USER MOD reduce.3.24.130724 H: found=0, std=0, add=1031, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1027 hydrogens (5 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 113 SER OG : rot -86:sc= -3.74! USER MOD Set 1.2: A 116 HIS : no HD1:sc= -12.1! C(o=-16!,f=-23!) USER MOD Set 2.1: A 88 TYR OH : rot -74:sc= -2.62! USER MOD Set 2.2: A 90 SER OG : rot -116:sc= 0.201 USER MOD Set 3.1: A 72 SER OG : rot 180:sc= -1.88! USER MOD Set 3.2: A 75 THR OG1 : rot 142:sc= -0.523! USER MOD Set 4.1: A 55 HIS :FLIP no HD1:sc= -0.861 F(o=-4.7,f=-4.2) USER MOD Set 4.2: A 57 GLN : amide:sc= -3.34! C(o=-4.2!,f=-4.2!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -178:sc= -0.352 (180deg=-0.381) USER MOD Single : A 29 TYR OH : rot -107:sc= 0.161 USER MOD Single : A 30 CYS SG : rot 55:sc= -0.637 USER MOD Single : A 31 SER OG : rot -49:sc= -0.592! USER MOD Single : A 32 ASN : amide:sc=-0.00333 X(o=-0.0033,f=-0.18) USER MOD Single : A 35 HIS : no HE2:sc= -6.63! C(o=-6.6!,f=-15!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -140:sc= -3.09! USER MOD Single : A 52 SER OG : rot -61:sc= 1.1 USER MOD Single : A 54 GLN : amide:sc= -8.36! C(o=-8.4!,f=-10!) USER MOD Single : A 59 GLN :FLIP amide:sc= -0.0188 F(o=-1,f=-0.019) USER MOD Single : A 61 SER OG : rot -55:sc= 0.671 USER MOD Single : A 64 SER OG : rot 73:sc= 0.774 USER MOD Single : A 69 TYR OH : rot 150:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 175:sc= -3.46! (180deg=-3.81!) USER MOD Single : A 73 THR OG1 : rot 166:sc= -1.82 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl -159:sc= -5.13 (180deg=-8.09!) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.0959 USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot 67:sc= 1.06 USER MOD Single : A 94 ASN :FLIP amide:sc= -4.51! C(o=-6.7!,f=-4.5!) USER MOD Single : A 97 CYS SG : rot 55:sc= -2.03 USER MOD Single : A 106 ASN : amide:sc= -1.33 K(o=-1.3,f=-5!) USER MOD Single : A 107 HIS : no HD1:sc= -3.66! C(o=-3.7!,f=-3.2!) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 ASN :FLIP amide:sc= -0.0512 F(o=-1.4,f=-0.051) USER MOD Single : A 110 THR OG1 : rot -75:sc= 0.00687 USER MOD Single : A 111 TYR OH : rot 5:sc= -4.77! USER MOD Single : A 114 LYS NZ :NH3+ 155:sc= -2.09 (180deg=-2.9!) USER MOD Single : A 115 LYS NZ :NH3+ 147:sc= -0.538 (180deg=-1.93!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= -0.384 X(o=-0.38,f=-0.0053) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 ASN : amide:sc= -0.956 K(o=-0.96,f=-3.3!) USER MOD Single : A 130 SER OG : rot 74:sc= 0.995 USER MOD Single : A 131 CYS SG : rot -59:sc= -0.11! USER MOD Single : A 132 LYS NZ :NH3+ 144:sc= -1.58! (180deg=-3.11!) USER MOD Single : A 137 THR OG1 : rot 81:sc= 0.414 USER MOD Single : A 138 HIS : no HD1:sc= -5.24! C(o=-5.2!,f=-8.8!) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN :FLIP amide:sc= -0.965 F(o=-2!,f=-0.97) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 SER OG : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot -60:sc= 0.803 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 24 -7.816 -5.880 15.166 1.00 0.00 N ATOM 2 CA LYS A 24 -6.883 -5.817 14.054 1.00 0.00 C ATOM 3 C LYS A 24 -6.950 -7.124 13.262 1.00 0.00 C ATOM 4 O LYS A 24 -5.996 -7.901 13.257 1.00 0.00 O ATOM 5 CB LYS A 24 -5.478 -5.472 14.553 1.00 0.00 C ATOM 6 CG LYS A 24 -5.514 -4.281 15.514 1.00 0.00 C ATOM 7 CD LYS A 24 -4.970 -4.670 16.890 1.00 0.00 C ATOM 8 CE LYS A 24 -5.380 -3.646 17.950 1.00 0.00 C ATOM 9 NZ LYS A 24 -5.998 -4.323 19.112 1.00 0.00 N ATOM 0 HA LYS A 24 -7.160 -5.015 13.370 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.044 -6.336 15.056 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -4.834 -5.240 13.705 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.924 -3.461 15.104 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -6.538 -3.920 15.613 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.344 -5.656 17.168 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -3.883 -4.741 16.849 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -4.507 -3.079 18.274 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -6.083 -2.932 17.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -6.271 -3.614 19.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -6.843 -4.844 18.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -5.316 -4.987 19.530 1.00 0.00 H new ATOM 23 N PRO A 25 -8.116 -7.332 12.594 1.00 0.00 N ATOM 24 CA PRO A 25 -8.321 -8.531 11.800 1.00 0.00 C ATOM 25 C PRO A 25 -7.541 -8.458 10.486 1.00 0.00 C ATOM 26 O PRO A 25 -6.904 -9.431 10.083 1.00 0.00 O ATOM 27 CB PRO A 25 -9.824 -8.616 11.595 1.00 0.00 C ATOM 28 CG PRO A 25 -10.363 -7.223 11.880 1.00 0.00 C ATOM 29 CD PRO A 25 -9.267 -6.434 12.577 1.00 0.00 C ATOM 0 HA PRO A 25 -7.949 -9.430 12.292 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.062 -8.926 10.578 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -10.269 -9.352 12.265 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -10.658 -6.731 10.953 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.252 -7.279 12.508 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -9.042 -5.512 12.042 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -9.564 -6.152 13.587 1.00 0.00 H new ATOM 37 N LYS A 26 -7.616 -7.296 9.854 1.00 0.00 N ATOM 38 CA LYS A 26 -6.925 -7.084 8.594 1.00 0.00 C ATOM 39 C LYS A 26 -5.624 -6.322 8.852 1.00 0.00 C ATOM 40 O LYS A 26 -5.583 -5.423 9.691 1.00 0.00 O ATOM 41 CB LYS A 26 -7.850 -6.398 7.585 1.00 0.00 C ATOM 42 CG LYS A 26 -7.043 -5.699 6.489 1.00 0.00 C ATOM 43 CD LYS A 26 -6.228 -6.710 5.679 1.00 0.00 C ATOM 44 CE LYS A 26 -4.814 -6.189 5.415 1.00 0.00 C ATOM 45 NZ LYS A 26 -4.682 -5.735 4.013 1.00 0.00 N ATOM 0 H LYS A 26 -8.145 -6.492 10.191 1.00 0.00 H new ATOM 0 HA LYS A 26 -6.651 -8.038 8.144 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.516 -7.135 7.137 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -8.479 -5.671 8.099 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -7.717 -5.156 5.827 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.375 -4.964 6.937 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.176 -7.656 6.218 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.728 -6.910 4.732 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -4.591 -5.365 6.093 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -4.087 -6.975 5.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -3.707 -5.416 3.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -4.907 -6.521 3.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -5.339 -4.948 3.840 1.00 0.00 H new ATOM 59 N LEU A 27 -4.593 -6.709 8.116 1.00 0.00 N ATOM 60 CA LEU A 27 -3.294 -6.073 8.255 1.00 0.00 C ATOM 61 C LEU A 27 -2.342 -6.631 7.196 1.00 0.00 C ATOM 62 O LEU A 27 -1.987 -7.809 7.233 1.00 0.00 O ATOM 63 CB LEU A 27 -2.776 -6.221 9.687 1.00 0.00 C ATOM 64 CG LEU A 27 -2.210 -7.594 10.057 1.00 0.00 C ATOM 65 CD1 LEU A 27 -0.780 -7.756 9.537 1.00 0.00 C ATOM 66 CD2 LEU A 27 -2.302 -7.836 11.565 1.00 0.00 C ATOM 0 H LEU A 27 -4.631 -7.455 7.421 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.374 -5.000 8.079 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -1.999 -5.474 9.850 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -3.591 -5.989 10.373 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.818 -8.357 9.570 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.402 -8.740 9.814 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.774 -7.657 8.452 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.144 -6.987 9.975 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.893 -8.818 11.801 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.733 -7.070 12.092 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -3.345 -7.792 11.878 1.00 0.00 H new ATOM 78 N LEU A 28 -1.955 -5.760 6.276 1.00 0.00 N ATOM 79 CA LEU A 28 -1.050 -6.151 5.208 1.00 0.00 C ATOM 80 C LEU A 28 0.283 -6.596 5.812 1.00 0.00 C ATOM 81 O LEU A 28 0.551 -6.345 6.986 1.00 0.00 O ATOM 82 CB LEU A 28 -0.915 -5.025 4.181 1.00 0.00 C ATOM 83 CG LEU A 28 -1.261 -5.391 2.736 1.00 0.00 C ATOM 84 CD1 LEU A 28 -1.047 -4.197 1.802 1.00 0.00 C ATOM 85 CD2 LEU A 28 -0.479 -6.623 2.279 1.00 0.00 C ATOM 0 H LEU A 28 -2.252 -4.784 6.248 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.452 -7.003 4.661 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.557 -4.200 4.490 1.00 0.00 H new ATOM 0 HB3 LEU A 28 0.111 -4.658 4.206 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.319 -5.648 2.693 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.300 -4.484 0.781 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.685 -3.371 2.116 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -0.003 -3.885 1.843 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.744 -6.861 1.249 1.00 0.00 H new ATOM 0 HD22 LEU A 28 0.590 -6.419 2.341 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.725 -7.469 2.921 1.00 0.00 H new ATOM 97 N TYR A 29 1.084 -7.248 4.982 1.00 0.00 N ATOM 98 CA TYR A 29 2.383 -7.730 5.420 1.00 0.00 C ATOM 99 C TYR A 29 3.318 -7.945 4.228 1.00 0.00 C ATOM 100 O TYR A 29 2.949 -8.602 3.255 1.00 0.00 O ATOM 101 CB TYR A 29 2.126 -9.076 6.100 1.00 0.00 C ATOM 102 CG TYR A 29 3.375 -9.949 6.245 1.00 0.00 C ATOM 103 CD1 TYR A 29 4.316 -9.651 7.208 1.00 0.00 C ATOM 104 CD2 TYR A 29 3.559 -11.033 5.411 1.00 0.00 C ATOM 105 CE1 TYR A 29 5.491 -10.473 7.345 1.00 0.00 C ATOM 106 CE2 TYR A 29 4.734 -11.855 5.547 1.00 0.00 C ATOM 107 CZ TYR A 29 5.642 -11.534 6.507 1.00 0.00 C ATOM 108 OH TYR A 29 6.752 -12.309 6.636 1.00 0.00 O ATOM 0 H TYR A 29 0.859 -7.454 4.009 1.00 0.00 H new ATOM 0 HA TYR A 29 2.855 -7.008 6.086 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.704 -8.897 7.089 1.00 0.00 H new ATOM 0 HB3 TYR A 29 1.377 -9.623 5.528 1.00 0.00 H new ATOM 0 HD1 TYR A 29 4.172 -8.802 7.859 1.00 0.00 H new ATOM 0 HD2 TYR A 29 2.822 -11.265 4.656 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.235 -10.252 8.096 1.00 0.00 H new ATOM 0 HE2 TYR A 29 4.890 -12.707 4.901 1.00 0.00 H new ATOM 0 HH TYR A 29 7.358 -12.140 5.884 1.00 0.00 H new ATOM 118 N CYS A 30 4.511 -7.379 4.343 1.00 0.00 N ATOM 119 CA CYS A 30 5.501 -7.501 3.287 1.00 0.00 C ATOM 120 C CYS A 30 6.049 -8.929 3.304 1.00 0.00 C ATOM 121 O CYS A 30 6.066 -9.579 4.348 1.00 0.00 O ATOM 122 CB CYS A 30 6.614 -6.461 3.433 1.00 0.00 C ATOM 123 SG CYS A 30 5.912 -4.867 3.995 1.00 0.00 S ATOM 0 H CYS A 30 4.814 -6.835 5.151 1.00 0.00 H new ATOM 0 HA CYS A 30 5.033 -7.304 2.322 1.00 0.00 H new ATOM 0 HB2 CYS A 30 7.359 -6.812 4.147 1.00 0.00 H new ATOM 0 HB3 CYS A 30 7.125 -6.327 2.480 1.00 0.00 H new ATOM 0 HG CYS A 30 5.233 -5.053 5.088 1.00 0.00 H new ATOM 129 N SER A 31 6.483 -9.377 2.135 1.00 0.00 N ATOM 130 CA SER A 31 7.030 -10.716 2.002 1.00 0.00 C ATOM 131 C SER A 31 8.263 -10.869 2.895 1.00 0.00 C ATOM 132 O SER A 31 8.153 -11.300 4.042 1.00 0.00 O ATOM 133 CB SER A 31 7.387 -11.024 0.546 1.00 0.00 C ATOM 134 OG SER A 31 8.447 -10.198 0.071 1.00 0.00 O ATOM 0 H SER A 31 6.467 -8.836 1.271 1.00 0.00 H new ATOM 0 HA SER A 31 6.269 -11.429 2.319 1.00 0.00 H new ATOM 0 HB2 SER A 31 7.676 -12.071 0.457 1.00 0.00 H new ATOM 0 HB3 SER A 31 6.507 -10.881 -0.081 1.00 0.00 H new ATOM 0 HG SER A 31 8.254 -9.262 0.287 1.00 0.00 H new ATOM 140 N ASN A 32 9.408 -10.508 2.335 1.00 0.00 N ATOM 141 CA ASN A 32 10.660 -10.599 3.066 1.00 0.00 C ATOM 142 C ASN A 32 10.765 -9.423 4.038 1.00 0.00 C ATOM 143 O ASN A 32 11.026 -9.615 5.225 1.00 0.00 O ATOM 144 CB ASN A 32 11.858 -10.536 2.117 1.00 0.00 C ATOM 145 CG ASN A 32 12.746 -11.773 2.271 1.00 0.00 C ATOM 146 OD1 ASN A 32 12.631 -12.746 1.545 1.00 0.00 O ATOM 147 ND2 ASN A 32 13.636 -11.680 3.255 1.00 0.00 N ATOM 0 H ASN A 32 9.495 -10.152 1.383 1.00 0.00 H new ATOM 0 HA ASN A 32 10.671 -11.550 3.598 1.00 0.00 H new ATOM 0 HB2 ASN A 32 11.507 -10.462 1.088 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.441 -9.638 2.321 1.00 0.00 H new ATOM 0 HD21 ASN A 32 14.276 -12.453 3.439 1.00 0.00 H new ATOM 0 HD22 ASN A 32 13.679 -10.836 3.826 1.00 0.00 H new ATOM 154 N GLY A 33 10.557 -8.231 3.499 1.00 0.00 N ATOM 155 CA GLY A 33 10.625 -7.023 4.305 1.00 0.00 C ATOM 156 C GLY A 33 10.127 -7.284 5.728 1.00 0.00 C ATOM 157 O GLY A 33 10.718 -6.804 6.694 1.00 0.00 O ATOM 0 H GLY A 33 10.341 -8.075 2.514 1.00 0.00 H new ATOM 0 HA2 GLY A 33 11.652 -6.660 4.336 1.00 0.00 H new ATOM 0 HA3 GLY A 33 10.024 -6.239 3.844 1.00 0.00 H new ATOM 161 N GLY A 34 9.045 -8.045 5.812 1.00 0.00 N ATOM 162 CA GLY A 34 8.461 -8.376 7.100 1.00 0.00 C ATOM 163 C GLY A 34 7.790 -7.152 7.729 1.00 0.00 C ATOM 164 O GLY A 34 7.282 -7.224 8.846 1.00 0.00 O ATOM 0 H GLY A 34 8.558 -8.442 5.008 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.728 -9.174 6.977 1.00 0.00 H new ATOM 0 HA3 GLY A 34 9.235 -8.754 7.768 1.00 0.00 H new ATOM 168 N HIS A 35 7.811 -6.058 6.982 1.00 0.00 N ATOM 169 CA HIS A 35 7.211 -4.821 7.452 1.00 0.00 C ATOM 170 C HIS A 35 5.689 -4.906 7.320 1.00 0.00 C ATOM 171 O HIS A 35 5.173 -5.719 6.555 1.00 0.00 O ATOM 172 CB HIS A 35 7.803 -3.616 6.718 1.00 0.00 C ATOM 173 CG HIS A 35 9.192 -3.241 7.175 1.00 0.00 C ATOM 174 ND1 HIS A 35 10.292 -4.058 6.979 1.00 0.00 N ATOM 175 CD2 HIS A 35 9.649 -2.129 7.819 1.00 0.00 C ATOM 176 CE1 HIS A 35 11.357 -3.455 7.488 1.00 0.00 C ATOM 177 NE2 HIS A 35 10.956 -2.259 8.008 1.00 0.00 N ATOM 0 H HIS A 35 8.234 -6.002 6.055 1.00 0.00 H new ATOM 0 HA HIS A 35 7.442 -4.679 8.508 1.00 0.00 H new ATOM 0 HB2 HIS A 35 7.829 -3.831 5.650 1.00 0.00 H new ATOM 0 HB3 HIS A 35 7.143 -2.760 6.855 1.00 0.00 H new ATOM 0 HD1 HIS A 35 10.284 -4.969 6.521 1.00 0.00 H new ATOM 0 HD2 HIS A 35 9.048 -1.285 8.124 1.00 0.00 H new ATOM 0 HE1 HIS A 35 12.365 -3.842 7.491 1.00 0.00 H new ATOM 185 N PHE A 36 5.012 -4.054 8.077 1.00 0.00 N ATOM 186 CA PHE A 36 3.560 -4.023 8.054 1.00 0.00 C ATOM 187 C PHE A 36 3.045 -2.594 7.866 1.00 0.00 C ATOM 188 O PHE A 36 2.950 -1.833 8.828 1.00 0.00 O ATOM 189 CB PHE A 36 3.080 -4.551 9.407 1.00 0.00 C ATOM 190 CG PHE A 36 3.488 -5.998 9.690 1.00 0.00 C ATOM 191 CD1 PHE A 36 4.764 -6.284 10.063 1.00 0.00 C ATOM 192 CD2 PHE A 36 2.575 -6.999 9.568 1.00 0.00 C ATOM 193 CE1 PHE A 36 5.143 -7.627 10.326 1.00 0.00 C ATOM 194 CE2 PHE A 36 2.954 -8.342 9.831 1.00 0.00 C ATOM 195 CZ PHE A 36 4.230 -8.628 10.205 1.00 0.00 C ATOM 0 H PHE A 36 5.443 -3.380 8.710 1.00 0.00 H new ATOM 0 HA PHE A 36 3.188 -4.627 7.226 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.476 -3.912 10.196 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.993 -4.475 9.450 1.00 0.00 H new ATOM 0 HD1 PHE A 36 5.489 -5.490 10.159 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.562 -6.772 9.271 1.00 0.00 H new ATOM 0 HE1 PHE A 36 6.157 -7.854 10.622 1.00 0.00 H new ATOM 0 HE2 PHE A 36 2.229 -9.136 9.734 1.00 0.00 H new ATOM 0 HZ PHE A 36 4.518 -9.649 10.406 1.00 0.00 H new ATOM 205 N LEU A 37 2.727 -2.273 6.620 1.00 0.00 N ATOM 206 CA LEU A 37 2.224 -0.949 6.294 1.00 0.00 C ATOM 207 C LEU A 37 1.266 -0.487 7.394 1.00 0.00 C ATOM 208 O LEU A 37 0.731 -1.305 8.141 1.00 0.00 O ATOM 209 CB LEU A 37 1.604 -0.941 4.895 1.00 0.00 C ATOM 210 CG LEU A 37 2.536 -0.536 3.751 1.00 0.00 C ATOM 211 CD1 LEU A 37 2.242 -1.351 2.490 1.00 0.00 C ATOM 212 CD2 LEU A 37 2.462 0.970 3.491 1.00 0.00 C ATOM 0 H LEU A 37 2.808 -2.907 5.825 1.00 0.00 H new ATOM 0 HA LEU A 37 3.041 -0.229 6.259 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.216 -1.938 4.685 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.752 -0.262 4.901 1.00 0.00 H new ATOM 0 HG LEU A 37 3.560 -0.761 4.048 1.00 0.00 H new ATOM 0 HD11 LEU A 37 2.918 -1.044 1.692 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.386 -2.411 2.700 1.00 0.00 H new ATOM 0 HD13 LEU A 37 1.212 -1.180 2.178 1.00 0.00 H new ATOM 0 HD21 LEU A 37 3.134 1.232 2.673 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.441 1.243 3.224 1.00 0.00 H new ATOM 0 HD23 LEU A 37 2.758 1.510 4.391 1.00 0.00 H new ATOM 224 N ARG A 38 1.079 0.823 7.459 1.00 0.00 N ATOM 225 CA ARG A 38 0.195 1.404 8.455 1.00 0.00 C ATOM 226 C ARG A 38 -0.545 2.609 7.870 1.00 0.00 C ATOM 227 O ARG A 38 -0.104 3.193 6.881 1.00 0.00 O ATOM 228 CB ARG A 38 0.976 1.847 9.694 1.00 0.00 C ATOM 229 CG ARG A 38 2.334 2.434 9.305 1.00 0.00 C ATOM 230 CD ARG A 38 3.478 1.620 9.914 1.00 0.00 C ATOM 231 NE ARG A 38 3.533 1.842 11.377 1.00 0.00 N ATOM 232 CZ ARG A 38 4.039 2.942 11.951 1.00 0.00 C ATOM 233 NH1 ARG A 38 4.536 3.927 11.190 1.00 0.00 N ATOM 234 NH2 ARG A 38 4.048 3.057 13.286 1.00 0.00 N ATOM 0 H ARG A 38 1.525 1.499 6.838 1.00 0.00 H new ATOM 0 HA ARG A 38 -0.524 0.638 8.747 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.399 2.590 10.246 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.121 0.997 10.360 1.00 0.00 H new ATOM 0 HG2 ARG A 38 2.431 2.448 8.219 1.00 0.00 H new ATOM 0 HG3 ARG A 38 2.398 3.468 9.644 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.334 0.560 9.704 1.00 0.00 H new ATOM 0 HD3 ARG A 38 4.425 1.910 9.458 1.00 0.00 H new ATOM 0 HE ARG A 38 3.163 1.112 11.986 1.00 0.00 H new ATOM 0 HH11 ARG A 38 4.529 3.839 10.174 1.00 0.00 H new ATOM 0 HH12 ARG A 38 4.921 4.764 11.627 1.00 0.00 H new ATOM 0 HH21 ARG A 38 3.670 2.307 13.865 1.00 0.00 H new ATOM 0 HH22 ARG A 38 4.433 3.894 13.723 1.00 0.00 H new ATOM 248 N ILE A 39 -1.658 2.945 8.505 1.00 0.00 N ATOM 249 CA ILE A 39 -2.463 4.070 8.060 1.00 0.00 C ATOM 250 C ILE A 39 -2.811 4.950 9.262 1.00 0.00 C ATOM 251 O ILE A 39 -3.586 4.546 10.128 1.00 0.00 O ATOM 252 CB ILE A 39 -3.687 3.579 7.283 1.00 0.00 C ATOM 253 CG1 ILE A 39 -3.953 4.463 6.063 1.00 0.00 C ATOM 254 CG2 ILE A 39 -4.911 3.476 8.195 1.00 0.00 C ATOM 255 CD1 ILE A 39 -4.329 3.618 4.844 1.00 0.00 C ATOM 0 H ILE A 39 -2.021 2.458 9.324 1.00 0.00 H new ATOM 0 HA ILE A 39 -1.899 4.690 7.363 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.477 2.575 6.913 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -4.757 5.164 6.286 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.066 5.056 5.839 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -5.766 3.125 7.618 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -4.705 2.773 9.002 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -5.135 4.456 8.616 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.513 4.271 3.991 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.513 2.935 4.609 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -5.230 3.045 5.063 1.00 0.00 H new ATOM 267 N LEU A 40 -2.221 6.136 9.276 1.00 0.00 N ATOM 268 CA LEU A 40 -2.459 7.077 10.358 1.00 0.00 C ATOM 269 C LEU A 40 -3.681 7.935 10.023 1.00 0.00 C ATOM 270 O LEU A 40 -3.859 8.347 8.878 1.00 0.00 O ATOM 271 CB LEU A 40 -1.197 7.891 10.647 1.00 0.00 C ATOM 272 CG LEU A 40 0.134 7.176 10.402 1.00 0.00 C ATOM 273 CD1 LEU A 40 1.251 8.181 10.112 1.00 0.00 C ATOM 274 CD2 LEU A 40 0.483 6.252 11.570 1.00 0.00 C ATOM 0 H LEU A 40 -1.579 6.467 8.556 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.686 6.545 11.282 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.221 8.792 10.033 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.227 8.214 11.688 1.00 0.00 H new ATOM 0 HG LEU A 40 0.027 6.549 9.517 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.186 7.647 9.942 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.997 8.761 9.225 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.367 8.852 10.963 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.433 5.756 11.370 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.565 6.838 12.486 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.300 5.502 11.687 1.00 0.00 H new ATOM 286 N PRO A 41 -4.512 8.185 11.070 1.00 0.00 N ATOM 287 CA PRO A 41 -5.712 8.986 10.898 1.00 0.00 C ATOM 288 C PRO A 41 -5.366 10.471 10.772 1.00 0.00 C ATOM 289 O PRO A 41 -6.250 11.325 10.831 1.00 0.00 O ATOM 290 CB PRO A 41 -6.570 8.676 12.113 1.00 0.00 C ATOM 291 CG PRO A 41 -5.629 8.077 13.146 1.00 0.00 C ATOM 292 CD PRO A 41 -4.333 7.713 12.440 1.00 0.00 C ATOM 0 HA PRO A 41 -6.248 8.749 9.979 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -7.046 9.579 12.495 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.368 7.978 11.860 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -5.439 8.790 13.948 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -6.076 7.194 13.603 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -3.476 8.191 12.915 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -4.155 6.638 12.468 1.00 0.00 H new ATOM 300 N ASP A 42 -4.079 10.734 10.603 1.00 0.00 N ATOM 301 CA ASP A 42 -3.606 12.101 10.469 1.00 0.00 C ATOM 302 C ASP A 42 -3.475 12.448 8.985 1.00 0.00 C ATOM 303 O ASP A 42 -3.641 13.603 8.597 1.00 0.00 O ATOM 304 CB ASP A 42 -2.231 12.274 11.118 1.00 0.00 C ATOM 305 CG ASP A 42 -2.244 12.945 12.493 1.00 0.00 C ATOM 306 OD1 ASP A 42 -2.600 14.142 12.537 1.00 0.00 O ATOM 307 OD2 ASP A 42 -1.899 12.245 13.470 1.00 0.00 O ATOM 0 H ASP A 42 -3.349 10.023 10.556 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.323 12.756 10.963 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -1.765 11.293 11.214 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -1.602 12.862 10.450 1.00 0.00 H new ATOM 312 N GLY A 43 -3.178 11.427 8.195 1.00 0.00 N ATOM 313 CA GLY A 43 -3.022 11.609 6.762 1.00 0.00 C ATOM 314 C GLY A 43 -1.602 11.258 6.315 1.00 0.00 C ATOM 315 O GLY A 43 -1.154 11.698 5.257 1.00 0.00 O ATOM 0 H GLY A 43 -3.041 10.470 8.520 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -3.739 10.982 6.232 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -3.245 12.642 6.497 1.00 0.00 H new ATOM 319 N THR A 44 -0.932 10.471 7.144 1.00 0.00 N ATOM 320 CA THR A 44 0.428 10.056 6.848 1.00 0.00 C ATOM 321 C THR A 44 0.531 8.530 6.841 1.00 0.00 C ATOM 322 O THR A 44 0.047 7.867 7.758 1.00 0.00 O ATOM 323 CB THR A 44 1.358 10.724 7.863 1.00 0.00 C ATOM 324 OG1 THR A 44 1.709 11.962 7.252 1.00 0.00 O ATOM 325 CG2 THR A 44 2.691 9.988 8.008 1.00 0.00 C ATOM 0 H THR A 44 -1.306 10.110 8.021 1.00 0.00 H new ATOM 0 HA THR A 44 0.730 10.375 5.850 1.00 0.00 H new ATOM 0 HB THR A 44 0.862 10.771 8.833 1.00 0.00 H new ATOM 0 HG1 THR A 44 2.310 12.460 7.844 1.00 0.00 H new ATOM 0 HG21 THR A 44 3.313 10.503 8.740 1.00 0.00 H new ATOM 0 HG22 THR A 44 2.508 8.967 8.342 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.203 9.969 7.046 1.00 0.00 H new ATOM 333 N VAL A 45 1.166 8.016 5.798 1.00 0.00 N ATOM 334 CA VAL A 45 1.339 6.580 5.660 1.00 0.00 C ATOM 335 C VAL A 45 2.810 6.224 5.880 1.00 0.00 C ATOM 336 O VAL A 45 3.670 7.104 5.898 1.00 0.00 O ATOM 337 CB VAL A 45 0.809 6.117 4.302 1.00 0.00 C ATOM 338 CG1 VAL A 45 0.832 7.260 3.286 1.00 0.00 C ATOM 339 CG2 VAL A 45 1.597 4.911 3.787 1.00 0.00 C ATOM 0 H VAL A 45 1.567 8.569 5.040 1.00 0.00 H new ATOM 0 HA VAL A 45 0.760 6.052 6.417 1.00 0.00 H new ATOM 0 HB VAL A 45 -0.228 5.807 4.436 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.450 6.904 2.329 1.00 0.00 H new ATOM 0 HG12 VAL A 45 0.207 8.078 3.644 1.00 0.00 H new ATOM 0 HG13 VAL A 45 1.855 7.614 3.159 1.00 0.00 H new ATOM 0 HG21 VAL A 45 1.199 4.602 2.820 1.00 0.00 H new ATOM 0 HG22 VAL A 45 2.647 5.182 3.678 1.00 0.00 H new ATOM 0 HG23 VAL A 45 1.507 4.088 4.496 1.00 0.00 H new ATOM 349 N ASP A 46 3.056 4.932 6.043 1.00 0.00 N ATOM 350 CA ASP A 46 4.409 4.449 6.262 1.00 0.00 C ATOM 351 C ASP A 46 4.375 2.937 6.493 1.00 0.00 C ATOM 352 O ASP A 46 3.351 2.294 6.270 1.00 0.00 O ATOM 353 CB ASP A 46 5.034 5.102 7.496 1.00 0.00 C ATOM 354 CG ASP A 46 4.078 5.957 8.330 1.00 0.00 C ATOM 355 OD1 ASP A 46 2.938 5.490 8.542 1.00 0.00 O ATOM 356 OD2 ASP A 46 4.508 7.058 8.737 1.00 0.00 O ATOM 0 H ASP A 46 2.341 4.205 6.028 1.00 0.00 H new ATOM 0 HA ASP A 46 5.003 4.699 5.383 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.447 4.319 8.133 1.00 0.00 H new ATOM 0 HB3 ASP A 46 5.869 5.725 7.175 1.00 0.00 H new ATOM 361 N GLY A 47 5.508 2.413 6.937 1.00 0.00 N ATOM 362 CA GLY A 47 5.621 0.989 7.201 1.00 0.00 C ATOM 363 C GLY A 47 6.317 0.733 8.539 1.00 0.00 C ATOM 364 O GLY A 47 7.097 1.562 9.006 1.00 0.00 O ATOM 0 H GLY A 47 6.356 2.949 7.121 1.00 0.00 H new ATOM 0 HA2 GLY A 47 4.629 0.538 7.211 1.00 0.00 H new ATOM 0 HA3 GLY A 47 6.181 0.510 6.398 1.00 0.00 H new ATOM 368 N THR A 48 6.010 -0.419 9.119 1.00 0.00 N ATOM 369 CA THR A 48 6.596 -0.795 10.394 1.00 0.00 C ATOM 370 C THR A 48 7.111 -2.234 10.340 1.00 0.00 C ATOM 371 O THR A 48 6.400 -3.136 9.898 1.00 0.00 O ATOM 372 CB THR A 48 5.547 -0.564 11.483 1.00 0.00 C ATOM 373 OG1 THR A 48 5.735 0.796 11.864 1.00 0.00 O ATOM 374 CG2 THR A 48 5.845 -1.354 12.759 1.00 0.00 C ATOM 0 H THR A 48 5.363 -1.104 8.729 1.00 0.00 H new ATOM 0 HA THR A 48 7.466 -0.181 10.626 1.00 0.00 H new ATOM 0 HB THR A 48 4.564 -0.843 11.105 1.00 0.00 H new ATOM 0 HG1 THR A 48 5.644 0.879 12.836 1.00 0.00 H new ATOM 0 HG21 THR A 48 5.071 -1.155 13.500 1.00 0.00 H new ATOM 0 HG22 THR A 48 5.863 -2.420 12.531 1.00 0.00 H new ATOM 0 HG23 THR A 48 6.814 -1.051 13.156 1.00 0.00 H new ATOM 382 N ARG A 49 8.343 -2.406 10.797 1.00 0.00 N ATOM 383 CA ARG A 49 8.961 -3.721 10.807 1.00 0.00 C ATOM 384 C ARG A 49 7.967 -4.771 11.307 1.00 0.00 C ATOM 385 O ARG A 49 7.838 -5.841 10.714 1.00 0.00 O ATOM 386 CB ARG A 49 10.203 -3.739 11.700 1.00 0.00 C ATOM 387 CG ARG A 49 10.940 -5.075 11.588 1.00 0.00 C ATOM 388 CD ARG A 49 11.047 -5.759 12.952 1.00 0.00 C ATOM 389 NE ARG A 49 12.314 -6.518 13.040 1.00 0.00 N ATOM 390 CZ ARG A 49 12.517 -7.548 13.872 1.00 0.00 C ATOM 391 NH1 ARG A 49 11.537 -7.949 14.693 1.00 0.00 N ATOM 392 NH2 ARG A 49 13.700 -8.178 13.883 1.00 0.00 N ATOM 0 H ARG A 49 8.930 -1.656 11.163 1.00 0.00 H new ATOM 0 HA ARG A 49 9.259 -3.955 9.785 1.00 0.00 H new ATOM 0 HB2 ARG A 49 10.871 -2.926 11.416 1.00 0.00 H new ATOM 0 HB3 ARG A 49 9.913 -3.566 12.736 1.00 0.00 H new ATOM 0 HG2 ARG A 49 10.414 -5.727 10.891 1.00 0.00 H new ATOM 0 HG3 ARG A 49 11.938 -4.911 11.180 1.00 0.00 H new ATOM 0 HD2 ARG A 49 11.004 -5.014 13.746 1.00 0.00 H new ATOM 0 HD3 ARG A 49 10.201 -6.430 13.099 1.00 0.00 H new ATOM 0 HE ARG A 49 13.081 -6.239 12.429 1.00 0.00 H new ATOM 0 HH11 ARG A 49 10.637 -7.470 14.684 1.00 0.00 H new ATOM 0 HH12 ARG A 49 11.691 -8.733 15.327 1.00 0.00 H new ATOM 0 HH21 ARG A 49 14.446 -7.873 13.258 1.00 0.00 H new ATOM 0 HH22 ARG A 49 13.854 -8.962 14.517 1.00 0.00 H new ATOM 406 N ASP A 50 7.288 -4.428 12.392 1.00 0.00 N ATOM 407 CA ASP A 50 6.310 -5.328 12.978 1.00 0.00 C ATOM 408 C ASP A 50 5.091 -4.523 13.432 1.00 0.00 C ATOM 409 O ASP A 50 5.180 -3.729 14.368 1.00 0.00 O ATOM 410 CB ASP A 50 6.884 -6.046 14.201 1.00 0.00 C ATOM 411 CG ASP A 50 7.350 -7.481 13.949 1.00 0.00 C ATOM 412 OD1 ASP A 50 7.782 -7.745 12.806 1.00 0.00 O ATOM 413 OD2 ASP A 50 7.264 -8.282 14.904 1.00 0.00 O ATOM 0 H ASP A 50 7.396 -3.539 12.880 1.00 0.00 H new ATOM 0 HA ASP A 50 6.036 -6.065 12.223 1.00 0.00 H new ATOM 0 HB2 ASP A 50 7.726 -5.468 14.581 1.00 0.00 H new ATOM 0 HB3 ASP A 50 6.127 -6.058 14.985 1.00 0.00 H new ATOM 418 N ARG A 51 3.980 -4.756 12.749 1.00 0.00 N ATOM 419 CA ARG A 51 2.744 -4.062 13.070 1.00 0.00 C ATOM 420 C ARG A 51 2.702 -3.715 14.560 1.00 0.00 C ATOM 421 O ARG A 51 2.782 -4.602 15.409 1.00 0.00 O ATOM 422 CB ARG A 51 1.525 -4.916 12.718 1.00 0.00 C ATOM 423 CG ARG A 51 1.538 -6.236 13.491 1.00 0.00 C ATOM 424 CD ARG A 51 1.439 -7.430 12.540 1.00 0.00 C ATOM 425 NE ARG A 51 0.325 -8.314 12.952 1.00 0.00 N ATOM 426 CZ ARG A 51 0.247 -9.616 12.645 1.00 0.00 C ATOM 427 NH1 ARG A 51 1.216 -10.193 11.921 1.00 0.00 N ATOM 428 NH2 ARG A 51 -0.801 -10.341 13.061 1.00 0.00 N ATOM 0 H ARG A 51 3.910 -5.416 11.974 1.00 0.00 H new ATOM 0 HA ARG A 51 2.715 -3.147 12.479 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.613 -4.365 12.947 1.00 0.00 H new ATOM 0 HB3 ARG A 51 1.515 -5.118 11.647 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.454 -6.309 14.078 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.706 -6.257 14.195 1.00 0.00 H new ATOM 0 HD2 ARG A 51 1.279 -7.081 11.520 1.00 0.00 H new ATOM 0 HD3 ARG A 51 2.376 -7.987 12.543 1.00 0.00 H new ATOM 0 HE ARG A 51 -0.430 -7.907 13.504 1.00 0.00 H new ATOM 0 HH11 ARG A 51 2.013 -9.641 11.604 1.00 0.00 H new ATOM 0 HH12 ARG A 51 1.157 -11.184 11.687 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -1.539 -9.902 13.611 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -0.860 -11.332 12.827 1.00 0.00 H new ATOM 442 N SER A 52 2.577 -2.425 14.832 1.00 0.00 N ATOM 443 CA SER A 52 2.523 -1.950 16.204 1.00 0.00 C ATOM 444 C SER A 52 2.382 -0.427 16.226 1.00 0.00 C ATOM 445 O SER A 52 3.311 0.280 16.615 1.00 0.00 O ATOM 446 CB SER A 52 3.767 -2.380 16.984 1.00 0.00 C ATOM 447 OG SER A 52 4.103 -1.448 18.008 1.00 0.00 O ATOM 0 H SER A 52 2.511 -1.693 14.125 1.00 0.00 H new ATOM 0 HA SER A 52 1.653 -2.395 16.686 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.596 -3.361 17.428 1.00 0.00 H new ATOM 0 HB3 SER A 52 4.608 -2.483 16.298 1.00 0.00 H new ATOM 0 HG SER A 52 4.292 -0.575 17.606 1.00 0.00 H new ATOM 453 N ASP A 53 1.214 0.034 15.805 1.00 0.00 N ATOM 454 CA ASP A 53 0.940 1.460 15.771 1.00 0.00 C ATOM 455 C ASP A 53 -0.511 1.707 16.191 1.00 0.00 C ATOM 456 O ASP A 53 -1.211 0.778 16.590 1.00 0.00 O ATOM 457 CB ASP A 53 1.126 2.024 14.361 1.00 0.00 C ATOM 458 CG ASP A 53 1.583 3.483 14.303 1.00 0.00 C ATOM 459 OD1 ASP A 53 2.016 3.985 15.363 1.00 0.00 O ATOM 460 OD2 ASP A 53 1.489 4.064 13.200 1.00 0.00 O ATOM 0 H ASP A 53 0.446 -0.555 15.484 1.00 0.00 H new ATOM 0 HA ASP A 53 1.635 1.952 16.451 1.00 0.00 H new ATOM 0 HB2 ASP A 53 1.855 1.409 13.833 1.00 0.00 H new ATOM 0 HB3 ASP A 53 0.183 1.933 13.822 1.00 0.00 H new ATOM 465 N GLN A 54 -0.918 2.963 16.086 1.00 0.00 N ATOM 466 CA GLN A 54 -2.272 3.343 16.450 1.00 0.00 C ATOM 467 C GLN A 54 -3.287 2.551 15.622 1.00 0.00 C ATOM 468 O GLN A 54 -4.359 2.205 16.114 1.00 0.00 O ATOM 469 CB GLN A 54 -2.483 4.849 16.281 1.00 0.00 C ATOM 470 CG GLN A 54 -2.878 5.189 14.842 1.00 0.00 C ATOM 471 CD GLN A 54 -1.732 4.889 13.874 1.00 0.00 C ATOM 472 OE1 GLN A 54 -0.562 4.998 14.203 1.00 0.00 O ATOM 473 NE2 GLN A 54 -2.131 4.504 12.665 1.00 0.00 N ATOM 0 H GLN A 54 -0.334 3.731 15.754 1.00 0.00 H new ATOM 0 HA GLN A 54 -2.425 3.104 17.502 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -3.260 5.190 16.965 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.569 5.380 16.546 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -3.759 4.614 14.557 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -3.149 6.243 14.775 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -3.127 4.433 12.455 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -1.441 4.279 11.948 1.00 0.00 H new ATOM 482 N HIS A 55 -2.911 2.287 14.380 1.00 0.00 N ATOM 483 CA HIS A 55 -3.774 1.542 13.479 1.00 0.00 C ATOM 484 C HIS A 55 -3.065 1.340 12.138 1.00 0.00 C ATOM 485 O HIS A 55 -2.899 2.288 11.371 1.00 0.00 O ATOM 486 CB HIS A 55 -5.132 2.232 13.334 1.00 0.00 C ATOM 487 CG HIS A 55 -6.267 1.503 14.013 1.00 0.00 C ATOM 488 ND1 HIS A 55 -6.972 1.806 15.141 1.00 0.00 N flip ATOM 489 CD2 HIS A 55 -6.789 0.314 13.533 1.00 0.00 C flip ATOM 490 CE1 HIS A 55 -7.877 0.855 15.338 1.00 0.00 C flip ATOM 491 NE2 HIS A 55 -7.765 -0.071 14.342 1.00 0.00 N flip ATOM 0 H HIS A 55 -2.020 2.576 13.976 1.00 0.00 H new ATOM 0 HA HIS A 55 -3.975 0.555 13.896 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -5.062 3.239 13.746 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -5.364 2.337 12.274 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -6.457 -0.211 12.649 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -8.585 0.820 16.153 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -8.333 -0.912 14.239 1.00 0.00 H new ATOM 499 N ILE A 56 -2.667 0.100 11.897 1.00 0.00 N ATOM 500 CA ILE A 56 -1.980 -0.238 10.662 1.00 0.00 C ATOM 501 C ILE A 56 -2.897 -1.102 9.793 1.00 0.00 C ATOM 502 O ILE A 56 -2.440 -1.740 8.846 1.00 0.00 O ATOM 503 CB ILE A 56 -0.627 -0.887 10.962 1.00 0.00 C ATOM 504 CG1 ILE A 56 -0.755 -2.410 11.041 1.00 0.00 C ATOM 505 CG2 ILE A 56 -0.005 -0.297 12.229 1.00 0.00 C ATOM 506 CD1 ILE A 56 -1.837 -2.818 12.042 1.00 0.00 C ATOM 0 H ILE A 56 -2.807 -0.683 12.536 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.756 0.664 10.092 1.00 0.00 H new ATOM 0 HB ILE A 56 0.050 -0.663 10.137 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.996 -2.810 10.056 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.200 -2.844 11.336 1.00 0.00 H new ATOM 0 HG21 ILE A 56 0.956 -0.776 12.420 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.143 0.775 12.096 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -0.670 -0.469 13.075 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.907 -3.905 12.079 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.580 -2.437 13.031 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.796 -2.403 11.731 1.00 0.00 H new ATOM 518 N GLN A 57 -4.174 -1.093 10.146 1.00 0.00 N ATOM 519 CA GLN A 57 -5.159 -1.867 9.410 1.00 0.00 C ATOM 520 C GLN A 57 -5.293 -1.335 7.982 1.00 0.00 C ATOM 521 O GLN A 57 -5.793 -0.231 7.771 1.00 0.00 O ATOM 522 CB GLN A 57 -6.510 -1.859 10.128 1.00 0.00 C ATOM 523 CG GLN A 57 -6.818 -3.229 10.734 1.00 0.00 C ATOM 524 CD GLN A 57 -7.882 -3.119 11.827 1.00 0.00 C ATOM 525 OE1 GLN A 57 -7.594 -2.879 12.988 1.00 0.00 O ATOM 526 NE2 GLN A 57 -9.125 -3.307 11.393 1.00 0.00 N ATOM 0 H GLN A 57 -4.549 -0.562 10.932 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.817 -2.901 9.361 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -6.504 -1.103 10.913 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -7.297 -1.583 9.426 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -7.163 -3.907 9.953 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -5.907 -3.659 11.150 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -9.297 -3.504 10.407 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -9.907 -3.254 12.046 1.00 0.00 H new ATOM 535 N LEU A 58 -4.839 -2.146 7.038 1.00 0.00 N ATOM 536 CA LEU A 58 -4.902 -1.770 5.635 1.00 0.00 C ATOM 537 C LEU A 58 -5.919 -2.660 4.919 1.00 0.00 C ATOM 538 O LEU A 58 -5.920 -3.877 5.098 1.00 0.00 O ATOM 539 CB LEU A 58 -3.506 -1.804 5.008 1.00 0.00 C ATOM 540 CG LEU A 58 -2.614 -0.594 5.293 1.00 0.00 C ATOM 541 CD1 LEU A 58 -1.534 -0.446 4.220 1.00 0.00 C ATOM 542 CD2 LEU A 58 -3.449 0.679 5.446 1.00 0.00 C ATOM 0 H LEU A 58 -4.426 -3.062 7.216 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.248 -0.742 5.531 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -2.993 -2.699 5.359 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.617 -1.903 3.928 1.00 0.00 H new ATOM 0 HG LEU A 58 -2.105 -0.760 6.242 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -0.913 0.421 4.446 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.913 -1.342 4.203 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -2.005 -0.312 3.246 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.791 1.524 5.648 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -4.004 0.863 4.526 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -4.148 0.558 6.273 1.00 0.00 H new ATOM 554 N GLN A 59 -6.761 -2.019 4.122 1.00 0.00 N ATOM 555 CA GLN A 59 -7.782 -2.737 3.378 1.00 0.00 C ATOM 556 C GLN A 59 -7.776 -2.301 1.911 1.00 0.00 C ATOM 557 O GLN A 59 -7.694 -1.110 1.615 1.00 0.00 O ATOM 558 CB GLN A 59 -9.163 -2.534 4.005 1.00 0.00 C ATOM 559 CG GLN A 59 -10.261 -3.115 3.112 1.00 0.00 C ATOM 560 CD GLN A 59 -10.807 -4.420 3.695 1.00 0.00 C ATOM 561 OE1 GLN A 59 -9.869 -5.234 4.171 1.00 0.00 O flip ATOM 562 NE2 GLN A 59 -12.001 -4.671 3.711 1.00 0.00 N flip ATOM 0 H GLN A 59 -6.757 -1.010 3.975 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.553 -3.802 3.421 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.195 -3.011 4.984 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -9.342 -1.470 4.162 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -11.070 -2.392 3.007 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -9.865 -3.296 2.113 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -12.668 -4.001 3.328 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -12.332 -5.551 4.107 1.00 0.00 H new ATOM 571 N LEU A 60 -7.863 -3.288 1.033 1.00 0.00 N ATOM 572 CA LEU A 60 -7.869 -3.021 -0.395 1.00 0.00 C ATOM 573 C LEU A 60 -9.295 -3.162 -0.931 1.00 0.00 C ATOM 574 O LEU A 60 -10.154 -3.747 -0.273 1.00 0.00 O ATOM 575 CB LEU A 60 -6.852 -3.913 -1.111 1.00 0.00 C ATOM 576 CG LEU A 60 -5.581 -4.245 -0.327 1.00 0.00 C ATOM 577 CD1 LEU A 60 -5.450 -5.753 -0.107 1.00 0.00 C ATOM 578 CD2 LEU A 60 -4.346 -3.655 -1.010 1.00 0.00 C ATOM 0 H LEU A 60 -7.930 -4.275 1.283 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.555 -1.996 -0.592 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.344 -4.848 -1.379 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.564 -3.426 -2.042 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.656 -3.782 0.657 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -4.538 -5.961 0.453 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -6.311 -6.115 0.455 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -5.407 -6.259 -1.071 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.456 -3.906 -0.432 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -4.254 -4.067 -2.015 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.446 -2.571 -1.070 1.00 0.00 H new ATOM 590 N SER A 61 -9.503 -2.616 -2.120 1.00 0.00 N ATOM 591 CA SER A 61 -10.811 -2.674 -2.752 1.00 0.00 C ATOM 592 C SER A 61 -10.657 -2.953 -4.248 1.00 0.00 C ATOM 593 O SER A 61 -11.177 -2.210 -5.078 1.00 0.00 O ATOM 594 CB SER A 61 -11.586 -1.374 -2.531 1.00 0.00 C ATOM 595 OG SER A 61 -12.585 -1.173 -3.527 1.00 0.00 O ATOM 0 H SER A 61 -8.788 -2.131 -2.663 1.00 0.00 H new ATOM 0 HA SER A 61 -11.377 -3.485 -2.295 1.00 0.00 H new ATOM 0 HB2 SER A 61 -12.054 -1.394 -1.547 1.00 0.00 H new ATOM 0 HB3 SER A 61 -10.893 -0.533 -2.538 1.00 0.00 H new ATOM 0 HG SER A 61 -12.174 -1.213 -4.416 1.00 0.00 H new ATOM 601 N ALA A 62 -9.941 -4.027 -4.547 1.00 0.00 N ATOM 602 CA ALA A 62 -9.712 -4.414 -5.929 1.00 0.00 C ATOM 603 C ALA A 62 -11.002 -4.216 -6.729 1.00 0.00 C ATOM 604 O ALA A 62 -12.053 -4.736 -6.357 1.00 0.00 O ATOM 605 CB ALA A 62 -9.210 -5.858 -5.979 1.00 0.00 C ATOM 0 H ALA A 62 -9.512 -4.642 -3.855 1.00 0.00 H new ATOM 0 HA ALA A 62 -8.944 -3.787 -6.381 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -9.038 -6.148 -7.016 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -8.277 -5.939 -5.421 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -9.956 -6.518 -5.536 1.00 0.00 H new ATOM 611 N GLU A 63 -10.879 -3.464 -7.812 1.00 0.00 N ATOM 612 CA GLU A 63 -12.021 -3.192 -8.668 1.00 0.00 C ATOM 613 C GLU A 63 -11.813 -3.821 -10.047 1.00 0.00 C ATOM 614 O GLU A 63 -12.699 -3.765 -10.899 1.00 0.00 O ATOM 615 CB GLU A 63 -12.273 -1.688 -8.784 1.00 0.00 C ATOM 616 CG GLU A 63 -11.191 -1.014 -9.630 1.00 0.00 C ATOM 617 CD GLU A 63 -11.808 -0.249 -10.802 1.00 0.00 C ATOM 618 OE1 GLU A 63 -12.893 -0.678 -11.252 1.00 0.00 O ATOM 619 OE2 GLU A 63 -11.181 0.748 -11.222 1.00 0.00 O ATOM 0 H GLU A 63 -10.006 -3.034 -8.117 1.00 0.00 H new ATOM 0 HA GLU A 63 -12.905 -3.641 -8.215 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -13.251 -1.513 -9.232 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.293 -1.241 -7.790 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.612 -0.330 -9.009 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.498 -1.766 -10.007 1.00 0.00 H new ATOM 626 N SER A 64 -10.638 -4.406 -10.224 1.00 0.00 N ATOM 627 CA SER A 64 -10.302 -5.045 -11.485 1.00 0.00 C ATOM 628 C SER A 64 -8.783 -5.128 -11.642 1.00 0.00 C ATOM 629 O SER A 64 -8.071 -4.173 -11.338 1.00 0.00 O ATOM 630 CB SER A 64 -10.917 -4.290 -12.666 1.00 0.00 C ATOM 631 OG SER A 64 -12.110 -4.914 -13.135 1.00 0.00 O ATOM 0 H SER A 64 -9.906 -4.451 -9.515 1.00 0.00 H new ATOM 0 HA SER A 64 -10.715 -6.054 -11.478 1.00 0.00 H new ATOM 0 HB2 SER A 64 -11.137 -3.265 -12.366 1.00 0.00 H new ATOM 0 HB3 SER A 64 -10.193 -4.236 -13.479 1.00 0.00 H new ATOM 0 HG SER A 64 -12.833 -4.765 -12.490 1.00 0.00 H new ATOM 637 N VAL A 65 -8.331 -6.280 -12.117 1.00 0.00 N ATOM 638 CA VAL A 65 -6.909 -6.500 -12.318 1.00 0.00 C ATOM 639 C VAL A 65 -6.282 -5.241 -12.920 1.00 0.00 C ATOM 640 O VAL A 65 -6.857 -4.625 -13.816 1.00 0.00 O ATOM 641 CB VAL A 65 -6.688 -7.747 -13.176 1.00 0.00 C ATOM 642 CG1 VAL A 65 -6.600 -9.003 -12.306 1.00 0.00 C ATOM 643 CG2 VAL A 65 -7.787 -7.887 -14.231 1.00 0.00 C ATOM 0 H VAL A 65 -8.925 -7.070 -12.368 1.00 0.00 H new ATOM 0 HA VAL A 65 -6.413 -6.686 -11.365 1.00 0.00 H new ATOM 0 HB VAL A 65 -5.737 -7.632 -13.695 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.443 -9.875 -12.941 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -5.767 -8.906 -11.610 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.528 -9.124 -11.747 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.607 -8.781 -14.828 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.756 -7.969 -13.738 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.782 -7.011 -14.880 1.00 0.00 H new ATOM 653 N GLY A 66 -5.112 -4.896 -12.404 1.00 0.00 N ATOM 654 CA GLY A 66 -4.401 -3.721 -12.880 1.00 0.00 C ATOM 655 C GLY A 66 -5.045 -2.439 -12.350 1.00 0.00 C ATOM 656 O GLY A 66 -4.622 -1.338 -12.699 1.00 0.00 O ATOM 0 H GLY A 66 -4.638 -5.409 -11.661 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.360 -3.768 -12.561 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.401 -3.708 -13.970 1.00 0.00 H new ATOM 660 N GLU A 67 -6.058 -2.624 -11.517 1.00 0.00 N ATOM 661 CA GLU A 67 -6.764 -1.495 -10.935 1.00 0.00 C ATOM 662 C GLU A 67 -7.462 -1.915 -9.640 1.00 0.00 C ATOM 663 O GLU A 67 -8.489 -2.591 -9.676 1.00 0.00 O ATOM 664 CB GLU A 67 -7.764 -0.903 -11.930 1.00 0.00 C ATOM 665 CG GLU A 67 -7.641 0.621 -11.991 1.00 0.00 C ATOM 666 CD GLU A 67 -8.125 1.157 -13.339 1.00 0.00 C ATOM 667 OE1 GLU A 67 -7.782 0.522 -14.359 1.00 0.00 O ATOM 668 OE2 GLU A 67 -8.828 2.191 -13.320 1.00 0.00 O ATOM 0 H GLU A 67 -6.407 -3.539 -11.231 1.00 0.00 H new ATOM 0 HA GLU A 67 -6.036 -0.720 -10.696 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.591 -1.325 -12.920 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.778 -1.178 -11.639 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -8.225 1.069 -11.187 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.603 0.912 -11.832 1.00 0.00 H new ATOM 675 N VAL A 68 -6.877 -1.498 -8.527 1.00 0.00 N ATOM 676 CA VAL A 68 -7.430 -1.823 -7.224 1.00 0.00 C ATOM 677 C VAL A 68 -7.475 -0.558 -6.364 1.00 0.00 C ATOM 678 O VAL A 68 -6.799 0.425 -6.664 1.00 0.00 O ATOM 679 CB VAL A 68 -6.625 -2.955 -6.581 1.00 0.00 C ATOM 680 CG1 VAL A 68 -6.611 -4.195 -7.477 1.00 0.00 C ATOM 681 CG2 VAL A 68 -5.202 -2.498 -6.254 1.00 0.00 C ATOM 0 H VAL A 68 -6.025 -0.938 -8.501 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.453 -2.186 -7.323 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.114 -3.224 -5.645 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -6.032 -4.984 -6.997 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -7.633 -4.540 -7.637 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -6.158 -3.945 -8.436 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.651 -3.321 -5.798 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.700 -2.189 -7.171 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.240 -1.658 -5.560 1.00 0.00 H new ATOM 691 N TYR A 69 -8.277 -0.625 -5.312 1.00 0.00 N ATOM 692 CA TYR A 69 -8.419 0.503 -4.407 1.00 0.00 C ATOM 693 C TYR A 69 -7.940 0.140 -3.000 1.00 0.00 C ATOM 694 O TYR A 69 -7.675 -1.026 -2.712 1.00 0.00 O ATOM 695 CB TYR A 69 -9.915 0.819 -4.357 1.00 0.00 C ATOM 696 CG TYR A 69 -10.396 1.733 -5.486 1.00 0.00 C ATOM 697 CD1 TYR A 69 -10.756 1.194 -6.705 1.00 0.00 C ATOM 698 CD2 TYR A 69 -10.469 3.096 -5.286 1.00 0.00 C ATOM 699 CE1 TYR A 69 -11.208 2.054 -7.767 1.00 0.00 C ATOM 700 CE2 TYR A 69 -10.921 3.957 -6.349 1.00 0.00 C ATOM 701 CZ TYR A 69 -11.269 3.393 -7.537 1.00 0.00 C ATOM 702 OH TYR A 69 -11.696 4.206 -8.540 1.00 0.00 O ATOM 0 H TYR A 69 -8.835 -1.442 -5.066 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.825 1.349 -4.752 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -10.475 -0.115 -4.396 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -10.145 1.288 -3.400 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -10.698 0.127 -6.862 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -10.187 3.518 -4.332 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -11.492 1.645 -8.725 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -10.982 5.026 -6.206 1.00 0.00 H new ATOM 0 HH TYR A 69 -12.138 4.993 -8.158 1.00 0.00 H new ATOM 712 N ILE A 70 -7.844 1.161 -2.160 1.00 0.00 N ATOM 713 CA ILE A 70 -7.402 0.964 -0.790 1.00 0.00 C ATOM 714 C ILE A 70 -8.122 1.959 0.122 1.00 0.00 C ATOM 715 O ILE A 70 -8.137 3.158 -0.152 1.00 0.00 O ATOM 716 CB ILE A 70 -5.876 1.042 -0.703 1.00 0.00 C ATOM 717 CG1 ILE A 70 -5.221 0.025 -1.639 1.00 0.00 C ATOM 718 CG2 ILE A 70 -5.400 0.882 0.742 1.00 0.00 C ATOM 719 CD1 ILE A 70 -3.700 0.026 -1.471 1.00 0.00 C ATOM 0 H ILE A 70 -8.065 2.127 -2.402 1.00 0.00 H new ATOM 0 HA ILE A 70 -7.667 -0.035 -0.444 1.00 0.00 H new ATOM 0 HB ILE A 70 -5.565 2.032 -1.036 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.613 -0.971 -1.431 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.477 0.259 -2.672 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.312 0.941 0.775 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.826 1.676 1.355 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.723 -0.086 1.126 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.259 -0.706 -2.148 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.309 1.017 -1.703 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -3.447 -0.232 -0.443 1.00 0.00 H new ATOM 731 N LYS A 71 -8.701 1.425 1.187 1.00 0.00 N ATOM 732 CA LYS A 71 -9.420 2.252 2.141 1.00 0.00 C ATOM 733 C LYS A 71 -9.025 1.845 3.562 1.00 0.00 C ATOM 734 O LYS A 71 -9.283 0.719 3.984 1.00 0.00 O ATOM 735 CB LYS A 71 -10.926 2.185 1.879 1.00 0.00 C ATOM 736 CG LYS A 71 -11.635 3.422 2.434 1.00 0.00 C ATOM 737 CD LYS A 71 -12.479 3.067 3.660 1.00 0.00 C ATOM 738 CE LYS A 71 -11.626 3.061 4.930 1.00 0.00 C ATOM 739 NZ LYS A 71 -10.812 4.294 5.014 1.00 0.00 N ATOM 0 H LYS A 71 -8.687 0.430 1.410 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.144 3.300 2.021 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -11.109 2.107 0.807 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -11.339 1.288 2.339 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -10.897 4.178 2.703 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -12.272 3.857 1.663 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -13.292 3.786 3.767 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -12.936 2.087 3.520 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -12.269 2.982 5.807 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -10.974 2.187 4.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -10.304 4.313 5.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.126 4.311 4.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -11.433 5.125 4.947 1.00 0.00 H new ATOM 753 N SER A 72 -8.406 2.785 4.261 1.00 0.00 N ATOM 754 CA SER A 72 -7.972 2.538 5.626 1.00 0.00 C ATOM 755 C SER A 72 -9.125 1.953 6.444 1.00 0.00 C ATOM 756 O SER A 72 -10.005 2.685 6.895 1.00 0.00 O ATOM 757 CB SER A 72 -7.455 3.821 6.280 1.00 0.00 C ATOM 758 OG SER A 72 -7.685 3.834 7.686 1.00 0.00 O ATOM 0 H SER A 72 -8.195 3.718 3.908 1.00 0.00 H new ATOM 0 HA SER A 72 -7.153 1.820 5.600 1.00 0.00 H new ATOM 0 HB2 SER A 72 -6.387 3.922 6.087 1.00 0.00 H new ATOM 0 HB3 SER A 72 -7.944 4.682 5.825 1.00 0.00 H new ATOM 0 HG SER A 72 -7.339 4.668 8.066 1.00 0.00 H new ATOM 764 N THR A 73 -9.084 0.640 6.610 1.00 0.00 N ATOM 765 CA THR A 73 -10.115 -0.052 7.365 1.00 0.00 C ATOM 766 C THR A 73 -10.236 0.543 8.770 1.00 0.00 C ATOM 767 O THR A 73 -9.741 -0.034 9.737 1.00 0.00 O ATOM 768 CB THR A 73 -9.780 -1.545 7.365 1.00 0.00 C ATOM 769 OG1 THR A 73 -8.607 -1.637 6.561 1.00 0.00 O ATOM 770 CG2 THR A 73 -10.817 -2.377 6.607 1.00 0.00 C ATOM 0 H THR A 73 -8.353 0.036 6.235 1.00 0.00 H new ATOM 0 HA THR A 73 -11.095 0.076 6.905 1.00 0.00 H new ATOM 0 HB THR A 73 -9.709 -1.901 8.393 1.00 0.00 H new ATOM 0 HG1 THR A 73 -8.193 -2.516 6.686 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.532 -3.429 6.637 1.00 0.00 H new ATOM 0 HG22 THR A 73 -11.795 -2.252 7.073 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.864 -2.043 5.570 1.00 0.00 H new ATOM 778 N GLU A 74 -10.898 1.689 8.837 1.00 0.00 N ATOM 779 CA GLU A 74 -11.091 2.368 10.107 1.00 0.00 C ATOM 780 C GLU A 74 -11.733 3.738 9.884 1.00 0.00 C ATOM 781 O GLU A 74 -12.912 3.930 10.177 1.00 0.00 O ATOM 782 CB GLU A 74 -9.768 2.499 10.865 1.00 0.00 C ATOM 783 CG GLU A 74 -9.943 3.338 12.133 1.00 0.00 C ATOM 784 CD GLU A 74 -10.433 2.475 13.298 1.00 0.00 C ATOM 785 OE1 GLU A 74 -10.144 1.259 13.264 1.00 0.00 O ATOM 786 OE2 GLU A 74 -11.086 3.051 14.195 1.00 0.00 O ATOM 0 H GLU A 74 -11.307 2.164 8.033 1.00 0.00 H new ATOM 0 HA GLU A 74 -11.765 1.768 10.719 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -9.396 1.509 11.128 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -9.019 2.960 10.220 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -8.995 3.807 12.397 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.655 4.142 11.946 1.00 0.00 H new ATOM 793 N THR A 75 -10.929 4.656 9.367 1.00 0.00 N ATOM 794 CA THR A 75 -11.405 6.003 9.101 1.00 0.00 C ATOM 795 C THR A 75 -11.976 6.097 7.685 1.00 0.00 C ATOM 796 O THR A 75 -12.759 5.244 7.270 1.00 0.00 O ATOM 797 CB THR A 75 -10.248 6.971 9.355 1.00 0.00 C ATOM 798 OG1 THR A 75 -9.427 6.843 8.197 1.00 0.00 O ATOM 799 CG2 THR A 75 -9.345 6.517 10.504 1.00 0.00 C ATOM 0 H THR A 75 -9.951 4.493 9.125 1.00 0.00 H new ATOM 0 HA THR A 75 -12.225 6.272 9.767 1.00 0.00 H new ATOM 0 HB THR A 75 -10.646 7.961 9.576 1.00 0.00 H new ATOM 0 HG1 THR A 75 -9.070 7.722 7.950 1.00 0.00 H new ATOM 0 HG21 THR A 75 -8.541 7.239 10.642 1.00 0.00 H new ATOM 0 HG22 THR A 75 -9.930 6.447 11.421 1.00 0.00 H new ATOM 0 HG23 THR A 75 -8.920 5.541 10.269 1.00 0.00 H new ATOM 807 N GLY A 76 -11.563 7.142 6.983 1.00 0.00 N ATOM 808 CA GLY A 76 -12.024 7.359 5.622 1.00 0.00 C ATOM 809 C GLY A 76 -10.890 7.875 4.734 1.00 0.00 C ATOM 810 O GLY A 76 -11.092 8.781 3.928 1.00 0.00 O ATOM 0 H GLY A 76 -10.914 7.848 7.331 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.415 6.427 5.214 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.845 8.076 5.622 1.00 0.00 H new ATOM 814 N GLN A 77 -9.722 7.275 4.913 1.00 0.00 N ATOM 815 CA GLN A 77 -8.555 7.663 4.139 1.00 0.00 C ATOM 816 C GLN A 77 -8.246 6.604 3.078 1.00 0.00 C ATOM 817 O GLN A 77 -7.919 5.466 3.410 1.00 0.00 O ATOM 818 CB GLN A 77 -7.347 7.898 5.047 1.00 0.00 C ATOM 819 CG GLN A 77 -6.809 9.322 4.887 1.00 0.00 C ATOM 820 CD GLN A 77 -7.443 10.266 5.910 1.00 0.00 C ATOM 821 OE1 GLN A 77 -7.104 10.271 7.082 1.00 0.00 O ATOM 822 NE2 GLN A 77 -8.380 11.063 5.404 1.00 0.00 N ATOM 0 H GLN A 77 -9.559 6.523 5.583 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.775 8.603 3.633 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -7.630 7.727 6.086 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -6.563 7.180 4.808 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -5.726 9.321 5.010 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -7.015 9.681 3.879 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -8.616 11.008 4.413 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -8.863 11.730 6.007 1.00 0.00 H new ATOM 831 N TYR A 78 -8.361 7.017 1.825 1.00 0.00 N ATOM 832 CA TYR A 78 -8.097 6.118 0.714 1.00 0.00 C ATOM 833 C TYR A 78 -6.637 6.211 0.267 1.00 0.00 C ATOM 834 O TYR A 78 -6.232 7.201 -0.341 1.00 0.00 O ATOM 835 CB TYR A 78 -8.999 6.585 -0.430 1.00 0.00 C ATOM 836 CG TYR A 78 -10.446 6.101 -0.319 1.00 0.00 C ATOM 837 CD1 TYR A 78 -11.358 6.817 0.430 1.00 0.00 C ATOM 838 CD2 TYR A 78 -10.840 4.948 -0.969 1.00 0.00 C ATOM 839 CE1 TYR A 78 -12.720 6.361 0.534 1.00 0.00 C ATOM 840 CE2 TYR A 78 -12.202 4.492 -0.865 1.00 0.00 C ATOM 841 CZ TYR A 78 -13.075 5.221 -0.119 1.00 0.00 C ATOM 842 OH TYR A 78 -14.361 4.791 -0.020 1.00 0.00 O ATOM 0 H TYR A 78 -8.633 7.962 1.554 1.00 0.00 H new ATOM 0 HA TYR A 78 -8.289 5.085 1.003 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -8.993 7.674 -0.462 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -8.581 6.236 -1.374 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -11.050 7.719 0.938 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -10.127 4.388 -1.555 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -13.443 6.911 1.117 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -12.523 3.592 -1.368 1.00 0.00 H new ATOM 0 HH TYR A 78 -14.471 3.966 -0.538 1.00 0.00 H new ATOM 852 N LEU A 79 -5.886 5.167 0.586 1.00 0.00 N ATOM 853 CA LEU A 79 -4.479 5.119 0.225 1.00 0.00 C ATOM 854 C LEU A 79 -4.307 5.627 -1.208 1.00 0.00 C ATOM 855 O LEU A 79 -5.210 5.488 -2.032 1.00 0.00 O ATOM 856 CB LEU A 79 -3.916 3.715 0.452 1.00 0.00 C ATOM 857 CG LEU A 79 -2.489 3.646 1.001 1.00 0.00 C ATOM 858 CD1 LEU A 79 -2.349 4.489 2.270 1.00 0.00 C ATOM 859 CD2 LEU A 79 -2.059 2.195 1.227 1.00 0.00 C ATOM 0 H LEU A 79 -6.225 4.348 1.090 1.00 0.00 H new ATOM 0 HA LEU A 79 -3.897 5.779 0.869 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.575 3.188 1.141 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.947 3.175 -0.494 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.815 4.070 0.257 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.326 4.423 2.640 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.587 5.529 2.044 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -3.035 4.117 3.031 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.041 2.174 1.617 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.732 1.723 1.943 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.097 1.653 0.282 1.00 0.00 H new ATOM 871 N ALA A 80 -3.142 6.204 -1.462 1.00 0.00 N ATOM 872 CA ALA A 80 -2.840 6.733 -2.781 1.00 0.00 C ATOM 873 C ALA A 80 -1.368 7.145 -2.836 1.00 0.00 C ATOM 874 O ALA A 80 -0.634 6.971 -1.864 1.00 0.00 O ATOM 875 CB ALA A 80 -3.783 7.898 -3.092 1.00 0.00 C ATOM 0 H ALA A 80 -2.395 6.317 -0.776 1.00 0.00 H new ATOM 0 HA ALA A 80 -2.998 5.972 -3.545 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.557 8.295 -4.082 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.815 7.547 -3.069 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.650 8.683 -2.347 1.00 0.00 H new ATOM 881 N MET A 81 -0.980 7.683 -3.983 1.00 0.00 N ATOM 882 CA MET A 81 0.392 8.121 -4.177 1.00 0.00 C ATOM 883 C MET A 81 0.444 9.424 -4.978 1.00 0.00 C ATOM 884 O MET A 81 0.042 9.459 -6.140 1.00 0.00 O ATOM 885 CB MET A 81 1.175 7.035 -4.918 1.00 0.00 C ATOM 886 CG MET A 81 2.506 6.747 -4.222 1.00 0.00 C ATOM 887 SD MET A 81 3.154 5.176 -4.770 1.00 0.00 S ATOM 888 CE MET A 81 4.887 5.584 -4.898 1.00 0.00 C ATOM 0 H MET A 81 -1.591 7.826 -4.787 1.00 0.00 H new ATOM 0 HA MET A 81 0.838 8.300 -3.199 1.00 0.00 H new ATOM 0 HB2 MET A 81 0.581 6.122 -4.966 1.00 0.00 H new ATOM 0 HB3 MET A 81 1.358 7.351 -5.945 1.00 0.00 H new ATOM 0 HG2 MET A 81 3.220 7.541 -4.442 1.00 0.00 H new ATOM 0 HG3 MET A 81 2.366 6.735 -3.141 1.00 0.00 H new ATOM 0 HE1 MET A 81 5.380 4.873 -5.561 1.00 0.00 H new ATOM 0 HE2 MET A 81 4.995 6.591 -5.300 1.00 0.00 H new ATOM 0 HE3 MET A 81 5.346 5.537 -3.910 1.00 0.00 H new ATOM 898 N ASP A 82 0.941 10.463 -4.325 1.00 0.00 N ATOM 899 CA ASP A 82 1.051 11.765 -4.961 1.00 0.00 C ATOM 900 C ASP A 82 2.174 11.727 -6.000 1.00 0.00 C ATOM 901 O ASP A 82 2.915 10.749 -6.083 1.00 0.00 O ATOM 902 CB ASP A 82 1.389 12.852 -3.938 1.00 0.00 C ATOM 903 CG ASP A 82 0.414 12.960 -2.764 1.00 0.00 C ATOM 904 OD1 ASP A 82 -0.738 13.372 -3.019 1.00 0.00 O ATOM 905 OD2 ASP A 82 0.843 12.628 -1.638 1.00 0.00 O ATOM 0 H ASP A 82 1.273 10.430 -3.361 1.00 0.00 H new ATOM 0 HA ASP A 82 0.093 11.995 -5.427 1.00 0.00 H new ATOM 0 HB2 ASP A 82 2.388 12.662 -3.545 1.00 0.00 H new ATOM 0 HB3 ASP A 82 1.425 13.813 -4.450 1.00 0.00 H new ATOM 910 N THR A 83 2.264 12.805 -6.766 1.00 0.00 N ATOM 911 CA THR A 83 3.284 12.907 -7.795 1.00 0.00 C ATOM 912 C THR A 83 4.679 12.785 -7.178 1.00 0.00 C ATOM 913 O THR A 83 5.658 12.558 -7.888 1.00 0.00 O ATOM 914 CB THR A 83 3.066 14.221 -8.548 1.00 0.00 C ATOM 915 OG1 THR A 83 2.651 15.136 -7.537 1.00 0.00 O ATOM 916 CG2 THR A 83 1.873 14.157 -9.504 1.00 0.00 C ATOM 0 H THR A 83 1.647 13.614 -6.694 1.00 0.00 H new ATOM 0 HA THR A 83 3.207 12.088 -8.511 1.00 0.00 H new ATOM 0 HB THR A 83 3.967 14.472 -9.108 1.00 0.00 H new ATOM 0 HG1 THR A 83 2.489 16.015 -7.938 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.763 15.115 -10.013 1.00 0.00 H new ATOM 0 HG22 THR A 83 2.039 13.372 -10.241 1.00 0.00 H new ATOM 0 HG23 THR A 83 0.966 13.939 -8.940 1.00 0.00 H new ATOM 924 N ASP A 84 4.725 12.941 -5.863 1.00 0.00 N ATOM 925 CA ASP A 84 5.983 12.850 -5.143 1.00 0.00 C ATOM 926 C ASP A 84 6.295 11.381 -4.851 1.00 0.00 C ATOM 927 O ASP A 84 7.270 11.074 -4.168 1.00 0.00 O ATOM 928 CB ASP A 84 5.908 13.592 -3.807 1.00 0.00 C ATOM 929 CG ASP A 84 7.121 14.466 -3.483 1.00 0.00 C ATOM 930 OD1 ASP A 84 8.223 14.103 -3.949 1.00 0.00 O ATOM 931 OD2 ASP A 84 6.919 15.477 -2.776 1.00 0.00 O ATOM 0 H ASP A 84 3.911 13.130 -5.278 1.00 0.00 H new ATOM 0 HA ASP A 84 6.759 13.300 -5.763 1.00 0.00 H new ATOM 0 HB2 ASP A 84 5.017 14.219 -3.807 1.00 0.00 H new ATOM 0 HB3 ASP A 84 5.783 12.860 -3.009 1.00 0.00 H new ATOM 936 N GLY A 85 5.448 10.513 -5.384 1.00 0.00 N ATOM 937 CA GLY A 85 5.620 9.083 -5.189 1.00 0.00 C ATOM 938 C GLY A 85 5.612 8.728 -3.701 1.00 0.00 C ATOM 939 O GLY A 85 6.152 7.697 -3.302 1.00 0.00 O ATOM 0 H GLY A 85 4.641 10.772 -5.951 1.00 0.00 H new ATOM 0 HA2 GLY A 85 4.822 8.544 -5.699 1.00 0.00 H new ATOM 0 HA3 GLY A 85 6.560 8.761 -5.638 1.00 0.00 H new ATOM 943 N LEU A 86 4.993 9.601 -2.920 1.00 0.00 N ATOM 944 CA LEU A 86 4.907 9.392 -1.485 1.00 0.00 C ATOM 945 C LEU A 86 3.481 8.972 -1.119 1.00 0.00 C ATOM 946 O LEU A 86 2.568 9.796 -1.123 1.00 0.00 O ATOM 947 CB LEU A 86 5.394 10.632 -0.733 1.00 0.00 C ATOM 948 CG LEU A 86 5.956 10.388 0.670 1.00 0.00 C ATOM 949 CD1 LEU A 86 6.246 11.710 1.382 1.00 0.00 C ATOM 950 CD2 LEU A 86 5.024 9.490 1.485 1.00 0.00 C ATOM 0 H LEU A 86 4.546 10.455 -3.254 1.00 0.00 H new ATOM 0 HA LEU A 86 5.568 8.581 -1.178 1.00 0.00 H new ATOM 0 HB2 LEU A 86 6.165 11.117 -1.332 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.564 11.334 -0.653 1.00 0.00 H new ATOM 0 HG LEU A 86 6.905 9.861 0.571 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.644 11.508 2.376 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.976 12.280 0.808 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.325 12.286 1.470 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.447 9.332 2.477 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.048 9.967 1.578 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.912 8.530 0.982 1.00 0.00 H new ATOM 962 N LEU A 87 3.336 7.692 -0.812 1.00 0.00 N ATOM 963 CA LEU A 87 2.038 7.153 -0.445 1.00 0.00 C ATOM 964 C LEU A 87 1.294 8.171 0.421 1.00 0.00 C ATOM 965 O LEU A 87 1.887 8.795 1.300 1.00 0.00 O ATOM 966 CB LEU A 87 2.194 5.781 0.215 1.00 0.00 C ATOM 967 CG LEU A 87 1.659 4.589 -0.580 1.00 0.00 C ATOM 968 CD1 LEU A 87 2.298 4.525 -1.969 1.00 0.00 C ATOM 969 CD2 LEU A 87 1.845 3.284 0.196 1.00 0.00 C ATOM 0 H LEU A 87 4.096 7.012 -0.810 1.00 0.00 H new ATOM 0 HA LEU A 87 1.430 6.986 -1.334 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.253 5.614 0.414 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.688 5.805 1.180 1.00 0.00 H new ATOM 0 HG LEU A 87 0.588 4.728 -0.724 1.00 0.00 H new ATOM 0 HD11 LEU A 87 1.900 3.668 -2.513 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.071 5.440 -2.516 1.00 0.00 H new ATOM 0 HD13 LEU A 87 3.378 4.421 -1.868 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.456 2.453 -0.392 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.905 3.125 0.392 1.00 0.00 H new ATOM 0 HD23 LEU A 87 1.306 3.343 1.142 1.00 0.00 H new ATOM 981 N TYR A 88 0.006 8.307 0.144 1.00 0.00 N ATOM 982 CA TYR A 88 -0.825 9.239 0.887 1.00 0.00 C ATOM 983 C TYR A 88 -2.310 8.970 0.636 1.00 0.00 C ATOM 984 O TYR A 88 -2.680 8.429 -0.405 1.00 0.00 O ATOM 985 CB TYR A 88 -0.475 10.631 0.357 1.00 0.00 C ATOM 986 CG TYR A 88 -1.326 11.076 -0.834 1.00 0.00 C ATOM 987 CD1 TYR A 88 -1.078 10.560 -2.090 1.00 0.00 C ATOM 988 CD2 TYR A 88 -2.341 11.993 -0.653 1.00 0.00 C ATOM 989 CE1 TYR A 88 -1.879 10.979 -3.211 1.00 0.00 C ATOM 990 CE2 TYR A 88 -3.142 12.412 -1.774 1.00 0.00 C ATOM 991 CZ TYR A 88 -2.871 11.884 -2.998 1.00 0.00 C ATOM 992 OH TYR A 88 -3.628 12.279 -4.057 1.00 0.00 O ATOM 0 H TYR A 88 -0.483 7.787 -0.585 1.00 0.00 H new ATOM 0 HA TYR A 88 -0.647 9.142 1.958 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -0.590 11.355 1.163 1.00 0.00 H new ATOM 0 HB3 TYR A 88 0.575 10.644 0.065 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -0.284 9.842 -2.232 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -2.535 12.397 0.330 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -1.696 10.583 -4.199 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -3.940 13.129 -1.646 1.00 0.00 H new ATOM 0 HH TYR A 88 -3.108 12.888 -4.622 1.00 0.00 H new ATOM 1002 N GLY A 89 -3.122 9.360 1.608 1.00 0.00 N ATOM 1003 CA GLY A 89 -4.559 9.167 1.506 1.00 0.00 C ATOM 1004 C GLY A 89 -5.256 10.461 1.081 1.00 0.00 C ATOM 1005 O GLY A 89 -4.770 11.555 1.365 1.00 0.00 O ATOM 0 H GLY A 89 -2.812 9.809 2.470 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.774 8.380 0.783 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -4.954 8.835 2.466 1.00 0.00 H new ATOM 1009 N SER A 90 -6.385 10.293 0.407 1.00 0.00 N ATOM 1010 CA SER A 90 -7.154 11.434 -0.059 1.00 0.00 C ATOM 1011 C SER A 90 -8.645 11.090 -0.072 1.00 0.00 C ATOM 1012 O SER A 90 -9.015 9.917 -0.103 1.00 0.00 O ATOM 1013 CB SER A 90 -6.699 11.873 -1.453 1.00 0.00 C ATOM 1014 OG SER A 90 -6.146 10.792 -2.199 1.00 0.00 O ATOM 0 H SER A 90 -6.785 9.384 0.173 1.00 0.00 H new ATOM 0 HA SER A 90 -6.985 12.264 0.627 1.00 0.00 H new ATOM 0 HB2 SER A 90 -7.546 12.292 -1.996 1.00 0.00 H new ATOM 0 HB3 SER A 90 -5.957 12.666 -1.359 1.00 0.00 H new ATOM 0 HG SER A 90 -5.200 10.971 -2.383 1.00 0.00 H new ATOM 1020 N GLN A 91 -9.461 12.134 -0.048 1.00 0.00 N ATOM 1021 CA GLN A 91 -10.903 11.956 -0.057 1.00 0.00 C ATOM 1022 C GLN A 91 -11.427 11.936 -1.494 1.00 0.00 C ATOM 1023 O GLN A 91 -12.550 12.364 -1.755 1.00 0.00 O ATOM 1024 CB GLN A 91 -11.595 13.047 0.764 1.00 0.00 C ATOM 1025 CG GLN A 91 -12.989 12.599 1.207 1.00 0.00 C ATOM 1026 CD GLN A 91 -13.486 13.438 2.385 1.00 0.00 C ATOM 1027 OE1 GLN A 91 -13.650 12.960 3.496 1.00 0.00 O ATOM 1028 NE2 GLN A 91 -13.715 14.713 2.083 1.00 0.00 N ATOM 0 H GLN A 91 -9.151 13.105 -0.022 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.134 10.997 0.406 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -10.991 13.287 1.639 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.673 13.958 0.171 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.685 12.688 0.373 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -12.964 11.547 1.490 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -13.557 15.048 1.133 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -14.048 15.355 2.802 1.00 0.00 H new ATOM 1037 N THR A 92 -10.588 11.436 -2.389 1.00 0.00 N ATOM 1038 CA THR A 92 -10.952 11.355 -3.793 1.00 0.00 C ATOM 1039 C THR A 92 -10.569 9.988 -4.366 1.00 0.00 C ATOM 1040 O THR A 92 -9.464 9.813 -4.877 1.00 0.00 O ATOM 1041 CB THR A 92 -10.290 12.526 -4.522 1.00 0.00 C ATOM 1042 OG1 THR A 92 -8.924 12.138 -4.633 1.00 0.00 O ATOM 1043 CG2 THR A 92 -10.248 13.797 -3.671 1.00 0.00 C ATOM 0 H THR A 92 -9.657 11.083 -2.169 1.00 0.00 H new ATOM 0 HA THR A 92 -12.031 11.438 -3.927 1.00 0.00 H new ATOM 0 HB THR A 92 -10.828 12.727 -5.449 1.00 0.00 H new ATOM 0 HG1 THR A 92 -8.851 11.366 -5.232 1.00 0.00 H new ATOM 0 HG21 THR A 92 -9.768 14.597 -4.235 1.00 0.00 H new ATOM 0 HG22 THR A 92 -11.264 14.095 -3.411 1.00 0.00 H new ATOM 0 HG23 THR A 92 -9.682 13.606 -2.759 1.00 0.00 H new ATOM 1051 N PRO A 93 -11.529 9.031 -4.258 1.00 0.00 N ATOM 1052 CA PRO A 93 -11.304 7.686 -4.758 1.00 0.00 C ATOM 1053 C PRO A 93 -11.388 7.648 -6.286 1.00 0.00 C ATOM 1054 O PRO A 93 -12.481 7.672 -6.851 1.00 0.00 O ATOM 1055 CB PRO A 93 -12.364 6.832 -4.083 1.00 0.00 C ATOM 1056 CG PRO A 93 -13.430 7.800 -3.594 1.00 0.00 C ATOM 1057 CD PRO A 93 -12.849 9.203 -3.659 1.00 0.00 C ATOM 0 HA PRO A 93 -10.306 7.313 -4.527 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -12.785 6.108 -4.781 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -11.940 6.266 -3.253 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -14.324 7.728 -4.213 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.728 7.557 -2.574 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -13.474 9.863 -4.261 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -12.778 9.649 -2.667 1.00 0.00 H new ATOM 1065 N ASN A 94 -10.221 7.588 -6.910 1.00 0.00 N ATOM 1066 CA ASN A 94 -10.150 7.547 -8.361 1.00 0.00 C ATOM 1067 C ASN A 94 -8.812 6.936 -8.783 1.00 0.00 C ATOM 1068 O ASN A 94 -8.130 6.307 -7.976 1.00 0.00 O ATOM 1069 CB ASN A 94 -10.237 8.953 -8.957 1.00 0.00 C ATOM 1070 CG ASN A 94 -11.346 9.765 -8.286 1.00 0.00 C ATOM 1071 OD1 ASN A 94 -11.034 10.206 -7.071 1.00 0.00 O flip ATOM 1072 ND2 ASN A 94 -12.415 9.977 -8.835 1.00 0.00 N flip ATOM 0 H ASN A 94 -9.317 7.567 -6.438 1.00 0.00 H new ATOM 0 HA ASN A 94 -10.987 6.950 -8.724 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -9.282 9.464 -8.834 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -10.427 8.887 -10.028 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -12.590 9.609 -9.770 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -13.134 10.522 -8.359 1.00 0.00 H new ATOM 1079 N GLU A 95 -8.477 7.143 -10.049 1.00 0.00 N ATOM 1080 CA GLU A 95 -7.234 6.620 -10.589 1.00 0.00 C ATOM 1081 C GLU A 95 -6.108 6.764 -9.563 1.00 0.00 C ATOM 1082 O GLU A 95 -5.291 5.859 -9.401 1.00 0.00 O ATOM 1083 CB GLU A 95 -6.871 7.317 -11.902 1.00 0.00 C ATOM 1084 CG GLU A 95 -7.752 6.817 -13.049 1.00 0.00 C ATOM 1085 CD GLU A 95 -7.172 7.228 -14.404 1.00 0.00 C ATOM 1086 OE1 GLU A 95 -6.341 6.453 -14.924 1.00 0.00 O ATOM 1087 OE2 GLU A 95 -7.573 8.308 -14.889 1.00 0.00 O ATOM 0 H GLU A 95 -9.045 7.666 -10.716 1.00 0.00 H new ATOM 0 HA GLU A 95 -7.371 5.560 -10.804 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -6.989 8.395 -11.791 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.823 7.134 -12.137 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.838 5.731 -13.000 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.759 7.221 -12.942 1.00 0.00 H new ATOM 1094 N GLU A 96 -6.101 7.909 -8.895 1.00 0.00 N ATOM 1095 CA GLU A 96 -5.089 8.182 -7.889 1.00 0.00 C ATOM 1096 C GLU A 96 -5.119 7.108 -6.800 1.00 0.00 C ATOM 1097 O GLU A 96 -4.239 6.250 -6.746 1.00 0.00 O ATOM 1098 CB GLU A 96 -5.275 9.577 -7.289 1.00 0.00 C ATOM 1099 CG GLU A 96 -4.085 9.959 -6.407 1.00 0.00 C ATOM 1100 CD GLU A 96 -3.771 11.452 -6.524 1.00 0.00 C ATOM 1101 OE1 GLU A 96 -4.730 12.214 -6.775 1.00 0.00 O ATOM 1102 OE2 GLU A 96 -2.581 11.797 -6.361 1.00 0.00 O ATOM 0 H GLU A 96 -6.780 8.658 -9.031 1.00 0.00 H new ATOM 0 HA GLU A 96 -4.111 8.156 -8.370 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.388 10.308 -8.089 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -6.192 9.604 -6.700 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -4.303 9.710 -5.368 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -3.211 9.376 -6.698 1.00 0.00 H new ATOM 1109 N CYS A 97 -6.139 7.192 -5.960 1.00 0.00 N ATOM 1110 CA CYS A 97 -6.296 6.237 -4.875 1.00 0.00 C ATOM 1111 C CYS A 97 -6.032 4.835 -5.427 1.00 0.00 C ATOM 1112 O CYS A 97 -5.402 4.011 -4.765 1.00 0.00 O ATOM 1113 CB CYS A 97 -7.675 6.343 -4.222 1.00 0.00 C ATOM 1114 SG CYS A 97 -8.109 4.759 -3.416 1.00 0.00 S ATOM 0 H CYS A 97 -6.866 7.906 -6.008 1.00 0.00 H new ATOM 0 HA CYS A 97 -5.576 6.458 -4.087 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -7.677 7.147 -3.486 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -8.424 6.596 -4.973 1.00 0.00 H new ATOM 0 HG CYS A 97 -7.171 4.426 -2.580 1.00 0.00 H new ATOM 1120 N LEU A 98 -6.526 4.607 -6.635 1.00 0.00 N ATOM 1121 CA LEU A 98 -6.352 3.318 -7.284 1.00 0.00 C ATOM 1122 C LEU A 98 -4.881 2.905 -7.200 1.00 0.00 C ATOM 1123 O LEU A 98 -4.024 3.716 -6.854 1.00 0.00 O ATOM 1124 CB LEU A 98 -6.899 3.359 -8.712 1.00 0.00 C ATOM 1125 CG LEU A 98 -8.308 2.796 -8.907 1.00 0.00 C ATOM 1126 CD1 LEU A 98 -8.869 3.183 -10.277 1.00 0.00 C ATOM 1127 CD2 LEU A 98 -8.329 1.282 -8.687 1.00 0.00 C ATOM 0 H LEU A 98 -7.047 5.293 -7.182 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.929 2.550 -6.769 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.893 4.394 -9.053 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.216 2.807 -9.357 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.960 3.240 -8.155 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.871 2.770 -10.390 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -8.913 4.269 -10.359 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.223 2.786 -11.060 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.342 0.907 -8.832 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.659 0.801 -9.400 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.001 1.057 -7.672 1.00 0.00 H new ATOM 1139 N PHE A 99 -4.635 1.644 -7.523 1.00 0.00 N ATOM 1140 CA PHE A 99 -3.283 1.113 -7.488 1.00 0.00 C ATOM 1141 C PHE A 99 -3.111 -0.016 -8.507 1.00 0.00 C ATOM 1142 O PHE A 99 -3.556 -1.139 -8.275 1.00 0.00 O ATOM 1143 CB PHE A 99 -3.057 0.553 -6.082 1.00 0.00 C ATOM 1144 CG PHE A 99 -1.952 1.265 -5.299 1.00 0.00 C ATOM 1145 CD1 PHE A 99 -0.763 1.539 -5.899 1.00 0.00 C ATOM 1146 CD2 PHE A 99 -2.159 1.623 -4.004 1.00 0.00 C ATOM 1147 CE1 PHE A 99 0.263 2.199 -5.172 1.00 0.00 C ATOM 1148 CE2 PHE A 99 -1.133 2.284 -3.277 1.00 0.00 C ATOM 1149 CZ PHE A 99 0.056 2.558 -3.877 1.00 0.00 C ATOM 0 H PHE A 99 -5.349 0.975 -7.810 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.569 1.899 -7.732 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -3.989 0.622 -5.520 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.809 -0.506 -6.159 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -0.599 1.255 -6.928 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.104 1.405 -3.528 1.00 0.00 H new ATOM 0 HE1 PHE A 99 1.208 2.416 -5.648 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -1.297 2.569 -2.248 1.00 0.00 H new ATOM 0 HZ PHE A 99 0.836 3.061 -3.325 1.00 0.00 H new ATOM 1159 N LEU A 100 -2.464 0.321 -9.613 1.00 0.00 N ATOM 1160 CA LEU A 100 -2.227 -0.650 -10.667 1.00 0.00 C ATOM 1161 C LEU A 100 -1.567 -1.894 -10.070 1.00 0.00 C ATOM 1162 O LEU A 100 -0.365 -1.899 -9.811 1.00 0.00 O ATOM 1163 CB LEU A 100 -1.429 -0.017 -11.809 1.00 0.00 C ATOM 1164 CG LEU A 100 -2.175 0.157 -13.133 1.00 0.00 C ATOM 1165 CD1 LEU A 100 -1.649 1.370 -13.904 1.00 0.00 C ATOM 1166 CD2 LEU A 100 -2.114 -1.123 -13.969 1.00 0.00 C ATOM 0 H LEU A 100 -2.096 1.254 -9.802 1.00 0.00 H new ATOM 0 HA LEU A 100 -3.170 -0.971 -11.109 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.078 0.962 -11.481 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.545 -0.628 -11.991 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.225 0.347 -12.911 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.196 1.471 -14.841 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.787 2.270 -13.305 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.588 1.234 -14.116 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.652 -0.972 -14.905 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.074 -1.368 -14.184 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.573 -1.942 -13.415 1.00 0.00 H new ATOM 1178 N GLU A 101 -2.382 -2.919 -9.870 1.00 0.00 N ATOM 1179 CA GLU A 101 -1.892 -4.166 -9.308 1.00 0.00 C ATOM 1180 C GLU A 101 -0.938 -4.851 -10.289 1.00 0.00 C ATOM 1181 O GLU A 101 -0.732 -4.367 -11.401 1.00 0.00 O ATOM 1182 CB GLU A 101 -3.051 -5.092 -8.934 1.00 0.00 C ATOM 1183 CG GLU A 101 -2.886 -5.629 -7.511 1.00 0.00 C ATOM 1184 CD GLU A 101 -4.216 -6.153 -6.965 1.00 0.00 C ATOM 1185 OE1 GLU A 101 -5.051 -6.562 -7.801 1.00 0.00 O ATOM 1186 OE2 GLU A 101 -4.367 -6.134 -5.724 1.00 0.00 O ATOM 0 H GLU A 101 -3.379 -2.911 -10.087 1.00 0.00 H new ATOM 0 HA GLU A 101 -1.342 -3.939 -8.395 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -3.994 -4.551 -9.016 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -3.098 -5.924 -9.637 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -2.145 -6.429 -7.504 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.508 -4.839 -6.862 1.00 0.00 H new ATOM 1193 N ARG A 102 -0.381 -5.967 -9.842 1.00 0.00 N ATOM 1194 CA ARG A 102 0.546 -6.724 -10.666 1.00 0.00 C ATOM 1195 C ARG A 102 1.032 -7.965 -9.916 1.00 0.00 C ATOM 1196 O ARG A 102 1.992 -7.896 -9.150 1.00 0.00 O ATOM 1197 CB ARG A 102 1.753 -5.871 -11.062 1.00 0.00 C ATOM 1198 CG ARG A 102 1.512 -5.167 -12.399 1.00 0.00 C ATOM 1199 CD ARG A 102 2.752 -5.245 -13.291 1.00 0.00 C ATOM 1200 NE ARG A 102 3.688 -4.149 -12.953 1.00 0.00 N ATOM 1201 CZ ARG A 102 4.940 -4.059 -13.421 1.00 0.00 C ATOM 1202 NH1 ARG A 102 5.415 -4.999 -14.250 1.00 0.00 N ATOM 1203 NH2 ARG A 102 5.718 -3.030 -13.060 1.00 0.00 N ATOM 0 H ARG A 102 -0.554 -6.365 -8.919 1.00 0.00 H new ATOM 0 HA ARG A 102 0.016 -7.026 -11.569 1.00 0.00 H new ATOM 0 HB2 ARG A 102 1.949 -5.130 -10.287 1.00 0.00 H new ATOM 0 HB3 ARG A 102 2.640 -6.500 -11.133 1.00 0.00 H new ATOM 0 HG2 ARG A 102 0.664 -5.626 -12.908 1.00 0.00 H new ATOM 0 HG3 ARG A 102 1.251 -4.123 -12.223 1.00 0.00 H new ATOM 0 HD2 ARG A 102 3.245 -6.208 -13.160 1.00 0.00 H new ATOM 0 HD3 ARG A 102 2.461 -5.176 -14.339 1.00 0.00 H new ATOM 0 HE ARG A 102 3.359 -3.416 -12.324 1.00 0.00 H new ATOM 0 HH11 ARG A 102 4.823 -5.783 -14.525 1.00 0.00 H new ATOM 0 HH12 ARG A 102 6.368 -4.930 -14.606 1.00 0.00 H new ATOM 0 HH21 ARG A 102 5.357 -2.315 -12.429 1.00 0.00 H new ATOM 0 HH22 ARG A 102 6.671 -2.962 -13.416 1.00 0.00 H new ATOM 1217 N LEU A 103 0.347 -9.072 -10.162 1.00 0.00 N ATOM 1218 CA LEU A 103 0.697 -10.327 -9.519 1.00 0.00 C ATOM 1219 C LEU A 103 2.164 -10.651 -9.807 1.00 0.00 C ATOM 1220 O LEU A 103 2.471 -11.355 -10.768 1.00 0.00 O ATOM 1221 CB LEU A 103 -0.272 -11.434 -9.942 1.00 0.00 C ATOM 1222 CG LEU A 103 -0.320 -12.665 -9.034 1.00 0.00 C ATOM 1223 CD1 LEU A 103 -0.998 -12.338 -7.702 1.00 0.00 C ATOM 1224 CD2 LEU A 103 -0.991 -13.843 -9.744 1.00 0.00 C ATOM 0 H LEU A 103 -0.449 -9.126 -10.798 1.00 0.00 H new ATOM 0 HA LEU A 103 0.595 -10.242 -8.437 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.274 -11.010 -10.000 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.005 -11.759 -10.948 1.00 0.00 H new ATOM 0 HG LEU A 103 0.704 -12.964 -8.809 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.019 -13.230 -7.076 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.441 -11.551 -7.194 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.018 -12.000 -7.886 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.012 -14.705 -9.077 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.010 -13.570 -10.017 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.429 -14.094 -10.644 1.00 0.00 H new ATOM 1236 N GLU A 104 3.031 -10.122 -8.956 1.00 0.00 N ATOM 1237 CA GLU A 104 4.459 -10.346 -9.107 1.00 0.00 C ATOM 1238 C GLU A 104 4.787 -11.829 -8.918 1.00 0.00 C ATOM 1239 O GLU A 104 5.368 -12.457 -9.802 1.00 0.00 O ATOM 1240 CB GLU A 104 5.256 -9.480 -8.130 1.00 0.00 C ATOM 1241 CG GLU A 104 6.686 -10.002 -7.975 1.00 0.00 C ATOM 1242 CD GLU A 104 6.731 -11.203 -7.027 1.00 0.00 C ATOM 1243 OE1 GLU A 104 6.560 -10.972 -5.811 1.00 0.00 O ATOM 1244 OE2 GLU A 104 6.934 -12.324 -7.541 1.00 0.00 O ATOM 0 H GLU A 104 2.772 -9.539 -8.160 1.00 0.00 H new ATOM 0 HA GLU A 104 4.747 -10.056 -10.117 1.00 0.00 H new ATOM 0 HB2 GLU A 104 5.278 -8.450 -8.486 1.00 0.00 H new ATOM 0 HB3 GLU A 104 4.761 -9.471 -7.159 1.00 0.00 H new ATOM 0 HG2 GLU A 104 7.080 -10.289 -8.950 1.00 0.00 H new ATOM 0 HG3 GLU A 104 7.328 -9.208 -7.593 1.00 0.00 H new ATOM 1251 N GLU A 105 4.400 -12.344 -7.761 1.00 0.00 N ATOM 1252 CA GLU A 105 4.646 -13.741 -7.444 1.00 0.00 C ATOM 1253 C GLU A 105 3.384 -14.571 -7.690 1.00 0.00 C ATOM 1254 O GLU A 105 2.863 -14.600 -8.804 1.00 0.00 O ATOM 1255 CB GLU A 105 5.134 -13.900 -6.003 1.00 0.00 C ATOM 1256 CG GLU A 105 5.633 -15.323 -5.746 1.00 0.00 C ATOM 1257 CD GLU A 105 7.116 -15.325 -5.371 1.00 0.00 C ATOM 1258 OE1 GLU A 105 7.840 -14.464 -5.916 1.00 0.00 O ATOM 1259 OE2 GLU A 105 7.492 -16.187 -4.548 1.00 0.00 O ATOM 0 H GLU A 105 3.918 -11.819 -7.031 1.00 0.00 H new ATOM 0 HA GLU A 105 5.434 -14.109 -8.101 1.00 0.00 H new ATOM 0 HB2 GLU A 105 5.936 -13.189 -5.807 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.324 -13.665 -5.313 1.00 0.00 H new ATOM 0 HG2 GLU A 105 5.051 -15.777 -4.944 1.00 0.00 H new ATOM 0 HG3 GLU A 105 5.479 -15.933 -6.636 1.00 0.00 H new ATOM 1266 N ASN A 106 2.929 -15.225 -6.631 1.00 0.00 N ATOM 1267 CA ASN A 106 1.738 -16.052 -6.718 1.00 0.00 C ATOM 1268 C ASN A 106 0.805 -15.721 -5.551 1.00 0.00 C ATOM 1269 O ASN A 106 0.189 -16.614 -4.972 1.00 0.00 O ATOM 1270 CB ASN A 106 2.092 -17.538 -6.633 1.00 0.00 C ATOM 1271 CG ASN A 106 2.476 -17.929 -5.204 1.00 0.00 C ATOM 1272 OD1 ASN A 106 2.783 -17.097 -4.367 1.00 0.00 O ATOM 1273 ND2 ASN A 106 2.440 -19.239 -4.974 1.00 0.00 N ATOM 0 H ASN A 106 3.364 -15.199 -5.709 1.00 0.00 H new ATOM 0 HA ASN A 106 1.257 -15.850 -7.675 1.00 0.00 H new ATOM 0 HB2 ASN A 106 1.243 -18.137 -6.962 1.00 0.00 H new ATOM 0 HB3 ASN A 106 2.919 -17.758 -7.309 1.00 0.00 H new ATOM 0 HD21 ASN A 106 2.678 -19.601 -4.051 1.00 0.00 H new ATOM 0 HD22 ASN A 106 2.174 -19.881 -5.721 1.00 0.00 H new ATOM 1280 N HIS A 107 0.732 -14.435 -5.241 1.00 0.00 N ATOM 1281 CA HIS A 107 -0.115 -13.975 -4.153 1.00 0.00 C ATOM 1282 C HIS A 107 -0.002 -12.454 -4.024 1.00 0.00 C ATOM 1283 O HIS A 107 -0.993 -11.740 -4.172 1.00 0.00 O ATOM 1284 CB HIS A 107 0.225 -14.707 -2.853 1.00 0.00 C ATOM 1285 CG HIS A 107 -0.606 -15.944 -2.611 1.00 0.00 C ATOM 1286 ND1 HIS A 107 -1.984 -15.910 -2.491 1.00 0.00 N ATOM 1287 CD2 HIS A 107 -0.239 -17.250 -2.469 1.00 0.00 C ATOM 1288 CE1 HIS A 107 -2.417 -17.146 -2.285 1.00 0.00 C ATOM 1289 NE2 HIS A 107 -1.334 -17.975 -2.271 1.00 0.00 N ATOM 0 H HIS A 107 1.245 -13.697 -5.724 1.00 0.00 H new ATOM 0 HA HIS A 107 -1.156 -14.211 -4.373 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.278 -14.987 -2.870 1.00 0.00 H new ATOM 0 HB3 HIS A 107 0.091 -14.022 -2.016 1.00 0.00 H new ATOM 0 HD2 HIS A 107 0.771 -17.630 -2.511 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -3.446 -17.444 -2.152 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -1.361 -18.985 -2.131 1.00 0.00 H new ATOM 1297 N TYR A 108 1.213 -12.004 -3.748 1.00 0.00 N ATOM 1298 CA TYR A 108 1.467 -10.581 -3.597 1.00 0.00 C ATOM 1299 C TYR A 108 0.748 -9.777 -4.682 1.00 0.00 C ATOM 1300 O TYR A 108 0.492 -10.289 -5.771 1.00 0.00 O ATOM 1301 CB TYR A 108 2.978 -10.403 -3.763 1.00 0.00 C ATOM 1302 CG TYR A 108 3.815 -11.338 -2.888 1.00 0.00 C ATOM 1303 CD1 TYR A 108 3.524 -11.471 -1.546 1.00 0.00 C ATOM 1304 CD2 TYR A 108 4.860 -12.049 -3.441 1.00 0.00 C ATOM 1305 CE1 TYR A 108 4.311 -12.351 -0.722 1.00 0.00 C ATOM 1306 CE2 TYR A 108 5.648 -12.929 -2.618 1.00 0.00 C ATOM 1307 CZ TYR A 108 5.335 -13.037 -1.299 1.00 0.00 C ATOM 1308 OH TYR A 108 6.079 -13.868 -0.521 1.00 0.00 O ATOM 0 H TYR A 108 2.032 -12.599 -3.625 1.00 0.00 H new ATOM 0 HA TYR A 108 1.108 -10.227 -2.631 1.00 0.00 H new ATOM 0 HB2 TYR A 108 3.240 -10.569 -4.808 1.00 0.00 H new ATOM 0 HB3 TYR A 108 3.240 -9.371 -3.528 1.00 0.00 H new ATOM 0 HD1 TYR A 108 2.706 -10.915 -1.113 1.00 0.00 H new ATOM 0 HD2 TYR A 108 5.087 -11.945 -4.492 1.00 0.00 H new ATOM 0 HE1 TYR A 108 4.094 -12.464 0.330 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.469 -13.491 -3.039 1.00 0.00 H new ATOM 0 HH TYR A 108 6.774 -14.292 -1.067 1.00 0.00 H new ATOM 1318 N ASN A 109 0.444 -8.532 -4.348 1.00 0.00 N ATOM 1319 CA ASN A 109 -0.240 -7.653 -5.280 1.00 0.00 C ATOM 1320 C ASN A 109 0.569 -6.365 -5.448 1.00 0.00 C ATOM 1321 O ASN A 109 0.099 -5.283 -5.102 1.00 0.00 O ATOM 1322 CB ASN A 109 -1.629 -7.274 -4.762 1.00 0.00 C ATOM 1323 CG ASN A 109 -2.539 -8.501 -4.683 1.00 0.00 C ATOM 1324 OD1 ASN A 109 -3.193 -8.763 -5.811 1.00 0.00 O flip ATOM 1325 ND2 ASN A 109 -2.640 -9.167 -3.666 1.00 0.00 N flip ATOM 0 H ASN A 109 0.659 -8.111 -3.444 1.00 0.00 H new ATOM 0 HA ASN A 109 -0.340 -8.181 -6.229 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -1.541 -6.818 -3.776 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -2.075 -6.528 -5.420 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -2.109 -8.911 -2.834 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -3.255 -9.980 -3.648 1.00 0.00 H new ATOM 1332 N THR A 110 1.773 -6.526 -5.978 1.00 0.00 N ATOM 1333 CA THR A 110 2.652 -5.390 -6.196 1.00 0.00 C ATOM 1334 C THR A 110 1.945 -4.321 -7.031 1.00 0.00 C ATOM 1335 O THR A 110 1.910 -4.409 -8.258 1.00 0.00 O ATOM 1336 CB THR A 110 3.942 -5.906 -6.835 1.00 0.00 C ATOM 1337 OG1 THR A 110 3.516 -6.464 -8.075 1.00 0.00 O ATOM 1338 CG2 THR A 110 4.536 -7.095 -6.077 1.00 0.00 C ATOM 0 H THR A 110 2.160 -7.426 -6.263 1.00 0.00 H new ATOM 0 HA THR A 110 2.911 -4.904 -5.255 1.00 0.00 H new ATOM 0 HB THR A 110 4.674 -5.099 -6.877 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.078 -7.326 -7.913 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.450 -7.422 -6.572 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.764 -6.797 -5.054 1.00 0.00 H new ATOM 0 HG23 THR A 110 3.817 -7.914 -6.064 1.00 0.00 H new ATOM 1346 N TYR A 111 1.400 -3.335 -6.334 1.00 0.00 N ATOM 1347 CA TYR A 111 0.696 -2.250 -6.997 1.00 0.00 C ATOM 1348 C TYR A 111 1.679 -1.225 -7.564 1.00 0.00 C ATOM 1349 O TYR A 111 2.892 -1.403 -7.468 1.00 0.00 O ATOM 1350 CB TYR A 111 -0.156 -1.579 -5.917 1.00 0.00 C ATOM 1351 CG TYR A 111 -0.966 -2.559 -5.066 1.00 0.00 C ATOM 1352 CD1 TYR A 111 -0.414 -3.099 -3.922 1.00 0.00 C ATOM 1353 CD2 TYR A 111 -2.249 -2.902 -5.441 1.00 0.00 C ATOM 1354 CE1 TYR A 111 -1.177 -4.021 -3.121 1.00 0.00 C ATOM 1355 CE2 TYR A 111 -3.012 -3.824 -4.640 1.00 0.00 C ATOM 1356 CZ TYR A 111 -2.438 -4.338 -3.519 1.00 0.00 C ATOM 1357 OH TYR A 111 -3.158 -5.208 -2.762 1.00 0.00 O ATOM 0 H TYR A 111 1.432 -3.264 -5.317 1.00 0.00 H new ATOM 0 HA TYR A 111 0.098 -2.629 -7.826 1.00 0.00 H new ATOM 0 HB2 TYR A 111 0.495 -0.998 -5.264 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.840 -0.876 -6.393 1.00 0.00 H new ATOM 0 HD1 TYR A 111 0.590 -2.830 -3.628 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.681 -2.479 -6.336 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -0.757 -4.451 -2.224 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -4.017 -4.101 -4.923 1.00 0.00 H new ATOM 0 HH TYR A 111 -2.654 -5.432 -1.952 1.00 0.00 H new ATOM 1367 N ILE A 112 1.119 -0.173 -8.144 1.00 0.00 N ATOM 1368 CA ILE A 112 1.931 0.881 -8.727 1.00 0.00 C ATOM 1369 C ILE A 112 1.097 2.158 -8.841 1.00 0.00 C ATOM 1370 O ILE A 112 -0.032 2.125 -9.330 1.00 0.00 O ATOM 1371 CB ILE A 112 2.534 0.420 -10.056 1.00 0.00 C ATOM 1372 CG1 ILE A 112 4.063 0.470 -10.011 1.00 0.00 C ATOM 1373 CG2 ILE A 112 1.968 1.229 -11.225 1.00 0.00 C ATOM 1374 CD1 ILE A 112 4.666 -0.036 -11.322 1.00 0.00 C ATOM 0 H ILE A 112 0.112 -0.028 -8.222 1.00 0.00 H new ATOM 0 HA ILE A 112 2.778 1.110 -8.081 1.00 0.00 H new ATOM 0 HB ILE A 112 2.250 -0.620 -10.217 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.392 1.493 -9.826 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.426 -0.137 -9.181 1.00 0.00 H new ATOM 0 HG21 ILE A 112 2.413 0.881 -12.157 1.00 0.00 H new ATOM 0 HG22 ILE A 112 0.887 1.098 -11.268 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.201 2.284 -11.083 1.00 0.00 H new ATOM 0 HD11 ILE A 112 5.753 0.010 -11.264 1.00 0.00 H new ATOM 0 HD12 ILE A 112 4.355 -1.067 -11.492 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.320 0.588 -12.146 1.00 0.00 H new ATOM 1386 N SER A 113 1.683 3.254 -8.381 1.00 0.00 N ATOM 1387 CA SER A 113 1.008 4.539 -8.425 1.00 0.00 C ATOM 1388 C SER A 113 0.288 4.707 -9.764 1.00 0.00 C ATOM 1389 O SER A 113 0.896 5.115 -10.753 1.00 0.00 O ATOM 1390 CB SER A 113 1.995 5.688 -8.205 1.00 0.00 C ATOM 1391 OG SER A 113 1.334 6.945 -8.090 1.00 0.00 O ATOM 0 H SER A 113 2.619 3.278 -7.976 1.00 0.00 H new ATOM 0 HA SER A 113 0.274 4.567 -7.619 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.575 5.500 -7.302 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.700 5.724 -9.035 1.00 0.00 H new ATOM 0 HG SER A 113 1.194 7.324 -8.983 1.00 0.00 H new ATOM 1397 N LYS A 114 -0.997 4.383 -9.754 1.00 0.00 N ATOM 1398 CA LYS A 114 -1.805 4.492 -10.956 1.00 0.00 C ATOM 1399 C LYS A 114 -1.882 5.960 -11.383 1.00 0.00 C ATOM 1400 O LYS A 114 -2.112 6.258 -12.553 1.00 0.00 O ATOM 1401 CB LYS A 114 -3.174 3.842 -10.742 1.00 0.00 C ATOM 1402 CG LYS A 114 -3.945 3.740 -12.060 1.00 0.00 C ATOM 1403 CD LYS A 114 -4.862 2.516 -12.066 1.00 0.00 C ATOM 1404 CE LYS A 114 -5.511 2.324 -13.437 1.00 0.00 C ATOM 1405 NZ LYS A 114 -4.612 2.805 -14.509 1.00 0.00 N ATOM 0 H LYS A 114 -1.498 4.045 -8.932 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.342 3.944 -11.777 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.046 2.848 -10.314 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.750 4.426 -10.024 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -4.537 4.643 -12.210 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.243 3.677 -12.892 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -4.289 1.627 -11.803 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -5.635 2.633 -11.307 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -5.740 1.270 -13.593 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -6.456 2.865 -13.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -4.837 2.313 -15.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -4.742 3.829 -14.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -3.624 2.611 -14.247 1.00 0.00 H new ATOM 1419 N LYS A 115 -1.683 6.836 -10.409 1.00 0.00 N ATOM 1420 CA LYS A 115 -1.727 8.265 -10.669 1.00 0.00 C ATOM 1421 C LYS A 115 -0.550 8.652 -11.567 1.00 0.00 C ATOM 1422 O LYS A 115 -0.495 9.770 -12.078 1.00 0.00 O ATOM 1423 CB LYS A 115 -1.781 9.047 -9.356 1.00 0.00 C ATOM 1424 CG LYS A 115 -2.668 10.287 -9.491 1.00 0.00 C ATOM 1425 CD LYS A 115 -1.872 11.564 -9.215 1.00 0.00 C ATOM 1426 CE LYS A 115 -1.482 12.260 -10.521 1.00 0.00 C ATOM 1427 NZ LYS A 115 -2.659 12.393 -11.409 1.00 0.00 N ATOM 0 H LYS A 115 -1.491 6.584 -9.439 1.00 0.00 H new ATOM 0 HA LYS A 115 -2.638 8.526 -11.207 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.165 8.406 -8.562 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -0.774 9.346 -9.065 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -3.091 10.328 -10.495 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.504 10.218 -8.795 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -2.466 12.241 -8.601 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -0.975 11.322 -8.646 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -1.068 13.245 -10.306 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.701 11.690 -11.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -2.579 13.270 -11.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.701 11.578 -12.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -3.525 12.424 -10.835 1.00 0.00 H new ATOM 1441 N HIS A 116 0.363 7.706 -11.732 1.00 0.00 N ATOM 1442 CA HIS A 116 1.536 7.934 -12.559 1.00 0.00 C ATOM 1443 C HIS A 116 2.410 6.678 -12.566 1.00 0.00 C ATOM 1444 O HIS A 116 3.563 6.717 -12.138 1.00 0.00 O ATOM 1445 CB HIS A 116 2.293 9.180 -12.097 1.00 0.00 C ATOM 1446 CG HIS A 116 1.964 9.612 -10.688 1.00 0.00 C ATOM 1447 ND1 HIS A 116 2.081 8.767 -9.598 1.00 0.00 N ATOM 1448 CD2 HIS A 116 1.521 10.807 -10.202 1.00 0.00 C ATOM 1449 CE1 HIS A 116 1.721 9.434 -8.511 1.00 0.00 C ATOM 1450 NE2 HIS A 116 1.375 10.698 -8.888 1.00 0.00 N ATOM 0 H HIS A 116 0.314 6.780 -11.307 1.00 0.00 H new ATOM 0 HA HIS A 116 1.229 8.127 -13.587 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.364 8.988 -12.167 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.071 10.001 -12.779 1.00 0.00 H new ATOM 0 HD2 HIS A 116 1.323 11.692 -10.788 1.00 0.00 H new ATOM 0 HE1 HIS A 116 1.705 9.045 -7.504 1.00 0.00 H new ATOM 0 HE2 HIS A 116 1.056 11.438 -8.262 1.00 0.00 H new ATOM 1458 N ALA A 117 1.829 5.594 -13.059 1.00 0.00 N ATOM 1459 CA ALA A 117 2.541 4.329 -13.128 1.00 0.00 C ATOM 1460 C ALA A 117 3.599 4.404 -14.230 1.00 0.00 C ATOM 1461 O ALA A 117 4.494 3.562 -14.294 1.00 0.00 O ATOM 1462 CB ALA A 117 1.542 3.193 -13.355 1.00 0.00 C ATOM 0 H ALA A 117 0.873 5.566 -13.414 1.00 0.00 H new ATOM 0 HA ALA A 117 3.057 4.127 -12.189 1.00 0.00 H new ATOM 0 HB1 ALA A 117 2.076 2.244 -13.407 1.00 0.00 H new ATOM 0 HB2 ALA A 117 0.830 3.164 -12.530 1.00 0.00 H new ATOM 0 HB3 ALA A 117 1.007 3.360 -14.290 1.00 0.00 H new ATOM 1468 N GLU A 118 3.462 5.419 -15.070 1.00 0.00 N ATOM 1469 CA GLU A 118 4.395 5.615 -16.166 1.00 0.00 C ATOM 1470 C GLU A 118 5.821 5.761 -15.630 1.00 0.00 C ATOM 1471 O GLU A 118 6.787 5.609 -16.376 1.00 0.00 O ATOM 1472 CB GLU A 118 4.001 6.826 -17.013 1.00 0.00 C ATOM 1473 CG GLU A 118 5.180 7.313 -17.858 1.00 0.00 C ATOM 1474 CD GLU A 118 4.695 8.113 -19.068 1.00 0.00 C ATOM 1475 OE1 GLU A 118 4.269 7.461 -20.046 1.00 0.00 O ATOM 1476 OE2 GLU A 118 4.760 9.359 -18.987 1.00 0.00 O ATOM 0 H GLU A 118 2.718 6.115 -15.014 1.00 0.00 H new ATOM 0 HA GLU A 118 4.358 4.736 -16.810 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.167 6.563 -17.664 1.00 0.00 H new ATOM 0 HB3 GLU A 118 3.657 7.631 -16.364 1.00 0.00 H new ATOM 0 HG2 GLU A 118 5.838 7.932 -17.248 1.00 0.00 H new ATOM 0 HG3 GLU A 118 5.768 6.459 -18.194 1.00 0.00 H new ATOM 1483 N LYS A 119 5.907 6.054 -14.341 1.00 0.00 N ATOM 1484 CA LYS A 119 7.198 6.223 -13.696 1.00 0.00 C ATOM 1485 C LYS A 119 7.559 4.940 -12.945 1.00 0.00 C ATOM 1486 O LYS A 119 8.636 4.843 -12.357 1.00 0.00 O ATOM 1487 CB LYS A 119 7.197 7.473 -12.813 1.00 0.00 C ATOM 1488 CG LYS A 119 8.203 8.506 -13.324 1.00 0.00 C ATOM 1489 CD LYS A 119 7.816 9.916 -12.875 1.00 0.00 C ATOM 1490 CE LYS A 119 7.568 10.826 -14.080 1.00 0.00 C ATOM 1491 NZ LYS A 119 8.077 12.190 -13.813 1.00 0.00 N ATOM 0 H LYS A 119 5.103 6.179 -13.725 1.00 0.00 H new ATOM 0 HA LYS A 119 7.977 6.388 -14.440 1.00 0.00 H new ATOM 0 HB2 LYS A 119 6.199 7.910 -12.796 1.00 0.00 H new ATOM 0 HB3 LYS A 119 7.442 7.198 -11.787 1.00 0.00 H new ATOM 0 HG2 LYS A 119 9.199 8.263 -12.954 1.00 0.00 H new ATOM 0 HG3 LYS A 119 8.249 8.467 -14.412 1.00 0.00 H new ATOM 0 HD2 LYS A 119 6.919 9.872 -12.257 1.00 0.00 H new ATOM 0 HD3 LYS A 119 8.609 10.335 -12.255 1.00 0.00 H new ATOM 0 HE2 LYS A 119 8.059 10.414 -14.961 1.00 0.00 H new ATOM 0 HE3 LYS A 119 6.501 10.866 -14.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 7.901 12.795 -14.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 7.589 12.587 -12.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 9.099 12.149 -13.626 1.00 0.00 H new ATOM 1505 N ASN A 120 6.640 3.987 -12.989 1.00 0.00 N ATOM 1506 CA ASN A 120 6.848 2.714 -12.321 1.00 0.00 C ATOM 1507 C ASN A 120 6.989 2.951 -10.816 1.00 0.00 C ATOM 1508 O ASN A 120 7.787 2.291 -10.152 1.00 0.00 O ATOM 1509 CB ASN A 120 8.128 2.036 -12.814 1.00 0.00 C ATOM 1510 CG ASN A 120 8.028 1.692 -14.301 1.00 0.00 C ATOM 1511 OD1 ASN A 120 8.885 2.028 -15.102 1.00 0.00 O ATOM 1512 ND2 ASN A 120 6.936 1.005 -14.626 1.00 0.00 N ATOM 0 H ASN A 120 5.749 4.071 -13.478 1.00 0.00 H new ATOM 0 HA ASN A 120 5.993 2.074 -12.540 1.00 0.00 H new ATOM 0 HB2 ASN A 120 8.980 2.694 -12.646 1.00 0.00 H new ATOM 0 HB3 ASN A 120 8.308 1.128 -12.238 1.00 0.00 H new ATOM 0 HD21 ASN A 120 6.777 0.728 -15.595 1.00 0.00 H new ATOM 0 HD22 ASN A 120 6.258 0.755 -13.906 1.00 0.00 H new ATOM 1519 N TRP A 121 6.201 3.894 -10.321 1.00 0.00 N ATOM 1520 CA TRP A 121 6.227 4.226 -8.907 1.00 0.00 C ATOM 1521 C TRP A 121 5.420 3.164 -8.157 1.00 0.00 C ATOM 1522 O TRP A 121 4.197 3.260 -8.063 1.00 0.00 O ATOM 1523 CB TRP A 121 5.713 5.647 -8.667 1.00 0.00 C ATOM 1524 CG TRP A 121 6.693 6.742 -9.091 1.00 0.00 C ATOM 1525 CD1 TRP A 121 8.008 6.630 -9.320 1.00 0.00 C ATOM 1526 CD2 TRP A 121 6.379 8.131 -9.331 1.00 0.00 C ATOM 1527 NE1 TRP A 121 8.564 7.839 -9.687 1.00 0.00 N ATOM 1528 CE2 TRP A 121 7.541 8.780 -9.694 1.00 0.00 C ATOM 1529 CE3 TRP A 121 5.154 8.815 -9.243 1.00 0.00 C ATOM 1530 CZ2 TRP A 121 7.593 10.146 -9.998 1.00 0.00 C ATOM 1531 CZ3 TRP A 121 5.223 10.179 -9.550 1.00 0.00 C ATOM 1532 CH2 TRP A 121 6.384 10.848 -9.917 1.00 0.00 C ATOM 0 H TRP A 121 5.540 4.439 -10.875 1.00 0.00 H new ATOM 0 HA TRP A 121 7.249 4.219 -8.528 1.00 0.00 H new ATOM 0 HB2 TRP A 121 4.777 5.781 -9.210 1.00 0.00 H new ATOM 0 HB3 TRP A 121 5.486 5.767 -7.608 1.00 0.00 H new ATOM 0 HD1 TRP A 121 8.564 5.709 -9.229 1.00 0.00 H new ATOM 0 HE1 TRP A 121 9.544 8.010 -9.912 1.00 0.00 H new ATOM 0 HE3 TRP A 121 4.233 8.327 -8.961 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 8.516 10.632 -10.280 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.309 10.752 -9.498 1.00 0.00 H new ATOM 0 HH2 TRP A 121 6.354 11.905 -10.139 1.00 0.00 H new ATOM 1543 N PHE A 122 6.137 2.175 -7.643 1.00 0.00 N ATOM 1544 CA PHE A 122 5.502 1.096 -6.904 1.00 0.00 C ATOM 1545 C PHE A 122 5.107 1.553 -5.498 1.00 0.00 C ATOM 1546 O PHE A 122 5.332 2.704 -5.129 1.00 0.00 O ATOM 1547 CB PHE A 122 6.529 -0.032 -6.792 1.00 0.00 C ATOM 1548 CG PHE A 122 6.488 -1.029 -7.952 1.00 0.00 C ATOM 1549 CD1 PHE A 122 7.166 -0.763 -9.100 1.00 0.00 C ATOM 1550 CD2 PHE A 122 5.774 -2.180 -7.835 1.00 0.00 C ATOM 1551 CE1 PHE A 122 7.129 -1.688 -10.177 1.00 0.00 C ATOM 1552 CE2 PHE A 122 5.736 -3.105 -8.911 1.00 0.00 C ATOM 1553 CZ PHE A 122 6.414 -2.840 -10.060 1.00 0.00 C ATOM 0 H PHE A 122 7.151 2.098 -7.724 1.00 0.00 H new ATOM 0 HA PHE A 122 4.597 0.773 -7.419 1.00 0.00 H new ATOM 0 HB2 PHE A 122 7.527 0.403 -6.736 1.00 0.00 H new ATOM 0 HB3 PHE A 122 6.363 -0.570 -5.858 1.00 0.00 H new ATOM 0 HD1 PHE A 122 7.733 0.152 -9.193 1.00 0.00 H new ATOM 0 HD2 PHE A 122 5.235 -2.391 -6.923 1.00 0.00 H new ATOM 0 HE1 PHE A 122 7.668 -1.477 -11.089 1.00 0.00 H new ATOM 0 HE2 PHE A 122 5.169 -4.019 -8.817 1.00 0.00 H new ATOM 0 HZ PHE A 122 6.385 -3.543 -10.879 1.00 0.00 H new ATOM 1563 N VAL A 123 4.524 0.626 -4.752 1.00 0.00 N ATOM 1564 CA VAL A 123 4.096 0.918 -3.395 1.00 0.00 C ATOM 1565 C VAL A 123 4.935 0.100 -2.412 1.00 0.00 C ATOM 1566 O VAL A 123 4.427 -0.363 -1.392 1.00 0.00 O ATOM 1567 CB VAL A 123 2.594 0.664 -3.254 1.00 0.00 C ATOM 1568 CG1 VAL A 123 2.242 -0.774 -3.643 1.00 0.00 C ATOM 1569 CG2 VAL A 123 2.114 0.981 -1.837 1.00 0.00 C ATOM 0 H VAL A 123 4.338 -0.328 -5.062 1.00 0.00 H new ATOM 0 HA VAL A 123 4.258 1.971 -3.162 1.00 0.00 H new ATOM 0 HB VAL A 123 2.076 1.334 -3.940 1.00 0.00 H new ATOM 0 HG11 VAL A 123 1.168 -0.928 -3.534 1.00 0.00 H new ATOM 0 HG12 VAL A 123 2.531 -0.952 -4.679 1.00 0.00 H new ATOM 0 HG13 VAL A 123 2.776 -1.468 -2.994 1.00 0.00 H new ATOM 0 HG21 VAL A 123 1.043 0.792 -1.765 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.643 0.349 -1.124 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.313 2.029 -1.611 1.00 0.00 H new ATOM 1579 N GLY A 124 6.206 -0.053 -2.753 1.00 0.00 N ATOM 1580 CA GLY A 124 7.121 -0.808 -1.914 1.00 0.00 C ATOM 1581 C GLY A 124 7.862 0.114 -0.944 1.00 0.00 C ATOM 1582 O GLY A 124 8.573 1.025 -1.368 1.00 0.00 O ATOM 0 H GLY A 124 6.624 0.333 -3.599 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.568 -1.562 -1.354 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.840 -1.338 -2.539 1.00 0.00 H new ATOM 1586 N LEU A 125 7.672 -0.153 0.340 1.00 0.00 N ATOM 1587 CA LEU A 125 8.313 0.642 1.373 1.00 0.00 C ATOM 1588 C LEU A 125 9.611 -0.044 1.806 1.00 0.00 C ATOM 1589 O LEU A 125 9.602 -1.216 2.182 1.00 0.00 O ATOM 1590 CB LEU A 125 7.343 0.905 2.526 1.00 0.00 C ATOM 1591 CG LEU A 125 6.017 1.568 2.148 1.00 0.00 C ATOM 1592 CD1 LEU A 125 5.540 2.510 3.256 1.00 0.00 C ATOM 1593 CD2 LEU A 125 6.124 2.280 0.798 1.00 0.00 C ATOM 0 H LEU A 125 7.083 -0.909 0.688 1.00 0.00 H new ATOM 0 HA LEU A 125 8.584 1.624 0.985 1.00 0.00 H new ATOM 0 HB2 LEU A 125 7.125 -0.044 3.015 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.845 1.535 3.261 1.00 0.00 H new ATOM 0 HG LEU A 125 5.264 0.788 2.041 1.00 0.00 H new ATOM 0 HD11 LEU A 125 4.596 2.968 2.962 1.00 0.00 H new ATOM 0 HD12 LEU A 125 5.398 1.945 4.178 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.286 3.288 3.418 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.168 2.742 0.554 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.895 3.048 0.852 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.385 1.557 0.025 1.00 0.00 H new ATOM 1605 N LYS A 126 10.695 0.714 1.738 1.00 0.00 N ATOM 1606 CA LYS A 126 11.997 0.194 2.118 1.00 0.00 C ATOM 1607 C LYS A 126 11.837 -0.745 3.316 1.00 0.00 C ATOM 1608 O LYS A 126 11.180 -0.399 4.296 1.00 0.00 O ATOM 1609 CB LYS A 126 12.981 1.340 2.363 1.00 0.00 C ATOM 1610 CG LYS A 126 14.372 0.804 2.708 1.00 0.00 C ATOM 1611 CD LYS A 126 15.294 1.932 3.177 1.00 0.00 C ATOM 1612 CE LYS A 126 16.710 1.413 3.430 1.00 0.00 C ATOM 1613 NZ LYS A 126 17.486 2.390 4.227 1.00 0.00 N ATOM 0 H LYS A 126 10.698 1.685 1.425 1.00 0.00 H new ATOM 0 HA LYS A 126 12.424 -0.394 1.306 1.00 0.00 H new ATOM 0 HB2 LYS A 126 13.040 1.970 1.475 1.00 0.00 H new ATOM 0 HB3 LYS A 126 12.618 1.969 3.176 1.00 0.00 H new ATOM 0 HG2 LYS A 126 14.291 0.048 3.489 1.00 0.00 H new ATOM 0 HG3 LYS A 126 14.804 0.316 1.835 1.00 0.00 H new ATOM 0 HD2 LYS A 126 15.321 2.721 2.425 1.00 0.00 H new ATOM 0 HD3 LYS A 126 14.897 2.375 4.090 1.00 0.00 H new ATOM 0 HE2 LYS A 126 16.665 0.459 3.956 1.00 0.00 H new ATOM 0 HE3 LYS A 126 17.212 1.230 2.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 18.445 2.022 4.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 17.544 3.291 3.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 17.015 2.544 5.141 1.00 0.00 H new ATOM 1627 N LYS A 127 12.449 -1.914 3.197 1.00 0.00 N ATOM 1628 CA LYS A 127 12.382 -2.905 4.257 1.00 0.00 C ATOM 1629 C LYS A 127 13.182 -2.409 5.464 1.00 0.00 C ATOM 1630 O LYS A 127 14.122 -3.068 5.904 1.00 0.00 O ATOM 1631 CB LYS A 127 12.833 -4.273 3.741 1.00 0.00 C ATOM 1632 CG LYS A 127 14.271 -4.215 3.219 1.00 0.00 C ATOM 1633 CD LYS A 127 15.259 -4.706 4.280 1.00 0.00 C ATOM 1634 CE LYS A 127 16.239 -5.721 3.688 1.00 0.00 C ATOM 1635 NZ LYS A 127 17.196 -6.179 4.720 1.00 0.00 N ATOM 0 H LYS A 127 12.994 -2.197 2.382 1.00 0.00 H new ATOM 0 HA LYS A 127 11.352 -3.039 4.589 1.00 0.00 H new ATOM 0 HB2 LYS A 127 12.762 -5.009 4.542 1.00 0.00 H new ATOM 0 HB3 LYS A 127 12.166 -4.603 2.945 1.00 0.00 H new ATOM 0 HG2 LYS A 127 14.361 -4.827 2.322 1.00 0.00 H new ATOM 0 HG3 LYS A 127 14.517 -3.192 2.933 1.00 0.00 H new ATOM 0 HD2 LYS A 127 15.810 -3.859 4.689 1.00 0.00 H new ATOM 0 HD3 LYS A 127 14.714 -5.161 5.107 1.00 0.00 H new ATOM 0 HE2 LYS A 127 15.691 -6.574 3.288 1.00 0.00 H new ATOM 0 HE3 LYS A 127 16.780 -5.271 2.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 17.854 -6.867 4.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 17.731 -5.365 5.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 16.676 -6.627 5.501 1.00 0.00 H new ATOM 1649 N ASN A 128 12.778 -1.250 5.965 1.00 0.00 N ATOM 1650 CA ASN A 128 13.445 -0.658 7.112 1.00 0.00 C ATOM 1651 C ASN A 128 12.407 0.028 8.002 1.00 0.00 C ATOM 1652 O ASN A 128 12.426 -0.131 9.221 1.00 0.00 O ATOM 1653 CB ASN A 128 14.464 0.396 6.674 1.00 0.00 C ATOM 1654 CG ASN A 128 15.827 -0.241 6.397 1.00 0.00 C ATOM 1655 OD1 ASN A 128 15.988 -1.066 5.513 1.00 0.00 O ATOM 1656 ND2 ASN A 128 16.797 0.187 7.201 1.00 0.00 N ATOM 0 H ASN A 128 11.998 -0.706 5.597 1.00 0.00 H new ATOM 0 HA ASN A 128 13.959 -1.454 7.651 1.00 0.00 H new ATOM 0 HB2 ASN A 128 14.106 0.902 5.777 1.00 0.00 H new ATOM 0 HB3 ASN A 128 14.564 1.155 7.450 1.00 0.00 H new ATOM 0 HD21 ASN A 128 17.744 -0.178 7.097 1.00 0.00 H new ATOM 0 HD22 ASN A 128 16.594 0.880 7.921 1.00 0.00 H new ATOM 1663 N GLY A 129 11.525 0.777 7.357 1.00 0.00 N ATOM 1664 CA GLY A 129 10.481 1.489 8.074 1.00 0.00 C ATOM 1665 C GLY A 129 10.406 2.950 7.626 1.00 0.00 C ATOM 1666 O GLY A 129 10.782 3.852 8.373 1.00 0.00 O ATOM 0 H GLY A 129 11.512 0.906 6.345 1.00 0.00 H new ATOM 0 HA2 GLY A 129 9.521 1.003 7.903 1.00 0.00 H new ATOM 0 HA3 GLY A 129 10.675 1.443 9.146 1.00 0.00 H new ATOM 1670 N SER A 130 9.917 3.139 6.409 1.00 0.00 N ATOM 1671 CA SER A 130 9.788 4.475 5.853 1.00 0.00 C ATOM 1672 C SER A 130 9.438 4.391 4.366 1.00 0.00 C ATOM 1673 O SER A 130 10.188 3.815 3.580 1.00 0.00 O ATOM 1674 CB SER A 130 11.074 5.280 6.051 1.00 0.00 C ATOM 1675 OG SER A 130 11.078 5.982 7.291 1.00 0.00 O ATOM 0 H SER A 130 9.605 2.389 5.792 1.00 0.00 H new ATOM 0 HA SER A 130 8.985 4.989 6.380 1.00 0.00 H new ATOM 0 HB2 SER A 130 11.932 4.609 6.012 1.00 0.00 H new ATOM 0 HB3 SER A 130 11.187 5.990 5.232 1.00 0.00 H new ATOM 0 HG SER A 130 11.221 5.349 8.025 1.00 0.00 H new ATOM 1681 N CYS A 131 8.298 4.975 4.026 1.00 0.00 N ATOM 1682 CA CYS A 131 7.839 4.973 2.647 1.00 0.00 C ATOM 1683 C CYS A 131 8.994 5.433 1.756 1.00 0.00 C ATOM 1684 O CYS A 131 9.904 6.120 2.218 1.00 0.00 O ATOM 1685 CB CYS A 131 6.595 5.845 2.464 1.00 0.00 C ATOM 1686 SG CYS A 131 6.197 6.002 0.685 1.00 0.00 S ATOM 0 H CYS A 131 7.679 5.452 4.681 1.00 0.00 H new ATOM 0 HA CYS A 131 7.541 3.964 2.362 1.00 0.00 H new ATOM 0 HB2 CYS A 131 5.751 5.406 2.996 1.00 0.00 H new ATOM 0 HB3 CYS A 131 6.766 6.831 2.895 1.00 0.00 H new ATOM 0 HG CYS A 131 7.206 6.533 0.060 1.00 0.00 H new ATOM 1692 N LYS A 132 8.921 5.036 0.494 1.00 0.00 N ATOM 1693 CA LYS A 132 9.949 5.399 -0.466 1.00 0.00 C ATOM 1694 C LYS A 132 9.473 6.599 -1.288 1.00 0.00 C ATOM 1695 O LYS A 132 8.300 6.966 -1.234 1.00 0.00 O ATOM 1696 CB LYS A 132 10.341 4.188 -1.315 1.00 0.00 C ATOM 1697 CG LYS A 132 11.856 4.130 -1.522 1.00 0.00 C ATOM 1698 CD LYS A 132 12.591 4.086 -0.181 1.00 0.00 C ATOM 1699 CE LYS A 132 13.479 5.319 -0.001 1.00 0.00 C ATOM 1700 NZ LYS A 132 12.882 6.248 0.984 1.00 0.00 N ATOM 0 H LYS A 132 8.165 4.466 0.114 1.00 0.00 H new ATOM 0 HA LYS A 132 10.859 5.706 0.049 1.00 0.00 H new ATOM 0 HB2 LYS A 132 10.002 3.273 -0.829 1.00 0.00 H new ATOM 0 HB3 LYS A 132 9.840 4.240 -2.282 1.00 0.00 H new ATOM 0 HG2 LYS A 132 12.113 3.249 -2.111 1.00 0.00 H new ATOM 0 HG3 LYS A 132 12.182 5.000 -2.091 1.00 0.00 H new ATOM 0 HD2 LYS A 132 11.868 4.033 0.633 1.00 0.00 H new ATOM 0 HD3 LYS A 132 13.200 3.184 -0.126 1.00 0.00 H new ATOM 0 HE2 LYS A 132 14.471 5.014 0.332 1.00 0.00 H new ATOM 0 HE3 LYS A 132 13.606 5.826 -0.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 13.637 6.695 1.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 12.339 6.981 0.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 12.249 5.721 1.619 1.00 0.00 H new ATOM 1714 N ARG A 133 10.407 7.176 -2.029 1.00 0.00 N ATOM 1715 CA ARG A 133 10.098 8.326 -2.861 1.00 0.00 C ATOM 1716 C ARG A 133 9.882 7.890 -4.311 1.00 0.00 C ATOM 1717 O ARG A 133 10.451 6.894 -4.755 1.00 0.00 O ATOM 1718 CB ARG A 133 11.223 9.362 -2.809 1.00 0.00 C ATOM 1719 CG ARG A 133 12.499 8.819 -3.455 1.00 0.00 C ATOM 1720 CD ARG A 133 13.555 9.917 -3.590 1.00 0.00 C ATOM 1721 NE ARG A 133 14.280 10.082 -2.311 1.00 0.00 N ATOM 1722 CZ ARG A 133 13.860 10.861 -1.304 1.00 0.00 C ATOM 1723 NH1 ARG A 133 12.717 11.550 -1.423 1.00 0.00 N ATOM 1724 NH2 ARG A 133 14.583 10.950 -0.179 1.00 0.00 N ATOM 0 H ARG A 133 11.379 6.868 -2.071 1.00 0.00 H new ATOM 0 HA ARG A 133 9.185 8.779 -2.475 1.00 0.00 H new ATOM 0 HB2 ARG A 133 10.909 10.271 -3.323 1.00 0.00 H new ATOM 0 HB3 ARG A 133 11.423 9.635 -1.773 1.00 0.00 H new ATOM 0 HG2 ARG A 133 12.895 8.000 -2.854 1.00 0.00 H new ATOM 0 HG3 ARG A 133 12.267 8.410 -4.438 1.00 0.00 H new ATOM 0 HD2 ARG A 133 14.256 9.663 -4.385 1.00 0.00 H new ATOM 0 HD3 ARG A 133 13.080 10.857 -3.872 1.00 0.00 H new ATOM 0 HE ARG A 133 15.154 9.571 -2.188 1.00 0.00 H new ATOM 0 HH11 ARG A 133 12.167 11.482 -2.279 1.00 0.00 H new ATOM 0 HH12 ARG A 133 12.397 12.143 -0.657 1.00 0.00 H new ATOM 0 HH21 ARG A 133 15.453 10.425 -0.089 1.00 0.00 H new ATOM 0 HH22 ARG A 133 14.263 11.543 0.587 1.00 0.00 H new ATOM 1738 N GLY A 134 9.058 8.657 -5.010 1.00 0.00 N ATOM 1739 CA GLY A 134 8.761 8.362 -6.401 1.00 0.00 C ATOM 1740 C GLY A 134 10.007 7.864 -7.135 1.00 0.00 C ATOM 1741 O GLY A 134 9.990 6.793 -7.740 1.00 0.00 O ATOM 0 H GLY A 134 8.587 9.482 -4.639 1.00 0.00 H new ATOM 0 HA2 GLY A 134 7.976 7.608 -6.457 1.00 0.00 H new ATOM 0 HA3 GLY A 134 8.379 9.257 -6.892 1.00 0.00 H new ATOM 1745 N PRO A 135 11.088 8.686 -7.056 1.00 0.00 N ATOM 1746 CA PRO A 135 12.341 8.340 -7.706 1.00 0.00 C ATOM 1747 C PRO A 135 13.075 7.243 -6.932 1.00 0.00 C ATOM 1748 O PRO A 135 14.255 7.386 -6.616 1.00 0.00 O ATOM 1749 CB PRO A 135 13.121 9.643 -7.774 1.00 0.00 C ATOM 1750 CG PRO A 135 12.480 10.567 -6.752 1.00 0.00 C ATOM 1751 CD PRO A 135 11.145 9.962 -6.349 1.00 0.00 C ATOM 0 HA PRO A 135 12.198 7.925 -8.703 1.00 0.00 H new ATOM 0 HB2 PRO A 135 14.174 9.480 -7.546 1.00 0.00 H new ATOM 0 HB3 PRO A 135 13.074 10.074 -8.774 1.00 0.00 H new ATOM 0 HG2 PRO A 135 13.126 10.680 -5.881 1.00 0.00 H new ATOM 0 HG3 PRO A 135 12.336 11.562 -7.174 1.00 0.00 H new ATOM 0 HD2 PRO A 135 11.084 9.820 -5.270 1.00 0.00 H new ATOM 0 HD3 PRO A 135 10.315 10.609 -6.633 1.00 0.00 H new ATOM 1759 N ARG A 136 12.346 6.174 -6.648 1.00 0.00 N ATOM 1760 CA ARG A 136 12.913 5.054 -5.917 1.00 0.00 C ATOM 1761 C ARG A 136 11.810 4.080 -5.498 1.00 0.00 C ATOM 1762 O ARG A 136 11.841 3.539 -4.394 1.00 0.00 O ATOM 1763 CB ARG A 136 13.663 5.531 -4.672 1.00 0.00 C ATOM 1764 CG ARG A 136 15.166 5.628 -4.941 1.00 0.00 C ATOM 1765 CD ARG A 136 15.960 4.834 -3.902 1.00 0.00 C ATOM 1766 NE ARG A 136 17.402 5.148 -4.019 1.00 0.00 N ATOM 1767 CZ ARG A 136 18.384 4.337 -3.601 1.00 0.00 C ATOM 1768 NH1 ARG A 136 18.085 3.160 -3.035 1.00 0.00 N ATOM 1769 NH2 ARG A 136 19.664 4.704 -3.748 1.00 0.00 N ATOM 0 H ARG A 136 11.367 6.060 -6.911 1.00 0.00 H new ATOM 0 HA ARG A 136 13.616 4.549 -6.579 1.00 0.00 H new ATOM 0 HB2 ARG A 136 13.282 6.504 -4.364 1.00 0.00 H new ATOM 0 HB3 ARG A 136 13.481 4.842 -3.847 1.00 0.00 H new ATOM 0 HG2 ARG A 136 15.386 5.249 -5.939 1.00 0.00 H new ATOM 0 HG3 ARG A 136 15.476 6.673 -4.921 1.00 0.00 H new ATOM 0 HD2 ARG A 136 15.607 5.076 -2.900 1.00 0.00 H new ATOM 0 HD3 ARG A 136 15.799 3.766 -4.048 1.00 0.00 H new ATOM 0 HE ARG A 136 17.665 6.037 -4.444 1.00 0.00 H new ATOM 0 HH11 ARG A 136 17.110 2.881 -2.922 1.00 0.00 H new ATOM 0 HH12 ARG A 136 18.832 2.543 -2.717 1.00 0.00 H new ATOM 0 HH21 ARG A 136 19.891 5.601 -4.178 1.00 0.00 H new ATOM 0 HH22 ARG A 136 20.411 4.087 -3.430 1.00 0.00 H new ATOM 1783 N THR A 137 10.860 3.888 -6.401 1.00 0.00 N ATOM 1784 CA THR A 137 9.748 2.989 -6.139 1.00 0.00 C ATOM 1785 C THR A 137 9.619 1.959 -7.262 1.00 0.00 C ATOM 1786 O THR A 137 8.588 1.890 -7.930 1.00 0.00 O ATOM 1787 CB THR A 137 8.490 3.837 -5.944 1.00 0.00 C ATOM 1788 OG1 THR A 137 8.978 5.175 -5.895 1.00 0.00 O ATOM 1789 CG2 THR A 137 7.847 3.625 -4.572 1.00 0.00 C ATOM 0 H THR A 137 10.837 4.340 -7.315 1.00 0.00 H new ATOM 0 HA THR A 137 9.912 2.412 -5.229 1.00 0.00 H new ATOM 0 HB THR A 137 7.767 3.598 -6.724 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.128 5.502 -6.807 1.00 0.00 H new ATOM 0 HG21 THR A 137 6.958 4.250 -4.486 1.00 0.00 H new ATOM 0 HG22 THR A 137 7.566 2.578 -4.460 1.00 0.00 H new ATOM 0 HG23 THR A 137 8.558 3.896 -3.791 1.00 0.00 H new ATOM 1797 N HIS A 138 10.679 1.183 -7.435 1.00 0.00 N ATOM 1798 CA HIS A 138 10.696 0.159 -8.467 1.00 0.00 C ATOM 1799 C HIS A 138 11.190 -1.161 -7.871 1.00 0.00 C ATOM 1800 O HIS A 138 12.186 -1.186 -7.149 1.00 0.00 O ATOM 1801 CB HIS A 138 11.526 0.614 -9.669 1.00 0.00 C ATOM 1802 CG HIS A 138 11.442 2.096 -9.948 1.00 0.00 C ATOM 1803 ND1 HIS A 138 11.627 3.055 -8.967 1.00 0.00 N ATOM 1804 CD2 HIS A 138 11.193 2.772 -11.106 1.00 0.00 C ATOM 1805 CE1 HIS A 138 11.492 4.251 -9.521 1.00 0.00 C ATOM 1806 NE2 HIS A 138 11.223 4.073 -10.847 1.00 0.00 N ATOM 0 H HIS A 138 11.532 1.242 -6.879 1.00 0.00 H new ATOM 0 HA HIS A 138 9.685 -0.006 -8.839 1.00 0.00 H new ATOM 0 HB2 HIS A 138 12.569 0.345 -9.500 1.00 0.00 H new ATOM 0 HB3 HIS A 138 11.195 0.069 -10.553 1.00 0.00 H new ATOM 0 HD2 HIS A 138 11.004 2.324 -12.070 1.00 0.00 H new ATOM 0 HE1 HIS A 138 11.579 5.200 -9.013 1.00 0.00 H new ATOM 0 HE2 HIS A 138 11.070 4.818 -11.527 1.00 0.00 H new ATOM 1814 N TYR A 139 10.470 -2.225 -8.195 1.00 0.00 N ATOM 1815 CA TYR A 139 10.822 -3.545 -7.701 1.00 0.00 C ATOM 1816 C TYR A 139 12.271 -3.892 -8.048 1.00 0.00 C ATOM 1817 O TYR A 139 13.020 -3.041 -8.525 1.00 0.00 O ATOM 1818 CB TYR A 139 9.890 -4.525 -8.416 1.00 0.00 C ATOM 1819 CG TYR A 139 10.355 -4.915 -9.820 1.00 0.00 C ATOM 1820 CD1 TYR A 139 10.125 -4.066 -10.884 1.00 0.00 C ATOM 1821 CD2 TYR A 139 11.005 -6.115 -10.024 1.00 0.00 C ATOM 1822 CE1 TYR A 139 10.564 -4.432 -12.205 1.00 0.00 C ATOM 1823 CE2 TYR A 139 11.443 -6.482 -11.345 1.00 0.00 C ATOM 1824 CZ TYR A 139 11.201 -5.622 -12.371 1.00 0.00 C ATOM 1825 OH TYR A 139 11.614 -5.969 -13.620 1.00 0.00 O ATOM 0 H TYR A 139 9.644 -2.200 -8.794 1.00 0.00 H new ATOM 0 HA TYR A 139 10.722 -3.588 -6.616 1.00 0.00 H new ATOM 0 HB2 TYR A 139 9.796 -5.427 -7.812 1.00 0.00 H new ATOM 0 HB3 TYR A 139 8.896 -4.082 -8.484 1.00 0.00 H new ATOM 0 HD1 TYR A 139 9.616 -3.127 -10.725 1.00 0.00 H new ATOM 0 HD2 TYR A 139 11.185 -6.779 -9.192 1.00 0.00 H new ATOM 0 HE1 TYR A 139 10.391 -3.776 -13.046 1.00 0.00 H new ATOM 0 HE2 TYR A 139 11.952 -7.419 -11.518 1.00 0.00 H new ATOM 0 HH TYR A 139 12.054 -6.844 -13.588 1.00 0.00 H new ATOM 1835 N GLY A 140 12.623 -5.144 -7.796 1.00 0.00 N ATOM 1836 CA GLY A 140 13.969 -5.615 -8.076 1.00 0.00 C ATOM 1837 C GLY A 140 14.426 -6.628 -7.025 1.00 0.00 C ATOM 1838 O GLY A 140 15.388 -7.362 -7.242 1.00 0.00 O ATOM 0 H GLY A 140 11.999 -5.847 -7.401 1.00 0.00 H new ATOM 0 HA2 GLY A 140 13.999 -6.073 -9.065 1.00 0.00 H new ATOM 0 HA3 GLY A 140 14.657 -4.770 -8.095 1.00 0.00 H new ATOM 1842 N GLN A 141 13.713 -6.635 -5.908 1.00 0.00 N ATOM 1843 CA GLN A 141 14.034 -7.546 -4.822 1.00 0.00 C ATOM 1844 C GLN A 141 12.758 -8.190 -4.275 1.00 0.00 C ATOM 1845 O GLN A 141 12.449 -9.335 -4.599 1.00 0.00 O ATOM 1846 CB GLN A 141 14.804 -6.827 -3.712 1.00 0.00 C ATOM 1847 CG GLN A 141 16.301 -7.130 -3.800 1.00 0.00 C ATOM 1848 CD GLN A 141 16.999 -6.172 -4.768 1.00 0.00 C ATOM 1849 OE1 GLN A 141 17.398 -6.744 -5.901 1.00 0.00 O flip ATOM 1850 NE2 GLN A 141 17.164 -4.993 -4.504 1.00 0.00 N flip ATOM 0 H GLN A 141 12.915 -6.025 -5.732 1.00 0.00 H new ATOM 0 HA GLN A 141 14.677 -8.334 -5.213 1.00 0.00 H new ATOM 0 HB2 GLN A 141 14.642 -5.752 -3.789 1.00 0.00 H new ATOM 0 HB3 GLN A 141 14.423 -7.138 -2.739 1.00 0.00 H new ATOM 0 HG2 GLN A 141 16.751 -7.045 -2.811 1.00 0.00 H new ATOM 0 HG3 GLN A 141 16.449 -8.158 -4.131 1.00 0.00 H new ATOM 0 HE21 GLN A 141 16.833 -4.618 -3.615 1.00 0.00 H new ATOM 0 HE22 GLN A 141 17.633 -4.382 -5.172 1.00 0.00 H new ATOM 1859 N LYS A 142 12.052 -7.425 -3.456 1.00 0.00 N ATOM 1860 CA LYS A 142 10.816 -7.906 -2.861 1.00 0.00 C ATOM 1861 C LYS A 142 10.346 -6.912 -1.798 1.00 0.00 C ATOM 1862 O LYS A 142 9.938 -7.310 -0.708 1.00 0.00 O ATOM 1863 CB LYS A 142 10.995 -9.331 -2.334 1.00 0.00 C ATOM 1864 CG LYS A 142 12.359 -9.500 -1.662 1.00 0.00 C ATOM 1865 CD LYS A 142 13.225 -10.506 -2.423 1.00 0.00 C ATOM 1866 CE LYS A 142 13.828 -11.541 -1.472 1.00 0.00 C ATOM 1867 NZ LYS A 142 13.441 -12.909 -1.883 1.00 0.00 N ATOM 0 H LYS A 142 12.312 -6.475 -3.190 1.00 0.00 H new ATOM 0 HA LYS A 142 10.029 -7.965 -3.613 1.00 0.00 H new ATOM 0 HB2 LYS A 142 10.203 -9.561 -1.621 1.00 0.00 H new ATOM 0 HB3 LYS A 142 10.900 -10.041 -3.156 1.00 0.00 H new ATOM 0 HG2 LYS A 142 12.868 -8.537 -1.617 1.00 0.00 H new ATOM 0 HG3 LYS A 142 12.223 -9.836 -0.634 1.00 0.00 H new ATOM 0 HD2 LYS A 142 12.624 -11.009 -3.180 1.00 0.00 H new ATOM 0 HD3 LYS A 142 14.023 -9.981 -2.948 1.00 0.00 H new ATOM 0 HE2 LYS A 142 14.914 -11.450 -1.467 1.00 0.00 H new ATOM 0 HE3 LYS A 142 13.487 -11.351 -0.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 13.858 -13.600 -1.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 12.405 -12.997 -1.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 13.787 -13.093 -2.846 1.00 0.00 H new ATOM 1881 N ALA A 143 10.418 -5.637 -2.152 1.00 0.00 N ATOM 1882 CA ALA A 143 10.005 -4.583 -1.241 1.00 0.00 C ATOM 1883 C ALA A 143 8.600 -4.111 -1.619 1.00 0.00 C ATOM 1884 O ALA A 143 8.132 -3.085 -1.126 1.00 0.00 O ATOM 1885 CB ALA A 143 11.030 -3.448 -1.275 1.00 0.00 C ATOM 0 H ALA A 143 10.756 -5.310 -3.057 1.00 0.00 H new ATOM 0 HA ALA A 143 9.964 -4.954 -0.217 1.00 0.00 H new ATOM 0 HB1 ALA A 143 10.720 -2.657 -0.592 1.00 0.00 H new ATOM 0 HB2 ALA A 143 12.005 -3.829 -0.971 1.00 0.00 H new ATOM 0 HB3 ALA A 143 11.096 -3.048 -2.287 1.00 0.00 H new ATOM 1891 N ILE A 144 7.965 -4.881 -2.490 1.00 0.00 N ATOM 1892 CA ILE A 144 6.623 -4.555 -2.940 1.00 0.00 C ATOM 1893 C ILE A 144 5.694 -5.738 -2.661 1.00 0.00 C ATOM 1894 O ILE A 144 4.483 -5.565 -2.533 1.00 0.00 O ATOM 1895 CB ILE A 144 6.640 -4.118 -4.406 1.00 0.00 C ATOM 1896 CG1 ILE A 144 7.290 -5.186 -5.288 1.00 0.00 C ATOM 1897 CG2 ILE A 144 7.316 -2.755 -4.564 1.00 0.00 C ATOM 1898 CD1 ILE A 144 7.839 -4.573 -6.578 1.00 0.00 C ATOM 0 H ILE A 144 8.356 -5.731 -2.896 1.00 0.00 H new ATOM 0 HA ILE A 144 6.231 -3.704 -2.383 1.00 0.00 H new ATOM 0 HB ILE A 144 5.609 -4.006 -4.742 1.00 0.00 H new ATOM 0 HG12 ILE A 144 8.097 -5.673 -4.740 1.00 0.00 H new ATOM 0 HG13 ILE A 144 6.559 -5.957 -5.530 1.00 0.00 H new ATOM 0 HG21 ILE A 144 7.315 -2.468 -5.616 1.00 0.00 H new ATOM 0 HG22 ILE A 144 6.772 -2.010 -3.984 1.00 0.00 H new ATOM 0 HG23 ILE A 144 8.344 -2.815 -4.206 1.00 0.00 H new ATOM 0 HD11 ILE A 144 8.296 -5.354 -7.186 1.00 0.00 H new ATOM 0 HD12 ILE A 144 7.025 -4.108 -7.135 1.00 0.00 H new ATOM 0 HD13 ILE A 144 8.588 -3.820 -6.333 1.00 0.00 H new ATOM 1910 N LEU A 145 6.297 -6.915 -2.575 1.00 0.00 N ATOM 1911 CA LEU A 145 5.539 -8.127 -2.314 1.00 0.00 C ATOM 1912 C LEU A 145 4.707 -7.939 -1.044 1.00 0.00 C ATOM 1913 O LEU A 145 5.226 -8.049 0.065 1.00 0.00 O ATOM 1914 CB LEU A 145 6.470 -9.340 -2.265 1.00 0.00 C ATOM 1915 CG LEU A 145 7.555 -9.397 -3.341 1.00 0.00 C ATOM 1916 CD1 LEU A 145 8.012 -10.837 -3.584 1.00 0.00 C ATOM 1917 CD2 LEU A 145 7.086 -8.720 -4.630 1.00 0.00 C ATOM 0 H LEU A 145 7.302 -7.055 -2.681 1.00 0.00 H new ATOM 0 HA LEU A 145 4.840 -8.323 -3.127 1.00 0.00 H new ATOM 0 HB2 LEU A 145 6.953 -9.363 -1.288 1.00 0.00 H new ATOM 0 HB3 LEU A 145 5.863 -10.242 -2.341 1.00 0.00 H new ATOM 0 HG LEU A 145 8.421 -8.841 -2.982 1.00 0.00 H new ATOM 0 HD11 LEU A 145 8.784 -10.849 -4.354 1.00 0.00 H new ATOM 0 HD12 LEU A 145 8.415 -11.252 -2.660 1.00 0.00 H new ATOM 0 HD13 LEU A 145 7.164 -11.438 -3.912 1.00 0.00 H new ATOM 0 HD21 LEU A 145 7.877 -8.775 -5.378 1.00 0.00 H new ATOM 0 HD22 LEU A 145 6.196 -9.227 -5.004 1.00 0.00 H new ATOM 0 HD23 LEU A 145 6.850 -7.675 -4.427 1.00 0.00 H new ATOM 1929 N PHE A 146 3.428 -7.658 -1.249 1.00 0.00 N ATOM 1930 CA PHE A 146 2.518 -7.454 -0.135 1.00 0.00 C ATOM 1931 C PHE A 146 1.551 -8.631 0.006 1.00 0.00 C ATOM 1932 O PHE A 146 0.800 -8.936 -0.919 1.00 0.00 O ATOM 1933 CB PHE A 146 1.718 -6.186 -0.437 1.00 0.00 C ATOM 1934 CG PHE A 146 2.463 -4.889 -0.116 1.00 0.00 C ATOM 1935 CD1 PHE A 146 3.353 -4.853 0.913 1.00 0.00 C ATOM 1936 CD2 PHE A 146 2.236 -3.772 -0.858 1.00 0.00 C ATOM 1937 CE1 PHE A 146 4.044 -3.649 1.212 1.00 0.00 C ATOM 1938 CE2 PHE A 146 2.928 -2.568 -0.559 1.00 0.00 C ATOM 1939 CZ PHE A 146 3.817 -2.532 0.469 1.00 0.00 C ATOM 0 H PHE A 146 3.001 -7.567 -2.171 1.00 0.00 H new ATOM 0 HA PHE A 146 3.081 -7.368 0.794 1.00 0.00 H new ATOM 0 HB2 PHE A 146 1.444 -6.184 -1.492 1.00 0.00 H new ATOM 0 HB3 PHE A 146 0.789 -6.210 0.133 1.00 0.00 H new ATOM 0 HD1 PHE A 146 3.534 -5.740 1.502 1.00 0.00 H new ATOM 0 HD2 PHE A 146 1.530 -3.800 -1.674 1.00 0.00 H new ATOM 0 HE1 PHE A 146 4.750 -3.620 2.029 1.00 0.00 H new ATOM 0 HE2 PHE A 146 2.748 -1.681 -1.148 1.00 0.00 H new ATOM 0 HZ PHE A 146 4.343 -1.617 0.696 1.00 0.00 H new ATOM 1949 N LEU A 147 1.601 -9.260 1.171 1.00 0.00 N ATOM 1950 CA LEU A 147 0.738 -10.397 1.445 1.00 0.00 C ATOM 1951 C LEU A 147 -0.306 -9.999 2.491 1.00 0.00 C ATOM 1952 O LEU A 147 -0.019 -9.990 3.687 1.00 0.00 O ATOM 1953 CB LEU A 147 1.571 -11.618 1.841 1.00 0.00 C ATOM 1954 CG LEU A 147 0.891 -12.978 1.669 1.00 0.00 C ATOM 1955 CD1 LEU A 147 0.554 -13.598 3.027 1.00 0.00 C ATOM 1956 CD2 LEU A 147 -0.342 -12.865 0.770 1.00 0.00 C ATOM 0 H LEU A 147 2.225 -9.004 1.936 1.00 0.00 H new ATOM 0 HA LEU A 147 0.194 -10.688 0.546 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.487 -11.615 1.251 1.00 0.00 H new ATOM 0 HB3 LEU A 147 1.864 -11.510 2.885 1.00 0.00 H new ATOM 0 HG LEU A 147 1.592 -13.649 1.173 1.00 0.00 H new ATOM 0 HD11 LEU A 147 0.072 -14.564 2.876 1.00 0.00 H new ATOM 0 HD12 LEU A 147 1.470 -13.736 3.602 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -0.120 -12.937 3.572 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.806 -13.845 0.664 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -1.055 -12.172 1.216 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -0.044 -12.497 -0.212 1.00 0.00 H new ATOM 1968 N PRO A 148 -1.526 -9.672 1.988 1.00 0.00 N ATOM 1969 CA PRO A 148 -2.615 -9.275 2.865 1.00 0.00 C ATOM 1970 C PRO A 148 -3.201 -10.485 3.595 1.00 0.00 C ATOM 1971 O PRO A 148 -3.313 -11.566 3.020 1.00 0.00 O ATOM 1972 CB PRO A 148 -3.619 -8.584 1.958 1.00 0.00 C ATOM 1973 CG PRO A 148 -3.279 -9.029 0.545 1.00 0.00 C ATOM 1974 CD PRO A 148 -1.902 -9.672 0.577 1.00 0.00 C ATOM 0 HA PRO A 148 -2.291 -8.605 3.661 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -4.639 -8.863 2.221 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -3.550 -7.500 2.053 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.022 -9.737 0.179 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.287 -8.178 -0.136 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -1.928 -10.684 0.174 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -1.188 -9.108 -0.023 1.00 0.00 H new ATOM 1982 N LEU A 149 -3.559 -10.262 4.851 1.00 0.00 N ATOM 1983 CA LEU A 149 -4.130 -11.321 5.666 1.00 0.00 C ATOM 1984 C LEU A 149 -5.374 -10.792 6.382 1.00 0.00 C ATOM 1985 O LEU A 149 -5.396 -10.698 7.608 1.00 0.00 O ATOM 1986 CB LEU A 149 -3.075 -11.899 6.611 1.00 0.00 C ATOM 1987 CG LEU A 149 -2.228 -10.879 7.375 1.00 0.00 C ATOM 1988 CD1 LEU A 149 -2.801 -10.626 8.771 1.00 0.00 C ATOM 1989 CD2 LEU A 149 -0.762 -11.313 7.426 1.00 0.00 C ATOM 0 H LEU A 149 -3.465 -9.363 5.324 1.00 0.00 H new ATOM 0 HA LEU A 149 -4.452 -12.153 5.039 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -3.577 -12.540 7.336 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -2.406 -12.536 6.031 1.00 0.00 H new ATOM 0 HG LEU A 149 -2.265 -9.932 6.836 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -2.180 -9.897 9.293 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -3.817 -10.241 8.683 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -2.815 -11.560 9.333 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -0.182 -10.571 7.974 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -0.685 -12.277 7.928 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -0.373 -11.400 6.412 1.00 0.00 H new ATOM 2001 N PRO A 150 -6.407 -10.452 5.565 1.00 0.00 N ATOM 2002 CA PRO A 150 -7.652 -9.935 6.108 1.00 0.00 C ATOM 2003 C PRO A 150 -8.479 -11.054 6.745 1.00 0.00 C ATOM 2004 O PRO A 150 -8.213 -12.234 6.518 1.00 0.00 O ATOM 2005 CB PRO A 150 -8.351 -9.277 4.930 1.00 0.00 C ATOM 2006 CG PRO A 150 -7.698 -9.850 3.683 1.00 0.00 C ATOM 2007 CD PRO A 150 -6.417 -10.551 4.109 1.00 0.00 C ATOM 0 HA PRO A 150 -7.494 -9.217 6.913 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -9.420 -9.488 4.943 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -8.240 -8.193 4.966 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -8.370 -10.551 3.187 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -7.480 -9.057 2.967 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -6.407 -11.591 3.783 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -5.540 -10.072 3.674 1.00 0.00 H new ATOM 2015 N VAL A 151 -9.465 -10.645 7.529 1.00 0.00 N ATOM 2016 CA VAL A 151 -10.332 -11.598 8.200 1.00 0.00 C ATOM 2017 C VAL A 151 -11.546 -10.862 8.771 1.00 0.00 C ATOM 2018 O VAL A 151 -11.799 -10.913 9.974 1.00 0.00 O ATOM 2019 CB VAL A 151 -9.544 -12.364 9.264 1.00 0.00 C ATOM 2020 CG1 VAL A 151 -8.837 -13.577 8.655 1.00 0.00 C ATOM 2021 CG2 VAL A 151 -8.545 -11.447 9.973 1.00 0.00 C ATOM 0 H VAL A 151 -9.683 -9.666 7.715 1.00 0.00 H new ATOM 0 HA VAL A 151 -10.703 -12.340 7.493 1.00 0.00 H new ATOM 0 HB VAL A 151 -10.252 -12.727 10.009 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -8.284 -14.104 9.432 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -9.577 -14.248 8.218 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -8.146 -13.244 7.880 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -7.998 -12.017 10.724 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -7.844 -11.040 9.244 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -9.081 -10.630 10.456 1.00 0.00 H new ATOM 2031 N SER A 152 -12.266 -10.194 7.881 1.00 0.00 N ATOM 2032 CA SER A 152 -13.447 -9.448 8.281 1.00 0.00 C ATOM 2033 C SER A 152 -14.472 -10.392 8.914 1.00 0.00 C ATOM 2034 O SER A 152 -15.394 -10.853 8.243 1.00 0.00 O ATOM 2035 CB SER A 152 -14.066 -8.716 7.089 1.00 0.00 C ATOM 2036 OG SER A 152 -15.115 -7.838 7.487 1.00 0.00 O ATOM 0 H SER A 152 -12.054 -10.154 6.884 1.00 0.00 H new ATOM 0 HA SER A 152 -13.147 -8.701 9.016 1.00 0.00 H new ATOM 0 HB2 SER A 152 -13.293 -8.147 6.572 1.00 0.00 H new ATOM 0 HB3 SER A 152 -14.454 -9.445 6.378 1.00 0.00 H new ATOM 0 HG SER A 152 -15.483 -7.389 6.698 1.00 0.00 H new ATOM 2042 N SER A 153 -14.276 -10.651 10.198 1.00 0.00 N ATOM 2043 CA SER A 153 -15.171 -11.531 10.929 1.00 0.00 C ATOM 2044 C SER A 153 -15.567 -10.888 12.259 1.00 0.00 C ATOM 2045 O SER A 153 -15.371 -11.477 13.321 1.00 0.00 O ATOM 2046 CB SER A 153 -14.525 -12.897 11.172 1.00 0.00 C ATOM 2047 OG SER A 153 -15.343 -13.739 11.979 1.00 0.00 O ATOM 0 H SER A 153 -13.510 -10.267 10.751 1.00 0.00 H new ATOM 0 HA SER A 153 -16.066 -11.685 10.326 1.00 0.00 H new ATOM 0 HB2 SER A 153 -14.336 -13.384 10.215 1.00 0.00 H new ATOM 0 HB3 SER A 153 -13.558 -12.760 11.656 1.00 0.00 H new ATOM 0 HG SER A 153 -15.498 -13.310 12.847 1.00 0.00 H new ATOM 2053 N ASP A 154 -16.118 -9.687 12.158 1.00 0.00 N ATOM 2054 CA ASP A 154 -16.543 -8.956 13.341 1.00 0.00 C ATOM 2055 C ASP A 154 -17.693 -8.019 12.969 1.00 0.00 C ATOM 2056 O ASP A 154 -18.028 -7.876 11.794 1.00 0.00 O ATOM 2057 CB ASP A 154 -15.402 -8.106 13.903 1.00 0.00 C ATOM 2058 CG ASP A 154 -15.610 -7.611 15.335 1.00 0.00 C ATOM 2059 OD1 ASP A 154 -16.350 -6.616 15.491 1.00 0.00 O ATOM 2060 OD2 ASP A 154 -15.023 -8.240 16.243 1.00 0.00 O ATOM 0 H ASP A 154 -16.280 -9.202 11.276 1.00 0.00 H new ATOM 0 HA ASP A 154 -16.855 -9.681 14.092 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -14.482 -8.690 13.866 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -15.258 -7.243 13.253 1.00 0.00 H new TER 2065 ASP A 154 HETATM 2066 C1 NTS A 178 15.989 -4.693 -0.129 1.00 0.00 C HETATM 2067 C2 NTS A 178 15.471 -5.830 0.490 1.00 0.00 C HETATM 2068 C3 NTS A 178 14.273 -6.387 0.047 1.00 0.00 C HETATM 2069 C4 NTS A 178 13.591 -5.805 -1.020 1.00 0.00 C HETATM 2070 C5 NTS A 178 13.413 -4.095 -2.711 1.00 0.00 C HETATM 2071 C6 NTS A 178 13.915 -2.958 -3.342 1.00 0.00 C HETATM 2072 C7 NTS A 178 15.112 -2.396 -2.905 1.00 0.00 C HETATM 2073 C8 NTS A 178 15.805 -2.968 -1.838 1.00 0.00 C HETATM 2074 C9 NTS A 178 15.308 -4.108 -1.200 1.00 0.00 C HETATM 2075 C10 NTS A 178 14.106 -4.668 -1.643 1.00 0.00 C HETATM 2076 O11 NTS A 178 18.427 -5.280 1.430 1.00 0.00 O HETATM 2077 O12 NTS A 178 17.239 -2.595 1.561 1.00 0.00 O HETATM 2078 O13 NTS A 178 18.575 -3.493 -0.898 1.00 0.00 O HETATM 2079 O31 NTS A 178 13.990 -7.809 2.615 1.00 0.00 O HETATM 2080 O32 NTS A 178 14.345 -9.339 0.131 1.00 0.00 O HETATM 2081 O33 NTS A 178 11.816 -7.916 0.640 1.00 0.00 O HETATM 2082 O61 NTS A 178 11.293 -2.749 -4.673 1.00 0.00 O HETATM 2083 O62 NTS A 178 13.751 -2.739 -6.283 1.00 0.00 O HETATM 2084 O63 NTS A 178 13.081 -0.418 -4.600 1.00 0.00 O HETATM 2085 S1 NTS A 178 17.559 -4.010 0.495 1.00 0.00 S HETATM 2086 S3 NTS A 178 13.602 -7.869 0.859 1.00 0.00 S HETATM 2087 S6 NTS A 178 13.010 -2.211 -4.732 1.00 0.00 S HETATM 0 H8 NTS A 178 16.741 -2.523 -1.499 1.00 0.00 H new HETATM 0 H7 NTS A 178 15.508 -1.508 -3.397 1.00 0.00 H new HETATM 0 H5 NTS A 178 12.477 -4.538 -3.052 1.00 0.00 H new HETATM 0 H4 NTS A 178 12.654 -6.239 -1.368 1.00 0.00 H new HETATM 0 H2 NTS A 178 16.005 -6.285 1.324 1.00 0.00 H new