USER MOD reduce.3.24.130724 H: found=0, std=0, add=1057, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 765 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 114 SER OG : rot -21:sc= 0.373 USER MOD Set 1.2: A 118 TYR OH : rot 136:sc= 0.452 USER MOD Set 2.1: A 25 TYR OH : rot 80:sc= 1.26 USER MOD Set 2.2: A 28 SER OG : rot 45:sc= 0.371 USER MOD Set 2.3: A 109 THR OG1 : rot -99:sc= 0.483 USER MOD Set 2.4: A 120 HIS : no HD1:sc= 0.718 K(o=2.8,f=-2.5!) USER MOD Set 3.1: A 50 ASN : amide:sc= 0.192 K(o=0.39,f=-3.3) USER MOD Set 3.2: A 53 LYS NZ :NH3+ -170:sc= 0.199 (180deg=0) USER MOD Set 4.1: A 29 MET CE :methyl 136:sc= -1.85 (180deg=-5.73!) USER MOD Set 4.2: A 47 MET CE :methyl -153:sc= -3.29! (180deg=-4.43!) USER MOD Set 5.1: A 19 CYS SG : rot 57:sc= 0.292 USER MOD Set 5.2: A 21 TYR OH : rot -160:sc= 0.0707 USER MOD Set 5.3: A 136 THR OG1 : rot 76:sc= 1.28 USER MOD Single : A 13 LYS NZ :NH3+ -136:sc= -0.195 (180deg=-0.735) USER MOD Single : A 17 GLN : amide:sc= 1.12 K(o=1.1,f=0) USER MOD Single : A 18 SER OG : rot 32:sc= -0.578 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot -58:sc= -1.31! USER MOD Single : A 40 THR OG1 : rot 110:sc= -0.823 USER MOD Single : A 41 GLN :FLIP amide:sc= -0.093 F(o=-0.78,f=-0.093) USER MOD Single : A 44 CYS SG : rot -109:sc= -0.53 USER MOD Single : A 46 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.023) USER MOD Single : A 51 CYS SG : rot -26:sc= -0.0282 USER MOD Single : A 52 GLN : amide:sc= 0.312 X(o=0.31,f=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -0.25 K(o=-0.25,f=-1.1) USER MOD Single : A 58 MET CE :methyl 165:sc= -0.0401 (180deg=-0.325) USER MOD Single : A 59 LYS NZ :NH3+ 167:sc= 1.13 (180deg=0.564) USER MOD Single : A 60 LYS NZ :NH3+ 166:sc= -0.0319 (180deg=-0.313) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -83:sc= 1.23 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0703) USER MOD Single : A 79 THR OG1 : rot 84:sc= 0.995 USER MOD Single : A 80 ASN : amide:sc= -0.0072 X(o=-0.0072,f=-0.099) USER MOD Single : A 81 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0118) USER MOD Single : A 82 ASN : amide:sc= -0.423 K(o=-0.42,f=-5.5!) USER MOD Single : A 87 HIS : no HD1:sc=-0.00187 K(o=-0.0019,f=-0.62) USER MOD Single : A 91 ASN : amide:sc= -2.2! C(o=-2.2!,f=-2.2!) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 CYS SG : rot 180:sc= -0.162 USER MOD Single : A 97 GLN :FLIP amide:sc= -0.464 F(o=-1.3,f=-0.46) USER MOD Single : A 103 SER OG : rot -74:sc= 0.581 USER MOD Single : A 104 THR OG1 : rot 72:sc= 1.21 USER MOD Single : A 107 TYR OH : rot -102:sc= 1.24 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ -165:sc= -0.0146 (180deg=-0.234) USER MOD Single : A 115 ASN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 116 HIS : no HE2:sc= -3.99! C(o=-4!,f=-6.2!) USER MOD Single : A 117 HIS :FLIP no HE2:sc= 0.139 F(o=-0.55,f=0.14) USER MOD Single : A 119 CYS SG : rot 170:sc= -0.197 USER MOD Single : A 123 THR OG1 : rot 180:sc= -1.08 USER MOD Single : A 128 ASN : amide:sc= -0.0248 X(o=-0.025,f=0) USER MOD Single : A 139 GLN :FLIP amide:sc= -0.12 F(o=-3.4!,f=-0.12) USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 GLN : amide:sc= -0.0691 K(o=-0.069,f=-2.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 12 -25.116 -5.586 8.395 1.00 0.00 N ATOM 2 CA GLU A 12 -23.707 -5.549 7.961 1.00 0.00 C ATOM 3 C GLU A 12 -23.387 -4.208 7.311 1.00 0.00 C ATOM 4 O GLU A 12 -24.251 -3.590 6.685 1.00 0.00 O ATOM 5 CB GLU A 12 -23.394 -6.707 6.985 1.00 0.00 C ATOM 6 CG GLU A 12 -24.178 -6.683 5.666 1.00 0.00 C ATOM 7 CD GLU A 12 -25.656 -6.972 5.841 1.00 0.00 C ATOM 8 OE1 GLU A 12 -26.020 -8.155 5.990 1.00 0.00 O ATOM 9 OE2 GLU A 12 -26.461 -6.022 5.826 1.00 0.00 O ATOM 0 HA GLU A 12 -23.079 -5.671 8.844 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -22.329 -6.689 6.756 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -23.595 -7.651 7.491 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -24.059 -5.706 5.198 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -23.750 -7.417 4.983 1.00 0.00 H new ATOM 11 N LYS A 13 -22.156 -3.755 7.468 1.00 0.00 N ATOM 12 CA LYS A 13 -21.742 -2.491 6.896 1.00 0.00 C ATOM 13 C LYS A 13 -21.163 -2.691 5.507 1.00 0.00 C ATOM 14 O LYS A 13 -20.397 -3.627 5.268 1.00 0.00 O ATOM 15 CB LYS A 13 -20.704 -1.782 7.778 1.00 0.00 C ATOM 16 CG LYS A 13 -21.237 -1.186 9.075 1.00 0.00 C ATOM 17 CD LYS A 13 -21.443 -2.239 10.149 1.00 0.00 C ATOM 18 CE LYS A 13 -21.705 -1.595 11.501 1.00 0.00 C ATOM 19 NZ LYS A 13 -20.570 -0.731 11.933 1.00 0.00 N ATOM 0 H LYS A 13 -21.427 -4.245 7.987 1.00 0.00 H new ATOM 0 HA LYS A 13 -22.632 -1.865 6.833 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -19.916 -2.494 8.023 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -20.243 -0.984 7.195 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -20.541 -0.430 9.439 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -22.182 -0.680 8.879 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -22.282 -2.880 9.879 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -20.562 -2.877 10.211 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -22.616 -0.999 11.449 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -21.875 -2.372 12.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -20.364 -0.905 12.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -19.729 -0.952 11.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -20.825 0.269 11.800 1.00 0.00 H new ATOM 22 N LEU A 14 -21.529 -1.814 4.601 1.00 0.00 N ATOM 23 CA LEU A 14 -21.017 -1.853 3.251 1.00 0.00 C ATOM 24 C LEU A 14 -20.437 -0.493 2.867 1.00 0.00 C ATOM 25 O LEU A 14 -19.234 -0.371 2.641 1.00 0.00 O ATOM 26 CB LEU A 14 -22.093 -2.331 2.228 1.00 0.00 C ATOM 27 CG LEU A 14 -23.419 -1.538 2.146 1.00 0.00 C ATOM 28 CD1 LEU A 14 -24.169 -1.907 0.877 1.00 0.00 C ATOM 29 CD2 LEU A 14 -24.302 -1.812 3.360 1.00 0.00 C ATOM 0 H LEU A 14 -22.188 -1.056 4.778 1.00 0.00 H new ATOM 0 HA LEU A 14 -20.215 -2.590 3.218 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -21.638 -2.325 1.237 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -22.337 -3.368 2.460 1.00 0.00 H new ATOM 0 HG LEU A 14 -23.175 -0.476 2.131 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -25.101 -1.344 0.828 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -23.555 -1.668 0.009 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -24.390 -2.974 0.882 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -25.226 -1.241 3.274 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -24.536 -2.876 3.407 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -23.776 -1.516 4.267 1.00 0.00 H new ATOM 41 N ILE A 15 -21.282 0.535 2.861 1.00 0.00 N ATOM 42 CA ILE A 15 -20.854 1.886 2.500 1.00 0.00 C ATOM 43 C ILE A 15 -19.994 2.494 3.616 1.00 0.00 C ATOM 44 O ILE A 15 -19.222 3.430 3.392 1.00 0.00 O ATOM 45 CB ILE A 15 -22.077 2.809 2.201 1.00 0.00 C ATOM 46 CG1 ILE A 15 -21.614 4.194 1.719 1.00 0.00 C ATOM 47 CG2 ILE A 15 -22.980 2.933 3.423 1.00 0.00 C ATOM 48 CD1 ILE A 15 -22.751 5.143 1.395 1.00 0.00 C ATOM 0 H ILE A 15 -22.270 0.459 3.103 1.00 0.00 H new ATOM 0 HA ILE A 15 -20.256 1.812 1.592 1.00 0.00 H new ATOM 0 HB ILE A 15 -22.657 2.349 1.401 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -20.986 4.644 2.488 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -20.993 4.070 0.832 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -23.824 3.581 3.187 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -23.348 1.947 3.705 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -22.415 3.360 4.251 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -22.344 6.098 1.062 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -23.367 4.716 0.604 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -23.360 5.299 2.285 1.00 0.00 H new ATOM 59 N ALA A 16 -20.111 1.932 4.806 1.00 0.00 N ATOM 60 CA ALA A 16 -19.356 2.406 5.949 1.00 0.00 C ATOM 61 C ALA A 16 -17.984 1.768 5.977 1.00 0.00 C ATOM 62 O ALA A 16 -17.025 2.360 6.460 1.00 0.00 O ATOM 63 CB ALA A 16 -20.106 2.125 7.242 1.00 0.00 C ATOM 0 H ALA A 16 -20.726 1.143 5.005 1.00 0.00 H new ATOM 0 HA ALA A 16 -19.232 3.485 5.856 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -19.522 2.489 8.088 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -21.070 2.633 7.221 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -20.264 1.051 7.345 1.00 0.00 H new ATOM 69 N GLN A 17 -17.887 0.554 5.447 1.00 0.00 N ATOM 70 CA GLN A 17 -16.612 -0.137 5.403 1.00 0.00 C ATOM 71 C GLN A 17 -15.877 0.190 4.128 1.00 0.00 C ATOM 72 O GLN A 17 -14.665 -0.006 4.030 1.00 0.00 O ATOM 73 CB GLN A 17 -16.770 -1.653 5.561 1.00 0.00 C ATOM 74 CG GLN A 17 -17.366 -2.074 6.893 1.00 0.00 C ATOM 75 CD GLN A 17 -17.174 -3.550 7.185 1.00 0.00 C ATOM 76 OE1 GLN A 17 -16.193 -3.946 7.814 1.00 0.00 O ATOM 77 NE2 GLN A 17 -18.098 -4.373 6.728 1.00 0.00 N ATOM 0 H GLN A 17 -18.669 0.036 5.047 1.00 0.00 H new ATOM 0 HA GLN A 17 -16.024 0.215 6.250 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -17.402 -2.028 4.756 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -15.794 -2.124 5.446 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -16.909 -1.488 7.691 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -18.431 -1.843 6.898 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -18.897 -4.006 6.211 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -18.014 -5.376 6.892 1.00 0.00 H new ATOM 86 N SER A 18 -16.606 0.678 3.146 1.00 0.00 N ATOM 87 CA SER A 18 -15.992 1.084 1.897 1.00 0.00 C ATOM 88 C SER A 18 -15.284 2.414 2.078 1.00 0.00 C ATOM 89 O SER A 18 -15.922 3.470 2.189 1.00 0.00 O ATOM 90 CB SER A 18 -17.021 1.169 0.777 1.00 0.00 C ATOM 91 OG SER A 18 -18.090 2.024 1.130 1.00 0.00 O ATOM 0 H SER A 18 -17.618 0.803 3.186 1.00 0.00 H new ATOM 0 HA SER A 18 -15.259 0.329 1.613 1.00 0.00 H new ATOM 0 HB2 SER A 18 -16.544 1.535 -0.132 1.00 0.00 H new ATOM 0 HB3 SER A 18 -17.406 0.173 0.556 1.00 0.00 H new ATOM 0 HG SER A 18 -17.759 2.737 1.716 1.00 0.00 H new ATOM 97 N CYS A 19 -13.984 2.357 2.127 1.00 0.00 N ATOM 98 CA CYS A 19 -13.175 3.528 2.347 1.00 0.00 C ATOM 99 C CYS A 19 -12.421 3.890 1.077 1.00 0.00 C ATOM 100 O CYS A 19 -11.853 3.020 0.416 1.00 0.00 O ATOM 101 CB CYS A 19 -12.205 3.270 3.497 1.00 0.00 C ATOM 102 SG CYS A 19 -13.009 2.710 5.021 1.00 0.00 S ATOM 0 H CYS A 19 -13.450 1.495 2.015 1.00 0.00 H new ATOM 0 HA CYS A 19 -13.818 4.368 2.612 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -11.477 2.521 3.185 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -11.651 4.185 3.705 1.00 0.00 H new ATOM 0 HG CYS A 19 -13.704 1.639 4.777 1.00 0.00 H new ATOM 108 N ASP A 20 -12.432 5.160 0.733 1.00 0.00 N ATOM 109 CA ASP A 20 -11.775 5.633 -0.475 1.00 0.00 C ATOM 110 C ASP A 20 -10.644 6.575 -0.126 1.00 0.00 C ATOM 111 O ASP A 20 -10.870 7.649 0.438 1.00 0.00 O ATOM 112 CB ASP A 20 -12.775 6.349 -1.391 1.00 0.00 C ATOM 113 CG ASP A 20 -13.914 5.457 -1.833 1.00 0.00 C ATOM 114 OD1 ASP A 20 -14.935 5.390 -1.118 1.00 0.00 O ATOM 115 OD2 ASP A 20 -13.806 4.828 -2.909 1.00 0.00 O ATOM 0 H ASP A 20 -12.892 5.892 1.275 1.00 0.00 H new ATOM 0 HA ASP A 20 -11.372 4.767 -1.001 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -13.181 7.216 -0.870 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.251 6.723 -2.271 1.00 0.00 H new ATOM 118 N TYR A 21 -9.431 6.175 -0.439 1.00 0.00 N ATOM 119 CA TYR A 21 -8.264 7.001 -0.154 1.00 0.00 C ATOM 120 C TYR A 21 -7.459 7.234 -1.419 1.00 0.00 C ATOM 121 O TYR A 21 -7.211 6.305 -2.174 1.00 0.00 O ATOM 122 CB TYR A 21 -7.377 6.331 0.893 1.00 0.00 C ATOM 123 CG TYR A 21 -8.072 6.017 2.201 1.00 0.00 C ATOM 124 CD1 TYR A 21 -8.413 7.026 3.089 1.00 0.00 C ATOM 125 CD2 TYR A 21 -8.377 4.708 2.550 1.00 0.00 C ATOM 126 CE1 TYR A 21 -9.040 6.743 4.285 1.00 0.00 C ATOM 127 CE2 TYR A 21 -9.002 4.416 3.744 1.00 0.00 C ATOM 128 CZ TYR A 21 -9.330 5.437 4.608 1.00 0.00 C ATOM 129 OH TYR A 21 -9.953 5.152 5.800 1.00 0.00 O ATOM 0 H TYR A 21 -9.221 5.285 -0.891 1.00 0.00 H new ATOM 0 HA TYR A 21 -8.613 7.959 0.232 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -6.981 5.405 0.476 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -6.525 6.979 1.096 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -8.184 8.052 2.840 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -8.120 3.905 1.875 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -9.302 7.541 4.964 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -9.233 3.393 4.000 1.00 0.00 H new ATOM 0 HH TYR A 21 -9.809 4.210 6.027 1.00 0.00 H new ATOM 135 N LYS A 22 -7.053 8.467 -1.656 1.00 0.00 N ATOM 136 CA LYS A 22 -6.262 8.771 -2.836 1.00 0.00 C ATOM 137 C LYS A 22 -4.779 8.656 -2.537 1.00 0.00 C ATOM 138 O LYS A 22 -4.250 9.352 -1.668 1.00 0.00 O ATOM 139 CB LYS A 22 -6.561 10.168 -3.376 1.00 0.00 C ATOM 140 CG LYS A 22 -8.014 10.408 -3.746 1.00 0.00 C ATOM 141 CD LYS A 22 -8.178 11.725 -4.495 1.00 0.00 C ATOM 142 CE LYS A 22 -7.641 12.900 -3.688 1.00 0.00 C ATOM 143 NZ LYS A 22 -7.771 14.183 -4.421 1.00 0.00 N ATOM 0 H LYS A 22 -7.254 9.267 -1.056 1.00 0.00 H new ATOM 0 HA LYS A 22 -6.537 8.041 -3.597 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -6.265 10.903 -2.628 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -5.943 10.342 -4.256 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -8.376 9.587 -4.365 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -8.625 10.420 -2.844 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -7.655 11.669 -5.449 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.232 11.888 -4.719 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -8.179 12.967 -2.742 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -6.593 12.725 -3.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -7.394 14.956 -3.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -7.237 14.130 -5.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -8.774 14.364 -4.629 1.00 0.00 H new ATOM 146 N ALA A 23 -4.120 7.782 -3.252 1.00 0.00 N ATOM 147 CA ALA A 23 -2.696 7.595 -3.113 1.00 0.00 C ATOM 148 C ALA A 23 -2.035 7.817 -4.454 1.00 0.00 C ATOM 149 O ALA A 23 -2.710 7.863 -5.471 1.00 0.00 O ATOM 150 CB ALA A 23 -2.395 6.201 -2.596 1.00 0.00 C ATOM 0 H ALA A 23 -4.555 7.178 -3.949 1.00 0.00 H new ATOM 0 HA ALA A 23 -2.303 8.314 -2.394 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -1.317 6.075 -2.496 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -2.868 6.064 -1.624 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -2.784 5.461 -3.296 1.00 0.00 H new ATOM 156 N ALA A 24 -0.736 7.968 -4.466 1.00 0.00 N ATOM 157 CA ALA A 24 -0.034 8.158 -5.711 1.00 0.00 C ATOM 158 C ALA A 24 0.661 6.869 -6.122 1.00 0.00 C ATOM 159 O ALA A 24 1.418 6.292 -5.343 1.00 0.00 O ATOM 160 CB ALA A 24 0.957 9.297 -5.588 1.00 0.00 C ATOM 0 H ALA A 24 -0.145 7.963 -3.635 1.00 0.00 H new ATOM 0 HA ALA A 24 -0.753 8.420 -6.488 1.00 0.00 H new ATOM 0 HB1 ALA A 24 1.479 9.429 -6.536 1.00 0.00 H new ATOM 0 HB2 ALA A 24 0.427 10.215 -5.335 1.00 0.00 H new ATOM 0 HB3 ALA A 24 1.679 9.068 -4.804 1.00 0.00 H new ATOM 166 N TYR A 25 0.390 6.414 -7.336 1.00 0.00 N ATOM 167 CA TYR A 25 0.954 5.164 -7.832 1.00 0.00 C ATOM 168 C TYR A 25 2.450 5.329 -8.113 1.00 0.00 C ATOM 169 O TYR A 25 2.840 5.770 -9.200 1.00 0.00 O ATOM 170 CB TYR A 25 0.213 4.706 -9.115 1.00 0.00 C ATOM 171 CG TYR A 25 0.308 3.210 -9.403 1.00 0.00 C ATOM 172 CD1 TYR A 25 1.533 2.551 -9.392 1.00 0.00 C ATOM 173 CD2 TYR A 25 -0.838 2.452 -9.665 1.00 0.00 C ATOM 174 CE1 TYR A 25 1.619 1.195 -9.635 1.00 0.00 C ATOM 175 CE2 TYR A 25 -0.755 1.094 -9.903 1.00 0.00 C ATOM 176 CZ TYR A 25 0.473 0.473 -9.889 1.00 0.00 C ATOM 177 OH TYR A 25 0.556 -0.882 -10.115 1.00 0.00 O ATOM 0 H TYR A 25 -0.219 6.893 -7.999 1.00 0.00 H new ATOM 0 HA TYR A 25 0.826 4.399 -7.066 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -0.838 4.980 -9.029 1.00 0.00 H new ATOM 0 HB3 TYR A 25 0.617 5.253 -9.967 1.00 0.00 H new ATOM 0 HD1 TYR A 25 2.434 3.111 -9.189 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -1.803 2.936 -9.681 1.00 0.00 H new ATOM 0 HE1 TYR A 25 2.580 0.702 -9.626 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -1.650 0.522 -10.099 1.00 0.00 H new ATOM 0 HH TYR A 25 0.643 -1.352 -9.259 1.00 0.00 H new ATOM 183 N LEU A 26 3.284 4.990 -7.123 1.00 0.00 N ATOM 184 CA LEU A 26 4.728 5.109 -7.274 1.00 0.00 C ATOM 185 C LEU A 26 5.253 4.031 -8.210 1.00 0.00 C ATOM 186 O LEU A 26 5.840 4.339 -9.248 1.00 0.00 O ATOM 187 CB LEU A 26 5.442 5.050 -5.908 1.00 0.00 C ATOM 188 CG LEU A 26 6.961 5.328 -5.931 1.00 0.00 C ATOM 189 CD1 LEU A 26 7.246 6.720 -6.474 1.00 0.00 C ATOM 190 CD2 LEU A 26 7.567 5.166 -4.538 1.00 0.00 C ATOM 0 H LEU A 26 2.981 4.634 -6.217 1.00 0.00 H new ATOM 0 HA LEU A 26 4.943 6.083 -7.713 1.00 0.00 H new ATOM 0 HB2 LEU A 26 4.970 5.771 -5.241 1.00 0.00 H new ATOM 0 HB3 LEU A 26 5.279 4.062 -5.476 1.00 0.00 H new ATOM 0 HG LEU A 26 7.425 4.597 -6.593 1.00 0.00 H new ATOM 0 HD11 LEU A 26 8.322 6.894 -6.481 1.00 0.00 H new ATOM 0 HD12 LEU A 26 6.858 6.801 -7.490 1.00 0.00 H new ATOM 0 HD13 LEU A 26 6.762 7.464 -5.841 1.00 0.00 H new ATOM 0 HD21 LEU A 26 8.637 5.367 -4.581 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.093 5.868 -3.851 1.00 0.00 H new ATOM 0 HD23 LEU A 26 7.403 4.147 -4.186 1.00 0.00 H new ATOM 202 N GLY A 27 5.042 2.772 -7.853 1.00 0.00 N ATOM 203 CA GLY A 27 5.472 1.704 -8.721 1.00 0.00 C ATOM 204 C GLY A 27 5.041 0.342 -8.237 1.00 0.00 C ATOM 205 O GLY A 27 4.514 0.198 -7.130 1.00 0.00 O ATOM 0 H GLY A 27 4.587 2.477 -6.989 1.00 0.00 H new ATOM 0 HA2 GLY A 27 5.071 1.872 -9.721 1.00 0.00 H new ATOM 0 HA3 GLY A 27 6.559 1.727 -8.805 1.00 0.00 H new ATOM 209 N SER A 28 5.250 -0.655 -9.068 1.00 0.00 N ATOM 210 CA SER A 28 4.920 -2.018 -8.731 1.00 0.00 C ATOM 211 C SER A 28 6.097 -2.928 -9.045 1.00 0.00 C ATOM 212 O SER A 28 6.350 -3.253 -10.207 1.00 0.00 O ATOM 213 CB SER A 28 3.676 -2.464 -9.498 1.00 0.00 C ATOM 214 OG SER A 28 3.814 -2.206 -10.886 1.00 0.00 O ATOM 0 H SER A 28 5.654 -0.541 -9.997 1.00 0.00 H new ATOM 0 HA SER A 28 4.706 -2.080 -7.664 1.00 0.00 H new ATOM 0 HB2 SER A 28 3.508 -3.529 -9.338 1.00 0.00 H new ATOM 0 HB3 SER A 28 2.800 -1.942 -9.113 1.00 0.00 H new ATOM 0 HG SER A 28 4.704 -2.488 -11.184 1.00 0.00 H new ATOM 220 N MET A 29 6.832 -3.310 -8.020 1.00 0.00 N ATOM 221 CA MET A 29 7.992 -4.162 -8.205 1.00 0.00 C ATOM 222 C MET A 29 7.585 -5.612 -8.240 1.00 0.00 C ATOM 223 O MET A 29 6.537 -5.990 -7.709 1.00 0.00 O ATOM 224 CB MET A 29 9.039 -3.947 -7.103 1.00 0.00 C ATOM 225 CG MET A 29 10.041 -2.814 -7.355 1.00 0.00 C ATOM 226 SD MET A 29 9.363 -1.161 -7.086 1.00 0.00 S ATOM 227 CE MET A 29 8.639 -0.793 -8.680 1.00 0.00 C ATOM 0 H MET A 29 6.648 -3.045 -7.052 1.00 0.00 H new ATOM 0 HA MET A 29 8.442 -3.889 -9.159 1.00 0.00 H new ATOM 0 HB2 MET A 29 8.519 -3.747 -6.166 1.00 0.00 H new ATOM 0 HB3 MET A 29 9.594 -4.875 -6.967 1.00 0.00 H new ATOM 0 HG2 MET A 29 10.903 -2.953 -6.702 1.00 0.00 H new ATOM 0 HG3 MET A 29 10.403 -2.885 -8.381 1.00 0.00 H new ATOM 0 HE1 MET A 29 7.655 -0.347 -8.538 1.00 0.00 H new ATOM 0 HE2 MET A 29 9.280 -0.094 -9.218 1.00 0.00 H new ATOM 0 HE3 MET A 29 8.541 -1.713 -9.256 1.00 0.00 H new ATOM 237 N LEU A 30 8.402 -6.421 -8.861 1.00 0.00 N ATOM 238 CA LEU A 30 8.147 -7.830 -8.951 1.00 0.00 C ATOM 239 C LEU A 30 9.113 -8.561 -8.042 1.00 0.00 C ATOM 240 O LEU A 30 10.317 -8.590 -8.300 1.00 0.00 O ATOM 241 CB LEU A 30 8.290 -8.290 -10.401 1.00 0.00 C ATOM 242 CG LEU A 30 7.713 -9.657 -10.726 1.00 0.00 C ATOM 243 CD1 LEU A 30 6.232 -9.697 -10.397 1.00 0.00 C ATOM 244 CD2 LEU A 30 7.936 -9.993 -12.186 1.00 0.00 C ATOM 0 H LEU A 30 9.263 -6.119 -9.318 1.00 0.00 H new ATOM 0 HA LEU A 30 7.129 -8.052 -8.631 1.00 0.00 H new ATOM 0 HB2 LEU A 30 7.810 -7.553 -11.044 1.00 0.00 H new ATOM 0 HB3 LEU A 30 9.349 -8.295 -10.657 1.00 0.00 H new ATOM 0 HG LEU A 30 8.226 -10.402 -10.117 1.00 0.00 H new ATOM 0 HD11 LEU A 30 5.833 -10.683 -10.635 1.00 0.00 H new ATOM 0 HD12 LEU A 30 6.090 -9.495 -9.335 1.00 0.00 H new ATOM 0 HD13 LEU A 30 5.708 -8.942 -10.984 1.00 0.00 H new ATOM 0 HD21 LEU A 30 7.516 -10.976 -12.401 1.00 0.00 H new ATOM 0 HD22 LEU A 30 7.447 -9.245 -12.810 1.00 0.00 H new ATOM 0 HD23 LEU A 30 9.005 -10.000 -12.398 1.00 0.00 H new ATOM 256 N ILE A 31 8.595 -9.132 -6.967 1.00 0.00 N ATOM 257 CA ILE A 31 9.453 -9.744 -5.967 1.00 0.00 C ATOM 258 C ILE A 31 9.214 -11.241 -5.863 1.00 0.00 C ATOM 259 O ILE A 31 8.115 -11.681 -5.536 1.00 0.00 O ATOM 260 CB ILE A 31 9.242 -9.111 -4.563 1.00 0.00 C ATOM 261 CG1 ILE A 31 9.115 -7.575 -4.646 1.00 0.00 C ATOM 262 CG2 ILE A 31 10.387 -9.497 -3.634 1.00 0.00 C ATOM 263 CD1 ILE A 31 10.284 -6.883 -5.318 1.00 0.00 C ATOM 0 H ILE A 31 7.596 -9.184 -6.766 1.00 0.00 H new ATOM 0 HA ILE A 31 10.476 -9.562 -6.295 1.00 0.00 H new ATOM 0 HB ILE A 31 8.307 -9.500 -4.159 1.00 0.00 H new ATOM 0 HG12 ILE A 31 8.202 -7.327 -5.188 1.00 0.00 H new ATOM 0 HG13 ILE A 31 9.005 -7.177 -3.637 1.00 0.00 H new ATOM 0 HG21 ILE A 31 10.228 -9.048 -2.654 1.00 0.00 H new ATOM 0 HG22 ILE A 31 10.424 -10.582 -3.534 1.00 0.00 H new ATOM 0 HG23 ILE A 31 11.329 -9.138 -4.049 1.00 0.00 H new ATOM 0 HD11 ILE A 31 10.110 -5.807 -5.332 1.00 0.00 H new ATOM 0 HD12 ILE A 31 11.199 -7.096 -4.765 1.00 0.00 H new ATOM 0 HD13 ILE A 31 10.384 -7.248 -6.340 1.00 0.00 H new ATOM 274 N LYS A 32 10.247 -12.018 -6.146 1.00 0.00 N ATOM 275 CA LYS A 32 10.155 -13.465 -6.019 1.00 0.00 C ATOM 276 C LYS A 32 10.669 -13.907 -4.655 1.00 0.00 C ATOM 277 O LYS A 32 10.110 -14.808 -4.028 1.00 0.00 O ATOM 278 CB LYS A 32 10.897 -14.206 -7.160 1.00 0.00 C ATOM 279 CG LYS A 32 12.382 -13.883 -7.308 1.00 0.00 C ATOM 280 CD LYS A 32 12.623 -12.631 -8.134 1.00 0.00 C ATOM 281 CE LYS A 32 14.109 -12.335 -8.262 1.00 0.00 C ATOM 282 NZ LYS A 32 14.365 -11.102 -9.045 1.00 0.00 N ATOM 0 H LYS A 32 11.154 -11.675 -6.463 1.00 0.00 H new ATOM 0 HA LYS A 32 9.103 -13.735 -6.105 1.00 0.00 H new ATOM 0 HB2 LYS A 32 10.792 -15.279 -6.999 1.00 0.00 H new ATOM 0 HB3 LYS A 32 10.399 -13.975 -8.102 1.00 0.00 H new ATOM 0 HG2 LYS A 32 12.823 -13.753 -6.320 1.00 0.00 H new ATOM 0 HG3 LYS A 32 12.890 -14.727 -7.775 1.00 0.00 H new ATOM 0 HD2 LYS A 32 12.188 -12.757 -9.125 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.119 -11.783 -7.670 1.00 0.00 H new ATOM 0 HE2 LYS A 32 14.545 -12.230 -7.268 1.00 0.00 H new ATOM 0 HE3 LYS A 32 14.607 -13.178 -8.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 15.390 -10.937 -9.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 13.972 -11.211 -10.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 13.912 -10.292 -8.575 1.00 0.00 H new ATOM 285 N GLU A 33 11.726 -13.258 -4.192 1.00 0.00 N ATOM 286 CA GLU A 33 12.279 -13.539 -2.878 1.00 0.00 C ATOM 287 C GLU A 33 11.698 -12.573 -1.856 1.00 0.00 C ATOM 288 O GLU A 33 12.430 -11.856 -1.170 1.00 0.00 O ATOM 289 CB GLU A 33 13.814 -13.439 -2.882 1.00 0.00 C ATOM 290 CG GLU A 33 14.533 -14.733 -3.254 1.00 0.00 C ATOM 291 CD GLU A 33 14.233 -15.205 -4.656 1.00 0.00 C ATOM 292 OE1 GLU A 33 14.887 -14.722 -5.598 1.00 0.00 O ATOM 293 OE2 GLU A 33 13.348 -16.077 -4.820 1.00 0.00 O ATOM 0 H GLU A 33 12.219 -12.530 -4.710 1.00 0.00 H new ATOM 0 HA GLU A 33 12.010 -14.560 -2.609 1.00 0.00 H new ATOM 0 HB2 GLU A 33 14.113 -12.659 -3.582 1.00 0.00 H new ATOM 0 HB3 GLU A 33 14.147 -13.125 -1.893 1.00 0.00 H new ATOM 0 HG2 GLU A 33 15.608 -14.585 -3.151 1.00 0.00 H new ATOM 0 HG3 GLU A 33 14.249 -15.513 -2.548 1.00 0.00 H new ATOM 296 N LEU A 34 10.376 -12.541 -1.776 1.00 0.00 N ATOM 297 CA LEU A 34 9.698 -11.667 -0.843 1.00 0.00 C ATOM 298 C LEU A 34 9.923 -12.132 0.582 1.00 0.00 C ATOM 299 O LEU A 34 9.795 -13.321 0.886 1.00 0.00 O ATOM 300 CB LEU A 34 8.186 -11.554 -1.142 1.00 0.00 C ATOM 301 CG LEU A 34 7.353 -12.840 -1.011 1.00 0.00 C ATOM 302 CD1 LEU A 34 5.902 -12.497 -0.717 1.00 0.00 C ATOM 303 CD2 LEU A 34 7.435 -13.670 -2.284 1.00 0.00 C ATOM 0 H LEU A 34 9.755 -13.113 -2.349 1.00 0.00 H new ATOM 0 HA LEU A 34 10.127 -10.672 -0.964 1.00 0.00 H new ATOM 0 HB2 LEU A 34 7.763 -10.806 -0.472 1.00 0.00 H new ATOM 0 HB3 LEU A 34 8.068 -11.175 -2.157 1.00 0.00 H new ATOM 0 HG LEU A 34 7.760 -13.425 -0.186 1.00 0.00 H new ATOM 0 HD11 LEU A 34 5.322 -13.416 -0.626 1.00 0.00 H new ATOM 0 HD12 LEU A 34 5.842 -11.937 0.216 1.00 0.00 H new ATOM 0 HD13 LEU A 34 5.499 -11.892 -1.530 1.00 0.00 H new ATOM 0 HD21 LEU A 34 6.838 -14.575 -2.168 1.00 0.00 H new ATOM 0 HD22 LEU A 34 7.053 -13.088 -3.123 1.00 0.00 H new ATOM 0 HD23 LEU A 34 8.473 -13.942 -2.475 1.00 0.00 H new ATOM 315 N ARG A 35 10.280 -11.205 1.442 1.00 0.00 N ATOM 316 CA ARG A 35 10.524 -11.518 2.836 1.00 0.00 C ATOM 317 C ARG A 35 9.627 -10.668 3.720 1.00 0.00 C ATOM 318 O ARG A 35 10.023 -10.224 4.794 1.00 0.00 O ATOM 319 CB ARG A 35 12.008 -11.313 3.196 1.00 0.00 C ATOM 320 CG ARG A 35 12.971 -12.034 2.260 1.00 0.00 C ATOM 321 CD ARG A 35 14.380 -12.123 2.838 1.00 0.00 C ATOM 322 NE ARG A 35 14.930 -10.817 3.224 1.00 0.00 N ATOM 323 CZ ARG A 35 16.017 -10.260 2.666 1.00 0.00 C ATOM 324 NH1 ARG A 35 16.592 -10.823 1.606 1.00 0.00 N ATOM 325 NH2 ARG A 35 16.516 -9.128 3.160 1.00 0.00 N ATOM 0 H ARG A 35 10.409 -10.222 1.201 1.00 0.00 H new ATOM 0 HA ARG A 35 10.288 -12.569 3.005 1.00 0.00 H new ATOM 0 HB2 ARG A 35 12.232 -10.246 3.182 1.00 0.00 H new ATOM 0 HB3 ARG A 35 12.177 -11.661 4.215 1.00 0.00 H new ATOM 0 HG2 ARG A 35 12.598 -13.039 2.061 1.00 0.00 H new ATOM 0 HG3 ARG A 35 13.005 -11.512 1.304 1.00 0.00 H new ATOM 0 HD2 ARG A 35 14.368 -12.777 3.710 1.00 0.00 H new ATOM 0 HD3 ARG A 35 15.039 -12.585 2.103 1.00 0.00 H new ATOM 0 HE ARG A 35 14.456 -10.300 3.964 1.00 0.00 H new ATOM 0 HH11 ARG A 35 16.207 -11.682 1.213 1.00 0.00 H new ATOM 0 HH12 ARG A 35 17.417 -10.395 1.186 1.00 0.00 H new ATOM 0 HH21 ARG A 35 16.072 -8.683 3.963 1.00 0.00 H new ATOM 0 HH22 ARG A 35 17.342 -8.706 2.735 1.00 0.00 H new ATOM 328 N GLY A 36 8.407 -10.448 3.249 1.00 0.00 N ATOM 329 CA GLY A 36 7.441 -9.680 4.005 1.00 0.00 C ATOM 330 C GLY A 36 7.669 -8.190 3.898 1.00 0.00 C ATOM 331 O GLY A 36 7.743 -7.642 2.792 1.00 0.00 O ATOM 0 H GLY A 36 8.069 -10.791 2.350 1.00 0.00 H new ATOM 0 HA2 GLY A 36 6.438 -9.916 3.651 1.00 0.00 H new ATOM 0 HA3 GLY A 36 7.487 -9.976 5.053 1.00 0.00 H new ATOM 335 N THR A 37 7.811 -7.541 5.042 1.00 0.00 N ATOM 336 CA THR A 37 8.005 -6.100 5.107 1.00 0.00 C ATOM 337 C THR A 37 9.357 -5.690 4.524 1.00 0.00 C ATOM 338 O THR A 37 9.609 -4.508 4.247 1.00 0.00 O ATOM 339 CB THR A 37 7.896 -5.605 6.557 1.00 0.00 C ATOM 340 OG1 THR A 37 8.756 -6.389 7.399 1.00 0.00 O ATOM 341 CG2 THR A 37 6.466 -5.716 7.057 1.00 0.00 C ATOM 0 H THR A 37 7.795 -7.998 5.954 1.00 0.00 H new ATOM 0 HA THR A 37 7.219 -5.639 4.509 1.00 0.00 H new ATOM 0 HB THR A 37 8.198 -4.558 6.589 1.00 0.00 H new ATOM 0 HG1 THR A 37 8.687 -6.071 8.323 1.00 0.00 H new ATOM 0 HG21 THR A 37 6.412 -5.360 8.086 1.00 0.00 H new ATOM 0 HG22 THR A 37 5.813 -5.111 6.429 1.00 0.00 H new ATOM 0 HG23 THR A 37 6.146 -6.757 7.016 1.00 0.00 H new ATOM 348 N GLU A 38 10.221 -6.669 4.340 1.00 0.00 N ATOM 349 CA GLU A 38 11.517 -6.437 3.757 1.00 0.00 C ATOM 350 C GLU A 38 11.357 -5.980 2.318 1.00 0.00 C ATOM 351 O GLU A 38 11.984 -5.020 1.885 1.00 0.00 O ATOM 352 CB GLU A 38 12.331 -7.716 3.785 1.00 0.00 C ATOM 353 CG GLU A 38 13.786 -7.518 3.437 1.00 0.00 C ATOM 354 CD GLU A 38 14.570 -6.910 4.570 1.00 0.00 C ATOM 355 OE1 GLU A 38 14.406 -5.708 4.841 1.00 0.00 O ATOM 356 OE2 GLU A 38 15.357 -7.645 5.209 1.00 0.00 O ATOM 0 H GLU A 38 10.041 -7.641 4.591 1.00 0.00 H new ATOM 0 HA GLU A 38 12.030 -5.666 4.332 1.00 0.00 H new ATOM 0 HB2 GLU A 38 12.261 -8.159 4.779 1.00 0.00 H new ATOM 0 HB3 GLU A 38 11.894 -8.430 3.087 1.00 0.00 H new ATOM 0 HG2 GLU A 38 14.226 -8.478 3.168 1.00 0.00 H new ATOM 0 HG3 GLU A 38 13.863 -6.876 2.560 1.00 0.00 H new ATOM 359 N SER A 39 10.490 -6.669 1.596 1.00 0.00 N ATOM 360 CA SER A 39 10.255 -6.390 0.195 1.00 0.00 C ATOM 361 C SER A 39 9.585 -5.038 0.008 1.00 0.00 C ATOM 362 O SER A 39 9.930 -4.282 -0.907 1.00 0.00 O ATOM 363 CB SER A 39 9.396 -7.495 -0.398 1.00 0.00 C ATOM 364 OG SER A 39 9.941 -8.763 -0.082 1.00 0.00 O ATOM 0 H SER A 39 9.931 -7.437 1.967 1.00 0.00 H new ATOM 0 HA SER A 39 11.214 -6.355 -0.322 1.00 0.00 H new ATOM 0 HB2 SER A 39 8.379 -7.422 -0.012 1.00 0.00 H new ATOM 0 HB3 SER A 39 9.335 -7.377 -1.480 1.00 0.00 H new ATOM 0 HG SER A 39 10.858 -8.819 -0.423 1.00 0.00 H new ATOM 370 N THR A 40 8.641 -4.728 0.886 1.00 0.00 N ATOM 371 CA THR A 40 7.929 -3.474 0.810 1.00 0.00 C ATOM 372 C THR A 40 8.876 -2.308 1.063 1.00 0.00 C ATOM 373 O THR A 40 8.866 -1.319 0.331 1.00 0.00 O ATOM 374 CB THR A 40 6.758 -3.435 1.811 1.00 0.00 C ATOM 375 OG1 THR A 40 7.217 -3.814 3.106 1.00 0.00 O ATOM 376 CG2 THR A 40 5.650 -4.380 1.376 1.00 0.00 C ATOM 0 H THR A 40 8.355 -5.332 1.657 1.00 0.00 H new ATOM 0 HA THR A 40 7.518 -3.384 -0.196 1.00 0.00 H new ATOM 0 HB THR A 40 6.365 -2.419 1.841 1.00 0.00 H new ATOM 0 HG1 THR A 40 7.213 -3.032 3.696 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.832 -4.338 2.096 1.00 0.00 H new ATOM 0 HG22 THR A 40 5.284 -4.083 0.393 1.00 0.00 H new ATOM 0 HG23 THR A 40 6.038 -5.397 1.327 1.00 0.00 H new ATOM 383 N GLN A 41 9.718 -2.445 2.087 1.00 0.00 N ATOM 384 CA GLN A 41 10.688 -1.412 2.419 1.00 0.00 C ATOM 385 C GLN A 41 11.737 -1.299 1.320 1.00 0.00 C ATOM 386 O GLN A 41 12.152 -0.199 0.958 1.00 0.00 O ATOM 387 CB GLN A 41 11.373 -1.721 3.754 1.00 0.00 C ATOM 388 CG GLN A 41 12.358 -0.647 4.193 1.00 0.00 C ATOM 389 CD GLN A 41 13.155 -1.031 5.424 1.00 0.00 C ATOM 390 OE1 GLN A 41 12.577 -1.854 6.281 1.00 0.00 O flip ATOM 391 NE2 GLN A 41 14.290 -0.588 5.599 1.00 0.00 N flip ATOM 0 H GLN A 41 9.745 -3.261 2.698 1.00 0.00 H new ATOM 0 HA GLN A 41 10.157 -0.464 2.507 1.00 0.00 H new ATOM 0 HB2 GLN A 41 10.612 -1.842 4.525 1.00 0.00 H new ATOM 0 HB3 GLN A 41 11.898 -2.673 3.672 1.00 0.00 H new ATOM 0 HG2 GLN A 41 13.046 -0.438 3.374 1.00 0.00 H new ATOM 0 HG3 GLN A 41 11.813 0.275 4.395 1.00 0.00 H new ATOM 0 HE21 GLN A 41 14.702 0.045 4.914 1.00 0.00 H new ATOM 0 HE22 GLN A 41 14.819 -0.854 6.429 1.00 0.00 H new ATOM 400 N ASP A 42 12.150 -2.450 0.796 1.00 0.00 N ATOM 401 CA ASP A 42 13.165 -2.516 -0.257 1.00 0.00 C ATOM 402 C ASP A 42 12.746 -1.691 -1.464 1.00 0.00 C ATOM 403 O ASP A 42 13.454 -0.771 -1.872 1.00 0.00 O ATOM 404 CB ASP A 42 13.403 -3.972 -0.675 1.00 0.00 C ATOM 405 CG ASP A 42 14.640 -4.147 -1.536 1.00 0.00 C ATOM 406 OD1 ASP A 42 14.552 -3.959 -2.762 1.00 0.00 O ATOM 407 OD2 ASP A 42 15.705 -4.494 -0.981 1.00 0.00 O ATOM 0 H ASP A 42 11.794 -3.361 1.086 1.00 0.00 H new ATOM 0 HA ASP A 42 14.093 -2.103 0.139 1.00 0.00 H new ATOM 0 HB2 ASP A 42 13.498 -4.590 0.218 1.00 0.00 H new ATOM 0 HB3 ASP A 42 12.532 -4.334 -1.222 1.00 0.00 H new ATOM 410 N ALA A 43 11.576 -2.011 -2.019 1.00 0.00 N ATOM 411 CA ALA A 43 11.062 -1.294 -3.184 1.00 0.00 C ATOM 412 C ALA A 43 10.801 0.168 -2.849 1.00 0.00 C ATOM 413 O ALA A 43 11.113 1.069 -3.645 1.00 0.00 O ATOM 414 CB ALA A 43 9.791 -1.952 -3.699 1.00 0.00 C ATOM 0 H ALA A 43 10.970 -2.759 -1.682 1.00 0.00 H new ATOM 0 HA ALA A 43 11.819 -1.337 -3.968 1.00 0.00 H new ATOM 0 HB1 ALA A 43 9.423 -1.404 -4.567 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.004 -2.982 -3.984 1.00 0.00 H new ATOM 0 HB3 ALA A 43 9.033 -1.942 -2.916 1.00 0.00 H new ATOM 420 N CYS A 44 10.238 0.397 -1.661 1.00 0.00 N ATOM 421 CA CYS A 44 9.928 1.737 -1.198 1.00 0.00 C ATOM 422 C CYS A 44 11.165 2.618 -1.207 1.00 0.00 C ATOM 423 O CYS A 44 11.227 3.593 -1.944 1.00 0.00 O ATOM 424 CB CYS A 44 9.331 1.691 0.211 1.00 0.00 C ATOM 425 SG CYS A 44 8.974 3.308 0.923 1.00 0.00 S ATOM 0 H CYS A 44 9.988 -0.340 -1.002 1.00 0.00 H new ATOM 0 HA CYS A 44 9.195 2.166 -1.882 1.00 0.00 H new ATOM 0 HB2 CYS A 44 8.410 1.109 0.183 1.00 0.00 H new ATOM 0 HB3 CYS A 44 10.022 1.163 0.868 1.00 0.00 H new ATOM 0 HG CYS A 44 9.824 3.561 1.873 1.00 0.00 H new ATOM 431 N ALA A 45 12.160 2.246 -0.409 1.00 0.00 N ATOM 432 CA ALA A 45 13.386 3.023 -0.287 1.00 0.00 C ATOM 433 C ALA A 45 14.110 3.145 -1.623 1.00 0.00 C ATOM 434 O ALA A 45 14.638 4.211 -1.956 1.00 0.00 O ATOM 435 CB ALA A 45 14.298 2.404 0.758 1.00 0.00 C ATOM 0 H ALA A 45 12.140 1.404 0.167 1.00 0.00 H new ATOM 0 HA ALA A 45 13.113 4.029 0.031 1.00 0.00 H new ATOM 0 HB1 ALA A 45 15.211 2.994 0.840 1.00 0.00 H new ATOM 0 HB2 ALA A 45 13.789 2.388 1.722 1.00 0.00 H new ATOM 0 HB3 ALA A 45 14.550 1.385 0.464 1.00 0.00 H new ATOM 441 N LYS A 46 14.109 2.058 -2.393 1.00 0.00 N ATOM 442 CA LYS A 46 14.771 2.031 -3.690 1.00 0.00 C ATOM 443 C LYS A 46 14.249 3.156 -4.585 1.00 0.00 C ATOM 444 O LYS A 46 15.019 4.013 -5.050 1.00 0.00 O ATOM 445 CB LYS A 46 14.548 0.672 -4.364 1.00 0.00 C ATOM 446 CG LYS A 46 15.498 0.379 -5.514 1.00 0.00 C ATOM 447 CD LYS A 46 15.214 -0.988 -6.122 1.00 0.00 C ATOM 448 CE LYS A 46 16.309 -1.410 -7.094 1.00 0.00 C ATOM 449 NZ LYS A 46 16.447 -0.465 -8.226 1.00 0.00 N ATOM 0 H LYS A 46 13.654 1.182 -2.137 1.00 0.00 H new ATOM 0 HA LYS A 46 15.840 2.181 -3.538 1.00 0.00 H new ATOM 0 HB2 LYS A 46 14.651 -0.113 -3.615 1.00 0.00 H new ATOM 0 HB3 LYS A 46 13.524 0.627 -4.734 1.00 0.00 H new ATOM 0 HG2 LYS A 46 15.397 1.149 -6.279 1.00 0.00 H new ATOM 0 HG3 LYS A 46 16.528 0.416 -5.158 1.00 0.00 H new ATOM 0 HD2 LYS A 46 15.127 -1.729 -5.327 1.00 0.00 H new ATOM 0 HD3 LYS A 46 14.256 -0.964 -6.641 1.00 0.00 H new ATOM 0 HE2 LYS A 46 17.258 -1.478 -6.562 1.00 0.00 H new ATOM 0 HE3 LYS A 46 16.087 -2.405 -7.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 17.155 -0.827 -8.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 15.532 -0.367 -8.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 16.751 0.463 -7.868 1.00 0.00 H new ATOM 452 N MET A 47 12.946 3.180 -4.800 1.00 0.00 N ATOM 453 CA MET A 47 12.359 4.196 -5.652 1.00 0.00 C ATOM 454 C MET A 47 12.238 5.528 -4.944 1.00 0.00 C ATOM 455 O MET A 47 12.218 6.562 -5.588 1.00 0.00 O ATOM 456 CB MET A 47 11.016 3.764 -6.198 1.00 0.00 C ATOM 457 CG MET A 47 11.107 2.691 -7.262 1.00 0.00 C ATOM 458 SD MET A 47 9.541 2.432 -8.092 1.00 0.00 S ATOM 459 CE MET A 47 8.504 2.062 -6.685 1.00 0.00 C ATOM 0 H MET A 47 12.282 2.516 -4.402 1.00 0.00 H new ATOM 0 HA MET A 47 13.041 4.324 -6.493 1.00 0.00 H new ATOM 0 HB2 MET A 47 10.401 3.397 -5.376 1.00 0.00 H new ATOM 0 HB3 MET A 47 10.506 4.633 -6.614 1.00 0.00 H new ATOM 0 HG2 MET A 47 11.864 2.971 -7.995 1.00 0.00 H new ATOM 0 HG3 MET A 47 11.435 1.756 -6.807 1.00 0.00 H new ATOM 0 HE1 MET A 47 7.673 1.432 -7.001 1.00 0.00 H new ATOM 0 HE2 MET A 47 9.089 1.538 -5.929 1.00 0.00 H new ATOM 0 HE3 MET A 47 8.116 2.990 -6.265 1.00 0.00 H new ATOM 469 N ARG A 48 12.164 5.504 -3.623 1.00 0.00 N ATOM 470 CA ARG A 48 12.087 6.737 -2.840 1.00 0.00 C ATOM 471 C ARG A 48 13.377 7.542 -3.017 1.00 0.00 C ATOM 472 O ARG A 48 13.378 8.770 -2.946 1.00 0.00 O ATOM 473 CB ARG A 48 11.862 6.417 -1.359 1.00 0.00 C ATOM 474 CG ARG A 48 11.688 7.636 -0.470 1.00 0.00 C ATOM 475 CD ARG A 48 11.555 7.231 0.986 1.00 0.00 C ATOM 476 NE ARG A 48 11.490 8.393 1.875 1.00 0.00 N ATOM 477 CZ ARG A 48 12.202 8.521 2.998 1.00 0.00 C ATOM 478 NH1 ARG A 48 13.039 7.563 3.373 1.00 0.00 N ATOM 479 NH2 ARG A 48 12.074 9.609 3.742 1.00 0.00 N ATOM 0 H ARG A 48 12.155 4.649 -3.067 1.00 0.00 H new ATOM 0 HA ARG A 48 11.244 7.329 -3.196 1.00 0.00 H new ATOM 0 HB2 ARG A 48 10.977 5.787 -1.267 1.00 0.00 H new ATOM 0 HB3 ARG A 48 12.708 5.835 -0.994 1.00 0.00 H new ATOM 0 HG2 ARG A 48 12.542 8.303 -0.589 1.00 0.00 H new ATOM 0 HG3 ARG A 48 10.803 8.193 -0.779 1.00 0.00 H new ATOM 0 HD2 ARG A 48 10.657 6.626 1.114 1.00 0.00 H new ATOM 0 HD3 ARG A 48 12.403 6.606 1.267 1.00 0.00 H new ATOM 0 HE ARG A 48 10.860 9.154 1.620 1.00 0.00 H new ATOM 0 HH11 ARG A 48 13.141 6.723 2.803 1.00 0.00 H new ATOM 0 HH12 ARG A 48 13.580 7.666 4.231 1.00 0.00 H new ATOM 0 HH21 ARG A 48 11.432 10.349 3.457 1.00 0.00 H new ATOM 0 HH22 ARG A 48 12.617 9.707 4.600 1.00 0.00 H new ATOM 482 N ALA A 49 14.474 6.832 -3.229 1.00 0.00 N ATOM 483 CA ALA A 49 15.754 7.464 -3.485 1.00 0.00 C ATOM 484 C ALA A 49 15.935 7.716 -4.977 1.00 0.00 C ATOM 485 O ALA A 49 16.642 8.635 -5.383 1.00 0.00 O ATOM 486 CB ALA A 49 16.885 6.599 -2.953 1.00 0.00 C ATOM 0 H ALA A 49 14.501 5.812 -3.228 1.00 0.00 H new ATOM 0 HA ALA A 49 15.777 8.423 -2.968 1.00 0.00 H new ATOM 0 HB1 ALA A 49 17.840 7.086 -3.152 1.00 0.00 H new ATOM 0 HB2 ALA A 49 16.764 6.463 -1.878 1.00 0.00 H new ATOM 0 HB3 ALA A 49 16.863 5.627 -3.447 1.00 0.00 H new ATOM 492 N ASN A 50 15.291 6.890 -5.792 1.00 0.00 N ATOM 493 CA ASN A 50 15.390 7.008 -7.248 1.00 0.00 C ATOM 494 C ASN A 50 14.549 8.177 -7.794 1.00 0.00 C ATOM 495 O ASN A 50 14.965 8.858 -8.729 1.00 0.00 O ATOM 496 CB ASN A 50 14.957 5.699 -7.917 1.00 0.00 C ATOM 497 CG ASN A 50 15.207 5.688 -9.416 1.00 0.00 C ATOM 498 OD1 ASN A 50 16.158 6.298 -9.908 1.00 0.00 O ATOM 499 ND2 ASN A 50 14.357 4.989 -10.148 1.00 0.00 N ATOM 0 H ASN A 50 14.693 6.128 -5.472 1.00 0.00 H new ATOM 0 HA ASN A 50 16.434 7.213 -7.485 1.00 0.00 H new ATOM 0 HB2 ASN A 50 15.493 4.868 -7.459 1.00 0.00 H new ATOM 0 HB3 ASN A 50 13.896 5.535 -7.730 1.00 0.00 H new ATOM 0 HD21 ASN A 50 14.476 4.940 -11.160 1.00 0.00 H new ATOM 0 HD22 ASN A 50 13.583 4.498 -9.701 1.00 0.00 H new ATOM 506 N CYS A 51 13.372 8.404 -7.203 1.00 0.00 N ATOM 507 CA CYS A 51 12.466 9.468 -7.662 1.00 0.00 C ATOM 508 C CYS A 51 13.126 10.839 -7.564 1.00 0.00 C ATOM 509 O CYS A 51 12.962 11.686 -8.449 1.00 0.00 O ATOM 510 CB CYS A 51 11.155 9.446 -6.863 1.00 0.00 C ATOM 511 SG CYS A 51 11.372 9.602 -5.077 1.00 0.00 S ATOM 0 H CYS A 51 13.023 7.869 -6.408 1.00 0.00 H new ATOM 0 HA CYS A 51 12.238 9.279 -8.711 1.00 0.00 H new ATOM 0 HB2 CYS A 51 10.516 10.258 -7.212 1.00 0.00 H new ATOM 0 HB3 CYS A 51 10.630 8.514 -7.074 1.00 0.00 H new ATOM 0 HG CYS A 51 12.550 9.165 -4.743 1.00 0.00 H new ATOM 517 N GLN A 52 13.866 11.055 -6.491 1.00 0.00 N ATOM 518 CA GLN A 52 14.591 12.294 -6.307 1.00 0.00 C ATOM 519 C GLN A 52 15.888 12.258 -7.118 1.00 0.00 C ATOM 520 O GLN A 52 16.945 11.859 -6.630 1.00 0.00 O ATOM 521 CB GLN A 52 14.859 12.551 -4.814 1.00 0.00 C ATOM 522 CG GLN A 52 15.525 11.390 -4.084 1.00 0.00 C ATOM 523 CD GLN A 52 15.636 11.629 -2.597 1.00 0.00 C ATOM 524 OE1 GLN A 52 16.610 12.207 -2.122 1.00 0.00 O ATOM 525 NE2 GLN A 52 14.648 11.174 -1.853 1.00 0.00 N ATOM 0 H GLN A 52 13.979 10.383 -5.732 1.00 0.00 H new ATOM 0 HA GLN A 52 13.985 13.123 -6.672 1.00 0.00 H new ATOM 0 HB2 GLN A 52 15.490 13.435 -4.718 1.00 0.00 H new ATOM 0 HB3 GLN A 52 13.914 12.779 -4.322 1.00 0.00 H new ATOM 0 HG2 GLN A 52 14.954 10.479 -4.261 1.00 0.00 H new ATOM 0 HG3 GLN A 52 16.520 11.228 -4.498 1.00 0.00 H new ATOM 0 HE21 GLN A 52 13.858 10.700 -2.289 1.00 0.00 H new ATOM 0 HE22 GLN A 52 14.674 11.296 -0.841 1.00 0.00 H new ATOM 534 N LYS A 53 15.785 12.638 -8.369 1.00 0.00 N ATOM 535 CA LYS A 53 16.909 12.578 -9.275 1.00 0.00 C ATOM 536 C LYS A 53 17.311 13.975 -9.723 1.00 0.00 C ATOM 537 O LYS A 53 16.490 14.895 -9.718 1.00 0.00 O ATOM 538 CB LYS A 53 16.532 11.727 -10.497 1.00 0.00 C ATOM 539 CG LYS A 53 17.717 11.238 -11.320 1.00 0.00 C ATOM 540 CD LYS A 53 18.568 10.237 -10.545 1.00 0.00 C ATOM 541 CE LYS A 53 17.778 8.988 -10.189 1.00 0.00 C ATOM 542 NZ LYS A 53 18.593 8.012 -9.432 1.00 0.00 N ATOM 0 H LYS A 53 14.926 12.996 -8.787 1.00 0.00 H new ATOM 0 HA LYS A 53 17.756 12.125 -8.759 1.00 0.00 H new ATOM 0 HB2 LYS A 53 15.960 10.863 -10.159 1.00 0.00 H new ATOM 0 HB3 LYS A 53 15.875 12.311 -11.142 1.00 0.00 H new ATOM 0 HG2 LYS A 53 17.356 10.775 -12.238 1.00 0.00 H new ATOM 0 HG3 LYS A 53 18.332 12.089 -11.613 1.00 0.00 H new ATOM 0 HD2 LYS A 53 19.438 9.960 -11.140 1.00 0.00 H new ATOM 0 HD3 LYS A 53 18.941 10.704 -9.634 1.00 0.00 H new ATOM 0 HE2 LYS A 53 16.906 9.267 -9.598 1.00 0.00 H new ATOM 0 HE3 LYS A 53 17.408 8.521 -11.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 18.076 7.113 -9.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 19.494 7.854 -9.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 18.783 8.383 -8.479 1.00 0.00 H new ATOM 545 N SER A 54 18.576 14.129 -10.101 1.00 0.00 N ATOM 546 CA SER A 54 19.073 15.396 -10.611 1.00 0.00 C ATOM 547 C SER A 54 18.419 15.711 -11.954 1.00 0.00 C ATOM 548 O SER A 54 18.331 16.870 -12.365 1.00 0.00 O ATOM 549 CB SER A 54 20.593 15.333 -10.762 1.00 0.00 C ATOM 550 OG SER A 54 20.976 14.187 -11.507 1.00 0.00 O ATOM 0 H SER A 54 19.275 13.388 -10.062 1.00 0.00 H new ATOM 0 HA SER A 54 18.822 16.189 -9.907 1.00 0.00 H new ATOM 0 HB2 SER A 54 20.952 16.234 -11.261 1.00 0.00 H new ATOM 0 HB3 SER A 54 21.060 15.306 -9.778 1.00 0.00 H new ATOM 0 HG SER A 54 21.952 14.165 -11.595 1.00 0.00 H new ATOM 556 N THR A 55 17.967 14.664 -12.630 1.00 0.00 N ATOM 557 CA THR A 55 17.278 14.801 -13.887 1.00 0.00 C ATOM 558 C THR A 55 15.854 15.292 -13.635 1.00 0.00 C ATOM 559 O THR A 55 15.002 14.526 -13.184 1.00 0.00 O ATOM 560 CB THR A 55 17.215 13.451 -14.626 1.00 0.00 C ATOM 561 OG1 THR A 55 18.470 12.764 -14.493 1.00 0.00 O ATOM 562 CG2 THR A 55 16.909 13.660 -16.101 1.00 0.00 C ATOM 0 H THR A 55 18.072 13.700 -12.315 1.00 0.00 H new ATOM 0 HA THR A 55 17.823 15.517 -14.502 1.00 0.00 H new ATOM 0 HB THR A 55 16.419 12.853 -14.182 1.00 0.00 H new ATOM 0 HG1 THR A 55 18.424 11.905 -14.963 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.869 12.694 -16.605 1.00 0.00 H new ATOM 0 HG22 THR A 55 15.948 14.164 -16.205 1.00 0.00 H new ATOM 0 HG23 THR A 55 17.690 14.272 -16.552 1.00 0.00 H new ATOM 569 N GLU A 56 15.597 16.559 -13.925 1.00 0.00 N ATOM 570 CA GLU A 56 14.275 17.136 -13.689 1.00 0.00 C ATOM 571 C GLU A 56 13.288 16.741 -14.792 1.00 0.00 C ATOM 572 O GLU A 56 12.141 17.193 -14.814 1.00 0.00 O ATOM 573 CB GLU A 56 14.360 18.660 -13.554 1.00 0.00 C ATOM 574 CG GLU A 56 14.929 19.362 -14.772 1.00 0.00 C ATOM 575 CD GLU A 56 14.892 20.865 -14.639 1.00 0.00 C ATOM 576 OE1 GLU A 56 13.784 21.435 -14.650 1.00 0.00 O ATOM 577 OE2 GLU A 56 15.969 21.486 -14.534 1.00 0.00 O ATOM 0 H GLU A 56 16.279 17.206 -14.321 1.00 0.00 H new ATOM 0 HA GLU A 56 13.901 16.731 -12.749 1.00 0.00 H new ATOM 0 HB2 GLU A 56 13.362 19.052 -13.356 1.00 0.00 H new ATOM 0 HB3 GLU A 56 14.976 18.903 -12.688 1.00 0.00 H new ATOM 0 HG2 GLU A 56 15.958 19.039 -14.926 1.00 0.00 H new ATOM 0 HG3 GLU A 56 14.365 19.064 -15.656 1.00 0.00 H new ATOM 580 N GLN A 57 13.736 15.880 -15.694 1.00 0.00 N ATOM 581 CA GLN A 57 12.895 15.392 -16.778 1.00 0.00 C ATOM 582 C GLN A 57 12.023 14.234 -16.275 1.00 0.00 C ATOM 583 O GLN A 57 11.214 13.673 -17.018 1.00 0.00 O ATOM 584 CB GLN A 57 13.772 14.946 -17.962 1.00 0.00 C ATOM 585 CG GLN A 57 13.010 14.683 -19.260 1.00 0.00 C ATOM 586 CD GLN A 57 12.193 15.880 -19.719 1.00 0.00 C ATOM 587 OE1 GLN A 57 12.529 17.026 -19.426 1.00 0.00 O ATOM 588 NE2 GLN A 57 11.129 15.623 -20.461 1.00 0.00 N ATOM 0 H GLN A 57 14.684 15.503 -15.696 1.00 0.00 H new ATOM 0 HA GLN A 57 12.241 16.194 -17.121 1.00 0.00 H new ATOM 0 HB2 GLN A 57 14.524 15.713 -18.148 1.00 0.00 H new ATOM 0 HB3 GLN A 57 14.305 14.038 -17.680 1.00 0.00 H new ATOM 0 HG2 GLN A 57 13.718 14.411 -20.043 1.00 0.00 H new ATOM 0 HG3 GLN A 57 12.347 13.829 -19.120 1.00 0.00 H new ATOM 0 HE21 GLN A 57 10.883 14.658 -20.683 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.555 16.389 -20.812 1.00 0.00 H new ATOM 597 N MET A 58 12.197 13.898 -14.999 1.00 0.00 N ATOM 598 CA MET A 58 11.436 12.832 -14.356 1.00 0.00 C ATOM 599 C MET A 58 9.944 13.157 -14.353 1.00 0.00 C ATOM 600 O MET A 58 9.547 14.328 -14.303 1.00 0.00 O ATOM 601 CB MET A 58 11.941 12.613 -12.919 1.00 0.00 C ATOM 602 CG MET A 58 11.206 11.515 -12.155 1.00 0.00 C ATOM 603 SD MET A 58 11.282 9.907 -12.983 1.00 0.00 S ATOM 604 CE MET A 58 13.044 9.577 -12.919 1.00 0.00 C ATOM 0 H MET A 58 12.869 14.357 -14.383 1.00 0.00 H new ATOM 0 HA MET A 58 11.582 11.913 -14.924 1.00 0.00 H new ATOM 0 HB2 MET A 58 13.002 12.368 -12.953 1.00 0.00 H new ATOM 0 HB3 MET A 58 11.848 13.548 -12.367 1.00 0.00 H new ATOM 0 HG2 MET A 58 11.635 11.425 -11.157 1.00 0.00 H new ATOM 0 HG3 MET A 58 10.163 11.804 -12.029 1.00 0.00 H new ATOM 0 HE1 MET A 58 13.226 8.525 -13.141 1.00 0.00 H new ATOM 0 HE2 MET A 58 13.557 10.197 -13.654 1.00 0.00 H new ATOM 0 HE3 MET A 58 13.421 9.808 -11.923 1.00 0.00 H new ATOM 614 N LYS A 59 9.126 12.127 -14.420 1.00 0.00 N ATOM 615 CA LYS A 59 7.686 12.292 -14.445 1.00 0.00 C ATOM 616 C LYS A 59 7.110 12.100 -13.058 1.00 0.00 C ATOM 617 O LYS A 59 7.686 11.393 -12.232 1.00 0.00 O ATOM 618 CB LYS A 59 7.030 11.290 -15.418 1.00 0.00 C ATOM 619 CG LYS A 59 7.410 11.484 -16.882 1.00 0.00 C ATOM 620 CD LYS A 59 8.820 10.994 -17.181 1.00 0.00 C ATOM 621 CE LYS A 59 9.260 11.394 -18.575 1.00 0.00 C ATOM 622 NZ LYS A 59 9.287 12.868 -18.738 1.00 0.00 N ATOM 0 H LYS A 59 9.438 11.157 -14.459 1.00 0.00 H new ATOM 0 HA LYS A 59 7.472 13.304 -14.789 1.00 0.00 H new ATOM 0 HB2 LYS A 59 7.304 10.279 -15.116 1.00 0.00 H new ATOM 0 HB3 LYS A 59 5.947 11.369 -15.324 1.00 0.00 H new ATOM 0 HG2 LYS A 59 6.700 10.950 -17.513 1.00 0.00 H new ATOM 0 HG3 LYS A 59 7.332 12.541 -17.139 1.00 0.00 H new ATOM 0 HD2 LYS A 59 9.513 11.405 -16.447 1.00 0.00 H new ATOM 0 HD3 LYS A 59 8.858 9.909 -17.083 1.00 0.00 H new ATOM 0 HE2 LYS A 59 10.251 10.987 -18.775 1.00 0.00 H new ATOM 0 HE3 LYS A 59 8.583 10.959 -19.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 9.795 13.111 -19.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 8.313 13.229 -18.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 9.772 13.298 -17.925 1.00 0.00 H new ATOM 625 N LYS A 60 5.984 12.737 -12.800 1.00 0.00 N ATOM 626 CA LYS A 60 5.317 12.588 -11.527 1.00 0.00 C ATOM 627 C LYS A 60 4.407 11.374 -11.552 1.00 0.00 C ATOM 628 O LYS A 60 4.046 10.871 -12.622 1.00 0.00 O ATOM 629 CB LYS A 60 4.520 13.844 -11.164 1.00 0.00 C ATOM 630 CG LYS A 60 5.388 15.041 -10.813 1.00 0.00 C ATOM 631 CD LYS A 60 4.544 16.245 -10.425 1.00 0.00 C ATOM 632 CE LYS A 60 5.410 17.450 -10.076 1.00 0.00 C ATOM 633 NZ LYS A 60 6.338 17.809 -11.178 1.00 0.00 N ATOM 0 H LYS A 60 5.515 13.361 -13.456 1.00 0.00 H new ATOM 0 HA LYS A 60 6.080 12.445 -10.762 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.875 14.108 -12.002 1.00 0.00 H new ATOM 0 HB3 LYS A 60 3.869 13.619 -10.319 1.00 0.00 H new ATOM 0 HG2 LYS A 60 6.053 14.781 -9.990 1.00 0.00 H new ATOM 0 HG3 LYS A 60 6.019 15.297 -11.664 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.877 16.502 -11.248 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.915 15.989 -9.572 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.770 18.303 -9.850 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.984 17.234 -9.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 6.732 18.756 -11.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 7.111 17.114 -11.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 5.822 17.809 -12.081 1.00 0.00 H new ATOM 636 N VAL A 61 4.046 10.913 -10.386 1.00 0.00 N ATOM 637 CA VAL A 61 3.205 9.747 -10.254 1.00 0.00 C ATOM 638 C VAL A 61 1.718 10.134 -10.265 1.00 0.00 C ATOM 639 O VAL A 61 1.346 11.206 -9.779 1.00 0.00 O ATOM 640 CB VAL A 61 3.549 8.975 -8.964 1.00 0.00 C ATOM 641 CG1 VAL A 61 4.915 8.321 -9.102 1.00 0.00 C ATOM 642 CG2 VAL A 61 3.542 9.907 -7.763 1.00 0.00 C ATOM 0 H VAL A 61 4.324 11.332 -9.499 1.00 0.00 H new ATOM 0 HA VAL A 61 3.393 9.099 -11.110 1.00 0.00 H new ATOM 0 HB VAL A 61 2.793 8.205 -8.809 1.00 0.00 H new ATOM 0 HG11 VAL A 61 5.152 7.777 -8.188 1.00 0.00 H new ATOM 0 HG12 VAL A 61 4.903 7.628 -9.943 1.00 0.00 H new ATOM 0 HG13 VAL A 61 5.670 9.088 -9.274 1.00 0.00 H new ATOM 0 HG21 VAL A 61 3.787 9.343 -6.863 1.00 0.00 H new ATOM 0 HG22 VAL A 61 4.281 10.695 -7.910 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.553 10.352 -7.654 1.00 0.00 H new ATOM 652 N PRO A 62 0.850 9.277 -10.842 1.00 0.00 N ATOM 653 CA PRO A 62 -0.579 9.546 -10.930 1.00 0.00 C ATOM 654 C PRO A 62 -1.315 9.199 -9.642 1.00 0.00 C ATOM 655 O PRO A 62 -0.861 8.364 -8.854 1.00 0.00 O ATOM 656 CB PRO A 62 -1.059 8.631 -12.076 1.00 0.00 C ATOM 657 CG PRO A 62 0.142 7.843 -12.517 1.00 0.00 C ATOM 658 CD PRO A 62 1.183 7.989 -11.442 1.00 0.00 C ATOM 0 HA PRO A 62 -0.776 10.604 -11.102 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -1.856 7.969 -11.737 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -1.462 9.219 -12.900 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -0.117 6.794 -12.663 1.00 0.00 H new ATOM 0 HG3 PRO A 62 0.518 8.214 -13.471 1.00 0.00 H new ATOM 0 HD2 PRO A 62 1.130 7.178 -10.715 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.192 7.983 -11.853 1.00 0.00 H new ATOM 666 N THR A 63 -2.444 9.840 -9.432 1.00 0.00 N ATOM 667 CA THR A 63 -3.251 9.603 -8.264 1.00 0.00 C ATOM 668 C THR A 63 -4.252 8.478 -8.525 1.00 0.00 C ATOM 669 O THR A 63 -4.907 8.443 -9.567 1.00 0.00 O ATOM 670 CB THR A 63 -4.004 10.881 -7.853 1.00 0.00 C ATOM 671 OG1 THR A 63 -3.073 11.971 -7.765 1.00 0.00 O ATOM 672 CG2 THR A 63 -4.693 10.693 -6.506 1.00 0.00 C ATOM 0 H THR A 63 -2.825 10.540 -10.069 1.00 0.00 H new ATOM 0 HA THR A 63 -2.588 9.309 -7.451 1.00 0.00 H new ATOM 0 HB THR A 63 -4.764 11.097 -8.604 1.00 0.00 H new ATOM 0 HG1 THR A 63 -3.549 12.787 -7.505 1.00 0.00 H new ATOM 0 HG21 THR A 63 -5.219 11.609 -6.235 1.00 0.00 H new ATOM 0 HG22 THR A 63 -5.406 9.871 -6.574 1.00 0.00 H new ATOM 0 HG23 THR A 63 -3.947 10.464 -5.745 1.00 0.00 H new ATOM 679 N ILE A 64 -4.350 7.571 -7.585 1.00 0.00 N ATOM 680 CA ILE A 64 -5.229 6.437 -7.695 1.00 0.00 C ATOM 681 C ILE A 64 -6.146 6.362 -6.459 1.00 0.00 C ATOM 682 O ILE A 64 -5.685 6.493 -5.319 1.00 0.00 O ATOM 683 CB ILE A 64 -4.384 5.118 -7.883 1.00 0.00 C ATOM 684 CG1 ILE A 64 -5.266 3.873 -8.117 1.00 0.00 C ATOM 685 CG2 ILE A 64 -3.426 4.897 -6.715 1.00 0.00 C ATOM 686 CD1 ILE A 64 -5.828 3.245 -6.861 1.00 0.00 C ATOM 0 H ILE A 64 -3.817 7.601 -6.716 1.00 0.00 H new ATOM 0 HA ILE A 64 -5.866 6.549 -8.572 1.00 0.00 H new ATOM 0 HB ILE A 64 -3.792 5.260 -8.787 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -6.094 4.150 -8.769 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -4.679 3.124 -8.648 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.860 3.980 -6.877 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.739 5.740 -6.644 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -3.995 4.813 -5.789 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -6.433 2.378 -7.127 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -5.009 2.931 -6.214 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -6.447 3.973 -6.336 1.00 0.00 H new ATOM 697 N ILE A 65 -7.442 6.195 -6.699 1.00 0.00 N ATOM 698 CA ILE A 65 -8.415 6.086 -5.624 1.00 0.00 C ATOM 699 C ILE A 65 -8.487 4.655 -5.144 1.00 0.00 C ATOM 700 O ILE A 65 -8.934 3.761 -5.875 1.00 0.00 O ATOM 701 CB ILE A 65 -9.851 6.533 -6.046 1.00 0.00 C ATOM 702 CG1 ILE A 65 -9.861 7.956 -6.608 1.00 0.00 C ATOM 703 CG2 ILE A 65 -10.812 6.429 -4.866 1.00 0.00 C ATOM 704 CD1 ILE A 65 -9.612 8.024 -8.094 1.00 0.00 C ATOM 0 H ILE A 65 -7.842 6.132 -7.635 1.00 0.00 H new ATOM 0 HA ILE A 65 -8.075 6.755 -4.834 1.00 0.00 H new ATOM 0 HB ILE A 65 -10.182 5.860 -6.837 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -10.824 8.417 -6.389 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -9.101 8.545 -6.094 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -11.807 6.744 -5.179 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -10.851 5.397 -4.518 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -10.465 7.072 -4.057 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -9.634 9.064 -8.419 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -8.636 7.594 -8.319 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -10.386 7.463 -8.619 1.00 0.00 H new ATOM 715 N LEU A 66 -8.028 4.434 -3.946 1.00 0.00 N ATOM 716 CA LEU A 66 -8.058 3.130 -3.354 1.00 0.00 C ATOM 717 C LEU A 66 -9.385 2.904 -2.669 1.00 0.00 C ATOM 718 O LEU A 66 -9.604 3.365 -1.542 1.00 0.00 O ATOM 719 CB LEU A 66 -6.911 2.973 -2.359 1.00 0.00 C ATOM 720 CG LEU A 66 -5.511 3.042 -2.962 1.00 0.00 C ATOM 721 CD1 LEU A 66 -4.473 3.166 -1.885 1.00 0.00 C ATOM 722 CD2 LEU A 66 -5.233 1.816 -3.794 1.00 0.00 C ATOM 0 H LEU A 66 -7.621 5.156 -3.351 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.937 2.384 -4.139 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -7.001 3.751 -1.600 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -7.022 2.016 -1.849 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.464 3.925 -3.600 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.483 3.214 -2.338 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.653 4.074 -1.309 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.529 2.301 -1.225 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.230 1.882 -4.216 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -5.305 0.927 -3.167 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.963 1.751 -4.601 1.00 0.00 H new ATOM 734 N SER A 67 -10.282 2.239 -3.367 1.00 0.00 N ATOM 735 CA SER A 67 -11.569 1.908 -2.825 1.00 0.00 C ATOM 736 C SER A 67 -11.486 0.555 -2.150 1.00 0.00 C ATOM 737 O SER A 67 -11.630 -0.491 -2.786 1.00 0.00 O ATOM 738 CB SER A 67 -12.616 1.887 -3.924 1.00 0.00 C ATOM 739 OG SER A 67 -12.668 3.132 -4.608 1.00 0.00 O ATOM 0 H SER A 67 -10.133 1.917 -4.323 1.00 0.00 H new ATOM 0 HA SER A 67 -11.861 2.662 -2.094 1.00 0.00 H new ATOM 0 HB2 SER A 67 -12.389 1.090 -4.631 1.00 0.00 H new ATOM 0 HB3 SER A 67 -13.593 1.664 -3.495 1.00 0.00 H new ATOM 0 HG SER A 67 -13.233 3.757 -4.108 1.00 0.00 H new ATOM 745 N VAL A 68 -11.215 0.585 -0.880 1.00 0.00 N ATOM 746 CA VAL A 68 -11.049 -0.619 -0.100 1.00 0.00 C ATOM 747 C VAL A 68 -12.317 -0.955 0.677 1.00 0.00 C ATOM 748 O VAL A 68 -12.868 -0.119 1.394 1.00 0.00 O ATOM 749 CB VAL A 68 -9.826 -0.516 0.865 1.00 0.00 C ATOM 750 CG1 VAL A 68 -9.851 0.788 1.643 1.00 0.00 C ATOM 751 CG2 VAL A 68 -9.773 -1.706 1.821 1.00 0.00 C ATOM 0 H VAL A 68 -11.101 1.447 -0.346 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.854 -1.430 -0.802 1.00 0.00 H new ATOM 0 HB VAL A 68 -8.925 -0.532 0.252 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -8.988 0.832 2.307 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -9.818 1.627 0.948 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.766 0.842 2.233 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.911 -1.605 2.480 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -10.685 -1.734 2.418 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.686 -2.629 1.248 1.00 0.00 H new ATOM 761 N SER A 69 -12.791 -2.164 0.494 1.00 0.00 N ATOM 762 CA SER A 69 -13.958 -2.643 1.188 1.00 0.00 C ATOM 763 C SER A 69 -13.668 -4.023 1.763 1.00 0.00 C ATOM 764 O SER A 69 -12.834 -4.758 1.231 1.00 0.00 O ATOM 765 CB SER A 69 -15.141 -2.700 0.224 1.00 0.00 C ATOM 766 OG SER A 69 -15.283 -1.467 -0.465 1.00 0.00 O ATOM 0 H SER A 69 -12.376 -2.844 -0.143 1.00 0.00 H new ATOM 0 HA SER A 69 -14.209 -1.965 2.004 1.00 0.00 H new ATOM 0 HB2 SER A 69 -14.995 -3.508 -0.492 1.00 0.00 H new ATOM 0 HB3 SER A 69 -16.055 -2.923 0.774 1.00 0.00 H new ATOM 0 HG SER A 69 -16.044 -1.521 -1.079 1.00 0.00 H new ATOM 772 N ALA A 70 -14.357 -4.377 2.836 1.00 0.00 N ATOM 773 CA ALA A 70 -14.142 -5.660 3.512 1.00 0.00 C ATOM 774 C ALA A 70 -14.425 -6.856 2.598 1.00 0.00 C ATOM 775 O ALA A 70 -14.001 -7.973 2.879 1.00 0.00 O ATOM 776 CB ALA A 70 -14.997 -5.739 4.766 1.00 0.00 C ATOM 0 H ALA A 70 -15.076 -3.794 3.265 1.00 0.00 H new ATOM 0 HA ALA A 70 -13.088 -5.710 3.786 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -14.830 -6.696 5.261 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -14.726 -4.929 5.443 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -16.049 -5.649 4.495 1.00 0.00 H new ATOM 782 N LYS A 71 -15.132 -6.618 1.504 1.00 0.00 N ATOM 783 CA LYS A 71 -15.486 -7.687 0.584 1.00 0.00 C ATOM 784 C LYS A 71 -14.597 -7.676 -0.672 1.00 0.00 C ATOM 785 O LYS A 71 -14.568 -8.647 -1.430 1.00 0.00 O ATOM 786 CB LYS A 71 -16.969 -7.573 0.199 1.00 0.00 C ATOM 787 CG LYS A 71 -17.489 -8.733 -0.630 1.00 0.00 C ATOM 788 CD LYS A 71 -18.977 -8.604 -0.896 1.00 0.00 C ATOM 789 CE LYS A 71 -19.490 -9.779 -1.706 1.00 0.00 C ATOM 790 NZ LYS A 71 -20.955 -9.727 -1.895 1.00 0.00 N ATOM 0 H LYS A 71 -15.471 -5.695 1.232 1.00 0.00 H new ATOM 0 HA LYS A 71 -15.318 -8.638 1.090 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -17.564 -7.496 1.109 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -17.118 -6.648 -0.358 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -16.951 -8.774 -1.577 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -17.291 -9.670 -0.110 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -19.515 -8.548 0.050 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -19.175 -7.675 -1.431 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -19.000 -9.789 -2.679 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -19.222 -10.709 -1.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -21.262 -10.549 -2.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -21.425 -9.743 -0.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -21.209 -8.852 -2.397 1.00 0.00 H new ATOM 793 N GLY A 72 -13.854 -6.600 -0.870 1.00 0.00 N ATOM 794 CA GLY A 72 -13.018 -6.490 -2.056 1.00 0.00 C ATOM 795 C GLY A 72 -12.425 -5.111 -2.206 1.00 0.00 C ATOM 796 O GLY A 72 -12.878 -4.167 -1.560 1.00 0.00 O ATOM 0 H GLY A 72 -13.811 -5.801 -0.237 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -12.215 -7.226 -2.003 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -13.610 -6.728 -2.940 1.00 0.00 H new ATOM 800 N VAL A 73 -11.414 -4.986 -3.051 1.00 0.00 N ATOM 801 CA VAL A 73 -10.741 -3.712 -3.248 1.00 0.00 C ATOM 802 C VAL A 73 -10.692 -3.337 -4.726 1.00 0.00 C ATOM 803 O VAL A 73 -10.404 -4.179 -5.589 1.00 0.00 O ATOM 804 CB VAL A 73 -9.298 -3.736 -2.674 1.00 0.00 C ATOM 805 CG1 VAL A 73 -8.616 -2.387 -2.841 1.00 0.00 C ATOM 806 CG2 VAL A 73 -9.316 -4.133 -1.214 1.00 0.00 C ATOM 0 H VAL A 73 -11.041 -5.752 -3.612 1.00 0.00 H new ATOM 0 HA VAL A 73 -11.320 -2.962 -2.709 1.00 0.00 H new ATOM 0 HB VAL A 73 -8.728 -4.476 -3.236 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -7.608 -2.436 -2.430 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -8.564 -2.134 -3.900 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -9.187 -1.623 -2.313 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -8.297 -4.145 -0.828 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -9.910 -3.415 -0.649 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -9.754 -5.126 -1.112 1.00 0.00 H new ATOM 816 N LYS A 74 -10.987 -2.080 -5.007 1.00 0.00 N ATOM 817 CA LYS A 74 -10.951 -1.561 -6.365 1.00 0.00 C ATOM 818 C LYS A 74 -9.924 -0.443 -6.471 1.00 0.00 C ATOM 819 O LYS A 74 -9.847 0.427 -5.600 1.00 0.00 O ATOM 820 CB LYS A 74 -12.326 -1.036 -6.801 1.00 0.00 C ATOM 821 CG LYS A 74 -13.435 -2.075 -6.779 1.00 0.00 C ATOM 822 CD LYS A 74 -14.681 -1.575 -7.507 1.00 0.00 C ATOM 823 CE LYS A 74 -15.299 -0.359 -6.826 1.00 0.00 C ATOM 824 NZ LYS A 74 -15.851 -0.691 -5.490 1.00 0.00 N ATOM 0 H LYS A 74 -11.257 -1.392 -4.304 1.00 0.00 H new ATOM 0 HA LYS A 74 -10.671 -2.381 -7.026 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -12.608 -0.209 -6.150 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -12.243 -0.633 -7.810 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -13.083 -2.995 -7.246 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -13.688 -2.318 -5.747 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -14.421 -1.321 -8.535 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -15.418 -2.377 -7.554 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -14.545 0.421 -6.723 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -16.092 0.045 -7.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -16.365 0.131 -5.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -16.502 -1.498 -5.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -15.074 -0.939 -4.845 1.00 0.00 H new ATOM 827 N PHE A 75 -9.143 -0.470 -7.531 1.00 0.00 N ATOM 828 CA PHE A 75 -8.120 0.536 -7.750 1.00 0.00 C ATOM 829 C PHE A 75 -8.444 1.321 -9.024 1.00 0.00 C ATOM 830 O PHE A 75 -8.315 0.792 -10.139 1.00 0.00 O ATOM 831 CB PHE A 75 -6.732 -0.126 -7.881 1.00 0.00 C ATOM 832 CG PHE A 75 -6.488 -1.264 -6.915 1.00 0.00 C ATOM 833 CD1 PHE A 75 -6.832 -2.565 -7.252 1.00 0.00 C ATOM 834 CD2 PHE A 75 -5.911 -1.031 -5.681 1.00 0.00 C ATOM 835 CE1 PHE A 75 -6.607 -3.608 -6.377 1.00 0.00 C ATOM 836 CE2 PHE A 75 -5.683 -2.071 -4.798 1.00 0.00 C ATOM 837 CZ PHE A 75 -6.032 -3.362 -5.149 1.00 0.00 C ATOM 0 H PHE A 75 -9.197 -1.182 -8.260 1.00 0.00 H new ATOM 0 HA PHE A 75 -8.101 1.214 -6.897 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -6.615 -0.498 -8.899 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -5.965 0.634 -7.730 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -7.282 -2.764 -8.213 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -5.635 -0.025 -5.403 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -6.881 -4.615 -6.654 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -5.233 -1.875 -3.836 1.00 0.00 H new ATOM 0 HZ PHE A 75 -5.854 -4.176 -4.462 1.00 0.00 H new ATOM 843 N ILE A 76 -8.883 2.567 -8.862 1.00 0.00 N ATOM 844 CA ILE A 76 -9.253 3.406 -10.005 1.00 0.00 C ATOM 845 C ILE A 76 -8.344 4.632 -10.086 1.00 0.00 C ATOM 846 O ILE A 76 -7.974 5.197 -9.076 1.00 0.00 O ATOM 847 CB ILE A 76 -10.732 3.909 -9.922 1.00 0.00 C ATOM 848 CG1 ILE A 76 -11.717 2.761 -9.618 1.00 0.00 C ATOM 849 CG2 ILE A 76 -11.131 4.616 -11.218 1.00 0.00 C ATOM 850 CD1 ILE A 76 -11.847 2.424 -8.140 1.00 0.00 C ATOM 0 H ILE A 76 -8.992 3.019 -7.954 1.00 0.00 H new ATOM 0 HA ILE A 76 -9.142 2.780 -10.891 1.00 0.00 H new ATOM 0 HB ILE A 76 -10.786 4.618 -9.096 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -12.700 3.029 -10.006 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -11.395 1.869 -10.155 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -12.163 4.959 -11.142 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -10.475 5.471 -11.383 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -11.040 3.922 -12.054 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -12.558 1.607 -8.014 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.875 2.123 -7.749 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -12.201 3.300 -7.597 1.00 0.00 H new ATOM 861 N ASP A 77 -8.002 5.028 -11.290 1.00 0.00 N ATOM 862 CA ASP A 77 -7.158 6.203 -11.515 1.00 0.00 C ATOM 863 C ASP A 77 -7.983 7.489 -11.401 1.00 0.00 C ATOM 864 O ASP A 77 -9.156 7.510 -11.754 1.00 0.00 O ATOM 865 CB ASP A 77 -6.489 6.104 -12.893 1.00 0.00 C ATOM 866 CG ASP A 77 -5.994 7.429 -13.431 1.00 0.00 C ATOM 867 OD1 ASP A 77 -5.204 8.113 -12.751 1.00 0.00 O ATOM 868 OD2 ASP A 77 -6.388 7.785 -14.551 1.00 0.00 O ATOM 0 H ASP A 77 -8.294 4.554 -12.145 1.00 0.00 H new ATOM 0 HA ASP A 77 -6.382 6.235 -10.750 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -5.649 5.412 -12.829 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -7.200 5.678 -13.601 1.00 0.00 H new ATOM 871 N ALA A 78 -7.369 8.548 -10.897 1.00 0.00 N ATOM 872 CA ALA A 78 -8.059 9.823 -10.719 1.00 0.00 C ATOM 873 C ALA A 78 -7.845 10.746 -11.911 1.00 0.00 C ATOM 874 O ALA A 78 -8.596 11.710 -12.110 1.00 0.00 O ATOM 875 CB ALA A 78 -7.582 10.507 -9.445 1.00 0.00 C ATOM 0 H ALA A 78 -6.392 8.553 -10.602 1.00 0.00 H new ATOM 0 HA ALA A 78 -9.126 9.613 -10.641 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -8.104 11.456 -9.324 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -7.791 9.866 -8.588 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -6.509 10.689 -9.509 1.00 0.00 H new ATOM 881 N THR A 79 -6.836 10.446 -12.703 1.00 0.00 N ATOM 882 CA THR A 79 -6.477 11.276 -13.840 1.00 0.00 C ATOM 883 C THR A 79 -7.462 11.094 -15.002 1.00 0.00 C ATOM 884 O THR A 79 -8.093 12.052 -15.458 1.00 0.00 O ATOM 885 CB THR A 79 -5.056 10.932 -14.325 1.00 0.00 C ATOM 886 OG1 THR A 79 -4.214 10.662 -13.192 1.00 0.00 O ATOM 887 CG2 THR A 79 -4.469 12.086 -15.127 1.00 0.00 C ATOM 0 H THR A 79 -6.243 9.625 -12.580 1.00 0.00 H new ATOM 0 HA THR A 79 -6.515 12.314 -13.511 1.00 0.00 H new ATOM 0 HB THR A 79 -5.110 10.051 -14.965 1.00 0.00 H new ATOM 0 HG1 THR A 79 -4.322 9.727 -12.920 1.00 0.00 H new ATOM 0 HG21 THR A 79 -3.465 11.824 -15.461 1.00 0.00 H new ATOM 0 HG22 THR A 79 -5.099 12.284 -15.994 1.00 0.00 H new ATOM 0 HG23 THR A 79 -4.422 12.977 -14.501 1.00 0.00 H new ATOM 894 N ASN A 80 -7.594 9.867 -15.460 1.00 0.00 N ATOM 895 CA ASN A 80 -8.447 9.549 -16.595 1.00 0.00 C ATOM 896 C ASN A 80 -9.646 8.736 -16.127 1.00 0.00 C ATOM 897 O ASN A 80 -10.589 8.501 -16.885 1.00 0.00 O ATOM 898 CB ASN A 80 -7.638 8.746 -17.629 1.00 0.00 C ATOM 899 CG ASN A 80 -8.340 8.604 -18.967 1.00 0.00 C ATOM 900 OD1 ASN A 80 -9.112 7.670 -19.184 1.00 0.00 O ATOM 901 ND2 ASN A 80 -8.054 9.512 -19.875 1.00 0.00 N ATOM 0 H ASN A 80 -7.115 9.060 -15.059 1.00 0.00 H new ATOM 0 HA ASN A 80 -8.804 10.471 -17.053 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -6.675 9.233 -17.783 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -7.433 7.753 -17.228 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -8.478 9.458 -20.801 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -7.408 10.270 -19.653 1.00 0.00 H new ATOM 908 N LYS A 81 -9.601 8.337 -14.851 1.00 0.00 N ATOM 909 CA LYS A 81 -10.633 7.494 -14.231 1.00 0.00 C ATOM 910 C LYS A 81 -10.546 6.074 -14.766 1.00 0.00 C ATOM 911 O LYS A 81 -11.540 5.347 -14.819 1.00 0.00 O ATOM 912 CB LYS A 81 -12.052 8.072 -14.416 1.00 0.00 C ATOM 913 CG LYS A 81 -12.260 9.455 -13.795 1.00 0.00 C ATOM 914 CD LYS A 81 -11.824 9.508 -12.328 1.00 0.00 C ATOM 915 CE LYS A 81 -12.531 8.461 -11.471 1.00 0.00 C ATOM 916 NZ LYS A 81 -14.005 8.628 -11.469 1.00 0.00 N ATOM 0 H LYS A 81 -8.845 8.590 -14.215 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.441 7.477 -13.158 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.271 8.130 -15.482 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.772 7.380 -13.980 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -11.698 10.195 -14.365 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.313 9.729 -13.868 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -10.746 9.356 -12.267 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -12.029 10.500 -11.927 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -12.282 7.466 -11.840 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -12.160 8.523 -10.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -14.433 7.925 -10.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.246 9.585 -11.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -14.371 8.491 -12.433 1.00 0.00 H new ATOM 919 N ASN A 82 -9.337 5.686 -15.137 1.00 0.00 N ATOM 920 CA ASN A 82 -9.067 4.355 -15.659 1.00 0.00 C ATOM 921 C ASN A 82 -9.290 3.315 -14.574 1.00 0.00 C ATOM 922 O ASN A 82 -8.781 3.455 -13.458 1.00 0.00 O ATOM 923 CB ASN A 82 -7.607 4.275 -16.152 1.00 0.00 C ATOM 924 CG ASN A 82 -7.278 2.986 -16.913 1.00 0.00 C ATOM 925 OD1 ASN A 82 -7.852 1.930 -16.672 1.00 0.00 O ATOM 926 ND2 ASN A 82 -6.339 3.073 -17.835 1.00 0.00 N ATOM 0 H ASN A 82 -8.513 6.285 -15.085 1.00 0.00 H new ATOM 0 HA ASN A 82 -9.744 4.158 -16.490 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -7.405 5.129 -16.799 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.939 4.360 -15.295 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -6.072 2.247 -18.371 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -5.880 3.966 -18.012 1.00 0.00 H new ATOM 933 N ILE A 83 -10.065 2.291 -14.884 1.00 0.00 N ATOM 934 CA ILE A 83 -10.256 1.201 -13.959 1.00 0.00 C ATOM 935 C ILE A 83 -9.003 0.315 -13.977 1.00 0.00 C ATOM 936 O ILE A 83 -8.882 -0.628 -14.761 1.00 0.00 O ATOM 937 CB ILE A 83 -11.552 0.380 -14.267 1.00 0.00 C ATOM 938 CG1 ILE A 83 -11.689 -0.816 -13.313 1.00 0.00 C ATOM 939 CG2 ILE A 83 -11.609 -0.070 -15.727 1.00 0.00 C ATOM 940 CD1 ILE A 83 -11.844 -0.422 -11.859 1.00 0.00 C ATOM 0 H ILE A 83 -10.568 2.196 -15.766 1.00 0.00 H new ATOM 0 HA ILE A 83 -10.398 1.609 -12.958 1.00 0.00 H new ATOM 0 HB ILE A 83 -12.401 1.043 -14.101 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -12.552 -1.411 -13.613 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -10.811 -1.453 -13.416 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -12.524 -0.637 -15.898 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.597 0.804 -16.378 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -10.747 -0.699 -15.948 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -11.935 -1.319 -11.247 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -10.970 0.147 -11.541 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -12.738 0.190 -11.741 1.00 0.00 H new ATOM 951 N ILE A 84 -8.054 0.677 -13.133 1.00 0.00 N ATOM 952 CA ILE A 84 -6.764 0.022 -13.076 1.00 0.00 C ATOM 953 C ILE A 84 -6.888 -1.449 -12.725 1.00 0.00 C ATOM 954 O ILE A 84 -6.442 -2.305 -13.486 1.00 0.00 O ATOM 955 CB ILE A 84 -5.822 0.750 -12.088 1.00 0.00 C ATOM 956 CG1 ILE A 84 -5.641 2.195 -12.544 1.00 0.00 C ATOM 957 CG2 ILE A 84 -4.467 0.047 -11.986 1.00 0.00 C ATOM 958 CD1 ILE A 84 -4.810 3.028 -11.613 1.00 0.00 C ATOM 0 H ILE A 84 -8.160 1.440 -12.464 1.00 0.00 H new ATOM 0 HA ILE A 84 -6.327 0.078 -14.073 1.00 0.00 H new ATOM 0 HB ILE A 84 -6.273 0.731 -11.096 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.177 2.199 -13.531 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -6.622 2.657 -12.651 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -3.830 0.585 -11.284 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -4.613 -0.975 -11.635 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -3.992 0.029 -12.967 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -4.728 4.041 -12.006 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -5.282 3.057 -10.631 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -3.815 2.592 -11.524 1.00 0.00 H new ATOM 969 N ALA A 85 -7.498 -1.753 -11.596 1.00 0.00 N ATOM 970 CA ALA A 85 -7.647 -3.152 -11.208 1.00 0.00 C ATOM 971 C ALA A 85 -8.736 -3.358 -10.170 1.00 0.00 C ATOM 972 O ALA A 85 -9.157 -2.422 -9.490 1.00 0.00 O ATOM 973 CB ALA A 85 -6.321 -3.706 -10.695 1.00 0.00 C ATOM 0 H ALA A 85 -7.891 -1.075 -10.943 1.00 0.00 H new ATOM 0 HA ALA A 85 -7.948 -3.698 -12.102 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -6.449 -4.750 -10.410 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -5.568 -3.634 -11.480 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -5.997 -3.130 -9.828 1.00 0.00 H new ATOM 979 N GLU A 86 -9.188 -4.597 -10.074 1.00 0.00 N ATOM 980 CA GLU A 86 -10.166 -5.018 -9.087 1.00 0.00 C ATOM 981 C GLU A 86 -9.793 -6.394 -8.592 1.00 0.00 C ATOM 982 O GLU A 86 -9.452 -7.266 -9.390 1.00 0.00 O ATOM 983 CB GLU A 86 -11.577 -5.082 -9.674 1.00 0.00 C ATOM 984 CG GLU A 86 -12.222 -3.743 -9.944 1.00 0.00 C ATOM 985 CD GLU A 86 -13.681 -3.889 -10.301 1.00 0.00 C ATOM 986 OE1 GLU A 86 -14.485 -4.266 -9.415 1.00 0.00 O ATOM 987 OE2 GLU A 86 -14.037 -3.661 -11.474 1.00 0.00 O ATOM 0 H GLU A 86 -8.880 -5.350 -10.690 1.00 0.00 H new ATOM 0 HA GLU A 86 -10.164 -4.288 -8.278 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -11.540 -5.644 -10.607 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -12.213 -5.642 -8.989 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -12.124 -3.108 -9.064 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -11.696 -3.243 -10.758 1.00 0.00 H new ATOM 990 N HIS A 87 -9.835 -6.596 -7.296 1.00 0.00 N ATOM 991 CA HIS A 87 -9.517 -7.896 -6.743 1.00 0.00 C ATOM 992 C HIS A 87 -10.128 -8.075 -5.377 1.00 0.00 C ATOM 993 O HIS A 87 -10.411 -7.102 -4.675 1.00 0.00 O ATOM 994 CB HIS A 87 -8.002 -8.111 -6.661 1.00 0.00 C ATOM 995 CG HIS A 87 -7.540 -9.321 -7.406 1.00 0.00 C ATOM 996 ND1 HIS A 87 -7.541 -10.591 -6.861 1.00 0.00 N ATOM 997 CD2 HIS A 87 -7.067 -9.457 -8.665 1.00 0.00 C ATOM 998 CE1 HIS A 87 -7.093 -11.452 -7.750 1.00 0.00 C ATOM 999 NE2 HIS A 87 -6.797 -10.793 -8.854 1.00 0.00 N ATOM 0 H HIS A 87 -10.084 -5.885 -6.608 1.00 0.00 H new ATOM 0 HA HIS A 87 -9.941 -8.641 -7.417 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -7.494 -7.232 -7.058 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -7.710 -8.203 -5.615 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -6.927 -8.666 -9.387 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -6.986 -12.516 -7.601 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -6.428 -11.207 -9.710 1.00 0.00 H new ATOM 1004 N GLU A 88 -10.350 -9.322 -5.012 1.00 0.00 N ATOM 1005 CA GLU A 88 -10.847 -9.647 -3.699 1.00 0.00 C ATOM 1006 C GLU A 88 -9.790 -9.287 -2.670 1.00 0.00 C ATOM 1007 O GLU A 88 -8.602 -9.492 -2.907 1.00 0.00 O ATOM 1008 CB GLU A 88 -11.187 -11.131 -3.617 1.00 0.00 C ATOM 1009 CG GLU A 88 -12.238 -11.577 -4.619 1.00 0.00 C ATOM 1010 CD GLU A 88 -13.552 -10.855 -4.439 1.00 0.00 C ATOM 1011 OE1 GLU A 88 -14.371 -11.300 -3.606 1.00 0.00 O ATOM 1012 OE2 GLU A 88 -13.771 -9.834 -5.126 1.00 0.00 O ATOM 0 H GLU A 88 -10.191 -10.129 -5.615 1.00 0.00 H new ATOM 0 HA GLU A 88 -11.756 -9.079 -3.499 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -10.278 -11.711 -3.776 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -11.539 -11.358 -2.611 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -11.868 -11.405 -5.630 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -12.400 -12.650 -4.517 1.00 0.00 H new ATOM 1015 N ILE A 89 -10.221 -8.761 -1.541 1.00 0.00 N ATOM 1016 CA ILE A 89 -9.302 -8.294 -0.503 1.00 0.00 C ATOM 1017 C ILE A 89 -8.383 -9.437 -0.003 1.00 0.00 C ATOM 1018 O ILE A 89 -7.239 -9.204 0.379 1.00 0.00 O ATOM 1019 CB ILE A 89 -10.099 -7.626 0.678 1.00 0.00 C ATOM 1020 CG1 ILE A 89 -9.221 -6.643 1.498 1.00 0.00 C ATOM 1021 CG2 ILE A 89 -10.747 -8.670 1.582 1.00 0.00 C ATOM 1022 CD1 ILE A 89 -8.218 -7.291 2.429 1.00 0.00 C ATOM 0 H ILE A 89 -11.208 -8.643 -1.311 1.00 0.00 H new ATOM 0 HA ILE A 89 -8.652 -7.535 -0.939 1.00 0.00 H new ATOM 0 HB ILE A 89 -10.897 -7.040 0.222 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -8.683 -5.997 0.804 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -9.877 -6.002 2.087 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -11.288 -8.170 2.385 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -11.441 -9.276 0.999 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -9.976 -9.311 2.008 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -7.657 -6.518 2.954 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -8.743 -7.913 3.154 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -7.531 -7.909 1.851 1.00 0.00 H new ATOM 1033 N ARG A 90 -8.869 -10.679 -0.086 1.00 0.00 N ATOM 1034 CA ARG A 90 -8.099 -11.839 0.385 1.00 0.00 C ATOM 1035 C ARG A 90 -6.871 -12.111 -0.497 1.00 0.00 C ATOM 1036 O ARG A 90 -6.037 -12.960 -0.171 1.00 0.00 O ATOM 1037 CB ARG A 90 -8.973 -13.108 0.453 1.00 0.00 C ATOM 1038 CG ARG A 90 -10.081 -13.075 1.507 1.00 0.00 C ATOM 1039 CD ARG A 90 -11.343 -12.398 0.989 1.00 0.00 C ATOM 1040 NE ARG A 90 -11.911 -13.104 -0.165 1.00 0.00 N ATOM 1041 CZ ARG A 90 -12.910 -12.637 -0.922 1.00 0.00 C ATOM 1042 NH1 ARG A 90 -13.515 -11.495 -0.610 1.00 0.00 N ATOM 1043 NH2 ARG A 90 -13.326 -13.328 -1.976 1.00 0.00 N ATOM 0 H ARG A 90 -9.785 -10.908 -0.472 1.00 0.00 H new ATOM 0 HA ARG A 90 -7.755 -11.590 1.389 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.427 -13.271 -0.524 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.329 -13.964 0.652 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.317 -14.093 1.816 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -9.724 -12.548 2.392 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -12.084 -12.353 1.787 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -11.114 -11.370 0.708 1.00 0.00 H new ATOM 0 HE ARG A 90 -11.517 -14.013 -0.407 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -13.218 -10.968 0.212 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -14.276 -11.145 -1.192 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -12.884 -14.217 -2.210 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -14.088 -12.970 -2.552 1.00 0.00 H new ATOM 1046 N ASN A 91 -6.763 -11.394 -1.608 1.00 0.00 N ATOM 1047 CA ASN A 91 -5.637 -11.569 -2.515 1.00 0.00 C ATOM 1048 C ASN A 91 -4.444 -10.732 -2.053 1.00 0.00 C ATOM 1049 O ASN A 91 -3.315 -10.920 -2.522 1.00 0.00 O ATOM 1050 CB ASN A 91 -6.042 -11.222 -3.961 1.00 0.00 C ATOM 1051 CG ASN A 91 -5.496 -9.892 -4.459 1.00 0.00 C ATOM 1052 OD1 ASN A 91 -6.058 -8.837 -4.194 1.00 0.00 O ATOM 1053 ND2 ASN A 91 -4.427 -9.946 -5.231 1.00 0.00 N ATOM 0 H ASN A 91 -7.439 -10.689 -1.902 1.00 0.00 H new ATOM 0 HA ASN A 91 -5.337 -12.617 -2.499 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -5.696 -12.015 -4.624 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -7.130 -11.203 -4.027 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -4.042 -9.090 -5.629 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -3.986 -10.844 -5.429 1.00 0.00 H new ATOM 1060 N ILE A 92 -4.693 -9.812 -1.132 1.00 0.00 N ATOM 1061 CA ILE A 92 -3.630 -8.999 -0.582 1.00 0.00 C ATOM 1062 C ILE A 92 -2.932 -9.781 0.523 1.00 0.00 C ATOM 1063 O ILE A 92 -3.468 -9.951 1.613 1.00 0.00 O ATOM 1064 CB ILE A 92 -4.157 -7.647 -0.037 1.00 0.00 C ATOM 1065 CG1 ILE A 92 -4.903 -6.890 -1.149 1.00 0.00 C ATOM 1066 CG2 ILE A 92 -3.004 -6.805 0.509 1.00 0.00 C ATOM 1067 CD1 ILE A 92 -5.428 -5.531 -0.735 1.00 0.00 C ATOM 0 H ILE A 92 -5.620 -9.614 -0.754 1.00 0.00 H new ATOM 0 HA ILE A 92 -2.925 -8.767 -1.380 1.00 0.00 H new ATOM 0 HB ILE A 92 -4.851 -7.842 0.780 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -4.233 -6.764 -1.999 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -5.739 -7.501 -1.490 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.392 -5.859 0.888 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -2.510 -7.345 1.317 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -2.287 -6.610 -0.288 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -5.940 -5.067 -1.578 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -6.126 -5.648 0.094 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -4.596 -4.899 -0.423 1.00 0.00 H new ATOM 1078 N SER A 93 -1.747 -10.271 0.219 1.00 0.00 N ATOM 1079 CA SER A 93 -1.013 -11.122 1.132 1.00 0.00 C ATOM 1080 C SER A 93 -0.442 -10.340 2.312 1.00 0.00 C ATOM 1081 O SER A 93 -0.466 -10.820 3.447 1.00 0.00 O ATOM 1082 CB SER A 93 0.103 -11.865 0.386 1.00 0.00 C ATOM 1083 OG SER A 93 0.715 -12.849 1.210 1.00 0.00 O ATOM 0 H SER A 93 -1.268 -10.091 -0.664 1.00 0.00 H new ATOM 0 HA SER A 93 -1.716 -11.850 1.538 1.00 0.00 H new ATOM 0 HB2 SER A 93 -0.307 -12.339 -0.506 1.00 0.00 H new ATOM 0 HB3 SER A 93 0.855 -11.151 0.050 1.00 0.00 H new ATOM 0 HG SER A 93 1.420 -13.305 0.706 1.00 0.00 H new ATOM 1089 N CYS A 94 0.068 -9.143 2.059 1.00 0.00 N ATOM 1090 CA CYS A 94 0.667 -8.360 3.132 1.00 0.00 C ATOM 1091 C CYS A 94 0.552 -6.866 2.860 1.00 0.00 C ATOM 1092 O CYS A 94 0.494 -6.441 1.711 1.00 0.00 O ATOM 1093 CB CYS A 94 2.140 -8.756 3.312 1.00 0.00 C ATOM 1094 SG CYS A 94 2.943 -8.034 4.765 1.00 0.00 S ATOM 0 H CYS A 94 0.080 -8.699 1.141 1.00 0.00 H new ATOM 0 HA CYS A 94 0.122 -8.574 4.052 1.00 0.00 H new ATOM 0 HB2 CYS A 94 2.205 -9.842 3.380 1.00 0.00 H new ATOM 0 HB3 CYS A 94 2.694 -8.458 2.422 1.00 0.00 H new ATOM 0 HG CYS A 94 4.179 -8.434 4.822 1.00 0.00 H new ATOM 1100 N ALA A 95 0.514 -6.084 3.928 1.00 0.00 N ATOM 1101 CA ALA A 95 0.443 -4.638 3.836 1.00 0.00 C ATOM 1102 C ALA A 95 1.450 -4.016 4.794 1.00 0.00 C ATOM 1103 O ALA A 95 1.439 -4.308 5.997 1.00 0.00 O ATOM 1104 CB ALA A 95 -0.965 -4.151 4.152 1.00 0.00 C ATOM 0 H ALA A 95 0.532 -6.438 4.885 1.00 0.00 H new ATOM 0 HA ALA A 95 0.685 -4.334 2.818 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -0.999 -3.064 4.078 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.668 -4.585 3.441 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -1.237 -4.455 5.163 1.00 0.00 H new ATOM 1110 N ALA A 96 2.322 -3.177 4.271 1.00 0.00 N ATOM 1111 CA ALA A 96 3.352 -2.559 5.081 1.00 0.00 C ATOM 1112 C ALA A 96 3.587 -1.115 4.668 1.00 0.00 C ATOM 1113 O ALA A 96 3.033 -0.645 3.675 1.00 0.00 O ATOM 1114 CB ALA A 96 4.639 -3.358 4.971 1.00 0.00 C ATOM 0 H ALA A 96 2.338 -2.908 3.287 1.00 0.00 H new ATOM 0 HA ALA A 96 3.018 -2.556 6.118 1.00 0.00 H new ATOM 0 HB1 ALA A 96 5.411 -2.890 5.582 1.00 0.00 H new ATOM 0 HB2 ALA A 96 4.467 -4.376 5.321 1.00 0.00 H new ATOM 0 HB3 ALA A 96 4.964 -3.383 3.931 1.00 0.00 H new ATOM 1120 N GLN A 97 4.400 -0.414 5.432 1.00 0.00 N ATOM 1121 CA GLN A 97 4.732 0.967 5.134 1.00 0.00 C ATOM 1122 C GLN A 97 6.196 1.235 5.443 1.00 0.00 C ATOM 1123 O GLN A 97 6.865 0.400 6.064 1.00 0.00 O ATOM 1124 CB GLN A 97 3.817 1.933 5.902 1.00 0.00 C ATOM 1125 CG GLN A 97 3.874 1.786 7.412 1.00 0.00 C ATOM 1126 CD GLN A 97 3.003 2.799 8.129 1.00 0.00 C ATOM 1127 OE1 GLN A 97 3.568 3.954 8.420 1.00 0.00 O flip ATOM 1128 NE2 GLN A 97 1.830 2.545 8.413 1.00 0.00 N flip ATOM 0 H GLN A 97 4.847 -0.781 6.272 1.00 0.00 H new ATOM 0 HA GLN A 97 4.569 1.139 4.070 1.00 0.00 H new ATOM 0 HB2 GLN A 97 4.086 2.956 5.639 1.00 0.00 H new ATOM 0 HB3 GLN A 97 2.789 1.779 5.573 1.00 0.00 H new ATOM 0 HG2 GLN A 97 3.557 0.780 7.688 1.00 0.00 H new ATOM 0 HG3 GLN A 97 4.906 1.898 7.746 1.00 0.00 H new ATOM 0 HE21 GLN A 97 1.431 1.638 8.170 1.00 0.00 H new ATOM 0 HE22 GLN A 97 1.259 3.242 8.891 1.00 0.00 H new ATOM 1137 N ASP A 98 6.695 2.381 5.008 1.00 0.00 N ATOM 1138 CA ASP A 98 8.098 2.731 5.212 1.00 0.00 C ATOM 1139 C ASP A 98 8.375 3.027 6.692 1.00 0.00 C ATOM 1140 O ASP A 98 7.569 3.682 7.363 1.00 0.00 O ATOM 1141 CB ASP A 98 8.484 3.934 4.345 1.00 0.00 C ATOM 1142 CG ASP A 98 9.978 4.181 4.320 1.00 0.00 C ATOM 1143 OD1 ASP A 98 10.508 4.773 5.284 1.00 0.00 O ATOM 1144 OD2 ASP A 98 10.632 3.775 3.336 1.00 0.00 O ATOM 0 H ASP A 98 6.152 3.087 4.511 1.00 0.00 H new ATOM 0 HA ASP A 98 8.708 1.879 4.913 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.130 3.772 3.327 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.979 4.824 4.720 1.00 0.00 H new ATOM 1147 N PRO A 99 9.500 2.515 7.232 1.00 0.00 N ATOM 1148 CA PRO A 99 9.873 2.715 8.640 1.00 0.00 C ATOM 1149 C PRO A 99 10.125 4.183 9.008 1.00 0.00 C ATOM 1150 O PRO A 99 9.737 4.630 10.092 1.00 0.00 O ATOM 1151 CB PRO A 99 11.172 1.913 8.790 1.00 0.00 C ATOM 1152 CG PRO A 99 11.176 0.967 7.645 1.00 0.00 C ATOM 1153 CD PRO A 99 10.480 1.675 6.527 1.00 0.00 C ATOM 0 HA PRO A 99 9.066 2.398 9.301 1.00 0.00 H new ATOM 0 HB2 PRO A 99 12.044 2.566 8.765 1.00 0.00 H new ATOM 0 HB3 PRO A 99 11.200 1.381 9.741 1.00 0.00 H new ATOM 0 HG2 PRO A 99 12.194 0.698 7.364 1.00 0.00 H new ATOM 0 HG3 PRO A 99 10.661 0.041 7.901 1.00 0.00 H new ATOM 0 HD2 PRO A 99 11.172 2.273 5.934 1.00 0.00 H new ATOM 0 HD3 PRO A 99 9.997 0.976 5.845 1.00 0.00 H new ATOM 1161 N GLU A 100 10.762 4.929 8.117 1.00 0.00 N ATOM 1162 CA GLU A 100 11.107 6.315 8.414 1.00 0.00 C ATOM 1163 C GLU A 100 10.110 7.290 7.802 1.00 0.00 C ATOM 1164 O GLU A 100 9.834 8.353 8.372 1.00 0.00 O ATOM 1165 CB GLU A 100 12.540 6.637 7.970 1.00 0.00 C ATOM 1166 CG GLU A 100 12.823 6.323 6.517 1.00 0.00 C ATOM 1167 CD GLU A 100 14.229 6.672 6.106 1.00 0.00 C ATOM 1168 OE1 GLU A 100 14.457 7.825 5.677 1.00 0.00 O ATOM 1169 OE2 GLU A 100 15.110 5.797 6.183 1.00 0.00 O ATOM 0 H GLU A 100 11.048 4.605 7.193 1.00 0.00 H new ATOM 0 HA GLU A 100 11.055 6.436 9.496 1.00 0.00 H new ATOM 0 HB2 GLU A 100 12.734 7.695 8.146 1.00 0.00 H new ATOM 0 HB3 GLU A 100 13.237 6.077 8.594 1.00 0.00 H new ATOM 0 HG2 GLU A 100 12.651 5.261 6.340 1.00 0.00 H new ATOM 0 HG3 GLU A 100 12.120 6.869 5.889 1.00 0.00 H new ATOM 1172 N ASP A 101 9.578 6.942 6.654 1.00 0.00 N ATOM 1173 CA ASP A 101 8.583 7.780 6.011 1.00 0.00 C ATOM 1174 C ASP A 101 7.209 7.169 6.174 1.00 0.00 C ATOM 1175 O ASP A 101 6.867 6.192 5.523 1.00 0.00 O ATOM 1176 CB ASP A 101 8.893 7.993 4.533 1.00 0.00 C ATOM 1177 CG ASP A 101 7.957 9.005 3.909 1.00 0.00 C ATOM 1178 OD1 ASP A 101 8.189 10.216 4.082 1.00 0.00 O ATOM 1179 OD2 ASP A 101 6.974 8.599 3.267 1.00 0.00 O ATOM 0 H ASP A 101 9.813 6.090 6.145 1.00 0.00 H new ATOM 0 HA ASP A 101 8.606 8.756 6.496 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.923 8.332 4.422 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.810 7.044 4.003 1.00 0.00 H new ATOM 1182 N LEU A 102 6.416 7.760 7.033 1.00 0.00 N ATOM 1183 CA LEU A 102 5.101 7.224 7.342 1.00 0.00 C ATOM 1184 C LEU A 102 4.057 7.683 6.323 1.00 0.00 C ATOM 1185 O LEU A 102 2.860 7.537 6.547 1.00 0.00 O ATOM 1186 CB LEU A 102 4.665 7.625 8.767 1.00 0.00 C ATOM 1187 CG LEU A 102 5.577 7.184 9.936 1.00 0.00 C ATOM 1188 CD1 LEU A 102 5.983 5.727 9.804 1.00 0.00 C ATOM 1189 CD2 LEU A 102 6.800 8.081 10.056 1.00 0.00 C ATOM 0 H LEU A 102 6.653 8.615 7.535 1.00 0.00 H new ATOM 0 HA LEU A 102 5.172 6.138 7.290 1.00 0.00 H new ATOM 0 HB2 LEU A 102 4.575 8.711 8.800 1.00 0.00 H new ATOM 0 HB3 LEU A 102 3.670 7.217 8.943 1.00 0.00 H new ATOM 0 HG LEU A 102 4.998 7.286 10.854 1.00 0.00 H new ATOM 0 HD11 LEU A 102 6.623 5.450 10.642 1.00 0.00 H new ATOM 0 HD12 LEU A 102 5.092 5.099 9.806 1.00 0.00 H new ATOM 0 HD13 LEU A 102 6.526 5.584 8.870 1.00 0.00 H new ATOM 0 HD21 LEU A 102 7.419 7.743 10.887 1.00 0.00 H new ATOM 0 HD22 LEU A 102 7.377 8.036 9.132 1.00 0.00 H new ATOM 0 HD23 LEU A 102 6.482 9.108 10.235 1.00 0.00 H new ATOM 1201 N SER A 103 4.516 8.223 5.205 1.00 0.00 N ATOM 1202 CA SER A 103 3.621 8.700 4.173 1.00 0.00 C ATOM 1203 C SER A 103 3.691 7.787 2.947 1.00 0.00 C ATOM 1204 O SER A 103 2.989 7.998 1.964 1.00 0.00 O ATOM 1205 CB SER A 103 3.980 10.142 3.793 1.00 0.00 C ATOM 1206 OG SER A 103 2.925 10.782 3.084 1.00 0.00 O ATOM 0 H SER A 103 5.507 8.340 4.993 1.00 0.00 H new ATOM 0 HA SER A 103 2.600 8.684 4.555 1.00 0.00 H new ATOM 0 HB2 SER A 103 4.207 10.709 4.695 1.00 0.00 H new ATOM 0 HB3 SER A 103 4.882 10.142 3.181 1.00 0.00 H new ATOM 0 HG SER A 103 2.887 10.434 2.169 1.00 0.00 H new ATOM 1212 N THR A 104 4.538 6.777 3.013 1.00 0.00 N ATOM 1213 CA THR A 104 4.685 5.842 1.918 1.00 0.00 C ATOM 1214 C THR A 104 4.332 4.432 2.378 1.00 0.00 C ATOM 1215 O THR A 104 4.777 3.987 3.442 1.00 0.00 O ATOM 1216 CB THR A 104 6.122 5.859 1.356 1.00 0.00 C ATOM 1217 OG1 THR A 104 6.521 7.213 1.114 1.00 0.00 O ATOM 1218 CG2 THR A 104 6.198 5.074 0.055 1.00 0.00 C ATOM 0 H THR A 104 5.136 6.584 3.817 1.00 0.00 H new ATOM 0 HA THR A 104 4.002 6.148 1.125 1.00 0.00 H new ATOM 0 HB THR A 104 6.788 5.397 2.085 1.00 0.00 H new ATOM 0 HG1 THR A 104 6.671 7.668 1.969 1.00 0.00 H new ATOM 0 HG21 THR A 104 7.219 5.098 -0.325 1.00 0.00 H new ATOM 0 HG22 THR A 104 5.902 4.041 0.236 1.00 0.00 H new ATOM 0 HG23 THR A 104 5.527 5.520 -0.679 1.00 0.00 H new ATOM 1225 N PHE A 105 3.535 3.738 1.587 1.00 0.00 N ATOM 1226 CA PHE A 105 3.108 2.403 1.940 1.00 0.00 C ATOM 1227 C PHE A 105 3.222 1.468 0.751 1.00 0.00 C ATOM 1228 O PHE A 105 3.234 1.907 -0.398 1.00 0.00 O ATOM 1229 CB PHE A 105 1.670 2.418 2.469 1.00 0.00 C ATOM 1230 CG PHE A 105 0.650 2.846 1.454 1.00 0.00 C ATOM 1231 CD1 PHE A 105 0.433 4.187 1.190 1.00 0.00 C ATOM 1232 CD2 PHE A 105 -0.089 1.902 0.757 1.00 0.00 C ATOM 1233 CE1 PHE A 105 -0.496 4.579 0.253 1.00 0.00 C ATOM 1234 CE2 PHE A 105 -1.019 2.288 -0.181 1.00 0.00 C ATOM 1235 CZ PHE A 105 -1.223 3.627 -0.433 1.00 0.00 C ATOM 0 H PHE A 105 3.172 4.079 0.697 1.00 0.00 H new ATOM 0 HA PHE A 105 3.764 2.037 2.729 1.00 0.00 H new ATOM 0 HB2 PHE A 105 1.415 1.420 2.827 1.00 0.00 H new ATOM 0 HB3 PHE A 105 1.617 3.088 3.327 1.00 0.00 H new ATOM 0 HD1 PHE A 105 0.999 4.935 1.725 1.00 0.00 H new ATOM 0 HD2 PHE A 105 0.067 0.851 0.953 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -0.656 5.629 0.055 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -1.587 1.543 -0.718 1.00 0.00 H new ATOM 0 HZ PHE A 105 -1.953 3.932 -1.168 1.00 0.00 H new ATOM 1241 N ALA A 106 3.297 0.186 1.028 1.00 0.00 N ATOM 1242 CA ALA A 106 3.412 -0.811 -0.010 1.00 0.00 C ATOM 1243 C ALA A 106 2.739 -2.095 0.419 1.00 0.00 C ATOM 1244 O ALA A 106 2.888 -2.533 1.558 1.00 0.00 O ATOM 1245 CB ALA A 106 4.873 -1.067 -0.339 1.00 0.00 C ATOM 0 H ALA A 106 3.280 -0.193 1.975 1.00 0.00 H new ATOM 0 HA ALA A 106 2.914 -0.438 -0.905 1.00 0.00 H new ATOM 0 HB1 ALA A 106 4.943 -1.821 -1.123 1.00 0.00 H new ATOM 0 HB2 ALA A 106 5.336 -0.142 -0.683 1.00 0.00 H new ATOM 0 HB3 ALA A 106 5.390 -1.422 0.553 1.00 0.00 H new ATOM 1251 N TYR A 107 1.996 -2.691 -0.476 1.00 0.00 N ATOM 1252 CA TYR A 107 1.322 -3.925 -0.168 1.00 0.00 C ATOM 1253 C TYR A 107 1.705 -5.020 -1.147 1.00 0.00 C ATOM 1254 O TYR A 107 1.858 -4.780 -2.356 1.00 0.00 O ATOM 1255 CB TYR A 107 -0.209 -3.738 -0.113 1.00 0.00 C ATOM 1256 CG TYR A 107 -0.831 -3.229 -1.394 1.00 0.00 C ATOM 1257 CD1 TYR A 107 -0.973 -1.868 -1.627 1.00 0.00 C ATOM 1258 CD2 TYR A 107 -1.280 -4.112 -2.367 1.00 0.00 C ATOM 1259 CE1 TYR A 107 -1.542 -1.404 -2.793 1.00 0.00 C ATOM 1260 CE2 TYR A 107 -1.850 -3.653 -3.536 1.00 0.00 C ATOM 1261 CZ TYR A 107 -1.979 -2.300 -3.745 1.00 0.00 C ATOM 1262 OH TYR A 107 -2.543 -1.841 -4.909 1.00 0.00 O ATOM 0 H TYR A 107 1.842 -2.343 -1.422 1.00 0.00 H new ATOM 0 HA TYR A 107 1.649 -4.235 0.824 1.00 0.00 H new ATOM 0 HB2 TYR A 107 -0.669 -4.692 0.144 1.00 0.00 H new ATOM 0 HB3 TYR A 107 -0.448 -3.043 0.692 1.00 0.00 H new ATOM 0 HD1 TYR A 107 -0.633 -1.162 -0.884 1.00 0.00 H new ATOM 0 HD2 TYR A 107 -1.181 -5.175 -2.206 1.00 0.00 H new ATOM 0 HE1 TYR A 107 -1.645 -0.342 -2.960 1.00 0.00 H new ATOM 0 HE2 TYR A 107 -2.193 -4.353 -4.284 1.00 0.00 H new ATOM 0 HH TYR A 107 -3.518 -1.922 -4.854 1.00 0.00 H new ATOM 1268 N ILE A 108 1.876 -6.209 -0.621 1.00 0.00 N ATOM 1269 CA ILE A 108 2.228 -7.355 -1.416 1.00 0.00 C ATOM 1270 C ILE A 108 0.965 -8.078 -1.815 1.00 0.00 C ATOM 1271 O ILE A 108 0.203 -8.550 -0.957 1.00 0.00 O ATOM 1272 CB ILE A 108 3.158 -8.302 -0.642 1.00 0.00 C ATOM 1273 CG1 ILE A 108 4.374 -7.525 -0.136 1.00 0.00 C ATOM 1274 CG2 ILE A 108 3.593 -9.465 -1.531 1.00 0.00 C ATOM 1275 CD1 ILE A 108 5.294 -8.334 0.738 1.00 0.00 C ATOM 0 H ILE A 108 1.774 -6.407 0.374 1.00 0.00 H new ATOM 0 HA ILE A 108 2.763 -7.020 -2.305 1.00 0.00 H new ATOM 0 HB ILE A 108 2.621 -8.713 0.213 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.937 -7.152 -0.992 1.00 0.00 H new ATOM 0 HG13 ILE A 108 4.030 -6.655 0.423 1.00 0.00 H new ATOM 0 HG21 ILE A 108 4.251 -10.127 -0.968 1.00 0.00 H new ATOM 0 HG22 ILE A 108 2.714 -10.020 -1.859 1.00 0.00 H new ATOM 0 HG23 ILE A 108 4.124 -9.079 -2.401 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.132 -7.714 1.057 1.00 0.00 H new ATOM 0 HD12 ILE A 108 4.748 -8.685 1.614 1.00 0.00 H new ATOM 0 HD13 ILE A 108 5.669 -9.190 0.177 1.00 0.00 H new ATOM 1286 N THR A 109 0.747 -8.164 -3.103 1.00 0.00 N ATOM 1287 CA THR A 109 -0.483 -8.717 -3.637 1.00 0.00 C ATOM 1288 C THR A 109 -0.234 -10.028 -4.380 1.00 0.00 C ATOM 1289 O THR A 109 0.765 -10.178 -5.093 1.00 0.00 O ATOM 1290 CB THR A 109 -1.142 -7.705 -4.593 1.00 0.00 C ATOM 1291 OG1 THR A 109 -0.426 -6.462 -4.523 1.00 0.00 O ATOM 1292 CG2 THR A 109 -2.600 -7.460 -4.211 1.00 0.00 C ATOM 0 H THR A 109 1.411 -7.855 -3.813 1.00 0.00 H new ATOM 0 HA THR A 109 -1.146 -8.922 -2.797 1.00 0.00 H new ATOM 0 HB THR A 109 -1.111 -8.111 -5.604 1.00 0.00 H new ATOM 0 HG1 THR A 109 -0.906 -5.841 -3.936 1.00 0.00 H new ATOM 0 HG21 THR A 109 -3.041 -6.742 -4.902 1.00 0.00 H new ATOM 0 HG22 THR A 109 -3.152 -8.399 -4.262 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.649 -7.065 -3.196 1.00 0.00 H new ATOM 1299 N LYS A 110 -1.138 -10.975 -4.195 1.00 0.00 N ATOM 1300 CA LYS A 110 -1.060 -12.264 -4.857 1.00 0.00 C ATOM 1301 C LYS A 110 -1.794 -12.197 -6.193 1.00 0.00 C ATOM 1302 O LYS A 110 -3.030 -12.188 -6.229 1.00 0.00 O ATOM 1303 CB LYS A 110 -1.699 -13.345 -3.969 1.00 0.00 C ATOM 1304 CG LYS A 110 -1.698 -14.744 -4.582 1.00 0.00 C ATOM 1305 CD LYS A 110 -0.549 -15.600 -4.065 1.00 0.00 C ATOM 1306 CE LYS A 110 -0.723 -15.928 -2.586 1.00 0.00 C ATOM 1307 NZ LYS A 110 0.255 -16.942 -2.122 1.00 0.00 N ATOM 0 H LYS A 110 -1.946 -10.871 -3.582 1.00 0.00 H new ATOM 0 HA LYS A 110 -0.014 -12.516 -5.031 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -1.168 -13.378 -3.018 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -2.727 -13.058 -3.750 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -2.644 -15.237 -4.359 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -1.629 -14.663 -5.667 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -0.494 -16.524 -4.640 1.00 0.00 H new ATOM 0 HD3 LYS A 110 0.394 -15.075 -4.214 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -0.608 -15.018 -1.997 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -1.735 -16.295 -2.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 0.102 -17.136 -1.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 0.129 -17.820 -2.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 1.221 -16.583 -2.263 1.00 0.00 H new ATOM 1310 N ASP A 111 -1.046 -12.118 -7.278 1.00 0.00 N ATOM 1311 CA ASP A 111 -1.653 -12.065 -8.599 1.00 0.00 C ATOM 1312 C ASP A 111 -1.531 -13.403 -9.306 1.00 0.00 C ATOM 1313 O ASP A 111 -0.494 -13.722 -9.892 1.00 0.00 O ATOM 1314 CB ASP A 111 -1.045 -10.962 -9.456 1.00 0.00 C ATOM 1315 CG ASP A 111 -1.691 -10.892 -10.825 1.00 0.00 C ATOM 1316 OD1 ASP A 111 -2.825 -10.379 -10.926 1.00 0.00 O ATOM 1317 OD2 ASP A 111 -1.079 -11.358 -11.800 1.00 0.00 O ATOM 0 H ASP A 111 -0.026 -12.089 -7.274 1.00 0.00 H new ATOM 0 HA ASP A 111 -2.709 -11.837 -8.457 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -1.161 -10.003 -8.950 1.00 0.00 H new ATOM 0 HB3 ASP A 111 0.025 -11.137 -9.568 1.00 0.00 H new ATOM 1320 N LEU A 112 -2.601 -14.171 -9.263 1.00 0.00 N ATOM 1321 CA LEU A 112 -2.621 -15.513 -9.832 1.00 0.00 C ATOM 1322 C LEU A 112 -2.526 -15.485 -11.354 1.00 0.00 C ATOM 1323 O LEU A 112 -2.262 -16.506 -11.983 1.00 0.00 O ATOM 1324 CB LEU A 112 -3.877 -16.259 -9.387 1.00 0.00 C ATOM 1325 CG LEU A 112 -4.048 -16.410 -7.872 1.00 0.00 C ATOM 1326 CD1 LEU A 112 -5.331 -17.150 -7.551 1.00 0.00 C ATOM 1327 CD2 LEU A 112 -2.850 -17.129 -7.268 1.00 0.00 C ATOM 0 H LEU A 112 -3.482 -13.888 -8.834 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.744 -16.042 -9.460 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -4.748 -15.738 -9.784 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -3.867 -17.252 -9.836 1.00 0.00 H new ATOM 0 HG LEU A 112 -4.108 -15.414 -7.433 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -5.434 -17.247 -6.470 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -6.181 -16.595 -7.948 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -5.302 -18.141 -8.003 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -2.989 -17.227 -6.191 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -2.757 -18.119 -7.714 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -1.944 -16.556 -7.466 1.00 0.00 H new ATOM 1339 N LYS A 113 -2.738 -14.319 -11.941 1.00 0.00 N ATOM 1340 CA LYS A 113 -2.634 -14.176 -13.383 1.00 0.00 C ATOM 1341 C LYS A 113 -1.176 -14.195 -13.823 1.00 0.00 C ATOM 1342 O LYS A 113 -0.862 -14.601 -14.942 1.00 0.00 O ATOM 1343 CB LYS A 113 -3.316 -12.889 -13.877 1.00 0.00 C ATOM 1344 CG LYS A 113 -4.828 -12.996 -14.060 1.00 0.00 C ATOM 1345 CD LYS A 113 -5.556 -13.164 -12.738 1.00 0.00 C ATOM 1346 CE LYS A 113 -7.059 -13.257 -12.938 1.00 0.00 C ATOM 1347 NZ LYS A 113 -7.613 -12.026 -13.555 1.00 0.00 N ATOM 0 H LYS A 113 -2.982 -13.462 -11.444 1.00 0.00 H new ATOM 0 HA LYS A 113 -3.151 -15.025 -13.830 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -3.106 -12.088 -13.168 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -2.869 -12.599 -14.828 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -5.195 -12.102 -14.564 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -5.055 -13.843 -14.708 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -5.198 -14.063 -12.236 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -5.326 -12.322 -12.085 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -7.289 -14.115 -13.570 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -7.543 -13.431 -11.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -8.647 -12.017 -13.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -7.208 -11.190 -13.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -7.373 -12.006 -14.567 1.00 0.00 H new ATOM 1350 N SER A 114 -0.290 -13.767 -12.947 1.00 0.00 N ATOM 1351 CA SER A 114 1.121 -13.731 -13.271 1.00 0.00 C ATOM 1352 C SER A 114 1.883 -14.764 -12.450 1.00 0.00 C ATOM 1353 O SER A 114 2.971 -15.202 -12.841 1.00 0.00 O ATOM 1354 CB SER A 114 1.673 -12.329 -13.008 1.00 0.00 C ATOM 1355 OG SER A 114 2.973 -12.159 -13.552 1.00 0.00 O ATOM 0 H SER A 114 -0.521 -13.440 -12.009 1.00 0.00 H new ATOM 0 HA SER A 114 1.249 -13.972 -14.326 1.00 0.00 H new ATOM 0 HB2 SER A 114 1.000 -11.588 -13.439 1.00 0.00 H new ATOM 0 HB3 SER A 114 1.703 -12.147 -11.934 1.00 0.00 H new ATOM 0 HG SER A 114 3.390 -13.036 -13.684 1.00 0.00 H new ATOM 1361 N ASN A 115 1.299 -15.143 -11.305 1.00 0.00 N ATOM 1362 CA ASN A 115 1.882 -16.122 -10.368 1.00 0.00 C ATOM 1363 C ASN A 115 3.030 -15.500 -9.565 1.00 0.00 C ATOM 1364 O ASN A 115 3.180 -15.758 -8.370 1.00 0.00 O ATOM 1365 CB ASN A 115 2.345 -17.401 -11.090 1.00 0.00 C ATOM 1366 CG ASN A 115 2.882 -18.461 -10.142 1.00 0.00 C ATOM 1367 OD1 ASN A 115 2.459 -18.560 -8.989 1.00 0.00 O ATOM 1368 ND2 ASN A 115 3.808 -19.266 -10.625 1.00 0.00 N ATOM 0 H ASN A 115 0.398 -14.776 -10.997 1.00 0.00 H new ATOM 0 HA ASN A 115 1.095 -16.409 -9.670 1.00 0.00 H new ATOM 0 HB2 ASN A 115 1.509 -17.816 -11.653 1.00 0.00 H new ATOM 0 HB3 ASN A 115 3.119 -17.143 -11.813 1.00 0.00 H new ATOM 0 HD21 ASN A 115 4.200 -20.003 -10.038 1.00 0.00 H new ATOM 0 HD22 ASN A 115 4.132 -19.152 -11.585 1.00 0.00 H new ATOM 1375 N HIS A 116 3.823 -14.676 -10.223 1.00 0.00 N ATOM 1376 CA HIS A 116 4.929 -13.989 -9.579 1.00 0.00 C ATOM 1377 C HIS A 116 4.379 -12.864 -8.685 1.00 0.00 C ATOM 1378 O HIS A 116 3.580 -12.045 -9.136 1.00 0.00 O ATOM 1379 CB HIS A 116 5.881 -13.421 -10.647 1.00 0.00 C ATOM 1380 CG HIS A 116 7.257 -13.070 -10.148 1.00 0.00 C ATOM 1381 ND1 HIS A 116 8.388 -13.200 -10.925 1.00 0.00 N ATOM 1382 CD2 HIS A 116 7.680 -12.567 -8.962 1.00 0.00 C ATOM 1383 CE1 HIS A 116 9.440 -12.794 -10.249 1.00 0.00 C ATOM 1384 NE2 HIS A 116 9.040 -12.404 -9.055 1.00 0.00 N ATOM 0 H HIS A 116 3.720 -14.464 -11.215 1.00 0.00 H new ATOM 0 HA HIS A 116 5.488 -14.689 -8.958 1.00 0.00 H new ATOM 0 HB2 HIS A 116 5.977 -14.150 -11.452 1.00 0.00 H new ATOM 0 HB3 HIS A 116 5.428 -12.528 -11.078 1.00 0.00 H new ATOM 0 HD1 HIS A 116 8.406 -13.557 -11.880 1.00 0.00 H new ATOM 0 HD2 HIS A 116 7.063 -12.338 -8.106 1.00 0.00 H new ATOM 0 HE1 HIS A 116 10.458 -12.782 -10.610 1.00 0.00 H new ATOM 1389 N HIS A 117 4.807 -12.843 -7.429 1.00 0.00 N ATOM 1390 CA HIS A 117 4.322 -11.858 -6.452 1.00 0.00 C ATOM 1391 C HIS A 117 4.672 -10.416 -6.827 1.00 0.00 C ATOM 1392 O HIS A 117 5.827 -10.096 -7.125 1.00 0.00 O ATOM 1393 CB HIS A 117 4.867 -12.169 -5.056 1.00 0.00 C ATOM 1394 CG HIS A 117 3.852 -12.753 -4.126 1.00 0.00 C ATOM 1395 ND1 HIS A 117 2.659 -12.272 -3.708 1.00 0.00 N flip ATOM 1396 CD2 HIS A 117 4.022 -13.955 -3.481 1.00 0.00 C flip ATOM 1397 CE1 HIS A 117 2.138 -13.183 -2.825 1.00 0.00 C flip ATOM 1398 NE2 HIS A 117 2.986 -14.190 -2.706 1.00 0.00 N flip ATOM 0 H HIS A 117 5.493 -13.498 -7.055 1.00 0.00 H new ATOM 0 HA HIS A 117 3.235 -11.940 -6.455 1.00 0.00 H new ATOM 0 HB2 HIS A 117 5.702 -12.863 -5.149 1.00 0.00 H new ATOM 0 HB3 HIS A 117 5.262 -11.252 -4.618 1.00 0.00 H new ATOM 0 HD1 HIS A 117 2.227 -11.394 -3.996 1.00 0.00 H new ATOM 0 HD2 HIS A 117 4.876 -14.607 -3.594 1.00 0.00 H new ATOM 0 HE1 HIS A 117 1.192 -13.093 -2.312 1.00 0.00 H new ATOM 1403 N TYR A 118 3.660 -9.554 -6.796 1.00 0.00 N ATOM 1404 CA TYR A 118 3.838 -8.135 -7.076 1.00 0.00 C ATOM 1405 C TYR A 118 3.838 -7.334 -5.786 1.00 0.00 C ATOM 1406 O TYR A 118 3.125 -7.666 -4.831 1.00 0.00 O ATOM 1407 CB TYR A 118 2.719 -7.601 -7.978 1.00 0.00 C ATOM 1408 CG TYR A 118 2.804 -8.022 -9.422 1.00 0.00 C ATOM 1409 CD1 TYR A 118 3.647 -7.363 -10.310 1.00 0.00 C ATOM 1410 CD2 TYR A 118 2.031 -9.062 -9.906 1.00 0.00 C ATOM 1411 CE1 TYR A 118 3.716 -7.736 -11.638 1.00 0.00 C ATOM 1412 CE2 TYR A 118 2.091 -9.440 -11.230 1.00 0.00 C ATOM 1413 CZ TYR A 118 2.935 -8.777 -12.092 1.00 0.00 C ATOM 1414 OH TYR A 118 2.997 -9.153 -13.416 1.00 0.00 O ATOM 0 H TYR A 118 2.699 -9.818 -6.577 1.00 0.00 H new ATOM 0 HA TYR A 118 4.795 -8.025 -7.585 1.00 0.00 H new ATOM 0 HB2 TYR A 118 1.761 -7.931 -7.576 1.00 0.00 H new ATOM 0 HB3 TYR A 118 2.726 -6.512 -7.933 1.00 0.00 H new ATOM 0 HD1 TYR A 118 4.258 -6.546 -9.955 1.00 0.00 H new ATOM 0 HD2 TYR A 118 1.368 -9.587 -9.234 1.00 0.00 H new ATOM 0 HE1 TYR A 118 4.377 -7.216 -12.316 1.00 0.00 H new ATOM 0 HE2 TYR A 118 1.478 -10.253 -11.590 1.00 0.00 H new ATOM 0 HH TYR A 118 3.039 -10.130 -13.477 1.00 0.00 H new ATOM 1420 N CYS A 119 4.627 -6.287 -5.761 1.00 0.00 N ATOM 1421 CA CYS A 119 4.675 -5.393 -4.632 1.00 0.00 C ATOM 1422 C CYS A 119 4.296 -3.999 -5.102 1.00 0.00 C ATOM 1423 O CYS A 119 5.070 -3.329 -5.790 1.00 0.00 O ATOM 1424 CB CYS A 119 6.074 -5.393 -4.005 1.00 0.00 C ATOM 1425 SG CYS A 119 6.203 -4.463 -2.460 1.00 0.00 S ATOM 0 H CYS A 119 5.254 -6.032 -6.524 1.00 0.00 H new ATOM 0 HA CYS A 119 3.972 -5.725 -3.868 1.00 0.00 H new ATOM 0 HB2 CYS A 119 6.375 -6.424 -3.820 1.00 0.00 H new ATOM 0 HB3 CYS A 119 6.781 -4.978 -4.724 1.00 0.00 H new ATOM 0 HG CYS A 119 7.355 -4.700 -1.906 1.00 0.00 H new ATOM 1431 N HIS A 120 3.093 -3.573 -4.764 1.00 0.00 N ATOM 1432 CA HIS A 120 2.609 -2.274 -5.196 1.00 0.00 C ATOM 1433 C HIS A 120 2.837 -1.241 -4.116 1.00 0.00 C ATOM 1434 O HIS A 120 2.195 -1.275 -3.062 1.00 0.00 O ATOM 1435 CB HIS A 120 1.119 -2.331 -5.582 1.00 0.00 C ATOM 1436 CG HIS A 120 0.810 -3.259 -6.729 1.00 0.00 C ATOM 1437 ND1 HIS A 120 0.573 -2.825 -8.024 1.00 0.00 N ATOM 1438 CD2 HIS A 120 0.693 -4.607 -6.766 1.00 0.00 C ATOM 1439 CE1 HIS A 120 0.324 -3.865 -8.796 1.00 0.00 C ATOM 1440 NE2 HIS A 120 0.393 -4.956 -8.058 1.00 0.00 N ATOM 0 H HIS A 120 2.435 -4.105 -4.194 1.00 0.00 H new ATOM 0 HA HIS A 120 3.172 -1.985 -6.083 1.00 0.00 H new ATOM 0 HB2 HIS A 120 0.542 -2.644 -4.712 1.00 0.00 H new ATOM 0 HB3 HIS A 120 0.785 -1.327 -5.842 1.00 0.00 H new ATOM 0 HD2 HIS A 120 0.814 -5.283 -5.932 1.00 0.00 H new ATOM 0 HE1 HIS A 120 0.102 -3.829 -9.852 1.00 0.00 H new ATOM 0 HE2 HIS A 120 0.247 -5.908 -8.395 1.00 0.00 H new ATOM 1445 N VAL A 121 3.762 -0.339 -4.370 1.00 0.00 N ATOM 1446 CA VAL A 121 4.093 0.710 -3.429 1.00 0.00 C ATOM 1447 C VAL A 121 3.558 2.052 -3.913 1.00 0.00 C ATOM 1448 O VAL A 121 3.800 2.467 -5.062 1.00 0.00 O ATOM 1449 CB VAL A 121 5.625 0.785 -3.170 1.00 0.00 C ATOM 1450 CG1 VAL A 121 6.398 0.817 -4.470 1.00 0.00 C ATOM 1451 CG2 VAL A 121 5.980 1.990 -2.303 1.00 0.00 C ATOM 0 H VAL A 121 4.305 -0.312 -5.233 1.00 0.00 H new ATOM 0 HA VAL A 121 3.613 0.468 -2.481 1.00 0.00 H new ATOM 0 HB VAL A 121 5.910 -0.117 -2.628 1.00 0.00 H new ATOM 0 HG11 VAL A 121 7.466 0.869 -4.257 1.00 0.00 H new ATOM 0 HG12 VAL A 121 6.186 -0.086 -5.042 1.00 0.00 H new ATOM 0 HG13 VAL A 121 6.100 1.691 -5.049 1.00 0.00 H new ATOM 0 HG21 VAL A 121 7.057 2.016 -2.139 1.00 0.00 H new ATOM 0 HG22 VAL A 121 5.668 2.905 -2.806 1.00 0.00 H new ATOM 0 HG23 VAL A 121 5.469 1.911 -1.343 1.00 0.00 H new ATOM 1461 N PHE A 122 2.811 2.715 -3.045 1.00 0.00 N ATOM 1462 CA PHE A 122 2.205 3.990 -3.364 1.00 0.00 C ATOM 1463 C PHE A 122 2.614 5.034 -2.341 1.00 0.00 C ATOM 1464 O PHE A 122 2.839 4.721 -1.167 1.00 0.00 O ATOM 1465 CB PHE A 122 0.670 3.887 -3.381 1.00 0.00 C ATOM 1466 CG PHE A 122 0.100 2.856 -4.323 1.00 0.00 C ATOM 1467 CD1 PHE A 122 0.738 2.535 -5.507 1.00 0.00 C ATOM 1468 CD2 PHE A 122 -1.085 2.210 -4.015 1.00 0.00 C ATOM 1469 CE1 PHE A 122 0.208 1.591 -6.361 1.00 0.00 C ATOM 1470 CE2 PHE A 122 -1.619 1.269 -4.868 1.00 0.00 C ATOM 1471 CZ PHE A 122 -0.971 0.959 -6.044 1.00 0.00 C ATOM 0 H PHE A 122 2.610 2.382 -2.102 1.00 0.00 H new ATOM 0 HA PHE A 122 2.552 4.282 -4.355 1.00 0.00 H new ATOM 0 HB2 PHE A 122 0.327 3.661 -2.371 1.00 0.00 H new ATOM 0 HB3 PHE A 122 0.260 4.862 -3.646 1.00 0.00 H new ATOM 0 HD1 PHE A 122 1.663 3.030 -5.766 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -1.597 2.447 -3.094 1.00 0.00 H new ATOM 0 HE1 PHE A 122 0.720 1.348 -7.280 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -2.545 0.774 -4.615 1.00 0.00 H new ATOM 0 HZ PHE A 122 -1.388 0.222 -6.714 1.00 0.00 H new ATOM 1477 N THR A 123 2.705 6.264 -2.777 1.00 0.00 N ATOM 1478 CA THR A 123 3.041 7.348 -1.896 1.00 0.00 C ATOM 1479 C THR A 123 1.792 8.132 -1.544 1.00 0.00 C ATOM 1480 O THR A 123 1.107 8.656 -2.425 1.00 0.00 O ATOM 1481 CB THR A 123 4.081 8.288 -2.535 1.00 0.00 C ATOM 1482 OG1 THR A 123 3.638 8.688 -3.835 1.00 0.00 O ATOM 1483 CG2 THR A 123 5.423 7.598 -2.655 1.00 0.00 C ATOM 0 H THR A 123 2.549 6.539 -3.747 1.00 0.00 H new ATOM 0 HA THR A 123 3.476 6.924 -0.991 1.00 0.00 H new ATOM 0 HB THR A 123 4.190 9.164 -1.896 1.00 0.00 H new ATOM 0 HG1 THR A 123 4.302 9.287 -4.237 1.00 0.00 H new ATOM 0 HG21 THR A 123 6.143 8.279 -3.109 1.00 0.00 H new ATOM 0 HG22 THR A 123 5.773 7.307 -1.664 1.00 0.00 H new ATOM 0 HG23 THR A 123 5.321 6.710 -3.279 1.00 0.00 H new ATOM 1490 N ALA A 124 1.477 8.194 -0.274 1.00 0.00 N ATOM 1491 CA ALA A 124 0.322 8.925 0.169 1.00 0.00 C ATOM 1492 C ALA A 124 0.672 10.388 0.278 1.00 0.00 C ATOM 1493 O ALA A 124 1.822 10.737 0.531 1.00 0.00 O ATOM 1494 CB ALA A 124 -0.168 8.393 1.503 1.00 0.00 C ATOM 0 H ALA A 124 2.008 7.744 0.472 1.00 0.00 H new ATOM 0 HA ALA A 124 -0.482 8.800 -0.556 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -1.043 8.960 1.821 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -0.435 7.341 1.399 1.00 0.00 H new ATOM 0 HB3 ALA A 124 0.621 8.496 2.248 1.00 0.00 H new ATOM 1500 N PHE A 125 -0.307 11.242 0.088 1.00 0.00 N ATOM 1501 CA PHE A 125 -0.075 12.675 0.146 1.00 0.00 C ATOM 1502 C PHE A 125 -0.157 13.170 1.589 1.00 0.00 C ATOM 1503 O PHE A 125 -0.141 14.380 1.844 1.00 0.00 O ATOM 1504 CB PHE A 125 -1.102 13.415 -0.714 1.00 0.00 C ATOM 1505 CG PHE A 125 -1.284 12.837 -2.092 1.00 0.00 C ATOM 1506 CD1 PHE A 125 -0.272 12.911 -3.039 1.00 0.00 C ATOM 1507 CD2 PHE A 125 -2.476 12.226 -2.441 1.00 0.00 C ATOM 1508 CE1 PHE A 125 -0.450 12.386 -4.303 1.00 0.00 C ATOM 1509 CE2 PHE A 125 -2.658 11.700 -3.702 1.00 0.00 C ATOM 1510 CZ PHE A 125 -1.645 11.780 -4.635 1.00 0.00 C ATOM 0 H PHE A 125 -1.272 10.975 -0.108 1.00 0.00 H new ATOM 0 HA PHE A 125 0.924 12.877 -0.241 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -2.063 13.408 -0.199 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -0.798 14.458 -0.807 1.00 0.00 H new ATOM 0 HD1 PHE A 125 0.665 13.384 -2.784 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -3.274 12.161 -1.716 1.00 0.00 H new ATOM 0 HE1 PHE A 125 0.345 12.449 -5.032 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -3.593 11.225 -3.960 1.00 0.00 H new ATOM 0 HZ PHE A 125 -1.787 11.369 -5.624 1.00 0.00 H new ATOM 1516 N ASP A 126 -0.232 12.230 2.526 1.00 0.00 N ATOM 1517 CA ASP A 126 -0.357 12.553 3.940 1.00 0.00 C ATOM 1518 C ASP A 126 -0.096 11.313 4.806 1.00 0.00 C ATOM 1519 O ASP A 126 -0.483 10.197 4.441 1.00 0.00 O ATOM 1520 CB ASP A 126 -1.752 13.119 4.220 1.00 0.00 C ATOM 1521 CG ASP A 126 -2.018 13.332 5.687 1.00 0.00 C ATOM 1522 OD1 ASP A 126 -1.535 14.336 6.246 1.00 0.00 O ATOM 1523 OD2 ASP A 126 -2.710 12.499 6.285 1.00 0.00 O ATOM 0 H ASP A 126 -0.208 11.230 2.327 1.00 0.00 H new ATOM 0 HA ASP A 126 0.389 13.305 4.195 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -1.865 14.067 3.695 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -2.502 12.439 3.816 1.00 0.00 H new ATOM 1526 N VAL A 127 0.563 11.523 5.945 1.00 0.00 N ATOM 1527 CA VAL A 127 0.899 10.440 6.876 1.00 0.00 C ATOM 1528 C VAL A 127 -0.357 9.774 7.439 1.00 0.00 C ATOM 1529 O VAL A 127 -0.476 8.545 7.439 1.00 0.00 O ATOM 1530 CB VAL A 127 1.771 10.961 8.046 1.00 0.00 C ATOM 1531 CG1 VAL A 127 2.023 9.865 9.072 1.00 0.00 C ATOM 1532 CG2 VAL A 127 3.089 11.516 7.526 1.00 0.00 C ATOM 0 H VAL A 127 0.879 12.444 6.250 1.00 0.00 H new ATOM 0 HA VAL A 127 1.464 9.700 6.310 1.00 0.00 H new ATOM 0 HB VAL A 127 1.225 11.766 8.538 1.00 0.00 H new ATOM 0 HG11 VAL A 127 2.637 10.259 9.882 1.00 0.00 H new ATOM 0 HG12 VAL A 127 1.071 9.518 9.475 1.00 0.00 H new ATOM 0 HG13 VAL A 127 2.541 9.033 8.595 1.00 0.00 H new ATOM 0 HG21 VAL A 127 3.687 11.877 8.363 1.00 0.00 H new ATOM 0 HG22 VAL A 127 3.634 10.730 7.003 1.00 0.00 H new ATOM 0 HG23 VAL A 127 2.892 12.339 6.839 1.00 0.00 H new ATOM 1542 N ASN A 128 -1.294 10.588 7.906 1.00 0.00 N ATOM 1543 CA ASN A 128 -2.545 10.077 8.459 1.00 0.00 C ATOM 1544 C ASN A 128 -3.303 9.294 7.400 1.00 0.00 C ATOM 1545 O ASN A 128 -3.841 8.228 7.671 1.00 0.00 O ATOM 1546 CB ASN A 128 -3.408 11.229 8.995 1.00 0.00 C ATOM 1547 CG ASN A 128 -4.771 10.771 9.490 1.00 0.00 C ATOM 1548 OD1 ASN A 128 -4.922 10.382 10.648 1.00 0.00 O ATOM 1549 ND2 ASN A 128 -5.775 10.834 8.630 1.00 0.00 N ATOM 0 H ASN A 128 -1.213 11.605 7.914 1.00 0.00 H new ATOM 0 HA ASN A 128 -2.312 9.409 9.289 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -2.879 11.723 9.810 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -3.544 11.970 8.208 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -6.712 10.555 8.919 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -5.611 11.162 7.678 1.00 0.00 H new ATOM 1556 N LEU A 129 -3.321 9.835 6.188 1.00 0.00 N ATOM 1557 CA LEU A 129 -3.972 9.194 5.050 1.00 0.00 C ATOM 1558 C LEU A 129 -3.389 7.787 4.840 1.00 0.00 C ATOM 1559 O LEU A 129 -4.132 6.808 4.689 1.00 0.00 O ATOM 1560 CB LEU A 129 -3.779 10.077 3.790 1.00 0.00 C ATOM 1561 CG LEU A 129 -4.656 9.777 2.552 1.00 0.00 C ATOM 1562 CD1 LEU A 129 -4.218 8.506 1.845 1.00 0.00 C ATOM 1563 CD2 LEU A 129 -6.125 9.695 2.940 1.00 0.00 C ATOM 0 H LEU A 129 -2.885 10.730 5.965 1.00 0.00 H new ATOM 0 HA LEU A 129 -5.040 9.089 5.240 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -3.953 11.114 4.079 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -2.735 10.001 3.486 1.00 0.00 H new ATOM 0 HG LEU A 129 -4.526 10.603 1.853 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -4.859 8.331 0.981 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -3.185 8.611 1.515 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -4.295 7.663 2.531 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -6.724 9.483 2.054 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.264 8.899 3.671 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -6.441 10.644 3.373 1.00 0.00 H new ATOM 1575 N ALA A 130 -2.059 7.694 4.860 1.00 0.00 N ATOM 1576 CA ALA A 130 -1.372 6.415 4.699 1.00 0.00 C ATOM 1577 C ALA A 130 -1.763 5.447 5.814 1.00 0.00 C ATOM 1578 O ALA A 130 -2.042 4.268 5.561 1.00 0.00 O ATOM 1579 CB ALA A 130 0.138 6.621 4.685 1.00 0.00 C ATOM 0 H ALA A 130 -1.436 8.492 4.986 1.00 0.00 H new ATOM 0 HA ALA A 130 -1.675 5.982 3.746 1.00 0.00 H new ATOM 0 HB1 ALA A 130 0.635 5.659 4.564 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.408 7.276 3.856 1.00 0.00 H new ATOM 0 HB3 ALA A 130 0.452 7.076 5.624 1.00 0.00 H new ATOM 1585 N ALA A 131 -1.793 5.957 7.042 1.00 0.00 N ATOM 1586 CA ALA A 131 -2.162 5.159 8.203 1.00 0.00 C ATOM 1587 C ALA A 131 -3.592 4.648 8.076 1.00 0.00 C ATOM 1588 O ALA A 131 -3.878 3.498 8.412 1.00 0.00 O ATOM 1589 CB ALA A 131 -1.993 5.969 9.480 1.00 0.00 C ATOM 0 H ALA A 131 -1.564 6.927 7.258 1.00 0.00 H new ATOM 0 HA ALA A 131 -1.497 4.296 8.251 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -2.273 5.358 10.338 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -0.953 6.279 9.579 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.632 6.851 9.439 1.00 0.00 H new ATOM 1595 N GLU A 132 -4.484 5.509 7.585 1.00 0.00 N ATOM 1596 CA GLU A 132 -5.881 5.143 7.361 1.00 0.00 C ATOM 1597 C GLU A 132 -5.972 3.969 6.395 1.00 0.00 C ATOM 1598 O GLU A 132 -6.702 3.004 6.637 1.00 0.00 O ATOM 1599 CB GLU A 132 -6.659 6.329 6.791 1.00 0.00 C ATOM 1600 CG GLU A 132 -6.825 7.499 7.745 1.00 0.00 C ATOM 1601 CD GLU A 132 -7.613 7.144 8.986 1.00 0.00 C ATOM 1602 OE1 GLU A 132 -8.860 7.101 8.913 1.00 0.00 O ATOM 1603 OE2 GLU A 132 -6.995 6.929 10.045 1.00 0.00 O ATOM 0 H GLU A 132 -4.260 6.472 7.333 1.00 0.00 H new ATOM 0 HA GLU A 132 -6.315 4.856 8.319 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -6.152 6.680 5.892 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -7.647 5.984 6.485 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -5.841 7.863 8.039 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -7.325 8.316 7.225 1.00 0.00 H new ATOM 1606 N ILE A 133 -5.227 4.062 5.299 1.00 0.00 N ATOM 1607 CA ILE A 133 -5.195 2.999 4.297 1.00 0.00 C ATOM 1608 C ILE A 133 -4.747 1.677 4.914 1.00 0.00 C ATOM 1609 O ILE A 133 -5.443 0.667 4.797 1.00 0.00 O ATOM 1610 CB ILE A 133 -4.261 3.349 3.112 1.00 0.00 C ATOM 1611 CG1 ILE A 133 -4.723 4.636 2.435 1.00 0.00 C ATOM 1612 CG2 ILE A 133 -4.221 2.202 2.105 1.00 0.00 C ATOM 1613 CD1 ILE A 133 -3.890 5.033 1.237 1.00 0.00 C ATOM 0 H ILE A 133 -4.636 4.864 5.080 1.00 0.00 H new ATOM 0 HA ILE A 133 -6.212 2.898 3.919 1.00 0.00 H new ATOM 0 HB ILE A 133 -3.254 3.502 3.499 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -5.760 4.517 2.121 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -4.702 5.446 3.164 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -3.560 2.466 1.279 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -3.850 1.301 2.594 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -5.225 2.019 1.722 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -4.282 5.957 0.812 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -2.856 5.186 1.547 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -3.931 4.243 0.487 1.00 0.00 H new ATOM 1624 N ILE A 134 -3.596 1.695 5.584 1.00 0.00 N ATOM 1625 CA ILE A 134 -3.056 0.494 6.221 1.00 0.00 C ATOM 1626 C ILE A 134 -4.048 -0.081 7.229 1.00 0.00 C ATOM 1627 O ILE A 134 -4.290 -1.290 7.258 1.00 0.00 O ATOM 1628 CB ILE A 134 -1.704 0.782 6.930 1.00 0.00 C ATOM 1629 CG1 ILE A 134 -0.644 1.227 5.913 1.00 0.00 C ATOM 1630 CG2 ILE A 134 -1.222 -0.443 7.704 1.00 0.00 C ATOM 1631 CD1 ILE A 134 -0.339 0.187 4.849 1.00 0.00 C ATOM 0 H ILE A 134 -3.019 2.528 5.700 1.00 0.00 H new ATOM 0 HA ILE A 134 -2.884 -0.237 5.431 1.00 0.00 H new ATOM 0 HB ILE A 134 -1.862 1.593 7.641 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -0.982 2.142 5.427 1.00 0.00 H new ATOM 0 HG13 ILE A 134 0.276 1.470 6.444 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -0.274 -0.216 8.191 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -1.962 -0.712 8.458 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -1.086 -1.277 7.016 1.00 0.00 H new ATOM 0 HD11 ILE A 134 0.419 0.575 4.168 1.00 0.00 H new ATOM 0 HD12 ILE A 134 0.031 -0.722 5.324 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -1.247 -0.039 4.290 1.00 0.00 H new ATOM 1642 N LEU A 135 -4.632 0.795 8.033 1.00 0.00 N ATOM 1643 CA LEU A 135 -5.605 0.396 9.036 1.00 0.00 C ATOM 1644 C LEU A 135 -6.798 -0.299 8.384 1.00 0.00 C ATOM 1645 O LEU A 135 -7.200 -1.385 8.803 1.00 0.00 O ATOM 1646 CB LEU A 135 -6.053 1.636 9.853 1.00 0.00 C ATOM 1647 CG LEU A 135 -7.088 1.418 10.982 1.00 0.00 C ATOM 1648 CD1 LEU A 135 -8.509 1.408 10.437 1.00 0.00 C ATOM 1649 CD2 LEU A 135 -6.798 0.131 11.748 1.00 0.00 C ATOM 0 H LEU A 135 -4.445 1.797 8.008 1.00 0.00 H new ATOM 0 HA LEU A 135 -5.143 -0.318 9.717 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -5.164 2.085 10.295 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -6.466 2.366 9.156 1.00 0.00 H new ATOM 0 HG LEU A 135 -7.000 2.256 11.674 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -9.212 1.253 11.256 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -8.720 2.362 9.954 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -8.614 0.602 9.711 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -7.540 0.001 12.536 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -6.843 -0.717 11.065 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.804 0.188 12.192 1.00 0.00 H new ATOM 1661 N THR A 136 -7.342 0.316 7.351 1.00 0.00 N ATOM 1662 CA THR A 136 -8.493 -0.233 6.668 1.00 0.00 C ATOM 1663 C THR A 136 -8.148 -1.559 5.973 1.00 0.00 C ATOM 1664 O THR A 136 -8.905 -2.523 6.064 1.00 0.00 O ATOM 1665 CB THR A 136 -9.070 0.774 5.657 1.00 0.00 C ATOM 1666 OG1 THR A 136 -9.264 2.038 6.311 1.00 0.00 O ATOM 1667 CG2 THR A 136 -10.405 0.286 5.118 1.00 0.00 C ATOM 0 H THR A 136 -7.003 1.198 6.967 1.00 0.00 H new ATOM 0 HA THR A 136 -9.255 -0.435 7.421 1.00 0.00 H new ATOM 0 HB THR A 136 -8.371 0.878 4.827 1.00 0.00 H new ATOM 0 HG1 THR A 136 -8.398 2.482 6.428 1.00 0.00 H new ATOM 0 HG21 THR A 136 -10.797 1.011 4.405 1.00 0.00 H new ATOM 0 HG22 THR A 136 -10.267 -0.674 4.620 1.00 0.00 H new ATOM 0 HG23 THR A 136 -11.109 0.170 5.942 1.00 0.00 H new ATOM 1674 N LEU A 137 -6.995 -1.605 5.301 1.00 0.00 N ATOM 1675 CA LEU A 137 -6.538 -2.834 4.644 1.00 0.00 C ATOM 1676 C LEU A 137 -6.367 -3.953 5.664 1.00 0.00 C ATOM 1677 O LEU A 137 -6.849 -5.067 5.465 1.00 0.00 O ATOM 1678 CB LEU A 137 -5.212 -2.604 3.907 1.00 0.00 C ATOM 1679 CG LEU A 137 -5.262 -1.689 2.679 1.00 0.00 C ATOM 1680 CD1 LEU A 137 -3.862 -1.471 2.129 1.00 0.00 C ATOM 1681 CD2 LEU A 137 -6.164 -2.282 1.607 1.00 0.00 C ATOM 0 H LEU A 137 -6.363 -0.811 5.197 1.00 0.00 H new ATOM 0 HA LEU A 137 -7.297 -3.123 3.917 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -4.496 -2.186 4.615 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -4.823 -3.573 3.595 1.00 0.00 H new ATOM 0 HG LEU A 137 -5.674 -0.726 2.982 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -3.911 -0.819 1.257 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -3.239 -1.007 2.894 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -3.431 -2.430 1.842 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -6.187 -1.618 0.743 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -5.779 -3.256 1.306 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -7.173 -2.397 2.003 1.00 0.00 H new ATOM 1693 N GLY A 138 -5.688 -3.637 6.765 1.00 0.00 N ATOM 1694 CA GLY A 138 -5.461 -4.613 7.810 1.00 0.00 C ATOM 1695 C GLY A 138 -6.751 -5.099 8.429 1.00 0.00 C ATOM 1696 O GLY A 138 -6.939 -6.296 8.620 1.00 0.00 O ATOM 0 H GLY A 138 -5.290 -2.716 6.949 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -4.915 -5.462 7.399 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -4.832 -4.174 8.584 1.00 0.00 H new ATOM 1700 N GLN A 139 -7.648 -4.166 8.726 1.00 0.00 N ATOM 1701 CA GLN A 139 -8.941 -4.499 9.312 1.00 0.00 C ATOM 1702 C GLN A 139 -9.764 -5.356 8.351 1.00 0.00 C ATOM 1703 O GLN A 139 -10.376 -6.345 8.758 1.00 0.00 O ATOM 1704 CB GLN A 139 -9.707 -3.217 9.683 1.00 0.00 C ATOM 1705 CG GLN A 139 -11.116 -3.446 10.239 1.00 0.00 C ATOM 1706 CD GLN A 139 -11.153 -3.856 11.715 1.00 0.00 C ATOM 1707 OE1 GLN A 139 -10.128 -4.538 12.189 1.00 0.00 O flip ATOM 1708 NE2 GLN A 139 -12.111 -3.547 12.421 1.00 0.00 N flip ATOM 0 H GLN A 139 -7.503 -3.169 8.570 1.00 0.00 H new ATOM 0 HA GLN A 139 -8.769 -5.075 10.221 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -9.126 -2.665 10.422 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -9.780 -2.585 8.798 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -11.696 -2.532 10.113 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -11.606 -4.219 9.647 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -12.888 -3.019 12.024 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -12.129 -3.819 13.404 1.00 0.00 H new ATOM 1717 N ALA A 140 -9.762 -4.977 7.077 1.00 0.00 N ATOM 1718 CA ALA A 140 -10.491 -5.713 6.056 1.00 0.00 C ATOM 1719 C ALA A 140 -9.941 -7.126 5.913 1.00 0.00 C ATOM 1720 O ALA A 140 -10.695 -8.088 5.831 1.00 0.00 O ATOM 1721 CB ALA A 140 -10.429 -4.980 4.723 1.00 0.00 C ATOM 0 H ALA A 140 -9.260 -4.160 6.728 1.00 0.00 H new ATOM 0 HA ALA A 140 -11.534 -5.782 6.365 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -10.980 -5.545 3.971 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -10.873 -3.991 4.831 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -9.389 -4.879 4.411 1.00 0.00 H new ATOM 1727 N PHE A 141 -8.620 -7.243 5.899 1.00 0.00 N ATOM 1728 CA PHE A 141 -7.968 -8.537 5.781 1.00 0.00 C ATOM 1729 C PHE A 141 -8.230 -9.376 7.029 1.00 0.00 C ATOM 1730 O PHE A 141 -8.431 -10.589 6.947 1.00 0.00 O ATOM 1731 CB PHE A 141 -6.464 -8.353 5.558 1.00 0.00 C ATOM 1732 CG PHE A 141 -5.731 -9.623 5.225 1.00 0.00 C ATOM 1733 CD1 PHE A 141 -6.033 -10.332 4.071 1.00 0.00 C ATOM 1734 CD2 PHE A 141 -4.734 -10.102 6.058 1.00 0.00 C ATOM 1735 CE1 PHE A 141 -5.355 -11.494 3.757 1.00 0.00 C ATOM 1736 CE2 PHE A 141 -4.053 -11.264 5.750 1.00 0.00 C ATOM 1737 CZ PHE A 141 -4.365 -11.960 4.598 1.00 0.00 C ATOM 0 H PHE A 141 -7.978 -6.453 5.968 1.00 0.00 H new ATOM 0 HA PHE A 141 -8.381 -9.063 4.921 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -6.313 -7.637 4.750 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -6.025 -7.918 6.456 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -6.807 -9.971 3.410 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -4.486 -9.561 6.959 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -5.599 -12.036 2.856 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -3.278 -11.628 6.409 1.00 0.00 H new ATOM 0 HZ PHE A 141 -3.834 -12.869 4.356 1.00 0.00 H new ATOM 1743 N GLU A 142 -8.245 -8.713 8.177 1.00 0.00 N ATOM 1744 CA GLU A 142 -8.508 -9.368 9.444 1.00 0.00 C ATOM 1745 C GLU A 142 -9.903 -9.978 9.456 1.00 0.00 C ATOM 1746 O GLU A 142 -10.065 -11.172 9.718 1.00 0.00 O ATOM 1747 CB GLU A 142 -8.361 -8.377 10.598 1.00 0.00 C ATOM 1748 CG GLU A 142 -8.671 -8.968 11.961 1.00 0.00 C ATOM 1749 CD GLU A 142 -8.532 -7.962 13.074 1.00 0.00 C ATOM 1750 OE1 GLU A 142 -9.466 -7.169 13.282 1.00 0.00 O ATOM 1751 OE2 GLU A 142 -7.490 -7.971 13.760 1.00 0.00 O ATOM 0 H GLU A 142 -8.076 -7.710 8.253 1.00 0.00 H new ATOM 0 HA GLU A 142 -7.778 -10.167 9.570 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -7.342 -7.990 10.604 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -9.023 -7.529 10.422 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -9.687 -9.364 11.959 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -8.002 -9.808 12.150 1.00 0.00 H new ATOM 1754 N VAL A 143 -10.908 -9.159 9.151 1.00 0.00 N ATOM 1755 CA VAL A 143 -12.291 -9.619 9.149 1.00 0.00 C ATOM 1756 C VAL A 143 -12.534 -10.621 8.013 1.00 0.00 C ATOM 1757 O VAL A 143 -13.425 -11.463 8.096 1.00 0.00 O ATOM 1758 CB VAL A 143 -13.302 -8.433 9.059 1.00 0.00 C ATOM 1759 CG1 VAL A 143 -13.240 -7.746 7.706 1.00 0.00 C ATOM 1760 CG2 VAL A 143 -14.720 -8.898 9.369 1.00 0.00 C ATOM 0 H VAL A 143 -10.789 -8.177 8.903 1.00 0.00 H new ATOM 0 HA VAL A 143 -12.462 -10.123 10.100 1.00 0.00 H new ATOM 0 HB VAL A 143 -13.013 -7.700 9.812 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -13.958 -6.926 7.681 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -12.236 -7.355 7.542 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -13.482 -8.464 6.922 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -15.404 -8.052 9.299 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -15.016 -9.664 8.653 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -14.755 -9.311 10.377 1.00 0.00 H new ATOM 1770 N ALA A 144 -11.731 -10.529 6.958 1.00 0.00 N ATOM 1771 CA ALA A 144 -11.836 -11.454 5.840 1.00 0.00 C ATOM 1772 C ALA A 144 -11.326 -12.828 6.243 1.00 0.00 C ATOM 1773 O ALA A 144 -11.907 -13.850 5.874 1.00 0.00 O ATOM 1774 CB ALA A 144 -11.066 -10.936 4.638 1.00 0.00 C ATOM 0 H ALA A 144 -11.002 -9.823 6.856 1.00 0.00 H new ATOM 0 HA ALA A 144 -12.887 -11.538 5.562 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -11.159 -11.644 3.814 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -11.471 -9.971 4.335 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -10.015 -10.821 4.901 1.00 0.00 H new ATOM 1780 N TYR A 145 -10.238 -12.841 7.007 1.00 0.00 N ATOM 1781 CA TYR A 145 -9.645 -14.082 7.496 1.00 0.00 C ATOM 1782 C TYR A 145 -10.560 -14.730 8.533 1.00 0.00 C ATOM 1783 O TYR A 145 -10.511 -15.944 8.764 1.00 0.00 O ATOM 1784 CB TYR A 145 -8.265 -13.796 8.102 1.00 0.00 C ATOM 1785 CG TYR A 145 -7.497 -15.030 8.527 1.00 0.00 C ATOM 1786 CD1 TYR A 145 -6.841 -15.813 7.590 1.00 0.00 C ATOM 1787 CD2 TYR A 145 -7.421 -15.404 9.862 1.00 0.00 C ATOM 1788 CE1 TYR A 145 -6.131 -16.934 7.967 1.00 0.00 C ATOM 1789 CE2 TYR A 145 -6.715 -16.526 10.249 1.00 0.00 C ATOM 1790 CZ TYR A 145 -6.071 -17.287 9.297 1.00 0.00 C ATOM 1791 OH TYR A 145 -5.360 -18.400 9.677 1.00 0.00 O ATOM 0 H TYR A 145 -9.745 -11.998 7.303 1.00 0.00 H new ATOM 0 HA TYR A 145 -9.526 -14.773 6.662 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -7.669 -13.246 7.373 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -8.390 -13.146 8.968 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -6.887 -15.540 6.546 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -7.922 -14.808 10.610 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -5.625 -17.532 7.223 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -6.668 -16.806 11.291 1.00 0.00 H new ATOM 0 HH TYR A 145 -5.417 -18.509 10.649 1.00 0.00 H new ATOM 1797 N GLN A 146 -11.391 -13.910 9.152 1.00 0.00 N ATOM 1798 CA GLN A 146 -12.350 -14.375 10.131 1.00 0.00 C ATOM 1799 C GLN A 146 -13.629 -14.821 9.432 1.00 0.00 C ATOM 1800 O GLN A 146 -14.567 -14.016 9.324 1.00 0.00 O ATOM 1801 CB GLN A 146 -12.658 -13.263 11.139 1.00 0.00 C ATOM 1802 CG GLN A 146 -11.468 -12.857 11.990 1.00 0.00 C ATOM 1803 CD GLN A 146 -11.753 -11.648 12.863 1.00 0.00 C ATOM 1804 OE1 GLN A 146 -12.539 -10.769 12.498 1.00 0.00 O ATOM 1805 NE2 GLN A 146 -11.125 -11.597 14.021 1.00 0.00 N ATOM 0 H GLN A 146 -11.418 -12.904 8.988 1.00 0.00 H new ATOM 0 HA GLN A 146 -11.926 -15.223 10.668 1.00 0.00 H new ATOM 0 HB2 GLN A 146 -13.022 -12.388 10.600 1.00 0.00 H new ATOM 0 HB3 GLN A 146 -13.465 -13.593 11.794 1.00 0.00 H new ATOM 0 HG2 GLN A 146 -11.177 -13.695 12.623 1.00 0.00 H new ATOM 0 HG3 GLN A 146 -10.620 -12.638 11.340 1.00 0.00 H new ATOM 0 HE21 GLN A 146 -10.483 -12.344 14.286 1.00 0.00 H new ATOM 0 HE22 GLN A 146 -11.281 -10.811 14.652 1.00 0.00 H new TER 1814 GLN A 146