USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1066 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 17 GLN : amide:sc= -0.352 K(o=-0.86,f=-3.5!) USER MOD Set 1.2: A 19 ASN : amide:sc= -0.509 K(o=-0.86,f=-0.29) USER MOD Single : A 1 ALA N :NH3+ -171:sc= 1.11 (180deg=1.05) USER MOD Single : A 2 THR OG1 : rot 25:sc= 1.2 USER MOD Single : A 3 SER OG : rot 1:sc= 0.733 USER MOD Single : A 4 THR OG1 : rot 30:sc= 0.551 USER MOD Single : A 6 THR OG1 : rot 9:sc= 0.63 USER MOD Single : A 9 TYR OH : rot -104:sc= 0.15 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 SER OG : rot 33:sc= 1.24 USER MOD Single : A 15 GLN : amide:sc= -0.187 X(o=-0.19,f=-0.44) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl 177:sc= -0.392 (180deg=-0.511) USER MOD Single : A 25 ASN : amide:sc= -0.121 K(o=-0.12,f=-2.3!) USER MOD Single : A 27 LYS NZ :NH3+ -111:sc= 1.17 (180deg=-0.233) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 83:sc= 0.253 USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 SER OG : rot 37:sc= 0.751 USER MOD Single : A 42 SER OG : rot -170:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.634 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 172:sc= 0.836 (180deg=0.741) USER MOD Single : A 49 SER OG : rot 180:sc= 0.00977 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0.921 K(o=0.92,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= 0.688 K(o=0.69,f=-3.3) USER MOD Single : A 61 GLN : amide:sc= -0.409 K(o=-0.41,f=-3.2!) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 27:sc= 1.12 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.0469 X(o=-0.047,f=-0.28) USER MOD Single : A 78 SER OG : rot 17:sc= 0.0702 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 180:sc=-0.00212 USER MOD Single : A 89 LYS NZ :NH3+ 175:sc= -0.0232 (180deg=-0.0519) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot -40:sc= 1.26 USER MOD Single : A 93 THR OG1 : rot -36:sc= 0.695 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0869 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -0.503 K(o=-0.5,f=-4.9!) USER MOD Single : A 102 THR OG1 : rot -122:sc= 0.529 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc=-0.00889 K(o=-0.0089,f=-3.1!) USER MOD Single : A 116 ASN : amide:sc= -0.0416 K(o=-0.042,f=-1.2) USER MOD Single : A 118 MET CE :methyl 171:sc= 0 (180deg=-0.122) USER MOD Single : A 120 ASN : amide:sc= -2! K(o=-2!,f=-0.74) USER MOD Single : A 126 SER OG : rot 180:sc=-0.000765 USER MOD Single : A 127 TYR OH : rot -92:sc= 1.33 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 SER OG : rot 52:sc= 1.24 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot -31:sc= 1.21 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 3.939 -25.001 -6.405 1.00 0.00 N ATOM 2 CA ALA A 1 3.678 -23.713 -7.043 1.00 0.00 C ATOM 3 C ALA A 1 2.716 -22.912 -6.188 1.00 0.00 C ATOM 4 O ALA A 1 1.813 -23.470 -5.566 1.00 0.00 O ATOM 5 CB ALA A 1 3.082 -23.886 -8.440 1.00 0.00 C ATOM 0 H1 ALA A 1 4.710 -25.487 -6.906 1.00 0.00 H new ATOM 0 H2 ALA A 1 4.213 -24.848 -5.413 1.00 0.00 H new ATOM 0 H3 ALA A 1 3.080 -25.586 -6.441 1.00 0.00 H new ATOM 0 HA ALA A 1 4.629 -23.189 -7.141 1.00 0.00 H new ATOM 0 HB1 ALA A 1 2.902 -22.906 -8.883 1.00 0.00 H new ATOM 0 HB2 ALA A 1 3.778 -24.444 -9.066 1.00 0.00 H new ATOM 0 HB3 ALA A 1 2.141 -24.431 -8.369 1.00 0.00 H new ATOM 11 N THR A 2 2.837 -21.589 -6.266 1.00 0.00 N ATOM 12 CA THR A 2 1.915 -20.675 -5.629 1.00 0.00 C ATOM 13 C THR A 2 0.841 -20.351 -6.673 1.00 0.00 C ATOM 14 O THR A 2 1.080 -20.361 -7.888 1.00 0.00 O ATOM 15 CB THR A 2 2.734 -19.435 -5.196 1.00 0.00 C ATOM 16 OG1 THR A 2 3.249 -19.582 -3.887 1.00 0.00 O ATOM 17 CG2 THR A 2 1.991 -18.096 -5.220 1.00 0.00 C ATOM 0 H THR A 2 3.587 -21.125 -6.779 1.00 0.00 H new ATOM 0 HA THR A 2 1.424 -21.076 -4.742 1.00 0.00 H new ATOM 0 HB THR A 2 3.516 -19.398 -5.954 1.00 0.00 H new ATOM 0 HG1 THR A 2 3.342 -20.535 -3.677 1.00 0.00 H new ATOM 0 HG21 THR A 2 2.663 -17.301 -4.898 1.00 0.00 H new ATOM 0 HG22 THR A 2 1.645 -17.890 -6.233 1.00 0.00 H new ATOM 0 HG23 THR A 2 1.135 -18.143 -4.546 1.00 0.00 H new ATOM 25 N SER A 3 -0.371 -20.048 -6.216 1.00 0.00 N ATOM 26 CA SER A 3 -1.377 -19.370 -7.007 1.00 0.00 C ATOM 27 C SER A 3 -2.115 -18.447 -6.046 1.00 0.00 C ATOM 28 O SER A 3 -2.836 -18.902 -5.157 1.00 0.00 O ATOM 29 CB SER A 3 -2.279 -20.402 -7.693 1.00 0.00 C ATOM 30 OG SER A 3 -1.486 -21.180 -8.575 1.00 0.00 O ATOM 0 H SER A 3 -0.680 -20.273 -5.270 1.00 0.00 H new ATOM 0 HA SER A 3 -0.957 -18.775 -7.818 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.756 -21.041 -6.950 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.076 -19.902 -8.243 1.00 0.00 H new ATOM 0 HG SER A 3 -0.552 -20.887 -8.520 1.00 0.00 H new ATOM 36 N THR A 4 -1.882 -17.142 -6.144 1.00 0.00 N ATOM 37 CA THR A 4 -2.736 -16.189 -5.471 1.00 0.00 C ATOM 38 C THR A 4 -2.982 -15.020 -6.390 1.00 0.00 C ATOM 39 O THR A 4 -2.128 -14.625 -7.195 1.00 0.00 O ATOM 40 CB THR A 4 -2.160 -15.765 -4.112 1.00 0.00 C ATOM 41 OG1 THR A 4 -3.031 -14.940 -3.362 1.00 0.00 O ATOM 42 CG2 THR A 4 -0.794 -15.066 -4.190 1.00 0.00 C ATOM 0 H THR A 4 -1.117 -16.731 -6.678 1.00 0.00 H new ATOM 0 HA THR A 4 -3.694 -16.657 -5.244 1.00 0.00 H new ATOM 0 HB THR A 4 -2.033 -16.721 -3.603 1.00 0.00 H new ATOM 0 HG1 THR A 4 -3.960 -15.156 -3.586 1.00 0.00 H new ATOM 0 HG21 THR A 4 -0.463 -14.801 -3.186 1.00 0.00 H new ATOM 0 HG22 THR A 4 -0.067 -15.738 -4.647 1.00 0.00 H new ATOM 0 HG23 THR A 4 -0.882 -14.162 -4.793 1.00 0.00 H new ATOM 50 N VAL A 5 -4.150 -14.458 -6.155 1.00 0.00 N ATOM 51 CA VAL A 5 -4.609 -13.194 -6.700 1.00 0.00 C ATOM 52 C VAL A 5 -5.134 -12.383 -5.525 1.00 0.00 C ATOM 53 O VAL A 5 -5.737 -12.926 -4.596 1.00 0.00 O ATOM 54 CB VAL A 5 -5.632 -13.405 -7.839 1.00 0.00 C ATOM 55 CG1 VAL A 5 -4.942 -14.083 -9.026 1.00 0.00 C ATOM 56 CG2 VAL A 5 -6.885 -14.201 -7.426 1.00 0.00 C ATOM 0 H VAL A 5 -4.843 -14.893 -5.546 1.00 0.00 H new ATOM 0 HA VAL A 5 -3.802 -12.640 -7.180 1.00 0.00 H new ATOM 0 HB VAL A 5 -5.992 -12.414 -8.116 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -5.663 -14.232 -9.830 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -4.127 -13.452 -9.382 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -4.544 -15.048 -8.713 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -7.550 -14.303 -8.284 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -6.589 -15.190 -7.076 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -7.404 -13.673 -6.626 1.00 0.00 H new ATOM 66 N THR A 6 -4.822 -11.098 -5.479 1.00 0.00 N ATOM 67 CA THR A 6 -5.319 -10.189 -4.465 1.00 0.00 C ATOM 68 C THR A 6 -5.322 -8.814 -5.119 1.00 0.00 C ATOM 69 O THR A 6 -4.422 -8.504 -5.904 1.00 0.00 O ATOM 70 CB THR A 6 -4.432 -10.263 -3.206 1.00 0.00 C ATOM 71 OG1 THR A 6 -4.515 -11.544 -2.609 1.00 0.00 O ATOM 72 CG2 THR A 6 -4.807 -9.254 -2.118 1.00 0.00 C ATOM 0 H THR A 6 -4.205 -10.652 -6.158 1.00 0.00 H new ATOM 0 HA THR A 6 -6.323 -10.439 -4.123 1.00 0.00 H new ATOM 0 HB THR A 6 -3.428 -10.037 -3.567 1.00 0.00 H new ATOM 0 HG1 THR A 6 -5.005 -12.150 -3.202 1.00 0.00 H new ATOM 0 HG21 THR A 6 -4.136 -9.371 -1.267 1.00 0.00 H new ATOM 0 HG22 THR A 6 -4.718 -8.242 -2.514 1.00 0.00 H new ATOM 0 HG23 THR A 6 -5.834 -9.429 -1.797 1.00 0.00 H new ATOM 80 N GLY A 7 -6.314 -8.002 -4.787 1.00 0.00 N ATOM 81 CA GLY A 7 -6.573 -6.701 -5.368 1.00 0.00 C ATOM 82 C GLY A 7 -7.723 -6.065 -4.607 1.00 0.00 C ATOM 83 O GLY A 7 -8.217 -6.644 -3.642 1.00 0.00 O ATOM 0 H GLY A 7 -6.993 -8.249 -4.067 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -5.684 -6.074 -5.308 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.823 -6.799 -6.424 1.00 0.00 H new ATOM 87 N GLY A 8 -8.142 -4.875 -4.999 1.00 0.00 N ATOM 88 CA GLY A 8 -9.111 -4.088 -4.266 1.00 0.00 C ATOM 89 C GLY A 8 -8.730 -2.625 -4.385 1.00 0.00 C ATOM 90 O GLY A 8 -7.832 -2.263 -5.149 1.00 0.00 O ATOM 0 H GLY A 8 -7.811 -4.423 -5.851 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -10.112 -4.253 -4.664 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -9.131 -4.391 -3.219 1.00 0.00 H new ATOM 94 N TYR A 9 -9.427 -1.776 -3.639 1.00 0.00 N ATOM 95 CA TYR A 9 -9.267 -0.337 -3.704 1.00 0.00 C ATOM 96 C TYR A 9 -8.538 0.120 -2.446 1.00 0.00 C ATOM 97 O TYR A 9 -8.531 -0.584 -1.433 1.00 0.00 O ATOM 98 CB TYR A 9 -10.629 0.357 -3.848 1.00 0.00 C ATOM 99 CG TYR A 9 -11.428 0.078 -5.120 1.00 0.00 C ATOM 100 CD1 TYR A 9 -11.895 -1.217 -5.410 1.00 0.00 C ATOM 101 CD2 TYR A 9 -11.771 1.134 -5.989 1.00 0.00 C ATOM 102 CE1 TYR A 9 -12.728 -1.453 -6.514 1.00 0.00 C ATOM 103 CE2 TYR A 9 -12.605 0.909 -7.102 1.00 0.00 C ATOM 104 CZ TYR A 9 -13.098 -0.391 -7.363 1.00 0.00 C ATOM 105 OH TYR A 9 -13.939 -0.648 -8.403 1.00 0.00 O ATOM 0 H TYR A 9 -10.129 -2.078 -2.963 1.00 0.00 H new ATOM 0 HA TYR A 9 -8.680 -0.065 -4.581 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -11.244 0.072 -2.994 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -10.468 1.433 -3.780 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -11.608 -2.041 -4.774 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -11.390 2.127 -5.799 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -13.087 -2.452 -6.714 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -12.868 1.728 -7.755 1.00 0.00 H new ATOM 0 HH TYR A 9 -13.429 -0.663 -9.240 1.00 0.00 H new ATOM 115 N ALA A 10 -7.914 1.295 -2.513 1.00 0.00 N ATOM 116 CA ALA A 10 -7.373 1.955 -1.337 1.00 0.00 C ATOM 117 C ALA A 10 -8.360 2.983 -0.793 1.00 0.00 C ATOM 118 O ALA A 10 -9.303 3.383 -1.485 1.00 0.00 O ATOM 119 CB ALA A 10 -6.059 2.650 -1.684 1.00 0.00 C ATOM 0 H ALA A 10 -7.772 1.810 -3.382 1.00 0.00 H new ATOM 0 HA ALA A 10 -7.195 1.197 -0.574 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -5.662 3.142 -0.796 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -5.341 1.912 -2.042 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -6.235 3.393 -2.462 1.00 0.00 H new ATOM 125 N GLN A 11 -8.068 3.504 0.395 1.00 0.00 N ATOM 126 CA GLN A 11 -8.557 4.791 0.848 1.00 0.00 C ATOM 127 C GLN A 11 -7.423 5.467 1.608 1.00 0.00 C ATOM 128 O GLN A 11 -7.082 5.021 2.702 1.00 0.00 O ATOM 129 CB GLN A 11 -9.798 4.634 1.747 1.00 0.00 C ATOM 130 CG GLN A 11 -10.441 6.004 2.015 1.00 0.00 C ATOM 131 CD GLN A 11 -11.254 6.022 3.301 1.00 0.00 C ATOM 132 OE1 GLN A 11 -12.483 5.961 3.278 1.00 0.00 O ATOM 133 NE2 GLN A 11 -10.592 6.152 4.439 1.00 0.00 N ATOM 0 H GLN A 11 -7.475 3.032 1.077 1.00 0.00 H new ATOM 0 HA GLN A 11 -8.863 5.396 -0.005 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -10.521 3.973 1.268 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -9.515 4.167 2.690 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -9.661 6.764 2.071 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -11.086 6.270 1.177 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -9.573 6.200 4.434 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -11.100 6.204 5.322 1.00 0.00 H new ATOM 142 N SER A 12 -6.890 6.568 1.064 1.00 0.00 N ATOM 143 CA SER A 12 -6.057 7.463 1.847 1.00 0.00 C ATOM 144 C SER A 12 -6.954 8.444 2.601 1.00 0.00 C ATOM 145 O SER A 12 -8.056 8.789 2.168 1.00 0.00 O ATOM 146 CB SER A 12 -5.033 8.179 0.951 1.00 0.00 C ATOM 147 OG SER A 12 -4.069 8.889 1.714 1.00 0.00 O ATOM 0 H SER A 12 -7.024 6.851 0.093 1.00 0.00 H new ATOM 0 HA SER A 12 -5.483 6.893 2.577 1.00 0.00 H new ATOM 0 HB2 SER A 12 -4.529 7.448 0.319 1.00 0.00 H new ATOM 0 HB3 SER A 12 -5.552 8.870 0.287 1.00 0.00 H new ATOM 0 HG SER A 12 -3.895 8.408 2.550 1.00 0.00 H new ATOM 153 N ASP A 13 -6.452 8.891 3.747 1.00 0.00 N ATOM 154 CA ASP A 13 -7.003 9.911 4.622 1.00 0.00 C ATOM 155 C ASP A 13 -5.856 10.813 5.070 1.00 0.00 C ATOM 156 O ASP A 13 -4.682 10.527 4.804 1.00 0.00 O ATOM 157 CB ASP A 13 -7.724 9.282 5.829 1.00 0.00 C ATOM 158 CG ASP A 13 -6.813 8.494 6.784 1.00 0.00 C ATOM 159 OD1 ASP A 13 -5.794 9.043 7.275 1.00 0.00 O ATOM 160 OD2 ASP A 13 -7.153 7.324 7.070 1.00 0.00 O ATOM 0 H ASP A 13 -5.578 8.516 4.115 1.00 0.00 H new ATOM 0 HA ASP A 13 -7.750 10.497 4.087 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -8.219 10.073 6.392 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -8.505 8.616 5.462 1.00 0.00 H new ATOM 165 N ALA A 14 -6.174 11.922 5.727 1.00 0.00 N ATOM 166 CA ALA A 14 -5.216 12.644 6.538 1.00 0.00 C ATOM 167 C ALA A 14 -5.931 13.166 7.772 1.00 0.00 C ATOM 168 O ALA A 14 -7.152 13.377 7.732 1.00 0.00 O ATOM 169 CB ALA A 14 -4.609 13.797 5.731 1.00 0.00 C ATOM 0 H ALA A 14 -7.104 12.341 5.709 1.00 0.00 H new ATOM 0 HA ALA A 14 -4.403 11.984 6.841 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -3.890 14.334 6.349 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -4.105 13.399 4.850 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.400 14.479 5.419 1.00 0.00 H new ATOM 175 N GLN A 15 -5.169 13.479 8.820 1.00 0.00 N ATOM 176 CA GLN A 15 -5.657 14.105 10.045 1.00 0.00 C ATOM 177 C GLN A 15 -5.924 15.603 9.788 1.00 0.00 C ATOM 178 O GLN A 15 -5.253 16.493 10.324 1.00 0.00 O ATOM 179 CB GLN A 15 -4.664 13.807 11.187 1.00 0.00 C ATOM 180 CG GLN A 15 -5.226 14.064 12.593 1.00 0.00 C ATOM 181 CD GLN A 15 -6.340 13.074 12.925 1.00 0.00 C ATOM 182 OE1 GLN A 15 -7.508 13.354 12.688 1.00 0.00 O ATOM 183 NE2 GLN A 15 -6.001 11.892 13.423 1.00 0.00 N ATOM 0 H GLN A 15 -4.165 13.298 8.839 1.00 0.00 H new ATOM 0 HA GLN A 15 -6.614 13.690 10.361 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -4.350 12.765 11.118 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -3.772 14.418 11.047 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -4.427 13.978 13.329 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -5.609 15.083 12.655 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -5.021 11.680 13.613 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -6.720 11.195 13.616 1.00 0.00 H new ATOM 192 N GLY A 16 -6.893 15.883 8.919 1.00 0.00 N ATOM 193 CA GLY A 16 -7.326 17.198 8.495 1.00 0.00 C ATOM 194 C GLY A 16 -8.082 17.116 7.174 1.00 0.00 C ATOM 195 O GLY A 16 -9.090 17.795 7.005 1.00 0.00 O ATOM 0 H GLY A 16 -7.428 15.142 8.466 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -7.966 17.640 9.259 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -6.462 17.853 8.385 1.00 0.00 H new ATOM 199 N GLN A 17 -7.648 16.248 6.253 1.00 0.00 N ATOM 200 CA GLN A 17 -8.193 16.159 4.906 1.00 0.00 C ATOM 201 C GLN A 17 -8.540 14.709 4.585 1.00 0.00 C ATOM 202 O GLN A 17 -7.692 13.952 4.119 1.00 0.00 O ATOM 203 CB GLN A 17 -7.182 16.747 3.898 1.00 0.00 C ATOM 204 CG GLN A 17 -7.249 18.277 3.788 1.00 0.00 C ATOM 205 CD GLN A 17 -8.426 18.733 2.922 1.00 0.00 C ATOM 206 OE1 GLN A 17 -9.504 18.145 2.930 1.00 0.00 O ATOM 207 NE2 GLN A 17 -8.243 19.739 2.088 1.00 0.00 N ATOM 0 H GLN A 17 -6.897 15.581 6.431 1.00 0.00 H new ATOM 0 HA GLN A 17 -9.111 16.742 4.835 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -6.174 16.455 4.194 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -7.365 16.311 2.916 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -7.342 18.709 4.784 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -6.318 18.652 3.363 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -7.351 20.234 2.074 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -8.993 20.022 1.458 1.00 0.00 H new ATOM 216 N MET A 18 -9.805 14.322 4.760 1.00 0.00 N ATOM 217 CA MET A 18 -10.331 13.060 4.235 1.00 0.00 C ATOM 218 C MET A 18 -10.616 13.213 2.738 1.00 0.00 C ATOM 219 O MET A 18 -11.752 13.054 2.274 1.00 0.00 O ATOM 220 CB MET A 18 -11.571 12.616 5.023 1.00 0.00 C ATOM 221 CG MET A 18 -11.181 12.165 6.429 1.00 0.00 C ATOM 222 SD MET A 18 -12.588 11.784 7.498 1.00 0.00 S ATOM 223 CE MET A 18 -11.692 11.083 8.913 1.00 0.00 C ATOM 0 H MET A 18 -10.494 14.875 5.270 1.00 0.00 H new ATOM 0 HA MET A 18 -9.587 12.273 4.359 1.00 0.00 H new ATOM 0 HB2 MET A 18 -12.284 13.438 5.084 1.00 0.00 H new ATOM 0 HB3 MET A 18 -12.069 11.800 4.499 1.00 0.00 H new ATOM 0 HG2 MET A 18 -10.547 11.282 6.353 1.00 0.00 H new ATOM 0 HG3 MET A 18 -10.584 12.947 6.897 1.00 0.00 H new ATOM 0 HE1 MET A 18 -12.404 10.787 9.684 1.00 0.00 H new ATOM 0 HE2 MET A 18 -11.125 10.211 8.588 1.00 0.00 H new ATOM 0 HE3 MET A 18 -11.009 11.830 9.318 1.00 0.00 H new ATOM 233 N ASN A 19 -9.582 13.565 1.967 1.00 0.00 N ATOM 234 CA ASN A 19 -9.606 13.420 0.517 1.00 0.00 C ATOM 235 C ASN A 19 -9.479 11.922 0.281 1.00 0.00 C ATOM 236 O ASN A 19 -8.363 11.399 0.275 1.00 0.00 O ATOM 237 CB ASN A 19 -8.474 14.196 -0.187 1.00 0.00 C ATOM 238 CG ASN A 19 -8.725 15.689 -0.340 1.00 0.00 C ATOM 239 OD1 ASN A 19 -8.521 16.265 -1.406 1.00 0.00 O ATOM 240 ND2 ASN A 19 -9.140 16.347 0.725 1.00 0.00 N ATOM 0 H ASN A 19 -8.713 13.955 2.332 1.00 0.00 H new ATOM 0 HA ASN A 19 -10.520 13.839 0.097 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -7.550 14.052 0.374 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -8.317 13.765 -1.176 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -9.298 17.353 0.673 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -9.303 15.849 1.600 1.00 0.00 H new ATOM 247 N LYS A 20 -10.626 11.248 0.140 1.00 0.00 N ATOM 248 CA LYS A 20 -10.717 9.829 -0.180 1.00 0.00 C ATOM 249 C LYS A 20 -10.001 9.639 -1.508 1.00 0.00 C ATOM 250 O LYS A 20 -10.461 10.141 -2.533 1.00 0.00 O ATOM 251 CB LYS A 20 -12.169 9.296 -0.171 1.00 0.00 C ATOM 252 CG LYS A 20 -13.227 10.061 -0.996 1.00 0.00 C ATOM 253 CD LYS A 20 -13.924 11.181 -0.207 1.00 0.00 C ATOM 254 CE LYS A 20 -14.725 12.114 -1.119 1.00 0.00 C ATOM 255 NZ LYS A 20 -15.924 11.461 -1.682 1.00 0.00 N ATOM 0 H LYS A 20 -11.538 11.691 0.249 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.234 9.229 0.591 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -12.149 8.266 -0.527 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -12.508 9.269 0.864 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.749 10.490 -1.877 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.978 9.356 -1.352 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.590 10.741 0.535 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -13.177 11.759 0.337 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -15.027 12.997 -0.556 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.086 12.458 -1.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.432 12.133 -2.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.638 10.633 -2.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -16.549 11.156 -0.908 1.00 0.00 H new ATOM 269 N MET A 21 -8.811 9.055 -1.463 1.00 0.00 N ATOM 270 CA MET A 21 -7.901 8.997 -2.587 1.00 0.00 C ATOM 271 C MET A 21 -7.341 7.595 -2.654 1.00 0.00 C ATOM 272 O MET A 21 -6.584 7.162 -1.782 1.00 0.00 O ATOM 273 CB MET A 21 -6.833 10.088 -2.469 1.00 0.00 C ATOM 274 CG MET A 21 -7.445 11.405 -2.962 1.00 0.00 C ATOM 275 SD MET A 21 -6.379 12.850 -2.860 1.00 0.00 S ATOM 276 CE MET A 21 -5.235 12.535 -4.216 1.00 0.00 C ATOM 0 H MET A 21 -8.449 8.601 -0.625 1.00 0.00 H new ATOM 0 HA MET A 21 -8.412 9.201 -3.528 1.00 0.00 H new ATOM 0 HB2 MET A 21 -6.500 10.186 -1.436 1.00 0.00 H new ATOM 0 HB3 MET A 21 -5.956 9.829 -3.063 1.00 0.00 H new ATOM 0 HG2 MET A 21 -7.751 11.275 -4.000 1.00 0.00 H new ATOM 0 HG3 MET A 21 -8.349 11.602 -2.385 1.00 0.00 H new ATOM 0 HE1 MET A 21 -4.545 13.373 -4.312 1.00 0.00 H new ATOM 0 HE2 MET A 21 -4.673 11.624 -4.013 1.00 0.00 H new ATOM 0 HE3 MET A 21 -5.794 12.417 -5.144 1.00 0.00 H new ATOM 286 N GLY A 22 -7.778 6.884 -3.684 1.00 0.00 N ATOM 287 CA GLY A 22 -7.422 5.525 -3.983 1.00 0.00 C ATOM 288 C GLY A 22 -7.820 5.253 -5.424 1.00 0.00 C ATOM 289 O GLY A 22 -8.328 6.132 -6.139 1.00 0.00 O ATOM 0 H GLY A 22 -8.428 7.273 -4.367 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -6.352 5.370 -3.845 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -7.933 4.838 -3.308 1.00 0.00 H new ATOM 293 N GLY A 23 -7.583 4.024 -5.842 1.00 0.00 N ATOM 294 CA GLY A 23 -7.699 3.541 -7.196 1.00 0.00 C ATOM 295 C GLY A 23 -7.789 2.038 -7.065 1.00 0.00 C ATOM 296 O GLY A 23 -8.562 1.562 -6.237 1.00 0.00 O ATOM 0 H GLY A 23 -7.285 3.291 -5.198 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.583 3.949 -7.687 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -6.837 3.835 -7.796 1.00 0.00 H new ATOM 300 N PHE A 24 -6.958 1.308 -7.802 1.00 0.00 N ATOM 301 CA PHE A 24 -6.895 -0.142 -7.724 1.00 0.00 C ATOM 302 C PHE A 24 -5.513 -0.521 -7.206 1.00 0.00 C ATOM 303 O PHE A 24 -4.524 0.182 -7.447 1.00 0.00 O ATOM 304 CB PHE A 24 -7.172 -0.775 -9.097 1.00 0.00 C ATOM 305 CG PHE A 24 -8.601 -0.645 -9.606 1.00 0.00 C ATOM 306 CD1 PHE A 24 -9.121 0.612 -9.969 1.00 0.00 C ATOM 307 CD2 PHE A 24 -9.418 -1.785 -9.740 1.00 0.00 C ATOM 308 CE1 PHE A 24 -10.444 0.732 -10.428 1.00 0.00 C ATOM 309 CE2 PHE A 24 -10.740 -1.667 -10.200 1.00 0.00 C ATOM 310 CZ PHE A 24 -11.255 -0.407 -10.544 1.00 0.00 C ATOM 0 H PHE A 24 -6.306 1.712 -8.474 1.00 0.00 H new ATOM 0 HA PHE A 24 -7.660 -0.519 -7.045 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -6.503 -0.321 -9.828 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -6.918 -1.834 -9.047 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -8.498 1.491 -9.894 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -9.024 -2.758 -9.487 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -10.837 1.703 -10.692 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -11.361 -2.546 -10.289 1.00 0.00 H new ATOM 0 HZ PHE A 24 -12.272 -0.315 -10.897 1.00 0.00 H new ATOM 320 N ASN A 25 -5.446 -1.647 -6.508 1.00 0.00 N ATOM 321 CA ASN A 25 -4.238 -2.298 -6.025 1.00 0.00 C ATOM 322 C ASN A 25 -4.213 -3.706 -6.604 1.00 0.00 C ATOM 323 O ASN A 25 -5.255 -4.242 -6.993 1.00 0.00 O ATOM 324 CB ASN A 25 -4.248 -2.358 -4.486 1.00 0.00 C ATOM 325 CG ASN A 25 -3.319 -1.329 -3.867 1.00 0.00 C ATOM 326 OD1 ASN A 25 -2.174 -1.636 -3.556 1.00 0.00 O ATOM 327 ND2 ASN A 25 -3.781 -0.105 -3.667 1.00 0.00 N ATOM 0 H ASN A 25 -6.288 -2.161 -6.248 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.353 -1.741 -6.334 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -5.263 -2.193 -4.124 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -3.951 -3.355 -4.161 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -3.181 0.604 -3.246 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -4.737 0.129 -3.933 1.00 0.00 H new ATOM 334 N LEU A 26 -3.046 -4.349 -6.584 1.00 0.00 N ATOM 335 CA LEU A 26 -2.920 -5.770 -6.880 1.00 0.00 C ATOM 336 C LEU A 26 -1.780 -6.356 -6.054 1.00 0.00 C ATOM 337 O LEU A 26 -0.989 -5.593 -5.486 1.00 0.00 O ATOM 338 CB LEU A 26 -2.699 -5.984 -8.393 1.00 0.00 C ATOM 339 CG LEU A 26 -3.387 -7.261 -8.910 1.00 0.00 C ATOM 340 CD1 LEU A 26 -4.904 -7.079 -8.957 1.00 0.00 C ATOM 341 CD2 LEU A 26 -2.918 -7.617 -10.323 1.00 0.00 C ATOM 0 H LEU A 26 -2.160 -3.895 -6.361 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.841 -6.288 -6.611 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.081 -5.122 -8.939 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.630 -6.042 -8.597 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.120 -8.061 -8.219 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -5.369 -7.994 -9.325 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -5.275 -6.861 -7.956 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -5.151 -6.253 -9.624 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.424 -8.523 -10.657 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -3.155 -6.798 -11.002 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -1.841 -7.783 -10.318 1.00 0.00 H new ATOM 353 N LYS A 27 -1.675 -7.686 -6.004 1.00 0.00 N ATOM 354 CA LYS A 27 -0.540 -8.397 -5.435 1.00 0.00 C ATOM 355 C LYS A 27 -0.191 -9.571 -6.338 1.00 0.00 C ATOM 356 O LYS A 27 -1.052 -10.101 -7.048 1.00 0.00 O ATOM 357 CB LYS A 27 -0.868 -8.915 -4.021 1.00 0.00 C ATOM 358 CG LYS A 27 0.367 -8.935 -3.105 1.00 0.00 C ATOM 359 CD LYS A 27 0.199 -9.887 -1.910 1.00 0.00 C ATOM 360 CE LYS A 27 0.849 -11.255 -2.170 1.00 0.00 C ATOM 361 NZ LYS A 27 1.041 -12.002 -0.910 1.00 0.00 N ATOM 0 H LYS A 27 -2.397 -8.308 -6.368 1.00 0.00 H new ATOM 0 HA LYS A 27 0.305 -7.712 -5.361 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -1.638 -8.285 -3.575 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -1.281 -9.921 -4.092 1.00 0.00 H new ATOM 0 HG2 LYS A 27 1.240 -9.235 -3.684 1.00 0.00 H new ATOM 0 HG3 LYS A 27 0.559 -7.927 -2.738 1.00 0.00 H new ATOM 0 HD2 LYS A 27 0.643 -9.437 -1.022 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -0.862 -10.023 -1.701 1.00 0.00 H new ATOM 0 HE2 LYS A 27 0.223 -11.835 -2.848 1.00 0.00 H new ATOM 0 HE3 LYS A 27 1.811 -11.116 -2.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 2.057 -12.068 -0.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 0.557 -11.506 -0.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 0.645 -12.958 -1.010 1.00 0.00 H new ATOM 375 N TYR A 28 1.035 -10.048 -6.188 1.00 0.00 N ATOM 376 CA TYR A 28 1.552 -11.314 -6.661 1.00 0.00 C ATOM 377 C TYR A 28 2.372 -11.899 -5.515 1.00 0.00 C ATOM 378 O TYR A 28 2.968 -11.150 -4.734 1.00 0.00 O ATOM 379 CB TYR A 28 2.364 -11.140 -7.950 1.00 0.00 C ATOM 380 CG TYR A 28 1.483 -11.221 -9.180 1.00 0.00 C ATOM 381 CD1 TYR A 28 1.102 -12.487 -9.661 1.00 0.00 C ATOM 382 CD2 TYR A 28 0.983 -10.059 -9.801 1.00 0.00 C ATOM 383 CE1 TYR A 28 0.191 -12.597 -10.722 1.00 0.00 C ATOM 384 CE2 TYR A 28 0.074 -10.164 -10.873 1.00 0.00 C ATOM 385 CZ TYR A 28 -0.352 -11.438 -11.318 1.00 0.00 C ATOM 386 OH TYR A 28 -1.291 -11.550 -12.301 1.00 0.00 O ATOM 0 H TYR A 28 1.748 -9.513 -5.692 1.00 0.00 H new ATOM 0 HA TYR A 28 0.748 -11.999 -6.930 1.00 0.00 H new ATOM 0 HB2 TYR A 28 2.876 -10.178 -7.931 1.00 0.00 H new ATOM 0 HB3 TYR A 28 3.134 -11.910 -8.002 1.00 0.00 H new ATOM 0 HD1 TYR A 28 1.513 -13.379 -9.211 1.00 0.00 H new ATOM 0 HD2 TYR A 28 1.297 -9.085 -9.455 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -0.096 -13.573 -11.085 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -0.298 -9.272 -11.355 1.00 0.00 H new ATOM 0 HH TYR A 28 -1.559 -10.656 -12.601 1.00 0.00 H new ATOM 396 N ARG A 29 2.304 -13.215 -5.315 1.00 0.00 N ATOM 397 CA ARG A 29 3.329 -13.936 -4.565 1.00 0.00 C ATOM 398 C ARG A 29 3.900 -14.984 -5.520 1.00 0.00 C ATOM 399 O ARG A 29 3.223 -15.321 -6.497 1.00 0.00 O ATOM 400 CB ARG A 29 2.728 -14.509 -3.261 1.00 0.00 C ATOM 401 CG ARG A 29 3.758 -14.801 -2.158 1.00 0.00 C ATOM 402 CD ARG A 29 4.261 -16.242 -2.127 1.00 0.00 C ATOM 403 NE ARG A 29 3.529 -17.105 -1.193 1.00 0.00 N ATOM 404 CZ ARG A 29 4.006 -18.278 -0.744 1.00 0.00 C ATOM 405 NH1 ARG A 29 5.252 -18.653 -1.021 1.00 0.00 N ATOM 406 NH2 ARG A 29 3.233 -19.050 0.017 1.00 0.00 N ATOM 0 H ARG A 29 1.547 -13.804 -5.663 1.00 0.00 H new ATOM 0 HA ARG A 29 4.145 -13.296 -4.230 1.00 0.00 H new ATOM 0 HB2 ARG A 29 1.991 -13.804 -2.875 1.00 0.00 H new ATOM 0 HB3 ARG A 29 2.195 -15.430 -3.496 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.611 -14.135 -2.289 1.00 0.00 H new ATOM 0 HG3 ARG A 29 3.314 -14.564 -1.191 1.00 0.00 H new ATOM 0 HD2 ARG A 29 4.189 -16.664 -3.129 1.00 0.00 H new ATOM 0 HD3 ARG A 29 5.317 -16.243 -1.856 1.00 0.00 H new ATOM 0 HE ARG A 29 2.612 -16.799 -0.868 1.00 0.00 H new ATOM 0 HH11 ARG A 29 5.855 -18.048 -1.579 1.00 0.00 H new ATOM 0 HH12 ARG A 29 5.605 -19.545 -0.675 1.00 0.00 H new ATOM 0 HH21 ARG A 29 2.288 -18.749 0.254 1.00 0.00 H new ATOM 0 HH22 ARG A 29 3.586 -19.942 0.363 1.00 0.00 H new ATOM 420 N TYR A 30 5.093 -15.496 -5.234 1.00 0.00 N ATOM 421 CA TYR A 30 5.759 -16.552 -5.983 1.00 0.00 C ATOM 422 C TYR A 30 6.251 -17.582 -4.975 1.00 0.00 C ATOM 423 O TYR A 30 6.407 -17.249 -3.799 1.00 0.00 O ATOM 424 CB TYR A 30 6.913 -15.948 -6.796 1.00 0.00 C ATOM 425 CG TYR A 30 6.416 -14.931 -7.802 1.00 0.00 C ATOM 426 CD1 TYR A 30 5.732 -15.384 -8.942 1.00 0.00 C ATOM 427 CD2 TYR A 30 6.520 -13.548 -7.550 1.00 0.00 C ATOM 428 CE1 TYR A 30 5.111 -14.473 -9.808 1.00 0.00 C ATOM 429 CE2 TYR A 30 5.923 -12.628 -8.431 1.00 0.00 C ATOM 430 CZ TYR A 30 5.198 -13.089 -9.553 1.00 0.00 C ATOM 431 OH TYR A 30 4.582 -12.201 -10.378 1.00 0.00 O ATOM 0 H TYR A 30 5.644 -15.171 -4.440 1.00 0.00 H new ATOM 0 HA TYR A 30 5.085 -17.035 -6.690 1.00 0.00 H new ATOM 0 HB2 TYR A 30 7.625 -15.474 -6.121 1.00 0.00 H new ATOM 0 HB3 TYR A 30 7.447 -16.743 -7.316 1.00 0.00 H new ATOM 0 HD1 TYR A 30 5.684 -16.442 -9.153 1.00 0.00 H new ATOM 0 HD2 TYR A 30 7.057 -13.195 -6.682 1.00 0.00 H new ATOM 0 HE1 TYR A 30 4.567 -14.831 -10.669 1.00 0.00 H new ATOM 0 HE2 TYR A 30 6.019 -11.568 -8.250 1.00 0.00 H new ATOM 0 HH TYR A 30 3.640 -12.115 -10.122 1.00 0.00 H new ATOM 441 N GLU A 31 6.454 -18.826 -5.398 1.00 0.00 N ATOM 442 CA GLU A 31 6.914 -19.861 -4.491 1.00 0.00 C ATOM 443 C GLU A 31 8.414 -20.029 -4.643 1.00 0.00 C ATOM 444 O GLU A 31 8.960 -20.011 -5.752 1.00 0.00 O ATOM 445 CB GLU A 31 6.158 -21.167 -4.731 1.00 0.00 C ATOM 446 CG GLU A 31 5.968 -21.949 -3.421 1.00 0.00 C ATOM 447 CD GLU A 31 4.625 -22.666 -3.443 1.00 0.00 C ATOM 448 OE1 GLU A 31 3.626 -22.049 -3.002 1.00 0.00 O ATOM 449 OE2 GLU A 31 4.557 -23.791 -3.981 1.00 0.00 O ATOM 0 H GLU A 31 6.307 -19.136 -6.358 1.00 0.00 H new ATOM 0 HA GLU A 31 6.708 -19.567 -3.462 1.00 0.00 H new ATOM 0 HB2 GLU A 31 5.185 -20.951 -5.173 1.00 0.00 H new ATOM 0 HB3 GLU A 31 6.705 -21.780 -5.447 1.00 0.00 H new ATOM 0 HG2 GLU A 31 6.775 -22.671 -3.297 1.00 0.00 H new ATOM 0 HG3 GLU A 31 6.015 -21.269 -2.570 1.00 0.00 H new ATOM 456 N GLU A 32 9.072 -20.222 -3.513 1.00 0.00 N ATOM 457 CA GLU A 32 10.496 -20.342 -3.350 1.00 0.00 C ATOM 458 C GLU A 32 10.779 -21.772 -2.884 1.00 0.00 C ATOM 459 O GLU A 32 9.910 -22.471 -2.346 1.00 0.00 O ATOM 460 CB GLU A 32 11.007 -19.239 -2.394 1.00 0.00 C ATOM 461 CG GLU A 32 10.302 -19.119 -1.025 1.00 0.00 C ATOM 462 CD GLU A 32 8.881 -18.533 -1.110 1.00 0.00 C ATOM 463 OE1 GLU A 32 8.730 -17.293 -1.221 1.00 0.00 O ATOM 464 OE2 GLU A 32 7.927 -19.355 -1.136 1.00 0.00 O ATOM 0 H GLU A 32 8.580 -20.304 -2.623 1.00 0.00 H new ATOM 0 HA GLU A 32 11.042 -20.184 -4.280 1.00 0.00 H new ATOM 0 HB2 GLU A 32 12.068 -19.410 -2.215 1.00 0.00 H new ATOM 0 HB3 GLU A 32 10.921 -18.280 -2.905 1.00 0.00 H new ATOM 0 HG2 GLU A 32 10.252 -20.106 -0.564 1.00 0.00 H new ATOM 0 HG3 GLU A 32 10.906 -18.492 -0.369 1.00 0.00 H new ATOM 471 N ASP A 33 12.001 -22.220 -3.129 1.00 0.00 N ATOM 472 CA ASP A 33 12.496 -23.558 -2.842 1.00 0.00 C ATOM 473 C ASP A 33 13.838 -23.320 -2.172 1.00 0.00 C ATOM 474 O ASP A 33 14.891 -23.381 -2.809 1.00 0.00 O ATOM 475 CB ASP A 33 12.578 -24.371 -4.144 1.00 0.00 C ATOM 476 CG ASP A 33 13.279 -25.717 -3.955 1.00 0.00 C ATOM 477 OD1 ASP A 33 12.894 -26.463 -3.037 1.00 0.00 O ATOM 478 OD2 ASP A 33 14.176 -26.029 -4.776 1.00 0.00 O ATOM 0 H ASP A 33 12.713 -21.628 -3.557 1.00 0.00 H new ATOM 0 HA ASP A 33 11.852 -24.149 -2.191 1.00 0.00 H new ATOM 0 HB2 ASP A 33 11.571 -24.541 -4.526 1.00 0.00 H new ATOM 0 HB3 ASP A 33 13.111 -23.791 -4.897 1.00 0.00 H new ATOM 483 N ASN A 34 13.778 -22.826 -0.930 1.00 0.00 N ATOM 484 CA ASN A 34 14.965 -22.424 -0.176 1.00 0.00 C ATOM 485 C ASN A 34 14.688 -22.244 1.308 1.00 0.00 C ATOM 486 O ASN A 34 15.558 -22.532 2.131 1.00 0.00 O ATOM 487 CB ASN A 34 15.524 -21.093 -0.706 1.00 0.00 C ATOM 488 CG ASN A 34 17.027 -21.189 -0.867 1.00 0.00 C ATOM 489 OD1 ASN A 34 17.798 -20.847 0.026 1.00 0.00 O ATOM 490 ND2 ASN A 34 17.465 -21.623 -2.034 1.00 0.00 N ATOM 0 H ASN A 34 12.904 -22.695 -0.422 1.00 0.00 H new ATOM 0 HA ASN A 34 15.684 -23.233 -0.308 1.00 0.00 H new ATOM 0 HB2 ASN A 34 15.062 -20.851 -1.663 1.00 0.00 H new ATOM 0 HB3 ASN A 34 15.275 -20.285 -0.018 1.00 0.00 H new ATOM 0 HD21 ASN A 34 18.468 -21.681 -2.213 1.00 0.00 H new ATOM 0 HD22 ASN A 34 16.801 -21.900 -2.757 1.00 0.00 H new ATOM 497 N SER A 35 13.520 -21.703 1.659 1.00 0.00 N ATOM 498 CA SER A 35 13.078 -21.526 3.031 1.00 0.00 C ATOM 499 C SER A 35 11.566 -21.298 3.047 1.00 0.00 C ATOM 500 O SER A 35 11.037 -20.744 2.082 1.00 0.00 O ATOM 501 CB SER A 35 13.770 -20.297 3.623 1.00 0.00 C ATOM 502 OG SER A 35 15.011 -20.664 4.194 1.00 0.00 O ATOM 0 H SER A 35 12.842 -21.369 0.974 1.00 0.00 H new ATOM 0 HA SER A 35 13.326 -22.412 3.615 1.00 0.00 H new ATOM 0 HB2 SER A 35 13.926 -19.549 2.846 1.00 0.00 H new ATOM 0 HB3 SER A 35 13.133 -19.842 4.381 1.00 0.00 H new ATOM 0 HG SER A 35 15.431 -21.359 3.646 1.00 0.00 H new ATOM 508 N PRO A 36 10.879 -21.632 4.153 1.00 0.00 N ATOM 509 CA PRO A 36 9.485 -21.286 4.362 1.00 0.00 C ATOM 510 C PRO A 36 9.387 -19.815 4.766 1.00 0.00 C ATOM 511 O PRO A 36 9.438 -19.455 5.949 1.00 0.00 O ATOM 512 CB PRO A 36 8.987 -22.250 5.432 1.00 0.00 C ATOM 513 CG PRO A 36 10.233 -22.530 6.272 1.00 0.00 C ATOM 514 CD PRO A 36 11.401 -22.357 5.302 1.00 0.00 C ATOM 0 HA PRO A 36 8.867 -21.385 3.470 1.00 0.00 H new ATOM 0 HB2 PRO A 36 8.191 -21.808 6.031 1.00 0.00 H new ATOM 0 HB3 PRO A 36 8.586 -23.164 4.993 1.00 0.00 H new ATOM 0 HG2 PRO A 36 10.309 -21.838 7.111 1.00 0.00 H new ATOM 0 HG3 PRO A 36 10.211 -23.536 6.690 1.00 0.00 H new ATOM 0 HD2 PRO A 36 12.216 -21.806 5.771 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.802 -23.325 5.001 1.00 0.00 H new ATOM 522 N LEU A 37 9.288 -18.967 3.750 1.00 0.00 N ATOM 523 CA LEU A 37 9.040 -17.535 3.792 1.00 0.00 C ATOM 524 C LEU A 37 8.158 -17.229 2.578 1.00 0.00 C ATOM 525 O LEU A 37 8.043 -18.070 1.690 1.00 0.00 O ATOM 526 CB LEU A 37 10.369 -16.760 3.785 1.00 0.00 C ATOM 527 CG LEU A 37 10.238 -15.286 4.219 1.00 0.00 C ATOM 528 CD1 LEU A 37 9.709 -15.149 5.658 1.00 0.00 C ATOM 529 CD2 LEU A 37 11.609 -14.611 4.125 1.00 0.00 C ATOM 0 H LEU A 37 9.389 -19.296 2.790 1.00 0.00 H new ATOM 0 HA LEU A 37 8.533 -17.224 4.705 1.00 0.00 H new ATOM 0 HB2 LEU A 37 11.074 -17.262 4.448 1.00 0.00 H new ATOM 0 HB3 LEU A 37 10.794 -16.796 2.782 1.00 0.00 H new ATOM 0 HG LEU A 37 9.521 -14.806 3.552 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.634 -14.093 5.919 1.00 0.00 H new ATOM 0 HD12 LEU A 37 8.725 -15.612 5.729 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.394 -15.645 6.346 1.00 0.00 H new ATOM 0 HD21 LEU A 37 11.523 -13.568 4.431 1.00 0.00 H new ATOM 0 HD22 LEU A 37 12.313 -15.124 4.780 1.00 0.00 H new ATOM 0 HD23 LEU A 37 11.969 -14.659 3.097 1.00 0.00 H new ATOM 541 N GLY A 38 7.396 -16.138 2.585 1.00 0.00 N ATOM 542 CA GLY A 38 6.598 -15.722 1.433 1.00 0.00 C ATOM 543 C GLY A 38 6.673 -14.208 1.286 1.00 0.00 C ATOM 544 O GLY A 38 7.239 -13.544 2.153 1.00 0.00 O ATOM 0 H GLY A 38 7.314 -15.517 3.390 1.00 0.00 H new ATOM 0 HA2 GLY A 38 6.966 -16.205 0.528 1.00 0.00 H new ATOM 0 HA3 GLY A 38 5.562 -16.035 1.562 1.00 0.00 H new ATOM 548 N VAL A 39 6.071 -13.645 0.233 1.00 0.00 N ATOM 549 CA VAL A 39 6.254 -12.244 -0.163 1.00 0.00 C ATOM 550 C VAL A 39 4.906 -11.511 -0.252 1.00 0.00 C ATOM 551 O VAL A 39 3.845 -12.111 -0.470 1.00 0.00 O ATOM 552 CB VAL A 39 7.055 -12.203 -1.495 1.00 0.00 C ATOM 553 CG1 VAL A 39 7.292 -10.783 -2.040 1.00 0.00 C ATOM 554 CG2 VAL A 39 8.424 -12.873 -1.319 1.00 0.00 C ATOM 0 H VAL A 39 5.434 -14.157 -0.377 1.00 0.00 H new ATOM 0 HA VAL A 39 6.827 -11.712 0.596 1.00 0.00 H new ATOM 0 HB VAL A 39 6.436 -12.739 -2.215 1.00 0.00 H new ATOM 0 HG11 VAL A 39 7.857 -10.840 -2.970 1.00 0.00 H new ATOM 0 HG12 VAL A 39 6.333 -10.300 -2.227 1.00 0.00 H new ATOM 0 HG13 VAL A 39 7.854 -10.202 -1.309 1.00 0.00 H new ATOM 0 HG21 VAL A 39 8.971 -12.835 -2.261 1.00 0.00 H new ATOM 0 HG22 VAL A 39 8.990 -12.348 -0.549 1.00 0.00 H new ATOM 0 HG23 VAL A 39 8.285 -13.912 -1.021 1.00 0.00 H new ATOM 564 N ILE A 40 4.949 -10.187 -0.135 1.00 0.00 N ATOM 565 CA ILE A 40 3.921 -9.244 -0.541 1.00 0.00 C ATOM 566 C ILE A 40 4.629 -8.106 -1.278 1.00 0.00 C ATOM 567 O ILE A 40 5.709 -7.681 -0.864 1.00 0.00 O ATOM 568 CB ILE A 40 3.074 -8.788 0.676 1.00 0.00 C ATOM 569 CG1 ILE A 40 2.208 -7.536 0.384 1.00 0.00 C ATOM 570 CG2 ILE A 40 3.850 -8.643 2.000 1.00 0.00 C ATOM 571 CD1 ILE A 40 2.832 -6.146 0.596 1.00 0.00 C ATOM 0 H ILE A 40 5.757 -9.717 0.273 1.00 0.00 H new ATOM 0 HA ILE A 40 3.195 -9.696 -1.217 1.00 0.00 H new ATOM 0 HB ILE A 40 2.396 -9.627 0.833 1.00 0.00 H new ATOM 0 HG12 ILE A 40 1.877 -7.596 -0.653 1.00 0.00 H new ATOM 0 HG13 ILE A 40 1.316 -7.597 1.007 1.00 0.00 H new ATOM 0 HG21 ILE A 40 3.169 -8.320 2.787 1.00 0.00 H new ATOM 0 HG22 ILE A 40 4.290 -9.603 2.271 1.00 0.00 H new ATOM 0 HG23 ILE A 40 4.641 -7.903 1.879 1.00 0.00 H new ATOM 0 HD11 ILE A 40 2.100 -5.377 0.349 1.00 0.00 H new ATOM 0 HD12 ILE A 40 3.134 -6.038 1.638 1.00 0.00 H new ATOM 0 HD13 ILE A 40 3.704 -6.037 -0.048 1.00 0.00 H new ATOM 583 N GLY A 41 3.996 -7.610 -2.341 1.00 0.00 N ATOM 584 CA GLY A 41 4.393 -6.433 -3.089 1.00 0.00 C ATOM 585 C GLY A 41 3.141 -5.860 -3.736 1.00 0.00 C ATOM 586 O GLY A 41 2.572 -6.499 -4.628 1.00 0.00 O ATOM 0 H GLY A 41 3.153 -8.044 -2.716 1.00 0.00 H new ATOM 0 HA2 GLY A 41 4.855 -5.698 -2.430 1.00 0.00 H new ATOM 0 HA3 GLY A 41 5.133 -6.691 -3.847 1.00 0.00 H new ATOM 590 N SER A 42 2.667 -4.714 -3.251 1.00 0.00 N ATOM 591 CA SER A 42 1.500 -4.016 -3.783 1.00 0.00 C ATOM 592 C SER A 42 1.856 -2.575 -4.151 1.00 0.00 C ATOM 593 O SER A 42 2.836 -2.021 -3.638 1.00 0.00 O ATOM 594 CB SER A 42 0.301 -4.158 -2.838 1.00 0.00 C ATOM 595 OG SER A 42 0.645 -4.067 -1.463 1.00 0.00 O ATOM 0 H SER A 42 3.094 -4.234 -2.459 1.00 0.00 H new ATOM 0 HA SER A 42 1.185 -4.484 -4.716 1.00 0.00 H new ATOM 0 HB2 SER A 42 -0.429 -3.384 -3.073 1.00 0.00 H new ATOM 0 HB3 SER A 42 -0.182 -5.118 -3.020 1.00 0.00 H new ATOM 0 HG SER A 42 -0.127 -4.321 -0.915 1.00 0.00 H new ATOM 601 N PHE A 43 1.105 -2.005 -5.096 1.00 0.00 N ATOM 602 CA PHE A 43 1.393 -0.719 -5.722 1.00 0.00 C ATOM 603 C PHE A 43 0.107 0.096 -5.695 1.00 0.00 C ATOM 604 O PHE A 43 -0.911 -0.378 -6.211 1.00 0.00 O ATOM 605 CB PHE A 43 1.861 -0.933 -7.170 1.00 0.00 C ATOM 606 CG PHE A 43 3.180 -1.670 -7.325 1.00 0.00 C ATOM 607 CD1 PHE A 43 3.237 -3.071 -7.189 1.00 0.00 C ATOM 608 CD2 PHE A 43 4.352 -0.954 -7.631 1.00 0.00 C ATOM 609 CE1 PHE A 43 4.456 -3.751 -7.343 1.00 0.00 C ATOM 610 CE2 PHE A 43 5.573 -1.633 -7.783 1.00 0.00 C ATOM 611 CZ PHE A 43 5.625 -3.028 -7.638 1.00 0.00 C ATOM 0 H PHE A 43 0.256 -2.441 -5.455 1.00 0.00 H new ATOM 0 HA PHE A 43 2.187 -0.196 -5.189 1.00 0.00 H new ATOM 0 HB2 PHE A 43 1.090 -1.487 -7.705 1.00 0.00 H new ATOM 0 HB3 PHE A 43 1.949 0.040 -7.653 1.00 0.00 H new ATOM 0 HD1 PHE A 43 2.338 -3.625 -6.965 1.00 0.00 H new ATOM 0 HD2 PHE A 43 4.313 0.119 -7.749 1.00 0.00 H new ATOM 0 HE1 PHE A 43 4.495 -4.825 -7.235 1.00 0.00 H new ATOM 0 HE2 PHE A 43 6.472 -1.081 -8.012 1.00 0.00 H new ATOM 0 HZ PHE A 43 6.565 -3.547 -7.753 1.00 0.00 H new ATOM 621 N THR A 44 0.130 1.280 -5.088 1.00 0.00 N ATOM 622 CA THR A 44 -1.080 2.052 -4.839 1.00 0.00 C ATOM 623 C THR A 44 -1.266 3.071 -5.976 1.00 0.00 C ATOM 624 O THR A 44 -0.283 3.548 -6.556 1.00 0.00 O ATOM 625 CB THR A 44 -1.048 2.616 -3.394 1.00 0.00 C ATOM 626 OG1 THR A 44 -0.205 3.740 -3.238 1.00 0.00 O ATOM 627 CG2 THR A 44 -0.587 1.557 -2.374 1.00 0.00 C ATOM 0 H THR A 44 0.985 1.728 -4.757 1.00 0.00 H new ATOM 0 HA THR A 44 -1.981 1.440 -4.865 1.00 0.00 H new ATOM 0 HB THR A 44 -2.079 2.917 -3.207 1.00 0.00 H new ATOM 0 HG1 THR A 44 -0.234 4.044 -2.307 1.00 0.00 H new ATOM 0 HG21 THR A 44 -0.579 1.993 -1.375 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.272 0.710 -2.394 1.00 0.00 H new ATOM 0 HG23 THR A 44 0.417 1.218 -2.630 1.00 0.00 H new ATOM 635 N TYR A 45 -2.513 3.381 -6.342 1.00 0.00 N ATOM 636 CA TYR A 45 -2.857 4.305 -7.425 1.00 0.00 C ATOM 637 C TYR A 45 -3.988 5.230 -6.965 1.00 0.00 C ATOM 638 O TYR A 45 -4.755 4.832 -6.085 1.00 0.00 O ATOM 639 CB TYR A 45 -3.254 3.478 -8.664 1.00 0.00 C ATOM 640 CG TYR A 45 -2.520 3.864 -9.932 1.00 0.00 C ATOM 641 CD1 TYR A 45 -1.149 3.574 -10.071 1.00 0.00 C ATOM 642 CD2 TYR A 45 -3.209 4.475 -10.994 1.00 0.00 C ATOM 643 CE1 TYR A 45 -0.469 3.933 -11.248 1.00 0.00 C ATOM 644 CE2 TYR A 45 -2.536 4.846 -12.168 1.00 0.00 C ATOM 645 CZ TYR A 45 -1.154 4.597 -12.291 1.00 0.00 C ATOM 646 OH TYR A 45 -0.501 5.004 -13.414 1.00 0.00 O ATOM 0 H TYR A 45 -3.332 2.985 -5.881 1.00 0.00 H new ATOM 0 HA TYR A 45 -2.007 4.934 -7.689 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -3.069 2.424 -8.457 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -4.326 3.587 -8.831 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -0.619 3.075 -9.273 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -4.269 4.661 -10.905 1.00 0.00 H new ATOM 0 HE1 TYR A 45 0.580 3.701 -11.356 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -3.075 5.321 -12.975 1.00 0.00 H new ATOM 0 HH TYR A 45 -1.135 5.441 -14.021 1.00 0.00 H new ATOM 656 N THR A 46 -4.137 6.434 -7.532 1.00 0.00 N ATOM 657 CA THR A 46 -5.303 7.274 -7.248 1.00 0.00 C ATOM 658 C THR A 46 -5.942 7.844 -8.521 1.00 0.00 C ATOM 659 O THR A 46 -5.262 8.465 -9.341 1.00 0.00 O ATOM 660 CB THR A 46 -4.903 8.361 -6.238 1.00 0.00 C ATOM 661 OG1 THR A 46 -4.614 7.777 -4.977 1.00 0.00 O ATOM 662 CG2 THR A 46 -6.029 9.375 -6.012 1.00 0.00 C ATOM 0 H THR A 46 -3.469 6.844 -8.185 1.00 0.00 H new ATOM 0 HA THR A 46 -6.083 6.658 -6.801 1.00 0.00 H new ATOM 0 HB THR A 46 -4.031 8.864 -6.655 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.359 8.479 -4.342 1.00 0.00 H new ATOM 0 HG21 THR A 46 -5.704 10.125 -5.291 1.00 0.00 H new ATOM 0 HG22 THR A 46 -6.276 9.861 -6.956 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.910 8.861 -5.628 1.00 0.00 H new ATOM 670 N GLU A 47 -7.273 7.699 -8.645 1.00 0.00 N ATOM 671 CA GLU A 47 -8.078 8.274 -9.731 1.00 0.00 C ATOM 672 C GLU A 47 -9.010 9.401 -9.252 1.00 0.00 C ATOM 673 O GLU A 47 -9.550 10.139 -10.080 1.00 0.00 O ATOM 674 CB GLU A 47 -8.861 7.179 -10.489 1.00 0.00 C ATOM 675 CG GLU A 47 -9.872 6.349 -9.671 1.00 0.00 C ATOM 676 CD GLU A 47 -11.265 6.979 -9.552 1.00 0.00 C ATOM 677 OE1 GLU A 47 -11.907 7.306 -10.569 1.00 0.00 O ATOM 678 OE2 GLU A 47 -11.790 7.083 -8.416 1.00 0.00 O ATOM 0 H GLU A 47 -7.829 7.166 -7.976 1.00 0.00 H new ATOM 0 HA GLU A 47 -7.376 8.732 -10.428 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -9.398 7.653 -11.310 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -8.140 6.493 -10.933 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.970 5.365 -10.130 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.470 6.195 -8.670 1.00 0.00 H new ATOM 685 N LYS A 48 -9.220 9.547 -7.941 1.00 0.00 N ATOM 686 CA LYS A 48 -10.107 10.562 -7.365 1.00 0.00 C ATOM 687 C LYS A 48 -9.553 11.959 -7.611 1.00 0.00 C ATOM 688 O LYS A 48 -8.338 12.130 -7.589 1.00 0.00 O ATOM 689 CB LYS A 48 -10.226 10.314 -5.851 1.00 0.00 C ATOM 690 CG LYS A 48 -11.232 9.197 -5.549 1.00 0.00 C ATOM 691 CD LYS A 48 -12.663 9.757 -5.512 1.00 0.00 C ATOM 692 CE LYS A 48 -13.700 8.636 -5.467 1.00 0.00 C ATOM 693 NZ LYS A 48 -13.761 7.895 -6.742 1.00 0.00 N ATOM 0 H LYS A 48 -8.773 8.956 -7.240 1.00 0.00 H new ATOM 0 HA LYS A 48 -11.087 10.492 -7.837 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -9.250 10.047 -5.446 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.538 11.232 -5.353 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.159 8.419 -6.309 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -10.992 8.732 -4.593 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -12.781 10.399 -4.639 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.835 10.378 -6.391 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -13.456 7.948 -4.658 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -14.680 9.056 -5.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -14.374 7.062 -6.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.148 8.512 -7.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -12.805 7.588 -7.011 1.00 0.00 H new ATOM 707 N SER A 49 -10.404 12.962 -7.818 1.00 0.00 N ATOM 708 CA SER A 49 -9.949 14.344 -7.896 1.00 0.00 C ATOM 709 C SER A 49 -9.612 14.848 -6.492 1.00 0.00 C ATOM 710 O SER A 49 -10.321 14.526 -5.531 1.00 0.00 O ATOM 711 CB SER A 49 -11.012 15.214 -8.578 1.00 0.00 C ATOM 712 OG SER A 49 -12.325 14.971 -8.104 1.00 0.00 O ATOM 0 H SER A 49 -11.410 12.841 -7.934 1.00 0.00 H new ATOM 0 HA SER A 49 -9.045 14.403 -8.503 1.00 0.00 H new ATOM 0 HB2 SER A 49 -10.766 16.264 -8.423 1.00 0.00 H new ATOM 0 HB3 SER A 49 -10.983 15.035 -9.653 1.00 0.00 H new ATOM 0 HG SER A 49 -12.956 15.555 -8.574 1.00 0.00 H new ATOM 718 N ARG A 50 -8.579 15.691 -6.372 1.00 0.00 N ATOM 719 CA ARG A 50 -8.425 16.574 -5.240 1.00 0.00 C ATOM 720 C ARG A 50 -9.341 17.748 -5.518 1.00 0.00 C ATOM 721 O ARG A 50 -9.465 18.226 -6.650 1.00 0.00 O ATOM 722 CB ARG A 50 -6.960 17.030 -5.092 1.00 0.00 C ATOM 723 CG ARG A 50 -6.086 15.894 -4.532 1.00 0.00 C ATOM 724 CD ARG A 50 -5.444 16.224 -3.175 1.00 0.00 C ATOM 725 NE ARG A 50 -4.206 17.008 -3.329 1.00 0.00 N ATOM 726 CZ ARG A 50 -3.722 17.948 -2.509 1.00 0.00 C ATOM 727 NH1 ARG A 50 -4.425 18.358 -1.458 1.00 0.00 N ATOM 728 NH2 ARG A 50 -2.538 18.473 -2.793 1.00 0.00 N ATOM 0 H ARG A 50 -7.834 15.770 -7.064 1.00 0.00 H new ATOM 0 HA ARG A 50 -8.682 16.080 -4.303 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -6.574 17.348 -6.061 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -6.909 17.894 -4.430 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -6.695 14.996 -4.428 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -5.299 15.664 -5.251 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -6.153 16.782 -2.564 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -5.224 15.299 -2.643 1.00 0.00 H new ATOM 0 HE ARG A 50 -3.651 16.810 -4.161 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -5.343 17.955 -1.270 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -4.046 19.075 -0.839 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -2.025 18.158 -3.616 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -2.141 19.192 -2.188 1.00 0.00 H new ATOM 742 N THR A 51 -9.963 18.204 -4.458 1.00 0.00 N ATOM 743 CA THR A 51 -10.588 19.502 -4.349 1.00 0.00 C ATOM 744 C THR A 51 -10.425 19.864 -2.877 1.00 0.00 C ATOM 745 O THR A 51 -10.841 19.104 -1.991 1.00 0.00 O ATOM 746 CB THR A 51 -12.037 19.456 -4.882 1.00 0.00 C ATOM 747 OG1 THR A 51 -12.667 20.718 -4.794 1.00 0.00 O ATOM 748 CG2 THR A 51 -12.949 18.460 -4.157 1.00 0.00 C ATOM 0 H THR A 51 -10.052 17.653 -3.604 1.00 0.00 H new ATOM 0 HA THR A 51 -10.138 20.281 -4.964 1.00 0.00 H new ATOM 0 HB THR A 51 -11.916 19.135 -5.917 1.00 0.00 H new ATOM 0 HG1 THR A 51 -13.581 20.652 -5.141 1.00 0.00 H new ATOM 0 HG21 THR A 51 -13.946 18.494 -4.596 1.00 0.00 H new ATOM 0 HG22 THR A 51 -12.542 17.454 -4.258 1.00 0.00 H new ATOM 0 HG23 THR A 51 -13.008 18.723 -3.101 1.00 0.00 H new ATOM 756 N ALA A 52 -9.709 20.951 -2.607 1.00 0.00 N ATOM 757 CA ALA A 52 -9.506 21.452 -1.265 1.00 0.00 C ATOM 758 C ALA A 52 -10.652 22.427 -1.010 1.00 0.00 C ATOM 759 O ALA A 52 -11.713 22.005 -0.541 1.00 0.00 O ATOM 760 CB ALA A 52 -8.096 22.037 -1.148 1.00 0.00 C ATOM 0 H ALA A 52 -9.251 21.510 -3.327 1.00 0.00 H new ATOM 0 HA ALA A 52 -9.540 20.687 -0.489 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -7.942 22.415 -0.137 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -7.361 21.261 -1.361 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -7.980 22.852 -1.862 1.00 0.00 H new ATOM 766 N SER A 53 -10.495 23.695 -1.380 1.00 0.00 N ATOM 767 CA SER A 53 -11.572 24.664 -1.355 1.00 0.00 C ATOM 768 C SER A 53 -11.151 25.798 -2.275 1.00 0.00 C ATOM 769 O SER A 53 -10.683 26.833 -1.799 1.00 0.00 O ATOM 770 CB SER A 53 -11.830 25.124 0.088 1.00 0.00 C ATOM 771 OG SER A 53 -13.038 25.851 0.180 1.00 0.00 O ATOM 0 H SER A 53 -9.607 24.076 -1.707 1.00 0.00 H new ATOM 0 HA SER A 53 -12.516 24.247 -1.706 1.00 0.00 H new ATOM 0 HB2 SER A 53 -11.872 24.257 0.748 1.00 0.00 H new ATOM 0 HB3 SER A 53 -11.001 25.744 0.429 1.00 0.00 H new ATOM 0 HG SER A 53 -13.181 26.132 1.108 1.00 0.00 H new ATOM 777 N SER A 54 -11.312 25.588 -3.578 1.00 0.00 N ATOM 778 CA SER A 54 -10.935 26.531 -4.621 1.00 0.00 C ATOM 779 C SER A 54 -9.441 26.874 -4.523 1.00 0.00 C ATOM 780 O SER A 54 -9.027 27.840 -3.872 1.00 0.00 O ATOM 781 CB SER A 54 -11.886 27.739 -4.637 1.00 0.00 C ATOM 782 OG SER A 54 -13.233 27.302 -4.464 1.00 0.00 O ATOM 0 H SER A 54 -11.721 24.730 -3.947 1.00 0.00 H new ATOM 0 HA SER A 54 -11.056 26.071 -5.602 1.00 0.00 H new ATOM 0 HB2 SER A 54 -11.616 28.435 -3.843 1.00 0.00 H new ATOM 0 HB3 SER A 54 -11.788 28.277 -5.580 1.00 0.00 H new ATOM 0 HG SER A 54 -13.832 28.077 -4.474 1.00 0.00 H new ATOM 788 N GLY A 55 -8.629 26.013 -5.139 1.00 0.00 N ATOM 789 CA GLY A 55 -7.276 26.365 -5.528 1.00 0.00 C ATOM 790 C GLY A 55 -6.587 25.258 -6.322 1.00 0.00 C ATOM 791 O GLY A 55 -5.867 25.542 -7.282 1.00 0.00 O ATOM 0 H GLY A 55 -8.896 25.058 -5.378 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -7.299 27.276 -6.126 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -6.691 26.585 -4.635 1.00 0.00 H new ATOM 795 N ASP A 56 -6.795 24.002 -5.911 1.00 0.00 N ATOM 796 CA ASP A 56 -6.166 22.808 -6.472 1.00 0.00 C ATOM 797 C ASP A 56 -7.283 21.902 -6.995 1.00 0.00 C ATOM 798 O ASP A 56 -7.931 21.216 -6.200 1.00 0.00 O ATOM 799 CB ASP A 56 -5.326 22.069 -5.410 1.00 0.00 C ATOM 800 CG ASP A 56 -4.072 22.806 -4.936 1.00 0.00 C ATOM 801 OD1 ASP A 56 -3.347 23.396 -5.763 1.00 0.00 O ATOM 802 OD2 ASP A 56 -3.833 22.746 -3.700 1.00 0.00 O ATOM 0 H ASP A 56 -7.434 23.784 -5.146 1.00 0.00 H new ATOM 0 HA ASP A 56 -5.487 23.088 -7.277 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -5.959 21.870 -4.545 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -5.027 21.102 -5.816 1.00 0.00 H new ATOM 807 N TYR A 57 -7.606 21.960 -8.289 1.00 0.00 N ATOM 808 CA TYR A 57 -8.525 21.020 -8.941 1.00 0.00 C ATOM 809 C TYR A 57 -7.896 20.505 -10.232 1.00 0.00 C ATOM 810 O TYR A 57 -8.158 21.045 -11.312 1.00 0.00 O ATOM 811 CB TYR A 57 -9.897 21.679 -9.143 1.00 0.00 C ATOM 812 CG TYR A 57 -11.032 20.853 -9.738 1.00 0.00 C ATOM 813 CD1 TYR A 57 -11.082 19.447 -9.621 1.00 0.00 C ATOM 814 CD2 TYR A 57 -12.107 21.528 -10.350 1.00 0.00 C ATOM 815 CE1 TYR A 57 -12.183 18.726 -10.119 1.00 0.00 C ATOM 816 CE2 TYR A 57 -13.223 20.818 -10.824 1.00 0.00 C ATOM 817 CZ TYR A 57 -13.268 19.413 -10.705 1.00 0.00 C ATOM 818 OH TYR A 57 -14.338 18.716 -11.173 1.00 0.00 O ATOM 0 H TYR A 57 -7.234 22.668 -8.922 1.00 0.00 H new ATOM 0 HA TYR A 57 -8.697 20.150 -8.307 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -10.231 22.048 -8.173 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -9.753 22.550 -9.783 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -10.268 18.920 -9.145 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -12.073 22.602 -10.456 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -12.198 17.648 -10.053 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -14.046 21.348 -11.279 1.00 0.00 H new ATOM 0 HH TYR A 57 -14.997 19.339 -11.544 1.00 0.00 H new ATOM 828 N ASN A 58 -7.007 19.515 -10.135 1.00 0.00 N ATOM 829 CA ASN A 58 -6.281 18.956 -11.274 1.00 0.00 C ATOM 830 C ASN A 58 -5.512 17.714 -10.849 1.00 0.00 C ATOM 831 O ASN A 58 -5.679 16.656 -11.452 1.00 0.00 O ATOM 832 CB ASN A 58 -5.291 19.976 -11.889 1.00 0.00 C ATOM 833 CG ASN A 58 -5.559 20.229 -13.365 1.00 0.00 C ATOM 834 OD1 ASN A 58 -4.799 19.816 -14.240 1.00 0.00 O ATOM 835 ND2 ASN A 58 -6.643 20.915 -13.675 1.00 0.00 N ATOM 0 H ASN A 58 -6.768 19.073 -9.248 1.00 0.00 H new ATOM 0 HA ASN A 58 -7.022 18.699 -12.031 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -5.359 20.917 -11.344 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -4.272 19.609 -11.766 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -6.861 21.110 -14.652 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -7.263 21.250 -12.937 1.00 0.00 H new ATOM 842 N LYS A 59 -4.584 17.847 -9.893 1.00 0.00 N ATOM 843 CA LYS A 59 -3.503 16.880 -9.716 1.00 0.00 C ATOM 844 C LYS A 59 -3.796 15.962 -8.542 1.00 0.00 C ATOM 845 O LYS A 59 -4.143 16.438 -7.460 1.00 0.00 O ATOM 846 CB LYS A 59 -2.196 17.649 -9.507 1.00 0.00 C ATOM 847 CG LYS A 59 -0.960 16.953 -10.085 1.00 0.00 C ATOM 848 CD LYS A 59 -0.903 16.996 -11.623 1.00 0.00 C ATOM 849 CE LYS A 59 -1.336 15.671 -12.260 1.00 0.00 C ATOM 850 NZ LYS A 59 -1.391 15.757 -13.729 1.00 0.00 N ATOM 0 H LYS A 59 -4.564 18.621 -9.229 1.00 0.00 H new ATOM 0 HA LYS A 59 -3.414 16.251 -10.602 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -2.291 18.635 -9.962 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -2.046 17.804 -8.439 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -0.064 17.424 -9.681 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -0.949 15.914 -9.756 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -1.546 17.798 -11.986 1.00 0.00 H new ATOM 0 HD3 LYS A 59 0.112 17.234 -11.940 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -0.640 14.884 -11.969 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -2.316 15.388 -11.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -1.688 14.840 -14.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -2.074 16.490 -14.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -0.450 16.002 -14.098 1.00 0.00 H new ATOM 864 N ASN A 60 -3.619 14.657 -8.739 1.00 0.00 N ATOM 865 CA ASN A 60 -4.122 13.645 -7.819 1.00 0.00 C ATOM 866 C ASN A 60 -3.232 12.405 -7.708 1.00 0.00 C ATOM 867 O ASN A 60 -3.694 11.398 -7.170 1.00 0.00 O ATOM 868 CB ASN A 60 -5.533 13.226 -8.257 1.00 0.00 C ATOM 869 CG ASN A 60 -5.564 12.418 -9.553 1.00 0.00 C ATOM 870 OD1 ASN A 60 -4.580 12.329 -10.284 1.00 0.00 O ATOM 871 ND2 ASN A 60 -6.699 11.827 -9.867 1.00 0.00 N ATOM 0 H ASN A 60 -3.122 14.273 -9.543 1.00 0.00 H new ATOM 0 HA ASN A 60 -4.131 14.101 -6.829 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -5.990 12.637 -7.462 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -6.144 14.120 -8.383 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -6.771 11.285 -10.728 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -7.506 11.911 -9.249 1.00 0.00 H new ATOM 878 N GLN A 61 -1.952 12.441 -8.088 1.00 0.00 N ATOM 879 CA GLN A 61 -1.253 11.202 -8.417 1.00 0.00 C ATOM 880 C GLN A 61 -0.223 10.941 -7.322 1.00 0.00 C ATOM 881 O GLN A 61 0.613 11.798 -7.005 1.00 0.00 O ATOM 882 CB GLN A 61 -0.502 11.387 -9.750 1.00 0.00 C ATOM 883 CG GLN A 61 -1.396 11.430 -10.997 1.00 0.00 C ATOM 884 CD GLN A 61 -0.558 11.608 -12.266 1.00 0.00 C ATOM 885 OE1 GLN A 61 -0.010 12.679 -12.519 1.00 0.00 O ATOM 886 NE2 GLN A 61 -0.408 10.590 -13.095 1.00 0.00 N ATOM 0 H GLN A 61 -1.394 13.290 -8.173 1.00 0.00 H new ATOM 0 HA GLN A 61 -1.960 10.377 -8.498 1.00 0.00 H new ATOM 0 HB2 GLN A 61 0.072 12.312 -9.701 1.00 0.00 H new ATOM 0 HB3 GLN A 61 0.214 10.573 -9.862 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -1.975 10.509 -11.066 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -2.109 12.250 -10.910 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -0.859 9.697 -12.893 1.00 0.00 H new ATOM 0 HE22 GLN A 61 0.159 10.697 -13.936 1.00 0.00 H new ATOM 895 N TYR A 62 -0.270 9.727 -6.772 1.00 0.00 N ATOM 896 CA TYR A 62 0.460 9.342 -5.571 1.00 0.00 C ATOM 897 C TYR A 62 0.719 7.844 -5.644 1.00 0.00 C ATOM 898 O TYR A 62 -0.233 7.065 -5.769 1.00 0.00 O ATOM 899 CB TYR A 62 -0.362 9.734 -4.331 1.00 0.00 C ATOM 900 CG TYR A 62 0.101 9.193 -2.988 1.00 0.00 C ATOM 901 CD1 TYR A 62 1.254 9.711 -2.367 1.00 0.00 C ATOM 902 CD2 TYR A 62 -0.675 8.231 -2.315 1.00 0.00 C ATOM 903 CE1 TYR A 62 1.650 9.250 -1.099 1.00 0.00 C ATOM 904 CE2 TYR A 62 -0.285 7.763 -1.048 1.00 0.00 C ATOM 905 CZ TYR A 62 0.886 8.262 -0.438 1.00 0.00 C ATOM 906 OH TYR A 62 1.231 7.815 0.795 1.00 0.00 O ATOM 0 H TYR A 62 -0.831 8.969 -7.161 1.00 0.00 H new ATOM 0 HA TYR A 62 1.418 9.857 -5.498 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.380 10.822 -4.268 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -1.390 9.407 -4.490 1.00 0.00 H new ATOM 0 HD1 TYR A 62 1.839 10.468 -2.869 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.575 7.850 -2.774 1.00 0.00 H new ATOM 0 HE1 TYR A 62 2.537 9.651 -0.631 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -0.883 7.020 -0.540 1.00 0.00 H new ATOM 0 HH TYR A 62 0.587 7.137 1.089 1.00 0.00 H new ATOM 916 N TYR A 63 1.988 7.439 -5.635 1.00 0.00 N ATOM 917 CA TYR A 63 2.384 6.037 -5.671 1.00 0.00 C ATOM 918 C TYR A 63 3.074 5.710 -4.368 1.00 0.00 C ATOM 919 O TYR A 63 4.171 6.206 -4.106 1.00 0.00 O ATOM 920 CB TYR A 63 3.308 5.707 -6.861 1.00 0.00 C ATOM 921 CG TYR A 63 4.152 6.831 -7.439 1.00 0.00 C ATOM 922 CD1 TYR A 63 3.574 7.749 -8.338 1.00 0.00 C ATOM 923 CD2 TYR A 63 5.525 6.921 -7.136 1.00 0.00 C ATOM 924 CE1 TYR A 63 4.357 8.761 -8.917 1.00 0.00 C ATOM 925 CE2 TYR A 63 6.320 7.923 -7.727 1.00 0.00 C ATOM 926 CZ TYR A 63 5.734 8.855 -8.616 1.00 0.00 C ATOM 927 OH TYR A 63 6.476 9.842 -9.191 1.00 0.00 O ATOM 0 H TYR A 63 2.777 8.085 -5.602 1.00 0.00 H new ATOM 0 HA TYR A 63 1.488 5.430 -5.803 1.00 0.00 H new ATOM 0 HB2 TYR A 63 3.982 4.909 -6.550 1.00 0.00 H new ATOM 0 HB3 TYR A 63 2.689 5.307 -7.664 1.00 0.00 H new ATOM 0 HD1 TYR A 63 2.525 7.674 -8.583 1.00 0.00 H new ATOM 0 HD2 TYR A 63 5.970 6.218 -6.447 1.00 0.00 H new ATOM 0 HE1 TYR A 63 3.905 9.470 -9.595 1.00 0.00 H new ATOM 0 HE2 TYR A 63 7.375 7.980 -7.502 1.00 0.00 H new ATOM 0 HH TYR A 63 7.404 9.775 -8.884 1.00 0.00 H new ATOM 937 N GLY A 64 2.462 4.799 -3.620 1.00 0.00 N ATOM 938 CA GLY A 64 3.093 4.015 -2.588 1.00 0.00 C ATOM 939 C GLY A 64 3.546 2.723 -3.225 1.00 0.00 C ATOM 940 O GLY A 64 2.765 2.065 -3.923 1.00 0.00 O ATOM 0 H GLY A 64 1.471 4.585 -3.728 1.00 0.00 H new ATOM 0 HA2 GLY A 64 3.940 4.551 -2.161 1.00 0.00 H new ATOM 0 HA3 GLY A 64 2.396 3.819 -1.773 1.00 0.00 H new ATOM 944 N ILE A 65 4.797 2.356 -2.973 1.00 0.00 N ATOM 945 CA ILE A 65 5.301 1.033 -3.278 1.00 0.00 C ATOM 946 C ILE A 65 5.725 0.499 -1.922 1.00 0.00 C ATOM 947 O ILE A 65 6.695 0.997 -1.352 1.00 0.00 O ATOM 948 CB ILE A 65 6.444 1.103 -4.320 1.00 0.00 C ATOM 949 CG1 ILE A 65 5.972 1.837 -5.600 1.00 0.00 C ATOM 950 CG2 ILE A 65 6.939 -0.319 -4.640 1.00 0.00 C ATOM 951 CD1 ILE A 65 7.045 1.978 -6.684 1.00 0.00 C ATOM 0 H ILE A 65 5.489 2.974 -2.550 1.00 0.00 H new ATOM 0 HA ILE A 65 4.572 0.372 -3.747 1.00 0.00 H new ATOM 0 HB ILE A 65 7.275 1.673 -3.904 1.00 0.00 H new ATOM 0 HG12 ILE A 65 5.120 1.301 -6.018 1.00 0.00 H new ATOM 0 HG13 ILE A 65 5.619 2.831 -5.324 1.00 0.00 H new ATOM 0 HG21 ILE A 65 7.744 -0.268 -5.374 1.00 0.00 H new ATOM 0 HG22 ILE A 65 7.308 -0.789 -3.729 1.00 0.00 H new ATOM 0 HG23 ILE A 65 6.116 -0.908 -5.045 1.00 0.00 H new ATOM 0 HD11 ILE A 65 6.628 2.503 -7.543 1.00 0.00 H new ATOM 0 HD12 ILE A 65 7.890 2.542 -6.289 1.00 0.00 H new ATOM 0 HD13 ILE A 65 7.382 0.989 -6.993 1.00 0.00 H new ATOM 963 N THR A 66 4.984 -0.477 -1.404 1.00 0.00 N ATOM 964 CA THR A 66 5.198 -1.176 -0.171 1.00 0.00 C ATOM 965 C THR A 66 5.375 -2.659 -0.489 1.00 0.00 C ATOM 966 O THR A 66 4.793 -3.183 -1.447 1.00 0.00 O ATOM 967 CB THR A 66 4.025 -0.882 0.791 1.00 0.00 C ATOM 968 OG1 THR A 66 4.233 -1.513 2.036 1.00 0.00 O ATOM 969 CG2 THR A 66 2.659 -1.343 0.256 1.00 0.00 C ATOM 0 H THR A 66 4.153 -0.816 -1.888 1.00 0.00 H new ATOM 0 HA THR A 66 6.102 -0.841 0.338 1.00 0.00 H new ATOM 0 HB THR A 66 4.004 0.203 0.893 1.00 0.00 H new ATOM 0 HG1 THR A 66 5.194 -1.630 2.187 1.00 0.00 H new ATOM 0 HG21 THR A 66 1.884 -1.104 0.984 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.445 -0.833 -0.683 1.00 0.00 H new ATOM 0 HG23 THR A 66 2.679 -2.420 0.087 1.00 0.00 H new ATOM 977 N ALA A 67 6.196 -3.321 0.319 1.00 0.00 N ATOM 978 CA ALA A 67 6.546 -4.713 0.198 1.00 0.00 C ATOM 979 C ALA A 67 6.872 -5.269 1.578 1.00 0.00 C ATOM 980 O ALA A 67 7.018 -4.534 2.560 1.00 0.00 O ATOM 981 CB ALA A 67 7.767 -4.832 -0.717 1.00 0.00 C ATOM 0 H ALA A 67 6.653 -2.870 1.112 1.00 0.00 H new ATOM 0 HA ALA A 67 5.716 -5.278 -0.225 1.00 0.00 H new ATOM 0 HB1 ALA A 67 8.045 -5.881 -0.819 1.00 0.00 H new ATOM 0 HB2 ALA A 67 7.527 -4.423 -1.699 1.00 0.00 H new ATOM 0 HB3 ALA A 67 8.600 -4.276 -0.286 1.00 0.00 H new ATOM 987 N GLY A 68 7.065 -6.578 1.627 1.00 0.00 N ATOM 988 CA GLY A 68 7.746 -7.241 2.715 1.00 0.00 C ATOM 989 C GLY A 68 7.724 -8.751 2.511 1.00 0.00 C ATOM 990 O GLY A 68 7.095 -9.254 1.573 1.00 0.00 O ATOM 0 H GLY A 68 6.745 -7.215 0.897 1.00 0.00 H new ATOM 0 HA2 GLY A 68 8.776 -6.890 2.776 1.00 0.00 H new ATOM 0 HA3 GLY A 68 7.267 -6.988 3.661 1.00 0.00 H new ATOM 994 N PRO A 69 8.399 -9.488 3.399 1.00 0.00 N ATOM 995 CA PRO A 69 8.147 -10.900 3.588 1.00 0.00 C ATOM 996 C PRO A 69 6.825 -11.108 4.355 1.00 0.00 C ATOM 997 O PRO A 69 6.181 -10.155 4.800 1.00 0.00 O ATOM 998 CB PRO A 69 9.378 -11.402 4.342 1.00 0.00 C ATOM 999 CG PRO A 69 9.781 -10.201 5.194 1.00 0.00 C ATOM 1000 CD PRO A 69 9.391 -8.998 4.342 1.00 0.00 C ATOM 0 HA PRO A 69 8.015 -11.454 2.659 1.00 0.00 H new ATOM 0 HB2 PRO A 69 9.146 -12.272 4.957 1.00 0.00 H new ATOM 0 HB3 PRO A 69 10.175 -11.697 3.660 1.00 0.00 H new ATOM 0 HG2 PRO A 69 9.260 -10.198 6.151 1.00 0.00 H new ATOM 0 HG3 PRO A 69 10.849 -10.206 5.412 1.00 0.00 H new ATOM 0 HD2 PRO A 69 8.983 -8.197 4.959 1.00 0.00 H new ATOM 0 HD3 PRO A 69 10.257 -8.589 3.822 1.00 0.00 H new ATOM 1008 N ALA A 70 6.419 -12.366 4.526 1.00 0.00 N ATOM 1009 CA ALA A 70 5.210 -12.803 5.209 1.00 0.00 C ATOM 1010 C ALA A 70 5.576 -13.978 6.117 1.00 0.00 C ATOM 1011 O ALA A 70 5.886 -15.065 5.619 1.00 0.00 O ATOM 1012 CB ALA A 70 4.140 -13.182 4.175 1.00 0.00 C ATOM 0 H ALA A 70 6.961 -13.152 4.168 1.00 0.00 H new ATOM 0 HA ALA A 70 4.793 -12.004 5.822 1.00 0.00 H new ATOM 0 HB1 ALA A 70 3.236 -13.509 4.690 1.00 0.00 H new ATOM 0 HB2 ALA A 70 3.911 -12.316 3.554 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.512 -13.991 3.546 1.00 0.00 H new ATOM 1018 N TYR A 71 5.567 -13.764 7.437 1.00 0.00 N ATOM 1019 CA TYR A 71 5.963 -14.779 8.412 1.00 0.00 C ATOM 1020 C TYR A 71 4.794 -15.737 8.591 1.00 0.00 C ATOM 1021 O TYR A 71 3.674 -15.288 8.833 1.00 0.00 O ATOM 1022 CB TYR A 71 6.296 -14.128 9.772 1.00 0.00 C ATOM 1023 CG TYR A 71 7.691 -14.428 10.280 1.00 0.00 C ATOM 1024 CD1 TYR A 71 8.803 -13.947 9.566 1.00 0.00 C ATOM 1025 CD2 TYR A 71 7.886 -15.160 11.469 1.00 0.00 C ATOM 1026 CE1 TYR A 71 10.103 -14.195 10.037 1.00 0.00 C ATOM 1027 CE2 TYR A 71 9.188 -15.412 11.941 1.00 0.00 C ATOM 1028 CZ TYR A 71 10.307 -14.929 11.225 1.00 0.00 C ATOM 1029 OH TYR A 71 11.572 -15.109 11.694 1.00 0.00 O ATOM 0 H TYR A 71 5.284 -12.879 7.858 1.00 0.00 H new ATOM 0 HA TYR A 71 6.850 -15.303 8.055 1.00 0.00 H new ATOM 0 HB2 TYR A 71 6.178 -13.048 9.683 1.00 0.00 H new ATOM 0 HB3 TYR A 71 5.571 -14.468 10.512 1.00 0.00 H new ATOM 0 HD1 TYR A 71 8.657 -13.386 8.655 1.00 0.00 H new ATOM 0 HD2 TYR A 71 7.033 -15.529 12.020 1.00 0.00 H new ATOM 0 HE1 TYR A 71 10.953 -13.821 9.486 1.00 0.00 H new ATOM 0 HE2 TYR A 71 9.332 -15.975 12.851 1.00 0.00 H new ATOM 0 HH TYR A 71 11.543 -15.634 12.521 1.00 0.00 H new ATOM 1039 N ARG A 72 5.045 -17.042 8.503 1.00 0.00 N ATOM 1040 CA ARG A 72 4.097 -18.101 8.844 1.00 0.00 C ATOM 1041 C ARG A 72 4.673 -18.751 10.095 1.00 0.00 C ATOM 1042 O ARG A 72 5.833 -19.157 10.078 1.00 0.00 O ATOM 1043 CB ARG A 72 3.943 -19.040 7.632 1.00 0.00 C ATOM 1044 CG ARG A 72 2.811 -20.075 7.765 1.00 0.00 C ATOM 1045 CD ARG A 72 2.489 -20.660 6.384 1.00 0.00 C ATOM 1046 NE ARG A 72 1.401 -21.658 6.382 1.00 0.00 N ATOM 1047 CZ ARG A 72 0.970 -22.306 5.288 1.00 0.00 C ATOM 1048 NH1 ARG A 72 1.401 -21.972 4.077 1.00 0.00 N ATOM 1049 NH2 ARG A 72 0.082 -23.273 5.427 1.00 0.00 N ATOM 0 H ARG A 72 5.943 -17.403 8.182 1.00 0.00 H new ATOM 0 HA ARG A 72 3.084 -17.761 9.061 1.00 0.00 H new ATOM 0 HB2 ARG A 72 3.764 -18.437 6.742 1.00 0.00 H new ATOM 0 HB3 ARG A 72 4.884 -19.568 7.476 1.00 0.00 H new ATOM 0 HG2 ARG A 72 3.109 -20.870 8.448 1.00 0.00 H new ATOM 0 HG3 ARG A 72 1.923 -19.606 8.189 1.00 0.00 H new ATOM 0 HD2 ARG A 72 2.219 -19.845 5.712 1.00 0.00 H new ATOM 0 HD3 ARG A 72 3.390 -21.122 5.980 1.00 0.00 H new ATOM 0 HE ARG A 72 0.947 -21.869 7.271 1.00 0.00 H new ATOM 0 HH11 ARG A 72 2.071 -21.211 3.966 1.00 0.00 H new ATOM 0 HH12 ARG A 72 1.062 -22.476 3.258 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -0.265 -23.517 6.354 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -0.257 -23.776 4.607 1.00 0.00 H new ATOM 1063 N ILE A 73 3.942 -18.706 11.206 1.00 0.00 N ATOM 1064 CA ILE A 73 4.470 -19.050 12.523 1.00 0.00 C ATOM 1065 C ILE A 73 4.660 -20.566 12.559 1.00 0.00 C ATOM 1066 O ILE A 73 5.792 -21.044 12.615 1.00 0.00 O ATOM 1067 CB ILE A 73 3.539 -18.541 13.648 1.00 0.00 C ATOM 1068 CG1 ILE A 73 3.219 -17.032 13.528 1.00 0.00 C ATOM 1069 CG2 ILE A 73 4.179 -18.834 15.017 1.00 0.00 C ATOM 1070 CD1 ILE A 73 1.902 -16.692 14.231 1.00 0.00 C ATOM 0 H ILE A 73 2.961 -18.428 11.218 1.00 0.00 H new ATOM 0 HA ILE A 73 5.429 -18.562 12.696 1.00 0.00 H new ATOM 0 HB ILE A 73 2.593 -19.073 13.550 1.00 0.00 H new ATOM 0 HG12 ILE A 73 4.030 -16.449 13.965 1.00 0.00 H new ATOM 0 HG13 ILE A 73 3.157 -16.752 12.476 1.00 0.00 H new ATOM 0 HG21 ILE A 73 3.523 -18.475 15.810 1.00 0.00 H new ATOM 0 HG22 ILE A 73 4.327 -19.908 15.127 1.00 0.00 H new ATOM 0 HG23 ILE A 73 5.141 -18.326 15.085 1.00 0.00 H new ATOM 0 HD11 ILE A 73 1.701 -15.625 14.131 1.00 0.00 H new ATOM 0 HD12 ILE A 73 1.090 -17.258 13.775 1.00 0.00 H new ATOM 0 HD13 ILE A 73 1.976 -16.950 15.287 1.00 0.00 H new ATOM 1082 N ASN A 74 3.551 -21.310 12.482 1.00 0.00 N ATOM 1083 CA ASN A 74 3.557 -22.717 12.121 1.00 0.00 C ATOM 1084 C ASN A 74 2.420 -22.912 11.132 1.00 0.00 C ATOM 1085 O ASN A 74 2.678 -22.825 9.933 1.00 0.00 O ATOM 1086 CB ASN A 74 3.536 -23.662 13.333 1.00 0.00 C ATOM 1087 CG ASN A 74 4.205 -24.973 12.931 1.00 0.00 C ATOM 1088 OD1 ASN A 74 5.412 -24.997 12.703 1.00 0.00 O ATOM 1089 ND2 ASN A 74 3.476 -26.068 12.804 1.00 0.00 N ATOM 0 H ASN A 74 2.619 -20.941 12.672 1.00 0.00 H new ATOM 0 HA ASN A 74 4.498 -22.994 11.646 1.00 0.00 H new ATOM 0 HB2 ASN A 74 4.061 -23.211 14.175 1.00 0.00 H new ATOM 0 HB3 ASN A 74 2.511 -23.842 13.656 1.00 0.00 H new ATOM 0 HD21 ASN A 74 3.915 -26.942 12.515 1.00 0.00 H new ATOM 0 HD22 ASN A 74 2.475 -26.039 12.995 1.00 0.00 H new ATOM 1096 N ASP A 75 1.160 -23.013 11.571 1.00 0.00 N ATOM 1097 CA ASP A 75 0.015 -22.935 10.662 1.00 0.00 C ATOM 1098 C ASP A 75 -1.259 -22.554 11.417 1.00 0.00 C ATOM 1099 O ASP A 75 -2.088 -23.392 11.777 1.00 0.00 O ATOM 1100 CB ASP A 75 -0.148 -24.195 9.793 1.00 0.00 C ATOM 1101 CG ASP A 75 -0.968 -23.896 8.543 1.00 0.00 C ATOM 1102 OD1 ASP A 75 -0.812 -22.787 7.974 1.00 0.00 O ATOM 1103 OD2 ASP A 75 -1.706 -24.776 8.045 1.00 0.00 O ATOM 0 H ASP A 75 0.909 -23.149 12.550 1.00 0.00 H new ATOM 0 HA ASP A 75 0.217 -22.132 9.953 1.00 0.00 H new ATOM 0 HB2 ASP A 75 0.834 -24.573 9.506 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -0.635 -24.980 10.372 1.00 0.00 H new ATOM 1108 N TRP A 76 -1.387 -21.253 11.669 1.00 0.00 N ATOM 1109 CA TRP A 76 -2.622 -20.591 12.079 1.00 0.00 C ATOM 1110 C TRP A 76 -2.875 -19.376 11.193 1.00 0.00 C ATOM 1111 O TRP A 76 -4.017 -19.098 10.820 1.00 0.00 O ATOM 1112 CB TRP A 76 -2.528 -20.144 13.543 1.00 0.00 C ATOM 1113 CG TRP A 76 -2.349 -21.226 14.558 1.00 0.00 C ATOM 1114 CD1 TRP A 76 -3.347 -21.955 15.101 1.00 0.00 C ATOM 1115 CD2 TRP A 76 -1.120 -21.692 15.195 1.00 0.00 C ATOM 1116 NE1 TRP A 76 -2.834 -22.803 16.059 1.00 0.00 N ATOM 1117 CE2 TRP A 76 -1.465 -22.687 16.158 1.00 0.00 C ATOM 1118 CE3 TRP A 76 0.248 -21.366 15.068 1.00 0.00 C ATOM 1119 CZ2 TRP A 76 -0.506 -23.319 16.962 1.00 0.00 C ATOM 1120 CZ3 TRP A 76 1.222 -22.001 15.863 1.00 0.00 C ATOM 1121 CH2 TRP A 76 0.846 -22.970 16.812 1.00 0.00 C ATOM 0 H TRP A 76 -0.602 -20.606 11.590 1.00 0.00 H new ATOM 0 HA TRP A 76 -3.446 -21.297 11.976 1.00 0.00 H new ATOM 0 HB2 TRP A 76 -1.694 -19.448 13.635 1.00 0.00 H new ATOM 0 HB3 TRP A 76 -3.434 -19.590 13.790 1.00 0.00 H new ATOM 0 HD1 TRP A 76 -4.389 -21.885 14.827 1.00 0.00 H new ATOM 0 HE1 TRP A 76 -3.398 -23.438 16.624 1.00 0.00 H new ATOM 0 HE3 TRP A 76 0.552 -20.618 14.350 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 -0.803 -24.063 17.686 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 2.264 -21.743 15.744 1.00 0.00 H new ATOM 0 HH2 TRP A 76 1.597 -23.445 17.425 1.00 0.00 H new ATOM 1132 N ALA A 77 -1.812 -18.636 10.880 1.00 0.00 N ATOM 1133 CA ALA A 77 -1.875 -17.344 10.206 1.00 0.00 C ATOM 1134 C ALA A 77 -0.598 -17.121 9.398 1.00 0.00 C ATOM 1135 O ALA A 77 0.354 -17.902 9.514 1.00 0.00 O ATOM 1136 CB ALA A 77 -2.034 -16.261 11.279 1.00 0.00 C ATOM 0 H ALA A 77 -0.859 -18.928 11.095 1.00 0.00 H new ATOM 0 HA ALA A 77 -2.719 -17.308 9.517 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -2.084 -15.282 10.803 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -2.951 -16.438 11.842 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -1.181 -16.292 11.956 1.00 0.00 H new ATOM 1142 N SER A 78 -0.543 -16.038 8.619 1.00 0.00 N ATOM 1143 CA SER A 78 0.702 -15.607 8.005 1.00 0.00 C ATOM 1144 C SER A 78 0.667 -14.085 7.876 1.00 0.00 C ATOM 1145 O SER A 78 -0.064 -13.574 7.034 1.00 0.00 O ATOM 1146 CB SER A 78 0.890 -16.331 6.661 1.00 0.00 C ATOM 1147 OG SER A 78 2.183 -16.133 6.128 1.00 0.00 O ATOM 0 H SER A 78 -1.347 -15.449 8.403 1.00 0.00 H new ATOM 0 HA SER A 78 1.566 -15.868 8.616 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.714 -17.398 6.797 1.00 0.00 H new ATOM 0 HB3 SER A 78 0.146 -15.973 5.949 1.00 0.00 H new ATOM 0 HG SER A 78 2.782 -15.812 6.834 1.00 0.00 H new ATOM 1153 N ILE A 79 1.405 -13.350 8.718 1.00 0.00 N ATOM 1154 CA ILE A 79 1.329 -11.888 8.806 1.00 0.00 C ATOM 1155 C ILE A 79 2.723 -11.282 9.063 1.00 0.00 C ATOM 1156 O ILE A 79 3.626 -11.995 9.511 1.00 0.00 O ATOM 1157 CB ILE A 79 0.258 -11.449 9.840 1.00 0.00 C ATOM 1158 CG1 ILE A 79 0.647 -11.586 11.331 1.00 0.00 C ATOM 1159 CG2 ILE A 79 -1.127 -12.085 9.588 1.00 0.00 C ATOM 1160 CD1 ILE A 79 0.740 -13.010 11.893 1.00 0.00 C ATOM 0 H ILE A 79 2.079 -13.760 9.364 1.00 0.00 H new ATOM 0 HA ILE A 79 0.999 -11.490 7.847 1.00 0.00 H new ATOM 0 HB ILE A 79 0.196 -10.376 9.656 1.00 0.00 H new ATOM 0 HG12 ILE A 79 1.612 -11.100 11.477 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -0.081 -11.033 11.924 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -1.830 -11.738 10.345 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -1.486 -11.796 8.600 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -1.044 -13.171 9.641 1.00 0.00 H new ATOM 0 HD11 ILE A 79 1.020 -12.968 12.946 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -0.227 -13.504 11.794 1.00 0.00 H new ATOM 0 HD13 ILE A 79 1.493 -13.571 11.339 1.00 0.00 H new ATOM 1172 N TYR A 80 2.933 -10.007 8.704 1.00 0.00 N ATOM 1173 CA TYR A 80 4.178 -9.262 8.930 1.00 0.00 C ATOM 1174 C TYR A 80 3.915 -7.747 9.085 1.00 0.00 C ATOM 1175 O TYR A 80 2.793 -7.290 8.834 1.00 0.00 O ATOM 1176 CB TYR A 80 5.136 -9.568 7.770 1.00 0.00 C ATOM 1177 CG TYR A 80 6.601 -9.312 8.053 1.00 0.00 C ATOM 1178 CD1 TYR A 80 7.308 -10.160 8.926 1.00 0.00 C ATOM 1179 CD2 TYR A 80 7.265 -8.242 7.429 1.00 0.00 C ATOM 1180 CE1 TYR A 80 8.681 -9.962 9.152 1.00 0.00 C ATOM 1181 CE2 TYR A 80 8.625 -8.008 7.685 1.00 0.00 C ATOM 1182 CZ TYR A 80 9.343 -8.876 8.536 1.00 0.00 C ATOM 1183 OH TYR A 80 10.678 -8.704 8.727 1.00 0.00 O ATOM 0 H TYR A 80 2.219 -9.450 8.234 1.00 0.00 H new ATOM 0 HA TYR A 80 4.635 -9.579 9.868 1.00 0.00 H new ATOM 0 HB2 TYR A 80 5.015 -10.614 7.488 1.00 0.00 H new ATOM 0 HB3 TYR A 80 4.840 -8.969 6.909 1.00 0.00 H new ATOM 0 HD1 TYR A 80 6.793 -10.967 9.425 1.00 0.00 H new ATOM 0 HD2 TYR A 80 6.727 -7.597 6.750 1.00 0.00 H new ATOM 0 HE1 TYR A 80 9.228 -10.637 9.794 1.00 0.00 H new ATOM 0 HE2 TYR A 80 9.122 -7.164 7.231 1.00 0.00 H new ATOM 0 HH TYR A 80 10.980 -7.912 8.234 1.00 0.00 H new ATOM 1193 N GLY A 81 4.943 -6.962 9.431 1.00 0.00 N ATOM 1194 CA GLY A 81 4.942 -5.498 9.440 1.00 0.00 C ATOM 1195 C GLY A 81 5.709 -4.999 8.218 1.00 0.00 C ATOM 1196 O GLY A 81 6.906 -5.272 8.102 1.00 0.00 O ATOM 0 H GLY A 81 5.839 -7.351 9.726 1.00 0.00 H new ATOM 0 HA2 GLY A 81 3.919 -5.121 9.424 1.00 0.00 H new ATOM 0 HA3 GLY A 81 5.405 -5.126 10.354 1.00 0.00 H new ATOM 1200 N VAL A 82 5.034 -4.323 7.289 1.00 0.00 N ATOM 1201 CA VAL A 82 5.511 -4.045 5.935 1.00 0.00 C ATOM 1202 C VAL A 82 5.820 -2.554 5.759 1.00 0.00 C ATOM 1203 O VAL A 82 5.340 -1.706 6.518 1.00 0.00 O ATOM 1204 CB VAL A 82 4.483 -4.561 4.904 1.00 0.00 C ATOM 1205 CG1 VAL A 82 4.398 -6.095 4.924 1.00 0.00 C ATOM 1206 CG2 VAL A 82 3.073 -3.996 5.123 1.00 0.00 C ATOM 0 H VAL A 82 4.105 -3.940 7.465 1.00 0.00 H new ATOM 0 HA VAL A 82 6.447 -4.577 5.765 1.00 0.00 H new ATOM 0 HB VAL A 82 4.846 -4.213 3.937 1.00 0.00 H new ATOM 0 HG11 VAL A 82 3.666 -6.428 4.188 1.00 0.00 H new ATOM 0 HG12 VAL A 82 5.374 -6.517 4.683 1.00 0.00 H new ATOM 0 HG13 VAL A 82 4.093 -6.430 5.916 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.399 -4.397 4.366 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.717 -4.280 6.113 1.00 0.00 H new ATOM 0 HG23 VAL A 82 3.100 -2.909 5.045 1.00 0.00 H new ATOM 1216 N VAL A 83 6.609 -2.219 4.741 1.00 0.00 N ATOM 1217 CA VAL A 83 7.189 -0.890 4.552 1.00 0.00 C ATOM 1218 C VAL A 83 7.164 -0.504 3.098 1.00 0.00 C ATOM 1219 O VAL A 83 6.961 -1.365 2.247 1.00 0.00 O ATOM 1220 CB VAL A 83 8.638 -0.852 5.061 1.00 0.00 C ATOM 1221 CG1 VAL A 83 8.569 -0.560 6.545 1.00 0.00 C ATOM 1222 CG2 VAL A 83 9.434 -2.136 4.780 1.00 0.00 C ATOM 0 H VAL A 83 6.869 -2.878 4.008 1.00 0.00 H new ATOM 0 HA VAL A 83 6.590 -0.181 5.124 1.00 0.00 H new ATOM 0 HB VAL A 83 9.184 -0.078 4.521 1.00 0.00 H new ATOM 0 HG11 VAL A 83 9.578 -0.523 6.956 1.00 0.00 H new ATOM 0 HG12 VAL A 83 8.076 0.399 6.705 1.00 0.00 H new ATOM 0 HG13 VAL A 83 8.003 -1.346 7.045 1.00 0.00 H new ATOM 0 HG21 VAL A 83 10.446 -2.029 5.170 1.00 0.00 H new ATOM 0 HG22 VAL A 83 8.945 -2.981 5.266 1.00 0.00 H new ATOM 0 HG23 VAL A 83 9.476 -2.310 3.705 1.00 0.00 H new ATOM 1232 N GLY A 84 7.376 0.774 2.811 1.00 0.00 N ATOM 1233 CA GLY A 84 7.340 1.303 1.471 1.00 0.00 C ATOM 1234 C GLY A 84 7.738 2.764 1.460 1.00 0.00 C ATOM 1235 O GLY A 84 8.305 3.284 2.430 1.00 0.00 O ATOM 0 H GLY A 84 7.581 1.477 3.521 1.00 0.00 H new ATOM 0 HA2 GLY A 84 8.014 0.733 0.832 1.00 0.00 H new ATOM 0 HA3 GLY A 84 6.338 1.191 1.058 1.00 0.00 H new ATOM 1239 N VAL A 85 7.445 3.437 0.357 1.00 0.00 N ATOM 1240 CA VAL A 85 7.555 4.880 0.267 1.00 0.00 C ATOM 1241 C VAL A 85 6.485 5.379 -0.708 1.00 0.00 C ATOM 1242 O VAL A 85 6.248 4.746 -1.744 1.00 0.00 O ATOM 1243 CB VAL A 85 9.010 5.241 -0.088 1.00 0.00 C ATOM 1244 CG1 VAL A 85 9.434 4.810 -1.493 1.00 0.00 C ATOM 1245 CG2 VAL A 85 9.306 6.711 0.203 1.00 0.00 C ATOM 0 H VAL A 85 7.123 2.993 -0.503 1.00 0.00 H new ATOM 0 HA VAL A 85 7.356 5.389 1.210 1.00 0.00 H new ATOM 0 HB VAL A 85 9.640 4.647 0.574 1.00 0.00 H new ATOM 0 HG11 VAL A 85 10.470 5.100 -1.665 1.00 0.00 H new ATOM 0 HG12 VAL A 85 9.340 3.728 -1.586 1.00 0.00 H new ATOM 0 HG13 VAL A 85 8.794 5.294 -2.231 1.00 0.00 H new ATOM 0 HG21 VAL A 85 10.341 6.933 -0.059 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.640 7.340 -0.387 1.00 0.00 H new ATOM 0 HG23 VAL A 85 9.149 6.911 1.263 1.00 0.00 H new ATOM 1255 N GLY A 86 5.828 6.483 -0.350 1.00 0.00 N ATOM 1256 CA GLY A 86 4.720 7.115 -1.039 1.00 0.00 C ATOM 1257 C GLY A 86 5.160 8.464 -1.583 1.00 0.00 C ATOM 1258 O GLY A 86 5.391 9.379 -0.789 1.00 0.00 O ATOM 0 H GLY A 86 6.083 6.992 0.496 1.00 0.00 H new ATOM 0 HA2 GLY A 86 4.375 6.478 -1.854 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.880 7.243 -0.356 1.00 0.00 H new ATOM 1262 N TYR A 87 5.307 8.591 -2.904 1.00 0.00 N ATOM 1263 CA TYR A 87 5.691 9.830 -3.577 1.00 0.00 C ATOM 1264 C TYR A 87 4.428 10.529 -4.066 1.00 0.00 C ATOM 1265 O TYR A 87 3.536 9.864 -4.596 1.00 0.00 O ATOM 1266 CB TYR A 87 6.605 9.535 -4.783 1.00 0.00 C ATOM 1267 CG TYR A 87 7.763 10.504 -4.922 1.00 0.00 C ATOM 1268 CD1 TYR A 87 7.510 11.849 -5.251 1.00 0.00 C ATOM 1269 CD2 TYR A 87 9.095 10.072 -4.757 1.00 0.00 C ATOM 1270 CE1 TYR A 87 8.567 12.762 -5.376 1.00 0.00 C ATOM 1271 CE2 TYR A 87 10.157 10.987 -4.867 1.00 0.00 C ATOM 1272 CZ TYR A 87 9.899 12.343 -5.163 1.00 0.00 C ATOM 1273 OH TYR A 87 10.914 13.238 -5.290 1.00 0.00 O ATOM 0 H TYR A 87 5.158 7.815 -3.549 1.00 0.00 H new ATOM 0 HA TYR A 87 6.235 10.463 -2.876 1.00 0.00 H new ATOM 0 HB2 TYR A 87 6.999 8.523 -4.690 1.00 0.00 H new ATOM 0 HB3 TYR A 87 6.009 9.562 -5.695 1.00 0.00 H new ATOM 0 HD1 TYR A 87 6.494 12.180 -5.408 1.00 0.00 H new ATOM 0 HD2 TYR A 87 9.301 9.033 -4.545 1.00 0.00 H new ATOM 0 HE1 TYR A 87 8.362 13.790 -5.636 1.00 0.00 H new ATOM 0 HE2 TYR A 87 11.174 10.651 -4.725 1.00 0.00 H new ATOM 0 HH TYR A 87 11.768 12.792 -5.110 1.00 0.00 H new ATOM 1283 N GLY A 88 4.355 11.858 -3.960 1.00 0.00 N ATOM 1284 CA GLY A 88 3.234 12.640 -4.472 1.00 0.00 C ATOM 1285 C GLY A 88 3.673 13.992 -5.028 1.00 0.00 C ATOM 1286 O GLY A 88 4.727 14.526 -4.664 1.00 0.00 O ATOM 0 H GLY A 88 5.078 12.422 -3.513 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.728 12.075 -5.255 1.00 0.00 H new ATOM 0 HA3 GLY A 88 2.509 12.797 -3.673 1.00 0.00 H new ATOM 1290 N LYS A 89 2.810 14.576 -5.863 1.00 0.00 N ATOM 1291 CA LYS A 89 2.904 15.921 -6.433 1.00 0.00 C ATOM 1292 C LYS A 89 1.539 16.582 -6.216 1.00 0.00 C ATOM 1293 O LYS A 89 0.531 15.882 -6.070 1.00 0.00 O ATOM 1294 CB LYS A 89 3.234 15.803 -7.941 1.00 0.00 C ATOM 1295 CG LYS A 89 3.696 17.115 -8.622 1.00 0.00 C ATOM 1296 CD LYS A 89 3.098 17.296 -10.029 1.00 0.00 C ATOM 1297 CE LYS A 89 3.195 18.742 -10.548 1.00 0.00 C ATOM 1298 NZ LYS A 89 4.354 18.995 -11.430 1.00 0.00 N ATOM 0 H LYS A 89 1.972 14.089 -6.179 1.00 0.00 H new ATOM 0 HA LYS A 89 3.688 16.516 -5.965 1.00 0.00 H new ATOM 0 HB2 LYS A 89 4.015 15.053 -8.068 1.00 0.00 H new ATOM 0 HB3 LYS A 89 2.350 15.434 -8.462 1.00 0.00 H new ATOM 0 HG2 LYS A 89 3.411 17.963 -7.999 1.00 0.00 H new ATOM 0 HG3 LYS A 89 4.784 17.121 -8.690 1.00 0.00 H new ATOM 0 HD2 LYS A 89 3.613 16.632 -10.724 1.00 0.00 H new ATOM 0 HD3 LYS A 89 2.051 16.992 -10.014 1.00 0.00 H new ATOM 0 HE2 LYS A 89 2.281 18.983 -11.091 1.00 0.00 H new ATOM 0 HE3 LYS A 89 3.247 19.419 -9.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 4.301 19.964 -11.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 5.234 18.880 -10.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 4.343 18.319 -12.220 1.00 0.00 H new ATOM 1312 N PHE A 90 1.464 17.907 -6.271 1.00 0.00 N ATOM 1313 CA PHE A 90 0.227 18.643 -6.510 1.00 0.00 C ATOM 1314 C PHE A 90 0.487 19.611 -7.663 1.00 0.00 C ATOM 1315 O PHE A 90 1.629 19.722 -8.118 1.00 0.00 O ATOM 1316 CB PHE A 90 -0.287 19.311 -5.224 1.00 0.00 C ATOM 1317 CG PHE A 90 0.390 20.598 -4.787 1.00 0.00 C ATOM 1318 CD1 PHE A 90 1.736 20.597 -4.377 1.00 0.00 C ATOM 1319 CD2 PHE A 90 -0.345 21.797 -4.735 1.00 0.00 C ATOM 1320 CE1 PHE A 90 2.346 21.790 -3.952 1.00 0.00 C ATOM 1321 CE2 PHE A 90 0.259 22.980 -4.278 1.00 0.00 C ATOM 1322 CZ PHE A 90 1.609 22.984 -3.899 1.00 0.00 C ATOM 0 H PHE A 90 2.276 18.512 -6.148 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.584 17.975 -6.801 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -1.350 19.516 -5.353 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.198 18.590 -4.411 1.00 0.00 H new ATOM 0 HD1 PHE A 90 2.302 19.677 -4.389 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.379 21.808 -5.048 1.00 0.00 H new ATOM 0 HE1 PHE A 90 3.387 21.788 -3.665 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.319 23.890 -4.218 1.00 0.00 H new ATOM 0 HZ PHE A 90 2.079 23.899 -3.569 1.00 0.00 H new ATOM 1332 N GLN A 91 -0.546 20.253 -8.202 1.00 0.00 N ATOM 1333 CA GLN A 91 -0.384 21.291 -9.211 1.00 0.00 C ATOM 1334 C GLN A 91 -1.541 22.261 -8.990 1.00 0.00 C ATOM 1335 O GLN A 91 -2.630 21.830 -8.602 1.00 0.00 O ATOM 1336 CB GLN A 91 -0.370 20.641 -10.609 1.00 0.00 C ATOM 1337 CG GLN A 91 0.264 21.502 -11.705 1.00 0.00 C ATOM 1338 CD GLN A 91 0.534 20.682 -12.972 1.00 0.00 C ATOM 1339 OE1 GLN A 91 -0.286 19.893 -13.446 1.00 0.00 O ATOM 1340 NE2 GLN A 91 1.735 20.772 -13.512 1.00 0.00 N ATOM 0 H GLN A 91 -1.517 20.067 -7.951 1.00 0.00 H new ATOM 0 HA GLN A 91 0.557 21.836 -9.135 1.00 0.00 H new ATOM 0 HB2 GLN A 91 0.169 19.695 -10.550 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -1.395 20.406 -10.897 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -0.396 22.336 -11.943 1.00 0.00 H new ATOM 0 HG3 GLN A 91 1.198 21.929 -11.340 1.00 0.00 H new ATOM 0 HE21 GLN A 91 2.420 21.422 -13.127 1.00 0.00 H new ATOM 0 HE22 GLN A 91 1.978 20.192 -14.315 1.00 0.00 H new ATOM 1349 N THR A 92 -1.310 23.546 -9.193 1.00 0.00 N ATOM 1350 CA THR A 92 -2.162 24.621 -8.734 1.00 0.00 C ATOM 1351 C THR A 92 -2.614 25.387 -9.965 1.00 0.00 C ATOM 1352 O THR A 92 -1.828 25.704 -10.856 1.00 0.00 O ATOM 1353 CB THR A 92 -1.387 25.465 -7.715 1.00 0.00 C ATOM 1354 OG1 THR A 92 -1.073 24.668 -6.595 1.00 0.00 O ATOM 1355 CG2 THR A 92 -2.175 26.677 -7.232 1.00 0.00 C ATOM 0 H THR A 92 -0.491 23.879 -9.702 1.00 0.00 H new ATOM 0 HA THR A 92 -3.055 24.272 -8.215 1.00 0.00 H new ATOM 0 HB THR A 92 -0.489 25.825 -8.217 1.00 0.00 H new ATOM 0 HG1 THR A 92 -1.834 24.088 -6.383 1.00 0.00 H new ATOM 0 HG21 THR A 92 -1.577 27.237 -6.513 1.00 0.00 H new ATOM 0 HG22 THR A 92 -2.415 27.317 -8.081 1.00 0.00 H new ATOM 0 HG23 THR A 92 -3.098 26.345 -6.756 1.00 0.00 H new ATOM 1363 N THR A 93 -3.911 25.643 -10.012 1.00 0.00 N ATOM 1364 CA THR A 93 -4.654 26.006 -11.206 1.00 0.00 C ATOM 1365 C THR A 93 -5.540 27.222 -10.906 1.00 0.00 C ATOM 1366 O THR A 93 -6.637 27.327 -11.452 1.00 0.00 O ATOM 1367 CB THR A 93 -5.378 24.729 -11.713 1.00 0.00 C ATOM 1368 OG1 THR A 93 -6.276 24.954 -12.786 1.00 0.00 O ATOM 1369 CG2 THR A 93 -6.157 23.970 -10.628 1.00 0.00 C ATOM 0 H THR A 93 -4.501 25.601 -9.181 1.00 0.00 H new ATOM 0 HA THR A 93 -4.021 26.339 -12.028 1.00 0.00 H new ATOM 0 HB THR A 93 -4.539 24.123 -12.056 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.718 25.820 -12.666 1.00 0.00 H new ATOM 0 HG21 THR A 93 -6.632 23.093 -11.067 1.00 0.00 H new ATOM 0 HG22 THR A 93 -5.472 23.656 -9.841 1.00 0.00 H new ATOM 0 HG23 THR A 93 -6.921 24.622 -10.205 1.00 0.00 H new ATOM 1377 N GLU A 94 -5.122 28.133 -10.026 1.00 0.00 N ATOM 1378 CA GLU A 94 -5.937 29.300 -9.691 1.00 0.00 C ATOM 1379 C GLU A 94 -5.040 30.472 -9.300 1.00 0.00 C ATOM 1380 O GLU A 94 -5.194 31.566 -9.835 1.00 0.00 O ATOM 1381 CB GLU A 94 -6.963 28.908 -8.607 1.00 0.00 C ATOM 1382 CG GLU A 94 -8.274 29.704 -8.702 1.00 0.00 C ATOM 1383 CD GLU A 94 -9.456 28.862 -8.208 1.00 0.00 C ATOM 1384 OE1 GLU A 94 -9.485 28.484 -7.026 1.00 0.00 O ATOM 1385 OE2 GLU A 94 -10.330 28.510 -9.038 1.00 0.00 O ATOM 0 H GLU A 94 -4.229 28.086 -9.535 1.00 0.00 H new ATOM 0 HA GLU A 94 -6.507 29.638 -10.557 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -7.184 27.844 -8.692 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -6.521 29.064 -7.623 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -8.196 30.615 -8.108 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -8.445 30.010 -9.734 1.00 0.00 H new ATOM 1392 N TYR A 95 -4.053 30.245 -8.428 1.00 0.00 N ATOM 1393 CA TYR A 95 -3.018 31.243 -8.180 1.00 0.00 C ATOM 1394 C TYR A 95 -2.120 31.409 -9.421 1.00 0.00 C ATOM 1395 O TYR A 95 -1.925 30.450 -10.175 1.00 0.00 O ATOM 1396 CB TYR A 95 -2.198 30.832 -6.948 1.00 0.00 C ATOM 1397 CG TYR A 95 -2.809 31.100 -5.578 1.00 0.00 C ATOM 1398 CD1 TYR A 95 -4.140 31.545 -5.412 1.00 0.00 C ATOM 1399 CD2 TYR A 95 -1.994 30.926 -4.443 1.00 0.00 C ATOM 1400 CE1 TYR A 95 -4.637 31.831 -4.129 1.00 0.00 C ATOM 1401 CE2 TYR A 95 -2.482 31.214 -3.156 1.00 0.00 C ATOM 1402 CZ TYR A 95 -3.807 31.678 -2.996 1.00 0.00 C ATOM 1403 OH TYR A 95 -4.292 31.987 -1.763 1.00 0.00 O ATOM 0 H TYR A 95 -3.952 29.386 -7.888 1.00 0.00 H new ATOM 0 HA TYR A 95 -3.484 32.208 -7.982 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -1.991 29.764 -7.022 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -1.238 31.346 -6.995 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -4.778 31.666 -6.275 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -0.982 30.567 -4.562 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -5.656 32.169 -4.009 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -1.846 31.081 -2.293 1.00 0.00 H new ATOM 0 HH TYR A 95 -3.599 31.826 -1.089 1.00 0.00 H new ATOM 1413 N PRO A 96 -1.497 32.592 -9.615 1.00 0.00 N ATOM 1414 CA PRO A 96 -0.640 32.870 -10.768 1.00 0.00 C ATOM 1415 C PRO A 96 0.665 32.060 -10.759 1.00 0.00 C ATOM 1416 O PRO A 96 1.403 32.072 -11.742 1.00 0.00 O ATOM 1417 CB PRO A 96 -0.374 34.380 -10.723 1.00 0.00 C ATOM 1418 CG PRO A 96 -0.485 34.713 -9.237 1.00 0.00 C ATOM 1419 CD PRO A 96 -1.596 33.775 -8.769 1.00 0.00 C ATOM 0 HA PRO A 96 -1.132 32.570 -11.693 1.00 0.00 H new ATOM 0 HB2 PRO A 96 0.612 34.627 -11.118 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -1.102 34.934 -11.315 1.00 0.00 H new ATOM 0 HG2 PRO A 96 0.451 34.529 -8.709 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -0.742 35.760 -9.074 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -1.472 33.516 -7.718 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -2.574 34.246 -8.868 1.00 0.00 H new ATOM 1427 N THR A 97 0.954 31.331 -9.681 1.00 0.00 N ATOM 1428 CA THR A 97 2.057 30.393 -9.555 1.00 0.00 C ATOM 1429 C THR A 97 1.901 29.154 -10.454 1.00 0.00 C ATOM 1430 O THR A 97 2.755 28.284 -10.368 1.00 0.00 O ATOM 1431 CB THR A 97 2.193 30.010 -8.067 1.00 0.00 C ATOM 1432 OG1 THR A 97 0.915 29.843 -7.484 1.00 0.00 O ATOM 1433 CG2 THR A 97 2.920 31.105 -7.280 1.00 0.00 C ATOM 0 H THR A 97 0.393 31.386 -8.831 1.00 0.00 H new ATOM 0 HA THR A 97 2.970 30.876 -9.902 1.00 0.00 H new ATOM 0 HB THR A 97 2.761 29.081 -8.024 1.00 0.00 H new ATOM 0 HG1 THR A 97 1.015 29.598 -6.540 1.00 0.00 H new ATOM 0 HG21 THR A 97 3.002 30.808 -6.234 1.00 0.00 H new ATOM 0 HG22 THR A 97 3.917 31.250 -7.695 1.00 0.00 H new ATOM 0 HG23 THR A 97 2.359 32.037 -7.350 1.00 0.00 H new ATOM 1441 N TYR A 98 0.881 29.079 -11.327 1.00 0.00 N ATOM 1442 CA TYR A 98 0.470 27.989 -12.229 1.00 0.00 C ATOM 1443 C TYR A 98 1.562 26.990 -12.651 1.00 0.00 C ATOM 1444 O TYR A 98 1.298 25.793 -12.744 1.00 0.00 O ATOM 1445 CB TYR A 98 -0.186 28.614 -13.474 1.00 0.00 C ATOM 1446 CG TYR A 98 -0.948 27.641 -14.363 1.00 0.00 C ATOM 1447 CD1 TYR A 98 -0.260 26.758 -15.223 1.00 0.00 C ATOM 1448 CD2 TYR A 98 -2.357 27.619 -14.333 1.00 0.00 C ATOM 1449 CE1 TYR A 98 -0.967 25.838 -16.015 1.00 0.00 C ATOM 1450 CE2 TYR A 98 -3.073 26.721 -15.145 1.00 0.00 C ATOM 1451 CZ TYR A 98 -2.378 25.823 -15.987 1.00 0.00 C ATOM 1452 OH TYR A 98 -3.047 24.954 -16.794 1.00 0.00 O ATOM 0 H TYR A 98 0.251 29.875 -11.429 1.00 0.00 H new ATOM 0 HA TYR A 98 -0.222 27.378 -11.650 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -0.871 29.397 -13.149 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.589 29.095 -14.070 1.00 0.00 H new ATOM 0 HD1 TYR A 98 0.818 26.790 -15.272 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -2.890 28.296 -13.682 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -0.431 25.143 -16.645 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -4.153 26.718 -15.125 1.00 0.00 H new ATOM 0 HH TYR A 98 -4.012 25.061 -16.661 1.00 0.00 H new ATOM 1462 N LYS A 99 2.786 27.441 -12.919 1.00 0.00 N ATOM 1463 CA LYS A 99 3.958 26.594 -13.119 1.00 0.00 C ATOM 1464 C LYS A 99 4.569 26.268 -11.739 1.00 0.00 C ATOM 1465 O LYS A 99 5.703 26.667 -11.464 1.00 0.00 O ATOM 1466 CB LYS A 99 4.861 27.356 -14.117 1.00 0.00 C ATOM 1467 CG LYS A 99 5.987 26.584 -14.831 1.00 0.00 C ATOM 1468 CD LYS A 99 7.315 26.566 -14.059 1.00 0.00 C ATOM 1469 CE LYS A 99 8.553 26.600 -14.965 1.00 0.00 C ATOM 1470 NZ LYS A 99 8.708 25.401 -15.813 1.00 0.00 N ATOM 0 H LYS A 99 2.995 28.436 -13.005 1.00 0.00 H new ATOM 0 HA LYS A 99 3.757 25.616 -13.556 1.00 0.00 H new ATOM 0 HB2 LYS A 99 4.217 27.786 -14.884 1.00 0.00 H new ATOM 0 HB3 LYS A 99 5.318 28.188 -13.581 1.00 0.00 H new ATOM 0 HG2 LYS A 99 5.661 25.557 -14.998 1.00 0.00 H new ATOM 0 HG3 LYS A 99 6.154 27.029 -15.812 1.00 0.00 H new ATOM 0 HD2 LYS A 99 7.345 27.422 -13.385 1.00 0.00 H new ATOM 0 HD3 LYS A 99 7.353 25.670 -13.439 1.00 0.00 H new ATOM 0 HE2 LYS A 99 8.499 27.481 -15.605 1.00 0.00 H new ATOM 0 HE3 LYS A 99 9.442 26.711 -14.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 9.564 25.496 -16.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 8.792 24.558 -15.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 7.877 25.303 -16.431 1.00 0.00 H new ATOM 1484 N ASN A 100 3.870 25.524 -10.866 1.00 0.00 N ATOM 1485 CA ASN A 100 4.297 25.151 -9.520 1.00 0.00 C ATOM 1486 C ASN A 100 4.430 23.635 -9.528 1.00 0.00 C ATOM 1487 O ASN A 100 3.450 22.905 -9.688 1.00 0.00 O ATOM 1488 CB ASN A 100 3.336 25.627 -8.408 1.00 0.00 C ATOM 1489 CG ASN A 100 3.925 25.374 -7.022 1.00 0.00 C ATOM 1490 OD1 ASN A 100 4.677 24.428 -6.819 1.00 0.00 O ATOM 1491 ND2 ASN A 100 3.661 26.209 -6.034 1.00 0.00 N ATOM 0 H ASN A 100 2.949 25.152 -11.097 1.00 0.00 H new ATOM 0 HA ASN A 100 5.240 25.644 -9.284 1.00 0.00 H new ATOM 0 HB2 ASN A 100 3.132 26.691 -8.531 1.00 0.00 H new ATOM 0 HB3 ASN A 100 2.382 25.107 -8.501 1.00 0.00 H new ATOM 0 HD21 ASN A 100 4.081 26.062 -5.116 1.00 0.00 H new ATOM 0 HD22 ASN A 100 3.037 27.001 -6.188 1.00 0.00 H new ATOM 1498 N ASP A 101 5.660 23.144 -9.472 1.00 0.00 N ATOM 1499 CA ASP A 101 5.954 21.735 -9.196 1.00 0.00 C ATOM 1500 C ASP A 101 6.690 21.589 -7.878 1.00 0.00 C ATOM 1501 O ASP A 101 7.542 22.407 -7.531 1.00 0.00 O ATOM 1502 CB ASP A 101 6.732 21.024 -10.319 1.00 0.00 C ATOM 1503 CG ASP A 101 8.079 21.643 -10.686 1.00 0.00 C ATOM 1504 OD1 ASP A 101 9.098 21.378 -10.018 1.00 0.00 O ATOM 1505 OD2 ASP A 101 8.109 22.331 -11.736 1.00 0.00 O ATOM 0 H ASP A 101 6.493 23.714 -9.618 1.00 0.00 H new ATOM 0 HA ASP A 101 4.985 21.240 -9.137 1.00 0.00 H new ATOM 0 HB2 ASP A 101 6.898 19.989 -10.022 1.00 0.00 H new ATOM 0 HB3 ASP A 101 6.107 21.003 -11.212 1.00 0.00 H new ATOM 1510 N THR A 102 6.357 20.519 -7.160 1.00 0.00 N ATOM 1511 CA THR A 102 7.017 20.072 -5.951 1.00 0.00 C ATOM 1512 C THR A 102 7.129 18.553 -6.036 1.00 0.00 C ATOM 1513 O THR A 102 6.357 17.893 -6.745 1.00 0.00 O ATOM 1514 CB THR A 102 6.210 20.502 -4.713 1.00 0.00 C ATOM 1515 OG1 THR A 102 4.921 19.925 -4.736 1.00 0.00 O ATOM 1516 CG2 THR A 102 6.066 22.019 -4.620 1.00 0.00 C ATOM 0 H THR A 102 5.579 19.915 -7.425 1.00 0.00 H new ATOM 0 HA THR A 102 8.007 20.517 -5.857 1.00 0.00 H new ATOM 0 HB THR A 102 6.763 20.151 -3.842 1.00 0.00 H new ATOM 0 HG1 THR A 102 4.245 20.634 -4.710 1.00 0.00 H new ATOM 0 HG21 THR A 102 5.490 22.276 -3.731 1.00 0.00 H new ATOM 0 HG22 THR A 102 7.054 22.475 -4.556 1.00 0.00 H new ATOM 0 HG23 THR A 102 5.551 22.391 -5.506 1.00 0.00 H new ATOM 1524 N SER A 103 8.068 17.990 -5.286 1.00 0.00 N ATOM 1525 CA SER A 103 8.400 16.583 -5.319 1.00 0.00 C ATOM 1526 C SER A 103 8.783 16.197 -3.894 1.00 0.00 C ATOM 1527 O SER A 103 9.816 16.645 -3.395 1.00 0.00 O ATOM 1528 CB SER A 103 9.515 16.388 -6.361 1.00 0.00 C ATOM 1529 OG SER A 103 9.034 16.616 -7.683 1.00 0.00 O ATOM 0 H SER A 103 8.632 18.520 -4.621 1.00 0.00 H new ATOM 0 HA SER A 103 7.581 15.932 -5.626 1.00 0.00 H new ATOM 0 HB2 SER A 103 10.338 17.071 -6.148 1.00 0.00 H new ATOM 0 HB3 SER A 103 9.913 15.376 -6.286 1.00 0.00 H new ATOM 0 HG SER A 103 9.764 16.487 -8.324 1.00 0.00 H new ATOM 1535 N ASP A 104 7.891 15.469 -3.215 1.00 0.00 N ATOM 1536 CA ASP A 104 8.025 15.085 -1.811 1.00 0.00 C ATOM 1537 C ASP A 104 7.798 13.580 -1.725 1.00 0.00 C ATOM 1538 O ASP A 104 6.759 13.098 -2.203 1.00 0.00 O ATOM 1539 CB ASP A 104 6.968 15.780 -0.931 1.00 0.00 C ATOM 1540 CG ASP A 104 7.354 17.168 -0.427 1.00 0.00 C ATOM 1541 OD1 ASP A 104 7.975 17.249 0.654 1.00 0.00 O ATOM 1542 OD2 ASP A 104 6.918 18.178 -1.043 1.00 0.00 O ATOM 0 H ASP A 104 7.032 15.122 -3.642 1.00 0.00 H new ATOM 0 HA ASP A 104 9.013 15.377 -1.456 1.00 0.00 H new ATOM 0 HB2 ASP A 104 6.042 15.862 -1.500 1.00 0.00 H new ATOM 0 HB3 ASP A 104 6.759 15.144 -0.071 1.00 0.00 H new ATOM 1547 N TYR A 105 8.711 12.854 -1.079 1.00 0.00 N ATOM 1548 CA TYR A 105 8.481 11.474 -0.667 1.00 0.00 C ATOM 1549 C TYR A 105 7.937 11.461 0.769 1.00 0.00 C ATOM 1550 O TYR A 105 8.138 12.406 1.541 1.00 0.00 O ATOM 1551 CB TYR A 105 9.771 10.638 -0.802 1.00 0.00 C ATOM 1552 CG TYR A 105 10.796 10.834 0.304 1.00 0.00 C ATOM 1553 CD1 TYR A 105 10.716 10.061 1.480 1.00 0.00 C ATOM 1554 CD2 TYR A 105 11.814 11.798 0.173 1.00 0.00 C ATOM 1555 CE1 TYR A 105 11.608 10.287 2.542 1.00 0.00 C ATOM 1556 CE2 TYR A 105 12.712 12.032 1.232 1.00 0.00 C ATOM 1557 CZ TYR A 105 12.601 11.284 2.425 1.00 0.00 C ATOM 1558 OH TYR A 105 13.423 11.544 3.477 1.00 0.00 O ATOM 0 H TYR A 105 9.633 13.210 -0.827 1.00 0.00 H new ATOM 0 HA TYR A 105 7.740 11.015 -1.322 1.00 0.00 H new ATOM 0 HB2 TYR A 105 9.498 9.583 -0.838 1.00 0.00 H new ATOM 0 HB3 TYR A 105 10.241 10.878 -1.756 1.00 0.00 H new ATOM 0 HD1 TYR A 105 9.964 9.290 1.565 1.00 0.00 H new ATOM 0 HD2 TYR A 105 11.906 12.361 -0.744 1.00 0.00 H new ATOM 0 HE1 TYR A 105 11.534 9.700 3.445 1.00 0.00 H new ATOM 0 HE2 TYR A 105 13.483 12.781 1.132 1.00 0.00 H new ATOM 0 HH TYR A 105 14.051 12.256 3.233 1.00 0.00 H new ATOM 1568 N GLY A 106 7.296 10.363 1.161 1.00 0.00 N ATOM 1569 CA GLY A 106 6.887 10.080 2.526 1.00 0.00 C ATOM 1570 C GLY A 106 7.136 8.609 2.793 1.00 0.00 C ATOM 1571 O GLY A 106 6.774 7.779 1.963 1.00 0.00 O ATOM 0 H GLY A 106 7.040 9.621 0.510 1.00 0.00 H new ATOM 0 HA2 GLY A 106 7.450 10.695 3.228 1.00 0.00 H new ATOM 0 HA3 GLY A 106 5.833 10.320 2.666 1.00 0.00 H new ATOM 1575 N PHE A 107 7.779 8.272 3.909 1.00 0.00 N ATOM 1576 CA PHE A 107 8.141 6.890 4.213 1.00 0.00 C ATOM 1577 C PHE A 107 6.873 6.154 4.655 1.00 0.00 C ATOM 1578 O PHE A 107 6.184 6.640 5.559 1.00 0.00 O ATOM 1579 CB PHE A 107 9.237 6.891 5.290 1.00 0.00 C ATOM 1580 CG PHE A 107 10.170 5.691 5.281 1.00 0.00 C ATOM 1581 CD1 PHE A 107 9.704 4.400 5.602 1.00 0.00 C ATOM 1582 CD2 PHE A 107 11.533 5.876 4.973 1.00 0.00 C ATOM 1583 CE1 PHE A 107 10.592 3.309 5.608 1.00 0.00 C ATOM 1584 CE2 PHE A 107 12.421 4.786 4.989 1.00 0.00 C ATOM 1585 CZ PHE A 107 11.951 3.500 5.305 1.00 0.00 C ATOM 0 H PHE A 107 8.062 8.944 4.623 1.00 0.00 H new ATOM 0 HA PHE A 107 8.545 6.371 3.343 1.00 0.00 H new ATOM 0 HB2 PHE A 107 9.835 7.794 5.173 1.00 0.00 H new ATOM 0 HB3 PHE A 107 8.760 6.950 6.268 1.00 0.00 H new ATOM 0 HD1 PHE A 107 8.662 4.248 5.844 1.00 0.00 H new ATOM 0 HD2 PHE A 107 11.898 6.861 4.723 1.00 0.00 H new ATOM 0 HE1 PHE A 107 10.228 2.321 5.846 1.00 0.00 H new ATOM 0 HE2 PHE A 107 13.465 4.937 4.758 1.00 0.00 H new ATOM 0 HZ PHE A 107 12.632 2.661 5.315 1.00 0.00 H new ATOM 1595 N SER A 108 6.542 5.025 4.032 1.00 0.00 N ATOM 1596 CA SER A 108 5.383 4.207 4.377 1.00 0.00 C ATOM 1597 C SER A 108 5.829 3.143 5.378 1.00 0.00 C ATOM 1598 O SER A 108 6.855 2.487 5.164 1.00 0.00 O ATOM 1599 CB SER A 108 4.816 3.536 3.119 1.00 0.00 C ATOM 1600 OG SER A 108 4.761 4.454 2.041 1.00 0.00 O ATOM 0 H SER A 108 7.085 4.646 3.256 1.00 0.00 H new ATOM 0 HA SER A 108 4.603 4.831 4.813 1.00 0.00 H new ATOM 0 HB2 SER A 108 5.437 2.683 2.845 1.00 0.00 H new ATOM 0 HB3 SER A 108 3.818 3.150 3.326 1.00 0.00 H new ATOM 0 HG SER A 108 4.398 4.006 1.248 1.00 0.00 H new ATOM 1606 N TYR A 109 5.094 2.984 6.477 1.00 0.00 N ATOM 1607 CA TYR A 109 5.319 1.918 7.443 1.00 0.00 C ATOM 1608 C TYR A 109 3.953 1.517 8.003 1.00 0.00 C ATOM 1609 O TYR A 109 3.119 2.379 8.320 1.00 0.00 O ATOM 1610 CB TYR A 109 6.342 2.401 8.482 1.00 0.00 C ATOM 1611 CG TYR A 109 6.490 1.590 9.754 1.00 0.00 C ATOM 1612 CD1 TYR A 109 6.684 0.195 9.705 1.00 0.00 C ATOM 1613 CD2 TYR A 109 6.498 2.254 10.997 1.00 0.00 C ATOM 1614 CE1 TYR A 109 6.880 -0.532 10.892 1.00 0.00 C ATOM 1615 CE2 TYR A 109 6.705 1.536 12.185 1.00 0.00 C ATOM 1616 CZ TYR A 109 6.892 0.137 12.139 1.00 0.00 C ATOM 1617 OH TYR A 109 7.044 -0.566 13.294 1.00 0.00 O ATOM 0 H TYR A 109 4.318 3.600 6.722 1.00 0.00 H new ATOM 0 HA TYR A 109 5.756 1.019 7.009 1.00 0.00 H new ATOM 0 HB2 TYR A 109 7.317 2.445 7.997 1.00 0.00 H new ATOM 0 HB3 TYR A 109 6.079 3.421 8.763 1.00 0.00 H new ATOM 0 HD1 TYR A 109 6.682 -0.316 8.754 1.00 0.00 H new ATOM 0 HD2 TYR A 109 6.344 3.322 11.036 1.00 0.00 H new ATOM 0 HE1 TYR A 109 7.022 -1.602 10.852 1.00 0.00 H new ATOM 0 HE2 TYR A 109 6.721 2.053 13.133 1.00 0.00 H new ATOM 0 HH TYR A 109 7.030 0.050 14.056 1.00 0.00 H new ATOM 1627 N GLY A 110 3.697 0.210 8.058 1.00 0.00 N ATOM 1628 CA GLY A 110 2.372 -0.380 8.153 1.00 0.00 C ATOM 1629 C GLY A 110 2.454 -1.865 8.489 1.00 0.00 C ATOM 1630 O GLY A 110 3.531 -2.388 8.779 1.00 0.00 O ATOM 0 H GLY A 110 4.439 -0.489 8.036 1.00 0.00 H new ATOM 0 HA2 GLY A 110 1.794 0.138 8.919 1.00 0.00 H new ATOM 0 HA3 GLY A 110 1.843 -0.246 7.210 1.00 0.00 H new ATOM 1634 N ALA A 111 1.317 -2.558 8.445 1.00 0.00 N ATOM 1635 CA ALA A 111 1.232 -3.995 8.676 1.00 0.00 C ATOM 1636 C ALA A 111 0.297 -4.646 7.662 1.00 0.00 C ATOM 1637 O ALA A 111 -0.551 -3.966 7.081 1.00 0.00 O ATOM 1638 CB ALA A 111 0.782 -4.270 10.112 1.00 0.00 C ATOM 0 H ALA A 111 0.415 -2.127 8.244 1.00 0.00 H new ATOM 0 HA ALA A 111 2.220 -4.436 8.542 1.00 0.00 H new ATOM 0 HB1 ALA A 111 0.722 -5.346 10.275 1.00 0.00 H new ATOM 0 HB2 ALA A 111 1.501 -3.838 10.808 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -0.198 -3.822 10.278 1.00 0.00 H new ATOM 1644 N GLY A 112 0.467 -5.956 7.464 1.00 0.00 N ATOM 1645 CA GLY A 112 -0.141 -6.724 6.391 1.00 0.00 C ATOM 1646 C GLY A 112 -0.730 -8.027 6.908 1.00 0.00 C ATOM 1647 O GLY A 112 0.005 -8.987 7.177 1.00 0.00 O ATOM 0 H GLY A 112 1.055 -6.525 8.073 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -0.923 -6.132 5.916 1.00 0.00 H new ATOM 0 HA3 GLY A 112 0.606 -6.938 5.626 1.00 0.00 H new ATOM 1651 N LEU A 113 -2.057 -8.075 7.019 1.00 0.00 N ATOM 1652 CA LEU A 113 -2.814 -9.116 7.700 1.00 0.00 C ATOM 1653 C LEU A 113 -3.635 -9.850 6.636 1.00 0.00 C ATOM 1654 O LEU A 113 -4.075 -9.233 5.660 1.00 0.00 O ATOM 1655 CB LEU A 113 -3.782 -8.483 8.726 1.00 0.00 C ATOM 1656 CG LEU A 113 -3.220 -7.876 10.032 1.00 0.00 C ATOM 1657 CD1 LEU A 113 -2.580 -8.931 10.938 1.00 0.00 C ATOM 1658 CD2 LEU A 113 -2.231 -6.721 9.829 1.00 0.00 C ATOM 0 H LEU A 113 -2.658 -7.355 6.617 1.00 0.00 H new ATOM 0 HA LEU A 113 -2.139 -9.793 8.224 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -4.334 -7.696 8.212 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -4.506 -9.248 9.007 1.00 0.00 H new ATOM 0 HG LEU A 113 -4.103 -7.461 10.518 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -2.201 -8.453 11.841 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -3.325 -9.679 11.208 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -1.757 -9.413 10.410 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -1.890 -6.359 10.799 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.376 -7.072 9.252 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -2.724 -5.910 9.292 1.00 0.00 H new ATOM 1670 N GLN A 114 -3.875 -11.147 6.833 1.00 0.00 N ATOM 1671 CA GLN A 114 -4.728 -11.969 5.977 1.00 0.00 C ATOM 1672 C GLN A 114 -5.764 -12.675 6.847 1.00 0.00 C ATOM 1673 O GLN A 114 -5.606 -12.758 8.071 1.00 0.00 O ATOM 1674 CB GLN A 114 -3.900 -12.896 5.059 1.00 0.00 C ATOM 1675 CG GLN A 114 -2.969 -13.931 5.721 1.00 0.00 C ATOM 1676 CD GLN A 114 -3.575 -15.332 5.858 1.00 0.00 C ATOM 1677 OE1 GLN A 114 -4.637 -15.507 6.441 1.00 0.00 O ATOM 1678 NE2 GLN A 114 -2.895 -16.371 5.393 1.00 0.00 N ATOM 0 H GLN A 114 -3.471 -11.667 7.612 1.00 0.00 H new ATOM 0 HA GLN A 114 -5.279 -11.344 5.275 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -4.595 -13.436 4.416 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -3.291 -12.266 4.411 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -2.051 -14.001 5.138 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -2.691 -13.570 6.711 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -2.010 -16.225 4.907 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -3.257 -17.316 5.521 1.00 0.00 H new ATOM 1687 N PHE A 115 -6.850 -13.107 6.221 1.00 0.00 N ATOM 1688 CA PHE A 115 -8.044 -13.657 6.842 1.00 0.00 C ATOM 1689 C PHE A 115 -8.414 -14.924 6.060 1.00 0.00 C ATOM 1690 O PHE A 115 -7.991 -15.067 4.910 1.00 0.00 O ATOM 1691 CB PHE A 115 -9.100 -12.542 6.778 1.00 0.00 C ATOM 1692 CG PHE A 115 -10.428 -12.792 7.460 1.00 0.00 C ATOM 1693 CD1 PHE A 115 -10.559 -12.554 8.840 1.00 0.00 C ATOM 1694 CD2 PHE A 115 -11.552 -13.182 6.709 1.00 0.00 C ATOM 1695 CE1 PHE A 115 -11.801 -12.727 9.474 1.00 0.00 C ATOM 1696 CE2 PHE A 115 -12.800 -13.334 7.339 1.00 0.00 C ATOM 1697 CZ PHE A 115 -12.923 -13.113 8.721 1.00 0.00 C ATOM 0 H PHE A 115 -6.924 -13.081 5.204 1.00 0.00 H new ATOM 0 HA PHE A 115 -7.930 -13.953 7.885 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -8.664 -11.642 7.212 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -9.297 -12.327 5.728 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -9.701 -12.237 9.415 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -11.456 -13.365 5.649 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -11.893 -12.564 10.538 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -13.665 -13.621 6.760 1.00 0.00 H new ATOM 0 HZ PHE A 115 -13.880 -13.240 9.205 1.00 0.00 H new ATOM 1707 N ASN A 116 -9.193 -15.828 6.665 1.00 0.00 N ATOM 1708 CA ASN A 116 -9.257 -17.242 6.275 1.00 0.00 C ATOM 1709 C ASN A 116 -9.634 -17.371 4.784 1.00 0.00 C ATOM 1710 O ASN A 116 -10.731 -16.938 4.411 1.00 0.00 O ATOM 1711 CB ASN A 116 -10.271 -18.023 7.142 1.00 0.00 C ATOM 1712 CG ASN A 116 -9.726 -18.592 8.452 1.00 0.00 C ATOM 1713 OD1 ASN A 116 -8.526 -18.671 8.690 1.00 0.00 O ATOM 1714 ND2 ASN A 116 -10.601 -19.055 9.334 1.00 0.00 N ATOM 0 H ASN A 116 -9.804 -15.596 7.448 1.00 0.00 H new ATOM 0 HA ASN A 116 -8.269 -17.674 6.436 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -11.106 -17.363 7.374 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -10.670 -18.846 6.549 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -10.274 -19.474 10.205 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -11.601 -18.992 9.142 1.00 0.00 H new ATOM 1721 N PRO A 117 -8.729 -17.893 3.929 1.00 0.00 N ATOM 1722 CA PRO A 117 -8.856 -17.858 2.473 1.00 0.00 C ATOM 1723 C PRO A 117 -9.725 -18.986 1.908 1.00 0.00 C ATOM 1724 O PRO A 117 -10.080 -19.929 2.616 1.00 0.00 O ATOM 1725 CB PRO A 117 -7.422 -18.004 1.967 1.00 0.00 C ATOM 1726 CG PRO A 117 -6.778 -18.915 3.009 1.00 0.00 C ATOM 1727 CD PRO A 117 -7.419 -18.416 4.298 1.00 0.00 C ATOM 0 HA PRO A 117 -9.348 -16.939 2.155 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -7.389 -18.445 0.971 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -6.916 -17.040 1.906 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -6.997 -19.967 2.824 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -5.693 -18.814 3.026 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -7.513 -19.224 5.023 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -6.808 -17.642 4.762 1.00 0.00 H new ATOM 1735 N MET A 118 -10.015 -18.899 0.608 1.00 0.00 N ATOM 1736 CA MET A 118 -10.845 -19.807 -0.171 1.00 0.00 C ATOM 1737 C MET A 118 -10.278 -19.900 -1.600 1.00 0.00 C ATOM 1738 O MET A 118 -9.330 -19.205 -1.966 1.00 0.00 O ATOM 1739 CB MET A 118 -12.283 -19.261 -0.154 1.00 0.00 C ATOM 1740 CG MET A 118 -13.108 -19.752 1.040 1.00 0.00 C ATOM 1741 SD MET A 118 -14.437 -18.609 1.498 1.00 0.00 S ATOM 1742 CE MET A 118 -13.476 -17.453 2.504 1.00 0.00 C ATOM 0 H MET A 118 -9.648 -18.138 0.037 1.00 0.00 H new ATOM 0 HA MET A 118 -10.849 -20.813 0.247 1.00 0.00 H new ATOM 0 HB2 MET A 118 -12.250 -18.172 -0.139 1.00 0.00 H new ATOM 0 HB3 MET A 118 -12.785 -19.552 -1.077 1.00 0.00 H new ATOM 0 HG2 MET A 118 -13.538 -20.725 0.802 1.00 0.00 H new ATOM 0 HG3 MET A 118 -12.449 -19.896 1.896 1.00 0.00 H new ATOM 0 HE1 MET A 118 -14.089 -16.585 2.747 1.00 0.00 H new ATOM 0 HE2 MET A 118 -13.163 -17.945 3.425 1.00 0.00 H new ATOM 0 HE3 MET A 118 -12.596 -17.131 1.947 1.00 0.00 H new ATOM 1752 N GLU A 119 -10.890 -20.731 -2.446 1.00 0.00 N ATOM 1753 CA GLU A 119 -10.379 -21.189 -3.751 1.00 0.00 C ATOM 1754 C GLU A 119 -10.857 -20.313 -4.926 1.00 0.00 C ATOM 1755 O GLU A 119 -10.867 -20.719 -6.090 1.00 0.00 O ATOM 1756 CB GLU A 119 -10.767 -22.668 -3.913 1.00 0.00 C ATOM 1757 CG GLU A 119 -9.583 -23.590 -3.604 1.00 0.00 C ATOM 1758 CD GLU A 119 -10.076 -24.920 -3.058 1.00 0.00 C ATOM 1759 OE1 GLU A 119 -10.483 -25.809 -3.847 1.00 0.00 O ATOM 1760 OE2 GLU A 119 -10.055 -25.086 -1.821 1.00 0.00 O ATOM 0 H GLU A 119 -11.805 -21.127 -2.233 1.00 0.00 H new ATOM 0 HA GLU A 119 -9.294 -21.090 -3.772 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -11.598 -22.903 -3.248 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -11.114 -22.846 -4.931 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.997 -23.755 -4.508 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -8.923 -23.114 -2.879 1.00 0.00 H new ATOM 1767 N ASN A 120 -11.314 -19.106 -4.601 1.00 0.00 N ATOM 1768 CA ASN A 120 -12.041 -18.171 -5.471 1.00 0.00 C ATOM 1769 C ASN A 120 -12.288 -16.821 -4.773 1.00 0.00 C ATOM 1770 O ASN A 120 -12.798 -15.887 -5.388 1.00 0.00 O ATOM 1771 CB ASN A 120 -13.419 -18.756 -5.841 1.00 0.00 C ATOM 1772 CG ASN A 120 -14.418 -18.666 -4.703 1.00 0.00 C ATOM 1773 OD1 ASN A 120 -15.546 -18.231 -4.882 1.00 0.00 O ATOM 1774 ND2 ASN A 120 -13.994 -19.035 -3.508 1.00 0.00 N ATOM 0 H ASN A 120 -11.180 -18.726 -3.664 1.00 0.00 H new ATOM 0 HA ASN A 120 -11.425 -18.018 -6.357 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -13.813 -18.226 -6.708 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -13.300 -19.799 -6.133 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -14.614 -18.961 -2.701 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -13.046 -19.394 -3.392 1.00 0.00 H new ATOM 1781 N VAL A 121 -11.975 -16.744 -3.477 1.00 0.00 N ATOM 1782 CA VAL A 121 -12.269 -15.682 -2.537 1.00 0.00 C ATOM 1783 C VAL A 121 -11.029 -15.635 -1.652 1.00 0.00 C ATOM 1784 O VAL A 121 -10.461 -16.674 -1.320 1.00 0.00 O ATOM 1785 CB VAL A 121 -13.556 -16.030 -1.754 1.00 0.00 C ATOM 1786 CG1 VAL A 121 -13.689 -15.297 -0.413 1.00 0.00 C ATOM 1787 CG2 VAL A 121 -14.793 -15.706 -2.590 1.00 0.00 C ATOM 0 H VAL A 121 -11.460 -17.500 -3.026 1.00 0.00 H new ATOM 0 HA VAL A 121 -12.462 -14.712 -2.995 1.00 0.00 H new ATOM 0 HB VAL A 121 -13.481 -17.097 -1.545 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -14.617 -15.595 0.074 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -12.845 -15.553 0.227 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -13.700 -14.221 -0.586 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -15.690 -15.957 -2.024 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -14.801 -14.643 -2.831 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -14.771 -16.287 -3.512 1.00 0.00 H new ATOM 1797 N ALA A 122 -10.588 -14.447 -1.273 1.00 0.00 N ATOM 1798 CA ALA A 122 -9.522 -14.231 -0.316 1.00 0.00 C ATOM 1799 C ALA A 122 -9.774 -12.868 0.308 1.00 0.00 C ATOM 1800 O ALA A 122 -10.485 -12.061 -0.296 1.00 0.00 O ATOM 1801 CB ALA A 122 -8.177 -14.277 -1.042 1.00 0.00 C ATOM 0 H ALA A 122 -10.978 -13.578 -1.638 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.498 -14.998 0.458 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -7.371 -14.115 -0.326 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -8.052 -15.251 -1.515 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -8.148 -13.498 -1.804 1.00 0.00 H new ATOM 1807 N LEU A 123 -9.205 -12.605 1.481 1.00 0.00 N ATOM 1808 CA LEU A 123 -9.341 -11.337 2.178 1.00 0.00 C ATOM 1809 C LEU A 123 -7.961 -10.990 2.721 1.00 0.00 C ATOM 1810 O LEU A 123 -7.415 -11.722 3.551 1.00 0.00 O ATOM 1811 CB LEU A 123 -10.386 -11.405 3.312 1.00 0.00 C ATOM 1812 CG LEU A 123 -11.873 -11.142 2.984 1.00 0.00 C ATOM 1813 CD1 LEU A 123 -12.106 -9.878 2.150 1.00 0.00 C ATOM 1814 CD2 LEU A 123 -12.596 -12.337 2.349 1.00 0.00 C ATOM 0 H LEU A 123 -8.627 -13.281 1.980 1.00 0.00 H new ATOM 0 HA LEU A 123 -9.701 -10.568 1.495 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -10.319 -12.396 3.760 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -10.087 -10.688 4.077 1.00 0.00 H new ATOM 0 HG LEU A 123 -12.319 -10.979 3.965 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -13.173 -9.759 1.959 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -11.736 -9.009 2.695 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -11.576 -9.965 1.202 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -13.634 -12.070 2.150 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -12.104 -12.605 1.414 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -12.564 -13.186 3.032 1.00 0.00 H new ATOM 1826 N ASP A 124 -7.393 -9.881 2.254 1.00 0.00 N ATOM 1827 CA ASP A 124 -6.194 -9.273 2.834 1.00 0.00 C ATOM 1828 C ASP A 124 -6.552 -7.860 3.266 1.00 0.00 C ATOM 1829 O ASP A 124 -7.398 -7.221 2.642 1.00 0.00 O ATOM 1830 CB ASP A 124 -5.041 -9.237 1.819 1.00 0.00 C ATOM 1831 CG ASP A 124 -4.049 -10.375 2.032 1.00 0.00 C ATOM 1832 OD1 ASP A 124 -4.377 -11.505 1.615 1.00 0.00 O ATOM 1833 OD2 ASP A 124 -2.928 -10.162 2.538 1.00 0.00 O ATOM 0 H ASP A 124 -7.757 -9.370 1.450 1.00 0.00 H new ATOM 0 HA ASP A 124 -5.859 -9.865 3.685 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -5.447 -9.295 0.809 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -4.519 -8.283 1.898 1.00 0.00 H new ATOM 1838 N PHE A 125 -5.887 -7.342 4.296 1.00 0.00 N ATOM 1839 CA PHE A 125 -6.001 -5.950 4.703 1.00 0.00 C ATOM 1840 C PHE A 125 -4.603 -5.501 5.105 1.00 0.00 C ATOM 1841 O PHE A 125 -3.988 -6.120 5.979 1.00 0.00 O ATOM 1842 CB PHE A 125 -6.992 -5.787 5.869 1.00 0.00 C ATOM 1843 CG PHE A 125 -8.246 -6.643 5.805 1.00 0.00 C ATOM 1844 CD1 PHE A 125 -9.256 -6.368 4.865 1.00 0.00 C ATOM 1845 CD2 PHE A 125 -8.381 -7.751 6.665 1.00 0.00 C ATOM 1846 CE1 PHE A 125 -10.388 -7.197 4.785 1.00 0.00 C ATOM 1847 CE2 PHE A 125 -9.527 -8.562 6.603 1.00 0.00 C ATOM 1848 CZ PHE A 125 -10.530 -8.287 5.660 1.00 0.00 C ATOM 0 H PHE A 125 -5.248 -7.886 4.876 1.00 0.00 H new ATOM 0 HA PHE A 125 -6.389 -5.339 3.888 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -6.469 -6.014 6.798 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -7.293 -4.741 5.920 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -9.161 -5.519 4.204 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -7.600 -7.978 7.375 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -11.152 -6.995 4.048 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -9.636 -9.396 7.280 1.00 0.00 H new ATOM 0 HZ PHE A 125 -11.409 -8.912 5.607 1.00 0.00 H new ATOM 1858 N SER A 126 -4.090 -4.442 4.482 1.00 0.00 N ATOM 1859 CA SER A 126 -2.859 -3.802 4.917 1.00 0.00 C ATOM 1860 C SER A 126 -3.164 -2.336 5.209 1.00 0.00 C ATOM 1861 O SER A 126 -3.878 -1.700 4.432 1.00 0.00 O ATOM 1862 CB SER A 126 -1.756 -3.974 3.867 1.00 0.00 C ATOM 1863 OG SER A 126 -1.504 -5.337 3.550 1.00 0.00 O ATOM 0 H SER A 126 -4.518 -4.007 3.664 1.00 0.00 H new ATOM 0 HA SER A 126 -2.484 -4.271 5.827 1.00 0.00 H new ATOM 0 HB2 SER A 126 -2.039 -3.441 2.959 1.00 0.00 H new ATOM 0 HB3 SER A 126 -0.838 -3.515 4.233 1.00 0.00 H new ATOM 0 HG SER A 126 -0.795 -5.390 2.876 1.00 0.00 H new ATOM 1869 N TYR A 127 -2.638 -1.827 6.323 1.00 0.00 N ATOM 1870 CA TYR A 127 -2.869 -0.489 6.857 1.00 0.00 C ATOM 1871 C TYR A 127 -1.500 0.150 7.065 1.00 0.00 C ATOM 1872 O TYR A 127 -0.688 -0.410 7.811 1.00 0.00 O ATOM 1873 CB TYR A 127 -3.616 -0.563 8.204 1.00 0.00 C ATOM 1874 CG TYR A 127 -5.105 -0.866 8.151 1.00 0.00 C ATOM 1875 CD1 TYR A 127 -5.571 -2.194 8.227 1.00 0.00 C ATOM 1876 CD2 TYR A 127 -6.033 0.193 8.104 1.00 0.00 C ATOM 1877 CE1 TYR A 127 -6.953 -2.458 8.259 1.00 0.00 C ATOM 1878 CE2 TYR A 127 -7.415 -0.065 8.091 1.00 0.00 C ATOM 1879 CZ TYR A 127 -7.882 -1.396 8.184 1.00 0.00 C ATOM 1880 OH TYR A 127 -9.214 -1.653 8.276 1.00 0.00 O ATOM 0 H TYR A 127 -2.004 -2.370 6.909 1.00 0.00 H new ATOM 0 HA TYR A 127 -3.480 0.095 6.169 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -3.136 -1.327 8.816 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -3.482 0.388 8.719 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -4.866 -3.011 8.261 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -5.679 1.213 8.078 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -7.305 -3.476 8.341 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -8.118 0.751 8.010 1.00 0.00 H new ATOM 0 HH TYR A 127 -9.584 -1.789 7.379 1.00 0.00 H new ATOM 1890 N GLU A 128 -1.242 1.300 6.438 1.00 0.00 N ATOM 1891 CA GLU A 128 0.007 2.046 6.553 1.00 0.00 C ATOM 1892 C GLU A 128 -0.280 3.505 6.899 1.00 0.00 C ATOM 1893 O GLU A 128 -1.370 4.030 6.649 1.00 0.00 O ATOM 1894 CB GLU A 128 0.843 1.914 5.265 1.00 0.00 C ATOM 1895 CG GLU A 128 0.162 2.532 4.026 1.00 0.00 C ATOM 1896 CD GLU A 128 0.960 2.338 2.731 1.00 0.00 C ATOM 1897 OE1 GLU A 128 1.276 1.172 2.404 1.00 0.00 O ATOM 1898 OE2 GLU A 128 1.204 3.345 2.022 1.00 0.00 O ATOM 0 H GLU A 128 -1.918 1.748 5.819 1.00 0.00 H new ATOM 0 HA GLU A 128 0.599 1.623 7.365 1.00 0.00 H new ATOM 0 HB2 GLU A 128 1.809 2.395 5.417 1.00 0.00 H new ATOM 0 HB3 GLU A 128 1.039 0.859 5.074 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -0.826 2.088 3.905 1.00 0.00 H new ATOM 0 HG3 GLU A 128 0.014 3.598 4.196 1.00 0.00 H new ATOM 1905 N GLN A 129 0.711 4.168 7.485 1.00 0.00 N ATOM 1906 CA GLN A 129 0.700 5.597 7.741 1.00 0.00 C ATOM 1907 C GLN A 129 2.032 6.184 7.271 1.00 0.00 C ATOM 1908 O GLN A 129 3.052 5.481 7.230 1.00 0.00 O ATOM 1909 CB GLN A 129 0.359 5.858 9.219 1.00 0.00 C ATOM 1910 CG GLN A 129 1.431 5.319 10.177 1.00 0.00 C ATOM 1911 CD GLN A 129 0.874 4.732 11.468 1.00 0.00 C ATOM 1912 OE1 GLN A 129 0.346 3.624 11.472 1.00 0.00 O ATOM 1913 NE2 GLN A 129 1.078 5.394 12.588 1.00 0.00 N ATOM 0 H GLN A 129 1.566 3.711 7.802 1.00 0.00 H new ATOM 0 HA GLN A 129 -0.079 6.108 7.176 1.00 0.00 H new ATOM 0 HB2 GLN A 129 0.242 6.930 9.377 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -0.599 5.395 9.454 1.00 0.00 H new ATOM 0 HG2 GLN A 129 2.010 4.552 9.662 1.00 0.00 H new ATOM 0 HG3 GLN A 129 2.120 6.126 10.425 1.00 0.00 H new ATOM 0 HE21 GLN A 129 1.518 6.314 12.564 1.00 0.00 H new ATOM 0 HE22 GLN A 129 0.796 4.987 13.480 1.00 0.00 H new ATOM 1922 N SER A 130 2.002 7.460 6.909 1.00 0.00 N ATOM 1923 CA SER A 130 3.119 8.283 6.493 1.00 0.00 C ATOM 1924 C SER A 130 2.907 9.678 7.092 1.00 0.00 C ATOM 1925 O SER A 130 1.791 10.021 7.491 1.00 0.00 O ATOM 1926 CB SER A 130 3.195 8.282 4.962 1.00 0.00 C ATOM 1927 OG SER A 130 4.512 8.559 4.525 1.00 0.00 O ATOM 0 H SER A 130 1.126 7.982 6.900 1.00 0.00 H new ATOM 0 HA SER A 130 4.076 7.903 6.850 1.00 0.00 H new ATOM 0 HB2 SER A 130 2.876 7.313 4.578 1.00 0.00 H new ATOM 0 HB3 SER A 130 2.509 9.027 4.559 1.00 0.00 H new ATOM 0 HG SER A 130 5.139 7.954 4.973 1.00 0.00 H new ATOM 1933 N ARG A 131 3.968 10.484 7.187 1.00 0.00 N ATOM 1934 CA ARG A 131 3.896 11.841 7.728 1.00 0.00 C ATOM 1935 C ARG A 131 4.550 12.785 6.733 1.00 0.00 C ATOM 1936 O ARG A 131 5.777 12.758 6.587 1.00 0.00 O ATOM 1937 CB ARG A 131 4.539 11.878 9.123 1.00 0.00 C ATOM 1938 CG ARG A 131 4.287 13.222 9.830 1.00 0.00 C ATOM 1939 CD ARG A 131 5.005 13.295 11.183 1.00 0.00 C ATOM 1940 NE ARG A 131 4.577 12.221 12.091 1.00 0.00 N ATOM 1941 CZ ARG A 131 5.268 11.706 13.112 1.00 0.00 C ATOM 1942 NH1 ARG A 131 6.412 12.251 13.519 1.00 0.00 N ATOM 1943 NH2 ARG A 131 4.825 10.602 13.691 1.00 0.00 N ATOM 0 H ARG A 131 4.905 10.211 6.889 1.00 0.00 H new ATOM 0 HA ARG A 131 2.864 12.166 7.862 1.00 0.00 H new ATOM 0 HB2 ARG A 131 4.138 11.066 9.730 1.00 0.00 H new ATOM 0 HB3 ARG A 131 5.612 11.709 9.034 1.00 0.00 H new ATOM 0 HG2 ARG A 131 4.628 14.038 9.193 1.00 0.00 H new ATOM 0 HG3 ARG A 131 3.216 13.360 9.979 1.00 0.00 H new ATOM 0 HD2 ARG A 131 6.082 13.230 11.026 1.00 0.00 H new ATOM 0 HD3 ARG A 131 4.808 14.262 11.646 1.00 0.00 H new ATOM 0 HE ARG A 131 3.652 11.826 11.923 1.00 0.00 H new ATOM 0 HH11 ARG A 131 6.778 13.079 13.049 1.00 0.00 H new ATOM 0 HH12 ARG A 131 6.923 11.841 14.301 1.00 0.00 H new ATOM 0 HH21 ARG A 131 3.969 10.159 13.357 1.00 0.00 H new ATOM 0 HH22 ARG A 131 5.339 10.194 14.472 1.00 0.00 H new ATOM 1957 N ILE A 132 3.754 13.585 6.030 1.00 0.00 N ATOM 1958 CA ILE A 132 4.209 14.528 5.009 1.00 0.00 C ATOM 1959 C ILE A 132 3.448 15.839 5.199 1.00 0.00 C ATOM 1960 O ILE A 132 2.321 15.832 5.679 1.00 0.00 O ATOM 1961 CB ILE A 132 4.041 13.940 3.586 1.00 0.00 C ATOM 1962 CG1 ILE A 132 2.600 13.460 3.303 1.00 0.00 C ATOM 1963 CG2 ILE A 132 5.051 12.800 3.367 1.00 0.00 C ATOM 1964 CD1 ILE A 132 2.355 12.991 1.863 1.00 0.00 C ATOM 0 H ILE A 132 2.742 13.597 6.158 1.00 0.00 H new ATOM 0 HA ILE A 132 5.276 14.721 5.121 1.00 0.00 H new ATOM 0 HB ILE A 132 4.242 14.743 2.877 1.00 0.00 H new ATOM 0 HG12 ILE A 132 2.363 12.642 3.983 1.00 0.00 H new ATOM 0 HG13 ILE A 132 1.909 14.272 3.529 1.00 0.00 H new ATOM 0 HG21 ILE A 132 4.927 12.391 2.364 1.00 0.00 H new ATOM 0 HG22 ILE A 132 6.064 13.185 3.479 1.00 0.00 H new ATOM 0 HG23 ILE A 132 4.878 12.014 4.103 1.00 0.00 H new ATOM 0 HD11 ILE A 132 1.318 12.672 1.756 1.00 0.00 H new ATOM 0 HD12 ILE A 132 2.556 13.811 1.174 1.00 0.00 H new ATOM 0 HD13 ILE A 132 3.017 12.155 1.635 1.00 0.00 H new ATOM 1976 N ARG A 133 4.037 16.975 4.819 1.00 0.00 N ATOM 1977 CA ARG A 133 3.497 18.329 5.010 1.00 0.00 C ATOM 1978 C ARG A 133 3.238 18.650 6.491 1.00 0.00 C ATOM 1979 O ARG A 133 2.460 19.563 6.772 1.00 0.00 O ATOM 1980 CB ARG A 133 2.218 18.566 4.172 1.00 0.00 C ATOM 1981 CG ARG A 133 2.211 18.072 2.713 1.00 0.00 C ATOM 1982 CD ARG A 133 0.774 17.943 2.172 1.00 0.00 C ATOM 1983 NE ARG A 133 0.346 19.061 1.320 1.00 0.00 N ATOM 1984 CZ ARG A 133 -0.152 20.255 1.650 1.00 0.00 C ATOM 1985 NH1 ARG A 133 -0.234 20.656 2.916 1.00 0.00 N ATOM 1986 NH2 ARG A 133 -0.569 21.043 0.669 1.00 0.00 N ATOM 0 H ARG A 133 4.942 16.980 4.349 1.00 0.00 H new ATOM 0 HA ARG A 133 4.266 19.014 4.652 1.00 0.00 H new ATOM 0 HB2 ARG A 133 1.386 18.090 4.690 1.00 0.00 H new ATOM 0 HB3 ARG A 133 2.017 19.637 4.163 1.00 0.00 H new ATOM 0 HG2 ARG A 133 2.776 18.765 2.089 1.00 0.00 H new ATOM 0 HG3 ARG A 133 2.713 17.106 2.651 1.00 0.00 H new ATOM 0 HD2 ARG A 133 0.694 17.017 1.603 1.00 0.00 H new ATOM 0 HD3 ARG A 133 0.087 17.860 3.014 1.00 0.00 H new ATOM 0 HE ARG A 133 0.445 18.899 0.318 1.00 0.00 H new ATOM 0 HH11 ARG A 133 0.089 20.045 3.666 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -0.619 21.574 3.136 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -0.503 20.730 -0.300 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -0.955 21.962 0.883 1.00 0.00 H new ATOM 2000 N SER A 134 3.835 17.925 7.445 1.00 0.00 N ATOM 2001 CA SER A 134 3.412 17.941 8.845 1.00 0.00 C ATOM 2002 C SER A 134 1.913 17.636 8.998 1.00 0.00 C ATOM 2003 O SER A 134 1.269 18.163 9.904 1.00 0.00 O ATOM 2004 CB SER A 134 3.838 19.252 9.533 1.00 0.00 C ATOM 2005 OG SER A 134 5.238 19.265 9.753 1.00 0.00 O ATOM 0 H SER A 134 4.628 17.309 7.264 1.00 0.00 H new ATOM 0 HA SER A 134 3.928 17.132 9.363 1.00 0.00 H new ATOM 0 HB2 SER A 134 3.553 20.103 8.915 1.00 0.00 H new ATOM 0 HB3 SER A 134 3.314 19.358 10.483 1.00 0.00 H new ATOM 0 HG SER A 134 5.493 20.105 10.189 1.00 0.00 H new ATOM 2011 N VAL A 135 1.349 16.773 8.153 1.00 0.00 N ATOM 2012 CA VAL A 135 0.082 16.111 8.431 1.00 0.00 C ATOM 2013 C VAL A 135 0.305 14.601 8.434 1.00 0.00 C ATOM 2014 O VAL A 135 1.212 14.071 7.782 1.00 0.00 O ATOM 2015 CB VAL A 135 -1.076 16.581 7.523 1.00 0.00 C ATOM 2016 CG1 VAL A 135 -1.335 18.085 7.703 1.00 0.00 C ATOM 2017 CG2 VAL A 135 -0.885 16.280 6.033 1.00 0.00 C ATOM 0 H VAL A 135 1.761 16.515 7.256 1.00 0.00 H new ATOM 0 HA VAL A 135 -0.259 16.406 9.424 1.00 0.00 H new ATOM 0 HB VAL A 135 -1.937 15.998 7.850 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -2.154 18.393 7.054 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -1.599 18.287 8.741 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -0.436 18.643 7.442 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -1.747 16.646 5.475 1.00 0.00 H new ATOM 0 HG22 VAL A 135 0.017 16.776 5.674 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -0.789 15.204 5.889 1.00 0.00 H new ATOM 2027 N ASP A 136 -0.493 13.917 9.244 1.00 0.00 N ATOM 2028 CA ASP A 136 -0.611 12.474 9.207 1.00 0.00 C ATOM 2029 C ASP A 136 -1.327 12.098 7.914 1.00 0.00 C ATOM 2030 O ASP A 136 -2.258 12.811 7.531 1.00 0.00 O ATOM 2031 CB ASP A 136 -1.444 12.027 10.403 1.00 0.00 C ATOM 2032 CG ASP A 136 -1.215 10.554 10.650 1.00 0.00 C ATOM 2033 OD1 ASP A 136 -1.841 9.715 9.975 1.00 0.00 O ATOM 2034 OD2 ASP A 136 -0.349 10.291 11.527 1.00 0.00 O ATOM 0 H ASP A 136 -1.081 14.358 9.951 1.00 0.00 H new ATOM 0 HA ASP A 136 0.368 11.996 9.247 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -1.170 12.602 11.287 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -2.501 12.216 10.215 1.00 0.00 H new ATOM 2039 N VAL A 137 -0.900 11.027 7.250 1.00 0.00 N ATOM 2040 CA VAL A 137 -1.431 10.557 5.980 1.00 0.00 C ATOM 2041 C VAL A 137 -1.573 9.042 6.098 1.00 0.00 C ATOM 2042 O VAL A 137 -0.596 8.301 5.940 1.00 0.00 O ATOM 2043 CB VAL A 137 -0.512 11.017 4.822 1.00 0.00 C ATOM 2044 CG1 VAL A 137 -0.927 10.444 3.457 1.00 0.00 C ATOM 2045 CG2 VAL A 137 -0.518 12.552 4.724 1.00 0.00 C ATOM 0 H VAL A 137 -0.142 10.440 7.600 1.00 0.00 H new ATOM 0 HA VAL A 137 -2.410 10.978 5.751 1.00 0.00 H new ATOM 0 HB VAL A 137 0.484 10.640 5.056 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -0.243 10.804 2.688 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -0.891 9.355 3.493 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -1.941 10.766 3.220 1.00 0.00 H new ATOM 0 HG21 VAL A 137 0.131 12.867 3.907 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -1.533 12.901 4.536 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -0.156 12.978 5.660 1.00 0.00 H new ATOM 2055 N GLY A 138 -2.783 8.567 6.385 1.00 0.00 N ATOM 2056 CA GLY A 138 -3.085 7.148 6.339 1.00 0.00 C ATOM 2057 C GLY A 138 -3.331 6.747 4.889 1.00 0.00 C ATOM 2058 O GLY A 138 -3.795 7.560 4.083 1.00 0.00 O ATOM 0 H GLY A 138 -3.573 9.154 6.653 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -2.258 6.572 6.755 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -3.964 6.929 6.946 1.00 0.00 H new ATOM 2062 N THR A 139 -3.053 5.496 4.534 1.00 0.00 N ATOM 2063 CA THR A 139 -3.836 4.804 3.521 1.00 0.00 C ATOM 2064 C THR A 139 -3.988 3.352 3.969 1.00 0.00 C ATOM 2065 O THR A 139 -3.174 2.843 4.745 1.00 0.00 O ATOM 2066 CB THR A 139 -3.282 5.050 2.098 1.00 0.00 C ATOM 2067 OG1 THR A 139 -4.157 4.559 1.095 1.00 0.00 O ATOM 2068 CG2 THR A 139 -1.903 4.453 1.857 1.00 0.00 C ATOM 0 H THR A 139 -2.293 4.944 4.933 1.00 0.00 H new ATOM 0 HA THR A 139 -4.846 5.205 3.433 1.00 0.00 H new ATOM 0 HB THR A 139 -3.199 6.135 2.032 1.00 0.00 H new ATOM 0 HG1 THR A 139 -3.773 4.735 0.211 1.00 0.00 H new ATOM 0 HG21 THR A 139 -1.586 4.669 0.837 1.00 0.00 H new ATOM 0 HG22 THR A 139 -1.191 4.888 2.558 1.00 0.00 H new ATOM 0 HG23 THR A 139 -1.943 3.374 2.003 1.00 0.00 H new ATOM 2076 N TRP A 140 -5.044 2.680 3.527 1.00 0.00 N ATOM 2077 CA TRP A 140 -5.156 1.243 3.687 1.00 0.00 C ATOM 2078 C TRP A 140 -5.732 0.659 2.416 1.00 0.00 C ATOM 2079 O TRP A 140 -6.446 1.357 1.683 1.00 0.00 O ATOM 2080 CB TRP A 140 -5.986 0.901 4.925 1.00 0.00 C ATOM 2081 CG TRP A 140 -7.480 1.006 4.844 1.00 0.00 C ATOM 2082 CD1 TRP A 140 -8.200 2.150 4.815 1.00 0.00 C ATOM 2083 CD2 TRP A 140 -8.453 -0.079 4.927 1.00 0.00 C ATOM 2084 NE1 TRP A 140 -9.545 1.847 4.910 1.00 0.00 N ATOM 2085 CE2 TRP A 140 -9.753 0.492 5.048 1.00 0.00 C ATOM 2086 CE3 TRP A 140 -8.362 -1.487 4.970 1.00 0.00 C ATOM 2087 CZ2 TRP A 140 -10.894 -0.288 5.279 1.00 0.00 C ATOM 2088 CZ3 TRP A 140 -9.500 -2.281 5.200 1.00 0.00 C ATOM 2089 CH2 TRP A 140 -10.757 -1.682 5.386 1.00 0.00 C ATOM 0 H TRP A 140 -5.836 3.114 3.053 1.00 0.00 H new ATOM 0 HA TRP A 140 -4.173 0.800 3.851 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -5.742 -0.121 5.214 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -5.653 1.549 5.735 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -7.788 3.145 4.731 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -10.292 2.541 4.881 1.00 0.00 H new ATOM 0 HE3 TRP A 140 -7.403 -1.962 4.824 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -11.865 0.176 5.373 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 -9.407 -3.356 5.234 1.00 0.00 H new ATOM 0 HH2 TRP A 140 -11.618 -2.293 5.611 1.00 0.00 H new ATOM 2100 N ILE A 141 -5.447 -0.614 2.167 1.00 0.00 N ATOM 2101 CA ILE A 141 -5.799 -1.286 0.929 1.00 0.00 C ATOM 2102 C ILE A 141 -6.682 -2.479 1.255 1.00 0.00 C ATOM 2103 O ILE A 141 -6.414 -3.235 2.196 1.00 0.00 O ATOM 2104 CB ILE A 141 -4.534 -1.640 0.106 1.00 0.00 C ATOM 2105 CG1 ILE A 141 -3.540 -2.566 0.844 1.00 0.00 C ATOM 2106 CG2 ILE A 141 -3.837 -0.336 -0.307 1.00 0.00 C ATOM 2107 CD1 ILE A 141 -2.336 -3.001 -0.003 1.00 0.00 C ATOM 0 H ILE A 141 -4.958 -1.214 2.831 1.00 0.00 H new ATOM 0 HA ILE A 141 -6.374 -0.623 0.283 1.00 0.00 H new ATOM 0 HB ILE A 141 -4.865 -2.205 -0.766 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -3.177 -2.054 1.735 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -4.072 -3.455 1.182 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -2.944 -0.569 -0.887 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -4.517 0.264 -0.912 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -3.554 0.224 0.585 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -1.689 -3.648 0.589 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -2.686 -3.544 -0.881 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -1.777 -2.121 -0.320 1.00 0.00 H new ATOM 2119 N ALA A 142 -7.689 -2.681 0.410 1.00 0.00 N ATOM 2120 CA ALA A 142 -8.568 -3.820 0.463 1.00 0.00 C ATOM 2121 C ALA A 142 -7.904 -4.895 -0.371 1.00 0.00 C ATOM 2122 O ALA A 142 -7.387 -4.622 -1.459 1.00 0.00 O ATOM 2123 CB ALA A 142 -9.904 -3.453 -0.186 1.00 0.00 C ATOM 0 H ALA A 142 -7.913 -2.034 -0.346 1.00 0.00 H new ATOM 0 HA ALA A 142 -8.746 -4.145 1.488 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -10.574 -4.312 -0.149 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -10.353 -2.619 0.353 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -9.738 -3.167 -1.225 1.00 0.00 H new ATOM 2129 N GLY A 143 -7.888 -6.103 0.157 1.00 0.00 N ATOM 2130 CA GLY A 143 -7.494 -7.313 -0.516 1.00 0.00 C ATOM 2131 C GLY A 143 -8.741 -8.167 -0.632 1.00 0.00 C ATOM 2132 O GLY A 143 -9.378 -8.484 0.374 1.00 0.00 O ATOM 0 H GLY A 143 -8.167 -6.270 1.124 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -7.082 -7.093 -1.501 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -6.718 -7.834 0.045 1.00 0.00 H new ATOM 2136 N VAL A 144 -9.087 -8.504 -1.861 1.00 0.00 N ATOM 2137 CA VAL A 144 -10.081 -9.454 -2.306 1.00 0.00 C ATOM 2138 C VAL A 144 -9.389 -10.207 -3.447 1.00 0.00 C ATOM 2139 O VAL A 144 -8.555 -9.620 -4.136 1.00 0.00 O ATOM 2140 CB VAL A 144 -11.361 -8.725 -2.772 1.00 0.00 C ATOM 2141 CG1 VAL A 144 -12.514 -9.724 -2.912 1.00 0.00 C ATOM 2142 CG2 VAL A 144 -11.831 -7.632 -1.800 1.00 0.00 C ATOM 0 H VAL A 144 -8.624 -8.067 -2.658 1.00 0.00 H new ATOM 0 HA VAL A 144 -10.412 -10.133 -1.520 1.00 0.00 H new ATOM 0 HB VAL A 144 -11.101 -8.260 -3.723 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -13.411 -9.200 -3.241 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -12.249 -10.485 -3.646 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -12.703 -10.199 -1.949 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -12.734 -7.162 -2.190 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -12.044 -8.077 -0.828 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -11.049 -6.881 -1.691 1.00 0.00 H new ATOM 2152 N GLY A 145 -9.686 -11.486 -3.668 1.00 0.00 N ATOM 2153 CA GLY A 145 -9.071 -12.236 -4.755 1.00 0.00 C ATOM 2154 C GLY A 145 -9.292 -13.721 -4.547 1.00 0.00 C ATOM 2155 O GLY A 145 -10.443 -14.116 -4.391 1.00 0.00 O ATOM 0 H GLY A 145 -10.349 -12.022 -3.108 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -9.498 -11.926 -5.709 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -8.003 -12.021 -4.798 1.00 0.00 H new ATOM 2159 N TYR A 146 -8.227 -14.520 -4.538 1.00 0.00 N ATOM 2160 CA TYR A 146 -8.202 -15.956 -4.285 1.00 0.00 C ATOM 2161 C TYR A 146 -6.815 -16.277 -3.715 1.00 0.00 C ATOM 2162 O TYR A 146 -5.802 -15.692 -4.125 1.00 0.00 O ATOM 2163 CB TYR A 146 -8.513 -16.754 -5.573 1.00 0.00 C ATOM 2164 CG TYR A 146 -7.653 -17.985 -5.810 1.00 0.00 C ATOM 2165 CD1 TYR A 146 -7.827 -19.104 -4.984 1.00 0.00 C ATOM 2166 CD2 TYR A 146 -6.668 -18.018 -6.816 1.00 0.00 C ATOM 2167 CE1 TYR A 146 -7.047 -20.255 -5.154 1.00 0.00 C ATOM 2168 CE2 TYR A 146 -5.866 -19.161 -6.985 1.00 0.00 C ATOM 2169 CZ TYR A 146 -6.055 -20.286 -6.151 1.00 0.00 C ATOM 2170 OH TYR A 146 -5.278 -21.391 -6.295 1.00 0.00 O ATOM 0 H TYR A 146 -7.293 -14.153 -4.721 1.00 0.00 H new ATOM 0 HA TYR A 146 -8.973 -16.248 -3.572 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -9.558 -17.064 -5.543 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -8.403 -16.086 -6.428 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -8.574 -19.078 -4.204 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -6.528 -17.162 -7.460 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -7.207 -21.116 -4.522 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -5.106 -19.179 -7.752 1.00 0.00 H new ATOM 0 HH TYR A 146 -5.159 -21.823 -5.423 1.00 0.00 H new ATOM 2180 N ARG A 147 -6.730 -17.206 -2.760 1.00 0.00 N ATOM 2181 CA ARG A 147 -5.443 -17.556 -2.164 1.00 0.00 C ATOM 2182 C ARG A 147 -5.370 -19.067 -2.041 1.00 0.00 C ATOM 2183 O ARG A 147 -5.773 -19.592 -1.006 1.00 0.00 O ATOM 2184 CB ARG A 147 -5.215 -16.793 -0.836 1.00 0.00 C ATOM 2185 CG ARG A 147 -3.856 -17.091 -0.164 1.00 0.00 C ATOM 2186 CD ARG A 147 -3.792 -16.729 1.330 1.00 0.00 C ATOM 2187 NE ARG A 147 -3.611 -15.291 1.579 1.00 0.00 N ATOM 2188 CZ ARG A 147 -2.488 -14.663 1.942 1.00 0.00 C ATOM 2189 NH1 ARG A 147 -1.364 -15.328 2.190 1.00 0.00 N ATOM 2190 NH2 ARG A 147 -2.460 -13.347 2.050 1.00 0.00 N ATOM 0 H ARG A 147 -7.527 -17.722 -2.388 1.00 0.00 H new ATOM 0 HA ARG A 147 -4.618 -17.239 -2.802 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -5.287 -15.722 -1.027 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -6.015 -17.047 -0.141 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -3.633 -18.152 -0.278 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -3.076 -16.543 -0.692 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -4.710 -17.061 1.816 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -2.971 -17.276 1.793 1.00 0.00 H new ATOM 0 HE ARG A 147 -4.438 -14.705 1.461 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -1.343 -16.344 2.105 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -0.522 -14.822 2.465 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -3.300 -12.801 1.856 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -1.599 -12.876 2.328 1.00 0.00 H new ATOM 2204 N PHE A 148 -4.732 -19.687 -3.038 1.00 0.00 N ATOM 2205 CA PHE A 148 -4.151 -21.016 -3.025 1.00 0.00 C ATOM 2206 C PHE A 148 -5.206 -22.108 -2.982 1.00 0.00 C ATOM 2207 O PHE A 148 -5.333 -22.764 -4.036 1.00 0.00 O ATOM 2208 CB PHE A 148 -3.090 -21.145 -1.932 1.00 0.00 C ATOM 2209 CG PHE A 148 -1.798 -20.368 -2.135 1.00 0.00 C ATOM 2210 CD1 PHE A 148 -1.759 -18.958 -2.299 1.00 0.00 C ATOM 2211 CD2 PHE A 148 -0.591 -21.090 -2.081 1.00 0.00 C ATOM 2212 CE1 PHE A 148 -0.513 -18.299 -2.287 1.00 0.00 C ATOM 2213 CE2 PHE A 148 0.641 -20.427 -2.142 1.00 0.00 C ATOM 2214 CZ PHE A 148 0.679 -19.030 -2.219 1.00 0.00 C ATOM 0 H PHE A 148 -4.603 -19.230 -3.941 1.00 0.00 H new ATOM 0 HA PHE A 148 -3.633 -21.162 -3.973 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -3.534 -20.826 -0.989 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -2.839 -22.200 -1.825 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -2.673 -18.398 -2.431 1.00 0.00 H new ATOM 0 HD2 PHE A 148 -0.615 -22.166 -1.992 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -0.478 -17.220 -2.331 1.00 0.00 H new ATOM 0 HE2 PHE A 148 1.561 -20.993 -2.130 1.00 0.00 H new ATOM 0 HZ PHE A 148 1.629 -18.516 -2.226 1.00 0.00 H new TER 2224 PHE A 148