USER MOD reduce.3.24.130724 H: found=0, std=0, add=1188, rem=0, adj=49 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 139:sc= 1.21 USER MOD Set 1.2: C 125 CYS SG : rot -44:sc= -1.53! USER MOD Set 1.3: C 144 CYS SG : rot -137:sc= 0.459 USER MOD Set 1.4: C 146 GLN :FLIP amide:sc= -0.0278 F(o=-2.4!,f=0.11) USER MOD Set 2.1: C 94 CYS SG : rot 129:sc= 1.9 USER MOD Set 2.2: C 97 CYS SG : rot -53:sc= 0.132 USER MOD Set 2.3: C 116 HIS : no HD1:sc= 0.205 K(o=-1.7,f=-2.5) USER MOD Set 2.4: C 119 CYS SG : rot -162:sc= -3.9! USER MOD Set 3.1: B 11 CYS SG : rot 134:sc= 0.509 USER MOD Set 3.2: B 14 CYS SG : rot 171:sc= -0.427 USER MOD Set 3.3: B 27 HIS : no HE2:sc= -2.33 K(o=-2.9,f=-8.1!) USER MOD Set 3.4: B 32 CYS SG : rot -43:sc= -0.634 USER MOD Set 4.1: A 231 TYR OH : rot 165:sc= 0.0127 USER MOD Set 4.2: A 235 ASN : amide:sc= 0.851 K(o=1.1,f=0.046) USER MOD Set 4.3: A 237 GLN : amide:sc= 0.268 K(o=1.1,f=0.046) USER MOD Set 5.1: A 204 CYS SG : rot 145:sc= 2.03 USER MOD Set 5.2: A 207 CYS SG : rot -43:sc= 1.25! USER MOD Set 5.3: A 225 CYS SG : rot -143:sc= 1.06! USER MOD Set 5.4: A 228 CYS SG : rot 126:sc= -0.518 USER MOD Single : A 206 ASN : amide:sc= -0.333 X(o=-0.33,f=0) USER MOD Single : A 210 THR OG1 : rot -44:sc= 0.484 USER MOD Single : A 212 THR OG1 : rot 173:sc= 0.806 USER MOD Single : A 220 THR OG1 : rot -86:sc= 1.08 USER MOD Single : A 222 HIS : no HD1:sc= -0.559 K(o=-0.56,f=-6.8!) USER MOD Single : A 223 TYR OH : rot -93:sc= 1.31 USER MOD Single : A 226 ASN : amide:sc= 0.759 K(o=0.76,f=-6.8!) USER MOD Single : A 232 HIS : no HE2:sc= -0.19 K(o=-0.19,f=-2.3!) USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 MET CE :methyl 135:sc= -0.147 (180deg=-0.701) USER MOD Single : A 238 ASN : amide:sc= 1.21 K(o=1.2,f=-0.034) USER MOD Single : B 1 GLY N :NH3+ -119:sc= 0.0944 (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 88:sc= 1.22 USER MOD Single : B 22 SER OG : rot 180:sc= 0.055 USER MOD Single : B 23 THR OG1 : rot 139:sc= -2.86! USER MOD Single : B 28 GLN : amide:sc= -1.06 X(o=-1.1,f=-0.73) USER MOD Single : B 30 TYR OH : rot -176:sc= 1.24 USER MOD Single : B 31 TYR OH : rot -174:sc= 1.22 USER MOD Single : B 33 SER OG : rot 180:sc= 0 USER MOD Single : B 34 HIS : no HD1:sc= -0.377 X(o=-0.38,f=-0.13) USER MOD Single : C 96 SER OG : rot 180:sc= -0.053 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 -150:sc= 0 USER MOD Single : C 108 MET CE :methyl 166:sc= -0.0176 (180deg=-0.249) 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 180:sc= -0.507 USER MOD Single : C 121 LYS NZ :NH3+ 138:sc= 0.824 (180deg=0.405) USER MOD Single : C 126 GLN : amide:sc= 0.269 X(o=0.27,f=-0.052) USER MOD Single : C 127 LYS NZ :NH3+ -139:sc= 0.996 (180deg=-1.12) USER MOD Single : C 128 HIS : +bothHN:sc= 0.297 K(o=0.3,f=-7.1!) USER MOD Single : C 130 SER OG : rot 122:sc= 1.06 USER MOD Single : C 135 TYR OH : rot 165:sc= 0 USER MOD Single : C 139 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 140 SER OG : rot 98:sc= 1.01 USER MOD Single : C 149 TYR OH : rot 180:sc= 0 USER MOD Single : C 152 THR OG1 : rot -91:sc= 1.35 USER MOD Single : C 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 155 ASN : amide:sc=-0.00722 X(o=-0.0072,f=0) USER MOD Single : C 158 SER OG : rot 180:sc= 0 USER MOD Single : C 161 SER OG : rot 180:sc= 0 USER MOD Single : C 164 SER OG : rot 180:sc= 0 USER MOD Single : C 169 MET CE :methyl -166:sc= 0 (180deg=-0.0536) USER MOD Single : C 175 THR OG1 : rot 82:sc= 1.03 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 200 -6.062 6.982 7.903 1.00 0.91 N ATOM 2 CA GLU A 200 -5.869 5.529 7.684 1.00 0.71 C ATOM 3 C GLU A 200 -5.141 5.298 6.366 1.00 0.62 C ATOM 4 O GLU A 200 -5.249 6.105 5.445 1.00 0.70 O ATOM 5 CB GLU A 200 -7.219 4.798 7.675 1.00 0.79 C ATOM 6 CG GLU A 200 -7.748 4.477 9.066 1.00 0.88 C ATOM 7 CD GLU A 200 -7.725 5.679 9.983 1.00 1.29 C ATOM 8 OE1 GLU A 200 -8.319 6.717 9.624 1.00 1.61 O ATOM 9 OE2 GLU A 200 -7.080 5.613 11.047 1.00 1.63 O ATOM 0 HA GLU A 200 -5.268 5.130 8.501 1.00 0.71 H new ATOM 0 HB2 GLU A 200 -7.951 5.411 7.150 1.00 0.79 H new ATOM 0 HB3 GLU A 200 -7.117 3.871 7.111 1.00 0.79 H new ATOM 0 HG2 GLU A 200 -8.769 4.104 8.986 1.00 0.88 H new ATOM 0 HG3 GLU A 200 -7.150 3.678 9.504 1.00 0.88 H new ATOM 18 N ALA A 201 -4.390 4.208 6.282 1.00 0.56 N ATOM 19 CA ALA A 201 -3.652 3.893 5.067 1.00 0.57 C ATOM 20 C ALA A 201 -4.597 3.425 3.967 1.00 0.57 C ATOM 21 O ALA A 201 -4.834 4.142 2.996 1.00 0.89 O ATOM 22 CB ALA A 201 -2.588 2.842 5.345 1.00 0.62 C ATOM 0 H ALA A 201 -4.276 3.531 7.036 1.00 0.56 H new ATOM 0 HA ALA A 201 -3.156 4.801 4.724 1.00 0.57 H new ATOM 0 HB1 ALA A 201 -2.047 2.620 4.425 1.00 0.62 H new ATOM 0 HB2 ALA A 201 -1.891 3.219 6.094 1.00 0.62 H new ATOM 0 HB3 ALA A 201 -3.062 1.933 5.716 1.00 0.62 H new ATOM 28 N ARG A 202 -5.154 2.237 4.138 1.00 0.40 N ATOM 29 CA ARG A 202 -6.073 1.674 3.159 1.00 0.35 C ATOM 30 C ARG A 202 -7.193 0.928 3.873 1.00 0.33 C ATOM 31 O ARG A 202 -7.150 0.757 5.093 1.00 0.33 O ATOM 32 CB ARG A 202 -5.324 0.728 2.215 1.00 0.37 C ATOM 33 CG ARG A 202 -5.842 0.739 0.785 1.00 0.36 C ATOM 34 CD ARG A 202 -5.068 1.722 -0.080 1.00 0.28 C ATOM 35 NE ARG A 202 -5.509 3.102 0.112 1.00 0.46 N ATOM 36 CZ ARG A 202 -4.905 4.164 -0.430 1.00 0.44 C ATOM 37 NH1 ARG A 202 -3.823 4.007 -1.186 1.00 0.42 N ATOM 38 NH2 ARG A 202 -5.380 5.386 -0.206 1.00 0.72 N ATOM 0 H ARG A 202 -4.986 1.641 4.948 1.00 0.40 H new ATOM 0 HA ARG A 202 -6.505 2.483 2.570 1.00 0.35 H new ATOM 0 HB2 ARG A 202 -4.268 0.998 2.210 1.00 0.37 H new ATOM 0 HB3 ARG A 202 -5.391 -0.287 2.607 1.00 0.37 H new ATOM 0 HG2 ARG A 202 -5.763 -0.262 0.360 1.00 0.36 H new ATOM 0 HG3 ARG A 202 -6.899 1.004 0.782 1.00 0.36 H new ATOM 0 HD2 ARG A 202 -4.006 1.648 0.152 1.00 0.28 H new ATOM 0 HD3 ARG A 202 -5.185 1.449 -1.129 1.00 0.28 H new ATOM 0 HE ARG A 202 -6.329 3.265 0.696 1.00 0.46 H new ATOM 0 HH11 ARG A 202 -3.450 3.073 -1.355 1.00 0.42 H new ATOM 0 HH12 ARG A 202 -3.366 4.821 -1.597 1.00 0.42 H new ATOM 0 HH21 ARG A 202 -6.205 5.513 0.380 1.00 0.72 H new ATOM 0 HH22 ARG A 202 -4.919 6.196 -0.620 1.00 0.72 H new ATOM 52 N GLU A 203 -8.189 0.502 3.115 1.00 0.37 N ATOM 53 CA GLU A 203 -9.322 -0.224 3.668 1.00 0.39 C ATOM 54 C GLU A 203 -9.376 -1.647 3.115 1.00 0.37 C ATOM 55 O GLU A 203 -8.627 -1.993 2.200 1.00 0.36 O ATOM 56 CB GLU A 203 -10.636 0.506 3.336 1.00 0.48 C ATOM 57 CG GLU A 203 -10.463 1.975 2.952 1.00 0.49 C ATOM 58 CD GLU A 203 -10.220 2.175 1.465 1.00 0.51 C ATOM 59 OE1 GLU A 203 -9.051 2.097 1.028 1.00 0.55 O ATOM 60 OE2 GLU A 203 -11.200 2.418 0.726 1.00 0.53 O ATOM 0 H GLU A 203 -8.237 0.648 2.107 1.00 0.37 H new ATOM 0 HA GLU A 203 -9.198 -0.271 4.750 1.00 0.39 H new ATOM 0 HB2 GLU A 203 -11.130 -0.015 2.516 1.00 0.48 H new ATOM 0 HB3 GLU A 203 -11.300 0.444 4.199 1.00 0.48 H new ATOM 0 HG2 GLU A 203 -11.354 2.529 3.247 1.00 0.49 H new ATOM 0 HG3 GLU A 203 -9.627 2.395 3.511 1.00 0.49 H new ATOM 67 N CYS A 204 -10.261 -2.461 3.688 1.00 0.39 N ATOM 68 CA CYS A 204 -10.459 -3.836 3.255 1.00 0.39 C ATOM 69 C CYS A 204 -11.865 -3.963 2.685 1.00 0.42 C ATOM 70 O CYS A 204 -12.744 -3.157 2.999 1.00 0.54 O ATOM 71 CB CYS A 204 -10.264 -4.815 4.427 1.00 0.41 C ATOM 72 SG CYS A 204 -10.686 -6.559 4.063 1.00 0.46 S ATOM 0 H CYS A 204 -10.859 -2.182 4.466 1.00 0.39 H new ATOM 0 HA CYS A 204 -9.722 -4.088 2.492 1.00 0.39 H new ATOM 0 HB2 CYS A 204 -9.224 -4.769 4.749 1.00 0.41 H new ATOM 0 HB3 CYS A 204 -10.872 -4.478 5.266 1.00 0.41 H new ATOM 0 HG CYS A 204 -9.880 -7.345 4.713 1.00 0.46 H new ATOM 77 N VAL A 205 -12.078 -4.971 1.858 1.00 0.38 N ATOM 78 CA VAL A 205 -13.376 -5.189 1.240 1.00 0.40 C ATOM 79 C VAL A 205 -14.348 -5.830 2.219 1.00 0.48 C ATOM 80 O VAL A 205 -15.562 -5.814 2.004 1.00 0.52 O ATOM 81 CB VAL A 205 -13.273 -6.087 -0.015 1.00 0.38 C ATOM 82 CG1 VAL A 205 -12.294 -5.507 -1.024 1.00 0.36 C ATOM 83 CG2 VAL A 205 -12.883 -7.510 0.360 1.00 0.47 C ATOM 0 H VAL A 205 -11.367 -5.654 1.598 1.00 0.38 H new ATOM 0 HA VAL A 205 -13.745 -4.207 0.944 1.00 0.40 H new ATOM 0 HB VAL A 205 -14.258 -6.119 -0.481 1.00 0.38 H new ATOM 0 HG11 VAL A 205 -12.241 -6.159 -1.896 1.00 0.36 H new ATOM 0 HG12 VAL A 205 -12.631 -4.517 -1.331 1.00 0.36 H new ATOM 0 HG13 VAL A 205 -11.306 -5.429 -0.569 1.00 0.36 H new ATOM 0 HG21 VAL A 205 -12.818 -8.119 -0.542 1.00 0.47 H new ATOM 0 HG22 VAL A 205 -11.916 -7.502 0.863 1.00 0.47 H new ATOM 0 HG23 VAL A 205 -13.635 -7.930 1.028 1.00 0.47 H new ATOM 93 N ASN A 206 -13.821 -6.380 3.305 1.00 0.51 N ATOM 94 CA ASN A 206 -14.666 -7.049 4.285 1.00 0.60 C ATOM 95 C ASN A 206 -14.537 -6.460 5.684 1.00 0.63 C ATOM 96 O ASN A 206 -15.491 -6.513 6.462 1.00 0.72 O ATOM 97 CB ASN A 206 -14.348 -8.541 4.333 1.00 0.65 C ATOM 98 CG ASN A 206 -15.454 -9.401 3.755 1.00 0.79 C ATOM 99 OD1 ASN A 206 -16.404 -9.769 4.451 1.00 0.88 O ATOM 100 ND2 ASN A 206 -15.331 -9.742 2.483 1.00 1.26 N ATOM 0 H ASN A 206 -12.826 -6.377 3.528 1.00 0.51 H new ATOM 0 HA ASN A 206 -15.694 -6.894 3.959 1.00 0.60 H new ATOM 0 HB2 ASN A 206 -13.425 -8.728 3.784 1.00 0.65 H new ATOM 0 HB3 ASN A 206 -14.169 -8.836 5.367 1.00 0.65 H new ATOM 0 HD21 ASN A 206 -16.038 -10.331 2.042 1.00 1.26 H new ATOM 0 HD22 ASN A 206 -14.530 -9.416 1.943 1.00 1.26 H new ATOM 107 N CYS A 207 -13.377 -5.907 6.026 1.00 0.57 N ATOM 108 CA CYS A 207 -13.203 -5.350 7.361 1.00 0.61 C ATOM 109 C CYS A 207 -12.640 -3.921 7.328 1.00 0.58 C ATOM 110 O CYS A 207 -13.386 -2.945 7.407 1.00 0.62 O ATOM 111 CB CYS A 207 -12.332 -6.287 8.226 1.00 0.63 C ATOM 112 SG CYS A 207 -10.563 -6.405 7.770 1.00 0.55 S ATOM 0 H CYS A 207 -12.564 -5.834 5.415 1.00 0.57 H new ATOM 0 HA CYS A 207 -14.189 -5.278 7.820 1.00 0.61 H new ATOM 0 HB2 CYS A 207 -12.396 -5.954 9.262 1.00 0.63 H new ATOM 0 HB3 CYS A 207 -12.763 -7.288 8.186 1.00 0.63 H new ATOM 0 HG CYS A 207 -10.453 -6.490 6.477 1.00 0.55 H new ATOM 117 N GLY A 208 -11.335 -3.818 7.219 1.00 0.54 N ATOM 118 CA GLY A 208 -10.671 -2.535 7.192 1.00 0.52 C ATOM 119 C GLY A 208 -9.524 -2.498 8.175 1.00 0.49 C ATOM 120 O GLY A 208 -9.152 -1.434 8.678 1.00 0.52 O ATOM 0 H GLY A 208 -10.706 -4.618 7.147 1.00 0.54 H new ATOM 0 HA2 GLY A 208 -10.300 -2.335 6.187 1.00 0.52 H new ATOM 0 HA3 GLY A 208 -11.385 -1.747 7.431 1.00 0.52 H new ATOM 124 N ALA A 209 -8.971 -3.671 8.459 1.00 0.47 N ATOM 125 CA ALA A 209 -7.859 -3.794 9.387 1.00 0.46 C ATOM 126 C ALA A 209 -6.561 -3.308 8.754 1.00 0.42 C ATOM 127 O ALA A 209 -5.899 -4.039 8.019 1.00 0.41 O ATOM 128 CB ALA A 209 -7.716 -5.237 9.848 1.00 0.49 C ATOM 0 H ALA A 209 -9.279 -4.556 8.055 1.00 0.47 H new ATOM 0 HA ALA A 209 -8.068 -3.166 10.253 1.00 0.46 H new ATOM 0 HB1 ALA A 209 -6.880 -5.316 10.543 1.00 0.49 H new ATOM 0 HB2 ALA A 209 -8.633 -5.552 10.346 1.00 0.49 H new ATOM 0 HB3 ALA A 209 -7.533 -5.878 8.986 1.00 0.49 H new ATOM 134 N THR A 210 -6.193 -2.073 9.054 1.00 0.45 N ATOM 135 CA THR A 210 -4.974 -1.486 8.519 1.00 0.48 C ATOM 136 C THR A 210 -3.751 -1.985 9.295 1.00 0.47 C ATOM 137 O THR A 210 -2.616 -1.585 9.026 1.00 0.47 O ATOM 138 CB THR A 210 -5.032 0.060 8.549 1.00 0.61 C ATOM 139 OG1 THR A 210 -3.916 0.616 7.840 1.00 0.67 O ATOM 140 CG2 THR A 210 -5.043 0.587 9.977 1.00 0.70 C ATOM 0 H THR A 210 -6.723 -1.455 9.668 1.00 0.45 H new ATOM 0 HA THR A 210 -4.884 -1.800 7.479 1.00 0.48 H new ATOM 0 HB THR A 210 -5.959 0.364 8.062 1.00 0.61 H new ATOM 0 HG1 THR A 210 -3.098 0.137 8.090 1.00 0.67 H new ATOM 0 HG21 THR A 210 -5.084 1.676 9.963 1.00 0.70 H new ATOM 0 HG22 THR A 210 -5.916 0.198 10.502 1.00 0.70 H new ATOM 0 HG23 THR A 210 -4.137 0.265 10.491 1.00 0.70 H new ATOM 148 N ALA A 211 -3.998 -2.874 10.252 1.00 0.49 N ATOM 149 CA ALA A 211 -2.941 -3.444 11.074 1.00 0.52 C ATOM 150 C ALA A 211 -2.201 -4.552 10.333 1.00 0.44 C ATOM 151 O ALA A 211 -1.145 -5.004 10.780 1.00 0.44 O ATOM 152 CB ALA A 211 -3.514 -3.975 12.380 1.00 0.64 C ATOM 0 H ALA A 211 -4.932 -3.217 10.477 1.00 0.49 H new ATOM 0 HA ALA A 211 -2.226 -2.652 11.297 1.00 0.52 H new ATOM 0 HB1 ALA A 211 -2.711 -4.398 12.984 1.00 0.64 H new ATOM 0 HB2 ALA A 211 -3.989 -3.160 12.927 1.00 0.64 H new ATOM 0 HB3 ALA A 211 -4.253 -4.747 12.166 1.00 0.64 H new ATOM 158 N THR A 212 -2.765 -4.988 9.208 1.00 0.42 N ATOM 159 CA THR A 212 -2.158 -6.040 8.400 1.00 0.41 C ATOM 160 C THR A 212 -0.737 -5.643 7.982 1.00 0.37 C ATOM 161 O THR A 212 -0.486 -4.485 7.639 1.00 0.34 O ATOM 162 CB THR A 212 -3.014 -6.356 7.145 1.00 0.40 C ATOM 163 OG1 THR A 212 -2.414 -7.415 6.386 1.00 0.46 O ATOM 164 CG2 THR A 212 -3.176 -5.126 6.264 1.00 0.30 C ATOM 0 H THR A 212 -3.643 -4.627 8.836 1.00 0.42 H new ATOM 0 HA THR A 212 -2.110 -6.941 9.012 1.00 0.41 H new ATOM 0 HB THR A 212 -4.001 -6.669 7.487 1.00 0.40 H new ATOM 0 HG1 THR A 212 -3.017 -7.680 5.660 1.00 0.46 H new ATOM 0 HG21 THR A 212 -3.780 -5.379 5.393 1.00 0.30 H new ATOM 0 HG22 THR A 212 -3.669 -4.335 6.830 1.00 0.30 H new ATOM 0 HG23 THR A 212 -2.195 -4.781 5.937 1.00 0.30 H new ATOM 172 N PRO A 213 0.213 -6.594 8.026 1.00 0.45 N ATOM 173 CA PRO A 213 1.615 -6.345 7.662 1.00 0.49 C ATOM 174 C PRO A 213 1.773 -5.838 6.229 1.00 0.49 C ATOM 175 O PRO A 213 2.632 -5.003 5.945 1.00 0.56 O ATOM 176 CB PRO A 213 2.288 -7.715 7.827 1.00 0.59 C ATOM 177 CG PRO A 213 1.172 -8.703 7.846 1.00 0.62 C ATOM 178 CD PRO A 213 -0.005 -7.989 8.440 1.00 0.55 C ATOM 0 HA PRO A 213 2.055 -5.566 8.284 1.00 0.49 H new ATOM 0 HB2 PRO A 213 2.977 -7.916 7.007 1.00 0.59 H new ATOM 0 HB3 PRO A 213 2.868 -7.760 8.749 1.00 0.59 H new ATOM 0 HG2 PRO A 213 0.947 -9.056 6.840 1.00 0.62 H new ATOM 0 HG3 PRO A 213 1.437 -9.579 8.439 1.00 0.62 H new ATOM 0 HD2 PRO A 213 -0.949 -8.380 8.060 1.00 0.55 H new ATOM 0 HD3 PRO A 213 -0.032 -8.089 9.525 1.00 0.55 H new ATOM 186 N LEU A 214 0.935 -6.334 5.332 1.00 0.43 N ATOM 187 CA LEU A 214 0.980 -5.933 3.937 1.00 0.44 C ATOM 188 C LEU A 214 -0.378 -6.151 3.288 1.00 0.39 C ATOM 189 O LEU A 214 -1.030 -7.162 3.529 1.00 0.46 O ATOM 190 CB LEU A 214 2.055 -6.722 3.183 1.00 0.53 C ATOM 191 CG LEU A 214 2.358 -6.227 1.767 1.00 0.63 C ATOM 192 CD1 LEU A 214 2.927 -4.817 1.800 1.00 0.74 C ATOM 193 CD2 LEU A 214 3.327 -7.169 1.074 1.00 0.74 C ATOM 0 H LEU A 214 0.211 -7.019 5.549 1.00 0.43 H new ATOM 0 HA LEU A 214 1.232 -4.874 3.890 1.00 0.44 H new ATOM 0 HB2 LEU A 214 2.977 -6.695 3.764 1.00 0.53 H new ATOM 0 HB3 LEU A 214 1.744 -7.765 3.127 1.00 0.53 H new ATOM 0 HG LEU A 214 1.425 -6.208 1.204 1.00 0.63 H new ATOM 0 HD11 LEU A 214 3.135 -4.485 0.783 1.00 0.74 H new ATOM 0 HD12 LEU A 214 2.204 -4.144 2.261 1.00 0.74 H new ATOM 0 HD13 LEU A 214 3.850 -4.811 2.380 1.00 0.74 H new ATOM 0 HD21 LEU A 214 3.533 -6.804 0.068 1.00 0.74 H new ATOM 0 HD22 LEU A 214 4.257 -7.216 1.640 1.00 0.74 H new ATOM 0 HD23 LEU A 214 2.887 -8.165 1.016 1.00 0.74 H new ATOM 205 N TRP A 215 -0.796 -5.195 2.471 1.00 0.31 N ATOM 206 CA TRP A 215 -2.080 -5.279 1.793 1.00 0.27 C ATOM 207 C TRP A 215 -2.018 -6.261 0.633 1.00 0.32 C ATOM 208 O TRP A 215 -1.070 -6.247 -0.154 1.00 0.40 O ATOM 209 CB TRP A 215 -2.501 -3.903 1.276 1.00 0.25 C ATOM 210 CG TRP A 215 -2.810 -2.927 2.364 1.00 0.28 C ATOM 211 CD1 TRP A 215 -2.055 -1.859 2.750 1.00 0.36 C ATOM 212 CD2 TRP A 215 -3.964 -2.930 3.208 1.00 0.31 C ATOM 213 NE1 TRP A 215 -2.666 -1.201 3.789 1.00 0.41 N ATOM 214 CE2 TRP A 215 -3.841 -1.838 4.086 1.00 0.38 C ATOM 215 CE3 TRP A 215 -5.091 -3.753 3.308 1.00 0.37 C ATOM 216 CZ2 TRP A 215 -4.801 -1.545 5.047 1.00 0.45 C ATOM 217 CZ3 TRP A 215 -6.045 -3.461 4.263 1.00 0.46 C ATOM 218 CH2 TRP A 215 -5.895 -2.366 5.122 1.00 0.48 C ATOM 0 H TRP A 215 -0.263 -4.351 2.262 1.00 0.31 H new ATOM 0 HA TRP A 215 -2.817 -5.634 2.514 1.00 0.27 H new ATOM 0 HB2 TRP A 215 -1.704 -3.499 0.652 1.00 0.25 H new ATOM 0 HB3 TRP A 215 -3.379 -4.016 0.640 1.00 0.25 H new ATOM 0 HD1 TRP A 215 -1.114 -1.573 2.304 1.00 0.36 H new ATOM 0 HE1 TRP A 215 -2.304 -0.373 4.262 1.00 0.41 H new ATOM 0 HE3 TRP A 215 -5.213 -4.601 2.650 1.00 0.37 H new ATOM 0 HZ2 TRP A 215 -4.689 -0.701 5.711 1.00 0.45 H new ATOM 0 HZ3 TRP A 215 -6.921 -4.087 4.348 1.00 0.46 H new ATOM 0 HH2 TRP A 215 -6.658 -2.164 5.859 1.00 0.48 H new ATOM 229 N ARG A 216 -3.025 -7.111 0.536 1.00 0.33 N ATOM 230 CA ARG A 216 -3.089 -8.091 -0.533 1.00 0.39 C ATOM 231 C ARG A 216 -3.940 -7.543 -1.671 1.00 0.37 C ATOM 232 O ARG A 216 -5.152 -7.405 -1.527 1.00 0.46 O ATOM 233 CB ARG A 216 -3.674 -9.415 -0.022 1.00 0.46 C ATOM 234 CG ARG A 216 -2.663 -10.324 0.665 1.00 0.55 C ATOM 235 CD ARG A 216 -2.193 -9.749 1.995 1.00 0.57 C ATOM 236 NE ARG A 216 -1.487 -10.741 2.811 1.00 0.55 N ATOM 237 CZ ARG A 216 -0.174 -10.968 2.752 1.00 0.73 C ATOM 238 NH1 ARG A 216 0.594 -10.269 1.925 1.00 1.02 N ATOM 239 NH2 ARG A 216 0.369 -11.896 3.529 1.00 0.80 N ATOM 0 H ARG A 216 -3.811 -7.142 1.186 1.00 0.33 H new ATOM 0 HA ARG A 216 -2.080 -8.285 -0.896 1.00 0.39 H new ATOM 0 HB2 ARG A 216 -4.482 -9.196 0.677 1.00 0.46 H new ATOM 0 HB3 ARG A 216 -4.116 -9.952 -0.862 1.00 0.46 H new ATOM 0 HG2 ARG A 216 -3.110 -11.304 0.831 1.00 0.55 H new ATOM 0 HG3 ARG A 216 -1.804 -10.472 0.010 1.00 0.55 H new ATOM 0 HD2 ARG A 216 -1.535 -8.900 1.809 1.00 0.57 H new ATOM 0 HD3 ARG A 216 -3.052 -9.371 2.549 1.00 0.57 H new ATOM 0 HE ARG A 216 -2.037 -11.295 3.468 1.00 0.55 H new ATOM 0 HH11 ARG A 216 0.181 -9.552 1.329 1.00 1.02 H new ATOM 0 HH12 ARG A 216 1.597 -10.449 1.886 1.00 1.02 H new ATOM 0 HH21 ARG A 216 -0.217 -12.433 4.168 1.00 0.80 H new ATOM 0 HH22 ARG A 216 1.373 -12.073 3.487 1.00 0.80 H new ATOM 253 N ARG A 217 -3.302 -7.198 -2.780 1.00 0.38 N ATOM 254 CA ARG A 217 -4.019 -6.664 -3.930 1.00 0.39 C ATOM 255 C ARG A 217 -3.832 -7.568 -5.140 1.00 0.44 C ATOM 256 O ARG A 217 -2.731 -8.060 -5.399 1.00 0.50 O ATOM 257 CB ARG A 217 -3.544 -5.245 -4.267 1.00 0.43 C ATOM 258 CG ARG A 217 -4.393 -4.570 -5.332 1.00 0.45 C ATOM 259 CD ARG A 217 -3.567 -3.655 -6.221 1.00 0.43 C ATOM 260 NE ARG A 217 -3.293 -2.362 -5.592 1.00 0.52 N ATOM 261 CZ ARG A 217 -3.101 -1.228 -6.265 1.00 1.07 C ATOM 262 NH1 ARG A 217 -3.164 -1.211 -7.593 1.00 1.43 N ATOM 263 NH2 ARG A 217 -2.846 -0.106 -5.607 1.00 1.46 N ATOM 0 H ARG A 217 -2.293 -7.278 -2.908 1.00 0.38 H new ATOM 0 HA ARG A 217 -5.077 -6.623 -3.672 1.00 0.39 H new ATOM 0 HB2 ARG A 217 -3.558 -4.639 -3.361 1.00 0.43 H new ATOM 0 HB3 ARG A 217 -2.509 -5.286 -4.607 1.00 0.43 H new ATOM 0 HG2 ARG A 217 -4.878 -5.330 -5.945 1.00 0.45 H new ATOM 0 HG3 ARG A 217 -5.184 -3.993 -4.853 1.00 0.45 H new ATOM 0 HD2 ARG A 217 -2.624 -4.144 -6.464 1.00 0.43 H new ATOM 0 HD3 ARG A 217 -4.094 -3.494 -7.161 1.00 0.43 H new ATOM 0 HE ARG A 217 -3.246 -2.327 -4.574 1.00 0.52 H new ATOM 0 HH11 ARG A 217 -3.361 -2.071 -8.105 1.00 1.43 H new ATOM 0 HH12 ARG A 217 -3.016 -0.338 -8.099 1.00 1.43 H new ATOM 0 HH21 ARG A 217 -2.797 -0.112 -4.588 1.00 1.46 H new ATOM 0 HH22 ARG A 217 -2.699 0.764 -6.119 1.00 1.46 H new ATOM 277 N ASP A 218 -4.914 -7.784 -5.869 1.00 0.44 N ATOM 278 CA ASP A 218 -4.894 -8.624 -7.058 1.00 0.50 C ATOM 279 C ASP A 218 -4.549 -7.784 -8.292 1.00 0.54 C ATOM 280 O ASP A 218 -3.866 -6.762 -8.186 1.00 0.57 O ATOM 281 CB ASP A 218 -6.255 -9.308 -7.239 1.00 0.51 C ATOM 282 CG ASP A 218 -7.307 -8.367 -7.790 1.00 0.51 C ATOM 283 OD1 ASP A 218 -7.542 -7.309 -7.178 1.00 0.48 O ATOM 284 OD2 ASP A 218 -7.874 -8.671 -8.857 1.00 0.59 O ATOM 0 H ASP A 218 -5.828 -7.385 -5.656 1.00 0.44 H new ATOM 0 HA ASP A 218 -4.130 -9.392 -6.937 1.00 0.50 H new ATOM 0 HB2 ASP A 218 -6.144 -10.158 -7.912 1.00 0.51 H new ATOM 0 HB3 ASP A 218 -6.591 -9.702 -6.280 1.00 0.51 H new ATOM 289 N ARG A 219 -5.010 -8.219 -9.458 1.00 0.60 N ATOM 290 CA ARG A 219 -4.754 -7.502 -10.695 1.00 0.65 C ATOM 291 C ARG A 219 -5.727 -6.334 -10.865 1.00 0.63 C ATOM 292 O ARG A 219 -5.351 -5.276 -11.373 1.00 0.68 O ATOM 293 CB ARG A 219 -4.866 -8.447 -11.892 1.00 0.72 C ATOM 294 CG ARG A 219 -4.692 -7.746 -13.230 1.00 0.86 C ATOM 295 CD ARG A 219 -5.211 -8.591 -14.377 1.00 0.94 C ATOM 296 NE ARG A 219 -5.284 -7.838 -15.625 1.00 0.91 N ATOM 297 CZ ARG A 219 -5.559 -8.390 -16.805 1.00 1.12 C ATOM 298 NH1 ARG A 219 -5.850 -9.682 -16.887 1.00 1.57 N ATOM 299 NH2 ARG A 219 -5.567 -7.639 -17.895 1.00 1.34 N ATOM 0 H ARG A 219 -5.564 -9.068 -9.570 1.00 0.60 H new ATOM 0 HA ARG A 219 -3.741 -7.104 -10.647 1.00 0.65 H new ATOM 0 HB2 ARG A 219 -4.114 -9.230 -11.799 1.00 0.72 H new ATOM 0 HB3 ARG A 219 -5.840 -8.936 -11.870 1.00 0.72 H new ATOM 0 HG2 ARG A 219 -5.220 -6.792 -13.213 1.00 0.86 H new ATOM 0 HG3 ARG A 219 -3.637 -7.524 -13.390 1.00 0.86 H new ATOM 0 HD2 ARG A 219 -4.561 -9.455 -14.513 1.00 0.94 H new ATOM 0 HD3 ARG A 219 -6.201 -8.973 -14.126 1.00 0.94 H new ATOM 0 HE ARG A 219 -5.115 -6.833 -15.591 1.00 0.91 H new ATOM 0 HH11 ARG A 219 -5.864 -10.256 -16.044 1.00 1.57 H new ATOM 0 HH12 ARG A 219 -6.060 -10.101 -17.793 1.00 1.57 H new ATOM 0 HH21 ARG A 219 -5.363 -6.642 -17.829 1.00 1.34 H new ATOM 0 HH22 ARG A 219 -5.777 -8.058 -18.801 1.00 1.34 H new ATOM 313 N THR A 220 -6.972 -6.525 -10.438 1.00 0.59 N ATOM 314 CA THR A 220 -7.981 -5.480 -10.560 1.00 0.62 C ATOM 315 C THR A 220 -7.705 -4.349 -9.575 1.00 0.58 C ATOM 316 O THR A 220 -7.588 -3.185 -9.962 1.00 0.70 O ATOM 317 CB THR A 220 -9.415 -6.022 -10.339 1.00 0.65 C ATOM 318 OG1 THR A 220 -9.535 -6.623 -9.042 1.00 0.82 O ATOM 319 CG2 THR A 220 -9.781 -7.044 -11.405 1.00 0.90 C ATOM 0 H THR A 220 -7.304 -7.388 -10.007 1.00 0.59 H new ATOM 0 HA THR A 220 -7.919 -5.100 -11.580 1.00 0.62 H new ATOM 0 HB THR A 220 -10.101 -5.178 -10.408 1.00 0.65 H new ATOM 0 HG1 THR A 220 -9.243 -7.557 -9.086 1.00 0.82 H new ATOM 0 HG21 THR A 220 -10.793 -7.409 -11.227 1.00 0.90 H new ATOM 0 HG22 THR A 220 -9.731 -6.577 -12.389 1.00 0.90 H new ATOM 0 HG23 THR A 220 -9.082 -7.879 -11.364 1.00 0.90 H new ATOM 327 N GLY A 221 -7.574 -4.699 -8.307 1.00 0.47 N ATOM 328 CA GLY A 221 -7.312 -3.708 -7.288 1.00 0.44 C ATOM 329 C GLY A 221 -8.041 -4.009 -5.998 1.00 0.41 C ATOM 330 O GLY A 221 -8.226 -3.126 -5.163 1.00 0.43 O ATOM 0 H GLY A 221 -7.645 -5.657 -7.964 1.00 0.47 H new ATOM 0 HA2 GLY A 221 -6.240 -3.662 -7.095 1.00 0.44 H new ATOM 0 HA3 GLY A 221 -7.613 -2.726 -7.653 1.00 0.44 H new ATOM 334 N HIS A 222 -8.448 -5.260 -5.833 1.00 0.41 N ATOM 335 CA HIS A 222 -9.157 -5.685 -4.640 1.00 0.41 C ATOM 336 C HIS A 222 -8.234 -5.617 -3.437 1.00 0.37 C ATOM 337 O HIS A 222 -7.341 -6.448 -3.285 1.00 0.42 O ATOM 338 CB HIS A 222 -9.685 -7.113 -4.808 1.00 0.48 C ATOM 339 CG HIS A 222 -11.177 -7.190 -4.854 1.00 0.60 C ATOM 340 ND1 HIS A 222 -11.904 -8.178 -4.226 1.00 0.75 N ATOM 341 CD2 HIS A 222 -12.083 -6.389 -5.462 1.00 0.72 C ATOM 342 CE1 HIS A 222 -13.186 -7.978 -4.442 1.00 0.90 C ATOM 343 NE2 HIS A 222 -13.323 -6.900 -5.186 1.00 0.90 N ATOM 0 H HIS A 222 -8.297 -6.001 -6.517 1.00 0.41 H new ATOM 0 HA HIS A 222 -10.003 -5.016 -4.484 1.00 0.41 H new ATOM 0 HB2 HIS A 222 -9.278 -7.538 -5.725 1.00 0.48 H new ATOM 0 HB3 HIS A 222 -9.322 -7.727 -3.984 1.00 0.48 H new ATOM 0 HD2 HIS A 222 -11.868 -5.511 -6.054 1.00 0.72 H new ATOM 0 HE1 HIS A 222 -13.991 -8.595 -4.071 1.00 0.90 H new ATOM 0 HE2 HIS A 222 -14.209 -6.509 -5.505 1.00 0.90 H new ATOM 352 N TYR A 223 -8.433 -4.611 -2.602 1.00 0.33 N ATOM 353 CA TYR A 223 -7.615 -4.441 -1.418 1.00 0.29 C ATOM 354 C TYR A 223 -8.153 -5.276 -0.272 1.00 0.31 C ATOM 355 O TYR A 223 -9.236 -5.014 0.251 1.00 0.33 O ATOM 356 CB TYR A 223 -7.542 -2.967 -1.025 1.00 0.28 C ATOM 357 CG TYR A 223 -6.289 -2.289 -1.525 1.00 0.32 C ATOM 358 CD1 TYR A 223 -5.037 -2.774 -1.171 1.00 0.45 C ATOM 359 CD2 TYR A 223 -6.353 -1.180 -2.359 1.00 0.40 C ATOM 360 CE1 TYR A 223 -3.884 -2.172 -1.629 1.00 0.58 C ATOM 361 CE2 TYR A 223 -5.202 -0.572 -2.822 1.00 0.54 C ATOM 362 CZ TYR A 223 -3.972 -1.073 -2.454 1.00 0.60 C ATOM 363 OH TYR A 223 -2.825 -0.473 -2.915 1.00 0.78 O ATOM 0 H TYR A 223 -9.155 -3.901 -2.724 1.00 0.33 H new ATOM 0 HA TYR A 223 -6.606 -4.785 -1.645 1.00 0.29 H new ATOM 0 HB2 TYR A 223 -8.414 -2.447 -1.421 1.00 0.28 H new ATOM 0 HB3 TYR A 223 -7.587 -2.883 0.061 1.00 0.28 H new ATOM 0 HD1 TYR A 223 -4.965 -3.637 -0.526 1.00 0.45 H new ATOM 0 HD2 TYR A 223 -7.316 -0.787 -2.650 1.00 0.40 H new ATOM 0 HE1 TYR A 223 -2.918 -2.560 -1.342 1.00 0.58 H new ATOM 0 HE2 TYR A 223 -5.266 0.291 -3.468 1.00 0.54 H new ATOM 0 HH TYR A 223 -2.575 0.260 -2.314 1.00 0.78 H new ATOM 373 N LEU A 224 -7.406 -6.304 0.084 1.00 0.33 N ATOM 374 CA LEU A 224 -7.786 -7.181 1.171 1.00 0.37 C ATOM 375 C LEU A 224 -6.704 -7.157 2.242 1.00 0.36 C ATOM 376 O LEU A 224 -5.512 -7.116 1.925 1.00 0.34 O ATOM 377 CB LEU A 224 -7.996 -8.611 0.656 1.00 0.42 C ATOM 378 CG LEU A 224 -8.737 -8.725 -0.679 1.00 0.48 C ATOM 379 CD1 LEU A 224 -7.881 -9.452 -1.705 1.00 0.52 C ATOM 380 CD2 LEU A 224 -10.064 -9.443 -0.496 1.00 0.61 C ATOM 0 H LEU A 224 -6.526 -6.552 -0.369 1.00 0.33 H new ATOM 0 HA LEU A 224 -8.725 -6.833 1.601 1.00 0.37 H new ATOM 0 HB2 LEU A 224 -7.022 -9.089 0.554 1.00 0.42 H new ATOM 0 HB3 LEU A 224 -8.549 -9.173 1.409 1.00 0.42 H new ATOM 0 HG LEU A 224 -8.937 -7.718 -1.045 1.00 0.48 H new ATOM 0 HD11 LEU A 224 -8.424 -9.523 -2.647 1.00 0.52 H new ATOM 0 HD12 LEU A 224 -6.954 -8.901 -1.862 1.00 0.52 H new ATOM 0 HD13 LEU A 224 -7.651 -10.454 -1.342 1.00 0.52 H new ATOM 0 HD21 LEU A 224 -10.575 -9.514 -1.456 1.00 0.61 H new ATOM 0 HD22 LEU A 224 -9.885 -10.445 -0.106 1.00 0.61 H new ATOM 0 HD23 LEU A 224 -10.685 -8.886 0.205 1.00 0.61 H new ATOM 392 N CYS A 225 -7.125 -7.156 3.497 1.00 0.38 N ATOM 393 CA CYS A 225 -6.209 -7.134 4.627 1.00 0.38 C ATOM 394 C CYS A 225 -5.250 -8.326 4.583 1.00 0.41 C ATOM 395 O CYS A 225 -4.071 -8.202 4.241 1.00 0.39 O ATOM 396 CB CYS A 225 -7.027 -7.176 5.919 1.00 0.43 C ATOM 397 SG CYS A 225 -8.213 -8.565 5.990 1.00 0.51 S ATOM 0 H CYS A 225 -8.110 -7.170 3.761 1.00 0.38 H new ATOM 0 HA CYS A 225 -5.612 -6.223 4.584 1.00 0.38 H new ATOM 0 HB2 CYS A 225 -6.347 -7.247 6.768 1.00 0.43 H new ATOM 0 HB3 CYS A 225 -7.572 -6.238 6.025 1.00 0.43 H new ATOM 0 HG CYS A 225 -9.301 -8.177 6.587 1.00 0.51 H new ATOM 402 N ASN A 226 -5.793 -9.472 4.947 1.00 0.47 N ATOM 403 CA ASN A 226 -5.075 -10.735 4.980 1.00 0.51 C ATOM 404 C ASN A 226 -6.050 -11.834 5.372 1.00 0.59 C ATOM 405 O ASN A 226 -6.052 -12.916 4.790 1.00 0.64 O ATOM 406 CB ASN A 226 -3.908 -10.692 5.977 1.00 0.51 C ATOM 407 CG ASN A 226 -3.102 -11.981 5.991 1.00 0.54 C ATOM 408 OD1 ASN A 226 -2.229 -12.191 5.148 1.00 0.63 O ATOM 409 ND2 ASN A 226 -3.376 -12.848 6.957 1.00 0.68 N ATOM 0 H ASN A 226 -6.768 -9.554 5.235 1.00 0.47 H new ATOM 0 HA ASN A 226 -4.656 -10.930 3.993 1.00 0.51 H new ATOM 0 HB2 ASN A 226 -3.251 -9.860 5.725 1.00 0.51 H new ATOM 0 HB3 ASN A 226 -4.297 -10.500 6.977 1.00 0.51 H new ATOM 0 HD21 ASN A 226 -2.856 -13.723 7.019 1.00 0.68 H new ATOM 0 HD22 ASN A 226 -4.106 -12.639 7.638 1.00 0.68 H new ATOM 416 N ALA A 227 -6.904 -11.523 6.348 1.00 0.61 N ATOM 417 CA ALA A 227 -7.899 -12.471 6.830 1.00 0.68 C ATOM 418 C ALA A 227 -8.994 -12.658 5.788 1.00 0.68 C ATOM 419 O ALA A 227 -9.261 -13.778 5.345 1.00 0.73 O ATOM 420 CB ALA A 227 -8.493 -12.005 8.153 1.00 0.70 C ATOM 0 H ALA A 227 -6.923 -10.618 6.819 1.00 0.61 H new ATOM 0 HA ALA A 227 -7.409 -13.430 6.999 1.00 0.68 H new ATOM 0 HB1 ALA A 227 -9.234 -12.728 8.494 1.00 0.70 H new ATOM 0 HB2 ALA A 227 -7.701 -11.918 8.897 1.00 0.70 H new ATOM 0 HB3 ALA A 227 -8.970 -11.034 8.016 1.00 0.70 H new ATOM 426 N CYS A 228 -9.612 -11.557 5.380 1.00 0.64 N ATOM 427 CA CYS A 228 -10.665 -11.611 4.377 1.00 0.65 C ATOM 428 C CYS A 228 -10.062 -11.789 2.983 1.00 0.64 C ATOM 429 O CYS A 228 -10.771 -12.027 2.008 1.00 0.69 O ATOM 430 CB CYS A 228 -11.515 -10.340 4.424 1.00 0.62 C ATOM 431 SG CYS A 228 -11.637 -9.565 6.074 1.00 0.62 S ATOM 0 H CYS A 228 -9.403 -10.621 5.727 1.00 0.64 H new ATOM 0 HA CYS A 228 -11.305 -12.466 4.595 1.00 0.65 H new ATOM 0 HB2 CYS A 228 -11.098 -9.614 3.726 1.00 0.62 H new ATOM 0 HB3 CYS A 228 -12.519 -10.578 4.074 1.00 0.62 H new ATOM 0 HG CYS A 228 -11.280 -8.318 5.995 1.00 0.62 H new ATOM 436 N GLY A 229 -8.740 -11.680 2.909 1.00 0.61 N ATOM 437 CA GLY A 229 -8.044 -11.824 1.644 1.00 0.63 C ATOM 438 C GLY A 229 -8.138 -13.225 1.083 1.00 0.69 C ATOM 439 O GLY A 229 -8.078 -13.427 -0.128 1.00 0.70 O ATOM 0 H GLY A 229 -8.135 -11.493 3.708 1.00 0.61 H new ATOM 0 HA2 GLY A 229 -8.459 -11.120 0.923 1.00 0.63 H new ATOM 0 HA3 GLY A 229 -6.995 -11.561 1.779 1.00 0.63 H new ATOM 443 N LEU A 230 -8.314 -14.198 1.962 1.00 0.74 N ATOM 444 CA LEU A 230 -8.409 -15.588 1.545 1.00 0.82 C ATOM 445 C LEU A 230 -9.797 -15.912 1.002 1.00 0.83 C ATOM 446 O LEU A 230 -10.039 -17.020 0.528 1.00 0.90 O ATOM 447 CB LEU A 230 -8.071 -16.516 2.713 1.00 0.90 C ATOM 448 CG LEU A 230 -6.623 -16.441 3.200 1.00 0.95 C ATOM 449 CD1 LEU A 230 -6.443 -17.251 4.472 1.00 1.09 C ATOM 450 CD2 LEU A 230 -5.667 -16.923 2.118 1.00 0.98 C ATOM 0 H LEU A 230 -8.394 -14.051 2.968 1.00 0.74 H new ATOM 0 HA LEU A 230 -7.688 -15.746 0.743 1.00 0.82 H new ATOM 0 HB2 LEU A 230 -8.732 -16.281 3.547 1.00 0.90 H new ATOM 0 HB3 LEU A 230 -8.286 -17.542 2.416 1.00 0.90 H new ATOM 0 HG LEU A 230 -6.391 -15.399 3.422 1.00 0.95 H new ATOM 0 HD11 LEU A 230 -5.406 -17.185 4.802 1.00 1.09 H new ATOM 0 HD12 LEU A 230 -7.097 -16.857 5.250 1.00 1.09 H new ATOM 0 HD13 LEU A 230 -6.696 -18.293 4.278 1.00 1.09 H new ATOM 0 HD21 LEU A 230 -4.642 -16.862 2.484 1.00 0.98 H new ATOM 0 HD22 LEU A 230 -5.899 -17.957 1.861 1.00 0.98 H new ATOM 0 HD23 LEU A 230 -5.774 -16.296 1.233 1.00 0.98 H new ATOM 462 N TYR A 231 -10.700 -14.940 1.052 1.00 0.79 N ATOM 463 CA TYR A 231 -12.060 -15.134 0.560 1.00 0.82 C ATOM 464 C TYR A 231 -12.052 -15.342 -0.953 1.00 0.80 C ATOM 465 O TYR A 231 -12.878 -16.081 -1.495 1.00 0.85 O ATOM 466 CB TYR A 231 -12.931 -13.928 0.922 1.00 0.79 C ATOM 467 CG TYR A 231 -14.397 -14.252 1.081 1.00 0.90 C ATOM 468 CD1 TYR A 231 -14.812 -15.295 1.900 1.00 1.04 C ATOM 469 CD2 TYR A 231 -15.364 -13.515 0.414 1.00 0.96 C ATOM 470 CE1 TYR A 231 -16.153 -15.594 2.047 1.00 1.19 C ATOM 471 CE2 TYR A 231 -16.706 -13.808 0.557 1.00 1.11 C ATOM 472 CZ TYR A 231 -17.095 -14.847 1.374 1.00 1.20 C ATOM 473 OH TYR A 231 -18.432 -15.144 1.516 1.00 1.38 O ATOM 0 H TYR A 231 -10.516 -14.010 1.428 1.00 0.79 H new ATOM 0 HA TYR A 231 -12.477 -16.023 1.033 1.00 0.82 H new ATOM 0 HB2 TYR A 231 -12.563 -13.494 1.851 1.00 0.79 H new ATOM 0 HB3 TYR A 231 -12.820 -13.168 0.149 1.00 0.79 H new ATOM 0 HD1 TYR A 231 -14.075 -15.881 2.430 1.00 1.04 H new ATOM 0 HD2 TYR A 231 -15.063 -12.700 -0.227 1.00 0.96 H new ATOM 0 HE1 TYR A 231 -16.461 -16.409 2.686 1.00 1.19 H new ATOM 0 HE2 TYR A 231 -17.447 -13.225 0.031 1.00 1.11 H new ATOM 0 HH TYR A 231 -18.970 -14.398 1.178 1.00 1.38 H new ATOM 483 N HIS A 232 -11.085 -14.721 -1.621 1.00 0.74 N ATOM 484 CA HIS A 232 -10.964 -14.823 -3.071 1.00 0.73 C ATOM 485 C HIS A 232 -10.146 -16.054 -3.469 1.00 0.75 C ATOM 486 O HIS A 232 -9.874 -16.272 -4.647 1.00 0.77 O ATOM 487 CB HIS A 232 -10.315 -13.555 -3.643 1.00 0.73 C ATOM 488 CG HIS A 232 -10.770 -13.222 -5.033 1.00 0.73 C ATOM 489 ND1 HIS A 232 -10.575 -14.054 -6.112 1.00 0.95 N ATOM 490 CD2 HIS A 232 -11.431 -12.143 -5.511 1.00 0.74 C ATOM 491 CE1 HIS A 232 -11.100 -13.505 -7.190 1.00 0.95 C ATOM 492 NE2 HIS A 232 -11.628 -12.342 -6.856 1.00 0.78 N ATOM 0 H HIS A 232 -10.372 -14.140 -1.180 1.00 0.74 H new ATOM 0 HA HIS A 232 -11.967 -14.928 -3.485 1.00 0.73 H new ATOM 0 HB2 HIS A 232 -10.538 -12.715 -2.986 1.00 0.73 H new ATOM 0 HB3 HIS A 232 -9.232 -13.680 -3.644 1.00 0.73 H new ATOM 0 HD1 HIS A 232 -10.098 -14.955 -6.082 1.00 0.95 H new ATOM 0 HD2 HIS A 232 -11.746 -11.282 -4.940 1.00 0.74 H new ATOM 0 HE1 HIS A 232 -11.098 -13.935 -8.181 1.00 0.95 H new ATOM 501 N LYS A 233 -9.755 -16.851 -2.482 1.00 0.80 N ATOM 502 CA LYS A 233 -8.969 -18.053 -2.740 1.00 0.84 C ATOM 503 C LYS A 233 -9.654 -19.287 -2.162 1.00 0.87 C ATOM 504 O LYS A 233 -10.031 -20.200 -2.896 1.00 0.94 O ATOM 505 CB LYS A 233 -7.564 -17.913 -2.147 1.00 0.85 C ATOM 506 CG LYS A 233 -6.570 -17.233 -3.076 1.00 0.83 C ATOM 507 CD LYS A 233 -6.263 -18.097 -4.288 1.00 0.94 C ATOM 508 CE LYS A 233 -4.974 -17.666 -4.967 1.00 1.08 C ATOM 509 NZ LYS A 233 -4.654 -18.520 -6.142 1.00 1.28 N ATOM 0 H LYS A 233 -9.968 -16.688 -1.498 1.00 0.80 H new ATOM 0 HA LYS A 233 -8.888 -18.175 -3.820 1.00 0.84 H new ATOM 0 HB2 LYS A 233 -7.627 -17.345 -1.219 1.00 0.85 H new ATOM 0 HB3 LYS A 233 -7.188 -18.903 -1.890 1.00 0.85 H new ATOM 0 HG2 LYS A 233 -6.973 -16.274 -3.403 1.00 0.83 H new ATOM 0 HG3 LYS A 233 -5.648 -17.023 -2.534 1.00 0.83 H new ATOM 0 HD2 LYS A 233 -6.183 -19.140 -3.982 1.00 0.94 H new ATOM 0 HD3 LYS A 233 -7.088 -18.036 -4.998 1.00 0.94 H new ATOM 0 HE2 LYS A 233 -5.061 -16.627 -5.286 1.00 1.08 H new ATOM 0 HE3 LYS A 233 -4.154 -17.712 -4.251 1.00 1.08 H new ATOM 0 HZ1 LYS A 233 -3.768 -18.194 -6.577 1.00 1.28 H new ATOM 0 HZ2 LYS A 233 -4.545 -19.507 -5.834 1.00 1.28 H new ATOM 0 HZ3 LYS A 233 -5.425 -18.457 -6.837 1.00 1.28 H new ATOM 523 N MET A 234 -9.832 -19.291 -0.846 1.00 0.86 N ATOM 524 CA MET A 234 -10.458 -20.410 -0.150 1.00 0.91 C ATOM 525 C MET A 234 -11.882 -20.628 -0.643 1.00 0.99 C ATOM 526 O MET A 234 -12.251 -21.733 -1.034 1.00 1.09 O ATOM 527 CB MET A 234 -10.464 -20.163 1.360 1.00 0.88 C ATOM 528 CG MET A 234 -10.640 -21.428 2.185 1.00 0.92 C ATOM 529 SD MET A 234 -9.254 -22.567 2.011 1.00 1.07 S ATOM 530 CE MET A 234 -7.926 -21.599 2.728 1.00 1.14 C ATOM 0 H MET A 234 -9.549 -18.525 -0.235 1.00 0.86 H new ATOM 0 HA MET A 234 -9.876 -21.307 -0.362 1.00 0.91 H new ATOM 0 HB2 MET A 234 -9.528 -19.682 1.644 1.00 0.88 H new ATOM 0 HB3 MET A 234 -11.267 -19.467 1.602 1.00 0.88 H new ATOM 0 HG2 MET A 234 -10.755 -21.159 3.235 1.00 0.92 H new ATOM 0 HG3 MET A 234 -11.559 -21.930 1.882 1.00 0.92 H new ATOM 0 HE1 MET A 234 -7.340 -22.226 3.399 1.00 1.14 H new ATOM 0 HE2 MET A 234 -7.284 -21.218 1.934 1.00 1.14 H new ATOM 0 HE3 MET A 234 -8.346 -20.763 3.287 1.00 1.14 H new ATOM 540 N ASN A 235 -12.681 -19.567 -0.631 1.00 0.96 N ATOM 541 CA ASN A 235 -14.063 -19.656 -1.093 1.00 1.04 C ATOM 542 C ASN A 235 -14.125 -19.471 -2.601 1.00 1.06 C ATOM 543 O ASN A 235 -15.090 -19.874 -3.245 1.00 1.20 O ATOM 544 CB ASN A 235 -14.953 -18.615 -0.404 1.00 1.02 C ATOM 545 CG ASN A 235 -15.665 -19.178 0.811 1.00 1.15 C ATOM 546 OD1 ASN A 235 -15.079 -19.918 1.597 1.00 1.23 O ATOM 547 ND2 ASN A 235 -16.939 -18.851 0.959 1.00 1.25 N ATOM 0 H ASN A 235 -12.399 -18.641 -0.309 1.00 0.96 H new ATOM 0 HA ASN A 235 -14.437 -20.646 -0.833 1.00 1.04 H new ATOM 0 HB2 ASN A 235 -14.344 -17.763 -0.103 1.00 1.02 H new ATOM 0 HB3 ASN A 235 -15.691 -18.244 -1.115 1.00 1.02 H new ATOM 0 HD21 ASN A 235 -17.471 -19.217 1.749 1.00 1.25 H new ATOM 0 HD22 ASN A 235 -17.389 -18.233 0.283 1.00 1.25 H new ATOM 554 N GLY A 236 -13.081 -18.862 -3.153 1.00 0.94 N ATOM 555 CA GLY A 236 -13.024 -18.626 -4.584 1.00 0.98 C ATOM 556 C GLY A 236 -14.065 -17.626 -5.049 1.00 0.98 C ATOM 557 O GLY A 236 -14.512 -17.669 -6.194 1.00 1.09 O ATOM 0 H GLY A 236 -12.270 -18.526 -2.633 1.00 0.94 H new ATOM 0 HA2 GLY A 236 -12.031 -18.263 -4.850 1.00 0.98 H new ATOM 0 HA3 GLY A 236 -13.170 -19.569 -5.111 1.00 0.98 H new ATOM 561 N GLN A 237 -14.446 -16.719 -4.161 1.00 0.90 N ATOM 562 CA GLN A 237 -15.445 -15.711 -4.480 1.00 0.90 C ATOM 563 C GLN A 237 -14.778 -14.368 -4.738 1.00 0.84 C ATOM 564 O GLN A 237 -13.557 -14.290 -4.838 1.00 0.79 O ATOM 565 CB GLN A 237 -16.462 -15.596 -3.342 1.00 0.92 C ATOM 566 CG GLN A 237 -17.299 -16.850 -3.160 1.00 1.05 C ATOM 567 CD GLN A 237 -18.132 -16.827 -1.896 1.00 1.11 C ATOM 568 OE1 GLN A 237 -18.371 -17.868 -1.287 1.00 1.21 O ATOM 569 NE2 GLN A 237 -18.588 -15.650 -1.500 1.00 1.17 N ATOM 0 H GLN A 237 -14.077 -16.661 -3.212 1.00 0.90 H new ATOM 0 HA GLN A 237 -15.971 -16.013 -5.386 1.00 0.90 H new ATOM 0 HB2 GLN A 237 -15.935 -15.380 -2.413 1.00 0.92 H new ATOM 0 HB3 GLN A 237 -17.122 -14.751 -3.537 1.00 0.92 H new ATOM 0 HG2 GLN A 237 -17.958 -16.969 -4.020 1.00 1.05 H new ATOM 0 HG3 GLN A 237 -16.642 -17.719 -3.140 1.00 1.05 H new ATOM 0 HE21 GLN A 237 -18.366 -14.811 -2.035 1.00 1.17 H new ATOM 0 HE22 GLN A 237 -19.162 -15.582 -0.659 1.00 1.17 H new ATOM 578 N ASN A 238 -15.584 -13.327 -4.854 1.00 0.87 N ATOM 579 CA ASN A 238 -15.076 -11.987 -5.105 1.00 0.84 C ATOM 580 C ASN A 238 -14.651 -11.324 -3.802 1.00 0.84 C ATOM 581 O ASN A 238 -15.492 -11.249 -2.884 1.00 0.96 O ATOM 582 CB ASN A 238 -16.152 -11.146 -5.796 1.00 0.95 C ATOM 583 CG ASN A 238 -15.674 -9.748 -6.130 1.00 0.91 C ATOM 584 OD1 ASN A 238 -14.679 -9.568 -6.831 1.00 0.93 O ATOM 585 ND2 ASN A 238 -16.383 -8.744 -5.631 1.00 0.96 N ATOM 586 OXT ASN A 238 -13.486 -10.883 -3.709 1.00 0.80 O ATOM 0 H ASN A 238 -16.600 -13.384 -4.778 1.00 0.87 H new ATOM 0 HA ASN A 238 -14.204 -12.059 -5.755 1.00 0.84 H new ATOM 0 HB2 ASN A 238 -16.467 -11.647 -6.712 1.00 0.95 H new ATOM 0 HB3 ASN A 238 -17.028 -11.082 -5.150 1.00 0.95 H new ATOM 0 HD21 ASN A 238 -16.109 -7.781 -5.824 1.00 0.96 H new ATOM 0 HD22 ASN A 238 -17.202 -8.935 -5.054 1.00 0.96 H new ATOM 594 N GLY B 1 -30.726 14.007 -15.689 1.00 1.44 N ATOM 595 CA GLY B 1 -31.716 13.668 -14.638 1.00 1.42 C ATOM 596 C GLY B 1 -31.312 12.427 -13.873 1.00 1.36 C ATOM 597 O GLY B 1 -30.375 11.732 -14.277 1.00 1.36 O ATOM 0 H1 GLY B 1 -30.327 14.948 -15.499 1.00 1.44 H new ATOM 0 H2 GLY B 1 -29.963 13.300 -15.688 1.00 1.44 H new ATOM 0 H3 GLY B 1 -31.193 14.010 -16.618 1.00 1.44 H new ATOM 0 HA2 GLY B 1 -31.816 14.505 -13.948 1.00 1.42 H new ATOM 0 HA3 GLY B 1 -32.694 13.513 -15.094 1.00 1.42 H new ATOM 603 N SER B 2 -32.010 12.153 -12.771 1.00 1.35 N ATOM 604 CA SER B 2 -31.726 10.994 -11.927 1.00 1.32 C ATOM 605 C SER B 2 -30.314 11.075 -11.340 1.00 1.29 C ATOM 606 O SER B 2 -29.655 12.118 -11.418 1.00 1.34 O ATOM 607 CB SER B 2 -31.912 9.699 -12.726 1.00 1.32 C ATOM 608 OG SER B 2 -33.195 9.653 -13.326 1.00 1.35 O ATOM 0 H SER B 2 -32.786 12.727 -12.440 1.00 1.35 H new ATOM 0 HA SER B 2 -32.431 10.993 -11.096 1.00 1.32 H new ATOM 0 HB2 SER B 2 -31.144 9.629 -13.496 1.00 1.32 H new ATOM 0 HB3 SER B 2 -31.783 8.840 -12.068 1.00 1.32 H new ATOM 0 HG SER B 2 -33.290 8.819 -13.832 1.00 1.35 H new ATOM 614 N LEU B 3 -29.860 9.993 -10.725 1.00 1.26 N ATOM 615 CA LEU B 3 -28.529 9.960 -10.139 1.00 1.24 C ATOM 616 C LEU B 3 -27.493 9.574 -11.192 1.00 1.23 C ATOM 617 O LEU B 3 -26.654 10.398 -11.576 1.00 1.22 O ATOM 618 CB LEU B 3 -28.486 8.975 -8.965 1.00 1.26 C ATOM 619 CG LEU B 3 -27.201 9.005 -8.133 1.00 1.27 C ATOM 620 CD1 LEU B 3 -27.086 10.312 -7.368 1.00 1.23 C ATOM 621 CD2 LEU B 3 -27.161 7.824 -7.178 1.00 1.39 C ATOM 0 H LEU B 3 -30.392 9.129 -10.619 1.00 1.26 H new ATOM 0 HA LEU B 3 -28.291 10.956 -9.766 1.00 1.24 H new ATOM 0 HB2 LEU B 3 -29.330 9.182 -8.307 1.00 1.26 H new ATOM 0 HB3 LEU B 3 -28.624 7.966 -9.353 1.00 1.26 H new ATOM 0 HG LEU B 3 -26.351 8.932 -8.812 1.00 1.27 H new ATOM 0 HD11 LEU B 3 -26.166 10.312 -6.784 1.00 1.23 H new ATOM 0 HD12 LEU B 3 -27.069 11.145 -8.071 1.00 1.23 H new ATOM 0 HD13 LEU B 3 -27.940 10.419 -6.699 1.00 1.23 H new ATOM 0 HD21 LEU B 3 -26.242 7.860 -6.594 1.00 1.39 H new ATOM 0 HD22 LEU B 3 -28.019 7.869 -6.507 1.00 1.39 H new ATOM 0 HD23 LEU B 3 -27.194 6.895 -7.747 1.00 1.39 H new ATOM 633 N LEU B 4 -27.566 8.316 -11.644 1.00 1.27 N ATOM 634 CA LEU B 4 -26.660 7.762 -12.663 1.00 1.29 C ATOM 635 C LEU B 4 -25.240 7.571 -12.130 1.00 1.24 C ATOM 636 O LEU B 4 -24.660 6.494 -12.266 1.00 1.22 O ATOM 637 CB LEU B 4 -26.636 8.631 -13.927 1.00 1.32 C ATOM 638 CG LEU B 4 -27.618 8.221 -15.030 1.00 1.42 C ATOM 639 CD1 LEU B 4 -27.430 6.759 -15.397 1.00 1.54 C ATOM 640 CD2 LEU B 4 -29.054 8.483 -14.603 1.00 1.42 C ATOM 0 H LEU B 4 -28.260 7.647 -11.311 1.00 1.27 H new ATOM 0 HA LEU B 4 -27.055 6.780 -12.924 1.00 1.29 H new ATOM 0 HB2 LEU B 4 -26.847 9.662 -13.642 1.00 1.32 H new ATOM 0 HB3 LEU B 4 -25.627 8.614 -14.339 1.00 1.32 H new ATOM 0 HG LEU B 4 -27.409 8.828 -15.911 1.00 1.42 H new ATOM 0 HD11 LEU B 4 -28.136 6.487 -16.182 1.00 1.54 H new ATOM 0 HD12 LEU B 4 -26.412 6.602 -15.754 1.00 1.54 H new ATOM 0 HD13 LEU B 4 -27.606 6.138 -14.519 1.00 1.54 H new ATOM 0 HD21 LEU B 4 -29.732 8.184 -15.403 1.00 1.42 H new ATOM 0 HD22 LEU B 4 -29.277 7.908 -13.704 1.00 1.42 H new ATOM 0 HD23 LEU B 4 -29.184 9.545 -14.396 1.00 1.42 H new ATOM 652 N LYS B 5 -24.685 8.619 -11.541 1.00 1.25 N ATOM 653 CA LYS B 5 -23.343 8.566 -10.985 1.00 1.22 C ATOM 654 C LYS B 5 -23.413 8.495 -9.465 1.00 1.16 C ATOM 655 O LYS B 5 -23.779 9.474 -8.809 1.00 1.27 O ATOM 656 CB LYS B 5 -22.537 9.792 -11.421 1.00 1.38 C ATOM 657 CG LYS B 5 -22.559 10.029 -12.924 1.00 1.49 C ATOM 658 CD LYS B 5 -21.912 8.877 -13.673 1.00 1.59 C ATOM 659 CE LYS B 5 -22.183 8.955 -15.165 1.00 1.88 C ATOM 660 NZ LYS B 5 -21.495 7.866 -15.905 1.00 2.01 N ATOM 0 H LYS B 5 -25.147 9.522 -11.436 1.00 1.25 H new ATOM 0 HA LYS B 5 -22.843 7.672 -11.358 1.00 1.22 H new ATOM 0 HB2 LYS B 5 -22.931 10.674 -10.916 1.00 1.38 H new ATOM 0 HB3 LYS B 5 -21.504 9.673 -11.095 1.00 1.38 H new ATOM 0 HG2 LYS B 5 -23.589 10.152 -13.260 1.00 1.49 H new ATOM 0 HG3 LYS B 5 -22.035 10.956 -13.156 1.00 1.49 H new ATOM 0 HD2 LYS B 5 -20.836 8.887 -13.497 1.00 1.59 H new ATOM 0 HD3 LYS B 5 -22.290 7.932 -13.283 1.00 1.59 H new ATOM 0 HE2 LYS B 5 -23.257 8.895 -15.344 1.00 1.88 H new ATOM 0 HE3 LYS B 5 -21.850 9.921 -15.546 1.00 1.88 H new ATOM 0 HZ1 LYS B 5 -21.703 7.951 -16.920 1.00 2.01 H new ATOM 0 HZ2 LYS B 5 -20.469 7.939 -15.754 1.00 2.01 H new ATOM 0 HZ3 LYS B 5 -21.831 6.945 -15.559 1.00 2.01 H new ATOM 674 N PRO B 6 -23.075 7.335 -8.889 1.00 1.02 N ATOM 675 CA PRO B 6 -23.106 7.132 -7.445 1.00 1.00 C ATOM 676 C PRO B 6 -21.856 7.676 -6.754 1.00 1.02 C ATOM 677 O PRO B 6 -21.040 6.919 -6.224 1.00 1.01 O ATOM 678 CB PRO B 6 -23.189 5.610 -7.316 1.00 0.90 C ATOM 679 CG PRO B 6 -22.470 5.088 -8.514 1.00 0.86 C ATOM 680 CD PRO B 6 -22.626 6.125 -9.603 1.00 0.95 C ATOM 0 HA PRO B 6 -23.932 7.658 -6.967 1.00 1.00 H new ATOM 0 HB2 PRO B 6 -22.723 5.265 -6.393 1.00 0.90 H new ATOM 0 HB3 PRO B 6 -24.225 5.270 -7.297 1.00 0.90 H new ATOM 0 HG2 PRO B 6 -21.417 4.919 -8.289 1.00 0.86 H new ATOM 0 HG3 PRO B 6 -22.887 4.131 -8.829 1.00 0.86 H new ATOM 0 HD2 PRO B 6 -21.686 6.297 -10.126 1.00 0.95 H new ATOM 0 HD3 PRO B 6 -23.354 5.811 -10.351 1.00 0.95 H new ATOM 688 N ALA B 7 -21.710 8.997 -6.767 1.00 1.11 N ATOM 689 CA ALA B 7 -20.566 9.651 -6.144 1.00 1.15 C ATOM 690 C ALA B 7 -20.722 9.707 -4.621 1.00 1.14 C ATOM 691 O ALA B 7 -20.736 10.782 -4.020 1.00 1.22 O ATOM 692 CB ALA B 7 -20.386 11.047 -6.721 1.00 1.26 C ATOM 0 H ALA B 7 -22.373 9.637 -7.204 1.00 1.11 H new ATOM 0 HA ALA B 7 -19.674 9.064 -6.362 1.00 1.15 H new ATOM 0 HB1 ALA B 7 -19.529 11.528 -6.249 1.00 1.26 H new ATOM 0 HB2 ALA B 7 -20.217 10.978 -7.796 1.00 1.26 H new ATOM 0 HB3 ALA B 7 -21.283 11.637 -6.532 1.00 1.26 H new ATOM 698 N ARG B 8 -20.846 8.537 -4.010 1.00 1.08 N ATOM 699 CA ARG B 8 -21.004 8.423 -2.568 1.00 1.08 C ATOM 700 C ARG B 8 -20.211 7.230 -2.055 1.00 1.01 C ATOM 701 O ARG B 8 -20.498 6.093 -2.411 1.00 1.02 O ATOM 702 CB ARG B 8 -22.484 8.268 -2.197 1.00 1.12 C ATOM 703 CG ARG B 8 -23.264 9.572 -2.207 1.00 1.21 C ATOM 704 CD ARG B 8 -22.861 10.474 -1.049 1.00 1.25 C ATOM 705 NE ARG B 8 -23.619 11.723 -1.046 1.00 1.41 N ATOM 706 CZ ARG B 8 -23.845 12.461 0.041 1.00 1.46 C ATOM 707 NH1 ARG B 8 -23.378 12.074 1.226 1.00 1.66 N ATOM 708 NH2 ARG B 8 -24.535 13.593 -0.055 1.00 1.61 N ATOM 0 H ARG B 8 -20.840 7.642 -4.499 1.00 1.08 H new ATOM 0 HA ARG B 8 -20.626 9.333 -2.103 1.00 1.08 H new ATOM 0 HB2 ARG B 8 -22.951 7.572 -2.893 1.00 1.12 H new ATOM 0 HB3 ARG B 8 -22.554 7.822 -1.205 1.00 1.12 H new ATOM 0 HG2 ARG B 8 -23.094 10.091 -3.150 1.00 1.21 H new ATOM 0 HG3 ARG B 8 -24.331 9.359 -2.149 1.00 1.21 H new ATOM 0 HD2 ARG B 8 -23.021 9.950 -0.107 1.00 1.25 H new ATOM 0 HD3 ARG B 8 -21.796 10.695 -1.114 1.00 1.25 H new ATOM 0 HE ARG B 8 -24.000 12.052 -1.933 1.00 1.41 H new ATOM 0 HH11 ARG B 8 -22.844 11.209 1.306 1.00 1.66 H new ATOM 0 HH12 ARG B 8 -23.554 12.643 2.054 1.00 1.66 H new ATOM 0 HH21 ARG B 8 -24.892 13.897 -0.961 1.00 1.61 H new ATOM 0 HH22 ARG B 8 -24.708 14.157 0.777 1.00 1.61 H new ATOM 722 N PHE B 9 -19.211 7.497 -1.232 1.00 0.97 N ATOM 723 CA PHE B 9 -18.375 6.437 -0.678 1.00 0.91 C ATOM 724 C PHE B 9 -18.672 6.232 0.804 1.00 0.91 C ATOM 725 O PHE B 9 -17.780 5.904 1.587 1.00 0.86 O ATOM 726 CB PHE B 9 -16.891 6.762 -0.888 1.00 0.88 C ATOM 727 CG PHE B 9 -16.528 8.197 -0.613 1.00 0.93 C ATOM 728 CD1 PHE B 9 -16.296 8.635 0.682 1.00 0.91 C ATOM 729 CD2 PHE B 9 -16.410 9.105 -1.653 1.00 1.04 C ATOM 730 CE1 PHE B 9 -15.957 9.949 0.935 1.00 0.98 C ATOM 731 CE2 PHE B 9 -16.069 10.422 -1.406 1.00 1.11 C ATOM 732 CZ PHE B 9 -15.842 10.844 -0.110 1.00 1.07 C ATOM 0 H PHE B 9 -18.956 8.437 -0.931 1.00 0.97 H new ATOM 0 HA PHE B 9 -18.606 5.510 -1.203 1.00 0.91 H new ATOM 0 HB2 PHE B 9 -16.295 6.118 -0.242 1.00 0.88 H new ATOM 0 HB3 PHE B 9 -16.620 6.521 -1.916 1.00 0.88 H new ATOM 0 HD1 PHE B 9 -16.382 7.939 1.503 1.00 0.91 H new ATOM 0 HD2 PHE B 9 -16.586 8.780 -2.668 1.00 1.04 H new ATOM 0 HE1 PHE B 9 -15.782 10.277 1.949 1.00 0.98 H new ATOM 0 HE2 PHE B 9 -15.980 11.120 -2.225 1.00 1.11 H new ATOM 0 HZ PHE B 9 -15.575 11.872 0.085 1.00 1.07 H new ATOM 742 N MET B 10 -19.930 6.413 1.177 1.00 0.97 N ATOM 743 CA MET B 10 -20.344 6.257 2.564 1.00 0.98 C ATOM 744 C MET B 10 -21.803 5.822 2.643 1.00 1.04 C ATOM 745 O MET B 10 -22.706 6.590 2.303 1.00 1.11 O ATOM 746 CB MET B 10 -20.155 7.571 3.331 1.00 1.00 C ATOM 747 CG MET B 10 -20.543 7.489 4.800 1.00 1.02 C ATOM 748 SD MET B 10 -20.365 9.069 5.651 1.00 1.08 S ATOM 749 CE MET B 10 -20.949 8.632 7.288 1.00 1.12 C ATOM 0 H MET B 10 -20.683 6.668 0.538 1.00 0.97 H new ATOM 0 HA MET B 10 -19.721 5.487 3.018 1.00 0.98 H new ATOM 0 HB2 MET B 10 -19.111 7.876 3.258 1.00 1.00 H new ATOM 0 HB3 MET B 10 -20.749 8.349 2.851 1.00 1.00 H new ATOM 0 HG2 MET B 10 -21.576 7.151 4.881 1.00 1.02 H new ATOM 0 HG3 MET B 10 -19.923 6.742 5.295 1.00 1.02 H new ATOM 0 HE1 MET B 10 -20.901 9.507 7.937 1.00 1.12 H new ATOM 0 HE2 MET B 10 -21.980 8.282 7.225 1.00 1.12 H new ATOM 0 HE3 MET B 10 -20.322 7.841 7.699 1.00 1.12 H new ATOM 759 N CYS B 11 -22.022 4.587 3.068 1.00 1.04 N ATOM 760 CA CYS B 11 -23.358 4.039 3.205 1.00 1.11 C ATOM 761 C CYS B 11 -23.978 4.452 4.534 1.00 1.17 C ATOM 762 O CYS B 11 -23.279 4.589 5.542 1.00 1.16 O ATOM 763 CB CYS B 11 -23.265 2.521 3.119 1.00 1.10 C ATOM 764 SG CYS B 11 -21.541 1.947 3.138 1.00 1.02 S ATOM 0 H CYS B 11 -21.278 3.939 3.327 1.00 1.04 H new ATOM 0 HA CYS B 11 -23.994 4.423 2.407 1.00 1.11 H new ATOM 0 HB2 CYS B 11 -23.805 2.076 3.955 1.00 1.10 H new ATOM 0 HB3 CYS B 11 -23.752 2.178 2.206 1.00 1.10 H new ATOM 0 HG CYS B 11 -21.422 0.958 3.974 1.00 1.02 H new ATOM 769 N LEU B 12 -25.287 4.640 4.527 1.00 1.24 N ATOM 770 CA LEU B 12 -26.010 5.021 5.732 1.00 1.32 C ATOM 771 C LEU B 12 -26.028 3.880 6.764 1.00 1.31 C ATOM 772 O LEU B 12 -25.850 4.139 7.953 1.00 1.34 O ATOM 773 CB LEU B 12 -27.437 5.474 5.397 1.00 1.42 C ATOM 774 CG LEU B 12 -27.538 6.820 4.677 1.00 1.51 C ATOM 775 CD1 LEU B 12 -27.414 6.638 3.173 1.00 1.49 C ATOM 776 CD2 LEU B 12 -28.845 7.510 5.021 1.00 1.64 C ATOM 0 H LEU B 12 -25.873 4.535 3.699 1.00 1.24 H new ATOM 0 HA LEU B 12 -25.481 5.863 6.178 1.00 1.32 H new ATOM 0 HB2 LEU B 12 -27.907 4.711 4.776 1.00 1.42 H new ATOM 0 HB3 LEU B 12 -28.010 5.530 6.322 1.00 1.42 H new ATOM 0 HG LEU B 12 -26.714 7.449 5.014 1.00 1.51 H new ATOM 0 HD11 LEU B 12 -27.489 7.608 2.682 1.00 1.49 H new ATOM 0 HD12 LEU B 12 -26.450 6.186 2.939 1.00 1.49 H new ATOM 0 HD13 LEU B 12 -28.214 5.989 2.818 1.00 1.49 H new ATOM 0 HD21 LEU B 12 -28.900 8.466 4.500 1.00 1.64 H new ATOM 0 HD22 LEU B 12 -29.680 6.881 4.714 1.00 1.64 H new ATOM 0 HD23 LEU B 12 -28.895 7.680 6.097 1.00 1.64 H new ATOM 788 N PRO B 13 -26.269 2.605 6.356 1.00 1.30 N ATOM 789 CA PRO B 13 -26.271 1.475 7.297 1.00 1.30 C ATOM 790 C PRO B 13 -24.931 1.301 8.018 1.00 1.22 C ATOM 791 O PRO B 13 -24.885 1.259 9.248 1.00 1.28 O ATOM 792 CB PRO B 13 -26.557 0.255 6.413 1.00 1.31 C ATOM 793 CG PRO B 13 -27.228 0.809 5.208 1.00 1.34 C ATOM 794 CD PRO B 13 -26.612 2.159 4.987 1.00 1.29 C ATOM 0 HA PRO B 13 -27.004 1.625 8.090 1.00 1.30 H new ATOM 0 HB2 PRO B 13 -25.637 -0.267 6.149 1.00 1.31 H new ATOM 0 HB3 PRO B 13 -27.195 -0.464 6.926 1.00 1.31 H new ATOM 0 HG2 PRO B 13 -27.077 0.163 4.343 1.00 1.34 H new ATOM 0 HG3 PRO B 13 -28.304 0.890 5.361 1.00 1.34 H new ATOM 0 HD2 PRO B 13 -25.729 2.099 4.350 1.00 1.29 H new ATOM 0 HD3 PRO B 13 -27.308 2.844 4.503 1.00 1.29 H new ATOM 802 N CYS B 14 -23.846 1.212 7.250 1.00 1.09 N ATOM 803 CA CYS B 14 -22.518 1.036 7.818 1.00 1.00 C ATOM 804 C CYS B 14 -22.087 2.260 8.615 1.00 1.04 C ATOM 805 O CYS B 14 -21.908 2.193 9.833 1.00 1.06 O ATOM 806 CB CYS B 14 -21.499 0.759 6.712 1.00 0.92 C ATOM 807 SG CYS B 14 -21.814 -0.769 5.772 1.00 1.03 S ATOM 0 H CYS B 14 -23.865 1.259 6.231 1.00 1.09 H new ATOM 0 HA CYS B 14 -22.560 0.183 8.495 1.00 1.00 H new ATOM 0 HB2 CYS B 14 -21.491 1.602 6.021 1.00 0.92 H new ATOM 0 HB3 CYS B 14 -20.505 0.701 7.155 1.00 0.92 H new ATOM 0 HG CYS B 14 -21.023 -0.815 4.741 1.00 1.03 H new ATOM 812 N GLY B 15 -21.932 3.375 7.921 1.00 1.07 N ATOM 813 CA GLY B 15 -21.501 4.597 8.569 1.00 1.11 C ATOM 814 C GLY B 15 -20.000 4.773 8.477 1.00 1.01 C ATOM 815 O GLY B 15 -19.438 5.729 9.018 1.00 1.04 O ATOM 0 H GLY B 15 -22.097 3.457 6.918 1.00 1.07 H new ATOM 0 HA2 GLY B 15 -21.998 5.450 8.107 1.00 1.11 H new ATOM 0 HA3 GLY B 15 -21.803 4.581 9.616 1.00 1.11 H new ATOM 819 N ILE B 16 -19.352 3.841 7.788 1.00 0.95 N ATOM 820 CA ILE B 16 -17.908 3.876 7.604 1.00 0.87 C ATOM 821 C ILE B 16 -17.578 4.242 6.161 1.00 0.83 C ATOM 822 O ILE B 16 -17.839 3.464 5.241 1.00 0.84 O ATOM 823 CB ILE B 16 -17.260 2.516 7.949 1.00 0.85 C ATOM 824 CG1 ILE B 16 -17.622 2.095 9.376 1.00 0.94 C ATOM 825 CG2 ILE B 16 -15.745 2.585 7.787 1.00 0.77 C ATOM 826 CD1 ILE B 16 -18.358 0.773 9.449 1.00 1.06 C ATOM 0 H ILE B 16 -19.810 3.045 7.344 1.00 0.95 H new ATOM 0 HA ILE B 16 -17.504 4.629 8.281 1.00 0.87 H new ATOM 0 HB ILE B 16 -17.648 1.769 7.257 1.00 0.85 H new ATOM 0 HG12 ILE B 16 -16.710 2.027 9.968 1.00 0.94 H new ATOM 0 HG13 ILE B 16 -18.239 2.871 9.829 1.00 0.94 H new ATOM 0 HG21 ILE B 16 -15.308 1.618 8.035 1.00 0.77 H new ATOM 0 HG22 ILE B 16 -15.501 2.840 6.756 1.00 0.77 H new ATOM 0 HG23 ILE B 16 -15.342 3.347 8.455 1.00 0.77 H new ATOM 0 HD11 ILE B 16 -18.582 0.538 10.490 1.00 1.06 H new ATOM 0 HD12 ILE B 16 -19.288 0.843 8.884 1.00 1.06 H new ATOM 0 HD13 ILE B 16 -17.734 -0.014 9.026 1.00 1.06 H new ATOM 838 N ALA B 17 -17.024 5.432 5.972 1.00 0.84 N ATOM 839 CA ALA B 17 -16.669 5.910 4.644 1.00 0.83 C ATOM 840 C ALA B 17 -15.392 5.250 4.146 1.00 0.75 C ATOM 841 O ALA B 17 -14.492 4.940 4.927 1.00 0.76 O ATOM 842 CB ALA B 17 -16.513 7.422 4.653 1.00 0.89 C ATOM 0 H ALA B 17 -16.810 6.086 6.725 1.00 0.84 H new ATOM 0 HA ALA B 17 -17.475 5.642 3.961 1.00 0.83 H new ATOM 0 HB1 ALA B 17 -16.247 7.766 3.654 1.00 0.89 H new ATOM 0 HB2 ALA B 17 -17.453 7.883 4.958 1.00 0.89 H new ATOM 0 HB3 ALA B 17 -15.727 7.703 5.354 1.00 0.89 H new ATOM 848 N PHE B 18 -15.325 5.036 2.843 1.00 0.70 N ATOM 849 CA PHE B 18 -14.160 4.418 2.227 1.00 0.63 C ATOM 850 C PHE B 18 -13.391 5.445 1.405 1.00 0.64 C ATOM 851 O PHE B 18 -13.790 6.607 1.326 1.00 0.72 O ATOM 852 CB PHE B 18 -14.585 3.235 1.350 1.00 0.59 C ATOM 853 CG PHE B 18 -14.561 1.913 2.070 1.00 0.56 C ATOM 854 CD1 PHE B 18 -14.858 1.834 3.422 1.00 0.60 C ATOM 855 CD2 PHE B 18 -14.230 0.749 1.394 1.00 0.52 C ATOM 856 CE1 PHE B 18 -14.827 0.624 4.086 1.00 0.60 C ATOM 857 CE2 PHE B 18 -14.197 -0.464 2.055 1.00 0.53 C ATOM 858 CZ PHE B 18 -14.497 -0.527 3.402 1.00 0.56 C ATOM 0 H PHE B 18 -16.067 5.282 2.187 1.00 0.70 H new ATOM 0 HA PHE B 18 -13.505 4.044 3.014 1.00 0.63 H new ATOM 0 HB2 PHE B 18 -15.592 3.416 0.973 1.00 0.59 H new ATOM 0 HB3 PHE B 18 -13.925 3.180 0.484 1.00 0.59 H new ATOM 0 HD1 PHE B 18 -15.117 2.732 3.963 1.00 0.60 H new ATOM 0 HD2 PHE B 18 -13.996 0.791 0.341 1.00 0.52 H new ATOM 0 HE1 PHE B 18 -15.061 0.579 5.139 1.00 0.60 H new ATOM 0 HE2 PHE B 18 -13.936 -1.364 1.518 1.00 0.53 H new ATOM 0 HZ PHE B 18 -14.473 -1.475 3.918 1.00 0.56 H new ATOM 868 N SER B 19 -12.285 5.028 0.806 1.00 0.59 N ATOM 869 CA SER B 19 -11.480 5.936 0.002 1.00 0.60 C ATOM 870 C SER B 19 -11.166 5.343 -1.370 1.00 0.57 C ATOM 871 O SER B 19 -11.069 6.068 -2.363 1.00 0.60 O ATOM 872 CB SER B 19 -10.188 6.280 0.744 1.00 0.60 C ATOM 873 OG SER B 19 -10.473 6.840 2.016 1.00 0.68 O ATOM 0 H SER B 19 -11.927 4.075 0.860 1.00 0.59 H new ATOM 0 HA SER B 19 -12.056 6.847 -0.159 1.00 0.60 H new ATOM 0 HB2 SER B 19 -9.582 5.382 0.864 1.00 0.60 H new ATOM 0 HB3 SER B 19 -9.601 6.984 0.155 1.00 0.60 H new ATOM 0 HG SER B 19 -9.634 7.052 2.476 1.00 0.68 H new ATOM 879 N SER B 20 -11.010 4.029 -1.426 1.00 0.52 N ATOM 880 CA SER B 20 -10.711 3.358 -2.680 1.00 0.51 C ATOM 881 C SER B 20 -11.980 2.743 -3.278 1.00 0.52 C ATOM 882 O SER B 20 -12.699 1.997 -2.609 1.00 0.54 O ATOM 883 CB SER B 20 -9.643 2.283 -2.460 1.00 0.45 C ATOM 884 OG SER B 20 -8.635 2.743 -1.570 1.00 0.44 O ATOM 0 H SER B 20 -11.085 3.409 -0.620 1.00 0.52 H new ATOM 0 HA SER B 20 -10.325 4.093 -3.386 1.00 0.51 H new ATOM 0 HB2 SER B 20 -10.106 1.382 -2.057 1.00 0.45 H new ATOM 0 HB3 SER B 20 -9.194 2.011 -3.415 1.00 0.45 H new ATOM 0 HG SER B 20 -8.897 2.542 -0.647 1.00 0.44 H new ATOM 890 N PRO B 21 -12.287 3.063 -4.549 1.00 0.54 N ATOM 891 CA PRO B 21 -13.477 2.536 -5.231 1.00 0.56 C ATOM 892 C PRO B 21 -13.433 1.017 -5.375 1.00 0.52 C ATOM 893 O PRO B 21 -14.468 0.352 -5.402 1.00 0.54 O ATOM 894 CB PRO B 21 -13.435 3.198 -6.612 1.00 0.62 C ATOM 895 CG PRO B 21 -12.518 4.364 -6.462 1.00 0.61 C ATOM 896 CD PRO B 21 -11.516 3.972 -5.415 1.00 0.58 C ATOM 0 HA PRO B 21 -14.388 2.751 -4.672 1.00 0.56 H new ATOM 0 HB2 PRO B 21 -13.069 2.505 -7.369 1.00 0.62 H new ATOM 0 HB3 PRO B 21 -14.429 3.517 -6.926 1.00 0.62 H new ATOM 0 HG2 PRO B 21 -12.025 4.596 -7.406 1.00 0.61 H new ATOM 0 HG3 PRO B 21 -13.067 5.256 -6.161 1.00 0.61 H new ATOM 0 HD2 PRO B 21 -10.649 3.476 -5.851 1.00 0.58 H new ATOM 0 HD3 PRO B 21 -11.146 4.837 -4.865 1.00 0.58 H new ATOM 904 N SER B 22 -12.220 0.484 -5.456 1.00 0.49 N ATOM 905 CA SER B 22 -12.005 -0.949 -5.600 1.00 0.47 C ATOM 906 C SER B 22 -12.473 -1.706 -4.358 1.00 0.46 C ATOM 907 O SER B 22 -13.042 -2.794 -4.460 1.00 0.48 O ATOM 908 CB SER B 22 -10.523 -1.209 -5.852 1.00 0.47 C ATOM 909 OG SER B 22 -9.938 -0.115 -6.538 1.00 0.48 O ATOM 0 H SER B 22 -11.360 1.032 -5.424 1.00 0.49 H new ATOM 0 HA SER B 22 -12.591 -1.309 -6.445 1.00 0.47 H new ATOM 0 HB2 SER B 22 -10.009 -1.369 -4.904 1.00 0.47 H new ATOM 0 HB3 SER B 22 -10.402 -2.120 -6.438 1.00 0.47 H new ATOM 0 HG SER B 22 -8.987 -0.296 -6.691 1.00 0.48 H new ATOM 915 N THR B 23 -12.243 -1.122 -3.189 1.00 0.45 N ATOM 916 CA THR B 23 -12.647 -1.743 -1.941 1.00 0.46 C ATOM 917 C THR B 23 -14.154 -1.642 -1.746 1.00 0.51 C ATOM 918 O THR B 23 -14.775 -2.503 -1.119 1.00 0.54 O ATOM 919 CB THR B 23 -11.930 -1.091 -0.748 1.00 0.44 C ATOM 920 OG1 THR B 23 -11.186 0.048 -1.194 1.00 0.56 O ATOM 921 CG2 THR B 23 -10.994 -2.076 -0.078 1.00 0.41 C ATOM 0 H THR B 23 -11.779 -0.220 -3.082 1.00 0.45 H new ATOM 0 HA THR B 23 -12.367 -2.795 -1.992 1.00 0.46 H new ATOM 0 HB THR B 23 -12.683 -0.778 -0.024 1.00 0.44 H new ATOM 0 HG1 THR B 23 -11.283 0.777 -0.546 1.00 0.56 H new ATOM 0 HG21 THR B 23 -10.498 -1.592 0.763 1.00 0.41 H new ATOM 0 HG22 THR B 23 -11.564 -2.933 0.281 1.00 0.41 H new ATOM 0 HG23 THR B 23 -10.246 -2.413 -0.796 1.00 0.41 H new ATOM 929 N LEU B 24 -14.738 -0.593 -2.310 1.00 0.53 N ATOM 930 CA LEU B 24 -16.171 -0.360 -2.199 1.00 0.59 C ATOM 931 C LEU B 24 -16.968 -1.369 -3.025 1.00 0.60 C ATOM 932 O LEU B 24 -18.117 -1.673 -2.696 1.00 0.65 O ATOM 933 CB LEU B 24 -16.513 1.065 -2.641 1.00 0.61 C ATOM 934 CG LEU B 24 -17.871 1.585 -2.163 1.00 0.66 C ATOM 935 CD1 LEU B 24 -17.839 1.860 -0.666 1.00 0.70 C ATOM 936 CD2 LEU B 24 -18.258 2.842 -2.928 1.00 0.69 C ATOM 0 H LEU B 24 -14.238 0.113 -2.851 1.00 0.53 H new ATOM 0 HA LEU B 24 -16.447 -0.488 -1.152 1.00 0.59 H new ATOM 0 HB2 LEU B 24 -15.736 1.738 -2.278 1.00 0.61 H new ATOM 0 HB3 LEU B 24 -16.488 1.107 -3.730 1.00 0.61 H new ATOM 0 HG LEU B 24 -18.622 0.819 -2.356 1.00 0.66 H new ATOM 0 HD11 LEU B 24 -18.812 2.229 -0.343 1.00 0.70 H new ATOM 0 HD12 LEU B 24 -17.604 0.939 -0.132 1.00 0.70 H new ATOM 0 HD13 LEU B 24 -17.077 2.609 -0.450 1.00 0.70 H new ATOM 0 HD21 LEU B 24 -19.226 3.199 -2.576 1.00 0.69 H new ATOM 0 HD22 LEU B 24 -17.506 3.614 -2.765 1.00 0.69 H new ATOM 0 HD23 LEU B 24 -18.320 2.616 -3.992 1.00 0.69 H new ATOM 948 N GLU B 25 -16.345 -1.896 -4.079 1.00 0.58 N ATOM 949 CA GLU B 25 -16.993 -2.867 -4.961 1.00 0.60 C ATOM 950 C GLU B 25 -17.495 -4.083 -4.182 1.00 0.60 C ATOM 951 O GLU B 25 -18.689 -4.384 -4.188 1.00 0.62 O ATOM 952 CB GLU B 25 -16.025 -3.318 -6.057 1.00 0.60 C ATOM 953 CG GLU B 25 -16.654 -4.244 -7.086 1.00 0.63 C ATOM 954 CD GLU B 25 -15.886 -5.539 -7.250 1.00 0.83 C ATOM 955 OE1 GLU B 25 -15.584 -6.189 -6.230 1.00 1.15 O ATOM 956 OE2 GLU B 25 -15.582 -5.918 -8.400 1.00 1.25 O ATOM 0 H GLU B 25 -15.387 -1.665 -4.344 1.00 0.58 H new ATOM 0 HA GLU B 25 -17.853 -2.376 -5.417 1.00 0.60 H new ATOM 0 HB2 GLU B 25 -15.631 -2.438 -6.566 1.00 0.60 H new ATOM 0 HB3 GLU B 25 -15.178 -3.825 -5.595 1.00 0.60 H new ATOM 0 HG2 GLU B 25 -17.679 -4.468 -6.789 1.00 0.63 H new ATOM 0 HG3 GLU B 25 -16.705 -3.732 -8.047 1.00 0.63 H new ATOM 963 N ALA B 26 -16.582 -4.773 -3.510 1.00 0.61 N ATOM 964 CA ALA B 26 -16.940 -5.955 -2.732 1.00 0.64 C ATOM 965 C ALA B 26 -17.617 -5.559 -1.431 1.00 0.67 C ATOM 966 O ALA B 26 -18.292 -6.368 -0.792 1.00 0.72 O ATOM 967 CB ALA B 26 -15.715 -6.806 -2.457 1.00 0.66 C ATOM 0 H ALA B 26 -15.590 -4.536 -3.487 1.00 0.61 H new ATOM 0 HA ALA B 26 -17.644 -6.546 -3.317 1.00 0.64 H new ATOM 0 HB1 ALA B 26 -16.003 -7.682 -1.876 1.00 0.66 H new ATOM 0 HB2 ALA B 26 -15.275 -7.126 -3.401 1.00 0.66 H new ATOM 0 HB3 ALA B 26 -14.985 -6.223 -1.896 1.00 0.66 H new ATOM 973 N HIS B 27 -17.421 -4.307 -1.034 1.00 0.67 N ATOM 974 CA HIS B 27 -18.033 -3.794 0.177 1.00 0.71 C ATOM 975 C HIS B 27 -19.554 -3.858 0.034 1.00 0.75 C ATOM 976 O HIS B 27 -20.259 -4.244 0.969 1.00 0.80 O ATOM 977 CB HIS B 27 -17.559 -2.351 0.449 1.00 0.71 C ATOM 978 CG HIS B 27 -18.255 -1.664 1.591 1.00 0.76 C ATOM 979 ND1 HIS B 27 -17.595 -1.149 2.698 1.00 0.78 N ATOM 980 CD2 HIS B 27 -19.565 -1.415 1.793 1.00 0.81 C ATOM 981 CE1 HIS B 27 -18.488 -0.614 3.524 1.00 0.84 C ATOM 982 NE2 HIS B 27 -19.673 -0.781 2.984 1.00 0.85 N ATOM 0 H HIS B 27 -16.843 -3.632 -1.535 1.00 0.67 H new ATOM 0 HA HIS B 27 -17.732 -4.405 1.028 1.00 0.71 H new ATOM 0 HB2 HIS B 27 -16.488 -2.367 0.651 1.00 0.71 H new ATOM 0 HB3 HIS B 27 -17.704 -1.759 -0.455 1.00 0.71 H new ATOM 0 HD1 HIS B 27 -16.587 -1.177 2.853 1.00 0.78 H new ATOM 0 HD2 HIS B 27 -20.376 -1.673 1.129 1.00 0.81 H new ATOM 0 HE1 HIS B 27 -18.278 -0.131 4.467 1.00 0.84 H new ATOM 990 N GLN B 28 -20.043 -3.498 -1.151 1.00 0.75 N ATOM 991 CA GLN B 28 -21.474 -3.505 -1.443 1.00 0.81 C ATOM 992 C GLN B 28 -21.960 -4.937 -1.690 1.00 0.81 C ATOM 993 O GLN B 28 -22.633 -5.219 -2.681 1.00 0.85 O ATOM 994 CB GLN B 28 -21.765 -2.624 -2.670 1.00 0.83 C ATOM 995 CG GLN B 28 -23.237 -2.265 -2.839 1.00 1.08 C ATOM 996 CD GLN B 28 -23.525 -1.522 -4.132 1.00 1.25 C ATOM 997 OE1 GLN B 28 -24.428 -0.687 -4.191 1.00 1.36 O ATOM 998 NE2 GLN B 28 -22.785 -1.832 -5.189 1.00 1.57 N ATOM 0 H GLN B 28 -19.461 -3.195 -1.932 1.00 0.75 H new ATOM 0 HA GLN B 28 -22.010 -3.101 -0.584 1.00 0.81 H new ATOM 0 HB2 GLN B 28 -21.184 -1.705 -2.591 1.00 0.83 H new ATOM 0 HB3 GLN B 28 -21.422 -3.142 -3.566 1.00 0.83 H new ATOM 0 HG2 GLN B 28 -23.833 -3.177 -2.811 1.00 1.08 H new ATOM 0 HG3 GLN B 28 -23.554 -1.651 -1.996 1.00 1.08 H new ATOM 0 HE21 GLN B 28 -22.044 -2.528 -5.106 1.00 1.57 H new ATOM 0 HE22 GLN B 28 -22.957 -1.374 -6.084 1.00 1.57 H new ATOM 1007 N ALA B 29 -21.614 -5.833 -0.777 1.00 0.81 N ATOM 1008 CA ALA B 29 -22.002 -7.229 -0.887 1.00 0.83 C ATOM 1009 C ALA B 29 -21.984 -7.909 0.476 1.00 0.87 C ATOM 1010 O ALA B 29 -22.969 -8.526 0.886 1.00 0.90 O ATOM 1011 CB ALA B 29 -21.085 -7.965 -1.856 1.00 0.83 C ATOM 0 H ALA B 29 -21.062 -5.615 0.052 1.00 0.81 H new ATOM 0 HA ALA B 29 -23.020 -7.265 -1.274 1.00 0.83 H new ATOM 0 HB1 ALA B 29 -21.391 -9.009 -1.925 1.00 0.83 H new ATOM 0 HB2 ALA B 29 -21.149 -7.502 -2.841 1.00 0.83 H new ATOM 0 HB3 ALA B 29 -20.057 -7.911 -1.496 1.00 0.83 H new ATOM 1017 N TYR B 30 -20.869 -7.788 1.186 1.00 0.87 N ATOM 1018 CA TYR B 30 -20.739 -8.424 2.493 1.00 0.91 C ATOM 1019 C TYR B 30 -20.671 -7.414 3.638 1.00 0.91 C ATOM 1020 O TYR B 30 -20.919 -7.772 4.788 1.00 1.01 O ATOM 1021 CB TYR B 30 -19.482 -9.301 2.542 1.00 0.94 C ATOM 1022 CG TYR B 30 -19.097 -9.932 1.219 1.00 0.92 C ATOM 1023 CD1 TYR B 30 -19.777 -11.037 0.721 1.00 0.99 C ATOM 1024 CD2 TYR B 30 -18.042 -9.422 0.473 1.00 0.93 C ATOM 1025 CE1 TYR B 30 -19.413 -11.618 -0.482 1.00 1.07 C ATOM 1026 CE2 TYR B 30 -17.675 -9.993 -0.730 1.00 1.01 C ATOM 1027 CZ TYR B 30 -18.362 -11.091 -1.203 1.00 1.07 C ATOM 1028 OH TYR B 30 -17.995 -11.666 -2.402 1.00 1.20 O ATOM 0 H TYR B 30 -20.049 -7.261 0.884 1.00 0.87 H new ATOM 0 HA TYR B 30 -21.635 -9.031 2.625 1.00 0.91 H new ATOM 0 HB2 TYR B 30 -18.647 -8.696 2.897 1.00 0.94 H new ATOM 0 HB3 TYR B 30 -19.636 -10.093 3.275 1.00 0.94 H new ATOM 0 HD1 TYR B 30 -20.603 -11.449 1.282 1.00 0.99 H new ATOM 0 HD2 TYR B 30 -17.499 -8.564 0.840 1.00 0.93 H new ATOM 0 HE1 TYR B 30 -19.949 -12.479 -0.854 1.00 1.07 H new ATOM 0 HE2 TYR B 30 -16.854 -9.581 -1.298 1.00 1.01 H new ATOM 0 HH TYR B 30 -17.199 -11.214 -2.751 1.00 1.20 H new ATOM 1038 N TYR B 31 -20.354 -6.157 3.337 1.00 0.86 N ATOM 1039 CA TYR B 31 -20.219 -5.150 4.388 1.00 0.87 C ATOM 1040 C TYR B 31 -21.560 -4.561 4.829 1.00 0.94 C ATOM 1041 O TYR B 31 -21.912 -4.668 6.006 1.00 1.03 O ATOM 1042 CB TYR B 31 -19.272 -4.044 3.951 1.00 0.81 C ATOM 1043 CG TYR B 31 -18.385 -3.544 5.067 1.00 0.77 C ATOM 1044 CD1 TYR B 31 -18.918 -2.872 6.158 1.00 0.88 C ATOM 1045 CD2 TYR B 31 -17.014 -3.746 5.027 1.00 0.71 C ATOM 1046 CE1 TYR B 31 -18.107 -2.415 7.180 1.00 0.89 C ATOM 1047 CE2 TYR B 31 -16.198 -3.292 6.043 1.00 0.68 C ATOM 1048 CZ TYR B 31 -16.746 -2.628 7.118 1.00 0.75 C ATOM 1049 OH TYR B 31 -15.930 -2.173 8.128 1.00 0.77 O ATOM 0 H TYR B 31 -20.188 -5.814 2.391 1.00 0.86 H new ATOM 0 HA TYR B 31 -19.801 -5.662 5.255 1.00 0.87 H new ATOM 0 HB2 TYR B 31 -18.648 -4.410 3.136 1.00 0.81 H new ATOM 0 HB3 TYR B 31 -19.854 -3.211 3.557 1.00 0.81 H new ATOM 0 HD1 TYR B 31 -19.984 -2.703 6.209 1.00 0.88 H new ATOM 0 HD2 TYR B 31 -16.578 -4.267 4.187 1.00 0.71 H new ATOM 0 HE1 TYR B 31 -18.537 -1.894 8.023 1.00 0.89 H new ATOM 0 HE2 TYR B 31 -15.132 -3.457 5.995 1.00 0.68 H new ATOM 0 HH TYR B 31 -14.993 -2.322 7.883 1.00 0.77 H new ATOM 1059 N CYS B 32 -22.301 -3.920 3.915 1.00 0.94 N ATOM 1060 CA CYS B 32 -23.596 -3.341 4.275 1.00 1.02 C ATOM 1061 C CYS B 32 -24.616 -4.459 4.502 1.00 1.07 C ATOM 1062 O CYS B 32 -25.461 -4.726 3.643 1.00 1.10 O ATOM 1063 CB CYS B 32 -24.109 -2.391 3.188 1.00 1.01 C ATOM 1064 SG CYS B 32 -22.821 -1.554 2.200 1.00 0.98 S ATOM 0 H CYS B 32 -22.030 -3.792 2.940 1.00 0.94 H new ATOM 0 HA CYS B 32 -23.464 -2.766 5.192 1.00 1.02 H new ATOM 0 HB2 CYS B 32 -24.752 -2.955 2.512 1.00 1.01 H new ATOM 0 HB3 CYS B 32 -24.732 -1.631 3.659 1.00 1.01 H new ATOM 0 HG CYS B 32 -21.869 -1.145 2.985 1.00 0.98 H new ATOM 1069 N SER B 33 -24.503 -5.112 5.656 1.00 1.09 N ATOM 1070 CA SER B 33 -25.361 -6.228 6.032 1.00 1.16 C ATOM 1071 C SER B 33 -25.102 -7.414 5.099 1.00 1.09 C ATOM 1072 O SER B 33 -24.242 -8.248 5.378 1.00 1.07 O ATOM 1073 CB SER B 33 -26.837 -5.819 6.029 1.00 1.27 C ATOM 1074 OG SER B 33 -27.049 -4.674 6.842 1.00 1.43 O ATOM 0 H SER B 33 -23.805 -4.877 6.362 1.00 1.09 H new ATOM 0 HA SER B 33 -25.120 -6.531 7.051 1.00 1.16 H new ATOM 0 HB2 SER B 33 -27.158 -5.610 5.009 1.00 1.27 H new ATOM 0 HB3 SER B 33 -27.448 -6.645 6.392 1.00 1.27 H new ATOM 0 HG SER B 33 -27.998 -4.431 6.823 1.00 1.43 H new ATOM 1080 N HIS B 34 -25.817 -7.475 3.982 1.00 1.10 N ATOM 1081 CA HIS B 34 -25.643 -8.546 3.014 1.00 1.07 C ATOM 1082 C HIS B 34 -26.326 -8.177 1.709 1.00 1.06 C ATOM 1083 O HIS B 34 -27.469 -8.557 1.462 1.00 1.14 O ATOM 1084 CB HIS B 34 -26.197 -9.871 3.543 1.00 1.14 C ATOM 1085 CG HIS B 34 -25.133 -10.836 3.975 1.00 1.09 C ATOM 1086 ND1 HIS B 34 -25.275 -11.688 5.049 1.00 1.18 N ATOM 1087 CD2 HIS B 34 -23.901 -11.072 3.471 1.00 1.04 C ATOM 1088 CE1 HIS B 34 -24.175 -12.405 5.185 1.00 1.14 C ATOM 1089 NE2 HIS B 34 -23.326 -12.050 4.241 1.00 1.06 N ATOM 0 H HIS B 34 -26.527 -6.789 3.725 1.00 1.10 H new ATOM 0 HA HIS B 34 -24.575 -8.677 2.840 1.00 1.07 H new ATOM 0 HB2 HIS B 34 -26.857 -9.669 4.387 1.00 1.14 H new ATOM 0 HB3 HIS B 34 -26.805 -10.337 2.767 1.00 1.14 H new ATOM 0 HD2 HIS B 34 -23.453 -10.581 2.620 1.00 1.04 H new ATOM 0 HE1 HIS B 34 -24.000 -13.156 5.942 1.00 1.14 H new ATOM 0 HE2 HIS B 34 -22.393 -12.440 4.105 1.00 1.06 H new ATOM 1098 N ARG B 35 -25.617 -7.419 0.886 1.00 0.99 N ATOM 1099 CA ARG B 35 -26.137 -6.977 -0.400 1.00 0.99 C ATOM 1100 C ARG B 35 -25.916 -8.059 -1.451 1.00 1.01 C ATOM 1101 O ARG B 35 -25.196 -7.858 -2.426 1.00 1.03 O ATOM 1102 CB ARG B 35 -25.451 -5.678 -0.839 1.00 0.94 C ATOM 1103 CG ARG B 35 -25.232 -4.678 0.285 1.00 0.94 C ATOM 1104 CD ARG B 35 -26.447 -3.790 0.496 1.00 1.04 C ATOM 1105 NE ARG B 35 -26.623 -2.827 -0.591 1.00 1.05 N ATOM 1106 CZ ARG B 35 -26.110 -1.595 -0.595 1.00 1.06 C ATOM 1107 NH1 ARG B 35 -25.312 -1.192 0.390 1.00 1.04 N ATOM 1108 NH2 ARG B 35 -26.374 -0.776 -1.602 1.00 1.11 N ATOM 0 H ARG B 35 -24.671 -7.095 1.088 1.00 0.99 H new ATOM 0 HA ARG B 35 -27.206 -6.790 -0.296 1.00 0.99 H new ATOM 0 HB2 ARG B 35 -24.487 -5.922 -1.286 1.00 0.94 H new ATOM 0 HB3 ARG B 35 -26.053 -5.207 -1.617 1.00 0.94 H new ATOM 0 HG2 ARG B 35 -25.008 -5.212 1.208 1.00 0.94 H new ATOM 0 HG3 ARG B 35 -24.365 -4.059 0.056 1.00 0.94 H new ATOM 0 HD2 ARG B 35 -27.339 -4.411 0.577 1.00 1.04 H new ATOM 0 HD3 ARG B 35 -26.344 -3.255 1.440 1.00 1.04 H new ATOM 0 HE ARG B 35 -27.174 -3.116 -1.399 1.00 1.05 H new ATOM 0 HH11 ARG B 35 -25.088 -1.826 1.157 1.00 1.04 H new ATOM 0 HH12 ARG B 35 -24.924 -0.249 0.379 1.00 1.04 H new ATOM 0 HH21 ARG B 35 -26.968 -1.088 -2.371 1.00 1.11 H new ATOM 0 HH22 ARG B 35 -25.984 0.166 -1.609 1.00 1.11 H new ATOM 1122 N ILE B 36 -26.526 -9.209 -1.230 1.00 1.07 N ATOM 1123 CA ILE B 36 -26.400 -10.333 -2.142 1.00 1.12 C ATOM 1124 C ILE B 36 -27.749 -10.675 -2.752 1.00 1.32 C ATOM 1125 O ILE B 36 -27.804 -10.947 -3.970 1.00 1.45 O ATOM 1126 CB ILE B 36 -25.816 -11.579 -1.437 1.00 1.06 C ATOM 1127 CG1 ILE B 36 -26.450 -11.764 -0.054 1.00 1.12 C ATOM 1128 CG2 ILE B 36 -24.304 -11.465 -1.324 1.00 1.04 C ATOM 1129 CD1 ILE B 36 -26.005 -13.025 0.655 1.00 1.18 C ATOM 1130 OXT ILE B 36 -28.757 -10.645 -2.017 1.00 1.45 O ATOM 0 H ILE B 36 -27.119 -9.391 -0.420 1.00 1.07 H new ATOM 0 HA ILE B 36 -25.710 -10.035 -2.931 1.00 1.12 H new ATOM 0 HB ILE B 36 -26.051 -12.457 -2.039 1.00 1.06 H new ATOM 0 HG12 ILE B 36 -26.204 -10.903 0.567 1.00 1.12 H new ATOM 0 HG13 ILE B 36 -27.535 -11.781 -0.161 1.00 1.12 H new ATOM 0 HG21 ILE B 36 -23.909 -12.350 -0.825 1.00 1.04 H new ATOM 0 HG22 ILE B 36 -23.870 -11.385 -2.321 1.00 1.04 H new ATOM 0 HG23 ILE B 36 -24.048 -10.578 -0.745 1.00 1.04 H new ATOM 0 HD11 ILE B 36 -26.495 -13.088 1.627 1.00 1.18 H new ATOM 0 HD12 ILE B 36 -26.275 -13.894 0.055 1.00 1.18 H new ATOM 0 HD13 ILE B 36 -24.924 -13.002 0.794 1.00 1.18 H new ATOM 1272 N ASP C 91 21.639 -3.295 -5.395 1.00 1.08 N ATOM 1273 CA ASP C 91 22.605 -2.204 -5.534 1.00 1.09 C ATOM 1274 C ASP C 91 23.866 -2.466 -4.715 1.00 1.14 C ATOM 1275 O ASP C 91 24.978 -2.400 -5.237 1.00 1.53 O ATOM 1276 CB ASP C 91 21.991 -0.873 -5.110 1.00 1.03 C ATOM 1277 CG ASP C 91 22.961 0.276 -5.292 1.00 1.19 C ATOM 1278 OD1 ASP C 91 23.285 0.603 -6.450 1.00 1.54 O ATOM 1279 OD2 ASP C 91 23.418 0.842 -4.280 1.00 1.34 O ATOM 0 HA ASP C 91 22.879 -2.152 -6.588 1.00 1.09 H new ATOM 0 HB2 ASP C 91 21.091 -0.685 -5.695 1.00 1.03 H new ATOM 0 HB3 ASP C 91 21.686 -0.930 -4.065 1.00 1.03 H new ATOM 1284 N GLY C 92 23.692 -2.755 -3.432 1.00 0.94 N ATOM 1285 CA GLY C 92 24.832 -3.028 -2.580 1.00 1.00 C ATOM 1286 C GLY C 92 24.599 -2.608 -1.144 1.00 0.95 C ATOM 1287 O GLY C 92 24.413 -3.453 -0.269 1.00 1.04 O ATOM 0 H GLY C 92 22.785 -2.805 -2.968 1.00 0.94 H new ATOM 0 HA2 GLY C 92 25.057 -4.094 -2.611 1.00 1.00 H new ATOM 0 HA3 GLY C 92 25.706 -2.506 -2.970 1.00 1.00 H new ATOM 1291 N LEU C 93 24.601 -1.308 -0.902 1.00 0.88 N ATOM 1292 CA LEU C 93 24.390 -0.777 0.438 1.00 0.88 C ATOM 1293 C LEU C 93 23.013 -0.135 0.545 1.00 0.83 C ATOM 1294 O LEU C 93 22.422 0.244 -0.466 1.00 0.84 O ATOM 1295 CB LEU C 93 25.478 0.245 0.774 1.00 0.98 C ATOM 1296 CG LEU C 93 26.903 -0.314 0.775 1.00 1.17 C ATOM 1297 CD1 LEU C 93 27.916 0.810 0.639 1.00 1.58 C ATOM 1298 CD2 LEU C 93 27.165 -1.119 2.040 1.00 1.17 C ATOM 0 H LEU C 93 24.747 -0.596 -1.618 1.00 0.88 H new ATOM 0 HA LEU C 93 24.445 -1.599 1.152 1.00 0.88 H new ATOM 0 HB2 LEU C 93 25.424 1.063 0.055 1.00 0.98 H new ATOM 0 HB3 LEU C 93 25.268 0.669 1.756 1.00 0.98 H new ATOM 0 HG LEU C 93 27.009 -0.980 -0.081 1.00 1.17 H new ATOM 0 HD11 LEU C 93 28.924 0.394 0.642 1.00 1.58 H new ATOM 0 HD12 LEU C 93 27.746 1.342 -0.297 1.00 1.58 H new ATOM 0 HD13 LEU C 93 27.807 1.501 1.475 1.00 1.58 H new ATOM 0 HD21 LEU C 93 28.183 -1.507 2.020 1.00 1.17 H new ATOM 0 HD22 LEU C 93 27.038 -0.478 2.912 1.00 1.17 H new ATOM 0 HD23 LEU C 93 26.461 -1.950 2.095 1.00 1.17 H new ATOM 1310 N CYS C 94 22.507 -0.031 1.769 1.00 0.81 N ATOM 1311 CA CYS C 94 21.197 0.556 2.024 1.00 0.77 C ATOM 1312 C CYS C 94 21.257 2.079 1.914 1.00 0.84 C ATOM 1313 O CYS C 94 22.303 2.666 1.616 1.00 1.04 O ATOM 1314 CB CYS C 94 20.737 0.141 3.427 1.00 0.75 C ATOM 1315 SG CYS C 94 19.019 0.570 3.893 1.00 0.70 S ATOM 0 H CYS C 94 22.991 -0.350 2.609 1.00 0.81 H new ATOM 0 HA CYS C 94 20.487 0.196 1.280 1.00 0.77 H new ATOM 0 HB2 CYS C 94 20.854 -0.939 3.517 1.00 0.75 H new ATOM 0 HB3 CYS C 94 21.410 0.596 4.154 1.00 0.75 H new ATOM 0 HG CYS C 94 18.415 -0.488 4.346 1.00 0.70 H new ATOM 1320 N ALA C 95 20.126 2.710 2.154 1.00 0.79 N ATOM 1321 CA ALA C 95 20.034 4.156 2.099 1.00 0.88 C ATOM 1322 C ALA C 95 19.639 4.713 3.457 1.00 0.82 C ATOM 1323 O ALA C 95 19.897 5.879 3.763 1.00 0.92 O ATOM 1324 CB ALA C 95 19.046 4.588 1.032 1.00 1.00 C ATOM 0 H ALA C 95 19.252 2.241 2.391 1.00 0.79 H new ATOM 0 HA ALA C 95 21.013 4.556 1.836 1.00 0.88 H new ATOM 0 HB1 ALA C 95 18.991 5.676 1.006 1.00 1.00 H new ATOM 0 HB2 ALA C 95 19.375 4.218 0.061 1.00 1.00 H new ATOM 0 HB3 ALA C 95 18.061 4.180 1.261 1.00 1.00 H new ATOM 1330 N SER C 96 19.012 3.877 4.273 1.00 0.72 N ATOM 1331 CA SER C 96 18.590 4.285 5.604 1.00 0.70 C ATOM 1332 C SER C 96 19.591 3.785 6.641 1.00 0.69 C ATOM 1333 O SER C 96 19.961 4.506 7.570 1.00 0.74 O ATOM 1334 CB SER C 96 17.192 3.749 5.904 1.00 0.70 C ATOM 1335 OG SER C 96 16.317 3.983 4.814 1.00 0.77 O ATOM 0 H SER C 96 18.785 2.911 4.036 1.00 0.72 H new ATOM 0 HA SER C 96 18.555 5.374 5.648 1.00 0.70 H new ATOM 0 HB2 SER C 96 17.244 2.680 6.111 1.00 0.70 H new ATOM 0 HB3 SER C 96 16.799 4.228 6.801 1.00 0.70 H new ATOM 0 HG SER C 96 15.428 3.630 5.027 1.00 0.77 H new ATOM 1341 N CYS C 97 20.043 2.551 6.466 1.00 0.69 N ATOM 1342 CA CYS C 97 21.007 1.971 7.373 1.00 0.69 C ATOM 1343 C CYS C 97 22.317 1.749 6.630 1.00 0.73 C ATOM 1344 O CYS C 97 22.346 1.750 5.403 1.00 0.90 O ATOM 1345 CB CYS C 97 20.458 0.678 8.004 1.00 0.67 C ATOM 1346 SG CYS C 97 20.505 -0.815 6.956 1.00 0.69 S ATOM 0 H CYS C 97 19.754 1.938 5.704 1.00 0.69 H new ATOM 0 HA CYS C 97 21.198 2.655 8.200 1.00 0.69 H new ATOM 0 HB2 CYS C 97 21.022 0.475 8.914 1.00 0.67 H new ATOM 0 HB3 CYS C 97 19.425 0.855 8.302 1.00 0.67 H new ATOM 0 HG CYS C 97 19.931 -0.564 5.817 1.00 0.69 H new ATOM 1351 N ASP C 98 23.408 1.608 7.356 1.00 0.79 N ATOM 1352 CA ASP C 98 24.703 1.412 6.719 1.00 0.82 C ATOM 1353 C ASP C 98 25.093 -0.052 6.752 1.00 0.83 C ATOM 1354 O ASP C 98 26.167 -0.414 7.231 1.00 0.97 O ATOM 1355 CB ASP C 98 25.781 2.271 7.387 1.00 0.86 C ATOM 1356 CG ASP C 98 26.019 3.571 6.645 1.00 0.96 C ATOM 1357 OD1 ASP C 98 25.186 4.498 6.768 1.00 1.41 O ATOM 1358 OD2 ASP C 98 27.036 3.674 5.930 1.00 1.32 O ATOM 0 H ASP C 98 23.429 1.624 8.376 1.00 0.79 H new ATOM 0 HA ASP C 98 24.619 1.727 5.679 1.00 0.82 H new ATOM 0 HB2 ASP C 98 25.485 2.489 8.413 1.00 0.86 H new ATOM 0 HB3 ASP C 98 26.713 1.708 7.437 1.00 0.86 H new ATOM 1363 N LYS C 99 24.203 -0.892 6.250 1.00 0.83 N ATOM 1364 CA LYS C 99 24.430 -2.326 6.215 1.00 0.85 C ATOM 1365 C LYS C 99 24.445 -2.836 4.783 1.00 0.86 C ATOM 1366 O LYS C 99 23.845 -2.236 3.891 1.00 0.92 O ATOM 1367 CB LYS C 99 23.345 -3.055 7.012 1.00 0.82 C ATOM 1368 CG LYS C 99 23.328 -2.691 8.489 1.00 0.90 C ATOM 1369 CD LYS C 99 24.558 -3.215 9.215 1.00 1.00 C ATOM 1370 CE LYS C 99 24.440 -3.033 10.719 1.00 1.21 C ATOM 1371 NZ LYS C 99 25.677 -3.451 11.428 1.00 1.44 N ATOM 0 H LYS C 99 23.308 -0.601 5.857 1.00 0.83 H new ATOM 0 HA LYS C 99 25.402 -2.526 6.667 1.00 0.85 H new ATOM 0 HB2 LYS C 99 22.371 -2.826 6.578 1.00 0.82 H new ATOM 0 HB3 LYS C 99 23.493 -4.130 6.913 1.00 0.82 H new ATOM 0 HG2 LYS C 99 23.277 -1.607 8.596 1.00 0.90 H new ATOM 0 HG3 LYS C 99 22.430 -3.099 8.954 1.00 0.90 H new ATOM 0 HD2 LYS C 99 24.694 -4.272 8.985 1.00 1.00 H new ATOM 0 HD3 LYS C 99 25.444 -2.694 8.853 1.00 1.00 H new ATOM 0 HE2 LYS C 99 24.230 -1.987 10.942 1.00 1.21 H new ATOM 0 HE3 LYS C 99 23.596 -3.614 11.090 1.00 1.21 H new ATOM 0 HZ1 LYS C 99 25.555 -3.311 12.451 1.00 1.44 H new ATOM 0 HZ2 LYS C 99 25.864 -4.456 11.236 1.00 1.44 H new ATOM 0 HZ3 LYS C 99 26.479 -2.879 11.094 1.00 1.44 H new ATOM 1385 N ARG C 100 25.136 -3.944 4.574 1.00 0.84 N ATOM 1386 CA ARG C 100 25.233 -4.553 3.258 1.00 0.88 C ATOM 1387 C ARG C 100 23.955 -5.320 2.946 1.00 0.85 C ATOM 1388 O ARG C 100 23.475 -6.106 3.768 1.00 0.85 O ATOM 1389 CB ARG C 100 26.443 -5.488 3.192 1.00 0.94 C ATOM 1390 CG ARG C 100 27.769 -4.779 3.420 1.00 1.08 C ATOM 1391 CD ARG C 100 28.910 -5.768 3.603 1.00 1.14 C ATOM 1392 NE ARG C 100 28.721 -6.618 4.783 1.00 1.20 N ATOM 1393 CZ ARG C 100 29.619 -6.757 5.759 1.00 1.28 C ATOM 1394 NH1 ARG C 100 30.779 -6.120 5.698 1.00 1.42 N ATOM 1395 NH2 ARG C 100 29.357 -7.543 6.796 1.00 1.48 N ATOM 0 H ARG C 100 25.642 -4.444 5.305 1.00 0.84 H new ATOM 0 HA ARG C 100 25.364 -3.767 2.515 1.00 0.88 H new ATOM 0 HB2 ARG C 100 26.327 -6.273 3.939 1.00 0.94 H new ATOM 0 HB3 ARG C 100 26.463 -5.975 2.217 1.00 0.94 H new ATOM 0 HG2 ARG C 100 27.984 -4.128 2.573 1.00 1.08 H new ATOM 0 HG3 ARG C 100 27.694 -4.142 4.301 1.00 1.08 H new ATOM 0 HD2 ARG C 100 28.992 -6.395 2.715 1.00 1.14 H new ATOM 0 HD3 ARG C 100 29.850 -5.223 3.696 1.00 1.14 H new ATOM 0 HE ARG C 100 27.846 -7.136 4.862 1.00 1.20 H new ATOM 0 HH11 ARG C 100 30.990 -5.519 4.901 1.00 1.42 H new ATOM 0 HH12 ARG C 100 31.462 -6.231 6.448 1.00 1.42 H new ATOM 0 HH21 ARG C 100 28.468 -8.041 6.847 1.00 1.48 H new ATOM 0 HH22 ARG C 100 30.044 -7.649 7.542 1.00 1.48 H new ATOM 1409 N ILE C 101 23.404 -5.086 1.767 1.00 0.88 N ATOM 1410 CA ILE C 101 22.175 -5.741 1.355 1.00 0.86 C ATOM 1411 C ILE C 101 22.448 -7.157 0.862 1.00 0.90 C ATOM 1412 O ILE C 101 23.320 -7.384 0.016 1.00 0.95 O ATOM 1413 CB ILE C 101 21.466 -4.932 0.250 1.00 0.87 C ATOM 1414 CG1 ILE C 101 21.194 -3.508 0.744 1.00 0.83 C ATOM 1415 CG2 ILE C 101 20.170 -5.608 -0.174 1.00 0.90 C ATOM 1416 CD1 ILE C 101 20.599 -2.599 -0.309 1.00 0.84 C ATOM 0 H ILE C 101 23.791 -4.444 1.075 1.00 0.88 H new ATOM 0 HA ILE C 101 21.523 -5.795 2.227 1.00 0.86 H new ATOM 0 HB ILE C 101 22.119 -4.887 -0.622 1.00 0.87 H new ATOM 0 HG12 ILE C 101 20.517 -3.553 1.597 1.00 0.83 H new ATOM 0 HG13 ILE C 101 22.127 -3.073 1.101 1.00 0.83 H new ATOM 0 HG21 ILE C 101 19.690 -5.017 -0.954 1.00 0.90 H new ATOM 0 HG22 ILE C 101 20.388 -6.605 -0.556 1.00 0.90 H new ATOM 0 HG23 ILE C 101 19.503 -5.686 0.684 1.00 0.90 H new ATOM 0 HD11 ILE C 101 20.435 -1.609 0.116 1.00 0.84 H new ATOM 0 HD12 ILE C 101 21.284 -2.523 -1.153 1.00 0.84 H new ATOM 0 HD13 ILE C 101 19.649 -3.010 -0.649 1.00 0.84 H new ATOM 1428 N ARG C 102 21.712 -8.107 1.410 1.00 0.89 N ATOM 1429 CA ARG C 102 21.849 -9.503 1.036 1.00 0.92 C ATOM 1430 C ARG C 102 20.528 -10.014 0.481 1.00 0.91 C ATOM 1431 O ARG C 102 19.606 -9.229 0.263 1.00 0.90 O ATOM 1432 CB ARG C 102 22.291 -10.336 2.246 1.00 0.95 C ATOM 1433 CG ARG C 102 23.659 -9.946 2.791 1.00 1.01 C ATOM 1434 CD ARG C 102 24.784 -10.456 1.899 1.00 1.09 C ATOM 1435 NE ARG C 102 24.869 -9.735 0.623 1.00 1.15 N ATOM 1436 CZ ARG C 102 25.545 -10.179 -0.439 1.00 1.37 C ATOM 1437 NH1 ARG C 102 26.224 -11.321 -0.369 1.00 1.55 N ATOM 1438 NH2 ARG C 102 25.550 -9.471 -1.568 1.00 1.48 N ATOM 0 H ARG C 102 21.005 -7.934 2.124 1.00 0.89 H new ATOM 0 HA ARG C 102 22.613 -9.597 0.264 1.00 0.92 H new ATOM 0 HB2 ARG C 102 21.550 -10.230 3.039 1.00 0.95 H new ATOM 0 HB3 ARG C 102 22.309 -11.389 1.964 1.00 0.95 H new ATOM 0 HG2 ARG C 102 23.723 -8.861 2.873 1.00 1.01 H new ATOM 0 HG3 ARG C 102 23.779 -10.350 3.796 1.00 1.01 H new ATOM 0 HD2 ARG C 102 25.732 -10.362 2.428 1.00 1.09 H new ATOM 0 HD3 ARG C 102 24.633 -11.517 1.702 1.00 1.09 H new ATOM 0 HE ARG C 102 24.383 -8.842 0.543 1.00 1.15 H new ATOM 0 HH11 ARG C 102 26.229 -11.859 0.497 1.00 1.55 H new ATOM 0 HH12 ARG C 102 26.740 -11.658 -1.182 1.00 1.55 H new ATOM 0 HH21 ARG C 102 25.038 -8.591 -1.620 1.00 1.48 H new ATOM 0 HH22 ARG C 102 26.066 -9.809 -2.380 1.00 1.48 H new ATOM 1452 N ALA C 103 20.426 -11.322 0.278 1.00 0.94 N ATOM 1453 CA ALA C 103 19.207 -11.918 -0.262 1.00 0.96 C ATOM 1454 C ALA C 103 18.149 -12.086 0.827 1.00 0.94 C ATOM 1455 O ALA C 103 17.782 -13.206 1.193 1.00 1.30 O ATOM 1456 CB ALA C 103 19.514 -13.255 -0.928 1.00 1.06 C ATOM 0 H ALA C 103 21.170 -11.990 0.478 1.00 0.94 H new ATOM 0 HA ALA C 103 18.806 -11.242 -1.017 1.00 0.96 H new ATOM 0 HB1 ALA C 103 18.594 -13.684 -1.324 1.00 1.06 H new ATOM 0 HB2 ALA C 103 20.223 -13.102 -1.742 1.00 1.06 H new ATOM 0 HB3 ALA C 103 19.945 -13.936 -0.195 1.00 1.06 H new ATOM 1462 N TYR C 104 17.673 -10.958 1.342 1.00 0.87 N ATOM 1463 CA TYR C 104 16.658 -10.934 2.389 1.00 0.81 C ATOM 1464 C TYR C 104 16.235 -9.493 2.661 1.00 0.74 C ATOM 1465 O TYR C 104 16.320 -9.000 3.784 1.00 0.82 O ATOM 1466 CB TYR C 104 17.184 -11.585 3.678 1.00 0.86 C ATOM 1467 CG TYR C 104 16.120 -11.802 4.737 1.00 0.89 C ATOM 1468 CD1 TYR C 104 14.990 -12.564 4.471 1.00 0.98 C ATOM 1469 CD2 TYR C 104 16.247 -11.235 5.999 1.00 0.90 C ATOM 1470 CE1 TYR C 104 14.017 -12.756 5.434 1.00 1.08 C ATOM 1471 CE2 TYR C 104 15.278 -11.422 6.966 1.00 1.00 C ATOM 1472 CZ TYR C 104 14.165 -12.182 6.679 1.00 1.08 C ATOM 1473 OH TYR C 104 13.195 -12.370 7.638 1.00 1.23 O ATOM 0 H TYR C 104 17.981 -10.032 1.045 1.00 0.87 H new ATOM 0 HA TYR C 104 15.794 -11.506 2.050 1.00 0.81 H new ATOM 0 HB2 TYR C 104 17.636 -12.545 3.430 1.00 0.86 H new ATOM 0 HB3 TYR C 104 17.973 -10.959 4.093 1.00 0.86 H new ATOM 0 HD1 TYR C 104 14.869 -13.014 3.497 1.00 0.98 H new ATOM 0 HD2 TYR C 104 17.118 -10.638 6.228 1.00 0.90 H new ATOM 0 HE1 TYR C 104 13.145 -13.353 5.212 1.00 1.08 H new ATOM 0 HE2 TYR C 104 15.392 -10.975 7.942 1.00 1.00 H new ATOM 0 HH TYR C 104 13.451 -11.900 8.459 1.00 1.23 H new ATOM 1483 N GLU C 105 15.815 -8.806 1.616 1.00 0.87 N ATOM 1484 CA GLU C 105 15.374 -7.427 1.742 1.00 0.84 C ATOM 1485 C GLU C 105 13.901 -7.307 1.378 1.00 0.74 C ATOM 1486 O GLU C 105 13.133 -6.663 2.095 1.00 0.74 O ATOM 1487 CB GLU C 105 16.221 -6.491 0.863 1.00 0.96 C ATOM 1488 CG GLU C 105 17.012 -7.198 -0.231 1.00 1.04 C ATOM 1489 CD GLU C 105 16.126 -7.828 -1.283 1.00 1.16 C ATOM 1490 OE1 GLU C 105 15.670 -8.973 -1.066 1.00 1.55 O ATOM 1491 OE2 GLU C 105 15.865 -7.172 -2.307 1.00 1.43 O ATOM 0 H GLU C 105 15.769 -9.180 0.668 1.00 0.87 H new ATOM 0 HA GLU C 105 15.506 -7.124 2.781 1.00 0.84 H new ATOM 0 HB2 GLU C 105 15.564 -5.754 0.401 1.00 0.96 H new ATOM 0 HB3 GLU C 105 16.915 -5.944 1.501 1.00 0.96 H new ATOM 0 HG2 GLU C 105 17.682 -6.483 -0.708 1.00 1.04 H new ATOM 0 HG3 GLU C 105 17.637 -7.969 0.220 1.00 1.04 H new ATOM 1498 N MET C 106 13.522 -7.942 0.265 1.00 0.74 N ATOM 1499 CA MET C 106 12.144 -7.930 -0.225 1.00 0.75 C ATOM 1500 C MET C 106 11.641 -6.500 -0.402 1.00 0.66 C ATOM 1501 O MET C 106 10.494 -6.184 -0.081 1.00 0.73 O ATOM 1502 CB MET C 106 11.223 -8.709 0.724 1.00 0.84 C ATOM 1503 CG MET C 106 11.542 -10.194 0.800 1.00 0.94 C ATOM 1504 SD MET C 106 10.282 -11.134 1.688 1.00 1.07 S ATOM 1505 CE MET C 106 10.975 -12.784 1.609 1.00 1.19 C ATOM 0 H MET C 106 14.163 -8.478 -0.320 1.00 0.74 H new ATOM 0 HA MET C 106 12.129 -8.420 -1.199 1.00 0.75 H new ATOM 0 HB2 MET C 106 11.297 -8.279 1.723 1.00 0.84 H new ATOM 0 HB3 MET C 106 10.190 -8.584 0.398 1.00 0.84 H new ATOM 0 HG2 MET C 106 11.642 -10.592 -0.210 1.00 0.94 H new ATOM 0 HG3 MET C 106 12.505 -10.330 1.293 1.00 0.94 H new ATOM 0 HE1 MET C 106 10.310 -13.483 2.116 1.00 1.19 H new ATOM 0 HE2 MET C 106 11.088 -13.082 0.567 1.00 1.19 H new ATOM 0 HE3 MET C 106 11.950 -12.793 2.096 1.00 1.19 H new ATOM 1515 N THR C 107 12.506 -5.645 -0.931 1.00 0.59 N ATOM 1516 CA THR C 107 12.163 -4.250 -1.149 1.00 0.52 C ATOM 1517 C THR C 107 11.523 -4.060 -2.521 1.00 0.54 C ATOM 1518 O THR C 107 11.832 -4.782 -3.475 1.00 0.68 O ATOM 1519 CB THR C 107 13.405 -3.330 -1.010 1.00 0.55 C ATOM 1520 OG1 THR C 107 13.046 -1.959 -1.243 1.00 0.56 O ATOM 1521 CG2 THR C 107 14.503 -3.739 -1.980 1.00 0.70 C ATOM 0 H THR C 107 13.452 -5.896 -1.217 1.00 0.59 H new ATOM 0 HA THR C 107 11.444 -3.967 -0.380 1.00 0.52 H new ATOM 0 HB THR C 107 13.781 -3.436 0.008 1.00 0.55 H new ATOM 0 HG1 THR C 107 13.813 -1.479 -1.619 1.00 0.56 H new ATOM 0 HG21 THR C 107 15.360 -3.077 -1.860 1.00 0.70 H new ATOM 0 HG22 THR C 107 14.806 -4.766 -1.775 1.00 0.70 H new ATOM 0 HG23 THR C 107 14.131 -3.668 -3.002 1.00 0.70 H new ATOM 1529 N MET C 108 10.618 -3.098 -2.614 1.00 0.52 N ATOM 1530 CA MET C 108 9.938 -2.807 -3.865 1.00 0.55 C ATOM 1531 C MET C 108 10.850 -2.007 -4.783 1.00 0.58 C ATOM 1532 O MET C 108 11.831 -1.410 -4.329 1.00 0.63 O ATOM 1533 CB MET C 108 8.633 -2.049 -3.604 1.00 0.55 C ATOM 1534 CG MET C 108 7.415 -2.952 -3.452 1.00 0.64 C ATOM 1535 SD MET C 108 7.552 -4.095 -2.060 1.00 1.11 S ATOM 1536 CE MET C 108 7.475 -2.960 -0.673 1.00 1.04 C ATOM 0 H MET C 108 10.337 -2.504 -1.834 1.00 0.52 H new ATOM 0 HA MET C 108 9.691 -3.748 -4.356 1.00 0.55 H new ATOM 0 HB2 MET C 108 8.746 -1.452 -2.699 1.00 0.55 H new ATOM 0 HB3 MET C 108 8.458 -1.354 -4.425 1.00 0.55 H new ATOM 0 HG2 MET C 108 6.526 -2.335 -3.322 1.00 0.64 H new ATOM 0 HG3 MET C 108 7.275 -3.522 -4.371 1.00 0.64 H new ATOM 0 HE1 MET C 108 7.297 -3.519 0.245 1.00 1.04 H new ATOM 0 HE2 MET C 108 8.418 -2.420 -0.592 1.00 1.04 H new ATOM 0 HE3 MET C 108 6.662 -2.250 -0.828 1.00 1.04 H new ATOM 1546 N ARG C 109 10.541 -2.018 -6.071 1.00 0.60 N ATOM 1547 CA ARG C 109 11.336 -1.301 -7.055 1.00 0.66 C ATOM 1548 C ARG C 109 11.295 0.204 -6.803 1.00 0.63 C ATOM 1549 O ARG C 109 10.222 0.810 -6.748 1.00 0.72 O ATOM 1550 CB ARG C 109 10.847 -1.614 -8.470 1.00 0.76 C ATOM 1551 CG ARG C 109 11.954 -1.598 -9.512 1.00 0.88 C ATOM 1552 CD ARG C 109 12.922 -2.754 -9.308 1.00 1.00 C ATOM 1553 NE ARG C 109 14.036 -2.718 -10.255 1.00 1.13 N ATOM 1554 CZ ARG C 109 15.090 -3.530 -10.187 1.00 1.29 C ATOM 1555 NH1 ARG C 109 15.164 -4.435 -9.219 1.00 1.48 N ATOM 1556 NH2 ARG C 109 16.068 -3.440 -11.082 1.00 1.48 N ATOM 0 H ARG C 109 9.742 -2.518 -6.460 1.00 0.60 H new ATOM 0 HA ARG C 109 12.369 -1.634 -6.959 1.00 0.66 H new ATOM 0 HB2 ARG C 109 10.371 -2.594 -8.473 1.00 0.76 H new ATOM 0 HB3 ARG C 109 10.084 -0.888 -8.751 1.00 0.76 H new ATOM 0 HG2 ARG C 109 11.518 -1.657 -10.509 1.00 0.88 H new ATOM 0 HG3 ARG C 109 12.495 -0.654 -9.456 1.00 0.88 H new ATOM 0 HD2 ARG C 109 13.312 -2.724 -8.291 1.00 1.00 H new ATOM 0 HD3 ARG C 109 12.386 -3.697 -9.416 1.00 1.00 H new ATOM 0 HE ARG C 109 14.004 -2.033 -11.010 1.00 1.13 H new ATOM 0 HH11 ARG C 109 14.415 -4.507 -8.530 1.00 1.48 H new ATOM 0 HH12 ARG C 109 15.970 -5.058 -9.164 1.00 1.48 H new ATOM 0 HH21 ARG C 109 16.015 -2.746 -11.827 1.00 1.48 H new ATOM 0 HH22 ARG C 109 16.872 -4.065 -11.024 1.00 1.48 H new ATOM 1570 N VAL C 110 12.472 0.789 -6.643 1.00 0.64 N ATOM 1571 CA VAL C 110 12.603 2.218 -6.396 1.00 0.62 C ATOM 1572 C VAL C 110 13.428 2.879 -7.498 1.00 0.70 C ATOM 1573 O VAL C 110 13.661 2.274 -8.545 1.00 0.79 O ATOM 1574 CB VAL C 110 13.256 2.498 -5.024 1.00 0.66 C ATOM 1575 CG1 VAL C 110 12.222 2.428 -3.911 1.00 1.02 C ATOM 1576 CG2 VAL C 110 14.394 1.525 -4.756 1.00 0.87 C ATOM 0 H VAL C 110 13.361 0.290 -6.680 1.00 0.64 H new ATOM 0 HA VAL C 110 11.598 2.641 -6.392 1.00 0.62 H new ATOM 0 HB VAL C 110 13.668 3.507 -5.047 1.00 0.66 H new ATOM 0 HG11 VAL C 110 12.704 2.628 -2.954 1.00 1.02 H new ATOM 0 HG12 VAL C 110 11.445 3.171 -4.089 1.00 1.02 H new ATOM 0 HG13 VAL C 110 11.775 1.434 -3.891 1.00 1.02 H new ATOM 0 HG21 VAL C 110 14.838 1.743 -3.784 1.00 0.87 H new ATOM 0 HG22 VAL C 110 14.009 0.505 -4.759 1.00 0.87 H new ATOM 0 HG23 VAL C 110 15.152 1.629 -5.532 1.00 0.87 H new ATOM 1586 N LYS C 111 13.866 4.113 -7.259 1.00 0.73 N ATOM 1587 CA LYS C 111 14.661 4.855 -8.236 1.00 0.83 C ATOM 1588 C LYS C 111 16.000 4.169 -8.503 1.00 0.85 C ATOM 1589 O LYS C 111 16.256 3.692 -9.611 1.00 0.93 O ATOM 1590 CB LYS C 111 14.900 6.285 -7.744 1.00 0.89 C ATOM 1591 CG LYS C 111 13.622 7.066 -7.479 1.00 0.89 C ATOM 1592 CD LYS C 111 13.916 8.499 -7.060 1.00 0.99 C ATOM 1593 CE LYS C 111 14.477 9.323 -8.212 1.00 1.22 C ATOM 1594 NZ LYS C 111 14.835 10.698 -7.783 1.00 1.41 N ATOM 0 H LYS C 111 13.683 4.622 -6.394 1.00 0.73 H new ATOM 0 HA LYS C 111 14.101 4.881 -9.171 1.00 0.83 H new ATOM 0 HB2 LYS C 111 15.490 6.250 -6.828 1.00 0.89 H new ATOM 0 HB3 LYS C 111 15.494 6.820 -8.485 1.00 0.89 H new ATOM 0 HG2 LYS C 111 13.004 7.069 -8.377 1.00 0.89 H new ATOM 0 HG3 LYS C 111 13.047 6.569 -6.698 1.00 0.89 H new ATOM 0 HD2 LYS C 111 13.002 8.965 -6.692 1.00 0.99 H new ATOM 0 HD3 LYS C 111 14.628 8.497 -6.234 1.00 0.99 H new ATOM 0 HE2 LYS C 111 15.359 8.828 -8.617 1.00 1.22 H new ATOM 0 HE3 LYS C 111 13.742 9.373 -9.015 1.00 1.22 H new ATOM 0 HZ1 LYS C 111 15.213 11.227 -8.594 1.00 1.41 H new ATOM 0 HZ2 LYS C 111 13.988 11.180 -7.419 1.00 1.41 H new ATOM 0 HZ3 LYS C 111 15.555 10.652 -7.034 1.00 1.41 H new ATOM 1608 N ASP C 112 16.853 4.126 -7.490 1.00 0.80 N ATOM 1609 CA ASP C 112 18.160 3.492 -7.623 1.00 0.83 C ATOM 1610 C ASP C 112 18.553 2.821 -6.320 1.00 0.79 C ATOM 1611 O ASP C 112 18.652 1.596 -6.249 1.00 0.80 O ATOM 1612 CB ASP C 112 19.220 4.516 -8.029 1.00 0.94 C ATOM 1613 CG ASP C 112 20.605 3.905 -8.154 1.00 0.96 C ATOM 1614 OD1 ASP C 112 20.744 2.847 -8.811 1.00 1.16 O ATOM 1615 OD2 ASP C 112 21.566 4.483 -7.602 1.00 0.98 O ATOM 0 H ASP C 112 16.666 4.521 -6.568 1.00 0.80 H new ATOM 0 HA ASP C 112 18.096 2.735 -8.405 1.00 0.83 H new ATOM 0 HB2 ASP C 112 18.939 4.967 -8.981 1.00 0.94 H new ATOM 0 HB3 ASP C 112 19.246 5.318 -7.292 1.00 0.94 H new ATOM 1620 N LYS C 113 18.757 3.628 -5.287 1.00 0.83 N ATOM 1621 CA LYS C 113 19.131 3.105 -3.980 1.00 0.85 C ATOM 1622 C LYS C 113 17.995 2.274 -3.389 1.00 0.74 C ATOM 1623 O LYS C 113 16.868 2.751 -3.241 1.00 0.73 O ATOM 1624 CB LYS C 113 19.518 4.247 -3.031 1.00 0.96 C ATOM 1625 CG LYS C 113 18.414 5.267 -2.802 1.00 0.99 C ATOM 1626 CD LYS C 113 18.938 6.501 -2.088 1.00 1.20 C ATOM 1627 CE LYS C 113 17.825 7.500 -1.825 1.00 1.15 C ATOM 1628 NZ LYS C 113 18.355 8.804 -1.352 1.00 1.42 N ATOM 0 H LYS C 113 18.670 4.643 -5.328 1.00 0.83 H new ATOM 0 HA LYS C 113 19.999 2.457 -4.106 1.00 0.85 H new ATOM 0 HB2 LYS C 113 19.811 3.823 -2.070 1.00 0.96 H new ATOM 0 HB3 LYS C 113 20.392 4.759 -3.433 1.00 0.96 H new ATOM 0 HG2 LYS C 113 17.979 5.556 -3.759 1.00 0.99 H new ATOM 0 HG3 LYS C 113 17.616 4.815 -2.213 1.00 0.99 H new ATOM 0 HD2 LYS C 113 19.399 6.210 -1.144 1.00 1.20 H new ATOM 0 HD3 LYS C 113 19.716 6.970 -2.691 1.00 1.20 H new ATOM 0 HE2 LYS C 113 17.249 7.651 -2.738 1.00 1.15 H new ATOM 0 HE3 LYS C 113 17.141 7.094 -1.080 1.00 1.15 H new ATOM 0 HZ1 LYS C 113 17.565 9.459 -1.183 1.00 1.42 H new ATOM 0 HZ2 LYS C 113 18.883 8.664 -0.467 1.00 1.42 H new ATOM 0 HZ3 LYS C 113 18.988 9.204 -2.074 1.00 1.42 H new ATOM 1642 N VAL C 114 18.292 1.027 -3.068 1.00 0.73 N ATOM 1643 CA VAL C 114 17.293 0.133 -2.506 1.00 0.67 C ATOM 1644 C VAL C 114 17.345 0.159 -0.986 1.00 0.68 C ATOM 1645 O VAL C 114 18.395 0.412 -0.398 1.00 0.86 O ATOM 1646 CB VAL C 114 17.457 -1.316 -3.014 1.00 0.72 C ATOM 1647 CG1 VAL C 114 16.721 -1.502 -4.326 1.00 0.69 C ATOM 1648 CG2 VAL C 114 18.923 -1.672 -3.174 1.00 0.85 C ATOM 0 H VAL C 114 19.215 0.610 -3.186 1.00 0.73 H new ATOM 0 HA VAL C 114 16.320 0.493 -2.840 1.00 0.67 H new ATOM 0 HB VAL C 114 17.024 -1.987 -2.272 1.00 0.72 H new ATOM 0 HG11 VAL C 114 16.846 -2.528 -4.671 1.00 0.69 H new ATOM 0 HG12 VAL C 114 15.661 -1.295 -4.181 1.00 0.69 H new ATOM 0 HG13 VAL C 114 17.126 -0.817 -5.071 1.00 0.69 H new ATOM 0 HG21 VAL C 114 19.011 -2.697 -3.533 1.00 0.85 H new ATOM 0 HG22 VAL C 114 19.385 -0.995 -3.892 1.00 0.85 H new ATOM 0 HG23 VAL C 114 19.427 -1.580 -2.212 1.00 0.85 H new ATOM 1658 N TYR C 115 16.207 -0.096 -0.362 1.00 0.64 N ATOM 1659 CA TYR C 115 16.105 -0.080 1.088 1.00 0.63 C ATOM 1660 C TYR C 115 15.925 -1.493 1.635 1.00 0.64 C ATOM 1661 O TYR C 115 16.230 -2.481 0.967 1.00 0.91 O ATOM 1662 CB TYR C 115 14.919 0.791 1.520 1.00 0.63 C ATOM 1663 CG TYR C 115 14.981 2.219 1.020 1.00 0.69 C ATOM 1664 CD1 TYR C 115 14.453 2.570 -0.218 1.00 0.85 C ATOM 1665 CD2 TYR C 115 15.560 3.218 1.790 1.00 0.85 C ATOM 1666 CE1 TYR C 115 14.504 3.875 -0.674 1.00 0.93 C ATOM 1667 CE2 TYR C 115 15.614 4.527 1.341 1.00 0.99 C ATOM 1668 CZ TYR C 115 15.085 4.850 0.108 1.00 0.93 C ATOM 1669 OH TYR C 115 15.140 6.149 -0.344 1.00 1.09 O ATOM 0 H TYR C 115 15.334 -0.318 -0.841 1.00 0.64 H new ATOM 0 HA TYR C 115 17.029 0.335 1.490 1.00 0.63 H new ATOM 0 HB2 TYR C 115 13.997 0.333 1.162 1.00 0.63 H new ATOM 0 HB3 TYR C 115 14.868 0.801 2.609 1.00 0.63 H new ATOM 0 HD1 TYR C 115 13.995 1.810 -0.834 1.00 0.85 H new ATOM 0 HD2 TYR C 115 15.975 2.970 2.756 1.00 0.85 H new ATOM 0 HE1 TYR C 115 14.090 4.129 -1.639 1.00 0.93 H new ATOM 0 HE2 TYR C 115 16.068 5.292 1.953 1.00 0.99 H new ATOM 0 HH TYR C 115 15.580 6.711 0.328 1.00 1.09 H new ATOM 1679 N HIS C 116 15.429 -1.576 2.859 1.00 0.56 N ATOM 1680 CA HIS C 116 15.186 -2.850 3.515 1.00 0.54 C ATOM 1681 C HIS C 116 13.718 -2.950 3.893 1.00 0.51 C ATOM 1682 O HIS C 116 13.006 -1.957 3.847 1.00 0.50 O ATOM 1683 CB HIS C 116 16.055 -2.987 4.765 1.00 0.57 C ATOM 1684 CG HIS C 116 17.438 -3.475 4.496 1.00 0.61 C ATOM 1685 ND1 HIS C 116 18.570 -2.743 4.777 1.00 0.63 N ATOM 1686 CD2 HIS C 116 17.870 -4.640 3.966 1.00 0.67 C ATOM 1687 CE1 HIS C 116 19.638 -3.440 4.439 1.00 0.68 C ATOM 1688 NE2 HIS C 116 19.242 -4.604 3.946 1.00 0.71 N ATOM 0 H HIS C 116 15.184 -0.763 3.425 1.00 0.56 H new ATOM 0 HA HIS C 116 15.444 -3.656 2.828 1.00 0.54 H new ATOM 0 HB2 HIS C 116 16.113 -2.018 5.261 1.00 0.57 H new ATOM 0 HB3 HIS C 116 15.568 -3.672 5.459 1.00 0.57 H new ATOM 0 HD2 HIS C 116 17.248 -5.453 3.620 1.00 0.67 H new ATOM 0 HE1 HIS C 116 20.663 -3.116 4.546 1.00 0.68 H new ATOM 0 HE2 HIS C 116 19.853 -5.348 3.609 1.00 0.71 H new ATOM 1696 N LEU C 117 13.270 -4.140 4.280 1.00 0.53 N ATOM 1697 CA LEU C 117 11.872 -4.341 4.666 1.00 0.54 C ATOM 1698 C LEU C 117 11.521 -3.527 5.912 1.00 0.54 C ATOM 1699 O LEU C 117 10.361 -3.207 6.153 1.00 0.61 O ATOM 1700 CB LEU C 117 11.595 -5.830 4.907 1.00 0.60 C ATOM 1701 CG LEU C 117 12.541 -6.525 5.888 1.00 0.71 C ATOM 1702 CD1 LEU C 117 11.848 -6.767 7.219 1.00 0.90 C ATOM 1703 CD2 LEU C 117 13.041 -7.835 5.304 1.00 1.03 C ATOM 0 H LEU C 117 13.849 -4.978 4.336 1.00 0.53 H new ATOM 0 HA LEU C 117 11.242 -3.993 3.847 1.00 0.54 H new ATOM 0 HB2 LEU C 117 10.575 -5.937 5.275 1.00 0.60 H new ATOM 0 HB3 LEU C 117 11.645 -6.350 3.951 1.00 0.60 H new ATOM 0 HG LEU C 117 13.397 -5.873 6.060 1.00 0.71 H new ATOM 0 HD11 LEU C 117 12.537 -7.262 7.903 1.00 0.90 H new ATOM 0 HD12 LEU C 117 11.536 -5.814 7.645 1.00 0.90 H new ATOM 0 HD13 LEU C 117 10.974 -7.399 7.064 1.00 0.90 H new ATOM 0 HD21 LEU C 117 13.713 -8.317 6.014 1.00 1.03 H new ATOM 0 HD22 LEU C 117 12.194 -8.491 5.103 1.00 1.03 H new ATOM 0 HD23 LEU C 117 13.576 -7.639 4.375 1.00 1.03 H new ATOM 1715 N GLU C 118 12.541 -3.195 6.692 1.00 0.52 N ATOM 1716 CA GLU C 118 12.360 -2.418 7.911 1.00 0.55 C ATOM 1717 C GLU C 118 12.742 -0.958 7.684 1.00 0.52 C ATOM 1718 O GLU C 118 12.231 -0.057 8.349 1.00 0.54 O ATOM 1719 CB GLU C 118 13.213 -3.014 9.029 1.00 0.63 C ATOM 1720 CG GLU C 118 14.658 -3.254 8.622 1.00 0.60 C ATOM 1721 CD GLU C 118 15.492 -3.838 9.736 1.00 0.81 C ATOM 1722 OE1 GLU C 118 15.888 -3.080 10.646 1.00 1.47 O ATOM 1723 OE2 GLU C 118 15.764 -5.057 9.698 1.00 1.05 O ATOM 0 H GLU C 118 13.509 -3.454 6.500 1.00 0.52 H new ATOM 0 HA GLU C 118 11.309 -2.455 8.197 1.00 0.55 H new ATOM 0 HB2 GLU C 118 13.192 -2.344 9.889 1.00 0.63 H new ATOM 0 HB3 GLU C 118 12.772 -3.958 9.349 1.00 0.63 H new ATOM 0 HG2 GLU C 118 14.682 -3.928 7.765 1.00 0.60 H new ATOM 0 HG3 GLU C 118 15.101 -2.312 8.299 1.00 0.60 H new ATOM 1730 N CYS C 119 13.645 -0.735 6.738 1.00 0.52 N ATOM 1731 CA CYS C 119 14.113 0.602 6.416 1.00 0.52 C ATOM 1732 C CYS C 119 13.125 1.330 5.495 1.00 0.49 C ATOM 1733 O CYS C 119 13.126 2.558 5.410 1.00 0.72 O ATOM 1734 CB CYS C 119 15.500 0.497 5.774 1.00 0.56 C ATOM 1735 SG CYS C 119 16.701 -0.423 6.801 1.00 0.60 S ATOM 0 H CYS C 119 14.070 -1.473 6.176 1.00 0.52 H new ATOM 0 HA CYS C 119 14.183 1.192 7.330 1.00 0.52 H new ATOM 0 HB2 CYS C 119 15.409 0.006 4.805 1.00 0.56 H new ATOM 0 HB3 CYS C 119 15.884 1.500 5.588 1.00 0.56 H new ATOM 0 HG CYS C 119 17.909 -0.156 6.400 1.00 0.60 H new ATOM 1740 N PHE C 120 12.273 0.566 4.828 1.00 0.43 N ATOM 1741 CA PHE C 120 11.285 1.131 3.919 1.00 0.37 C ATOM 1742 C PHE C 120 9.989 1.465 4.661 1.00 0.35 C ATOM 1743 O PHE C 120 9.017 0.709 4.615 1.00 0.43 O ATOM 1744 CB PHE C 120 11.006 0.150 2.772 1.00 0.38 C ATOM 1745 CG PHE C 120 10.391 0.784 1.557 1.00 0.37 C ATOM 1746 CD1 PHE C 120 11.119 1.670 0.780 1.00 0.45 C ATOM 1747 CD2 PHE C 120 9.088 0.488 1.191 1.00 0.44 C ATOM 1748 CE1 PHE C 120 10.557 2.250 -0.342 1.00 0.50 C ATOM 1749 CE2 PHE C 120 8.522 1.066 0.070 1.00 0.48 C ATOM 1750 CZ PHE C 120 9.258 1.948 -0.697 1.00 0.47 C ATOM 0 H PHE C 120 12.246 -0.451 4.899 1.00 0.43 H new ATOM 0 HA PHE C 120 11.686 2.056 3.505 1.00 0.37 H new ATOM 0 HB2 PHE C 120 11.941 -0.330 2.484 1.00 0.38 H new ATOM 0 HB3 PHE C 120 10.342 -0.636 3.134 1.00 0.38 H new ATOM 0 HD1 PHE C 120 12.136 1.910 1.053 1.00 0.45 H new ATOM 0 HD2 PHE C 120 8.509 -0.201 1.787 1.00 0.44 H new ATOM 0 HE1 PHE C 120 11.134 2.939 -0.940 1.00 0.50 H new ATOM 0 HE2 PHE C 120 7.505 0.828 -0.206 1.00 0.48 H new ATOM 0 HZ PHE C 120 8.818 2.401 -1.573 1.00 0.47 H new ATOM 1760 N LYS C 121 9.990 2.591 5.359 1.00 0.34 N ATOM 1761 CA LYS C 121 8.822 3.034 6.108 1.00 0.35 C ATOM 1762 C LYS C 121 8.600 4.524 5.898 1.00 0.34 C ATOM 1763 O LYS C 121 9.531 5.249 5.537 1.00 0.37 O ATOM 1764 CB LYS C 121 8.986 2.733 7.603 1.00 0.41 C ATOM 1765 CG LYS C 121 10.347 3.121 8.159 1.00 0.50 C ATOM 1766 CD LYS C 121 10.316 3.265 9.673 1.00 0.87 C ATOM 1767 CE LYS C 121 11.719 3.279 10.271 1.00 1.03 C ATOM 1768 NZ LYS C 121 12.368 1.944 10.185 1.00 1.35 N ATOM 0 H LYS C 121 10.792 3.218 5.423 1.00 0.34 H new ATOM 0 HA LYS C 121 7.953 2.488 5.741 1.00 0.35 H new ATOM 0 HB2 LYS C 121 8.212 3.263 8.158 1.00 0.41 H new ATOM 0 HB3 LYS C 121 8.825 1.668 7.770 1.00 0.41 H new ATOM 0 HG2 LYS C 121 11.083 2.366 7.880 1.00 0.50 H new ATOM 0 HG3 LYS C 121 10.669 4.061 7.711 1.00 0.50 H new ATOM 0 HD2 LYS C 121 9.798 4.186 9.940 1.00 0.87 H new ATOM 0 HD3 LYS C 121 9.745 2.443 10.104 1.00 0.87 H new ATOM 0 HE2 LYS C 121 12.330 4.015 9.748 1.00 1.03 H new ATOM 0 HE3 LYS C 121 11.667 3.592 11.314 1.00 1.03 H new ATOM 0 HZ1 LYS C 121 13.362 2.059 9.903 1.00 1.35 H new ATOM 0 HZ2 LYS C 121 12.323 1.476 11.112 1.00 1.35 H new ATOM 0 HZ3 LYS C 121 11.873 1.362 9.479 1.00 1.35 H new ATOM 1782 N CYS C 122 7.370 4.972 6.123 1.00 0.33 N ATOM 1783 CA CYS C 122 7.022 6.375 5.960 1.00 0.32 C ATOM 1784 C CYS C 122 7.810 7.246 6.934 1.00 0.35 C ATOM 1785 O CYS C 122 8.255 6.782 7.990 1.00 0.39 O ATOM 1786 CB CYS C 122 5.521 6.578 6.173 1.00 0.32 C ATOM 1787 SG CYS C 122 4.937 8.281 5.867 1.00 0.35 S ATOM 0 H CYS C 122 6.595 4.379 6.420 1.00 0.33 H new ATOM 0 HA CYS C 122 7.280 6.673 4.944 1.00 0.32 H new ATOM 0 HB2 CYS C 122 4.978 5.898 5.517 1.00 0.32 H new ATOM 0 HB3 CYS C 122 5.271 6.300 7.197 1.00 0.32 H new ATOM 0 HG CYS C 122 3.800 8.243 5.238 1.00 0.35 H new ATOM 1792 N ALA C 123 7.964 8.507 6.578 1.00 0.37 N ATOM 1793 CA ALA C 123 8.696 9.454 7.398 1.00 0.42 C ATOM 1794 C ALA C 123 7.754 10.225 8.314 1.00 0.46 C ATOM 1795 O ALA C 123 8.192 10.883 9.259 1.00 0.54 O ATOM 1796 CB ALA C 123 9.480 10.414 6.519 1.00 0.45 C ATOM 0 H ALA C 123 7.587 8.903 5.717 1.00 0.37 H new ATOM 0 HA ALA C 123 9.394 8.896 8.022 1.00 0.42 H new ATOM 0 HB1 ALA C 123 10.025 11.119 7.146 1.00 0.45 H new ATOM 0 HB2 ALA C 123 10.186 9.853 5.907 1.00 0.45 H new ATOM 0 HB3 ALA C 123 8.792 10.959 5.873 1.00 0.45 H new ATOM 1802 N ALA C 124 6.459 10.126 8.058 1.00 0.41 N ATOM 1803 CA ALA C 124 5.490 10.842 8.872 1.00 0.46 C ATOM 1804 C ALA C 124 4.635 9.908 9.723 1.00 0.47 C ATOM 1805 O ALA C 124 4.646 10.004 10.951 1.00 0.56 O ATOM 1806 CB ALA C 124 4.619 11.734 8.005 1.00 0.47 C ATOM 0 H ALA C 124 6.059 9.566 7.305 1.00 0.41 H new ATOM 0 HA ALA C 124 6.055 11.467 9.564 1.00 0.46 H new ATOM 0 HB1 ALA C 124 3.900 12.261 8.632 1.00 0.47 H new ATOM 0 HB2 ALA C 124 5.245 12.458 7.483 1.00 0.47 H new ATOM 0 HB3 ALA C 124 4.085 11.124 7.276 1.00 0.47 H new ATOM 1812 N CYS C 125 3.897 9.005 9.090 1.00 0.43 N ATOM 1813 CA CYS C 125 3.037 8.099 9.841 1.00 0.45 C ATOM 1814 C CYS C 125 3.746 6.788 10.174 1.00 0.43 C ATOM 1815 O CYS C 125 3.270 6.016 11.007 1.00 0.46 O ATOM 1816 CB CYS C 125 1.727 7.844 9.087 1.00 0.45 C ATOM 1817 SG CYS C 125 1.877 6.853 7.569 1.00 0.41 S ATOM 0 H CYS C 125 3.875 8.881 8.078 1.00 0.43 H new ATOM 0 HA CYS C 125 2.797 8.583 10.788 1.00 0.45 H new ATOM 0 HB2 CYS C 125 1.032 7.342 9.761 1.00 0.45 H new ATOM 0 HB3 CYS C 125 1.283 8.806 8.830 1.00 0.45 H new ATOM 0 HG CYS C 125 2.908 7.256 6.888 1.00 0.41 H new ATOM 1822 N GLN C 126 4.873 6.546 9.504 1.00 0.40 N ATOM 1823 CA GLN C 126 5.687 5.345 9.723 1.00 0.40 C ATOM 1824 C GLN C 126 4.958 4.062 9.319 1.00 0.40 C ATOM 1825 O GLN C 126 5.410 2.964 9.646 1.00 0.56 O ATOM 1826 CB GLN C 126 6.128 5.245 11.190 1.00 0.49 C ATOM 1827 CG GLN C 126 7.487 5.868 11.482 1.00 0.53 C ATOM 1828 CD GLN C 126 7.454 7.383 11.520 1.00 0.57 C ATOM 1829 OE1 GLN C 126 7.149 7.989 12.550 1.00 0.71 O ATOM 1830 NE2 GLN C 126 7.780 8.009 10.406 1.00 0.52 N ATOM 0 H GLN C 126 5.249 7.175 8.794 1.00 0.40 H new ATOM 0 HA GLN C 126 6.564 5.445 9.084 1.00 0.40 H new ATOM 0 HB2 GLN C 126 5.378 5.729 11.816 1.00 0.49 H new ATOM 0 HB3 GLN C 126 6.154 4.194 11.478 1.00 0.49 H new ATOM 0 HG2 GLN C 126 7.852 5.495 12.439 1.00 0.53 H new ATOM 0 HG3 GLN C 126 8.198 5.546 10.722 1.00 0.53 H new ATOM 0 HE21 GLN C 126 8.027 7.474 9.574 1.00 0.52 H new ATOM 0 HE22 GLN C 126 7.786 9.029 10.377 1.00 0.52 H new ATOM 1839 N LYS C 127 3.848 4.191 8.599 1.00 0.39 N ATOM 1840 CA LYS C 127 3.092 3.021 8.168 1.00 0.41 C ATOM 1841 C LYS C 127 3.774 2.358 6.977 1.00 0.37 C ATOM 1842 O LYS C 127 4.752 2.883 6.438 1.00 0.41 O ATOM 1843 CB LYS C 127 1.655 3.404 7.795 1.00 0.44 C ATOM 1844 CG LYS C 127 0.882 4.079 8.916 1.00 0.60 C ATOM 1845 CD LYS C 127 0.742 3.184 10.136 1.00 0.93 C ATOM 1846 CE LYS C 127 0.050 3.907 11.278 1.00 1.17 C ATOM 1847 NZ LYS C 127 0.703 5.206 11.595 1.00 1.58 N ATOM 0 H LYS C 127 3.455 5.085 8.304 1.00 0.39 H new ATOM 0 HA LYS C 127 3.059 2.317 9.000 1.00 0.41 H new ATOM 0 HB2 LYS C 127 1.680 4.071 6.933 1.00 0.44 H new ATOM 0 HB3 LYS C 127 1.119 2.506 7.488 1.00 0.44 H new ATOM 0 HG2 LYS C 127 1.389 5.001 9.200 1.00 0.60 H new ATOM 0 HG3 LYS C 127 -0.108 4.357 8.556 1.00 0.60 H new ATOM 0 HD2 LYS C 127 0.174 2.292 9.871 1.00 0.93 H new ATOM 0 HD3 LYS C 127 1.728 2.850 10.459 1.00 0.93 H new ATOM 0 HE2 LYS C 127 -0.994 4.081 11.017 1.00 1.17 H new ATOM 0 HE3 LYS C 127 0.056 3.273 12.165 1.00 1.17 H new ATOM 0 HZ1 LYS C 127 0.745 5.331 12.627 1.00 1.58 H new ATOM 0 HZ2 LYS C 127 1.667 5.214 11.206 1.00 1.58 H new ATOM 0 HZ3 LYS C 127 0.154 5.982 11.175 1.00 1.58 H new ATOM 1861 N HIS C 128 3.266 1.203 6.577 1.00 0.40 N ATOM 1862 CA HIS C 128 3.831 0.487 5.444 1.00 0.41 C ATOM 1863 C HIS C 128 3.079 0.842 4.172 1.00 0.39 C ATOM 1864 O HIS C 128 1.905 1.207 4.216 1.00 0.39 O ATOM 1865 CB HIS C 128 3.817 -1.034 5.672 1.00 0.51 C ATOM 1866 CG HIS C 128 2.451 -1.661 5.641 1.00 0.56 C ATOM 1867 ND1 HIS C 128 1.748 -1.901 4.475 1.00 0.68 N ATOM 1868 CD2 HIS C 128 1.666 -2.106 6.644 1.00 0.64 C ATOM 1869 CE1 HIS C 128 0.590 -2.461 4.774 1.00 0.78 C ATOM 1870 NE2 HIS C 128 0.515 -2.598 6.083 1.00 0.76 N ATOM 0 H HIS C 128 2.469 0.744 7.017 1.00 0.40 H new ATOM 0 HA HIS C 128 4.872 0.794 5.339 1.00 0.41 H new ATOM 0 HB2 HIS C 128 4.437 -1.508 4.911 1.00 0.51 H new ATOM 0 HB3 HIS C 128 4.278 -1.247 6.636 1.00 0.51 H new ATOM 0 HD1 HIS C 128 2.072 -1.681 3.533 1.00 0.68 H new ATOM 0 HD2 HIS C 128 1.901 -2.080 7.698 1.00 0.64 H new ATOM 0 HE1 HIS C 128 -0.169 -2.757 4.065 1.00 0.78 H new ATOM 0 HE2 HIS C 128 -0.269 -3.003 6.594 1.00 0.76 H new ATOM 1879 N PHE C 129 3.753 0.707 3.046 1.00 0.39 N ATOM 1880 CA PHE C 129 3.161 1.025 1.755 1.00 0.39 C ATOM 1881 C PHE C 129 2.402 -0.170 1.189 1.00 0.48 C ATOM 1882 O PHE C 129 2.434 -1.268 1.758 1.00 0.56 O ATOM 1883 CB PHE C 129 4.256 1.462 0.775 1.00 0.37 C ATOM 1884 CG PHE C 129 5.040 2.660 1.240 1.00 0.28 C ATOM 1885 CD1 PHE C 129 6.047 2.524 2.183 1.00 0.37 C ATOM 1886 CD2 PHE C 129 4.767 3.921 0.737 1.00 0.21 C ATOM 1887 CE1 PHE C 129 6.765 3.620 2.616 1.00 0.40 C ATOM 1888 CE2 PHE C 129 5.484 5.021 1.167 1.00 0.23 C ATOM 1889 CZ PHE C 129 6.483 4.871 2.107 1.00 0.33 C ATOM 0 H PHE C 129 4.717 0.377 2.997 1.00 0.39 H new ATOM 0 HA PHE C 129 2.452 1.841 1.895 1.00 0.39 H new ATOM 0 HB2 PHE C 129 4.942 0.630 0.615 1.00 0.37 H new ATOM 0 HB3 PHE C 129 3.800 1.689 -0.189 1.00 0.37 H new ATOM 0 HD1 PHE C 129 6.273 1.547 2.584 1.00 0.37 H new ATOM 0 HD2 PHE C 129 3.986 4.046 0.001 1.00 0.21 H new ATOM 0 HE1 PHE C 129 7.546 3.499 3.352 1.00 0.40 H new ATOM 0 HE2 PHE C 129 5.262 5.999 0.767 1.00 0.23 H new ATOM 0 HZ PHE C 129 7.043 5.731 2.444 1.00 0.33 H new ATOM 1899 N SER C 130 1.711 0.056 0.083 1.00 0.54 N ATOM 1900 CA SER C 130 0.956 -0.989 -0.587 1.00 0.69 C ATOM 1901 C SER C 130 1.422 -1.094 -2.036 1.00 0.60 C ATOM 1902 O SER C 130 1.757 -0.084 -2.652 1.00 0.80 O ATOM 1903 CB SER C 130 -0.546 -0.687 -0.531 1.00 0.87 C ATOM 1904 OG SER C 130 -0.812 0.496 0.206 1.00 1.44 O ATOM 0 H SER C 130 1.658 0.966 -0.374 1.00 0.54 H new ATOM 0 HA SER C 130 1.129 -1.938 -0.080 1.00 0.69 H new ATOM 0 HB2 SER C 130 -0.935 -0.581 -1.544 1.00 0.87 H new ATOM 0 HB3 SER C 130 -1.070 -1.527 -0.075 1.00 0.87 H new ATOM 0 HG SER C 130 -1.297 1.132 -0.360 1.00 1.44 H new ATOM 1910 N VAL C 131 1.462 -2.308 -2.568 1.00 0.76 N ATOM 1911 CA VAL C 131 1.903 -2.518 -3.941 1.00 0.73 C ATOM 1912 C VAL C 131 0.924 -1.890 -4.936 1.00 0.65 C ATOM 1913 O VAL C 131 -0.278 -2.158 -4.899 1.00 0.73 O ATOM 1914 CB VAL C 131 2.093 -4.025 -4.256 1.00 0.94 C ATOM 1915 CG1 VAL C 131 0.824 -4.818 -3.970 1.00 1.06 C ATOM 1916 CG2 VAL C 131 2.542 -4.218 -5.699 1.00 0.96 C ATOM 0 H VAL C 131 1.196 -3.159 -2.073 1.00 0.76 H new ATOM 0 HA VAL C 131 2.870 -2.026 -4.046 1.00 0.73 H new ATOM 0 HB VAL C 131 2.874 -4.408 -3.599 1.00 0.94 H new ATOM 0 HG11 VAL C 131 0.992 -5.870 -4.202 1.00 1.06 H new ATOM 0 HG12 VAL C 131 0.561 -4.716 -2.917 1.00 1.06 H new ATOM 0 HG13 VAL C 131 0.010 -4.436 -4.586 1.00 1.06 H new ATOM 0 HG21 VAL C 131 2.670 -5.281 -5.901 1.00 0.96 H new ATOM 0 HG22 VAL C 131 1.789 -3.809 -6.372 1.00 0.96 H new ATOM 0 HG23 VAL C 131 3.489 -3.702 -5.857 1.00 0.96 H new ATOM 1926 N GLY C 132 1.449 -1.024 -5.795 1.00 0.57 N ATOM 1927 CA GLY C 132 0.625 -0.375 -6.794 1.00 0.58 C ATOM 1928 C GLY C 132 0.036 0.944 -6.325 1.00 0.52 C ATOM 1929 O GLY C 132 -0.867 1.484 -6.966 1.00 0.61 O ATOM 0 H GLY C 132 2.434 -0.760 -5.816 1.00 0.57 H new ATOM 0 HA2 GLY C 132 1.222 -0.200 -7.689 1.00 0.58 H new ATOM 0 HA3 GLY C 132 -0.186 -1.046 -7.078 1.00 0.58 H new ATOM 1933 N ASP C 133 0.534 1.462 -5.209 1.00 0.50 N ATOM 1934 CA ASP C 133 0.042 2.730 -4.678 1.00 0.49 C ATOM 1935 C ASP C 133 1.048 3.847 -4.931 1.00 0.40 C ATOM 1936 O ASP C 133 2.212 3.595 -5.252 1.00 0.37 O ATOM 1937 CB ASP C 133 -0.266 2.617 -3.181 1.00 0.51 C ATOM 1938 CG ASP C 133 -1.743 2.382 -2.918 1.00 0.73 C ATOM 1939 OD1 ASP C 133 -2.567 2.702 -3.800 1.00 0.85 O ATOM 1940 OD2 ASP C 133 -2.095 1.864 -1.832 1.00 1.06 O ATOM 0 H ASP C 133 1.273 1.028 -4.656 1.00 0.50 H new ATOM 0 HA ASP C 133 -0.884 2.974 -5.198 1.00 0.49 H new ATOM 0 HB2 ASP C 133 0.313 1.798 -2.753 1.00 0.51 H new ATOM 0 HB3 ASP C 133 0.051 3.530 -2.676 1.00 0.51 H new ATOM 1945 N ARG C 134 0.588 5.079 -4.800 1.00 0.41 N ATOM 1946 CA ARG C 134 1.433 6.250 -5.018 1.00 0.37 C ATOM 1947 C ARG C 134 2.283 6.546 -3.781 1.00 0.31 C ATOM 1948 O ARG C 134 1.859 6.279 -2.658 1.00 0.31 O ATOM 1949 CB ARG C 134 0.557 7.457 -5.369 1.00 0.44 C ATOM 1950 CG ARG C 134 -0.539 7.721 -4.347 1.00 0.64 C ATOM 1951 CD ARG C 134 -1.808 8.279 -4.981 1.00 0.78 C ATOM 1952 NE ARG C 134 -2.271 7.484 -6.123 1.00 1.08 N ATOM 1953 CZ ARG C 134 -2.954 6.337 -6.028 1.00 1.74 C ATOM 1954 NH1 ARG C 134 -3.214 5.791 -4.842 1.00 2.09 N ATOM 1955 NH2 ARG C 134 -3.370 5.728 -7.134 1.00 2.18 N ATOM 0 H ARG C 134 -0.374 5.300 -4.542 1.00 0.41 H new ATOM 0 HA ARG C 134 2.110 6.046 -5.848 1.00 0.37 H new ATOM 0 HB2 ARG C 134 1.187 8.343 -5.453 1.00 0.44 H new ATOM 0 HB3 ARG C 134 0.102 7.295 -6.346 1.00 0.44 H new ATOM 0 HG2 ARG C 134 -0.775 6.794 -3.825 1.00 0.64 H new ATOM 0 HG3 ARG C 134 -0.172 8.423 -3.599 1.00 0.64 H new ATOM 0 HD2 ARG C 134 -2.596 8.320 -4.229 1.00 0.78 H new ATOM 0 HD3 ARG C 134 -1.625 9.303 -5.307 1.00 0.78 H new ATOM 0 HE ARG C 134 -2.057 7.831 -7.058 1.00 1.08 H new ATOM 0 HH11 ARG C 134 -2.891 6.247 -3.989 1.00 2.09 H new ATOM 0 HH12 ARG C 134 -3.736 4.916 -4.787 1.00 2.09 H new ATOM 0 HH21 ARG C 134 -3.168 6.135 -8.047 1.00 2.18 H new ATOM 0 HH22 ARG C 134 -3.891 4.854 -7.069 1.00 2.18 H new ATOM 1969 N TYR C 135 3.482 7.085 -3.988 1.00 0.30 N ATOM 1970 CA TYR C 135 4.376 7.406 -2.878 1.00 0.29 C ATOM 1971 C TYR C 135 5.375 8.495 -3.268 1.00 0.31 C ATOM 1972 O TYR C 135 5.483 8.868 -4.439 1.00 0.37 O ATOM 1973 CB TYR C 135 5.123 6.144 -2.412 1.00 0.30 C ATOM 1974 CG TYR C 135 6.364 5.805 -3.221 1.00 0.34 C ATOM 1975 CD1 TYR C 135 6.291 5.556 -4.585 1.00 0.37 C ATOM 1976 CD2 TYR C 135 7.613 5.731 -2.611 1.00 0.42 C ATOM 1977 CE1 TYR C 135 7.421 5.246 -5.318 1.00 0.43 C ATOM 1978 CE2 TYR C 135 8.748 5.421 -3.338 1.00 0.49 C ATOM 1979 CZ TYR C 135 8.647 5.180 -4.690 1.00 0.48 C ATOM 1980 OH TYR C 135 9.776 4.871 -5.417 1.00 0.57 O ATOM 0 H TYR C 135 3.856 7.308 -4.910 1.00 0.30 H new ATOM 0 HA TYR C 135 3.768 7.784 -2.056 1.00 0.29 H new ATOM 0 HB2 TYR C 135 5.410 6.273 -1.368 1.00 0.30 H new ATOM 0 HB3 TYR C 135 4.438 5.297 -2.452 1.00 0.30 H new ATOM 0 HD1 TYR C 135 5.334 5.605 -5.082 1.00 0.37 H new ATOM 0 HD2 TYR C 135 7.697 5.919 -1.551 1.00 0.42 H new ATOM 0 HE1 TYR C 135 7.344 5.056 -6.378 1.00 0.43 H new ATOM 0 HE2 TYR C 135 9.709 5.368 -2.848 1.00 0.49 H new ATOM 0 HH TYR C 135 10.574 5.096 -4.894 1.00 0.57 H new ATOM 1990 N LEU C 136 6.103 8.998 -2.279 1.00 0.32 N ATOM 1991 CA LEU C 136 7.103 10.031 -2.503 1.00 0.40 C ATOM 1992 C LEU C 136 8.428 9.626 -1.860 1.00 0.41 C ATOM 1993 O LEU C 136 8.443 8.967 -0.819 1.00 0.48 O ATOM 1994 CB LEU C 136 6.616 11.367 -1.930 1.00 0.45 C ATOM 1995 CG LEU C 136 7.527 12.570 -2.192 1.00 0.55 C ATOM 1996 CD1 LEU C 136 7.587 12.883 -3.680 1.00 0.63 C ATOM 1997 CD2 LEU C 136 7.038 13.780 -1.410 1.00 0.63 C ATOM 0 H LEU C 136 6.017 8.703 -1.306 1.00 0.32 H new ATOM 0 HA LEU C 136 7.258 10.148 -3.575 1.00 0.40 H new ATOM 0 HB2 LEU C 136 5.631 11.582 -2.345 1.00 0.45 H new ATOM 0 HB3 LEU C 136 6.491 11.256 -0.853 1.00 0.45 H new ATOM 0 HG LEU C 136 8.534 12.322 -1.856 1.00 0.55 H new ATOM 0 HD11 LEU C 136 8.239 13.741 -3.845 1.00 0.63 H new ATOM 0 HD12 LEU C 136 7.979 12.020 -4.218 1.00 0.63 H new ATOM 0 HD13 LEU C 136 6.586 13.113 -4.044 1.00 0.63 H new ATOM 0 HD21 LEU C 136 7.694 14.628 -1.605 1.00 0.63 H new ATOM 0 HD22 LEU C 136 6.023 14.028 -1.720 1.00 0.63 H new ATOM 0 HD23 LEU C 136 7.046 13.552 -0.344 1.00 0.63 H new ATOM 2009 N LEU C 137 9.533 10.020 -2.480 1.00 0.42 N ATOM 2010 CA LEU C 137 10.859 9.687 -1.973 1.00 0.46 C ATOM 2011 C LEU C 137 11.577 10.944 -1.491 1.00 0.46 C ATOM 2012 O LEU C 137 11.748 11.900 -2.251 1.00 0.49 O ATOM 2013 CB LEU C 137 11.675 8.983 -3.063 1.00 0.55 C ATOM 2014 CG LEU C 137 12.954 8.292 -2.586 1.00 0.64 C ATOM 2015 CD1 LEU C 137 13.039 6.884 -3.158 1.00 1.16 C ATOM 2016 CD2 LEU C 137 14.180 9.106 -2.980 1.00 1.06 C ATOM 0 H LEU C 137 9.537 10.572 -3.338 1.00 0.42 H new ATOM 0 HA LEU C 137 10.752 9.010 -1.125 1.00 0.46 H new ATOM 0 HB2 LEU C 137 11.040 8.240 -3.545 1.00 0.55 H new ATOM 0 HB3 LEU C 137 11.941 9.717 -3.824 1.00 0.55 H new ATOM 0 HG LEU C 137 12.926 8.222 -1.499 1.00 0.64 H new ATOM 0 HD11 LEU C 137 13.954 6.405 -2.810 1.00 1.16 H new ATOM 0 HD12 LEU C 137 12.177 6.304 -2.827 1.00 1.16 H new ATOM 0 HD13 LEU C 137 13.047 6.933 -4.247 1.00 1.16 H new ATOM 0 HD21 LEU C 137 15.080 8.599 -2.632 1.00 1.06 H new ATOM 0 HD22 LEU C 137 14.216 9.207 -4.065 1.00 1.06 H new ATOM 0 HD23 LEU C 137 14.122 10.095 -2.525 1.00 1.06 H new ATOM 2028 N ILE C 138 11.988 10.944 -0.228 1.00 0.49 N ATOM 2029 CA ILE C 138 12.679 12.093 0.351 1.00 0.54 C ATOM 2030 C ILE C 138 14.192 11.851 0.358 1.00 0.58 C ATOM 2031 O ILE C 138 14.670 10.867 -0.206 1.00 0.73 O ATOM 2032 CB ILE C 138 12.181 12.390 1.790 1.00 0.53 C ATOM 2033 CG1 ILE C 138 10.710 11.978 1.950 1.00 0.61 C ATOM 2034 CG2 ILE C 138 12.341 13.872 2.130 1.00 0.64 C ATOM 2035 CD1 ILE C 138 9.750 12.788 1.100 1.00 0.77 C ATOM 0 H ILE C 138 11.856 10.163 0.415 1.00 0.49 H new ATOM 0 HA ILE C 138 12.456 12.962 -0.267 1.00 0.54 H new ATOM 0 HB ILE C 138 12.791 11.806 2.479 1.00 0.53 H new ATOM 0 HG12 ILE C 138 10.608 10.924 1.692 1.00 0.61 H new ATOM 0 HG13 ILE C 138 10.426 12.079 2.998 1.00 0.61 H new ATOM 0 HG21 ILE C 138 11.985 14.053 3.144 1.00 0.64 H new ATOM 0 HG22 ILE C 138 13.393 14.150 2.060 1.00 0.64 H new ATOM 0 HG23 ILE C 138 11.760 14.471 1.429 1.00 0.64 H new ATOM 0 HD11 ILE C 138 8.731 12.438 1.268 1.00 0.77 H new ATOM 0 HD12 ILE C 138 9.822 13.841 1.373 1.00 0.77 H new ATOM 0 HD13 ILE C 138 10.006 12.668 0.047 1.00 0.77 H new ATOM 2047 N ASN C 139 14.941 12.743 1.001 1.00 0.70 N ATOM 2048 CA ASN C 139 16.395 12.632 1.057 1.00 0.73 C ATOM 2049 C ASN C 139 16.851 11.552 2.036 1.00 0.66 C ATOM 2050 O ASN C 139 17.920 10.965 1.861 1.00 0.84 O ATOM 2051 CB ASN C 139 17.021 13.977 1.448 1.00 0.90 C ATOM 2052 CG ASN C 139 16.883 15.029 0.362 1.00 1.04 C ATOM 2053 OD1 ASN C 139 17.639 15.041 -0.610 1.00 1.12 O ATOM 2054 ND2 ASN C 139 15.932 15.934 0.527 1.00 1.32 N ATOM 0 H ASN C 139 14.563 13.553 1.492 1.00 0.70 H new ATOM 0 HA ASN C 139 16.732 12.347 0.060 1.00 0.73 H new ATOM 0 HB2 ASN C 139 16.549 14.340 2.361 1.00 0.90 H new ATOM 0 HB3 ASN C 139 18.077 13.829 1.672 1.00 0.90 H new ATOM 0 HD21 ASN C 139 15.806 16.674 -0.164 1.00 1.32 H new ATOM 0 HD22 ASN C 139 15.324 15.892 1.345 1.00 1.32 H new ATOM 2061 N SER C 140 16.046 11.285 3.055 1.00 0.57 N ATOM 2062 CA SER C 140 16.398 10.283 4.052 1.00 0.61 C ATOM 2063 C SER C 140 15.434 9.096 4.018 1.00 0.54 C ATOM 2064 O SER C 140 15.848 7.950 3.829 1.00 0.68 O ATOM 2065 CB SER C 140 16.394 10.919 5.443 1.00 0.76 C ATOM 2066 OG SER C 140 15.116 11.451 5.754 1.00 1.04 O ATOM 0 H SER C 140 15.150 11.745 3.213 1.00 0.57 H new ATOM 0 HA SER C 140 17.395 9.909 3.821 1.00 0.61 H new ATOM 0 HB2 SER C 140 16.673 10.174 6.188 1.00 0.76 H new ATOM 0 HB3 SER C 140 17.142 11.710 5.487 1.00 0.76 H new ATOM 0 HG SER C 140 14.622 10.812 6.309 1.00 1.04 H new ATOM 2072 N ASP C 141 14.152 9.382 4.187 1.00 0.53 N ATOM 2073 CA ASP C 141 13.133 8.343 4.204 1.00 0.48 C ATOM 2074 C ASP C 141 12.186 8.508 3.025 1.00 0.41 C ATOM 2075 O ASP C 141 12.504 9.188 2.048 1.00 0.46 O ATOM 2076 CB ASP C 141 12.332 8.399 5.514 1.00 0.49 C ATOM 2077 CG ASP C 141 13.205 8.433 6.755 1.00 0.72 C ATOM 2078 OD1 ASP C 141 13.683 9.531 7.125 1.00 1.06 O ATOM 2079 OD2 ASP C 141 13.410 7.368 7.374 1.00 1.10 O ATOM 0 H ASP C 141 13.792 10.328 4.315 1.00 0.53 H new ATOM 0 HA ASP C 141 13.632 7.377 4.130 1.00 0.48 H new ATOM 0 HB2 ASP C 141 11.694 9.283 5.503 1.00 0.49 H new ATOM 0 HB3 ASP C 141 11.674 7.532 5.566 1.00 0.49 H new ATOM 2084 N ILE C 142 11.021 7.889 3.128 1.00 0.37 N ATOM 2085 CA ILE C 142 10.004 7.957 2.090 1.00 0.32 C ATOM 2086 C ILE C 142 8.684 8.410 2.702 1.00 0.30 C ATOM 2087 O ILE C 142 8.542 8.431 3.920 1.00 0.32 O ATOM 2088 CB ILE C 142 9.801 6.598 1.369 1.00 0.31 C ATOM 2089 CG1 ILE C 142 9.970 5.417 2.342 1.00 0.37 C ATOM 2090 CG2 ILE C 142 10.757 6.474 0.187 1.00 0.38 C ATOM 2091 CD1 ILE C 142 11.397 4.919 2.482 1.00 0.45 C ATOM 0 H ILE C 142 10.753 7.325 3.934 1.00 0.37 H new ATOM 0 HA ILE C 142 10.346 8.674 1.344 1.00 0.32 H new ATOM 0 HB ILE C 142 8.779 6.566 0.990 1.00 0.31 H new ATOM 0 HG12 ILE C 142 9.605 5.716 3.324 1.00 0.37 H new ATOM 0 HG13 ILE C 142 9.342 4.592 2.006 1.00 0.37 H new ATOM 0 HG21 ILE C 142 10.602 5.515 -0.308 1.00 0.38 H new ATOM 0 HG22 ILE C 142 10.568 7.282 -0.520 1.00 0.38 H new ATOM 0 HG23 ILE C 142 11.785 6.536 0.543 1.00 0.38 H new ATOM 0 HD11 ILE C 142 11.425 4.087 3.186 1.00 0.45 H new ATOM 0 HD12 ILE C 142 11.763 4.585 1.511 1.00 0.45 H new ATOM 0 HD13 ILE C 142 12.030 5.727 2.850 1.00 0.45 H new ATOM 2103 N VAL C 143 7.728 8.783 1.867 1.00 0.29 N ATOM 2104 CA VAL C 143 6.432 9.242 2.351 1.00 0.28 C ATOM 2105 C VAL C 143 5.306 8.554 1.585 1.00 0.24 C ATOM 2106 O VAL C 143 5.437 8.281 0.388 1.00 0.23 O ATOM 2107 CB VAL C 143 6.305 10.783 2.231 1.00 0.34 C ATOM 2108 CG1 VAL C 143 4.874 11.250 2.443 1.00 0.37 C ATOM 2109 CG2 VAL C 143 7.225 11.474 3.226 1.00 0.45 C ATOM 0 H VAL C 143 7.823 8.778 0.851 1.00 0.29 H new ATOM 0 HA VAL C 143 6.352 8.978 3.406 1.00 0.28 H new ATOM 0 HB VAL C 143 6.601 11.053 1.217 1.00 0.34 H new ATOM 0 HG11 VAL C 143 4.828 12.335 2.351 1.00 0.37 H new ATOM 0 HG12 VAL C 143 4.228 10.794 1.693 1.00 0.37 H new ATOM 0 HG13 VAL C 143 4.539 10.956 3.438 1.00 0.37 H new ATOM 0 HG21 VAL C 143 7.122 12.555 3.127 1.00 0.45 H new ATOM 0 HG22 VAL C 143 6.955 11.175 4.239 1.00 0.45 H new ATOM 0 HG23 VAL C 143 8.258 11.188 3.026 1.00 0.45 H new ATOM 2119 N CYS C 144 4.217 8.268 2.290 1.00 0.23 N ATOM 2120 CA CYS C 144 3.063 7.602 1.709 1.00 0.21 C ATOM 2121 C CYS C 144 2.214 8.575 0.888 1.00 0.20 C ATOM 2122 O CYS C 144 2.721 9.524 0.289 1.00 0.32 O ATOM 2123 CB CYS C 144 2.210 6.991 2.828 1.00 0.26 C ATOM 2124 SG CYS C 144 1.467 8.219 3.956 1.00 0.32 S ATOM 0 H CYS C 144 4.112 8.492 3.279 1.00 0.23 H new ATOM 0 HA CYS C 144 3.420 6.818 1.041 1.00 0.21 H new ATOM 0 HB2 CYS C 144 1.414 6.397 2.380 1.00 0.26 H new ATOM 0 HB3 CYS C 144 2.829 6.307 3.409 1.00 0.26 H new ATOM 0 HG CYS C 144 1.579 7.804 5.183 1.00 0.32 H new ATOM 2129 N GLU C 145 0.917 8.316 0.868 1.00 0.21 N ATOM 2130 CA GLU C 145 -0.037 9.150 0.157 1.00 0.22 C ATOM 2131 C GLU C 145 -1.095 9.651 1.129 1.00 0.26 C ATOM 2132 O GLU C 145 -1.975 10.438 0.776 1.00 0.28 O ATOM 2133 CB GLU C 145 -0.703 8.363 -0.968 1.00 0.25 C ATOM 2134 CG GLU C 145 -1.518 7.183 -0.475 1.00 0.29 C ATOM 2135 CD GLU C 145 -2.726 6.923 -1.340 1.00 0.49 C ATOM 2136 OE1 GLU C 145 -2.597 6.203 -2.347 1.00 0.95 O ATOM 2137 OE2 GLU C 145 -3.820 7.426 -1.010 1.00 0.59 O ATOM 0 H GLU C 145 0.495 7.519 1.346 1.00 0.21 H new ATOM 0 HA GLU C 145 0.493 9.997 -0.279 1.00 0.22 H new ATOM 0 HB2 GLU C 145 -1.351 9.031 -1.535 1.00 0.25 H new ATOM 0 HB3 GLU C 145 0.064 8.004 -1.654 1.00 0.25 H new ATOM 0 HG2 GLU C 145 -0.889 6.293 -0.455 1.00 0.29 H new ATOM 0 HG3 GLU C 145 -1.840 7.369 0.550 1.00 0.29 H new ATOM 2144 N GLN C 146 -0.991 9.193 2.366 1.00 0.31 N ATOM 2145 CA GLN C 146 -1.934 9.565 3.403 1.00 0.38 C ATOM 2146 C GLN C 146 -1.537 10.899 4.013 1.00 0.38 C ATOM 2147 O GLN C 146 -2.376 11.774 4.235 1.00 0.46 O ATOM 2148 CB GLN C 146 -1.977 8.482 4.485 1.00 0.44 C ATOM 2149 CG GLN C 146 -2.896 8.816 5.653 1.00 0.67 C ATOM 2150 CD GLN C 146 -2.592 8.006 6.902 1.00 0.83 C ATOM 2151 OE1 GLN C 146 -1.337 7.622 7.079 1.00 0.86 O flip ATOM 2152 NE2 GLN C 146 -3.483 7.728 7.707 1.00 1.34 N flip ATOM 0 H GLN C 146 -0.256 8.558 2.676 1.00 0.31 H new ATOM 0 HA GLN C 146 -2.926 9.661 2.962 1.00 0.38 H new ATOM 0 HB2 GLN C 146 -2.303 7.544 4.035 1.00 0.44 H new ATOM 0 HB3 GLN C 146 -0.968 8.320 4.864 1.00 0.44 H new ATOM 0 HG2 GLN C 146 -2.807 9.877 5.885 1.00 0.67 H new ATOM 0 HG3 GLN C 146 -3.930 8.640 5.356 1.00 0.67 H new ATOM 0 HE21 GLN C 146 -4.439 8.041 7.538 1.00 1.34 H new ATOM 0 HE22 GLN C 146 -3.264 7.185 8.542 1.00 1.34 H new ATOM 2161 N ASP C 147 -0.249 11.052 4.270 1.00 0.33 N ATOM 2162 CA ASP C 147 0.263 12.278 4.863 1.00 0.35 C ATOM 2163 C ASP C 147 1.148 13.036 3.877 1.00 0.33 C ATOM 2164 O ASP C 147 1.777 14.034 4.231 1.00 0.38 O ATOM 2165 CB ASP C 147 1.024 11.976 6.164 1.00 0.40 C ATOM 2166 CG ASP C 147 2.170 10.993 5.986 1.00 0.38 C ATOM 2167 OD1 ASP C 147 3.061 11.270 5.161 1.00 0.38 O ATOM 2168 OD2 ASP C 147 2.192 9.971 6.712 1.00 0.40 O ATOM 0 H ASP C 147 0.461 10.345 4.078 1.00 0.33 H new ATOM 0 HA ASP C 147 -0.587 12.916 5.107 1.00 0.35 H new ATOM 0 HB2 ASP C 147 1.416 12.908 6.570 1.00 0.40 H new ATOM 0 HB3 ASP C 147 0.325 11.577 6.899 1.00 0.40 H new ATOM 2173 N ILE C 148 1.165 12.580 2.626 1.00 0.29 N ATOM 2174 CA ILE C 148 1.966 13.221 1.583 1.00 0.30 C ATOM 2175 C ILE C 148 1.499 14.660 1.354 1.00 0.33 C ATOM 2176 O ILE C 148 2.296 15.542 1.032 1.00 0.38 O ATOM 2177 CB ILE C 148 1.918 12.414 0.256 1.00 0.28 C ATOM 2178 CG1 ILE C 148 3.096 12.792 -0.667 1.00 0.35 C ATOM 2179 CG2 ILE C 148 0.580 12.590 -0.459 1.00 0.26 C ATOM 2180 CD1 ILE C 148 2.803 13.908 -1.654 1.00 0.65 C ATOM 0 H ILE C 148 0.633 11.769 2.309 1.00 0.29 H new ATOM 0 HA ILE C 148 3.001 13.241 1.924 1.00 0.30 H new ATOM 0 HB ILE C 148 2.016 11.359 0.511 1.00 0.28 H new ATOM 0 HG12 ILE C 148 3.943 13.087 -0.048 1.00 0.35 H new ATOM 0 HG13 ILE C 148 3.401 11.906 -1.223 1.00 0.35 H new ATOM 0 HG21 ILE C 148 0.582 12.012 -1.383 1.00 0.26 H new ATOM 0 HG22 ILE C 148 -0.226 12.240 0.186 1.00 0.26 H new ATOM 0 HG23 ILE C 148 0.427 13.644 -0.691 1.00 0.26 H new ATOM 0 HD11 ILE C 148 3.690 14.102 -2.258 1.00 0.65 H new ATOM 0 HD12 ILE C 148 1.979 13.612 -2.304 1.00 0.65 H new ATOM 0 HD13 ILE C 148 2.529 14.812 -1.110 1.00 0.65 H new ATOM 2192 N TYR C 149 0.207 14.896 1.561 1.00 0.33 N ATOM 2193 CA TYR C 149 -0.373 16.223 1.383 1.00 0.38 C ATOM 2194 C TYR C 149 0.060 17.142 2.522 1.00 0.45 C ATOM 2195 O TYR C 149 0.014 18.367 2.407 1.00 0.52 O ATOM 2196 CB TYR C 149 -1.900 16.125 1.324 1.00 0.42 C ATOM 2197 CG TYR C 149 -2.562 17.265 0.582 1.00 0.51 C ATOM 2198 CD1 TYR C 149 -2.667 17.249 -0.803 1.00 0.61 C ATOM 2199 CD2 TYR C 149 -3.086 18.355 1.266 1.00 0.68 C ATOM 2200 CE1 TYR C 149 -3.274 18.288 -1.486 1.00 0.75 C ATOM 2201 CE2 TYR C 149 -3.695 19.397 0.591 1.00 0.79 C ATOM 2202 CZ TYR C 149 -3.787 19.359 -0.785 1.00 0.77 C ATOM 2203 OH TYR C 149 -4.398 20.394 -1.460 1.00 0.93 O ATOM 0 H TYR C 149 -0.461 14.182 1.853 1.00 0.33 H new ATOM 0 HA TYR C 149 -0.015 16.644 0.443 1.00 0.38 H new ATOM 0 HB2 TYR C 149 -2.175 15.185 0.845 1.00 0.42 H new ATOM 0 HB3 TYR C 149 -2.291 16.091 2.341 1.00 0.42 H new ATOM 0 HD1 TYR C 149 -2.268 16.411 -1.356 1.00 0.61 H new ATOM 0 HD2 TYR C 149 -3.016 18.389 2.343 1.00 0.68 H new ATOM 0 HE1 TYR C 149 -3.346 18.260 -2.563 1.00 0.75 H new ATOM 0 HE2 TYR C 149 -4.097 20.237 1.139 1.00 0.79 H new ATOM 0 HH TYR C 149 -4.705 21.068 -0.818 1.00 0.93 H new ATOM 2213 N GLU C 150 0.488 16.535 3.618 1.00 0.49 N ATOM 2214 CA GLU C 150 0.941 17.282 4.775 1.00 0.59 C ATOM 2215 C GLU C 150 2.433 17.558 4.663 1.00 0.60 C ATOM 2216 O GLU C 150 2.883 18.680 4.885 1.00 0.70 O ATOM 2217 CB GLU C 150 0.648 16.513 6.065 1.00 0.66 C ATOM 2218 CG GLU C 150 -0.787 16.026 6.170 1.00 0.76 C ATOM 2219 CD GLU C 150 -1.267 15.947 7.601 1.00 1.13 C ATOM 2220 OE1 GLU C 150 -1.489 17.011 8.216 1.00 1.67 O ATOM 2221 OE2 GLU C 150 -1.434 14.821 8.118 1.00 1.48 O ATOM 0 H GLU C 150 0.530 15.522 3.728 1.00 0.49 H new ATOM 0 HA GLU C 150 0.402 18.229 4.807 1.00 0.59 H new ATOM 0 HB2 GLU C 150 1.319 15.656 6.128 1.00 0.66 H new ATOM 0 HB3 GLU C 150 0.869 17.154 6.918 1.00 0.66 H new ATOM 0 HG2 GLU C 150 -1.437 16.697 5.608 1.00 0.76 H new ATOM 0 HG3 GLU C 150 -0.868 15.042 5.708 1.00 0.76 H new ATOM 2228 N TRP C 151 3.190 16.529 4.296 1.00 0.52 N ATOM 2229 CA TRP C 151 4.637 16.641 4.150 1.00 0.54 C ATOM 2230 C TRP C 151 5.008 17.741 3.155 1.00 0.60 C ATOM 2231 O TRP C 151 5.954 18.502 3.379 1.00 0.68 O ATOM 2232 CB TRP C 151 5.222 15.300 3.697 1.00 0.46 C ATOM 2233 CG TRP C 151 6.719 15.261 3.715 1.00 0.50 C ATOM 2234 CD1 TRP C 151 7.557 15.608 2.695 1.00 0.55 C ATOM 2235 CD2 TRP C 151 7.557 14.845 4.802 1.00 0.56 C ATOM 2236 NE1 TRP C 151 8.864 15.442 3.082 1.00 0.63 N ATOM 2237 CE2 TRP C 151 8.890 14.972 4.370 1.00 0.63 C ATOM 2238 CE3 TRP C 151 7.307 14.380 6.099 1.00 0.62 C ATOM 2239 CZ2 TRP C 151 9.971 14.653 5.187 1.00 0.73 C ATOM 2240 CZ3 TRP C 151 8.384 14.063 6.909 1.00 0.73 C ATOM 2241 CH2 TRP C 151 9.700 14.200 6.448 1.00 0.77 C ATOM 0 H TRP C 151 2.821 15.600 4.093 1.00 0.52 H new ATOM 0 HA TRP C 151 5.058 16.908 5.119 1.00 0.54 H new ATOM 0 HB2 TRP C 151 4.839 14.510 4.342 1.00 0.46 H new ATOM 0 HB3 TRP C 151 4.874 15.084 2.687 1.00 0.46 H new ATOM 0 HD1 TRP C 151 7.239 15.961 1.725 1.00 0.55 H new ATOM 0 HE1 TRP C 151 9.682 15.637 2.505 1.00 0.63 H new ATOM 0 HE3 TRP C 151 6.295 14.271 6.460 1.00 0.62 H new ATOM 0 HZ2 TRP C 151 10.987 14.760 4.837 1.00 0.73 H new ATOM 0 HZ3 TRP C 151 8.207 13.704 7.912 1.00 0.73 H new ATOM 0 HH2 TRP C 151 10.519 13.942 7.104 1.00 0.77 H new ATOM 2252 N THR C 152 4.244 17.837 2.077 1.00 0.58 N ATOM 2253 CA THR C 152 4.493 18.833 1.045 1.00 0.65 C ATOM 2254 C THR C 152 4.296 20.252 1.574 1.00 0.75 C ATOM 2255 O THR C 152 5.052 21.156 1.241 1.00 0.85 O ATOM 2256 CB THR C 152 3.579 18.604 -0.171 1.00 0.62 C ATOM 2257 OG1 THR C 152 2.330 18.053 0.260 1.00 0.53 O ATOM 2258 CG2 THR C 152 4.235 17.664 -1.171 1.00 0.60 C ATOM 0 H THR C 152 3.442 17.234 1.894 1.00 0.58 H new ATOM 0 HA THR C 152 5.533 18.721 0.737 1.00 0.65 H new ATOM 0 HB THR C 152 3.407 19.564 -0.659 1.00 0.62 H new ATOM 0 HG1 THR C 152 2.380 17.074 0.242 1.00 0.53 H new ATOM 0 HG21 THR C 152 3.570 17.517 -2.022 1.00 0.60 H new ATOM 0 HG22 THR C 152 5.175 18.097 -1.515 1.00 0.60 H new ATOM 0 HG23 THR C 152 4.431 16.704 -0.694 1.00 0.60 H new ATOM 2266 N LYS C 153 3.300 20.442 2.424 1.00 0.77 N ATOM 2267 CA LYS C 153 3.026 21.762 2.983 1.00 0.87 C ATOM 2268 C LYS C 153 3.937 22.053 4.173 1.00 0.93 C ATOM 2269 O LYS C 153 4.183 23.210 4.511 1.00 1.04 O ATOM 2270 CB LYS C 153 1.561 21.872 3.407 1.00 0.87 C ATOM 2271 CG LYS C 153 0.575 21.717 2.258 1.00 0.83 C ATOM 2272 CD LYS C 153 -0.839 22.073 2.686 1.00 0.92 C ATOM 2273 CE LYS C 153 -1.378 21.092 3.716 1.00 0.90 C ATOM 2274 NZ LYS C 153 -2.355 21.731 4.630 1.00 1.14 N ATOM 0 H LYS C 153 2.670 19.706 2.742 1.00 0.77 H new ATOM 0 HA LYS C 153 3.226 22.501 2.207 1.00 0.87 H new ATOM 0 HB2 LYS C 153 1.352 21.110 4.158 1.00 0.87 H new ATOM 0 HB3 LYS C 153 1.402 22.840 3.882 1.00 0.87 H new ATOM 0 HG2 LYS C 153 0.877 22.357 1.429 1.00 0.83 H new ATOM 0 HG3 LYS C 153 0.598 20.690 1.893 1.00 0.83 H new ATOM 0 HD2 LYS C 153 -0.851 23.081 3.102 1.00 0.92 H new ATOM 0 HD3 LYS C 153 -1.492 22.081 1.814 1.00 0.92 H new ATOM 0 HE2 LYS C 153 -1.853 20.254 3.206 1.00 0.90 H new ATOM 0 HE3 LYS C 153 -0.551 20.684 4.297 1.00 0.90 H new ATOM 0 HZ1 LYS C 153 -2.698 21.029 5.317 1.00 1.14 H new ATOM 0 HZ2 LYS C 153 -1.896 22.515 5.136 1.00 1.14 H new ATOM 0 HZ3 LYS C 153 -3.157 22.098 4.079 1.00 1.14 H new ATOM 2288 N ILE C 154 4.438 20.999 4.799 1.00 0.88 N ATOM 2289 CA ILE C 154 5.318 21.133 5.954 1.00 0.95 C ATOM 2290 C ILE C 154 6.761 21.429 5.534 1.00 0.98 C ATOM 2291 O ILE C 154 7.394 22.343 6.064 1.00 1.10 O ATOM 2292 CB ILE C 154 5.274 19.857 6.833 1.00 0.91 C ATOM 2293 CG1 ILE C 154 3.975 19.818 7.647 1.00 0.91 C ATOM 2294 CG2 ILE C 154 6.488 19.775 7.755 1.00 1.02 C ATOM 2295 CD1 ILE C 154 3.801 18.550 8.455 1.00 0.90 C ATOM 0 H ILE C 154 4.250 20.035 4.526 1.00 0.88 H new ATOM 0 HA ILE C 154 4.955 21.978 6.539 1.00 0.95 H new ATOM 0 HB ILE C 154 5.301 18.991 6.172 1.00 0.91 H new ATOM 0 HG12 ILE C 154 3.954 20.674 8.322 1.00 0.91 H new ATOM 0 HG13 ILE C 154 3.128 19.925 6.969 1.00 0.91 H new ATOM 0 HG21 ILE C 154 6.427 18.869 8.358 1.00 1.02 H new ATOM 0 HG22 ILE C 154 7.399 19.752 7.156 1.00 1.02 H new ATOM 0 HG23 ILE C 154 6.507 20.646 8.410 1.00 1.02 H new ATOM 0 HD11 ILE C 154 2.860 18.595 9.004 1.00 0.90 H new ATOM 0 HD12 ILE C 154 3.790 17.690 7.785 1.00 0.90 H new ATOM 0 HD13 ILE C 154 4.628 18.451 9.159 1.00 0.90 H new ATOM 2307 N ASN C 155 7.272 20.672 4.572 1.00 0.93 N ATOM 2308 CA ASN C 155 8.648 20.851 4.121 1.00 0.96 C ATOM 2309 C ASN C 155 8.750 21.825 2.950 1.00 1.05 C ATOM 2310 O ASN C 155 9.791 22.450 2.746 1.00 1.16 O ATOM 2311 CB ASN C 155 9.261 19.500 3.751 1.00 0.90 C ATOM 2312 CG ASN C 155 9.720 18.722 4.973 1.00 0.86 C ATOM 2313 OD1 ASN C 155 10.890 18.771 5.353 1.00 1.13 O ATOM 2314 ND2 ASN C 155 8.801 18.004 5.605 1.00 0.90 N ATOM 0 H ASN C 155 6.760 19.933 4.091 1.00 0.93 H new ATOM 0 HA ASN C 155 9.209 21.286 4.948 1.00 0.96 H new ATOM 0 HB2 ASN C 155 8.528 18.909 3.201 1.00 0.90 H new ATOM 0 HB3 ASN C 155 10.109 19.658 3.084 1.00 0.90 H new ATOM 0 HD21 ASN C 155 9.054 17.468 6.435 1.00 0.90 H new ATOM 0 HD22 ASN C 155 7.841 17.988 5.261 1.00 0.90 H new ATOM 2321 N GLY C 156 7.682 21.954 2.179 1.00 1.07 N ATOM 2322 CA GLY C 156 7.701 22.866 1.052 1.00 1.18 C ATOM 2323 C GLY C 156 7.354 22.180 -0.251 1.00 1.12 C ATOM 2324 O GLY C 156 7.927 21.141 -0.585 1.00 1.47 O ATOM 0 H GLY C 156 6.806 21.448 2.311 1.00 1.07 H new ATOM 0 HA2 GLY C 156 6.995 23.676 1.232 1.00 1.18 H new ATOM 0 HA3 GLY C 156 8.690 23.317 0.970 1.00 1.18 H new ATOM 2328 N GLY C 157 6.415 22.760 -0.983 1.00 1.06 N ATOM 2329 CA GLY C 157 5.993 22.190 -2.244 1.00 1.02 C ATOM 2330 C GLY C 157 4.484 22.159 -2.371 1.00 0.95 C ATOM 2331 O GLY C 157 3.883 21.093 -2.493 1.00 1.21 O ATOM 0 H GLY C 157 5.935 23.622 -0.723 1.00 1.06 H new ATOM 0 HA2 GLY C 157 6.415 22.771 -3.064 1.00 1.02 H new ATOM 0 HA3 GLY C 157 6.386 21.177 -2.335 1.00 1.02 H new ATOM 2335 N SER C 158 3.870 23.334 -2.336 1.00 0.91 N ATOM 2336 CA SER C 158 2.421 23.443 -2.435 1.00 0.85 C ATOM 2337 C SER C 158 2.006 24.011 -3.790 1.00 0.93 C ATOM 2338 O SER C 158 2.270 25.179 -4.096 1.00 1.15 O ATOM 2339 CB SER C 158 1.889 24.326 -1.308 1.00 0.89 C ATOM 2340 OG SER C 158 2.392 23.898 -0.054 1.00 0.93 O ATOM 0 H SER C 158 4.354 24.227 -2.240 1.00 0.91 H new ATOM 0 HA SER C 158 1.994 22.445 -2.342 1.00 0.85 H new ATOM 0 HB2 SER C 158 2.176 25.362 -1.486 1.00 0.89 H new ATOM 0 HB3 SER C 158 0.800 24.294 -1.298 1.00 0.89 H new ATOM 0 HG SER C 158 2.041 24.477 0.654 1.00 0.93 H new ATOM 2346 N GLY C 159 1.342 23.186 -4.595 1.00 0.84 N ATOM 2347 CA GLY C 159 0.893 23.616 -5.909 1.00 0.93 C ATOM 2348 C GLY C 159 -0.506 24.203 -5.875 1.00 0.89 C ATOM 2349 O GLY C 159 -1.339 23.891 -6.721 1.00 0.98 O ATOM 0 H GLY C 159 1.106 22.222 -4.359 1.00 0.84 H new ATOM 0 HA2 GLY C 159 1.587 24.359 -6.303 1.00 0.93 H new ATOM 0 HA3 GLY C 159 0.912 22.768 -6.593 1.00 0.93 H new ATOM 2353 N GLY C 160 -0.763 25.048 -4.885 1.00 0.84 N ATOM 2354 CA GLY C 160 -2.068 25.666 -4.753 1.00 0.85 C ATOM 2355 C GLY C 160 -3.059 24.765 -4.044 1.00 0.82 C ATOM 2356 O GLY C 160 -2.700 23.684 -3.572 1.00 0.90 O ATOM 0 H GLY C 160 -0.088 25.317 -4.169 1.00 0.84 H new ATOM 0 HA2 GLY C 160 -1.971 26.601 -4.202 1.00 0.85 H new ATOM 0 HA3 GLY C 160 -2.451 25.917 -5.742 1.00 0.85 H new ATOM 2360 N SER C 161 -4.303 25.204 -3.964 1.00 0.78 N ATOM 2361 CA SER C 161 -5.342 24.427 -3.311 1.00 0.77 C ATOM 2362 C SER C 161 -6.124 23.617 -4.340 1.00 0.71 C ATOM 2363 O SER C 161 -7.294 23.892 -4.611 1.00 0.83 O ATOM 2364 CB SER C 161 -6.273 25.354 -2.531 1.00 0.85 C ATOM 2365 OG SER C 161 -5.529 26.326 -1.816 1.00 1.04 O ATOM 0 H SER C 161 -4.619 26.096 -4.344 1.00 0.78 H new ATOM 0 HA SER C 161 -4.879 23.731 -2.612 1.00 0.77 H new ATOM 0 HB2 SER C 161 -6.961 25.848 -3.217 1.00 0.85 H new ATOM 0 HB3 SER C 161 -6.879 24.770 -1.838 1.00 0.85 H new ATOM 0 HG SER C 161 -6.143 26.911 -1.324 1.00 1.04 H new ATOM 2371 N GLY C 162 -5.464 22.627 -4.925 1.00 0.68 N ATOM 2372 CA GLY C 162 -6.111 21.792 -5.916 1.00 0.67 C ATOM 2373 C GLY C 162 -5.314 21.702 -7.198 1.00 0.70 C ATOM 2374 O GLY C 162 -5.550 20.823 -8.024 1.00 0.78 O ATOM 0 H GLY C 162 -4.492 22.387 -4.731 1.00 0.68 H new ATOM 0 HA2 GLY C 162 -6.253 20.791 -5.508 1.00 0.67 H new ATOM 0 HA3 GLY C 162 -7.102 22.191 -6.134 1.00 0.67 H new ATOM 2378 N GLY C 163 -4.367 22.615 -7.361 1.00 0.73 N ATOM 2379 CA GLY C 163 -3.541 22.625 -8.553 1.00 0.80 C ATOM 2380 C GLY C 163 -2.561 21.469 -8.585 1.00 0.79 C ATOM 2381 O GLY C 163 -2.448 20.713 -7.619 1.00 0.79 O ATOM 0 H GLY C 163 -4.155 23.351 -6.688 1.00 0.73 H new ATOM 0 HA2 GLY C 163 -4.180 22.581 -9.435 1.00 0.80 H new ATOM 0 HA3 GLY C 163 -2.992 23.565 -8.604 1.00 0.80 H new ATOM 2385 N SER C 164 -1.859 21.325 -9.696 1.00 0.87 N ATOM 2386 CA SER C 164 -0.889 20.258 -9.845 1.00 0.90 C ATOM 2387 C SER C 164 0.404 20.605 -9.113 1.00 0.81 C ATOM 2388 O SER C 164 0.968 21.684 -9.308 1.00 0.93 O ATOM 2389 CB SER C 164 -0.615 20.000 -11.325 1.00 1.13 C ATOM 2390 OG SER C 164 -1.830 19.906 -12.053 1.00 1.30 O ATOM 0 H SER C 164 -1.944 21.936 -10.509 1.00 0.87 H new ATOM 0 HA SER C 164 -1.298 19.350 -9.403 1.00 0.90 H new ATOM 0 HB2 SER C 164 -0.003 20.805 -11.732 1.00 1.13 H new ATOM 0 HB3 SER C 164 -0.045 19.078 -11.439 1.00 1.13 H new ATOM 0 HG SER C 164 -1.633 19.742 -12.999 1.00 1.30 H new ATOM 2396 N GLY C 165 0.858 19.691 -8.264 1.00 0.76 N ATOM 2397 CA GLY C 165 2.076 19.911 -7.513 1.00 0.78 C ATOM 2398 C GLY C 165 3.320 19.626 -8.328 1.00 0.81 C ATOM 2399 O GLY C 165 3.420 20.032 -9.487 1.00 1.14 O ATOM 0 H GLY C 165 0.401 18.798 -8.083 1.00 0.76 H new ATOM 0 HA2 GLY C 165 2.103 20.943 -7.165 1.00 0.78 H new ATOM 0 HA3 GLY C 165 2.073 19.276 -6.627 1.00 0.78 H new ATOM 2403 N GLY C 166 4.263 18.910 -7.734 1.00 0.87 N ATOM 2404 CA GLY C 166 5.492 18.592 -8.429 1.00 0.96 C ATOM 2405 C GLY C 166 5.420 17.274 -9.170 1.00 0.98 C ATOM 2406 O GLY C 166 4.849 17.196 -10.260 1.00 1.12 O ATOM 0 H GLY C 166 4.199 18.544 -6.784 1.00 0.87 H new ATOM 0 HA2 GLY C 166 5.722 19.389 -9.136 1.00 0.96 H new ATOM 0 HA3 GLY C 166 6.312 18.556 -7.711 1.00 0.96 H new ATOM 2410 N ASP C 167 5.984 16.236 -8.574 1.00 0.97 N ATOM 2411 CA ASP C 167 5.999 14.914 -9.189 1.00 1.02 C ATOM 2412 C ASP C 167 5.417 13.875 -8.245 1.00 0.87 C ATOM 2413 O ASP C 167 5.201 14.147 -7.063 1.00 1.07 O ATOM 2414 CB ASP C 167 7.427 14.515 -9.565 1.00 1.25 C ATOM 2415 CG ASP C 167 7.515 13.892 -10.944 1.00 1.16 C ATOM 2416 OD1 ASP C 167 6.562 13.203 -11.359 1.00 1.44 O ATOM 2417 OD2 ASP C 167 8.548 14.093 -11.622 1.00 1.50 O ATOM 0 H ASP C 167 6.439 16.281 -7.662 1.00 0.97 H new ATOM 0 HA ASP C 167 5.388 14.957 -10.091 1.00 1.02 H new ATOM 0 HB2 ASP C 167 8.068 15.396 -9.527 1.00 1.25 H new ATOM 0 HB3 ASP C 167 7.809 13.810 -8.827 1.00 1.25 H new ATOM 2422 N VAL C 168 5.174 12.688 -8.775 1.00 0.75 N ATOM 2423 CA VAL C 168 4.624 11.590 -7.998 1.00 0.60 C ATOM 2424 C VAL C 168 4.967 10.264 -8.667 1.00 0.65 C ATOM 2425 O VAL C 168 4.950 10.161 -9.894 1.00 0.78 O ATOM 2426 CB VAL C 168 3.090 11.728 -7.823 1.00 0.61 C ATOM 2427 CG1 VAL C 168 2.364 11.598 -9.155 1.00 0.82 C ATOM 2428 CG2 VAL C 168 2.564 10.713 -6.817 1.00 0.58 C ATOM 0 H VAL C 168 5.352 12.459 -9.753 1.00 0.75 H new ATOM 0 HA VAL C 168 5.070 11.619 -7.004 1.00 0.60 H new ATOM 0 HB VAL C 168 2.891 12.727 -7.434 1.00 0.61 H new ATOM 0 HG11 VAL C 168 1.291 11.700 -8.996 1.00 0.82 H new ATOM 0 HG12 VAL C 168 2.706 12.380 -9.833 1.00 0.82 H new ATOM 0 HG13 VAL C 168 2.575 10.621 -9.591 1.00 0.82 H new ATOM 0 HG21 VAL C 168 1.485 10.830 -6.712 1.00 0.58 H new ATOM 0 HG22 VAL C 168 2.787 9.705 -7.167 1.00 0.58 H new ATOM 0 HG23 VAL C 168 3.042 10.876 -5.851 1.00 0.58 H new ATOM 2438 N MET C 169 5.306 9.260 -7.871 1.00 0.56 N ATOM 2439 CA MET C 169 5.666 7.959 -8.414 1.00 0.60 C ATOM 2440 C MET C 169 4.850 6.851 -7.769 1.00 0.56 C ATOM 2441 O MET C 169 4.216 7.051 -6.731 1.00 0.53 O ATOM 2442 CB MET C 169 7.161 7.694 -8.219 1.00 0.64 C ATOM 2443 CG MET C 169 8.047 8.583 -9.075 1.00 1.02 C ATOM 2444 SD MET C 169 9.807 8.334 -8.763 1.00 1.10 S ATOM 2445 CE MET C 169 10.502 9.658 -9.751 1.00 1.55 C ATOM 0 H MET C 169 5.339 9.321 -6.853 1.00 0.56 H new ATOM 0 HA MET C 169 5.444 7.968 -9.481 1.00 0.60 H new ATOM 0 HB2 MET C 169 7.415 7.843 -7.170 1.00 0.64 H new ATOM 0 HB3 MET C 169 7.371 6.650 -8.453 1.00 0.64 H new ATOM 0 HG2 MET C 169 7.839 8.389 -10.127 1.00 1.02 H new ATOM 0 HG3 MET C 169 7.794 9.627 -8.888 1.00 1.02 H new ATOM 0 HE1 MET C 169 11.574 9.499 -9.871 1.00 1.55 H new ATOM 0 HE2 MET C 169 10.025 9.670 -10.731 1.00 1.55 H new ATOM 0 HE3 MET C 169 10.331 10.612 -9.253 1.00 1.55 H new ATOM 2455 N VAL C 170 4.859 5.692 -8.402 1.00 0.61 N ATOM 2456 CA VAL C 170 4.132 4.533 -7.910 1.00 0.60 C ATOM 2457 C VAL C 170 5.114 3.420 -7.564 1.00 0.63 C ATOM 2458 O VAL C 170 6.033 3.142 -8.340 1.00 0.73 O ATOM 2459 CB VAL C 170 3.121 4.026 -8.965 1.00 0.65 C ATOM 2460 CG1 VAL C 170 2.288 2.879 -8.419 1.00 0.65 C ATOM 2461 CG2 VAL C 170 2.218 5.160 -9.439 1.00 0.68 C ATOM 0 H VAL C 170 5.369 5.526 -9.270 1.00 0.61 H new ATOM 0 HA VAL C 170 3.580 4.827 -7.017 1.00 0.60 H new ATOM 0 HB VAL C 170 3.690 3.657 -9.818 1.00 0.65 H new ATOM 0 HG11 VAL C 170 1.586 2.543 -9.183 1.00 0.65 H new ATOM 0 HG12 VAL C 170 2.943 2.054 -8.140 1.00 0.65 H new ATOM 0 HG13 VAL C 170 1.736 3.216 -7.542 1.00 0.65 H new ATOM 0 HG21 VAL C 170 1.515 4.780 -10.180 1.00 0.68 H new ATOM 0 HG22 VAL C 170 1.666 5.565 -8.590 1.00 0.68 H new ATOM 0 HG23 VAL C 170 2.826 5.947 -9.885 1.00 0.68 H new ATOM 2471 N VAL C 171 4.939 2.801 -6.399 1.00 0.57 N ATOM 2472 CA VAL C 171 5.824 1.720 -5.977 1.00 0.62 C ATOM 2473 C VAL C 171 5.700 0.532 -6.920 1.00 0.77 C ATOM 2474 O VAL C 171 4.600 0.031 -7.167 1.00 0.89 O ATOM 2475 CB VAL C 171 5.544 1.250 -4.530 1.00 0.61 C ATOM 2476 CG1 VAL C 171 6.339 2.073 -3.531 1.00 1.03 C ATOM 2477 CG2 VAL C 171 4.059 1.314 -4.212 1.00 0.91 C ATOM 0 H VAL C 171 4.198 3.027 -5.735 1.00 0.57 H new ATOM 0 HA VAL C 171 6.837 2.121 -6.008 1.00 0.62 H new ATOM 0 HB VAL C 171 5.863 0.211 -4.450 1.00 0.61 H new ATOM 0 HG11 VAL C 171 6.126 1.724 -2.521 1.00 1.03 H new ATOM 0 HG12 VAL C 171 7.404 1.964 -3.735 1.00 1.03 H new ATOM 0 HG13 VAL C 171 6.059 3.123 -3.619 1.00 1.03 H new ATOM 0 HG21 VAL C 171 3.891 0.978 -3.189 1.00 0.91 H new ATOM 0 HG22 VAL C 171 3.708 2.340 -4.319 1.00 0.91 H new ATOM 0 HG23 VAL C 171 3.512 0.670 -4.900 1.00 0.91 H new ATOM 2487 N GLY C 172 6.833 0.100 -7.455 1.00 0.81 N ATOM 2488 CA GLY C 172 6.843 -1.018 -8.372 1.00 0.96 C ATOM 2489 C GLY C 172 6.715 -2.352 -7.662 1.00 0.99 C ATOM 2490 O GLY C 172 6.543 -2.402 -6.442 1.00 1.04 O ATOM 0 H GLY C 172 7.749 0.507 -7.268 1.00 0.81 H new ATOM 0 HA2 GLY C 172 6.024 -0.908 -9.083 1.00 0.96 H new ATOM 0 HA3 GLY C 172 7.769 -1.004 -8.948 1.00 0.96 H new ATOM 2494 N GLU C 173 6.810 -3.430 -8.427 1.00 1.04 N ATOM 2495 CA GLU C 173 6.705 -4.776 -7.881 1.00 1.10 C ATOM 2496 C GLU C 173 7.897 -5.097 -6.974 1.00 1.06 C ATOM 2497 O GLU C 173 8.977 -4.513 -7.121 1.00 1.05 O ATOM 2498 CB GLU C 173 6.606 -5.798 -9.018 1.00 1.25 C ATOM 2499 CG GLU C 173 7.786 -5.777 -9.979 1.00 1.53 C ATOM 2500 CD GLU C 173 7.616 -6.741 -11.139 1.00 1.63 C ATOM 2501 OE1 GLU C 173 6.753 -7.643 -11.055 1.00 1.96 O ATOM 2502 OE2 GLU C 173 8.342 -6.597 -12.147 1.00 1.72 O ATOM 0 H GLU C 173 6.961 -3.398 -9.435 1.00 1.04 H new ATOM 0 HA GLU C 173 5.800 -4.831 -7.276 1.00 1.10 H new ATOM 0 HB2 GLU C 173 6.519 -6.796 -8.588 1.00 1.25 H new ATOM 0 HB3 GLU C 173 5.691 -5.612 -9.580 1.00 1.25 H new ATOM 0 HG2 GLU C 173 7.914 -4.767 -10.368 1.00 1.53 H new ATOM 0 HG3 GLU C 173 8.697 -6.027 -9.435 1.00 1.53 H new ATOM 2509 N PRO C 174 7.703 -6.006 -6.000 1.00 1.09 N ATOM 2510 CA PRO C 174 8.764 -6.411 -5.073 1.00 1.08 C ATOM 2511 C PRO C 174 9.906 -7.128 -5.785 1.00 1.15 C ATOM 2512 O PRO C 174 9.680 -8.009 -6.621 1.00 1.34 O ATOM 2513 CB PRO C 174 8.058 -7.362 -4.102 1.00 1.15 C ATOM 2514 CG PRO C 174 6.858 -7.845 -4.840 1.00 1.30 C ATOM 2515 CD PRO C 174 6.433 -6.703 -5.718 1.00 1.17 C ATOM 0 HA PRO C 174 9.223 -5.553 -4.583 1.00 1.08 H new ATOM 0 HB2 PRO C 174 8.707 -8.191 -3.819 1.00 1.15 H new ATOM 0 HB3 PRO C 174 7.776 -6.849 -3.182 1.00 1.15 H new ATOM 0 HG2 PRO C 174 7.093 -8.729 -5.433 1.00 1.30 H new ATOM 0 HG3 PRO C 174 6.062 -8.126 -4.151 1.00 1.30 H new ATOM 0 HD2 PRO C 174 5.954 -7.054 -6.632 1.00 1.17 H new ATOM 0 HD3 PRO C 174 5.719 -6.051 -5.214 1.00 1.17 H new ATOM 2523 N THR C 175 11.125 -6.737 -5.460 1.00 1.04 N ATOM 2524 CA THR C 175 12.300 -7.339 -6.057 1.00 1.11 C ATOM 2525 C THR C 175 12.501 -8.751 -5.519 1.00 1.12 C ATOM 2526 O THR C 175 12.649 -8.948 -4.314 1.00 1.05 O ATOM 2527 CB THR C 175 13.559 -6.498 -5.774 1.00 1.07 C ATOM 2528 OG1 THR C 175 13.241 -5.096 -5.846 1.00 1.03 O ATOM 2529 CG2 THR C 175 14.661 -6.820 -6.772 1.00 1.30 C ATOM 0 H THR C 175 11.326 -6.002 -4.782 1.00 1.04 H new ATOM 0 HA THR C 175 12.143 -7.379 -7.135 1.00 1.11 H new ATOM 0 HB THR C 175 13.912 -6.742 -4.772 1.00 1.07 H new ATOM 0 HG1 THR C 175 12.842 -4.807 -4.999 1.00 1.03 H new ATOM 0 HG21 THR C 175 15.540 -6.214 -6.552 1.00 1.30 H new ATOM 0 HG22 THR C 175 14.921 -7.876 -6.699 1.00 1.30 H new ATOM 0 HG23 THR C 175 14.313 -6.601 -7.782 1.00 1.30 H new