USER MOD reduce.3.24.130724 H: found=0, std=0, add=1350, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1347 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 105 SER OG : rot -36:sc= 0.59 USER MOD Set 1.2: A 107 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 60 HIS :FLIP no HD1:sc= 0.0272 F(o=2.3,f=3.2) USER MOD Set 2.2: A 80 HIS : no HD1:sc= 0.765 K(o=3.2,f=-4.3) USER MOD Set 2.3: A 83 THR OG1 : rot -92:sc= 1.14 USER MOD Set 2.4: A 96 HIS : no HE2:sc= 1.26 K(o=3.2,f=-7.7!) USER MOD Set 3.1: A 75 THR OG1 : rot -18:sc= 0.384 USER MOD Set 3.2: A 161 SER OG : rot -92:sc= 0.246 USER MOD Set 4.1: A 70 THR OG1 : rot 180:sc= -0.0676 USER MOD Set 4.2: A 100 GLN :FLIP amide:sc= -0.436 F(o=-1.1,f=-0.5) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -171:sc= -0.0247 (180deg=-0.19) USER MOD Single : A 5 THR OG1 : rot 83:sc= 0.53 USER MOD Single : A 10 THR OG1 : rot 64:sc= 0.964 USER MOD Single : A 11 GLN : amide:sc= 0.0157 X(o=0.016,f=0) USER MOD Single : A 13 GLN : amide:sc= -0.21 X(o=-0.21,f=0) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 19 LYS NZ :NH3+ -105:sc= -0.136 (180deg=-0.31) USER MOD Single : A 24 SER OG : rot 172:sc= 0.768 USER MOD Single : A 26 HIS : no HD1:sc= -2.36! C(o=-2.4!,f=-6.2!) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 SER OG : rot 140:sc= 0.281 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 80:sc=-0.00253 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 47:sc= 0.257 USER MOD Single : A 65 SER OG : rot 45:sc= 0.195 USER MOD Single : A 71 SER OG : rot -62:sc= 0.579 USER MOD Single : A 78 TYR OH : rot 57:sc= 0.242 USER MOD Single : A 85 SER OG : rot 32:sc= 0.0854 USER MOD Single : A 92 SER OG : rot 19:sc= 0.222 USER MOD Single : A 115 LYS NZ :NH3+ -155:sc= 0.226 (180deg=-0.113) USER MOD Single : A 116 THR OG1 : rot -83:sc= -0.298 USER MOD Single : A 117 THR OG1 : rot 71:sc= 0.35 USER MOD Single : A 119 GLN : amide:sc= -0.272 X(o=-0.27,f=-0.00044) USER MOD Single : A 120 GLN : amide:sc= -0.0021 X(o=-0.0021,f=-0.0021) USER MOD Single : A 121 SER OG : rot -9:sc= 1.47 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot -91:sc= 0.803 USER MOD Single : A 128 MET CE :methyl -159:sc= -0.0232 (180deg=-0.995) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -5.11! C(o=-5.1!,f=-5.9!) USER MOD Single : A 150 TYR OH : rot 151:sc= 0.362 USER MOD Single : A 151 SER OG : rot 19:sc= 0.229 USER MOD Single : A 154 CYS SG : rot -148:sc= -1.06 USER MOD Single : A 156 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 SER OG : rot 98:sc= 1.21 USER MOD Single : A 159 THR OG1 : rot 180:sc= 0 USER MOD Single : A 162 CYS SG : rot -59:sc= -1.19 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 169 ASN : amide:sc= -0.831 K(o=-0.83,f=-4.1!) USER MOD Single : A 173 THR OG1 : rot 105:sc= 0.154 USER MOD Single : A 176 THR OG1 : rot 35:sc= 0.0209 USER MOD Single : A 181 THR OG1 : rot 180:sc= 0 USER MOD Single : A 185 HIS : no HD1:sc= 0.421 K(o=0.42,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -20.588 1.914 -17.415 1.00 32.04 N ATOM 2 CA MET A 1 -19.613 2.585 -18.302 1.00 70.12 C ATOM 3 C MET A 1 -18.261 1.863 -18.178 1.00 50.03 C ATOM 4 O MET A 1 -17.431 2.223 -17.331 1.00 3.32 O ATOM 5 CB MET A 1 -19.479 4.093 -17.936 1.00 42.01 C ATOM 6 CG MET A 1 -20.812 4.845 -17.796 1.00 2.44 C ATOM 7 SD MET A 1 -21.781 4.837 -19.315 1.00 22.42 S ATOM 8 CE MET A 1 -23.312 5.593 -18.757 1.00 44.52 C ATOM 0 H1 MET A 1 -21.540 2.290 -17.599 1.00 32.04 H new ATOM 0 H2 MET A 1 -20.578 0.891 -17.599 1.00 32.04 H new ATOM 0 H3 MET A 1 -20.332 2.089 -16.422 1.00 32.04 H new ATOM 0 HA MET A 1 -19.958 2.534 -19.335 1.00 70.12 H new ATOM 0 HB2 MET A 1 -18.931 4.177 -16.998 1.00 42.01 H new ATOM 0 HB3 MET A 1 -18.879 4.586 -18.701 1.00 42.01 H new ATOM 0 HG2 MET A 1 -21.397 4.393 -16.995 1.00 2.44 H new ATOM 0 HG3 MET A 1 -20.613 5.876 -17.503 1.00 2.44 H new ATOM 0 HE1 MET A 1 -24.012 5.656 -19.590 1.00 44.52 H new ATOM 0 HE2 MET A 1 -23.748 4.988 -17.962 1.00 44.52 H new ATOM 0 HE3 MET A 1 -23.107 6.595 -18.380 1.00 44.52 H new ATOM 20 N ASP A 2 -18.069 0.808 -18.997 1.00 52.24 N ATOM 21 CA ASP A 2 -16.906 -0.107 -18.875 1.00 71.42 C ATOM 22 C ASP A 2 -15.570 0.589 -19.202 1.00 44.41 C ATOM 23 O ASP A 2 -14.566 0.270 -18.578 1.00 0.31 O ATOM 24 CB ASP A 2 -17.082 -1.377 -19.756 1.00 63.32 C ATOM 25 CG ASP A 2 -18.190 -2.317 -19.242 1.00 30.42 C ATOM 26 OD1 ASP A 2 -19.366 -2.136 -19.608 1.00 11.14 O ATOM 27 OD2 ASP A 2 -17.891 -3.230 -18.449 1.00 33.43 O ATOM 0 H ASP A 2 -18.706 0.565 -19.755 1.00 52.24 H new ATOM 0 HA ASP A 2 -16.870 -0.412 -17.829 1.00 71.42 H new ATOM 0 HB2 ASP A 2 -17.314 -1.075 -20.777 1.00 63.32 H new ATOM 0 HB3 ASP A 2 -16.138 -1.922 -19.791 1.00 63.32 H new ATOM 32 N GLU A 3 -15.578 1.537 -20.173 1.00 1.42 N ATOM 33 CA GLU A 3 -14.366 2.307 -20.584 1.00 44.24 C ATOM 34 C GLU A 3 -13.700 3.019 -19.384 1.00 53.00 C ATOM 35 O GLU A 3 -12.470 3.028 -19.263 1.00 64.20 O ATOM 36 CB GLU A 3 -14.709 3.340 -21.694 1.00 33.31 C ATOM 37 CG GLU A 3 -15.147 2.720 -23.038 1.00 42.31 C ATOM 38 CD GLU A 3 -15.503 3.773 -24.109 1.00 4.31 C ATOM 39 OE1 GLU A 3 -14.594 4.520 -24.549 1.00 73.42 O ATOM 40 OE2 GLU A 3 -16.685 3.858 -24.519 1.00 60.21 O ATOM 0 H GLU A 3 -16.418 1.792 -20.693 1.00 1.42 H new ATOM 0 HA GLU A 3 -13.654 1.585 -20.984 1.00 44.24 H new ATOM 0 HB2 GLU A 3 -15.506 3.990 -21.333 1.00 33.31 H new ATOM 0 HB3 GLU A 3 -13.837 3.970 -21.867 1.00 33.31 H new ATOM 0 HG2 GLU A 3 -14.346 2.085 -23.415 1.00 42.31 H new ATOM 0 HG3 GLU A 3 -16.011 2.077 -22.869 1.00 42.31 H new ATOM 47 N ASP A 4 -14.537 3.612 -18.507 1.00 51.24 N ATOM 48 CA ASP A 4 -14.090 4.255 -17.250 1.00 25.31 C ATOM 49 C ASP A 4 -13.494 3.208 -16.307 1.00 24.32 C ATOM 50 O ASP A 4 -12.376 3.358 -15.812 1.00 40.32 O ATOM 51 CB ASP A 4 -15.282 4.985 -16.555 1.00 51.04 C ATOM 52 CG ASP A 4 -14.942 5.524 -15.148 1.00 2.23 C ATOM 53 OD1 ASP A 4 -14.373 6.631 -15.046 1.00 21.33 O ATOM 54 OD2 ASP A 4 -15.259 4.848 -14.137 1.00 32.43 O ATOM 0 H ASP A 4 -15.546 3.659 -18.650 1.00 51.24 H new ATOM 0 HA ASP A 4 -13.324 4.992 -17.491 1.00 25.31 H new ATOM 0 HB2 ASP A 4 -15.606 5.814 -17.184 1.00 51.04 H new ATOM 0 HB3 ASP A 4 -16.123 4.296 -16.478 1.00 51.04 H new ATOM 59 N THR A 5 -14.256 2.129 -16.117 1.00 1.33 N ATOM 60 CA THR A 5 -13.964 1.077 -15.142 1.00 52.45 C ATOM 61 C THR A 5 -12.681 0.283 -15.513 1.00 34.51 C ATOM 62 O THR A 5 -11.953 -0.170 -14.633 1.00 24.42 O ATOM 63 CB THR A 5 -15.208 0.128 -15.038 1.00 64.14 C ATOM 64 OG1 THR A 5 -16.402 0.923 -14.883 1.00 22.33 O ATOM 65 CG2 THR A 5 -15.109 -0.855 -13.862 1.00 74.21 C ATOM 0 H THR A 5 -15.110 1.959 -16.647 1.00 1.33 H new ATOM 0 HA THR A 5 -13.771 1.537 -14.173 1.00 52.45 H new ATOM 0 HB THR A 5 -15.242 -0.459 -15.956 1.00 64.14 H new ATOM 0 HG1 THR A 5 -16.708 1.228 -15.762 1.00 22.33 H new ATOM 0 HG21 THR A 5 -15.997 -1.486 -13.840 1.00 74.21 H new ATOM 0 HG22 THR A 5 -14.223 -1.479 -13.983 1.00 74.21 H new ATOM 0 HG23 THR A 5 -15.036 -0.298 -12.928 1.00 74.21 H new ATOM 73 N GLU A 6 -12.387 0.167 -16.825 1.00 60.33 N ATOM 74 CA GLU A 6 -11.223 -0.599 -17.329 1.00 73.43 C ATOM 75 C GLU A 6 -10.002 0.323 -17.531 1.00 54.33 C ATOM 76 O GLU A 6 -8.883 -0.169 -17.723 1.00 33.35 O ATOM 77 CB GLU A 6 -11.583 -1.349 -18.645 1.00 44.53 C ATOM 78 CG GLU A 6 -11.759 -0.445 -19.879 1.00 22.22 C ATOM 79 CD GLU A 6 -12.278 -1.198 -21.112 1.00 3.05 C ATOM 80 OE1 GLU A 6 -11.462 -1.770 -21.867 1.00 0.13 O ATOM 81 OE2 GLU A 6 -13.507 -1.233 -21.325 1.00 73.15 O ATOM 0 H GLU A 6 -12.945 0.598 -17.562 1.00 60.33 H new ATOM 0 HA GLU A 6 -10.957 -1.344 -16.580 1.00 73.43 H new ATOM 0 HB2 GLU A 6 -10.801 -2.079 -18.856 1.00 44.53 H new ATOM 0 HB3 GLU A 6 -12.506 -1.907 -18.487 1.00 44.53 H new ATOM 0 HG2 GLU A 6 -12.452 0.361 -19.635 1.00 22.22 H new ATOM 0 HG3 GLU A 6 -10.803 0.019 -20.121 1.00 22.22 H new ATOM 88 N ASP A 7 -10.230 1.663 -17.503 1.00 33.41 N ATOM 89 CA ASP A 7 -9.142 2.673 -17.544 1.00 31.12 C ATOM 90 C ASP A 7 -8.261 2.532 -16.288 1.00 44.13 C ATOM 91 O ASP A 7 -7.043 2.760 -16.344 1.00 35.21 O ATOM 92 CB ASP A 7 -9.715 4.113 -17.654 1.00 72.30 C ATOM 93 CG ASP A 7 -8.629 5.175 -17.917 1.00 31.10 C ATOM 94 OD1 ASP A 7 -8.229 5.344 -19.090 1.00 11.30 O ATOM 95 OD2 ASP A 7 -8.155 5.828 -16.960 1.00 4.05 O ATOM 0 H ASP A 7 -11.164 2.069 -17.452 1.00 33.41 H new ATOM 0 HA ASP A 7 -8.534 2.495 -18.431 1.00 31.12 H new ATOM 0 HB2 ASP A 7 -10.449 4.145 -18.459 1.00 72.30 H new ATOM 0 HB3 ASP A 7 -10.241 4.360 -16.732 1.00 72.30 H new ATOM 100 N TRP A 8 -8.938 2.192 -15.155 1.00 44.22 N ATOM 101 CA TRP A 8 -8.312 1.641 -13.928 1.00 53.45 C ATOM 102 C TRP A 8 -7.182 0.663 -14.301 1.00 73.24 C ATOM 103 O TRP A 8 -6.021 0.983 -14.105 1.00 32.44 O ATOM 104 CB TRP A 8 -9.415 0.925 -13.079 1.00 11.53 C ATOM 105 CG TRP A 8 -8.946 0.118 -11.870 1.00 1.11 C ATOM 106 CD1 TRP A 8 -8.501 0.605 -10.673 1.00 2.41 C ATOM 107 CD2 TRP A 8 -8.914 -1.327 -11.743 1.00 63.24 C ATOM 108 NE1 TRP A 8 -8.211 -0.430 -9.821 1.00 62.23 N ATOM 109 CE2 TRP A 8 -8.455 -1.623 -10.452 1.00 13.42 C ATOM 110 CE3 TRP A 8 -9.231 -2.392 -12.596 1.00 44.21 C ATOM 111 CZ2 TRP A 8 -8.312 -2.937 -9.988 1.00 70.33 C ATOM 112 CZ3 TRP A 8 -9.086 -3.693 -12.140 1.00 5.54 C ATOM 113 CH2 TRP A 8 -8.632 -3.954 -10.842 1.00 22.02 C ATOM 0 H TRP A 8 -9.949 2.296 -15.072 1.00 44.22 H new ATOM 0 HA TRP A 8 -7.873 2.447 -13.339 1.00 53.45 H new ATOM 0 HB2 TRP A 8 -10.117 1.682 -12.729 1.00 11.53 H new ATOM 0 HB3 TRP A 8 -9.969 0.256 -13.738 1.00 11.53 H new ATOM 0 HD1 TRP A 8 -8.393 1.652 -10.433 1.00 2.41 H new ATOM 0 HE1 TRP A 8 -7.867 -0.328 -8.866 1.00 62.23 H new ATOM 0 HE3 TRP A 8 -9.585 -2.201 -13.598 1.00 44.21 H new ATOM 0 HZ2 TRP A 8 -7.960 -3.139 -8.987 1.00 70.33 H new ATOM 0 HZ3 TRP A 8 -9.327 -4.517 -12.796 1.00 5.54 H new ATOM 0 HH2 TRP A 8 -8.533 -4.977 -10.510 1.00 22.02 H new ATOM 124 N GLU A 9 -7.563 -0.436 -14.993 1.00 22.25 N ATOM 125 CA GLU A 9 -6.655 -1.539 -15.384 1.00 15.25 C ATOM 126 C GLU A 9 -5.560 -1.071 -16.368 1.00 31.23 C ATOM 127 O GLU A 9 -4.440 -1.585 -16.341 1.00 25.03 O ATOM 128 CB GLU A 9 -7.475 -2.702 -16.018 1.00 51.24 C ATOM 129 CG GLU A 9 -6.636 -3.942 -16.406 1.00 30.11 C ATOM 130 CD GLU A 9 -7.468 -5.038 -17.087 1.00 14.24 C ATOM 131 OE1 GLU A 9 -8.074 -5.874 -16.380 1.00 71.23 O ATOM 132 OE2 GLU A 9 -7.531 -5.060 -18.339 1.00 31.42 O ATOM 0 H GLU A 9 -8.525 -0.583 -15.300 1.00 22.25 H new ATOM 0 HA GLU A 9 -6.156 -1.888 -14.480 1.00 15.25 H new ATOM 0 HB2 GLU A 9 -8.250 -3.009 -15.315 1.00 51.24 H new ATOM 0 HB3 GLU A 9 -7.982 -2.329 -16.908 1.00 51.24 H new ATOM 0 HG2 GLU A 9 -5.832 -3.635 -17.075 1.00 30.11 H new ATOM 0 HG3 GLU A 9 -6.168 -4.352 -15.511 1.00 30.11 H new ATOM 139 N THR A 10 -5.895 -0.072 -17.202 1.00 75.45 N ATOM 140 CA THR A 10 -5.047 0.389 -18.313 1.00 60.21 C ATOM 141 C THR A 10 -3.754 1.049 -17.782 1.00 11.42 C ATOM 142 O THR A 10 -2.647 0.627 -18.133 1.00 41.41 O ATOM 143 CB THR A 10 -5.849 1.369 -19.238 1.00 22.32 C ATOM 144 OG1 THR A 10 -7.079 0.744 -19.639 1.00 64.34 O ATOM 145 CG2 THR A 10 -5.059 1.766 -20.495 1.00 3.22 C ATOM 0 H THR A 10 -6.772 0.443 -17.122 1.00 75.45 H new ATOM 0 HA THR A 10 -4.753 -0.476 -18.908 1.00 60.21 H new ATOM 0 HB THR A 10 -6.041 2.276 -18.664 1.00 22.32 H new ATOM 0 HG1 THR A 10 -7.638 0.586 -18.850 1.00 64.34 H new ATOM 0 HG21 THR A 10 -5.658 2.445 -21.102 1.00 3.22 H new ATOM 0 HG22 THR A 10 -4.134 2.262 -20.202 1.00 3.22 H new ATOM 0 HG23 THR A 10 -4.824 0.873 -21.074 1.00 3.22 H new ATOM 153 N GLN A 11 -3.905 2.078 -16.930 1.00 32.34 N ATOM 154 CA GLN A 11 -2.765 2.704 -16.221 1.00 31.50 C ATOM 155 C GLN A 11 -2.165 1.763 -15.149 1.00 64.32 C ATOM 156 O GLN A 11 -0.948 1.776 -14.921 1.00 10.31 O ATOM 157 CB GLN A 11 -3.205 4.051 -15.583 1.00 64.11 C ATOM 158 CG GLN A 11 -4.408 3.964 -14.615 1.00 42.33 C ATOM 159 CD GLN A 11 -4.935 5.335 -14.177 1.00 24.14 C ATOM 160 OE1 GLN A 11 -4.505 5.894 -13.166 1.00 0.22 O ATOM 161 NE2 GLN A 11 -5.859 5.895 -14.947 1.00 72.21 N ATOM 0 H GLN A 11 -4.808 2.499 -16.712 1.00 32.34 H new ATOM 0 HA GLN A 11 -1.983 2.897 -16.955 1.00 31.50 H new ATOM 0 HB2 GLN A 11 -2.357 4.473 -15.044 1.00 64.11 H new ATOM 0 HB3 GLN A 11 -3.453 4.749 -16.383 1.00 64.11 H new ATOM 0 HG2 GLN A 11 -5.214 3.410 -15.097 1.00 42.33 H new ATOM 0 HG3 GLN A 11 -4.114 3.396 -13.732 1.00 42.33 H new ATOM 0 HE21 GLN A 11 -6.195 5.407 -15.777 1.00 72.21 H new ATOM 0 HE22 GLN A 11 -6.233 6.813 -14.709 1.00 72.21 H new ATOM 170 N LEU A 12 -3.040 0.938 -14.528 1.00 40.11 N ATOM 171 CA LEU A 12 -2.678 0.053 -13.398 1.00 31.41 C ATOM 172 C LEU A 12 -1.599 -0.959 -13.792 1.00 10.55 C ATOM 173 O LEU A 12 -0.590 -1.069 -13.107 1.00 24.30 O ATOM 174 CB LEU A 12 -3.924 -0.712 -12.887 1.00 44.01 C ATOM 175 CG LEU A 12 -3.776 -1.472 -11.541 1.00 42.42 C ATOM 176 CD1 LEU A 12 -3.563 -0.484 -10.374 1.00 21.20 C ATOM 177 CD2 LEU A 12 -4.976 -2.412 -11.298 1.00 31.52 C ATOM 0 H LEU A 12 -4.021 0.868 -14.799 1.00 40.11 H new ATOM 0 HA LEU A 12 -2.284 0.691 -12.607 1.00 31.41 H new ATOM 0 HB2 LEU A 12 -4.743 0.001 -12.786 1.00 44.01 H new ATOM 0 HB3 LEU A 12 -4.219 -1.430 -13.652 1.00 44.01 H new ATOM 0 HG LEU A 12 -2.888 -2.101 -11.597 1.00 42.42 H new ATOM 0 HD11 LEU A 12 -3.462 -1.039 -9.441 1.00 21.20 H new ATOM 0 HD12 LEU A 12 -2.658 0.098 -10.550 1.00 21.20 H new ATOM 0 HD13 LEU A 12 -4.418 0.188 -10.305 1.00 21.20 H new ATOM 0 HD21 LEU A 12 -4.845 -2.931 -10.348 1.00 31.52 H new ATOM 0 HD22 LEU A 12 -5.896 -1.828 -11.269 1.00 31.52 H new ATOM 0 HD23 LEU A 12 -5.036 -3.142 -12.105 1.00 31.52 H new ATOM 189 N GLN A 13 -1.823 -1.650 -14.930 1.00 41.14 N ATOM 190 CA GLN A 13 -0.987 -2.784 -15.385 1.00 23.31 C ATOM 191 C GLN A 13 0.493 -2.387 -15.566 1.00 10.42 C ATOM 192 O GLN A 13 1.381 -3.210 -15.353 1.00 12.44 O ATOM 193 CB GLN A 13 -1.562 -3.381 -16.698 1.00 50.31 C ATOM 194 CG GLN A 13 -1.612 -2.399 -17.886 1.00 2.34 C ATOM 195 CD GLN A 13 -2.329 -2.969 -19.107 1.00 3.14 C ATOM 196 OE1 GLN A 13 -1.716 -3.566 -19.991 1.00 21.40 O ATOM 197 NE2 GLN A 13 -3.640 -2.812 -19.153 1.00 21.32 N ATOM 0 H GLN A 13 -2.593 -1.436 -15.563 1.00 41.14 H new ATOM 0 HA GLN A 13 -1.016 -3.544 -14.605 1.00 23.31 H new ATOM 0 HB2 GLN A 13 -0.960 -4.244 -16.983 1.00 50.31 H new ATOM 0 HB3 GLN A 13 -2.570 -3.746 -16.504 1.00 50.31 H new ATOM 0 HG2 GLN A 13 -2.114 -1.484 -17.572 1.00 2.34 H new ATOM 0 HG3 GLN A 13 -0.595 -2.124 -18.165 1.00 2.34 H new ATOM 0 HE21 GLN A 13 -4.120 -2.312 -18.405 1.00 21.32 H new ATOM 0 HE22 GLN A 13 -4.172 -3.191 -19.937 1.00 21.32 H new ATOM 206 N ALA A 14 0.730 -1.113 -15.939 1.00 75.50 N ATOM 207 CA ALA A 14 2.081 -0.542 -16.075 1.00 4.24 C ATOM 208 C ALA A 14 2.722 -0.307 -14.689 1.00 75.41 C ATOM 209 O ALA A 14 3.903 -0.611 -14.484 1.00 22.20 O ATOM 210 CB ALA A 14 2.011 0.768 -16.874 1.00 14.04 C ATOM 0 H ALA A 14 -0.015 -0.450 -16.155 1.00 75.50 H new ATOM 0 HA ALA A 14 2.710 -1.251 -16.614 1.00 4.24 H new ATOM 0 HB1 ALA A 14 3.012 1.188 -16.973 1.00 14.04 H new ATOM 0 HB2 ALA A 14 1.602 0.569 -17.864 1.00 14.04 H new ATOM 0 HB3 ALA A 14 1.369 1.478 -16.353 1.00 14.04 H new ATOM 216 N ASN A 15 1.903 0.225 -13.751 1.00 20.30 N ATOM 217 CA ASN A 15 2.311 0.501 -12.349 1.00 74.43 C ATOM 218 C ASN A 15 2.660 -0.810 -11.612 1.00 42.31 C ATOM 219 O ASN A 15 3.573 -0.840 -10.778 1.00 22.21 O ATOM 220 CB ASN A 15 1.183 1.257 -11.576 1.00 64.23 C ATOM 221 CG ASN A 15 0.751 2.580 -12.226 1.00 4.21 C ATOM 222 OD1 ASN A 15 1.514 3.217 -12.954 1.00 14.22 O ATOM 223 ND2 ASN A 15 -0.476 3.022 -11.947 1.00 43.43 N ATOM 0 H ASN A 15 0.934 0.477 -13.945 1.00 20.30 H new ATOM 0 HA ASN A 15 3.197 1.135 -12.382 1.00 74.43 H new ATOM 0 HB2 ASN A 15 0.314 0.604 -11.495 1.00 64.23 H new ATOM 0 HB3 ASN A 15 1.526 1.459 -10.561 1.00 64.23 H new ATOM 0 HD21 ASN A 15 -0.801 3.906 -12.339 1.00 43.43 H new ATOM 0 HD22 ASN A 15 -1.089 2.476 -11.341 1.00 43.43 H new ATOM 230 N ARG A 16 1.925 -1.898 -11.946 1.00 62.41 N ATOM 231 CA ARG A 16 2.157 -3.231 -11.355 1.00 51.05 C ATOM 232 C ARG A 16 3.441 -3.810 -11.916 1.00 72.14 C ATOM 233 O ARG A 16 4.262 -4.319 -11.167 1.00 12.13 O ATOM 234 CB ARG A 16 1.009 -4.245 -11.664 1.00 34.15 C ATOM 235 CG ARG A 16 -0.421 -3.732 -11.465 1.00 0.04 C ATOM 236 CD ARG A 16 -0.652 -3.086 -10.095 1.00 51.32 C ATOM 237 NE ARG A 16 -0.403 -4.025 -8.996 1.00 23.13 N ATOM 238 CZ ARG A 16 -0.245 -3.680 -7.713 1.00 43.22 C ATOM 239 NH1 ARG A 16 -0.298 -2.403 -7.328 1.00 61.53 N ATOM 240 NH2 ARG A 16 -0.032 -4.620 -6.817 1.00 64.34 N ATOM 0 H ARG A 16 1.164 -1.874 -12.625 1.00 62.41 H new ATOM 0 HA ARG A 16 2.207 -3.088 -10.276 1.00 51.05 H new ATOM 0 HB2 ARG A 16 1.113 -4.575 -12.697 1.00 34.15 H new ATOM 0 HB3 ARG A 16 1.149 -5.123 -11.033 1.00 34.15 H new ATOM 0 HG2 ARG A 16 -0.650 -3.005 -12.244 1.00 0.04 H new ATOM 0 HG3 ARG A 16 -1.117 -4.562 -11.589 1.00 0.04 H new ATOM 0 HD2 ARG A 16 0.002 -2.220 -9.987 1.00 51.32 H new ATOM 0 HD3 ARG A 16 -1.677 -2.721 -10.035 1.00 51.32 H new ATOM 0 HE ARG A 16 -0.346 -5.017 -9.228 1.00 23.13 H new ATOM 0 HH11 ARG A 16 -0.462 -1.669 -8.017 1.00 61.53 H new ATOM 0 HH12 ARG A 16 -0.175 -2.161 -6.345 1.00 61.53 H new ATOM 0 HH21 ARG A 16 0.011 -5.598 -7.104 1.00 64.34 H new ATOM 0 HH22 ARG A 16 0.090 -4.371 -5.836 1.00 64.34 H new ATOM 254 N ASP A 17 3.566 -3.701 -13.257 1.00 33.45 N ATOM 255 CA ASP A 17 4.637 -4.331 -14.045 1.00 32.20 C ATOM 256 C ASP A 17 6.027 -3.952 -13.515 1.00 53.44 C ATOM 257 O ASP A 17 6.842 -4.832 -13.216 1.00 43.32 O ATOM 258 CB ASP A 17 4.504 -3.937 -15.546 1.00 32.25 C ATOM 259 CG ASP A 17 5.678 -4.423 -16.421 1.00 4.40 C ATOM 260 OD1 ASP A 17 5.795 -5.642 -16.651 1.00 62.12 O ATOM 261 OD2 ASP A 17 6.485 -3.584 -16.888 1.00 35.11 O ATOM 0 H ASP A 17 2.913 -3.163 -13.827 1.00 33.45 H new ATOM 0 HA ASP A 17 4.530 -5.411 -13.948 1.00 32.20 H new ATOM 0 HB2 ASP A 17 3.575 -4.348 -15.940 1.00 32.25 H new ATOM 0 HB3 ASP A 17 4.430 -2.852 -15.623 1.00 32.25 H new ATOM 266 N GLU A 18 6.267 -2.628 -13.392 1.00 32.30 N ATOM 267 CA GLU A 18 7.552 -2.090 -12.912 1.00 41.34 C ATOM 268 C GLU A 18 7.815 -2.435 -11.426 1.00 40.15 C ATOM 269 O GLU A 18 8.957 -2.693 -11.041 1.00 74.02 O ATOM 270 CB GLU A 18 7.640 -0.566 -13.145 1.00 53.01 C ATOM 271 CG GLU A 18 6.602 0.268 -12.379 1.00 35.15 C ATOM 272 CD GLU A 18 6.812 1.777 -12.547 1.00 4.54 C ATOM 273 OE1 GLU A 18 7.888 2.279 -12.149 1.00 11.14 O ATOM 274 OE2 GLU A 18 5.930 2.467 -13.094 1.00 10.03 O ATOM 0 H GLU A 18 5.580 -1.910 -13.621 1.00 32.30 H new ATOM 0 HA GLU A 18 8.334 -2.573 -13.498 1.00 41.34 H new ATOM 0 HB2 GLU A 18 8.637 -0.227 -12.862 1.00 53.01 H new ATOM 0 HB3 GLU A 18 7.527 -0.369 -14.211 1.00 53.01 H new ATOM 0 HG2 GLU A 18 5.603 0.004 -12.726 1.00 35.15 H new ATOM 0 HG3 GLU A 18 6.649 0.015 -11.320 1.00 35.15 H new ATOM 281 N LYS A 19 6.751 -2.452 -10.602 1.00 33.40 N ATOM 282 CA LYS A 19 6.866 -2.751 -9.158 1.00 43.33 C ATOM 283 C LYS A 19 7.045 -4.275 -8.928 1.00 24.44 C ATOM 284 O LYS A 19 7.632 -4.701 -7.928 1.00 71.44 O ATOM 285 CB LYS A 19 5.636 -2.174 -8.388 1.00 15.44 C ATOM 286 CG LYS A 19 5.782 -2.159 -6.841 1.00 42.51 C ATOM 287 CD LYS A 19 7.132 -1.530 -6.384 1.00 23.22 C ATOM 288 CE LYS A 19 7.184 -1.202 -4.877 1.00 22.02 C ATOM 289 NZ LYS A 19 6.308 -0.044 -4.552 1.00 63.20 N ATOM 0 H LYS A 19 5.798 -2.262 -10.911 1.00 33.40 H new ATOM 0 HA LYS A 19 7.756 -2.264 -8.760 1.00 43.33 H new ATOM 0 HB2 LYS A 19 5.456 -1.155 -8.731 1.00 15.44 H new ATOM 0 HB3 LYS A 19 4.754 -2.759 -8.650 1.00 15.44 H new ATOM 0 HG2 LYS A 19 4.956 -1.598 -6.405 1.00 42.51 H new ATOM 0 HG3 LYS A 19 5.711 -3.178 -6.461 1.00 42.51 H new ATOM 0 HD2 LYS A 19 7.943 -2.217 -6.626 1.00 23.22 H new ATOM 0 HD3 LYS A 19 7.308 -0.617 -6.952 1.00 23.22 H new ATOM 0 HE2 LYS A 19 6.870 -2.073 -4.301 1.00 22.02 H new ATOM 0 HE3 LYS A 19 8.210 -0.979 -4.585 1.00 22.02 H new ATOM 0 HZ1 LYS A 19 6.894 0.799 -4.386 1.00 63.20 H new ATOM 0 HZ2 LYS A 19 5.661 0.136 -5.346 1.00 63.20 H new ATOM 0 HZ3 LYS A 19 5.756 -0.256 -3.697 1.00 63.20 H new ATOM 303 N ASP A 20 6.573 -5.072 -9.900 1.00 61.44 N ATOM 304 CA ASP A 20 6.681 -6.542 -9.887 1.00 23.14 C ATOM 305 C ASP A 20 8.123 -6.950 -10.219 1.00 52.13 C ATOM 306 O ASP A 20 8.788 -7.610 -9.413 1.00 61.14 O ATOM 307 CB ASP A 20 5.668 -7.159 -10.893 1.00 25.02 C ATOM 308 CG ASP A 20 5.856 -8.671 -11.127 1.00 13.25 C ATOM 309 OD1 ASP A 20 5.671 -9.461 -10.175 1.00 4.33 O ATOM 310 OD2 ASP A 20 6.174 -9.075 -12.268 1.00 1.23 O ATOM 0 H ASP A 20 6.100 -4.710 -10.728 1.00 61.44 H new ATOM 0 HA ASP A 20 6.437 -6.923 -8.895 1.00 23.14 H new ATOM 0 HB2 ASP A 20 4.656 -6.982 -10.528 1.00 25.02 H new ATOM 0 HB3 ASP A 20 5.758 -6.640 -11.847 1.00 25.02 H new ATOM 315 N ARG A 21 8.625 -6.459 -11.382 1.00 4.23 N ATOM 316 CA ARG A 21 9.997 -6.762 -11.866 1.00 34.12 C ATOM 317 C ARG A 21 11.048 -6.217 -10.882 1.00 24.22 C ATOM 318 O ARG A 21 12.166 -6.695 -10.857 1.00 45.01 O ATOM 319 CB ARG A 21 10.225 -6.211 -13.317 1.00 24.31 C ATOM 320 CG ARG A 21 10.124 -4.671 -13.495 1.00 42.45 C ATOM 321 CD ARG A 21 11.441 -3.887 -13.235 1.00 71.13 C ATOM 322 NE ARG A 21 11.178 -2.471 -12.927 1.00 62.34 N ATOM 323 CZ ARG A 21 12.006 -1.445 -13.164 1.00 71.01 C ATOM 324 NH1 ARG A 21 13.198 -1.627 -13.741 1.00 52.43 N ATOM 325 NH2 ARG A 21 11.652 -0.234 -12.785 1.00 62.20 N ATOM 0 H ARG A 21 8.096 -5.848 -12.005 1.00 4.23 H new ATOM 0 HA ARG A 21 10.110 -7.845 -11.914 1.00 34.12 H new ATOM 0 HB2 ARG A 21 11.212 -6.530 -13.652 1.00 24.31 H new ATOM 0 HB3 ARG A 21 9.497 -6.680 -13.979 1.00 24.31 H new ATOM 0 HG2 ARG A 21 9.789 -4.460 -14.510 1.00 42.45 H new ATOM 0 HG3 ARG A 21 9.356 -4.293 -12.821 1.00 42.45 H new ATOM 0 HD2 ARG A 21 11.981 -4.346 -12.407 1.00 71.13 H new ATOM 0 HD3 ARG A 21 12.085 -3.956 -14.112 1.00 71.13 H new ATOM 0 HE ARG A 21 10.282 -2.251 -12.493 1.00 62.34 H new ATOM 0 HH11 ARG A 21 13.496 -2.564 -14.012 1.00 52.43 H new ATOM 0 HH12 ARG A 21 13.810 -0.829 -13.910 1.00 52.43 H new ATOM 0 HH21 ARG A 21 10.757 -0.087 -12.318 1.00 62.20 H new ATOM 0 HH22 ARG A 21 12.273 0.557 -12.959 1.00 62.20 H new ATOM 339 N PHE A 22 10.645 -5.214 -10.076 1.00 54.14 N ATOM 340 CA PHE A 22 11.488 -4.574 -9.045 1.00 2.34 C ATOM 341 C PHE A 22 11.995 -5.619 -8.014 1.00 74.33 C ATOM 342 O PHE A 22 13.167 -5.614 -7.648 1.00 71.33 O ATOM 343 CB PHE A 22 10.648 -3.471 -8.341 1.00 23.52 C ATOM 344 CG PHE A 22 11.417 -2.579 -7.370 1.00 61.25 C ATOM 345 CD1 PHE A 22 12.037 -1.412 -7.823 1.00 1.03 C ATOM 346 CD2 PHE A 22 11.525 -2.901 -6.014 1.00 75.54 C ATOM 347 CE1 PHE A 22 12.738 -0.602 -6.954 1.00 62.31 C ATOM 348 CE2 PHE A 22 12.227 -2.089 -5.150 1.00 1.10 C ATOM 349 CZ PHE A 22 12.835 -0.942 -5.620 1.00 52.44 C ATOM 0 H PHE A 22 9.706 -4.818 -10.124 1.00 54.14 H new ATOM 0 HA PHE A 22 12.366 -4.130 -9.514 1.00 2.34 H new ATOM 0 HB2 PHE A 22 10.195 -2.840 -9.106 1.00 23.52 H new ATOM 0 HB3 PHE A 22 9.833 -3.950 -7.799 1.00 23.52 H new ATOM 0 HD1 PHE A 22 11.967 -1.141 -8.866 1.00 1.03 H new ATOM 0 HD2 PHE A 22 11.053 -3.797 -5.639 1.00 75.54 H new ATOM 0 HE1 PHE A 22 13.211 0.298 -7.318 1.00 62.31 H new ATOM 0 HE2 PHE A 22 12.302 -2.350 -4.105 1.00 1.10 H new ATOM 0 HZ PHE A 22 13.388 -0.309 -4.942 1.00 52.44 H new ATOM 359 N PHE A 23 11.086 -6.524 -7.593 1.00 53.42 N ATOM 360 CA PHE A 23 11.354 -7.571 -6.570 1.00 22.42 C ATOM 361 C PHE A 23 12.344 -8.666 -7.067 1.00 44.44 C ATOM 362 O PHE A 23 12.811 -9.485 -6.268 1.00 63.05 O ATOM 363 CB PHE A 23 10.000 -8.221 -6.111 1.00 5.53 C ATOM 364 CG PHE A 23 9.143 -7.376 -5.150 1.00 2.11 C ATOM 365 CD1 PHE A 23 9.020 -5.991 -5.305 1.00 64.22 C ATOM 366 CD2 PHE A 23 8.495 -7.969 -4.058 1.00 5.45 C ATOM 367 CE1 PHE A 23 8.261 -5.240 -4.426 1.00 14.23 C ATOM 368 CE2 PHE A 23 7.741 -7.212 -3.175 1.00 42.25 C ATOM 369 CZ PHE A 23 7.636 -5.848 -3.353 1.00 72.44 C ATOM 0 H PHE A 23 10.133 -6.553 -7.955 1.00 53.42 H new ATOM 0 HA PHE A 23 11.836 -7.081 -5.724 1.00 22.42 H new ATOM 0 HB2 PHE A 23 9.406 -8.443 -6.998 1.00 5.53 H new ATOM 0 HB3 PHE A 23 10.221 -9.173 -5.629 1.00 5.53 H new ATOM 0 HD1 PHE A 23 9.526 -5.501 -6.124 1.00 64.22 H new ATOM 0 HD2 PHE A 23 8.585 -9.034 -3.902 1.00 5.45 H new ATOM 0 HE1 PHE A 23 8.156 -4.176 -4.578 1.00 14.23 H new ATOM 0 HE2 PHE A 23 7.236 -7.690 -2.348 1.00 42.25 H new ATOM 0 HZ PHE A 23 7.065 -5.255 -2.654 1.00 72.44 H new ATOM 379 N SER A 24 12.645 -8.676 -8.384 1.00 42.03 N ATOM 380 CA SER A 24 13.517 -9.691 -9.018 1.00 54.25 C ATOM 381 C SER A 24 14.769 -9.070 -9.690 1.00 2.12 C ATOM 382 O SER A 24 15.865 -9.641 -9.625 1.00 70.13 O ATOM 383 CB SER A 24 12.685 -10.472 -10.057 1.00 44.34 C ATOM 384 OG SER A 24 11.568 -11.104 -9.447 1.00 22.42 O ATOM 0 H SER A 24 12.290 -7.980 -9.039 1.00 42.03 H new ATOM 0 HA SER A 24 13.886 -10.357 -8.238 1.00 54.25 H new ATOM 0 HB2 SER A 24 12.341 -9.793 -10.837 1.00 44.34 H new ATOM 0 HB3 SER A 24 13.312 -11.221 -10.540 1.00 44.34 H new ATOM 0 HG SER A 24 10.988 -11.482 -10.140 1.00 22.42 H new ATOM 390 N GLU A 25 14.604 -7.895 -10.310 1.00 41.42 N ATOM 391 CA GLU A 25 15.618 -7.284 -11.193 1.00 41.31 C ATOM 392 C GLU A 25 16.441 -6.238 -10.425 1.00 31.41 C ATOM 393 O GLU A 25 17.666 -6.169 -10.571 1.00 54.12 O ATOM 394 CB GLU A 25 14.930 -6.613 -12.421 1.00 72.24 C ATOM 395 CG GLU A 25 14.140 -7.573 -13.338 1.00 43.45 C ATOM 396 CD GLU A 25 15.027 -8.632 -14.012 1.00 5.23 C ATOM 397 OE1 GLU A 25 15.867 -8.259 -14.861 1.00 12.35 O ATOM 398 OE2 GLU A 25 14.910 -9.832 -13.691 1.00 23.33 O ATOM 0 H GLU A 25 13.758 -7.333 -10.215 1.00 41.42 H new ATOM 0 HA GLU A 25 16.286 -8.071 -11.543 1.00 41.31 H new ATOM 0 HB2 GLU A 25 14.251 -5.840 -12.060 1.00 72.24 H new ATOM 0 HB3 GLU A 25 15.694 -6.113 -13.017 1.00 72.24 H new ATOM 0 HG2 GLU A 25 13.369 -8.073 -12.752 1.00 43.45 H new ATOM 0 HG3 GLU A 25 13.629 -6.993 -14.107 1.00 43.45 H new ATOM 405 N HIS A 26 15.750 -5.422 -9.610 1.00 45.43 N ATOM 406 CA HIS A 26 16.379 -4.301 -8.890 1.00 53.21 C ATOM 407 C HIS A 26 16.892 -4.772 -7.519 1.00 63.41 C ATOM 408 O HIS A 26 18.104 -4.789 -7.258 1.00 41.34 O ATOM 409 CB HIS A 26 15.365 -3.135 -8.719 1.00 20.02 C ATOM 410 CG HIS A 26 15.937 -1.948 -7.992 1.00 0.30 C ATOM 411 ND1 HIS A 26 15.925 -1.888 -6.623 1.00 2.12 N ATOM 412 CD2 HIS A 26 16.561 -0.849 -8.473 1.00 55.05 C ATOM 413 CE1 HIS A 26 16.540 -0.779 -6.299 1.00 13.12 C ATOM 414 NE2 HIS A 26 16.948 -0.109 -7.383 1.00 11.35 N ATOM 0 H HIS A 26 14.750 -5.519 -9.433 1.00 45.43 H new ATOM 0 HA HIS A 26 17.226 -3.940 -9.473 1.00 53.21 H new ATOM 0 HB2 HIS A 26 15.019 -2.817 -9.702 1.00 20.02 H new ATOM 0 HB3 HIS A 26 14.493 -3.499 -8.176 1.00 20.02 H new ATOM 0 HD2 HIS A 26 16.723 -0.602 -9.512 1.00 55.05 H new ATOM 0 HE1 HIS A 26 16.698 -0.446 -5.284 1.00 13.12 H new ATOM 0 HE2 HIS A 26 17.449 0.779 -7.397 1.00 11.35 H new ATOM 422 N ARG A 27 15.949 -5.201 -6.667 1.00 34.10 N ATOM 423 CA ARG A 27 16.218 -5.585 -5.279 1.00 74.41 C ATOM 424 C ARG A 27 16.301 -7.103 -5.163 1.00 74.24 C ATOM 425 O ARG A 27 15.567 -7.839 -5.846 1.00 22.43 O ATOM 426 CB ARG A 27 15.119 -5.012 -4.317 1.00 64.30 C ATOM 427 CG ARG A 27 15.373 -3.562 -3.864 1.00 21.32 C ATOM 428 CD ARG A 27 16.661 -3.440 -3.034 1.00 3.35 C ATOM 429 NE ARG A 27 17.056 -2.047 -2.803 1.00 74.11 N ATOM 430 CZ ARG A 27 18.021 -1.659 -1.954 1.00 51.31 C ATOM 431 NH1 ARG A 27 18.693 -2.544 -1.217 1.00 73.15 N ATOM 432 NH2 ARG A 27 18.318 -0.389 -1.858 1.00 43.02 N ATOM 0 H ARG A 27 14.967 -5.291 -6.929 1.00 34.10 H new ATOM 0 HA ARG A 27 17.176 -5.160 -4.981 1.00 74.41 H new ATOM 0 HB2 ARG A 27 14.152 -5.061 -4.818 1.00 64.30 H new ATOM 0 HB3 ARG A 27 15.054 -5.650 -3.436 1.00 64.30 H new ATOM 0 HG2 ARG A 27 15.442 -2.915 -4.738 1.00 21.32 H new ATOM 0 HG3 ARG A 27 14.526 -3.212 -3.274 1.00 21.32 H new ATOM 0 HD2 ARG A 27 16.518 -3.937 -2.074 1.00 3.35 H new ATOM 0 HD3 ARG A 27 17.469 -3.962 -3.546 1.00 3.35 H new ATOM 0 HE ARG A 27 16.563 -1.322 -3.324 1.00 74.11 H new ATOM 0 HH11 ARG A 27 18.478 -3.538 -1.292 1.00 73.15 H new ATOM 0 HH12 ARG A 27 19.422 -2.227 -0.578 1.00 73.15 H new ATOM 0 HH21 ARG A 27 17.818 0.296 -2.425 1.00 43.02 H new ATOM 0 HH22 ARG A 27 19.049 -0.083 -1.216 1.00 43.02 H new ATOM 446 N GLN A 28 17.241 -7.551 -4.313 1.00 14.31 N ATOM 447 CA GLN A 28 17.327 -8.947 -3.875 1.00 5.04 C ATOM 448 C GLN A 28 16.033 -9.301 -3.117 1.00 44.23 C ATOM 449 O GLN A 28 15.495 -8.462 -2.370 1.00 22.04 O ATOM 450 CB GLN A 28 18.592 -9.181 -3.000 1.00 15.14 C ATOM 451 CG GLN A 28 18.683 -8.278 -1.757 1.00 50.53 C ATOM 452 CD GLN A 28 20.025 -8.374 -1.038 1.00 44.14 C ATOM 453 OE1 GLN A 28 20.205 -9.186 -0.134 1.00 21.22 O ATOM 454 NE2 GLN A 28 20.980 -7.549 -1.441 1.00 11.31 N ATOM 0 H GLN A 28 17.962 -6.951 -3.912 1.00 14.31 H new ATOM 0 HA GLN A 28 17.425 -9.603 -4.740 1.00 5.04 H new ATOM 0 HB2 GLN A 28 18.609 -10.223 -2.679 1.00 15.14 H new ATOM 0 HB3 GLN A 28 19.478 -9.022 -3.615 1.00 15.14 H new ATOM 0 HG2 GLN A 28 18.511 -7.244 -2.055 1.00 50.53 H new ATOM 0 HG3 GLN A 28 17.887 -8.546 -1.063 1.00 50.53 H new ATOM 0 HE21 GLN A 28 20.797 -6.887 -2.195 1.00 11.31 H new ATOM 0 HE22 GLN A 28 21.898 -7.576 -0.998 1.00 11.31 H new ATOM 463 N SER A 29 15.544 -10.521 -3.370 1.00 3.42 N ATOM 464 CA SER A 29 14.189 -10.957 -2.997 1.00 50.04 C ATOM 465 C SER A 29 13.828 -10.639 -1.512 1.00 31.44 C ATOM 466 O SER A 29 14.484 -11.139 -0.588 1.00 51.24 O ATOM 467 CB SER A 29 14.103 -12.473 -3.259 1.00 45.31 C ATOM 468 OG SER A 29 14.478 -12.774 -4.600 1.00 74.53 O ATOM 0 H SER A 29 16.084 -11.244 -3.846 1.00 3.42 H new ATOM 0 HA SER A 29 13.467 -10.405 -3.599 1.00 50.04 H new ATOM 0 HB2 SER A 29 14.755 -13.005 -2.566 1.00 45.31 H new ATOM 0 HB3 SER A 29 13.087 -12.822 -3.073 1.00 45.31 H new ATOM 0 HG SER A 29 15.018 -13.592 -4.613 1.00 74.53 H new ATOM 474 N PRO A 30 12.758 -9.793 -1.280 1.00 75.13 N ATOM 475 CA PRO A 30 12.211 -9.543 0.072 1.00 63.02 C ATOM 476 C PRO A 30 11.296 -10.687 0.535 1.00 63.20 C ATOM 477 O PRO A 30 11.057 -10.862 1.732 1.00 5.34 O ATOM 478 CB PRO A 30 11.433 -8.226 -0.103 1.00 40.21 C ATOM 479 CG PRO A 30 10.983 -8.226 -1.533 1.00 44.53 C ATOM 480 CD PRO A 30 12.053 -8.971 -2.315 1.00 54.42 C ATOM 0 HA PRO A 30 12.983 -9.482 0.839 1.00 63.02 H new ATOM 0 HB2 PRO A 30 10.583 -8.177 0.578 1.00 40.21 H new ATOM 0 HB3 PRO A 30 12.064 -7.364 0.112 1.00 40.21 H new ATOM 0 HG2 PRO A 30 10.014 -8.715 -1.636 1.00 44.53 H new ATOM 0 HG3 PRO A 30 10.867 -7.208 -1.905 1.00 44.53 H new ATOM 0 HD2 PRO A 30 11.615 -9.598 -3.091 1.00 54.42 H new ATOM 0 HD3 PRO A 30 12.737 -8.282 -2.810 1.00 54.42 H new ATOM 488 N ILE A 31 10.734 -11.420 -0.436 1.00 72.12 N ATOM 489 CA ILE A 31 10.137 -12.732 -0.198 1.00 33.02 C ATOM 490 C ILE A 31 11.280 -13.752 -0.297 1.00 42.41 C ATOM 491 O ILE A 31 11.860 -13.866 -1.384 1.00 22.21 O ATOM 492 CB ILE A 31 9.007 -13.056 -1.252 1.00 34.22 C ATOM 493 CG1 ILE A 31 8.019 -11.846 -1.395 1.00 60.44 C ATOM 494 CG2 ILE A 31 8.256 -14.365 -0.884 1.00 51.43 C ATOM 495 CD1 ILE A 31 7.439 -11.328 -0.090 1.00 33.11 C ATOM 0 H ILE A 31 10.683 -11.115 -1.408 1.00 72.12 H new ATOM 0 HA ILE A 31 9.659 -12.763 0.781 1.00 33.02 H new ATOM 0 HB ILE A 31 9.481 -13.215 -2.221 1.00 34.22 H new ATOM 0 HG12 ILE A 31 8.541 -11.028 -1.892 1.00 60.44 H new ATOM 0 HG13 ILE A 31 7.197 -12.143 -2.047 1.00 60.44 H new ATOM 0 HG21 ILE A 31 7.484 -14.563 -1.627 1.00 51.43 H new ATOM 0 HG22 ILE A 31 8.961 -15.196 -0.864 1.00 51.43 H new ATOM 0 HG23 ILE A 31 7.795 -14.256 0.098 1.00 51.43 H new ATOM 0 HD11 ILE A 31 6.769 -10.493 -0.296 1.00 33.11 H new ATOM 0 HD12 ILE A 31 6.883 -12.126 0.403 1.00 33.11 H new ATOM 0 HD13 ILE A 31 8.247 -10.993 0.560 1.00 33.11 H new ATOM 507 N PRO A 32 11.652 -14.448 0.842 1.00 2.31 N ATOM 508 CA PRO A 32 12.856 -15.326 0.933 1.00 52.34 C ATOM 509 C PRO A 32 13.160 -16.136 -0.358 1.00 51.54 C ATOM 510 O PRO A 32 12.249 -16.777 -0.898 1.00 11.21 O ATOM 511 CB PRO A 32 12.491 -16.254 2.106 1.00 53.34 C ATOM 512 CG PRO A 32 11.691 -15.383 3.032 1.00 14.45 C ATOM 513 CD PRO A 32 10.905 -14.437 2.139 1.00 64.34 C ATOM 0 HA PRO A 32 13.770 -14.749 1.073 1.00 52.34 H new ATOM 0 HB2 PRO A 32 11.912 -17.113 1.768 1.00 53.34 H new ATOM 0 HB3 PRO A 32 13.382 -16.644 2.597 1.00 53.34 H new ATOM 0 HG2 PRO A 32 11.023 -15.981 3.651 1.00 14.45 H new ATOM 0 HG3 PRO A 32 12.343 -14.830 3.709 1.00 14.45 H new ATOM 0 HD2 PRO A 32 9.877 -14.775 2.009 1.00 64.34 H new ATOM 0 HD3 PRO A 32 10.860 -13.434 2.564 1.00 64.34 H new ATOM 521 N PRO A 33 14.439 -16.093 -0.879 1.00 4.32 N ATOM 522 CA PRO A 33 14.845 -16.779 -2.140 1.00 53.33 C ATOM 523 C PRO A 33 14.398 -18.262 -2.217 1.00 3.15 C ATOM 524 O PRO A 33 14.034 -18.753 -3.298 1.00 64.32 O ATOM 525 CB PRO A 33 16.403 -16.634 -2.157 1.00 44.03 C ATOM 526 CG PRO A 33 16.781 -16.134 -0.784 1.00 51.41 C ATOM 527 CD PRO A 33 15.592 -15.335 -0.311 1.00 1.11 C ATOM 0 HA PRO A 33 14.363 -16.332 -3.009 1.00 53.33 H new ATOM 0 HB2 PRO A 33 16.883 -17.589 -2.372 1.00 44.03 H new ATOM 0 HB3 PRO A 33 16.723 -15.935 -2.930 1.00 44.03 H new ATOM 0 HG2 PRO A 33 16.992 -16.962 -0.108 1.00 51.41 H new ATOM 0 HG3 PRO A 33 17.679 -15.517 -0.823 1.00 51.41 H new ATOM 0 HD2 PRO A 33 15.546 -15.283 0.777 1.00 1.11 H new ATOM 0 HD3 PRO A 33 15.622 -14.309 -0.678 1.00 1.11 H new ATOM 535 N GLU A 34 14.370 -18.936 -1.053 1.00 42.34 N ATOM 536 CA GLU A 34 13.962 -20.347 -0.938 1.00 50.44 C ATOM 537 C GLU A 34 12.422 -20.501 -1.004 1.00 71.03 C ATOM 538 O GLU A 34 11.919 -21.432 -1.648 1.00 61.41 O ATOM 539 CB GLU A 34 14.519 -20.956 0.374 1.00 22.22 C ATOM 540 CG GLU A 34 16.059 -20.993 0.446 1.00 51.20 C ATOM 541 CD GLU A 34 16.589 -21.645 1.732 1.00 73.22 C ATOM 542 OE1 GLU A 34 16.689 -22.891 1.779 1.00 64.45 O ATOM 543 OE2 GLU A 34 16.894 -20.918 2.706 1.00 1.03 O ATOM 0 H GLU A 34 14.631 -18.515 -0.162 1.00 42.34 H new ATOM 0 HA GLU A 34 14.380 -20.890 -1.785 1.00 50.44 H new ATOM 0 HB2 GLU A 34 14.140 -20.381 1.219 1.00 22.22 H new ATOM 0 HB3 GLU A 34 14.136 -21.971 0.482 1.00 22.22 H new ATOM 0 HG2 GLU A 34 16.444 -21.539 -0.416 1.00 51.20 H new ATOM 0 HG3 GLU A 34 16.444 -19.976 0.377 1.00 51.20 H new ATOM 550 N GLU A 35 11.676 -19.577 -0.349 1.00 0.52 N ATOM 551 CA GLU A 35 10.192 -19.577 -0.365 1.00 31.02 C ATOM 552 C GLU A 35 9.670 -19.354 -1.793 1.00 33.44 C ATOM 553 O GLU A 35 8.860 -20.139 -2.294 1.00 72.32 O ATOM 554 CB GLU A 35 9.627 -18.473 0.584 1.00 33.25 C ATOM 555 CG GLU A 35 9.770 -18.770 2.095 1.00 51.52 C ATOM 556 CD GLU A 35 8.845 -19.901 2.582 1.00 75.31 C ATOM 557 OE1 GLU A 35 7.611 -19.696 2.610 1.00 2.44 O ATOM 558 OE2 GLU A 35 9.333 -20.994 2.932 1.00 41.43 O ATOM 0 H GLU A 35 12.081 -18.818 0.200 1.00 0.52 H new ATOM 0 HA GLU A 35 9.851 -20.550 -0.010 1.00 31.02 H new ATOM 0 HB2 GLU A 35 10.134 -17.533 0.365 1.00 33.25 H new ATOM 0 HB3 GLU A 35 8.571 -18.326 0.357 1.00 33.25 H new ATOM 0 HG2 GLU A 35 10.805 -19.038 2.310 1.00 51.52 H new ATOM 0 HG3 GLU A 35 9.552 -17.863 2.659 1.00 51.52 H new ATOM 565 N ARG A 36 10.219 -18.324 -2.476 1.00 44.40 N ATOM 566 CA ARG A 36 9.731 -17.884 -3.801 1.00 1.04 C ATOM 567 C ARG A 36 10.151 -18.850 -4.936 1.00 72.02 C ATOM 568 O ARG A 36 9.861 -18.583 -6.107 1.00 14.11 O ATOM 569 CB ARG A 36 10.192 -16.435 -4.130 1.00 24.31 C ATOM 570 CG ARG A 36 11.715 -16.257 -4.314 1.00 62.42 C ATOM 571 CD ARG A 36 12.085 -14.894 -4.920 1.00 53.04 C ATOM 572 NE ARG A 36 11.572 -14.748 -6.293 1.00 64.22 N ATOM 573 CZ ARG A 36 11.751 -13.685 -7.100 1.00 5.51 C ATOM 574 NH1 ARG A 36 12.458 -12.616 -6.717 1.00 60.32 N ATOM 575 NH2 ARG A 36 11.184 -13.691 -8.299 1.00 22.41 N ATOM 0 H ARG A 36 11.007 -17.779 -2.127 1.00 44.40 H new ATOM 0 HA ARG A 36 8.643 -17.896 -3.742 1.00 1.04 H new ATOM 0 HB2 ARG A 36 9.691 -16.109 -5.042 1.00 24.31 H new ATOM 0 HB3 ARG A 36 9.859 -15.774 -3.330 1.00 24.31 H new ATOM 0 HG2 ARG A 36 12.209 -16.366 -3.348 1.00 62.42 H new ATOM 0 HG3 ARG A 36 12.094 -17.051 -4.958 1.00 62.42 H new ATOM 0 HD2 ARG A 36 11.682 -14.097 -4.295 1.00 53.04 H new ATOM 0 HD3 ARG A 36 13.169 -14.780 -4.923 1.00 53.04 H new ATOM 0 HE ARG A 36 11.030 -15.526 -6.668 1.00 64.22 H new ATOM 0 HH11 ARG A 36 12.881 -12.590 -5.789 1.00 60.32 H new ATOM 0 HH12 ARG A 36 12.575 -11.827 -7.353 1.00 60.32 H new ATOM 0 HH21 ARG A 36 10.625 -14.491 -8.595 1.00 22.41 H new ATOM 0 HH22 ARG A 36 11.307 -12.896 -8.925 1.00 22.41 H new ATOM 589 N ASP A 37 10.874 -19.934 -4.602 1.00 31.24 N ATOM 590 CA ASP A 37 11.145 -21.023 -5.559 1.00 40.24 C ATOM 591 C ASP A 37 9.823 -21.692 -5.989 1.00 64.13 C ATOM 592 O ASP A 37 9.591 -21.933 -7.178 1.00 24.11 O ATOM 593 CB ASP A 37 12.120 -22.063 -4.944 1.00 14.14 C ATOM 594 CG ASP A 37 12.441 -23.225 -5.903 1.00 21.32 C ATOM 595 OD1 ASP A 37 13.172 -22.998 -6.889 1.00 71.11 O ATOM 596 OD2 ASP A 37 11.958 -24.361 -5.688 1.00 20.53 O ATOM 0 H ASP A 37 11.281 -20.080 -3.678 1.00 31.24 H new ATOM 0 HA ASP A 37 11.622 -20.601 -6.444 1.00 40.24 H new ATOM 0 HB2 ASP A 37 13.047 -21.563 -4.664 1.00 14.14 H new ATOM 0 HB3 ASP A 37 11.685 -22.464 -4.028 1.00 14.14 H new ATOM 601 N ASP A 38 8.961 -21.956 -4.997 1.00 22.23 N ATOM 602 CA ASP A 38 7.631 -22.565 -5.209 1.00 31.44 C ATOM 603 C ASP A 38 6.616 -21.533 -5.734 1.00 44.31 C ATOM 604 O ASP A 38 5.684 -21.877 -6.464 1.00 43.14 O ATOM 605 CB ASP A 38 7.117 -23.179 -3.885 1.00 51.21 C ATOM 606 CG ASP A 38 8.095 -24.201 -3.289 1.00 70.51 C ATOM 607 OD1 ASP A 38 8.265 -25.291 -3.881 1.00 22.30 O ATOM 608 OD2 ASP A 38 8.714 -23.915 -2.242 1.00 20.11 O ATOM 0 H ASP A 38 9.164 -21.754 -4.018 1.00 22.23 H new ATOM 0 HA ASP A 38 7.736 -23.348 -5.960 1.00 31.44 H new ATOM 0 HB2 ASP A 38 6.945 -22.382 -3.162 1.00 51.21 H new ATOM 0 HB3 ASP A 38 6.156 -23.662 -4.062 1.00 51.21 H new ATOM 613 N PHE A 39 6.804 -20.271 -5.327 1.00 1.51 N ATOM 614 CA PHE A 39 5.917 -19.147 -5.686 1.00 30.30 C ATOM 615 C PHE A 39 6.396 -18.445 -6.968 1.00 2.14 C ATOM 616 O PHE A 39 7.536 -18.605 -7.400 1.00 71.20 O ATOM 617 CB PHE A 39 5.830 -18.111 -4.520 1.00 64.42 C ATOM 618 CG PHE A 39 5.148 -18.616 -3.241 1.00 22.21 C ATOM 619 CD1 PHE A 39 5.800 -19.508 -2.391 1.00 52.41 C ATOM 620 CD2 PHE A 39 3.870 -18.177 -2.873 1.00 73.34 C ATOM 621 CE1 PHE A 39 5.201 -19.960 -1.231 1.00 1.22 C ATOM 622 CE2 PHE A 39 3.271 -18.632 -1.710 1.00 43.04 C ATOM 623 CZ PHE A 39 3.939 -19.517 -0.887 1.00 31.20 C ATOM 0 H PHE A 39 7.585 -19.994 -4.732 1.00 1.51 H new ATOM 0 HA PHE A 39 4.925 -19.562 -5.867 1.00 30.30 H new ATOM 0 HB2 PHE A 39 6.840 -17.786 -4.269 1.00 64.42 H new ATOM 0 HB3 PHE A 39 5.292 -17.233 -4.876 1.00 64.42 H new ATOM 0 HD1 PHE A 39 6.792 -19.852 -2.644 1.00 52.41 H new ATOM 0 HD2 PHE A 39 3.345 -17.475 -3.504 1.00 73.34 H new ATOM 0 HE1 PHE A 39 5.720 -20.660 -0.593 1.00 1.22 H new ATOM 0 HE2 PHE A 39 2.280 -18.294 -1.446 1.00 43.04 H new ATOM 0 HZ PHE A 39 3.475 -19.862 0.025 1.00 31.20 H new ATOM 633 N ASP A 40 5.484 -17.693 -7.586 1.00 70.41 N ATOM 634 CA ASP A 40 5.808 -16.691 -8.626 1.00 5.41 C ATOM 635 C ASP A 40 6.225 -15.372 -7.948 1.00 35.54 C ATOM 636 O ASP A 40 6.283 -15.323 -6.721 1.00 10.21 O ATOM 637 CB ASP A 40 4.626 -16.473 -9.602 1.00 13.11 C ATOM 638 CG ASP A 40 4.389 -17.674 -10.539 1.00 14.22 C ATOM 639 OD1 ASP A 40 5.249 -17.929 -11.412 1.00 54.50 O ATOM 640 OD2 ASP A 40 3.369 -18.376 -10.397 1.00 41.02 O ATOM 0 H ASP A 40 4.486 -17.756 -7.383 1.00 70.41 H new ATOM 0 HA ASP A 40 6.639 -17.065 -9.224 1.00 5.41 H new ATOM 0 HB2 ASP A 40 3.719 -16.282 -9.028 1.00 13.11 H new ATOM 0 HB3 ASP A 40 4.817 -15.583 -10.202 1.00 13.11 H new ATOM 645 N GLY A 41 6.655 -14.394 -8.778 1.00 54.41 N ATOM 646 CA GLY A 41 7.112 -13.030 -8.374 1.00 62.40 C ATOM 647 C GLY A 41 6.305 -12.295 -7.261 1.00 54.12 C ATOM 648 O GLY A 41 5.947 -12.894 -6.248 1.00 42.51 O ATOM 0 H GLY A 41 6.698 -14.531 -9.788 1.00 54.41 H new ATOM 0 HA2 GLY A 41 8.147 -13.108 -8.042 1.00 62.40 H new ATOM 0 HA3 GLY A 41 7.109 -12.399 -9.263 1.00 62.40 H new ATOM 652 N LEU A 42 6.171 -10.942 -7.380 1.00 73.01 N ATOM 653 CA LEU A 42 5.486 -10.094 -6.357 1.00 3.43 C ATOM 654 C LEU A 42 4.098 -10.699 -6.041 1.00 12.34 C ATOM 655 O LEU A 42 3.144 -10.546 -6.822 1.00 3.55 O ATOM 656 CB LEU A 42 5.357 -8.593 -6.841 1.00 71.25 C ATOM 657 CG LEU A 42 5.021 -7.476 -5.765 1.00 75.03 C ATOM 658 CD1 LEU A 42 5.029 -6.077 -6.408 1.00 24.14 C ATOM 659 CD2 LEU A 42 3.688 -7.700 -5.009 1.00 32.23 C ATOM 0 H LEU A 42 6.529 -10.414 -8.176 1.00 73.01 H new ATOM 0 HA LEU A 42 6.088 -10.083 -5.448 1.00 3.43 H new ATOM 0 HB2 LEU A 42 6.296 -8.318 -7.322 1.00 71.25 H new ATOM 0 HB3 LEU A 42 4.583 -8.558 -7.608 1.00 71.25 H new ATOM 0 HG LEU A 42 5.812 -7.550 -5.019 1.00 75.03 H new ATOM 0 HD11 LEU A 42 4.796 -5.328 -5.652 1.00 24.14 H new ATOM 0 HD12 LEU A 42 6.015 -5.875 -6.828 1.00 24.14 H new ATOM 0 HD13 LEU A 42 4.282 -6.037 -7.201 1.00 24.14 H new ATOM 0 HD21 LEU A 42 3.535 -6.892 -4.293 1.00 32.23 H new ATOM 0 HD22 LEU A 42 2.863 -7.714 -5.722 1.00 32.23 H new ATOM 0 HD23 LEU A 42 3.726 -8.652 -4.479 1.00 32.23 H new ATOM 671 N SER A 43 4.040 -11.431 -4.916 1.00 35.20 N ATOM 672 CA SER A 43 2.819 -12.058 -4.419 1.00 45.44 C ATOM 673 C SER A 43 1.876 -10.989 -3.850 1.00 14.24 C ATOM 674 O SER A 43 2.243 -10.259 -2.915 1.00 11.10 O ATOM 675 CB SER A 43 3.179 -13.106 -3.334 1.00 65.50 C ATOM 676 OG SER A 43 4.163 -14.022 -3.808 1.00 74.11 O ATOM 0 H SER A 43 4.853 -11.602 -4.324 1.00 35.20 H new ATOM 0 HA SER A 43 2.309 -12.564 -5.239 1.00 45.44 H new ATOM 0 HB2 SER A 43 3.550 -12.599 -2.443 1.00 65.50 H new ATOM 0 HB3 SER A 43 2.282 -13.652 -3.040 1.00 65.50 H new ATOM 0 HG SER A 43 4.373 -14.670 -3.104 1.00 74.11 H new ATOM 682 N TYR A 44 0.684 -10.886 -4.449 1.00 10.12 N ATOM 683 CA TYR A 44 -0.380 -9.995 -3.975 1.00 32.42 C ATOM 684 C TYR A 44 -1.754 -10.613 -4.309 1.00 51.35 C ATOM 685 O TYR A 44 -1.828 -11.787 -4.703 1.00 25.32 O ATOM 686 CB TYR A 44 -0.178 -8.542 -4.535 1.00 31.30 C ATOM 687 CG TYR A 44 -0.551 -8.268 -6.011 1.00 50.12 C ATOM 688 CD1 TYR A 44 0.123 -8.865 -7.077 1.00 2.43 C ATOM 689 CD2 TYR A 44 -1.575 -7.370 -6.327 1.00 40.24 C ATOM 690 CE1 TYR A 44 -0.224 -8.573 -8.391 1.00 24.44 C ATOM 691 CE2 TYR A 44 -1.917 -7.075 -7.628 1.00 32.21 C ATOM 692 CZ TYR A 44 -1.243 -7.675 -8.657 1.00 73.23 C ATOM 693 OH TYR A 44 -1.576 -7.366 -9.960 1.00 61.23 O ATOM 0 H TYR A 44 0.430 -11.421 -5.280 1.00 10.12 H new ATOM 0 HA TYR A 44 -0.336 -9.895 -2.890 1.00 32.42 H new ATOM 0 HB2 TYR A 44 -0.760 -7.862 -3.913 1.00 31.30 H new ATOM 0 HB3 TYR A 44 0.871 -8.277 -4.402 1.00 31.30 H new ATOM 0 HD1 TYR A 44 0.924 -9.562 -6.879 1.00 2.43 H new ATOM 0 HD2 TYR A 44 -2.116 -6.892 -5.524 1.00 40.24 H new ATOM 0 HE1 TYR A 44 0.302 -9.048 -9.206 1.00 24.44 H new ATOM 0 HE2 TYR A 44 -2.712 -6.374 -7.835 1.00 32.21 H new ATOM 0 HH TYR A 44 -2.313 -6.720 -9.965 1.00 61.23 H new ATOM 703 N PHE A 45 -2.829 -9.840 -4.127 1.00 73.30 N ATOM 704 CA PHE A 45 -4.209 -10.332 -4.323 1.00 74.14 C ATOM 705 C PHE A 45 -4.597 -10.110 -5.795 1.00 24.03 C ATOM 706 O PHE A 45 -4.148 -9.138 -6.411 1.00 23.12 O ATOM 707 CB PHE A 45 -5.177 -9.617 -3.346 1.00 34.32 C ATOM 708 CG PHE A 45 -4.726 -9.709 -1.884 1.00 4.44 C ATOM 709 CD1 PHE A 45 -4.858 -10.901 -1.173 1.00 65.44 C ATOM 710 CD2 PHE A 45 -4.149 -8.615 -1.230 1.00 65.40 C ATOM 711 CE1 PHE A 45 -4.426 -11.000 0.138 1.00 23.04 C ATOM 712 CE2 PHE A 45 -3.722 -8.715 0.083 1.00 23.02 C ATOM 713 CZ PHE A 45 -3.861 -9.906 0.765 1.00 71.11 C ATOM 0 H PHE A 45 -2.776 -8.862 -3.842 1.00 73.30 H new ATOM 0 HA PHE A 45 -4.274 -11.398 -4.103 1.00 74.14 H new ATOM 0 HB2 PHE A 45 -5.262 -8.568 -3.629 1.00 34.32 H new ATOM 0 HB3 PHE A 45 -6.171 -10.054 -3.442 1.00 34.32 H new ATOM 0 HD1 PHE A 45 -5.304 -11.760 -1.652 1.00 65.44 H new ATOM 0 HD2 PHE A 45 -4.035 -7.679 -1.757 1.00 65.40 H new ATOM 0 HE1 PHE A 45 -4.531 -11.933 0.672 1.00 23.04 H new ATOM 0 HE2 PHE A 45 -3.280 -7.860 0.574 1.00 23.02 H new ATOM 0 HZ PHE A 45 -3.528 -9.983 1.789 1.00 71.11 H new ATOM 723 N ASP A 46 -5.409 -11.010 -6.364 1.00 24.21 N ATOM 724 CA ASP A 46 -5.700 -10.995 -7.811 1.00 30.35 C ATOM 725 C ASP A 46 -6.599 -9.768 -8.148 1.00 11.34 C ATOM 726 O ASP A 46 -7.649 -9.607 -7.511 1.00 25.33 O ATOM 727 CB ASP A 46 -6.356 -12.333 -8.239 1.00 74.42 C ATOM 728 CG ASP A 46 -6.675 -12.421 -9.743 1.00 73.13 C ATOM 729 OD1 ASP A 46 -5.727 -12.476 -10.560 1.00 22.34 O ATOM 730 OD2 ASP A 46 -7.867 -12.432 -10.113 1.00 70.10 O ATOM 0 H ASP A 46 -5.877 -11.757 -5.850 1.00 24.21 H new ATOM 0 HA ASP A 46 -4.772 -10.896 -8.375 1.00 30.35 H new ATOM 0 HB2 ASP A 46 -5.691 -13.154 -7.970 1.00 74.42 H new ATOM 0 HB3 ASP A 46 -7.278 -12.471 -7.674 1.00 74.42 H new ATOM 735 N PRO A 47 -6.170 -8.884 -9.131 1.00 14.01 N ATOM 736 CA PRO A 47 -6.808 -7.560 -9.417 1.00 11.01 C ATOM 737 C PRO A 47 -8.355 -7.612 -9.517 1.00 41.44 C ATOM 738 O PRO A 47 -8.920 -8.156 -10.470 1.00 61.23 O ATOM 739 CB PRO A 47 -6.133 -7.105 -10.750 1.00 4.04 C ATOM 740 CG PRO A 47 -5.397 -8.320 -11.263 1.00 44.40 C ATOM 741 CD PRO A 47 -5.006 -9.097 -10.030 1.00 62.45 C ATOM 0 HA PRO A 47 -6.652 -6.856 -8.600 1.00 11.01 H new ATOM 0 HB2 PRO A 47 -6.877 -6.763 -11.470 1.00 4.04 H new ATOM 0 HB3 PRO A 47 -5.448 -6.274 -10.580 1.00 4.04 H new ATOM 0 HG2 PRO A 47 -6.031 -8.916 -11.919 1.00 44.40 H new ATOM 0 HG3 PRO A 47 -4.519 -8.033 -11.842 1.00 44.40 H new ATOM 0 HD2 PRO A 47 -4.851 -10.153 -10.249 1.00 62.45 H new ATOM 0 HD3 PRO A 47 -4.081 -8.723 -9.591 1.00 62.45 H new ATOM 749 N ASP A 48 -9.009 -7.063 -8.482 1.00 2.52 N ATOM 750 CA ASP A 48 -10.465 -7.153 -8.269 1.00 73.23 C ATOM 751 C ASP A 48 -11.094 -5.738 -8.150 1.00 53.22 C ATOM 752 O ASP A 48 -10.675 -4.957 -7.287 1.00 41.12 O ATOM 753 CB ASP A 48 -10.737 -7.983 -6.984 1.00 31.22 C ATOM 754 CG ASP A 48 -12.223 -8.061 -6.586 1.00 5.43 C ATOM 755 OD1 ASP A 48 -13.058 -8.403 -7.451 1.00 61.41 O ATOM 756 OD2 ASP A 48 -12.558 -7.787 -5.413 1.00 44.43 O ATOM 0 H ASP A 48 -8.532 -6.532 -7.753 1.00 2.52 H new ATOM 0 HA ASP A 48 -10.925 -7.647 -9.125 1.00 73.23 H new ATOM 0 HB2 ASP A 48 -10.358 -8.994 -7.131 1.00 31.22 H new ATOM 0 HB3 ASP A 48 -10.173 -7.549 -6.158 1.00 31.22 H new ATOM 761 N PRO A 49 -12.112 -5.381 -9.001 1.00 55.04 N ATOM 762 CA PRO A 49 -12.838 -4.092 -8.884 1.00 45.23 C ATOM 763 C PRO A 49 -13.952 -4.109 -7.806 1.00 61.45 C ATOM 764 O PRO A 49 -14.492 -3.051 -7.464 1.00 22.22 O ATOM 765 CB PRO A 49 -13.435 -3.916 -10.298 1.00 71.21 C ATOM 766 CG PRO A 49 -13.710 -5.317 -10.767 1.00 43.11 C ATOM 767 CD PRO A 49 -12.614 -6.186 -10.160 1.00 43.02 C ATOM 0 HA PRO A 49 -12.184 -3.279 -8.567 1.00 45.23 H new ATOM 0 HB2 PRO A 49 -14.347 -3.320 -10.272 1.00 71.21 H new ATOM 0 HB3 PRO A 49 -12.738 -3.405 -10.962 1.00 71.21 H new ATOM 0 HG2 PRO A 49 -14.696 -5.650 -10.444 1.00 43.11 H new ATOM 0 HG3 PRO A 49 -13.695 -5.374 -11.855 1.00 43.11 H new ATOM 0 HD2 PRO A 49 -13.004 -7.151 -9.836 1.00 43.02 H new ATOM 0 HD3 PRO A 49 -11.820 -6.388 -10.879 1.00 43.02 H new ATOM 775 N ASP A 50 -14.305 -5.307 -7.288 1.00 63.14 N ATOM 776 CA ASP A 50 -15.404 -5.462 -6.302 1.00 73.12 C ATOM 777 C ASP A 50 -14.987 -4.956 -4.908 1.00 51.13 C ATOM 778 O ASP A 50 -15.790 -4.341 -4.205 1.00 51.22 O ATOM 779 CB ASP A 50 -15.864 -6.941 -6.236 1.00 61.35 C ATOM 780 CG ASP A 50 -17.123 -7.162 -5.373 1.00 13.13 C ATOM 781 OD1 ASP A 50 -18.247 -6.981 -5.896 1.00 10.14 O ATOM 782 OD2 ASP A 50 -17.001 -7.494 -4.174 1.00 44.43 O ATOM 0 H ASP A 50 -13.845 -6.183 -7.536 1.00 63.14 H new ATOM 0 HA ASP A 50 -16.243 -4.850 -6.635 1.00 73.12 H new ATOM 0 HB2 ASP A 50 -16.061 -7.296 -7.247 1.00 61.35 H new ATOM 0 HB3 ASP A 50 -15.051 -7.548 -5.838 1.00 61.35 H new ATOM 787 N TYR A 51 -13.709 -5.171 -4.547 1.00 51.44 N ATOM 788 CA TYR A 51 -13.156 -4.787 -3.217 1.00 11.42 C ATOM 789 C TYR A 51 -12.606 -3.333 -3.254 1.00 41.34 C ATOM 790 O TYR A 51 -11.981 -2.859 -2.300 1.00 52.34 O ATOM 791 CB TYR A 51 -12.048 -5.811 -2.793 1.00 11.01 C ATOM 792 CG TYR A 51 -11.802 -5.927 -1.272 1.00 34.43 C ATOM 793 CD1 TYR A 51 -12.875 -5.954 -0.373 1.00 23.24 C ATOM 794 CD2 TYR A 51 -10.514 -6.016 -0.737 1.00 71.13 C ATOM 795 CE1 TYR A 51 -12.669 -6.070 0.989 1.00 64.24 C ATOM 796 CE2 TYR A 51 -10.314 -6.135 0.627 1.00 41.51 C ATOM 797 CZ TYR A 51 -11.390 -6.155 1.484 1.00 60.10 C ATOM 798 OH TYR A 51 -11.188 -6.272 2.846 1.00 23.23 O ATOM 0 H TYR A 51 -13.025 -5.614 -5.160 1.00 51.44 H new ATOM 0 HA TYR A 51 -13.952 -4.815 -2.472 1.00 11.42 H new ATOM 0 HB2 TYR A 51 -12.320 -6.795 -3.176 1.00 11.01 H new ATOM 0 HB3 TYR A 51 -11.112 -5.529 -3.275 1.00 11.01 H new ATOM 0 HD1 TYR A 51 -13.884 -5.883 -0.751 1.00 23.24 H new ATOM 0 HD2 TYR A 51 -9.661 -5.992 -1.399 1.00 71.13 H new ATOM 0 HE1 TYR A 51 -13.512 -6.094 1.663 1.00 64.24 H new ATOM 0 HE2 TYR A 51 -9.311 -6.212 1.020 1.00 41.51 H new ATOM 0 HH TYR A 51 -11.332 -7.202 3.119 1.00 23.23 H new ATOM 808 N ARG A 52 -12.872 -2.642 -4.378 1.00 12.30 N ATOM 809 CA ARG A 52 -12.446 -1.259 -4.640 1.00 61.31 C ATOM 810 C ARG A 52 -13.439 -0.269 -4.002 1.00 21.14 C ATOM 811 O ARG A 52 -14.583 -0.166 -4.453 1.00 55.24 O ATOM 812 CB ARG A 52 -12.377 -1.063 -6.180 1.00 14.10 C ATOM 813 CG ARG A 52 -11.867 0.308 -6.664 1.00 31.51 C ATOM 814 CD ARG A 52 -11.879 0.435 -8.203 1.00 60.40 C ATOM 815 NE ARG A 52 -13.250 0.441 -8.738 1.00 74.55 N ATOM 816 CZ ARG A 52 -13.609 0.039 -9.969 1.00 50.12 C ATOM 817 NH1 ARG A 52 -12.707 -0.409 -10.848 1.00 71.34 N ATOM 818 NH2 ARG A 52 -14.883 0.084 -10.309 1.00 72.34 N ATOM 0 H ARG A 52 -13.405 -3.044 -5.150 1.00 12.30 H new ATOM 0 HA ARG A 52 -11.466 -1.070 -4.201 1.00 61.31 H new ATOM 0 HB2 ARG A 52 -11.731 -1.836 -6.596 1.00 14.10 H new ATOM 0 HB3 ARG A 52 -13.373 -1.224 -6.592 1.00 14.10 H new ATOM 0 HG2 ARG A 52 -12.486 1.095 -6.233 1.00 31.51 H new ATOM 0 HG3 ARG A 52 -10.852 0.464 -6.298 1.00 31.51 H new ATOM 0 HD2 ARG A 52 -11.370 1.353 -8.496 1.00 60.40 H new ATOM 0 HD3 ARG A 52 -11.321 -0.393 -8.641 1.00 60.40 H new ATOM 0 HE ARG A 52 -13.990 0.779 -8.123 1.00 74.55 H new ATOM 0 HH11 ARG A 52 -11.721 -0.451 -10.590 1.00 71.34 H new ATOM 0 HH12 ARG A 52 -13.005 -0.708 -11.776 1.00 71.34 H new ATOM 0 HH21 ARG A 52 -15.577 0.420 -9.642 1.00 72.34 H new ATOM 0 HH22 ARG A 52 -15.174 -0.217 -11.239 1.00 72.34 H new ATOM 832 N VAL A 53 -12.996 0.454 -2.964 1.00 44.11 N ATOM 833 CA VAL A 53 -13.840 1.407 -2.210 1.00 71.12 C ATOM 834 C VAL A 53 -13.257 2.825 -2.379 1.00 45.40 C ATOM 835 O VAL A 53 -12.036 2.996 -2.425 1.00 12.12 O ATOM 836 CB VAL A 53 -13.955 1.023 -0.677 1.00 43.31 C ATOM 837 CG1 VAL A 53 -14.536 -0.401 -0.496 1.00 10.54 C ATOM 838 CG2 VAL A 53 -12.605 1.172 0.070 1.00 11.34 C ATOM 0 H VAL A 53 -12.038 0.398 -2.618 1.00 44.11 H new ATOM 0 HA VAL A 53 -14.852 1.369 -2.613 1.00 71.12 H new ATOM 0 HB VAL A 53 -14.649 1.733 -0.227 1.00 43.31 H new ATOM 0 HG11 VAL A 53 -14.602 -0.635 0.567 1.00 10.54 H new ATOM 0 HG12 VAL A 53 -15.530 -0.448 -0.940 1.00 10.54 H new ATOM 0 HG13 VAL A 53 -13.885 -1.125 -0.987 1.00 10.54 H new ATOM 0 HG21 VAL A 53 -12.736 0.897 1.117 1.00 11.34 H new ATOM 0 HG22 VAL A 53 -11.862 0.518 -0.387 1.00 11.34 H new ATOM 0 HG23 VAL A 53 -12.266 2.206 0.006 1.00 11.34 H new ATOM 848 N GLU A 54 -14.132 3.824 -2.522 1.00 11.35 N ATOM 849 CA GLU A 54 -13.730 5.243 -2.640 1.00 3.43 C ATOM 850 C GLU A 54 -13.507 5.855 -1.237 1.00 11.31 C ATOM 851 O GLU A 54 -14.125 5.417 -0.258 1.00 11.10 O ATOM 852 CB GLU A 54 -14.807 6.035 -3.432 1.00 12.21 C ATOM 853 CG GLU A 54 -16.228 5.931 -2.844 1.00 71.11 C ATOM 854 CD GLU A 54 -17.265 6.800 -3.572 1.00 21.11 C ATOM 855 OE1 GLU A 54 -17.451 7.971 -3.177 1.00 73.22 O ATOM 856 OE2 GLU A 54 -17.902 6.314 -4.536 1.00 73.54 O ATOM 0 H GLU A 54 -15.141 3.680 -2.560 1.00 11.35 H new ATOM 0 HA GLU A 54 -12.789 5.305 -3.187 1.00 3.43 H new ATOM 0 HB2 GLU A 54 -14.517 7.085 -3.468 1.00 12.21 H new ATOM 0 HB3 GLU A 54 -14.824 5.674 -4.460 1.00 12.21 H new ATOM 0 HG2 GLU A 54 -16.551 4.890 -2.879 1.00 71.11 H new ATOM 0 HG3 GLU A 54 -16.199 6.220 -1.793 1.00 71.11 H new ATOM 863 N ALA A 55 -12.625 6.868 -1.161 1.00 44.32 N ATOM 864 CA ALA A 55 -12.253 7.531 0.105 1.00 1.05 C ATOM 865 C ALA A 55 -12.006 9.028 -0.121 1.00 42.31 C ATOM 866 O ALA A 55 -11.539 9.431 -1.193 1.00 40.21 O ATOM 867 CB ALA A 55 -11.001 6.871 0.712 1.00 41.03 C ATOM 0 H ALA A 55 -12.148 7.252 -1.977 1.00 44.32 H new ATOM 0 HA ALA A 55 -13.081 7.418 0.805 1.00 1.05 H new ATOM 0 HB1 ALA A 55 -10.741 7.372 1.644 1.00 41.03 H new ATOM 0 HB2 ALA A 55 -11.204 5.819 0.910 1.00 41.03 H new ATOM 0 HB3 ALA A 55 -10.170 6.954 0.012 1.00 41.03 H new ATOM 873 N THR A 56 -12.333 9.848 0.896 1.00 24.40 N ATOM 874 CA THR A 56 -12.042 11.289 0.897 1.00 23.23 C ATOM 875 C THR A 56 -10.692 11.538 1.602 1.00 34.14 C ATOM 876 O THR A 56 -10.453 11.045 2.710 1.00 53.50 O ATOM 877 CB THR A 56 -13.184 12.096 1.599 1.00 45.20 C ATOM 878 OG1 THR A 56 -14.444 11.796 0.966 1.00 13.51 O ATOM 879 CG2 THR A 56 -12.941 13.622 1.549 1.00 63.24 C ATOM 0 H THR A 56 -12.807 9.526 1.740 1.00 24.40 H new ATOM 0 HA THR A 56 -11.982 11.635 -0.135 1.00 23.23 H new ATOM 0 HB THR A 56 -13.199 11.796 2.647 1.00 45.20 H new ATOM 0 HG1 THR A 56 -15.160 12.300 1.407 1.00 13.51 H new ATOM 0 HG21 THR A 56 -13.761 14.138 2.049 1.00 63.24 H new ATOM 0 HG22 THR A 56 -12.003 13.858 2.052 1.00 63.24 H new ATOM 0 HG23 THR A 56 -12.887 13.948 0.510 1.00 63.24 H new ATOM 887 N VAL A 57 -9.816 12.278 0.924 1.00 1.33 N ATOM 888 CA VAL A 57 -8.505 12.682 1.432 1.00 1.24 C ATOM 889 C VAL A 57 -8.658 13.815 2.464 1.00 44.33 C ATOM 890 O VAL A 57 -9.331 14.818 2.211 1.00 42.13 O ATOM 891 CB VAL A 57 -7.571 13.171 0.264 1.00 52.13 C ATOM 892 CG1 VAL A 57 -6.133 13.451 0.757 1.00 74.02 C ATOM 893 CG2 VAL A 57 -7.573 12.165 -0.902 1.00 3.04 C ATOM 0 H VAL A 57 -10.003 12.622 -0.018 1.00 1.33 H new ATOM 0 HA VAL A 57 -8.051 11.812 1.906 1.00 1.24 H new ATOM 0 HB VAL A 57 -7.975 14.115 -0.103 1.00 52.13 H new ATOM 0 HG11 VAL A 57 -5.520 13.786 -0.080 1.00 74.02 H new ATOM 0 HG12 VAL A 57 -6.156 14.226 1.524 1.00 74.02 H new ATOM 0 HG13 VAL A 57 -5.708 12.539 1.175 1.00 74.02 H new ATOM 0 HG21 VAL A 57 -6.920 12.527 -1.696 1.00 3.04 H new ATOM 0 HG22 VAL A 57 -7.214 11.198 -0.549 1.00 3.04 H new ATOM 0 HG23 VAL A 57 -8.587 12.057 -1.287 1.00 3.04 H new ATOM 903 N THR A 58 -8.032 13.622 3.618 1.00 13.24 N ATOM 904 CA THR A 58 -7.963 14.608 4.694 1.00 44.15 C ATOM 905 C THR A 58 -6.486 14.976 4.882 1.00 30.40 C ATOM 906 O THR A 58 -5.730 14.187 5.439 1.00 12.23 O ATOM 907 CB THR A 58 -8.560 14.014 6.022 1.00 35.43 C ATOM 908 OG1 THR A 58 -9.896 13.537 5.784 1.00 60.02 O ATOM 909 CG2 THR A 58 -8.576 15.031 7.179 1.00 31.14 C ATOM 0 H THR A 58 -7.545 12.754 3.839 1.00 13.24 H new ATOM 0 HA THR A 58 -8.547 15.493 4.443 1.00 44.15 H new ATOM 0 HB THR A 58 -7.909 13.193 6.323 1.00 35.43 H new ATOM 0 HG1 THR A 58 -10.264 13.166 6.613 1.00 60.02 H new ATOM 0 HG21 THR A 58 -8.999 14.564 8.068 1.00 31.14 H new ATOM 0 HG22 THR A 58 -7.558 15.358 7.390 1.00 31.14 H new ATOM 0 HG23 THR A 58 -9.183 15.892 6.898 1.00 31.14 H new ATOM 917 N VAL A 59 -6.061 16.150 4.379 1.00 70.31 N ATOM 918 CA VAL A 59 -4.641 16.570 4.437 1.00 22.30 C ATOM 919 C VAL A 59 -4.426 17.441 5.686 1.00 13.04 C ATOM 920 O VAL A 59 -5.231 18.331 5.973 1.00 43.21 O ATOM 921 CB VAL A 59 -4.176 17.309 3.124 1.00 15.31 C ATOM 922 CG1 VAL A 59 -2.732 17.864 3.243 1.00 73.13 C ATOM 923 CG2 VAL A 59 -4.290 16.364 1.907 1.00 42.10 C ATOM 0 H VAL A 59 -6.677 16.826 3.928 1.00 70.31 H new ATOM 0 HA VAL A 59 -4.019 15.677 4.508 1.00 22.30 H new ATOM 0 HB VAL A 59 -4.839 18.162 2.980 1.00 15.31 H new ATOM 0 HG11 VAL A 59 -2.457 18.364 2.314 1.00 73.13 H new ATOM 0 HG12 VAL A 59 -2.683 18.576 4.067 1.00 73.13 H new ATOM 0 HG13 VAL A 59 -2.041 17.042 3.431 1.00 73.13 H new ATOM 0 HG21 VAL A 59 -3.966 16.888 1.008 1.00 42.10 H new ATOM 0 HG22 VAL A 59 -3.659 15.489 2.065 1.00 42.10 H new ATOM 0 HG23 VAL A 59 -5.326 16.047 1.788 1.00 42.10 H new ATOM 933 N HIS A 60 -3.349 17.142 6.433 1.00 51.35 N ATOM 934 CA HIS A 60 -3.086 17.717 7.763 1.00 15.31 C ATOM 935 C HIS A 60 -2.055 18.849 7.701 1.00 14.30 C ATOM 936 O HIS A 60 -1.002 18.709 7.066 1.00 4.35 O ATOM 937 CB HIS A 60 -2.608 16.589 8.708 1.00 41.30 C ATOM 938 CG HIS A 60 -3.623 15.490 8.808 1.00 62.11 C ATOM 939 ND1 HIS A 60 -4.715 15.365 9.591 1.00 2.03 N flip ATOM 940 CD2 HIS A 60 -3.640 14.405 7.961 1.00 13.43 C flip ATOM 941 CE1 HIS A 60 -5.371 14.237 9.196 1.00 50.13 C flip ATOM 942 NE2 HIS A 60 -4.706 13.680 8.216 1.00 40.31 N flip ATOM 0 H HIS A 60 -2.629 16.487 6.127 1.00 51.35 H new ATOM 0 HA HIS A 60 -4.008 18.154 8.145 1.00 15.31 H new ATOM 0 HB2 HIS A 60 -1.665 16.183 8.343 1.00 41.30 H new ATOM 0 HB3 HIS A 60 -2.416 17.000 9.699 1.00 41.30 H new ATOM 0 HD2 HIS A 60 -2.897 14.185 7.208 1.00 13.43 H new ATOM 0 HE1 HIS A 60 -6.290 13.864 9.623 1.00 50.13 H new ATOM 0 HE2 HIS A 60 -4.972 12.824 7.730 1.00 40.31 H new ATOM 951 N GLU A 61 -2.399 19.971 8.365 1.00 32.25 N ATOM 952 CA GLU A 61 -1.521 21.144 8.547 1.00 44.35 C ATOM 953 C GLU A 61 -0.217 20.760 9.278 1.00 24.52 C ATOM 954 O GLU A 61 0.836 21.343 9.025 1.00 61.05 O ATOM 955 CB GLU A 61 -2.281 22.247 9.338 1.00 12.31 C ATOM 956 CG GLU A 61 -2.865 21.773 10.687 1.00 15.33 C ATOM 957 CD GLU A 61 -3.561 22.892 11.481 1.00 45.52 C ATOM 958 OE1 GLU A 61 -4.778 23.108 11.286 1.00 65.22 O ATOM 959 OE2 GLU A 61 -2.896 23.557 12.303 1.00 23.32 O ATOM 0 H GLU A 61 -3.315 20.089 8.799 1.00 32.25 H new ATOM 0 HA GLU A 61 -1.248 21.527 7.564 1.00 44.35 H new ATOM 0 HB2 GLU A 61 -1.602 23.079 9.522 1.00 12.31 H new ATOM 0 HB3 GLU A 61 -3.092 22.629 8.718 1.00 12.31 H new ATOM 0 HG2 GLU A 61 -3.579 20.971 10.503 1.00 15.33 H new ATOM 0 HG3 GLU A 61 -2.063 21.353 11.294 1.00 15.33 H new ATOM 966 N THR A 62 -0.312 19.768 10.183 1.00 22.04 N ATOM 967 CA THR A 62 0.813 19.268 10.979 1.00 20.20 C ATOM 968 C THR A 62 1.156 17.813 10.562 1.00 20.21 C ATOM 969 O THR A 62 0.527 16.863 11.046 1.00 72.31 O ATOM 970 CB THR A 62 0.461 19.359 12.509 1.00 25.11 C ATOM 971 OG1 THR A 62 -0.818 18.743 12.753 1.00 62.51 O ATOM 972 CG2 THR A 62 0.425 20.820 13.013 1.00 61.20 C ATOM 0 H THR A 62 -1.189 19.287 10.381 1.00 22.04 H new ATOM 0 HA THR A 62 1.693 19.884 10.795 1.00 20.20 H new ATOM 0 HB THR A 62 1.246 18.834 13.054 1.00 25.11 H new ATOM 0 HG1 THR A 62 -0.858 17.878 12.293 1.00 62.51 H new ATOM 0 HG21 THR A 62 0.178 20.833 14.075 1.00 61.20 H new ATOM 0 HG22 THR A 62 1.401 21.281 12.862 1.00 61.20 H new ATOM 0 HG23 THR A 62 -0.329 21.378 12.458 1.00 61.20 H new ATOM 980 N PRO A 63 2.118 17.615 9.599 1.00 33.13 N ATOM 981 CA PRO A 63 2.598 16.264 9.234 1.00 0.50 C ATOM 982 C PRO A 63 3.574 15.701 10.296 1.00 65.42 C ATOM 983 O PRO A 63 4.607 16.318 10.595 1.00 22.22 O ATOM 984 CB PRO A 63 3.291 16.496 7.859 1.00 0.41 C ATOM 985 CG PRO A 63 3.759 17.924 7.892 1.00 15.14 C ATOM 986 CD PRO A 63 2.775 18.676 8.779 1.00 63.25 C ATOM 0 HA PRO A 63 1.801 15.522 9.181 1.00 0.50 H new ATOM 0 HB2 PRO A 63 4.127 15.810 7.718 1.00 0.41 H new ATOM 0 HB3 PRO A 63 2.598 16.327 7.035 1.00 0.41 H new ATOM 0 HG2 PRO A 63 4.772 17.992 8.290 1.00 15.14 H new ATOM 0 HG3 PRO A 63 3.781 18.349 6.889 1.00 15.14 H new ATOM 0 HD2 PRO A 63 3.286 19.404 9.409 1.00 63.25 H new ATOM 0 HD3 PRO A 63 2.045 19.226 8.184 1.00 63.25 H new ATOM 994 N GLU A 64 3.233 14.530 10.875 1.00 23.33 N ATOM 995 CA GLU A 64 4.055 13.884 11.922 1.00 70.12 C ATOM 996 C GLU A 64 5.047 12.881 11.295 1.00 61.53 C ATOM 997 O GLU A 64 4.817 12.355 10.193 1.00 64.02 O ATOM 998 CB GLU A 64 3.160 13.190 12.992 1.00 52.04 C ATOM 999 CG GLU A 64 2.219 12.095 12.447 1.00 22.20 C ATOM 1000 CD GLU A 64 1.575 11.238 13.549 1.00 35.40 C ATOM 1001 OE1 GLU A 64 0.572 11.673 14.158 1.00 3.12 O ATOM 1002 OE2 GLU A 64 2.084 10.127 13.830 1.00 2.13 O ATOM 0 H GLU A 64 2.389 14.010 10.634 1.00 23.33 H new ATOM 0 HA GLU A 64 4.630 14.661 12.426 1.00 70.12 H new ATOM 0 HB2 GLU A 64 3.805 12.748 13.752 1.00 52.04 H new ATOM 0 HB3 GLU A 64 2.558 13.951 13.489 1.00 52.04 H new ATOM 0 HG2 GLU A 64 1.432 12.564 11.856 1.00 22.20 H new ATOM 0 HG3 GLU A 64 2.780 11.446 11.774 1.00 22.20 H new ATOM 1009 N SER A 65 6.141 12.620 12.026 1.00 73.13 N ATOM 1010 CA SER A 65 7.232 11.746 11.588 1.00 15.40 C ATOM 1011 C SER A 65 6.920 10.288 11.994 1.00 51.34 C ATOM 1012 O SER A 65 6.859 9.959 13.182 1.00 74.44 O ATOM 1013 CB SER A 65 8.565 12.255 12.196 1.00 22.22 C ATOM 1014 OG SER A 65 8.505 12.344 13.613 1.00 64.34 O ATOM 0 H SER A 65 6.292 13.018 12.953 1.00 73.13 H new ATOM 0 HA SER A 65 7.331 11.767 10.503 1.00 15.40 H new ATOM 0 HB2 SER A 65 9.374 11.583 11.909 1.00 22.22 H new ATOM 0 HB3 SER A 65 8.802 13.235 11.781 1.00 22.22 H new ATOM 0 HG SER A 65 8.080 11.538 13.974 1.00 64.34 H new ATOM 1020 N VAL A 66 6.663 9.442 10.982 1.00 73.42 N ATOM 1021 CA VAL A 66 6.285 8.025 11.143 1.00 3.13 C ATOM 1022 C VAL A 66 7.312 7.156 10.393 1.00 22.01 C ATOM 1023 O VAL A 66 7.396 7.223 9.166 1.00 71.22 O ATOM 1024 CB VAL A 66 4.831 7.760 10.577 1.00 3.33 C ATOM 1025 CG1 VAL A 66 4.323 6.337 10.930 1.00 1.23 C ATOM 1026 CG2 VAL A 66 3.835 8.851 11.050 1.00 45.53 C ATOM 0 H VAL A 66 6.713 9.730 10.005 1.00 73.42 H new ATOM 0 HA VAL A 66 6.280 7.771 12.203 1.00 3.13 H new ATOM 0 HB VAL A 66 4.893 7.817 9.490 1.00 3.33 H new ATOM 0 HG11 VAL A 66 3.322 6.197 10.523 1.00 1.23 H new ATOM 0 HG12 VAL A 66 4.996 5.594 10.502 1.00 1.23 H new ATOM 0 HG13 VAL A 66 4.294 6.219 12.013 1.00 1.23 H new ATOM 0 HG21 VAL A 66 2.845 8.641 10.644 1.00 45.53 H new ATOM 0 HG22 VAL A 66 3.788 8.853 12.139 1.00 45.53 H new ATOM 0 HG23 VAL A 66 4.171 9.827 10.699 1.00 45.53 H new ATOM 1036 N ASP A 67 8.090 6.352 11.131 1.00 22.54 N ATOM 1037 CA ASP A 67 9.174 5.537 10.550 1.00 24.05 C ATOM 1038 C ASP A 67 8.591 4.272 9.915 1.00 24.31 C ATOM 1039 O ASP A 67 8.073 3.411 10.620 1.00 71.31 O ATOM 1040 CB ASP A 67 10.236 5.170 11.627 1.00 54.30 C ATOM 1041 CG ASP A 67 11.063 6.375 12.094 1.00 14.11 C ATOM 1042 OD1 ASP A 67 11.744 7.001 11.250 1.00 23.11 O ATOM 1043 OD2 ASP A 67 11.024 6.726 13.300 1.00 41.14 O ATOM 0 H ASP A 67 7.990 6.246 12.141 1.00 22.54 H new ATOM 0 HA ASP A 67 9.672 6.123 9.778 1.00 24.05 H new ATOM 0 HB2 ASP A 67 9.734 4.727 12.487 1.00 54.30 H new ATOM 0 HB3 ASP A 67 10.907 4.411 11.223 1.00 54.30 H new ATOM 1048 N LEU A 68 8.668 4.169 8.581 1.00 42.43 N ATOM 1049 CA LEU A 68 8.056 3.060 7.815 1.00 1.13 C ATOM 1050 C LEU A 68 9.095 2.371 6.921 1.00 30.31 C ATOM 1051 O LEU A 68 10.212 2.874 6.759 1.00 63.12 O ATOM 1052 CB LEU A 68 6.879 3.586 6.961 1.00 32.20 C ATOM 1053 CG LEU A 68 5.724 4.272 7.751 1.00 5.44 C ATOM 1054 CD1 LEU A 68 4.713 4.921 6.809 1.00 13.21 C ATOM 1055 CD2 LEU A 68 5.043 3.280 8.717 1.00 75.41 C ATOM 0 H LEU A 68 9.155 4.849 7.997 1.00 42.43 H new ATOM 0 HA LEU A 68 7.677 2.324 8.525 1.00 1.13 H new ATOM 0 HB2 LEU A 68 7.271 4.298 6.235 1.00 32.20 H new ATOM 0 HB3 LEU A 68 6.463 2.752 6.396 1.00 32.20 H new ATOM 0 HG LEU A 68 6.162 5.068 8.353 1.00 5.44 H new ATOM 0 HD11 LEU A 68 3.921 5.390 7.393 1.00 13.21 H new ATOM 0 HD12 LEU A 68 5.213 5.676 6.203 1.00 13.21 H new ATOM 0 HD13 LEU A 68 4.282 4.160 6.158 1.00 13.21 H new ATOM 0 HD21 LEU A 68 4.242 3.787 9.254 1.00 75.41 H new ATOM 0 HD22 LEU A 68 4.629 2.446 8.150 1.00 75.41 H new ATOM 0 HD23 LEU A 68 5.777 2.905 9.430 1.00 75.41 H new ATOM 1067 N GLU A 69 8.693 1.232 6.311 1.00 65.43 N ATOM 1068 CA GLU A 69 9.575 0.414 5.470 1.00 61.12 C ATOM 1069 C GLU A 69 9.672 1.053 4.075 1.00 3.34 C ATOM 1070 O GLU A 69 8.666 1.500 3.503 1.00 32.52 O ATOM 1071 CB GLU A 69 9.081 -1.078 5.399 1.00 3.20 C ATOM 1072 CG GLU A 69 7.718 -1.316 4.703 1.00 61.21 C ATOM 1073 CD GLU A 69 7.198 -2.778 4.761 1.00 50.43 C ATOM 1074 OE1 GLU A 69 7.930 -3.705 4.344 1.00 11.20 O ATOM 1075 OE2 GLU A 69 6.055 -3.003 5.232 1.00 43.42 O ATOM 0 H GLU A 69 7.747 0.861 6.393 1.00 65.43 H new ATOM 0 HA GLU A 69 10.570 0.385 5.913 1.00 61.12 H new ATOM 0 HB2 GLU A 69 9.838 -1.665 4.879 1.00 3.20 H new ATOM 0 HB3 GLU A 69 9.019 -1.467 6.415 1.00 3.20 H new ATOM 0 HG2 GLU A 69 6.975 -0.663 5.161 1.00 61.21 H new ATOM 0 HG3 GLU A 69 7.804 -1.018 3.658 1.00 61.21 H new ATOM 1082 N THR A 70 10.901 1.191 3.593 1.00 52.11 N ATOM 1083 CA THR A 70 11.194 1.651 2.238 1.00 13.01 C ATOM 1084 C THR A 70 11.702 0.466 1.393 1.00 43.43 C ATOM 1085 O THR A 70 11.872 -0.652 1.903 1.00 54.23 O ATOM 1086 CB THR A 70 12.228 2.836 2.283 1.00 5.51 C ATOM 1087 OG1 THR A 70 12.459 3.369 0.971 1.00 71.52 O ATOM 1088 CG2 THR A 70 13.571 2.432 2.924 1.00 1.40 C ATOM 0 H THR A 70 11.737 0.984 4.140 1.00 52.11 H new ATOM 0 HA THR A 70 10.288 2.032 1.767 1.00 13.01 H new ATOM 0 HB THR A 70 11.780 3.605 2.913 1.00 5.51 H new ATOM 0 HG1 THR A 70 13.104 4.105 1.026 1.00 71.52 H new ATOM 0 HG21 THR A 70 14.245 3.289 2.928 1.00 1.40 H new ATOM 0 HG22 THR A 70 13.400 2.100 3.948 1.00 1.40 H new ATOM 0 HG23 THR A 70 14.019 1.621 2.350 1.00 1.40 H new ATOM 1096 N SER A 71 11.968 0.723 0.108 1.00 75.33 N ATOM 1097 CA SER A 71 12.475 -0.283 -0.842 1.00 52.32 C ATOM 1098 C SER A 71 14.026 -0.267 -0.865 1.00 65.24 C ATOM 1099 O SER A 71 14.656 -0.760 -1.810 1.00 2.31 O ATOM 1100 CB SER A 71 11.879 0.004 -2.236 1.00 42.12 C ATOM 1101 OG SER A 71 10.456 -0.045 -2.208 1.00 35.35 O ATOM 0 H SER A 71 11.837 1.644 -0.310 1.00 75.33 H new ATOM 0 HA SER A 71 12.169 -1.282 -0.531 1.00 52.32 H new ATOM 0 HB2 SER A 71 12.205 0.986 -2.579 1.00 42.12 H new ATOM 0 HB3 SER A 71 12.257 -0.725 -2.953 1.00 42.12 H new ATOM 0 HG SER A 71 10.165 -0.943 -1.946 1.00 35.35 H new ATOM 1107 N ASP A 72 14.625 0.282 0.215 1.00 21.03 N ATOM 1108 CA ASP A 72 16.079 0.474 0.351 1.00 4.13 C ATOM 1109 C ASP A 72 16.580 -0.317 1.588 1.00 30.14 C ATOM 1110 O ASP A 72 17.381 0.172 2.383 1.00 73.42 O ATOM 1111 CB ASP A 72 16.389 2.001 0.442 1.00 72.40 C ATOM 1112 CG ASP A 72 17.886 2.344 0.279 1.00 30.44 C ATOM 1113 OD1 ASP A 72 18.398 2.274 -0.856 1.00 52.22 O ATOM 1114 OD2 ASP A 72 18.552 2.710 1.271 1.00 4.20 O ATOM 0 H ASP A 72 14.100 0.608 1.027 1.00 21.03 H new ATOM 0 HA ASP A 72 16.610 0.088 -0.519 1.00 4.13 H new ATOM 0 HB2 ASP A 72 15.820 2.524 -0.327 1.00 72.40 H new ATOM 0 HB3 ASP A 72 16.043 2.376 1.405 1.00 72.40 H new ATOM 1119 N ASP A 73 16.032 -1.550 1.742 1.00 12.14 N ATOM 1120 CA ASP A 73 16.432 -2.576 2.765 1.00 11.21 C ATOM 1121 C ASP A 73 16.401 -2.062 4.222 1.00 70.44 C ATOM 1122 O ASP A 73 17.046 -2.638 5.106 1.00 33.55 O ATOM 1123 CB ASP A 73 17.800 -3.273 2.409 1.00 23.11 C ATOM 1124 CG ASP A 73 19.071 -2.397 2.538 1.00 21.25 C ATOM 1125 OD1 ASP A 73 19.602 -2.241 3.662 1.00 32.44 O ATOM 1126 OD2 ASP A 73 19.560 -1.872 1.513 1.00 5.24 O ATOM 0 H ASP A 73 15.274 -1.877 1.143 1.00 12.14 H new ATOM 0 HA ASP A 73 15.656 -3.340 2.717 1.00 11.21 H new ATOM 0 HB2 ASP A 73 17.918 -4.144 3.054 1.00 23.11 H new ATOM 0 HB3 ASP A 73 17.740 -3.640 1.385 1.00 23.11 H new ATOM 1131 N ARG A 74 15.561 -1.048 4.490 1.00 41.22 N ATOM 1132 CA ARG A 74 15.677 -0.242 5.725 1.00 24.32 C ATOM 1133 C ARG A 74 14.349 0.437 6.115 1.00 63.44 C ATOM 1134 O ARG A 74 13.279 0.138 5.559 1.00 15.41 O ATOM 1135 CB ARG A 74 16.853 0.785 5.556 1.00 23.42 C ATOM 1136 CG ARG A 74 18.040 0.577 6.531 1.00 54.31 C ATOM 1137 CD ARG A 74 19.324 1.260 6.043 1.00 14.33 C ATOM 1138 NE ARG A 74 19.807 0.643 4.790 1.00 72.10 N ATOM 1139 CZ ARG A 74 20.411 1.288 3.779 1.00 44.34 C ATOM 1140 NH1 ARG A 74 20.627 2.601 3.828 1.00 71.10 N ATOM 1141 NH2 ARG A 74 20.779 0.611 2.706 1.00 71.45 N ATOM 0 H ARG A 74 14.798 -0.765 3.875 1.00 41.22 H new ATOM 0 HA ARG A 74 15.908 -0.906 6.558 1.00 24.32 H new ATOM 0 HB2 ARG A 74 17.226 0.725 4.533 1.00 23.42 H new ATOM 0 HB3 ARG A 74 16.460 1.792 5.693 1.00 23.42 H new ATOM 0 HG2 ARG A 74 17.774 0.969 7.512 1.00 54.31 H new ATOM 0 HG3 ARG A 74 18.223 -0.490 6.653 1.00 54.31 H new ATOM 0 HD2 ARG A 74 19.137 2.322 5.882 1.00 14.33 H new ATOM 0 HD3 ARG A 74 20.095 1.185 6.810 1.00 14.33 H new ATOM 0 HE ARG A 74 19.669 -0.362 4.684 1.00 72.10 H new ATOM 0 HH11 ARG A 74 20.332 3.136 4.645 1.00 71.10 H new ATOM 0 HH12 ARG A 74 21.088 3.071 3.049 1.00 71.10 H new ATOM 0 HH21 ARG A 74 20.604 -0.392 2.651 1.00 71.45 H new ATOM 0 HH22 ARG A 74 21.238 1.092 1.932 1.00 71.45 H new ATOM 1155 N THR A 75 14.474 1.373 7.075 1.00 63.42 N ATOM 1156 CA THR A 75 13.369 2.155 7.624 1.00 24.51 C ATOM 1157 C THR A 75 13.768 3.632 7.471 1.00 52.44 C ATOM 1158 O THR A 75 14.948 3.980 7.619 1.00 31.54 O ATOM 1159 CB THR A 75 13.090 1.832 9.135 1.00 33.05 C ATOM 1160 OG1 THR A 75 12.803 0.446 9.290 1.00 2.43 O ATOM 1161 CG2 THR A 75 11.918 2.641 9.709 1.00 33.11 C ATOM 0 H THR A 75 15.373 1.606 7.496 1.00 63.42 H new ATOM 0 HA THR A 75 12.450 1.914 7.090 1.00 24.51 H new ATOM 0 HB THR A 75 13.991 2.107 9.684 1.00 33.05 H new ATOM 0 HG1 THR A 75 12.555 0.064 8.422 1.00 2.43 H new ATOM 0 HG21 THR A 75 11.771 2.376 10.756 1.00 33.11 H new ATOM 0 HG22 THR A 75 12.138 3.706 9.631 1.00 33.11 H new ATOM 0 HG23 THR A 75 11.011 2.416 9.148 1.00 33.11 H new ATOM 1169 N VAL A 76 12.788 4.484 7.173 1.00 4.41 N ATOM 1170 CA VAL A 76 13.001 5.921 6.926 1.00 32.31 C ATOM 1171 C VAL A 76 11.816 6.718 7.465 1.00 13.20 C ATOM 1172 O VAL A 76 10.715 6.182 7.625 1.00 65.54 O ATOM 1173 CB VAL A 76 13.232 6.266 5.397 1.00 55.34 C ATOM 1174 CG1 VAL A 76 14.621 5.801 4.891 1.00 33.24 C ATOM 1175 CG2 VAL A 76 12.116 5.683 4.530 1.00 50.44 C ATOM 0 H VAL A 76 11.812 4.199 7.094 1.00 4.41 H new ATOM 0 HA VAL A 76 13.915 6.199 7.450 1.00 32.31 H new ATOM 0 HB VAL A 76 13.207 7.352 5.311 1.00 55.34 H new ATOM 0 HG11 VAL A 76 14.730 6.061 3.838 1.00 33.24 H new ATOM 0 HG12 VAL A 76 15.403 6.294 5.469 1.00 33.24 H new ATOM 0 HG13 VAL A 76 14.709 4.721 5.009 1.00 33.24 H new ATOM 0 HG21 VAL A 76 12.298 5.934 3.485 1.00 50.44 H new ATOM 0 HG22 VAL A 76 12.095 4.599 4.644 1.00 50.44 H new ATOM 0 HG23 VAL A 76 11.158 6.100 4.841 1.00 50.44 H new ATOM 1185 N ARG A 77 12.080 7.995 7.751 1.00 65.13 N ATOM 1186 CA ARG A 77 11.088 8.960 8.219 1.00 24.41 C ATOM 1187 C ARG A 77 10.104 9.255 7.072 1.00 3.42 C ATOM 1188 O ARG A 77 10.528 9.663 5.988 1.00 52.41 O ATOM 1189 CB ARG A 77 11.835 10.255 8.701 1.00 64.33 C ATOM 1190 CG ARG A 77 11.000 11.346 9.438 1.00 0.33 C ATOM 1191 CD ARG A 77 10.077 12.176 8.520 1.00 42.44 C ATOM 1192 NE ARG A 77 10.781 12.685 7.327 1.00 13.05 N ATOM 1193 CZ ARG A 77 11.289 13.925 7.190 1.00 14.14 C ATOM 1194 NH1 ARG A 77 11.179 14.829 8.155 1.00 35.21 N ATOM 1195 NH2 ARG A 77 11.947 14.244 6.092 1.00 24.55 N ATOM 0 H ARG A 77 13.014 8.395 7.661 1.00 65.13 H new ATOM 0 HA ARG A 77 10.517 8.566 9.060 1.00 24.41 H new ATOM 0 HB2 ARG A 77 12.644 9.948 9.364 1.00 64.33 H new ATOM 0 HB3 ARG A 77 12.297 10.719 7.829 1.00 64.33 H new ATOM 0 HG2 ARG A 77 10.392 10.864 10.204 1.00 0.33 H new ATOM 0 HG3 ARG A 77 11.683 12.022 9.952 1.00 0.33 H new ATOM 0 HD2 ARG A 77 9.233 11.561 8.206 1.00 42.44 H new ATOM 0 HD3 ARG A 77 9.668 13.015 9.083 1.00 42.44 H new ATOM 0 HE ARG A 77 10.892 12.045 6.541 1.00 13.05 H new ATOM 0 HH11 ARG A 77 10.701 14.591 9.024 1.00 35.21 H new ATOM 0 HH12 ARG A 77 11.572 15.762 8.027 1.00 35.21 H new ATOM 0 HH21 ARG A 77 12.069 13.553 5.352 1.00 24.55 H new ATOM 0 HH22 ARG A 77 12.334 15.182 5.983 1.00 24.55 H new ATOM 1209 N TYR A 78 8.817 9.001 7.315 1.00 40.12 N ATOM 1210 CA TYR A 78 7.708 9.449 6.454 1.00 14.04 C ATOM 1211 C TYR A 78 6.973 10.609 7.144 1.00 0.44 C ATOM 1212 O TYR A 78 6.937 10.687 8.369 1.00 30.05 O ATOM 1213 CB TYR A 78 6.720 8.279 6.172 1.00 12.30 C ATOM 1214 CG TYR A 78 7.196 7.233 5.143 1.00 31.44 C ATOM 1215 CD1 TYR A 78 8.332 6.456 5.358 1.00 4.54 C ATOM 1216 CD2 TYR A 78 6.485 7.019 3.959 1.00 74.02 C ATOM 1217 CE1 TYR A 78 8.734 5.512 4.435 1.00 61.51 C ATOM 1218 CE2 TYR A 78 6.887 6.076 3.037 1.00 74.12 C ATOM 1219 CZ TYR A 78 8.012 5.324 3.279 1.00 21.13 C ATOM 1220 OH TYR A 78 8.418 4.379 2.359 1.00 41.25 O ATOM 0 H TYR A 78 8.505 8.470 8.128 1.00 40.12 H new ATOM 0 HA TYR A 78 8.112 9.786 5.499 1.00 14.04 H new ATOM 0 HB2 TYR A 78 6.513 7.768 7.112 1.00 12.30 H new ATOM 0 HB3 TYR A 78 5.777 8.700 5.824 1.00 12.30 H new ATOM 0 HD1 TYR A 78 8.907 6.595 6.261 1.00 4.54 H new ATOM 0 HD2 TYR A 78 5.600 7.606 3.762 1.00 74.02 H new ATOM 0 HE1 TYR A 78 9.618 4.919 4.621 1.00 61.51 H new ATOM 0 HE2 TYR A 78 6.321 5.929 2.129 1.00 74.12 H new ATOM 0 HH TYR A 78 8.473 3.502 2.793 1.00 41.25 H new ATOM 1230 N LEU A 79 6.420 11.522 6.348 1.00 71.33 N ATOM 1231 CA LEU A 79 5.577 12.619 6.842 1.00 72.01 C ATOM 1232 C LEU A 79 4.111 12.265 6.604 1.00 4.35 C ATOM 1233 O LEU A 79 3.745 11.845 5.491 1.00 32.32 O ATOM 1234 CB LEU A 79 5.950 13.956 6.144 1.00 72.33 C ATOM 1235 CG LEU A 79 7.355 14.536 6.496 1.00 22.50 C ATOM 1236 CD1 LEU A 79 7.661 15.800 5.671 1.00 45.05 C ATOM 1237 CD2 LEU A 79 7.481 14.810 8.016 1.00 43.43 C ATOM 0 H LEU A 79 6.542 11.525 5.335 1.00 71.33 H new ATOM 0 HA LEU A 79 5.743 12.753 7.911 1.00 72.01 H new ATOM 0 HB2 LEU A 79 5.899 13.808 5.065 1.00 72.33 H new ATOM 0 HB3 LEU A 79 5.196 14.700 6.400 1.00 72.33 H new ATOM 0 HG LEU A 79 8.100 13.785 6.232 1.00 22.50 H new ATOM 0 HD11 LEU A 79 8.647 16.180 5.939 1.00 45.05 H new ATOM 0 HD12 LEU A 79 7.644 15.554 4.609 1.00 45.05 H new ATOM 0 HD13 LEU A 79 6.910 16.561 5.880 1.00 45.05 H new ATOM 0 HD21 LEU A 79 8.470 15.214 8.232 1.00 43.43 H new ATOM 0 HD22 LEU A 79 6.721 15.530 8.320 1.00 43.43 H new ATOM 0 HD23 LEU A 79 7.341 13.880 8.566 1.00 43.43 H new ATOM 1249 N HIS A 80 3.282 12.417 7.656 1.00 45.41 N ATOM 1250 CA HIS A 80 1.851 12.146 7.571 1.00 53.33 C ATOM 1251 C HIS A 80 1.164 13.318 6.868 1.00 14.22 C ATOM 1252 O HIS A 80 0.847 14.336 7.483 1.00 73.42 O ATOM 1253 CB HIS A 80 1.263 11.912 8.989 1.00 74.30 C ATOM 1254 CG HIS A 80 -0.220 11.644 9.000 1.00 61.03 C ATOM 1255 ND1 HIS A 80 -1.063 12.263 9.890 1.00 30.02 N ATOM 1256 CD2 HIS A 80 -0.946 10.825 8.206 1.00 4.02 C ATOM 1257 CE1 HIS A 80 -2.266 11.809 9.610 1.00 50.42 C ATOM 1258 NE2 HIS A 80 -2.244 10.939 8.602 1.00 30.40 N ATOM 0 H HIS A 80 3.591 12.729 8.577 1.00 45.41 H new ATOM 0 HA HIS A 80 1.678 11.239 6.992 1.00 53.33 H new ATOM 0 HB2 HIS A 80 1.778 11.069 9.450 1.00 74.30 H new ATOM 0 HB3 HIS A 80 1.468 12.787 9.606 1.00 74.30 H new ATOM 0 HD2 HIS A 80 -0.569 10.200 7.410 1.00 4.02 H new ATOM 0 HE1 HIS A 80 -3.162 12.106 10.134 1.00 50.42 H new ATOM 0 HE2 HIS A 80 -3.046 10.451 8.203 1.00 30.40 H new ATOM 1266 N VAL A 81 0.931 13.151 5.569 1.00 45.34 N ATOM 1267 CA VAL A 81 0.335 14.201 4.737 1.00 65.34 C ATOM 1268 C VAL A 81 -1.190 14.086 4.736 1.00 73.52 C ATOM 1269 O VAL A 81 -1.879 15.099 4.786 1.00 64.23 O ATOM 1270 CB VAL A 81 0.916 14.177 3.274 1.00 52.10 C ATOM 1271 CG1 VAL A 81 2.442 14.449 3.304 1.00 1.35 C ATOM 1272 CG2 VAL A 81 0.585 12.853 2.532 1.00 24.02 C ATOM 0 H VAL A 81 1.147 12.292 5.063 1.00 45.34 H new ATOM 0 HA VAL A 81 0.600 15.165 5.170 1.00 65.34 H new ATOM 0 HB VAL A 81 0.432 14.973 2.708 1.00 52.10 H new ATOM 0 HG11 VAL A 81 2.835 14.430 2.287 1.00 1.35 H new ATOM 0 HG12 VAL A 81 2.629 15.427 3.747 1.00 1.35 H new ATOM 0 HG13 VAL A 81 2.937 13.681 3.898 1.00 1.35 H new ATOM 0 HG21 VAL A 81 1.007 12.884 1.527 1.00 24.02 H new ATOM 0 HG22 VAL A 81 1.012 12.013 3.079 1.00 24.02 H new ATOM 0 HG23 VAL A 81 -0.496 12.732 2.468 1.00 24.02 H new ATOM 1282 N ALA A 82 -1.715 12.849 4.753 1.00 72.41 N ATOM 1283 CA ALA A 82 -3.156 12.612 4.549 1.00 13.51 C ATOM 1284 C ALA A 82 -3.670 11.404 5.333 1.00 45.11 C ATOM 1285 O ALA A 82 -2.899 10.583 5.811 1.00 11.33 O ATOM 1286 CB ALA A 82 -3.455 12.447 3.047 1.00 11.01 C ATOM 0 H ALA A 82 -1.168 12.002 4.905 1.00 72.41 H new ATOM 0 HA ALA A 82 -3.685 13.484 4.933 1.00 13.51 H new ATOM 0 HB1 ALA A 82 -4.522 12.272 2.905 1.00 11.01 H new ATOM 0 HB2 ALA A 82 -3.162 13.353 2.516 1.00 11.01 H new ATOM 0 HB3 ALA A 82 -2.893 11.599 2.655 1.00 11.01 H new ATOM 1292 N THR A 83 -5.002 11.352 5.465 1.00 3.15 N ATOM 1293 CA THR A 83 -5.751 10.193 5.963 1.00 41.11 C ATOM 1294 C THR A 83 -6.943 9.985 5.022 1.00 4.15 C ATOM 1295 O THR A 83 -7.672 10.931 4.704 1.00 10.15 O ATOM 1296 CB THR A 83 -6.255 10.380 7.435 1.00 1.21 C ATOM 1297 OG1 THR A 83 -5.138 10.659 8.290 1.00 13.01 O ATOM 1298 CG2 THR A 83 -7.001 9.139 7.967 1.00 14.34 C ATOM 0 H THR A 83 -5.604 12.138 5.221 1.00 3.15 H new ATOM 0 HA THR A 83 -5.091 9.326 5.979 1.00 41.11 H new ATOM 0 HB THR A 83 -6.959 11.212 7.433 1.00 1.21 H new ATOM 0 HG1 THR A 83 -4.790 9.820 8.658 1.00 13.01 H new ATOM 0 HG21 THR A 83 -7.328 9.322 8.990 1.00 14.34 H new ATOM 0 HG22 THR A 83 -7.869 8.939 7.339 1.00 14.34 H new ATOM 0 HG23 THR A 83 -6.333 8.278 7.948 1.00 14.34 H new ATOM 1306 N LEU A 84 -7.126 8.750 4.581 1.00 71.45 N ATOM 1307 CA LEU A 84 -8.106 8.384 3.562 1.00 45.22 C ATOM 1308 C LEU A 84 -9.313 7.776 4.297 1.00 50.03 C ATOM 1309 O LEU A 84 -9.236 6.658 4.808 1.00 62.50 O ATOM 1310 CB LEU A 84 -7.454 7.399 2.540 1.00 22.14 C ATOM 1311 CG LEU A 84 -6.011 7.786 2.033 1.00 21.15 C ATOM 1312 CD1 LEU A 84 -5.470 6.766 1.013 1.00 53.41 C ATOM 1313 CD2 LEU A 84 -5.946 9.232 1.479 1.00 4.14 C ATOM 0 H LEU A 84 -6.588 7.955 4.927 1.00 71.45 H new ATOM 0 HA LEU A 84 -8.443 9.244 2.984 1.00 45.22 H new ATOM 0 HB2 LEU A 84 -7.404 6.411 2.998 1.00 22.14 H new ATOM 0 HB3 LEU A 84 -8.112 7.316 1.675 1.00 22.14 H new ATOM 0 HG LEU A 84 -5.359 7.754 2.906 1.00 21.15 H new ATOM 0 HD11 LEU A 84 -4.474 7.069 0.689 1.00 53.41 H new ATOM 0 HD12 LEU A 84 -5.417 5.781 1.477 1.00 53.41 H new ATOM 0 HD13 LEU A 84 -6.136 6.725 0.151 1.00 53.41 H new ATOM 0 HD21 LEU A 84 -4.932 9.448 1.144 1.00 4.14 H new ATOM 0 HD22 LEU A 84 -6.635 9.331 0.640 1.00 4.14 H new ATOM 0 HD23 LEU A 84 -6.226 9.935 2.263 1.00 4.14 H new ATOM 1325 N SER A 85 -10.379 8.575 4.418 1.00 61.43 N ATOM 1326 CA SER A 85 -11.585 8.233 5.188 1.00 63.21 C ATOM 1327 C SER A 85 -12.599 7.483 4.302 1.00 11.41 C ATOM 1328 O SER A 85 -12.997 7.997 3.252 1.00 73.55 O ATOM 1329 CB SER A 85 -12.189 9.540 5.763 1.00 33.14 C ATOM 1330 OG SER A 85 -12.348 10.539 4.761 1.00 2.42 O ATOM 0 H SER A 85 -10.431 9.493 3.977 1.00 61.43 H new ATOM 0 HA SER A 85 -11.327 7.567 6.011 1.00 63.21 H new ATOM 0 HB2 SER A 85 -13.156 9.324 6.216 1.00 33.14 H new ATOM 0 HB3 SER A 85 -11.544 9.920 6.555 1.00 33.14 H new ATOM 0 HG SER A 85 -12.546 10.112 3.902 1.00 2.42 H new ATOM 1336 N PHE A 86 -13.016 6.277 4.739 1.00 51.53 N ATOM 1337 CA PHE A 86 -13.924 5.400 3.969 1.00 51.44 C ATOM 1338 C PHE A 86 -14.666 4.427 4.907 1.00 53.12 C ATOM 1339 O PHE A 86 -14.624 4.570 6.133 1.00 35.21 O ATOM 1340 CB PHE A 86 -13.148 4.640 2.838 1.00 4.41 C ATOM 1341 CG PHE A 86 -11.998 3.729 3.295 1.00 30.25 C ATOM 1342 CD1 PHE A 86 -10.706 4.235 3.467 1.00 10.42 C ATOM 1343 CD2 PHE A 86 -12.203 2.366 3.542 1.00 52.30 C ATOM 1344 CE1 PHE A 86 -9.667 3.417 3.871 1.00 5.24 C ATOM 1345 CE2 PHE A 86 -11.160 1.553 3.947 1.00 11.13 C ATOM 1346 CZ PHE A 86 -9.896 2.079 4.111 1.00 12.51 C ATOM 0 H PHE A 86 -12.733 5.883 5.636 1.00 51.53 H new ATOM 0 HA PHE A 86 -14.673 6.024 3.482 1.00 51.44 H new ATOM 0 HB2 PHE A 86 -13.863 4.035 2.280 1.00 4.41 H new ATOM 0 HB3 PHE A 86 -12.745 5.378 2.144 1.00 4.41 H new ATOM 0 HD1 PHE A 86 -10.516 5.282 3.281 1.00 10.42 H new ATOM 0 HD2 PHE A 86 -13.189 1.944 3.415 1.00 52.30 H new ATOM 0 HE1 PHE A 86 -8.676 3.826 3.999 1.00 5.24 H new ATOM 0 HE2 PHE A 86 -11.336 0.504 4.135 1.00 11.13 H new ATOM 0 HZ PHE A 86 -9.084 1.442 4.428 1.00 12.51 H new ATOM 1356 N ASP A 87 -15.398 3.481 4.302 1.00 20.20 N ATOM 1357 CA ASP A 87 -16.106 2.399 5.006 1.00 11.40 C ATOM 1358 C ASP A 87 -15.714 1.063 4.364 1.00 70.10 C ATOM 1359 O ASP A 87 -15.544 0.981 3.136 1.00 74.42 O ATOM 1360 CB ASP A 87 -17.644 2.603 4.937 1.00 64.14 C ATOM 1361 CG ASP A 87 -18.097 3.942 5.547 1.00 43.43 C ATOM 1362 OD1 ASP A 87 -18.146 4.961 4.811 1.00 44.51 O ATOM 1363 OD2 ASP A 87 -18.389 3.994 6.762 1.00 63.40 O ATOM 0 H ASP A 87 -15.518 3.445 3.290 1.00 20.20 H new ATOM 0 HA ASP A 87 -15.822 2.405 6.058 1.00 11.40 H new ATOM 0 HB2 ASP A 87 -17.966 2.556 3.897 1.00 64.14 H new ATOM 0 HB3 ASP A 87 -18.138 1.785 5.461 1.00 64.14 H new ATOM 1368 N LEU A 88 -15.568 0.024 5.195 1.00 62.32 N ATOM 1369 CA LEU A 88 -15.144 -1.316 4.756 1.00 30.21 C ATOM 1370 C LEU A 88 -15.688 -2.391 5.728 1.00 42.55 C ATOM 1371 O LEU A 88 -15.708 -2.171 6.950 1.00 32.21 O ATOM 1372 CB LEU A 88 -13.590 -1.386 4.689 1.00 31.54 C ATOM 1373 CG LEU A 88 -12.993 -2.662 4.010 1.00 51.43 C ATOM 1374 CD1 LEU A 88 -13.366 -2.721 2.513 1.00 64.23 C ATOM 1375 CD2 LEU A 88 -11.468 -2.751 4.226 1.00 75.51 C ATOM 0 H LEU A 88 -15.741 0.087 6.198 1.00 62.32 H new ATOM 0 HA LEU A 88 -15.548 -1.508 3.762 1.00 30.21 H new ATOM 0 HB2 LEU A 88 -13.229 -0.509 4.151 1.00 31.54 H new ATOM 0 HB3 LEU A 88 -13.198 -1.321 5.704 1.00 31.54 H new ATOM 0 HG LEU A 88 -13.436 -3.535 4.489 1.00 51.43 H new ATOM 0 HD11 LEU A 88 -12.938 -3.618 2.066 1.00 64.23 H new ATOM 0 HD12 LEU A 88 -14.451 -2.746 2.409 1.00 64.23 H new ATOM 0 HD13 LEU A 88 -12.973 -1.840 2.005 1.00 64.23 H new ATOM 0 HD21 LEU A 88 -11.084 -3.649 3.742 1.00 75.51 H new ATOM 0 HD22 LEU A 88 -10.988 -1.873 3.795 1.00 75.51 H new ATOM 0 HD23 LEU A 88 -11.254 -2.795 5.294 1.00 75.51 H new ATOM 1387 N ASP A 89 -16.120 -3.538 5.150 1.00 25.32 N ATOM 1388 CA ASP A 89 -16.603 -4.744 5.874 1.00 62.11 C ATOM 1389 C ASP A 89 -17.984 -4.502 6.527 1.00 75.21 C ATOM 1390 O ASP A 89 -19.013 -4.965 6.019 1.00 20.13 O ATOM 1391 CB ASP A 89 -15.559 -5.258 6.907 1.00 61.41 C ATOM 1392 CG ASP A 89 -15.969 -6.591 7.563 1.00 34.24 C ATOM 1393 OD1 ASP A 89 -16.011 -7.612 6.855 1.00 23.30 O ATOM 1394 OD2 ASP A 89 -16.229 -6.628 8.780 1.00 71.51 O ATOM 0 H ASP A 89 -16.144 -3.655 4.137 1.00 25.32 H new ATOM 0 HA ASP A 89 -16.730 -5.532 5.132 1.00 62.11 H new ATOM 0 HB2 ASP A 89 -14.597 -5.384 6.411 1.00 61.41 H new ATOM 0 HB3 ASP A 89 -15.422 -4.505 7.683 1.00 61.41 H new ATOM 1399 N GLY A 90 -17.983 -3.755 7.638 1.00 21.31 N ATOM 1400 CA GLY A 90 -19.214 -3.342 8.331 1.00 25.01 C ATOM 1401 C GLY A 90 -19.001 -2.098 9.198 1.00 31.44 C ATOM 1402 O GLY A 90 -19.931 -1.633 9.867 1.00 45.34 O ATOM 0 H GLY A 90 -17.129 -3.419 8.084 1.00 21.31 H new ATOM 0 HA2 GLY A 90 -19.993 -3.141 7.595 1.00 25.01 H new ATOM 0 HA3 GLY A 90 -19.569 -4.161 8.956 1.00 25.01 H new ATOM 1406 N GLU A 91 -17.763 -1.560 9.172 1.00 11.32 N ATOM 1407 CA GLU A 91 -17.315 -0.432 10.012 1.00 22.23 C ATOM 1408 C GLU A 91 -16.757 0.693 9.123 1.00 54.54 C ATOM 1409 O GLU A 91 -16.512 0.492 7.930 1.00 53.51 O ATOM 1410 CB GLU A 91 -16.210 -0.939 10.988 1.00 10.21 C ATOM 1411 CG GLU A 91 -14.972 -1.529 10.264 1.00 11.20 C ATOM 1412 CD GLU A 91 -13.837 -1.999 11.187 1.00 75.44 C ATOM 1413 OE1 GLU A 91 -13.540 -1.305 12.181 1.00 2.00 O ATOM 1414 OE2 GLU A 91 -13.186 -3.021 10.881 1.00 21.55 O ATOM 0 H GLU A 91 -17.031 -1.907 8.552 1.00 11.32 H new ATOM 0 HA GLU A 91 -18.157 -0.039 10.583 1.00 22.23 H new ATOM 0 HB2 GLU A 91 -15.890 -0.113 11.624 1.00 10.21 H new ATOM 0 HB3 GLU A 91 -16.635 -1.699 11.643 1.00 10.21 H new ATOM 0 HG2 GLU A 91 -15.295 -2.372 9.654 1.00 11.20 H new ATOM 0 HG3 GLU A 91 -14.576 -0.776 9.583 1.00 11.20 H new ATOM 1421 N SER A 92 -16.577 1.882 9.706 1.00 73.44 N ATOM 1422 CA SER A 92 -15.856 2.978 9.052 1.00 54.02 C ATOM 1423 C SER A 92 -14.345 2.765 9.270 1.00 73.31 C ATOM 1424 O SER A 92 -13.904 2.573 10.413 1.00 33.12 O ATOM 1425 CB SER A 92 -16.325 4.341 9.610 1.00 2.04 C ATOM 1426 OG SER A 92 -15.715 5.425 8.926 1.00 24.42 O ATOM 0 H SER A 92 -16.924 2.111 10.637 1.00 73.44 H new ATOM 0 HA SER A 92 -16.065 2.983 7.982 1.00 54.02 H new ATOM 0 HB2 SER A 92 -17.409 4.418 9.521 1.00 2.04 H new ATOM 0 HB3 SER A 92 -16.088 4.401 10.672 1.00 2.04 H new ATOM 0 HG SER A 92 -15.370 5.115 8.063 1.00 24.42 H new ATOM 1432 N ARG A 93 -13.568 2.760 8.169 1.00 71.41 N ATOM 1433 CA ARG A 93 -12.111 2.522 8.198 1.00 1.13 C ATOM 1434 C ARG A 93 -11.351 3.714 7.621 1.00 4.51 C ATOM 1435 O ARG A 93 -11.791 4.341 6.656 1.00 52.44 O ATOM 1436 CB ARG A 93 -11.740 1.229 7.413 1.00 54.32 C ATOM 1437 CG ARG A 93 -12.110 -0.106 8.103 1.00 34.10 C ATOM 1438 CD ARG A 93 -11.301 -0.361 9.400 1.00 25.53 C ATOM 1439 NE ARG A 93 -11.734 0.486 10.522 1.00 42.51 N ATOM 1440 CZ ARG A 93 -10.926 1.200 11.332 1.00 13.33 C ATOM 1441 NH1 ARG A 93 -9.605 1.194 11.176 1.00 5.10 N ATOM 1442 NH2 ARG A 93 -11.458 1.938 12.274 1.00 50.13 N ATOM 0 H ARG A 93 -13.935 2.922 7.231 1.00 71.41 H new ATOM 0 HA ARG A 93 -11.821 2.393 9.241 1.00 1.13 H new ATOM 0 HB2 ARG A 93 -12.232 1.263 6.441 1.00 54.32 H new ATOM 0 HB3 ARG A 93 -10.666 1.235 7.227 1.00 54.32 H new ATOM 0 HG2 ARG A 93 -13.174 -0.104 8.339 1.00 34.10 H new ATOM 0 HG3 ARG A 93 -11.940 -0.928 7.407 1.00 34.10 H new ATOM 0 HD2 ARG A 93 -11.400 -1.409 9.683 1.00 25.53 H new ATOM 0 HD3 ARG A 93 -10.244 -0.182 9.204 1.00 25.53 H new ATOM 0 HE ARG A 93 -12.736 0.538 10.704 1.00 42.51 H new ATOM 0 HH11 ARG A 93 -9.182 0.641 10.431 1.00 5.10 H new ATOM 0 HH12 ARG A 93 -9.015 1.743 11.802 1.00 5.10 H new ATOM 0 HH21 ARG A 93 -12.471 1.967 12.388 1.00 50.13 H new ATOM 0 HH22 ARG A 93 -10.859 2.483 12.894 1.00 50.13 H new ATOM 1456 N ASP A 94 -10.204 4.007 8.232 1.00 71.20 N ATOM 1457 CA ASP A 94 -9.284 5.058 7.787 1.00 52.22 C ATOM 1458 C ASP A 94 -7.867 4.474 7.630 1.00 23.35 C ATOM 1459 O ASP A 94 -7.385 3.732 8.497 1.00 61.43 O ATOM 1460 CB ASP A 94 -9.309 6.248 8.795 1.00 12.44 C ATOM 1461 CG ASP A 94 -8.824 5.886 10.217 1.00 24.10 C ATOM 1462 OD1 ASP A 94 -9.566 5.195 10.957 1.00 71.41 O ATOM 1463 OD2 ASP A 94 -7.716 6.315 10.614 1.00 71.24 O ATOM 0 H ASP A 94 -9.881 3.514 9.064 1.00 71.20 H new ATOM 0 HA ASP A 94 -9.600 5.439 6.816 1.00 52.22 H new ATOM 0 HB2 ASP A 94 -8.686 7.053 8.405 1.00 12.44 H new ATOM 0 HB3 ASP A 94 -10.326 6.635 8.858 1.00 12.44 H new ATOM 1468 N LEU A 95 -7.231 4.772 6.482 1.00 71.51 N ATOM 1469 CA LEU A 95 -5.825 4.423 6.207 1.00 1.22 C ATOM 1470 C LEU A 95 -5.049 5.708 5.965 1.00 51.22 C ATOM 1471 O LEU A 95 -5.428 6.512 5.117 1.00 42.00 O ATOM 1472 CB LEU A 95 -5.688 3.477 4.977 1.00 14.05 C ATOM 1473 CG LEU A 95 -6.309 2.056 5.124 1.00 41.14 C ATOM 1474 CD1 LEU A 95 -6.004 1.189 3.886 1.00 73.13 C ATOM 1475 CD2 LEU A 95 -5.850 1.371 6.425 1.00 23.50 C ATOM 0 H LEU A 95 -7.683 5.266 5.712 1.00 71.51 H new ATOM 0 HA LEU A 95 -5.424 3.887 7.067 1.00 1.22 H new ATOM 0 HB2 LEU A 95 -6.149 3.964 4.118 1.00 14.05 H new ATOM 0 HB3 LEU A 95 -4.628 3.365 4.749 1.00 14.05 H new ATOM 0 HG LEU A 95 -7.391 2.171 5.188 1.00 41.14 H new ATOM 0 HD11 LEU A 95 -6.449 0.202 4.014 1.00 73.13 H new ATOM 0 HD12 LEU A 95 -6.422 1.663 2.998 1.00 73.13 H new ATOM 0 HD13 LEU A 95 -4.925 1.088 3.769 1.00 73.13 H new ATOM 0 HD21 LEU A 95 -6.303 0.382 6.495 1.00 23.50 H new ATOM 0 HD22 LEU A 95 -4.764 1.274 6.422 1.00 23.50 H new ATOM 0 HD23 LEU A 95 -6.158 1.972 7.281 1.00 23.50 H new ATOM 1487 N HIS A 96 -3.948 5.885 6.688 1.00 64.44 N ATOM 1488 CA HIS A 96 -3.171 7.125 6.656 1.00 13.14 C ATOM 1489 C HIS A 96 -2.143 7.043 5.518 1.00 4.33 C ATOM 1490 O HIS A 96 -1.431 6.043 5.385 1.00 0.14 O ATOM 1491 CB HIS A 96 -2.481 7.348 8.023 1.00 30.33 C ATOM 1492 CG HIS A 96 -3.432 7.493 9.186 1.00 12.34 C ATOM 1493 ND1 HIS A 96 -3.567 8.681 9.856 1.00 2.43 N ATOM 1494 CD2 HIS A 96 -4.262 6.580 9.754 1.00 51.41 C ATOM 1495 CE1 HIS A 96 -4.462 8.473 10.796 1.00 4.14 C ATOM 1496 NE2 HIS A 96 -4.915 7.218 10.774 1.00 74.05 N ATOM 0 H HIS A 96 -3.567 5.175 7.313 1.00 64.44 H new ATOM 0 HA HIS A 96 -3.828 7.975 6.471 1.00 13.14 H new ATOM 0 HB2 HIS A 96 -1.812 6.510 8.219 1.00 30.33 H new ATOM 0 HB3 HIS A 96 -1.862 8.243 7.962 1.00 30.33 H new ATOM 0 HD1 HIS A 96 -3.072 9.552 9.664 1.00 2.43 H new ATOM 0 HD2 HIS A 96 -4.383 5.549 9.458 1.00 51.41 H new ATOM 0 HE1 HIS A 96 -4.790 9.225 11.499 1.00 4.14 H new ATOM 1504 N ALA A 97 -2.097 8.103 4.699 1.00 52.33 N ATOM 1505 CA ALA A 97 -1.230 8.203 3.519 1.00 30.52 C ATOM 1506 C ALA A 97 -0.011 9.046 3.882 1.00 53.12 C ATOM 1507 O ALA A 97 -0.148 10.186 4.350 1.00 1.54 O ATOM 1508 CB ALA A 97 -2.008 8.838 2.343 1.00 55.12 C ATOM 0 H ALA A 97 -2.674 8.932 4.842 1.00 52.33 H new ATOM 0 HA ALA A 97 -0.903 7.211 3.207 1.00 30.52 H new ATOM 0 HB1 ALA A 97 -1.357 8.908 1.472 1.00 55.12 H new ATOM 0 HB2 ALA A 97 -2.872 8.219 2.101 1.00 55.12 H new ATOM 0 HB3 ALA A 97 -2.345 9.835 2.626 1.00 55.12 H new ATOM 1514 N PHE A 98 1.178 8.459 3.705 1.00 40.13 N ATOM 1515 CA PHE A 98 2.453 9.086 4.041 1.00 22.01 C ATOM 1516 C PHE A 98 3.348 9.143 2.791 1.00 41.33 C ATOM 1517 O PHE A 98 3.049 8.517 1.765 1.00 73.41 O ATOM 1518 CB PHE A 98 3.189 8.275 5.147 1.00 40.14 C ATOM 1519 CG PHE A 98 2.352 7.824 6.351 1.00 4.05 C ATOM 1520 CD1 PHE A 98 2.200 8.632 7.465 1.00 22.54 C ATOM 1521 CD2 PHE A 98 1.753 6.566 6.377 1.00 52.12 C ATOM 1522 CE1 PHE A 98 1.482 8.203 8.563 1.00 32.31 C ATOM 1523 CE2 PHE A 98 1.034 6.140 7.477 1.00 15.22 C ATOM 1524 CZ PHE A 98 0.901 6.961 8.570 1.00 3.24 C ATOM 0 H PHE A 98 1.279 7.521 3.318 1.00 40.13 H new ATOM 0 HA PHE A 98 2.253 10.093 4.407 1.00 22.01 H new ATOM 0 HB2 PHE A 98 3.624 7.389 4.685 1.00 40.14 H new ATOM 0 HB3 PHE A 98 4.017 8.880 5.517 1.00 40.14 H new ATOM 0 HD1 PHE A 98 2.650 9.614 7.475 1.00 22.54 H new ATOM 0 HD2 PHE A 98 1.853 5.913 5.523 1.00 52.12 H new ATOM 0 HE1 PHE A 98 1.377 8.849 9.422 1.00 32.31 H new ATOM 0 HE2 PHE A 98 0.577 5.162 7.477 1.00 15.22 H new ATOM 0 HZ PHE A 98 0.341 6.630 9.432 1.00 3.24 H new ATOM 1534 N ARG A 99 4.450 9.892 2.915 1.00 61.52 N ATOM 1535 CA ARG A 99 5.524 9.981 1.907 1.00 3.50 C ATOM 1536 C ARG A 99 6.762 10.594 2.591 1.00 72.14 C ATOM 1537 O ARG A 99 6.611 11.528 3.385 1.00 44.13 O ATOM 1538 CB ARG A 99 5.047 10.796 0.676 1.00 1.24 C ATOM 1539 CG ARG A 99 4.534 12.231 0.984 1.00 74.40 C ATOM 1540 CD ARG A 99 3.347 12.652 0.103 1.00 65.11 C ATOM 1541 NE ARG A 99 3.640 12.609 -1.340 1.00 64.33 N ATOM 1542 CZ ARG A 99 2.912 13.219 -2.289 1.00 10.31 C ATOM 1543 NH1 ARG A 99 1.828 13.937 -1.983 1.00 43.42 N ATOM 1544 NH2 ARG A 99 3.262 13.094 -3.558 1.00 73.34 N ATOM 0 H ARG A 99 4.628 10.469 3.737 1.00 61.52 H new ATOM 0 HA ARG A 99 5.789 8.995 1.526 1.00 3.50 H new ATOM 0 HB2 ARG A 99 5.872 10.868 -0.033 1.00 1.24 H new ATOM 0 HB3 ARG A 99 4.249 10.242 0.182 1.00 1.24 H new ATOM 0 HG2 ARG A 99 4.238 12.287 2.032 1.00 74.40 H new ATOM 0 HG3 ARG A 99 5.351 12.939 0.845 1.00 74.40 H new ATOM 0 HD2 ARG A 99 2.500 11.999 0.313 1.00 65.11 H new ATOM 0 HD3 ARG A 99 3.045 13.664 0.374 1.00 65.11 H new ATOM 0 HE ARG A 99 4.456 12.076 -1.640 1.00 64.33 H new ATOM 0 HH11 ARG A 99 1.537 14.031 -1.010 1.00 43.42 H new ATOM 0 HH12 ARG A 99 1.292 14.391 -2.722 1.00 43.42 H new ATOM 0 HH21 ARG A 99 4.079 12.538 -3.809 1.00 73.34 H new ATOM 0 HH22 ARG A 99 2.715 13.554 -4.286 1.00 73.34 H new ATOM 1558 N GLN A 100 7.966 10.064 2.261 1.00 11.11 N ATOM 1559 CA GLN A 100 9.190 10.195 3.096 1.00 43.31 C ATOM 1560 C GLN A 100 9.497 11.650 3.550 1.00 4.23 C ATOM 1561 O GLN A 100 9.285 11.990 4.725 1.00 24.25 O ATOM 1562 CB GLN A 100 10.415 9.549 2.382 1.00 31.44 C ATOM 1563 CG GLN A 100 10.245 8.045 2.053 1.00 4.33 C ATOM 1564 CD GLN A 100 11.469 7.372 1.405 1.00 13.14 C ATOM 1565 OE1 GLN A 100 12.671 7.807 1.758 1.00 74.33 O flip ATOM 1566 NE2 GLN A 100 11.331 6.436 0.613 1.00 25.04 N flip ATOM 0 H GLN A 100 8.118 9.531 1.405 1.00 11.11 H new ATOM 0 HA GLN A 100 8.987 9.647 4.016 1.00 43.31 H new ATOM 0 HB2 GLN A 100 10.608 10.091 1.456 1.00 31.44 H new ATOM 0 HB3 GLN A 100 11.295 9.673 3.013 1.00 31.44 H new ATOM 0 HG2 GLN A 100 10.003 7.513 2.973 1.00 4.33 H new ATOM 0 HG3 GLN A 100 9.391 7.930 1.385 1.00 4.33 H new ATOM 0 HE21 GLN A 100 10.396 6.119 0.356 1.00 25.04 H new ATOM 0 HE22 GLN A 100 12.152 5.979 0.215 1.00 25.04 H new ATOM 1575 N ALA A 101 9.992 12.507 2.637 1.00 65.04 N ATOM 1576 CA ALA A 101 10.253 13.927 2.944 1.00 75.15 C ATOM 1577 C ALA A 101 9.401 14.863 2.061 1.00 73.43 C ATOM 1578 O ALA A 101 8.363 15.363 2.498 1.00 62.14 O ATOM 1579 CB ALA A 101 11.763 14.221 2.805 1.00 33.43 C ATOM 0 H ALA A 101 10.220 12.240 1.679 1.00 65.04 H new ATOM 0 HA ALA A 101 9.958 14.123 3.975 1.00 75.15 H new ATOM 0 HB1 ALA A 101 11.952 15.270 3.032 1.00 33.43 H new ATOM 0 HB2 ALA A 101 12.321 13.593 3.499 1.00 33.43 H new ATOM 0 HB3 ALA A 101 12.083 14.008 1.785 1.00 33.43 H new ATOM 1585 N ALA A 102 9.811 15.040 0.792 1.00 23.11 N ATOM 1586 CA ALA A 102 9.223 16.045 -0.122 1.00 0.34 C ATOM 1587 C ALA A 102 8.757 15.395 -1.442 1.00 51.40 C ATOM 1588 O ALA A 102 8.914 15.986 -2.520 1.00 14.30 O ATOM 1589 CB ALA A 102 10.268 17.158 -0.370 1.00 10.12 C ATOM 0 H ALA A 102 10.559 14.492 0.368 1.00 23.11 H new ATOM 0 HA ALA A 102 8.336 16.483 0.336 1.00 0.34 H new ATOM 0 HB1 ALA A 102 9.849 17.907 -1.042 1.00 10.12 H new ATOM 0 HB2 ALA A 102 10.531 17.628 0.578 1.00 10.12 H new ATOM 0 HB3 ALA A 102 11.161 16.725 -0.820 1.00 10.12 H new ATOM 1595 N ASP A 103 8.160 14.188 -1.339 1.00 14.04 N ATOM 1596 CA ASP A 103 7.749 13.373 -2.512 1.00 33.43 C ATOM 1597 C ASP A 103 6.789 14.149 -3.435 1.00 31.05 C ATOM 1598 O ASP A 103 5.773 14.687 -2.981 1.00 30.11 O ATOM 1599 CB ASP A 103 7.055 12.062 -2.052 1.00 64.44 C ATOM 1600 CG ASP A 103 6.647 11.120 -3.206 1.00 52.21 C ATOM 1601 OD1 ASP A 103 5.514 11.251 -3.728 1.00 24.44 O ATOM 1602 OD2 ASP A 103 7.452 10.247 -3.586 1.00 1.15 O ATOM 0 H ASP A 103 7.948 13.748 -0.443 1.00 14.04 H new ATOM 0 HA ASP A 103 8.656 13.136 -3.068 1.00 33.43 H new ATOM 0 HB2 ASP A 103 7.726 11.526 -1.381 1.00 64.44 H new ATOM 0 HB3 ASP A 103 6.166 12.318 -1.476 1.00 64.44 H new ATOM 1607 N GLU A 104 7.150 14.190 -4.719 1.00 12.04 N ATOM 1608 CA GLU A 104 6.306 14.693 -5.818 1.00 52.32 C ATOM 1609 C GLU A 104 6.098 13.575 -6.869 1.00 54.50 C ATOM 1610 O GLU A 104 5.497 13.798 -7.926 1.00 5.21 O ATOM 1611 CB GLU A 104 6.962 15.950 -6.447 1.00 62.12 C ATOM 1612 CG GLU A 104 8.407 15.743 -6.953 1.00 2.25 C ATOM 1613 CD GLU A 104 8.998 16.997 -7.616 1.00 2.34 C ATOM 1614 OE1 GLU A 104 9.560 17.853 -6.897 1.00 41.13 O ATOM 1615 OE2 GLU A 104 8.877 17.150 -8.854 1.00 53.24 O ATOM 0 H GLU A 104 8.063 13.866 -5.038 1.00 12.04 H new ATOM 0 HA GLU A 104 5.328 14.980 -5.433 1.00 52.32 H new ATOM 0 HB2 GLU A 104 6.345 16.286 -7.280 1.00 62.12 H new ATOM 0 HB3 GLU A 104 6.962 16.751 -5.708 1.00 62.12 H new ATOM 0 HG2 GLU A 104 9.040 15.449 -6.116 1.00 2.25 H new ATOM 0 HG3 GLU A 104 8.421 14.920 -7.668 1.00 2.25 H new ATOM 1622 N SER A 105 6.575 12.357 -6.536 1.00 23.23 N ATOM 1623 CA SER A 105 6.474 11.162 -7.396 1.00 24.13 C ATOM 1624 C SER A 105 5.100 10.457 -7.234 1.00 53.54 C ATOM 1625 O SER A 105 4.904 9.351 -7.757 1.00 54.32 O ATOM 1626 CB SER A 105 7.640 10.197 -7.042 1.00 24.01 C ATOM 1627 OG SER A 105 7.680 9.057 -7.889 1.00 3.11 O ATOM 0 H SER A 105 7.047 12.175 -5.650 1.00 23.23 H new ATOM 0 HA SER A 105 6.550 11.465 -8.440 1.00 24.13 H new ATOM 0 HB2 SER A 105 8.586 10.733 -7.115 1.00 24.01 H new ATOM 0 HB3 SER A 105 7.537 9.873 -6.006 1.00 24.01 H new ATOM 0 HG SER A 105 6.766 8.777 -8.104 1.00 3.11 H new ATOM 1633 N ARG A 106 4.164 11.103 -6.487 1.00 10.24 N ATOM 1634 CA ARG A 106 2.771 10.617 -6.276 1.00 1.33 C ATOM 1635 C ARG A 106 2.751 9.309 -5.447 1.00 53.14 C ATOM 1636 O ARG A 106 1.709 8.668 -5.327 1.00 30.05 O ATOM 1637 CB ARG A 106 2.024 10.415 -7.640 1.00 62.31 C ATOM 1638 CG ARG A 106 2.034 11.639 -8.587 1.00 61.01 C ATOM 1639 CD ARG A 106 1.155 12.813 -8.106 1.00 51.21 C ATOM 1640 NE ARG A 106 1.198 13.950 -9.048 1.00 63.04 N ATOM 1641 CZ ARG A 106 0.726 13.943 -10.313 1.00 21.24 C ATOM 1642 NH1 ARG A 106 0.156 12.865 -10.839 1.00 15.02 N ATOM 1643 NH2 ARG A 106 0.815 15.040 -11.043 1.00 33.32 N ATOM 0 H ARG A 106 4.356 11.984 -6.010 1.00 10.24 H new ATOM 0 HA ARG A 106 2.243 11.385 -5.711 1.00 1.33 H new ATOM 0 HB2 ARG A 106 2.475 9.570 -8.161 1.00 62.31 H new ATOM 0 HB3 ARG A 106 0.988 10.146 -7.432 1.00 62.31 H new ATOM 0 HG2 ARG A 106 3.060 11.989 -8.700 1.00 61.01 H new ATOM 0 HG3 ARG A 106 1.694 11.325 -9.574 1.00 61.01 H new ATOM 0 HD2 ARG A 106 0.125 12.474 -7.992 1.00 51.21 H new ATOM 0 HD3 ARG A 106 1.493 13.142 -7.123 1.00 51.21 H new ATOM 0 HE ARG A 106 1.621 14.816 -8.714 1.00 63.04 H new ATOM 0 HH11 ARG A 106 0.066 12.014 -10.284 1.00 15.02 H new ATOM 0 HH12 ARG A 106 -0.192 12.888 -11.798 1.00 15.02 H new ATOM 0 HH21 ARG A 106 1.237 15.881 -10.650 1.00 33.32 H new ATOM 0 HH22 ARG A 106 0.462 15.046 -12.000 1.00 33.32 H new ATOM 1657 N THR A 107 3.895 8.953 -4.840 1.00 31.13 N ATOM 1658 CA THR A 107 4.075 7.657 -4.178 1.00 24.21 C ATOM 1659 C THR A 107 3.502 7.725 -2.752 1.00 20.13 C ATOM 1660 O THR A 107 4.176 8.151 -1.802 1.00 34.33 O ATOM 1661 CB THR A 107 5.585 7.227 -4.177 1.00 51.13 C ATOM 1662 OG1 THR A 107 6.135 7.392 -5.497 1.00 1.44 O ATOM 1663 CG2 THR A 107 5.770 5.759 -3.746 1.00 33.23 C ATOM 0 H THR A 107 4.717 9.556 -4.796 1.00 31.13 H new ATOM 0 HA THR A 107 3.531 6.894 -4.734 1.00 24.21 H new ATOM 0 HB THR A 107 6.103 7.862 -3.458 1.00 51.13 H new ATOM 0 HG1 THR A 107 7.078 7.125 -5.494 1.00 1.44 H new ATOM 0 HG21 THR A 107 6.830 5.506 -3.760 1.00 33.23 H new ATOM 0 HG22 THR A 107 5.378 5.624 -2.738 1.00 33.23 H new ATOM 0 HG23 THR A 107 5.232 5.107 -4.435 1.00 33.23 H new ATOM 1671 N LEU A 108 2.207 7.391 -2.648 1.00 53.44 N ATOM 1672 CA LEU A 108 1.481 7.335 -1.377 1.00 62.33 C ATOM 1673 C LEU A 108 1.650 5.953 -0.756 1.00 73.14 C ATOM 1674 O LEU A 108 1.367 4.938 -1.395 1.00 35.14 O ATOM 1675 CB LEU A 108 -0.019 7.625 -1.592 1.00 52.43 C ATOM 1676 CG LEU A 108 -0.363 8.997 -2.234 1.00 24.15 C ATOM 1677 CD1 LEU A 108 -1.871 9.090 -2.493 1.00 45.42 C ATOM 1678 CD2 LEU A 108 0.151 10.178 -1.369 1.00 44.01 C ATOM 0 H LEU A 108 1.631 7.150 -3.455 1.00 53.44 H new ATOM 0 HA LEU A 108 1.889 8.093 -0.709 1.00 62.33 H new ATOM 0 HB2 LEU A 108 -0.434 6.838 -2.221 1.00 52.43 H new ATOM 0 HB3 LEU A 108 -0.523 7.561 -0.628 1.00 52.43 H new ATOM 0 HG LEU A 108 0.152 9.070 -3.192 1.00 24.15 H new ATOM 0 HD11 LEU A 108 -2.104 10.055 -2.943 1.00 45.42 H new ATOM 0 HD12 LEU A 108 -2.174 8.291 -3.170 1.00 45.42 H new ATOM 0 HD13 LEU A 108 -2.409 8.990 -1.550 1.00 45.42 H new ATOM 0 HD21 LEU A 108 -0.108 11.121 -1.850 1.00 44.01 H new ATOM 0 HD22 LEU A 108 -0.311 10.135 -0.383 1.00 44.01 H new ATOM 0 HD23 LEU A 108 1.234 10.109 -1.266 1.00 44.01 H new ATOM 1690 N PHE A 109 2.101 5.937 0.489 1.00 4.01 N ATOM 1691 CA PHE A 109 2.349 4.716 1.244 1.00 4.12 C ATOM 1692 C PHE A 109 1.296 4.620 2.356 1.00 25.32 C ATOM 1693 O PHE A 109 1.326 5.418 3.299 1.00 1.42 O ATOM 1694 CB PHE A 109 3.790 4.772 1.821 1.00 31.21 C ATOM 1695 CG PHE A 109 4.337 3.435 2.304 1.00 14.43 C ATOM 1696 CD1 PHE A 109 4.750 2.477 1.383 1.00 43.12 C ATOM 1697 CD2 PHE A 109 4.476 3.147 3.664 1.00 5.51 C ATOM 1698 CE1 PHE A 109 5.279 1.277 1.807 1.00 14.34 C ATOM 1699 CE2 PHE A 109 4.997 1.939 4.087 1.00 40.01 C ATOM 1700 CZ PHE A 109 5.401 1.009 3.156 1.00 60.24 C ATOM 0 H PHE A 109 2.309 6.787 1.013 1.00 4.01 H new ATOM 0 HA PHE A 109 2.271 3.830 0.613 1.00 4.12 H new ATOM 0 HB2 PHE A 109 4.458 5.167 1.055 1.00 31.21 H new ATOM 0 HB3 PHE A 109 3.806 5.477 2.652 1.00 31.21 H new ATOM 0 HD1 PHE A 109 4.655 2.676 0.326 1.00 43.12 H new ATOM 0 HD2 PHE A 109 4.171 3.880 4.396 1.00 5.51 H new ATOM 0 HE1 PHE A 109 5.599 0.544 1.082 1.00 14.34 H new ATOM 0 HE2 PHE A 109 5.087 1.726 5.142 1.00 40.01 H new ATOM 0 HZ PHE A 109 5.815 0.066 3.482 1.00 60.24 H new ATOM 1710 N VAL A 110 0.334 3.689 2.215 1.00 53.41 N ATOM 1711 CA VAL A 110 -0.687 3.421 3.254 1.00 40.53 C ATOM 1712 C VAL A 110 -0.433 2.025 3.873 1.00 11.22 C ATOM 1713 O VAL A 110 -0.759 0.988 3.277 1.00 23.42 O ATOM 1714 CB VAL A 110 -2.189 3.577 2.747 1.00 31.42 C ATOM 1715 CG1 VAL A 110 -2.476 5.029 2.331 1.00 43.41 C ATOM 1716 CG2 VAL A 110 -2.562 2.613 1.599 1.00 4.32 C ATOM 0 H VAL A 110 0.240 3.103 1.385 1.00 53.41 H new ATOM 0 HA VAL A 110 -0.577 4.190 4.019 1.00 40.53 H new ATOM 0 HB VAL A 110 -2.817 3.306 3.595 1.00 31.42 H new ATOM 0 HG11 VAL A 110 -3.507 5.112 1.988 1.00 43.41 H new ATOM 0 HG12 VAL A 110 -2.323 5.689 3.185 1.00 43.41 H new ATOM 0 HG13 VAL A 110 -1.801 5.317 1.525 1.00 43.41 H new ATOM 0 HG21 VAL A 110 -3.599 2.778 1.308 1.00 4.32 H new ATOM 0 HG22 VAL A 110 -1.911 2.796 0.744 1.00 4.32 H new ATOM 0 HG23 VAL A 110 -2.439 1.583 1.934 1.00 4.32 H new ATOM 1726 N PRO A 111 0.246 1.961 5.053 1.00 42.13 N ATOM 1727 CA PRO A 111 0.311 0.729 5.839 1.00 75.24 C ATOM 1728 C PRO A 111 -1.076 0.392 6.409 1.00 2.22 C ATOM 1729 O PRO A 111 -1.844 1.298 6.767 1.00 45.15 O ATOM 1730 CB PRO A 111 1.346 1.041 6.970 1.00 2.04 C ATOM 1731 CG PRO A 111 2.030 2.304 6.530 1.00 53.31 C ATOM 1732 CD PRO A 111 1.008 3.047 5.704 1.00 14.44 C ATOM 0 HA PRO A 111 0.612 -0.139 5.252 1.00 75.24 H new ATOM 0 HB2 PRO A 111 0.852 1.174 7.932 1.00 2.04 H new ATOM 0 HB3 PRO A 111 2.060 0.226 7.088 1.00 2.04 H new ATOM 0 HG2 PRO A 111 2.349 2.897 7.387 1.00 53.31 H new ATOM 0 HG3 PRO A 111 2.923 2.084 5.945 1.00 53.31 H new ATOM 0 HD2 PRO A 111 0.367 3.673 6.325 1.00 14.44 H new ATOM 0 HD3 PRO A 111 1.481 3.702 4.972 1.00 14.44 H new ATOM 1740 N PHE A 112 -1.400 -0.898 6.460 1.00 52.12 N ATOM 1741 CA PHE A 112 -2.584 -1.400 7.166 1.00 21.11 C ATOM 1742 C PHE A 112 -2.215 -2.693 7.907 1.00 11.22 C ATOM 1743 O PHE A 112 -1.123 -3.239 7.719 1.00 22.50 O ATOM 1744 CB PHE A 112 -3.792 -1.612 6.200 1.00 4.44 C ATOM 1745 CG PHE A 112 -3.636 -2.723 5.157 1.00 12.12 C ATOM 1746 CD1 PHE A 112 -2.996 -2.480 3.939 1.00 20.51 C ATOM 1747 CD2 PHE A 112 -4.130 -4.012 5.398 1.00 12.00 C ATOM 1748 CE1 PHE A 112 -2.867 -3.486 2.999 1.00 52.22 C ATOM 1749 CE2 PHE A 112 -3.998 -5.007 4.457 1.00 63.43 C ATOM 1750 CZ PHE A 112 -3.364 -4.748 3.262 1.00 51.44 C ATOM 0 H PHE A 112 -0.849 -1.630 6.012 1.00 52.12 H new ATOM 0 HA PHE A 112 -2.906 -0.653 7.892 1.00 21.11 H new ATOM 0 HB2 PHE A 112 -4.677 -1.826 6.799 1.00 4.44 H new ATOM 0 HB3 PHE A 112 -3.981 -0.675 5.677 1.00 4.44 H new ATOM 0 HD1 PHE A 112 -2.599 -1.498 3.730 1.00 20.51 H new ATOM 0 HD2 PHE A 112 -4.621 -4.227 6.335 1.00 12.00 H new ATOM 0 HE1 PHE A 112 -2.377 -3.285 2.058 1.00 52.22 H new ATOM 0 HE2 PHE A 112 -4.392 -5.993 4.656 1.00 63.43 H new ATOM 0 HZ PHE A 112 -3.255 -5.533 2.529 1.00 51.44 H new ATOM 1760 N ARG A 113 -3.110 -3.143 8.776 1.00 72.13 N ATOM 1761 CA ARG A 113 -3.018 -4.465 9.421 1.00 23.24 C ATOM 1762 C ARG A 113 -4.414 -5.074 9.467 1.00 43.44 C ATOM 1763 O ARG A 113 -5.300 -4.517 10.106 1.00 30.44 O ATOM 1764 CB ARG A 113 -2.410 -4.353 10.849 1.00 63.01 C ATOM 1765 CG ARG A 113 -2.436 -5.675 11.650 1.00 11.24 C ATOM 1766 CD ARG A 113 -1.785 -5.582 13.041 1.00 15.22 C ATOM 1767 NE ARG A 113 -1.845 -6.892 13.717 1.00 54.22 N ATOM 1768 CZ ARG A 113 -0.820 -7.535 14.295 1.00 51.34 C ATOM 1769 NH1 ARG A 113 0.410 -7.011 14.317 1.00 11.51 N ATOM 1770 NH2 ARG A 113 -1.029 -8.723 14.838 1.00 12.14 N ATOM 0 H ARG A 113 -3.928 -2.605 9.061 1.00 72.13 H new ATOM 0 HA ARG A 113 -2.354 -5.108 8.844 1.00 23.24 H new ATOM 0 HB2 ARG A 113 -1.379 -4.010 10.768 1.00 63.01 H new ATOM 0 HB3 ARG A 113 -2.956 -3.592 11.406 1.00 63.01 H new ATOM 0 HG2 ARG A 113 -3.471 -5.996 11.766 1.00 11.24 H new ATOM 0 HG3 ARG A 113 -1.926 -6.446 11.073 1.00 11.24 H new ATOM 0 HD2 ARG A 113 -0.748 -5.261 12.945 1.00 15.22 H new ATOM 0 HD3 ARG A 113 -2.297 -4.830 13.641 1.00 15.22 H new ATOM 0 HE ARG A 113 -2.754 -7.353 13.748 1.00 54.22 H new ATOM 0 HH11 ARG A 113 0.585 -6.102 13.888 1.00 11.51 H new ATOM 0 HH12 ARG A 113 1.173 -7.520 14.763 1.00 11.51 H new ATOM 0 HH21 ARG A 113 -1.960 -9.138 14.814 1.00 12.14 H new ATOM 0 HH22 ARG A 113 -0.259 -9.224 15.281 1.00 12.14 H new ATOM 1784 N ASP A 114 -4.603 -6.229 8.818 1.00 3.03 N ATOM 1785 CA ASP A 114 -5.931 -6.854 8.658 1.00 54.33 C ATOM 1786 C ASP A 114 -5.901 -8.248 9.332 1.00 14.32 C ATOM 1787 O ASP A 114 -4.982 -8.526 10.118 1.00 24.11 O ATOM 1788 CB ASP A 114 -6.295 -6.920 7.150 1.00 33.12 C ATOM 1789 CG ASP A 114 -5.557 -8.021 6.373 1.00 32.33 C ATOM 1790 OD1 ASP A 114 -4.320 -7.926 6.204 1.00 63.51 O ATOM 1791 OD2 ASP A 114 -6.210 -9.006 5.960 1.00 22.13 O ATOM 0 H ASP A 114 -3.845 -6.759 8.388 1.00 3.03 H new ATOM 0 HA ASP A 114 -6.708 -6.264 9.144 1.00 54.33 H new ATOM 0 HB2 ASP A 114 -7.369 -7.080 7.053 1.00 33.12 H new ATOM 0 HB3 ASP A 114 -6.074 -5.956 6.691 1.00 33.12 H new ATOM 1796 N LYS A 115 -6.885 -9.132 9.038 1.00 61.03 N ATOM 1797 CA LYS A 115 -7.002 -10.445 9.720 1.00 42.24 C ATOM 1798 C LYS A 115 -6.163 -11.555 9.041 1.00 1.21 C ATOM 1799 O LYS A 115 -6.140 -12.696 9.527 1.00 70.12 O ATOM 1800 CB LYS A 115 -8.490 -10.873 9.862 1.00 21.40 C ATOM 1801 CG LYS A 115 -9.427 -9.805 10.488 1.00 14.40 C ATOM 1802 CD LYS A 115 -8.882 -9.113 11.758 1.00 1.11 C ATOM 1803 CE LYS A 115 -8.668 -10.065 12.936 1.00 2.31 C ATOM 1804 NZ LYS A 115 -8.251 -9.333 14.162 1.00 22.14 N ATOM 0 H LYS A 115 -7.606 -8.961 8.337 1.00 61.03 H new ATOM 0 HA LYS A 115 -6.586 -10.312 10.719 1.00 42.24 H new ATOM 0 HB2 LYS A 115 -8.872 -11.135 8.875 1.00 21.40 H new ATOM 0 HB3 LYS A 115 -8.535 -11.776 10.472 1.00 21.40 H new ATOM 0 HG2 LYS A 115 -9.633 -9.041 9.738 1.00 14.40 H new ATOM 0 HG3 LYS A 115 -10.379 -10.278 10.731 1.00 14.40 H new ATOM 0 HD2 LYS A 115 -7.936 -8.628 11.518 1.00 1.11 H new ATOM 0 HD3 LYS A 115 -9.576 -8.328 12.059 1.00 1.11 H new ATOM 0 HE2 LYS A 115 -9.589 -10.613 13.134 1.00 2.31 H new ATOM 0 HE3 LYS A 115 -7.909 -10.802 12.676 1.00 2.31 H new ATOM 0 HZ1 LYS A 115 -7.721 -9.974 14.786 1.00 22.14 H new ATOM 0 HZ2 LYS A 115 -7.646 -8.529 13.898 1.00 22.14 H new ATOM 0 HZ3 LYS A 115 -9.094 -8.983 14.661 1.00 22.14 H new ATOM 1818 N THR A 116 -5.472 -11.235 7.931 1.00 62.53 N ATOM 1819 CA THR A 116 -4.453 -12.136 7.360 1.00 20.33 C ATOM 1820 C THR A 116 -3.107 -11.877 8.062 1.00 23.45 C ATOM 1821 O THR A 116 -2.331 -12.817 8.310 1.00 41.33 O ATOM 1822 CB THR A 116 -4.288 -11.985 5.799 1.00 70.22 C ATOM 1823 OG1 THR A 116 -3.779 -10.687 5.460 1.00 4.51 O ATOM 1824 CG2 THR A 116 -5.616 -12.228 5.048 1.00 41.45 C ATOM 0 H THR A 116 -5.599 -10.365 7.414 1.00 62.53 H new ATOM 0 HA THR A 116 -4.790 -13.158 7.532 1.00 20.33 H new ATOM 0 HB THR A 116 -3.575 -12.747 5.486 1.00 70.22 H new ATOM 0 HG1 THR A 116 -4.516 -10.042 5.439 1.00 4.51 H new ATOM 0 HG21 THR A 116 -5.454 -12.113 3.976 1.00 41.45 H new ATOM 0 HG22 THR A 116 -5.972 -13.237 5.255 1.00 41.45 H new ATOM 0 HG23 THR A 116 -6.360 -11.505 5.382 1.00 41.45 H new ATOM 1832 N THR A 117 -2.871 -10.591 8.418 1.00 73.42 N ATOM 1833 CA THR A 117 -1.628 -10.129 9.062 1.00 52.44 C ATOM 1834 C THR A 117 -1.522 -10.699 10.500 1.00 4.34 C ATOM 1835 O THR A 117 -2.436 -10.529 11.314 1.00 23.41 O ATOM 1836 CB THR A 117 -1.578 -8.558 9.099 1.00 33.22 C ATOM 1837 OG1 THR A 117 -1.803 -8.019 7.785 1.00 3.30 O ATOM 1838 CG2 THR A 117 -0.235 -8.013 9.617 1.00 54.20 C ATOM 0 H THR A 117 -3.547 -9.843 8.263 1.00 73.42 H new ATOM 0 HA THR A 117 -0.783 -10.491 8.477 1.00 52.44 H new ATOM 0 HB THR A 117 -2.363 -8.248 9.788 1.00 33.22 H new ATOM 0 HG1 THR A 117 -2.740 -8.156 7.531 1.00 3.30 H new ATOM 0 HG21 THR A 117 -0.261 -6.923 9.619 1.00 54.20 H new ATOM 0 HG22 THR A 117 -0.063 -8.374 10.631 1.00 54.20 H new ATOM 0 HG23 THR A 117 0.571 -8.355 8.968 1.00 54.20 H new ATOM 1846 N GLY A 118 -0.405 -11.393 10.783 1.00 30.22 N ATOM 1847 CA GLY A 118 -0.177 -12.059 12.075 1.00 12.21 C ATOM 1848 C GLY A 118 -0.762 -13.473 12.177 1.00 14.02 C ATOM 1849 O GLY A 118 -0.419 -14.208 13.113 1.00 33.24 O ATOM 0 H GLY A 118 0.363 -11.507 10.122 1.00 30.22 H new ATOM 0 HA2 GLY A 118 0.896 -12.110 12.258 1.00 12.21 H new ATOM 0 HA3 GLY A 118 -0.606 -11.445 12.866 1.00 12.21 H new ATOM 1853 N GLN A 119 -1.651 -13.859 11.233 1.00 25.20 N ATOM 1854 CA GLN A 119 -2.409 -15.130 11.309 1.00 4.32 C ATOM 1855 C GLN A 119 -1.933 -16.133 10.222 1.00 34.53 C ATOM 1856 O GLN A 119 -1.229 -17.104 10.528 1.00 61.45 O ATOM 1857 CB GLN A 119 -3.942 -14.844 11.192 1.00 45.02 C ATOM 1858 CG GLN A 119 -4.529 -13.889 12.263 1.00 1.33 C ATOM 1859 CD GLN A 119 -4.355 -14.401 13.698 1.00 11.43 C ATOM 1860 OE1 GLN A 119 -5.196 -15.140 14.217 1.00 33.11 O ATOM 1861 NE2 GLN A 119 -3.280 -13.994 14.360 1.00 13.45 N ATOM 0 H GLN A 119 -1.862 -13.304 10.404 1.00 25.20 H new ATOM 0 HA GLN A 119 -2.219 -15.593 12.277 1.00 4.32 H new ATOM 0 HB2 GLN A 119 -4.140 -14.422 10.207 1.00 45.02 H new ATOM 0 HB3 GLN A 119 -4.476 -15.793 11.246 1.00 45.02 H new ATOM 0 HG2 GLN A 119 -4.049 -12.915 12.172 1.00 1.33 H new ATOM 0 HG3 GLN A 119 -5.590 -13.741 12.064 1.00 1.33 H new ATOM 0 HE21 GLN A 119 -2.602 -13.383 13.905 1.00 13.45 H new ATOM 0 HE22 GLN A 119 -3.132 -14.292 15.324 1.00 13.45 H new ATOM 1870 N GLN A 120 -2.308 -15.877 8.947 1.00 44.15 N ATOM 1871 CA GLN A 120 -1.945 -16.746 7.785 1.00 33.31 C ATOM 1872 C GLN A 120 -0.782 -16.119 6.973 1.00 64.32 C ATOM 1873 O GLN A 120 -0.500 -16.517 5.836 1.00 15.42 O ATOM 1874 CB GLN A 120 -3.210 -16.987 6.908 1.00 44.42 C ATOM 1875 CG GLN A 120 -3.861 -15.705 6.351 1.00 3.45 C ATOM 1876 CD GLN A 120 -5.191 -15.957 5.640 1.00 73.34 C ATOM 1877 OE1 GLN A 120 -5.236 -16.179 4.429 1.00 34.24 O ATOM 1878 NE2 GLN A 120 -6.288 -15.929 6.392 1.00 44.51 N ATOM 0 H GLN A 120 -2.870 -15.066 8.687 1.00 44.15 H new ATOM 0 HA GLN A 120 -1.591 -17.712 8.145 1.00 33.31 H new ATOM 0 HB2 GLN A 120 -2.939 -17.633 6.073 1.00 44.42 H new ATOM 0 HB3 GLN A 120 -3.949 -17.526 7.501 1.00 44.42 H new ATOM 0 HG2 GLN A 120 -4.023 -15.004 7.170 1.00 3.45 H new ATOM 0 HG3 GLN A 120 -3.170 -15.229 5.655 1.00 3.45 H new ATOM 0 HE21 GLN A 120 -6.216 -15.742 7.392 1.00 44.51 H new ATOM 0 HE22 GLN A 120 -7.201 -16.094 5.968 1.00 44.51 H new ATOM 1887 N SER A 121 -0.093 -15.175 7.636 1.00 60.22 N ATOM 1888 CA SER A 121 1.047 -14.413 7.111 1.00 14.31 C ATOM 1889 C SER A 121 1.568 -13.525 8.249 1.00 5.21 C ATOM 1890 O SER A 121 0.791 -13.179 9.142 1.00 71.12 O ATOM 1891 CB SER A 121 0.644 -13.573 5.872 1.00 60.12 C ATOM 1892 OG SER A 121 -0.443 -12.718 6.168 1.00 25.22 O ATOM 0 H SER A 121 -0.327 -14.913 8.593 1.00 60.22 H new ATOM 0 HA SER A 121 1.832 -15.090 6.773 1.00 14.31 H new ATOM 0 HB2 SER A 121 1.496 -12.981 5.538 1.00 60.12 H new ATOM 0 HB3 SER A 121 0.375 -14.237 5.050 1.00 60.12 H new ATOM 0 HG SER A 121 -0.806 -12.944 7.050 1.00 25.22 H new ATOM 1898 N TYR A 122 2.867 -13.170 8.230 1.00 63.11 N ATOM 1899 CA TYR A 122 3.521 -12.486 9.375 1.00 34.44 C ATOM 1900 C TYR A 122 3.039 -11.010 9.549 1.00 13.13 C ATOM 1901 O TYR A 122 2.447 -10.413 8.640 1.00 73.03 O ATOM 1902 CB TYR A 122 5.078 -12.585 9.237 1.00 24.12 C ATOM 1903 CG TYR A 122 5.853 -12.186 10.517 1.00 72.43 C ATOM 1904 CD1 TYR A 122 5.820 -12.997 11.656 1.00 50.21 C ATOM 1905 CD2 TYR A 122 6.563 -10.985 10.607 1.00 32.22 C ATOM 1906 CE1 TYR A 122 6.471 -12.624 12.821 1.00 40.14 C ATOM 1907 CE2 TYR A 122 7.203 -10.608 11.770 1.00 74.31 C ATOM 1908 CZ TYR A 122 7.158 -11.427 12.870 1.00 45.43 C ATOM 1909 OH TYR A 122 7.791 -11.038 14.034 1.00 22.11 O ATOM 0 H TYR A 122 3.487 -13.343 7.439 1.00 63.11 H new ATOM 0 HA TYR A 122 3.221 -13.000 10.288 1.00 34.44 H new ATOM 0 HB2 TYR A 122 5.344 -13.607 8.968 1.00 24.12 H new ATOM 0 HB3 TYR A 122 5.401 -11.945 8.416 1.00 24.12 H new ATOM 0 HD1 TYR A 122 5.278 -13.930 11.627 1.00 50.21 H new ATOM 0 HD2 TYR A 122 6.612 -10.336 9.745 1.00 32.22 H new ATOM 0 HE1 TYR A 122 6.441 -13.267 13.688 1.00 40.14 H new ATOM 0 HE2 TYR A 122 7.738 -9.671 11.814 1.00 74.31 H new ATOM 0 HH TYR A 122 8.227 -10.172 13.895 1.00 22.11 H new ATOM 1919 N ASP A 123 3.329 -10.449 10.737 1.00 54.42 N ATOM 1920 CA ASP A 123 2.879 -9.113 11.169 1.00 43.02 C ATOM 1921 C ASP A 123 4.083 -8.130 11.211 1.00 5.11 C ATOM 1922 O ASP A 123 5.007 -8.272 10.410 1.00 13.42 O ATOM 1923 CB ASP A 123 2.140 -9.235 12.530 1.00 33.31 C ATOM 1924 CG ASP A 123 3.058 -9.559 13.722 1.00 4.24 C ATOM 1925 OD1 ASP A 123 3.676 -10.643 13.725 1.00 63.52 O ATOM 1926 OD2 ASP A 123 3.163 -8.725 14.647 1.00 55.23 O ATOM 0 H ASP A 123 3.896 -10.923 11.440 1.00 54.42 H new ATOM 0 HA ASP A 123 2.170 -8.699 10.452 1.00 43.02 H new ATOM 0 HB2 ASP A 123 1.618 -8.300 12.732 1.00 33.31 H new ATOM 0 HB3 ASP A 123 1.381 -10.013 12.449 1.00 33.31 H new ATOM 1931 N GLY A 124 4.048 -7.111 12.104 1.00 74.41 N ATOM 1932 CA GLY A 124 5.088 -6.067 12.167 1.00 4.24 C ATOM 1933 C GLY A 124 4.703 -4.864 11.319 1.00 45.22 C ATOM 1934 O GLY A 124 4.958 -3.715 11.696 1.00 55.53 O ATOM 0 H GLY A 124 3.304 -6.994 12.792 1.00 74.41 H new ATOM 0 HA2 GLY A 124 5.234 -5.756 13.201 1.00 4.24 H new ATOM 0 HA3 GLY A 124 6.038 -6.473 11.819 1.00 4.24 H new ATOM 1938 N GLY A 125 4.085 -5.155 10.165 1.00 12.12 N ATOM 1939 CA GLY A 125 3.502 -4.156 9.289 1.00 71.11 C ATOM 1940 C GLY A 125 3.137 -4.766 7.945 1.00 73.44 C ATOM 1941 O GLY A 125 3.797 -5.702 7.491 1.00 24.41 O ATOM 0 H GLY A 125 3.980 -6.109 9.818 1.00 12.12 H new ATOM 0 HA2 GLY A 125 2.613 -3.731 9.755 1.00 71.11 H new ATOM 0 HA3 GLY A 125 4.207 -3.338 9.143 1.00 71.11 H new ATOM 1945 N ARG A 126 2.057 -4.265 7.342 1.00 15.13 N ATOM 1946 CA ARG A 126 1.653 -4.584 5.959 1.00 3.42 C ATOM 1947 C ARG A 126 1.383 -3.271 5.249 1.00 31.42 C ATOM 1948 O ARG A 126 1.079 -2.277 5.912 1.00 63.32 O ATOM 1949 CB ARG A 126 0.404 -5.504 5.945 1.00 34.32 C ATOM 1950 CG ARG A 126 -0.067 -5.961 4.523 1.00 41.15 C ATOM 1951 CD ARG A 126 -0.639 -7.383 4.532 1.00 55.44 C ATOM 1952 NE ARG A 126 0.359 -8.305 5.098 1.00 75.14 N ATOM 1953 CZ ARG A 126 0.118 -9.540 5.538 1.00 34.23 C ATOM 1954 NH1 ARG A 126 -1.100 -10.066 5.483 1.00 50.24 N ATOM 1955 NH2 ARG A 126 1.099 -10.237 6.085 1.00 42.45 N ATOM 0 H ARG A 126 1.423 -3.614 7.804 1.00 15.13 H new ATOM 0 HA ARG A 126 2.445 -5.129 5.445 1.00 3.42 H new ATOM 0 HB2 ARG A 126 0.618 -6.390 6.542 1.00 34.32 H new ATOM 0 HB3 ARG A 126 -0.419 -4.981 6.433 1.00 34.32 H new ATOM 0 HG2 ARG A 126 -0.824 -5.269 4.153 1.00 41.15 H new ATOM 0 HG3 ARG A 126 0.774 -5.914 3.831 1.00 41.15 H new ATOM 0 HD2 ARG A 126 -1.556 -7.415 5.121 1.00 55.44 H new ATOM 0 HD3 ARG A 126 -0.900 -7.689 3.519 1.00 55.44 H new ATOM 0 HE ARG A 126 1.320 -7.969 5.159 1.00 75.14 H new ATOM 0 HH11 ARG A 126 -1.873 -9.523 5.098 1.00 50.24 H new ATOM 0 HH12 ARG A 126 -1.262 -11.013 5.825 1.00 50.24 H new ATOM 0 HH21 ARG A 126 2.030 -9.829 6.167 1.00 42.45 H new ATOM 0 HH22 ARG A 126 0.925 -11.183 6.425 1.00 42.45 H new ATOM 1969 N TYR A 127 1.502 -3.247 3.915 1.00 63.42 N ATOM 1970 CA TYR A 127 1.411 -1.994 3.162 1.00 2.34 C ATOM 1971 C TYR A 127 0.627 -2.159 1.848 1.00 1.40 C ATOM 1972 O TYR A 127 0.491 -3.263 1.298 1.00 1.22 O ATOM 1973 CB TYR A 127 2.837 -1.437 2.907 1.00 30.00 C ATOM 1974 CG TYR A 127 3.656 -2.132 1.798 1.00 50.42 C ATOM 1975 CD1 TYR A 127 4.205 -3.405 1.975 1.00 61.41 C ATOM 1976 CD2 TYR A 127 3.890 -1.495 0.573 1.00 55.40 C ATOM 1977 CE1 TYR A 127 4.950 -4.004 0.973 1.00 15.12 C ATOM 1978 CE2 TYR A 127 4.636 -2.092 -0.421 1.00 2.03 C ATOM 1979 CZ TYR A 127 5.160 -3.346 -0.218 1.00 32.51 C ATOM 1980 OH TYR A 127 5.896 -3.952 -1.217 1.00 64.20 O ATOM 0 H TYR A 127 1.660 -4.075 3.341 1.00 63.42 H new ATOM 0 HA TYR A 127 0.851 -1.276 3.761 1.00 2.34 H new ATOM 0 HB2 TYR A 127 2.751 -0.380 2.657 1.00 30.00 H new ATOM 0 HB3 TYR A 127 3.400 -1.500 3.838 1.00 30.00 H new ATOM 0 HD1 TYR A 127 4.046 -3.929 2.906 1.00 61.41 H new ATOM 0 HD2 TYR A 127 3.476 -0.512 0.403 1.00 55.40 H new ATOM 0 HE1 TYR A 127 5.367 -4.989 1.126 1.00 15.12 H new ATOM 0 HE2 TYR A 127 4.808 -1.577 -1.354 1.00 2.03 H new ATOM 0 HH TYR A 127 6.841 -3.713 -1.118 1.00 64.20 H new ATOM 1990 N MET A 128 0.138 -1.012 1.375 1.00 44.30 N ATOM 1991 CA MET A 128 -0.585 -0.842 0.116 1.00 53.32 C ATOM 1992 C MET A 128 -0.115 0.520 -0.448 1.00 71.13 C ATOM 1993 O MET A 128 0.137 1.446 0.330 1.00 24.24 O ATOM 1994 CB MET A 128 -2.137 -0.885 0.373 1.00 55.13 C ATOM 1995 CG MET A 128 -2.965 -1.468 -0.789 1.00 4.41 C ATOM 1996 SD MET A 128 -2.962 -0.448 -2.275 1.00 32.32 S ATOM 1997 CE MET A 128 -4.116 0.843 -1.816 1.00 45.32 C ATOM 0 H MET A 128 0.241 -0.135 1.885 1.00 44.30 H new ATOM 0 HA MET A 128 -0.382 -1.640 -0.599 1.00 53.32 H new ATOM 0 HB2 MET A 128 -2.327 -1.476 1.269 1.00 55.13 H new ATOM 0 HB3 MET A 128 -2.486 0.127 0.578 1.00 55.13 H new ATOM 0 HG2 MET A 128 -2.577 -2.456 -1.038 1.00 4.41 H new ATOM 0 HG3 MET A 128 -3.994 -1.604 -0.456 1.00 4.41 H new ATOM 0 HE1 MET A 128 -4.503 1.322 -2.716 1.00 45.32 H new ATOM 0 HE2 MET A 128 -4.942 0.409 -1.252 1.00 45.32 H new ATOM 0 HE3 MET A 128 -3.606 1.585 -1.201 1.00 45.32 H new ATOM 2007 N GLU A 129 0.045 0.642 -1.769 1.00 50.45 N ATOM 2008 CA GLU A 129 0.647 1.846 -2.391 1.00 0.13 C ATOM 2009 C GLU A 129 -0.250 2.365 -3.521 1.00 65.05 C ATOM 2010 O GLU A 129 -0.680 1.593 -4.383 1.00 21.55 O ATOM 2011 CB GLU A 129 2.057 1.501 -2.922 1.00 44.20 C ATOM 2012 CG GLU A 129 2.818 2.672 -3.567 1.00 23.41 C ATOM 2013 CD GLU A 129 4.114 2.207 -4.233 1.00 3.22 C ATOM 2014 OE1 GLU A 129 4.038 1.598 -5.330 1.00 4.32 O ATOM 2015 OE2 GLU A 129 5.208 2.387 -3.648 1.00 42.04 O ATOM 0 H GLU A 129 -0.232 -0.076 -2.438 1.00 50.45 H new ATOM 0 HA GLU A 129 0.736 2.634 -1.643 1.00 0.13 H new ATOM 0 HB2 GLU A 129 2.653 1.111 -2.097 1.00 44.20 H new ATOM 0 HB3 GLU A 129 1.966 0.700 -3.655 1.00 44.20 H new ATOM 0 HG2 GLU A 129 2.181 3.155 -4.308 1.00 23.41 H new ATOM 0 HG3 GLU A 129 3.047 3.419 -2.807 1.00 23.41 H new ATOM 2022 N LEU A 130 -0.540 3.681 -3.488 1.00 12.42 N ATOM 2023 CA LEU A 130 -1.363 4.372 -4.502 1.00 53.40 C ATOM 2024 C LEU A 130 -0.489 5.393 -5.238 1.00 11.11 C ATOM 2025 O LEU A 130 0.342 6.065 -4.619 1.00 23.40 O ATOM 2026 CB LEU A 130 -2.591 5.110 -3.863 1.00 73.12 C ATOM 2027 CG LEU A 130 -3.348 4.351 -2.719 1.00 62.21 C ATOM 2028 CD1 LEU A 130 -2.664 4.555 -1.354 1.00 4.52 C ATOM 2029 CD2 LEU A 130 -4.832 4.745 -2.650 1.00 65.12 C ATOM 0 H LEU A 130 -0.206 4.301 -2.750 1.00 12.42 H new ATOM 0 HA LEU A 130 -1.750 3.621 -5.191 1.00 53.40 H new ATOM 0 HB2 LEU A 130 -2.246 6.066 -3.468 1.00 73.12 H new ATOM 0 HB3 LEU A 130 -3.306 5.332 -4.656 1.00 73.12 H new ATOM 0 HG LEU A 130 -3.301 3.290 -2.964 1.00 62.21 H new ATOM 0 HD11 LEU A 130 -3.217 4.014 -0.586 1.00 4.52 H new ATOM 0 HD12 LEU A 130 -1.642 4.178 -1.399 1.00 4.52 H new ATOM 0 HD13 LEU A 130 -2.648 5.617 -1.110 1.00 4.52 H new ATOM 0 HD21 LEU A 130 -5.317 4.195 -1.844 1.00 65.12 H new ATOM 0 HD22 LEU A 130 -4.916 5.815 -2.461 1.00 65.12 H new ATOM 0 HD23 LEU A 130 -5.317 4.504 -3.596 1.00 65.12 H new ATOM 2041 N GLU A 131 -0.682 5.494 -6.556 1.00 54.35 N ATOM 2042 CA GLU A 131 -0.053 6.516 -7.405 1.00 15.04 C ATOM 2043 C GLU A 131 -1.187 7.264 -8.140 1.00 12.12 C ATOM 2044 O GLU A 131 -1.615 6.830 -9.219 1.00 74.11 O ATOM 2045 CB GLU A 131 0.941 5.857 -8.398 1.00 31.54 C ATOM 2046 CG GLU A 131 2.161 5.168 -7.742 1.00 32.40 C ATOM 2047 CD GLU A 131 2.941 4.306 -8.740 1.00 13.30 C ATOM 2048 OE1 GLU A 131 2.475 3.195 -9.061 1.00 52.13 O ATOM 2049 OE2 GLU A 131 3.992 4.749 -9.244 1.00 74.30 O ATOM 0 H GLU A 131 -1.289 4.859 -7.074 1.00 54.35 H new ATOM 0 HA GLU A 131 0.526 7.221 -6.808 1.00 15.04 H new ATOM 0 HB2 GLU A 131 0.402 5.119 -8.992 1.00 31.54 H new ATOM 0 HB3 GLU A 131 1.301 6.620 -9.088 1.00 31.54 H new ATOM 0 HG2 GLU A 131 2.823 5.926 -7.323 1.00 32.40 H new ATOM 0 HG3 GLU A 131 1.823 4.546 -6.913 1.00 32.40 H new ATOM 2056 N PRO A 132 -1.747 8.355 -7.520 1.00 51.51 N ATOM 2057 CA PRO A 132 -2.887 9.106 -8.098 1.00 53.11 C ATOM 2058 C PRO A 132 -2.520 9.857 -9.403 1.00 23.15 C ATOM 2059 O PRO A 132 -1.344 10.142 -9.677 1.00 40.30 O ATOM 2060 CB PRO A 132 -3.286 10.079 -6.951 1.00 15.51 C ATOM 2061 CG PRO A 132 -2.035 10.262 -6.147 1.00 52.33 C ATOM 2062 CD PRO A 132 -1.326 8.929 -6.208 1.00 62.54 C ATOM 0 HA PRO A 132 -3.701 8.451 -8.408 1.00 53.11 H new ATOM 0 HB2 PRO A 132 -3.644 11.030 -7.346 1.00 15.51 H new ATOM 0 HB3 PRO A 132 -4.089 9.664 -6.342 1.00 15.51 H new ATOM 0 HG2 PRO A 132 -1.414 11.057 -6.560 1.00 52.33 H new ATOM 0 HG3 PRO A 132 -2.265 10.539 -5.118 1.00 52.33 H new ATOM 0 HD2 PRO A 132 -0.244 9.050 -6.154 1.00 62.54 H new ATOM 0 HD3 PRO A 132 -1.617 8.284 -5.379 1.00 62.54 H new ATOM 2070 N ASP A 133 -3.571 10.205 -10.163 1.00 74.42 N ATOM 2071 CA ASP A 133 -3.482 10.878 -11.479 1.00 2.31 C ATOM 2072 C ASP A 133 -2.997 12.341 -11.326 1.00 74.35 C ATOM 2073 O ASP A 133 -2.466 12.952 -12.266 1.00 32.20 O ATOM 2074 CB ASP A 133 -4.888 10.821 -12.144 1.00 53.04 C ATOM 2075 CG ASP A 133 -4.978 11.569 -13.483 1.00 44.31 C ATOM 2076 OD1 ASP A 133 -4.547 11.009 -14.514 1.00 73.24 O ATOM 2077 OD2 ASP A 133 -5.475 12.724 -13.513 1.00 44.33 O ATOM 0 H ASP A 133 -4.533 10.024 -9.876 1.00 74.42 H new ATOM 0 HA ASP A 133 -2.752 10.369 -12.108 1.00 2.31 H new ATOM 0 HB2 ASP A 133 -5.161 9.778 -12.304 1.00 53.04 H new ATOM 0 HB3 ASP A 133 -5.621 11.241 -11.455 1.00 53.04 H new ATOM 2082 N ARG A 134 -3.155 12.851 -10.104 1.00 75.43 N ATOM 2083 CA ARG A 134 -2.769 14.204 -9.688 1.00 64.22 C ATOM 2084 C ARG A 134 -2.515 14.168 -8.176 1.00 22.51 C ATOM 2085 O ARG A 134 -2.917 13.212 -7.501 1.00 61.41 O ATOM 2086 CB ARG A 134 -3.865 15.230 -10.076 1.00 60.33 C ATOM 2087 CG ARG A 134 -5.304 14.889 -9.565 1.00 41.22 C ATOM 2088 CD ARG A 134 -5.832 15.861 -8.490 1.00 23.05 C ATOM 2089 NE ARG A 134 -7.202 15.538 -8.068 1.00 74.03 N ATOM 2090 CZ ARG A 134 -8.316 15.753 -8.794 1.00 14.31 C ATOM 2091 NH1 ARG A 134 -8.266 16.296 -10.012 1.00 64.02 N ATOM 2092 NH2 ARG A 134 -9.487 15.444 -8.280 1.00 14.53 N ATOM 0 H ARG A 134 -3.572 12.313 -9.345 1.00 75.43 H new ATOM 0 HA ARG A 134 -1.861 14.525 -10.199 1.00 64.22 H new ATOM 0 HB2 ARG A 134 -3.580 16.207 -9.687 1.00 60.33 H new ATOM 0 HB3 ARG A 134 -3.893 15.315 -11.162 1.00 60.33 H new ATOM 0 HG2 ARG A 134 -5.990 14.892 -10.412 1.00 41.22 H new ATOM 0 HG3 ARG A 134 -5.304 13.878 -9.158 1.00 41.22 H new ATOM 0 HD2 ARG A 134 -5.172 15.834 -7.623 1.00 23.05 H new ATOM 0 HD3 ARG A 134 -5.805 16.879 -8.879 1.00 23.05 H new ATOM 0 HE ARG A 134 -7.319 15.115 -7.147 1.00 74.03 H new ATOM 0 HH11 ARG A 134 -7.367 16.560 -10.416 1.00 64.02 H new ATOM 0 HH12 ARG A 134 -9.126 16.447 -10.539 1.00 64.02 H new ATOM 0 HH21 ARG A 134 -9.544 15.047 -7.342 1.00 14.53 H new ATOM 0 HH22 ARG A 134 -10.338 15.602 -8.819 1.00 14.53 H new ATOM 2106 N ASP A 135 -1.859 15.199 -7.635 1.00 72.33 N ATOM 2107 CA ASP A 135 -1.457 15.197 -6.216 1.00 41.21 C ATOM 2108 C ASP A 135 -2.668 15.581 -5.350 1.00 40.45 C ATOM 2109 O ASP A 135 -3.455 16.451 -5.736 1.00 23.00 O ATOM 2110 CB ASP A 135 -0.258 16.141 -5.955 1.00 44.21 C ATOM 2111 CG ASP A 135 0.473 15.778 -4.650 1.00 51.15 C ATOM 2112 OD1 ASP A 135 0.064 16.230 -3.556 1.00 53.43 O ATOM 2113 OD2 ASP A 135 1.444 14.992 -4.718 1.00 11.02 O ATOM 0 H ASP A 135 -1.595 16.040 -8.148 1.00 72.33 H new ATOM 0 HA ASP A 135 -1.124 14.194 -5.948 1.00 41.21 H new ATOM 0 HB2 ASP A 135 0.439 16.085 -6.791 1.00 44.21 H new ATOM 0 HB3 ASP A 135 -0.610 17.171 -5.902 1.00 44.21 H new ATOM 2118 N LEU A 136 -2.794 14.946 -4.176 1.00 20.25 N ATOM 2119 CA LEU A 136 -4.032 14.988 -3.380 1.00 72.40 C ATOM 2120 C LEU A 136 -4.063 16.191 -2.428 1.00 44.43 C ATOM 2121 O LEU A 136 -3.075 16.505 -1.750 1.00 22.24 O ATOM 2122 CB LEU A 136 -4.215 13.663 -2.608 1.00 72.33 C ATOM 2123 CG LEU A 136 -4.339 12.377 -3.485 1.00 4.12 C ATOM 2124 CD1 LEU A 136 -4.591 11.144 -2.611 1.00 64.32 C ATOM 2125 CD2 LEU A 136 -5.426 12.523 -4.573 1.00 64.42 C ATOM 0 H LEU A 136 -2.048 14.393 -3.753 1.00 20.25 H new ATOM 0 HA LEU A 136 -4.867 15.110 -4.070 1.00 72.40 H new ATOM 0 HB2 LEU A 136 -3.369 13.539 -1.932 1.00 72.33 H new ATOM 0 HB3 LEU A 136 -5.108 13.745 -1.989 1.00 72.33 H new ATOM 0 HG LEU A 136 -3.388 12.240 -4.001 1.00 4.12 H new ATOM 0 HD11 LEU A 136 -4.674 10.260 -3.244 1.00 64.32 H new ATOM 0 HD12 LEU A 136 -3.762 11.016 -1.915 1.00 64.32 H new ATOM 0 HD13 LEU A 136 -5.517 11.278 -2.051 1.00 64.32 H new ATOM 0 HD21 LEU A 136 -5.479 11.606 -5.160 1.00 64.42 H new ATOM 0 HD22 LEU A 136 -6.391 12.708 -4.101 1.00 64.42 H new ATOM 0 HD23 LEU A 136 -5.176 13.358 -5.227 1.00 64.42 H new ATOM 2137 N SER A 137 -5.224 16.849 -2.401 1.00 53.05 N ATOM 2138 CA SER A 137 -5.491 18.039 -1.587 1.00 35.33 C ATOM 2139 C SER A 137 -6.515 17.726 -0.472 1.00 31.54 C ATOM 2140 O SER A 137 -7.077 16.620 -0.413 1.00 53.43 O ATOM 2141 CB SER A 137 -5.998 19.157 -2.520 1.00 53.02 C ATOM 2142 OG SER A 137 -5.024 19.477 -3.506 1.00 3.12 O ATOM 0 H SER A 137 -6.027 16.562 -2.960 1.00 53.05 H new ATOM 0 HA SER A 137 -4.577 18.365 -1.091 1.00 35.33 H new ATOM 0 HB2 SER A 137 -6.921 18.840 -3.005 1.00 53.02 H new ATOM 0 HB3 SER A 137 -6.234 20.046 -1.934 1.00 53.02 H new ATOM 0 HG SER A 137 -5.368 20.187 -4.087 1.00 3.12 H new ATOM 2148 N ASP A 138 -6.730 18.701 0.427 1.00 41.33 N ATOM 2149 CA ASP A 138 -7.666 18.563 1.554 1.00 74.21 C ATOM 2150 C ASP A 138 -9.127 18.675 1.052 1.00 30.14 C ATOM 2151 O ASP A 138 -9.570 19.743 0.617 1.00 24.22 O ATOM 2152 CB ASP A 138 -7.335 19.606 2.662 1.00 61.34 C ATOM 2153 CG ASP A 138 -7.411 21.074 2.204 1.00 70.35 C ATOM 2154 OD1 ASP A 138 -6.547 21.503 1.410 1.00 52.42 O ATOM 2155 OD2 ASP A 138 -8.343 21.800 2.617 1.00 64.20 O ATOM 0 H ASP A 138 -6.260 19.606 0.393 1.00 41.33 H new ATOM 0 HA ASP A 138 -7.554 17.575 2.001 1.00 74.21 H new ATOM 0 HB2 ASP A 138 -8.024 19.463 3.495 1.00 61.34 H new ATOM 0 HB3 ASP A 138 -6.332 19.409 3.040 1.00 61.34 H new ATOM 2160 N GLY A 139 -9.844 17.535 1.073 1.00 63.10 N ATOM 2161 CA GLY A 139 -11.212 17.443 0.537 1.00 74.40 C ATOM 2162 C GLY A 139 -11.262 16.803 -0.847 1.00 44.45 C ATOM 2163 O GLY A 139 -12.349 16.642 -1.416 1.00 62.44 O ATOM 0 H GLY A 139 -9.493 16.659 1.459 1.00 63.10 H new ATOM 0 HA2 GLY A 139 -11.828 16.862 1.223 1.00 74.40 H new ATOM 0 HA3 GLY A 139 -11.646 18.442 0.487 1.00 74.40 H new ATOM 2167 N ASP A 140 -10.078 16.439 -1.385 1.00 62.35 N ATOM 2168 CA ASP A 140 -9.949 15.705 -2.672 1.00 45.35 C ATOM 2169 C ASP A 140 -10.363 14.234 -2.442 1.00 41.41 C ATOM 2170 O ASP A 140 -10.526 13.824 -1.300 1.00 2.13 O ATOM 2171 CB ASP A 140 -8.475 15.813 -3.188 1.00 24.14 C ATOM 2172 CG ASP A 140 -8.223 15.415 -4.658 1.00 43.13 C ATOM 2173 OD1 ASP A 140 -9.185 15.162 -5.422 1.00 72.24 O ATOM 2174 OD2 ASP A 140 -7.041 15.385 -5.064 1.00 22.24 O ATOM 0 H ASP A 140 -9.182 16.644 -0.943 1.00 62.35 H new ATOM 0 HA ASP A 140 -10.600 16.137 -3.432 1.00 45.35 H new ATOM 0 HB2 ASP A 140 -8.142 16.842 -3.052 1.00 24.14 H new ATOM 0 HB3 ASP A 140 -7.846 15.188 -2.554 1.00 24.14 H new ATOM 2179 N GLU A 141 -10.590 13.455 -3.508 1.00 12.20 N ATOM 2180 CA GLU A 141 -10.921 12.012 -3.391 1.00 73.52 C ATOM 2181 C GLU A 141 -9.751 11.132 -3.869 1.00 61.22 C ATOM 2182 O GLU A 141 -8.796 11.622 -4.482 1.00 14.34 O ATOM 2183 CB GLU A 141 -12.214 11.703 -4.182 1.00 35.23 C ATOM 2184 CG GLU A 141 -13.454 12.436 -3.644 1.00 31.12 C ATOM 2185 CD GLU A 141 -14.724 12.111 -4.439 1.00 64.41 C ATOM 2186 OE1 GLU A 141 -15.329 11.038 -4.204 1.00 55.32 O ATOM 2187 OE2 GLU A 141 -15.105 12.910 -5.326 1.00 55.50 O ATOM 0 H GLU A 141 -10.552 13.794 -4.469 1.00 12.20 H new ATOM 0 HA GLU A 141 -11.092 11.778 -2.340 1.00 73.52 H new ATOM 0 HB2 GLU A 141 -12.065 11.977 -5.227 1.00 35.23 H new ATOM 0 HB3 GLU A 141 -12.398 10.629 -4.157 1.00 35.23 H new ATOM 0 HG2 GLU A 141 -13.605 12.166 -2.599 1.00 31.12 H new ATOM 0 HG3 GLU A 141 -13.277 13.511 -3.673 1.00 31.12 H new ATOM 2194 N ILE A 142 -9.847 9.830 -3.556 1.00 3.12 N ATOM 2195 CA ILE A 142 -8.847 8.804 -3.915 1.00 54.41 C ATOM 2196 C ILE A 142 -9.542 7.420 -3.915 1.00 60.42 C ATOM 2197 O ILE A 142 -10.564 7.228 -3.241 1.00 20.42 O ATOM 2198 CB ILE A 142 -7.626 8.830 -2.906 1.00 60.52 C ATOM 2199 CG1 ILE A 142 -6.478 7.834 -3.312 1.00 14.01 C ATOM 2200 CG2 ILE A 142 -8.106 8.582 -1.451 1.00 70.05 C ATOM 2201 CD1 ILE A 142 -5.808 8.108 -4.664 1.00 45.51 C ATOM 0 H ILE A 142 -10.638 9.450 -3.035 1.00 3.12 H new ATOM 0 HA ILE A 142 -8.447 9.010 -4.908 1.00 54.41 H new ATOM 0 HB ILE A 142 -7.194 9.829 -2.958 1.00 60.52 H new ATOM 0 HG12 ILE A 142 -5.712 7.856 -2.537 1.00 14.01 H new ATOM 0 HG13 ILE A 142 -6.887 6.824 -3.328 1.00 14.01 H new ATOM 0 HG21 ILE A 142 -7.250 8.604 -0.777 1.00 70.05 H new ATOM 0 HG22 ILE A 142 -8.814 9.359 -1.164 1.00 70.05 H new ATOM 0 HG23 ILE A 142 -8.591 7.608 -1.389 1.00 70.05 H new ATOM 0 HD11 ILE A 142 -5.033 7.363 -4.844 1.00 45.51 H new ATOM 0 HD12 ILE A 142 -6.554 8.054 -5.457 1.00 45.51 H new ATOM 0 HD13 ILE A 142 -5.361 9.102 -4.654 1.00 45.51 H new ATOM 2213 N THR A 143 -8.996 6.477 -4.689 1.00 73.43 N ATOM 2214 CA THR A 143 -9.553 5.128 -4.858 1.00 31.04 C ATOM 2215 C THR A 143 -8.666 4.090 -4.125 1.00 32.23 C ATOM 2216 O THR A 143 -7.462 4.029 -4.366 1.00 63.11 O ATOM 2217 CB THR A 143 -9.650 4.816 -6.387 1.00 51.11 C ATOM 2218 OG1 THR A 143 -10.406 5.855 -7.031 1.00 64.44 O ATOM 2219 CG2 THR A 143 -10.308 3.461 -6.669 1.00 11.13 C ATOM 0 H THR A 143 -8.142 6.630 -5.225 1.00 73.43 H new ATOM 0 HA THR A 143 -10.550 5.073 -4.421 1.00 31.04 H new ATOM 0 HB THR A 143 -8.634 4.773 -6.780 1.00 51.11 H new ATOM 0 HG1 THR A 143 -10.469 5.667 -7.991 1.00 64.44 H new ATOM 0 HG21 THR A 143 -10.350 3.294 -7.745 1.00 11.13 H new ATOM 0 HG22 THR A 143 -9.724 2.668 -6.202 1.00 11.13 H new ATOM 0 HG23 THR A 143 -11.319 3.455 -6.261 1.00 11.13 H new ATOM 2227 N LEU A 144 -9.285 3.280 -3.238 1.00 32.42 N ATOM 2228 CA LEU A 144 -8.598 2.310 -2.352 1.00 21.23 C ATOM 2229 C LEU A 144 -9.045 0.893 -2.746 1.00 23.02 C ATOM 2230 O LEU A 144 -10.082 0.410 -2.273 1.00 51.43 O ATOM 2231 CB LEU A 144 -8.961 2.564 -0.833 1.00 40.34 C ATOM 2232 CG LEU A 144 -8.117 3.604 -0.032 1.00 31.25 C ATOM 2233 CD1 LEU A 144 -6.672 3.109 0.194 1.00 64.55 C ATOM 2234 CD2 LEU A 144 -8.155 4.989 -0.696 1.00 74.31 C ATOM 0 H LEU A 144 -10.297 3.281 -3.114 1.00 32.42 H new ATOM 0 HA LEU A 144 -7.521 2.427 -2.468 1.00 21.23 H new ATOM 0 HB2 LEU A 144 -10.004 2.878 -0.789 1.00 40.34 H new ATOM 0 HB3 LEU A 144 -8.893 1.609 -0.311 1.00 40.34 H new ATOM 0 HG LEU A 144 -8.573 3.709 0.952 1.00 31.25 H new ATOM 0 HD11 LEU A 144 -6.114 3.859 0.755 1.00 64.55 H new ATOM 0 HD12 LEU A 144 -6.691 2.175 0.756 1.00 64.55 H new ATOM 0 HD13 LEU A 144 -6.189 2.943 -0.769 1.00 64.55 H new ATOM 0 HD21 LEU A 144 -7.557 5.689 -0.112 1.00 74.31 H new ATOM 0 HD22 LEU A 144 -7.750 4.920 -1.706 1.00 74.31 H new ATOM 0 HD23 LEU A 144 -9.185 5.342 -0.742 1.00 74.31 H new ATOM 2246 N ASP A 145 -8.291 0.243 -3.636 1.00 74.40 N ATOM 2247 CA ASP A 145 -8.538 -1.160 -4.019 1.00 52.32 C ATOM 2248 C ASP A 145 -7.413 -2.053 -3.464 1.00 2.04 C ATOM 2249 O ASP A 145 -6.300 -2.106 -3.983 1.00 13.42 O ATOM 2250 CB ASP A 145 -8.764 -1.306 -5.550 1.00 73.43 C ATOM 2251 CG ASP A 145 -7.659 -0.794 -6.464 1.00 63.12 C ATOM 2252 OD1 ASP A 145 -7.307 0.400 -6.375 1.00 74.12 O ATOM 2253 OD2 ASP A 145 -7.182 -1.577 -7.311 1.00 22.31 O ATOM 0 H ASP A 145 -7.495 0.667 -4.112 1.00 74.40 H new ATOM 0 HA ASP A 145 -9.469 -1.503 -3.568 1.00 52.32 H new ATOM 0 HB2 ASP A 145 -8.923 -2.362 -5.770 1.00 73.43 H new ATOM 0 HB3 ASP A 145 -9.686 -0.784 -5.808 1.00 73.43 H new ATOM 2258 N PHE A 146 -7.739 -2.711 -2.339 1.00 24.21 N ATOM 2259 CA PHE A 146 -6.784 -3.495 -1.523 1.00 0.14 C ATOM 2260 C PHE A 146 -6.372 -4.829 -2.180 1.00 71.43 C ATOM 2261 O PHE A 146 -5.659 -5.622 -1.558 1.00 14.12 O ATOM 2262 CB PHE A 146 -7.384 -3.759 -0.120 1.00 25.11 C ATOM 2263 CG PHE A 146 -8.104 -2.562 0.481 1.00 70.11 C ATOM 2264 CD1 PHE A 146 -7.397 -1.442 0.913 1.00 10.40 C ATOM 2265 CD2 PHE A 146 -9.496 -2.545 0.572 1.00 72.31 C ATOM 2266 CE1 PHE A 146 -8.063 -0.354 1.429 1.00 3.02 C ATOM 2267 CE2 PHE A 146 -10.152 -1.454 1.081 1.00 3.32 C ATOM 2268 CZ PHE A 146 -9.439 -0.358 1.507 1.00 1.25 C ATOM 0 H PHE A 146 -8.687 -2.716 -1.961 1.00 24.21 H new ATOM 0 HA PHE A 146 -5.877 -2.896 -1.439 1.00 0.14 H new ATOM 0 HB2 PHE A 146 -8.082 -4.594 -0.186 1.00 25.11 H new ATOM 0 HB3 PHE A 146 -6.584 -4.065 0.554 1.00 25.11 H new ATOM 0 HD1 PHE A 146 -6.319 -1.428 0.842 1.00 10.40 H new ATOM 0 HD2 PHE A 146 -10.063 -3.401 0.238 1.00 72.31 H new ATOM 0 HE1 PHE A 146 -7.506 0.505 1.774 1.00 3.02 H new ATOM 0 HE2 PHE A 146 -11.230 -1.455 1.147 1.00 3.32 H new ATOM 0 HZ PHE A 146 -9.959 0.502 1.904 1.00 1.25 H new ATOM 2278 N ASN A 147 -6.830 -5.080 -3.422 1.00 11.20 N ATOM 2279 CA ASN A 147 -6.323 -6.197 -4.236 1.00 32.12 C ATOM 2280 C ASN A 147 -4.842 -5.955 -4.585 1.00 0.42 C ATOM 2281 O ASN A 147 -4.062 -6.890 -4.692 1.00 53.31 O ATOM 2282 CB ASN A 147 -7.167 -6.391 -5.521 1.00 33.42 C ATOM 2283 CG ASN A 147 -7.117 -5.208 -6.486 1.00 33.23 C ATOM 2284 OD1 ASN A 147 -6.251 -5.133 -7.347 1.00 1.40 O ATOM 2285 ND2 ASN A 147 -8.073 -4.314 -6.396 1.00 32.41 N ATOM 0 H ASN A 147 -7.550 -4.523 -3.882 1.00 11.20 H new ATOM 0 HA ASN A 147 -6.407 -7.114 -3.653 1.00 32.12 H new ATOM 0 HB2 ASN A 147 -6.819 -7.284 -6.040 1.00 33.42 H new ATOM 0 HB3 ASN A 147 -8.204 -6.571 -5.238 1.00 33.42 H new ATOM 0 HD21 ASN A 147 -8.106 -3.534 -7.053 1.00 32.41 H new ATOM 0 HD22 ASN A 147 -8.784 -4.399 -5.669 1.00 32.41 H new ATOM 2292 N LEU A 148 -4.468 -4.665 -4.689 1.00 63.05 N ATOM 2293 CA LEU A 148 -3.099 -4.223 -5.024 1.00 53.14 C ATOM 2294 C LEU A 148 -2.104 -4.457 -3.873 1.00 13.11 C ATOM 2295 O LEU A 148 -0.897 -4.275 -4.062 1.00 41.35 O ATOM 2296 CB LEU A 148 -3.103 -2.713 -5.376 1.00 40.11 C ATOM 2297 CG LEU A 148 -4.121 -2.278 -6.460 1.00 75.41 C ATOM 2298 CD1 LEU A 148 -4.091 -0.752 -6.697 1.00 42.23 C ATOM 2299 CD2 LEU A 148 -3.943 -3.080 -7.769 1.00 70.25 C ATOM 0 H LEU A 148 -5.115 -3.891 -4.541 1.00 63.05 H new ATOM 0 HA LEU A 148 -2.776 -4.820 -5.877 1.00 53.14 H new ATOM 0 HB2 LEU A 148 -3.305 -2.147 -4.466 1.00 40.11 H new ATOM 0 HB3 LEU A 148 -2.104 -2.434 -5.710 1.00 40.11 H new ATOM 0 HG LEU A 148 -5.116 -2.515 -6.082 1.00 75.41 H new ATOM 0 HD11 LEU A 148 -4.819 -0.489 -7.464 1.00 42.23 H new ATOM 0 HD12 LEU A 148 -4.338 -0.235 -5.770 1.00 42.23 H new ATOM 0 HD13 LEU A 148 -3.095 -0.454 -7.025 1.00 42.23 H new ATOM 0 HD21 LEU A 148 -4.675 -2.745 -8.503 1.00 70.25 H new ATOM 0 HD22 LEU A 148 -2.938 -2.920 -8.160 1.00 70.25 H new ATOM 0 HD23 LEU A 148 -4.090 -4.141 -7.568 1.00 70.25 H new ATOM 2311 N ALA A 149 -2.619 -4.859 -2.690 1.00 53.22 N ATOM 2312 CA ALA A 149 -1.825 -4.930 -1.459 1.00 11.13 C ATOM 2313 C ALA A 149 -0.750 -6.007 -1.553 1.00 73.34 C ATOM 2314 O ALA A 149 -1.037 -7.168 -1.851 1.00 45.50 O ATOM 2315 CB ALA A 149 -2.719 -5.182 -0.244 1.00 42.23 C ATOM 0 H ALA A 149 -3.592 -5.140 -2.569 1.00 53.22 H new ATOM 0 HA ALA A 149 -1.332 -3.966 -1.334 1.00 11.13 H new ATOM 0 HB1 ALA A 149 -2.105 -5.230 0.656 1.00 42.23 H new ATOM 0 HB2 ALA A 149 -3.440 -4.370 -0.148 1.00 42.23 H new ATOM 0 HB3 ALA A 149 -3.250 -6.125 -0.372 1.00 42.23 H new ATOM 2321 N TYR A 150 0.466 -5.598 -1.220 1.00 3.23 N ATOM 2322 CA TYR A 150 1.686 -6.359 -1.482 1.00 52.14 C ATOM 2323 C TYR A 150 2.089 -7.127 -0.230 1.00 50.44 C ATOM 2324 O TYR A 150 1.770 -6.707 0.899 1.00 25.32 O ATOM 2325 CB TYR A 150 2.833 -5.395 -1.888 1.00 13.13 C ATOM 2326 CG TYR A 150 2.396 -4.239 -2.803 1.00 32.14 C ATOM 2327 CD1 TYR A 150 1.959 -3.023 -2.268 1.00 61.22 C ATOM 2328 CD2 TYR A 150 2.419 -4.358 -4.180 1.00 34.31 C ATOM 2329 CE1 TYR A 150 1.566 -1.985 -3.078 1.00 24.35 C ATOM 2330 CE2 TYR A 150 2.028 -3.317 -4.989 1.00 61.20 C ATOM 2331 CZ TYR A 150 1.604 -2.133 -4.437 1.00 41.15 C ATOM 2332 OH TYR A 150 1.202 -1.104 -5.257 1.00 43.43 O ATOM 0 H TYR A 150 0.639 -4.709 -0.750 1.00 3.23 H new ATOM 0 HA TYR A 150 1.500 -7.060 -2.296 1.00 52.14 H new ATOM 0 HB2 TYR A 150 3.279 -4.979 -0.984 1.00 13.13 H new ATOM 0 HB3 TYR A 150 3.611 -5.968 -2.393 1.00 13.13 H new ATOM 0 HD1 TYR A 150 1.930 -2.897 -1.196 1.00 61.22 H new ATOM 0 HD2 TYR A 150 2.749 -5.284 -4.628 1.00 34.31 H new ATOM 0 HE1 TYR A 150 1.228 -1.056 -2.643 1.00 24.35 H new ATOM 0 HE2 TYR A 150 2.054 -3.431 -6.063 1.00 61.20 H new ATOM 0 HH TYR A 150 1.691 -1.151 -6.105 1.00 43.43 H new ATOM 2342 N SER A 151 2.779 -8.247 -0.439 1.00 43.11 N ATOM 2343 CA SER A 151 3.472 -8.953 0.628 1.00 4.24 C ATOM 2344 C SER A 151 4.636 -8.055 1.162 1.00 40.55 C ATOM 2345 O SER A 151 5.478 -7.603 0.362 1.00 2.32 O ATOM 2346 CB SER A 151 3.981 -10.304 0.084 1.00 3.31 C ATOM 2347 OG SER A 151 4.495 -11.116 1.116 1.00 53.32 O ATOM 0 H SER A 151 2.871 -8.688 -1.354 1.00 43.11 H new ATOM 0 HA SER A 151 2.802 -9.159 1.463 1.00 4.24 H new ATOM 0 HB2 SER A 151 3.166 -10.825 -0.419 1.00 3.31 H new ATOM 0 HB3 SER A 151 4.756 -10.128 -0.662 1.00 3.31 H new ATOM 0 HG SER A 151 4.153 -10.803 1.979 1.00 53.32 H new ATOM 2353 N PRO A 152 4.681 -7.757 2.508 1.00 75.11 N ATOM 2354 CA PRO A 152 5.627 -6.773 3.091 1.00 1.23 C ATOM 2355 C PRO A 152 7.087 -7.262 3.066 1.00 2.22 C ATOM 2356 O PRO A 152 7.360 -8.417 3.442 1.00 21.11 O ATOM 2357 CB PRO A 152 5.112 -6.574 4.553 1.00 64.25 C ATOM 2358 CG PRO A 152 3.785 -7.285 4.611 1.00 2.51 C ATOM 2359 CD PRO A 152 3.851 -8.372 3.571 1.00 21.55 C ATOM 0 HA PRO A 152 5.647 -5.846 2.519 1.00 1.23 H new ATOM 0 HB2 PRO A 152 5.813 -6.991 5.276 1.00 64.25 H new ATOM 0 HB3 PRO A 152 5.001 -5.516 4.790 1.00 64.25 H new ATOM 0 HG2 PRO A 152 3.609 -7.703 5.602 1.00 2.51 H new ATOM 0 HG3 PRO A 152 2.965 -6.597 4.405 1.00 2.51 H new ATOM 0 HD2 PRO A 152 4.306 -9.281 3.964 1.00 21.55 H new ATOM 0 HD3 PRO A 152 2.861 -8.643 3.205 1.00 21.55 H new ATOM 2367 N PHE A 153 7.998 -6.387 2.562 1.00 65.22 N ATOM 2368 CA PHE A 153 9.460 -6.577 2.603 1.00 25.23 C ATOM 2369 C PHE A 153 9.942 -7.118 3.968 1.00 53.15 C ATOM 2370 O PHE A 153 10.578 -8.174 4.047 1.00 43.20 O ATOM 2371 CB PHE A 153 10.196 -5.220 2.339 1.00 75.32 C ATOM 2372 CG PHE A 153 9.871 -4.473 1.036 1.00 62.45 C ATOM 2373 CD1 PHE A 153 10.574 -4.742 -0.140 1.00 12.04 C ATOM 2374 CD2 PHE A 153 8.898 -3.469 0.997 1.00 52.15 C ATOM 2375 CE1 PHE A 153 10.312 -4.047 -1.308 1.00 15.02 C ATOM 2376 CE2 PHE A 153 8.643 -2.769 -0.170 1.00 3.10 C ATOM 2377 CZ PHE A 153 9.346 -3.062 -1.322 1.00 44.22 C ATOM 0 H PHE A 153 7.724 -5.515 2.109 1.00 65.22 H new ATOM 0 HA PHE A 153 9.696 -7.305 1.827 1.00 25.23 H new ATOM 0 HB2 PHE A 153 9.977 -4.552 3.172 1.00 75.32 H new ATOM 0 HB3 PHE A 153 11.269 -5.411 2.357 1.00 75.32 H new ATOM 0 HD1 PHE A 153 11.337 -5.507 -0.138 1.00 12.04 H new ATOM 0 HD2 PHE A 153 8.337 -3.236 1.890 1.00 52.15 H new ATOM 0 HE1 PHE A 153 10.863 -4.276 -2.208 1.00 15.02 H new ATOM 0 HE2 PHE A 153 7.893 -1.992 -0.179 1.00 3.10 H new ATOM 0 HZ PHE A 153 9.140 -2.520 -2.233 1.00 44.22 H new ATOM 2387 N CYS A 154 9.592 -6.369 5.031 1.00 45.24 N ATOM 2388 CA CYS A 154 10.123 -6.570 6.387 1.00 61.45 C ATOM 2389 C CYS A 154 9.556 -7.825 7.068 1.00 20.22 C ATOM 2390 O CYS A 154 10.301 -8.556 7.736 1.00 14.23 O ATOM 2391 CB CYS A 154 9.833 -5.320 7.223 1.00 64.23 C ATOM 2392 SG CYS A 154 10.485 -3.816 6.471 1.00 31.31 S ATOM 0 H CYS A 154 8.925 -5.600 4.969 1.00 45.24 H new ATOM 0 HA CYS A 154 11.198 -6.729 6.309 1.00 61.45 H new ATOM 0 HB2 CYS A 154 8.756 -5.218 7.356 1.00 64.23 H new ATOM 0 HB3 CYS A 154 10.266 -5.443 8.216 1.00 64.23 H new ATOM 0 HG CYS A 154 10.835 -2.981 7.404 1.00 31.31 H new ATOM 2398 N ALA A 155 8.235 -8.065 6.899 1.00 71.10 N ATOM 2399 CA ALA A 155 7.536 -9.209 7.523 1.00 4.13 C ATOM 2400 C ALA A 155 8.140 -10.559 7.085 1.00 40.13 C ATOM 2401 O ALA A 155 8.238 -11.499 7.879 1.00 74.52 O ATOM 2402 CB ALA A 155 6.029 -9.170 7.203 1.00 22.03 C ATOM 0 H ALA A 155 7.628 -7.475 6.330 1.00 71.10 H new ATOM 0 HA ALA A 155 7.670 -9.119 8.601 1.00 4.13 H new ATOM 0 HB1 ALA A 155 5.535 -10.021 7.672 1.00 22.03 H new ATOM 0 HB2 ALA A 155 5.599 -8.245 7.586 1.00 22.03 H new ATOM 0 HB3 ALA A 155 5.885 -9.217 6.124 1.00 22.03 H new ATOM 2408 N TYR A 156 8.528 -10.637 5.805 1.00 15.32 N ATOM 2409 CA TYR A 156 9.091 -11.863 5.200 1.00 71.10 C ATOM 2410 C TYR A 156 10.637 -11.906 5.280 1.00 64.40 C ATOM 2411 O TYR A 156 11.221 -12.992 5.242 1.00 42.02 O ATOM 2412 CB TYR A 156 8.573 -12.004 3.740 1.00 33.02 C ATOM 2413 CG TYR A 156 7.085 -12.405 3.653 1.00 71.23 C ATOM 2414 CD1 TYR A 156 6.085 -11.579 4.178 1.00 62.14 C ATOM 2415 CD2 TYR A 156 6.679 -13.610 3.057 1.00 61.01 C ATOM 2416 CE1 TYR A 156 4.752 -11.935 4.128 1.00 61.42 C ATOM 2417 CE2 TYR A 156 5.340 -13.965 3.002 1.00 14.43 C ATOM 2418 CZ TYR A 156 4.383 -13.122 3.535 1.00 13.03 C ATOM 2419 OH TYR A 156 3.051 -13.467 3.475 1.00 74.34 O ATOM 0 H TYR A 156 8.462 -9.854 5.155 1.00 15.32 H new ATOM 0 HA TYR A 156 8.747 -12.722 5.777 1.00 71.10 H new ATOM 0 HB2 TYR A 156 8.718 -11.058 3.218 1.00 33.02 H new ATOM 0 HB3 TYR A 156 9.174 -12.750 3.220 1.00 33.02 H new ATOM 0 HD1 TYR A 156 6.363 -10.640 4.633 1.00 62.14 H new ATOM 0 HD2 TYR A 156 7.422 -14.271 2.635 1.00 61.01 H new ATOM 0 HE1 TYR A 156 4.001 -11.285 4.552 1.00 61.42 H new ATOM 0 HE2 TYR A 156 5.045 -14.898 2.544 1.00 14.43 H new ATOM 0 HH TYR A 156 2.957 -14.333 3.025 1.00 74.34 H new ATOM 2429 N SER A 157 11.292 -10.735 5.410 1.00 2.23 N ATOM 2430 CA SER A 157 12.767 -10.645 5.538 1.00 0.24 C ATOM 2431 C SER A 157 13.162 -9.541 6.535 1.00 22.53 C ATOM 2432 O SER A 157 12.887 -8.361 6.306 1.00 31.03 O ATOM 2433 CB SER A 157 13.428 -10.410 4.156 1.00 61.15 C ATOM 2434 OG SER A 157 13.232 -11.525 3.302 1.00 41.22 O ATOM 0 H SER A 157 10.822 -9.830 5.430 1.00 2.23 H new ATOM 0 HA SER A 157 13.133 -11.595 5.926 1.00 0.24 H new ATOM 0 HB2 SER A 157 13.007 -9.516 3.695 1.00 61.15 H new ATOM 0 HB3 SER A 157 14.495 -10.230 4.285 1.00 61.15 H new ATOM 0 HG SER A 157 12.477 -11.349 2.703 1.00 41.22 H new ATOM 2440 N ASP A 158 13.855 -9.946 7.617 1.00 20.42 N ATOM 2441 CA ASP A 158 14.239 -9.055 8.739 1.00 65.12 C ATOM 2442 C ASP A 158 15.438 -8.168 8.368 1.00 1.10 C ATOM 2443 O ASP A 158 15.719 -7.186 9.063 1.00 32.31 O ATOM 2444 CB ASP A 158 14.560 -9.890 10.012 1.00 61.20 C ATOM 2445 CG ASP A 158 13.311 -10.537 10.631 1.00 53.23 C ATOM 2446 OD1 ASP A 158 12.772 -11.501 10.044 1.00 23.52 O ATOM 2447 OD2 ASP A 158 12.851 -10.080 11.697 1.00 74.04 O ATOM 0 H ASP A 158 14.169 -10.909 7.742 1.00 20.42 H new ATOM 0 HA ASP A 158 13.391 -8.402 8.948 1.00 65.12 H new ATOM 0 HB2 ASP A 158 15.279 -10.669 9.758 1.00 61.20 H new ATOM 0 HB3 ASP A 158 15.035 -9.247 10.753 1.00 61.20 H new ATOM 2452 N THR A 159 16.161 -8.543 7.282 1.00 61.25 N ATOM 2453 CA THR A 159 17.222 -7.707 6.677 1.00 50.30 C ATOM 2454 C THR A 159 16.650 -6.358 6.162 1.00 63.15 C ATOM 2455 O THR A 159 17.397 -5.396 5.958 1.00 15.11 O ATOM 2456 CB THR A 159 17.966 -8.486 5.527 1.00 1.15 C ATOM 2457 OG1 THR A 159 19.098 -7.743 5.054 1.00 14.21 O ATOM 2458 CG2 THR A 159 17.051 -8.820 4.335 1.00 50.42 C ATOM 0 H THR A 159 16.023 -9.433 6.804 1.00 61.25 H new ATOM 0 HA THR A 159 17.952 -7.480 7.454 1.00 50.30 H new ATOM 0 HB THR A 159 18.294 -9.427 5.970 1.00 1.15 H new ATOM 0 HG1 THR A 159 19.545 -8.246 4.342 1.00 14.21 H new ATOM 0 HG21 THR A 159 17.622 -9.356 3.577 1.00 50.42 H new ATOM 0 HG22 THR A 159 16.224 -9.443 4.675 1.00 50.42 H new ATOM 0 HG23 THR A 159 16.658 -7.897 3.908 1.00 50.42 H new ATOM 2466 N PHE A 160 15.321 -6.326 5.941 1.00 64.31 N ATOM 2467 CA PHE A 160 14.551 -5.091 5.755 1.00 21.34 C ATOM 2468 C PHE A 160 14.030 -4.679 7.147 1.00 12.51 C ATOM 2469 O PHE A 160 13.306 -5.457 7.787 1.00 41.43 O ATOM 2470 CB PHE A 160 13.365 -5.321 4.768 1.00 74.21 C ATOM 2471 CG PHE A 160 13.782 -5.631 3.327 1.00 42.52 C ATOM 2472 CD1 PHE A 160 14.270 -6.888 2.974 1.00 30.30 C ATOM 2473 CD2 PHE A 160 13.690 -4.662 2.325 1.00 44.13 C ATOM 2474 CE1 PHE A 160 14.655 -7.164 1.673 1.00 65.45 C ATOM 2475 CE2 PHE A 160 14.075 -4.937 1.027 1.00 65.54 C ATOM 2476 CZ PHE A 160 14.557 -6.190 0.701 1.00 63.30 C ATOM 0 H PHE A 160 14.750 -7.170 5.887 1.00 64.31 H new ATOM 0 HA PHE A 160 15.174 -4.307 5.324 1.00 21.34 H new ATOM 0 HB2 PHE A 160 12.755 -6.144 5.140 1.00 74.21 H new ATOM 0 HB3 PHE A 160 12.734 -4.432 4.766 1.00 74.21 H new ATOM 0 HD1 PHE A 160 14.349 -7.658 3.727 1.00 30.30 H new ATOM 0 HD2 PHE A 160 13.311 -3.681 2.569 1.00 44.13 H new ATOM 0 HE1 PHE A 160 15.033 -8.143 1.419 1.00 65.45 H new ATOM 0 HE2 PHE A 160 13.999 -4.173 0.268 1.00 65.54 H new ATOM 0 HZ PHE A 160 14.857 -6.407 -0.314 1.00 63.30 H new ATOM 2486 N SER A 161 14.445 -3.494 7.624 1.00 22.53 N ATOM 2487 CA SER A 161 14.084 -2.997 8.964 1.00 50.34 C ATOM 2488 C SER A 161 12.573 -2.655 9.016 1.00 1.14 C ATOM 2489 O SER A 161 12.049 -2.016 8.092 1.00 13.52 O ATOM 2490 CB SER A 161 14.960 -1.781 9.315 1.00 62.32 C ATOM 2491 OG SER A 161 14.734 -1.332 10.641 1.00 33.35 O ATOM 0 H SER A 161 15.038 -2.855 7.095 1.00 22.53 H new ATOM 0 HA SER A 161 14.269 -3.771 9.708 1.00 50.34 H new ATOM 0 HB2 SER A 161 16.011 -2.044 9.195 1.00 62.32 H new ATOM 0 HB3 SER A 161 14.752 -0.970 8.617 1.00 62.32 H new ATOM 0 HG SER A 161 14.042 -0.638 10.638 1.00 33.35 H new ATOM 2497 N CYS A 162 11.912 -3.035 10.130 1.00 10.24 N ATOM 2498 CA CYS A 162 10.438 -3.112 10.234 1.00 63.21 C ATOM 2499 C CYS A 162 9.782 -1.706 10.323 1.00 3.51 C ATOM 2500 O CYS A 162 10.361 -0.802 10.942 1.00 71.24 O ATOM 2501 CB CYS A 162 10.064 -3.967 11.475 1.00 32.20 C ATOM 2502 SG CYS A 162 8.291 -4.260 11.697 1.00 45.41 S ATOM 0 H CYS A 162 12.391 -3.300 10.991 1.00 10.24 H new ATOM 0 HA CYS A 162 10.054 -3.580 9.328 1.00 63.21 H new ATOM 0 HB2 CYS A 162 10.569 -4.930 11.400 1.00 32.20 H new ATOM 0 HB3 CYS A 162 10.450 -3.473 12.367 1.00 32.20 H new ATOM 0 HG CYS A 162 7.675 -3.122 11.820 1.00 45.41 H new ATOM 2508 N PRO A 163 8.569 -1.494 9.695 1.00 74.10 N ATOM 2509 CA PRO A 163 7.820 -0.227 9.817 1.00 53.55 C ATOM 2510 C PRO A 163 7.139 -0.081 11.192 1.00 62.44 C ATOM 2511 O PRO A 163 7.064 -1.040 11.972 1.00 33.04 O ATOM 2512 CB PRO A 163 6.769 -0.310 8.672 1.00 33.42 C ATOM 2513 CG PRO A 163 6.540 -1.772 8.454 1.00 1.21 C ATOM 2514 CD PRO A 163 7.850 -2.467 8.813 1.00 2.54 C ATOM 0 HA PRO A 163 8.471 0.644 9.738 1.00 53.55 H new ATOM 0 HB2 PRO A 163 5.844 0.196 8.949 1.00 33.42 H new ATOM 0 HB3 PRO A 163 7.136 0.170 7.765 1.00 33.42 H new ATOM 0 HG2 PRO A 163 5.723 -2.135 9.078 1.00 1.21 H new ATOM 0 HG3 PRO A 163 6.264 -1.973 7.419 1.00 1.21 H new ATOM 0 HD2 PRO A 163 7.669 -3.410 9.329 1.00 2.54 H new ATOM 0 HD3 PRO A 163 8.433 -2.698 7.921 1.00 2.54 H new ATOM 2522 N LEU A 164 6.670 1.137 11.476 1.00 34.12 N ATOM 2523 CA LEU A 164 5.856 1.456 12.658 1.00 23.10 C ATOM 2524 C LEU A 164 4.417 1.761 12.182 1.00 23.14 C ATOM 2525 O LEU A 164 4.106 2.912 11.838 1.00 42.33 O ATOM 2526 CB LEU A 164 6.464 2.662 13.448 1.00 11.50 C ATOM 2527 CG LEU A 164 5.635 3.184 14.679 1.00 13.32 C ATOM 2528 CD1 LEU A 164 5.449 2.091 15.751 1.00 44.41 C ATOM 2529 CD2 LEU A 164 6.254 4.469 15.271 1.00 24.32 C ATOM 0 H LEU A 164 6.847 1.946 10.881 1.00 34.12 H new ATOM 0 HA LEU A 164 5.843 0.608 13.343 1.00 23.10 H new ATOM 0 HB2 LEU A 164 7.454 2.374 13.801 1.00 11.50 H new ATOM 0 HB3 LEU A 164 6.602 3.491 12.753 1.00 11.50 H new ATOM 0 HG LEU A 164 4.640 3.441 14.314 1.00 13.32 H new ATOM 0 HD11 LEU A 164 4.871 2.493 16.584 1.00 44.41 H new ATOM 0 HD12 LEU A 164 4.919 1.243 15.318 1.00 44.41 H new ATOM 0 HD13 LEU A 164 6.425 1.764 16.110 1.00 44.41 H new ATOM 0 HD21 LEU A 164 5.657 4.803 16.120 1.00 24.32 H new ATOM 0 HD22 LEU A 164 7.272 4.263 15.602 1.00 24.32 H new ATOM 0 HD23 LEU A 164 6.271 5.249 14.510 1.00 24.32 H new ATOM 2541 N PRO A 165 3.527 0.722 12.085 1.00 35.01 N ATOM 2542 CA PRO A 165 2.121 0.931 11.700 1.00 34.24 C ATOM 2543 C PRO A 165 1.298 1.460 12.903 1.00 4.34 C ATOM 2544 O PRO A 165 1.504 1.004 14.038 1.00 45.24 O ATOM 2545 CB PRO A 165 1.671 -0.484 11.252 1.00 15.30 C ATOM 2546 CG PRO A 165 2.478 -1.423 12.105 1.00 23.12 C ATOM 2547 CD PRO A 165 3.810 -0.725 12.352 1.00 23.51 C ATOM 0 HA PRO A 165 1.981 1.677 10.917 1.00 34.24 H new ATOM 0 HB2 PRO A 165 0.602 -0.628 11.406 1.00 15.30 H new ATOM 0 HB3 PRO A 165 1.865 -0.645 10.192 1.00 15.30 H new ATOM 0 HG2 PRO A 165 1.967 -1.633 13.045 1.00 23.12 H new ATOM 0 HG3 PRO A 165 2.625 -2.379 11.602 1.00 23.12 H new ATOM 0 HD2 PRO A 165 4.157 -0.880 13.374 1.00 23.51 H new ATOM 0 HD3 PRO A 165 4.587 -1.107 11.690 1.00 23.51 H new ATOM 2555 N PRO A 166 0.387 2.462 12.690 1.00 13.55 N ATOM 2556 CA PRO A 166 -0.514 2.950 13.761 1.00 42.34 C ATOM 2557 C PRO A 166 -1.547 1.879 14.209 1.00 53.52 C ATOM 2558 O PRO A 166 -1.514 0.726 13.773 1.00 24.02 O ATOM 2559 CB PRO A 166 -1.196 4.194 13.119 1.00 54.22 C ATOM 2560 CG PRO A 166 -1.086 3.992 11.637 1.00 24.30 C ATOM 2561 CD PRO A 166 0.205 3.223 11.421 1.00 24.54 C ATOM 0 HA PRO A 166 0.023 3.188 14.679 1.00 42.34 H new ATOM 0 HB2 PRO A 166 -2.238 4.273 13.428 1.00 54.22 H new ATOM 0 HB3 PRO A 166 -0.702 5.115 13.427 1.00 54.22 H new ATOM 0 HG2 PRO A 166 -1.941 3.436 11.253 1.00 24.30 H new ATOM 0 HG3 PRO A 166 -1.065 4.947 11.112 1.00 24.30 H new ATOM 0 HD2 PRO A 166 0.133 2.556 10.562 1.00 24.54 H new ATOM 0 HD3 PRO A 166 1.043 3.894 11.234 1.00 24.54 H new ATOM 2569 N GLU A 167 -2.395 2.274 15.154 1.00 33.00 N ATOM 2570 CA GLU A 167 -3.552 1.474 15.610 1.00 22.40 C ATOM 2571 C GLU A 167 -4.805 1.798 14.763 1.00 55.01 C ATOM 2572 O GLU A 167 -5.691 0.957 14.599 1.00 44.11 O ATOM 2573 CB GLU A 167 -3.794 1.761 17.112 1.00 32.24 C ATOM 2574 CG GLU A 167 -2.558 1.479 17.994 1.00 43.03 C ATOM 2575 CD GLU A 167 -2.689 2.050 19.411 1.00 61.42 C ATOM 2576 OE1 GLU A 167 -2.415 3.257 19.593 1.00 52.42 O ATOM 2577 OE2 GLU A 167 -3.063 1.306 20.343 1.00 23.21 O ATOM 0 H GLU A 167 -2.306 3.168 15.637 1.00 33.00 H new ATOM 0 HA GLU A 167 -3.343 0.412 15.480 1.00 22.40 H new ATOM 0 HB2 GLU A 167 -4.088 2.804 17.233 1.00 32.24 H new ATOM 0 HB3 GLU A 167 -4.628 1.152 17.462 1.00 32.24 H new ATOM 0 HG2 GLU A 167 -2.401 0.402 18.055 1.00 43.03 H new ATOM 0 HG3 GLU A 167 -1.674 1.904 17.518 1.00 43.03 H new ATOM 2584 N SER A 168 -4.837 3.026 14.213 1.00 3.34 N ATOM 2585 CA SER A 168 -5.993 3.577 13.461 1.00 14.12 C ATOM 2586 C SER A 168 -6.221 2.877 12.091 1.00 50.35 C ATOM 2587 O SER A 168 -7.335 2.902 11.553 1.00 31.25 O ATOM 2588 CB SER A 168 -5.770 5.092 13.253 1.00 4.02 C ATOM 2589 OG SER A 168 -5.482 5.744 14.484 1.00 11.35 O ATOM 0 H SER A 168 -4.054 3.676 14.276 1.00 3.34 H new ATOM 0 HA SER A 168 -6.891 3.393 14.050 1.00 14.12 H new ATOM 0 HB2 SER A 168 -4.948 5.249 12.555 1.00 4.02 H new ATOM 0 HB3 SER A 168 -6.659 5.535 12.803 1.00 4.02 H new ATOM 0 HG SER A 168 -5.344 6.701 14.323 1.00 11.35 H new ATOM 2595 N ASN A 169 -5.169 2.221 11.566 1.00 44.32 N ATOM 2596 CA ASN A 169 -5.158 1.618 10.208 1.00 70.34 C ATOM 2597 C ASN A 169 -5.549 0.122 10.249 1.00 74.42 C ATOM 2598 O ASN A 169 -5.490 -0.569 9.222 1.00 43.31 O ATOM 2599 CB ASN A 169 -3.740 1.792 9.576 1.00 41.25 C ATOM 2600 CG ASN A 169 -2.636 0.994 10.294 1.00 11.43 C ATOM 2601 OD1 ASN A 169 -2.765 0.653 11.455 1.00 44.41 O ATOM 2602 ND2 ASN A 169 -1.516 0.752 9.634 1.00 12.11 N ATOM 0 H ASN A 169 -4.293 2.090 12.072 1.00 44.32 H new ATOM 0 HA ASN A 169 -5.898 2.132 9.595 1.00 70.34 H new ATOM 0 HB2 ASN A 169 -3.778 1.483 8.532 1.00 41.25 H new ATOM 0 HB3 ASN A 169 -3.476 2.849 9.586 1.00 41.25 H new ATOM 0 HD21 ASN A 169 -0.744 0.273 10.098 1.00 12.11 H new ATOM 0 HD22 ASN A 169 -1.424 1.044 8.661 1.00 12.11 H new ATOM 2609 N TRP A 170 -5.937 -0.369 11.442 1.00 65.13 N ATOM 2610 CA TRP A 170 -6.277 -1.787 11.657 1.00 13.33 C ATOM 2611 C TRP A 170 -7.681 -2.079 11.096 1.00 22.03 C ATOM 2612 O TRP A 170 -8.663 -1.444 11.489 1.00 41.10 O ATOM 2613 CB TRP A 170 -6.180 -2.162 13.166 1.00 3.22 C ATOM 2614 CG TRP A 170 -4.772 -2.132 13.751 1.00 72.02 C ATOM 2615 CD1 TRP A 170 -3.601 -1.839 13.105 1.00 63.33 C ATOM 2616 CD2 TRP A 170 -4.401 -2.417 15.111 1.00 1.05 C ATOM 2617 NE1 TRP A 170 -2.541 -1.925 13.971 1.00 34.02 N ATOM 2618 CE2 TRP A 170 -3.002 -2.274 15.206 1.00 22.03 C ATOM 2619 CE3 TRP A 170 -5.117 -2.769 16.254 1.00 2.51 C ATOM 2620 CZ2 TRP A 170 -2.307 -2.479 16.397 1.00 1.41 C ATOM 2621 CZ3 TRP A 170 -4.431 -2.975 17.434 1.00 54.51 C ATOM 2622 CH2 TRP A 170 -3.038 -2.827 17.501 1.00 33.32 C ATOM 0 H TRP A 170 -6.023 0.205 12.281 1.00 65.13 H new ATOM 0 HA TRP A 170 -5.556 -2.406 11.123 1.00 13.33 H new ATOM 0 HB2 TRP A 170 -6.808 -1.477 13.736 1.00 3.22 H new ATOM 0 HB3 TRP A 170 -6.592 -3.162 13.303 1.00 3.22 H new ATOM 0 HD1 TRP A 170 -3.523 -1.577 12.060 1.00 63.33 H new ATOM 0 HE1 TRP A 170 -1.565 -1.755 13.730 1.00 34.02 H new ATOM 0 HE3 TRP A 170 -6.191 -2.879 16.217 1.00 2.51 H new ATOM 0 HZ2 TRP A 170 -1.234 -2.368 16.447 1.00 1.41 H new ATOM 0 HZ3 TRP A 170 -4.977 -3.255 18.322 1.00 54.51 H new ATOM 0 HH2 TRP A 170 -2.532 -2.991 18.441 1.00 33.32 H new ATOM 2633 N LEU A 171 -7.743 -3.015 10.138 1.00 40.43 N ATOM 2634 CA LEU A 171 -8.980 -3.459 9.489 1.00 11.21 C ATOM 2635 C LEU A 171 -9.424 -4.779 10.153 1.00 63.00 C ATOM 2636 O LEU A 171 -8.667 -5.753 10.129 1.00 21.14 O ATOM 2637 CB LEU A 171 -8.729 -3.679 7.956 1.00 53.13 C ATOM 2638 CG LEU A 171 -7.905 -2.578 7.196 1.00 5.33 C ATOM 2639 CD1 LEU A 171 -7.783 -2.898 5.693 1.00 40.42 C ATOM 2640 CD2 LEU A 171 -8.479 -1.166 7.406 1.00 62.23 C ATOM 0 H LEU A 171 -6.914 -3.494 9.786 1.00 40.43 H new ATOM 0 HA LEU A 171 -9.759 -2.705 9.602 1.00 11.21 H new ATOM 0 HB2 LEU A 171 -8.214 -4.632 7.832 1.00 53.13 H new ATOM 0 HB3 LEU A 171 -9.698 -3.774 7.466 1.00 53.13 H new ATOM 0 HG LEU A 171 -6.905 -2.589 7.630 1.00 5.33 H new ATOM 0 HD11 LEU A 171 -7.207 -2.115 5.200 1.00 40.42 H new ATOM 0 HD12 LEU A 171 -7.278 -3.855 5.565 1.00 40.42 H new ATOM 0 HD13 LEU A 171 -8.778 -2.950 5.250 1.00 40.42 H new ATOM 0 HD21 LEU A 171 -7.874 -0.442 6.860 1.00 62.23 H new ATOM 0 HD22 LEU A 171 -9.505 -1.132 7.039 1.00 62.23 H new ATOM 0 HD23 LEU A 171 -8.466 -0.922 8.468 1.00 62.23 H new ATOM 2652 N GLU A 172 -10.625 -4.813 10.765 1.00 55.14 N ATOM 2653 CA GLU A 172 -11.185 -6.040 11.387 1.00 71.14 C ATOM 2654 C GLU A 172 -11.942 -6.848 10.304 1.00 44.24 C ATOM 2655 O GLU A 172 -13.147 -7.120 10.397 1.00 72.13 O ATOM 2656 CB GLU A 172 -12.086 -5.659 12.608 1.00 1.24 C ATOM 2657 CG GLU A 172 -12.425 -6.816 13.586 1.00 22.35 C ATOM 2658 CD GLU A 172 -11.198 -7.435 14.292 1.00 54.34 C ATOM 2659 OE1 GLU A 172 -10.224 -6.705 14.601 1.00 60.01 O ATOM 2660 OE2 GLU A 172 -11.202 -8.653 14.557 1.00 35.52 O ATOM 0 H GLU A 172 -11.234 -3.999 10.844 1.00 55.14 H new ATOM 0 HA GLU A 172 -10.389 -6.674 11.778 1.00 71.14 H new ATOM 0 HB2 GLU A 172 -11.589 -4.868 13.169 1.00 1.24 H new ATOM 0 HB3 GLU A 172 -13.020 -5.243 12.230 1.00 1.24 H new ATOM 0 HG2 GLU A 172 -13.116 -6.445 14.343 1.00 22.35 H new ATOM 0 HG3 GLU A 172 -12.946 -7.600 13.036 1.00 22.35 H new ATOM 2667 N THR A 173 -11.178 -7.192 9.256 1.00 14.31 N ATOM 2668 CA THR A 173 -11.645 -7.918 8.075 1.00 75.24 C ATOM 2669 C THR A 173 -10.435 -8.557 7.370 1.00 35.31 C ATOM 2670 O THR A 173 -9.304 -8.061 7.488 1.00 63.54 O ATOM 2671 CB THR A 173 -12.400 -6.974 7.084 1.00 31.52 C ATOM 2672 OG1 THR A 173 -12.977 -7.737 6.020 1.00 12.44 O ATOM 2673 CG2 THR A 173 -11.504 -5.863 6.495 1.00 71.52 C ATOM 0 H THR A 173 -10.185 -6.963 9.210 1.00 14.31 H new ATOM 0 HA THR A 173 -12.345 -8.689 8.395 1.00 75.24 H new ATOM 0 HB THR A 173 -13.180 -6.481 7.664 1.00 31.52 H new ATOM 0 HG1 THR A 173 -13.946 -7.804 6.153 1.00 12.44 H new ATOM 0 HG21 THR A 173 -12.091 -5.244 5.816 1.00 71.52 H new ATOM 0 HG22 THR A 173 -11.113 -5.245 7.303 1.00 71.52 H new ATOM 0 HG23 THR A 173 -10.675 -6.315 5.950 1.00 71.52 H new ATOM 2681 N ALA A 174 -10.666 -9.662 6.661 1.00 51.33 N ATOM 2682 CA ALA A 174 -9.626 -10.344 5.891 1.00 63.53 C ATOM 2683 C ALA A 174 -9.593 -9.743 4.486 1.00 30.44 C ATOM 2684 O ALA A 174 -10.494 -10.002 3.671 1.00 52.32 O ATOM 2685 CB ALA A 174 -9.885 -11.858 5.846 1.00 12.33 C ATOM 0 H ALA A 174 -11.581 -10.110 6.604 1.00 51.33 H new ATOM 0 HA ALA A 174 -8.656 -10.202 6.368 1.00 63.53 H new ATOM 0 HB1 ALA A 174 -9.099 -12.345 5.268 1.00 12.33 H new ATOM 0 HB2 ALA A 174 -9.889 -12.257 6.860 1.00 12.33 H new ATOM 0 HB3 ALA A 174 -10.851 -12.048 5.377 1.00 12.33 H new ATOM 2691 N VAL A 175 -8.602 -8.862 4.251 1.00 24.11 N ATOM 2692 CA VAL A 175 -8.301 -8.327 2.917 1.00 13.33 C ATOM 2693 C VAL A 175 -7.908 -9.488 1.987 1.00 23.31 C ATOM 2694 O VAL A 175 -6.773 -9.958 1.986 1.00 40.20 O ATOM 2695 CB VAL A 175 -7.178 -7.217 2.958 1.00 25.31 C ATOM 2696 CG1 VAL A 175 -6.747 -6.769 1.533 1.00 43.32 C ATOM 2697 CG2 VAL A 175 -7.658 -6.007 3.794 1.00 0.25 C ATOM 0 H VAL A 175 -7.989 -8.503 4.984 1.00 24.11 H new ATOM 0 HA VAL A 175 -9.195 -7.838 2.530 1.00 13.33 H new ATOM 0 HB VAL A 175 -6.299 -7.651 3.433 1.00 25.31 H new ATOM 0 HG11 VAL A 175 -5.973 -6.005 1.610 1.00 43.32 H new ATOM 0 HG12 VAL A 175 -6.357 -7.626 0.984 1.00 43.32 H new ATOM 0 HG13 VAL A 175 -7.608 -6.361 1.004 1.00 43.32 H new ATOM 0 HG21 VAL A 175 -6.877 -5.247 3.816 1.00 0.25 H new ATOM 0 HG22 VAL A 175 -8.558 -5.588 3.345 1.00 0.25 H new ATOM 0 HG23 VAL A 175 -7.877 -6.332 4.811 1.00 0.25 H new ATOM 2707 N THR A 176 -8.926 -10.014 1.309 1.00 4.22 N ATOM 2708 CA THR A 176 -8.803 -11.051 0.295 1.00 74.13 C ATOM 2709 C THR A 176 -9.591 -10.581 -0.933 1.00 42.45 C ATOM 2710 O THR A 176 -10.740 -10.143 -0.807 1.00 33.11 O ATOM 2711 CB THR A 176 -9.356 -12.425 0.827 1.00 35.41 C ATOM 2712 OG1 THR A 176 -10.662 -12.234 1.402 1.00 5.50 O ATOM 2713 CG2 THR A 176 -8.434 -13.062 1.888 1.00 4.35 C ATOM 0 H THR A 176 -9.891 -9.718 1.458 1.00 4.22 H new ATOM 0 HA THR A 176 -7.756 -11.212 0.038 1.00 74.13 H new ATOM 0 HB THR A 176 -9.404 -13.101 -0.027 1.00 35.41 H new ATOM 0 HG1 THR A 176 -11.144 -11.545 0.898 1.00 5.50 H new ATOM 0 HG21 THR A 176 -8.862 -14.007 2.221 1.00 4.35 H new ATOM 0 HG22 THR A 176 -7.450 -13.242 1.454 1.00 4.35 H new ATOM 0 HG23 THR A 176 -8.338 -12.387 2.739 1.00 4.35 H new ATOM 2721 N ALA A 177 -8.948 -10.619 -2.099 1.00 25.30 N ATOM 2722 CA ALA A 177 -9.545 -10.191 -3.369 1.00 74.21 C ATOM 2723 C ALA A 177 -8.972 -11.077 -4.473 1.00 62.55 C ATOM 2724 O ALA A 177 -7.748 -11.164 -4.620 1.00 5.40 O ATOM 2725 CB ALA A 177 -9.259 -8.699 -3.606 1.00 20.01 C ATOM 0 H ALA A 177 -7.988 -10.951 -2.193 1.00 25.30 H new ATOM 0 HA ALA A 177 -10.629 -10.301 -3.356 1.00 74.21 H new ATOM 0 HB1 ALA A 177 -9.705 -8.389 -4.551 1.00 20.01 H new ATOM 0 HB2 ALA A 177 -9.687 -8.113 -2.793 1.00 20.01 H new ATOM 0 HB3 ALA A 177 -8.182 -8.536 -3.643 1.00 20.01 H new ATOM 2731 N GLY A 178 -9.859 -11.738 -5.229 1.00 52.45 N ATOM 2732 CA GLY A 178 -9.449 -12.816 -6.132 1.00 23.14 C ATOM 2733 C GLY A 178 -8.659 -13.935 -5.427 1.00 71.15 C ATOM 2734 O GLY A 178 -8.966 -14.290 -4.278 1.00 32.12 O ATOM 0 H GLY A 178 -10.860 -11.544 -5.232 1.00 52.45 H new ATOM 0 HA2 GLY A 178 -10.335 -13.246 -6.599 1.00 23.14 H new ATOM 0 HA3 GLY A 178 -8.838 -12.398 -6.932 1.00 23.14 H new ATOM 2738 N GLU A 179 -7.685 -14.519 -6.154 1.00 20.34 N ATOM 2739 CA GLU A 179 -6.705 -15.478 -5.601 1.00 22.23 C ATOM 2740 C GLU A 179 -5.822 -14.820 -4.517 1.00 54.24 C ATOM 2741 O GLU A 179 -5.552 -13.610 -4.562 1.00 14.12 O ATOM 2742 CB GLU A 179 -5.820 -16.063 -6.738 1.00 55.41 C ATOM 2743 CG GLU A 179 -6.618 -16.755 -7.864 1.00 1.21 C ATOM 2744 CD GLU A 179 -5.717 -17.460 -8.888 1.00 42.23 C ATOM 2745 OE1 GLU A 179 -5.156 -18.528 -8.556 1.00 72.10 O ATOM 2746 OE2 GLU A 179 -5.540 -16.948 -10.014 1.00 64.03 O ATOM 0 H GLU A 179 -7.555 -14.337 -7.149 1.00 20.34 H new ATOM 0 HA GLU A 179 -7.260 -16.290 -5.132 1.00 22.23 H new ATOM 0 HB2 GLU A 179 -5.224 -15.259 -7.170 1.00 55.41 H new ATOM 0 HB3 GLU A 179 -5.122 -16.781 -6.308 1.00 55.41 H new ATOM 0 HG2 GLU A 179 -7.299 -17.484 -7.425 1.00 1.21 H new ATOM 0 HG3 GLU A 179 -7.231 -16.014 -8.376 1.00 1.21 H new ATOM 2753 N ARG A 180 -5.358 -15.655 -3.568 1.00 13.33 N ATOM 2754 CA ARG A 180 -4.616 -15.215 -2.367 1.00 24.54 C ATOM 2755 C ARG A 180 -3.939 -16.411 -1.669 1.00 50.33 C ATOM 2756 O ARG A 180 -4.101 -17.566 -2.095 1.00 4.02 O ATOM 2757 CB ARG A 180 -5.545 -14.476 -1.337 1.00 20.11 C ATOM 2758 CG ARG A 180 -6.658 -15.337 -0.665 1.00 62.41 C ATOM 2759 CD ARG A 180 -7.847 -15.651 -1.597 1.00 42.33 C ATOM 2760 NE ARG A 180 -8.874 -16.477 -0.956 1.00 61.34 N ATOM 2761 CZ ARG A 180 -10.095 -16.726 -1.472 1.00 53.45 C ATOM 2762 NH1 ARG A 180 -10.469 -16.212 -2.645 1.00 62.41 N ATOM 2763 NH2 ARG A 180 -10.921 -17.529 -0.825 1.00 5.13 N ATOM 0 H ARG A 180 -5.488 -16.666 -3.612 1.00 13.33 H new ATOM 0 HA ARG A 180 -3.856 -14.514 -2.711 1.00 24.54 H new ATOM 0 HB2 ARG A 180 -4.917 -14.055 -0.551 1.00 20.11 H new ATOM 0 HB3 ARG A 180 -6.022 -13.639 -1.847 1.00 20.11 H new ATOM 0 HG2 ARG A 180 -6.221 -16.274 -0.320 1.00 62.41 H new ATOM 0 HG3 ARG A 180 -7.027 -14.813 0.217 1.00 62.41 H new ATOM 0 HD2 ARG A 180 -8.297 -14.716 -1.931 1.00 42.33 H new ATOM 0 HD3 ARG A 180 -7.479 -16.163 -2.486 1.00 42.33 H new ATOM 0 HE ARG A 180 -8.649 -16.894 -0.053 1.00 61.34 H new ATOM 0 HH11 ARG A 180 -9.827 -15.618 -3.170 1.00 62.41 H new ATOM 0 HH12 ARG A 180 -11.397 -16.413 -3.017 1.00 62.41 H new ATOM 0 HH21 ARG A 180 -10.633 -17.954 0.056 1.00 5.13 H new ATOM 0 HH22 ARG A 180 -11.847 -17.724 -1.207 1.00 5.13 H new ATOM 2777 N THR A 181 -3.120 -16.094 -0.634 1.00 55.53 N ATOM 2778 CA THR A 181 -2.618 -17.064 0.362 1.00 71.10 C ATOM 2779 C THR A 181 -3.731 -18.032 0.844 1.00 22.15 C ATOM 2780 O THR A 181 -4.732 -17.616 1.442 1.00 14.44 O ATOM 2781 CB THR A 181 -1.978 -16.322 1.588 1.00 64.43 C ATOM 2782 OG1 THR A 181 -1.008 -15.359 1.118 1.00 3.22 O ATOM 2783 CG2 THR A 181 -1.291 -17.301 2.568 1.00 25.13 C ATOM 0 H THR A 181 -2.788 -15.144 -0.469 1.00 55.53 H new ATOM 0 HA THR A 181 -1.851 -17.661 -0.132 1.00 71.10 H new ATOM 0 HB THR A 181 -2.783 -15.822 2.126 1.00 64.43 H new ATOM 0 HG1 THR A 181 -0.610 -14.895 1.884 1.00 3.22 H new ATOM 0 HG21 THR A 181 -0.863 -16.742 3.400 1.00 25.13 H new ATOM 0 HG22 THR A 181 -2.026 -18.011 2.948 1.00 25.13 H new ATOM 0 HG23 THR A 181 -0.500 -17.841 2.048 1.00 25.13 H new ATOM 2791 N ASP A 182 -3.529 -19.313 0.520 1.00 72.40 N ATOM 2792 CA ASP A 182 -4.446 -20.413 0.846 1.00 61.04 C ATOM 2793 C ASP A 182 -3.607 -21.646 1.234 1.00 43.13 C ATOM 2794 O ASP A 182 -2.464 -21.783 0.776 1.00 73.31 O ATOM 2795 CB ASP A 182 -5.370 -20.701 -0.374 1.00 41.43 C ATOM 2796 CG ASP A 182 -6.343 -21.882 -0.170 1.00 51.35 C ATOM 2797 OD1 ASP A 182 -7.447 -21.667 0.375 1.00 13.53 O ATOM 2798 OD2 ASP A 182 -6.005 -23.030 -0.543 1.00 3.21 O ATOM 0 H ASP A 182 -2.702 -19.623 0.010 1.00 72.40 H new ATOM 0 HA ASP A 182 -5.088 -20.150 1.687 1.00 61.04 H new ATOM 0 HB2 ASP A 182 -5.948 -19.804 -0.597 1.00 41.43 H new ATOM 0 HB3 ASP A 182 -4.748 -20.904 -1.246 1.00 41.43 H new ATOM 2803 N LEU A 183 -4.189 -22.535 2.064 1.00 11.51 N ATOM 2804 CA LEU A 183 -3.476 -23.696 2.656 1.00 5.42 C ATOM 2805 C LEU A 183 -2.962 -24.701 1.585 1.00 24.43 C ATOM 2806 O LEU A 183 -1.952 -25.382 1.804 1.00 61.53 O ATOM 2807 CB LEU A 183 -4.367 -24.423 3.725 1.00 35.24 C ATOM 2808 CG LEU A 183 -5.570 -25.311 3.222 1.00 21.22 C ATOM 2809 CD1 LEU A 183 -6.177 -26.134 4.382 1.00 41.53 C ATOM 2810 CD2 LEU A 183 -6.675 -24.485 2.520 1.00 4.30 C ATOM 0 H LEU A 183 -5.167 -22.472 2.346 1.00 11.51 H new ATOM 0 HA LEU A 183 -2.594 -23.294 3.155 1.00 5.42 H new ATOM 0 HB2 LEU A 183 -3.714 -25.057 4.325 1.00 35.24 H new ATOM 0 HB3 LEU A 183 -4.772 -23.662 4.392 1.00 35.24 H new ATOM 0 HG LEU A 183 -5.155 -25.992 2.479 1.00 21.22 H new ATOM 0 HD11 LEU A 183 -7.004 -26.737 4.007 1.00 41.53 H new ATOM 0 HD12 LEU A 183 -5.413 -26.788 4.803 1.00 41.53 H new ATOM 0 HD13 LEU A 183 -6.542 -25.458 5.155 1.00 41.53 H new ATOM 0 HD21 LEU A 183 -7.476 -25.150 2.196 1.00 4.30 H new ATOM 0 HD22 LEU A 183 -7.075 -23.747 3.216 1.00 4.30 H new ATOM 0 HD23 LEU A 183 -6.253 -23.976 1.653 1.00 4.30 H new ATOM 2822 N GLU A 184 -3.654 -24.766 0.429 1.00 32.13 N ATOM 2823 CA GLU A 184 -3.306 -25.670 -0.692 1.00 63.12 C ATOM 2824 C GLU A 184 -3.446 -24.936 -2.052 1.00 30.35 C ATOM 2825 O GLU A 184 -4.269 -25.294 -2.911 1.00 64.45 O ATOM 2826 CB GLU A 184 -4.160 -26.977 -0.626 1.00 43.43 C ATOM 2827 CG GLU A 184 -5.687 -26.768 -0.503 1.00 52.13 C ATOM 2828 CD GLU A 184 -6.477 -28.088 -0.536 1.00 63.13 C ATOM 2829 OE1 GLU A 184 -6.437 -28.842 0.463 1.00 15.33 O ATOM 2830 OE2 GLU A 184 -7.124 -28.397 -1.562 1.00 51.31 O ATOM 0 H GLU A 184 -4.475 -24.190 0.244 1.00 32.13 H new ATOM 0 HA GLU A 184 -2.261 -25.966 -0.599 1.00 63.12 H new ATOM 0 HB2 GLU A 184 -3.962 -27.565 -1.522 1.00 43.43 H new ATOM 0 HB3 GLU A 184 -3.822 -27.569 0.225 1.00 43.43 H new ATOM 0 HG2 GLU A 184 -5.903 -26.244 0.428 1.00 52.13 H new ATOM 0 HG3 GLU A 184 -6.027 -26.126 -1.316 1.00 52.13 H new ATOM 2837 N HIS A 185 -2.595 -23.913 -2.242 1.00 52.04 N ATOM 2838 CA HIS A 185 -2.570 -23.076 -3.461 1.00 53.10 C ATOM 2839 C HIS A 185 -1.129 -22.555 -3.687 1.00 11.11 C ATOM 2840 O HIS A 185 -0.439 -23.028 -4.620 1.00 50.11 O ATOM 2841 CB HIS A 185 -3.586 -21.905 -3.326 1.00 21.21 C ATOM 2842 CG HIS A 185 -3.536 -20.894 -4.447 1.00 42.33 C ATOM 2843 ND1 HIS A 185 -2.952 -19.648 -4.313 1.00 12.44 N ATOM 2844 CD2 HIS A 185 -3.992 -20.953 -5.720 1.00 64.12 C ATOM 2845 CE1 HIS A 185 -3.055 -18.991 -5.448 1.00 62.30 C ATOM 2846 NE2 HIS A 185 -3.681 -19.760 -6.316 1.00 71.11 N ATOM 0 H HIS A 185 -1.898 -23.639 -1.550 1.00 52.04 H new ATOM 0 HA HIS A 185 -2.865 -23.668 -4.327 1.00 53.10 H new ATOM 0 HB2 HIS A 185 -4.593 -22.320 -3.274 1.00 21.21 H new ATOM 0 HB3 HIS A 185 -3.404 -21.391 -2.383 1.00 21.21 H new ATOM 0 HD2 HIS A 185 -4.505 -21.785 -6.180 1.00 64.12 H new ATOM 0 HE1 HIS A 185 -2.689 -17.992 -5.636 1.00 62.30 H new ATOM 0 HE2 HIS A 185 -3.899 -19.507 -7.280 1.00 71.11 H new TER 2855 HIS A 185