USER MOD reduce.3.24.130724 H: found=0, std=0, add=1247, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1248 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 38 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 157 GLN : amide:sc= -0.137 K(o=-2,f=-3) USER MOD Set 2.2: A 160 GLN : amide:sc= -1.89! C(o=-2!,f=-2.6!) USER MOD Set 3.1: A 143 THR OG1 : rot 180:sc= -0.3 USER MOD Set 3.2: A 144 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 117 GLN : amide:sc= -1.1 K(o=-1.1,f=-4.2!) USER MOD Set 4.2: A 121 LYS NZ :NH3+ -161:sc= -0.0014 (180deg=0) USER MOD Set 5.1: A 109 SER OG : rot 180:sc= -0.017 USER MOD Set 5.2: A 112 GLN : amide:sc= -4.36! C(o=-4.4!,f=-2.3!) USER MOD Set 6.1: A 45 CYS SG : rot 64:sc= -2.56 USER MOD Set 6.2: A 165 HIS : no HD1:sc= -2.53 K(o=-5.1,f=-3.3) USER MOD Set 7.1: A 28 LYS NZ :NH3+ -116:sc= 0.696 (180deg=0) USER MOD Set 7.2: A 29 GLN : amide:sc= -1.94 K(o=-1.2,f=-2.5) USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.207 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot -60:sc= 0.107 USER MOD Single : A 46 ASN : amide:sc= -0.371 K(o=-0.37,f=-2.6!) USER MOD Single : A 47 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.178) USER MOD Single : A 48 SER OG : rot -109:sc= -4.3! USER MOD Single : A 49 ASN : amide:sc= -0.0101 K(o=-0.01,f=-2.9!) USER MOD Single : A 50 MET CE :methyl -179:sc= -3.88 (180deg=-4.02) USER MOD Single : A 62 ASN : amide:sc=-0.00664 X(o=-0.0066,f=-0.14) USER MOD Single : A 64 ASN : amide:sc= -0.71 K(o=-0.71,f=-1.7) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -109:sc= -0.637 (180deg=-5.53!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -0.329 K(o=-0.33,f=-1.9!) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0134) USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.983 USER MOD Single : A 98 TYR OH : rot -10:sc= -3.99! USER MOD Single : A 101 TYR OH : rot 180:sc= -3.07! USER MOD Single : A 103 GLN : amide:sc= -0.8 K(o=-0.8,f=-2.6!) USER MOD Single : A 104 ASN : amide:sc= -0.216 K(o=-0.22,f=-0.81) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl -152:sc= -0.13 (180deg=-0.486) USER MOD Single : A 119 SER OG : rot 170:sc= 0 USER MOD Single : A 120 THR OG1 : rot -28:sc= -1.47! USER MOD Single : A 125 GLN : amide:sc= 0 X(o=0,f=-0.078) USER MOD Single : A 128 GLN : amide:sc= -0.261 K(o=-0.26,f=-2.7!) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= -1.04 K(o=-1,f=0.093!) USER MOD Single : A 138 THR OG1 : rot 180:sc= -0.0651 USER MOD Single : A 139 THR OG1 : rot -160:sc= -3.73! USER MOD Single : A 145 ASN : amide:sc= -5.3! C(o=-5.3!,f=-2.7!) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 GLN : amide:sc= -0.62 K(o=-0.62,f=-2.7!) USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 156 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 162 MET CE :methyl -118:sc= -16.9! (180deg=-22.3!) USER MOD Single : A 163 THR OG1 : rot 68:sc= 0.679 USER MOD Single : A 164 THR OG1 : rot -68:sc= 0.768 USER MOD Single : A 170 SER OG : rot 180:sc= 0 USER MOD Single : A 176 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 SER OG : rot -172:sc= 0.398 USER MOD Single : A 178 SER OG : rot 180:sc= -4.45! USER MOD Single : A 184 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 185 MET CE :methyl -123:sc= -1.25 (180deg=-2.32!) USER MOD ----------------------------------------------------------------- ATOM 20 N THR A 21 19.869 11.713 0.069 1.00 0.95 N ATOM 21 CA THR A 21 20.128 10.586 -0.870 1.00 0.95 C ATOM 22 C THR A 21 18.798 10.081 -1.437 1.00 0.85 C ATOM 23 O THR A 21 17.736 10.496 -1.019 1.00 0.75 O ATOM 24 CB THR A 21 20.844 9.450 -0.132 1.00 0.90 C ATOM 25 OG1 THR A 21 21.044 8.362 -1.023 1.00 1.12 O ATOM 26 CG2 THR A 21 19.998 8.987 1.056 1.00 0.95 C ATOM 0 HA THR A 21 20.761 10.932 -1.687 1.00 0.95 H new ATOM 0 HB THR A 21 21.807 9.808 0.232 1.00 0.90 H new ATOM 0 HG1 THR A 21 21.503 7.635 -0.553 1.00 1.12 H new ATOM 0 HG21 THR A 21 20.513 8.179 1.576 1.00 0.95 H new ATOM 0 HG22 THR A 21 19.846 9.821 1.741 1.00 0.95 H new ATOM 0 HG23 THR A 21 19.032 8.630 0.698 1.00 0.95 H new ATOM 34 N SER A 22 18.849 9.194 -2.393 1.00 0.91 N ATOM 35 CA SER A 22 17.590 8.671 -2.997 1.00 0.86 C ATOM 36 C SER A 22 16.697 8.059 -1.911 1.00 0.73 C ATOM 37 O SER A 22 15.486 8.080 -2.009 1.00 0.72 O ATOM 38 CB SER A 22 17.933 7.601 -4.034 1.00 0.98 C ATOM 39 OG SER A 22 18.244 8.229 -5.271 1.00 1.33 O ATOM 0 H SER A 22 19.709 8.808 -2.783 1.00 0.91 H new ATOM 0 HA SER A 22 17.056 9.492 -3.475 1.00 0.86 H new ATOM 0 HB2 SER A 22 18.779 7.005 -3.692 1.00 0.98 H new ATOM 0 HB3 SER A 22 17.093 6.918 -4.161 1.00 0.98 H new ATOM 0 HG SER A 22 18.466 7.546 -5.938 1.00 1.33 H new ATOM 45 N SER A 23 17.280 7.505 -0.883 1.00 0.66 N ATOM 46 CA SER A 23 16.457 6.886 0.197 1.00 0.54 C ATOM 47 C SER A 23 15.715 7.973 0.977 1.00 0.48 C ATOM 48 O SER A 23 14.534 7.859 1.241 1.00 0.45 O ATOM 49 CB SER A 23 17.368 6.112 1.149 1.00 0.54 C ATOM 50 OG SER A 23 16.603 5.634 2.246 1.00 0.81 O ATOM 0 H SER A 23 18.289 7.454 -0.744 1.00 0.66 H new ATOM 0 HA SER A 23 15.731 6.208 -0.251 1.00 0.54 H new ATOM 0 HB2 SER A 23 17.835 5.278 0.626 1.00 0.54 H new ATOM 0 HB3 SER A 23 18.172 6.756 1.505 1.00 0.54 H new ATOM 0 HG SER A 23 17.184 5.136 2.858 1.00 0.81 H new ATOM 56 N GLU A 24 16.391 9.027 1.347 1.00 0.46 N ATOM 57 CA GLU A 24 15.710 10.117 2.104 1.00 0.40 C ATOM 58 C GLU A 24 14.507 10.599 1.297 1.00 0.38 C ATOM 59 O GLU A 24 13.444 10.850 1.829 1.00 0.35 O ATOM 60 CB GLU A 24 16.683 11.279 2.321 1.00 0.48 C ATOM 61 CG GLU A 24 16.572 11.783 3.763 1.00 0.49 C ATOM 62 CD GLU A 24 17.640 11.108 4.624 1.00 1.07 C ATOM 63 OE1 GLU A 24 18.805 11.213 4.278 1.00 2.19 O ATOM 64 OE2 GLU A 24 17.275 10.498 5.615 1.00 1.49 O ATOM 0 H GLU A 24 17.382 9.180 1.159 1.00 0.46 H new ATOM 0 HA GLU A 24 15.380 9.744 3.074 1.00 0.40 H new ATOM 0 HB2 GLU A 24 17.703 10.955 2.117 1.00 0.48 H new ATOM 0 HB3 GLU A 24 16.460 12.088 1.625 1.00 0.48 H new ATOM 0 HG2 GLU A 24 16.698 12.865 3.792 1.00 0.49 H new ATOM 0 HG3 GLU A 24 15.580 11.567 4.160 1.00 0.49 H new ATOM 71 N ARG A 25 14.666 10.716 0.008 1.00 0.46 N ATOM 72 CA ARG A 25 13.535 11.166 -0.844 1.00 0.47 C ATOM 73 C ARG A 25 12.448 10.090 -0.834 1.00 0.42 C ATOM 74 O ARG A 25 11.273 10.382 -0.919 1.00 0.42 O ATOM 75 CB ARG A 25 14.025 11.392 -2.277 1.00 0.59 C ATOM 76 CG ARG A 25 15.379 12.107 -2.254 1.00 0.63 C ATOM 77 CD ARG A 25 15.503 13.017 -3.475 1.00 0.44 C ATOM 78 NE ARG A 25 16.675 12.595 -4.292 1.00 1.46 N ATOM 79 CZ ARG A 25 17.449 13.493 -4.837 1.00 1.91 C ATOM 80 NH1 ARG A 25 17.133 14.012 -5.993 1.00 2.09 N ATOM 81 NH2 ARG A 25 18.537 13.875 -4.227 1.00 2.75 N ATOM 0 H ARG A 25 15.533 10.518 -0.491 1.00 0.46 H new ATOM 0 HA ARG A 25 13.131 12.101 -0.456 1.00 0.47 H new ATOM 0 HB2 ARG A 25 14.116 10.437 -2.795 1.00 0.59 H new ATOM 0 HB3 ARG A 25 13.298 11.987 -2.830 1.00 0.59 H new ATOM 0 HG2 ARG A 25 15.476 12.693 -1.340 1.00 0.63 H new ATOM 0 HG3 ARG A 25 16.187 11.376 -2.250 1.00 0.63 H new ATOM 0 HD2 ARG A 25 14.593 12.967 -4.073 1.00 0.44 H new ATOM 0 HD3 ARG A 25 15.621 14.053 -3.159 1.00 0.44 H new ATOM 0 HE ARG A 25 16.873 11.603 -4.425 1.00 1.46 H new ATOM 0 HH11 ARG A 25 16.281 13.715 -6.470 1.00 2.09 H new ATOM 0 HH12 ARG A 25 17.738 14.714 -6.419 1.00 2.09 H new ATOM 0 HH21 ARG A 25 18.783 13.472 -3.323 1.00 2.75 H new ATOM 0 HH22 ARG A 25 19.141 14.577 -4.654 1.00 2.75 H new ATOM 95 N ILE A 26 12.826 8.844 -0.720 1.00 0.41 N ATOM 96 CA ILE A 26 11.800 7.766 -0.693 1.00 0.38 C ATOM 97 C ILE A 26 11.008 7.879 0.618 1.00 0.19 C ATOM 98 O ILE A 26 9.852 7.513 0.690 1.00 0.26 O ATOM 99 CB ILE A 26 12.482 6.386 -0.818 1.00 0.47 C ATOM 100 CG1 ILE A 26 12.894 6.179 -2.288 1.00 0.67 C ATOM 101 CG2 ILE A 26 11.511 5.271 -0.382 1.00 0.59 C ATOM 102 CD1 ILE A 26 13.413 4.753 -2.518 1.00 0.40 C ATOM 0 H ILE A 26 13.794 8.530 -0.645 1.00 0.41 H new ATOM 0 HA ILE A 26 11.115 7.873 -1.534 1.00 0.38 H new ATOM 0 HB ILE A 26 13.360 6.347 -0.173 1.00 0.47 H new ATOM 0 HG12 ILE A 26 12.040 6.369 -2.939 1.00 0.67 H new ATOM 0 HG13 ILE A 26 13.667 6.899 -2.558 1.00 0.67 H new ATOM 0 HG21 ILE A 26 12.003 4.303 -0.475 1.00 0.59 H new ATOM 0 HG22 ILE A 26 11.216 5.430 0.655 1.00 0.59 H new ATOM 0 HG23 ILE A 26 10.626 5.290 -1.018 1.00 0.59 H new ATOM 0 HD11 ILE A 26 13.697 4.633 -3.564 1.00 0.40 H new ATOM 0 HD12 ILE A 26 14.281 4.575 -1.883 1.00 0.40 H new ATOM 0 HD13 ILE A 26 12.630 4.036 -2.271 1.00 0.40 H new ATOM 114 N ASP A 27 11.615 8.397 1.650 1.00 0.30 N ATOM 115 CA ASP A 27 10.886 8.546 2.943 1.00 0.21 C ATOM 116 C ASP A 27 9.869 9.681 2.807 1.00 0.18 C ATOM 117 O ASP A 27 8.702 9.527 3.113 1.00 0.13 O ATOM 118 CB ASP A 27 11.883 8.886 4.054 1.00 0.31 C ATOM 119 CG ASP A 27 11.130 9.074 5.373 1.00 0.14 C ATOM 120 OD1 ASP A 27 10.242 8.283 5.644 1.00 1.06 O ATOM 121 OD2 ASP A 27 11.454 10.008 6.089 1.00 1.16 O ATOM 0 H ASP A 27 12.581 8.723 1.655 1.00 0.30 H new ATOM 0 HA ASP A 27 10.374 7.616 3.191 1.00 0.21 H new ATOM 0 HB2 ASP A 27 12.619 8.089 4.153 1.00 0.31 H new ATOM 0 HB3 ASP A 27 12.429 9.795 3.802 1.00 0.31 H new ATOM 126 N LYS A 28 10.308 10.819 2.346 1.00 0.25 N ATOM 127 CA LYS A 28 9.378 11.972 2.185 1.00 0.30 C ATOM 128 C LYS A 28 8.395 11.698 1.036 1.00 0.31 C ATOM 129 O LYS A 28 7.419 12.401 0.870 1.00 0.45 O ATOM 130 CB LYS A 28 10.182 13.242 1.885 1.00 0.47 C ATOM 131 CG LYS A 28 11.020 13.042 0.621 1.00 1.31 C ATOM 132 CD LYS A 28 10.217 13.485 -0.604 1.00 1.91 C ATOM 133 CE LYS A 28 10.761 14.819 -1.116 1.00 2.46 C ATOM 134 NZ LYS A 28 10.838 14.786 -2.604 1.00 3.76 N ATOM 0 H LYS A 28 11.274 11.001 2.073 1.00 0.25 H new ATOM 0 HA LYS A 28 8.815 12.109 3.108 1.00 0.30 H new ATOM 0 HB2 LYS A 28 9.507 14.088 1.754 1.00 0.47 H new ATOM 0 HB3 LYS A 28 10.831 13.480 2.728 1.00 0.47 H new ATOM 0 HG2 LYS A 28 11.943 13.617 0.690 1.00 1.31 H new ATOM 0 HG3 LYS A 28 11.304 11.994 0.523 1.00 1.31 H new ATOM 0 HD2 LYS A 28 10.282 12.729 -1.387 1.00 1.91 H new ATOM 0 HD3 LYS A 28 9.163 13.586 -0.344 1.00 1.91 H new ATOM 0 HE2 LYS A 28 10.115 15.635 -0.793 1.00 2.46 H new ATOM 0 HE3 LYS A 28 11.748 15.007 -0.694 1.00 2.46 H new ATOM 0 HZ1 LYS A 28 11.831 14.863 -2.902 1.00 3.76 H new ATOM 0 HZ2 LYS A 28 10.441 13.890 -2.952 1.00 3.76 H new ATOM 0 HZ3 LYS A 28 10.296 15.581 -2.997 1.00 3.76 H new ATOM 148 N GLN A 29 8.637 10.684 0.246 1.00 0.30 N ATOM 149 CA GLN A 29 7.699 10.385 -0.876 1.00 0.30 C ATOM 150 C GLN A 29 6.541 9.533 -0.354 1.00 0.26 C ATOM 151 O GLN A 29 5.395 9.765 -0.688 1.00 0.35 O ATOM 152 CB GLN A 29 8.439 9.625 -1.983 1.00 0.31 C ATOM 153 CG GLN A 29 8.422 10.452 -3.270 1.00 0.62 C ATOM 154 CD GLN A 29 9.807 11.057 -3.510 1.00 1.03 C ATOM 155 OE1 GLN A 29 9.930 12.236 -3.776 1.00 1.97 O ATOM 156 NE2 GLN A 29 10.862 10.294 -3.425 1.00 2.12 N ATOM 0 H GLN A 29 9.436 10.055 0.328 1.00 0.30 H new ATOM 0 HA GLN A 29 7.311 11.319 -1.282 1.00 0.30 H new ATOM 0 HB2 GLN A 29 9.467 9.428 -1.679 1.00 0.31 H new ATOM 0 HB3 GLN A 29 7.966 8.658 -2.153 1.00 0.31 H new ATOM 0 HG2 GLN A 29 8.137 9.824 -4.114 1.00 0.62 H new ATOM 0 HG3 GLN A 29 7.676 11.243 -3.196 1.00 0.62 H new ATOM 0 HE21 GLN A 29 10.759 9.304 -3.202 1.00 2.12 H new ATOM 0 HE22 GLN A 29 11.790 10.687 -3.582 1.00 2.12 H new ATOM 165 N ILE A 30 6.819 8.557 0.471 1.00 0.18 N ATOM 166 CA ILE A 30 5.708 7.721 1.004 1.00 0.21 C ATOM 167 C ILE A 30 4.851 8.583 1.924 1.00 0.17 C ATOM 168 O ILE A 30 3.646 8.448 1.963 1.00 0.17 O ATOM 169 CB ILE A 30 6.253 6.519 1.774 1.00 0.35 C ATOM 170 CG1 ILE A 30 7.034 5.614 0.814 1.00 0.62 C ATOM 171 CG2 ILE A 30 5.084 5.742 2.370 1.00 0.32 C ATOM 172 CD1 ILE A 30 7.419 4.305 1.513 1.00 0.49 C ATOM 0 H ILE A 30 7.754 8.307 0.794 1.00 0.18 H new ATOM 0 HA ILE A 30 5.110 7.344 0.174 1.00 0.21 H new ATOM 0 HB ILE A 30 6.915 6.857 2.571 1.00 0.35 H new ATOM 0 HG12 ILE A 30 6.430 5.400 -0.067 1.00 0.62 H new ATOM 0 HG13 ILE A 30 7.931 6.127 0.468 1.00 0.62 H new ATOM 0 HG21 ILE A 30 5.463 4.882 2.922 1.00 0.32 H new ATOM 0 HG22 ILE A 30 4.524 6.389 3.046 1.00 0.32 H new ATOM 0 HG23 ILE A 30 4.429 5.400 1.569 1.00 0.32 H new ATOM 0 HD11 ILE A 30 7.973 3.672 0.820 1.00 0.49 H new ATOM 0 HD12 ILE A 30 8.041 4.525 2.380 1.00 0.49 H new ATOM 0 HD13 ILE A 30 6.517 3.786 1.836 1.00 0.49 H new ATOM 184 N ARG A 31 5.450 9.492 2.651 1.00 0.25 N ATOM 185 CA ARG A 31 4.635 10.378 3.533 1.00 0.37 C ATOM 186 C ARG A 31 3.551 11.026 2.667 1.00 0.38 C ATOM 187 O ARG A 31 2.476 11.362 3.126 1.00 0.42 O ATOM 188 CB ARG A 31 5.528 11.460 4.146 1.00 0.46 C ATOM 189 CG ARG A 31 4.934 11.922 5.479 1.00 0.85 C ATOM 190 CD ARG A 31 4.298 13.302 5.303 1.00 0.86 C ATOM 191 NE ARG A 31 4.214 13.983 6.626 1.00 1.10 N ATOM 192 CZ ARG A 31 3.349 13.577 7.515 1.00 2.48 C ATOM 193 NH1 ARG A 31 3.520 12.432 8.117 1.00 3.67 N ATOM 194 NH2 ARG A 31 2.311 14.317 7.803 1.00 3.08 N ATOM 0 H ARG A 31 6.456 9.657 2.672 1.00 0.25 H new ATOM 0 HA ARG A 31 4.184 9.804 4.342 1.00 0.37 H new ATOM 0 HB2 ARG A 31 6.534 11.071 4.300 1.00 0.46 H new ATOM 0 HB3 ARG A 31 5.614 12.305 3.463 1.00 0.46 H new ATOM 0 HG2 ARG A 31 4.187 11.207 5.824 1.00 0.85 H new ATOM 0 HG3 ARG A 31 5.712 11.963 6.241 1.00 0.85 H new ATOM 0 HD2 ARG A 31 4.889 13.901 4.611 1.00 0.86 H new ATOM 0 HD3 ARG A 31 3.303 13.203 4.869 1.00 0.86 H new ATOM 0 HE ARG A 31 4.832 14.766 6.837 1.00 1.10 H new ATOM 0 HH11 ARG A 31 4.330 11.854 7.893 1.00 3.67 H new ATOM 0 HH12 ARG A 31 2.844 12.115 8.812 1.00 3.67 H new ATOM 0 HH21 ARG A 31 2.177 15.212 7.333 1.00 3.08 H new ATOM 0 HH22 ARG A 31 1.635 13.999 8.498 1.00 3.08 H new ATOM 208 N TYR A 32 3.833 11.164 1.398 1.00 0.35 N ATOM 209 CA TYR A 32 2.849 11.743 0.455 1.00 0.37 C ATOM 210 C TYR A 32 1.815 10.665 0.141 1.00 0.32 C ATOM 211 O TYR A 32 0.628 10.918 0.086 1.00 0.41 O ATOM 212 CB TYR A 32 3.585 12.140 -0.827 1.00 0.38 C ATOM 213 CG TYR A 32 2.842 13.245 -1.527 1.00 0.43 C ATOM 214 CD1 TYR A 32 1.574 13.003 -2.063 1.00 1.28 C ATOM 215 CD2 TYR A 32 3.426 14.509 -1.650 1.00 0.81 C ATOM 216 CE1 TYR A 32 0.887 14.027 -2.721 1.00 1.52 C ATOM 217 CE2 TYR A 32 2.742 15.535 -2.307 1.00 0.65 C ATOM 218 CZ TYR A 32 1.470 15.294 -2.844 1.00 0.79 C ATOM 219 OH TYR A 32 0.792 16.305 -3.494 1.00 1.02 O ATOM 0 H TYR A 32 4.721 10.893 0.975 1.00 0.35 H new ATOM 0 HA TYR A 32 2.360 12.619 0.880 1.00 0.37 H new ATOM 0 HB2 TYR A 32 4.597 12.466 -0.589 1.00 0.38 H new ATOM 0 HB3 TYR A 32 3.675 11.277 -1.486 1.00 0.38 H new ATOM 0 HD1 TYR A 32 1.125 12.025 -1.969 1.00 1.28 H new ATOM 0 HD2 TYR A 32 4.407 14.693 -1.237 1.00 0.81 H new ATOM 0 HE1 TYR A 32 -0.093 13.841 -3.134 1.00 1.52 H new ATOM 0 HE2 TYR A 32 3.193 16.512 -2.401 1.00 0.65 H new ATOM 0 HH TYR A 32 1.337 17.120 -3.490 1.00 1.02 H new ATOM 229 N ILE A 33 2.271 9.454 -0.049 1.00 0.20 N ATOM 230 CA ILE A 33 1.338 8.330 -0.347 1.00 0.18 C ATOM 231 C ILE A 33 0.211 8.314 0.692 1.00 0.19 C ATOM 232 O ILE A 33 -0.951 8.223 0.357 1.00 0.19 O ATOM 233 CB ILE A 33 2.108 7.006 -0.297 1.00 0.16 C ATOM 234 CG1 ILE A 33 3.157 6.993 -1.411 1.00 0.24 C ATOM 235 CG2 ILE A 33 1.141 5.837 -0.498 1.00 0.18 C ATOM 236 CD1 ILE A 33 3.915 5.664 -1.382 1.00 0.21 C ATOM 0 H ILE A 33 3.257 9.195 -0.010 1.00 0.20 H new ATOM 0 HA ILE A 33 0.909 8.461 -1.340 1.00 0.18 H new ATOM 0 HB ILE A 33 2.596 6.906 0.673 1.00 0.16 H new ATOM 0 HG12 ILE A 33 2.676 7.129 -2.380 1.00 0.24 H new ATOM 0 HG13 ILE A 33 3.851 7.823 -1.281 1.00 0.24 H new ATOM 0 HG21 ILE A 33 1.693 4.898 -0.462 1.00 0.18 H new ATOM 0 HG22 ILE A 33 0.389 5.847 0.291 1.00 0.18 H new ATOM 0 HG23 ILE A 33 0.651 5.933 -1.467 1.00 0.18 H new ATOM 0 HD11 ILE A 33 4.662 5.654 -2.175 1.00 0.21 H new ATOM 0 HD12 ILE A 33 4.408 5.548 -0.417 1.00 0.21 H new ATOM 0 HD13 ILE A 33 3.215 4.842 -1.533 1.00 0.21 H new ATOM 248 N LEU A 34 0.554 8.401 1.948 1.00 0.25 N ATOM 249 CA LEU A 34 -0.486 8.390 3.016 1.00 0.29 C ATOM 250 C LEU A 34 -1.335 9.659 2.921 1.00 0.30 C ATOM 251 O LEU A 34 -2.545 9.612 3.019 1.00 0.29 O ATOM 252 CB LEU A 34 0.198 8.344 4.383 1.00 0.36 C ATOM 253 CG LEU A 34 -0.069 6.994 5.048 1.00 0.53 C ATOM 254 CD1 LEU A 34 0.835 5.931 4.423 1.00 0.91 C ATOM 255 CD2 LEU A 34 0.228 7.103 6.546 1.00 0.34 C ATOM 0 H LEU A 34 1.515 8.480 2.282 1.00 0.25 H new ATOM 0 HA LEU A 34 -1.125 7.516 2.891 1.00 0.29 H new ATOM 0 HB2 LEU A 34 1.271 8.498 4.269 1.00 0.36 H new ATOM 0 HB3 LEU A 34 -0.174 9.151 5.014 1.00 0.36 H new ATOM 0 HG LEU A 34 -1.112 6.712 4.902 1.00 0.53 H new ATOM 0 HD11 LEU A 34 0.645 4.968 4.897 1.00 0.91 H new ATOM 0 HD12 LEU A 34 0.626 5.858 3.356 1.00 0.91 H new ATOM 0 HD13 LEU A 34 1.879 6.209 4.570 1.00 0.91 H new ATOM 0 HD21 LEU A 34 0.039 6.142 7.025 1.00 0.34 H new ATOM 0 HD22 LEU A 34 1.272 7.382 6.691 1.00 0.34 H new ATOM 0 HD23 LEU A 34 -0.415 7.863 6.990 1.00 0.34 H new ATOM 267 N ASP A 35 -0.714 10.795 2.723 1.00 0.34 N ATOM 268 CA ASP A 35 -1.494 12.065 2.615 1.00 0.38 C ATOM 269 C ASP A 35 -2.589 11.879 1.570 1.00 0.33 C ATOM 270 O ASP A 35 -3.638 12.490 1.630 1.00 0.32 O ATOM 271 CB ASP A 35 -0.567 13.205 2.187 1.00 0.44 C ATOM 272 CG ASP A 35 -1.085 14.527 2.756 1.00 0.63 C ATOM 273 OD1 ASP A 35 -1.054 14.680 3.966 1.00 1.03 O ATOM 274 OD2 ASP A 35 -1.503 15.364 1.973 1.00 1.50 O ATOM 0 H ASP A 35 0.297 10.897 2.632 1.00 0.34 H new ATOM 0 HA ASP A 35 -1.937 12.310 3.580 1.00 0.38 H new ATOM 0 HB2 ASP A 35 0.446 13.016 2.542 1.00 0.44 H new ATOM 0 HB3 ASP A 35 -0.519 13.259 1.099 1.00 0.44 H new ATOM 279 N GLY A 36 -2.354 11.019 0.623 1.00 0.32 N ATOM 280 CA GLY A 36 -3.375 10.763 -0.418 1.00 0.29 C ATOM 281 C GLY A 36 -4.423 9.810 0.154 1.00 0.22 C ATOM 282 O GLY A 36 -5.607 10.021 0.013 1.00 0.22 O ATOM 0 H GLY A 36 -1.493 10.481 0.527 1.00 0.32 H new ATOM 0 HA2 GLY A 36 -3.842 11.698 -0.728 1.00 0.29 H new ATOM 0 HA3 GLY A 36 -2.912 10.329 -1.304 1.00 0.29 H new ATOM 286 N ILE A 37 -3.986 8.762 0.798 1.00 0.19 N ATOM 287 CA ILE A 37 -4.939 7.773 1.383 1.00 0.21 C ATOM 288 C ILE A 37 -5.927 8.462 2.324 1.00 0.30 C ATOM 289 O ILE A 37 -7.027 7.988 2.523 1.00 0.33 O ATOM 290 CB ILE A 37 -4.170 6.715 2.171 1.00 0.27 C ATOM 291 CG1 ILE A 37 -3.155 6.027 1.255 1.00 0.21 C ATOM 292 CG2 ILE A 37 -5.155 5.676 2.717 1.00 0.35 C ATOM 293 CD1 ILE A 37 -3.888 5.317 0.118 1.00 0.22 C ATOM 0 H ILE A 37 -3.000 8.546 0.946 1.00 0.19 H new ATOM 0 HA ILE A 37 -5.488 7.308 0.564 1.00 0.21 H new ATOM 0 HB ILE A 37 -3.643 7.189 2.999 1.00 0.27 H new ATOM 0 HG12 ILE A 37 -2.459 6.762 0.850 1.00 0.21 H new ATOM 0 HG13 ILE A 37 -2.564 5.309 1.824 1.00 0.21 H new ATOM 0 HG21 ILE A 37 -4.610 4.919 3.280 1.00 0.35 H new ATOM 0 HG22 ILE A 37 -5.876 6.166 3.371 1.00 0.35 H new ATOM 0 HG23 ILE A 37 -5.681 5.203 1.888 1.00 0.35 H new ATOM 0 HD11 ILE A 37 -3.163 4.828 -0.533 1.00 0.22 H new ATOM 0 HD12 ILE A 37 -4.566 4.570 0.532 1.00 0.22 H new ATOM 0 HD13 ILE A 37 -4.459 6.045 -0.458 1.00 0.22 H new ATOM 305 N SER A 38 -5.564 9.574 2.904 1.00 0.42 N ATOM 306 CA SER A 38 -6.515 10.259 3.814 1.00 0.53 C ATOM 307 C SER A 38 -7.680 10.726 2.965 1.00 0.45 C ATOM 308 O SER A 38 -8.831 10.604 3.335 1.00 0.43 O ATOM 309 CB SER A 38 -5.837 11.459 4.477 1.00 0.69 C ATOM 310 OG SER A 38 -4.578 11.057 5.001 1.00 1.47 O ATOM 0 H SER A 38 -4.660 10.031 2.787 1.00 0.42 H new ATOM 0 HA SER A 38 -6.851 9.586 4.603 1.00 0.53 H new ATOM 0 HB2 SER A 38 -5.703 12.262 3.752 1.00 0.69 H new ATOM 0 HB3 SER A 38 -6.467 11.852 5.275 1.00 0.69 H new ATOM 0 HG SER A 38 -4.140 11.824 5.425 1.00 1.47 H new ATOM 316 N ALA A 39 -7.380 11.235 1.806 1.00 0.41 N ATOM 317 CA ALA A 39 -8.453 11.691 0.901 1.00 0.36 C ATOM 318 C ALA A 39 -9.080 10.474 0.213 1.00 0.25 C ATOM 319 O ALA A 39 -10.163 10.551 -0.333 1.00 0.25 O ATOM 320 CB ALA A 39 -7.871 12.636 -0.154 1.00 0.41 C ATOM 0 H ALA A 39 -6.432 11.353 1.450 1.00 0.41 H new ATOM 0 HA ALA A 39 -9.214 12.221 1.473 1.00 0.36 H new ATOM 0 HB1 ALA A 39 -8.666 12.971 -0.821 1.00 0.41 H new ATOM 0 HB2 ALA A 39 -7.423 13.499 0.338 1.00 0.41 H new ATOM 0 HB3 ALA A 39 -7.110 12.112 -0.732 1.00 0.41 H new ATOM 326 N LEU A 40 -8.413 9.348 0.236 1.00 0.20 N ATOM 327 CA LEU A 40 -8.984 8.137 -0.415 1.00 0.19 C ATOM 328 C LEU A 40 -9.862 7.378 0.581 1.00 0.42 C ATOM 329 O LEU A 40 -10.636 6.519 0.209 1.00 0.68 O ATOM 330 CB LEU A 40 -7.863 7.213 -0.892 1.00 0.23 C ATOM 331 CG LEU A 40 -6.975 7.947 -1.896 1.00 0.23 C ATOM 332 CD1 LEU A 40 -5.862 7.013 -2.367 1.00 0.40 C ATOM 333 CD2 LEU A 40 -7.814 8.387 -3.094 1.00 0.17 C ATOM 0 H LEU A 40 -7.502 9.218 0.676 1.00 0.20 H new ATOM 0 HA LEU A 40 -9.581 8.453 -1.270 1.00 0.19 H new ATOM 0 HB2 LEU A 40 -7.267 6.881 -0.042 1.00 0.23 H new ATOM 0 HB3 LEU A 40 -8.287 6.321 -1.353 1.00 0.23 H new ATOM 0 HG LEU A 40 -6.537 8.824 -1.420 1.00 0.23 H new ATOM 0 HD11 LEU A 40 -5.228 7.535 -3.083 1.00 0.40 H new ATOM 0 HD12 LEU A 40 -5.263 6.701 -1.512 1.00 0.40 H new ATOM 0 HD13 LEU A 40 -6.300 6.136 -2.843 1.00 0.40 H new ATOM 0 HD21 LEU A 40 -7.180 8.910 -3.810 1.00 0.17 H new ATOM 0 HD22 LEU A 40 -8.254 7.511 -3.571 1.00 0.17 H new ATOM 0 HD23 LEU A 40 -8.608 9.054 -2.757 1.00 0.17 H new ATOM 345 N ARG A 41 -9.747 7.681 1.841 1.00 0.39 N ATOM 346 CA ARG A 41 -10.572 6.972 2.852 1.00 0.58 C ATOM 347 C ARG A 41 -11.369 7.990 3.676 1.00 0.44 C ATOM 348 O ARG A 41 -12.051 7.637 4.618 1.00 0.49 O ATOM 349 CB ARG A 41 -9.652 6.175 3.776 1.00 0.79 C ATOM 350 CG ARG A 41 -10.493 5.253 4.653 1.00 0.94 C ATOM 351 CD ARG A 41 -9.577 4.277 5.394 1.00 1.21 C ATOM 352 NE ARG A 41 -9.132 4.887 6.677 1.00 0.47 N ATOM 353 CZ ARG A 41 -9.758 4.602 7.787 1.00 1.19 C ATOM 354 NH1 ARG A 41 -11.049 4.412 7.778 1.00 2.49 N ATOM 355 NH2 ARG A 41 -9.093 4.509 8.906 1.00 0.78 N ATOM 0 H ARG A 41 -9.116 8.390 2.214 1.00 0.39 H new ATOM 0 HA ARG A 41 -11.266 6.298 2.350 1.00 0.58 H new ATOM 0 HB2 ARG A 41 -8.945 5.590 3.188 1.00 0.79 H new ATOM 0 HB3 ARG A 41 -9.066 6.852 4.398 1.00 0.79 H new ATOM 0 HG2 ARG A 41 -11.070 5.840 5.367 1.00 0.94 H new ATOM 0 HG3 ARG A 41 -11.208 4.704 4.041 1.00 0.94 H new ATOM 0 HD2 ARG A 41 -10.104 3.343 5.587 1.00 1.21 H new ATOM 0 HD3 ARG A 41 -8.713 4.033 4.776 1.00 1.21 H new ATOM 0 HE ARG A 41 -8.338 5.527 6.689 1.00 0.47 H new ATOM 0 HH11 ARG A 41 -11.569 4.486 6.904 1.00 2.49 H new ATOM 0 HH12 ARG A 41 -11.538 4.189 8.645 1.00 2.49 H new ATOM 0 HH21 ARG A 41 -8.084 4.659 8.914 1.00 0.78 H new ATOM 0 HH22 ARG A 41 -9.582 4.286 9.773 1.00 0.78 H new ATOM 369 N LYS A 42 -11.300 9.248 3.328 1.00 0.28 N ATOM 370 CA LYS A 42 -12.062 10.269 4.088 1.00 0.19 C ATOM 371 C LYS A 42 -13.492 10.295 3.567 1.00 0.36 C ATOM 372 O LYS A 42 -14.441 10.365 4.316 1.00 0.45 O ATOM 373 CB LYS A 42 -11.426 11.642 3.870 1.00 0.14 C ATOM 374 CG LYS A 42 -10.695 12.079 5.141 1.00 1.36 C ATOM 375 CD LYS A 42 -10.895 13.581 5.356 1.00 0.99 C ATOM 376 CE LYS A 42 -10.427 13.964 6.761 1.00 1.77 C ATOM 377 NZ LYS A 42 -11.601 14.377 7.582 1.00 1.77 N ATOM 0 H LYS A 42 -10.748 9.608 2.550 1.00 0.28 H new ATOM 0 HA LYS A 42 -12.052 10.027 5.151 1.00 0.19 H new ATOM 0 HB2 LYS A 42 -10.729 11.602 3.033 1.00 0.14 H new ATOM 0 HB3 LYS A 42 -12.193 12.372 3.611 1.00 0.14 H new ATOM 0 HG2 LYS A 42 -11.074 11.525 6.000 1.00 1.36 H new ATOM 0 HG3 LYS A 42 -9.632 11.851 5.058 1.00 1.36 H new ATOM 0 HD2 LYS A 42 -10.335 14.143 4.609 1.00 0.99 H new ATOM 0 HD3 LYS A 42 -11.946 13.840 5.228 1.00 0.99 H new ATOM 0 HE2 LYS A 42 -9.921 13.120 7.230 1.00 1.77 H new ATOM 0 HE3 LYS A 42 -9.704 14.778 6.706 1.00 1.77 H new ATOM 0 HZ1 LYS A 42 -11.282 14.637 8.537 1.00 1.77 H new ATOM 0 HZ2 LYS A 42 -12.065 15.194 7.137 1.00 1.77 H new ATOM 0 HZ3 LYS A 42 -12.275 13.588 7.645 1.00 1.77 H new ATOM 391 N GLU A 43 -13.658 10.226 2.285 1.00 0.42 N ATOM 392 CA GLU A 43 -15.022 10.241 1.726 1.00 0.61 C ATOM 393 C GLU A 43 -15.592 8.832 1.802 1.00 0.74 C ATOM 394 O GLU A 43 -16.615 8.591 2.428 1.00 0.81 O ATOM 395 CB GLU A 43 -14.965 10.699 0.266 1.00 0.62 C ATOM 396 CG GLU A 43 -16.098 11.691 -0.004 1.00 0.90 C ATOM 397 CD GLU A 43 -16.526 11.591 -1.470 1.00 0.89 C ATOM 398 OE1 GLU A 43 -16.424 10.508 -2.024 1.00 1.19 O ATOM 399 OE2 GLU A 43 -16.947 12.598 -2.013 1.00 1.51 O ATOM 0 H GLU A 43 -12.905 10.160 1.600 1.00 0.42 H new ATOM 0 HA GLU A 43 -15.655 10.926 2.290 1.00 0.61 H new ATOM 0 HB2 GLU A 43 -14.002 11.165 0.058 1.00 0.62 H new ATOM 0 HB3 GLU A 43 -15.054 9.840 -0.399 1.00 0.62 H new ATOM 0 HG2 GLU A 43 -16.945 11.478 0.648 1.00 0.90 H new ATOM 0 HG3 GLU A 43 -15.769 12.705 0.221 1.00 0.90 H new ATOM 406 N THR A 44 -14.933 7.905 1.157 1.00 0.88 N ATOM 407 CA THR A 44 -15.416 6.502 1.148 1.00 1.05 C ATOM 408 C THR A 44 -14.962 5.743 2.397 1.00 0.86 C ATOM 409 O THR A 44 -14.359 4.705 2.298 1.00 0.86 O ATOM 410 CB THR A 44 -14.898 5.794 -0.114 1.00 1.38 C ATOM 411 OG1 THR A 44 -15.582 4.559 -0.274 1.00 1.74 O ATOM 412 CG2 THR A 44 -13.391 5.529 -0.010 1.00 1.20 C ATOM 0 H THR A 44 -14.073 8.067 0.633 1.00 0.88 H new ATOM 0 HA THR A 44 -16.506 6.515 1.147 1.00 1.05 H new ATOM 0 HB THR A 44 -15.080 6.438 -0.974 1.00 1.38 H new ATOM 0 HG1 THR A 44 -15.416 3.990 0.506 1.00 1.74 H new ATOM 0 HG21 THR A 44 -13.047 5.027 -0.914 1.00 1.20 H new ATOM 0 HG22 THR A 44 -12.862 6.475 0.104 1.00 1.20 H new ATOM 0 HG23 THR A 44 -13.192 4.896 0.855 1.00 1.20 H new ATOM 420 N CYS A 45 -15.290 6.220 3.563 1.00 0.75 N ATOM 421 CA CYS A 45 -14.921 5.498 4.810 1.00 0.61 C ATOM 422 C CYS A 45 -15.231 6.403 5.996 1.00 0.36 C ATOM 423 O CYS A 45 -15.723 5.940 7.008 1.00 0.51 O ATOM 424 CB CYS A 45 -13.456 5.046 4.795 1.00 1.10 C ATOM 425 SG CYS A 45 -13.396 3.235 5.025 1.00 2.14 S ATOM 0 H CYS A 45 -15.804 7.089 3.707 1.00 0.75 H new ATOM 0 HA CYS A 45 -15.508 4.583 4.891 1.00 0.61 H new ATOM 0 HB2 CYS A 45 -12.985 5.322 3.851 1.00 1.10 H new ATOM 0 HB3 CYS A 45 -12.899 5.546 5.587 1.00 1.10 H new ATOM 0 HG CYS A 45 -13.972 2.650 4.017 1.00 2.14 H new ATOM 430 N ASN A 46 -15.049 7.696 5.868 1.00 0.57 N ATOM 431 CA ASN A 46 -15.465 8.575 6.990 1.00 1.11 C ATOM 432 C ASN A 46 -16.988 8.594 6.904 1.00 1.29 C ATOM 433 O ASN A 46 -17.688 8.523 7.895 1.00 1.67 O ATOM 434 CB ASN A 46 -14.894 9.985 6.842 1.00 1.36 C ATOM 435 CG ASN A 46 -14.756 10.628 8.224 1.00 1.72 C ATOM 436 OD1 ASN A 46 -14.584 9.943 9.211 1.00 2.22 O ATOM 437 ND2 ASN A 46 -14.822 11.926 8.335 1.00 1.84 N ATOM 0 H ASN A 46 -14.642 8.164 5.058 1.00 0.57 H new ATOM 0 HA ASN A 46 -15.101 8.212 7.951 1.00 1.11 H new ATOM 0 HB2 ASN A 46 -13.923 9.945 6.349 1.00 1.36 H new ATOM 0 HB3 ASN A 46 -15.547 10.589 6.212 1.00 1.36 H new ATOM 0 HD21 ASN A 46 -14.729 12.365 9.251 1.00 1.84 H new ATOM 0 HD22 ASN A 46 -14.967 12.502 7.506 1.00 1.84 H new ATOM 444 N LYS A 47 -17.504 8.606 5.689 1.00 1.09 N ATOM 445 CA LYS A 47 -18.976 8.532 5.496 1.00 1.39 C ATOM 446 C LYS A 47 -19.353 7.065 5.324 1.00 1.51 C ATOM 447 O LYS A 47 -20.415 6.739 4.830 1.00 1.66 O ATOM 448 CB LYS A 47 -19.388 9.324 4.251 1.00 1.24 C ATOM 449 CG LYS A 47 -18.746 10.713 4.282 1.00 2.34 C ATOM 450 CD LYS A 47 -18.635 11.257 2.856 1.00 2.73 C ATOM 451 CE LYS A 47 -18.311 12.751 2.902 1.00 4.13 C ATOM 452 NZ LYS A 47 -18.775 13.404 1.644 1.00 4.40 N ATOM 0 H LYS A 47 -16.959 8.664 4.829 1.00 1.09 H new ATOM 0 HA LYS A 47 -19.489 8.960 6.357 1.00 1.39 H new ATOM 0 HB2 LYS A 47 -19.079 8.791 3.352 1.00 1.24 H new ATOM 0 HB3 LYS A 47 -20.473 9.416 4.210 1.00 1.24 H new ATOM 0 HG2 LYS A 47 -19.344 11.388 4.894 1.00 2.34 H new ATOM 0 HG3 LYS A 47 -17.758 10.658 4.740 1.00 2.34 H new ATOM 0 HD2 LYS A 47 -17.857 10.722 2.311 1.00 2.73 H new ATOM 0 HD3 LYS A 47 -19.570 11.093 2.320 1.00 2.73 H new ATOM 0 HE2 LYS A 47 -18.796 13.212 3.763 1.00 4.13 H new ATOM 0 HE3 LYS A 47 -17.238 12.897 3.025 1.00 4.13 H new ATOM 0 HZ1 LYS A 47 -18.194 14.245 1.455 1.00 4.40 H new ATOM 0 HZ2 LYS A 47 -18.685 12.736 0.852 1.00 4.40 H new ATOM 0 HZ3 LYS A 47 -19.771 13.687 1.746 1.00 4.40 H new ATOM 466 N SER A 48 -18.491 6.172 5.730 1.00 1.54 N ATOM 467 CA SER A 48 -18.799 4.737 5.591 1.00 1.80 C ATOM 468 C SER A 48 -17.921 3.919 6.542 1.00 2.16 C ATOM 469 O SER A 48 -16.827 3.529 6.200 1.00 2.64 O ATOM 470 CB SER A 48 -18.551 4.302 4.157 1.00 1.47 C ATOM 471 OG SER A 48 -17.347 4.876 3.683 1.00 1.59 O ATOM 0 H SER A 48 -17.587 6.384 6.152 1.00 1.54 H new ATOM 0 HA SER A 48 -19.846 4.568 5.844 1.00 1.80 H new ATOM 0 HB2 SER A 48 -18.493 3.215 4.102 1.00 1.47 H new ATOM 0 HB3 SER A 48 -19.384 4.609 3.525 1.00 1.47 H new ATOM 0 HG SER A 48 -17.553 5.567 3.019 1.00 1.59 H new ATOM 477 N ASN A 49 -18.409 3.674 7.734 1.00 2.52 N ATOM 478 CA ASN A 49 -17.640 2.883 8.766 1.00 3.47 C ATOM 479 C ASN A 49 -16.748 1.804 8.125 1.00 3.02 C ATOM 480 O ASN A 49 -15.673 1.511 8.609 1.00 4.22 O ATOM 481 CB ASN A 49 -18.633 2.208 9.712 1.00 4.60 C ATOM 482 CG ASN A 49 -19.193 3.244 10.689 1.00 5.30 C ATOM 483 OD1 ASN A 49 -19.509 4.352 10.302 1.00 4.89 O ATOM 484 ND2 ASN A 49 -19.326 2.928 11.947 1.00 6.52 N ATOM 0 H ASN A 49 -19.326 3.992 8.048 1.00 2.52 H new ATOM 0 HA ASN A 49 -16.992 3.575 9.304 1.00 3.47 H new ATOM 0 HB2 ASN A 49 -19.444 1.755 9.142 1.00 4.60 H new ATOM 0 HB3 ASN A 49 -18.141 1.405 10.260 1.00 4.60 H new ATOM 0 HD21 ASN A 49 -19.696 3.611 12.608 1.00 6.52 H new ATOM 0 HD22 ASN A 49 -19.060 1.998 12.270 1.00 6.52 H new ATOM 491 N MET A 50 -17.171 1.228 7.032 1.00 1.45 N ATOM 492 CA MET A 50 -16.332 0.193 6.355 1.00 1.29 C ATOM 493 C MET A 50 -15.615 0.860 5.188 1.00 1.96 C ATOM 494 O MET A 50 -14.450 0.620 4.940 1.00 2.25 O ATOM 495 CB MET A 50 -17.224 -0.928 5.803 1.00 0.41 C ATOM 496 CG MET A 50 -16.933 -2.238 6.540 1.00 1.63 C ATOM 497 SD MET A 50 -16.660 -3.567 5.338 1.00 2.06 S ATOM 498 CE MET A 50 -18.281 -3.502 4.527 1.00 0.91 C ATOM 0 H MET A 50 -18.062 1.429 6.577 1.00 1.45 H new ATOM 0 HA MET A 50 -15.622 -0.230 7.066 1.00 1.29 H new ATOM 0 HB2 MET A 50 -18.274 -0.660 5.921 1.00 0.41 H new ATOM 0 HB3 MET A 50 -17.045 -1.054 4.735 1.00 0.41 H new ATOM 0 HG2 MET A 50 -16.054 -2.122 7.174 1.00 1.63 H new ATOM 0 HG3 MET A 50 -17.767 -2.492 7.194 1.00 1.63 H new ATOM 0 HE1 MET A 50 -18.331 -4.266 3.751 1.00 0.91 H new ATOM 0 HE2 MET A 50 -19.064 -3.681 5.264 1.00 0.91 H new ATOM 0 HE3 MET A 50 -18.424 -2.519 4.078 1.00 0.91 H new ATOM 660 N ASN A 62 -10.395 -8.446 6.039 1.00 0.60 N ATOM 661 CA ASN A 62 -8.907 -8.490 6.054 1.00 0.71 C ATOM 662 C ASN A 62 -8.396 -8.994 4.708 1.00 0.63 C ATOM 663 O ASN A 62 -8.345 -10.180 4.450 1.00 0.53 O ATOM 664 CB ASN A 62 -8.418 -9.423 7.166 1.00 0.78 C ATOM 665 CG ASN A 62 -7.862 -8.592 8.324 1.00 1.32 C ATOM 666 OD1 ASN A 62 -8.470 -7.628 8.741 1.00 1.64 O ATOM 667 ND2 ASN A 62 -6.722 -8.930 8.863 1.00 2.07 N ATOM 0 HA ASN A 62 -8.526 -7.485 6.238 1.00 0.71 H new ATOM 0 HB2 ASN A 62 -9.238 -10.050 7.516 1.00 0.78 H new ATOM 0 HB3 ASN A 62 -7.647 -10.091 6.782 1.00 0.78 H new ATOM 0 HD21 ASN A 62 -6.341 -8.384 9.636 1.00 2.07 H new ATOM 0 HD22 ASN A 62 -6.212 -9.740 8.512 1.00 2.07 H new ATOM 674 N LEU A 63 -8.007 -8.094 3.853 1.00 1.00 N ATOM 675 CA LEU A 63 -7.487 -8.500 2.525 1.00 0.97 C ATOM 676 C LEU A 63 -6.267 -9.399 2.729 1.00 1.00 C ATOM 677 O LEU A 63 -6.024 -9.884 3.817 1.00 1.14 O ATOM 678 CB LEU A 63 -7.088 -7.244 1.753 1.00 1.01 C ATOM 679 CG LEU A 63 -8.182 -6.905 0.742 1.00 0.58 C ATOM 680 CD1 LEU A 63 -7.936 -5.508 0.173 1.00 0.63 C ATOM 681 CD2 LEU A 63 -8.159 -7.930 -0.394 1.00 0.74 C ATOM 0 H LEU A 63 -8.028 -7.088 4.020 1.00 1.00 H new ATOM 0 HA LEU A 63 -8.246 -9.045 1.964 1.00 0.97 H new ATOM 0 HB2 LEU A 63 -6.942 -6.411 2.441 1.00 1.01 H new ATOM 0 HB3 LEU A 63 -6.140 -7.404 1.240 1.00 1.01 H new ATOM 0 HG LEU A 63 -9.154 -6.929 1.235 1.00 0.58 H new ATOM 0 HD11 LEU A 63 -8.717 -5.266 -0.548 1.00 0.63 H new ATOM 0 HD12 LEU A 63 -7.951 -4.778 0.982 1.00 0.63 H new ATOM 0 HD13 LEU A 63 -6.965 -5.482 -0.321 1.00 0.63 H new ATOM 0 HD21 LEU A 63 -8.939 -7.690 -1.117 1.00 0.74 H new ATOM 0 HD22 LEU A 63 -7.187 -7.905 -0.887 1.00 0.74 H new ATOM 0 HD23 LEU A 63 -8.334 -8.926 0.011 1.00 0.74 H new ATOM 693 N ASN A 64 -5.490 -9.625 1.706 1.00 0.90 N ATOM 694 CA ASN A 64 -4.291 -10.491 1.878 1.00 0.96 C ATOM 695 C ASN A 64 -3.062 -9.744 1.376 1.00 0.91 C ATOM 696 O ASN A 64 -2.102 -10.331 0.918 1.00 1.08 O ATOM 697 CB ASN A 64 -4.472 -11.788 1.086 1.00 0.97 C ATOM 698 CG ASN A 64 -5.841 -12.391 1.399 1.00 1.65 C ATOM 699 OD1 ASN A 64 -6.351 -12.238 2.490 1.00 2.59 O ATOM 700 ND2 ASN A 64 -6.463 -13.077 0.479 1.00 1.76 N ATOM 0 H ASN A 64 -5.631 -9.252 0.767 1.00 0.90 H new ATOM 0 HA ASN A 64 -4.163 -10.737 2.932 1.00 0.96 H new ATOM 0 HB2 ASN A 64 -4.386 -11.589 0.018 1.00 0.97 H new ATOM 0 HB3 ASN A 64 -3.684 -12.496 1.343 1.00 0.97 H new ATOM 0 HD21 ASN A 64 -7.377 -13.484 0.677 1.00 1.76 H new ATOM 0 HD22 ASN A 64 -6.035 -13.206 -0.438 1.00 1.76 H new ATOM 707 N LEU A 65 -3.093 -8.450 1.464 1.00 0.78 N ATOM 708 CA LEU A 65 -1.941 -7.639 1.001 1.00 0.75 C ATOM 709 C LEU A 65 -0.888 -7.382 2.117 1.00 0.87 C ATOM 710 O LEU A 65 0.236 -7.058 1.790 1.00 1.24 O ATOM 711 CB LEU A 65 -2.467 -6.299 0.470 1.00 0.67 C ATOM 712 CG LEU A 65 -2.950 -5.412 1.618 1.00 0.82 C ATOM 713 CD1 LEU A 65 -2.353 -4.015 1.459 1.00 0.81 C ATOM 714 CD2 LEU A 65 -4.474 -5.313 1.578 1.00 0.88 C ATOM 0 H LEU A 65 -3.875 -7.914 1.841 1.00 0.78 H new ATOM 0 HA LEU A 65 -1.434 -8.202 0.218 1.00 0.75 H new ATOM 0 HB2 LEU A 65 -1.680 -5.788 -0.084 1.00 0.67 H new ATOM 0 HB3 LEU A 65 -3.285 -6.475 -0.228 1.00 0.67 H new ATOM 0 HG LEU A 65 -2.636 -5.843 2.569 1.00 0.82 H new ATOM 0 HD11 LEU A 65 -2.694 -3.378 2.275 1.00 0.81 H new ATOM 0 HD12 LEU A 65 -1.265 -4.080 1.480 1.00 0.81 H new ATOM 0 HD13 LEU A 65 -2.673 -3.589 0.508 1.00 0.81 H new ATOM 0 HD21 LEU A 65 -4.819 -4.681 2.396 1.00 0.88 H new ATOM 0 HD22 LEU A 65 -4.786 -4.879 0.628 1.00 0.88 H new ATOM 0 HD23 LEU A 65 -4.906 -6.308 1.681 1.00 0.88 H new ATOM 726 N PRO A 66 -1.241 -7.498 3.397 1.00 1.44 N ATOM 727 CA PRO A 66 -0.268 -7.231 4.474 1.00 1.59 C ATOM 728 C PRO A 66 0.676 -8.420 4.668 1.00 1.07 C ATOM 729 O PRO A 66 0.434 -9.508 4.185 1.00 1.48 O ATOM 730 CB PRO A 66 -1.138 -7.024 5.716 1.00 2.82 C ATOM 731 CG PRO A 66 -2.480 -7.734 5.432 1.00 3.31 C ATOM 732 CD PRO A 66 -2.580 -7.894 3.904 1.00 2.42 C ATOM 0 HA PRO A 66 0.369 -6.374 4.257 1.00 1.59 H new ATOM 0 HB2 PRO A 66 -0.657 -7.442 6.601 1.00 2.82 H new ATOM 0 HB3 PRO A 66 -1.293 -5.962 5.909 1.00 2.82 H new ATOM 0 HG2 PRO A 66 -2.517 -8.705 5.926 1.00 3.31 H new ATOM 0 HG3 PRO A 66 -3.316 -7.149 5.816 1.00 3.31 H new ATOM 0 HD2 PRO A 66 -2.821 -8.921 3.628 1.00 2.42 H new ATOM 0 HD3 PRO A 66 -3.364 -7.260 3.490 1.00 2.42 H new ATOM 740 N LYS A 67 1.748 -8.210 5.378 1.00 1.00 N ATOM 741 CA LYS A 67 2.721 -9.311 5.622 1.00 1.48 C ATOM 742 C LYS A 67 3.852 -8.776 6.497 1.00 1.38 C ATOM 743 O LYS A 67 5.016 -9.043 6.270 1.00 1.71 O ATOM 744 CB LYS A 67 3.284 -9.809 4.289 1.00 1.86 C ATOM 745 CG LYS A 67 2.564 -11.095 3.878 1.00 2.17 C ATOM 746 CD LYS A 67 3.532 -12.276 3.963 1.00 3.26 C ATOM 747 CE LYS A 67 3.429 -13.116 2.687 1.00 3.28 C ATOM 748 NZ LYS A 67 4.794 -13.364 2.139 1.00 4.17 N ATOM 0 H LYS A 67 1.994 -7.316 5.803 1.00 1.00 H new ATOM 0 HA LYS A 67 2.226 -10.142 6.124 1.00 1.48 H new ATOM 0 HB2 LYS A 67 3.156 -9.047 3.521 1.00 1.86 H new ATOM 0 HB3 LYS A 67 4.355 -9.993 4.380 1.00 1.86 H new ATOM 0 HG2 LYS A 67 1.707 -11.267 4.529 1.00 2.17 H new ATOM 0 HG3 LYS A 67 2.179 -11.000 2.863 1.00 2.17 H new ATOM 0 HD2 LYS A 67 4.552 -11.915 4.091 1.00 3.26 H new ATOM 0 HD3 LYS A 67 3.299 -12.889 4.834 1.00 3.26 H new ATOM 0 HE2 LYS A 67 2.935 -14.063 2.902 1.00 3.28 H new ATOM 0 HE3 LYS A 67 2.818 -12.599 1.947 1.00 3.28 H new ATOM 0 HZ1 LYS A 67 4.722 -13.935 1.273 1.00 4.17 H new ATOM 0 HZ2 LYS A 67 5.250 -12.456 1.918 1.00 4.17 H new ATOM 0 HZ3 LYS A 67 5.363 -13.875 2.844 1.00 4.17 H new ATOM 762 N MET A 68 3.508 -8.016 7.496 1.00 0.99 N ATOM 763 CA MET A 68 4.540 -7.444 8.403 1.00 0.90 C ATOM 764 C MET A 68 4.388 -8.057 9.796 1.00 1.02 C ATOM 765 O MET A 68 3.328 -8.524 10.165 1.00 1.20 O ATOM 766 CB MET A 68 4.344 -5.929 8.492 1.00 0.89 C ATOM 767 CG MET A 68 5.658 -5.217 8.164 1.00 0.73 C ATOM 768 SD MET A 68 5.427 -3.430 8.335 1.00 1.19 S ATOM 769 CE MET A 68 6.925 -2.919 7.458 1.00 0.42 C ATOM 0 H MET A 68 2.547 -7.764 7.726 1.00 0.99 H new ATOM 0 HA MET A 68 5.534 -7.665 8.015 1.00 0.90 H new ATOM 0 HB2 MET A 68 3.565 -5.612 7.798 1.00 0.89 H new ATOM 0 HB3 MET A 68 4.011 -5.654 9.493 1.00 0.89 H new ATOM 0 HG2 MET A 68 6.447 -5.559 8.833 1.00 0.73 H new ATOM 0 HG3 MET A 68 5.973 -5.459 7.149 1.00 0.73 H new ATOM 0 HE1 MET A 68 7.642 -2.511 8.170 1.00 0.42 H new ATOM 0 HE2 MET A 68 7.363 -3.780 6.954 1.00 0.42 H new ATOM 0 HE3 MET A 68 6.673 -2.157 6.721 1.00 0.42 H new ATOM 779 N ALA A 69 5.434 -8.059 10.575 1.00 0.94 N ATOM 780 CA ALA A 69 5.337 -8.642 11.943 1.00 1.08 C ATOM 781 C ALA A 69 6.482 -8.111 12.808 1.00 0.96 C ATOM 782 O ALA A 69 7.224 -7.239 12.404 1.00 0.82 O ATOM 783 CB ALA A 69 5.431 -10.165 11.857 1.00 1.40 C ATOM 0 H ALA A 69 6.349 -7.684 10.325 1.00 0.94 H new ATOM 0 HA ALA A 69 4.383 -8.360 12.389 1.00 1.08 H new ATOM 0 HB1 ALA A 69 5.360 -10.591 12.858 1.00 1.40 H new ATOM 0 HB2 ALA A 69 4.616 -10.546 11.242 1.00 1.40 H new ATOM 0 HB3 ALA A 69 6.385 -10.446 11.410 1.00 1.40 H new ATOM 789 N GLU A 70 6.626 -8.630 13.995 1.00 1.22 N ATOM 790 CA GLU A 70 7.719 -8.157 14.890 1.00 1.23 C ATOM 791 C GLU A 70 8.966 -9.024 14.701 1.00 1.49 C ATOM 792 O GLU A 70 10.043 -8.677 15.143 1.00 1.72 O ATOM 793 CB GLU A 70 7.255 -8.241 16.345 1.00 1.49 C ATOM 794 CG GLU A 70 5.942 -7.475 16.508 1.00 1.88 C ATOM 795 CD GLU A 70 5.562 -7.422 17.989 1.00 2.26 C ATOM 796 OE1 GLU A 70 5.403 -8.479 18.577 1.00 1.92 O ATOM 797 OE2 GLU A 70 5.436 -6.326 18.510 1.00 3.06 O ATOM 0 H GLU A 70 6.033 -9.363 14.385 1.00 1.22 H new ATOM 0 HA GLU A 70 7.963 -7.125 14.640 1.00 1.23 H new ATOM 0 HB2 GLU A 70 7.119 -9.283 16.634 1.00 1.49 H new ATOM 0 HB3 GLU A 70 8.016 -7.824 17.005 1.00 1.49 H new ATOM 0 HG2 GLU A 70 6.047 -6.465 16.112 1.00 1.88 H new ATOM 0 HG3 GLU A 70 5.152 -7.961 15.936 1.00 1.88 H new ATOM 804 N LYS A 71 8.834 -10.145 14.051 1.00 1.48 N ATOM 805 CA LYS A 71 10.017 -11.022 13.841 1.00 1.75 C ATOM 806 C LYS A 71 10.740 -10.611 12.555 1.00 1.61 C ATOM 807 O LYS A 71 11.900 -10.914 12.362 1.00 1.68 O ATOM 808 CB LYS A 71 9.550 -12.470 13.730 1.00 2.01 C ATOM 809 CG LYS A 71 8.535 -12.593 12.591 1.00 0.86 C ATOM 810 CD LYS A 71 9.070 -13.555 11.528 1.00 1.03 C ATOM 811 CE LYS A 71 9.627 -12.754 10.351 1.00 3.09 C ATOM 812 NZ LYS A 71 9.291 -13.447 9.075 1.00 3.67 N ATOM 0 H LYS A 71 7.959 -10.491 13.657 1.00 1.48 H new ATOM 0 HA LYS A 71 10.703 -10.922 14.682 1.00 1.75 H new ATOM 0 HB2 LYS A 71 10.402 -13.125 13.545 1.00 2.01 H new ATOM 0 HB3 LYS A 71 9.099 -12.791 14.669 1.00 2.01 H new ATOM 0 HG2 LYS A 71 7.582 -12.955 12.977 1.00 0.86 H new ATOM 0 HG3 LYS A 71 8.349 -11.614 12.149 1.00 0.86 H new ATOM 0 HD2 LYS A 71 9.850 -14.187 11.953 1.00 1.03 H new ATOM 0 HD3 LYS A 71 8.274 -14.217 11.187 1.00 1.03 H new ATOM 0 HE2 LYS A 71 9.209 -11.748 10.352 1.00 3.09 H new ATOM 0 HE3 LYS A 71 10.708 -12.650 10.447 1.00 3.09 H new ATOM 0 HZ1 LYS A 71 9.670 -12.902 8.274 1.00 3.67 H new ATOM 0 HZ2 LYS A 71 9.710 -14.399 9.076 1.00 3.67 H new ATOM 0 HZ3 LYS A 71 8.258 -13.524 8.983 1.00 3.67 H new ATOM 826 N ASP A 72 10.064 -9.923 11.675 1.00 1.44 N ATOM 827 CA ASP A 72 10.714 -9.493 10.406 1.00 1.35 C ATOM 828 C ASP A 72 11.856 -8.525 10.719 1.00 1.54 C ATOM 829 O ASP A 72 12.884 -8.532 10.070 1.00 1.76 O ATOM 830 CB ASP A 72 9.681 -8.796 9.517 1.00 0.95 C ATOM 831 CG ASP A 72 9.797 -9.331 8.088 1.00 0.77 C ATOM 832 OD1 ASP A 72 9.185 -10.347 7.806 1.00 1.03 O ATOM 833 OD2 ASP A 72 10.496 -8.714 7.302 1.00 1.70 O ATOM 0 H ASP A 72 9.090 -9.641 11.781 1.00 1.44 H new ATOM 0 HA ASP A 72 11.112 -10.365 9.887 1.00 1.35 H new ATOM 0 HB2 ASP A 72 8.676 -8.971 9.902 1.00 0.95 H new ATOM 0 HB3 ASP A 72 9.844 -7.718 9.528 1.00 0.95 H new ATOM 838 N GLY A 73 11.689 -7.694 11.710 1.00 1.51 N ATOM 839 CA GLY A 73 12.769 -6.730 12.062 1.00 1.74 C ATOM 840 C GLY A 73 12.440 -5.360 11.469 1.00 1.15 C ATOM 841 O GLY A 73 13.318 -4.590 11.133 1.00 1.14 O ATOM 0 H GLY A 73 10.852 -7.641 12.291 1.00 1.51 H new ATOM 0 HA2 GLY A 73 12.866 -6.656 13.145 1.00 1.74 H new ATOM 0 HA3 GLY A 73 13.726 -7.084 11.679 1.00 1.74 H new ATOM 845 N CYS A 74 11.180 -5.045 11.338 1.00 0.72 N ATOM 846 CA CYS A 74 10.806 -3.721 10.770 1.00 0.27 C ATOM 847 C CYS A 74 10.635 -2.707 11.903 1.00 0.60 C ATOM 848 O CYS A 74 10.730 -1.515 11.697 1.00 1.38 O ATOM 849 CB CYS A 74 9.491 -3.843 9.995 1.00 0.67 C ATOM 850 SG CYS A 74 9.829 -4.357 8.293 1.00 1.30 S ATOM 0 H CYS A 74 10.397 -5.645 11.599 1.00 0.72 H new ATOM 0 HA CYS A 74 11.594 -3.385 10.095 1.00 0.27 H new ATOM 0 HB2 CYS A 74 8.838 -4.568 10.481 1.00 0.67 H new ATOM 0 HB3 CYS A 74 8.966 -2.888 9.999 1.00 0.67 H new ATOM 855 N PHE A 75 10.383 -3.171 13.095 1.00 0.49 N ATOM 856 CA PHE A 75 10.208 -2.230 14.235 1.00 0.96 C ATOM 857 C PHE A 75 11.477 -2.226 15.089 1.00 1.17 C ATOM 858 O PHE A 75 12.487 -2.791 14.716 1.00 1.14 O ATOM 859 CB PHE A 75 9.017 -2.678 15.085 1.00 1.18 C ATOM 860 CG PHE A 75 7.792 -2.794 14.209 1.00 0.82 C ATOM 861 CD1 PHE A 75 7.556 -3.974 13.493 1.00 1.13 C ATOM 862 CD2 PHE A 75 6.896 -1.723 14.110 1.00 2.33 C ATOM 863 CE1 PHE A 75 6.423 -4.083 12.677 1.00 1.48 C ATOM 864 CE2 PHE A 75 5.762 -1.832 13.294 1.00 2.01 C ATOM 865 CZ PHE A 75 5.527 -3.011 12.578 1.00 0.48 C ATOM 0 H PHE A 75 10.291 -4.160 13.329 1.00 0.49 H new ATOM 0 HA PHE A 75 10.024 -1.225 13.856 1.00 0.96 H new ATOM 0 HB2 PHE A 75 9.233 -3.637 15.557 1.00 1.18 H new ATOM 0 HB3 PHE A 75 8.838 -1.961 15.887 1.00 1.18 H new ATOM 0 HD1 PHE A 75 8.248 -4.800 13.570 1.00 1.13 H new ATOM 0 HD2 PHE A 75 7.079 -0.813 14.662 1.00 2.33 H new ATOM 0 HE1 PHE A 75 6.240 -4.993 12.125 1.00 1.48 H new ATOM 0 HE2 PHE A 75 5.070 -1.006 13.218 1.00 2.01 H new ATOM 0 HZ PHE A 75 4.654 -3.095 11.948 1.00 0.48 H new ATOM 875 N GLN A 76 11.437 -1.595 16.230 1.00 1.48 N ATOM 876 CA GLN A 76 12.645 -1.557 17.101 1.00 1.69 C ATOM 877 C GLN A 76 12.995 -2.977 17.556 1.00 1.61 C ATOM 878 O GLN A 76 14.148 -3.322 17.708 1.00 1.69 O ATOM 879 CB GLN A 76 12.367 -0.680 18.325 1.00 1.92 C ATOM 880 CG GLN A 76 13.652 0.038 18.741 1.00 2.34 C ATOM 881 CD GLN A 76 13.381 1.538 18.877 1.00 3.29 C ATOM 882 OE1 GLN A 76 12.512 2.072 18.216 1.00 3.89 O ATOM 883 NE2 GLN A 76 14.092 2.247 19.710 1.00 3.73 N ATOM 0 H GLN A 76 10.621 -1.105 16.596 1.00 1.48 H new ATOM 0 HA GLN A 76 13.482 -1.141 16.540 1.00 1.69 H new ATOM 0 HB2 GLN A 76 11.589 0.048 18.095 1.00 1.92 H new ATOM 0 HB3 GLN A 76 11.997 -1.292 19.148 1.00 1.92 H new ATOM 0 HG2 GLN A 76 14.015 -0.363 19.687 1.00 2.34 H new ATOM 0 HG3 GLN A 76 14.433 -0.135 18.001 1.00 2.34 H new ATOM 0 HE21 GLN A 76 14.822 1.801 20.266 1.00 3.73 H new ATOM 0 HE22 GLN A 76 13.918 3.248 19.806 1.00 3.73 H new ATOM 892 N SER A 77 12.008 -3.805 17.772 1.00 1.46 N ATOM 893 CA SER A 77 12.293 -5.202 18.212 1.00 1.37 C ATOM 894 C SER A 77 13.133 -5.903 17.143 1.00 1.28 C ATOM 895 O SER A 77 12.647 -6.236 16.080 1.00 1.49 O ATOM 896 CB SER A 77 10.976 -5.954 18.401 1.00 1.31 C ATOM 897 OG SER A 77 10.317 -5.463 19.562 1.00 2.21 O ATOM 0 H SER A 77 11.020 -3.576 17.663 1.00 1.46 H new ATOM 0 HA SER A 77 12.839 -5.187 19.155 1.00 1.37 H new ATOM 0 HB2 SER A 77 10.340 -5.823 17.525 1.00 1.31 H new ATOM 0 HB3 SER A 77 11.165 -7.023 18.501 1.00 1.31 H new ATOM 0 HG SER A 77 9.471 -5.942 19.685 1.00 2.21 H new ATOM 903 N GLY A 78 14.394 -6.121 17.409 1.00 1.32 N ATOM 904 CA GLY A 78 15.260 -6.792 16.396 1.00 1.29 C ATOM 905 C GLY A 78 15.197 -6.002 15.088 1.00 1.13 C ATOM 906 O GLY A 78 15.027 -6.556 14.020 1.00 1.03 O ATOM 0 H GLY A 78 14.860 -5.865 18.280 1.00 1.32 H new ATOM 0 HA2 GLY A 78 16.288 -6.845 16.755 1.00 1.29 H new ATOM 0 HA3 GLY A 78 14.926 -7.817 16.234 1.00 1.29 H new ATOM 910 N PHE A 79 15.321 -4.706 15.169 1.00 1.12 N ATOM 911 CA PHE A 79 15.256 -3.867 13.941 1.00 0.98 C ATOM 912 C PHE A 79 16.301 -4.337 12.927 1.00 0.89 C ATOM 913 O PHE A 79 17.428 -3.882 12.926 1.00 1.34 O ATOM 914 CB PHE A 79 15.526 -2.407 14.310 1.00 1.01 C ATOM 915 CG PHE A 79 15.454 -1.550 13.070 1.00 0.86 C ATOM 916 CD1 PHE A 79 14.297 -1.554 12.280 1.00 0.64 C ATOM 917 CD2 PHE A 79 16.545 -0.752 12.708 1.00 1.00 C ATOM 918 CE1 PHE A 79 14.233 -0.759 11.130 1.00 0.52 C ATOM 919 CE2 PHE A 79 16.481 0.042 11.558 1.00 0.88 C ATOM 920 CZ PHE A 79 15.325 0.039 10.768 1.00 0.60 C ATOM 0 H PHE A 79 15.465 -4.190 16.037 1.00 1.12 H new ATOM 0 HA PHE A 79 14.264 -3.959 13.498 1.00 0.98 H new ATOM 0 HB2 PHE A 79 14.795 -2.066 15.043 1.00 1.01 H new ATOM 0 HB3 PHE A 79 16.509 -2.314 14.772 1.00 1.01 H new ATOM 0 HD1 PHE A 79 13.455 -2.170 12.558 1.00 0.64 H new ATOM 0 HD2 PHE A 79 17.437 -0.749 13.317 1.00 1.00 H new ATOM 0 HE1 PHE A 79 13.341 -0.761 10.521 1.00 0.52 H new ATOM 0 HE2 PHE A 79 17.324 0.658 11.279 1.00 0.88 H new ATOM 0 HZ PHE A 79 15.276 0.652 9.880 1.00 0.60 H new ATOM 930 N ASN A 80 15.934 -5.233 12.053 1.00 0.75 N ATOM 931 CA ASN A 80 16.902 -5.712 11.030 1.00 0.71 C ATOM 932 C ASN A 80 17.112 -4.598 9.999 1.00 0.67 C ATOM 933 O ASN A 80 16.980 -3.431 10.310 1.00 1.14 O ATOM 934 CB ASN A 80 16.343 -6.965 10.348 1.00 0.76 C ATOM 935 CG ASN A 80 17.421 -8.051 10.314 1.00 0.51 C ATOM 936 OD1 ASN A 80 18.155 -8.166 9.351 1.00 1.07 O ATOM 937 ND2 ASN A 80 17.549 -8.857 11.331 1.00 1.37 N ATOM 0 H ASN A 80 15.006 -5.653 12.004 1.00 0.75 H new ATOM 0 HA ASN A 80 17.855 -5.963 11.497 1.00 0.71 H new ATOM 0 HB2 ASN A 80 15.466 -7.325 10.886 1.00 0.76 H new ATOM 0 HB3 ASN A 80 16.019 -6.727 9.335 1.00 0.76 H new ATOM 0 HD21 ASN A 80 18.265 -9.584 11.319 1.00 1.37 H new ATOM 0 HD22 ASN A 80 16.934 -8.761 12.139 1.00 1.37 H new ATOM 944 N GLU A 81 17.436 -4.933 8.779 1.00 0.65 N ATOM 945 CA GLU A 81 17.644 -3.865 7.758 1.00 0.64 C ATOM 946 C GLU A 81 17.343 -4.408 6.361 1.00 0.66 C ATOM 947 O GLU A 81 16.546 -3.854 5.630 1.00 0.57 O ATOM 948 CB GLU A 81 19.094 -3.382 7.815 1.00 0.65 C ATOM 949 CG GLU A 81 19.299 -2.531 9.069 1.00 0.51 C ATOM 950 CD GLU A 81 20.689 -1.895 9.035 1.00 0.35 C ATOM 951 OE1 GLU A 81 21.228 -1.759 7.949 1.00 0.49 O ATOM 952 OE2 GLU A 81 21.190 -1.555 10.093 1.00 0.58 O ATOM 0 H GLU A 81 17.565 -5.889 8.447 1.00 0.65 H new ATOM 0 HA GLU A 81 16.971 -3.034 7.970 1.00 0.64 H new ATOM 0 HB2 GLU A 81 19.772 -4.235 7.827 1.00 0.65 H new ATOM 0 HB3 GLU A 81 19.330 -2.799 6.925 1.00 0.65 H new ATOM 0 HG2 GLU A 81 18.535 -1.756 9.124 1.00 0.51 H new ATOM 0 HG3 GLU A 81 19.192 -3.148 9.961 1.00 0.51 H new ATOM 959 N GLU A 82 17.981 -5.478 5.977 1.00 0.84 N ATOM 960 CA GLU A 82 17.737 -6.040 4.619 1.00 0.87 C ATOM 961 C GLU A 82 16.422 -6.824 4.601 1.00 0.81 C ATOM 962 O GLU A 82 15.832 -7.031 3.561 1.00 0.82 O ATOM 963 CB GLU A 82 18.884 -6.976 4.240 1.00 0.98 C ATOM 964 CG GLU A 82 18.901 -7.175 2.724 1.00 0.92 C ATOM 965 CD GLU A 82 19.320 -8.611 2.404 1.00 1.19 C ATOM 966 OE1 GLU A 82 18.926 -9.500 3.140 1.00 1.63 O ATOM 967 OE2 GLU A 82 20.029 -8.796 1.429 1.00 1.12 O ATOM 0 H GLU A 82 18.660 -5.987 6.543 1.00 0.84 H new ATOM 0 HA GLU A 82 17.676 -5.220 3.904 1.00 0.87 H new ATOM 0 HB2 GLU A 82 19.834 -6.558 4.573 1.00 0.98 H new ATOM 0 HB3 GLU A 82 18.765 -7.936 4.742 1.00 0.98 H new ATOM 0 HG2 GLU A 82 17.914 -6.971 2.308 1.00 0.92 H new ATOM 0 HG3 GLU A 82 19.593 -6.471 2.262 1.00 0.92 H new ATOM 974 N THR A 83 15.953 -7.263 5.737 1.00 0.75 N ATOM 975 CA THR A 83 14.680 -8.031 5.757 1.00 0.72 C ATOM 976 C THR A 83 13.513 -7.057 5.678 1.00 0.59 C ATOM 977 O THR A 83 12.538 -7.292 4.987 1.00 0.49 O ATOM 978 CB THR A 83 14.587 -8.846 7.049 1.00 0.73 C ATOM 979 OG1 THR A 83 15.840 -9.466 7.305 1.00 0.79 O ATOM 980 CG2 THR A 83 13.505 -9.917 6.898 1.00 0.75 C ATOM 0 H THR A 83 16.394 -7.123 6.646 1.00 0.75 H new ATOM 0 HA THR A 83 14.649 -8.712 4.907 1.00 0.72 H new ATOM 0 HB THR A 83 14.331 -8.188 7.880 1.00 0.73 H new ATOM 0 HG1 THR A 83 15.784 -9.987 8.133 1.00 0.79 H new ATOM 0 HG21 THR A 83 13.438 -10.498 7.818 1.00 0.75 H new ATOM 0 HG22 THR A 83 12.546 -9.439 6.700 1.00 0.75 H new ATOM 0 HG23 THR A 83 13.760 -10.577 6.069 1.00 0.75 H new ATOM 988 N CYS A 84 13.599 -5.959 6.374 1.00 0.59 N ATOM 989 CA CYS A 84 12.492 -4.976 6.326 1.00 0.47 C ATOM 990 C CYS A 84 12.477 -4.303 4.956 1.00 0.48 C ATOM 991 O CYS A 84 11.454 -4.218 4.306 1.00 0.40 O ATOM 992 CB CYS A 84 12.682 -3.916 7.410 1.00 0.47 C ATOM 993 SG CYS A 84 11.141 -2.986 7.600 1.00 0.52 S ATOM 0 H CYS A 84 14.386 -5.704 6.971 1.00 0.59 H new ATOM 0 HA CYS A 84 11.547 -5.492 6.497 1.00 0.47 H new ATOM 0 HB2 CYS A 84 12.956 -4.387 8.354 1.00 0.47 H new ATOM 0 HB3 CYS A 84 13.497 -3.244 7.141 1.00 0.47 H new ATOM 998 N LEU A 85 13.607 -3.827 4.511 1.00 0.57 N ATOM 999 CA LEU A 85 13.660 -3.160 3.181 1.00 0.61 C ATOM 1000 C LEU A 85 13.107 -4.111 2.118 1.00 0.54 C ATOM 1001 O LEU A 85 12.386 -3.708 1.227 1.00 0.50 O ATOM 1002 CB LEU A 85 15.110 -2.805 2.845 1.00 0.75 C ATOM 1003 CG LEU A 85 15.144 -1.845 1.656 1.00 0.81 C ATOM 1004 CD1 LEU A 85 14.525 -0.505 2.062 1.00 0.77 C ATOM 1005 CD2 LEU A 85 16.595 -1.627 1.224 1.00 0.95 C ATOM 0 H LEU A 85 14.495 -3.871 5.011 1.00 0.57 H new ATOM 0 HA LEU A 85 13.061 -2.249 3.204 1.00 0.61 H new ATOM 0 HB2 LEU A 85 15.592 -2.346 3.709 1.00 0.75 H new ATOM 0 HB3 LEU A 85 15.671 -3.710 2.610 1.00 0.75 H new ATOM 0 HG LEU A 85 14.576 -2.269 0.828 1.00 0.81 H new ATOM 0 HD11 LEU A 85 14.550 0.179 1.214 1.00 0.77 H new ATOM 0 HD12 LEU A 85 13.492 -0.661 2.373 1.00 0.77 H new ATOM 0 HD13 LEU A 85 15.092 -0.078 2.889 1.00 0.77 H new ATOM 0 HD21 LEU A 85 16.623 -0.943 0.376 1.00 0.95 H new ATOM 0 HD22 LEU A 85 17.161 -1.202 2.053 1.00 0.95 H new ATOM 0 HD23 LEU A 85 17.036 -2.581 0.935 1.00 0.95 H new ATOM 1017 N VAL A 86 13.434 -5.373 2.202 1.00 0.57 N ATOM 1018 CA VAL A 86 12.912 -6.333 1.191 1.00 0.53 C ATOM 1019 C VAL A 86 11.381 -6.281 1.199 1.00 0.34 C ATOM 1020 O VAL A 86 10.761 -6.088 0.180 1.00 0.26 O ATOM 1021 CB VAL A 86 13.400 -7.754 1.522 1.00 0.68 C ATOM 1022 CG1 VAL A 86 12.648 -8.790 0.674 1.00 0.67 C ATOM 1023 CG2 VAL A 86 14.895 -7.859 1.214 1.00 0.88 C ATOM 0 H VAL A 86 14.035 -5.777 2.921 1.00 0.57 H new ATOM 0 HA VAL A 86 13.277 -6.063 0.200 1.00 0.53 H new ATOM 0 HB VAL A 86 13.214 -7.951 2.578 1.00 0.68 H new ATOM 0 HG11 VAL A 86 13.005 -9.790 0.920 1.00 0.67 H new ATOM 0 HG12 VAL A 86 11.580 -8.724 0.882 1.00 0.67 H new ATOM 0 HG13 VAL A 86 12.824 -8.592 -0.383 1.00 0.67 H new ATOM 0 HG21 VAL A 86 15.245 -8.865 1.447 1.00 0.88 H new ATOM 0 HG22 VAL A 86 15.064 -7.652 0.157 1.00 0.88 H new ATOM 0 HG23 VAL A 86 15.443 -7.135 1.818 1.00 0.88 H new ATOM 1033 N LYS A 87 10.769 -6.451 2.338 1.00 0.34 N ATOM 1034 CA LYS A 87 9.280 -6.410 2.386 1.00 0.25 C ATOM 1035 C LYS A 87 8.783 -5.080 1.809 1.00 0.19 C ATOM 1036 O LYS A 87 7.674 -4.984 1.327 1.00 0.29 O ATOM 1037 CB LYS A 87 8.808 -6.543 3.836 1.00 0.34 C ATOM 1038 CG LYS A 87 8.990 -7.987 4.305 1.00 0.53 C ATOM 1039 CD LYS A 87 7.645 -8.715 4.246 1.00 1.14 C ATOM 1040 CE LYS A 87 7.813 -10.144 4.765 1.00 0.57 C ATOM 1041 NZ LYS A 87 8.449 -10.983 3.710 1.00 0.44 N ATOM 0 H LYS A 87 11.231 -6.615 3.232 1.00 0.34 H new ATOM 0 HA LYS A 87 8.879 -7.235 1.797 1.00 0.25 H new ATOM 0 HB2 LYS A 87 9.375 -5.868 4.477 1.00 0.34 H new ATOM 0 HB3 LYS A 87 7.760 -6.253 3.916 1.00 0.34 H new ATOM 0 HG2 LYS A 87 9.719 -8.496 3.675 1.00 0.53 H new ATOM 0 HG3 LYS A 87 9.381 -8.004 5.322 1.00 0.53 H new ATOM 0 HD2 LYS A 87 6.906 -8.184 4.846 1.00 1.14 H new ATOM 0 HD3 LYS A 87 7.273 -8.731 3.222 1.00 1.14 H new ATOM 0 HE2 LYS A 87 8.427 -10.146 5.666 1.00 0.57 H new ATOM 0 HE3 LYS A 87 6.843 -10.559 5.040 1.00 0.57 H new ATOM 0 HZ1 LYS A 87 8.502 -11.969 4.036 1.00 0.44 H new ATOM 0 HZ2 LYS A 87 7.881 -10.936 2.840 1.00 0.44 H new ATOM 0 HZ3 LYS A 87 9.408 -10.630 3.517 1.00 0.44 H new ATOM 1055 N ILE A 88 9.593 -4.052 1.849 1.00 0.24 N ATOM 1056 CA ILE A 88 9.151 -2.740 1.289 1.00 0.42 C ATOM 1057 C ILE A 88 9.083 -2.862 -0.234 1.00 0.34 C ATOM 1058 O ILE A 88 8.159 -2.390 -0.865 1.00 0.32 O ATOM 1059 CB ILE A 88 10.150 -1.644 1.679 1.00 0.63 C ATOM 1060 CG1 ILE A 88 10.145 -1.466 3.202 1.00 0.79 C ATOM 1061 CG2 ILE A 88 9.762 -0.323 1.009 1.00 0.68 C ATOM 1062 CD1 ILE A 88 8.751 -1.031 3.670 1.00 0.40 C ATOM 0 H ILE A 88 10.534 -4.064 2.242 1.00 0.24 H new ATOM 0 HA ILE A 88 8.171 -2.476 1.687 1.00 0.42 H new ATOM 0 HB ILE A 88 11.147 -1.934 1.348 1.00 0.63 H new ATOM 0 HG12 ILE A 88 10.426 -2.401 3.687 1.00 0.79 H new ATOM 0 HG13 ILE A 88 10.885 -0.720 3.493 1.00 0.79 H new ATOM 0 HG21 ILE A 88 10.476 0.451 1.290 1.00 0.68 H new ATOM 0 HG22 ILE A 88 9.770 -0.448 -0.074 1.00 0.68 H new ATOM 0 HG23 ILE A 88 8.763 -0.030 1.333 1.00 0.68 H new ATOM 0 HD11 ILE A 88 8.753 -0.906 4.753 1.00 0.40 H new ATOM 0 HD12 ILE A 88 8.487 -0.086 3.196 1.00 0.40 H new ATOM 0 HD13 ILE A 88 8.021 -1.792 3.394 1.00 0.40 H new ATOM 1074 N ILE A 89 10.045 -3.518 -0.824 1.00 0.33 N ATOM 1075 CA ILE A 89 10.029 -3.706 -2.302 1.00 0.33 C ATOM 1076 C ILE A 89 8.805 -4.549 -2.643 1.00 0.25 C ATOM 1077 O ILE A 89 7.911 -4.139 -3.356 1.00 0.24 O ATOM 1078 CB ILE A 89 11.285 -4.474 -2.728 1.00 0.47 C ATOM 1079 CG1 ILE A 89 12.532 -3.826 -2.115 1.00 0.82 C ATOM 1080 CG2 ILE A 89 11.412 -4.454 -4.255 1.00 0.37 C ATOM 1081 CD1 ILE A 89 12.600 -2.354 -2.522 1.00 0.85 C ATOM 0 H ILE A 89 10.844 -3.933 -0.344 1.00 0.33 H new ATOM 0 HA ILE A 89 10.000 -2.743 -2.811 1.00 0.33 H new ATOM 0 HB ILE A 89 11.201 -5.503 -2.378 1.00 0.47 H new ATOM 0 HG12 ILE A 89 12.502 -3.912 -1.029 1.00 0.82 H new ATOM 0 HG13 ILE A 89 13.428 -4.348 -2.451 1.00 0.82 H new ATOM 0 HG21 ILE A 89 12.306 -5.001 -4.553 1.00 0.37 H new ATOM 0 HG22 ILE A 89 10.534 -4.924 -4.699 1.00 0.37 H new ATOM 0 HG23 ILE A 89 11.486 -3.423 -4.600 1.00 0.37 H new ATOM 0 HD11 ILE A 89 13.487 -1.896 -2.085 1.00 0.85 H new ATOM 0 HD12 ILE A 89 12.651 -2.279 -3.608 1.00 0.85 H new ATOM 0 HD13 ILE A 89 11.710 -1.836 -2.164 1.00 0.85 H new ATOM 1093 N THR A 90 8.778 -5.729 -2.102 1.00 0.31 N ATOM 1094 CA THR A 90 7.644 -6.666 -2.324 1.00 0.47 C ATOM 1095 C THR A 90 6.332 -6.016 -1.866 1.00 0.43 C ATOM 1096 O THR A 90 5.257 -6.458 -2.217 1.00 0.53 O ATOM 1097 CB THR A 90 7.872 -7.936 -1.490 1.00 0.75 C ATOM 1098 OG1 THR A 90 8.922 -7.728 -0.556 1.00 1.83 O ATOM 1099 CG2 THR A 90 8.232 -9.107 -2.396 1.00 0.76 C ATOM 0 H THR A 90 9.514 -6.095 -1.498 1.00 0.31 H new ATOM 0 HA THR A 90 7.585 -6.909 -3.385 1.00 0.47 H new ATOM 0 HB THR A 90 6.950 -8.164 -0.955 1.00 0.75 H new ATOM 0 HG1 THR A 90 9.058 -8.543 -0.029 1.00 1.83 H new ATOM 0 HG21 THR A 90 8.391 -10.000 -1.791 1.00 0.76 H new ATOM 0 HG22 THR A 90 7.419 -9.285 -3.100 1.00 0.76 H new ATOM 0 HG23 THR A 90 9.144 -8.875 -2.946 1.00 0.76 H new ATOM 1107 N GLY A 91 6.410 -4.990 -1.063 1.00 0.47 N ATOM 1108 CA GLY A 91 5.167 -4.341 -0.562 1.00 0.64 C ATOM 1109 C GLY A 91 4.685 -3.269 -1.539 1.00 0.61 C ATOM 1110 O GLY A 91 3.508 -2.976 -1.614 1.00 0.73 O ATOM 0 H GLY A 91 7.281 -4.574 -0.733 1.00 0.47 H new ATOM 0 HA2 GLY A 91 4.389 -5.092 -0.425 1.00 0.64 H new ATOM 0 HA3 GLY A 91 5.353 -3.893 0.414 1.00 0.64 H new ATOM 1114 N LEU A 92 5.575 -2.665 -2.277 1.00 0.51 N ATOM 1115 CA LEU A 92 5.142 -1.602 -3.225 1.00 0.56 C ATOM 1116 C LEU A 92 4.641 -2.227 -4.532 1.00 0.47 C ATOM 1117 O LEU A 92 3.752 -1.704 -5.169 1.00 0.44 O ATOM 1118 CB LEU A 92 6.314 -0.665 -3.518 1.00 0.59 C ATOM 1119 CG LEU A 92 6.529 0.276 -2.332 1.00 0.69 C ATOM 1120 CD1 LEU A 92 7.847 1.031 -2.509 1.00 0.81 C ATOM 1121 CD2 LEU A 92 5.375 1.280 -2.264 1.00 0.60 C ATOM 0 H LEU A 92 6.576 -2.860 -2.265 1.00 0.51 H new ATOM 0 HA LEU A 92 4.329 -1.036 -2.771 1.00 0.56 H new ATOM 0 HB2 LEU A 92 7.218 -1.245 -3.704 1.00 0.59 H new ATOM 0 HB3 LEU A 92 6.114 -0.088 -4.421 1.00 0.59 H new ATOM 0 HG LEU A 92 6.564 -0.305 -1.410 1.00 0.69 H new ATOM 0 HD11 LEU A 92 7.999 1.701 -1.663 1.00 0.81 H new ATOM 0 HD12 LEU A 92 8.670 0.319 -2.560 1.00 0.81 H new ATOM 0 HD13 LEU A 92 7.813 1.612 -3.431 1.00 0.81 H new ATOM 0 HD21 LEU A 92 5.526 1.952 -1.419 1.00 0.60 H new ATOM 0 HD22 LEU A 92 5.342 1.859 -3.187 1.00 0.60 H new ATOM 0 HD23 LEU A 92 4.434 0.745 -2.138 1.00 0.60 H new ATOM 1133 N LEU A 93 5.194 -3.340 -4.942 1.00 0.43 N ATOM 1134 CA LEU A 93 4.725 -3.977 -6.211 1.00 0.35 C ATOM 1135 C LEU A 93 3.276 -4.456 -6.018 1.00 0.35 C ATOM 1136 O LEU A 93 2.371 -4.089 -6.759 1.00 0.36 O ATOM 1137 CB LEU A 93 5.631 -5.167 -6.556 1.00 0.29 C ATOM 1138 CG LEU A 93 7.098 -4.720 -6.529 1.00 0.38 C ATOM 1139 CD1 LEU A 93 7.977 -5.862 -6.014 1.00 0.42 C ATOM 1140 CD2 LEU A 93 7.540 -4.338 -7.944 1.00 0.63 C ATOM 0 H LEU A 93 5.944 -3.833 -4.458 1.00 0.43 H new ATOM 0 HA LEU A 93 4.767 -3.257 -7.028 1.00 0.35 H new ATOM 0 HB2 LEU A 93 5.473 -5.976 -5.843 1.00 0.29 H new ATOM 0 HB3 LEU A 93 5.377 -5.557 -7.542 1.00 0.29 H new ATOM 0 HG LEU A 93 7.200 -3.859 -5.868 1.00 0.38 H new ATOM 0 HD11 LEU A 93 9.018 -5.540 -5.996 1.00 0.42 H new ATOM 0 HD12 LEU A 93 7.665 -6.135 -5.006 1.00 0.42 H new ATOM 0 HD13 LEU A 93 7.875 -6.725 -6.672 1.00 0.42 H new ATOM 0 HD21 LEU A 93 8.582 -4.020 -7.926 1.00 0.63 H new ATOM 0 HD22 LEU A 93 7.435 -5.200 -8.603 1.00 0.63 H new ATOM 0 HD23 LEU A 93 6.918 -3.522 -8.312 1.00 0.63 H new ATOM 1152 N GLU A 94 3.040 -5.256 -5.013 1.00 0.36 N ATOM 1153 CA GLU A 94 1.652 -5.726 -4.760 1.00 0.38 C ATOM 1154 C GLU A 94 0.794 -4.503 -4.450 1.00 0.43 C ATOM 1155 O GLU A 94 -0.353 -4.415 -4.836 1.00 0.39 O ATOM 1156 CB GLU A 94 1.634 -6.683 -3.564 1.00 0.37 C ATOM 1157 CG GLU A 94 2.312 -7.998 -3.949 1.00 0.71 C ATOM 1158 CD GLU A 94 2.013 -9.056 -2.886 1.00 1.18 C ATOM 1159 OE1 GLU A 94 2.762 -9.132 -1.926 1.00 2.48 O ATOM 1160 OE2 GLU A 94 1.039 -9.773 -3.049 1.00 0.38 O ATOM 0 H GLU A 94 3.745 -5.601 -4.361 1.00 0.36 H new ATOM 0 HA GLU A 94 1.267 -6.254 -5.632 1.00 0.38 H new ATOM 0 HB2 GLU A 94 2.149 -6.231 -2.716 1.00 0.37 H new ATOM 0 HB3 GLU A 94 0.607 -6.870 -3.250 1.00 0.37 H new ATOM 0 HG2 GLU A 94 1.953 -8.333 -4.922 1.00 0.71 H new ATOM 0 HG3 GLU A 94 3.388 -7.852 -4.039 1.00 0.71 H new ATOM 1167 N PHE A 95 1.358 -3.544 -3.768 1.00 0.50 N ATOM 1168 CA PHE A 95 0.598 -2.310 -3.445 1.00 0.53 C ATOM 1169 C PHE A 95 0.147 -1.657 -4.747 1.00 0.45 C ATOM 1170 O PHE A 95 -0.886 -1.029 -4.811 1.00 0.42 O ATOM 1171 CB PHE A 95 1.510 -1.340 -2.690 1.00 0.61 C ATOM 1172 CG PHE A 95 1.326 -1.490 -1.195 1.00 0.69 C ATOM 1173 CD1 PHE A 95 0.986 -2.732 -0.638 1.00 0.80 C ATOM 1174 CD2 PHE A 95 1.501 -0.379 -0.364 1.00 1.01 C ATOM 1175 CE1 PHE A 95 0.821 -2.857 0.743 1.00 0.86 C ATOM 1176 CE2 PHE A 95 1.336 -0.504 1.018 1.00 1.10 C ATOM 1177 CZ PHE A 95 0.995 -1.744 1.573 1.00 0.87 C ATOM 0 H PHE A 95 2.317 -3.565 -3.420 1.00 0.50 H new ATOM 0 HA PHE A 95 -0.267 -2.556 -2.829 1.00 0.53 H new ATOM 0 HB2 PHE A 95 2.550 -1.530 -2.955 1.00 0.61 H new ATOM 0 HB3 PHE A 95 1.287 -0.316 -2.988 1.00 0.61 H new ATOM 0 HD1 PHE A 95 0.852 -3.592 -1.278 1.00 0.80 H new ATOM 0 HD2 PHE A 95 1.764 0.577 -0.791 1.00 1.01 H new ATOM 0 HE1 PHE A 95 0.559 -3.813 1.171 1.00 0.86 H new ATOM 0 HE2 PHE A 95 1.471 0.355 1.658 1.00 1.10 H new ATOM 0 HZ PHE A 95 0.866 -1.841 2.641 1.00 0.87 H new ATOM 1187 N GLU A 96 0.925 -1.800 -5.787 1.00 0.42 N ATOM 1188 CA GLU A 96 0.552 -1.188 -7.089 1.00 0.35 C ATOM 1189 C GLU A 96 -0.709 -1.859 -7.626 1.00 0.26 C ATOM 1190 O GLU A 96 -1.614 -1.196 -8.077 1.00 0.18 O ATOM 1191 CB GLU A 96 1.684 -1.365 -8.096 1.00 0.44 C ATOM 1192 CG GLU A 96 2.840 -0.430 -7.737 1.00 1.31 C ATOM 1193 CD GLU A 96 2.578 0.965 -8.315 1.00 2.28 C ATOM 1194 OE1 GLU A 96 1.483 1.189 -8.805 1.00 2.56 O ATOM 1195 OE2 GLU A 96 3.477 1.788 -8.255 1.00 3.09 O ATOM 0 H GLU A 96 1.805 -2.316 -5.788 1.00 0.42 H new ATOM 0 HA GLU A 96 0.369 -0.124 -6.939 1.00 0.35 H new ATOM 0 HB2 GLU A 96 2.026 -2.400 -8.096 1.00 0.44 H new ATOM 0 HB3 GLU A 96 1.326 -1.148 -9.103 1.00 0.44 H new ATOM 0 HG2 GLU A 96 2.949 -0.370 -6.654 1.00 1.31 H new ATOM 0 HG3 GLU A 96 3.776 -0.827 -8.130 1.00 1.31 H new ATOM 1202 N VAL A 97 -0.785 -3.167 -7.583 1.00 0.30 N ATOM 1203 CA VAL A 97 -2.024 -3.838 -8.097 1.00 0.24 C ATOM 1204 C VAL A 97 -3.220 -3.377 -7.251 1.00 0.21 C ATOM 1205 O VAL A 97 -4.337 -3.275 -7.726 1.00 0.22 O ATOM 1206 CB VAL A 97 -1.868 -5.369 -8.038 1.00 0.34 C ATOM 1207 CG1 VAL A 97 -1.761 -5.851 -6.589 1.00 0.59 C ATOM 1208 CG2 VAL A 97 -3.082 -6.027 -8.696 1.00 0.26 C ATOM 0 H VAL A 97 -0.061 -3.789 -7.223 1.00 0.30 H new ATOM 0 HA VAL A 97 -2.190 -3.562 -9.138 1.00 0.24 H new ATOM 0 HB VAL A 97 -0.956 -5.644 -8.567 1.00 0.34 H new ATOM 0 HG11 VAL A 97 -1.652 -6.935 -6.573 1.00 0.59 H new ATOM 0 HG12 VAL A 97 -0.893 -5.392 -6.116 1.00 0.59 H new ATOM 0 HG13 VAL A 97 -2.662 -5.569 -6.044 1.00 0.59 H new ATOM 0 HG21 VAL A 97 -2.975 -7.111 -8.656 1.00 0.26 H new ATOM 0 HG22 VAL A 97 -3.988 -5.732 -8.166 1.00 0.26 H new ATOM 0 HG23 VAL A 97 -3.150 -5.707 -9.736 1.00 0.26 H new ATOM 1218 N TYR A 98 -2.993 -3.062 -6.006 1.00 0.35 N ATOM 1219 CA TYR A 98 -4.110 -2.575 -5.156 1.00 0.31 C ATOM 1220 C TYR A 98 -4.417 -1.138 -5.568 1.00 0.18 C ATOM 1221 O TYR A 98 -5.539 -0.676 -5.490 1.00 0.13 O ATOM 1222 CB TYR A 98 -3.700 -2.640 -3.687 1.00 0.42 C ATOM 1223 CG TYR A 98 -3.623 -4.089 -3.278 1.00 0.47 C ATOM 1224 CD1 TYR A 98 -4.758 -4.902 -3.385 1.00 0.46 C ATOM 1225 CD2 TYR A 98 -2.421 -4.623 -2.803 1.00 0.61 C ATOM 1226 CE1 TYR A 98 -4.691 -6.250 -3.016 1.00 0.50 C ATOM 1227 CE2 TYR A 98 -2.354 -5.971 -2.433 1.00 0.66 C ATOM 1228 CZ TYR A 98 -3.489 -6.784 -2.539 1.00 0.57 C ATOM 1229 OH TYR A 98 -3.423 -8.110 -2.166 1.00 0.62 O ATOM 0 H TYR A 98 -2.086 -3.121 -5.544 1.00 0.35 H new ATOM 0 HA TYR A 98 -4.998 -3.194 -5.286 1.00 0.31 H new ATOM 0 HB2 TYR A 98 -2.736 -2.153 -3.540 1.00 0.42 H new ATOM 0 HB3 TYR A 98 -4.423 -2.109 -3.068 1.00 0.42 H new ATOM 0 HD1 TYR A 98 -5.686 -4.488 -3.752 1.00 0.46 H new ATOM 0 HD2 TYR A 98 -1.545 -3.996 -2.722 1.00 0.61 H new ATOM 0 HE1 TYR A 98 -5.566 -6.877 -3.099 1.00 0.50 H new ATOM 0 HE2 TYR A 98 -1.426 -6.384 -2.066 1.00 0.66 H new ATOM 0 HH TYR A 98 -4.327 -8.489 -2.143 1.00 0.62 H new ATOM 1239 N LEU A 99 -3.424 -0.446 -6.058 1.00 0.21 N ATOM 1240 CA LEU A 99 -3.640 0.939 -6.536 1.00 0.18 C ATOM 1241 C LEU A 99 -4.417 0.847 -7.843 1.00 0.12 C ATOM 1242 O LEU A 99 -5.170 1.728 -8.199 1.00 0.21 O ATOM 1243 CB LEU A 99 -2.293 1.611 -6.781 1.00 0.27 C ATOM 1244 CG LEU A 99 -1.583 1.818 -5.446 1.00 0.27 C ATOM 1245 CD1 LEU A 99 -0.080 1.980 -5.680 1.00 0.22 C ATOM 1246 CD2 LEU A 99 -2.137 3.075 -4.778 1.00 0.34 C ATOM 0 H LEU A 99 -2.467 -0.788 -6.146 1.00 0.21 H new ATOM 0 HA LEU A 99 -4.189 1.526 -5.800 1.00 0.18 H new ATOM 0 HB2 LEU A 99 -1.681 0.995 -7.440 1.00 0.27 H new ATOM 0 HB3 LEU A 99 -2.437 2.568 -7.282 1.00 0.27 H new ATOM 0 HG LEU A 99 -1.751 0.954 -4.803 1.00 0.27 H new ATOM 0 HD11 LEU A 99 0.423 2.128 -4.724 1.00 0.22 H new ATOM 0 HD12 LEU A 99 0.312 1.084 -6.162 1.00 0.22 H new ATOM 0 HD13 LEU A 99 0.097 2.844 -6.321 1.00 0.22 H new ATOM 0 HD21 LEU A 99 -1.635 3.231 -3.823 1.00 0.34 H new ATOM 0 HD22 LEU A 99 -1.964 3.936 -5.423 1.00 0.34 H new ATOM 0 HD23 LEU A 99 -3.207 2.956 -4.610 1.00 0.34 H new ATOM 1258 N GLU A 100 -4.267 -0.254 -8.535 1.00 0.07 N ATOM 1259 CA GLU A 100 -5.017 -0.461 -9.787 1.00 0.16 C ATOM 1260 C GLU A 100 -6.480 -0.574 -9.383 1.00 0.28 C ATOM 1261 O GLU A 100 -7.376 -0.129 -10.071 1.00 0.39 O ATOM 1262 CB GLU A 100 -4.526 -1.758 -10.447 1.00 0.27 C ATOM 1263 CG GLU A 100 -5.423 -2.130 -11.621 1.00 0.84 C ATOM 1264 CD GLU A 100 -5.386 -1.019 -12.670 1.00 0.37 C ATOM 1265 OE1 GLU A 100 -6.132 -0.066 -12.522 1.00 1.30 O ATOM 1266 OE2 GLU A 100 -4.612 -1.139 -13.605 1.00 1.59 O ATOM 0 H GLU A 100 -3.647 -1.021 -8.274 1.00 0.07 H new ATOM 0 HA GLU A 100 -4.879 0.351 -10.501 1.00 0.16 H new ATOM 0 HB2 GLU A 100 -3.499 -1.632 -10.791 1.00 0.27 H new ATOM 0 HB3 GLU A 100 -4.520 -2.566 -9.715 1.00 0.27 H new ATOM 0 HG2 GLU A 100 -5.091 -3.070 -12.061 1.00 0.84 H new ATOM 0 HG3 GLU A 100 -6.445 -2.283 -11.276 1.00 0.84 H new ATOM 1273 N TYR A 101 -6.709 -1.144 -8.227 1.00 0.26 N ATOM 1274 CA TYR A 101 -8.091 -1.269 -7.704 1.00 0.37 C ATOM 1275 C TYR A 101 -8.678 0.125 -7.520 1.00 0.40 C ATOM 1276 O TYR A 101 -9.793 0.405 -7.912 1.00 0.51 O ATOM 1277 CB TYR A 101 -8.044 -1.977 -6.345 1.00 0.36 C ATOM 1278 CG TYR A 101 -9.186 -2.956 -6.227 1.00 0.39 C ATOM 1279 CD1 TYR A 101 -9.468 -3.830 -7.281 1.00 0.35 C ATOM 1280 CD2 TYR A 101 -9.959 -2.992 -5.060 1.00 0.49 C ATOM 1281 CE1 TYR A 101 -10.523 -4.741 -7.174 1.00 0.36 C ATOM 1282 CE2 TYR A 101 -11.016 -3.904 -4.953 1.00 0.52 C ATOM 1283 CZ TYR A 101 -11.298 -4.777 -6.010 1.00 0.44 C ATOM 1284 OH TYR A 101 -12.339 -5.675 -5.903 1.00 0.47 O ATOM 0 H TYR A 101 -5.985 -1.530 -7.621 1.00 0.26 H new ATOM 0 HA TYR A 101 -8.705 -1.840 -8.400 1.00 0.37 H new ATOM 0 HB2 TYR A 101 -7.094 -2.500 -6.232 1.00 0.36 H new ATOM 0 HB3 TYR A 101 -8.101 -1.242 -5.542 1.00 0.36 H new ATOM 0 HD1 TYR A 101 -8.870 -3.801 -8.180 1.00 0.35 H new ATOM 0 HD2 TYR A 101 -9.741 -2.318 -4.245 1.00 0.49 H new ATOM 0 HE1 TYR A 101 -10.739 -5.416 -7.989 1.00 0.36 H new ATOM 0 HE2 TYR A 101 -11.614 -3.934 -4.054 1.00 0.52 H new ATOM 0 HH TYR A 101 -12.774 -5.569 -5.031 1.00 0.47 H new ATOM 1294 N LEU A 102 -7.936 0.990 -6.897 1.00 0.35 N ATOM 1295 CA LEU A 102 -8.435 2.369 -6.637 1.00 0.43 C ATOM 1296 C LEU A 102 -8.025 3.325 -7.762 1.00 0.46 C ATOM 1297 O LEU A 102 -8.256 4.514 -7.675 1.00 0.63 O ATOM 1298 CB LEU A 102 -7.846 2.865 -5.316 1.00 0.41 C ATOM 1299 CG LEU A 102 -7.948 1.763 -4.258 1.00 0.36 C ATOM 1300 CD1 LEU A 102 -6.630 1.662 -3.493 1.00 0.27 C ATOM 1301 CD2 LEU A 102 -9.082 2.100 -3.299 1.00 0.43 C ATOM 0 H LEU A 102 -6.995 0.801 -6.552 1.00 0.35 H new ATOM 0 HA LEU A 102 -9.524 2.344 -6.588 1.00 0.43 H new ATOM 0 HB2 LEU A 102 -6.804 3.152 -5.457 1.00 0.41 H new ATOM 0 HB3 LEU A 102 -8.379 3.755 -4.981 1.00 0.41 H new ATOM 0 HG LEU A 102 -8.150 0.806 -4.739 1.00 0.36 H new ATOM 0 HD11 LEU A 102 -6.705 0.877 -2.741 1.00 0.27 H new ATOM 0 HD12 LEU A 102 -5.824 1.424 -4.187 1.00 0.27 H new ATOM 0 HD13 LEU A 102 -6.419 2.613 -3.005 1.00 0.27 H new ATOM 0 HD21 LEU A 102 -9.162 1.320 -2.542 1.00 0.43 H new ATOM 0 HD22 LEU A 102 -8.878 3.055 -2.816 1.00 0.43 H new ATOM 0 HD23 LEU A 102 -10.019 2.166 -3.852 1.00 0.43 H new ATOM 1313 N GLN A 103 -7.416 2.838 -8.808 1.00 0.32 N ATOM 1314 CA GLN A 103 -7.001 3.762 -9.902 1.00 0.34 C ATOM 1315 C GLN A 103 -8.221 4.147 -10.744 1.00 0.37 C ATOM 1316 O GLN A 103 -8.253 5.192 -11.363 1.00 0.49 O ATOM 1317 CB GLN A 103 -5.965 3.087 -10.802 1.00 0.42 C ATOM 1318 CG GLN A 103 -5.262 4.153 -11.646 1.00 0.29 C ATOM 1319 CD GLN A 103 -5.963 4.281 -12.999 1.00 1.67 C ATOM 1320 OE1 GLN A 103 -6.498 3.317 -13.512 1.00 2.16 O ATOM 1321 NE2 GLN A 103 -5.983 5.437 -13.603 1.00 2.68 N ATOM 0 H GLN A 103 -7.190 1.854 -8.952 1.00 0.32 H new ATOM 0 HA GLN A 103 -6.563 4.655 -9.456 1.00 0.34 H new ATOM 0 HB2 GLN A 103 -5.237 2.546 -10.197 1.00 0.42 H new ATOM 0 HB3 GLN A 103 -6.449 2.355 -11.448 1.00 0.42 H new ATOM 0 HG2 GLN A 103 -5.276 5.111 -11.126 1.00 0.29 H new ATOM 0 HG3 GLN A 103 -4.216 3.885 -11.791 1.00 0.29 H new ATOM 0 HE21 GLN A 103 -5.534 6.245 -13.172 1.00 2.68 H new ATOM 0 HE22 GLN A 103 -6.448 5.533 -14.506 1.00 2.68 H new ATOM 1330 N ASN A 104 -9.220 3.305 -10.782 1.00 0.44 N ATOM 1331 CA ASN A 104 -10.428 3.621 -11.599 1.00 0.45 C ATOM 1332 C ASN A 104 -11.685 3.599 -10.722 1.00 0.42 C ATOM 1333 O ASN A 104 -12.662 4.262 -11.011 1.00 0.44 O ATOM 1334 CB ASN A 104 -10.571 2.579 -12.710 1.00 0.52 C ATOM 1335 CG ASN A 104 -10.590 3.278 -14.070 1.00 0.30 C ATOM 1336 OD1 ASN A 104 -9.883 4.244 -14.280 1.00 0.74 O ATOM 1337 ND2 ASN A 104 -11.374 2.827 -15.009 1.00 1.07 N ATOM 0 H ASN A 104 -9.252 2.415 -10.284 1.00 0.44 H new ATOM 0 HA ASN A 104 -10.314 4.616 -12.030 1.00 0.45 H new ATOM 0 HB2 ASN A 104 -9.744 1.870 -12.666 1.00 0.52 H new ATOM 0 HB3 ASN A 104 -11.489 2.008 -12.571 1.00 0.52 H new ATOM 0 HD21 ASN A 104 -11.394 3.285 -15.920 1.00 1.07 H new ATOM 0 HD22 ASN A 104 -11.967 2.016 -14.832 1.00 1.07 H new ATOM 1344 N ARG A 105 -11.677 2.845 -9.656 1.00 0.37 N ATOM 1345 CA ARG A 105 -12.879 2.786 -8.777 1.00 0.36 C ATOM 1346 C ARG A 105 -13.262 4.200 -8.341 1.00 0.34 C ATOM 1347 O ARG A 105 -14.405 4.480 -8.038 1.00 0.38 O ATOM 1348 CB ARG A 105 -12.571 1.937 -7.542 1.00 0.28 C ATOM 1349 CG ARG A 105 -13.445 0.681 -7.554 1.00 0.57 C ATOM 1350 CD ARG A 105 -12.869 -0.339 -8.539 1.00 2.22 C ATOM 1351 NE ARG A 105 -13.280 0.021 -9.923 1.00 3.12 N ATOM 1352 CZ ARG A 105 -14.120 -0.738 -10.574 1.00 4.05 C ATOM 1353 NH1 ARG A 105 -15.405 -0.562 -10.431 1.00 3.89 N ATOM 1354 NH2 ARG A 105 -13.674 -1.677 -11.365 1.00 5.35 N ATOM 0 H ARG A 105 -10.891 2.268 -9.356 1.00 0.37 H new ATOM 0 HA ARG A 105 -13.707 2.338 -9.326 1.00 0.36 H new ATOM 0 HB2 ARG A 105 -11.517 1.659 -7.532 1.00 0.28 H new ATOM 0 HB3 ARG A 105 -12.757 2.514 -6.636 1.00 0.28 H new ATOM 0 HG2 ARG A 105 -13.492 0.249 -6.554 1.00 0.57 H new ATOM 0 HG3 ARG A 105 -14.465 0.939 -7.838 1.00 0.57 H new ATOM 0 HD2 ARG A 105 -11.782 -0.358 -8.465 1.00 2.22 H new ATOM 0 HD3 ARG A 105 -13.223 -1.340 -8.292 1.00 2.22 H new ATOM 0 HE ARG A 105 -12.905 0.861 -10.364 1.00 3.12 H new ATOM 0 HH11 ARG A 105 -15.754 0.169 -9.811 1.00 3.89 H new ATOM 0 HH12 ARG A 105 -16.061 -1.155 -10.940 1.00 3.89 H new ATOM 0 HH21 ARG A 105 -12.670 -1.817 -11.474 1.00 5.35 H new ATOM 0 HH22 ARG A 105 -14.330 -2.270 -11.873 1.00 5.35 H new ATOM 1368 N PHE A 106 -12.316 5.098 -8.309 1.00 0.32 N ATOM 1369 CA PHE A 106 -12.632 6.494 -7.897 1.00 0.35 C ATOM 1370 C PHE A 106 -13.107 7.282 -9.118 1.00 0.46 C ATOM 1371 O PHE A 106 -12.326 7.651 -9.973 1.00 0.80 O ATOM 1372 CB PHE A 106 -11.382 7.158 -7.316 1.00 0.36 C ATOM 1373 CG PHE A 106 -11.277 6.843 -5.842 1.00 0.30 C ATOM 1374 CD1 PHE A 106 -12.174 7.424 -4.936 1.00 0.45 C ATOM 1375 CD2 PHE A 106 -10.283 5.973 -5.381 1.00 0.87 C ATOM 1376 CE1 PHE A 106 -12.075 7.136 -3.569 1.00 0.31 C ATOM 1377 CE2 PHE A 106 -10.184 5.683 -4.013 1.00 0.97 C ATOM 1378 CZ PHE A 106 -11.079 6.266 -3.109 1.00 0.40 C ATOM 0 H PHE A 106 -11.340 4.926 -8.550 1.00 0.32 H new ATOM 0 HA PHE A 106 -13.415 6.481 -7.139 1.00 0.35 H new ATOM 0 HB2 PHE A 106 -10.494 6.802 -7.838 1.00 0.36 H new ATOM 0 HB3 PHE A 106 -11.429 8.237 -7.465 1.00 0.36 H new ATOM 0 HD1 PHE A 106 -12.942 8.094 -5.292 1.00 0.45 H new ATOM 0 HD2 PHE A 106 -9.592 5.525 -6.079 1.00 0.87 H new ATOM 0 HE1 PHE A 106 -12.766 7.584 -2.871 1.00 0.31 H new ATOM 0 HE2 PHE A 106 -9.418 5.010 -3.657 1.00 0.97 H new ATOM 0 HZ PHE A 106 -11.001 6.045 -2.055 1.00 0.40 H new ATOM 1388 N GLU A 107 -14.382 7.539 -9.209 1.00 0.38 N ATOM 1389 CA GLU A 107 -14.909 8.301 -10.377 1.00 0.45 C ATOM 1390 C GLU A 107 -15.059 9.774 -9.998 1.00 0.27 C ATOM 1391 O GLU A 107 -14.838 10.659 -10.800 1.00 0.16 O ATOM 1392 CB GLU A 107 -16.277 7.744 -10.772 1.00 0.62 C ATOM 1393 CG GLU A 107 -16.808 8.523 -11.974 1.00 1.46 C ATOM 1394 CD GLU A 107 -16.871 7.600 -13.192 1.00 1.90 C ATOM 1395 OE1 GLU A 107 -16.121 6.637 -13.219 1.00 2.08 O ATOM 1396 OE2 GLU A 107 -17.667 7.870 -14.075 1.00 2.70 O ATOM 0 H GLU A 107 -15.083 7.254 -8.525 1.00 0.38 H new ATOM 0 HA GLU A 107 -14.217 8.205 -11.214 1.00 0.45 H new ATOM 0 HB2 GLU A 107 -16.195 6.685 -11.017 1.00 0.62 H new ATOM 0 HB3 GLU A 107 -16.971 7.825 -9.936 1.00 0.62 H new ATOM 0 HG2 GLU A 107 -17.799 8.921 -11.754 1.00 1.46 H new ATOM 0 HG3 GLU A 107 -16.161 9.375 -12.183 1.00 1.46 H new ATOM 1403 N SER A 108 -15.420 10.039 -8.775 1.00 0.43 N ATOM 1404 CA SER A 108 -15.574 11.452 -8.326 1.00 0.36 C ATOM 1405 C SER A 108 -14.242 11.911 -7.753 1.00 0.21 C ATOM 1406 O SER A 108 -13.756 12.987 -8.042 1.00 0.17 O ATOM 1407 CB SER A 108 -16.654 11.537 -7.248 1.00 0.68 C ATOM 1408 OG SER A 108 -17.917 11.755 -7.864 1.00 1.56 O ATOM 0 H SER A 108 -15.616 9.336 -8.063 1.00 0.43 H new ATOM 0 HA SER A 108 -15.866 12.085 -9.164 1.00 0.36 H new ATOM 0 HB2 SER A 108 -16.675 10.616 -6.665 1.00 0.68 H new ATOM 0 HB3 SER A 108 -16.430 12.348 -6.555 1.00 0.68 H new ATOM 0 HG SER A 108 -18.612 11.808 -7.175 1.00 1.56 H new ATOM 1414 N SER A 109 -13.634 11.073 -6.965 1.00 0.49 N ATOM 1415 CA SER A 109 -12.311 11.411 -6.384 1.00 0.65 C ATOM 1416 C SER A 109 -11.251 10.699 -7.217 1.00 0.66 C ATOM 1417 O SER A 109 -10.205 10.322 -6.728 1.00 0.71 O ATOM 1418 CB SER A 109 -12.242 10.920 -4.938 1.00 0.91 C ATOM 1419 OG SER A 109 -12.270 12.037 -4.060 1.00 1.58 O ATOM 0 H SER A 109 -14.002 10.160 -6.697 1.00 0.49 H new ATOM 0 HA SER A 109 -12.151 12.489 -6.393 1.00 0.65 H new ATOM 0 HB2 SER A 109 -13.080 10.256 -4.727 1.00 0.91 H new ATOM 0 HB3 SER A 109 -11.331 10.343 -4.781 1.00 0.91 H new ATOM 0 HG SER A 109 -12.227 11.725 -3.132 1.00 1.58 H new ATOM 1425 N GLU A 110 -11.534 10.492 -8.476 1.00 0.62 N ATOM 1426 CA GLU A 110 -10.578 9.788 -9.361 1.00 0.64 C ATOM 1427 C GLU A 110 -9.187 10.420 -9.251 1.00 0.63 C ATOM 1428 O GLU A 110 -8.224 9.773 -8.893 1.00 0.70 O ATOM 1429 CB GLU A 110 -11.063 9.892 -10.807 1.00 0.66 C ATOM 1430 CG GLU A 110 -10.270 8.917 -11.676 1.00 0.63 C ATOM 1431 CD GLU A 110 -10.951 8.770 -13.038 1.00 0.83 C ATOM 1432 OE1 GLU A 110 -11.290 9.786 -13.622 1.00 0.69 O ATOM 1433 OE2 GLU A 110 -11.122 7.643 -13.473 1.00 1.39 O ATOM 0 H GLU A 110 -12.399 10.787 -8.928 1.00 0.62 H new ATOM 0 HA GLU A 110 -10.518 8.742 -9.059 1.00 0.64 H new ATOM 0 HB2 GLU A 110 -12.127 9.664 -10.863 1.00 0.66 H new ATOM 0 HB3 GLU A 110 -10.935 10.911 -11.173 1.00 0.66 H new ATOM 0 HG2 GLU A 110 -9.250 9.277 -11.806 1.00 0.63 H new ATOM 0 HG3 GLU A 110 -10.205 7.946 -11.184 1.00 0.63 H new ATOM 1440 N GLU A 111 -9.080 11.682 -9.571 1.00 0.62 N ATOM 1441 CA GLU A 111 -7.759 12.372 -9.508 1.00 0.62 C ATOM 1442 C GLU A 111 -7.086 12.122 -8.153 1.00 0.55 C ATOM 1443 O GLU A 111 -5.876 12.126 -8.044 1.00 0.46 O ATOM 1444 CB GLU A 111 -7.972 13.876 -9.694 1.00 0.70 C ATOM 1445 CG GLU A 111 -6.640 14.542 -10.035 1.00 0.60 C ATOM 1446 CD GLU A 111 -6.822 16.061 -10.078 1.00 0.65 C ATOM 1447 OE1 GLU A 111 -7.633 16.563 -9.316 1.00 0.71 O ATOM 1448 OE2 GLU A 111 -6.147 16.696 -10.872 1.00 1.23 O ATOM 0 H GLU A 111 -9.857 12.269 -9.876 1.00 0.62 H new ATOM 0 HA GLU A 111 -7.117 11.981 -10.297 1.00 0.62 H new ATOM 0 HB2 GLU A 111 -8.695 14.056 -10.490 1.00 0.70 H new ATOM 0 HB3 GLU A 111 -8.385 14.311 -8.784 1.00 0.70 H new ATOM 0 HG2 GLU A 111 -5.888 14.277 -9.292 1.00 0.60 H new ATOM 0 HG3 GLU A 111 -6.278 14.182 -10.998 1.00 0.60 H new ATOM 1455 N GLN A 112 -7.855 11.912 -7.123 1.00 0.69 N ATOM 1456 CA GLN A 112 -7.255 11.672 -5.780 1.00 0.65 C ATOM 1457 C GLN A 112 -6.546 10.316 -5.762 1.00 0.42 C ATOM 1458 O GLN A 112 -5.393 10.213 -5.392 1.00 0.32 O ATOM 1459 CB GLN A 112 -8.358 11.682 -4.723 1.00 0.78 C ATOM 1460 CG GLN A 112 -9.224 12.932 -4.900 1.00 1.33 C ATOM 1461 CD GLN A 112 -9.444 13.598 -3.540 1.00 1.92 C ATOM 1462 OE1 GLN A 112 -9.300 14.798 -3.408 1.00 2.20 O ATOM 1463 NE2 GLN A 112 -9.791 12.865 -2.517 1.00 3.03 N ATOM 0 H GLN A 112 -8.874 11.896 -7.152 1.00 0.69 H new ATOM 0 HA GLN A 112 -6.532 12.458 -5.564 1.00 0.65 H new ATOM 0 HB2 GLN A 112 -8.972 10.786 -4.814 1.00 0.78 H new ATOM 0 HB3 GLN A 112 -7.920 11.668 -3.725 1.00 0.78 H new ATOM 0 HG2 GLN A 112 -8.740 13.629 -5.584 1.00 1.33 H new ATOM 0 HG3 GLN A 112 -10.182 12.663 -5.344 1.00 1.33 H new ATOM 0 HE21 GLN A 112 -9.912 11.858 -2.628 1.00 3.03 H new ATOM 0 HE22 GLN A 112 -9.942 13.299 -1.606 1.00 3.03 H new ATOM 1472 N ALA A 113 -7.225 9.274 -6.153 1.00 0.52 N ATOM 1473 CA ALA A 113 -6.588 7.926 -6.155 1.00 0.47 C ATOM 1474 C ALA A 113 -5.323 7.965 -7.019 1.00 0.39 C ATOM 1475 O ALA A 113 -4.302 7.399 -6.679 1.00 0.42 O ATOM 1476 CB ALA A 113 -7.569 6.907 -6.730 1.00 0.70 C ATOM 0 H ALA A 113 -8.194 9.297 -6.471 1.00 0.52 H new ATOM 0 HA ALA A 113 -6.323 7.642 -5.137 1.00 0.47 H new ATOM 0 HB1 ALA A 113 -7.108 5.920 -6.734 1.00 0.70 H new ATOM 0 HB2 ALA A 113 -8.470 6.884 -6.118 1.00 0.70 H new ATOM 0 HB3 ALA A 113 -7.830 7.189 -7.750 1.00 0.70 H new ATOM 1482 N ARG A 114 -5.390 8.633 -8.137 1.00 0.48 N ATOM 1483 CA ARG A 114 -4.203 8.717 -9.034 1.00 0.43 C ATOM 1484 C ARG A 114 -3.083 9.493 -8.338 1.00 0.40 C ATOM 1485 O ARG A 114 -1.915 9.264 -8.579 1.00 0.38 O ATOM 1486 CB ARG A 114 -4.603 9.440 -10.320 1.00 0.60 C ATOM 1487 CG ARG A 114 -3.425 9.449 -11.296 1.00 0.36 C ATOM 1488 CD ARG A 114 -3.911 9.917 -12.668 1.00 0.26 C ATOM 1489 NE ARG A 114 -2.844 10.723 -13.324 1.00 1.50 N ATOM 1490 CZ ARG A 114 -2.868 12.026 -13.246 1.00 3.00 C ATOM 1491 NH1 ARG A 114 -3.812 12.697 -13.847 1.00 3.05 N ATOM 1492 NH2 ARG A 114 -1.950 12.658 -12.567 1.00 4.60 N ATOM 0 H ARG A 114 -6.219 9.126 -8.469 1.00 0.48 H new ATOM 0 HA ARG A 114 -3.849 7.713 -9.268 1.00 0.43 H new ATOM 0 HB2 ARG A 114 -5.461 8.945 -10.775 1.00 0.60 H new ATOM 0 HB3 ARG A 114 -4.908 10.462 -10.094 1.00 0.60 H new ATOM 0 HG2 ARG A 114 -2.640 10.110 -10.930 1.00 0.36 H new ATOM 0 HG3 ARG A 114 -2.992 8.451 -11.371 1.00 0.36 H new ATOM 0 HD2 ARG A 114 -4.166 9.058 -13.288 1.00 0.26 H new ATOM 0 HD3 ARG A 114 -4.818 10.513 -12.561 1.00 0.26 H new ATOM 0 HE ARG A 114 -2.094 10.257 -13.834 1.00 1.50 H new ATOM 0 HH11 ARG A 114 -4.530 12.203 -14.377 1.00 3.05 H new ATOM 0 HH12 ARG A 114 -3.832 13.715 -13.787 1.00 3.05 H new ATOM 0 HH21 ARG A 114 -1.212 12.134 -12.096 1.00 4.60 H new ATOM 0 HH22 ARG A 114 -1.970 13.676 -12.507 1.00 4.60 H new ATOM 1506 N ALA A 115 -3.427 10.413 -7.480 1.00 0.47 N ATOM 1507 CA ALA A 115 -2.377 11.206 -6.776 1.00 0.55 C ATOM 1508 C ALA A 115 -1.634 10.317 -5.775 1.00 0.50 C ATOM 1509 O ALA A 115 -0.497 10.576 -5.432 1.00 0.69 O ATOM 1510 CB ALA A 115 -3.032 12.370 -6.034 1.00 0.65 C ATOM 0 H ALA A 115 -4.388 10.651 -7.235 1.00 0.47 H new ATOM 0 HA ALA A 115 -1.667 11.590 -7.508 1.00 0.55 H new ATOM 0 HB1 ALA A 115 -2.266 12.950 -5.519 1.00 0.65 H new ATOM 0 HB2 ALA A 115 -3.553 13.009 -6.747 1.00 0.65 H new ATOM 0 HB3 ALA A 115 -3.744 11.982 -5.306 1.00 0.65 H new ATOM 1516 N VAL A 116 -2.263 9.277 -5.298 1.00 0.31 N ATOM 1517 CA VAL A 116 -1.578 8.390 -4.316 1.00 0.34 C ATOM 1518 C VAL A 116 -0.818 7.283 -5.057 1.00 0.33 C ATOM 1519 O VAL A 116 0.098 6.685 -4.526 1.00 0.33 O ATOM 1520 CB VAL A 116 -2.613 7.767 -3.369 1.00 0.30 C ATOM 1521 CG1 VAL A 116 -3.563 6.852 -4.147 1.00 0.53 C ATOM 1522 CG2 VAL A 116 -1.887 6.948 -2.298 1.00 0.44 C ATOM 0 H VAL A 116 -3.215 9.005 -5.544 1.00 0.31 H new ATOM 0 HA VAL A 116 -0.870 8.980 -3.734 1.00 0.34 H new ATOM 0 HB VAL A 116 -3.192 8.564 -2.902 1.00 0.30 H new ATOM 0 HG11 VAL A 116 -4.291 6.417 -3.462 1.00 0.53 H new ATOM 0 HG12 VAL A 116 -4.083 7.431 -4.910 1.00 0.53 H new ATOM 0 HG13 VAL A 116 -2.992 6.055 -4.623 1.00 0.53 H new ATOM 0 HG21 VAL A 116 -2.618 6.503 -1.623 1.00 0.44 H new ATOM 0 HG22 VAL A 116 -1.306 6.159 -2.775 1.00 0.44 H new ATOM 0 HG23 VAL A 116 -1.219 7.598 -1.733 1.00 0.44 H new ATOM 1532 N GLN A 117 -1.199 6.995 -6.274 1.00 0.42 N ATOM 1533 CA GLN A 117 -0.507 5.920 -7.040 1.00 0.45 C ATOM 1534 C GLN A 117 0.793 6.453 -7.656 1.00 0.49 C ATOM 1535 O GLN A 117 1.818 5.798 -7.631 1.00 0.47 O ATOM 1536 CB GLN A 117 -1.430 5.429 -8.154 1.00 0.41 C ATOM 1537 CG GLN A 117 -0.768 4.260 -8.875 1.00 0.53 C ATOM 1538 CD GLN A 117 -1.411 4.071 -10.251 1.00 0.15 C ATOM 1539 OE1 GLN A 117 -2.548 3.654 -10.351 1.00 1.26 O ATOM 1540 NE2 GLN A 117 -0.725 4.360 -11.324 1.00 0.77 N ATOM 0 H GLN A 117 -1.960 7.459 -6.770 1.00 0.42 H new ATOM 0 HA GLN A 117 -0.265 5.100 -6.364 1.00 0.45 H new ATOM 0 HB2 GLN A 117 -2.389 5.119 -7.738 1.00 0.41 H new ATOM 0 HB3 GLN A 117 -1.633 6.237 -8.857 1.00 0.41 H new ATOM 0 HG2 GLN A 117 0.300 4.446 -8.985 1.00 0.53 H new ATOM 0 HG3 GLN A 117 -0.874 3.349 -8.285 1.00 0.53 H new ATOM 0 HE21 GLN A 117 0.229 4.710 -11.240 1.00 0.77 H new ATOM 0 HE22 GLN A 117 -1.144 4.236 -12.246 1.00 0.77 H new ATOM 1549 N MET A 118 0.762 7.632 -8.216 1.00 0.56 N ATOM 1550 CA MET A 118 1.997 8.199 -8.840 1.00 0.61 C ATOM 1551 C MET A 118 3.177 8.082 -7.867 1.00 0.44 C ATOM 1552 O MET A 118 4.243 7.611 -8.216 1.00 0.33 O ATOM 1553 CB MET A 118 1.766 9.672 -9.178 1.00 0.78 C ATOM 1554 CG MET A 118 0.773 9.783 -10.339 1.00 0.94 C ATOM 1555 SD MET A 118 1.646 9.545 -11.906 1.00 0.57 S ATOM 1556 CE MET A 118 0.948 7.926 -12.313 1.00 2.18 C ATOM 0 H MET A 118 -0.064 8.229 -8.270 1.00 0.56 H new ATOM 0 HA MET A 118 2.224 7.643 -9.749 1.00 0.61 H new ATOM 0 HB2 MET A 118 1.381 10.200 -8.305 1.00 0.78 H new ATOM 0 HB3 MET A 118 2.710 10.146 -9.447 1.00 0.78 H new ATOM 0 HG2 MET A 118 -0.013 9.036 -10.232 1.00 0.94 H new ATOM 0 HG3 MET A 118 0.289 10.759 -10.325 1.00 0.94 H new ATOM 0 HE1 MET A 118 1.656 7.368 -12.926 1.00 2.18 H new ATOM 0 HE2 MET A 118 0.750 7.374 -11.394 1.00 2.18 H new ATOM 0 HE3 MET A 118 0.017 8.059 -12.864 1.00 2.18 H new ATOM 1566 N SER A 119 2.994 8.511 -6.650 1.00 0.46 N ATOM 1567 CA SER A 119 4.102 8.430 -5.659 1.00 0.40 C ATOM 1568 C SER A 119 4.474 6.966 -5.413 1.00 0.28 C ATOM 1569 O SER A 119 5.631 6.603 -5.428 1.00 0.29 O ATOM 1570 CB SER A 119 3.652 9.067 -4.343 1.00 0.50 C ATOM 1571 OG SER A 119 3.870 10.471 -4.403 1.00 0.69 O ATOM 0 H SER A 119 2.125 8.914 -6.299 1.00 0.46 H new ATOM 0 HA SER A 119 4.971 8.961 -6.047 1.00 0.40 H new ATOM 0 HB2 SER A 119 2.597 8.858 -4.166 1.00 0.50 H new ATOM 0 HB3 SER A 119 4.206 8.636 -3.509 1.00 0.50 H new ATOM 0 HG SER A 119 3.439 10.902 -3.636 1.00 0.69 H new ATOM 1577 N THR A 120 3.506 6.124 -5.176 1.00 0.23 N ATOM 1578 CA THR A 120 3.814 4.687 -4.913 1.00 0.24 C ATOM 1579 C THR A 120 4.722 4.125 -6.010 1.00 0.32 C ATOM 1580 O THR A 120 5.442 3.171 -5.795 1.00 0.30 O ATOM 1581 CB THR A 120 2.514 3.883 -4.859 1.00 0.46 C ATOM 1582 OG1 THR A 120 1.876 3.923 -6.127 1.00 1.39 O ATOM 1583 CG2 THR A 120 1.590 4.483 -3.798 1.00 0.74 C ATOM 0 H THR A 120 2.516 6.367 -5.153 1.00 0.23 H new ATOM 0 HA THR A 120 4.331 4.609 -3.956 1.00 0.24 H new ATOM 0 HB THR A 120 2.737 2.847 -4.602 1.00 0.46 H new ATOM 0 HG1 THR A 120 2.123 4.750 -6.592 1.00 1.39 H new ATOM 0 HG21 THR A 120 0.663 3.911 -3.758 1.00 0.74 H new ATOM 0 HG22 THR A 120 2.081 4.447 -2.825 1.00 0.74 H new ATOM 0 HG23 THR A 120 1.367 5.519 -4.054 1.00 0.74 H new ATOM 1591 N LYS A 121 4.715 4.709 -7.177 1.00 0.44 N ATOM 1592 CA LYS A 121 5.603 4.196 -8.259 1.00 0.57 C ATOM 1593 C LYS A 121 6.991 4.793 -8.048 1.00 0.55 C ATOM 1594 O LYS A 121 8.003 4.149 -8.243 1.00 0.62 O ATOM 1595 CB LYS A 121 5.060 4.629 -9.625 1.00 0.77 C ATOM 1596 CG LYS A 121 3.570 4.298 -9.715 1.00 0.99 C ATOM 1597 CD LYS A 121 3.342 3.265 -10.821 1.00 0.92 C ATOM 1598 CE LYS A 121 3.572 3.919 -12.185 1.00 1.58 C ATOM 1599 NZ LYS A 121 2.283 3.997 -12.929 1.00 2.40 N ATOM 0 H LYS A 121 4.138 5.512 -7.427 1.00 0.44 H new ATOM 0 HA LYS A 121 5.646 3.107 -8.230 1.00 0.57 H new ATOM 0 HB2 LYS A 121 5.214 5.699 -9.766 1.00 0.77 H new ATOM 0 HB3 LYS A 121 5.604 4.121 -10.421 1.00 0.77 H new ATOM 0 HG2 LYS A 121 3.215 3.909 -8.761 1.00 0.99 H new ATOM 0 HG3 LYS A 121 2.998 5.202 -9.924 1.00 0.99 H new ATOM 0 HD2 LYS A 121 4.020 2.422 -10.691 1.00 0.92 H new ATOM 0 HD3 LYS A 121 2.328 2.870 -10.761 1.00 0.92 H new ATOM 0 HE2 LYS A 121 3.989 4.918 -12.054 1.00 1.58 H new ATOM 0 HE3 LYS A 121 4.299 3.343 -12.757 1.00 1.58 H new ATOM 0 HZ1 LYS A 121 2.475 4.132 -13.942 1.00 2.40 H new ATOM 0 HZ2 LYS A 121 1.749 3.115 -12.792 1.00 2.40 H new ATOM 0 HZ3 LYS A 121 1.725 4.799 -12.573 1.00 2.40 H new ATOM 1613 N VAL A 122 7.029 6.028 -7.641 1.00 0.52 N ATOM 1614 CA VAL A 122 8.325 6.713 -7.395 1.00 0.56 C ATOM 1615 C VAL A 122 9.145 5.938 -6.356 1.00 0.47 C ATOM 1616 O VAL A 122 10.357 5.972 -6.373 1.00 0.50 O ATOM 1617 CB VAL A 122 8.032 8.122 -6.875 1.00 0.61 C ATOM 1618 CG1 VAL A 122 9.335 8.813 -6.473 1.00 0.78 C ATOM 1619 CG2 VAL A 122 7.353 8.928 -7.980 1.00 0.76 C ATOM 0 H VAL A 122 6.204 6.601 -7.466 1.00 0.52 H new ATOM 0 HA VAL A 122 8.899 6.762 -8.320 1.00 0.56 H new ATOM 0 HB VAL A 122 7.380 8.058 -6.004 1.00 0.61 H new ATOM 0 HG11 VAL A 122 9.117 9.815 -6.104 1.00 0.78 H new ATOM 0 HG12 VAL A 122 9.826 8.237 -5.689 1.00 0.78 H new ATOM 0 HG13 VAL A 122 9.993 8.881 -7.339 1.00 0.78 H new ATOM 0 HG21 VAL A 122 7.140 9.934 -7.618 1.00 0.76 H new ATOM 0 HG22 VAL A 122 8.012 8.986 -8.846 1.00 0.76 H new ATOM 0 HG23 VAL A 122 6.421 8.441 -8.266 1.00 0.76 H new ATOM 1629 N LEU A 123 8.506 5.251 -5.448 1.00 0.39 N ATOM 1630 CA LEU A 123 9.282 4.494 -4.420 1.00 0.36 C ATOM 1631 C LEU A 123 9.708 3.141 -4.992 1.00 0.34 C ATOM 1632 O LEU A 123 10.663 2.537 -4.543 1.00 0.30 O ATOM 1633 CB LEU A 123 8.417 4.261 -3.173 1.00 0.37 C ATOM 1634 CG LEU A 123 8.124 5.586 -2.451 1.00 0.09 C ATOM 1635 CD1 LEU A 123 9.395 6.423 -2.308 1.00 0.51 C ATOM 1636 CD2 LEU A 123 7.085 6.380 -3.237 1.00 0.58 C ATOM 0 H LEU A 123 7.491 5.180 -5.372 1.00 0.39 H new ATOM 0 HA LEU A 123 10.163 5.074 -4.146 1.00 0.36 H new ATOM 0 HB2 LEU A 123 7.480 3.784 -3.460 1.00 0.37 H new ATOM 0 HB3 LEU A 123 8.928 3.578 -2.494 1.00 0.37 H new ATOM 0 HG LEU A 123 7.743 5.356 -1.456 1.00 0.09 H new ATOM 0 HD11 LEU A 123 9.161 7.355 -1.794 1.00 0.51 H new ATOM 0 HD12 LEU A 123 10.134 5.867 -1.732 1.00 0.51 H new ATOM 0 HD13 LEU A 123 9.798 6.645 -3.296 1.00 0.51 H new ATOM 0 HD21 LEU A 123 6.879 7.319 -2.723 1.00 0.58 H new ATOM 0 HD22 LEU A 123 7.467 6.590 -4.236 1.00 0.58 H new ATOM 0 HD23 LEU A 123 6.166 5.800 -3.314 1.00 0.58 H new ATOM 1648 N ILE A 124 9.006 2.664 -5.977 1.00 0.46 N ATOM 1649 CA ILE A 124 9.357 1.352 -6.587 1.00 0.51 C ATOM 1650 C ILE A 124 10.617 1.510 -7.435 1.00 0.54 C ATOM 1651 O ILE A 124 11.466 0.640 -7.469 1.00 0.50 O ATOM 1652 CB ILE A 124 8.188 0.884 -7.460 1.00 0.63 C ATOM 1653 CG1 ILE A 124 6.983 0.601 -6.567 1.00 0.46 C ATOM 1654 CG2 ILE A 124 8.563 -0.396 -8.207 1.00 0.72 C ATOM 1655 CD1 ILE A 124 5.762 0.306 -7.437 1.00 0.31 C ATOM 0 H ILE A 124 8.198 3.129 -6.390 1.00 0.46 H new ATOM 0 HA ILE A 124 9.546 0.613 -5.809 1.00 0.51 H new ATOM 0 HB ILE A 124 7.950 1.663 -8.184 1.00 0.63 H new ATOM 0 HG12 ILE A 124 7.192 -0.247 -5.915 1.00 0.46 H new ATOM 0 HG13 ILE A 124 6.785 1.458 -5.923 1.00 0.46 H new ATOM 0 HG21 ILE A 124 7.723 -0.717 -8.823 1.00 0.72 H new ATOM 0 HG22 ILE A 124 9.428 -0.206 -8.843 1.00 0.72 H new ATOM 0 HG23 ILE A 124 8.806 -1.179 -7.488 1.00 0.72 H new ATOM 0 HD11 ILE A 124 4.901 0.104 -6.800 1.00 0.31 H new ATOM 0 HD12 ILE A 124 5.550 1.167 -8.071 1.00 0.31 H new ATOM 0 HD13 ILE A 124 5.963 -0.564 -8.062 1.00 0.31 H new ATOM 1667 N GLN A 125 10.750 2.610 -8.117 1.00 0.67 N ATOM 1668 CA GLN A 125 11.954 2.816 -8.955 1.00 0.76 C ATOM 1669 C GLN A 125 13.070 3.424 -8.105 1.00 0.72 C ATOM 1670 O GLN A 125 14.231 3.102 -8.263 1.00 0.79 O ATOM 1671 CB GLN A 125 11.598 3.762 -10.096 1.00 0.85 C ATOM 1672 CG GLN A 125 11.292 2.942 -11.348 1.00 1.00 C ATOM 1673 CD GLN A 125 11.123 3.876 -12.547 1.00 0.76 C ATOM 1674 OE1 GLN A 125 10.401 4.851 -12.474 1.00 0.94 O ATOM 1675 NE2 GLN A 125 11.761 3.616 -13.654 1.00 1.07 N ATOM 0 H GLN A 125 10.075 3.375 -8.129 1.00 0.67 H new ATOM 0 HA GLN A 125 12.297 1.864 -9.359 1.00 0.76 H new ATOM 0 HB2 GLN A 125 10.735 4.370 -9.825 1.00 0.85 H new ATOM 0 HB3 GLN A 125 12.424 4.447 -10.288 1.00 0.85 H new ATOM 0 HG2 GLN A 125 12.099 2.234 -11.537 1.00 1.00 H new ATOM 0 HG3 GLN A 125 10.384 2.358 -11.199 1.00 1.00 H new ATOM 0 HE21 GLN A 125 12.367 2.797 -13.713 1.00 1.07 H new ATOM 0 HE22 GLN A 125 11.655 4.231 -14.461 1.00 1.07 H new ATOM 1684 N PHE A 126 12.727 4.302 -7.202 1.00 0.64 N ATOM 1685 CA PHE A 126 13.767 4.934 -6.340 1.00 0.63 C ATOM 1686 C PHE A 126 14.426 3.871 -5.458 1.00 0.62 C ATOM 1687 O PHE A 126 15.602 3.939 -5.171 1.00 0.70 O ATOM 1688 CB PHE A 126 13.118 5.996 -5.448 1.00 0.55 C ATOM 1689 CG PHE A 126 12.996 7.300 -6.202 1.00 0.53 C ATOM 1690 CD1 PHE A 126 12.559 7.307 -7.532 1.00 0.55 C ATOM 1691 CD2 PHE A 126 13.321 8.507 -5.567 1.00 0.54 C ATOM 1692 CE1 PHE A 126 12.447 8.518 -8.227 1.00 0.53 C ATOM 1693 CE2 PHE A 126 13.208 9.716 -6.262 1.00 0.55 C ATOM 1694 CZ PHE A 126 12.772 9.722 -7.592 1.00 0.53 C ATOM 0 H PHE A 126 11.771 4.609 -7.024 1.00 0.64 H new ATOM 0 HA PHE A 126 14.522 5.398 -6.975 1.00 0.63 H new ATOM 0 HB2 PHE A 126 12.133 5.659 -5.126 1.00 0.55 H new ATOM 0 HB3 PHE A 126 13.715 6.141 -4.548 1.00 0.55 H new ATOM 0 HD1 PHE A 126 12.308 6.378 -8.022 1.00 0.55 H new ATOM 0 HD2 PHE A 126 13.659 8.504 -4.541 1.00 0.54 H new ATOM 0 HE1 PHE A 126 12.110 8.523 -9.253 1.00 0.53 H new ATOM 0 HE2 PHE A 126 13.457 10.645 -5.772 1.00 0.55 H new ATOM 0 HZ PHE A 126 12.686 10.656 -8.128 1.00 0.53 H new ATOM 1704 N LEU A 127 13.679 2.894 -5.016 1.00 0.52 N ATOM 1705 CA LEU A 127 14.271 1.837 -4.142 1.00 0.52 C ATOM 1706 C LEU A 127 14.968 0.780 -5.001 1.00 0.50 C ATOM 1707 O LEU A 127 16.064 0.349 -4.702 1.00 0.53 O ATOM 1708 CB LEU A 127 13.161 1.163 -3.324 1.00 0.51 C ATOM 1709 CG LEU A 127 13.703 0.704 -1.958 1.00 1.31 C ATOM 1710 CD1 LEU A 127 15.008 -0.082 -2.135 1.00 2.98 C ATOM 1711 CD2 LEU A 127 13.965 1.925 -1.073 1.00 0.62 C ATOM 0 H LEU A 127 12.686 2.782 -5.221 1.00 0.52 H new ATOM 0 HA LEU A 127 14.996 2.298 -3.472 1.00 0.52 H new ATOM 0 HB2 LEU A 127 12.334 1.858 -3.179 1.00 0.51 H new ATOM 0 HB3 LEU A 127 12.766 0.307 -3.871 1.00 0.51 H new ATOM 0 HG LEU A 127 12.961 0.058 -1.488 1.00 1.31 H new ATOM 0 HD11 LEU A 127 15.377 -0.399 -1.160 1.00 2.98 H new ATOM 0 HD12 LEU A 127 14.823 -0.959 -2.755 1.00 2.98 H new ATOM 0 HD13 LEU A 127 15.752 0.552 -2.616 1.00 2.98 H new ATOM 0 HD21 LEU A 127 14.349 1.598 -0.106 1.00 0.62 H new ATOM 0 HD22 LEU A 127 14.698 2.573 -1.554 1.00 0.62 H new ATOM 0 HD23 LEU A 127 13.035 2.475 -0.927 1.00 0.62 H new ATOM 1723 N GLN A 128 14.339 0.349 -6.062 1.00 0.46 N ATOM 1724 CA GLN A 128 14.964 -0.687 -6.934 1.00 0.44 C ATOM 1725 C GLN A 128 16.389 -0.264 -7.303 1.00 0.59 C ATOM 1726 O GLN A 128 17.300 -1.068 -7.331 1.00 0.61 O ATOM 1727 CB GLN A 128 14.134 -0.844 -8.208 1.00 0.49 C ATOM 1728 CG GLN A 128 12.898 -1.692 -7.907 1.00 0.56 C ATOM 1729 CD GLN A 128 13.123 -3.115 -8.418 1.00 1.36 C ATOM 1730 OE1 GLN A 128 14.210 -3.459 -8.835 1.00 2.24 O ATOM 1731 NE2 GLN A 128 12.131 -3.964 -8.405 1.00 1.83 N ATOM 0 H GLN A 128 13.419 0.670 -6.362 1.00 0.46 H new ATOM 0 HA GLN A 128 14.999 -1.636 -6.399 1.00 0.44 H new ATOM 0 HB2 GLN A 128 13.835 0.135 -8.583 1.00 0.49 H new ATOM 0 HB3 GLN A 128 14.731 -1.316 -8.988 1.00 0.49 H new ATOM 0 HG2 GLN A 128 12.705 -1.705 -6.834 1.00 0.56 H new ATOM 0 HG3 GLN A 128 12.020 -1.257 -8.384 1.00 0.56 H new ATOM 0 HE21 GLN A 128 11.217 -3.676 -8.055 1.00 1.83 H new ATOM 0 HE22 GLN A 128 12.270 -4.916 -8.745 1.00 1.83 H new ATOM 1740 N LYS A 129 16.587 0.995 -7.584 1.00 0.73 N ATOM 1741 CA LYS A 129 17.951 1.476 -7.947 1.00 0.90 C ATOM 1742 C LYS A 129 18.702 1.885 -6.677 1.00 0.91 C ATOM 1743 O LYS A 129 19.911 1.790 -6.601 1.00 1.01 O ATOM 1744 CB LYS A 129 17.836 2.681 -8.887 1.00 0.96 C ATOM 1745 CG LYS A 129 17.133 3.833 -8.165 1.00 2.60 C ATOM 1746 CD LYS A 129 16.297 4.629 -9.168 1.00 2.10 C ATOM 1747 CE LYS A 129 17.166 5.718 -9.801 1.00 2.95 C ATOM 1748 NZ LYS A 129 16.455 7.029 -9.750 1.00 3.71 N ATOM 0 H LYS A 129 15.862 1.713 -7.578 1.00 0.73 H new ATOM 0 HA LYS A 129 18.497 0.677 -8.449 1.00 0.90 H new ATOM 0 HB2 LYS A 129 18.827 2.995 -9.214 1.00 0.96 H new ATOM 0 HB3 LYS A 129 17.278 2.405 -9.781 1.00 0.96 H new ATOM 0 HG2 LYS A 129 16.495 3.444 -7.372 1.00 2.60 H new ATOM 0 HG3 LYS A 129 17.869 4.483 -7.692 1.00 2.60 H new ATOM 0 HD2 LYS A 129 15.906 3.966 -9.940 1.00 2.10 H new ATOM 0 HD3 LYS A 129 15.439 5.078 -8.668 1.00 2.10 H new ATOM 0 HE2 LYS A 129 18.117 5.789 -9.273 1.00 2.95 H new ATOM 0 HE3 LYS A 129 17.394 5.458 -10.835 1.00 2.95 H new ATOM 0 HZ1 LYS A 129 17.051 7.764 -10.182 1.00 3.71 H new ATOM 0 HZ2 LYS A 129 15.559 6.958 -10.273 1.00 3.71 H new ATOM 0 HZ3 LYS A 129 16.259 7.279 -8.760 1.00 3.71 H new ATOM 1762 N LYS A 130 17.991 2.333 -5.676 1.00 0.88 N ATOM 1763 CA LYS A 130 18.662 2.741 -4.407 1.00 0.97 C ATOM 1764 C LYS A 130 19.001 1.503 -3.578 1.00 0.88 C ATOM 1765 O LYS A 130 19.539 1.610 -2.494 1.00 1.00 O ATOM 1766 CB LYS A 130 17.732 3.656 -3.603 1.00 1.25 C ATOM 1767 CG LYS A 130 18.392 4.030 -2.272 1.00 1.74 C ATOM 1768 CD LYS A 130 17.812 3.165 -1.150 1.00 1.97 C ATOM 1769 CE LYS A 130 18.890 2.900 -0.095 1.00 2.25 C ATOM 1770 NZ LYS A 130 18.447 1.797 0.806 1.00 2.59 N ATOM 0 H LYS A 130 16.976 2.434 -5.682 1.00 0.88 H new ATOM 0 HA LYS A 130 19.581 3.277 -4.646 1.00 0.97 H new ATOM 0 HB2 LYS A 130 17.510 4.557 -4.175 1.00 1.25 H new ATOM 0 HB3 LYS A 130 16.782 3.153 -3.420 1.00 1.25 H new ATOM 0 HG2 LYS A 130 19.470 3.885 -2.336 1.00 1.74 H new ATOM 0 HG3 LYS A 130 18.224 5.085 -2.055 1.00 1.74 H new ATOM 0 HD2 LYS A 130 16.959 3.667 -0.694 1.00 1.97 H new ATOM 0 HD3 LYS A 130 17.447 2.222 -1.556 1.00 1.97 H new ATOM 0 HE2 LYS A 130 19.829 2.633 -0.579 1.00 2.25 H new ATOM 0 HE3 LYS A 130 19.076 3.804 0.485 1.00 2.25 H new ATOM 0 HZ1 LYS A 130 19.180 1.618 1.522 1.00 2.59 H new ATOM 0 HZ2 LYS A 130 17.561 2.069 1.278 1.00 2.59 H new ATOM 0 HZ3 LYS A 130 18.291 0.934 0.247 1.00 2.59 H new ATOM 1784 N ALA A 131 18.709 0.329 -4.069 1.00 0.76 N ATOM 1785 CA ALA A 131 19.043 -0.890 -3.289 1.00 0.84 C ATOM 1786 C ALA A 131 20.472 -1.324 -3.622 1.00 0.75 C ATOM 1787 O ALA A 131 20.737 -2.485 -3.863 1.00 0.93 O ATOM 1788 CB ALA A 131 18.067 -2.015 -3.638 1.00 0.78 C ATOM 0 H ALA A 131 18.258 0.165 -4.969 1.00 0.76 H new ATOM 0 HA ALA A 131 18.965 -0.672 -2.224 1.00 0.84 H new ATOM 0 HB1 ALA A 131 18.318 -2.906 -3.062 1.00 0.78 H new ATOM 0 HB2 ALA A 131 17.051 -1.702 -3.398 1.00 0.78 H new ATOM 0 HB3 ALA A 131 18.136 -2.239 -4.702 1.00 0.78 H new ATOM 1794 N LYS A 132 21.404 -0.405 -3.636 1.00 0.65 N ATOM 1795 CA LYS A 132 22.808 -0.791 -3.941 1.00 0.66 C ATOM 1796 C LYS A 132 23.270 -1.782 -2.877 1.00 0.86 C ATOM 1797 O LYS A 132 23.047 -1.588 -1.699 1.00 1.14 O ATOM 1798 CB LYS A 132 23.708 0.448 -3.925 1.00 0.77 C ATOM 1799 CG LYS A 132 23.641 1.116 -2.551 1.00 1.03 C ATOM 1800 CD LYS A 132 25.002 1.001 -1.864 1.00 1.77 C ATOM 1801 CE LYS A 132 24.805 0.956 -0.348 1.00 2.02 C ATOM 1802 NZ LYS A 132 25.489 2.125 0.276 1.00 2.20 N ATOM 0 H LYS A 132 21.252 0.587 -3.451 1.00 0.65 H new ATOM 0 HA LYS A 132 22.866 -1.245 -4.930 1.00 0.66 H new ATOM 0 HB2 LYS A 132 24.736 0.166 -4.153 1.00 0.77 H new ATOM 0 HB3 LYS A 132 23.391 1.149 -4.697 1.00 0.77 H new ATOM 0 HG2 LYS A 132 23.362 2.164 -2.657 1.00 1.03 H new ATOM 0 HG3 LYS A 132 22.872 0.642 -1.941 1.00 1.03 H new ATOM 0 HD2 LYS A 132 25.517 0.102 -2.201 1.00 1.77 H new ATOM 0 HD3 LYS A 132 25.631 1.849 -2.135 1.00 1.77 H new ATOM 0 HE2 LYS A 132 23.742 0.972 -0.108 1.00 2.02 H new ATOM 0 HE3 LYS A 132 25.209 0.027 0.055 1.00 2.02 H new ATOM 0 HZ1 LYS A 132 25.356 2.095 1.307 1.00 2.20 H new ATOM 0 HZ2 LYS A 132 26.505 2.090 0.057 1.00 2.20 H new ATOM 0 HZ3 LYS A 132 25.084 3.006 -0.100 1.00 2.20 H new ATOM 1816 N ASN A 133 23.890 -2.856 -3.275 1.00 0.77 N ATOM 1817 CA ASN A 133 24.334 -3.861 -2.273 1.00 0.93 C ATOM 1818 C ASN A 133 23.100 -4.406 -1.559 1.00 0.96 C ATOM 1819 O ASN A 133 23.101 -4.646 -0.367 1.00 1.21 O ATOM 1820 CB ASN A 133 25.276 -3.202 -1.263 1.00 1.24 C ATOM 1821 CG ASN A 133 26.065 -4.280 -0.519 1.00 1.14 C ATOM 1822 OD1 ASN A 133 25.493 -5.210 0.015 1.00 1.45 O ATOM 1823 ND2 ASN A 133 27.366 -4.195 -0.462 1.00 1.70 N ATOM 0 H ASN A 133 24.108 -3.081 -4.246 1.00 0.77 H new ATOM 0 HA ASN A 133 24.867 -4.674 -2.766 1.00 0.93 H new ATOM 0 HB2 ASN A 133 25.960 -2.525 -1.776 1.00 1.24 H new ATOM 0 HB3 ASN A 133 24.704 -2.602 -0.555 1.00 1.24 H new ATOM 0 HD21 ASN A 133 27.903 -4.909 0.031 1.00 1.70 H new ATOM 0 HD22 ASN A 133 27.846 -3.415 -0.910 1.00 1.70 H new ATOM 1830 N LEU A 134 22.045 -4.597 -2.298 1.00 0.81 N ATOM 1831 CA LEU A 134 20.785 -5.125 -1.710 1.00 1.02 C ATOM 1832 C LEU A 134 20.210 -6.185 -2.647 1.00 1.28 C ATOM 1833 O LEU A 134 20.902 -6.733 -3.480 1.00 1.48 O ATOM 1834 CB LEU A 134 19.778 -3.983 -1.543 1.00 0.78 C ATOM 1835 CG LEU A 134 19.370 -3.858 -0.074 1.00 1.19 C ATOM 1836 CD1 LEU A 134 18.713 -5.157 0.399 1.00 1.23 C ATOM 1837 CD2 LEU A 134 20.613 -3.577 0.771 1.00 3.50 C ATOM 0 H LEU A 134 22.002 -4.407 -3.299 1.00 0.81 H new ATOM 0 HA LEU A 134 20.988 -5.566 -0.734 1.00 1.02 H new ATOM 0 HB2 LEU A 134 20.216 -3.047 -1.888 1.00 0.78 H new ATOM 0 HB3 LEU A 134 18.898 -4.169 -2.159 1.00 0.78 H new ATOM 0 HG LEU A 134 18.658 -3.040 0.034 1.00 1.19 H new ATOM 0 HD11 LEU A 134 18.426 -5.059 1.446 1.00 1.23 H new ATOM 0 HD12 LEU A 134 17.827 -5.357 -0.203 1.00 1.23 H new ATOM 0 HD13 LEU A 134 19.418 -5.981 0.292 1.00 1.23 H new ATOM 0 HD21 LEU A 134 20.328 -3.487 1.819 1.00 3.50 H new ATOM 0 HD22 LEU A 134 21.323 -4.396 0.657 1.00 3.50 H new ATOM 0 HD23 LEU A 134 21.076 -2.647 0.440 1.00 3.50 H new ATOM 1849 N ASP A 135 18.953 -6.481 -2.515 1.00 1.42 N ATOM 1850 CA ASP A 135 18.335 -7.509 -3.395 1.00 1.82 C ATOM 1851 C ASP A 135 17.315 -6.850 -4.323 1.00 1.12 C ATOM 1852 O ASP A 135 17.152 -5.645 -4.331 1.00 1.65 O ATOM 1853 CB ASP A 135 17.634 -8.561 -2.532 1.00 2.74 C ATOM 1854 CG ASP A 135 18.564 -8.998 -1.399 1.00 3.95 C ATOM 1855 OD1 ASP A 135 19.697 -9.343 -1.690 1.00 4.26 O ATOM 1856 OD2 ASP A 135 18.126 -8.982 -0.261 1.00 4.88 O ATOM 0 H ASP A 135 18.323 -6.056 -1.835 1.00 1.42 H new ATOM 0 HA ASP A 135 19.111 -7.985 -3.994 1.00 1.82 H new ATOM 0 HB2 ASP A 135 16.711 -8.152 -2.121 1.00 2.74 H new ATOM 0 HB3 ASP A 135 17.358 -9.421 -3.142 1.00 2.74 H new ATOM 1861 N ALA A 136 16.612 -7.636 -5.088 1.00 1.39 N ATOM 1862 CA ALA A 136 15.587 -7.082 -5.997 1.00 0.64 C ATOM 1863 C ALA A 136 14.214 -7.481 -5.486 1.00 0.46 C ATOM 1864 O ALA A 136 13.204 -6.943 -5.895 1.00 0.29 O ATOM 1865 CB ALA A 136 15.794 -7.621 -7.413 1.00 0.70 C ATOM 0 H ALA A 136 16.710 -8.651 -5.118 1.00 1.39 H new ATOM 0 HA ALA A 136 15.670 -5.996 -6.025 1.00 0.64 H new ATOM 0 HB1 ALA A 136 15.033 -7.207 -8.075 1.00 0.70 H new ATOM 0 HB2 ALA A 136 16.782 -7.333 -7.771 1.00 0.70 H new ATOM 0 HB3 ALA A 136 15.714 -8.708 -7.404 1.00 0.70 H new ATOM 1871 N ILE A 137 14.173 -8.408 -4.573 1.00 1.18 N ATOM 1872 CA ILE A 137 12.886 -8.833 -4.000 1.00 1.16 C ATOM 1873 C ILE A 137 11.958 -9.356 -5.099 1.00 0.90 C ATOM 1874 O ILE A 137 10.769 -9.505 -4.898 1.00 1.05 O ATOM 1875 CB ILE A 137 12.276 -7.626 -3.290 1.00 1.13 C ATOM 1876 CG1 ILE A 137 13.151 -7.240 -2.097 1.00 1.30 C ATOM 1877 CG2 ILE A 137 10.879 -7.962 -2.788 1.00 1.24 C ATOM 1878 CD1 ILE A 137 14.420 -6.537 -2.587 1.00 0.92 C ATOM 0 H ILE A 137 14.991 -8.890 -4.200 1.00 1.18 H new ATOM 0 HA ILE A 137 13.031 -9.647 -3.290 1.00 1.16 H new ATOM 0 HB ILE A 137 12.217 -6.797 -3.995 1.00 1.13 H new ATOM 0 HG12 ILE A 137 12.597 -6.583 -1.426 1.00 1.30 H new ATOM 0 HG13 ILE A 137 13.415 -8.130 -1.526 1.00 1.30 H new ATOM 0 HG21 ILE A 137 10.455 -7.094 -2.284 1.00 1.24 H new ATOM 0 HG22 ILE A 137 10.246 -8.237 -3.631 1.00 1.24 H new ATOM 0 HG23 ILE A 137 10.935 -8.796 -2.089 1.00 1.24 H new ATOM 0 HD11 ILE A 137 15.039 -6.265 -1.732 1.00 0.92 H new ATOM 0 HD12 ILE A 137 14.978 -7.208 -3.240 1.00 0.92 H new ATOM 0 HD13 ILE A 137 14.148 -5.637 -3.139 1.00 0.92 H new ATOM 1890 N THR A 138 12.487 -9.654 -6.259 1.00 0.88 N ATOM 1891 CA THR A 138 11.632 -10.176 -7.362 1.00 0.77 C ATOM 1892 C THR A 138 10.360 -9.327 -7.486 1.00 0.66 C ATOM 1893 O THR A 138 10.340 -8.168 -7.124 1.00 0.79 O ATOM 1894 CB THR A 138 11.257 -11.631 -7.065 1.00 0.79 C ATOM 1895 OG1 THR A 138 12.125 -12.150 -6.067 1.00 1.10 O ATOM 1896 CG2 THR A 138 11.388 -12.462 -8.343 1.00 0.88 C ATOM 0 H THR A 138 13.476 -9.557 -6.488 1.00 0.88 H new ATOM 0 HA THR A 138 12.182 -10.125 -8.301 1.00 0.77 H new ATOM 0 HB THR A 138 10.228 -11.676 -6.708 1.00 0.79 H new ATOM 0 HG1 THR A 138 11.884 -13.080 -5.876 1.00 1.10 H new ATOM 0 HG21 THR A 138 11.121 -13.498 -8.132 1.00 0.88 H new ATOM 0 HG22 THR A 138 10.720 -12.063 -9.106 1.00 0.88 H new ATOM 0 HG23 THR A 138 12.416 -12.418 -8.702 1.00 0.88 H new ATOM 1904 N THR A 139 9.301 -9.895 -7.985 1.00 0.53 N ATOM 1905 CA THR A 139 8.038 -9.125 -8.118 1.00 0.56 C ATOM 1906 C THR A 139 6.910 -10.089 -8.525 1.00 0.42 C ATOM 1907 O THR A 139 7.164 -11.067 -9.199 1.00 0.53 O ATOM 1908 CB THR A 139 8.236 -8.021 -9.174 1.00 0.77 C ATOM 1909 OG1 THR A 139 7.237 -7.027 -9.019 1.00 0.87 O ATOM 1910 CG2 THR A 139 8.163 -8.600 -10.592 1.00 0.71 C ATOM 0 H THR A 139 9.256 -10.862 -8.307 1.00 0.53 H new ATOM 0 HA THR A 139 7.768 -8.654 -7.173 1.00 0.56 H new ATOM 0 HB THR A 139 9.222 -7.581 -9.028 1.00 0.77 H new ATOM 0 HG1 THR A 139 7.158 -6.511 -9.848 1.00 0.87 H new ATOM 0 HG21 THR A 139 8.306 -7.801 -11.319 1.00 0.71 H new ATOM 0 HG22 THR A 139 8.944 -9.350 -10.719 1.00 0.71 H new ATOM 0 HG23 THR A 139 7.188 -9.061 -10.747 1.00 0.71 H new ATOM 1958 N THR A 143 0.487 -12.127 -14.022 1.00 0.46 N ATOM 1959 CA THR A 143 -0.458 -13.258 -14.221 1.00 0.66 C ATOM 1960 C THR A 143 -1.038 -13.649 -12.862 1.00 0.59 C ATOM 1961 O THR A 143 -2.236 -13.779 -12.699 1.00 0.64 O ATOM 1962 CB THR A 143 0.288 -14.448 -14.829 1.00 0.80 C ATOM 1963 OG1 THR A 143 1.273 -14.906 -13.914 1.00 1.06 O ATOM 1964 CG2 THR A 143 0.958 -14.015 -16.133 1.00 0.56 C ATOM 0 HA THR A 143 -1.261 -12.963 -14.897 1.00 0.66 H new ATOM 0 HB THR A 143 -0.416 -15.254 -15.035 1.00 0.80 H new ATOM 0 HG1 THR A 143 1.750 -15.669 -14.302 1.00 1.06 H new ATOM 0 HG21 THR A 143 1.490 -14.862 -16.567 1.00 0.56 H new ATOM 0 HG22 THR A 143 0.199 -13.665 -16.833 1.00 0.56 H new ATOM 0 HG23 THR A 143 1.663 -13.209 -15.930 1.00 0.56 H new ATOM 1972 N THR A 144 -0.195 -13.818 -11.875 1.00 0.55 N ATOM 1973 CA THR A 144 -0.695 -14.175 -10.518 1.00 0.62 C ATOM 1974 C THR A 144 -1.382 -12.949 -9.920 1.00 0.60 C ATOM 1975 O THR A 144 -2.429 -13.040 -9.308 1.00 0.59 O ATOM 1976 CB THR A 144 0.481 -14.587 -9.628 1.00 0.65 C ATOM 1977 OG1 THR A 144 1.326 -15.480 -10.341 1.00 0.66 O ATOM 1978 CG2 THR A 144 -0.049 -15.276 -8.371 1.00 0.83 C ATOM 0 H THR A 144 0.818 -13.724 -11.953 1.00 0.55 H new ATOM 0 HA THR A 144 -1.397 -15.006 -10.584 1.00 0.62 H new ATOM 0 HB THR A 144 1.050 -13.702 -9.343 1.00 0.65 H new ATOM 0 HG1 THR A 144 2.079 -15.742 -9.772 1.00 0.66 H new ATOM 0 HG21 THR A 144 0.788 -15.570 -7.737 1.00 0.83 H new ATOM 0 HG22 THR A 144 -0.695 -14.589 -7.824 1.00 0.83 H new ATOM 0 HG23 THR A 144 -0.618 -16.162 -8.654 1.00 0.83 H new ATOM 1986 N ASN A 145 -0.803 -11.796 -10.114 1.00 0.62 N ATOM 1987 CA ASN A 145 -1.419 -10.550 -9.586 1.00 0.63 C ATOM 1988 C ASN A 145 -2.785 -10.363 -10.249 1.00 0.61 C ATOM 1989 O ASN A 145 -3.644 -9.671 -9.742 1.00 0.65 O ATOM 1990 CB ASN A 145 -0.520 -9.356 -9.916 1.00 0.62 C ATOM 1991 CG ASN A 145 -0.101 -8.660 -8.620 1.00 0.71 C ATOM 1992 OD1 ASN A 145 1.039 -8.274 -8.464 1.00 0.78 O ATOM 1993 ND2 ASN A 145 -0.983 -8.483 -7.676 1.00 0.76 N ATOM 0 H ASN A 145 0.074 -11.665 -10.618 1.00 0.62 H new ATOM 0 HA ASN A 145 -1.536 -10.619 -8.505 1.00 0.63 H new ATOM 0 HB2 ASN A 145 0.361 -9.691 -10.463 1.00 0.62 H new ATOM 0 HB3 ASN A 145 -1.049 -8.656 -10.563 1.00 0.62 H new ATOM 0 HD21 ASN A 145 -0.715 -8.020 -6.807 1.00 0.76 H new ATOM 0 HD22 ASN A 145 -1.941 -8.807 -7.806 1.00 0.76 H new ATOM 2000 N ALA A 146 -2.991 -10.984 -11.381 1.00 0.59 N ATOM 2001 CA ALA A 146 -4.298 -10.854 -12.074 1.00 0.63 C ATOM 2002 C ALA A 146 -5.338 -11.693 -11.337 1.00 0.72 C ATOM 2003 O ALA A 146 -6.498 -11.344 -11.276 1.00 0.78 O ATOM 2004 CB ALA A 146 -4.159 -11.348 -13.517 1.00 0.60 C ATOM 0 H ALA A 146 -2.307 -11.575 -11.853 1.00 0.59 H new ATOM 0 HA ALA A 146 -4.613 -9.810 -12.082 1.00 0.63 H new ATOM 0 HB1 ALA A 146 -5.117 -11.254 -14.028 1.00 0.60 H new ATOM 0 HB2 ALA A 146 -3.411 -10.749 -14.036 1.00 0.60 H new ATOM 0 HB3 ALA A 146 -3.850 -12.393 -13.516 1.00 0.60 H new ATOM 2010 N SER A 147 -4.931 -12.793 -10.766 1.00 0.74 N ATOM 2011 CA SER A 147 -5.901 -13.642 -10.024 1.00 0.82 C ATOM 2012 C SER A 147 -6.312 -12.919 -8.742 1.00 0.72 C ATOM 2013 O SER A 147 -7.473 -12.852 -8.406 1.00 0.61 O ATOM 2014 CB SER A 147 -5.252 -14.980 -9.670 1.00 0.95 C ATOM 2015 OG SER A 147 -6.217 -15.818 -9.046 1.00 1.62 O ATOM 0 H SER A 147 -3.972 -13.139 -10.782 1.00 0.74 H new ATOM 0 HA SER A 147 -6.778 -13.825 -10.645 1.00 0.82 H new ATOM 0 HB2 SER A 147 -4.864 -15.459 -10.569 1.00 0.95 H new ATOM 0 HB3 SER A 147 -4.405 -14.821 -9.003 1.00 0.95 H new ATOM 0 HG SER A 147 -5.805 -16.678 -8.819 1.00 1.62 H new ATOM 2021 N LEU A 148 -5.373 -12.363 -8.027 1.00 0.75 N ATOM 2022 CA LEU A 148 -5.738 -11.635 -6.781 1.00 0.66 C ATOM 2023 C LEU A 148 -6.681 -10.490 -7.155 1.00 0.59 C ATOM 2024 O LEU A 148 -7.694 -10.270 -6.524 1.00 0.52 O ATOM 2025 CB LEU A 148 -4.467 -11.073 -6.118 1.00 0.64 C ATOM 2026 CG LEU A 148 -4.820 -9.926 -5.155 1.00 0.50 C ATOM 2027 CD1 LEU A 148 -5.798 -10.419 -4.087 1.00 0.56 C ATOM 2028 CD2 LEU A 148 -3.554 -9.417 -4.483 1.00 0.55 C ATOM 0 H LEU A 148 -4.378 -12.381 -8.249 1.00 0.75 H new ATOM 0 HA LEU A 148 -6.228 -12.309 -6.078 1.00 0.66 H new ATOM 0 HB2 LEU A 148 -3.953 -11.866 -5.575 1.00 0.64 H new ATOM 0 HB3 LEU A 148 -3.780 -10.714 -6.884 1.00 0.64 H new ATOM 0 HG LEU A 148 -5.285 -9.119 -5.721 1.00 0.50 H new ATOM 0 HD11 LEU A 148 -6.041 -9.600 -3.411 1.00 0.56 H new ATOM 0 HD12 LEU A 148 -6.709 -10.777 -4.566 1.00 0.56 H new ATOM 0 HD13 LEU A 148 -5.341 -11.232 -3.523 1.00 0.56 H new ATOM 0 HD21 LEU A 148 -3.805 -8.605 -3.801 1.00 0.55 H new ATOM 0 HD22 LEU A 148 -3.087 -10.228 -3.924 1.00 0.55 H new ATOM 0 HD23 LEU A 148 -2.861 -9.053 -5.241 1.00 0.55 H new ATOM 2040 N LEU A 149 -6.339 -9.752 -8.170 1.00 0.61 N ATOM 2041 CA LEU A 149 -7.199 -8.617 -8.582 1.00 0.58 C ATOM 2042 C LEU A 149 -8.539 -9.155 -9.075 1.00 0.58 C ATOM 2043 O LEU A 149 -9.543 -8.479 -9.022 1.00 0.47 O ATOM 2044 CB LEU A 149 -6.503 -7.832 -9.698 1.00 0.60 C ATOM 2045 CG LEU A 149 -7.306 -6.570 -10.038 1.00 0.58 C ATOM 2046 CD1 LEU A 149 -7.574 -5.761 -8.765 1.00 0.55 C ATOM 2047 CD2 LEU A 149 -6.504 -5.712 -11.019 1.00 0.66 C ATOM 0 H LEU A 149 -5.499 -9.887 -8.732 1.00 0.61 H new ATOM 0 HA LEU A 149 -7.370 -7.953 -7.734 1.00 0.58 H new ATOM 0 HB2 LEU A 149 -5.495 -7.558 -9.386 1.00 0.60 H new ATOM 0 HB3 LEU A 149 -6.403 -8.458 -10.585 1.00 0.60 H new ATOM 0 HG LEU A 149 -8.256 -6.860 -10.486 1.00 0.58 H new ATOM 0 HD11 LEU A 149 -8.145 -4.867 -9.016 1.00 0.55 H new ATOM 0 HD12 LEU A 149 -8.142 -6.369 -8.061 1.00 0.55 H new ATOM 0 HD13 LEU A 149 -6.626 -5.471 -8.312 1.00 0.55 H new ATOM 0 HD21 LEU A 149 -7.071 -4.814 -11.264 1.00 0.66 H new ATOM 0 HD22 LEU A 149 -5.555 -5.430 -10.564 1.00 0.66 H new ATOM 0 HD23 LEU A 149 -6.315 -6.281 -11.929 1.00 0.66 H new ATOM 2059 N THR A 150 -8.566 -10.375 -9.537 1.00 0.80 N ATOM 2060 CA THR A 150 -9.849 -10.962 -10.015 1.00 0.81 C ATOM 2061 C THR A 150 -10.636 -11.484 -8.800 1.00 0.81 C ATOM 2062 O THR A 150 -11.830 -11.695 -8.864 1.00 0.82 O ATOM 2063 CB THR A 150 -9.548 -12.085 -11.045 1.00 0.83 C ATOM 2064 OG1 THR A 150 -10.564 -12.085 -12.037 1.00 0.81 O ATOM 2065 CG2 THR A 150 -9.486 -13.480 -10.398 1.00 1.20 C ATOM 0 H THR A 150 -7.755 -10.990 -9.604 1.00 0.80 H new ATOM 0 HA THR A 150 -10.460 -10.212 -10.517 1.00 0.81 H new ATOM 0 HB THR A 150 -8.569 -11.878 -11.478 1.00 0.83 H new ATOM 0 HG1 THR A 150 -10.381 -12.790 -12.693 1.00 0.81 H new ATOM 0 HG21 THR A 150 -9.273 -14.227 -11.163 1.00 1.20 H new ATOM 0 HG22 THR A 150 -8.698 -13.497 -9.645 1.00 1.20 H new ATOM 0 HG23 THR A 150 -10.443 -13.706 -9.927 1.00 1.20 H new ATOM 2073 N LYS A 151 -9.963 -11.697 -7.698 1.00 0.79 N ATOM 2074 CA LYS A 151 -10.646 -12.208 -6.478 1.00 0.78 C ATOM 2075 C LYS A 151 -11.355 -11.054 -5.765 1.00 0.63 C ATOM 2076 O LYS A 151 -12.534 -11.131 -5.480 1.00 0.41 O ATOM 2077 CB LYS A 151 -9.609 -12.830 -5.542 1.00 0.83 C ATOM 2078 CG LYS A 151 -10.317 -13.579 -4.412 1.00 0.83 C ATOM 2079 CD LYS A 151 -9.534 -13.392 -3.111 1.00 0.90 C ATOM 2080 CE LYS A 151 -10.039 -12.139 -2.388 1.00 0.99 C ATOM 2081 NZ LYS A 151 -10.637 -12.514 -1.072 1.00 1.42 N ATOM 0 H LYS A 151 -8.961 -11.536 -7.593 1.00 0.79 H new ATOM 0 HA LYS A 151 -11.381 -12.962 -6.760 1.00 0.78 H new ATOM 0 HB2 LYS A 151 -8.967 -13.513 -6.098 1.00 0.83 H new ATOM 0 HB3 LYS A 151 -8.966 -12.053 -5.129 1.00 0.83 H new ATOM 0 HG2 LYS A 151 -11.334 -13.205 -4.294 1.00 0.83 H new ATOM 0 HG3 LYS A 151 -10.393 -14.639 -4.655 1.00 0.83 H new ATOM 0 HD2 LYS A 151 -9.654 -14.267 -2.472 1.00 0.90 H new ATOM 0 HD3 LYS A 151 -8.469 -13.298 -3.325 1.00 0.90 H new ATOM 0 HE2 LYS A 151 -9.216 -11.440 -2.237 1.00 0.99 H new ATOM 0 HE3 LYS A 151 -10.782 -11.629 -3.002 1.00 0.99 H new ATOM 0 HZ1 LYS A 151 -10.977 -11.658 -0.589 1.00 1.42 H new ATOM 0 HZ2 LYS A 151 -11.434 -13.164 -1.226 1.00 1.42 H new ATOM 0 HZ3 LYS A 151 -9.917 -12.981 -0.484 1.00 1.42 H new ATOM 2095 N LEU A 152 -10.663 -9.978 -5.486 1.00 0.80 N ATOM 2096 CA LEU A 152 -11.350 -8.839 -4.807 1.00 0.69 C ATOM 2097 C LEU A 152 -12.429 -8.332 -5.750 1.00 0.55 C ATOM 2098 O LEU A 152 -13.512 -7.975 -5.335 1.00 0.45 O ATOM 2099 CB LEU A 152 -10.395 -7.681 -4.449 1.00 0.91 C ATOM 2100 CG LEU A 152 -9.113 -7.712 -5.284 1.00 0.23 C ATOM 2101 CD1 LEU A 152 -8.599 -6.284 -5.482 1.00 0.78 C ATOM 2102 CD2 LEU A 152 -8.055 -8.527 -4.541 1.00 0.86 C ATOM 0 H LEU A 152 -9.674 -9.840 -5.694 1.00 0.80 H new ATOM 0 HA LEU A 152 -11.763 -9.198 -3.864 1.00 0.69 H new ATOM 0 HB2 LEU A 152 -10.905 -6.730 -4.604 1.00 0.91 H new ATOM 0 HB3 LEU A 152 -10.139 -7.737 -3.391 1.00 0.91 H new ATOM 0 HG LEU A 152 -9.318 -8.164 -6.255 1.00 0.23 H new ATOM 0 HD11 LEU A 152 -7.686 -6.305 -6.077 1.00 0.78 H new ATOM 0 HD12 LEU A 152 -9.355 -5.694 -5.999 1.00 0.78 H new ATOM 0 HD13 LEU A 152 -8.389 -5.835 -4.511 1.00 0.78 H new ATOM 0 HD21 LEU A 152 -7.138 -8.554 -5.129 1.00 0.86 H new ATOM 0 HD22 LEU A 152 -7.853 -8.066 -3.574 1.00 0.86 H new ATOM 0 HD23 LEU A 152 -8.419 -9.543 -4.389 1.00 0.86 H new ATOM 2114 N GLN A 153 -12.149 -8.313 -7.024 1.00 0.66 N ATOM 2115 CA GLN A 153 -13.176 -7.844 -7.983 1.00 0.70 C ATOM 2116 C GLN A 153 -14.299 -8.883 -8.060 1.00 0.65 C ATOM 2117 O GLN A 153 -15.419 -8.577 -8.415 1.00 0.62 O ATOM 2118 CB GLN A 153 -12.562 -7.662 -9.373 1.00 0.97 C ATOM 2119 CG GLN A 153 -12.343 -6.172 -9.649 1.00 0.71 C ATOM 2120 CD GLN A 153 -13.316 -5.706 -10.735 1.00 0.92 C ATOM 2121 OE1 GLN A 153 -14.267 -6.393 -11.050 1.00 1.73 O ATOM 2122 NE2 GLN A 153 -13.115 -4.560 -11.326 1.00 0.38 N ATOM 0 H GLN A 153 -11.261 -8.600 -7.435 1.00 0.66 H new ATOM 0 HA GLN A 153 -13.571 -6.887 -7.643 1.00 0.70 H new ATOM 0 HB2 GLN A 153 -11.614 -8.196 -9.435 1.00 0.97 H new ATOM 0 HB3 GLN A 153 -13.219 -8.089 -10.130 1.00 0.97 H new ATOM 0 HG2 GLN A 153 -12.496 -5.596 -8.737 1.00 0.71 H new ATOM 0 HG3 GLN A 153 -11.315 -5.997 -9.967 1.00 0.71 H new ATOM 0 HE21 GLN A 153 -12.317 -3.983 -11.062 1.00 0.38 H new ATOM 0 HE22 GLN A 153 -13.756 -4.241 -12.052 1.00 0.38 H new ATOM 2131 N ALA A 154 -14.000 -10.113 -7.731 1.00 0.68 N ATOM 2132 CA ALA A 154 -15.040 -11.180 -7.786 1.00 0.67 C ATOM 2133 C ALA A 154 -15.751 -11.283 -6.433 1.00 0.68 C ATOM 2134 O ALA A 154 -15.988 -12.362 -5.928 1.00 1.19 O ATOM 2135 CB ALA A 154 -14.373 -12.518 -8.109 1.00 0.69 C ATOM 0 H ALA A 154 -13.078 -10.424 -7.426 1.00 0.68 H new ATOM 0 HA ALA A 154 -15.769 -10.933 -8.558 1.00 0.67 H new ATOM 0 HB1 ALA A 154 -15.130 -13.301 -8.150 1.00 0.69 H new ATOM 0 HB2 ALA A 154 -13.869 -12.450 -9.073 1.00 0.69 H new ATOM 0 HB3 ALA A 154 -13.645 -12.758 -7.334 1.00 0.69 H new ATOM 2141 N GLN A 155 -16.094 -10.171 -5.845 1.00 0.17 N ATOM 2142 CA GLN A 155 -16.791 -10.208 -4.527 1.00 0.17 C ATOM 2143 C GLN A 155 -18.098 -9.418 -4.622 1.00 0.18 C ATOM 2144 O GLN A 155 -18.251 -8.556 -5.462 1.00 0.34 O ATOM 2145 CB GLN A 155 -15.900 -9.576 -3.457 1.00 0.19 C ATOM 2146 CG GLN A 155 -14.574 -10.334 -3.378 1.00 0.40 C ATOM 2147 CD GLN A 155 -14.244 -10.627 -1.913 1.00 0.75 C ATOM 2148 OE1 GLN A 155 -14.546 -11.691 -1.412 1.00 1.07 O ATOM 2149 NE2 GLN A 155 -13.634 -9.720 -1.201 1.00 1.33 N ATOM 0 H GLN A 155 -15.922 -9.238 -6.219 1.00 0.17 H new ATOM 0 HA GLN A 155 -17.003 -11.243 -4.260 1.00 0.17 H new ATOM 0 HB2 GLN A 155 -15.717 -8.528 -3.694 1.00 0.19 H new ATOM 0 HB3 GLN A 155 -16.403 -9.601 -2.490 1.00 0.19 H new ATOM 0 HG2 GLN A 155 -14.640 -11.265 -3.941 1.00 0.40 H new ATOM 0 HG3 GLN A 155 -13.777 -9.744 -3.831 1.00 0.40 H new ATOM 0 HE21 GLN A 155 -13.380 -8.826 -1.622 1.00 1.33 H new ATOM 0 HE22 GLN A 155 -13.411 -9.905 -0.223 1.00 1.33 H new ATOM 2158 N ASN A 156 -19.041 -9.695 -3.760 1.00 0.12 N ATOM 2159 CA ASN A 156 -20.326 -8.944 -3.803 1.00 0.16 C ATOM 2160 C ASN A 156 -20.026 -7.451 -3.672 1.00 0.19 C ATOM 2161 O ASN A 156 -18.934 -7.063 -3.312 1.00 0.42 O ATOM 2162 CB ASN A 156 -21.223 -9.389 -2.644 1.00 0.32 C ATOM 2163 CG ASN A 156 -22.091 -10.568 -3.090 1.00 0.53 C ATOM 2164 OD1 ASN A 156 -23.061 -10.388 -3.799 1.00 1.18 O ATOM 2165 ND2 ASN A 156 -21.782 -11.773 -2.699 1.00 0.39 N ATOM 0 H ASN A 156 -18.976 -10.406 -3.032 1.00 0.12 H new ATOM 0 HA ASN A 156 -20.838 -9.141 -4.745 1.00 0.16 H new ATOM 0 HB2 ASN A 156 -20.612 -9.677 -1.788 1.00 0.32 H new ATOM 0 HB3 ASN A 156 -21.854 -8.561 -2.321 1.00 0.32 H new ATOM 0 HD21 ASN A 156 -22.355 -12.566 -2.988 1.00 0.39 H new ATOM 0 HD22 ASN A 156 -20.967 -11.923 -2.104 1.00 0.39 H new ATOM 2172 N GLN A 157 -20.977 -6.609 -3.960 1.00 0.24 N ATOM 2173 CA GLN A 157 -20.726 -5.145 -3.844 1.00 0.31 C ATOM 2174 C GLN A 157 -20.353 -4.811 -2.399 1.00 0.33 C ATOM 2175 O GLN A 157 -19.604 -3.893 -2.133 1.00 0.32 O ATOM 2176 CB GLN A 157 -21.989 -4.380 -4.234 1.00 0.52 C ATOM 2177 CG GLN A 157 -21.705 -2.880 -4.198 1.00 0.86 C ATOM 2178 CD GLN A 157 -20.812 -2.502 -5.382 1.00 2.02 C ATOM 2179 OE1 GLN A 157 -20.959 -3.038 -6.463 1.00 2.39 O ATOM 2180 NE2 GLN A 157 -19.884 -1.596 -5.225 1.00 3.07 N ATOM 0 H GLN A 157 -21.914 -6.868 -4.269 1.00 0.24 H new ATOM 0 HA GLN A 157 -19.910 -4.859 -4.508 1.00 0.31 H new ATOM 0 HB2 GLN A 157 -22.313 -4.676 -5.232 1.00 0.52 H new ATOM 0 HB3 GLN A 157 -22.801 -4.624 -3.549 1.00 0.52 H new ATOM 0 HG2 GLN A 157 -22.640 -2.321 -4.240 1.00 0.86 H new ATOM 0 HG3 GLN A 157 -21.217 -2.614 -3.261 1.00 0.86 H new ATOM 0 HE21 GLN A 157 -19.759 -1.145 -4.318 1.00 3.07 H new ATOM 0 HE22 GLN A 157 -19.284 -1.339 -6.009 1.00 3.07 H new ATOM 2189 N TRP A 158 -20.875 -5.556 -1.467 1.00 0.40 N ATOM 2190 CA TRP A 158 -20.564 -5.302 -0.032 1.00 0.49 C ATOM 2191 C TRP A 158 -19.073 -5.545 0.221 1.00 0.43 C ATOM 2192 O TRP A 158 -18.339 -4.649 0.590 1.00 0.42 O ATOM 2193 CB TRP A 158 -21.394 -6.258 0.829 1.00 0.59 C ATOM 2194 CG TRP A 158 -21.261 -5.908 2.275 1.00 0.81 C ATOM 2195 CD1 TRP A 158 -20.102 -5.905 2.973 1.00 0.96 C ATOM 2196 CD2 TRP A 158 -22.308 -5.528 3.215 1.00 1.02 C ATOM 2197 NE1 TRP A 158 -20.372 -5.547 4.281 1.00 1.13 N ATOM 2198 CE2 TRP A 158 -21.717 -5.303 4.480 1.00 1.18 C ATOM 2199 CE3 TRP A 158 -23.699 -5.355 3.093 1.00 1.19 C ATOM 2200 CZ2 TRP A 158 -22.478 -4.926 5.585 1.00 1.43 C ATOM 2201 CZ3 TRP A 158 -24.469 -4.974 4.205 1.00 1.49 C ATOM 2202 CH2 TRP A 158 -23.859 -4.759 5.449 1.00 1.59 C ATOM 0 H TRP A 158 -21.509 -6.337 -1.638 1.00 0.40 H new ATOM 0 HA TRP A 158 -20.805 -4.270 0.223 1.00 0.49 H new ATOM 0 HB2 TRP A 158 -22.441 -6.208 0.532 1.00 0.59 H new ATOM 0 HB3 TRP A 158 -21.064 -7.284 0.665 1.00 0.59 H new ATOM 0 HD1 TRP A 158 -19.127 -6.143 2.574 1.00 0.96 H new ATOM 0 HE1 TRP A 158 -19.663 -5.472 5.011 1.00 1.13 H new ATOM 0 HE3 TRP A 158 -24.178 -5.516 2.139 1.00 1.19 H new ATOM 0 HZ2 TRP A 158 -22.003 -4.764 6.541 1.00 1.43 H new ATOM 0 HZ3 TRP A 158 -25.536 -4.846 4.101 1.00 1.49 H new ATOM 0 HH2 TRP A 158 -24.455 -4.465 6.300 1.00 1.59 H new ATOM 2213 N LEU A 159 -18.623 -6.754 0.029 1.00 0.41 N ATOM 2214 CA LEU A 159 -17.183 -7.062 0.263 1.00 0.43 C ATOM 2215 C LEU A 159 -16.312 -6.383 -0.799 1.00 0.19 C ATOM 2216 O LEU A 159 -15.101 -6.363 -0.694 1.00 0.24 O ATOM 2217 CB LEU A 159 -16.976 -8.574 0.202 1.00 0.64 C ATOM 2218 CG LEU A 159 -17.587 -9.220 1.447 1.00 1.04 C ATOM 2219 CD1 LEU A 159 -17.498 -10.742 1.329 1.00 1.00 C ATOM 2220 CD2 LEU A 159 -16.817 -8.758 2.685 1.00 1.68 C ATOM 0 H LEU A 159 -19.190 -7.543 -0.280 1.00 0.41 H new ATOM 0 HA LEU A 159 -16.894 -6.687 1.245 1.00 0.43 H new ATOM 0 HB2 LEU A 159 -17.440 -8.980 -0.697 1.00 0.64 H new ATOM 0 HB3 LEU A 159 -15.912 -8.805 0.144 1.00 0.64 H new ATOM 0 HG LEU A 159 -18.633 -8.925 1.536 1.00 1.04 H new ATOM 0 HD11 LEU A 159 -17.933 -11.202 2.216 1.00 1.00 H new ATOM 0 HD12 LEU A 159 -18.044 -11.071 0.445 1.00 1.00 H new ATOM 0 HD13 LEU A 159 -16.453 -11.040 1.242 1.00 1.00 H new ATOM 0 HD21 LEU A 159 -17.249 -9.216 3.574 1.00 1.68 H new ATOM 0 HD22 LEU A 159 -15.772 -9.055 2.595 1.00 1.68 H new ATOM 0 HD23 LEU A 159 -16.880 -7.673 2.769 1.00 1.68 H new ATOM 2232 N GLN A 160 -16.907 -5.813 -1.815 1.00 0.19 N ATOM 2233 CA GLN A 160 -16.093 -5.130 -2.859 1.00 0.13 C ATOM 2234 C GLN A 160 -15.631 -3.792 -2.300 1.00 0.25 C ATOM 2235 O GLN A 160 -14.452 -3.500 -2.248 1.00 0.51 O ATOM 2236 CB GLN A 160 -16.946 -4.897 -4.109 1.00 0.12 C ATOM 2237 CG GLN A 160 -16.050 -4.428 -5.257 1.00 0.75 C ATOM 2238 CD GLN A 160 -15.765 -2.931 -5.108 1.00 2.05 C ATOM 2239 OE1 GLN A 160 -16.676 -2.136 -4.988 1.00 2.52 O ATOM 2240 NE2 GLN A 160 -14.529 -2.513 -5.110 1.00 3.31 N ATOM 0 H GLN A 160 -17.916 -5.792 -1.965 1.00 0.19 H new ATOM 0 HA GLN A 160 -15.234 -5.745 -3.129 1.00 0.13 H new ATOM 0 HB2 GLN A 160 -17.461 -5.816 -4.388 1.00 0.12 H new ATOM 0 HB3 GLN A 160 -17.714 -4.151 -3.905 1.00 0.12 H new ATOM 0 HG2 GLN A 160 -15.115 -4.988 -5.254 1.00 0.75 H new ATOM 0 HG3 GLN A 160 -16.535 -4.623 -6.213 1.00 0.75 H new ATOM 0 HE21 GLN A 160 -13.765 -3.181 -5.211 1.00 3.31 H new ATOM 0 HE22 GLN A 160 -14.327 -1.518 -5.011 1.00 3.31 H new ATOM 2249 N ASP A 161 -16.551 -2.984 -1.855 1.00 0.53 N ATOM 2250 CA ASP A 161 -16.165 -1.677 -1.270 1.00 0.72 C ATOM 2251 C ASP A 161 -15.267 -1.945 -0.065 1.00 0.56 C ATOM 2252 O ASP A 161 -14.340 -1.211 0.208 1.00 0.67 O ATOM 2253 CB ASP A 161 -17.420 -0.931 -0.821 1.00 1.00 C ATOM 2254 CG ASP A 161 -17.154 0.575 -0.836 1.00 1.48 C ATOM 2255 OD1 ASP A 161 -16.112 0.979 -0.348 1.00 1.27 O ATOM 2256 OD2 ASP A 161 -17.997 1.301 -1.337 1.00 2.31 O ATOM 0 H ASP A 161 -17.553 -3.175 -1.872 1.00 0.53 H new ATOM 0 HA ASP A 161 -15.638 -1.070 -2.006 1.00 0.72 H new ATOM 0 HB2 ASP A 161 -18.253 -1.170 -1.482 1.00 1.00 H new ATOM 0 HB3 ASP A 161 -17.706 -1.250 0.181 1.00 1.00 H new ATOM 2261 N MET A 162 -15.526 -3.006 0.650 1.00 0.42 N ATOM 2262 CA MET A 162 -14.674 -3.334 1.823 1.00 0.34 C ATOM 2263 C MET A 162 -13.232 -3.495 1.343 1.00 0.19 C ATOM 2264 O MET A 162 -12.310 -2.973 1.932 1.00 0.25 O ATOM 2265 CB MET A 162 -15.153 -4.645 2.461 1.00 0.45 C ATOM 2266 CG MET A 162 -14.170 -5.081 3.558 1.00 0.83 C ATOM 2267 SD MET A 162 -12.919 -6.182 2.846 1.00 0.81 S ATOM 2268 CE MET A 162 -11.469 -5.147 3.172 1.00 0.51 C ATOM 0 H MET A 162 -16.290 -3.658 0.471 1.00 0.42 H new ATOM 0 HA MET A 162 -14.737 -2.537 2.564 1.00 0.34 H new ATOM 0 HB2 MET A 162 -16.148 -4.511 2.884 1.00 0.45 H new ATOM 0 HB3 MET A 162 -15.232 -5.422 1.701 1.00 0.45 H new ATOM 0 HG2 MET A 162 -13.691 -4.207 4.000 1.00 0.83 H new ATOM 0 HG3 MET A 162 -14.705 -5.591 4.359 1.00 0.83 H new ATOM 0 HE1 MET A 162 -11.000 -4.870 2.228 1.00 0.51 H new ATOM 0 HE2 MET A 162 -11.777 -4.246 3.702 1.00 0.51 H new ATOM 0 HE3 MET A 162 -10.756 -5.701 3.783 1.00 0.51 H new ATOM 2278 N THR A 163 -13.032 -4.220 0.268 1.00 0.15 N ATOM 2279 CA THR A 163 -11.649 -4.426 -0.261 1.00 0.25 C ATOM 2280 C THR A 163 -10.896 -3.089 -0.292 1.00 0.27 C ATOM 2281 O THR A 163 -9.827 -2.965 0.262 1.00 0.29 O ATOM 2282 CB THR A 163 -11.722 -5.018 -1.670 1.00 0.39 C ATOM 2283 OG1 THR A 163 -12.366 -6.283 -1.615 1.00 0.45 O ATOM 2284 CG2 THR A 163 -10.307 -5.190 -2.224 1.00 0.43 C ATOM 0 H THR A 163 -13.770 -4.679 -0.266 1.00 0.15 H new ATOM 0 HA THR A 163 -11.114 -5.116 0.391 1.00 0.25 H new ATOM 0 HB THR A 163 -12.287 -4.349 -2.319 1.00 0.39 H new ATOM 0 HG1 THR A 163 -13.309 -6.160 -1.379 1.00 0.45 H new ATOM 0 HG21 THR A 163 -10.358 -5.612 -3.228 1.00 0.43 H new ATOM 0 HG22 THR A 163 -9.811 -4.220 -2.263 1.00 0.43 H new ATOM 0 HG23 THR A 163 -9.742 -5.861 -1.577 1.00 0.43 H new ATOM 2292 N THR A 164 -11.450 -2.085 -0.916 1.00 0.37 N ATOM 2293 CA THR A 164 -10.755 -0.764 -0.957 1.00 0.44 C ATOM 2294 C THR A 164 -10.403 -0.325 0.470 1.00 0.41 C ATOM 2295 O THR A 164 -9.336 0.193 0.724 1.00 0.50 O ATOM 2296 CB THR A 164 -11.672 0.279 -1.606 1.00 0.51 C ATOM 2297 OG1 THR A 164 -12.885 0.363 -0.875 1.00 1.13 O ATOM 2298 CG2 THR A 164 -11.969 -0.128 -3.050 1.00 2.09 C ATOM 0 H THR A 164 -12.349 -2.120 -1.397 1.00 0.37 H new ATOM 0 HA THR A 164 -9.840 -0.854 -1.543 1.00 0.44 H new ATOM 0 HB THR A 164 -11.178 1.251 -1.600 1.00 0.51 H new ATOM 0 HG1 THR A 164 -13.394 -0.466 -0.990 1.00 1.13 H new ATOM 0 HG21 THR A 164 -12.621 0.614 -3.510 1.00 2.09 H new ATOM 0 HG22 THR A 164 -11.036 -0.189 -3.610 1.00 2.09 H new ATOM 0 HG23 THR A 164 -12.462 -1.100 -3.060 1.00 2.09 H new ATOM 2306 N HIS A 165 -11.296 -0.528 1.400 1.00 0.30 N ATOM 2307 CA HIS A 165 -11.026 -0.126 2.813 1.00 0.29 C ATOM 2308 C HIS A 165 -9.709 -0.740 3.302 1.00 0.24 C ATOM 2309 O HIS A 165 -8.744 -0.045 3.544 1.00 0.34 O ATOM 2310 CB HIS A 165 -12.172 -0.619 3.708 1.00 0.27 C ATOM 2311 CG HIS A 165 -11.894 -0.265 5.144 1.00 0.29 C ATOM 2312 ND1 HIS A 165 -12.298 -1.077 6.192 1.00 0.66 N ATOM 2313 CD2 HIS A 165 -11.246 0.797 5.720 1.00 0.75 C ATOM 2314 CE1 HIS A 165 -11.890 -0.498 7.334 1.00 0.72 C ATOM 2315 NE2 HIS A 165 -11.244 0.649 7.104 1.00 0.69 N ATOM 0 H HIS A 165 -12.207 -0.958 1.242 1.00 0.30 H new ATOM 0 HA HIS A 165 -10.951 0.960 2.861 1.00 0.29 H new ATOM 0 HB2 HIS A 165 -13.112 -0.169 3.390 1.00 0.27 H new ATOM 0 HB3 HIS A 165 -12.285 -1.698 3.606 1.00 0.27 H new ATOM 0 HD2 HIS A 165 -10.804 1.623 5.182 1.00 0.75 H new ATOM 0 HE1 HIS A 165 -12.063 -0.909 8.317 1.00 0.72 H new ATOM 0 HE2 HIS A 165 -10.837 1.280 7.794 1.00 0.69 H new ATOM 2323 N LEU A 166 -9.670 -2.035 3.475 1.00 0.11 N ATOM 2324 CA LEU A 166 -8.424 -2.692 3.981 1.00 0.07 C ATOM 2325 C LEU A 166 -7.207 -2.213 3.198 1.00 0.10 C ATOM 2326 O LEU A 166 -6.147 -2.014 3.755 1.00 0.05 O ATOM 2327 CB LEU A 166 -8.533 -4.209 3.829 1.00 0.07 C ATOM 2328 CG LEU A 166 -8.954 -4.856 5.159 1.00 1.12 C ATOM 2329 CD1 LEU A 166 -7.797 -4.767 6.153 1.00 0.99 C ATOM 2330 CD2 LEU A 166 -10.181 -4.144 5.741 1.00 2.21 C ATOM 0 H LEU A 166 -10.447 -2.669 3.288 1.00 0.11 H new ATOM 0 HA LEU A 166 -8.308 -2.428 5.032 1.00 0.07 H new ATOM 0 HB2 LEU A 166 -9.260 -4.451 3.054 1.00 0.07 H new ATOM 0 HB3 LEU A 166 -7.575 -4.618 3.506 1.00 0.07 H new ATOM 0 HG LEU A 166 -9.209 -5.900 4.976 1.00 1.12 H new ATOM 0 HD11 LEU A 166 -8.092 -5.225 7.097 1.00 0.99 H new ATOM 0 HD12 LEU A 166 -6.930 -5.292 5.751 1.00 0.99 H new ATOM 0 HD13 LEU A 166 -7.542 -3.721 6.321 1.00 0.99 H new ATOM 0 HD21 LEU A 166 -10.464 -4.616 6.682 1.00 2.21 H new ATOM 0 HD22 LEU A 166 -9.943 -3.095 5.919 1.00 2.21 H new ATOM 0 HD23 LEU A 166 -11.010 -4.214 5.037 1.00 2.21 H new ATOM 2342 N ILE A 167 -7.332 -2.042 1.912 1.00 0.18 N ATOM 2343 CA ILE A 167 -6.156 -1.592 1.122 1.00 0.22 C ATOM 2344 C ILE A 167 -5.648 -0.264 1.693 1.00 0.22 C ATOM 2345 O ILE A 167 -4.463 -0.067 1.879 1.00 0.27 O ATOM 2346 CB ILE A 167 -6.547 -1.409 -0.347 1.00 0.28 C ATOM 2347 CG1 ILE A 167 -6.944 -2.768 -0.935 1.00 0.31 C ATOM 2348 CG2 ILE A 167 -5.356 -0.836 -1.130 1.00 0.30 C ATOM 2349 CD1 ILE A 167 -7.255 -2.613 -2.427 1.00 0.57 C ATOM 0 H ILE A 167 -8.189 -2.193 1.379 1.00 0.18 H new ATOM 0 HA ILE A 167 -5.369 -2.344 1.183 1.00 0.22 H new ATOM 0 HB ILE A 167 -7.388 -0.719 -0.419 1.00 0.28 H new ATOM 0 HG12 ILE A 167 -6.136 -3.486 -0.795 1.00 0.31 H new ATOM 0 HG13 ILE A 167 -7.815 -3.162 -0.411 1.00 0.31 H new ATOM 0 HG21 ILE A 167 -5.636 -0.706 -2.175 1.00 0.30 H new ATOM 0 HG22 ILE A 167 -5.073 0.128 -0.708 1.00 0.30 H new ATOM 0 HG23 ILE A 167 -4.512 -1.523 -1.063 1.00 0.30 H new ATOM 0 HD11 ILE A 167 -7.537 -3.581 -2.842 1.00 0.57 H new ATOM 0 HD12 ILE A 167 -8.077 -1.909 -2.556 1.00 0.57 H new ATOM 0 HD13 ILE A 167 -6.372 -2.239 -2.946 1.00 0.57 H new ATOM 2361 N LEU A 168 -6.541 0.644 1.972 1.00 0.22 N ATOM 2362 CA LEU A 168 -6.121 1.959 2.534 1.00 0.21 C ATOM 2363 C LEU A 168 -5.677 1.777 3.987 1.00 0.15 C ATOM 2364 O LEU A 168 -4.967 2.597 4.535 1.00 0.15 O ATOM 2365 CB LEU A 168 -7.299 2.935 2.484 1.00 0.22 C ATOM 2366 CG LEU A 168 -7.851 3.004 1.060 1.00 0.38 C ATOM 2367 CD1 LEU A 168 -9.328 3.404 1.101 1.00 0.35 C ATOM 2368 CD2 LEU A 168 -7.066 4.045 0.260 1.00 0.61 C ATOM 0 H LEU A 168 -7.546 0.532 1.835 1.00 0.22 H new ATOM 0 HA LEU A 168 -5.293 2.355 1.947 1.00 0.21 H new ATOM 0 HB2 LEU A 168 -8.080 2.612 3.172 1.00 0.22 H new ATOM 0 HB3 LEU A 168 -6.978 3.925 2.808 1.00 0.22 H new ATOM 0 HG LEU A 168 -7.752 2.027 0.586 1.00 0.38 H new ATOM 0 HD11 LEU A 168 -9.720 3.453 0.085 1.00 0.35 H new ATOM 0 HD12 LEU A 168 -9.890 2.664 1.672 1.00 0.35 H new ATOM 0 HD13 LEU A 168 -9.428 4.380 1.576 1.00 0.35 H new ATOM 0 HD21 LEU A 168 -7.459 4.095 -0.756 1.00 0.61 H new ATOM 0 HD22 LEU A 168 -7.165 5.020 0.736 1.00 0.61 H new ATOM 0 HD23 LEU A 168 -6.014 3.762 0.229 1.00 0.61 H new ATOM 2380 N ARG A 169 -6.091 0.712 4.618 1.00 0.09 N ATOM 2381 CA ARG A 169 -5.695 0.484 6.036 1.00 0.05 C ATOM 2382 C ARG A 169 -4.232 0.040 6.096 1.00 0.07 C ATOM 2383 O ARG A 169 -3.506 0.393 7.006 1.00 0.07 O ATOM 2384 CB ARG A 169 -6.586 -0.599 6.648 1.00 0.06 C ATOM 2385 CG ARG A 169 -7.378 -0.009 7.816 1.00 0.83 C ATOM 2386 CD ARG A 169 -6.484 0.063 9.055 1.00 1.23 C ATOM 2387 NE ARG A 169 -7.306 0.444 10.239 1.00 1.81 N ATOM 2388 CZ ARG A 169 -6.733 0.953 11.294 1.00 2.50 C ATOM 2389 NH1 ARG A 169 -6.362 2.205 11.296 1.00 3.96 N ATOM 2390 NH2 ARG A 169 -6.532 0.212 12.350 1.00 2.00 N ATOM 0 H ARG A 169 -6.686 -0.010 4.212 1.00 0.09 H new ATOM 0 HA ARG A 169 -5.813 1.410 6.598 1.00 0.05 H new ATOM 0 HB2 ARG A 169 -7.268 -0.992 5.894 1.00 0.06 H new ATOM 0 HB3 ARG A 169 -5.976 -1.434 6.993 1.00 0.06 H new ATOM 0 HG2 ARG A 169 -7.740 0.986 7.558 1.00 0.83 H new ATOM 0 HG3 ARG A 169 -8.254 -0.624 8.022 1.00 0.83 H new ATOM 0 HD2 ARG A 169 -6.004 -0.900 9.227 1.00 1.23 H new ATOM 0 HD3 ARG A 169 -5.689 0.792 8.901 1.00 1.23 H new ATOM 0 HE ARG A 169 -8.317 0.307 10.224 1.00 1.81 H new ATOM 0 HH11 ARG A 169 -6.520 2.785 10.472 1.00 3.96 H new ATOM 0 HH12 ARG A 169 -5.914 2.603 12.121 1.00 3.96 H new ATOM 0 HH21 ARG A 169 -6.823 -0.766 12.350 1.00 2.00 H new ATOM 0 HH22 ARG A 169 -6.084 0.611 13.175 1.00 2.00 H new ATOM 2404 N SER A 170 -3.782 -0.716 5.128 1.00 0.13 N ATOM 2405 CA SER A 170 -2.370 -1.155 5.134 1.00 0.17 C ATOM 2406 C SER A 170 -1.523 0.013 4.663 1.00 0.13 C ATOM 2407 O SER A 170 -0.502 0.323 5.226 1.00 0.09 O ATOM 2408 CB SER A 170 -2.193 -2.340 4.185 1.00 0.27 C ATOM 2409 OG SER A 170 -1.393 -3.332 4.815 1.00 0.63 O ATOM 0 H SER A 170 -4.337 -1.044 4.338 1.00 0.13 H new ATOM 0 HA SER A 170 -2.069 -1.466 6.134 1.00 0.17 H new ATOM 0 HB2 SER A 170 -3.165 -2.756 3.919 1.00 0.27 H new ATOM 0 HB3 SER A 170 -1.722 -2.011 3.258 1.00 0.27 H new ATOM 0 HG SER A 170 -1.279 -4.094 4.209 1.00 0.63 H new ATOM 2415 N PHE A 171 -1.951 0.690 3.642 1.00 0.15 N ATOM 2416 CA PHE A 171 -1.165 1.853 3.160 1.00 0.15 C ATOM 2417 C PHE A 171 -0.904 2.801 4.329 1.00 0.10 C ATOM 2418 O PHE A 171 0.213 3.187 4.585 1.00 0.16 O ATOM 2419 CB PHE A 171 -1.941 2.569 2.062 1.00 0.19 C ATOM 2420 CG PHE A 171 -1.563 1.947 0.748 1.00 0.18 C ATOM 2421 CD1 PHE A 171 -1.756 0.576 0.551 1.00 0.50 C ATOM 2422 CD2 PHE A 171 -1.000 2.730 -0.260 1.00 0.22 C ATOM 2423 CE1 PHE A 171 -1.386 -0.013 -0.662 1.00 0.49 C ATOM 2424 CE2 PHE A 171 -0.625 2.143 -1.471 1.00 0.27 C ATOM 2425 CZ PHE A 171 -0.818 0.772 -1.675 1.00 0.21 C ATOM 0 H PHE A 171 -2.806 0.491 3.122 1.00 0.15 H new ATOM 0 HA PHE A 171 -0.211 1.516 2.754 1.00 0.15 H new ATOM 0 HB2 PHE A 171 -3.014 2.479 2.232 1.00 0.19 H new ATOM 0 HB3 PHE A 171 -1.707 3.634 2.062 1.00 0.19 H new ATOM 0 HD1 PHE A 171 -2.190 -0.027 1.335 1.00 0.50 H new ATOM 0 HD2 PHE A 171 -0.854 3.789 -0.104 1.00 0.22 H new ATOM 0 HE1 PHE A 171 -1.538 -1.071 -0.818 1.00 0.49 H new ATOM 0 HE2 PHE A 171 -0.186 2.748 -2.251 1.00 0.27 H new ATOM 0 HZ PHE A 171 -0.530 0.319 -2.612 1.00 0.21 H new ATOM 2435 N LYS A 172 -1.918 3.161 5.057 1.00 0.07 N ATOM 2436 CA LYS A 172 -1.703 4.071 6.214 1.00 0.12 C ATOM 2437 C LYS A 172 -0.651 3.466 7.161 1.00 0.10 C ATOM 2438 O LYS A 172 0.422 4.010 7.343 1.00 0.11 O ATOM 2439 CB LYS A 172 -3.021 4.260 6.969 1.00 0.18 C ATOM 2440 CG LYS A 172 -2.994 5.594 7.721 1.00 0.77 C ATOM 2441 CD LYS A 172 -3.716 6.661 6.897 1.00 0.37 C ATOM 2442 CE LYS A 172 -4.362 7.682 7.836 1.00 0.56 C ATOM 2443 NZ LYS A 172 -3.506 8.901 7.912 1.00 1.28 N ATOM 0 H LYS A 172 -2.883 2.867 4.904 1.00 0.07 H new ATOM 0 HA LYS A 172 -1.350 5.037 5.852 1.00 0.12 H new ATOM 0 HB2 LYS A 172 -3.858 4.241 6.271 1.00 0.18 H new ATOM 0 HB3 LYS A 172 -3.172 3.439 7.670 1.00 0.18 H new ATOM 0 HG2 LYS A 172 -3.474 5.485 8.694 1.00 0.77 H new ATOM 0 HG3 LYS A 172 -1.964 5.898 7.906 1.00 0.77 H new ATOM 0 HD2 LYS A 172 -3.012 7.159 6.231 1.00 0.37 H new ATOM 0 HD3 LYS A 172 -4.476 6.197 6.269 1.00 0.37 H new ATOM 0 HE2 LYS A 172 -5.356 7.945 7.475 1.00 0.56 H new ATOM 0 HE3 LYS A 172 -4.487 7.250 8.829 1.00 0.56 H new ATOM 0 HZ1 LYS A 172 -3.945 9.595 8.550 1.00 1.28 H new ATOM 0 HZ2 LYS A 172 -2.566 8.643 8.275 1.00 1.28 H new ATOM 0 HZ3 LYS A 172 -3.409 9.316 6.964 1.00 1.28 H new ATOM 2457 N GLU A 173 -0.953 2.346 7.771 1.00 0.11 N ATOM 2458 CA GLU A 173 0.025 1.722 8.718 1.00 0.13 C ATOM 2459 C GLU A 173 1.232 1.159 7.960 1.00 0.09 C ATOM 2460 O GLU A 173 2.328 1.649 8.094 1.00 0.07 O ATOM 2461 CB GLU A 173 -0.657 0.589 9.487 1.00 0.19 C ATOM 2462 CG GLU A 173 0.260 0.122 10.620 1.00 1.00 C ATOM 2463 CD GLU A 173 0.772 -1.287 10.314 1.00 2.38 C ATOM 2464 OE1 GLU A 173 -0.013 -2.216 10.413 1.00 2.21 O ATOM 2465 OE2 GLU A 173 1.940 -1.412 9.986 1.00 3.95 O ATOM 0 H GLU A 173 -1.830 1.838 7.655 1.00 0.11 H new ATOM 0 HA GLU A 173 0.370 2.489 9.411 1.00 0.13 H new ATOM 0 HB2 GLU A 173 -1.609 0.931 9.892 1.00 0.19 H new ATOM 0 HB3 GLU A 173 -0.876 -0.241 8.816 1.00 0.19 H new ATOM 0 HG2 GLU A 173 1.099 0.809 10.730 1.00 1.00 H new ATOM 0 HG3 GLU A 173 -0.282 0.126 11.566 1.00 1.00 H new ATOM 2472 N PHE A 174 1.033 0.120 7.189 1.00 0.12 N ATOM 2473 CA PHE A 174 2.155 -0.521 6.417 1.00 0.18 C ATOM 2474 C PHE A 174 3.172 0.520 5.911 1.00 0.15 C ATOM 2475 O PHE A 174 4.337 0.469 6.256 1.00 0.16 O ATOM 2476 CB PHE A 174 1.568 -1.271 5.220 1.00 0.23 C ATOM 2477 CG PHE A 174 2.477 -2.405 4.831 1.00 0.36 C ATOM 2478 CD1 PHE A 174 2.374 -3.640 5.481 1.00 1.97 C ATOM 2479 CD2 PHE A 174 3.423 -2.221 3.818 1.00 1.33 C ATOM 2480 CE1 PHE A 174 3.220 -4.694 5.117 1.00 2.07 C ATOM 2481 CE2 PHE A 174 4.269 -3.274 3.453 1.00 1.26 C ATOM 2482 CZ PHE A 174 4.169 -4.510 4.103 1.00 0.59 C ATOM 0 H PHE A 174 0.124 -0.324 7.056 1.00 0.12 H new ATOM 0 HA PHE A 174 2.679 -1.204 7.085 1.00 0.18 H new ATOM 0 HB2 PHE A 174 0.579 -1.655 5.470 1.00 0.23 H new ATOM 0 HB3 PHE A 174 1.442 -0.589 4.379 1.00 0.23 H new ATOM 0 HD1 PHE A 174 1.642 -3.780 6.263 1.00 1.97 H new ATOM 0 HD2 PHE A 174 3.501 -1.267 3.318 1.00 1.33 H new ATOM 0 HE1 PHE A 174 3.141 -5.648 5.617 1.00 2.07 H new ATOM 0 HE2 PHE A 174 4.999 -3.133 2.670 1.00 1.26 H new ATOM 0 HZ PHE A 174 4.824 -5.322 3.823 1.00 0.59 H new ATOM 2492 N LEU A 175 2.757 1.460 5.098 1.00 0.13 N ATOM 2493 CA LEU A 175 3.733 2.474 4.593 1.00 0.15 C ATOM 2494 C LEU A 175 4.353 3.219 5.780 1.00 0.11 C ATOM 2495 O LEU A 175 5.532 3.512 5.789 1.00 0.12 O ATOM 2496 CB LEU A 175 3.029 3.488 3.686 1.00 0.18 C ATOM 2497 CG LEU A 175 2.699 2.860 2.323 1.00 0.23 C ATOM 2498 CD1 LEU A 175 1.432 3.497 1.762 1.00 0.34 C ATOM 2499 CD2 LEU A 175 3.835 3.115 1.333 1.00 0.14 C ATOM 0 H LEU A 175 1.799 1.569 4.766 1.00 0.13 H new ATOM 0 HA LEU A 175 4.507 1.960 4.024 1.00 0.15 H new ATOM 0 HB2 LEU A 175 2.113 3.836 4.163 1.00 0.18 H new ATOM 0 HB3 LEU A 175 3.666 4.361 3.545 1.00 0.18 H new ATOM 0 HG LEU A 175 2.562 1.788 2.462 1.00 0.23 H new ATOM 0 HD11 LEU A 175 1.198 3.051 0.795 1.00 0.34 H new ATOM 0 HD12 LEU A 175 0.604 3.327 2.450 1.00 0.34 H new ATOM 0 HD13 LEU A 175 1.587 4.569 1.639 1.00 0.34 H new ATOM 0 HD21 LEU A 175 3.588 2.665 0.372 1.00 0.14 H new ATOM 0 HD22 LEU A 175 3.973 4.189 1.206 1.00 0.14 H new ATOM 0 HD23 LEU A 175 4.756 2.674 1.714 1.00 0.14 H new ATOM 2511 N GLN A 176 3.570 3.542 6.779 1.00 0.07 N ATOM 2512 CA GLN A 176 4.126 4.274 7.958 1.00 0.06 C ATOM 2513 C GLN A 176 5.362 3.538 8.493 1.00 0.06 C ATOM 2514 O GLN A 176 6.413 4.123 8.678 1.00 0.19 O ATOM 2515 CB GLN A 176 3.064 4.353 9.059 1.00 0.07 C ATOM 2516 CG GLN A 176 2.536 5.785 9.160 1.00 0.11 C ATOM 2517 CD GLN A 176 1.782 5.959 10.480 1.00 0.32 C ATOM 2518 OE1 GLN A 176 2.376 6.249 11.499 1.00 0.75 O ATOM 2519 NE2 GLN A 176 0.487 5.795 10.505 1.00 1.71 N ATOM 0 H GLN A 176 2.573 3.331 6.829 1.00 0.07 H new ATOM 0 HA GLN A 176 4.411 5.281 7.652 1.00 0.06 H new ATOM 0 HB2 GLN A 176 2.246 3.668 8.839 1.00 0.07 H new ATOM 0 HB3 GLN A 176 3.491 4.044 10.013 1.00 0.07 H new ATOM 0 HG2 GLN A 176 3.363 6.493 9.105 1.00 0.11 H new ATOM 0 HG3 GLN A 176 1.875 6.000 8.320 1.00 0.11 H new ATOM 0 HE21 GLN A 176 -0.013 5.551 9.650 1.00 1.71 H new ATOM 0 HE22 GLN A 176 -0.025 5.910 11.380 1.00 1.71 H new ATOM 2528 N SER A 177 5.247 2.260 8.738 1.00 0.14 N ATOM 2529 CA SER A 177 6.412 1.491 9.252 1.00 0.17 C ATOM 2530 C SER A 177 7.536 1.538 8.218 1.00 0.14 C ATOM 2531 O SER A 177 8.700 1.470 8.550 1.00 0.15 O ATOM 2532 CB SER A 177 6.000 0.039 9.495 1.00 0.29 C ATOM 2533 OG SER A 177 5.933 -0.202 10.894 1.00 1.15 O ATOM 0 H SER A 177 4.394 1.717 8.603 1.00 0.14 H new ATOM 0 HA SER A 177 6.756 1.928 10.189 1.00 0.17 H new ATOM 0 HB2 SER A 177 5.033 -0.159 9.033 1.00 0.29 H new ATOM 0 HB3 SER A 177 6.718 -0.637 9.032 1.00 0.29 H new ATOM 0 HG SER A 177 5.801 -1.160 11.055 1.00 1.15 H new ATOM 2539 N SER A 178 7.193 1.654 6.964 1.00 0.15 N ATOM 2540 CA SER A 178 8.240 1.712 5.905 1.00 0.19 C ATOM 2541 C SER A 178 9.008 3.033 6.021 1.00 0.16 C ATOM 2542 O SER A 178 10.170 3.117 5.680 1.00 0.26 O ATOM 2543 CB SER A 178 7.582 1.631 4.527 1.00 0.33 C ATOM 2544 OG SER A 178 8.590 1.646 3.524 1.00 0.84 O ATOM 0 H SER A 178 6.232 1.711 6.627 1.00 0.15 H new ATOM 0 HA SER A 178 8.927 0.875 6.030 1.00 0.19 H new ATOM 0 HB2 SER A 178 6.988 0.721 4.448 1.00 0.33 H new ATOM 0 HB3 SER A 178 6.900 2.470 4.387 1.00 0.33 H new ATOM 0 HG SER A 178 8.172 1.593 2.639 1.00 0.84 H new ATOM 2550 N LEU A 179 8.363 4.064 6.495 1.00 0.14 N ATOM 2551 CA LEU A 179 9.050 5.381 6.634 1.00 0.18 C ATOM 2552 C LEU A 179 10.040 5.325 7.800 1.00 0.22 C ATOM 2553 O LEU A 179 11.167 5.764 7.692 1.00 0.35 O ATOM 2554 CB LEU A 179 8.010 6.469 6.912 1.00 0.15 C ATOM 2555 CG LEU A 179 7.470 7.018 5.591 1.00 0.36 C ATOM 2556 CD1 LEU A 179 6.189 6.272 5.211 1.00 0.85 C ATOM 2557 CD2 LEU A 179 7.162 8.508 5.747 1.00 0.36 C ATOM 0 H LEU A 179 7.388 4.052 6.793 1.00 0.14 H new ATOM 0 HA LEU A 179 9.585 5.607 5.712 1.00 0.18 H new ATOM 0 HB2 LEU A 179 7.194 6.061 7.508 1.00 0.15 H new ATOM 0 HB3 LEU A 179 8.459 7.274 7.495 1.00 0.15 H new ATOM 0 HG LEU A 179 8.217 6.879 4.809 1.00 0.36 H new ATOM 0 HD11 LEU A 179 5.805 6.664 4.269 1.00 0.85 H new ATOM 0 HD12 LEU A 179 6.406 5.210 5.100 1.00 0.85 H new ATOM 0 HD13 LEU A 179 5.442 6.410 5.993 1.00 0.85 H new ATOM 0 HD21 LEU A 179 6.777 8.900 4.806 1.00 0.36 H new ATOM 0 HD22 LEU A 179 6.416 8.645 6.530 1.00 0.36 H new ATOM 0 HD23 LEU A 179 8.073 9.042 6.017 1.00 0.36 H new ATOM 2569 N ARG A 180 9.622 4.794 8.918 1.00 0.21 N ATOM 2570 CA ARG A 180 10.534 4.718 10.097 1.00 0.36 C ATOM 2571 C ARG A 180 11.625 3.674 9.848 1.00 0.34 C ATOM 2572 O ARG A 180 12.706 3.748 10.401 1.00 0.52 O ATOM 2573 CB ARG A 180 9.729 4.325 11.337 1.00 0.44 C ATOM 2574 CG ARG A 180 10.403 4.898 12.586 1.00 1.32 C ATOM 2575 CD ARG A 180 9.406 5.770 13.349 1.00 1.30 C ATOM 2576 NE ARG A 180 9.068 6.970 12.534 1.00 2.50 N ATOM 2577 CZ ARG A 180 8.423 7.964 13.078 1.00 3.31 C ATOM 2578 NH1 ARG A 180 7.156 7.843 13.359 1.00 3.13 N ATOM 2579 NH2 ARG A 180 9.047 9.081 13.340 1.00 4.52 N ATOM 0 H ARG A 180 8.689 4.410 9.066 1.00 0.21 H new ATOM 0 HA ARG A 180 10.999 5.691 10.253 1.00 0.36 H new ATOM 0 HB2 ARG A 180 8.709 4.701 11.256 1.00 0.44 H new ATOM 0 HB3 ARG A 180 9.663 3.240 11.412 1.00 0.44 H new ATOM 0 HG2 ARG A 180 10.758 4.089 13.224 1.00 1.32 H new ATOM 0 HG3 ARG A 180 11.276 5.487 12.304 1.00 1.32 H new ATOM 0 HD2 ARG A 180 8.503 5.201 13.569 1.00 1.30 H new ATOM 0 HD3 ARG A 180 9.831 6.075 14.305 1.00 1.30 H new ATOM 0 HE ARG A 180 9.341 7.014 11.552 1.00 2.50 H new ATOM 0 HH11 ARG A 180 6.669 6.971 13.153 1.00 3.13 H new ATOM 0 HH12 ARG A 180 6.651 8.621 13.785 1.00 3.13 H new ATOM 0 HH21 ARG A 180 10.038 9.175 13.119 1.00 4.52 H new ATOM 0 HH22 ARG A 180 8.543 9.859 13.766 1.00 4.52 H new ATOM 2593 N ALA A 181 11.361 2.706 9.014 1.00 0.17 N ATOM 2594 CA ALA A 181 12.389 1.670 8.735 1.00 0.21 C ATOM 2595 C ALA A 181 13.400 2.245 7.752 1.00 0.39 C ATOM 2596 O ALA A 181 14.575 1.942 7.802 1.00 0.52 O ATOM 2597 CB ALA A 181 11.721 0.435 8.126 1.00 0.20 C ATOM 0 H ALA A 181 10.479 2.590 8.516 1.00 0.17 H new ATOM 0 HA ALA A 181 12.890 1.381 9.659 1.00 0.21 H new ATOM 0 HB1 ALA A 181 12.476 -0.324 7.922 1.00 0.20 H new ATOM 0 HB2 ALA A 181 10.986 0.037 8.826 1.00 0.20 H new ATOM 0 HB3 ALA A 181 11.224 0.711 7.196 1.00 0.20 H new ATOM 2603 N LEU A 182 12.951 3.087 6.862 1.00 0.42 N ATOM 2604 CA LEU A 182 13.884 3.696 5.881 1.00 0.60 C ATOM 2605 C LEU A 182 14.648 4.836 6.556 1.00 0.71 C ATOM 2606 O LEU A 182 15.717 5.221 6.126 1.00 0.93 O ATOM 2607 CB LEU A 182 13.092 4.248 4.691 1.00 0.79 C ATOM 2608 CG LEU A 182 12.926 3.155 3.633 1.00 1.18 C ATOM 2609 CD1 LEU A 182 11.449 3.033 3.254 1.00 1.57 C ATOM 2610 CD2 LEU A 182 13.739 3.522 2.389 1.00 1.15 C ATOM 0 H LEU A 182 11.977 3.378 6.774 1.00 0.42 H new ATOM 0 HA LEU A 182 14.586 2.941 5.527 1.00 0.60 H new ATOM 0 HB2 LEU A 182 12.115 4.598 5.023 1.00 0.79 H new ATOM 0 HB3 LEU A 182 13.610 5.106 4.263 1.00 0.79 H new ATOM 0 HG LEU A 182 13.280 2.205 4.034 1.00 1.18 H new ATOM 0 HD11 LEU A 182 11.330 2.255 2.500 1.00 1.57 H new ATOM 0 HD12 LEU A 182 10.867 2.774 4.138 1.00 1.57 H new ATOM 0 HD13 LEU A 182 11.097 3.983 2.853 1.00 1.57 H new ATOM 0 HD21 LEU A 182 13.621 2.744 1.635 1.00 1.15 H new ATOM 0 HD22 LEU A 182 13.384 4.472 1.989 1.00 1.15 H new ATOM 0 HD23 LEU A 182 14.792 3.612 2.656 1.00 1.15 H new ATOM 2622 N ARG A 183 14.105 5.381 7.612 1.00 0.61 N ATOM 2623 CA ARG A 183 14.796 6.495 8.317 1.00 0.75 C ATOM 2624 C ARG A 183 15.769 5.924 9.353 1.00 0.76 C ATOM 2625 O ARG A 183 16.706 6.581 9.762 1.00 0.86 O ATOM 2626 CB ARG A 183 13.756 7.368 9.022 1.00 0.74 C ATOM 2627 CG ARG A 183 13.683 8.732 8.336 1.00 1.58 C ATOM 2628 CD ARG A 183 14.666 9.694 9.006 1.00 1.54 C ATOM 2629 NE ARG A 183 13.980 10.987 9.290 1.00 1.35 N ATOM 2630 CZ ARG A 183 14.671 12.092 9.352 1.00 2.16 C ATOM 2631 NH1 ARG A 183 14.890 12.785 8.268 1.00 3.50 N ATOM 2632 NH2 ARG A 183 15.144 12.504 10.497 1.00 2.01 N ATOM 0 H ARG A 183 13.211 5.101 8.016 1.00 0.61 H new ATOM 0 HA ARG A 183 15.350 7.094 7.595 1.00 0.75 H new ATOM 0 HB2 ARG A 183 12.780 6.883 8.995 1.00 0.74 H new ATOM 0 HB3 ARG A 183 14.021 7.491 10.072 1.00 0.74 H new ATOM 0 HG2 ARG A 183 13.921 8.631 7.277 1.00 1.58 H new ATOM 0 HG3 ARG A 183 12.670 9.129 8.399 1.00 1.58 H new ATOM 0 HD2 ARG A 183 15.043 9.259 9.932 1.00 1.54 H new ATOM 0 HD3 ARG A 183 15.527 9.861 8.358 1.00 1.54 H new ATOM 0 HE ARG A 183 12.971 11.008 9.436 1.00 1.35 H new ATOM 0 HH11 ARG A 183 14.521 12.463 7.373 1.00 3.50 H new ATOM 0 HH12 ARG A 183 15.430 13.649 8.315 1.00 3.50 H new ATOM 0 HH21 ARG A 183 14.973 11.962 11.344 1.00 2.01 H new ATOM 0 HH22 ARG A 183 15.684 13.368 10.545 1.00 2.01 H new ATOM 2646 N GLN A 184 15.557 4.708 9.781 1.00 0.73 N ATOM 2647 CA GLN A 184 16.474 4.105 10.788 1.00 0.84 C ATOM 2648 C GLN A 184 17.648 3.436 10.070 1.00 0.87 C ATOM 2649 O GLN A 184 18.773 3.488 10.524 1.00 1.24 O ATOM 2650 CB GLN A 184 15.717 3.059 11.610 1.00 0.77 C ATOM 2651 CG GLN A 184 14.818 3.763 12.628 1.00 0.87 C ATOM 2652 CD GLN A 184 15.522 3.809 13.986 1.00 0.86 C ATOM 2653 OE1 GLN A 184 16.129 4.801 14.336 1.00 1.77 O ATOM 2654 NE2 GLN A 184 15.466 2.768 14.771 1.00 0.65 N ATOM 0 H GLN A 184 14.790 4.108 9.477 1.00 0.73 H new ATOM 0 HA GLN A 184 16.848 4.885 11.451 1.00 0.84 H new ATOM 0 HB2 GLN A 184 15.117 2.429 10.953 1.00 0.77 H new ATOM 0 HB3 GLN A 184 16.422 2.404 12.123 1.00 0.77 H new ATOM 0 HG2 GLN A 184 14.591 4.774 12.290 1.00 0.87 H new ATOM 0 HG3 GLN A 184 13.868 3.235 12.717 1.00 0.87 H new ATOM 0 HE21 GLN A 184 14.956 1.935 14.477 1.00 0.65 H new ATOM 0 HE22 GLN A 184 15.932 2.788 15.678 1.00 0.65 H new ATOM 2663 N MET A 185 17.397 2.811 8.951 1.00 0.64 N ATOM 2664 CA MET A 185 18.506 2.146 8.211 1.00 0.68 C ATOM 2665 C MET A 185 18.703 2.833 6.856 1.00 1.94 C ATOM 2666 O MET A 185 19.625 2.455 6.151 1.00 2.74 O ATOM 2667 CB MET A 185 18.176 0.661 8.005 1.00 1.31 C ATOM 2668 CG MET A 185 16.989 0.512 7.047 1.00 0.48 C ATOM 2669 SD MET A 185 15.815 -0.691 7.717 1.00 2.23 S ATOM 2670 CE MET A 185 14.788 -0.860 6.236 1.00 0.73 C ATOM 2671 OXT MET A 185 17.929 3.724 6.547 1.00 2.81 O ATOM 0 H MET A 185 16.476 2.733 8.520 1.00 0.64 H new ATOM 0 HA MET A 185 19.426 2.226 8.789 1.00 0.68 H new ATOM 0 HB2 MET A 185 19.045 0.140 7.603 1.00 1.31 H new ATOM 0 HB3 MET A 185 17.941 0.197 8.963 1.00 1.31 H new ATOM 0 HG2 MET A 185 16.498 1.475 6.907 1.00 0.48 H new ATOM 0 HG3 MET A 185 17.338 0.187 6.067 1.00 0.48 H new ATOM 0 HE1 MET A 185 13.754 -0.619 6.481 1.00 0.73 H new ATOM 0 HE2 MET A 185 15.147 -0.178 5.465 1.00 0.73 H new ATOM 0 HE3 MET A 185 14.844 -1.885 5.869 1.00 0.73 H new