USER MOD reduce.3.24.130724 H: found=0, std=0, add=1072, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1070 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 79 TYR OH : rot -115:sc= 0.157 USER MOD Set 1.2: B 133 HIS : no HD1:sc= 1.05 K(o=1.2,f=-2.9!) USER MOD Set 2.1: A 57 CYS SG : rot 9:sc= 2.15 USER MOD Set 2.2: A 68 CYS SG : rot -93:sc= 0.765 USER MOD Set 3.1: A 30 GLN : amide:sc= 0.828 K(o=-2.1,f=-5.2) USER MOD Set 3.2: A 38 HIS : no HE2:sc= -2.9! C(o=-2.1!,f=-8.5!) USER MOD Single : A 1 TYR N :NH3+ 161:sc= 0.238 (180deg=0.103) USER MOD Single : A 1 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0.0358 USER MOD Single : A 8 CYS SG : rot 180:sc= -0.392 USER MOD Single : A 9 MET CE :methyl 160:sc= 0 (180deg=-0.381) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 SER OG : rot -106:sc= 1.27 USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 150:sc= -0.421 USER MOD Single : A 24 MET CE :methyl 159:sc= -0.0443 (180deg=-0.32) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot -44:sc= -2.52! USER MOD Single : A 34 SER OG : rot 180:sc= -1.23 USER MOD Single : A 35 GLN : amide:sc= -1.14! X(o=-1.1!,f=-0.71) USER MOD Single : A 36 SER OG : rot 180:sc= 0.117 USER MOD Single : A 40 HIS : no HD1:sc= -0.0491 X(o=-0.049,f=-0.2) USER MOD Single : A 42 TYR OH : rot 30:sc= -0.512 USER MOD Single : A 45 SER OG : rot 180:sc= 0.0948 USER MOD Single : A 46 LYS NZ :NH3+ 171:sc= 2.38 (180deg=2.25) USER MOD Single : A 49 ASN : amide:sc= 0.0922 K(o=0.092,f=-4.9!) USER MOD Single : A 50 LYS NZ :NH3+ -166:sc= 1.29 (180deg=1.17) USER MOD Single : A 51 ASN : amide:sc= -0.0559 K(o=-0.056,f=-1.1) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= 0.421 K(o=0.42,f=-3.7!) USER MOD Single : A 56 TYR OH : rot 180:sc= -0.77 USER MOD Single : A 59 ASN : amide:sc= 0.0887 K(o=0.089,f=-8.7!) USER MOD Single : A 70 THR OG1 : rot 77:sc= 1.34 USER MOD Single : A 71 THR OG1 : rot 180:sc=-0.00938 USER MOD Single : A 74 ASN : amide:sc= -0.0965 X(o=-0.097,f=-0.23) USER MOD Single : A 75 LYS NZ :NH3+ 130:sc= 1.26 (180deg=0.623) USER MOD Single : A 80 CYS SG : rot 100:sc= 0.444 USER MOD Single : A 85 CYS SG : rot 57:sc= -1.51 USER MOD Single : B 102 SER OG : rot 180:sc= 0.118 USER MOD Single : B 105 LYS NZ :NH3+ -141:sc= 1.29 (180deg=1) USER MOD Single : B 107 THR OG1 : rot -62:sc= 1.35 USER MOD Single : B 113 GLN : amide:sc= 0.235 K(o=0.23,f=-3!) USER MOD Single : B 116 LYS NZ :NH3+ -166:sc= 1.21 (180deg=0.884) USER MOD Single : B 117 ASN : amide:sc= -1.88 K(o=-1.9,f=-2.4!) USER MOD Single : B 129 LYS NZ :NH3+ -167:sc= 1.33 (180deg=0.706!) USER MOD Single : B 130 SER OG : rot -62:sc= 0.105 USER MOD Single : B 135 HIS : no HD1:sc= -0.625 X(o=-0.62,f=-0.23) USER MOD Single : B 137 LYS NZ :NH3+ -176:sc= 1.27 (180deg=1.2) USER MOD Single : B 138 LYS NZ :NH3+ -165:sc=-0.00604 (180deg=-0.124) USER MOD Single : B 143 LYS NZ :NH3+ -153:sc= 3.4 (180deg=3.02) USER MOD Single : B 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 152 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 1 -23.930 6.599 -12.352 1.00 15.00 N ATOM 2 CA TYR A 1 -25.346 6.686 -12.778 1.00 15.00 C ATOM 3 C TYR A 1 -26.002 7.924 -12.190 1.00 15.00 C ATOM 4 O TYR A 1 -26.582 8.738 -12.910 1.00 15.00 O ATOM 5 CB TYR A 1 -26.120 5.436 -12.343 1.00 15.00 C ATOM 6 CG TYR A 1 -25.464 4.138 -12.754 1.00 15.00 C ATOM 7 CD1 TYR A 1 -25.423 3.753 -14.086 1.00 15.00 C ATOM 8 CD2 TYR A 1 -24.888 3.299 -11.810 1.00 15.00 C ATOM 9 CE1 TYR A 1 -24.825 2.569 -14.467 1.00 15.00 C ATOM 10 CE2 TYR A 1 -24.287 2.113 -12.183 1.00 15.00 C ATOM 11 CZ TYR A 1 -24.259 1.753 -13.512 1.00 15.00 C ATOM 12 OH TYR A 1 -23.660 0.572 -13.888 1.00 15.00 O ATOM 0 H1 TYR A 1 -23.589 5.625 -12.478 1.00 15.00 H new ATOM 0 H2 TYR A 1 -23.354 7.245 -12.929 1.00 15.00 H new ATOM 0 H3 TYR A 1 -23.852 6.867 -11.350 1.00 15.00 H new ATOM 0 HA TYR A 1 -25.368 6.753 -13.866 1.00 15.00 H new ATOM 0 HB2 TYR A 1 -26.232 5.448 -11.259 1.00 15.00 H new ATOM 0 HB3 TYR A 1 -27.123 5.475 -12.767 1.00 15.00 H new ATOM 0 HD1 TYR A 1 -25.866 4.390 -14.837 1.00 15.00 H new ATOM 0 HD2 TYR A 1 -24.910 3.578 -10.767 1.00 15.00 H new ATOM 0 HE1 TYR A 1 -24.801 2.284 -15.508 1.00 15.00 H new ATOM 0 HE2 TYR A 1 -23.842 1.472 -11.437 1.00 15.00 H new ATOM 0 HH TYR A 1 -23.310 0.116 -13.095 1.00 15.00 H new ATOM 24 N VAL A 2 -25.912 8.058 -10.873 1.00 15.00 N ATOM 25 CA VAL A 2 -26.483 9.195 -10.166 1.00 15.00 C ATOM 26 C VAL A 2 -25.511 9.691 -9.105 1.00 15.00 C ATOM 27 O VAL A 2 -24.483 9.063 -8.856 1.00 15.00 O ATOM 28 CB VAL A 2 -27.824 8.840 -9.484 1.00 15.00 C ATOM 29 CG1 VAL A 2 -28.937 8.687 -10.508 1.00 15.00 C ATOM 30 CG2 VAL A 2 -27.689 7.572 -8.655 1.00 15.00 C ATOM 0 H VAL A 2 -25.443 7.384 -10.268 1.00 15.00 H new ATOM 0 HA VAL A 2 -26.669 9.973 -10.907 1.00 15.00 H new ATOM 0 HB VAL A 2 -28.086 9.663 -8.819 1.00 15.00 H new ATOM 0 HG11 VAL A 2 -29.868 8.437 -9.999 1.00 15.00 H new ATOM 0 HG12 VAL A 2 -29.061 9.623 -11.053 1.00 15.00 H new ATOM 0 HG13 VAL A 2 -28.681 7.891 -11.207 1.00 15.00 H new ATOM 0 HG21 VAL A 2 -28.645 7.341 -8.184 1.00 15.00 H new ATOM 0 HG22 VAL A 2 -27.394 6.745 -9.301 1.00 15.00 H new ATOM 0 HG23 VAL A 2 -26.932 7.720 -7.885 1.00 15.00 H new ATOM 40 N GLU A 3 -25.831 10.815 -8.486 1.00 15.00 N ATOM 41 CA GLU A 3 -24.983 11.377 -7.447 1.00 15.00 C ATOM 42 C GLU A 3 -25.305 10.744 -6.095 1.00 15.00 C ATOM 43 O GLU A 3 -24.425 10.575 -5.249 1.00 15.00 O ATOM 44 CB GLU A 3 -25.176 12.894 -7.367 1.00 15.00 C ATOM 45 CG GLU A 3 -24.129 13.598 -6.518 1.00 15.00 C ATOM 46 CD GLU A 3 -22.818 13.792 -7.252 1.00 15.00 C ATOM 47 OE1 GLU A 3 -22.595 14.900 -7.792 1.00 15.00 O ATOM 48 OE2 GLU A 3 -22.007 12.846 -7.289 1.00 15.00 O1- ATOM 0 H GLU A 3 -26.672 11.357 -8.685 1.00 15.00 H new ATOM 0 HA GLU A 3 -23.944 11.163 -7.699 1.00 15.00 H new ATOM 0 HB2 GLU A 3 -25.153 13.308 -8.375 1.00 15.00 H new ATOM 0 HB3 GLU A 3 -26.164 13.105 -6.959 1.00 15.00 H new ATOM 0 HG2 GLU A 3 -24.513 14.569 -6.205 1.00 15.00 H new ATOM 0 HG3 GLU A 3 -23.952 13.018 -5.612 1.00 15.00 H new ATOM 55 N PHE A 4 -26.570 10.382 -5.910 1.00 15.00 N ATOM 56 CA PHE A 4 -27.029 9.784 -4.663 1.00 15.00 C ATOM 57 C PHE A 4 -26.699 8.295 -4.604 1.00 15.00 C ATOM 58 O PHE A 4 -27.525 7.446 -4.948 1.00 15.00 O ATOM 59 CB PHE A 4 -28.536 10.001 -4.497 1.00 15.00 C ATOM 60 CG PHE A 4 -28.911 11.435 -4.246 1.00 15.00 C ATOM 61 CD1 PHE A 4 -29.119 11.894 -2.954 1.00 15.00 C ATOM 62 CD2 PHE A 4 -29.058 12.324 -5.299 1.00 15.00 C ATOM 63 CE1 PHE A 4 -29.459 13.211 -2.718 1.00 15.00 C ATOM 64 CE2 PHE A 4 -29.399 13.643 -5.069 1.00 15.00 C ATOM 65 CZ PHE A 4 -29.601 14.086 -3.777 1.00 15.00 C ATOM 0 H PHE A 4 -27.300 10.494 -6.614 1.00 15.00 H new ATOM 0 HA PHE A 4 -26.505 10.274 -3.843 1.00 15.00 H new ATOM 0 HB2 PHE A 4 -29.046 9.652 -5.395 1.00 15.00 H new ATOM 0 HB3 PHE A 4 -28.894 9.390 -3.669 1.00 15.00 H new ATOM 0 HD1 PHE A 4 -29.014 11.213 -2.122 1.00 15.00 H new ATOM 0 HD2 PHE A 4 -28.904 11.982 -6.312 1.00 15.00 H new ATOM 0 HE1 PHE A 4 -29.614 13.557 -1.707 1.00 15.00 H new ATOM 0 HE2 PHE A 4 -29.507 14.326 -5.898 1.00 15.00 H new ATOM 0 HZ PHE A 4 -29.870 15.116 -3.595 1.00 15.00 H new ATOM 75 N SER A 5 -25.483 7.987 -4.187 1.00 15.00 N ATOM 76 CA SER A 5 -25.042 6.608 -4.069 1.00 15.00 C ATOM 77 C SER A 5 -25.105 6.151 -2.616 1.00 15.00 C ATOM 78 O SER A 5 -24.614 6.836 -1.717 1.00 15.00 O ATOM 79 CB SER A 5 -23.617 6.467 -4.599 1.00 15.00 C ATOM 80 OG SER A 5 -23.045 7.739 -4.872 1.00 15.00 O ATOM 0 H SER A 5 -24.780 8.678 -3.923 1.00 15.00 H new ATOM 0 HA SER A 5 -25.706 5.979 -4.661 1.00 15.00 H new ATOM 0 HB2 SER A 5 -23.005 5.939 -3.868 1.00 15.00 H new ATOM 0 HB3 SER A 5 -23.621 5.864 -5.507 1.00 15.00 H new ATOM 0 HG SER A 5 -22.132 7.622 -5.209 1.00 15.00 H new ATOM 86 N GLU A 6 -25.715 5.001 -2.386 1.00 15.00 N ATOM 87 CA GLU A 6 -25.833 4.460 -1.040 1.00 15.00 C ATOM 88 C GLU A 6 -25.379 3.003 -1.014 1.00 15.00 C ATOM 89 O GLU A 6 -25.841 2.188 -1.815 1.00 15.00 O ATOM 90 CB GLU A 6 -27.276 4.574 -0.547 1.00 15.00 C ATOM 91 CG GLU A 6 -27.426 4.363 0.951 1.00 15.00 C ATOM 92 CD GLU A 6 -26.578 5.318 1.766 1.00 15.00 C ATOM 93 OE1 GLU A 6 -25.396 5.004 2.019 1.00 15.00 O ATOM 94 OE2 GLU A 6 -27.089 6.387 2.160 1.00 15.00 O1- ATOM 0 H GLU A 6 -26.137 4.423 -3.113 1.00 15.00 H new ATOM 0 HA GLU A 6 -25.191 5.038 -0.375 1.00 15.00 H new ATOM 0 HB2 GLU A 6 -27.663 5.559 -0.807 1.00 15.00 H new ATOM 0 HB3 GLU A 6 -27.889 3.842 -1.072 1.00 15.00 H new ATOM 0 HG2 GLU A 6 -28.473 4.487 1.228 1.00 15.00 H new ATOM 0 HG3 GLU A 6 -27.150 3.338 1.198 1.00 15.00 H new ATOM 101 N GLU A 7 -24.472 2.685 -0.098 1.00 15.00 N ATOM 102 CA GLU A 7 -23.946 1.334 0.035 1.00 15.00 C ATOM 103 C GLU A 7 -23.258 1.159 1.384 1.00 15.00 C ATOM 104 O GLU A 7 -22.906 2.141 2.042 1.00 15.00 O ATOM 105 CB GLU A 7 -22.971 1.022 -1.107 1.00 15.00 C ATOM 106 CG GLU A 7 -21.873 2.061 -1.288 1.00 15.00 C ATOM 107 CD GLU A 7 -21.139 1.914 -2.604 1.00 15.00 C ATOM 108 OE1 GLU A 7 -20.731 2.945 -3.180 1.00 15.00 O ATOM 109 OE2 GLU A 7 -20.975 0.769 -3.078 1.00 15.00 O1- ATOM 0 H GLU A 7 -24.083 3.352 0.569 1.00 15.00 H new ATOM 0 HA GLU A 7 -24.779 0.634 -0.021 1.00 15.00 H new ATOM 0 HB2 GLU A 7 -22.511 0.051 -0.923 1.00 15.00 H new ATOM 0 HB3 GLU A 7 -23.533 0.937 -2.037 1.00 15.00 H new ATOM 0 HG2 GLU A 7 -22.309 3.058 -1.230 1.00 15.00 H new ATOM 0 HG3 GLU A 7 -21.160 1.976 -0.468 1.00 15.00 H new ATOM 116 N CYS A 8 -23.083 -0.089 1.798 1.00 15.00 N ATOM 117 CA CYS A 8 -22.443 -0.396 3.071 1.00 15.00 C ATOM 118 C CYS A 8 -21.587 -1.656 2.948 1.00 15.00 C ATOM 119 O CYS A 8 -22.024 -2.660 2.376 1.00 15.00 O ATOM 120 CB CYS A 8 -23.503 -0.589 4.163 1.00 15.00 C ATOM 121 SG CYS A 8 -24.663 0.791 4.342 1.00 15.00 S ATOM 0 H CYS A 8 -23.377 -0.909 1.268 1.00 15.00 H new ATOM 0 HA CYS A 8 -21.799 0.440 3.344 1.00 15.00 H new ATOM 0 HB2 CYS A 8 -24.068 -1.495 3.946 1.00 15.00 H new ATOM 0 HB3 CYS A 8 -22.999 -0.748 5.116 1.00 15.00 H new ATOM 0 HG CYS A 8 -25.514 0.523 5.288 1.00 15.00 H new ATOM 127 N MET A 9 -20.376 -1.607 3.492 1.00 15.00 N ATOM 128 CA MET A 9 -19.464 -2.747 3.431 1.00 15.00 C ATOM 129 C MET A 9 -19.209 -3.323 4.819 1.00 15.00 C ATOM 130 O MET A 9 -19.422 -2.650 5.834 1.00 15.00 O ATOM 131 CB MET A 9 -18.143 -2.342 2.774 1.00 15.00 C ATOM 132 CG MET A 9 -18.298 -1.915 1.326 1.00 15.00 C ATOM 133 SD MET A 9 -18.890 -3.251 0.268 1.00 15.00 S ATOM 134 CE MET A 9 -19.419 -2.317 -1.163 1.00 15.00 C ATOM 0 H MET A 9 -20.002 -0.793 3.980 1.00 15.00 H new ATOM 0 HA MET A 9 -19.935 -3.520 2.825 1.00 15.00 H new ATOM 0 HB2 MET A 9 -17.699 -1.524 3.341 1.00 15.00 H new ATOM 0 HB3 MET A 9 -17.448 -3.180 2.826 1.00 15.00 H new ATOM 0 HG2 MET A 9 -18.993 -1.077 1.271 1.00 15.00 H new ATOM 0 HG3 MET A 9 -17.339 -1.558 0.952 1.00 15.00 H new ATOM 0 HE1 MET A 9 -19.476 -2.978 -2.028 1.00 15.00 H new ATOM 0 HE2 MET A 9 -20.401 -1.884 -0.972 1.00 15.00 H new ATOM 0 HE3 MET A 9 -18.703 -1.519 -1.362 1.00 15.00 H new ATOM 144 N HIS A 10 -18.743 -4.567 4.849 1.00 15.00 N ATOM 145 CA HIS A 10 -18.481 -5.265 6.106 1.00 15.00 C ATOM 146 C HIS A 10 -17.128 -4.878 6.706 1.00 15.00 C ATOM 147 O HIS A 10 -16.090 -5.429 6.335 1.00 15.00 O ATOM 148 CB HIS A 10 -18.558 -6.783 5.883 1.00 15.00 C ATOM 149 CG HIS A 10 -18.154 -7.608 7.070 1.00 15.00 C ATOM 150 ND1 HIS A 10 -18.676 -7.383 8.323 1.00 15.00 N ATOM 151 CD2 HIS A 10 -17.268 -8.629 7.137 1.00 15.00 C ATOM 152 CE1 HIS A 10 -18.101 -8.270 9.118 1.00 15.00 C ATOM 153 NE2 HIS A 10 -17.246 -9.045 8.442 1.00 15.00 N ATOM 0 H HIS A 10 -18.538 -5.116 4.014 1.00 15.00 H new ATOM 0 HA HIS A 10 -19.246 -4.964 6.822 1.00 15.00 H new ATOM 0 HB2 HIS A 10 -19.579 -7.045 5.605 1.00 15.00 H new ATOM 0 HB3 HIS A 10 -17.920 -7.046 5.039 1.00 15.00 H new ATOM 0 HD2 HIS A 10 -16.691 -9.037 6.320 1.00 15.00 H new ATOM 0 HE1 HIS A 10 -18.297 -8.357 10.177 1.00 15.00 H new ATOM 0 HE2 HIS A 10 -16.683 -9.804 8.826 1.00 15.00 H new ATOM 161 N GLY A 11 -17.175 -3.931 7.641 1.00 15.00 N ATOM 162 CA GLY A 11 -15.993 -3.461 8.349 1.00 15.00 C ATOM 163 C GLY A 11 -14.778 -3.217 7.473 1.00 15.00 C ATOM 164 O GLY A 11 -14.747 -2.271 6.685 1.00 15.00 O ATOM 0 H GLY A 11 -18.038 -3.469 7.927 1.00 15.00 H new ATOM 0 HA2 GLY A 11 -16.242 -2.534 8.866 1.00 15.00 H new ATOM 0 HA3 GLY A 11 -15.731 -4.192 9.114 1.00 15.00 H new ATOM 168 N SER A 12 -13.781 -4.081 7.621 1.00 15.00 N ATOM 169 CA SER A 12 -12.530 -3.976 6.879 1.00 15.00 C ATOM 170 C SER A 12 -12.709 -4.266 5.395 1.00 15.00 C ATOM 171 O SER A 12 -11.945 -3.770 4.569 1.00 15.00 O ATOM 172 CB SER A 12 -11.510 -4.947 7.468 1.00 15.00 C ATOM 173 OG SER A 12 -11.144 -4.564 8.783 1.00 15.00 O ATOM 0 H SER A 12 -13.817 -4.875 8.260 1.00 15.00 H new ATOM 0 HA SER A 12 -12.179 -2.948 6.970 1.00 15.00 H new ATOM 0 HB2 SER A 12 -11.927 -5.954 7.482 1.00 15.00 H new ATOM 0 HB3 SER A 12 -10.624 -4.978 6.834 1.00 15.00 H new ATOM 0 HG SER A 12 -10.239 -4.187 8.774 1.00 15.00 H new ATOM 179 N GLY A 13 -13.718 -5.056 5.059 1.00 15.00 N ATOM 180 CA GLY A 13 -13.954 -5.398 3.671 1.00 15.00 C ATOM 181 C GLY A 13 -12.774 -6.134 3.067 1.00 15.00 C ATOM 182 O GLY A 13 -12.259 -5.748 2.021 1.00 15.00 O ATOM 0 H GLY A 13 -14.377 -5.466 5.721 1.00 15.00 H new ATOM 0 HA2 GLY A 13 -14.847 -6.018 3.596 1.00 15.00 H new ATOM 0 HA3 GLY A 13 -14.148 -4.490 3.100 1.00 15.00 H new ATOM 186 N GLU A 14 -12.344 -7.203 3.727 1.00 15.00 N ATOM 187 CA GLU A 14 -11.208 -7.984 3.254 1.00 15.00 C ATOM 188 C GLU A 14 -11.545 -8.708 1.953 1.00 15.00 C ATOM 189 O GLU A 14 -10.657 -9.154 1.226 1.00 15.00 O ATOM 190 CB GLU A 14 -10.780 -8.993 4.318 1.00 15.00 C ATOM 191 CG GLU A 14 -9.414 -9.609 4.065 1.00 15.00 C ATOM 192 CD GLU A 14 -9.319 -11.040 4.560 1.00 15.00 C ATOM 193 OE1 GLU A 14 -8.709 -11.879 3.858 1.00 15.00 O ATOM 194 OE2 GLU A 14 -9.862 -11.337 5.646 1.00 15.00 O1- ATOM 0 H GLU A 14 -12.764 -7.548 4.590 1.00 15.00 H new ATOM 0 HA GLU A 14 -10.383 -7.298 3.061 1.00 15.00 H new ATOM 0 HB2 GLU A 14 -10.772 -8.500 5.290 1.00 15.00 H new ATOM 0 HB3 GLU A 14 -11.523 -9.789 4.370 1.00 15.00 H new ATOM 0 HG2 GLU A 14 -9.200 -9.583 2.997 1.00 15.00 H new ATOM 0 HG3 GLU A 14 -8.651 -9.007 4.558 1.00 15.00 H new ATOM 201 N ASN A 15 -12.831 -8.821 1.665 1.00 15.00 N ATOM 202 CA ASN A 15 -13.283 -9.479 0.449 1.00 15.00 C ATOM 203 C ASN A 15 -13.844 -8.444 -0.519 1.00 15.00 C ATOM 204 O ASN A 15 -14.668 -8.754 -1.380 1.00 15.00 O ATOM 205 CB ASN A 15 -14.340 -10.538 0.774 1.00 15.00 C ATOM 206 CG ASN A 15 -14.338 -11.694 -0.210 1.00 15.00 C ATOM 207 OD1 ASN A 15 -13.971 -11.541 -1.374 1.00 15.00 O ATOM 208 ND2 ASN A 15 -14.756 -12.863 0.252 1.00 15.00 N ATOM 0 H ASN A 15 -13.582 -8.465 2.257 1.00 15.00 H new ATOM 0 HA ASN A 15 -12.435 -9.978 -0.020 1.00 15.00 H new ATOM 0 HB2 ASN A 15 -14.165 -10.922 1.779 1.00 15.00 H new ATOM 0 HB3 ASN A 15 -15.325 -10.072 0.778 1.00 15.00 H new ATOM 0 HD21 ASN A 15 -14.781 -13.675 -0.364 1.00 15.00 H new ATOM 0 HD22 ASN A 15 -15.053 -12.951 1.224 1.00 15.00 H new ATOM 215 N TYR A 16 -13.394 -7.204 -0.363 1.00 15.00 N ATOM 216 CA TYR A 16 -13.837 -6.114 -1.223 1.00 15.00 C ATOM 217 C TYR A 16 -13.283 -6.299 -2.630 1.00 15.00 C ATOM 218 O TYR A 16 -12.085 -6.134 -2.867 1.00 15.00 O ATOM 219 CB TYR A 16 -13.393 -4.759 -0.657 1.00 15.00 C ATOM 220 CG TYR A 16 -13.877 -3.569 -1.453 1.00 15.00 C ATOM 221 CD1 TYR A 16 -15.212 -3.191 -1.425 1.00 15.00 C ATOM 222 CD2 TYR A 16 -13.000 -2.826 -2.236 1.00 15.00 C ATOM 223 CE1 TYR A 16 -15.660 -2.104 -2.150 1.00 15.00 C ATOM 224 CE2 TYR A 16 -13.441 -1.736 -2.963 1.00 15.00 C ATOM 225 CZ TYR A 16 -14.772 -1.381 -2.919 1.00 15.00 C ATOM 226 OH TYR A 16 -15.217 -0.299 -3.645 1.00 15.00 O ATOM 0 H TYR A 16 -12.721 -6.929 0.353 1.00 15.00 H new ATOM 0 HA TYR A 16 -14.926 -6.130 -1.263 1.00 15.00 H new ATOM 0 HB2 TYR A 16 -13.755 -4.669 0.367 1.00 15.00 H new ATOM 0 HB3 TYR A 16 -12.304 -4.735 -0.613 1.00 15.00 H new ATOM 0 HD1 TYR A 16 -15.912 -3.756 -0.827 1.00 15.00 H new ATOM 0 HD2 TYR A 16 -11.957 -3.105 -2.277 1.00 15.00 H new ATOM 0 HE1 TYR A 16 -16.702 -1.821 -2.115 1.00 15.00 H new ATOM 0 HE2 TYR A 16 -12.746 -1.166 -3.562 1.00 15.00 H new ATOM 0 HH TYR A 16 -14.465 0.100 -4.131 1.00 15.00 H new ATOM 236 N ASP A 17 -14.158 -6.634 -3.563 1.00 15.00 N ATOM 237 CA ASP A 17 -13.754 -6.844 -4.940 1.00 15.00 C ATOM 238 C ASP A 17 -14.367 -5.774 -5.831 1.00 15.00 C ATOM 239 O ASP A 17 -14.688 -6.015 -6.994 1.00 15.00 O ATOM 240 CB ASP A 17 -14.174 -8.233 -5.418 1.00 15.00 C ATOM 241 CG ASP A 17 -13.352 -8.716 -6.596 1.00 15.00 C ATOM 242 OD1 ASP A 17 -13.704 -9.767 -7.176 1.00 15.00 O ATOM 243 OD2 ASP A 17 -12.349 -8.057 -6.945 1.00 15.00 O1- ATOM 0 H ASP A 17 -15.154 -6.766 -3.390 1.00 15.00 H new ATOM 0 HA ASP A 17 -12.668 -6.775 -4.998 1.00 15.00 H new ATOM 0 HB2 ASP A 17 -14.075 -8.942 -4.596 1.00 15.00 H new ATOM 0 HB3 ASP A 17 -15.227 -8.214 -5.698 1.00 15.00 H new ATOM 248 N GLY A 18 -14.530 -4.586 -5.267 1.00 15.00 N ATOM 249 CA GLY A 18 -15.095 -3.482 -6.013 1.00 15.00 C ATOM 250 C GLY A 18 -14.081 -2.861 -6.949 1.00 15.00 C ATOM 251 O GLY A 18 -12.892 -2.791 -6.624 1.00 15.00 O ATOM 0 H GLY A 18 -14.280 -4.367 -4.303 1.00 15.00 H new ATOM 0 HA2 GLY A 18 -15.953 -3.832 -6.587 1.00 15.00 H new ATOM 0 HA3 GLY A 18 -15.462 -2.725 -5.320 1.00 15.00 H new ATOM 255 N LYS A 19 -14.538 -2.426 -8.115 1.00 15.00 N ATOM 256 CA LYS A 19 -13.652 -1.821 -9.095 1.00 15.00 C ATOM 257 C LYS A 19 -13.366 -0.364 -8.748 1.00 15.00 C ATOM 258 O LYS A 19 -14.222 0.514 -8.900 1.00 15.00 O ATOM 259 CB LYS A 19 -14.247 -1.929 -10.501 1.00 15.00 C ATOM 260 CG LYS A 19 -13.623 -3.039 -11.330 1.00 15.00 C ATOM 261 CD LYS A 19 -14.275 -3.162 -12.696 1.00 15.00 C ATOM 262 CE LYS A 19 -13.539 -4.168 -13.566 1.00 15.00 C ATOM 263 NZ LYS A 19 -14.160 -4.316 -14.907 1.00 15.00 N1+ ATOM 0 H LYS A 19 -15.515 -2.481 -8.403 1.00 15.00 H new ATOM 0 HA LYS A 19 -12.708 -2.366 -9.076 1.00 15.00 H new ATOM 0 HB2 LYS A 19 -15.320 -2.102 -10.422 1.00 15.00 H new ATOM 0 HB3 LYS A 19 -14.115 -0.979 -11.019 1.00 15.00 H new ATOM 0 HG2 LYS A 19 -12.557 -2.845 -11.453 1.00 15.00 H new ATOM 0 HG3 LYS A 19 -13.715 -3.985 -10.797 1.00 15.00 H new ATOM 0 HD2 LYS A 19 -15.314 -3.469 -12.580 1.00 15.00 H new ATOM 0 HD3 LYS A 19 -14.283 -2.189 -13.187 1.00 15.00 H new ATOM 0 HE2 LYS A 19 -12.501 -3.854 -13.681 1.00 15.00 H new ATOM 0 HE3 LYS A 19 -13.526 -5.136 -13.066 1.00 15.00 H new ATOM 0 HZ1 LYS A 19 -13.623 -5.012 -15.463 1.00 15.00 H new ATOM 0 HZ2 LYS A 19 -15.142 -4.641 -14.801 1.00 15.00 H new ATOM 0 HZ3 LYS A 19 -14.150 -3.399 -15.397 1.00 15.00 H new ATOM 277 N ILE A 20 -12.158 -0.127 -8.261 1.00 15.00 N ATOM 278 CA ILE A 20 -11.718 1.206 -7.891 1.00 15.00 C ATOM 279 C ILE A 20 -10.194 1.260 -7.895 1.00 15.00 C ATOM 280 O ILE A 20 -9.530 0.374 -7.349 1.00 15.00 O ATOM 281 CB ILE A 20 -12.277 1.633 -6.509 1.00 15.00 C ATOM 282 CG1 ILE A 20 -11.791 3.035 -6.138 1.00 15.00 C ATOM 283 CG2 ILE A 20 -11.891 0.629 -5.428 1.00 15.00 C ATOM 284 CD1 ILE A 20 -12.536 3.648 -4.970 1.00 15.00 C ATOM 0 H ILE A 20 -11.457 -0.853 -8.112 1.00 15.00 H new ATOM 0 HA ILE A 20 -12.107 1.911 -8.626 1.00 15.00 H new ATOM 0 HB ILE A 20 -13.365 1.653 -6.579 1.00 15.00 H new ATOM 0 HG12 ILE A 20 -10.729 2.990 -5.897 1.00 15.00 H new ATOM 0 HG13 ILE A 20 -11.893 3.687 -7.005 1.00 15.00 H new ATOM 0 HG21 ILE A 20 -12.296 0.953 -4.469 1.00 15.00 H new ATOM 0 HG22 ILE A 20 -12.296 -0.351 -5.680 1.00 15.00 H new ATOM 0 HG23 ILE A 20 -10.805 0.566 -5.361 1.00 15.00 H new ATOM 0 HD11 ILE A 20 -12.137 4.641 -4.765 1.00 15.00 H new ATOM 0 HD12 ILE A 20 -13.595 3.726 -5.215 1.00 15.00 H new ATOM 0 HD13 ILE A 20 -12.413 3.018 -4.089 1.00 15.00 H new ATOM 296 N SER A 21 -9.645 2.278 -8.538 1.00 15.00 N ATOM 297 CA SER A 21 -8.200 2.435 -8.626 1.00 15.00 C ATOM 298 C SER A 21 -7.778 3.822 -8.154 1.00 15.00 C ATOM 299 O SER A 21 -6.812 4.397 -8.657 1.00 15.00 O ATOM 300 CB SER A 21 -7.733 2.199 -10.066 1.00 15.00 C ATOM 301 OG SER A 21 -8.829 1.933 -10.936 1.00 15.00 O ATOM 0 H SER A 21 -10.178 3.010 -9.008 1.00 15.00 H new ATOM 0 HA SER A 21 -7.731 1.696 -7.976 1.00 15.00 H new ATOM 0 HB2 SER A 21 -7.190 3.075 -10.421 1.00 15.00 H new ATOM 0 HB3 SER A 21 -7.037 1.361 -10.090 1.00 15.00 H new ATOM 0 HG SER A 21 -8.496 1.789 -11.847 1.00 15.00 H new ATOM 307 N LYS A 22 -8.509 4.355 -7.189 1.00 15.00 N ATOM 308 CA LYS A 22 -8.211 5.669 -6.645 1.00 15.00 C ATOM 309 C LYS A 22 -8.331 5.658 -5.130 1.00 15.00 C ATOM 310 O LYS A 22 -9.146 4.923 -4.566 1.00 15.00 O ATOM 311 CB LYS A 22 -9.140 6.736 -7.236 1.00 15.00 C ATOM 312 CG LYS A 22 -8.756 7.173 -8.645 1.00 15.00 C ATOM 313 CD LYS A 22 -9.444 8.471 -9.044 1.00 15.00 C ATOM 314 CE LYS A 22 -10.938 8.279 -9.246 1.00 15.00 C ATOM 315 NZ LYS A 22 -11.613 9.545 -9.641 1.00 15.00 N1+ ATOM 0 H LYS A 22 -9.315 3.896 -6.765 1.00 15.00 H new ATOM 0 HA LYS A 22 -7.185 5.917 -6.918 1.00 15.00 H new ATOM 0 HB2 LYS A 22 -10.159 6.350 -7.250 1.00 15.00 H new ATOM 0 HB3 LYS A 22 -9.139 7.608 -6.582 1.00 15.00 H new ATOM 0 HG2 LYS A 22 -7.675 7.302 -8.703 1.00 15.00 H new ATOM 0 HG3 LYS A 22 -9.022 6.389 -9.354 1.00 15.00 H new ATOM 0 HD2 LYS A 22 -9.275 9.224 -8.274 1.00 15.00 H new ATOM 0 HD3 LYS A 22 -8.999 8.851 -9.964 1.00 15.00 H new ATOM 0 HE2 LYS A 22 -11.106 7.523 -10.013 1.00 15.00 H new ATOM 0 HE3 LYS A 22 -11.383 7.903 -8.325 1.00 15.00 H new ATOM 0 HZ1 LYS A 22 -12.630 9.371 -9.769 1.00 15.00 H new ATOM 0 HZ2 LYS A 22 -11.475 10.259 -8.897 1.00 15.00 H new ATOM 0 HZ3 LYS A 22 -11.206 9.891 -10.533 1.00 15.00 H new ATOM 329 N THR A 23 -7.508 6.460 -4.476 1.00 15.00 N ATOM 330 CA THR A 23 -7.523 6.557 -3.028 1.00 15.00 C ATOM 331 C THR A 23 -8.510 7.628 -2.578 1.00 15.00 C ATOM 332 O THR A 23 -9.117 8.312 -3.408 1.00 15.00 O ATOM 333 CB THR A 23 -6.120 6.896 -2.490 1.00 15.00 C ATOM 334 OG1 THR A 23 -5.496 7.870 -3.339 1.00 15.00 O ATOM 335 CG2 THR A 23 -5.249 5.653 -2.421 1.00 15.00 C ATOM 0 H THR A 23 -6.817 7.057 -4.930 1.00 15.00 H new ATOM 0 HA THR A 23 -7.832 5.591 -2.629 1.00 15.00 H new ATOM 0 HB THR A 23 -6.229 7.300 -1.484 1.00 15.00 H new ATOM 0 HG1 THR A 23 -4.886 8.424 -2.808 1.00 15.00 H new ATOM 0 HG21 THR A 23 -4.264 5.920 -2.038 1.00 15.00 H new ATOM 0 HG22 THR A 23 -5.710 4.922 -1.757 1.00 15.00 H new ATOM 0 HG23 THR A 23 -5.147 5.225 -3.418 1.00 15.00 H new ATOM 343 N MET A 24 -8.659 7.793 -1.267 1.00 15.00 N ATOM 344 CA MET A 24 -9.573 8.796 -0.731 1.00 15.00 C ATOM 345 C MET A 24 -9.030 10.198 -0.993 1.00 15.00 C ATOM 346 O MET A 24 -9.760 11.184 -0.902 1.00 15.00 O ATOM 347 CB MET A 24 -9.804 8.584 0.771 1.00 15.00 C ATOM 348 CG MET A 24 -8.572 8.831 1.628 1.00 15.00 C ATOM 349 SD MET A 24 -8.566 10.465 2.401 1.00 15.00 S ATOM 350 CE MET A 24 -9.883 10.278 3.602 1.00 15.00 C ATOM 0 H MET A 24 -8.163 7.250 -0.561 1.00 15.00 H new ATOM 0 HA MET A 24 -10.532 8.689 -1.238 1.00 15.00 H new ATOM 0 HB2 MET A 24 -10.603 9.247 1.102 1.00 15.00 H new ATOM 0 HB3 MET A 24 -10.149 7.563 0.934 1.00 15.00 H new ATOM 0 HG2 MET A 24 -8.517 8.068 2.404 1.00 15.00 H new ATOM 0 HG3 MET A 24 -7.680 8.723 1.011 1.00 15.00 H new ATOM 0 HE1 MET A 24 -9.767 11.024 4.388 1.00 15.00 H new ATOM 0 HE2 MET A 24 -10.846 10.416 3.110 1.00 15.00 H new ATOM 0 HE3 MET A 24 -9.838 9.280 4.039 1.00 15.00 H new ATOM 360 N SER A 25 -7.750 10.274 -1.341 1.00 15.00 N ATOM 361 CA SER A 25 -7.100 11.542 -1.630 1.00 15.00 C ATOM 362 C SER A 25 -7.263 11.909 -3.107 1.00 15.00 C ATOM 363 O SER A 25 -6.737 12.921 -3.569 1.00 15.00 O ATOM 364 CB SER A 25 -5.620 11.452 -1.267 1.00 15.00 C ATOM 365 OG SER A 25 -5.455 10.973 0.059 1.00 15.00 O ATOM 0 H SER A 25 -7.139 9.462 -1.430 1.00 15.00 H new ATOM 0 HA SER A 25 -7.570 12.323 -1.033 1.00 15.00 H new ATOM 0 HB2 SER A 25 -5.109 10.788 -1.965 1.00 15.00 H new ATOM 0 HB3 SER A 25 -5.157 12.434 -1.364 1.00 15.00 H new ATOM 0 HG SER A 25 -4.500 10.921 0.272 1.00 15.00 H new ATOM 371 N GLY A 26 -7.985 11.065 -3.845 1.00 15.00 N ATOM 372 CA GLY A 26 -8.210 11.313 -5.256 1.00 15.00 C ATOM 373 C GLY A 26 -6.975 11.052 -6.098 1.00 15.00 C ATOM 374 O GLY A 26 -6.834 11.604 -7.191 1.00 15.00 O ATOM 0 H GLY A 26 -8.417 10.213 -3.487 1.00 15.00 H new ATOM 0 HA2 GLY A 26 -9.025 10.680 -5.607 1.00 15.00 H new ATOM 0 HA3 GLY A 26 -8.527 12.347 -5.393 1.00 15.00 H new ATOM 378 N LEU A 27 -6.082 10.211 -5.594 1.00 15.00 N ATOM 379 CA LEU A 27 -4.856 9.883 -6.310 1.00 15.00 C ATOM 380 C LEU A 27 -5.029 8.577 -7.076 1.00 15.00 C ATOM 381 O LEU A 27 -5.953 7.810 -6.800 1.00 15.00 O ATOM 382 CB LEU A 27 -3.679 9.778 -5.337 1.00 15.00 C ATOM 383 CG LEU A 27 -3.372 11.049 -4.539 1.00 15.00 C ATOM 384 CD1 LEU A 27 -2.270 10.788 -3.527 1.00 15.00 C ATOM 385 CD2 LEU A 27 -2.980 12.186 -5.471 1.00 15.00 C ATOM 0 H LEU A 27 -6.183 9.744 -4.693 1.00 15.00 H new ATOM 0 HA LEU A 27 -4.644 10.681 -7.021 1.00 15.00 H new ATOM 0 HB2 LEU A 27 -3.880 8.968 -4.635 1.00 15.00 H new ATOM 0 HB3 LEU A 27 -2.788 9.498 -5.899 1.00 15.00 H new ATOM 0 HG LEU A 27 -4.274 11.342 -4.001 1.00 15.00 H new ATOM 0 HD11 LEU A 27 -2.065 11.702 -2.969 1.00 15.00 H new ATOM 0 HD12 LEU A 27 -2.587 10.005 -2.838 1.00 15.00 H new ATOM 0 HD13 LEU A 27 -1.366 10.470 -4.047 1.00 15.00 H new ATOM 0 HD21 LEU A 27 -2.766 13.080 -4.885 1.00 15.00 H new ATOM 0 HD22 LEU A 27 -2.093 11.903 -6.038 1.00 15.00 H new ATOM 0 HD23 LEU A 27 -3.800 12.391 -6.159 1.00 15.00 H new ATOM 397 N GLU A 28 -4.141 8.327 -8.026 1.00 15.00 N ATOM 398 CA GLU A 28 -4.210 7.124 -8.844 1.00 15.00 C ATOM 399 C GLU A 28 -3.453 5.974 -8.193 1.00 15.00 C ATOM 400 O GLU A 28 -2.385 6.167 -7.604 1.00 15.00 O ATOM 401 CB GLU A 28 -3.632 7.392 -10.234 1.00 15.00 C ATOM 402 CG GLU A 28 -4.137 8.673 -10.881 1.00 15.00 C ATOM 403 CD GLU A 28 -3.508 8.914 -12.238 1.00 15.00 C ATOM 404 OE1 GLU A 28 -4.255 9.086 -13.224 1.00 15.00 O ATOM 405 OE2 GLU A 28 -2.259 8.914 -12.330 1.00 15.00 O1- ATOM 0 H GLU A 28 -3.360 8.944 -8.251 1.00 15.00 H new ATOM 0 HA GLU A 28 -5.259 6.844 -8.935 1.00 15.00 H new ATOM 0 HB2 GLU A 28 -2.545 7.439 -10.161 1.00 15.00 H new ATOM 0 HB3 GLU A 28 -3.872 6.550 -10.884 1.00 15.00 H new ATOM 0 HG2 GLU A 28 -5.220 8.621 -10.988 1.00 15.00 H new ATOM 0 HG3 GLU A 28 -3.921 9.518 -10.227 1.00 15.00 H new ATOM 412 N CYS A 29 -4.012 4.778 -8.303 1.00 15.00 N ATOM 413 CA CYS A 29 -3.396 3.590 -7.738 1.00 15.00 C ATOM 414 C CYS A 29 -2.490 2.913 -8.761 1.00 15.00 C ATOM 415 O CYS A 29 -2.810 2.844 -9.950 1.00 15.00 O ATOM 416 CB CYS A 29 -4.468 2.605 -7.257 1.00 15.00 C ATOM 417 SG CYS A 29 -3.809 1.062 -6.575 1.00 15.00 S ATOM 0 H CYS A 29 -4.896 4.606 -8.781 1.00 15.00 H new ATOM 0 HA CYS A 29 -2.791 3.897 -6.885 1.00 15.00 H new ATOM 0 HB2 CYS A 29 -5.079 3.093 -6.497 1.00 15.00 H new ATOM 0 HB3 CYS A 29 -5.127 2.367 -8.092 1.00 15.00 H new ATOM 0 HG CYS A 29 -2.857 0.620 -7.342 1.00 15.00 H new ATOM 423 N GLN A 30 -1.353 2.431 -8.286 1.00 15.00 N ATOM 424 CA GLN A 30 -0.392 1.744 -9.128 1.00 15.00 C ATOM 425 C GLN A 30 -0.761 0.267 -9.221 1.00 15.00 C ATOM 426 O GLN A 30 -1.318 -0.299 -8.277 1.00 15.00 O ATOM 427 CB GLN A 30 1.021 1.899 -8.552 1.00 15.00 C ATOM 428 CG GLN A 30 2.074 1.071 -9.279 1.00 15.00 C ATOM 429 CD GLN A 30 3.333 0.868 -8.463 1.00 15.00 C ATOM 430 OE1 GLN A 30 3.766 1.755 -7.735 1.00 15.00 O ATOM 431 NE2 GLN A 30 3.919 -0.314 -8.564 1.00 15.00 N ATOM 0 H GLN A 30 -1.072 2.506 -7.308 1.00 15.00 H new ATOM 0 HA GLN A 30 -0.411 2.183 -10.126 1.00 15.00 H new ATOM 0 HB2 GLN A 30 1.307 2.950 -8.592 1.00 15.00 H new ATOM 0 HB3 GLN A 30 1.008 1.612 -7.500 1.00 15.00 H new ATOM 0 HG2 GLN A 30 1.652 0.099 -9.534 1.00 15.00 H new ATOM 0 HG3 GLN A 30 2.331 1.563 -10.217 1.00 15.00 H new ATOM 0 HE21 GLN A 30 3.528 -1.026 -9.181 1.00 15.00 H new ATOM 0 HE22 GLN A 30 4.762 -0.513 -8.025 1.00 15.00 H new ATOM 440 N ALA A 31 -0.474 -0.347 -10.360 1.00 15.00 N ATOM 441 CA ALA A 31 -0.771 -1.756 -10.551 1.00 15.00 C ATOM 442 C ALA A 31 0.170 -2.608 -9.713 1.00 15.00 C ATOM 443 O ALA A 31 1.368 -2.326 -9.624 1.00 15.00 O ATOM 444 CB ALA A 31 -0.673 -2.130 -12.020 1.00 15.00 C ATOM 0 H ALA A 31 -0.038 0.108 -11.162 1.00 15.00 H new ATOM 0 HA ALA A 31 -1.793 -1.944 -10.223 1.00 15.00 H new ATOM 0 HB1 ALA A 31 -0.899 -3.189 -12.142 1.00 15.00 H new ATOM 0 HB2 ALA A 31 -1.386 -1.539 -12.594 1.00 15.00 H new ATOM 0 HB3 ALA A 31 0.337 -1.931 -12.380 1.00 15.00 H new ATOM 450 N TRP A 32 -0.375 -3.654 -9.113 1.00 15.00 N ATOM 451 CA TRP A 32 0.407 -4.551 -8.271 1.00 15.00 C ATOM 452 C TRP A 32 1.460 -5.290 -9.098 1.00 15.00 C ATOM 453 O TRP A 32 2.477 -5.739 -8.572 1.00 15.00 O ATOM 454 CB TRP A 32 -0.517 -5.550 -7.567 1.00 15.00 C ATOM 455 CG TRP A 32 -1.587 -4.890 -6.748 1.00 15.00 C ATOM 456 CD1 TRP A 32 -2.860 -4.594 -7.148 1.00 15.00 C ATOM 457 CD2 TRP A 32 -1.478 -4.436 -5.392 1.00 15.00 C ATOM 458 NE1 TRP A 32 -3.547 -3.985 -6.126 1.00 15.00 N ATOM 459 CE2 TRP A 32 -2.723 -3.878 -5.039 1.00 15.00 C ATOM 460 CE3 TRP A 32 -0.453 -4.450 -4.441 1.00 15.00 C ATOM 461 CZ2 TRP A 32 -2.967 -3.337 -3.778 1.00 15.00 C ATOM 462 CZ3 TRP A 32 -0.699 -3.912 -3.190 1.00 15.00 C ATOM 463 CH2 TRP A 32 -1.947 -3.364 -2.868 1.00 15.00 C ATOM 0 H TRP A 32 -1.360 -3.905 -9.193 1.00 15.00 H new ATOM 0 HA TRP A 32 0.923 -3.956 -7.517 1.00 15.00 H new ATOM 0 HB2 TRP A 32 -0.984 -6.192 -8.314 1.00 15.00 H new ATOM 0 HB3 TRP A 32 0.080 -6.195 -6.922 1.00 15.00 H new ATOM 0 HD1 TRP A 32 -3.267 -4.808 -8.125 1.00 15.00 H new ATOM 0 HE1 TRP A 32 -4.514 -3.665 -6.170 1.00 15.00 H new ATOM 0 HE3 TRP A 32 0.512 -4.873 -4.678 1.00 15.00 H new ATOM 0 HZ2 TRP A 32 -3.928 -2.912 -3.528 1.00 15.00 H new ATOM 0 HZ3 TRP A 32 0.086 -3.915 -2.448 1.00 15.00 H new ATOM 0 HH2 TRP A 32 -2.107 -2.955 -1.881 1.00 15.00 H new ATOM 474 N ASP A 33 1.216 -5.395 -10.397 1.00 15.00 N ATOM 475 CA ASP A 33 2.133 -6.079 -11.298 1.00 15.00 C ATOM 476 C ASP A 33 2.981 -5.081 -12.091 1.00 15.00 C ATOM 477 O ASP A 33 3.632 -5.450 -13.069 1.00 15.00 O ATOM 478 CB ASP A 33 1.359 -7.000 -12.247 1.00 15.00 C ATOM 479 CG ASP A 33 0.461 -6.247 -13.210 1.00 15.00 C ATOM 480 OD1 ASP A 33 0.681 -6.340 -14.435 1.00 15.00 O ATOM 481 OD2 ASP A 33 -0.485 -5.577 -12.747 1.00 15.00 O1- ATOM 0 H ASP A 33 0.387 -5.013 -10.852 1.00 15.00 H new ATOM 0 HA ASP A 33 2.809 -6.685 -10.695 1.00 15.00 H new ATOM 0 HB2 ASP A 33 2.067 -7.602 -12.816 1.00 15.00 H new ATOM 0 HB3 ASP A 33 0.753 -7.690 -11.660 1.00 15.00 H new ATOM 486 N SER A 34 2.980 -3.820 -11.664 1.00 15.00 N ATOM 487 CA SER A 34 3.759 -2.784 -12.336 1.00 15.00 C ATOM 488 C SER A 34 5.220 -2.829 -11.892 1.00 15.00 C ATOM 489 O SER A 34 5.564 -3.523 -10.931 1.00 15.00 O ATOM 490 CB SER A 34 3.173 -1.399 -12.047 1.00 15.00 C ATOM 491 OG SER A 34 2.228 -1.034 -13.030 1.00 15.00 O ATOM 0 H SER A 34 2.449 -3.492 -10.857 1.00 15.00 H new ATOM 0 HA SER A 34 3.713 -2.973 -13.409 1.00 15.00 H new ATOM 0 HB2 SER A 34 2.700 -1.398 -11.065 1.00 15.00 H new ATOM 0 HB3 SER A 34 3.974 -0.661 -12.016 1.00 15.00 H new ATOM 0 HG SER A 34 1.867 -0.147 -12.823 1.00 15.00 H new ATOM 497 N GLN A 35 6.075 -2.094 -12.597 1.00 15.00 N ATOM 498 CA GLN A 35 7.491 -2.052 -12.265 1.00 15.00 C ATOM 499 C GLN A 35 7.943 -0.646 -11.883 1.00 15.00 C ATOM 500 O GLN A 35 9.127 -0.319 -11.985 1.00 15.00 O ATOM 501 CB GLN A 35 8.343 -2.577 -13.417 1.00 15.00 C ATOM 502 CG GLN A 35 8.924 -3.958 -13.157 1.00 15.00 C ATOM 503 CD GLN A 35 9.524 -4.089 -11.770 1.00 15.00 C ATOM 504 OE1 GLN A 35 10.676 -3.723 -11.542 1.00 15.00 O ATOM 505 NE2 GLN A 35 8.753 -4.626 -10.835 1.00 15.00 N ATOM 0 H GLN A 35 5.811 -1.522 -13.399 1.00 15.00 H new ATOM 0 HA GLN A 35 7.631 -2.700 -11.400 1.00 15.00 H new ATOM 0 HB2 GLN A 35 7.736 -2.611 -14.322 1.00 15.00 H new ATOM 0 HB3 GLN A 35 9.158 -1.878 -13.605 1.00 15.00 H new ATOM 0 HG2 GLN A 35 8.141 -4.706 -13.282 1.00 15.00 H new ATOM 0 HG3 GLN A 35 9.691 -4.171 -13.902 1.00 15.00 H new ATOM 0 HE21 GLN A 35 7.802 -4.917 -11.063 1.00 15.00 H new ATOM 0 HE22 GLN A 35 9.110 -4.748 -9.887 1.00 15.00 H new ATOM 514 N SER A 36 7.000 0.188 -11.459 1.00 15.00 N ATOM 515 CA SER A 36 7.336 1.526 -11.012 1.00 15.00 C ATOM 516 C SER A 36 8.155 1.350 -9.744 1.00 15.00 C ATOM 517 O SER A 36 7.774 0.556 -8.879 1.00 15.00 O ATOM 518 CB SER A 36 6.055 2.315 -10.743 1.00 15.00 C ATOM 519 OG SER A 36 4.947 1.702 -11.394 1.00 15.00 O ATOM 0 H SER A 36 6.007 -0.040 -11.417 1.00 15.00 H new ATOM 0 HA SER A 36 7.901 2.082 -11.760 1.00 15.00 H new ATOM 0 HB2 SER A 36 5.871 2.367 -9.670 1.00 15.00 H new ATOM 0 HB3 SER A 36 6.171 3.340 -11.096 1.00 15.00 H new ATOM 0 HG SER A 36 4.134 2.218 -11.211 1.00 15.00 H new ATOM 525 N PRO A 37 9.289 2.042 -9.589 1.00 15.00 N ATOM 526 CA PRO A 37 10.121 1.799 -8.420 1.00 15.00 C ATOM 527 C PRO A 37 9.541 2.339 -7.119 1.00 15.00 C ATOM 528 O PRO A 37 9.598 3.533 -6.819 1.00 15.00 O ATOM 529 CB PRO A 37 11.409 2.547 -8.767 1.00 15.00 C ATOM 530 CG PRO A 37 10.996 3.622 -9.714 1.00 15.00 C ATOM 531 CD PRO A 37 9.830 3.075 -10.487 1.00 15.00 C ATOM 0 HA PRO A 37 10.237 0.731 -8.234 1.00 15.00 H new ATOM 0 HB2 PRO A 37 11.873 2.966 -7.874 1.00 15.00 H new ATOM 0 HB3 PRO A 37 12.140 1.880 -9.224 1.00 15.00 H new ATOM 0 HG2 PRO A 37 10.716 4.528 -9.176 1.00 15.00 H new ATOM 0 HG3 PRO A 37 11.815 3.888 -10.382 1.00 15.00 H new ATOM 0 HD2 PRO A 37 9.092 3.847 -10.704 1.00 15.00 H new ATOM 0 HD3 PRO A 37 10.142 2.655 -11.443 1.00 15.00 H new ATOM 539 N HIS A 38 8.967 1.419 -6.366 1.00 15.00 N ATOM 540 CA HIS A 38 8.439 1.682 -5.047 1.00 15.00 C ATOM 541 C HIS A 38 9.126 0.752 -4.063 1.00 15.00 C ATOM 542 O HIS A 38 9.727 -0.239 -4.484 1.00 15.00 O ATOM 543 CB HIS A 38 6.920 1.527 -5.013 1.00 15.00 C ATOM 544 CG HIS A 38 6.217 2.850 -5.058 1.00 15.00 C ATOM 545 ND1 HIS A 38 4.999 3.064 -5.661 1.00 15.00 N ATOM 546 CD2 HIS A 38 6.601 4.053 -4.559 1.00 15.00 C ATOM 547 CE1 HIS A 38 4.687 4.360 -5.513 1.00 15.00 C ATOM 548 NE2 HIS A 38 5.631 5.004 -4.853 1.00 15.00 N ATOM 0 H HIS A 38 8.854 0.450 -6.663 1.00 15.00 H new ATOM 0 HA HIS A 38 8.643 2.716 -4.767 1.00 15.00 H new ATOM 0 HB2 HIS A 38 6.599 0.918 -5.858 1.00 15.00 H new ATOM 0 HB3 HIS A 38 6.631 0.994 -4.107 1.00 15.00 H new ATOM 0 HD1 HIS A 38 4.433 2.361 -6.137 1.00 15.00 H new ATOM 0 HD2 HIS A 38 7.517 4.241 -4.018 1.00 15.00 H new ATOM 0 HE1 HIS A 38 3.782 4.817 -5.885 1.00 15.00 H new ATOM 556 N ALA A 39 9.060 1.039 -2.775 1.00 15.00 N ATOM 557 CA ALA A 39 9.650 0.131 -1.808 1.00 15.00 C ATOM 558 C ALA A 39 8.564 -0.822 -1.311 1.00 15.00 C ATOM 559 O ALA A 39 7.642 -0.406 -0.604 1.00 15.00 O ATOM 560 CB ALA A 39 10.268 0.904 -0.651 1.00 15.00 C ATOM 0 H ALA A 39 8.617 1.869 -2.382 1.00 15.00 H new ATOM 0 HA ALA A 39 10.449 -0.441 -2.279 1.00 15.00 H new ATOM 0 HB1 ALA A 39 10.704 0.205 0.062 1.00 15.00 H new ATOM 0 HB2 ALA A 39 11.045 1.567 -1.031 1.00 15.00 H new ATOM 0 HB3 ALA A 39 9.497 1.494 -0.155 1.00 15.00 H new ATOM 566 N HIS A 40 8.685 -2.097 -1.669 1.00 15.00 N ATOM 567 CA HIS A 40 7.704 -3.104 -1.270 1.00 15.00 C ATOM 568 C HIS A 40 8.182 -4.507 -1.629 1.00 15.00 C ATOM 569 O HIS A 40 9.278 -4.683 -2.162 1.00 15.00 O ATOM 570 CB HIS A 40 6.337 -2.830 -1.929 1.00 15.00 C ATOM 571 CG HIS A 40 6.326 -2.951 -3.429 1.00 15.00 C ATOM 572 ND1 HIS A 40 6.804 -1.947 -4.237 1.00 15.00 N ATOM 573 CD2 HIS A 40 5.867 -3.963 -4.208 1.00 15.00 C ATOM 574 CE1 HIS A 40 6.626 -2.366 -5.479 1.00 15.00 C ATOM 575 NE2 HIS A 40 6.062 -3.580 -5.509 1.00 15.00 N ATOM 0 H HIS A 40 9.453 -2.459 -2.235 1.00 15.00 H new ATOM 0 HA HIS A 40 7.590 -3.042 -0.188 1.00 15.00 H new ATOM 0 HB2 HIS A 40 5.605 -3.524 -1.517 1.00 15.00 H new ATOM 0 HB3 HIS A 40 6.013 -1.826 -1.657 1.00 15.00 H new ATOM 0 HD2 HIS A 40 5.432 -4.891 -3.868 1.00 15.00 H new ATOM 0 HE1 HIS A 40 6.901 -1.801 -6.357 1.00 15.00 H new ATOM 0 HE2 HIS A 40 5.823 -4.118 -6.342 1.00 15.00 H new ATOM 583 N GLY A 41 7.349 -5.498 -1.326 1.00 15.00 N ATOM 584 CA GLY A 41 7.668 -6.879 -1.639 1.00 15.00 C ATOM 585 C GLY A 41 6.414 -7.712 -1.807 1.00 15.00 C ATOM 586 O GLY A 41 6.426 -8.934 -1.623 1.00 15.00 O ATOM 0 H GLY A 41 6.449 -5.366 -0.864 1.00 15.00 H new ATOM 0 HA2 GLY A 41 8.258 -6.919 -2.554 1.00 15.00 H new ATOM 0 HA3 GLY A 41 8.283 -7.301 -0.844 1.00 15.00 H new ATOM 590 N TYR A 42 5.327 -7.039 -2.161 1.00 15.00 N ATOM 591 CA TYR A 42 4.040 -7.694 -2.344 1.00 15.00 C ATOM 592 C TYR A 42 3.792 -7.983 -3.818 1.00 15.00 C ATOM 593 O TYR A 42 3.574 -7.073 -4.614 1.00 15.00 O ATOM 594 CB TYR A 42 2.918 -6.820 -1.776 1.00 15.00 C ATOM 595 CG TYR A 42 3.251 -6.211 -0.429 1.00 15.00 C ATOM 596 CD1 TYR A 42 3.262 -4.832 -0.251 1.00 15.00 C ATOM 597 CD2 TYR A 42 3.572 -7.014 0.658 1.00 15.00 C ATOM 598 CE1 TYR A 42 3.583 -4.273 0.973 1.00 15.00 C ATOM 599 CE2 TYR A 42 3.892 -6.464 1.883 1.00 15.00 C ATOM 600 CZ TYR A 42 3.897 -5.092 2.037 1.00 15.00 C ATOM 601 OH TYR A 42 4.222 -4.541 3.256 1.00 15.00 O ATOM 0 H TYR A 42 5.312 -6.033 -2.328 1.00 15.00 H new ATOM 0 HA TYR A 42 4.053 -8.642 -1.806 1.00 15.00 H new ATOM 0 HB2 TYR A 42 2.697 -6.020 -2.483 1.00 15.00 H new ATOM 0 HB3 TYR A 42 2.013 -7.420 -1.681 1.00 15.00 H new ATOM 0 HD1 TYR A 42 3.016 -4.187 -1.082 1.00 15.00 H new ATOM 0 HD2 TYR A 42 3.571 -8.088 0.543 1.00 15.00 H new ATOM 0 HE1 TYR A 42 3.588 -3.200 1.095 1.00 15.00 H new ATOM 0 HE2 TYR A 42 4.137 -7.104 2.717 1.00 15.00 H new ATOM 0 HH TYR A 42 3.754 -3.687 3.364 1.00 15.00 H new ATOM 611 N ILE A 43 3.848 -9.256 -4.169 1.00 15.00 N ATOM 612 CA ILE A 43 3.630 -9.688 -5.542 1.00 15.00 C ATOM 613 C ILE A 43 2.326 -10.476 -5.621 1.00 15.00 C ATOM 614 O ILE A 43 2.062 -11.308 -4.751 1.00 15.00 O ATOM 615 CB ILE A 43 4.803 -10.569 -6.039 1.00 15.00 C ATOM 616 CG1 ILE A 43 6.151 -9.916 -5.703 1.00 15.00 C ATOM 617 CG2 ILE A 43 4.702 -10.827 -7.537 1.00 15.00 C ATOM 618 CD1 ILE A 43 6.398 -8.598 -6.414 1.00 15.00 C ATOM 0 H ILE A 43 4.044 -10.016 -3.517 1.00 15.00 H new ATOM 0 HA ILE A 43 3.571 -8.806 -6.180 1.00 15.00 H new ATOM 0 HB ILE A 43 4.740 -11.527 -5.524 1.00 15.00 H new ATOM 0 HG12 ILE A 43 6.204 -9.751 -4.627 1.00 15.00 H new ATOM 0 HG13 ILE A 43 6.952 -10.610 -5.959 1.00 15.00 H new ATOM 0 HG21 ILE A 43 5.539 -11.448 -7.856 1.00 15.00 H new ATOM 0 HG22 ILE A 43 3.765 -11.340 -7.756 1.00 15.00 H new ATOM 0 HG23 ILE A 43 4.729 -9.878 -8.072 1.00 15.00 H new ATOM 0 HD11 ILE A 43 7.371 -8.204 -6.122 1.00 15.00 H new ATOM 0 HD12 ILE A 43 6.380 -8.757 -7.492 1.00 15.00 H new ATOM 0 HD13 ILE A 43 5.620 -7.885 -6.139 1.00 15.00 H new ATOM 630 N PRO A 44 1.483 -10.217 -6.639 1.00 15.00 N ATOM 631 CA PRO A 44 0.195 -10.915 -6.811 1.00 15.00 C ATOM 632 C PRO A 44 0.311 -12.440 -6.736 1.00 15.00 C ATOM 633 O PRO A 44 -0.588 -13.110 -6.231 1.00 15.00 O ATOM 634 CB PRO A 44 -0.250 -10.484 -8.207 1.00 15.00 C ATOM 635 CG PRO A 44 0.381 -9.155 -8.418 1.00 15.00 C ATOM 636 CD PRO A 44 1.698 -9.198 -7.692 1.00 15.00 C ATOM 0 HA PRO A 44 -0.504 -10.659 -6.015 1.00 15.00 H new ATOM 0 HB2 PRO A 44 0.074 -11.199 -8.963 1.00 15.00 H new ATOM 0 HB3 PRO A 44 -1.336 -10.420 -8.273 1.00 15.00 H new ATOM 0 HG2 PRO A 44 0.528 -8.958 -9.480 1.00 15.00 H new ATOM 0 HG3 PRO A 44 -0.252 -8.357 -8.030 1.00 15.00 H new ATOM 0 HD2 PRO A 44 2.514 -9.477 -8.359 1.00 15.00 H new ATOM 0 HD3 PRO A 44 1.952 -8.228 -7.265 1.00 15.00 H new ATOM 644 N SER A 45 1.428 -12.984 -7.217 1.00 15.00 N ATOM 645 CA SER A 45 1.657 -14.427 -7.198 1.00 15.00 C ATOM 646 C SER A 45 1.823 -14.949 -5.768 1.00 15.00 C ATOM 647 O SER A 45 1.731 -16.151 -5.519 1.00 15.00 O ATOM 648 CB SER A 45 2.901 -14.764 -8.015 1.00 15.00 C ATOM 649 OG SER A 45 3.230 -13.703 -8.899 1.00 15.00 O ATOM 0 H SER A 45 2.191 -12.444 -7.626 1.00 15.00 H new ATOM 0 HA SER A 45 0.785 -14.911 -7.636 1.00 15.00 H new ATOM 0 HB2 SER A 45 3.739 -14.958 -7.345 1.00 15.00 H new ATOM 0 HB3 SER A 45 2.730 -15.677 -8.585 1.00 15.00 H new ATOM 0 HG SER A 45 4.031 -13.940 -9.411 1.00 15.00 H new ATOM 655 N LYS A 46 2.076 -14.041 -4.833 1.00 15.00 N ATOM 656 CA LYS A 46 2.253 -14.408 -3.434 1.00 15.00 C ATOM 657 C LYS A 46 0.935 -14.282 -2.678 1.00 15.00 C ATOM 658 O LYS A 46 0.809 -14.754 -1.546 1.00 15.00 O ATOM 659 CB LYS A 46 3.320 -13.522 -2.781 1.00 15.00 C ATOM 660 CG LYS A 46 4.699 -13.661 -3.411 1.00 15.00 C ATOM 661 CD LYS A 46 5.630 -12.523 -3.005 1.00 15.00 C ATOM 662 CE LYS A 46 5.990 -12.585 -1.529 1.00 15.00 C ATOM 663 NZ LYS A 46 7.071 -11.624 -1.172 1.00 15.00 N1+ ATOM 0 H LYS A 46 2.163 -13.042 -5.020 1.00 15.00 H new ATOM 0 HA LYS A 46 2.583 -15.446 -3.390 1.00 15.00 H new ATOM 0 HB2 LYS A 46 3.004 -12.481 -2.845 1.00 15.00 H new ATOM 0 HB3 LYS A 46 3.387 -13.770 -1.722 1.00 15.00 H new ATOM 0 HG2 LYS A 46 5.139 -14.613 -3.114 1.00 15.00 H new ATOM 0 HG3 LYS A 46 4.601 -13.680 -4.496 1.00 15.00 H new ATOM 0 HD2 LYS A 46 6.540 -12.568 -3.603 1.00 15.00 H new ATOM 0 HD3 LYS A 46 5.152 -11.568 -3.222 1.00 15.00 H new ATOM 0 HE2 LYS A 46 5.104 -12.371 -0.931 1.00 15.00 H new ATOM 0 HE3 LYS A 46 6.308 -13.597 -1.277 1.00 15.00 H new ATOM 0 HZ1 LYS A 46 7.178 -11.591 -0.138 1.00 15.00 H new ATOM 0 HZ2 LYS A 46 7.966 -11.932 -1.603 1.00 15.00 H new ATOM 0 HZ3 LYS A 46 6.825 -10.677 -1.525 1.00 15.00 H new ATOM 677 N PHE A 47 -0.048 -13.648 -3.314 1.00 15.00 N ATOM 678 CA PHE A 47 -1.360 -13.457 -2.705 1.00 15.00 C ATOM 679 C PHE A 47 -2.479 -13.785 -3.699 1.00 15.00 C ATOM 680 O PHE A 47 -3.291 -12.919 -4.028 1.00 15.00 O ATOM 681 CB PHE A 47 -1.526 -12.009 -2.226 1.00 15.00 C ATOM 682 CG PHE A 47 -0.494 -11.555 -1.231 1.00 15.00 C ATOM 683 CD1 PHE A 47 -0.679 -11.766 0.125 1.00 15.00 C ATOM 684 CD2 PHE A 47 0.660 -10.908 -1.653 1.00 15.00 C ATOM 685 CE1 PHE A 47 0.263 -11.342 1.041 1.00 15.00 C ATOM 686 CE2 PHE A 47 1.606 -10.483 -0.741 1.00 15.00 C ATOM 687 CZ PHE A 47 1.406 -10.700 0.608 1.00 15.00 C ATOM 0 H PHE A 47 0.041 -13.258 -4.252 1.00 15.00 H new ATOM 0 HA PHE A 47 -1.429 -14.134 -1.853 1.00 15.00 H new ATOM 0 HB2 PHE A 47 -1.492 -11.348 -3.092 1.00 15.00 H new ATOM 0 HB3 PHE A 47 -2.514 -11.899 -1.780 1.00 15.00 H new ATOM 0 HD1 PHE A 47 -1.571 -12.268 0.470 1.00 15.00 H new ATOM 0 HD2 PHE A 47 0.820 -10.735 -2.707 1.00 15.00 H new ATOM 0 HE1 PHE A 47 0.106 -11.512 2.096 1.00 15.00 H new ATOM 0 HE2 PHE A 47 2.500 -9.982 -1.082 1.00 15.00 H new ATOM 0 HZ PHE A 47 2.143 -10.368 1.324 1.00 15.00 H new ATOM 697 N PRO A 48 -2.560 -15.040 -4.178 1.00 15.00 N ATOM 698 CA PRO A 48 -3.589 -15.436 -5.144 1.00 15.00 C ATOM 699 C PRO A 48 -4.969 -15.549 -4.501 1.00 15.00 C ATOM 700 O PRO A 48 -5.995 -15.415 -5.171 1.00 15.00 O ATOM 701 CB PRO A 48 -3.106 -16.802 -5.634 1.00 15.00 C ATOM 702 CG PRO A 48 -2.278 -17.349 -4.525 1.00 15.00 C ATOM 703 CD PRO A 48 -1.671 -16.167 -3.819 1.00 15.00 C ATOM 0 HA PRO A 48 -3.709 -14.704 -5.942 1.00 15.00 H new ATOM 0 HB2 PRO A 48 -3.947 -17.459 -5.858 1.00 15.00 H new ATOM 0 HB3 PRO A 48 -2.523 -16.707 -6.550 1.00 15.00 H new ATOM 0 HG2 PRO A 48 -2.888 -17.938 -3.840 1.00 15.00 H new ATOM 0 HG3 PRO A 48 -1.502 -18.011 -4.910 1.00 15.00 H new ATOM 0 HD2 PRO A 48 -1.637 -16.321 -2.740 1.00 15.00 H new ATOM 0 HD3 PRO A 48 -0.647 -15.988 -4.148 1.00 15.00 H new ATOM 711 N ASN A 49 -4.977 -15.779 -3.195 1.00 15.00 N ATOM 712 CA ASN A 49 -6.216 -15.917 -2.433 1.00 15.00 C ATOM 713 C ASN A 49 -6.811 -14.553 -2.101 1.00 15.00 C ATOM 714 O ASN A 49 -8.006 -14.435 -1.839 1.00 15.00 O ATOM 715 CB ASN A 49 -5.970 -16.701 -1.135 1.00 15.00 C ATOM 716 CG ASN A 49 -5.000 -16.004 -0.190 1.00 15.00 C ATOM 717 OD1 ASN A 49 -4.084 -15.301 -0.623 1.00 15.00 O ATOM 718 ND2 ASN A 49 -5.191 -16.194 1.106 1.00 15.00 N ATOM 0 H ASN A 49 -4.131 -15.875 -2.634 1.00 15.00 H new ATOM 0 HA ASN A 49 -6.924 -16.466 -3.053 1.00 15.00 H new ATOM 0 HB2 ASN A 49 -6.921 -16.852 -0.623 1.00 15.00 H new ATOM 0 HB3 ASN A 49 -5.580 -17.688 -1.382 1.00 15.00 H new ATOM 0 HD21 ASN A 49 -4.569 -15.752 1.783 1.00 15.00 H new ATOM 0 HD22 ASN A 49 -5.960 -16.782 1.427 1.00 15.00 H new ATOM 725 N LYS A 50 -5.972 -13.523 -2.122 1.00 15.00 N ATOM 726 CA LYS A 50 -6.425 -12.174 -1.816 1.00 15.00 C ATOM 727 C LYS A 50 -6.949 -11.479 -3.069 1.00 15.00 C ATOM 728 O LYS A 50 -7.356 -10.318 -3.019 1.00 15.00 O ATOM 729 CB LYS A 50 -5.291 -11.354 -1.192 1.00 15.00 C ATOM 730 CG LYS A 50 -4.772 -11.913 0.127 1.00 15.00 C ATOM 731 CD LYS A 50 -5.889 -12.105 1.143 1.00 15.00 C ATOM 732 CE LYS A 50 -5.337 -12.416 2.527 1.00 15.00 C ATOM 733 NZ LYS A 50 -6.349 -13.075 3.398 1.00 15.00 N1+ ATOM 0 H LYS A 50 -4.980 -13.597 -2.347 1.00 15.00 H new ATOM 0 HA LYS A 50 -7.241 -12.248 -1.097 1.00 15.00 H new ATOM 0 HB2 LYS A 50 -4.465 -11.298 -1.901 1.00 15.00 H new ATOM 0 HB3 LYS A 50 -5.641 -10.335 -1.030 1.00 15.00 H new ATOM 0 HG2 LYS A 50 -4.278 -12.868 -0.053 1.00 15.00 H new ATOM 0 HG3 LYS A 50 -4.021 -11.237 0.537 1.00 15.00 H new ATOM 0 HD2 LYS A 50 -6.500 -11.204 1.188 1.00 15.00 H new ATOM 0 HD3 LYS A 50 -6.541 -12.916 0.819 1.00 15.00 H new ATOM 0 HE2 LYS A 50 -4.465 -13.063 2.432 1.00 15.00 H new ATOM 0 HE3 LYS A 50 -5.000 -11.493 2.998 1.00 15.00 H new ATOM 0 HZ1 LYS A 50 -6.023 -13.055 4.385 1.00 15.00 H new ATOM 0 HZ2 LYS A 50 -7.254 -12.569 3.322 1.00 15.00 H new ATOM 0 HZ3 LYS A 50 -6.477 -14.062 3.096 1.00 15.00 H new ATOM 747 N ASN A 51 -6.922 -12.207 -4.188 1.00 15.00 N ATOM 748 CA ASN A 51 -7.398 -11.700 -5.474 1.00 15.00 C ATOM 749 C ASN A 51 -6.698 -10.397 -5.860 1.00 15.00 C ATOM 750 O ASN A 51 -7.345 -9.384 -6.142 1.00 15.00 O ATOM 751 CB ASN A 51 -8.919 -11.504 -5.444 1.00 15.00 C ATOM 752 CG ASN A 51 -9.520 -11.353 -6.831 1.00 15.00 C ATOM 753 OD1 ASN A 51 -9.005 -11.893 -7.811 1.00 15.00 O ATOM 754 ND2 ASN A 51 -10.613 -10.617 -6.925 1.00 15.00 N ATOM 0 H ASN A 51 -6.570 -13.163 -4.226 1.00 15.00 H new ATOM 0 HA ASN A 51 -7.154 -12.443 -6.233 1.00 15.00 H new ATOM 0 HB2 ASN A 51 -9.381 -12.355 -4.944 1.00 15.00 H new ATOM 0 HB3 ASN A 51 -9.155 -10.620 -4.852 1.00 15.00 H new ATOM 0 HD21 ASN A 51 -11.059 -10.480 -7.832 1.00 15.00 H new ATOM 0 HD22 ASN A 51 -11.011 -10.185 -6.091 1.00 15.00 H new ATOM 761 N LEU A 52 -5.371 -10.422 -5.849 1.00 15.00 N ATOM 762 CA LEU A 52 -4.594 -9.249 -6.223 1.00 15.00 C ATOM 763 C LEU A 52 -4.455 -9.203 -7.737 1.00 15.00 C ATOM 764 O LEU A 52 -3.752 -10.024 -8.325 1.00 15.00 O ATOM 765 CB LEU A 52 -3.210 -9.294 -5.569 1.00 15.00 C ATOM 766 CG LEU A 52 -2.963 -8.253 -4.472 1.00 15.00 C ATOM 767 CD1 LEU A 52 -3.876 -8.493 -3.277 1.00 15.00 C ATOM 768 CD2 LEU A 52 -1.504 -8.272 -4.037 1.00 15.00 C ATOM 0 H LEU A 52 -4.814 -11.236 -5.587 1.00 15.00 H new ATOM 0 HA LEU A 52 -5.108 -8.353 -5.876 1.00 15.00 H new ATOM 0 HB2 LEU A 52 -3.061 -10.286 -5.144 1.00 15.00 H new ATOM 0 HB3 LEU A 52 -2.456 -9.163 -6.346 1.00 15.00 H new ATOM 0 HG LEU A 52 -3.192 -7.269 -4.882 1.00 15.00 H new ATOM 0 HD11 LEU A 52 -3.681 -7.741 -2.513 1.00 15.00 H new ATOM 0 HD12 LEU A 52 -4.916 -8.426 -3.595 1.00 15.00 H new ATOM 0 HD13 LEU A 52 -3.685 -9.485 -2.867 1.00 15.00 H new ATOM 0 HD21 LEU A 52 -1.347 -7.526 -3.258 1.00 15.00 H new ATOM 0 HD22 LEU A 52 -1.252 -9.260 -3.650 1.00 15.00 H new ATOM 0 HD23 LEU A 52 -0.867 -8.044 -4.891 1.00 15.00 H new ATOM 780 N LYS A 53 -5.116 -8.237 -8.362 1.00 15.00 N ATOM 781 CA LYS A 53 -5.082 -8.093 -9.811 1.00 15.00 C ATOM 782 C LYS A 53 -5.185 -6.626 -10.204 1.00 15.00 C ATOM 783 O LYS A 53 -5.812 -5.831 -9.497 1.00 15.00 O ATOM 784 CB LYS A 53 -6.242 -8.870 -10.458 1.00 15.00 C ATOM 785 CG LYS A 53 -6.195 -10.378 -10.237 1.00 15.00 C ATOM 786 CD LYS A 53 -5.228 -11.058 -11.192 1.00 15.00 C ATOM 787 CE LYS A 53 -4.972 -12.504 -10.792 1.00 15.00 C ATOM 788 NZ LYS A 53 -4.363 -13.290 -11.898 1.00 15.00 N1+ ATOM 0 H LYS A 53 -5.685 -7.538 -7.884 1.00 15.00 H new ATOM 0 HA LYS A 53 -4.134 -8.497 -10.166 1.00 15.00 H new ATOM 0 HB2 LYS A 53 -7.183 -8.487 -10.064 1.00 15.00 H new ATOM 0 HB3 LYS A 53 -6.241 -8.673 -11.530 1.00 15.00 H new ATOM 0 HG2 LYS A 53 -5.897 -10.586 -9.209 1.00 15.00 H new ATOM 0 HG3 LYS A 53 -7.193 -10.796 -10.371 1.00 15.00 H new ATOM 0 HD2 LYS A 53 -5.631 -11.025 -12.204 1.00 15.00 H new ATOM 0 HD3 LYS A 53 -4.285 -10.511 -11.207 1.00 15.00 H new ATOM 0 HE2 LYS A 53 -4.313 -12.529 -9.924 1.00 15.00 H new ATOM 0 HE3 LYS A 53 -5.911 -12.969 -10.492 1.00 15.00 H new ATOM 0 HZ1 LYS A 53 -4.206 -14.268 -11.583 1.00 15.00 H new ATOM 0 HZ2 LYS A 53 -5.003 -13.289 -12.718 1.00 15.00 H new ATOM 0 HZ3 LYS A 53 -3.454 -12.863 -12.168 1.00 15.00 H new ATOM 802 N LYS A 54 -4.578 -6.286 -11.342 1.00 15.00 N ATOM 803 CA LYS A 54 -4.599 -4.925 -11.877 1.00 15.00 C ATOM 804 C LYS A 54 -4.091 -3.911 -10.854 1.00 15.00 C ATOM 805 O LYS A 54 -3.076 -4.134 -10.188 1.00 15.00 O ATOM 806 CB LYS A 54 -6.021 -4.551 -12.327 1.00 15.00 C ATOM 807 CG LYS A 54 -6.680 -5.588 -13.225 1.00 15.00 C ATOM 808 CD LYS A 54 -5.970 -5.700 -14.562 1.00 15.00 C ATOM 809 CE LYS A 54 -6.697 -6.650 -15.498 1.00 15.00 C ATOM 810 NZ LYS A 54 -5.995 -6.785 -16.800 1.00 15.00 N1+ ATOM 0 H LYS A 54 -4.058 -6.947 -11.919 1.00 15.00 H new ATOM 0 HA LYS A 54 -3.930 -4.898 -12.737 1.00 15.00 H new ATOM 0 HB2 LYS A 54 -6.643 -4.402 -11.444 1.00 15.00 H new ATOM 0 HB3 LYS A 54 -5.985 -3.598 -12.856 1.00 15.00 H new ATOM 0 HG2 LYS A 54 -6.675 -6.558 -12.727 1.00 15.00 H new ATOM 0 HG3 LYS A 54 -7.724 -5.319 -13.388 1.00 15.00 H new ATOM 0 HD2 LYS A 54 -5.901 -4.715 -15.023 1.00 15.00 H new ATOM 0 HD3 LYS A 54 -4.950 -6.051 -14.406 1.00 15.00 H new ATOM 0 HE2 LYS A 54 -6.782 -7.630 -15.028 1.00 15.00 H new ATOM 0 HE3 LYS A 54 -7.711 -6.288 -15.667 1.00 15.00 H new ATOM 0 HZ1 LYS A 54 -6.521 -7.441 -17.412 1.00 15.00 H new ATOM 0 HZ2 LYS A 54 -5.936 -5.854 -17.261 1.00 15.00 H new ATOM 0 HZ3 LYS A 54 -5.036 -7.154 -16.641 1.00 15.00 H new ATOM 824 N ASN A 55 -4.795 -2.791 -10.749 1.00 15.00 N ATOM 825 CA ASN A 55 -4.442 -1.735 -9.814 1.00 15.00 C ATOM 826 C ASN A 55 -5.649 -1.380 -8.957 1.00 15.00 C ATOM 827 O ASN A 55 -5.859 -0.225 -8.589 1.00 15.00 O ATOM 828 CB ASN A 55 -3.919 -0.496 -10.559 1.00 15.00 C ATOM 829 CG ASN A 55 -4.968 0.201 -11.406 1.00 15.00 C ATOM 830 OD1 ASN A 55 -5.843 -0.434 -12.001 1.00 15.00 O ATOM 831 ND2 ASN A 55 -4.877 1.520 -11.474 1.00 15.00 N ATOM 0 H ASN A 55 -5.624 -2.591 -11.309 1.00 15.00 H new ATOM 0 HA ASN A 55 -3.643 -2.094 -9.165 1.00 15.00 H new ATOM 0 HB2 ASN A 55 -3.524 0.213 -9.832 1.00 15.00 H new ATOM 0 HB3 ASN A 55 -3.088 -0.793 -11.199 1.00 15.00 H new ATOM 0 HD21 ASN A 55 -5.546 2.049 -12.034 1.00 15.00 H new ATOM 0 HD22 ASN A 55 -4.138 2.007 -10.967 1.00 15.00 H new ATOM 838 N TYR A 56 -6.445 -2.392 -8.644 1.00 15.00 N ATOM 839 CA TYR A 56 -7.634 -2.198 -7.830 1.00 15.00 C ATOM 840 C TYR A 56 -7.275 -2.209 -6.351 1.00 15.00 C ATOM 841 O TYR A 56 -6.338 -2.899 -5.935 1.00 15.00 O ATOM 842 CB TYR A 56 -8.672 -3.284 -8.119 1.00 15.00 C ATOM 843 CG TYR A 56 -9.093 -3.362 -9.571 1.00 15.00 C ATOM 844 CD1 TYR A 56 -9.339 -4.589 -10.171 1.00 15.00 C ATOM 845 CD2 TYR A 56 -9.244 -2.213 -10.339 1.00 15.00 C ATOM 846 CE1 TYR A 56 -9.721 -4.672 -11.494 1.00 15.00 C ATOM 847 CE2 TYR A 56 -9.627 -2.287 -11.664 1.00 15.00 C ATOM 848 CZ TYR A 56 -9.866 -3.519 -12.237 1.00 15.00 C ATOM 849 OH TYR A 56 -10.246 -3.600 -13.557 1.00 15.00 O ATOM 0 H TYR A 56 -6.288 -3.355 -8.942 1.00 15.00 H new ATOM 0 HA TYR A 56 -8.062 -1.228 -8.084 1.00 15.00 H new ATOM 0 HB2 TYR A 56 -8.267 -4.250 -7.816 1.00 15.00 H new ATOM 0 HB3 TYR A 56 -9.554 -3.102 -7.505 1.00 15.00 H new ATOM 0 HD1 TYR A 56 -9.230 -5.494 -9.592 1.00 15.00 H new ATOM 0 HD2 TYR A 56 -9.059 -1.247 -9.892 1.00 15.00 H new ATOM 0 HE1 TYR A 56 -9.906 -5.635 -11.946 1.00 15.00 H new ATOM 0 HE2 TYR A 56 -9.739 -1.386 -12.248 1.00 15.00 H new ATOM 0 HH TYR A 56 -10.303 -2.698 -13.937 1.00 15.00 H new ATOM 859 N CYS A 57 -8.012 -1.430 -5.569 1.00 15.00 N ATOM 860 CA CYS A 57 -7.797 -1.355 -4.131 1.00 15.00 C ATOM 861 C CYS A 57 -8.028 -2.724 -3.496 1.00 15.00 C ATOM 862 O CYS A 57 -9.072 -3.351 -3.698 1.00 15.00 O ATOM 863 CB CYS A 57 -8.735 -0.318 -3.510 1.00 15.00 C ATOM 864 SG CYS A 57 -8.312 0.142 -1.811 1.00 15.00 S ATOM 0 H CYS A 57 -8.769 -0.838 -5.911 1.00 15.00 H new ATOM 0 HA CYS A 57 -6.768 -1.050 -3.944 1.00 15.00 H new ATOM 0 HB2 CYS A 57 -8.728 0.579 -4.130 1.00 15.00 H new ATOM 0 HB3 CYS A 57 -9.752 -0.709 -3.526 1.00 15.00 H new ATOM 0 HG CYS A 57 -7.160 -0.372 -1.496 1.00 15.00 H new ATOM 870 N ARG A 58 -7.044 -3.188 -2.742 1.00 15.00 N ATOM 871 CA ARG A 58 -7.123 -4.488 -2.086 1.00 15.00 C ATOM 872 C ARG A 58 -6.692 -4.368 -0.633 1.00 15.00 C ATOM 873 O ARG A 58 -6.098 -3.369 -0.238 1.00 15.00 O ATOM 874 CB ARG A 58 -6.208 -5.505 -2.791 1.00 15.00 C ATOM 875 CG ARG A 58 -6.532 -5.745 -4.261 1.00 15.00 C ATOM 876 CD ARG A 58 -7.744 -6.649 -4.424 1.00 15.00 C ATOM 877 NE ARG A 58 -8.947 -5.898 -4.778 1.00 15.00 N ATOM 878 CZ ARG A 58 -9.905 -6.360 -5.580 1.00 15.00 C ATOM 879 NH1 ARG A 58 -9.809 -7.571 -6.121 1.00 15.00 N1+ ATOM 880 NH2 ARG A 58 -10.951 -5.599 -5.870 1.00 15.00 N ATOM 0 H ARG A 58 -6.176 -2.682 -2.567 1.00 15.00 H new ATOM 0 HA ARG A 58 -8.156 -4.831 -2.139 1.00 15.00 H new ATOM 0 HB2 ARG A 58 -5.177 -5.160 -2.712 1.00 15.00 H new ATOM 0 HB3 ARG A 58 -6.268 -6.455 -2.260 1.00 15.00 H new ATOM 0 HG2 ARG A 58 -6.719 -4.791 -4.754 1.00 15.00 H new ATOM 0 HG3 ARG A 58 -5.671 -6.196 -4.756 1.00 15.00 H new ATOM 0 HD2 ARG A 58 -7.541 -7.391 -5.196 1.00 15.00 H new ATOM 0 HD3 ARG A 58 -7.917 -7.193 -3.496 1.00 15.00 H new ATOM 0 HE ARG A 58 -9.060 -4.963 -4.387 1.00 15.00 H new ATOM 0 HH11 ARG A 58 -8.997 -8.155 -5.923 1.00 15.00 H new ATOM 0 HH12 ARG A 58 -10.548 -7.916 -6.734 1.00 15.00 H new ATOM 0 HH21 ARG A 58 -11.022 -4.660 -5.479 1.00 15.00 H new ATOM 0 HH22 ARG A 58 -11.685 -5.953 -6.484 1.00 15.00 H new ATOM 894 N ASN A 59 -6.995 -5.382 0.162 1.00 15.00 N ATOM 895 CA ASN A 59 -6.596 -5.382 1.561 1.00 15.00 C ATOM 896 C ASN A 59 -6.061 -6.752 1.953 1.00 15.00 C ATOM 897 O ASN A 59 -6.777 -7.576 2.521 1.00 15.00 O ATOM 898 CB ASN A 59 -7.747 -4.984 2.486 1.00 15.00 C ATOM 899 CG ASN A 59 -7.241 -4.556 3.850 1.00 15.00 C ATOM 900 OD1 ASN A 59 -6.228 -5.066 4.337 1.00 15.00 O ATOM 901 ND2 ASN A 59 -7.935 -3.621 4.475 1.00 15.00 N ATOM 0 H ASN A 59 -7.512 -6.210 -0.134 1.00 15.00 H new ATOM 0 HA ASN A 59 -5.809 -4.637 1.677 1.00 15.00 H new ATOM 0 HB2 ASN A 59 -8.313 -4.169 2.035 1.00 15.00 H new ATOM 0 HB3 ASN A 59 -8.432 -5.824 2.598 1.00 15.00 H new ATOM 0 HD21 ASN A 59 -7.639 -3.295 5.395 1.00 15.00 H new ATOM 0 HD22 ASN A 59 -8.767 -3.225 4.037 1.00 15.00 H new ATOM 908 N PRO A 60 -4.785 -7.018 1.643 1.00 15.00 N ATOM 909 CA PRO A 60 -4.150 -8.290 1.959 1.00 15.00 C ATOM 910 C PRO A 60 -3.577 -8.331 3.374 1.00 15.00 C ATOM 911 O PRO A 60 -2.903 -9.289 3.743 1.00 15.00 O ATOM 912 CB PRO A 60 -3.033 -8.369 0.920 1.00 15.00 C ATOM 913 CG PRO A 60 -2.652 -6.954 0.639 1.00 15.00 C ATOM 914 CD PRO A 60 -3.862 -6.103 0.941 1.00 15.00 C ATOM 0 HA PRO A 60 -4.852 -9.123 1.928 1.00 15.00 H new ATOM 0 HB2 PRO A 60 -2.183 -8.937 1.299 1.00 15.00 H new ATOM 0 HB3 PRO A 60 -3.374 -8.871 0.015 1.00 15.00 H new ATOM 0 HG2 PRO A 60 -1.805 -6.653 1.256 1.00 15.00 H new ATOM 0 HG3 PRO A 60 -2.347 -6.836 -0.401 1.00 15.00 H new ATOM 0 HD2 PRO A 60 -3.601 -5.247 1.563 1.00 15.00 H new ATOM 0 HD3 PRO A 60 -4.309 -5.709 0.028 1.00 15.00 H new ATOM 922 N ASP A 61 -3.836 -7.290 4.159 1.00 15.00 N ATOM 923 CA ASP A 61 -3.328 -7.232 5.529 1.00 15.00 C ATOM 924 C ASP A 61 -4.458 -7.360 6.542 1.00 15.00 C ATOM 925 O ASP A 61 -4.215 -7.590 7.727 1.00 15.00 O ATOM 926 CB ASP A 61 -2.565 -5.930 5.778 1.00 15.00 C ATOM 927 CG ASP A 61 -1.664 -6.027 6.996 1.00 15.00 C ATOM 928 OD1 ASP A 61 -1.730 -5.138 7.865 1.00 15.00 O ATOM 929 OD2 ASP A 61 -0.893 -7.005 7.094 1.00 15.00 O1- ATOM 0 H ASP A 61 -4.389 -6.481 3.875 1.00 15.00 H new ATOM 0 HA ASP A 61 -2.646 -8.073 5.655 1.00 15.00 H new ATOM 0 HB2 ASP A 61 -1.965 -5.687 4.901 1.00 15.00 H new ATOM 0 HB3 ASP A 61 -3.274 -5.114 5.915 1.00 15.00 H new ATOM 934 N ARG A 62 -5.694 -7.209 6.062 1.00 15.00 N ATOM 935 CA ARG A 62 -6.885 -7.305 6.907 1.00 15.00 C ATOM 936 C ARG A 62 -6.893 -6.197 7.961 1.00 15.00 C ATOM 937 O ARG A 62 -7.342 -6.405 9.091 1.00 15.00 O ATOM 938 CB ARG A 62 -6.968 -8.677 7.593 1.00 15.00 C ATOM 939 CG ARG A 62 -6.689 -9.849 6.668 1.00 15.00 C ATOM 940 CD ARG A 62 -6.859 -11.179 7.384 1.00 15.00 C ATOM 941 NE ARG A 62 -5.987 -11.297 8.551 1.00 15.00 N ATOM 942 CZ ARG A 62 -5.803 -12.421 9.237 1.00 15.00 C ATOM 943 NH1 ARG A 62 -6.434 -13.534 8.880 1.00 15.00 N1+ ATOM 944 NH2 ARG A 62 -4.995 -12.422 10.288 1.00 15.00 N ATOM 0 H ARG A 62 -5.897 -7.018 5.081 1.00 15.00 H new ATOM 0 HA ARG A 62 -7.756 -7.186 6.262 1.00 15.00 H new ATOM 0 HB2 ARG A 62 -6.257 -8.702 8.419 1.00 15.00 H new ATOM 0 HB3 ARG A 62 -7.962 -8.796 8.024 1.00 15.00 H new ATOM 0 HG2 ARG A 62 -7.363 -9.807 5.813 1.00 15.00 H new ATOM 0 HG3 ARG A 62 -5.674 -9.772 6.278 1.00 15.00 H new ATOM 0 HD2 ARG A 62 -7.897 -11.291 7.696 1.00 15.00 H new ATOM 0 HD3 ARG A 62 -6.646 -11.992 6.690 1.00 15.00 H new ATOM 0 HE ARG A 62 -5.487 -10.463 8.859 1.00 15.00 H new ATOM 0 HH11 ARG A 62 -7.063 -13.529 8.077 1.00 15.00 H new ATOM 0 HH12 ARG A 62 -6.290 -14.394 9.409 1.00 15.00 H new ATOM 0 HH21 ARG A 62 -4.519 -11.564 10.566 1.00 15.00 H new ATOM 0 HH22 ARG A 62 -4.849 -13.281 10.819 1.00 15.00 H new ATOM 958 N ASP A 63 -6.407 -5.019 7.580 1.00 15.00 N ATOM 959 CA ASP A 63 -6.349 -3.876 8.487 1.00 15.00 C ATOM 960 C ASP A 63 -7.716 -3.197 8.598 1.00 15.00 C ATOM 961 O ASP A 63 -8.719 -3.715 8.109 1.00 15.00 O ATOM 962 CB ASP A 63 -5.288 -2.872 8.026 1.00 15.00 C ATOM 963 CG ASP A 63 -5.806 -1.926 6.968 1.00 15.00 C ATOM 964 OD1 ASP A 63 -6.127 -0.764 7.309 1.00 15.00 O ATOM 965 OD2 ASP A 63 -5.916 -2.354 5.807 1.00 15.00 O1- ATOM 0 H ASP A 63 -6.046 -4.830 6.645 1.00 15.00 H new ATOM 0 HA ASP A 63 -6.070 -4.244 9.474 1.00 15.00 H new ATOM 0 HB2 ASP A 63 -4.940 -2.297 8.884 1.00 15.00 H new ATOM 0 HB3 ASP A 63 -4.427 -3.413 7.634 1.00 15.00 H new ATOM 970 N LEU A 64 -7.741 -2.048 9.261 1.00 15.00 N ATOM 971 CA LEU A 64 -8.967 -1.280 9.483 1.00 15.00 C ATOM 972 C LEU A 64 -9.756 -1.017 8.195 1.00 15.00 C ATOM 973 O LEU A 64 -10.977 -1.201 8.171 1.00 15.00 O ATOM 974 CB LEU A 64 -8.632 0.058 10.149 1.00 15.00 C ATOM 975 CG LEU A 64 -8.727 0.079 11.676 1.00 15.00 C ATOM 976 CD1 LEU A 64 -7.621 -0.753 12.302 1.00 15.00 C ATOM 977 CD2 LEU A 64 -8.667 1.509 12.184 1.00 15.00 C ATOM 0 H LEU A 64 -6.909 -1.617 9.663 1.00 15.00 H new ATOM 0 HA LEU A 64 -9.598 -1.887 10.132 1.00 15.00 H new ATOM 0 HB2 LEU A 64 -7.620 0.343 9.862 1.00 15.00 H new ATOM 0 HB3 LEU A 64 -9.302 0.820 9.751 1.00 15.00 H new ATOM 0 HG LEU A 64 -9.682 -0.359 11.965 1.00 15.00 H new ATOM 0 HD11 LEU A 64 -7.712 -0.721 13.388 1.00 15.00 H new ATOM 0 HD12 LEU A 64 -7.705 -1.785 11.961 1.00 15.00 H new ATOM 0 HD13 LEU A 64 -6.652 -0.351 12.007 1.00 15.00 H new ATOM 0 HD21 LEU A 64 -8.735 1.512 13.272 1.00 15.00 H new ATOM 0 HD22 LEU A 64 -7.725 1.964 11.879 1.00 15.00 H new ATOM 0 HD23 LEU A 64 -9.497 2.079 11.767 1.00 15.00 H new ATOM 989 N ARG A 65 -9.075 -0.587 7.137 1.00 15.00 N ATOM 990 CA ARG A 65 -9.754 -0.282 5.875 1.00 15.00 C ATOM 991 C ARG A 65 -8.822 -0.457 4.679 1.00 15.00 C ATOM 992 O ARG A 65 -7.629 -0.192 4.775 1.00 15.00 O ATOM 993 CB ARG A 65 -10.313 1.144 5.907 1.00 15.00 C ATOM 994 CG ARG A 65 -9.355 2.166 6.494 1.00 15.00 C ATOM 995 CD ARG A 65 -10.103 3.333 7.121 1.00 15.00 C ATOM 996 NE ARG A 65 -10.446 4.361 6.141 1.00 15.00 N ATOM 997 CZ ARG A 65 -11.656 4.911 6.023 1.00 15.00 C ATOM 998 NH1 ARG A 65 -12.650 4.533 6.822 1.00 15.00 N1+ ATOM 999 NH2 ARG A 65 -11.868 5.844 5.106 1.00 15.00 N ATOM 0 H ARG A 65 -8.065 -0.442 7.124 1.00 15.00 H new ATOM 0 HA ARG A 65 -10.577 -0.988 5.761 1.00 15.00 H new ATOM 0 HB2 ARG A 65 -10.573 1.445 4.892 1.00 15.00 H new ATOM 0 HB3 ARG A 65 -11.236 1.149 6.488 1.00 15.00 H new ATOM 0 HG2 ARG A 65 -8.727 1.688 7.246 1.00 15.00 H new ATOM 0 HG3 ARG A 65 -8.691 2.535 5.712 1.00 15.00 H new ATOM 0 HD2 ARG A 65 -11.014 2.966 7.594 1.00 15.00 H new ATOM 0 HD3 ARG A 65 -9.491 3.774 7.908 1.00 15.00 H new ATOM 0 HE ARG A 65 -9.713 4.679 5.506 1.00 15.00 H new ATOM 0 HH11 ARG A 65 -12.490 3.818 7.531 1.00 15.00 H new ATOM 0 HH12 ARG A 65 -13.572 4.958 6.725 1.00 15.00 H new ATOM 0 HH21 ARG A 65 -11.108 6.139 4.494 1.00 15.00 H new ATOM 0 HH22 ARG A 65 -12.792 6.267 5.013 1.00 15.00 H new ATOM 1013 N PRO A 66 -9.372 -0.893 3.528 1.00 15.00 N ATOM 1014 CA PRO A 66 -8.595 -1.125 2.302 1.00 15.00 C ATOM 1015 C PRO A 66 -7.718 0.055 1.893 1.00 15.00 C ATOM 1016 O PRO A 66 -8.105 1.224 2.012 1.00 15.00 O ATOM 1017 CB PRO A 66 -9.667 -1.379 1.243 1.00 15.00 C ATOM 1018 CG PRO A 66 -10.836 -1.895 2.002 1.00 15.00 C ATOM 1019 CD PRO A 66 -10.805 -1.190 3.329 1.00 15.00 C ATOM 0 HA PRO A 66 -7.891 -1.946 2.438 1.00 15.00 H new ATOM 0 HB2 PRO A 66 -9.917 -0.464 0.706 1.00 15.00 H new ATOM 0 HB3 PRO A 66 -9.327 -2.102 0.501 1.00 15.00 H new ATOM 0 HG2 PRO A 66 -11.767 -1.692 1.473 1.00 15.00 H new ATOM 0 HG3 PRO A 66 -10.772 -2.975 2.131 1.00 15.00 H new ATOM 0 HD2 PRO A 66 -11.405 -0.280 3.314 1.00 15.00 H new ATOM 0 HD3 PRO A 66 -11.199 -1.819 4.127 1.00 15.00 H new ATOM 1027 N TRP A 67 -6.541 -0.277 1.391 1.00 15.00 N ATOM 1028 CA TRP A 67 -5.570 0.708 0.949 1.00 15.00 C ATOM 1029 C TRP A 67 -5.072 0.341 -0.439 1.00 15.00 C ATOM 1030 O TRP A 67 -5.465 -0.687 -0.996 1.00 15.00 O ATOM 1031 CB TRP A 67 -4.394 0.778 1.929 1.00 15.00 C ATOM 1032 CG TRP A 67 -3.906 -0.567 2.379 1.00 15.00 C ATOM 1033 CD1 TRP A 67 -4.428 -1.327 3.384 1.00 15.00 C ATOM 1034 CD2 TRP A 67 -2.801 -1.305 1.847 1.00 15.00 C ATOM 1035 NE1 TRP A 67 -3.722 -2.497 3.505 1.00 15.00 N ATOM 1036 CE2 TRP A 67 -2.718 -2.508 2.573 1.00 15.00 C ATOM 1037 CE3 TRP A 67 -1.878 -1.068 0.825 1.00 15.00 C ATOM 1038 CZ2 TRP A 67 -1.746 -3.469 2.311 1.00 15.00 C ATOM 1039 CZ3 TRP A 67 -0.915 -2.023 0.567 1.00 15.00 C ATOM 1040 CH2 TRP A 67 -0.855 -3.210 1.307 1.00 15.00 C ATOM 0 H TRP A 67 -6.231 -1.242 1.278 1.00 15.00 H new ATOM 0 HA TRP A 67 -6.048 1.687 0.915 1.00 15.00 H new ATOM 0 HB2 TRP A 67 -3.571 1.315 1.458 1.00 15.00 H new ATOM 0 HB3 TRP A 67 -4.694 1.357 2.802 1.00 15.00 H new ATOM 0 HD1 TRP A 67 -5.274 -1.048 3.995 1.00 15.00 H new ATOM 0 HE1 TRP A 67 -3.913 -3.238 4.179 1.00 15.00 H new ATOM 0 HE3 TRP A 67 -1.917 -0.156 0.248 1.00 15.00 H new ATOM 0 HZ2 TRP A 67 -1.697 -4.386 2.880 1.00 15.00 H new ATOM 0 HZ3 TRP A 67 -0.195 -1.851 -0.220 1.00 15.00 H new ATOM 0 HH2 TRP A 67 -0.089 -3.936 1.080 1.00 15.00 H new ATOM 1051 N CYS A 68 -4.226 1.183 -1.004 1.00 15.00 N ATOM 1052 CA CYS A 68 -3.683 0.934 -2.326 1.00 15.00 C ATOM 1053 C CYS A 68 -2.435 1.772 -2.570 1.00 15.00 C ATOM 1054 O CYS A 68 -2.293 2.867 -2.022 1.00 15.00 O ATOM 1055 CB CYS A 68 -4.734 1.228 -3.402 1.00 15.00 C ATOM 1056 SG CYS A 68 -6.014 2.407 -2.899 1.00 15.00 S ATOM 0 H CYS A 68 -3.900 2.045 -0.568 1.00 15.00 H new ATOM 0 HA CYS A 68 -3.406 -0.119 -2.382 1.00 15.00 H new ATOM 0 HB2 CYS A 68 -4.230 1.614 -4.288 1.00 15.00 H new ATOM 0 HB3 CYS A 68 -5.213 0.292 -3.690 1.00 15.00 H new ATOM 0 HG CYS A 68 -7.031 1.761 -2.411 1.00 15.00 H new ATOM 1062 N PHE A 69 -1.521 1.237 -3.371 1.00 15.00 N ATOM 1063 CA PHE A 69 -0.292 1.940 -3.704 1.00 15.00 C ATOM 1064 C PHE A 69 -0.599 3.053 -4.693 1.00 15.00 C ATOM 1065 O PHE A 69 -1.335 2.851 -5.652 1.00 15.00 O ATOM 1066 CB PHE A 69 0.742 0.977 -4.295 1.00 15.00 C ATOM 1067 CG PHE A 69 1.657 0.367 -3.270 1.00 15.00 C ATOM 1068 CD1 PHE A 69 2.934 0.867 -3.074 1.00 15.00 C ATOM 1069 CD2 PHE A 69 1.236 -0.703 -2.497 1.00 15.00 C ATOM 1070 CE1 PHE A 69 3.776 0.311 -2.131 1.00 15.00 C ATOM 1071 CE2 PHE A 69 2.075 -1.265 -1.551 1.00 15.00 C ATOM 1072 CZ PHE A 69 3.346 -0.756 -1.367 1.00 15.00 C ATOM 0 H PHE A 69 -1.610 0.317 -3.802 1.00 15.00 H new ATOM 0 HA PHE A 69 0.127 2.368 -2.794 1.00 15.00 H new ATOM 0 HB2 PHE A 69 0.221 0.179 -4.824 1.00 15.00 H new ATOM 0 HB3 PHE A 69 1.342 1.510 -5.033 1.00 15.00 H new ATOM 0 HD1 PHE A 69 3.276 1.703 -3.667 1.00 15.00 H new ATOM 0 HD2 PHE A 69 0.242 -1.103 -2.634 1.00 15.00 H new ATOM 0 HE1 PHE A 69 4.770 0.710 -1.991 1.00 15.00 H new ATOM 0 HE2 PHE A 69 1.736 -2.101 -0.957 1.00 15.00 H new ATOM 0 HZ PHE A 69 4.002 -1.191 -0.628 1.00 15.00 H new ATOM 1082 N THR A 70 -0.046 4.221 -4.459 1.00 15.00 N ATOM 1083 CA THR A 70 -0.277 5.357 -5.326 1.00 15.00 C ATOM 1084 C THR A 70 0.824 5.472 -6.372 1.00 15.00 C ATOM 1085 O THR A 70 1.785 4.706 -6.357 1.00 15.00 O ATOM 1086 CB THR A 70 -0.355 6.650 -4.500 1.00 15.00 C ATOM 1087 OG1 THR A 70 0.310 6.460 -3.241 1.00 15.00 O ATOM 1088 CG2 THR A 70 -1.800 7.045 -4.253 1.00 15.00 C ATOM 0 H THR A 70 0.572 4.411 -3.670 1.00 15.00 H new ATOM 0 HA THR A 70 -1.227 5.206 -5.839 1.00 15.00 H new ATOM 0 HB THR A 70 0.134 7.447 -5.060 1.00 15.00 H new ATOM 0 HG1 THR A 70 1.280 6.503 -3.374 1.00 15.00 H new ATOM 0 HG21 THR A 70 -1.831 7.963 -3.666 1.00 15.00 H new ATOM 0 HG22 THR A 70 -2.301 7.207 -5.207 1.00 15.00 H new ATOM 0 HG23 THR A 70 -2.307 6.249 -3.708 1.00 15.00 H new ATOM 1096 N THR A 71 0.681 6.409 -7.295 1.00 15.00 N ATOM 1097 CA THR A 71 1.690 6.596 -8.328 1.00 15.00 C ATOM 1098 C THR A 71 2.488 7.870 -8.067 1.00 15.00 C ATOM 1099 O THR A 71 3.183 8.381 -8.949 1.00 15.00 O ATOM 1100 CB THR A 71 1.061 6.649 -9.733 1.00 15.00 C ATOM 1101 OG1 THR A 71 -0.333 6.306 -9.666 1.00 15.00 O ATOM 1102 CG2 THR A 71 1.776 5.689 -10.673 1.00 15.00 C ATOM 0 H THR A 71 -0.114 7.046 -7.352 1.00 15.00 H new ATOM 0 HA THR A 71 2.360 5.737 -8.291 1.00 15.00 H new ATOM 0 HB THR A 71 1.164 7.664 -10.116 1.00 15.00 H new ATOM 0 HG1 THR A 71 -0.723 6.345 -10.564 1.00 15.00 H new ATOM 0 HG21 THR A 71 1.319 5.739 -11.661 1.00 15.00 H new ATOM 0 HG22 THR A 71 2.828 5.966 -10.745 1.00 15.00 H new ATOM 0 HG23 THR A 71 1.694 4.673 -10.287 1.00 15.00 H new ATOM 1110 N ASP A 72 2.396 8.361 -6.838 1.00 15.00 N ATOM 1111 CA ASP A 72 3.093 9.574 -6.436 1.00 15.00 C ATOM 1112 C ASP A 72 4.421 9.224 -5.773 1.00 15.00 C ATOM 1113 O ASP A 72 4.478 8.336 -4.929 1.00 15.00 O ATOM 1114 CB ASP A 72 2.227 10.396 -5.474 1.00 15.00 C ATOM 1115 CG ASP A 72 1.303 11.351 -6.201 1.00 15.00 C ATOM 1116 OD1 ASP A 72 1.617 12.558 -6.265 1.00 15.00 O ATOM 1117 OD2 ASP A 72 0.265 10.899 -6.722 1.00 15.00 O1- ATOM 0 H ASP A 72 1.840 7.933 -6.097 1.00 15.00 H new ATOM 0 HA ASP A 72 3.289 10.171 -7.327 1.00 15.00 H new ATOM 0 HB2 ASP A 72 1.635 9.721 -4.856 1.00 15.00 H new ATOM 0 HB3 ASP A 72 2.872 10.961 -4.801 1.00 15.00 H new ATOM 1122 N PRO A 73 5.509 9.917 -6.136 1.00 15.00 N ATOM 1123 CA PRO A 73 6.836 9.653 -5.565 1.00 15.00 C ATOM 1124 C PRO A 73 6.914 9.988 -4.077 1.00 15.00 C ATOM 1125 O PRO A 73 7.694 9.390 -3.335 1.00 15.00 O ATOM 1126 CB PRO A 73 7.768 10.575 -6.364 1.00 15.00 C ATOM 1127 CG PRO A 73 6.982 11.031 -7.546 1.00 15.00 C ATOM 1128 CD PRO A 73 5.543 11.003 -7.129 1.00 15.00 C ATOM 0 HA PRO A 73 7.095 8.597 -5.634 1.00 15.00 H new ATOM 0 HB2 PRO A 73 8.090 11.423 -5.759 1.00 15.00 H new ATOM 0 HB3 PRO A 73 8.668 10.045 -6.675 1.00 15.00 H new ATOM 0 HG2 PRO A 73 7.280 12.035 -7.848 1.00 15.00 H new ATOM 0 HG3 PRO A 73 7.152 10.378 -8.402 1.00 15.00 H new ATOM 0 HD2 PRO A 73 5.229 11.954 -6.699 1.00 15.00 H new ATOM 0 HD3 PRO A 73 4.882 10.801 -7.972 1.00 15.00 H new ATOM 1136 N ASN A 74 6.091 10.935 -3.646 1.00 15.00 N ATOM 1137 CA ASN A 74 6.083 11.365 -2.252 1.00 15.00 C ATOM 1138 C ASN A 74 5.146 10.511 -1.400 1.00 15.00 C ATOM 1139 O ASN A 74 5.137 10.632 -0.176 1.00 15.00 O ATOM 1140 CB ASN A 74 5.683 12.842 -2.149 1.00 15.00 C ATOM 1141 CG ASN A 74 4.274 13.105 -2.648 1.00 15.00 C ATOM 1142 OD1 ASN A 74 3.302 12.940 -1.913 1.00 15.00 O ATOM 1143 ND2 ASN A 74 4.155 13.534 -3.895 1.00 15.00 N ATOM 0 H ASN A 74 5.420 11.421 -4.241 1.00 15.00 H new ATOM 0 HA ASN A 74 7.095 11.238 -1.867 1.00 15.00 H new ATOM 0 HB2 ASN A 74 5.762 13.164 -1.111 1.00 15.00 H new ATOM 0 HB3 ASN A 74 6.386 13.445 -2.724 1.00 15.00 H new ATOM 0 HD21 ASN A 74 3.232 13.740 -4.277 1.00 15.00 H new ATOM 0 HD22 ASN A 74 4.986 13.658 -4.473 1.00 15.00 H new ATOM 1150 N LYS A 75 4.367 9.648 -2.040 1.00 15.00 N ATOM 1151 CA LYS A 75 3.433 8.789 -1.321 1.00 15.00 C ATOM 1152 C LYS A 75 3.394 7.404 -1.951 1.00 15.00 C ATOM 1153 O LYS A 75 2.853 7.223 -3.040 1.00 15.00 O ATOM 1154 CB LYS A 75 2.028 9.403 -1.315 1.00 15.00 C ATOM 1155 CG LYS A 75 1.376 9.450 0.060 1.00 15.00 C ATOM 1156 CD LYS A 75 2.016 10.511 0.944 1.00 15.00 C ATOM 1157 CE LYS A 75 1.254 10.692 2.248 1.00 15.00 C ATOM 1158 NZ LYS A 75 1.342 9.492 3.120 1.00 15.00 N1+ ATOM 0 H LYS A 75 4.363 9.524 -3.052 1.00 15.00 H new ATOM 0 HA LYS A 75 3.777 8.698 -0.291 1.00 15.00 H new ATOM 0 HB2 LYS A 75 2.084 10.416 -1.713 1.00 15.00 H new ATOM 0 HB3 LYS A 75 1.390 8.831 -1.988 1.00 15.00 H new ATOM 0 HG2 LYS A 75 0.312 9.658 -0.048 1.00 15.00 H new ATOM 0 HG3 LYS A 75 1.463 8.475 0.539 1.00 15.00 H new ATOM 0 HD2 LYS A 75 3.047 10.230 1.161 1.00 15.00 H new ATOM 0 HD3 LYS A 75 2.050 11.459 0.408 1.00 15.00 H new ATOM 0 HE2 LYS A 75 1.650 11.556 2.781 1.00 15.00 H new ATOM 0 HE3 LYS A 75 0.208 10.904 2.029 1.00 15.00 H new ATOM 0 HZ1 LYS A 75 1.624 9.780 4.079 1.00 15.00 H new ATOM 0 HZ2 LYS A 75 0.415 9.022 3.158 1.00 15.00 H new ATOM 0 HZ3 LYS A 75 2.048 8.833 2.734 1.00 15.00 H new ATOM 1172 N ARG A 76 3.957 6.430 -1.252 1.00 15.00 N ATOM 1173 CA ARG A 76 4.002 5.059 -1.750 1.00 15.00 C ATOM 1174 C ARG A 76 2.609 4.450 -1.820 1.00 15.00 C ATOM 1175 O ARG A 76 2.213 3.888 -2.841 1.00 15.00 O ATOM 1176 CB ARG A 76 4.894 4.194 -0.859 1.00 15.00 C ATOM 1177 CG ARG A 76 6.380 4.426 -1.074 1.00 15.00 C ATOM 1178 CD ARG A 76 7.220 3.532 -0.175 1.00 15.00 C ATOM 1179 NE ARG A 76 7.549 4.177 1.095 1.00 15.00 N ATOM 1180 CZ ARG A 76 8.765 4.609 1.420 1.00 15.00 C ATOM 1181 NH1 ARG A 76 9.780 4.465 0.570 1.00 15.00 N1+ ATOM 1182 NH2 ARG A 76 8.958 5.201 2.591 1.00 15.00 N ATOM 0 H ARG A 76 4.390 6.561 -0.338 1.00 15.00 H new ATOM 0 HA ARG A 76 4.418 5.089 -2.757 1.00 15.00 H new ATOM 0 HB2 ARG A 76 4.652 4.393 0.185 1.00 15.00 H new ATOM 0 HB3 ARG A 76 4.669 3.144 -1.044 1.00 15.00 H new ATOM 0 HG2 ARG A 76 6.632 4.234 -2.117 1.00 15.00 H new ATOM 0 HG3 ARG A 76 6.619 5.471 -0.875 1.00 15.00 H new ATOM 0 HD2 ARG A 76 6.680 2.605 0.019 1.00 15.00 H new ATOM 0 HD3 ARG A 76 8.141 3.262 -0.692 1.00 15.00 H new ATOM 0 HE ARG A 76 6.799 4.304 1.775 1.00 15.00 H new ATOM 0 HH11 ARG A 76 9.628 4.022 -0.336 1.00 15.00 H new ATOM 0 HH12 ARG A 76 10.710 4.798 0.825 1.00 15.00 H new ATOM 0 HH21 ARG A 76 8.177 5.323 3.236 1.00 15.00 H new ATOM 0 HH22 ARG A 76 9.887 5.535 2.847 1.00 15.00 H new ATOM 1196 N TRP A 77 1.872 4.565 -0.732 1.00 15.00 N ATOM 1197 CA TRP A 77 0.528 4.021 -0.663 1.00 15.00 C ATOM 1198 C TRP A 77 -0.337 4.888 0.234 1.00 15.00 C ATOM 1199 O TRP A 77 0.181 5.642 1.053 1.00 15.00 O ATOM 1200 CB TRP A 77 0.561 2.580 -0.132 1.00 15.00 C ATOM 1201 CG TRP A 77 1.171 2.456 1.234 1.00 15.00 C ATOM 1202 CD1 TRP A 77 2.493 2.309 1.533 1.00 15.00 C ATOM 1203 CD2 TRP A 77 0.473 2.467 2.487 1.00 15.00 C ATOM 1204 NE1 TRP A 77 2.663 2.234 2.894 1.00 15.00 N ATOM 1205 CE2 TRP A 77 1.437 2.331 3.501 1.00 15.00 C ATOM 1206 CE3 TRP A 77 -0.873 2.586 2.846 1.00 15.00 C ATOM 1207 CZ2 TRP A 77 1.096 2.306 4.852 1.00 15.00 C ATOM 1208 CZ3 TRP A 77 -1.209 2.562 4.186 1.00 15.00 C ATOM 1209 CH2 TRP A 77 -0.229 2.425 5.175 1.00 15.00 C ATOM 0 H TRP A 77 2.182 5.032 0.120 1.00 15.00 H new ATOM 0 HA TRP A 77 0.102 4.012 -1.666 1.00 15.00 H new ATOM 0 HB2 TRP A 77 -0.456 2.189 -0.103 1.00 15.00 H new ATOM 0 HB3 TRP A 77 1.122 1.958 -0.829 1.00 15.00 H new ATOM 0 HD1 TRP A 77 3.290 2.259 0.806 1.00 15.00 H new ATOM 0 HE1 TRP A 77 3.556 2.124 3.375 1.00 15.00 H new ATOM 0 HE3 TRP A 77 -1.636 2.695 2.090 1.00 15.00 H new ATOM 0 HZ2 TRP A 77 1.850 2.197 5.617 1.00 15.00 H new ATOM 0 HZ3 TRP A 77 -2.246 2.651 4.475 1.00 15.00 H new ATOM 0 HH2 TRP A 77 -0.524 2.413 6.214 1.00 15.00 H new ATOM 1220 N GLU A 78 -1.645 4.784 0.075 1.00 15.00 N ATOM 1221 CA GLU A 78 -2.582 5.553 0.879 1.00 15.00 C ATOM 1222 C GLU A 78 -3.843 4.741 1.134 1.00 15.00 C ATOM 1223 O GLU A 78 -4.014 3.654 0.578 1.00 15.00 O ATOM 1224 CB GLU A 78 -2.932 6.876 0.194 1.00 15.00 C ATOM 1225 CG GLU A 78 -1.969 8.009 0.524 1.00 15.00 C ATOM 1226 CD GLU A 78 -1.871 8.285 2.012 1.00 15.00 C ATOM 1227 OE1 GLU A 78 -0.820 7.980 2.615 1.00 15.00 O ATOM 1228 OE2 GLU A 78 -2.846 8.808 2.587 1.00 15.00 O1- ATOM 0 H GLU A 78 -2.086 4.169 -0.609 1.00 15.00 H new ATOM 0 HA GLU A 78 -2.108 5.780 1.834 1.00 15.00 H new ATOM 0 HB2 GLU A 78 -2.944 6.724 -0.885 1.00 15.00 H new ATOM 0 HB3 GLU A 78 -3.940 7.171 0.486 1.00 15.00 H new ATOM 0 HG2 GLU A 78 -0.980 7.762 0.139 1.00 15.00 H new ATOM 0 HG3 GLU A 78 -2.293 8.915 0.012 1.00 15.00 H new ATOM 1235 N TYR A 79 -4.720 5.273 1.967 1.00 15.00 N ATOM 1236 CA TYR A 79 -5.959 4.598 2.318 1.00 15.00 C ATOM 1237 C TYR A 79 -7.115 5.072 1.443 1.00 15.00 C ATOM 1238 O TYR A 79 -7.043 6.128 0.806 1.00 15.00 O ATOM 1239 CB TYR A 79 -6.302 4.839 3.787 1.00 15.00 C ATOM 1240 CG TYR A 79 -5.448 4.063 4.768 1.00 15.00 C ATOM 1241 CD1 TYR A 79 -4.489 4.706 5.538 1.00 15.00 C ATOM 1242 CD2 TYR A 79 -5.614 2.693 4.934 1.00 15.00 C ATOM 1243 CE1 TYR A 79 -3.712 4.007 6.444 1.00 15.00 C ATOM 1244 CE2 TYR A 79 -4.841 1.986 5.837 1.00 15.00 C ATOM 1245 CZ TYR A 79 -3.894 2.646 6.593 1.00 15.00 C ATOM 1246 OH TYR A 79 -3.127 1.944 7.500 1.00 15.00 O ATOM 0 H TYR A 79 -4.596 6.180 2.417 1.00 15.00 H new ATOM 0 HA TYR A 79 -5.810 3.531 2.150 1.00 15.00 H new ATOM 0 HB2 TYR A 79 -6.202 5.903 4.000 1.00 15.00 H new ATOM 0 HB3 TYR A 79 -7.348 4.578 3.950 1.00 15.00 H new ATOM 0 HD1 TYR A 79 -4.347 5.771 5.428 1.00 15.00 H new ATOM 0 HD2 TYR A 79 -6.358 2.173 4.349 1.00 15.00 H new ATOM 0 HE1 TYR A 79 -2.967 4.523 7.032 1.00 15.00 H new ATOM 0 HE2 TYR A 79 -4.978 0.921 5.950 1.00 15.00 H new ATOM 0 HH TYR A 79 -2.553 1.310 7.022 1.00 15.00 H new ATOM 1256 N CYS A 80 -8.177 4.285 1.409 1.00 15.00 N ATOM 1257 CA CYS A 80 -9.358 4.625 0.632 1.00 15.00 C ATOM 1258 C CYS A 80 -10.544 4.796 1.575 1.00 15.00 C ATOM 1259 O CYS A 80 -10.502 4.331 2.716 1.00 15.00 O ATOM 1260 CB CYS A 80 -9.646 3.534 -0.404 1.00 15.00 C ATOM 1261 SG CYS A 80 -10.709 4.070 -1.765 1.00 15.00 S ATOM 0 H CYS A 80 -8.246 3.401 1.913 1.00 15.00 H new ATOM 0 HA CYS A 80 -9.186 5.560 0.098 1.00 15.00 H new ATOM 0 HB2 CYS A 80 -8.701 3.179 -0.814 1.00 15.00 H new ATOM 0 HB3 CYS A 80 -10.115 2.687 0.097 1.00 15.00 H new ATOM 0 HG CYS A 80 -9.977 4.355 -2.801 1.00 15.00 H new ATOM 1267 N ASP A 81 -11.586 5.481 1.121 1.00 15.00 N ATOM 1268 CA ASP A 81 -12.758 5.711 1.958 1.00 15.00 C ATOM 1269 C ASP A 81 -13.963 4.946 1.440 1.00 15.00 C ATOM 1270 O ASP A 81 -14.506 5.259 0.380 1.00 15.00 O ATOM 1271 CB ASP A 81 -13.092 7.202 2.049 1.00 15.00 C ATOM 1272 CG ASP A 81 -14.215 7.469 3.031 1.00 15.00 C ATOM 1273 OD1 ASP A 81 -14.025 7.198 4.238 1.00 15.00 O ATOM 1274 OD2 ASP A 81 -15.285 7.951 2.608 1.00 15.00 O1- ATOM 0 H ASP A 81 -11.645 5.884 0.186 1.00 15.00 H new ATOM 0 HA ASP A 81 -12.515 5.346 2.956 1.00 15.00 H new ATOM 0 HB2 ASP A 81 -12.204 7.755 2.354 1.00 15.00 H new ATOM 0 HB3 ASP A 81 -13.375 7.572 1.064 1.00 15.00 H new ATOM 1279 N ILE A 82 -14.372 3.938 2.193 1.00 15.00 N ATOM 1280 CA ILE A 82 -15.506 3.118 1.818 1.00 15.00 C ATOM 1281 C ILE A 82 -16.539 3.113 2.942 1.00 15.00 C ATOM 1282 O ILE A 82 -16.191 2.911 4.106 1.00 15.00 O ATOM 1283 CB ILE A 82 -15.063 1.670 1.509 1.00 15.00 C ATOM 1284 CG1 ILE A 82 -13.913 1.669 0.501 1.00 15.00 C ATOM 1285 CG2 ILE A 82 -16.229 0.851 0.977 1.00 15.00 C ATOM 1286 CD1 ILE A 82 -13.333 0.295 0.253 1.00 15.00 C ATOM 0 H ILE A 82 -13.931 3.669 3.072 1.00 15.00 H new ATOM 0 HA ILE A 82 -15.951 3.542 0.918 1.00 15.00 H new ATOM 0 HB ILE A 82 -14.718 1.214 2.437 1.00 15.00 H new ATOM 0 HG12 ILE A 82 -14.267 2.082 -0.444 1.00 15.00 H new ATOM 0 HG13 ILE A 82 -13.124 2.329 0.861 1.00 15.00 H new ATOM 0 HG21 ILE A 82 -15.894 -0.165 0.766 1.00 15.00 H new ATOM 0 HG22 ILE A 82 -17.024 0.824 1.722 1.00 15.00 H new ATOM 0 HG23 ILE A 82 -16.605 1.306 0.061 1.00 15.00 H new ATOM 0 HD11 ILE A 82 -12.522 0.368 -0.472 1.00 15.00 H new ATOM 0 HD12 ILE A 82 -12.948 -0.112 1.188 1.00 15.00 H new ATOM 0 HD13 ILE A 82 -14.110 -0.363 -0.137 1.00 15.00 H new ATOM 1298 N PRO A 83 -17.815 3.376 2.619 1.00 15.00 N ATOM 1299 CA PRO A 83 -18.897 3.386 3.610 1.00 15.00 C ATOM 1300 C PRO A 83 -19.082 2.021 4.272 1.00 15.00 C ATOM 1301 O PRO A 83 -19.305 1.013 3.596 1.00 15.00 O ATOM 1302 CB PRO A 83 -20.137 3.764 2.795 1.00 15.00 C ATOM 1303 CG PRO A 83 -19.781 3.489 1.378 1.00 15.00 C ATOM 1304 CD PRO A 83 -18.303 3.706 1.270 1.00 15.00 C ATOM 0 HA PRO A 83 -18.693 4.076 4.428 1.00 15.00 H new ATOM 0 HB2 PRO A 83 -21.003 3.177 3.103 1.00 15.00 H new ATOM 0 HB3 PRO A 83 -20.396 4.813 2.938 1.00 15.00 H new ATOM 0 HG2 PRO A 83 -20.046 2.469 1.101 1.00 15.00 H new ATOM 0 HG3 PRO A 83 -20.322 4.153 0.704 1.00 15.00 H new ATOM 0 HD2 PRO A 83 -17.856 3.063 0.512 1.00 15.00 H new ATOM 0 HD3 PRO A 83 -18.066 4.734 0.996 1.00 15.00 H new ATOM 1312 N ARG A 84 -18.996 1.995 5.592 1.00 15.00 N ATOM 1313 CA ARG A 84 -19.129 0.757 6.344 1.00 15.00 C ATOM 1314 C ARG A 84 -20.495 0.668 7.013 1.00 15.00 C ATOM 1315 O ARG A 84 -21.180 1.677 7.185 1.00 15.00 O ATOM 1316 CB ARG A 84 -18.018 0.666 7.396 1.00 15.00 C ATOM 1317 CG ARG A 84 -18.233 1.585 8.594 1.00 15.00 C ATOM 1318 CD ARG A 84 -16.924 2.141 9.129 1.00 15.00 C ATOM 1319 NE ARG A 84 -16.550 3.392 8.472 1.00 15.00 N ATOM 1320 CZ ARG A 84 -15.956 4.406 9.095 1.00 15.00 C ATOM 1321 NH1 ARG A 84 -15.678 4.330 10.391 1.00 15.00 N1+ ATOM 1322 NH2 ARG A 84 -15.652 5.508 8.423 1.00 15.00 N ATOM 0 H ARG A 84 -18.834 2.821 6.168 1.00 15.00 H new ATOM 0 HA ARG A 84 -19.038 -0.079 5.650 1.00 15.00 H new ATOM 0 HB2 ARG A 84 -17.945 -0.363 7.747 1.00 15.00 H new ATOM 0 HB3 ARG A 84 -17.065 0.911 6.927 1.00 15.00 H new ATOM 0 HG2 ARG A 84 -18.886 2.409 8.306 1.00 15.00 H new ATOM 0 HG3 ARG A 84 -18.743 1.036 9.385 1.00 15.00 H new ATOM 0 HD2 ARG A 84 -17.013 2.308 10.202 1.00 15.00 H new ATOM 0 HD3 ARG A 84 -16.132 1.406 8.985 1.00 15.00 H new ATOM 0 HE ARG A 84 -16.756 3.493 7.478 1.00 15.00 H new ATOM 0 HH11 ARG A 84 -15.920 3.490 10.916 1.00 15.00 H new ATOM 0 HH12 ARG A 84 -15.222 5.112 10.862 1.00 15.00 H new ATOM 0 HH21 ARG A 84 -15.874 5.577 7.430 1.00 15.00 H new ATOM 0 HH22 ARG A 84 -15.196 6.286 8.899 1.00 15.00 H new ATOM 1336 N CYS A 85 -20.895 -0.546 7.361 1.00 15.00 N ATOM 1337 CA CYS A 85 -22.170 -0.769 8.033 1.00 15.00 C ATOM 1338 C CYS A 85 -22.090 -0.306 9.489 1.00 15.00 C ATOM 1339 O CYS A 85 -20.999 -0.087 10.019 1.00 15.00 O ATOM 1340 CB CYS A 85 -22.547 -2.250 7.981 1.00 15.00 C ATOM 1341 SG CYS A 85 -22.544 -2.953 6.317 1.00 15.00 S ATOM 0 H CYS A 85 -20.355 -1.394 7.190 1.00 15.00 H new ATOM 0 HA CYS A 85 -22.937 -0.191 7.518 1.00 15.00 H new ATOM 0 HB2 CYS A 85 -21.851 -2.813 8.603 1.00 15.00 H new ATOM 0 HB3 CYS A 85 -23.538 -2.377 8.416 1.00 15.00 H new ATOM 0 HG CYS A 85 -21.375 -2.779 5.775 1.00 15.00 H new ATOM 1347 N ALA A 86 -23.241 -0.169 10.134 1.00 15.00 N ATOM 1348 CA ALA A 86 -23.288 0.273 11.523 1.00 15.00 C ATOM 1349 C ALA A 86 -23.156 -0.908 12.482 1.00 15.00 C ATOM 1350 O ALA A 86 -23.321 -0.760 13.694 1.00 15.00 O ATOM 1351 CB ALA A 86 -24.579 1.027 11.787 1.00 15.00 C ATOM 0 H ALA A 86 -24.154 -0.357 9.719 1.00 15.00 H new ATOM 0 HA ALA A 86 -22.445 0.941 11.697 1.00 15.00 H new ATOM 0 HB1 ALA A 86 -24.604 1.353 12.827 1.00 15.00 H new ATOM 0 HB2 ALA A 86 -24.632 1.897 11.133 1.00 15.00 H new ATOM 0 HB3 ALA A 86 -25.429 0.373 11.591 1.00 15.00 H new ATOM 1357 N ALA A 87 -22.855 -2.073 11.932 1.00 15.00 N ATOM 1358 CA ALA A 87 -22.701 -3.284 12.723 1.00 15.00 C ATOM 1359 C ALA A 87 -21.231 -3.550 13.024 1.00 15.00 C ATOM 1360 O ALA A 87 -20.946 -4.333 13.951 1.00 15.00 O ATOM 1361 CB ALA A 87 -23.325 -4.473 12.002 1.00 15.00 C ATOM 1362 OXT ALA A 87 -20.363 -2.958 12.341 1.00 15.00 O1- ATOM 0 H ALA A 87 -22.711 -2.206 10.931 1.00 15.00 H new ATOM 0 HA ALA A 87 -23.221 -3.143 13.671 1.00 15.00 H new ATOM 0 HB1 ALA A 87 -23.201 -5.371 12.607 1.00 15.00 H new ATOM 0 HB2 ALA A 87 -24.387 -4.286 11.843 1.00 15.00 H new ATOM 0 HB3 ALA A 87 -22.834 -4.614 11.039 1.00 15.00 H new TER 1368 ALA A 87 ATOM 1369 N GLY B 101 19.617 4.459 -14.967 1.00 15.00 N ATOM 1370 CA GLY B 101 19.098 3.262 -14.266 1.00 15.00 C ATOM 1371 C GLY B 101 17.725 3.497 -13.676 1.00 15.00 C ATOM 1372 O GLY B 101 16.739 3.601 -14.404 1.00 15.00 O ATOM 0 HA2 GLY B 101 19.054 2.425 -14.963 1.00 15.00 H new ATOM 0 HA3 GLY B 101 19.789 2.979 -13.472 1.00 15.00 H new ATOM 1378 N SER B 102 17.664 3.589 -12.358 1.00 15.00 N ATOM 1379 CA SER B 102 16.409 3.819 -11.662 1.00 15.00 C ATOM 1380 C SER B 102 16.684 4.609 -10.384 1.00 15.00 C ATOM 1381 O SER B 102 17.662 5.356 -10.318 1.00 15.00 O ATOM 1382 CB SER B 102 15.720 2.482 -11.349 1.00 15.00 C ATOM 1383 OG SER B 102 14.327 2.657 -11.125 1.00 15.00 O ATOM 0 H SER B 102 18.475 3.507 -11.745 1.00 15.00 H new ATOM 0 HA SER B 102 15.737 4.397 -12.296 1.00 15.00 H new ATOM 0 HB2 SER B 102 15.873 1.789 -12.177 1.00 15.00 H new ATOM 0 HB3 SER B 102 16.178 2.032 -10.468 1.00 15.00 H new ATOM 0 HG SER B 102 13.915 1.789 -10.930 1.00 15.00 H new ATOM 1389 N VAL B 103 15.833 4.454 -9.378 1.00 15.00 N ATOM 1390 CA VAL B 103 16.014 5.163 -8.117 1.00 15.00 C ATOM 1391 C VAL B 103 17.120 4.497 -7.283 1.00 15.00 C ATOM 1392 O VAL B 103 16.872 3.703 -6.374 1.00 15.00 O ATOM 1393 CB VAL B 103 14.688 5.262 -7.318 1.00 15.00 C ATOM 1394 CG1 VAL B 103 14.080 3.889 -7.070 1.00 15.00 C ATOM 1395 CG2 VAL B 103 14.897 6.012 -6.008 1.00 15.00 C ATOM 0 H VAL B 103 15.014 3.847 -9.410 1.00 15.00 H new ATOM 0 HA VAL B 103 16.323 6.183 -8.347 1.00 15.00 H new ATOM 0 HB VAL B 103 13.980 5.828 -7.924 1.00 15.00 H new ATOM 0 HG11 VAL B 103 13.153 3.998 -6.508 1.00 15.00 H new ATOM 0 HG12 VAL B 103 13.871 3.406 -8.024 1.00 15.00 H new ATOM 0 HG13 VAL B 103 14.780 3.279 -6.500 1.00 15.00 H new ATOM 0 HG21 VAL B 103 13.953 6.068 -5.466 1.00 15.00 H new ATOM 0 HG22 VAL B 103 15.633 5.485 -5.401 1.00 15.00 H new ATOM 0 HG23 VAL B 103 15.255 7.020 -6.219 1.00 15.00 H new ATOM 1405 N GLU B 104 18.355 4.821 -7.616 1.00 15.00 N ATOM 1406 CA GLU B 104 19.503 4.258 -6.926 1.00 15.00 C ATOM 1407 C GLU B 104 19.941 5.149 -5.772 1.00 15.00 C ATOM 1408 O GLU B 104 20.870 4.814 -5.037 1.00 15.00 O ATOM 1409 CB GLU B 104 20.646 4.045 -7.915 1.00 15.00 C ATOM 1410 CG GLU B 104 20.322 3.001 -8.970 1.00 15.00 C ATOM 1411 CD GLU B 104 21.102 3.194 -10.251 1.00 15.00 C ATOM 1412 OE1 GLU B 104 20.492 3.607 -11.262 1.00 15.00 O ATOM 1413 OE2 GLU B 104 22.324 2.930 -10.256 1.00 15.00 O1- ATOM 0 H GLU B 104 18.591 5.474 -8.363 1.00 15.00 H new ATOM 0 HA GLU B 104 19.218 3.294 -6.504 1.00 15.00 H new ATOM 0 HB2 GLU B 104 20.878 4.991 -8.405 1.00 15.00 H new ATOM 0 HB3 GLU B 104 21.540 3.740 -7.371 1.00 15.00 H new ATOM 0 HG2 GLU B 104 20.532 2.010 -8.569 1.00 15.00 H new ATOM 0 HG3 GLU B 104 19.255 3.035 -9.192 1.00 15.00 H new ATOM 1420 N LYS B 105 19.260 6.282 -5.613 1.00 15.00 N ATOM 1421 CA LYS B 105 19.570 7.218 -4.535 1.00 15.00 C ATOM 1422 C LYS B 105 19.346 6.554 -3.183 1.00 15.00 C ATOM 1423 O LYS B 105 20.148 6.707 -2.264 1.00 15.00 O ATOM 1424 CB LYS B 105 18.710 8.482 -4.641 1.00 15.00 C ATOM 1425 CG LYS B 105 19.087 9.551 -3.626 1.00 15.00 C ATOM 1426 CD LYS B 105 18.108 10.713 -3.638 1.00 15.00 C ATOM 1427 CE LYS B 105 18.672 11.924 -2.912 1.00 15.00 C ATOM 1428 NZ LYS B 105 17.666 13.009 -2.771 1.00 15.00 N1+ ATOM 0 H LYS B 105 18.491 6.574 -6.216 1.00 15.00 H new ATOM 0 HA LYS B 105 20.618 7.505 -4.627 1.00 15.00 H new ATOM 0 HB2 LYS B 105 18.804 8.895 -5.645 1.00 15.00 H new ATOM 0 HB3 LYS B 105 17.663 8.213 -4.504 1.00 15.00 H new ATOM 0 HG2 LYS B 105 19.116 9.111 -2.629 1.00 15.00 H new ATOM 0 HG3 LYS B 105 20.090 9.919 -3.842 1.00 15.00 H new ATOM 0 HD2 LYS B 105 17.873 10.982 -4.668 1.00 15.00 H new ATOM 0 HD3 LYS B 105 17.174 10.408 -3.167 1.00 15.00 H new ATOM 0 HE2 LYS B 105 19.022 11.624 -1.924 1.00 15.00 H new ATOM 0 HE3 LYS B 105 19.538 12.301 -3.456 1.00 15.00 H new ATOM 0 HZ1 LYS B 105 18.127 13.930 -2.914 1.00 15.00 H new ATOM 0 HZ2 LYS B 105 16.917 12.882 -3.481 1.00 15.00 H new ATOM 0 HZ3 LYS B 105 17.249 12.974 -1.819 1.00 15.00 H new ATOM 1442 N LEU B 106 18.253 5.809 -3.070 1.00 15.00 N ATOM 1443 CA LEU B 106 17.928 5.104 -1.836 1.00 15.00 C ATOM 1444 C LEU B 106 18.602 3.737 -1.832 1.00 15.00 C ATOM 1445 O LEU B 106 17.964 2.714 -1.573 1.00 15.00 O ATOM 1446 CB LEU B 106 16.412 4.941 -1.681 1.00 15.00 C ATOM 1447 CG LEU B 106 15.638 6.196 -1.249 1.00 15.00 C ATOM 1448 CD1 LEU B 106 16.392 6.965 -0.178 1.00 15.00 C ATOM 1449 CD2 LEU B 106 15.346 7.093 -2.444 1.00 15.00 C ATOM 0 H LEU B 106 17.575 5.677 -3.820 1.00 15.00 H new ATOM 0 HA LEU B 106 18.295 5.692 -0.995 1.00 15.00 H new ATOM 0 HB2 LEU B 106 16.005 4.597 -2.632 1.00 15.00 H new ATOM 0 HB3 LEU B 106 16.224 4.154 -0.951 1.00 15.00 H new ATOM 0 HG LEU B 106 14.689 5.869 -0.825 1.00 15.00 H new ATOM 0 HD11 LEU B 106 15.820 7.848 0.107 1.00 15.00 H new ATOM 0 HD12 LEU B 106 16.535 6.328 0.695 1.00 15.00 H new ATOM 0 HD13 LEU B 106 17.363 7.272 -0.566 1.00 15.00 H new ATOM 0 HD21 LEU B 106 14.797 7.974 -2.112 1.00 15.00 H new ATOM 0 HD22 LEU B 106 16.284 7.402 -2.905 1.00 15.00 H new ATOM 0 HD23 LEU B 106 14.747 6.546 -3.172 1.00 15.00 H new ATOM 1461 N THR B 107 19.898 3.742 -2.111 1.00 15.00 N ATOM 1462 CA THR B 107 20.697 2.527 -2.176 1.00 15.00 C ATOM 1463 C THR B 107 20.611 1.706 -0.888 1.00 15.00 C ATOM 1464 O THR B 107 20.420 0.491 -0.930 1.00 15.00 O ATOM 1465 CB THR B 107 22.171 2.876 -2.453 1.00 15.00 C ATOM 1466 OG1 THR B 107 22.277 4.254 -2.844 1.00 15.00 O ATOM 1467 CG2 THR B 107 22.748 1.984 -3.541 1.00 15.00 C ATOM 0 H THR B 107 20.427 4.593 -2.300 1.00 15.00 H new ATOM 0 HA THR B 107 20.292 1.924 -2.989 1.00 15.00 H new ATOM 0 HB THR B 107 22.741 2.711 -1.539 1.00 15.00 H new ATOM 0 HG1 THR B 107 21.771 4.399 -3.670 1.00 15.00 H new ATOM 0 HG21 THR B 107 23.790 2.252 -3.717 1.00 15.00 H new ATOM 0 HG22 THR B 107 22.689 0.942 -3.226 1.00 15.00 H new ATOM 0 HG23 THR B 107 22.179 2.118 -4.461 1.00 15.00 H new ATOM 1475 N ALA B 108 20.745 2.374 0.251 1.00 15.00 N ATOM 1476 CA ALA B 108 20.695 1.690 1.538 1.00 15.00 C ATOM 1477 C ALA B 108 19.263 1.439 1.992 1.00 15.00 C ATOM 1478 O ALA B 108 18.933 0.342 2.442 1.00 15.00 O ATOM 1479 CB ALA B 108 21.442 2.492 2.590 1.00 15.00 C ATOM 0 H ALA B 108 20.888 3.382 0.311 1.00 15.00 H new ATOM 0 HA ALA B 108 21.177 0.721 1.412 1.00 15.00 H new ATOM 0 HB1 ALA B 108 21.397 1.970 3.546 1.00 15.00 H new ATOM 0 HB2 ALA B 108 22.483 2.607 2.288 1.00 15.00 H new ATOM 0 HB3 ALA B 108 20.983 3.475 2.692 1.00 15.00 H new ATOM 1485 N ASP B 109 18.413 2.451 1.855 1.00 15.00 N ATOM 1486 CA ASP B 109 17.015 2.350 2.287 1.00 15.00 C ATOM 1487 C ASP B 109 16.287 1.204 1.588 1.00 15.00 C ATOM 1488 O ASP B 109 15.631 0.388 2.240 1.00 15.00 O ATOM 1489 CB ASP B 109 16.271 3.662 2.034 1.00 15.00 C ATOM 1490 CG ASP B 109 15.401 4.070 3.209 1.00 15.00 C ATOM 1491 OD1 ASP B 109 15.817 4.960 3.980 1.00 15.00 O ATOM 1492 OD2 ASP B 109 14.297 3.506 3.369 1.00 15.00 O1- ATOM 0 H ASP B 109 18.663 3.353 1.449 1.00 15.00 H new ATOM 0 HA ASP B 109 17.027 2.144 3.357 1.00 15.00 H new ATOM 0 HB2 ASP B 109 16.993 4.452 1.829 1.00 15.00 H new ATOM 0 HB3 ASP B 109 15.650 3.559 1.144 1.00 15.00 H new ATOM 1497 N ALA B 110 16.415 1.133 0.267 1.00 15.00 N ATOM 1498 CA ALA B 110 15.762 0.083 -0.503 1.00 15.00 C ATOM 1499 C ALA B 110 16.381 -1.276 -0.197 1.00 15.00 C ATOM 1500 O ALA B 110 15.685 -2.287 -0.147 1.00 15.00 O ATOM 1501 CB ALA B 110 15.844 0.380 -1.993 1.00 15.00 C ATOM 0 H ALA B 110 16.963 1.788 -0.290 1.00 15.00 H new ATOM 0 HA ALA B 110 14.711 0.055 -0.214 1.00 15.00 H new ATOM 0 HB1 ALA B 110 15.350 -0.416 -2.550 1.00 15.00 H new ATOM 0 HB2 ALA B 110 15.351 1.329 -2.202 1.00 15.00 H new ATOM 0 HB3 ALA B 110 16.890 0.440 -2.295 1.00 15.00 H new ATOM 1507 N GLU B 111 17.691 -1.284 0.026 1.00 15.00 N ATOM 1508 CA GLU B 111 18.412 -2.515 0.330 1.00 15.00 C ATOM 1509 C GLU B 111 17.925 -3.116 1.642 1.00 15.00 C ATOM 1510 O GLU B 111 17.580 -4.293 1.701 1.00 15.00 O ATOM 1511 CB GLU B 111 19.912 -2.240 0.410 1.00 15.00 C ATOM 1512 CG GLU B 111 20.754 -3.484 0.645 1.00 15.00 C ATOM 1513 CD GLU B 111 22.239 -3.199 0.578 1.00 15.00 C ATOM 1514 OE1 GLU B 111 22.798 -3.195 -0.539 1.00 15.00 O ATOM 1515 OE2 GLU B 111 22.856 -2.979 1.641 1.00 15.00 O1- ATOM 0 H GLU B 111 18.277 -0.449 0.002 1.00 15.00 H new ATOM 0 HA GLU B 111 18.221 -3.229 -0.471 1.00 15.00 H new ATOM 0 HB2 GLU B 111 20.234 -1.765 -0.516 1.00 15.00 H new ATOM 0 HB3 GLU B 111 20.099 -1.529 1.215 1.00 15.00 H new ATOM 0 HG2 GLU B 111 20.511 -3.904 1.621 1.00 15.00 H new ATOM 0 HG3 GLU B 111 20.498 -4.238 -0.099 1.00 15.00 H new ATOM 1522 N LEU B 112 17.888 -2.294 2.685 1.00 15.00 N ATOM 1523 CA LEU B 112 17.440 -2.737 3.999 1.00 15.00 C ATOM 1524 C LEU B 112 16.014 -3.276 3.936 1.00 15.00 C ATOM 1525 O LEU B 112 15.704 -4.317 4.521 1.00 15.00 O ATOM 1526 CB LEU B 112 17.518 -1.581 5.003 1.00 15.00 C ATOM 1527 CG LEU B 112 18.909 -0.979 5.207 1.00 15.00 C ATOM 1528 CD1 LEU B 112 18.829 0.248 6.101 1.00 15.00 C ATOM 1529 CD2 LEU B 112 19.853 -2.009 5.807 1.00 15.00 C ATOM 0 H LEU B 112 18.164 -1.313 2.645 1.00 15.00 H new ATOM 0 HA LEU B 112 18.098 -3.541 4.328 1.00 15.00 H new ATOM 0 HB2 LEU B 112 16.844 -0.790 4.673 1.00 15.00 H new ATOM 0 HB3 LEU B 112 17.149 -1.934 5.966 1.00 15.00 H new ATOM 0 HG LEU B 112 19.300 -0.677 4.235 1.00 15.00 H new ATOM 0 HD11 LEU B 112 19.827 0.665 6.237 1.00 15.00 H new ATOM 0 HD12 LEU B 112 18.184 0.994 5.638 1.00 15.00 H new ATOM 0 HD13 LEU B 112 18.419 -0.034 7.071 1.00 15.00 H new ATOM 0 HD21 LEU B 112 20.838 -1.563 5.945 1.00 15.00 H new ATOM 0 HD22 LEU B 112 19.466 -2.339 6.771 1.00 15.00 H new ATOM 0 HD23 LEU B 112 19.933 -2.864 5.136 1.00 15.00 H new ATOM 1541 N GLN B 113 15.155 -2.576 3.204 1.00 15.00 N ATOM 1542 CA GLN B 113 13.763 -2.980 3.071 1.00 15.00 C ATOM 1543 C GLN B 113 13.639 -4.274 2.269 1.00 15.00 C ATOM 1544 O GLN B 113 12.867 -5.161 2.638 1.00 15.00 O ATOM 1545 CB GLN B 113 12.938 -1.871 2.413 1.00 15.00 C ATOM 1546 CG GLN B 113 11.435 -2.112 2.470 1.00 15.00 C ATOM 1547 CD GLN B 113 10.918 -2.243 3.891 1.00 15.00 C ATOM 1548 OE1 GLN B 113 10.527 -1.257 4.517 1.00 15.00 O ATOM 1549 NE2 GLN B 113 10.915 -3.459 4.414 1.00 15.00 N ATOM 0 H GLN B 113 15.399 -1.727 2.694 1.00 15.00 H new ATOM 0 HA GLN B 113 13.373 -3.160 4.073 1.00 15.00 H new ATOM 0 HB2 GLN B 113 13.164 -0.923 2.902 1.00 15.00 H new ATOM 0 HB3 GLN B 113 13.242 -1.773 1.371 1.00 15.00 H new ATOM 0 HG2 GLN B 113 10.920 -1.289 1.974 1.00 15.00 H new ATOM 0 HG3 GLN B 113 11.195 -3.019 1.915 1.00 15.00 H new ATOM 0 HE21 GLN B 113 11.247 -4.251 3.864 1.00 15.00 H new ATOM 0 HE22 GLN B 113 10.581 -3.604 5.367 1.00 15.00 H new ATOM 1558 N ARG B 114 14.399 -4.378 1.182 1.00 15.00 N ATOM 1559 CA ARG B 114 14.365 -5.570 0.339 1.00 15.00 C ATOM 1560 C ARG B 114 14.924 -6.771 1.087 1.00 15.00 C ATOM 1561 O ARG B 114 14.323 -7.844 1.087 1.00 15.00 O ATOM 1562 CB ARG B 114 15.161 -5.349 -0.953 1.00 15.00 C ATOM 1563 CG ARG B 114 15.083 -6.521 -1.921 1.00 15.00 C ATOM 1564 CD ARG B 114 15.958 -6.299 -3.144 1.00 15.00 C ATOM 1565 NE ARG B 114 15.630 -5.052 -3.832 1.00 15.00 N ATOM 1566 CZ ARG B 114 14.972 -4.985 -4.990 1.00 15.00 C ATOM 1567 NH1 ARG B 114 14.568 -6.096 -5.598 1.00 15.00 N1+ ATOM 1568 NH2 ARG B 114 14.720 -3.805 -5.537 1.00 15.00 N ATOM 0 H ARG B 114 15.044 -3.654 0.865 1.00 15.00 H new ATOM 0 HA ARG B 114 13.324 -5.765 0.080 1.00 15.00 H new ATOM 0 HB2 ARG B 114 14.791 -4.452 -1.450 1.00 15.00 H new ATOM 0 HB3 ARG B 114 16.205 -5.165 -0.700 1.00 15.00 H new ATOM 0 HG2 ARG B 114 15.393 -7.434 -1.413 1.00 15.00 H new ATOM 0 HG3 ARG B 114 14.049 -6.666 -2.235 1.00 15.00 H new ATOM 0 HD2 ARG B 114 17.005 -6.282 -2.842 1.00 15.00 H new ATOM 0 HD3 ARG B 114 15.838 -7.135 -3.832 1.00 15.00 H new ATOM 0 HE ARG B 114 15.923 -4.177 -3.399 1.00 15.00 H new ATOM 0 HH11 ARG B 114 14.761 -7.006 -5.179 1.00 15.00 H new ATOM 0 HH12 ARG B 114 14.065 -6.039 -6.484 1.00 15.00 H new ATOM 0 HH21 ARG B 114 15.029 -2.951 -5.073 1.00 15.00 H new ATOM 0 HH22 ARG B 114 14.217 -3.750 -6.423 1.00 15.00 H new ATOM 1582 N LEU B 115 16.069 -6.573 1.728 1.00 15.00 N ATOM 1583 CA LEU B 115 16.732 -7.622 2.495 1.00 15.00 C ATOM 1584 C LEU B 115 15.786 -8.191 3.548 1.00 15.00 C ATOM 1585 O LEU B 115 15.616 -9.408 3.661 1.00 15.00 O ATOM 1586 CB LEU B 115 17.987 -7.053 3.164 1.00 15.00 C ATOM 1587 CG LEU B 115 18.933 -8.083 3.783 1.00 15.00 C ATOM 1588 CD1 LEU B 115 19.678 -8.842 2.699 1.00 15.00 C ATOM 1589 CD2 LEU B 115 19.912 -7.399 4.725 1.00 15.00 C ATOM 0 H LEU B 115 16.565 -5.681 1.731 1.00 15.00 H new ATOM 0 HA LEU B 115 17.019 -8.428 1.820 1.00 15.00 H new ATOM 0 HB2 LEU B 115 18.541 -6.476 2.424 1.00 15.00 H new ATOM 0 HB3 LEU B 115 17.677 -6.357 3.943 1.00 15.00 H new ATOM 0 HG LEU B 115 18.342 -8.798 4.355 1.00 15.00 H new ATOM 0 HD11 LEU B 115 20.346 -9.570 3.158 1.00 15.00 H new ATOM 0 HD12 LEU B 115 18.963 -9.359 2.059 1.00 15.00 H new ATOM 0 HD13 LEU B 115 20.261 -8.142 2.100 1.00 15.00 H new ATOM 0 HD21 LEU B 115 20.580 -8.143 5.159 1.00 15.00 H new ATOM 0 HD22 LEU B 115 20.498 -6.665 4.171 1.00 15.00 H new ATOM 0 HD23 LEU B 115 19.361 -6.898 5.521 1.00 15.00 H new ATOM 1601 N LYS B 116 15.155 -7.291 4.295 1.00 15.00 N ATOM 1602 CA LYS B 116 14.215 -7.668 5.340 1.00 15.00 C ATOM 1603 C LYS B 116 13.011 -8.392 4.744 1.00 15.00 C ATOM 1604 O LYS B 116 12.593 -9.433 5.242 1.00 15.00 O ATOM 1605 CB LYS B 116 13.749 -6.421 6.101 1.00 15.00 C ATOM 1606 CG LYS B 116 13.002 -6.723 7.390 1.00 15.00 C ATOM 1607 CD LYS B 116 12.577 -5.443 8.089 1.00 15.00 C ATOM 1608 CE LYS B 116 12.365 -5.667 9.578 1.00 15.00 C ATOM 1609 NZ LYS B 116 12.009 -4.410 10.288 1.00 15.00 N1+ ATOM 0 H LYS B 116 15.281 -6.284 4.192 1.00 15.00 H new ATOM 0 HA LYS B 116 14.720 -8.343 6.031 1.00 15.00 H new ATOM 0 HB2 LYS B 116 14.617 -5.805 6.333 1.00 15.00 H new ATOM 0 HB3 LYS B 116 13.104 -5.831 5.450 1.00 15.00 H new ATOM 0 HG2 LYS B 116 12.124 -7.330 7.171 1.00 15.00 H new ATOM 0 HG3 LYS B 116 13.638 -7.309 8.053 1.00 15.00 H new ATOM 0 HD2 LYS B 116 13.337 -4.676 7.940 1.00 15.00 H new ATOM 0 HD3 LYS B 116 11.656 -5.071 7.641 1.00 15.00 H new ATOM 0 HE2 LYS B 116 11.574 -6.402 9.724 1.00 15.00 H new ATOM 0 HE3 LYS B 116 13.273 -6.085 10.014 1.00 15.00 H new ATOM 0 HZ1 LYS B 116 12.105 -4.552 11.314 1.00 15.00 H new ATOM 0 HZ2 LYS B 116 12.646 -3.646 9.983 1.00 15.00 H new ATOM 0 HZ3 LYS B 116 11.027 -4.152 10.065 1.00 15.00 H new ATOM 1623 N ASN B 117 12.472 -7.838 3.662 1.00 15.00 N ATOM 1624 CA ASN B 117 11.313 -8.416 2.985 1.00 15.00 C ATOM 1625 C ASN B 117 11.622 -9.811 2.438 1.00 15.00 C ATOM 1626 O ASN B 117 10.804 -10.723 2.547 1.00 15.00 O ATOM 1627 CB ASN B 117 10.854 -7.487 1.854 1.00 15.00 C ATOM 1628 CG ASN B 117 9.840 -8.128 0.926 1.00 15.00 C ATOM 1629 OD1 ASN B 117 8.640 -8.134 1.203 1.00 15.00 O ATOM 1630 ND2 ASN B 117 10.312 -8.651 -0.197 1.00 15.00 N ATOM 0 H ASN B 117 12.822 -6.982 3.231 1.00 15.00 H new ATOM 0 HA ASN B 117 10.510 -8.519 3.714 1.00 15.00 H new ATOM 0 HB2 ASN B 117 10.421 -6.585 2.287 1.00 15.00 H new ATOM 0 HB3 ASN B 117 11.722 -7.176 1.273 1.00 15.00 H new ATOM 0 HD21 ASN B 117 9.674 -9.078 -0.868 1.00 15.00 H new ATOM 0 HD22 ASN B 117 11.313 -8.626 -0.390 1.00 15.00 H new ATOM 1637 N GLU B 118 12.810 -9.970 1.868 1.00 15.00 N ATOM 1638 CA GLU B 118 13.232 -11.249 1.301 1.00 15.00 C ATOM 1639 C GLU B 118 13.407 -12.300 2.395 1.00 15.00 C ATOM 1640 O GLU B 118 13.150 -13.484 2.182 1.00 15.00 O ATOM 1641 CB GLU B 118 14.536 -11.071 0.523 1.00 15.00 C ATOM 1642 CG GLU B 118 14.958 -12.298 -0.264 1.00 15.00 C ATOM 1643 CD GLU B 118 16.287 -12.104 -0.955 1.00 15.00 C ATOM 1644 OE1 GLU B 118 17.321 -12.050 -0.259 1.00 15.00 O ATOM 1645 OE2 GLU B 118 16.306 -11.996 -2.198 1.00 15.00 O1- ATOM 0 H GLU B 118 13.503 -9.226 1.785 1.00 15.00 H new ATOM 0 HA GLU B 118 12.455 -11.596 0.620 1.00 15.00 H new ATOM 0 HB2 GLU B 118 14.426 -10.232 -0.164 1.00 15.00 H new ATOM 0 HB3 GLU B 118 15.331 -10.809 1.221 1.00 15.00 H new ATOM 0 HG2 GLU B 118 15.021 -13.154 0.408 1.00 15.00 H new ATOM 0 HG3 GLU B 118 14.195 -12.531 -1.007 1.00 15.00 H new ATOM 1652 N ALA B 119 13.841 -11.862 3.566 1.00 15.00 N ATOM 1653 CA ALA B 119 14.036 -12.768 4.689 1.00 15.00 C ATOM 1654 C ALA B 119 12.698 -13.086 5.355 1.00 15.00 C ATOM 1655 O ALA B 119 12.446 -14.218 5.769 1.00 15.00 O ATOM 1656 CB ALA B 119 15.001 -12.166 5.695 1.00 15.00 C ATOM 0 H ALA B 119 14.065 -10.887 3.764 1.00 15.00 H new ATOM 0 HA ALA B 119 14.465 -13.697 4.314 1.00 15.00 H new ATOM 0 HB1 ALA B 119 15.136 -12.856 6.528 1.00 15.00 H new ATOM 0 HB2 ALA B 119 15.962 -11.986 5.214 1.00 15.00 H new ATOM 0 HB3 ALA B 119 14.599 -11.223 6.066 1.00 15.00 H new ATOM 1662 N ALA B 120 11.842 -12.077 5.445 1.00 15.00 N ATOM 1663 CA ALA B 120 10.524 -12.230 6.053 1.00 15.00 C ATOM 1664 C ALA B 120 9.598 -13.045 5.159 1.00 15.00 C ATOM 1665 O ALA B 120 8.589 -13.580 5.617 1.00 15.00 O ATOM 1666 CB ALA B 120 9.915 -10.867 6.341 1.00 15.00 C ATOM 0 H ALA B 120 12.038 -11.136 5.102 1.00 15.00 H new ATOM 0 HA ALA B 120 10.646 -12.768 6.993 1.00 15.00 H new ATOM 0 HB1 ALA B 120 8.932 -10.996 6.794 1.00 15.00 H new ATOM 0 HB2 ALA B 120 10.561 -10.317 7.026 1.00 15.00 H new ATOM 0 HB3 ALA B 120 9.815 -10.309 5.410 1.00 15.00 H new ATOM 1672 N GLU B 121 9.965 -13.145 3.886 1.00 15.00 N ATOM 1673 CA GLU B 121 9.184 -13.872 2.886 1.00 15.00 C ATOM 1674 C GLU B 121 8.858 -15.302 3.334 1.00 15.00 C ATOM 1675 O GLU B 121 7.879 -15.888 2.873 1.00 15.00 O ATOM 1676 CB GLU B 121 9.947 -13.899 1.559 1.00 15.00 C ATOM 1677 CG GLU B 121 9.098 -14.301 0.367 1.00 15.00 C ATOM 1678 CD GLU B 121 9.751 -13.955 -0.951 1.00 15.00 C ATOM 1679 OE1 GLU B 121 9.286 -13.003 -1.613 1.00 15.00 O ATOM 1680 OE2 GLU B 121 10.727 -14.629 -1.334 1.00 15.00 O1- ATOM 0 H GLU B 121 10.816 -12.723 3.515 1.00 15.00 H new ATOM 0 HA GLU B 121 8.236 -13.348 2.760 1.00 15.00 H new ATOM 0 HB2 GLU B 121 10.370 -12.911 1.375 1.00 15.00 H new ATOM 0 HB3 GLU B 121 10.783 -14.592 1.647 1.00 15.00 H new ATOM 0 HG2 GLU B 121 8.909 -15.374 0.405 1.00 15.00 H new ATOM 0 HG3 GLU B 121 8.130 -13.804 0.431 1.00 15.00 H new ATOM 1687 N GLU B 122 9.684 -15.855 4.221 1.00 15.00 N ATOM 1688 CA GLU B 122 9.476 -17.209 4.729 1.00 15.00 C ATOM 1689 C GLU B 122 8.117 -17.335 5.423 1.00 15.00 C ATOM 1690 O GLU B 122 7.204 -17.984 4.906 1.00 15.00 O ATOM 1691 CB GLU B 122 10.601 -17.594 5.696 1.00 15.00 C ATOM 1692 CG GLU B 122 10.613 -19.071 6.053 1.00 15.00 C ATOM 1693 CD GLU B 122 11.665 -19.416 7.089 1.00 15.00 C ATOM 1694 OE1 GLU B 122 11.320 -19.511 8.285 1.00 15.00 O ATOM 1695 OE2 GLU B 122 12.841 -19.595 6.711 1.00 15.00 O1- ATOM 0 H GLU B 122 10.505 -15.385 4.603 1.00 15.00 H new ATOM 0 HA GLU B 122 9.489 -17.893 3.880 1.00 15.00 H new ATOM 0 HB2 GLU B 122 11.560 -17.328 5.250 1.00 15.00 H new ATOM 0 HB3 GLU B 122 10.501 -17.008 6.610 1.00 15.00 H new ATOM 0 HG2 GLU B 122 9.631 -19.357 6.430 1.00 15.00 H new ATOM 0 HG3 GLU B 122 10.792 -19.657 5.151 1.00 15.00 H new ATOM 1702 N ALA B 123 7.986 -16.724 6.597 1.00 15.00 N ATOM 1703 CA ALA B 123 6.733 -16.784 7.343 1.00 15.00 C ATOM 1704 C ALA B 123 6.509 -15.525 8.178 1.00 15.00 C ATOM 1705 O ALA B 123 5.673 -15.508 9.084 1.00 15.00 O ATOM 1706 CB ALA B 123 6.707 -18.016 8.233 1.00 15.00 C ATOM 0 H ALA B 123 8.725 -16.186 7.049 1.00 15.00 H new ATOM 0 HA ALA B 123 5.922 -16.848 6.618 1.00 15.00 H new ATOM 0 HB1 ALA B 123 5.767 -18.048 8.783 1.00 15.00 H new ATOM 0 HB2 ALA B 123 6.798 -18.911 7.618 1.00 15.00 H new ATOM 0 HB3 ALA B 123 7.538 -17.974 8.937 1.00 15.00 H new ATOM 1712 N GLU B 124 7.242 -14.470 7.864 1.00 15.00 N ATOM 1713 CA GLU B 124 7.110 -13.208 8.584 1.00 15.00 C ATOM 1714 C GLU B 124 6.493 -12.151 7.676 1.00 15.00 C ATOM 1715 O GLU B 124 6.333 -11.000 8.067 1.00 15.00 O ATOM 1716 CB GLU B 124 8.475 -12.728 9.090 1.00 15.00 C ATOM 1717 CG GLU B 124 8.722 -12.998 10.564 1.00 15.00 C ATOM 1718 CD GLU B 124 7.871 -12.132 11.470 1.00 15.00 C ATOM 1719 OE1 GLU B 124 6.754 -12.558 11.828 1.00 15.00 O ATOM 1720 OE2 GLU B 124 8.322 -11.026 11.838 1.00 15.00 O1- ATOM 0 H GLU B 124 7.935 -14.459 7.116 1.00 15.00 H new ATOM 0 HA GLU B 124 6.458 -13.368 9.443 1.00 15.00 H new ATOM 0 HB2 GLU B 124 9.257 -13.214 8.507 1.00 15.00 H new ATOM 0 HB3 GLU B 124 8.561 -11.657 8.909 1.00 15.00 H new ATOM 0 HG2 GLU B 124 8.518 -14.048 10.776 1.00 15.00 H new ATOM 0 HG3 GLU B 124 9.775 -12.826 10.789 1.00 15.00 H new ATOM 1727 N LEU B 125 6.135 -12.568 6.466 1.00 15.00 N ATOM 1728 CA LEU B 125 5.549 -11.674 5.472 1.00 15.00 C ATOM 1729 C LEU B 125 4.248 -11.059 5.974 1.00 15.00 C ATOM 1730 O LEU B 125 3.973 -9.884 5.734 1.00 15.00 O ATOM 1731 CB LEU B 125 5.304 -12.439 4.169 1.00 15.00 C ATOM 1732 CG LEU B 125 4.881 -11.585 2.972 1.00 15.00 C ATOM 1733 CD1 LEU B 125 6.020 -10.685 2.521 1.00 15.00 C ATOM 1734 CD2 LEU B 125 4.417 -12.473 1.829 1.00 15.00 C ATOM 0 H LEU B 125 6.242 -13.531 6.147 1.00 15.00 H new ATOM 0 HA LEU B 125 6.251 -10.861 5.289 1.00 15.00 H new ATOM 0 HB2 LEU B 125 6.216 -12.975 3.906 1.00 15.00 H new ATOM 0 HB3 LEU B 125 4.534 -13.189 4.348 1.00 15.00 H new ATOM 0 HG LEU B 125 4.050 -10.950 3.279 1.00 15.00 H new ATOM 0 HD11 LEU B 125 5.696 -10.087 1.669 1.00 15.00 H new ATOM 0 HD12 LEU B 125 6.308 -10.025 3.339 1.00 15.00 H new ATOM 0 HD13 LEU B 125 6.874 -11.297 2.231 1.00 15.00 H new ATOM 0 HD21 LEU B 125 4.119 -11.852 0.984 1.00 15.00 H new ATOM 0 HD22 LEU B 125 5.231 -13.132 1.526 1.00 15.00 H new ATOM 0 HD23 LEU B 125 3.568 -13.073 2.156 1.00 15.00 H new ATOM 1746 N GLU B 126 3.453 -11.860 6.672 1.00 15.00 N ATOM 1747 CA GLU B 126 2.187 -11.392 7.213 1.00 15.00 C ATOM 1748 C GLU B 126 2.410 -10.252 8.210 1.00 15.00 C ATOM 1749 O GLU B 126 1.712 -9.237 8.176 1.00 15.00 O ATOM 1750 CB GLU B 126 1.435 -12.541 7.889 1.00 15.00 C ATOM 1751 CG GLU B 126 0.738 -13.476 6.909 1.00 15.00 C ATOM 1752 CD GLU B 126 -0.389 -12.799 6.156 1.00 15.00 C ATOM 1753 OE1 GLU B 126 -1.526 -12.766 6.675 1.00 15.00 O ATOM 1754 OE2 GLU B 126 -0.142 -12.288 5.042 1.00 15.00 O1- ATOM 0 H GLU B 126 3.664 -12.837 6.876 1.00 15.00 H new ATOM 0 HA GLU B 126 1.585 -11.016 6.386 1.00 15.00 H new ATOM 0 HB2 GLU B 126 2.136 -13.118 8.492 1.00 15.00 H new ATOM 0 HB3 GLU B 126 0.694 -12.126 8.572 1.00 15.00 H new ATOM 0 HG2 GLU B 126 1.468 -13.858 6.196 1.00 15.00 H new ATOM 0 HG3 GLU B 126 0.343 -14.335 7.451 1.00 15.00 H new ATOM 1761 N ARG B 127 3.400 -10.414 9.080 1.00 15.00 N ATOM 1762 CA ARG B 127 3.701 -9.401 10.083 1.00 15.00 C ATOM 1763 C ARG B 127 4.452 -8.227 9.457 1.00 15.00 C ATOM 1764 O ARG B 127 4.233 -7.075 9.826 1.00 15.00 O ATOM 1765 CB ARG B 127 4.510 -10.003 11.230 1.00 15.00 C ATOM 1766 CG ARG B 127 4.319 -9.262 12.537 1.00 15.00 C ATOM 1767 CD ARG B 127 5.489 -9.491 13.478 1.00 15.00 C ATOM 1768 NE ARG B 127 6.763 -9.143 12.850 1.00 15.00 N ATOM 1769 CZ ARG B 127 7.202 -7.895 12.681 1.00 15.00 C ATOM 1770 NH1 ARG B 127 6.474 -6.860 13.090 1.00 15.00 N1+ ATOM 1771 NH2 ARG B 127 8.375 -7.676 12.102 1.00 15.00 N ATOM 0 H ARG B 127 4.006 -11.234 9.111 1.00 15.00 H new ATOM 0 HA ARG B 127 2.758 -9.030 10.485 1.00 15.00 H new ATOM 0 HB2 ARG B 127 4.222 -11.046 11.364 1.00 15.00 H new ATOM 0 HB3 ARG B 127 5.567 -9.996 10.965 1.00 15.00 H new ATOM 0 HG2 ARG B 127 4.211 -8.195 12.340 1.00 15.00 H new ATOM 0 HG3 ARG B 127 3.396 -9.593 13.014 1.00 15.00 H new ATOM 0 HD2 ARG B 127 5.353 -8.895 14.380 1.00 15.00 H new ATOM 0 HD3 ARG B 127 5.509 -10.536 13.787 1.00 15.00 H new ATOM 0 HE ARG B 127 7.355 -9.905 12.519 1.00 15.00 H new ATOM 0 HH11 ARG B 127 5.571 -7.017 13.538 1.00 15.00 H new ATOM 0 HH12 ARG B 127 6.819 -5.909 12.956 1.00 15.00 H new ATOM 0 HH21 ARG B 127 8.942 -8.462 11.785 1.00 15.00 H new ATOM 0 HH22 ARG B 127 8.710 -6.721 11.973 1.00 15.00 H new ATOM 1785 N LEU B 128 5.331 -8.531 8.505 1.00 15.00 N ATOM 1786 CA LEU B 128 6.106 -7.507 7.802 1.00 15.00 C ATOM 1787 C LEU B 128 5.157 -6.528 7.120 1.00 15.00 C ATOM 1788 O LEU B 128 5.415 -5.327 7.063 1.00 15.00 O ATOM 1789 CB LEU B 128 7.040 -8.172 6.770 1.00 15.00 C ATOM 1790 CG LEU B 128 8.080 -7.266 6.084 1.00 15.00 C ATOM 1791 CD1 LEU B 128 7.516 -6.670 4.802 1.00 15.00 C ATOM 1792 CD2 LEU B 128 8.560 -6.168 7.023 1.00 15.00 C ATOM 0 H LEU B 128 5.526 -9.484 8.200 1.00 15.00 H new ATOM 0 HA LEU B 128 6.720 -6.958 8.517 1.00 15.00 H new ATOM 0 HB2 LEU B 128 7.572 -8.983 7.267 1.00 15.00 H new ATOM 0 HB3 LEU B 128 6.421 -8.625 5.995 1.00 15.00 H new ATOM 0 HG LEU B 128 8.940 -7.884 5.825 1.00 15.00 H new ATOM 0 HD11 LEU B 128 8.268 -6.034 4.335 1.00 15.00 H new ATOM 0 HD12 LEU B 128 7.243 -7.473 4.117 1.00 15.00 H new ATOM 0 HD13 LEU B 128 6.632 -6.076 5.035 1.00 15.00 H new ATOM 0 HD21 LEU B 128 9.293 -5.545 6.510 1.00 15.00 H new ATOM 0 HD22 LEU B 128 7.713 -5.554 7.328 1.00 15.00 H new ATOM 0 HD23 LEU B 128 9.019 -6.617 7.904 1.00 15.00 H new ATOM 1804 N LYS B 129 4.050 -7.061 6.621 1.00 15.00 N ATOM 1805 CA LYS B 129 3.030 -6.268 5.952 1.00 15.00 C ATOM 1806 C LYS B 129 2.498 -5.188 6.892 1.00 15.00 C ATOM 1807 O LYS B 129 2.491 -4.002 6.558 1.00 15.00 O ATOM 1808 CB LYS B 129 1.893 -7.185 5.512 1.00 15.00 C ATOM 1809 CG LYS B 129 1.242 -6.787 4.200 1.00 15.00 C ATOM 1810 CD LYS B 129 -0.020 -7.599 3.934 1.00 15.00 C ATOM 1811 CE LYS B 129 0.212 -9.098 4.075 1.00 15.00 C ATOM 1812 NZ LYS B 129 -0.574 -9.677 5.198 1.00 15.00 N1+ ATOM 0 H LYS B 129 3.834 -8.057 6.669 1.00 15.00 H new ATOM 0 HA LYS B 129 3.465 -5.781 5.079 1.00 15.00 H new ATOM 0 HB2 LYS B 129 2.276 -8.201 5.420 1.00 15.00 H new ATOM 0 HB3 LYS B 129 1.132 -7.200 6.292 1.00 15.00 H new ATOM 0 HG2 LYS B 129 0.995 -5.726 4.222 1.00 15.00 H new ATOM 0 HG3 LYS B 129 1.949 -6.933 3.383 1.00 15.00 H new ATOM 0 HD2 LYS B 129 -0.801 -7.288 4.628 1.00 15.00 H new ATOM 0 HD3 LYS B 129 -0.382 -7.383 2.929 1.00 15.00 H new ATOM 0 HE2 LYS B 129 -0.061 -9.597 3.145 1.00 15.00 H new ATOM 0 HE3 LYS B 129 1.273 -9.288 4.238 1.00 15.00 H new ATOM 0 HZ1 LYS B 129 -0.230 -10.637 5.404 1.00 15.00 H new ATOM 0 HZ2 LYS B 129 -0.463 -9.081 6.043 1.00 15.00 H new ATOM 0 HZ3 LYS B 129 -1.579 -9.719 4.933 1.00 15.00 H new ATOM 1826 N SER B 130 2.071 -5.612 8.077 1.00 15.00 N ATOM 1827 CA SER B 130 1.543 -4.693 9.076 1.00 15.00 C ATOM 1828 C SER B 130 2.643 -3.773 9.614 1.00 15.00 C ATOM 1829 O SER B 130 2.380 -2.633 10.003 1.00 15.00 O ATOM 1830 CB SER B 130 0.895 -5.481 10.214 1.00 15.00 C ATOM 1831 OG SER B 130 0.048 -6.504 9.703 1.00 15.00 O ATOM 0 H SER B 130 2.081 -6.589 8.368 1.00 15.00 H new ATOM 0 HA SER B 130 0.787 -4.065 8.604 1.00 15.00 H new ATOM 0 HB2 SER B 130 1.668 -5.923 10.842 1.00 15.00 H new ATOM 0 HB3 SER B 130 0.317 -4.807 10.846 1.00 15.00 H new ATOM 0 HG SER B 130 -0.677 -6.099 9.182 1.00 15.00 H new ATOM 1837 N GLU B 131 3.880 -4.263 9.632 1.00 15.00 N ATOM 1838 CA GLU B 131 4.997 -3.461 10.109 1.00 15.00 C ATOM 1839 C GLU B 131 5.290 -2.341 9.117 1.00 15.00 C ATOM 1840 O GLU B 131 5.521 -1.197 9.509 1.00 15.00 O ATOM 1841 CB GLU B 131 6.242 -4.327 10.319 1.00 15.00 C ATOM 1842 CG GLU B 131 7.320 -3.640 11.142 1.00 15.00 C ATOM 1843 CD GLU B 131 8.625 -4.407 11.174 1.00 15.00 C ATOM 1844 OE1 GLU B 131 8.901 -5.079 12.191 1.00 15.00 O ATOM 1845 OE2 GLU B 131 9.385 -4.331 10.190 1.00 15.00 O1- ATOM 0 H GLU B 131 4.130 -5.203 9.324 1.00 15.00 H new ATOM 0 HA GLU B 131 4.725 -3.025 11.070 1.00 15.00 H new ATOM 0 HB2 GLU B 131 5.952 -5.254 10.814 1.00 15.00 H new ATOM 0 HB3 GLU B 131 6.655 -4.600 9.348 1.00 15.00 H new ATOM 0 HG2 GLU B 131 7.501 -2.645 10.735 1.00 15.00 H new ATOM 0 HG3 GLU B 131 6.959 -3.506 12.162 1.00 15.00 H new ATOM 1852 N ARG B 132 5.262 -2.678 7.829 1.00 15.00 N ATOM 1853 CA ARG B 132 5.505 -1.710 6.764 1.00 15.00 C ATOM 1854 C ARG B 132 4.514 -0.558 6.865 1.00 15.00 C ATOM 1855 O ARG B 132 4.833 0.585 6.533 1.00 15.00 O ATOM 1856 CB ARG B 132 5.371 -2.389 5.399 1.00 15.00 C ATOM 1857 CG ARG B 132 6.674 -2.482 4.617 1.00 15.00 C ATOM 1858 CD ARG B 132 6.857 -1.286 3.697 1.00 15.00 C ATOM 1859 NE ARG B 132 7.868 -0.352 4.190 1.00 15.00 N ATOM 1860 CZ ARG B 132 7.788 0.970 4.057 1.00 15.00 C ATOM 1861 NH1 ARG B 132 6.748 1.515 3.438 1.00 15.00 N1+ ATOM 1862 NH2 ARG B 132 8.758 1.741 4.531 1.00 15.00 N ATOM 0 H ARG B 132 5.071 -3.623 7.497 1.00 15.00 H new ATOM 0 HA ARG B 132 6.516 -1.318 6.871 1.00 15.00 H new ATOM 0 HB2 ARG B 132 4.974 -3.394 5.543 1.00 15.00 H new ATOM 0 HB3 ARG B 132 4.641 -1.841 4.803 1.00 15.00 H new ATOM 0 HG2 ARG B 132 7.513 -2.541 5.311 1.00 15.00 H new ATOM 0 HG3 ARG B 132 6.682 -3.400 4.029 1.00 15.00 H new ATOM 0 HD2 ARG B 132 7.142 -1.635 2.705 1.00 15.00 H new ATOM 0 HD3 ARG B 132 5.906 -0.764 3.590 1.00 15.00 H new ATOM 0 HE ARG B 132 8.685 -0.737 4.665 1.00 15.00 H new ATOM 0 HH11 ARG B 132 6.009 0.921 3.063 1.00 15.00 H new ATOM 0 HH12 ARG B 132 6.688 2.528 3.337 1.00 15.00 H new ATOM 0 HH21 ARG B 132 9.563 1.320 4.996 1.00 15.00 H new ATOM 0 HH22 ARG B 132 8.699 2.754 4.430 1.00 15.00 H new ATOM 1876 N HIS B 133 3.314 -0.879 7.336 1.00 15.00 N ATOM 1877 CA HIS B 133 2.253 0.103 7.510 1.00 15.00 C ATOM 1878 C HIS B 133 2.674 1.202 8.482 1.00 15.00 C ATOM 1879 O HIS B 133 2.608 2.389 8.166 1.00 15.00 O ATOM 1880 CB HIS B 133 0.992 -0.580 8.045 1.00 15.00 C ATOM 1881 CG HIS B 133 -0.042 -0.873 7.003 1.00 15.00 C ATOM 1882 ND1 HIS B 133 -1.350 -0.476 7.162 1.00 15.00 N ATOM 1883 CD2 HIS B 133 0.077 -1.544 5.834 1.00 15.00 C ATOM 1884 CE1 HIS B 133 -1.993 -0.911 6.092 1.00 15.00 C ATOM 1885 NE2 HIS B 133 -1.168 -1.559 5.263 1.00 15.00 N ATOM 0 H HIS B 133 3.051 -1.826 7.607 1.00 15.00 H new ATOM 0 HA HIS B 133 2.050 0.552 6.538 1.00 15.00 H new ATOM 0 HB2 HIS B 133 1.277 -1.514 8.529 1.00 15.00 H new ATOM 0 HB3 HIS B 133 0.548 0.054 8.812 1.00 15.00 H new ATOM 0 HD2 HIS B 133 0.978 -1.982 5.430 1.00 15.00 H new ATOM 0 HE1 HIS B 133 -3.047 -0.762 5.911 1.00 15.00 H new ATOM 0 HE2 HIS B 133 -1.419 -1.985 4.371 1.00 15.00 H new ATOM 1893 N ASP B 134 3.130 0.795 9.660 1.00 15.00 N ATOM 1894 CA ASP B 134 3.532 1.746 10.691 1.00 15.00 C ATOM 1895 C ASP B 134 4.921 2.318 10.427 1.00 15.00 C ATOM 1896 O ASP B 134 5.236 3.428 10.852 1.00 15.00 O ATOM 1897 CB ASP B 134 3.489 1.091 12.070 1.00 15.00 C ATOM 1898 CG ASP B 134 3.027 2.061 13.138 1.00 15.00 C ATOM 1899 OD1 ASP B 134 3.856 2.470 13.974 1.00 15.00 O ATOM 1900 OD2 ASP B 134 1.827 2.422 13.134 1.00 15.00 O1- ATOM 0 H ASP B 134 3.231 -0.185 9.926 1.00 15.00 H new ATOM 0 HA ASP B 134 2.821 2.572 10.664 1.00 15.00 H new ATOM 0 HB2 ASP B 134 2.818 0.232 12.044 1.00 15.00 H new ATOM 0 HB3 ASP B 134 4.480 0.714 12.325 1.00 15.00 H new ATOM 1905 N HIS B 135 5.746 1.573 9.719 1.00 15.00 N ATOM 1906 CA HIS B 135 7.098 2.026 9.414 1.00 15.00 C ATOM 1907 C HIS B 135 7.094 3.125 8.359 1.00 15.00 C ATOM 1908 O HIS B 135 7.965 3.998 8.361 1.00 15.00 O ATOM 1909 CB HIS B 135 7.970 0.857 8.945 1.00 15.00 C ATOM 1910 CG HIS B 135 8.654 0.136 10.064 1.00 15.00 C ATOM 1911 ND1 HIS B 135 9.950 -0.311 9.946 1.00 15.00 N ATOM 1912 CD2 HIS B 135 8.188 -0.183 11.294 1.00 15.00 C ATOM 1913 CE1 HIS B 135 10.239 -0.889 11.101 1.00 15.00 C ATOM 1914 NE2 HIS B 135 9.204 -0.834 11.944 1.00 15.00 N ATOM 0 H HIS B 135 5.510 0.655 9.343 1.00 15.00 H new ATOM 0 HA HIS B 135 7.518 2.436 10.333 1.00 15.00 H new ATOM 0 HB2 HIS B 135 7.350 0.150 8.393 1.00 15.00 H new ATOM 0 HB3 HIS B 135 8.722 1.231 8.251 1.00 15.00 H new ATOM 0 HD2 HIS B 135 7.206 0.034 11.687 1.00 15.00 H new ATOM 0 HE1 HIS B 135 11.190 -1.346 11.332 1.00 15.00 H new ATOM 0 HE2 HIS B 135 9.175 -1.207 12.893 1.00 15.00 H new ATOM 1922 N ASP B 136 6.108 3.092 7.468 1.00 15.00 N ATOM 1923 CA ASP B 136 6.015 4.087 6.403 1.00 15.00 C ATOM 1924 C ASP B 136 5.671 5.468 6.941 1.00 15.00 C ATOM 1925 O ASP B 136 6.226 6.468 6.487 1.00 15.00 O ATOM 1926 CB ASP B 136 4.986 3.685 5.352 1.00 15.00 C ATOM 1927 CG ASP B 136 5.160 4.490 4.083 1.00 15.00 C ATOM 1928 OD1 ASP B 136 6.021 4.114 3.258 1.00 15.00 O ATOM 1929 OD2 ASP B 136 4.461 5.509 3.911 1.00 15.00 O1- ATOM 0 H ASP B 136 5.366 2.392 7.461 1.00 15.00 H new ATOM 0 HA ASP B 136 7.001 4.131 5.940 1.00 15.00 H new ATOM 0 HB2 ASP B 136 5.086 2.623 5.129 1.00 15.00 H new ATOM 0 HB3 ASP B 136 3.981 3.835 5.747 1.00 15.00 H new ATOM 1934 N LYS B 137 4.765 5.529 7.909 1.00 15.00 N ATOM 1935 CA LYS B 137 4.376 6.813 8.487 1.00 15.00 C ATOM 1936 C LYS B 137 5.566 7.449 9.198 1.00 15.00 C ATOM 1937 O LYS B 137 5.678 8.671 9.284 1.00 15.00 O ATOM 1938 CB LYS B 137 3.189 6.656 9.441 1.00 15.00 C ATOM 1939 CG LYS B 137 3.493 5.858 10.695 1.00 15.00 C ATOM 1940 CD LYS B 137 2.231 5.526 11.471 1.00 15.00 C ATOM 1941 CE LYS B 137 1.270 4.691 10.641 1.00 15.00 C ATOM 1942 NZ LYS B 137 0.294 3.966 11.493 1.00 15.00 N1+ ATOM 0 H LYS B 137 4.291 4.718 8.307 1.00 15.00 H new ATOM 0 HA LYS B 137 4.060 7.471 7.678 1.00 15.00 H new ATOM 0 HB2 LYS B 137 2.839 7.646 9.732 1.00 15.00 H new ATOM 0 HB3 LYS B 137 2.371 6.173 8.907 1.00 15.00 H new ATOM 0 HG2 LYS B 137 4.006 4.935 10.423 1.00 15.00 H new ATOM 0 HG3 LYS B 137 4.172 6.425 11.331 1.00 15.00 H new ATOM 0 HD2 LYS B 137 2.493 4.985 12.380 1.00 15.00 H new ATOM 0 HD3 LYS B 137 1.739 6.448 11.780 1.00 15.00 H new ATOM 0 HE2 LYS B 137 0.735 5.337 9.944 1.00 15.00 H new ATOM 0 HE3 LYS B 137 1.834 3.975 10.043 1.00 15.00 H new ATOM 0 HZ1 LYS B 137 -0.301 3.355 10.897 1.00 15.00 H new ATOM 0 HZ2 LYS B 137 0.804 3.382 12.186 1.00 15.00 H new ATOM 0 HZ3 LYS B 137 -0.307 4.652 11.994 1.00 15.00 H new ATOM 1956 N LYS B 138 6.461 6.606 9.699 1.00 15.00 N ATOM 1957 CA LYS B 138 7.662 7.080 10.369 1.00 15.00 C ATOM 1958 C LYS B 138 8.635 7.624 9.327 1.00 15.00 C ATOM 1959 O LYS B 138 9.370 8.581 9.574 1.00 15.00 O ATOM 1960 CB LYS B 138 8.305 5.941 11.166 1.00 15.00 C ATOM 1961 CG LYS B 138 9.411 6.389 12.106 1.00 15.00 C ATOM 1962 CD LYS B 138 8.891 7.359 13.155 1.00 15.00 C ATOM 1963 CE LYS B 138 9.843 7.465 14.336 1.00 15.00 C ATOM 1964 NZ LYS B 138 9.800 6.250 15.196 1.00 15.00 N1+ ATOM 0 H LYS B 138 6.376 5.591 9.653 1.00 15.00 H new ATOM 0 HA LYS B 138 7.403 7.877 11.066 1.00 15.00 H new ATOM 0 HB2 LYS B 138 7.532 5.436 11.746 1.00 15.00 H new ATOM 0 HB3 LYS B 138 8.710 5.208 10.469 1.00 15.00 H new ATOM 0 HG2 LYS B 138 9.847 5.519 12.597 1.00 15.00 H new ATOM 0 HG3 LYS B 138 10.207 6.864 11.533 1.00 15.00 H new ATOM 0 HD2 LYS B 138 8.755 8.343 12.707 1.00 15.00 H new ATOM 0 HD3 LYS B 138 7.912 7.029 13.504 1.00 15.00 H new ATOM 0 HE2 LYS B 138 10.859 7.615 13.971 1.00 15.00 H new ATOM 0 HE3 LYS B 138 9.586 8.341 14.932 1.00 15.00 H new ATOM 0 HZ1 LYS B 138 10.256 6.454 16.108 1.00 15.00 H new ATOM 0 HZ2 LYS B 138 8.810 5.974 15.357 1.00 15.00 H new ATOM 0 HZ3 LYS B 138 10.304 5.472 14.724 1.00 15.00 H new ATOM 1978 N GLU B 139 8.603 7.016 8.144 1.00 15.00 N ATOM 1979 CA GLU B 139 9.459 7.425 7.041 1.00 15.00 C ATOM 1980 C GLU B 139 9.054 8.800 6.530 1.00 15.00 C ATOM 1981 O GLU B 139 9.864 9.513 5.946 1.00 15.00 O ATOM 1982 CB GLU B 139 9.383 6.414 5.897 1.00 15.00 C ATOM 1983 CG GLU B 139 10.168 5.141 6.155 1.00 15.00 C ATOM 1984 CD GLU B 139 11.630 5.413 6.431 1.00 15.00 C ATOM 1985 OE1 GLU B 139 12.242 6.215 5.699 1.00 15.00 O ATOM 1986 OE2 GLU B 139 12.174 4.822 7.385 1.00 15.00 O1- ATOM 0 H GLU B 139 7.987 6.232 7.927 1.00 15.00 H new ATOM 0 HA GLU B 139 10.484 7.469 7.410 1.00 15.00 H new ATOM 0 HB2 GLU B 139 8.339 6.157 5.720 1.00 15.00 H new ATOM 0 HB3 GLU B 139 9.755 6.881 4.985 1.00 15.00 H new ATOM 0 HG2 GLU B 139 9.732 4.614 7.004 1.00 15.00 H new ATOM 0 HG3 GLU B 139 10.080 4.482 5.292 1.00 15.00 H new ATOM 1993 N ALA B 140 7.796 9.167 6.755 1.00 15.00 N ATOM 1994 CA ALA B 140 7.284 10.456 6.316 1.00 15.00 C ATOM 1995 C ALA B 140 8.067 11.602 6.948 1.00 15.00 C ATOM 1996 O ALA B 140 8.638 12.434 6.243 1.00 15.00 O ATOM 1997 CB ALA B 140 5.803 10.585 6.637 1.00 15.00 C ATOM 0 H ALA B 140 7.112 8.586 7.241 1.00 15.00 H new ATOM 0 HA ALA B 140 7.410 10.514 5.235 1.00 15.00 H new ATOM 0 HB1 ALA B 140 5.441 11.556 6.300 1.00 15.00 H new ATOM 0 HB2 ALA B 140 5.250 9.795 6.128 1.00 15.00 H new ATOM 0 HB3 ALA B 140 5.655 10.496 7.713 1.00 15.00 H new ATOM 2003 N GLU B 141 8.116 11.620 8.275 1.00 15.00 N ATOM 2004 CA GLU B 141 8.829 12.666 8.997 1.00 15.00 C ATOM 2005 C GLU B 141 10.340 12.472 8.901 1.00 15.00 C ATOM 2006 O GLU B 141 11.103 13.434 8.990 1.00 15.00 O ATOM 2007 CB GLU B 141 8.401 12.698 10.465 1.00 15.00 C ATOM 2008 CG GLU B 141 7.191 13.581 10.729 1.00 15.00 C ATOM 2009 CD GLU B 141 5.876 12.851 10.554 1.00 15.00 C ATOM 2010 OE1 GLU B 141 5.364 12.800 9.417 1.00 15.00 O ATOM 2011 OE2 GLU B 141 5.340 12.329 11.557 1.00 15.00 O1- ATOM 0 H GLU B 141 7.671 10.923 8.872 1.00 15.00 H new ATOM 0 HA GLU B 141 8.574 13.619 8.533 1.00 15.00 H new ATOM 0 HB2 GLU B 141 8.177 11.682 10.791 1.00 15.00 H new ATOM 0 HB3 GLU B 141 9.236 13.050 11.070 1.00 15.00 H new ATOM 0 HG2 GLU B 141 7.250 13.974 11.744 1.00 15.00 H new ATOM 0 HG3 GLU B 141 7.218 14.436 10.054 1.00 15.00 H new ATOM 2018 N ARG B 142 10.775 11.230 8.726 1.00 15.00 N ATOM 2019 CA ARG B 142 12.199 10.944 8.618 1.00 15.00 C ATOM 2020 C ARG B 142 12.745 11.434 7.280 1.00 15.00 C ATOM 2021 O ARG B 142 13.672 12.240 7.243 1.00 15.00 O ATOM 2022 CB ARG B 142 12.475 9.446 8.781 1.00 15.00 C ATOM 2023 CG ARG B 142 13.953 9.118 8.929 1.00 15.00 C ATOM 2024 CD ARG B 142 14.174 7.700 9.440 1.00 15.00 C ATOM 2025 NE ARG B 142 14.057 6.702 8.377 1.00 15.00 N ATOM 2026 CZ ARG B 142 15.091 6.208 7.695 1.00 15.00 C ATOM 2027 NH1 ARG B 142 16.326 6.614 7.961 1.00 15.00 N1+ ATOM 2028 NH2 ARG B 142 14.881 5.307 6.748 1.00 15.00 N ATOM 0 H ARG B 142 10.169 10.413 8.656 1.00 15.00 H new ATOM 0 HA ARG B 142 12.707 11.476 9.422 1.00 15.00 H new ATOM 0 HB2 ARG B 142 11.939 9.078 9.656 1.00 15.00 H new ATOM 0 HB3 ARG B 142 12.077 8.914 7.917 1.00 15.00 H new ATOM 0 HG2 ARG B 142 14.449 9.238 7.966 1.00 15.00 H new ATOM 0 HG3 ARG B 142 14.415 9.827 9.616 1.00 15.00 H new ATOM 0 HD2 ARG B 142 15.162 7.630 9.894 1.00 15.00 H new ATOM 0 HD3 ARG B 142 13.448 7.481 10.223 1.00 15.00 H new ATOM 0 HE ARG B 142 13.124 6.362 8.142 1.00 15.00 H new ATOM 0 HH11 ARG B 142 16.489 7.308 8.691 1.00 15.00 H new ATOM 0 HH12 ARG B 142 17.113 6.232 7.436 1.00 15.00 H new ATOM 0 HH21 ARG B 142 13.932 4.994 6.543 1.00 15.00 H new ATOM 0 HH22 ARG B 142 15.668 4.926 6.223 1.00 15.00 H new ATOM 2042 N LYS B 143 12.138 10.974 6.190 1.00 15.00 N ATOM 2043 CA LYS B 143 12.569 11.345 4.843 1.00 15.00 C ATOM 2044 C LYS B 143 12.440 12.841 4.595 1.00 15.00 C ATOM 2045 O LYS B 143 13.233 13.416 3.853 1.00 15.00 O ATOM 2046 CB LYS B 143 11.763 10.580 3.792 1.00 15.00 C ATOM 2047 CG LYS B 143 12.195 9.133 3.633 1.00 15.00 C ATOM 2048 CD LYS B 143 13.566 9.032 2.987 1.00 15.00 C ATOM 2049 CE LYS B 143 14.076 7.602 2.984 1.00 15.00 C ATOM 2050 NZ LYS B 143 14.353 7.101 4.355 1.00 15.00 N1+ ATOM 0 H LYS B 143 11.340 10.339 6.213 1.00 15.00 H new ATOM 0 HA LYS B 143 13.623 11.079 4.760 1.00 15.00 H new ATOM 0 HB2 LYS B 143 10.708 10.608 4.063 1.00 15.00 H new ATOM 0 HB3 LYS B 143 11.859 11.087 2.832 1.00 15.00 H new ATOM 0 HG2 LYS B 143 12.214 8.648 4.609 1.00 15.00 H new ATOM 0 HG3 LYS B 143 11.465 8.598 3.026 1.00 15.00 H new ATOM 0 HD2 LYS B 143 13.515 9.403 1.963 1.00 15.00 H new ATOM 0 HD3 LYS B 143 14.270 9.669 3.523 1.00 15.00 H new ATOM 0 HE2 LYS B 143 13.339 6.957 2.505 1.00 15.00 H new ATOM 0 HE3 LYS B 143 14.986 7.544 2.387 1.00 15.00 H new ATOM 0 HZ1 LYS B 143 15.086 6.365 4.314 1.00 15.00 H new ATOM 0 HZ2 LYS B 143 14.684 7.886 4.951 1.00 15.00 H new ATOM 0 HZ3 LYS B 143 13.483 6.701 4.761 1.00 15.00 H new ATOM 2064 N ALA B 144 11.448 13.464 5.221 1.00 15.00 N ATOM 2065 CA ALA B 144 11.224 14.897 5.062 1.00 15.00 C ATOM 2066 C ALA B 144 12.487 15.689 5.377 1.00 15.00 C ATOM 2067 O ALA B 144 12.862 16.597 4.638 1.00 15.00 O ATOM 2068 CB ALA B 144 10.077 15.361 5.949 1.00 15.00 C ATOM 0 H ALA B 144 10.786 13.000 5.843 1.00 15.00 H new ATOM 0 HA ALA B 144 10.959 15.080 4.021 1.00 15.00 H new ATOM 0 HB1 ALA B 144 9.925 16.432 5.817 1.00 15.00 H new ATOM 0 HB2 ALA B 144 9.166 14.829 5.674 1.00 15.00 H new ATOM 0 HB3 ALA B 144 10.317 15.155 6.992 1.00 15.00 H new ATOM 2074 N LEU B 145 13.138 15.336 6.478 1.00 15.00 N ATOM 2075 CA LEU B 145 14.359 16.013 6.889 1.00 15.00 C ATOM 2076 C LEU B 145 15.593 15.333 6.298 1.00 15.00 C ATOM 2077 O LEU B 145 16.548 15.995 5.895 1.00 15.00 O ATOM 2078 CB LEU B 145 14.472 16.039 8.418 1.00 15.00 C ATOM 2079 CG LEU B 145 13.649 17.117 9.137 1.00 15.00 C ATOM 2080 CD1 LEU B 145 13.836 18.476 8.478 1.00 15.00 C ATOM 2081 CD2 LEU B 145 12.175 16.741 9.176 1.00 15.00 C ATOM 0 H LEU B 145 12.840 14.585 7.101 1.00 15.00 H new ATOM 0 HA LEU B 145 14.311 17.035 6.514 1.00 15.00 H new ATOM 0 HB2 LEU B 145 14.170 15.064 8.801 1.00 15.00 H new ATOM 0 HB3 LEU B 145 15.521 16.175 8.682 1.00 15.00 H new ATOM 0 HG LEU B 145 14.012 17.183 10.163 1.00 15.00 H new ATOM 0 HD11 LEU B 145 13.242 19.222 9.007 1.00 15.00 H new ATOM 0 HD12 LEU B 145 14.888 18.757 8.516 1.00 15.00 H new ATOM 0 HD13 LEU B 145 13.511 18.424 7.439 1.00 15.00 H new ATOM 0 HD21 LEU B 145 11.614 17.521 9.691 1.00 15.00 H new ATOM 0 HD22 LEU B 145 11.799 16.635 8.158 1.00 15.00 H new ATOM 0 HD23 LEU B 145 12.054 15.797 9.707 1.00 15.00 H new ATOM 2093 N GLU B 146 15.555 14.005 6.244 1.00 15.00 N ATOM 2094 CA GLU B 146 16.670 13.207 5.735 1.00 15.00 C ATOM 2095 C GLU B 146 17.008 13.537 4.280 1.00 15.00 C ATOM 2096 O GLU B 146 18.161 13.827 3.963 1.00 15.00 O ATOM 2097 CB GLU B 146 16.351 11.717 5.879 1.00 15.00 C ATOM 2098 CG GLU B 146 17.384 10.792 5.260 1.00 15.00 C ATOM 2099 CD GLU B 146 17.167 9.348 5.654 1.00 15.00 C ATOM 2100 OE1 GLU B 146 16.098 8.790 5.331 1.00 15.00 O ATOM 2101 OE2 GLU B 146 18.064 8.765 6.297 1.00 15.00 O1- ATOM 0 H GLU B 146 14.755 13.452 6.550 1.00 15.00 H new ATOM 0 HA GLU B 146 17.548 13.455 6.331 1.00 15.00 H new ATOM 0 HB2 GLU B 146 16.256 11.479 6.938 1.00 15.00 H new ATOM 0 HB3 GLU B 146 15.382 11.519 5.420 1.00 15.00 H new ATOM 0 HG2 GLU B 146 17.344 10.880 4.174 1.00 15.00 H new ATOM 0 HG3 GLU B 146 18.381 11.105 5.569 1.00 15.00 H new ATOM 2108 N ASP B 147 16.010 13.511 3.403 1.00 15.00 N ATOM 2109 CA ASP B 147 16.238 13.790 1.984 1.00 15.00 C ATOM 2110 C ASP B 147 16.620 15.247 1.766 1.00 15.00 C ATOM 2111 O ASP B 147 17.374 15.569 0.848 1.00 15.00 O ATOM 2112 CB ASP B 147 14.997 13.449 1.156 1.00 15.00 C ATOM 2113 CG ASP B 147 15.289 13.405 -0.333 1.00 15.00 C ATOM 2114 OD1 ASP B 147 16.057 12.521 -0.766 1.00 15.00 O ATOM 2115 OD2 ASP B 147 14.741 14.241 -1.081 1.00 15.00 O1- ATOM 0 H ASP B 147 15.041 13.302 3.644 1.00 15.00 H new ATOM 0 HA ASP B 147 17.065 13.161 1.655 1.00 15.00 H new ATOM 0 HB2 ASP B 147 14.605 12.483 1.475 1.00 15.00 H new ATOM 0 HB3 ASP B 147 14.220 14.189 1.349 1.00 15.00 H new ATOM 2120 N LYS B 148 16.111 16.124 2.622 1.00 15.00 N ATOM 2121 CA LYS B 148 16.415 17.544 2.529 1.00 15.00 C ATOM 2122 C LYS B 148 17.860 17.800 2.958 1.00 15.00 C ATOM 2123 O LYS B 148 18.470 18.804 2.590 1.00 15.00 O ATOM 2124 CB LYS B 148 15.453 18.348 3.405 1.00 15.00 C ATOM 2125 CG LYS B 148 15.433 19.834 3.096 1.00 15.00 C ATOM 2126 CD LYS B 148 14.584 20.598 4.096 1.00 15.00 C ATOM 2127 CE LYS B 148 14.556 22.082 3.779 1.00 15.00 C ATOM 2128 NZ LYS B 148 13.907 22.870 4.858 1.00 15.00 N1+ ATOM 0 H LYS B 148 15.486 15.876 3.388 1.00 15.00 H new ATOM 0 HA LYS B 148 16.294 17.863 1.494 1.00 15.00 H new ATOM 0 HB2 LYS B 148 14.446 17.948 3.283 1.00 15.00 H new ATOM 0 HB3 LYS B 148 15.727 18.208 4.451 1.00 15.00 H new ATOM 0 HG2 LYS B 148 16.451 20.223 3.109 1.00 15.00 H new ATOM 0 HG3 LYS B 148 15.044 19.993 2.090 1.00 15.00 H new ATOM 0 HD2 LYS B 148 13.568 20.204 4.089 1.00 15.00 H new ATOM 0 HD3 LYS B 148 14.978 20.446 5.101 1.00 15.00 H new ATOM 0 HE2 LYS B 148 15.575 22.440 3.631 1.00 15.00 H new ATOM 0 HE3 LYS B 148 14.023 22.242 2.842 1.00 15.00 H new ATOM 0 HZ1 LYS B 148 13.909 23.878 4.601 1.00 15.00 H new ATOM 0 HZ2 LYS B 148 12.926 22.546 4.982 1.00 15.00 H new ATOM 0 HZ3 LYS B 148 14.430 22.738 5.747 1.00 15.00 H new ATOM 2142 N LEU B 149 18.397 16.882 3.749 1.00 15.00 N ATOM 2143 CA LEU B 149 19.766 16.987 4.222 1.00 15.00 C ATOM 2144 C LEU B 149 20.705 16.269 3.257 1.00 15.00 C ATOM 2145 O LEU B 149 21.666 16.853 2.750 1.00 15.00 O ATOM 2146 CB LEU B 149 19.893 16.385 5.626 1.00 15.00 C ATOM 2147 CG LEU B 149 21.293 16.444 6.238 1.00 15.00 C ATOM 2148 CD1 LEU B 149 21.620 17.860 6.690 1.00 15.00 C ATOM 2149 CD2 LEU B 149 21.407 15.471 7.403 1.00 15.00 C ATOM 0 H LEU B 149 17.901 16.053 4.077 1.00 15.00 H new ATOM 0 HA LEU B 149 20.041 18.041 4.270 1.00 15.00 H new ATOM 0 HB2 LEU B 149 19.202 16.904 6.290 1.00 15.00 H new ATOM 0 HB3 LEU B 149 19.575 15.343 5.587 1.00 15.00 H new ATOM 0 HG LEU B 149 22.015 16.153 5.475 1.00 15.00 H new ATOM 0 HD11 LEU B 149 22.620 17.882 7.123 1.00 15.00 H new ATOM 0 HD12 LEU B 149 21.580 18.534 5.834 1.00 15.00 H new ATOM 0 HD13 LEU B 149 20.894 18.180 7.438 1.00 15.00 H new ATOM 0 HD21 LEU B 149 22.410 15.526 7.826 1.00 15.00 H new ATOM 0 HD22 LEU B 149 20.675 15.732 8.168 1.00 15.00 H new ATOM 0 HD23 LEU B 149 21.218 14.457 7.050 1.00 15.00 H new ATOM 2161 N ALA B 150 20.408 15.005 2.998 1.00 15.00 N ATOM 2162 CA ALA B 150 21.210 14.198 2.096 1.00 15.00 C ATOM 2163 C ALA B 150 20.634 14.250 0.687 1.00 15.00 C ATOM 2164 O ALA B 150 19.927 13.337 0.253 1.00 15.00 O ATOM 2165 CB ALA B 150 21.290 12.762 2.597 1.00 15.00 C ATOM 0 H ALA B 150 19.611 14.514 3.404 1.00 15.00 H new ATOM 0 HA ALA B 150 22.221 14.604 2.067 1.00 15.00 H new ATOM 0 HB1 ALA B 150 21.895 12.170 1.910 1.00 15.00 H new ATOM 0 HB2 ALA B 150 21.746 12.747 3.587 1.00 15.00 H new ATOM 0 HB3 ALA B 150 20.287 12.340 2.653 1.00 15.00 H new ATOM 2171 N ASP B 151 20.930 15.330 -0.018 1.00 15.00 N ATOM 2172 CA ASP B 151 20.442 15.521 -1.379 1.00 15.00 C ATOM 2173 C ASP B 151 21.170 14.609 -2.361 1.00 15.00 C ATOM 2174 O ASP B 151 20.701 14.385 -3.481 1.00 15.00 O ATOM 2175 CB ASP B 151 20.574 16.991 -1.799 1.00 15.00 C ATOM 2176 CG ASP B 151 22.012 17.446 -1.961 1.00 15.00 C ATOM 2177 OD1 ASP B 151 22.843 17.153 -1.074 1.00 15.00 O ATOM 2178 OD2 ASP B 151 22.308 18.125 -2.970 1.00 15.00 O1- ATOM 0 H ASP B 151 21.509 16.094 0.330 1.00 15.00 H new ATOM 0 HA ASP B 151 19.386 15.252 -1.397 1.00 15.00 H new ATOM 0 HB2 ASP B 151 20.045 17.141 -2.740 1.00 15.00 H new ATOM 0 HB3 ASP B 151 20.084 17.619 -1.055 1.00 15.00 H new ATOM 2183 N TYR B 152 22.303 14.072 -1.937 1.00 15.00 N ATOM 2184 CA TYR B 152 23.080 13.168 -2.768 1.00 15.00 C ATOM 2185 C TYR B 152 23.050 11.761 -2.185 1.00 15.00 C ATOM 2186 O TYR B 152 22.049 11.054 -2.402 1.00 15.00 O ATOM 2187 CB TYR B 152 24.520 13.656 -2.906 1.00 15.00 C ATOM 2188 CG TYR B 152 24.689 14.737 -3.946 1.00 15.00 C ATOM 2189 CD1 TYR B 152 24.955 16.048 -3.577 1.00 15.00 C ATOM 2190 CD2 TYR B 152 24.576 14.444 -5.299 1.00 15.00 C ATOM 2191 CE1 TYR B 152 25.104 17.038 -4.529 1.00 15.00 C ATOM 2192 CE2 TYR B 152 24.725 15.425 -6.256 1.00 15.00 C ATOM 2193 CZ TYR B 152 24.988 16.720 -5.866 1.00 15.00 C ATOM 2194 OH TYR B 152 25.131 17.700 -6.821 1.00 15.00 O ATOM 2195 OXT TYR B 152 24.022 11.366 -1.505 1.00 15.00 O1- ATOM 0 H TYR B 152 22.706 14.248 -1.017 1.00 15.00 H new ATOM 0 HA TYR B 152 22.633 13.147 -3.762 1.00 15.00 H new ATOM 0 HB2 TYR B 152 24.862 14.033 -1.942 1.00 15.00 H new ATOM 0 HB3 TYR B 152 25.159 12.811 -3.163 1.00 15.00 H new ATOM 0 HD1 TYR B 152 25.047 16.298 -2.530 1.00 15.00 H new ATOM 0 HD2 TYR B 152 24.368 13.430 -5.607 1.00 15.00 H new ATOM 0 HE1 TYR B 152 25.310 18.055 -4.228 1.00 15.00 H new ATOM 0 HE2 TYR B 152 24.636 15.180 -7.304 1.00 15.00 H new ATOM 0 HH TYR B 152 25.021 17.307 -7.712 1.00 15.00 H new TER 2205 TYR B 152