.00 N ATOM 1758 CA SER A 113 -19.122 -0.986 -5.131 1.00 0.00 C ATOM 1759 C SER A 113 -19.778 -2.227 -5.727 1.00 0.00 C ATOM 1760 O SER A 113 -20.127 -3.143 -4.976 1.00 0.00 O ATOM 1761 CB SER A 113 -19.916 0.288 -5.458 1.00 0.00 C ATOM 1762 OG SER A 113 -20.500 0.809 -4.285 1.00 0.00 O ATOM 0 H SER A 113 -17.528 -1.194 -6.475 1.00 0.00 H new ATOM 0 HA SER A 113 -19.133 -1.120 -4.049 1.00 0.00 H new ATOM 0 HB2 SER A 113 -19.257 1.031 -5.907 1.00 0.00 H new ATOM 0 HB3 SER A 113 -20.691 0.065 -6.191 1.00 0.00 H new ATOM 0 HG SER A 113 -21.002 1.622 -4.503 1.00 0.00 H new ATOM 1768 N GLY A 114 -19.944 -2.289 -7.046 1.00 0.00 N ATOM 1769 CA GLY A 114 -20.759 -3.301 -7.693 1.00 0.00 C ATOM 1770 C GLY A 114 -19.986 -3.879 -8.854 1.00 0.00 C ATOM 1771 O GLY A 114 -19.852 -3.216 -9.883 1.00 0.00 O ATOM 0 H GLY A 114 -19.512 -1.632 -7.696 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -21.018 -4.087 -6.984 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -21.695 -2.865 -8.042 1.00 0.00 H new ATOM 1775 N THR A 115 -19.485 -5.104 -8.673 1.00 0.00 N ATOM 1776 CA THR A 115 -18.667 -5.812 -9.653 1.00 0.00 C ATOM 1777 C THR A 115 -17.557 -4.902 -10.203 1.00 0.00 C ATOM 1778 O THR A 115 -17.404 -4.749 -11.411 1.00 0.00 O ATOM 1779 CB THR A 115 -19.568 -6.498 -10.707 1.00 0.00 C ATOM 1780 OG1 THR A 115 -20.633 -5.668 -11.142 1.00 0.00 O ATOM 1781 CG2 THR A 115 -20.219 -7.749 -10.108 1.00 0.00 C ATOM 0 H THR A 115 -19.642 -5.641 -7.820 1.00 0.00 H new ATOM 0 HA THR A 115 -18.124 -6.630 -9.178 1.00 0.00 H new ATOM 0 HB THR A 115 -18.916 -6.731 -11.549 1.00 0.00 H new ATOM 0 HG1 THR A 115 -20.284 -4.782 -11.374 1.00 0.00 H new ATOM 0 HG21 THR A 115 -20.851 -8.225 -10.858 1.00 0.00 H new ATOM 0 HG22 THR A 115 -19.444 -8.447 -9.792 1.00 0.00 H new ATOM 0 HG23 THR A 115 -20.826 -7.467 -9.248 1.00 0.00 H new ATOM 1789 N THR A 116 -16.810 -4.282 -9.287 1.00 0.00 N ATOM 1790 CA THR A 116 -15.710 -3.384 -9.600 1.00 0.00 C ATOM 1791 C THR A 116 -14.554 -3.627 -8.651 1.00 0.00 C ATOM 1792 O THR A 116 -14.679 -3.337 -7.458 1.00 0.00 O ATOM 1793 CB THR A 116 -16.151 -1.911 -9.506 1.00 0.00 C ATOM 1794 OG1 THR A 116 -17.362 -1.715 -8.779 1.00 0.00 O ATOM 1795 CG2 THR A 116 -16.213 -1.344 -10.912 1.00 0.00 C ATOM 0 H THR A 116 -16.961 -4.397 -8.285 1.00 0.00 H new ATOM 0 HA THR A 116 -15.393 -3.586 -10.623 1.00 0.00 H new ATOM 0 HB THR A 116 -15.411 -1.366 -8.920 1.00 0.00 H new ATOM 0 HG1 THR A 116 -17.580 -0.760 -8.758 1.00 0.00 H new ATOM 0 HG21 THR A 116 -16.524 -0.300 -10.870 1.00 0.00 H new ATOM 0 HG22 THR A 116 -15.229 -1.411 -11.375 1.00 0.00 H new ATOM 0 HG23 THR A 116 -16.931 -1.913 -11.502 1.00 0.00 H new ATOM 1803 N PHE A 117 -13.423 -4.120 -9.150 1.00 0.00 N ATOM 1804 CA PHE A 117 -12.208 -4.279 -8.404 1.00 0.00 C ATOM 1805 C PHE A 117 -11.120 -3.515 -9.157 1.00 0.00 C ATOM 1806 O PHE A 117 -10.649 -3.956 -10.205 1.00 0.00 O ATOM 1807 CB PHE A 117 -11.883 -5.779 -8.296 1.00 0.00 C ATOM 1808 CG PHE A 117 -12.221 -6.492 -6.993 1.00 0.00 C ATOM 1809 CD1 PHE A 117 -11.558 -6.168 -5.793 1.00 0.00 C ATOM 1810 CD2 PHE A 117 -13.154 -7.546 -6.991 1.00 0.00 C ATOM 1811 CE1 PHE A 117 -11.854 -6.835 -4.595 1.00 0.00 C ATOM 1812 CE2 PHE A 117 -13.448 -8.224 -5.794 1.00 0.00 C ATOM 1813 CZ PHE A 117 -12.814 -7.857 -4.593 1.00 0.00 C ATOM 0 H PHE A 117 -13.340 -4.426 -10.119 1.00 0.00 H new ATOM 0 HA PHE A 117 -12.290 -3.887 -7.390 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -12.405 -6.293 -9.103 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -10.815 -5.903 -8.477 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.808 -5.391 -5.795 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -13.644 -7.834 -7.909 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -11.346 -6.563 -3.681 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -14.165 -9.032 -5.797 1.00 0.00 H new ATOM 0 HZ PHE A 117 -13.066 -8.361 -3.672 1.00 0.00 H new ATOM 1823 N VAL A 118 -10.695 -2.367 -8.633 1.00 0.00 N ATOM 1824 CA VAL A 118 -9.591 -1.604 -9.200 1.00 0.00 C ATOM 1825 C VAL A 118 -8.307 -2.186 -8.619 1.00 0.00 C ATOM 1826 O VAL A 118 -7.988 -1.992 -7.447 1.00 0.00 O ATOM 1827 CB VAL A 118 -9.719 -0.121 -8.849 1.00 0.00 C ATOM 1828 CG1 VAL A 118 -8.723 0.684 -9.687 1.00 0.00 C ATOM 1829 CG2 VAL A 118 -11.136 0.443 -9.025 1.00 0.00 C ATOM 0 H VAL A 118 -11.108 -1.942 -7.803 1.00 0.00 H new ATOM 0 HA VAL A 118 -9.592 -1.674 -10.288 1.00 0.00 H new ATOM 0 HB VAL A 118 -9.494 -0.030 -7.786 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -8.811 1.742 -9.440 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -7.710 0.344 -9.473 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -8.938 0.540 -10.746 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -11.143 1.499 -8.756 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -11.446 0.331 -10.064 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -11.827 -0.100 -8.380 1.00 0.00 H new ATOM 1839 N TYR A 119 -7.644 -3.059 -9.356 1.00 0.00 N ATOM 1840 CA TYR A 119 -6.399 -3.691 -8.905 1.00 0.00 C ATOM 1841 C TYR A 119 -5.328 -2.613 -8.994 1.00 0.00 C ATOM 1842 O TYR A 119 -5.238 -1.948 -10.032 1.00 0.00 O ATOM 1843 CB TYR A 119 -6.040 -4.926 -9.747 1.00 0.00 C ATOM 1844 CG TYR A 119 -7.078 -6.031 -9.706 1.00 0.00 C ATOM 1845 CD1 TYR A 119 -8.255 -5.877 -10.451 1.00 0.00 C ATOM 1846 CD2 TYR A 119 -6.884 -7.205 -8.950 1.00 0.00 C ATOM 1847 CE1 TYR A 119 -9.253 -6.860 -10.432 1.00 0.00 C ATOM 1848 CE2 TYR A 119 -7.890 -8.190 -8.902 1.00 0.00 C ATOM 1849 CZ TYR A 119 -9.085 -8.013 -9.640 1.00 0.00 C ATOM 1850 OH TYR A 119 -10.079 -8.938 -9.572 1.00 0.00 O ATOM 0 H TYR A 119 -7.946 -3.355 -10.284 1.00 0.00 H new ATOM 0 HA TYR A 119 -6.498 -4.065 -7.886 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -5.896 -4.616 -10.782 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -5.087 -5.325 -9.398 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -8.395 -4.988 -11.048 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -5.962 -7.350 -8.406 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -10.148 -6.734 -11.023 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -7.750 -9.078 -8.304 1.00 0.00 H new ATOM 0 HH TYR A 119 -9.803 -9.672 -8.984 1.00 0.00 H new ATOM 1860 N SER A 120 -4.576 -2.377 -7.917 1.00 0.00 N ATOM 1861 CA SER A 120 -3.542 -1.351 -7.893 1.00 0.00 C ATOM 1862 C SER A 120 -2.437 -1.713 -8.880 1.00 0.00 C ATOM 1863 O SER A 120 -2.367 -2.852 -9.361 1.00 0.00 O ATOM 1864 CB SER A 120 -3.019 -1.158 -6.460 1.00 0.00 C ATOM 1865 OG SER A 120 -1.898 -1.951 -6.104 1.00 0.00 O ATOM 0 H SER A 120 -4.669 -2.892 -7.042 1.00 0.00 H new ATOM 0 HA SER A 120 -3.958 -0.394 -8.208 1.00 0.00 H new ATOM 0 HB2 SER A 120 -2.756 -0.109 -6.327 1.00 0.00 H new ATOM 0 HB3 SER A 120 -3.830 -1.374 -5.764 1.00 0.00 H new ATOM 0 HG SER A 120 -1.082 -1.412 -6.169 1.00 0.00 H new ATOM 1871 N GLN A 121 -1.523 -0.772 -9.117 1.00 0.00 N ATOM 1872 CA GLN A 121 -0.356 -1.084 -9.911 1.00 0.00 C ATOM 1873 C GLN A 121 0.484 -2.168 -9.230 1.00 0.00 C ATOM 1874 O GLN A 121 0.404 -2.349 -8.007 1.00 0.00 O ATOM 1875 CB GLN A 121 0.473 0.173 -10.187 1.00 0.00 C ATOM 1876 CG GLN A 121 1.339 0.691 -9.037 1.00 0.00 C ATOM 1877 CD GLN A 121 0.703 1.750 -8.157 1.00 0.00 C ATOM 1878 OE1 GLN A 121 -0.251 1.513 -7.417 1.00 0.00 O ATOM 1879 NE2 GLN A 121 1.289 2.935 -8.174 1.00 0.00 N ATOM 0 H GLN A 121 -1.573 0.188 -8.776 1.00 0.00 H new ATOM 0 HA GLN A 121 -0.690 -1.473 -10.873 1.00 0.00 H new ATOM 0 HB2 GLN A 121 1.123 -0.028 -11.039 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -0.207 0.970 -10.487 1.00 0.00 H new ATOM 0 HG2 GLN A 121 1.620 -0.155 -8.410 1.00 0.00 H new ATOM 0 HG3 GLN A 121 2.260 1.098 -9.455 1.00 0.00 H new ATOM 0 HE21 GLN A 121 2.078 3.105 -8.797 1.00 0.00 H new ATOM 0 HE22 GLN A 121 0.952 3.679 -7.564 1.00 0.00 H new ATOM 1888 N LYS A 122 1.322 -2.827 -10.023 1.00 0.00 N ATOM 1889 CA LYS A 122 2.346 -3.757 -9.577 1.00 0.00 C ATOM 1890 C LYS A 122 3.558 -2.932 -9.171 1.00 0.00 C ATOM 1891 O LYS A 122 3.931 -2.016 -9.902 1.00 0.00 O ATOM 1892 CB LYS A 122 2.669 -4.677 -10.765 1.00 0.00 C ATOM 1893 CG LYS A 122 3.411 -5.961 -10.379 1.00 0.00 C ATOM 1894 CD LYS A 122 3.911 -6.685 -11.638 1.00 0.00 C ATOM 1895 CE LYS A 122 4.382 -8.111 -11.332 1.00 0.00 C ATOM 1896 NZ LYS A 122 5.090 -8.727 -12.471 1.00 0.00 N ATOM 0 H LYS A 122 1.303 -2.721 -11.037 1.00 0.00 H new ATOM 0 HA LYS A 122 2.031 -4.365 -8.729 1.00 0.00 H new ATOM 0 HB2 LYS A 122 1.739 -4.945 -11.267 1.00 0.00 H new ATOM 0 HB3 LYS A 122 3.272 -4.124 -11.485 1.00 0.00 H new ATOM 0 HG2 LYS A 122 4.253 -5.722 -9.730 1.00 0.00 H new ATOM 0 HG3 LYS A 122 2.749 -6.616 -9.813 1.00 0.00 H new ATOM 0 HD2 LYS A 122 3.112 -6.718 -12.378 1.00 0.00 H new ATOM 0 HD3 LYS A 122 4.731 -6.119 -12.080 1.00 0.00 H new ATOM 0 HE2 LYS A 122 5.041 -8.094 -10.464 1.00 0.00 H new ATOM 0 HE3 LYS A 122 3.522 -8.726 -11.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 5.388 -9.690 -12.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 4.455 -8.769 -13.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 5.927 -8.157 -12.709 1.00 0.00 H new ATOM 1910 N ILE A 123 4.179 -3.255 -8.041 1.00 0.00 N ATOM 1911 CA ILE A 123 5.444 -2.685 -7.602 1.00 0.00 C ATOM 1912 C ILE A 123 6.302 -3.870 -7.197 1.00 0.00 C ATOM 1913 O ILE A 123 6.156 -4.431 -6.111 1.00 0.00 O ATOM 1914 CB ILE A 123 5.228 -1.627 -6.483 1.00 0.00 C ATOM 1915 CG1 ILE A 123 4.229 -0.498 -6.827 1.00 0.00 C ATOM 1916 CG2 ILE A 123 6.547 -0.973 -6.045 1.00 0.00 C ATOM 1917 CD1 ILE A 123 4.697 0.508 -7.892 1.00 0.00 C ATOM 0 H ILE A 123 3.803 -3.942 -7.387 1.00 0.00 H new ATOM 0 HA ILE A 123 5.951 -2.122 -8.386 1.00 0.00 H new ATOM 0 HB ILE A 123 4.794 -2.213 -5.673 1.00 0.00 H new ATOM 0 HG12 ILE A 123 3.299 -0.953 -7.168 1.00 0.00 H new ATOM 0 HG13 ILE A 123 4.000 0.050 -5.913 1.00 0.00 H new ATOM 0 HG21 ILE A 123 6.348 -0.241 -5.262 1.00 0.00 H new ATOM 0 HG22 ILE A 123 7.223 -1.738 -5.663 1.00 0.00 H new ATOM 0 HG23 ILE A 123 7.007 -0.475 -6.898 1.00 0.00 H new ATOM 0 HD11 ILE A 123 3.919 1.254 -8.054 1.00 0.00 H new ATOM 0 HD12 ILE A 123 5.608 1.001 -7.552 1.00 0.00 H new ATOM 0 HD13 ILE A 123 4.896 -0.017 -8.826 1.00 0.00 H new ATOM 1929 N ASP A 124 7.148 -4.284 -8.134 1.00 0.00 N ATOM 1930 CA ASP A 124 8.313 -5.131 -7.910 1.00 0.00 C ATOM 1931 C ASP A 124 9.217 -4.441 -6.871 1.00 0.00 C ATOM 1932 O ASP A 124 9.279 -3.209 -6.840 1.00 0.00 O ATOM 1933 CB ASP A 124 9.000 -5.325 -9.272 1.00 0.00 C ATOM 1934 CG ASP A 124 8.472 -6.537 -10.050 1.00 0.00 C ATOM 1935 OD1 ASP A 124 8.985 -7.653 -9.825 1.00 0.00 O ATOM 1936 OD2 ASP A 124 7.541 -6.393 -10.891 1.00 0.00 O ATOM 0 H ASP A 124 7.035 -4.026 -9.114 1.00 0.00 H new ATOM 0 HA ASP A 124 8.058 -6.114 -7.513 1.00 0.00 H new ATOM 0 HB2 ASP A 124 8.860 -4.427 -9.873 1.00 0.00 H new ATOM 0 HB3 ASP A 124 10.073 -5.441 -9.117 1.00 0.00 H new ATOM 1941 N PHE A 125 9.901 -5.182 -5.999 1.00 0.00 N ATOM 1942 CA PHE A 125 10.808 -4.664 -4.976 1.00 0.00 C ATOM 1943 C PHE A 125 11.918 -5.682 -4.720 1.00 0.00 C ATOM 1944 O PHE A 125 11.822 -6.852 -5.099 1.00 0.00 O ATOM 1945 CB PHE A 125 10.046 -4.325 -3.679 1.00 0.00 C ATOM 1946 CG PHE A 125 9.550 -5.505 -2.859 1.00 0.00 C ATOM 1947 CD1 PHE A 125 8.276 -6.054 -3.103 1.00 0.00 C ATOM 1948 CD2 PHE A 125 10.343 -6.023 -1.817 1.00 0.00 C ATOM 1949 CE1 PHE A 125 7.813 -7.129 -2.322 1.00 0.00 C ATOM 1950 CE2 PHE A 125 9.896 -7.116 -1.055 1.00 0.00 C ATOM 1951 CZ PHE A 125 8.631 -7.673 -1.313 1.00 0.00 C ATOM 0 H PHE A 125 9.835 -6.200 -5.986 1.00 0.00 H new ATOM 0 HA PHE A 125 11.257 -3.737 -5.334 1.00 0.00 H new ATOM 0 HB2 PHE A 125 10.697 -3.720 -3.048 1.00 0.00 H new ATOM 0 HB3 PHE A 125 9.188 -3.705 -3.939 1.00 0.00 H new ATOM 0 HD1 PHE A 125 7.655 -5.650 -3.889 1.00 0.00 H new ATOM 0 HD2 PHE A 125 11.303 -5.577 -1.602 1.00 0.00 H new ATOM 0 HE1 PHE A 125 6.829 -7.538 -2.497 1.00 0.00 H new ATOM 0 HE2 PHE A 125 10.521 -7.526 -0.275 1.00 0.00 H new ATOM 0 HZ PHE A 125 8.286 -8.519 -0.737 1.00 0.00 H new ATOM 1961 N GLU A 126 12.977 -5.257 -4.044 1.00 0.00 N ATOM 1962 CA GLU A 126 14.138 -6.113 -3.851 1.00 0.00 C ATOM 1963 C GLU A 126 14.164 -6.556 -2.384 1.00 0.00 C ATOM 1964 O GLU A 126 13.781 -5.783 -1.500 1.00 0.00 O ATOM 1965 CB GLU A 126 15.339 -5.357 -4.393 1.00 0.00 C ATOM 1966 CG GLU A 126 15.458 -5.380 -5.922 1.00 0.00 C ATOM 1967 CD GLU A 126 16.488 -6.366 -6.469 1.00 0.00 C ATOM 1968 OE1 GLU A 126 17.656 -6.373 -6.021 1.00 0.00 O ATOM 1969 OE2 GLU A 126 16.153 -7.076 -7.440 1.00 0.00 O ATOM 0 H GLU A 126 13.056 -4.331 -3.623 1.00 0.00 H new ATOM 0 HA GLU A 126 14.126 -7.053 -4.403 1.00 0.00 H new ATOM 0 HB2 GLU A 126 15.283 -4.321 -4.060 1.00 0.00 H new ATOM 0 HB3 GLU A 126 16.246 -5.782 -3.963 1.00 0.00 H new ATOM 0 HG2 GLU A 126 14.483 -5.623 -6.345 1.00 0.00 H new ATOM 0 HG3 GLU A 126 15.715 -4.379 -6.268 1.00 0.00 H new ATOM 1976 N ARG A 127 14.550 -7.811 -2.118 1.00 0.00 N ATOM 1977 CA ARG A 127 14.336 -8.455 -0.820 1.00 0.00 C ATOM 1978 C ARG A 127 15.668 -8.594 -0.083 1.00 0.00 C ATOM 1979 O ARG A 127 16.326 -9.630 -0.199 1.00 0.00 O ATOM 1980 CB ARG A 127 13.638 -9.813 -0.976 1.00 0.00 C ATOM 1981 CG ARG A 127 12.388 -9.845 -1.863 1.00 0.00 C ATOM 1982 CD ARG A 127 11.352 -10.804 -1.275 1.00 0.00 C ATOM 1983 NE ARG A 127 11.875 -12.162 -1.008 1.00 0.00 N ATOM 1984 CZ ARG A 127 11.834 -13.245 -1.799 1.00 0.00 C ATOM 1985 NH1 ARG A 127 11.450 -13.165 -3.069 1.00 0.00 N ATOM 1986 NH2 ARG A 127 12.197 -14.422 -1.305 1.00 0.00 N ATOM 0 H ARG A 127 15.020 -8.407 -2.799 1.00 0.00 H new ATOM 0 HA ARG A 127 13.675 -7.825 -0.226 1.00 0.00 H new ATOM 0 HB2 ARG A 127 14.360 -10.523 -1.379 1.00 0.00 H new ATOM 0 HB3 ARG A 127 13.361 -10.169 0.016 1.00 0.00 H new ATOM 0 HG2 ARG A 127 11.964 -8.844 -1.944 1.00 0.00 H new ATOM 0 HG3 ARG A 127 12.656 -10.160 -2.871 1.00 0.00 H new ATOM 0 HD2 ARG A 127 10.969 -10.384 -0.345 1.00 0.00 H new ATOM 0 HD3 ARG A 127 10.509 -10.879 -1.962 1.00 0.00 H new ATOM 0 HE ARG A 127 12.327 -12.292 -0.103 1.00 0.00 H new ATOM 0 HH11 ARG A 127 11.178 -12.265 -3.464 1.00 0.00 H new ATOM 0 HH12 ARG A 127 11.428 -14.004 -3.649 1.00 0.00 H new ATOM 0 HH21 ARG A 127 12.503 -14.496 -0.335 1.00 0.00 H new ATOM 0 HH22 ARG A 127 12.170 -15.253 -1.896 1.00 0.00 H new ATOM 2000 N GLU A 128 15.995 -7.538 0.660 1.00 0.00 N ATOM 2001 CA GLU A 128 17.272 -7.160 1.290 1.00 0.00 C ATOM 2002 C GLU A 128 18.522 -7.307 0.419 1.00 0.00 C ATOM 2003 O GLU A 128 19.573 -6.765 0.823 1.00 0.00 O ATOM 2004 CB GLU A 128 17.423 -7.698 2.721 1.00 0.00 C ATOM 2005 CG GLU A 128 17.534 -9.219 2.886 1.00 0.00 C ATOM 2006 CD GLU A 128 18.902 -9.808 3.254 1.00 0.00 C ATOM 2007 OE1 GLU A 128 19.706 -9.144 3.954 1.00 0.00 O ATOM 2008 OE2 GLU A 128 19.078 -11.023 2.997 1.00 0.00 O ATOM 0 H GLU A 128 15.285 -6.835 0.863 1.00 0.00 H new ATOM 0 HA GLU A 128 17.198 -6.077 1.390 1.00 0.00 H new ATOM 0 HB2 GLU A 128 18.311 -7.244 3.161 1.00 0.00 H new ATOM 0 HB3 GLU A 128 16.568 -7.356 3.303 1.00 0.00 H new ATOM 0 HG2 GLU A 128 16.822 -9.524 3.653 1.00 0.00 H new ATOM 0 HG3 GLU A 128 17.213 -9.680 1.952 1.00 0.00 H new TER 2015 GLU A 128