USER MOD reduce.3.24.130724 H: found=0, std=0, add=1188, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1177 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: C 122 CYS SG : rot 141:sc= 1.54 USER MOD Set 1.2: C 125 CYS SG : rot -44:sc= -1.48! USER MOD Set 1.3: C 144 CYS SG : rot -134:sc= 1.78 USER MOD Set 2.1: C 128 HIS : +bothHN:sc= 0.499 K(o=0.17,f=-7.9!) USER MOD Set 2.2: C 130 SER OG : rot -90:sc= -0.324 USER MOD Set 3.1: C 94 CYS SG : rot 120:sc= 0.698 USER MOD Set 3.2: C 97 CYS SG : rot -42:sc= -0.412 USER MOD Set 3.3: C 116 HIS : no HE2:sc= -0.719 K(o=-6.3,f=-8.6!) USER MOD Set 3.4: C 119 CYS SG : rot -160:sc= -5.9! USER MOD Set 4.1: B 11 CYS SG : rot 125:sc= 0.755 USER MOD Set 4.2: B 14 CYS SG : rot -174:sc= -0.349 USER MOD Set 4.3: B 27 HIS : no HE2:sc= -2.5! C(o=-4.2!,f=-6.9!) USER MOD Set 4.4: B 32 CYS SG : rot -107:sc= -2.08 USER MOD Set 5.1: A 231 TYR OH : rot 158:sc= 0.28 USER MOD Set 5.2: A 235 ASN : amide:sc= 1.2 K(o=2.1,f=-0.34) USER MOD Set 5.3: A 237 GLN : amide:sc= 0.613 K(o=2.1,f=-5.2!) USER MOD Set 5.4: B 30 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 222 HIS : no HD1:sc= -0.127 K(o=0.25,f=-5.9!) USER MOD Set 6.2: A 238 ASN : amide:sc= 0.372 K(o=0.25,f=-1.3) USER MOD Set 7.1: A 204 CYS SG : rot 147:sc= 1.35 USER MOD Set 7.2: A 207 CYS SG : rot -45:sc= 0.58! USER MOD Set 7.3: A 225 CYS SG : rot -145:sc= 2.39! USER MOD Set 7.4: A 228 CYS SG : rot 134:sc= -0.539 USER MOD Single : A 206 ASN : amide:sc= -0.409 X(o=-0.41,f=-0.34) USER MOD Single : A 210 THR OG1 : rot -39:sc= 0.432 USER MOD Single : A 212 THR OG1 : rot 172:sc= 1.13 USER MOD Single : A 220 THR OG1 : rot -7:sc= 0.141 USER MOD Single : A 223 TYR OH : rot -97:sc= 2.42 USER MOD Single : A 226 ASN : amide:sc= 0.761 K(o=0.76,f=-6.9!) USER MOD Single : A 232 HIS : no HE2:sc= -1.27 X(o=-1.3,f=-1) USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 MET CE :methyl 161:sc= -0.0712 (180deg=-0.519) USER MOD Single : B 1 GLY N :NH3+ -119:sc= 0.0923 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 81:sc= 1.25 USER MOD Single : B 22 SER OG : rot 180:sc= 0.0393 USER MOD Single : B 23 THR OG1 : rot 143:sc= -1.93! USER MOD Single : B 28 GLN :FLIP amide:sc= -0.327 F(o=-1.3!,f=-0.33) USER MOD Single : B 31 TYR OH : rot -177:sc= 0.969 USER MOD Single : B 33 SER OG : rot 180:sc= 0 USER MOD Single : B 34 HIS : no HD1:sc= -0.15 X(o=-0.15,f=-0.0052) USER MOD Single : C 96 SER OG : rot 85:sc= 0.677 USER MOD Single : C 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 104 TYR OH : rot 180:sc= 0 USER MOD Single : C 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 107 THR OG1 : rot 159:sc= 0.635 USER MOD Single : C 108 MET CE :methyl -154:sc= 0 (180deg=-0.601) USER MOD Single : C 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 115 TYR OH : rot -102:sc= 0.82 USER MOD Single : C 121 LYS NZ :NH3+ -163:sc= 0.994 (180deg=0.595) USER MOD Single : C 126 GLN : amide:sc= 0.378 X(o=0.38,f=-0.023) USER MOD Single : C 127 LYS NZ :NH3+ -162:sc= 0.913 (180deg=0.0707) USER MOD Single : C 135 TYR OH : rot -91:sc= 0.225 USER MOD Single : C 139 ASN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : C 140 SER OG : rot 180:sc= 0 USER MOD Single : C 146 GLN : amide:sc= -0.0459 K(o=-0.046,f=-1.6) USER MOD Single : C 149 TYR OH : rot 180:sc= 0 USER MOD Single : C 152 THR OG1 : rot -92:sc= 1.24 USER MOD Single : C 153 LYS NZ :NH3+ -158:sc= 0.0253 (180deg=0) USER MOD Single : C 155 ASN : amide:sc= 0.82 K(o=0.82,f=0) USER MOD Single : C 158 SER OG : rot 150:sc= -0.601 USER MOD Single : C 161 SER OG : rot -82:sc= 0.113 USER MOD Single : C 164 SER OG : rot 180:sc= 0 USER MOD Single : C 169 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 175 THR OG1 : rot 137:sc= 1.36 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 200 -5.829 6.276 7.636 1.00 0.91 N ATOM 2 CA GLU A 200 -5.119 4.992 7.444 1.00 0.71 C ATOM 3 C GLU A 200 -4.593 4.899 6.020 1.00 0.62 C ATOM 4 O GLU A 200 -5.043 5.633 5.144 1.00 0.70 O ATOM 5 CB GLU A 200 -6.049 3.810 7.731 1.00 0.79 C ATOM 6 CG GLU A 200 -6.549 3.757 9.165 1.00 0.88 C ATOM 7 CD GLU A 200 -5.454 4.043 10.169 1.00 1.29 C ATOM 8 OE1 GLU A 200 -4.324 3.557 9.981 1.00 1.63 O ATOM 9 OE2 GLU A 200 -5.714 4.780 11.140 1.00 1.61 O ATOM 0 HA GLU A 200 -4.283 4.953 8.142 1.00 0.71 H new ATOM 0 HB2 GLU A 200 -6.906 3.862 7.059 1.00 0.79 H new ATOM 0 HB3 GLU A 200 -5.523 2.883 7.505 1.00 0.79 H new ATOM 0 HG2 GLU A 200 -7.354 4.481 9.293 1.00 0.88 H new ATOM 0 HG3 GLU A 200 -6.972 2.772 9.363 1.00 0.88 H new ATOM 18 N ALA A 201 -3.649 3.991 5.795 1.00 0.56 N ATOM 19 CA ALA A 201 -3.057 3.803 4.475 1.00 0.57 C ATOM 20 C ALA A 201 -4.099 3.359 3.456 1.00 0.57 C ATOM 21 O ALA A 201 -4.253 3.971 2.402 1.00 0.89 O ATOM 22 CB ALA A 201 -1.925 2.789 4.551 1.00 0.62 C ATOM 0 H ALA A 201 -3.276 3.371 6.514 1.00 0.56 H new ATOM 0 HA ALA A 201 -2.657 4.762 4.144 1.00 0.57 H new ATOM 0 HB1 ALA A 201 -1.489 2.655 3.561 1.00 0.62 H new ATOM 0 HB2 ALA A 201 -1.160 3.149 5.239 1.00 0.62 H new ATOM 0 HB3 ALA A 201 -2.314 1.835 4.908 1.00 0.62 H new ATOM 28 N ARG A 202 -4.826 2.302 3.782 1.00 0.40 N ATOM 29 CA ARG A 202 -5.844 1.776 2.886 1.00 0.35 C ATOM 30 C ARG A 202 -6.925 1.056 3.685 1.00 0.33 C ATOM 31 O ARG A 202 -6.764 0.820 4.884 1.00 0.33 O ATOM 32 CB ARG A 202 -5.210 0.814 1.875 1.00 0.37 C ATOM 33 CG ARG A 202 -5.872 0.830 0.503 1.00 0.36 C ATOM 34 CD ARG A 202 -5.078 1.661 -0.499 1.00 0.28 C ATOM 35 NE ARG A 202 -5.436 3.077 -0.457 1.00 0.46 N ATOM 36 CZ ARG A 202 -4.728 4.036 -1.058 1.00 0.44 C ATOM 37 NH1 ARG A 202 -3.612 3.738 -1.712 1.00 0.42 N ATOM 38 NH2 ARG A 202 -5.132 5.299 -1.000 1.00 0.72 N ATOM 0 H ARG A 202 -4.730 1.792 4.660 1.00 0.40 H new ATOM 0 HA ARG A 202 -6.299 2.606 2.346 1.00 0.35 H new ATOM 0 HB2 ARG A 202 -4.156 1.066 1.761 1.00 0.37 H new ATOM 0 HB3 ARG A 202 -5.254 -0.199 2.276 1.00 0.37 H new ATOM 0 HG2 ARG A 202 -5.968 -0.191 0.134 1.00 0.36 H new ATOM 0 HG3 ARG A 202 -6.881 1.233 0.591 1.00 0.36 H new ATOM 0 HD2 ARG A 202 -4.013 1.552 -0.294 1.00 0.28 H new ATOM 0 HD3 ARG A 202 -5.250 1.275 -1.504 1.00 0.28 H new ATOM 0 HE ARG A 202 -6.273 3.348 0.060 1.00 0.46 H new ATOM 0 HH11 ARG A 202 -3.290 2.771 -1.758 1.00 0.42 H new ATOM 0 HH12 ARG A 202 -3.076 4.476 -2.169 1.00 0.42 H new ATOM 0 HH21 ARG A 202 -5.985 5.539 -0.495 1.00 0.72 H new ATOM 0 HH22 ARG A 202 -4.589 6.030 -1.460 1.00 0.72 H new ATOM 52 N GLU A 203 -8.027 0.731 3.024 1.00 0.37 N ATOM 53 CA GLU A 203 -9.132 0.026 3.661 1.00 0.39 C ATOM 54 C GLU A 203 -9.262 -1.381 3.085 1.00 0.37 C ATOM 55 O GLU A 203 -8.651 -1.694 2.064 1.00 0.36 O ATOM 56 CB GLU A 203 -10.452 0.787 3.461 1.00 0.48 C ATOM 57 CG GLU A 203 -10.287 2.224 2.974 1.00 0.49 C ATOM 58 CD GLU A 203 -10.216 2.328 1.463 1.00 0.51 C ATOM 59 OE1 GLU A 203 -11.280 2.472 0.820 1.00 0.53 O ATOM 60 OE2 GLU A 203 -9.096 2.279 0.909 1.00 0.55 O ATOM 0 H GLU A 203 -8.181 0.946 2.039 1.00 0.37 H new ATOM 0 HA GLU A 203 -8.922 -0.038 4.729 1.00 0.39 H new ATOM 0 HB2 GLU A 203 -11.066 0.242 2.744 1.00 0.48 H new ATOM 0 HB3 GLU A 203 -10.997 0.797 4.405 1.00 0.48 H new ATOM 0 HG2 GLU A 203 -11.122 2.824 3.336 1.00 0.49 H new ATOM 0 HG3 GLU A 203 -9.380 2.647 3.406 1.00 0.49 H new ATOM 67 N CYS A 204 -10.045 -2.226 3.749 1.00 0.39 N ATOM 68 CA CYS A 204 -10.263 -3.587 3.289 1.00 0.39 C ATOM 69 C CYS A 204 -11.655 -3.706 2.687 1.00 0.42 C ATOM 70 O CYS A 204 -12.500 -2.827 2.861 1.00 0.54 O ATOM 71 CB CYS A 204 -10.098 -4.587 4.441 1.00 0.41 C ATOM 72 SG CYS A 204 -10.340 -6.338 3.975 1.00 0.46 S ATOM 0 H CYS A 204 -10.539 -1.988 4.609 1.00 0.39 H new ATOM 0 HA CYS A 204 -9.518 -3.821 2.528 1.00 0.39 H new ATOM 0 HB2 CYS A 204 -9.100 -4.472 4.863 1.00 0.41 H new ATOM 0 HB3 CYS A 204 -10.808 -4.333 5.228 1.00 0.41 H new ATOM 0 HG CYS A 204 -9.554 -7.089 4.688 1.00 0.46 H new ATOM 77 N VAL A 205 -11.888 -4.802 1.996 1.00 0.38 N ATOM 78 CA VAL A 205 -13.170 -5.043 1.367 1.00 0.40 C ATOM 79 C VAL A 205 -14.177 -5.609 2.360 1.00 0.48 C ATOM 80 O VAL A 205 -15.387 -5.486 2.163 1.00 0.52 O ATOM 81 CB VAL A 205 -13.044 -6.017 0.179 1.00 0.38 C ATOM 82 CG1 VAL A 205 -12.322 -5.363 -0.987 1.00 0.36 C ATOM 83 CG2 VAL A 205 -12.339 -7.296 0.600 1.00 0.47 C ATOM 0 H VAL A 205 -11.202 -5.544 1.855 1.00 0.38 H new ATOM 0 HA VAL A 205 -13.523 -4.078 1.003 1.00 0.40 H new ATOM 0 HB VAL A 205 -14.050 -6.276 -0.150 1.00 0.38 H new ATOM 0 HG11 VAL A 205 -12.247 -6.072 -1.812 1.00 0.36 H new ATOM 0 HG12 VAL A 205 -12.879 -4.484 -1.313 1.00 0.36 H new ATOM 0 HG13 VAL A 205 -11.322 -5.063 -0.674 1.00 0.36 H new ATOM 0 HG21 VAL A 205 -12.262 -7.967 -0.255 1.00 0.47 H new ATOM 0 HG22 VAL A 205 -11.340 -7.058 0.965 1.00 0.47 H new ATOM 0 HG23 VAL A 205 -12.909 -7.782 1.392 1.00 0.47 H new ATOM 93 N ASN A 206 -13.683 -6.220 3.431 1.00 0.51 N ATOM 94 CA ASN A 206 -14.572 -6.820 4.418 1.00 0.60 C ATOM 95 C ASN A 206 -14.310 -6.325 5.835 1.00 0.63 C ATOM 96 O ASN A 206 -15.138 -6.545 6.722 1.00 0.72 O ATOM 97 CB ASN A 206 -14.471 -8.343 4.376 1.00 0.65 C ATOM 98 CG ASN A 206 -15.570 -8.979 3.547 1.00 0.79 C ATOM 99 OD1 ASN A 206 -16.650 -9.285 4.056 1.00 0.88 O ATOM 100 ND2 ASN A 206 -15.301 -9.198 2.267 1.00 1.26 N ATOM 0 H ASN A 206 -12.688 -6.312 3.636 1.00 0.51 H new ATOM 0 HA ASN A 206 -15.582 -6.509 4.150 1.00 0.60 H new ATOM 0 HB2 ASN A 206 -13.502 -8.628 3.967 1.00 0.65 H new ATOM 0 HB3 ASN A 206 -14.515 -8.734 5.392 1.00 0.65 H new ATOM 0 HD21 ASN A 206 -16.000 -9.634 1.666 1.00 1.26 H new ATOM 0 HD22 ASN A 206 -14.395 -8.930 1.883 1.00 1.26 H new ATOM 107 N CYS A 207 -13.181 -5.660 6.071 1.00 0.57 N ATOM 108 CA CYS A 207 -12.905 -5.162 7.410 1.00 0.61 C ATOM 109 C CYS A 207 -12.300 -3.752 7.375 1.00 0.58 C ATOM 110 O CYS A 207 -13.031 -2.757 7.378 1.00 0.62 O ATOM 111 CB CYS A 207 -12.034 -6.163 8.204 1.00 0.63 C ATOM 112 SG CYS A 207 -10.279 -6.309 7.701 1.00 0.55 S ATOM 0 H CYS A 207 -12.464 -5.459 5.374 1.00 0.57 H new ATOM 0 HA CYS A 207 -13.853 -5.074 7.940 1.00 0.61 H new ATOM 0 HB2 CYS A 207 -12.064 -5.879 9.256 1.00 0.63 H new ATOM 0 HB3 CYS A 207 -12.493 -7.149 8.127 1.00 0.63 H new ATOM 0 HG CYS A 207 -10.203 -6.371 6.405 1.00 0.55 H new ATOM 117 N GLY A 208 -10.985 -3.673 7.330 1.00 0.54 N ATOM 118 CA GLY A 208 -10.303 -2.395 7.302 1.00 0.52 C ATOM 119 C GLY A 208 -9.077 -2.384 8.193 1.00 0.49 C ATOM 120 O GLY A 208 -8.707 -1.346 8.739 1.00 0.52 O ATOM 0 H GLY A 208 -10.365 -4.483 7.312 1.00 0.54 H new ATOM 0 HA2 GLY A 208 -10.009 -2.164 6.278 1.00 0.52 H new ATOM 0 HA3 GLY A 208 -10.990 -1.611 7.621 1.00 0.52 H new ATOM 124 N ALA A 209 -8.446 -3.543 8.346 1.00 0.47 N ATOM 125 CA ALA A 209 -7.258 -3.653 9.182 1.00 0.46 C ATOM 126 C ALA A 209 -5.994 -3.314 8.399 1.00 0.42 C ATOM 127 O ALA A 209 -5.473 -4.145 7.656 1.00 0.41 O ATOM 128 CB ALA A 209 -7.149 -5.048 9.774 1.00 0.49 C ATOM 0 H ALA A 209 -8.736 -4.415 7.904 1.00 0.47 H new ATOM 0 HA ALA A 209 -7.357 -2.932 9.993 1.00 0.46 H new ATOM 0 HB1 ALA A 209 -6.256 -5.111 10.395 1.00 0.49 H new ATOM 0 HB2 ALA A 209 -8.029 -5.255 10.382 1.00 0.49 H new ATOM 0 HB3 ALA A 209 -7.084 -5.781 8.970 1.00 0.49 H new ATOM 134 N THR A 210 -5.491 -2.101 8.581 1.00 0.45 N ATOM 135 CA THR A 210 -4.286 -1.667 7.887 1.00 0.48 C ATOM 136 C THR A 210 -3.037 -2.177 8.604 1.00 0.47 C ATOM 137 O THR A 210 -1.909 -1.899 8.191 1.00 0.47 O ATOM 138 CB THR A 210 -4.224 -0.128 7.751 1.00 0.61 C ATOM 139 OG1 THR A 210 -3.164 0.250 6.860 1.00 0.67 O ATOM 140 CG2 THR A 210 -4.011 0.536 9.104 1.00 0.70 C ATOM 0 H THR A 210 -5.897 -1.401 9.202 1.00 0.45 H new ATOM 0 HA THR A 210 -4.322 -2.092 6.884 1.00 0.48 H new ATOM 0 HB THR A 210 -5.178 0.209 7.346 1.00 0.61 H new ATOM 0 HG1 THR A 210 -2.386 -0.325 7.015 1.00 0.67 H new ATOM 0 HG21 THR A 210 -3.972 1.618 8.976 1.00 0.70 H new ATOM 0 HG22 THR A 210 -4.835 0.279 9.769 1.00 0.70 H new ATOM 0 HG23 THR A 210 -3.073 0.187 9.537 1.00 0.70 H new ATOM 148 N ALA A 211 -3.254 -2.945 9.668 1.00 0.49 N ATOM 149 CA ALA A 211 -2.164 -3.511 10.447 1.00 0.52 C ATOM 150 C ALA A 211 -1.567 -4.724 9.747 1.00 0.44 C ATOM 151 O ALA A 211 -0.561 -5.274 10.194 1.00 0.44 O ATOM 152 CB ALA A 211 -2.645 -3.893 11.838 1.00 0.64 C ATOM 0 H ALA A 211 -4.183 -3.189 10.010 1.00 0.49 H new ATOM 0 HA ALA A 211 -1.388 -2.752 10.540 1.00 0.52 H new ATOM 0 HB1 ALA A 211 -1.816 -4.315 12.407 1.00 0.64 H new ATOM 0 HB2 ALA A 211 -3.022 -3.007 12.349 1.00 0.64 H new ATOM 0 HB3 ALA A 211 -3.442 -4.632 11.757 1.00 0.64 H new ATOM 158 N THR A 212 -2.198 -5.142 8.655 1.00 0.42 N ATOM 159 CA THR A 212 -1.719 -6.278 7.884 1.00 0.41 C ATOM 160 C THR A 212 -0.295 -6.010 7.394 1.00 0.37 C ATOM 161 O THR A 212 0.025 -4.887 6.999 1.00 0.34 O ATOM 162 CB THR A 212 -2.645 -6.579 6.675 1.00 0.40 C ATOM 163 OG1 THR A 212 -2.092 -7.632 5.871 1.00 0.46 O ATOM 164 CG2 THR A 212 -2.852 -5.338 5.815 1.00 0.30 C ATOM 0 H THR A 212 -3.044 -4.708 8.285 1.00 0.42 H new ATOM 0 HA THR A 212 -1.725 -7.152 8.536 1.00 0.41 H new ATOM 0 HB THR A 212 -3.611 -6.893 7.070 1.00 0.40 H new ATOM 0 HG1 THR A 212 -2.745 -7.902 5.192 1.00 0.46 H new ATOM 0 HG21 THR A 212 -3.505 -5.581 4.977 1.00 0.30 H new ATOM 0 HG22 THR A 212 -3.310 -4.552 6.415 1.00 0.30 H new ATOM 0 HG23 THR A 212 -1.890 -4.992 5.437 1.00 0.30 H new ATOM 172 N PRO A 213 0.581 -7.032 7.433 1.00 0.45 N ATOM 173 CA PRO A 213 1.979 -6.908 6.999 1.00 0.49 C ATOM 174 C PRO A 213 2.107 -6.359 5.578 1.00 0.49 C ATOM 175 O PRO A 213 3.087 -5.685 5.248 1.00 0.56 O ATOM 176 CB PRO A 213 2.520 -8.345 7.071 1.00 0.59 C ATOM 177 CG PRO A 213 1.322 -9.222 7.225 1.00 0.62 C ATOM 178 CD PRO A 213 0.286 -8.387 7.917 1.00 0.55 C ATOM 0 HA PRO A 213 2.529 -6.205 7.625 1.00 0.49 H new ATOM 0 HB2 PRO A 213 3.077 -8.599 6.169 1.00 0.59 H new ATOM 0 HB3 PRO A 213 3.203 -8.464 7.912 1.00 0.59 H new ATOM 0 HG2 PRO A 213 0.962 -9.565 6.255 1.00 0.62 H new ATOM 0 HG3 PRO A 213 1.561 -10.111 7.809 1.00 0.62 H new ATOM 0 HD2 PRO A 213 -0.725 -8.699 7.655 1.00 0.55 H new ATOM 0 HD3 PRO A 213 0.370 -8.456 9.002 1.00 0.55 H new ATOM 186 N LEU A 214 1.110 -6.643 4.748 1.00 0.43 N ATOM 187 CA LEU A 214 1.099 -6.180 3.371 1.00 0.44 C ATOM 188 C LEU A 214 -0.295 -6.334 2.778 1.00 0.39 C ATOM 189 O LEU A 214 -0.891 -7.405 2.857 1.00 0.46 O ATOM 190 CB LEU A 214 2.114 -6.965 2.533 1.00 0.53 C ATOM 191 CG LEU A 214 2.501 -6.319 1.200 1.00 0.63 C ATOM 192 CD1 LEU A 214 3.346 -5.078 1.433 1.00 0.74 C ATOM 193 CD2 LEU A 214 3.248 -7.315 0.323 1.00 0.74 C ATOM 0 H LEU A 214 0.294 -7.196 5.010 1.00 0.43 H new ATOM 0 HA LEU A 214 1.377 -5.126 3.358 1.00 0.44 H new ATOM 0 HB2 LEU A 214 3.018 -7.106 3.126 1.00 0.53 H new ATOM 0 HB3 LEU A 214 1.706 -7.956 2.333 1.00 0.53 H new ATOM 0 HG LEU A 214 1.588 -6.021 0.685 1.00 0.63 H new ATOM 0 HD11 LEU A 214 3.611 -4.633 0.474 1.00 0.74 H new ATOM 0 HD12 LEU A 214 2.779 -4.358 2.023 1.00 0.74 H new ATOM 0 HD13 LEU A 214 4.254 -5.352 1.969 1.00 0.74 H new ATOM 0 HD21 LEU A 214 3.516 -6.840 -0.621 1.00 0.74 H new ATOM 0 HD22 LEU A 214 4.153 -7.642 0.834 1.00 0.74 H new ATOM 0 HD23 LEU A 214 2.610 -8.177 0.127 1.00 0.74 H new ATOM 205 N TRP A 215 -0.817 -5.258 2.207 1.00 0.31 N ATOM 206 CA TRP A 215 -2.137 -5.286 1.596 1.00 0.27 C ATOM 207 C TRP A 215 -2.111 -6.156 0.344 1.00 0.32 C ATOM 208 O TRP A 215 -1.301 -5.935 -0.561 1.00 0.40 O ATOM 209 CB TRP A 215 -2.595 -3.872 1.227 1.00 0.25 C ATOM 210 CG TRP A 215 -3.121 -3.078 2.384 1.00 0.28 C ATOM 211 CD1 TRP A 215 -2.476 -2.082 3.061 1.00 0.36 C ATOM 212 CD2 TRP A 215 -4.406 -3.211 2.998 1.00 0.31 C ATOM 213 NE1 TRP A 215 -3.284 -1.590 4.058 1.00 0.41 N ATOM 214 CE2 TRP A 215 -4.473 -2.269 4.040 1.00 0.38 C ATOM 215 CE3 TRP A 215 -5.504 -4.037 2.772 1.00 0.37 C ATOM 216 CZ2 TRP A 215 -5.598 -2.128 4.845 1.00 0.45 C ATOM 217 CZ3 TRP A 215 -6.619 -3.898 3.572 1.00 0.46 C ATOM 218 CH2 TRP A 215 -6.657 -2.951 4.600 1.00 0.48 C ATOM 0 H TRP A 215 -0.346 -4.355 2.154 1.00 0.31 H new ATOM 0 HA TRP A 215 -2.839 -5.704 2.317 1.00 0.27 H new ATOM 0 HB2 TRP A 215 -1.757 -3.335 0.782 1.00 0.25 H new ATOM 0 HB3 TRP A 215 -3.371 -3.940 0.464 1.00 0.25 H new ATOM 0 HD1 TRP A 215 -1.477 -1.732 2.844 1.00 0.36 H new ATOM 0 HE1 TRP A 215 -3.038 -0.841 4.706 1.00 0.41 H new ATOM 0 HE3 TRP A 215 -5.483 -4.774 1.983 1.00 0.37 H new ATOM 0 HZ2 TRP A 215 -5.632 -1.393 5.636 1.00 0.45 H new ATOM 0 HZ3 TRP A 215 -7.477 -4.531 3.401 1.00 0.46 H new ATOM 0 HH2 TRP A 215 -7.543 -2.870 5.212 1.00 0.48 H new ATOM 229 N ARG A 216 -2.989 -7.144 0.301 1.00 0.33 N ATOM 230 CA ARG A 216 -3.069 -8.045 -0.837 1.00 0.39 C ATOM 231 C ARG A 216 -3.948 -7.441 -1.923 1.00 0.37 C ATOM 232 O ARG A 216 -5.161 -7.321 -1.758 1.00 0.46 O ATOM 233 CB ARG A 216 -3.628 -9.406 -0.407 1.00 0.46 C ATOM 234 CG ARG A 216 -2.567 -10.429 -0.019 1.00 0.55 C ATOM 235 CD ARG A 216 -1.770 -9.993 1.204 1.00 0.57 C ATOM 236 NE ARG A 216 -1.406 -11.128 2.057 1.00 0.55 N ATOM 237 CZ ARG A 216 -0.319 -11.887 1.886 1.00 0.73 C ATOM 238 NH1 ARG A 216 0.541 -11.627 0.905 1.00 1.02 N ATOM 239 NH2 ARG A 216 -0.091 -12.901 2.712 1.00 0.80 N ATOM 0 H ARG A 216 -3.659 -7.343 1.044 1.00 0.33 H new ATOM 0 HA ARG A 216 -2.064 -8.191 -1.233 1.00 0.39 H new ATOM 0 HB2 ARG A 216 -4.299 -9.258 0.439 1.00 0.46 H new ATOM 0 HB3 ARG A 216 -4.227 -9.813 -1.222 1.00 0.46 H new ATOM 0 HG2 ARG A 216 -3.045 -11.387 0.183 1.00 0.55 H new ATOM 0 HG3 ARG A 216 -1.888 -10.582 -0.858 1.00 0.55 H new ATOM 0 HD2 ARG A 216 -0.865 -9.477 0.882 1.00 0.57 H new ATOM 0 HD3 ARG A 216 -2.356 -9.278 1.782 1.00 0.57 H new ATOM 0 HE ARG A 216 -2.025 -11.354 2.835 1.00 0.55 H new ATOM 0 HH11 ARG A 216 0.374 -10.842 0.275 1.00 1.02 H new ATOM 0 HH12 ARG A 216 1.368 -12.212 0.783 1.00 1.02 H new ATOM 0 HH21 ARG A 216 -0.743 -13.097 3.471 1.00 0.80 H new ATOM 0 HH22 ARG A 216 0.736 -13.484 2.587 1.00 0.80 H new ATOM 253 N ARG A 217 -3.331 -7.041 -3.023 1.00 0.38 N ATOM 254 CA ARG A 217 -4.061 -6.450 -4.134 1.00 0.39 C ATOM 255 C ARG A 217 -3.907 -7.302 -5.386 1.00 0.44 C ATOM 256 O ARG A 217 -2.813 -7.785 -5.692 1.00 0.50 O ATOM 257 CB ARG A 217 -3.569 -5.023 -4.420 1.00 0.43 C ATOM 258 CG ARG A 217 -4.327 -4.345 -5.552 1.00 0.45 C ATOM 259 CD ARG A 217 -3.410 -3.491 -6.415 1.00 0.43 C ATOM 260 NE ARG A 217 -3.420 -2.091 -5.996 1.00 0.52 N ATOM 261 CZ ARG A 217 -3.781 -1.070 -6.777 1.00 1.07 C ATOM 262 NH1 ARG A 217 -4.120 -1.273 -8.047 1.00 1.43 N ATOM 263 NH2 ARG A 217 -3.791 0.158 -6.282 1.00 1.46 N ATOM 0 H ARG A 217 -2.324 -7.115 -3.171 1.00 0.38 H new ATOM 0 HA ARG A 217 -5.114 -6.408 -3.855 1.00 0.39 H new ATOM 0 HB2 ARG A 217 -3.667 -4.423 -3.515 1.00 0.43 H new ATOM 0 HB3 ARG A 217 -2.508 -5.054 -4.669 1.00 0.43 H new ATOM 0 HG2 ARG A 217 -4.808 -5.102 -6.172 1.00 0.45 H new ATOM 0 HG3 ARG A 217 -5.119 -3.722 -5.137 1.00 0.45 H new ATOM 0 HD2 ARG A 217 -2.393 -3.880 -6.360 1.00 0.43 H new ATOM 0 HD3 ARG A 217 -3.722 -3.561 -7.457 1.00 0.43 H new ATOM 0 HE ARG A 217 -3.131 -1.879 -5.041 1.00 0.52 H new ATOM 0 HH11 ARG A 217 -4.106 -2.217 -8.434 1.00 1.43 H new ATOM 0 HH12 ARG A 217 -4.394 -0.485 -8.634 1.00 1.43 H new ATOM 0 HH21 ARG A 217 -3.524 0.319 -5.311 1.00 1.46 H new ATOM 0 HH22 ARG A 217 -4.065 0.943 -6.872 1.00 1.46 H new ATOM 277 N ASP A 218 -5.009 -7.486 -6.095 1.00 0.44 N ATOM 278 CA ASP A 218 -5.018 -8.267 -7.323 1.00 0.50 C ATOM 279 C ASP A 218 -4.948 -7.342 -8.540 1.00 0.54 C ATOM 280 O ASP A 218 -4.633 -6.156 -8.414 1.00 0.57 O ATOM 281 CB ASP A 218 -6.283 -9.133 -7.390 1.00 0.51 C ATOM 282 CG ASP A 218 -7.482 -8.372 -7.919 1.00 0.51 C ATOM 283 OD1 ASP A 218 -7.819 -7.314 -7.359 1.00 0.48 O ATOM 284 OD2 ASP A 218 -8.078 -8.816 -8.923 1.00 0.59 O ATOM 0 H ASP A 218 -5.918 -7.101 -5.838 1.00 0.44 H new ATOM 0 HA ASP A 218 -4.145 -8.919 -7.328 1.00 0.50 H new ATOM 0 HB2 ASP A 218 -6.095 -9.996 -8.028 1.00 0.51 H new ATOM 0 HB3 ASP A 218 -6.510 -9.516 -6.395 1.00 0.51 H new ATOM 289 N ARG A 219 -5.252 -7.880 -9.714 1.00 0.60 N ATOM 290 CA ARG A 219 -5.223 -7.104 -10.945 1.00 0.65 C ATOM 291 C ARG A 219 -6.362 -6.082 -10.996 1.00 0.63 C ATOM 292 O ARG A 219 -6.161 -4.948 -11.431 1.00 0.68 O ATOM 293 CB ARG A 219 -5.313 -8.034 -12.152 1.00 0.72 C ATOM 294 CG ARG A 219 -5.201 -7.311 -13.482 1.00 0.86 C ATOM 295 CD ARG A 219 -5.591 -8.215 -14.637 1.00 0.94 C ATOM 296 NE ARG A 219 -5.596 -7.504 -15.911 1.00 0.91 N ATOM 297 CZ ARG A 219 -6.163 -7.973 -17.019 1.00 1.12 C ATOM 298 NH1 ARG A 219 -6.772 -9.152 -17.004 1.00 1.57 N ATOM 299 NH2 ARG A 219 -6.122 -7.263 -18.137 1.00 1.34 N ATOM 0 H ARG A 219 -5.523 -8.855 -9.839 1.00 0.60 H new ATOM 0 HA ARG A 219 -4.279 -6.559 -10.970 1.00 0.65 H new ATOM 0 HB2 ARG A 219 -4.522 -8.781 -12.085 1.00 0.72 H new ATOM 0 HB3 ARG A 219 -6.261 -8.571 -12.118 1.00 0.72 H new ATOM 0 HG2 ARG A 219 -5.843 -6.430 -13.474 1.00 0.86 H new ATOM 0 HG3 ARG A 219 -4.179 -6.959 -13.622 1.00 0.86 H new ATOM 0 HD2 ARG A 219 -4.896 -9.053 -14.692 1.00 0.94 H new ATOM 0 HD3 ARG A 219 -6.580 -8.633 -14.452 1.00 0.94 H new ATOM 0 HE ARG A 219 -5.138 -6.594 -15.955 1.00 0.91 H new ATOM 0 HH11 ARG A 219 -6.805 -9.698 -16.143 1.00 1.57 H new ATOM 0 HH12 ARG A 219 -7.207 -9.512 -17.853 1.00 1.57 H new ATOM 0 HH21 ARG A 219 -5.655 -6.356 -18.148 1.00 1.34 H new ATOM 0 HH22 ARG A 219 -6.557 -7.623 -18.986 1.00 1.34 H new ATOM 313 N THR A 220 -7.551 -6.479 -10.544 1.00 0.59 N ATOM 314 CA THR A 220 -8.703 -5.582 -10.567 1.00 0.62 C ATOM 315 C THR A 220 -8.535 -4.440 -9.567 1.00 0.58 C ATOM 316 O THR A 220 -8.944 -3.308 -9.828 1.00 0.70 O ATOM 317 CB THR A 220 -10.031 -6.328 -10.291 1.00 0.65 C ATOM 318 OG1 THR A 220 -10.024 -6.925 -8.984 1.00 0.82 O ATOM 319 CG2 THR A 220 -10.277 -7.404 -11.340 1.00 0.90 C ATOM 0 H THR A 220 -7.740 -7.406 -10.162 1.00 0.59 H new ATOM 0 HA THR A 220 -8.752 -5.168 -11.574 1.00 0.62 H new ATOM 0 HB THR A 220 -10.835 -5.594 -10.340 1.00 0.65 H new ATOM 0 HG1 THR A 220 -9.135 -6.824 -8.583 1.00 0.82 H new ATOM 0 HG21 THR A 220 -11.216 -7.914 -11.125 1.00 0.90 H new ATOM 0 HG22 THR A 220 -10.332 -6.944 -12.327 1.00 0.90 H new ATOM 0 HG23 THR A 220 -9.460 -8.125 -11.320 1.00 0.90 H new ATOM 327 N GLY A 221 -7.922 -4.736 -8.428 1.00 0.47 N ATOM 328 CA GLY A 221 -7.708 -3.719 -7.420 1.00 0.44 C ATOM 329 C GLY A 221 -8.421 -4.029 -6.123 1.00 0.41 C ATOM 330 O GLY A 221 -8.692 -3.130 -5.327 1.00 0.43 O ATOM 0 H GLY A 221 -7.570 -5.662 -8.185 1.00 0.47 H new ATOM 0 HA2 GLY A 221 -6.639 -3.621 -7.229 1.00 0.44 H new ATOM 0 HA3 GLY A 221 -8.053 -2.757 -7.800 1.00 0.44 H new ATOM 334 N HIS A 222 -8.725 -5.299 -5.904 1.00 0.41 N ATOM 335 CA HIS A 222 -9.404 -5.717 -4.690 1.00 0.41 C ATOM 336 C HIS A 222 -8.426 -5.730 -3.528 1.00 0.37 C ATOM 337 O HIS A 222 -7.635 -6.660 -3.387 1.00 0.42 O ATOM 338 CB HIS A 222 -10.027 -7.105 -4.869 1.00 0.48 C ATOM 339 CG HIS A 222 -11.522 -7.102 -4.786 1.00 0.60 C ATOM 340 ND1 HIS A 222 -12.253 -8.091 -4.159 1.00 0.75 N ATOM 341 CD2 HIS A 222 -12.429 -6.209 -5.253 1.00 0.72 C ATOM 342 CE1 HIS A 222 -13.538 -7.805 -4.244 1.00 0.90 C ATOM 343 NE2 HIS A 222 -13.673 -6.670 -4.902 1.00 0.90 N ATOM 0 H HIS A 222 -8.512 -6.057 -6.552 1.00 0.41 H new ATOM 0 HA HIS A 222 -10.203 -5.006 -4.477 1.00 0.41 H new ATOM 0 HB2 HIS A 222 -9.725 -7.508 -5.836 1.00 0.48 H new ATOM 0 HB3 HIS A 222 -9.630 -7.774 -4.106 1.00 0.48 H new ATOM 0 HD2 HIS A 222 -12.213 -5.303 -5.800 1.00 0.72 H new ATOM 0 HE1 HIS A 222 -14.344 -8.401 -3.842 1.00 0.90 H new ATOM 0 HE2 HIS A 222 -14.558 -6.210 -5.115 1.00 0.90 H new ATOM 352 N TYR A 223 -8.461 -4.676 -2.728 1.00 0.33 N ATOM 353 CA TYR A 223 -7.582 -4.566 -1.576 1.00 0.29 C ATOM 354 C TYR A 223 -8.082 -5.435 -0.434 1.00 0.31 C ATOM 355 O TYR A 223 -9.147 -5.188 0.132 1.00 0.33 O ATOM 356 CB TYR A 223 -7.467 -3.112 -1.120 1.00 0.28 C ATOM 357 CG TYR A 223 -6.346 -2.354 -1.791 1.00 0.32 C ATOM 358 CD1 TYR A 223 -5.025 -2.591 -1.442 1.00 0.45 C ATOM 359 CD2 TYR A 223 -6.607 -1.404 -2.769 1.00 0.40 C ATOM 360 CE1 TYR A 223 -3.992 -1.902 -2.048 1.00 0.58 C ATOM 361 CE2 TYR A 223 -5.580 -0.712 -3.380 1.00 0.54 C ATOM 362 CZ TYR A 223 -4.275 -0.964 -3.016 1.00 0.60 C ATOM 363 OH TYR A 223 -3.248 -0.279 -3.629 1.00 0.78 O ATOM 0 H TYR A 223 -9.090 -3.883 -2.856 1.00 0.33 H new ATOM 0 HA TYR A 223 -6.593 -4.916 -1.872 1.00 0.29 H new ATOM 0 HB2 TYR A 223 -8.409 -2.602 -1.319 1.00 0.28 H new ATOM 0 HB3 TYR A 223 -7.315 -3.089 -0.041 1.00 0.28 H new ATOM 0 HD1 TYR A 223 -4.800 -3.326 -0.684 1.00 0.45 H new ATOM 0 HD2 TYR A 223 -7.629 -1.203 -3.056 1.00 0.40 H new ATOM 0 HE1 TYR A 223 -2.969 -2.098 -1.764 1.00 0.58 H new ATOM 0 HE2 TYR A 223 -5.799 0.024 -4.140 1.00 0.54 H new ATOM 0 HH TYR A 223 -3.129 0.591 -3.193 1.00 0.78 H new ATOM 373 N LEU A 224 -7.317 -6.463 -0.122 1.00 0.33 N ATOM 374 CA LEU A 224 -7.657 -7.376 0.951 1.00 0.37 C ATOM 375 C LEU A 224 -6.576 -7.323 2.021 1.00 0.36 C ATOM 376 O LEU A 224 -5.387 -7.277 1.696 1.00 0.34 O ATOM 377 CB LEU A 224 -7.782 -8.805 0.411 1.00 0.42 C ATOM 378 CG LEU A 224 -8.411 -8.933 -0.982 1.00 0.48 C ATOM 379 CD1 LEU A 224 -7.620 -9.918 -1.831 1.00 0.52 C ATOM 380 CD2 LEU A 224 -9.863 -9.371 -0.879 1.00 0.61 C ATOM 0 H LEU A 224 -6.446 -6.688 -0.603 1.00 0.33 H new ATOM 0 HA LEU A 224 -8.613 -7.080 1.382 1.00 0.37 H new ATOM 0 HB2 LEU A 224 -6.789 -9.253 0.384 1.00 0.42 H new ATOM 0 HB3 LEU A 224 -8.376 -9.389 1.114 1.00 0.42 H new ATOM 0 HG LEU A 224 -8.382 -7.955 -1.462 1.00 0.48 H new ATOM 0 HD11 LEU A 224 -8.078 -9.999 -2.817 1.00 0.52 H new ATOM 0 HD12 LEU A 224 -6.594 -9.566 -1.936 1.00 0.52 H new ATOM 0 HD13 LEU A 224 -7.621 -10.896 -1.350 1.00 0.52 H new ATOM 0 HD21 LEU A 224 -10.289 -9.455 -1.879 1.00 0.61 H new ATOM 0 HD22 LEU A 224 -9.917 -10.338 -0.379 1.00 0.61 H new ATOM 0 HD23 LEU A 224 -10.426 -8.634 -0.306 1.00 0.61 H new ATOM 392 N CYS A 225 -6.986 -7.312 3.283 1.00 0.38 N ATOM 393 CA CYS A 225 -6.050 -7.270 4.397 1.00 0.38 C ATOM 394 C CYS A 225 -5.130 -8.489 4.375 1.00 0.41 C ATOM 395 O CYS A 225 -3.965 -8.411 3.983 1.00 0.39 O ATOM 396 CB CYS A 225 -6.833 -7.240 5.711 1.00 0.43 C ATOM 397 SG CYS A 225 -8.083 -8.565 5.850 1.00 0.51 S ATOM 0 H CYS A 225 -7.967 -7.332 3.561 1.00 0.38 H new ATOM 0 HA CYS A 225 -5.436 -6.373 4.309 1.00 0.38 H new ATOM 0 HB2 CYS A 225 -6.133 -7.324 6.543 1.00 0.43 H new ATOM 0 HB3 CYS A 225 -7.328 -6.274 5.807 1.00 0.43 H new ATOM 0 HG CYS A 225 -9.115 -8.121 6.505 1.00 0.51 H new ATOM 402 N ASN A 226 -5.688 -9.604 4.807 1.00 0.47 N ATOM 403 CA ASN A 226 -4.995 -10.879 4.861 1.00 0.51 C ATOM 404 C ASN A 226 -5.996 -11.952 5.252 1.00 0.59 C ATOM 405 O ASN A 226 -5.943 -13.082 4.771 1.00 0.64 O ATOM 406 CB ASN A 226 -3.847 -10.842 5.876 1.00 0.51 C ATOM 407 CG ASN A 226 -2.806 -11.918 5.619 1.00 0.54 C ATOM 408 OD1 ASN A 226 -2.489 -12.237 4.470 1.00 0.63 O ATOM 409 ND2 ASN A 226 -2.265 -12.489 6.686 1.00 0.68 N ATOM 0 H ASN A 226 -6.652 -9.651 5.136 1.00 0.47 H new ATOM 0 HA ASN A 226 -4.566 -11.096 3.883 1.00 0.51 H new ATOM 0 HB2 ASN A 226 -3.369 -9.863 5.842 1.00 0.51 H new ATOM 0 HB3 ASN A 226 -4.251 -10.965 6.881 1.00 0.51 H new ATOM 0 HD21 ASN A 226 -1.561 -13.219 6.572 1.00 0.68 H new ATOM 0 HD22 ASN A 226 -2.552 -12.199 7.621 1.00 0.68 H new ATOM 416 N ALA A 227 -6.932 -11.570 6.117 1.00 0.61 N ATOM 417 CA ALA A 227 -7.966 -12.477 6.587 1.00 0.68 C ATOM 418 C ALA A 227 -9.081 -12.585 5.556 1.00 0.68 C ATOM 419 O ALA A 227 -9.428 -13.679 5.113 1.00 0.73 O ATOM 420 CB ALA A 227 -8.514 -12.004 7.928 1.00 0.70 C ATOM 0 H ALA A 227 -6.992 -10.630 6.507 1.00 0.61 H new ATOM 0 HA ALA A 227 -7.530 -13.466 6.725 1.00 0.68 H new ATOM 0 HB1 ALA A 227 -9.288 -12.692 8.268 1.00 0.70 H new ATOM 0 HB2 ALA A 227 -7.707 -11.974 8.660 1.00 0.70 H new ATOM 0 HB3 ALA A 227 -8.940 -11.007 7.816 1.00 0.70 H new ATOM 426 N CYS A 228 -9.626 -11.442 5.152 1.00 0.64 N ATOM 427 CA CYS A 228 -10.696 -11.423 4.167 1.00 0.65 C ATOM 428 C CYS A 228 -10.158 -11.768 2.779 1.00 0.64 C ATOM 429 O CYS A 228 -10.921 -12.070 1.864 1.00 0.69 O ATOM 430 CB CYS A 228 -11.372 -10.056 4.145 1.00 0.62 C ATOM 431 SG CYS A 228 -11.586 -9.297 5.789 1.00 0.62 S ATOM 0 H CYS A 228 -9.344 -10.522 5.491 1.00 0.64 H new ATOM 0 HA CYS A 228 -11.433 -12.175 4.448 1.00 0.65 H new ATOM 0 HB2 CYS A 228 -10.784 -9.383 3.521 1.00 0.62 H new ATOM 0 HB3 CYS A 228 -12.350 -10.155 3.674 1.00 0.62 H new ATOM 0 HG CYS A 228 -11.218 -8.051 5.743 1.00 0.62 H new ATOM 436 N GLY A 229 -8.841 -11.721 2.637 1.00 0.61 N ATOM 437 CA GLY A 229 -8.216 -12.035 1.367 1.00 0.63 C ATOM 438 C GLY A 229 -8.413 -13.483 0.975 1.00 0.69 C ATOM 439 O GLY A 229 -8.383 -13.828 -0.207 1.00 0.70 O ATOM 0 H GLY A 229 -8.191 -11.470 3.382 1.00 0.61 H new ATOM 0 HA2 GLY A 229 -8.630 -11.391 0.591 1.00 0.63 H new ATOM 0 HA3 GLY A 229 -7.149 -11.818 1.426 1.00 0.63 H new ATOM 443 N LEU A 230 -8.636 -14.329 1.969 1.00 0.74 N ATOM 444 CA LEU A 230 -8.837 -15.753 1.738 1.00 0.82 C ATOM 445 C LEU A 230 -10.214 -16.023 1.136 1.00 0.83 C ATOM 446 O LEU A 230 -10.466 -17.101 0.602 1.00 0.90 O ATOM 447 CB LEU A 230 -8.671 -16.522 3.049 1.00 0.90 C ATOM 448 CG LEU A 230 -7.306 -16.364 3.724 1.00 0.95 C ATOM 449 CD1 LEU A 230 -7.332 -16.941 5.131 1.00 1.09 C ATOM 450 CD2 LEU A 230 -6.220 -17.040 2.902 1.00 0.98 C ATOM 0 H LEU A 230 -8.683 -14.053 2.950 1.00 0.74 H new ATOM 0 HA LEU A 230 -8.086 -16.094 1.025 1.00 0.82 H new ATOM 0 HB2 LEU A 230 -9.444 -16.195 3.745 1.00 0.90 H new ATOM 0 HB3 LEU A 230 -8.844 -17.581 2.856 1.00 0.90 H new ATOM 0 HG LEU A 230 -7.083 -15.299 3.789 1.00 0.95 H new ATOM 0 HD11 LEU A 230 -6.352 -16.818 5.593 1.00 1.09 H new ATOM 0 HD12 LEU A 230 -8.081 -16.418 5.725 1.00 1.09 H new ATOM 0 HD13 LEU A 230 -7.581 -18.001 5.085 1.00 1.09 H new ATOM 0 HD21 LEU A 230 -5.258 -16.916 3.399 1.00 0.98 H new ATOM 0 HD22 LEU A 230 -6.445 -18.102 2.806 1.00 0.98 H new ATOM 0 HD23 LEU A 230 -6.178 -16.587 1.912 1.00 0.98 H new ATOM 462 N TYR A 231 -11.088 -15.027 1.194 1.00 0.79 N ATOM 463 CA TYR A 231 -12.446 -15.154 0.663 1.00 0.82 C ATOM 464 C TYR A 231 -12.422 -15.326 -0.857 1.00 0.80 C ATOM 465 O TYR A 231 -13.175 -16.124 -1.421 1.00 0.85 O ATOM 466 CB TYR A 231 -13.264 -13.917 1.035 1.00 0.79 C ATOM 467 CG TYR A 231 -14.751 -14.167 1.152 1.00 0.90 C ATOM 468 CD1 TYR A 231 -15.257 -15.011 2.134 1.00 1.04 C ATOM 469 CD2 TYR A 231 -15.651 -13.551 0.292 1.00 0.96 C ATOM 470 CE1 TYR A 231 -16.613 -15.236 2.253 1.00 1.19 C ATOM 471 CE2 TYR A 231 -17.010 -13.772 0.404 1.00 1.11 C ATOM 472 CZ TYR A 231 -17.487 -14.614 1.388 1.00 1.20 C ATOM 473 OH TYR A 231 -18.841 -14.837 1.507 1.00 1.38 O ATOM 0 H TYR A 231 -10.883 -14.116 1.605 1.00 0.79 H new ATOM 0 HA TYR A 231 -12.908 -16.039 1.101 1.00 0.82 H new ATOM 0 HB2 TYR A 231 -12.897 -13.525 1.984 1.00 0.79 H new ATOM 0 HB3 TYR A 231 -13.095 -13.145 0.285 1.00 0.79 H new ATOM 0 HD1 TYR A 231 -14.577 -15.499 2.816 1.00 1.04 H new ATOM 0 HD2 TYR A 231 -15.282 -12.888 -0.477 1.00 0.96 H new ATOM 0 HE1 TYR A 231 -16.988 -15.897 3.021 1.00 1.19 H new ATOM 0 HE2 TYR A 231 -17.696 -13.288 -0.275 1.00 1.11 H new ATOM 0 HH TYR A 231 -19.332 -14.096 1.095 1.00 1.38 H new ATOM 483 N HIS A 232 -11.525 -14.597 -1.509 1.00 0.74 N ATOM 484 CA HIS A 232 -11.393 -14.648 -2.965 1.00 0.73 C ATOM 485 C HIS A 232 -10.515 -15.827 -3.396 1.00 0.75 C ATOM 486 O HIS A 232 -10.293 -16.047 -4.584 1.00 0.77 O ATOM 487 CB HIS A 232 -10.792 -13.332 -3.490 1.00 0.73 C ATOM 488 CG HIS A 232 -11.155 -13.012 -4.914 1.00 0.73 C ATOM 489 ND1 HIS A 232 -10.626 -13.677 -6.002 1.00 0.95 N ATOM 490 CD2 HIS A 232 -11.991 -12.079 -5.424 1.00 0.74 C ATOM 491 CE1 HIS A 232 -11.122 -13.164 -7.112 1.00 0.95 C ATOM 492 NE2 HIS A 232 -11.953 -12.196 -6.790 1.00 0.78 N ATOM 0 H HIS A 232 -10.873 -13.959 -1.052 1.00 0.74 H new ATOM 0 HA HIS A 232 -12.388 -14.785 -3.390 1.00 0.73 H new ATOM 0 HB2 HIS A 232 -11.123 -12.514 -2.850 1.00 0.73 H new ATOM 0 HB3 HIS A 232 -9.706 -13.383 -3.406 1.00 0.73 H new ATOM 0 HD1 HIS A 232 -9.956 -14.445 -5.955 1.00 0.95 H new ATOM 0 HD2 HIS A 232 -12.580 -11.372 -4.859 1.00 0.74 H new ATOM 0 HE1 HIS A 232 -10.886 -13.485 -8.116 1.00 0.95 H new ATOM 501 N LYS A 233 -10.023 -16.594 -2.431 1.00 0.80 N ATOM 502 CA LYS A 233 -9.162 -17.727 -2.742 1.00 0.84 C ATOM 503 C LYS A 233 -9.775 -19.053 -2.298 1.00 0.87 C ATOM 504 O LYS A 233 -10.010 -19.941 -3.118 1.00 0.94 O ATOM 505 CB LYS A 233 -7.791 -17.537 -2.089 1.00 0.85 C ATOM 506 CG LYS A 233 -6.663 -17.334 -3.092 1.00 0.83 C ATOM 507 CD LYS A 233 -6.404 -18.596 -3.900 1.00 0.94 C ATOM 508 CE LYS A 233 -5.694 -18.290 -5.209 1.00 1.08 C ATOM 509 NZ LYS A 233 -5.795 -19.420 -6.170 1.00 1.28 N ATOM 0 H LYS A 233 -10.203 -16.454 -1.437 1.00 0.80 H new ATOM 0 HA LYS A 233 -9.049 -17.766 -3.825 1.00 0.84 H new ATOM 0 HB2 LYS A 233 -7.832 -16.677 -1.421 1.00 0.85 H new ATOM 0 HB3 LYS A 233 -7.567 -18.408 -1.473 1.00 0.85 H new ATOM 0 HG2 LYS A 233 -6.916 -16.515 -3.765 1.00 0.83 H new ATOM 0 HG3 LYS A 233 -5.754 -17.045 -2.565 1.00 0.83 H new ATOM 0 HD2 LYS A 233 -5.801 -19.287 -3.312 1.00 0.94 H new ATOM 0 HD3 LYS A 233 -7.350 -19.096 -4.107 1.00 0.94 H new ATOM 0 HE2 LYS A 233 -6.125 -17.394 -5.655 1.00 1.08 H new ATOM 0 HE3 LYS A 233 -4.644 -18.074 -5.011 1.00 1.08 H new ATOM 0 HZ1 LYS A 233 -5.299 -19.173 -7.050 1.00 1.28 H new ATOM 0 HZ2 LYS A 233 -5.361 -20.269 -5.754 1.00 1.28 H new ATOM 0 HZ3 LYS A 233 -6.796 -19.610 -6.379 1.00 1.28 H new ATOM 523 N MET A 234 -10.045 -19.175 -1.005 1.00 0.86 N ATOM 524 CA MET A 234 -10.608 -20.401 -0.448 1.00 0.91 C ATOM 525 C MET A 234 -12.061 -20.589 -0.872 1.00 0.99 C ATOM 526 O MET A 234 -12.434 -21.647 -1.379 1.00 1.09 O ATOM 527 CB MET A 234 -10.506 -20.382 1.078 1.00 0.88 C ATOM 528 CG MET A 234 -10.553 -21.765 1.710 1.00 0.92 C ATOM 529 SD MET A 234 -9.149 -22.796 1.229 1.00 1.07 S ATOM 530 CE MET A 234 -7.787 -21.894 1.969 1.00 1.14 C ATOM 0 H MET A 234 -9.883 -18.438 -0.319 1.00 0.86 H new ATOM 0 HA MET A 234 -10.032 -21.241 -0.837 1.00 0.91 H new ATOM 0 HB2 MET A 234 -9.576 -19.892 1.365 1.00 0.88 H new ATOM 0 HB3 MET A 234 -11.321 -19.780 1.481 1.00 0.88 H new ATOM 0 HG2 MET A 234 -10.570 -21.664 2.795 1.00 0.92 H new ATOM 0 HG3 MET A 234 -11.479 -22.261 1.421 1.00 0.92 H new ATOM 0 HE1 MET A 234 -6.921 -22.550 2.058 1.00 1.14 H new ATOM 0 HE2 MET A 234 -7.532 -21.040 1.341 1.00 1.14 H new ATOM 0 HE3 MET A 234 -8.078 -21.542 2.959 1.00 1.14 H new ATOM 540 N ASN A 235 -12.873 -19.559 -0.675 1.00 0.96 N ATOM 541 CA ASN A 235 -14.288 -19.631 -1.039 1.00 1.04 C ATOM 542 C ASN A 235 -14.482 -19.394 -2.531 1.00 1.06 C ATOM 543 O ASN A 235 -15.508 -19.767 -3.101 1.00 1.20 O ATOM 544 CB ASN A 235 -15.111 -18.616 -0.244 1.00 1.02 C ATOM 545 CG ASN A 235 -15.564 -19.158 1.099 1.00 1.15 C ATOM 546 OD1 ASN A 235 -14.814 -19.848 1.788 1.00 1.23 O ATOM 547 ND2 ASN A 235 -16.793 -18.850 1.476 1.00 1.25 N ATOM 0 H ASN A 235 -12.583 -18.669 -0.269 1.00 0.96 H new ATOM 0 HA ASN A 235 -14.637 -20.634 -0.795 1.00 1.04 H new ATOM 0 HB2 ASN A 235 -14.517 -17.715 -0.087 1.00 1.02 H new ATOM 0 HB3 ASN A 235 -15.984 -18.325 -0.828 1.00 1.02 H new ATOM 0 HD21 ASN A 235 -17.152 -19.188 2.369 1.00 1.25 H new ATOM 0 HD22 ASN A 235 -17.382 -18.275 0.874 1.00 1.25 H new ATOM 554 N GLY A 236 -13.493 -18.763 -3.155 1.00 0.94 N ATOM 555 CA GLY A 236 -13.567 -18.480 -4.576 1.00 0.98 C ATOM 556 C GLY A 236 -14.652 -17.475 -4.904 1.00 0.98 C ATOM 557 O GLY A 236 -15.243 -17.510 -5.984 1.00 1.09 O ATOM 0 H GLY A 236 -12.639 -18.442 -2.700 1.00 0.94 H new ATOM 0 HA2 GLY A 236 -12.605 -18.099 -4.919 1.00 0.98 H new ATOM 0 HA3 GLY A 236 -13.755 -19.406 -5.120 1.00 0.98 H new ATOM 561 N GLN A 237 -14.916 -16.584 -3.962 1.00 0.90 N ATOM 562 CA GLN A 237 -15.932 -15.561 -4.138 1.00 0.90 C ATOM 563 C GLN A 237 -15.283 -14.213 -4.425 1.00 0.84 C ATOM 564 O GLN A 237 -14.117 -14.155 -4.817 1.00 0.79 O ATOM 565 CB GLN A 237 -16.827 -15.490 -2.897 1.00 0.92 C ATOM 566 CG GLN A 237 -17.658 -16.747 -2.692 1.00 1.05 C ATOM 567 CD GLN A 237 -18.465 -16.726 -1.409 1.00 1.11 C ATOM 568 OE1 GLN A 237 -18.007 -17.186 -0.366 1.00 1.21 O ATOM 569 NE2 GLN A 237 -19.675 -16.198 -1.478 1.00 1.17 N ATOM 0 H GLN A 237 -14.437 -16.550 -3.062 1.00 0.90 H new ATOM 0 HA GLN A 237 -16.555 -15.822 -4.993 1.00 0.90 H new ATOM 0 HB2 GLN A 237 -16.206 -15.324 -2.017 1.00 0.92 H new ATOM 0 HB3 GLN A 237 -17.492 -14.631 -2.984 1.00 0.92 H new ATOM 0 HG2 GLN A 237 -18.335 -16.869 -3.538 1.00 1.05 H new ATOM 0 HG3 GLN A 237 -16.998 -17.614 -2.684 1.00 1.05 H new ATOM 0 HE21 GLN A 237 -20.019 -15.826 -2.363 1.00 1.17 H new ATOM 0 HE22 GLN A 237 -20.264 -16.162 -0.646 1.00 1.17 H new ATOM 578 N ASN A 238 -16.033 -13.139 -4.240 1.00 0.87 N ATOM 579 CA ASN A 238 -15.527 -11.794 -4.494 1.00 0.84 C ATOM 580 C ASN A 238 -14.902 -11.201 -3.234 1.00 0.84 C ATOM 581 O ASN A 238 -15.591 -11.163 -2.195 1.00 0.96 O ATOM 582 CB ASN A 238 -16.657 -10.889 -4.995 1.00 0.95 C ATOM 583 CG ASN A 238 -16.153 -9.577 -5.567 1.00 0.91 C ATOM 584 OD1 ASN A 238 -15.124 -9.526 -6.243 1.00 0.93 O ATOM 585 ND2 ASN A 238 -16.883 -8.502 -5.305 1.00 0.96 N ATOM 586 OXT ASN A 238 -13.728 -10.771 -3.299 1.00 0.80 O ATOM 0 H ASN A 238 -16.999 -13.170 -3.914 1.00 0.87 H new ATOM 0 HA ASN A 238 -14.756 -11.860 -5.262 1.00 0.84 H new ATOM 0 HB2 ASN A 238 -17.227 -11.417 -5.759 1.00 0.95 H new ATOM 0 HB3 ASN A 238 -17.342 -10.682 -4.172 1.00 0.95 H new ATOM 0 HD21 ASN A 238 -16.599 -7.592 -5.667 1.00 0.96 H new ATOM 0 HD22 ASN A 238 -17.729 -8.585 -4.741 1.00 0.96 H new ATOM 594 N GLY B 1 -30.860 14.746 -14.330 1.00 1.44 N ATOM 595 CA GLY B 1 -31.827 14.451 -13.244 1.00 1.42 C ATOM 596 C GLY B 1 -31.518 13.135 -12.561 1.00 1.36 C ATOM 597 O GLY B 1 -30.634 12.404 -13.007 1.00 1.36 O ATOM 0 H1 GLY B 1 -30.357 15.631 -14.116 1.00 1.44 H new ATOM 0 H2 GLY B 1 -30.174 13.968 -14.405 1.00 1.44 H new ATOM 0 H3 GLY B 1 -31.370 14.847 -15.231 1.00 1.44 H new ATOM 0 HA2 GLY B 1 -31.806 15.256 -12.509 1.00 1.42 H new ATOM 0 HA3 GLY B 1 -32.836 14.420 -13.654 1.00 1.42 H new ATOM 603 N SER B 2 -32.257 12.831 -11.491 1.00 1.35 N ATOM 604 CA SER B 2 -32.059 11.599 -10.721 1.00 1.32 C ATOM 605 C SER B 2 -30.665 11.590 -10.072 1.00 1.29 C ATOM 606 O SER B 2 -29.991 12.623 -10.021 1.00 1.34 O ATOM 607 CB SER B 2 -32.261 10.366 -11.615 1.00 1.32 C ATOM 608 OG SER B 2 -33.465 10.469 -12.366 1.00 1.35 O ATOM 0 H SER B 2 -33.005 13.427 -11.135 1.00 1.35 H new ATOM 0 HA SER B 2 -32.803 11.562 -9.925 1.00 1.32 H new ATOM 0 HB2 SER B 2 -31.414 10.262 -12.293 1.00 1.32 H new ATOM 0 HB3 SER B 2 -32.289 9.467 -10.999 1.00 1.32 H new ATOM 0 HG SER B 2 -33.569 9.673 -12.928 1.00 1.35 H new ATOM 614 N LEU B 3 -30.243 10.441 -9.565 1.00 1.26 N ATOM 615 CA LEU B 3 -28.936 10.331 -8.933 1.00 1.24 C ATOM 616 C LEU B 3 -27.833 10.231 -9.985 1.00 1.23 C ATOM 617 O LEU B 3 -27.072 11.180 -10.177 1.00 1.22 O ATOM 618 CB LEU B 3 -28.890 9.116 -8.002 1.00 1.26 C ATOM 619 CG LEU B 3 -27.604 8.974 -7.183 1.00 1.27 C ATOM 620 CD1 LEU B 3 -27.497 10.080 -6.147 1.00 1.23 C ATOM 621 CD2 LEU B 3 -27.546 7.612 -6.512 1.00 1.39 C ATOM 0 H LEU B 3 -30.783 9.576 -9.578 1.00 1.26 H new ATOM 0 HA LEU B 3 -28.769 11.231 -8.341 1.00 1.24 H new ATOM 0 HB2 LEU B 3 -29.735 9.171 -7.316 1.00 1.26 H new ATOM 0 HB3 LEU B 3 -29.023 8.214 -8.600 1.00 1.26 H new ATOM 0 HG LEU B 3 -26.758 9.062 -7.864 1.00 1.27 H new ATOM 0 HD11 LEU B 3 -26.575 9.958 -5.578 1.00 1.23 H new ATOM 0 HD12 LEU B 3 -27.488 11.048 -6.648 1.00 1.23 H new ATOM 0 HD13 LEU B 3 -28.350 10.029 -5.471 1.00 1.23 H new ATOM 0 HD21 LEU B 3 -26.625 7.530 -5.935 1.00 1.39 H new ATOM 0 HD22 LEU B 3 -28.402 7.497 -5.848 1.00 1.39 H new ATOM 0 HD23 LEU B 3 -27.569 6.831 -7.272 1.00 1.39 H new ATOM 633 N LEU B 4 -27.762 9.080 -10.661 1.00 1.27 N ATOM 634 CA LEU B 4 -26.763 8.817 -11.709 1.00 1.29 C ATOM 635 C LEU B 4 -25.341 8.738 -11.142 1.00 1.24 C ATOM 636 O LEU B 4 -24.695 7.693 -11.209 1.00 1.22 O ATOM 637 CB LEU B 4 -26.832 9.879 -12.822 1.00 1.32 C ATOM 638 CG LEU B 4 -27.717 9.525 -14.026 1.00 1.42 C ATOM 639 CD1 LEU B 4 -27.219 8.256 -14.702 1.00 1.54 C ATOM 640 CD2 LEU B 4 -29.171 9.371 -13.603 1.00 1.42 C ATOM 0 H LEU B 4 -28.398 8.299 -10.498 1.00 1.27 H new ATOM 0 HA LEU B 4 -27.006 7.844 -12.137 1.00 1.29 H new ATOM 0 HB2 LEU B 4 -27.196 10.810 -12.388 1.00 1.32 H new ATOM 0 HB3 LEU B 4 -25.820 10.069 -13.181 1.00 1.32 H new ATOM 0 HG LEU B 4 -27.657 10.343 -14.743 1.00 1.42 H new ATOM 0 HD11 LEU B 4 -27.859 8.022 -15.553 1.00 1.54 H new ATOM 0 HD12 LEU B 4 -26.196 8.405 -15.048 1.00 1.54 H new ATOM 0 HD13 LEU B 4 -27.245 7.431 -13.991 1.00 1.54 H new ATOM 0 HD21 LEU B 4 -29.778 9.120 -14.473 1.00 1.42 H new ATOM 0 HD22 LEU B 4 -29.252 8.575 -12.862 1.00 1.42 H new ATOM 0 HD23 LEU B 4 -29.525 10.307 -13.171 1.00 1.42 H new ATOM 652 N LYS B 5 -24.856 9.845 -10.596 1.00 1.25 N ATOM 653 CA LYS B 5 -23.518 9.908 -10.023 1.00 1.22 C ATOM 654 C LYS B 5 -23.530 9.443 -8.571 1.00 1.16 C ATOM 655 O LYS B 5 -24.113 10.101 -7.709 1.00 1.27 O ATOM 656 CB LYS B 5 -22.974 11.339 -10.101 1.00 1.38 C ATOM 657 CG LYS B 5 -22.558 11.773 -11.499 1.00 1.49 C ATOM 658 CD LYS B 5 -21.308 11.042 -11.966 1.00 1.59 C ATOM 659 CE LYS B 5 -21.645 9.942 -12.957 1.00 1.88 C ATOM 660 NZ LYS B 5 -20.471 9.080 -13.247 1.00 2.01 N ATOM 0 H LYS B 5 -25.376 10.721 -10.538 1.00 1.25 H new ATOM 0 HA LYS B 5 -22.871 9.245 -10.598 1.00 1.22 H new ATOM 0 HB2 LYS B 5 -23.735 12.026 -9.731 1.00 1.38 H new ATOM 0 HB3 LYS B 5 -22.115 11.426 -9.435 1.00 1.38 H new ATOM 0 HG2 LYS B 5 -23.373 11.582 -12.197 1.00 1.49 H new ATOM 0 HG3 LYS B 5 -22.376 12.848 -11.507 1.00 1.49 H new ATOM 0 HD2 LYS B 5 -20.621 11.751 -12.428 1.00 1.59 H new ATOM 0 HD3 LYS B 5 -20.793 10.613 -11.106 1.00 1.59 H new ATOM 0 HE2 LYS B 5 -22.455 9.331 -12.559 1.00 1.88 H new ATOM 0 HE3 LYS B 5 -22.007 10.387 -13.884 1.00 1.88 H new ATOM 0 HZ1 LYS B 5 -20.742 8.342 -13.927 1.00 2.01 H new ATOM 0 HZ2 LYS B 5 -19.707 9.659 -13.650 1.00 2.01 H new ATOM 0 HZ3 LYS B 5 -20.141 8.635 -12.367 1.00 2.01 H new ATOM 674 N PRO B 6 -22.893 8.301 -8.279 1.00 1.02 N ATOM 675 CA PRO B 6 -22.826 7.766 -6.932 1.00 1.00 C ATOM 676 C PRO B 6 -21.674 8.377 -6.138 1.00 1.02 C ATOM 677 O PRO B 6 -20.696 7.702 -5.815 1.00 1.01 O ATOM 678 CB PRO B 6 -22.614 6.270 -7.154 1.00 0.90 C ATOM 679 CG PRO B 6 -21.979 6.140 -8.506 1.00 0.86 C ATOM 680 CD PRO B 6 -22.179 7.448 -9.241 1.00 0.95 C ATOM 0 HA PRO B 6 -23.719 7.988 -6.348 1.00 1.00 H new ATOM 0 HB2 PRO B 6 -21.974 5.847 -6.380 1.00 0.90 H new ATOM 0 HB3 PRO B 6 -23.561 5.731 -7.114 1.00 0.90 H new ATOM 0 HG2 PRO B 6 -20.917 5.915 -8.409 1.00 0.86 H new ATOM 0 HG3 PRO B 6 -22.429 5.317 -9.062 1.00 0.86 H new ATOM 0 HD2 PRO B 6 -21.226 7.890 -9.533 1.00 0.95 H new ATOM 0 HD3 PRO B 6 -22.758 7.307 -10.154 1.00 0.95 H new ATOM 688 N ALA B 7 -21.797 9.662 -5.835 1.00 1.11 N ATOM 689 CA ALA B 7 -20.774 10.382 -5.088 1.00 1.15 C ATOM 690 C ALA B 7 -20.871 10.079 -3.594 1.00 1.14 C ATOM 691 O ALA B 7 -21.117 10.970 -2.776 1.00 1.22 O ATOM 692 CB ALA B 7 -20.889 11.877 -5.346 1.00 1.26 C ATOM 0 H ALA B 7 -22.602 10.231 -6.097 1.00 1.11 H new ATOM 0 HA ALA B 7 -19.796 10.045 -5.432 1.00 1.15 H new ATOM 0 HB1 ALA B 7 -20.119 12.404 -4.782 1.00 1.26 H new ATOM 0 HB2 ALA B 7 -20.758 12.074 -6.410 1.00 1.26 H new ATOM 0 HB3 ALA B 7 -21.872 12.226 -5.031 1.00 1.26 H new ATOM 698 N ARG B 8 -20.689 8.812 -3.247 1.00 1.08 N ATOM 699 CA ARG B 8 -20.753 8.372 -1.860 1.00 1.08 C ATOM 700 C ARG B 8 -19.781 7.228 -1.625 1.00 1.01 C ATOM 701 O ARG B 8 -19.766 6.253 -2.372 1.00 1.02 O ATOM 702 CB ARG B 8 -22.173 7.920 -1.493 1.00 1.12 C ATOM 703 CG ARG B 8 -23.153 9.057 -1.256 1.00 1.21 C ATOM 704 CD ARG B 8 -22.713 9.945 -0.105 1.00 1.25 C ATOM 705 NE ARG B 8 -23.726 10.938 0.230 1.00 1.41 N ATOM 706 CZ ARG B 8 -23.812 12.141 -0.336 1.00 1.46 C ATOM 707 NH1 ARG B 8 -22.956 12.504 -1.289 1.00 1.66 N ATOM 708 NH2 ARG B 8 -24.767 12.974 0.043 1.00 1.61 N ATOM 0 H ARG B 8 -20.494 8.065 -3.914 1.00 1.08 H new ATOM 0 HA ARG B 8 -20.479 9.216 -1.227 1.00 1.08 H new ATOM 0 HB2 ARG B 8 -22.557 7.286 -2.292 1.00 1.12 H new ATOM 0 HB3 ARG B 8 -22.124 7.305 -0.594 1.00 1.12 H new ATOM 0 HG2 ARG B 8 -23.244 9.655 -2.163 1.00 1.21 H new ATOM 0 HG3 ARG B 8 -24.141 8.648 -1.044 1.00 1.21 H new ATOM 0 HD2 ARG B 8 -22.504 9.329 0.770 1.00 1.25 H new ATOM 0 HD3 ARG B 8 -21.783 10.449 -0.369 1.00 1.25 H new ATOM 0 HE ARG B 8 -24.413 10.696 0.944 1.00 1.41 H new ATOM 0 HH11 ARG B 8 -22.226 11.859 -1.592 1.00 1.66 H new ATOM 0 HH12 ARG B 8 -23.030 13.427 -1.716 1.00 1.66 H new ATOM 0 HH21 ARG B 8 -25.432 12.694 0.764 1.00 1.61 H new ATOM 0 HH22 ARG B 8 -24.839 13.897 -0.386 1.00 1.61 H new ATOM 722 N PHE B 9 -18.966 7.360 -0.592 1.00 0.97 N ATOM 723 CA PHE B 9 -18.000 6.327 -0.241 1.00 0.91 C ATOM 724 C PHE B 9 -18.178 5.941 1.222 1.00 0.91 C ATOM 725 O PHE B 9 -17.322 5.293 1.825 1.00 0.86 O ATOM 726 CB PHE B 9 -16.567 6.811 -0.500 1.00 0.88 C ATOM 727 CG PHE B 9 -16.287 8.201 0.005 1.00 0.93 C ATOM 728 CD1 PHE B 9 -16.057 8.436 1.352 1.00 0.91 C ATOM 729 CD2 PHE B 9 -16.252 9.274 -0.873 1.00 1.04 C ATOM 730 CE1 PHE B 9 -15.800 9.711 1.814 1.00 0.98 C ATOM 731 CE2 PHE B 9 -15.996 10.550 -0.417 1.00 1.11 C ATOM 732 CZ PHE B 9 -15.769 10.769 0.928 1.00 1.07 C ATOM 0 H PHE B 9 -18.953 8.175 0.022 1.00 0.97 H new ATOM 0 HA PHE B 9 -18.175 5.452 -0.866 1.00 0.91 H new ATOM 0 HB2 PHE B 9 -15.870 6.118 -0.029 1.00 0.88 H new ATOM 0 HB3 PHE B 9 -16.372 6.779 -1.572 1.00 0.88 H new ATOM 0 HD1 PHE B 9 -16.079 7.611 2.049 1.00 0.91 H new ATOM 0 HD2 PHE B 9 -16.427 9.108 -1.926 1.00 1.04 H new ATOM 0 HE1 PHE B 9 -15.624 9.880 2.866 1.00 0.98 H new ATOM 0 HE2 PHE B 9 -15.973 11.377 -1.111 1.00 1.11 H new ATOM 0 HZ PHE B 9 -15.567 11.768 1.286 1.00 1.07 H new ATOM 742 N MET B 10 -19.307 6.349 1.781 1.00 0.97 N ATOM 743 CA MET B 10 -19.626 6.078 3.171 1.00 0.98 C ATOM 744 C MET B 10 -21.122 5.855 3.330 1.00 1.04 C ATOM 745 O MET B 10 -21.926 6.689 2.911 1.00 1.11 O ATOM 746 CB MET B 10 -19.186 7.255 4.042 1.00 1.00 C ATOM 747 CG MET B 10 -19.654 7.167 5.486 1.00 1.02 C ATOM 748 SD MET B 10 -19.460 8.728 6.369 1.00 1.08 S ATOM 749 CE MET B 10 -20.395 8.394 7.861 1.00 1.12 C ATOM 0 H MET B 10 -20.025 6.876 1.284 1.00 0.97 H new ATOM 0 HA MET B 10 -19.097 5.178 3.486 1.00 0.98 H new ATOM 0 HB2 MET B 10 -18.098 7.318 4.027 1.00 1.00 H new ATOM 0 HB3 MET B 10 -19.564 8.179 3.604 1.00 1.00 H new ATOM 0 HG2 MET B 10 -20.702 6.868 5.508 1.00 1.02 H new ATOM 0 HG3 MET B 10 -19.090 6.389 6.001 1.00 1.02 H new ATOM 0 HE1 MET B 10 -20.368 9.269 8.511 1.00 1.12 H new ATOM 0 HE2 MET B 10 -21.429 8.167 7.600 1.00 1.12 H new ATOM 0 HE3 MET B 10 -19.957 7.542 8.382 1.00 1.12 H new ATOM 759 N CYS B 11 -21.493 4.731 3.920 1.00 1.04 N ATOM 760 CA CYS B 11 -22.889 4.421 4.135 1.00 1.11 C ATOM 761 C CYS B 11 -23.361 4.969 5.469 1.00 1.17 C ATOM 762 O CYS B 11 -22.573 5.136 6.401 1.00 1.16 O ATOM 763 CB CYS B 11 -23.102 2.915 4.098 1.00 1.10 C ATOM 764 SG CYS B 11 -22.007 2.051 2.936 1.00 1.02 S ATOM 0 H CYS B 11 -20.844 4.020 4.257 1.00 1.04 H new ATOM 0 HA CYS B 11 -23.469 4.888 3.339 1.00 1.11 H new ATOM 0 HB2 CYS B 11 -22.947 2.510 5.098 1.00 1.10 H new ATOM 0 HB3 CYS B 11 -24.138 2.710 3.828 1.00 1.10 H new ATOM 0 HG CYS B 11 -21.363 1.112 3.563 1.00 1.02 H new ATOM 769 N LEU B 12 -24.651 5.237 5.549 1.00 1.24 N ATOM 770 CA LEU B 12 -25.255 5.754 6.764 1.00 1.32 C ATOM 771 C LEU B 12 -25.350 4.667 7.846 1.00 1.31 C ATOM 772 O LEU B 12 -25.024 4.932 9.003 1.00 1.34 O ATOM 773 CB LEU B 12 -26.636 6.357 6.472 1.00 1.42 C ATOM 774 CG LEU B 12 -26.624 7.803 5.956 1.00 1.51 C ATOM 775 CD1 LEU B 12 -26.014 7.884 4.561 1.00 1.49 C ATOM 776 CD2 LEU B 12 -28.031 8.377 5.945 1.00 1.64 C ATOM 0 H LEU B 12 -25.307 5.104 4.779 1.00 1.24 H new ATOM 0 HA LEU B 12 -24.611 6.546 7.145 1.00 1.32 H new ATOM 0 HB2 LEU B 12 -27.140 5.730 5.736 1.00 1.42 H new ATOM 0 HB3 LEU B 12 -27.231 6.319 7.384 1.00 1.42 H new ATOM 0 HG LEU B 12 -26.007 8.394 6.633 1.00 1.51 H new ATOM 0 HD11 LEU B 12 -26.019 8.920 4.221 1.00 1.49 H new ATOM 0 HD12 LEU B 12 -24.988 7.517 4.591 1.00 1.49 H new ATOM 0 HD13 LEU B 12 -26.598 7.274 3.872 1.00 1.49 H new ATOM 0 HD21 LEU B 12 -28.003 9.402 5.576 1.00 1.64 H new ATOM 0 HD22 LEU B 12 -28.665 7.775 5.294 1.00 1.64 H new ATOM 0 HD23 LEU B 12 -28.436 8.366 6.957 1.00 1.64 H new ATOM 788 N PRO B 13 -25.808 3.431 7.513 1.00 1.30 N ATOM 789 CA PRO B 13 -25.900 2.349 8.500 1.00 1.30 C ATOM 790 C PRO B 13 -24.525 1.850 8.949 1.00 1.22 C ATOM 791 O PRO B 13 -24.326 1.528 10.124 1.00 1.28 O ATOM 792 CB PRO B 13 -26.655 1.230 7.765 1.00 1.31 C ATOM 793 CG PRO B 13 -27.240 1.872 6.555 1.00 1.34 C ATOM 794 CD PRO B 13 -26.304 2.986 6.196 1.00 1.29 C ATOM 0 HA PRO B 13 -26.399 2.685 9.409 1.00 1.30 H new ATOM 0 HB2 PRO B 13 -25.982 0.417 7.491 1.00 1.31 H new ATOM 0 HB3 PRO B 13 -27.433 0.801 8.397 1.00 1.31 H new ATOM 0 HG2 PRO B 13 -27.330 1.157 5.737 1.00 1.34 H new ATOM 0 HG3 PRO B 13 -28.241 2.252 6.758 1.00 1.34 H new ATOM 0 HD2 PRO B 13 -25.494 2.642 5.553 1.00 1.29 H new ATOM 0 HD3 PRO B 13 -26.815 3.788 5.664 1.00 1.29 H new ATOM 802 N CYS B 14 -23.583 1.778 8.008 1.00 1.09 N ATOM 803 CA CYS B 14 -22.234 1.320 8.307 1.00 1.00 C ATOM 804 C CYS B 14 -21.473 2.374 9.106 1.00 1.04 C ATOM 805 O CYS B 14 -20.869 2.070 10.136 1.00 1.06 O ATOM 806 CB CYS B 14 -21.495 0.995 7.005 1.00 0.92 C ATOM 807 SG CYS B 14 -22.364 -0.231 5.974 1.00 1.03 S ATOM 0 H CYS B 14 -23.734 2.032 7.032 1.00 1.09 H new ATOM 0 HA CYS B 14 -22.296 0.416 8.913 1.00 1.00 H new ATOM 0 HB2 CYS B 14 -21.361 1.913 6.432 1.00 0.92 H new ATOM 0 HB3 CYS B 14 -20.500 0.620 7.243 1.00 0.92 H new ATOM 0 HG CYS B 14 -21.618 -0.551 4.959 1.00 1.03 H new ATOM 812 N GLY B 15 -21.508 3.610 8.623 1.00 1.07 N ATOM 813 CA GLY B 15 -20.822 4.695 9.303 1.00 1.11 C ATOM 814 C GLY B 15 -19.332 4.699 9.023 1.00 1.01 C ATOM 815 O GLY B 15 -18.604 5.571 9.497 1.00 1.04 O ATOM 0 H GLY B 15 -22.000 3.882 7.772 1.00 1.07 H new ATOM 0 HA2 GLY B 15 -21.251 5.647 8.989 1.00 1.11 H new ATOM 0 HA3 GLY B 15 -20.987 4.610 10.377 1.00 1.11 H new ATOM 819 N ILE B 16 -18.880 3.722 8.253 1.00 0.95 N ATOM 820 CA ILE B 16 -17.472 3.604 7.915 1.00 0.87 C ATOM 821 C ILE B 16 -17.188 4.274 6.578 1.00 0.83 C ATOM 822 O ILE B 16 -17.742 3.884 5.549 1.00 0.84 O ATOM 823 CB ILE B 16 -17.035 2.125 7.858 1.00 0.85 C ATOM 824 CG1 ILE B 16 -17.401 1.422 9.168 1.00 0.94 C ATOM 825 CG2 ILE B 16 -15.538 2.016 7.591 1.00 0.77 C ATOM 826 CD1 ILE B 16 -17.261 -0.082 9.112 1.00 1.06 C ATOM 0 H ILE B 16 -19.472 2.996 7.849 1.00 0.95 H new ATOM 0 HA ILE B 16 -16.900 4.104 8.697 1.00 0.87 H new ATOM 0 HB ILE B 16 -17.561 1.636 7.038 1.00 0.85 H new ATOM 0 HG12 ILE B 16 -16.766 1.807 9.966 1.00 0.94 H new ATOM 0 HG13 ILE B 16 -18.429 1.673 9.429 1.00 0.94 H new ATOM 0 HG21 ILE B 16 -15.250 0.965 7.555 1.00 0.77 H new ATOM 0 HG22 ILE B 16 -15.303 2.490 6.638 1.00 0.77 H new ATOM 0 HG23 ILE B 16 -14.989 2.515 8.389 1.00 0.77 H new ATOM 0 HD11 ILE B 16 -17.538 -0.509 10.076 1.00 1.06 H new ATOM 0 HD12 ILE B 16 -17.916 -0.480 8.337 1.00 1.06 H new ATOM 0 HD13 ILE B 16 -16.228 -0.343 8.882 1.00 1.06 H new ATOM 838 N ALA B 17 -16.335 5.289 6.604 1.00 0.84 N ATOM 839 CA ALA B 17 -15.978 6.020 5.399 1.00 0.83 C ATOM 840 C ALA B 17 -14.783 5.387 4.700 1.00 0.75 C ATOM 841 O ALA B 17 -13.720 5.208 5.297 1.00 0.76 O ATOM 842 CB ALA B 17 -15.687 7.474 5.733 1.00 0.89 C ATOM 0 H ALA B 17 -15.876 5.625 7.451 1.00 0.84 H new ATOM 0 HA ALA B 17 -16.826 5.976 4.715 1.00 0.83 H new ATOM 0 HB1 ALA B 17 -15.421 8.010 4.822 1.00 0.89 H new ATOM 0 HB2 ALA B 17 -16.572 7.930 6.177 1.00 0.89 H new ATOM 0 HB3 ALA B 17 -14.859 7.526 6.440 1.00 0.89 H new ATOM 848 N PHE B 18 -14.967 5.052 3.433 1.00 0.70 N ATOM 849 CA PHE B 18 -13.913 4.441 2.641 1.00 0.63 C ATOM 850 C PHE B 18 -13.150 5.507 1.868 1.00 0.64 C ATOM 851 O PHE B 18 -13.423 6.700 2.002 1.00 0.72 O ATOM 852 CB PHE B 18 -14.502 3.400 1.685 1.00 0.59 C ATOM 853 CG PHE B 18 -14.545 2.013 2.268 1.00 0.56 C ATOM 854 CD1 PHE B 18 -14.730 1.820 3.631 1.00 0.60 C ATOM 855 CD2 PHE B 18 -14.386 0.901 1.457 1.00 0.52 C ATOM 856 CE1 PHE B 18 -14.758 0.547 4.168 1.00 0.60 C ATOM 857 CE2 PHE B 18 -14.410 -0.372 1.990 1.00 0.53 C ATOM 858 CZ PHE B 18 -14.597 -0.550 3.346 1.00 0.56 C ATOM 0 H PHE B 18 -15.842 5.194 2.929 1.00 0.70 H new ATOM 0 HA PHE B 18 -13.217 3.937 3.312 1.00 0.63 H new ATOM 0 HB2 PHE B 18 -15.512 3.702 1.408 1.00 0.59 H new ATOM 0 HB3 PHE B 18 -13.912 3.383 0.769 1.00 0.59 H new ATOM 0 HD1 PHE B 18 -14.853 2.675 4.279 1.00 0.60 H new ATOM 0 HD2 PHE B 18 -14.242 1.032 0.395 1.00 0.52 H new ATOM 0 HE1 PHE B 18 -14.906 0.411 5.229 1.00 0.60 H new ATOM 0 HE2 PHE B 18 -14.282 -1.229 1.346 1.00 0.53 H new ATOM 0 HZ PHE B 18 -14.617 -1.546 3.763 1.00 0.56 H new ATOM 868 N SER B 19 -12.186 5.080 1.074 1.00 0.59 N ATOM 869 CA SER B 19 -11.386 6.008 0.290 1.00 0.60 C ATOM 870 C SER B 19 -11.174 5.491 -1.130 1.00 0.57 C ATOM 871 O SER B 19 -11.019 6.278 -2.066 1.00 0.60 O ATOM 872 CB SER B 19 -10.045 6.249 0.988 1.00 0.60 C ATOM 873 OG SER B 19 -10.248 6.675 2.328 1.00 0.68 O ATOM 0 H SER B 19 -11.937 4.098 0.954 1.00 0.59 H new ATOM 0 HA SER B 19 -11.923 6.954 0.216 1.00 0.60 H new ATOM 0 HB2 SER B 19 -9.454 5.333 0.977 1.00 0.60 H new ATOM 0 HB3 SER B 19 -9.476 7.002 0.444 1.00 0.60 H new ATOM 0 HG SER B 19 -9.380 6.823 2.759 1.00 0.68 H new ATOM 879 N SER B 20 -11.175 4.177 -1.287 1.00 0.52 N ATOM 880 CA SER B 20 -10.989 3.570 -2.591 1.00 0.51 C ATOM 881 C SER B 20 -12.308 2.977 -3.098 1.00 0.52 C ATOM 882 O SER B 20 -13.033 2.317 -2.352 1.00 0.54 O ATOM 883 CB SER B 20 -9.903 2.493 -2.508 1.00 0.45 C ATOM 884 OG SER B 20 -8.822 2.919 -1.689 1.00 0.44 O ATOM 0 H SER B 20 -11.303 3.511 -0.525 1.00 0.52 H new ATOM 0 HA SER B 20 -10.670 4.334 -3.300 1.00 0.51 H new ATOM 0 HB2 SER B 20 -10.328 1.574 -2.105 1.00 0.45 H new ATOM 0 HB3 SER B 20 -9.537 2.263 -3.509 1.00 0.45 H new ATOM 0 HG SER B 20 -9.053 2.784 -0.746 1.00 0.44 H new ATOM 890 N PRO B 21 -12.649 3.218 -4.373 1.00 0.54 N ATOM 891 CA PRO B 21 -13.885 2.696 -4.965 1.00 0.56 C ATOM 892 C PRO B 21 -13.838 1.181 -5.153 1.00 0.52 C ATOM 893 O PRO B 21 -14.869 0.505 -5.145 1.00 0.54 O ATOM 894 CB PRO B 21 -13.959 3.403 -6.321 1.00 0.62 C ATOM 895 CG PRO B 21 -12.547 3.754 -6.647 1.00 0.61 C ATOM 896 CD PRO B 21 -11.869 4.022 -5.333 1.00 0.58 C ATOM 0 HA PRO B 21 -14.752 2.879 -4.330 1.00 0.56 H new ATOM 0 HB2 PRO B 21 -14.391 2.753 -7.082 1.00 0.62 H new ATOM 0 HB3 PRO B 21 -14.586 4.293 -6.269 1.00 0.62 H new ATOM 0 HG2 PRO B 21 -12.056 2.939 -7.180 1.00 0.61 H new ATOM 0 HG3 PRO B 21 -12.503 4.630 -7.294 1.00 0.61 H new ATOM 0 HD2 PRO B 21 -10.822 3.720 -5.352 1.00 0.58 H new ATOM 0 HD3 PRO B 21 -11.890 5.082 -5.079 1.00 0.58 H new ATOM 904 N SER B 22 -12.629 0.653 -5.306 1.00 0.49 N ATOM 905 CA SER B 22 -12.422 -0.773 -5.501 1.00 0.47 C ATOM 906 C SER B 22 -12.763 -1.562 -4.236 1.00 0.46 C ATOM 907 O SER B 22 -13.240 -2.696 -4.308 1.00 0.48 O ATOM 908 CB SER B 22 -10.971 -1.016 -5.910 1.00 0.47 C ATOM 909 OG SER B 22 -10.487 0.074 -6.679 1.00 0.48 O ATOM 0 H SER B 22 -11.769 1.201 -5.298 1.00 0.49 H new ATOM 0 HA SER B 22 -13.088 -1.121 -6.291 1.00 0.47 H new ATOM 0 HB2 SER B 22 -10.353 -1.146 -5.022 1.00 0.47 H new ATOM 0 HB3 SER B 22 -10.898 -1.938 -6.487 1.00 0.47 H new ATOM 0 HG SER B 22 -9.555 -0.093 -6.933 1.00 0.48 H new ATOM 915 N THR B 23 -12.524 -0.956 -3.082 1.00 0.45 N ATOM 916 CA THR B 23 -12.813 -1.596 -1.812 1.00 0.46 C ATOM 917 C THR B 23 -14.298 -1.487 -1.487 1.00 0.51 C ATOM 918 O THR B 23 -14.891 -2.391 -0.892 1.00 0.54 O ATOM 919 CB THR B 23 -11.984 -0.962 -0.681 1.00 0.44 C ATOM 920 OG1 THR B 23 -11.486 0.311 -1.101 1.00 0.56 O ATOM 921 CG2 THR B 23 -10.825 -1.860 -0.297 1.00 0.41 C ATOM 0 H THR B 23 -12.129 -0.019 -3.002 1.00 0.45 H new ATOM 0 HA THR B 23 -12.544 -2.649 -1.895 1.00 0.46 H new ATOM 0 HB THR B 23 -12.628 -0.834 0.189 1.00 0.44 H new ATOM 0 HG1 THR B 23 -11.496 0.932 -0.343 1.00 0.56 H new ATOM 0 HG21 THR B 23 -10.252 -1.393 0.504 1.00 0.41 H new ATOM 0 HG22 THR B 23 -11.208 -2.822 0.044 1.00 0.41 H new ATOM 0 HG23 THR B 23 -10.180 -2.012 -1.163 1.00 0.41 H new ATOM 929 N LEU B 24 -14.897 -0.375 -1.908 1.00 0.53 N ATOM 930 CA LEU B 24 -16.313 -0.121 -1.675 1.00 0.59 C ATOM 931 C LEU B 24 -17.181 -1.129 -2.424 1.00 0.60 C ATOM 932 O LEU B 24 -18.299 -1.430 -1.999 1.00 0.65 O ATOM 933 CB LEU B 24 -16.675 1.300 -2.110 1.00 0.61 C ATOM 934 CG LEU B 24 -18.069 1.774 -1.693 1.00 0.66 C ATOM 935 CD1 LEU B 24 -18.127 2.011 -0.193 1.00 0.70 C ATOM 936 CD2 LEU B 24 -18.449 3.036 -2.449 1.00 0.69 C ATOM 0 H LEU B 24 -14.417 0.368 -2.416 1.00 0.53 H new ATOM 0 HA LEU B 24 -16.503 -0.229 -0.607 1.00 0.59 H new ATOM 0 HB2 LEU B 24 -15.937 1.988 -1.698 1.00 0.61 H new ATOM 0 HB3 LEU B 24 -16.598 1.361 -3.196 1.00 0.61 H new ATOM 0 HG LEU B 24 -18.787 0.993 -1.943 1.00 0.66 H new ATOM 0 HD11 LEU B 24 -19.126 2.348 0.084 1.00 0.70 H new ATOM 0 HD12 LEU B 24 -17.898 1.083 0.331 1.00 0.70 H new ATOM 0 HD13 LEU B 24 -17.398 2.773 0.083 1.00 0.70 H new ATOM 0 HD21 LEU B 24 -19.443 3.360 -2.141 1.00 0.69 H new ATOM 0 HD22 LEU B 24 -17.727 3.823 -2.230 1.00 0.69 H new ATOM 0 HD23 LEU B 24 -18.450 2.832 -3.520 1.00 0.69 H new ATOM 948 N GLU B 25 -16.653 -1.649 -3.530 1.00 0.58 N ATOM 949 CA GLU B 25 -17.366 -2.627 -4.353 1.00 0.60 C ATOM 950 C GLU B 25 -17.786 -3.843 -3.531 1.00 0.60 C ATOM 951 O GLU B 25 -18.970 -4.157 -3.432 1.00 0.62 O ATOM 952 CB GLU B 25 -16.487 -3.066 -5.527 1.00 0.60 C ATOM 953 CG GLU B 25 -17.230 -3.885 -6.568 1.00 0.63 C ATOM 954 CD GLU B 25 -16.730 -5.315 -6.663 1.00 0.83 C ATOM 955 OE1 GLU B 25 -15.932 -5.739 -5.801 1.00 1.15 O ATOM 956 OE2 GLU B 25 -17.138 -6.025 -7.605 1.00 1.25 O ATOM 0 H GLU B 25 -15.726 -1.407 -3.880 1.00 0.58 H new ATOM 0 HA GLU B 25 -18.268 -2.151 -4.736 1.00 0.60 H new ATOM 0 HB2 GLU B 25 -16.065 -2.182 -6.005 1.00 0.60 H new ATOM 0 HB3 GLU B 25 -15.651 -3.651 -5.145 1.00 0.60 H new ATOM 0 HG2 GLU B 25 -18.293 -3.893 -6.326 1.00 0.63 H new ATOM 0 HG3 GLU B 25 -17.128 -3.405 -7.541 1.00 0.63 H new ATOM 963 N ALA B 26 -16.812 -4.515 -2.937 1.00 0.61 N ATOM 964 CA ALA B 26 -17.087 -5.692 -2.127 1.00 0.64 C ATOM 965 C ALA B 26 -17.761 -5.291 -0.823 1.00 0.67 C ATOM 966 O ALA B 26 -18.517 -6.069 -0.232 1.00 0.72 O ATOM 967 CB ALA B 26 -15.806 -6.459 -1.861 1.00 0.66 C ATOM 0 H ALA B 26 -15.825 -4.266 -3.000 1.00 0.61 H new ATOM 0 HA ALA B 26 -17.767 -6.344 -2.675 1.00 0.64 H new ATOM 0 HB1 ALA B 26 -16.027 -7.337 -1.254 1.00 0.66 H new ATOM 0 HB2 ALA B 26 -15.367 -6.774 -2.808 1.00 0.66 H new ATOM 0 HB3 ALA B 26 -15.102 -5.818 -1.330 1.00 0.66 H new ATOM 973 N HIS B 27 -17.484 -4.069 -0.376 1.00 0.67 N ATOM 974 CA HIS B 27 -18.088 -3.562 0.842 1.00 0.71 C ATOM 975 C HIS B 27 -19.605 -3.524 0.671 1.00 0.75 C ATOM 976 O HIS B 27 -20.347 -3.988 1.534 1.00 0.80 O ATOM 977 CB HIS B 27 -17.541 -2.159 1.199 1.00 0.71 C ATOM 978 CG HIS B 27 -18.319 -1.438 2.275 1.00 0.76 C ATOM 979 ND1 HIS B 27 -17.775 -1.005 3.480 1.00 0.78 N ATOM 980 CD2 HIS B 27 -19.627 -1.126 2.333 1.00 0.81 C ATOM 981 CE1 HIS B 27 -18.740 -0.455 4.218 1.00 0.84 C ATOM 982 NE2 HIS B 27 -19.850 -0.534 3.525 1.00 0.85 N ATOM 0 H HIS B 27 -16.849 -3.419 -0.839 1.00 0.67 H new ATOM 0 HA HIS B 27 -17.832 -4.228 1.666 1.00 0.71 H new ATOM 0 HB2 HIS B 27 -16.505 -2.258 1.522 1.00 0.71 H new ATOM 0 HB3 HIS B 27 -17.536 -1.545 0.298 1.00 0.71 H new ATOM 0 HD1 HIS B 27 -16.797 -1.094 3.755 1.00 0.78 H new ATOM 0 HD2 HIS B 27 -20.363 -1.315 1.566 1.00 0.81 H new ATOM 0 HE1 HIS B 27 -18.628 -0.025 5.202 1.00 0.84 H new ATOM 990 N GLN B 28 -20.057 -2.986 -0.454 1.00 0.75 N ATOM 991 CA GLN B 28 -21.485 -2.863 -0.735 1.00 0.81 C ATOM 992 C GLN B 28 -22.100 -4.203 -1.129 1.00 0.81 C ATOM 993 O GLN B 28 -23.025 -4.258 -1.939 1.00 0.85 O ATOM 994 CB GLN B 28 -21.718 -1.834 -1.843 1.00 0.83 C ATOM 995 CG GLN B 28 -22.539 -0.634 -1.393 1.00 1.08 C ATOM 996 CD GLN B 28 -23.809 -0.439 -2.205 1.00 1.25 C ATOM 997 OE1 GLN B 28 -24.359 -1.523 -2.733 1.00 1.36 O flip ATOM 998 NE2 GLN B 28 -24.300 0.682 -2.346 1.00 1.57 N flip ATOM 0 H GLN B 28 -19.453 -2.625 -1.192 1.00 0.75 H new ATOM 0 HA GLN B 28 -21.974 -2.528 0.180 1.00 0.81 H new ATOM 0 HB2 GLN B 28 -20.754 -1.486 -2.214 1.00 0.83 H new ATOM 0 HB3 GLN B 28 -22.225 -2.319 -2.678 1.00 0.83 H new ATOM 0 HG2 GLN B 28 -22.802 -0.756 -0.342 1.00 1.08 H new ATOM 0 HG3 GLN B 28 -21.927 0.265 -1.466 1.00 1.08 H new ATOM 0 HE21 GLN B 28 -23.848 1.493 -1.925 1.00 1.57 H new ATOM 0 HE22 GLN B 28 -25.159 0.799 -2.884 1.00 1.57 H new ATOM 1007 N ALA B 29 -21.590 -5.269 -0.535 1.00 0.81 N ATOM 1008 CA ALA B 29 -22.074 -6.608 -0.798 1.00 0.83 C ATOM 1009 C ALA B 29 -22.005 -7.461 0.460 1.00 0.87 C ATOM 1010 O ALA B 29 -22.993 -8.080 0.858 1.00 0.90 O ATOM 1011 CB ALA B 29 -21.268 -7.254 -1.916 1.00 0.83 C ATOM 0 H ALA B 29 -20.829 -5.227 0.143 1.00 0.81 H new ATOM 0 HA ALA B 29 -23.116 -6.539 -1.112 1.00 0.83 H new ATOM 0 HB1 ALA B 29 -21.644 -8.260 -2.101 1.00 0.83 H new ATOM 0 HB2 ALA B 29 -21.363 -6.658 -2.824 1.00 0.83 H new ATOM 0 HB3 ALA B 29 -20.219 -7.307 -1.624 1.00 0.83 H new ATOM 1017 N TYR B 30 -20.843 -7.469 1.104 1.00 0.87 N ATOM 1018 CA TYR B 30 -20.651 -8.276 2.305 1.00 0.91 C ATOM 1019 C TYR B 30 -20.408 -7.432 3.561 1.00 0.91 C ATOM 1020 O TYR B 30 -20.168 -7.983 4.634 1.00 1.01 O ATOM 1021 CB TYR B 30 -19.486 -9.250 2.095 1.00 0.94 C ATOM 1022 CG TYR B 30 -19.714 -10.242 0.975 1.00 0.92 C ATOM 1023 CD1 TYR B 30 -20.509 -11.367 1.166 1.00 0.99 C ATOM 1024 CD2 TYR B 30 -19.131 -10.053 -0.272 1.00 0.93 C ATOM 1025 CE1 TYR B 30 -20.716 -12.276 0.145 1.00 1.07 C ATOM 1026 CE2 TYR B 30 -19.335 -10.957 -1.297 1.00 1.01 C ATOM 1027 CZ TYR B 30 -20.127 -12.067 -1.084 1.00 1.07 C ATOM 1028 OH TYR B 30 -20.334 -12.969 -2.104 1.00 1.20 O ATOM 0 H TYR B 30 -20.025 -6.931 0.818 1.00 0.87 H new ATOM 0 HA TYR B 30 -21.577 -8.827 2.470 1.00 0.91 H new ATOM 0 HB2 TYR B 30 -18.581 -8.680 1.884 1.00 0.94 H new ATOM 0 HB3 TYR B 30 -19.310 -9.796 3.022 1.00 0.94 H new ATOM 0 HD1 TYR B 30 -20.972 -11.533 2.127 1.00 0.99 H new ATOM 0 HD2 TYR B 30 -18.509 -9.187 -0.443 1.00 0.93 H new ATOM 0 HE1 TYR B 30 -21.336 -13.145 0.309 1.00 1.07 H new ATOM 0 HE2 TYR B 30 -18.876 -10.796 -2.261 1.00 1.01 H new ATOM 0 HH TYR B 30 -19.850 -12.675 -2.904 1.00 1.20 H new ATOM 1038 N TYR B 31 -20.483 -6.109 3.446 1.00 0.86 N ATOM 1039 CA TYR B 31 -20.254 -5.249 4.607 1.00 0.87 C ATOM 1040 C TYR B 31 -21.554 -4.608 5.100 1.00 0.94 C ATOM 1041 O TYR B 31 -21.875 -4.720 6.283 1.00 1.03 O ATOM 1042 CB TYR B 31 -19.217 -4.171 4.293 1.00 0.81 C ATOM 1043 CG TYR B 31 -18.250 -3.902 5.428 1.00 0.77 C ATOM 1044 CD1 TYR B 31 -18.685 -3.853 6.747 1.00 0.88 C ATOM 1045 CD2 TYR B 31 -16.898 -3.699 5.178 1.00 0.71 C ATOM 1046 CE1 TYR B 31 -17.803 -3.608 7.782 1.00 0.89 C ATOM 1047 CE2 TYR B 31 -16.010 -3.455 6.208 1.00 0.68 C ATOM 1048 CZ TYR B 31 -16.467 -3.412 7.508 1.00 0.75 C ATOM 1049 OH TYR B 31 -15.585 -3.169 8.538 1.00 0.77 O ATOM 0 H TYR B 31 -20.696 -5.615 2.580 1.00 0.86 H new ATOM 0 HA TYR B 31 -19.868 -5.882 5.406 1.00 0.87 H new ATOM 0 HB2 TYR B 31 -18.652 -4.470 3.410 1.00 0.81 H new ATOM 0 HB3 TYR B 31 -19.734 -3.245 4.042 1.00 0.81 H new ATOM 0 HD1 TYR B 31 -19.731 -4.009 6.967 1.00 0.88 H new ATOM 0 HD2 TYR B 31 -16.535 -3.733 4.161 1.00 0.71 H new ATOM 0 HE1 TYR B 31 -18.159 -3.570 8.801 1.00 0.89 H new ATOM 0 HE2 TYR B 31 -14.963 -3.299 5.996 1.00 0.68 H new ATOM 0 HH TYR B 31 -14.691 -3.007 8.171 1.00 0.77 H new ATOM 1059 N CYS B 32 -22.290 -3.923 4.213 1.00 0.94 N ATOM 1060 CA CYS B 32 -23.555 -3.300 4.604 1.00 1.02 C ATOM 1061 C CYS B 32 -24.604 -4.376 4.875 1.00 1.07 C ATOM 1062 O CYS B 32 -25.462 -4.641 4.032 1.00 1.10 O ATOM 1063 CB CYS B 32 -24.076 -2.356 3.515 1.00 1.01 C ATOM 1064 SG CYS B 32 -22.792 -1.566 2.498 1.00 0.98 S ATOM 0 H CYS B 32 -22.033 -3.789 3.235 1.00 0.94 H new ATOM 0 HA CYS B 32 -23.372 -2.719 5.508 1.00 1.02 H new ATOM 0 HB2 CYS B 32 -24.743 -2.916 2.860 1.00 1.01 H new ATOM 0 HB3 CYS B 32 -24.674 -1.577 3.987 1.00 1.01 H new ATOM 0 HG CYS B 32 -22.693 -0.311 2.822 1.00 0.98 H new ATOM 1069 N SER B 33 -24.505 -5.004 6.041 1.00 1.09 N ATOM 1070 CA SER B 33 -25.415 -6.069 6.442 1.00 1.16 C ATOM 1071 C SER B 33 -25.273 -7.265 5.491 1.00 1.09 C ATOM 1072 O SER B 33 -24.411 -8.123 5.696 1.00 1.07 O ATOM 1073 CB SER B 33 -26.860 -5.560 6.487 1.00 1.27 C ATOM 1074 OG SER B 33 -26.919 -4.258 7.045 1.00 1.43 O ATOM 0 H SER B 33 -23.790 -4.788 6.736 1.00 1.09 H new ATOM 0 HA SER B 33 -25.153 -6.398 7.447 1.00 1.16 H new ATOM 0 HB2 SER B 33 -27.277 -5.548 5.480 1.00 1.27 H new ATOM 0 HB3 SER B 33 -27.472 -6.242 7.078 1.00 1.27 H new ATOM 0 HG SER B 33 -27.850 -3.952 7.063 1.00 1.43 H new ATOM 1080 N HIS B 34 -26.085 -7.288 4.433 1.00 1.10 N ATOM 1081 CA HIS B 34 -26.055 -8.358 3.440 1.00 1.07 C ATOM 1082 C HIS B 34 -26.710 -7.882 2.152 1.00 1.06 C ATOM 1083 O HIS B 34 -27.859 -8.217 1.872 1.00 1.14 O ATOM 1084 CB HIS B 34 -26.771 -9.616 3.951 1.00 1.14 C ATOM 1085 CG HIS B 34 -25.859 -10.609 4.606 1.00 1.09 C ATOM 1086 ND1 HIS B 34 -26.111 -11.172 5.838 1.00 1.18 N ATOM 1087 CD2 HIS B 34 -24.686 -11.137 4.188 1.00 1.04 C ATOM 1088 CE1 HIS B 34 -25.130 -12.000 6.148 1.00 1.14 C ATOM 1089 NE2 HIS B 34 -24.255 -11.997 5.164 1.00 1.06 N ATOM 0 H HIS B 34 -26.780 -6.566 4.242 1.00 1.10 H new ATOM 0 HA HIS B 34 -25.013 -8.615 3.251 1.00 1.07 H new ATOM 0 HB2 HIS B 34 -27.541 -9.320 4.663 1.00 1.14 H new ATOM 0 HB3 HIS B 34 -27.278 -10.099 3.115 1.00 1.14 H new ATOM 0 HD2 HIS B 34 -24.182 -10.921 3.257 1.00 1.04 H new ATOM 0 HE1 HIS B 34 -25.058 -12.581 7.055 1.00 1.14 H new ATOM 0 HE2 HIS B 34 -23.396 -12.546 5.133 1.00 1.06 H new ATOM 1098 N ARG B 35 -25.976 -7.097 1.373 1.00 0.99 N ATOM 1099 CA ARG B 35 -26.495 -6.567 0.116 1.00 0.99 C ATOM 1100 C ARG B 35 -26.366 -7.604 -0.997 1.00 1.01 C ATOM 1101 O ARG B 35 -25.779 -7.338 -2.047 1.00 1.03 O ATOM 1102 CB ARG B 35 -25.749 -5.289 -0.284 1.00 0.94 C ATOM 1103 CG ARG B 35 -25.506 -4.326 0.863 1.00 0.94 C ATOM 1104 CD ARG B 35 -26.757 -3.547 1.226 1.00 1.04 C ATOM 1105 NE ARG B 35 -27.083 -2.523 0.230 1.00 1.05 N ATOM 1106 CZ ARG B 35 -26.506 -1.318 0.169 1.00 1.06 C ATOM 1107 NH1 ARG B 35 -25.540 -0.985 1.021 1.00 1.04 N ATOM 1108 NH2 ARG B 35 -26.896 -0.447 -0.754 1.00 1.11 N ATOM 0 H ARG B 35 -25.020 -6.813 1.588 1.00 0.99 H new ATOM 0 HA ARG B 35 -27.549 -6.330 0.262 1.00 0.99 H new ATOM 0 HB2 ARG B 35 -24.790 -5.564 -0.722 1.00 0.94 H new ATOM 0 HB3 ARG B 35 -26.319 -4.777 -1.059 1.00 0.94 H new ATOM 0 HG2 ARG B 35 -25.159 -4.881 1.735 1.00 0.94 H new ATOM 0 HG3 ARG B 35 -24.712 -3.631 0.591 1.00 0.94 H new ATOM 0 HD2 ARG B 35 -27.596 -4.236 1.323 1.00 1.04 H new ATOM 0 HD3 ARG B 35 -26.618 -3.074 2.198 1.00 1.04 H new ATOM 0 HE ARG B 35 -27.798 -2.744 -0.463 1.00 1.05 H new ATOM 0 HH11 ARG B 35 -25.233 -1.651 1.729 1.00 1.04 H new ATOM 0 HH12 ARG B 35 -25.107 -0.063 0.966 1.00 1.04 H new ATOM 0 HH21 ARG B 35 -27.633 -0.698 -1.413 1.00 1.11 H new ATOM 0 HH22 ARG B 35 -26.459 0.473 -0.804 1.00 1.11 H new ATOM 1122 N ILE B 36 -26.925 -8.782 -0.768 1.00 1.07 N ATOM 1123 CA ILE B 36 -26.871 -9.858 -1.743 1.00 1.12 C ATOM 1124 C ILE B 36 -28.275 -10.333 -2.080 1.00 1.32 C ATOM 1125 O ILE B 36 -28.428 -11.110 -3.046 1.00 1.45 O ATOM 1126 CB ILE B 36 -26.040 -11.057 -1.233 1.00 1.06 C ATOM 1127 CG1 ILE B 36 -26.510 -11.476 0.163 1.00 1.12 C ATOM 1128 CG2 ILE B 36 -24.556 -10.710 -1.221 1.00 1.04 C ATOM 1129 CD1 ILE B 36 -26.050 -12.859 0.571 1.00 1.18 C ATOM 1130 OXT ILE B 36 -29.223 -9.920 -1.379 1.00 1.45 O ATOM 0 H ILE B 36 -27.424 -9.017 0.090 1.00 1.07 H new ATOM 0 HA ILE B 36 -26.387 -9.460 -2.635 1.00 1.12 H new ATOM 0 HB ILE B 36 -26.189 -11.897 -1.911 1.00 1.06 H new ATOM 0 HG12 ILE B 36 -26.146 -10.752 0.892 1.00 1.12 H new ATOM 0 HG13 ILE B 36 -27.599 -11.441 0.196 1.00 1.12 H new ATOM 0 HG21 ILE B 36 -23.985 -11.565 -0.859 1.00 1.04 H new ATOM 0 HG22 ILE B 36 -24.233 -10.459 -2.231 1.00 1.04 H new ATOM 0 HG23 ILE B 36 -24.387 -9.857 -0.564 1.00 1.04 H new ATOM 0 HD11 ILE B 36 -26.421 -13.086 1.570 1.00 1.18 H new ATOM 0 HD12 ILE B 36 -26.436 -13.594 -0.135 1.00 1.18 H new ATOM 0 HD13 ILE B 36 -24.961 -12.895 0.572 1.00 1.18 H new ATOM 1272 N ASP C 91 22.197 -2.185 -4.962 1.00 1.08 N ATOM 1273 CA ASP C 91 22.912 -0.974 -5.361 1.00 1.09 C ATOM 1274 C ASP C 91 24.188 -0.807 -4.536 1.00 1.14 C ATOM 1275 O ASP C 91 25.203 -0.332 -5.041 1.00 1.53 O ATOM 1276 CB ASP C 91 22.012 0.269 -5.245 1.00 1.03 C ATOM 1277 CG ASP C 91 22.032 0.912 -3.869 1.00 1.19 C ATOM 1278 OD1 ASP C 91 21.318 0.424 -2.977 1.00 1.34 O ATOM 1279 OD2 ASP C 91 22.755 1.917 -3.685 1.00 1.54 O ATOM 0 HA ASP C 91 23.194 -1.078 -6.409 1.00 1.09 H new ATOM 0 HB2 ASP C 91 22.327 1.005 -5.985 1.00 1.03 H new ATOM 0 HB3 ASP C 91 20.988 -0.011 -5.490 1.00 1.03 H new ATOM 1284 N GLY C 92 24.142 -1.215 -3.274 1.00 0.94 N ATOM 1285 CA GLY C 92 25.315 -1.110 -2.431 1.00 1.00 C ATOM 1286 C GLY C 92 24.985 -1.116 -0.956 1.00 0.95 C ATOM 1287 O GLY C 92 24.917 -2.179 -0.331 1.00 1.04 O ATOM 0 H GLY C 92 23.319 -1.614 -2.822 1.00 0.94 H new ATOM 0 HA2 GLY C 92 25.989 -1.938 -2.650 1.00 1.00 H new ATOM 0 HA3 GLY C 92 25.849 -0.192 -2.674 1.00 1.00 H new ATOM 1291 N LEU C 93 24.772 0.063 -0.396 1.00 0.88 N ATOM 1292 CA LEU C 93 24.464 0.187 1.019 1.00 0.88 C ATOM 1293 C LEU C 93 23.159 0.936 1.235 1.00 0.83 C ATOM 1294 O LEU C 93 22.623 1.556 0.320 1.00 0.84 O ATOM 1295 CB LEU C 93 25.601 0.904 1.758 1.00 0.98 C ATOM 1296 CG LEU C 93 26.832 0.047 2.055 1.00 1.17 C ATOM 1297 CD1 LEU C 93 27.878 0.207 0.964 1.00 1.58 C ATOM 1298 CD2 LEU C 93 27.413 0.411 3.410 1.00 1.17 C ATOM 0 H LEU C 93 24.807 0.949 -0.900 1.00 0.88 H new ATOM 0 HA LEU C 93 24.355 -0.820 1.422 1.00 0.88 H new ATOM 0 HB2 LEU C 93 25.912 1.764 1.165 1.00 0.98 H new ATOM 0 HB3 LEU C 93 25.212 1.291 2.700 1.00 0.98 H new ATOM 0 HG LEU C 93 26.525 -0.999 2.078 1.00 1.17 H new ATOM 0 HD11 LEU C 93 28.744 -0.412 1.197 1.00 1.58 H new ATOM 0 HD12 LEU C 93 27.457 -0.103 0.008 1.00 1.58 H new ATOM 0 HD13 LEU C 93 28.184 1.251 0.904 1.00 1.58 H new ATOM 0 HD21 LEU C 93 28.289 -0.207 3.608 1.00 1.17 H new ATOM 0 HD22 LEU C 93 27.703 1.462 3.411 1.00 1.17 H new ATOM 0 HD23 LEU C 93 26.665 0.240 4.184 1.00 1.17 H new ATOM 1310 N CYS C 94 22.666 0.873 2.456 1.00 0.81 N ATOM 1311 CA CYS C 94 21.430 1.530 2.829 1.00 0.77 C ATOM 1312 C CYS C 94 21.709 2.972 3.232 1.00 0.84 C ATOM 1313 O CYS C 94 22.721 3.262 3.873 1.00 1.04 O ATOM 1314 CB CYS C 94 20.813 0.751 3.985 1.00 0.75 C ATOM 1315 SG CYS C 94 19.246 1.383 4.658 1.00 0.70 S ATOM 0 H CYS C 94 23.112 0.364 3.219 1.00 0.81 H new ATOM 0 HA CYS C 94 20.736 1.549 1.988 1.00 0.77 H new ATOM 0 HB2 CYS C 94 20.651 -0.275 3.655 1.00 0.75 H new ATOM 0 HB3 CYS C 94 21.540 0.714 4.796 1.00 0.75 H new ATOM 0 HG CYS C 94 18.323 0.477 4.532 1.00 0.70 H new ATOM 1320 N ALA C 95 20.825 3.873 2.848 1.00 0.79 N ATOM 1321 CA ALA C 95 20.985 5.276 3.188 1.00 0.88 C ATOM 1322 C ALA C 95 20.283 5.574 4.507 1.00 0.82 C ATOM 1323 O ALA C 95 20.450 6.647 5.088 1.00 0.92 O ATOM 1324 CB ALA C 95 20.450 6.158 2.074 1.00 1.00 C ATOM 0 H ALA C 95 19.990 3.660 2.302 1.00 0.79 H new ATOM 0 HA ALA C 95 22.047 5.494 3.305 1.00 0.88 H new ATOM 0 HB1 ALA C 95 20.578 7.206 2.346 1.00 1.00 H new ATOM 0 HB2 ALA C 95 20.996 5.953 1.153 1.00 1.00 H new ATOM 0 HB3 ALA C 95 19.391 5.950 1.922 1.00 1.00 H new ATOM 1330 N SER C 96 19.500 4.611 4.976 1.00 0.72 N ATOM 1331 CA SER C 96 18.784 4.759 6.231 1.00 0.70 C ATOM 1332 C SER C 96 19.620 4.199 7.374 1.00 0.69 C ATOM 1333 O SER C 96 19.673 4.777 8.462 1.00 0.74 O ATOM 1334 CB SER C 96 17.431 4.053 6.156 1.00 0.70 C ATOM 1335 OG SER C 96 16.546 4.736 5.282 1.00 0.77 O ATOM 0 H SER C 96 19.346 3.720 4.504 1.00 0.72 H new ATOM 0 HA SER C 96 18.606 5.818 6.416 1.00 0.70 H new ATOM 0 HB2 SER C 96 17.570 3.029 5.810 1.00 0.70 H new ATOM 0 HB3 SER C 96 16.991 3.996 7.152 1.00 0.70 H new ATOM 0 HG SER C 96 16.704 4.441 4.361 1.00 0.77 H new ATOM 1341 N CYS C 97 20.279 3.079 7.123 1.00 0.69 N ATOM 1342 CA CYS C 97 21.128 2.465 8.122 1.00 0.69 C ATOM 1343 C CYS C 97 22.469 2.098 7.484 1.00 0.73 C ATOM 1344 O CYS C 97 22.520 1.675 6.334 1.00 0.90 O ATOM 1345 CB CYS C 97 20.422 1.258 8.768 1.00 0.67 C ATOM 1346 SG CYS C 97 20.450 -0.286 7.799 1.00 0.69 S ATOM 0 H CYS C 97 20.240 2.579 6.235 1.00 0.69 H new ATOM 0 HA CYS C 97 21.326 3.169 8.930 1.00 0.69 H new ATOM 0 HB2 CYS C 97 20.884 1.066 9.736 1.00 0.67 H new ATOM 0 HB3 CYS C 97 19.383 1.527 8.958 1.00 0.67 H new ATOM 0 HG CYS C 97 20.230 -0.016 6.546 1.00 0.69 H new ATOM 1351 N ASP C 98 23.555 2.285 8.222 1.00 0.79 N ATOM 1352 CA ASP C 98 24.894 2.005 7.697 1.00 0.82 C ATOM 1353 C ASP C 98 25.191 0.509 7.649 1.00 0.83 C ATOM 1354 O ASP C 98 26.082 0.016 8.343 1.00 0.97 O ATOM 1355 CB ASP C 98 25.953 2.720 8.536 1.00 0.86 C ATOM 1356 CG ASP C 98 26.928 3.504 7.683 1.00 0.96 C ATOM 1357 OD1 ASP C 98 27.624 2.896 6.840 1.00 1.32 O ATOM 1358 OD2 ASP C 98 27.004 4.740 7.847 1.00 1.41 O ATOM 0 H ASP C 98 23.541 2.628 9.183 1.00 0.79 H new ATOM 0 HA ASP C 98 24.925 2.381 6.674 1.00 0.82 H new ATOM 0 HB2 ASP C 98 25.463 3.395 9.237 1.00 0.86 H new ATOM 0 HB3 ASP C 98 26.500 1.987 9.129 1.00 0.86 H new ATOM 1363 N LYS C 99 24.444 -0.207 6.832 1.00 0.83 N ATOM 1364 CA LYS C 99 24.631 -1.640 6.681 1.00 0.85 C ATOM 1365 C LYS C 99 24.556 -2.040 5.216 1.00 0.86 C ATOM 1366 O LYS C 99 23.759 -1.489 4.453 1.00 0.92 O ATOM 1367 CB LYS C 99 23.570 -2.407 7.475 1.00 0.82 C ATOM 1368 CG LYS C 99 23.947 -2.674 8.923 1.00 0.90 C ATOM 1369 CD LYS C 99 25.135 -3.616 9.027 1.00 1.00 C ATOM 1370 CE LYS C 99 25.270 -4.195 10.426 1.00 1.21 C ATOM 1371 NZ LYS C 99 26.409 -5.145 10.521 1.00 1.44 N ATOM 0 H LYS C 99 23.696 0.182 6.258 1.00 0.83 H new ATOM 0 HA LYS C 99 25.618 -1.892 7.068 1.00 0.85 H new ATOM 0 HB2 LYS C 99 22.637 -1.843 7.452 1.00 0.82 H new ATOM 0 HB3 LYS C 99 23.379 -3.359 6.980 1.00 0.82 H new ATOM 0 HG2 LYS C 99 24.184 -1.732 9.417 1.00 0.90 H new ATOM 0 HG3 LYS C 99 23.094 -3.104 9.448 1.00 0.90 H new ATOM 0 HD2 LYS C 99 25.022 -4.426 8.307 1.00 1.00 H new ATOM 0 HD3 LYS C 99 26.048 -3.081 8.764 1.00 1.00 H new ATOM 0 HE2 LYS C 99 25.411 -3.386 11.143 1.00 1.21 H new ATOM 0 HE3 LYS C 99 24.347 -4.706 10.699 1.00 1.21 H new ATOM 0 HZ1 LYS C 99 26.469 -5.519 11.490 1.00 1.44 H new ATOM 0 HZ2 LYS C 99 26.263 -5.930 9.855 1.00 1.44 H new ATOM 0 HZ3 LYS C 99 27.293 -4.651 10.285 1.00 1.44 H new ATOM 1385 N ARG C 100 25.403 -2.984 4.819 1.00 0.84 N ATOM 1386 CA ARG C 100 25.404 -3.471 3.447 1.00 0.88 C ATOM 1387 C ARG C 100 24.139 -4.274 3.195 1.00 0.85 C ATOM 1388 O ARG C 100 23.727 -5.077 4.034 1.00 0.85 O ATOM 1389 CB ARG C 100 26.641 -4.331 3.158 1.00 0.94 C ATOM 1390 CG ARG C 100 27.912 -3.524 2.940 1.00 1.08 C ATOM 1391 CD ARG C 100 29.034 -4.389 2.378 1.00 1.14 C ATOM 1392 NE ARG C 100 29.391 -5.484 3.282 1.00 1.20 N ATOM 1393 CZ ARG C 100 30.315 -5.394 4.240 1.00 1.28 C ATOM 1394 NH1 ARG C 100 31.048 -4.293 4.365 1.00 1.42 N ATOM 1395 NH2 ARG C 100 30.530 -6.421 5.052 1.00 1.48 N ATOM 0 H ARG C 100 26.094 -3.425 5.426 1.00 0.84 H new ATOM 0 HA ARG C 100 25.435 -2.612 2.777 1.00 0.88 H new ATOM 0 HB2 ARG C 100 26.796 -5.019 3.989 1.00 0.94 H new ATOM 0 HB3 ARG C 100 26.451 -4.938 2.273 1.00 0.94 H new ATOM 0 HG2 ARG C 100 27.708 -2.701 2.255 1.00 1.08 H new ATOM 0 HG3 ARG C 100 28.230 -3.082 3.884 1.00 1.08 H new ATOM 0 HD2 ARG C 100 28.728 -4.799 1.416 1.00 1.14 H new ATOM 0 HD3 ARG C 100 29.912 -3.769 2.195 1.00 1.14 H new ATOM 0 HE ARG C 100 28.902 -6.372 3.172 1.00 1.20 H new ATOM 0 HH11 ARG C 100 30.906 -3.510 3.726 1.00 1.42 H new ATOM 0 HH12 ARG C 100 31.753 -4.230 5.100 1.00 1.42 H new ATOM 0 HH21 ARG C 100 29.989 -7.279 4.944 1.00 1.48 H new ATOM 0 HH22 ARG C 100 31.236 -6.353 5.785 1.00 1.48 H new ATOM 1409 N ILE C 101 23.520 -4.058 2.048 1.00 0.88 N ATOM 1410 CA ILE C 101 22.293 -4.758 1.718 1.00 0.86 C ATOM 1411 C ILE C 101 22.575 -6.215 1.362 1.00 0.90 C ATOM 1412 O ILE C 101 23.589 -6.530 0.733 1.00 0.95 O ATOM 1413 CB ILE C 101 21.542 -4.072 0.558 1.00 0.87 C ATOM 1414 CG1 ILE C 101 21.630 -2.549 0.700 1.00 0.83 C ATOM 1415 CG2 ILE C 101 20.085 -4.516 0.536 1.00 0.90 C ATOM 1416 CD1 ILE C 101 21.107 -1.792 -0.500 1.00 0.84 C ATOM 0 H ILE C 101 23.845 -3.407 1.333 1.00 0.88 H new ATOM 0 HA ILE C 101 21.658 -4.726 2.603 1.00 0.86 H new ATOM 0 HB ILE C 101 22.009 -4.364 -0.383 1.00 0.87 H new ATOM 0 HG12 ILE C 101 21.069 -2.243 1.583 1.00 0.83 H new ATOM 0 HG13 ILE C 101 22.670 -2.269 0.869 1.00 0.83 H new ATOM 0 HG21 ILE C 101 19.567 -4.024 -0.287 1.00 0.90 H new ATOM 0 HG22 ILE C 101 20.036 -5.597 0.402 1.00 0.90 H new ATOM 0 HG23 ILE C 101 19.608 -4.245 1.478 1.00 0.90 H new ATOM 0 HD11 ILE C 101 21.203 -0.721 -0.324 1.00 0.84 H new ATOM 0 HD12 ILE C 101 21.683 -2.068 -1.383 1.00 0.84 H new ATOM 0 HD13 ILE C 101 20.058 -2.041 -0.659 1.00 0.84 H new ATOM 1428 N ARG C 102 21.695 -7.098 1.812 1.00 0.89 N ATOM 1429 CA ARG C 102 21.812 -8.526 1.547 1.00 0.92 C ATOM 1430 C ARG C 102 20.623 -8.981 0.714 1.00 0.91 C ATOM 1431 O ARG C 102 19.811 -8.157 0.295 1.00 0.90 O ATOM 1432 CB ARG C 102 21.855 -9.319 2.860 1.00 0.95 C ATOM 1433 CG ARG C 102 22.963 -8.899 3.815 1.00 1.01 C ATOM 1434 CD ARG C 102 24.325 -9.407 3.362 1.00 1.09 C ATOM 1435 NE ARG C 102 24.805 -8.706 2.173 1.00 1.15 N ATOM 1436 CZ ARG C 102 25.684 -9.206 1.311 1.00 1.37 C ATOM 1437 NH1 ARG C 102 26.206 -10.413 1.502 1.00 1.55 N ATOM 1438 NH2 ARG C 102 26.038 -8.495 0.252 1.00 1.48 N ATOM 0 H ARG C 102 20.880 -6.846 2.371 1.00 0.89 H new ATOM 0 HA ARG C 102 22.738 -8.708 1.003 1.00 0.92 H new ATOM 0 HB2 ARG C 102 20.896 -9.211 3.366 1.00 0.95 H new ATOM 0 HB3 ARG C 102 21.975 -10.377 2.627 1.00 0.95 H new ATOM 0 HG2 ARG C 102 22.987 -7.812 3.888 1.00 1.01 H new ATOM 0 HG3 ARG C 102 22.747 -9.281 4.813 1.00 1.01 H new ATOM 0 HD2 ARG C 102 25.045 -9.283 4.171 1.00 1.09 H new ATOM 0 HD3 ARG C 102 24.262 -10.475 3.152 1.00 1.09 H new ATOM 0 HE ARG C 102 24.441 -7.770 1.993 1.00 1.15 H new ATOM 0 HH11 ARG C 102 25.933 -10.964 2.316 1.00 1.55 H new ATOM 0 HH12 ARG C 102 26.880 -10.789 0.835 1.00 1.55 H new ATOM 0 HH21 ARG C 102 25.637 -7.569 0.102 1.00 1.48 H new ATOM 0 HH22 ARG C 102 26.712 -8.873 -0.414 1.00 1.48 H new ATOM 1452 N ALA C 103 20.501 -10.285 0.490 1.00 0.94 N ATOM 1453 CA ALA C 103 19.385 -10.820 -0.287 1.00 0.96 C ATOM 1454 C ALA C 103 18.091 -10.743 0.516 1.00 0.94 C ATOM 1455 O ALA C 103 17.000 -10.950 -0.013 1.00 1.30 O ATOM 1456 CB ALA C 103 19.662 -12.254 -0.716 1.00 1.06 C ATOM 0 H ALA C 103 21.156 -10.988 0.832 1.00 0.94 H new ATOM 0 HA ALA C 103 19.273 -10.212 -1.185 1.00 0.96 H new ATOM 0 HB1 ALA C 103 18.817 -12.631 -1.293 1.00 1.06 H new ATOM 0 HB2 ALA C 103 20.562 -12.283 -1.330 1.00 1.06 H new ATOM 0 HB3 ALA C 103 19.805 -12.877 0.167 1.00 1.06 H new ATOM 1462 N TYR C 104 18.231 -10.422 1.799 1.00 0.87 N ATOM 1463 CA TYR C 104 17.097 -10.293 2.708 1.00 0.81 C ATOM 1464 C TYR C 104 16.510 -8.880 2.623 1.00 0.74 C ATOM 1465 O TYR C 104 15.915 -8.376 3.576 1.00 0.82 O ATOM 1466 CB TYR C 104 17.553 -10.602 4.143 1.00 0.86 C ATOM 1467 CG TYR C 104 16.425 -10.830 5.129 1.00 0.89 C ATOM 1468 CD1 TYR C 104 15.513 -11.866 4.956 1.00 0.98 C ATOM 1469 CD2 TYR C 104 16.273 -10.003 6.236 1.00 0.90 C ATOM 1470 CE1 TYR C 104 14.482 -12.069 5.859 1.00 1.08 C ATOM 1471 CE2 TYR C 104 15.249 -10.200 7.140 1.00 1.00 C ATOM 1472 CZ TYR C 104 14.358 -11.232 6.949 1.00 1.08 C ATOM 1473 OH TYR C 104 13.336 -11.430 7.854 1.00 1.23 O ATOM 0 H TYR C 104 19.134 -10.244 2.238 1.00 0.87 H new ATOM 0 HA TYR C 104 16.321 -11.003 2.422 1.00 0.81 H new ATOM 0 HB2 TYR C 104 18.187 -11.488 4.126 1.00 0.86 H new ATOM 0 HB3 TYR C 104 18.169 -9.776 4.500 1.00 0.86 H new ATOM 0 HD1 TYR C 104 15.610 -12.523 4.104 1.00 0.98 H new ATOM 0 HD2 TYR C 104 16.969 -9.192 6.391 1.00 0.90 H new ATOM 0 HE1 TYR C 104 13.780 -12.877 5.711 1.00 1.08 H new ATOM 0 HE2 TYR C 104 15.147 -9.547 7.994 1.00 1.00 H new ATOM 0 HH TYR C 104 13.391 -10.755 8.563 1.00 1.23 H new ATOM 1483 N GLU C 105 16.698 -8.240 1.476 1.00 0.87 N ATOM 1484 CA GLU C 105 16.191 -6.894 1.251 1.00 0.84 C ATOM 1485 C GLU C 105 14.663 -6.893 1.223 1.00 0.74 C ATOM 1486 O GLU C 105 14.026 -6.307 2.099 1.00 0.74 O ATOM 1487 CB GLU C 105 16.752 -6.325 -0.057 1.00 0.96 C ATOM 1488 CG GLU C 105 16.872 -7.353 -1.173 1.00 1.04 C ATOM 1489 CD GLU C 105 16.289 -6.862 -2.479 1.00 1.16 C ATOM 1490 OE1 GLU C 105 15.077 -6.558 -2.516 1.00 1.55 O ATOM 1491 OE2 GLU C 105 17.043 -6.782 -3.472 1.00 1.43 O ATOM 0 H GLU C 105 17.202 -8.636 0.682 1.00 0.87 H new ATOM 0 HA GLU C 105 16.519 -6.259 2.074 1.00 0.84 H new ATOM 0 HB2 GLU C 105 16.110 -5.511 -0.393 1.00 0.96 H new ATOM 0 HB3 GLU C 105 17.735 -5.896 0.136 1.00 0.96 H new ATOM 0 HG2 GLU C 105 17.922 -7.604 -1.320 1.00 1.04 H new ATOM 0 HG3 GLU C 105 16.364 -8.270 -0.874 1.00 1.04 H new ATOM 1498 N MET C 106 14.093 -7.562 0.215 1.00 0.74 N ATOM 1499 CA MET C 106 12.642 -7.661 0.055 1.00 0.75 C ATOM 1500 C MET C 106 12.007 -6.278 0.049 1.00 0.66 C ATOM 1501 O MET C 106 11.001 -6.030 0.722 1.00 0.73 O ATOM 1502 CB MET C 106 12.037 -8.526 1.164 1.00 0.84 C ATOM 1503 CG MET C 106 12.481 -9.979 1.108 1.00 0.94 C ATOM 1504 SD MET C 106 11.568 -11.035 2.249 1.00 1.07 S ATOM 1505 CE MET C 106 12.282 -12.637 1.876 1.00 1.19 C ATOM 0 H MET C 106 14.623 -8.047 -0.509 1.00 0.74 H new ATOM 0 HA MET C 106 12.435 -8.136 -0.904 1.00 0.75 H new ATOM 0 HB2 MET C 106 12.312 -8.107 2.132 1.00 0.84 H new ATOM 0 HB3 MET C 106 10.950 -8.483 1.095 1.00 0.84 H new ATOM 0 HG2 MET C 106 12.353 -10.354 0.092 1.00 0.94 H new ATOM 0 HG3 MET C 106 13.545 -10.038 1.338 1.00 0.94 H new ATOM 0 HE1 MET C 106 11.818 -13.397 2.504 1.00 1.19 H new ATOM 0 HE2 MET C 106 12.109 -12.877 0.827 1.00 1.19 H new ATOM 0 HE3 MET C 106 13.354 -12.611 2.070 1.00 1.19 H new ATOM 1515 N THR C 107 12.595 -5.385 -0.727 1.00 0.59 N ATOM 1516 CA THR C 107 12.118 -4.020 -0.816 1.00 0.52 C ATOM 1517 C THR C 107 11.529 -3.737 -2.200 1.00 0.54 C ATOM 1518 O THR C 107 11.300 -4.660 -2.983 1.00 0.68 O ATOM 1519 CB THR C 107 13.268 -3.035 -0.495 1.00 0.55 C ATOM 1520 OG1 THR C 107 12.772 -1.703 -0.316 1.00 0.56 O ATOM 1521 CG2 THR C 107 14.320 -3.044 -1.593 1.00 0.70 C ATOM 0 H THR C 107 13.409 -5.585 -1.308 1.00 0.59 H new ATOM 0 HA THR C 107 11.324 -3.880 -0.082 1.00 0.52 H new ATOM 0 HB THR C 107 13.728 -3.368 0.436 1.00 0.55 H new ATOM 0 HG1 THR C 107 13.418 -1.180 0.203 1.00 0.56 H new ATOM 0 HG21 THR C 107 15.115 -2.343 -1.341 1.00 0.70 H new ATOM 0 HG22 THR C 107 14.737 -4.046 -1.689 1.00 0.70 H new ATOM 0 HG23 THR C 107 13.863 -2.749 -2.537 1.00 0.70 H new ATOM 1529 N MET C 108 11.273 -2.469 -2.489 1.00 0.52 N ATOM 1530 CA MET C 108 10.711 -2.067 -3.771 1.00 0.55 C ATOM 1531 C MET C 108 11.684 -1.164 -4.518 1.00 0.58 C ATOM 1532 O MET C 108 12.604 -0.601 -3.922 1.00 0.63 O ATOM 1533 CB MET C 108 9.371 -1.348 -3.570 1.00 0.55 C ATOM 1534 CG MET C 108 8.193 -2.287 -3.365 1.00 0.64 C ATOM 1535 SD MET C 108 7.701 -2.425 -1.635 1.00 1.11 S ATOM 1536 CE MET C 108 6.147 -3.303 -1.798 1.00 1.04 C ATOM 0 H MET C 108 11.447 -1.695 -1.847 1.00 0.52 H new ATOM 0 HA MET C 108 10.538 -2.964 -4.366 1.00 0.55 H new ATOM 0 HB2 MET C 108 9.450 -0.687 -2.707 1.00 0.55 H new ATOM 0 HB3 MET C 108 9.174 -0.718 -4.437 1.00 0.55 H new ATOM 0 HG2 MET C 108 7.346 -1.933 -3.952 1.00 0.64 H new ATOM 0 HG3 MET C 108 8.452 -3.276 -3.744 1.00 0.64 H new ATOM 0 HE1 MET C 108 5.509 -3.074 -0.944 1.00 1.04 H new ATOM 0 HE2 MET C 108 5.649 -2.994 -2.717 1.00 1.04 H new ATOM 0 HE3 MET C 108 6.337 -4.376 -1.832 1.00 1.04 H new ATOM 1546 N ARG C 109 11.476 -1.036 -5.820 1.00 0.60 N ATOM 1547 CA ARG C 109 12.329 -0.213 -6.662 1.00 0.66 C ATOM 1548 C ARG C 109 12.183 1.266 -6.319 1.00 0.63 C ATOM 1549 O ARG C 109 11.070 1.781 -6.174 1.00 0.72 O ATOM 1550 CB ARG C 109 11.987 -0.433 -8.135 1.00 0.76 C ATOM 1551 CG ARG C 109 13.198 -0.707 -9.011 1.00 0.88 C ATOM 1552 CD ARG C 109 13.826 -2.054 -8.691 1.00 1.00 C ATOM 1553 NE ARG C 109 14.897 -2.401 -9.624 1.00 1.13 N ATOM 1554 CZ ARG C 109 15.086 -3.622 -10.123 1.00 1.29 C ATOM 1555 NH1 ARG C 109 14.263 -4.614 -9.795 1.00 1.48 N ATOM 1556 NH2 ARG C 109 16.095 -3.853 -10.952 1.00 1.48 N ATOM 0 H ARG C 109 10.716 -1.497 -6.320 1.00 0.60 H new ATOM 0 HA ARG C 109 13.362 -0.509 -6.480 1.00 0.66 H new ATOM 0 HB2 ARG C 109 11.294 -1.271 -8.216 1.00 0.76 H new ATOM 0 HB3 ARG C 109 11.468 0.448 -8.513 1.00 0.76 H new ATOM 0 HG2 ARG C 109 12.902 -0.683 -10.060 1.00 0.88 H new ATOM 0 HG3 ARG C 109 13.936 0.082 -8.870 1.00 0.88 H new ATOM 0 HD2 ARG C 109 14.223 -2.036 -7.676 1.00 1.00 H new ATOM 0 HD3 ARG C 109 13.058 -2.827 -8.719 1.00 1.00 H new ATOM 0 HE ARG C 109 15.539 -1.662 -9.911 1.00 1.13 H new ATOM 0 HH11 ARG C 109 13.484 -4.441 -9.160 1.00 1.48 H new ATOM 0 HH12 ARG C 109 14.411 -5.547 -10.179 1.00 1.48 H new ATOM 0 HH21 ARG C 109 16.728 -3.095 -11.209 1.00 1.48 H new ATOM 0 HH22 ARG C 109 16.238 -4.788 -11.333 1.00 1.48 H new ATOM 1570 N VAL C 110 13.318 1.933 -6.172 1.00 0.64 N ATOM 1571 CA VAL C 110 13.345 3.354 -5.867 1.00 0.62 C ATOM 1572 C VAL C 110 14.153 4.080 -6.942 1.00 0.70 C ATOM 1573 O VAL C 110 14.370 3.536 -8.026 1.00 0.79 O ATOM 1574 CB VAL C 110 13.956 3.647 -4.472 1.00 0.66 C ATOM 1575 CG1 VAL C 110 13.200 4.772 -3.781 1.00 1.02 C ATOM 1576 CG2 VAL C 110 13.970 2.398 -3.599 1.00 0.87 C ATOM 0 H VAL C 110 14.241 1.507 -6.260 1.00 0.64 H new ATOM 0 HA VAL C 110 12.315 3.711 -5.851 1.00 0.62 H new ATOM 0 HB VAL C 110 14.989 3.962 -4.621 1.00 0.66 H new ATOM 0 HG11 VAL C 110 13.644 4.962 -2.804 1.00 1.02 H new ATOM 0 HG12 VAL C 110 13.258 5.676 -4.388 1.00 1.02 H new ATOM 0 HG13 VAL C 110 12.156 4.485 -3.655 1.00 1.02 H new ATOM 0 HG21 VAL C 110 14.404 2.637 -2.628 1.00 0.87 H new ATOM 0 HG22 VAL C 110 12.950 2.039 -3.462 1.00 0.87 H new ATOM 0 HG23 VAL C 110 14.566 1.623 -4.082 1.00 0.87 H new ATOM 1586 N LYS C 111 14.600 5.294 -6.645 1.00 0.73 N ATOM 1587 CA LYS C 111 15.379 6.072 -7.600 1.00 0.83 C ATOM 1588 C LYS C 111 16.727 5.414 -7.877 1.00 0.85 C ATOM 1589 O LYS C 111 17.151 5.303 -9.029 1.00 0.93 O ATOM 1590 CB LYS C 111 15.577 7.501 -7.090 1.00 0.89 C ATOM 1591 CG LYS C 111 14.276 8.263 -6.890 1.00 0.89 C ATOM 1592 CD LYS C 111 14.534 9.704 -6.477 1.00 0.99 C ATOM 1593 CE LYS C 111 14.965 10.555 -7.662 1.00 1.22 C ATOM 1594 NZ LYS C 111 15.272 11.953 -7.260 1.00 1.41 N ATOM 0 H LYS C 111 14.437 5.760 -5.753 1.00 0.73 H new ATOM 0 HA LYS C 111 14.823 6.108 -8.537 1.00 0.83 H new ATOM 0 HB2 LYS C 111 16.118 7.468 -6.144 1.00 0.89 H new ATOM 0 HB3 LYS C 111 16.203 8.046 -7.797 1.00 0.89 H new ATOM 0 HG2 LYS C 111 13.697 8.246 -7.813 1.00 0.89 H new ATOM 0 HG3 LYS C 111 13.675 7.767 -6.128 1.00 0.89 H new ATOM 0 HD2 LYS C 111 13.630 10.124 -6.035 1.00 0.99 H new ATOM 0 HD3 LYS C 111 15.307 9.731 -5.709 1.00 0.99 H new ATOM 0 HE2 LYS C 111 15.844 10.110 -8.127 1.00 1.22 H new ATOM 0 HE3 LYS C 111 14.175 10.559 -8.413 1.00 1.22 H new ATOM 0 HZ1 LYS C 111 15.562 12.499 -8.096 1.00 1.41 H new ATOM 0 HZ2 LYS C 111 14.426 12.387 -6.839 1.00 1.41 H new ATOM 0 HZ3 LYS C 111 16.044 11.952 -6.563 1.00 1.41 H new ATOM 1608 N ASP C 112 17.390 4.970 -6.819 1.00 0.80 N ATOM 1609 CA ASP C 112 18.690 4.316 -6.946 1.00 0.83 C ATOM 1610 C ASP C 112 18.992 3.510 -5.695 1.00 0.79 C ATOM 1611 O ASP C 112 19.053 2.284 -5.733 1.00 0.80 O ATOM 1612 CB ASP C 112 19.798 5.346 -7.188 1.00 0.94 C ATOM 1613 CG ASP C 112 21.068 4.722 -7.733 1.00 0.96 C ATOM 1614 OD1 ASP C 112 21.080 4.334 -8.920 1.00 1.16 O ATOM 1615 OD2 ASP C 112 22.065 4.628 -6.983 1.00 0.98 O ATOM 0 H ASP C 112 17.051 5.050 -5.860 1.00 0.80 H new ATOM 0 HA ASP C 112 18.653 3.645 -7.804 1.00 0.83 H new ATOM 0 HB2 ASP C 112 19.440 6.101 -7.888 1.00 0.94 H new ATOM 0 HB3 ASP C 112 20.022 5.859 -6.253 1.00 0.94 H new ATOM 1620 N LYS C 113 19.165 4.211 -4.583 1.00 0.83 N ATOM 1621 CA LYS C 113 19.448 3.564 -3.308 1.00 0.85 C ATOM 1622 C LYS C 113 18.208 2.835 -2.801 1.00 0.74 C ATOM 1623 O LYS C 113 17.144 3.439 -2.640 1.00 0.73 O ATOM 1624 CB LYS C 113 19.933 4.592 -2.273 1.00 0.96 C ATOM 1625 CG LYS C 113 19.072 5.843 -2.170 1.00 0.99 C ATOM 1626 CD LYS C 113 19.777 6.929 -1.375 1.00 1.20 C ATOM 1627 CE LYS C 113 18.911 8.168 -1.225 1.00 1.15 C ATOM 1628 NZ LYS C 113 19.669 9.299 -0.630 1.00 1.42 N ATOM 0 H LYS C 113 19.114 5.229 -4.537 1.00 0.83 H new ATOM 0 HA LYS C 113 20.243 2.834 -3.459 1.00 0.85 H new ATOM 0 HB2 LYS C 113 19.972 4.112 -1.295 1.00 0.96 H new ATOM 0 HB3 LYS C 113 20.952 4.888 -2.524 1.00 0.96 H new ATOM 0 HG2 LYS C 113 18.840 6.212 -3.169 1.00 0.99 H new ATOM 0 HG3 LYS C 113 18.123 5.597 -1.693 1.00 0.99 H new ATOM 0 HD2 LYS C 113 20.038 6.546 -0.388 1.00 1.20 H new ATOM 0 HD3 LYS C 113 20.710 7.195 -1.871 1.00 1.20 H new ATOM 0 HE2 LYS C 113 18.524 8.462 -2.201 1.00 1.15 H new ATOM 0 HE3 LYS C 113 18.050 7.937 -0.598 1.00 1.15 H new ATOM 0 HZ1 LYS C 113 19.046 10.127 -0.543 1.00 1.42 H new ATOM 0 HZ2 LYS C 113 20.017 9.027 0.312 1.00 1.42 H new ATOM 0 HZ3 LYS C 113 20.476 9.536 -1.242 1.00 1.42 H new ATOM 1642 N VAL C 114 18.341 1.537 -2.569 1.00 0.73 N ATOM 1643 CA VAL C 114 17.225 0.731 -2.096 1.00 0.67 C ATOM 1644 C VAL C 114 17.293 0.518 -0.588 1.00 0.68 C ATOM 1645 O VAL C 114 18.228 -0.095 -0.071 1.00 0.86 O ATOM 1646 CB VAL C 114 17.155 -0.637 -2.812 1.00 0.72 C ATOM 1647 CG1 VAL C 114 16.317 -0.537 -4.074 1.00 0.69 C ATOM 1648 CG2 VAL C 114 18.543 -1.156 -3.144 1.00 0.85 C ATOM 0 H VAL C 114 19.210 1.020 -2.701 1.00 0.73 H new ATOM 0 HA VAL C 114 16.319 1.288 -2.334 1.00 0.67 H new ATOM 0 HB VAL C 114 16.682 -1.344 -2.131 1.00 0.72 H new ATOM 0 HG11 VAL C 114 16.280 -1.510 -4.564 1.00 0.69 H new ATOM 0 HG12 VAL C 114 15.306 -0.222 -3.815 1.00 0.69 H new ATOM 0 HG13 VAL C 114 16.763 0.193 -4.750 1.00 0.69 H new ATOM 0 HG21 VAL C 114 18.461 -2.120 -3.647 1.00 0.85 H new ATOM 0 HG22 VAL C 114 19.050 -0.447 -3.799 1.00 0.85 H new ATOM 0 HG23 VAL C 114 19.117 -1.274 -2.225 1.00 0.85 H new ATOM 1658 N TYR C 115 16.295 1.035 0.113 1.00 0.64 N ATOM 1659 CA TYR C 115 16.230 0.905 1.561 1.00 0.63 C ATOM 1660 C TYR C 115 15.805 -0.507 1.953 1.00 0.64 C ATOM 1661 O TYR C 115 15.240 -1.243 1.147 1.00 0.91 O ATOM 1662 CB TYR C 115 15.243 1.917 2.150 1.00 0.63 C ATOM 1663 CG TYR C 115 15.587 3.362 1.871 1.00 0.69 C ATOM 1664 CD1 TYR C 115 16.859 3.855 2.119 1.00 0.85 C ATOM 1665 CD2 TYR C 115 14.632 4.236 1.362 1.00 0.85 C ATOM 1666 CE1 TYR C 115 17.169 5.177 1.871 1.00 0.99 C ATOM 1667 CE2 TYR C 115 14.937 5.559 1.112 1.00 0.93 C ATOM 1668 CZ TYR C 115 16.208 6.024 1.368 1.00 0.93 C ATOM 1669 OH TYR C 115 16.521 7.339 1.120 1.00 1.09 O ATOM 0 H TYR C 115 15.517 1.550 -0.299 1.00 0.64 H new ATOM 0 HA TYR C 115 17.224 1.103 1.961 1.00 0.63 H new ATOM 0 HB2 TYR C 115 14.249 1.710 1.753 1.00 0.63 H new ATOM 0 HB3 TYR C 115 15.192 1.770 3.229 1.00 0.63 H new ATOM 0 HD1 TYR C 115 17.618 3.195 2.512 1.00 0.85 H new ATOM 0 HD2 TYR C 115 13.635 3.873 1.159 1.00 0.85 H new ATOM 0 HE1 TYR C 115 18.164 5.546 2.071 1.00 0.99 H new ATOM 0 HE2 TYR C 115 14.184 6.225 0.718 1.00 0.93 H new ATOM 0 HH TYR C 115 16.162 7.902 1.838 1.00 1.09 H new ATOM 1679 N HIS C 116 16.067 -0.873 3.198 1.00 0.56 N ATOM 1680 CA HIS C 116 15.707 -2.195 3.698 1.00 0.54 C ATOM 1681 C HIS C 116 14.212 -2.263 3.980 1.00 0.51 C ATOM 1682 O HIS C 116 13.548 -1.235 4.019 1.00 0.50 O ATOM 1683 CB HIS C 116 16.482 -2.507 4.980 1.00 0.57 C ATOM 1684 CG HIS C 116 17.929 -2.805 4.753 1.00 0.61 C ATOM 1685 ND1 HIS C 116 18.959 -1.993 5.187 1.00 0.63 N ATOM 1686 CD2 HIS C 116 18.519 -3.855 4.141 1.00 0.67 C ATOM 1687 CE1 HIS C 116 20.115 -2.536 4.848 1.00 0.68 C ATOM 1688 NE2 HIS C 116 19.877 -3.670 4.212 1.00 0.71 N ATOM 0 H HIS C 116 16.528 -0.274 3.883 1.00 0.56 H new ATOM 0 HA HIS C 116 15.963 -2.932 2.936 1.00 0.54 H new ATOM 0 HB2 HIS C 116 16.398 -1.659 5.660 1.00 0.57 H new ATOM 0 HB3 HIS C 116 16.018 -3.360 5.475 1.00 0.57 H new ATOM 0 HD1 HIS C 116 18.845 -1.113 5.690 1.00 0.63 H new ATOM 0 HD2 HIS C 116 18.013 -4.690 3.679 1.00 0.67 H new ATOM 0 HE1 HIS C 116 21.091 -2.122 5.056 1.00 0.68 H new ATOM 1696 N LEU C 117 13.686 -3.468 4.189 1.00 0.53 N ATOM 1697 CA LEU C 117 12.263 -3.640 4.480 1.00 0.54 C ATOM 1698 C LEU C 117 11.898 -2.936 5.790 1.00 0.54 C ATOM 1699 O LEU C 117 10.762 -2.498 5.980 1.00 0.61 O ATOM 1700 CB LEU C 117 11.892 -5.130 4.548 1.00 0.60 C ATOM 1701 CG LEU C 117 12.388 -5.890 5.783 1.00 0.71 C ATOM 1702 CD1 LEU C 117 11.506 -7.104 6.042 1.00 0.90 C ATOM 1703 CD2 LEU C 117 13.840 -6.319 5.613 1.00 1.03 C ATOM 0 H LEU C 117 14.220 -4.337 4.163 1.00 0.53 H new ATOM 0 HA LEU C 117 11.693 -3.186 3.669 1.00 0.54 H new ATOM 0 HB2 LEU C 117 10.806 -5.216 4.505 1.00 0.60 H new ATOM 0 HB3 LEU C 117 12.287 -5.623 3.660 1.00 0.60 H new ATOM 0 HG LEU C 117 12.330 -5.221 6.641 1.00 0.71 H new ATOM 0 HD11 LEU C 117 11.868 -7.636 6.922 1.00 0.90 H new ATOM 0 HD12 LEU C 117 10.480 -6.779 6.212 1.00 0.90 H new ATOM 0 HD13 LEU C 117 11.538 -7.768 5.178 1.00 0.90 H new ATOM 0 HD21 LEU C 117 14.167 -6.856 6.503 1.00 1.03 H new ATOM 0 HD22 LEU C 117 13.928 -6.970 4.743 1.00 1.03 H new ATOM 0 HD23 LEU C 117 14.465 -5.438 5.471 1.00 1.03 H new ATOM 1715 N GLU C 118 12.879 -2.825 6.683 1.00 0.52 N ATOM 1716 CA GLU C 118 12.692 -2.168 7.972 1.00 0.55 C ATOM 1717 C GLU C 118 13.009 -0.682 7.851 1.00 0.52 C ATOM 1718 O GLU C 118 12.573 0.136 8.664 1.00 0.54 O ATOM 1719 CB GLU C 118 13.605 -2.809 9.023 1.00 0.63 C ATOM 1720 CG GLU C 118 15.043 -2.975 8.549 1.00 0.60 C ATOM 1721 CD GLU C 118 15.990 -3.405 9.648 1.00 0.81 C ATOM 1722 OE1 GLU C 118 16.398 -2.550 10.464 1.00 1.47 O ATOM 1723 OE2 GLU C 118 16.342 -4.601 9.700 1.00 1.05 O ATOM 0 H GLU C 118 13.821 -3.186 6.533 1.00 0.52 H new ATOM 0 HA GLU C 118 11.653 -2.286 8.281 1.00 0.55 H new ATOM 0 HB2 GLU C 118 13.595 -2.197 9.925 1.00 0.63 H new ATOM 0 HB3 GLU C 118 13.204 -3.785 9.296 1.00 0.63 H new ATOM 0 HG2 GLU C 118 15.071 -3.712 7.746 1.00 0.60 H new ATOM 0 HG3 GLU C 118 15.391 -2.032 8.128 1.00 0.60 H new ATOM 1730 N CYS C 119 13.763 -0.347 6.815 1.00 0.52 N ATOM 1731 CA CYS C 119 14.168 1.020 6.561 1.00 0.52 C ATOM 1732 C CYS C 119 13.265 1.658 5.501 1.00 0.49 C ATOM 1733 O CYS C 119 13.562 2.733 4.973 1.00 0.72 O ATOM 1734 CB CYS C 119 15.635 1.028 6.117 1.00 0.56 C ATOM 1735 SG CYS C 119 16.709 -0.034 7.147 1.00 0.60 S ATOM 0 H CYS C 119 14.109 -1.018 6.129 1.00 0.52 H new ATOM 0 HA CYS C 119 14.069 1.610 7.472 1.00 0.52 H new ATOM 0 HB2 CYS C 119 15.695 0.697 5.080 1.00 0.56 H new ATOM 0 HB3 CYS C 119 16.011 2.051 6.147 1.00 0.56 H new ATOM 0 HG CYS C 119 17.948 0.333 7.004 1.00 0.60 H new ATOM 1740 N PHE C 120 12.157 0.989 5.207 1.00 0.43 N ATOM 1741 CA PHE C 120 11.198 1.473 4.223 1.00 0.37 C ATOM 1742 C PHE C 120 9.849 1.724 4.891 1.00 0.35 C ATOM 1743 O PHE C 120 9.036 0.810 5.033 1.00 0.43 O ATOM 1744 CB PHE C 120 11.046 0.459 3.081 1.00 0.38 C ATOM 1745 CG PHE C 120 10.543 1.052 1.795 1.00 0.37 C ATOM 1746 CD1 PHE C 120 9.184 1.135 1.534 1.00 0.44 C ATOM 1747 CD2 PHE C 120 11.433 1.520 0.843 1.00 0.45 C ATOM 1748 CE1 PHE C 120 8.723 1.676 0.349 1.00 0.48 C ATOM 1749 CE2 PHE C 120 10.978 2.062 -0.344 1.00 0.50 C ATOM 1750 CZ PHE C 120 9.622 2.138 -0.592 1.00 0.47 C ATOM 0 H PHE C 120 11.899 0.102 5.640 1.00 0.43 H new ATOM 0 HA PHE C 120 11.565 2.410 3.805 1.00 0.37 H new ATOM 0 HB2 PHE C 120 12.011 -0.013 2.898 1.00 0.38 H new ATOM 0 HB3 PHE C 120 10.362 -0.328 3.397 1.00 0.38 H new ATOM 0 HD1 PHE C 120 8.477 0.772 2.266 1.00 0.44 H new ATOM 0 HD2 PHE C 120 12.495 1.461 1.030 1.00 0.45 H new ATOM 0 HE1 PHE C 120 7.662 1.737 0.159 1.00 0.48 H new ATOM 0 HE2 PHE C 120 11.683 2.426 -1.077 1.00 0.50 H new ATOM 0 HZ PHE C 120 9.265 2.558 -1.521 1.00 0.47 H new ATOM 1760 N LYS C 121 9.631 2.960 5.321 1.00 0.34 N ATOM 1761 CA LYS C 121 8.389 3.344 5.981 1.00 0.35 C ATOM 1762 C LYS C 121 8.186 4.850 5.865 1.00 0.34 C ATOM 1763 O LYS C 121 9.124 5.582 5.548 1.00 0.37 O ATOM 1764 CB LYS C 121 8.410 2.925 7.457 1.00 0.41 C ATOM 1765 CG LYS C 121 9.617 3.441 8.222 1.00 0.50 C ATOM 1766 CD LYS C 121 9.685 2.862 9.625 1.00 0.87 C ATOM 1767 CE LYS C 121 10.985 3.233 10.319 1.00 1.03 C ATOM 1768 NZ LYS C 121 12.173 2.712 9.590 1.00 1.35 N ATOM 0 H LYS C 121 10.304 3.720 5.223 1.00 0.34 H new ATOM 0 HA LYS C 121 7.560 2.833 5.491 1.00 0.35 H new ATOM 0 HB2 LYS C 121 7.503 3.287 7.941 1.00 0.41 H new ATOM 0 HB3 LYS C 121 8.391 1.837 7.517 1.00 0.41 H new ATOM 0 HG2 LYS C 121 10.527 3.187 7.679 1.00 0.50 H new ATOM 0 HG3 LYS C 121 9.573 4.529 8.279 1.00 0.50 H new ATOM 0 HD2 LYS C 121 8.842 3.227 10.211 1.00 0.87 H new ATOM 0 HD3 LYS C 121 9.594 1.777 9.577 1.00 0.87 H new ATOM 0 HE2 LYS C 121 11.056 4.318 10.400 1.00 1.03 H new ATOM 0 HE3 LYS C 121 10.980 2.837 11.334 1.00 1.03 H new ATOM 0 HZ1 LYS C 121 13.001 2.727 10.219 1.00 1.35 H new ATOM 0 HZ2 LYS C 121 11.990 1.736 9.282 1.00 1.35 H new ATOM 0 HZ3 LYS C 121 12.359 3.308 8.759 1.00 1.35 H new ATOM 1782 N CYS C 122 6.963 5.299 6.113 1.00 0.33 N ATOM 1783 CA CYS C 122 6.631 6.715 6.033 1.00 0.32 C ATOM 1784 C CYS C 122 7.407 7.529 7.065 1.00 0.35 C ATOM 1785 O CYS C 122 7.764 7.034 8.141 1.00 0.39 O ATOM 1786 CB CYS C 122 5.129 6.914 6.235 1.00 0.32 C ATOM 1787 SG CYS C 122 4.528 8.597 5.871 1.00 0.35 S ATOM 0 H CYS C 122 6.180 4.699 6.373 1.00 0.33 H new ATOM 0 HA CYS C 122 6.914 7.069 5.042 1.00 0.32 H new ATOM 0 HB2 CYS C 122 4.594 6.207 5.601 1.00 0.32 H new ATOM 0 HB3 CYS C 122 4.879 6.669 7.267 1.00 0.32 H new ATOM 0 HG CYS C 122 3.372 8.527 5.280 1.00 0.35 H new ATOM 1792 N ALA C 123 7.652 8.783 6.728 1.00 0.37 N ATOM 1793 CA ALA C 123 8.368 9.692 7.600 1.00 0.42 C ATOM 1794 C ALA C 123 7.389 10.460 8.474 1.00 0.46 C ATOM 1795 O ALA C 123 7.785 11.130 9.429 1.00 0.54 O ATOM 1796 CB ALA C 123 9.220 10.654 6.785 1.00 0.45 C ATOM 0 H ALA C 123 7.360 9.198 5.843 1.00 0.37 H new ATOM 0 HA ALA C 123 9.028 9.110 8.243 1.00 0.42 H new ATOM 0 HB1 ALA C 123 9.750 11.329 7.457 1.00 0.45 H new ATOM 0 HB2 ALA C 123 9.941 10.090 6.194 1.00 0.45 H new ATOM 0 HB3 ALA C 123 8.580 11.233 6.120 1.00 0.45 H new ATOM 1802 N ALA C 124 6.105 10.345 8.162 1.00 0.41 N ATOM 1803 CA ALA C 124 5.083 11.038 8.926 1.00 0.46 C ATOM 1804 C ALA C 124 4.247 10.081 9.772 1.00 0.47 C ATOM 1805 O ALA C 124 4.263 10.167 11.000 1.00 0.56 O ATOM 1806 CB ALA C 124 4.192 11.849 8.006 1.00 0.47 C ATOM 0 H ALA C 124 5.750 9.781 7.389 1.00 0.41 H new ATOM 0 HA ALA C 124 5.595 11.713 9.612 1.00 0.46 H new ATOM 0 HB1 ALA C 124 3.432 12.362 8.595 1.00 0.47 H new ATOM 0 HB2 ALA C 124 4.794 12.584 7.471 1.00 0.47 H new ATOM 0 HB3 ALA C 124 3.709 11.185 7.289 1.00 0.47 H new ATOM 1812 N CYS C 125 3.526 9.163 9.128 1.00 0.43 N ATOM 1813 CA CYS C 125 2.682 8.227 9.864 1.00 0.45 C ATOM 1814 C CYS C 125 3.420 6.931 10.190 1.00 0.43 C ATOM 1815 O CYS C 125 2.938 6.121 10.988 1.00 0.46 O ATOM 1816 CB CYS C 125 1.377 7.945 9.103 1.00 0.45 C ATOM 1817 SG CYS C 125 1.562 6.998 7.555 1.00 0.41 S ATOM 0 H CYS C 125 3.510 9.049 8.114 1.00 0.43 H new ATOM 0 HA CYS C 125 2.426 8.699 10.812 1.00 0.45 H new ATOM 0 HB2 CYS C 125 0.702 7.401 9.763 1.00 0.45 H new ATOM 0 HB3 CYS C 125 0.898 8.897 8.872 1.00 0.45 H new ATOM 0 HG CYS C 125 2.568 7.466 6.878 1.00 0.41 H new ATOM 1822 N GLN C 126 4.577 6.741 9.562 1.00 0.40 N ATOM 1823 CA GLN C 126 5.421 5.561 9.787 1.00 0.40 C ATOM 1824 C GLN C 126 4.738 4.255 9.373 1.00 0.40 C ATOM 1825 O GLN C 126 5.117 3.185 9.848 1.00 0.56 O ATOM 1826 CB GLN C 126 5.840 5.461 11.258 1.00 0.49 C ATOM 1827 CG GLN C 126 7.181 6.102 11.568 1.00 0.53 C ATOM 1828 CD GLN C 126 7.088 7.603 11.728 1.00 0.57 C ATOM 1829 OE1 GLN C 126 6.807 8.108 12.810 1.00 0.71 O ATOM 1830 NE2 GLN C 126 7.337 8.326 10.654 1.00 0.52 N ATOM 0 H GLN C 126 4.960 7.398 8.882 1.00 0.40 H new ATOM 0 HA GLN C 126 6.300 5.696 9.157 1.00 0.40 H new ATOM 0 HB2 GLN C 126 5.074 5.931 11.875 1.00 0.49 H new ATOM 0 HB3 GLN C 126 5.878 4.410 11.543 1.00 0.49 H new ATOM 0 HG2 GLN C 126 7.584 5.668 12.483 1.00 0.53 H new ATOM 0 HG3 GLN C 126 7.884 5.869 10.768 1.00 0.53 H new ATOM 0 HE21 GLN C 126 7.567 7.867 9.773 1.00 0.52 H new ATOM 0 HE22 GLN C 126 7.300 9.344 10.705 1.00 0.52 H new ATOM 1839 N LYS C 127 3.747 4.327 8.499 1.00 0.39 N ATOM 1840 CA LYS C 127 3.056 3.121 8.063 1.00 0.41 C ATOM 1841 C LYS C 127 3.800 2.469 6.906 1.00 0.37 C ATOM 1842 O LYS C 127 4.642 3.100 6.261 1.00 0.41 O ATOM 1843 CB LYS C 127 1.609 3.419 7.655 1.00 0.44 C ATOM 1844 CG LYS C 127 0.746 3.972 8.783 1.00 0.60 C ATOM 1845 CD LYS C 127 0.908 3.174 10.067 1.00 0.93 C ATOM 1846 CE LYS C 127 0.070 3.760 11.191 1.00 1.17 C ATOM 1847 NZ LYS C 127 0.218 5.238 11.283 1.00 1.58 N ATOM 0 H LYS C 127 3.406 5.193 8.082 1.00 0.39 H new ATOM 0 HA LYS C 127 3.034 2.431 8.907 1.00 0.41 H new ATOM 0 HB2 LYS C 127 1.615 4.134 6.832 1.00 0.44 H new ATOM 0 HB3 LYS C 127 1.153 2.503 7.278 1.00 0.44 H new ATOM 0 HG2 LYS C 127 1.013 5.013 8.967 1.00 0.60 H new ATOM 0 HG3 LYS C 127 -0.300 3.960 8.478 1.00 0.60 H new ATOM 0 HD2 LYS C 127 0.615 2.139 9.894 1.00 0.93 H new ATOM 0 HD3 LYS C 127 1.958 3.163 10.361 1.00 0.93 H new ATOM 0 HE2 LYS C 127 -0.979 3.510 11.030 1.00 1.17 H new ATOM 0 HE3 LYS C 127 0.364 3.306 12.137 1.00 1.17 H new ATOM 0 HZ1 LYS C 127 -0.107 5.562 12.216 1.00 1.58 H new ATOM 0 HZ2 LYS C 127 1.218 5.495 11.156 1.00 1.58 H new ATOM 0 HZ3 LYS C 127 -0.353 5.691 10.541 1.00 1.58 H new ATOM 1861 N HIS C 128 3.506 1.201 6.667 1.00 0.40 N ATOM 1862 CA HIS C 128 4.144 0.466 5.588 1.00 0.41 C ATOM 1863 C HIS C 128 3.428 0.726 4.270 1.00 0.39 C ATOM 1864 O HIS C 128 2.243 1.052 4.251 1.00 0.39 O ATOM 1865 CB HIS C 128 4.172 -1.047 5.883 1.00 0.51 C ATOM 1866 CG HIS C 128 2.868 -1.760 5.634 1.00 0.56 C ATOM 1867 ND1 HIS C 128 2.448 -2.161 4.379 1.00 0.68 N ATOM 1868 CD2 HIS C 128 1.893 -2.144 6.487 1.00 0.64 C ATOM 1869 CE1 HIS C 128 1.275 -2.753 4.480 1.00 0.78 C ATOM 1870 NE2 HIS C 128 0.914 -2.759 5.748 1.00 0.76 N ATOM 0 H HIS C 128 2.830 0.660 7.206 1.00 0.40 H new ATOM 0 HA HIS C 128 5.173 0.818 5.509 1.00 0.41 H new ATOM 0 HB2 HIS C 128 4.946 -1.509 5.270 1.00 0.51 H new ATOM 0 HB3 HIS C 128 4.459 -1.195 6.924 1.00 0.51 H new ATOM 0 HD1 HIS C 128 2.965 -2.021 3.511 1.00 0.68 H new ATOM 0 HD2 HIS C 128 1.886 -1.994 7.557 1.00 0.64 H new ATOM 0 HE1 HIS C 128 0.704 -3.165 3.661 1.00 0.78 H new ATOM 0 HE2 HIS C 128 0.050 -3.155 6.118 1.00 0.76 H new ATOM 1879 N PHE C 129 4.150 0.558 3.178 1.00 0.39 N ATOM 1880 CA PHE C 129 3.591 0.762 1.851 1.00 0.39 C ATOM 1881 C PHE C 129 3.117 -0.567 1.278 1.00 0.48 C ATOM 1882 O PHE C 129 3.410 -1.630 1.834 1.00 0.56 O ATOM 1883 CB PHE C 129 4.637 1.384 0.923 1.00 0.37 C ATOM 1884 CG PHE C 129 5.113 2.742 1.363 1.00 0.28 C ATOM 1885 CD1 PHE C 129 6.023 2.872 2.401 1.00 0.37 C ATOM 1886 CD2 PHE C 129 4.656 3.885 0.734 1.00 0.21 C ATOM 1887 CE1 PHE C 129 6.466 4.117 2.801 1.00 0.40 C ATOM 1888 CE2 PHE C 129 5.095 5.132 1.131 1.00 0.23 C ATOM 1889 CZ PHE C 129 6.002 5.249 2.164 1.00 0.33 C ATOM 0 H PHE C 129 5.131 0.279 3.183 1.00 0.39 H new ATOM 0 HA PHE C 129 2.743 1.442 1.930 1.00 0.39 H new ATOM 0 HB2 PHE C 129 5.494 0.714 0.857 1.00 0.37 H new ATOM 0 HB3 PHE C 129 4.217 1.464 -0.080 1.00 0.37 H new ATOM 0 HD1 PHE C 129 6.390 1.989 2.903 1.00 0.37 H new ATOM 0 HD2 PHE C 129 3.948 3.801 -0.077 1.00 0.21 H new ATOM 0 HE1 PHE C 129 7.175 4.204 3.611 1.00 0.40 H new ATOM 0 HE2 PHE C 129 4.728 6.017 0.632 1.00 0.23 H new ATOM 0 HZ PHE C 129 6.348 6.224 2.473 1.00 0.33 H new ATOM 1899 N SER C 130 2.374 -0.506 0.186 1.00 0.54 N ATOM 1900 CA SER C 130 1.876 -1.702 -0.466 1.00 0.69 C ATOM 1901 C SER C 130 1.888 -1.519 -1.979 1.00 0.60 C ATOM 1902 O SER C 130 1.934 -0.392 -2.476 1.00 0.80 O ATOM 1903 CB SER C 130 0.466 -2.041 0.028 1.00 0.87 C ATOM 1904 OG SER C 130 0.476 -3.218 0.827 1.00 1.44 O ATOM 0 H SER C 130 2.102 0.365 -0.269 1.00 0.54 H new ATOM 0 HA SER C 130 2.531 -2.535 -0.212 1.00 0.69 H new ATOM 0 HB2 SER C 130 0.069 -1.207 0.607 1.00 0.87 H new ATOM 0 HB3 SER C 130 -0.198 -2.181 -0.825 1.00 0.87 H new ATOM 0 HG SER C 130 0.336 -4.002 0.256 1.00 1.44 H new ATOM 1910 N VAL C 131 1.868 -2.630 -2.703 1.00 0.76 N ATOM 1911 CA VAL C 131 1.883 -2.592 -4.159 1.00 0.73 C ATOM 1912 C VAL C 131 0.586 -1.993 -4.707 1.00 0.65 C ATOM 1913 O VAL C 131 -0.511 -2.489 -4.439 1.00 0.73 O ATOM 1914 CB VAL C 131 2.123 -3.999 -4.761 1.00 0.94 C ATOM 1915 CG1 VAL C 131 1.153 -5.020 -4.182 1.00 1.06 C ATOM 1916 CG2 VAL C 131 2.028 -3.961 -6.281 1.00 0.96 C ATOM 0 H VAL C 131 1.841 -3.569 -2.306 1.00 0.76 H new ATOM 0 HA VAL C 131 2.713 -1.951 -4.457 1.00 0.73 H new ATOM 0 HB VAL C 131 3.132 -4.309 -4.491 1.00 0.94 H new ATOM 0 HG11 VAL C 131 1.347 -5.997 -4.624 1.00 1.06 H new ATOM 0 HG12 VAL C 131 1.287 -5.077 -3.102 1.00 1.06 H new ATOM 0 HG13 VAL C 131 0.130 -4.717 -4.405 1.00 1.06 H new ATOM 0 HG21 VAL C 131 2.200 -4.960 -6.681 1.00 0.96 H new ATOM 0 HG22 VAL C 131 1.036 -3.618 -6.575 1.00 0.96 H new ATOM 0 HG23 VAL C 131 2.780 -3.278 -6.676 1.00 0.96 H new ATOM 1926 N GLY C 132 0.729 -0.912 -5.457 1.00 0.57 N ATOM 1927 CA GLY C 132 -0.420 -0.252 -6.036 1.00 0.58 C ATOM 1928 C GLY C 132 -0.670 1.111 -5.426 1.00 0.52 C ATOM 1929 O GLY C 132 -1.358 1.944 -6.014 1.00 0.61 O ATOM 0 H GLY C 132 1.626 -0.478 -5.676 1.00 0.57 H new ATOM 0 HA2 GLY C 132 -0.271 -0.145 -7.110 1.00 0.58 H new ATOM 0 HA3 GLY C 132 -1.303 -0.877 -5.898 1.00 0.58 H new ATOM 1933 N ASP C 133 -0.108 1.341 -4.247 1.00 0.50 N ATOM 1934 CA ASP C 133 -0.275 2.614 -3.562 1.00 0.49 C ATOM 1935 C ASP C 133 0.759 3.616 -4.059 1.00 0.40 C ATOM 1936 O ASP C 133 1.760 3.234 -4.664 1.00 0.37 O ATOM 1937 CB ASP C 133 -0.146 2.434 -2.045 1.00 0.51 C ATOM 1938 CG ASP C 133 -1.161 1.457 -1.478 1.00 0.73 C ATOM 1939 OD1 ASP C 133 -2.327 1.463 -1.938 1.00 0.85 O ATOM 1940 OD2 ASP C 133 -0.799 0.680 -0.572 1.00 1.06 O ATOM 0 H ASP C 133 0.467 0.663 -3.746 1.00 0.50 H new ATOM 0 HA ASP C 133 -1.273 2.994 -3.781 1.00 0.49 H new ATOM 0 HB2 ASP C 133 0.859 2.084 -1.810 1.00 0.51 H new ATOM 0 HB3 ASP C 133 -0.268 3.401 -1.558 1.00 0.51 H new ATOM 1945 N ARG C 134 0.518 4.892 -3.815 1.00 0.41 N ATOM 1946 CA ARG C 134 1.442 5.933 -4.248 1.00 0.37 C ATOM 1947 C ARG C 134 2.440 6.269 -3.150 1.00 0.31 C ATOM 1948 O ARG C 134 2.130 6.155 -1.965 1.00 0.31 O ATOM 1949 CB ARG C 134 0.669 7.186 -4.659 1.00 0.44 C ATOM 1950 CG ARG C 134 0.092 7.108 -6.060 1.00 0.64 C ATOM 1951 CD ARG C 134 -0.889 8.239 -6.313 1.00 0.78 C ATOM 1952 NE ARG C 134 -1.105 8.475 -7.739 1.00 1.08 N ATOM 1953 CZ ARG C 134 -2.243 8.942 -8.253 1.00 1.74 C ATOM 1954 NH1 ARG C 134 -3.300 9.140 -7.473 1.00 2.09 N ATOM 1955 NH2 ARG C 134 -2.327 9.190 -9.553 1.00 2.18 N ATOM 0 H ARG C 134 -0.306 5.235 -3.321 1.00 0.41 H new ATOM 0 HA ARG C 134 1.997 5.558 -5.108 1.00 0.37 H new ATOM 0 HB2 ARG C 134 -0.142 7.352 -3.949 1.00 0.44 H new ATOM 0 HB3 ARG C 134 1.331 8.049 -4.595 1.00 0.44 H new ATOM 0 HG2 ARG C 134 0.899 7.152 -6.792 1.00 0.64 H new ATOM 0 HG3 ARG C 134 -0.410 6.150 -6.197 1.00 0.64 H new ATOM 0 HD2 ARG C 134 -1.841 8.005 -5.837 1.00 0.78 H new ATOM 0 HD3 ARG C 134 -0.516 9.152 -5.848 1.00 0.78 H new ATOM 0 HE ARG C 134 -0.338 8.270 -8.380 1.00 1.08 H new ATOM 0 HH11 ARG C 134 -3.243 8.935 -6.476 1.00 2.09 H new ATOM 0 HH12 ARG C 134 -4.168 9.498 -7.872 1.00 2.09 H new ATOM 0 HH21 ARG C 134 -1.522 9.023 -10.157 1.00 2.18 H new ATOM 0 HH22 ARG C 134 -3.196 9.547 -9.949 1.00 2.18 H new ATOM 1969 N TYR C 135 3.638 6.681 -3.547 1.00 0.30 N ATOM 1970 CA TYR C 135 4.678 7.032 -2.591 1.00 0.29 C ATOM 1971 C TYR C 135 5.592 8.114 -3.153 1.00 0.31 C ATOM 1972 O TYR C 135 5.663 8.315 -4.370 1.00 0.37 O ATOM 1973 CB TYR C 135 5.500 5.791 -2.209 1.00 0.30 C ATOM 1974 CG TYR C 135 6.639 5.450 -3.156 1.00 0.34 C ATOM 1975 CD1 TYR C 135 6.396 5.085 -4.476 1.00 0.37 C ATOM 1976 CD2 TYR C 135 7.957 5.483 -2.718 1.00 0.42 C ATOM 1977 CE1 TYR C 135 7.436 4.768 -5.331 1.00 0.43 C ATOM 1978 CE2 TYR C 135 9.000 5.169 -3.567 1.00 0.49 C ATOM 1979 CZ TYR C 135 8.734 4.812 -4.872 1.00 0.48 C ATOM 1980 OH TYR C 135 9.771 4.501 -5.722 1.00 0.57 O ATOM 0 H TYR C 135 3.912 6.780 -4.524 1.00 0.30 H new ATOM 0 HA TYR C 135 4.194 7.422 -1.696 1.00 0.29 H new ATOM 0 HB2 TYR C 135 5.912 5.941 -1.211 1.00 0.30 H new ATOM 0 HB3 TYR C 135 4.829 4.934 -2.151 1.00 0.30 H new ATOM 0 HD1 TYR C 135 5.379 5.049 -4.839 1.00 0.37 H new ATOM 0 HD2 TYR C 135 8.170 5.759 -1.696 1.00 0.42 H new ATOM 0 HE1 TYR C 135 7.231 4.487 -6.354 1.00 0.43 H new ATOM 0 HE2 TYR C 135 10.019 5.203 -3.211 1.00 0.49 H new ATOM 0 HH TYR C 135 9.965 3.542 -5.665 1.00 0.57 H new ATOM 1990 N LEU C 136 6.283 8.815 -2.266 1.00 0.32 N ATOM 1991 CA LEU C 136 7.204 9.862 -2.672 1.00 0.40 C ATOM 1992 C LEU C 136 8.474 9.802 -1.829 1.00 0.41 C ATOM 1993 O LEU C 136 8.410 9.708 -0.604 1.00 0.48 O ATOM 1994 CB LEU C 136 6.548 11.239 -2.535 1.00 0.45 C ATOM 1995 CG LEU C 136 7.411 12.422 -2.994 1.00 0.55 C ATOM 1996 CD1 LEU C 136 7.638 12.371 -4.500 1.00 0.63 C ATOM 1997 CD2 LEU C 136 6.763 13.740 -2.596 1.00 0.63 C ATOM 0 H LEU C 136 6.222 8.676 -1.257 1.00 0.32 H new ATOM 0 HA LEU C 136 7.465 9.704 -3.718 1.00 0.40 H new ATOM 0 HB2 LEU C 136 5.622 11.241 -3.109 1.00 0.45 H new ATOM 0 HB3 LEU C 136 6.276 11.392 -1.491 1.00 0.45 H new ATOM 0 HG LEU C 136 8.380 12.351 -2.500 1.00 0.55 H new ATOM 0 HD11 LEU C 136 8.252 13.219 -4.804 1.00 0.63 H new ATOM 0 HD12 LEU C 136 8.146 11.443 -4.760 1.00 0.63 H new ATOM 0 HD13 LEU C 136 6.678 12.415 -5.014 1.00 0.63 H new ATOM 0 HD21 LEU C 136 7.388 14.568 -2.929 1.00 0.63 H new ATOM 0 HD22 LEU C 136 5.780 13.817 -3.061 1.00 0.63 H new ATOM 0 HD23 LEU C 136 6.656 13.780 -1.512 1.00 0.63 H new ATOM 2009 N LEU C 137 9.622 9.825 -2.490 1.00 0.42 N ATOM 2010 CA LEU C 137 10.902 9.787 -1.797 1.00 0.46 C ATOM 2011 C LEU C 137 11.410 11.205 -1.579 1.00 0.46 C ATOM 2012 O LEU C 137 11.497 11.996 -2.523 1.00 0.49 O ATOM 2013 CB LEU C 137 11.924 8.971 -2.598 1.00 0.55 C ATOM 2014 CG LEU C 137 13.372 9.082 -2.107 1.00 0.64 C ATOM 2015 CD1 LEU C 137 13.521 8.521 -0.704 1.00 1.16 C ATOM 2016 CD2 LEU C 137 14.316 8.372 -3.057 1.00 1.06 C ATOM 0 H LEU C 137 9.694 9.870 -3.506 1.00 0.42 H new ATOM 0 HA LEU C 137 10.765 9.305 -0.829 1.00 0.46 H new ATOM 0 HB2 LEU C 137 11.628 7.922 -2.574 1.00 0.55 H new ATOM 0 HB3 LEU C 137 11.884 9.290 -3.640 1.00 0.55 H new ATOM 0 HG LEU C 137 13.632 10.140 -2.080 1.00 0.64 H new ATOM 0 HD11 LEU C 137 14.559 8.614 -0.383 1.00 1.16 H new ATOM 0 HD12 LEU C 137 12.879 9.076 -0.020 1.00 1.16 H new ATOM 0 HD13 LEU C 137 13.233 7.470 -0.700 1.00 1.16 H new ATOM 0 HD21 LEU C 137 15.338 8.463 -2.690 1.00 1.06 H new ATOM 0 HD22 LEU C 137 14.045 7.318 -3.119 1.00 1.06 H new ATOM 0 HD23 LEU C 137 14.244 8.824 -4.046 1.00 1.06 H new ATOM 2028 N ILE C 138 11.725 11.531 -0.335 1.00 0.49 N ATOM 2029 CA ILE C 138 12.220 12.858 -0.006 1.00 0.54 C ATOM 2030 C ILE C 138 13.750 12.850 -0.031 1.00 0.58 C ATOM 2031 O ILE C 138 14.355 12.159 -0.850 1.00 0.73 O ATOM 2032 CB ILE C 138 11.705 13.340 1.376 1.00 0.53 C ATOM 2033 CG1 ILE C 138 10.301 12.784 1.656 1.00 0.61 C ATOM 2034 CG2 ILE C 138 11.681 14.867 1.438 1.00 0.64 C ATOM 2035 CD1 ILE C 138 9.233 13.297 0.707 1.00 0.77 C ATOM 0 H ILE C 138 11.647 10.897 0.461 1.00 0.49 H new ATOM 0 HA ILE C 138 11.843 13.557 -0.752 1.00 0.54 H new ATOM 0 HB ILE C 138 12.388 12.967 2.139 1.00 0.53 H new ATOM 0 HG12 ILE C 138 10.334 11.696 1.596 1.00 0.61 H new ATOM 0 HG13 ILE C 138 10.018 13.039 2.677 1.00 0.61 H new ATOM 0 HG21 ILE C 138 11.317 15.186 2.415 1.00 0.64 H new ATOM 0 HG22 ILE C 138 12.688 15.253 1.282 1.00 0.64 H new ATOM 0 HG23 ILE C 138 11.021 15.252 0.661 1.00 0.64 H new ATOM 0 HD11 ILE C 138 8.271 12.858 0.971 1.00 0.77 H new ATOM 0 HD12 ILE C 138 9.170 14.383 0.783 1.00 0.77 H new ATOM 0 HD13 ILE C 138 9.491 13.019 -0.315 1.00 0.77 H new ATOM 2047 N ASN C 139 14.369 13.606 0.860 1.00 0.70 N ATOM 2048 CA ASN C 139 15.821 13.676 0.918 1.00 0.73 C ATOM 2049 C ASN C 139 16.368 12.638 1.886 1.00 0.66 C ATOM 2050 O ASN C 139 17.531 12.245 1.806 1.00 0.84 O ATOM 2051 CB ASN C 139 16.263 15.077 1.345 1.00 0.90 C ATOM 2052 CG ASN C 139 15.896 16.141 0.327 1.00 1.04 C ATOM 2053 OD1 ASN C 139 15.855 15.881 -0.875 1.00 1.12 O ATOM 2054 ND2 ASN C 139 15.627 17.349 0.800 1.00 1.32 N ATOM 0 H ASN C 139 13.890 14.180 1.553 1.00 0.70 H new ATOM 0 HA ASN C 139 16.218 13.466 -0.075 1.00 0.73 H new ATOM 0 HB2 ASN C 139 15.804 15.322 2.303 1.00 0.90 H new ATOM 0 HB3 ASN C 139 17.342 15.083 1.498 1.00 0.90 H new ATOM 0 HD21 ASN C 139 15.375 18.103 0.160 1.00 1.32 H new ATOM 0 HD22 ASN C 139 15.672 17.525 1.804 1.00 1.32 H new ATOM 2061 N SER C 140 15.519 12.191 2.798 1.00 0.57 N ATOM 2062 CA SER C 140 15.914 11.203 3.787 1.00 0.61 C ATOM 2063 C SER C 140 15.043 9.951 3.689 1.00 0.54 C ATOM 2064 O SER C 140 15.461 8.931 3.139 1.00 0.68 O ATOM 2065 CB SER C 140 15.814 11.812 5.188 1.00 0.76 C ATOM 2066 OG SER C 140 15.108 13.042 5.154 1.00 1.04 O ATOM 0 H SER C 140 14.549 12.498 2.873 1.00 0.57 H new ATOM 0 HA SER C 140 16.946 10.909 3.593 1.00 0.61 H new ATOM 0 HB2 SER C 140 15.308 11.116 5.857 1.00 0.76 H new ATOM 0 HB3 SER C 140 16.814 11.972 5.592 1.00 0.76 H new ATOM 0 HG SER C 140 15.054 13.413 6.059 1.00 1.04 H new ATOM 2072 N ASP C 141 13.821 10.049 4.202 1.00 0.53 N ATOM 2073 CA ASP C 141 12.887 8.927 4.193 1.00 0.48 C ATOM 2074 C ASP C 141 11.845 9.089 3.094 1.00 0.41 C ATOM 2075 O ASP C 141 11.948 9.982 2.247 1.00 0.46 O ATOM 2076 CB ASP C 141 12.189 8.804 5.552 1.00 0.49 C ATOM 2077 CG ASP C 141 12.756 7.688 6.406 1.00 0.72 C ATOM 2078 OD1 ASP C 141 13.793 7.903 7.072 1.00 1.06 O ATOM 2079 OD2 ASP C 141 12.158 6.595 6.439 1.00 1.10 O ATOM 0 H ASP C 141 13.452 10.898 4.631 1.00 0.53 H new ATOM 0 HA ASP C 141 13.458 8.019 3.997 1.00 0.48 H new ATOM 0 HB2 ASP C 141 12.281 9.748 6.089 1.00 0.49 H new ATOM 0 HB3 ASP C 141 11.125 8.629 5.394 1.00 0.49 H new ATOM 2084 N ILE C 142 10.841 8.223 3.114 1.00 0.37 N ATOM 2085 CA ILE C 142 9.768 8.253 2.129 1.00 0.32 C ATOM 2086 C ILE C 142 8.452 8.647 2.789 1.00 0.30 C ATOM 2087 O ILE C 142 8.324 8.587 4.009 1.00 0.32 O ATOM 2088 CB ILE C 142 9.585 6.889 1.418 1.00 0.31 C ATOM 2089 CG1 ILE C 142 9.609 5.727 2.427 1.00 0.37 C ATOM 2090 CG2 ILE C 142 10.641 6.703 0.341 1.00 0.38 C ATOM 2091 CD1 ILE C 142 10.985 5.143 2.694 1.00 0.45 C ATOM 0 H ILE C 142 10.747 7.483 3.810 1.00 0.37 H new ATOM 0 HA ILE C 142 10.050 8.993 1.380 1.00 0.32 H new ATOM 0 HB ILE C 142 8.606 6.885 0.938 1.00 0.31 H new ATOM 0 HG12 ILE C 142 9.188 6.075 3.370 1.00 0.37 H new ATOM 0 HG13 ILE C 142 8.958 4.933 2.061 1.00 0.37 H new ATOM 0 HG21 ILE C 142 10.497 5.739 -0.148 1.00 0.38 H new ATOM 0 HG22 ILE C 142 10.553 7.501 -0.397 1.00 0.38 H new ATOM 0 HG23 ILE C 142 11.632 6.735 0.794 1.00 0.38 H new ATOM 0 HD11 ILE C 142 10.902 4.331 3.417 1.00 0.45 H new ATOM 0 HD12 ILE C 142 11.404 4.759 1.764 1.00 0.45 H new ATOM 0 HD13 ILE C 142 11.638 5.919 3.094 1.00 0.45 H new ATOM 2103 N VAL C 143 7.487 9.063 1.985 1.00 0.29 N ATOM 2104 CA VAL C 143 6.182 9.464 2.494 1.00 0.28 C ATOM 2105 C VAL C 143 5.074 8.760 1.710 1.00 0.24 C ATOM 2106 O VAL C 143 5.244 8.469 0.521 1.00 0.23 O ATOM 2107 CB VAL C 143 6.001 11.000 2.411 1.00 0.34 C ATOM 2108 CG1 VAL C 143 4.622 11.430 2.891 1.00 0.37 C ATOM 2109 CG2 VAL C 143 7.082 11.705 3.217 1.00 0.45 C ATOM 0 H VAL C 143 7.582 9.133 0.972 1.00 0.29 H new ATOM 0 HA VAL C 143 6.120 9.171 3.542 1.00 0.28 H new ATOM 0 HB VAL C 143 6.093 11.287 1.363 1.00 0.34 H new ATOM 0 HG11 VAL C 143 4.533 12.514 2.818 1.00 0.37 H new ATOM 0 HG12 VAL C 143 3.858 10.960 2.271 1.00 0.37 H new ATOM 0 HG13 VAL C 143 4.486 11.124 3.928 1.00 0.37 H new ATOM 0 HG21 VAL C 143 6.941 12.784 3.149 1.00 0.45 H new ATOM 0 HG22 VAL C 143 7.018 11.396 4.260 1.00 0.45 H new ATOM 0 HG23 VAL C 143 8.062 11.441 2.820 1.00 0.45 H new ATOM 2119 N CYS C 144 3.963 8.469 2.385 1.00 0.23 N ATOM 2120 CA CYS C 144 2.830 7.793 1.766 1.00 0.21 C ATOM 2121 C CYS C 144 2.021 8.747 0.893 1.00 0.20 C ATOM 2122 O CYS C 144 2.496 9.806 0.496 1.00 0.32 O ATOM 2123 CB CYS C 144 1.921 7.199 2.847 1.00 0.26 C ATOM 2124 SG CYS C 144 1.125 8.441 3.921 1.00 0.32 S ATOM 0 H CYS C 144 3.826 8.695 3.370 1.00 0.23 H new ATOM 0 HA CYS C 144 3.223 6.997 1.133 1.00 0.21 H new ATOM 0 HB2 CYS C 144 1.147 6.601 2.366 1.00 0.26 H new ATOM 0 HB3 CYS C 144 2.508 6.521 3.467 1.00 0.26 H new ATOM 0 HG CYS C 144 1.229 8.071 5.163 1.00 0.32 H new ATOM 2129 N GLU C 145 0.793 8.352 0.595 1.00 0.21 N ATOM 2130 CA GLU C 145 -0.101 9.169 -0.207 1.00 0.22 C ATOM 2131 C GLU C 145 -1.251 9.679 0.654 1.00 0.26 C ATOM 2132 O GLU C 145 -2.087 10.467 0.201 1.00 0.28 O ATOM 2133 CB GLU C 145 -0.648 8.366 -1.390 1.00 0.25 C ATOM 2134 CG GLU C 145 -1.456 7.146 -0.972 1.00 0.29 C ATOM 2135 CD GLU C 145 -2.351 6.629 -2.074 1.00 0.49 C ATOM 2136 OE1 GLU C 145 -3.482 7.142 -2.220 1.00 0.59 O ATOM 2137 OE2 GLU C 145 -1.941 5.694 -2.789 1.00 0.95 O ATOM 0 H GLU C 145 0.392 7.465 0.899 1.00 0.21 H new ATOM 0 HA GLU C 145 0.460 10.019 -0.596 1.00 0.22 H new ATOM 0 HB2 GLU C 145 -1.275 9.015 -2.001 1.00 0.25 H new ATOM 0 HB3 GLU C 145 0.184 8.044 -2.016 1.00 0.25 H new ATOM 0 HG2 GLU C 145 -0.775 6.354 -0.662 1.00 0.29 H new ATOM 0 HG3 GLU C 145 -2.065 7.400 -0.105 1.00 0.29 H new ATOM 2144 N GLN C 146 -1.268 9.249 1.912 1.00 0.31 N ATOM 2145 CA GLN C 146 -2.325 9.633 2.832 1.00 0.38 C ATOM 2146 C GLN C 146 -1.985 10.936 3.546 1.00 0.38 C ATOM 2147 O GLN C 146 -2.852 11.793 3.740 1.00 0.46 O ATOM 2148 CB GLN C 146 -2.579 8.518 3.850 1.00 0.44 C ATOM 2149 CG GLN C 146 -3.959 8.587 4.482 1.00 0.67 C ATOM 2150 CD GLN C 146 -3.924 8.999 5.940 1.00 0.83 C ATOM 2151 OE1 GLN C 146 -3.937 8.157 6.838 1.00 0.86 O ATOM 2152 NE2 GLN C 146 -3.873 10.297 6.183 1.00 1.34 N ATOM 0 H GLN C 146 -0.560 8.635 2.314 1.00 0.31 H new ATOM 0 HA GLN C 146 -3.234 9.793 2.252 1.00 0.38 H new ATOM 0 HB2 GLN C 146 -2.459 7.552 3.359 1.00 0.44 H new ATOM 0 HB3 GLN C 146 -1.824 8.572 4.634 1.00 0.44 H new ATOM 0 HG2 GLN C 146 -4.572 9.295 3.925 1.00 0.67 H new ATOM 0 HG3 GLN C 146 -4.440 7.613 4.397 1.00 0.67 H new ATOM 0 HE21 GLN C 146 -3.864 10.961 5.409 1.00 1.34 H new ATOM 0 HE22 GLN C 146 -3.843 10.635 7.145 1.00 1.34 H new ATOM 2161 N ASP C 147 -0.729 11.091 3.941 1.00 0.33 N ATOM 2162 CA ASP C 147 -0.311 12.304 4.636 1.00 0.35 C ATOM 2163 C ASP C 147 0.659 13.131 3.793 1.00 0.33 C ATOM 2164 O ASP C 147 1.137 14.182 4.231 1.00 0.38 O ATOM 2165 CB ASP C 147 0.292 11.978 6.013 1.00 0.40 C ATOM 2166 CG ASP C 147 1.600 11.198 5.966 1.00 0.38 C ATOM 2167 OD1 ASP C 147 2.520 11.624 5.241 1.00 0.38 O ATOM 2168 OD2 ASP C 147 1.721 10.195 6.712 1.00 0.40 O ATOM 0 H ASP C 147 0.010 10.404 3.796 1.00 0.33 H new ATOM 0 HA ASP C 147 -1.203 12.909 4.796 1.00 0.35 H new ATOM 0 HB2 ASP C 147 0.460 12.911 6.551 1.00 0.40 H new ATOM 0 HB3 ASP C 147 -0.436 11.406 6.587 1.00 0.40 H new ATOM 2173 N ILE C 148 0.910 12.674 2.566 1.00 0.29 N ATOM 2174 CA ILE C 148 1.819 13.359 1.645 1.00 0.30 C ATOM 2175 C ILE C 148 1.389 14.805 1.399 1.00 0.33 C ATOM 2176 O ILE C 148 2.226 15.686 1.196 1.00 0.38 O ATOM 2177 CB ILE C 148 1.905 12.625 0.284 1.00 0.28 C ATOM 2178 CG1 ILE C 148 2.977 13.261 -0.608 1.00 0.35 C ATOM 2179 CG2 ILE C 148 0.550 12.627 -0.421 1.00 0.26 C ATOM 2180 CD1 ILE C 148 3.134 12.575 -1.947 1.00 0.65 C ATOM 0 H ILE C 148 0.493 11.825 2.184 1.00 0.29 H new ATOM 0 HA ILE C 148 2.800 13.354 2.121 1.00 0.30 H new ATOM 0 HB ILE C 148 2.188 11.590 0.476 1.00 0.28 H new ATOM 0 HG12 ILE C 148 2.726 14.309 -0.773 1.00 0.35 H new ATOM 0 HG13 ILE C 148 3.933 13.241 -0.084 1.00 0.35 H new ATOM 0 HG21 ILE C 148 0.635 12.106 -1.375 1.00 0.26 H new ATOM 0 HG22 ILE C 148 -0.186 12.122 0.204 1.00 0.26 H new ATOM 0 HG23 ILE C 148 0.233 13.655 -0.596 1.00 0.26 H new ATOM 0 HD11 ILE C 148 3.909 13.078 -2.525 1.00 0.65 H new ATOM 0 HD12 ILE C 148 3.416 11.534 -1.791 1.00 0.65 H new ATOM 0 HD13 ILE C 148 2.190 12.618 -2.491 1.00 0.65 H new ATOM 2192 N TYR C 149 0.084 15.045 1.447 1.00 0.33 N ATOM 2193 CA TYR C 149 -0.457 16.375 1.210 1.00 0.38 C ATOM 2194 C TYR C 149 0.010 17.356 2.280 1.00 0.45 C ATOM 2195 O TYR C 149 0.182 18.542 2.015 1.00 0.52 O ATOM 2196 CB TYR C 149 -1.987 16.321 1.166 1.00 0.42 C ATOM 2197 CG TYR C 149 -2.622 17.523 0.500 1.00 0.51 C ATOM 2198 CD1 TYR C 149 -2.220 17.932 -0.765 1.00 0.61 C ATOM 2199 CD2 TYR C 149 -3.620 18.247 1.136 1.00 0.68 C ATOM 2200 CE1 TYR C 149 -2.796 19.028 -1.377 1.00 0.75 C ATOM 2201 CE2 TYR C 149 -4.203 19.345 0.530 1.00 0.79 C ATOM 2202 CZ TYR C 149 -3.785 19.732 -0.726 1.00 0.77 C ATOM 2203 OH TYR C 149 -4.362 20.822 -1.336 1.00 0.93 O ATOM 0 H TYR C 149 -0.619 14.334 1.648 1.00 0.33 H new ATOM 0 HA TYR C 149 -0.087 16.727 0.247 1.00 0.38 H new ATOM 0 HB2 TYR C 149 -2.294 15.419 0.636 1.00 0.42 H new ATOM 0 HB3 TYR C 149 -2.368 16.238 2.184 1.00 0.42 H new ATOM 0 HD1 TYR C 149 -1.444 17.384 -1.279 1.00 0.61 H new ATOM 0 HD2 TYR C 149 -3.947 17.948 2.121 1.00 0.68 H new ATOM 0 HE1 TYR C 149 -2.472 19.332 -2.362 1.00 0.75 H new ATOM 0 HE2 TYR C 149 -4.981 19.896 1.037 1.00 0.79 H new ATOM 0 HH TYR C 149 -5.043 21.206 -0.744 1.00 0.93 H new ATOM 2213 N GLU C 150 0.239 16.852 3.482 1.00 0.49 N ATOM 2214 CA GLU C 150 0.686 17.692 4.582 1.00 0.59 C ATOM 2215 C GLU C 150 2.193 17.886 4.519 1.00 0.60 C ATOM 2216 O GLU C 150 2.685 19.008 4.620 1.00 0.70 O ATOM 2217 CB GLU C 150 0.286 17.081 5.926 1.00 0.66 C ATOM 2218 CG GLU C 150 -1.210 17.085 6.162 1.00 0.76 C ATOM 2219 CD GLU C 150 -1.590 16.543 7.522 1.00 1.13 C ATOM 2220 OE1 GLU C 150 -1.399 17.256 8.528 1.00 1.67 O ATOM 2221 OE2 GLU C 150 -2.104 15.405 7.587 1.00 1.48 O ATOM 0 H GLU C 150 0.123 15.867 3.721 1.00 0.49 H new ATOM 0 HA GLU C 150 0.203 18.665 4.489 1.00 0.59 H new ATOM 0 HB2 GLU C 150 0.652 16.056 5.975 1.00 0.66 H new ATOM 0 HB3 GLU C 150 0.775 17.633 6.729 1.00 0.66 H new ATOM 0 HG2 GLU C 150 -1.586 18.103 6.064 1.00 0.76 H new ATOM 0 HG3 GLU C 150 -1.697 16.490 5.390 1.00 0.76 H new ATOM 2228 N TRP C 151 2.911 16.787 4.316 1.00 0.52 N ATOM 2229 CA TRP C 151 4.368 16.814 4.242 1.00 0.54 C ATOM 2230 C TRP C 151 4.854 17.818 3.197 1.00 0.60 C ATOM 2231 O TRP C 151 5.809 18.560 3.437 1.00 0.68 O ATOM 2232 CB TRP C 151 4.907 15.418 3.914 1.00 0.46 C ATOM 2233 CG TRP C 151 6.380 15.275 4.145 1.00 0.50 C ATOM 2234 CD1 TRP C 151 7.375 15.406 3.218 1.00 0.55 C ATOM 2235 CD2 TRP C 151 7.024 14.967 5.386 1.00 0.56 C ATOM 2236 NE1 TRP C 151 8.598 15.203 3.810 1.00 0.63 N ATOM 2237 CE2 TRP C 151 8.408 14.930 5.140 1.00 0.63 C ATOM 2238 CE3 TRP C 151 6.561 14.716 6.682 1.00 0.62 C ATOM 2239 CZ2 TRP C 151 9.334 14.658 6.141 1.00 0.73 C ATOM 2240 CZ3 TRP C 151 7.481 14.448 7.675 1.00 0.73 C ATOM 2241 CH2 TRP C 151 8.854 14.418 7.400 1.00 0.77 C ATOM 0 H TRP C 151 2.504 15.859 4.199 1.00 0.52 H new ATOM 0 HA TRP C 151 4.746 17.128 5.215 1.00 0.54 H new ATOM 0 HB2 TRP C 151 4.379 14.682 4.521 1.00 0.46 H new ATOM 0 HB3 TRP C 151 4.687 15.188 2.871 1.00 0.46 H new ATOM 0 HD1 TRP C 151 7.223 15.635 2.174 1.00 0.55 H new ATOM 0 HE1 TRP C 151 9.501 15.248 3.337 1.00 0.63 H new ATOM 0 HE3 TRP C 151 5.504 14.732 6.901 1.00 0.62 H new ATOM 0 HZ2 TRP C 151 10.393 14.637 5.933 1.00 0.73 H new ATOM 0 HZ3 TRP C 151 7.137 14.258 8.681 1.00 0.73 H new ATOM 0 HH2 TRP C 151 9.548 14.201 8.198 1.00 0.77 H new ATOM 2252 N THR C 152 4.179 17.852 2.053 1.00 0.58 N ATOM 2253 CA THR C 152 4.550 18.753 0.970 1.00 0.65 C ATOM 2254 C THR C 152 4.245 20.210 1.316 1.00 0.75 C ATOM 2255 O THR C 152 5.022 21.103 1.004 1.00 0.85 O ATOM 2256 CB THR C 152 3.830 18.372 -0.337 1.00 0.62 C ATOM 2257 OG1 THR C 152 2.471 18.010 -0.058 1.00 0.53 O ATOM 2258 CG2 THR C 152 4.537 17.215 -1.027 1.00 0.60 C ATOM 0 H THR C 152 3.370 17.264 1.852 1.00 0.58 H new ATOM 0 HA THR C 152 5.626 18.651 0.829 1.00 0.65 H new ATOM 0 HB THR C 152 3.848 19.235 -1.002 1.00 0.62 H new ATOM 0 HG1 THR C 152 2.413 17.042 0.084 1.00 0.53 H new ATOM 0 HG21 THR C 152 4.010 16.964 -1.948 1.00 0.60 H new ATOM 0 HG22 THR C 152 5.562 17.503 -1.262 1.00 0.60 H new ATOM 0 HG23 THR C 152 4.546 16.348 -0.366 1.00 0.60 H new ATOM 2266 N LYS C 153 3.114 20.444 1.970 1.00 0.77 N ATOM 2267 CA LYS C 153 2.724 21.800 2.351 1.00 0.87 C ATOM 2268 C LYS C 153 3.633 22.346 3.448 1.00 0.93 C ATOM 2269 O LYS C 153 3.932 23.542 3.485 1.00 1.04 O ATOM 2270 CB LYS C 153 1.266 21.836 2.815 1.00 0.87 C ATOM 2271 CG LYS C 153 0.269 21.558 1.701 1.00 0.83 C ATOM 2272 CD LYS C 153 -1.163 21.840 2.139 1.00 0.92 C ATOM 2273 CE LYS C 153 -1.674 20.796 3.119 1.00 0.90 C ATOM 2274 NZ LYS C 153 -3.084 21.049 3.521 1.00 1.14 N ATOM 0 H LYS C 153 2.453 19.719 2.247 1.00 0.77 H new ATOM 0 HA LYS C 153 2.828 22.433 1.469 1.00 0.87 H new ATOM 0 HB2 LYS C 153 1.127 21.101 3.608 1.00 0.87 H new ATOM 0 HB3 LYS C 153 1.054 22.814 3.246 1.00 0.87 H new ATOM 0 HG2 LYS C 153 0.512 22.173 0.834 1.00 0.83 H new ATOM 0 HG3 LYS C 153 0.355 20.518 1.388 1.00 0.83 H new ATOM 0 HD2 LYS C 153 -1.214 22.826 2.601 1.00 0.92 H new ATOM 0 HD3 LYS C 153 -1.812 21.864 1.264 1.00 0.92 H new ATOM 0 HE2 LYS C 153 -1.598 19.807 2.667 1.00 0.90 H new ATOM 0 HE3 LYS C 153 -1.040 20.791 4.006 1.00 0.90 H new ATOM 0 HZ1 LYS C 153 -3.276 20.578 4.428 1.00 1.14 H new ATOM 0 HZ2 LYS C 153 -3.238 22.073 3.623 1.00 1.14 H new ATOM 0 HZ3 LYS C 153 -3.725 20.674 2.793 1.00 1.14 H new ATOM 2288 N ILE C 154 4.070 21.463 4.332 1.00 0.88 N ATOM 2289 CA ILE C 154 4.946 21.847 5.433 1.00 0.95 C ATOM 2290 C ILE C 154 6.369 22.107 4.941 1.00 0.98 C ATOM 2291 O ILE C 154 6.960 23.138 5.251 1.00 1.10 O ATOM 2292 CB ILE C 154 4.974 20.758 6.530 1.00 0.91 C ATOM 2293 CG1 ILE C 154 3.579 20.582 7.138 1.00 0.91 C ATOM 2294 CG2 ILE C 154 5.992 21.102 7.612 1.00 1.02 C ATOM 2295 CD1 ILE C 154 3.449 19.355 8.015 1.00 0.90 C ATOM 0 H ILE C 154 3.832 20.471 4.310 1.00 0.88 H new ATOM 0 HA ILE C 154 4.544 22.767 5.857 1.00 0.95 H new ATOM 0 HB ILE C 154 5.276 19.816 6.071 1.00 0.91 H new ATOM 0 HG12 ILE C 154 3.334 21.466 7.727 1.00 0.91 H new ATOM 0 HG13 ILE C 154 2.846 20.522 6.333 1.00 0.91 H new ATOM 0 HG21 ILE C 154 5.993 20.321 8.372 1.00 1.02 H new ATOM 0 HG22 ILE C 154 6.984 21.177 7.167 1.00 1.02 H new ATOM 0 HG23 ILE C 154 5.727 22.055 8.071 1.00 1.02 H new ATOM 0 HD11 ILE C 154 2.435 19.296 8.410 1.00 0.90 H new ATOM 0 HD12 ILE C 154 3.661 18.463 7.426 1.00 0.90 H new ATOM 0 HD13 ILE C 154 4.157 19.422 8.841 1.00 0.90 H new ATOM 2307 N ASN C 155 6.907 21.180 4.156 1.00 0.93 N ATOM 2308 CA ASN C 155 8.272 21.309 3.642 1.00 0.96 C ATOM 2309 C ASN C 155 8.353 22.309 2.495 1.00 1.05 C ATOM 2310 O ASN C 155 9.419 22.858 2.212 1.00 1.16 O ATOM 2311 CB ASN C 155 8.804 19.945 3.188 1.00 0.90 C ATOM 2312 CG ASN C 155 9.236 19.081 4.354 1.00 0.86 C ATOM 2313 OD1 ASN C 155 10.388 19.124 4.788 1.00 1.13 O ATOM 2314 ND2 ASN C 155 8.312 18.289 4.874 1.00 0.90 N ATOM 0 H ASN C 155 6.423 20.332 3.861 1.00 0.93 H new ATOM 0 HA ASN C 155 8.892 21.684 4.456 1.00 0.96 H new ATOM 0 HB2 ASN C 155 8.031 19.426 2.621 1.00 0.90 H new ATOM 0 HB3 ASN C 155 9.649 20.092 2.515 1.00 0.90 H new ATOM 0 HD21 ASN C 155 8.543 17.685 5.663 1.00 0.90 H new ATOM 0 HD22 ASN C 155 7.369 18.282 4.486 1.00 0.90 H new ATOM 2321 N GLY C 156 7.227 22.547 1.840 1.00 1.07 N ATOM 2322 CA GLY C 156 7.196 23.480 0.732 1.00 1.18 C ATOM 2323 C GLY C 156 7.141 22.766 -0.600 1.00 1.12 C ATOM 2324 O GLY C 156 7.950 21.875 -0.865 1.00 1.47 O ATOM 0 H GLY C 156 6.331 22.110 2.056 1.00 1.07 H new ATOM 0 HA2 GLY C 156 6.329 24.133 0.831 1.00 1.18 H new ATOM 0 HA3 GLY C 156 8.080 24.116 0.767 1.00 1.18 H new ATOM 2328 N GLY C 157 6.174 23.133 -1.428 1.00 1.06 N ATOM 2329 CA GLY C 157 6.044 22.510 -2.731 1.00 1.02 C ATOM 2330 C GLY C 157 4.603 22.215 -3.097 1.00 0.95 C ATOM 2331 O GLY C 157 4.295 21.154 -3.640 1.00 1.21 O ATOM 0 H GLY C 157 5.478 23.850 -1.222 1.00 1.06 H new ATOM 0 HA2 GLY C 157 6.480 23.163 -3.487 1.00 1.02 H new ATOM 0 HA3 GLY C 157 6.615 21.582 -2.744 1.00 1.02 H new ATOM 2335 N SER C 158 3.718 23.154 -2.804 1.00 0.91 N ATOM 2336 CA SER C 158 2.303 22.995 -3.107 1.00 0.85 C ATOM 2337 C SER C 158 1.955 23.692 -4.421 1.00 0.93 C ATOM 2338 O SER C 158 2.336 24.842 -4.642 1.00 1.15 O ATOM 2339 CB SER C 158 1.461 23.564 -1.965 1.00 0.89 C ATOM 2340 OG SER C 158 1.977 23.153 -0.709 1.00 0.93 O ATOM 0 H SER C 158 3.955 24.038 -2.355 1.00 0.91 H new ATOM 0 HA SER C 158 2.084 21.933 -3.215 1.00 0.85 H new ATOM 0 HB2 SER C 158 1.451 24.653 -2.021 1.00 0.89 H new ATOM 0 HB3 SER C 158 0.428 23.230 -2.066 1.00 0.89 H new ATOM 0 HG SER C 158 1.786 23.840 -0.036 1.00 0.93 H new ATOM 2346 N GLY C 159 1.234 22.996 -5.292 1.00 0.84 N ATOM 2347 CA GLY C 159 0.860 23.571 -6.572 1.00 0.93 C ATOM 2348 C GLY C 159 -0.556 24.112 -6.570 1.00 0.89 C ATOM 2349 O GLY C 159 -1.257 24.051 -7.581 1.00 0.98 O ATOM 0 H GLY C 159 0.902 22.044 -5.136 1.00 0.84 H new ATOM 0 HA2 GLY C 159 1.553 24.374 -6.823 1.00 0.93 H new ATOM 0 HA3 GLY C 159 0.956 22.813 -7.350 1.00 0.93 H new ATOM 2353 N GLY C 160 -0.975 24.651 -5.433 1.00 0.84 N ATOM 2354 CA GLY C 160 -2.314 25.186 -5.314 1.00 0.85 C ATOM 2355 C GLY C 160 -3.292 24.145 -4.809 1.00 0.82 C ATOM 2356 O GLY C 160 -3.116 22.949 -5.053 1.00 0.90 O ATOM 0 H GLY C 160 -0.408 24.727 -4.589 1.00 0.84 H new ATOM 0 HA2 GLY C 160 -2.306 26.038 -4.634 1.00 0.85 H new ATOM 0 HA3 GLY C 160 -2.645 25.556 -6.284 1.00 0.85 H new ATOM 2360 N SER C 161 -4.321 24.594 -4.111 1.00 0.78 N ATOM 2361 CA SER C 161 -5.323 23.694 -3.567 1.00 0.77 C ATOM 2362 C SER C 161 -6.242 23.172 -4.669 1.00 0.71 C ATOM 2363 O SER C 161 -7.260 23.788 -4.995 1.00 0.83 O ATOM 2364 CB SER C 161 -6.130 24.417 -2.491 1.00 0.85 C ATOM 2365 OG SER C 161 -5.944 25.823 -2.581 1.00 1.04 O ATOM 0 H SER C 161 -4.485 25.580 -3.907 1.00 0.78 H new ATOM 0 HA SER C 161 -4.820 22.836 -3.120 1.00 0.77 H new ATOM 0 HB2 SER C 161 -7.188 24.178 -2.601 1.00 0.85 H new ATOM 0 HB3 SER C 161 -5.825 24.068 -1.505 1.00 0.85 H new ATOM 0 HG SER C 161 -5.112 26.073 -2.128 1.00 1.04 H new ATOM 2371 N GLY C 162 -5.860 22.047 -5.255 1.00 0.68 N ATOM 2372 CA GLY C 162 -6.652 21.453 -6.311 1.00 0.67 C ATOM 2373 C GLY C 162 -5.866 21.277 -7.593 1.00 0.70 C ATOM 2374 O GLY C 162 -6.280 20.541 -8.490 1.00 0.78 O ATOM 0 H GLY C 162 -5.012 21.533 -5.016 1.00 0.68 H new ATOM 0 HA2 GLY C 162 -7.025 20.483 -5.980 1.00 0.67 H new ATOM 0 HA3 GLY C 162 -7.522 22.080 -6.505 1.00 0.67 H new ATOM 2378 N GLY C 163 -4.721 21.941 -7.671 1.00 0.73 N ATOM 2379 CA GLY C 163 -3.891 21.856 -8.856 1.00 0.80 C ATOM 2380 C GLY C 163 -2.778 20.835 -8.719 1.00 0.79 C ATOM 2381 O GLY C 163 -2.714 20.104 -7.726 1.00 0.79 O ATOM 0 H GLY C 163 -4.351 22.539 -6.932 1.00 0.73 H new ATOM 0 HA2 GLY C 163 -4.513 21.596 -9.713 1.00 0.80 H new ATOM 0 HA3 GLY C 163 -3.457 22.835 -9.062 1.00 0.80 H new ATOM 2385 N SER C 164 -1.904 20.785 -9.716 1.00 0.87 N ATOM 2386 CA SER C 164 -0.786 19.851 -9.714 1.00 0.90 C ATOM 2387 C SER C 164 0.432 20.484 -9.047 1.00 0.81 C ATOM 2388 O SER C 164 0.649 21.691 -9.155 1.00 0.93 O ATOM 2389 CB SER C 164 -0.445 19.437 -11.148 1.00 1.13 C ATOM 2390 OG SER C 164 -1.621 19.160 -11.894 1.00 1.30 O ATOM 0 H SER C 164 -1.949 21.384 -10.540 1.00 0.87 H new ATOM 0 HA SER C 164 -1.072 18.964 -9.148 1.00 0.90 H new ATOM 0 HB2 SER C 164 0.119 20.232 -11.635 1.00 1.13 H new ATOM 0 HB3 SER C 164 0.196 18.555 -11.133 1.00 1.13 H new ATOM 0 HG SER C 164 -1.376 18.900 -12.806 1.00 1.30 H new ATOM 2396 N GLY C 165 1.217 19.671 -8.353 1.00 0.76 N ATOM 2397 CA GLY C 165 2.397 20.178 -7.681 1.00 0.78 C ATOM 2398 C GLY C 165 3.659 19.487 -8.146 1.00 0.81 C ATOM 2399 O GLY C 165 4.479 20.081 -8.846 1.00 1.14 O ATOM 0 H GLY C 165 1.058 18.669 -8.243 1.00 0.76 H new ATOM 0 HA2 GLY C 165 2.484 21.249 -7.861 1.00 0.78 H new ATOM 0 HA3 GLY C 165 2.286 20.044 -6.605 1.00 0.78 H new ATOM 2403 N GLY C 166 3.808 18.231 -7.762 1.00 0.87 N ATOM 2404 CA GLY C 166 4.971 17.466 -8.149 1.00 0.96 C ATOM 2405 C GLY C 166 4.592 16.114 -8.716 1.00 0.98 C ATOM 2406 O GLY C 166 3.415 15.745 -8.715 1.00 1.12 O ATOM 0 H GLY C 166 3.138 17.724 -7.184 1.00 0.87 H new ATOM 0 HA2 GLY C 166 5.543 18.024 -8.891 1.00 0.96 H new ATOM 0 HA3 GLY C 166 5.620 17.328 -7.284 1.00 0.96 H new ATOM 2410 N ASP C 167 5.584 15.373 -9.189 1.00 0.97 N ATOM 2411 CA ASP C 167 5.349 14.053 -9.768 1.00 1.02 C ATOM 2412 C ASP C 167 5.313 12.994 -8.679 1.00 0.87 C ATOM 2413 O ASP C 167 6.172 12.969 -7.801 1.00 1.07 O ATOM 2414 CB ASP C 167 6.439 13.697 -10.783 1.00 1.25 C ATOM 2415 CG ASP C 167 6.421 14.593 -12.001 1.00 1.16 C ATOM 2416 OD1 ASP C 167 5.434 14.554 -12.761 1.00 1.44 O ATOM 2417 OD2 ASP C 167 7.400 15.341 -12.209 1.00 1.50 O ATOM 0 H ASP C 167 6.562 15.662 -9.184 1.00 0.97 H new ATOM 0 HA ASP C 167 4.386 14.082 -10.279 1.00 1.02 H new ATOM 0 HB2 ASP C 167 7.414 13.766 -10.301 1.00 1.25 H new ATOM 0 HB3 ASP C 167 6.312 12.661 -11.098 1.00 1.25 H new ATOM 2422 N VAL C 168 4.312 12.131 -8.738 1.00 0.75 N ATOM 2423 CA VAL C 168 4.163 11.063 -7.765 1.00 0.60 C ATOM 2424 C VAL C 168 4.347 9.707 -8.445 1.00 0.65 C ATOM 2425 O VAL C 168 3.996 9.536 -9.617 1.00 0.78 O ATOM 2426 CB VAL C 168 2.782 11.135 -7.066 1.00 0.61 C ATOM 2427 CG1 VAL C 168 1.643 10.975 -8.070 1.00 0.82 C ATOM 2428 CG2 VAL C 168 2.676 10.100 -5.950 1.00 0.58 C ATOM 0 H VAL C 168 3.587 12.151 -9.455 1.00 0.75 H new ATOM 0 HA VAL C 168 4.932 11.184 -7.002 1.00 0.60 H new ATOM 0 HB VAL C 168 2.692 12.124 -6.616 1.00 0.61 H new ATOM 0 HG11 VAL C 168 0.688 11.030 -7.548 1.00 0.82 H new ATOM 0 HG12 VAL C 168 1.698 11.771 -8.812 1.00 0.82 H new ATOM 0 HG13 VAL C 168 1.730 10.009 -8.567 1.00 0.82 H new ATOM 0 HG21 VAL C 168 1.697 10.174 -5.477 1.00 0.58 H new ATOM 0 HG22 VAL C 168 2.803 9.101 -6.367 1.00 0.58 H new ATOM 0 HG23 VAL C 168 3.452 10.285 -5.207 1.00 0.58 H new ATOM 2438 N MET C 169 4.918 8.753 -7.725 1.00 0.56 N ATOM 2439 CA MET C 169 5.148 7.424 -8.272 1.00 0.60 C ATOM 2440 C MET C 169 4.295 6.390 -7.553 1.00 0.56 C ATOM 2441 O MET C 169 3.811 6.630 -6.446 1.00 0.53 O ATOM 2442 CB MET C 169 6.625 7.052 -8.171 1.00 0.64 C ATOM 2443 CG MET C 169 7.465 7.618 -9.305 1.00 1.02 C ATOM 2444 SD MET C 169 9.216 7.218 -9.146 1.00 1.10 S ATOM 2445 CE MET C 169 9.841 7.833 -10.710 1.00 1.55 C ATOM 0 H MET C 169 5.230 8.874 -6.762 1.00 0.56 H new ATOM 0 HA MET C 169 4.862 7.436 -9.324 1.00 0.60 H new ATOM 0 HB2 MET C 169 7.019 7.412 -7.221 1.00 0.64 H new ATOM 0 HB3 MET C 169 6.720 5.966 -8.164 1.00 0.64 H new ATOM 0 HG2 MET C 169 7.094 7.231 -10.254 1.00 1.02 H new ATOM 0 HG3 MET C 169 7.346 8.701 -9.334 1.00 1.02 H new ATOM 0 HE1 MET C 169 10.916 7.659 -10.766 1.00 1.55 H new ATOM 0 HE2 MET C 169 9.346 7.312 -11.530 1.00 1.55 H new ATOM 0 HE3 MET C 169 9.642 8.902 -10.786 1.00 1.55 H new ATOM 2455 N VAL C 170 4.118 5.241 -8.188 1.00 0.61 N ATOM 2456 CA VAL C 170 3.322 4.164 -7.624 1.00 0.60 C ATOM 2457 C VAL C 170 4.225 3.021 -7.176 1.00 0.63 C ATOM 2458 O VAL C 170 5.147 2.633 -7.897 1.00 0.73 O ATOM 2459 CB VAL C 170 2.293 3.635 -8.648 1.00 0.65 C ATOM 2460 CG1 VAL C 170 1.402 2.565 -8.029 1.00 0.65 C ATOM 2461 CG2 VAL C 170 1.451 4.775 -9.200 1.00 0.68 C ATOM 0 H VAL C 170 4.519 5.031 -9.102 1.00 0.61 H new ATOM 0 HA VAL C 170 2.783 4.563 -6.764 1.00 0.60 H new ATOM 0 HB VAL C 170 2.844 3.180 -9.471 1.00 0.65 H new ATOM 0 HG11 VAL C 170 0.688 2.211 -8.773 1.00 0.65 H new ATOM 0 HG12 VAL C 170 2.017 1.731 -7.691 1.00 0.65 H new ATOM 0 HG13 VAL C 170 0.863 2.986 -7.180 1.00 0.65 H new ATOM 0 HG21 VAL C 170 0.733 4.382 -9.919 1.00 0.68 H new ATOM 0 HG22 VAL C 170 0.918 5.262 -8.384 1.00 0.68 H new ATOM 0 HG23 VAL C 170 2.099 5.500 -9.693 1.00 0.68 H new ATOM 2471 N VAL C 171 3.959 2.501 -5.983 1.00 0.57 N ATOM 2472 CA VAL C 171 4.735 1.403 -5.422 1.00 0.62 C ATOM 2473 C VAL C 171 4.509 0.126 -6.221 1.00 0.77 C ATOM 2474 O VAL C 171 3.389 -0.387 -6.286 1.00 0.89 O ATOM 2475 CB VAL C 171 4.368 1.141 -3.943 1.00 0.61 C ATOM 2476 CG1 VAL C 171 5.257 0.063 -3.347 1.00 1.03 C ATOM 2477 CG2 VAL C 171 4.467 2.416 -3.128 1.00 0.91 C ATOM 0 H VAL C 171 3.203 2.827 -5.381 1.00 0.57 H new ATOM 0 HA VAL C 171 5.784 1.693 -5.476 1.00 0.62 H new ATOM 0 HB VAL C 171 3.336 0.792 -3.912 1.00 0.61 H new ATOM 0 HG11 VAL C 171 4.979 -0.103 -2.306 1.00 1.03 H new ATOM 0 HG12 VAL C 171 5.132 -0.863 -3.908 1.00 1.03 H new ATOM 0 HG13 VAL C 171 6.298 0.381 -3.398 1.00 1.03 H new ATOM 0 HG21 VAL C 171 4.204 2.206 -2.091 1.00 0.91 H new ATOM 0 HG22 VAL C 171 5.487 2.799 -3.174 1.00 0.91 H new ATOM 0 HG23 VAL C 171 3.781 3.161 -3.533 1.00 0.91 H new ATOM 2487 N GLY C 172 5.572 -0.375 -6.835 1.00 0.81 N ATOM 2488 CA GLY C 172 5.472 -1.588 -7.616 1.00 0.96 C ATOM 2489 C GLY C 172 5.634 -2.833 -6.767 1.00 0.99 C ATOM 2490 O GLY C 172 5.663 -2.756 -5.536 1.00 1.04 O ATOM 0 H GLY C 172 6.504 0.039 -6.805 1.00 0.81 H new ATOM 0 HA2 GLY C 172 4.505 -1.616 -8.117 1.00 0.96 H new ATOM 0 HA3 GLY C 172 6.235 -1.580 -8.395 1.00 0.96 H new ATOM 2494 N GLU C 173 5.733 -3.980 -7.421 1.00 1.04 N ATOM 2495 CA GLU C 173 5.900 -5.249 -6.726 1.00 1.10 C ATOM 2496 C GLU C 173 7.314 -5.362 -6.157 1.00 1.06 C ATOM 2497 O GLU C 173 8.280 -4.937 -6.792 1.00 1.05 O ATOM 2498 CB GLU C 173 5.599 -6.416 -7.672 1.00 1.25 C ATOM 2499 CG GLU C 173 6.297 -6.311 -9.020 1.00 1.53 C ATOM 2500 CD GLU C 173 5.583 -7.087 -10.106 1.00 1.63 C ATOM 2501 OE1 GLU C 173 5.601 -8.333 -10.068 1.00 1.96 O ATOM 2502 OE2 GLU C 173 4.987 -6.453 -11.005 1.00 1.72 O ATOM 0 H GLU C 173 5.700 -4.059 -8.437 1.00 1.04 H new ATOM 0 HA GLU C 173 5.195 -5.290 -5.896 1.00 1.10 H new ATOM 0 HB2 GLU C 173 5.897 -7.347 -7.191 1.00 1.25 H new ATOM 0 HB3 GLU C 173 4.523 -6.471 -7.834 1.00 1.25 H new ATOM 0 HG2 GLU C 173 6.362 -5.263 -9.311 1.00 1.53 H new ATOM 0 HG3 GLU C 173 7.318 -6.680 -8.926 1.00 1.53 H new ATOM 2509 N PRO C 174 7.451 -5.918 -4.941 1.00 1.09 N ATOM 2510 CA PRO C 174 8.756 -6.076 -4.283 1.00 1.08 C ATOM 2511 C PRO C 174 9.640 -7.110 -4.977 1.00 1.15 C ATOM 2512 O PRO C 174 9.149 -7.971 -5.711 1.00 1.34 O ATOM 2513 CB PRO C 174 8.391 -6.546 -2.872 1.00 1.15 C ATOM 2514 CG PRO C 174 7.056 -7.191 -3.018 1.00 1.30 C ATOM 2515 CD PRO C 174 6.349 -6.440 -4.112 1.00 1.17 C ATOM 0 HA PRO C 174 9.333 -5.152 -4.303 1.00 1.08 H new ATOM 0 HB2 PRO C 174 9.129 -7.249 -2.486 1.00 1.15 H new ATOM 0 HB3 PRO C 174 8.352 -5.709 -2.174 1.00 1.15 H new ATOM 0 HG2 PRO C 174 7.158 -8.246 -3.272 1.00 1.30 H new ATOM 0 HG3 PRO C 174 6.495 -7.141 -2.085 1.00 1.30 H new ATOM 0 HD2 PRO C 174 5.690 -7.092 -4.685 1.00 1.17 H new ATOM 0 HD3 PRO C 174 5.732 -5.635 -3.712 1.00 1.17 H new ATOM 2523 N THR C 175 10.941 -7.018 -4.745 1.00 1.04 N ATOM 2524 CA THR C 175 11.893 -7.933 -5.346 1.00 1.11 C ATOM 2525 C THR C 175 11.982 -9.238 -4.562 1.00 1.12 C ATOM 2526 O THR C 175 11.954 -9.243 -3.329 1.00 1.05 O ATOM 2527 CB THR C 175 13.284 -7.284 -5.418 1.00 1.07 C ATOM 2528 OG1 THR C 175 13.367 -6.223 -4.457 1.00 1.03 O ATOM 2529 CG2 THR C 175 13.548 -6.734 -6.810 1.00 1.30 C ATOM 0 H THR C 175 11.361 -6.313 -4.140 1.00 1.04 H new ATOM 0 HA THR C 175 11.542 -8.158 -6.353 1.00 1.11 H new ATOM 0 HB THR C 175 14.035 -8.042 -5.196 1.00 1.07 H new ATOM 0 HG1 THR C 175 14.232 -6.264 -3.999 1.00 1.03 H new ATOM 0 HG21 THR C 175 14.538 -6.279 -6.840 1.00 1.30 H new ATOM 0 HG22 THR C 175 13.500 -7.545 -7.537 1.00 1.30 H new ATOM 0 HG23 THR C 175 12.796 -5.983 -7.053 1.00 1.30 H new