USER MOD reduce.3.24.130724 H: found=0, std=0, add=1562, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1555 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 107 HIS : no HE2:sc= -0.421 K(o=-0.25,f=-3.4) USER MOD Set 1.2: A 163 ASN : amide:sc= 0.166 K(o=-0.25,f=-6.8!) USER MOD Set 2.1: A 120 LYS NZ :NH3+ -167:sc= 0.663 (180deg=0.0586) USER MOD Set 2.2: A 159 HIS : no HE2:sc= -1.62 X(o=-0.95,f=-0.6) USER MOD Set 3.1: A 108 THR OG1 : rot -35:sc= 0.56 USER MOD Set 3.2: A 111 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 103 GLN : amide:sc= 0 X(o=-0.77,f=-1.1) USER MOD Set 4.2: A 104 HIS : no HD1:sc= -0.772 X(o=-0.77,f=-1.1) USER MOD Set 5.1: A 98 GLN : amide:sc= -0.029 K(o=-0.44,f=-2.6!) USER MOD Set 5.2: A 101 MET CE :methyl 151:sc= -0.408 (180deg=-0.911) USER MOD Set 6.1: A 45 ASN : amide:sc= 0.0708 K(o=-0.82,f=-4.5) USER MOD Set 6.2: A 49 ASN : amide:sc= -0.894 K(o=-0.82,f=-8.6!) USER MOD Set 7.1: A 22 MET CE :methyl 161:sc= -0.412 (180deg=-1.07) USER MOD Set 7.2: A 26 THR OG1 : rot 76:sc= 1.24 USER MOD Single : A 1 GLY N :NH3+ -124:sc= 0.139 (180deg=0) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 ASN : amide:sc= -0.124 X(o=-0.12,f=0) USER MOD Single : A 4 THR OG1 : rot -51:sc= 0.0982 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -0.129 K(o=-0.13,f=-6.5!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= -0.188 X(o=-0.19,f=-0.61) USER MOD Single : A 18 SER OG : rot 164:sc= 0.268 USER MOD Single : A 21 MET CE :methyl 166:sc= 0 (180deg=-0.0134) USER MOD Single : A 34 LYS NZ :NH3+ 153:sc= 1.29 (180deg=0.716) USER MOD Single : A 36 SER OG : rot -153:sc= -0.578 USER MOD Single : A 42 SER OG : rot 67:sc= 0.503 USER MOD Single : A 52 SER OG : rot 170:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 HIS : no HE2:sc= 0.356 K(o=0.36,f=-1.3) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 73:sc= 1.23 USER MOD Single : A 82 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00125) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= -0.019 X(o=-0.019,f=0) USER MOD Single : A 91 TYR OH : rot 6:sc= 1.23 USER MOD Single : A 92 GLN : amide:sc= -0.254 X(o=-0.25,f=0) USER MOD Single : A 96 LYS NZ :NH3+ -169:sc= -0.0492 (180deg=-0.164) USER MOD Single : A 97 ASN : amide:sc= 0.142 K(o=0.14,f=-6.1) USER MOD Single : A 100 TYR OH : rot 1:sc= 0.753 USER MOD Single : A 102 HIS : no HE2:sc= 0.275 K(o=0.28,f=-1.8) USER MOD Single : A 105 SER OG : rot 180:sc= -0.587 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.0959 USER MOD Single : A 113 SER OG : rot 50:sc= 0.181 USER MOD Single : A 114 SER OG : rot -111:sc= 0.0838 USER MOD Single : A 118 MET CE :methyl -161:sc= -0.499 (180deg=-1.13) USER MOD Single : A 119 SER OG : rot -57:sc= 0.299 USER MOD Single : A 121 TYR OH : rot 180:sc= -0.091 USER MOD Single : A 125 CYS SG : rot 107:sc= 0.723 USER MOD Single : A 126 THR OG1 : rot -170:sc= -0.0452 USER MOD Single : A 133 ASN : amide:sc= 0.459 K(o=0.46,f=-7.1!) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 TYR OH : rot 180:sc= 1.19 USER MOD Single : A 151 ASN : amide:sc= 0.609! K(o=0.61!,f=-0.1) USER MOD Single : A 153 GLN :FLIP amide:sc= -1.55! C(o=-3.3!,f=-1.6!) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 167 MET CE :methyl -165:sc= -0.187 (180deg=-0.36) USER MOD Single : A 170 TYR OH : rot -166:sc= 1.01 USER MOD Single : A 171 GLN : amide:sc=-0.00359 K(o=-0.0036,f=-0.78) USER MOD Single : A 172 THR OG1 : rot 91:sc= 1.26 USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 177 LYS NZ :NH3+ 154:sc= 0.351 (180deg=0.115) USER MOD Single : A 178 ASN :FLIP amide:sc= -0.45 F(o=-1.6,f=-0.45) USER MOD Single : A 180 GLN : amide:sc= -0.2 K(o=-0.2,f=-1.6!) USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 ASN : amide:sc= -0.343 X(o=-0.34,f=0) USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 ASN : amide:sc= 0.445 K(o=0.45,f=-4!) USER MOD Single : A 191 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.096 -16.046 -7.764 1.00 12.53 N ATOM 2 CA GLY A 1 -13.914 -16.892 -6.582 1.00 21.04 C ATOM 3 C GLY A 1 -13.061 -16.179 -5.553 1.00 23.40 C ATOM 4 O GLY A 1 -12.752 -14.998 -5.718 1.00 25.20 O ATOM 0 H1 GLY A 1 -15.112 -15.917 -7.945 1.00 12.53 H new ATOM 0 H2 GLY A 1 -13.653 -15.120 -7.599 1.00 12.53 H new ATOM 0 H3 GLY A 1 -13.652 -16.500 -8.588 1.00 12.53 H new ATOM 0 HA2 GLY A 1 -14.884 -17.141 -6.151 1.00 21.04 H new ATOM 0 HA3 GLY A 1 -13.442 -17.832 -6.868 1.00 21.04 H new ATOM 8 N MET A 2 -12.680 -16.871 -4.476 1.00 64.13 N ATOM 9 CA MET A 2 -11.701 -16.363 -3.511 1.00 63.34 C ATOM 10 C MET A 2 -10.834 -17.479 -2.908 1.00 14.31 C ATOM 11 O MET A 2 -10.176 -17.252 -1.897 1.00 3.13 O ATOM 12 CB MET A 2 -12.388 -15.522 -2.418 1.00 74.41 C ATOM 13 CG MET A 2 -13.512 -16.251 -1.672 1.00 52.11 C ATOM 14 SD MET A 2 -13.675 -15.770 0.067 1.00 4.20 S ATOM 15 CE MET A 2 -12.288 -16.719 0.758 1.00 71.43 C ATOM 0 H MET A 2 -13.041 -17.798 -4.249 1.00 64.13 H new ATOM 0 HA MET A 2 -11.021 -15.711 -4.059 1.00 63.34 H new ATOM 0 HB2 MET A 2 -11.636 -15.203 -1.696 1.00 74.41 H new ATOM 0 HB3 MET A 2 -12.796 -14.620 -2.873 1.00 74.41 H new ATOM 0 HG2 MET A 2 -14.456 -16.059 -2.181 1.00 52.11 H new ATOM 0 HG3 MET A 2 -13.333 -17.325 -1.726 1.00 52.11 H new ATOM 0 HE1 MET A 2 -12.229 -16.547 1.833 1.00 71.43 H new ATOM 0 HE2 MET A 2 -12.444 -17.781 0.568 1.00 71.43 H new ATOM 0 HE3 MET A 2 -11.358 -16.399 0.288 1.00 71.43 H new ATOM 25 N ASN A 3 -10.822 -18.680 -3.499 1.00 51.44 N ATOM 26 CA ASN A 3 -10.310 -19.886 -2.841 1.00 70.42 C ATOM 27 C ASN A 3 -9.092 -20.411 -3.575 1.00 23.34 C ATOM 28 O ASN A 3 -8.012 -20.499 -2.994 1.00 72.22 O ATOM 29 CB ASN A 3 -11.376 -20.989 -2.703 1.00 52.51 C ATOM 30 CG ASN A 3 -12.778 -20.443 -2.701 1.00 73.32 C ATOM 31 OD1 ASN A 3 -13.442 -20.410 -3.734 1.00 14.20 O ATOM 32 ND2 ASN A 3 -13.176 -19.922 -1.570 1.00 2.33 N ATOM 0 H ASN A 3 -11.167 -18.842 -4.445 1.00 51.44 H new ATOM 0 HA ASN A 3 -10.025 -19.598 -1.829 1.00 70.42 H new ATOM 0 HB2 ASN A 3 -11.268 -21.698 -3.524 1.00 52.51 H new ATOM 0 HB3 ASN A 3 -11.204 -21.542 -1.779 1.00 52.51 H new ATOM 0 HD21 ASN A 3 -14.082 -19.457 -1.514 1.00 2.33 H new ATOM 0 HD22 ASN A 3 -12.580 -19.980 -0.744 1.00 2.33 H new ATOM 39 N THR A 4 -9.222 -20.705 -4.870 1.00 65.25 N ATOM 40 CA THR A 4 -8.090 -21.142 -5.691 1.00 74.23 C ATOM 41 C THR A 4 -7.248 -19.937 -6.142 1.00 61.01 C ATOM 42 O THR A 4 -6.671 -19.897 -7.229 1.00 52.14 O ATOM 43 CB THR A 4 -8.566 -22.096 -6.801 1.00 65.31 C ATOM 44 OG1 THR A 4 -7.436 -22.743 -7.354 1.00 71.42 O ATOM 45 CG2 THR A 4 -9.418 -21.460 -7.905 1.00 63.43 C ATOM 0 H THR A 4 -10.106 -20.648 -5.376 1.00 65.25 H new ATOM 0 HA THR A 4 -7.396 -21.742 -5.102 1.00 74.23 H new ATOM 0 HB THR A 4 -9.243 -22.804 -6.323 1.00 65.31 H new ATOM 0 HG1 THR A 4 -6.762 -22.074 -7.595 1.00 71.42 H new ATOM 0 HG21 THR A 4 -9.698 -22.222 -8.633 1.00 63.43 H new ATOM 0 HG22 THR A 4 -10.318 -21.029 -7.467 1.00 63.43 H new ATOM 0 HG23 THR A 4 -8.845 -20.677 -8.401 1.00 63.43 H new ATOM 53 N VAL A 5 -7.150 -18.937 -5.276 1.00 30.22 N ATOM 54 CA VAL A 5 -6.302 -17.788 -5.441 1.00 31.43 C ATOM 55 C VAL A 5 -4.897 -18.278 -5.114 1.00 41.33 C ATOM 56 O VAL A 5 -4.562 -18.577 -3.965 1.00 30.32 O ATOM 57 CB VAL A 5 -6.767 -16.663 -4.498 1.00 71.31 C ATOM 58 CG1 VAL A 5 -5.938 -15.401 -4.740 1.00 71.13 C ATOM 59 CG2 VAL A 5 -8.253 -16.285 -4.636 1.00 42.53 C ATOM 0 H VAL A 5 -7.685 -18.914 -4.408 1.00 30.22 H new ATOM 0 HA VAL A 5 -6.334 -17.371 -6.448 1.00 31.43 H new ATOM 0 HB VAL A 5 -6.625 -17.060 -3.493 1.00 71.31 H new ATOM 0 HG11 VAL A 5 -6.274 -14.611 -4.069 1.00 71.13 H new ATOM 0 HG12 VAL A 5 -4.886 -15.615 -4.551 1.00 71.13 H new ATOM 0 HG13 VAL A 5 -6.062 -15.077 -5.773 1.00 71.13 H new ATOM 0 HG21 VAL A 5 -8.492 -15.486 -3.935 1.00 42.53 H new ATOM 0 HG22 VAL A 5 -8.449 -15.946 -5.653 1.00 42.53 H new ATOM 0 HG23 VAL A 5 -8.872 -17.156 -4.418 1.00 42.53 H new ATOM 69 N LYS A 6 -4.057 -18.355 -6.138 1.00 22.43 N ATOM 70 CA LYS A 6 -2.615 -18.522 -5.987 1.00 3.11 C ATOM 71 C LYS A 6 -1.877 -17.407 -6.716 1.00 24.10 C ATOM 72 O LYS A 6 -0.654 -17.461 -6.832 1.00 53.42 O ATOM 73 CB LYS A 6 -2.210 -19.921 -6.492 1.00 14.12 C ATOM 74 CG LYS A 6 -2.550 -21.045 -5.493 1.00 62.42 C ATOM 75 CD LYS A 6 -1.363 -21.555 -4.658 1.00 1.12 C ATOM 76 CE LYS A 6 -0.719 -20.467 -3.787 1.00 54.44 C ATOM 77 NZ LYS A 6 0.221 -21.024 -2.785 1.00 24.23 N ATOM 0 H LYS A 6 -4.361 -18.303 -7.110 1.00 22.43 H new ATOM 0 HA LYS A 6 -2.337 -18.452 -4.935 1.00 3.11 H new ATOM 0 HB2 LYS A 6 -2.713 -20.119 -7.438 1.00 14.12 H new ATOM 0 HB3 LYS A 6 -1.139 -19.933 -6.692 1.00 14.12 H new ATOM 0 HG2 LYS A 6 -3.324 -20.686 -4.815 1.00 62.42 H new ATOM 0 HG3 LYS A 6 -2.974 -21.884 -6.044 1.00 62.42 H new ATOM 0 HD2 LYS A 6 -1.702 -22.369 -4.018 1.00 1.12 H new ATOM 0 HD3 LYS A 6 -0.608 -21.968 -5.327 1.00 1.12 H new ATOM 0 HE2 LYS A 6 -0.188 -19.762 -4.426 1.00 54.44 H new ATOM 0 HE3 LYS A 6 -1.501 -19.906 -3.275 1.00 54.44 H new ATOM 0 HZ1 LYS A 6 0.628 -20.250 -2.223 1.00 24.23 H new ATOM 0 HZ2 LYS A 6 -0.289 -21.677 -2.156 1.00 24.23 H new ATOM 0 HZ3 LYS A 6 0.984 -21.537 -3.272 1.00 24.23 H new ATOM 91 N ASN A 7 -2.594 -16.418 -7.244 1.00 25.32 N ATOM 92 CA ASN A 7 -2.115 -15.620 -8.361 1.00 12.54 C ATOM 93 C ASN A 7 -2.982 -14.398 -8.574 1.00 11.13 C ATOM 94 O ASN A 7 -4.165 -14.384 -8.252 1.00 61.21 O ATOM 95 CB ASN A 7 -2.163 -16.419 -9.672 1.00 52.41 C ATOM 96 CG ASN A 7 -3.543 -17.022 -9.943 1.00 70.41 C ATOM 97 OD1 ASN A 7 -4.109 -17.717 -9.106 1.00 10.10 O ATOM 98 ND2 ASN A 7 -4.129 -16.777 -11.095 1.00 23.43 N ATOM 0 H ASN A 7 -3.519 -16.151 -6.909 1.00 25.32 H new ATOM 0 HA ASN A 7 -1.093 -15.334 -8.114 1.00 12.54 H new ATOM 0 HB2 ASN A 7 -1.886 -15.767 -10.501 1.00 52.41 H new ATOM 0 HB3 ASN A 7 -1.423 -17.218 -9.634 1.00 52.41 H new ATOM 0 HD21 ASN A 7 -5.052 -17.165 -11.290 1.00 23.43 H new ATOM 0 HD22 ASN A 7 -3.660 -16.199 -11.793 1.00 23.43 H new ATOM 105 N LYS A 8 -2.380 -13.412 -9.227 1.00 64.15 N ATOM 106 CA LYS A 8 -2.909 -12.092 -9.546 1.00 43.41 C ATOM 107 C LYS A 8 -4.330 -12.152 -10.076 1.00 32.33 C ATOM 108 O LYS A 8 -5.207 -11.517 -9.503 1.00 73.45 O ATOM 109 CB LYS A 8 -1.942 -11.506 -10.591 1.00 74.22 C ATOM 110 CG LYS A 8 -2.206 -10.064 -11.056 1.00 24.34 C ATOM 111 CD LYS A 8 -2.290 -9.951 -12.590 1.00 44.25 C ATOM 112 CE LYS A 8 -2.432 -8.492 -13.059 1.00 31.20 C ATOM 113 NZ LYS A 8 -1.870 -8.237 -14.404 1.00 31.41 N ATOM 0 H LYS A 8 -1.428 -13.525 -9.577 1.00 64.15 H new ATOM 0 HA LYS A 8 -2.969 -11.469 -8.654 1.00 43.41 H new ATOM 0 HB2 LYS A 8 -0.933 -11.550 -10.181 1.00 74.22 H new ATOM 0 HB3 LYS A 8 -1.958 -12.153 -11.468 1.00 74.22 H new ATOM 0 HG2 LYS A 8 -3.137 -9.707 -10.616 1.00 24.34 H new ATOM 0 HG3 LYS A 8 -1.411 -9.415 -10.689 1.00 24.34 H new ATOM 0 HD2 LYS A 8 -1.396 -10.388 -13.034 1.00 44.25 H new ATOM 0 HD3 LYS A 8 -3.140 -10.531 -12.949 1.00 44.25 H new ATOM 0 HE2 LYS A 8 -3.488 -8.222 -13.060 1.00 31.20 H new ATOM 0 HE3 LYS A 8 -1.937 -7.840 -12.340 1.00 31.20 H new ATOM 0 HZ1 LYS A 8 -2.002 -7.236 -14.651 1.00 31.41 H new ATOM 0 HZ2 LYS A 8 -0.855 -8.463 -14.405 1.00 31.41 H new ATOM 0 HZ3 LYS A 8 -2.358 -8.833 -15.103 1.00 31.41 H new ATOM 127 N GLN A 9 -4.545 -12.872 -11.173 1.00 72.34 N ATOM 128 CA GLN A 9 -5.801 -12.873 -11.903 1.00 41.11 C ATOM 129 C GLN A 9 -6.982 -13.197 -10.980 1.00 53.41 C ATOM 130 O GLN A 9 -7.947 -12.438 -10.935 1.00 65.42 O ATOM 131 CB GLN A 9 -5.675 -13.861 -13.075 1.00 61.31 C ATOM 132 CG GLN A 9 -6.387 -13.350 -14.334 1.00 72.12 C ATOM 133 CD GLN A 9 -5.703 -12.104 -14.905 1.00 65.31 C ATOM 134 OE1 GLN A 9 -4.474 -12.004 -14.919 1.00 5.43 O ATOM 135 NE2 GLN A 9 -6.467 -11.127 -15.354 1.00 44.32 N ATOM 0 H GLN A 9 -3.837 -13.480 -11.584 1.00 72.34 H new ATOM 0 HA GLN A 9 -6.006 -11.880 -12.302 1.00 41.11 H new ATOM 0 HB2 GLN A 9 -4.621 -14.028 -13.297 1.00 61.31 H new ATOM 0 HB3 GLN A 9 -6.096 -14.824 -12.785 1.00 61.31 H new ATOM 0 HG2 GLN A 9 -6.400 -14.136 -15.089 1.00 72.12 H new ATOM 0 HG3 GLN A 9 -7.425 -13.119 -14.096 1.00 72.12 H new ATOM 0 HE21 GLN A 9 -7.482 -11.224 -15.336 1.00 44.32 H new ATOM 0 HE22 GLN A 9 -6.043 -10.274 -15.719 1.00 44.32 H new ATOM 144 N GLU A 10 -6.869 -14.277 -10.206 1.00 25.34 N ATOM 145 CA GLU A 10 -7.855 -14.724 -9.229 1.00 12.23 C ATOM 146 C GLU A 10 -8.176 -13.643 -8.195 1.00 74.32 C ATOM 147 O GLU A 10 -9.326 -13.433 -7.824 1.00 65.24 O ATOM 148 CB GLU A 10 -7.270 -15.977 -8.561 1.00 14.51 C ATOM 149 CG GLU A 10 -7.473 -17.227 -9.416 1.00 64.15 C ATOM 150 CD GLU A 10 -8.916 -17.741 -9.383 1.00 22.00 C ATOM 151 OE1 GLU A 10 -9.516 -17.841 -8.289 1.00 23.12 O ATOM 152 OE2 GLU A 10 -9.473 -17.997 -10.479 1.00 33.13 O ATOM 0 H GLU A 10 -6.053 -14.888 -10.247 1.00 25.34 H new ATOM 0 HA GLU A 10 -8.802 -14.944 -9.722 1.00 12.23 H new ATOM 0 HB2 GLU A 10 -6.205 -15.829 -8.382 1.00 14.51 H new ATOM 0 HB3 GLU A 10 -7.740 -16.122 -7.588 1.00 14.51 H new ATOM 0 HG2 GLU A 10 -7.194 -17.006 -10.446 1.00 64.15 H new ATOM 0 HG3 GLU A 10 -6.804 -18.013 -9.066 1.00 64.15 H new ATOM 159 N ILE A 11 -7.157 -12.922 -7.744 1.00 51.52 N ATOM 160 CA ILE A 11 -7.329 -11.822 -6.800 1.00 34.23 C ATOM 161 C ILE A 11 -8.167 -10.711 -7.448 1.00 3.31 C ATOM 162 O ILE A 11 -9.080 -10.172 -6.818 1.00 2.21 O ATOM 163 CB ILE A 11 -5.969 -11.256 -6.343 1.00 42.54 C ATOM 164 CG1 ILE A 11 -4.995 -12.328 -5.813 1.00 13.32 C ATOM 165 CG2 ILE A 11 -6.199 -10.193 -5.259 1.00 30.03 C ATOM 166 CD1 ILE A 11 -3.525 -11.929 -5.802 1.00 12.23 C ATOM 0 H ILE A 11 -6.189 -13.082 -8.021 1.00 51.52 H new ATOM 0 HA ILE A 11 -7.846 -12.206 -5.920 1.00 34.23 H new ATOM 0 HB ILE A 11 -5.500 -10.822 -7.226 1.00 42.54 H new ATOM 0 HG12 ILE A 11 -5.290 -12.592 -4.797 1.00 13.32 H new ATOM 0 HG13 ILE A 11 -5.105 -13.226 -6.420 1.00 13.32 H new ATOM 0 HG21 ILE A 11 -5.239 -9.791 -4.934 1.00 30.03 H new ATOM 0 HG22 ILE A 11 -6.811 -9.387 -5.664 1.00 30.03 H new ATOM 0 HG23 ILE A 11 -6.710 -10.645 -4.409 1.00 30.03 H new ATOM 0 HD11 ILE A 11 -2.927 -12.753 -5.412 1.00 12.23 H new ATOM 0 HD12 ILE A 11 -3.204 -11.696 -6.817 1.00 12.23 H new ATOM 0 HD13 ILE A 11 -3.391 -11.052 -5.169 1.00 12.23 H new ATOM 178 N LEU A 12 -7.822 -10.305 -8.672 1.00 14.20 N ATOM 179 CA LEU A 12 -8.459 -9.163 -9.330 1.00 22.30 C ATOM 180 C LEU A 12 -9.929 -9.450 -9.642 1.00 45.45 C ATOM 181 O LEU A 12 -10.743 -8.529 -9.691 1.00 65.02 O ATOM 182 CB LEU A 12 -7.709 -8.787 -10.617 1.00 22.03 C ATOM 183 CG LEU A 12 -6.244 -8.355 -10.414 1.00 3.30 C ATOM 184 CD1 LEU A 12 -5.629 -7.980 -11.759 1.00 23.11 C ATOM 185 CD2 LEU A 12 -6.079 -7.195 -9.428 1.00 21.34 C ATOM 0 H LEU A 12 -7.098 -10.756 -9.232 1.00 14.20 H new ATOM 0 HA LEU A 12 -8.415 -8.320 -8.640 1.00 22.30 H new ATOM 0 HB2 LEU A 12 -7.730 -9.641 -11.294 1.00 22.03 H new ATOM 0 HB3 LEU A 12 -8.246 -7.976 -11.109 1.00 22.03 H new ATOM 0 HG LEU A 12 -5.725 -9.208 -9.978 1.00 3.30 H new ATOM 0 HD11 LEU A 12 -4.593 -7.675 -11.613 1.00 23.11 H new ATOM 0 HD12 LEU A 12 -5.663 -8.840 -12.427 1.00 23.11 H new ATOM 0 HD13 LEU A 12 -6.191 -7.156 -12.199 1.00 23.11 H new ATOM 0 HD21 LEU A 12 -5.022 -6.944 -9.334 1.00 21.34 H new ATOM 0 HD22 LEU A 12 -6.627 -6.326 -9.793 1.00 21.34 H new ATOM 0 HD23 LEU A 12 -6.470 -7.487 -8.454 1.00 21.34 H new ATOM 197 N GLU A 13 -10.292 -10.719 -9.803 1.00 54.55 N ATOM 198 CA GLU A 13 -11.677 -11.147 -9.876 1.00 4.30 C ATOM 199 C GLU A 13 -12.408 -10.921 -8.547 1.00 61.34 C ATOM 200 O GLU A 13 -13.589 -10.573 -8.569 1.00 2.41 O ATOM 201 CB GLU A 13 -11.739 -12.623 -10.287 1.00 34.00 C ATOM 202 CG GLU A 13 -11.404 -12.841 -11.772 1.00 70.43 C ATOM 203 CD GLU A 13 -12.435 -13.716 -12.497 1.00 43.52 C ATOM 204 OE1 GLU A 13 -13.536 -13.190 -12.792 1.00 45.53 O ATOM 205 OE2 GLU A 13 -12.113 -14.871 -12.862 1.00 21.43 O ATOM 0 H GLU A 13 -9.622 -11.484 -9.887 1.00 54.55 H new ATOM 0 HA GLU A 13 -12.184 -10.543 -10.629 1.00 4.30 H new ATOM 0 HB2 GLU A 13 -11.043 -13.196 -9.674 1.00 34.00 H new ATOM 0 HB3 GLU A 13 -12.737 -13.011 -10.083 1.00 34.00 H new ATOM 0 HG2 GLU A 13 -11.342 -11.874 -12.271 1.00 70.43 H new ATOM 0 HG3 GLU A 13 -10.421 -13.305 -11.853 1.00 70.43 H new ATOM 212 N ALA A 14 -11.735 -11.076 -7.399 1.00 12.30 N ATOM 213 CA ALA A 14 -12.392 -10.969 -6.098 1.00 2.50 C ATOM 214 C ALA A 14 -12.504 -9.495 -5.716 1.00 53.25 C ATOM 215 O ALA A 14 -13.423 -9.095 -5.011 1.00 10.21 O ATOM 216 CB ALA A 14 -11.580 -11.770 -5.074 1.00 14.22 C ATOM 0 H ALA A 14 -10.736 -11.276 -7.349 1.00 12.30 H new ATOM 0 HA ALA A 14 -13.401 -11.381 -6.129 1.00 2.50 H new ATOM 0 HB1 ALA A 14 -12.057 -11.700 -4.097 1.00 14.22 H new ATOM 0 HB2 ALA A 14 -11.535 -12.815 -5.382 1.00 14.22 H new ATOM 0 HB3 ALA A 14 -10.570 -11.365 -5.014 1.00 14.22 H new ATOM 222 N PHE A 15 -11.613 -8.663 -6.251 1.00 44.31 N ATOM 223 CA PHE A 15 -11.662 -7.230 -6.083 1.00 4.41 C ATOM 224 C PHE A 15 -13.011 -6.672 -6.551 1.00 10.22 C ATOM 225 O PHE A 15 -13.698 -5.988 -5.795 1.00 14.21 O ATOM 226 CB PHE A 15 -10.493 -6.609 -6.854 1.00 12.34 C ATOM 227 CG PHE A 15 -10.356 -5.139 -6.572 1.00 73.05 C ATOM 228 CD1 PHE A 15 -9.557 -4.715 -5.501 1.00 34.42 C ATOM 229 CD2 PHE A 15 -11.098 -4.206 -7.317 1.00 44.43 C ATOM 230 CE1 PHE A 15 -9.518 -3.367 -5.143 1.00 64.43 C ATOM 231 CE2 PHE A 15 -11.063 -2.850 -6.966 1.00 74.05 C ATOM 232 CZ PHE A 15 -10.307 -2.456 -5.848 1.00 43.51 C ATOM 0 H PHE A 15 -10.828 -8.980 -6.820 1.00 44.31 H new ATOM 0 HA PHE A 15 -11.567 -6.975 -5.027 1.00 4.41 H new ATOM 0 HB2 PHE A 15 -9.568 -7.119 -6.584 1.00 12.34 H new ATOM 0 HB3 PHE A 15 -10.641 -6.762 -7.923 1.00 12.34 H new ATOM 0 HD1 PHE A 15 -8.969 -5.435 -4.951 1.00 34.42 H new ATOM 0 HD2 PHE A 15 -11.693 -4.533 -8.157 1.00 44.43 H new ATOM 0 HE1 PHE A 15 -8.887 -3.033 -4.333 1.00 64.43 H new ATOM 0 HE2 PHE A 15 -11.608 -2.119 -7.545 1.00 74.05 H new ATOM 0 HZ PHE A 15 -10.337 -1.425 -5.527 1.00 43.51 H new ATOM 242 N ARG A 16 -13.385 -6.928 -7.811 1.00 71.05 N ATOM 243 CA ARG A 16 -14.602 -6.359 -8.402 1.00 62.32 C ATOM 244 C ARG A 16 -15.855 -7.058 -7.865 1.00 63.15 C ATOM 245 O ARG A 16 -16.943 -6.488 -7.930 1.00 30.44 O ATOM 246 CB ARG A 16 -14.496 -6.428 -9.941 1.00 25.12 C ATOM 247 CG ARG A 16 -15.242 -5.326 -10.721 1.00 10.43 C ATOM 248 CD ARG A 16 -16.749 -5.574 -10.834 1.00 5.22 C ATOM 249 NE ARG A 16 -17.381 -4.805 -11.910 1.00 51.55 N ATOM 250 CZ ARG A 16 -18.697 -4.714 -12.133 1.00 51.13 C ATOM 251 NH1 ARG A 16 -19.554 -5.461 -11.439 1.00 53.53 N ATOM 252 NH2 ARG A 16 -19.135 -3.871 -13.061 1.00 53.42 N ATOM 0 H ARG A 16 -12.858 -7.530 -8.444 1.00 71.05 H new ATOM 0 HA ARG A 16 -14.696 -5.312 -8.115 1.00 62.32 H new ATOM 0 HB2 ARG A 16 -13.442 -6.389 -10.215 1.00 25.12 H new ATOM 0 HB3 ARG A 16 -14.874 -7.396 -10.268 1.00 25.12 H new ATOM 0 HG2 ARG A 16 -15.075 -4.367 -10.230 1.00 10.43 H new ATOM 0 HG3 ARG A 16 -14.818 -5.249 -11.722 1.00 10.43 H new ATOM 0 HD2 ARG A 16 -16.924 -6.636 -11.004 1.00 5.22 H new ATOM 0 HD3 ARG A 16 -17.225 -5.320 -9.887 1.00 5.22 H new ATOM 0 HE ARG A 16 -16.765 -4.296 -12.543 1.00 51.55 H new ATOM 0 HH11 ARG A 16 -19.209 -6.109 -10.731 1.00 53.53 H new ATOM 0 HH12 ARG A 16 -20.556 -5.385 -11.616 1.00 53.53 H new ATOM 0 HH21 ARG A 16 -18.471 -3.306 -13.591 1.00 53.42 H new ATOM 0 HH22 ARG A 16 -20.135 -3.789 -13.244 1.00 53.42 H new ATOM 266 N GLU A 17 -15.743 -8.261 -7.306 1.00 65.24 N ATOM 267 CA GLU A 17 -16.847 -8.904 -6.611 1.00 11.44 C ATOM 268 C GLU A 17 -17.375 -8.075 -5.437 1.00 4.54 C ATOM 269 O GLU A 17 -18.566 -8.154 -5.134 1.00 70.13 O ATOM 270 CB GLU A 17 -16.399 -10.284 -6.111 1.00 14.41 C ATOM 271 CG GLU A 17 -16.852 -11.416 -7.046 1.00 33.21 C ATOM 272 CD GLU A 17 -17.352 -12.676 -6.328 1.00 63.34 C ATOM 273 OE1 GLU A 17 -17.577 -12.684 -5.097 1.00 53.12 O ATOM 274 OE2 GLU A 17 -17.484 -13.722 -7.007 1.00 32.22 O ATOM 0 H GLU A 17 -14.886 -8.813 -7.324 1.00 65.24 H new ATOM 0 HA GLU A 17 -17.666 -9.002 -7.324 1.00 11.44 H new ATOM 0 HB2 GLU A 17 -15.313 -10.301 -6.022 1.00 14.41 H new ATOM 0 HB3 GLU A 17 -16.803 -10.456 -5.113 1.00 14.41 H new ATOM 0 HG2 GLU A 17 -17.647 -11.041 -7.690 1.00 33.21 H new ATOM 0 HG3 GLU A 17 -16.019 -11.689 -7.694 1.00 33.21 H new ATOM 281 N SER A 18 -16.526 -7.280 -4.785 1.00 2.10 N ATOM 282 CA SER A 18 -16.935 -6.466 -3.659 1.00 65.31 C ATOM 283 C SER A 18 -17.315 -5.082 -4.164 1.00 63.32 C ATOM 284 O SER A 18 -16.674 -4.537 -5.072 1.00 25.43 O ATOM 285 CB SER A 18 -15.781 -6.420 -2.666 1.00 44.45 C ATOM 286 OG SER A 18 -15.962 -5.472 -1.624 1.00 44.45 O ATOM 0 H SER A 18 -15.540 -7.188 -5.028 1.00 2.10 H new ATOM 0 HA SER A 18 -17.807 -6.883 -3.154 1.00 65.31 H new ATOM 0 HB2 SER A 18 -15.652 -7.409 -2.227 1.00 44.45 H new ATOM 0 HB3 SER A 18 -14.861 -6.186 -3.202 1.00 44.45 H new ATOM 0 HG SER A 18 -15.338 -5.666 -0.893 1.00 44.45 H new ATOM 292 N PRO A 19 -18.361 -4.497 -3.574 1.00 70.35 N ATOM 293 CA PRO A 19 -18.722 -3.125 -3.811 1.00 13.43 C ATOM 294 C PRO A 19 -17.721 -2.197 -3.129 1.00 44.23 C ATOM 295 O PRO A 19 -17.186 -1.319 -3.800 1.00 10.00 O ATOM 296 CB PRO A 19 -20.150 -3.003 -3.278 1.00 11.24 C ATOM 297 CG PRO A 19 -20.249 -4.071 -2.189 1.00 23.52 C ATOM 298 CD PRO A 19 -19.267 -5.130 -2.631 1.00 22.51 C ATOM 0 HA PRO A 19 -18.693 -2.834 -4.861 1.00 13.43 H new ATOM 0 HB2 PRO A 19 -20.339 -2.008 -2.875 1.00 11.24 H new ATOM 0 HB3 PRO A 19 -20.883 -3.172 -4.067 1.00 11.24 H new ATOM 0 HG2 PRO A 19 -19.989 -3.669 -1.210 1.00 23.52 H new ATOM 0 HG3 PRO A 19 -21.260 -4.471 -2.112 1.00 23.52 H new ATOM 0 HD2 PRO A 19 -18.719 -5.529 -1.777 1.00 22.51 H new ATOM 0 HD3 PRO A 19 -19.786 -5.968 -3.097 1.00 22.51 H new ATOM 306 N ASP A 20 -17.422 -2.384 -1.839 1.00 32.43 N ATOM 307 CA ASP A 20 -16.604 -1.427 -1.089 1.00 24.13 C ATOM 308 C ASP A 20 -15.173 -1.441 -1.573 1.00 45.41 C ATOM 309 O ASP A 20 -14.578 -0.381 -1.752 1.00 65.45 O ATOM 310 CB ASP A 20 -16.613 -1.692 0.417 1.00 14.33 C ATOM 311 CG ASP A 20 -17.796 -0.955 1.025 1.00 52.41 C ATOM 312 OD1 ASP A 20 -17.713 0.281 1.224 1.00 1.44 O ATOM 313 OD2 ASP A 20 -18.853 -1.607 1.170 1.00 21.30 O ATOM 0 H ASP A 20 -17.734 -3.188 -1.294 1.00 32.43 H new ATOM 0 HA ASP A 20 -17.052 -0.450 -1.268 1.00 24.13 H new ATOM 0 HB2 ASP A 20 -16.690 -2.761 0.614 1.00 14.33 H new ATOM 0 HB3 ASP A 20 -15.681 -1.351 0.868 1.00 14.33 H new ATOM 318 N MET A 21 -14.622 -2.630 -1.824 1.00 22.51 N ATOM 319 CA MET A 21 -13.249 -2.768 -2.288 1.00 61.42 C ATOM 320 C MET A 21 -13.040 -1.909 -3.529 1.00 2.32 C ATOM 321 O MET A 21 -12.068 -1.153 -3.622 1.00 13.30 O ATOM 322 CB MET A 21 -12.966 -4.243 -2.589 1.00 42.05 C ATOM 323 CG MET A 21 -11.487 -4.611 -2.526 1.00 34.44 C ATOM 324 SD MET A 21 -10.796 -4.590 -0.855 1.00 22.21 S ATOM 325 CE MET A 21 -9.696 -3.162 -0.987 1.00 2.21 C ATOM 0 H MET A 21 -15.115 -3.516 -1.711 1.00 22.51 H new ATOM 0 HA MET A 21 -12.557 -2.429 -1.517 1.00 61.42 H new ATOM 0 HB2 MET A 21 -13.515 -4.861 -1.879 1.00 42.05 H new ATOM 0 HB3 MET A 21 -13.348 -4.482 -3.581 1.00 42.05 H new ATOM 0 HG2 MET A 21 -11.352 -5.605 -2.952 1.00 34.44 H new ATOM 0 HG3 MET A 21 -10.923 -3.918 -3.150 1.00 34.44 H new ATOM 0 HE1 MET A 21 -9.380 -2.853 0.009 1.00 2.21 H new ATOM 0 HE2 MET A 21 -8.821 -3.430 -1.579 1.00 2.21 H new ATOM 0 HE3 MET A 21 -10.223 -2.340 -1.471 1.00 2.21 H new ATOM 335 N MET A 22 -13.984 -1.989 -4.470 1.00 74.12 N ATOM 336 CA MET A 22 -13.862 -1.279 -5.724 1.00 33.32 C ATOM 337 C MET A 22 -14.334 0.176 -5.583 1.00 31.03 C ATOM 338 O MET A 22 -13.786 1.059 -6.249 1.00 5.24 O ATOM 339 CB MET A 22 -14.460 -2.157 -6.839 1.00 54.31 C ATOM 340 CG MET A 22 -15.963 -2.049 -7.105 1.00 25.41 C ATOM 341 SD MET A 22 -16.526 -0.495 -7.857 1.00 62.04 S ATOM 342 CE MET A 22 -15.349 -0.361 -9.233 1.00 51.55 C ATOM 0 H MET A 22 -14.837 -2.541 -4.378 1.00 74.12 H new ATOM 0 HA MET A 22 -12.828 -1.128 -6.035 1.00 33.32 H new ATOM 0 HB2 MET A 22 -13.938 -1.921 -7.767 1.00 54.31 H new ATOM 0 HB3 MET A 22 -14.236 -3.197 -6.602 1.00 54.31 H new ATOM 0 HG2 MET A 22 -16.257 -2.872 -7.756 1.00 25.41 H new ATOM 0 HG3 MET A 22 -16.490 -2.185 -6.161 1.00 25.41 H new ATOM 0 HE1 MET A 22 -15.742 0.327 -9.982 1.00 51.55 H new ATOM 0 HE2 MET A 22 -14.395 0.014 -8.861 1.00 51.55 H new ATOM 0 HE3 MET A 22 -15.202 -1.343 -9.683 1.00 51.55 H new ATOM 352 N ALA A 23 -15.225 0.474 -4.628 1.00 61.25 N ATOM 353 CA ALA A 23 -15.636 1.825 -4.265 1.00 25.41 C ATOM 354 C ALA A 23 -14.432 2.645 -3.819 1.00 11.14 C ATOM 355 O ALA A 23 -14.229 3.735 -4.347 1.00 12.45 O ATOM 356 CB ALA A 23 -16.708 1.826 -3.167 1.00 32.24 C ATOM 0 H ALA A 23 -15.690 -0.245 -4.073 1.00 61.25 H new ATOM 0 HA ALA A 23 -16.073 2.279 -5.154 1.00 25.41 H new ATOM 0 HB1 ALA A 23 -16.984 2.853 -2.929 1.00 32.24 H new ATOM 0 HB2 ALA A 23 -17.588 1.286 -3.517 1.00 32.24 H new ATOM 0 HB3 ALA A 23 -16.315 1.339 -2.274 1.00 32.24 H new ATOM 362 N ILE A 24 -13.603 2.118 -2.912 1.00 25.20 N ATOM 363 CA ILE A 24 -12.402 2.782 -2.395 1.00 25.42 C ATOM 364 C ILE A 24 -11.508 3.233 -3.559 1.00 44.54 C ATOM 365 O ILE A 24 -10.944 4.333 -3.558 1.00 33.05 O ATOM 366 CB ILE A 24 -11.657 1.827 -1.427 1.00 63.53 C ATOM 367 CG1 ILE A 24 -12.498 1.455 -0.187 1.00 22.32 C ATOM 368 CG2 ILE A 24 -10.329 2.421 -0.928 1.00 52.35 C ATOM 369 CD1 ILE A 24 -12.071 0.095 0.376 1.00 71.11 C ATOM 0 H ILE A 24 -13.753 1.194 -2.507 1.00 25.20 H new ATOM 0 HA ILE A 24 -12.683 3.674 -1.835 1.00 25.42 H new ATOM 0 HB ILE A 24 -11.467 0.932 -2.019 1.00 63.53 H new ATOM 0 HG12 ILE A 24 -12.383 2.222 0.579 1.00 22.32 H new ATOM 0 HG13 ILE A 24 -13.554 1.427 -0.454 1.00 22.32 H new ATOM 0 HG21 ILE A 24 -9.845 1.715 -0.253 1.00 52.35 H new ATOM 0 HG22 ILE A 24 -9.676 2.616 -1.778 1.00 52.35 H new ATOM 0 HG23 ILE A 24 -10.524 3.353 -0.398 1.00 52.35 H new ATOM 0 HD11 ILE A 24 -12.678 -0.144 1.249 1.00 71.11 H new ATOM 0 HD12 ILE A 24 -12.210 -0.673 -0.384 1.00 71.11 H new ATOM 0 HD13 ILE A 24 -11.021 0.134 0.665 1.00 71.11 H new ATOM 381 N LEU A 25 -11.385 2.380 -4.575 1.00 54.44 N ATOM 382 CA LEU A 25 -10.550 2.606 -5.752 1.00 54.33 C ATOM 383 C LEU A 25 -11.180 3.579 -6.744 1.00 15.23 C ATOM 384 O LEU A 25 -10.470 4.252 -7.492 1.00 54.33 O ATOM 385 CB LEU A 25 -10.322 1.261 -6.448 1.00 41.12 C ATOM 386 CG LEU A 25 -8.885 1.045 -6.950 1.00 11.23 C ATOM 387 CD1 LEU A 25 -7.903 1.055 -5.769 1.00 62.22 C ATOM 388 CD2 LEU A 25 -8.759 -0.307 -7.666 1.00 32.12 C ATOM 0 H LEU A 25 -11.878 1.487 -4.602 1.00 54.44 H new ATOM 0 HA LEU A 25 -9.612 3.049 -5.417 1.00 54.33 H new ATOM 0 HB2 LEU A 25 -10.577 0.459 -5.756 1.00 41.12 H new ATOM 0 HB3 LEU A 25 -11.006 1.182 -7.293 1.00 41.12 H new ATOM 0 HG LEU A 25 -8.650 1.853 -7.643 1.00 11.23 H new ATOM 0 HD11 LEU A 25 -6.889 0.901 -6.138 1.00 62.22 H new ATOM 0 HD12 LEU A 25 -7.961 2.015 -5.256 1.00 62.22 H new ATOM 0 HD13 LEU A 25 -8.162 0.256 -5.074 1.00 62.22 H new ATOM 0 HD21 LEU A 25 -7.735 -0.441 -8.014 1.00 32.12 H new ATOM 0 HD22 LEU A 25 -9.015 -1.110 -6.975 1.00 32.12 H new ATOM 0 HD23 LEU A 25 -9.438 -0.332 -8.519 1.00 32.12 H new ATOM 400 N THR A 26 -12.506 3.647 -6.753 1.00 23.35 N ATOM 401 CA THR A 26 -13.262 4.589 -7.550 1.00 55.50 C ATOM 402 C THR A 26 -13.195 5.981 -6.903 1.00 74.44 C ATOM 403 O THR A 26 -13.046 6.972 -7.606 1.00 64.30 O ATOM 404 CB THR A 26 -14.702 4.069 -7.701 1.00 64.03 C ATOM 405 OG1 THR A 26 -14.683 2.735 -8.175 1.00 13.22 O ATOM 406 CG2 THR A 26 -15.502 4.893 -8.706 1.00 64.23 C ATOM 0 H THR A 26 -13.094 3.031 -6.191 1.00 23.35 H new ATOM 0 HA THR A 26 -12.839 4.684 -8.550 1.00 55.50 H new ATOM 0 HB THR A 26 -15.169 4.140 -6.718 1.00 64.03 H new ATOM 0 HG1 THR A 26 -14.431 2.132 -7.445 1.00 13.22 H new ATOM 0 HG21 THR A 26 -16.513 4.492 -8.782 1.00 64.23 H new ATOM 0 HG22 THR A 26 -15.547 5.930 -8.373 1.00 64.23 H new ATOM 0 HG23 THR A 26 -15.018 4.846 -9.682 1.00 64.23 H new ATOM 414 N ILE A 27 -13.221 6.079 -5.573 1.00 15.33 N ATOM 415 CA ILE A 27 -13.147 7.359 -4.878 1.00 2.32 C ATOM 416 C ILE A 27 -11.816 8.030 -5.213 1.00 62.30 C ATOM 417 O ILE A 27 -11.825 9.176 -5.661 1.00 43.41 O ATOM 418 CB ILE A 27 -13.388 7.166 -3.366 1.00 73.21 C ATOM 419 CG1 ILE A 27 -14.846 6.723 -3.111 1.00 74.52 C ATOM 420 CG2 ILE A 27 -13.102 8.453 -2.572 1.00 22.52 C ATOM 421 CD1 ILE A 27 -15.017 5.989 -1.779 1.00 61.44 C ATOM 0 H ILE A 27 -13.294 5.274 -4.951 1.00 15.33 H new ATOM 0 HA ILE A 27 -13.937 8.029 -5.216 1.00 2.32 H new ATOM 0 HB ILE A 27 -12.699 6.394 -3.024 1.00 73.21 H new ATOM 0 HG12 ILE A 27 -15.495 7.599 -3.124 1.00 74.52 H new ATOM 0 HG13 ILE A 27 -15.171 6.073 -3.923 1.00 74.52 H new ATOM 0 HG21 ILE A 27 -13.284 8.275 -1.512 1.00 22.52 H new ATOM 0 HG22 ILE A 27 -12.062 8.747 -2.717 1.00 22.52 H new ATOM 0 HG23 ILE A 27 -13.757 9.250 -2.923 1.00 22.52 H new ATOM 0 HD11 ILE A 27 -16.061 5.702 -1.653 1.00 61.44 H new ATOM 0 HD12 ILE A 27 -14.392 5.096 -1.773 1.00 61.44 H new ATOM 0 HD13 ILE A 27 -14.720 6.646 -0.961 1.00 61.44 H new ATOM 433 N ILE A 28 -10.689 7.318 -5.050 1.00 41.34 N ATOM 434 CA ILE A 28 -9.358 7.878 -5.291 1.00 34.25 C ATOM 435 C ILE A 28 -9.244 8.429 -6.714 1.00 11.31 C ATOM 436 O ILE A 28 -8.754 9.542 -6.904 1.00 53.40 O ATOM 437 CB ILE A 28 -8.250 6.865 -4.909 1.00 75.03 C ATOM 438 CG1 ILE A 28 -6.838 7.471 -4.797 1.00 32.15 C ATOM 439 CG2 ILE A 28 -8.251 5.589 -5.754 1.00 64.31 C ATOM 440 CD1 ILE A 28 -6.086 7.599 -6.122 1.00 64.11 C ATOM 0 H ILE A 28 -10.679 6.343 -4.749 1.00 41.34 H new ATOM 0 HA ILE A 28 -9.207 8.735 -4.634 1.00 34.25 H new ATOM 0 HB ILE A 28 -8.529 6.568 -3.898 1.00 75.03 H new ATOM 0 HG12 ILE A 28 -6.917 8.459 -4.344 1.00 32.15 H new ATOM 0 HG13 ILE A 28 -6.247 6.856 -4.118 1.00 32.15 H new ATOM 0 HG21 ILE A 28 -7.446 4.933 -5.423 1.00 64.31 H new ATOM 0 HG22 ILE A 28 -9.206 5.077 -5.639 1.00 64.31 H new ATOM 0 HG23 ILE A 28 -8.102 5.847 -6.802 1.00 64.31 H new ATOM 0 HD11 ILE A 28 -5.103 8.035 -5.942 1.00 64.11 H new ATOM 0 HD12 ILE A 28 -5.969 6.613 -6.570 1.00 64.11 H new ATOM 0 HD13 ILE A 28 -6.649 8.241 -6.799 1.00 64.11 H new ATOM 452 N ARG A 29 -9.683 7.669 -7.722 1.00 41.33 N ATOM 453 CA ARG A 29 -9.539 8.087 -9.122 1.00 15.43 C ATOM 454 C ARG A 29 -10.285 9.398 -9.413 1.00 11.32 C ATOM 455 O ARG A 29 -9.880 10.144 -10.296 1.00 61.44 O ATOM 456 CB ARG A 29 -9.953 6.960 -10.090 1.00 4.54 C ATOM 457 CG ARG A 29 -11.423 6.577 -10.021 1.00 54.11 C ATOM 458 CD ARG A 29 -11.967 5.980 -11.316 1.00 71.31 C ATOM 459 NE ARG A 29 -12.496 7.072 -12.160 1.00 32.24 N ATOM 460 CZ ARG A 29 -13.613 7.774 -11.900 1.00 4.21 C ATOM 461 NH1 ARG A 29 -14.642 7.231 -11.259 1.00 0.15 N ATOM 462 NH2 ARG A 29 -13.709 9.052 -12.234 1.00 12.45 N ATOM 0 H ARG A 29 -10.139 6.765 -7.597 1.00 41.33 H new ATOM 0 HA ARG A 29 -8.481 8.288 -9.291 1.00 15.43 H new ATOM 0 HB2 ARG A 29 -9.719 7.269 -11.109 1.00 4.54 H new ATOM 0 HB3 ARG A 29 -9.350 6.077 -9.878 1.00 4.54 H new ATOM 0 HG2 ARG A 29 -11.564 5.858 -9.214 1.00 54.11 H new ATOM 0 HG3 ARG A 29 -12.007 7.461 -9.766 1.00 54.11 H new ATOM 0 HD2 ARG A 29 -11.179 5.443 -11.844 1.00 71.31 H new ATOM 0 HD3 ARG A 29 -12.753 5.258 -11.097 1.00 71.31 H new ATOM 0 HE ARG A 29 -11.974 7.311 -13.003 1.00 32.24 H new ATOM 0 HH11 ARG A 29 -14.596 6.260 -10.952 1.00 0.15 H new ATOM 0 HH12 ARG A 29 -15.478 7.786 -11.074 1.00 0.15 H new ATOM 0 HH21 ARG A 29 -12.928 9.518 -12.696 1.00 12.45 H new ATOM 0 HH22 ARG A 29 -14.564 9.570 -12.029 1.00 12.45 H new ATOM 476 N ASP A 30 -11.351 9.690 -8.673 1.00 2.55 N ATOM 477 CA ASP A 30 -12.235 10.846 -8.854 1.00 54.42 C ATOM 478 C ASP A 30 -11.809 12.055 -8.003 1.00 63.13 C ATOM 479 O ASP A 30 -12.456 13.104 -8.015 1.00 2.24 O ATOM 480 CB ASP A 30 -13.661 10.387 -8.493 1.00 64.44 C ATOM 481 CG ASP A 30 -14.747 10.937 -9.414 1.00 61.23 C ATOM 482 OD1 ASP A 30 -15.085 12.136 -9.337 1.00 11.11 O ATOM 483 OD2 ASP A 30 -15.358 10.138 -10.166 1.00 23.21 O ATOM 0 H ASP A 30 -11.639 9.101 -7.892 1.00 2.55 H new ATOM 0 HA ASP A 30 -12.183 11.187 -9.888 1.00 54.42 H new ATOM 0 HB2 ASP A 30 -13.697 9.298 -8.517 1.00 64.44 H new ATOM 0 HB3 ASP A 30 -13.880 10.691 -7.469 1.00 64.44 H new ATOM 488 N LEU A 31 -10.711 11.929 -7.247 1.00 42.12 N ATOM 489 CA LEU A 31 -10.148 13.020 -6.444 1.00 51.13 C ATOM 490 C LEU A 31 -9.470 14.103 -7.281 1.00 63.42 C ATOM 491 O LEU A 31 -9.236 15.209 -6.785 1.00 74.21 O ATOM 492 CB LEU A 31 -9.085 12.495 -5.477 1.00 74.34 C ATOM 493 CG LEU A 31 -9.603 11.634 -4.328 1.00 0.24 C ATOM 494 CD1 LEU A 31 -8.419 11.005 -3.589 1.00 11.55 C ATOM 495 CD2 LEU A 31 -10.432 12.472 -3.359 1.00 11.53 C ATOM 0 H LEU A 31 -10.184 11.059 -7.175 1.00 42.12 H new ATOM 0 HA LEU A 31 -11.002 13.448 -5.920 1.00 51.13 H new ATOM 0 HB2 LEU A 31 -8.360 11.912 -6.045 1.00 74.34 H new ATOM 0 HB3 LEU A 31 -8.551 13.347 -5.056 1.00 74.34 H new ATOM 0 HG LEU A 31 -10.240 10.849 -4.736 1.00 0.24 H new ATOM 0 HD11 LEU A 31 -8.788 10.390 -2.768 1.00 11.55 H new ATOM 0 HD12 LEU A 31 -7.847 10.384 -4.279 1.00 11.55 H new ATOM 0 HD13 LEU A 31 -7.778 11.792 -3.193 1.00 11.55 H new ATOM 0 HD21 LEU A 31 -10.792 11.840 -2.547 1.00 11.53 H new ATOM 0 HD22 LEU A 31 -9.815 13.272 -2.950 1.00 11.53 H new ATOM 0 HD23 LEU A 31 -11.282 12.904 -3.887 1.00 11.53 H new ATOM 507 N GLY A 32 -9.091 13.786 -8.520 1.00 33.22 N ATOM 508 CA GLY A 32 -8.415 14.718 -9.405 1.00 15.21 C ATOM 509 C GLY A 32 -7.028 15.153 -8.907 1.00 74.14 C ATOM 510 O GLY A 32 -6.647 16.306 -9.131 1.00 60.41 O ATOM 0 H GLY A 32 -9.249 12.867 -8.934 1.00 33.22 H new ATOM 0 HA2 GLY A 32 -8.310 14.259 -10.388 1.00 15.21 H new ATOM 0 HA3 GLY A 32 -9.039 15.603 -9.531 1.00 15.21 H new ATOM 514 N LEU A 33 -6.313 14.306 -8.159 1.00 22.03 N ATOM 515 CA LEU A 33 -4.947 14.578 -7.684 1.00 73.14 C ATOM 516 C LEU A 33 -3.899 14.246 -8.756 1.00 61.01 C ATOM 517 O LEU A 33 -4.253 13.815 -9.858 1.00 11.51 O ATOM 518 CB LEU A 33 -4.661 13.757 -6.422 1.00 11.35 C ATOM 519 CG LEU A 33 -5.690 13.903 -5.302 1.00 71.10 C ATOM 520 CD1 LEU A 33 -5.349 12.973 -4.137 1.00 44.52 C ATOM 521 CD2 LEU A 33 -5.796 15.337 -4.804 1.00 40.53 C ATOM 0 H LEU A 33 -6.670 13.398 -7.861 1.00 22.03 H new ATOM 0 HA LEU A 33 -4.880 15.643 -7.460 1.00 73.14 H new ATOM 0 HB2 LEU A 33 -4.597 12.705 -6.700 1.00 11.35 H new ATOM 0 HB3 LEU A 33 -3.683 14.045 -6.035 1.00 11.35 H new ATOM 0 HG LEU A 33 -6.658 13.624 -5.719 1.00 71.10 H new ATOM 0 HD11 LEU A 33 -6.092 13.090 -3.348 1.00 44.52 H new ATOM 0 HD12 LEU A 33 -5.348 11.940 -4.484 1.00 44.52 H new ATOM 0 HD13 LEU A 33 -4.363 13.225 -3.747 1.00 44.52 H new ATOM 0 HD21 LEU A 33 -6.539 15.392 -4.009 1.00 40.53 H new ATOM 0 HD22 LEU A 33 -4.829 15.661 -4.420 1.00 40.53 H new ATOM 0 HD23 LEU A 33 -6.096 15.987 -5.626 1.00 40.53 H new ATOM 533 N LYS A 34 -2.606 14.425 -8.433 1.00 71.23 N ATOM 534 CA LYS A 34 -1.499 14.251 -9.374 1.00 60.34 C ATOM 535 C LYS A 34 -0.655 13.045 -8.972 1.00 31.22 C ATOM 536 O LYS A 34 -0.181 12.945 -7.839 1.00 71.32 O ATOM 537 CB LYS A 34 -0.640 15.524 -9.504 1.00 40.51 C ATOM 538 CG LYS A 34 -1.466 16.819 -9.631 1.00 2.44 C ATOM 539 CD LYS A 34 -1.556 17.532 -8.277 1.00 44.14 C ATOM 540 CE LYS A 34 -2.809 18.399 -8.148 1.00 2.53 C ATOM 541 NZ LYS A 34 -2.966 18.885 -6.762 1.00 60.22 N ATOM 0 H LYS A 34 -2.303 14.698 -7.498 1.00 71.23 H new ATOM 0 HA LYS A 34 -1.924 14.066 -10.361 1.00 60.34 H new ATOM 0 HB2 LYS A 34 0.011 15.603 -8.633 1.00 40.51 H new ATOM 0 HB3 LYS A 34 0.006 15.428 -10.377 1.00 40.51 H new ATOM 0 HG2 LYS A 34 -1.007 17.479 -10.367 1.00 2.44 H new ATOM 0 HG3 LYS A 34 -2.467 16.585 -9.993 1.00 2.44 H new ATOM 0 HD2 LYS A 34 -1.549 16.790 -7.479 1.00 44.14 H new ATOM 0 HD3 LYS A 34 -0.672 18.155 -8.140 1.00 44.14 H new ATOM 0 HE2 LYS A 34 -2.743 19.246 -8.831 1.00 2.53 H new ATOM 0 HE3 LYS A 34 -3.688 17.823 -8.439 1.00 2.53 H new ATOM 0 HZ1 LYS A 34 -3.493 19.782 -6.766 1.00 60.22 H new ATOM 0 HZ2 LYS A 34 -3.488 18.179 -6.204 1.00 60.22 H new ATOM 0 HZ3 LYS A 34 -2.028 19.037 -6.339 1.00 60.22 H new ATOM 555 N ASP A 35 -0.483 12.126 -9.923 1.00 0.43 N ATOM 556 CA ASP A 35 0.293 10.881 -9.862 1.00 74.31 C ATOM 557 C ASP A 35 -0.088 9.911 -8.735 1.00 12.43 C ATOM 558 O ASP A 35 0.601 8.913 -8.499 1.00 41.20 O ATOM 559 CB ASP A 35 1.801 11.177 -9.957 1.00 15.32 C ATOM 560 CG ASP A 35 2.316 10.725 -11.319 1.00 41.54 C ATOM 561 OD1 ASP A 35 2.557 9.509 -11.513 1.00 33.03 O ATOM 562 OD2 ASP A 35 2.366 11.557 -12.255 1.00 14.23 O ATOM 0 H ASP A 35 -0.921 12.242 -10.837 1.00 0.43 H new ATOM 0 HA ASP A 35 0.009 10.309 -10.746 1.00 74.31 H new ATOM 0 HB2 ASP A 35 1.984 12.243 -9.821 1.00 15.32 H new ATOM 0 HB3 ASP A 35 2.336 10.658 -9.162 1.00 15.32 H new ATOM 567 N SER A 36 -1.184 10.189 -8.029 1.00 43.41 N ATOM 568 CA SER A 36 -1.577 9.498 -6.817 1.00 53.24 C ATOM 569 C SER A 36 -2.262 8.175 -7.102 1.00 55.34 C ATOM 570 O SER A 36 -3.108 8.102 -8.001 1.00 35.22 O ATOM 571 CB SER A 36 -2.534 10.373 -6.000 1.00 75.03 C ATOM 572 OG SER A 36 -2.410 11.743 -6.304 1.00 52.42 O ATOM 0 H SER A 36 -1.837 10.924 -8.299 1.00 43.41 H new ATOM 0 HA SER A 36 -0.662 9.299 -6.259 1.00 53.24 H new ATOM 0 HB2 SER A 36 -3.560 10.055 -6.186 1.00 75.03 H new ATOM 0 HB3 SER A 36 -2.341 10.222 -4.938 1.00 75.03 H new ATOM 0 HG SER A 36 -2.678 12.276 -5.527 1.00 52.42 H new ATOM 578 N TRP A 37 -1.984 7.156 -6.291 1.00 0.11 N ATOM 579 CA TRP A 37 -2.747 5.924 -6.333 1.00 0.22 C ATOM 580 C TRP A 37 -2.699 5.170 -5.005 1.00 15.42 C ATOM 581 O TRP A 37 -2.004 5.571 -4.068 1.00 71.12 O ATOM 582 CB TRP A 37 -2.327 5.081 -7.542 1.00 72.43 C ATOM 583 CG TRP A 37 -0.914 4.615 -7.691 1.00 21.30 C ATOM 584 CD1 TRP A 37 0.226 5.316 -7.486 1.00 75.21 C ATOM 585 CD2 TRP A 37 -0.499 3.319 -8.199 1.00 43.52 C ATOM 586 NE1 TRP A 37 1.314 4.520 -7.782 1.00 32.21 N ATOM 587 CE2 TRP A 37 0.922 3.270 -8.222 1.00 41.11 C ATOM 588 CE3 TRP A 37 -1.197 2.190 -8.670 1.00 33.14 C ATOM 589 CZ2 TRP A 37 1.612 2.129 -8.655 1.00 21.43 C ATOM 590 CZ3 TRP A 37 -0.525 1.063 -9.155 1.00 54.43 C ATOM 591 CH2 TRP A 37 0.873 1.039 -9.156 1.00 21.01 C ATOM 0 H TRP A 37 -1.235 7.166 -5.599 1.00 0.11 H new ATOM 0 HA TRP A 37 -3.800 6.169 -6.471 1.00 0.22 H new ATOM 0 HB2 TRP A 37 -2.960 4.194 -7.551 1.00 72.43 H new ATOM 0 HB3 TRP A 37 -2.571 5.656 -8.435 1.00 72.43 H new ATOM 0 HD1 TRP A 37 0.276 6.339 -7.144 1.00 75.21 H new ATOM 0 HE1 TRP A 37 2.285 4.817 -7.688 1.00 32.21 H new ATOM 0 HE3 TRP A 37 -2.277 2.194 -8.656 1.00 33.14 H new ATOM 0 HZ2 TRP A 37 2.690 2.086 -8.605 1.00 21.43 H new ATOM 0 HZ3 TRP A 37 -1.083 0.216 -9.527 1.00 54.43 H new ATOM 0 HH2 TRP A 37 1.392 0.176 -9.545 1.00 21.01 H new ATOM 602 N LEU A 38 -3.493 4.099 -4.927 1.00 20.31 N ATOM 603 CA LEU A 38 -3.515 3.156 -3.820 1.00 32.44 C ATOM 604 C LEU A 38 -2.259 2.290 -3.938 1.00 50.42 C ATOM 605 O LEU A 38 -1.986 1.742 -5.013 1.00 2.11 O ATOM 606 CB LEU A 38 -4.792 2.298 -3.911 1.00 63.22 C ATOM 607 CG LEU A 38 -5.039 1.433 -2.658 1.00 10.31 C ATOM 608 CD1 LEU A 38 -5.775 2.218 -1.566 1.00 33.04 C ATOM 609 CD2 LEU A 38 -5.850 0.172 -2.980 1.00 11.22 C ATOM 0 H LEU A 38 -4.159 3.862 -5.662 1.00 20.31 H new ATOM 0 HA LEU A 38 -3.523 3.665 -2.856 1.00 32.44 H new ATOM 0 HB2 LEU A 38 -5.650 2.952 -4.067 1.00 63.22 H new ATOM 0 HB3 LEU A 38 -4.723 1.649 -4.784 1.00 63.22 H new ATOM 0 HG LEU A 38 -4.052 1.142 -2.298 1.00 10.31 H new ATOM 0 HD11 LEU A 38 -5.931 1.576 -0.699 1.00 33.04 H new ATOM 0 HD12 LEU A 38 -5.179 3.083 -1.275 1.00 33.04 H new ATOM 0 HD13 LEU A 38 -6.739 2.554 -1.947 1.00 33.04 H new ATOM 0 HD21 LEU A 38 -6.000 -0.407 -2.069 1.00 11.22 H new ATOM 0 HD22 LEU A 38 -6.818 0.457 -3.392 1.00 11.22 H new ATOM 0 HD23 LEU A 38 -5.309 -0.432 -3.709 1.00 11.22 H new ATOM 621 N ALA A 39 -1.481 2.173 -2.863 1.00 50.35 N ATOM 622 CA ALA A 39 -0.223 1.433 -2.868 1.00 52.14 C ATOM 623 C ALA A 39 0.189 1.121 -1.452 1.00 23.12 C ATOM 624 O ALA A 39 -0.224 1.828 -0.551 1.00 73.25 O ATOM 625 CB ALA A 39 0.885 2.239 -3.541 1.00 2.23 C ATOM 0 H ALA A 39 -1.708 2.591 -1.961 1.00 50.35 H new ATOM 0 HA ALA A 39 -0.376 0.510 -3.427 1.00 52.14 H new ATOM 0 HB1 ALA A 39 1.811 1.664 -3.531 1.00 2.23 H new ATOM 0 HB2 ALA A 39 0.603 2.455 -4.572 1.00 2.23 H new ATOM 0 HB3 ALA A 39 1.033 3.175 -3.002 1.00 2.23 H new ATOM 631 N ALA A 40 1.039 0.117 -1.250 1.00 11.11 N ATOM 632 CA ALA A 40 1.274 -0.459 0.066 1.00 3.30 C ATOM 633 C ALA A 40 -0.033 -0.826 0.795 1.00 24.41 C ATOM 634 O ALA A 40 -1.095 -0.848 0.172 1.00 34.24 O ATOM 635 CB ALA A 40 2.219 0.431 0.869 1.00 52.14 C ATOM 0 H ALA A 40 1.583 -0.318 -1.995 1.00 11.11 H new ATOM 0 HA ALA A 40 1.779 -1.417 -0.057 1.00 3.30 H new ATOM 0 HB1 ALA A 40 2.387 -0.010 1.851 1.00 52.14 H new ATOM 0 HB2 ALA A 40 3.170 0.520 0.343 1.00 52.14 H new ATOM 0 HB3 ALA A 40 1.776 1.420 0.986 1.00 52.14 H new ATOM 641 N GLY A 41 0.061 -1.201 2.076 1.00 63.11 N ATOM 642 CA GLY A 41 -1.022 -1.294 3.049 1.00 74.52 C ATOM 643 C GLY A 41 -2.288 -1.943 2.528 1.00 51.42 C ATOM 644 O GLY A 41 -2.432 -3.161 2.615 1.00 65.52 O ATOM 0 H GLY A 41 0.958 -1.464 2.483 1.00 63.11 H new ATOM 0 HA2 GLY A 41 -0.669 -1.859 3.912 1.00 74.52 H new ATOM 0 HA3 GLY A 41 -1.263 -0.291 3.401 1.00 74.52 H new ATOM 648 N SER A 42 -3.204 -1.138 1.997 1.00 62.52 N ATOM 649 CA SER A 42 -4.482 -1.603 1.489 1.00 10.11 C ATOM 650 C SER A 42 -4.334 -2.516 0.268 1.00 41.55 C ATOM 651 O SER A 42 -5.030 -3.526 0.179 1.00 43.21 O ATOM 652 CB SER A 42 -5.335 -0.376 1.182 1.00 65.22 C ATOM 653 OG SER A 42 -6.240 -0.184 2.249 1.00 53.43 O ATOM 0 H SER A 42 -3.073 -0.130 1.908 1.00 62.52 H new ATOM 0 HA SER A 42 -4.969 -2.219 2.245 1.00 10.11 H new ATOM 0 HB2 SER A 42 -4.703 0.504 1.058 1.00 65.22 H new ATOM 0 HB3 SER A 42 -5.876 -0.515 0.246 1.00 65.22 H new ATOM 0 HG SER A 42 -5.744 0.060 3.058 1.00 53.43 H new ATOM 659 N VAL A 43 -3.372 -2.258 -0.626 1.00 11.32 N ATOM 660 CA VAL A 43 -3.058 -3.194 -1.702 1.00 53.25 C ATOM 661 C VAL A 43 -2.555 -4.520 -1.138 1.00 1.24 C ATOM 662 O VAL A 43 -2.583 -5.512 -1.865 1.00 25.31 O ATOM 663 CB VAL A 43 -2.027 -2.630 -2.695 1.00 31.33 C ATOM 664 CG1 VAL A 43 -1.795 -3.654 -3.826 1.00 13.43 C ATOM 665 CG2 VAL A 43 -2.520 -1.304 -3.273 1.00 63.32 C ATOM 0 H VAL A 43 -2.802 -1.412 -0.623 1.00 11.32 H new ATOM 0 HA VAL A 43 -3.987 -3.358 -2.248 1.00 53.25 H new ATOM 0 HB VAL A 43 -1.086 -2.449 -2.175 1.00 31.33 H new ATOM 0 HG11 VAL A 43 -1.065 -3.258 -4.532 1.00 13.43 H new ATOM 0 HG12 VAL A 43 -1.421 -4.586 -3.402 1.00 13.43 H new ATOM 0 HG13 VAL A 43 -2.735 -3.843 -4.344 1.00 13.43 H new ATOM 0 HG21 VAL A 43 -1.781 -0.916 -3.974 1.00 63.32 H new ATOM 0 HG22 VAL A 43 -3.465 -1.462 -3.792 1.00 63.32 H new ATOM 0 HG23 VAL A 43 -2.666 -0.587 -2.465 1.00 63.32 H new ATOM 675 N ARG A 44 -2.100 -4.583 0.116 1.00 23.14 N ATOM 676 CA ARG A 44 -1.650 -5.824 0.731 1.00 33.30 C ATOM 677 C ARG A 44 -2.643 -6.361 1.794 1.00 45.33 C ATOM 678 O ARG A 44 -2.436 -7.451 2.322 1.00 30.22 O ATOM 679 CB ARG A 44 -0.241 -5.637 1.229 1.00 2.44 C ATOM 680 CG ARG A 44 0.477 -6.934 1.637 1.00 71.15 C ATOM 681 CD ARG A 44 1.953 -6.653 1.943 1.00 24.33 C ATOM 682 NE ARG A 44 2.169 -5.346 2.600 1.00 71.04 N ATOM 683 CZ ARG A 44 1.749 -4.990 3.820 1.00 14.33 C ATOM 684 NH1 ARG A 44 1.088 -5.841 4.589 1.00 53.31 N ATOM 685 NH2 ARG A 44 1.949 -3.761 4.269 1.00 32.24 N ATOM 0 H ARG A 44 -2.035 -3.771 0.730 1.00 23.14 H new ATOM 0 HA ARG A 44 -1.633 -6.617 -0.017 1.00 33.30 H new ATOM 0 HB2 ARG A 44 0.342 -5.145 0.450 1.00 2.44 H new ATOM 0 HB3 ARG A 44 -0.260 -4.964 2.086 1.00 2.44 H new ATOM 0 HG2 ARG A 44 -0.007 -7.365 2.513 1.00 71.15 H new ATOM 0 HG3 ARG A 44 0.398 -7.669 0.836 1.00 71.15 H new ATOM 0 HD2 ARG A 44 2.342 -7.444 2.584 1.00 24.33 H new ATOM 0 HD3 ARG A 44 2.523 -6.685 1.015 1.00 24.33 H new ATOM 0 HE ARG A 44 2.690 -4.646 2.071 1.00 71.04 H new ATOM 0 HH11 ARG A 44 0.892 -6.784 4.254 1.00 53.31 H new ATOM 0 HH12 ARG A 44 0.775 -5.553 5.516 1.00 53.31 H new ATOM 0 HH21 ARG A 44 2.427 -3.076 3.684 1.00 32.24 H new ATOM 0 HH22 ARG A 44 1.625 -3.499 5.200 1.00 32.24 H new ATOM 699 N ASN A 45 -3.756 -5.676 2.055 1.00 41.12 N ATOM 700 CA ASN A 45 -4.911 -6.265 2.742 1.00 54.45 C ATOM 701 C ASN A 45 -5.679 -7.282 1.867 1.00 73.32 C ATOM 702 O ASN A 45 -5.806 -8.450 2.245 1.00 31.12 O ATOM 703 CB ASN A 45 -5.844 -5.141 3.222 1.00 72.55 C ATOM 704 CG ASN A 45 -6.895 -5.694 4.171 1.00 54.02 C ATOM 705 OD1 ASN A 45 -6.582 -5.995 5.317 1.00 11.10 O ATOM 706 ND2 ASN A 45 -8.133 -5.874 3.745 1.00 14.04 N ATOM 0 H ASN A 45 -3.885 -4.698 1.797 1.00 41.12 H new ATOM 0 HA ASN A 45 -4.536 -6.827 3.597 1.00 54.45 H new ATOM 0 HB2 ASN A 45 -5.263 -4.367 3.724 1.00 72.55 H new ATOM 0 HB3 ASN A 45 -6.329 -4.672 2.366 1.00 72.55 H new ATOM 0 HD21 ASN A 45 -8.836 -6.266 4.372 1.00 14.04 H new ATOM 0 HD22 ASN A 45 -8.386 -5.621 2.790 1.00 14.04 H new ATOM 713 N PHE A 46 -6.208 -6.841 0.716 1.00 52.03 N ATOM 714 CA PHE A 46 -7.207 -7.511 -0.143 1.00 30.30 C ATOM 715 C PHE A 46 -6.774 -8.841 -0.824 1.00 31.31 C ATOM 716 O PHE A 46 -7.558 -9.468 -1.534 1.00 64.02 O ATOM 717 CB PHE A 46 -7.705 -6.483 -1.182 1.00 64.43 C ATOM 718 CG PHE A 46 -7.015 -6.502 -2.534 1.00 65.15 C ATOM 719 CD1 PHE A 46 -5.728 -5.973 -2.683 1.00 23.11 C ATOM 720 CD2 PHE A 46 -7.659 -7.068 -3.649 1.00 53.21 C ATOM 721 CE1 PHE A 46 -5.102 -6.008 -3.937 1.00 52.54 C ATOM 722 CE2 PHE A 46 -7.039 -7.125 -4.912 1.00 45.12 C ATOM 723 CZ PHE A 46 -5.746 -6.569 -5.050 1.00 73.05 C ATOM 0 H PHE A 46 -5.930 -5.939 0.329 1.00 52.03 H new ATOM 0 HA PHE A 46 -8.003 -7.844 0.524 1.00 30.30 H new ATOM 0 HB2 PHE A 46 -8.771 -6.646 -1.340 1.00 64.43 H new ATOM 0 HB3 PHE A 46 -7.595 -5.486 -0.756 1.00 64.43 H new ATOM 0 HD1 PHE A 46 -5.219 -5.539 -1.835 1.00 23.11 H new ATOM 0 HD2 PHE A 46 -8.655 -7.469 -3.533 1.00 53.21 H new ATOM 0 HE1 PHE A 46 -4.109 -5.597 -4.048 1.00 52.54 H new ATOM 0 HE2 PHE A 46 -7.538 -7.582 -5.754 1.00 45.12 H new ATOM 0 HZ PHE A 46 -5.255 -6.576 -6.012 1.00 73.05 H new ATOM 733 N ILE A 47 -5.525 -9.274 -0.654 1.00 41.35 N ATOM 734 CA ILE A 47 -4.874 -10.488 -1.169 1.00 73.25 C ATOM 735 C ILE A 47 -4.518 -11.423 -0.023 1.00 3.50 C ATOM 736 O ILE A 47 -4.567 -12.630 -0.195 1.00 13.13 O ATOM 737 CB ILE A 47 -3.553 -10.102 -1.882 1.00 33.33 C ATOM 738 CG1 ILE A 47 -3.807 -9.299 -3.154 1.00 72.22 C ATOM 739 CG2 ILE A 47 -2.510 -11.217 -2.073 1.00 34.32 C ATOM 740 CD1 ILE A 47 -2.592 -8.527 -3.652 1.00 51.54 C ATOM 0 H ILE A 47 -4.871 -8.728 -0.093 1.00 41.35 H new ATOM 0 HA ILE A 47 -5.562 -10.980 -1.857 1.00 73.25 H new ATOM 0 HB ILE A 47 -3.058 -9.453 -1.159 1.00 33.33 H new ATOM 0 HG12 ILE A 47 -4.140 -9.977 -3.939 1.00 72.22 H new ATOM 0 HG13 ILE A 47 -4.621 -8.597 -2.972 1.00 72.22 H new ATOM 0 HG21 ILE A 47 -1.636 -10.814 -2.584 1.00 34.32 H new ATOM 0 HG22 ILE A 47 -2.213 -11.608 -1.100 1.00 34.32 H new ATOM 0 HG23 ILE A 47 -2.941 -12.020 -2.671 1.00 34.32 H new ATOM 0 HD11 ILE A 47 -2.854 -7.982 -4.559 1.00 51.54 H new ATOM 0 HD12 ILE A 47 -2.270 -7.822 -2.886 1.00 51.54 H new ATOM 0 HD13 ILE A 47 -1.782 -9.223 -3.868 1.00 51.54 H new ATOM 752 N TRP A 48 -4.052 -10.897 1.109 1.00 45.14 N ATOM 753 CA TRP A 48 -3.501 -11.734 2.166 1.00 42.41 C ATOM 754 C TRP A 48 -4.648 -12.444 2.871 1.00 74.35 C ATOM 755 O TRP A 48 -4.699 -13.670 2.911 1.00 22.33 O ATOM 756 CB TRP A 48 -2.657 -10.869 3.113 1.00 22.22 C ATOM 757 CG TRP A 48 -1.167 -10.793 2.863 1.00 31.30 C ATOM 758 CD1 TRP A 48 -0.453 -11.542 1.989 1.00 41.32 C ATOM 759 CD2 TRP A 48 -0.166 -10.031 3.612 1.00 13.42 C ATOM 760 NE1 TRP A 48 0.894 -11.299 2.149 1.00 32.00 N ATOM 761 CE2 TRP A 48 1.136 -10.415 3.174 1.00 52.31 C ATOM 762 CE3 TRP A 48 -0.227 -9.133 4.699 1.00 71.24 C ATOM 763 CZ2 TRP A 48 2.310 -9.948 3.788 1.00 12.14 C ATOM 764 CZ3 TRP A 48 0.938 -8.695 5.354 1.00 22.51 C ATOM 765 CH2 TRP A 48 2.205 -9.085 4.891 1.00 13.41 C ATOM 0 H TRP A 48 -4.046 -9.898 1.314 1.00 45.14 H new ATOM 0 HA TRP A 48 -2.838 -12.499 1.762 1.00 42.41 H new ATOM 0 HB2 TRP A 48 -3.054 -9.854 3.082 1.00 22.22 H new ATOM 0 HB3 TRP A 48 -2.808 -11.239 4.127 1.00 22.22 H new ATOM 0 HD1 TRP A 48 -0.877 -12.229 1.272 1.00 41.32 H new ATOM 0 HE1 TRP A 48 1.623 -11.724 1.576 1.00 32.00 H new ATOM 0 HE3 TRP A 48 -1.189 -8.774 5.035 1.00 71.24 H new ATOM 0 HZ2 TRP A 48 3.279 -10.248 3.417 1.00 12.14 H new ATOM 0 HZ3 TRP A 48 0.858 -8.054 6.219 1.00 22.51 H new ATOM 0 HH2 TRP A 48 3.096 -8.722 5.382 1.00 13.41 H new ATOM 776 N ASN A 49 -5.607 -11.660 3.360 1.00 31.41 N ATOM 777 CA ASN A 49 -6.825 -12.134 4.002 1.00 41.31 C ATOM 778 C ASN A 49 -7.566 -13.203 3.194 1.00 54.41 C ATOM 779 O ASN A 49 -8.097 -14.124 3.811 1.00 34.40 O ATOM 780 CB ASN A 49 -7.778 -10.960 4.218 1.00 43.14 C ATOM 781 CG ASN A 49 -7.364 -9.990 5.306 1.00 73.23 C ATOM 782 OD1 ASN A 49 -6.918 -10.405 6.363 1.00 25.14 O ATOM 783 ND2 ASN A 49 -7.490 -8.702 5.078 1.00 23.30 N ATOM 0 H ASN A 49 -5.552 -10.642 3.317 1.00 31.41 H new ATOM 0 HA ASN A 49 -6.516 -12.585 4.945 1.00 41.31 H new ATOM 0 HB2 ASN A 49 -7.873 -10.412 3.281 1.00 43.14 H new ATOM 0 HB3 ASN A 49 -8.766 -11.353 4.459 1.00 43.14 H new ATOM 0 HD21 ASN A 49 -7.213 -8.028 5.792 1.00 23.30 H new ATOM 0 HD22 ASN A 49 -7.865 -8.376 4.187 1.00 23.30 H new ATOM 790 N LEU A 50 -7.592 -13.109 1.852 1.00 41.41 N ATOM 791 CA LEU A 50 -8.201 -14.065 0.935 1.00 21.12 C ATOM 792 C LEU A 50 -7.729 -15.492 1.214 1.00 2.00 C ATOM 793 O LEU A 50 -8.462 -16.439 0.961 1.00 73.14 O ATOM 794 CB LEU A 50 -7.723 -13.742 -0.492 1.00 63.44 C ATOM 795 CG LEU A 50 -8.295 -12.543 -1.240 1.00 54.41 C ATOM 796 CD1 LEU A 50 -7.668 -12.511 -2.644 1.00 23.21 C ATOM 797 CD2 LEU A 50 -9.808 -12.582 -1.430 1.00 2.53 C ATOM 0 H LEU A 50 -7.165 -12.322 1.363 1.00 41.41 H new ATOM 0 HA LEU A 50 -9.282 -13.994 1.056 1.00 21.12 H new ATOM 0 HB2 LEU A 50 -6.642 -13.610 -0.448 1.00 63.44 H new ATOM 0 HB3 LEU A 50 -7.912 -14.624 -1.103 1.00 63.44 H new ATOM 0 HG LEU A 50 -8.064 -11.667 -0.634 1.00 54.41 H new ATOM 0 HD11 LEU A 50 -8.063 -11.660 -3.199 1.00 23.21 H new ATOM 0 HD12 LEU A 50 -6.586 -12.417 -2.557 1.00 23.21 H new ATOM 0 HD13 LEU A 50 -7.911 -13.433 -3.172 1.00 23.21 H new ATOM 0 HD21 LEU A 50 -10.130 -11.692 -1.971 1.00 2.53 H new ATOM 0 HD22 LEU A 50 -10.080 -13.471 -1.999 1.00 2.53 H new ATOM 0 HD23 LEU A 50 -10.296 -12.611 -0.456 1.00 2.53 H new ATOM 809 N LEU A 51 -6.481 -15.646 1.668 1.00 1.13 N ATOM 810 CA LEU A 51 -5.794 -16.921 1.822 1.00 61.31 C ATOM 811 C LEU A 51 -5.724 -17.299 3.311 1.00 43.13 C ATOM 812 O LEU A 51 -5.171 -18.344 3.640 1.00 51.45 O ATOM 813 CB LEU A 51 -4.368 -16.838 1.231 1.00 44.04 C ATOM 814 CG LEU A 51 -4.170 -16.021 -0.068 1.00 31.24 C ATOM 815 CD1 LEU A 51 -2.710 -15.586 -0.270 1.00 25.01 C ATOM 816 CD2 LEU A 51 -4.681 -16.793 -1.283 1.00 41.41 C ATOM 0 H LEU A 51 -5.904 -14.852 1.947 1.00 1.13 H new ATOM 0 HA LEU A 51 -6.351 -17.688 1.283 1.00 61.31 H new ATOM 0 HB2 LEU A 51 -3.714 -16.417 1.994 1.00 44.04 H new ATOM 0 HB3 LEU A 51 -4.024 -17.855 1.042 1.00 44.04 H new ATOM 0 HG LEU A 51 -4.761 -15.111 0.038 1.00 31.24 H new ATOM 0 HD11 LEU A 51 -2.625 -15.016 -1.195 1.00 25.01 H new ATOM 0 HD12 LEU A 51 -2.396 -14.965 0.569 1.00 25.01 H new ATOM 0 HD13 LEU A 51 -2.072 -16.468 -0.327 1.00 25.01 H new ATOM 0 HD21 LEU A 51 -4.530 -16.197 -2.183 1.00 41.41 H new ATOM 0 HD22 LEU A 51 -4.134 -17.732 -1.374 1.00 41.41 H new ATOM 0 HD23 LEU A 51 -5.744 -17.002 -1.160 1.00 41.41 H new ATOM 828 N SER A 52 -6.234 -16.451 4.214 1.00 1.11 N ATOM 829 CA SER A 52 -6.068 -16.543 5.663 1.00 70.15 C ATOM 830 C SER A 52 -7.403 -16.589 6.404 1.00 22.51 C ATOM 831 O SER A 52 -7.414 -16.454 7.621 1.00 42.23 O ATOM 832 CB SER A 52 -5.219 -15.362 6.156 1.00 54.03 C ATOM 833 OG SER A 52 -3.840 -15.639 6.029 1.00 52.13 O ATOM 0 H SER A 52 -6.798 -15.647 3.938 1.00 1.11 H new ATOM 0 HA SER A 52 -5.559 -17.482 5.880 1.00 70.15 H new ATOM 0 HB2 SER A 52 -5.468 -14.468 5.584 1.00 54.03 H new ATOM 0 HB3 SER A 52 -5.456 -15.150 7.199 1.00 54.03 H new ATOM 0 HG SER A 52 -3.326 -14.822 6.195 1.00 52.13 H new ATOM 839 N ASP A 53 -8.519 -16.747 5.692 1.00 10.00 N ATOM 840 CA ASP A 53 -9.872 -16.961 6.209 1.00 65.11 C ATOM 841 C ASP A 53 -10.421 -15.788 7.037 1.00 50.32 C ATOM 842 O ASP A 53 -11.474 -15.857 7.676 1.00 63.43 O ATOM 843 CB ASP A 53 -9.995 -18.348 6.852 1.00 72.44 C ATOM 844 CG ASP A 53 -9.366 -18.525 8.239 1.00 24.24 C ATOM 845 OD1 ASP A 53 -9.986 -18.144 9.255 1.00 1.32 O ATOM 846 OD2 ASP A 53 -8.323 -19.228 8.317 1.00 14.31 O ATOM 0 H ASP A 53 -8.501 -16.728 4.672 1.00 10.00 H new ATOM 0 HA ASP A 53 -10.555 -16.968 5.360 1.00 65.11 H new ATOM 0 HB2 ASP A 53 -11.054 -18.596 6.925 1.00 72.44 H new ATOM 0 HB3 ASP A 53 -9.543 -19.076 6.178 1.00 72.44 H new ATOM 851 N LYS A 54 -9.719 -14.661 6.930 1.00 65.25 N ATOM 852 CA LYS A 54 -9.987 -13.335 7.467 1.00 14.21 C ATOM 853 C LYS A 54 -11.081 -12.638 6.659 1.00 42.21 C ATOM 854 O LYS A 54 -11.785 -13.266 5.882 1.00 11.40 O ATOM 855 CB LYS A 54 -8.669 -12.567 7.393 1.00 71.32 C ATOM 856 CG LYS A 54 -7.610 -13.125 8.350 1.00 53.32 C ATOM 857 CD LYS A 54 -7.610 -12.350 9.658 1.00 1.00 C ATOM 858 CE LYS A 54 -6.907 -11.004 9.519 1.00 10.22 C ATOM 859 NZ LYS A 54 -7.787 -9.893 9.945 1.00 32.41 N ATOM 0 H LYS A 54 -8.847 -14.660 6.402 1.00 65.25 H new ATOM 0 HA LYS A 54 -10.347 -13.387 8.495 1.00 14.21 H new ATOM 0 HB2 LYS A 54 -8.287 -12.604 6.373 1.00 71.32 H new ATOM 0 HB3 LYS A 54 -8.850 -11.518 7.628 1.00 71.32 H new ATOM 0 HG2 LYS A 54 -7.808 -14.179 8.545 1.00 53.32 H new ATOM 0 HG3 LYS A 54 -6.625 -13.066 7.886 1.00 53.32 H new ATOM 0 HD2 LYS A 54 -8.637 -12.191 9.986 1.00 1.00 H new ATOM 0 HD3 LYS A 54 -7.116 -12.940 10.430 1.00 1.00 H new ATOM 0 HE2 LYS A 54 -5.998 -11.002 10.120 1.00 10.22 H new ATOM 0 HE3 LYS A 54 -6.604 -10.854 8.483 1.00 10.22 H new ATOM 0 HZ1 LYS A 54 -7.282 -8.990 9.839 1.00 32.41 H new ATOM 0 HZ2 LYS A 54 -8.643 -9.882 9.354 1.00 32.41 H new ATOM 0 HZ3 LYS A 54 -8.055 -10.025 10.941 1.00 32.41 H new ATOM 873 N SER A 55 -11.215 -11.321 6.835 1.00 2.20 N ATOM 874 CA SER A 55 -12.100 -10.459 6.070 1.00 63.14 C ATOM 875 C SER A 55 -11.290 -9.631 5.072 1.00 12.33 C ATOM 876 O SER A 55 -10.759 -8.578 5.408 1.00 21.30 O ATOM 877 CB SER A 55 -12.957 -9.617 7.011 1.00 42.13 C ATOM 878 OG SER A 55 -14.124 -9.146 6.378 1.00 70.33 O ATOM 0 H SER A 55 -10.686 -10.813 7.544 1.00 2.20 H new ATOM 0 HA SER A 55 -12.793 -11.060 5.481 1.00 63.14 H new ATOM 0 HB2 SER A 55 -13.231 -10.212 7.882 1.00 42.13 H new ATOM 0 HB3 SER A 55 -12.374 -8.771 7.374 1.00 42.13 H new ATOM 0 HG SER A 55 -14.648 -8.613 7.012 1.00 70.33 H new ATOM 884 N PRO A 56 -11.046 -10.161 3.856 1.00 30.24 N ATOM 885 CA PRO A 56 -10.386 -9.407 2.804 1.00 54.13 C ATOM 886 C PRO A 56 -11.114 -8.108 2.463 1.00 12.03 C ATOM 887 O PRO A 56 -10.452 -7.145 2.076 1.00 44.23 O ATOM 888 CB PRO A 56 -10.278 -10.376 1.620 1.00 73.11 C ATOM 889 CG PRO A 56 -11.380 -11.399 1.867 1.00 71.45 C ATOM 890 CD PRO A 56 -11.497 -11.450 3.374 1.00 72.32 C ATOM 0 HA PRO A 56 -9.400 -9.063 3.115 1.00 54.13 H new ATOM 0 HB2 PRO A 56 -10.420 -9.860 0.670 1.00 73.11 H new ATOM 0 HB3 PRO A 56 -9.297 -10.850 1.582 1.00 73.11 H new ATOM 0 HG2 PRO A 56 -12.319 -11.095 1.403 1.00 71.45 H new ATOM 0 HG3 PRO A 56 -11.121 -12.373 1.453 1.00 71.45 H new ATOM 0 HD2 PRO A 56 -12.526 -11.642 3.679 1.00 72.32 H new ATOM 0 HD3 PRO A 56 -10.888 -12.255 3.785 1.00 72.32 H new ATOM 898 N PHE A 57 -12.425 -8.040 2.698 1.00 31.41 N ATOM 899 CA PHE A 57 -13.243 -6.874 2.417 1.00 23.54 C ATOM 900 C PHE A 57 -13.581 -6.166 3.716 1.00 50.02 C ATOM 901 O PHE A 57 -14.737 -5.861 4.000 1.00 10.14 O ATOM 902 CB PHE A 57 -14.458 -7.288 1.581 1.00 54.21 C ATOM 903 CG PHE A 57 -14.111 -8.144 0.380 1.00 61.54 C ATOM 904 CD1 PHE A 57 -13.508 -7.542 -0.730 1.00 4.30 C ATOM 905 CD2 PHE A 57 -14.364 -9.526 0.362 1.00 72.21 C ATOM 906 CE1 PHE A 57 -13.238 -8.289 -1.889 1.00 12.21 C ATOM 907 CE2 PHE A 57 -14.050 -10.291 -0.774 1.00 64.24 C ATOM 908 CZ PHE A 57 -13.502 -9.667 -1.907 1.00 30.40 C ATOM 0 H PHE A 57 -12.954 -8.815 3.098 1.00 31.41 H new ATOM 0 HA PHE A 57 -12.701 -6.147 1.813 1.00 23.54 H new ATOM 0 HB2 PHE A 57 -15.155 -7.835 2.216 1.00 54.21 H new ATOM 0 HB3 PHE A 57 -14.975 -6.391 1.239 1.00 54.21 H new ATOM 0 HD1 PHE A 57 -13.248 -6.494 -0.696 1.00 4.30 H new ATOM 0 HD2 PHE A 57 -14.802 -10.003 1.226 1.00 72.21 H new ATOM 0 HE1 PHE A 57 -12.829 -7.804 -2.763 1.00 12.21 H new ATOM 0 HE2 PHE A 57 -14.229 -11.356 -0.776 1.00 64.24 H new ATOM 0 HZ PHE A 57 -13.284 -10.247 -2.791 1.00 30.40 H new ATOM 918 N ASP A 58 -12.546 -5.900 4.507 1.00 65.42 N ATOM 919 CA ASP A 58 -12.719 -5.379 5.854 1.00 64.35 C ATOM 920 C ASP A 58 -13.209 -3.929 5.833 1.00 1.00 C ATOM 921 O ASP A 58 -14.026 -3.550 6.667 1.00 62.53 O ATOM 922 CB ASP A 58 -11.411 -5.488 6.663 1.00 23.54 C ATOM 923 CG ASP A 58 -11.588 -6.198 8.009 1.00 11.31 C ATOM 924 OD1 ASP A 58 -12.538 -5.877 8.764 1.00 13.02 O ATOM 925 OD2 ASP A 58 -10.741 -7.052 8.345 1.00 13.21 O ATOM 0 H ASP A 58 -11.573 -6.039 4.233 1.00 65.42 H new ATOM 0 HA ASP A 58 -13.480 -5.988 6.342 1.00 64.35 H new ATOM 0 HB2 ASP A 58 -10.670 -6.025 6.071 1.00 23.54 H new ATOM 0 HB3 ASP A 58 -11.015 -4.487 6.837 1.00 23.54 H new ATOM 930 N HIS A 59 -12.683 -3.136 4.887 1.00 2.13 N ATOM 931 CA HIS A 59 -12.768 -1.685 4.641 1.00 53.15 C ATOM 932 C HIS A 59 -12.451 -0.761 5.822 1.00 45.34 C ATOM 933 O HIS A 59 -12.118 0.404 5.611 1.00 62.55 O ATOM 934 CB HIS A 59 -14.069 -1.295 3.921 1.00 25.31 C ATOM 935 CG HIS A 59 -15.211 -0.843 4.799 1.00 33.34 C ATOM 936 ND1 HIS A 59 -15.476 0.465 5.150 1.00 52.02 N ATOM 937 CD2 HIS A 59 -16.218 -1.621 5.312 1.00 64.42 C ATOM 938 CE1 HIS A 59 -16.641 0.478 5.808 1.00 22.42 C ATOM 939 NE2 HIS A 59 -17.138 -0.766 5.926 1.00 51.42 N ATOM 0 H HIS A 59 -12.100 -3.564 4.168 1.00 2.13 H new ATOM 0 HA HIS A 59 -11.932 -1.501 3.967 1.00 53.15 H new ATOM 0 HB2 HIS A 59 -13.843 -0.495 3.216 1.00 25.31 H new ATOM 0 HB3 HIS A 59 -14.406 -2.151 3.336 1.00 25.31 H new ATOM 0 HD1 HIS A 59 -14.890 1.275 4.945 1.00 52.02 H new ATOM 0 HD2 HIS A 59 -16.287 -2.697 5.252 1.00 64.42 H new ATOM 0 HE1 HIS A 59 -17.118 1.368 6.192 1.00 22.42 H new ATOM 947 N GLU A 60 -12.449 -1.278 7.039 1.00 32.11 N ATOM 948 CA GLU A 60 -12.168 -0.614 8.294 1.00 45.03 C ATOM 949 C GLU A 60 -10.702 -0.909 8.617 1.00 53.11 C ATOM 950 O GLU A 60 -10.347 -1.478 9.654 1.00 54.02 O ATOM 951 CB GLU A 60 -13.119 -1.133 9.375 1.00 34.14 C ATOM 952 CG GLU A 60 -14.607 -0.846 9.101 1.00 62.22 C ATOM 953 CD GLU A 60 -15.514 -1.364 10.223 1.00 21.54 C ATOM 954 OE1 GLU A 60 -15.063 -1.441 11.388 1.00 62.33 O ATOM 955 OE2 GLU A 60 -16.716 -1.623 9.966 1.00 45.45 O ATOM 0 H GLU A 60 -12.664 -2.265 7.183 1.00 32.11 H new ATOM 0 HA GLU A 60 -12.323 0.463 8.239 1.00 45.03 H new ATOM 0 HB2 GLU A 60 -12.981 -2.209 9.477 1.00 34.14 H new ATOM 0 HB3 GLU A 60 -12.844 -0.685 10.330 1.00 34.14 H new ATOM 0 HG2 GLU A 60 -14.753 0.228 8.985 1.00 62.22 H new ATOM 0 HG3 GLU A 60 -14.897 -1.310 8.158 1.00 62.22 H new ATOM 962 N THR A 61 -9.858 -0.618 7.637 1.00 71.32 N ATOM 963 CA THR A 61 -8.408 -0.719 7.702 1.00 22.53 C ATOM 964 C THR A 61 -7.780 0.567 7.137 1.00 24.10 C ATOM 965 O THR A 61 -8.503 1.433 6.651 1.00 53.45 O ATOM 966 CB THR A 61 -7.982 -2.031 7.016 1.00 74.45 C ATOM 967 OG1 THR A 61 -6.717 -2.441 7.486 1.00 52.02 O ATOM 968 CG2 THR A 61 -7.955 -1.966 5.486 1.00 70.41 C ATOM 0 H THR A 61 -10.184 -0.288 6.728 1.00 71.32 H new ATOM 0 HA THR A 61 -8.036 -0.783 8.725 1.00 22.53 H new ATOM 0 HB THR A 61 -8.750 -2.757 7.281 1.00 74.45 H new ATOM 0 HG1 THR A 61 -6.459 -3.276 7.044 1.00 52.02 H new ATOM 0 HG21 THR A 61 -7.645 -2.931 5.086 1.00 70.41 H new ATOM 0 HG22 THR A 61 -8.950 -1.722 5.115 1.00 70.41 H new ATOM 0 HG23 THR A 61 -7.251 -1.198 5.167 1.00 70.41 H new ATOM 976 N ASP A 62 -6.461 0.730 7.260 1.00 13.30 N ATOM 977 CA ASP A 62 -5.706 1.904 6.814 1.00 31.13 C ATOM 978 C ASP A 62 -5.527 1.876 5.287 1.00 11.13 C ATOM 979 O ASP A 62 -5.151 0.850 4.704 1.00 32.40 O ATOM 980 CB ASP A 62 -4.346 2.067 7.551 1.00 21.10 C ATOM 981 CG ASP A 62 -3.536 0.808 7.923 1.00 3.41 C ATOM 982 OD1 ASP A 62 -4.129 -0.192 8.395 1.00 72.11 O ATOM 983 OD2 ASP A 62 -2.284 0.845 8.008 1.00 50.41 O ATOM 0 H ASP A 62 -5.866 0.021 7.689 1.00 13.30 H new ATOM 0 HA ASP A 62 -6.292 2.784 7.079 1.00 31.13 H new ATOM 0 HB2 ASP A 62 -3.709 2.695 6.928 1.00 21.10 H new ATOM 0 HB3 ASP A 62 -4.536 2.619 8.472 1.00 21.10 H new ATOM 988 N ILE A 63 -5.816 3.001 4.622 1.00 74.42 N ATOM 989 CA ILE A 63 -5.942 3.125 3.172 1.00 65.53 C ATOM 990 C ILE A 63 -4.852 4.074 2.686 1.00 54.41 C ATOM 991 O ILE A 63 -5.030 5.289 2.641 1.00 53.32 O ATOM 992 CB ILE A 63 -7.356 3.587 2.734 1.00 34.40 C ATOM 993 CG1 ILE A 63 -8.531 2.954 3.506 1.00 43.22 C ATOM 994 CG2 ILE A 63 -7.501 3.363 1.227 1.00 53.05 C ATOM 995 CD1 ILE A 63 -8.558 1.427 3.554 1.00 63.35 C ATOM 0 H ILE A 63 -5.975 3.886 5.104 1.00 74.42 H new ATOM 0 HA ILE A 63 -5.812 2.145 2.713 1.00 65.53 H new ATOM 0 HB ILE A 63 -7.424 4.646 2.984 1.00 34.40 H new ATOM 0 HG12 ILE A 63 -8.511 3.329 4.529 1.00 43.22 H new ATOM 0 HG13 ILE A 63 -9.462 3.300 3.058 1.00 43.22 H new ATOM 0 HG21 ILE A 63 -8.492 3.684 0.905 1.00 53.05 H new ATOM 0 HG22 ILE A 63 -6.743 3.941 0.699 1.00 53.05 H new ATOM 0 HG23 ILE A 63 -7.372 2.304 1.002 1.00 53.05 H new ATOM 0 HD11 ILE A 63 -9.427 1.096 4.122 1.00 63.35 H new ATOM 0 HD12 ILE A 63 -8.616 1.032 2.540 1.00 63.35 H new ATOM 0 HD13 ILE A 63 -7.650 1.062 4.034 1.00 63.35 H new ATOM 1007 N ASP A 64 -3.705 3.524 2.311 1.00 14.40 N ATOM 1008 CA ASP A 64 -2.656 4.305 1.665 1.00 33.20 C ATOM 1009 C ASP A 64 -3.072 4.778 0.306 1.00 61.02 C ATOM 1010 O ASP A 64 -3.627 4.049 -0.511 1.00 25.04 O ATOM 1011 CB ASP A 64 -1.363 3.508 1.517 1.00 70.41 C ATOM 1012 CG ASP A 64 -0.293 3.882 2.518 1.00 25.14 C ATOM 1013 OD1 ASP A 64 0.034 5.087 2.610 1.00 62.33 O ATOM 1014 OD2 ASP A 64 0.230 2.976 3.203 1.00 63.13 O ATOM 0 H ASP A 64 -3.476 2.539 2.443 1.00 14.40 H new ATOM 0 HA ASP A 64 -2.483 5.163 2.314 1.00 33.20 H new ATOM 0 HB2 ASP A 64 -1.588 2.447 1.621 1.00 70.41 H new ATOM 0 HB3 ASP A 64 -0.971 3.654 0.510 1.00 70.41 H new ATOM 1019 N VAL A 65 -2.717 6.030 0.101 1.00 4.13 N ATOM 1020 CA VAL A 65 -3.071 6.899 -0.970 1.00 54.22 C ATOM 1021 C VAL A 65 -1.883 7.839 -1.183 1.00 42.31 C ATOM 1022 O VAL A 65 -1.947 9.051 -0.949 1.00 41.32 O ATOM 1023 CB VAL A 65 -4.350 7.632 -0.563 1.00 15.24 C ATOM 1024 CG1 VAL A 65 -5.626 6.850 -0.869 1.00 40.11 C ATOM 1025 CG2 VAL A 65 -4.428 8.135 0.875 1.00 15.52 C ATOM 0 H VAL A 65 -2.104 6.503 0.765 1.00 4.13 H new ATOM 0 HA VAL A 65 -3.273 6.383 -1.909 1.00 54.22 H new ATOM 0 HB VAL A 65 -4.283 8.515 -1.199 1.00 15.24 H new ATOM 0 HG11 VAL A 65 -6.493 7.431 -0.554 1.00 40.11 H new ATOM 0 HG12 VAL A 65 -5.687 6.659 -1.940 1.00 40.11 H new ATOM 0 HG13 VAL A 65 -5.609 5.902 -0.332 1.00 40.11 H new ATOM 0 HG21 VAL A 65 -5.383 8.635 1.034 1.00 15.52 H new ATOM 0 HG22 VAL A 65 -4.341 7.292 1.561 1.00 15.52 H new ATOM 0 HG23 VAL A 65 -3.615 8.837 1.059 1.00 15.52 H new ATOM 1035 N ILE A 66 -0.772 7.278 -1.637 1.00 55.50 N ATOM 1036 CA ILE A 66 0.406 8.069 -1.921 1.00 61.14 C ATOM 1037 C ILE A 66 0.104 8.974 -3.109 1.00 21.21 C ATOM 1038 O ILE A 66 -0.569 8.550 -4.053 1.00 62.30 O ATOM 1039 CB ILE A 66 1.625 7.156 -2.145 1.00 55.43 C ATOM 1040 CG1 ILE A 66 1.532 6.192 -3.348 1.00 60.24 C ATOM 1041 CG2 ILE A 66 1.900 6.353 -0.872 1.00 32.03 C ATOM 1042 CD1 ILE A 66 2.364 6.672 -4.536 1.00 35.14 C ATOM 0 H ILE A 66 -0.666 6.279 -1.815 1.00 55.50 H new ATOM 0 HA ILE A 66 0.662 8.704 -1.073 1.00 61.14 H new ATOM 0 HB ILE A 66 2.444 7.833 -2.387 1.00 55.43 H new ATOM 0 HG12 ILE A 66 1.871 5.201 -3.045 1.00 60.24 H new ATOM 0 HG13 ILE A 66 0.490 6.093 -3.652 1.00 60.24 H new ATOM 0 HG21 ILE A 66 2.763 5.706 -1.029 1.00 32.03 H new ATOM 0 HG22 ILE A 66 2.104 7.036 -0.048 1.00 32.03 H new ATOM 0 HG23 ILE A 66 1.029 5.744 -0.631 1.00 32.03 H new ATOM 0 HD11 ILE A 66 2.268 5.963 -5.358 1.00 35.14 H new ATOM 0 HD12 ILE A 66 2.008 7.651 -4.858 1.00 35.14 H new ATOM 0 HD13 ILE A 66 3.411 6.746 -4.241 1.00 35.14 H new ATOM 1054 N PHE A 67 0.601 10.208 -3.063 1.00 63.40 N ATOM 1055 CA PHE A 67 0.566 11.165 -4.164 1.00 53.43 C ATOM 1056 C PHE A 67 1.924 11.828 -4.348 1.00 40.54 C ATOM 1057 O PHE A 67 2.797 11.724 -3.484 1.00 55.30 O ATOM 1058 CB PHE A 67 -0.547 12.214 -3.989 1.00 42.10 C ATOM 1059 CG PHE A 67 -0.375 13.241 -2.903 1.00 13.54 C ATOM 1060 CD1 PHE A 67 -0.357 12.852 -1.554 1.00 42.13 C ATOM 1061 CD2 PHE A 67 -0.346 14.604 -3.245 1.00 2.11 C ATOM 1062 CE1 PHE A 67 -0.248 13.828 -0.552 1.00 24.12 C ATOM 1063 CE2 PHE A 67 -0.198 15.575 -2.242 1.00 71.00 C ATOM 1064 CZ PHE A 67 -0.157 15.187 -0.899 1.00 55.10 C ATOM 0 H PHE A 67 1.055 10.581 -2.229 1.00 63.40 H new ATOM 0 HA PHE A 67 0.332 10.606 -5.070 1.00 53.43 H new ATOM 0 HB2 PHE A 67 -0.662 12.743 -4.935 1.00 42.10 H new ATOM 0 HB3 PHE A 67 -1.481 11.684 -3.805 1.00 42.10 H new ATOM 0 HD1 PHE A 67 -0.427 11.807 -1.289 1.00 42.13 H new ATOM 0 HD2 PHE A 67 -0.437 14.904 -4.278 1.00 2.11 H new ATOM 0 HE1 PHE A 67 -0.234 13.535 0.487 1.00 24.12 H new ATOM 0 HE2 PHE A 67 -0.116 16.619 -2.507 1.00 71.00 H new ATOM 0 HZ PHE A 67 -0.055 15.934 -0.126 1.00 55.10 H new ATOM 1074 N PHE A 68 2.085 12.508 -5.483 1.00 31.35 N ATOM 1075 CA PHE A 68 3.263 13.268 -5.844 1.00 42.31 C ATOM 1076 C PHE A 68 2.744 14.624 -6.316 1.00 34.31 C ATOM 1077 O PHE A 68 2.255 14.745 -7.437 1.00 71.11 O ATOM 1078 CB PHE A 68 4.049 12.513 -6.929 1.00 35.34 C ATOM 1079 CG PHE A 68 5.169 13.316 -7.552 1.00 55.33 C ATOM 1080 CD1 PHE A 68 6.432 13.356 -6.938 1.00 75.40 C ATOM 1081 CD2 PHE A 68 4.950 14.025 -8.750 1.00 60.12 C ATOM 1082 CE1 PHE A 68 7.466 14.107 -7.516 1.00 32.42 C ATOM 1083 CE2 PHE A 68 5.986 14.776 -9.327 1.00 4.43 C ATOM 1084 CZ PHE A 68 7.249 14.811 -8.711 1.00 0.15 C ATOM 0 H PHE A 68 1.362 12.540 -6.201 1.00 31.35 H new ATOM 0 HA PHE A 68 3.958 13.406 -5.016 1.00 42.31 H new ATOM 0 HB2 PHE A 68 4.466 11.604 -6.494 1.00 35.34 H new ATOM 0 HB3 PHE A 68 3.359 12.203 -7.713 1.00 35.34 H new ATOM 0 HD1 PHE A 68 6.606 12.810 -6.023 1.00 75.40 H new ATOM 0 HD2 PHE A 68 3.981 13.990 -9.226 1.00 60.12 H new ATOM 0 HE1 PHE A 68 8.434 14.144 -7.039 1.00 32.42 H new ATOM 0 HE2 PHE A 68 5.813 15.325 -10.241 1.00 4.43 H new ATOM 0 HZ PHE A 68 8.052 15.379 -9.157 1.00 0.15 H new ATOM 1094 N ASP A 69 2.778 15.627 -5.441 1.00 51.30 N ATOM 1095 CA ASP A 69 2.386 16.995 -5.781 1.00 62.14 C ATOM 1096 C ASP A 69 3.433 17.952 -5.223 1.00 33.42 C ATOM 1097 O ASP A 69 3.329 18.374 -4.065 1.00 51.21 O ATOM 1098 CB ASP A 69 0.976 17.352 -5.316 1.00 54.22 C ATOM 1099 CG ASP A 69 0.576 18.784 -5.704 1.00 61.23 C ATOM 1100 OD1 ASP A 69 1.403 19.539 -6.265 1.00 31.42 O ATOM 1101 OD2 ASP A 69 -0.604 19.112 -5.425 1.00 22.44 O ATOM 0 H ASP A 69 3.079 15.514 -4.473 1.00 51.30 H new ATOM 0 HA ASP A 69 2.348 17.083 -6.867 1.00 62.14 H new ATOM 0 HB2 ASP A 69 0.265 16.649 -5.749 1.00 54.22 H new ATOM 0 HB3 ASP A 69 0.914 17.241 -4.233 1.00 54.22 H new ATOM 1106 N PRO A 70 4.509 18.200 -5.986 1.00 35.05 N ATOM 1107 CA PRO A 70 5.671 18.936 -5.517 1.00 35.45 C ATOM 1108 C PRO A 70 5.462 20.434 -5.334 1.00 63.11 C ATOM 1109 O PRO A 70 6.371 21.121 -4.871 1.00 0.24 O ATOM 1110 CB PRO A 70 6.771 18.635 -6.517 1.00 73.44 C ATOM 1111 CG PRO A 70 6.027 18.326 -7.805 1.00 54.42 C ATOM 1112 CD PRO A 70 4.730 17.695 -7.332 1.00 4.24 C ATOM 0 HA PRO A 70 5.919 18.610 -4.507 1.00 35.45 H new ATOM 0 HB2 PRO A 70 7.442 19.485 -6.639 1.00 73.44 H new ATOM 0 HB3 PRO A 70 7.381 17.790 -6.196 1.00 73.44 H new ATOM 0 HG2 PRO A 70 5.843 19.229 -8.387 1.00 54.42 H new ATOM 0 HG3 PRO A 70 6.594 17.646 -8.441 1.00 54.42 H new ATOM 0 HD2 PRO A 70 3.903 17.962 -7.990 1.00 4.24 H new ATOM 0 HD3 PRO A 70 4.801 16.607 -7.334 1.00 4.24 H new ATOM 1120 N ASP A 71 4.293 20.943 -5.704 1.00 0.13 N ATOM 1121 CA ASP A 71 3.942 22.349 -5.518 1.00 52.20 C ATOM 1122 C ASP A 71 3.094 22.557 -4.253 1.00 2.15 C ATOM 1123 O ASP A 71 2.914 23.699 -3.813 1.00 44.20 O ATOM 1124 CB ASP A 71 3.246 22.871 -6.786 1.00 0.33 C ATOM 1125 CG ASP A 71 3.484 24.367 -7.000 1.00 44.24 C ATOM 1126 OD1 ASP A 71 4.664 24.749 -7.222 1.00 33.33 O ATOM 1127 OD2 ASP A 71 2.503 25.145 -7.019 1.00 54.32 O ATOM 0 H ASP A 71 3.557 20.391 -6.144 1.00 0.13 H new ATOM 0 HA ASP A 71 4.852 22.929 -5.365 1.00 52.20 H new ATOM 0 HB2 ASP A 71 3.611 22.319 -7.652 1.00 0.33 H new ATOM 0 HB3 ASP A 71 2.175 22.681 -6.715 1.00 0.33 H new ATOM 1132 N PHE A 72 2.584 21.475 -3.645 1.00 1.34 N ATOM 1133 CA PHE A 72 1.664 21.539 -2.513 1.00 72.40 C ATOM 1134 C PHE A 72 2.374 21.957 -1.224 1.00 20.25 C ATOM 1135 O PHE A 72 3.544 21.621 -0.998 1.00 60.33 O ATOM 1136 CB PHE A 72 0.959 20.179 -2.329 1.00 72.13 C ATOM 1137 CG PHE A 72 -0.540 20.256 -2.092 1.00 15.32 C ATOM 1138 CD1 PHE A 72 -1.356 21.004 -2.963 1.00 3.33 C ATOM 1139 CD2 PHE A 72 -1.144 19.513 -1.060 1.00 11.33 C ATOM 1140 CE1 PHE A 72 -2.746 21.059 -2.764 1.00 3.44 C ATOM 1141 CE2 PHE A 72 -2.539 19.542 -0.882 1.00 35.31 C ATOM 1142 CZ PHE A 72 -3.340 20.333 -1.720 1.00 61.13 C ATOM 0 H PHE A 72 2.805 20.522 -3.934 1.00 1.34 H new ATOM 0 HA PHE A 72 0.918 22.303 -2.732 1.00 72.40 H new ATOM 0 HB2 PHE A 72 1.140 19.571 -3.215 1.00 72.13 H new ATOM 0 HB3 PHE A 72 1.418 19.660 -1.487 1.00 72.13 H new ATOM 0 HD1 PHE A 72 -0.911 21.539 -3.789 1.00 3.33 H new ATOM 0 HD2 PHE A 72 -0.532 18.916 -0.400 1.00 11.33 H new ATOM 0 HE1 PHE A 72 -3.359 21.662 -3.417 1.00 3.44 H new ATOM 0 HE2 PHE A 72 -2.995 18.954 -0.099 1.00 35.31 H new ATOM 0 HZ PHE A 72 -4.407 20.383 -1.562 1.00 61.13 H new ATOM 1152 N SER A 73 1.651 22.665 -0.359 1.00 60.30 N ATOM 1153 CA SER A 73 2.120 23.076 0.958 1.00 55.20 C ATOM 1154 C SER A 73 2.000 21.928 1.969 1.00 1.35 C ATOM 1155 O SER A 73 1.256 20.961 1.766 1.00 71.32 O ATOM 1156 CB SER A 73 1.346 24.330 1.381 1.00 64.22 C ATOM 1157 OG SER A 73 1.304 25.271 0.321 1.00 2.52 O ATOM 0 H SER A 73 0.701 22.975 -0.561 1.00 60.30 H new ATOM 0 HA SER A 73 3.181 23.325 0.922 1.00 55.20 H new ATOM 0 HB2 SER A 73 0.332 24.057 1.673 1.00 64.22 H new ATOM 0 HB3 SER A 73 1.819 24.779 2.254 1.00 64.22 H new ATOM 0 HG SER A 73 0.805 26.064 0.607 1.00 2.52 H new ATOM 1163 N TYR A 74 2.735 22.044 3.078 1.00 40.50 N ATOM 1164 CA TYR A 74 2.751 21.060 4.148 1.00 75.33 C ATOM 1165 C TYR A 74 1.361 21.012 4.765 1.00 74.11 C ATOM 1166 O TYR A 74 0.817 19.926 4.923 1.00 75.42 O ATOM 1167 CB TYR A 74 3.830 21.416 5.189 1.00 24.35 C ATOM 1168 CG TYR A 74 4.061 20.414 6.316 1.00 63.20 C ATOM 1169 CD1 TYR A 74 3.062 20.177 7.283 1.00 54.04 C ATOM 1170 CD2 TYR A 74 5.315 19.784 6.458 1.00 22.31 C ATOM 1171 CE1 TYR A 74 3.310 19.326 8.375 1.00 52.24 C ATOM 1172 CE2 TYR A 74 5.564 18.921 7.541 1.00 63.24 C ATOM 1173 CZ TYR A 74 4.558 18.685 8.502 1.00 64.53 C ATOM 1174 OH TYR A 74 4.786 17.815 9.521 1.00 33.15 O ATOM 0 H TYR A 74 3.345 22.842 3.255 1.00 40.50 H new ATOM 0 HA TYR A 74 3.004 20.073 3.760 1.00 75.33 H new ATOM 0 HB2 TYR A 74 4.774 21.559 4.663 1.00 24.35 H new ATOM 0 HB3 TYR A 74 3.566 22.374 5.636 1.00 24.35 H new ATOM 0 HD1 TYR A 74 2.098 20.653 7.184 1.00 54.04 H new ATOM 0 HD2 TYR A 74 6.091 19.966 5.729 1.00 22.31 H new ATOM 0 HE1 TYR A 74 2.542 19.164 9.117 1.00 52.24 H new ATOM 0 HE2 TYR A 74 6.526 18.439 7.637 1.00 63.24 H new ATOM 0 HH TYR A 74 5.699 17.465 9.454 1.00 33.15 H new ATOM 1184 N GLU A 75 0.794 22.169 5.129 1.00 11.41 N ATOM 1185 CA GLU A 75 -0.491 22.199 5.832 1.00 21.42 C ATOM 1186 C GLU A 75 -1.574 21.676 4.901 1.00 72.13 C ATOM 1187 O GLU A 75 -2.294 20.758 5.270 1.00 31.41 O ATOM 1188 CB GLU A 75 -0.830 23.597 6.373 1.00 60.53 C ATOM 1189 CG GLU A 75 -0.746 23.622 7.906 1.00 33.34 C ATOM 1190 CD GLU A 75 -1.965 23.041 8.637 1.00 43.42 C ATOM 1191 OE1 GLU A 75 -3.012 23.720 8.755 1.00 1.34 O ATOM 1192 OE2 GLU A 75 -1.838 21.924 9.183 1.00 4.15 O ATOM 0 H GLU A 75 1.201 23.087 4.950 1.00 11.41 H new ATOM 0 HA GLU A 75 -0.425 21.554 6.708 1.00 21.42 H new ATOM 0 HB2 GLU A 75 -0.141 24.331 5.954 1.00 60.53 H new ATOM 0 HB3 GLU A 75 -1.833 23.882 6.054 1.00 60.53 H new ATOM 0 HG2 GLU A 75 0.141 23.068 8.214 1.00 33.34 H new ATOM 0 HG3 GLU A 75 -0.606 24.653 8.230 1.00 33.34 H new ATOM 1199 N GLU A 76 -1.642 22.199 3.675 1.00 40.41 N ATOM 1200 CA GLU A 76 -2.609 21.821 2.644 1.00 62.51 C ATOM 1201 C GLU A 76 -2.689 20.318 2.449 1.00 22.32 C ATOM 1202 O GLU A 76 -3.784 19.774 2.304 1.00 31.42 O ATOM 1203 CB GLU A 76 -2.182 22.442 1.319 1.00 35.43 C ATOM 1204 CG GLU A 76 -2.634 23.888 1.226 1.00 12.25 C ATOM 1205 CD GLU A 76 -4.015 23.968 0.566 1.00 42.14 C ATOM 1206 OE1 GLU A 76 -5.018 23.656 1.250 1.00 40.24 O ATOM 1207 OE2 GLU A 76 -4.103 24.270 -0.648 1.00 35.45 O ATOM 0 H GLU A 76 -0.999 22.926 3.362 1.00 40.41 H new ATOM 0 HA GLU A 76 -3.587 22.178 2.967 1.00 62.51 H new ATOM 0 HB2 GLU A 76 -1.098 22.389 1.221 1.00 35.43 H new ATOM 0 HB3 GLU A 76 -2.605 21.871 0.492 1.00 35.43 H new ATOM 0 HG2 GLU A 76 -2.672 24.330 2.222 1.00 12.25 H new ATOM 0 HG3 GLU A 76 -1.913 24.466 0.648 1.00 12.25 H new ATOM 1214 N THR A 77 -1.535 19.655 2.472 1.00 2.24 N ATOM 1215 CA THR A 77 -1.471 18.196 2.432 1.00 71.31 C ATOM 1216 C THR A 77 -2.396 17.588 3.501 1.00 60.22 C ATOM 1217 O THR A 77 -3.239 16.738 3.201 1.00 1.14 O ATOM 1218 CB THR A 77 -0.012 17.728 2.567 1.00 44.54 C ATOM 1219 OG1 THR A 77 0.787 18.252 1.520 1.00 64.13 O ATOM 1220 CG2 THR A 77 0.095 16.203 2.509 1.00 12.14 C ATOM 0 H THR A 77 -0.623 20.110 2.519 1.00 2.24 H new ATOM 0 HA THR A 77 -1.833 17.840 1.468 1.00 71.31 H new ATOM 0 HB THR A 77 0.340 18.089 3.533 1.00 44.54 H new ATOM 0 HG1 THR A 77 0.932 19.210 1.667 1.00 64.13 H new ATOM 0 HG21 THR A 77 1.140 15.908 2.607 1.00 12.14 H new ATOM 0 HG22 THR A 77 -0.484 15.766 3.323 1.00 12.14 H new ATOM 0 HG23 THR A 77 -0.294 15.847 1.555 1.00 12.14 H new ATOM 1228 N LEU A 78 -2.277 18.059 4.741 1.00 64.33 N ATOM 1229 CA LEU A 78 -3.055 17.606 5.882 1.00 54.31 C ATOM 1230 C LEU A 78 -4.518 17.993 5.726 1.00 24.22 C ATOM 1231 O LEU A 78 -5.396 17.208 6.059 1.00 23.41 O ATOM 1232 CB LEU A 78 -2.519 18.230 7.180 1.00 34.11 C ATOM 1233 CG LEU A 78 -0.989 18.217 7.321 1.00 41.00 C ATOM 1234 CD1 LEU A 78 -0.603 18.752 8.689 1.00 22.35 C ATOM 1235 CD2 LEU A 78 -0.342 16.849 7.088 1.00 74.43 C ATOM 0 H LEU A 78 -1.611 18.793 4.983 1.00 64.33 H new ATOM 0 HA LEU A 78 -2.968 16.521 5.930 1.00 54.31 H new ATOM 0 HB2 LEU A 78 -2.866 19.262 7.240 1.00 34.11 H new ATOM 0 HB3 LEU A 78 -2.952 17.698 8.027 1.00 34.11 H new ATOM 0 HG LEU A 78 -0.604 18.859 6.529 1.00 41.00 H new ATOM 0 HD11 LEU A 78 0.482 18.743 8.790 1.00 22.35 H new ATOM 0 HD12 LEU A 78 -0.969 19.773 8.797 1.00 22.35 H new ATOM 0 HD13 LEU A 78 -1.045 18.124 9.463 1.00 22.35 H new ATOM 0 HD21 LEU A 78 0.738 16.932 7.207 1.00 74.43 H new ATOM 0 HD22 LEU A 78 -0.733 16.134 7.812 1.00 74.43 H new ATOM 0 HD23 LEU A 78 -0.570 16.506 6.079 1.00 74.43 H new ATOM 1247 N LEU A 79 -4.800 19.223 5.299 1.00 24.24 N ATOM 1248 CA LEU A 79 -6.143 19.751 5.120 1.00 62.42 C ATOM 1249 C LEU A 79 -6.919 18.900 4.136 1.00 53.12 C ATOM 1250 O LEU A 79 -8.052 18.517 4.395 1.00 63.42 O ATOM 1251 CB LEU A 79 -6.024 21.190 4.587 1.00 63.30 C ATOM 1252 CG LEU A 79 -5.295 22.182 5.503 1.00 43.44 C ATOM 1253 CD1 LEU A 79 -5.359 23.621 4.988 1.00 60.44 C ATOM 1254 CD2 LEU A 79 -5.778 22.051 6.937 1.00 60.31 C ATOM 0 H LEU A 79 -4.073 19.898 5.062 1.00 24.24 H new ATOM 0 HA LEU A 79 -6.675 19.740 6.071 1.00 62.42 H new ATOM 0 HB2 LEU A 79 -5.506 21.161 3.629 1.00 63.30 H new ATOM 0 HB3 LEU A 79 -7.027 21.571 4.395 1.00 63.30 H new ATOM 0 HG LEU A 79 -4.237 21.919 5.490 1.00 43.44 H new ATOM 0 HD11 LEU A 79 -4.827 24.278 5.676 1.00 60.44 H new ATOM 0 HD12 LEU A 79 -4.896 23.676 4.003 1.00 60.44 H new ATOM 0 HD13 LEU A 79 -6.400 23.936 4.918 1.00 60.44 H new ATOM 0 HD21 LEU A 79 -5.246 22.764 7.567 1.00 60.31 H new ATOM 0 HD22 LEU A 79 -6.848 22.255 6.981 1.00 60.31 H new ATOM 0 HD23 LEU A 79 -5.587 21.039 7.294 1.00 60.31 H new ATOM 1266 N LEU A 80 -6.288 18.591 3.016 1.00 24.25 N ATOM 1267 CA LEU A 80 -6.852 17.766 1.963 1.00 24.53 C ATOM 1268 C LEU A 80 -7.127 16.344 2.455 1.00 22.52 C ATOM 1269 O LEU A 80 -8.174 15.782 2.142 1.00 72.53 O ATOM 1270 CB LEU A 80 -5.897 17.789 0.770 1.00 4.25 C ATOM 1271 CG LEU A 80 -6.390 16.981 -0.438 1.00 1.35 C ATOM 1272 CD1 LEU A 80 -7.796 17.368 -0.908 1.00 15.23 C ATOM 1273 CD2 LEU A 80 -5.392 17.228 -1.566 1.00 11.12 C ATOM 0 H LEU A 80 -5.344 18.916 2.809 1.00 24.25 H new ATOM 0 HA LEU A 80 -7.817 18.167 1.654 1.00 24.53 H new ATOM 0 HB2 LEU A 80 -5.740 18.823 0.463 1.00 4.25 H new ATOM 0 HB3 LEU A 80 -4.929 17.399 1.085 1.00 4.25 H new ATOM 0 HG LEU A 80 -6.454 15.932 -0.150 1.00 1.35 H new ATOM 0 HD11 LEU A 80 -8.075 16.754 -1.765 1.00 15.23 H new ATOM 0 HD12 LEU A 80 -8.508 17.206 -0.098 1.00 15.23 H new ATOM 0 HD13 LEU A 80 -7.807 18.419 -1.196 1.00 15.23 H new ATOM 0 HD21 LEU A 80 -5.699 16.673 -2.452 1.00 11.12 H new ATOM 0 HD22 LEU A 80 -5.361 18.293 -1.798 1.00 11.12 H new ATOM 0 HD23 LEU A 80 -4.402 16.896 -1.255 1.00 11.12 H new ATOM 1285 N GLU A 81 -6.221 15.779 3.255 1.00 42.43 N ATOM 1286 CA GLU A 81 -6.385 14.475 3.888 1.00 23.22 C ATOM 1287 C GLU A 81 -7.630 14.509 4.783 1.00 23.22 C ATOM 1288 O GLU A 81 -8.576 13.747 4.605 1.00 52.33 O ATOM 1289 CB GLU A 81 -5.108 14.174 4.690 1.00 63.34 C ATOM 1290 CG GLU A 81 -5.068 12.790 5.343 1.00 13.22 C ATOM 1291 CD GLU A 81 -4.106 12.789 6.530 1.00 3.03 C ATOM 1292 OE1 GLU A 81 -2.933 13.213 6.390 1.00 52.13 O ATOM 1293 OE2 GLU A 81 -4.530 12.481 7.667 1.00 34.22 O ATOM 0 H GLU A 81 -5.334 16.228 3.484 1.00 42.43 H new ATOM 0 HA GLU A 81 -6.529 13.685 3.151 1.00 23.22 H new ATOM 0 HB2 GLU A 81 -4.248 14.272 4.027 1.00 63.34 H new ATOM 0 HB3 GLU A 81 -4.998 14.930 5.468 1.00 63.34 H new ATOM 0 HG2 GLU A 81 -6.067 12.509 5.676 1.00 13.22 H new ATOM 0 HG3 GLU A 81 -4.754 12.045 4.612 1.00 13.22 H new ATOM 1300 N LYS A 82 -7.652 15.441 5.732 1.00 12.22 N ATOM 1301 CA LYS A 82 -8.733 15.704 6.669 1.00 11.33 C ATOM 1302 C LYS A 82 -10.066 15.911 5.943 1.00 63.24 C ATOM 1303 O LYS A 82 -11.085 15.380 6.383 1.00 14.11 O ATOM 1304 CB LYS A 82 -8.269 16.940 7.469 1.00 42.14 C ATOM 1305 CG LYS A 82 -9.335 17.802 8.151 1.00 75.11 C ATOM 1306 CD LYS A 82 -8.976 19.286 7.996 1.00 54.21 C ATOM 1307 CE LYS A 82 -9.791 20.267 8.835 1.00 63.31 C ATOM 1308 NZ LYS A 82 -11.240 19.987 8.903 1.00 24.54 N ATOM 0 H LYS A 82 -6.863 16.072 5.873 1.00 12.22 H new ATOM 0 HA LYS A 82 -8.926 14.864 7.336 1.00 11.33 H new ATOM 0 HB2 LYS A 82 -7.575 16.598 8.237 1.00 42.14 H new ATOM 0 HB3 LYS A 82 -7.704 17.582 6.793 1.00 42.14 H new ATOM 0 HG2 LYS A 82 -10.312 17.606 7.710 1.00 75.11 H new ATOM 0 HG3 LYS A 82 -9.405 17.543 9.207 1.00 75.11 H new ATOM 0 HD2 LYS A 82 -7.923 19.412 8.248 1.00 54.21 H new ATOM 0 HD3 LYS A 82 -9.087 19.558 6.946 1.00 54.21 H new ATOM 0 HE2 LYS A 82 -9.391 20.272 9.849 1.00 63.31 H new ATOM 0 HE3 LYS A 82 -9.650 21.270 8.431 1.00 63.31 H new ATOM 0 HZ1 LYS A 82 -11.708 20.715 9.480 1.00 24.54 H new ATOM 0 HZ2 LYS A 82 -11.641 19.995 7.943 1.00 24.54 H new ATOM 0 HZ3 LYS A 82 -11.393 19.053 9.334 1.00 24.54 H new ATOM 1322 N LYS A 83 -10.087 16.691 4.860 1.00 64.40 N ATOM 1323 CA LYS A 83 -11.259 16.898 4.021 1.00 55.43 C ATOM 1324 C LYS A 83 -11.805 15.559 3.570 1.00 14.11 C ATOM 1325 O LYS A 83 -12.976 15.269 3.782 1.00 74.50 O ATOM 1326 CB LYS A 83 -10.908 17.816 2.839 1.00 24.43 C ATOM 1327 CG LYS A 83 -12.147 18.172 2.005 1.00 31.42 C ATOM 1328 CD LYS A 83 -11.993 17.936 0.501 1.00 32.53 C ATOM 1329 CE LYS A 83 -12.002 16.445 0.147 1.00 21.22 C ATOM 1330 NZ LYS A 83 -12.229 16.235 -1.300 1.00 72.53 N ATOM 0 H LYS A 83 -9.268 17.206 4.538 1.00 64.40 H new ATOM 0 HA LYS A 83 -12.042 17.397 4.592 1.00 55.43 H new ATOM 0 HB2 LYS A 83 -10.447 18.730 3.213 1.00 24.43 H new ATOM 0 HB3 LYS A 83 -10.171 17.325 2.204 1.00 24.43 H new ATOM 0 HG2 LYS A 83 -12.992 17.586 2.366 1.00 31.42 H new ATOM 0 HG3 LYS A 83 -12.391 19.221 2.172 1.00 31.42 H new ATOM 0 HD2 LYS A 83 -12.802 18.439 -0.029 1.00 32.53 H new ATOM 0 HD3 LYS A 83 -11.060 18.384 0.158 1.00 32.53 H new ATOM 0 HE2 LYS A 83 -11.053 15.995 0.437 1.00 21.22 H new ATOM 0 HE3 LYS A 83 -12.782 15.939 0.716 1.00 21.22 H new ATOM 0 HZ1 LYS A 83 -12.230 15.216 -1.507 1.00 72.53 H new ATOM 0 HZ2 LYS A 83 -13.146 16.644 -1.570 1.00 72.53 H new ATOM 0 HZ3 LYS A 83 -11.471 16.698 -1.841 1.00 72.53 H new ATOM 1344 N LEU A 84 -10.948 14.739 2.972 1.00 42.00 N ATOM 1345 CA LEU A 84 -11.286 13.398 2.525 1.00 72.20 C ATOM 1346 C LEU A 84 -11.891 12.567 3.654 1.00 13.41 C ATOM 1347 O LEU A 84 -12.849 11.826 3.425 1.00 23.25 O ATOM 1348 CB LEU A 84 -10.012 12.739 1.981 1.00 61.52 C ATOM 1349 CG LEU A 84 -10.123 12.442 0.487 1.00 73.53 C ATOM 1350 CD1 LEU A 84 -8.700 12.357 -0.065 1.00 12.01 C ATOM 1351 CD2 LEU A 84 -10.922 11.151 0.262 1.00 13.41 C ATOM 0 H LEU A 84 -9.979 14.996 2.782 1.00 42.00 H new ATOM 0 HA LEU A 84 -12.041 13.456 1.741 1.00 72.20 H new ATOM 0 HB2 LEU A 84 -9.159 13.394 2.159 1.00 61.52 H new ATOM 0 HB3 LEU A 84 -9.822 11.813 2.523 1.00 61.52 H new ATOM 0 HG LEU A 84 -10.664 13.228 -0.040 1.00 73.53 H new ATOM 0 HD11 LEU A 84 -8.736 12.145 -1.134 1.00 12.01 H new ATOM 0 HD12 LEU A 84 -8.189 13.305 0.100 1.00 12.01 H new ATOM 0 HD13 LEU A 84 -8.159 11.560 0.445 1.00 12.01 H new ATOM 0 HD21 LEU A 84 -10.995 10.950 -0.807 1.00 13.41 H new ATOM 0 HD22 LEU A 84 -10.417 10.320 0.754 1.00 13.41 H new ATOM 0 HD23 LEU A 84 -11.923 11.265 0.678 1.00 13.41 H new ATOM 1363 N ARG A 85 -11.342 12.679 4.867 1.00 60.11 N ATOM 1364 CA ARG A 85 -11.853 11.961 6.017 1.00 32.35 C ATOM 1365 C ARG A 85 -13.244 12.417 6.419 1.00 62.10 C ATOM 1366 O ARG A 85 -14.090 11.564 6.671 1.00 41.10 O ATOM 1367 CB ARG A 85 -10.861 12.039 7.179 1.00 15.23 C ATOM 1368 CG ARG A 85 -9.538 11.348 6.819 1.00 0.34 C ATOM 1369 CD ARG A 85 -8.566 11.304 7.989 1.00 55.41 C ATOM 1370 NE ARG A 85 -8.129 12.620 8.462 1.00 74.43 N ATOM 1371 CZ ARG A 85 -8.591 13.306 9.510 1.00 43.01 C ATOM 1372 NH1 ARG A 85 -9.667 12.935 10.192 1.00 60.41 N ATOM 1373 NH2 ARG A 85 -7.960 14.413 9.860 1.00 60.52 N ATOM 0 H ARG A 85 -10.535 13.269 5.069 1.00 60.11 H new ATOM 0 HA ARG A 85 -11.958 10.914 5.732 1.00 32.35 H new ATOM 0 HB2 ARG A 85 -10.673 13.082 7.433 1.00 15.23 H new ATOM 0 HB3 ARG A 85 -11.293 11.569 8.063 1.00 15.23 H new ATOM 0 HG2 ARG A 85 -9.743 10.332 6.482 1.00 0.34 H new ATOM 0 HG3 ARG A 85 -9.073 11.873 5.984 1.00 0.34 H new ATOM 0 HD2 ARG A 85 -9.036 10.772 8.816 1.00 55.41 H new ATOM 0 HD3 ARG A 85 -7.689 10.727 7.696 1.00 55.41 H new ATOM 0 HE ARG A 85 -7.383 13.065 7.927 1.00 74.43 H new ATOM 0 HH11 ARG A 85 -10.177 12.094 9.922 1.00 60.41 H new ATOM 0 HH12 ARG A 85 -9.984 13.491 10.987 1.00 60.41 H new ATOM 0 HH21 ARG A 85 -7.143 14.722 9.334 1.00 60.52 H new ATOM 0 HH22 ARG A 85 -8.290 14.958 10.657 1.00 60.52 H new ATOM 1387 N GLU A 86 -13.511 13.723 6.468 1.00 15.14 N ATOM 1388 CA GLU A 86 -14.841 14.204 6.781 1.00 44.12 C ATOM 1389 C GLU A 86 -15.824 13.801 5.678 1.00 4.43 C ATOM 1390 O GLU A 86 -16.978 13.492 5.975 1.00 22.13 O ATOM 1391 CB GLU A 86 -14.819 15.730 6.948 1.00 75.13 C ATOM 1392 CG GLU A 86 -14.358 16.196 8.336 1.00 22.52 C ATOM 1393 CD GLU A 86 -14.980 17.536 8.764 1.00 12.31 C ATOM 1394 OE1 GLU A 86 -14.410 18.595 8.411 1.00 72.30 O ATOM 1395 OE2 GLU A 86 -15.997 17.544 9.496 1.00 3.44 O ATOM 0 H GLU A 86 -12.823 14.456 6.295 1.00 15.14 H new ATOM 0 HA GLU A 86 -15.170 13.753 7.717 1.00 44.12 H new ATOM 0 HB2 GLU A 86 -14.159 16.159 6.194 1.00 75.13 H new ATOM 0 HB3 GLU A 86 -15.818 16.121 6.757 1.00 75.13 H new ATOM 0 HG2 GLU A 86 -14.613 15.433 9.071 1.00 22.52 H new ATOM 0 HG3 GLU A 86 -13.272 16.290 8.338 1.00 22.52 H new ATOM 1402 N ASP A 87 -15.375 13.781 4.422 1.00 52.12 N ATOM 1403 CA ASP A 87 -16.192 13.424 3.268 1.00 24.31 C ATOM 1404 C ASP A 87 -16.626 11.967 3.402 1.00 3.33 C ATOM 1405 O ASP A 87 -17.803 11.658 3.225 1.00 52.22 O ATOM 1406 CB ASP A 87 -15.403 13.639 1.964 1.00 62.13 C ATOM 1407 CG ASP A 87 -15.883 14.809 1.109 1.00 51.23 C ATOM 1408 OD1 ASP A 87 -16.005 15.949 1.613 1.00 44.02 O ATOM 1409 OD2 ASP A 87 -16.030 14.601 -0.120 1.00 24.11 O ATOM 0 H ASP A 87 -14.414 14.018 4.177 1.00 52.12 H new ATOM 0 HA ASP A 87 -17.075 14.062 3.232 1.00 24.31 H new ATOM 0 HB2 ASP A 87 -14.354 13.796 2.213 1.00 62.13 H new ATOM 0 HB3 ASP A 87 -15.456 12.727 1.369 1.00 62.13 H new ATOM 1414 N PHE A 88 -15.692 11.078 3.757 1.00 63.21 N ATOM 1415 CA PHE A 88 -15.920 9.645 3.853 1.00 42.01 C ATOM 1416 C PHE A 88 -15.285 9.091 5.135 1.00 3.45 C ATOM 1417 O PHE A 88 -14.197 8.510 5.078 1.00 24.15 O ATOM 1418 CB PHE A 88 -15.383 8.943 2.601 1.00 20.13 C ATOM 1419 CG PHE A 88 -15.796 9.546 1.277 1.00 61.21 C ATOM 1420 CD1 PHE A 88 -17.086 9.326 0.762 1.00 42.20 C ATOM 1421 CD2 PHE A 88 -14.874 10.323 0.554 1.00 44.32 C ATOM 1422 CE1 PHE A 88 -17.432 9.840 -0.499 1.00 74.53 C ATOM 1423 CE2 PHE A 88 -15.195 10.767 -0.740 1.00 73.51 C ATOM 1424 CZ PHE A 88 -16.471 10.512 -1.271 1.00 44.32 C ATOM 0 H PHE A 88 -14.736 11.348 3.990 1.00 63.21 H new ATOM 0 HA PHE A 88 -16.991 9.452 3.908 1.00 42.01 H new ATOM 0 HB2 PHE A 88 -14.294 8.936 2.651 1.00 20.13 H new ATOM 0 HB3 PHE A 88 -15.710 7.903 2.623 1.00 20.13 H new ATOM 0 HD1 PHE A 88 -17.809 8.763 1.334 1.00 42.20 H new ATOM 0 HD2 PHE A 88 -13.921 10.578 0.992 1.00 44.32 H new ATOM 0 HE1 PHE A 88 -18.437 9.718 -0.874 1.00 74.53 H new ATOM 0 HE2 PHE A 88 -14.463 11.303 -1.325 1.00 73.51 H new ATOM 0 HZ PHE A 88 -16.712 10.833 -2.273 1.00 44.32 H new ATOM 1434 N PRO A 89 -15.966 9.183 6.289 1.00 22.13 N ATOM 1435 CA PRO A 89 -15.433 8.716 7.569 1.00 1.32 C ATOM 1436 C PRO A 89 -15.420 7.181 7.681 1.00 44.21 C ATOM 1437 O PRO A 89 -14.994 6.645 8.703 1.00 34.22 O ATOM 1438 CB PRO A 89 -16.342 9.358 8.623 1.00 22.15 C ATOM 1439 CG PRO A 89 -17.687 9.436 7.906 1.00 40.02 C ATOM 1440 CD PRO A 89 -17.279 9.784 6.477 1.00 31.44 C ATOM 0 HA PRO A 89 -14.389 9.001 7.695 1.00 1.32 H new ATOM 0 HB2 PRO A 89 -16.401 8.754 9.529 1.00 22.15 H new ATOM 0 HB3 PRO A 89 -15.984 10.344 8.920 1.00 22.15 H new ATOM 0 HG2 PRO A 89 -18.228 8.491 7.955 1.00 40.02 H new ATOM 0 HG3 PRO A 89 -18.335 10.198 8.340 1.00 40.02 H new ATOM 0 HD2 PRO A 89 -17.997 9.391 5.757 1.00 31.44 H new ATOM 0 HD3 PRO A 89 -17.241 10.864 6.332 1.00 31.44 H new ATOM 1448 N GLN A 90 -15.933 6.474 6.669 1.00 14.31 N ATOM 1449 CA GLN A 90 -16.028 5.016 6.576 1.00 50.21 C ATOM 1450 C GLN A 90 -14.758 4.359 6.000 1.00 65.41 C ATOM 1451 O GLN A 90 -14.722 3.141 5.829 1.00 41.01 O ATOM 1452 CB GLN A 90 -17.286 4.670 5.749 1.00 34.14 C ATOM 1453 CG GLN A 90 -17.159 4.859 4.222 1.00 34.15 C ATOM 1454 CD GLN A 90 -18.276 5.679 3.577 1.00 51.34 C ATOM 1455 OE1 GLN A 90 -19.106 5.197 2.815 1.00 53.01 O ATOM 1456 NE2 GLN A 90 -18.278 6.979 3.809 1.00 13.35 N ATOM 0 H GLN A 90 -16.316 6.934 5.843 1.00 14.31 H new ATOM 0 HA GLN A 90 -16.116 4.605 7.582 1.00 50.21 H new ATOM 0 HB2 GLN A 90 -17.554 3.632 5.947 1.00 34.14 H new ATOM 0 HB3 GLN A 90 -18.112 5.285 6.105 1.00 34.14 H new ATOM 0 HG2 GLN A 90 -16.205 5.342 4.009 1.00 34.15 H new ATOM 0 HG3 GLN A 90 -17.131 3.877 3.751 1.00 34.15 H new ATOM 0 HE21 GLN A 90 -17.589 7.385 4.442 1.00 13.35 H new ATOM 0 HE22 GLN A 90 -18.968 7.577 3.355 1.00 13.35 H new ATOM 1465 N TYR A 91 -13.754 5.163 5.633 1.00 53.11 N ATOM 1466 CA TYR A 91 -12.472 4.752 5.052 1.00 53.23 C ATOM 1467 C TYR A 91 -11.351 5.480 5.803 1.00 52.04 C ATOM 1468 O TYR A 91 -11.646 6.286 6.686 1.00 10.23 O ATOM 1469 CB TYR A 91 -12.476 5.122 3.556 1.00 34.25 C ATOM 1470 CG TYR A 91 -13.624 4.504 2.759 1.00 63.54 C ATOM 1471 CD1 TYR A 91 -13.944 3.141 2.904 1.00 30.24 C ATOM 1472 CD2 TYR A 91 -14.444 5.310 1.947 1.00 25.12 C ATOM 1473 CE1 TYR A 91 -15.023 2.567 2.206 1.00 23.44 C ATOM 1474 CE2 TYR A 91 -15.550 4.759 1.274 1.00 25.21 C ATOM 1475 CZ TYR A 91 -15.829 3.378 1.379 1.00 21.53 C ATOM 1476 OH TYR A 91 -16.907 2.854 0.737 1.00 25.25 O ATOM 0 H TYR A 91 -13.818 6.175 5.740 1.00 53.11 H new ATOM 0 HA TYR A 91 -12.315 3.677 5.143 1.00 53.23 H new ATOM 0 HB2 TYR A 91 -12.527 6.207 3.462 1.00 34.25 H new ATOM 0 HB3 TYR A 91 -11.531 4.807 3.113 1.00 34.25 H new ATOM 0 HD1 TYR A 91 -13.351 2.524 3.563 1.00 30.24 H new ATOM 0 HD2 TYR A 91 -14.222 6.361 1.840 1.00 25.12 H new ATOM 0 HE1 TYR A 91 -15.233 1.512 2.303 1.00 23.44 H new ATOM 0 HE2 TYR A 91 -16.187 5.393 0.676 1.00 25.21 H new ATOM 0 HH TYR A 91 -17.046 1.930 1.032 1.00 25.25 H new ATOM 1486 N GLN A 92 -10.078 5.262 5.452 1.00 72.44 N ATOM 1487 CA GLN A 92 -8.927 5.800 6.192 1.00 3.35 C ATOM 1488 C GLN A 92 -7.813 6.284 5.260 1.00 1.34 C ATOM 1489 O GLN A 92 -6.804 5.612 5.084 1.00 4.14 O ATOM 1490 CB GLN A 92 -8.404 4.745 7.185 1.00 24.21 C ATOM 1491 CG GLN A 92 -9.523 4.211 8.071 1.00 41.42 C ATOM 1492 CD GLN A 92 -9.044 3.519 9.326 1.00 30.53 C ATOM 1493 OE1 GLN A 92 -8.611 4.167 10.277 1.00 21.33 O ATOM 1494 NE2 GLN A 92 -9.165 2.211 9.376 1.00 70.44 N ATOM 0 H GLN A 92 -9.814 4.703 4.640 1.00 72.44 H new ATOM 0 HA GLN A 92 -9.265 6.674 6.748 1.00 3.35 H new ATOM 0 HB2 GLN A 92 -7.948 3.921 6.636 1.00 24.21 H new ATOM 0 HB3 GLN A 92 -7.624 5.184 7.807 1.00 24.21 H new ATOM 0 HG2 GLN A 92 -10.175 5.038 8.352 1.00 41.42 H new ATOM 0 HG3 GLN A 92 -10.127 3.512 7.492 1.00 41.42 H new ATOM 0 HE21 GLN A 92 -9.528 1.701 8.570 1.00 70.44 H new ATOM 0 HE22 GLN A 92 -8.896 1.706 10.220 1.00 70.44 H new ATOM 1503 N TRP A 93 -8.026 7.425 4.611 1.00 0.42 N ATOM 1504 CA TRP A 93 -7.158 7.966 3.570 1.00 12.34 C ATOM 1505 C TRP A 93 -5.837 8.535 4.149 1.00 0.01 C ATOM 1506 O TRP A 93 -5.783 9.703 4.540 1.00 54.44 O ATOM 1507 CB TRP A 93 -7.952 9.062 2.844 1.00 31.13 C ATOM 1508 CG TRP A 93 -9.332 8.662 2.427 1.00 35.45 C ATOM 1509 CD1 TRP A 93 -10.484 9.059 3.013 1.00 44.04 C ATOM 1510 CD2 TRP A 93 -9.723 7.749 1.366 1.00 61.14 C ATOM 1511 NE1 TRP A 93 -11.556 8.488 2.360 1.00 0.03 N ATOM 1512 CE2 TRP A 93 -11.144 7.690 1.311 1.00 11.14 C ATOM 1513 CE3 TRP A 93 -9.007 6.967 0.441 1.00 33.21 C ATOM 1514 CZ2 TRP A 93 -11.813 6.921 0.348 1.00 63.10 C ATOM 1515 CZ3 TRP A 93 -9.665 6.196 -0.531 1.00 44.43 C ATOM 1516 CH2 TRP A 93 -11.067 6.168 -0.573 1.00 13.12 C ATOM 0 H TRP A 93 -8.834 8.018 4.802 1.00 0.42 H new ATOM 0 HA TRP A 93 -6.867 7.171 2.883 1.00 12.34 H new ATOM 0 HB2 TRP A 93 -8.022 9.933 3.496 1.00 31.13 H new ATOM 0 HB3 TRP A 93 -7.395 9.370 1.959 1.00 31.13 H new ATOM 0 HD1 TRP A 93 -10.554 9.722 3.863 1.00 44.04 H new ATOM 0 HE1 TRP A 93 -12.531 8.637 2.619 1.00 0.03 H new ATOM 0 HE3 TRP A 93 -7.928 6.960 0.479 1.00 33.21 H new ATOM 0 HZ2 TRP A 93 -12.892 6.908 0.315 1.00 63.10 H new ATOM 0 HZ3 TRP A 93 -9.092 5.625 -1.246 1.00 44.43 H new ATOM 0 HH2 TRP A 93 -11.573 5.567 -1.314 1.00 13.12 H new ATOM 1527 N GLU A 94 -4.751 7.762 4.155 1.00 43.32 N ATOM 1528 CA GLU A 94 -3.433 8.083 4.731 1.00 63.41 C ATOM 1529 C GLU A 94 -2.601 9.113 3.922 1.00 62.44 C ATOM 1530 O GLU A 94 -1.372 8.993 3.867 1.00 21.23 O ATOM 1531 CB GLU A 94 -2.648 6.760 4.887 1.00 64.31 C ATOM 1532 CG GLU A 94 -3.252 5.764 5.882 1.00 52.33 C ATOM 1533 CD GLU A 94 -2.831 6.121 7.314 1.00 30.34 C ATOM 1534 OE1 GLU A 94 -3.220 7.209 7.806 1.00 22.54 O ATOM 1535 OE2 GLU A 94 -2.005 5.398 7.912 1.00 33.34 O ATOM 0 H GLU A 94 -4.763 6.834 3.732 1.00 43.32 H new ATOM 0 HA GLU A 94 -3.610 8.568 5.691 1.00 63.41 H new ATOM 0 HB2 GLU A 94 -2.578 6.279 3.911 1.00 64.31 H new ATOM 0 HB3 GLU A 94 -1.631 6.993 5.201 1.00 64.31 H new ATOM 0 HG2 GLU A 94 -4.339 5.773 5.802 1.00 52.33 H new ATOM 0 HG3 GLU A 94 -2.923 4.753 5.640 1.00 52.33 H new ATOM 1542 N LEU A 95 -3.213 10.116 3.281 1.00 62.11 N ATOM 1543 CA LEU A 95 -2.718 10.866 2.108 1.00 2.01 C ATOM 1544 C LEU A 95 -1.240 11.297 2.187 1.00 20.04 C ATOM 1545 O LEU A 95 -0.898 12.311 2.789 1.00 3.15 O ATOM 1546 CB LEU A 95 -3.640 12.080 1.896 1.00 41.13 C ATOM 1547 CG LEU A 95 -3.567 12.698 0.492 1.00 12.21 C ATOM 1548 CD1 LEU A 95 -4.140 11.779 -0.596 1.00 64.42 C ATOM 1549 CD2 LEU A 95 -4.344 14.018 0.487 1.00 51.33 C ATOM 0 H LEU A 95 -4.128 10.451 3.584 1.00 62.11 H new ATOM 0 HA LEU A 95 -2.748 10.189 1.254 1.00 2.01 H new ATOM 0 HB2 LEU A 95 -4.669 11.778 2.093 1.00 41.13 H new ATOM 0 HB3 LEU A 95 -3.386 12.845 2.630 1.00 41.13 H new ATOM 0 HG LEU A 95 -2.513 12.856 0.262 1.00 12.21 H new ATOM 0 HD11 LEU A 95 -4.061 12.270 -1.566 1.00 64.42 H new ATOM 0 HD12 LEU A 95 -3.579 10.845 -0.615 1.00 64.42 H new ATOM 0 HD13 LEU A 95 -5.188 11.569 -0.380 1.00 64.42 H new ATOM 0 HD21 LEU A 95 -4.297 14.464 -0.507 1.00 51.33 H new ATOM 0 HD22 LEU A 95 -5.384 13.829 0.751 1.00 51.33 H new ATOM 0 HD23 LEU A 95 -3.904 14.702 1.213 1.00 51.33 H new ATOM 1561 N LYS A 96 -0.341 10.529 1.542 1.00 54.21 N ATOM 1562 CA LYS A 96 1.102 10.657 1.804 1.00 14.51 C ATOM 1563 C LYS A 96 1.860 11.231 0.612 1.00 13.41 C ATOM 1564 O LYS A 96 2.074 10.542 -0.389 1.00 40.40 O ATOM 1565 CB LYS A 96 1.673 9.307 2.267 1.00 21.31 C ATOM 1566 CG LYS A 96 3.154 9.306 2.681 1.00 43.54 C ATOM 1567 CD LYS A 96 3.436 9.897 4.069 1.00 54.31 C ATOM 1568 CE LYS A 96 3.431 11.420 3.986 1.00 22.14 C ATOM 1569 NZ LYS A 96 2.412 11.991 4.891 1.00 4.13 N ATOM 0 H LYS A 96 -0.585 9.824 0.846 1.00 54.21 H new ATOM 0 HA LYS A 96 1.239 11.378 2.610 1.00 14.51 H new ATOM 0 HB2 LYS A 96 1.080 8.955 3.111 1.00 21.31 H new ATOM 0 HB3 LYS A 96 1.541 8.584 1.462 1.00 21.31 H new ATOM 0 HG2 LYS A 96 3.523 8.280 2.657 1.00 43.54 H new ATOM 0 HG3 LYS A 96 3.724 9.867 1.940 1.00 43.54 H new ATOM 0 HD2 LYS A 96 2.682 9.559 4.780 1.00 54.31 H new ATOM 0 HD3 LYS A 96 4.400 9.546 4.436 1.00 54.31 H new ATOM 0 HE2 LYS A 96 4.416 11.806 4.250 1.00 22.14 H new ATOM 0 HE3 LYS A 96 3.230 11.732 2.961 1.00 22.14 H new ATOM 0 HZ1 LYS A 96 2.294 13.004 4.686 1.00 4.13 H new ATOM 0 HZ2 LYS A 96 1.506 11.501 4.747 1.00 4.13 H new ATOM 0 HZ3 LYS A 96 2.717 11.870 5.878 1.00 4.13 H new ATOM 1583 N ASN A 97 2.305 12.482 0.742 1.00 44.13 N ATOM 1584 CA ASN A 97 3.068 13.179 -0.289 1.00 73.40 C ATOM 1585 C ASN A 97 4.489 12.643 -0.325 1.00 63.01 C ATOM 1586 O ASN A 97 5.322 13.011 0.508 1.00 42.54 O ATOM 1587 CB ASN A 97 3.113 14.706 -0.098 1.00 24.31 C ATOM 1588 CG ASN A 97 3.431 15.400 -1.430 1.00 42.10 C ATOM 1589 OD1 ASN A 97 3.898 14.775 -2.378 1.00 75.44 O ATOM 1590 ND2 ASN A 97 3.202 16.697 -1.542 1.00 42.10 N ATOM 0 H ASN A 97 2.142 13.044 1.577 1.00 44.13 H new ATOM 0 HA ASN A 97 2.552 12.990 -1.231 1.00 73.40 H new ATOM 0 HB2 ASN A 97 2.156 15.060 0.285 1.00 24.31 H new ATOM 0 HB3 ASN A 97 3.868 14.964 0.644 1.00 24.31 H new ATOM 0 HD21 ASN A 97 3.413 17.179 -2.416 1.00 42.10 H new ATOM 0 HD22 ASN A 97 2.814 17.216 -0.754 1.00 42.10 H new ATOM 1597 N GLN A 98 4.768 11.789 -1.301 1.00 54.31 N ATOM 1598 CA GLN A 98 6.079 11.193 -1.535 1.00 75.32 C ATOM 1599 C GLN A 98 7.188 12.246 -1.733 1.00 41.12 C ATOM 1600 O GLN A 98 8.357 11.935 -1.519 1.00 14.13 O ATOM 1601 CB GLN A 98 6.009 10.235 -2.735 1.00 33.41 C ATOM 1602 CG GLN A 98 4.933 9.144 -2.629 1.00 74.01 C ATOM 1603 CD GLN A 98 5.089 8.255 -1.397 1.00 41.54 C ATOM 1604 OE1 GLN A 98 5.934 7.370 -1.348 1.00 43.31 O ATOM 1605 NE2 GLN A 98 4.265 8.446 -0.382 1.00 55.41 N ATOM 0 H GLN A 98 4.066 11.481 -1.974 1.00 54.31 H new ATOM 0 HA GLN A 98 6.348 10.633 -0.639 1.00 75.32 H new ATOM 0 HB2 GLN A 98 5.826 10.819 -3.637 1.00 33.41 H new ATOM 0 HB3 GLN A 98 6.981 9.756 -2.856 1.00 33.41 H new ATOM 0 HG2 GLN A 98 3.950 9.615 -2.606 1.00 74.01 H new ATOM 0 HG3 GLN A 98 4.968 8.522 -3.523 1.00 74.01 H new ATOM 0 HE21 GLN A 98 3.563 9.184 -0.427 1.00 55.41 H new ATOM 0 HE22 GLN A 98 4.331 7.855 0.447 1.00 55.41 H new ATOM 1614 N VAL A 99 6.841 13.495 -2.065 1.00 71.42 N ATOM 1615 CA VAL A 99 7.780 14.603 -2.231 1.00 0.44 C ATOM 1616 C VAL A 99 8.465 14.978 -0.905 1.00 75.32 C ATOM 1617 O VAL A 99 9.624 15.399 -0.909 1.00 13.45 O ATOM 1618 CB VAL A 99 7.007 15.819 -2.793 1.00 62.31 C ATOM 1619 CG1 VAL A 99 7.889 17.072 -2.921 1.00 32.15 C ATOM 1620 CG2 VAL A 99 6.326 15.527 -4.139 1.00 13.31 C ATOM 0 H VAL A 99 5.872 13.767 -2.229 1.00 71.42 H new ATOM 0 HA VAL A 99 8.566 14.296 -2.921 1.00 0.44 H new ATOM 0 HB VAL A 99 6.228 16.018 -2.057 1.00 62.31 H new ATOM 0 HG11 VAL A 99 7.296 17.895 -3.320 1.00 32.15 H new ATOM 0 HG12 VAL A 99 8.276 17.346 -1.940 1.00 32.15 H new ATOM 0 HG13 VAL A 99 8.721 16.864 -3.594 1.00 32.15 H new ATOM 0 HG21 VAL A 99 5.800 16.418 -4.482 1.00 13.31 H new ATOM 0 HG22 VAL A 99 7.080 15.245 -4.874 1.00 13.31 H new ATOM 0 HG23 VAL A 99 5.615 14.710 -4.017 1.00 13.31 H new ATOM 1630 N TYR A 100 7.744 14.903 0.223 1.00 12.33 N ATOM 1631 CA TYR A 100 8.223 15.440 1.495 1.00 33.23 C ATOM 1632 C TYR A 100 9.233 14.465 2.077 1.00 33.13 C ATOM 1633 O TYR A 100 10.433 14.622 1.865 1.00 55.22 O ATOM 1634 CB TYR A 100 7.059 15.735 2.459 1.00 20.43 C ATOM 1635 CG TYR A 100 6.433 17.088 2.217 1.00 12.51 C ATOM 1636 CD1 TYR A 100 5.690 17.312 1.047 1.00 31.02 C ATOM 1637 CD2 TYR A 100 6.651 18.146 3.121 1.00 55.53 C ATOM 1638 CE1 TYR A 100 5.186 18.588 0.766 1.00 71.34 C ATOM 1639 CE2 TYR A 100 6.165 19.432 2.826 1.00 11.41 C ATOM 1640 CZ TYR A 100 5.440 19.668 1.637 1.00 4.11 C ATOM 1641 OH TYR A 100 5.014 20.928 1.346 1.00 63.24 O ATOM 0 H TYR A 100 6.821 14.472 0.275 1.00 12.33 H new ATOM 0 HA TYR A 100 8.715 16.399 1.332 1.00 33.23 H new ATOM 0 HB2 TYR A 100 6.298 14.962 2.351 1.00 20.43 H new ATOM 0 HB3 TYR A 100 7.421 15.685 3.486 1.00 20.43 H new ATOM 0 HD1 TYR A 100 5.507 16.498 0.362 1.00 31.02 H new ATOM 0 HD2 TYR A 100 7.191 17.970 4.040 1.00 55.53 H new ATOM 0 HE1 TYR A 100 4.598 18.747 -0.126 1.00 71.34 H new ATOM 0 HE2 TYR A 100 6.347 20.245 3.513 1.00 11.41 H new ATOM 0 HH TYR A 100 4.533 20.922 0.492 1.00 63.24 H new ATOM 1651 N MET A 101 8.734 13.444 2.780 1.00 3.21 N ATOM 1652 CA MET A 101 9.445 12.227 3.166 1.00 13.45 C ATOM 1653 C MET A 101 10.844 12.512 3.733 1.00 21.15 C ATOM 1654 O MET A 101 11.816 11.790 3.479 1.00 13.34 O ATOM 1655 CB MET A 101 9.431 11.264 1.966 1.00 71.14 C ATOM 1656 CG MET A 101 8.011 11.112 1.408 1.00 52.21 C ATOM 1657 SD MET A 101 6.687 10.843 2.624 1.00 42.52 S ATOM 1658 CE MET A 101 6.507 9.074 2.387 1.00 14.13 C ATOM 0 H MET A 101 7.770 13.447 3.112 1.00 3.21 H new ATOM 0 HA MET A 101 8.933 11.743 3.998 1.00 13.45 H new ATOM 0 HB2 MET A 101 10.095 11.637 1.186 1.00 71.14 H new ATOM 0 HB3 MET A 101 9.813 10.290 2.271 1.00 71.14 H new ATOM 0 HG2 MET A 101 7.772 12.008 0.835 1.00 52.21 H new ATOM 0 HG3 MET A 101 8.007 10.276 0.708 1.00 52.21 H new ATOM 0 HE1 MET A 101 6.163 8.616 3.314 1.00 14.13 H new ATOM 0 HE2 MET A 101 5.780 8.885 1.598 1.00 14.13 H new ATOM 0 HE3 MET A 101 7.468 8.645 2.105 1.00 14.13 H new ATOM 1668 N HIS A 102 10.933 13.595 4.507 1.00 31.21 N ATOM 1669 CA HIS A 102 12.127 14.168 5.106 1.00 3.42 C ATOM 1670 C HIS A 102 11.725 14.544 6.538 1.00 53.51 C ATOM 1671 O HIS A 102 11.685 15.720 6.904 1.00 71.40 O ATOM 1672 CB HIS A 102 12.584 15.344 4.228 1.00 15.34 C ATOM 1673 CG HIS A 102 13.899 15.941 4.644 1.00 14.31 C ATOM 1674 ND1 HIS A 102 14.185 16.489 5.874 1.00 44.14 N ATOM 1675 CD2 HIS A 102 15.029 16.004 3.877 1.00 40.10 C ATOM 1676 CE1 HIS A 102 15.472 16.853 5.861 1.00 41.23 C ATOM 1677 NE2 HIS A 102 16.025 16.592 4.662 1.00 71.00 N ATOM 0 H HIS A 102 10.101 14.134 4.747 1.00 31.21 H new ATOM 0 HA HIS A 102 12.984 13.497 5.160 1.00 3.42 H new ATOM 0 HB2 HIS A 102 12.661 15.005 3.195 1.00 15.34 H new ATOM 0 HB3 HIS A 102 11.820 16.121 4.252 1.00 15.34 H new ATOM 0 HD1 HIS A 102 13.535 16.598 6.652 1.00 44.14 H new ATOM 0 HD2 HIS A 102 15.133 15.664 2.857 1.00 40.10 H new ATOM 0 HE1 HIS A 102 15.995 17.295 6.696 1.00 41.23 H new ATOM 1685 N GLN A 103 11.255 13.536 7.275 1.00 0.22 N ATOM 1686 CA GLN A 103 10.584 13.598 8.576 1.00 61.12 C ATOM 1687 C GLN A 103 10.181 12.198 9.080 1.00 53.22 C ATOM 1688 O GLN A 103 9.634 12.097 10.180 1.00 62.53 O ATOM 1689 CB GLN A 103 9.321 14.496 8.505 1.00 55.01 C ATOM 1690 CG GLN A 103 8.256 13.886 7.597 1.00 11.21 C ATOM 1691 CD GLN A 103 7.069 14.779 7.273 1.00 53.40 C ATOM 1692 OE1 GLN A 103 5.974 14.605 7.800 1.00 44.32 O ATOM 1693 NE2 GLN A 103 7.218 15.694 6.333 1.00 33.55 N ATOM 0 H GLN A 103 11.341 12.573 6.950 1.00 0.22 H new ATOM 0 HA GLN A 103 11.298 14.028 9.278 1.00 61.12 H new ATOM 0 HB2 GLN A 103 8.913 14.633 9.506 1.00 55.01 H new ATOM 0 HB3 GLN A 103 9.595 15.484 8.135 1.00 55.01 H new ATOM 0 HG2 GLN A 103 8.730 13.591 6.661 1.00 11.21 H new ATOM 0 HG3 GLN A 103 7.884 12.976 8.067 1.00 11.21 H new ATOM 0 HE21 GLN A 103 8.130 15.835 5.898 1.00 33.55 H new ATOM 0 HE22 GLN A 103 6.421 16.260 6.042 1.00 33.55 H new ATOM 1702 N HIS A 104 10.348 11.144 8.269 1.00 0.23 N ATOM 1703 CA HIS A 104 9.730 9.831 8.449 1.00 20.35 C ATOM 1704 C HIS A 104 10.710 8.674 8.182 1.00 24.44 C ATOM 1705 O HIS A 104 10.293 7.512 8.178 1.00 61.10 O ATOM 1706 CB HIS A 104 8.555 9.702 7.477 1.00 2.23 C ATOM 1707 CG HIS A 104 7.302 10.458 7.791 1.00 44.44 C ATOM 1708 ND1 HIS A 104 6.787 10.803 9.018 1.00 1.11 N ATOM 1709 CD2 HIS A 104 6.403 10.824 6.838 1.00 11.23 C ATOM 1710 CE1 HIS A 104 5.603 11.400 8.793 1.00 20.25 C ATOM 1711 NE2 HIS A 104 5.310 11.414 7.477 1.00 74.43 N ATOM 0 H HIS A 104 10.940 11.188 7.440 1.00 0.23 H new ATOM 0 HA HIS A 104 9.405 9.762 9.487 1.00 20.35 H new ATOM 0 HB2 HIS A 104 8.899 10.018 6.492 1.00 2.23 H new ATOM 0 HB3 HIS A 104 8.298 8.645 7.401 1.00 2.23 H new ATOM 0 HD2 HIS A 104 6.515 10.683 5.773 1.00 11.23 H new ATOM 0 HE1 HIS A 104 4.970 11.814 9.565 1.00 20.25 H new ATOM 0 HE2 HIS A 104 4.465 11.780 7.039 1.00 74.43 H new ATOM 1719 N SER A 105 11.970 8.951 7.849 1.00 4.53 N ATOM 1720 CA SER A 105 12.958 7.962 7.444 1.00 45.21 C ATOM 1721 C SER A 105 14.338 8.651 7.437 1.00 71.20 C ATOM 1722 O SER A 105 14.391 9.889 7.399 1.00 2.31 O ATOM 1723 CB SER A 105 12.525 7.420 6.060 1.00 21.45 C ATOM 1724 OG SER A 105 13.497 6.841 5.221 1.00 12.24 O ATOM 0 H SER A 105 12.339 9.902 7.855 1.00 4.53 H new ATOM 0 HA SER A 105 13.028 7.112 8.123 1.00 45.21 H new ATOM 0 HB2 SER A 105 11.747 6.675 6.227 1.00 21.45 H new ATOM 0 HB3 SER A 105 12.066 8.243 5.513 1.00 21.45 H new ATOM 0 HG SER A 105 13.075 6.545 4.387 1.00 12.24 H new ATOM 1730 N PRO A 106 15.434 7.871 7.461 1.00 43.33 N ATOM 1731 CA PRO A 106 16.818 8.331 7.327 1.00 72.02 C ATOM 1732 C PRO A 106 17.112 8.887 5.933 1.00 12.15 C ATOM 1733 O PRO A 106 16.184 9.213 5.193 1.00 35.31 O ATOM 1734 CB PRO A 106 17.684 7.115 7.692 1.00 74.24 C ATOM 1735 CG PRO A 106 16.805 5.938 7.314 1.00 45.24 C ATOM 1736 CD PRO A 106 15.413 6.430 7.658 1.00 74.05 C ATOM 0 HA PRO A 106 17.032 9.171 7.987 1.00 72.02 H new ATOM 0 HB2 PRO A 106 18.624 7.110 7.140 1.00 74.24 H new ATOM 0 HB3 PRO A 106 17.937 7.105 8.752 1.00 74.24 H new ATOM 0 HG2 PRO A 106 16.896 5.689 6.257 1.00 45.24 H new ATOM 0 HG3 PRO A 106 17.067 5.041 7.876 1.00 45.24 H new ATOM 0 HD2 PRO A 106 14.665 5.960 7.019 1.00 74.05 H new ATOM 0 HD3 PRO A 106 15.155 6.181 8.687 1.00 74.05 H new ATOM 1744 N HIS A 107 18.402 9.035 5.593 1.00 20.03 N ATOM 1745 CA HIS A 107 18.917 9.503 4.307 1.00 44.12 C ATOM 1746 C HIS A 107 18.517 8.581 3.133 1.00 1.32 C ATOM 1747 O HIS A 107 19.344 7.967 2.458 1.00 71.43 O ATOM 1748 CB HIS A 107 20.438 9.771 4.395 1.00 61.02 C ATOM 1749 CG HIS A 107 21.373 8.583 4.348 1.00 14.35 C ATOM 1750 ND1 HIS A 107 22.307 8.349 3.357 1.00 51.42 N ATOM 1751 CD2 HIS A 107 21.438 7.548 5.242 1.00 22.13 C ATOM 1752 CE1 HIS A 107 22.929 7.193 3.655 1.00 54.51 C ATOM 1753 NE2 HIS A 107 22.397 6.650 4.763 1.00 54.55 N ATOM 0 H HIS A 107 19.152 8.818 6.249 1.00 20.03 H new ATOM 0 HA HIS A 107 18.440 10.456 4.080 1.00 44.12 H new ATOM 0 HB2 HIS A 107 20.707 10.440 3.577 1.00 61.02 H new ATOM 0 HB3 HIS A 107 20.629 10.309 5.323 1.00 61.02 H new ATOM 0 HD1 HIS A 107 22.491 8.943 2.548 1.00 51.42 H new ATOM 0 HD2 HIS A 107 20.858 7.445 6.147 1.00 22.13 H new ATOM 0 HE1 HIS A 107 23.740 6.763 3.085 1.00 54.51 H new ATOM 1761 N THR A 108 17.223 8.432 2.877 1.00 15.42 N ATOM 1762 CA THR A 108 16.647 7.468 1.946 1.00 24.24 C ATOM 1763 C THR A 108 16.785 7.846 0.467 1.00 42.20 C ATOM 1764 O THR A 108 16.153 7.216 -0.390 1.00 15.45 O ATOM 1765 CB THR A 108 15.202 7.165 2.395 1.00 74.10 C ATOM 1766 OG1 THR A 108 14.664 6.067 1.677 1.00 30.43 O ATOM 1767 CG2 THR A 108 14.254 8.361 2.239 1.00 74.24 C ATOM 0 H THR A 108 16.514 9.006 3.333 1.00 15.42 H new ATOM 0 HA THR A 108 17.231 6.549 1.992 1.00 24.24 H new ATOM 0 HB THR A 108 15.274 6.927 3.456 1.00 74.10 H new ATOM 0 HG1 THR A 108 14.997 6.084 0.756 1.00 30.43 H new ATOM 0 HG21 THR A 108 13.255 8.080 2.573 1.00 74.24 H new ATOM 0 HG22 THR A 108 14.617 9.194 2.842 1.00 74.24 H new ATOM 0 HG23 THR A 108 14.216 8.661 1.192 1.00 74.24 H new ATOM 1775 N ALA A 109 17.648 8.816 0.181 1.00 24.41 N ATOM 1776 CA ALA A 109 17.833 9.504 -1.082 1.00 33.15 C ATOM 1777 C ALA A 109 16.511 10.028 -1.642 1.00 13.23 C ATOM 1778 O ALA A 109 15.467 10.055 -0.983 1.00 20.13 O ATOM 1779 CB ALA A 109 18.622 8.609 -2.044 1.00 63.30 C ATOM 0 H ALA A 109 18.289 9.167 0.892 1.00 24.41 H new ATOM 0 HA ALA A 109 18.432 10.401 -0.928 1.00 33.15 H new ATOM 0 HB1 ALA A 109 18.760 9.128 -2.993 1.00 63.30 H new ATOM 0 HB2 ALA A 109 19.596 8.379 -1.611 1.00 63.30 H new ATOM 0 HB3 ALA A 109 18.072 7.683 -2.213 1.00 63.30 H new ATOM 1785 N SER A 110 16.602 10.556 -2.850 1.00 34.03 N ATOM 1786 CA SER A 110 15.479 11.031 -3.626 1.00 0.41 C ATOM 1787 C SER A 110 14.884 9.852 -4.405 1.00 20.24 C ATOM 1788 O SER A 110 15.576 8.858 -4.687 1.00 52.41 O ATOM 1789 CB SER A 110 15.999 12.147 -4.534 1.00 31.13 C ATOM 1790 OG SER A 110 14.937 12.822 -5.172 1.00 60.24 O ATOM 0 H SER A 110 17.494 10.668 -3.331 1.00 34.03 H new ATOM 0 HA SER A 110 14.679 11.435 -3.006 1.00 0.41 H new ATOM 0 HB2 SER A 110 16.583 12.855 -3.946 1.00 31.13 H new ATOM 0 HB3 SER A 110 16.669 11.727 -5.284 1.00 31.13 H new ATOM 0 HG SER A 110 15.297 13.531 -5.745 1.00 60.24 H new ATOM 1796 N TYR A 111 13.603 9.971 -4.738 1.00 15.35 N ATOM 1797 CA TYR A 111 12.823 9.057 -5.569 1.00 54.50 C ATOM 1798 C TYR A 111 12.654 9.685 -6.958 1.00 23.02 C ATOM 1799 O TYR A 111 13.249 10.727 -7.236 1.00 20.44 O ATOM 1800 CB TYR A 111 11.469 8.769 -4.892 1.00 41.21 C ATOM 1801 CG TYR A 111 11.514 8.343 -3.429 1.00 74.24 C ATOM 1802 CD1 TYR A 111 12.641 7.689 -2.897 1.00 2.54 C ATOM 1803 CD2 TYR A 111 10.405 8.591 -2.598 1.00 64.10 C ATOM 1804 CE1 TYR A 111 12.669 7.292 -1.551 1.00 33.42 C ATOM 1805 CE2 TYR A 111 10.404 8.156 -1.259 1.00 72.03 C ATOM 1806 CZ TYR A 111 11.538 7.495 -0.733 1.00 13.45 C ATOM 1807 OH TYR A 111 11.564 7.059 0.554 1.00 52.22 O ATOM 0 H TYR A 111 13.044 10.760 -4.414 1.00 15.35 H new ATOM 0 HA TYR A 111 13.335 8.102 -5.684 1.00 54.50 H new ATOM 0 HB2 TYR A 111 10.853 9.665 -4.967 1.00 41.21 H new ATOM 0 HB3 TYR A 111 10.964 7.987 -5.459 1.00 41.21 H new ATOM 0 HD1 TYR A 111 13.493 7.491 -3.531 1.00 2.54 H new ATOM 0 HD2 TYR A 111 9.549 9.119 -2.991 1.00 64.10 H new ATOM 0 HE1 TYR A 111 13.556 6.831 -1.142 1.00 33.42 H new ATOM 0 HE2 TYR A 111 9.539 8.327 -0.635 1.00 72.03 H new ATOM 0 HH TYR A 111 10.712 7.273 0.989 1.00 52.22 H new ATOM 1817 N THR A 112 11.874 9.053 -7.842 1.00 21.15 N ATOM 1818 CA THR A 112 11.716 9.546 -9.220 1.00 63.24 C ATOM 1819 C THR A 112 10.256 9.739 -9.662 1.00 23.32 C ATOM 1820 O THR A 112 10.010 10.408 -10.670 1.00 44.11 O ATOM 1821 CB THR A 112 12.525 8.675 -10.213 1.00 71.22 C ATOM 1822 OG1 THR A 112 11.826 7.527 -10.653 1.00 74.21 O ATOM 1823 CG2 THR A 112 13.869 8.181 -9.668 1.00 41.10 C ATOM 0 H THR A 112 11.345 8.206 -7.633 1.00 21.15 H new ATOM 0 HA THR A 112 12.133 10.553 -9.230 1.00 63.24 H new ATOM 0 HB THR A 112 12.693 9.365 -11.040 1.00 71.22 H new ATOM 0 HG1 THR A 112 12.387 7.021 -11.277 1.00 74.21 H new ATOM 0 HG21 THR A 112 14.370 7.579 -10.426 1.00 41.10 H new ATOM 0 HG22 THR A 112 14.494 9.036 -9.412 1.00 41.10 H new ATOM 0 HG23 THR A 112 13.700 7.575 -8.778 1.00 41.10 H new ATOM 1831 N SER A 113 9.297 9.114 -8.972 1.00 31.32 N ATOM 1832 CA SER A 113 7.873 9.072 -9.294 1.00 14.32 C ATOM 1833 C SER A 113 7.134 8.343 -8.169 1.00 71.04 C ATOM 1834 O SER A 113 7.773 7.688 -7.339 1.00 75.42 O ATOM 1835 CB SER A 113 7.649 8.293 -10.607 1.00 62.40 C ATOM 1836 OG SER A 113 7.500 9.140 -11.727 1.00 34.02 O ATOM 0 H SER A 113 9.511 8.593 -8.122 1.00 31.32 H new ATOM 0 HA SER A 113 7.502 10.091 -9.406 1.00 14.32 H new ATOM 0 HB2 SER A 113 8.491 7.622 -10.774 1.00 62.40 H new ATOM 0 HB3 SER A 113 6.760 7.670 -10.507 1.00 62.40 H new ATOM 0 HG SER A 113 8.230 9.793 -11.742 1.00 34.02 H new ATOM 1842 N SER A 114 5.796 8.354 -8.217 1.00 13.25 N ATOM 1843 CA SER A 114 4.933 7.512 -7.396 1.00 33.45 C ATOM 1844 C SER A 114 5.362 6.047 -7.494 1.00 35.14 C ATOM 1845 O SER A 114 5.625 5.409 -6.480 1.00 60.13 O ATOM 1846 CB SER A 114 3.470 7.698 -7.830 1.00 53.14 C ATOM 1847 OG SER A 114 3.304 7.540 -9.233 1.00 20.12 O ATOM 0 H SER A 114 5.276 8.966 -8.846 1.00 13.25 H new ATOM 0 HA SER A 114 5.024 7.810 -6.352 1.00 33.45 H new ATOM 0 HB2 SER A 114 2.843 6.976 -7.308 1.00 53.14 H new ATOM 0 HB3 SER A 114 3.128 8.690 -7.534 1.00 53.14 H new ATOM 0 HG SER A 114 3.077 8.404 -9.635 1.00 20.12 H new ATOM 1853 N ARG A 115 5.438 5.516 -8.723 1.00 21.14 N ATOM 1854 CA ARG A 115 5.930 4.172 -9.016 1.00 20.30 C ATOM 1855 C ARG A 115 7.258 3.924 -8.309 1.00 4.34 C ATOM 1856 O ARG A 115 7.370 2.960 -7.567 1.00 23.13 O ATOM 1857 CB ARG A 115 6.048 3.955 -10.543 1.00 54.35 C ATOM 1858 CG ARG A 115 5.216 2.771 -11.046 1.00 34.31 C ATOM 1859 CD ARG A 115 3.717 3.083 -11.014 1.00 53.44 C ATOM 1860 NE ARG A 115 3.197 3.544 -12.308 1.00 63.45 N ATOM 1861 CZ ARG A 115 2.315 4.519 -12.545 1.00 35.43 C ATOM 1862 NH1 ARG A 115 2.037 5.424 -11.611 1.00 55.53 N ATOM 1863 NH2 ARG A 115 1.737 4.578 -13.737 1.00 1.43 N ATOM 0 H ARG A 115 5.151 6.026 -9.558 1.00 21.14 H new ATOM 0 HA ARG A 115 5.212 3.446 -8.636 1.00 20.30 H new ATOM 0 HB2 ARG A 115 5.729 4.861 -11.059 1.00 54.35 H new ATOM 0 HB3 ARG A 115 7.094 3.792 -10.801 1.00 54.35 H new ATOM 0 HG2 ARG A 115 5.515 2.522 -12.064 1.00 34.31 H new ATOM 0 HG3 ARG A 115 5.419 1.895 -10.430 1.00 34.31 H new ATOM 0 HD2 ARG A 115 3.172 2.190 -10.708 1.00 53.44 H new ATOM 0 HD3 ARG A 115 3.527 3.847 -10.260 1.00 53.44 H new ATOM 0 HE ARG A 115 3.555 3.058 -13.130 1.00 63.45 H new ATOM 0 HH11 ARG A 115 2.499 5.378 -10.703 1.00 55.53 H new ATOM 0 HH12 ARG A 115 1.362 6.164 -11.803 1.00 55.53 H new ATOM 0 HH21 ARG A 115 1.969 3.887 -14.451 1.00 1.43 H new ATOM 0 HH22 ARG A 115 1.061 5.314 -13.940 1.00 1.43 H new ATOM 1877 N ASP A 116 8.244 4.792 -8.515 1.00 62.11 N ATOM 1878 CA ASP A 116 9.593 4.566 -8.012 1.00 12.11 C ATOM 1879 C ASP A 116 9.644 4.494 -6.491 1.00 20.00 C ATOM 1880 O ASP A 116 10.288 3.603 -5.944 1.00 32.32 O ATOM 1881 CB ASP A 116 10.519 5.674 -8.492 1.00 21.44 C ATOM 1882 CG ASP A 116 11.935 5.373 -8.009 1.00 32.14 C ATOM 1883 OD1 ASP A 116 12.536 4.395 -8.513 1.00 41.23 O ATOM 1884 OD2 ASP A 116 12.423 6.066 -7.092 1.00 12.43 O ATOM 0 H ASP A 116 8.131 5.665 -9.031 1.00 62.11 H new ATOM 0 HA ASP A 116 9.920 3.602 -8.401 1.00 12.11 H new ATOM 0 HB2 ASP A 116 10.497 5.740 -9.580 1.00 21.44 H new ATOM 0 HB3 ASP A 116 10.186 6.638 -8.107 1.00 21.44 H new ATOM 1889 N ALA A 117 8.946 5.406 -5.812 1.00 72.34 N ATOM 1890 CA ALA A 117 8.887 5.448 -4.358 1.00 23.40 C ATOM 1891 C ALA A 117 8.487 4.093 -3.754 1.00 52.13 C ATOM 1892 O ALA A 117 9.058 3.702 -2.734 1.00 50.53 O ATOM 1893 CB ALA A 117 7.943 6.565 -3.913 1.00 74.42 C ATOM 0 H ALA A 117 8.402 6.141 -6.264 1.00 72.34 H new ATOM 0 HA ALA A 117 9.887 5.663 -3.982 1.00 23.40 H new ATOM 0 HB1 ALA A 117 7.901 6.594 -2.824 1.00 74.42 H new ATOM 0 HB2 ALA A 117 8.309 7.521 -4.287 1.00 74.42 H new ATOM 0 HB3 ALA A 117 6.945 6.378 -4.310 1.00 74.42 H new ATOM 1899 N MET A 118 7.599 3.327 -4.411 1.00 12.52 N ATOM 1900 CA MET A 118 7.200 2.003 -3.930 1.00 42.42 C ATOM 1901 C MET A 118 8.407 1.100 -3.699 1.00 51.42 C ATOM 1902 O MET A 118 8.419 0.345 -2.729 1.00 4.13 O ATOM 1903 CB MET A 118 6.222 1.278 -4.881 1.00 11.21 C ATOM 1904 CG MET A 118 4.788 1.304 -4.363 1.00 31.11 C ATOM 1905 SD MET A 118 4.126 2.976 -4.164 1.00 23.31 S ATOM 1906 CE MET A 118 3.596 3.226 -5.867 1.00 23.31 C ATOM 0 H MET A 118 7.145 3.608 -5.280 1.00 12.52 H new ATOM 0 HA MET A 118 6.687 2.190 -2.987 1.00 42.42 H new ATOM 0 HB2 MET A 118 6.260 1.747 -5.864 1.00 11.21 H new ATOM 0 HB3 MET A 118 6.542 0.244 -5.008 1.00 11.21 H new ATOM 0 HG2 MET A 118 4.151 0.749 -5.051 1.00 31.11 H new ATOM 0 HG3 MET A 118 4.747 0.788 -3.404 1.00 31.11 H new ATOM 0 HE1 MET A 118 3.469 4.292 -6.056 1.00 23.31 H new ATOM 0 HE2 MET A 118 4.349 2.825 -6.545 1.00 23.31 H new ATOM 0 HE3 MET A 118 2.649 2.712 -6.032 1.00 23.31 H new ATOM 1916 N SER A 119 9.416 1.126 -4.573 1.00 24.03 N ATOM 1917 CA SER A 119 10.530 0.196 -4.457 1.00 41.32 C ATOM 1918 C SER A 119 11.465 0.553 -3.283 1.00 73.45 C ATOM 1919 O SER A 119 12.326 -0.263 -2.941 1.00 14.43 O ATOM 1920 CB SER A 119 11.221 0.071 -5.820 1.00 62.14 C ATOM 1921 OG SER A 119 11.909 1.241 -6.169 1.00 53.32 O ATOM 0 H SER A 119 9.481 1.774 -5.358 1.00 24.03 H new ATOM 0 HA SER A 119 10.163 -0.797 -4.196 1.00 41.32 H new ATOM 0 HB2 SER A 119 11.918 -0.767 -5.798 1.00 62.14 H new ATOM 0 HB3 SER A 119 10.477 -0.154 -6.584 1.00 62.14 H new ATOM 0 HG SER A 119 11.287 1.999 -6.169 1.00 53.32 H new ATOM 1927 N LYS A 120 11.271 1.714 -2.638 1.00 52.54 N ATOM 1928 CA LYS A 120 11.925 2.154 -1.405 1.00 22.41 C ATOM 1929 C LYS A 120 11.004 1.983 -0.179 1.00 73.24 C ATOM 1930 O LYS A 120 11.269 2.588 0.863 1.00 14.10 O ATOM 1931 CB LYS A 120 12.366 3.631 -1.552 1.00 43.45 C ATOM 1932 CG LYS A 120 13.690 3.847 -2.304 1.00 13.33 C ATOM 1933 CD LYS A 120 13.568 4.478 -3.697 1.00 31.10 C ATOM 1934 CE LYS A 120 13.392 3.446 -4.805 1.00 4.32 C ATOM 1935 NZ LYS A 120 13.934 3.931 -6.089 1.00 71.13 N ATOM 0 H LYS A 120 10.612 2.410 -2.988 1.00 52.54 H new ATOM 0 HA LYS A 120 12.802 1.528 -1.240 1.00 22.41 H new ATOM 0 HB2 LYS A 120 11.579 4.179 -2.070 1.00 43.45 H new ATOM 0 HB3 LYS A 120 12.456 4.067 -0.557 1.00 43.45 H new ATOM 0 HG2 LYS A 120 14.334 4.480 -1.694 1.00 13.33 H new ATOM 0 HG3 LYS A 120 14.191 2.884 -2.404 1.00 13.33 H new ATOM 0 HD2 LYS A 120 12.719 5.162 -3.707 1.00 31.10 H new ATOM 0 HD3 LYS A 120 14.459 5.072 -3.900 1.00 31.10 H new ATOM 0 HE2 LYS A 120 13.894 2.520 -4.524 1.00 4.32 H new ATOM 0 HE3 LYS A 120 12.334 3.212 -4.921 1.00 4.32 H new ATOM 0 HZ1 LYS A 120 13.608 3.313 -6.859 1.00 71.13 H new ATOM 0 HZ2 LYS A 120 13.603 4.902 -6.261 1.00 71.13 H new ATOM 0 HZ3 LYS A 120 14.973 3.920 -6.053 1.00 71.13 H new ATOM 1949 N TYR A 121 9.912 1.216 -0.242 1.00 22.44 N ATOM 1950 CA TYR A 121 9.183 0.847 0.969 1.00 30.11 C ATOM 1951 C TYR A 121 10.053 -0.019 1.893 1.00 10.34 C ATOM 1952 O TYR A 121 11.079 -0.552 1.465 1.00 23.43 O ATOM 1953 CB TYR A 121 7.868 0.149 0.601 1.00 22.21 C ATOM 1954 CG TYR A 121 6.701 1.106 0.468 1.00 34.24 C ATOM 1955 CD1 TYR A 121 6.374 1.998 1.509 1.00 22.12 C ATOM 1956 CD2 TYR A 121 5.896 1.066 -0.677 1.00 72.33 C ATOM 1957 CE1 TYR A 121 5.271 2.855 1.398 1.00 51.54 C ATOM 1958 CE2 TYR A 121 4.791 1.919 -0.801 1.00 30.32 C ATOM 1959 CZ TYR A 121 4.469 2.821 0.241 1.00 52.25 C ATOM 1960 OH TYR A 121 3.383 3.636 0.170 1.00 42.43 O ATOM 0 H TYR A 121 9.519 0.844 -1.107 1.00 22.44 H new ATOM 0 HA TYR A 121 8.937 1.753 1.522 1.00 30.11 H new ATOM 0 HB2 TYR A 121 7.999 -0.387 -0.339 1.00 22.21 H new ATOM 0 HB3 TYR A 121 7.634 -0.596 1.362 1.00 22.21 H new ATOM 0 HD1 TYR A 121 6.980 2.021 2.402 1.00 22.12 H new ATOM 0 HD2 TYR A 121 6.129 0.372 -1.471 1.00 72.33 H new ATOM 0 HE1 TYR A 121 5.036 3.541 2.199 1.00 51.54 H new ATOM 0 HE2 TYR A 121 4.184 1.888 -1.694 1.00 30.32 H new ATOM 0 HH TYR A 121 2.929 3.502 -0.688 1.00 42.43 H new ATOM 1970 N PRO A 122 9.666 -0.200 3.168 1.00 12.31 N ATOM 1971 CA PRO A 122 10.449 -0.968 4.118 1.00 61.31 C ATOM 1972 C PRO A 122 10.448 -2.468 3.827 1.00 25.11 C ATOM 1973 O PRO A 122 11.240 -3.174 4.447 1.00 71.44 O ATOM 1974 CB PRO A 122 9.879 -0.636 5.495 1.00 32.13 C ATOM 1975 CG PRO A 122 8.436 -0.229 5.222 1.00 61.33 C ATOM 1976 CD PRO A 122 8.515 0.389 3.829 1.00 53.54 C ATOM 0 HA PRO A 122 11.503 -0.697 4.053 1.00 61.31 H new ATOM 0 HB2 PRO A 122 9.929 -1.496 6.163 1.00 32.13 H new ATOM 0 HB3 PRO A 122 10.436 0.171 5.971 1.00 32.13 H new ATOM 0 HG2 PRO A 122 7.763 -1.086 5.246 1.00 61.33 H new ATOM 0 HG3 PRO A 122 8.071 0.484 5.961 1.00 61.33 H new ATOM 0 HD2 PRO A 122 7.603 0.189 3.266 1.00 53.54 H new ATOM 0 HD3 PRO A 122 8.619 1.472 3.893 1.00 53.54 H new ATOM 1984 N GLU A 123 9.658 -2.970 2.871 1.00 53.25 N ATOM 1985 CA GLU A 123 9.567 -4.411 2.614 1.00 11.53 C ATOM 1986 C GLU A 123 9.298 -4.692 1.129 1.00 51.13 C ATOM 1987 O GLU A 123 8.589 -3.912 0.489 1.00 22.02 O ATOM 1988 CB GLU A 123 8.459 -5.054 3.483 1.00 11.51 C ATOM 1989 CG GLU A 123 8.127 -4.306 4.794 1.00 63.22 C ATOM 1990 CD GLU A 123 6.949 -4.874 5.571 1.00 50.23 C ATOM 1991 OE1 GLU A 123 6.556 -6.040 5.344 1.00 22.22 O ATOM 1992 OE2 GLU A 123 6.386 -4.146 6.418 1.00 71.23 O ATOM 0 H GLU A 123 9.072 -2.399 2.262 1.00 53.25 H new ATOM 0 HA GLU A 123 10.526 -4.855 2.881 1.00 11.53 H new ATOM 0 HB2 GLU A 123 7.550 -5.128 2.886 1.00 11.51 H new ATOM 0 HB3 GLU A 123 8.760 -6.072 3.732 1.00 11.51 H new ATOM 0 HG2 GLU A 123 9.008 -4.318 5.436 1.00 63.22 H new ATOM 0 HG3 GLU A 123 7.919 -3.262 4.558 1.00 63.22 H new ATOM 1999 N ARG A 124 9.777 -5.832 0.605 1.00 43.15 N ATOM 2000 CA ARG A 124 9.502 -6.327 -0.753 1.00 25.43 C ATOM 2001 C ARG A 124 7.999 -6.508 -0.921 1.00 5.22 C ATOM 2002 O ARG A 124 7.429 -5.900 -1.819 1.00 14.44 O ATOM 2003 CB ARG A 124 10.258 -7.641 -1.075 1.00 33.04 C ATOM 2004 CG ARG A 124 11.786 -7.485 -1.031 1.00 4.34 C ATOM 2005 CD ARG A 124 12.570 -8.780 -1.312 1.00 43.24 C ATOM 2006 NE ARG A 124 12.898 -8.969 -2.739 1.00 42.44 N ATOM 2007 CZ ARG A 124 12.471 -9.949 -3.545 1.00 12.44 C ATOM 2008 NH1 ARG A 124 11.498 -10.759 -3.175 1.00 4.13 N ATOM 2009 NH2 ARG A 124 13.007 -10.110 -4.747 1.00 3.23 N ATOM 0 H ARG A 124 10.387 -6.455 1.134 1.00 43.15 H new ATOM 0 HA ARG A 124 9.869 -5.586 -1.464 1.00 25.43 H new ATOM 0 HB2 ARG A 124 9.957 -8.410 -0.363 1.00 33.04 H new ATOM 0 HB3 ARG A 124 9.963 -7.989 -2.065 1.00 33.04 H new ATOM 0 HG2 ARG A 124 12.082 -6.731 -1.760 1.00 4.34 H new ATOM 0 HG3 ARG A 124 12.072 -7.109 -0.049 1.00 4.34 H new ATOM 0 HD2 ARG A 124 13.493 -8.770 -0.733 1.00 43.24 H new ATOM 0 HD3 ARG A 124 11.986 -9.632 -0.965 1.00 43.24 H new ATOM 0 HE ARG A 124 13.519 -8.276 -3.157 1.00 42.44 H new ATOM 0 HH11 ARG A 124 11.058 -10.644 -2.262 1.00 4.13 H new ATOM 0 HH12 ARG A 124 11.185 -11.500 -3.802 1.00 4.13 H new ATOM 0 HH21 ARG A 124 13.749 -9.485 -5.062 1.00 3.23 H new ATOM 0 HH22 ARG A 124 12.677 -10.859 -5.356 1.00 3.23 H new ATOM 2023 N CYS A 125 7.358 -7.247 -0.005 1.00 61.31 N ATOM 2024 CA CYS A 125 5.901 -7.341 0.071 1.00 3.24 C ATOM 2025 C CYS A 125 5.235 -5.964 0.043 1.00 53.41 C ATOM 2026 O CYS A 125 4.177 -5.807 -0.563 1.00 13.53 O ATOM 2027 CB CYS A 125 5.475 -8.046 1.370 1.00 50.52 C ATOM 2028 SG CYS A 125 5.131 -9.794 1.088 1.00 51.32 S ATOM 0 H CYS A 125 7.841 -7.797 0.705 1.00 61.31 H new ATOM 0 HA CYS A 125 5.581 -7.911 -0.801 1.00 3.24 H new ATOM 0 HB2 CYS A 125 6.263 -7.945 2.116 1.00 50.52 H new ATOM 0 HB3 CYS A 125 4.588 -7.560 1.775 1.00 50.52 H new ATOM 0 HG CYS A 125 6.092 -10.512 1.589 1.00 51.32 H new ATOM 2034 N THR A 126 5.791 -4.972 0.746 1.00 34.20 N ATOM 2035 CA THR A 126 5.141 -3.677 0.841 1.00 51.24 C ATOM 2036 C THR A 126 5.178 -2.923 -0.500 1.00 4.10 C ATOM 2037 O THR A 126 4.228 -2.202 -0.817 1.00 70.41 O ATOM 2038 CB THR A 126 5.687 -2.878 2.025 1.00 73.05 C ATOM 2039 OG1 THR A 126 5.498 -3.634 3.207 1.00 63.15 O ATOM 2040 CG2 THR A 126 4.938 -1.558 2.218 1.00 10.10 C ATOM 0 H THR A 126 6.676 -5.046 1.248 1.00 34.20 H new ATOM 0 HA THR A 126 4.082 -3.831 1.049 1.00 51.24 H new ATOM 0 HB THR A 126 6.738 -2.670 1.825 1.00 73.05 H new ATOM 0 HG1 THR A 126 5.696 -3.076 3.988 1.00 63.15 H new ATOM 0 HG21 THR A 126 5.358 -1.022 3.069 1.00 10.10 H new ATOM 0 HG22 THR A 126 5.038 -0.948 1.320 1.00 10.10 H new ATOM 0 HG23 THR A 126 3.883 -1.762 2.402 1.00 10.10 H new ATOM 2048 N ALA A 127 6.234 -3.106 -1.297 1.00 34.01 N ATOM 2049 CA ALA A 127 6.435 -2.469 -2.588 1.00 14.22 C ATOM 2050 C ALA A 127 5.484 -3.052 -3.644 1.00 61.43 C ATOM 2051 O ALA A 127 5.878 -3.889 -4.461 1.00 51.13 O ATOM 2052 CB ALA A 127 7.916 -2.642 -2.971 1.00 52.32 C ATOM 0 H ALA A 127 7.001 -3.729 -1.044 1.00 34.01 H new ATOM 0 HA ALA A 127 6.201 -1.406 -2.533 1.00 14.22 H new ATOM 0 HB1 ALA A 127 8.099 -2.173 -3.938 1.00 52.32 H new ATOM 0 HB2 ALA A 127 8.545 -2.172 -2.215 1.00 52.32 H new ATOM 0 HB3 ALA A 127 8.154 -3.704 -3.032 1.00 52.32 H new ATOM 2058 N VAL A 128 4.235 -2.584 -3.647 1.00 53.43 N ATOM 2059 CA VAL A 128 3.206 -2.971 -4.604 1.00 63.35 C ATOM 2060 C VAL A 128 2.189 -1.831 -4.726 1.00 64.05 C ATOM 2061 O VAL A 128 2.008 -1.054 -3.784 1.00 52.21 O ATOM 2062 CB VAL A 128 2.592 -4.326 -4.173 1.00 32.30 C ATOM 2063 CG1 VAL A 128 2.021 -4.313 -2.749 1.00 22.32 C ATOM 2064 CG2 VAL A 128 1.509 -4.858 -5.121 1.00 34.14 C ATOM 0 H VAL A 128 3.905 -1.905 -2.961 1.00 53.43 H new ATOM 0 HA VAL A 128 3.619 -3.128 -5.601 1.00 63.35 H new ATOM 0 HB VAL A 128 3.448 -5.000 -4.213 1.00 32.30 H new ATOM 0 HG11 VAL A 128 1.608 -5.294 -2.514 1.00 22.32 H new ATOM 0 HG12 VAL A 128 2.815 -4.074 -2.041 1.00 22.32 H new ATOM 0 HG13 VAL A 128 1.235 -3.562 -2.679 1.00 22.32 H new ATOM 0 HG21 VAL A 128 1.132 -5.810 -4.746 1.00 34.14 H new ATOM 0 HG22 VAL A 128 0.690 -4.141 -5.177 1.00 34.14 H new ATOM 0 HG23 VAL A 128 1.934 -5.002 -6.114 1.00 34.14 H new ATOM 2074 N GLY A 129 1.511 -1.737 -5.871 1.00 54.33 N ATOM 2075 CA GLY A 129 0.427 -0.788 -6.126 1.00 23.24 C ATOM 2076 C GLY A 129 -0.672 -1.451 -6.953 1.00 72.14 C ATOM 2077 O GLY A 129 -0.393 -2.432 -7.655 1.00 22.34 O ATOM 0 H GLY A 129 1.708 -2.338 -6.671 1.00 54.33 H new ATOM 0 HA2 GLY A 129 0.016 -0.432 -5.181 1.00 23.24 H new ATOM 0 HA3 GLY A 129 0.814 0.083 -6.654 1.00 23.24 H new ATOM 2081 N LEU A 130 -1.912 -0.950 -6.855 1.00 24.23 N ATOM 2082 CA LEU A 130 -3.095 -1.490 -7.531 1.00 30.12 C ATOM 2083 C LEU A 130 -4.141 -0.375 -7.584 1.00 2.53 C ATOM 2084 O LEU A 130 -4.543 0.068 -6.514 1.00 65.35 O ATOM 2085 CB LEU A 130 -3.603 -2.733 -6.759 1.00 63.25 C ATOM 2086 CG LEU A 130 -4.868 -3.448 -7.283 1.00 50.23 C ATOM 2087 CD1 LEU A 130 -6.174 -2.827 -6.782 1.00 3.24 C ATOM 2088 CD2 LEU A 130 -4.910 -3.590 -8.807 1.00 21.22 C ATOM 0 H LEU A 130 -2.123 -0.132 -6.284 1.00 24.23 H new ATOM 0 HA LEU A 130 -2.870 -1.814 -8.547 1.00 30.12 H new ATOM 0 HB2 LEU A 130 -2.794 -3.463 -6.733 1.00 63.25 H new ATOM 0 HB3 LEU A 130 -3.793 -2.431 -5.729 1.00 63.25 H new ATOM 0 HG LEU A 130 -4.788 -4.449 -6.859 1.00 50.23 H new ATOM 0 HD11 LEU A 130 -7.020 -3.380 -7.190 1.00 3.24 H new ATOM 0 HD12 LEU A 130 -6.203 -2.870 -5.693 1.00 3.24 H new ATOM 0 HD13 LEU A 130 -6.230 -1.788 -7.105 1.00 3.24 H new ATOM 0 HD21 LEU A 130 -5.827 -4.101 -9.100 1.00 21.22 H new ATOM 0 HD22 LEU A 130 -4.884 -2.601 -9.265 1.00 21.22 H new ATOM 0 HD23 LEU A 130 -4.049 -4.168 -9.142 1.00 21.22 H new ATOM 2100 N ARG A 131 -4.562 0.142 -8.751 1.00 52.54 N ATOM 2101 CA ARG A 131 -5.586 1.211 -8.830 1.00 70.03 C ATOM 2102 C ARG A 131 -6.333 1.166 -10.170 1.00 34.32 C ATOM 2103 O ARG A 131 -5.926 0.415 -11.054 1.00 54.31 O ATOM 2104 CB ARG A 131 -4.928 2.577 -8.551 1.00 21.32 C ATOM 2105 CG ARG A 131 -5.836 3.716 -8.043 1.00 41.22 C ATOM 2106 CD ARG A 131 -6.224 4.788 -9.072 1.00 1.44 C ATOM 2107 NE ARG A 131 -5.080 5.491 -9.683 1.00 53.22 N ATOM 2108 CZ ARG A 131 -5.189 6.536 -10.514 1.00 71.12 C ATOM 2109 NH1 ARG A 131 -6.372 6.828 -11.053 1.00 72.20 N ATOM 2110 NH2 ARG A 131 -4.131 7.286 -10.787 1.00 71.42 N ATOM 0 H ARG A 131 -4.210 -0.161 -9.659 1.00 52.54 H new ATOM 0 HA ARG A 131 -6.343 1.048 -8.063 1.00 70.03 H new ATOM 0 HB2 ARG A 131 -4.137 2.425 -7.817 1.00 21.32 H new ATOM 0 HB3 ARG A 131 -4.449 2.914 -9.471 1.00 21.32 H new ATOM 0 HG2 ARG A 131 -6.751 3.274 -7.648 1.00 41.22 H new ATOM 0 HG3 ARG A 131 -5.334 4.208 -7.210 1.00 41.22 H new ATOM 0 HD2 ARG A 131 -6.811 4.320 -9.862 1.00 1.44 H new ATOM 0 HD3 ARG A 131 -6.869 5.522 -8.588 1.00 1.44 H new ATOM 0 HE ARG A 131 -4.142 5.159 -9.457 1.00 53.22 H new ATOM 0 HH11 ARG A 131 -7.188 6.257 -10.832 1.00 72.20 H new ATOM 0 HH12 ARG A 131 -6.462 7.622 -11.686 1.00 72.20 H new ATOM 0 HH21 ARG A 131 -3.229 7.069 -10.364 1.00 71.42 H new ATOM 0 HH22 ARG A 131 -4.219 8.081 -11.420 1.00 71.42 H new ATOM 2124 N LEU A 132 -7.427 1.930 -10.311 1.00 5.40 N ATOM 2125 CA LEU A 132 -8.171 2.067 -11.552 1.00 53.12 C ATOM 2126 C LEU A 132 -7.434 2.962 -12.523 1.00 2.14 C ATOM 2127 O LEU A 132 -6.666 3.836 -12.117 1.00 53.45 O ATOM 2128 CB LEU A 132 -9.562 2.662 -11.246 1.00 74.12 C ATOM 2129 CG LEU A 132 -10.662 1.619 -11.450 1.00 61.02 C ATOM 2130 CD1 LEU A 132 -10.541 0.407 -10.552 1.00 3.42 C ATOM 2131 CD2 LEU A 132 -12.031 2.291 -11.322 1.00 13.52 C ATOM 0 H LEU A 132 -7.819 2.477 -9.544 1.00 5.40 H new ATOM 0 HA LEU A 132 -8.280 1.083 -12.009 1.00 53.12 H new ATOM 0 HB2 LEU A 132 -9.588 3.026 -10.219 1.00 74.12 H new ATOM 0 HB3 LEU A 132 -9.745 3.520 -11.893 1.00 74.12 H new ATOM 0 HG LEU A 132 -10.543 1.221 -12.458 1.00 61.02 H new ATOM 0 HD11 LEU A 132 -11.359 -0.283 -10.760 1.00 3.42 H new ATOM 0 HD12 LEU A 132 -9.590 -0.091 -10.739 1.00 3.42 H new ATOM 0 HD13 LEU A 132 -10.587 0.721 -9.509 1.00 3.42 H new ATOM 0 HD21 LEU A 132 -12.816 1.549 -11.467 1.00 13.52 H new ATOM 0 HD22 LEU A 132 -12.128 2.733 -10.330 1.00 13.52 H new ATOM 0 HD23 LEU A 132 -12.125 3.071 -12.077 1.00 13.52 H new ATOM 2143 N ASN A 133 -7.782 2.808 -13.794 1.00 0.23 N ATOM 2144 CA ASN A 133 -7.314 3.682 -14.863 1.00 23.32 C ATOM 2145 C ASN A 133 -8.503 4.332 -15.548 1.00 75.43 C ATOM 2146 O ASN A 133 -9.634 4.250 -15.065 1.00 73.11 O ATOM 2147 CB ASN A 133 -6.404 2.943 -15.855 1.00 3.33 C ATOM 2148 CG ASN A 133 -7.104 1.918 -16.738 1.00 3.54 C ATOM 2149 OD1 ASN A 133 -8.268 1.593 -16.537 1.00 61.45 O ATOM 2150 ND2 ASN A 133 -6.419 1.412 -17.740 1.00 4.51 N ATOM 0 H ASN A 133 -8.403 2.066 -14.115 1.00 0.23 H new ATOM 0 HA ASN A 133 -6.698 4.468 -14.425 1.00 23.32 H new ATOM 0 HB2 ASN A 133 -5.918 3.679 -16.495 1.00 3.33 H new ATOM 0 HB3 ASN A 133 -5.617 2.439 -15.295 1.00 3.33 H new ATOM 0 HD21 ASN A 133 -6.856 0.736 -18.367 1.00 4.51 H new ATOM 0 HD22 ASN A 133 -5.451 1.695 -17.891 1.00 4.51 H new ATOM 2157 N GLU A 134 -8.235 4.984 -16.675 1.00 51.24 N ATOM 2158 CA GLU A 134 -9.233 5.694 -17.467 1.00 23.31 C ATOM 2159 C GLU A 134 -10.323 4.770 -18.021 1.00 61.00 C ATOM 2160 O GLU A 134 -11.384 5.277 -18.383 1.00 54.40 O ATOM 2161 CB GLU A 134 -8.541 6.486 -18.585 1.00 75.24 C ATOM 2162 CG GLU A 134 -7.774 7.696 -18.028 1.00 23.24 C ATOM 2163 CD GLU A 134 -7.940 8.947 -18.889 1.00 31.11 C ATOM 2164 OE1 GLU A 134 -7.374 9.030 -19.998 1.00 44.13 O ATOM 2165 OE2 GLU A 134 -8.660 9.871 -18.448 1.00 60.42 O ATOM 0 H GLU A 134 -7.297 5.034 -17.072 1.00 51.24 H new ATOM 0 HA GLU A 134 -9.747 6.390 -16.804 1.00 23.31 H new ATOM 0 HB2 GLU A 134 -7.852 5.833 -19.122 1.00 75.24 H new ATOM 0 HB3 GLU A 134 -9.285 6.826 -19.305 1.00 75.24 H new ATOM 0 HG2 GLU A 134 -8.122 7.907 -17.017 1.00 23.24 H new ATOM 0 HG3 GLU A 134 -6.715 7.448 -17.956 1.00 23.24 H new ATOM 2172 N GLU A 135 -10.122 3.447 -18.009 1.00 14.51 N ATOM 2173 CA GLU A 135 -11.136 2.452 -18.358 1.00 61.04 C ATOM 2174 C GLU A 135 -11.367 1.447 -17.248 1.00 73.13 C ATOM 2175 O GLU A 135 -11.923 0.362 -17.448 1.00 43.42 O ATOM 2176 CB GLU A 135 -10.776 1.733 -19.668 1.00 40.11 C ATOM 2177 CG GLU A 135 -10.662 2.677 -20.876 1.00 0.32 C ATOM 2178 CD GLU A 135 -11.433 2.137 -22.078 1.00 12.31 C ATOM 2179 OE1 GLU A 135 -10.993 1.131 -22.679 1.00 41.45 O ATOM 2180 OE2 GLU A 135 -12.495 2.707 -22.421 1.00 71.23 O ATOM 0 H GLU A 135 -9.227 3.031 -17.750 1.00 14.51 H new ATOM 0 HA GLU A 135 -12.070 2.995 -18.501 1.00 61.04 H new ATOM 0 HB2 GLU A 135 -9.830 1.208 -19.537 1.00 40.11 H new ATOM 0 HB3 GLU A 135 -11.533 0.977 -19.878 1.00 40.11 H new ATOM 0 HG2 GLU A 135 -11.045 3.662 -20.608 1.00 0.32 H new ATOM 0 HG3 GLU A 135 -9.613 2.805 -21.142 1.00 0.32 H new ATOM 2187 N LEU A 136 -11.077 1.889 -16.037 1.00 13.53 N ATOM 2188 CA LEU A 136 -11.630 1.372 -14.818 1.00 4.44 C ATOM 2189 C LEU A 136 -11.178 -0.072 -14.586 1.00 53.25 C ATOM 2190 O LEU A 136 -11.936 -0.915 -14.093 1.00 2.14 O ATOM 2191 CB LEU A 136 -13.142 1.639 -14.756 1.00 55.32 C ATOM 2192 CG LEU A 136 -13.468 3.115 -14.602 1.00 20.02 C ATOM 2193 CD1 LEU A 136 -13.226 4.025 -15.789 1.00 4.21 C ATOM 2194 CD2 LEU A 136 -14.852 3.300 -13.985 1.00 2.35 C ATOM 0 H LEU A 136 -10.419 2.653 -15.880 1.00 13.53 H new ATOM 0 HA LEU A 136 -11.233 1.908 -13.956 1.00 4.44 H new ATOM 0 HB2 LEU A 136 -13.612 1.260 -15.663 1.00 55.32 H new ATOM 0 HB3 LEU A 136 -13.571 1.087 -13.920 1.00 55.32 H new ATOM 0 HG LEU A 136 -12.704 3.473 -13.912 1.00 20.02 H new ATOM 0 HD11 LEU A 136 -13.505 5.046 -15.528 1.00 4.21 H new ATOM 0 HD12 LEU A 136 -12.171 3.995 -16.061 1.00 4.21 H new ATOM 0 HD13 LEU A 136 -13.828 3.689 -16.633 1.00 4.21 H new ATOM 0 HD21 LEU A 136 -15.066 4.364 -13.883 1.00 2.35 H new ATOM 0 HD22 LEU A 136 -15.602 2.839 -14.628 1.00 2.35 H new ATOM 0 HD23 LEU A 136 -14.878 2.829 -13.002 1.00 2.35 H new ATOM 2206 N ASP A 137 -9.941 -0.327 -14.991 1.00 4.14 N ATOM 2207 CA ASP A 137 -9.234 -1.596 -15.039 1.00 33.01 C ATOM 2208 C ASP A 137 -8.283 -1.708 -13.851 1.00 3.31 C ATOM 2209 O ASP A 137 -8.435 -0.962 -12.887 1.00 53.14 O ATOM 2210 CB ASP A 137 -8.492 -1.656 -16.377 1.00 21.10 C ATOM 2211 CG ASP A 137 -8.203 -3.092 -16.836 1.00 2.30 C ATOM 2212 OD1 ASP A 137 -8.576 -4.068 -16.143 1.00 50.54 O ATOM 2213 OD2 ASP A 137 -7.594 -3.251 -17.914 1.00 61.32 O ATOM 0 H ASP A 137 -9.348 0.431 -15.329 1.00 4.14 H new ATOM 0 HA ASP A 137 -9.922 -2.438 -14.970 1.00 33.01 H new ATOM 0 HB2 ASP A 137 -9.085 -1.149 -17.138 1.00 21.10 H new ATOM 0 HB3 ASP A 137 -7.552 -1.112 -16.290 1.00 21.10 H new ATOM 2218 N PHE A 138 -7.335 -2.641 -13.881 1.00 42.33 N ATOM 2219 CA PHE A 138 -6.397 -2.882 -12.795 1.00 22.20 C ATOM 2220 C PHE A 138 -4.962 -2.538 -13.210 1.00 2.51 C ATOM 2221 O PHE A 138 -4.217 -3.389 -13.707 1.00 54.11 O ATOM 2222 CB PHE A 138 -6.523 -4.333 -12.322 1.00 33.33 C ATOM 2223 CG PHE A 138 -7.944 -4.821 -12.100 1.00 3.24 C ATOM 2224 CD1 PHE A 138 -8.722 -4.305 -11.046 1.00 41.44 C ATOM 2225 CD2 PHE A 138 -8.495 -5.786 -12.965 1.00 23.12 C ATOM 2226 CE1 PHE A 138 -10.035 -4.767 -10.853 1.00 72.25 C ATOM 2227 CE2 PHE A 138 -9.800 -6.258 -12.758 1.00 33.00 C ATOM 2228 CZ PHE A 138 -10.571 -5.753 -11.701 1.00 4.34 C ATOM 0 H PHE A 138 -7.197 -3.262 -14.678 1.00 42.33 H new ATOM 0 HA PHE A 138 -6.643 -2.225 -11.961 1.00 22.20 H new ATOM 0 HB2 PHE A 138 -6.044 -4.980 -13.057 1.00 33.33 H new ATOM 0 HB3 PHE A 138 -5.968 -4.444 -11.390 1.00 33.33 H new ATOM 0 HD1 PHE A 138 -8.310 -3.555 -10.387 1.00 41.44 H new ATOM 0 HD2 PHE A 138 -7.911 -6.164 -13.791 1.00 23.12 H new ATOM 0 HE1 PHE A 138 -10.635 -4.364 -10.051 1.00 72.25 H new ATOM 0 HE2 PHE A 138 -10.211 -7.011 -13.414 1.00 33.00 H new ATOM 0 HZ PHE A 138 -11.574 -6.120 -11.539 1.00 4.34 H new ATOM 2238 N GLU A 139 -4.553 -1.291 -12.970 1.00 64.44 N ATOM 2239 CA GLU A 139 -3.141 -0.908 -12.962 1.00 25.21 C ATOM 2240 C GLU A 139 -2.456 -1.698 -11.846 1.00 3.21 C ATOM 2241 O GLU A 139 -3.049 -1.872 -10.782 1.00 24.12 O ATOM 2242 CB GLU A 139 -3.017 0.604 -12.715 1.00 42.42 C ATOM 2243 CG GLU A 139 -1.568 1.113 -12.649 1.00 72.02 C ATOM 2244 CD GLU A 139 -0.794 0.909 -13.950 1.00 54.42 C ATOM 2245 OE1 GLU A 139 -0.189 -0.178 -14.105 1.00 43.34 O ATOM 2246 OE2 GLU A 139 -0.732 1.850 -14.770 1.00 41.41 O ATOM 0 H GLU A 139 -5.191 -0.519 -12.776 1.00 64.44 H new ATOM 0 HA GLU A 139 -2.669 -1.130 -13.919 1.00 25.21 H new ATOM 0 HB2 GLU A 139 -3.541 1.135 -13.509 1.00 42.42 H new ATOM 0 HB3 GLU A 139 -3.520 0.851 -11.780 1.00 42.42 H new ATOM 0 HG2 GLU A 139 -1.574 2.174 -12.401 1.00 72.02 H new ATOM 0 HG3 GLU A 139 -1.047 0.600 -11.841 1.00 72.02 H new ATOM 2253 N LEU A 140 -1.221 -2.157 -12.058 1.00 32.14 N ATOM 2254 CA LEU A 140 -0.489 -3.016 -11.130 1.00 53.42 C ATOM 2255 C LEU A 140 0.997 -2.633 -11.172 1.00 54.21 C ATOM 2256 O LEU A 140 1.509 -2.250 -12.228 1.00 42.31 O ATOM 2257 CB LEU A 140 -0.676 -4.471 -11.577 1.00 61.13 C ATOM 2258 CG LEU A 140 -0.158 -5.476 -10.528 1.00 4.20 C ATOM 2259 CD1 LEU A 140 -1.313 -6.091 -9.735 1.00 31.21 C ATOM 2260 CD2 LEU A 140 0.702 -6.542 -11.201 1.00 45.11 C ATOM 0 H LEU A 140 -0.691 -1.935 -12.901 1.00 32.14 H new ATOM 0 HA LEU A 140 -0.858 -2.897 -10.111 1.00 53.42 H new ATOM 0 HB2 LEU A 140 -1.733 -4.658 -11.765 1.00 61.13 H new ATOM 0 HB3 LEU A 140 -0.151 -4.630 -12.519 1.00 61.13 H new ATOM 0 HG LEU A 140 0.468 -4.943 -9.812 1.00 4.20 H new ATOM 0 HD11 LEU A 140 -0.917 -6.795 -9.003 1.00 31.21 H new ATOM 0 HD12 LEU A 140 -1.861 -5.302 -9.220 1.00 31.21 H new ATOM 0 HD13 LEU A 140 -1.984 -6.614 -10.416 1.00 31.21 H new ATOM 0 HD21 LEU A 140 1.062 -7.246 -10.451 1.00 45.11 H new ATOM 0 HD22 LEU A 140 0.107 -7.075 -11.943 1.00 45.11 H new ATOM 0 HD23 LEU A 140 1.552 -6.068 -11.691 1.00 45.11 H new ATOM 2272 N TYR A 141 1.732 -2.758 -10.068 1.00 25.12 N ATOM 2273 CA TYR A 141 3.194 -2.600 -10.040 1.00 54.53 C ATOM 2274 C TYR A 141 3.743 -3.482 -8.937 1.00 70.12 C ATOM 2275 O TYR A 141 3.160 -3.513 -7.852 1.00 2.50 O ATOM 2276 CB TYR A 141 3.559 -1.132 -9.803 1.00 25.02 C ATOM 2277 CG TYR A 141 5.026 -0.779 -9.885 1.00 4.20 C ATOM 2278 CD1 TYR A 141 5.706 -0.881 -11.115 1.00 33.40 C ATOM 2279 CD2 TYR A 141 5.684 -0.248 -8.759 1.00 32.30 C ATOM 2280 CE1 TYR A 141 7.038 -0.448 -11.226 1.00 24.21 C ATOM 2281 CE2 TYR A 141 7.019 0.175 -8.866 1.00 74.23 C ATOM 2282 CZ TYR A 141 7.701 0.086 -10.099 1.00 4.14 C ATOM 2283 OH TYR A 141 8.987 0.518 -10.179 1.00 72.34 O ATOM 0 H TYR A 141 1.330 -2.974 -9.156 1.00 25.12 H new ATOM 0 HA TYR A 141 3.629 -2.897 -10.994 1.00 54.53 H new ATOM 0 HB2 TYR A 141 3.021 -0.525 -10.531 1.00 25.02 H new ATOM 0 HB3 TYR A 141 3.194 -0.845 -8.817 1.00 25.02 H new ATOM 0 HD1 TYR A 141 5.201 -1.294 -11.976 1.00 33.40 H new ATOM 0 HD2 TYR A 141 5.164 -0.166 -7.816 1.00 32.30 H new ATOM 0 HE1 TYR A 141 7.554 -0.523 -12.172 1.00 24.21 H new ATOM 0 HE2 TYR A 141 7.527 0.571 -7.999 1.00 74.23 H new ATOM 0 HH TYR A 141 9.274 0.854 -9.304 1.00 72.34 H new ATOM 2293 N VAL A 142 4.823 -4.201 -9.229 1.00 70.02 N ATOM 2294 CA VAL A 142 5.494 -5.139 -8.339 1.00 51.45 C ATOM 2295 C VAL A 142 6.959 -5.241 -8.773 1.00 24.21 C ATOM 2296 O VAL A 142 7.344 -6.193 -9.451 1.00 41.22 O ATOM 2297 CB VAL A 142 4.809 -6.520 -8.349 1.00 73.04 C ATOM 2298 CG1 VAL A 142 3.707 -6.570 -7.290 1.00 25.30 C ATOM 2299 CG2 VAL A 142 4.266 -6.938 -9.732 1.00 4.20 C ATOM 0 H VAL A 142 5.276 -4.141 -10.141 1.00 70.02 H new ATOM 0 HA VAL A 142 5.435 -4.776 -7.313 1.00 51.45 H new ATOM 0 HB VAL A 142 5.582 -7.249 -8.106 1.00 73.04 H new ATOM 0 HG11 VAL A 142 3.231 -7.550 -7.307 1.00 25.30 H new ATOM 0 HG12 VAL A 142 4.140 -6.394 -6.305 1.00 25.30 H new ATOM 0 HG13 VAL A 142 2.964 -5.802 -7.502 1.00 25.30 H new ATOM 0 HG21 VAL A 142 3.799 -7.920 -9.658 1.00 4.20 H new ATOM 0 HG22 VAL A 142 3.528 -6.210 -10.069 1.00 4.20 H new ATOM 0 HG23 VAL A 142 5.087 -6.980 -10.448 1.00 4.20 H new ATOM 2309 N PRO A 143 7.802 -4.263 -8.417 1.00 4.41 N ATOM 2310 CA PRO A 143 9.150 -4.179 -8.949 1.00 51.24 C ATOM 2311 C PRO A 143 10.096 -5.257 -8.427 1.00 45.31 C ATOM 2312 O PRO A 143 11.243 -5.297 -8.879 1.00 21.20 O ATOM 2313 CB PRO A 143 9.631 -2.761 -8.626 1.00 42.51 C ATOM 2314 CG PRO A 143 8.824 -2.401 -7.379 1.00 32.31 C ATOM 2315 CD PRO A 143 7.485 -3.095 -7.623 1.00 34.10 C ATOM 0 HA PRO A 143 9.144 -4.368 -10.023 1.00 51.24 H new ATOM 0 HB2 PRO A 143 10.704 -2.732 -8.435 1.00 42.51 H new ATOM 0 HB3 PRO A 143 9.435 -2.071 -9.447 1.00 42.51 H new ATOM 0 HG2 PRO A 143 9.305 -2.761 -6.469 1.00 32.31 H new ATOM 0 HG3 PRO A 143 8.706 -1.323 -7.272 1.00 32.31 H new ATOM 0 HD2 PRO A 143 7.010 -3.375 -6.683 1.00 34.10 H new ATOM 0 HD3 PRO A 143 6.791 -2.438 -8.148 1.00 34.10 H new ATOM 2323 N TYR A 144 9.641 -6.119 -7.516 1.00 41.22 N ATOM 2324 CA TYR A 144 10.389 -7.271 -7.044 1.00 10.13 C ATOM 2325 C TYR A 144 9.616 -8.573 -7.294 1.00 4.21 C ATOM 2326 O TYR A 144 10.238 -9.629 -7.438 1.00 65.04 O ATOM 2327 CB TYR A 144 10.737 -7.051 -5.564 1.00 1.30 C ATOM 2328 CG TYR A 144 11.449 -5.733 -5.270 1.00 50.45 C ATOM 2329 CD1 TYR A 144 12.612 -5.385 -5.985 1.00 22.30 C ATOM 2330 CD2 TYR A 144 10.937 -4.835 -4.311 1.00 25.21 C ATOM 2331 CE1 TYR A 144 13.292 -4.188 -5.708 1.00 53.15 C ATOM 2332 CE2 TYR A 144 11.599 -3.619 -4.046 1.00 24.34 C ATOM 2333 CZ TYR A 144 12.797 -3.303 -4.728 1.00 51.21 C ATOM 2334 OH TYR A 144 13.487 -2.158 -4.461 1.00 4.42 O ATOM 0 H TYR A 144 8.723 -6.028 -7.081 1.00 41.22 H new ATOM 0 HA TYR A 144 11.319 -7.374 -7.602 1.00 10.13 H new ATOM 0 HB2 TYR A 144 9.819 -7.092 -4.978 1.00 1.30 H new ATOM 0 HB3 TYR A 144 11.368 -7.873 -5.226 1.00 1.30 H new ATOM 0 HD1 TYR A 144 12.984 -6.046 -6.754 1.00 22.30 H new ATOM 0 HD2 TYR A 144 10.032 -5.080 -3.776 1.00 25.21 H new ATOM 0 HE1 TYR A 144 14.196 -3.945 -6.247 1.00 53.15 H new ATOM 0 HE2 TYR A 144 11.191 -2.929 -3.322 1.00 24.34 H new ATOM 0 HH TYR A 144 13.021 -1.650 -3.764 1.00 4.42 H new ATOM 2344 N GLY A 145 8.289 -8.517 -7.444 1.00 24.00 N ATOM 2345 CA GLY A 145 7.437 -9.672 -7.706 1.00 22.22 C ATOM 2346 C GLY A 145 6.194 -9.728 -6.820 1.00 1.31 C ATOM 2347 O GLY A 145 5.962 -8.836 -5.997 1.00 30.40 O ATOM 0 H GLY A 145 7.768 -7.642 -7.384 1.00 24.00 H new ATOM 0 HA2 GLY A 145 7.128 -9.655 -8.751 1.00 22.22 H new ATOM 0 HA3 GLY A 145 8.018 -10.582 -7.560 1.00 22.22 H new ATOM 2351 N LEU A 146 5.378 -10.765 -7.046 1.00 13.12 N ATOM 2352 CA LEU A 146 4.107 -11.024 -6.363 1.00 45.25 C ATOM 2353 C LEU A 146 4.161 -12.249 -5.463 1.00 34.30 C ATOM 2354 O LEU A 146 3.419 -12.291 -4.482 1.00 34.31 O ATOM 2355 CB LEU A 146 2.972 -11.251 -7.381 1.00 10.22 C ATOM 2356 CG LEU A 146 2.368 -9.947 -7.911 1.00 10.12 C ATOM 2357 CD1 LEU A 146 1.472 -10.209 -9.122 1.00 10.20 C ATOM 2358 CD2 LEU A 146 1.555 -9.205 -6.837 1.00 10.10 C ATOM 0 H LEU A 146 5.597 -11.478 -7.742 1.00 13.12 H new ATOM 0 HA LEU A 146 3.918 -10.140 -5.754 1.00 45.25 H new ATOM 0 HB2 LEU A 146 3.355 -11.833 -8.219 1.00 10.22 H new ATOM 0 HB3 LEU A 146 2.186 -11.844 -6.913 1.00 10.22 H new ATOM 0 HG LEU A 146 3.208 -9.317 -8.205 1.00 10.12 H new ATOM 0 HD11 LEU A 146 1.056 -9.266 -9.478 1.00 10.20 H new ATOM 0 HD12 LEU A 146 2.059 -10.669 -9.916 1.00 10.20 H new ATOM 0 HD13 LEU A 146 0.661 -10.878 -8.836 1.00 10.20 H new ATOM 0 HD21 LEU A 146 1.147 -8.287 -7.259 1.00 10.10 H new ATOM 0 HD22 LEU A 146 0.739 -9.841 -6.494 1.00 10.10 H new ATOM 0 HD23 LEU A 146 2.202 -8.960 -5.995 1.00 10.10 H new ATOM 2370 N GLU A 147 5.000 -13.240 -5.776 1.00 12.44 N ATOM 2371 CA GLU A 147 5.125 -14.474 -5.007 1.00 23.32 C ATOM 2372 C GLU A 147 5.423 -14.163 -3.543 1.00 62.05 C ATOM 2373 O GLU A 147 4.901 -14.847 -2.670 1.00 24.01 O ATOM 2374 CB GLU A 147 6.210 -15.379 -5.618 1.00 24.34 C ATOM 2375 CG GLU A 147 5.654 -16.648 -6.286 1.00 1.11 C ATOM 2376 CD GLU A 147 5.952 -17.922 -5.476 1.00 45.25 C ATOM 2377 OE1 GLU A 147 7.123 -18.176 -5.113 1.00 1.41 O ATOM 2378 OE2 GLU A 147 5.005 -18.642 -5.075 1.00 4.14 O ATOM 0 H GLU A 147 5.620 -13.204 -6.585 1.00 12.44 H new ATOM 0 HA GLU A 147 4.177 -15.011 -5.048 1.00 23.32 H new ATOM 0 HB2 GLU A 147 6.773 -14.808 -6.356 1.00 24.34 H new ATOM 0 HB3 GLU A 147 6.912 -15.669 -4.836 1.00 24.34 H new ATOM 0 HG2 GLU A 147 4.576 -16.546 -6.412 1.00 1.11 H new ATOM 0 HG3 GLU A 147 6.083 -16.747 -7.283 1.00 1.11 H new ATOM 2385 N ASP A 148 6.167 -13.094 -3.263 1.00 25.13 N ATOM 2386 CA ASP A 148 6.439 -12.612 -1.912 1.00 5.22 C ATOM 2387 C ASP A 148 5.143 -12.479 -1.121 1.00 4.20 C ATOM 2388 O ASP A 148 5.072 -12.904 0.032 1.00 31.20 O ATOM 2389 CB ASP A 148 7.139 -11.245 -1.944 1.00 74.22 C ATOM 2390 CG ASP A 148 8.611 -11.365 -2.297 1.00 65.11 C ATOM 2391 OD1 ASP A 148 8.917 -11.632 -3.482 1.00 50.24 O ATOM 2392 OD2 ASP A 148 9.461 -11.185 -1.394 1.00 22.31 O ATOM 0 H ASP A 148 6.607 -12.526 -3.987 1.00 25.13 H new ATOM 0 HA ASP A 148 7.093 -13.340 -1.431 1.00 5.22 H new ATOM 0 HB2 ASP A 148 6.644 -10.602 -2.671 1.00 74.22 H new ATOM 0 HB3 ASP A 148 7.038 -10.764 -0.971 1.00 74.22 H new ATOM 2397 N ILE A 149 4.104 -11.914 -1.740 1.00 14.51 N ATOM 2398 CA ILE A 149 2.839 -11.646 -1.089 1.00 71.04 C ATOM 2399 C ILE A 149 2.138 -12.980 -0.862 1.00 53.52 C ATOM 2400 O ILE A 149 1.744 -13.253 0.270 1.00 43.25 O ATOM 2401 CB ILE A 149 1.995 -10.642 -1.905 1.00 21.10 C ATOM 2402 CG1 ILE A 149 2.797 -9.352 -2.203 1.00 23.01 C ATOM 2403 CG2 ILE A 149 0.725 -10.318 -1.109 1.00 13.13 C ATOM 2404 CD1 ILE A 149 1.987 -8.279 -2.937 1.00 22.34 C ATOM 0 H ILE A 149 4.127 -11.630 -2.719 1.00 14.51 H new ATOM 0 HA ILE A 149 2.994 -11.167 -0.122 1.00 71.04 H new ATOM 0 HB ILE A 149 1.730 -11.085 -2.865 1.00 21.10 H new ATOM 0 HG12 ILE A 149 3.165 -8.938 -1.264 1.00 23.01 H new ATOM 0 HG13 ILE A 149 3.671 -9.608 -2.802 1.00 23.01 H new ATOM 0 HG21 ILE A 149 0.115 -9.610 -1.670 1.00 13.13 H new ATOM 0 HG22 ILE A 149 0.157 -11.233 -0.942 1.00 13.13 H new ATOM 0 HG23 ILE A 149 0.999 -9.881 -0.149 1.00 13.13 H new ATOM 0 HD11 ILE A 149 2.615 -7.405 -3.111 1.00 22.34 H new ATOM 0 HD12 ILE A 149 1.642 -8.674 -3.892 1.00 22.34 H new ATOM 0 HD13 ILE A 149 1.128 -7.993 -2.330 1.00 22.34 H new ATOM 2416 N LEU A 150 2.002 -13.812 -1.902 1.00 34.24 N ATOM 2417 CA LEU A 150 1.330 -15.111 -1.775 1.00 13.32 C ATOM 2418 C LEU A 150 1.996 -16.004 -0.726 1.00 50.35 C ATOM 2419 O LEU A 150 1.321 -16.827 -0.112 1.00 12.32 O ATOM 2420 CB LEU A 150 1.288 -15.887 -3.107 1.00 3.43 C ATOM 2421 CG LEU A 150 0.384 -15.363 -4.239 1.00 70.22 C ATOM 2422 CD1 LEU A 150 -0.847 -14.592 -3.756 1.00 3.50 C ATOM 2423 CD2 LEU A 150 1.119 -14.490 -5.252 1.00 1.23 C ATOM 0 H LEU A 150 2.348 -13.609 -2.840 1.00 34.24 H new ATOM 0 HA LEU A 150 0.313 -14.874 -1.464 1.00 13.32 H new ATOM 0 HB2 LEU A 150 2.306 -15.937 -3.493 1.00 3.43 H new ATOM 0 HB3 LEU A 150 0.981 -16.909 -2.885 1.00 3.43 H new ATOM 0 HG LEU A 150 0.054 -16.283 -4.722 1.00 70.22 H new ATOM 0 HD11 LEU A 150 -1.428 -14.259 -4.616 1.00 3.50 H new ATOM 0 HD12 LEU A 150 -1.461 -15.241 -3.132 1.00 3.50 H new ATOM 0 HD13 LEU A 150 -0.529 -13.726 -3.175 1.00 3.50 H new ATOM 0 HD21 LEU A 150 0.421 -14.157 -6.020 1.00 1.23 H new ATOM 0 HD22 LEU A 150 1.542 -13.623 -4.745 1.00 1.23 H new ATOM 0 HD23 LEU A 150 1.920 -15.066 -5.715 1.00 1.23 H new ATOM 2435 N ASN A 151 3.307 -15.865 -0.530 1.00 21.21 N ATOM 2436 CA ASN A 151 4.086 -16.650 0.417 1.00 33.32 C ATOM 2437 C ASN A 151 4.253 -15.931 1.753 1.00 21.23 C ATOM 2438 O ASN A 151 4.941 -16.467 2.623 1.00 63.22 O ATOM 2439 CB ASN A 151 5.450 -16.992 -0.188 1.00 51.11 C ATOM 2440 CG ASN A 151 5.315 -18.005 -1.304 1.00 11.50 C ATOM 2441 OD1 ASN A 151 5.060 -19.181 -1.072 1.00 14.54 O ATOM 2442 ND2 ASN A 151 5.411 -17.539 -2.531 1.00 65.44 N ATOM 0 H ASN A 151 3.868 -15.184 -1.041 1.00 21.21 H new ATOM 0 HA ASN A 151 3.540 -17.572 0.617 1.00 33.32 H new ATOM 0 HB2 ASN A 151 5.919 -16.085 -0.571 1.00 51.11 H new ATOM 0 HB3 ASN A 151 6.106 -17.387 0.588 1.00 51.11 H new ATOM 0 HD21 ASN A 151 5.272 -18.163 -3.326 1.00 65.44 H new ATOM 0 HD22 ASN A 151 5.625 -16.554 -2.687 1.00 65.44 H new ATOM 2449 N PHE A 152 3.622 -14.765 1.942 1.00 2.50 N ATOM 2450 CA PHE A 152 3.566 -14.005 3.182 1.00 25.10 C ATOM 2451 C PHE A 152 4.955 -13.582 3.673 1.00 5.14 C ATOM 2452 O PHE A 152 5.260 -13.640 4.861 1.00 33.13 O ATOM 2453 CB PHE A 152 2.743 -14.796 4.204 1.00 70.15 C ATOM 2454 CG PHE A 152 1.296 -14.988 3.807 1.00 54.13 C ATOM 2455 CD1 PHE A 152 0.390 -13.977 4.150 1.00 5.43 C ATOM 2456 CD2 PHE A 152 0.841 -16.125 3.105 1.00 63.24 C ATOM 2457 CE1 PHE A 152 -0.970 -14.121 3.846 1.00 32.34 C ATOM 2458 CE2 PHE A 152 -0.529 -16.263 2.803 1.00 13.30 C ATOM 2459 CZ PHE A 152 -1.428 -15.259 3.197 1.00 5.03 C ATOM 0 H PHE A 152 3.111 -14.307 1.187 1.00 2.50 H new ATOM 0 HA PHE A 152 3.058 -13.055 3.013 1.00 25.10 H new ATOM 0 HB2 PHE A 152 3.203 -15.774 4.348 1.00 70.15 H new ATOM 0 HB3 PHE A 152 2.781 -14.281 5.164 1.00 70.15 H new ATOM 0 HD1 PHE A 152 0.740 -13.086 4.649 1.00 5.43 H new ATOM 0 HD2 PHE A 152 1.542 -16.888 2.800 1.00 63.24 H new ATOM 0 HE1 PHE A 152 -1.666 -13.342 4.118 1.00 32.34 H new ATOM 0 HE2 PHE A 152 -0.884 -17.134 2.273 1.00 13.30 H new ATOM 0 HZ PHE A 152 -2.483 -15.373 2.994 1.00 5.03 H new ATOM 2469 N GLN A 153 5.822 -13.161 2.759 1.00 72.21 N ATOM 2470 CA GLN A 153 7.235 -12.956 3.007 1.00 45.15 C ATOM 2471 C GLN A 153 7.544 -11.495 3.357 1.00 45.14 C ATOM 2472 O GLN A 153 7.688 -10.639 2.481 1.00 74.23 O ATOM 2473 CB GLN A 153 7.981 -13.331 1.722 1.00 24.13 C ATOM 2474 CG GLN A 153 7.929 -14.826 1.405 1.00 23.14 C ATOM 2475 CD GLN A 153 9.332 -15.391 1.183 1.00 53.41 C ATOM 2476 OE1 GLN A 153 9.676 -16.463 1.862 1.00 70.24 O flip ATOM 2477 NE2 GLN A 153 10.173 -14.796 0.523 1.00 3.31 N flip ATOM 0 H GLN A 153 5.549 -12.948 1.800 1.00 72.21 H new ATOM 0 HA GLN A 153 7.545 -13.569 3.853 1.00 45.15 H new ATOM 0 HB2 GLN A 153 7.554 -12.775 0.887 1.00 24.13 H new ATOM 0 HB3 GLN A 153 9.022 -13.022 1.812 1.00 24.13 H new ATOM 0 HG2 GLN A 153 7.445 -15.358 2.224 1.00 23.14 H new ATOM 0 HG3 GLN A 153 7.322 -14.991 0.515 1.00 23.14 H new ATOM 0 HE21 GLN A 153 9.911 -13.964 -0.006 1.00 3.31 H new ATOM 0 HE22 GLN A 153 11.136 -15.132 0.501 1.00 3.31 H new ATOM 2486 N VAL A 154 7.717 -11.195 4.638 1.00 63.45 N ATOM 2487 CA VAL A 154 8.203 -9.897 5.095 1.00 42.42 C ATOM 2488 C VAL A 154 9.725 -9.889 4.946 1.00 42.35 C ATOM 2489 O VAL A 154 10.449 -10.392 5.810 1.00 62.43 O ATOM 2490 CB VAL A 154 7.687 -9.625 6.518 1.00 11.41 C ATOM 2491 CG1 VAL A 154 8.262 -8.345 7.117 1.00 2.02 C ATOM 2492 CG2 VAL A 154 6.159 -9.539 6.467 1.00 52.33 C ATOM 0 H VAL A 154 7.523 -11.850 5.396 1.00 63.45 H new ATOM 0 HA VAL A 154 7.822 -9.071 4.494 1.00 42.42 H new ATOM 0 HB VAL A 154 8.012 -10.442 7.162 1.00 11.41 H new ATOM 0 HG11 VAL A 154 7.864 -8.203 8.122 1.00 2.02 H new ATOM 0 HG12 VAL A 154 9.348 -8.422 7.165 1.00 2.02 H new ATOM 0 HG13 VAL A 154 7.985 -7.495 6.493 1.00 2.02 H new ATOM 0 HG21 VAL A 154 5.772 -9.346 7.468 1.00 52.33 H new ATOM 0 HG22 VAL A 154 5.862 -8.729 5.801 1.00 52.33 H new ATOM 0 HG23 VAL A 154 5.754 -10.481 6.096 1.00 52.33 H new ATOM 2502 N ARG A 155 10.209 -9.426 3.792 1.00 33.42 N ATOM 2503 CA ARG A 155 11.630 -9.307 3.464 1.00 1.34 C ATOM 2504 C ARG A 155 11.903 -7.815 3.284 1.00 33.14 C ATOM 2505 O ARG A 155 11.056 -7.163 2.670 1.00 50.22 O ATOM 2506 CB ARG A 155 11.923 -10.028 2.124 1.00 42.24 C ATOM 2507 CG ARG A 155 11.327 -11.415 1.938 1.00 72.12 C ATOM 2508 CD ARG A 155 12.028 -12.446 2.807 1.00 12.20 C ATOM 2509 NE ARG A 155 11.192 -13.598 3.045 1.00 74.23 N ATOM 2510 CZ ARG A 155 10.479 -13.901 4.126 1.00 65.44 C ATOM 2511 NH1 ARG A 155 10.142 -12.996 5.034 1.00 42.45 N ATOM 2512 NH2 ARG A 155 10.102 -15.145 4.313 1.00 33.22 N ATOM 0 H ARG A 155 9.601 -9.113 3.035 1.00 33.42 H new ATOM 0 HA ARG A 155 12.250 -9.749 4.244 1.00 1.34 H new ATOM 0 HB2 ARG A 155 11.564 -9.394 1.313 1.00 42.24 H new ATOM 0 HB3 ARG A 155 13.004 -10.107 2.012 1.00 42.24 H new ATOM 0 HG2 ARG A 155 10.266 -11.392 2.185 1.00 72.12 H new ATOM 0 HG3 ARG A 155 11.405 -11.708 0.891 1.00 72.12 H new ATOM 0 HD2 ARG A 155 12.953 -12.761 2.324 1.00 12.20 H new ATOM 0 HD3 ARG A 155 12.304 -11.993 3.759 1.00 12.20 H new ATOM 0 HE ARG A 155 11.141 -14.271 2.280 1.00 74.23 H new ATOM 0 HH11 ARG A 155 10.431 -12.025 4.918 1.00 42.45 H new ATOM 0 HH12 ARG A 155 9.594 -13.271 5.849 1.00 42.45 H new ATOM 0 HH21 ARG A 155 10.356 -15.863 3.634 1.00 33.22 H new ATOM 0 HH22 ARG A 155 9.555 -15.394 5.137 1.00 33.22 H new ATOM 2526 N PRO A 156 13.058 -7.261 3.678 1.00 72.44 N ATOM 2527 CA PRO A 156 13.428 -5.898 3.307 1.00 14.34 C ATOM 2528 C PRO A 156 13.754 -5.838 1.809 1.00 12.30 C ATOM 2529 O PRO A 156 14.236 -6.811 1.223 1.00 62.34 O ATOM 2530 CB PRO A 156 14.620 -5.531 4.192 1.00 51.25 C ATOM 2531 CG PRO A 156 15.204 -6.875 4.623 1.00 74.33 C ATOM 2532 CD PRO A 156 14.056 -7.871 4.536 1.00 14.24 C ATOM 0 HA PRO A 156 12.621 -5.183 3.464 1.00 14.34 H new ATOM 0 HB2 PRO A 156 15.352 -4.937 3.645 1.00 51.25 H new ATOM 0 HB3 PRO A 156 14.308 -4.939 5.053 1.00 51.25 H new ATOM 0 HG2 PRO A 156 16.028 -7.170 3.973 1.00 74.33 H new ATOM 0 HG3 PRO A 156 15.600 -6.822 5.637 1.00 74.33 H new ATOM 0 HD2 PRO A 156 14.395 -8.822 4.124 1.00 14.24 H new ATOM 0 HD3 PRO A 156 13.645 -8.080 5.524 1.00 14.24 H new ATOM 2540 N THR A 157 13.478 -4.702 1.166 1.00 65.04 N ATOM 2541 CA THR A 157 13.905 -4.422 -0.198 1.00 11.33 C ATOM 2542 C THR A 157 15.437 -4.454 -0.291 1.00 4.30 C ATOM 2543 O THR A 157 16.124 -4.165 0.695 1.00 73.33 O ATOM 2544 CB THR A 157 13.358 -3.054 -0.669 1.00 41.51 C ATOM 2545 OG1 THR A 157 13.920 -1.975 0.040 1.00 33.13 O ATOM 2546 CG2 THR A 157 11.828 -2.978 -0.598 1.00 23.32 C ATOM 0 H THR A 157 12.944 -3.942 1.588 1.00 65.04 H new ATOM 0 HA THR A 157 13.502 -5.193 -0.854 1.00 11.33 H new ATOM 0 HB THR A 157 13.658 -2.970 -1.714 1.00 41.51 H new ATOM 0 HG1 THR A 157 13.545 -1.133 -0.294 1.00 33.13 H new ATOM 0 HG21 THR A 157 11.496 -1.997 -0.939 1.00 23.32 H new ATOM 0 HG22 THR A 157 11.395 -3.750 -1.235 1.00 23.32 H new ATOM 0 HG23 THR A 157 11.503 -3.133 0.431 1.00 23.32 H new ATOM 2554 N PRO A 158 15.993 -4.663 -1.496 1.00 5.50 N ATOM 2555 CA PRO A 158 17.417 -4.476 -1.735 1.00 34.44 C ATOM 2556 C PRO A 158 17.838 -3.038 -1.423 1.00 10.23 C ATOM 2557 O PRO A 158 18.957 -2.814 -0.976 1.00 41.21 O ATOM 2558 CB PRO A 158 17.622 -4.829 -3.212 1.00 51.14 C ATOM 2559 CG PRO A 158 16.262 -4.567 -3.849 1.00 1.22 C ATOM 2560 CD PRO A 158 15.316 -5.008 -2.735 1.00 11.33 C ATOM 0 HA PRO A 158 18.032 -5.104 -1.091 1.00 34.44 H new ATOM 0 HB2 PRO A 158 18.399 -4.214 -3.665 1.00 51.14 H new ATOM 0 HB3 PRO A 158 17.926 -5.868 -3.335 1.00 51.14 H new ATOM 0 HG2 PRO A 158 16.127 -3.518 -4.111 1.00 1.22 H new ATOM 0 HG3 PRO A 158 16.118 -5.145 -4.762 1.00 1.22 H new ATOM 0 HD2 PRO A 158 14.354 -4.500 -2.812 1.00 11.33 H new ATOM 0 HD3 PRO A 158 15.117 -6.078 -2.789 1.00 11.33 H new ATOM 2568 N HIS A 159 16.928 -2.070 -1.581 1.00 11.51 N ATOM 2569 CA HIS A 159 17.192 -0.652 -1.430 1.00 52.24 C ATOM 2570 C HIS A 159 17.379 -0.240 0.038 1.00 52.52 C ATOM 2571 O HIS A 159 17.561 0.953 0.292 1.00 71.11 O ATOM 2572 CB HIS A 159 16.028 0.115 -2.089 1.00 10.41 C ATOM 2573 CG HIS A 159 16.472 1.310 -2.890 1.00 62.23 C ATOM 2574 ND1 HIS A 159 17.314 2.308 -2.461 1.00 21.13 N ATOM 2575 CD2 HIS A 159 16.134 1.574 -4.189 1.00 11.23 C ATOM 2576 CE1 HIS A 159 17.476 3.166 -3.486 1.00 65.31 C ATOM 2577 NE2 HIS A 159 16.751 2.775 -4.554 1.00 13.20 N ATOM 0 H HIS A 159 15.958 -2.269 -1.826 1.00 11.51 H new ATOM 0 HA HIS A 159 18.134 -0.407 -1.920 1.00 52.24 H new ATOM 0 HB2 HIS A 159 15.478 -0.565 -2.740 1.00 10.41 H new ATOM 0 HB3 HIS A 159 15.336 0.444 -1.314 1.00 10.41 H new ATOM 0 HD1 HIS A 159 17.738 2.385 -1.536 1.00 21.13 H new ATOM 0 HD2 HIS A 159 15.504 0.964 -4.820 1.00 11.23 H new ATOM 0 HE1 HIS A 159 18.101 4.046 -3.457 1.00 65.31 H new ATOM 2585 N PHE A 160 17.280 -1.184 0.984 1.00 65.45 N ATOM 2586 CA PHE A 160 17.384 -0.960 2.419 1.00 70.05 C ATOM 2587 C PHE A 160 18.667 -1.537 3.001 1.00 73.42 C ATOM 2588 O PHE A 160 19.286 -0.863 3.815 1.00 63.04 O ATOM 2589 CB PHE A 160 16.164 -1.552 3.138 1.00 41.35 C ATOM 2590 CG PHE A 160 15.101 -0.528 3.463 1.00 61.25 C ATOM 2591 CD1 PHE A 160 14.538 0.266 2.447 1.00 14.24 C ATOM 2592 CD2 PHE A 160 14.661 -0.382 4.789 1.00 50.11 C ATOM 2593 CE1 PHE A 160 13.583 1.241 2.776 1.00 31.23 C ATOM 2594 CE2 PHE A 160 13.686 0.574 5.110 1.00 30.00 C ATOM 2595 CZ PHE A 160 13.148 1.395 4.104 1.00 34.11 C ATOM 0 H PHE A 160 17.118 -2.164 0.752 1.00 65.45 H new ATOM 0 HA PHE A 160 17.412 0.118 2.577 1.00 70.05 H new ATOM 0 HB2 PHE A 160 15.727 -2.332 2.514 1.00 41.35 H new ATOM 0 HB3 PHE A 160 16.492 -2.029 4.061 1.00 41.35 H new ATOM 0 HD1 PHE A 160 14.839 0.126 1.419 1.00 14.24 H new ATOM 0 HD2 PHE A 160 15.075 -1.009 5.565 1.00 50.11 H new ATOM 0 HE1 PHE A 160 13.179 1.878 2.003 1.00 31.23 H new ATOM 0 HE2 PHE A 160 13.349 0.679 6.131 1.00 30.00 H new ATOM 0 HZ PHE A 160 12.405 2.139 4.350 1.00 34.11 H new ATOM 2605 N LEU A 161 19.072 -2.748 2.591 1.00 33.43 N ATOM 2606 CA LEU A 161 20.271 -3.407 3.117 1.00 45.14 C ATOM 2607 C LEU A 161 21.516 -2.530 2.950 1.00 1.52 C ATOM 2608 O LEU A 161 22.443 -2.619 3.754 1.00 51.43 O ATOM 2609 CB LEU A 161 20.520 -4.728 2.369 1.00 5.11 C ATOM 2610 CG LEU A 161 19.782 -5.985 2.852 1.00 30.32 C ATOM 2611 CD1 LEU A 161 20.176 -6.404 4.269 1.00 30.40 C ATOM 2612 CD2 LEU A 161 18.259 -5.945 2.743 1.00 32.44 C ATOM 0 H LEU A 161 18.577 -3.295 1.887 1.00 33.43 H new ATOM 0 HA LEU A 161 20.097 -3.589 4.178 1.00 45.14 H new ATOM 0 HB2 LEU A 161 20.261 -4.572 1.322 1.00 5.11 H new ATOM 0 HB3 LEU A 161 21.590 -4.935 2.406 1.00 5.11 H new ATOM 0 HG LEU A 161 20.123 -6.737 2.140 1.00 30.32 H new ATOM 0 HD11 LEU A 161 19.620 -7.298 4.552 1.00 30.40 H new ATOM 0 HD12 LEU A 161 21.245 -6.616 4.302 1.00 30.40 H new ATOM 0 HD13 LEU A 161 19.944 -5.597 4.965 1.00 30.40 H new ATOM 0 HD21 LEU A 161 17.843 -6.883 3.111 1.00 32.44 H new ATOM 0 HD22 LEU A 161 17.873 -5.118 3.339 1.00 32.44 H new ATOM 0 HD23 LEU A 161 17.972 -5.806 1.701 1.00 32.44 H new ATOM 2624 N GLU A 162 21.525 -1.726 1.883 1.00 62.25 N ATOM 2625 CA GLU A 162 22.613 -0.858 1.451 1.00 73.21 C ATOM 2626 C GLU A 162 23.202 -0.027 2.584 1.00 72.14 C ATOM 2627 O GLU A 162 24.426 0.020 2.721 1.00 21.03 O ATOM 2628 CB GLU A 162 22.124 0.097 0.349 1.00 13.32 C ATOM 2629 CG GLU A 162 21.701 -0.603 -0.945 1.00 11.54 C ATOM 2630 CD GLU A 162 22.829 -1.368 -1.647 1.00 31.44 C ATOM 2631 OE1 GLU A 162 24.017 -1.210 -1.281 1.00 62.42 O ATOM 2632 OE2 GLU A 162 22.541 -2.089 -2.630 1.00 42.35 O ATOM 0 H GLU A 162 20.719 -1.663 1.261 1.00 62.25 H new ATOM 0 HA GLU A 162 23.396 -1.517 1.077 1.00 73.21 H new ATOM 0 HB2 GLU A 162 21.280 0.672 0.730 1.00 13.32 H new ATOM 0 HB3 GLU A 162 22.918 0.808 0.121 1.00 13.32 H new ATOM 0 HG2 GLU A 162 20.892 -1.298 -0.720 1.00 11.54 H new ATOM 0 HG3 GLU A 162 21.300 0.142 -1.633 1.00 11.54 H new ATOM 2639 N ASN A 163 22.349 0.669 3.336 1.00 74.12 N ATOM 2640 CA ASN A 163 22.698 1.569 4.395 1.00 72.42 C ATOM 2641 C ASN A 163 21.928 1.184 5.631 1.00 11.24 C ATOM 2642 O ASN A 163 20.703 1.194 5.632 1.00 52.42 O ATOM 2643 CB ASN A 163 22.472 3.010 3.954 1.00 13.24 C ATOM 2644 CG ASN A 163 21.021 3.399 3.739 1.00 32.03 C ATOM 2645 OD1 ASN A 163 20.354 2.914 2.832 1.00 3.31 O ATOM 2646 ND2 ASN A 163 20.513 4.362 4.492 1.00 45.41 N ATOM 0 H ASN A 163 21.340 0.604 3.201 1.00 74.12 H new ATOM 0 HA ASN A 163 23.758 1.496 4.639 1.00 72.42 H new ATOM 0 HB2 ASN A 163 22.903 3.674 4.703 1.00 13.24 H new ATOM 0 HB3 ASN A 163 23.018 3.179 3.026 1.00 13.24 H new ATOM 0 HD21 ASN A 163 19.567 4.700 4.317 1.00 45.41 H new ATOM 0 HD22 ASN A 163 21.068 4.766 5.247 1.00 45.41 H new ATOM 2653 N GLU A 164 22.652 0.831 6.689 1.00 54.54 N ATOM 2654 CA GLU A 164 22.056 0.224 7.875 1.00 43.34 C ATOM 2655 C GLU A 164 21.220 1.243 8.665 1.00 30.43 C ATOM 2656 O GLU A 164 20.365 0.856 9.457 1.00 73.22 O ATOM 2657 CB GLU A 164 23.125 -0.489 8.720 1.00 51.45 C ATOM 2658 CG GLU A 164 24.093 -1.294 7.834 1.00 13.41 C ATOM 2659 CD GLU A 164 24.626 -2.574 8.472 1.00 1.41 C ATOM 2660 OE1 GLU A 164 23.880 -3.576 8.447 1.00 42.23 O ATOM 2661 OE2 GLU A 164 25.831 -2.629 8.826 1.00 2.21 O ATOM 0 H GLU A 164 23.662 0.957 6.749 1.00 54.54 H new ATOM 0 HA GLU A 164 21.354 -0.548 7.560 1.00 43.34 H new ATOM 0 HB2 GLU A 164 23.684 0.246 9.299 1.00 51.45 H new ATOM 0 HB3 GLU A 164 22.642 -1.156 9.434 1.00 51.45 H new ATOM 0 HG2 GLU A 164 23.585 -1.552 6.905 1.00 13.41 H new ATOM 0 HG3 GLU A 164 24.937 -0.657 7.570 1.00 13.41 H new ATOM 2668 N ASP A 165 21.360 2.531 8.330 1.00 30.04 N ATOM 2669 CA ASP A 165 20.423 3.606 8.639 1.00 53.44 C ATOM 2670 C ASP A 165 19.024 3.158 8.233 1.00 24.12 C ATOM 2671 O ASP A 165 18.087 3.191 9.032 1.00 2.34 O ATOM 2672 CB ASP A 165 20.782 4.873 7.831 1.00 30.00 C ATOM 2673 CG ASP A 165 21.358 6.026 8.646 1.00 70.44 C ATOM 2674 OD1 ASP A 165 22.577 5.971 8.928 1.00 52.43 O ATOM 2675 OD2 ASP A 165 20.635 7.032 8.822 1.00 53.33 O ATOM 0 H ASP A 165 22.172 2.863 7.810 1.00 30.04 H new ATOM 0 HA ASP A 165 20.469 3.830 9.705 1.00 53.44 H new ATOM 0 HB2 ASP A 165 21.502 4.600 7.060 1.00 30.00 H new ATOM 0 HB3 ASP A 165 19.885 5.224 7.320 1.00 30.00 H new ATOM 2680 N ARG A 166 18.867 2.743 6.965 1.00 72.32 N ATOM 2681 CA ARG A 166 17.556 2.309 6.484 1.00 21.10 C ATOM 2682 C ARG A 166 17.110 1.032 7.194 1.00 52.55 C ATOM 2683 O ARG A 166 15.907 0.856 7.395 1.00 21.44 O ATOM 2684 CB ARG A 166 17.514 2.147 4.947 1.00 13.33 C ATOM 2685 CG ARG A 166 16.794 3.329 4.274 1.00 10.24 C ATOM 2686 CD ARG A 166 16.595 3.162 2.759 1.00 65.24 C ATOM 2687 NE ARG A 166 17.798 3.513 1.988 1.00 61.13 N ATOM 2688 CZ ARG A 166 17.868 4.044 0.761 1.00 25.32 C ATOM 2689 NH1 ARG A 166 16.765 4.276 0.053 1.00 43.23 N ATOM 2690 NH2 ARG A 166 19.052 4.376 0.263 1.00 51.15 N ATOM 0 H ARG A 166 19.615 2.701 6.273 1.00 72.32 H new ATOM 0 HA ARG A 166 16.847 3.100 6.730 1.00 21.10 H new ATOM 0 HB2 ARG A 166 18.530 2.071 4.560 1.00 13.33 H new ATOM 0 HB3 ARG A 166 17.006 1.217 4.692 1.00 13.33 H new ATOM 0 HG2 ARG A 166 15.820 3.463 4.745 1.00 10.24 H new ATOM 0 HG3 ARG A 166 17.365 4.240 4.457 1.00 10.24 H new ATOM 0 HD2 ARG A 166 16.319 2.130 2.544 1.00 65.24 H new ATOM 0 HD3 ARG A 166 15.764 3.788 2.434 1.00 65.24 H new ATOM 0 HE ARG A 166 18.691 3.329 2.446 1.00 61.13 H new ATOM 0 HH11 ARG A 166 15.851 4.049 0.444 1.00 43.23 H new ATOM 0 HH12 ARG A 166 16.834 4.681 -0.881 1.00 43.23 H new ATOM 0 HH21 ARG A 166 19.897 4.226 0.814 1.00 51.15 H new ATOM 0 HH22 ARG A 166 19.117 4.781 -0.671 1.00 51.15 H new ATOM 2704 N MET A 167 18.037 0.162 7.589 1.00 13.12 N ATOM 2705 CA MET A 167 17.678 -1.073 8.262 1.00 2.24 C ATOM 2706 C MET A 167 17.098 -0.800 9.644 1.00 32.42 C ATOM 2707 O MET A 167 16.138 -1.481 10.004 1.00 25.20 O ATOM 2708 CB MET A 167 18.867 -2.035 8.323 1.00 12.43 C ATOM 2709 CG MET A 167 19.198 -2.593 6.932 1.00 5.52 C ATOM 2710 SD MET A 167 17.860 -3.506 6.101 1.00 4.23 S ATOM 2711 CE MET A 167 17.551 -4.807 7.320 1.00 3.22 C ATOM 0 H MET A 167 19.039 0.294 7.453 1.00 13.12 H new ATOM 0 HA MET A 167 16.898 -1.560 7.676 1.00 2.24 H new ATOM 0 HB2 MET A 167 19.737 -1.518 8.727 1.00 12.43 H new ATOM 0 HB3 MET A 167 18.640 -2.856 9.003 1.00 12.43 H new ATOM 0 HG2 MET A 167 19.498 -1.764 6.291 1.00 5.52 H new ATOM 0 HG3 MET A 167 20.060 -3.254 7.023 1.00 5.52 H new ATOM 0 HE1 MET A 167 16.958 -5.600 6.864 1.00 3.22 H new ATOM 0 HE2 MET A 167 18.501 -5.216 7.664 1.00 3.22 H new ATOM 0 HE3 MET A 167 17.007 -4.390 8.168 1.00 3.22 H new ATOM 2721 N GLU A 168 17.580 0.201 10.389 1.00 2.12 N ATOM 2722 CA GLU A 168 16.981 0.534 11.682 1.00 43.35 C ATOM 2723 C GLU A 168 15.506 0.916 11.519 1.00 72.31 C ATOM 2724 O GLU A 168 14.685 0.551 12.361 1.00 73.14 O ATOM 2725 CB GLU A 168 17.719 1.670 12.402 1.00 44.45 C ATOM 2726 CG GLU A 168 19.054 1.246 13.030 1.00 22.22 C ATOM 2727 CD GLU A 168 19.263 1.958 14.376 1.00 43.33 C ATOM 2728 OE1 GLU A 168 18.793 1.409 15.414 1.00 10.43 O ATOM 2729 OE2 GLU A 168 19.812 3.077 14.407 1.00 42.45 O ATOM 0 H GLU A 168 18.372 0.786 10.122 1.00 2.12 H new ATOM 0 HA GLU A 168 17.066 -0.363 12.295 1.00 43.35 H new ATOM 0 HB2 GLU A 168 17.903 2.477 11.693 1.00 44.45 H new ATOM 0 HB3 GLU A 168 17.073 2.072 13.183 1.00 44.45 H new ATOM 0 HG2 GLU A 168 19.067 0.166 13.177 1.00 22.22 H new ATOM 0 HG3 GLU A 168 19.874 1.486 12.353 1.00 22.22 H new ATOM 2736 N LEU A 169 15.130 1.621 10.446 1.00 13.32 N ATOM 2737 CA LEU A 169 13.731 1.975 10.192 1.00 72.52 C ATOM 2738 C LEU A 169 12.865 0.737 9.984 1.00 44.21 C ATOM 2739 O LEU A 169 11.724 0.691 10.453 1.00 34.54 O ATOM 2740 CB LEU A 169 13.633 2.913 8.987 1.00 30.10 C ATOM 2741 CG LEU A 169 12.162 3.236 8.644 1.00 24.32 C ATOM 2742 CD1 LEU A 169 12.108 4.651 8.120 1.00 13.43 C ATOM 2743 CD2 LEU A 169 11.570 2.356 7.540 1.00 65.34 C ATOM 0 H LEU A 169 15.780 1.959 9.736 1.00 13.32 H new ATOM 0 HA LEU A 169 13.352 2.492 11.073 1.00 72.52 H new ATOM 0 HB2 LEU A 169 14.170 3.837 9.199 1.00 30.10 H new ATOM 0 HB3 LEU A 169 14.117 2.453 8.125 1.00 30.10 H new ATOM 0 HG LEU A 169 11.590 3.071 9.557 1.00 24.32 H new ATOM 0 HD11 LEU A 169 11.079 4.907 7.869 1.00 13.43 H new ATOM 0 HD12 LEU A 169 12.476 5.336 8.884 1.00 13.43 H new ATOM 0 HD13 LEU A 169 12.730 4.733 7.229 1.00 13.43 H new ATOM 0 HD21 LEU A 169 10.535 2.646 7.359 1.00 65.34 H new ATOM 0 HD22 LEU A 169 12.148 2.483 6.625 1.00 65.34 H new ATOM 0 HD23 LEU A 169 11.605 1.311 7.849 1.00 65.34 H new ATOM 2755 N TYR A 170 13.375 -0.224 9.216 1.00 70.12 N ATOM 2756 CA TYR A 170 12.701 -1.500 9.012 1.00 4.30 C ATOM 2757 C TYR A 170 12.513 -2.166 10.372 1.00 74.13 C ATOM 2758 O TYR A 170 11.383 -2.305 10.839 1.00 54.03 O ATOM 2759 CB TYR A 170 13.482 -2.368 8.008 1.00 30.30 C ATOM 2760 CG TYR A 170 12.973 -3.786 7.800 1.00 54.33 C ATOM 2761 CD1 TYR A 170 11.636 -4.018 7.424 1.00 45.31 C ATOM 2762 CD2 TYR A 170 13.858 -4.876 7.917 1.00 52.53 C ATOM 2763 CE1 TYR A 170 11.197 -5.322 7.136 1.00 3.24 C ATOM 2764 CE2 TYR A 170 13.426 -6.183 7.625 1.00 2.34 C ATOM 2765 CZ TYR A 170 12.091 -6.408 7.219 1.00 25.23 C ATOM 2766 OH TYR A 170 11.644 -7.660 6.930 1.00 50.35 O ATOM 0 H TYR A 170 14.263 -0.139 8.721 1.00 70.12 H new ATOM 0 HA TYR A 170 11.715 -1.355 8.570 1.00 4.30 H new ATOM 0 HB2 TYR A 170 13.481 -1.860 7.044 1.00 30.30 H new ATOM 0 HB3 TYR A 170 14.519 -2.422 8.338 1.00 30.30 H new ATOM 0 HD1 TYR A 170 10.945 -3.191 7.357 1.00 45.31 H new ATOM 0 HD2 TYR A 170 14.877 -4.707 8.233 1.00 52.53 H new ATOM 0 HE1 TYR A 170 10.170 -5.492 6.850 1.00 3.24 H new ATOM 0 HE2 TYR A 170 14.113 -7.012 7.711 1.00 2.34 H new ATOM 0 HH TYR A 170 12.296 -8.321 7.245 1.00 50.35 H new ATOM 2776 N GLN A 171 13.624 -2.497 11.024 1.00 44.02 N ATOM 2777 CA GLN A 171 13.729 -3.176 12.306 1.00 61.54 C ATOM 2778 C GLN A 171 12.773 -2.596 13.344 1.00 43.44 C ATOM 2779 O GLN A 171 11.926 -3.308 13.897 1.00 62.32 O ATOM 2780 CB GLN A 171 15.170 -3.005 12.786 1.00 71.11 C ATOM 2781 CG GLN A 171 16.167 -3.864 12.002 1.00 62.41 C ATOM 2782 CD GLN A 171 16.296 -5.284 12.555 1.00 2.11 C ATOM 2783 OE1 GLN A 171 15.467 -5.735 13.349 1.00 61.45 O ATOM 2784 NE2 GLN A 171 17.291 -6.043 12.132 1.00 5.24 N ATOM 0 H GLN A 171 14.543 -2.280 10.638 1.00 44.02 H new ATOM 0 HA GLN A 171 13.462 -4.226 12.182 1.00 61.54 H new ATOM 0 HB2 GLN A 171 15.454 -1.956 12.698 1.00 71.11 H new ATOM 0 HB3 GLN A 171 15.228 -3.264 13.843 1.00 71.11 H new ATOM 0 HG2 GLN A 171 15.854 -3.913 10.959 1.00 62.41 H new ATOM 0 HG3 GLN A 171 17.145 -3.383 12.019 1.00 62.41 H new ATOM 0 HE21 GLN A 171 17.975 -5.668 11.475 1.00 5.24 H new ATOM 0 HE22 GLN A 171 17.375 -7.004 12.462 1.00 5.24 H new ATOM 2793 N THR A 172 12.912 -1.298 13.607 1.00 31.13 N ATOM 2794 CA THR A 172 12.210 -0.598 14.687 1.00 53.21 C ATOM 2795 C THR A 172 10.688 -0.663 14.505 1.00 21.12 C ATOM 2796 O THR A 172 9.940 -0.640 15.487 1.00 44.02 O ATOM 2797 CB THR A 172 12.712 0.856 14.789 1.00 62.43 C ATOM 2798 OG1 THR A 172 14.110 0.855 14.953 1.00 13.12 O ATOM 2799 CG2 THR A 172 12.140 1.622 15.987 1.00 32.24 C ATOM 0 H THR A 172 13.527 -0.690 13.066 1.00 31.13 H new ATOM 0 HA THR A 172 12.433 -1.102 15.627 1.00 53.21 H new ATOM 0 HB THR A 172 12.387 1.346 13.871 1.00 62.43 H new ATOM 0 HG1 THR A 172 14.542 0.892 14.074 1.00 13.12 H new ATOM 0 HG21 THR A 172 12.538 2.637 15.993 1.00 32.24 H new ATOM 0 HG22 THR A 172 11.053 1.659 15.910 1.00 32.24 H new ATOM 0 HG23 THR A 172 12.422 1.116 16.910 1.00 32.24 H new ATOM 2807 N ARG A 173 10.197 -0.805 13.271 1.00 3.30 N ATOM 2808 CA ARG A 173 8.773 -0.906 12.968 1.00 50.13 C ATOM 2809 C ARG A 173 8.463 -2.271 12.358 1.00 31.50 C ATOM 2810 O ARG A 173 7.531 -2.384 11.565 1.00 3.34 O ATOM 2811 CB ARG A 173 8.371 0.290 12.091 1.00 33.14 C ATOM 2812 CG ARG A 173 6.864 0.609 12.110 1.00 21.41 C ATOM 2813 CD ARG A 173 6.613 2.011 12.685 1.00 3.30 C ATOM 2814 NE ARG A 173 5.188 2.367 12.689 1.00 30.44 N ATOM 2815 CZ ARG A 173 4.469 2.795 11.647 1.00 4.21 C ATOM 2816 NH1 ARG A 173 4.990 2.839 10.423 1.00 22.54 N ATOM 2817 NH2 ARG A 173 3.215 3.176 11.832 1.00 74.42 N ATOM 0 H ARG A 173 10.790 -0.853 12.443 1.00 3.30 H new ATOM 0 HA ARG A 173 8.167 -0.851 13.872 1.00 50.13 H new ATOM 0 HB2 ARG A 173 8.921 1.170 12.422 1.00 33.14 H new ATOM 0 HB3 ARG A 173 8.676 0.091 11.064 1.00 33.14 H new ATOM 0 HG2 ARG A 173 6.462 0.548 11.099 1.00 21.41 H new ATOM 0 HG3 ARG A 173 6.337 -0.135 12.708 1.00 21.41 H new ATOM 0 HD2 ARG A 173 6.999 2.058 13.703 1.00 3.30 H new ATOM 0 HD3 ARG A 173 7.167 2.745 12.100 1.00 3.30 H new ATOM 0 HE ARG A 173 4.697 2.278 13.578 1.00 30.44 H new ATOM 0 HH11 ARG A 173 5.954 2.543 10.268 1.00 22.54 H new ATOM 0 HH12 ARG A 173 4.426 3.169 9.640 1.00 22.54 H new ATOM 0 HH21 ARG A 173 2.804 3.142 12.765 1.00 74.42 H new ATOM 0 HH22 ARG A 173 2.660 3.504 11.042 1.00 74.42 H new ATOM 2831 N LEU A 174 9.235 -3.301 12.716 1.00 63.21 N ATOM 2832 CA LEU A 174 9.055 -4.680 12.281 1.00 13.41 C ATOM 2833 C LEU A 174 8.916 -5.568 13.508 1.00 25.44 C ATOM 2834 O LEU A 174 7.836 -6.086 13.745 1.00 13.04 O ATOM 2835 CB LEU A 174 10.239 -5.129 11.410 1.00 71.24 C ATOM 2836 CG LEU A 174 10.209 -6.633 11.080 1.00 13.32 C ATOM 2837 CD1 LEU A 174 9.163 -6.920 10.007 1.00 23.21 C ATOM 2838 CD2 LEU A 174 11.592 -7.093 10.641 1.00 24.34 C ATOM 0 H LEU A 174 10.033 -3.188 13.342 1.00 63.21 H new ATOM 0 HA LEU A 174 8.152 -4.759 11.675 1.00 13.41 H new ATOM 0 HB2 LEU A 174 10.236 -4.559 10.481 1.00 71.24 H new ATOM 0 HB3 LEU A 174 11.171 -4.894 11.925 1.00 71.24 H new ATOM 0 HG LEU A 174 9.930 -7.192 11.973 1.00 13.32 H new ATOM 0 HD11 LEU A 174 9.153 -7.987 9.784 1.00 23.21 H new ATOM 0 HD12 LEU A 174 8.180 -6.616 10.366 1.00 23.21 H new ATOM 0 HD13 LEU A 174 9.407 -6.363 9.103 1.00 23.21 H new ATOM 0 HD21 LEU A 174 11.565 -8.158 10.409 1.00 24.34 H new ATOM 0 HD22 LEU A 174 11.896 -6.536 9.755 1.00 24.34 H new ATOM 0 HD23 LEU A 174 12.307 -6.915 11.445 1.00 24.34 H new ATOM 2850 N SER A 175 9.967 -5.747 14.316 1.00 62.32 N ATOM 2851 CA SER A 175 9.846 -6.560 15.529 1.00 5.02 C ATOM 2852 C SER A 175 8.972 -5.884 16.600 1.00 41.45 C ATOM 2853 O SER A 175 8.700 -6.487 17.636 1.00 50.35 O ATOM 2854 CB SER A 175 11.230 -6.987 16.046 1.00 50.02 C ATOM 2855 OG SER A 175 11.693 -8.103 15.296 1.00 41.31 O ATOM 0 H SER A 175 10.892 -5.349 14.157 1.00 62.32 H new ATOM 0 HA SER A 175 9.316 -7.476 15.268 1.00 5.02 H new ATOM 0 HB2 SER A 175 11.934 -6.159 15.959 1.00 50.02 H new ATOM 0 HB3 SER A 175 11.171 -7.245 17.103 1.00 50.02 H new ATOM 0 HG SER A 175 12.576 -8.374 15.624 1.00 41.31 H new ATOM 2861 N LYS A 176 8.475 -4.663 16.355 1.00 52.02 N ATOM 2862 CA LYS A 176 7.399 -4.019 17.110 1.00 24.44 C ATOM 2863 C LYS A 176 6.056 -4.105 16.361 1.00 72.55 C ATOM 2864 O LYS A 176 5.211 -3.237 16.576 1.00 53.04 O ATOM 2865 CB LYS A 176 7.775 -2.560 17.455 1.00 32.33 C ATOM 2866 CG LYS A 176 9.066 -2.315 18.263 1.00 54.21 C ATOM 2867 CD LYS A 176 9.093 -2.918 19.681 1.00 53.32 C ATOM 2868 CE LYS A 176 9.600 -4.354 19.637 1.00 62.45 C ATOM 2869 NZ LYS A 176 9.387 -5.105 20.886 1.00 64.34 N ATOM 0 H LYS A 176 8.827 -4.078 15.597 1.00 52.02 H new ATOM 0 HA LYS A 176 7.271 -4.559 18.048 1.00 24.44 H new ATOM 0 HB2 LYS A 176 7.857 -2.006 16.520 1.00 32.33 H new ATOM 0 HB3 LYS A 176 6.945 -2.124 18.012 1.00 32.33 H new ATOM 0 HG2 LYS A 176 9.907 -2.720 17.700 1.00 54.21 H new ATOM 0 HG3 LYS A 176 9.224 -1.239 18.343 1.00 54.21 H new ATOM 0 HD2 LYS A 176 9.735 -2.318 20.326 1.00 53.32 H new ATOM 0 HD3 LYS A 176 8.093 -2.892 20.114 1.00 53.32 H new ATOM 0 HE2 LYS A 176 9.103 -4.879 18.821 1.00 62.45 H new ATOM 0 HE3 LYS A 176 10.666 -4.345 19.408 1.00 62.45 H new ATOM 0 HZ1 LYS A 176 9.757 -6.071 20.778 1.00 64.34 H new ATOM 0 HZ2 LYS A 176 9.883 -4.629 21.666 1.00 64.34 H new ATOM 0 HZ3 LYS A 176 8.369 -5.146 21.097 1.00 64.34 H new ATOM 2883 N LYS A 177 5.843 -5.043 15.428 1.00 4.21 N ATOM 2884 CA LYS A 177 4.582 -5.174 14.702 1.00 62.32 C ATOM 2885 C LYS A 177 3.882 -6.464 15.065 1.00 2.11 C ATOM 2886 O LYS A 177 4.489 -7.501 15.334 1.00 53.02 O ATOM 2887 CB LYS A 177 4.761 -5.119 13.178 1.00 31.23 C ATOM 2888 CG LYS A 177 4.804 -3.697 12.619 1.00 63.35 C ATOM 2889 CD LYS A 177 3.407 -3.054 12.516 1.00 13.41 C ATOM 2890 CE LYS A 177 3.478 -2.013 11.403 1.00 30.14 C ATOM 2891 NZ LYS A 177 2.220 -1.254 11.201 1.00 23.11 N ATOM 0 H LYS A 177 6.545 -5.732 15.158 1.00 4.21 H new ATOM 0 HA LYS A 177 3.975 -4.320 15.002 1.00 62.32 H new ATOM 0 HB2 LYS A 177 5.683 -5.634 12.910 1.00 31.23 H new ATOM 0 HB3 LYS A 177 3.943 -5.662 12.704 1.00 31.23 H new ATOM 0 HG2 LYS A 177 5.437 -3.080 13.256 1.00 63.35 H new ATOM 0 HG3 LYS A 177 5.265 -3.713 11.632 1.00 63.35 H new ATOM 0 HD2 LYS A 177 2.651 -3.807 12.293 1.00 13.41 H new ATOM 0 HD3 LYS A 177 3.125 -2.590 13.461 1.00 13.41 H new ATOM 0 HE2 LYS A 177 4.281 -1.311 11.628 1.00 30.14 H new ATOM 0 HE3 LYS A 177 3.742 -2.512 10.470 1.00 30.14 H new ATOM 0 HZ1 LYS A 177 2.438 -0.325 10.787 1.00 23.11 H new ATOM 0 HZ2 LYS A 177 1.595 -1.782 10.558 1.00 23.11 H new ATOM 0 HZ3 LYS A 177 1.743 -1.122 12.116 1.00 23.11 H new ATOM 2905 N ASN A 178 2.574 -6.376 14.921 1.00 4.02 N ATOM 2906 CA ASN A 178 1.554 -7.377 15.160 1.00 52.01 C ATOM 2907 C ASN A 178 1.290 -8.278 13.950 1.00 33.34 C ATOM 2908 O ASN A 178 0.248 -8.923 13.904 1.00 44.21 O ATOM 2909 CB ASN A 178 0.295 -6.604 15.543 1.00 33.10 C ATOM 2910 CG ASN A 178 -0.472 -6.047 14.354 1.00 3.10 C ATOM 2911 OD1 ASN A 178 -1.533 -6.715 13.940 1.00 43.32 O flip ATOM 2912 ND2 ASN A 178 -0.085 -5.029 13.784 1.00 45.03 N flip ATOM 0 H ASN A 178 2.155 -5.504 14.598 1.00 4.02 H new ATOM 0 HA ASN A 178 1.882 -8.057 15.946 1.00 52.01 H new ATOM 0 HB2 ASN A 178 -0.363 -7.260 16.112 1.00 33.10 H new ATOM 0 HB3 ASN A 178 0.572 -5.781 16.202 1.00 33.10 H new ATOM 0 HD21 ASN A 178 0.738 -4.534 14.127 1.00 45.03 H new ATOM 0 HD22 ASN A 178 -0.587 -4.679 12.968 1.00 45.03 H new ATOM 2919 N TRP A 179 2.151 -8.326 12.931 1.00 5.40 N ATOM 2920 CA TRP A 179 1.749 -8.875 11.630 1.00 74.25 C ATOM 2921 C TRP A 179 1.371 -10.340 11.667 1.00 61.22 C ATOM 2922 O TRP A 179 0.450 -10.772 10.974 1.00 61.53 O ATOM 2923 CB TRP A 179 2.833 -8.604 10.591 1.00 11.34 C ATOM 2924 CG TRP A 179 2.976 -7.176 10.231 1.00 52.24 C ATOM 2925 CD1 TRP A 179 4.117 -6.462 10.151 1.00 51.34 C ATOM 2926 CD2 TRP A 179 1.901 -6.279 9.865 1.00 64.35 C ATOM 2927 NE1 TRP A 179 3.821 -5.181 9.730 1.00 3.13 N ATOM 2928 CE2 TRP A 179 2.459 -4.993 9.614 1.00 3.21 C ATOM 2929 CE3 TRP A 179 0.508 -6.454 9.731 1.00 45.02 C ATOM 2930 CZ2 TRP A 179 1.659 -3.885 9.318 1.00 13.10 C ATOM 2931 CZ3 TRP A 179 -0.301 -5.317 9.525 1.00 72.14 C ATOM 2932 CH2 TRP A 179 0.266 -4.040 9.344 1.00 61.43 C ATOM 0 H TRP A 179 3.116 -7.998 12.977 1.00 5.40 H new ATOM 0 HA TRP A 179 0.834 -8.356 11.344 1.00 74.25 H new ATOM 0 HB2 TRP A 179 3.787 -8.970 10.972 1.00 11.34 H new ATOM 0 HB3 TRP A 179 2.609 -9.175 9.690 1.00 11.34 H new ATOM 0 HD1 TRP A 179 5.105 -6.833 10.380 1.00 51.34 H new ATOM 0 HE1 TRP A 179 4.520 -4.465 9.530 1.00 3.13 H new ATOM 0 HE3 TRP A 179 0.069 -7.439 9.785 1.00 45.02 H new ATOM 0 HZ2 TRP A 179 2.104 -2.932 9.075 1.00 13.10 H new ATOM 0 HZ3 TRP A 179 -1.375 -5.427 9.506 1.00 72.14 H new ATOM 0 HH2 TRP A 179 -0.374 -3.178 9.225 1.00 61.43 H new ATOM 2943 N GLN A 180 2.052 -11.088 12.519 1.00 11.20 N ATOM 2944 CA GLN A 180 1.747 -12.481 12.735 1.00 61.43 C ATOM 2945 C GLN A 180 0.424 -12.672 13.515 1.00 50.11 C ATOM 2946 O GLN A 180 -0.147 -13.763 13.495 1.00 5.24 O ATOM 2947 CB GLN A 180 2.969 -13.116 13.422 1.00 12.43 C ATOM 2948 CG GLN A 180 3.362 -12.486 14.782 1.00 44.14 C ATOM 2949 CD GLN A 180 2.572 -13.036 15.974 1.00 53.34 C ATOM 2950 OE1 GLN A 180 1.991 -14.116 15.906 1.00 41.25 O ATOM 2951 NE2 GLN A 180 2.534 -12.315 17.077 1.00 52.05 N ATOM 0 H GLN A 180 2.831 -10.741 13.078 1.00 11.20 H new ATOM 0 HA GLN A 180 1.569 -12.990 11.788 1.00 61.43 H new ATOM 0 HB2 GLN A 180 2.769 -14.177 13.575 1.00 12.43 H new ATOM 0 HB3 GLN A 180 3.822 -13.046 12.747 1.00 12.43 H new ATOM 0 HG2 GLN A 180 4.425 -12.654 14.955 1.00 44.14 H new ATOM 0 HG3 GLN A 180 3.214 -11.407 14.728 1.00 44.14 H new ATOM 0 HE21 GLN A 180 3.022 -11.420 17.118 1.00 52.05 H new ATOM 0 HE22 GLN A 180 2.017 -12.652 17.889 1.00 52.05 H new ATOM 2960 N GLU A 181 -0.098 -11.631 14.185 1.00 51.03 N ATOM 2961 CA GLU A 181 -1.180 -11.787 15.161 1.00 10.00 C ATOM 2962 C GLU A 181 -2.517 -11.848 14.399 1.00 51.25 C ATOM 2963 O GLU A 181 -3.533 -12.347 14.886 1.00 71.31 O ATOM 2964 CB GLU A 181 -1.155 -10.768 16.320 1.00 50.02 C ATOM 2965 CG GLU A 181 -2.151 -9.705 16.034 1.00 62.35 C ATOM 2966 CD GLU A 181 -2.193 -8.519 16.977 1.00 32.11 C ATOM 2967 OE1 GLU A 181 -1.581 -8.551 18.072 1.00 73.34 O ATOM 2968 OE2 GLU A 181 -2.836 -7.534 16.563 1.00 4.03 O ATOM 0 H GLU A 181 0.217 -10.668 14.065 1.00 51.03 H new ATOM 0 HA GLU A 181 -1.033 -12.728 15.691 1.00 10.00 H new ATOM 0 HB2 GLU A 181 -1.388 -11.262 17.263 1.00 50.02 H new ATOM 0 HB3 GLU A 181 -0.159 -10.336 16.424 1.00 50.02 H new ATOM 0 HG2 GLU A 181 -1.964 -9.329 15.028 1.00 62.35 H new ATOM 0 HG3 GLU A 181 -3.140 -10.163 16.024 1.00 62.35 H new ATOM 2975 N LYS A 182 -2.546 -11.202 13.227 1.00 12.43 N ATOM 2976 CA LYS A 182 -3.689 -11.101 12.351 1.00 43.22 C ATOM 2977 C LYS A 182 -3.629 -12.172 11.273 1.00 2.33 C ATOM 2978 O LYS A 182 -4.653 -12.590 10.758 1.00 14.03 O ATOM 2979 CB LYS A 182 -3.832 -9.665 11.871 1.00 25.20 C ATOM 2980 CG LYS A 182 -2.823 -9.242 10.893 1.00 73.43 C ATOM 2981 CD LYS A 182 -2.875 -7.727 10.673 1.00 34.22 C ATOM 2982 CE LYS A 182 -4.235 -7.313 10.104 1.00 14.14 C ATOM 2983 NZ LYS A 182 -4.287 -5.879 9.745 1.00 41.12 N ATOM 0 H LYS A 182 -1.728 -10.717 12.859 1.00 12.43 H new ATOM 0 HA LYS A 182 -4.619 -11.315 12.878 1.00 43.22 H new ATOM 0 HB2 LYS A 182 -4.821 -9.541 11.429 1.00 25.20 H new ATOM 0 HB3 LYS A 182 -3.782 -9.001 12.734 1.00 25.20 H new ATOM 0 HG2 LYS A 182 -1.831 -9.529 11.241 1.00 73.43 H new ATOM 0 HG3 LYS A 182 -2.990 -9.757 9.947 1.00 73.43 H new ATOM 0 HD2 LYS A 182 -2.697 -7.211 11.616 1.00 34.22 H new ATOM 0 HD3 LYS A 182 -2.081 -7.426 9.989 1.00 34.22 H new ATOM 0 HE2 LYS A 182 -4.453 -7.913 9.221 1.00 14.14 H new ATOM 0 HE3 LYS A 182 -5.013 -7.529 10.837 1.00 14.14 H new ATOM 0 HZ1 LYS A 182 -5.228 -5.650 9.365 1.00 41.12 H new ATOM 0 HZ2 LYS A 182 -4.106 -5.302 10.591 1.00 41.12 H new ATOM 0 HZ3 LYS A 182 -3.564 -5.675 9.026 1.00 41.12 H new ATOM 2997 N TRP A 183 -2.417 -12.601 10.964 1.00 65.15 N ATOM 2998 CA TRP A 183 -2.113 -13.621 9.970 1.00 23.30 C ATOM 2999 C TRP A 183 -1.038 -14.594 10.456 1.00 64.42 C ATOM 3000 O TRP A 183 0.153 -14.293 10.432 1.00 11.33 O ATOM 3001 CB TRP A 183 -1.629 -12.921 8.713 1.00 3.33 C ATOM 3002 CG TRP A 183 -2.603 -12.006 8.052 1.00 33.12 C ATOM 3003 CD1 TRP A 183 -3.753 -12.407 7.470 1.00 30.20 C ATOM 3004 CD2 TRP A 183 -2.500 -10.567 7.792 1.00 22.20 C ATOM 3005 NE1 TRP A 183 -4.419 -11.321 6.974 1.00 2.02 N ATOM 3006 CE2 TRP A 183 -3.719 -10.167 7.173 1.00 43.43 C ATOM 3007 CE3 TRP A 183 -1.536 -9.550 8.025 1.00 42.05 C ATOM 3008 CZ2 TRP A 183 -4.041 -8.836 6.929 1.00 63.33 C ATOM 3009 CZ3 TRP A 183 -1.815 -8.217 7.670 1.00 25.14 C ATOM 3010 CH2 TRP A 183 -3.091 -7.864 7.214 1.00 52.13 C ATOM 0 H TRP A 183 -1.581 -12.233 11.418 1.00 65.15 H new ATOM 0 HA TRP A 183 -3.014 -14.203 9.779 1.00 23.30 H new ATOM 0 HB2 TRP A 183 -0.736 -12.348 8.962 1.00 3.33 H new ATOM 0 HB3 TRP A 183 -1.329 -13.681 7.992 1.00 3.33 H new ATOM 0 HD1 TRP A 183 -4.095 -13.429 7.406 1.00 30.20 H new ATOM 0 HE1 TRP A 183 -5.327 -11.368 6.512 1.00 2.02 H new ATOM 0 HE3 TRP A 183 -0.587 -9.800 8.476 1.00 42.05 H new ATOM 0 HZ2 TRP A 183 -5.006 -8.565 6.528 1.00 63.33 H new ATOM 0 HZ3 TRP A 183 -1.044 -7.465 7.749 1.00 25.14 H new ATOM 0 HH2 TRP A 183 -3.340 -6.821 7.082 1.00 52.13 H new ATOM 3021 N LYS A 184 -1.412 -15.817 10.816 1.00 5.32 N ATOM 3022 CA LYS A 184 -0.508 -16.854 11.323 1.00 1.03 C ATOM 3023 C LYS A 184 0.609 -17.240 10.357 1.00 54.33 C ATOM 3024 O LYS A 184 1.651 -17.752 10.773 1.00 5.30 O ATOM 3025 CB LYS A 184 -1.370 -18.054 11.705 1.00 62.14 C ATOM 3026 CG LYS A 184 -1.867 -18.847 10.498 1.00 14.01 C ATOM 3027 CD LYS A 184 -2.924 -19.902 10.852 1.00 1.22 C ATOM 3028 CE LYS A 184 -2.333 -21.011 11.729 1.00 14.23 C ATOM 3029 NZ LYS A 184 -3.304 -22.078 12.043 1.00 30.13 N ATOM 0 H LYS A 184 -2.382 -16.128 10.763 1.00 5.32 H new ATOM 0 HA LYS A 184 0.026 -16.460 12.188 1.00 1.03 H new ATOM 0 HB2 LYS A 184 -0.795 -18.715 12.354 1.00 62.14 H new ATOM 0 HB3 LYS A 184 -2.227 -17.708 12.282 1.00 62.14 H new ATOM 0 HG2 LYS A 184 -2.286 -18.156 9.767 1.00 14.01 H new ATOM 0 HG3 LYS A 184 -1.019 -19.339 10.022 1.00 14.01 H new ATOM 0 HD2 LYS A 184 -3.755 -19.427 11.374 1.00 1.22 H new ATOM 0 HD3 LYS A 184 -3.328 -20.336 9.937 1.00 1.22 H new ATOM 0 HE2 LYS A 184 -1.473 -21.448 11.222 1.00 14.23 H new ATOM 0 HE3 LYS A 184 -1.967 -20.575 12.659 1.00 14.23 H new ATOM 0 HZ1 LYS A 184 -2.848 -22.799 12.638 1.00 30.13 H new ATOM 0 HZ2 LYS A 184 -4.114 -21.671 12.552 1.00 30.13 H new ATOM 0 HZ3 LYS A 184 -3.635 -22.517 11.160 1.00 30.13 H new ATOM 3043 N ASN A 185 0.383 -17.006 9.066 1.00 30.54 N ATOM 3044 CA ASN A 185 1.245 -17.467 7.981 1.00 43.12 C ATOM 3045 C ASN A 185 2.398 -16.487 7.744 1.00 25.31 C ATOM 3046 O ASN A 185 3.196 -16.685 6.833 1.00 64.52 O ATOM 3047 CB ASN A 185 0.427 -17.693 6.697 1.00 62.42 C ATOM 3048 CG ASN A 185 1.052 -18.783 5.827 1.00 62.44 C ATOM 3049 OD1 ASN A 185 0.722 -19.957 5.972 1.00 2.04 O ATOM 3050 ND2 ASN A 185 1.979 -18.457 4.946 1.00 41.11 N ATOM 0 H ASN A 185 -0.425 -16.477 8.738 1.00 30.54 H new ATOM 0 HA ASN A 185 1.681 -18.423 8.272 1.00 43.12 H new ATOM 0 HB2 ASN A 185 -0.594 -17.973 6.958 1.00 62.42 H new ATOM 0 HB3 ASN A 185 0.368 -16.763 6.132 1.00 62.42 H new ATOM 0 HD21 ASN A 185 2.424 -19.181 4.382 1.00 41.11 H new ATOM 0 HD22 ASN A 185 2.250 -17.481 4.829 1.00 41.11 H new ATOM 3057 N LEU A 186 2.452 -15.384 8.502 1.00 23.50 N ATOM 3058 CA LEU A 186 3.349 -14.284 8.216 1.00 34.34 C ATOM 3059 C LEU A 186 4.799 -14.676 8.473 1.00 71.25 C ATOM 3060 O LEU A 186 5.172 -14.916 9.625 1.00 70.41 O ATOM 3061 CB LEU A 186 2.940 -13.006 8.987 1.00 24.32 C ATOM 3062 CG LEU A 186 2.604 -11.822 8.071 1.00 14.43 C ATOM 3063 CD1 LEU A 186 3.685 -11.652 7.017 1.00 45.24 C ATOM 3064 CD2 LEU A 186 1.312 -11.968 7.282 1.00 44.13 C ATOM 0 H LEU A 186 1.871 -15.240 9.328 1.00 23.50 H new ATOM 0 HA LEU A 186 3.266 -14.049 7.155 1.00 34.34 H new ATOM 0 HB2 LEU A 186 2.075 -13.229 9.612 1.00 24.32 H new ATOM 0 HB3 LEU A 186 3.751 -12.719 9.656 1.00 24.32 H new ATOM 0 HG LEU A 186 2.514 -10.980 8.757 1.00 14.43 H new ATOM 0 HD11 LEU A 186 3.436 -10.809 6.373 1.00 45.24 H new ATOM 0 HD12 LEU A 186 4.642 -11.466 7.504 1.00 45.24 H new ATOM 0 HD13 LEU A 186 3.754 -12.559 6.417 1.00 45.24 H new ATOM 0 HD21 LEU A 186 1.161 -11.083 6.665 1.00 44.13 H new ATOM 0 HD22 LEU A 186 1.373 -12.849 6.644 1.00 44.13 H new ATOM 0 HD23 LEU A 186 0.475 -12.077 7.972 1.00 44.13 H new ATOM 3076 N ILE A 187 5.614 -14.715 7.414 1.00 21.22 N ATOM 3077 CA ILE A 187 7.030 -15.028 7.541 1.00 65.23 C ATOM 3078 C ILE A 187 7.785 -13.726 7.727 1.00 41.45 C ATOM 3079 O ILE A 187 7.676 -12.826 6.901 1.00 4.33 O ATOM 3080 CB ILE A 187 7.630 -15.767 6.317 1.00 53.03 C ATOM 3081 CG1 ILE A 187 6.719 -16.824 5.690 1.00 41.11 C ATOM 3082 CG2 ILE A 187 8.949 -16.372 6.815 1.00 5.02 C ATOM 3083 CD1 ILE A 187 7.351 -17.545 4.491 1.00 21.30 C ATOM 0 H ILE A 187 5.310 -14.532 6.458 1.00 21.22 H new ATOM 0 HA ILE A 187 7.129 -15.702 8.392 1.00 65.23 H new ATOM 0 HB ILE A 187 7.772 -15.060 5.499 1.00 53.03 H new ATOM 0 HG12 ILE A 187 6.455 -17.561 6.449 1.00 41.11 H new ATOM 0 HG13 ILE A 187 5.791 -16.349 5.370 1.00 41.11 H new ATOM 0 HG21 ILE A 187 9.432 -16.912 6.001 1.00 5.02 H new ATOM 0 HG22 ILE A 187 9.607 -15.575 7.162 1.00 5.02 H new ATOM 0 HG23 ILE A 187 8.747 -17.059 7.637 1.00 5.02 H new ATOM 0 HD11 ILE A 187 6.649 -18.280 4.097 1.00 21.30 H new ATOM 0 HD12 ILE A 187 7.590 -16.819 3.714 1.00 21.30 H new ATOM 0 HD13 ILE A 187 8.264 -18.049 4.809 1.00 21.30 H new ATOM 3095 N PHE A 188 8.696 -13.692 8.684 1.00 42.22 N ATOM 3096 CA PHE A 188 9.542 -12.550 9.015 1.00 1.43 C ATOM 3097 C PHE A 188 10.989 -12.905 8.736 1.00 1.30 C ATOM 3098 O PHE A 188 11.439 -13.963 9.179 1.00 65.11 O ATOM 3099 CB PHE A 188 9.419 -12.240 10.501 1.00 41.22 C ATOM 3100 CG PHE A 188 8.364 -11.225 10.861 1.00 30.50 C ATOM 3101 CD1 PHE A 188 7.017 -11.423 10.512 1.00 50.25 C ATOM 3102 CD2 PHE A 188 8.740 -10.088 11.592 1.00 34.44 C ATOM 3103 CE1 PHE A 188 6.042 -10.516 10.952 1.00 11.14 C ATOM 3104 CE2 PHE A 188 7.766 -9.185 12.033 1.00 52.43 C ATOM 3105 CZ PHE A 188 6.413 -9.401 11.729 1.00 64.42 C ATOM 0 H PHE A 188 8.877 -14.498 9.283 1.00 42.22 H new ATOM 0 HA PHE A 188 9.232 -11.692 8.419 1.00 1.43 H new ATOM 0 HB2 PHE A 188 9.204 -13.167 11.032 1.00 41.22 H new ATOM 0 HB3 PHE A 188 10.383 -11.882 10.862 1.00 41.22 H new ATOM 0 HD1 PHE A 188 6.734 -12.271 9.907 1.00 50.25 H new ATOM 0 HD2 PHE A 188 9.782 -9.910 11.814 1.00 34.44 H new ATOM 0 HE1 PHE A 188 5.005 -10.673 10.695 1.00 11.14 H new ATOM 0 HE2 PHE A 188 8.057 -8.319 12.609 1.00 52.43 H new ATOM 0 HZ PHE A 188 5.660 -8.716 12.089 1.00 64.42 H new ATOM 3115 N LYS A 189 11.725 -12.034 8.044 1.00 22.30 N ATOM 3116 CA LYS A 189 13.156 -12.194 7.793 1.00 31.40 C ATOM 3117 C LYS A 189 13.836 -10.829 7.742 1.00 32.12 C ATOM 3118 O LYS A 189 13.186 -9.787 7.620 1.00 3.20 O ATOM 3119 CB LYS A 189 13.385 -12.923 6.458 1.00 1.10 C ATOM 3120 CG LYS A 189 12.750 -14.317 6.355 1.00 32.12 C ATOM 3121 CD LYS A 189 13.490 -15.369 7.163 1.00 32.01 C ATOM 3122 CE LYS A 189 12.721 -16.685 7.059 1.00 51.43 C ATOM 3123 NZ LYS A 189 13.564 -17.813 7.489 1.00 51.12 N ATOM 0 H LYS A 189 11.336 -11.184 7.636 1.00 22.30 H new ATOM 0 HA LYS A 189 13.584 -12.783 8.604 1.00 31.40 H new ATOM 0 HB2 LYS A 189 12.993 -12.303 5.652 1.00 1.10 H new ATOM 0 HB3 LYS A 189 14.458 -13.018 6.294 1.00 1.10 H new ATOM 0 HG2 LYS A 189 11.716 -14.265 6.697 1.00 32.12 H new ATOM 0 HG3 LYS A 189 12.725 -14.622 5.309 1.00 32.12 H new ATOM 0 HD2 LYS A 189 14.505 -15.492 6.786 1.00 32.01 H new ATOM 0 HD3 LYS A 189 13.572 -15.059 8.205 1.00 32.01 H new ATOM 0 HE2 LYS A 189 11.824 -16.638 7.677 1.00 51.43 H new ATOM 0 HE3 LYS A 189 12.393 -16.840 6.031 1.00 51.43 H new ATOM 0 HZ1 LYS A 189 13.025 -18.699 7.411 1.00 51.12 H new ATOM 0 HZ2 LYS A 189 14.407 -17.867 6.883 1.00 51.12 H new ATOM 0 HZ3 LYS A 189 13.856 -17.671 8.477 1.00 51.12 H new ATOM 3137 N ASN A 190 15.164 -10.849 7.781 1.00 14.10 N ATOM 3138 CA ASN A 190 16.053 -9.695 7.696 1.00 31.14 C ATOM 3139 C ASN A 190 16.658 -9.484 6.315 1.00 62.31 C ATOM 3140 O ASN A 190 17.351 -8.494 6.107 1.00 22.22 O ATOM 3141 CB ASN A 190 17.212 -9.882 8.678 1.00 50.32 C ATOM 3142 CG ASN A 190 18.107 -11.068 8.304 1.00 33.42 C ATOM 3143 OD1 ASN A 190 17.625 -12.183 8.085 1.00 44.52 O ATOM 3144 ND2 ASN A 190 19.405 -10.861 8.206 1.00 11.12 N ATOM 0 H ASN A 190 15.680 -11.724 7.879 1.00 14.10 H new ATOM 0 HA ASN A 190 15.440 -8.824 7.929 1.00 31.14 H new ATOM 0 HB2 ASN A 190 17.812 -8.972 8.706 1.00 50.32 H new ATOM 0 HB3 ASN A 190 16.814 -10.033 9.682 1.00 50.32 H new ATOM 0 HD21 ASN A 190 20.026 -11.628 7.946 1.00 11.12 H new ATOM 0 HD22 ASN A 190 19.789 -9.934 8.390 1.00 11.12 H new ATOM 3151 N THR A 191 16.404 -10.392 5.387 1.00 11.40 N ATOM 3152 CA THR A 191 16.836 -10.374 4.009 1.00 25.02 C ATOM 3153 C THR A 191 15.687 -10.947 3.193 1.00 61.34 C ATOM 3154 O THR A 191 14.978 -11.853 3.695 1.00 41.23 O ATOM 3155 CB THR A 191 18.148 -11.166 3.853 1.00 72.43 C ATOM 3156 OG1 THR A 191 18.055 -12.474 4.392 1.00 11.24 O ATOM 3157 CG2 THR A 191 19.343 -10.480 4.516 1.00 42.25 C ATOM 0 H THR A 191 15.848 -11.221 5.599 1.00 11.40 H new ATOM 0 HA THR A 191 17.062 -9.368 3.656 1.00 25.02 H new ATOM 0 HB THR A 191 18.308 -11.213 2.776 1.00 72.43 H new ATOM 0 HG1 THR A 191 18.908 -12.940 4.269 1.00 11.24 H new ATOM 0 HG21 THR A 191 20.237 -11.087 4.371 1.00 42.25 H new ATOM 0 HG22 THR A 191 19.494 -9.498 4.067 1.00 42.25 H new ATOM 0 HG23 THR A 191 19.151 -10.365 5.583 1.00 42.25 H new TER 3165 THR A 191