USER MOD reduce.3.24.130724 H: found=0, std=0, add=1188, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1177 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: C 122 CYS SG : rot 142:sc= 1.72 USER MOD Set 1.2: C 125 CYS SG : rot -43:sc= 0.0724 USER MOD Set 1.3: C 144 CYS SG : rot -138:sc= -0.52! USER MOD Set 1.4: C 146 GLN :FLIP amide:sc= -0.551 F(o=-0.5!,f=0.72) USER MOD Set 2.1: C 111 LYS NZ :NH3+ -150:sc= 0 (180deg=0) USER MOD Set 2.2: C 169 MET CE :methyl 173:sc= -0.062 (180deg=-0.119) USER MOD Set 3.1: C 94 CYS SG : rot 149:sc= 0.757 USER MOD Set 3.2: C 97 CYS SG : rot -50:sc= 0.108 USER MOD Set 3.3: C 116 HIS : no HD1:sc= 0.121 K(o=-1.9,f=-3.1) USER MOD Set 3.4: C 119 CYS SG : rot 137:sc= -2.86! USER MOD Set 4.1: B 11 CYS SG : rot -169:sc= 0.531 USER MOD Set 4.2: B 14 CYS SG : rot -170:sc= -0.531 USER MOD Set 4.3: B 27 HIS : no HE2:sc= -1.27! C(o=-0.95!,f=-6.2!) USER MOD Set 4.4: B 32 CYS SG : rot -40:sc= 0.325 USER MOD Set 5.1: A 231 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 235 ASN : amide:sc= 0.808 K(o=0.91,f=-0.99) USER MOD Set 5.3: A 237 GLN : amide:sc= 0.0969 K(o=0.91,f=-5.6!) USER MOD Set 6.1: A 204 CYS SG : rot 147:sc= 1.75 USER MOD Set 6.2: A 207 CYS SG : rot -46:sc= 0.554! USER MOD Set 6.3: A 225 CYS SG : rot 180:sc= 1.6! USER MOD Set 6.4: A 228 CYS SG : rot 74:sc= -1.78! USER MOD Single : A 206 ASN : amide:sc= -0.0476 X(o=-0.048,f=-0.43) USER MOD Single : A 210 THR OG1 : rot -45:sc= 0.403 USER MOD Single : A 212 THR OG1 : rot 171:sc= 0.385 USER MOD Single : A 220 THR OG1 : rot -82:sc= 1.07 USER MOD Single : A 222 HIS : no HD1:sc= -0.644 K(o=-0.64,f=-6.3!) USER MOD Single : A 223 TYR OH : rot -93:sc= 1.74 USER MOD Single : A 226 ASN : amide:sc= 0.556 K(o=0.56,f=-3.9!) USER MOD Single : A 232 HIS : no HE2:sc= -0.882 X(o=-0.88,f=-1.1) USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 MET CE :methyl 161:sc= -0.149 (180deg=-0.688) USER MOD Single : A 238 ASN : amide:sc= 1.26 K(o=1.3,f=-0.0086) USER MOD Single : B 1 GLY N :NH3+ -116:sc= 0.149 (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 -162:sc= 0 (180deg=-0.0698) USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 93:sc= 1.21 USER MOD Single : B 22 SER OG : rot 94:sc= 0.0476 USER MOD Single : B 23 THR OG1 : rot -170:sc= -2.57! USER MOD Single : B 28 GLN : amide:sc= -1.13 X(o=-1.1,f=-0.67) USER MOD Single : B 30 TYR OH : rot -140:sc= 1.3 USER MOD Single : B 31 TYR OH : rot -175:sc= 1.24 USER MOD Single : B 33 SER OG : rot 180:sc= 0 USER MOD Single : B 34 HIS : no HD1:sc= -0.18 X(o=-0.18,f=-0.039) USER MOD Single : C 96 SER OG : rot 71:sc= 1.23 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 180:sc= 0 USER MOD Single : C 108 MET CE :methyl 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 150:sc= -0.149 USER MOD Single : C 121 LYS NZ :NH3+ -157:sc= 0.431 (180deg=-0.26) USER MOD Single : C 126 GLN : amide:sc= 0.746 K(o=0.75,f=-0.016) USER MOD Single : C 127 LYS NZ :NH3+ -121:sc= 0.558 (180deg=-0.35) USER MOD Single : C 128 HIS : +bothHN:sc= 0.717 K(o=0.72,f=-5.9!) USER MOD Single : C 130 SER OG : rot -90:sc= -1.82! USER MOD Single : C 135 TYR OH : rot 180:sc= 0 USER MOD Single : C 139 ASN : amide:sc= -0.01 K(o=-0.01,f=-0.53) USER MOD Single : C 140 SER OG : rot 180:sc= 0.0358 USER MOD Single : C 149 TYR OH : rot 180:sc=-0.00454 USER MOD Single : C 152 THR OG1 : rot -92:sc= 1.23 USER MOD Single : C 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 155 ASN : amide:sc= -0.396 X(o=-0.4,f=-0.024) USER MOD Single : C 158 SER OG : rot 180:sc= -0.0444 USER MOD Single : C 161 SER OG : rot 180:sc= 0.0808 USER MOD Single : C 164 SER OG : rot 180:sc= 0 USER MOD Single : C 175 THR OG1 : rot 74:sc= 0.868 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 200 -5.789 6.562 8.216 1.00 0.91 N ATOM 2 CA GLU A 200 -5.491 5.139 7.927 1.00 0.71 C ATOM 3 C GLU A 200 -4.950 4.986 6.513 1.00 0.62 C ATOM 4 O GLU A 200 -5.104 5.883 5.687 1.00 0.70 O ATOM 5 CB GLU A 200 -6.748 4.286 8.099 1.00 0.79 C ATOM 6 CG GLU A 200 -7.198 4.156 9.545 1.00 0.88 C ATOM 7 CD GLU A 200 -6.086 3.684 10.459 1.00 1.29 C ATOM 8 OE1 GLU A 200 -5.248 4.520 10.856 1.00 1.61 O ATOM 9 OE2 GLU A 200 -6.047 2.481 10.783 1.00 1.63 O ATOM 0 HA GLU A 200 -4.734 4.797 8.632 1.00 0.71 H new ATOM 0 HB2 GLU A 200 -7.557 4.722 7.513 1.00 0.79 H new ATOM 0 HB3 GLU A 200 -6.561 3.291 7.694 1.00 0.79 H new ATOM 0 HG2 GLU A 200 -7.567 5.120 9.895 1.00 0.88 H new ATOM 0 HG3 GLU A 200 -8.032 3.456 9.601 1.00 0.88 H new ATOM 18 N ALA A 201 -4.321 3.850 6.239 1.00 0.56 N ATOM 19 CA ALA A 201 -3.750 3.600 4.924 1.00 0.57 C ATOM 20 C ALA A 201 -4.811 3.148 3.924 1.00 0.57 C ATOM 21 O ALA A 201 -5.304 3.945 3.126 1.00 0.89 O ATOM 22 CB ALA A 201 -2.634 2.574 5.023 1.00 0.62 C ATOM 0 H ALA A 201 -4.194 3.090 6.908 1.00 0.56 H new ATOM 0 HA ALA A 201 -3.336 4.539 4.556 1.00 0.57 H new ATOM 0 HB1 ALA A 201 -2.215 2.396 4.033 1.00 0.62 H new ATOM 0 HB2 ALA A 201 -1.853 2.948 5.685 1.00 0.62 H new ATOM 0 HB3 ALA A 201 -3.032 1.641 5.422 1.00 0.62 H new ATOM 28 N ARG A 202 -5.177 1.875 3.981 1.00 0.40 N ATOM 29 CA ARG A 202 -6.165 1.333 3.062 1.00 0.35 C ATOM 30 C ARG A 202 -7.228 0.556 3.825 1.00 0.33 C ATOM 31 O ARG A 202 -7.107 0.351 5.032 1.00 0.33 O ATOM 32 CB ARG A 202 -5.489 0.428 2.028 1.00 0.37 C ATOM 33 CG ARG A 202 -6.013 0.615 0.611 1.00 0.36 C ATOM 34 CD ARG A 202 -5.255 1.706 -0.132 1.00 0.28 C ATOM 35 NE ARG A 202 -5.568 3.042 0.370 1.00 0.46 N ATOM 36 CZ ARG A 202 -5.084 4.169 -0.148 1.00 0.44 C ATOM 37 NH1 ARG A 202 -4.230 4.141 -1.159 1.00 0.42 N ATOM 38 NH2 ARG A 202 -5.427 5.338 0.369 1.00 0.72 N ATOM 0 H ARG A 202 -4.806 1.202 4.651 1.00 0.40 H new ATOM 0 HA ARG A 202 -6.645 2.161 2.541 1.00 0.35 H new ATOM 0 HB2 ARG A 202 -4.416 0.620 2.037 1.00 0.37 H new ATOM 0 HB3 ARG A 202 -5.629 -0.612 2.323 1.00 0.37 H new ATOM 0 HG2 ARG A 202 -5.927 -0.324 0.065 1.00 0.36 H new ATOM 0 HG3 ARG A 202 -7.073 0.868 0.646 1.00 0.36 H new ATOM 0 HD2 ARG A 202 -4.184 1.528 -0.040 1.00 0.28 H new ATOM 0 HD3 ARG A 202 -5.496 1.654 -1.194 1.00 0.28 H new ATOM 0 HE ARG A 202 -6.198 3.116 1.169 1.00 0.46 H new ATOM 0 HH11 ARG A 202 -3.934 3.247 -1.552 1.00 0.42 H new ATOM 0 HH12 ARG A 202 -3.868 5.013 -1.545 1.00 0.42 H new ATOM 0 HH21 ARG A 202 -6.063 5.376 1.165 1.00 0.72 H new ATOM 0 HH22 ARG A 202 -5.055 6.200 -0.029 1.00 0.72 H new ATOM 52 N GLU A 203 -8.262 0.136 3.116 1.00 0.37 N ATOM 53 CA GLU A 203 -9.355 -0.616 3.713 1.00 0.39 C ATOM 54 C GLU A 203 -9.451 -2.003 3.083 1.00 0.37 C ATOM 55 O GLU A 203 -8.857 -2.252 2.034 1.00 0.36 O ATOM 56 CB GLU A 203 -10.682 0.131 3.515 1.00 0.48 C ATOM 57 CG GLU A 203 -10.521 1.600 3.136 1.00 0.49 C ATOM 58 CD GLU A 203 -10.456 1.825 1.632 1.00 0.51 C ATOM 59 OE1 GLU A 203 -9.401 1.548 1.020 1.00 0.55 O ATOM 60 OE2 GLU A 203 -11.457 2.298 1.058 1.00 0.53 O ATOM 0 H GLU A 203 -8.368 0.305 2.116 1.00 0.37 H new ATOM 0 HA GLU A 203 -9.158 -0.722 4.780 1.00 0.39 H new ATOM 0 HB2 GLU A 203 -11.257 -0.372 2.738 1.00 0.48 H new ATOM 0 HB3 GLU A 203 -11.264 0.066 4.435 1.00 0.48 H new ATOM 0 HG2 GLU A 203 -11.355 2.169 3.547 1.00 0.49 H new ATOM 0 HG3 GLU A 203 -9.613 1.990 3.595 1.00 0.49 H new ATOM 67 N CYS A 204 -10.185 -2.900 3.737 1.00 0.39 N ATOM 68 CA CYS A 204 -10.387 -4.250 3.230 1.00 0.39 C ATOM 69 C CYS A 204 -11.816 -4.376 2.728 1.00 0.42 C ATOM 70 O CYS A 204 -12.712 -3.674 3.204 1.00 0.54 O ATOM 71 CB CYS A 204 -10.124 -5.299 4.322 1.00 0.41 C ATOM 72 SG CYS A 204 -10.273 -7.038 3.772 1.00 0.46 S ATOM 0 H CYS A 204 -10.651 -2.712 4.624 1.00 0.39 H new ATOM 0 HA CYS A 204 -9.684 -4.430 2.417 1.00 0.39 H new ATOM 0 HB2 CYS A 204 -9.121 -5.144 4.720 1.00 0.41 H new ATOM 0 HB3 CYS A 204 -10.822 -5.131 5.142 1.00 0.41 H new ATOM 0 HG CYS A 204 -9.431 -7.776 4.433 1.00 0.46 H new ATOM 77 N VAL A 205 -12.029 -5.268 1.781 1.00 0.38 N ATOM 78 CA VAL A 205 -13.351 -5.468 1.216 1.00 0.40 C ATOM 79 C VAL A 205 -14.244 -6.245 2.174 1.00 0.48 C ATOM 80 O VAL A 205 -15.473 -6.197 2.072 1.00 0.52 O ATOM 81 CB VAL A 205 -13.289 -6.223 -0.131 1.00 0.38 C ATOM 82 CG1 VAL A 205 -12.340 -5.535 -1.101 1.00 0.36 C ATOM 83 CG2 VAL A 205 -12.885 -7.678 0.073 1.00 0.47 C ATOM 0 H VAL A 205 -11.304 -5.867 1.386 1.00 0.38 H new ATOM 0 HA VAL A 205 -13.771 -4.476 1.047 1.00 0.40 H new ATOM 0 HB VAL A 205 -14.289 -6.206 -0.564 1.00 0.38 H new ATOM 0 HG11 VAL A 205 -12.316 -6.088 -2.040 1.00 0.36 H new ATOM 0 HG12 VAL A 205 -12.684 -4.518 -1.287 1.00 0.36 H new ATOM 0 HG13 VAL A 205 -11.339 -5.506 -0.671 1.00 0.36 H new ATOM 0 HG21 VAL A 205 -12.850 -8.184 -0.892 1.00 0.47 H new ATOM 0 HG22 VAL A 205 -11.902 -7.720 0.541 1.00 0.47 H new ATOM 0 HG23 VAL A 205 -13.614 -8.171 0.715 1.00 0.47 H new ATOM 93 N ASN A 206 -13.628 -6.937 3.124 1.00 0.51 N ATOM 94 CA ASN A 206 -14.385 -7.750 4.061 1.00 0.60 C ATOM 95 C ASN A 206 -14.182 -7.325 5.513 1.00 0.63 C ATOM 96 O ASN A 206 -15.040 -7.595 6.355 1.00 0.72 O ATOM 97 CB ASN A 206 -14.017 -9.220 3.888 1.00 0.65 C ATOM 98 CG ASN A 206 -15.233 -10.117 3.766 1.00 0.79 C ATOM 99 OD1 ASN A 206 -16.285 -9.848 4.348 1.00 0.88 O ATOM 100 ND2 ASN A 206 -15.098 -11.193 3.004 1.00 1.26 N ATOM 0 H ASN A 206 -12.618 -6.951 3.264 1.00 0.51 H new ATOM 0 HA ASN A 206 -15.441 -7.601 3.833 1.00 0.60 H new ATOM 0 HB2 ASN A 206 -13.397 -9.333 2.999 1.00 0.65 H new ATOM 0 HB3 ASN A 206 -13.417 -9.543 4.739 1.00 0.65 H new ATOM 0 HD21 ASN A 206 -15.882 -11.834 2.883 1.00 1.26 H new ATOM 0 HD22 ASN A 206 -14.210 -11.380 2.539 1.00 1.26 H new ATOM 107 N CYS A 207 -13.067 -6.670 5.829 1.00 0.57 N ATOM 108 CA CYS A 207 -12.842 -6.243 7.203 1.00 0.61 C ATOM 109 C CYS A 207 -12.336 -4.793 7.280 1.00 0.58 C ATOM 110 O CYS A 207 -13.131 -3.860 7.398 1.00 0.62 O ATOM 111 CB CYS A 207 -11.909 -7.232 7.938 1.00 0.63 C ATOM 112 SG CYS A 207 -10.143 -7.193 7.471 1.00 0.55 S ATOM 0 H CYS A 207 -12.325 -6.430 5.171 1.00 0.57 H new ATOM 0 HA CYS A 207 -13.802 -6.255 7.719 1.00 0.61 H new ATOM 0 HB2 CYS A 207 -11.983 -7.038 9.008 1.00 0.63 H new ATOM 0 HB3 CYS A 207 -12.283 -8.242 7.770 1.00 0.63 H new ATOM 0 HG CYS A 207 -10.037 -7.182 6.175 1.00 0.55 H new ATOM 117 N GLY A 208 -11.033 -4.614 7.218 1.00 0.54 N ATOM 118 CA GLY A 208 -10.452 -3.291 7.284 1.00 0.52 C ATOM 119 C GLY A 208 -9.220 -3.250 8.160 1.00 0.49 C ATOM 120 O GLY A 208 -8.881 -2.205 8.715 1.00 0.52 O ATOM 0 H GLY A 208 -10.356 -5.370 7.122 1.00 0.54 H new ATOM 0 HA2 GLY A 208 -10.192 -2.960 6.279 1.00 0.52 H new ATOM 0 HA3 GLY A 208 -11.193 -2.590 7.669 1.00 0.52 H new ATOM 124 N ALA A 209 -8.547 -4.387 8.291 1.00 0.47 N ATOM 125 CA ALA A 209 -7.348 -4.471 9.113 1.00 0.46 C ATOM 126 C ALA A 209 -6.122 -4.013 8.334 1.00 0.42 C ATOM 127 O ALA A 209 -5.558 -4.763 7.539 1.00 0.41 O ATOM 128 CB ALA A 209 -7.155 -5.893 9.625 1.00 0.49 C ATOM 0 H ALA A 209 -8.812 -5.262 7.839 1.00 0.47 H new ATOM 0 HA ALA A 209 -7.473 -3.807 9.968 1.00 0.46 H new ATOM 0 HB1 ALA A 209 -6.255 -5.940 10.238 1.00 0.49 H new ATOM 0 HB2 ALA A 209 -8.018 -6.184 10.224 1.00 0.49 H new ATOM 0 HB3 ALA A 209 -7.054 -6.574 8.780 1.00 0.49 H new ATOM 134 N THR A 210 -5.701 -2.781 8.573 1.00 0.45 N ATOM 135 CA THR A 210 -4.541 -2.227 7.889 1.00 0.48 C ATOM 136 C THR A 210 -3.245 -2.637 8.592 1.00 0.47 C ATOM 137 O THR A 210 -2.151 -2.204 8.213 1.00 0.47 O ATOM 138 CB THR A 210 -4.632 -0.684 7.770 1.00 0.61 C ATOM 139 OG1 THR A 210 -3.576 -0.186 6.934 1.00 0.67 O ATOM 140 CG2 THR A 210 -4.560 -0.017 9.133 1.00 0.70 C ATOM 0 H THR A 210 -6.145 -2.145 9.235 1.00 0.45 H new ATOM 0 HA THR A 210 -4.531 -2.638 6.879 1.00 0.48 H new ATOM 0 HB THR A 210 -5.596 -0.444 7.321 1.00 0.61 H new ATOM 0 HG1 THR A 210 -2.731 -0.613 7.185 1.00 0.67 H new ATOM 0 HG21 THR A 210 -4.627 1.064 9.013 1.00 0.70 H new ATOM 0 HG22 THR A 210 -5.387 -0.365 9.752 1.00 0.70 H new ATOM 0 HG23 THR A 210 -3.615 -0.271 9.613 1.00 0.70 H new ATOM 148 N ALA A 211 -3.380 -3.495 9.598 1.00 0.49 N ATOM 149 CA ALA A 211 -2.234 -3.991 10.352 1.00 0.52 C ATOM 150 C ALA A 211 -1.480 -5.048 9.551 1.00 0.44 C ATOM 151 O ALA A 211 -0.409 -5.503 9.955 1.00 0.44 O ATOM 152 CB ALA A 211 -2.683 -4.561 11.686 1.00 0.64 C ATOM 0 H ALA A 211 -4.278 -3.863 9.912 1.00 0.49 H new ATOM 0 HA ALA A 211 -1.560 -3.155 10.540 1.00 0.52 H new ATOM 0 HB1 ALA A 211 -1.816 -4.927 12.236 1.00 0.64 H new ATOM 0 HB2 ALA A 211 -3.179 -3.783 12.266 1.00 0.64 H new ATOM 0 HB3 ALA A 211 -3.377 -5.384 11.515 1.00 0.64 H new ATOM 158 N THR A 212 -2.061 -5.442 8.419 1.00 0.42 N ATOM 159 CA THR A 212 -1.453 -6.425 7.535 1.00 0.41 C ATOM 160 C THR A 212 -0.111 -5.899 7.028 1.00 0.37 C ATOM 161 O THR A 212 0.036 -4.695 6.806 1.00 0.34 O ATOM 162 CB THR A 212 -2.385 -6.754 6.337 1.00 0.40 C ATOM 163 OG1 THR A 212 -1.766 -7.701 5.458 1.00 0.46 O ATOM 164 CG2 THR A 212 -2.740 -5.494 5.556 1.00 0.30 C ATOM 0 H THR A 212 -2.961 -5.089 8.093 1.00 0.42 H new ATOM 0 HA THR A 212 -1.294 -7.344 8.099 1.00 0.41 H new ATOM 0 HB THR A 212 -3.300 -7.186 6.743 1.00 0.40 H new ATOM 0 HG1 THR A 212 -2.418 -8.003 4.791 1.00 0.46 H new ATOM 0 HG21 THR A 212 -3.393 -5.754 4.723 1.00 0.30 H new ATOM 0 HG22 THR A 212 -3.252 -4.791 6.213 1.00 0.30 H new ATOM 0 HG23 THR A 212 -1.829 -5.035 5.173 1.00 0.30 H new ATOM 172 N PRO A 213 0.892 -6.779 6.861 1.00 0.45 N ATOM 173 CA PRO A 213 2.222 -6.378 6.391 1.00 0.49 C ATOM 174 C PRO A 213 2.184 -5.783 4.989 1.00 0.49 C ATOM 175 O PRO A 213 2.954 -4.877 4.665 1.00 0.56 O ATOM 176 CB PRO A 213 3.027 -7.684 6.400 1.00 0.59 C ATOM 177 CG PRO A 213 2.006 -8.771 6.385 1.00 0.62 C ATOM 178 CD PRO A 213 0.815 -8.227 7.120 1.00 0.55 C ATOM 0 HA PRO A 213 2.654 -5.600 7.021 1.00 0.49 H new ATOM 0 HB2 PRO A 213 3.684 -7.748 5.532 1.00 0.59 H new ATOM 0 HB3 PRO A 213 3.660 -7.750 7.285 1.00 0.59 H new ATOM 0 HG2 PRO A 213 1.743 -9.045 5.364 1.00 0.62 H new ATOM 0 HG3 PRO A 213 2.386 -9.671 6.869 1.00 0.62 H new ATOM 0 HD2 PRO A 213 -0.117 -8.653 6.748 1.00 0.55 H new ATOM 0 HD3 PRO A 213 0.864 -8.449 8.186 1.00 0.55 H new ATOM 186 N LEU A 214 1.272 -6.285 4.168 1.00 0.43 N ATOM 187 CA LEU A 214 1.130 -5.818 2.799 1.00 0.44 C ATOM 188 C LEU A 214 -0.261 -6.145 2.276 1.00 0.39 C ATOM 189 O LEU A 214 -0.709 -7.286 2.370 1.00 0.46 O ATOM 190 CB LEU A 214 2.191 -6.472 1.906 1.00 0.53 C ATOM 191 CG LEU A 214 2.272 -5.940 0.476 1.00 0.63 C ATOM 192 CD1 LEU A 214 2.874 -4.546 0.462 1.00 0.74 C ATOM 193 CD2 LEU A 214 3.088 -6.884 -0.394 1.00 0.74 C ATOM 0 H LEU A 214 0.616 -7.021 4.430 1.00 0.43 H new ATOM 0 HA LEU A 214 1.270 -4.737 2.781 1.00 0.44 H new ATOM 0 HB2 LEU A 214 3.165 -6.344 2.378 1.00 0.53 H new ATOM 0 HB3 LEU A 214 1.995 -7.543 1.865 1.00 0.53 H new ATOM 0 HG LEU A 214 1.263 -5.882 0.069 1.00 0.63 H new ATOM 0 HD11 LEU A 214 2.925 -4.182 -0.564 1.00 0.74 H new ATOM 0 HD12 LEU A 214 2.252 -3.875 1.055 1.00 0.74 H new ATOM 0 HD13 LEU A 214 3.878 -4.579 0.885 1.00 0.74 H new ATOM 0 HD21 LEU A 214 3.137 -6.492 -1.410 1.00 0.74 H new ATOM 0 HD22 LEU A 214 4.096 -6.971 0.010 1.00 0.74 H new ATOM 0 HD23 LEU A 214 2.616 -7.866 -0.407 1.00 0.74 H new ATOM 205 N TRP A 215 -0.943 -5.152 1.733 1.00 0.31 N ATOM 206 CA TRP A 215 -2.277 -5.360 1.199 1.00 0.27 C ATOM 207 C TRP A 215 -2.212 -6.235 -0.046 1.00 0.32 C ATOM 208 O TRP A 215 -1.422 -5.983 -0.959 1.00 0.40 O ATOM 209 CB TRP A 215 -2.940 -4.024 0.874 1.00 0.25 C ATOM 210 CG TRP A 215 -3.377 -3.266 2.088 1.00 0.28 C ATOM 211 CD1 TRP A 215 -2.699 -2.268 2.731 1.00 0.36 C ATOM 212 CD2 TRP A 215 -4.596 -3.453 2.813 1.00 0.31 C ATOM 213 NE1 TRP A 215 -3.427 -1.823 3.809 1.00 0.41 N ATOM 214 CE2 TRP A 215 -4.594 -2.536 3.877 1.00 0.38 C ATOM 215 CE3 TRP A 215 -5.686 -4.306 2.660 1.00 0.37 C ATOM 216 CZ2 TRP A 215 -5.643 -2.452 4.786 1.00 0.45 C ATOM 217 CZ3 TRP A 215 -6.728 -4.222 3.562 1.00 0.46 C ATOM 218 CH2 TRP A 215 -6.700 -3.299 4.613 1.00 0.48 C ATOM 0 H TRP A 215 -0.596 -4.196 1.650 1.00 0.31 H new ATOM 0 HA TRP A 215 -2.878 -5.866 1.954 1.00 0.27 H new ATOM 0 HB2 TRP A 215 -2.243 -3.410 0.303 1.00 0.25 H new ATOM 0 HB3 TRP A 215 -3.805 -4.202 0.235 1.00 0.25 H new ATOM 0 HD1 TRP A 215 -1.733 -1.885 2.435 1.00 0.36 H new ATOM 0 HE1 TRP A 215 -3.144 -1.084 4.452 1.00 0.41 H new ATOM 0 HE3 TRP A 215 -5.716 -5.020 1.850 1.00 0.37 H new ATOM 0 HZ2 TRP A 215 -5.622 -1.742 5.600 1.00 0.45 H new ATOM 0 HZ3 TRP A 215 -7.578 -4.879 3.454 1.00 0.46 H new ATOM 0 HH2 TRP A 215 -7.531 -3.256 5.301 1.00 0.48 H new ATOM 229 N ARG A 216 -3.030 -7.271 -0.069 1.00 0.33 N ATOM 230 CA ARG A 216 -3.069 -8.193 -1.192 1.00 0.39 C ATOM 231 C ARG A 216 -3.948 -7.629 -2.300 1.00 0.37 C ATOM 232 O ARG A 216 -5.102 -8.023 -2.456 1.00 0.46 O ATOM 233 CB ARG A 216 -3.593 -9.564 -0.751 1.00 0.46 C ATOM 234 CG ARG A 216 -2.532 -10.474 -0.149 1.00 0.55 C ATOM 235 CD ARG A 216 -2.117 -10.022 1.243 1.00 0.57 C ATOM 236 NE ARG A 216 -1.304 -11.029 1.921 1.00 0.55 N ATOM 237 CZ ARG A 216 -0.038 -10.852 2.291 1.00 0.73 C ATOM 238 NH1 ARG A 216 0.551 -9.672 2.133 1.00 1.02 N ATOM 239 NH2 ARG A 216 0.626 -11.846 2.857 1.00 0.80 N ATOM 0 H ARG A 216 -3.681 -7.497 0.683 1.00 0.33 H new ATOM 0 HA ARG A 216 -2.054 -8.318 -1.570 1.00 0.39 H new ATOM 0 HB2 ARG A 216 -4.388 -9.418 -0.020 1.00 0.46 H new ATOM 0 HB3 ARG A 216 -4.039 -10.064 -1.611 1.00 0.46 H new ATOM 0 HG2 ARG A 216 -2.914 -11.494 -0.100 1.00 0.55 H new ATOM 0 HG3 ARG A 216 -1.658 -10.492 -0.800 1.00 0.55 H new ATOM 0 HD2 ARG A 216 -1.556 -9.090 1.170 1.00 0.57 H new ATOM 0 HD3 ARG A 216 -3.006 -9.813 1.837 1.00 0.57 H new ATOM 0 HE ARG A 216 -1.737 -11.930 2.125 1.00 0.55 H new ATOM 0 HH11 ARG A 216 0.033 -8.894 1.726 1.00 1.02 H new ATOM 0 HH12 ARG A 216 1.522 -9.544 2.419 1.00 1.02 H new ATOM 0 HH21 ARG A 216 0.168 -12.745 3.009 1.00 0.80 H new ATOM 0 HH22 ARG A 216 1.596 -11.714 3.142 1.00 0.80 H new ATOM 253 N ARG A 217 -3.403 -6.682 -3.045 1.00 0.38 N ATOM 254 CA ARG A 217 -4.129 -6.057 -4.137 1.00 0.39 C ATOM 255 C ARG A 217 -3.913 -6.827 -5.433 1.00 0.44 C ATOM 256 O ARG A 217 -2.815 -7.319 -5.701 1.00 0.50 O ATOM 257 CB ARG A 217 -3.674 -4.606 -4.312 1.00 0.43 C ATOM 258 CG ARG A 217 -4.531 -3.812 -5.283 1.00 0.45 C ATOM 259 CD ARG A 217 -3.690 -3.107 -6.337 1.00 0.43 C ATOM 260 NE ARG A 217 -3.713 -1.655 -6.178 1.00 0.52 N ATOM 261 CZ ARG A 217 -4.092 -0.801 -7.129 1.00 1.07 C ATOM 262 NH1 ARG A 217 -4.530 -1.249 -8.303 1.00 1.43 N ATOM 263 NH2 ARG A 217 -4.040 0.504 -6.899 1.00 1.46 N ATOM 0 H ARG A 217 -2.456 -6.328 -2.912 1.00 0.38 H new ATOM 0 HA ARG A 217 -5.192 -6.071 -3.895 1.00 0.39 H new ATOM 0 HB2 ARG A 217 -3.686 -4.111 -3.341 1.00 0.43 H new ATOM 0 HB3 ARG A 217 -2.641 -4.598 -4.661 1.00 0.43 H new ATOM 0 HG2 ARG A 217 -5.240 -4.480 -5.772 1.00 0.45 H new ATOM 0 HG3 ARG A 217 -5.115 -3.075 -4.732 1.00 0.45 H new ATOM 0 HD2 ARG A 217 -2.661 -3.462 -6.276 1.00 0.43 H new ATOM 0 HD3 ARG A 217 -4.059 -3.368 -7.329 1.00 0.43 H new ATOM 0 HE ARG A 217 -3.420 -1.269 -5.280 1.00 0.52 H new ATOM 0 HH11 ARG A 217 -4.578 -2.252 -8.480 1.00 1.43 H new ATOM 0 HH12 ARG A 217 -4.818 -0.589 -9.025 1.00 1.43 H new ATOM 0 HH21 ARG A 217 -3.711 0.850 -5.998 1.00 1.46 H new ATOM 0 HH22 ARG A 217 -4.329 1.161 -7.623 1.00 1.46 H new ATOM 277 N ASP A 218 -4.972 -6.944 -6.220 1.00 0.44 N ATOM 278 CA ASP A 218 -4.907 -7.638 -7.499 1.00 0.50 C ATOM 279 C ASP A 218 -4.740 -6.625 -8.632 1.00 0.54 C ATOM 280 O ASP A 218 -4.467 -5.447 -8.388 1.00 0.57 O ATOM 281 CB ASP A 218 -6.174 -8.476 -7.724 1.00 0.51 C ATOM 282 CG ASP A 218 -7.323 -7.657 -8.279 1.00 0.51 C ATOM 283 OD1 ASP A 218 -7.743 -6.693 -7.615 1.00 0.48 O ATOM 284 OD2 ASP A 218 -7.791 -7.955 -9.398 1.00 0.59 O ATOM 0 H ASP A 218 -5.892 -6.565 -5.994 1.00 0.44 H new ATOM 0 HA ASP A 218 -4.048 -8.308 -7.488 1.00 0.50 H new ATOM 0 HB2 ASP A 218 -5.949 -9.292 -8.411 1.00 0.51 H new ATOM 0 HB3 ASP A 218 -6.478 -8.929 -6.780 1.00 0.51 H new ATOM 289 N ARG A 219 -4.912 -7.085 -9.864 1.00 0.60 N ATOM 290 CA ARG A 219 -4.782 -6.232 -11.038 1.00 0.65 C ATOM 291 C ARG A 219 -5.874 -5.157 -11.085 1.00 0.63 C ATOM 292 O ARG A 219 -5.610 -4.012 -11.458 1.00 0.68 O ATOM 293 CB ARG A 219 -4.839 -7.090 -12.303 1.00 0.72 C ATOM 294 CG ARG A 219 -4.926 -6.295 -13.595 1.00 0.86 C ATOM 295 CD ARG A 219 -5.144 -7.214 -14.781 1.00 0.94 C ATOM 296 NE ARG A 219 -5.408 -6.470 -16.008 1.00 0.91 N ATOM 297 CZ ARG A 219 -6.217 -6.897 -16.978 1.00 1.12 C ATOM 298 NH1 ARG A 219 -6.862 -8.051 -16.859 1.00 1.57 N ATOM 299 NH2 ARG A 219 -6.391 -6.163 -18.065 1.00 1.34 N ATOM 0 H ARG A 219 -5.144 -8.055 -10.077 1.00 0.60 H new ATOM 0 HA ARG A 219 -3.821 -5.722 -10.979 1.00 0.65 H new ATOM 0 HB2 ARG A 219 -3.952 -7.723 -12.339 1.00 0.72 H new ATOM 0 HB3 ARG A 219 -5.702 -7.753 -12.239 1.00 0.72 H new ATOM 0 HG2 ARG A 219 -5.744 -5.577 -13.531 1.00 0.86 H new ATOM 0 HG3 ARG A 219 -4.009 -5.722 -13.737 1.00 0.86 H new ATOM 0 HD2 ARG A 219 -4.264 -7.842 -14.920 1.00 0.94 H new ATOM 0 HD3 ARG A 219 -5.981 -7.881 -14.574 1.00 0.94 H new ATOM 0 HE ARG A 219 -4.946 -5.569 -16.131 1.00 0.91 H new ATOM 0 HH11 ARG A 219 -6.741 -8.619 -16.020 1.00 1.57 H new ATOM 0 HH12 ARG A 219 -7.479 -8.370 -17.606 1.00 1.57 H new ATOM 0 HH21 ARG A 219 -5.906 -5.271 -18.161 1.00 1.34 H new ATOM 0 HH22 ARG A 219 -7.010 -6.490 -18.807 1.00 1.34 H new ATOM 313 N THR A 220 -7.093 -5.517 -10.702 1.00 0.59 N ATOM 314 CA THR A 220 -8.197 -4.568 -10.734 1.00 0.62 C ATOM 315 C THR A 220 -8.076 -3.542 -9.608 1.00 0.58 C ATOM 316 O THR A 220 -8.198 -2.338 -9.840 1.00 0.70 O ATOM 317 CB THR A 220 -9.573 -5.269 -10.676 1.00 0.65 C ATOM 318 OG1 THR A 220 -9.696 -6.061 -9.488 1.00 0.82 O ATOM 319 CG2 THR A 220 -9.773 -6.148 -11.904 1.00 0.90 C ATOM 0 H THR A 220 -7.340 -6.449 -10.369 1.00 0.59 H new ATOM 0 HA THR A 220 -8.133 -4.047 -11.690 1.00 0.62 H new ATOM 0 HB THR A 220 -10.342 -4.497 -10.659 1.00 0.65 H new ATOM 0 HG1 THR A 220 -9.257 -6.926 -9.625 1.00 0.82 H new ATOM 0 HG21 THR A 220 -10.747 -6.635 -11.848 1.00 0.90 H new ATOM 0 HG22 THR A 220 -9.725 -5.533 -12.803 1.00 0.90 H new ATOM 0 HG23 THR A 220 -8.990 -6.906 -11.941 1.00 0.90 H new ATOM 327 N GLY A 221 -7.828 -4.013 -8.394 1.00 0.47 N ATOM 328 CA GLY A 221 -7.687 -3.107 -7.274 1.00 0.44 C ATOM 329 C GLY A 221 -8.376 -3.600 -6.019 1.00 0.41 C ATOM 330 O GLY A 221 -8.720 -2.807 -5.145 1.00 0.43 O ATOM 0 H GLY A 221 -7.722 -5.002 -8.166 1.00 0.47 H new ATOM 0 HA2 GLY A 221 -6.627 -2.960 -7.065 1.00 0.44 H new ATOM 0 HA3 GLY A 221 -8.096 -2.135 -7.548 1.00 0.44 H new ATOM 334 N HIS A 222 -8.581 -4.907 -5.926 1.00 0.41 N ATOM 335 CA HIS A 222 -9.224 -5.495 -4.762 1.00 0.41 C ATOM 336 C HIS A 222 -8.259 -5.498 -3.587 1.00 0.37 C ATOM 337 O HIS A 222 -7.392 -6.362 -3.491 1.00 0.42 O ATOM 338 CB HIS A 222 -9.681 -6.929 -5.060 1.00 0.48 C ATOM 339 CG HIS A 222 -11.150 -7.052 -5.322 1.00 0.60 C ATOM 340 ND1 HIS A 222 -11.910 -8.106 -4.857 1.00 0.75 N ATOM 341 CD2 HIS A 222 -11.999 -6.259 -6.019 1.00 0.72 C ATOM 342 CE1 HIS A 222 -13.157 -7.952 -5.249 1.00 0.90 C ATOM 343 NE2 HIS A 222 -13.239 -6.842 -5.951 1.00 0.90 N ATOM 0 H HIS A 222 -8.311 -5.579 -6.644 1.00 0.41 H new ATOM 0 HA HIS A 222 -10.100 -4.896 -4.512 1.00 0.41 H new ATOM 0 HB2 HIS A 222 -9.134 -7.302 -5.926 1.00 0.48 H new ATOM 0 HB3 HIS A 222 -9.417 -7.567 -4.217 1.00 0.48 H new ATOM 0 HD2 HIS A 222 -11.747 -5.342 -6.531 1.00 0.72 H new ATOM 0 HE1 HIS A 222 -13.975 -8.623 -5.031 1.00 0.90 H new ATOM 0 HE2 HIS A 222 -14.089 -6.474 -6.377 1.00 0.90 H new ATOM 352 N TYR A 223 -8.388 -4.508 -2.717 1.00 0.33 N ATOM 353 CA TYR A 223 -7.526 -4.413 -1.552 1.00 0.29 C ATOM 354 C TYR A 223 -8.011 -5.354 -0.461 1.00 0.31 C ATOM 355 O TYR A 223 -9.067 -5.144 0.133 1.00 0.33 O ATOM 356 CB TYR A 223 -7.467 -2.975 -1.037 1.00 0.28 C ATOM 357 CG TYR A 223 -6.507 -2.101 -1.813 1.00 0.32 C ATOM 358 CD1 TYR A 223 -5.133 -2.269 -1.683 1.00 0.45 C ATOM 359 CD2 TYR A 223 -6.968 -1.112 -2.675 1.00 0.40 C ATOM 360 CE1 TYR A 223 -4.248 -1.480 -2.391 1.00 0.58 C ATOM 361 CE2 TYR A 223 -6.086 -0.317 -3.385 1.00 0.54 C ATOM 362 CZ TYR A 223 -4.728 -0.506 -3.238 1.00 0.60 C ATOM 363 OH TYR A 223 -3.844 0.279 -3.946 1.00 0.78 O ATOM 0 H TYR A 223 -9.079 -3.762 -2.796 1.00 0.33 H new ATOM 0 HA TYR A 223 -6.518 -4.709 -1.843 1.00 0.29 H new ATOM 0 HB2 TYR A 223 -8.465 -2.538 -1.084 1.00 0.28 H new ATOM 0 HB3 TYR A 223 -7.172 -2.984 0.012 1.00 0.28 H new ATOM 0 HD1 TYR A 223 -4.752 -3.029 -1.017 1.00 0.45 H new ATOM 0 HD2 TYR A 223 -8.031 -0.962 -2.792 1.00 0.40 H new ATOM 0 HE1 TYR A 223 -3.184 -1.626 -2.281 1.00 0.58 H new ATOM 0 HE2 TYR A 223 -6.459 0.447 -4.051 1.00 0.54 H new ATOM 0 HH TYR A 223 -3.652 1.095 -3.439 1.00 0.78 H new ATOM 373 N LEU A 224 -7.245 -6.409 -0.239 1.00 0.33 N ATOM 374 CA LEU A 224 -7.572 -7.399 0.772 1.00 0.37 C ATOM 375 C LEU A 224 -6.459 -7.459 1.808 1.00 0.36 C ATOM 376 O LEU A 224 -5.281 -7.420 1.450 1.00 0.34 O ATOM 377 CB LEU A 224 -7.754 -8.774 0.122 1.00 0.42 C ATOM 378 CG LEU A 224 -8.704 -8.812 -1.079 1.00 0.48 C ATOM 379 CD1 LEU A 224 -8.062 -9.559 -2.242 1.00 0.52 C ATOM 380 CD2 LEU A 224 -10.027 -9.458 -0.691 1.00 0.61 C ATOM 0 H LEU A 224 -6.384 -6.602 -0.751 1.00 0.33 H new ATOM 0 HA LEU A 224 -8.504 -7.115 1.261 1.00 0.37 H new ATOM 0 HB2 LEU A 224 -6.778 -9.138 -0.197 1.00 0.42 H new ATOM 0 HB3 LEU A 224 -8.122 -9.468 0.877 1.00 0.42 H new ATOM 0 HG LEU A 224 -8.903 -7.788 -1.396 1.00 0.48 H new ATOM 0 HD11 LEU A 224 -8.750 -9.577 -3.087 1.00 0.52 H new ATOM 0 HD12 LEU A 224 -7.141 -9.055 -2.534 1.00 0.52 H new ATOM 0 HD13 LEU A 224 -7.835 -10.581 -1.937 1.00 0.52 H new ATOM 0 HD21 LEU A 224 -10.690 -9.477 -1.556 1.00 0.61 H new ATOM 0 HD22 LEU A 224 -9.848 -10.477 -0.349 1.00 0.61 H new ATOM 0 HD23 LEU A 224 -10.492 -8.883 0.110 1.00 0.61 H new ATOM 392 N CYS A 225 -6.833 -7.532 3.081 1.00 0.38 N ATOM 393 CA CYS A 225 -5.865 -7.590 4.170 1.00 0.38 C ATOM 394 C CYS A 225 -4.880 -8.741 3.972 1.00 0.41 C ATOM 395 O CYS A 225 -3.718 -8.542 3.607 1.00 0.39 O ATOM 396 CB CYS A 225 -6.611 -7.772 5.494 1.00 0.43 C ATOM 397 SG CYS A 225 -7.768 -9.184 5.497 1.00 0.51 S ATOM 0 H CYS A 225 -7.806 -7.552 3.385 1.00 0.38 H new ATOM 0 HA CYS A 225 -5.298 -6.659 4.183 1.00 0.38 H new ATOM 0 HB2 CYS A 225 -5.884 -7.908 6.295 1.00 0.43 H new ATOM 0 HB3 CYS A 225 -7.164 -6.860 5.717 1.00 0.43 H new ATOM 0 HG CYS A 225 -8.353 -9.263 6.655 1.00 0.51 H new ATOM 402 N ASN A 226 -5.375 -9.938 4.227 1.00 0.47 N ATOM 403 CA ASN A 226 -4.614 -11.170 4.096 1.00 0.51 C ATOM 404 C ASN A 226 -5.531 -12.345 4.390 1.00 0.59 C ATOM 405 O ASN A 226 -5.491 -13.367 3.710 1.00 0.64 O ATOM 406 CB ASN A 226 -3.422 -11.192 5.059 1.00 0.51 C ATOM 407 CG ASN A 226 -2.496 -12.374 4.818 1.00 0.54 C ATOM 408 OD1 ASN A 226 -2.386 -12.879 3.698 1.00 0.63 O ATOM 409 ND2 ASN A 226 -1.820 -12.817 5.864 1.00 0.68 N ATOM 0 H ASN A 226 -6.335 -10.086 4.537 1.00 0.47 H new ATOM 0 HA ASN A 226 -4.225 -11.236 3.080 1.00 0.51 H new ATOM 0 HB2 ASN A 226 -2.857 -10.266 4.953 1.00 0.51 H new ATOM 0 HB3 ASN A 226 -3.789 -11.226 6.085 1.00 0.51 H new ATOM 0 HD21 ASN A 226 -1.179 -13.604 5.761 1.00 0.68 H new ATOM 0 HD22 ASN A 226 -1.939 -12.372 6.774 1.00 0.68 H new ATOM 416 N ALA A 227 -6.380 -12.174 5.399 1.00 0.61 N ATOM 417 CA ALA A 227 -7.319 -13.214 5.794 1.00 0.68 C ATOM 418 C ALA A 227 -8.466 -13.300 4.797 1.00 0.68 C ATOM 419 O ALA A 227 -8.730 -14.359 4.227 1.00 0.73 O ATOM 420 CB ALA A 227 -7.845 -12.945 7.194 1.00 0.70 C ATOM 0 H ALA A 227 -6.435 -11.323 5.958 1.00 0.61 H new ATOM 0 HA ALA A 227 -6.798 -14.171 5.800 1.00 0.68 H new ATOM 0 HB1 ALA A 227 -8.546 -13.730 7.476 1.00 0.70 H new ATOM 0 HB2 ALA A 227 -7.013 -12.930 7.899 1.00 0.70 H new ATOM 0 HB3 ALA A 227 -8.353 -11.981 7.213 1.00 0.70 H new ATOM 426 N CYS A 228 -9.142 -12.176 4.576 1.00 0.64 N ATOM 427 CA CYS A 228 -10.252 -12.134 3.633 1.00 0.65 C ATOM 428 C CYS A 228 -9.736 -12.288 2.202 1.00 0.64 C ATOM 429 O CYS A 228 -10.482 -12.636 1.289 1.00 0.69 O ATOM 430 CB CYS A 228 -11.031 -10.824 3.774 1.00 0.62 C ATOM 431 SG CYS A 228 -11.192 -10.209 5.486 1.00 0.62 S ATOM 0 H CYS A 228 -8.941 -11.287 5.035 1.00 0.64 H new ATOM 0 HA CYS A 228 -10.925 -12.962 3.857 1.00 0.65 H new ATOM 0 HB2 CYS A 228 -10.540 -10.059 3.173 1.00 0.62 H new ATOM 0 HB3 CYS A 228 -12.029 -10.964 3.358 1.00 0.62 H new ATOM 0 HG CYS A 228 -10.054 -9.720 5.880 1.00 0.62 H new ATOM 436 N GLY A 229 -8.443 -12.035 2.028 1.00 0.61 N ATOM 437 CA GLY A 229 -7.822 -12.149 0.722 1.00 0.63 C ATOM 438 C GLY A 229 -7.826 -13.572 0.200 1.00 0.69 C ATOM 439 O GLY A 229 -7.830 -13.799 -1.009 1.00 0.70 O ATOM 0 H GLY A 229 -7.810 -11.751 2.775 1.00 0.61 H new ATOM 0 HA2 GLY A 229 -8.347 -11.505 0.016 1.00 0.63 H new ATOM 0 HA3 GLY A 229 -6.795 -11.789 0.779 1.00 0.63 H new ATOM 443 N LEU A 230 -7.851 -14.532 1.116 1.00 0.74 N ATOM 444 CA LEU A 230 -7.851 -15.942 0.748 1.00 0.82 C ATOM 445 C LEU A 230 -9.175 -16.336 0.098 1.00 0.83 C ATOM 446 O LEU A 230 -9.270 -17.366 -0.568 1.00 0.90 O ATOM 447 CB LEU A 230 -7.587 -16.812 1.977 1.00 0.90 C ATOM 448 CG LEU A 230 -6.270 -16.533 2.705 1.00 0.95 C ATOM 449 CD1 LEU A 230 -6.157 -17.393 3.955 1.00 1.09 C ATOM 450 CD2 LEU A 230 -5.084 -16.778 1.782 1.00 0.98 C ATOM 0 H LEU A 230 -7.872 -14.359 2.121 1.00 0.74 H new ATOM 0 HA LEU A 230 -7.053 -16.103 0.023 1.00 0.82 H new ATOM 0 HB2 LEU A 230 -8.408 -16.676 2.681 1.00 0.90 H new ATOM 0 HB3 LEU A 230 -7.599 -17.858 1.671 1.00 0.90 H new ATOM 0 HG LEU A 230 -6.262 -15.485 3.005 1.00 0.95 H new ATOM 0 HD11 LEU A 230 -5.214 -17.180 4.459 1.00 1.09 H new ATOM 0 HD12 LEU A 230 -6.986 -17.169 4.627 1.00 1.09 H new ATOM 0 HD13 LEU A 230 -6.190 -18.446 3.676 1.00 1.09 H new ATOM 0 HD21 LEU A 230 -4.157 -16.574 2.318 1.00 0.98 H new ATOM 0 HD22 LEU A 230 -5.090 -17.816 1.450 1.00 0.98 H new ATOM 0 HD23 LEU A 230 -5.155 -16.119 0.916 1.00 0.98 H new ATOM 462 N TYR A 231 -10.190 -15.500 0.276 1.00 0.79 N ATOM 463 CA TYR A 231 -11.509 -15.757 -0.289 1.00 0.82 C ATOM 464 C TYR A 231 -11.458 -15.731 -1.815 1.00 0.80 C ATOM 465 O TYR A 231 -12.201 -16.450 -2.484 1.00 0.85 O ATOM 466 CB TYR A 231 -12.508 -14.714 0.218 1.00 0.79 C ATOM 467 CG TYR A 231 -13.832 -15.294 0.667 1.00 0.90 C ATOM 468 CD1 TYR A 231 -13.883 -16.324 1.598 1.00 1.04 C ATOM 469 CD2 TYR A 231 -15.030 -14.804 0.163 1.00 0.96 C ATOM 470 CE1 TYR A 231 -15.091 -16.851 2.010 1.00 1.19 C ATOM 471 CE2 TYR A 231 -16.242 -15.327 0.570 1.00 1.11 C ATOM 472 CZ TYR A 231 -16.267 -16.350 1.494 1.00 1.20 C ATOM 473 OH TYR A 231 -17.471 -16.873 1.902 1.00 1.38 O ATOM 0 H TYR A 231 -10.124 -14.634 0.810 1.00 0.79 H new ATOM 0 HA TYR A 231 -11.833 -16.748 0.029 1.00 0.82 H new ATOM 0 HB2 TYR A 231 -12.060 -14.172 1.051 1.00 0.79 H new ATOM 0 HB3 TYR A 231 -12.691 -13.987 -0.573 1.00 0.79 H new ATOM 0 HD1 TYR A 231 -12.964 -16.718 2.006 1.00 1.04 H new ATOM 0 HD2 TYR A 231 -15.014 -14.001 -0.559 1.00 0.96 H new ATOM 0 HE1 TYR A 231 -15.114 -17.652 2.734 1.00 1.19 H new ATOM 0 HE2 TYR A 231 -17.165 -14.937 0.167 1.00 1.11 H new ATOM 0 HH TYR A 231 -18.202 -16.408 1.444 1.00 1.38 H new ATOM 483 N HIS A 232 -10.547 -14.931 -2.357 1.00 0.74 N ATOM 484 CA HIS A 232 -10.393 -14.794 -3.801 1.00 0.73 C ATOM 485 C HIS A 232 -9.507 -15.903 -4.368 1.00 0.75 C ATOM 486 O HIS A 232 -9.152 -15.884 -5.545 1.00 0.77 O ATOM 487 CB HIS A 232 -9.785 -13.426 -4.132 1.00 0.73 C ATOM 488 CG HIS A 232 -10.170 -12.888 -5.480 1.00 0.73 C ATOM 489 ND1 HIS A 232 -9.645 -13.366 -6.663 1.00 0.95 N ATOM 490 CD2 HIS A 232 -11.020 -11.892 -5.827 1.00 0.74 C ATOM 491 CE1 HIS A 232 -10.152 -12.684 -7.675 1.00 0.95 C ATOM 492 NE2 HIS A 232 -10.988 -11.786 -7.196 1.00 0.78 N ATOM 0 H HIS A 232 -9.898 -14.363 -1.813 1.00 0.74 H new ATOM 0 HA HIS A 232 -11.379 -14.876 -4.258 1.00 0.73 H new ATOM 0 HB2 HIS A 232 -10.091 -12.711 -3.368 1.00 0.73 H new ATOM 0 HB3 HIS A 232 -8.699 -13.502 -4.081 1.00 0.73 H new ATOM 0 HD1 HIS A 232 -8.971 -14.127 -6.744 1.00 0.95 H new ATOM 0 HD2 HIS A 232 -11.613 -11.292 -5.152 1.00 0.74 H new ATOM 0 HE1 HIS A 232 -9.920 -12.837 -8.719 1.00 0.95 H new ATOM 501 N LYS A 233 -9.145 -16.866 -3.531 1.00 0.80 N ATOM 502 CA LYS A 233 -8.292 -17.965 -3.970 1.00 0.84 C ATOM 503 C LYS A 233 -8.823 -19.313 -3.485 1.00 0.87 C ATOM 504 O LYS A 233 -9.160 -20.179 -4.291 1.00 0.94 O ATOM 505 CB LYS A 233 -6.860 -17.749 -3.467 1.00 0.85 C ATOM 506 CG LYS A 233 -5.802 -17.918 -4.546 1.00 0.83 C ATOM 507 CD LYS A 233 -5.731 -19.350 -5.040 1.00 0.94 C ATOM 508 CE LYS A 233 -4.818 -19.482 -6.244 1.00 1.08 C ATOM 509 NZ LYS A 233 -4.797 -20.875 -6.762 1.00 1.28 N ATOM 0 H LYS A 233 -9.425 -16.910 -2.551 1.00 0.80 H new ATOM 0 HA LYS A 233 -8.294 -17.979 -5.060 1.00 0.84 H new ATOM 0 HB2 LYS A 233 -6.780 -16.747 -3.045 1.00 0.85 H new ATOM 0 HB3 LYS A 233 -6.658 -18.452 -2.659 1.00 0.85 H new ATOM 0 HG2 LYS A 233 -6.025 -17.255 -5.382 1.00 0.83 H new ATOM 0 HG3 LYS A 233 -4.830 -17.620 -4.153 1.00 0.83 H new ATOM 0 HD2 LYS A 233 -5.371 -19.995 -4.238 1.00 0.94 H new ATOM 0 HD3 LYS A 233 -6.731 -19.695 -5.302 1.00 0.94 H new ATOM 0 HE2 LYS A 233 -5.152 -18.805 -7.031 1.00 1.08 H new ATOM 0 HE3 LYS A 233 -3.807 -19.179 -5.970 1.00 1.08 H new ATOM 0 HZ1 LYS A 233 -4.163 -20.930 -7.585 1.00 1.28 H new ATOM 0 HZ2 LYS A 233 -4.455 -21.517 -6.018 1.00 1.28 H new ATOM 0 HZ3 LYS A 233 -5.758 -21.154 -7.046 1.00 1.28 H new ATOM 523 N MET A 234 -8.910 -19.475 -2.169 1.00 0.86 N ATOM 524 CA MET A 234 -9.385 -20.721 -1.569 1.00 0.91 C ATOM 525 C MET A 234 -10.817 -21.022 -1.996 1.00 0.99 C ATOM 526 O MET A 234 -11.122 -22.123 -2.453 1.00 1.09 O ATOM 527 CB MET A 234 -9.301 -20.646 -0.042 1.00 0.88 C ATOM 528 CG MET A 234 -9.641 -21.957 0.652 1.00 0.92 C ATOM 529 SD MET A 234 -8.523 -23.302 0.205 1.00 1.07 S ATOM 530 CE MET A 234 -6.944 -22.614 0.695 1.00 1.14 C ATOM 0 H MET A 234 -8.656 -18.755 -1.492 1.00 0.86 H new ATOM 0 HA MET A 234 -8.743 -21.528 -1.921 1.00 0.91 H new ATOM 0 HB2 MET A 234 -8.293 -20.344 0.244 1.00 0.88 H new ATOM 0 HB3 MET A 234 -9.979 -19.870 0.313 1.00 0.88 H new ATOM 0 HG2 MET A 234 -9.609 -21.809 1.731 1.00 0.92 H new ATOM 0 HG3 MET A 234 -10.662 -22.242 0.399 1.00 0.92 H new ATOM 0 HE1 MET A 234 -6.215 -23.417 0.802 1.00 1.14 H new ATOM 0 HE2 MET A 234 -6.601 -21.912 -0.065 1.00 1.14 H new ATOM 0 HE3 MET A 234 -7.053 -22.094 1.646 1.00 1.14 H new ATOM 540 N ASN A 235 -11.691 -20.040 -1.846 1.00 0.96 N ATOM 541 CA ASN A 235 -13.082 -20.210 -2.235 1.00 1.04 C ATOM 542 C ASN A 235 -13.256 -19.853 -3.704 1.00 1.06 C ATOM 543 O ASN A 235 -14.156 -20.357 -4.376 1.00 1.20 O ATOM 544 CB ASN A 235 -14.001 -19.345 -1.368 1.00 1.02 C ATOM 545 CG ASN A 235 -14.422 -20.043 -0.087 1.00 1.15 C ATOM 546 OD1 ASN A 235 -13.679 -20.852 0.471 1.00 1.23 O ATOM 547 ND2 ASN A 235 -15.622 -19.736 0.387 1.00 1.25 N ATOM 0 H ASN A 235 -11.465 -19.123 -1.461 1.00 0.96 H new ATOM 0 HA ASN A 235 -13.358 -21.254 -2.085 1.00 1.04 H new ATOM 0 HB2 ASN A 235 -13.490 -18.415 -1.120 1.00 1.02 H new ATOM 0 HB3 ASN A 235 -14.889 -19.078 -1.941 1.00 1.02 H new ATOM 0 HD21 ASN A 235 -15.960 -20.175 1.243 1.00 1.25 H new ATOM 0 HD22 ASN A 235 -16.207 -19.061 -0.105 1.00 1.25 H new ATOM 554 N GLY A 236 -12.377 -18.984 -4.195 1.00 0.94 N ATOM 555 CA GLY A 236 -12.429 -18.568 -5.584 1.00 0.98 C ATOM 556 C GLY A 236 -13.548 -17.588 -5.854 1.00 0.98 C ATOM 557 O GLY A 236 -14.101 -17.557 -6.952 1.00 1.09 O ATOM 0 H GLY A 236 -11.626 -18.559 -3.651 1.00 0.94 H new ATOM 0 HA2 GLY A 236 -11.478 -18.113 -5.859 1.00 0.98 H new ATOM 0 HA3 GLY A 236 -12.558 -19.445 -6.218 1.00 0.98 H new ATOM 561 N GLN A 237 -13.877 -16.781 -4.854 1.00 0.90 N ATOM 562 CA GLN A 237 -14.942 -15.798 -4.986 1.00 0.90 C ATOM 563 C GLN A 237 -14.366 -14.420 -5.289 1.00 0.84 C ATOM 564 O GLN A 237 -13.149 -14.258 -5.399 1.00 0.79 O ATOM 565 CB GLN A 237 -15.789 -15.759 -3.714 1.00 0.92 C ATOM 566 CG GLN A 237 -16.818 -16.878 -3.645 1.00 1.05 C ATOM 567 CD GLN A 237 -17.357 -17.099 -2.248 1.00 1.11 C ATOM 568 OE1 GLN A 237 -16.819 -17.898 -1.482 1.00 1.21 O ATOM 569 NE2 GLN A 237 -18.428 -16.399 -1.906 1.00 1.17 N ATOM 0 H GLN A 237 -13.421 -16.789 -3.942 1.00 0.90 H new ATOM 0 HA GLN A 237 -15.581 -16.091 -5.819 1.00 0.90 H new ATOM 0 HB2 GLN A 237 -15.133 -15.823 -2.846 1.00 0.92 H new ATOM 0 HB3 GLN A 237 -16.301 -14.799 -3.656 1.00 0.92 H new ATOM 0 HG2 GLN A 237 -17.645 -16.645 -4.315 1.00 1.05 H new ATOM 0 HG3 GLN A 237 -16.366 -17.802 -4.005 1.00 1.05 H new ATOM 0 HE21 GLN A 237 -18.844 -15.747 -2.570 1.00 1.17 H new ATOM 0 HE22 GLN A 237 -18.836 -16.512 -0.978 1.00 1.17 H new ATOM 578 N ASN A 238 -15.246 -13.442 -5.438 1.00 0.87 N ATOM 579 CA ASN A 238 -14.839 -12.076 -5.738 1.00 0.84 C ATOM 580 C ASN A 238 -14.560 -11.306 -4.456 1.00 0.84 C ATOM 581 O ASN A 238 -15.482 -11.206 -3.622 1.00 0.96 O ATOM 582 CB ASN A 238 -15.931 -11.374 -6.551 1.00 0.95 C ATOM 583 CG ASN A 238 -15.590 -9.933 -6.889 1.00 0.91 C ATOM 584 OD1 ASN A 238 -14.769 -9.665 -7.769 1.00 0.93 O ATOM 585 ND2 ASN A 238 -16.230 -8.997 -6.206 1.00 0.96 N ATOM 586 OXT ASN A 238 -13.424 -10.802 -4.299 1.00 0.80 O ATOM 0 H ASN A 238 -16.255 -13.570 -5.355 1.00 0.87 H new ATOM 0 HA ASN A 238 -13.921 -12.106 -6.325 1.00 0.84 H new ATOM 0 HB2 ASN A 238 -16.100 -11.927 -7.475 1.00 0.95 H new ATOM 0 HB3 ASN A 238 -16.865 -11.398 -5.990 1.00 0.95 H new ATOM 0 HD21 ASN A 238 -16.051 -8.012 -6.400 1.00 0.96 H new ATOM 0 HD22 ASN A 238 -16.902 -9.261 -5.486 1.00 0.96 H new ATOM 594 N GLY B 1 -31.391 13.890 -13.991 1.00 1.44 N ATOM 595 CA GLY B 1 -32.331 13.750 -12.852 1.00 1.42 C ATOM 596 C GLY B 1 -32.060 12.491 -12.066 1.00 1.36 C ATOM 597 O GLY B 1 -31.102 11.774 -12.366 1.00 1.36 O ATOM 0 H1 GLY B 1 -30.801 14.735 -13.852 1.00 1.44 H new ATOM 0 H2 GLY B 1 -30.783 13.048 -14.045 1.00 1.44 H new ATOM 0 H3 GLY B 1 -31.929 13.985 -14.876 1.00 1.44 H new ATOM 0 HA2 GLY B 1 -32.242 14.616 -12.196 1.00 1.42 H new ATOM 0 HA3 GLY B 1 -33.356 13.735 -13.224 1.00 1.42 H new ATOM 603 N SER B 2 -32.897 12.223 -11.062 1.00 1.35 N ATOM 604 CA SER B 2 -32.751 11.039 -10.220 1.00 1.32 C ATOM 605 C SER B 2 -31.365 11.005 -9.565 1.00 1.29 C ATOM 606 O SER B 2 -30.735 12.050 -9.376 1.00 1.34 O ATOM 607 CB SER B 2 -33.001 9.779 -11.055 1.00 1.32 C ATOM 608 OG SER B 2 -34.307 9.794 -11.616 1.00 1.35 O ATOM 0 H SER B 2 -33.688 12.816 -10.813 1.00 1.35 H new ATOM 0 HA SER B 2 -33.490 11.078 -9.419 1.00 1.32 H new ATOM 0 HB2 SER B 2 -32.259 9.712 -11.851 1.00 1.32 H new ATOM 0 HB3 SER B 2 -32.879 8.894 -10.431 1.00 1.32 H new ATOM 0 HG SER B 2 -34.445 8.981 -12.146 1.00 1.35 H new ATOM 614 N LEU B 3 -30.898 9.818 -9.199 1.00 1.26 N ATOM 615 CA LEU B 3 -29.587 9.682 -8.580 1.00 1.24 C ATOM 616 C LEU B 3 -28.500 9.554 -9.643 1.00 1.23 C ATOM 617 O LEU B 3 -27.807 10.529 -9.950 1.00 1.22 O ATOM 618 CB LEU B 3 -29.553 8.470 -7.641 1.00 1.26 C ATOM 619 CG LEU B 3 -28.249 8.294 -6.863 1.00 1.27 C ATOM 620 CD1 LEU B 3 -28.065 9.424 -5.864 1.00 1.23 C ATOM 621 CD2 LEU B 3 -28.232 6.945 -6.163 1.00 1.39 C ATOM 0 H LEU B 3 -31.404 8.941 -9.319 1.00 1.26 H new ATOM 0 HA LEU B 3 -29.396 10.581 -7.994 1.00 1.24 H new ATOM 0 HB2 LEU B 3 -30.374 8.557 -6.930 1.00 1.26 H new ATOM 0 HB3 LEU B 3 -29.733 7.569 -8.228 1.00 1.26 H new ATOM 0 HG LEU B 3 -27.417 8.327 -7.566 1.00 1.27 H new ATOM 0 HD11 LEU B 3 -27.131 9.281 -5.320 1.00 1.23 H new ATOM 0 HD12 LEU B 3 -28.034 10.376 -6.393 1.00 1.23 H new ATOM 0 HD13 LEU B 3 -28.898 9.427 -5.161 1.00 1.23 H new ATOM 0 HD21 LEU B 3 -27.298 6.832 -5.613 1.00 1.39 H new ATOM 0 HD22 LEU B 3 -29.071 6.884 -5.470 1.00 1.39 H new ATOM 0 HD23 LEU B 3 -28.315 6.150 -6.904 1.00 1.39 H new ATOM 633 N LEU B 4 -28.372 8.343 -10.195 1.00 1.27 N ATOM 634 CA LEU B 4 -27.387 8.020 -11.237 1.00 1.29 C ATOM 635 C LEU B 4 -25.954 8.019 -10.707 1.00 1.24 C ATOM 636 O LEU B 4 -25.209 7.068 -10.936 1.00 1.22 O ATOM 637 CB LEU B 4 -27.507 8.967 -12.439 1.00 1.32 C ATOM 638 CG LEU B 4 -28.510 8.542 -13.517 1.00 1.42 C ATOM 639 CD1 LEU B 4 -28.355 7.068 -13.841 1.00 1.54 C ATOM 640 CD2 LEU B 4 -29.933 8.845 -13.082 1.00 1.42 C ATOM 0 H LEU B 4 -28.955 7.549 -9.929 1.00 1.27 H new ATOM 0 HA LEU B 4 -27.617 7.007 -11.567 1.00 1.29 H new ATOM 0 HB2 LEU B 4 -27.789 9.955 -12.074 1.00 1.32 H new ATOM 0 HB3 LEU B 4 -26.525 9.066 -12.901 1.00 1.32 H new ATOM 0 HG LEU B 4 -28.300 9.117 -14.419 1.00 1.42 H new ATOM 0 HD11 LEU B 4 -29.076 6.786 -14.608 1.00 1.54 H new ATOM 0 HD12 LEU B 4 -27.345 6.880 -14.205 1.00 1.54 H new ATOM 0 HD13 LEU B 4 -28.532 6.477 -12.942 1.00 1.54 H new ATOM 0 HD21 LEU B 4 -30.626 8.534 -13.864 1.00 1.42 H new ATOM 0 HD22 LEU B 4 -30.156 8.303 -12.163 1.00 1.42 H new ATOM 0 HD23 LEU B 4 -30.040 9.916 -12.907 1.00 1.42 H new ATOM 652 N LYS B 5 -25.564 9.079 -10.016 1.00 1.25 N ATOM 653 CA LYS B 5 -24.219 9.179 -9.467 1.00 1.22 C ATOM 654 C LYS B 5 -24.156 8.545 -8.080 1.00 1.16 C ATOM 655 O LYS B 5 -24.770 9.041 -7.135 1.00 1.27 O ATOM 656 CB LYS B 5 -23.786 10.644 -9.393 1.00 1.38 C ATOM 657 CG LYS B 5 -23.737 11.340 -10.746 1.00 1.49 C ATOM 658 CD LYS B 5 -22.324 11.400 -11.309 1.00 1.59 C ATOM 659 CE LYS B 5 -21.816 10.028 -11.730 1.00 1.88 C ATOM 660 NZ LYS B 5 -20.446 10.095 -12.303 1.00 2.01 N ATOM 0 H LYS B 5 -26.160 9.884 -9.821 1.00 1.25 H new ATOM 0 HA LYS B 5 -23.538 8.641 -10.126 1.00 1.22 H new ATOM 0 HB2 LYS B 5 -24.474 11.184 -8.742 1.00 1.38 H new ATOM 0 HB3 LYS B 5 -22.800 10.699 -8.931 1.00 1.38 H new ATOM 0 HG2 LYS B 5 -24.384 10.813 -11.448 1.00 1.49 H new ATOM 0 HG3 LYS B 5 -24.130 12.352 -10.647 1.00 1.49 H new ATOM 0 HD2 LYS B 5 -22.304 12.072 -12.167 1.00 1.59 H new ATOM 0 HD3 LYS B 5 -21.653 11.820 -10.560 1.00 1.59 H new ATOM 0 HE2 LYS B 5 -21.817 9.361 -10.868 1.00 1.88 H new ATOM 0 HE3 LYS B 5 -22.496 9.599 -12.466 1.00 1.88 H new ATOM 0 HZ1 LYS B 5 -20.137 9.140 -12.577 1.00 2.01 H new ATOM 0 HZ2 LYS B 5 -20.450 10.711 -13.141 1.00 2.01 H new ATOM 0 HZ3 LYS B 5 -19.791 10.480 -11.593 1.00 2.01 H new ATOM 674 N PRO B 6 -23.412 7.438 -7.941 1.00 1.02 N ATOM 675 CA PRO B 6 -23.266 6.739 -6.669 1.00 1.00 C ATOM 676 C PRO B 6 -22.173 7.364 -5.803 1.00 1.02 C ATOM 677 O PRO B 6 -21.197 6.706 -5.440 1.00 1.01 O ATOM 678 CB PRO B 6 -22.881 5.326 -7.105 1.00 0.90 C ATOM 679 CG PRO B 6 -22.122 5.514 -8.377 1.00 0.86 C ATOM 680 CD PRO B 6 -22.646 6.776 -9.016 1.00 0.95 C ATOM 0 HA PRO B 6 -24.166 6.777 -6.056 1.00 1.00 H new ATOM 0 HB2 PRO B 6 -22.271 4.831 -6.349 1.00 0.90 H new ATOM 0 HB3 PRO B 6 -23.764 4.705 -7.259 1.00 0.90 H new ATOM 0 HG2 PRO B 6 -21.053 5.596 -8.181 1.00 0.86 H new ATOM 0 HG3 PRO B 6 -22.260 4.659 -9.039 1.00 0.86 H new ATOM 0 HD2 PRO B 6 -21.833 7.408 -9.373 1.00 0.95 H new ATOM 0 HD3 PRO B 6 -23.278 6.554 -9.876 1.00 0.95 H new ATOM 688 N ALA B 7 -22.349 8.638 -5.472 1.00 1.11 N ATOM 689 CA ALA B 7 -21.383 9.366 -4.658 1.00 1.15 C ATOM 690 C ALA B 7 -21.540 9.023 -3.177 1.00 1.14 C ATOM 691 O ALA B 7 -21.772 9.898 -2.340 1.00 1.22 O ATOM 692 CB ALA B 7 -21.533 10.863 -4.883 1.00 1.26 C ATOM 0 H ALA B 7 -23.157 9.191 -5.757 1.00 1.11 H new ATOM 0 HA ALA B 7 -20.381 9.064 -4.963 1.00 1.15 H new ATOM 0 HB1 ALA B 7 -20.807 11.398 -4.270 1.00 1.26 H new ATOM 0 HB2 ALA B 7 -21.359 11.092 -5.934 1.00 1.26 H new ATOM 0 HB3 ALA B 7 -22.540 11.173 -4.606 1.00 1.26 H new ATOM 698 N ARG B 8 -21.418 7.745 -2.863 1.00 1.08 N ATOM 699 CA ARG B 8 -21.539 7.269 -1.493 1.00 1.08 C ATOM 700 C ARG B 8 -20.458 6.238 -1.200 1.00 1.01 C ATOM 701 O ARG B 8 -20.337 5.242 -1.908 1.00 1.02 O ATOM 702 CB ARG B 8 -22.918 6.646 -1.249 1.00 1.12 C ATOM 703 CG ARG B 8 -24.065 7.644 -1.265 1.00 1.21 C ATOM 704 CD ARG B 8 -23.933 8.670 -0.152 1.00 1.25 C ATOM 705 NE ARG B 8 -25.225 9.254 0.198 1.00 1.41 N ATOM 706 CZ ARG B 8 -25.400 10.505 0.622 1.00 1.46 C ATOM 707 NH1 ARG B 8 -24.364 11.330 0.737 1.00 1.66 N ATOM 708 NH2 ARG B 8 -26.618 10.931 0.929 1.00 1.61 N ATOM 0 H ARG B 8 -21.233 7.010 -3.546 1.00 1.08 H new ATOM 0 HA ARG B 8 -21.419 8.124 -0.827 1.00 1.08 H new ATOM 0 HB2 ARG B 8 -23.101 5.887 -2.010 1.00 1.12 H new ATOM 0 HB3 ARG B 8 -22.908 6.136 -0.286 1.00 1.12 H new ATOM 0 HG2 ARG B 8 -24.091 8.153 -2.228 1.00 1.21 H new ATOM 0 HG3 ARG B 8 -25.011 7.113 -1.160 1.00 1.21 H new ATOM 0 HD2 ARG B 8 -23.496 8.198 0.728 1.00 1.25 H new ATOM 0 HD3 ARG B 8 -23.249 9.459 -0.463 1.00 1.25 H new ATOM 0 HE ARG B 8 -26.052 8.663 0.112 1.00 1.41 H new ATOM 0 HH11 ARG B 8 -23.426 11.007 0.500 1.00 1.66 H new ATOM 0 HH12 ARG B 8 -24.507 12.286 1.062 1.00 1.66 H new ATOM 0 HH21 ARG B 8 -27.416 10.302 0.840 1.00 1.61 H new ATOM 0 HH22 ARG B 8 -26.757 11.888 1.254 1.00 1.61 H new ATOM 722 N PHE B 9 -19.667 6.492 -0.171 1.00 0.97 N ATOM 723 CA PHE B 9 -18.601 5.577 0.223 1.00 0.91 C ATOM 724 C PHE B 9 -18.761 5.195 1.690 1.00 0.91 C ATOM 725 O PHE B 9 -17.812 4.765 2.344 1.00 0.86 O ATOM 726 CB PHE B 9 -17.223 6.213 -0.014 1.00 0.88 C ATOM 727 CG PHE B 9 -17.083 7.612 0.531 1.00 0.93 C ATOM 728 CD1 PHE B 9 -16.721 7.825 1.852 1.00 0.91 C ATOM 729 CD2 PHE B 9 -17.305 8.711 -0.283 1.00 1.04 C ATOM 730 CE1 PHE B 9 -16.584 9.106 2.352 1.00 0.98 C ATOM 731 CE2 PHE B 9 -17.168 9.995 0.211 1.00 1.11 C ATOM 732 CZ PHE B 9 -16.807 10.192 1.529 1.00 1.07 C ATOM 0 H PHE B 9 -19.741 7.327 0.411 1.00 0.97 H new ATOM 0 HA PHE B 9 -18.671 4.678 -0.389 1.00 0.91 H new ATOM 0 HB2 PHE B 9 -16.461 5.580 0.441 1.00 0.88 H new ATOM 0 HB3 PHE B 9 -17.024 6.231 -1.085 1.00 0.88 H new ATOM 0 HD1 PHE B 9 -16.544 6.979 2.499 1.00 0.91 H new ATOM 0 HD2 PHE B 9 -17.588 8.563 -1.315 1.00 1.04 H new ATOM 0 HE1 PHE B 9 -16.303 9.257 3.384 1.00 0.98 H new ATOM 0 HE2 PHE B 9 -17.343 10.843 -0.434 1.00 1.11 H new ATOM 0 HZ PHE B 9 -16.699 11.195 1.916 1.00 1.07 H new ATOM 742 N MET B 10 -19.980 5.349 2.188 1.00 0.97 N ATOM 743 CA MET B 10 -20.296 5.047 3.576 1.00 0.98 C ATOM 744 C MET B 10 -21.753 4.625 3.704 1.00 1.04 C ATOM 745 O MET B 10 -22.662 5.438 3.518 1.00 1.11 O ATOM 746 CB MET B 10 -20.020 6.274 4.450 1.00 1.00 C ATOM 747 CG MET B 10 -20.413 6.103 5.908 1.00 1.02 C ATOM 748 SD MET B 10 -20.156 7.613 6.861 1.00 1.08 S ATOM 749 CE MET B 10 -20.859 7.141 8.438 1.00 1.12 C ATOM 0 H MET B 10 -20.774 5.685 1.644 1.00 0.97 H new ATOM 0 HA MET B 10 -19.666 4.224 3.913 1.00 0.98 H new ATOM 0 HB2 MET B 10 -18.958 6.512 4.397 1.00 1.00 H new ATOM 0 HB3 MET B 10 -20.558 7.128 4.038 1.00 1.00 H new ATOM 0 HG2 MET B 10 -21.461 5.810 5.969 1.00 1.02 H new ATOM 0 HG3 MET B 10 -19.830 5.294 6.348 1.00 1.02 H new ATOM 0 HE1 MET B 10 -21.070 8.035 9.025 1.00 1.12 H new ATOM 0 HE2 MET B 10 -21.784 6.589 8.273 1.00 1.12 H new ATOM 0 HE3 MET B 10 -20.152 6.511 8.978 1.00 1.12 H new ATOM 759 N CYS B 11 -21.967 3.352 3.993 1.00 1.04 N ATOM 760 CA CYS B 11 -23.307 2.812 4.143 1.00 1.11 C ATOM 761 C CYS B 11 -23.879 3.144 5.514 1.00 1.17 C ATOM 762 O CYS B 11 -23.139 3.282 6.488 1.00 1.16 O ATOM 763 CB CYS B 11 -23.258 1.303 3.953 1.00 1.10 C ATOM 764 SG CYS B 11 -21.684 0.736 3.236 1.00 1.02 S ATOM 0 H CYS B 11 -21.222 2.669 4.129 1.00 1.04 H new ATOM 0 HA CYS B 11 -23.955 3.262 3.390 1.00 1.11 H new ATOM 0 HB2 CYS B 11 -23.411 0.815 4.915 1.00 1.10 H new ATOM 0 HB3 CYS B 11 -24.079 0.996 3.305 1.00 1.10 H new ATOM 0 HG CYS B 11 -21.792 -0.510 2.883 1.00 1.02 H new ATOM 769 N LEU B 12 -25.195 3.269 5.576 1.00 1.24 N ATOM 770 CA LEU B 12 -25.880 3.564 6.826 1.00 1.32 C ATOM 771 C LEU B 12 -25.826 2.364 7.782 1.00 1.31 C ATOM 772 O LEU B 12 -25.480 2.534 8.953 1.00 1.34 O ATOM 773 CB LEU B 12 -27.333 3.988 6.566 1.00 1.42 C ATOM 774 CG LEU B 12 -27.567 5.501 6.479 1.00 1.51 C ATOM 775 CD1 LEU B 12 -26.732 6.117 5.364 1.00 1.49 C ATOM 776 CD2 LEU B 12 -29.043 5.799 6.264 1.00 1.64 C ATOM 0 H LEU B 12 -25.814 3.170 4.771 1.00 1.24 H new ATOM 0 HA LEU B 12 -25.362 4.397 7.302 1.00 1.32 H new ATOM 0 HB2 LEU B 12 -27.667 3.531 5.634 1.00 1.42 H new ATOM 0 HB3 LEU B 12 -27.960 3.585 7.361 1.00 1.42 H new ATOM 0 HG LEU B 12 -27.255 5.948 7.423 1.00 1.51 H new ATOM 0 HD11 LEU B 12 -26.916 7.191 5.323 1.00 1.49 H new ATOM 0 HD12 LEU B 12 -25.675 5.937 5.559 1.00 1.49 H new ATOM 0 HD13 LEU B 12 -27.007 5.665 4.411 1.00 1.49 H new ATOM 0 HD21 LEU B 12 -29.192 6.877 6.205 1.00 1.64 H new ATOM 0 HD22 LEU B 12 -29.376 5.335 5.336 1.00 1.64 H new ATOM 0 HD23 LEU B 12 -29.620 5.399 7.097 1.00 1.64 H new ATOM 788 N PRO B 13 -26.166 1.129 7.321 1.00 1.30 N ATOM 789 CA PRO B 13 -26.115 -0.060 8.183 1.00 1.30 C ATOM 790 C PRO B 13 -24.705 -0.321 8.708 1.00 1.22 C ATOM 791 O PRO B 13 -24.522 -0.742 9.853 1.00 1.28 O ATOM 792 CB PRO B 13 -26.565 -1.204 7.266 1.00 1.31 C ATOM 793 CG PRO B 13 -27.304 -0.540 6.155 1.00 1.34 C ATOM 794 CD PRO B 13 -26.638 0.790 5.962 1.00 1.29 C ATOM 0 HA PRO B 13 -26.741 0.053 9.068 1.00 1.30 H new ATOM 0 HB2 PRO B 13 -25.711 -1.768 6.890 1.00 1.31 H new ATOM 0 HB3 PRO B 13 -27.203 -1.909 7.799 1.00 1.31 H new ATOM 0 HG2 PRO B 13 -27.259 -1.136 5.244 1.00 1.34 H new ATOM 0 HG3 PRO B 13 -28.358 -0.418 6.404 1.00 1.34 H new ATOM 0 HD2 PRO B 13 -25.813 0.728 5.252 1.00 1.29 H new ATOM 0 HD3 PRO B 13 -27.333 1.537 5.579 1.00 1.29 H new ATOM 802 N CYS B 14 -23.711 -0.062 7.866 1.00 1.09 N ATOM 803 CA CYS B 14 -22.322 -0.266 8.235 1.00 1.00 C ATOM 804 C CYS B 14 -21.813 0.862 9.127 1.00 1.04 C ATOM 805 O CYS B 14 -21.471 0.645 10.291 1.00 1.06 O ATOM 806 CB CYS B 14 -21.458 -0.373 6.976 1.00 0.92 C ATOM 807 SG CYS B 14 -21.761 -1.890 6.015 1.00 1.03 S ATOM 0 H CYS B 14 -23.846 0.292 6.919 1.00 1.09 H new ATOM 0 HA CYS B 14 -22.255 -1.196 8.800 1.00 1.00 H new ATOM 0 HB2 CYS B 14 -21.645 0.493 6.341 1.00 0.92 H new ATOM 0 HB3 CYS B 14 -20.407 -0.337 7.262 1.00 0.92 H new ATOM 0 HG CYS B 14 -20.855 -2.006 5.090 1.00 1.03 H new ATOM 812 N GLY B 15 -21.787 2.065 8.580 1.00 1.07 N ATOM 813 CA GLY B 15 -21.297 3.204 9.325 1.00 1.11 C ATOM 814 C GLY B 15 -19.814 3.410 9.105 1.00 1.01 C ATOM 815 O GLY B 15 -19.188 4.264 9.737 1.00 1.04 O ATOM 0 H GLY B 15 -22.097 2.274 7.631 1.00 1.07 H new ATOM 0 HA2 GLY B 15 -21.839 4.100 9.022 1.00 1.11 H new ATOM 0 HA3 GLY B 15 -21.492 3.057 10.387 1.00 1.11 H new ATOM 819 N ILE B 16 -19.256 2.613 8.203 1.00 0.95 N ATOM 820 CA ILE B 16 -17.841 2.686 7.878 1.00 0.87 C ATOM 821 C ILE B 16 -17.626 3.524 6.622 1.00 0.83 C ATOM 822 O ILE B 16 -18.299 3.321 5.611 1.00 0.84 O ATOM 823 CB ILE B 16 -17.242 1.278 7.646 1.00 0.85 C ATOM 824 CG1 ILE B 16 -17.503 0.378 8.857 1.00 0.94 C ATOM 825 CG2 ILE B 16 -15.748 1.372 7.361 1.00 0.77 C ATOM 826 CD1 ILE B 16 -16.939 -1.022 8.710 1.00 1.06 C ATOM 0 H ILE B 16 -19.769 1.903 7.680 1.00 0.95 H new ATOM 0 HA ILE B 16 -17.337 3.150 8.726 1.00 0.87 H new ATOM 0 HB ILE B 16 -17.729 0.836 6.777 1.00 0.85 H new ATOM 0 HG12 ILE B 16 -17.071 0.843 9.743 1.00 0.94 H new ATOM 0 HG13 ILE B 16 -18.578 0.311 9.024 1.00 0.94 H new ATOM 0 HG21 ILE B 16 -15.345 0.372 7.201 1.00 0.77 H new ATOM 0 HG22 ILE B 16 -15.585 1.976 6.469 1.00 0.77 H new ATOM 0 HG23 ILE B 16 -15.244 1.835 8.210 1.00 0.77 H new ATOM 0 HD11 ILE B 16 -17.163 -1.600 9.606 1.00 1.06 H new ATOM 0 HD12 ILE B 16 -17.389 -1.506 7.843 1.00 1.06 H new ATOM 0 HD13 ILE B 16 -15.859 -0.967 8.574 1.00 1.06 H new ATOM 838 N ALA B 17 -16.692 4.459 6.693 1.00 0.84 N ATOM 839 CA ALA B 17 -16.388 5.313 5.558 1.00 0.83 C ATOM 840 C ALA B 17 -15.166 4.789 4.816 1.00 0.75 C ATOM 841 O ALA B 17 -14.084 4.662 5.395 1.00 0.76 O ATOM 842 CB ALA B 17 -16.166 6.748 6.014 1.00 0.89 C ATOM 0 H ALA B 17 -16.132 4.645 7.525 1.00 0.84 H new ATOM 0 HA ALA B 17 -17.238 5.301 4.875 1.00 0.83 H new ATOM 0 HB1 ALA B 17 -15.939 7.373 5.150 1.00 0.89 H new ATOM 0 HB2 ALA B 17 -17.067 7.118 6.503 1.00 0.89 H new ATOM 0 HB3 ALA B 17 -15.332 6.782 6.715 1.00 0.89 H new ATOM 848 N PHE B 18 -15.345 4.474 3.545 1.00 0.70 N ATOM 849 CA PHE B 18 -14.263 3.958 2.722 1.00 0.63 C ATOM 850 C PHE B 18 -13.542 5.090 1.999 1.00 0.64 C ATOM 851 O PHE B 18 -13.982 6.242 2.024 1.00 0.72 O ATOM 852 CB PHE B 18 -14.805 2.938 1.716 1.00 0.59 C ATOM 853 CG PHE B 18 -14.711 1.514 2.193 1.00 0.56 C ATOM 854 CD1 PHE B 18 -14.856 1.209 3.536 1.00 0.60 C ATOM 855 CD2 PHE B 18 -14.473 0.486 1.297 1.00 0.52 C ATOM 856 CE1 PHE B 18 -14.764 -0.097 3.977 1.00 0.60 C ATOM 857 CE2 PHE B 18 -14.379 -0.822 1.734 1.00 0.53 C ATOM 858 CZ PHE B 18 -14.525 -1.112 3.075 1.00 0.56 C ATOM 0 H PHE B 18 -16.236 4.567 3.057 1.00 0.70 H new ATOM 0 HA PHE B 18 -13.543 3.461 3.373 1.00 0.63 H new ATOM 0 HB2 PHE B 18 -15.847 3.172 1.500 1.00 0.59 H new ATOM 0 HB3 PHE B 18 -14.255 3.036 0.780 1.00 0.59 H new ATOM 0 HD1 PHE B 18 -15.043 2.001 4.246 1.00 0.60 H new ATOM 0 HD2 PHE B 18 -14.360 0.708 0.246 1.00 0.52 H new ATOM 0 HE1 PHE B 18 -14.879 -0.323 5.027 1.00 0.60 H new ATOM 0 HE2 PHE B 18 -14.191 -1.616 1.026 1.00 0.53 H new ATOM 0 HZ PHE B 18 -14.452 -2.134 3.418 1.00 0.56 H new ATOM 868 N SER B 19 -12.427 4.762 1.361 1.00 0.59 N ATOM 869 CA SER B 19 -11.641 5.749 0.638 1.00 0.60 C ATOM 870 C SER B 19 -11.399 5.306 -0.808 1.00 0.57 C ATOM 871 O SER B 19 -11.266 6.137 -1.712 1.00 0.60 O ATOM 872 CB SER B 19 -10.312 5.977 1.361 1.00 0.60 C ATOM 873 OG SER B 19 -10.515 6.115 2.760 1.00 0.68 O ATOM 0 H SER B 19 -12.046 3.816 1.330 1.00 0.59 H new ATOM 0 HA SER B 19 -12.197 6.686 0.609 1.00 0.60 H new ATOM 0 HB2 SER B 19 -9.640 5.141 1.167 1.00 0.60 H new ATOM 0 HB3 SER B 19 -9.829 6.872 0.969 1.00 0.60 H new ATOM 0 HG SER B 19 -9.653 6.258 3.203 1.00 0.68 H new ATOM 879 N SER B 20 -11.357 3.999 -1.027 1.00 0.52 N ATOM 880 CA SER B 20 -11.128 3.458 -2.355 1.00 0.51 C ATOM 881 C SER B 20 -12.400 2.795 -2.888 1.00 0.52 C ATOM 882 O SER B 20 -12.989 1.935 -2.228 1.00 0.54 O ATOM 883 CB SER B 20 -9.972 2.456 -2.307 1.00 0.45 C ATOM 884 OG SER B 20 -8.983 2.870 -1.371 1.00 0.44 O ATOM 0 H SER B 20 -11.479 3.295 -0.299 1.00 0.52 H new ATOM 0 HA SER B 20 -10.863 4.269 -3.033 1.00 0.51 H new ATOM 0 HB2 SER B 20 -10.350 1.471 -2.032 1.00 0.45 H new ATOM 0 HB3 SER B 20 -9.525 2.361 -3.297 1.00 0.45 H new ATOM 0 HG SER B 20 -9.162 2.456 -0.501 1.00 0.44 H new ATOM 890 N PRO B 21 -12.844 3.189 -4.093 1.00 0.54 N ATOM 891 CA PRO B 21 -14.053 2.631 -4.719 1.00 0.56 C ATOM 892 C PRO B 21 -13.908 1.147 -5.048 1.00 0.52 C ATOM 893 O PRO B 21 -14.885 0.396 -5.029 1.00 0.54 O ATOM 894 CB PRO B 21 -14.213 3.457 -6.001 1.00 0.62 C ATOM 895 CG PRO B 21 -12.859 4.017 -6.275 1.00 0.61 C ATOM 896 CD PRO B 21 -12.211 4.219 -4.936 1.00 0.58 C ATOM 0 HA PRO B 21 -14.915 2.688 -4.055 1.00 0.56 H new ATOM 0 HB2 PRO B 21 -14.558 2.837 -6.829 1.00 0.62 H new ATOM 0 HB3 PRO B 21 -14.948 4.251 -5.869 1.00 0.62 H new ATOM 0 HG2 PRO B 21 -12.273 3.336 -6.892 1.00 0.61 H new ATOM 0 HG3 PRO B 21 -12.930 4.959 -6.819 1.00 0.61 H new ATOM 0 HD2 PRO B 21 -11.130 4.087 -4.988 1.00 0.58 H new ATOM 0 HD3 PRO B 21 -12.392 5.222 -4.549 1.00 0.58 H new ATOM 904 N SER B 22 -12.679 0.729 -5.320 1.00 0.49 N ATOM 905 CA SER B 22 -12.392 -0.656 -5.657 1.00 0.47 C ATOM 906 C SER B 22 -12.698 -1.578 -4.478 1.00 0.46 C ATOM 907 O SER B 22 -13.156 -2.710 -4.659 1.00 0.48 O ATOM 908 CB SER B 22 -10.924 -0.784 -6.053 1.00 0.47 C ATOM 909 OG SER B 22 -10.464 0.404 -6.678 1.00 0.48 O ATOM 0 H SER B 22 -11.860 1.336 -5.313 1.00 0.49 H new ATOM 0 HA SER B 22 -13.026 -0.954 -6.492 1.00 0.47 H new ATOM 0 HB2 SER B 22 -10.321 -0.992 -5.169 1.00 0.47 H new ATOM 0 HB3 SER B 22 -10.798 -1.629 -6.730 1.00 0.47 H new ATOM 0 HG SER B 22 -10.050 0.987 -6.008 1.00 0.48 H new ATOM 915 N THR B 23 -12.454 -1.082 -3.274 1.00 0.45 N ATOM 916 CA THR B 23 -12.698 -1.846 -2.066 1.00 0.46 C ATOM 917 C THR B 23 -14.193 -1.921 -1.756 1.00 0.51 C ATOM 918 O THR B 23 -14.683 -2.917 -1.217 1.00 0.54 O ATOM 919 CB THR B 23 -11.956 -1.211 -0.876 1.00 0.44 C ATOM 920 OG1 THR B 23 -10.937 -0.322 -1.358 1.00 0.56 O ATOM 921 CG2 THR B 23 -11.325 -2.279 -0.002 1.00 0.41 C ATOM 0 H THR B 23 -12.084 -0.146 -3.110 1.00 0.45 H new ATOM 0 HA THR B 23 -12.326 -2.858 -2.228 1.00 0.46 H new ATOM 0 HB THR B 23 -12.678 -0.654 -0.279 1.00 0.44 H new ATOM 0 HG1 THR B 23 -10.367 -0.043 -0.612 1.00 0.56 H new ATOM 0 HG21 THR B 23 -10.806 -1.807 0.832 1.00 0.41 H new ATOM 0 HG22 THR B 23 -12.101 -2.941 0.381 1.00 0.41 H new ATOM 0 HG23 THR B 23 -10.613 -2.858 -0.591 1.00 0.41 H new ATOM 929 N LEU B 24 -14.914 -0.869 -2.129 1.00 0.53 N ATOM 930 CA LEU B 24 -16.349 -0.791 -1.886 1.00 0.59 C ATOM 931 C LEU B 24 -17.111 -1.816 -2.726 1.00 0.60 C ATOM 932 O LEU B 24 -18.185 -2.273 -2.330 1.00 0.65 O ATOM 933 CB LEU B 24 -16.859 0.619 -2.192 1.00 0.61 C ATOM 934 CG LEU B 24 -18.269 0.928 -1.681 1.00 0.66 C ATOM 935 CD1 LEU B 24 -18.285 1.016 -0.164 1.00 0.70 C ATOM 936 CD2 LEU B 24 -18.785 2.217 -2.301 1.00 0.69 C ATOM 0 H LEU B 24 -14.525 -0.054 -2.604 1.00 0.53 H new ATOM 0 HA LEU B 24 -16.524 -1.018 -0.834 1.00 0.59 H new ATOM 0 HB2 LEU B 24 -16.167 1.340 -1.758 1.00 0.61 H new ATOM 0 HB3 LEU B 24 -16.840 0.768 -3.272 1.00 0.61 H new ATOM 0 HG LEU B 24 -18.930 0.114 -1.978 1.00 0.66 H new ATOM 0 HD11 LEU B 24 -19.297 1.236 0.177 1.00 0.70 H new ATOM 0 HD12 LEU B 24 -17.958 0.066 0.259 1.00 0.70 H new ATOM 0 HD13 LEU B 24 -17.612 1.809 0.162 1.00 0.70 H new ATOM 0 HD21 LEU B 24 -19.788 2.424 -1.928 1.00 0.69 H new ATOM 0 HD22 LEU B 24 -18.122 3.040 -2.034 1.00 0.69 H new ATOM 0 HD23 LEU B 24 -18.815 2.112 -3.386 1.00 0.69 H new ATOM 948 N GLU B 25 -16.539 -2.177 -3.874 1.00 0.58 N ATOM 949 CA GLU B 25 -17.156 -3.138 -4.789 1.00 0.60 C ATOM 950 C GLU B 25 -17.521 -4.445 -4.080 1.00 0.60 C ATOM 951 O GLU B 25 -18.694 -4.813 -4.004 1.00 0.62 O ATOM 952 CB GLU B 25 -16.208 -3.429 -5.958 1.00 0.60 C ATOM 953 CG GLU B 25 -16.813 -4.308 -7.042 1.00 0.63 C ATOM 954 CD GLU B 25 -15.847 -5.366 -7.533 1.00 0.83 C ATOM 955 OE1 GLU B 25 -15.630 -6.359 -6.811 1.00 1.15 O ATOM 956 OE2 GLU B 25 -15.293 -5.211 -8.640 1.00 1.25 O ATOM 0 H GLU B 25 -15.641 -1.815 -4.195 1.00 0.58 H new ATOM 0 HA GLU B 25 -18.078 -2.693 -5.164 1.00 0.60 H new ATOM 0 HB2 GLU B 25 -15.896 -2.484 -6.403 1.00 0.60 H new ATOM 0 HB3 GLU B 25 -15.310 -3.912 -5.572 1.00 0.60 H new ATOM 0 HG2 GLU B 25 -17.711 -4.791 -6.656 1.00 0.63 H new ATOM 0 HG3 GLU B 25 -17.122 -3.685 -7.881 1.00 0.63 H new ATOM 963 N ALA B 26 -16.515 -5.134 -3.555 1.00 0.61 N ATOM 964 CA ALA B 26 -16.734 -6.403 -2.869 1.00 0.64 C ATOM 965 C ALA B 26 -17.381 -6.190 -1.506 1.00 0.67 C ATOM 966 O ALA B 26 -18.067 -7.072 -0.986 1.00 0.72 O ATOM 967 CB ALA B 26 -15.427 -7.161 -2.724 1.00 0.66 C ATOM 0 H ALA B 26 -15.540 -4.836 -3.591 1.00 0.61 H new ATOM 0 HA ALA B 26 -17.418 -6.998 -3.475 1.00 0.64 H new ATOM 0 HB1 ALA B 26 -15.609 -8.105 -2.210 1.00 0.66 H new ATOM 0 HB2 ALA B 26 -15.010 -7.360 -3.711 1.00 0.66 H new ATOM 0 HB3 ALA B 26 -14.722 -6.563 -2.146 1.00 0.66 H new ATOM 973 N HIS B 27 -17.155 -5.015 -0.928 1.00 0.67 N ATOM 974 CA HIS B 27 -17.729 -4.681 0.367 1.00 0.71 C ATOM 975 C HIS B 27 -19.256 -4.752 0.290 1.00 0.75 C ATOM 976 O HIS B 27 -19.909 -5.290 1.190 1.00 0.80 O ATOM 977 CB HIS B 27 -17.260 -3.276 0.817 1.00 0.71 C ATOM 978 CG HIS B 27 -18.039 -2.679 1.965 1.00 0.76 C ATOM 979 ND1 HIS B 27 -17.472 -2.301 3.174 1.00 0.78 N ATOM 980 CD2 HIS B 27 -19.358 -2.424 2.084 1.00 0.81 C ATOM 981 CE1 HIS B 27 -18.428 -1.837 3.976 1.00 0.84 C ATOM 982 NE2 HIS B 27 -19.563 -1.912 3.320 1.00 0.85 N ATOM 0 H HIS B 27 -16.579 -4.280 -1.337 1.00 0.67 H new ATOM 0 HA HIS B 27 -17.386 -5.402 1.109 1.00 0.71 H new ATOM 0 HB2 HIS B 27 -16.210 -3.334 1.102 1.00 0.71 H new ATOM 0 HB3 HIS B 27 -17.322 -2.599 -0.035 1.00 0.71 H new ATOM 0 HD1 HIS B 27 -16.482 -2.368 3.410 1.00 0.78 H new ATOM 0 HD2 HIS B 27 -20.113 -2.597 1.331 1.00 0.81 H new ATOM 0 HE1 HIS B 27 -18.294 -1.467 4.982 1.00 0.84 H new ATOM 990 N GLN B 28 -19.810 -4.217 -0.794 1.00 0.75 N ATOM 991 CA GLN B 28 -21.257 -4.187 -0.995 1.00 0.81 C ATOM 992 C GLN B 28 -21.798 -5.564 -1.389 1.00 0.81 C ATOM 993 O GLN B 28 -22.507 -5.707 -2.386 1.00 0.85 O ATOM 994 CB GLN B 28 -21.607 -3.150 -2.063 1.00 0.83 C ATOM 995 CG GLN B 28 -23.037 -2.648 -1.980 1.00 1.08 C ATOM 996 CD GLN B 28 -23.409 -1.737 -3.135 1.00 1.25 C ATOM 997 OE1 GLN B 28 -24.195 -0.807 -2.970 1.00 1.36 O ATOM 998 NE2 GLN B 28 -22.869 -2.010 -4.315 1.00 1.57 N ATOM 0 H GLN B 28 -19.275 -3.795 -1.553 1.00 0.75 H new ATOM 0 HA GLN B 28 -21.727 -3.908 -0.052 1.00 0.81 H new ATOM 0 HB2 GLN B 28 -20.928 -2.303 -1.970 1.00 0.83 H new ATOM 0 HB3 GLN B 28 -21.441 -3.586 -3.048 1.00 0.83 H new ATOM 0 HG2 GLN B 28 -23.716 -3.501 -1.963 1.00 1.08 H new ATOM 0 HG3 GLN B 28 -23.175 -2.112 -1.041 1.00 1.08 H new ATOM 0 HE21 GLN B 28 -22.220 -2.791 -4.411 1.00 1.57 H new ATOM 0 HE22 GLN B 28 -23.102 -1.439 -5.127 1.00 1.57 H new ATOM 1007 N ALA B 29 -21.468 -6.568 -0.590 1.00 0.81 N ATOM 1008 CA ALA B 29 -21.911 -7.927 -0.836 1.00 0.83 C ATOM 1009 C ALA B 29 -21.858 -8.749 0.444 1.00 0.87 C ATOM 1010 O ALA B 29 -22.859 -9.335 0.860 1.00 0.90 O ATOM 1011 CB ALA B 29 -21.064 -8.579 -1.916 1.00 0.83 C ATOM 0 H ALA B 29 -20.888 -6.462 0.243 1.00 0.81 H new ATOM 0 HA ALA B 29 -22.944 -7.890 -1.181 1.00 0.83 H new ATOM 0 HB1 ALA B 29 -21.412 -9.598 -2.086 1.00 0.83 H new ATOM 0 HB2 ALA B 29 -21.150 -8.007 -2.840 1.00 0.83 H new ATOM 0 HB3 ALA B 29 -20.022 -8.600 -1.598 1.00 0.83 H new ATOM 1017 N TYR B 30 -20.693 -8.769 1.082 1.00 0.87 N ATOM 1018 CA TYR B 30 -20.513 -9.546 2.306 1.00 0.91 C ATOM 1019 C TYR B 30 -20.373 -8.662 3.547 1.00 0.91 C ATOM 1020 O TYR B 30 -20.390 -9.172 4.668 1.00 1.01 O ATOM 1021 CB TYR B 30 -19.274 -10.445 2.198 1.00 0.94 C ATOM 1022 CG TYR B 30 -18.928 -10.891 0.793 1.00 0.92 C ATOM 1023 CD1 TYR B 30 -19.499 -12.030 0.243 1.00 0.99 C ATOM 1024 CD2 TYR B 30 -18.012 -10.181 0.026 1.00 0.93 C ATOM 1025 CE1 TYR B 30 -19.168 -12.451 -1.031 1.00 1.07 C ATOM 1026 CE2 TYR B 30 -17.679 -10.589 -1.251 1.00 1.01 C ATOM 1027 CZ TYR B 30 -18.258 -11.726 -1.776 1.00 1.07 C ATOM 1028 OH TYR B 30 -17.925 -12.142 -3.048 1.00 1.20 O ATOM 0 H TYR B 30 -19.864 -8.260 0.776 1.00 0.87 H new ATOM 0 HA TYR B 30 -21.412 -10.153 2.419 1.00 0.91 H new ATOM 0 HB2 TYR B 30 -18.419 -9.912 2.615 1.00 0.94 H new ATOM 0 HB3 TYR B 30 -19.430 -11.329 2.816 1.00 0.94 H new ATOM 0 HD1 TYR B 30 -20.214 -12.597 0.820 1.00 0.99 H new ATOM 0 HD2 TYR B 30 -17.552 -9.294 0.436 1.00 0.93 H new ATOM 0 HE1 TYR B 30 -19.618 -13.342 -1.442 1.00 1.07 H new ATOM 0 HE2 TYR B 30 -16.970 -10.021 -1.835 1.00 1.01 H new ATOM 0 HH TYR B 30 -16.963 -12.022 -3.190 1.00 1.20 H new ATOM 1038 N TYR B 31 -20.246 -7.348 3.369 1.00 0.86 N ATOM 1039 CA TYR B 31 -20.072 -6.464 4.519 1.00 0.87 C ATOM 1040 C TYR B 31 -21.389 -5.852 5.001 1.00 0.94 C ATOM 1041 O TYR B 31 -21.710 -5.971 6.182 1.00 1.03 O ATOM 1042 CB TYR B 31 -19.055 -5.364 4.220 1.00 0.81 C ATOM 1043 CG TYR B 31 -18.121 -5.078 5.378 1.00 0.77 C ATOM 1044 CD1 TYR B 31 -18.574 -5.121 6.692 1.00 0.88 C ATOM 1045 CD2 TYR B 31 -16.787 -4.767 5.157 1.00 0.71 C ATOM 1046 CE1 TYR B 31 -17.725 -4.862 7.749 1.00 0.89 C ATOM 1047 CE2 TYR B 31 -15.932 -4.506 6.210 1.00 0.68 C ATOM 1048 CZ TYR B 31 -16.406 -4.556 7.505 1.00 0.75 C ATOM 1049 OH TYR B 31 -15.556 -4.295 8.557 1.00 0.77 O ATOM 0 H TYR B 31 -20.260 -6.881 2.462 1.00 0.86 H new ATOM 0 HA TYR B 31 -19.692 -7.088 5.328 1.00 0.87 H new ATOM 0 HB2 TYR B 31 -18.465 -5.651 3.350 1.00 0.81 H new ATOM 0 HB3 TYR B 31 -19.587 -4.449 3.957 1.00 0.81 H new ATOM 0 HD1 TYR B 31 -19.608 -5.361 6.889 1.00 0.88 H new ATOM 0 HD2 TYR B 31 -16.411 -4.728 4.145 1.00 0.71 H new ATOM 0 HE1 TYR B 31 -18.094 -4.899 8.763 1.00 0.89 H new ATOM 0 HE2 TYR B 31 -14.897 -4.264 6.021 1.00 0.68 H new ATOM 0 HH TYR B 31 -14.682 -4.020 8.211 1.00 0.77 H new ATOM 1059 N CYS B 32 -22.141 -5.185 4.118 1.00 0.94 N ATOM 1060 CA CYS B 32 -23.414 -4.584 4.522 1.00 1.02 C ATOM 1061 C CYS B 32 -24.454 -5.674 4.784 1.00 1.07 C ATOM 1062 O CYS B 32 -25.349 -5.902 3.964 1.00 1.10 O ATOM 1063 CB CYS B 32 -23.938 -3.628 3.446 1.00 1.01 C ATOM 1064 SG CYS B 32 -22.648 -2.830 2.442 1.00 0.98 S ATOM 0 H CYS B 32 -21.895 -5.050 3.137 1.00 0.94 H new ATOM 0 HA CYS B 32 -23.240 -4.018 5.437 1.00 1.02 H new ATOM 0 HB2 CYS B 32 -24.605 -4.179 2.784 1.00 1.01 H new ATOM 0 HB3 CYS B 32 -24.535 -2.854 3.927 1.00 1.01 H new ATOM 0 HG CYS B 32 -21.644 -2.507 3.202 1.00 0.98 H new ATOM 1069 N SER B 33 -24.323 -6.337 5.927 1.00 1.09 N ATOM 1070 CA SER B 33 -25.211 -7.421 6.324 1.00 1.16 C ATOM 1071 C SER B 33 -25.078 -8.600 5.354 1.00 1.09 C ATOM 1072 O SER B 33 -24.233 -9.475 5.551 1.00 1.07 O ATOM 1073 CB SER B 33 -26.657 -6.924 6.424 1.00 1.27 C ATOM 1074 OG SER B 33 -26.734 -5.781 7.266 1.00 1.43 O ATOM 0 H SER B 33 -23.592 -6.135 6.609 1.00 1.09 H new ATOM 0 HA SER B 33 -24.920 -7.773 7.314 1.00 1.16 H new ATOM 0 HB2 SER B 33 -27.032 -6.677 5.431 1.00 1.27 H new ATOM 0 HB3 SER B 33 -27.294 -7.716 6.818 1.00 1.27 H new ATOM 0 HG SER B 33 -27.664 -5.475 7.318 1.00 1.43 H new ATOM 1080 N HIS B 34 -25.884 -8.609 4.299 1.00 1.10 N ATOM 1081 CA HIS B 34 -25.840 -9.674 3.306 1.00 1.07 C ATOM 1082 C HIS B 34 -26.488 -9.211 2.008 1.00 1.06 C ATOM 1083 O HIS B 34 -27.707 -9.259 1.859 1.00 1.14 O ATOM 1084 CB HIS B 34 -26.530 -10.942 3.825 1.00 1.14 C ATOM 1085 CG HIS B 34 -25.578 -11.950 4.399 1.00 1.09 C ATOM 1086 ND1 HIS B 34 -25.745 -12.530 5.637 1.00 1.18 N ATOM 1087 CD2 HIS B 34 -24.435 -12.469 3.895 1.00 1.04 C ATOM 1088 CE1 HIS B 34 -24.746 -13.359 5.871 1.00 1.14 C ATOM 1089 NE2 HIS B 34 -23.938 -13.339 4.830 1.00 1.06 N ATOM 0 H HIS B 34 -26.579 -7.887 4.109 1.00 1.10 H new ATOM 0 HA HIS B 34 -24.795 -9.915 3.113 1.00 1.07 H new ATOM 0 HB2 HIS B 34 -27.256 -10.664 4.589 1.00 1.14 H new ATOM 0 HB3 HIS B 34 -27.086 -11.403 3.009 1.00 1.14 H new ATOM 0 HD2 HIS B 34 -23.996 -12.240 2.935 1.00 1.04 H new ATOM 0 HE1 HIS B 34 -24.613 -13.953 6.763 1.00 1.14 H new ATOM 0 HE2 HIS B 34 -23.081 -13.883 4.735 1.00 1.06 H new ATOM 1098 N ARG B 35 -25.663 -8.749 1.079 1.00 0.99 N ATOM 1099 CA ARG B 35 -26.142 -8.274 -0.214 1.00 0.99 C ATOM 1100 C ARG B 35 -25.746 -9.268 -1.299 1.00 1.01 C ATOM 1101 O ARG B 35 -25.324 -8.887 -2.390 1.00 1.03 O ATOM 1102 CB ARG B 35 -25.559 -6.893 -0.541 1.00 0.94 C ATOM 1103 CG ARG B 35 -25.345 -6.001 0.673 1.00 0.94 C ATOM 1104 CD ARG B 35 -26.525 -5.075 0.913 1.00 1.04 C ATOM 1105 NE ARG B 35 -26.723 -4.142 -0.195 1.00 1.05 N ATOM 1106 CZ ARG B 35 -26.177 -2.926 -0.262 1.00 1.06 C ATOM 1107 NH1 ARG B 35 -25.356 -2.495 0.693 1.00 1.04 N ATOM 1108 NH2 ARG B 35 -26.445 -2.143 -1.302 1.00 1.11 N ATOM 0 H ARG B 35 -24.651 -8.692 1.197 1.00 0.99 H new ATOM 0 HA ARG B 35 -27.228 -8.187 -0.171 1.00 0.99 H new ATOM 0 HB2 ARG B 35 -24.606 -7.026 -1.052 1.00 0.94 H new ATOM 0 HB3 ARG B 35 -26.226 -6.385 -1.237 1.00 0.94 H new ATOM 0 HG2 ARG B 35 -25.185 -6.621 1.555 1.00 0.94 H new ATOM 0 HG3 ARG B 35 -24.441 -5.408 0.533 1.00 0.94 H new ATOM 0 HD2 ARG B 35 -27.429 -5.668 1.053 1.00 1.04 H new ATOM 0 HD3 ARG B 35 -26.365 -4.515 1.834 1.00 1.04 H new ATOM 0 HE ARG B 35 -27.318 -4.440 -0.968 1.00 1.05 H new ATOM 0 HH11 ARG B 35 -25.138 -3.096 1.488 1.00 1.04 H new ATOM 0 HH12 ARG B 35 -24.945 -1.564 0.630 1.00 1.04 H new ATOM 0 HH21 ARG B 35 -27.064 -2.473 -2.042 1.00 1.11 H new ATOM 0 HH22 ARG B 35 -26.031 -1.212 -1.360 1.00 1.11 H new ATOM 1122 N ILE B 36 -25.894 -10.545 -0.988 1.00 1.07 N ATOM 1123 CA ILE B 36 -25.541 -11.607 -1.914 1.00 1.12 C ATOM 1124 C ILE B 36 -26.732 -11.977 -2.787 1.00 1.32 C ATOM 1125 O ILE B 36 -26.520 -12.402 -3.942 1.00 1.45 O ATOM 1126 CB ILE B 36 -25.033 -12.862 -1.169 1.00 1.06 C ATOM 1127 CG1 ILE B 36 -26.038 -13.298 -0.098 1.00 1.12 C ATOM 1128 CG2 ILE B 36 -23.669 -12.589 -0.549 1.00 1.04 C ATOM 1129 CD1 ILE B 36 -25.674 -14.596 0.592 1.00 1.18 C ATOM 1130 OXT ILE B 36 -27.878 -11.833 -2.314 1.00 1.45 O ATOM 0 H ILE B 36 -26.259 -10.873 -0.094 1.00 1.07 H new ATOM 0 HA ILE B 36 -24.735 -11.232 -2.546 1.00 1.12 H new ATOM 0 HB ILE B 36 -24.930 -13.675 -1.887 1.00 1.06 H new ATOM 0 HG12 ILE B 36 -26.121 -12.510 0.651 1.00 1.12 H new ATOM 0 HG13 ILE B 36 -27.021 -13.405 -0.558 1.00 1.12 H new ATOM 0 HG21 ILE B 36 -23.322 -13.481 -0.027 1.00 1.04 H new ATOM 0 HG22 ILE B 36 -22.959 -12.328 -1.333 1.00 1.04 H new ATOM 0 HG23 ILE B 36 -23.749 -11.763 0.158 1.00 1.04 H new ATOM 0 HD11 ILE B 36 -26.433 -14.838 1.336 1.00 1.18 H new ATOM 0 HD12 ILE B 36 -25.620 -15.397 -0.145 1.00 1.18 H new ATOM 0 HD13 ILE B 36 -24.706 -14.489 1.082 1.00 1.18 H new ATOM 1272 N ASP C 91 21.432 -4.481 -5.172 1.00 1.08 N ATOM 1273 CA ASP C 91 22.342 -3.338 -5.224 1.00 1.09 C ATOM 1274 C ASP C 91 23.539 -3.605 -4.314 1.00 1.14 C ATOM 1275 O ASP C 91 23.848 -4.763 -4.019 1.00 1.53 O ATOM 1276 CB ASP C 91 21.630 -2.043 -4.807 1.00 1.03 C ATOM 1277 CG ASP C 91 22.221 -0.815 -5.470 1.00 1.19 C ATOM 1278 OD1 ASP C 91 23.173 -0.233 -4.910 1.00 1.34 O ATOM 1279 OD2 ASP C 91 21.741 -0.428 -6.552 1.00 1.54 O ATOM 0 HA ASP C 91 22.686 -3.209 -6.250 1.00 1.09 H new ATOM 0 HB2 ASP C 91 20.573 -2.116 -5.062 1.00 1.03 H new ATOM 0 HB3 ASP C 91 21.690 -1.932 -3.724 1.00 1.03 H new ATOM 1284 N GLY C 92 24.205 -2.547 -3.869 1.00 0.94 N ATOM 1285 CA GLY C 92 25.358 -2.710 -3.004 1.00 1.00 C ATOM 1286 C GLY C 92 25.019 -2.531 -1.536 1.00 0.95 C ATOM 1287 O GLY C 92 24.931 -3.503 -0.783 1.00 1.04 O ATOM 0 H GLY C 92 23.968 -1.580 -4.091 1.00 0.94 H new ATOM 0 HA2 GLY C 92 25.784 -3.702 -3.156 1.00 1.00 H new ATOM 0 HA3 GLY C 92 26.124 -1.988 -3.286 1.00 1.00 H new ATOM 1291 N LEU C 93 24.818 -1.287 -1.132 1.00 0.88 N ATOM 1292 CA LEU C 93 24.494 -0.976 0.255 1.00 0.88 C ATOM 1293 C LEU C 93 23.161 -0.249 0.353 1.00 0.83 C ATOM 1294 O LEU C 93 22.645 0.261 -0.642 1.00 0.84 O ATOM 1295 CB LEU C 93 25.589 -0.103 0.877 1.00 0.98 C ATOM 1296 CG LEU C 93 26.539 -0.822 1.834 1.00 1.17 C ATOM 1297 CD1 LEU C 93 27.540 -1.663 1.062 1.00 1.58 C ATOM 1298 CD2 LEU C 93 27.249 0.182 2.727 1.00 1.17 C ATOM 0 H LEU C 93 24.873 -0.473 -1.745 1.00 0.88 H new ATOM 0 HA LEU C 93 24.425 -1.918 0.798 1.00 0.88 H new ATOM 0 HB2 LEU C 93 26.177 0.339 0.073 1.00 0.98 H new ATOM 0 HB3 LEU C 93 25.114 0.718 1.413 1.00 0.98 H new ATOM 0 HG LEU C 93 25.955 -1.490 2.467 1.00 1.17 H new ATOM 0 HD11 LEU C 93 28.208 -2.167 1.761 1.00 1.58 H new ATOM 0 HD12 LEU C 93 27.009 -2.406 0.467 1.00 1.58 H new ATOM 0 HD13 LEU C 93 28.123 -1.020 0.403 1.00 1.58 H new ATOM 0 HD21 LEU C 93 27.922 -0.345 3.403 1.00 1.17 H new ATOM 0 HD22 LEU C 93 27.822 0.875 2.111 1.00 1.17 H new ATOM 0 HD23 LEU C 93 26.512 0.737 3.308 1.00 1.17 H new ATOM 1310 N CYS C 94 22.614 -0.213 1.557 1.00 0.81 N ATOM 1311 CA CYS C 94 21.358 0.465 1.822 1.00 0.77 C ATOM 1312 C CYS C 94 21.607 1.966 1.864 1.00 0.84 C ATOM 1313 O CYS C 94 22.689 2.413 2.240 1.00 1.04 O ATOM 1314 CB CYS C 94 20.794 -0.031 3.157 1.00 0.75 C ATOM 1315 SG CYS C 94 19.208 0.693 3.706 1.00 0.70 S ATOM 0 H CYS C 94 23.029 -0.654 2.378 1.00 0.81 H new ATOM 0 HA CYS C 94 20.634 0.251 1.036 1.00 0.77 H new ATOM 0 HB2 CYS C 94 20.669 -1.112 3.092 1.00 0.75 H new ATOM 0 HB3 CYS C 94 21.538 0.157 3.931 1.00 0.75 H new ATOM 0 HG CYS C 94 18.546 -0.186 4.398 1.00 0.70 H new ATOM 1320 N ALA C 95 20.620 2.740 1.468 1.00 0.79 N ATOM 1321 CA ALA C 95 20.757 4.186 1.475 1.00 0.88 C ATOM 1322 C ALA C 95 20.088 4.764 2.711 1.00 0.82 C ATOM 1323 O ALA C 95 20.151 5.966 2.966 1.00 0.92 O ATOM 1324 CB ALA C 95 20.180 4.790 0.204 1.00 1.00 C ATOM 0 H ALA C 95 19.717 2.398 1.138 1.00 0.79 H new ATOM 0 HA ALA C 95 21.817 4.439 1.506 1.00 0.88 H new ATOM 0 HB1 ALA C 95 20.294 5.874 0.232 1.00 1.00 H new ATOM 0 HB2 ALA C 95 20.710 4.392 -0.661 1.00 1.00 H new ATOM 0 HB3 ALA C 95 19.122 4.538 0.129 1.00 1.00 H new ATOM 1330 N SER C 96 19.450 3.895 3.476 1.00 0.72 N ATOM 1331 CA SER C 96 18.786 4.300 4.697 1.00 0.70 C ATOM 1332 C SER C 96 19.691 4.017 5.890 1.00 0.69 C ATOM 1333 O SER C 96 19.731 4.785 6.853 1.00 0.74 O ATOM 1334 CB SER C 96 17.462 3.557 4.851 1.00 0.70 C ATOM 1335 OG SER C 96 16.504 3.998 3.897 1.00 0.77 O ATOM 0 H SER C 96 19.379 2.899 3.269 1.00 0.72 H new ATOM 0 HA SER C 96 18.578 5.369 4.652 1.00 0.70 H new ATOM 0 HB2 SER C 96 17.628 2.486 4.733 1.00 0.70 H new ATOM 0 HB3 SER C 96 17.072 3.710 5.857 1.00 0.70 H new ATOM 0 HG SER C 96 16.765 3.688 3.005 1.00 0.77 H new ATOM 1341 N CYS C 97 20.419 2.911 5.812 1.00 0.69 N ATOM 1342 CA CYS C 97 21.333 2.521 6.865 1.00 0.69 C ATOM 1343 C CYS C 97 22.657 2.074 6.244 1.00 0.73 C ATOM 1344 O CYS C 97 22.705 1.703 5.071 1.00 0.90 O ATOM 1345 CB CYS C 97 20.705 1.419 7.732 1.00 0.67 C ATOM 1346 SG CYS C 97 20.678 -0.243 6.982 1.00 0.69 S ATOM 0 H CYS C 97 20.390 2.267 5.022 1.00 0.69 H new ATOM 0 HA CYS C 97 21.533 3.370 7.518 1.00 0.69 H new ATOM 0 HB2 CYS C 97 21.251 1.366 8.674 1.00 0.67 H new ATOM 0 HB3 CYS C 97 19.682 1.708 7.972 1.00 0.67 H new ATOM 0 HG CYS C 97 20.183 -0.170 5.782 1.00 0.69 H new ATOM 1351 N ASP C 98 23.730 2.125 7.012 1.00 0.79 N ATOM 1352 CA ASP C 98 25.037 1.738 6.503 1.00 0.82 C ATOM 1353 C ASP C 98 25.237 0.232 6.618 1.00 0.83 C ATOM 1354 O ASP C 98 26.070 -0.235 7.396 1.00 0.97 O ATOM 1355 CB ASP C 98 26.147 2.475 7.254 1.00 0.86 C ATOM 1356 CG ASP C 98 27.047 3.264 6.324 1.00 0.96 C ATOM 1357 OD1 ASP C 98 27.920 2.656 5.673 1.00 1.32 O ATOM 1358 OD2 ASP C 98 26.884 4.501 6.244 1.00 1.41 O ATOM 0 H ASP C 98 23.725 2.429 7.986 1.00 0.79 H new ATOM 0 HA ASP C 98 25.084 2.015 5.450 1.00 0.82 H new ATOM 0 HB2 ASP C 98 25.702 3.151 7.984 1.00 0.86 H new ATOM 0 HB3 ASP C 98 26.746 1.754 7.811 1.00 0.86 H new ATOM 1363 N LYS C 99 24.460 -0.527 5.857 1.00 0.83 N ATOM 1364 CA LYS C 99 24.557 -1.981 5.876 1.00 0.85 C ATOM 1365 C LYS C 99 24.543 -2.544 4.460 1.00 0.86 C ATOM 1366 O LYS C 99 23.965 -1.946 3.548 1.00 0.92 O ATOM 1367 CB LYS C 99 23.400 -2.583 6.681 1.00 0.82 C ATOM 1368 CG LYS C 99 23.419 -2.216 8.153 1.00 0.90 C ATOM 1369 CD LYS C 99 24.591 -2.862 8.869 1.00 1.00 C ATOM 1370 CE LYS C 99 24.915 -2.136 10.159 1.00 1.21 C ATOM 1371 NZ LYS C 99 26.176 -2.628 10.768 1.00 1.44 N ATOM 0 H LYS C 99 23.755 -0.160 5.218 1.00 0.83 H new ATOM 0 HA LYS C 99 25.501 -2.249 6.350 1.00 0.85 H new ATOM 0 HB2 LYS C 99 22.457 -2.252 6.246 1.00 0.82 H new ATOM 0 HB3 LYS C 99 23.431 -3.668 6.587 1.00 0.82 H new ATOM 0 HG2 LYS C 99 23.478 -1.133 8.259 1.00 0.90 H new ATOM 0 HG3 LYS C 99 22.486 -2.532 8.620 1.00 0.90 H new ATOM 0 HD2 LYS C 99 24.358 -3.905 9.084 1.00 1.00 H new ATOM 0 HD3 LYS C 99 25.465 -2.858 8.218 1.00 1.00 H new ATOM 0 HE2 LYS C 99 24.999 -1.067 9.963 1.00 1.21 H new ATOM 0 HE3 LYS C 99 24.095 -2.267 10.865 1.00 1.21 H new ATOM 0 HZ1 LYS C 99 26.363 -2.107 11.648 1.00 1.44 H new ATOM 0 HZ2 LYS C 99 26.087 -3.643 10.979 1.00 1.44 H new ATOM 0 HZ3 LYS C 99 26.963 -2.480 10.104 1.00 1.44 H new ATOM 1385 N ARG C 100 25.181 -3.698 4.279 1.00 0.84 N ATOM 1386 CA ARG C 100 25.237 -4.347 2.975 1.00 0.88 C ATOM 1387 C ARG C 100 23.906 -5.012 2.658 1.00 0.85 C ATOM 1388 O ARG C 100 23.237 -5.549 3.546 1.00 0.85 O ATOM 1389 CB ARG C 100 26.353 -5.392 2.946 1.00 0.94 C ATOM 1390 CG ARG C 100 27.750 -4.796 2.931 1.00 1.08 C ATOM 1391 CD ARG C 100 28.813 -5.871 3.082 1.00 1.14 C ATOM 1392 NE ARG C 100 28.710 -6.567 4.365 1.00 1.20 N ATOM 1393 CZ ARG C 100 29.259 -6.127 5.498 1.00 1.28 C ATOM 1394 NH1 ARG C 100 29.959 -5.000 5.507 1.00 1.42 N ATOM 1395 NH2 ARG C 100 29.114 -6.813 6.621 1.00 1.48 N ATOM 0 H ARG C 100 25.666 -4.202 5.021 1.00 0.84 H new ATOM 0 HA ARG C 100 25.444 -3.586 2.223 1.00 0.88 H new ATOM 0 HB2 ARG C 100 26.254 -6.040 3.817 1.00 0.94 H new ATOM 0 HB3 ARG C 100 26.227 -6.021 2.065 1.00 0.94 H new ATOM 0 HG2 ARG C 100 27.907 -4.256 1.997 1.00 1.08 H new ATOM 0 HG3 ARG C 100 27.846 -4.071 3.739 1.00 1.08 H new ATOM 0 HD2 ARG C 100 28.718 -6.592 2.270 1.00 1.14 H new ATOM 0 HD3 ARG C 100 29.801 -5.419 2.993 1.00 1.14 H new ATOM 0 HE ARG C 100 28.186 -7.442 4.395 1.00 1.20 H new ATOM 0 HH11 ARG C 100 30.079 -4.467 4.646 1.00 1.42 H new ATOM 0 HH12 ARG C 100 30.377 -4.666 6.375 1.00 1.42 H new ATOM 0 HH21 ARG C 100 28.580 -7.682 6.622 1.00 1.48 H new ATOM 0 HH22 ARG C 100 29.536 -6.472 7.485 1.00 1.48 H new ATOM 1409 N ILE C 101 23.517 -4.978 1.396 1.00 0.88 N ATOM 1410 CA ILE C 101 22.267 -5.577 0.981 1.00 0.86 C ATOM 1411 C ILE C 101 22.418 -7.085 0.803 1.00 0.90 C ATOM 1412 O ILE C 101 23.340 -7.568 0.135 1.00 0.95 O ATOM 1413 CB ILE C 101 21.748 -4.933 -0.320 1.00 0.87 C ATOM 1414 CG1 ILE C 101 21.456 -3.449 -0.082 1.00 0.83 C ATOM 1415 CG2 ILE C 101 20.500 -5.649 -0.819 1.00 0.90 C ATOM 1416 CD1 ILE C 101 21.028 -2.709 -1.326 1.00 0.84 C ATOM 0 H ILE C 101 24.050 -4.542 0.644 1.00 0.88 H new ATOM 0 HA ILE C 101 21.535 -5.394 1.768 1.00 0.86 H new ATOM 0 HB ILE C 101 22.517 -5.026 -1.087 1.00 0.87 H new ATOM 0 HG12 ILE C 101 20.674 -3.358 0.672 1.00 0.83 H new ATOM 0 HG13 ILE C 101 22.348 -2.973 0.325 1.00 0.83 H new ATOM 0 HG21 ILE C 101 20.152 -5.177 -1.738 1.00 0.90 H new ATOM 0 HG22 ILE C 101 20.735 -6.695 -1.015 1.00 0.90 H new ATOM 0 HG23 ILE C 101 19.718 -5.588 -0.062 1.00 0.90 H new ATOM 0 HD11 ILE C 101 20.838 -1.664 -1.081 1.00 0.84 H new ATOM 0 HD12 ILE C 101 21.818 -2.768 -2.075 1.00 0.84 H new ATOM 0 HD13 ILE C 101 20.118 -3.159 -1.722 1.00 0.84 H new ATOM 1428 N ARG C 102 21.524 -7.822 1.441 1.00 0.89 N ATOM 1429 CA ARG C 102 21.519 -9.274 1.372 1.00 0.92 C ATOM 1430 C ARG C 102 20.162 -9.738 0.864 1.00 0.91 C ATOM 1431 O ARG C 102 19.278 -8.915 0.631 1.00 0.90 O ATOM 1432 CB ARG C 102 21.798 -9.884 2.750 1.00 0.95 C ATOM 1433 CG ARG C 102 23.136 -9.476 3.355 1.00 1.01 C ATOM 1434 CD ARG C 102 24.296 -10.240 2.734 1.00 1.09 C ATOM 1435 NE ARG C 102 24.596 -9.786 1.375 1.00 1.15 N ATOM 1436 CZ ARG C 102 25.295 -10.497 0.492 1.00 1.37 C ATOM 1437 NH1 ARG C 102 25.777 -11.691 0.818 1.00 1.55 N ATOM 1438 NH2 ARG C 102 25.513 -10.017 -0.721 1.00 1.48 N ATOM 0 H ARG C 102 20.782 -7.431 2.021 1.00 0.89 H new ATOM 0 HA ARG C 102 22.304 -9.603 0.691 1.00 0.92 H new ATOM 0 HB2 ARG C 102 21.000 -9.592 3.432 1.00 0.95 H new ATOM 0 HB3 ARG C 102 21.766 -10.970 2.667 1.00 0.95 H new ATOM 0 HG2 ARG C 102 23.288 -8.406 3.212 1.00 1.01 H new ATOM 0 HG3 ARG C 102 23.118 -9.654 4.430 1.00 1.01 H new ATOM 0 HD2 ARG C 102 25.182 -10.122 3.358 1.00 1.09 H new ATOM 0 HD3 ARG C 102 24.059 -11.304 2.715 1.00 1.09 H new ATOM 0 HE ARG C 102 24.249 -8.871 1.087 1.00 1.15 H new ATOM 0 HH11 ARG C 102 25.613 -12.070 1.751 1.00 1.55 H new ATOM 0 HH12 ARG C 102 26.311 -12.229 0.136 1.00 1.55 H new ATOM 0 HH21 ARG C 102 25.146 -9.102 -0.981 1.00 1.48 H new ATOM 0 HH22 ARG C 102 26.048 -10.562 -1.397 1.00 1.48 H new ATOM 1452 N ALA C 103 19.986 -11.045 0.720 1.00 0.94 N ATOM 1453 CA ALA C 103 18.722 -11.598 0.239 1.00 0.96 C ATOM 1454 C ALA C 103 17.674 -11.616 1.353 1.00 0.94 C ATOM 1455 O ALA C 103 17.068 -12.647 1.641 1.00 1.30 O ATOM 1456 CB ALA C 103 18.939 -13.000 -0.319 1.00 1.06 C ATOM 0 H ALA C 103 20.700 -11.743 0.928 1.00 0.94 H new ATOM 0 HA ALA C 103 18.349 -10.958 -0.561 1.00 0.96 H new ATOM 0 HB1 ALA C 103 17.990 -13.401 -0.674 1.00 1.06 H new ATOM 0 HB2 ALA C 103 19.647 -12.957 -1.147 1.00 1.06 H new ATOM 0 HB3 ALA C 103 19.336 -13.646 0.464 1.00 1.06 H new ATOM 1462 N TYR C 104 17.474 -10.464 1.978 1.00 0.87 N ATOM 1463 CA TYR C 104 16.512 -10.330 3.062 1.00 0.81 C ATOM 1464 C TYR C 104 15.903 -8.928 3.061 1.00 0.74 C ATOM 1465 O TYR C 104 15.278 -8.501 4.032 1.00 0.82 O ATOM 1466 CB TYR C 104 17.191 -10.631 4.411 1.00 0.86 C ATOM 1467 CG TYR C 104 16.247 -10.658 5.597 1.00 0.89 C ATOM 1468 CD1 TYR C 104 15.176 -11.543 5.640 1.00 0.98 C ATOM 1469 CD2 TYR C 104 16.422 -9.790 6.668 1.00 0.90 C ATOM 1470 CE1 TYR C 104 14.308 -11.561 6.716 1.00 1.08 C ATOM 1471 CE2 TYR C 104 15.559 -9.802 7.746 1.00 1.00 C ATOM 1472 CZ TYR C 104 14.503 -10.688 7.766 1.00 1.08 C ATOM 1473 OH TYR C 104 13.639 -10.699 8.840 1.00 1.23 O ATOM 0 H TYR C 104 17.970 -9.602 1.750 1.00 0.87 H new ATOM 0 HA TYR C 104 15.708 -11.050 2.913 1.00 0.81 H new ATOM 0 HB2 TYR C 104 17.696 -11.595 4.342 1.00 0.86 H new ATOM 0 HB3 TYR C 104 17.960 -9.880 4.592 1.00 0.86 H new ATOM 0 HD1 TYR C 104 15.019 -12.228 4.820 1.00 0.98 H new ATOM 0 HD2 TYR C 104 17.248 -9.094 6.657 1.00 0.90 H new ATOM 0 HE1 TYR C 104 13.481 -12.255 6.734 1.00 1.08 H new ATOM 0 HE2 TYR C 104 15.711 -9.120 8.570 1.00 1.00 H new ATOM 0 HH TYR C 104 13.919 -10.023 9.492 1.00 1.23 H new ATOM 1483 N GLU C 105 16.085 -8.202 1.966 1.00 0.87 N ATOM 1484 CA GLU C 105 15.531 -6.863 1.874 1.00 0.84 C ATOM 1485 C GLU C 105 14.057 -6.943 1.498 1.00 0.74 C ATOM 1486 O GLU C 105 13.217 -6.339 2.161 1.00 0.74 O ATOM 1487 CB GLU C 105 16.312 -5.980 0.883 1.00 0.96 C ATOM 1488 CG GLU C 105 17.070 -6.738 -0.196 1.00 1.04 C ATOM 1489 CD GLU C 105 16.152 -7.457 -1.157 1.00 1.16 C ATOM 1490 OE1 GLU C 105 15.444 -6.782 -1.925 1.00 1.43 O ATOM 1491 OE2 GLU C 105 16.119 -8.705 -1.122 1.00 1.55 O ATOM 0 H GLU C 105 16.603 -8.513 1.144 1.00 0.87 H new ATOM 0 HA GLU C 105 15.624 -6.389 2.851 1.00 0.84 H new ATOM 0 HB2 GLU C 105 15.614 -5.295 0.402 1.00 0.96 H new ATOM 0 HB3 GLU C 105 17.021 -5.371 1.444 1.00 0.96 H new ATOM 0 HG2 GLU C 105 17.697 -6.041 -0.752 1.00 1.04 H new ATOM 0 HG3 GLU C 105 17.736 -7.461 0.274 1.00 1.04 H new ATOM 1498 N MET C 106 13.759 -7.714 0.446 1.00 0.74 N ATOM 1499 CA MET C 106 12.393 -7.909 -0.037 1.00 0.75 C ATOM 1500 C MET C 106 11.682 -6.570 -0.198 1.00 0.66 C ATOM 1501 O MET C 106 10.498 -6.430 0.117 1.00 0.73 O ATOM 1502 CB MET C 106 11.622 -8.828 0.918 1.00 0.84 C ATOM 1503 CG MET C 106 12.256 -10.203 1.058 1.00 0.94 C ATOM 1504 SD MET C 106 11.406 -11.254 2.256 1.00 1.07 S ATOM 1505 CE MET C 106 12.531 -12.648 2.332 1.00 1.19 C ATOM 0 H MET C 106 14.462 -8.220 -0.093 1.00 0.74 H new ATOM 0 HA MET C 106 12.433 -8.385 -1.017 1.00 0.75 H new ATOM 0 HB2 MET C 106 11.566 -8.358 1.900 1.00 0.84 H new ATOM 0 HB3 MET C 106 10.599 -8.940 0.559 1.00 0.84 H new ATOM 0 HG2 MET C 106 12.257 -10.697 0.086 1.00 0.94 H new ATOM 0 HG3 MET C 106 13.297 -10.088 1.359 1.00 0.94 H new ATOM 0 HE1 MET C 106 12.146 -13.389 3.033 1.00 1.19 H new ATOM 0 HE2 MET C 106 12.622 -13.097 1.343 1.00 1.19 H new ATOM 0 HE3 MET C 106 13.511 -12.307 2.667 1.00 1.19 H new ATOM 1515 N THR C 107 12.417 -5.593 -0.703 1.00 0.59 N ATOM 1516 CA THR C 107 11.885 -4.260 -0.894 1.00 0.52 C ATOM 1517 C THR C 107 11.287 -4.114 -2.291 1.00 0.54 C ATOM 1518 O THR C 107 11.433 -4.999 -3.136 1.00 0.68 O ATOM 1519 CB THR C 107 12.977 -3.191 -0.661 1.00 0.55 C ATOM 1520 OG1 THR C 107 12.379 -1.915 -0.385 1.00 0.56 O ATOM 1521 CG2 THR C 107 13.903 -3.072 -1.866 1.00 0.70 C ATOM 0 H THR C 107 13.390 -5.703 -0.989 1.00 0.59 H new ATOM 0 HA THR C 107 11.094 -4.105 -0.160 1.00 0.52 H new ATOM 0 HB THR C 107 13.568 -3.507 0.198 1.00 0.55 H new ATOM 0 HG1 THR C 107 13.083 -1.249 -0.238 1.00 0.56 H new ATOM 0 HG21 THR C 107 14.659 -2.312 -1.670 1.00 0.70 H new ATOM 0 HG22 THR C 107 14.390 -4.030 -2.047 1.00 0.70 H new ATOM 0 HG23 THR C 107 13.323 -2.788 -2.744 1.00 0.70 H new ATOM 1529 N MET C 108 10.611 -3.002 -2.526 1.00 0.52 N ATOM 1530 CA MET C 108 9.982 -2.743 -3.810 1.00 0.55 C ATOM 1531 C MET C 108 10.993 -2.181 -4.802 1.00 0.58 C ATOM 1532 O MET C 108 12.134 -1.884 -4.440 1.00 0.63 O ATOM 1533 CB MET C 108 8.812 -1.771 -3.643 1.00 0.55 C ATOM 1534 CG MET C 108 7.693 -2.301 -2.758 1.00 0.64 C ATOM 1535 SD MET C 108 8.030 -2.079 -0.997 1.00 1.11 S ATOM 1536 CE MET C 108 6.500 -2.674 -0.282 1.00 1.04 C ATOM 0 H MET C 108 10.483 -2.259 -1.839 1.00 0.52 H new ATOM 0 HA MET C 108 9.603 -3.687 -4.201 1.00 0.55 H new ATOM 0 HB2 MET C 108 9.185 -0.838 -3.221 1.00 0.55 H new ATOM 0 HB3 MET C 108 8.404 -1.536 -4.626 1.00 0.55 H new ATOM 0 HG2 MET C 108 6.763 -1.793 -3.012 1.00 0.64 H new ATOM 0 HG3 MET C 108 7.544 -3.361 -2.964 1.00 0.64 H new ATOM 0 HE1 MET C 108 6.553 -2.601 0.804 1.00 1.04 H new ATOM 0 HE2 MET C 108 5.669 -2.070 -0.646 1.00 1.04 H new ATOM 0 HE3 MET C 108 6.345 -3.714 -0.568 1.00 1.04 H new ATOM 1546 N ARG C 109 10.576 -2.042 -6.050 1.00 0.60 N ATOM 1547 CA ARG C 109 11.449 -1.513 -7.088 1.00 0.66 C ATOM 1548 C ARG C 109 11.608 -0.003 -6.935 1.00 0.63 C ATOM 1549 O ARG C 109 10.783 0.770 -7.420 1.00 0.72 O ATOM 1550 CB ARG C 109 10.893 -1.848 -8.473 1.00 0.76 C ATOM 1551 CG ARG C 109 11.922 -1.745 -9.589 1.00 0.88 C ATOM 1552 CD ARG C 109 12.893 -2.915 -9.561 1.00 1.00 C ATOM 1553 NE ARG C 109 13.905 -2.813 -10.612 1.00 1.13 N ATOM 1554 CZ ARG C 109 14.120 -3.746 -11.546 1.00 1.29 C ATOM 1555 NH1 ARG C 109 13.392 -4.859 -11.570 1.00 1.48 N ATOM 1556 NH2 ARG C 109 15.068 -3.566 -12.454 1.00 1.48 N ATOM 0 H ARG C 109 9.639 -2.288 -6.370 1.00 0.60 H new ATOM 0 HA ARG C 109 12.429 -1.978 -6.983 1.00 0.66 H new ATOM 0 HB2 ARG C 109 10.488 -2.860 -8.457 1.00 0.76 H new ATOM 0 HB3 ARG C 109 10.063 -1.176 -8.693 1.00 0.76 H new ATOM 0 HG2 ARG C 109 11.414 -1.716 -10.553 1.00 0.88 H new ATOM 0 HG3 ARG C 109 12.474 -0.810 -9.491 1.00 0.88 H new ATOM 0 HD2 ARG C 109 13.383 -2.956 -8.588 1.00 1.00 H new ATOM 0 HD3 ARG C 109 12.341 -3.847 -9.679 1.00 1.00 H new ATOM 0 HE ARG C 109 14.485 -1.975 -10.634 1.00 1.13 H new ATOM 0 HH11 ARG C 109 12.663 -5.006 -10.872 1.00 1.48 H new ATOM 0 HH12 ARG C 109 13.563 -5.565 -12.286 1.00 1.48 H new ATOM 0 HH21 ARG C 109 15.633 -2.717 -12.440 1.00 1.48 H new ATOM 0 HH22 ARG C 109 15.233 -4.277 -13.167 1.00 1.48 H new ATOM 1570 N VAL C 110 12.655 0.404 -6.233 1.00 0.64 N ATOM 1571 CA VAL C 110 12.933 1.819 -6.018 1.00 0.62 C ATOM 1572 C VAL C 110 13.608 2.419 -7.252 1.00 0.70 C ATOM 1573 O VAL C 110 14.099 1.682 -8.115 1.00 0.79 O ATOM 1574 CB VAL C 110 13.825 2.040 -4.771 1.00 0.66 C ATOM 1575 CG1 VAL C 110 13.770 3.486 -4.307 1.00 1.02 C ATOM 1576 CG2 VAL C 110 13.411 1.112 -3.643 1.00 0.87 C ATOM 0 H VAL C 110 13.329 -0.227 -5.800 1.00 0.64 H new ATOM 0 HA VAL C 110 11.981 2.321 -5.846 1.00 0.62 H new ATOM 0 HB VAL C 110 14.852 1.810 -5.054 1.00 0.66 H new ATOM 0 HG11 VAL C 110 14.406 3.611 -3.430 1.00 1.02 H new ATOM 0 HG12 VAL C 110 14.122 4.138 -5.106 1.00 1.02 H new ATOM 0 HG13 VAL C 110 12.743 3.747 -4.051 1.00 1.02 H new ATOM 0 HG21 VAL C 110 14.050 1.284 -2.777 1.00 0.87 H new ATOM 0 HG22 VAL C 110 12.373 1.308 -3.373 1.00 0.87 H new ATOM 0 HG23 VAL C 110 13.511 0.077 -3.968 1.00 0.87 H new ATOM 1586 N LYS C 111 13.617 3.748 -7.332 1.00 0.73 N ATOM 1587 CA LYS C 111 14.220 4.461 -8.455 1.00 0.83 C ATOM 1588 C LYS C 111 15.652 4.007 -8.719 1.00 0.85 C ATOM 1589 O LYS C 111 15.941 3.445 -9.771 1.00 0.93 O ATOM 1590 CB LYS C 111 14.206 5.971 -8.204 1.00 0.89 C ATOM 1591 CG LYS C 111 12.826 6.605 -8.267 1.00 0.89 C ATOM 1592 CD LYS C 111 12.905 8.118 -8.115 1.00 0.99 C ATOM 1593 CE LYS C 111 13.652 8.762 -9.276 1.00 1.22 C ATOM 1594 NZ LYS C 111 13.617 10.246 -9.204 1.00 1.41 N ATOM 0 H LYS C 111 13.209 4.358 -6.624 1.00 0.73 H new ATOM 0 HA LYS C 111 13.621 4.229 -9.336 1.00 0.83 H new ATOM 0 HB2 LYS C 111 14.639 6.168 -7.223 1.00 0.89 H new ATOM 0 HB3 LYS C 111 14.849 6.455 -8.939 1.00 0.89 H new ATOM 0 HG2 LYS C 111 12.353 6.357 -9.217 1.00 0.89 H new ATOM 0 HG3 LYS C 111 12.197 6.191 -7.479 1.00 0.89 H new ATOM 0 HD2 LYS C 111 11.898 8.531 -8.056 1.00 0.99 H new ATOM 0 HD3 LYS C 111 13.406 8.364 -7.179 1.00 0.99 H new ATOM 0 HE2 LYS C 111 14.688 8.423 -9.274 1.00 1.22 H new ATOM 0 HE3 LYS C 111 13.211 8.434 -10.217 1.00 1.22 H new ATOM 0 HZ1 LYS C 111 13.653 10.641 -10.165 1.00 1.41 H new ATOM 0 HZ2 LYS C 111 12.739 10.550 -8.737 1.00 1.41 H new ATOM 0 HZ3 LYS C 111 14.435 10.587 -8.659 1.00 1.41 H new ATOM 1608 N ASP C 112 16.544 4.241 -7.765 1.00 0.80 N ATOM 1609 CA ASP C 112 17.944 3.869 -7.939 1.00 0.83 C ATOM 1610 C ASP C 112 18.436 2.965 -6.818 1.00 0.79 C ATOM 1611 O ASP C 112 18.811 1.817 -7.055 1.00 0.80 O ATOM 1612 CB ASP C 112 18.819 5.123 -8.015 1.00 0.94 C ATOM 1613 CG ASP C 112 20.302 4.801 -7.982 1.00 0.96 C ATOM 1614 OD1 ASP C 112 20.787 4.119 -8.908 1.00 1.16 O ATOM 1615 OD2 ASP C 112 20.987 5.226 -7.029 1.00 0.98 O ATOM 0 H ASP C 112 16.327 4.682 -6.871 1.00 0.80 H new ATOM 0 HA ASP C 112 18.019 3.313 -8.873 1.00 0.83 H new ATOM 0 HB2 ASP C 112 18.589 5.667 -8.931 1.00 0.94 H new ATOM 0 HB3 ASP C 112 18.575 5.783 -7.182 1.00 0.94 H new ATOM 1620 N LYS C 113 18.438 3.486 -5.602 1.00 0.83 N ATOM 1621 CA LYS C 113 18.910 2.727 -4.454 1.00 0.85 C ATOM 1622 C LYS C 113 17.764 2.019 -3.747 1.00 0.74 C ATOM 1623 O LYS C 113 16.772 2.640 -3.368 1.00 0.73 O ATOM 1624 CB LYS C 113 19.648 3.646 -3.475 1.00 0.96 C ATOM 1625 CG LYS C 113 18.915 4.948 -3.174 1.00 0.99 C ATOM 1626 CD LYS C 113 19.723 6.159 -3.614 1.00 1.20 C ATOM 1627 CE LYS C 113 19.037 7.466 -3.244 1.00 1.15 C ATOM 1628 NZ LYS C 113 19.814 8.650 -3.698 1.00 1.42 N ATOM 0 H LYS C 113 18.119 4.430 -5.384 1.00 0.83 H new ATOM 0 HA LYS C 113 19.601 1.967 -4.819 1.00 0.85 H new ATOM 0 HB2 LYS C 113 19.811 3.109 -2.541 1.00 0.96 H new ATOM 0 HB3 LYS C 113 20.631 3.881 -3.884 1.00 0.96 H new ATOM 0 HG2 LYS C 113 17.951 4.949 -3.682 1.00 0.99 H new ATOM 0 HG3 LYS C 113 18.712 5.014 -2.105 1.00 0.99 H new ATOM 0 HD2 LYS C 113 20.710 6.124 -3.152 1.00 1.20 H new ATOM 0 HD3 LYS C 113 19.874 6.122 -4.693 1.00 1.20 H new ATOM 0 HE2 LYS C 113 18.042 7.492 -3.689 1.00 1.15 H new ATOM 0 HE3 LYS C 113 18.904 7.512 -2.163 1.00 1.15 H new ATOM 0 HZ1 LYS C 113 19.312 9.520 -3.426 1.00 1.42 H new ATOM 0 HZ2 LYS C 113 20.754 8.639 -3.254 1.00 1.42 H new ATOM 0 HZ3 LYS C 113 19.920 8.620 -4.732 1.00 1.42 H new ATOM 1642 N VAL C 114 17.904 0.714 -3.586 1.00 0.73 N ATOM 1643 CA VAL C 114 16.895 -0.081 -2.908 1.00 0.67 C ATOM 1644 C VAL C 114 17.187 -0.127 -1.410 1.00 0.68 C ATOM 1645 O VAL C 114 18.328 -0.335 -0.997 1.00 0.86 O ATOM 1646 CB VAL C 114 16.811 -1.514 -3.475 1.00 0.72 C ATOM 1647 CG1 VAL C 114 16.083 -1.515 -4.812 1.00 0.69 C ATOM 1648 CG2 VAL C 114 18.196 -2.120 -3.625 1.00 0.85 C ATOM 0 H VAL C 114 18.709 0.182 -3.917 1.00 0.73 H new ATOM 0 HA VAL C 114 15.930 0.396 -3.079 1.00 0.67 H new ATOM 0 HB VAL C 114 16.247 -2.125 -2.770 1.00 0.72 H new ATOM 0 HG11 VAL C 114 16.033 -2.533 -5.198 1.00 0.69 H new ATOM 0 HG12 VAL C 114 15.073 -1.128 -4.677 1.00 0.69 H new ATOM 0 HG13 VAL C 114 16.621 -0.885 -5.520 1.00 0.69 H new ATOM 0 HG21 VAL C 114 18.110 -3.130 -4.026 1.00 0.85 H new ATOM 0 HG22 VAL C 114 18.789 -1.509 -4.305 1.00 0.85 H new ATOM 0 HG23 VAL C 114 18.684 -2.157 -2.651 1.00 0.85 H new ATOM 1658 N TYR C 115 16.159 0.076 -0.604 1.00 0.64 N ATOM 1659 CA TYR C 115 16.317 0.080 0.845 1.00 0.63 C ATOM 1660 C TYR C 115 15.870 -1.244 1.455 1.00 0.64 C ATOM 1661 O TYR C 115 15.438 -2.151 0.750 1.00 0.91 O ATOM 1662 CB TYR C 115 15.504 1.224 1.456 1.00 0.63 C ATOM 1663 CG TYR C 115 15.620 2.533 0.701 1.00 0.69 C ATOM 1664 CD1 TYR C 115 16.724 3.356 0.869 1.00 0.85 C ATOM 1665 CD2 TYR C 115 14.627 2.942 -0.180 1.00 0.85 C ATOM 1666 CE1 TYR C 115 16.835 4.550 0.181 1.00 0.99 C ATOM 1667 CE2 TYR C 115 14.733 4.131 -0.873 1.00 0.93 C ATOM 1668 CZ TYR C 115 15.839 4.931 -0.688 1.00 0.93 C ATOM 1669 OH TYR C 115 15.960 6.116 -1.384 1.00 1.09 O ATOM 0 H TYR C 115 15.205 0.240 -0.926 1.00 0.64 H new ATOM 0 HA TYR C 115 17.375 0.220 1.066 1.00 0.63 H new ATOM 0 HB2 TYR C 115 14.455 0.930 1.495 1.00 0.63 H new ATOM 0 HB3 TYR C 115 15.830 1.379 2.484 1.00 0.63 H new ATOM 0 HD1 TYR C 115 17.509 3.059 1.548 1.00 0.85 H new ATOM 0 HD2 TYR C 115 13.757 2.319 -0.325 1.00 0.85 H new ATOM 0 HE1 TYR C 115 17.700 5.181 0.325 1.00 0.99 H new ATOM 0 HE2 TYR C 115 13.953 4.432 -1.557 1.00 0.93 H new ATOM 0 HH TYR C 115 15.498 6.038 -2.245 1.00 1.09 H new ATOM 1679 N HIS C 116 15.991 -1.347 2.770 1.00 0.56 N ATOM 1680 CA HIS C 116 15.571 -2.547 3.487 1.00 0.54 C ATOM 1681 C HIS C 116 14.063 -2.495 3.703 1.00 0.51 C ATOM 1682 O HIS C 116 13.469 -1.429 3.587 1.00 0.50 O ATOM 1683 CB HIS C 116 16.281 -2.640 4.847 1.00 0.57 C ATOM 1684 CG HIS C 116 17.677 -3.179 4.785 1.00 0.61 C ATOM 1685 ND1 HIS C 116 18.794 -2.430 5.083 1.00 0.63 N ATOM 1686 CD2 HIS C 116 18.132 -4.416 4.480 1.00 0.67 C ATOM 1687 CE1 HIS C 116 19.872 -3.184 4.963 1.00 0.68 C ATOM 1688 NE2 HIS C 116 19.501 -4.400 4.602 1.00 0.71 N ATOM 0 H HIS C 116 16.377 -0.614 3.365 1.00 0.56 H new ATOM 0 HA HIS C 116 15.835 -3.424 2.897 1.00 0.54 H new ATOM 0 HB2 HIS C 116 16.308 -1.647 5.297 1.00 0.57 H new ATOM 0 HB3 HIS C 116 15.690 -3.273 5.508 1.00 0.57 H new ATOM 0 HD2 HIS C 116 17.528 -5.264 4.192 1.00 0.67 H new ATOM 0 HE1 HIS C 116 20.888 -2.860 5.132 1.00 0.68 H new ATOM 0 HE2 HIS C 116 20.124 -5.191 4.441 1.00 0.71 H new ATOM 1696 N LEU C 117 13.442 -3.628 4.020 1.00 0.53 N ATOM 1697 CA LEU C 117 12.001 -3.645 4.266 1.00 0.54 C ATOM 1698 C LEU C 117 11.696 -2.862 5.540 1.00 0.54 C ATOM 1699 O LEU C 117 10.622 -2.286 5.696 1.00 0.61 O ATOM 1700 CB LEU C 117 11.463 -5.086 4.360 1.00 0.60 C ATOM 1701 CG LEU C 117 11.877 -5.882 5.605 1.00 0.71 C ATOM 1702 CD1 LEU C 117 10.751 -5.905 6.629 1.00 0.90 C ATOM 1703 CD2 LEU C 117 12.272 -7.302 5.222 1.00 1.03 C ATOM 0 H LEU C 117 13.904 -4.533 4.112 1.00 0.53 H new ATOM 0 HA LEU C 117 11.496 -3.170 3.425 1.00 0.54 H new ATOM 0 HB2 LEU C 117 10.374 -5.049 4.323 1.00 0.60 H new ATOM 0 HB3 LEU C 117 11.793 -5.634 3.477 1.00 0.60 H new ATOM 0 HG LEU C 117 12.739 -5.389 6.053 1.00 0.71 H new ATOM 0 HD11 LEU C 117 11.066 -6.475 7.503 1.00 0.90 H new ATOM 0 HD12 LEU C 117 10.510 -4.885 6.928 1.00 0.90 H new ATOM 0 HD13 LEU C 117 9.869 -6.372 6.190 1.00 0.90 H new ATOM 0 HD21 LEU C 117 12.563 -7.853 6.117 1.00 1.03 H new ATOM 0 HD22 LEU C 117 11.426 -7.800 4.749 1.00 1.03 H new ATOM 0 HD23 LEU C 117 13.111 -7.271 4.526 1.00 1.03 H new ATOM 1715 N GLU C 118 12.669 -2.839 6.438 1.00 0.52 N ATOM 1716 CA GLU C 118 12.542 -2.119 7.693 1.00 0.55 C ATOM 1717 C GLU C 118 12.974 -0.666 7.509 1.00 0.52 C ATOM 1718 O GLU C 118 12.625 0.213 8.300 1.00 0.54 O ATOM 1719 CB GLU C 118 13.405 -2.793 8.756 1.00 0.63 C ATOM 1720 CG GLU C 118 14.883 -2.803 8.407 1.00 0.60 C ATOM 1721 CD GLU C 118 15.532 -4.149 8.626 1.00 0.81 C ATOM 1722 OE1 GLU C 118 15.906 -4.443 9.779 1.00 1.47 O ATOM 1723 OE2 GLU C 118 15.687 -4.910 7.650 1.00 1.05 O ATOM 0 H GLU C 118 13.563 -3.316 6.318 1.00 0.52 H new ATOM 0 HA GLU C 118 11.500 -2.135 8.014 1.00 0.55 H new ATOM 0 HB2 GLU C 118 13.266 -2.279 9.707 1.00 0.63 H new ATOM 0 HB3 GLU C 118 13.064 -3.819 8.895 1.00 0.63 H new ATOM 0 HG2 GLU C 118 15.006 -2.512 7.364 1.00 0.60 H new ATOM 0 HG3 GLU C 118 15.398 -2.055 9.010 1.00 0.60 H new ATOM 1730 N CYS C 119 13.730 -0.426 6.445 1.00 0.52 N ATOM 1731 CA CYS C 119 14.228 0.900 6.136 1.00 0.52 C ATOM 1732 C CYS C 119 13.286 1.624 5.173 1.00 0.49 C ATOM 1733 O CYS C 119 13.500 2.787 4.833 1.00 0.72 O ATOM 1734 CB CYS C 119 15.638 0.799 5.550 1.00 0.56 C ATOM 1735 SG CYS C 119 16.877 0.148 6.725 1.00 0.60 S ATOM 0 H CYS C 119 14.012 -1.144 5.778 1.00 0.52 H new ATOM 0 HA CYS C 119 14.272 1.483 7.056 1.00 0.52 H new ATOM 0 HB2 CYS C 119 15.611 0.156 4.671 1.00 0.56 H new ATOM 0 HB3 CYS C 119 15.953 1.786 5.213 1.00 0.56 H new ATOM 0 HG CYS C 119 17.643 -0.708 6.117 1.00 0.60 H new ATOM 1740 N PHE C 120 12.251 0.921 4.736 1.00 0.43 N ATOM 1741 CA PHE C 120 11.261 1.490 3.835 1.00 0.37 C ATOM 1742 C PHE C 120 10.033 1.902 4.638 1.00 0.35 C ATOM 1743 O PHE C 120 9.025 1.194 4.671 1.00 0.43 O ATOM 1744 CB PHE C 120 10.881 0.480 2.745 1.00 0.38 C ATOM 1745 CG PHE C 120 10.398 1.113 1.467 1.00 0.37 C ATOM 1746 CD1 PHE C 120 11.293 1.431 0.458 1.00 0.45 C ATOM 1747 CD2 PHE C 120 9.053 1.386 1.274 1.00 0.44 C ATOM 1748 CE1 PHE C 120 10.856 2.011 -0.718 1.00 0.50 C ATOM 1749 CE2 PHE C 120 8.610 1.966 0.100 1.00 0.48 C ATOM 1750 CZ PHE C 120 9.514 2.280 -0.897 1.00 0.47 C ATOM 0 H PHE C 120 12.075 -0.050 4.993 1.00 0.43 H new ATOM 0 HA PHE C 120 11.681 2.368 3.344 1.00 0.37 H new ATOM 0 HB2 PHE C 120 11.747 -0.145 2.525 1.00 0.38 H new ATOM 0 HB3 PHE C 120 10.102 -0.179 3.129 1.00 0.38 H new ATOM 0 HD1 PHE C 120 12.344 1.223 0.592 1.00 0.45 H new ATOM 0 HD2 PHE C 120 8.342 1.143 2.050 1.00 0.44 H new ATOM 0 HE1 PHE C 120 11.564 2.254 -1.496 1.00 0.50 H new ATOM 0 HE2 PHE C 120 7.559 2.173 -0.038 1.00 0.48 H new ATOM 0 HZ PHE C 120 9.171 2.735 -1.814 1.00 0.47 H new ATOM 1760 N LYS C 121 10.135 3.043 5.306 1.00 0.34 N ATOM 1761 CA LYS C 121 9.050 3.548 6.131 1.00 0.35 C ATOM 1762 C LYS C 121 8.811 5.030 5.870 1.00 0.34 C ATOM 1763 O LYS C 121 9.705 5.737 5.408 1.00 0.37 O ATOM 1764 CB LYS C 121 9.368 3.317 7.610 1.00 0.41 C ATOM 1765 CG LYS C 121 10.784 3.721 8.000 1.00 0.50 C ATOM 1766 CD LYS C 121 11.096 3.343 9.439 1.00 0.87 C ATOM 1767 CE LYS C 121 12.560 3.584 9.784 1.00 1.03 C ATOM 1768 NZ LYS C 121 13.477 2.738 8.975 1.00 1.35 N ATOM 0 H LYS C 121 10.963 3.638 5.291 1.00 0.34 H new ATOM 0 HA LYS C 121 8.140 3.007 5.871 1.00 0.35 H new ATOM 0 HB2 LYS C 121 8.659 3.879 8.218 1.00 0.41 H new ATOM 0 HB3 LYS C 121 9.223 2.262 7.844 1.00 0.41 H new ATOM 0 HG2 LYS C 121 11.498 3.238 7.333 1.00 0.50 H new ATOM 0 HG3 LYS C 121 10.905 4.797 7.871 1.00 0.50 H new ATOM 0 HD2 LYS C 121 10.464 3.923 10.112 1.00 0.87 H new ATOM 0 HD3 LYS C 121 10.853 2.293 9.599 1.00 0.87 H new ATOM 0 HE2 LYS C 121 12.801 4.635 9.622 1.00 1.03 H new ATOM 0 HE3 LYS C 121 12.720 3.380 10.843 1.00 1.03 H new ATOM 0 HZ1 LYS C 121 14.383 2.631 9.475 1.00 1.35 H new ATOM 0 HZ2 LYS C 121 13.048 1.801 8.831 1.00 1.35 H new ATOM 0 HZ3 LYS C 121 13.642 3.189 8.053 1.00 1.35 H new ATOM 1782 N CYS C 122 7.599 5.486 6.160 1.00 0.33 N ATOM 1783 CA CYS C 122 7.237 6.880 5.964 1.00 0.32 C ATOM 1784 C CYS C 122 7.985 7.775 6.945 1.00 0.35 C ATOM 1785 O CYS C 122 8.276 7.377 8.077 1.00 0.39 O ATOM 1786 CB CYS C 122 5.729 7.063 6.143 1.00 0.32 C ATOM 1787 SG CYS C 122 5.121 8.749 5.799 1.00 0.35 S ATOM 0 H CYS C 122 6.848 4.906 6.534 1.00 0.33 H new ATOM 0 HA CYS C 122 7.516 7.166 4.950 1.00 0.32 H new ATOM 0 HB2 CYS C 122 5.211 6.363 5.487 1.00 0.32 H new ATOM 0 HB3 CYS C 122 5.463 6.797 7.166 1.00 0.32 H new ATOM 0 HG CYS C 122 3.972 8.681 5.195 1.00 0.35 H new ATOM 1792 N ALA C 123 8.277 8.986 6.507 1.00 0.37 N ATOM 1793 CA ALA C 123 8.988 9.953 7.327 1.00 0.42 C ATOM 1794 C ALA C 123 8.018 10.813 8.131 1.00 0.46 C ATOM 1795 O ALA C 123 8.431 11.564 9.013 1.00 0.54 O ATOM 1796 CB ALA C 123 9.871 10.829 6.453 1.00 0.45 C ATOM 0 H ALA C 123 8.030 9.327 5.578 1.00 0.37 H new ATOM 0 HA ALA C 123 9.615 9.406 8.032 1.00 0.42 H new ATOM 0 HB1 ALA C 123 10.399 11.550 7.077 1.00 0.45 H new ATOM 0 HB2 ALA C 123 10.594 10.206 5.926 1.00 0.45 H new ATOM 0 HB3 ALA C 123 9.254 11.360 5.728 1.00 0.45 H new ATOM 1802 N ALA C 124 6.730 10.691 7.846 1.00 0.41 N ATOM 1803 CA ALA C 124 5.734 11.481 8.553 1.00 0.46 C ATOM 1804 C ALA C 124 4.870 10.638 9.490 1.00 0.47 C ATOM 1805 O ALA C 124 4.802 10.921 10.691 1.00 0.56 O ATOM 1806 CB ALA C 124 4.873 12.244 7.565 1.00 0.47 C ATOM 0 H ALA C 124 6.353 10.060 7.139 1.00 0.41 H new ATOM 0 HA ALA C 124 6.272 12.190 9.182 1.00 0.46 H new ATOM 0 HB1 ALA C 124 4.131 12.831 8.106 1.00 0.47 H new ATOM 0 HB2 ALA C 124 5.501 12.909 6.973 1.00 0.47 H new ATOM 0 HB3 ALA C 124 4.367 11.540 6.904 1.00 0.47 H new ATOM 1812 N CYS C 125 4.209 9.608 8.965 1.00 0.43 N ATOM 1813 CA CYS C 125 3.356 8.773 9.805 1.00 0.45 C ATOM 1814 C CYS C 125 4.062 7.481 10.211 1.00 0.43 C ATOM 1815 O CYS C 125 3.616 6.783 11.122 1.00 0.46 O ATOM 1816 CB CYS C 125 2.017 8.480 9.114 1.00 0.45 C ATOM 1817 SG CYS C 125 2.116 7.386 7.662 1.00 0.41 S ATOM 0 H CYS C 125 4.246 9.336 7.983 1.00 0.43 H new ATOM 0 HA CYS C 125 3.147 9.331 10.718 1.00 0.45 H new ATOM 0 HB2 CYS C 125 1.342 8.031 9.842 1.00 0.45 H new ATOM 0 HB3 CYS C 125 1.571 9.426 8.806 1.00 0.45 H new ATOM 0 HG CYS C 125 3.132 7.730 6.928 1.00 0.41 H new ATOM 1822 N GLN C 126 5.164 7.179 9.526 1.00 0.40 N ATOM 1823 CA GLN C 126 5.972 5.982 9.803 1.00 0.40 C ATOM 1824 C GLN C 126 5.202 4.684 9.549 1.00 0.40 C ATOM 1825 O GLN C 126 5.549 3.640 10.103 1.00 0.56 O ATOM 1826 CB GLN C 126 6.484 5.986 11.252 1.00 0.49 C ATOM 1827 CG GLN C 126 7.873 6.580 11.427 1.00 0.53 C ATOM 1828 CD GLN C 126 7.847 8.088 11.554 1.00 0.57 C ATOM 1829 OE1 GLN C 126 7.663 8.627 12.646 1.00 0.71 O ATOM 1830 NE2 GLN C 126 8.046 8.777 10.446 1.00 0.52 N ATOM 0 H GLN C 126 5.525 7.753 8.764 1.00 0.40 H new ATOM 0 HA GLN C 126 6.815 6.019 9.113 1.00 0.40 H new ATOM 0 HB2 GLN C 126 5.782 6.546 11.871 1.00 0.49 H new ATOM 0 HB3 GLN C 126 6.491 4.962 11.625 1.00 0.49 H new ATOM 0 HG2 GLN C 126 8.338 6.152 12.315 1.00 0.53 H new ATOM 0 HG3 GLN C 126 8.494 6.301 10.576 1.00 0.53 H new ATOM 0 HE21 GLN C 126 8.194 8.290 9.562 1.00 0.52 H new ATOM 0 HE22 GLN C 126 8.051 9.797 10.474 1.00 0.52 H new ATOM 1839 N LYS C 127 4.162 4.739 8.732 1.00 0.39 N ATOM 1840 CA LYS C 127 3.382 3.544 8.436 1.00 0.41 C ATOM 1841 C LYS C 127 3.978 2.791 7.253 1.00 0.37 C ATOM 1842 O LYS C 127 4.686 3.370 6.429 1.00 0.41 O ATOM 1843 CB LYS C 127 1.920 3.904 8.157 1.00 0.44 C ATOM 1844 CG LYS C 127 1.216 4.560 9.337 1.00 0.60 C ATOM 1845 CD LYS C 127 1.111 3.619 10.528 1.00 0.93 C ATOM 1846 CE LYS C 127 0.549 4.330 11.752 1.00 1.17 C ATOM 1847 NZ LYS C 127 1.452 5.411 12.233 1.00 1.58 N ATOM 0 H LYS C 127 3.840 5.587 8.266 1.00 0.39 H new ATOM 0 HA LYS C 127 3.415 2.895 9.311 1.00 0.41 H new ATOM 0 HB2 LYS C 127 1.878 4.577 7.300 1.00 0.44 H new ATOM 0 HB3 LYS C 127 1.379 3.000 7.879 1.00 0.44 H new ATOM 0 HG2 LYS C 127 1.759 5.458 9.631 1.00 0.60 H new ATOM 0 HG3 LYS C 127 0.218 4.876 9.034 1.00 0.60 H new ATOM 0 HD2 LYS C 127 0.472 2.775 10.271 1.00 0.93 H new ATOM 0 HD3 LYS C 127 2.096 3.214 10.761 1.00 0.93 H new ATOM 0 HE2 LYS C 127 -0.426 4.753 11.510 1.00 1.17 H new ATOM 0 HE3 LYS C 127 0.392 3.606 12.552 1.00 1.17 H new ATOM 0 HZ1 LYS C 127 1.730 5.219 13.217 1.00 1.58 H new ATOM 0 HZ2 LYS C 127 2.301 5.446 11.634 1.00 1.58 H new ATOM 0 HZ3 LYS C 127 0.956 6.324 12.185 1.00 1.58 H new ATOM 1861 N HIS C 128 3.708 1.494 7.193 1.00 0.40 N ATOM 1862 CA HIS C 128 4.209 0.658 6.111 1.00 0.41 C ATOM 1863 C HIS C 128 3.504 0.994 4.798 1.00 0.39 C ATOM 1864 O HIS C 128 2.334 1.376 4.792 1.00 0.39 O ATOM 1865 CB HIS C 128 4.030 -0.837 6.436 1.00 0.51 C ATOM 1866 CG HIS C 128 2.611 -1.335 6.336 1.00 0.56 C ATOM 1867 ND1 HIS C 128 2.026 -1.715 5.144 1.00 0.68 N ATOM 1868 CD2 HIS C 128 1.665 -1.515 7.287 1.00 0.64 C ATOM 1869 CE1 HIS C 128 0.786 -2.103 5.368 1.00 0.78 C ATOM 1870 NE2 HIS C 128 0.538 -1.995 6.661 1.00 0.76 N ATOM 0 H HIS C 128 3.144 0.997 7.882 1.00 0.40 H new ATOM 0 HA HIS C 128 5.274 0.862 6.002 1.00 0.41 H new ATOM 0 HB2 HIS C 128 4.654 -1.420 5.759 1.00 0.51 H new ATOM 0 HB3 HIS C 128 4.396 -1.022 7.446 1.00 0.51 H new ATOM 0 HD1 HIS C 128 2.482 -1.698 4.232 1.00 0.68 H new ATOM 0 HD2 HIS C 128 1.775 -1.318 8.343 1.00 0.64 H new ATOM 0 HE1 HIS C 128 0.089 -2.451 4.620 1.00 0.78 H new ATOM 0 HE2 HIS C 128 -0.343 -2.229 7.119 1.00 0.76 H new ATOM 1879 N PHE C 129 4.216 0.830 3.697 1.00 0.39 N ATOM 1880 CA PHE C 129 3.661 1.102 2.377 1.00 0.39 C ATOM 1881 C PHE C 129 2.938 -0.130 1.844 1.00 0.48 C ATOM 1882 O PHE C 129 2.897 -1.169 2.511 1.00 0.56 O ATOM 1883 CB PHE C 129 4.772 1.523 1.413 1.00 0.37 C ATOM 1884 CG PHE C 129 5.375 2.863 1.740 1.00 0.28 C ATOM 1885 CD1 PHE C 129 6.247 3.006 2.808 1.00 0.37 C ATOM 1886 CD2 PHE C 129 5.071 3.976 0.976 1.00 0.21 C ATOM 1887 CE1 PHE C 129 6.800 4.233 3.110 1.00 0.40 C ATOM 1888 CE2 PHE C 129 5.622 5.207 1.275 1.00 0.23 C ATOM 1889 CZ PHE C 129 6.488 5.335 2.342 1.00 0.33 C ATOM 0 H PHE C 129 5.184 0.509 3.688 1.00 0.39 H new ATOM 0 HA PHE C 129 2.943 1.918 2.461 1.00 0.39 H new ATOM 0 HB2 PHE C 129 5.558 0.767 1.424 1.00 0.37 H new ATOM 0 HB3 PHE C 129 4.371 1.551 0.400 1.00 0.37 H new ATOM 0 HD1 PHE C 129 6.497 2.146 3.411 1.00 0.37 H new ATOM 0 HD2 PHE C 129 4.396 3.881 0.138 1.00 0.21 H new ATOM 0 HE1 PHE C 129 7.476 4.330 3.946 1.00 0.40 H new ATOM 0 HE2 PHE C 129 5.375 6.069 0.674 1.00 0.23 H new ATOM 0 HZ PHE C 129 6.921 6.297 2.575 1.00 0.33 H new ATOM 1899 N SER C 130 2.373 -0.013 0.652 1.00 0.54 N ATOM 1900 CA SER C 130 1.654 -1.113 0.035 1.00 0.69 C ATOM 1901 C SER C 130 1.835 -1.086 -1.479 1.00 0.60 C ATOM 1902 O SER C 130 2.072 -0.031 -2.066 1.00 0.80 O ATOM 1903 CB SER C 130 0.169 -1.049 0.402 1.00 0.87 C ATOM 1904 OG SER C 130 -0.472 -2.285 0.149 1.00 1.44 O ATOM 0 H SER C 130 2.400 0.839 0.091 1.00 0.54 H new ATOM 0 HA SER C 130 2.063 -2.051 0.411 1.00 0.69 H new ATOM 0 HB2 SER C 130 0.062 -0.789 1.455 1.00 0.87 H new ATOM 0 HB3 SER C 130 -0.317 -0.260 -0.172 1.00 0.87 H new ATOM 0 HG SER C 130 -0.822 -2.291 -0.766 1.00 1.44 H new ATOM 1910 N VAL C 131 1.730 -2.253 -2.097 1.00 0.76 N ATOM 1911 CA VAL C 131 1.890 -2.377 -3.537 1.00 0.73 C ATOM 1912 C VAL C 131 0.633 -1.905 -4.268 1.00 0.65 C ATOM 1913 O VAL C 131 -0.488 -2.278 -3.917 1.00 0.73 O ATOM 1914 CB VAL C 131 2.231 -3.833 -3.950 1.00 0.94 C ATOM 1915 CG1 VAL C 131 1.182 -4.810 -3.439 1.00 1.06 C ATOM 1916 CG2 VAL C 131 2.377 -3.948 -5.463 1.00 0.96 C ATOM 0 H VAL C 131 1.533 -3.133 -1.619 1.00 0.76 H new ATOM 0 HA VAL C 131 2.725 -1.739 -3.825 1.00 0.73 H new ATOM 0 HB VAL C 131 3.185 -4.092 -3.492 1.00 0.94 H new ATOM 0 HG11 VAL C 131 1.448 -5.822 -3.744 1.00 1.06 H new ATOM 0 HG12 VAL C 131 1.137 -4.759 -2.351 1.00 1.06 H new ATOM 0 HG13 VAL C 131 0.209 -4.550 -3.855 1.00 1.06 H new ATOM 0 HG21 VAL C 131 2.616 -4.978 -5.728 1.00 0.96 H new ATOM 0 HG22 VAL C 131 1.442 -3.658 -5.942 1.00 0.96 H new ATOM 0 HG23 VAL C 131 3.178 -3.291 -5.802 1.00 0.96 H new ATOM 1926 N GLY C 132 0.827 -1.067 -5.276 1.00 0.57 N ATOM 1927 CA GLY C 132 -0.293 -0.559 -6.039 1.00 0.58 C ATOM 1928 C GLY C 132 -0.652 0.859 -5.652 1.00 0.52 C ATOM 1929 O GLY C 132 -1.337 1.558 -6.397 1.00 0.61 O ATOM 0 H GLY C 132 1.741 -0.730 -5.579 1.00 0.57 H new ATOM 0 HA2 GLY C 132 -0.052 -0.594 -7.102 1.00 0.58 H new ATOM 0 HA3 GLY C 132 -1.157 -1.205 -5.887 1.00 0.58 H new ATOM 1933 N ASP C 133 -0.193 1.284 -4.484 1.00 0.50 N ATOM 1934 CA ASP C 133 -0.466 2.629 -4.003 1.00 0.49 C ATOM 1935 C ASP C 133 0.630 3.578 -4.474 1.00 0.40 C ATOM 1936 O ASP C 133 1.681 3.141 -4.939 1.00 0.37 O ATOM 1937 CB ASP C 133 -0.580 2.649 -2.473 1.00 0.51 C ATOM 1938 CG ASP C 133 -1.816 1.920 -1.973 1.00 0.73 C ATOM 1939 OD1 ASP C 133 -2.935 2.240 -2.442 1.00 0.85 O ATOM 1940 OD2 ASP C 133 -1.681 1.024 -1.116 1.00 1.06 O ATOM 0 H ASP C 133 0.371 0.716 -3.852 1.00 0.50 H new ATOM 0 HA ASP C 133 -1.420 2.961 -4.413 1.00 0.49 H new ATOM 0 HB2 ASP C 133 0.309 2.190 -2.039 1.00 0.51 H new ATOM 0 HB3 ASP C 133 -0.607 3.682 -2.127 1.00 0.51 H new ATOM 1945 N ARG C 134 0.386 4.873 -4.359 1.00 0.41 N ATOM 1946 CA ARG C 134 1.357 5.868 -4.793 1.00 0.37 C ATOM 1947 C ARG C 134 2.214 6.332 -3.622 1.00 0.31 C ATOM 1948 O ARG C 134 1.812 6.204 -2.466 1.00 0.31 O ATOM 1949 CB ARG C 134 0.642 7.057 -5.444 1.00 0.44 C ATOM 1950 CG ARG C 134 -0.418 7.693 -4.558 1.00 0.64 C ATOM 1951 CD ARG C 134 -1.409 8.525 -5.364 1.00 0.78 C ATOM 1952 NE ARG C 134 -2.197 7.706 -6.288 1.00 1.08 N ATOM 1953 CZ ARG C 134 -3.398 7.197 -6.003 1.00 1.74 C ATOM 1954 NH1 ARG C 134 -3.930 7.358 -4.797 1.00 2.09 N ATOM 1955 NH2 ARG C 134 -4.056 6.501 -6.922 1.00 2.18 N ATOM 0 H ARG C 134 -0.473 5.261 -3.970 1.00 0.41 H new ATOM 0 HA ARG C 134 2.014 5.410 -5.532 1.00 0.37 H new ATOM 0 HB2 ARG C 134 1.381 7.812 -5.710 1.00 0.44 H new ATOM 0 HB3 ARG C 134 0.176 6.726 -6.372 1.00 0.44 H new ATOM 0 HG2 ARG C 134 -0.954 6.913 -4.017 1.00 0.64 H new ATOM 0 HG3 ARG C 134 0.064 8.325 -3.812 1.00 0.64 H new ATOM 0 HD2 ARG C 134 -2.080 9.048 -4.683 1.00 0.78 H new ATOM 0 HD3 ARG C 134 -0.869 9.286 -5.927 1.00 0.78 H new ATOM 0 HE ARG C 134 -1.803 7.512 -7.209 1.00 1.08 H new ATOM 0 HH11 ARG C 134 -3.421 7.874 -4.080 1.00 2.09 H new ATOM 0 HH12 ARG C 134 -4.848 6.966 -4.588 1.00 2.09 H new ATOM 0 HH21 ARG C 134 -3.644 6.356 -7.844 1.00 2.18 H new ATOM 0 HH22 ARG C 134 -4.974 6.111 -6.706 1.00 2.18 H new ATOM 1969 N TYR C 135 3.393 6.867 -3.923 1.00 0.30 N ATOM 1970 CA TYR C 135 4.301 7.335 -2.885 1.00 0.29 C ATOM 1971 C TYR C 135 5.254 8.406 -3.418 1.00 0.31 C ATOM 1972 O TYR C 135 5.373 8.608 -4.631 1.00 0.37 O ATOM 1973 CB TYR C 135 5.107 6.161 -2.308 1.00 0.30 C ATOM 1974 CG TYR C 135 6.301 5.745 -3.153 1.00 0.34 C ATOM 1975 CD1 TYR C 135 6.130 5.158 -4.401 1.00 0.37 C ATOM 1976 CD2 TYR C 135 7.599 5.942 -2.693 1.00 0.42 C ATOM 1977 CE1 TYR C 135 7.218 4.781 -5.166 1.00 0.43 C ATOM 1978 CE2 TYR C 135 8.689 5.568 -3.453 1.00 0.49 C ATOM 1979 CZ TYR C 135 8.494 4.989 -4.686 1.00 0.48 C ATOM 1980 OH TYR C 135 9.580 4.619 -5.446 1.00 0.57 O ATOM 0 H TYR C 135 3.740 6.986 -4.875 1.00 0.30 H new ATOM 0 HA TYR C 135 3.696 7.779 -2.094 1.00 0.29 H new ATOM 0 HB2 TYR C 135 5.458 6.432 -1.312 1.00 0.30 H new ATOM 0 HB3 TYR C 135 4.444 5.304 -2.190 1.00 0.30 H new ATOM 0 HD1 TYR C 135 5.132 4.994 -4.779 1.00 0.37 H new ATOM 0 HD2 TYR C 135 7.757 6.395 -1.725 1.00 0.42 H new ATOM 0 HE1 TYR C 135 7.070 4.326 -6.134 1.00 0.43 H new ATOM 0 HE2 TYR C 135 9.690 5.729 -3.082 1.00 0.49 H new ATOM 0 HH TYR C 135 10.405 4.835 -4.964 1.00 0.57 H new ATOM 1990 N LEU C 136 5.934 9.079 -2.498 1.00 0.32 N ATOM 1991 CA LEU C 136 6.891 10.121 -2.844 1.00 0.40 C ATOM 1992 C LEU C 136 8.245 9.809 -2.207 1.00 0.41 C ATOM 1993 O LEU C 136 8.316 9.402 -1.047 1.00 0.48 O ATOM 1994 CB LEU C 136 6.379 11.490 -2.378 1.00 0.45 C ATOM 1995 CG LEU C 136 7.298 12.676 -2.676 1.00 0.55 C ATOM 1996 CD1 LEU C 136 7.419 12.900 -4.175 1.00 0.63 C ATOM 1997 CD2 LEU C 136 6.784 13.929 -1.986 1.00 0.63 C ATOM 0 H LEU C 136 5.838 8.918 -1.495 1.00 0.32 H new ATOM 0 HA LEU C 136 7.010 10.152 -3.927 1.00 0.40 H new ATOM 0 HB2 LEU C 136 5.413 11.675 -2.847 1.00 0.45 H new ATOM 0 HB3 LEU C 136 6.208 11.447 -1.302 1.00 0.45 H new ATOM 0 HG LEU C 136 8.291 12.449 -2.287 1.00 0.55 H new ATOM 0 HD11 LEU C 136 8.077 13.748 -4.364 1.00 0.63 H new ATOM 0 HD12 LEU C 136 7.833 12.008 -4.644 1.00 0.63 H new ATOM 0 HD13 LEU C 136 6.433 13.105 -4.593 1.00 0.63 H new ATOM 0 HD21 LEU C 136 7.448 14.765 -2.207 1.00 0.63 H new ATOM 0 HD22 LEU C 136 5.781 14.157 -2.346 1.00 0.63 H new ATOM 0 HD23 LEU C 136 6.754 13.765 -0.909 1.00 0.63 H new ATOM 2009 N LEU C 137 9.315 9.977 -2.967 1.00 0.42 N ATOM 2010 CA LEU C 137 10.650 9.697 -2.457 1.00 0.46 C ATOM 2011 C LEU C 137 11.379 10.984 -2.089 1.00 0.46 C ATOM 2012 O LEU C 137 11.434 11.927 -2.876 1.00 0.49 O ATOM 2013 CB LEU C 137 11.462 8.905 -3.488 1.00 0.55 C ATOM 2014 CG LEU C 137 12.926 8.645 -3.112 1.00 0.64 C ATOM 2015 CD1 LEU C 137 13.020 7.822 -1.835 1.00 1.16 C ATOM 2016 CD2 LEU C 137 13.651 7.947 -4.253 1.00 1.06 C ATOM 0 H LEU C 137 9.288 10.304 -3.933 1.00 0.42 H new ATOM 0 HA LEU C 137 10.544 9.096 -1.554 1.00 0.46 H new ATOM 0 HB2 LEU C 137 10.971 7.946 -3.653 1.00 0.55 H new ATOM 0 HB3 LEU C 137 11.438 9.443 -4.436 1.00 0.55 H new ATOM 0 HG LEU C 137 13.408 9.606 -2.931 1.00 0.64 H new ATOM 0 HD11 LEU C 137 14.068 7.651 -1.589 1.00 1.16 H new ATOM 0 HD12 LEU C 137 12.539 8.361 -1.019 1.00 1.16 H new ATOM 0 HD13 LEU C 137 12.521 6.864 -1.982 1.00 1.16 H new ATOM 0 HD21 LEU C 137 14.689 7.770 -3.970 1.00 1.06 H new ATOM 0 HD22 LEU C 137 13.165 6.995 -4.465 1.00 1.06 H new ATOM 0 HD23 LEU C 137 13.620 8.576 -5.143 1.00 1.06 H new ATOM 2028 N ILE C 138 11.924 11.015 -0.881 1.00 0.49 N ATOM 2029 CA ILE C 138 12.668 12.169 -0.399 1.00 0.54 C ATOM 2030 C ILE C 138 14.144 11.794 -0.268 1.00 0.58 C ATOM 2031 O ILE C 138 14.489 10.614 -0.299 1.00 0.73 O ATOM 2032 CB ILE C 138 12.123 12.667 0.968 1.00 0.53 C ATOM 2033 CG1 ILE C 138 10.593 12.722 0.945 1.00 0.61 C ATOM 2034 CG2 ILE C 138 12.687 14.040 1.322 1.00 0.64 C ATOM 2035 CD1 ILE C 138 10.028 13.758 -0.007 1.00 0.77 C ATOM 0 H ILE C 138 11.864 10.247 -0.212 1.00 0.49 H new ATOM 0 HA ILE C 138 12.551 12.981 -1.117 1.00 0.54 H new ATOM 0 HB ILE C 138 12.444 11.958 1.732 1.00 0.53 H new ATOM 0 HG12 ILE C 138 10.208 11.741 0.668 1.00 0.61 H new ATOM 0 HG13 ILE C 138 10.232 12.933 1.952 1.00 0.61 H new ATOM 0 HG21 ILE C 138 12.287 14.361 2.284 1.00 0.64 H new ATOM 0 HG22 ILE C 138 13.774 13.982 1.382 1.00 0.64 H new ATOM 0 HG23 ILE C 138 12.404 14.759 0.553 1.00 0.64 H new ATOM 0 HD11 ILE C 138 8.939 13.735 0.035 1.00 0.77 H new ATOM 0 HD12 ILE C 138 10.381 14.748 0.281 1.00 0.77 H new ATOM 0 HD13 ILE C 138 10.357 13.537 -1.022 1.00 0.77 H new ATOM 2047 N ASN C 139 15.008 12.793 -0.129 1.00 0.70 N ATOM 2048 CA ASN C 139 16.445 12.560 0.005 1.00 0.73 C ATOM 2049 C ASN C 139 16.759 11.794 1.283 1.00 0.66 C ATOM 2050 O ASN C 139 17.738 11.059 1.349 1.00 0.84 O ATOM 2051 CB ASN C 139 17.200 13.891 0.006 1.00 0.90 C ATOM 2052 CG ASN C 139 17.205 14.551 -1.357 1.00 1.04 C ATOM 2053 OD1 ASN C 139 17.378 13.887 -2.377 1.00 1.12 O ATOM 2054 ND2 ASN C 139 17.000 15.857 -1.390 1.00 1.32 N ATOM 0 H ASN C 139 14.739 13.777 -0.106 1.00 0.70 H new ATOM 0 HA ASN C 139 16.768 11.961 -0.847 1.00 0.73 H new ATOM 0 HB2 ASN C 139 16.743 14.564 0.731 1.00 0.90 H new ATOM 0 HB3 ASN C 139 18.227 13.723 0.329 1.00 0.90 H new ATOM 0 HD21 ASN C 139 16.981 16.348 -2.284 1.00 1.32 H new ATOM 0 HD22 ASN C 139 16.860 16.373 -0.522 1.00 1.32 H new ATOM 2061 N SER C 140 15.917 11.972 2.293 1.00 0.57 N ATOM 2062 CA SER C 140 16.102 11.302 3.572 1.00 0.61 C ATOM 2063 C SER C 140 15.365 9.966 3.601 1.00 0.54 C ATOM 2064 O SER C 140 15.979 8.904 3.487 1.00 0.68 O ATOM 2065 CB SER C 140 15.605 12.206 4.701 1.00 0.76 C ATOM 2066 OG SER C 140 15.287 13.496 4.204 1.00 1.04 O ATOM 0 H SER C 140 15.097 12.577 2.250 1.00 0.57 H new ATOM 0 HA SER C 140 17.165 11.102 3.710 1.00 0.61 H new ATOM 0 HB2 SER C 140 14.725 11.763 5.168 1.00 0.76 H new ATOM 0 HB3 SER C 140 16.370 12.286 5.473 1.00 0.76 H new ATOM 0 HG SER C 140 14.969 14.061 4.939 1.00 1.04 H new ATOM 2072 N ASP C 141 14.046 10.032 3.745 1.00 0.53 N ATOM 2073 CA ASP C 141 13.211 8.837 3.797 1.00 0.48 C ATOM 2074 C ASP C 141 12.122 8.908 2.736 1.00 0.41 C ATOM 2075 O ASP C 141 12.198 9.719 1.813 1.00 0.46 O ATOM 2076 CB ASP C 141 12.577 8.684 5.185 1.00 0.49 C ATOM 2077 CG ASP C 141 13.387 7.790 6.103 1.00 0.72 C ATOM 2078 OD1 ASP C 141 13.617 6.614 5.748 1.00 1.10 O ATOM 2079 OD2 ASP C 141 13.806 8.259 7.188 1.00 1.06 O ATOM 0 H ASP C 141 13.529 10.907 3.828 1.00 0.53 H new ATOM 0 HA ASP C 141 13.841 7.969 3.602 1.00 0.48 H new ATOM 0 HB2 ASP C 141 12.472 9.668 5.642 1.00 0.49 H new ATOM 0 HB3 ASP C 141 11.573 8.274 5.078 1.00 0.49 H new ATOM 2084 N ILE C 142 11.112 8.066 2.864 1.00 0.37 N ATOM 2085 CA ILE C 142 10.015 8.044 1.907 1.00 0.32 C ATOM 2086 C ILE C 142 8.750 8.623 2.528 1.00 0.30 C ATOM 2087 O ILE C 142 8.648 8.754 3.748 1.00 0.32 O ATOM 2088 CB ILE C 142 9.712 6.616 1.378 1.00 0.31 C ATOM 2089 CG1 ILE C 142 10.299 5.527 2.297 1.00 0.37 C ATOM 2090 CG2 ILE C 142 10.223 6.458 -0.045 1.00 0.38 C ATOM 2091 CD1 ILE C 142 11.750 5.171 2.015 1.00 0.45 C ATOM 0 H ILE C 142 11.027 7.387 3.621 1.00 0.37 H new ATOM 0 HA ILE C 142 10.332 8.656 1.062 1.00 0.32 H new ATOM 0 HB ILE C 142 8.630 6.487 1.377 1.00 0.31 H new ATOM 0 HG12 ILE C 142 10.215 5.860 3.331 1.00 0.37 H new ATOM 0 HG13 ILE C 142 9.693 4.626 2.202 1.00 0.37 H new ATOM 0 HG21 ILE C 142 10.003 5.452 -0.401 1.00 0.38 H new ATOM 0 HG22 ILE C 142 9.733 7.187 -0.691 1.00 0.38 H new ATOM 0 HG23 ILE C 142 11.300 6.622 -0.065 1.00 0.38 H new ATOM 0 HD11 ILE C 142 12.076 4.397 2.710 1.00 0.45 H new ATOM 0 HD12 ILE C 142 11.842 4.803 0.993 1.00 0.45 H new ATOM 0 HD13 ILE C 142 12.373 6.057 2.140 1.00 0.45 H new ATOM 2103 N VAL C 143 7.805 8.992 1.679 1.00 0.29 N ATOM 2104 CA VAL C 143 6.540 9.552 2.125 1.00 0.28 C ATOM 2105 C VAL C 143 5.392 8.804 1.459 1.00 0.24 C ATOM 2106 O VAL C 143 5.457 8.496 0.263 1.00 0.23 O ATOM 2107 CB VAL C 143 6.440 11.066 1.805 1.00 0.34 C ATOM 2108 CG1 VAL C 143 5.081 11.628 2.192 1.00 0.37 C ATOM 2109 CG2 VAL C 143 7.546 11.839 2.504 1.00 0.45 C ATOM 0 H VAL C 143 7.892 8.912 0.666 1.00 0.29 H new ATOM 0 HA VAL C 143 6.480 9.438 3.207 1.00 0.28 H new ATOM 0 HB VAL C 143 6.559 11.181 0.728 1.00 0.34 H new ATOM 0 HG11 VAL C 143 5.046 12.691 1.954 1.00 0.37 H new ATOM 0 HG12 VAL C 143 4.300 11.106 1.638 1.00 0.37 H new ATOM 0 HG13 VAL C 143 4.921 11.490 3.261 1.00 0.37 H new ATOM 0 HG21 VAL C 143 7.456 12.899 2.265 1.00 0.45 H new ATOM 0 HG22 VAL C 143 7.461 11.701 3.582 1.00 0.45 H new ATOM 0 HG23 VAL C 143 8.515 11.472 2.167 1.00 0.45 H new ATOM 2119 N CYS C 144 4.363 8.494 2.239 1.00 0.23 N ATOM 2120 CA CYS C 144 3.202 7.773 1.740 1.00 0.21 C ATOM 2121 C CYS C 144 2.294 8.697 0.936 1.00 0.20 C ATOM 2122 O CYS C 144 2.700 9.778 0.513 1.00 0.32 O ATOM 2123 CB CYS C 144 2.415 7.188 2.914 1.00 0.26 C ATOM 2124 SG CYS C 144 1.620 8.448 3.968 1.00 0.32 S ATOM 0 H CYS C 144 4.311 8.734 3.229 1.00 0.23 H new ATOM 0 HA CYS C 144 3.550 6.971 1.089 1.00 0.21 H new ATOM 0 HB2 CYS C 144 1.649 6.516 2.527 1.00 0.26 H new ATOM 0 HB3 CYS C 144 3.087 6.587 3.526 1.00 0.26 H new ATOM 0 HG CYS C 144 1.766 8.123 5.218 1.00 0.32 H new ATOM 2129 N GLU C 145 1.058 8.263 0.737 1.00 0.21 N ATOM 2130 CA GLU C 145 0.082 9.057 0.014 1.00 0.22 C ATOM 2131 C GLU C 145 -0.990 9.540 0.983 1.00 0.26 C ATOM 2132 O GLU C 145 -1.896 10.288 0.614 1.00 0.28 O ATOM 2133 CB GLU C 145 -0.543 8.259 -1.138 1.00 0.25 C ATOM 2134 CG GLU C 145 -1.679 7.334 -0.724 1.00 0.29 C ATOM 2135 CD GLU C 145 -2.910 7.501 -1.597 1.00 0.49 C ATOM 2136 OE1 GLU C 145 -2.859 8.295 -2.562 1.00 0.95 O ATOM 2137 OE2 GLU C 145 -3.933 6.843 -1.329 1.00 0.59 O ATOM 0 H GLU C 145 0.709 7.363 1.068 1.00 0.21 H new ATOM 0 HA GLU C 145 0.585 9.918 -0.426 1.00 0.22 H new ATOM 0 HB2 GLU C 145 -0.916 8.958 -1.887 1.00 0.25 H new ATOM 0 HB3 GLU C 145 0.236 7.665 -1.616 1.00 0.25 H new ATOM 0 HG2 GLU C 145 -1.339 6.300 -0.775 1.00 0.29 H new ATOM 0 HG3 GLU C 145 -1.944 7.531 0.315 1.00 0.29 H new ATOM 2144 N GLN C 146 -0.854 9.122 2.237 1.00 0.31 N ATOM 2145 CA GLN C 146 -1.796 9.494 3.280 1.00 0.38 C ATOM 2146 C GLN C 146 -1.466 10.887 3.794 1.00 0.38 C ATOM 2147 O GLN C 146 -2.354 11.704 4.033 1.00 0.46 O ATOM 2148 CB GLN C 146 -1.741 8.480 4.429 1.00 0.44 C ATOM 2149 CG GLN C 146 -2.664 8.813 5.593 1.00 0.67 C ATOM 2150 CD GLN C 146 -2.381 7.979 6.831 1.00 0.83 C ATOM 2151 OE1 GLN C 146 -1.117 7.651 7.058 1.00 0.86 O flip ATOM 2152 NE2 GLN C 146 -3.293 7.643 7.588 1.00 1.34 N flip ATOM 0 H GLN C 146 -0.094 8.521 2.555 1.00 0.31 H new ATOM 0 HA GLN C 146 -2.804 9.495 2.866 1.00 0.38 H new ATOM 0 HB2 GLN C 146 -2.001 7.494 4.043 1.00 0.44 H new ATOM 0 HB3 GLN C 146 -0.717 8.418 4.797 1.00 0.44 H new ATOM 0 HG2 GLN C 146 -2.560 9.869 5.841 1.00 0.67 H new ATOM 0 HG3 GLN C 146 -3.698 8.658 5.286 1.00 0.67 H new ATOM 0 HE21 GLN C 146 -4.254 7.914 7.380 1.00 1.34 H new ATOM 0 HE22 GLN C 146 -3.087 7.094 8.422 1.00 1.34 H new ATOM 2161 N ASP C 147 -0.181 11.155 3.957 1.00 0.33 N ATOM 2162 CA ASP C 147 0.267 12.451 4.447 1.00 0.35 C ATOM 2163 C ASP C 147 1.133 13.169 3.411 1.00 0.33 C ATOM 2164 O ASP C 147 1.761 14.186 3.711 1.00 0.38 O ATOM 2165 CB ASP C 147 1.021 12.300 5.780 1.00 0.40 C ATOM 2166 CG ASP C 147 2.244 11.398 5.703 1.00 0.38 C ATOM 2167 OD1 ASP C 147 3.114 11.648 4.847 1.00 0.38 O ATOM 2168 OD2 ASP C 147 2.346 10.468 6.537 1.00 0.40 O ATOM 0 H ASP C 147 0.570 10.495 3.758 1.00 0.33 H new ATOM 0 HA ASP C 147 -0.617 13.064 4.622 1.00 0.35 H new ATOM 0 HB2 ASP C 147 1.332 13.287 6.123 1.00 0.40 H new ATOM 0 HB3 ASP C 147 0.336 11.903 6.529 1.00 0.40 H new ATOM 2173 N ILE C 148 1.130 12.654 2.182 1.00 0.29 N ATOM 2174 CA ILE C 148 1.919 13.236 1.094 1.00 0.30 C ATOM 2175 C ILE C 148 1.561 14.707 0.854 1.00 0.33 C ATOM 2176 O ILE C 148 2.437 15.537 0.610 1.00 0.38 O ATOM 2177 CB ILE C 148 1.748 12.443 -0.228 1.00 0.28 C ATOM 2178 CG1 ILE C 148 2.685 12.993 -1.311 1.00 0.35 C ATOM 2179 CG2 ILE C 148 0.300 12.469 -0.705 1.00 0.26 C ATOM 2180 CD1 ILE C 148 2.624 12.232 -2.619 1.00 0.65 C ATOM 0 H ILE C 148 0.589 11.832 1.913 1.00 0.29 H new ATOM 0 HA ILE C 148 2.961 13.176 1.408 1.00 0.30 H new ATOM 0 HB ILE C 148 2.016 11.405 -0.033 1.00 0.28 H new ATOM 0 HG12 ILE C 148 2.435 14.037 -1.498 1.00 0.35 H new ATOM 0 HG13 ILE C 148 3.709 12.972 -0.937 1.00 0.35 H new ATOM 0 HG21 ILE C 148 0.213 11.905 -1.633 1.00 0.26 H new ATOM 0 HG22 ILE C 148 -0.341 12.021 0.054 1.00 0.26 H new ATOM 0 HG23 ILE C 148 -0.008 13.500 -0.877 1.00 0.26 H new ATOM 0 HD11 ILE C 148 3.314 12.681 -3.334 1.00 0.65 H new ATOM 0 HD12 ILE C 148 2.904 11.192 -2.448 1.00 0.65 H new ATOM 0 HD13 ILE C 148 1.610 12.274 -3.018 1.00 0.65 H new ATOM 2192 N TYR C 149 0.274 15.022 0.947 1.00 0.33 N ATOM 2193 CA TYR C 149 -0.208 16.379 0.726 1.00 0.38 C ATOM 2194 C TYR C 149 0.207 17.293 1.872 1.00 0.45 C ATOM 2195 O TYR C 149 0.295 18.511 1.713 1.00 0.52 O ATOM 2196 CB TYR C 149 -1.732 16.374 0.574 1.00 0.42 C ATOM 2197 CG TYR C 149 -2.285 17.612 -0.093 1.00 0.51 C ATOM 2198 CD1 TYR C 149 -2.159 17.795 -1.463 1.00 0.61 C ATOM 2199 CD2 TYR C 149 -2.942 18.591 0.642 1.00 0.68 C ATOM 2200 CE1 TYR C 149 -2.668 18.920 -2.081 1.00 0.75 C ATOM 2201 CE2 TYR C 149 -3.457 19.717 0.030 1.00 0.79 C ATOM 2202 CZ TYR C 149 -3.317 19.877 -1.329 1.00 0.77 C ATOM 2203 OH TYR C 149 -3.832 20.995 -1.941 1.00 0.93 O ATOM 0 H TYR C 149 -0.458 14.350 1.176 1.00 0.33 H new ATOM 0 HA TYR C 149 0.239 16.761 -0.192 1.00 0.38 H new ATOM 0 HB2 TYR C 149 -2.027 15.499 -0.005 1.00 0.42 H new ATOM 0 HB3 TYR C 149 -2.185 16.271 1.560 1.00 0.42 H new ATOM 0 HD1 TYR C 149 -1.655 17.046 -2.055 1.00 0.61 H new ATOM 0 HD2 TYR C 149 -3.052 18.470 1.710 1.00 0.68 H new ATOM 0 HE1 TYR C 149 -2.559 19.050 -3.148 1.00 0.75 H new ATOM 0 HE2 TYR C 149 -3.967 20.468 0.615 1.00 0.79 H new ATOM 0 HH TYR C 149 -4.258 21.568 -1.270 1.00 0.93 H new ATOM 2213 N GLU C 150 0.472 16.698 3.025 1.00 0.49 N ATOM 2214 CA GLU C 150 0.878 17.461 4.189 1.00 0.59 C ATOM 2215 C GLU C 150 2.372 17.758 4.134 1.00 0.60 C ATOM 2216 O GLU C 150 2.788 18.909 4.244 1.00 0.70 O ATOM 2217 CB GLU C 150 0.537 16.703 5.473 1.00 0.66 C ATOM 2218 CG GLU C 150 -0.934 16.338 5.593 1.00 0.76 C ATOM 2219 CD GLU C 150 -1.301 15.851 6.978 1.00 1.13 C ATOM 2220 OE1 GLU C 150 -1.610 16.693 7.844 1.00 1.67 O ATOM 2221 OE2 GLU C 150 -1.280 14.623 7.208 1.00 1.48 O ATOM 0 H GLU C 150 0.413 15.691 3.177 1.00 0.49 H new ATOM 0 HA GLU C 150 0.333 18.405 4.188 1.00 0.59 H new ATOM 0 HB2 GLU C 150 1.133 15.792 5.516 1.00 0.66 H new ATOM 0 HB3 GLU C 150 0.823 17.312 6.331 1.00 0.66 H new ATOM 0 HG2 GLU C 150 -1.542 17.208 5.345 1.00 0.76 H new ATOM 0 HG3 GLU C 150 -1.173 15.564 4.864 1.00 0.76 H new ATOM 2228 N TRP C 151 3.168 16.712 3.929 1.00 0.52 N ATOM 2229 CA TRP C 151 4.623 16.839 3.875 1.00 0.54 C ATOM 2230 C TRP C 151 5.067 17.828 2.795 1.00 0.60 C ATOM 2231 O TRP C 151 5.991 18.612 3.010 1.00 0.68 O ATOM 2232 CB TRP C 151 5.265 15.469 3.633 1.00 0.46 C ATOM 2233 CG TRP C 151 6.746 15.459 3.844 1.00 0.50 C ATOM 2234 CD1 TRP C 151 7.708 15.580 2.886 1.00 0.55 C ATOM 2235 CD2 TRP C 151 7.434 15.320 5.093 1.00 0.56 C ATOM 2236 NE1 TRP C 151 8.952 15.528 3.458 1.00 0.63 N ATOM 2237 CE2 TRP C 151 8.812 15.368 4.813 1.00 0.63 C ATOM 2238 CE3 TRP C 151 7.021 15.165 6.421 1.00 0.62 C ATOM 2239 CZ2 TRP C 151 9.778 15.267 5.810 1.00 0.73 C ATOM 2240 CZ3 TRP C 151 7.981 15.060 7.409 1.00 0.73 C ATOM 2241 CH2 TRP C 151 9.346 15.113 7.099 1.00 0.77 C ATOM 0 H TRP C 151 2.827 15.760 3.797 1.00 0.52 H new ATOM 0 HA TRP C 151 4.956 17.228 4.837 1.00 0.54 H new ATOM 0 HB2 TRP C 151 4.806 14.739 4.299 1.00 0.46 H new ATOM 0 HB3 TRP C 151 5.049 15.150 2.613 1.00 0.46 H new ATOM 0 HD1 TRP C 151 7.517 15.699 1.830 1.00 0.55 H new ATOM 0 HE1 TRP C 151 9.838 15.597 2.958 1.00 0.63 H new ATOM 0 HE3 TRP C 151 5.971 15.128 6.669 1.00 0.62 H new ATOM 0 HZ2 TRP C 151 10.831 15.309 5.574 1.00 0.73 H new ATOM 0 HZ3 TRP C 151 7.674 14.935 8.437 1.00 0.73 H new ATOM 0 HH2 TRP C 151 10.072 15.031 7.894 1.00 0.77 H new ATOM 2252 N THR C 152 4.400 17.798 1.648 1.00 0.58 N ATOM 2253 CA THR C 152 4.743 18.690 0.547 1.00 0.65 C ATOM 2254 C THR C 152 4.563 20.152 0.941 1.00 0.75 C ATOM 2255 O THR C 152 5.414 20.989 0.648 1.00 0.85 O ATOM 2256 CB THR C 152 3.897 18.388 -0.708 1.00 0.62 C ATOM 2257 OG1 THR C 152 2.582 17.967 -0.323 1.00 0.53 O ATOM 2258 CG2 THR C 152 4.552 17.310 -1.556 1.00 0.60 C ATOM 0 H THR C 152 3.621 17.168 1.456 1.00 0.58 H new ATOM 0 HA THR C 152 5.793 18.514 0.314 1.00 0.65 H new ATOM 0 HB THR C 152 3.827 19.300 -1.300 1.00 0.62 H new ATOM 0 HG1 THR C 152 2.560 16.990 -0.248 1.00 0.53 H new ATOM 0 HG21 THR C 152 3.937 17.115 -2.435 1.00 0.60 H new ATOM 0 HG22 THR C 152 5.540 17.646 -1.872 1.00 0.60 H new ATOM 0 HG23 THR C 152 4.649 16.396 -0.971 1.00 0.60 H new ATOM 2266 N LYS C 153 3.469 20.450 1.630 1.00 0.77 N ATOM 2267 CA LYS C 153 3.188 21.813 2.056 1.00 0.87 C ATOM 2268 C LYS C 153 4.114 22.228 3.196 1.00 0.93 C ATOM 2269 O LYS C 153 4.519 23.385 3.289 1.00 1.04 O ATOM 2270 CB LYS C 153 1.728 21.948 2.491 1.00 0.87 C ATOM 2271 CG LYS C 153 0.734 21.751 1.358 1.00 0.83 C ATOM 2272 CD LYS C 153 -0.681 22.101 1.789 1.00 0.92 C ATOM 2273 CE LYS C 153 -1.272 21.035 2.699 1.00 0.90 C ATOM 2274 NZ LYS C 153 -2.590 21.444 3.254 1.00 1.14 N ATOM 0 H LYS C 153 2.763 19.767 1.905 1.00 0.77 H new ATOM 0 HA LYS C 153 3.366 22.475 1.208 1.00 0.87 H new ATOM 0 HB2 LYS C 153 1.522 21.219 3.274 1.00 0.87 H new ATOM 0 HB3 LYS C 153 1.578 22.935 2.927 1.00 0.87 H new ATOM 0 HG2 LYS C 153 1.021 22.372 0.509 1.00 0.83 H new ATOM 0 HG3 LYS C 153 0.767 20.715 1.020 1.00 0.83 H new ATOM 0 HD2 LYS C 153 -0.677 23.060 2.307 1.00 0.92 H new ATOM 0 HD3 LYS C 153 -1.312 22.217 0.908 1.00 0.92 H new ATOM 0 HE2 LYS C 153 -1.386 20.105 2.142 1.00 0.90 H new ATOM 0 HE3 LYS C 153 -0.581 20.833 3.517 1.00 0.90 H new ATOM 0 HZ1 LYS C 153 -2.957 20.689 3.868 1.00 1.14 H new ATOM 0 HZ2 LYS C 153 -2.478 22.317 3.808 1.00 1.14 H new ATOM 0 HZ3 LYS C 153 -3.258 21.612 2.475 1.00 1.14 H new ATOM 2288 N ILE C 154 4.451 21.273 4.055 1.00 0.88 N ATOM 2289 CA ILE C 154 5.323 21.535 5.195 1.00 0.95 C ATOM 2290 C ILE C 154 6.769 21.766 4.753 1.00 0.98 C ATOM 2291 O ILE C 154 7.432 22.682 5.239 1.00 1.10 O ATOM 2292 CB ILE C 154 5.279 20.372 6.214 1.00 0.91 C ATOM 2293 CG1 ILE C 154 3.866 20.225 6.784 1.00 0.91 C ATOM 2294 CG2 ILE C 154 6.282 20.595 7.340 1.00 1.02 C ATOM 2295 CD1 ILE C 154 3.665 18.966 7.600 1.00 0.90 C ATOM 0 H ILE C 154 4.132 20.307 3.984 1.00 0.88 H new ATOM 0 HA ILE C 154 4.952 22.442 5.673 1.00 0.95 H new ATOM 0 HB ILE C 154 5.550 19.452 5.695 1.00 0.91 H new ATOM 0 HG12 ILE C 154 3.644 21.091 7.408 1.00 0.91 H new ATOM 0 HG13 ILE C 154 3.150 20.232 5.962 1.00 0.91 H new ATOM 0 HG21 ILE C 154 6.231 19.763 8.043 1.00 1.02 H new ATOM 0 HG22 ILE C 154 7.288 20.658 6.924 1.00 1.02 H new ATOM 0 HG23 ILE C 154 6.046 21.524 7.859 1.00 1.02 H new ATOM 0 HD11 ILE C 154 2.640 18.932 7.970 1.00 0.90 H new ATOM 0 HD12 ILE C 154 3.854 18.093 6.975 1.00 0.90 H new ATOM 0 HD13 ILE C 154 4.356 18.965 8.443 1.00 0.90 H new ATOM 2307 N ASN C 155 7.250 20.941 3.830 1.00 0.93 N ATOM 2308 CA ASN C 155 8.625 21.057 3.341 1.00 0.96 C ATOM 2309 C ASN C 155 8.758 22.151 2.286 1.00 1.05 C ATOM 2310 O ASN C 155 9.848 22.675 2.059 1.00 1.16 O ATOM 2311 CB ASN C 155 9.115 19.720 2.776 1.00 0.90 C ATOM 2312 CG ASN C 155 9.938 18.927 3.775 1.00 0.86 C ATOM 2313 OD1 ASN C 155 10.879 18.224 3.404 1.00 1.13 O ATOM 2314 ND2 ASN C 155 9.582 19.024 5.049 1.00 0.90 N ATOM 0 H ASN C 155 6.713 20.186 3.404 1.00 0.93 H new ATOM 0 HA ASN C 155 9.248 21.332 4.192 1.00 0.96 H new ATOM 0 HB2 ASN C 155 8.256 19.125 2.466 1.00 0.90 H new ATOM 0 HB3 ASN C 155 9.714 19.905 1.884 1.00 0.90 H new ATOM 0 HD21 ASN C 155 10.094 18.505 5.763 1.00 0.90 H new ATOM 0 HD22 ASN C 155 8.796 19.617 5.315 1.00 0.90 H new ATOM 2321 N GLY C 156 7.652 22.488 1.639 1.00 1.07 N ATOM 2322 CA GLY C 156 7.675 23.529 0.628 1.00 1.18 C ATOM 2323 C GLY C 156 7.805 22.981 -0.780 1.00 1.12 C ATOM 2324 O GLY C 156 8.902 22.911 -1.333 1.00 1.47 O ATOM 0 H GLY C 156 6.739 22.061 1.795 1.00 1.07 H new ATOM 0 HA2 GLY C 156 6.761 24.119 0.700 1.00 1.18 H new ATOM 0 HA3 GLY C 156 8.507 24.204 0.828 1.00 1.18 H new ATOM 2328 N GLY C 157 6.683 22.582 -1.356 1.00 1.06 N ATOM 2329 CA GLY C 157 6.683 22.052 -2.702 1.00 1.02 C ATOM 2330 C GLY C 157 5.280 21.936 -3.247 1.00 0.95 C ATOM 2331 O GLY C 157 4.971 21.021 -4.009 1.00 1.21 O ATOM 0 H GLY C 157 5.766 22.616 -0.911 1.00 1.06 H new ATOM 0 HA2 GLY C 157 7.274 22.699 -3.350 1.00 1.02 H new ATOM 0 HA3 GLY C 157 7.160 21.072 -2.709 1.00 1.02 H new ATOM 2335 N SER C 158 4.427 22.870 -2.850 1.00 0.91 N ATOM 2336 CA SER C 158 3.043 22.875 -3.286 1.00 0.85 C ATOM 2337 C SER C 158 2.908 23.509 -4.668 1.00 0.93 C ATOM 2338 O SER C 158 3.552 24.517 -4.966 1.00 1.15 O ATOM 2339 CB SER C 158 2.188 23.638 -2.274 1.00 0.89 C ATOM 2340 OG SER C 158 2.738 23.533 -0.971 1.00 0.93 O ATOM 0 H SER C 158 4.674 23.636 -2.224 1.00 0.91 H new ATOM 0 HA SER C 158 2.696 21.844 -3.351 1.00 0.85 H new ATOM 0 HB2 SER C 158 2.123 24.687 -2.563 1.00 0.89 H new ATOM 0 HB3 SER C 158 1.172 23.243 -2.278 1.00 0.89 H new ATOM 0 HG SER C 158 2.178 24.029 -0.338 1.00 0.93 H new ATOM 2346 N GLY C 159 2.072 22.918 -5.507 1.00 0.84 N ATOM 2347 CA GLY C 159 1.869 23.445 -6.842 1.00 0.93 C ATOM 2348 C GLY C 159 0.449 23.914 -7.047 1.00 0.89 C ATOM 2349 O GLY C 159 -0.139 23.702 -8.107 1.00 0.98 O ATOM 0 H GLY C 159 1.530 22.082 -5.288 1.00 0.84 H new ATOM 0 HA2 GLY C 159 2.555 24.275 -7.014 1.00 0.93 H new ATOM 0 HA3 GLY C 159 2.108 22.676 -7.577 1.00 0.93 H new ATOM 2353 N GLY C 160 -0.095 24.562 -6.030 1.00 0.84 N ATOM 2354 CA GLY C 160 -1.455 25.045 -6.099 1.00 0.85 C ATOM 2355 C GLY C 160 -2.428 24.033 -5.540 1.00 0.82 C ATOM 2356 O GLY C 160 -2.264 22.830 -5.748 1.00 0.90 O ATOM 0 H GLY C 160 0.385 24.763 -5.153 1.00 0.84 H new ATOM 0 HA2 GLY C 160 -1.540 25.979 -5.543 1.00 0.85 H new ATOM 0 HA3 GLY C 160 -1.712 25.266 -7.135 1.00 0.85 H new ATOM 2360 N SER C 161 -3.433 24.509 -4.822 1.00 0.78 N ATOM 2361 CA SER C 161 -4.430 23.629 -4.230 1.00 0.77 C ATOM 2362 C SER C 161 -5.370 23.086 -5.304 1.00 0.71 C ATOM 2363 O SER C 161 -6.494 23.564 -5.464 1.00 0.83 O ATOM 2364 CB SER C 161 -5.218 24.388 -3.160 1.00 0.85 C ATOM 2365 OG SER C 161 -4.604 25.641 -2.880 1.00 1.04 O ATOM 0 H SER C 161 -3.581 25.501 -4.635 1.00 0.78 H new ATOM 0 HA SER C 161 -3.924 22.783 -3.764 1.00 0.77 H new ATOM 0 HB2 SER C 161 -6.242 24.546 -3.499 1.00 0.85 H new ATOM 0 HB3 SER C 161 -5.272 23.792 -2.249 1.00 0.85 H new ATOM 0 HG SER C 161 -5.122 26.113 -2.195 1.00 1.04 H new ATOM 2371 N GLY C 162 -4.889 22.100 -6.052 1.00 0.68 N ATOM 2372 CA GLY C 162 -5.679 21.507 -7.109 1.00 0.67 C ATOM 2373 C GLY C 162 -4.836 21.161 -8.318 1.00 0.70 C ATOM 2374 O GLY C 162 -5.193 20.282 -9.105 1.00 0.78 O ATOM 0 H GLY C 162 -3.957 21.699 -5.942 1.00 0.68 H new ATOM 0 HA2 GLY C 162 -6.166 20.606 -6.736 1.00 0.67 H new ATOM 0 HA3 GLY C 162 -6.469 22.198 -7.403 1.00 0.67 H new ATOM 2378 N GLY C 163 -3.714 21.854 -8.464 1.00 0.73 N ATOM 2379 CA GLY C 163 -2.826 21.612 -9.586 1.00 0.80 C ATOM 2380 C GLY C 163 -1.732 20.614 -9.257 1.00 0.79 C ATOM 2381 O GLY C 163 -1.628 20.149 -8.122 1.00 0.79 O ATOM 0 H GLY C 163 -3.401 22.583 -7.822 1.00 0.73 H new ATOM 0 HA2 GLY C 163 -3.407 21.244 -10.432 1.00 0.80 H new ATOM 0 HA3 GLY C 163 -2.373 22.554 -9.896 1.00 0.80 H new ATOM 2385 N SER C 164 -0.916 20.286 -10.247 1.00 0.87 N ATOM 2386 CA SER C 164 0.167 19.336 -10.056 1.00 0.90 C ATOM 2387 C SER C 164 1.371 20.011 -9.401 1.00 0.81 C ATOM 2388 O SER C 164 1.814 21.077 -9.839 1.00 0.93 O ATOM 2389 CB SER C 164 0.573 18.719 -11.396 1.00 1.13 C ATOM 2390 OG SER C 164 -0.542 18.125 -12.041 1.00 1.30 O ATOM 0 H SER C 164 -0.984 20.665 -11.192 1.00 0.87 H new ATOM 0 HA SER C 164 -0.185 18.544 -9.395 1.00 0.90 H new ATOM 0 HB2 SER C 164 1.003 19.487 -12.039 1.00 1.13 H new ATOM 0 HB3 SER C 164 1.347 17.968 -11.235 1.00 1.13 H new ATOM 0 HG SER C 164 -0.258 17.739 -12.896 1.00 1.30 H new ATOM 2396 N GLY C 165 1.897 19.384 -8.355 1.00 0.76 N ATOM 2397 CA GLY C 165 3.038 19.936 -7.654 1.00 0.78 C ATOM 2398 C GLY C 165 4.341 19.280 -8.067 1.00 0.81 C ATOM 2399 O GLY C 165 5.384 19.935 -8.117 1.00 1.14 O ATOM 0 H GLY C 165 1.551 18.501 -7.980 1.00 0.76 H new ATOM 0 HA2 GLY C 165 3.096 21.007 -7.847 1.00 0.78 H new ATOM 0 HA3 GLY C 165 2.896 19.813 -6.580 1.00 0.78 H new ATOM 2403 N GLY C 166 4.287 17.990 -8.371 1.00 0.87 N ATOM 2404 CA GLY C 166 5.481 17.272 -8.772 1.00 0.96 C ATOM 2405 C GLY C 166 5.160 15.956 -9.437 1.00 0.98 C ATOM 2406 O GLY C 166 4.053 15.766 -9.940 1.00 1.12 O ATOM 0 H GLY C 166 3.437 17.427 -8.347 1.00 0.87 H new ATOM 0 HA2 GLY C 166 6.062 17.890 -9.456 1.00 0.96 H new ATOM 0 HA3 GLY C 166 6.105 17.092 -7.897 1.00 0.96 H new ATOM 2410 N ASP C 167 6.122 15.049 -9.442 1.00 0.97 N ATOM 2411 CA ASP C 167 5.933 13.745 -10.061 1.00 1.02 C ATOM 2412 C ASP C 167 5.800 12.671 -8.993 1.00 0.87 C ATOM 2413 O ASP C 167 6.741 12.410 -8.239 1.00 1.07 O ATOM 2414 CB ASP C 167 7.105 13.403 -10.989 1.00 1.25 C ATOM 2415 CG ASP C 167 7.273 14.392 -12.123 1.00 1.16 C ATOM 2416 OD1 ASP C 167 6.476 14.349 -13.082 1.00 1.44 O ATOM 2417 OD2 ASP C 167 8.214 15.216 -12.066 1.00 1.50 O ATOM 0 H ASP C 167 7.042 15.190 -9.025 1.00 0.97 H new ATOM 0 HA ASP C 167 5.019 13.783 -10.653 1.00 1.02 H new ATOM 0 HB2 ASP C 167 8.025 13.369 -10.405 1.00 1.25 H new ATOM 0 HB3 ASP C 167 6.954 12.406 -11.404 1.00 1.25 H new ATOM 2422 N VAL C 168 4.623 12.067 -8.919 1.00 0.75 N ATOM 2423 CA VAL C 168 4.359 11.014 -7.950 1.00 0.60 C ATOM 2424 C VAL C 168 4.514 9.644 -8.612 1.00 0.65 C ATOM 2425 O VAL C 168 4.111 9.450 -9.760 1.00 0.78 O ATOM 2426 CB VAL C 168 2.946 11.160 -7.328 1.00 0.61 C ATOM 2427 CG1 VAL C 168 1.872 11.184 -8.405 1.00 0.82 C ATOM 2428 CG2 VAL C 168 2.671 10.048 -6.327 1.00 0.58 C ATOM 0 H VAL C 168 3.831 12.290 -9.522 1.00 0.75 H new ATOM 0 HA VAL C 168 5.086 11.104 -7.143 1.00 0.60 H new ATOM 0 HB VAL C 168 2.917 12.112 -6.798 1.00 0.61 H new ATOM 0 HG11 VAL C 168 0.892 11.287 -7.939 1.00 0.82 H new ATOM 0 HG12 VAL C 168 2.046 12.027 -9.074 1.00 0.82 H new ATOM 0 HG13 VAL C 168 1.907 10.255 -8.975 1.00 0.82 H new ATOM 0 HG21 VAL C 168 1.673 10.175 -5.907 1.00 0.58 H new ATOM 0 HG22 VAL C 168 2.732 9.083 -6.830 1.00 0.58 H new ATOM 0 HG23 VAL C 168 3.410 10.088 -5.527 1.00 0.58 H new ATOM 2438 N MET C 169 5.108 8.702 -7.895 1.00 0.56 N ATOM 2439 CA MET C 169 5.329 7.366 -8.432 1.00 0.60 C ATOM 2440 C MET C 169 4.439 6.346 -7.737 1.00 0.56 C ATOM 2441 O MET C 169 3.790 6.659 -6.738 1.00 0.53 O ATOM 2442 CB MET C 169 6.801 6.975 -8.279 1.00 0.64 C ATOM 2443 CG MET C 169 7.735 7.797 -9.151 1.00 1.02 C ATOM 2444 SD MET C 169 9.221 8.331 -8.279 1.00 1.10 S ATOM 2445 CE MET C 169 9.698 9.739 -9.277 1.00 1.55 C ATOM 0 H MET C 169 5.445 8.837 -6.942 1.00 0.56 H new ATOM 0 HA MET C 169 5.071 7.376 -9.491 1.00 0.60 H new ATOM 0 HB2 MET C 169 7.094 7.091 -7.235 1.00 0.64 H new ATOM 0 HB3 MET C 169 6.917 5.920 -8.528 1.00 0.64 H new ATOM 0 HG2 MET C 169 8.023 7.208 -10.022 1.00 1.02 H new ATOM 0 HG3 MET C 169 7.202 8.673 -9.520 1.00 1.02 H new ATOM 0 HE1 MET C 169 10.530 10.258 -8.800 1.00 1.55 H new ATOM 0 HE2 MET C 169 10.003 9.397 -10.266 1.00 1.55 H new ATOM 0 HE3 MET C 169 8.852 10.420 -9.373 1.00 1.55 H new ATOM 2455 N VAL C 170 4.412 5.133 -8.271 1.00 0.61 N ATOM 2456 CA VAL C 170 3.596 4.061 -7.710 1.00 0.60 C ATOM 2457 C VAL C 170 4.480 2.972 -7.109 1.00 0.63 C ATOM 2458 O VAL C 170 5.516 2.618 -7.676 1.00 0.73 O ATOM 2459 CB VAL C 170 2.664 3.444 -8.783 1.00 0.65 C ATOM 2460 CG1 VAL C 170 1.856 2.282 -8.216 1.00 0.65 C ATOM 2461 CG2 VAL C 170 1.739 4.504 -9.366 1.00 0.68 C ATOM 0 H VAL C 170 4.948 4.864 -9.096 1.00 0.61 H new ATOM 0 HA VAL C 170 2.978 4.495 -6.924 1.00 0.60 H new ATOM 0 HB VAL C 170 3.293 3.054 -9.583 1.00 0.65 H new ATOM 0 HG11 VAL C 170 1.213 1.872 -8.995 1.00 0.65 H new ATOM 0 HG12 VAL C 170 2.534 1.507 -7.860 1.00 0.65 H new ATOM 0 HG13 VAL C 170 1.242 2.636 -7.387 1.00 0.65 H new ATOM 0 HG21 VAL C 170 1.093 4.050 -10.117 1.00 0.68 H new ATOM 0 HG22 VAL C 170 1.127 4.930 -8.571 1.00 0.68 H new ATOM 0 HG23 VAL C 170 2.334 5.292 -9.828 1.00 0.68 H new ATOM 2471 N VAL C 171 4.076 2.462 -5.955 1.00 0.57 N ATOM 2472 CA VAL C 171 4.821 1.413 -5.281 1.00 0.62 C ATOM 2473 C VAL C 171 4.674 0.094 -6.037 1.00 0.77 C ATOM 2474 O VAL C 171 3.595 -0.506 -6.053 1.00 0.89 O ATOM 2475 CB VAL C 171 4.347 1.221 -3.824 1.00 0.61 C ATOM 2476 CG1 VAL C 171 5.212 0.201 -3.106 1.00 1.03 C ATOM 2477 CG2 VAL C 171 4.343 2.546 -3.075 1.00 0.91 C ATOM 0 H VAL C 171 3.232 2.760 -5.465 1.00 0.57 H new ATOM 0 HA VAL C 171 5.868 1.717 -5.263 1.00 0.62 H new ATOM 0 HB VAL C 171 3.325 0.843 -3.849 1.00 0.61 H new ATOM 0 HG11 VAL C 171 4.860 0.082 -2.081 1.00 1.03 H new ATOM 0 HG12 VAL C 171 5.152 -0.756 -3.624 1.00 1.03 H new ATOM 0 HG13 VAL C 171 6.247 0.544 -3.096 1.00 1.03 H new ATOM 0 HG21 VAL C 171 4.005 2.384 -2.051 1.00 0.91 H new ATOM 0 HG22 VAL C 171 5.351 2.960 -3.063 1.00 0.91 H new ATOM 0 HG23 VAL C 171 3.670 3.244 -3.573 1.00 0.91 H new ATOM 2487 N GLY C 172 5.751 -0.336 -6.682 1.00 0.81 N ATOM 2488 CA GLY C 172 5.726 -1.580 -7.426 1.00 0.96 C ATOM 2489 C GLY C 172 5.737 -2.795 -6.520 1.00 0.99 C ATOM 2490 O GLY C 172 5.743 -2.664 -5.294 1.00 1.04 O ATOM 0 H GLY C 172 6.644 0.157 -6.703 1.00 0.81 H new ATOM 0 HA2 GLY C 172 4.836 -1.607 -8.054 1.00 0.96 H new ATOM 0 HA3 GLY C 172 6.588 -1.619 -8.092 1.00 0.96 H new ATOM 2494 N GLU C 173 5.746 -3.975 -7.120 1.00 1.04 N ATOM 2495 CA GLU C 173 5.750 -5.212 -6.356 1.00 1.10 C ATOM 2496 C GLU C 173 7.105 -5.423 -5.682 1.00 1.06 C ATOM 2497 O GLU C 173 8.132 -4.961 -6.182 1.00 1.05 O ATOM 2498 CB GLU C 173 5.395 -6.401 -7.258 1.00 1.25 C ATOM 2499 CG GLU C 173 6.198 -6.474 -8.547 1.00 1.53 C ATOM 2500 CD GLU C 173 5.666 -7.529 -9.493 1.00 1.63 C ATOM 2501 OE1 GLU C 173 4.768 -7.210 -10.305 1.00 1.72 O ATOM 2502 OE2 GLU C 173 6.128 -8.687 -9.426 1.00 1.96 O ATOM 0 H GLU C 173 5.751 -4.102 -8.132 1.00 1.04 H new ATOM 0 HA GLU C 173 4.993 -5.140 -5.576 1.00 1.10 H new ATOM 0 HB2 GLU C 173 5.546 -7.324 -6.698 1.00 1.25 H new ATOM 0 HB3 GLU C 173 4.335 -6.349 -7.507 1.00 1.25 H new ATOM 0 HG2 GLU C 173 6.178 -5.502 -9.041 1.00 1.53 H new ATOM 0 HG3 GLU C 173 7.240 -6.691 -8.312 1.00 1.53 H new ATOM 2509 N PRO C 174 7.123 -6.095 -4.523 1.00 1.09 N ATOM 2510 CA PRO C 174 8.358 -6.359 -3.780 1.00 1.08 C ATOM 2511 C PRO C 174 9.239 -7.404 -4.459 1.00 1.15 C ATOM 2512 O PRO C 174 8.738 -8.337 -5.090 1.00 1.34 O ATOM 2513 CB PRO C 174 7.872 -6.894 -2.428 1.00 1.15 C ATOM 2514 CG PRO C 174 6.399 -6.654 -2.402 1.00 1.30 C ATOM 2515 CD PRO C 174 5.953 -6.648 -3.833 1.00 1.17 C ATOM 0 HA PRO C 174 8.971 -5.461 -3.706 1.00 1.08 H new ATOM 0 HB2 PRO C 174 8.097 -7.955 -2.324 1.00 1.15 H new ATOM 0 HB3 PRO C 174 8.367 -6.381 -1.603 1.00 1.15 H new ATOM 0 HG2 PRO C 174 5.887 -7.433 -1.838 1.00 1.30 H new ATOM 0 HG3 PRO C 174 6.167 -5.705 -1.918 1.00 1.30 H new ATOM 0 HD2 PRO C 174 5.708 -7.649 -4.187 1.00 1.17 H new ATOM 0 HD3 PRO C 174 5.066 -6.032 -3.980 1.00 1.17 H new ATOM 2523 N THR C 175 10.546 -7.244 -4.318 1.00 1.04 N ATOM 2524 CA THR C 175 11.502 -8.169 -4.900 1.00 1.11 C ATOM 2525 C THR C 175 11.567 -9.453 -4.080 1.00 1.12 C ATOM 2526 O THR C 175 11.569 -9.416 -2.848 1.00 1.05 O ATOM 2527 CB THR C 175 12.906 -7.534 -4.977 1.00 1.07 C ATOM 2528 OG1 THR C 175 12.788 -6.141 -5.295 1.00 1.03 O ATOM 2529 CG2 THR C 175 13.761 -8.221 -6.033 1.00 1.30 C ATOM 0 H THR C 175 10.970 -6.474 -3.800 1.00 1.04 H new ATOM 0 HA THR C 175 11.167 -8.404 -5.910 1.00 1.11 H new ATOM 0 HB THR C 175 13.389 -7.656 -4.007 1.00 1.07 H new ATOM 0 HG1 THR C 175 12.462 -5.653 -4.510 1.00 1.03 H new ATOM 0 HG21 THR C 175 14.745 -7.753 -6.065 1.00 1.30 H new ATOM 0 HG22 THR C 175 13.869 -9.276 -5.783 1.00 1.30 H new ATOM 0 HG23 THR C 175 13.282 -8.126 -7.007 1.00 1.30 H new