%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% % B-factor and local structure quality estimation % % in I-TASSER structure modeling % %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% 1. How was the local accuracy estimated? The local accuracy was defined as the distance deviation (in Angstrom) between residue positions in the model and the native structure. It was estimated using support vector regression that makes use of the coverage of threading alignment, divergence of I-TASSER simulation decoys, and sequence-based secondary structure and solvent accessibility predictions. Large-scale benchmark tests show that the estimated local accuracy has an average error of 2.21 Angstrom and the Pearson's correlation coefficient between estimated and actual error is 0.7. Based on these tests, the local accuracy estimations tend to be more accurate for residues: 1) that have higher threading alignment coverage 2) that are located at alpha-helix and beta-strand regions 3) that are buried (at 25% threshold) The estimated local accuracy for each model is available at the columns 61-66 in the model's PDB file and also at the bottom of this page (columns with label RSQ_*). 2. What is normalized B-factor? Normalized B-factor for a target protein is defined as z-score-based normalization of the raw B-factor values. The normalized B-factor (called B-factor profile, BFP) is predicted using a combination of both template-based assignment and profile-based prediction. Based on the distributions and predictions of the BFP, residues with BFP values higher than 0 are less stable in experimental structures. The estimated normalized B-factor is shown at the bottom of this page. For more information about the local accuracy and normalized B-factor predictions, please refer to the following article: J Yang, Y Wang, Y Zhang. ResQ: An approach to unified estimation of B-factor and residue-specific error in protein structure prediction, Journal of Molecular Biology, 428: 693-701 (2016). #RES SS SA COV BFP RSQ_1 RSQ_2 RSQ_3 RSQ_4 1 C E 0.19 1.72 33.26 29.20 19.79 18.60 2 C E 0.18 2.12 31.53 28.11 18.62 17.39 3 H B 0.14 0.25 30.33 26.78 18.16 16.96 4 H B 0.14 -0.08 29.31 25.88 17.88 16.45 5 H B 0.16 0.32 28.00 24.78 16.97 15.62 6 H B 0.16 -0.04 26.87 23.55 16.28 15.32 7 H B 0.16 -0.35 25.66 22.28 16.09 15.02 8 H B 0.16 -0.30 24.42 21.46 15.97 14.42 9 H B 0.16 -0.74 23.24 20.37 15.54 14.04 10 H B 0.16 -0.61 22.03 19.01 14.95 14.02 11 H B 0.16 -0.36 20.87 18.27 14.86 13.99 12 H B 0.16 -0.61 19.82 17.24 14.66 13.91 13 H B 0.16 -0.76 18.83 15.78 14.04 13.88 14 H B 0.16 -0.45 17.81 15.14 13.48 14.13 15 H B 0.16 -0.27 17.02 15.07 13.93 14.03 16 H B 0.16 -0.28 16.15 14.12 14.36 14.26 17 H B 0.18 -0.06 15.74 13.28 13.54 14.70 18 H B 0.18 0.08 15.26 13.69 13.55 14.62 19 C E 0.18 0.20 14.37 13.98 13.82 14.18 20 C E 0.22 0.53 13.18 13.16 12.98 13.27 21 C B 0.19 0.11 11.15 12.03 11.82 11.36 22 C E 0.19 0.29 9.40 10.77 10.76 10.29 23 H E 0.22 0.77 8.12 10.02 9.54 8.86 24 H E 0.30 0.69 7.95 9.83 9.55 8.48 25 H E 0.34 0.45 6.71 9.40 9.73 7.53 26 H E 0.38 0.45 4.82 8.46 8.62 4.92 27 H E 0.45 0.33 4.22 8.47 7.60 4.42 28 H B 0.49 0.13 4.07 8.30 7.46 4.17 29 H E 0.52 0.11 3.87 7.82 7.01 4.15 30 H E 0.54 -0.01 3.71 7.02 6.34 3.93 31 H B 0.54 -0.35 3.46 6.63 6.08 3.96 32 H B 0.58 -0.34 3.58 6.66 6.04 3.96 33 H E 0.66 -0.08 3.65 6.53 5.91 3.82 34 H E 0.68 -0.26 3.31 5.82 5.33 3.71 35 H B 0.68 -0.43 3.23 5.81 5.33 3.78 36 H E 0.68 -0.04 3.52 5.94 5.44 3.82 37 H E 0.69 0.08 3.50 5.69 5.25 3.75 38 H B 0.69 -0.23 3.28 5.20 4.93 3.80 39 H B 0.69 -0.27 3.31 5.50 5.12 3.88 40 H E 0.69 -0.20 3.26 5.48 5.03 3.68 41 H E 0.69 -0.18 3.12 4.98 4.75 3.67 42 H B 0.68 -0.41 3.44 4.98 4.80 3.59 43 H B 0.68 -0.67 3.49 5.23 4.95 3.58 44 H B 0.68 -0.72 3.08 5.41 5.13 3.59 45 H B 0.68 -0.66 3.08 4.98 5.04 3.56 46 H B 0.68 -0.85 3.43 5.25 5.25 3.51 47 H B 0.69 -0.99 3.19 5.53 5.46 3.46 48 H B 0.69 -0.99 2.91 5.45 5.55 3.48 49 H B 0.69 -1.07 3.09 5.52 5.67 3.42 50 H B 0.69 -1.02 3.30 5.84 5.85 3.42 51 H B 0.69 -1.01 2.98 6.14 6.11 3.41 52 H B 0.69 -1.02 2.82 6.14 6.19 3.38 53 H B 0.69 -0.74 3.11 6.40 6.40 3.37 54 H E 0.68 -0.52 3.14 6.73 6.64 3.40 55 C B 0.69 -0.55 2.91 7.23 7.05 3.46 56 C B 0.69 -0.47 2.83 7.02 6.96 3.42 57 C E 0.68 -0.16 2.83 7.25 7.29 3.44 58 C B 0.66 -0.33 2.98 6.96 7.02 3.53 59 C E 0.68 -0.44 2.91 6.51 6.65 3.52 60 H B 0.69 -0.47 3.06 5.83 6.11 3.48 61 H E 0.69 -0.17 3.06 5.82 6.06 3.48 62 H E 0.69 -0.35 3.30 6.20 6.23 3.45 63 H B 0.69 -0.59 3.22 5.97 5.90 3.48 64 H E 0.69 -0.51 3.10 5.68 5.67 3.55 65 H E 0.69 -0.42 3.26 5.98 5.84 3.52 66 H B 0.69 -0.64 3.46 6.20 5.89 3.52 67 H B 0.69 -0.62 3.27 5.82 5.57 3.58 68 H E 0.69 -0.36 3.22 5.95 5.60 3.61 69 H E 0.69 -0.35 3.52 6.33 5.82 3.58 70 H B 0.69 -0.53 3.55 6.33 5.82 3.60 71 H B 0.69 -0.46 3.33 6.02 5.56 3.69 72 H E 0.69 -0.18 3.40 6.44 5.84 3.68 73 H B 0.69 -0.39 3.78 6.75 6.02 3.69 74 H B 0.69 -0.32 3.58 6.44 5.78 3.72 75 H E 0.69 0.09 3.46 6.49 5.78 3.80 76 H E 0.69 0.12 3.77 7.04 6.18 3.79 77 C B 0.67 0.10 4.06 7.24 6.36 3.95 78 C B 0.68 0.09 3.73 6.90 6.14 4.00 79 C E 0.68 0.45 3.82 7.39 6.50 4.03 80 C E 0.68 0.64 4.17 7.66 6.62 3.97 81 C E 0.67 0.68 4.14 7.64 6.63 3.93 82 C E 0.68 0.59 4.05 8.35 7.23 3.91 83 C E 0.68 0.69 3.70 8.35 7.22 3.92 84 H E 0.69 0.59 3.98 8.44 7.25 3.82 85 H E 0.69 0.55 3.78 7.93 6.94 3.81 86 H B 0.69 0.06 3.67 7.63 6.76 3.88 87 H E 0.69 0.19 4.00 8.01 7.07 3.85 88 H E 0.69 0.26 3.82 7.85 6.98 3.74 89 H E 0.69 0.10 3.56 7.61 6.90 3.75 90 H B 0.69 -0.14 3.21 6.83 6.31 3.63 91 H B 0.69 -0.20 3.45 7.07 6.52 3.51 92 H E 0.69 -0.20 3.35 7.33 6.86 3.57 93 H B 0.69 -0.36 3.17 6.95 6.52 3.64 94 H B 0.69 -0.51 3.16 6.74 6.36 3.53 95 H B 0.66 -0.34 3.43 7.25 6.85 3.51 96 H E 0.69 -0.14 3.20 7.50 7.06 3.54 97 H B 0.69 -0.17 3.07 7.16 6.80 3.58 98 H B 0.69 -0.18 3.19 7.12 6.89 3.45 99 C B 0.68 0.00 3.41 8.02 7.86 3.58 100 C E 0.66 0.44 3.33 7.93 7.53 3.77 101 C E 0.64 0.60 3.21 7.17 6.94 3.68 102 C E 0.66 0.70 3.22 7.77 7.56 3.54 103 C E 0.66 0.53 3.16 7.45 7.37 3.48 104 C B 0.62 0.27 3.41 7.97 8.09 3.60 105 C E 0.63 0.24 3.46 8.22 8.55 3.56 106 C E 0.63 0.36 3.20 8.43 8.23 3.57 107 C E 0.60 0.18 3.26 8.21 8.17 3.65 108 C B 0.58 0.03 3.40 8.54 8.50 3.67 109 C E 0.57 0.12 3.46 8.96 8.94 3.74 110 C E 0.54 0.21 3.61 9.54 9.40 3.86 111 H B 0.52 0.05 3.43 8.31 8.12 3.81 112 H E 0.55 0.10 3.39 8.65 8.29 3.77 113 H E 0.59 0.21 3.51 9.10 8.70 3.63 114 H B 0.59 -0.05 3.49 8.79 8.44 3.69 115 C B 0.58 -0.02 3.35 8.95 8.47 3.78 116 C E 0.58 0.43 3.72 9.33 8.78 3.85 117 C E 0.63 0.66 3.59 9.18 8.48 3.69 118 C E 0.63 0.91 3.51 9.08 8.42 3.80 119 C E 0.62 0.88 3.52 8.46 7.77 3.86 120 H E 0.62 0.62 3.60 8.01 7.18 3.65 121 H E 0.62 0.41 3.57 8.36 7.63 3.60 122 H B 0.63 0.03 3.22 8.19 7.62 3.63 123 H E 0.63 0.05 3.22 7.57 7.06 3.61 124 H E 0.62 -0.02 3.44 7.78 7.21 3.53 125 H B 0.63 -0.36 3.25 8.12 7.64 3.50 126 H B 0.63 -0.37 3.04 7.82 7.45 3.55 127 H E 0.63 -0.12 3.15 7.65 7.18 3.49 128 H E 0.64 -0.07 3.25 8.13 7.63 3.42 129 C B 0.66 -0.12 3.09 8.32 7.97 3.54 130 C E 0.67 -0.05 2.91 7.87 7.58 3.46 131 C E 0.66 0.03 2.97 8.01 7.80 3.40 132 C E 0.63 0.15 2.94 8.00 7.78 3.48 133 C E 0.66 0.21 2.80 8.09 7.98 3.40 134 C E 0.67 0.20 2.81 7.87 7.95 3.41 135 C E 0.67 0.19 2.74 7.10 7.27 3.37 136 C B 0.68 -0.13 2.79 7.13 7.43 3.44 137 C E 0.66 -0.04 3.21 7.28 7.54 4.00 138 C E 0.62 -0.00 3.81 6.87 7.54 4.54 139 C B 0.60 -0.16 3.44 6.59 7.26 4.24 140 C E 0.56 -0.09 3.55 6.37 7.20 4.29 141 C B 0.60 -0.15 3.36 5.96 6.76 3.97 142 C E 0.60 -0.11 3.59 6.18 6.95 4.03 143 H E 0.58 -0.05 3.50 5.91 6.68 3.93 144 H E 0.58 -0.06 3.34 5.95 6.70 3.92 145 H E 0.58 -0.21 3.42 5.64 6.58 3.75 146 H B 0.59 -0.39 3.27 5.14 6.18 3.61 147 H B 0.63 -0.42 3.27 5.13 5.77 3.69 148 H E 0.62 -0.17 3.15 5.12 5.99 3.71 149 H E 0.62 -0.21 3.45 4.57 5.70 3.71 150 H B 0.63 -0.18 3.50 4.79 5.62 3.73 151 H E 0.63 0.10 3.27 4.87 5.50 3.76 152 H E 0.64 0.25 3.27 4.45 5.22 3.70 153 H E 0.65 0.12 3.71 4.60 5.17 3.82 154 H E 0.65 0.16 3.37 4.45 5.36 3.68 155 H E 0.67 0.03 3.49 4.33 5.04 3.61 156 H E 0.67 -0.16 3.02 4.34 5.16 3.55 157 H B 0.69 -0.53 2.86 4.52 5.54 3.54 158 H B 0.69 -0.64 3.25 4.65 5.50 3.52 159 H E 0.69 -0.57 3.25 4.43 5.26 3.48 160 H E 0.69 -0.69 2.82 4.91 5.76 3.45 161 H B 0.69 -0.92 2.90 5.39 6.20 3.43 162 H B 0.69 -1.09 3.23 4.88 5.54 3.45 163 H B 0.68 -1.09 3.00 5.20 5.87 3.40 164 H B 0.68 -0.90 2.75 5.78 6.40 3.38 165 H B 0.68 -0.94 2.97 5.85 6.38 3.38 166 H B 0.68 -0.91 3.14 5.74 6.21 3.40 167 H B 0.68 -0.72 2.94 6.30 6.68 3.37 168 C E 0.69 -0.56 2.91 6.82 7.07 3.46 169 C B 0.69 -0.84 3.04 6.67 6.91 3.41 170 C B 0.69 -0.69 3.08 6.50 6.75 3.44 171 C B 0.67 -0.71 3.14 6.74 6.86 3.46 172 C B 0.66 -0.85 2.93 6.17 6.50 3.50 173 C B 0.67 -0.79 3.07 6.11 6.57 3.51 174 H B 0.68 -0.68 2.97 5.57 6.13 3.53 175 H E 0.69 -0.73 3.00 5.20 5.67 3.53 176 H B 0.70 -0.85 2.85 5.35 6.00 3.45 177 H B 0.70 -0.86 2.74 5.01 5.84 3.44 178 H B 0.70 -0.79 2.92 4.62 5.42 3.49 179 H E 0.70 -0.68 2.95 4.87 5.63 3.51 180 H B 0.70 -0.75 2.72 4.94 5.86 3.47 181 H B 0.70 -0.72 2.79 4.61 5.55 3.47 182 H E 0.70 -0.40 3.00 4.81 5.51 3.54 183 H E 0.69 -0.48 2.87 5.07 5.86 3.55 184 H B 0.69 -0.64 2.74 4.89 5.77 3.52 185 H E 0.69 -0.38 2.96 4.95 5.64 3.55 186 H E 0.70 -0.32 3.02 5.33 5.86 3.61 187 H B 0.70 -0.56 2.78 5.63 6.31 3.58 188 H B 0.70 -0.52 2.80 5.55 6.22 3.55 189 H E 0.70 -0.20 3.14 5.78 6.19 3.62 190 H E 0.70 -0.10 3.02 5.92 6.38 3.68 191 H B 0.69 -0.36 2.83 6.12 6.70 3.67 192 H B 0.69 -0.35 2.89 5.80 6.35 3.64 193 C E 0.63 0.19 3.33 6.11 6.45 3.92 194 C E 0.60 0.38 3.31 6.63 6.90 3.96 195 C E 0.58 0.53 3.21 6.75 6.91 4.04 196 C E 0.68 0.32 3.05 6.86 7.33 3.75 197 H E 0.67 0.05 3.30 6.33 6.78 3.62 198 H E 0.69 -0.00 2.89 6.34 6.92 3.57 199 H E 0.69 -0.06 3.05 7.04 7.31 3.59 200 H B 0.70 -0.35 3.36 6.79 7.06 3.56 201 H B 0.70 -0.51 3.07 6.21 6.80 3.49 202 H E 0.70 -0.22 2.77 6.57 7.15 3.48 203 H E 0.70 -0.11 3.02 7.11 7.48 3.47 204 H E 0.71 -0.24 3.19 6.47 6.96 3.46 205 H B 0.71 -0.33 2.82 6.22 6.93 3.39 206 H E 0.71 -0.14 2.71 6.70 7.24 3.38 207 H E 0.71 -0.12 3.03 6.59 7.02 3.39 208 H B 0.67 -0.44 3.03 6.17 6.83 3.43 209 H E 0.70 -0.30 2.70 6.14 6.82 3.34 210 H E 0.68 -0.19 2.84 6.66 7.12 3.36 211 H E 0.70 -0.29 3.00 6.21 6.70 3.36 212 H B 0.70 -0.56 2.83 5.86 6.56 3.32 213 H E 0.70 -0.49 2.76 6.31 6.84 3.29 214 H E 0.74 -0.33 2.82 6.40 6.76 3.27 215 H B 0.76 -0.44 2.85 5.82 6.39 3.26 216 H B 0.76 -0.44 2.77 5.78 6.40 3.22 217 H E 0.76 -0.35 2.75 6.13 6.52 3.20 218 H E 0.79 -0.33 2.75 5.97 6.27 3.19 219 H B 0.81 -0.45 2.74 5.56 6.12 3.17 220 H E 0.81 -0.47 2.78 5.73 6.26 3.13 221 H E 0.81 -0.56 2.73 5.63 5.98 3.13 222 H B 0.80 -0.64 2.76 5.25 5.85 3.20 223 H B 0.82 -0.70 2.81 5.17 5.99 3.16 224 H E 0.85 -0.58 2.81 5.23 5.85 3.08 225 H B 0.86 -0.68 2.69 5.05 5.70 3.09 226 H B 0.86 -0.74 2.72 5.02 5.92 3.14 227 H E 0.86 -0.32 2.87 5.39 6.31 3.12 228 H E 0.86 -0.24 2.87 5.28 6.20 3.10 229 H B 0.85 -0.32 2.82 4.99 5.97 3.17 230 C E 0.80 -0.29 2.85 5.19 6.11 3.34 231 H E 0.81 -0.21 2.73 5.28 6.05 3.31 232 H E 0.81 -0.25 2.89 4.91 5.84 3.28 233 H B 0.81 -0.53 2.71 5.01 5.77 3.21 234 H B 0.81 -0.74 2.60 5.20 5.77 3.27 235 H E 0.81 -0.71 2.79 5.01 5.75 3.30 236 H B 0.81 -0.72 2.82 4.66 5.44 3.25 237 H B 0.81 -0.83 2.56 4.81 5.27 3.23 238 H B 0.81 -0.89 2.65 4.92 5.41 3.28 239 H B 0.81 -1.01 2.85 4.56 5.16 3.29 240 H B 0.81 -1.03 2.67 4.47 4.82 3.26 241 H B 0.81 -0.88 2.55 4.65 4.92 3.27 242 H B 0.81 -0.98 2.75 4.76 5.10 3.31 243 H B 0.81 -1.02 2.91 4.52 4.71 3.34 244 H B 0.80 -0.87 2.69 4.57 4.64 3.36 245 H B 0.80 -0.77 2.69 4.83 5.05 3.36 246 C B 0.80 -0.73 3.06 4.79 5.12 3.45 247 C B 0.80 -0.61 3.24 4.47 4.67 3.48 248 C E 0.78 -0.38 3.20 4.57 4.80 3.54 249 C B 0.79 -0.41 3.38 4.39 4.98 3.53 250 C E 0.81 -0.32 3.55 4.25 4.83 3.54 251 H B 0.81 -0.53 3.29 4.24 4.99 3.40 252 H E 0.81 -0.30 3.17 4.91 5.62 3.43 253 H E 0.81 -0.41 2.90 5.01 5.56 3.47 254 H B 0.81 -0.66 3.03 4.64 5.35 3.36 255 H E 0.81 -0.63 3.32 4.70 5.58 3.38 256 H E 0.81 -0.56 2.98 5.15 5.88 3.42 257 H B 0.81 -0.81 2.85 5.18 5.84 3.40 258 H B 0.81 -0.74 3.14 4.92 5.80 3.31 259 H E 0.81 -0.44 3.15 5.11 6.03 3.35 260 H E 0.80 -0.42 2.88 5.40 6.13 3.42 261 H B 0.80 -0.57 2.86 5.27 6.04 3.33 262 H B 0.80 -0.46 3.18 5.17 6.13 3.29 263 H E 0.80 -0.31 2.96 5.43 6.33 3.34 264 H B 0.80 -0.52 2.79 5.56 6.31 3.37 265 H B 0.80 -0.51 2.92 5.40 6.28 3.25 266 H E 0.80 -0.13 3.10 5.29 6.31 3.26 267 H E 0.80 -0.20 2.84 5.68 6.57 3.32 268 H B 0.78 -0.38 2.78 5.68 6.42 3.35 269 H B 0.78 -0.35 2.99 5.43 6.33 3.26 270 C E 0.79 -0.07 3.02 5.17 6.16 3.33 271 C B 0.79 0.01 2.80 5.13 6.05 3.38 272 C E 0.79 0.06 2.91 4.99 5.96 3.41 273 H E 0.80 0.05 2.92 5.09 5.95 3.46 274 H B 0.78 0.06 3.12 5.31 6.41 3.42 275 H E 0.78 0.07 3.32 5.59 6.74 3.40 276 H B 0.78 -0.29 2.96 5.42 6.31 3.39 277 H B 0.79 -0.39 2.91 5.62 6.44 3.44 278 H E 0.79 -0.18 3.25 5.76 6.81 3.45 279 H E 0.79 -0.20 3.29 5.68 6.71 3.42 280 H B 0.79 -0.36 2.92 5.60 6.36 3.44 281 H E 0.79 -0.24 3.02 5.84 6.67 3.48 282 H E 0.79 -0.17 3.41 5.74 6.75 3.49 283 H B 0.80 -0.52 3.17 5.52 6.36 3.45 284 H B 0.80 -0.49 2.94 5.67 6.32 3.50 285 H E 0.80 -0.26 3.21 5.85 6.70 3.51 286 H E 0.80 -0.34 3.46 5.44 6.36 3.52 287 H B 0.80 -0.44 3.09 5.63 6.27 3.53 288 H B 0.79 -0.35 3.05 6.08 6.66 3.58 289 H E 0.79 -0.00 3.46 5.65 6.47 3.61 290 C E 0.79 0.08 3.59 5.39 6.13 3.74 291 H B 0.79 0.01 3.23 5.24 5.86 3.63 292 H E 0.78 0.08 3.53 5.32 5.90 3.65 293 H E 0.78 -0.11 3.69 4.80 5.58 3.59 294 H B 0.79 -0.29 3.21 4.70 5.38 3.49 295 H E 0.80 -0.20 3.04 5.15 5.50 3.63 296 H E 0.81 -0.19 3.00 5.13 5.61 3.60 297 H E 0.81 -0.28 2.90 5.30 5.91 3.55 298 H B 0.81 -0.35 3.08 5.26 6.05 3.43 299 H E 0.81 -0.14 3.03 5.44 6.20 3.52 300 H E 0.80 0.03 2.94 5.84 6.65 3.54 301 H B 0.79 -0.22 3.20 5.74 6.63 3.46 302 H B 0.79 -0.16 3.47 5.83 6.77 3.54 303 C E 0.77 0.29 3.27 6.48 7.32 3.77 304 C E 0.77 0.32 3.15 6.46 7.37 3.64 305 C E 0.76 0.28 3.48 6.55 7.58 3.62 306 C E 0.76 0.27 3.68 6.60 7.59 3.60 307 H E 0.77 0.09 3.05 6.59 7.36 3.58 308 H E 0.77 -0.04 3.05 6.81 7.46 3.59 309 H B 0.78 -0.30 3.34 6.54 7.29 3.49 310 H B 0.79 -0.43 3.22 6.01 6.84 3.40 311 H E 0.79 -0.44 2.79 6.19 6.79 3.40 312 H B 0.79 -0.59 2.92 6.09 6.59 3.44 313 H B 0.80 -0.65 3.23 5.33 6.00 3.40 314 H E 0.81 -0.36 2.95 5.18 5.86 3.31 315 H E 0.81 -0.14 2.74 5.42 5.84 3.39 316 C B 0.81 -0.29 2.97 5.34 5.77 3.43 317 C E 0.79 -0.16 3.00 5.08 5.44 3.45 318 C E 0.79 -0.04 3.24 4.93 5.30 3.44 319 C E 0.74 0.31 3.08 5.07 5.37 3.56 320 C E 0.68 0.49 3.32 5.08 5.50 3.73 321 C E 0.66 0.24 3.68 4.87 5.21 3.80 322 C B 0.70 0.21 3.33 4.76 4.98 3.70 323 C E 0.73 0.41 3.18 4.78 5.19 3.64 324 C E 0.73 0.38 3.41 4.78 5.25 3.61 325 C B 0.74 0.09 3.43 4.78 5.26 3.57 326 C E 0.73 0.06 3.40 4.77 5.19 3.59 327 C B 0.75 -0.07 3.17 4.44 5.10 3.47 328 C E 0.73 0.19 3.33 4.53 5.12 3.51 329 C E 0.71 0.12 3.38 4.71 5.50 3.51 330 C E 0.70 0.25 3.22 4.99 5.61 3.56 331 C E 0.58 0.36 3.53 5.18 5.72 3.76 332 C B 0.59 0.01 3.61 5.10 5.81 3.72 333 C B 0.76 0.16 3.37 4.83 5.70 3.50 334 C E 0.76 0.42 3.10 5.03 5.79 3.52 335 C E 0.78 0.33 3.13 4.95 5.63 3.54 336 H E 0.79 0.22 3.56 5.23 5.97 3.60 337 H E 0.79 0.03 3.14 5.10 5.74 3.50 338 H B 0.79 -0.33 3.06 4.97 5.72 3.43 339 H B 0.79 -0.19 3.32 5.21 5.98 3.46 340 H E 0.76 0.12 3.12 5.43 6.16 3.58 341 C E 0.75 0.10 3.11 5.18 5.86 3.72 342 C E 0.73 -0.11 3.38 5.17 5.96 3.63 343 C E 0.74 0.24 3.56 5.54 6.36 3.69 344 C E 0.74 0.41 3.24 5.39 6.14 3.73 345 C E 0.76 0.34 3.10 5.10 5.87 3.59 346 H E 0.76 0.11 3.15 5.09 6.04 3.44 347 H E 0.78 0.02 2.83 5.06 5.81 3.42 348 H E 0.78 -0.24 2.88 4.86 5.55 3.47 349 H B 0.79 -0.60 3.04 4.52 5.42 3.41 350 H B 0.79 -0.73 2.88 4.62 5.45 3.33 351 H E 0.79 -0.68 2.72 4.71 5.27 3.38 352 H E 0.79 -0.78 2.84 4.46 5.07 3.40 353 H B 0.79 -0.96 2.93 4.25 5.04 3.33 354 H B 0.79 -0.98 2.65 4.34 4.88 3.30 355 H B 0.79 -0.96 2.68 4.42 4.74 3.36 356 H B 0.79 -0.82 2.83 4.23 4.69 3.36 357 H B 0.79 -0.86 2.76 4.06 4.63 3.30 358 H B 0.79 -0.82 2.59 4.23 4.43 3.32 359 H B 0.79 -0.65 2.71 4.42 4.43 3.39 360 C E 0.78 -0.62 2.92 4.50 4.61 3.49 361 C E 0.73 -0.65 2.80 4.45 4.69 3.43 362 C B 0.76 -0.48 2.67 4.61 4.88 3.38 363 C E 0.71 -0.27 2.75 4.81 5.03 3.42 364 C B 0.78 -0.44 2.90 4.45 4.70 3.31 365 C E 0.78 -0.52 2.65 4.52 4.72 3.26 366 H B 0.78 -0.55 2.85 4.39 4.72 3.24 367 H E 0.79 -0.60 2.84 4.32 4.78 3.19 368 H B 0.79 -0.77 2.69 4.16 4.47 3.18 369 H B 0.79 -0.81 2.72 4.23 4.54 3.22 370 H B 0.79 -0.73 2.89 4.24 5.01 3.23 371 H E 0.79 -0.63 2.87 4.24 5.05 3.20 372 H B 0.79 -0.71 2.70 4.18 4.89 3.22 373 H B 0.79 -0.67 2.81 4.37 5.07 3.27 374 H E 0.79 -0.30 3.02 4.45 5.36 3.26 375 H B 0.79 -0.37 2.87 4.45 5.39 3.23 376 H B 0.79 -0.52 2.73 4.54 5.38 3.28 377 H E 0.79 -0.29 2.96 4.76 5.58 3.31 378 H E 0.79 -0.12 3.13 4.82 5.83 3.29 379 H B 0.79 -0.33 2.86 4.77 5.77 3.29 380 H B 0.78 -0.34 2.84 4.90 5.78 3.37 381 H E 0.78 -0.03 3.18 5.01 5.94 3.39 382 H E 0.78 0.10 3.22 5.01 6.10 3.36 383 H B 0.77 -0.15 2.89 4.99 6.04 3.41 384 H B 0.78 -0.12 2.93 5.14 6.05 3.47 385 C E 0.78 0.33 3.50 5.52 6.53 3.62 386 C E 0.78 0.44 3.31 5.57 6.66 3.51 387 C E 0.78 0.56 3.11 5.53 6.56 3.60 388 C E 0.76 0.36 2.93 5.29 6.34 3.60 389 H E 0.75 0.22 3.00 5.21 6.22 3.52 390 H E 0.76 0.36 2.85 5.19 6.25 3.45 391 H E 0.75 0.29 3.21 5.01 6.16 3.44 392 H B 0.74 -0.03 3.09 5.09 6.11 3.43 393 H B 0.76 -0.09 2.75 5.17 6.11 3.39 394 H E 0.77 0.16 2.76 5.02 5.99 3.44 395 H E 0.78 0.18 2.69 5.08 6.05 3.37 396 H E 0.79 0.10 2.68 4.79 5.56 3.35 397 H E 0.79 0.16 2.50 4.28 5.07 3.25 398 H E 0.81 0.27 2.72 4.39 5.37 3.19 399 H E 0.82 0.16 2.67 4.41 5.21 3.17 400 H B 0.79 -0.16 2.42 4.29 5.10 3.20 401 H E 0.81 -0.04 2.45 4.25 5.21 3.13 402 H E 0.78 0.02 2.61 4.26 5.14 3.18 403 H E 0.80 -0.24 2.43 4.19 4.83 3.15 404 H B 0.79 -0.46 2.38 4.11 4.69 3.16 405 H E 0.80 -0.31 2.44 4.11 4.88 3.12 406 H E 0.81 -0.30 2.45 4.06 4.87 3.10 407 H B 0.81 -0.52 2.33 3.92 4.58 3.09 408 H B 0.80 -0.42 2.37 4.13 4.72 3.11 409 H E 0.80 -0.30 2.42 4.20 5.09 3.12 410 H B 0.80 -0.45 2.36 4.09 4.92 3.10 411 H B 0.79 -0.57 2.38 3.90 4.78 3.12 412 H E 0.79 -0.37 2.40 4.15 5.06 3.14 413 H E 0.78 -0.31 2.42 4.31 5.20 3.17 414 H B 0.77 -0.49 2.42 4.14 5.05 3.18 415 H B 0.77 -0.59 2.49 4.09 5.06 3.19 416 H E 0.77 -0.35 2.44 4.43 5.38 3.21 417 H E 0.77 -0.35 2.41 4.46 5.30 3.22 418 H B 0.77 -0.43 2.52 4.02 4.96 3.21 419 H E 0.77 0.01 2.57 4.31 5.35 3.24 420 H E 0.77 0.14 2.47 4.85 5.79 3.29 421 C B 0.77 -0.15 2.51 4.52 5.29 3.34 422 C E 0.74 -0.13 2.74 4.08 5.00 3.37 423 H E 0.74 0.03 2.75 4.07 4.70 3.35 424 H E 0.74 -0.03 2.46 4.03 4.58 3.33 425 H E 0.74 -0.27 2.50 4.32 4.99 3.34 426 H B 0.74 -0.65 2.66 4.35 4.89 3.29 427 H B 0.74 -0.57 2.50 4.31 4.74 3.26 428 H E 0.74 -0.49 2.45 4.46 5.11 3.29 429 H B 0.74 -0.61 2.51 4.62 5.29 3.27 430 H B 0.74 -0.74 2.54 4.72 5.20 3.25 431 H B 0.74 -0.73 2.44 4.80 5.39 3.24 432 H E 0.73 -0.58 2.48 4.97 5.71 3.28 433 H E 0.73 -0.50 2.52 5.14 5.79 3.26 434 H B 0.73 -0.80 2.52 5.28 5.82 3.25 435 H B 0.74 -0.64 2.49 5.33 6.04 3.23 436 H E 0.73 -0.32 2.53 5.50 6.31 3.29 437 H E 0.71 -0.22 2.57 5.73 6.37 3.31 438 C B 0.71 -0.37 2.64 5.80 6.44 3.34 439 C B 0.73 -0.23 2.71 5.82 6.60 3.31 440 C E 0.73 -0.06 2.67 6.08 6.73 3.35 441 C B 0.73 -0.26 2.71 5.91 6.47 3.31 442 C E 0.73 -0.32 2.66 5.83 6.50 3.28 443 H B 0.74 -0.37 2.64 5.51 6.18 3.21 444 H E 0.74 -0.19 2.68 5.59 5.99 3.23 445 H E 0.74 -0.36 2.59 5.52 5.99 3.21 446 H B 0.74 -0.55 2.53 5.19 5.87 3.19 447 H E 0.74 -0.49 2.59 5.03 5.57 3.20 448 H E 0.74 -0.39 2.67 5.18 5.50 3.22 449 H B 0.74 -0.58 2.60 4.87 5.34 3.21 450 H B 0.74 -0.58 2.50 4.52 5.18 3.20 451 H E 0.74 -0.37 2.59 4.48 4.92 3.22 452 H E 0.74 -0.33 2.72 4.66 4.93 3.24 453 H B 0.74 -0.50 2.60 4.31 4.69 3.22 454 H B 0.74 -0.49 2.49 4.10 4.59 3.22 455 H E 0.74 -0.31 2.69 4.29 4.60 3.25 456 H B 0.74 -0.54 2.78 4.43 4.67 3.27 457 H B 0.74 -0.58 2.56 4.28 4.50 3.25 458 H E 0.74 -0.43 2.58 4.20 4.61 3.28 459 H E 0.74 -0.48 2.86 4.50 4.95 3.32 460 H B 0.73 -0.63 2.88 4.67 4.96 3.35 461 C B 0.71 -0.49 2.74 4.73 5.19 3.44 462 C E 0.70 -0.10 2.78 5.18 5.75 3.44 463 C B 0.66 -0.09 3.16 4.89 5.43 3.54 464 C E 0.66 0.07 3.01 4.89 5.30 3.56 465 C E 0.59 0.25 3.24 4.77 5.29 3.69 466 C E 0.58 0.28 3.31 4.91 5.32 3.70 467 C E 0.60 0.11 3.03 4.80 5.26 3.62 468 C E 0.69 -0.32 2.76 4.73 5.05 3.47 469 C B 0.71 -0.38 3.00 4.81 5.02 3.46 470 C E 0.71 -0.49 2.83 4.79 5.08 3.42 471 H B 0.70 -0.65 2.57 4.66 4.99 3.36 472 H B 0.71 -0.68 2.65 4.81 5.00 3.29 473 H E 0.71 -0.36 2.83 5.27 5.41 3.31 474 C E 0.68 -0.10 2.79 5.51 5.79 3.47 475 C B 0.66 -0.41 2.71 4.97 5.40 3.48 476 H B 0.70 -0.53 2.70 4.70 4.94 3.27 477 H E 0.73 -0.32 2.70 4.90 5.09 3.24 478 H E 0.69 -0.35 2.55 5.12 5.51 3.27 479 H B 0.70 -0.61 2.54 4.62 5.16 3.24 480 H B 0.71 -0.56 2.67 4.37 4.86 3.23 481 H E 0.70 -0.39 2.64 4.64 5.13 3.25 482 H E 0.70 -0.34 2.53 4.73 5.34 3.23 483 H B 0.70 -0.37 2.61 4.51 5.27 3.22 484 H B 0.68 -0.20 2.70 4.88 5.56 3.29 485 H E 0.62 -0.04 2.74 5.32 5.98 3.38 486 C E 0.62 0.12 2.85 5.58 6.37 3.47 487 C E 0.60 0.09 2.91 5.43 6.32 3.50 488 C E 0.59 0.32 2.93 5.62 6.36 3.54 489 C E 0.55 0.35 3.04 6.78 7.58 3.59 490 C B 0.56 0.20 2.96 5.99 6.90 3.48 491 C E 0.63 0.09 2.83 5.99 6.90 3.40 492 C E 0.62 -0.08 2.91 6.11 7.04 3.41 493 C B 0.62 -0.13 2.82 5.69 6.65 3.45 494 C E 0.62 0.02 2.89 5.70 6.57 3.56 495 H E 0.63 -0.01 2.78 5.18 6.15 3.41 496 H B 0.64 -0.43 2.72 5.32 6.03 3.36 497 H E 0.64 -0.21 2.75 5.35 6.07 3.40 498 H E 0.64 -0.07 2.76 4.94 5.86 3.38 499 H B 0.64 -0.33 2.70 4.65 5.44 3.36 500 H B 0.63 -0.35 2.74 4.91 5.53 3.39 501 C E 0.63 0.23 2.96 5.06 5.79 3.55 502 C E 0.63 0.56 2.90 4.80 5.46 3.47 503 C E 0.63 0.50 2.84 4.67 5.14 3.51 504 C E 0.64 0.17 2.82 4.59 5.29 3.50 505 C E 0.64 -0.03 2.89 4.58 5.09 3.47 506 C E 0.64 -0.11 3.01 4.39 5.17 3.45 507 C B 0.63 -0.46 2.80 4.34 5.12 3.43 508 C E 0.63 -0.50 2.78 4.38 5.00 3.45 509 H B 0.63 -0.68 2.83 4.43 5.16 3.36 510 H B 0.63 -0.76 2.84 4.50 5.33 3.37 511 H B 0.63 -0.83 2.68 4.30 5.21 3.31 512 H E 0.63 -0.50 2.71 4.32 5.24 3.34 513 C E 0.64 -0.30 2.89 4.61 5.42 3.47 514 C B 0.63 -0.46 2.82 4.52 5.43 3.41 515 C E 0.60 -0.17 2.88 4.58 5.56 3.43 516 C E 0.60 -0.18 2.85 5.54 6.43 3.42 517 C B 0.60 0.04 2.83 6.19 6.99 3.53 518 C E 0.62 0.54 2.96 6.55 7.54 3.50 519 C E 0.56 0.47 3.02 7.12 7.96 3.66 520 C B 0.56 0.23 3.12 6.88 7.70 3.59 521 C E 0.56 0.31 3.15 6.87 7.80 3.62 522 C B 0.62 0.32 3.21 6.72 7.56 3.57 523 C E 0.62 0.50 3.01 6.71 7.38 3.58 524 C E 0.62 0.57 3.08 6.48 7.31 3.58 525 C B 0.62 0.27 3.31 7.38 7.97 3.62 526 C E 0.62 0.31 3.09 7.71 8.15 3.62 527 H E 0.62 0.47 3.23 9.10 9.51 3.66 528 H E 0.62 0.45 3.20 9.08 9.21 3.59 529 H E 0.62 0.23 3.00 7.28 7.68 3.55 530 C B 0.60 0.07 3.20 7.44 7.96 3.69 531 C E 0.60 0.13 3.10 7.59 7.95 3.62 532 C B 0.60 0.21 3.39 7.11 7.35 3.69 533 C E 0.60 0.45 3.16 6.69 6.95 3.69 534 H E 0.62 0.52 3.39 6.57 6.77 3.70 535 H E 0.62 0.29 3.28 6.55 6.56 3.65 536 H B 0.62 0.03 3.08 6.11 6.34 3.63 537 H B 0.63 0.18 3.25 5.77 6.00 3.65 538 C E 0.63 0.38 3.35 5.92 5.83 3.77 539 C E 0.63 0.34 3.16 5.40 5.52 3.65 540 C E 0.63 0.42 3.26 4.79 5.04 3.63 541 H E 0.63 0.61 2.90 4.18 4.59 3.60 542 H E 0.62 0.60 2.87 4.57 5.06 3.54 543 H E 0.59 0.46 2.67 4.95 5.44 3.58 544 H E 0.59 0.26 2.71 4.66 5.11 3.60 545 H E 0.60 0.01 2.85 4.35 4.75 3.55 546 H E 0.62 -0.09 2.68 4.86 5.28 3.50 547 H E 0.62 -0.36 2.62 5.13 5.65 3.52 548 H B 0.62 -0.64 2.70 4.91 5.50 3.51 549 H B 0.62 -0.71 2.73 5.08 5.53 3.48 550 H E 0.63 -0.70 2.63 5.39 5.88 3.47 551 H B 0.63 -0.86 2.62 5.43 6.08 3.48 552 H B 0.63 -0.99 2.71 5.37 6.02 3.47 553 H B 0.63 -0.94 2.66 5.66 6.18 3.46 554 H E 0.63 -0.73 2.64 5.71 6.38 3.46 555 H B 0.63 -0.74 2.72 5.67 6.45 3.46 556 H B 0.63 -0.85 2.68 5.89 6.56 3.48 557 H E 0.62 -0.67 2.74 6.14 6.77 3.53 558 H E 0.62 -0.41 2.82 6.06 6.88 3.55 559 C E 0.58 -0.57 2.93 6.65 7.49 3.62 560 C B 0.63 -0.42 2.86 6.40 7.09 3.57 561 C E 0.62 -0.13 2.89 6.45 7.36 3.56 562 C B 0.62 -0.22 3.13 6.19 7.14 3.54 563 C E 0.60 -0.18 2.99 6.52 7.31 3.57 564 H E 0.62 0.10 2.98 5.63 6.60 3.45 565 H E 0.62 0.09 2.87 5.71 6.57 3.46 566 H B 0.62 -0.33 2.80 5.83 6.64 3.53 567 H B 0.63 -0.39 2.93 5.79 6.46 3.48 568 H E 0.63 -0.19 3.06 5.42 6.27 3.47 569 H E 0.63 -0.14 2.82 5.84 6.64 3.53 570 H B 0.63 -0.31 2.87 6.24 6.81 3.55 571 H B 0.63 -0.29 3.12 6.08 6.64 3.52 572 H E 0.63 0.00 3.04 6.08 6.73 3.53 573 H E 0.63 0.03 2.85 6.51 7.07 3.61 574 H B 0.63 -0.24 3.03 6.56 6.91 3.58 575 H E 0.63 0.01 3.26 6.11 6.60 3.58 576 H E 0.63 0.15 2.97 6.26 6.78 3.61 577 H B 0.60 -0.03 2.92 6.67 6.97 3.70 578 H B 0.60 0.05 3.26 6.37 6.61 3.65 579 H E 0.60 0.47 3.30 5.98 6.40 3.67 580 H E 0.59 0.65 2.99 6.83 7.14 3.77 581 H B 0.59 0.45 3.03 7.18 7.26 3.80 582 C B 0.58 0.44 3.53 6.51 6.59 3.87 583 C E 0.62 0.95 3.47 6.22 6.51 3.89 584 C E 0.62 1.10 3.10 7.20 7.37 3.94 585 C E 0.60 1.35 3.30 7.30 7.28 3.96 586 C E 0.60 1.17 3.27 7.51 7.45 3.96 587 H E 0.57 1.07 3.17 8.80 8.63 4.06 588 H E 0.57 1.04 3.26 7.46 7.41 3.93 589 H E 0.56 0.95 3.04 7.51 7.62 3.95 590 H B 0.56 0.62 3.23 7.40 7.68 3.89 591 H B 0.57 0.34 3.11 7.06 7.29 3.81 592 H E 0.57 0.53 3.04 7.53 7.98 3.93 593 H E 0.59 0.67 3.03 7.72 8.10 3.83 594 H E 0.60 0.49 3.22 7.63 8.05 3.77 595 H B 0.60 0.34 3.01 7.58 7.84 3.75 596 H E 0.60 0.35 2.93 7.62 8.05 3.80 597 H E 0.60 0.24 3.07 7.32 7.90 3.74 598 H B 0.59 -0.06 3.14 6.43 7.03 3.71 599 H B 0.60 -0.02 2.90 6.66 7.14 3.73 600 H E 0.60 0.05 2.92 6.91 7.61 3.74 601 H E 0.60 -0.08 3.10 6.59 7.35 3.68 602 H B 0.60 -0.19 2.98 6.52 7.12 3.67 603 H E 0.60 0.09 2.89 6.51 7.19 3.72 604 H E 0.57 0.28 3.14 6.55 7.42 3.85 605 H B 0.55 0.32 3.30 6.16 7.12 3.85 606 H B 0.54 0.74 3.39 6.32 7.26 4.15 607 C E 0.46 1.73 3.37 6.56 7.72 4.18 RES: Residue number SS: Predicted secondary structure: C - random coil; H - alpha-helix; S - beta-strand SA: Predicted solvent accessibility at 25% cutoff: E - exposed; B - buried COV: Threading alignment coverage defined as the number of threading alignments on the residue divided by the number of total threading programs BFP: Predicted normalized B-factor RSQ_*: Residue-Specific Quality of models defined as the estimated deviation of the residue on the model from the native structure of the protein You are requested to cite the following article when you use the ResQ prediction results: J Yang, Y Wang, Y Zhang. ResQ: An approach to unified estimation of B-factor and residue-specific error in protein structure prediction, Journal of Molecular Biology, 428: 693-701 (2016).