USER MOD reduce.3.24.130724 H: found=0, std=0, add=1247, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1248 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 101 TYR OH : rot 165:sc= -0.734 USER MOD Set 1.2: A 153 GLN : amide:sc= -0.231 K(o=-1.4,f=-3.6!) USER MOD Set 1.3: A 160 GLN : amide:sc= -0.428 K(o=-1.4,f=-2.6) USER MOD Set 2.1: A 143 THR OG1 : rot -46:sc= -0.0251 USER MOD Set 2.2: A 144 THR OG1 : rot 180:sc= 0.00352 USER MOD Set 3.1: A 44 THR OG1 : rot -59:sc= 0.3 USER MOD Set 3.2: A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.41 USER MOD Single : A 22 SER OG : rot 180:sc= 0.00232 USER MOD Single : A 23 SER OG : rot 170:sc= -0.648 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.077 X(o=-0.077,f=-0.14) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.24) USER MOD Single : A 45 CYS SG : rot -150:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.0833 K(o=-0.083,f=-0.71) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -0.196 K(o=-0.2,f=-2.8!) USER MOD Single : A 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -0.106 K(o=-0.11,f=-1.1) USER MOD Single : A 64 ASN : amide:sc= -0.014 X(o=-0.014,f=-0.014) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl 169:sc= -3.76! (180deg=-4.42!) USER MOD Single : A 71 LYS NZ :NH3+ -153:sc= -0.376 (180deg=-1.34) USER MOD Single : A 76 GLN : amide:sc= -0.435 X(o=-0.44,f=-0.1) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= -2.22 USER MOD Single : A 98 TYR OH : rot -177:sc= -0.567 USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 ASN : amide:sc= -0.32 K(o=-0.32,f=-2.5!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot -32:sc= -2.17! USER MOD Single : A 112 GLN : amide:sc= -0.993 K(o=-0.99,f=-2.3) USER MOD Single : A 117 GLN : amide:sc= -3.53 K(o=-3.5,f=-7.4!) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 SER OG : rot 170:sc= -0.425 USER MOD Single : A 120 THR OG1 : rot 122:sc= -2.75! USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= -0.0471 X(o=-0.047,f=0) USER MOD Single : A 128 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 129 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.168) USER MOD Single : A 130 LYS NZ :NH3+ 148:sc= -0.367 (180deg=-1.09) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= -0.506 K(o=-0.51,f=-1.3) USER MOD Single : A 138 THR OG1 : rot 180:sc= -0.0028 USER MOD Single : A 139 THR OG1 : rot -172:sc= -5.33! USER MOD Single : A 145 ASN : amide:sc= -8.61! K(o=-8.6!,f=-4.3) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot -60:sc= -3.89! USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 GLN : amide:sc= -3.58 X(o=-3.6,f=-3.5!) USER MOD Single : A 156 ASN : amide:sc= -2.8! C(o=-2.8!,f=-13!) USER MOD Single : A 157 GLN : amide:sc=-0.00567 X(o=-0.0057,f=-0.25) USER MOD Single : A 162 MET CE :methyl -127:sc= -9.57! (180deg=-20.3!) USER MOD Single : A 163 THR OG1 : rot 86:sc= 1.2 USER MOD Single : A 165 HIS : no HD1:sc= -1.52 K(o=-1.5,f=-2.1!) USER MOD Single : A 170 SER OG : rot 170:sc= -0.301 USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 SER OG : rot 180:sc= 0 USER MOD Single : A 178 SER OG : rot -62:sc= 1.18 USER MOD Single : A 184 GLN : amide:sc= -0.507 K(o=-0.51,f=0) USER MOD Single : A 185 MET CE :methyl -129:sc= -2.7! (180deg=-5.96!) USER MOD ----------------------------------------------------------------- ATOM 20 N THR A 21 20.013 11.623 0.890 1.00 0.12 N ATOM 21 CA THR A 21 20.400 10.435 0.078 1.00 0.20 C ATOM 22 C THR A 21 19.156 9.853 -0.597 1.00 0.27 C ATOM 23 O THR A 21 18.038 10.188 -0.257 1.00 0.31 O ATOM 24 CB THR A 21 21.042 9.372 0.980 1.00 0.28 C ATOM 25 OG1 THR A 21 20.986 8.109 0.332 1.00 0.53 O ATOM 26 CG2 THR A 21 20.296 9.292 2.315 1.00 0.52 C ATOM 0 HA THR A 21 21.120 10.738 -0.683 1.00 0.20 H new ATOM 0 HB THR A 21 22.080 9.645 1.169 1.00 0.28 H new ATOM 0 HG1 THR A 21 21.397 7.429 0.905 1.00 0.53 H new ATOM 0 HG21 THR A 21 20.760 8.535 2.946 1.00 0.52 H new ATOM 0 HG22 THR A 21 20.341 10.259 2.816 1.00 0.52 H new ATOM 0 HG23 THR A 21 19.255 9.025 2.134 1.00 0.52 H new ATOM 34 N SER A 22 19.342 8.987 -1.556 1.00 0.29 N ATOM 35 CA SER A 22 18.175 8.385 -2.263 1.00 0.35 C ATOM 36 C SER A 22 17.207 7.780 -1.243 1.00 0.34 C ATOM 37 O SER A 22 16.014 7.718 -1.468 1.00 0.49 O ATOM 38 CB SER A 22 18.666 7.292 -3.212 1.00 0.40 C ATOM 39 OG SER A 22 19.709 7.813 -4.025 1.00 0.89 O ATOM 0 H SER A 22 20.255 8.669 -1.881 1.00 0.29 H new ATOM 0 HA SER A 22 17.659 9.159 -2.832 1.00 0.35 H new ATOM 0 HB2 SER A 22 19.026 6.435 -2.643 1.00 0.40 H new ATOM 0 HB3 SER A 22 17.845 6.939 -3.835 1.00 0.40 H new ATOM 0 HG SER A 22 20.028 7.115 -4.634 1.00 0.89 H new ATOM 45 N SER A 23 17.709 7.333 -0.125 1.00 0.25 N ATOM 46 CA SER A 23 16.815 6.733 0.905 1.00 0.28 C ATOM 47 C SER A 23 15.933 7.824 1.508 1.00 0.14 C ATOM 48 O SER A 23 14.756 7.628 1.733 1.00 0.19 O ATOM 49 CB SER A 23 17.663 6.098 2.006 1.00 0.38 C ATOM 50 OG SER A 23 16.819 5.700 3.078 1.00 1.24 O ATOM 0 H SER A 23 18.699 7.357 0.120 1.00 0.25 H new ATOM 0 HA SER A 23 16.187 5.970 0.444 1.00 0.28 H new ATOM 0 HB2 SER A 23 18.203 5.236 1.614 1.00 0.38 H new ATOM 0 HB3 SER A 23 18.410 6.808 2.361 1.00 0.38 H new ATOM 0 HG SER A 23 17.329 5.152 3.710 1.00 1.24 H new ATOM 56 N GLU A 24 16.488 8.977 1.766 1.00 0.11 N ATOM 57 CA GLU A 24 15.670 10.076 2.346 1.00 0.24 C ATOM 58 C GLU A 24 14.591 10.466 1.339 1.00 0.30 C ATOM 59 O GLU A 24 13.477 10.786 1.700 1.00 0.44 O ATOM 60 CB GLU A 24 16.564 11.282 2.637 1.00 0.33 C ATOM 61 CG GLU A 24 15.941 12.126 3.751 1.00 1.19 C ATOM 62 CD GLU A 24 15.036 13.199 3.141 1.00 2.71 C ATOM 63 OE1 GLU A 24 15.187 13.473 1.961 1.00 3.32 O ATOM 64 OE2 GLU A 24 14.206 13.727 3.863 1.00 3.56 O ATOM 0 H GLU A 24 17.469 9.203 1.600 1.00 0.11 H new ATOM 0 HA GLU A 24 15.207 9.745 3.276 1.00 0.24 H new ATOM 0 HB2 GLU A 24 17.558 10.947 2.933 1.00 0.33 H new ATOM 0 HB3 GLU A 24 16.685 11.883 1.736 1.00 0.33 H new ATOM 0 HG2 GLU A 24 15.365 11.490 4.423 1.00 1.19 H new ATOM 0 HG3 GLU A 24 16.724 12.594 4.348 1.00 1.19 H new ATOM 71 N ARG A 25 14.909 10.428 0.074 1.00 0.25 N ATOM 72 CA ARG A 25 13.897 10.780 -0.957 1.00 0.40 C ATOM 73 C ARG A 25 12.837 9.678 -0.992 1.00 0.42 C ATOM 74 O ARG A 25 11.699 9.906 -1.349 1.00 0.61 O ATOM 75 CB ARG A 25 14.577 10.894 -2.324 1.00 0.44 C ATOM 76 CG ARG A 25 15.838 11.752 -2.195 1.00 1.20 C ATOM 77 CD ARG A 25 16.017 12.597 -3.459 1.00 0.91 C ATOM 78 NE ARG A 25 17.472 12.812 -3.711 1.00 2.08 N ATOM 79 CZ ARG A 25 18.027 12.329 -4.790 1.00 2.95 C ATOM 80 NH1 ARG A 25 17.838 12.917 -5.939 1.00 3.03 N ATOM 81 NH2 ARG A 25 18.775 11.263 -4.720 1.00 4.18 N ATOM 0 H ARG A 25 15.826 10.168 -0.288 1.00 0.25 H new ATOM 0 HA ARG A 25 13.430 11.735 -0.716 1.00 0.40 H new ATOM 0 HB2 ARG A 25 14.835 9.903 -2.698 1.00 0.44 H new ATOM 0 HB3 ARG A 25 13.893 11.339 -3.047 1.00 0.44 H new ATOM 0 HG2 ARG A 25 15.762 12.399 -1.321 1.00 1.20 H new ATOM 0 HG3 ARG A 25 16.710 11.115 -2.045 1.00 1.20 H new ATOM 0 HD2 ARG A 25 15.559 12.096 -4.312 1.00 0.91 H new ATOM 0 HD3 ARG A 25 15.511 13.556 -3.343 1.00 0.91 H new ATOM 0 HE ARG A 25 18.033 13.337 -3.040 1.00 2.08 H new ATOM 0 HH11 ARG A 25 17.257 13.754 -5.994 1.00 3.03 H new ATOM 0 HH12 ARG A 25 18.271 12.540 -6.782 1.00 3.03 H new ATOM 0 HH21 ARG A 25 18.927 10.805 -3.821 1.00 4.18 H new ATOM 0 HH22 ARG A 25 19.208 10.887 -5.564 1.00 4.18 H new ATOM 95 N ILE A 26 13.201 8.484 -0.605 1.00 0.27 N ATOM 96 CA ILE A 26 12.214 7.369 -0.593 1.00 0.31 C ATOM 97 C ILE A 26 11.196 7.637 0.527 1.00 0.25 C ATOM 98 O ILE A 26 10.001 7.495 0.351 1.00 0.28 O ATOM 99 CB ILE A 26 12.947 6.041 -0.326 1.00 0.34 C ATOM 100 CG1 ILE A 26 13.838 5.684 -1.546 1.00 0.68 C ATOM 101 CG2 ILE A 26 11.932 4.920 -0.032 1.00 0.32 C ATOM 102 CD1 ILE A 26 13.108 4.768 -2.549 1.00 0.23 C ATOM 0 H ILE A 26 14.141 8.234 -0.297 1.00 0.27 H new ATOM 0 HA ILE A 26 11.702 7.304 -1.553 1.00 0.31 H new ATOM 0 HB ILE A 26 13.586 6.150 0.550 1.00 0.34 H new ATOM 0 HG12 ILE A 26 14.146 6.600 -2.050 1.00 0.68 H new ATOM 0 HG13 ILE A 26 14.746 5.190 -1.199 1.00 0.68 H new ATOM 0 HG21 ILE A 26 12.464 3.987 0.155 1.00 0.32 H new ATOM 0 HG22 ILE A 26 11.343 5.184 0.846 1.00 0.32 H new ATOM 0 HG23 ILE A 26 11.270 4.795 -0.889 1.00 0.32 H new ATOM 0 HD11 ILE A 26 13.770 4.545 -3.386 1.00 0.23 H new ATOM 0 HD12 ILE A 26 12.823 3.840 -2.054 1.00 0.23 H new ATOM 0 HD13 ILE A 26 12.214 5.271 -2.918 1.00 0.23 H new ATOM 114 N ASP A 27 11.672 8.016 1.683 1.00 0.20 N ATOM 115 CA ASP A 27 10.758 8.281 2.831 1.00 0.21 C ATOM 116 C ASP A 27 9.840 9.476 2.529 1.00 0.25 C ATOM 117 O ASP A 27 8.663 9.461 2.832 1.00 0.22 O ATOM 118 CB ASP A 27 11.607 8.550 4.095 1.00 0.21 C ATOM 119 CG ASP A 27 12.062 10.018 4.164 1.00 1.88 C ATOM 120 OD1 ASP A 27 11.211 10.876 4.332 1.00 2.13 O ATOM 121 OD2 ASP A 27 13.253 10.254 4.052 1.00 3.20 O ATOM 0 H ASP A 27 12.663 8.154 1.882 1.00 0.20 H new ATOM 0 HA ASP A 27 10.123 7.411 2.998 1.00 0.21 H new ATOM 0 HB2 ASP A 27 11.026 8.306 4.984 1.00 0.21 H new ATOM 0 HB3 ASP A 27 12.480 7.897 4.095 1.00 0.21 H new ATOM 126 N LYS A 28 10.377 10.515 1.954 1.00 0.33 N ATOM 127 CA LYS A 28 9.553 11.716 1.654 1.00 0.37 C ATOM 128 C LYS A 28 8.461 11.364 0.652 1.00 0.29 C ATOM 129 O LYS A 28 7.306 11.696 0.832 1.00 0.28 O ATOM 130 CB LYS A 28 10.451 12.806 1.060 1.00 0.54 C ATOM 131 CG LYS A 28 10.919 13.750 2.168 1.00 1.03 C ATOM 132 CD LYS A 28 9.698 14.368 2.842 1.00 1.74 C ATOM 133 CE LYS A 28 10.027 15.787 3.313 1.00 2.33 C ATOM 134 NZ LYS A 28 8.845 16.667 3.097 1.00 2.60 N ATOM 0 H LYS A 28 11.357 10.583 1.678 1.00 0.33 H new ATOM 0 HA LYS A 28 9.091 12.073 2.574 1.00 0.37 H new ATOM 0 HB2 LYS A 28 11.312 12.353 0.568 1.00 0.54 H new ATOM 0 HB3 LYS A 28 9.906 13.365 0.299 1.00 0.54 H new ATOM 0 HG2 LYS A 28 11.517 13.206 2.899 1.00 1.03 H new ATOM 0 HG3 LYS A 28 11.556 14.531 1.753 1.00 1.03 H new ATOM 0 HD2 LYS A 28 8.860 14.392 2.145 1.00 1.74 H new ATOM 0 HD3 LYS A 28 9.391 13.756 3.690 1.00 1.74 H new ATOM 0 HE2 LYS A 28 10.299 15.778 4.368 1.00 2.33 H new ATOM 0 HE3 LYS A 28 10.887 16.173 2.766 1.00 2.33 H new ATOM 0 HZ1 LYS A 28 9.067 17.631 3.417 1.00 2.60 H new ATOM 0 HZ2 LYS A 28 8.605 16.684 2.085 1.00 2.60 H new ATOM 0 HZ3 LYS A 28 8.036 16.301 3.638 1.00 2.60 H new ATOM 148 N GLN A 29 8.818 10.705 -0.408 1.00 0.48 N ATOM 149 CA GLN A 29 7.804 10.344 -1.433 1.00 0.44 C ATOM 150 C GLN A 29 6.686 9.510 -0.792 1.00 0.38 C ATOM 151 O GLN A 29 5.535 9.610 -1.173 1.00 0.35 O ATOM 152 CB GLN A 29 8.478 9.546 -2.547 1.00 0.49 C ATOM 153 CG GLN A 29 7.741 9.788 -3.863 1.00 1.39 C ATOM 154 CD GLN A 29 8.153 11.146 -4.436 1.00 1.04 C ATOM 155 OE1 GLN A 29 7.427 12.113 -4.321 1.00 1.84 O ATOM 156 NE2 GLN A 29 9.299 11.260 -5.051 1.00 0.88 N ATOM 0 H GLN A 29 9.770 10.399 -0.611 1.00 0.48 H new ATOM 0 HA GLN A 29 7.368 11.252 -1.850 1.00 0.44 H new ATOM 0 HB2 GLN A 29 9.522 9.844 -2.642 1.00 0.49 H new ATOM 0 HB3 GLN A 29 8.471 8.484 -2.304 1.00 0.49 H new ATOM 0 HG2 GLN A 29 7.974 8.995 -4.574 1.00 1.39 H new ATOM 0 HG3 GLN A 29 6.664 9.762 -3.699 1.00 1.39 H new ATOM 0 HE21 GLN A 29 9.909 10.448 -5.148 1.00 0.88 H new ATOM 0 HE22 GLN A 29 9.584 12.161 -5.435 1.00 0.88 H new ATOM 165 N ILE A 30 7.001 8.697 0.184 1.00 0.37 N ATOM 166 CA ILE A 30 5.926 7.884 0.831 1.00 0.32 C ATOM 167 C ILE A 30 5.007 8.818 1.616 1.00 0.33 C ATOM 168 O ILE A 30 3.806 8.634 1.657 1.00 0.32 O ATOM 169 CB ILE A 30 6.531 6.862 1.794 1.00 0.34 C ATOM 170 CG1 ILE A 30 7.578 5.997 1.054 1.00 0.37 C ATOM 171 CG2 ILE A 30 5.417 6.001 2.387 1.00 0.30 C ATOM 172 CD1 ILE A 30 6.935 4.753 0.419 1.00 0.81 C ATOM 0 H ILE A 30 7.941 8.561 0.557 1.00 0.37 H new ATOM 0 HA ILE A 30 5.368 7.355 0.058 1.00 0.32 H new ATOM 0 HB ILE A 30 7.038 7.377 2.610 1.00 0.34 H new ATOM 0 HG12 ILE A 30 8.062 6.593 0.280 1.00 0.37 H new ATOM 0 HG13 ILE A 30 8.356 5.689 1.752 1.00 0.37 H new ATOM 0 HG21 ILE A 30 5.847 5.272 3.074 1.00 0.30 H new ATOM 0 HG22 ILE A 30 4.714 6.636 2.926 1.00 0.30 H new ATOM 0 HG23 ILE A 30 4.894 5.480 1.585 1.00 0.30 H new ATOM 0 HD11 ILE A 30 7.700 4.169 -0.092 1.00 0.81 H new ATOM 0 HD12 ILE A 30 6.474 4.145 1.197 1.00 0.81 H new ATOM 0 HD13 ILE A 30 6.175 5.062 -0.298 1.00 0.81 H new ATOM 184 N ARG A 31 5.561 9.824 2.239 1.00 0.32 N ATOM 185 CA ARG A 31 4.715 10.773 3.015 1.00 0.31 C ATOM 186 C ARG A 31 3.637 11.340 2.093 1.00 0.31 C ATOM 187 O ARG A 31 2.534 11.632 2.512 1.00 0.29 O ATOM 188 CB ARG A 31 5.581 11.914 3.552 1.00 0.31 C ATOM 189 CG ARG A 31 4.840 12.627 4.685 1.00 0.23 C ATOM 190 CD ARG A 31 4.345 13.987 4.194 1.00 1.40 C ATOM 191 NE ARG A 31 3.253 14.469 5.086 1.00 1.89 N ATOM 192 CZ ARG A 31 3.430 15.537 5.814 1.00 1.88 C ATOM 193 NH1 ARG A 31 3.431 16.716 5.253 1.00 2.78 N ATOM 194 NH2 ARG A 31 3.607 15.427 7.102 1.00 1.52 N ATOM 0 H ARG A 31 6.560 10.028 2.243 1.00 0.32 H new ATOM 0 HA ARG A 31 4.251 10.253 3.853 1.00 0.31 H new ATOM 0 HB2 ARG A 31 6.532 11.524 3.914 1.00 0.31 H new ATOM 0 HB3 ARG A 31 5.810 12.619 2.752 1.00 0.31 H new ATOM 0 HG2 ARG A 31 3.998 12.021 5.021 1.00 0.23 H new ATOM 0 HG3 ARG A 31 5.502 12.756 5.542 1.00 0.23 H new ATOM 0 HD2 ARG A 31 5.166 14.704 4.186 1.00 1.40 H new ATOM 0 HD3 ARG A 31 3.983 13.906 3.169 1.00 1.40 H new ATOM 0 HE ARG A 31 2.368 13.964 5.127 1.00 1.89 H new ATOM 0 HH11 ARG A 31 3.293 16.802 4.246 1.00 2.78 H new ATOM 0 HH12 ARG A 31 3.569 17.551 5.822 1.00 2.78 H new ATOM 0 HH21 ARG A 31 3.607 14.506 7.540 1.00 1.52 H new ATOM 0 HH22 ARG A 31 3.745 16.262 7.671 1.00 1.52 H new ATOM 208 N TYR A 32 3.945 11.475 0.833 1.00 0.34 N ATOM 209 CA TYR A 32 2.939 11.996 -0.126 1.00 0.34 C ATOM 210 C TYR A 32 1.939 10.880 -0.403 1.00 0.34 C ATOM 211 O TYR A 32 0.758 11.110 -0.576 1.00 0.35 O ATOM 212 CB TYR A 32 3.633 12.403 -1.427 1.00 0.38 C ATOM 213 CG TYR A 32 3.231 13.811 -1.795 1.00 0.46 C ATOM 214 CD1 TYR A 32 3.830 14.901 -1.151 1.00 1.82 C ATOM 215 CD2 TYR A 32 2.260 14.026 -2.780 1.00 1.18 C ATOM 216 CE1 TYR A 32 3.458 16.206 -1.494 1.00 2.08 C ATOM 217 CE2 TYR A 32 1.888 15.331 -3.122 1.00 1.00 C ATOM 218 CZ TYR A 32 2.486 16.421 -2.479 1.00 0.91 C ATOM 219 OH TYR A 32 2.119 17.708 -2.817 1.00 1.18 O ATOM 0 H TYR A 32 4.853 11.246 0.428 1.00 0.34 H new ATOM 0 HA TYR A 32 2.432 12.868 0.286 1.00 0.34 H new ATOM 0 HB2 TYR A 32 4.715 12.342 -1.309 1.00 0.38 H new ATOM 0 HB3 TYR A 32 3.360 11.715 -2.227 1.00 0.38 H new ATOM 0 HD1 TYR A 32 4.578 14.735 -0.390 1.00 1.82 H new ATOM 0 HD2 TYR A 32 1.798 13.185 -3.276 1.00 1.18 H new ATOM 0 HE1 TYR A 32 3.921 17.047 -0.999 1.00 2.08 H new ATOM 0 HE2 TYR A 32 1.139 15.497 -3.882 1.00 1.00 H new ATOM 0 HH TYR A 32 1.434 17.680 -3.518 1.00 1.18 H new ATOM 229 N ILE A 33 2.411 9.664 -0.432 1.00 0.34 N ATOM 230 CA ILE A 33 1.502 8.515 -0.680 1.00 0.34 C ATOM 231 C ILE A 33 0.375 8.528 0.358 1.00 0.33 C ATOM 232 O ILE A 33 -0.778 8.318 0.038 1.00 0.32 O ATOM 233 CB ILE A 33 2.290 7.207 -0.565 1.00 0.34 C ATOM 234 CG1 ILE A 33 3.368 7.169 -1.651 1.00 0.37 C ATOM 235 CG2 ILE A 33 1.342 6.018 -0.749 1.00 0.28 C ATOM 236 CD1 ILE A 33 4.204 5.897 -1.494 1.00 0.26 C ATOM 0 H ILE A 33 3.391 9.418 -0.294 1.00 0.34 H new ATOM 0 HA ILE A 33 1.077 8.594 -1.681 1.00 0.34 H new ATOM 0 HB ILE A 33 2.757 7.149 0.418 1.00 0.34 H new ATOM 0 HG12 ILE A 33 2.906 7.194 -2.638 1.00 0.37 H new ATOM 0 HG13 ILE A 33 4.007 8.049 -1.575 1.00 0.37 H new ATOM 0 HG21 ILE A 33 1.905 5.088 -0.667 1.00 0.28 H new ATOM 0 HG22 ILE A 33 0.571 6.045 0.021 1.00 0.28 H new ATOM 0 HG23 ILE A 33 0.875 6.074 -1.732 1.00 0.28 H new ATOM 0 HD11 ILE A 33 4.972 5.869 -2.267 1.00 0.26 H new ATOM 0 HD12 ILE A 33 4.677 5.891 -0.512 1.00 0.26 H new ATOM 0 HD13 ILE A 33 3.559 5.024 -1.591 1.00 0.26 H new ATOM 248 N LEU A 34 0.703 8.769 1.598 1.00 0.35 N ATOM 249 CA LEU A 34 -0.344 8.790 2.660 1.00 0.34 C ATOM 250 C LEU A 34 -1.225 10.029 2.494 1.00 0.33 C ATOM 251 O LEU A 34 -2.427 9.970 2.667 1.00 0.29 O ATOM 252 CB LEU A 34 0.327 8.822 4.034 1.00 0.33 C ATOM 253 CG LEU A 34 0.155 7.464 4.717 1.00 0.35 C ATOM 254 CD1 LEU A 34 1.094 6.444 4.075 1.00 0.62 C ATOM 255 CD2 LEU A 34 0.491 7.599 6.204 1.00 0.33 C ATOM 0 H LEU A 34 1.652 8.953 1.922 1.00 0.35 H new ATOM 0 HA LEU A 34 -0.962 7.896 2.575 1.00 0.34 H new ATOM 0 HB2 LEU A 34 1.386 9.056 3.928 1.00 0.33 H new ATOM 0 HB3 LEU A 34 -0.113 9.608 4.647 1.00 0.33 H new ATOM 0 HG LEU A 34 -0.876 7.128 4.603 1.00 0.35 H new ATOM 0 HD11 LEU A 34 0.970 5.477 4.563 1.00 0.62 H new ATOM 0 HD12 LEU A 34 0.858 6.348 3.015 1.00 0.62 H new ATOM 0 HD13 LEU A 34 2.126 6.778 4.188 1.00 0.62 H new ATOM 0 HD21 LEU A 34 0.369 6.633 6.694 1.00 0.33 H new ATOM 0 HD22 LEU A 34 1.522 7.935 6.315 1.00 0.33 H new ATOM 0 HD23 LEU A 34 -0.179 8.326 6.664 1.00 0.33 H new ATOM 267 N ASP A 35 -0.647 11.152 2.154 1.00 0.38 N ATOM 268 CA ASP A 35 -1.467 12.386 1.973 1.00 0.37 C ATOM 269 C ASP A 35 -2.581 12.084 0.978 1.00 0.34 C ATOM 270 O ASP A 35 -3.698 12.544 1.114 1.00 0.27 O ATOM 271 CB ASP A 35 -0.587 13.516 1.439 1.00 0.41 C ATOM 272 CG ASP A 35 -0.117 14.390 2.604 1.00 0.40 C ATOM 273 OD1 ASP A 35 0.740 13.939 3.347 1.00 1.74 O ATOM 274 OD2 ASP A 35 -0.620 15.493 2.732 1.00 0.53 O ATOM 0 H ASP A 35 0.354 11.267 1.994 1.00 0.38 H new ATOM 0 HA ASP A 35 -1.894 12.695 2.927 1.00 0.37 H new ATOM 0 HB2 ASP A 35 0.272 13.103 0.910 1.00 0.41 H new ATOM 0 HB3 ASP A 35 -1.145 14.117 0.721 1.00 0.41 H new ATOM 279 N GLY A 36 -2.288 11.287 -0.007 1.00 0.42 N ATOM 280 CA GLY A 36 -3.331 10.922 -0.996 1.00 0.39 C ATOM 281 C GLY A 36 -4.369 10.057 -0.287 1.00 0.36 C ATOM 282 O GLY A 36 -5.555 10.274 -0.396 1.00 0.35 O ATOM 0 H GLY A 36 -1.370 10.873 -0.169 1.00 0.42 H new ATOM 0 HA2 GLY A 36 -3.797 11.818 -1.407 1.00 0.39 H new ATOM 0 HA3 GLY A 36 -2.890 10.380 -1.833 1.00 0.39 H new ATOM 286 N ILE A 37 -3.918 9.076 0.447 1.00 0.35 N ATOM 287 CA ILE A 37 -4.856 8.178 1.183 1.00 0.33 C ATOM 288 C ILE A 37 -5.768 8.994 2.100 1.00 0.34 C ATOM 289 O ILE A 37 -6.812 8.529 2.510 1.00 0.29 O ATOM 290 CB ILE A 37 -4.059 7.188 2.035 1.00 0.34 C ATOM 291 CG1 ILE A 37 -3.095 6.389 1.149 1.00 0.33 C ATOM 292 CG2 ILE A 37 -5.022 6.232 2.742 1.00 0.32 C ATOM 293 CD1 ILE A 37 -3.880 5.496 0.181 1.00 0.20 C ATOM 0 H ILE A 37 -2.930 8.856 0.570 1.00 0.35 H new ATOM 0 HA ILE A 37 -5.464 7.642 0.454 1.00 0.33 H new ATOM 0 HB ILE A 37 -3.482 7.739 2.778 1.00 0.34 H new ATOM 0 HG12 ILE A 37 -2.455 7.071 0.588 1.00 0.33 H new ATOM 0 HG13 ILE A 37 -2.441 5.777 1.770 1.00 0.33 H new ATOM 0 HG21 ILE A 37 -4.454 5.527 3.349 1.00 0.32 H new ATOM 0 HG22 ILE A 37 -5.696 6.802 3.382 1.00 0.32 H new ATOM 0 HG23 ILE A 37 -5.603 5.686 1.999 1.00 0.32 H new ATOM 0 HD11 ILE A 37 -3.184 4.934 -0.442 1.00 0.20 H new ATOM 0 HD12 ILE A 37 -4.500 4.802 0.748 1.00 0.20 H new ATOM 0 HD13 ILE A 37 -4.515 6.116 -0.452 1.00 0.20 H new ATOM 305 N SER A 38 -5.402 10.205 2.420 1.00 0.41 N ATOM 306 CA SER A 38 -6.279 11.022 3.296 1.00 0.43 C ATOM 307 C SER A 38 -7.537 11.326 2.506 1.00 0.34 C ATOM 308 O SER A 38 -8.648 11.209 2.991 1.00 0.31 O ATOM 309 CB SER A 38 -5.570 12.323 3.670 1.00 0.53 C ATOM 310 OG SER A 38 -4.425 12.025 4.458 1.00 1.21 O ATOM 0 H SER A 38 -4.541 10.658 2.114 1.00 0.41 H new ATOM 0 HA SER A 38 -6.518 10.489 4.216 1.00 0.43 H new ATOM 0 HB2 SER A 38 -5.276 12.862 2.769 1.00 0.53 H new ATOM 0 HB3 SER A 38 -6.247 12.973 4.224 1.00 0.53 H new ATOM 0 HG SER A 38 -3.967 12.858 4.698 1.00 1.21 H new ATOM 316 N ALA A 39 -7.364 11.690 1.270 1.00 0.34 N ATOM 317 CA ALA A 39 -8.535 11.979 0.416 1.00 0.30 C ATOM 318 C ALA A 39 -9.127 10.658 -0.082 1.00 0.24 C ATOM 319 O ALA A 39 -10.252 10.606 -0.538 1.00 0.24 O ATOM 320 CB ALA A 39 -8.104 12.835 -0.778 1.00 0.39 C ATOM 0 H ALA A 39 -6.457 11.799 0.816 1.00 0.34 H new ATOM 0 HA ALA A 39 -9.284 12.523 0.991 1.00 0.30 H new ATOM 0 HB1 ALA A 39 -8.970 13.046 -1.406 1.00 0.39 H new ATOM 0 HB2 ALA A 39 -7.679 13.772 -0.419 1.00 0.39 H new ATOM 0 HB3 ALA A 39 -7.356 12.297 -1.361 1.00 0.39 H new ATOM 326 N LEU A 40 -8.380 9.584 0.007 1.00 0.24 N ATOM 327 CA LEU A 40 -8.908 8.275 -0.459 1.00 0.17 C ATOM 328 C LEU A 40 -9.474 7.487 0.727 1.00 0.12 C ATOM 329 O LEU A 40 -10.023 6.419 0.559 1.00 0.11 O ATOM 330 CB LEU A 40 -7.788 7.462 -1.113 1.00 0.22 C ATOM 331 CG LEU A 40 -7.035 8.333 -2.119 1.00 0.28 C ATOM 332 CD1 LEU A 40 -5.645 7.743 -2.367 1.00 0.38 C ATOM 333 CD2 LEU A 40 -7.808 8.372 -3.434 1.00 0.28 C ATOM 0 H LEU A 40 -7.432 9.563 0.382 1.00 0.24 H new ATOM 0 HA LEU A 40 -9.699 8.457 -1.187 1.00 0.17 H new ATOM 0 HB2 LEU A 40 -7.101 7.094 -0.351 1.00 0.22 H new ATOM 0 HB3 LEU A 40 -8.205 6.589 -1.615 1.00 0.22 H new ATOM 0 HG LEU A 40 -6.936 9.343 -1.721 1.00 0.28 H new ATOM 0 HD11 LEU A 40 -5.109 8.364 -3.084 1.00 0.38 H new ATOM 0 HD12 LEU A 40 -5.091 7.711 -1.429 1.00 0.38 H new ATOM 0 HD13 LEU A 40 -5.744 6.733 -2.765 1.00 0.38 H new ATOM 0 HD21 LEU A 40 -7.273 8.993 -4.153 1.00 0.28 H new ATOM 0 HD22 LEU A 40 -7.905 7.361 -3.829 1.00 0.28 H new ATOM 0 HD23 LEU A 40 -8.799 8.791 -3.261 1.00 0.28 H new ATOM 345 N ARG A 41 -9.350 7.997 1.925 1.00 0.17 N ATOM 346 CA ARG A 41 -9.893 7.256 3.097 1.00 0.23 C ATOM 347 C ARG A 41 -10.854 8.151 3.886 1.00 0.18 C ATOM 348 O ARG A 41 -11.479 7.713 4.828 1.00 0.16 O ATOM 349 CB ARG A 41 -8.751 6.811 4.010 1.00 0.37 C ATOM 350 CG ARG A 41 -9.272 5.739 4.969 1.00 0.45 C ATOM 351 CD ARG A 41 -8.098 4.935 5.529 1.00 0.53 C ATOM 352 NE ARG A 41 -8.440 4.443 6.893 1.00 0.66 N ATOM 353 CZ ARG A 41 -7.964 5.050 7.944 1.00 0.68 C ATOM 354 NH1 ARG A 41 -8.430 6.219 8.289 1.00 1.30 N ATOM 355 NH2 ARG A 41 -7.022 4.488 8.650 1.00 1.59 N ATOM 0 H ARG A 41 -8.900 8.887 2.139 1.00 0.17 H new ATOM 0 HA ARG A 41 -10.430 6.379 2.736 1.00 0.23 H new ATOM 0 HB2 ARG A 41 -7.926 6.417 3.417 1.00 0.37 H new ATOM 0 HB3 ARG A 41 -8.363 7.662 4.570 1.00 0.37 H new ATOM 0 HG2 ARG A 41 -9.828 6.204 5.783 1.00 0.45 H new ATOM 0 HG3 ARG A 41 -9.964 5.077 4.448 1.00 0.45 H new ATOM 0 HD2 ARG A 41 -7.873 4.094 4.873 1.00 0.53 H new ATOM 0 HD3 ARG A 41 -7.203 5.556 5.568 1.00 0.53 H new ATOM 0 HE ARG A 41 -9.047 3.631 7.005 1.00 0.66 H new ATOM 0 HH11 ARG A 41 -9.167 6.658 7.736 1.00 1.30 H new ATOM 0 HH12 ARG A 41 -8.058 6.694 9.111 1.00 1.30 H new ATOM 0 HH21 ARG A 41 -6.658 3.574 8.380 1.00 1.59 H new ATOM 0 HH22 ARG A 41 -6.649 4.962 9.472 1.00 1.59 H new ATOM 369 N LYS A 42 -10.996 9.394 3.512 1.00 0.17 N ATOM 370 CA LYS A 42 -11.935 10.274 4.253 1.00 0.12 C ATOM 371 C LYS A 42 -13.353 9.960 3.781 1.00 0.10 C ATOM 372 O LYS A 42 -14.300 9.986 4.545 1.00 0.13 O ATOM 373 CB LYS A 42 -11.608 11.739 3.952 1.00 0.17 C ATOM 374 CG LYS A 42 -12.146 12.627 5.078 1.00 0.24 C ATOM 375 CD LYS A 42 -12.516 14.002 4.513 1.00 1.02 C ATOM 376 CE LYS A 42 -13.384 14.756 5.522 1.00 1.67 C ATOM 377 NZ LYS A 42 -12.654 14.872 6.816 1.00 1.34 N ATOM 0 H LYS A 42 -10.506 9.832 2.732 1.00 0.17 H new ATOM 0 HA LYS A 42 -11.847 10.104 5.326 1.00 0.12 H new ATOM 0 HB2 LYS A 42 -10.530 11.869 3.856 1.00 0.17 H new ATOM 0 HB3 LYS A 42 -12.051 12.033 3.000 1.00 0.17 H new ATOM 0 HG2 LYS A 42 -13.020 12.163 5.535 1.00 0.24 H new ATOM 0 HG3 LYS A 42 -11.395 12.734 5.861 1.00 0.24 H new ATOM 0 HD2 LYS A 42 -11.613 14.573 4.297 1.00 1.02 H new ATOM 0 HD3 LYS A 42 -13.053 13.887 3.571 1.00 1.02 H new ATOM 0 HE2 LYS A 42 -13.627 15.747 5.139 1.00 1.67 H new ATOM 0 HE3 LYS A 42 -14.328 14.231 5.670 1.00 1.67 H new ATOM 0 HZ1 LYS A 42 -13.085 15.623 7.392 1.00 1.34 H new ATOM 0 HZ2 LYS A 42 -12.709 13.968 7.328 1.00 1.34 H new ATOM 0 HZ3 LYS A 42 -11.657 15.106 6.633 1.00 1.34 H new ATOM 391 N GLU A 43 -13.498 9.652 2.523 1.00 0.23 N ATOM 392 CA GLU A 43 -14.840 9.333 1.980 1.00 0.37 C ATOM 393 C GLU A 43 -15.137 7.852 2.194 1.00 0.47 C ATOM 394 O GLU A 43 -16.178 7.490 2.720 1.00 0.55 O ATOM 395 CB GLU A 43 -14.861 9.642 0.480 1.00 0.48 C ATOM 396 CG GLU A 43 -16.092 10.486 0.145 1.00 0.37 C ATOM 397 CD GLU A 43 -15.659 11.735 -0.625 1.00 0.95 C ATOM 398 OE1 GLU A 43 -15.546 11.650 -1.836 1.00 1.15 O ATOM 399 OE2 GLU A 43 -15.447 12.756 0.011 1.00 2.37 O ATOM 0 H GLU A 43 -12.737 9.608 1.846 1.00 0.23 H new ATOM 0 HA GLU A 43 -15.594 9.932 2.491 1.00 0.37 H new ATOM 0 HB2 GLU A 43 -13.954 10.176 0.196 1.00 0.48 H new ATOM 0 HB3 GLU A 43 -14.877 8.714 -0.092 1.00 0.48 H new ATOM 0 HG2 GLU A 43 -16.794 9.903 -0.451 1.00 0.37 H new ATOM 0 HG3 GLU A 43 -16.611 10.771 1.060 1.00 0.37 H new ATOM 406 N THR A 44 -14.233 6.998 1.780 1.00 0.47 N ATOM 407 CA THR A 44 -14.454 5.534 1.941 1.00 0.59 C ATOM 408 C THR A 44 -13.979 5.074 3.322 1.00 0.66 C ATOM 409 O THR A 44 -13.201 4.149 3.454 1.00 0.90 O ATOM 410 CB THR A 44 -13.697 4.773 0.847 1.00 0.55 C ATOM 411 OG1 THR A 44 -14.024 3.392 0.923 1.00 0.71 O ATOM 412 CG2 THR A 44 -12.190 4.951 1.035 1.00 0.55 C ATOM 0 H THR A 44 -13.351 7.256 1.337 1.00 0.47 H new ATOM 0 HA THR A 44 -15.520 5.326 1.851 1.00 0.59 H new ATOM 0 HB THR A 44 -13.984 5.166 -0.128 1.00 0.55 H new ATOM 0 HG1 THR A 44 -13.785 3.047 1.809 1.00 0.71 H new ATOM 0 HG21 THR A 44 -11.659 4.407 0.254 1.00 0.55 H new ATOM 0 HG22 THR A 44 -11.938 6.010 0.975 1.00 0.55 H new ATOM 0 HG23 THR A 44 -11.897 4.563 2.010 1.00 0.55 H new ATOM 420 N CYS A 45 -14.463 5.708 4.345 1.00 0.53 N ATOM 421 CA CYS A 45 -14.090 5.335 5.731 1.00 0.64 C ATOM 422 C CYS A 45 -14.939 6.193 6.660 1.00 0.73 C ATOM 423 O CYS A 45 -15.488 5.722 7.635 1.00 0.91 O ATOM 424 CB CYS A 45 -12.602 5.601 5.971 1.00 0.62 C ATOM 425 SG CYS A 45 -11.888 4.264 6.964 1.00 0.94 S ATOM 0 H CYS A 45 -15.117 6.488 4.277 1.00 0.53 H new ATOM 0 HA CYS A 45 -14.265 4.274 5.911 1.00 0.64 H new ATOM 0 HB2 CYS A 45 -12.079 5.677 5.018 1.00 0.62 H new ATOM 0 HB3 CYS A 45 -12.472 6.555 6.483 1.00 0.62 H new ATOM 0 HG CYS A 45 -10.907 4.730 7.678 1.00 0.94 H new ATOM 430 N ASN A 46 -15.096 7.449 6.332 1.00 0.61 N ATOM 431 CA ASN A 46 -15.959 8.316 7.166 1.00 0.69 C ATOM 432 C ASN A 46 -17.404 7.947 6.840 1.00 0.73 C ATOM 433 O ASN A 46 -18.185 7.614 7.709 1.00 0.85 O ATOM 434 CB ASN A 46 -15.708 9.787 6.832 1.00 0.57 C ATOM 435 CG ASN A 46 -16.281 10.665 7.945 1.00 0.45 C ATOM 436 OD1 ASN A 46 -16.068 10.404 9.112 1.00 0.95 O ATOM 437 ND2 ASN A 46 -17.007 11.704 7.631 1.00 1.15 N ATOM 0 H ASN A 46 -14.665 7.903 5.527 1.00 0.61 H new ATOM 0 HA ASN A 46 -15.747 8.173 8.225 1.00 0.69 H new ATOM 0 HB2 ASN A 46 -14.639 9.970 6.724 1.00 0.57 H new ATOM 0 HB3 ASN A 46 -16.173 10.039 5.879 1.00 0.57 H new ATOM 0 HD21 ASN A 46 -17.395 12.296 8.366 1.00 1.15 H new ATOM 0 HD22 ASN A 46 -17.186 11.924 6.651 1.00 1.15 H new ATOM 444 N LYS A 47 -17.755 7.971 5.579 1.00 0.67 N ATOM 445 CA LYS A 47 -19.134 7.585 5.181 1.00 0.76 C ATOM 446 C LYS A 47 -19.169 6.092 4.834 1.00 0.86 C ATOM 447 O LYS A 47 -20.201 5.555 4.485 1.00 1.13 O ATOM 448 CB LYS A 47 -19.571 8.410 3.970 1.00 0.69 C ATOM 449 CG LYS A 47 -20.464 9.561 4.437 1.00 0.89 C ATOM 450 CD LYS A 47 -21.897 9.332 3.949 1.00 1.34 C ATOM 451 CE LYS A 47 -22.295 10.459 2.994 1.00 0.67 C ATOM 452 NZ LYS A 47 -23.246 9.933 1.974 1.00 1.66 N ATOM 0 H LYS A 47 -17.142 8.242 4.810 1.00 0.67 H new ATOM 0 HA LYS A 47 -19.817 7.777 6.009 1.00 0.76 H new ATOM 0 HB2 LYS A 47 -18.698 8.801 3.448 1.00 0.69 H new ATOM 0 HB3 LYS A 47 -20.110 7.780 3.262 1.00 0.69 H new ATOM 0 HG2 LYS A 47 -20.446 9.630 5.525 1.00 0.89 H new ATOM 0 HG3 LYS A 47 -20.085 10.508 4.052 1.00 0.89 H new ATOM 0 HD2 LYS A 47 -21.971 8.369 3.444 1.00 1.34 H new ATOM 0 HD3 LYS A 47 -22.581 9.301 4.797 1.00 1.34 H new ATOM 0 HE2 LYS A 47 -22.756 11.275 3.550 1.00 0.67 H new ATOM 0 HE3 LYS A 47 -21.410 10.866 2.506 1.00 0.67 H new ATOM 0 HZ1 LYS A 47 -23.517 10.699 1.324 1.00 1.66 H new ATOM 0 HZ2 LYS A 47 -22.790 9.168 1.437 1.00 1.66 H new ATOM 0 HZ3 LYS A 47 -24.095 9.565 2.448 1.00 1.66 H new ATOM 466 N SER A 48 -18.050 5.417 4.918 1.00 0.74 N ATOM 467 CA SER A 48 -18.035 3.968 4.585 1.00 0.81 C ATOM 468 C SER A 48 -18.469 3.155 5.802 1.00 1.12 C ATOM 469 O SER A 48 -17.730 2.990 6.751 1.00 2.32 O ATOM 470 CB SER A 48 -16.625 3.553 4.166 1.00 0.83 C ATOM 471 OG SER A 48 -16.666 2.243 3.617 1.00 1.27 O ATOM 0 H SER A 48 -17.152 5.808 5.202 1.00 0.74 H new ATOM 0 HA SER A 48 -18.726 3.780 3.763 1.00 0.81 H new ATOM 0 HB2 SER A 48 -16.230 4.255 3.432 1.00 0.83 H new ATOM 0 HB3 SER A 48 -15.955 3.579 5.025 1.00 0.83 H new ATOM 0 HG SER A 48 -15.764 1.974 3.346 1.00 1.27 H new ATOM 477 N ASN A 49 -19.669 2.641 5.770 1.00 0.69 N ATOM 478 CA ASN A 49 -20.199 1.825 6.906 1.00 0.72 C ATOM 479 C ASN A 49 -19.138 0.851 7.448 1.00 0.86 C ATOM 480 O ASN A 49 -19.219 0.411 8.578 1.00 1.41 O ATOM 481 CB ASN A 49 -21.404 1.020 6.417 1.00 1.00 C ATOM 482 CG ASN A 49 -22.537 1.973 6.032 1.00 0.67 C ATOM 483 OD1 ASN A 49 -22.362 3.175 6.031 1.00 0.85 O ATOM 484 ND2 ASN A 49 -23.700 1.481 5.700 1.00 1.59 N ATOM 0 H ASN A 49 -20.318 2.753 4.991 1.00 0.69 H new ATOM 0 HA ASN A 49 -20.482 2.504 7.710 1.00 0.72 H new ATOM 0 HB2 ASN A 49 -21.122 0.409 5.559 1.00 1.00 H new ATOM 0 HB3 ASN A 49 -21.739 0.337 7.198 1.00 1.00 H new ATOM 0 HD21 ASN A 49 -24.463 2.106 5.439 1.00 1.59 H new ATOM 0 HD22 ASN A 49 -23.846 0.471 5.701 1.00 1.59 H new ATOM 491 N MET A 50 -18.149 0.503 6.666 1.00 0.73 N ATOM 492 CA MET A 50 -17.113 -0.443 7.163 1.00 0.88 C ATOM 493 C MET A 50 -15.923 0.346 7.704 1.00 0.94 C ATOM 494 O MET A 50 -14.784 0.059 7.394 1.00 0.95 O ATOM 495 CB MET A 50 -16.648 -1.339 6.014 1.00 1.08 C ATOM 496 CG MET A 50 -17.554 -2.570 5.925 1.00 0.95 C ATOM 497 SD MET A 50 -18.928 -2.229 4.796 1.00 0.76 S ATOM 498 CE MET A 50 -18.875 -3.797 3.895 1.00 0.60 C ATOM 0 H MET A 50 -18.016 0.832 5.710 1.00 0.73 H new ATOM 0 HA MET A 50 -17.534 -1.059 7.958 1.00 0.88 H new ATOM 0 HB2 MET A 50 -16.675 -0.787 5.075 1.00 1.08 H new ATOM 0 HB3 MET A 50 -15.614 -1.646 6.174 1.00 1.08 H new ATOM 0 HG2 MET A 50 -16.984 -3.429 5.572 1.00 0.95 H new ATOM 0 HG3 MET A 50 -17.936 -2.825 6.913 1.00 0.95 H new ATOM 0 HE1 MET A 50 -19.654 -3.805 3.133 1.00 0.60 H new ATOM 0 HE2 MET A 50 -17.901 -3.911 3.420 1.00 0.60 H new ATOM 0 HE3 MET A 50 -19.038 -4.621 4.589 1.00 0.60 H new ATOM 660 N ASN A 62 -10.239 -9.266 5.830 1.00 0.37 N ATOM 661 CA ASN A 62 -8.772 -9.415 5.567 1.00 0.57 C ATOM 662 C ASN A 62 -8.548 -9.703 4.082 1.00 0.42 C ATOM 663 O ASN A 62 -8.857 -10.769 3.588 1.00 1.01 O ATOM 664 CB ASN A 62 -8.179 -10.555 6.407 1.00 1.00 C ATOM 665 CG ASN A 62 -8.740 -10.490 7.827 1.00 1.36 C ATOM 666 OD1 ASN A 62 -9.073 -9.426 8.310 1.00 0.81 O ATOM 667 ND2 ASN A 62 -8.850 -11.590 8.523 1.00 2.43 N ATOM 0 HA ASN A 62 -8.273 -8.486 5.844 1.00 0.57 H new ATOM 0 HB2 ASN A 62 -8.419 -11.517 5.954 1.00 1.00 H new ATOM 0 HB3 ASN A 62 -7.092 -10.476 6.430 1.00 1.00 H new ATOM 0 HD21 ASN A 62 -9.216 -11.557 9.474 1.00 2.43 H new ATOM 0 HD22 ASN A 62 -8.570 -12.482 8.115 1.00 2.43 H new ATOM 674 N LEU A 63 -8.013 -8.751 3.370 1.00 0.33 N ATOM 675 CA LEU A 63 -7.762 -8.941 1.914 1.00 0.30 C ATOM 676 C LEU A 63 -6.637 -9.957 1.710 1.00 0.40 C ATOM 677 O LEU A 63 -6.221 -10.632 2.630 1.00 0.49 O ATOM 678 CB LEU A 63 -7.355 -7.601 1.305 1.00 0.43 C ATOM 679 CG LEU A 63 -8.557 -6.969 0.604 1.00 0.39 C ATOM 680 CD1 LEU A 63 -8.187 -5.564 0.127 1.00 0.53 C ATOM 681 CD2 LEU A 63 -8.956 -7.828 -0.598 1.00 0.29 C ATOM 0 H LEU A 63 -7.736 -7.841 3.738 1.00 0.33 H new ATOM 0 HA LEU A 63 -8.666 -9.311 1.431 1.00 0.30 H new ATOM 0 HB2 LEU A 63 -6.984 -6.934 2.083 1.00 0.43 H new ATOM 0 HB3 LEU A 63 -6.541 -7.745 0.594 1.00 0.43 H new ATOM 0 HG LEU A 63 -9.394 -6.908 1.300 1.00 0.39 H new ATOM 0 HD11 LEU A 63 -9.044 -5.112 -0.373 1.00 0.53 H new ATOM 0 HD12 LEU A 63 -7.903 -4.952 0.983 1.00 0.53 H new ATOM 0 HD13 LEU A 63 -7.351 -5.625 -0.569 1.00 0.53 H new ATOM 0 HD21 LEU A 63 -9.813 -7.378 -1.098 1.00 0.29 H new ATOM 0 HD22 LEU A 63 -8.120 -7.889 -1.295 1.00 0.29 H new ATOM 0 HD23 LEU A 63 -9.219 -8.830 -0.258 1.00 0.29 H new ATOM 693 N ASN A 64 -6.142 -10.073 0.507 1.00 0.64 N ATOM 694 CA ASN A 64 -5.048 -11.047 0.243 1.00 0.98 C ATOM 695 C ASN A 64 -3.794 -10.303 -0.218 1.00 0.99 C ATOM 696 O ASN A 64 -3.320 -10.486 -1.322 1.00 1.52 O ATOM 697 CB ASN A 64 -5.489 -12.024 -0.850 1.00 1.29 C ATOM 698 CG ASN A 64 -4.556 -13.236 -0.862 1.00 1.11 C ATOM 699 OD1 ASN A 64 -4.509 -13.992 0.088 1.00 1.36 O ATOM 700 ND2 ASN A 64 -3.804 -13.456 -1.907 1.00 1.84 N ATOM 0 H ASN A 64 -6.449 -9.535 -0.303 1.00 0.64 H new ATOM 0 HA ASN A 64 -4.826 -11.596 1.158 1.00 0.98 H new ATOM 0 HB2 ASN A 64 -6.516 -12.344 -0.673 1.00 1.29 H new ATOM 0 HB3 ASN A 64 -5.473 -11.530 -1.822 1.00 1.29 H new ATOM 0 HD21 ASN A 64 -3.179 -14.262 -1.925 1.00 1.84 H new ATOM 0 HD22 ASN A 64 -3.842 -12.822 -2.705 1.00 1.84 H new ATOM 707 N LEU A 65 -3.251 -9.466 0.622 1.00 0.62 N ATOM 708 CA LEU A 65 -2.026 -8.713 0.239 1.00 0.66 C ATOM 709 C LEU A 65 -0.975 -8.863 1.347 1.00 0.89 C ATOM 710 O LEU A 65 -1.317 -9.183 2.468 1.00 1.59 O ATOM 711 CB LEU A 65 -2.376 -7.237 0.039 1.00 0.50 C ATOM 712 CG LEU A 65 -2.918 -6.647 1.338 1.00 0.62 C ATOM 713 CD1 LEU A 65 -2.452 -5.196 1.455 1.00 0.48 C ATOM 714 CD2 LEU A 65 -4.446 -6.690 1.319 1.00 0.72 C ATOM 0 H LEU A 65 -3.604 -9.271 1.559 1.00 0.62 H new ATOM 0 HA LEU A 65 -1.623 -9.109 -0.693 1.00 0.66 H new ATOM 0 HB2 LEU A 65 -1.492 -6.685 -0.279 1.00 0.50 H new ATOM 0 HB3 LEU A 65 -3.118 -7.135 -0.753 1.00 0.50 H new ATOM 0 HG LEU A 65 -2.552 -7.224 2.187 1.00 0.62 H new ATOM 0 HD11 LEU A 65 -2.834 -4.765 2.380 1.00 0.48 H new ATOM 0 HD12 LEU A 65 -1.363 -5.163 1.462 1.00 0.48 H new ATOM 0 HD13 LEU A 65 -2.827 -4.624 0.606 1.00 0.48 H new ATOM 0 HD21 LEU A 65 -4.833 -6.269 2.247 1.00 0.72 H new ATOM 0 HD22 LEU A 65 -4.816 -6.109 0.474 1.00 0.72 H new ATOM 0 HD23 LEU A 65 -4.780 -7.723 1.223 1.00 0.72 H new ATOM 726 N PRO A 66 0.277 -8.637 1.011 1.00 1.78 N ATOM 727 CA PRO A 66 1.378 -8.756 1.983 1.00 1.94 C ATOM 728 C PRO A 66 1.406 -7.541 2.913 1.00 1.19 C ATOM 729 O PRO A 66 1.601 -6.421 2.484 1.00 2.35 O ATOM 730 CB PRO A 66 2.633 -8.811 1.105 1.00 3.71 C ATOM 731 CG PRO A 66 2.249 -8.167 -0.247 1.00 4.47 C ATOM 732 CD PRO A 66 0.714 -8.243 -0.349 1.00 3.26 C ATOM 0 HA PRO A 66 1.285 -9.627 2.632 1.00 1.94 H new ATOM 0 HB2 PRO A 66 3.457 -8.272 1.572 1.00 3.71 H new ATOM 0 HB3 PRO A 66 2.964 -9.840 0.965 1.00 3.71 H new ATOM 0 HG2 PRO A 66 2.590 -7.133 -0.294 1.00 4.47 H new ATOM 0 HG3 PRO A 66 2.719 -8.696 -1.076 1.00 4.47 H new ATOM 0 HD2 PRO A 66 0.287 -7.284 -0.642 1.00 3.26 H new ATOM 0 HD3 PRO A 66 0.400 -8.973 -1.095 1.00 3.26 H new ATOM 740 N LYS A 67 1.208 -7.756 4.185 1.00 0.70 N ATOM 741 CA LYS A 67 1.219 -6.617 5.145 1.00 2.16 C ATOM 742 C LYS A 67 2.205 -6.913 6.278 1.00 1.84 C ATOM 743 O LYS A 67 2.496 -8.054 6.577 1.00 2.45 O ATOM 744 CB LYS A 67 -0.183 -6.426 5.730 1.00 3.61 C ATOM 745 CG LYS A 67 -0.624 -7.705 6.445 1.00 4.27 C ATOM 746 CD LYS A 67 -1.328 -8.629 5.452 1.00 4.21 C ATOM 747 CE LYS A 67 -2.834 -8.608 5.717 1.00 5.71 C ATOM 748 NZ LYS A 67 -3.188 -9.714 6.651 1.00 6.17 N ATOM 0 H LYS A 67 1.039 -8.672 4.601 1.00 0.70 H new ATOM 0 HA LYS A 67 1.523 -5.709 4.624 1.00 2.16 H new ATOM 0 HB2 LYS A 67 -0.185 -5.589 6.428 1.00 3.61 H new ATOM 0 HB3 LYS A 67 -0.888 -6.181 4.936 1.00 3.61 H new ATOM 0 HG2 LYS A 67 0.241 -8.209 6.877 1.00 4.27 H new ATOM 0 HG3 LYS A 67 -1.295 -7.461 7.269 1.00 4.27 H new ATOM 0 HD2 LYS A 67 -1.123 -8.307 4.431 1.00 4.21 H new ATOM 0 HD3 LYS A 67 -0.945 -9.645 5.549 1.00 4.21 H new ATOM 0 HE2 LYS A 67 -3.126 -7.649 6.145 1.00 5.71 H new ATOM 0 HE3 LYS A 67 -3.381 -8.719 4.781 1.00 5.71 H new ATOM 0 HZ1 LYS A 67 -4.212 -9.701 6.832 1.00 6.17 H new ATOM 0 HZ2 LYS A 67 -2.923 -10.625 6.226 1.00 6.17 H new ATOM 0 HZ3 LYS A 67 -2.676 -9.588 7.548 1.00 6.17 H new ATOM 762 N MET A 68 2.713 -5.895 6.915 1.00 1.81 N ATOM 763 CA MET A 68 3.671 -6.119 8.032 1.00 1.36 C ATOM 764 C MET A 68 2.941 -6.814 9.182 1.00 1.57 C ATOM 765 O MET A 68 1.744 -6.678 9.339 1.00 1.97 O ATOM 766 CB MET A 68 4.217 -4.772 8.511 1.00 1.27 C ATOM 767 CG MET A 68 4.842 -4.020 7.332 1.00 1.23 C ATOM 768 SD MET A 68 6.313 -3.131 7.899 1.00 0.85 S ATOM 769 CE MET A 68 6.432 -1.962 6.522 1.00 1.02 C ATOM 0 H MET A 68 2.506 -4.918 6.710 1.00 1.81 H new ATOM 0 HA MET A 68 4.498 -6.742 7.692 1.00 1.36 H new ATOM 0 HB2 MET A 68 3.415 -4.178 8.949 1.00 1.27 H new ATOM 0 HB3 MET A 68 4.962 -4.927 9.292 1.00 1.27 H new ATOM 0 HG2 MET A 68 5.109 -4.720 6.540 1.00 1.23 H new ATOM 0 HG3 MET A 68 4.121 -3.320 6.909 1.00 1.23 H new ATOM 0 HE1 MET A 68 7.160 -1.188 6.764 1.00 1.02 H new ATOM 0 HE2 MET A 68 6.749 -2.490 5.623 1.00 1.02 H new ATOM 0 HE3 MET A 68 5.459 -1.503 6.349 1.00 1.02 H new ATOM 779 N ALA A 69 3.647 -7.558 9.988 1.00 1.53 N ATOM 780 CA ALA A 69 2.981 -8.258 11.121 1.00 1.93 C ATOM 781 C ALA A 69 4.034 -8.737 12.120 1.00 2.09 C ATOM 782 O ALA A 69 3.890 -9.781 12.723 1.00 3.66 O ATOM 783 CB ALA A 69 2.198 -9.460 10.590 1.00 2.45 C ATOM 0 H ALA A 69 4.653 -7.711 9.911 1.00 1.53 H new ATOM 0 HA ALA A 69 2.298 -7.570 11.618 1.00 1.93 H new ATOM 0 HB1 ALA A 69 1.711 -9.972 11.420 1.00 2.45 H new ATOM 0 HB2 ALA A 69 1.444 -9.119 9.881 1.00 2.45 H new ATOM 0 HB3 ALA A 69 2.881 -10.147 10.090 1.00 2.45 H new ATOM 789 N GLU A 70 5.087 -7.969 12.298 1.00 1.41 N ATOM 790 CA GLU A 70 6.184 -8.337 13.259 1.00 1.24 C ATOM 791 C GLU A 70 7.172 -9.306 12.596 1.00 1.47 C ATOM 792 O GLU A 70 8.371 -9.140 12.698 1.00 1.45 O ATOM 793 CB GLU A 70 5.607 -8.980 14.530 1.00 1.36 C ATOM 794 CG GLU A 70 4.355 -8.215 14.967 1.00 2.30 C ATOM 795 CD GLU A 70 4.328 -8.104 16.493 1.00 1.89 C ATOM 796 OE1 GLU A 70 4.237 -9.134 17.141 1.00 1.75 O ATOM 797 OE2 GLU A 70 4.398 -6.992 16.987 1.00 2.17 O ATOM 0 H GLU A 70 5.236 -7.086 11.809 1.00 1.41 H new ATOM 0 HA GLU A 70 6.708 -7.422 13.536 1.00 1.24 H new ATOM 0 HB2 GLU A 70 5.360 -10.025 14.342 1.00 1.36 H new ATOM 0 HB3 GLU A 70 6.351 -8.967 15.327 1.00 1.36 H new ATOM 0 HG2 GLU A 70 4.349 -7.221 14.520 1.00 2.30 H new ATOM 0 HG3 GLU A 70 3.461 -8.729 14.614 1.00 2.30 H new ATOM 804 N LYS A 71 6.691 -10.315 11.919 1.00 1.69 N ATOM 805 CA LYS A 71 7.621 -11.278 11.263 1.00 1.91 C ATOM 806 C LYS A 71 8.423 -10.557 10.178 1.00 1.80 C ATOM 807 O LYS A 71 9.569 -10.871 9.927 1.00 1.77 O ATOM 808 CB LYS A 71 6.813 -12.415 10.631 1.00 2.25 C ATOM 809 CG LYS A 71 7.766 -13.414 9.969 1.00 2.18 C ATOM 810 CD LYS A 71 7.376 -14.839 10.370 1.00 1.86 C ATOM 811 CE LYS A 71 6.232 -15.328 9.479 1.00 2.67 C ATOM 812 NZ LYS A 71 4.946 -14.746 9.957 1.00 2.86 N ATOM 0 H LYS A 71 5.698 -10.513 11.793 1.00 1.69 H new ATOM 0 HA LYS A 71 8.305 -11.687 12.007 1.00 1.91 H new ATOM 0 HB2 LYS A 71 6.215 -12.917 11.392 1.00 2.25 H new ATOM 0 HB3 LYS A 71 6.119 -12.015 9.892 1.00 2.25 H new ATOM 0 HG2 LYS A 71 7.726 -13.307 8.885 1.00 2.18 H new ATOM 0 HG3 LYS A 71 8.793 -13.208 10.272 1.00 2.18 H new ATOM 0 HD2 LYS A 71 8.235 -15.503 10.273 1.00 1.86 H new ATOM 0 HD3 LYS A 71 7.071 -14.863 11.416 1.00 1.86 H new ATOM 0 HE2 LYS A 71 6.413 -15.037 8.444 1.00 2.67 H new ATOM 0 HE3 LYS A 71 6.181 -16.417 9.500 1.00 2.67 H new ATOM 0 HZ1 LYS A 71 4.161 -15.378 9.698 1.00 2.86 H new ATOM 0 HZ2 LYS A 71 4.977 -14.638 10.991 1.00 2.86 H new ATOM 0 HZ3 LYS A 71 4.801 -13.815 9.516 1.00 2.86 H new ATOM 826 N ASP A 72 7.827 -9.592 9.529 1.00 1.76 N ATOM 827 CA ASP A 72 8.554 -8.851 8.458 1.00 1.68 C ATOM 828 C ASP A 72 9.870 -8.302 9.013 1.00 1.11 C ATOM 829 O ASP A 72 10.862 -8.220 8.316 1.00 0.96 O ATOM 830 CB ASP A 72 7.687 -7.691 7.964 1.00 1.91 C ATOM 831 CG ASP A 72 6.525 -8.238 7.133 1.00 2.85 C ATOM 832 OD1 ASP A 72 6.141 -9.374 7.361 1.00 3.46 O ATOM 833 OD2 ASP A 72 6.038 -7.511 6.281 1.00 3.21 O ATOM 0 H ASP A 72 6.868 -9.285 9.694 1.00 1.76 H new ATOM 0 HA ASP A 72 8.766 -9.528 7.630 1.00 1.68 H new ATOM 0 HB2 ASP A 72 7.305 -7.122 8.812 1.00 1.91 H new ATOM 0 HB3 ASP A 72 8.286 -7.006 7.364 1.00 1.91 H new ATOM 838 N GLY A 73 9.886 -7.923 10.261 1.00 0.91 N ATOM 839 CA GLY A 73 11.139 -7.377 10.858 1.00 0.56 C ATOM 840 C GLY A 73 11.133 -5.851 10.747 1.00 0.51 C ATOM 841 O GLY A 73 12.164 -5.222 10.617 1.00 0.41 O ATOM 0 H GLY A 73 9.087 -7.967 10.893 1.00 0.91 H new ATOM 0 HA2 GLY A 73 11.217 -7.676 11.903 1.00 0.56 H new ATOM 0 HA3 GLY A 73 12.008 -7.786 10.344 1.00 0.56 H new ATOM 845 N CYS A 74 9.975 -5.252 10.794 1.00 0.71 N ATOM 846 CA CYS A 74 9.897 -3.767 10.689 1.00 0.71 C ATOM 847 C CYS A 74 9.410 -3.186 12.018 1.00 0.85 C ATOM 848 O CYS A 74 8.519 -2.361 12.056 1.00 1.20 O ATOM 849 CB CYS A 74 8.917 -3.394 9.577 1.00 0.73 C ATOM 850 SG CYS A 74 9.496 -4.082 8.007 1.00 1.26 S ATOM 0 H CYS A 74 9.079 -5.727 10.901 1.00 0.71 H new ATOM 0 HA CYS A 74 10.883 -3.362 10.459 1.00 0.71 H new ATOM 0 HB2 CYS A 74 7.923 -3.777 9.810 1.00 0.73 H new ATOM 0 HB3 CYS A 74 8.831 -2.310 9.502 1.00 0.73 H new ATOM 855 N PHE A 75 9.990 -3.608 13.108 1.00 0.58 N ATOM 856 CA PHE A 75 9.559 -3.079 14.433 1.00 0.71 C ATOM 857 C PHE A 75 10.719 -3.182 15.423 1.00 0.69 C ATOM 858 O PHE A 75 11.729 -3.799 15.149 1.00 0.42 O ATOM 859 CB PHE A 75 8.376 -3.898 14.950 1.00 0.76 C ATOM 860 CG PHE A 75 7.139 -3.548 14.157 1.00 0.89 C ATOM 861 CD1 PHE A 75 6.480 -2.335 14.389 1.00 1.28 C ATOM 862 CD2 PHE A 75 6.654 -4.436 13.191 1.00 1.15 C ATOM 863 CE1 PHE A 75 5.334 -2.010 13.653 1.00 1.42 C ATOM 864 CE2 PHE A 75 5.509 -4.111 12.455 1.00 1.20 C ATOM 865 CZ PHE A 75 4.848 -2.898 12.686 1.00 1.14 C ATOM 0 H PHE A 75 10.743 -4.295 13.139 1.00 0.58 H new ATOM 0 HA PHE A 75 9.260 -2.036 14.328 1.00 0.71 H new ATOM 0 HB2 PHE A 75 8.590 -4.963 14.860 1.00 0.76 H new ATOM 0 HB3 PHE A 75 8.213 -3.694 16.008 1.00 0.76 H new ATOM 0 HD1 PHE A 75 6.855 -1.650 15.135 1.00 1.28 H new ATOM 0 HD2 PHE A 75 7.163 -5.372 13.013 1.00 1.15 H new ATOM 0 HE1 PHE A 75 4.825 -1.074 13.831 1.00 1.42 H new ATOM 0 HE2 PHE A 75 5.135 -4.796 11.708 1.00 1.20 H new ATOM 0 HZ PHE A 75 3.964 -2.648 12.118 1.00 1.14 H new ATOM 875 N GLN A 76 10.585 -2.582 16.575 1.00 1.09 N ATOM 876 CA GLN A 76 11.680 -2.647 17.582 1.00 1.17 C ATOM 877 C GLN A 76 12.024 -4.111 17.869 1.00 1.06 C ATOM 878 O GLN A 76 13.175 -4.501 17.853 1.00 0.96 O ATOM 879 CB GLN A 76 11.226 -1.967 18.875 1.00 1.39 C ATOM 880 CG GLN A 76 12.452 -1.531 19.678 1.00 1.35 C ATOM 881 CD GLN A 76 12.781 -0.072 19.355 1.00 1.64 C ATOM 882 OE1 GLN A 76 13.912 0.257 19.059 1.00 2.07 O ATOM 883 NE2 GLN A 76 11.832 0.824 19.401 1.00 2.62 N ATOM 0 H GLN A 76 9.763 -2.050 16.861 1.00 1.09 H new ATOM 0 HA GLN A 76 12.561 -2.136 17.193 1.00 1.17 H new ATOM 0 HB2 GLN A 76 10.602 -1.103 18.645 1.00 1.39 H new ATOM 0 HB3 GLN A 76 10.617 -2.652 19.464 1.00 1.39 H new ATOM 0 HG2 GLN A 76 12.260 -1.644 20.745 1.00 1.35 H new ATOM 0 HG3 GLN A 76 13.303 -2.169 19.438 1.00 1.35 H new ATOM 0 HE21 GLN A 76 10.882 0.548 19.650 1.00 2.62 H new ATOM 0 HE22 GLN A 76 12.041 1.799 19.188 1.00 2.62 H new ATOM 892 N SER A 77 11.036 -4.926 18.126 1.00 1.16 N ATOM 893 CA SER A 77 11.309 -6.364 18.408 1.00 1.09 C ATOM 894 C SER A 77 12.140 -6.958 17.268 1.00 1.02 C ATOM 895 O SER A 77 11.636 -7.230 16.196 1.00 1.28 O ATOM 896 CB SER A 77 9.984 -7.120 18.522 1.00 1.13 C ATOM 897 OG SER A 77 10.132 -8.190 19.447 1.00 1.14 O ATOM 0 H SER A 77 10.052 -4.658 18.153 1.00 1.16 H new ATOM 0 HA SER A 77 11.860 -6.454 19.344 1.00 1.09 H new ATOM 0 HB2 SER A 77 9.194 -6.445 18.852 1.00 1.13 H new ATOM 0 HB3 SER A 77 9.687 -7.506 17.547 1.00 1.13 H new ATOM 0 HG SER A 77 9.284 -8.676 19.524 1.00 1.14 H new ATOM 903 N GLY A 78 13.411 -7.154 17.487 1.00 1.07 N ATOM 904 CA GLY A 78 14.273 -7.722 16.410 1.00 1.01 C ATOM 905 C GLY A 78 14.173 -6.838 15.166 1.00 1.06 C ATOM 906 O GLY A 78 13.839 -7.295 14.092 1.00 1.18 O ATOM 0 H GLY A 78 13.890 -6.946 18.363 1.00 1.07 H new ATOM 0 HA2 GLY A 78 15.308 -7.779 16.748 1.00 1.01 H new ATOM 0 HA3 GLY A 78 13.958 -8.739 16.174 1.00 1.01 H new ATOM 910 N PHE A 79 14.455 -5.572 15.309 1.00 0.99 N ATOM 911 CA PHE A 79 14.372 -4.648 14.141 1.00 1.04 C ATOM 912 C PHE A 79 15.450 -5.008 13.114 1.00 0.99 C ATOM 913 O PHE A 79 16.626 -5.033 13.416 1.00 0.89 O ATOM 914 CB PHE A 79 14.585 -3.210 14.622 1.00 1.07 C ATOM 915 CG PHE A 79 14.509 -2.262 13.449 1.00 1.03 C ATOM 916 CD1 PHE A 79 13.297 -2.079 12.773 1.00 1.28 C ATOM 917 CD2 PHE A 79 15.651 -1.563 13.039 1.00 0.78 C ATOM 918 CE1 PHE A 79 13.227 -1.198 11.687 1.00 1.25 C ATOM 919 CE2 PHE A 79 15.582 -0.682 11.954 1.00 0.74 C ATOM 920 CZ PHE A 79 14.369 -0.499 11.277 1.00 0.96 C ATOM 0 H PHE A 79 14.740 -5.136 16.186 1.00 0.99 H new ATOM 0 HA PHE A 79 13.391 -4.740 13.675 1.00 1.04 H new ATOM 0 HB2 PHE A 79 13.829 -2.949 15.362 1.00 1.07 H new ATOM 0 HB3 PHE A 79 15.555 -3.120 15.112 1.00 1.07 H new ATOM 0 HD1 PHE A 79 12.416 -2.617 13.089 1.00 1.28 H new ATOM 0 HD2 PHE A 79 16.586 -1.704 13.561 1.00 0.78 H new ATOM 0 HE1 PHE A 79 12.292 -1.058 11.165 1.00 1.25 H new ATOM 0 HE2 PHE A 79 16.463 -0.143 11.639 1.00 0.74 H new ATOM 0 HZ PHE A 79 14.315 0.181 10.439 1.00 0.96 H new ATOM 930 N ASN A 80 15.055 -5.277 11.900 1.00 1.07 N ATOM 931 CA ASN A 80 16.053 -5.625 10.848 1.00 1.03 C ATOM 932 C ASN A 80 16.287 -4.400 9.960 1.00 1.08 C ATOM 933 O ASN A 80 15.892 -3.301 10.292 1.00 1.77 O ATOM 934 CB ASN A 80 15.518 -6.782 9.999 1.00 1.03 C ATOM 935 CG ASN A 80 16.418 -8.006 10.174 1.00 0.69 C ATOM 936 OD1 ASN A 80 17.416 -8.143 9.496 1.00 0.70 O ATOM 937 ND2 ASN A 80 16.104 -8.912 11.061 1.00 1.45 N ATOM 0 H ASN A 80 14.083 -5.271 11.590 1.00 1.07 H new ATOM 0 HA ASN A 80 16.992 -5.926 11.313 1.00 1.03 H new ATOM 0 HB2 ASN A 80 14.497 -7.023 10.296 1.00 1.03 H new ATOM 0 HB3 ASN A 80 15.484 -6.490 8.949 1.00 1.03 H new ATOM 0 HD21 ASN A 80 16.697 -9.733 11.183 1.00 1.45 H new ATOM 0 HD22 ASN A 80 15.266 -8.798 11.631 1.00 1.45 H new ATOM 944 N GLU A 81 16.925 -4.574 8.833 1.00 0.48 N ATOM 945 CA GLU A 81 17.176 -3.407 7.938 1.00 0.49 C ATOM 946 C GLU A 81 16.978 -3.820 6.476 1.00 0.39 C ATOM 947 O GLU A 81 16.147 -3.276 5.776 1.00 0.33 O ATOM 948 CB GLU A 81 18.610 -2.910 8.138 1.00 0.57 C ATOM 949 CG GLU A 81 18.730 -2.230 9.503 1.00 0.72 C ATOM 950 CD GLU A 81 19.920 -1.268 9.492 1.00 0.82 C ATOM 951 OE1 GLU A 81 20.030 -0.504 8.546 1.00 1.54 O ATOM 952 OE2 GLU A 81 20.699 -1.310 10.429 1.00 0.74 O ATOM 0 H GLU A 81 17.281 -5.468 8.495 1.00 0.48 H new ATOM 0 HA GLU A 81 16.475 -2.609 8.183 1.00 0.49 H new ATOM 0 HB2 GLU A 81 19.308 -3.745 8.074 1.00 0.57 H new ATOM 0 HB3 GLU A 81 18.877 -2.210 7.347 1.00 0.57 H new ATOM 0 HG2 GLU A 81 17.813 -1.688 9.733 1.00 0.72 H new ATOM 0 HG3 GLU A 81 18.862 -2.979 10.284 1.00 0.72 H new ATOM 959 N GLU A 82 17.740 -4.770 6.009 1.00 0.41 N ATOM 960 CA GLU A 82 17.601 -5.211 4.590 1.00 0.33 C ATOM 961 C GLU A 82 16.377 -6.122 4.444 1.00 0.24 C ATOM 962 O GLU A 82 15.824 -6.267 3.370 1.00 0.20 O ATOM 963 CB GLU A 82 18.860 -5.977 4.176 1.00 0.31 C ATOM 964 CG GLU A 82 18.715 -6.460 2.731 1.00 0.39 C ATOM 965 CD GLU A 82 18.367 -7.948 2.724 1.00 1.24 C ATOM 966 OE1 GLU A 82 17.190 -8.261 2.779 1.00 2.12 O ATOM 967 OE2 GLU A 82 19.285 -8.752 2.665 1.00 1.40 O ATOM 0 H GLU A 82 18.454 -5.261 6.548 1.00 0.41 H new ATOM 0 HA GLU A 82 17.473 -4.338 3.951 1.00 0.33 H new ATOM 0 HB2 GLU A 82 19.736 -5.335 4.269 1.00 0.31 H new ATOM 0 HB3 GLU A 82 19.016 -6.827 4.840 1.00 0.31 H new ATOM 0 HG2 GLU A 82 17.937 -5.891 2.222 1.00 0.39 H new ATOM 0 HG3 GLU A 82 19.643 -6.290 2.185 1.00 0.39 H new ATOM 974 N THR A 83 15.942 -6.731 5.513 1.00 0.23 N ATOM 975 CA THR A 83 14.757 -7.624 5.427 1.00 0.20 C ATOM 976 C THR A 83 13.496 -6.767 5.405 1.00 0.23 C ATOM 977 O THR A 83 12.541 -7.058 4.710 1.00 0.18 O ATOM 978 CB THR A 83 14.732 -8.552 6.647 1.00 0.23 C ATOM 979 OG1 THR A 83 15.905 -9.352 6.656 1.00 0.28 O ATOM 980 CG2 THR A 83 13.499 -9.453 6.585 1.00 0.24 C ATOM 0 H THR A 83 16.357 -6.647 6.441 1.00 0.23 H new ATOM 0 HA THR A 83 14.807 -8.227 4.520 1.00 0.20 H new ATOM 0 HB THR A 83 14.693 -7.952 7.556 1.00 0.23 H new ATOM 0 HG1 THR A 83 15.891 -9.944 7.437 1.00 0.28 H new ATOM 0 HG21 THR A 83 13.485 -10.111 7.454 1.00 0.24 H new ATOM 0 HG22 THR A 83 12.599 -8.838 6.581 1.00 0.24 H new ATOM 0 HG23 THR A 83 13.532 -10.053 5.676 1.00 0.24 H new ATOM 988 N CYS A 84 13.490 -5.703 6.156 1.00 0.31 N ATOM 989 CA CYS A 84 12.298 -4.820 6.175 1.00 0.33 C ATOM 990 C CYS A 84 12.191 -4.097 4.833 1.00 0.29 C ATOM 991 O CYS A 84 11.153 -4.088 4.204 1.00 0.28 O ATOM 992 CB CYS A 84 12.430 -3.797 7.307 1.00 0.42 C ATOM 993 SG CYS A 84 10.926 -2.793 7.394 1.00 0.87 S ATOM 0 H CYS A 84 14.260 -5.408 6.757 1.00 0.31 H new ATOM 0 HA CYS A 84 11.401 -5.417 6.341 1.00 0.33 H new ATOM 0 HB2 CYS A 84 12.594 -4.308 8.256 1.00 0.42 H new ATOM 0 HB3 CYS A 84 13.297 -3.159 7.135 1.00 0.42 H new ATOM 998 N LEU A 85 13.262 -3.495 4.388 1.00 0.29 N ATOM 999 CA LEU A 85 13.227 -2.773 3.084 1.00 0.28 C ATOM 1000 C LEU A 85 12.768 -3.728 1.979 1.00 0.24 C ATOM 1001 O LEU A 85 12.027 -3.352 1.093 1.00 0.21 O ATOM 1002 CB LEU A 85 14.626 -2.247 2.757 1.00 0.29 C ATOM 1003 CG LEU A 85 14.535 -1.203 1.644 1.00 0.32 C ATOM 1004 CD1 LEU A 85 13.643 -0.047 2.098 1.00 0.46 C ATOM 1005 CD2 LEU A 85 15.936 -0.669 1.332 1.00 0.50 C ATOM 0 H LEU A 85 14.160 -3.472 4.872 1.00 0.29 H new ATOM 0 HA LEU A 85 12.530 -1.938 3.151 1.00 0.28 H new ATOM 0 HB2 LEU A 85 15.077 -1.807 3.646 1.00 0.29 H new ATOM 0 HB3 LEU A 85 15.271 -3.069 2.446 1.00 0.29 H new ATOM 0 HG LEU A 85 14.110 -1.662 0.751 1.00 0.32 H new ATOM 0 HD11 LEU A 85 13.579 0.697 1.304 1.00 0.46 H new ATOM 0 HD12 LEU A 85 12.645 -0.424 2.324 1.00 0.46 H new ATOM 0 HD13 LEU A 85 14.068 0.412 2.991 1.00 0.46 H new ATOM 0 HD21 LEU A 85 15.873 0.076 0.538 1.00 0.50 H new ATOM 0 HD22 LEU A 85 16.358 -0.211 2.227 1.00 0.50 H new ATOM 0 HD23 LEU A 85 16.575 -1.491 1.009 1.00 0.50 H new ATOM 1017 N VAL A 86 13.201 -4.959 2.019 1.00 0.24 N ATOM 1018 CA VAL A 86 12.777 -5.924 0.967 1.00 0.22 C ATOM 1019 C VAL A 86 11.251 -6.030 0.977 1.00 0.21 C ATOM 1020 O VAL A 86 10.613 -5.907 -0.045 1.00 0.23 O ATOM 1021 CB VAL A 86 13.414 -7.295 1.244 1.00 0.27 C ATOM 1022 CG1 VAL A 86 12.788 -8.370 0.347 1.00 0.23 C ATOM 1023 CG2 VAL A 86 14.914 -7.216 0.953 1.00 0.29 C ATOM 0 H VAL A 86 13.827 -5.336 2.731 1.00 0.24 H new ATOM 0 HA VAL A 86 13.105 -5.580 -0.014 1.00 0.22 H new ATOM 0 HB VAL A 86 13.242 -7.560 2.287 1.00 0.27 H new ATOM 0 HG11 VAL A 86 13.251 -9.334 0.557 1.00 0.23 H new ATOM 0 HG12 VAL A 86 11.718 -8.431 0.545 1.00 0.23 H new ATOM 0 HG13 VAL A 86 12.949 -8.110 -0.699 1.00 0.23 H new ATOM 0 HG21 VAL A 86 15.374 -8.185 1.147 1.00 0.29 H new ATOM 0 HG22 VAL A 86 15.068 -6.944 -0.091 1.00 0.29 H new ATOM 0 HG23 VAL A 86 15.370 -6.463 1.595 1.00 0.29 H new ATOM 1033 N LYS A 87 10.658 -6.253 2.116 1.00 0.26 N ATOM 1034 CA LYS A 87 9.173 -6.358 2.159 1.00 0.29 C ATOM 1035 C LYS A 87 8.557 -5.030 1.704 1.00 0.26 C ATOM 1036 O LYS A 87 7.416 -4.978 1.292 1.00 0.36 O ATOM 1037 CB LYS A 87 8.719 -6.674 3.585 1.00 0.36 C ATOM 1038 CG LYS A 87 8.832 -8.179 3.833 1.00 0.36 C ATOM 1039 CD LYS A 87 7.713 -8.905 3.084 1.00 0.84 C ATOM 1040 CE LYS A 87 7.061 -9.930 4.013 1.00 1.21 C ATOM 1041 NZ LYS A 87 7.956 -11.112 4.155 1.00 0.36 N ATOM 0 H LYS A 87 11.132 -6.366 3.012 1.00 0.26 H new ATOM 0 HA LYS A 87 8.846 -7.158 1.495 1.00 0.29 H new ATOM 0 HB2 LYS A 87 9.332 -6.129 4.303 1.00 0.36 H new ATOM 0 HB3 LYS A 87 7.690 -6.346 3.732 1.00 0.36 H new ATOM 0 HG2 LYS A 87 9.804 -8.542 3.497 1.00 0.36 H new ATOM 0 HG3 LYS A 87 8.765 -8.388 4.901 1.00 0.36 H new ATOM 0 HD2 LYS A 87 6.969 -8.188 2.736 1.00 0.84 H new ATOM 0 HD3 LYS A 87 8.115 -9.402 2.201 1.00 0.84 H new ATOM 0 HE2 LYS A 87 6.873 -9.484 4.989 1.00 1.21 H new ATOM 0 HE3 LYS A 87 6.095 -10.238 3.612 1.00 1.21 H new ATOM 0 HZ1 LYS A 87 7.513 -11.809 4.787 1.00 0.36 H new ATOM 0 HZ2 LYS A 87 8.114 -11.542 3.221 1.00 0.36 H new ATOM 0 HZ3 LYS A 87 8.867 -10.811 4.556 1.00 0.36 H new ATOM 1055 N ILE A 88 9.304 -3.956 1.765 1.00 0.17 N ATOM 1056 CA ILE A 88 8.753 -2.643 1.316 1.00 0.23 C ATOM 1057 C ILE A 88 8.686 -2.646 -0.213 1.00 0.24 C ATOM 1058 O ILE A 88 7.768 -2.117 -0.803 1.00 0.28 O ATOM 1059 CB ILE A 88 9.659 -1.501 1.799 1.00 0.22 C ATOM 1060 CG1 ILE A 88 9.617 -1.428 3.328 1.00 0.33 C ATOM 1061 CG2 ILE A 88 9.174 -0.170 1.218 1.00 0.33 C ATOM 1062 CD1 ILE A 88 8.187 -1.140 3.790 1.00 0.20 C ATOM 0 H ILE A 88 10.266 -3.932 2.104 1.00 0.17 H new ATOM 0 HA ILE A 88 7.757 -2.493 1.734 1.00 0.23 H new ATOM 0 HB ILE A 88 10.680 -1.690 1.466 1.00 0.22 H new ATOM 0 HG12 ILE A 88 9.966 -2.368 3.757 1.00 0.33 H new ATOM 0 HG13 ILE A 88 10.289 -0.647 3.683 1.00 0.33 H new ATOM 0 HG21 ILE A 88 9.821 0.636 1.565 1.00 0.33 H new ATOM 0 HG22 ILE A 88 9.203 -0.216 0.129 1.00 0.33 H new ATOM 0 HG23 ILE A 88 8.152 0.019 1.546 1.00 0.33 H new ATOM 0 HD11 ILE A 88 8.160 -1.089 4.878 1.00 0.20 H new ATOM 0 HD12 ILE A 88 7.855 -0.189 3.373 1.00 0.20 H new ATOM 0 HD13 ILE A 88 7.527 -1.937 3.448 1.00 0.20 H new ATOM 1074 N ILE A 89 9.641 -3.263 -0.854 1.00 0.22 N ATOM 1075 CA ILE A 89 9.617 -3.336 -2.343 1.00 0.24 C ATOM 1076 C ILE A 89 8.499 -4.300 -2.726 1.00 0.27 C ATOM 1077 O ILE A 89 7.508 -3.940 -3.338 1.00 0.39 O ATOM 1078 CB ILE A 89 10.954 -3.896 -2.838 1.00 0.23 C ATOM 1079 CG1 ILE A 89 12.106 -3.123 -2.181 1.00 0.17 C ATOM 1080 CG2 ILE A 89 11.045 -3.752 -4.363 1.00 0.43 C ATOM 1081 CD1 ILE A 89 13.445 -3.636 -2.716 1.00 0.71 C ATOM 0 H ILE A 89 10.438 -3.720 -0.411 1.00 0.22 H new ATOM 0 HA ILE A 89 9.455 -2.352 -2.783 1.00 0.24 H new ATOM 0 HB ILE A 89 11.023 -4.951 -2.572 1.00 0.23 H new ATOM 0 HG12 ILE A 89 12.006 -2.057 -2.387 1.00 0.17 H new ATOM 0 HG13 ILE A 89 12.066 -3.243 -1.098 1.00 0.17 H new ATOM 0 HG21 ILE A 89 11.998 -4.152 -4.710 1.00 0.43 H new ATOM 0 HG22 ILE A 89 10.229 -4.303 -4.830 1.00 0.43 H new ATOM 0 HG23 ILE A 89 10.973 -2.699 -4.634 1.00 0.43 H new ATOM 0 HD11 ILE A 89 14.260 -3.084 -2.247 1.00 0.71 H new ATOM 0 HD12 ILE A 89 13.546 -4.697 -2.487 1.00 0.71 H new ATOM 0 HD13 ILE A 89 13.484 -3.493 -3.796 1.00 0.71 H new ATOM 1093 N THR A 90 8.661 -5.525 -2.325 1.00 0.19 N ATOM 1094 CA THR A 90 7.639 -6.569 -2.590 1.00 0.23 C ATOM 1095 C THR A 90 6.271 -6.075 -2.111 1.00 0.22 C ATOM 1096 O THR A 90 5.239 -6.540 -2.552 1.00 0.21 O ATOM 1097 CB THR A 90 8.000 -7.834 -1.795 1.00 0.45 C ATOM 1098 OG1 THR A 90 9.071 -7.566 -0.902 1.00 1.70 O ATOM 1099 CG2 THR A 90 8.405 -8.952 -2.745 1.00 0.98 C ATOM 0 H THR A 90 9.479 -5.854 -1.812 1.00 0.19 H new ATOM 0 HA THR A 90 7.607 -6.784 -3.658 1.00 0.23 H new ATOM 0 HB THR A 90 7.125 -8.143 -1.224 1.00 0.45 H new ATOM 0 HG1 THR A 90 9.290 -8.379 -0.401 1.00 1.70 H new ATOM 0 HG21 THR A 90 8.659 -9.843 -2.171 1.00 0.98 H new ATOM 0 HG22 THR A 90 7.577 -9.177 -3.417 1.00 0.98 H new ATOM 0 HG23 THR A 90 9.270 -8.638 -3.329 1.00 0.98 H new ATOM 1107 N GLY A 91 6.261 -5.156 -1.186 1.00 0.30 N ATOM 1108 CA GLY A 91 4.973 -4.649 -0.643 1.00 0.35 C ATOM 1109 C GLY A 91 4.331 -3.655 -1.610 1.00 0.28 C ATOM 1110 O GLY A 91 3.145 -3.698 -1.845 1.00 0.32 O ATOM 0 H GLY A 91 7.096 -4.733 -0.781 1.00 0.30 H new ATOM 0 HA2 GLY A 91 4.294 -5.483 -0.467 1.00 0.35 H new ATOM 0 HA3 GLY A 91 5.143 -4.168 0.320 1.00 0.35 H new ATOM 1114 N LEU A 92 5.092 -2.746 -2.151 1.00 0.41 N ATOM 1115 CA LEU A 92 4.500 -1.735 -3.073 1.00 0.40 C ATOM 1116 C LEU A 92 4.081 -2.382 -4.399 1.00 0.30 C ATOM 1117 O LEU A 92 3.278 -1.837 -5.125 1.00 0.29 O ATOM 1118 CB LEU A 92 5.525 -0.633 -3.351 1.00 0.53 C ATOM 1119 CG LEU A 92 5.632 0.286 -2.133 1.00 0.50 C ATOM 1120 CD1 LEU A 92 6.950 1.059 -2.192 1.00 0.54 C ATOM 1121 CD2 LEU A 92 4.464 1.272 -2.137 1.00 0.56 C ATOM 0 H LEU A 92 6.096 -2.658 -1.996 1.00 0.41 H new ATOM 0 HA LEU A 92 3.616 -1.312 -2.596 1.00 0.40 H new ATOM 0 HB2 LEU A 92 6.497 -1.074 -3.573 1.00 0.53 H new ATOM 0 HB3 LEU A 92 5.227 -0.058 -4.228 1.00 0.53 H new ATOM 0 HG LEU A 92 5.602 -0.312 -1.222 1.00 0.50 H new ATOM 0 HD11 LEU A 92 7.027 1.714 -1.324 1.00 0.54 H new ATOM 0 HD12 LEU A 92 7.784 0.357 -2.192 1.00 0.54 H new ATOM 0 HD13 LEU A 92 6.980 1.658 -3.102 1.00 0.54 H new ATOM 0 HD21 LEU A 92 4.539 1.928 -1.270 1.00 0.56 H new ATOM 0 HD22 LEU A 92 4.496 1.870 -3.048 1.00 0.56 H new ATOM 0 HD23 LEU A 92 3.524 0.722 -2.096 1.00 0.56 H new ATOM 1133 N LEU A 93 4.612 -3.530 -4.730 1.00 0.30 N ATOM 1134 CA LEU A 93 4.216 -4.178 -6.019 1.00 0.25 C ATOM 1135 C LEU A 93 2.793 -4.737 -5.876 1.00 0.24 C ATOM 1136 O LEU A 93 1.884 -4.387 -6.620 1.00 0.25 O ATOM 1137 CB LEU A 93 5.197 -5.306 -6.357 1.00 0.23 C ATOM 1138 CG LEU A 93 6.632 -4.772 -6.285 1.00 0.45 C ATOM 1139 CD1 LEU A 93 7.593 -5.910 -5.928 1.00 0.51 C ATOM 1140 CD2 LEU A 93 7.022 -4.186 -7.643 1.00 0.54 C ATOM 0 H LEU A 93 5.295 -4.043 -4.172 1.00 0.30 H new ATOM 0 HA LEU A 93 4.240 -3.445 -6.826 1.00 0.25 H new ATOM 0 HB2 LEU A 93 5.070 -6.134 -5.660 1.00 0.23 H new ATOM 0 HB3 LEU A 93 4.992 -5.695 -7.354 1.00 0.23 H new ATOM 0 HG LEU A 93 6.691 -3.999 -5.519 1.00 0.45 H new ATOM 0 HD11 LEU A 93 8.611 -5.524 -5.878 1.00 0.51 H new ATOM 0 HD12 LEU A 93 7.316 -6.330 -4.961 1.00 0.51 H new ATOM 0 HD13 LEU A 93 7.536 -6.687 -6.690 1.00 0.51 H new ATOM 0 HD21 LEU A 93 8.042 -3.805 -7.595 1.00 0.54 H new ATOM 0 HD22 LEU A 93 6.960 -4.962 -8.406 1.00 0.54 H new ATOM 0 HD23 LEU A 93 6.342 -3.372 -7.897 1.00 0.54 H new ATOM 1152 N GLU A 94 2.579 -5.584 -4.905 1.00 0.24 N ATOM 1153 CA GLU A 94 1.212 -6.132 -4.695 1.00 0.24 C ATOM 1154 C GLU A 94 0.275 -4.949 -4.449 1.00 0.29 C ATOM 1155 O GLU A 94 -0.807 -4.860 -4.997 1.00 0.29 O ATOM 1156 CB GLU A 94 1.218 -7.062 -3.480 1.00 0.23 C ATOM 1157 CG GLU A 94 0.912 -8.492 -3.928 1.00 0.79 C ATOM 1158 CD GLU A 94 -0.565 -8.606 -4.305 1.00 1.81 C ATOM 1159 OE1 GLU A 94 -1.168 -7.580 -4.574 1.00 2.62 O ATOM 1160 OE2 GLU A 94 -1.070 -9.717 -4.317 1.00 2.10 O ATOM 0 H GLU A 94 3.289 -5.917 -4.253 1.00 0.24 H new ATOM 0 HA GLU A 94 0.881 -6.702 -5.563 1.00 0.24 H new ATOM 0 HB2 GLU A 94 2.189 -7.025 -2.985 1.00 0.23 H new ATOM 0 HB3 GLU A 94 0.477 -6.731 -2.752 1.00 0.23 H new ATOM 0 HG2 GLU A 94 1.537 -8.758 -4.780 1.00 0.79 H new ATOM 0 HG3 GLU A 94 1.149 -9.193 -3.128 1.00 0.79 H new ATOM 1167 N PHE A 95 0.717 -4.010 -3.655 1.00 0.34 N ATOM 1168 CA PHE A 95 -0.106 -2.799 -3.393 1.00 0.38 C ATOM 1169 C PHE A 95 -0.429 -2.155 -4.735 1.00 0.36 C ATOM 1170 O PHE A 95 -1.488 -1.610 -4.937 1.00 0.47 O ATOM 1171 CB PHE A 95 0.696 -1.799 -2.557 1.00 0.42 C ATOM 1172 CG PHE A 95 0.559 -2.117 -1.091 1.00 0.34 C ATOM 1173 CD1 PHE A 95 -0.698 -2.393 -0.548 1.00 1.00 C ATOM 1174 CD2 PHE A 95 1.693 -2.132 -0.275 1.00 0.86 C ATOM 1175 CE1 PHE A 95 -0.820 -2.684 0.811 1.00 0.89 C ATOM 1176 CE2 PHE A 95 1.574 -2.425 1.084 1.00 0.97 C ATOM 1177 CZ PHE A 95 0.315 -2.702 1.630 1.00 0.32 C ATOM 0 H PHE A 95 1.617 -4.032 -3.176 1.00 0.34 H new ATOM 0 HA PHE A 95 -1.014 -3.074 -2.857 1.00 0.38 H new ATOM 0 HB2 PHE A 95 1.746 -1.832 -2.847 1.00 0.42 H new ATOM 0 HB3 PHE A 95 0.343 -0.786 -2.751 1.00 0.42 H new ATOM 0 HD1 PHE A 95 -1.574 -2.381 -1.179 1.00 1.00 H new ATOM 0 HD2 PHE A 95 2.664 -1.916 -0.697 1.00 0.86 H new ATOM 0 HE1 PHE A 95 -1.792 -2.896 1.232 1.00 0.89 H new ATOM 0 HE2 PHE A 95 2.451 -2.438 1.713 1.00 0.97 H new ATOM 0 HZ PHE A 95 0.220 -2.929 2.682 1.00 0.32 H new ATOM 1187 N GLU A 96 0.500 -2.229 -5.652 1.00 0.25 N ATOM 1188 CA GLU A 96 0.297 -1.639 -7.005 1.00 0.23 C ATOM 1189 C GLU A 96 -0.995 -2.184 -7.602 1.00 0.22 C ATOM 1190 O GLU A 96 -1.786 -1.454 -8.163 1.00 0.20 O ATOM 1191 CB GLU A 96 1.469 -2.024 -7.903 1.00 0.33 C ATOM 1192 CG GLU A 96 1.852 -0.839 -8.787 1.00 0.26 C ATOM 1193 CD GLU A 96 0.834 -0.694 -9.920 1.00 0.90 C ATOM 1194 OE1 GLU A 96 0.761 -1.591 -10.744 1.00 1.12 O ATOM 1195 OE2 GLU A 96 0.145 0.313 -9.946 1.00 1.58 O ATOM 0 H GLU A 96 1.404 -2.681 -5.517 1.00 0.25 H new ATOM 0 HA GLU A 96 0.236 -0.554 -6.927 1.00 0.23 H new ATOM 0 HB2 GLU A 96 2.321 -2.327 -7.295 1.00 0.33 H new ATOM 0 HB3 GLU A 96 1.199 -2.880 -8.522 1.00 0.33 H new ATOM 0 HG2 GLU A 96 1.884 0.075 -8.194 1.00 0.26 H new ATOM 0 HG3 GLU A 96 2.851 -0.987 -9.198 1.00 0.26 H new ATOM 1202 N VAL A 97 -1.223 -3.462 -7.486 1.00 0.26 N ATOM 1203 CA VAL A 97 -2.492 -4.016 -8.045 1.00 0.28 C ATOM 1204 C VAL A 97 -3.661 -3.347 -7.302 1.00 0.26 C ATOM 1205 O VAL A 97 -4.622 -2.892 -7.899 1.00 0.29 O ATOM 1206 CB VAL A 97 -2.519 -5.559 -7.890 1.00 0.37 C ATOM 1207 CG1 VAL A 97 -3.217 -5.995 -6.589 1.00 0.89 C ATOM 1208 CG2 VAL A 97 -3.264 -6.164 -9.081 1.00 0.24 C ATOM 0 H VAL A 97 -0.602 -4.136 -7.039 1.00 0.26 H new ATOM 0 HA VAL A 97 -2.573 -3.806 -9.111 1.00 0.28 H new ATOM 0 HB VAL A 97 -1.488 -5.912 -7.853 1.00 0.37 H new ATOM 0 HG11 VAL A 97 -3.213 -7.083 -6.521 1.00 0.89 H new ATOM 0 HG12 VAL A 97 -2.687 -5.576 -5.734 1.00 0.89 H new ATOM 0 HG13 VAL A 97 -4.246 -5.635 -6.590 1.00 0.89 H new ATOM 0 HG21 VAL A 97 -3.289 -7.249 -8.982 1.00 0.24 H new ATOM 0 HG22 VAL A 97 -4.283 -5.779 -9.106 1.00 0.24 H new ATOM 0 HG23 VAL A 97 -2.752 -5.896 -10.005 1.00 0.24 H new ATOM 1218 N TYR A 98 -3.570 -3.270 -6.000 1.00 0.30 N ATOM 1219 CA TYR A 98 -4.657 -2.614 -5.216 1.00 0.30 C ATOM 1220 C TYR A 98 -4.721 -1.125 -5.587 1.00 0.21 C ATOM 1221 O TYR A 98 -5.716 -0.460 -5.367 1.00 0.24 O ATOM 1222 CB TYR A 98 -4.373 -2.766 -3.721 1.00 0.34 C ATOM 1223 CG TYR A 98 -4.543 -4.215 -3.330 1.00 0.52 C ATOM 1224 CD1 TYR A 98 -5.806 -4.701 -2.972 1.00 0.76 C ATOM 1225 CD2 TYR A 98 -3.438 -5.070 -3.334 1.00 0.65 C ATOM 1226 CE1 TYR A 98 -5.961 -6.046 -2.616 1.00 0.92 C ATOM 1227 CE2 TYR A 98 -3.592 -6.414 -2.978 1.00 0.80 C ATOM 1228 CZ TYR A 98 -4.853 -6.903 -2.619 1.00 0.87 C ATOM 1229 OH TYR A 98 -5.006 -8.229 -2.268 1.00 1.05 O ATOM 0 H TYR A 98 -2.793 -3.632 -5.448 1.00 0.30 H new ATOM 0 HA TYR A 98 -5.612 -3.085 -5.447 1.00 0.30 H new ATOM 0 HB2 TYR A 98 -3.360 -2.432 -3.495 1.00 0.34 H new ATOM 0 HB3 TYR A 98 -5.052 -2.139 -3.144 1.00 0.34 H new ATOM 0 HD1 TYR A 98 -6.660 -4.039 -2.970 1.00 0.76 H new ATOM 0 HD2 TYR A 98 -2.465 -4.693 -3.612 1.00 0.65 H new ATOM 0 HE1 TYR A 98 -6.935 -6.423 -2.339 1.00 0.92 H new ATOM 0 HE2 TYR A 98 -2.737 -7.074 -2.980 1.00 0.80 H new ATOM 0 HH TYR A 98 -4.132 -8.673 -2.277 1.00 1.05 H new ATOM 1239 N LEU A 99 -3.678 -0.605 -6.187 1.00 0.23 N ATOM 1240 CA LEU A 99 -3.693 0.822 -6.609 1.00 0.19 C ATOM 1241 C LEU A 99 -4.528 0.886 -7.871 1.00 0.19 C ATOM 1242 O LEU A 99 -5.270 1.817 -8.100 1.00 0.17 O ATOM 1243 CB LEU A 99 -2.274 1.316 -6.902 1.00 0.24 C ATOM 1244 CG LEU A 99 -1.511 1.485 -5.590 1.00 0.28 C ATOM 1245 CD1 LEU A 99 -0.078 1.933 -5.886 1.00 0.37 C ATOM 1246 CD2 LEU A 99 -2.209 2.540 -4.734 1.00 0.25 C ATOM 0 H LEU A 99 -2.819 -1.111 -6.401 1.00 0.23 H new ATOM 0 HA LEU A 99 -4.103 1.454 -5.821 1.00 0.19 H new ATOM 0 HB2 LEU A 99 -1.756 0.606 -7.547 1.00 0.24 H new ATOM 0 HB3 LEU A 99 -2.311 2.264 -7.438 1.00 0.24 H new ATOM 0 HG LEU A 99 -1.489 0.536 -5.055 1.00 0.28 H new ATOM 0 HD11 LEU A 99 0.466 2.054 -4.949 1.00 0.37 H new ATOM 0 HD12 LEU A 99 0.419 1.182 -6.500 1.00 0.37 H new ATOM 0 HD13 LEU A 99 -0.097 2.883 -6.420 1.00 0.37 H new ATOM 0 HD21 LEU A 99 -1.668 2.664 -3.796 1.00 0.25 H new ATOM 0 HD22 LEU A 99 -2.228 3.489 -5.270 1.00 0.25 H new ATOM 0 HD23 LEU A 99 -3.230 2.221 -4.524 1.00 0.25 H new ATOM 1258 N GLU A 100 -4.457 -0.152 -8.664 1.00 0.24 N ATOM 1259 CA GLU A 100 -5.292 -0.222 -9.883 1.00 0.27 C ATOM 1260 C GLU A 100 -6.735 -0.123 -9.404 1.00 0.29 C ATOM 1261 O GLU A 100 -7.589 0.470 -10.032 1.00 0.31 O ATOM 1262 CB GLU A 100 -5.056 -1.572 -10.563 1.00 0.33 C ATOM 1263 CG GLU A 100 -4.879 -1.375 -12.068 1.00 0.27 C ATOM 1264 CD GLU A 100 -6.141 -0.740 -12.658 1.00 0.66 C ATOM 1265 OE1 GLU A 100 -6.343 0.443 -12.436 1.00 1.81 O ATOM 1266 OE2 GLU A 100 -6.880 -1.447 -13.322 1.00 1.56 O ATOM 0 H GLU A 100 -3.849 -0.957 -8.511 1.00 0.24 H new ATOM 0 HA GLU A 100 -5.058 0.569 -10.596 1.00 0.27 H new ATOM 0 HB2 GLU A 100 -4.171 -2.050 -10.144 1.00 0.33 H new ATOM 0 HB3 GLU A 100 -5.898 -2.237 -10.371 1.00 0.33 H new ATOM 0 HG2 GLU A 100 -4.016 -0.739 -12.262 1.00 0.27 H new ATOM 0 HG3 GLU A 100 -4.683 -2.333 -12.549 1.00 0.27 H new ATOM 1273 N TYR A 101 -6.978 -0.684 -8.247 1.00 0.30 N ATOM 1274 CA TYR A 101 -8.325 -0.621 -7.642 1.00 0.35 C ATOM 1275 C TYR A 101 -8.698 0.837 -7.429 1.00 0.35 C ATOM 1276 O TYR A 101 -9.745 1.296 -7.839 1.00 0.42 O ATOM 1277 CB TYR A 101 -8.291 -1.334 -6.287 1.00 0.35 C ATOM 1278 CG TYR A 101 -9.476 -2.254 -6.158 1.00 0.39 C ATOM 1279 CD1 TYR A 101 -9.827 -3.088 -7.222 1.00 0.56 C ATOM 1280 CD2 TYR A 101 -10.221 -2.276 -4.975 1.00 0.28 C ATOM 1281 CE1 TYR A 101 -10.924 -3.946 -7.108 1.00 0.60 C ATOM 1282 CE2 TYR A 101 -11.320 -3.135 -4.858 1.00 0.32 C ATOM 1283 CZ TYR A 101 -11.673 -3.970 -5.926 1.00 0.46 C ATOM 1284 OH TYR A 101 -12.757 -4.816 -5.812 1.00 0.50 O ATOM 0 H TYR A 101 -6.284 -1.188 -7.695 1.00 0.30 H new ATOM 0 HA TYR A 101 -9.055 -1.099 -8.295 1.00 0.35 H new ATOM 0 HB2 TYR A 101 -7.366 -1.903 -6.190 1.00 0.35 H new ATOM 0 HB3 TYR A 101 -8.300 -0.601 -5.481 1.00 0.35 H new ATOM 0 HD1 TYR A 101 -9.250 -3.070 -8.134 1.00 0.56 H new ATOM 0 HD2 TYR A 101 -9.949 -1.631 -4.153 1.00 0.28 H new ATOM 0 HE1 TYR A 101 -11.194 -4.590 -7.932 1.00 0.60 H new ATOM 0 HE2 TYR A 101 -11.896 -3.154 -3.944 1.00 0.32 H new ATOM 0 HH TYR A 101 -13.017 -4.890 -4.870 1.00 0.50 H new ATOM 1294 N LEU A 102 -7.846 1.561 -6.775 1.00 0.28 N ATOM 1295 CA LEU A 102 -8.127 2.993 -6.502 1.00 0.31 C ATOM 1296 C LEU A 102 -7.555 3.857 -7.628 1.00 0.30 C ATOM 1297 O LEU A 102 -7.419 5.054 -7.488 1.00 0.41 O ATOM 1298 CB LEU A 102 -7.479 3.387 -5.172 1.00 0.28 C ATOM 1299 CG LEU A 102 -7.680 2.270 -4.138 1.00 0.27 C ATOM 1300 CD1 LEU A 102 -6.360 1.988 -3.426 1.00 0.21 C ATOM 1301 CD2 LEU A 102 -8.733 2.705 -3.123 1.00 0.31 C ATOM 0 H LEU A 102 -6.956 1.220 -6.412 1.00 0.28 H new ATOM 0 HA LEU A 102 -9.204 3.149 -6.446 1.00 0.31 H new ATOM 0 HB2 LEU A 102 -6.415 3.572 -5.317 1.00 0.28 H new ATOM 0 HB3 LEU A 102 -7.917 4.316 -4.806 1.00 0.28 H new ATOM 0 HG LEU A 102 -8.015 1.363 -4.640 1.00 0.27 H new ATOM 0 HD11 LEU A 102 -6.505 1.195 -2.692 1.00 0.21 H new ATOM 0 HD12 LEU A 102 -5.613 1.676 -4.155 1.00 0.21 H new ATOM 0 HD13 LEU A 102 -6.019 2.892 -2.921 1.00 0.21 H new ATOM 0 HD21 LEU A 102 -8.878 1.914 -2.387 1.00 0.31 H new ATOM 0 HD22 LEU A 102 -8.400 3.612 -2.619 1.00 0.31 H new ATOM 0 HD23 LEU A 102 -9.675 2.900 -3.636 1.00 0.31 H new ATOM 1313 N GLN A 103 -7.211 3.266 -8.740 1.00 0.23 N ATOM 1314 CA GLN A 103 -6.643 4.069 -9.856 1.00 0.21 C ATOM 1315 C GLN A 103 -7.769 4.489 -10.801 1.00 0.28 C ATOM 1316 O GLN A 103 -7.747 5.561 -11.371 1.00 0.50 O ATOM 1317 CB GLN A 103 -5.625 3.227 -10.630 1.00 0.11 C ATOM 1318 CG GLN A 103 -5.009 4.071 -11.748 1.00 0.21 C ATOM 1319 CD GLN A 103 -4.536 3.158 -12.879 1.00 0.31 C ATOM 1320 OE1 GLN A 103 -5.103 3.159 -13.954 1.00 1.17 O ATOM 1321 NE2 GLN A 103 -3.512 2.374 -12.684 1.00 1.43 N ATOM 0 H GLN A 103 -7.299 2.266 -8.922 1.00 0.23 H new ATOM 0 HA GLN A 103 -6.151 4.953 -9.451 1.00 0.21 H new ATOM 0 HB2 GLN A 103 -4.845 2.871 -9.957 1.00 0.11 H new ATOM 0 HB3 GLN A 103 -6.110 2.346 -11.050 1.00 0.11 H new ATOM 0 HG2 GLN A 103 -5.742 4.784 -12.125 1.00 0.21 H new ATOM 0 HG3 GLN A 103 -4.171 4.650 -11.360 1.00 0.21 H new ATOM 0 HE21 GLN A 103 -3.035 2.372 -11.782 1.00 1.43 H new ATOM 0 HE22 GLN A 103 -3.188 1.763 -13.433 1.00 1.43 H new ATOM 1330 N ASN A 104 -8.748 3.645 -10.979 1.00 0.37 N ATOM 1331 CA ASN A 104 -9.869 3.986 -11.898 1.00 0.41 C ATOM 1332 C ASN A 104 -11.206 3.928 -11.151 1.00 0.43 C ATOM 1333 O ASN A 104 -12.146 4.615 -11.496 1.00 0.44 O ATOM 1334 CB ASN A 104 -9.892 2.981 -13.051 1.00 0.48 C ATOM 1335 CG ASN A 104 -9.135 3.558 -14.248 1.00 1.37 C ATOM 1336 OD1 ASN A 104 -9.049 4.758 -14.407 1.00 1.73 O ATOM 1337 ND2 ASN A 104 -8.574 2.745 -15.102 1.00 2.18 N ATOM 0 H ASN A 104 -8.820 2.733 -10.527 1.00 0.37 H new ATOM 0 HA ASN A 104 -9.722 4.996 -12.281 1.00 0.41 H new ATOM 0 HB2 ASN A 104 -9.436 2.042 -12.738 1.00 0.48 H new ATOM 0 HB3 ASN A 104 -10.921 2.758 -13.332 1.00 0.48 H new ATOM 0 HD21 ASN A 104 -8.064 3.119 -15.902 1.00 2.18 H new ATOM 0 HD22 ASN A 104 -8.646 1.736 -14.969 1.00 2.18 H new ATOM 1344 N ARG A 105 -11.305 3.111 -10.139 1.00 0.45 N ATOM 1345 CA ARG A 105 -12.588 3.012 -9.387 1.00 0.49 C ATOM 1346 C ARG A 105 -12.910 4.358 -8.728 1.00 0.37 C ATOM 1347 O ARG A 105 -14.057 4.682 -8.490 1.00 0.36 O ATOM 1348 CB ARG A 105 -12.470 1.931 -8.310 1.00 0.62 C ATOM 1349 CG ARG A 105 -12.066 0.603 -8.957 1.00 1.97 C ATOM 1350 CD ARG A 105 -13.215 0.079 -9.820 1.00 2.93 C ATOM 1351 NE ARG A 105 -12.669 -0.457 -11.099 1.00 4.52 N ATOM 1352 CZ ARG A 105 -13.070 0.036 -12.239 1.00 5.77 C ATOM 1353 NH1 ARG A 105 -12.792 1.274 -12.547 1.00 6.49 N ATOM 1354 NH2 ARG A 105 -13.750 -0.706 -13.068 1.00 6.51 N ATOM 0 H ARG A 105 -10.555 2.509 -9.801 1.00 0.45 H new ATOM 0 HA ARG A 105 -13.389 2.750 -10.079 1.00 0.49 H new ATOM 0 HB2 ARG A 105 -11.730 2.224 -7.566 1.00 0.62 H new ATOM 0 HB3 ARG A 105 -13.420 1.818 -7.788 1.00 0.62 H new ATOM 0 HG2 ARG A 105 -11.174 0.742 -9.568 1.00 1.97 H new ATOM 0 HG3 ARG A 105 -11.815 -0.126 -8.187 1.00 1.97 H new ATOM 0 HD2 ARG A 105 -13.757 -0.702 -9.288 1.00 2.93 H new ATOM 0 HD3 ARG A 105 -13.927 0.879 -10.023 1.00 2.93 H new ATOM 0 HE ARG A 105 -11.981 -1.210 -11.083 1.00 4.52 H new ATOM 0 HH11 ARG A 105 -12.262 1.855 -11.897 1.00 6.49 H new ATOM 0 HH12 ARG A 105 -13.105 1.661 -13.438 1.00 6.49 H new ATOM 0 HH21 ARG A 105 -13.969 -1.672 -12.826 1.00 6.51 H new ATOM 0 HH22 ARG A 105 -14.063 -0.320 -13.959 1.00 6.51 H new ATOM 1368 N PHE A 106 -11.911 5.144 -8.430 1.00 0.30 N ATOM 1369 CA PHE A 106 -12.170 6.465 -7.786 1.00 0.29 C ATOM 1370 C PHE A 106 -12.571 7.486 -8.851 1.00 0.23 C ATOM 1371 O PHE A 106 -11.746 8.202 -9.382 1.00 0.29 O ATOM 1372 CB PHE A 106 -10.902 6.941 -7.072 1.00 0.38 C ATOM 1373 CG PHE A 106 -11.129 6.916 -5.580 1.00 0.11 C ATOM 1374 CD1 PHE A 106 -11.849 7.947 -4.965 1.00 0.75 C ATOM 1375 CD2 PHE A 106 -10.626 5.860 -4.812 1.00 0.73 C ATOM 1376 CE1 PHE A 106 -12.064 7.922 -3.582 1.00 0.98 C ATOM 1377 CE2 PHE A 106 -10.840 5.835 -3.429 1.00 0.56 C ATOM 1378 CZ PHE A 106 -11.560 6.866 -2.815 1.00 0.44 C ATOM 0 H PHE A 106 -10.929 4.930 -8.604 1.00 0.30 H new ATOM 0 HA PHE A 106 -12.979 6.363 -7.062 1.00 0.29 H new ATOM 0 HB2 PHE A 106 -10.061 6.299 -7.334 1.00 0.38 H new ATOM 0 HB3 PHE A 106 -10.646 7.950 -7.395 1.00 0.38 H new ATOM 0 HD1 PHE A 106 -12.239 8.762 -5.557 1.00 0.75 H new ATOM 0 HD2 PHE A 106 -10.072 5.064 -5.287 1.00 0.73 H new ATOM 0 HE1 PHE A 106 -12.619 8.718 -3.107 1.00 0.98 H new ATOM 0 HE2 PHE A 106 -10.450 5.021 -2.836 1.00 0.56 H new ATOM 0 HZ PHE A 106 -11.727 6.846 -1.748 1.00 0.44 H new ATOM 1388 N GLU A 107 -13.836 7.562 -9.167 1.00 0.19 N ATOM 1389 CA GLU A 107 -14.288 8.540 -10.195 1.00 0.30 C ATOM 1390 C GLU A 107 -14.738 9.840 -9.519 1.00 0.39 C ATOM 1391 O GLU A 107 -14.928 10.851 -10.166 1.00 0.51 O ATOM 1392 CB GLU A 107 -15.452 7.944 -10.992 1.00 0.31 C ATOM 1393 CG GLU A 107 -16.608 7.614 -10.045 1.00 0.70 C ATOM 1394 CD GLU A 107 -17.938 7.807 -10.779 1.00 0.79 C ATOM 1395 OE1 GLU A 107 -18.060 7.304 -11.884 1.00 0.44 O ATOM 1396 OE2 GLU A 107 -18.810 8.454 -10.224 1.00 1.56 O ATOM 0 H GLU A 107 -14.574 6.989 -8.758 1.00 0.19 H new ATOM 0 HA GLU A 107 -13.460 8.758 -10.869 1.00 0.30 H new ATOM 0 HB2 GLU A 107 -15.783 8.650 -11.754 1.00 0.31 H new ATOM 0 HB3 GLU A 107 -15.126 7.043 -11.512 1.00 0.31 H new ATOM 0 HG2 GLU A 107 -16.521 6.587 -9.691 1.00 0.70 H new ATOM 0 HG3 GLU A 107 -16.568 8.258 -9.166 1.00 0.70 H new ATOM 1403 N SER A 108 -14.900 9.832 -8.220 1.00 0.44 N ATOM 1404 CA SER A 108 -15.321 11.076 -7.514 1.00 0.62 C ATOM 1405 C SER A 108 -14.068 11.845 -7.101 1.00 0.61 C ATOM 1406 O SER A 108 -13.993 13.052 -7.221 1.00 0.77 O ATOM 1407 CB SER A 108 -16.134 10.714 -6.269 1.00 0.75 C ATOM 1408 OG SER A 108 -16.797 9.474 -6.483 1.00 1.55 O ATOM 0 H SER A 108 -14.759 9.019 -7.621 1.00 0.44 H new ATOM 0 HA SER A 108 -15.938 11.688 -8.172 1.00 0.62 H new ATOM 0 HB2 SER A 108 -15.479 10.644 -5.401 1.00 0.75 H new ATOM 0 HB3 SER A 108 -16.862 11.497 -6.056 1.00 0.75 H new ATOM 0 HG SER A 108 -17.317 9.239 -5.686 1.00 1.55 H new ATOM 1414 N SER A 109 -13.077 11.142 -6.628 1.00 0.46 N ATOM 1415 CA SER A 109 -11.809 11.802 -6.216 1.00 0.44 C ATOM 1416 C SER A 109 -10.672 11.197 -7.035 1.00 0.42 C ATOM 1417 O SER A 109 -9.560 11.054 -6.569 1.00 0.46 O ATOM 1418 CB SER A 109 -11.560 11.546 -4.730 1.00 0.45 C ATOM 1419 OG SER A 109 -10.381 12.232 -4.327 1.00 0.71 O ATOM 0 H SER A 109 -13.093 10.129 -6.509 1.00 0.46 H new ATOM 0 HA SER A 109 -11.868 12.877 -6.385 1.00 0.44 H new ATOM 0 HB2 SER A 109 -12.412 11.887 -4.142 1.00 0.45 H new ATOM 0 HB3 SER A 109 -11.454 10.477 -4.546 1.00 0.45 H new ATOM 0 HG SER A 109 -9.749 12.264 -5.075 1.00 0.71 H new ATOM 1425 N GLU A 110 -10.963 10.822 -8.252 1.00 0.44 N ATOM 1426 CA GLU A 110 -9.938 10.197 -9.136 1.00 0.41 C ATOM 1427 C GLU A 110 -8.604 10.949 -9.054 1.00 0.38 C ATOM 1428 O GLU A 110 -7.556 10.352 -8.918 1.00 0.42 O ATOM 1429 CB GLU A 110 -10.444 10.230 -10.579 1.00 0.41 C ATOM 1430 CG GLU A 110 -9.702 9.177 -11.402 1.00 0.41 C ATOM 1431 CD GLU A 110 -10.593 8.713 -12.554 1.00 0.74 C ATOM 1432 OE1 GLU A 110 -11.781 8.552 -12.330 1.00 1.85 O ATOM 1433 OE2 GLU A 110 -10.072 8.526 -13.641 1.00 0.05 O ATOM 0 H GLU A 110 -11.884 10.925 -8.677 1.00 0.44 H new ATOM 0 HA GLU A 110 -9.774 9.170 -8.808 1.00 0.41 H new ATOM 0 HB2 GLU A 110 -11.517 10.038 -10.604 1.00 0.41 H new ATOM 0 HB3 GLU A 110 -10.287 11.220 -11.008 1.00 0.41 H new ATOM 0 HG2 GLU A 110 -8.772 9.592 -11.791 1.00 0.41 H new ATOM 0 HG3 GLU A 110 -9.433 8.330 -10.771 1.00 0.41 H new ATOM 1440 N GLU A 111 -8.631 12.249 -9.149 1.00 0.35 N ATOM 1441 CA GLU A 111 -7.361 13.031 -9.093 1.00 0.38 C ATOM 1442 C GLU A 111 -6.558 12.646 -7.845 1.00 0.38 C ATOM 1443 O GLU A 111 -5.363 12.432 -7.909 1.00 0.39 O ATOM 1444 CB GLU A 111 -7.688 14.525 -9.047 1.00 0.43 C ATOM 1445 CG GLU A 111 -8.630 14.803 -7.876 1.00 2.58 C ATOM 1446 CD GLU A 111 -9.288 16.171 -8.062 1.00 2.78 C ATOM 1447 OE1 GLU A 111 -8.620 17.064 -8.560 1.00 1.78 O ATOM 1448 OE2 GLU A 111 -10.447 16.303 -7.705 1.00 4.22 O ATOM 0 H GLU A 111 -9.478 12.806 -9.263 1.00 0.35 H new ATOM 0 HA GLU A 111 -6.767 12.810 -9.979 1.00 0.38 H new ATOM 0 HB2 GLU A 111 -6.772 15.106 -8.937 1.00 0.43 H new ATOM 0 HB3 GLU A 111 -8.152 14.836 -9.983 1.00 0.43 H new ATOM 0 HG2 GLU A 111 -9.392 14.026 -7.817 1.00 2.58 H new ATOM 0 HG3 GLU A 111 -8.077 14.779 -6.937 1.00 2.58 H new ATOM 1455 N GLN A 112 -7.196 12.560 -6.710 1.00 0.39 N ATOM 1456 CA GLN A 112 -6.457 12.195 -5.467 1.00 0.43 C ATOM 1457 C GLN A 112 -5.950 10.755 -5.574 1.00 0.42 C ATOM 1458 O GLN A 112 -4.874 10.430 -5.111 1.00 0.43 O ATOM 1459 CB GLN A 112 -7.393 12.322 -4.265 1.00 0.52 C ATOM 1460 CG GLN A 112 -7.842 13.778 -4.128 1.00 0.51 C ATOM 1461 CD GLN A 112 -6.925 14.507 -3.144 1.00 0.85 C ATOM 1462 OE1 GLN A 112 -5.758 14.188 -3.035 1.00 1.66 O ATOM 1463 NE2 GLN A 112 -7.407 15.478 -2.419 1.00 1.03 N ATOM 0 H GLN A 112 -8.195 12.726 -6.589 1.00 0.39 H new ATOM 0 HA GLN A 112 -5.607 12.866 -5.339 1.00 0.43 H new ATOM 0 HB2 GLN A 112 -8.259 11.673 -4.393 1.00 0.52 H new ATOM 0 HB3 GLN A 112 -6.884 11.999 -3.357 1.00 0.52 H new ATOM 0 HG2 GLN A 112 -7.814 14.271 -5.100 1.00 0.51 H new ATOM 0 HG3 GLN A 112 -8.874 13.820 -3.779 1.00 0.51 H new ATOM 0 HE21 GLN A 112 -8.387 15.745 -2.511 1.00 1.03 H new ATOM 0 HE22 GLN A 112 -6.804 15.970 -1.760 1.00 1.03 H new ATOM 1472 N ALA A 113 -6.713 9.891 -6.184 1.00 0.41 N ATOM 1473 CA ALA A 113 -6.272 8.476 -6.325 1.00 0.41 C ATOM 1474 C ALA A 113 -5.040 8.423 -7.232 1.00 0.35 C ATOM 1475 O ALA A 113 -4.233 7.514 -7.156 1.00 0.19 O ATOM 1476 CB ALA A 113 -7.401 7.657 -6.949 1.00 0.41 C ATOM 0 H ALA A 113 -7.624 10.104 -6.591 1.00 0.41 H new ATOM 0 HA ALA A 113 -6.023 8.066 -5.346 1.00 0.41 H new ATOM 0 HB1 ALA A 113 -7.083 6.620 -7.054 1.00 0.41 H new ATOM 0 HB2 ALA A 113 -8.281 7.703 -6.308 1.00 0.41 H new ATOM 0 HB3 ALA A 113 -7.645 8.063 -7.931 1.00 0.41 H new ATOM 1482 N ARG A 114 -4.886 9.392 -8.090 1.00 0.55 N ATOM 1483 CA ARG A 114 -3.711 9.402 -9.001 1.00 0.52 C ATOM 1484 C ARG A 114 -2.483 9.907 -8.241 1.00 0.45 C ATOM 1485 O ARG A 114 -1.361 9.642 -8.614 1.00 0.44 O ATOM 1486 CB ARG A 114 -3.993 10.326 -10.187 1.00 0.62 C ATOM 1487 CG ARG A 114 -3.131 9.902 -11.377 1.00 0.76 C ATOM 1488 CD ARG A 114 -3.880 10.191 -12.679 1.00 0.51 C ATOM 1489 NE ARG A 114 -3.071 9.706 -13.833 1.00 0.42 N ATOM 1490 CZ ARG A 114 -3.455 8.653 -14.501 1.00 0.89 C ATOM 1491 NH1 ARG A 114 -4.692 8.550 -14.901 1.00 1.47 N ATOM 1492 NH2 ARG A 114 -2.601 7.703 -14.772 1.00 1.77 N ATOM 0 H ARG A 114 -5.526 10.179 -8.199 1.00 0.55 H new ATOM 0 HA ARG A 114 -3.524 8.392 -9.365 1.00 0.52 H new ATOM 0 HB2 ARG A 114 -5.049 10.281 -10.454 1.00 0.62 H new ATOM 0 HB3 ARG A 114 -3.776 11.359 -9.917 1.00 0.62 H new ATOM 0 HG2 ARG A 114 -2.183 10.440 -11.363 1.00 0.76 H new ATOM 0 HG3 ARG A 114 -2.895 8.840 -11.309 1.00 0.76 H new ATOM 0 HD2 ARG A 114 -4.852 9.698 -12.669 1.00 0.51 H new ATOM 0 HD3 ARG A 114 -4.066 11.261 -12.775 1.00 0.51 H new ATOM 0 HE ARG A 114 -2.218 10.197 -14.100 1.00 0.42 H new ATOM 0 HH11 ARG A 114 -5.359 9.293 -14.692 1.00 1.47 H new ATOM 0 HH12 ARG A 114 -4.992 7.727 -15.423 1.00 1.47 H new ATOM 0 HH21 ARG A 114 -1.633 7.784 -14.461 1.00 1.77 H new ATOM 0 HH22 ARG A 114 -2.902 6.880 -15.294 1.00 1.77 H new ATOM 1506 N ALA A 115 -2.685 10.635 -7.178 1.00 0.47 N ATOM 1507 CA ALA A 115 -1.525 11.155 -6.402 1.00 0.46 C ATOM 1508 C ALA A 115 -1.030 10.087 -5.424 1.00 0.39 C ATOM 1509 O ALA A 115 0.076 10.158 -4.926 1.00 0.55 O ATOM 1510 CB ALA A 115 -1.955 12.398 -5.620 1.00 0.58 C ATOM 0 H ALA A 115 -3.602 10.892 -6.814 1.00 0.47 H new ATOM 0 HA ALA A 115 -0.720 11.412 -7.090 1.00 0.46 H new ATOM 0 HB1 ALA A 115 -1.108 12.781 -5.051 1.00 0.58 H new ATOM 0 HB2 ALA A 115 -2.301 13.163 -6.315 1.00 0.58 H new ATOM 0 HB3 ALA A 115 -2.763 12.136 -4.936 1.00 0.58 H new ATOM 1516 N VAL A 116 -1.836 9.101 -5.134 1.00 0.22 N ATOM 1517 CA VAL A 116 -1.396 8.047 -4.179 1.00 0.16 C ATOM 1518 C VAL A 116 -0.715 6.899 -4.943 1.00 0.19 C ATOM 1519 O VAL A 116 0.319 6.402 -4.541 1.00 0.20 O ATOM 1520 CB VAL A 116 -2.614 7.539 -3.384 1.00 0.10 C ATOM 1521 CG1 VAL A 116 -3.433 6.538 -4.209 1.00 0.37 C ATOM 1522 CG2 VAL A 116 -2.134 6.863 -2.101 1.00 0.40 C ATOM 0 H VAL A 116 -2.774 8.981 -5.515 1.00 0.22 H new ATOM 0 HA VAL A 116 -0.671 8.462 -3.478 1.00 0.16 H new ATOM 0 HB VAL A 116 -3.250 8.392 -3.146 1.00 0.10 H new ATOM 0 HG11 VAL A 116 -4.286 6.196 -3.623 1.00 0.37 H new ATOM 0 HG12 VAL A 116 -3.788 7.021 -5.119 1.00 0.37 H new ATOM 0 HG13 VAL A 116 -2.807 5.685 -4.471 1.00 0.37 H new ATOM 0 HG21 VAL A 116 -2.994 6.502 -1.536 1.00 0.40 H new ATOM 0 HG22 VAL A 116 -1.487 6.023 -2.353 1.00 0.40 H new ATOM 0 HG23 VAL A 116 -1.578 7.581 -1.497 1.00 0.40 H new ATOM 1532 N GLN A 117 -1.297 6.464 -6.030 1.00 0.24 N ATOM 1533 CA GLN A 117 -0.691 5.340 -6.803 1.00 0.30 C ATOM 1534 C GLN A 117 0.471 5.841 -7.672 1.00 0.20 C ATOM 1535 O GLN A 117 1.481 5.177 -7.800 1.00 0.30 O ATOM 1536 CB GLN A 117 -1.755 4.690 -7.696 1.00 0.60 C ATOM 1537 CG GLN A 117 -2.385 5.740 -8.617 1.00 1.93 C ATOM 1538 CD GLN A 117 -1.779 5.620 -10.017 1.00 1.55 C ATOM 1539 OE1 GLN A 117 -0.764 4.980 -10.199 1.00 0.99 O ATOM 1540 NE2 GLN A 117 -2.364 6.215 -11.019 1.00 2.76 N ATOM 0 H GLN A 117 -2.164 6.838 -6.415 1.00 0.24 H new ATOM 0 HA GLN A 117 -0.307 4.605 -6.096 1.00 0.30 H new ATOM 0 HB2 GLN A 117 -1.305 3.896 -8.292 1.00 0.60 H new ATOM 0 HB3 GLN A 117 -2.525 4.228 -7.079 1.00 0.60 H new ATOM 0 HG2 GLN A 117 -3.465 5.598 -8.663 1.00 1.93 H new ATOM 0 HG3 GLN A 117 -2.212 6.740 -8.219 1.00 1.93 H new ATOM 0 HE21 GLN A 117 -3.217 6.753 -10.865 1.00 2.76 H new ATOM 0 HE22 GLN A 117 -1.969 6.143 -11.956 1.00 2.76 H new ATOM 1549 N MET A 118 0.348 6.994 -8.274 1.00 0.25 N ATOM 1550 CA MET A 118 1.463 7.498 -9.131 1.00 0.40 C ATOM 1551 C MET A 118 2.728 7.625 -8.286 1.00 0.40 C ATOM 1552 O MET A 118 3.757 7.063 -8.602 1.00 0.54 O ATOM 1553 CB MET A 118 1.096 8.865 -9.710 1.00 0.49 C ATOM 1554 CG MET A 118 -0.036 8.701 -10.725 1.00 0.61 C ATOM 1555 SD MET A 118 0.569 7.776 -12.158 1.00 1.63 S ATOM 1556 CE MET A 118 0.979 9.204 -13.191 1.00 1.45 C ATOM 0 H MET A 118 -0.467 7.604 -8.211 1.00 0.25 H new ATOM 0 HA MET A 118 1.635 6.799 -9.949 1.00 0.40 H new ATOM 0 HB2 MET A 118 0.788 9.539 -8.911 1.00 0.49 H new ATOM 0 HB3 MET A 118 1.966 9.315 -10.189 1.00 0.49 H new ATOM 0 HG2 MET A 118 -0.875 8.177 -10.268 1.00 0.61 H new ATOM 0 HG3 MET A 118 -0.403 9.679 -11.038 1.00 0.61 H new ATOM 0 HE1 MET A 118 1.378 8.860 -14.145 1.00 1.45 H new ATOM 0 HE2 MET A 118 0.081 9.796 -13.366 1.00 1.45 H new ATOM 0 HE3 MET A 118 1.725 9.817 -12.685 1.00 1.45 H new ATOM 1566 N SER A 119 2.660 8.354 -7.206 1.00 0.44 N ATOM 1567 CA SER A 119 3.859 8.504 -6.338 1.00 0.60 C ATOM 1568 C SER A 119 4.222 7.134 -5.759 1.00 0.44 C ATOM 1569 O SER A 119 5.373 6.749 -5.722 1.00 0.43 O ATOM 1570 CB SER A 119 3.547 9.481 -5.201 1.00 0.85 C ATOM 1571 OG SER A 119 4.409 9.217 -4.102 1.00 1.11 O ATOM 0 H SER A 119 1.828 8.851 -6.889 1.00 0.44 H new ATOM 0 HA SER A 119 4.695 8.891 -6.920 1.00 0.60 H new ATOM 0 HB2 SER A 119 3.679 10.508 -5.542 1.00 0.85 H new ATOM 0 HB3 SER A 119 2.506 9.378 -4.894 1.00 0.85 H new ATOM 0 HG SER A 119 4.325 9.935 -3.441 1.00 1.11 H new ATOM 1577 N THR A 120 3.239 6.393 -5.319 1.00 0.41 N ATOM 1578 CA THR A 120 3.511 5.042 -4.751 1.00 0.40 C ATOM 1579 C THR A 120 4.302 4.217 -5.781 1.00 0.27 C ATOM 1580 O THR A 120 5.012 3.295 -5.435 1.00 0.34 O ATOM 1581 CB THR A 120 2.165 4.371 -4.399 1.00 0.57 C ATOM 1582 OG1 THR A 120 1.722 4.860 -3.142 1.00 1.91 O ATOM 1583 CG2 THR A 120 2.310 2.847 -4.318 1.00 1.17 C ATOM 0 H THR A 120 2.257 6.667 -5.329 1.00 0.41 H new ATOM 0 HA THR A 120 4.108 5.113 -3.842 1.00 0.40 H new ATOM 0 HB THR A 120 1.444 4.608 -5.182 1.00 0.57 H new ATOM 0 HG1 THR A 120 0.840 5.274 -3.245 1.00 1.91 H new ATOM 0 HG21 THR A 120 1.346 2.403 -4.069 1.00 1.17 H new ATOM 0 HG22 THR A 120 2.649 2.462 -5.280 1.00 1.17 H new ATOM 0 HG23 THR A 120 3.038 2.591 -3.548 1.00 1.17 H new ATOM 1591 N LYS A 121 4.207 4.563 -7.037 1.00 0.16 N ATOM 1592 CA LYS A 121 4.980 3.821 -8.074 1.00 0.19 C ATOM 1593 C LYS A 121 6.379 4.420 -8.114 1.00 0.18 C ATOM 1594 O LYS A 121 7.366 3.733 -8.284 1.00 0.33 O ATOM 1595 CB LYS A 121 4.315 3.989 -9.443 1.00 0.26 C ATOM 1596 CG LYS A 121 2.994 3.221 -9.476 1.00 1.15 C ATOM 1597 CD LYS A 121 2.147 3.721 -10.647 1.00 2.18 C ATOM 1598 CE LYS A 121 1.661 2.532 -11.478 1.00 2.40 C ATOM 1599 NZ LYS A 121 2.010 2.751 -12.910 1.00 1.97 N ATOM 0 H LYS A 121 3.629 5.326 -7.389 1.00 0.16 H new ATOM 0 HA LYS A 121 5.016 2.758 -7.835 1.00 0.19 H new ATOM 0 HB2 LYS A 121 4.137 5.045 -9.643 1.00 0.26 H new ATOM 0 HB3 LYS A 121 4.978 3.623 -10.227 1.00 0.26 H new ATOM 0 HG2 LYS A 121 3.184 2.153 -9.580 1.00 1.15 H new ATOM 0 HG3 LYS A 121 2.456 3.360 -8.538 1.00 1.15 H new ATOM 0 HD2 LYS A 121 1.295 4.289 -10.275 1.00 2.18 H new ATOM 0 HD3 LYS A 121 2.733 4.397 -11.270 1.00 2.18 H new ATOM 0 HE2 LYS A 121 2.120 1.611 -11.118 1.00 2.40 H new ATOM 0 HE3 LYS A 121 0.583 2.415 -11.369 1.00 2.40 H new ATOM 0 HZ1 LYS A 121 1.680 1.943 -13.475 1.00 1.97 H new ATOM 0 HZ2 LYS A 121 1.553 3.621 -13.250 1.00 1.97 H new ATOM 0 HZ3 LYS A 121 3.042 2.842 -13.006 1.00 1.97 H new ATOM 1613 N VAL A 122 6.462 5.709 -7.942 1.00 0.27 N ATOM 1614 CA VAL A 122 7.782 6.386 -7.942 1.00 0.32 C ATOM 1615 C VAL A 122 8.656 5.761 -6.856 1.00 0.30 C ATOM 1616 O VAL A 122 9.866 5.805 -6.924 1.00 0.30 O ATOM 1617 CB VAL A 122 7.583 7.876 -7.657 1.00 0.37 C ATOM 1618 CG1 VAL A 122 8.942 8.568 -7.572 1.00 0.44 C ATOM 1619 CG2 VAL A 122 6.765 8.501 -8.789 1.00 0.39 C ATOM 0 H VAL A 122 5.662 6.326 -7.800 1.00 0.27 H new ATOM 0 HA VAL A 122 8.266 6.269 -8.912 1.00 0.32 H new ATOM 0 HB VAL A 122 7.056 7.998 -6.711 1.00 0.37 H new ATOM 0 HG11 VAL A 122 8.798 9.629 -7.369 1.00 0.44 H new ATOM 0 HG12 VAL A 122 9.528 8.121 -6.769 1.00 0.44 H new ATOM 0 HG13 VAL A 122 9.471 8.448 -8.517 1.00 0.44 H new ATOM 0 HG21 VAL A 122 6.621 9.563 -8.590 1.00 0.39 H new ATOM 0 HG22 VAL A 122 7.296 8.377 -9.733 1.00 0.39 H new ATOM 0 HG23 VAL A 122 5.795 8.008 -8.852 1.00 0.39 H new ATOM 1629 N LEU A 123 8.056 5.170 -5.855 1.00 0.28 N ATOM 1630 CA LEU A 123 8.868 4.528 -4.780 1.00 0.27 C ATOM 1631 C LEU A 123 9.297 3.144 -5.256 1.00 0.26 C ATOM 1632 O LEU A 123 10.356 2.655 -4.920 1.00 0.28 O ATOM 1633 CB LEU A 123 8.035 4.377 -3.502 1.00 0.23 C ATOM 1634 CG LEU A 123 7.950 5.709 -2.750 1.00 0.30 C ATOM 1635 CD1 LEU A 123 9.353 6.285 -2.532 1.00 0.55 C ATOM 1636 CD2 LEU A 123 7.101 6.690 -3.559 1.00 0.78 C ATOM 0 H LEU A 123 7.045 5.105 -5.736 1.00 0.28 H new ATOM 0 HA LEU A 123 9.738 5.149 -4.566 1.00 0.27 H new ATOM 0 HB2 LEU A 123 7.032 4.032 -3.754 1.00 0.23 H new ATOM 0 HB3 LEU A 123 8.481 3.618 -2.859 1.00 0.23 H new ATOM 0 HG LEU A 123 7.489 5.545 -1.776 1.00 0.30 H new ATOM 0 HD11 LEU A 123 9.279 7.232 -1.997 1.00 0.55 H new ATOM 0 HD12 LEU A 123 9.948 5.583 -1.947 1.00 0.55 H new ATOM 0 HD13 LEU A 123 9.832 6.451 -3.497 1.00 0.55 H new ATOM 0 HD21 LEU A 123 7.037 7.640 -3.028 1.00 0.78 H new ATOM 0 HD22 LEU A 123 7.560 6.850 -4.535 1.00 0.78 H new ATOM 0 HD23 LEU A 123 6.100 6.281 -3.692 1.00 0.78 H new ATOM 1648 N ILE A 124 8.471 2.512 -6.036 1.00 0.25 N ATOM 1649 CA ILE A 124 8.802 1.158 -6.552 1.00 0.25 C ATOM 1650 C ILE A 124 10.043 1.243 -7.446 1.00 0.21 C ATOM 1651 O ILE A 124 10.931 0.415 -7.372 1.00 0.19 O ATOM 1652 CB ILE A 124 7.607 0.631 -7.355 1.00 0.29 C ATOM 1653 CG1 ILE A 124 6.412 0.447 -6.414 1.00 0.42 C ATOM 1654 CG2 ILE A 124 7.959 -0.711 -7.996 1.00 0.40 C ATOM 1655 CD1 ILE A 124 5.218 -0.101 -7.199 1.00 0.57 C ATOM 0 H ILE A 124 7.570 2.880 -6.342 1.00 0.25 H new ATOM 0 HA ILE A 124 9.011 0.480 -5.724 1.00 0.25 H new ATOM 0 HB ILE A 124 7.356 1.345 -8.139 1.00 0.29 H new ATOM 0 HG12 ILE A 124 6.674 -0.237 -5.607 1.00 0.42 H new ATOM 0 HG13 ILE A 124 6.150 1.399 -5.952 1.00 0.42 H new ATOM 0 HG21 ILE A 124 7.104 -1.078 -8.564 1.00 0.40 H new ATOM 0 HG22 ILE A 124 8.811 -0.583 -8.664 1.00 0.40 H new ATOM 0 HG23 ILE A 124 8.213 -1.431 -7.218 1.00 0.40 H new ATOM 0 HD11 ILE A 124 4.370 -0.231 -6.527 1.00 0.57 H new ATOM 0 HD12 ILE A 124 4.950 0.599 -7.990 1.00 0.57 H new ATOM 0 HD13 ILE A 124 5.482 -1.062 -7.639 1.00 0.57 H new ATOM 1667 N GLN A 125 10.115 2.236 -8.291 1.00 0.21 N ATOM 1668 CA GLN A 125 11.295 2.369 -9.180 1.00 0.19 C ATOM 1669 C GLN A 125 12.459 2.976 -8.394 1.00 0.16 C ATOM 1670 O GLN A 125 13.564 2.473 -8.411 1.00 0.29 O ATOM 1671 CB GLN A 125 10.927 3.273 -10.352 1.00 0.26 C ATOM 1672 CG GLN A 125 10.495 2.406 -11.536 1.00 0.30 C ATOM 1673 CD GLN A 125 10.862 3.102 -12.847 1.00 0.38 C ATOM 1674 OE1 GLN A 125 9.996 3.455 -13.622 1.00 1.18 O ATOM 1675 NE2 GLN A 125 12.118 3.314 -13.132 1.00 1.33 N ATOM 0 H GLN A 125 9.405 2.960 -8.401 1.00 0.21 H new ATOM 0 HA GLN A 125 11.595 1.390 -9.555 1.00 0.19 H new ATOM 0 HB2 GLN A 125 10.121 3.949 -10.067 1.00 0.26 H new ATOM 0 HB3 GLN A 125 11.779 3.893 -10.631 1.00 0.26 H new ATOM 0 HG2 GLN A 125 10.981 1.432 -11.482 1.00 0.30 H new ATOM 0 HG3 GLN A 125 9.420 2.229 -11.496 1.00 0.30 H new ATOM 0 HE21 GLN A 125 12.846 3.018 -12.481 1.00 1.33 H new ATOM 0 HE22 GLN A 125 12.372 3.776 -14.005 1.00 1.33 H new ATOM 1684 N PHE A 126 12.215 4.050 -7.693 1.00 0.23 N ATOM 1685 CA PHE A 126 13.301 4.683 -6.892 1.00 0.18 C ATOM 1686 C PHE A 126 13.838 3.672 -5.877 1.00 0.16 C ATOM 1687 O PHE A 126 14.921 3.823 -5.354 1.00 0.37 O ATOM 1688 CB PHE A 126 12.749 5.900 -6.145 1.00 0.33 C ATOM 1689 CG PHE A 126 12.761 7.105 -7.056 1.00 0.46 C ATOM 1690 CD1 PHE A 126 12.162 7.035 -8.318 1.00 0.45 C ATOM 1691 CD2 PHE A 126 13.374 8.291 -6.635 1.00 0.64 C ATOM 1692 CE1 PHE A 126 12.177 8.152 -9.162 1.00 0.60 C ATOM 1693 CE2 PHE A 126 13.387 9.408 -7.479 1.00 0.79 C ATOM 1694 CZ PHE A 126 12.789 9.339 -8.742 1.00 0.77 C ATOM 0 H PHE A 126 11.310 4.517 -7.641 1.00 0.23 H new ATOM 0 HA PHE A 126 14.103 4.999 -7.559 1.00 0.18 H new ATOM 0 HB2 PHE A 126 11.733 5.700 -5.804 1.00 0.33 H new ATOM 0 HB3 PHE A 126 13.350 6.097 -5.257 1.00 0.33 H new ATOM 0 HD1 PHE A 126 11.688 6.120 -8.641 1.00 0.45 H new ATOM 0 HD2 PHE A 126 13.836 8.344 -5.660 1.00 0.64 H new ATOM 0 HE1 PHE A 126 11.716 8.098 -10.137 1.00 0.60 H new ATOM 0 HE2 PHE A 126 13.859 10.324 -7.155 1.00 0.79 H new ATOM 0 HZ PHE A 126 12.800 10.201 -9.393 1.00 0.77 H new ATOM 1704 N LEU A 127 13.085 2.643 -5.588 1.00 0.34 N ATOM 1705 CA LEU A 127 13.548 1.627 -4.606 1.00 0.38 C ATOM 1706 C LEU A 127 14.491 0.644 -5.297 1.00 0.11 C ATOM 1707 O LEU A 127 15.583 0.384 -4.834 1.00 0.25 O ATOM 1708 CB LEU A 127 12.336 0.868 -4.060 1.00 0.64 C ATOM 1709 CG LEU A 127 11.789 1.596 -2.834 1.00 1.04 C ATOM 1710 CD1 LEU A 127 10.418 1.024 -2.467 1.00 1.84 C ATOM 1711 CD2 LEU A 127 12.753 1.404 -1.662 1.00 0.85 C ATOM 0 H LEU A 127 12.166 2.465 -5.993 1.00 0.34 H new ATOM 0 HA LEU A 127 14.073 2.120 -3.788 1.00 0.38 H new ATOM 0 HB2 LEU A 127 11.564 0.794 -4.826 1.00 0.64 H new ATOM 0 HB3 LEU A 127 12.621 -0.150 -3.795 1.00 0.64 H new ATOM 0 HG LEU A 127 11.688 2.659 -3.055 1.00 1.04 H new ATOM 0 HD11 LEU A 127 10.029 1.545 -1.592 1.00 1.84 H new ATOM 0 HD12 LEU A 127 9.732 1.158 -3.304 1.00 1.84 H new ATOM 0 HD13 LEU A 127 10.515 -0.038 -2.244 1.00 1.84 H new ATOM 0 HD21 LEU A 127 12.367 1.922 -0.784 1.00 0.85 H new ATOM 0 HD22 LEU A 127 12.851 0.341 -1.442 1.00 0.85 H new ATOM 0 HD23 LEU A 127 13.729 1.812 -1.923 1.00 0.85 H new ATOM 1723 N GLN A 128 14.073 0.095 -6.401 1.00 0.15 N ATOM 1724 CA GLN A 128 14.938 -0.875 -7.127 1.00 0.31 C ATOM 1725 C GLN A 128 16.289 -0.227 -7.445 1.00 0.42 C ATOM 1726 O GLN A 128 17.324 -0.857 -7.360 1.00 0.61 O ATOM 1727 CB GLN A 128 14.251 -1.287 -8.430 1.00 0.53 C ATOM 1728 CG GLN A 128 13.307 -2.460 -8.164 1.00 0.61 C ATOM 1729 CD GLN A 128 12.567 -2.818 -9.452 1.00 0.41 C ATOM 1730 OE1 GLN A 128 12.139 -1.947 -10.183 1.00 0.70 O ATOM 1731 NE2 GLN A 128 12.398 -4.074 -9.766 1.00 1.27 N ATOM 0 H GLN A 128 13.167 0.276 -6.834 1.00 0.15 H new ATOM 0 HA GLN A 128 15.100 -1.754 -6.503 1.00 0.31 H new ATOM 0 HB2 GLN A 128 13.694 -0.445 -8.841 1.00 0.53 H new ATOM 0 HB3 GLN A 128 14.997 -1.569 -9.173 1.00 0.53 H new ATOM 0 HG2 GLN A 128 13.871 -3.321 -7.804 1.00 0.61 H new ATOM 0 HG3 GLN A 128 12.594 -2.197 -7.383 1.00 0.61 H new ATOM 0 HE21 GLN A 128 12.757 -4.806 -9.153 1.00 1.27 H new ATOM 0 HE22 GLN A 128 11.907 -4.323 -10.625 1.00 1.27 H new ATOM 1740 N LYS A 129 16.290 1.026 -7.816 1.00 0.37 N ATOM 1741 CA LYS A 129 17.576 1.705 -8.143 1.00 0.56 C ATOM 1742 C LYS A 129 18.252 2.188 -6.856 1.00 0.68 C ATOM 1743 O LYS A 129 19.461 2.255 -6.767 1.00 0.94 O ATOM 1744 CB LYS A 129 17.307 2.899 -9.067 1.00 0.48 C ATOM 1745 CG LYS A 129 16.452 3.939 -8.338 1.00 2.41 C ATOM 1746 CD LYS A 129 17.341 5.094 -7.872 1.00 3.73 C ATOM 1747 CE LYS A 129 17.097 6.316 -8.759 1.00 4.02 C ATOM 1748 NZ LYS A 129 17.455 5.985 -10.168 1.00 3.10 N ATOM 0 H LYS A 129 15.457 1.607 -7.906 1.00 0.37 H new ATOM 0 HA LYS A 129 18.236 0.999 -8.648 1.00 0.56 H new ATOM 0 HB2 LYS A 129 18.250 3.346 -9.382 1.00 0.48 H new ATOM 0 HB3 LYS A 129 16.796 2.564 -9.970 1.00 0.48 H new ATOM 0 HG2 LYS A 129 15.671 4.312 -9.000 1.00 2.41 H new ATOM 0 HG3 LYS A 129 15.954 3.481 -7.483 1.00 2.41 H new ATOM 0 HD2 LYS A 129 17.124 5.337 -6.832 1.00 3.73 H new ATOM 0 HD3 LYS A 129 18.390 4.801 -7.919 1.00 3.73 H new ATOM 0 HE2 LYS A 129 16.052 6.619 -8.699 1.00 4.02 H new ATOM 0 HE3 LYS A 129 17.694 7.158 -8.409 1.00 4.02 H new ATOM 0 HZ1 LYS A 129 17.486 6.858 -10.733 1.00 3.10 H new ATOM 0 HZ2 LYS A 129 18.387 5.525 -10.190 1.00 3.10 H new ATOM 0 HZ3 LYS A 129 16.742 5.341 -10.565 1.00 3.10 H new ATOM 1762 N LYS A 130 17.482 2.519 -5.854 1.00 0.68 N ATOM 1763 CA LYS A 130 18.091 2.987 -4.577 1.00 0.92 C ATOM 1764 C LYS A 130 18.544 1.781 -3.750 1.00 0.60 C ATOM 1765 O LYS A 130 19.061 1.927 -2.661 1.00 0.60 O ATOM 1766 CB LYS A 130 17.061 3.797 -3.784 1.00 1.37 C ATOM 1767 CG LYS A 130 17.658 4.226 -2.441 1.00 1.39 C ATOM 1768 CD LYS A 130 17.040 3.388 -1.320 1.00 1.86 C ATOM 1769 CE LYS A 130 18.126 2.984 -0.320 1.00 1.78 C ATOM 1770 NZ LYS A 130 17.890 1.583 0.140 1.00 2.33 N ATOM 0 H LYS A 130 16.463 2.486 -5.865 1.00 0.68 H new ATOM 0 HA LYS A 130 18.953 3.616 -4.798 1.00 0.92 H new ATOM 0 HB2 LYS A 130 16.759 4.675 -4.355 1.00 1.37 H new ATOM 0 HB3 LYS A 130 16.164 3.200 -3.619 1.00 1.37 H new ATOM 0 HG2 LYS A 130 18.740 4.096 -2.453 1.00 1.39 H new ATOM 0 HG3 LYS A 130 17.466 5.285 -2.267 1.00 1.39 H new ATOM 0 HD2 LYS A 130 16.260 3.958 -0.814 1.00 1.86 H new ATOM 0 HD3 LYS A 130 16.566 2.499 -1.736 1.00 1.86 H new ATOM 0 HE2 LYS A 130 19.109 3.064 -0.784 1.00 1.78 H new ATOM 0 HE3 LYS A 130 18.120 3.663 0.533 1.00 1.78 H new ATOM 0 HZ1 LYS A 130 18.802 1.126 0.342 1.00 2.33 H new ATOM 0 HZ2 LYS A 130 17.310 1.594 1.003 1.00 2.33 H new ATOM 0 HZ3 LYS A 130 17.394 1.052 -0.604 1.00 2.33 H new ATOM 1784 N ALA A 131 18.363 0.589 -4.251 1.00 0.42 N ATOM 1785 CA ALA A 131 18.796 -0.605 -3.480 1.00 0.43 C ATOM 1786 C ALA A 131 20.205 -1.009 -3.924 1.00 0.43 C ATOM 1787 O ALA A 131 20.529 -2.176 -4.008 1.00 0.69 O ATOM 1788 CB ALA A 131 17.818 -1.756 -3.732 1.00 0.44 C ATOM 0 H ALA A 131 17.936 0.394 -5.156 1.00 0.42 H new ATOM 0 HA ALA A 131 18.807 -0.373 -2.415 1.00 0.43 H new ATOM 0 HB1 ALA A 131 18.135 -2.633 -3.167 1.00 0.44 H new ATOM 0 HB2 ALA A 131 16.818 -1.460 -3.413 1.00 0.44 H new ATOM 0 HB3 ALA A 131 17.804 -1.995 -4.795 1.00 0.44 H new ATOM 1794 N LYS A 132 21.049 -0.046 -4.203 1.00 0.46 N ATOM 1795 CA LYS A 132 22.443 -0.369 -4.636 1.00 0.87 C ATOM 1796 C LYS A 132 23.068 -1.350 -3.642 1.00 1.10 C ATOM 1797 O LYS A 132 22.813 -1.288 -2.455 1.00 1.20 O ATOM 1798 CB LYS A 132 23.275 0.915 -4.671 1.00 1.17 C ATOM 1799 CG LYS A 132 23.294 1.544 -3.277 1.00 1.06 C ATOM 1800 CD LYS A 132 23.161 3.063 -3.399 1.00 1.95 C ATOM 1801 CE LYS A 132 22.072 3.561 -2.448 1.00 2.58 C ATOM 1802 NZ LYS A 132 21.999 5.047 -2.511 1.00 3.67 N ATOM 0 H LYS A 132 20.832 0.949 -4.149 1.00 0.46 H new ATOM 0 HA LYS A 132 22.422 -0.818 -5.629 1.00 0.87 H new ATOM 0 HB2 LYS A 132 24.292 0.694 -4.997 1.00 1.17 H new ATOM 0 HB3 LYS A 132 22.854 1.615 -5.393 1.00 1.17 H new ATOM 0 HG2 LYS A 132 22.478 1.144 -2.675 1.00 1.06 H new ATOM 0 HG3 LYS A 132 24.222 1.290 -2.765 1.00 1.06 H new ATOM 0 HD2 LYS A 132 24.111 3.541 -3.162 1.00 1.95 H new ATOM 0 HD3 LYS A 132 22.914 3.335 -4.425 1.00 1.95 H new ATOM 0 HE2 LYS A 132 21.110 3.127 -2.721 1.00 2.58 H new ATOM 0 HE3 LYS A 132 22.289 3.240 -1.429 1.00 2.58 H new ATOM 0 HZ1 LYS A 132 21.258 5.386 -1.864 1.00 3.67 H new ATOM 0 HZ2 LYS A 132 22.915 5.452 -2.231 1.00 3.67 H new ATOM 0 HZ3 LYS A 132 21.772 5.343 -3.482 1.00 3.67 H new ATOM 1816 N ASN A 133 23.873 -2.265 -4.111 1.00 1.27 N ATOM 1817 CA ASN A 133 24.491 -3.253 -3.182 1.00 1.55 C ATOM 1818 C ASN A 133 23.380 -3.945 -2.396 1.00 1.43 C ATOM 1819 O ASN A 133 23.484 -4.175 -1.207 1.00 1.73 O ATOM 1820 CB ASN A 133 25.440 -2.536 -2.219 1.00 1.95 C ATOM 1821 CG ASN A 133 26.149 -3.568 -1.341 1.00 1.30 C ATOM 1822 OD1 ASN A 133 26.532 -4.622 -1.810 1.00 1.82 O ATOM 1823 ND2 ASN A 133 26.344 -3.307 -0.077 1.00 0.75 N ATOM 0 H ASN A 133 24.128 -2.371 -5.093 1.00 1.27 H new ATOM 0 HA ASN A 133 25.059 -3.991 -3.748 1.00 1.55 H new ATOM 0 HB2 ASN A 133 26.172 -1.954 -2.779 1.00 1.95 H new ATOM 0 HB3 ASN A 133 24.883 -1.835 -1.597 1.00 1.95 H new ATOM 0 HD21 ASN A 133 26.818 -3.987 0.517 1.00 0.75 H new ATOM 0 HD22 ASN A 133 26.023 -2.423 0.317 1.00 0.75 H new ATOM 1830 N LEU A 134 22.314 -4.266 -3.068 1.00 1.07 N ATOM 1831 CA LEU A 134 21.168 -4.937 -2.400 1.00 1.13 C ATOM 1832 C LEU A 134 20.460 -5.836 -3.407 1.00 0.95 C ATOM 1833 O LEU A 134 21.019 -6.224 -4.414 1.00 0.89 O ATOM 1834 CB LEU A 134 20.184 -3.883 -1.883 1.00 1.08 C ATOM 1835 CG LEU A 134 19.810 -4.195 -0.433 1.00 1.33 C ATOM 1836 CD1 LEU A 134 20.783 -3.487 0.511 1.00 2.12 C ATOM 1837 CD2 LEU A 134 18.387 -3.701 -0.158 1.00 1.20 C ATOM 0 H LEU A 134 22.186 -4.090 -4.064 1.00 1.07 H new ATOM 0 HA LEU A 134 21.532 -5.533 -1.563 1.00 1.13 H new ATOM 0 HB2 LEU A 134 20.631 -2.891 -1.948 1.00 1.08 H new ATOM 0 HB3 LEU A 134 19.289 -3.871 -2.505 1.00 1.08 H new ATOM 0 HG LEU A 134 19.863 -5.271 -0.269 1.00 1.33 H new ATOM 0 HD11 LEU A 134 20.515 -3.710 1.544 1.00 2.12 H new ATOM 0 HD12 LEU A 134 21.797 -3.835 0.316 1.00 2.12 H new ATOM 0 HD13 LEU A 134 20.731 -2.411 0.347 1.00 2.12 H new ATOM 0 HD21 LEU A 134 18.118 -3.922 0.875 1.00 1.20 H new ATOM 0 HD22 LEU A 134 18.337 -2.625 -0.323 1.00 1.20 H new ATOM 0 HD23 LEU A 134 17.691 -4.204 -0.830 1.00 1.20 H new ATOM 1849 N ASP A 135 19.235 -6.168 -3.140 1.00 1.06 N ATOM 1850 CA ASP A 135 18.479 -7.043 -4.075 1.00 1.13 C ATOM 1851 C ASP A 135 17.393 -6.225 -4.768 1.00 0.81 C ATOM 1852 O ASP A 135 17.220 -5.051 -4.506 1.00 2.02 O ATOM 1853 CB ASP A 135 17.834 -8.186 -3.289 1.00 1.90 C ATOM 1854 CG ASP A 135 18.921 -8.997 -2.581 1.00 2.90 C ATOM 1855 OD1 ASP A 135 19.435 -9.921 -3.190 1.00 3.35 O ATOM 1856 OD2 ASP A 135 19.219 -8.682 -1.440 1.00 3.58 O ATOM 0 H ASP A 135 18.720 -5.871 -2.311 1.00 1.06 H new ATOM 0 HA ASP A 135 19.158 -7.453 -4.823 1.00 1.13 H new ATOM 0 HB2 ASP A 135 17.130 -7.787 -2.559 1.00 1.90 H new ATOM 0 HB3 ASP A 135 17.266 -8.829 -3.962 1.00 1.90 H new ATOM 1861 N ALA A 136 16.642 -6.844 -5.631 1.00 0.67 N ATOM 1862 CA ALA A 136 15.550 -6.128 -6.319 1.00 0.69 C ATOM 1863 C ALA A 136 14.222 -6.687 -5.832 1.00 0.53 C ATOM 1864 O ALA A 136 13.169 -6.146 -6.105 1.00 1.08 O ATOM 1865 CB ALA A 136 15.667 -6.310 -7.832 1.00 1.10 C ATOM 0 H ALA A 136 16.743 -7.826 -5.888 1.00 0.67 H new ATOM 0 HA ALA A 136 15.612 -5.063 -6.096 1.00 0.69 H new ATOM 0 HB1 ALA A 136 14.855 -5.777 -8.326 1.00 1.10 H new ATOM 0 HB2 ALA A 136 16.623 -5.913 -8.173 1.00 1.10 H new ATOM 0 HB3 ALA A 136 15.606 -7.370 -8.077 1.00 1.10 H new ATOM 1871 N ILE A 137 14.269 -7.756 -5.087 1.00 0.53 N ATOM 1872 CA ILE A 137 13.036 -8.343 -4.547 1.00 0.48 C ATOM 1873 C ILE A 137 12.084 -8.738 -5.686 1.00 0.25 C ATOM 1874 O ILE A 137 10.921 -9.014 -5.467 1.00 0.41 O ATOM 1875 CB ILE A 137 12.410 -7.308 -3.609 1.00 0.72 C ATOM 1876 CG1 ILE A 137 13.295 -7.156 -2.364 1.00 1.02 C ATOM 1877 CG2 ILE A 137 11.021 -7.758 -3.178 1.00 0.79 C ATOM 1878 CD1 ILE A 137 14.606 -6.447 -2.722 1.00 0.80 C ATOM 0 H ILE A 137 15.126 -8.246 -4.832 1.00 0.53 H new ATOM 0 HA ILE A 137 13.247 -9.257 -3.993 1.00 0.48 H new ATOM 0 HB ILE A 137 12.330 -6.356 -4.134 1.00 0.72 H new ATOM 0 HG12 ILE A 137 12.764 -6.588 -1.600 1.00 1.02 H new ATOM 0 HG13 ILE A 137 13.509 -8.137 -1.940 1.00 1.02 H new ATOM 0 HG21 ILE A 137 10.588 -7.013 -2.511 1.00 0.79 H new ATOM 0 HG22 ILE A 137 10.386 -7.872 -4.057 1.00 0.79 H new ATOM 0 HG23 ILE A 137 11.093 -8.713 -2.657 1.00 0.79 H new ATOM 0 HD11 ILE A 137 15.222 -6.347 -1.828 1.00 0.80 H new ATOM 0 HD12 ILE A 137 15.143 -7.031 -3.469 1.00 0.80 H new ATOM 0 HD13 ILE A 137 14.387 -5.458 -3.124 1.00 0.80 H new ATOM 1890 N THR A 138 12.578 -8.801 -6.899 1.00 0.77 N ATOM 1891 CA THR A 138 11.717 -9.203 -8.053 1.00 1.06 C ATOM 1892 C THR A 138 10.346 -8.515 -7.969 1.00 0.99 C ATOM 1893 O THR A 138 10.206 -7.460 -7.382 1.00 1.00 O ATOM 1894 CB THR A 138 11.534 -10.724 -8.033 1.00 1.24 C ATOM 1895 OG1 THR A 138 12.565 -11.312 -7.252 1.00 1.43 O ATOM 1896 CG2 THR A 138 11.600 -11.268 -9.462 1.00 1.64 C ATOM 0 H THR A 138 13.547 -8.590 -7.139 1.00 0.77 H new ATOM 0 HA THR A 138 12.199 -8.898 -8.982 1.00 1.06 H new ATOM 0 HB THR A 138 10.564 -10.968 -7.599 1.00 1.24 H new ATOM 0 HG1 THR A 138 12.449 -12.285 -7.236 1.00 1.43 H new ATOM 0 HG21 THR A 138 11.470 -12.350 -9.446 1.00 1.64 H new ATOM 0 HG22 THR A 138 10.809 -10.816 -10.060 1.00 1.64 H new ATOM 0 HG23 THR A 138 12.569 -11.026 -9.899 1.00 1.64 H new ATOM 1904 N THR A 139 9.338 -9.109 -8.542 1.00 0.96 N ATOM 1905 CA THR A 139 7.983 -8.500 -8.491 1.00 0.95 C ATOM 1906 C THR A 139 6.952 -9.554 -8.933 1.00 0.94 C ATOM 1907 O THR A 139 7.265 -10.404 -9.742 1.00 1.01 O ATOM 1908 CB THR A 139 7.954 -7.276 -9.419 1.00 1.14 C ATOM 1909 OG1 THR A 139 6.805 -6.491 -9.141 1.00 1.14 O ATOM 1910 CG2 THR A 139 7.929 -7.713 -10.886 1.00 1.24 C ATOM 0 H THR A 139 9.396 -9.994 -9.046 1.00 0.96 H new ATOM 0 HA THR A 139 7.739 -8.175 -7.480 1.00 0.95 H new ATOM 0 HB THR A 139 8.854 -6.686 -9.243 1.00 1.14 H new ATOM 0 HG1 THR A 139 6.722 -5.784 -9.814 1.00 1.14 H new ATOM 0 HG21 THR A 139 7.909 -6.832 -11.528 1.00 1.24 H new ATOM 0 HG22 THR A 139 8.820 -8.301 -11.106 1.00 1.24 H new ATOM 0 HG23 THR A 139 7.041 -8.317 -11.071 1.00 1.24 H new ATOM 1958 N THR A 143 0.171 -11.128 -14.474 1.00 0.93 N ATOM 1959 CA THR A 143 -0.832 -12.168 -14.833 1.00 0.77 C ATOM 1960 C THR A 143 -1.481 -12.672 -13.545 1.00 0.71 C ATOM 1961 O THR A 143 -2.688 -12.727 -13.423 1.00 0.73 O ATOM 1962 CB THR A 143 -0.135 -13.327 -15.547 1.00 0.65 C ATOM 1963 OG1 THR A 143 0.920 -13.817 -14.730 1.00 0.47 O ATOM 1964 CG2 THR A 143 0.434 -12.840 -16.879 1.00 1.13 C ATOM 0 HA THR A 143 -1.589 -11.750 -15.496 1.00 0.77 H new ATOM 0 HB THR A 143 -0.854 -14.125 -15.732 1.00 0.65 H new ATOM 0 HG1 THR A 143 1.439 -13.063 -14.379 1.00 0.47 H new ATOM 0 HG21 THR A 143 0.930 -13.667 -17.387 1.00 1.13 H new ATOM 0 HG22 THR A 143 -0.375 -12.464 -17.505 1.00 1.13 H new ATOM 0 HG23 THR A 143 1.153 -12.042 -16.697 1.00 1.13 H new ATOM 1972 N THR A 144 -0.680 -13.023 -12.575 1.00 0.65 N ATOM 1973 CA THR A 144 -1.239 -13.503 -11.282 1.00 0.58 C ATOM 1974 C THR A 144 -1.931 -12.328 -10.590 1.00 0.55 C ATOM 1975 O THR A 144 -3.064 -12.424 -10.154 1.00 0.71 O ATOM 1976 CB THR A 144 -0.101 -14.022 -10.400 1.00 0.62 C ATOM 1977 OG1 THR A 144 0.803 -14.780 -11.194 1.00 0.71 O ATOM 1978 CG2 THR A 144 -0.669 -14.905 -9.289 1.00 0.54 C ATOM 0 H THR A 144 0.338 -12.997 -12.624 1.00 0.65 H new ATOM 0 HA THR A 144 -1.953 -14.308 -11.453 1.00 0.58 H new ATOM 0 HB THR A 144 0.424 -13.177 -9.954 1.00 0.62 H new ATOM 0 HG1 THR A 144 1.534 -15.112 -10.631 1.00 0.71 H new ATOM 0 HG21 THR A 144 0.145 -15.272 -8.664 1.00 0.54 H new ATOM 0 HG22 THR A 144 -1.361 -14.323 -8.680 1.00 0.54 H new ATOM 0 HG23 THR A 144 -1.197 -15.750 -9.730 1.00 0.54 H new ATOM 1986 N ASN A 145 -1.259 -11.210 -10.500 1.00 0.39 N ATOM 1987 CA ASN A 145 -1.877 -10.022 -9.853 1.00 0.39 C ATOM 1988 C ASN A 145 -3.203 -9.712 -10.548 1.00 0.44 C ATOM 1989 O ASN A 145 -4.089 -9.119 -9.973 1.00 0.41 O ATOM 1990 CB ASN A 145 -0.939 -8.820 -9.974 1.00 0.40 C ATOM 1991 CG ASN A 145 -0.688 -8.228 -8.585 1.00 0.47 C ATOM 1992 OD1 ASN A 145 0.402 -7.778 -8.293 1.00 0.55 O ATOM 1993 ND2 ASN A 145 -1.657 -8.212 -7.709 1.00 0.44 N ATOM 0 H ASN A 145 -0.310 -11.071 -10.847 1.00 0.39 H new ATOM 0 HA ASN A 145 -2.053 -10.229 -8.797 1.00 0.39 H new ATOM 0 HB2 ASN A 145 0.004 -9.125 -10.427 1.00 0.40 H new ATOM 0 HB3 ASN A 145 -1.378 -8.067 -10.628 1.00 0.40 H new ATOM 0 HD21 ASN A 145 -1.498 -7.822 -6.780 1.00 0.44 H new ATOM 0 HD22 ASN A 145 -2.572 -8.590 -7.954 1.00 0.44 H new ATOM 2000 N ALA A 146 -3.350 -10.132 -11.778 1.00 0.54 N ATOM 2001 CA ALA A 146 -4.629 -9.889 -12.501 1.00 0.60 C ATOM 2002 C ALA A 146 -5.716 -10.696 -11.817 1.00 0.64 C ATOM 2003 O ALA A 146 -6.710 -10.155 -11.403 1.00 0.99 O ATOM 2004 CB ALA A 146 -4.493 -10.340 -13.956 1.00 0.63 C ATOM 0 H ALA A 146 -2.639 -10.632 -12.311 1.00 0.54 H new ATOM 0 HA ALA A 146 -4.877 -8.828 -12.485 1.00 0.60 H new ATOM 0 HB1 ALA A 146 -5.431 -10.161 -14.482 1.00 0.63 H new ATOM 0 HB2 ALA A 146 -3.693 -9.777 -14.438 1.00 0.63 H new ATOM 0 HB3 ALA A 146 -4.258 -11.404 -13.987 1.00 0.63 H new ATOM 2010 N SER A 147 -5.521 -11.981 -11.677 1.00 0.63 N ATOM 2011 CA SER A 147 -6.546 -12.829 -11.001 1.00 0.62 C ATOM 2012 C SER A 147 -6.884 -12.229 -9.640 1.00 0.58 C ATOM 2013 O SER A 147 -7.978 -12.393 -9.143 1.00 0.42 O ATOM 2014 CB SER A 147 -6.000 -14.245 -10.819 1.00 0.63 C ATOM 2015 OG SER A 147 -7.027 -15.186 -11.108 1.00 0.76 O ATOM 0 H SER A 147 -4.694 -12.481 -12.003 1.00 0.63 H new ATOM 0 HA SER A 147 -7.447 -12.868 -11.613 1.00 0.62 H new ATOM 0 HB2 SER A 147 -5.147 -14.406 -11.479 1.00 0.63 H new ATOM 0 HB3 SER A 147 -5.643 -14.381 -9.798 1.00 0.63 H new ATOM 0 HG SER A 147 -6.679 -16.095 -10.994 1.00 0.76 H new ATOM 2021 N LEU A 148 -5.967 -11.522 -9.034 1.00 0.73 N ATOM 2022 CA LEU A 148 -6.282 -10.906 -7.712 1.00 0.69 C ATOM 2023 C LEU A 148 -7.260 -9.753 -7.947 1.00 0.68 C ATOM 2024 O LEU A 148 -8.274 -9.652 -7.300 1.00 0.66 O ATOM 2025 CB LEU A 148 -5.005 -10.374 -7.039 1.00 0.70 C ATOM 2026 CG LEU A 148 -5.374 -9.395 -5.908 1.00 0.67 C ATOM 2027 CD1 LEU A 148 -6.365 -10.054 -4.945 1.00 0.57 C ATOM 2028 CD2 LEU A 148 -4.122 -8.999 -5.138 1.00 0.68 C ATOM 0 H LEU A 148 -5.028 -11.346 -9.390 1.00 0.73 H new ATOM 0 HA LEU A 148 -6.721 -11.656 -7.054 1.00 0.69 H new ATOM 0 HB2 LEU A 148 -4.423 -11.204 -6.638 1.00 0.70 H new ATOM 0 HB3 LEU A 148 -4.378 -9.872 -7.776 1.00 0.70 H new ATOM 0 HG LEU A 148 -5.830 -8.509 -6.349 1.00 0.67 H new ATOM 0 HD11 LEU A 148 -6.619 -9.354 -4.149 1.00 0.57 H new ATOM 0 HD12 LEU A 148 -7.269 -10.332 -5.487 1.00 0.57 H new ATOM 0 HD13 LEU A 148 -5.913 -10.946 -4.512 1.00 0.57 H new ATOM 0 HD21 LEU A 148 -4.390 -8.307 -4.340 1.00 0.68 H new ATOM 0 HD22 LEU A 148 -3.663 -9.889 -4.708 1.00 0.68 H new ATOM 0 HD23 LEU A 148 -3.416 -8.517 -5.814 1.00 0.68 H new ATOM 2040 N LEU A 149 -6.957 -8.889 -8.870 1.00 0.71 N ATOM 2041 CA LEU A 149 -7.871 -7.755 -9.157 1.00 0.69 C ATOM 2042 C LEU A 149 -9.208 -8.322 -9.636 1.00 0.65 C ATOM 2043 O LEU A 149 -10.233 -7.673 -9.580 1.00 0.83 O ATOM 2044 CB LEU A 149 -7.249 -6.891 -10.258 1.00 0.75 C ATOM 2045 CG LEU A 149 -8.235 -5.808 -10.696 1.00 0.79 C ATOM 2046 CD1 LEU A 149 -8.624 -4.954 -9.490 1.00 0.96 C ATOM 2047 CD2 LEU A 149 -7.575 -4.926 -11.757 1.00 0.87 C ATOM 0 H LEU A 149 -6.112 -8.920 -9.440 1.00 0.71 H new ATOM 0 HA LEU A 149 -8.028 -7.148 -8.265 1.00 0.69 H new ATOM 0 HB2 LEU A 149 -6.330 -6.431 -9.895 1.00 0.75 H new ATOM 0 HB3 LEU A 149 -6.979 -7.514 -11.111 1.00 0.75 H new ATOM 0 HG LEU A 149 -9.129 -6.273 -11.112 1.00 0.79 H new ATOM 0 HD11 LEU A 149 -9.327 -4.182 -9.803 1.00 0.96 H new ATOM 0 HD12 LEU A 149 -9.090 -5.584 -8.733 1.00 0.96 H new ATOM 0 HD13 LEU A 149 -7.732 -4.486 -9.073 1.00 0.96 H new ATOM 0 HD21 LEU A 149 -8.274 -4.152 -12.073 1.00 0.87 H new ATOM 0 HD22 LEU A 149 -6.682 -4.460 -11.339 1.00 0.87 H new ATOM 0 HD23 LEU A 149 -7.297 -5.536 -12.616 1.00 0.87 H new ATOM 2059 N THR A 150 -9.194 -9.543 -10.095 1.00 0.46 N ATOM 2060 CA THR A 150 -10.436 -10.194 -10.568 1.00 0.38 C ATOM 2061 C THR A 150 -11.172 -10.732 -9.343 1.00 0.36 C ATOM 2062 O THR A 150 -12.385 -10.789 -9.295 1.00 0.48 O ATOM 2063 CB THR A 150 -10.058 -11.337 -11.518 1.00 0.31 C ATOM 2064 OG1 THR A 150 -8.716 -11.181 -11.935 1.00 2.00 O ATOM 2065 CG2 THR A 150 -10.945 -11.291 -12.744 1.00 2.34 C ATOM 0 H THR A 150 -8.357 -10.122 -10.161 1.00 0.46 H new ATOM 0 HA THR A 150 -11.078 -9.494 -11.103 1.00 0.38 H new ATOM 0 HB THR A 150 -10.183 -12.287 -10.998 1.00 0.31 H new ATOM 0 HG1 THR A 150 -8.616 -10.325 -12.401 1.00 2.00 H new ATOM 0 HG21 THR A 150 -10.676 -12.104 -13.419 1.00 2.34 H new ATOM 0 HG22 THR A 150 -11.987 -11.399 -12.443 1.00 2.34 H new ATOM 0 HG23 THR A 150 -10.812 -10.337 -13.254 1.00 2.34 H new ATOM 2073 N LYS A 151 -10.425 -11.104 -8.343 1.00 0.24 N ATOM 2074 CA LYS A 151 -11.025 -11.621 -7.084 1.00 0.22 C ATOM 2075 C LYS A 151 -11.695 -10.461 -6.341 1.00 0.30 C ATOM 2076 O LYS A 151 -12.760 -10.610 -5.776 1.00 0.27 O ATOM 2077 CB LYS A 151 -9.921 -12.218 -6.208 1.00 0.41 C ATOM 2078 CG LYS A 151 -10.491 -13.354 -5.357 1.00 0.28 C ATOM 2079 CD LYS A 151 -9.467 -13.760 -4.295 1.00 0.61 C ATOM 2080 CE LYS A 151 -9.651 -12.892 -3.048 1.00 0.16 C ATOM 2081 NZ LYS A 151 -8.870 -13.474 -1.919 1.00 1.28 N ATOM 0 H LYS A 151 -9.406 -11.071 -8.346 1.00 0.24 H new ATOM 0 HA LYS A 151 -11.764 -12.390 -7.311 1.00 0.22 H new ATOM 0 HB2 LYS A 151 -9.110 -12.592 -6.833 1.00 0.41 H new ATOM 0 HB3 LYS A 151 -9.498 -11.447 -5.565 1.00 0.41 H new ATOM 0 HG2 LYS A 151 -11.418 -13.036 -4.880 1.00 0.28 H new ATOM 0 HG3 LYS A 151 -10.734 -14.209 -5.988 1.00 0.28 H new ATOM 0 HD2 LYS A 151 -9.590 -14.812 -4.040 1.00 0.61 H new ATOM 0 HD3 LYS A 151 -8.456 -13.643 -4.686 1.00 0.61 H new ATOM 0 HE2 LYS A 151 -9.318 -11.874 -3.248 1.00 0.16 H new ATOM 0 HE3 LYS A 151 -10.707 -12.836 -2.783 1.00 0.16 H new ATOM 0 HZ1 LYS A 151 -8.994 -12.885 -1.071 1.00 1.28 H new ATOM 0 HZ2 LYS A 151 -9.208 -14.438 -1.724 1.00 1.28 H new ATOM 0 HZ3 LYS A 151 -7.862 -13.506 -2.174 1.00 1.28 H new ATOM 2095 N LEU A 152 -11.092 -9.297 -6.353 1.00 0.44 N ATOM 2096 CA LEU A 152 -11.721 -8.135 -5.666 1.00 0.58 C ATOM 2097 C LEU A 152 -12.948 -7.740 -6.474 1.00 0.58 C ATOM 2098 O LEU A 152 -13.975 -7.370 -5.938 1.00 0.67 O ATOM 2099 CB LEU A 152 -10.775 -6.917 -5.604 1.00 0.70 C ATOM 2100 CG LEU A 152 -9.299 -7.326 -5.664 1.00 0.77 C ATOM 2101 CD1 LEU A 152 -8.427 -6.098 -5.397 1.00 0.78 C ATOM 2102 CD2 LEU A 152 -9.007 -8.384 -4.601 1.00 0.77 C ATOM 0 H LEU A 152 -10.198 -9.106 -6.806 1.00 0.44 H new ATOM 0 HA LEU A 152 -11.967 -8.423 -4.644 1.00 0.58 H new ATOM 0 HB2 LEU A 152 -10.998 -6.244 -6.432 1.00 0.70 H new ATOM 0 HB3 LEU A 152 -10.959 -6.362 -4.684 1.00 0.70 H new ATOM 0 HG LEU A 152 -9.080 -7.735 -6.650 1.00 0.77 H new ATOM 0 HD11 LEU A 152 -7.376 -6.382 -5.438 1.00 0.78 H new ATOM 0 HD12 LEU A 152 -8.627 -5.338 -6.152 1.00 0.78 H new ATOM 0 HD13 LEU A 152 -8.656 -5.697 -4.410 1.00 0.78 H new ATOM 0 HD21 LEU A 152 -7.956 -8.669 -4.650 1.00 0.77 H new ATOM 0 HD22 LEU A 152 -9.227 -7.978 -3.614 1.00 0.77 H new ATOM 0 HD23 LEU A 152 -9.630 -9.261 -4.780 1.00 0.77 H new ATOM 2114 N GLN A 153 -12.840 -7.817 -7.771 1.00 0.53 N ATOM 2115 CA GLN A 153 -13.986 -7.451 -8.638 1.00 0.61 C ATOM 2116 C GLN A 153 -14.934 -8.648 -8.786 1.00 0.62 C ATOM 2117 O GLN A 153 -15.999 -8.535 -9.358 1.00 0.97 O ATOM 2118 CB GLN A 153 -13.473 -7.036 -10.019 1.00 0.58 C ATOM 2119 CG GLN A 153 -13.067 -5.561 -9.992 1.00 0.65 C ATOM 2120 CD GLN A 153 -14.314 -4.682 -10.098 1.00 1.20 C ATOM 2121 OE1 GLN A 153 -15.374 -5.152 -10.463 1.00 1.61 O ATOM 2122 NE2 GLN A 153 -14.233 -3.417 -9.791 1.00 2.04 N ATOM 0 H GLN A 153 -12.002 -8.120 -8.267 1.00 0.53 H new ATOM 0 HA GLN A 153 -14.525 -6.620 -8.183 1.00 0.61 H new ATOM 0 HB2 GLN A 153 -12.621 -7.653 -10.302 1.00 0.58 H new ATOM 0 HB3 GLN A 153 -14.247 -7.197 -10.769 1.00 0.58 H new ATOM 0 HG2 GLN A 153 -12.530 -5.338 -9.070 1.00 0.65 H new ATOM 0 HG3 GLN A 153 -12.387 -5.346 -10.816 1.00 0.65 H new ATOM 0 HE21 GLN A 153 -13.344 -3.022 -9.485 1.00 2.04 H new ATOM 0 HE22 GLN A 153 -15.059 -2.822 -9.857 1.00 2.04 H new ATOM 2131 N ALA A 154 -14.559 -9.794 -8.274 1.00 0.30 N ATOM 2132 CA ALA A 154 -15.446 -10.984 -8.391 1.00 0.33 C ATOM 2133 C ALA A 154 -16.102 -11.257 -7.037 1.00 0.40 C ATOM 2134 O ALA A 154 -16.143 -12.378 -6.570 1.00 0.87 O ATOM 2135 CB ALA A 154 -14.617 -12.199 -8.813 1.00 0.36 C ATOM 0 H ALA A 154 -13.680 -9.953 -7.782 1.00 0.30 H new ATOM 0 HA ALA A 154 -16.216 -10.796 -9.139 1.00 0.33 H new ATOM 0 HB1 ALA A 154 -15.266 -13.070 -8.899 1.00 0.36 H new ATOM 0 HB2 ALA A 154 -14.146 -12.001 -9.776 1.00 0.36 H new ATOM 0 HB3 ALA A 154 -13.848 -12.392 -8.065 1.00 0.36 H new ATOM 2141 N GLN A 155 -16.616 -10.238 -6.403 1.00 0.69 N ATOM 2142 CA GLN A 155 -17.270 -10.434 -5.079 1.00 0.67 C ATOM 2143 C GLN A 155 -18.763 -10.115 -5.194 1.00 0.98 C ATOM 2144 O GLN A 155 -19.259 -9.798 -6.257 1.00 1.47 O ATOM 2145 CB GLN A 155 -16.625 -9.505 -4.046 1.00 0.80 C ATOM 2146 CG GLN A 155 -15.140 -9.850 -3.895 1.00 0.68 C ATOM 2147 CD GLN A 155 -14.997 -11.205 -3.199 1.00 0.96 C ATOM 2148 OE1 GLN A 155 -15.381 -12.223 -3.739 1.00 1.54 O ATOM 2149 NE2 GLN A 155 -14.452 -11.262 -2.014 1.00 0.97 N ATOM 0 H GLN A 155 -16.611 -9.277 -6.746 1.00 0.69 H new ATOM 0 HA GLN A 155 -17.144 -11.469 -4.762 1.00 0.67 H new ATOM 0 HB2 GLN A 155 -16.737 -8.466 -4.357 1.00 0.80 H new ATOM 0 HB3 GLN A 155 -17.131 -9.606 -3.086 1.00 0.80 H new ATOM 0 HG2 GLN A 155 -14.662 -9.880 -4.874 1.00 0.68 H new ATOM 0 HG3 GLN A 155 -14.634 -9.077 -3.317 1.00 0.68 H new ATOM 0 HE21 GLN A 155 -14.129 -10.408 -1.560 1.00 0.97 H new ATOM 0 HE22 GLN A 155 -14.349 -12.161 -1.543 1.00 0.97 H new ATOM 2158 N ASN A 156 -19.483 -10.199 -4.110 1.00 0.74 N ATOM 2159 CA ASN A 156 -20.944 -9.906 -4.162 1.00 1.08 C ATOM 2160 C ASN A 156 -21.193 -8.455 -3.749 1.00 1.35 C ATOM 2161 O ASN A 156 -22.218 -8.139 -3.181 1.00 3.05 O ATOM 2162 CB ASN A 156 -21.688 -10.846 -3.211 1.00 1.36 C ATOM 2163 CG ASN A 156 -21.230 -10.592 -1.773 1.00 1.22 C ATOM 2164 OD1 ASN A 156 -20.283 -9.867 -1.543 1.00 2.74 O ATOM 2165 ND2 ASN A 156 -21.869 -11.163 -0.789 1.00 1.67 N ATOM 0 H ASN A 156 -19.124 -10.458 -3.191 1.00 0.74 H new ATOM 0 HA ASN A 156 -21.307 -10.058 -5.179 1.00 1.08 H new ATOM 0 HB2 ASN A 156 -22.763 -10.687 -3.294 1.00 1.36 H new ATOM 0 HB3 ASN A 156 -21.497 -11.883 -3.486 1.00 1.36 H new ATOM 0 HD21 ASN A 156 -21.573 -11.001 0.174 1.00 1.67 H new ATOM 0 HD22 ASN A 156 -22.664 -11.772 -0.982 1.00 1.67 H new ATOM 2172 N GLN A 157 -20.252 -7.578 -4.033 1.00 1.04 N ATOM 2173 CA GLN A 157 -20.381 -6.128 -3.672 1.00 0.89 C ATOM 2174 C GLN A 157 -19.972 -5.908 -2.209 1.00 0.91 C ATOM 2175 O GLN A 157 -19.294 -4.956 -1.888 1.00 0.89 O ATOM 2176 CB GLN A 157 -21.817 -5.649 -3.888 1.00 1.01 C ATOM 2177 CG GLN A 157 -21.846 -4.122 -3.954 1.00 0.68 C ATOM 2178 CD GLN A 157 -22.651 -3.678 -5.176 1.00 0.82 C ATOM 2179 OE1 GLN A 157 -23.701 -4.221 -5.456 1.00 1.50 O ATOM 2180 NE2 GLN A 157 -22.201 -2.704 -5.919 1.00 1.01 N ATOM 0 H GLN A 157 -19.382 -7.815 -4.510 1.00 1.04 H new ATOM 0 HA GLN A 157 -19.718 -5.552 -4.317 1.00 0.89 H new ATOM 0 HB2 GLN A 157 -22.216 -6.070 -4.811 1.00 1.01 H new ATOM 0 HB3 GLN A 157 -22.454 -6.000 -3.076 1.00 1.01 H new ATOM 0 HG2 GLN A 157 -22.291 -3.717 -3.045 1.00 0.68 H new ATOM 0 HG3 GLN A 157 -20.830 -3.731 -4.013 1.00 0.68 H new ATOM 0 HE21 GLN A 157 -21.319 -2.248 -5.684 1.00 1.01 H new ATOM 0 HE22 GLN A 157 -22.731 -2.398 -6.735 1.00 1.01 H new ATOM 2189 N TRP A 158 -20.372 -6.779 -1.324 1.00 0.96 N ATOM 2190 CA TRP A 158 -20.002 -6.624 0.108 1.00 0.97 C ATOM 2191 C TRP A 158 -18.477 -6.642 0.245 1.00 0.83 C ATOM 2192 O TRP A 158 -17.868 -5.682 0.680 1.00 0.72 O ATOM 2193 CB TRP A 158 -20.599 -7.792 0.891 1.00 1.16 C ATOM 2194 CG TRP A 158 -20.245 -7.661 2.338 1.00 1.23 C ATOM 2195 CD1 TRP A 158 -19.012 -7.856 2.856 1.00 1.30 C ATOM 2196 CD2 TRP A 158 -21.110 -7.312 3.458 1.00 1.30 C ATOM 2197 NE1 TRP A 158 -19.063 -7.652 4.222 1.00 1.35 N ATOM 2198 CE2 TRP A 158 -20.335 -7.314 4.642 1.00 1.35 C ATOM 2199 CE3 TRP A 158 -22.477 -6.999 3.561 1.00 1.39 C ATOM 2200 CZ2 TRP A 158 -20.896 -7.015 5.883 1.00 1.44 C ATOM 2201 CZ3 TRP A 158 -23.045 -6.697 4.810 1.00 1.53 C ATOM 2202 CH2 TRP A 158 -22.256 -6.706 5.968 1.00 1.54 C ATOM 0 H TRP A 158 -20.944 -7.597 -1.535 1.00 0.96 H new ATOM 0 HA TRP A 158 -20.384 -5.679 0.495 1.00 0.97 H new ATOM 0 HB2 TRP A 158 -21.682 -7.807 0.771 1.00 1.16 H new ATOM 0 HB3 TRP A 158 -20.222 -8.736 0.498 1.00 1.16 H new ATOM 0 HD1 TRP A 158 -18.130 -8.127 2.294 1.00 1.30 H new ATOM 0 HE1 TRP A 158 -18.260 -7.740 4.844 1.00 1.35 H new ATOM 0 HE3 TRP A 158 -23.094 -6.991 2.675 1.00 1.39 H new ATOM 0 HZ2 TRP A 158 -20.283 -7.022 6.772 1.00 1.44 H new ATOM 0 HZ3 TRP A 158 -24.096 -6.457 4.878 1.00 1.53 H new ATOM 0 HH2 TRP A 158 -22.699 -6.474 6.925 1.00 1.54 H new ATOM 2213 N LEU A 159 -17.855 -7.725 -0.130 1.00 0.84 N ATOM 2214 CA LEU A 159 -16.371 -7.802 -0.029 1.00 0.73 C ATOM 2215 C LEU A 159 -15.745 -6.798 -1.001 1.00 0.57 C ATOM 2216 O LEU A 159 -14.591 -6.438 -0.875 1.00 0.52 O ATOM 2217 CB LEU A 159 -15.909 -9.217 -0.383 1.00 0.86 C ATOM 2218 CG LEU A 159 -16.690 -10.230 0.454 1.00 0.71 C ATOM 2219 CD1 LEU A 159 -17.631 -11.028 -0.452 1.00 1.02 C ATOM 2220 CD2 LEU A 159 -15.710 -11.186 1.139 1.00 1.46 C ATOM 0 H LEU A 159 -18.310 -8.559 -0.502 1.00 0.84 H new ATOM 0 HA LEU A 159 -16.060 -7.565 0.988 1.00 0.73 H new ATOM 0 HB2 LEU A 159 -16.066 -9.408 -1.445 1.00 0.86 H new ATOM 0 HB3 LEU A 159 -14.840 -9.320 -0.195 1.00 0.86 H new ATOM 0 HG LEU A 159 -17.275 -9.703 1.208 1.00 0.71 H new ATOM 0 HD11 LEU A 159 -18.187 -11.750 0.146 1.00 1.02 H new ATOM 0 HD12 LEU A 159 -18.329 -10.348 -0.941 1.00 1.02 H new ATOM 0 HD13 LEU A 159 -17.048 -11.555 -1.207 1.00 1.02 H new ATOM 0 HD21 LEU A 159 -16.265 -11.909 1.737 1.00 1.46 H new ATOM 0 HD22 LEU A 159 -15.126 -11.711 0.383 1.00 1.46 H new ATOM 0 HD23 LEU A 159 -15.040 -10.619 1.786 1.00 1.46 H new ATOM 2232 N GLN A 160 -16.497 -6.334 -1.965 1.00 0.51 N ATOM 2233 CA GLN A 160 -15.944 -5.347 -2.932 1.00 0.37 C ATOM 2234 C GLN A 160 -15.904 -3.969 -2.269 1.00 0.33 C ATOM 2235 O GLN A 160 -15.115 -3.117 -2.624 1.00 0.49 O ATOM 2236 CB GLN A 160 -16.842 -5.293 -4.170 1.00 0.52 C ATOM 2237 CG GLN A 160 -16.204 -4.389 -5.225 1.00 0.66 C ATOM 2238 CD GLN A 160 -16.746 -4.754 -6.607 1.00 0.70 C ATOM 2239 OE1 GLN A 160 -16.003 -4.822 -7.566 1.00 1.67 O ATOM 2240 NE2 GLN A 160 -18.021 -4.994 -6.752 1.00 1.34 N ATOM 0 H GLN A 160 -17.470 -6.597 -2.122 1.00 0.51 H new ATOM 0 HA GLN A 160 -14.937 -5.642 -3.228 1.00 0.37 H new ATOM 0 HB2 GLN A 160 -16.984 -6.296 -4.573 1.00 0.52 H new ATOM 0 HB3 GLN A 160 -17.828 -4.915 -3.901 1.00 0.52 H new ATOM 0 HG2 GLN A 160 -16.420 -3.344 -5.002 1.00 0.66 H new ATOM 0 HG3 GLN A 160 -15.120 -4.501 -5.207 1.00 0.66 H new ATOM 0 HE21 GLN A 160 -18.645 -4.937 -5.947 1.00 1.34 H new ATOM 0 HE22 GLN A 160 -18.393 -5.238 -7.670 1.00 1.34 H new ATOM 2249 N ASP A 161 -16.752 -3.751 -1.302 1.00 0.56 N ATOM 2250 CA ASP A 161 -16.774 -2.438 -0.603 1.00 0.58 C ATOM 2251 C ASP A 161 -15.740 -2.454 0.523 1.00 0.43 C ATOM 2252 O ASP A 161 -15.207 -1.432 0.906 1.00 0.51 O ATOM 2253 CB ASP A 161 -18.168 -2.206 -0.014 1.00 0.80 C ATOM 2254 CG ASP A 161 -18.419 -0.705 0.136 1.00 0.96 C ATOM 2255 OD1 ASP A 161 -18.402 -0.017 -0.872 1.00 1.83 O ATOM 2256 OD2 ASP A 161 -18.624 -0.267 1.256 1.00 0.90 O ATOM 0 H ASP A 161 -17.434 -4.431 -0.965 1.00 0.56 H new ATOM 0 HA ASP A 161 -16.537 -1.639 -1.305 1.00 0.58 H new ATOM 0 HB2 ASP A 161 -18.925 -2.649 -0.661 1.00 0.80 H new ATOM 0 HB3 ASP A 161 -18.250 -2.697 0.956 1.00 0.80 H new ATOM 2261 N MET A 162 -15.450 -3.611 1.057 1.00 0.37 N ATOM 2262 CA MET A 162 -14.447 -3.693 2.156 1.00 0.23 C ATOM 2263 C MET A 162 -13.036 -3.700 1.547 1.00 0.18 C ATOM 2264 O MET A 162 -12.086 -3.259 2.156 1.00 0.19 O ATOM 2265 CB MET A 162 -14.732 -4.964 3.004 1.00 0.31 C ATOM 2266 CG MET A 162 -13.593 -6.000 2.922 1.00 0.44 C ATOM 2267 SD MET A 162 -12.213 -5.463 3.965 1.00 0.73 S ATOM 2268 CE MET A 162 -10.903 -5.612 2.723 1.00 0.37 C ATOM 0 H MET A 162 -15.864 -4.501 0.779 1.00 0.37 H new ATOM 0 HA MET A 162 -14.516 -2.830 2.818 1.00 0.23 H new ATOM 0 HB2 MET A 162 -14.882 -4.676 4.045 1.00 0.31 H new ATOM 0 HB3 MET A 162 -15.660 -5.423 2.664 1.00 0.31 H new ATOM 0 HG2 MET A 162 -13.951 -6.977 3.248 1.00 0.44 H new ATOM 0 HG3 MET A 162 -13.261 -6.111 1.890 1.00 0.44 H new ATOM 0 HE1 MET A 162 -10.095 -6.228 3.118 1.00 0.37 H new ATOM 0 HE2 MET A 162 -11.306 -6.077 1.823 1.00 0.37 H new ATOM 0 HE3 MET A 162 -10.519 -4.622 2.479 1.00 0.37 H new ATOM 2278 N THR A 163 -12.899 -4.205 0.353 1.00 0.14 N ATOM 2279 CA THR A 163 -11.556 -4.251 -0.293 1.00 0.11 C ATOM 2280 C THR A 163 -10.890 -2.873 -0.226 1.00 0.09 C ATOM 2281 O THR A 163 -9.754 -2.744 0.180 1.00 0.09 O ATOM 2282 CB THR A 163 -11.713 -4.676 -1.755 1.00 0.08 C ATOM 2283 OG1 THR A 163 -12.282 -5.976 -1.805 1.00 0.22 O ATOM 2284 CG2 THR A 163 -10.342 -4.689 -2.436 1.00 0.16 C ATOM 0 H THR A 163 -13.661 -4.589 -0.206 1.00 0.14 H new ATOM 0 HA THR A 163 -10.929 -4.970 0.234 1.00 0.11 H new ATOM 0 HB THR A 163 -12.364 -3.972 -2.273 1.00 0.08 H new ATOM 0 HG1 THR A 163 -13.259 -5.907 -1.769 1.00 0.22 H new ATOM 0 HG21 THR A 163 -10.456 -4.992 -3.477 1.00 0.16 H new ATOM 0 HG22 THR A 163 -9.905 -3.691 -2.394 1.00 0.16 H new ATOM 0 HG23 THR A 163 -9.687 -5.393 -1.923 1.00 0.16 H new ATOM 2292 N THR A 164 -11.582 -1.841 -0.624 1.00 0.11 N ATOM 2293 CA THR A 164 -10.978 -0.478 -0.582 1.00 0.13 C ATOM 2294 C THR A 164 -10.638 -0.105 0.866 1.00 0.16 C ATOM 2295 O THR A 164 -9.695 0.617 1.126 1.00 0.20 O ATOM 2296 CB THR A 164 -11.976 0.533 -1.147 1.00 0.14 C ATOM 2297 OG1 THR A 164 -11.405 1.834 -1.112 1.00 1.58 O ATOM 2298 CG2 THR A 164 -13.253 0.512 -0.306 1.00 1.83 C ATOM 0 H THR A 164 -12.538 -1.882 -0.976 1.00 0.11 H new ATOM 0 HA THR A 164 -10.066 -0.468 -1.178 1.00 0.13 H new ATOM 0 HB THR A 164 -12.216 0.271 -2.177 1.00 0.14 H new ATOM 0 HG1 THR A 164 -12.044 2.482 -1.476 1.00 1.58 H new ATOM 0 HG21 THR A 164 -13.965 1.233 -0.708 1.00 1.83 H new ATOM 0 HG22 THR A 164 -13.691 -0.486 -0.334 1.00 1.83 H new ATOM 0 HG23 THR A 164 -13.014 0.774 0.725 1.00 1.83 H new ATOM 2306 N HIS A 165 -11.403 -0.584 1.807 1.00 0.22 N ATOM 2307 CA HIS A 165 -11.135 -0.253 3.237 1.00 0.24 C ATOM 2308 C HIS A 165 -9.762 -0.805 3.658 1.00 0.17 C ATOM 2309 O HIS A 165 -8.914 -0.077 4.135 1.00 0.29 O ATOM 2310 CB HIS A 165 -12.252 -0.866 4.108 1.00 0.31 C ATOM 2311 CG HIS A 165 -11.851 -0.883 5.562 1.00 0.50 C ATOM 2312 ND1 HIS A 165 -11.075 -1.898 6.096 1.00 0.88 N ATOM 2313 CD2 HIS A 165 -12.111 -0.025 6.601 1.00 0.82 C ATOM 2314 CE1 HIS A 165 -10.897 -1.631 7.400 1.00 0.95 C ATOM 2315 NE2 HIS A 165 -11.507 -0.498 7.762 1.00 0.84 N ATOM 0 H HIS A 165 -12.206 -1.193 1.648 1.00 0.22 H new ATOM 0 HA HIS A 165 -11.123 0.829 3.370 1.00 0.24 H new ATOM 0 HB2 HIS A 165 -13.170 -0.292 3.986 1.00 0.31 H new ATOM 0 HB3 HIS A 165 -12.464 -1.881 3.773 1.00 0.31 H new ATOM 0 HD2 HIS A 165 -12.696 0.880 6.529 1.00 0.82 H new ATOM 0 HE1 HIS A 165 -10.330 -2.256 8.074 1.00 0.95 H new ATOM 0 HE2 HIS A 165 -11.526 -0.072 8.689 1.00 0.84 H new ATOM 2323 N LEU A 166 -9.546 -2.083 3.513 1.00 0.19 N ATOM 2324 CA LEU A 166 -8.240 -2.669 3.936 1.00 0.22 C ATOM 2325 C LEU A 166 -7.089 -2.087 3.113 1.00 0.19 C ATOM 2326 O LEU A 166 -6.002 -1.898 3.621 1.00 0.23 O ATOM 2327 CB LEU A 166 -8.275 -4.187 3.763 1.00 0.30 C ATOM 2328 CG LEU A 166 -7.151 -4.815 4.590 1.00 0.78 C ATOM 2329 CD1 LEU A 166 -7.712 -5.967 5.425 1.00 1.21 C ATOM 2330 CD2 LEU A 166 -6.060 -5.345 3.657 1.00 2.62 C ATOM 0 H LEU A 166 -10.214 -2.747 3.121 1.00 0.19 H new ATOM 0 HA LEU A 166 -8.077 -2.422 4.985 1.00 0.22 H new ATOM 0 HB2 LEU A 166 -9.240 -4.579 4.083 1.00 0.30 H new ATOM 0 HB3 LEU A 166 -8.158 -4.448 2.711 1.00 0.30 H new ATOM 0 HG LEU A 166 -6.726 -4.060 5.252 1.00 0.78 H new ATOM 0 HD11 LEU A 166 -6.911 -6.414 6.014 1.00 1.21 H new ATOM 0 HD12 LEU A 166 -8.486 -5.589 6.093 1.00 1.21 H new ATOM 0 HD13 LEU A 166 -8.140 -6.721 4.764 1.00 1.21 H new ATOM 0 HD21 LEU A 166 -5.261 -5.792 4.249 1.00 2.62 H new ATOM 0 HD22 LEU A 166 -6.484 -6.098 2.992 1.00 2.62 H new ATOM 0 HD23 LEU A 166 -5.657 -4.523 3.065 1.00 2.62 H new ATOM 2342 N ILE A 167 -7.296 -1.802 1.854 1.00 0.16 N ATOM 2343 CA ILE A 167 -6.176 -1.238 1.046 1.00 0.20 C ATOM 2344 C ILE A 167 -5.674 0.042 1.720 1.00 0.16 C ATOM 2345 O ILE A 167 -4.523 0.149 2.082 1.00 0.09 O ATOM 2346 CB ILE A 167 -6.645 -0.915 -0.380 1.00 0.25 C ATOM 2347 CG1 ILE A 167 -7.005 -2.214 -1.105 1.00 0.31 C ATOM 2348 CG2 ILE A 167 -5.517 -0.205 -1.145 1.00 0.37 C ATOM 2349 CD1 ILE A 167 -7.675 -1.885 -2.441 1.00 0.35 C ATOM 0 H ILE A 167 -8.177 -1.933 1.357 1.00 0.16 H new ATOM 0 HA ILE A 167 -5.374 -1.974 0.988 1.00 0.20 H new ATOM 0 HB ILE A 167 -7.519 -0.266 -0.333 1.00 0.25 H new ATOM 0 HG12 ILE A 167 -6.108 -2.810 -1.273 1.00 0.31 H new ATOM 0 HG13 ILE A 167 -7.675 -2.813 -0.488 1.00 0.31 H new ATOM 0 HG21 ILE A 167 -5.851 0.024 -2.157 1.00 0.37 H new ATOM 0 HG22 ILE A 167 -5.255 0.720 -0.632 1.00 0.37 H new ATOM 0 HG23 ILE A 167 -4.643 -0.855 -1.190 1.00 0.37 H new ATOM 0 HD11 ILE A 167 -7.931 -2.810 -2.957 1.00 0.35 H new ATOM 0 HD12 ILE A 167 -8.581 -1.307 -2.261 1.00 0.35 H new ATOM 0 HD13 ILE A 167 -6.990 -1.303 -3.058 1.00 0.35 H new ATOM 2361 N LEU A 168 -6.532 1.009 1.889 1.00 0.20 N ATOM 2362 CA LEU A 168 -6.103 2.279 2.542 1.00 0.17 C ATOM 2363 C LEU A 168 -5.620 1.986 3.967 1.00 0.14 C ATOM 2364 O LEU A 168 -4.942 2.788 4.576 1.00 0.12 O ATOM 2365 CB LEU A 168 -7.283 3.252 2.593 1.00 0.16 C ATOM 2366 CG LEU A 168 -7.812 3.491 1.178 1.00 0.21 C ATOM 2367 CD1 LEU A 168 -9.316 3.767 1.233 1.00 0.39 C ATOM 2368 CD2 LEU A 168 -7.095 4.695 0.564 1.00 0.57 C ATOM 0 H LEU A 168 -7.511 0.976 1.604 1.00 0.20 H new ATOM 0 HA LEU A 168 -5.290 2.724 1.968 1.00 0.17 H new ATOM 0 HB2 LEU A 168 -8.074 2.847 3.224 1.00 0.16 H new ATOM 0 HB3 LEU A 168 -6.970 4.196 3.039 1.00 0.16 H new ATOM 0 HG LEU A 168 -7.628 2.607 0.568 1.00 0.21 H new ATOM 0 HD11 LEU A 168 -9.692 3.937 0.224 1.00 0.39 H new ATOM 0 HD12 LEU A 168 -9.827 2.910 1.671 1.00 0.39 H new ATOM 0 HD13 LEU A 168 -9.502 4.651 1.843 1.00 0.39 H new ATOM 0 HD21 LEU A 168 -7.471 4.867 -0.445 1.00 0.57 H new ATOM 0 HD22 LEU A 168 -7.279 5.579 1.175 1.00 0.57 H new ATOM 0 HD23 LEU A 168 -6.024 4.499 0.523 1.00 0.57 H new ATOM 2380 N ARG A 169 -5.965 0.845 4.505 1.00 0.18 N ATOM 2381 CA ARG A 169 -5.523 0.511 5.889 1.00 0.20 C ATOM 2382 C ARG A 169 -4.032 0.167 5.882 1.00 0.26 C ATOM 2383 O ARG A 169 -3.294 0.549 6.769 1.00 0.31 O ATOM 2384 CB ARG A 169 -6.320 -0.688 6.407 1.00 0.32 C ATOM 2385 CG ARG A 169 -5.850 -1.041 7.821 1.00 1.08 C ATOM 2386 CD ARG A 169 -7.040 -1.527 8.648 1.00 0.50 C ATOM 2387 NE ARG A 169 -6.573 -1.923 10.006 1.00 0.72 N ATOM 2388 CZ ARG A 169 -6.417 -3.185 10.298 1.00 1.81 C ATOM 2389 NH1 ARG A 169 -5.455 -3.870 9.742 1.00 2.90 N ATOM 2390 NH2 ARG A 169 -7.223 -3.764 11.145 1.00 2.30 N ATOM 0 H ARG A 169 -6.532 0.132 4.046 1.00 0.18 H new ATOM 0 HA ARG A 169 -5.695 1.369 6.539 1.00 0.20 H new ATOM 0 HB2 ARG A 169 -7.385 -0.455 6.414 1.00 0.32 H new ATOM 0 HB3 ARG A 169 -6.185 -1.542 5.743 1.00 0.32 H new ATOM 0 HG2 ARG A 169 -5.083 -1.815 7.778 1.00 1.08 H new ATOM 0 HG3 ARG A 169 -5.397 -0.169 8.293 1.00 1.08 H new ATOM 0 HD2 ARG A 169 -7.789 -0.739 8.725 1.00 0.50 H new ATOM 0 HD3 ARG A 169 -7.518 -2.374 8.155 1.00 0.50 H new ATOM 0 HE ARG A 169 -6.375 -1.209 10.707 1.00 0.72 H new ATOM 0 HH11 ARG A 169 -4.825 -3.419 9.079 1.00 2.90 H new ATOM 0 HH12 ARG A 169 -5.333 -4.857 9.971 1.00 2.90 H new ATOM 0 HH21 ARG A 169 -7.976 -3.230 11.579 1.00 2.30 H new ATOM 0 HH22 ARG A 169 -7.100 -4.751 11.373 1.00 2.30 H new ATOM 2404 N SER A 170 -3.579 -0.546 4.885 1.00 0.26 N ATOM 2405 CA SER A 170 -2.141 -0.902 4.826 1.00 0.34 C ATOM 2406 C SER A 170 -1.357 0.325 4.386 1.00 0.33 C ATOM 2407 O SER A 170 -0.327 0.642 4.924 1.00 0.41 O ATOM 2408 CB SER A 170 -1.936 -2.035 3.820 1.00 0.36 C ATOM 2409 OG SER A 170 -1.143 -3.054 4.415 1.00 0.71 O ATOM 0 H SER A 170 -4.146 -0.895 4.112 1.00 0.26 H new ATOM 0 HA SER A 170 -1.795 -1.232 5.806 1.00 0.34 H new ATOM 0 HB2 SER A 170 -2.899 -2.441 3.511 1.00 0.36 H new ATOM 0 HB3 SER A 170 -1.448 -1.656 2.922 1.00 0.36 H new ATOM 0 HG SER A 170 -1.143 -3.847 3.839 1.00 0.71 H new ATOM 2415 N PHE A 171 -1.841 1.039 3.415 1.00 0.28 N ATOM 2416 CA PHE A 171 -1.110 2.250 2.965 1.00 0.31 C ATOM 2417 C PHE A 171 -0.825 3.148 4.169 1.00 0.31 C ATOM 2418 O PHE A 171 0.302 3.484 4.443 1.00 0.22 O ATOM 2419 CB PHE A 171 -1.952 2.997 1.939 1.00 0.29 C ATOM 2420 CG PHE A 171 -1.654 2.426 0.582 1.00 0.36 C ATOM 2421 CD1 PHE A 171 -2.009 1.106 0.286 1.00 0.51 C ATOM 2422 CD2 PHE A 171 -1.008 3.210 -0.376 1.00 0.61 C ATOM 2423 CE1 PHE A 171 -1.717 0.569 -0.971 1.00 0.55 C ATOM 2424 CE2 PHE A 171 -0.717 2.676 -1.634 1.00 0.65 C ATOM 2425 CZ PHE A 171 -1.071 1.355 -1.933 1.00 0.48 C ATOM 0 H PHE A 171 -2.707 0.838 2.915 1.00 0.28 H new ATOM 0 HA PHE A 171 -0.164 1.962 2.506 1.00 0.31 H new ATOM 0 HB2 PHE A 171 -3.012 2.894 2.170 1.00 0.29 H new ATOM 0 HB3 PHE A 171 -1.722 4.062 1.962 1.00 0.29 H new ATOM 0 HD1 PHE A 171 -2.509 0.502 1.029 1.00 0.51 H new ATOM 0 HD2 PHE A 171 -0.733 4.229 -0.145 1.00 0.61 H new ATOM 0 HE1 PHE A 171 -1.989 -0.451 -1.200 1.00 0.55 H new ATOM 0 HE2 PHE A 171 -0.219 3.283 -2.376 1.00 0.65 H new ATOM 0 HZ PHE A 171 -0.846 0.942 -2.905 1.00 0.48 H new ATOM 2435 N LYS A 172 -1.829 3.519 4.905 1.00 0.44 N ATOM 2436 CA LYS A 172 -1.590 4.379 6.097 1.00 0.45 C ATOM 2437 C LYS A 172 -0.556 3.714 7.017 1.00 0.40 C ATOM 2438 O LYS A 172 0.520 4.236 7.238 1.00 0.36 O ATOM 2439 CB LYS A 172 -2.904 4.566 6.858 1.00 0.52 C ATOM 2440 CG LYS A 172 -2.818 5.827 7.719 1.00 0.99 C ATOM 2441 CD LYS A 172 -3.604 6.957 7.050 1.00 0.72 C ATOM 2442 CE LYS A 172 -4.148 7.904 8.122 1.00 0.94 C ATOM 2443 NZ LYS A 172 -3.230 9.068 8.269 1.00 1.72 N ATOM 0 H LYS A 172 -2.803 3.267 4.736 1.00 0.44 H new ATOM 0 HA LYS A 172 -1.212 5.349 5.774 1.00 0.45 H new ATOM 0 HB2 LYS A 172 -3.735 4.647 6.157 1.00 0.52 H new ATOM 0 HB3 LYS A 172 -3.100 3.697 7.486 1.00 0.52 H new ATOM 0 HG2 LYS A 172 -3.219 5.629 8.713 1.00 0.99 H new ATOM 0 HG3 LYS A 172 -1.777 6.121 7.849 1.00 0.99 H new ATOM 0 HD2 LYS A 172 -2.961 7.503 6.360 1.00 0.72 H new ATOM 0 HD3 LYS A 172 -4.425 6.545 6.463 1.00 0.72 H new ATOM 0 HE2 LYS A 172 -5.146 8.247 7.847 1.00 0.94 H new ATOM 0 HE3 LYS A 172 -4.242 7.379 9.073 1.00 0.94 H new ATOM 0 HZ1 LYS A 172 -3.600 9.712 8.997 1.00 1.72 H new ATOM 0 HZ2 LYS A 172 -2.286 8.733 8.550 1.00 1.72 H new ATOM 0 HZ3 LYS A 172 -3.162 9.573 7.363 1.00 1.72 H new ATOM 2457 N GLU A 173 -0.878 2.570 7.558 1.00 0.40 N ATOM 2458 CA GLU A 173 0.076 1.875 8.473 1.00 0.36 C ATOM 2459 C GLU A 173 1.305 1.386 7.701 1.00 0.35 C ATOM 2460 O GLU A 173 2.382 1.916 7.849 1.00 0.36 O ATOM 2461 CB GLU A 173 -0.625 0.677 9.115 1.00 0.40 C ATOM 2462 CG GLU A 173 -1.315 1.120 10.407 1.00 0.94 C ATOM 2463 CD GLU A 173 -1.338 -0.042 11.402 1.00 0.56 C ATOM 2464 OE1 GLU A 173 -0.559 -0.965 11.226 1.00 0.67 O ATOM 2465 OE2 GLU A 173 -2.133 0.010 12.326 1.00 1.23 O ATOM 0 H GLU A 173 -1.762 2.085 7.406 1.00 0.40 H new ATOM 0 HA GLU A 173 0.401 2.577 9.241 1.00 0.36 H new ATOM 0 HB2 GLU A 173 -1.357 0.258 8.425 1.00 0.40 H new ATOM 0 HB3 GLU A 173 0.099 -0.110 9.328 1.00 0.40 H new ATOM 0 HG2 GLU A 173 -0.788 1.971 10.839 1.00 0.94 H new ATOM 0 HG3 GLU A 173 -2.332 1.449 10.193 1.00 0.94 H new ATOM 2472 N PHE A 174 1.142 0.362 6.900 1.00 0.32 N ATOM 2473 CA PHE A 174 2.283 -0.216 6.108 1.00 0.31 C ATOM 2474 C PHE A 174 3.256 0.872 5.620 1.00 0.33 C ATOM 2475 O PHE A 174 4.417 0.869 5.976 1.00 0.36 O ATOM 2476 CB PHE A 174 1.725 -0.969 4.898 1.00 0.27 C ATOM 2477 CG PHE A 174 2.715 -2.011 4.452 1.00 0.33 C ATOM 2478 CD1 PHE A 174 3.778 -1.651 3.618 1.00 1.10 C ATOM 2479 CD2 PHE A 174 2.572 -3.336 4.875 1.00 0.62 C ATOM 2480 CE1 PHE A 174 4.704 -2.617 3.207 1.00 1.13 C ATOM 2481 CE2 PHE A 174 3.498 -4.305 4.463 1.00 0.67 C ATOM 2482 CZ PHE A 174 4.564 -3.944 3.630 1.00 0.49 C ATOM 0 H PHE A 174 0.249 -0.110 6.756 1.00 0.32 H new ATOM 0 HA PHE A 174 2.835 -0.890 6.762 1.00 0.31 H new ATOM 0 HB2 PHE A 174 0.777 -1.441 5.156 1.00 0.27 H new ATOM 0 HB3 PHE A 174 1.524 -0.272 4.084 1.00 0.27 H new ATOM 0 HD1 PHE A 174 3.885 -0.627 3.291 1.00 1.10 H new ATOM 0 HD2 PHE A 174 1.750 -3.613 5.518 1.00 0.62 H new ATOM 0 HE1 PHE A 174 5.526 -2.339 2.564 1.00 1.13 H new ATOM 0 HE2 PHE A 174 3.389 -5.329 4.788 1.00 0.67 H new ATOM 0 HZ PHE A 174 5.278 -4.690 3.314 1.00 0.49 H new ATOM 2492 N LEU A 175 2.810 1.795 4.804 1.00 0.32 N ATOM 2493 CA LEU A 175 3.748 2.851 4.312 1.00 0.35 C ATOM 2494 C LEU A 175 4.399 3.557 5.507 1.00 0.37 C ATOM 2495 O LEU A 175 5.585 3.824 5.510 1.00 0.38 O ATOM 2496 CB LEU A 175 2.997 3.888 3.465 1.00 0.33 C ATOM 2497 CG LEU A 175 2.537 3.265 2.139 1.00 0.33 C ATOM 2498 CD1 LEU A 175 1.400 4.098 1.547 1.00 0.36 C ATOM 2499 CD2 LEU A 175 3.698 3.257 1.144 1.00 0.31 C ATOM 0 H LEU A 175 1.852 1.863 4.461 1.00 0.32 H new ATOM 0 HA LEU A 175 4.512 2.376 3.697 1.00 0.35 H new ATOM 0 HB2 LEU A 175 2.135 4.262 4.017 1.00 0.33 H new ATOM 0 HB3 LEU A 175 3.644 4.743 3.267 1.00 0.33 H new ATOM 0 HG LEU A 175 2.197 2.246 2.327 1.00 0.33 H new ATOM 0 HD11 LEU A 175 1.075 3.654 0.606 1.00 0.36 H new ATOM 0 HD12 LEU A 175 0.563 4.120 2.245 1.00 0.36 H new ATOM 0 HD13 LEU A 175 1.749 5.115 1.367 1.00 0.36 H new ATOM 0 HD21 LEU A 175 3.369 2.814 0.204 1.00 0.31 H new ATOM 0 HD22 LEU A 175 4.032 4.279 0.966 1.00 0.31 H new ATOM 0 HD23 LEU A 175 4.522 2.672 1.551 1.00 0.31 H new ATOM 2511 N GLN A 176 3.635 3.864 6.523 1.00 0.39 N ATOM 2512 CA GLN A 176 4.215 4.557 7.712 1.00 0.42 C ATOM 2513 C GLN A 176 5.382 3.741 8.279 1.00 0.33 C ATOM 2514 O GLN A 176 6.350 4.284 8.771 1.00 0.19 O ATOM 2515 CB GLN A 176 3.137 4.715 8.786 1.00 0.52 C ATOM 2516 CG GLN A 176 2.444 6.067 8.619 1.00 0.69 C ATOM 2517 CD GLN A 176 2.449 6.809 9.956 1.00 1.08 C ATOM 2518 OE1 GLN A 176 3.108 7.820 10.100 1.00 2.36 O ATOM 2519 NE2 GLN A 176 1.736 6.347 10.946 1.00 0.42 N ATOM 0 H GLN A 176 2.636 3.665 6.581 1.00 0.39 H new ATOM 0 HA GLN A 176 4.579 5.539 7.409 1.00 0.42 H new ATOM 0 HB2 GLN A 176 2.408 3.909 8.706 1.00 0.52 H new ATOM 0 HB3 GLN A 176 3.584 4.644 9.778 1.00 0.52 H new ATOM 0 HG2 GLN A 176 2.956 6.659 7.860 1.00 0.69 H new ATOM 0 HG3 GLN A 176 1.420 5.923 8.274 1.00 0.69 H new ATOM 0 HE21 GLN A 176 1.183 5.498 10.824 1.00 0.42 H new ATOM 0 HE22 GLN A 176 1.731 6.834 11.842 1.00 0.42 H new ATOM 2528 N SER A 177 5.295 2.441 8.219 1.00 0.43 N ATOM 2529 CA SER A 177 6.393 1.592 8.758 1.00 0.36 C ATOM 2530 C SER A 177 7.603 1.675 7.827 1.00 0.28 C ATOM 2531 O SER A 177 8.735 1.587 8.257 1.00 0.21 O ATOM 2532 CB SER A 177 5.915 0.143 8.850 1.00 0.40 C ATOM 2533 OG SER A 177 4.887 0.049 9.829 1.00 0.41 O ATOM 0 H SER A 177 4.509 1.929 7.819 1.00 0.43 H new ATOM 0 HA SER A 177 6.675 1.944 9.750 1.00 0.36 H new ATOM 0 HB2 SER A 177 5.543 -0.192 7.882 1.00 0.40 H new ATOM 0 HB3 SER A 177 6.746 -0.510 9.115 1.00 0.40 H new ATOM 0 HG SER A 177 4.577 -0.879 9.890 1.00 0.41 H new ATOM 2539 N SER A 178 7.373 1.848 6.555 1.00 0.33 N ATOM 2540 CA SER A 178 8.512 1.943 5.600 1.00 0.30 C ATOM 2541 C SER A 178 9.296 3.224 5.890 1.00 0.28 C ATOM 2542 O SER A 178 10.494 3.290 5.698 1.00 0.30 O ATOM 2543 CB SER A 178 7.975 1.987 4.170 1.00 0.38 C ATOM 2544 OG SER A 178 7.540 3.308 3.873 1.00 1.45 O ATOM 0 H SER A 178 6.446 1.928 6.136 1.00 0.33 H new ATOM 0 HA SER A 178 9.164 1.077 5.713 1.00 0.30 H new ATOM 0 HB2 SER A 178 8.751 1.681 3.468 1.00 0.38 H new ATOM 0 HB3 SER A 178 7.148 1.285 4.058 1.00 0.38 H new ATOM 0 HG SER A 178 6.809 3.555 4.477 1.00 1.45 H new ATOM 2550 N LEU A 179 8.623 4.241 6.352 1.00 0.25 N ATOM 2551 CA LEU A 179 9.315 5.523 6.658 1.00 0.23 C ATOM 2552 C LEU A 179 10.155 5.360 7.928 1.00 0.19 C ATOM 2553 O LEU A 179 11.357 5.543 7.920 1.00 0.33 O ATOM 2554 CB LEU A 179 8.271 6.621 6.882 1.00 0.22 C ATOM 2555 CG LEU A 179 8.304 7.610 5.716 1.00 0.98 C ATOM 2556 CD1 LEU A 179 6.915 7.691 5.079 1.00 1.36 C ATOM 2557 CD2 LEU A 179 8.706 8.994 6.234 1.00 1.42 C ATOM 0 H LEU A 179 7.619 4.239 6.531 1.00 0.25 H new ATOM 0 HA LEU A 179 9.962 5.794 5.824 1.00 0.23 H new ATOM 0 HB2 LEU A 179 7.278 6.180 6.969 1.00 0.22 H new ATOM 0 HB3 LEU A 179 8.472 7.141 7.818 1.00 0.22 H new ATOM 0 HG LEU A 179 9.028 7.274 4.973 1.00 0.98 H new ATOM 0 HD11 LEU A 179 6.937 8.396 4.248 1.00 1.36 H new ATOM 0 HD12 LEU A 179 6.625 6.706 4.713 1.00 1.36 H new ATOM 0 HD13 LEU A 179 6.193 8.029 5.822 1.00 1.36 H new ATOM 0 HD21 LEU A 179 8.730 9.700 5.404 1.00 1.42 H new ATOM 0 HD22 LEU A 179 7.981 9.330 6.975 1.00 1.42 H new ATOM 0 HD23 LEU A 179 9.694 8.938 6.692 1.00 1.42 H new ATOM 2569 N ARG A 180 9.529 5.021 9.022 1.00 0.25 N ATOM 2570 CA ARG A 180 10.284 4.852 10.297 1.00 0.22 C ATOM 2571 C ARG A 180 11.307 3.722 10.155 1.00 0.13 C ATOM 2572 O ARG A 180 12.245 3.625 10.921 1.00 0.18 O ATOM 2573 CB ARG A 180 9.307 4.514 11.424 1.00 0.40 C ATOM 2574 CG ARG A 180 8.474 3.294 11.031 1.00 2.18 C ATOM 2575 CD ARG A 180 7.975 2.587 12.291 1.00 2.53 C ATOM 2576 NE ARG A 180 9.130 2.291 13.184 1.00 3.00 N ATOM 2577 CZ ARG A 180 9.049 2.539 14.463 1.00 2.87 C ATOM 2578 NH1 ARG A 180 9.084 3.771 14.892 1.00 2.15 N ATOM 2579 NH2 ARG A 180 8.936 1.555 15.312 1.00 3.80 N ATOM 0 H ARG A 180 8.525 4.853 9.088 1.00 0.25 H new ATOM 0 HA ARG A 180 10.807 5.780 10.528 1.00 0.22 H new ATOM 0 HB2 ARG A 180 9.854 4.312 12.345 1.00 0.40 H new ATOM 0 HB3 ARG A 180 8.654 5.365 11.621 1.00 0.40 H new ATOM 0 HG2 ARG A 180 7.629 3.601 10.415 1.00 2.18 H new ATOM 0 HG3 ARG A 180 9.074 2.610 10.431 1.00 2.18 H new ATOM 0 HD2 ARG A 180 7.251 3.215 12.811 1.00 2.53 H new ATOM 0 HD3 ARG A 180 7.462 1.663 12.024 1.00 2.53 H new ATOM 0 HE ARG A 180 9.985 1.894 12.795 1.00 3.00 H new ATOM 0 HH11 ARG A 180 9.175 4.540 14.228 1.00 2.15 H new ATOM 0 HH12 ARG A 180 9.021 3.965 15.891 1.00 2.15 H new ATOM 0 HH21 ARG A 180 8.911 0.592 14.976 1.00 3.80 H new ATOM 0 HH22 ARG A 180 8.873 1.748 16.311 1.00 3.80 H new ATOM 2593 N ALA A 181 11.145 2.869 9.179 1.00 0.16 N ATOM 2594 CA ALA A 181 12.121 1.760 8.999 1.00 0.26 C ATOM 2595 C ALA A 181 13.350 2.305 8.276 1.00 0.28 C ATOM 2596 O ALA A 181 14.468 1.904 8.534 1.00 0.44 O ATOM 2597 CB ALA A 181 11.487 0.645 8.164 1.00 0.32 C ATOM 0 H ALA A 181 10.382 2.893 8.502 1.00 0.16 H new ATOM 0 HA ALA A 181 12.407 1.356 9.970 1.00 0.26 H new ATOM 0 HB1 ALA A 181 12.204 -0.165 8.034 1.00 0.32 H new ATOM 0 HB2 ALA A 181 10.601 0.267 8.674 1.00 0.32 H new ATOM 0 HB3 ALA A 181 11.203 1.038 7.188 1.00 0.32 H new ATOM 2603 N LEU A 182 13.146 3.225 7.375 1.00 0.23 N ATOM 2604 CA LEU A 182 14.296 3.807 6.634 1.00 0.41 C ATOM 2605 C LEU A 182 15.059 4.768 7.547 1.00 0.46 C ATOM 2606 O LEU A 182 16.223 5.044 7.339 1.00 0.44 O ATOM 2607 CB LEU A 182 13.777 4.566 5.411 1.00 0.46 C ATOM 2608 CG LEU A 182 14.449 4.025 4.148 1.00 0.91 C ATOM 2609 CD1 LEU A 182 14.149 2.532 4.009 1.00 1.63 C ATOM 2610 CD2 LEU A 182 13.905 4.768 2.927 1.00 0.38 C ATOM 0 H LEU A 182 12.231 3.598 7.121 1.00 0.23 H new ATOM 0 HA LEU A 182 14.965 3.009 6.312 1.00 0.41 H new ATOM 0 HB2 LEU A 182 12.695 4.457 5.335 1.00 0.46 H new ATOM 0 HB3 LEU A 182 13.983 5.631 5.517 1.00 0.46 H new ATOM 0 HG LEU A 182 15.527 4.174 4.217 1.00 0.91 H new ATOM 0 HD11 LEU A 182 14.628 2.147 3.109 1.00 1.63 H new ATOM 0 HD12 LEU A 182 14.533 2.001 4.880 1.00 1.63 H new ATOM 0 HD13 LEU A 182 13.072 2.382 3.939 1.00 1.63 H new ATOM 0 HD21 LEU A 182 14.382 4.384 2.025 1.00 0.38 H new ATOM 0 HD22 LEU A 182 12.828 4.617 2.860 1.00 0.38 H new ATOM 0 HD23 LEU A 182 14.117 5.833 3.025 1.00 0.38 H new ATOM 2622 N ARG A 183 14.411 5.283 8.557 1.00 0.53 N ATOM 2623 CA ARG A 183 15.099 6.228 9.481 1.00 0.58 C ATOM 2624 C ARG A 183 15.795 5.445 10.595 1.00 0.62 C ATOM 2625 O ARG A 183 16.784 5.884 11.149 1.00 0.71 O ATOM 2626 CB ARG A 183 14.070 7.179 10.097 1.00 0.48 C ATOM 2627 CG ARG A 183 14.737 8.523 10.398 1.00 0.81 C ATOM 2628 CD ARG A 183 14.971 9.283 9.092 1.00 1.68 C ATOM 2629 NE ARG A 183 15.295 10.707 9.396 1.00 1.97 N ATOM 2630 CZ ARG A 183 16.023 11.404 8.567 1.00 3.38 C ATOM 2631 NH1 ARG A 183 16.030 11.109 7.295 1.00 4.58 N ATOM 2632 NH2 ARG A 183 16.746 12.397 9.011 1.00 3.91 N ATOM 0 H ARG A 183 13.435 5.090 8.782 1.00 0.53 H new ATOM 0 HA ARG A 183 15.840 6.801 8.923 1.00 0.58 H new ATOM 0 HB2 ARG A 183 13.234 7.321 9.412 1.00 0.48 H new ATOM 0 HB3 ARG A 183 13.663 6.749 11.012 1.00 0.48 H new ATOM 0 HG2 ARG A 183 14.107 9.112 11.065 1.00 0.81 H new ATOM 0 HG3 ARG A 183 15.685 8.363 10.912 1.00 0.81 H new ATOM 0 HD2 ARG A 183 15.787 8.825 8.533 1.00 1.68 H new ATOM 0 HD3 ARG A 183 14.083 9.227 8.462 1.00 1.68 H new ATOM 0 HE ARG A 183 14.947 11.137 10.253 1.00 1.97 H new ATOM 0 HH11 ARG A 183 15.466 10.333 6.948 1.00 4.58 H new ATOM 0 HH12 ARG A 183 16.599 11.655 6.648 1.00 4.58 H new ATOM 0 HH21 ARG A 183 16.741 12.627 10.005 1.00 3.91 H new ATOM 0 HH22 ARG A 183 17.315 12.942 8.364 1.00 3.91 H new ATOM 2646 N GLN A 184 15.291 4.288 10.929 1.00 0.58 N ATOM 2647 CA GLN A 184 15.931 3.485 12.008 1.00 0.67 C ATOM 2648 C GLN A 184 17.140 2.746 11.436 1.00 0.79 C ATOM 2649 O GLN A 184 18.082 2.437 12.140 1.00 0.84 O ATOM 2650 CB GLN A 184 14.927 2.471 12.559 1.00 0.64 C ATOM 2651 CG GLN A 184 13.814 3.209 13.307 1.00 0.90 C ATOM 2652 CD GLN A 184 14.066 3.123 14.814 1.00 1.09 C ATOM 2653 OE1 GLN A 184 13.240 2.624 15.553 1.00 2.33 O ATOM 2654 NE2 GLN A 184 15.180 3.591 15.306 1.00 0.54 N ATOM 0 H GLN A 184 14.466 3.866 10.502 1.00 0.58 H new ATOM 0 HA GLN A 184 16.252 4.147 12.812 1.00 0.67 H new ATOM 0 HB2 GLN A 184 14.504 1.883 11.745 1.00 0.64 H new ATOM 0 HB3 GLN A 184 15.429 1.773 13.229 1.00 0.64 H new ATOM 0 HG2 GLN A 184 13.780 4.252 12.992 1.00 0.90 H new ATOM 0 HG3 GLN A 184 12.846 2.771 13.064 1.00 0.90 H new ATOM 0 HE21 GLN A 184 15.874 4.010 14.687 1.00 0.54 H new ATOM 0 HE22 GLN A 184 15.357 3.538 16.309 1.00 0.54 H new ATOM 2663 N MET A 185 17.123 2.458 10.163 1.00 0.83 N ATOM 2664 CA MET A 185 18.272 1.739 9.548 1.00 0.95 C ATOM 2665 C MET A 185 19.566 2.508 9.829 1.00 1.40 C ATOM 2666 O MET A 185 19.477 3.683 10.145 1.00 1.54 O ATOM 2667 CB MET A 185 18.061 1.631 8.037 1.00 0.51 C ATOM 2668 CG MET A 185 17.069 0.504 7.738 1.00 0.61 C ATOM 2669 SD MET A 185 16.470 0.665 6.038 1.00 0.19 S ATOM 2670 CE MET A 185 14.817 -0.019 6.312 1.00 0.34 C ATOM 2671 OXT MET A 185 20.623 1.908 9.720 1.00 2.07 O ATOM 0 H MET A 185 16.363 2.690 9.524 1.00 0.83 H new ATOM 0 HA MET A 185 18.343 0.739 9.976 1.00 0.95 H new ATOM 0 HB2 MET A 185 17.684 2.575 7.644 1.00 0.51 H new ATOM 0 HB3 MET A 185 19.011 1.435 7.540 1.00 0.51 H new ATOM 0 HG2 MET A 185 17.550 -0.464 7.876 1.00 0.61 H new ATOM 0 HG3 MET A 185 16.232 0.546 8.435 1.00 0.61 H new ATOM 0 HE1 MET A 185 14.619 -0.798 5.576 1.00 0.34 H new ATOM 0 HE2 MET A 185 14.760 -0.443 7.314 1.00 0.34 H new ATOM 0 HE3 MET A 185 14.074 0.772 6.211 1.00 0.34 H new