USER MOD reduce.3.24.130724 H: found=0, std=0, add=1213, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1209 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 138 GLN : amide:sc= 0 X(o=-0.0098,f=0.34) USER MOD Set 1.2: A 142 ASN : amide:sc=-0.00983 X(o=-0.0098,f=0.34) USER MOD Set 2.1: A 22 SER OG : rot -48:sc= 0.0272 USER MOD Set 2.2: A 154 HIS : no HD1:sc= -0.613 X(o=-0.59,f=-0.44) USER MOD Single : A 1 GLY N :NH3+ 155:sc= 1.24 (180deg=0.998) USER MOD Single : A 3 SER OG : rot 180:sc= 0.0306 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 36:sc= 0.556 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= -0.133 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0.0189 USER MOD Single : A 23 SER OG : rot -79:sc= 1.05 USER MOD Single : A 27 GLN : amide:sc= 0.94 K(o=0.94,f=-8.3!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00565) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 73:sc= 0.0873 USER MOD Single : A 48 THR OG1 : rot 0:sc= 0.717 USER MOD Single : A 50 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0395) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 148:sc= 0.704 (180deg=0.194) USER MOD Single : A 58 LYS NZ :NH3+ 138:sc= -0.018 (180deg=-0.826) USER MOD Single : A 64 SER OG : rot 180:sc=-0.00532 USER MOD Single : A 66 THR OG1 : rot 83:sc= 1.18 USER MOD Single : A 67 MET CE :methyl 143:sc= -0.163 (180deg=-0.774) USER MOD Single : A 68 LYS NZ :NH3+ -144:sc= 1.24 (180deg=0.947) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 HIS : no HD1:sc= -1.39 X(o=-1.4,f=-1.1) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -91:sc= 0.0378 USER MOD Single : A 112 GLN : amide:sc= -2.59 K(o=-2.6,f=-4.3!) USER MOD Single : A 116 LYS NZ :NH3+ 173:sc=-0.00665 (180deg=-0.0788) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot -134:sc= 1.25 USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 THR OG1 : rot 130:sc= 0.372 USER MOD Single : A 127 TYR OH : rot 86:sc= -0.149 USER MOD Single : A 129 TYR OH : rot 130:sc= -0.0994 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0.0443 USER MOD Single : A 141 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 ASN : amide:sc= 0.597 K(o=0.6,f=-9.7!) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -33.594 -5.539 4.170 1.00 3.02 N ATOM 2 CA GLY A 1 -34.049 -5.981 5.503 1.00 41.01 C ATOM 3 C GLY A 1 -33.614 -4.957 6.543 1.00 34.41 C ATOM 4 O GLY A 1 -33.752 -3.764 6.281 1.00 11.32 O ATOM 0 H1 GLY A 1 -33.495 -6.365 3.546 1.00 3.02 H new ATOM 0 H2 GLY A 1 -34.291 -4.881 3.766 1.00 3.02 H new ATOM 0 H3 GLY A 1 -32.676 -5.059 4.258 1.00 3.02 H new ATOM 0 HA2 GLY A 1 -35.134 -6.090 5.513 1.00 41.01 H new ATOM 0 HA3 GLY A 1 -33.628 -6.959 5.739 1.00 41.01 H new ATOM 8 N ASP A 2 -33.091 -5.396 7.696 1.00 15.13 N ATOM 9 CA ASP A 2 -32.265 -4.554 8.570 1.00 15.34 C ATOM 10 C ASP A 2 -30.963 -4.289 7.816 1.00 60.30 C ATOM 11 O ASP A 2 -30.081 -5.146 7.768 1.00 24.42 O ATOM 12 CB ASP A 2 -32.012 -5.238 9.921 1.00 24.44 C ATOM 13 CG ASP A 2 -31.043 -4.454 10.818 1.00 4.03 C ATOM 14 OD1 ASP A 2 -30.747 -3.268 10.529 1.00 31.25 O ATOM 15 OD2 ASP A 2 -30.619 -5.020 11.846 1.00 75.23 O ATOM 0 H ASP A 2 -33.229 -6.343 8.048 1.00 15.13 H new ATOM 0 HA ASP A 2 -32.769 -3.616 8.802 1.00 15.34 H new ATOM 0 HB2 ASP A 2 -32.961 -5.362 10.442 1.00 24.44 H new ATOM 0 HB3 ASP A 2 -31.610 -6.236 9.747 1.00 24.44 H new ATOM 20 N SER A 3 -30.953 -3.185 7.063 1.00 2.31 N ATOM 21 CA SER A 3 -30.124 -2.984 5.882 1.00 42.43 C ATOM 22 C SER A 3 -30.139 -4.226 4.965 1.00 40.30 C ATOM 23 O SER A 3 -31.050 -5.052 5.020 1.00 14.13 O ATOM 24 CB SER A 3 -28.715 -2.526 6.291 1.00 32.13 C ATOM 25 OG SER A 3 -28.102 -1.809 5.229 1.00 54.42 O ATOM 0 H SER A 3 -31.545 -2.381 7.271 1.00 2.31 H new ATOM 0 HA SER A 3 -30.546 -2.180 5.279 1.00 42.43 H new ATOM 0 HB2 SER A 3 -28.773 -1.896 7.178 1.00 32.13 H new ATOM 0 HB3 SER A 3 -28.106 -3.391 6.554 1.00 32.13 H new ATOM 0 HG SER A 3 -27.206 -1.521 5.503 1.00 54.42 H new ATOM 31 N GLU A 4 -29.165 -4.334 4.070 1.00 43.22 N ATOM 32 CA GLU A 4 -28.753 -5.552 3.396 1.00 2.21 C ATOM 33 C GLU A 4 -27.248 -5.408 3.167 1.00 73.30 C ATOM 34 O GLU A 4 -26.743 -4.292 3.012 1.00 20.43 O ATOM 35 CB GLU A 4 -29.499 -5.723 2.055 1.00 33.14 C ATOM 36 CG GLU A 4 -30.693 -6.688 2.149 1.00 60.32 C ATOM 37 CD GLU A 4 -31.786 -6.351 1.133 1.00 41.12 C ATOM 38 OE1 GLU A 4 -31.488 -6.360 -0.086 1.00 62.13 O ATOM 39 OE2 GLU A 4 -32.913 -6.081 1.623 1.00 32.43 O ATOM 0 H GLU A 4 -28.612 -3.527 3.781 1.00 43.22 H new ATOM 0 HA GLU A 4 -28.986 -6.435 3.991 1.00 2.21 H new ATOM 0 HB2 GLU A 4 -29.852 -4.749 1.715 1.00 33.14 H new ATOM 0 HB3 GLU A 4 -28.801 -6.089 1.302 1.00 33.14 H new ATOM 0 HG2 GLU A 4 -30.348 -7.709 1.984 1.00 60.32 H new ATOM 0 HG3 GLU A 4 -31.110 -6.651 3.155 1.00 60.32 H new ATOM 46 N LEU A 5 -26.539 -6.533 3.112 1.00 35.25 N ATOM 47 CA LEU A 5 -25.137 -6.610 2.738 1.00 52.02 C ATOM 48 C LEU A 5 -25.095 -7.435 1.462 1.00 61.31 C ATOM 49 O LEU A 5 -25.221 -8.659 1.529 1.00 12.13 O ATOM 50 CB LEU A 5 -24.257 -7.251 3.830 1.00 32.21 C ATOM 51 CG LEU A 5 -24.177 -6.478 5.162 1.00 63.42 C ATOM 52 CD1 LEU A 5 -25.233 -6.967 6.161 1.00 64.50 C ATOM 53 CD2 LEU A 5 -22.786 -6.647 5.787 1.00 54.03 C ATOM 0 H LEU A 5 -26.942 -7.443 3.335 1.00 35.25 H new ATOM 0 HA LEU A 5 -24.731 -5.608 2.598 1.00 52.02 H new ATOM 0 HB2 LEU A 5 -24.635 -8.253 4.034 1.00 32.21 H new ATOM 0 HB3 LEU A 5 -23.247 -7.366 3.436 1.00 32.21 H new ATOM 0 HG LEU A 5 -24.365 -5.427 4.942 1.00 63.42 H new ATOM 0 HD11 LEU A 5 -25.147 -6.400 7.088 1.00 64.50 H new ATOM 0 HD12 LEU A 5 -26.228 -6.823 5.739 1.00 64.50 H new ATOM 0 HD13 LEU A 5 -25.076 -8.026 6.367 1.00 64.50 H new ATOM 0 HD21 LEU A 5 -22.740 -6.097 6.727 1.00 54.03 H new ATOM 0 HD22 LEU A 5 -22.598 -7.704 5.975 1.00 54.03 H new ATOM 0 HD23 LEU A 5 -22.030 -6.260 5.103 1.00 54.03 H new ATOM 65 N THR A 6 -24.981 -6.783 0.310 1.00 41.31 N ATOM 66 CA THR A 6 -24.803 -7.436 -0.981 1.00 74.52 C ATOM 67 C THR A 6 -23.728 -6.681 -1.777 1.00 32.41 C ATOM 68 O THR A 6 -23.264 -5.611 -1.357 1.00 20.22 O ATOM 69 CB THR A 6 -26.158 -7.559 -1.709 1.00 4.35 C ATOM 70 OG1 THR A 6 -26.791 -6.304 -1.841 1.00 55.12 O ATOM 71 CG2 THR A 6 -27.130 -8.480 -0.969 1.00 71.22 C ATOM 0 H THR A 6 -25.010 -5.765 0.247 1.00 41.31 H new ATOM 0 HA THR A 6 -24.446 -8.458 -0.857 1.00 74.52 H new ATOM 0 HB THR A 6 -25.924 -7.976 -2.689 1.00 4.35 H new ATOM 0 HG1 THR A 6 -27.645 -6.416 -2.308 1.00 55.12 H new ATOM 0 HG21 THR A 6 -28.069 -8.535 -1.519 1.00 71.22 H new ATOM 0 HG22 THR A 6 -26.697 -9.477 -0.889 1.00 71.22 H new ATOM 0 HG23 THR A 6 -27.317 -8.085 0.029 1.00 71.22 H new ATOM 79 N THR A 7 -23.299 -7.249 -2.903 1.00 34.11 N ATOM 80 CA THR A 7 -22.243 -6.726 -3.758 1.00 60.21 C ATOM 81 C THR A 7 -22.703 -6.938 -5.197 1.00 42.32 C ATOM 82 O THR A 7 -22.774 -8.092 -5.633 1.00 63.44 O ATOM 83 CB THR A 7 -20.911 -7.447 -3.465 1.00 2.35 C ATOM 84 OG1 THR A 7 -21.061 -8.859 -3.569 1.00 3.24 O ATOM 85 CG2 THR A 7 -20.356 -7.136 -2.072 1.00 14.24 C ATOM 0 H THR A 7 -23.695 -8.120 -3.255 1.00 34.11 H new ATOM 0 HA THR A 7 -22.064 -5.666 -3.576 1.00 60.21 H new ATOM 0 HB THR A 7 -20.210 -7.076 -4.213 1.00 2.35 H new ATOM 0 HG1 THR A 7 -21.686 -9.069 -4.294 1.00 3.24 H new ATOM 0 HG21 THR A 7 -19.418 -7.672 -1.926 1.00 14.24 H new ATOM 0 HG22 THR A 7 -20.179 -6.064 -1.982 1.00 14.24 H new ATOM 0 HG23 THR A 7 -21.075 -7.450 -1.315 1.00 14.24 H new ATOM 93 N GLN A 8 -23.077 -5.870 -5.894 1.00 0.41 N ATOM 94 CA GLN A 8 -23.386 -5.893 -7.309 1.00 33.31 C ATOM 95 C GLN A 8 -23.018 -4.535 -7.889 1.00 54.03 C ATOM 96 O GLN A 8 -23.056 -3.527 -7.181 1.00 13.23 O ATOM 97 CB GLN A 8 -24.863 -6.238 -7.542 1.00 40.12 C ATOM 98 CG GLN A 8 -25.901 -5.272 -6.948 1.00 12.35 C ATOM 99 CD GLN A 8 -27.272 -5.586 -7.541 1.00 32.51 C ATOM 100 OE1 GLN A 8 -27.785 -6.692 -7.386 1.00 51.43 O ATOM 101 NE2 GLN A 8 -27.872 -4.680 -8.298 1.00 12.13 N ATOM 0 H GLN A 8 -23.174 -4.945 -5.475 1.00 0.41 H new ATOM 0 HA GLN A 8 -22.810 -6.669 -7.813 1.00 33.31 H new ATOM 0 HB2 GLN A 8 -25.032 -6.300 -8.617 1.00 40.12 H new ATOM 0 HB3 GLN A 8 -25.049 -7.231 -7.132 1.00 40.12 H new ATOM 0 HG2 GLN A 8 -25.929 -5.371 -5.863 1.00 12.35 H new ATOM 0 HG3 GLN A 8 -25.624 -4.241 -7.167 1.00 12.35 H new ATOM 0 HE21 GLN A 8 -27.447 -3.762 -8.428 1.00 12.13 H new ATOM 0 HE22 GLN A 8 -28.759 -4.901 -8.751 1.00 12.13 H new ATOM 110 N ASP A 9 -22.676 -4.513 -9.176 1.00 35.45 N ATOM 111 CA ASP A 9 -22.101 -3.357 -9.868 1.00 22.53 C ATOM 112 C ASP A 9 -20.895 -2.792 -9.085 1.00 55.03 C ATOM 113 O ASP A 9 -20.669 -1.579 -9.020 1.00 32.42 O ATOM 114 CB ASP A 9 -23.209 -2.335 -10.176 1.00 40.33 C ATOM 115 CG ASP A 9 -23.057 -1.696 -11.558 1.00 15.25 C ATOM 116 OD1 ASP A 9 -23.435 -2.369 -12.543 1.00 33.11 O ATOM 117 OD2 ASP A 9 -22.694 -0.499 -11.682 1.00 2.02 O ATOM 0 H ASP A 9 -22.794 -5.322 -9.786 1.00 35.45 H new ATOM 0 HA ASP A 9 -21.690 -3.655 -10.832 1.00 22.53 H new ATOM 0 HB2 ASP A 9 -24.179 -2.828 -10.113 1.00 40.33 H new ATOM 0 HB3 ASP A 9 -23.198 -1.554 -9.416 1.00 40.33 H new ATOM 122 N GLY A 10 -20.183 -3.679 -8.384 1.00 1.45 N ATOM 123 CA GLY A 10 -19.081 -3.426 -7.478 1.00 21.12 C ATOM 124 C GLY A 10 -19.329 -4.078 -6.115 1.00 11.24 C ATOM 125 O GLY A 10 -20.460 -4.270 -5.663 1.00 1.43 O ATOM 0 H GLY A 10 -20.388 -4.676 -8.448 1.00 1.45 H new ATOM 0 HA2 GLY A 10 -18.157 -3.813 -7.907 1.00 21.12 H new ATOM 0 HA3 GLY A 10 -18.949 -2.351 -7.352 1.00 21.12 H new ATOM 129 N GLU A 11 -18.245 -4.421 -5.427 1.00 12.13 N ATOM 130 CA GLU A 11 -18.174 -4.394 -3.974 1.00 42.03 C ATOM 131 C GLU A 11 -17.968 -2.928 -3.549 1.00 34.11 C ATOM 132 O GLU A 11 -17.563 -2.090 -4.363 1.00 74.44 O ATOM 133 CB GLU A 11 -17.024 -5.328 -3.549 1.00 74.44 C ATOM 134 CG GLU A 11 -16.725 -5.350 -2.051 1.00 3.15 C ATOM 135 CD GLU A 11 -15.731 -6.439 -1.624 1.00 33.34 C ATOM 136 OE1 GLU A 11 -15.223 -7.217 -2.465 1.00 13.43 O ATOM 137 OE2 GLU A 11 -15.479 -6.565 -0.405 1.00 60.31 O ATOM 0 H GLU A 11 -17.380 -4.730 -5.871 1.00 12.13 H new ATOM 0 HA GLU A 11 -19.081 -4.751 -3.486 1.00 42.03 H new ATOM 0 HB2 GLU A 11 -17.263 -6.342 -3.871 1.00 74.44 H new ATOM 0 HB3 GLU A 11 -16.120 -5.030 -4.080 1.00 74.44 H new ATOM 0 HG2 GLU A 11 -16.330 -4.378 -1.756 1.00 3.15 H new ATOM 0 HG3 GLU A 11 -17.659 -5.493 -1.507 1.00 3.15 H new ATOM 144 N ASP A 12 -18.229 -2.609 -2.281 1.00 21.51 N ATOM 145 CA ASP A 12 -18.108 -1.254 -1.741 1.00 74.52 C ATOM 146 C ASP A 12 -16.646 -0.833 -1.589 1.00 21.43 C ATOM 147 O ASP A 12 -15.780 -1.651 -1.249 1.00 40.42 O ATOM 148 CB ASP A 12 -18.758 -1.183 -0.356 1.00 20.43 C ATOM 149 CG ASP A 12 -19.319 0.183 -0.008 1.00 4.41 C ATOM 150 OD1 ASP A 12 -18.478 1.094 0.191 1.00 12.34 O ATOM 151 OD2 ASP A 12 -20.556 0.288 0.148 1.00 1.05 O ATOM 0 H ASP A 12 -18.535 -3.294 -1.590 1.00 21.51 H new ATOM 0 HA ASP A 12 -18.605 -0.585 -2.444 1.00 74.52 H new ATOM 0 HB2 ASP A 12 -19.561 -1.918 -0.304 1.00 20.43 H new ATOM 0 HB3 ASP A 12 -18.020 -1.464 0.395 1.00 20.43 H new ATOM 156 N PHE A 13 -16.387 0.470 -1.698 1.00 13.11 N ATOM 157 CA PHE A 13 -15.084 1.073 -1.436 1.00 34.24 C ATOM 158 C PHE A 13 -14.658 0.934 0.028 1.00 64.44 C ATOM 159 O PHE A 13 -13.471 1.056 0.332 1.00 4.25 O ATOM 160 CB PHE A 13 -15.110 2.576 -1.769 1.00 74.24 C ATOM 161 CG PHE A 13 -15.947 2.992 -2.962 1.00 71.40 C ATOM 162 CD1 PHE A 13 -15.537 2.650 -4.261 1.00 73.24 C ATOM 163 CD2 PHE A 13 -17.143 3.714 -2.774 1.00 24.24 C ATOM 164 CE1 PHE A 13 -16.328 3.016 -5.364 1.00 3.12 C ATOM 165 CE2 PHE A 13 -17.911 4.107 -3.881 1.00 33.43 C ATOM 166 CZ PHE A 13 -17.504 3.760 -5.179 1.00 34.22 C ATOM 0 H PHE A 13 -17.095 1.149 -1.977 1.00 13.11 H new ATOM 0 HA PHE A 13 -14.373 0.541 -2.067 1.00 34.24 H new ATOM 0 HB2 PHE A 13 -15.475 3.113 -0.893 1.00 74.24 H new ATOM 0 HB3 PHE A 13 -14.085 2.905 -1.941 1.00 74.24 H new ATOM 0 HD1 PHE A 13 -14.616 2.107 -4.412 1.00 73.24 H new ATOM 0 HD2 PHE A 13 -17.469 3.965 -1.776 1.00 24.24 H new ATOM 0 HE1 PHE A 13 -16.029 2.723 -6.360 1.00 3.12 H new ATOM 0 HE2 PHE A 13 -18.816 4.677 -3.734 1.00 33.43 H new ATOM 0 HZ PHE A 13 -18.093 4.064 -6.032 1.00 34.22 H new ATOM 176 N LYS A 14 -15.593 0.728 0.957 1.00 11.11 N ATOM 177 CA LYS A 14 -15.270 0.516 2.362 1.00 31.45 C ATOM 178 C LYS A 14 -15.210 -0.979 2.645 1.00 3.45 C ATOM 179 O LYS A 14 -14.236 -1.417 3.246 1.00 74.23 O ATOM 180 CB LYS A 14 -16.261 1.280 3.255 1.00 44.11 C ATOM 181 CG LYS A 14 -15.729 1.534 4.676 1.00 42.23 C ATOM 182 CD LYS A 14 -14.432 2.364 4.706 1.00 74.53 C ATOM 183 CE LYS A 14 -14.470 3.382 5.849 1.00 23.24 C ATOM 184 NZ LYS A 14 -13.234 4.191 5.924 1.00 20.22 N ATOM 0 H LYS A 14 -16.592 0.704 0.754 1.00 11.11 H new ATOM 0 HA LYS A 14 -14.285 0.920 2.597 1.00 31.45 H new ATOM 0 HB2 LYS A 14 -16.499 2.235 2.787 1.00 44.11 H new ATOM 0 HB3 LYS A 14 -17.192 0.716 3.318 1.00 44.11 H new ATOM 0 HG2 LYS A 14 -16.495 2.050 5.256 1.00 42.23 H new ATOM 0 HG3 LYS A 14 -15.550 0.577 5.165 1.00 42.23 H new ATOM 0 HD2 LYS A 14 -13.574 1.703 4.829 1.00 74.53 H new ATOM 0 HD3 LYS A 14 -14.303 2.881 3.755 1.00 74.53 H new ATOM 0 HE2 LYS A 14 -15.326 4.043 5.715 1.00 23.24 H new ATOM 0 HE3 LYS A 14 -14.616 2.858 6.794 1.00 23.24 H new ATOM 0 HZ1 LYS A 14 -13.308 4.865 6.713 1.00 20.22 H new ATOM 0 HZ2 LYS A 14 -12.418 3.565 6.079 1.00 20.22 H new ATOM 0 HZ3 LYS A 14 -13.106 4.713 5.034 1.00 20.22 H new ATOM 198 N SER A 15 -16.140 -1.764 2.099 1.00 62.30 N ATOM 199 CA SER A 15 -16.223 -3.207 2.229 1.00 44.01 C ATOM 200 C SER A 15 -14.910 -3.900 1.900 1.00 0.11 C ATOM 201 O SER A 15 -14.562 -4.860 2.597 1.00 41.10 O ATOM 202 CB SER A 15 -17.318 -3.676 1.277 1.00 4.34 C ATOM 203 OG SER A 15 -18.612 -3.372 1.767 1.00 35.32 O ATOM 0 H SER A 15 -16.892 -1.383 1.525 1.00 62.30 H new ATOM 0 HA SER A 15 -16.448 -3.464 3.264 1.00 44.01 H new ATOM 0 HB2 SER A 15 -17.179 -3.205 0.304 1.00 4.34 H new ATOM 0 HB3 SER A 15 -17.231 -4.752 1.126 1.00 4.34 H new ATOM 0 HG SER A 15 -19.286 -3.687 1.129 1.00 35.32 H new ATOM 209 N PHE A 16 -14.186 -3.445 0.864 1.00 3.05 N ATOM 210 CA PHE A 16 -12.918 -4.092 0.570 1.00 11.35 C ATOM 211 C PHE A 16 -11.855 -3.711 1.613 1.00 61.13 C ATOM 212 O PHE A 16 -11.104 -4.581 2.070 1.00 61.14 O ATOM 213 CB PHE A 16 -12.467 -3.864 -0.882 1.00 51.10 C ATOM 214 CG PHE A 16 -11.550 -2.678 -1.104 1.00 15.14 C ATOM 215 CD1 PHE A 16 -12.091 -1.390 -1.239 1.00 52.31 C ATOM 216 CD2 PHE A 16 -10.152 -2.852 -1.125 1.00 15.13 C ATOM 217 CE1 PHE A 16 -11.238 -0.284 -1.383 1.00 1.42 C ATOM 218 CE2 PHE A 16 -9.302 -1.747 -1.295 1.00 24.45 C ATOM 219 CZ PHE A 16 -9.846 -0.461 -1.427 1.00 4.03 C ATOM 0 H PHE A 16 -14.446 -2.673 0.251 1.00 3.05 H new ATOM 0 HA PHE A 16 -13.062 -5.169 0.652 1.00 11.35 H new ATOM 0 HB2 PHE A 16 -11.960 -4.763 -1.231 1.00 51.10 H new ATOM 0 HB3 PHE A 16 -13.354 -3.736 -1.503 1.00 51.10 H new ATOM 0 HD1 PHE A 16 -13.162 -1.250 -1.232 1.00 52.31 H new ATOM 0 HD2 PHE A 16 -9.732 -3.840 -1.010 1.00 15.13 H new ATOM 0 HE1 PHE A 16 -11.655 0.709 -1.460 1.00 1.42 H new ATOM 0 HE2 PHE A 16 -8.232 -1.887 -1.324 1.00 24.45 H new ATOM 0 HZ PHE A 16 -9.196 0.391 -1.562 1.00 4.03 H new ATOM 229 N LEU A 17 -11.803 -2.426 1.979 1.00 14.42 N ATOM 230 CA LEU A 17 -10.691 -1.805 2.691 1.00 52.43 C ATOM 231 C LEU A 17 -10.765 -2.090 4.193 1.00 41.31 C ATOM 232 O LEU A 17 -9.753 -2.433 4.806 1.00 12.35 O ATOM 233 CB LEU A 17 -10.711 -0.294 2.395 1.00 20.31 C ATOM 234 CG LEU A 17 -9.413 0.483 2.689 1.00 22.14 C ATOM 235 CD1 LEU A 17 -9.018 0.515 4.167 1.00 75.30 C ATOM 236 CD2 LEU A 17 -8.218 0.012 1.851 1.00 44.32 C ATOM 0 H LEU A 17 -12.560 -1.772 1.779 1.00 14.42 H new ATOM 0 HA LEU A 17 -9.748 -2.228 2.346 1.00 52.43 H new ATOM 0 HB2 LEU A 17 -10.960 -0.156 1.343 1.00 20.31 H new ATOM 0 HB3 LEU A 17 -11.517 0.156 2.975 1.00 20.31 H new ATOM 0 HG LEU A 17 -9.664 1.502 2.394 1.00 22.14 H new ATOM 0 HD11 LEU A 17 -8.094 1.081 4.285 1.00 75.30 H new ATOM 0 HD12 LEU A 17 -9.811 0.990 4.745 1.00 75.30 H new ATOM 0 HD13 LEU A 17 -8.867 -0.503 4.525 1.00 75.30 H new ATOM 0 HD21 LEU A 17 -7.338 0.601 2.109 1.00 44.32 H new ATOM 0 HD22 LEU A 17 -8.022 -1.041 2.056 1.00 44.32 H new ATOM 0 HD23 LEU A 17 -8.443 0.140 0.792 1.00 44.32 H new ATOM 248 N ASP A 18 -11.958 -1.992 4.786 1.00 12.12 N ATOM 249 CA ASP A 18 -12.222 -2.291 6.197 1.00 14.21 C ATOM 250 C ASP A 18 -11.731 -3.692 6.530 1.00 44.03 C ATOM 251 O ASP A 18 -10.996 -3.872 7.501 1.00 2.41 O ATOM 252 CB ASP A 18 -13.724 -2.179 6.507 1.00 14.32 C ATOM 253 CG ASP A 18 -14.107 -2.888 7.817 1.00 54.03 C ATOM 254 OD1 ASP A 18 -13.941 -2.307 8.912 1.00 23.13 O ATOM 255 OD2 ASP A 18 -14.628 -4.025 7.734 1.00 12.23 O ATOM 0 H ASP A 18 -12.793 -1.693 4.282 1.00 12.12 H new ATOM 0 HA ASP A 18 -11.687 -1.564 6.808 1.00 14.21 H new ATOM 0 HB2 ASP A 18 -14.001 -1.127 6.572 1.00 14.32 H new ATOM 0 HB3 ASP A 18 -14.295 -2.609 5.684 1.00 14.32 H new ATOM 260 N LYS A 19 -12.086 -4.668 5.685 1.00 35.33 N ATOM 261 CA LYS A 19 -11.636 -6.037 5.866 1.00 54.04 C ATOM 262 C LYS A 19 -10.135 -6.122 5.703 1.00 23.54 C ATOM 263 O LYS A 19 -9.486 -6.779 6.508 1.00 22.41 O ATOM 264 CB LYS A 19 -12.331 -7.016 4.900 1.00 20.31 C ATOM 265 CG LYS A 19 -13.074 -8.054 5.745 1.00 21.24 C ATOM 266 CD LYS A 19 -13.548 -9.257 4.933 1.00 14.41 C ATOM 267 CE LYS A 19 -14.367 -10.179 5.840 1.00 4.41 C ATOM 268 NZ LYS A 19 -13.547 -10.955 6.793 1.00 23.53 N ATOM 0 H LYS A 19 -12.684 -4.526 4.871 1.00 35.33 H new ATOM 0 HA LYS A 19 -11.909 -6.333 6.879 1.00 54.04 H new ATOM 0 HB2 LYS A 19 -13.026 -6.484 4.250 1.00 20.31 H new ATOM 0 HB3 LYS A 19 -11.599 -7.501 4.255 1.00 20.31 H new ATOM 0 HG2 LYS A 19 -12.419 -8.398 6.546 1.00 21.24 H new ATOM 0 HG3 LYS A 19 -13.934 -7.581 6.218 1.00 21.24 H new ATOM 0 HD2 LYS A 19 -14.152 -8.926 4.088 1.00 14.41 H new ATOM 0 HD3 LYS A 19 -12.693 -9.795 4.523 1.00 14.41 H new ATOM 0 HE2 LYS A 19 -15.087 -9.580 6.398 1.00 4.41 H new ATOM 0 HE3 LYS A 19 -14.939 -10.869 5.220 1.00 4.41 H new ATOM 0 HZ1 LYS A 19 -14.166 -11.556 7.374 1.00 23.53 H new ATOM 0 HZ2 LYS A 19 -12.877 -11.553 6.268 1.00 23.53 H new ATOM 0 HZ3 LYS A 19 -13.020 -10.303 7.409 1.00 23.53 H new ATOM 282 N PHE A 20 -9.586 -5.495 4.664 1.00 34.32 N ATOM 283 CA PHE A 20 -8.171 -5.555 4.345 1.00 21.33 C ATOM 284 C PHE A 20 -7.334 -5.066 5.537 1.00 52.41 C ATOM 285 O PHE A 20 -6.392 -5.743 5.929 1.00 31.44 O ATOM 286 CB PHE A 20 -7.948 -4.772 3.044 1.00 55.44 C ATOM 287 CG PHE A 20 -6.514 -4.411 2.759 1.00 21.22 C ATOM 288 CD1 PHE A 20 -5.684 -5.283 2.037 1.00 20.55 C ATOM 289 CD2 PHE A 20 -6.016 -3.181 3.211 1.00 4.35 C ATOM 290 CE1 PHE A 20 -4.340 -4.945 1.807 1.00 71.11 C ATOM 291 CE2 PHE A 20 -4.676 -2.844 2.989 1.00 62.33 C ATOM 292 CZ PHE A 20 -3.830 -3.733 2.303 1.00 34.33 C ATOM 0 H PHE A 20 -10.125 -4.924 4.013 1.00 34.32 H new ATOM 0 HA PHE A 20 -7.836 -6.578 4.171 1.00 21.33 H new ATOM 0 HB2 PHE A 20 -8.331 -5.362 2.212 1.00 55.44 H new ATOM 0 HB3 PHE A 20 -8.537 -3.856 3.083 1.00 55.44 H new ATOM 0 HD1 PHE A 20 -6.079 -6.214 1.658 1.00 20.55 H new ATOM 0 HD2 PHE A 20 -6.667 -2.493 3.731 1.00 4.35 H new ATOM 0 HE1 PHE A 20 -3.701 -5.614 1.251 1.00 71.11 H new ATOM 0 HE2 PHE A 20 -4.291 -1.900 3.345 1.00 62.33 H new ATOM 0 HZ PHE A 20 -2.789 -3.485 2.157 1.00 34.33 H new ATOM 302 N THR A 21 -7.711 -3.950 6.163 1.00 32.13 N ATOM 303 CA THR A 21 -7.033 -3.436 7.355 1.00 15.33 C ATOM 304 C THR A 21 -7.381 -4.192 8.646 1.00 63.31 C ATOM 305 O THR A 21 -6.831 -3.880 9.702 1.00 32.15 O ATOM 306 CB THR A 21 -7.289 -1.928 7.514 1.00 22.41 C ATOM 307 OG1 THR A 21 -8.618 -1.523 7.201 1.00 2.24 O ATOM 308 CG2 THR A 21 -6.333 -1.126 6.641 1.00 22.34 C ATOM 0 H THR A 21 -8.497 -3.376 5.857 1.00 32.13 H new ATOM 0 HA THR A 21 -5.969 -3.607 7.193 1.00 15.33 H new ATOM 0 HB THR A 21 -7.125 -1.728 8.573 1.00 22.41 H new ATOM 0 HG1 THR A 21 -8.703 -0.555 7.327 1.00 2.24 H new ATOM 0 HG21 THR A 21 -6.530 -0.062 6.768 1.00 22.34 H new ATOM 0 HG22 THR A 21 -5.305 -1.342 6.933 1.00 22.34 H new ATOM 0 HG23 THR A 21 -6.478 -1.400 5.596 1.00 22.34 H new ATOM 316 N SER A 22 -8.266 -5.189 8.589 1.00 40.52 N ATOM 317 CA SER A 22 -8.692 -5.974 9.736 1.00 32.05 C ATOM 318 C SER A 22 -8.498 -7.474 9.464 1.00 34.14 C ATOM 319 O SER A 22 -9.218 -8.303 10.024 1.00 22.45 O ATOM 320 CB SER A 22 -10.129 -5.559 10.084 1.00 4.22 C ATOM 321 OG SER A 22 -10.479 -5.944 11.399 1.00 23.14 O ATOM 0 H SER A 22 -8.714 -5.476 7.719 1.00 40.52 H new ATOM 0 HA SER A 22 -8.078 -5.777 10.615 1.00 32.05 H new ATOM 0 HB2 SER A 22 -10.231 -4.479 9.981 1.00 4.22 H new ATOM 0 HB3 SER A 22 -10.821 -6.013 9.375 1.00 4.22 H new ATOM 0 HG SER A 22 -10.229 -6.881 11.543 1.00 23.14 H new ATOM 327 N SER A 23 -7.555 -7.832 8.590 1.00 61.22 N ATOM 328 CA SER A 23 -7.138 -9.199 8.322 1.00 32.35 C ATOM 329 C SER A 23 -5.684 -9.176 7.853 1.00 63.44 C ATOM 330 O SER A 23 -5.209 -8.152 7.355 1.00 35.33 O ATOM 331 CB SER A 23 -8.062 -9.815 7.269 1.00 53.10 C ATOM 332 OG SER A 23 -8.148 -9.000 6.119 1.00 34.22 O ATOM 0 H SER A 23 -7.045 -7.148 8.031 1.00 61.22 H new ATOM 0 HA SER A 23 -7.206 -9.812 9.221 1.00 32.35 H new ATOM 0 HB2 SER A 23 -7.692 -10.802 6.991 1.00 53.10 H new ATOM 0 HB3 SER A 23 -9.056 -9.955 7.693 1.00 53.10 H new ATOM 0 HG SER A 23 -8.762 -8.256 6.290 1.00 34.22 H new ATOM 338 N ALA A 24 -4.987 -10.308 7.957 1.00 61.01 N ATOM 339 CA ALA A 24 -3.645 -10.487 7.418 1.00 54.10 C ATOM 340 C ALA A 24 -3.740 -11.376 6.185 1.00 35.31 C ATOM 341 O ALA A 24 -3.438 -10.949 5.071 1.00 22.22 O ATOM 342 CB ALA A 24 -2.725 -11.081 8.491 1.00 3.44 C ATOM 0 H ALA A 24 -5.348 -11.138 8.427 1.00 61.01 H new ATOM 0 HA ALA A 24 -3.213 -9.530 7.125 1.00 54.10 H new ATOM 0 HB1 ALA A 24 -1.724 -11.212 8.080 1.00 3.44 H new ATOM 0 HB2 ALA A 24 -2.681 -10.407 9.346 1.00 3.44 H new ATOM 0 HB3 ALA A 24 -3.115 -12.047 8.810 1.00 3.44 H new ATOM 348 N ALA A 25 -4.197 -12.618 6.363 1.00 2.42 N ATOM 349 CA ALA A 25 -4.238 -13.624 5.305 1.00 23.13 C ATOM 350 C ALA A 25 -5.207 -13.272 4.166 1.00 60.43 C ATOM 351 O ALA A 25 -5.172 -13.898 3.104 1.00 0.14 O ATOM 352 CB ALA A 25 -4.617 -14.972 5.917 1.00 40.54 C ATOM 0 H ALA A 25 -4.553 -12.955 7.258 1.00 2.42 H new ATOM 0 HA ALA A 25 -3.245 -13.666 4.857 1.00 23.13 H new ATOM 0 HB1 ALA A 25 -4.650 -15.730 5.135 1.00 40.54 H new ATOM 0 HB2 ALA A 25 -3.875 -15.254 6.664 1.00 40.54 H new ATOM 0 HB3 ALA A 25 -5.596 -14.895 6.389 1.00 40.54 H new ATOM 358 N PHE A 26 -6.071 -12.278 4.366 1.00 2.11 N ATOM 359 CA PHE A 26 -7.041 -11.819 3.380 1.00 74.50 C ATOM 360 C PHE A 26 -6.561 -10.580 2.621 1.00 1.12 C ATOM 361 O PHE A 26 -7.182 -10.172 1.643 1.00 72.13 O ATOM 362 CB PHE A 26 -8.391 -11.586 4.058 1.00 43.40 C ATOM 363 CG PHE A 26 -9.551 -12.090 3.224 1.00 55.10 C ATOM 364 CD1 PHE A 26 -10.140 -11.270 2.242 1.00 52.40 C ATOM 365 CD2 PHE A 26 -10.003 -13.412 3.389 1.00 0.25 C ATOM 366 CE1 PHE A 26 -11.173 -11.772 1.430 1.00 0.13 C ATOM 367 CE2 PHE A 26 -11.042 -13.909 2.586 1.00 41.30 C ATOM 368 CZ PHE A 26 -11.623 -13.093 1.601 1.00 13.32 C ATOM 0 H PHE A 26 -6.115 -11.758 5.242 1.00 2.11 H new ATOM 0 HA PHE A 26 -7.157 -12.599 2.628 1.00 74.50 H new ATOM 0 HB2 PHE A 26 -8.399 -12.086 5.026 1.00 43.40 H new ATOM 0 HB3 PHE A 26 -8.520 -10.520 4.248 1.00 43.40 H new ATOM 0 HD1 PHE A 26 -9.798 -10.254 2.112 1.00 52.40 H new ATOM 0 HD2 PHE A 26 -9.549 -14.047 4.136 1.00 0.25 H new ATOM 0 HE1 PHE A 26 -11.621 -11.143 0.675 1.00 0.13 H new ATOM 0 HE2 PHE A 26 -11.395 -14.920 2.726 1.00 41.30 H new ATOM 0 HZ PHE A 26 -12.414 -13.480 0.976 1.00 13.32 H new ATOM 378 N GLN A 27 -5.430 -9.991 3.014 1.00 31.33 N ATOM 379 CA GLN A 27 -4.824 -8.915 2.234 1.00 61.51 C ATOM 380 C GLN A 27 -4.396 -9.434 0.859 1.00 62.24 C ATOM 381 O GLN A 27 -4.715 -8.851 -0.176 1.00 75.42 O ATOM 382 CB GLN A 27 -3.647 -8.264 2.978 1.00 21.13 C ATOM 383 CG GLN A 27 -4.133 -7.541 4.242 1.00 31.42 C ATOM 384 CD GLN A 27 -3.141 -6.527 4.807 1.00 4.14 C ATOM 385 OE1 GLN A 27 -2.217 -6.080 4.122 1.00 11.33 O ATOM 386 NE2 GLN A 27 -3.331 -6.168 6.062 1.00 35.04 N ATOM 0 H GLN A 27 -4.920 -10.240 3.861 1.00 31.33 H new ATOM 0 HA GLN A 27 -5.575 -8.138 2.091 1.00 61.51 H new ATOM 0 HB2 GLN A 27 -2.916 -9.026 3.248 1.00 21.13 H new ATOM 0 HB3 GLN A 27 -3.142 -7.556 2.320 1.00 21.13 H new ATOM 0 HG2 GLN A 27 -5.069 -7.029 4.017 1.00 31.42 H new ATOM 0 HG3 GLN A 27 -4.352 -8.283 5.009 1.00 31.42 H new ATOM 0 HE21 GLN A 27 -4.108 -6.562 6.593 1.00 35.04 H new ATOM 0 HE22 GLN A 27 -2.701 -5.497 6.501 1.00 35.04 H new ATOM 395 N TYR A 28 -3.699 -10.568 0.833 1.00 42.34 N ATOM 396 CA TYR A 28 -3.005 -11.082 -0.342 1.00 3.45 C ATOM 397 C TYR A 28 -3.914 -11.318 -1.554 1.00 75.10 C ATOM 398 O TYR A 28 -3.525 -11.034 -2.690 1.00 64.21 O ATOM 399 CB TYR A 28 -2.309 -12.376 0.074 1.00 0.43 C ATOM 400 CG TYR A 28 -1.338 -12.197 1.220 1.00 0.25 C ATOM 401 CD1 TYR A 28 -0.092 -11.610 0.959 1.00 12.25 C ATOM 402 CD2 TYR A 28 -1.666 -12.596 2.531 1.00 11.44 C ATOM 403 CE1 TYR A 28 0.870 -11.501 1.968 1.00 35.25 C ATOM 404 CE2 TYR A 28 -0.707 -12.473 3.558 1.00 34.02 C ATOM 405 CZ TYR A 28 0.578 -11.957 3.270 1.00 3.14 C ATOM 406 OH TYR A 28 1.535 -11.898 4.238 1.00 55.54 O ATOM 0 H TYR A 28 -3.600 -11.169 1.651 1.00 42.34 H new ATOM 0 HA TYR A 28 -2.293 -10.328 -0.676 1.00 3.45 H new ATOM 0 HB2 TYR A 28 -3.063 -13.110 0.358 1.00 0.43 H new ATOM 0 HB3 TYR A 28 -1.775 -12.784 -0.784 1.00 0.43 H new ATOM 0 HD1 TYR A 28 0.127 -11.238 -0.031 1.00 12.25 H new ATOM 0 HD2 TYR A 28 -2.646 -12.994 2.748 1.00 11.44 H new ATOM 0 HE1 TYR A 28 1.835 -11.068 1.750 1.00 35.25 H new ATOM 0 HE2 TYR A 28 -0.954 -12.773 4.566 1.00 34.02 H new ATOM 0 HH TYR A 28 1.173 -12.250 5.078 1.00 55.54 H new ATOM 416 N THR A 29 -5.136 -11.802 -1.328 1.00 13.31 N ATOM 417 CA THR A 29 -6.137 -12.080 -2.359 1.00 41.20 C ATOM 418 C THR A 29 -6.602 -10.800 -3.089 1.00 51.34 C ATOM 419 O THR A 29 -7.177 -10.884 -4.176 1.00 35.54 O ATOM 420 CB THR A 29 -7.288 -12.906 -1.722 1.00 33.32 C ATOM 421 OG1 THR A 29 -8.428 -13.009 -2.551 1.00 4.13 O ATOM 422 CG2 THR A 29 -7.784 -12.378 -0.376 1.00 34.22 C ATOM 0 H THR A 29 -5.468 -12.019 -0.388 1.00 13.31 H new ATOM 0 HA THR A 29 -5.694 -12.682 -3.153 1.00 41.20 H new ATOM 0 HB THR A 29 -6.816 -13.879 -1.582 1.00 33.32 H new ATOM 0 HG1 THR A 29 -9.115 -13.540 -2.097 1.00 4.13 H new ATOM 0 HG21 THR A 29 -8.587 -13.017 -0.008 1.00 34.22 H new ATOM 0 HG22 THR A 29 -6.962 -12.379 0.340 1.00 34.22 H new ATOM 0 HG23 THR A 29 -8.157 -11.361 -0.499 1.00 34.22 H new ATOM 430 N ARG A 30 -6.319 -9.602 -2.569 1.00 33.15 N ATOM 431 CA ARG A 30 -7.038 -8.368 -2.890 1.00 15.44 C ATOM 432 C ARG A 30 -6.166 -7.432 -3.737 1.00 14.45 C ATOM 433 O ARG A 30 -6.318 -6.211 -3.677 1.00 43.34 O ATOM 434 CB ARG A 30 -7.527 -7.815 -1.531 1.00 31.45 C ATOM 435 CG ARG A 30 -8.593 -6.712 -1.571 1.00 22.32 C ATOM 436 CD ARG A 30 -9.551 -6.801 -0.369 1.00 15.25 C ATOM 437 NE ARG A 30 -10.766 -7.528 -0.753 1.00 60.20 N ATOM 438 CZ ARG A 30 -11.943 -7.571 -0.129 1.00 40.14 C ATOM 439 NH1 ARG A 30 -12.067 -7.211 1.145 1.00 0.22 N ATOM 440 NH2 ARG A 30 -13.003 -7.947 -0.827 1.00 51.21 N ATOM 0 H ARG A 30 -5.565 -9.461 -1.897 1.00 33.15 H new ATOM 0 HA ARG A 30 -7.909 -8.514 -3.529 1.00 15.44 H new ATOM 0 HB2 ARG A 30 -7.922 -8.647 -0.949 1.00 31.45 H new ATOM 0 HB3 ARG A 30 -6.662 -7.431 -0.991 1.00 31.45 H new ATOM 0 HG2 ARG A 30 -8.107 -5.736 -1.577 1.00 22.32 H new ATOM 0 HG3 ARG A 30 -9.163 -6.790 -2.497 1.00 22.32 H new ATOM 0 HD2 ARG A 30 -9.060 -7.308 0.462 1.00 15.25 H new ATOM 0 HD3 ARG A 30 -9.809 -5.800 -0.024 1.00 15.25 H new ATOM 0 HE ARG A 30 -10.701 -8.074 -1.612 1.00 60.20 H new ATOM 0 HH11 ARG A 30 -11.250 -6.893 1.667 1.00 0.22 H new ATOM 0 HH12 ARG A 30 -12.979 -7.253 1.600 1.00 0.22 H new ATOM 0 HH21 ARG A 30 -12.904 -8.193 -1.812 1.00 51.21 H new ATOM 0 HH22 ARG A 30 -13.919 -7.991 -0.380 1.00 51.21 H new ATOM 454 N VAL A 31 -5.228 -7.998 -4.508 1.00 55.43 N ATOM 455 CA VAL A 31 -4.126 -7.298 -5.171 1.00 31.51 C ATOM 456 C VAL A 31 -3.877 -7.922 -6.562 1.00 3.01 C ATOM 457 O VAL A 31 -3.814 -9.153 -6.707 1.00 40.44 O ATOM 458 CB VAL A 31 -2.874 -7.368 -4.267 1.00 61.42 C ATOM 459 CG1 VAL A 31 -1.752 -6.447 -4.758 1.00 34.52 C ATOM 460 CG2 VAL A 31 -3.127 -7.017 -2.789 1.00 24.23 C ATOM 0 H VAL A 31 -5.219 -9.001 -4.693 1.00 55.43 H new ATOM 0 HA VAL A 31 -4.373 -6.248 -5.326 1.00 31.51 H new ATOM 0 HB VAL A 31 -2.584 -8.417 -4.332 1.00 61.42 H new ATOM 0 HG11 VAL A 31 -0.894 -6.531 -4.091 1.00 34.52 H new ATOM 0 HG12 VAL A 31 -1.457 -6.738 -5.766 1.00 34.52 H new ATOM 0 HG13 VAL A 31 -2.105 -5.416 -4.767 1.00 34.52 H new ATOM 0 HG21 VAL A 31 -2.193 -7.093 -2.232 1.00 24.23 H new ATOM 0 HG22 VAL A 31 -3.511 -5.999 -2.717 1.00 24.23 H new ATOM 0 HG23 VAL A 31 -3.857 -7.710 -2.370 1.00 24.23 H new ATOM 470 N LYS A 32 -3.795 -7.073 -7.591 1.00 0.35 N ATOM 471 CA LYS A 32 -3.387 -7.329 -8.978 1.00 12.45 C ATOM 472 C LYS A 32 -1.862 -7.333 -9.052 1.00 42.43 C ATOM 473 O LYS A 32 -1.209 -6.811 -8.161 1.00 11.33 O ATOM 474 CB LYS A 32 -3.900 -6.170 -9.864 1.00 63.52 C ATOM 475 CG LYS A 32 -5.094 -6.514 -10.754 1.00 32.21 C ATOM 476 CD LYS A 32 -4.706 -7.368 -11.966 1.00 41.33 C ATOM 477 CE LYS A 32 -5.872 -7.490 -12.953 1.00 1.23 C ATOM 478 NZ LYS A 32 -6.035 -6.259 -13.767 1.00 54.01 N ATOM 0 H LYS A 32 -4.037 -6.091 -7.461 1.00 0.35 H new ATOM 0 HA LYS A 32 -3.791 -8.284 -9.313 1.00 12.45 H new ATOM 0 HB2 LYS A 32 -4.176 -5.335 -9.220 1.00 63.52 H new ATOM 0 HB3 LYS A 32 -3.081 -5.827 -10.497 1.00 63.52 H new ATOM 0 HG2 LYS A 32 -5.839 -7.047 -10.164 1.00 32.21 H new ATOM 0 HG3 LYS A 32 -5.561 -5.592 -11.100 1.00 32.21 H new ATOM 0 HD2 LYS A 32 -3.846 -6.923 -12.467 1.00 41.33 H new ATOM 0 HD3 LYS A 32 -4.402 -8.360 -11.633 1.00 41.33 H new ATOM 0 HE2 LYS A 32 -5.703 -8.342 -13.612 1.00 1.23 H new ATOM 0 HE3 LYS A 32 -6.793 -7.688 -12.405 1.00 1.23 H new ATOM 0 HZ1 LYS A 32 -6.800 -6.398 -14.457 1.00 54.01 H new ATOM 0 HZ2 LYS A 32 -6.271 -5.460 -13.145 1.00 54.01 H new ATOM 0 HZ3 LYS A 32 -5.148 -6.055 -14.270 1.00 54.01 H new ATOM 492 N PHE A 33 -1.289 -7.876 -10.125 1.00 23.34 N ATOM 493 CA PHE A 33 0.142 -7.796 -10.417 1.00 55.01 C ATOM 494 C PHE A 33 0.313 -7.742 -11.942 1.00 0.33 C ATOM 495 O PHE A 33 -0.657 -8.053 -12.639 1.00 11.35 O ATOM 496 CB PHE A 33 0.867 -9.011 -9.821 1.00 3.25 C ATOM 497 CG PHE A 33 0.887 -9.009 -8.308 1.00 12.44 C ATOM 498 CD1 PHE A 33 1.856 -8.258 -7.614 1.00 0.31 C ATOM 499 CD2 PHE A 33 -0.158 -9.631 -7.598 1.00 12.22 C ATOM 500 CE1 PHE A 33 1.774 -8.130 -6.221 1.00 33.35 C ATOM 501 CE2 PHE A 33 -0.268 -9.447 -6.212 1.00 3.34 C ATOM 502 CZ PHE A 33 0.707 -8.711 -5.517 1.00 21.35 C ATOM 0 H PHE A 33 -1.816 -8.393 -10.829 1.00 23.34 H new ATOM 0 HA PHE A 33 0.577 -6.902 -9.970 1.00 55.01 H new ATOM 0 HB2 PHE A 33 0.382 -9.923 -10.170 1.00 3.25 H new ATOM 0 HB3 PHE A 33 1.892 -9.032 -10.192 1.00 3.25 H new ATOM 0 HD1 PHE A 33 2.661 -7.782 -8.155 1.00 0.31 H new ATOM 0 HD2 PHE A 33 -0.874 -10.249 -8.120 1.00 12.22 H new ATOM 0 HE1 PHE A 33 2.535 -7.582 -5.686 1.00 33.35 H new ATOM 0 HE2 PHE A 33 -1.104 -9.872 -5.677 1.00 3.34 H new ATOM 0 HZ PHE A 33 0.636 -8.593 -4.446 1.00 21.35 H new ATOM 512 N PRO A 34 1.493 -7.377 -12.484 1.00 74.42 N ATOM 513 CA PRO A 34 2.558 -6.657 -11.786 1.00 64.10 C ATOM 514 C PRO A 34 2.038 -5.297 -11.297 1.00 42.44 C ATOM 515 O PRO A 34 0.934 -4.880 -11.658 1.00 63.13 O ATOM 516 CB PRO A 34 3.691 -6.519 -12.811 1.00 32.12 C ATOM 517 CG PRO A 34 2.945 -6.470 -14.142 1.00 11.01 C ATOM 518 CD PRO A 34 1.769 -7.418 -13.915 1.00 75.21 C ATOM 0 HA PRO A 34 2.911 -7.177 -10.896 1.00 64.10 H new ATOM 0 HB2 PRO A 34 4.279 -5.616 -12.644 1.00 32.12 H new ATOM 0 HB3 PRO A 34 4.381 -7.361 -12.766 1.00 32.12 H new ATOM 0 HG2 PRO A 34 2.609 -5.460 -14.379 1.00 11.01 H new ATOM 0 HG3 PRO A 34 3.574 -6.799 -14.969 1.00 11.01 H new ATOM 0 HD2 PRO A 34 0.898 -7.104 -14.490 1.00 75.21 H new ATOM 0 HD3 PRO A 34 2.015 -8.430 -14.236 1.00 75.21 H new ATOM 526 N LEU A 35 2.802 -4.627 -10.439 1.00 33.14 N ATOM 527 CA LEU A 35 2.438 -3.317 -9.908 1.00 13.02 C ATOM 528 C LEU A 35 3.250 -2.248 -10.623 1.00 40.40 C ATOM 529 O LEU A 35 4.278 -2.545 -11.245 1.00 0.05 O ATOM 530 CB LEU A 35 2.744 -3.247 -8.414 1.00 33.21 C ATOM 531 CG LEU A 35 2.007 -4.244 -7.514 1.00 13.14 C ATOM 532 CD1 LEU A 35 2.563 -4.068 -6.115 1.00 13.45 C ATOM 533 CD2 LEU A 35 0.492 -4.120 -7.460 1.00 54.01 C ATOM 0 H LEU A 35 3.694 -4.979 -10.091 1.00 33.14 H new ATOM 0 HA LEU A 35 1.371 -3.156 -10.065 1.00 13.02 H new ATOM 0 HB2 LEU A 35 3.816 -3.394 -8.279 1.00 33.21 H new ATOM 0 HB3 LEU A 35 2.514 -2.240 -8.066 1.00 33.21 H new ATOM 0 HG LEU A 35 2.179 -5.230 -7.945 1.00 13.14 H new ATOM 0 HD11 LEU A 35 2.066 -4.761 -5.436 1.00 13.45 H new ATOM 0 HD12 LEU A 35 3.634 -4.272 -6.121 1.00 13.45 H new ATOM 0 HD13 LEU A 35 2.390 -3.045 -5.781 1.00 13.45 H new ATOM 0 HD21 LEU A 35 0.088 -4.880 -6.791 1.00 54.01 H new ATOM 0 HD22 LEU A 35 0.221 -3.131 -7.092 1.00 54.01 H new ATOM 0 HD23 LEU A 35 0.080 -4.261 -8.459 1.00 54.01 H new ATOM 545 N LYS A 36 2.822 -0.996 -10.468 1.00 2.11 N ATOM 546 CA LYS A 36 3.355 0.095 -11.302 1.00 20.23 C ATOM 547 C LYS A 36 4.766 0.450 -10.902 1.00 72.10 C ATOM 548 O LYS A 36 5.622 0.603 -11.779 1.00 35.25 O ATOM 549 CB LYS A 36 2.515 1.384 -11.259 1.00 12.15 C ATOM 550 CG LYS A 36 1.034 1.113 -11.475 1.00 3.24 C ATOM 551 CD LYS A 36 0.771 0.444 -12.844 1.00 21.33 C ATOM 552 CE LYS A 36 -0.693 0.552 -13.290 1.00 21.45 C ATOM 553 NZ LYS A 36 -0.901 0.031 -14.664 1.00 34.52 N ATOM 0 H LYS A 36 2.120 -0.709 -9.786 1.00 2.11 H new ATOM 0 HA LYS A 36 3.322 -0.298 -12.318 1.00 20.23 H new ATOM 0 HB2 LYS A 36 2.656 1.875 -10.296 1.00 12.15 H new ATOM 0 HB3 LYS A 36 2.872 2.074 -12.024 1.00 12.15 H new ATOM 0 HG2 LYS A 36 0.661 0.470 -10.678 1.00 3.24 H new ATOM 0 HG3 LYS A 36 0.480 2.050 -11.415 1.00 3.24 H new ATOM 0 HD2 LYS A 36 1.410 0.906 -13.597 1.00 21.33 H new ATOM 0 HD3 LYS A 36 1.052 -0.608 -12.789 1.00 21.33 H new ATOM 0 HE2 LYS A 36 -1.325 -0.001 -12.594 1.00 21.45 H new ATOM 0 HE3 LYS A 36 -1.008 1.595 -13.247 1.00 21.45 H new ATOM 0 HZ1 LYS A 36 -1.904 0.124 -14.922 1.00 34.52 H new ATOM 0 HZ2 LYS A 36 -0.319 0.574 -15.333 1.00 34.52 H new ATOM 0 HZ3 LYS A 36 -0.626 -0.971 -14.701 1.00 34.52 H new ATOM 567 N THR A 37 4.967 0.613 -9.601 1.00 21.23 N ATOM 568 CA THR A 37 6.248 1.065 -9.048 1.00 72.14 C ATOM 569 C THR A 37 7.014 -0.144 -8.471 1.00 0.12 C ATOM 570 O THR A 37 6.772 -0.530 -7.328 1.00 52.14 O ATOM 571 CB THR A 37 6.079 2.289 -8.125 1.00 74.30 C ATOM 572 OG1 THR A 37 7.348 2.778 -7.748 1.00 74.30 O ATOM 573 CG2 THR A 37 5.324 2.076 -6.812 1.00 51.42 C ATOM 0 H THR A 37 4.251 0.437 -8.896 1.00 21.23 H new ATOM 0 HA THR A 37 6.891 1.459 -9.835 1.00 72.14 H new ATOM 0 HB THR A 37 5.483 2.968 -8.735 1.00 74.30 H new ATOM 0 HG1 THR A 37 7.238 3.556 -7.163 1.00 74.30 H new ATOM 0 HG21 THR A 37 5.279 3.016 -6.262 1.00 51.42 H new ATOM 0 HG22 THR A 37 4.312 1.731 -7.026 1.00 51.42 H new ATOM 0 HG23 THR A 37 5.842 1.329 -6.211 1.00 51.42 H new ATOM 581 N PRO A 38 7.819 -0.895 -9.259 1.00 71.41 N ATOM 582 CA PRO A 38 8.626 -2.004 -8.736 1.00 33.53 C ATOM 583 C PRO A 38 9.659 -1.510 -7.712 1.00 24.13 C ATOM 584 O PRO A 38 9.812 -0.309 -7.515 1.00 32.42 O ATOM 585 CB PRO A 38 9.283 -2.649 -9.958 1.00 41.41 C ATOM 586 CG PRO A 38 9.429 -1.474 -10.916 1.00 44.30 C ATOM 587 CD PRO A 38 8.173 -0.653 -10.649 1.00 21.53 C ATOM 0 HA PRO A 38 8.016 -2.728 -8.196 1.00 33.53 H new ATOM 0 HB2 PRO A 38 10.247 -3.094 -9.712 1.00 41.41 H new ATOM 0 HB3 PRO A 38 8.665 -3.441 -10.380 1.00 41.41 H new ATOM 0 HG2 PRO A 38 10.335 -0.901 -10.717 1.00 44.30 H new ATOM 0 HG3 PRO A 38 9.482 -1.804 -11.954 1.00 44.30 H new ATOM 0 HD2 PRO A 38 8.356 0.407 -10.825 1.00 21.53 H new ATOM 0 HD3 PRO A 38 7.363 -0.952 -11.315 1.00 21.53 H new ATOM 595 N ILE A 39 10.399 -2.432 -7.081 1.00 41.50 N ATOM 596 CA ILE A 39 11.321 -2.111 -5.982 1.00 72.34 C ATOM 597 C ILE A 39 12.297 -0.975 -6.335 1.00 73.43 C ATOM 598 O ILE A 39 12.536 -0.138 -5.479 1.00 63.40 O ATOM 599 CB ILE A 39 12.059 -3.394 -5.499 1.00 54.10 C ATOM 600 CG1 ILE A 39 11.113 -4.316 -4.691 1.00 3.55 C ATOM 601 CG2 ILE A 39 13.308 -3.108 -4.639 1.00 52.51 C ATOM 602 CD1 ILE A 39 10.439 -5.399 -5.530 1.00 15.13 C ATOM 0 H ILE A 39 10.375 -3.424 -7.319 1.00 41.50 H new ATOM 0 HA ILE A 39 10.723 -1.733 -5.153 1.00 72.34 H new ATOM 0 HB ILE A 39 12.387 -3.887 -6.414 1.00 54.10 H new ATOM 0 HG12 ILE A 39 11.681 -4.791 -3.891 1.00 3.55 H new ATOM 0 HG13 ILE A 39 10.344 -3.706 -4.218 1.00 3.55 H new ATOM 0 HG21 ILE A 39 13.768 -4.050 -4.341 1.00 52.51 H new ATOM 0 HG22 ILE A 39 14.022 -2.523 -5.218 1.00 52.51 H new ATOM 0 HG23 ILE A 39 13.017 -2.549 -3.750 1.00 52.51 H new ATOM 0 HD11 ILE A 39 9.793 -6.003 -4.893 1.00 15.13 H new ATOM 0 HD12 ILE A 39 9.842 -4.933 -6.314 1.00 15.13 H new ATOM 0 HD13 ILE A 39 11.200 -6.035 -5.982 1.00 15.13 H new ATOM 614 N THR A 40 12.897 -0.978 -7.531 1.00 14.43 N ATOM 615 CA THR A 40 13.863 0.016 -8.017 1.00 23.41 C ATOM 616 C THR A 40 14.907 0.383 -6.954 1.00 24.01 C ATOM 617 O THR A 40 14.799 1.367 -6.220 1.00 54.22 O ATOM 618 CB THR A 40 13.189 1.228 -8.673 1.00 74.03 C ATOM 619 OG1 THR A 40 12.089 0.795 -9.452 1.00 13.31 O ATOM 620 CG2 THR A 40 14.197 1.917 -9.606 1.00 44.32 C ATOM 0 H THR A 40 12.714 -1.708 -8.219 1.00 14.43 H new ATOM 0 HA THR A 40 14.425 -0.459 -8.821 1.00 23.41 H new ATOM 0 HB THR A 40 12.851 1.916 -7.898 1.00 74.03 H new ATOM 0 HG1 THR A 40 11.355 0.527 -8.861 1.00 13.31 H new ATOM 0 HG21 THR A 40 13.726 2.780 -10.077 1.00 44.32 H new ATOM 0 HG22 THR A 40 15.061 2.245 -9.029 1.00 44.32 H new ATOM 0 HG23 THR A 40 14.519 1.215 -10.375 1.00 44.32 H new ATOM 628 N LEU A 41 15.914 -0.470 -6.841 1.00 55.44 N ATOM 629 CA LEU A 41 17.039 -0.316 -5.934 1.00 13.45 C ATOM 630 C LEU A 41 18.263 0.059 -6.750 1.00 3.52 C ATOM 631 O LEU A 41 18.216 0.027 -7.981 1.00 32.11 O ATOM 632 CB LEU A 41 17.241 -1.619 -5.163 1.00 35.04 C ATOM 633 CG LEU A 41 17.278 -2.911 -6.000 1.00 53.41 C ATOM 634 CD1 LEU A 41 18.510 -3.058 -6.886 1.00 52.23 C ATOM 635 CD2 LEU A 41 17.239 -4.066 -5.019 1.00 64.12 C ATOM 0 H LEU A 41 15.971 -1.321 -7.401 1.00 55.44 H new ATOM 0 HA LEU A 41 16.857 0.474 -5.205 1.00 13.45 H new ATOM 0 HB2 LEU A 41 18.175 -1.545 -4.607 1.00 35.04 H new ATOM 0 HB3 LEU A 41 16.440 -1.710 -4.430 1.00 35.04 H new ATOM 0 HG LEU A 41 16.429 -2.889 -6.683 1.00 53.41 H new ATOM 0 HD11 LEU A 41 18.451 -3.996 -7.438 1.00 52.23 H new ATOM 0 HD12 LEU A 41 18.555 -2.226 -7.588 1.00 52.23 H new ATOM 0 HD13 LEU A 41 19.406 -3.058 -6.266 1.00 52.23 H new ATOM 0 HD21 LEU A 41 17.263 -5.009 -5.566 1.00 64.12 H new ATOM 0 HD22 LEU A 41 18.102 -4.009 -4.355 1.00 64.12 H new ATOM 0 HD23 LEU A 41 16.324 -4.012 -4.430 1.00 64.12 H new ATOM 647 N LEU A 42 19.370 0.355 -6.074 1.00 32.12 N ATOM 648 CA LEU A 42 20.646 0.543 -6.744 1.00 54.23 C ATOM 649 C LEU A 42 21.405 -0.777 -6.783 1.00 2.54 C ATOM 650 O LEU A 42 21.467 -1.518 -5.800 1.00 64.30 O ATOM 651 CB LEU A 42 21.473 1.650 -6.071 1.00 53.42 C ATOM 652 CG LEU A 42 21.341 3.029 -6.747 1.00 60.22 C ATOM 653 CD1 LEU A 42 21.831 3.008 -8.201 1.00 23.35 C ATOM 654 CD2 LEU A 42 19.920 3.599 -6.689 1.00 74.34 C ATOM 0 H LEU A 42 19.405 0.469 -5.061 1.00 32.12 H new ATOM 0 HA LEU A 42 20.460 0.866 -7.768 1.00 54.23 H new ATOM 0 HB2 LEU A 42 21.166 1.737 -5.029 1.00 53.42 H new ATOM 0 HB3 LEU A 42 22.523 1.356 -6.070 1.00 53.42 H new ATOM 0 HG LEU A 42 21.985 3.690 -6.166 1.00 60.22 H new ATOM 0 HD11 LEU A 42 21.719 4.001 -8.637 1.00 23.35 H new ATOM 0 HD12 LEU A 42 22.881 2.717 -8.227 1.00 23.35 H new ATOM 0 HD13 LEU A 42 21.241 2.292 -8.773 1.00 23.35 H new ATOM 0 HD21 LEU A 42 19.897 4.571 -7.183 1.00 74.34 H new ATOM 0 HD22 LEU A 42 19.234 2.919 -7.195 1.00 74.34 H new ATOM 0 HD23 LEU A 42 19.616 3.713 -5.649 1.00 74.34 H new ATOM 666 N ALA A 43 22.005 -1.041 -7.938 1.00 0.11 N ATOM 667 CA ALA A 43 22.934 -2.125 -8.201 1.00 33.23 C ATOM 668 C ALA A 43 24.135 -2.091 -7.249 1.00 51.32 C ATOM 669 O ALA A 43 24.377 -1.073 -6.592 1.00 73.40 O ATOM 670 CB ALA A 43 23.401 -1.947 -9.646 1.00 60.11 C ATOM 0 H ALA A 43 21.843 -0.466 -8.765 1.00 0.11 H new ATOM 0 HA ALA A 43 22.446 -3.087 -8.046 1.00 33.23 H new ATOM 0 HB1 ALA A 43 24.106 -2.739 -9.901 1.00 60.11 H new ATOM 0 HB2 ALA A 43 22.542 -1.997 -10.315 1.00 60.11 H new ATOM 0 HB3 ALA A 43 23.889 -0.978 -9.754 1.00 60.11 H new ATOM 676 N ASP A 44 24.947 -3.154 -7.263 1.00 62.13 N ATOM 677 CA ASP A 44 26.234 -3.199 -6.559 1.00 24.43 C ATOM 678 C ASP A 44 27.093 -2.026 -7.028 1.00 53.11 C ATOM 679 O ASP A 44 27.740 -1.369 -6.219 1.00 43.32 O ATOM 680 CB ASP A 44 27.006 -4.498 -6.859 1.00 43.23 C ATOM 681 CG ASP A 44 26.690 -5.668 -5.930 1.00 4.12 C ATOM 682 OD1 ASP A 44 25.649 -6.320 -6.139 1.00 55.41 O ATOM 683 OD2 ASP A 44 27.530 -6.003 -5.055 1.00 40.24 O ATOM 0 H ASP A 44 24.728 -4.014 -7.767 1.00 62.13 H new ATOM 0 HA ASP A 44 26.031 -3.150 -5.489 1.00 24.43 H new ATOM 0 HB2 ASP A 44 26.793 -4.800 -7.884 1.00 43.23 H new ATOM 0 HB3 ASP A 44 28.074 -4.289 -6.804 1.00 43.23 H new ATOM 688 N ASP A 45 27.048 -1.740 -8.333 1.00 12.22 N ATOM 689 CA ASP A 45 27.819 -0.695 -9.002 1.00 24.01 C ATOM 690 C ASP A 45 27.388 0.704 -8.551 1.00 63.43 C ATOM 691 O ASP A 45 28.153 1.657 -8.668 1.00 23.31 O ATOM 692 CB ASP A 45 27.688 -0.798 -10.513 1.00 73.20 C ATOM 693 CG ASP A 45 27.925 -2.191 -11.084 1.00 72.14 C ATOM 694 OD1 ASP A 45 29.078 -2.629 -11.254 1.00 31.43 O ATOM 695 OD2 ASP A 45 26.921 -2.879 -11.383 1.00 2.54 O ATOM 0 H ASP A 45 26.447 -2.254 -8.977 1.00 12.22 H new ATOM 0 HA ASP A 45 28.861 -0.847 -8.721 1.00 24.01 H new ATOM 0 HB2 ASP A 45 26.689 -0.469 -10.800 1.00 73.20 H new ATOM 0 HB3 ASP A 45 28.395 -0.108 -10.972 1.00 73.20 H new ATOM 700 N GLY A 46 26.163 0.849 -8.033 1.00 13.34 N ATOM 701 CA GLY A 46 25.621 2.114 -7.557 1.00 22.14 C ATOM 702 C GLY A 46 25.240 3.096 -8.664 1.00 2.35 C ATOM 703 O GLY A 46 24.852 4.216 -8.346 1.00 1.24 O ATOM 0 H GLY A 46 25.512 0.070 -7.934 1.00 13.34 H new ATOM 0 HA2 GLY A 46 24.739 1.911 -6.949 1.00 22.14 H new ATOM 0 HA3 GLY A 46 26.355 2.587 -6.905 1.00 22.14 H new ATOM 707 N GLU A 47 25.281 2.703 -9.941 1.00 15.41 N ATOM 708 CA GLU A 47 24.845 3.523 -11.069 1.00 71.40 C ATOM 709 C GLU A 47 23.906 2.750 -12.005 1.00 53.50 C ATOM 710 O GLU A 47 23.899 2.944 -13.222 1.00 12.15 O ATOM 711 CB GLU A 47 26.036 4.139 -11.794 1.00 53.42 C ATOM 712 CG GLU A 47 27.046 3.108 -12.270 1.00 42.40 C ATOM 713 CD GLU A 47 28.002 3.726 -13.293 1.00 41.22 C ATOM 714 OE1 GLU A 47 28.525 4.834 -13.036 1.00 13.23 O ATOM 715 OE2 GLU A 47 28.151 3.113 -14.375 1.00 71.42 O ATOM 0 H GLU A 47 25.626 1.785 -10.222 1.00 15.41 H new ATOM 0 HA GLU A 47 24.258 4.353 -10.675 1.00 71.40 H new ATOM 0 HB2 GLU A 47 25.676 4.708 -12.651 1.00 53.42 H new ATOM 0 HB3 GLU A 47 26.533 4.845 -11.128 1.00 53.42 H new ATOM 0 HG2 GLU A 47 27.611 2.725 -11.420 1.00 42.40 H new ATOM 0 HG3 GLU A 47 26.526 2.260 -12.715 1.00 42.40 H new ATOM 722 N THR A 48 23.125 1.817 -11.469 1.00 51.40 N ATOM 723 CA THR A 48 22.090 1.132 -12.228 1.00 1.22 C ATOM 724 C THR A 48 20.900 0.887 -11.288 1.00 51.10 C ATOM 725 O THR A 48 20.991 0.094 -10.351 1.00 23.22 O ATOM 726 CB THR A 48 22.690 -0.120 -12.895 1.00 41.31 C ATOM 727 OG1 THR A 48 23.695 0.222 -13.835 1.00 41.40 O ATOM 728 CG2 THR A 48 21.653 -0.927 -13.665 1.00 74.23 C ATOM 0 H THR A 48 23.194 1.516 -10.497 1.00 51.40 H new ATOM 0 HA THR A 48 21.704 1.725 -13.057 1.00 1.22 H new ATOM 0 HB THR A 48 23.095 -0.707 -12.071 1.00 41.31 H new ATOM 0 HG1 THR A 48 23.799 1.196 -13.863 1.00 41.40 H new ATOM 0 HG21 THR A 48 22.130 -1.798 -14.115 1.00 74.23 H new ATOM 0 HG22 THR A 48 20.868 -1.255 -12.984 1.00 74.23 H new ATOM 0 HG23 THR A 48 21.218 -0.307 -14.449 1.00 74.23 H new ATOM 736 N GLU A 49 19.807 1.615 -11.507 1.00 63.13 N ATOM 737 CA GLU A 49 18.497 1.473 -10.878 1.00 54.14 C ATOM 738 C GLU A 49 17.879 0.150 -11.367 1.00 55.22 C ATOM 739 O GLU A 49 17.193 0.117 -12.393 1.00 2.42 O ATOM 740 CB GLU A 49 17.620 2.685 -11.264 1.00 15.22 C ATOM 741 CG GLU A 49 18.051 3.998 -10.582 1.00 22.12 C ATOM 742 CD GLU A 49 17.536 5.297 -11.239 1.00 32.35 C ATOM 743 OE1 GLU A 49 16.679 5.277 -12.161 1.00 31.11 O ATOM 744 OE2 GLU A 49 18.002 6.385 -10.821 1.00 35.11 O ATOM 0 H GLU A 49 19.816 2.379 -12.182 1.00 63.13 H new ATOM 0 HA GLU A 49 18.575 1.448 -9.791 1.00 54.14 H new ATOM 0 HB2 GLU A 49 17.654 2.818 -12.345 1.00 15.22 H new ATOM 0 HB3 GLU A 49 16.584 2.472 -11.002 1.00 15.22 H new ATOM 0 HG2 GLU A 49 17.710 3.977 -9.547 1.00 22.12 H new ATOM 0 HG3 GLU A 49 19.140 4.032 -10.558 1.00 22.12 H new ATOM 751 N LYS A 50 18.180 -0.973 -10.714 1.00 23.31 N ATOM 752 CA LYS A 50 17.668 -2.283 -11.136 1.00 41.22 C ATOM 753 C LYS A 50 16.278 -2.459 -10.543 1.00 60.40 C ATOM 754 O LYS A 50 16.102 -2.400 -9.321 1.00 22.44 O ATOM 755 CB LYS A 50 18.584 -3.472 -10.776 1.00 75.34 C ATOM 756 CG LYS A 50 19.958 -3.449 -11.471 1.00 40.13 C ATOM 757 CD LYS A 50 20.646 -4.830 -11.485 1.00 2.21 C ATOM 758 CE LYS A 50 22.180 -4.807 -11.346 1.00 75.43 C ATOM 759 NZ LYS A 50 22.866 -4.140 -12.473 1.00 72.24 N ATOM 0 H LYS A 50 18.777 -1.004 -9.888 1.00 23.31 H new ATOM 0 HA LYS A 50 17.634 -2.290 -12.225 1.00 41.22 H new ATOM 0 HB2 LYS A 50 18.736 -3.484 -9.697 1.00 75.34 H new ATOM 0 HB3 LYS A 50 18.074 -4.400 -11.036 1.00 75.34 H new ATOM 0 HG2 LYS A 50 19.835 -3.099 -12.496 1.00 40.13 H new ATOM 0 HG3 LYS A 50 20.604 -2.732 -10.965 1.00 40.13 H new ATOM 0 HD2 LYS A 50 20.234 -5.430 -10.674 1.00 2.21 H new ATOM 0 HD3 LYS A 50 20.390 -5.335 -12.417 1.00 2.21 H new ATOM 0 HE2 LYS A 50 22.445 -4.299 -10.419 1.00 75.43 H new ATOM 0 HE3 LYS A 50 22.545 -5.831 -11.264 1.00 75.43 H new ATOM 0 HZ1 LYS A 50 23.893 -4.278 -12.385 1.00 72.24 H new ATOM 0 HZ2 LYS A 50 22.537 -4.549 -13.371 1.00 72.24 H new ATOM 0 HZ3 LYS A 50 22.651 -3.123 -12.457 1.00 72.24 H new ATOM 773 N THR A 51 15.272 -2.685 -11.387 1.00 13.21 N ATOM 774 CA THR A 51 13.975 -3.135 -10.901 1.00 55.50 C ATOM 775 C THR A 51 14.060 -4.605 -10.480 1.00 42.24 C ATOM 776 O THR A 51 15.052 -5.285 -10.752 1.00 3.54 O ATOM 777 CB THR A 51 12.878 -2.880 -11.945 1.00 40.42 C ATOM 778 OG1 THR A 51 13.139 -3.492 -13.188 1.00 42.02 O ATOM 779 CG2 THR A 51 12.739 -1.386 -12.216 1.00 52.12 C ATOM 0 H THR A 51 15.331 -2.565 -12.398 1.00 13.21 H new ATOM 0 HA THR A 51 13.698 -2.556 -10.020 1.00 55.50 H new ATOM 0 HB THR A 51 11.970 -3.307 -11.519 1.00 40.42 H new ATOM 0 HG1 THR A 51 12.407 -3.296 -13.809 1.00 42.02 H new ATOM 0 HG21 THR A 51 11.958 -1.222 -12.958 1.00 52.12 H new ATOM 0 HG22 THR A 51 12.476 -0.872 -11.292 1.00 52.12 H new ATOM 0 HG23 THR A 51 13.684 -0.995 -12.592 1.00 52.12 H new ATOM 787 N PHE A 52 13.005 -5.094 -9.833 1.00 34.35 N ATOM 788 CA PHE A 52 12.790 -6.482 -9.433 1.00 44.43 C ATOM 789 C PHE A 52 11.277 -6.748 -9.487 1.00 4.52 C ATOM 790 O PHE A 52 10.507 -5.775 -9.490 1.00 63.34 O ATOM 791 CB PHE A 52 13.311 -6.690 -8.001 1.00 11.23 C ATOM 792 CG PHE A 52 14.736 -7.195 -7.884 1.00 22.24 C ATOM 793 CD1 PHE A 52 15.817 -6.306 -8.017 1.00 23.01 C ATOM 794 CD2 PHE A 52 14.990 -8.555 -7.612 1.00 34.35 C ATOM 795 CE1 PHE A 52 17.134 -6.785 -7.943 1.00 72.23 C ATOM 796 CE2 PHE A 52 16.309 -9.027 -7.515 1.00 63.10 C ATOM 797 CZ PHE A 52 17.385 -8.144 -7.694 1.00 14.42 C ATOM 0 H PHE A 52 12.228 -4.493 -9.557 1.00 34.35 H new ATOM 0 HA PHE A 52 13.321 -7.166 -10.095 1.00 44.43 H new ATOM 0 HB2 PHE A 52 13.236 -5.743 -7.466 1.00 11.23 H new ATOM 0 HB3 PHE A 52 12.653 -7.395 -7.494 1.00 11.23 H new ATOM 0 HD1 PHE A 52 15.634 -5.254 -8.176 1.00 23.01 H new ATOM 0 HD2 PHE A 52 14.165 -9.238 -7.477 1.00 34.35 H new ATOM 0 HE1 PHE A 52 17.961 -6.103 -8.079 1.00 72.23 H new ATOM 0 HE2 PHE A 52 16.495 -10.069 -7.303 1.00 63.10 H new ATOM 0 HZ PHE A 52 18.401 -8.508 -7.641 1.00 14.42 H new ATOM 807 N PRO A 53 10.824 -8.015 -9.494 1.00 24.11 N ATOM 808 CA PRO A 53 9.409 -8.328 -9.376 1.00 21.13 C ATOM 809 C PRO A 53 8.915 -8.009 -7.965 1.00 62.44 C ATOM 810 O PRO A 53 9.621 -8.213 -6.972 1.00 71.31 O ATOM 811 CB PRO A 53 9.281 -9.828 -9.652 1.00 53.33 C ATOM 812 CG PRO A 53 10.638 -10.372 -9.212 1.00 54.01 C ATOM 813 CD PRO A 53 11.604 -9.243 -9.586 1.00 75.30 C ATOM 0 HA PRO A 53 8.812 -7.741 -10.074 1.00 21.13 H new ATOM 0 HB2 PRO A 53 8.464 -10.275 -9.086 1.00 53.33 H new ATOM 0 HB3 PRO A 53 9.087 -10.030 -10.705 1.00 53.33 H new ATOM 0 HG2 PRO A 53 10.660 -10.583 -8.143 1.00 54.01 H new ATOM 0 HG3 PRO A 53 10.886 -11.301 -9.726 1.00 54.01 H new ATOM 0 HD2 PRO A 53 12.458 -9.217 -8.909 1.00 75.30 H new ATOM 0 HD3 PRO A 53 11.999 -9.382 -10.592 1.00 75.30 H new ATOM 821 N PHE A 54 7.665 -7.573 -7.873 1.00 0.02 N ATOM 822 CA PHE A 54 6.971 -7.418 -6.609 1.00 33.43 C ATOM 823 C PHE A 54 5.980 -8.577 -6.464 1.00 55.03 C ATOM 824 O PHE A 54 5.110 -8.760 -7.324 1.00 52.42 O ATOM 825 CB PHE A 54 6.315 -6.035 -6.572 1.00 41.03 C ATOM 826 CG PHE A 54 6.222 -5.461 -5.177 1.00 2.14 C ATOM 827 CD1 PHE A 54 5.196 -5.872 -4.311 1.00 2.13 C ATOM 828 CD2 PHE A 54 7.169 -4.516 -4.741 1.00 3.45 C ATOM 829 CE1 PHE A 54 5.128 -5.347 -3.008 1.00 71.40 C ATOM 830 CE2 PHE A 54 7.109 -4.005 -3.437 1.00 15.24 C ATOM 831 CZ PHE A 54 6.090 -4.422 -2.570 1.00 73.31 C ATOM 0 H PHE A 54 7.102 -7.316 -8.684 1.00 0.02 H new ATOM 0 HA PHE A 54 7.648 -7.463 -5.756 1.00 33.43 H new ATOM 0 HB2 PHE A 54 6.885 -5.352 -7.202 1.00 41.03 H new ATOM 0 HB3 PHE A 54 5.314 -6.102 -6.998 1.00 41.03 H new ATOM 0 HD1 PHE A 54 4.461 -6.589 -4.645 1.00 2.13 H new ATOM 0 HD2 PHE A 54 7.945 -4.183 -5.414 1.00 3.45 H new ATOM 0 HE1 PHE A 54 4.335 -5.656 -2.343 1.00 71.40 H new ATOM 0 HE2 PHE A 54 7.847 -3.291 -3.101 1.00 15.24 H new ATOM 0 HZ PHE A 54 6.044 -4.032 -1.564 1.00 73.31 H new ATOM 841 N THR A 55 6.137 -9.384 -5.412 1.00 74.30 N ATOM 842 CA THR A 55 5.259 -10.505 -5.072 1.00 13.43 C ATOM 843 C THR A 55 4.964 -10.500 -3.562 1.00 43.24 C ATOM 844 O THR A 55 5.411 -9.596 -2.845 1.00 35.12 O ATOM 845 CB THR A 55 5.854 -11.829 -5.584 1.00 21.44 C ATOM 846 OG1 THR A 55 7.120 -12.085 -5.018 1.00 1.25 O ATOM 847 CG2 THR A 55 6.010 -11.835 -7.107 1.00 14.34 C ATOM 0 H THR A 55 6.906 -9.271 -4.751 1.00 74.30 H new ATOM 0 HA THR A 55 4.299 -10.395 -5.576 1.00 13.43 H new ATOM 0 HB THR A 55 5.149 -12.605 -5.284 1.00 21.44 H new ATOM 0 HG1 THR A 55 7.467 -12.934 -5.364 1.00 1.25 H new ATOM 0 HG21 THR A 55 6.433 -12.788 -7.426 1.00 14.34 H new ATOM 0 HG22 THR A 55 5.034 -11.697 -7.573 1.00 14.34 H new ATOM 0 HG23 THR A 55 6.674 -11.024 -7.408 1.00 14.34 H new ATOM 855 N LYS A 56 4.143 -11.431 -3.057 1.00 43.30 N ATOM 856 CA LYS A 56 3.612 -11.390 -1.689 1.00 52.21 C ATOM 857 C LYS A 56 4.717 -11.549 -0.643 1.00 51.54 C ATOM 858 O LYS A 56 4.597 -11.064 0.484 1.00 53.53 O ATOM 859 CB LYS A 56 2.586 -12.506 -1.501 1.00 20.01 C ATOM 860 CG LYS A 56 1.528 -12.643 -2.601 1.00 2.42 C ATOM 861 CD LYS A 56 0.762 -11.376 -3.002 1.00 0.23 C ATOM 862 CE LYS A 56 -0.490 -11.756 -3.807 1.00 75.20 C ATOM 863 NZ LYS A 56 -0.186 -12.397 -5.110 1.00 62.51 N ATOM 0 H LYS A 56 3.827 -12.240 -3.592 1.00 43.30 H new ATOM 0 HA LYS A 56 3.146 -10.415 -1.548 1.00 52.21 H new ATOM 0 HB2 LYS A 56 3.120 -13.453 -1.419 1.00 20.01 H new ATOM 0 HB3 LYS A 56 2.075 -12.345 -0.552 1.00 20.01 H new ATOM 0 HG2 LYS A 56 2.017 -13.038 -3.492 1.00 2.42 H new ATOM 0 HG3 LYS A 56 0.801 -13.389 -2.279 1.00 2.42 H new ATOM 0 HD2 LYS A 56 0.477 -10.816 -2.112 1.00 0.23 H new ATOM 0 HD3 LYS A 56 1.404 -10.725 -3.596 1.00 0.23 H new ATOM 0 HE2 LYS A 56 -1.102 -12.434 -3.212 1.00 75.20 H new ATOM 0 HE3 LYS A 56 -1.085 -10.860 -3.982 1.00 75.20 H new ATOM 0 HZ1 LYS A 56 -0.934 -13.081 -5.343 1.00 62.51 H new ATOM 0 HZ2 LYS A 56 -0.138 -11.670 -5.852 1.00 62.51 H new ATOM 0 HZ3 LYS A 56 0.728 -12.890 -5.050 1.00 62.51 H new ATOM 877 N GLU A 57 5.826 -12.133 -1.079 1.00 73.14 N ATOM 878 CA GLU A 57 7.121 -12.236 -0.438 1.00 23.42 C ATOM 879 C GLU A 57 7.565 -10.910 0.185 1.00 64.44 C ATOM 880 O GLU A 57 8.194 -10.911 1.242 1.00 60.12 O ATOM 881 CB GLU A 57 8.060 -12.632 -1.580 1.00 64.41 C ATOM 882 CG GLU A 57 9.457 -13.088 -1.171 1.00 44.13 C ATOM 883 CD GLU A 57 10.067 -13.851 -2.347 1.00 23.41 C ATOM 884 OE1 GLU A 57 10.316 -13.240 -3.409 1.00 22.23 O ATOM 885 OE2 GLU A 57 10.233 -15.088 -2.231 1.00 31.23 O ATOM 0 H GLU A 57 5.835 -12.594 -1.989 1.00 73.14 H new ATOM 0 HA GLU A 57 7.111 -12.951 0.385 1.00 23.42 H new ATOM 0 HB2 GLU A 57 7.590 -13.434 -2.149 1.00 64.41 H new ATOM 0 HB3 GLU A 57 8.160 -11.781 -2.253 1.00 64.41 H new ATOM 0 HG2 GLU A 57 10.077 -12.230 -0.910 1.00 44.13 H new ATOM 0 HG3 GLU A 57 9.407 -13.725 -0.288 1.00 44.13 H new ATOM 892 N LYS A 58 7.205 -9.790 -0.451 1.00 0.44 N ATOM 893 CA LYS A 58 7.451 -8.425 -0.002 1.00 64.20 C ATOM 894 C LYS A 58 6.162 -7.599 -0.015 1.00 43.50 C ATOM 895 O LYS A 58 6.207 -6.411 -0.295 1.00 13.24 O ATOM 896 CB LYS A 58 8.578 -7.761 -0.806 1.00 0.25 C ATOM 897 CG LYS A 58 8.465 -7.940 -2.321 1.00 14.14 C ATOM 898 CD LYS A 58 9.281 -9.149 -2.769 1.00 33.44 C ATOM 899 CE LYS A 58 10.386 -8.653 -3.681 1.00 11.52 C ATOM 900 NZ LYS A 58 11.342 -7.774 -2.969 1.00 41.31 N ATOM 0 H LYS A 58 6.707 -9.819 -1.341 1.00 0.44 H new ATOM 0 HA LYS A 58 7.792 -8.469 1.032 1.00 64.20 H new ATOM 0 HB2 LYS A 58 8.590 -6.695 -0.578 1.00 0.25 H new ATOM 0 HB3 LYS A 58 9.533 -8.169 -0.475 1.00 0.25 H new ATOM 0 HG2 LYS A 58 7.420 -8.072 -2.602 1.00 14.14 H new ATOM 0 HG3 LYS A 58 8.821 -7.043 -2.828 1.00 14.14 H new ATOM 0 HD2 LYS A 58 9.701 -9.666 -1.907 1.00 33.44 H new ATOM 0 HD3 LYS A 58 8.647 -9.865 -3.292 1.00 33.44 H new ATOM 0 HE2 LYS A 58 10.921 -9.506 -4.099 1.00 11.52 H new ATOM 0 HE3 LYS A 58 9.948 -8.109 -4.518 1.00 11.52 H new ATOM 0 HZ1 LYS A 58 12.312 -8.009 -3.260 1.00 41.31 H new ATOM 0 HZ2 LYS A 58 11.141 -6.781 -3.203 1.00 41.31 H new ATOM 0 HZ3 LYS A 58 11.245 -7.914 -1.943 1.00 41.31 H new ATOM 914 N TRP A 59 5.007 -8.204 0.250 1.00 75.40 N ATOM 915 CA TRP A 59 3.805 -7.483 0.659 1.00 0.12 C ATOM 916 C TRP A 59 3.864 -7.301 2.180 1.00 60.02 C ATOM 917 O TRP A 59 3.473 -8.244 2.884 1.00 51.44 O ATOM 918 CB TRP A 59 2.507 -8.161 0.196 1.00 33.41 C ATOM 919 CG TRP A 59 1.272 -7.332 0.412 1.00 40.54 C ATOM 920 CD1 TRP A 59 0.546 -7.295 1.550 1.00 22.25 C ATOM 921 CD2 TRP A 59 0.666 -6.328 -0.464 1.00 33.34 C ATOM 922 NE1 TRP A 59 -0.460 -6.353 1.450 1.00 64.24 N ATOM 923 CE2 TRP A 59 -0.437 -5.728 0.218 1.00 63.22 C ATOM 924 CE3 TRP A 59 0.959 -5.837 -1.755 1.00 75.10 C ATOM 925 CZ2 TRP A 59 -1.210 -4.712 -0.372 1.00 63.50 C ATOM 926 CZ3 TRP A 59 0.194 -4.818 -2.351 1.00 75.31 C ATOM 927 CH2 TRP A 59 -0.897 -4.265 -1.664 1.00 21.43 C ATOM 0 H TRP A 59 4.878 -9.214 0.187 1.00 75.40 H new ATOM 0 HA TRP A 59 3.785 -6.509 0.169 1.00 0.12 H new ATOM 0 HB2 TRP A 59 2.592 -8.398 -0.865 1.00 33.41 H new ATOM 0 HB3 TRP A 59 2.394 -9.107 0.726 1.00 33.41 H new ATOM 0 HD1 TRP A 59 0.726 -7.914 2.416 1.00 22.25 H new ATOM 0 HE1 TRP A 59 -1.132 -6.146 2.189 1.00 64.24 H new ATOM 0 HE3 TRP A 59 1.793 -6.255 -2.299 1.00 75.10 H new ATOM 0 HZ2 TRP A 59 -2.040 -4.279 0.167 1.00 63.50 H new ATOM 0 HZ3 TRP A 59 0.447 -4.461 -3.338 1.00 75.31 H new ATOM 0 HH2 TRP A 59 -1.495 -3.496 -2.130 1.00 21.43 H new ATOM 938 N PRO A 60 4.485 -6.239 2.725 1.00 11.35 N ATOM 939 CA PRO A 60 4.193 -5.864 4.100 1.00 55.23 C ATOM 940 C PRO A 60 2.681 -5.665 4.247 1.00 72.24 C ATOM 941 O PRO A 60 2.017 -5.141 3.350 1.00 12.44 O ATOM 942 CB PRO A 60 4.970 -4.577 4.371 1.00 75.12 C ATOM 943 CG PRO A 60 5.039 -3.936 2.993 1.00 64.24 C ATOM 944 CD PRO A 60 5.167 -5.133 2.064 1.00 55.20 C ATOM 0 HA PRO A 60 4.490 -6.628 4.818 1.00 55.23 H new ATOM 0 HB2 PRO A 60 4.458 -3.938 5.090 1.00 75.12 H new ATOM 0 HB3 PRO A 60 5.962 -4.780 4.774 1.00 75.12 H new ATOM 0 HG2 PRO A 60 4.146 -3.350 2.775 1.00 64.24 H new ATOM 0 HG3 PRO A 60 5.892 -3.263 2.903 1.00 64.24 H new ATOM 0 HD2 PRO A 60 4.716 -4.922 1.094 1.00 55.20 H new ATOM 0 HD3 PRO A 60 6.214 -5.375 1.883 1.00 55.20 H new ATOM 952 N LEU A 61 2.127 -6.144 5.352 1.00 22.01 N ATOM 953 CA LEU A 61 0.747 -5.925 5.728 1.00 41.24 C ATOM 954 C LEU A 61 0.586 -4.457 6.073 1.00 24.44 C ATOM 955 O LEU A 61 1.466 -3.850 6.691 1.00 72.00 O ATOM 956 CB LEU A 61 0.392 -6.811 6.931 1.00 64.22 C ATOM 957 CG LEU A 61 -0.169 -8.187 6.546 1.00 0.44 C ATOM 958 CD1 LEU A 61 0.536 -8.923 5.413 1.00 62.40 C ATOM 959 CD2 LEU A 61 -0.109 -9.125 7.745 1.00 0.51 C ATOM 0 H LEU A 61 2.643 -6.710 6.026 1.00 22.01 H new ATOM 0 HA LEU A 61 0.076 -6.186 4.910 1.00 41.24 H new ATOM 0 HB2 LEU A 61 1.284 -6.951 7.542 1.00 64.22 H new ATOM 0 HB3 LEU A 61 -0.340 -6.291 7.549 1.00 64.22 H new ATOM 0 HG LEU A 61 -1.177 -7.952 6.204 1.00 0.44 H new ATOM 0 HD11 LEU A 61 0.044 -9.880 5.239 1.00 62.40 H new ATOM 0 HD12 LEU A 61 0.491 -8.322 4.505 1.00 62.40 H new ATOM 0 HD13 LEU A 61 1.578 -9.095 5.683 1.00 62.40 H new ATOM 0 HD21 LEU A 61 -0.509 -10.100 7.465 1.00 0.51 H new ATOM 0 HD22 LEU A 61 0.926 -9.236 8.068 1.00 0.51 H new ATOM 0 HD23 LEU A 61 -0.701 -8.711 8.561 1.00 0.51 H new ATOM 971 N LEU A 62 -0.559 -3.908 5.690 1.00 62.12 N ATOM 972 CA LEU A 62 -0.947 -2.554 6.055 1.00 24.33 C ATOM 973 C LEU A 62 -2.005 -2.655 7.137 1.00 35.04 C ATOM 974 O LEU A 62 -2.716 -3.660 7.220 1.00 15.23 O ATOM 975 CB LEU A 62 -1.480 -1.781 4.842 1.00 1.42 C ATOM 976 CG LEU A 62 -0.555 -1.833 3.615 1.00 42.52 C ATOM 977 CD1 LEU A 62 -1.131 -0.981 2.486 1.00 32.45 C ATOM 978 CD2 LEU A 62 0.858 -1.334 3.913 1.00 54.32 C ATOM 0 H LEU A 62 -1.248 -4.393 5.114 1.00 62.12 H new ATOM 0 HA LEU A 62 -0.080 -2.004 6.421 1.00 24.33 H new ATOM 0 HB2 LEU A 62 -2.455 -2.183 4.567 1.00 1.42 H new ATOM 0 HB3 LEU A 62 -1.633 -0.740 5.126 1.00 1.42 H new ATOM 0 HG LEU A 62 -0.493 -2.882 3.325 1.00 42.52 H new ATOM 0 HD11 LEU A 62 -0.468 -1.025 1.622 1.00 32.45 H new ATOM 0 HD12 LEU A 62 -2.114 -1.361 2.208 1.00 32.45 H new ATOM 0 HD13 LEU A 62 -1.223 0.052 2.820 1.00 32.45 H new ATOM 0 HD21 LEU A 62 1.464 -1.395 3.009 1.00 54.32 H new ATOM 0 HD22 LEU A 62 0.814 -0.299 4.252 1.00 54.32 H new ATOM 0 HD23 LEU A 62 1.305 -1.952 4.692 1.00 54.32 H new ATOM 990 N ASP A 63 -2.133 -1.601 7.929 1.00 44.51 N ATOM 991 CA ASP A 63 -2.981 -1.545 9.104 1.00 1.35 C ATOM 992 C ASP A 63 -3.769 -0.248 9.113 1.00 13.21 C ATOM 993 O ASP A 63 -3.610 0.630 8.262 1.00 64.04 O ATOM 994 CB ASP A 63 -2.154 -1.683 10.395 1.00 11.51 C ATOM 995 CG ASP A 63 -1.108 -0.585 10.635 1.00 33.05 C ATOM 996 OD1 ASP A 63 -1.184 0.474 9.980 1.00 44.52 O ATOM 997 OD2 ASP A 63 -0.215 -0.770 11.489 1.00 0.25 O ATOM 0 H ASP A 63 -1.629 -0.730 7.762 1.00 44.51 H new ATOM 0 HA ASP A 63 -3.677 -2.383 9.064 1.00 1.35 H new ATOM 0 HB2 ASP A 63 -2.838 -1.699 11.243 1.00 11.51 H new ATOM 0 HB3 ASP A 63 -1.645 -2.647 10.378 1.00 11.51 H new ATOM 1002 N SER A 64 -4.637 -0.138 10.106 1.00 34.32 N ATOM 1003 CA SER A 64 -5.499 1.016 10.319 1.00 21.13 C ATOM 1004 C SER A 64 -4.723 2.250 10.806 1.00 34.24 C ATOM 1005 O SER A 64 -5.266 3.355 10.811 1.00 53.50 O ATOM 1006 CB SER A 64 -6.585 0.607 11.308 1.00 34.05 C ATOM 1007 OG SER A 64 -7.410 -0.386 10.720 1.00 75.43 O ATOM 0 H SER A 64 -4.766 -0.869 10.806 1.00 34.32 H new ATOM 0 HA SER A 64 -5.945 1.315 9.370 1.00 21.13 H new ATOM 0 HB2 SER A 64 -6.133 0.224 12.223 1.00 34.05 H new ATOM 0 HB3 SER A 64 -7.184 1.474 11.586 1.00 34.05 H new ATOM 0 HG SER A 64 -8.107 -0.651 11.356 1.00 75.43 H new ATOM 1013 N GLU A 65 -3.455 2.088 11.178 1.00 63.11 N ATOM 1014 CA GLU A 65 -2.564 3.151 11.625 1.00 63.14 C ATOM 1015 C GLU A 65 -1.725 3.713 10.460 1.00 34.12 C ATOM 1016 O GLU A 65 -1.130 4.781 10.601 1.00 53.24 O ATOM 1017 CB GLU A 65 -1.652 2.622 12.735 1.00 4.12 C ATOM 1018 CG GLU A 65 -2.401 2.112 13.984 1.00 34.44 C ATOM 1019 CD GLU A 65 -1.547 1.244 14.925 1.00 44.32 C ATOM 1020 OE1 GLU A 65 -0.303 1.376 14.917 1.00 62.44 O ATOM 1021 OE2 GLU A 65 -2.118 0.397 15.661 1.00 55.13 O ATOM 0 H GLU A 65 -3.004 1.173 11.175 1.00 63.11 H new ATOM 0 HA GLU A 65 -3.172 3.968 12.013 1.00 63.14 H new ATOM 0 HB2 GLU A 65 -1.044 1.811 12.334 1.00 4.12 H new ATOM 0 HB3 GLU A 65 -0.967 3.415 13.035 1.00 4.12 H new ATOM 0 HG2 GLU A 65 -2.778 2.969 14.542 1.00 34.44 H new ATOM 0 HG3 GLU A 65 -3.268 1.534 13.663 1.00 34.44 H new ATOM 1028 N THR A 66 -1.744 3.058 9.300 1.00 12.24 N ATOM 1029 CA THR A 66 -1.124 3.473 8.046 1.00 63.13 C ATOM 1030 C THR A 66 -2.196 3.707 6.968 1.00 63.02 C ATOM 1031 O THR A 66 -1.878 3.964 5.805 1.00 3.41 O ATOM 1032 CB THR A 66 -0.088 2.412 7.600 1.00 32.43 C ATOM 1033 OG1 THR A 66 0.626 1.790 8.657 1.00 53.22 O ATOM 1034 CG2 THR A 66 0.996 3.007 6.697 1.00 73.44 C ATOM 0 H THR A 66 -2.226 2.164 9.207 1.00 12.24 H new ATOM 0 HA THR A 66 -0.601 4.417 8.196 1.00 63.13 H new ATOM 0 HB THR A 66 -0.713 1.679 7.089 1.00 32.43 H new ATOM 0 HG1 THR A 66 0.089 1.060 9.029 1.00 53.22 H new ATOM 0 HG21 THR A 66 1.700 2.226 6.410 1.00 73.44 H new ATOM 0 HG22 THR A 66 0.535 3.427 5.803 1.00 73.44 H new ATOM 0 HG23 THR A 66 1.526 3.793 7.235 1.00 73.44 H new ATOM 1042 N MET A 67 -3.470 3.617 7.339 1.00 55.54 N ATOM 1043 CA MET A 67 -4.619 3.748 6.454 1.00 3.13 C ATOM 1044 C MET A 67 -5.636 4.739 7.032 1.00 12.45 C ATOM 1045 O MET A 67 -6.834 4.444 7.085 1.00 24.42 O ATOM 1046 CB MET A 67 -5.196 2.348 6.240 1.00 62.44 C ATOM 1047 CG MET A 67 -6.122 2.242 5.028 1.00 3.24 C ATOM 1048 SD MET A 67 -5.359 2.431 3.397 1.00 15.33 S ATOM 1049 CE MET A 67 -4.184 1.058 3.494 1.00 4.23 C ATOM 0 H MET A 67 -3.739 3.443 8.307 1.00 55.54 H new ATOM 0 HA MET A 67 -4.331 4.159 5.487 1.00 3.13 H new ATOM 0 HB2 MET A 67 -4.375 1.641 6.121 1.00 62.44 H new ATOM 0 HB3 MET A 67 -5.746 2.051 7.133 1.00 62.44 H new ATOM 0 HG2 MET A 67 -6.615 1.271 5.062 1.00 3.24 H new ATOM 0 HG3 MET A 67 -6.900 2.998 5.128 1.00 3.24 H new ATOM 0 HE1 MET A 67 -4.101 0.581 2.518 1.00 4.23 H new ATOM 0 HE2 MET A 67 -3.208 1.435 3.798 1.00 4.23 H new ATOM 0 HE3 MET A 67 -4.535 0.330 4.225 1.00 4.23 H new ATOM 1059 N LYS A 68 -5.177 5.905 7.497 1.00 32.34 N ATOM 1060 CA LYS A 68 -6.054 6.983 7.961 1.00 63.32 C ATOM 1061 C LYS A 68 -5.989 8.200 7.027 1.00 72.31 C ATOM 1062 O LYS A 68 -5.017 8.377 6.293 1.00 41.50 O ATOM 1063 CB LYS A 68 -5.706 7.290 9.427 1.00 73.13 C ATOM 1064 CG LYS A 68 -4.312 7.894 9.663 1.00 71.33 C ATOM 1065 CD LYS A 68 -3.284 6.946 10.299 1.00 55.12 C ATOM 1066 CE LYS A 68 -3.307 7.001 11.829 1.00 13.45 C ATOM 1067 NZ LYS A 68 -1.970 6.709 12.384 1.00 13.21 N ATOM 0 H LYS A 68 -4.184 6.128 7.562 1.00 32.34 H new ATOM 0 HA LYS A 68 -7.099 6.674 7.927 1.00 63.32 H new ATOM 0 HB2 LYS A 68 -6.453 7.978 9.823 1.00 73.13 H new ATOM 0 HB3 LYS A 68 -5.785 6.367 10.002 1.00 73.13 H new ATOM 0 HG2 LYS A 68 -3.919 8.242 8.708 1.00 71.33 H new ATOM 0 HG3 LYS A 68 -4.418 8.770 10.302 1.00 71.33 H new ATOM 0 HD2 LYS A 68 -3.484 5.926 9.972 1.00 55.12 H new ATOM 0 HD3 LYS A 68 -2.287 7.205 9.944 1.00 55.12 H new ATOM 0 HE2 LYS A 68 -3.634 7.988 12.157 1.00 13.45 H new ATOM 0 HE3 LYS A 68 -4.030 6.281 12.213 1.00 13.45 H new ATOM 0 HZ1 LYS A 68 -2.071 6.169 13.267 1.00 13.21 H new ATOM 0 HZ2 LYS A 68 -1.424 6.151 11.698 1.00 13.21 H new ATOM 0 HZ3 LYS A 68 -1.472 7.601 12.579 1.00 13.21 H new ATOM 1081 N GLU A 69 -6.980 9.092 7.085 1.00 21.44 N ATOM 1082 CA GLU A 69 -7.095 10.268 6.222 1.00 0.43 C ATOM 1083 C GLU A 69 -6.898 11.553 7.045 1.00 22.21 C ATOM 1084 O GLU A 69 -7.758 11.858 7.877 1.00 34.43 O ATOM 1085 CB GLU A 69 -8.486 10.275 5.572 1.00 75.22 C ATOM 1086 CG GLU A 69 -8.636 9.363 4.351 1.00 14.43 C ATOM 1087 CD GLU A 69 -10.108 9.009 4.126 1.00 72.32 C ATOM 1088 OE1 GLU A 69 -10.789 9.804 3.438 1.00 33.51 O ATOM 1089 OE2 GLU A 69 -10.595 7.948 4.588 1.00 64.53 O ATOM 0 H GLU A 69 -7.747 9.013 7.753 1.00 21.44 H new ATOM 0 HA GLU A 69 -6.326 10.228 5.451 1.00 0.43 H new ATOM 0 HB2 GLU A 69 -9.221 9.979 6.320 1.00 75.22 H new ATOM 0 HB3 GLU A 69 -8.727 11.296 5.276 1.00 75.22 H new ATOM 0 HG2 GLU A 69 -8.236 9.860 3.467 1.00 14.43 H new ATOM 0 HG3 GLU A 69 -8.055 8.452 4.496 1.00 14.43 H new ATOM 1096 N GLU A 70 -5.831 12.334 6.822 1.00 40.51 N ATOM 1097 CA GLU A 70 -5.490 13.518 7.619 1.00 40.44 C ATOM 1098 C GLU A 70 -4.676 14.546 6.801 1.00 41.20 C ATOM 1099 O GLU A 70 -4.171 14.252 5.711 1.00 24.15 O ATOM 1100 CB GLU A 70 -4.662 13.070 8.842 1.00 33.22 C ATOM 1101 CG GLU A 70 -4.798 13.967 10.086 1.00 40.23 C ATOM 1102 CD GLU A 70 -5.906 13.480 11.016 1.00 55.43 C ATOM 1103 OE1 GLU A 70 -5.692 12.453 11.701 1.00 62.23 O ATOM 1104 OE2 GLU A 70 -6.982 14.123 11.059 1.00 55.10 O ATOM 0 H GLU A 70 -5.169 12.155 6.067 1.00 40.51 H new ATOM 0 HA GLU A 70 -6.417 14.000 7.931 1.00 40.44 H new ATOM 0 HB2 GLU A 70 -4.958 12.056 9.110 1.00 33.22 H new ATOM 0 HB3 GLU A 70 -3.611 13.030 8.555 1.00 33.22 H new ATOM 0 HG2 GLU A 70 -3.852 13.985 10.626 1.00 40.23 H new ATOM 0 HG3 GLU A 70 -5.008 14.991 9.775 1.00 40.23 H new ATOM 1111 N ARG A 71 -4.492 15.747 7.365 1.00 34.21 N ATOM 1112 CA ARG A 71 -3.536 16.776 6.947 1.00 61.23 C ATOM 1113 C ARG A 71 -2.935 17.436 8.203 1.00 41.30 C ATOM 1114 O ARG A 71 -3.378 18.510 8.607 1.00 35.35 O ATOM 1115 CB ARG A 71 -4.233 17.813 6.034 1.00 3.15 C ATOM 1116 CG ARG A 71 -3.248 18.848 5.460 1.00 63.14 C ATOM 1117 CD ARG A 71 -3.758 20.283 5.587 1.00 3.34 C ATOM 1118 NE ARG A 71 -4.687 20.671 4.512 1.00 71.14 N ATOM 1119 CZ ARG A 71 -4.454 21.480 3.468 1.00 73.14 C ATOM 1120 NH1 ARG A 71 -3.288 22.089 3.302 1.00 0.44 N ATOM 1121 NH2 ARG A 71 -5.413 21.672 2.570 1.00 24.34 N ATOM 0 H ARG A 71 -5.040 16.042 8.173 1.00 34.21 H new ATOM 0 HA ARG A 71 -2.728 16.327 6.369 1.00 61.23 H new ATOM 0 HB2 ARG A 71 -4.730 17.295 5.214 1.00 3.15 H new ATOM 0 HB3 ARG A 71 -5.008 18.329 6.601 1.00 3.15 H new ATOM 0 HG2 ARG A 71 -2.293 18.760 5.977 1.00 63.14 H new ATOM 0 HG3 ARG A 71 -3.064 18.624 4.409 1.00 63.14 H new ATOM 0 HD2 ARG A 71 -4.258 20.399 6.549 1.00 3.34 H new ATOM 0 HD3 ARG A 71 -2.907 20.965 5.586 1.00 3.34 H new ATOM 0 HE ARG A 71 -5.625 20.275 4.569 1.00 71.14 H new ATOM 0 HH11 ARG A 71 -2.538 21.948 3.979 1.00 0.44 H new ATOM 0 HH12 ARG A 71 -3.141 22.699 2.497 1.00 0.44 H new ATOM 0 HH21 ARG A 71 -6.314 21.207 2.679 1.00 24.34 H new ATOM 0 HH22 ARG A 71 -5.249 22.285 1.771 1.00 24.34 H new ATOM 1135 N ILE A 72 -1.931 16.828 8.841 1.00 53.34 N ATOM 1136 CA ILE A 72 -1.236 17.458 9.969 1.00 51.21 C ATOM 1137 C ILE A 72 -0.373 18.582 9.386 1.00 4.42 C ATOM 1138 O ILE A 72 0.670 18.303 8.795 1.00 73.41 O ATOM 1139 CB ILE A 72 -0.354 16.480 10.793 1.00 43.33 C ATOM 1140 CG1 ILE A 72 -1.036 15.217 11.347 1.00 55.21 C ATOM 1141 CG2 ILE A 72 0.243 17.235 12.003 1.00 3.45 C ATOM 1142 CD1 ILE A 72 -1.108 14.066 10.344 1.00 34.32 C ATOM 0 H ILE A 72 -1.581 15.902 8.597 1.00 53.34 H new ATOM 0 HA ILE A 72 -1.982 17.828 10.672 1.00 51.21 H new ATOM 0 HB ILE A 72 0.383 16.130 10.071 1.00 43.33 H new ATOM 0 HG12 ILE A 72 -0.496 14.882 12.232 1.00 55.21 H new ATOM 0 HG13 ILE A 72 -2.046 15.471 11.667 1.00 55.21 H new ATOM 0 HG21 ILE A 72 0.863 16.555 12.586 1.00 3.45 H new ATOM 0 HG22 ILE A 72 0.851 18.067 11.649 1.00 3.45 H new ATOM 0 HG23 ILE A 72 -0.564 17.616 12.628 1.00 3.45 H new ATOM 0 HD11 ILE A 72 -1.601 13.211 10.806 1.00 34.32 H new ATOM 0 HD12 ILE A 72 -1.674 14.382 9.468 1.00 34.32 H new ATOM 0 HD13 ILE A 72 -0.100 13.783 10.042 1.00 34.32 H new ATOM 1154 N THR A 73 -0.771 19.841 9.540 1.00 11.43 N ATOM 1155 CA THR A 73 0.075 20.995 9.245 1.00 74.21 C ATOM 1156 C THR A 73 0.903 21.323 10.496 1.00 0.33 C ATOM 1157 O THR A 73 0.325 21.525 11.562 1.00 35.11 O ATOM 1158 CB THR A 73 -0.819 22.139 8.716 1.00 12.51 C ATOM 1159 OG1 THR A 73 -0.043 23.234 8.277 1.00 61.44 O ATOM 1160 CG2 THR A 73 -1.887 22.666 9.685 1.00 41.24 C ATOM 0 H THR A 73 -1.700 20.093 9.877 1.00 11.43 H new ATOM 0 HA THR A 73 0.800 20.803 8.454 1.00 74.21 H new ATOM 0 HB THR A 73 -1.357 21.669 7.893 1.00 12.51 H new ATOM 0 HG1 THR A 73 -0.634 23.942 7.946 1.00 61.44 H new ATOM 0 HG21 THR A 73 -2.452 23.465 9.205 1.00 41.24 H new ATOM 0 HG22 THR A 73 -2.564 21.856 9.956 1.00 41.24 H new ATOM 0 HG23 THR A 73 -1.405 23.052 10.583 1.00 41.24 H new ATOM 1168 N GLN A 74 2.235 21.324 10.396 1.00 23.01 N ATOM 1169 CA GLN A 74 3.182 21.843 11.384 1.00 41.51 C ATOM 1170 C GLN A 74 3.925 23.028 10.759 1.00 75.11 C ATOM 1171 O GLN A 74 3.557 23.495 9.678 1.00 42.11 O ATOM 1172 CB GLN A 74 4.194 20.764 11.817 1.00 51.50 C ATOM 1173 CG GLN A 74 3.544 19.419 12.118 1.00 55.51 C ATOM 1174 CD GLN A 74 4.523 18.377 12.660 1.00 43.22 C ATOM 1175 OE1 GLN A 74 5.439 18.682 13.421 1.00 12.15 O ATOM 1176 NE2 GLN A 74 4.336 17.129 12.266 1.00 12.21 N ATOM 0 H GLN A 74 2.707 20.941 9.577 1.00 23.01 H new ATOM 0 HA GLN A 74 2.634 22.155 12.273 1.00 41.51 H new ATOM 0 HB2 GLN A 74 4.936 20.634 11.029 1.00 51.50 H new ATOM 0 HB3 GLN A 74 4.727 21.109 12.703 1.00 51.50 H new ATOM 0 HG2 GLN A 74 2.743 19.565 12.843 1.00 55.51 H new ATOM 0 HG3 GLN A 74 3.084 19.035 11.208 1.00 55.51 H new ATOM 0 HE21 GLN A 74 3.568 16.903 11.634 1.00 12.21 H new ATOM 0 HE22 GLN A 74 4.960 16.392 12.594 1.00 12.21 H new ATOM 1185 N GLU A 75 4.969 23.529 11.418 1.00 55.34 N ATOM 1186 CA GLU A 75 5.850 24.535 10.835 1.00 2.14 C ATOM 1187 C GLU A 75 7.297 24.018 10.779 1.00 41.13 C ATOM 1188 O GLU A 75 7.927 24.027 9.724 1.00 75.13 O ATOM 1189 CB GLU A 75 5.559 25.908 11.455 1.00 32.43 C ATOM 1190 CG GLU A 75 6.534 26.097 12.570 1.00 63.32 C ATOM 1191 CD GLU A 75 6.223 27.217 13.543 1.00 53.13 C ATOM 1192 OE1 GLU A 75 5.516 26.925 14.541 1.00 53.22 O ATOM 1193 OE2 GLU A 75 6.737 28.336 13.324 1.00 35.04 O ATOM 0 H GLU A 75 5.225 23.250 12.365 1.00 55.34 H new ATOM 0 HA GLU A 75 5.647 24.715 9.779 1.00 2.14 H new ATOM 0 HB2 GLU A 75 5.665 26.698 10.711 1.00 32.43 H new ATOM 0 HB3 GLU A 75 4.535 25.955 11.826 1.00 32.43 H new ATOM 0 HG2 GLU A 75 6.600 25.164 13.130 1.00 63.32 H new ATOM 0 HG3 GLU A 75 7.518 26.280 12.138 1.00 63.32 H new ATOM 1200 N GLU A 76 7.751 23.427 11.881 1.00 43.54 N ATOM 1201 CA GLU A 76 9.121 22.950 12.101 1.00 11.43 C ATOM 1202 C GLU A 76 9.174 21.433 11.868 1.00 60.24 C ATOM 1203 O GLU A 76 9.715 20.678 12.679 1.00 22.32 O ATOM 1204 CB GLU A 76 9.639 23.321 13.501 1.00 20.10 C ATOM 1205 CG GLU A 76 9.712 24.826 13.748 1.00 23.22 C ATOM 1206 CD GLU A 76 10.531 25.635 12.738 1.00 31.00 C ATOM 1207 OE1 GLU A 76 11.630 25.194 12.321 1.00 22.41 O ATOM 1208 OE2 GLU A 76 10.100 26.770 12.417 1.00 31.00 O ATOM 0 H GLU A 76 7.148 23.258 12.686 1.00 43.54 H new ATOM 0 HA GLU A 76 9.780 23.444 11.388 1.00 11.43 H new ATOM 0 HB2 GLU A 76 8.989 22.870 14.251 1.00 20.10 H new ATOM 0 HB3 GLU A 76 10.631 22.890 13.638 1.00 20.10 H new ATOM 0 HG2 GLU A 76 8.696 25.221 13.761 1.00 23.22 H new ATOM 0 HG3 GLU A 76 10.131 24.991 14.741 1.00 23.22 H new ATOM 1215 N GLY A 77 8.522 20.983 10.796 1.00 43.35 N ATOM 1216 CA GLY A 77 8.293 19.577 10.498 1.00 1.21 C ATOM 1217 C GLY A 77 7.654 19.374 9.128 1.00 75.40 C ATOM 1218 O GLY A 77 7.884 18.343 8.498 1.00 12.33 O ATOM 0 H GLY A 77 8.129 21.609 10.093 1.00 43.35 H new ATOM 0 HA2 GLY A 77 9.241 19.040 10.538 1.00 1.21 H new ATOM 0 HA3 GLY A 77 7.650 19.145 11.265 1.00 1.21 H new ATOM 1222 N GLY A 78 6.888 20.354 8.642 1.00 55.54 N ATOM 1223 CA GLY A 78 6.242 20.313 7.342 1.00 0.35 C ATOM 1224 C GLY A 78 4.755 20.022 7.502 1.00 62.10 C ATOM 1225 O GLY A 78 4.187 20.091 8.596 1.00 43.32 O ATOM 0 H GLY A 78 6.700 21.214 9.158 1.00 55.54 H new ATOM 0 HA2 GLY A 78 6.381 21.265 6.829 1.00 0.35 H new ATOM 0 HA3 GLY A 78 6.705 19.546 6.722 1.00 0.35 H new ATOM 1229 N ILE A 79 4.102 19.705 6.389 1.00 1.54 N ATOM 1230 CA ILE A 79 2.684 19.387 6.334 1.00 23.01 C ATOM 1231 C ILE A 79 2.573 17.925 5.904 1.00 20.35 C ATOM 1232 O ILE A 79 2.885 17.618 4.766 1.00 73.21 O ATOM 1233 CB ILE A 79 1.957 20.389 5.405 1.00 63.32 C ATOM 1234 CG1 ILE A 79 2.249 21.867 5.753 1.00 64.43 C ATOM 1235 CG2 ILE A 79 0.444 20.133 5.394 1.00 15.41 C ATOM 1236 CD1 ILE A 79 1.614 22.853 4.765 1.00 51.22 C ATOM 0 H ILE A 79 4.558 19.662 5.478 1.00 1.54 H new ATOM 0 HA ILE A 79 2.189 19.491 7.299 1.00 23.01 H new ATOM 0 HB ILE A 79 2.357 20.216 4.406 1.00 63.32 H new ATOM 0 HG12 ILE A 79 1.879 22.078 6.756 1.00 64.43 H new ATOM 0 HG13 ILE A 79 3.328 22.024 5.771 1.00 64.43 H new ATOM 0 HG21 ILE A 79 -0.042 20.851 4.733 1.00 15.41 H new ATOM 0 HG22 ILE A 79 0.249 19.122 5.037 1.00 15.41 H new ATOM 0 HG23 ILE A 79 0.049 20.244 6.404 1.00 15.41 H new ATOM 0 HD11 ILE A 79 1.855 23.873 5.063 1.00 51.22 H new ATOM 0 HD12 ILE A 79 2.003 22.666 3.764 1.00 51.22 H new ATOM 0 HD13 ILE A 79 0.532 22.721 4.764 1.00 51.22 H new ATOM 1248 N TYR A 80 2.185 17.008 6.788 1.00 13.51 N ATOM 1249 CA TYR A 80 2.038 15.585 6.482 1.00 55.13 C ATOM 1250 C TYR A 80 0.602 15.374 5.999 1.00 41.50 C ATOM 1251 O TYR A 80 -0.339 15.722 6.716 1.00 54.30 O ATOM 1252 CB TYR A 80 2.403 14.735 7.714 1.00 15.52 C ATOM 1253 CG TYR A 80 3.062 13.382 7.503 1.00 73.41 C ATOM 1254 CD1 TYR A 80 3.023 12.710 6.268 1.00 3.33 C ATOM 1255 CD2 TYR A 80 3.768 12.802 8.575 1.00 22.12 C ATOM 1256 CE1 TYR A 80 3.679 11.480 6.097 1.00 44.31 C ATOM 1257 CE2 TYR A 80 4.446 11.581 8.411 1.00 73.41 C ATOM 1258 CZ TYR A 80 4.398 10.912 7.168 1.00 51.42 C ATOM 1259 OH TYR A 80 4.996 9.706 6.992 1.00 23.14 O ATOM 0 H TYR A 80 1.959 17.237 7.756 1.00 13.51 H new ATOM 0 HA TYR A 80 2.721 15.264 5.695 1.00 55.13 H new ATOM 0 HB2 TYR A 80 3.067 15.331 8.341 1.00 15.52 H new ATOM 0 HB3 TYR A 80 1.489 14.571 8.284 1.00 15.52 H new ATOM 0 HD1 TYR A 80 2.482 13.145 5.441 1.00 3.33 H new ATOM 0 HD2 TYR A 80 3.789 13.300 9.533 1.00 22.12 H new ATOM 0 HE1 TYR A 80 3.633 10.970 5.146 1.00 44.31 H new ATOM 0 HE2 TYR A 80 5.002 11.156 9.233 1.00 73.41 H new ATOM 0 HH TYR A 80 5.454 9.445 7.818 1.00 23.14 H new ATOM 1269 N VAL A 81 0.413 14.890 4.770 1.00 14.41 N ATOM 1270 CA VAL A 81 -0.868 14.891 4.065 1.00 75.04 C ATOM 1271 C VAL A 81 -1.104 13.488 3.509 1.00 54.11 C ATOM 1272 O VAL A 81 -0.226 12.911 2.862 1.00 1.45 O ATOM 1273 CB VAL A 81 -0.847 15.976 2.963 1.00 21.11 C ATOM 1274 CG1 VAL A 81 -2.204 16.154 2.269 1.00 74.30 C ATOM 1275 CG2 VAL A 81 -0.451 17.342 3.535 1.00 63.34 C ATOM 0 H VAL A 81 1.168 14.475 4.224 1.00 14.41 H new ATOM 0 HA VAL A 81 -1.694 15.136 4.733 1.00 75.04 H new ATOM 0 HB VAL A 81 -0.114 15.626 2.237 1.00 21.11 H new ATOM 0 HG11 VAL A 81 -2.124 16.929 1.507 1.00 74.30 H new ATOM 0 HG12 VAL A 81 -2.500 15.215 1.802 1.00 74.30 H new ATOM 0 HG13 VAL A 81 -2.954 16.445 3.005 1.00 74.30 H new ATOM 0 HG21 VAL A 81 -0.445 18.083 2.736 1.00 63.34 H new ATOM 0 HG22 VAL A 81 -1.169 17.638 4.300 1.00 63.34 H new ATOM 0 HG23 VAL A 81 0.543 17.277 3.977 1.00 63.34 H new ATOM 1285 N SER A 82 -2.262 12.902 3.802 1.00 34.12 N ATOM 1286 CA SER A 82 -2.585 11.522 3.453 1.00 11.32 C ATOM 1287 C SER A 82 -4.073 11.466 3.162 1.00 31.02 C ATOM 1288 O SER A 82 -4.877 11.335 4.080 1.00 32.01 O ATOM 1289 CB SER A 82 -2.182 10.551 4.580 1.00 33.31 C ATOM 1290 OG SER A 82 -1.721 11.216 5.748 1.00 21.03 O ATOM 0 H SER A 82 -3.014 13.381 4.297 1.00 34.12 H new ATOM 0 HA SER A 82 -2.023 11.207 2.574 1.00 11.32 H new ATOM 0 HB2 SER A 82 -3.038 9.927 4.838 1.00 33.31 H new ATOM 0 HB3 SER A 82 -1.400 9.885 4.216 1.00 33.31 H new ATOM 0 HG SER A 82 -1.481 10.553 6.429 1.00 21.03 H new ATOM 1296 N LYS A 83 -4.470 11.673 1.905 1.00 23.42 N ATOM 1297 CA LYS A 83 -5.876 11.662 1.495 1.00 12.14 C ATOM 1298 C LYS A 83 -5.967 11.209 0.040 1.00 15.11 C ATOM 1299 O LYS A 83 -4.964 11.136 -0.667 1.00 2.21 O ATOM 1300 CB LYS A 83 -6.536 13.052 1.653 1.00 33.31 C ATOM 1301 CG LYS A 83 -6.459 13.644 3.069 1.00 52.43 C ATOM 1302 CD LYS A 83 -7.199 14.972 3.252 1.00 52.21 C ATOM 1303 CE LYS A 83 -6.463 16.133 2.569 1.00 63.53 C ATOM 1304 NZ LYS A 83 -7.036 16.499 1.257 1.00 75.44 N ATOM 0 H LYS A 83 -3.822 11.854 1.139 1.00 23.42 H new ATOM 0 HA LYS A 83 -6.414 10.970 2.143 1.00 12.14 H new ATOM 0 HB2 LYS A 83 -6.062 13.745 0.958 1.00 33.31 H new ATOM 0 HB3 LYS A 83 -7.584 12.976 1.362 1.00 33.31 H new ATOM 0 HG2 LYS A 83 -6.865 12.918 3.773 1.00 52.43 H new ATOM 0 HG3 LYS A 83 -5.411 13.790 3.330 1.00 52.43 H new ATOM 0 HD2 LYS A 83 -8.205 14.887 2.841 1.00 52.21 H new ATOM 0 HD3 LYS A 83 -7.306 15.185 4.316 1.00 52.21 H new ATOM 0 HE2 LYS A 83 -6.487 17.004 3.224 1.00 63.53 H new ATOM 0 HE3 LYS A 83 -5.415 15.862 2.437 1.00 63.53 H new ATOM 0 HZ1 LYS A 83 -6.494 17.288 0.850 1.00 75.44 H new ATOM 0 HZ2 LYS A 83 -6.990 15.680 0.617 1.00 75.44 H new ATOM 0 HZ3 LYS A 83 -8.028 16.787 1.379 1.00 75.44 H new ATOM 1318 N PHE A 84 -7.184 10.943 -0.424 1.00 13.22 N ATOM 1319 CA PHE A 84 -7.467 10.687 -1.833 1.00 51.12 C ATOM 1320 C PHE A 84 -7.198 11.955 -2.665 1.00 43.14 C ATOM 1321 O PHE A 84 -7.880 12.960 -2.475 1.00 53.00 O ATOM 1322 CB PHE A 84 -8.921 10.207 -1.981 1.00 54.43 C ATOM 1323 CG PHE A 84 -9.225 8.920 -1.230 1.00 14.13 C ATOM 1324 CD1 PHE A 84 -8.953 7.671 -1.817 1.00 22.55 C ATOM 1325 CD2 PHE A 84 -9.774 8.962 0.066 1.00 53.13 C ATOM 1326 CE1 PHE A 84 -9.183 6.481 -1.102 1.00 3.45 C ATOM 1327 CE2 PHE A 84 -10.030 7.772 0.767 1.00 60.51 C ATOM 1328 CZ PHE A 84 -9.729 6.529 0.189 1.00 0.45 C ATOM 0 H PHE A 84 -8.010 10.899 0.173 1.00 13.22 H new ATOM 0 HA PHE A 84 -6.809 9.903 -2.208 1.00 51.12 H new ATOM 0 HB2 PHE A 84 -9.590 10.990 -1.625 1.00 54.43 H new ATOM 0 HB3 PHE A 84 -9.138 10.059 -3.039 1.00 54.43 H new ATOM 0 HD1 PHE A 84 -8.565 7.625 -2.824 1.00 22.55 H new ATOM 0 HD2 PHE A 84 -9.999 9.914 0.523 1.00 53.13 H new ATOM 0 HE1 PHE A 84 -8.938 5.528 -1.548 1.00 3.45 H new ATOM 0 HE2 PHE A 84 -10.461 7.814 1.756 1.00 60.51 H new ATOM 0 HZ PHE A 84 -9.916 5.616 0.734 1.00 0.45 H new ATOM 1338 N THR A 85 -6.179 11.956 -3.531 1.00 33.33 N ATOM 1339 CA THR A 85 -5.913 13.014 -4.515 1.00 15.12 C ATOM 1340 C THR A 85 -7.054 13.095 -5.552 1.00 13.45 C ATOM 1341 O THR A 85 -7.531 14.190 -5.866 1.00 21.54 O ATOM 1342 CB THR A 85 -4.497 12.847 -5.153 1.00 22.35 C ATOM 1343 OG1 THR A 85 -4.427 13.391 -6.457 1.00 52.14 O ATOM 1344 CG2 THR A 85 -4.010 11.399 -5.278 1.00 62.51 C ATOM 0 H THR A 85 -5.496 11.199 -3.569 1.00 33.33 H new ATOM 0 HA THR A 85 -5.896 13.977 -4.005 1.00 15.12 H new ATOM 0 HB THR A 85 -3.859 13.383 -4.450 1.00 22.35 H new ATOM 0 HG1 THR A 85 -3.524 13.265 -6.816 1.00 52.14 H new ATOM 0 HG21 THR A 85 -3.019 11.386 -5.732 1.00 62.51 H new ATOM 0 HG22 THR A 85 -3.962 10.945 -4.288 1.00 62.51 H new ATOM 0 HG23 THR A 85 -4.702 10.835 -5.903 1.00 62.51 H new ATOM 1352 N LEU A 86 -7.465 11.951 -6.103 1.00 60.51 N ATOM 1353 CA LEU A 86 -8.412 11.778 -7.204 1.00 15.24 C ATOM 1354 C LEU A 86 -9.828 11.682 -6.633 1.00 44.32 C ATOM 1355 O LEU A 86 -9.982 11.307 -5.470 1.00 63.13 O ATOM 1356 CB LEU A 86 -8.011 10.496 -7.964 1.00 43.00 C ATOM 1357 CG LEU A 86 -8.770 10.204 -9.270 1.00 44.40 C ATOM 1358 CD1 LEU A 86 -8.430 11.235 -10.349 1.00 31.33 C ATOM 1359 CD2 LEU A 86 -8.415 8.800 -9.766 1.00 1.34 C ATOM 0 H LEU A 86 -7.117 11.054 -5.765 1.00 60.51 H new ATOM 0 HA LEU A 86 -8.392 12.622 -7.894 1.00 15.24 H new ATOM 0 HB2 LEU A 86 -6.947 10.555 -8.194 1.00 43.00 H new ATOM 0 HB3 LEU A 86 -8.146 9.647 -7.294 1.00 43.00 H new ATOM 0 HG LEU A 86 -9.839 10.265 -9.067 1.00 44.40 H new ATOM 0 HD11 LEU A 86 -8.981 11.003 -11.260 1.00 31.33 H new ATOM 0 HD12 LEU A 86 -8.706 12.230 -10.001 1.00 31.33 H new ATOM 0 HD13 LEU A 86 -7.360 11.207 -10.555 1.00 31.33 H new ATOM 0 HD21 LEU A 86 -8.953 8.594 -10.691 1.00 1.34 H new ATOM 0 HD22 LEU A 86 -7.342 8.739 -9.949 1.00 1.34 H new ATOM 0 HD23 LEU A 86 -8.696 8.066 -9.011 1.00 1.34 H new ATOM 1371 N ASN A 87 -10.865 11.926 -7.443 1.00 0.35 N ATOM 1372 CA ASN A 87 -12.266 11.938 -7.005 1.00 44.24 C ATOM 1373 C ASN A 87 -13.162 11.111 -7.939 1.00 75.34 C ATOM 1374 O ASN A 87 -14.336 11.428 -8.150 1.00 54.40 O ATOM 1375 CB ASN A 87 -12.730 13.395 -6.844 1.00 24.32 C ATOM 1376 CG ASN A 87 -12.451 13.873 -5.434 1.00 34.55 C ATOM 1377 OD1 ASN A 87 -13.248 13.621 -4.533 1.00 12.12 O ATOM 1378 ND2 ASN A 87 -11.354 14.562 -5.205 1.00 54.04 N ATOM 0 H ASN A 87 -10.753 12.124 -8.437 1.00 0.35 H new ATOM 0 HA ASN A 87 -12.350 11.452 -6.033 1.00 44.24 H new ATOM 0 HB2 ASN A 87 -12.213 14.032 -7.562 1.00 24.32 H new ATOM 0 HB3 ASN A 87 -13.796 13.472 -7.059 1.00 24.32 H new ATOM 0 HD21 ASN A 87 -11.151 14.899 -4.264 1.00 54.04 H new ATOM 0 HD22 ASN A 87 -10.707 14.759 -5.968 1.00 54.04 H new ATOM 1385 N GLU A 88 -12.624 10.052 -8.544 1.00 44.21 N ATOM 1386 CA GLU A 88 -13.361 9.194 -9.461 1.00 43.04 C ATOM 1387 C GLU A 88 -14.188 8.148 -8.712 1.00 42.01 C ATOM 1388 O GLU A 88 -13.923 7.852 -7.544 1.00 32.55 O ATOM 1389 CB GLU A 88 -12.374 8.498 -10.411 1.00 73.11 C ATOM 1390 CG GLU A 88 -11.828 9.451 -11.468 1.00 43.43 C ATOM 1391 CD GLU A 88 -12.920 10.173 -12.245 1.00 61.10 C ATOM 1392 OE1 GLU A 88 -13.427 9.584 -13.223 1.00 74.10 O ATOM 1393 OE2 GLU A 88 -13.292 11.305 -11.847 1.00 63.54 O ATOM 0 H GLU A 88 -11.654 9.766 -8.407 1.00 44.21 H new ATOM 0 HA GLU A 88 -14.051 9.816 -10.030 1.00 43.04 H new ATOM 0 HB2 GLU A 88 -11.547 8.084 -9.834 1.00 73.11 H new ATOM 0 HB3 GLU A 88 -12.872 7.661 -10.900 1.00 73.11 H new ATOM 0 HG2 GLU A 88 -11.186 10.188 -10.986 1.00 43.43 H new ATOM 0 HG3 GLU A 88 -11.204 8.892 -12.165 1.00 43.43 H new ATOM 1400 N PRO A 89 -15.191 7.544 -9.367 1.00 42.20 N ATOM 1401 CA PRO A 89 -15.978 6.463 -8.788 1.00 35.25 C ATOM 1402 C PRO A 89 -15.177 5.161 -8.687 1.00 21.21 C ATOM 1403 O PRO A 89 -15.009 4.637 -7.590 1.00 20.24 O ATOM 1404 CB PRO A 89 -17.196 6.320 -9.705 1.00 24.52 C ATOM 1405 CG PRO A 89 -16.702 6.853 -11.047 1.00 63.33 C ATOM 1406 CD PRO A 89 -15.708 7.946 -10.664 1.00 4.03 C ATOM 0 HA PRO A 89 -16.273 6.685 -7.762 1.00 35.25 H new ATOM 0 HB2 PRO A 89 -17.520 5.282 -9.781 1.00 24.52 H new ATOM 0 HB3 PRO A 89 -18.046 6.893 -9.335 1.00 24.52 H new ATOM 0 HG2 PRO A 89 -16.227 6.070 -11.638 1.00 63.33 H new ATOM 0 HG3 PRO A 89 -17.522 7.250 -11.645 1.00 63.33 H new ATOM 0 HD2 PRO A 89 -14.908 8.028 -11.400 1.00 4.03 H new ATOM 0 HD3 PRO A 89 -16.193 8.920 -10.611 1.00 4.03 H new ATOM 1414 N LYS A 90 -14.624 4.652 -9.788 1.00 41.23 N ATOM 1415 CA LYS A 90 -14.006 3.323 -9.833 1.00 40.02 C ATOM 1416 C LYS A 90 -12.497 3.358 -9.538 1.00 31.21 C ATOM 1417 O LYS A 90 -11.863 2.314 -9.649 1.00 1.41 O ATOM 1418 CB LYS A 90 -14.327 2.664 -11.200 1.00 44.24 C ATOM 1419 CG LYS A 90 -15.532 1.700 -11.244 1.00 23.34 C ATOM 1420 CD LYS A 90 -16.858 2.201 -10.646 1.00 2.14 C ATOM 1421 CE LYS A 90 -17.091 1.649 -9.231 1.00 52.13 C ATOM 1422 NZ LYS A 90 -18.174 0.637 -9.182 1.00 11.41 N ATOM 0 H LYS A 90 -14.591 5.150 -10.678 1.00 41.23 H new ATOM 0 HA LYS A 90 -14.433 2.713 -9.036 1.00 40.02 H new ATOM 0 HB2 LYS A 90 -14.500 3.458 -11.927 1.00 44.24 H new ATOM 0 HB3 LYS A 90 -13.443 2.118 -11.529 1.00 44.24 H new ATOM 0 HG2 LYS A 90 -15.711 1.432 -12.285 1.00 23.34 H new ATOM 0 HG3 LYS A 90 -15.251 0.785 -10.723 1.00 23.34 H new ATOM 0 HD2 LYS A 90 -16.854 3.291 -10.615 1.00 2.14 H new ATOM 0 HD3 LYS A 90 -17.684 1.904 -11.293 1.00 2.14 H new ATOM 0 HE2 LYS A 90 -16.167 1.204 -8.862 1.00 52.13 H new ATOM 0 HE3 LYS A 90 -17.338 2.472 -8.561 1.00 52.13 H new ATOM 0 HZ1 LYS A 90 -18.289 0.298 -8.205 1.00 11.41 H new ATOM 0 HZ2 LYS A 90 -19.064 1.065 -9.507 1.00 11.41 H new ATOM 0 HZ3 LYS A 90 -17.929 -0.163 -9.799 1.00 11.41 H new ATOM 1436 N HIS A 91 -11.901 4.501 -9.175 1.00 75.33 N ATOM 1437 CA HIS A 91 -10.458 4.718 -9.168 1.00 3.44 C ATOM 1438 C HIS A 91 -10.162 5.630 -7.969 1.00 54.00 C ATOM 1439 O HIS A 91 -10.714 6.728 -7.867 1.00 41.43 O ATOM 1440 CB HIS A 91 -10.062 5.342 -10.521 1.00 42.44 C ATOM 1441 CG HIS A 91 -8.590 5.392 -10.859 1.00 41.20 C ATOM 1442 ND1 HIS A 91 -8.086 5.671 -12.112 1.00 31.42 N ATOM 1443 CD2 HIS A 91 -7.528 5.056 -10.060 1.00 62.12 C ATOM 1444 CE1 HIS A 91 -6.754 5.528 -12.064 1.00 24.15 C ATOM 1445 NE2 HIS A 91 -6.370 5.147 -10.836 1.00 11.34 N ATOM 0 H HIS A 91 -12.428 5.319 -8.871 1.00 75.33 H new ATOM 0 HA HIS A 91 -9.877 3.802 -9.059 1.00 3.44 H new ATOM 0 HB2 HIS A 91 -10.570 4.787 -11.310 1.00 42.44 H new ATOM 0 HB3 HIS A 91 -10.449 6.361 -10.548 1.00 42.44 H new ATOM 0 HD2 HIS A 91 -7.578 4.772 -9.019 1.00 62.12 H new ATOM 0 HE1 HIS A 91 -6.085 5.696 -12.895 1.00 24.15 H new ATOM 0 HE2 HIS A 91 -5.416 4.960 -10.528 1.00 11.34 H new ATOM 1453 N LYS A 92 -9.358 5.170 -7.012 1.00 74.51 N ATOM 1454 CA LYS A 92 -9.139 5.792 -5.708 1.00 11.42 C ATOM 1455 C LYS A 92 -7.652 5.646 -5.398 1.00 13.05 C ATOM 1456 O LYS A 92 -7.200 4.552 -5.097 1.00 12.42 O ATOM 1457 CB LYS A 92 -9.978 5.059 -4.643 1.00 43.24 C ATOM 1458 CG LYS A 92 -11.502 5.250 -4.650 1.00 62.42 C ATOM 1459 CD LYS A 92 -11.983 6.533 -3.968 1.00 32.15 C ATOM 1460 CE LYS A 92 -13.270 6.295 -3.164 1.00 33.34 C ATOM 1461 NZ LYS A 92 -14.077 7.529 -3.088 1.00 22.13 N ATOM 0 H LYS A 92 -8.817 4.314 -7.130 1.00 74.51 H new ATOM 0 HA LYS A 92 -9.434 6.841 -5.710 1.00 11.42 H new ATOM 0 HB2 LYS A 92 -9.777 3.992 -4.740 1.00 43.24 H new ATOM 0 HB3 LYS A 92 -9.610 5.365 -3.663 1.00 43.24 H new ATOM 0 HG2 LYS A 92 -11.851 5.249 -5.683 1.00 62.42 H new ATOM 0 HG3 LYS A 92 -11.965 4.395 -4.157 1.00 62.42 H new ATOM 0 HD2 LYS A 92 -11.203 6.908 -3.305 1.00 32.15 H new ATOM 0 HD3 LYS A 92 -12.160 7.302 -4.720 1.00 32.15 H new ATOM 0 HE2 LYS A 92 -13.854 5.502 -3.630 1.00 33.34 H new ATOM 0 HE3 LYS A 92 -13.019 5.957 -2.159 1.00 33.34 H new ATOM 0 HZ1 LYS A 92 -14.942 7.345 -2.540 1.00 22.13 H new ATOM 0 HZ2 LYS A 92 -13.525 8.277 -2.622 1.00 22.13 H new ATOM 0 HZ3 LYS A 92 -14.334 7.835 -4.048 1.00 22.13 H new ATOM 1475 N ILE A 93 -6.868 6.711 -5.507 1.00 43.02 N ATOM 1476 CA ILE A 93 -5.447 6.672 -5.141 1.00 43.14 C ATOM 1477 C ILE A 93 -5.344 6.915 -3.628 1.00 42.02 C ATOM 1478 O ILE A 93 -6.150 7.691 -3.110 1.00 31.25 O ATOM 1479 CB ILE A 93 -4.644 7.748 -5.916 1.00 35.52 C ATOM 1480 CG1 ILE A 93 -5.145 8.158 -7.314 1.00 51.41 C ATOM 1481 CG2 ILE A 93 -3.195 7.316 -6.037 1.00 2.14 C ATOM 1482 CD1 ILE A 93 -5.462 7.018 -8.281 1.00 0.05 C ATOM 0 H ILE A 93 -7.188 7.618 -5.846 1.00 43.02 H new ATOM 0 HA ILE A 93 -5.024 5.702 -5.401 1.00 43.14 H new ATOM 0 HB ILE A 93 -4.784 8.640 -5.306 1.00 35.52 H new ATOM 0 HG12 ILE A 93 -6.044 8.763 -7.192 1.00 51.41 H new ATOM 0 HG13 ILE A 93 -4.391 8.797 -7.774 1.00 51.41 H new ATOM 0 HG21 ILE A 93 -2.633 8.075 -6.582 1.00 2.14 H new ATOM 0 HG22 ILE A 93 -2.768 7.194 -5.042 1.00 2.14 H new ATOM 0 HG23 ILE A 93 -3.141 6.369 -6.574 1.00 2.14 H new ATOM 0 HD11 ILE A 93 -5.805 7.431 -9.230 1.00 0.05 H new ATOM 0 HD12 ILE A 93 -4.565 6.422 -8.447 1.00 0.05 H new ATOM 0 HD13 ILE A 93 -6.243 6.387 -7.856 1.00 0.05 H new ATOM 1494 N PHE A 94 -4.342 6.383 -2.931 1.00 55.20 N ATOM 1495 CA PHE A 94 -4.078 6.710 -1.533 1.00 0.02 C ATOM 1496 C PHE A 94 -2.588 7.019 -1.390 1.00 41.43 C ATOM 1497 O PHE A 94 -1.759 6.126 -1.236 1.00 31.25 O ATOM 1498 CB PHE A 94 -4.599 5.599 -0.611 1.00 14.34 C ATOM 1499 CG PHE A 94 -4.344 5.839 0.866 1.00 53.42 C ATOM 1500 CD1 PHE A 94 -5.013 6.878 1.544 1.00 52.20 C ATOM 1501 CD2 PHE A 94 -3.452 5.009 1.571 1.00 11.42 C ATOM 1502 CE1 PHE A 94 -4.783 7.089 2.916 1.00 1.44 C ATOM 1503 CE2 PHE A 94 -3.238 5.213 2.945 1.00 3.54 C ATOM 1504 CZ PHE A 94 -3.896 6.257 3.619 1.00 33.44 C ATOM 0 H PHE A 94 -3.686 5.708 -3.324 1.00 55.20 H new ATOM 0 HA PHE A 94 -4.621 7.601 -1.218 1.00 0.02 H new ATOM 0 HB2 PHE A 94 -5.672 5.486 -0.768 1.00 14.34 H new ATOM 0 HB3 PHE A 94 -4.134 4.656 -0.899 1.00 14.34 H new ATOM 0 HD1 PHE A 94 -5.704 7.513 1.009 1.00 52.20 H new ATOM 0 HD2 PHE A 94 -2.932 4.215 1.056 1.00 11.42 H new ATOM 0 HE1 PHE A 94 -5.290 7.893 3.430 1.00 1.44 H new ATOM 0 HE2 PHE A 94 -2.565 4.565 3.486 1.00 3.54 H new ATOM 0 HZ PHE A 94 -3.720 6.418 4.672 1.00 33.44 H new ATOM 1514 N GLU A 95 -2.262 8.308 -1.491 1.00 1.41 N ATOM 1515 CA GLU A 95 -0.906 8.838 -1.504 1.00 22.45 C ATOM 1516 C GLU A 95 -0.692 9.535 -0.157 1.00 74.03 C ATOM 1517 O GLU A 95 -1.529 10.362 0.236 1.00 33.34 O ATOM 1518 CB GLU A 95 -0.735 9.840 -2.662 1.00 75.33 C ATOM 1519 CG GLU A 95 -1.233 9.387 -4.044 1.00 74.40 C ATOM 1520 CD GLU A 95 -0.399 8.281 -4.703 1.00 61.42 C ATOM 1521 OE1 GLU A 95 -0.524 7.093 -4.328 1.00 51.10 O ATOM 1522 OE2 GLU A 95 0.321 8.596 -5.679 1.00 3.35 O ATOM 0 H GLU A 95 -2.969 9.039 -1.569 1.00 1.41 H new ATOM 0 HA GLU A 95 -0.176 8.042 -1.651 1.00 22.45 H new ATOM 0 HB2 GLU A 95 -1.257 10.760 -2.397 1.00 75.33 H new ATOM 0 HB3 GLU A 95 0.323 10.087 -2.745 1.00 75.33 H new ATOM 0 HG2 GLU A 95 -2.261 9.037 -3.946 1.00 74.40 H new ATOM 0 HG3 GLU A 95 -1.252 10.251 -4.708 1.00 74.40 H new ATOM 1529 N ALA A 96 0.385 9.196 0.554 1.00 32.21 N ATOM 1530 CA ALA A 96 0.663 9.650 1.907 1.00 21.02 C ATOM 1531 C ALA A 96 2.116 10.119 2.008 1.00 13.34 C ATOM 1532 O ALA A 96 3.047 9.310 1.969 1.00 4.33 O ATOM 1533 CB ALA A 96 0.392 8.500 2.880 1.00 52.53 C ATOM 0 H ALA A 96 1.108 8.577 0.187 1.00 32.21 H new ATOM 0 HA ALA A 96 0.017 10.491 2.161 1.00 21.02 H new ATOM 0 HB1 ALA A 96 0.597 8.829 3.899 1.00 52.53 H new ATOM 0 HB2 ALA A 96 -0.651 8.195 2.801 1.00 52.53 H new ATOM 0 HB3 ALA A 96 1.037 7.656 2.635 1.00 52.53 H new ATOM 1539 N GLY A 97 2.324 11.429 2.118 1.00 32.13 N ATOM 1540 CA GLY A 97 3.646 12.008 2.254 1.00 52.32 C ATOM 1541 C GLY A 97 3.618 13.366 2.914 1.00 33.31 C ATOM 1542 O GLY A 97 2.552 13.951 3.138 1.00 53.20 O ATOM 0 H GLY A 97 1.571 12.118 2.115 1.00 32.13 H new ATOM 0 HA2 GLY A 97 4.275 11.336 2.839 1.00 52.32 H new ATOM 0 HA3 GLY A 97 4.104 12.096 1.269 1.00 52.32 H new ATOM 1546 N TYR A 98 4.808 13.878 3.203 1.00 52.40 N ATOM 1547 CA TYR A 98 4.953 15.277 3.544 1.00 40.52 C ATOM 1548 C TYR A 98 4.749 16.106 2.281 1.00 15.24 C ATOM 1549 O TYR A 98 5.011 15.660 1.162 1.00 15.44 O ATOM 1550 CB TYR A 98 6.306 15.527 4.207 1.00 3.34 C ATOM 1551 CG TYR A 98 6.249 15.426 5.716 1.00 21.05 C ATOM 1552 CD1 TYR A 98 5.673 16.478 6.448 1.00 22.24 C ATOM 1553 CD2 TYR A 98 6.757 14.301 6.393 1.00 33.21 C ATOM 1554 CE1 TYR A 98 5.571 16.401 7.846 1.00 41.20 C ATOM 1555 CE2 TYR A 98 6.679 14.229 7.797 1.00 43.24 C ATOM 1556 CZ TYR A 98 6.076 15.276 8.529 1.00 12.35 C ATOM 1557 OH TYR A 98 5.934 15.203 9.880 1.00 40.50 O ATOM 0 H TYR A 98 5.678 13.345 3.207 1.00 52.40 H new ATOM 0 HA TYR A 98 4.199 15.577 4.272 1.00 40.52 H new ATOM 0 HB2 TYR A 98 7.030 14.807 3.827 1.00 3.34 H new ATOM 0 HB3 TYR A 98 6.665 16.518 3.927 1.00 3.34 H new ATOM 0 HD1 TYR A 98 5.306 17.352 5.931 1.00 22.24 H new ATOM 0 HD2 TYR A 98 7.207 13.493 5.835 1.00 33.21 H new ATOM 0 HE1 TYR A 98 5.106 17.204 8.398 1.00 41.20 H new ATOM 0 HE2 TYR A 98 7.081 13.371 8.316 1.00 43.24 H new ATOM 0 HH TYR A 98 6.331 14.369 10.206 1.00 40.50 H new ATOM 1567 N GLU A 99 4.244 17.320 2.458 1.00 40.52 N ATOM 1568 CA GLU A 99 3.939 18.249 1.384 1.00 33.11 C ATOM 1569 C GLU A 99 5.244 18.832 0.822 1.00 42.34 C ATOM 1570 O GLU A 99 5.303 19.201 -0.350 1.00 1.15 O ATOM 1571 CB GLU A 99 2.983 19.302 1.962 1.00 62.41 C ATOM 1572 CG GLU A 99 2.159 20.090 0.942 1.00 23.44 C ATOM 1573 CD GLU A 99 2.933 21.234 0.282 1.00 52.52 C ATOM 1574 OE1 GLU A 99 3.587 22.008 1.011 1.00 75.22 O ATOM 1575 OE2 GLU A 99 2.838 21.355 -0.966 1.00 43.24 O ATOM 0 H GLU A 99 4.030 17.694 3.382 1.00 40.52 H new ATOM 0 HA GLU A 99 3.446 17.769 0.538 1.00 33.11 H new ATOM 0 HB2 GLU A 99 2.297 18.804 2.647 1.00 62.41 H new ATOM 0 HB3 GLU A 99 3.566 20.009 2.552 1.00 62.41 H new ATOM 0 HG2 GLU A 99 1.805 19.408 0.169 1.00 23.44 H new ATOM 0 HG3 GLU A 99 1.277 20.497 1.436 1.00 23.44 H new ATOM 1582 N GLU A 100 6.312 18.842 1.624 1.00 71.42 N ATOM 1583 CA GLU A 100 7.631 19.358 1.278 1.00 41.10 C ATOM 1584 C GLU A 100 8.735 18.307 1.485 1.00 1.11 C ATOM 1585 O GLU A 100 9.911 18.661 1.518 1.00 15.40 O ATOM 1586 CB GLU A 100 7.898 20.669 2.040 1.00 22.40 C ATOM 1587 CG GLU A 100 7.955 20.495 3.567 1.00 44.24 C ATOM 1588 CD GLU A 100 8.677 21.667 4.239 1.00 61.11 C ATOM 1589 OE1 GLU A 100 9.887 21.867 3.969 1.00 73.25 O ATOM 1590 OE2 GLU A 100 8.052 22.392 5.041 1.00 43.23 O ATOM 0 H GLU A 100 6.275 18.473 2.574 1.00 71.42 H new ATOM 0 HA GLU A 100 7.648 19.586 0.212 1.00 41.10 H new ATOM 0 HB2 GLU A 100 8.841 21.093 1.696 1.00 22.40 H new ATOM 0 HB3 GLU A 100 7.116 21.388 1.794 1.00 22.40 H new ATOM 0 HG2 GLU A 100 6.943 20.415 3.963 1.00 44.24 H new ATOM 0 HG3 GLU A 100 8.467 19.564 3.809 1.00 44.24 H new ATOM 1597 N SER A 101 8.387 17.024 1.599 1.00 42.34 N ATOM 1598 CA SER A 101 9.331 15.910 1.613 1.00 41.24 C ATOM 1599 C SER A 101 8.825 14.864 0.618 1.00 41.52 C ATOM 1600 O SER A 101 7.958 15.142 -0.215 1.00 40.20 O ATOM 1601 CB SER A 101 9.469 15.322 3.026 1.00 21.43 C ATOM 1602 OG SER A 101 10.797 15.006 3.380 1.00 54.13 O ATOM 0 H SER A 101 7.416 16.726 1.686 1.00 42.34 H new ATOM 0 HA SER A 101 10.325 16.250 1.322 1.00 41.24 H new ATOM 0 HB2 SER A 101 9.070 16.035 3.747 1.00 21.43 H new ATOM 0 HB3 SER A 101 8.859 14.421 3.097 1.00 21.43 H new ATOM 0 HG SER A 101 10.990 14.078 3.132 1.00 54.13 H new ATOM 1608 N GLU A 102 9.396 13.668 0.677 1.00 71.02 N ATOM 1609 CA GLU A 102 8.880 12.497 -0.012 1.00 2.45 C ATOM 1610 C GLU A 102 7.582 11.952 0.608 1.00 72.24 C ATOM 1611 O GLU A 102 7.073 12.453 1.618 1.00 63.20 O ATOM 1612 CB GLU A 102 9.994 11.466 -0.185 1.00 21.23 C ATOM 1613 CG GLU A 102 10.524 11.008 1.156 1.00 21.32 C ATOM 1614 CD GLU A 102 11.837 11.672 1.574 1.00 64.24 C ATOM 1615 OE1 GLU A 102 12.761 11.808 0.732 1.00 4.31 O ATOM 1616 OE2 GLU A 102 11.954 12.028 2.767 1.00 20.11 O ATOM 0 H GLU A 102 10.244 13.484 1.214 1.00 71.02 H new ATOM 0 HA GLU A 102 8.565 12.790 -1.013 1.00 2.45 H new ATOM 0 HB2 GLU A 102 9.617 10.609 -0.743 1.00 21.23 H new ATOM 0 HB3 GLU A 102 10.805 11.897 -0.772 1.00 21.23 H new ATOM 0 HG2 GLU A 102 9.771 11.207 1.918 1.00 21.32 H new ATOM 0 HG3 GLU A 102 10.670 9.928 1.126 1.00 21.32 H new ATOM 1623 N VAL A 103 7.039 10.920 -0.035 1.00 73.03 N ATOM 1624 CA VAL A 103 6.031 10.032 0.524 1.00 2.34 C ATOM 1625 C VAL A 103 6.685 8.933 1.360 1.00 61.31 C ATOM 1626 O VAL A 103 7.826 8.546 1.109 1.00 20.03 O ATOM 1627 CB VAL A 103 5.185 9.414 -0.605 1.00 34.22 C ATOM 1628 CG1 VAL A 103 4.165 10.417 -1.159 1.00 24.31 C ATOM 1629 CG2 VAL A 103 6.070 8.902 -1.747 1.00 75.34 C ATOM 0 H VAL A 103 7.299 10.674 -0.990 1.00 73.03 H new ATOM 0 HA VAL A 103 5.379 10.614 1.175 1.00 2.34 H new ATOM 0 HB VAL A 103 4.646 8.573 -0.170 1.00 34.22 H new ATOM 0 HG11 VAL A 103 3.586 9.946 -1.954 1.00 24.31 H new ATOM 0 HG12 VAL A 103 3.494 10.733 -0.360 1.00 24.31 H new ATOM 0 HG13 VAL A 103 4.689 11.286 -1.558 1.00 24.31 H new ATOM 0 HG21 VAL A 103 5.443 8.472 -2.528 1.00 75.34 H new ATOM 0 HG22 VAL A 103 6.647 9.730 -2.159 1.00 75.34 H new ATOM 0 HG23 VAL A 103 6.750 8.140 -1.367 1.00 75.34 H new ATOM 1639 N ASP A 104 5.904 8.366 2.281 1.00 43.33 N ATOM 1640 CA ASP A 104 6.254 7.152 3.025 1.00 40.52 C ATOM 1641 C ASP A 104 5.418 5.975 2.499 1.00 33.14 C ATOM 1642 O ASP A 104 5.830 4.822 2.613 1.00 23.44 O ATOM 1643 CB ASP A 104 6.055 7.394 4.542 1.00 2.21 C ATOM 1644 CG ASP A 104 7.115 6.740 5.445 1.00 4.15 C ATOM 1645 OD1 ASP A 104 8.295 7.171 5.360 1.00 71.40 O ATOM 1646 OD2 ASP A 104 6.768 5.888 6.301 1.00 41.30 O ATOM 0 H ASP A 104 4.992 8.744 2.537 1.00 43.33 H new ATOM 0 HA ASP A 104 7.304 6.901 2.876 1.00 40.52 H new ATOM 0 HB2 ASP A 104 6.053 8.468 4.727 1.00 2.21 H new ATOM 0 HB3 ASP A 104 5.072 7.020 4.829 1.00 2.21 H new ATOM 1651 N LEU A 105 4.272 6.244 1.843 1.00 22.15 N ATOM 1652 CA LEU A 105 3.380 5.241 1.254 1.00 23.35 C ATOM 1653 C LEU A 105 2.663 5.843 0.042 1.00 31.44 C ATOM 1654 O LEU A 105 2.222 6.993 0.090 1.00 3.21 O ATOM 1655 CB LEU A 105 2.338 4.789 2.300 1.00 3.34 C ATOM 1656 CG LEU A 105 1.517 3.565 1.846 1.00 20.41 C ATOM 1657 CD1 LEU A 105 2.316 2.285 2.112 1.00 51.33 C ATOM 1658 CD2 LEU A 105 0.177 3.487 2.583 1.00 71.01 C ATOM 0 H LEU A 105 3.936 7.198 1.707 1.00 22.15 H new ATOM 0 HA LEU A 105 3.967 4.379 0.938 1.00 23.35 H new ATOM 0 HB2 LEU A 105 2.848 4.551 3.233 1.00 3.34 H new ATOM 0 HB3 LEU A 105 1.660 5.616 2.510 1.00 3.34 H new ATOM 0 HG LEU A 105 1.316 3.669 0.780 1.00 20.41 H new ATOM 0 HD11 LEU A 105 1.735 1.420 1.791 1.00 51.33 H new ATOM 0 HD12 LEU A 105 3.253 2.319 1.557 1.00 51.33 H new ATOM 0 HD13 LEU A 105 2.529 2.204 3.178 1.00 51.33 H new ATOM 0 HD21 LEU A 105 -0.377 2.613 2.240 1.00 71.01 H new ATOM 0 HD22 LEU A 105 0.356 3.405 3.655 1.00 71.01 H new ATOM 0 HD23 LEU A 105 -0.403 4.387 2.380 1.00 71.01 H new ATOM 1670 N ARG A 106 2.497 5.070 -1.034 1.00 22.05 N ATOM 1671 CA ARG A 106 1.601 5.388 -2.158 1.00 0.13 C ATOM 1672 C ARG A 106 0.858 4.118 -2.565 1.00 64.34 C ATOM 1673 O ARG A 106 1.240 3.030 -2.106 1.00 72.13 O ATOM 1674 CB ARG A 106 2.356 5.984 -3.369 1.00 35.35 C ATOM 1675 CG ARG A 106 3.355 7.096 -3.064 1.00 72.23 C ATOM 1676 CD ARG A 106 3.413 8.192 -4.135 1.00 0.15 C ATOM 1677 NE ARG A 106 3.852 7.700 -5.442 1.00 35.45 N ATOM 1678 CZ ARG A 106 4.086 8.474 -6.505 1.00 11.03 C ATOM 1679 NH1 ARG A 106 3.819 9.779 -6.494 1.00 44.10 N ATOM 1680 NH2 ARG A 106 4.585 7.912 -7.593 1.00 31.35 N ATOM 0 H ARG A 106 2.991 4.186 -1.155 1.00 22.05 H new ATOM 0 HA ARG A 106 0.897 6.152 -1.828 1.00 0.13 H new ATOM 0 HB2 ARG A 106 2.887 5.176 -3.872 1.00 35.35 H new ATOM 0 HB3 ARG A 106 1.620 6.370 -4.075 1.00 35.35 H new ATOM 0 HG2 ARG A 106 3.097 7.550 -2.107 1.00 72.23 H new ATOM 0 HG3 ARG A 106 4.347 6.659 -2.952 1.00 72.23 H new ATOM 0 HD2 ARG A 106 2.426 8.644 -4.237 1.00 0.15 H new ATOM 0 HD3 ARG A 106 4.091 8.979 -3.804 1.00 0.15 H new ATOM 0 HE ARG A 106 3.989 6.695 -5.548 1.00 35.45 H new ATOM 0 HH11 ARG A 106 3.425 10.212 -5.659 1.00 44.10 H new ATOM 0 HH12 ARG A 106 4.008 10.345 -7.321 1.00 44.10 H new ATOM 0 HH21 ARG A 106 4.781 6.911 -7.606 1.00 31.35 H new ATOM 0 HH22 ARG A 106 4.773 8.479 -8.419 1.00 31.35 H new ATOM 1694 N VAL A 107 -0.163 4.236 -3.427 1.00 61.20 N ATOM 1695 CA VAL A 107 -0.876 3.135 -4.074 1.00 13.43 C ATOM 1696 C VAL A 107 -2.008 3.688 -4.961 1.00 34.42 C ATOM 1697 O VAL A 107 -2.655 4.667 -4.589 1.00 72.23 O ATOM 1698 CB VAL A 107 -1.417 2.143 -3.028 1.00 34.14 C ATOM 1699 CG1 VAL A 107 -2.123 2.882 -1.893 1.00 12.01 C ATOM 1700 CG2 VAL A 107 -2.338 1.089 -3.625 1.00 42.20 C ATOM 0 H VAL A 107 -0.528 5.148 -3.702 1.00 61.20 H new ATOM 0 HA VAL A 107 -0.178 2.590 -4.710 1.00 13.43 H new ATOM 0 HB VAL A 107 -0.550 1.616 -2.630 1.00 34.14 H new ATOM 0 HG11 VAL A 107 -2.497 2.161 -1.166 1.00 12.01 H new ATOM 0 HG12 VAL A 107 -1.420 3.557 -1.405 1.00 12.01 H new ATOM 0 HG13 VAL A 107 -2.957 3.456 -2.296 1.00 12.01 H new ATOM 0 HG21 VAL A 107 -2.685 0.421 -2.837 1.00 42.20 H new ATOM 0 HG22 VAL A 107 -3.194 1.576 -4.091 1.00 42.20 H new ATOM 0 HG23 VAL A 107 -1.795 0.514 -4.375 1.00 42.20 H new ATOM 1710 N GLU A 108 -2.348 3.007 -6.064 1.00 4.15 N ATOM 1711 CA GLU A 108 -3.627 3.191 -6.746 1.00 62.41 C ATOM 1712 C GLU A 108 -4.526 1.981 -6.455 1.00 74.32 C ATOM 1713 O GLU A 108 -4.071 0.830 -6.461 1.00 54.34 O ATOM 1714 CB GLU A 108 -3.470 3.388 -8.263 1.00 72.11 C ATOM 1715 CG GLU A 108 -2.377 4.361 -8.728 1.00 72.33 C ATOM 1716 CD GLU A 108 -2.670 4.852 -10.146 1.00 41.20 C ATOM 1717 OE1 GLU A 108 -2.686 4.002 -11.064 1.00 75.31 O ATOM 1718 OE2 GLU A 108 -2.936 6.056 -10.342 1.00 12.24 O ATOM 0 H GLU A 108 -1.742 2.315 -6.504 1.00 4.15 H new ATOM 0 HA GLU A 108 -4.082 4.104 -6.362 1.00 62.41 H new ATOM 0 HB2 GLU A 108 -3.272 2.415 -8.713 1.00 72.11 H new ATOM 0 HB3 GLU A 108 -4.424 3.734 -8.661 1.00 72.11 H new ATOM 0 HG2 GLU A 108 -2.322 5.210 -8.046 1.00 72.33 H new ATOM 0 HG3 GLU A 108 -1.406 3.867 -8.701 1.00 72.33 H new ATOM 1725 N PHE A 109 -5.812 2.237 -6.216 1.00 54.12 N ATOM 1726 CA PHE A 109 -6.872 1.244 -6.115 1.00 22.22 C ATOM 1727 C PHE A 109 -7.789 1.464 -7.318 1.00 15.03 C ATOM 1728 O PHE A 109 -8.260 2.590 -7.516 1.00 14.31 O ATOM 1729 CB PHE A 109 -7.676 1.456 -4.818 1.00 53.42 C ATOM 1730 CG PHE A 109 -6.942 1.658 -3.505 1.00 51.23 C ATOM 1731 CD1 PHE A 109 -5.839 0.857 -3.176 1.00 52.01 C ATOM 1732 CD2 PHE A 109 -7.401 2.619 -2.581 1.00 15.22 C ATOM 1733 CE1 PHE A 109 -5.215 0.993 -1.927 1.00 33.52 C ATOM 1734 CE2 PHE A 109 -6.756 2.779 -1.342 1.00 3.01 C ATOM 1735 CZ PHE A 109 -5.670 1.955 -1.007 1.00 62.40 C ATOM 0 H PHE A 109 -6.155 3.188 -6.082 1.00 54.12 H new ATOM 0 HA PHE A 109 -6.460 0.235 -6.100 1.00 22.22 H new ATOM 0 HB2 PHE A 109 -8.317 2.324 -4.970 1.00 53.42 H new ATOM 0 HB3 PHE A 109 -8.331 0.594 -4.696 1.00 53.42 H new ATOM 0 HD1 PHE A 109 -5.469 0.133 -3.887 1.00 52.01 H new ATOM 0 HD2 PHE A 109 -8.253 3.236 -2.826 1.00 15.22 H new ATOM 0 HE1 PHE A 109 -4.381 0.356 -1.671 1.00 33.52 H new ATOM 0 HE2 PHE A 109 -7.096 3.535 -0.649 1.00 3.01 H new ATOM 0 HZ PHE A 109 -5.186 2.059 -0.047 1.00 62.40 H new ATOM 1745 N GLU A 110 -8.124 0.436 -8.097 1.00 74.22 N ATOM 1746 CA GLU A 110 -9.040 0.577 -9.233 1.00 31.32 C ATOM 1747 C GLU A 110 -9.898 -0.683 -9.332 1.00 44.30 C ATOM 1748 O GLU A 110 -9.474 -1.738 -8.850 1.00 14.35 O ATOM 1749 CB GLU A 110 -8.262 0.804 -10.544 1.00 24.51 C ATOM 1750 CG GLU A 110 -8.840 1.948 -11.389 1.00 60.50 C ATOM 1751 CD GLU A 110 -8.814 1.711 -12.898 1.00 3.03 C ATOM 1752 OE1 GLU A 110 -7.821 1.143 -13.418 1.00 11.43 O ATOM 1753 OE2 GLU A 110 -9.761 2.149 -13.597 1.00 43.20 O ATOM 0 H GLU A 110 -7.772 -0.512 -7.962 1.00 74.22 H new ATOM 0 HA GLU A 110 -9.678 1.446 -9.075 1.00 31.32 H new ATOM 0 HB2 GLU A 110 -7.220 1.022 -10.310 1.00 24.51 H new ATOM 0 HB3 GLU A 110 -8.271 -0.115 -11.130 1.00 24.51 H new ATOM 0 HG2 GLU A 110 -9.871 2.122 -11.081 1.00 60.50 H new ATOM 0 HG3 GLU A 110 -8.283 2.859 -11.170 1.00 60.50 H new ATOM 1760 N LEU A 111 -11.083 -0.580 -9.945 1.00 24.35 N ATOM 1761 CA LEU A 111 -11.994 -1.714 -10.086 1.00 31.55 C ATOM 1762 C LEU A 111 -11.704 -2.454 -11.391 1.00 21.21 C ATOM 1763 O LEU A 111 -11.206 -1.891 -12.366 1.00 71.40 O ATOM 1764 CB LEU A 111 -13.473 -1.271 -10.016 1.00 74.23 C ATOM 1765 CG LEU A 111 -14.490 -2.128 -9.201 1.00 4.04 C ATOM 1766 CD1 LEU A 111 -15.746 -2.428 -10.016 1.00 11.14 C ATOM 1767 CD2 LEU A 111 -14.058 -3.471 -8.581 1.00 23.51 C ATOM 0 H LEU A 111 -11.433 0.287 -10.354 1.00 24.35 H new ATOM 0 HA LEU A 111 -11.825 -2.393 -9.250 1.00 31.55 H new ATOM 0 HB2 LEU A 111 -13.493 -0.261 -9.606 1.00 74.23 H new ATOM 0 HB3 LEU A 111 -13.844 -1.207 -11.039 1.00 74.23 H new ATOM 0 HG LEU A 111 -14.632 -1.457 -8.354 1.00 4.04 H new ATOM 0 HD11 LEU A 111 -16.433 -3.027 -9.418 1.00 11.14 H new ATOM 0 HD12 LEU A 111 -16.230 -1.492 -10.297 1.00 11.14 H new ATOM 0 HD13 LEU A 111 -15.473 -2.979 -10.916 1.00 11.14 H new ATOM 0 HD21 LEU A 111 -14.902 -3.917 -8.055 1.00 23.51 H new ATOM 0 HD22 LEU A 111 -13.725 -4.145 -9.370 1.00 23.51 H new ATOM 0 HD23 LEU A 111 -13.241 -3.302 -7.879 1.00 23.51 H new ATOM 1779 N GLN A 112 -11.993 -3.749 -11.372 1.00 42.41 N ATOM 1780 CA GLN A 112 -11.482 -4.719 -12.331 1.00 13.42 C ATOM 1781 C GLN A 112 -12.378 -4.877 -13.523 1.00 35.11 C ATOM 1782 O GLN A 112 -11.929 -4.970 -14.672 1.00 55.10 O ATOM 1783 CB GLN A 112 -11.386 -6.059 -11.598 1.00 52.21 C ATOM 1784 CG GLN A 112 -10.010 -6.059 -10.882 1.00 12.41 C ATOM 1785 CD GLN A 112 -9.771 -4.869 -9.978 1.00 40.10 C ATOM 1786 OE1 GLN A 112 -10.521 -4.634 -9.041 1.00 73.32 O ATOM 1787 NE2 GLN A 112 -8.727 -4.117 -10.231 1.00 24.14 N ATOM 0 H GLN A 112 -12.606 -4.164 -10.670 1.00 42.41 H new ATOM 0 HA GLN A 112 -10.517 -4.376 -12.704 1.00 13.42 H new ATOM 0 HB2 GLN A 112 -12.199 -6.170 -10.880 1.00 52.21 H new ATOM 0 HB3 GLN A 112 -11.462 -6.892 -12.297 1.00 52.21 H new ATOM 0 HG2 GLN A 112 -9.922 -6.971 -10.291 1.00 12.41 H new ATOM 0 HG3 GLN A 112 -9.223 -6.090 -11.635 1.00 12.41 H new ATOM 0 HE21 GLN A 112 -8.119 -4.337 -11.020 1.00 24.14 H new ATOM 0 HE22 GLN A 112 -8.523 -3.312 -9.639 1.00 24.14 H new ATOM 1796 N ALA A 113 -13.646 -5.068 -13.204 1.00 22.25 N ATOM 1797 CA ALA A 113 -14.588 -5.576 -14.148 1.00 24.34 C ATOM 1798 C ALA A 113 -15.927 -4.969 -13.867 1.00 62.33 C ATOM 1799 O ALA A 113 -16.418 -4.084 -14.570 1.00 32.44 O ATOM 1800 CB ALA A 113 -14.504 -7.109 -14.171 1.00 4.31 C ATOM 0 H ALA A 113 -14.037 -4.872 -12.283 1.00 22.25 H new ATOM 0 HA ALA A 113 -14.367 -5.284 -15.175 1.00 24.34 H new ATOM 0 HB1 ALA A 113 -15.222 -7.502 -14.891 1.00 4.31 H new ATOM 0 HB2 ALA A 113 -13.498 -7.414 -14.459 1.00 4.31 H new ATOM 0 HB3 ALA A 113 -14.733 -7.501 -13.180 1.00 4.31 H new ATOM 1806 N ASP A 114 -16.460 -5.442 -12.768 1.00 3.24 N ATOM 1807 CA ASP A 114 -17.639 -4.819 -12.166 1.00 40.41 C ATOM 1808 C ASP A 114 -17.796 -5.378 -10.768 1.00 40.11 C ATOM 1809 O ASP A 114 -18.892 -5.516 -10.232 1.00 74.22 O ATOM 1810 CB ASP A 114 -18.917 -4.963 -13.029 1.00 44.20 C ATOM 1811 CG ASP A 114 -19.708 -3.648 -13.043 1.00 2.34 C ATOM 1812 OD1 ASP A 114 -19.797 -2.991 -11.984 1.00 71.30 O ATOM 1813 OD2 ASP A 114 -20.171 -3.225 -14.129 1.00 63.24 O ATOM 0 H ASP A 114 -16.106 -6.255 -12.264 1.00 3.24 H new ATOM 0 HA ASP A 114 -17.490 -3.741 -12.111 1.00 40.41 H new ATOM 0 HB2 ASP A 114 -18.646 -5.242 -14.047 1.00 44.20 H new ATOM 0 HB3 ASP A 114 -19.541 -5.765 -12.634 1.00 44.20 H new ATOM 1818 N GLY A 115 -16.667 -5.800 -10.206 1.00 42.44 N ATOM 1819 CA GLY A 115 -16.715 -6.882 -9.254 1.00 24.35 C ATOM 1820 C GLY A 115 -15.935 -6.630 -7.991 1.00 35.23 C ATOM 1821 O GLY A 115 -16.353 -5.843 -7.144 1.00 13.43 O ATOM 0 H GLY A 115 -15.740 -5.418 -10.391 1.00 42.44 H new ATOM 0 HA2 GLY A 115 -17.755 -7.075 -8.992 1.00 24.35 H new ATOM 0 HA3 GLY A 115 -16.333 -7.786 -9.729 1.00 24.35 H new ATOM 1825 N LYS A 116 -14.862 -7.394 -7.831 1.00 4.22 N ATOM 1826 CA LYS A 116 -14.054 -7.406 -6.618 1.00 22.35 C ATOM 1827 C LYS A 116 -12.832 -6.552 -6.888 1.00 0.32 C ATOM 1828 O LYS A 116 -12.315 -6.593 -8.003 1.00 72.43 O ATOM 1829 CB LYS A 116 -13.643 -8.846 -6.263 1.00 31.15 C ATOM 1830 CG LYS A 116 -14.748 -9.600 -5.513 1.00 73.23 C ATOM 1831 CD LYS A 116 -15.858 -10.182 -6.405 1.00 1.33 C ATOM 1832 CE LYS A 116 -16.882 -10.981 -5.584 1.00 55.33 C ATOM 1833 NZ LYS A 116 -17.591 -10.154 -4.586 1.00 60.12 N ATOM 0 H LYS A 116 -14.523 -8.032 -8.551 1.00 4.22 H new ATOM 0 HA LYS A 116 -14.617 -7.011 -5.772 1.00 22.35 H new ATOM 0 HB2 LYS A 116 -13.394 -9.386 -7.177 1.00 31.15 H new ATOM 0 HB3 LYS A 116 -12.742 -8.823 -5.650 1.00 31.15 H new ATOM 0 HG2 LYS A 116 -14.293 -10.413 -4.948 1.00 73.23 H new ATOM 0 HG3 LYS A 116 -15.202 -8.923 -4.789 1.00 73.23 H new ATOM 0 HD2 LYS A 116 -16.364 -9.373 -6.931 1.00 1.33 H new ATOM 0 HD3 LYS A 116 -15.415 -10.828 -7.163 1.00 1.33 H new ATOM 0 HE2 LYS A 116 -17.610 -11.430 -6.259 1.00 55.33 H new ATOM 0 HE3 LYS A 116 -16.373 -11.799 -5.075 1.00 55.33 H new ATOM 0 HZ1 LYS A 116 -18.349 -10.714 -4.146 1.00 60.12 H new ATOM 0 HZ2 LYS A 116 -16.921 -9.842 -3.854 1.00 60.12 H new ATOM 0 HZ3 LYS A 116 -18.003 -9.322 -5.054 1.00 60.12 H new ATOM 1847 N TRP A 117 -12.382 -5.827 -5.873 1.00 60.23 N ATOM 1848 CA TRP A 117 -11.283 -4.885 -5.949 1.00 13.01 C ATOM 1849 C TRP A 117 -9.941 -5.611 -5.890 1.00 33.52 C ATOM 1850 O TRP A 117 -9.807 -6.619 -5.177 1.00 44.22 O ATOM 1851 CB TRP A 117 -11.445 -3.876 -4.816 1.00 2.24 C ATOM 1852 CG TRP A 117 -12.694 -3.059 -4.927 1.00 15.32 C ATOM 1853 CD1 TRP A 117 -13.877 -3.335 -4.338 1.00 15.34 C ATOM 1854 CD2 TRP A 117 -12.921 -1.854 -5.718 1.00 14.24 C ATOM 1855 NE1 TRP A 117 -14.803 -2.386 -4.713 1.00 53.01 N ATOM 1856 CE2 TRP A 117 -14.242 -1.390 -5.468 1.00 23.33 C ATOM 1857 CE3 TRP A 117 -12.145 -1.095 -6.613 1.00 44.41 C ATOM 1858 CZ2 TRP A 117 -14.736 -0.187 -5.984 1.00 0.44 C ATOM 1859 CZ3 TRP A 117 -12.631 0.116 -7.136 1.00 31.55 C ATOM 1860 CH2 TRP A 117 -13.909 0.589 -6.806 1.00 71.34 C ATOM 0 H TRP A 117 -12.791 -5.884 -4.940 1.00 60.23 H new ATOM 0 HA TRP A 117 -11.300 -4.355 -6.901 1.00 13.01 H new ATOM 0 HB2 TRP A 117 -11.449 -4.406 -3.864 1.00 2.24 H new ATOM 0 HB3 TRP A 117 -10.583 -3.210 -4.806 1.00 2.24 H new ATOM 0 HD1 TRP A 117 -14.067 -4.168 -3.677 1.00 15.34 H new ATOM 0 HE1 TRP A 117 -15.790 -2.421 -4.458 1.00 53.01 H new ATOM 0 HE3 TRP A 117 -11.165 -1.446 -6.901 1.00 44.41 H new ATOM 0 HZ2 TRP A 117 -15.739 0.138 -5.752 1.00 0.44 H new ATOM 0 HZ3 TRP A 117 -12.009 0.693 -7.804 1.00 31.55 H new ATOM 0 HH2 TRP A 117 -14.252 1.542 -7.182 1.00 71.34 H new ATOM 1871 N TYR A 118 -8.958 -5.097 -6.632 1.00 24.31 N ATOM 1872 CA TYR A 118 -7.611 -5.626 -6.740 1.00 71.33 C ATOM 1873 C TYR A 118 -6.665 -4.431 -6.835 1.00 43.44 C ATOM 1874 O TYR A 118 -6.605 -3.781 -7.876 1.00 34.35 O ATOM 1875 CB TYR A 118 -7.457 -6.559 -7.957 1.00 3.03 C ATOM 1876 CG TYR A 118 -8.022 -7.951 -7.800 1.00 53.12 C ATOM 1877 CD1 TYR A 118 -9.410 -8.145 -7.847 1.00 23.44 C ATOM 1878 CD2 TYR A 118 -7.170 -9.062 -7.691 1.00 20.51 C ATOM 1879 CE1 TYR A 118 -9.954 -9.424 -7.662 1.00 71.41 C ATOM 1880 CE2 TYR A 118 -7.702 -10.352 -7.532 1.00 51.23 C ATOM 1881 CZ TYR A 118 -9.104 -10.531 -7.464 1.00 71.12 C ATOM 1882 OH TYR A 118 -9.642 -11.753 -7.208 1.00 43.02 O ATOM 0 H TYR A 118 -9.094 -4.260 -7.199 1.00 24.31 H new ATOM 0 HA TYR A 118 -7.376 -6.235 -5.867 1.00 71.33 H new ATOM 0 HB2 TYR A 118 -7.938 -6.088 -8.814 1.00 3.03 H new ATOM 0 HB3 TYR A 118 -6.396 -6.643 -8.193 1.00 3.03 H new ATOM 0 HD1 TYR A 118 -10.064 -7.304 -8.027 1.00 23.44 H new ATOM 0 HD2 TYR A 118 -6.100 -8.924 -7.730 1.00 20.51 H new ATOM 0 HE1 TYR A 118 -11.025 -9.561 -7.671 1.00 71.41 H new ATOM 0 HE2 TYR A 118 -7.043 -11.205 -7.462 1.00 51.23 H new ATOM 0 HH TYR A 118 -8.923 -12.410 -7.097 1.00 43.02 H new ATOM 1892 N VAL A 119 -5.928 -4.153 -5.758 1.00 24.52 N ATOM 1893 CA VAL A 119 -4.935 -3.078 -5.696 1.00 22.41 C ATOM 1894 C VAL A 119 -3.896 -3.263 -6.806 1.00 52.04 C ATOM 1895 O VAL A 119 -3.445 -4.387 -7.016 1.00 20.31 O ATOM 1896 CB VAL A 119 -4.280 -3.086 -4.300 1.00 1.32 C ATOM 1897 CG1 VAL A 119 -3.112 -2.110 -4.193 1.00 64.43 C ATOM 1898 CG2 VAL A 119 -5.312 -2.758 -3.217 1.00 74.41 C ATOM 0 H VAL A 119 -6.006 -4.679 -4.887 1.00 24.52 H new ATOM 0 HA VAL A 119 -5.413 -2.111 -5.851 1.00 22.41 H new ATOM 0 HB VAL A 119 -3.890 -4.093 -4.150 1.00 1.32 H new ATOM 0 HG11 VAL A 119 -2.689 -2.157 -3.190 1.00 64.43 H new ATOM 0 HG12 VAL A 119 -2.347 -2.377 -4.922 1.00 64.43 H new ATOM 0 HG13 VAL A 119 -3.464 -1.098 -4.391 1.00 64.43 H new ATOM 0 HG21 VAL A 119 -4.830 -2.769 -2.240 1.00 74.41 H new ATOM 0 HG22 VAL A 119 -5.733 -1.770 -3.403 1.00 74.41 H new ATOM 0 HG23 VAL A 119 -6.109 -3.502 -3.237 1.00 74.41 H new ATOM 1908 N VAL A 120 -3.483 -2.185 -7.475 1.00 61.12 N ATOM 1909 CA VAL A 120 -2.597 -2.225 -8.643 1.00 1.13 C ATOM 1910 C VAL A 120 -1.257 -1.534 -8.378 1.00 34.51 C ATOM 1911 O VAL A 120 -0.446 -1.432 -9.300 1.00 72.20 O ATOM 1912 CB VAL A 120 -3.312 -1.618 -9.869 1.00 40.33 C ATOM 1913 CG1 VAL A 120 -4.456 -2.501 -10.380 1.00 55.20 C ATOM 1914 CG2 VAL A 120 -3.834 -0.215 -9.548 1.00 54.22 C ATOM 0 H VAL A 120 -3.760 -1.238 -7.215 1.00 61.12 H new ATOM 0 HA VAL A 120 -2.367 -3.270 -8.853 1.00 1.13 H new ATOM 0 HB VAL A 120 -2.571 -1.555 -10.666 1.00 40.33 H new ATOM 0 HG11 VAL A 120 -4.924 -2.027 -11.243 1.00 55.20 H new ATOM 0 HG12 VAL A 120 -4.062 -3.475 -10.671 1.00 55.20 H new ATOM 0 HG13 VAL A 120 -5.197 -2.630 -9.591 1.00 55.20 H new ATOM 0 HG21 VAL A 120 -4.335 0.196 -10.424 1.00 54.22 H new ATOM 0 HG22 VAL A 120 -4.540 -0.270 -8.719 1.00 54.22 H new ATOM 0 HG23 VAL A 120 -2.999 0.429 -9.271 1.00 54.22 H new ATOM 1924 N ASP A 121 -0.988 -1.085 -7.145 1.00 3.24 N ATOM 1925 CA ASP A 121 0.307 -0.492 -6.837 1.00 51.11 C ATOM 1926 C ASP A 121 0.777 -0.735 -5.408 1.00 21.31 C ATOM 1927 O ASP A 121 -0.022 -1.108 -4.548 1.00 1.44 O ATOM 1928 CB ASP A 121 0.326 1.006 -7.187 1.00 52.02 C ATOM 1929 CG ASP A 121 1.727 1.427 -7.643 1.00 22.52 C ATOM 1930 OD1 ASP A 121 2.537 0.544 -8.002 1.00 71.13 O ATOM 1931 OD2 ASP A 121 2.014 2.647 -7.633 1.00 31.43 O ATOM 0 H ASP A 121 -1.640 -1.122 -6.362 1.00 3.24 H new ATOM 0 HA ASP A 121 1.028 -1.009 -7.470 1.00 51.11 H new ATOM 0 HB2 ASP A 121 -0.398 1.211 -7.976 1.00 52.02 H new ATOM 0 HB3 ASP A 121 0.027 1.593 -6.319 1.00 52.02 H new ATOM 1936 N CYS A 122 2.073 -0.554 -5.142 1.00 62.50 N ATOM 1937 CA CYS A 122 2.656 -0.546 -3.799 1.00 33.12 C ATOM 1938 C CYS A 122 3.922 0.313 -3.820 1.00 55.13 C ATOM 1939 O CYS A 122 4.899 -0.089 -4.453 1.00 31.14 O ATOM 1940 CB CYS A 122 2.978 -1.995 -3.385 1.00 63.22 C ATOM 1941 SG CYS A 122 3.744 -2.118 -1.748 1.00 33.25 S ATOM 0 H CYS A 122 2.765 -0.405 -5.876 1.00 62.50 H new ATOM 0 HA CYS A 122 1.958 -0.126 -3.075 1.00 33.12 H new ATOM 0 HB2 CYS A 122 2.059 -2.581 -3.394 1.00 63.22 H new ATOM 0 HB3 CYS A 122 3.645 -2.437 -4.125 1.00 63.22 H new ATOM 0 HG CYS A 122 4.758 -2.929 -1.803 1.00 33.25 H new ATOM 1947 N TYR A 123 3.914 1.469 -3.150 1.00 73.01 N ATOM 1948 CA TYR A 123 5.118 2.213 -2.786 1.00 33.42 C ATOM 1949 C TYR A 123 5.196 2.213 -1.268 1.00 75.01 C ATOM 1950 O TYR A 123 4.161 2.284 -0.601 1.00 64.23 O ATOM 1951 CB TYR A 123 5.044 3.660 -3.267 1.00 60.34 C ATOM 1952 CG TYR A 123 6.305 4.489 -3.105 1.00 24.14 C ATOM 1953 CD1 TYR A 123 6.603 5.145 -1.888 1.00 55.44 C ATOM 1954 CD2 TYR A 123 7.150 4.668 -4.216 1.00 2.35 C ATOM 1955 CE1 TYR A 123 7.730 5.979 -1.798 1.00 15.14 C ATOM 1956 CE2 TYR A 123 8.266 5.516 -4.135 1.00 71.02 C ATOM 1957 CZ TYR A 123 8.552 6.185 -2.927 1.00 33.01 C ATOM 1958 OH TYR A 123 9.596 7.050 -2.855 1.00 51.42 O ATOM 0 H TYR A 123 3.053 1.920 -2.841 1.00 73.01 H new ATOM 0 HA TYR A 123 5.989 1.748 -3.247 1.00 33.42 H new ATOM 0 HB2 TYR A 123 4.771 3.656 -4.322 1.00 60.34 H new ATOM 0 HB3 TYR A 123 4.236 4.158 -2.730 1.00 60.34 H new ATOM 0 HD1 TYR A 123 5.965 5.005 -1.028 1.00 55.44 H new ATOM 0 HD2 TYR A 123 6.938 4.149 -5.139 1.00 2.35 H new ATOM 0 HE1 TYR A 123 7.968 6.464 -0.863 1.00 15.14 H new ATOM 0 HE2 TYR A 123 8.904 5.656 -4.995 1.00 71.02 H new ATOM 0 HH TYR A 123 10.060 7.075 -3.718 1.00 51.42 H new ATOM 1968 N THR A 124 6.408 2.172 -0.741 1.00 3.44 N ATOM 1969 CA THR A 124 6.718 2.141 0.673 1.00 53.12 C ATOM 1970 C THR A 124 8.191 2.519 0.852 1.00 15.44 C ATOM 1971 O THR A 124 9.011 2.276 -0.048 1.00 23.04 O ATOM 1972 CB THR A 124 6.384 0.732 1.216 1.00 0.14 C ATOM 1973 OG1 THR A 124 7.023 0.519 2.447 1.00 1.41 O ATOM 1974 CG2 THR A 124 6.800 -0.439 0.310 1.00 60.34 C ATOM 0 H THR A 124 7.246 2.159 -1.323 1.00 3.44 H new ATOM 0 HA THR A 124 6.125 2.858 1.240 1.00 53.12 H new ATOM 0 HB THR A 124 5.296 0.734 1.289 1.00 0.14 H new ATOM 0 HG1 THR A 124 6.371 0.191 3.101 1.00 1.41 H new ATOM 0 HG21 THR A 124 6.521 -1.381 0.782 1.00 60.34 H new ATOM 0 HG22 THR A 124 6.295 -0.352 -0.652 1.00 60.34 H new ATOM 0 HG23 THR A 124 7.879 -0.415 0.157 1.00 60.34 H new ATOM 1982 N GLY A 125 8.529 3.032 2.038 1.00 31.24 N ATOM 1983 CA GLY A 125 9.892 3.263 2.494 1.00 11.35 C ATOM 1984 C GLY A 125 10.690 1.977 2.753 1.00 14.44 C ATOM 1985 O GLY A 125 11.885 2.046 3.047 1.00 42.12 O ATOM 0 H GLY A 125 7.831 3.306 2.729 1.00 31.24 H new ATOM 0 HA2 GLY A 125 10.417 3.860 1.749 1.00 11.35 H new ATOM 0 HA3 GLY A 125 9.863 3.851 3.411 1.00 11.35 H new ATOM 1989 N TRP A 126 10.073 0.797 2.614 1.00 41.12 N ATOM 1990 CA TRP A 126 10.808 -0.455 2.491 1.00 61.24 C ATOM 1991 C TRP A 126 11.587 -0.495 1.173 1.00 0.51 C ATOM 1992 O TRP A 126 12.748 -0.893 1.146 1.00 53.44 O ATOM 1993 CB TRP A 126 9.845 -1.647 2.536 1.00 60.03 C ATOM 1994 CG TRP A 126 9.272 -1.923 3.888 1.00 52.14 C ATOM 1995 CD1 TRP A 126 7.975 -1.837 4.259 1.00 0.35 C ATOM 1996 CD2 TRP A 126 10.012 -2.214 5.100 1.00 11.31 C ATOM 1997 NE1 TRP A 126 7.868 -2.010 5.625 1.00 23.15 N ATOM 1998 CE2 TRP A 126 9.111 -2.176 6.201 1.00 44.12 C ATOM 1999 CE3 TRP A 126 11.377 -2.413 5.374 1.00 1.54 C ATOM 2000 CZ2 TRP A 126 9.566 -2.258 7.521 1.00 52.13 C ATOM 2001 CZ3 TRP A 126 11.835 -2.528 6.693 1.00 23.15 C ATOM 2002 CH2 TRP A 126 10.932 -2.450 7.769 1.00 52.13 C ATOM 0 H TRP A 126 9.059 0.690 2.584 1.00 41.12 H new ATOM 0 HA TRP A 126 11.506 -0.517 3.326 1.00 61.24 H new ATOM 0 HB2 TRP A 126 9.028 -1.466 1.838 1.00 60.03 H new ATOM 0 HB3 TRP A 126 10.370 -2.537 2.188 1.00 60.03 H new ATOM 0 HD1 TRP A 126 7.147 -1.660 3.588 1.00 0.35 H new ATOM 0 HE1 TRP A 126 6.987 -2.014 6.140 1.00 23.15 H new ATOM 0 HE3 TRP A 126 12.081 -2.478 4.557 1.00 1.54 H new ATOM 0 HZ2 TRP A 126 8.870 -2.174 8.343 1.00 52.13 H new ATOM 0 HZ3 TRP A 126 12.887 -2.677 6.885 1.00 23.15 H new ATOM 0 HH2 TRP A 126 11.291 -2.538 8.784 1.00 52.13 H new ATOM 2013 N TYR A 127 10.935 -0.159 0.055 1.00 11.13 N ATOM 2014 CA TYR A 127 11.415 -0.482 -1.287 1.00 32.34 C ATOM 2015 C TYR A 127 11.358 0.773 -2.176 1.00 23.33 C ATOM 2016 O TYR A 127 10.884 0.703 -3.311 1.00 15.53 O ATOM 2017 CB TYR A 127 10.620 -1.670 -1.885 1.00 62.24 C ATOM 2018 CG TYR A 127 10.610 -2.981 -1.102 1.00 24.21 C ATOM 2019 CD1 TYR A 127 11.698 -3.884 -1.149 1.00 31.34 C ATOM 2020 CD2 TYR A 127 9.478 -3.308 -0.333 1.00 73.10 C ATOM 2021 CE1 TYR A 127 11.687 -5.051 -0.353 1.00 24.34 C ATOM 2022 CE2 TYR A 127 9.473 -4.451 0.483 1.00 71.22 C ATOM 2023 CZ TYR A 127 10.602 -5.295 0.510 1.00 73.43 C ATOM 2024 OH TYR A 127 10.638 -6.382 1.321 1.00 24.24 O ATOM 0 H TYR A 127 10.051 0.350 0.059 1.00 11.13 H new ATOM 0 HA TYR A 127 12.456 -0.802 -1.233 1.00 32.34 H new ATOM 0 HB2 TYR A 127 9.586 -1.350 -2.017 1.00 62.24 H new ATOM 0 HB3 TYR A 127 11.019 -1.875 -2.878 1.00 62.24 H new ATOM 0 HD1 TYR A 127 12.539 -3.681 -1.795 1.00 31.34 H new ATOM 0 HD2 TYR A 127 8.605 -2.674 -0.371 1.00 73.10 H new ATOM 0 HE1 TYR A 127 12.507 -5.752 -0.406 1.00 24.34 H new ATOM 0 HE2 TYR A 127 8.608 -4.682 1.087 1.00 71.22 H new ATOM 0 HH TYR A 127 11.112 -6.157 2.149 1.00 24.24 H new ATOM 2034 N GLY A 128 11.748 1.946 -1.672 1.00 43.51 N ATOM 2035 CA GLY A 128 11.643 3.229 -2.367 1.00 23.22 C ATOM 2036 C GLY A 128 12.943 4.014 -2.267 1.00 23.13 C ATOM 2037 O GLY A 128 13.029 4.973 -1.505 1.00 11.54 O ATOM 0 H GLY A 128 12.157 2.031 -0.742 1.00 43.51 H new ATOM 0 HA2 GLY A 128 11.397 3.059 -3.415 1.00 23.22 H new ATOM 0 HA3 GLY A 128 10.828 3.813 -1.939 1.00 23.22 H new ATOM 2041 N TYR A 129 13.932 3.594 -3.055 1.00 35.01 N ATOM 2042 CA TYR A 129 15.287 4.126 -3.166 1.00 11.44 C ATOM 2043 C TYR A 129 15.960 4.262 -1.798 1.00 71.44 C ATOM 2044 O TYR A 129 16.099 5.370 -1.282 1.00 63.23 O ATOM 2045 CB TYR A 129 15.292 5.458 -3.934 1.00 21.25 C ATOM 2046 CG TYR A 129 15.246 5.371 -5.443 1.00 3.51 C ATOM 2047 CD1 TYR A 129 14.190 4.706 -6.087 1.00 72.43 C ATOM 2048 CD2 TYR A 129 16.238 6.020 -6.205 1.00 74.10 C ATOM 2049 CE1 TYR A 129 14.108 4.697 -7.486 1.00 51.31 C ATOM 2050 CE2 TYR A 129 16.182 5.990 -7.607 1.00 20.41 C ATOM 2051 CZ TYR A 129 15.108 5.337 -8.246 1.00 40.40 C ATOM 2052 OH TYR A 129 15.019 5.352 -9.597 1.00 34.22 O ATOM 0 H TYR A 129 13.792 2.805 -3.686 1.00 35.01 H new ATOM 0 HA TYR A 129 15.876 3.409 -3.737 1.00 11.44 H new ATOM 0 HB2 TYR A 129 14.437 6.046 -3.601 1.00 21.25 H new ATOM 0 HB3 TYR A 129 16.188 6.010 -3.652 1.00 21.25 H new ATOM 0 HD1 TYR A 129 13.437 4.199 -5.501 1.00 72.43 H new ATOM 0 HD2 TYR A 129 17.043 6.542 -5.709 1.00 74.10 H new ATOM 0 HE1 TYR A 129 13.284 4.203 -7.979 1.00 51.31 H new ATOM 0 HE2 TYR A 129 16.956 6.464 -8.192 1.00 20.41 H new ATOM 0 HH TYR A 129 15.140 6.268 -9.923 1.00 34.22 H new ATOM 2062 N ASP A 130 16.452 3.156 -1.234 1.00 40.52 N ATOM 2063 CA ASP A 130 17.287 3.217 -0.043 1.00 42.23 C ATOM 2064 C ASP A 130 18.311 2.106 -0.136 1.00 4.55 C ATOM 2065 O ASP A 130 19.495 2.384 -0.355 1.00 54.10 O ATOM 2066 CB ASP A 130 16.429 3.136 1.220 1.00 15.23 C ATOM 2067 CG ASP A 130 17.206 3.277 2.529 1.00 14.41 C ATOM 2068 OD1 ASP A 130 18.460 3.236 2.525 1.00 40.10 O ATOM 2069 OD2 ASP A 130 16.517 3.408 3.566 1.00 41.31 O ATOM 0 H ASP A 130 16.285 2.213 -1.585 1.00 40.52 H new ATOM 0 HA ASP A 130 17.814 4.169 0.018 1.00 42.23 H new ATOM 0 HB2 ASP A 130 15.670 3.917 1.178 1.00 15.23 H new ATOM 0 HB3 ASP A 130 15.904 2.181 1.226 1.00 15.23 H new ATOM 2074 N LEU A 131 17.873 0.849 -0.069 1.00 2.15 N ATOM 2075 CA LEU A 131 18.808 -0.248 0.097 1.00 14.41 C ATOM 2076 C LEU A 131 19.276 -0.734 -1.273 1.00 41.53 C ATOM 2077 O LEU A 131 18.464 -0.807 -2.201 1.00 51.10 O ATOM 2078 CB LEU A 131 18.142 -1.403 0.866 1.00 73.14 C ATOM 2079 CG LEU A 131 18.089 -1.289 2.406 1.00 41.50 C ATOM 2080 CD1 LEU A 131 19.360 -0.696 3.021 1.00 12.14 C ATOM 2081 CD2 LEU A 131 16.874 -0.494 2.889 1.00 11.52 C ATOM 0 H LEU A 131 16.892 0.574 -0.127 1.00 2.15 H new ATOM 0 HA LEU A 131 19.668 0.101 0.668 1.00 14.41 H new ATOM 0 HB2 LEU A 131 17.121 -1.508 0.500 1.00 73.14 H new ATOM 0 HB3 LEU A 131 18.667 -2.324 0.613 1.00 73.14 H new ATOM 0 HG LEU A 131 18.002 -2.319 2.752 1.00 41.50 H new ATOM 0 HD11 LEU A 131 19.251 -0.646 4.104 1.00 12.14 H new ATOM 0 HD12 LEU A 131 20.213 -1.326 2.771 1.00 12.14 H new ATOM 0 HD13 LEU A 131 19.521 0.307 2.626 1.00 12.14 H new ATOM 0 HD21 LEU A 131 16.882 -0.442 3.978 1.00 11.52 H new ATOM 0 HD22 LEU A 131 16.912 0.515 2.478 1.00 11.52 H new ATOM 0 HD23 LEU A 131 15.961 -0.987 2.556 1.00 11.52 H new ATOM 2093 N PRO A 132 20.549 -1.143 -1.410 1.00 33.21 N ATOM 2094 CA PRO A 132 21.053 -1.719 -2.643 1.00 42.44 C ATOM 2095 C PRO A 132 20.603 -3.174 -2.810 1.00 11.22 C ATOM 2096 O PRO A 132 20.084 -3.816 -1.892 1.00 1.42 O ATOM 2097 CB PRO A 132 22.580 -1.609 -2.541 1.00 53.43 C ATOM 2098 CG PRO A 132 22.828 -1.717 -1.040 1.00 3.14 C ATOM 2099 CD PRO A 132 21.636 -0.960 -0.458 1.00 11.41 C ATOM 0 HA PRO A 132 20.669 -1.197 -3.519 1.00 42.44 H new ATOM 0 HB2 PRO A 132 23.080 -2.405 -3.092 1.00 53.43 H new ATOM 0 HB3 PRO A 132 22.945 -0.664 -2.944 1.00 53.43 H new ATOM 0 HG2 PRO A 132 22.854 -2.754 -0.706 1.00 3.14 H new ATOM 0 HG3 PRO A 132 23.777 -1.265 -0.751 1.00 3.14 H new ATOM 0 HD2 PRO A 132 21.366 -1.350 0.524 1.00 11.41 H new ATOM 0 HD3 PRO A 132 21.869 0.097 -0.328 1.00 11.41 H new ATOM 2107 N ILE A 133 20.909 -3.726 -3.982 1.00 23.41 N ATOM 2108 CA ILE A 133 20.650 -5.100 -4.409 1.00 55.30 C ATOM 2109 C ILE A 133 21.157 -6.168 -3.426 1.00 15.34 C ATOM 2110 O ILE A 133 20.619 -7.283 -3.402 1.00 75.34 O ATOM 2111 CB ILE A 133 21.229 -5.241 -5.832 1.00 13.34 C ATOM 2112 CG1 ILE A 133 20.628 -6.437 -6.582 1.00 73.10 C ATOM 2113 CG2 ILE A 133 22.759 -5.282 -5.838 1.00 51.10 C ATOM 2114 CD1 ILE A 133 20.713 -6.234 -8.097 1.00 62.00 C ATOM 0 H ILE A 133 21.378 -3.187 -4.710 1.00 23.41 H new ATOM 0 HA ILE A 133 19.576 -5.287 -4.420 1.00 55.30 H new ATOM 0 HB ILE A 133 20.936 -4.341 -6.373 1.00 13.34 H new ATOM 0 HG12 ILE A 133 21.157 -7.348 -6.303 1.00 73.10 H new ATOM 0 HG13 ILE A 133 19.587 -6.570 -6.287 1.00 73.10 H new ATOM 0 HG21 ILE A 133 23.116 -5.382 -6.863 1.00 51.10 H new ATOM 0 HG22 ILE A 133 23.149 -4.361 -5.406 1.00 51.10 H new ATOM 0 HG23 ILE A 133 23.102 -6.133 -5.249 1.00 51.10 H new ATOM 0 HD11 ILE A 133 20.280 -7.096 -8.604 1.00 62.00 H new ATOM 0 HD12 ILE A 133 20.163 -5.335 -8.375 1.00 62.00 H new ATOM 0 HD13 ILE A 133 21.757 -6.126 -8.392 1.00 62.00 H new ATOM 2126 N GLY A 134 22.146 -5.812 -2.601 1.00 35.21 N ATOM 2127 CA GLY A 134 22.752 -6.659 -1.588 1.00 75.40 C ATOM 2128 C GLY A 134 21.938 -6.654 -0.297 1.00 44.54 C ATOM 2129 O GLY A 134 21.544 -7.726 0.161 1.00 44.43 O ATOM 0 H GLY A 134 22.560 -4.880 -2.628 1.00 35.21 H new ATOM 0 HA2 GLY A 134 22.833 -7.679 -1.965 1.00 75.40 H new ATOM 0 HA3 GLY A 134 23.765 -6.314 -1.382 1.00 75.40 H new ATOM 2133 N GLU A 135 21.647 -5.476 0.272 1.00 34.32 N ATOM 2134 CA GLU A 135 20.858 -5.368 1.508 1.00 62.12 C ATOM 2135 C GLU A 135 19.403 -5.788 1.302 1.00 73.34 C ATOM 2136 O GLU A 135 18.726 -6.109 2.274 1.00 15.21 O ATOM 2137 CB GLU A 135 20.910 -3.951 2.109 1.00 34.13 C ATOM 2138 CG GLU A 135 21.758 -3.803 3.384 1.00 63.03 C ATOM 2139 CD GLU A 135 21.327 -4.699 4.548 1.00 13.11 C ATOM 2140 OE1 GLU A 135 21.758 -5.879 4.531 1.00 15.41 O ATOM 2141 OE2 GLU A 135 20.605 -4.204 5.452 1.00 43.10 O ATOM 0 H GLU A 135 21.949 -4.578 -0.107 1.00 34.32 H new ATOM 0 HA GLU A 135 21.319 -6.058 2.215 1.00 62.12 H new ATOM 0 HB2 GLU A 135 21.300 -3.269 1.353 1.00 34.13 H new ATOM 0 HB3 GLU A 135 19.892 -3.632 2.332 1.00 34.13 H new ATOM 0 HG2 GLU A 135 22.797 -4.023 3.140 1.00 63.03 H new ATOM 0 HG3 GLU A 135 21.720 -2.764 3.710 1.00 63.03 H new ATOM 2148 N LEU A 136 18.928 -5.850 0.054 1.00 35.33 N ATOM 2149 CA LEU A 136 17.554 -6.192 -0.311 1.00 73.43 C ATOM 2150 C LEU A 136 17.035 -7.411 0.468 1.00 20.14 C ATOM 2151 O LEU A 136 15.909 -7.425 0.956 1.00 40.13 O ATOM 2152 CB LEU A 136 17.514 -6.462 -1.823 1.00 54.14 C ATOM 2153 CG LEU A 136 16.186 -6.129 -2.523 1.00 12.32 C ATOM 2154 CD1 LEU A 136 16.162 -6.862 -3.871 1.00 73.20 C ATOM 2155 CD2 LEU A 136 14.902 -6.491 -1.780 1.00 44.20 C ATOM 0 H LEU A 136 19.514 -5.656 -0.758 1.00 35.33 H new ATOM 0 HA LEU A 136 16.901 -5.358 -0.053 1.00 73.43 H new ATOM 0 HB2 LEU A 136 18.309 -5.886 -2.298 1.00 54.14 H new ATOM 0 HB3 LEU A 136 17.739 -7.515 -1.992 1.00 54.14 H new ATOM 0 HG LEU A 136 16.178 -5.042 -2.597 1.00 12.32 H new ATOM 0 HD11 LEU A 136 15.228 -6.642 -4.388 1.00 73.20 H new ATOM 0 HD12 LEU A 136 17.002 -6.529 -4.481 1.00 73.20 H new ATOM 0 HD13 LEU A 136 16.239 -7.936 -3.702 1.00 73.20 H new ATOM 0 HD21 LEU A 136 14.040 -6.204 -2.382 1.00 44.20 H new ATOM 0 HD22 LEU A 136 14.877 -7.566 -1.600 1.00 44.20 H new ATOM 0 HD23 LEU A 136 14.872 -5.962 -0.827 1.00 44.20 H new ATOM 2167 N LYS A 137 17.865 -8.448 0.630 1.00 53.20 N ATOM 2168 CA LYS A 137 17.603 -9.595 1.507 1.00 60.02 C ATOM 2169 C LYS A 137 17.067 -9.159 2.868 1.00 34.41 C ATOM 2170 O LYS A 137 15.951 -9.535 3.215 1.00 15.55 O ATOM 2171 CB LYS A 137 18.816 -10.512 1.613 1.00 63.03 C ATOM 2172 CG LYS A 137 20.085 -9.771 2.021 1.00 42.34 C ATOM 2173 CD LYS A 137 20.640 -10.148 3.390 1.00 73.14 C ATOM 2174 CE LYS A 137 21.741 -11.207 3.277 1.00 71.12 C ATOM 2175 NZ LYS A 137 22.120 -11.770 4.589 1.00 51.53 N ATOM 0 H LYS A 137 18.759 -8.514 0.143 1.00 53.20 H new ATOM 0 HA LYS A 137 16.812 -10.186 1.045 1.00 60.02 H new ATOM 0 HB2 LYS A 137 18.610 -11.297 2.341 1.00 63.03 H new ATOM 0 HB3 LYS A 137 18.980 -11.002 0.653 1.00 63.03 H new ATOM 0 HG2 LYS A 137 20.853 -9.957 1.271 1.00 42.34 H new ATOM 0 HG3 LYS A 137 19.882 -8.700 2.011 1.00 42.34 H new ATOM 0 HD2 LYS A 137 21.038 -9.259 3.880 1.00 73.14 H new ATOM 0 HD3 LYS A 137 19.834 -10.525 4.019 1.00 73.14 H new ATOM 0 HE2 LYS A 137 21.402 -12.011 2.624 1.00 71.12 H new ATOM 0 HE3 LYS A 137 22.620 -10.765 2.807 1.00 71.12 H new ATOM 0 HZ1 LYS A 137 22.868 -12.481 4.459 1.00 51.53 H new ATOM 0 HZ2 LYS A 137 22.470 -11.009 5.205 1.00 51.53 H new ATOM 0 HZ3 LYS A 137 21.290 -12.217 5.028 1.00 51.53 H new ATOM 2189 N GLN A 138 17.828 -8.365 3.611 1.00 3.34 N ATOM 2190 CA GLN A 138 17.496 -7.860 4.929 1.00 44.13 C ATOM 2191 C GLN A 138 16.169 -7.096 4.866 1.00 35.01 C ATOM 2192 O GLN A 138 15.295 -7.334 5.693 1.00 15.14 O ATOM 2193 CB GLN A 138 18.672 -6.987 5.392 1.00 24.41 C ATOM 2194 CG GLN A 138 18.570 -6.497 6.833 1.00 74.20 C ATOM 2195 CD GLN A 138 18.827 -7.553 7.901 1.00 74.24 C ATOM 2196 OE1 GLN A 138 19.647 -8.462 7.752 1.00 12.45 O ATOM 2197 NE2 GLN A 138 18.137 -7.450 9.022 1.00 3.12 N ATOM 0 H GLN A 138 18.740 -8.042 3.290 1.00 3.34 H new ATOM 0 HA GLN A 138 17.352 -8.662 5.653 1.00 44.13 H new ATOM 0 HB2 GLN A 138 19.595 -7.555 5.280 1.00 24.41 H new ATOM 0 HB3 GLN A 138 18.747 -6.122 4.733 1.00 24.41 H new ATOM 0 HG2 GLN A 138 19.280 -5.682 6.973 1.00 74.20 H new ATOM 0 HG3 GLN A 138 17.574 -6.082 6.988 1.00 74.20 H new ATOM 0 HE21 GLN A 138 17.461 -6.695 9.137 1.00 3.12 H new ATOM 0 HE22 GLN A 138 18.280 -8.125 9.773 1.00 3.12 H new ATOM 2206 N THR A 139 15.960 -6.258 3.849 1.00 20.34 N ATOM 2207 CA THR A 139 14.714 -5.524 3.640 1.00 74.12 C ATOM 2208 C THR A 139 13.500 -6.467 3.527 1.00 13.35 C ATOM 2209 O THR A 139 12.406 -6.141 3.987 1.00 43.31 O ATOM 2210 CB THR A 139 14.862 -4.681 2.361 1.00 64.04 C ATOM 2211 OG1 THR A 139 16.168 -4.146 2.241 1.00 14.34 O ATOM 2212 CG2 THR A 139 13.863 -3.534 2.283 1.00 75.34 C ATOM 0 H THR A 139 16.665 -6.068 3.136 1.00 20.34 H new ATOM 0 HA THR A 139 14.531 -4.883 4.502 1.00 74.12 H new ATOM 0 HB THR A 139 14.661 -5.369 1.540 1.00 64.04 H new ATOM 0 HG1 THR A 139 16.231 -3.617 1.418 1.00 14.34 H new ATOM 0 HG21 THR A 139 14.019 -2.978 1.359 1.00 75.34 H new ATOM 0 HG22 THR A 139 12.849 -3.933 2.300 1.00 75.34 H new ATOM 0 HG23 THR A 139 14.005 -2.869 3.135 1.00 75.34 H new ATOM 2220 N ILE A 140 13.661 -7.649 2.926 1.00 71.13 N ATOM 2221 CA ILE A 140 12.593 -8.641 2.831 1.00 61.04 C ATOM 2222 C ILE A 140 12.481 -9.389 4.165 1.00 64.22 C ATOM 2223 O ILE A 140 11.382 -9.775 4.566 1.00 72.40 O ATOM 2224 CB ILE A 140 12.810 -9.588 1.623 1.00 11.31 C ATOM 2225 CG1 ILE A 140 12.936 -8.853 0.265 1.00 51.50 C ATOM 2226 CG2 ILE A 140 11.596 -10.511 1.484 1.00 32.21 C ATOM 2227 CD1 ILE A 140 13.365 -9.770 -0.895 1.00 75.40 C ATOM 0 H ILE A 140 14.536 -7.943 2.492 1.00 71.13 H new ATOM 0 HA ILE A 140 11.642 -8.141 2.646 1.00 61.04 H new ATOM 0 HB ILE A 140 13.741 -10.116 1.829 1.00 11.31 H new ATOM 0 HG12 ILE A 140 11.978 -8.394 0.019 1.00 51.50 H new ATOM 0 HG13 ILE A 140 13.660 -8.044 0.365 1.00 51.50 H new ATOM 0 HG21 ILE A 140 11.743 -11.180 0.636 1.00 32.21 H new ATOM 0 HG22 ILE A 140 11.480 -11.099 2.394 1.00 32.21 H new ATOM 0 HG23 ILE A 140 10.700 -9.912 1.323 1.00 32.21 H new ATOM 0 HD11 ILE A 140 13.432 -9.187 -1.814 1.00 75.40 H new ATOM 0 HD12 ILE A 140 14.337 -10.209 -0.671 1.00 75.40 H new ATOM 0 HD13 ILE A 140 12.629 -10.564 -1.022 1.00 75.40 H new ATOM 2239 N GLN A 141 13.594 -9.604 4.870 1.00 40.42 N ATOM 2240 CA GLN A 141 13.570 -10.220 6.185 1.00 61.43 C ATOM 2241 C GLN A 141 12.716 -9.436 7.149 1.00 14.55 C ATOM 2242 O GLN A 141 11.852 -10.015 7.798 1.00 24.05 O ATOM 2243 CB GLN A 141 14.967 -10.505 6.729 1.00 71.11 C ATOM 2244 CG GLN A 141 15.662 -11.576 5.885 1.00 23.44 C ATOM 2245 CD GLN A 141 17.023 -11.942 6.438 1.00 0.32 C ATOM 2246 OE1 GLN A 141 18.009 -11.249 6.214 1.00 2.25 O ATOM 2247 NE2 GLN A 141 17.094 -13.050 7.150 1.00 51.54 N ATOM 0 H GLN A 141 14.528 -9.356 4.543 1.00 40.42 H new ATOM 0 HA GLN A 141 13.099 -11.196 6.068 1.00 61.43 H new ATOM 0 HB2 GLN A 141 15.559 -9.590 6.725 1.00 71.11 H new ATOM 0 HB3 GLN A 141 14.900 -10.837 7.765 1.00 71.11 H new ATOM 0 HG2 GLN A 141 15.036 -12.467 5.844 1.00 23.44 H new ATOM 0 HG3 GLN A 141 15.772 -11.216 4.862 1.00 23.44 H new ATOM 0 HE21 GLN A 141 16.254 -13.603 7.317 1.00 51.54 H new ATOM 0 HE22 GLN A 141 17.989 -13.354 7.533 1.00 51.54 H new ATOM 2256 N ASN A 142 12.912 -8.133 7.197 1.00 0.13 N ATOM 2257 CA ASN A 142 12.251 -7.326 8.211 1.00 0.14 C ATOM 2258 C ASN A 142 10.797 -7.037 7.829 1.00 4.15 C ATOM 2259 O ASN A 142 9.942 -6.870 8.691 1.00 20.43 O ATOM 2260 CB ASN A 142 12.995 -6.030 8.477 1.00 14.25 C ATOM 2261 CG ASN A 142 14.514 -6.150 8.586 1.00 43.12 C ATOM 2262 OD1 ASN A 142 15.106 -7.198 8.869 1.00 51.44 O ATOM 2263 ND2 ASN A 142 15.164 -5.050 8.272 1.00 22.43 N ATOM 0 H ASN A 142 13.514 -7.614 6.557 1.00 0.13 H new ATOM 0 HA ASN A 142 12.257 -7.909 9.132 1.00 0.14 H new ATOM 0 HB2 ASN A 142 12.761 -5.327 7.678 1.00 14.25 H new ATOM 0 HB3 ASN A 142 12.615 -5.598 9.403 1.00 14.25 H new ATOM 0 HD21 ASN A 142 16.184 -5.047 8.257 1.00 22.43 H new ATOM 0 HD22 ASN A 142 14.648 -4.200 8.043 1.00 22.43 H new ATOM 2270 N VAL A 143 10.447 -7.103 6.545 1.00 1.42 N ATOM 2271 CA VAL A 143 9.026 -7.178 6.180 1.00 12.14 C ATOM 2272 C VAL A 143 8.321 -8.335 6.915 1.00 14.33 C ATOM 2273 O VAL A 143 7.157 -8.200 7.306 1.00 24.42 O ATOM 2274 CB VAL A 143 8.851 -7.172 4.647 1.00 31.23 C ATOM 2275 CG1 VAL A 143 7.460 -7.626 4.178 1.00 11.51 C ATOM 2276 CG2 VAL A 143 9.045 -5.731 4.146 1.00 62.33 C ATOM 0 H VAL A 143 11.100 -7.106 5.761 1.00 1.42 H new ATOM 0 HA VAL A 143 8.514 -6.280 6.526 1.00 12.14 H new ATOM 0 HB VAL A 143 9.584 -7.874 4.248 1.00 31.23 H new ATOM 0 HG11 VAL A 143 7.415 -7.595 3.089 1.00 11.51 H new ATOM 0 HG12 VAL A 143 7.275 -8.644 4.520 1.00 11.51 H new ATOM 0 HG13 VAL A 143 6.702 -6.961 4.592 1.00 11.51 H new ATOM 0 HG21 VAL A 143 8.926 -5.703 3.063 1.00 62.33 H new ATOM 0 HG22 VAL A 143 8.303 -5.081 4.610 1.00 62.33 H new ATOM 0 HG23 VAL A 143 10.045 -5.386 4.410 1.00 62.33 H new ATOM 2286 N LYS A 144 9.004 -9.454 7.181 1.00 53.20 N ATOM 2287 CA LYS A 144 8.390 -10.537 7.942 1.00 51.32 C ATOM 2288 C LYS A 144 8.216 -10.200 9.427 1.00 75.30 C ATOM 2289 O LYS A 144 7.306 -10.799 10.009 1.00 3.33 O ATOM 2290 CB LYS A 144 9.181 -11.845 7.780 1.00 73.41 C ATOM 2291 CG LYS A 144 9.078 -12.409 6.358 1.00 0.54 C ATOM 2292 CD LYS A 144 10.099 -13.526 6.119 1.00 62.03 C ATOM 2293 CE LYS A 144 11.480 -12.952 5.762 1.00 20.04 C ATOM 2294 NZ LYS A 144 12.064 -13.663 4.610 1.00 43.20 N ATOM 0 H LYS A 144 9.964 -9.628 6.885 1.00 53.20 H new ATOM 0 HA LYS A 144 7.391 -10.672 7.527 1.00 51.32 H new ATOM 0 HB2 LYS A 144 10.228 -11.667 8.024 1.00 73.41 H new ATOM 0 HB3 LYS A 144 8.809 -12.583 8.490 1.00 73.41 H new ATOM 0 HG2 LYS A 144 8.072 -12.793 6.190 1.00 0.54 H new ATOM 0 HG3 LYS A 144 9.238 -11.608 5.636 1.00 0.54 H new ATOM 0 HD2 LYS A 144 10.180 -14.145 7.012 1.00 62.03 H new ATOM 0 HD3 LYS A 144 9.752 -14.173 5.313 1.00 62.03 H new ATOM 0 HE2 LYS A 144 11.388 -11.891 5.531 1.00 20.04 H new ATOM 0 HE3 LYS A 144 12.146 -13.035 6.621 1.00 20.04 H new ATOM 0 HZ1 LYS A 144 12.996 -13.258 4.388 1.00 43.20 H new ATOM 0 HZ2 LYS A 144 12.171 -14.671 4.842 1.00 43.20 H new ATOM 0 HZ3 LYS A 144 11.437 -13.562 3.786 1.00 43.20 H new ATOM 2308 N GLU A 145 9.008 -9.314 10.048 1.00 73.13 N ATOM 2309 CA GLU A 145 8.886 -9.054 11.476 1.00 44.33 C ATOM 2310 C GLU A 145 7.708 -8.105 11.735 1.00 35.33 C ATOM 2311 O GLU A 145 6.923 -8.351 12.647 1.00 11.24 O ATOM 2312 CB GLU A 145 10.240 -8.770 12.141 1.00 73.02 C ATOM 2313 CG GLU A 145 10.597 -7.360 11.849 1.00 21.03 C ATOM 2314 CD GLU A 145 11.965 -6.912 12.359 1.00 62.10 C ATOM 2315 OE1 GLU A 145 12.120 -6.548 13.543 1.00 75.20 O ATOM 2316 OE2 GLU A 145 12.932 -6.919 11.556 1.00 13.13 O ATOM 0 H GLU A 145 9.734 -8.772 9.580 1.00 73.13 H new ATOM 0 HA GLU A 145 8.600 -9.954 12.021 1.00 44.33 H new ATOM 0 HB2 GLU A 145 10.180 -8.935 13.217 1.00 73.02 H new ATOM 0 HB3 GLU A 145 11.004 -9.446 11.757 1.00 73.02 H new ATOM 0 HG2 GLU A 145 10.564 -7.210 10.770 1.00 21.03 H new ATOM 0 HG3 GLU A 145 9.836 -6.713 12.284 1.00 21.03 H new ATOM 2323 N GLU A 146 7.506 -7.104 10.870 1.00 43.54 N ATOM 2324 CA GLU A 146 6.360 -6.196 10.937 1.00 43.32 C ATOM 2325 C GLU A 146 5.066 -7.004 10.815 1.00 11.34 C ATOM 2326 O GLU A 146 4.168 -6.931 11.656 1.00 64.12 O ATOM 2327 CB GLU A 146 6.434 -5.171 9.800 1.00 11.13 C ATOM 2328 CG GLU A 146 7.707 -4.325 9.731 1.00 2.55 C ATOM 2329 CD GLU A 146 7.862 -3.230 10.793 1.00 42.20 C ATOM 2330 OE1 GLU A 146 6.849 -2.746 11.356 1.00 64.23 O ATOM 2331 OE2 GLU A 146 9.009 -2.792 11.017 1.00 24.41 O ATOM 0 H GLU A 146 8.141 -6.902 10.098 1.00 43.54 H new ATOM 0 HA GLU A 146 6.376 -5.669 11.891 1.00 43.32 H new ATOM 0 HB2 GLU A 146 6.324 -5.701 8.854 1.00 11.13 H new ATOM 0 HB3 GLU A 146 5.581 -4.499 9.890 1.00 11.13 H new ATOM 0 HG2 GLU A 146 8.565 -4.994 9.803 1.00 2.55 H new ATOM 0 HG3 GLU A 146 7.751 -3.855 8.748 1.00 2.55 H new ATOM 2338 N ASN A 147 5.008 -7.848 9.780 1.00 63.14 N ATOM 2339 CA ASN A 147 3.838 -8.660 9.477 1.00 24.45 C ATOM 2340 C ASN A 147 3.499 -9.590 10.632 1.00 64.42 C ATOM 2341 O ASN A 147 2.339 -9.975 10.771 1.00 22.03 O ATOM 2342 CB ASN A 147 4.086 -9.536 8.232 1.00 1.11 C ATOM 2343 CG ASN A 147 4.190 -8.745 6.940 1.00 12.53 C ATOM 2344 OD1 ASN A 147 3.932 -7.555 6.903 1.00 40.52 O ATOM 2345 ND2 ASN A 147 4.532 -9.383 5.833 1.00 11.15 N ATOM 0 H ASN A 147 5.780 -7.984 9.128 1.00 63.14 H new ATOM 0 HA ASN A 147 3.014 -7.969 9.299 1.00 24.45 H new ATOM 0 HB2 ASN A 147 5.006 -10.103 8.375 1.00 1.11 H new ATOM 0 HB3 ASN A 147 3.276 -10.260 8.141 1.00 1.11 H new ATOM 0 HD21 ASN A 147 4.580 -8.879 4.948 1.00 11.15 H new ATOM 0 HD22 ASN A 147 4.748 -10.379 5.865 1.00 11.15 H new ATOM 2352 N ALA A 148 4.505 -10.033 11.393 1.00 34.43 N ATOM 2353 CA ALA A 148 4.321 -10.974 12.483 1.00 0.52 C ATOM 2354 C ALA A 148 3.624 -10.328 13.676 1.00 41.13 C ATOM 2355 O ALA A 148 2.842 -11.021 14.328 1.00 43.53 O ATOM 2356 CB ALA A 148 5.672 -11.557 12.893 1.00 24.33 C ATOM 0 H ALA A 148 5.474 -9.742 11.262 1.00 34.43 H new ATOM 0 HA ALA A 148 3.675 -11.779 12.133 1.00 0.52 H new ATOM 0 HB1 ALA A 148 5.530 -12.263 13.711 1.00 24.33 H new ATOM 0 HB2 ALA A 148 6.119 -12.072 12.043 1.00 24.33 H new ATOM 0 HB3 ALA A 148 6.332 -10.753 13.218 1.00 24.33 H new ATOM 2362 N ALA A 149 3.884 -9.045 13.940 1.00 74.31 N ATOM 2363 CA ALA A 149 3.199 -8.299 14.983 1.00 20.43 C ATOM 2364 C ALA A 149 1.737 -8.108 14.596 1.00 74.03 C ATOM 2365 O ALA A 149 0.851 -8.511 15.340 1.00 21.41 O ATOM 2366 CB ALA A 149 3.904 -6.958 15.204 1.00 2.34 C ATOM 0 H ALA A 149 4.579 -8.498 13.431 1.00 74.31 H new ATOM 0 HA ALA A 149 3.230 -8.853 15.921 1.00 20.43 H new ATOM 0 HB1 ALA A 149 3.389 -6.401 15.986 1.00 2.34 H new ATOM 0 HB2 ALA A 149 4.937 -7.135 15.505 1.00 2.34 H new ATOM 0 HB3 ALA A 149 3.889 -6.382 14.279 1.00 2.34 H new ATOM 2372 N PHE A 150 1.459 -7.535 13.422 1.00 43.54 N ATOM 2373 CA PHE A 150 0.078 -7.254 13.028 1.00 13.24 C ATOM 2374 C PHE A 150 -0.761 -8.536 13.000 1.00 34.41 C ATOM 2375 O PHE A 150 -1.865 -8.579 13.553 1.00 11.52 O ATOM 2376 CB PHE A 150 0.035 -6.552 11.669 1.00 60.12 C ATOM 2377 CG PHE A 150 -1.381 -6.320 11.168 1.00 2.14 C ATOM 2378 CD1 PHE A 150 -2.037 -7.339 10.461 1.00 53.24 C ATOM 2379 CD2 PHE A 150 -2.067 -5.123 11.439 1.00 2.21 C ATOM 2380 CE1 PHE A 150 -3.327 -7.146 9.953 1.00 61.24 C ATOM 2381 CE2 PHE A 150 -3.380 -4.937 10.964 1.00 24.31 C ATOM 2382 CZ PHE A 150 -4.002 -5.940 10.199 1.00 11.32 C ATOM 0 H PHE A 150 2.162 -7.260 12.736 1.00 43.54 H new ATOM 0 HA PHE A 150 -0.353 -6.587 13.774 1.00 13.24 H new ATOM 0 HB2 PHE A 150 0.550 -5.594 11.744 1.00 60.12 H new ATOM 0 HB3 PHE A 150 0.580 -7.151 10.939 1.00 60.12 H new ATOM 0 HD1 PHE A 150 -1.540 -8.285 10.307 1.00 53.24 H new ATOM 0 HD2 PHE A 150 -1.586 -4.344 12.013 1.00 2.21 H new ATOM 0 HE1 PHE A 150 -3.802 -7.923 9.373 1.00 61.24 H new ATOM 0 HE2 PHE A 150 -3.910 -4.023 11.188 1.00 24.31 H new ATOM 0 HZ PHE A 150 -4.994 -5.783 9.803 1.00 11.32 H new ATOM 2392 N LYS A 151 -0.256 -9.597 12.348 1.00 43.50 N ATOM 2393 CA LYS A 151 -1.019 -10.832 12.191 1.00 13.23 C ATOM 2394 C LYS A 151 -1.335 -11.509 13.527 1.00 75.20 C ATOM 2395 O LYS A 151 -2.218 -12.367 13.548 1.00 35.43 O ATOM 2396 CB LYS A 151 -0.335 -11.764 11.182 1.00 20.02 C ATOM 2397 CG LYS A 151 0.750 -12.629 11.820 1.00 71.11 C ATOM 2398 CD LYS A 151 1.410 -13.580 10.817 1.00 22.22 C ATOM 2399 CE LYS A 151 2.375 -12.837 9.893 1.00 73.04 C ATOM 2400 NZ LYS A 151 2.827 -13.669 8.766 1.00 63.04 N ATOM 0 H LYS A 151 0.672 -9.618 11.926 1.00 43.50 H new ATOM 0 HA LYS A 151 -1.994 -10.571 11.778 1.00 13.23 H new ATOM 0 HB2 LYS A 151 -1.085 -12.409 10.723 1.00 20.02 H new ATOM 0 HB3 LYS A 151 0.105 -11.167 10.383 1.00 20.02 H new ATOM 0 HG2 LYS A 151 1.511 -11.985 12.260 1.00 71.11 H new ATOM 0 HG3 LYS A 151 0.315 -13.210 12.634 1.00 71.11 H new ATOM 0 HD2 LYS A 151 1.948 -14.361 11.354 1.00 22.22 H new ATOM 0 HD3 LYS A 151 0.642 -14.073 10.222 1.00 22.22 H new ATOM 0 HE2 LYS A 151 1.887 -11.942 9.507 1.00 73.04 H new ATOM 0 HE3 LYS A 151 3.241 -12.506 10.467 1.00 73.04 H new ATOM 0 HZ1 LYS A 151 3.479 -13.121 8.169 1.00 63.04 H new ATOM 0 HZ2 LYS A 151 3.317 -14.511 9.131 1.00 63.04 H new ATOM 0 HZ3 LYS A 151 2.005 -13.964 8.201 1.00 63.04 H new ATOM 2414 N GLU A 152 -0.632 -11.169 14.611 1.00 71.22 N ATOM 2415 CA GLU A 152 -0.907 -11.670 15.949 1.00 73.12 C ATOM 2416 C GLU A 152 -2.343 -11.308 16.347 1.00 1.43 C ATOM 2417 O GLU A 152 -3.071 -12.174 16.841 1.00 21.35 O ATOM 2418 CB GLU A 152 0.137 -11.100 16.924 1.00 60.00 C ATOM 2419 CG GLU A 152 0.084 -11.731 18.322 1.00 72.30 C ATOM 2420 CD GLU A 152 -0.107 -10.682 19.415 1.00 44.30 C ATOM 2421 OE1 GLU A 152 -1.205 -10.095 19.509 1.00 55.32 O ATOM 2422 OE2 GLU A 152 0.832 -10.476 20.216 1.00 11.35 O ATOM 0 H GLU A 152 0.158 -10.525 14.576 1.00 71.22 H new ATOM 0 HA GLU A 152 -0.829 -12.757 15.979 1.00 73.12 H new ATOM 0 HB2 GLU A 152 1.132 -11.249 16.505 1.00 60.00 H new ATOM 0 HB3 GLU A 152 -0.013 -10.024 17.015 1.00 60.00 H new ATOM 0 HG2 GLU A 152 -0.733 -12.452 18.364 1.00 72.30 H new ATOM 0 HG3 GLU A 152 1.006 -12.283 18.506 1.00 72.30 H new ATOM 2429 N ILE A 153 -2.756 -10.072 16.052 1.00 74.11 N ATOM 2430 CA ILE A 153 -4.057 -9.514 16.402 1.00 61.13 C ATOM 2431 C ILE A 153 -5.066 -9.821 15.298 1.00 22.23 C ATOM 2432 O ILE A 153 -6.138 -10.360 15.577 1.00 74.42 O ATOM 2433 CB ILE A 153 -3.972 -7.986 16.612 1.00 53.51 C ATOM 2434 CG1 ILE A 153 -2.627 -7.542 17.236 1.00 63.23 C ATOM 2435 CG2 ILE A 153 -5.179 -7.525 17.453 1.00 51.22 C ATOM 2436 CD1 ILE A 153 -2.576 -6.094 17.724 1.00 15.35 C ATOM 0 H ILE A 153 -2.168 -9.411 15.544 1.00 74.11 H new ATOM 0 HA ILE A 153 -4.381 -9.972 17.337 1.00 61.13 H new ATOM 0 HB ILE A 153 -4.009 -7.502 15.636 1.00 53.51 H new ATOM 0 HG12 ILE A 153 -2.402 -8.199 18.076 1.00 63.23 H new ATOM 0 HG13 ILE A 153 -1.838 -7.687 16.498 1.00 63.23 H new ATOM 0 HG21 ILE A 153 -5.126 -6.447 17.605 1.00 51.22 H new ATOM 0 HG22 ILE A 153 -6.103 -7.772 16.930 1.00 51.22 H new ATOM 0 HG23 ILE A 153 -5.163 -8.029 18.419 1.00 51.22 H new ATOM 0 HD11 ILE A 153 -1.592 -5.886 18.143 1.00 15.35 H new ATOM 0 HD12 ILE A 153 -2.764 -5.421 16.887 1.00 15.35 H new ATOM 0 HD13 ILE A 153 -3.336 -5.941 18.490 1.00 15.35 H new ATOM 2448 N HIS A 154 -4.735 -9.476 14.049 1.00 55.14 N ATOM 2449 CA HIS A 154 -5.622 -9.584 12.897 1.00 31.41 C ATOM 2450 C HIS A 154 -5.041 -10.608 11.921 1.00 13.34 C ATOM 2451 O HIS A 154 -4.413 -10.232 10.932 1.00 42.33 O ATOM 2452 CB HIS A 154 -5.868 -8.201 12.270 1.00 24.01 C ATOM 2453 CG HIS A 154 -6.971 -7.411 12.931 1.00 31.21 C ATOM 2454 ND1 HIS A 154 -8.121 -7.930 13.487 1.00 63.13 N ATOM 2455 CD2 HIS A 154 -7.040 -6.049 13.037 1.00 4.51 C ATOM 2456 CE1 HIS A 154 -8.846 -6.909 13.961 1.00 54.50 C ATOM 2457 NE2 HIS A 154 -8.254 -5.737 13.669 1.00 60.40 N ATOM 0 H HIS A 154 -3.816 -9.104 13.810 1.00 55.14 H new ATOM 0 HA HIS A 154 -6.605 -9.944 13.200 1.00 31.41 H new ATOM 0 HB2 HIS A 154 -4.945 -7.624 12.316 1.00 24.01 H new ATOM 0 HB3 HIS A 154 -6.110 -8.330 11.215 1.00 24.01 H new ATOM 0 HD2 HIS A 154 -6.297 -5.343 12.697 1.00 4.51 H new ATOM 0 HE1 HIS A 154 -9.775 -7.012 14.502 1.00 54.50 H new ATOM 0 HE2 HIS A 154 -8.616 -4.804 13.868 1.00 60.40 H new ATOM 2465 N PRO A 155 -5.216 -11.910 12.197 1.00 40.10 N ATOM 2466 CA PRO A 155 -4.785 -12.970 11.306 1.00 22.45 C ATOM 2467 C PRO A 155 -5.620 -12.985 10.025 1.00 24.04 C ATOM 2468 O PRO A 155 -6.795 -12.552 10.027 1.00 33.42 O ATOM 2469 CB PRO A 155 -4.903 -14.259 12.116 1.00 33.44 C ATOM 2470 CG PRO A 155 -5.972 -13.957 13.160 1.00 23.01 C ATOM 2471 CD PRO A 155 -5.816 -12.459 13.403 1.00 60.03 C ATOM 0 HA PRO A 155 -3.759 -12.833 10.964 1.00 22.45 H new ATOM 0 HB2 PRO A 155 -5.191 -15.100 11.485 1.00 33.44 H new ATOM 0 HB3 PRO A 155 -3.954 -14.522 12.584 1.00 33.44 H new ATOM 0 HG2 PRO A 155 -6.970 -14.203 12.796 1.00 23.01 H new ATOM 0 HG3 PRO A 155 -5.815 -14.531 14.073 1.00 23.01 H new ATOM 0 HD2 PRO A 155 -6.782 -11.995 13.603 1.00 60.03 H new ATOM 0 HD3 PRO A 155 -5.186 -12.270 14.272 1.00 60.03 H new TER 2479 PRO A 155