%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% % 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 RSQ_5 1 C E 0.14 1.96 23.88 29.97 24.46 23.20 18.20 2 C B 0.14 1.31 22.61 28.90 23.29 21.71 16.34 3 C E 0.15 0.84 21.53 28.23 21.90 19.91 14.42 4 C E 0.15 0.54 20.65 27.30 20.83 18.52 12.05 5 C E 0.14 0.60 19.33 26.09 19.95 17.28 11.73 6 C E 0.13 0.68 18.20 24.21 19.21 15.39 11.14 7 C E 0.13 0.82 17.90 22.99 19.13 14.05 11.06 8 C E 0.13 0.93 17.48 21.44 18.84 12.09 10.90 9 C E 0.13 1.11 15.90 19.78 18.95 10.82 10.83 10 C E 0.13 1.25 15.31 18.14 18.90 9.79 10.14 11 C E 0.13 1.24 15.08 17.01 19.77 9.28 10.04 12 C E 0.13 1.27 14.59 16.21 20.49 9.72 10.94 13 C E 0.14 1.10 13.51 15.07 20.23 9.77 11.79 14 C E 0.14 0.79 12.36 13.09 19.14 9.81 11.73 15 C E 0.15 0.66 10.87 11.18 16.67 9.76 11.26 16 C B 0.15 0.48 10.16 10.27 15.01 10.28 11.53 17 C E 0.15 0.43 9.17 9.10 12.82 9.46 11.24 18 C E 0.15 0.44 7.91 8.66 11.40 9.43 9.61 19 C E 0.15 0.50 6.40 7.72 9.93 8.23 8.43 20 C E 0.18 0.50 5.71 7.73 8.37 7.17 7.53 21 C E 0.26 0.89 4.13 6.08 6.64 6.08 6.25 22 C E 0.35 0.86 3.74 5.70 5.99 5.76 6.11 23 C E 0.38 0.43 3.21 5.14 5.58 5.24 5.16 24 S E 0.41 0.05 2.88 4.78 5.22 4.92 4.83 25 S B 0.41 -0.38 3.02 4.64 5.08 4.82 4.73 26 S E 0.41 -0.36 3.02 4.65 5.09 4.81 4.71 27 S B 0.40 -0.54 2.69 4.60 5.01 4.78 4.69 28 S E 0.40 -0.61 2.55 4.45 4.85 4.76 4.66 29 S B 0.40 -0.75 2.41 4.41 4.79 4.74 4.65 30 S B 0.40 -0.58 2.40 4.39 4.74 4.72 4.63 31 S B 0.36 -0.67 2.33 4.42 4.74 4.74 4.67 32 S B 0.40 -0.79 2.34 4.45 4.79 4.71 4.63 33 S B 0.40 -0.37 2.50 4.56 4.88 4.83 4.77 34 C B 0.40 0.05 2.95 4.79 5.11 5.07 5.01 35 C B 0.40 -0.24 3.36 4.87 5.22 5.15 5.09 36 C B 0.40 -0.43 3.20 4.89 5.25 5.12 5.06 37 S B 0.42 -0.73 2.48 4.47 4.82 4.77 4.71 38 S B 0.42 -0.78 2.38 4.42 4.77 4.68 4.61 39 S B 0.42 -0.61 2.39 4.43 4.77 4.67 4.61 40 S B 0.42 -0.57 2.49 4.45 4.82 4.70 4.62 41 S B 0.42 -0.44 2.63 4.48 4.85 4.72 4.64 42 C B 0.42 0.07 3.15 4.89 5.28 5.09 4.99 43 C E 0.41 0.66 3.79 5.02 5.43 5.21 5.11 44 C E 0.41 0.97 4.33 5.07 5.47 5.21 5.11 45 C E 0.41 0.57 3.39 5.01 5.38 5.92 6.23 46 C E 0.41 0.35 2.95 4.96 5.32 5.56 5.46 47 S E 0.40 -0.15 2.57 4.54 4.89 5.18 5.03 48 S B 0.41 -0.32 2.44 4.54 4.89 4.99 4.64 49 S B 0.41 -0.83 2.38 4.52 4.86 5.08 4.96 50 S B 0.41 -0.92 2.48 4.53 4.89 5.21 5.17 51 S B 0.41 -0.92 2.39 4.53 4.90 4.98 4.85 52 S B 0.40 -0.83 2.51 4.58 4.98 4.85 4.71 53 S B 0.40 -0.87 2.91 4.86 5.28 5.21 5.27 54 S B 0.40 -0.80 2.84 4.88 5.30 5.02 4.96 55 S B 0.40 -0.90 2.63 4.71 5.11 5.10 4.90 56 C B 0.38 -0.53 3.00 4.96 5.34 5.14 5.08 57 C B 0.40 -0.49 2.92 4.91 5.27 5.14 5.06 58 C B 0.40 -0.29 3.13 4.91 5.26 5.13 5.06 59 C E 0.40 -0.06 3.85 4.95 5.28 5.11 5.05 60 C B 0.40 0.04 5.23 4.95 5.27 5.07 5.01 61 C E 0.38 0.23 6.47 5.05 5.37 5.09 5.03 62 C E 0.38 0.48 7.43 5.11 5.45 5.09 5.05 63 C E 0.40 0.74 7.27 5.07 5.39 5.06 5.11 64 C E 0.40 1.00 7.05 5.09 5.39 5.05 5.05 65 C E 0.40 0.91 5.82 5.03 5.32 5.06 5.05 66 C E 0.40 1.02 5.00 5.14 5.40 5.06 5.04 67 C E 0.38 1.25 4.96 5.11 5.37 5.08 5.12 68 C E 0.37 1.25 3.54 5.06 5.31 5.08 5.05 69 C E 0.37 1.25 3.42 5.03 5.27 6.02 5.60 70 C E 0.34 1.23 3.47 5.16 5.38 6.20 5.71 71 C E 0.35 1.12 5.15 5.09 5.32 6.21 6.20 72 C E 0.35 0.85 5.07 5.09 5.34 6.20 6.35 73 C E 0.34 0.63 4.53 5.04 5.29 5.90 5.77 74 C E 0.33 0.41 3.90 5.07 5.34 6.19 5.54 75 C E 0.32 0.19 4.19 5.02 5.30 7.12 5.68 76 C E 0.34 0.04 3.96 4.97 5.26 5.28 5.35 77 C E 0.36 0.08 2.66 4.89 5.18 5.23 5.08 78 C E 0.36 -0.23 2.71 4.94 5.25 5.18 5.12 79 C E 0.37 -0.47 2.80 4.87 5.21 5.16 5.08 80 H B 0.37 -0.61 2.66 4.86 5.21 5.21 5.12 81 H B 0.37 -0.63 2.53 4.79 5.12 5.11 5.03 82 H E 0.40 -0.44 2.47 4.70 5.02 5.08 4.99 83 H B 0.40 -0.58 2.56 4.67 5.03 5.11 5.00 84 H B 0.40 -0.80 2.56 4.72 5.08 5.10 5.01 85 H B 0.40 -0.67 2.54 4.71 5.05 5.09 5.00 86 H E 0.40 -0.44 2.56 4.65 5.00 5.10 5.00 87 H B 0.38 -0.59 2.62 4.68 5.07 5.14 5.03 88 H B 0.38 -0.61 2.66 4.73 5.10 5.13 5.04 89 H E 0.38 -0.42 2.64 4.69 5.05 5.12 5.03 90 H E 0.38 -0.24 2.68 4.65 5.05 5.15 5.04 91 H E 0.38 -0.28 2.76 4.70 5.12 5.16 5.05 92 H B 0.40 -0.39 2.83 4.82 5.22 5.23 5.13 93 C E 0.41 -0.25 2.78 4.76 5.14 5.18 5.08 94 C E 0.42 -0.18 2.91 4.79 5.18 5.19 5.09 95 C E 0.41 -0.27 3.02 4.89 5.31 5.28 5.17 96 S E 0.41 -0.29 2.63 4.48 4.91 4.82 4.71 97 S B 0.41 -0.58 2.66 4.55 4.97 4.78 4.68 98 S E 0.41 -0.51 2.96 4.52 4.97 4.78 4.68 99 S B 0.41 -0.66 2.83 4.56 4.99 4.76 4.68 100 S E 0.41 -0.57 3.08 4.62 5.06 4.76 4.69 101 S B 0.41 -0.57 3.10 4.65 5.07 4.75 4.69 102 S E 0.41 -0.29 3.09 4.69 5.13 4.78 4.72 103 S B 0.42 -0.18 3.21 4.81 5.23 4.85 4.80 104 S E 0.42 0.08 3.30 4.95 5.35 4.97 4.93 105 C E 0.37 0.11 3.53 5.04 5.42 5.04 5.00 106 C E 0.36 0.36 3.46 5.17 5.53 5.45 5.58 107 C E 0.31 0.14 3.57 5.39 5.74 6.16 5.32 108 C E 0.31 0.21 3.32 5.26 5.60 5.54 5.25 109 C E 0.30 0.16 3.26 5.36 5.71 5.69 5.74 110 C E 0.27 0.15 3.37 5.61 5.87 5.58 5.60 111 C E 0.27 0.16 3.24 5.48 5.81 5.77 5.90 112 C E 0.26 0.37 3.11 5.45 5.74 5.71 5.86 113 C E 0.27 0.48 3.32 5.37 5.78 6.17 5.33 114 C E 0.27 0.55 3.33 5.59 5.78 6.23 5.33 115 C E 0.27 0.36 3.46 5.72 5.86 5.95 5.35 116 C E 0.31 0.28 3.30 5.74 5.91 5.85 5.43 117 C E 0.30 0.09 3.30 5.62 5.84 6.50 5.33 118 C E 0.34 0.40 3.25 5.52 5.67 6.07 5.27 119 C E 0.38 0.30 3.51 5.57 5.65 5.55 5.12 120 S B 0.35 -0.22 3.27 5.53 5.63 5.30 5.05 121 S B 0.36 -0.57 2.95 4.77 5.20 5.18 4.93 122 S B 0.37 -0.71 2.63 4.81 5.21 5.05 5.06 123 S B 0.38 -0.71 2.67 4.56 5.04 4.77 4.71 124 S B 0.35 -0.77 2.71 4.65 5.14 4.98 4.75 125 S B 0.38 -0.79 2.60 4.57 5.05 5.01 4.69 126 S B 0.38 -0.62 2.73 4.50 4.98 4.94 4.72 127 S B 0.38 -0.41 2.59 4.49 5.02 5.09 4.81 128 C E 0.40 -0.07 3.49 4.91 5.38 5.65 5.28 129 C E 0.40 -0.02 3.31 4.92 5.40 5.61 5.16 130 S E 0.41 -0.27 2.92 4.44 4.99 4.89 4.78 131 S E 0.41 -0.63 2.77 4.50 4.96 4.82 4.72 132 H B 0.40 -0.82 2.88 4.81 5.24 5.14 5.05 133 H B 0.38 -0.74 2.77 4.86 5.29 5.15 5.07 134 H E 0.38 -0.57 2.79 4.85 5.30 5.17 5.08 135 H B 0.38 -0.72 2.82 4.78 5.23 5.17 5.07 136 H B 0.38 -0.81 2.72 4.79 5.20 5.15 5.05 137 H B 0.38 -0.69 2.70 4.83 5.26 5.15 5.06 138 H E 0.42 -0.40 2.78 4.75 5.21 5.13 5.03 139 H E 0.42 -0.53 2.83 4.69 5.13 5.12 5.00 140 H B 0.42 -0.78 2.94 4.83 5.25 5.20 5.09 141 C B 0.42 -0.56 2.72 4.78 5.17 5.13 5.04 142 S B 0.43 -0.65 2.51 4.59 4.99 4.88 4.79 143 S B 0.43 -0.56 2.42 4.48 4.89 4.72 4.64 144 S B 0.38 -0.77 2.52 4.64 5.07 5.29 4.84 145 S B 0.43 -0.68 2.64 4.77 5.19 4.91 4.84 146 S E 0.40 -0.38 2.71 4.87 5.32 5.34 4.92 147 S B 0.38 -0.21 2.91 5.00 5.46 5.40 5.10 148 C E 0.40 0.26 3.26 5.31 5.78 5.79 5.62 149 C E 0.40 0.56 3.46 5.39 5.87 5.88 5.61 150 C E 0.41 0.83 3.36 5.36 5.86 5.64 5.34 151 C E 0.35 0.73 3.47 5.41 5.90 5.91 5.73 152 C E 0.35 0.42 3.18 5.29 5.75 5.59 5.23 153 C E 0.35 0.24 3.31 5.25 5.71 5.62 5.28 154 C E 0.38 -0.11 3.09 5.15 5.60 5.38 5.72 155 C B 0.41 -0.37 3.09 5.07 5.53 5.73 5.64 156 H E 0.42 -0.13 3.20 5.10 5.58 5.73 6.01 157 H E 0.42 -0.28 3.29 4.96 5.45 5.48 5.81 158 H B 0.42 -0.47 3.19 4.97 5.45 5.15 5.07 159 H E 0.42 -0.24 3.23 4.96 5.46 5.17 5.08 160 H E 0.41 -0.25 2.88 4.91 5.41 5.17 5.08 161 H B 0.41 -0.55 2.82 4.89 5.37 5.15 5.06 162 H E 0.41 -0.41 2.84 4.92 5.40 5.16 5.07 163 H E 0.41 -0.43 2.79 4.87 5.38 5.17 5.07 164 H B 0.41 -0.59 2.73 4.82 5.30 5.16 5.05 165 H B 0.41 -0.44 2.73 4.84 5.31 5.15 5.05 166 H E 0.41 -0.20 2.74 4.84 5.34 5.17 5.06 167 H E 0.41 -0.36 2.81 4.77 5.27 5.17 5.05 168 H B 0.40 -0.40 2.92 4.78 5.25 5.17 5.05 169 H E 0.40 -0.13 2.88 4.82 5.29 5.18 5.06 170 H E 0.41 0.21 2.81 4.77 5.28 5.19 5.05 171 H E 0.40 0.21 3.11 4.76 5.25 5.30 5.16 172 C E 0.41 0.08 3.12 4.81 5.27 5.23 5.09 173 C E 0.41 -0.08 3.15 4.77 5.21 5.20 5.07 174 C E 0.41 0.00 3.16 4.79 5.20 5.19 5.07 175 C E 0.37 -0.06 3.25 4.84 5.24 5.16 5.05 176 C B 0.42 0.00 3.02 4.67 5.10 5.01 4.89 177 C E 0.41 0.23 3.16 4.67 5.10 5.06 4.93 178 C E 0.41 0.20 3.43 4.78 5.20 5.13 4.99 179 C E 0.42 0.19 2.54 4.76 5.16 5.13 5.01 180 C E 0.40 0.23 2.94 4.84 5.22 5.18 5.07 181 C B 0.40 0.02 2.82 4.84 5.20 5.17 5.06 182 C E 0.36 0.08 2.96 4.81 5.16 5.26 5.16 183 C E 0.40 0.09 3.34 4.75 5.07 5.19 5.07 184 C E 0.38 0.01 3.71 4.71 5.01 5.18 5.07 185 C E 0.40 -0.02 3.89 4.68 4.96 5.05 4.95 186 C B 0.37 -0.05 3.58 4.72 4.99 5.11 5.02 187 C E 0.35 -0.11 3.95 4.83 5.07 5.13 5.03 188 C E 0.36 -0.04 4.00 4.83 5.06 5.12 5.04 189 C B 0.35 -0.06 3.98 4.73 4.95 5.17 5.01 190 C E 0.35 0.04 3.73 4.72 4.93 5.08 5.01 191 C E 0.34 0.26 4.20 4.78 4.97 5.14 5.05 192 C E 0.35 0.29 4.09 4.76 4.96 5.12 5.02 193 H E 0.35 0.10 4.65 4.76 4.96 5.22 5.10 194 H E 0.35 0.29 3.64 4.79 5.01 5.23 5.10 195 H E 0.35 0.12 3.62 4.77 4.99 5.15 5.02 196 H B 0.35 -0.12 3.84 4.73 4.96 5.18 5.04 197 C E 0.36 0.06 3.88 4.81 5.07 5.27 5.12 198 C E 0.36 0.06 3.72 4.81 5.08 5.24 5.10 199 H E 0.36 -0.07 3.62 4.76 5.04 5.17 5.02 200 H B 0.35 -0.08 3.55 4.65 4.95 5.19 5.03 201 H E 0.35 -0.04 3.59 4.68 5.02 5.28 5.12 202 H E 0.35 0.03 3.23 4.67 5.00 5.49 5.11 203 H B 0.33 -0.04 3.17 4.71 5.05 5.59 5.20 204 H E 0.33 0.13 3.92 4.71 5.09 5.44 5.21 205 H E 0.35 0.17 2.94 4.69 5.10 5.40 5.18 206 H E 0.34 0.08 3.79 4.75 5.15 5.35 5.20 207 H E 0.36 0.08 2.84 4.61 5.05 5.25 5.09 208 C E 0.36 0.08 2.69 4.46 4.90 5.11 4.96 209 C B 0.34 -0.28 2.74 4.56 4.96 5.20 5.06 210 C B 0.37 -0.46 2.62 4.51 4.91 5.14 5.01 211 S B 0.37 -0.55 2.32 4.31 4.66 4.96 4.84 212 S B 0.36 -0.80 2.20 4.25 4.57 4.77 4.66 213 S B 0.36 -0.79 2.20 4.26 4.56 4.74 4.64 214 S B 0.36 -0.62 2.26 4.31 4.58 4.71 4.63 215 S B 0.36 -0.61 2.34 4.34 4.59 4.71 4.63 216 S B 0.36 -0.74 2.48 4.48 4.74 4.86 4.78 217 C B 0.36 -0.45 2.70 4.75 4.98 5.09 5.02 218 C E 0.37 -0.24 2.75 4.79 5.04 5.15 5.08 219 C B 0.36 -0.53 2.81 4.78 5.07 5.19 5.10 220 C E 0.36 -0.57 2.76 4.71 5.00 5.16 5.07 221 S B 0.37 -0.72 2.27 4.28 4.54 4.71 4.63 222 S B 0.37 -0.75 2.22 4.26 4.51 4.69 4.61 223 S B 0.37 -0.64 2.23 4.27 4.51 4.68 4.61 224 S B 0.37 -0.63 2.21 4.23 4.50 4.70 4.61 225 S B 0.36 -0.53 2.22 4.29 4.57 4.77 4.67 226 S B 0.34 -0.36 2.43 4.39 4.70 4.99 4.88 227 C E 0.34 -0.08 2.77 4.66 4.99 5.22 5.09 228 C E 0.35 0.30 2.96 4.67 5.01 5.24 5.11 229 C E 0.36 0.43 3.02 4.68 4.98 5.19 5.07 230 C E 0.37 0.15 3.00 4.68 4.96 5.14 5.04 231 C B 0.35 -0.22 2.72 4.65 4.92 5.02 4.92 232 S E 0.36 -0.43 2.43 4.34 4.59 4.83 4.75 233 S B 0.37 -0.48 2.40 4.30 4.53 4.72 4.71 234 S E 0.37 -0.59 2.35 4.38 4.61 4.80 4.72 235 C B 0.37 -0.76 2.47 4.54 4.81 5.03 4.93 236 C B 0.33 -0.68 2.60 4.63 4.92 5.12 5.02 237 C B 0.37 -0.54 2.57 4.45 4.80 5.06 4.95 238 C B 0.37 -0.67 2.72 4.53 4.93 5.09 4.98 239 C B 0.37 -0.65 2.76 4.46 4.88 5.01 4.89 240 S B 0.37 -0.56 2.68 4.36 4.76 4.88 4.76 241 S E 0.36 -0.28 2.88 4.49 4.85 4.96 4.86 242 C B 0.37 -0.59 2.86 4.72 5.04 5.15 5.06 243 C B 0.37 -0.52 2.82 4.78 5.07 5.15 5.06 244 C E 0.37 -0.23 2.99 4.78 5.03 5.11 5.04 245 C E 0.36 -0.19 2.96 4.83 5.06 5.10 5.04 246 C E 0.36 0.28 3.02 4.88 5.09 5.08 5.04 247 C E 0.35 0.38 2.67 4.98 5.15 5.44 5.04 248 C E 0.26 0.11 2.97 5.21 5.37 5.86 5.30 249 C B 0.26 -0.05 2.85 5.20 5.35 5.84 5.90 250 C E 0.26 0.13 2.93 5.26 5.39 5.80 5.80 251 C E 0.27 0.29 2.84 5.23 5.37 5.42 5.89 252 C B 0.30 0.28 2.85 5.14 5.29 5.27 5.25 253 C E 0.29 0.54 2.98 5.18 5.35 5.30 5.27 254 C E 0.34 0.88 3.44 5.04 5.23 5.20 5.09 255 C E 0.40 0.73 3.61 4.88 5.10 5.07 5.02 256 C E 0.38 0.54 3.26 4.86 5.10 5.11 5.05 257 C E 0.40 0.28 3.09 4.81 5.09 5.12 5.04 258 C E 0.37 0.03 2.92 4.82 5.12 5.12 5.03 259 C B 0.35 -0.31 2.87 4.86 5.17 5.18 5.08 260 H B 0.35 -0.39 2.84 4.81 5.09 5.13 5.05 261 H E 0.35 -0.23 2.90 4.84 5.12 5.13 5.05 262 H E 0.35 -0.27 2.84 4.84 5.15 5.16 5.06 263 H B 0.35 -0.63 2.80 4.77 5.09 5.15 5.05 264 H B 0.36 -0.72 2.76 4.76 5.04 5.11 5.03 265 H E 0.36 -0.55 2.87 4.80 5.11 5.13 5.05 266 H B 0.36 -0.71 2.85 4.77 5.11 5.15 5.05 267 H B 0.36 -0.70 2.82 4.71 5.04 5.14 5.04 268 H E 0.36 -0.54 2.80 4.75 5.06 5.13 5.04 269 H E 0.36 -0.25 2.86 4.78 5.12 5.16 5.06 270 H B 0.36 -0.37 2.93 4.80 5.17 5.17 5.06 271 H B 0.35 -0.48 2.83 4.79 5.13 5.25 5.15 272 C E 0.36 -0.21 2.76 4.78 5.10 5.20 5.11 273 C E 0.36 -0.10 2.76 4.77 5.10 5.22 5.13 274 C E 0.36 -0.38 2.80 4.78 5.14 5.28 5.17 275 S E 0.35 -0.31 2.41 4.34 4.71 4.97 4.85 276 S B 0.36 -0.54 2.35 4.22 4.61 4.87 4.75 277 S E 0.37 -0.57 2.36 4.15 4.57 4.77 4.64 278 S B 0.37 -0.70 2.32 4.15 4.54 4.76 4.63 279 S E 0.37 -0.62 2.41 4.14 4.56 4.85 4.71 280 S B 0.37 -0.66 2.50 4.24 4.61 4.83 4.70 281 S E 0.37 -0.32 2.51 4.25 4.65 4.84 4.70 282 S E 0.37 -0.20 2.34 4.28 4.63 4.83 4.70 283 S B 0.36 -0.18 2.35 4.29 4.57 4.85 4.74 284 C B 0.36 -0.09 2.62 4.58 4.83 5.03 4.93 285 C E 0.36 0.14 3.13 4.71 4.93 5.09 5.00 286 C E 0.31 0.04 2.69 4.83 5.02 6.41 5.61 287 C B 0.35 -0.19 3.05 4.84 5.04 6.34 6.56 288 C B 0.35 -0.55 2.78 4.77 4.99 5.50 5.56 289 S B 0.33 -0.88 2.28 4.28 4.56 4.78 4.68 290 S B 0.36 -0.86 2.25 4.27 4.60 4.74 4.62 291 S B 0.36 -0.84 2.45 4.25 4.63 4.76 4.64 292 S B 0.36 -0.92 2.47 4.18 4.59 4.85 4.72 293 S B 0.36 -0.99 2.37 4.19 4.59 4.78 4.65 294 S B 0.36 -0.79 2.52 4.22 4.64 4.81 4.67 295 S B 0.36 -0.52 2.66 4.27 4.68 4.83 4.70 296 C E 0.36 -0.23 3.17 4.74 5.18 5.31 5.16 297 C E 0.36 -0.28 3.61 4.73 5.19 5.30 5.15 298 S E 0.37 -0.15 2.54 4.32 4.77 4.88 4.73 299 S E 0.36 -0.45 2.61 4.41 4.85 5.05 4.91 300 H B 0.36 -0.78 2.85 4.68 5.08 5.29 5.17 301 H B 0.36 -0.72 2.83 4.69 5.09 5.22 5.10 302 H E 0.37 -0.55 2.91 4.71 5.15 5.24 5.10 303 H B 0.37 -0.62 2.98 4.75 5.16 5.24 5.11 304 H B 0.37 -0.67 2.87 4.75 5.13 5.21 5.09 305 H B 0.37 -0.60 2.92 4.76 5.17 5.23 5.10 306 H E 0.37 -0.34 3.14 4.81 5.24 5.27 5.13 307 C E 0.37 -0.25 3.21 4.94 5.35 5.37 5.23 308 C B 0.35 -0.41 3.05 4.91 5.31 5.32 5.19 309 C B 0.36 -0.64 2.92 4.86 5.23 5.27 5.16 310 C B 0.36 -0.59 2.83 4.76 5.13 5.20 5.09 311 C E 0.36 -0.35 3.03 4.72 5.13 5.19 5.07 312 S B 0.35 -0.53 3.18 4.59 5.03 5.09 4.97 313 S E 0.35 -0.41 3.25 4.62 5.06 5.14 5.03 314 C B 0.35 -0.24 3.49 4.65 5.12 5.11 4.99 315 C E 0.36 -0.25 3.98 4.68 5.13 5.15 5.03 316 C B 0.36 -0.07 4.46 4.76 5.23 5.21 5.50 317 C E 0.36 0.35 4.29 4.75 5.25 5.26 5.79 318 C E 0.36 0.36 3.91 4.75 5.25 5.29 5.93 319 C B 0.36 0.17 3.54 4.76 5.25 5.36 5.70 320 H E 0.36 0.31 3.62 4.82 5.32 5.38 5.63 321 H E 0.35 -0.07 3.45 4.74 5.23 5.40 5.16 322 H B 0.35 -0.20 3.59 4.75 5.25 5.30 5.14 323 H E 0.35 0.08 3.85 4.81 5.31 5.32 5.16 324 H E 0.35 -0.18 3.64 4.79 5.28 5.31 5.15 325 H B 0.35 -0.53 3.36 4.77 5.23 5.28 5.14 326 H E 0.34 -0.37 3.72 4.82 5.31 5.31 5.16 327 H E 0.34 -0.16 3.82 4.87 5.36 5.34 5.18 328 H B 0.34 -0.32 3.46 4.86 5.32 5.32 5.17 329 H B 0.33 -0.29 3.36 4.86 5.32 5.32 5.18 330 H E 0.34 0.13 3.58 4.90 5.38 5.34 5.18 331 H E 0.35 0.05 3.58 4.93 5.40 5.34 5.18 332 H B 0.35 -0.04 3.23 4.91 5.35 5.32 5.17 333 H E 0.35 0.35 3.28 4.91 5.36 5.31 5.17 334 H E 0.35 0.56 3.62 4.97 5.44 5.35 5.18 335 H E 0.35 0.51 3.62 4.98 5.43 5.35 5.18 336 C E 0.33 0.45 3.30 4.99 5.42 5.34 5.19 337 C E 0.34 0.28 3.61 4.98 5.39 5.33 5.19 338 C E 0.36 0.13 3.16 4.94 5.31 5.29 5.16 339 C B 0.36 -0.16 2.94 4.87 5.24 5.25 5.13 340 C B 0.37 -0.09 2.96 4.82 5.22 5.20 5.07 341 C B 0.37 0.18 3.40 5.44 5.64 5.19 5.06 342 C E 0.36 -0.03 4.25 6.75 7.39 5.27 5.13 343 C B 0.33 -0.32 5.10 7.76 7.42 5.38 5.25 344 C B 0.34 -0.30 6.04 8.58 8.30 6.90 6.14 345 C B 0.34 -0.29 6.93 9.36 8.48 6.22 6.99 346 C B 0.32 0.18 8.04 10.61 9.61 6.99 8.36 347 C B 0.31 0.39 8.03 10.54 9.84 6.28 8.54 348 C B 0.22 -0.53 8.35 10.65 10.95 6.68 8.64 349 C B 0.21 -0.63 9.08 11.03 11.48 7.41 10.25 350 C B 0.21 -0.74 8.44 10.17 11.84 7.49 8.34 351 C B 0.20 -0.45 6.75 8.03 12.92 6.72 7.15 352 C B 0.27 0.35 5.44 6.25 11.79 6.41 6.38 353 C B 0.29 0.14 4.68 6.19 11.12 6.09 6.79 354 C B 0.30 -0.23 4.18 6.52 9.49 5.98 6.24 355 C B 0.34 -0.18 3.71 6.05 8.70 5.86 5.84 356 C E 0.40 -0.12 3.45 5.69 7.62 5.84 5.64 357 C B 0.45 0.04 3.42 5.66 6.93 5.56 5.65 358 C E 0.48 0.45 3.15 5.38 5.73 5.38 5.18 359 C B 0.52 0.35 2.86 5.17 5.48 5.80 4.99 360 C B 0.54 0.25 2.73 5.08 5.27 5.13 5.33 361 C B 0.63 0.23 2.54 4.90 5.07 5.11 5.20 362 C E 0.70 0.22 2.39 4.78 4.93 5.01 6.08 363 C B 0.76 -0.01 2.28 4.66 4.80 4.90 5.37 364 C B 0.77 -0.26 2.25 4.61 4.74 4.55 5.39 365 C B 0.78 -0.39 2.21 4.66 4.78 4.53 5.71 366 C B 0.78 -0.59 2.15 4.62 4.74 4.52 5.35 367 C B 0.78 -0.67 2.09 4.55 4.68 4.50 4.64 368 C B 0.78 -0.71 2.08 4.51 4.65 4.57 4.59 369 C B 0.78 -0.70 2.11 4.46 4.63 4.58 4.50 370 H B 0.78 -0.60 2.05 4.42 4.60 4.58 4.98 371 H B 0.78 -0.41 2.16 4.36 4.58 4.58 4.54 372 C B 0.78 -0.44 2.12 4.37 4.62 4.60 4.46 373 C B 0.77 -0.22 2.18 4.32 4.61 4.60 4.50 374 C E 0.77 0.02 2.26 4.35 4.68 4.65 5.12 375 C B 0.77 -0.14 2.31 4.37 4.69 4.98 4.86 376 C B 0.77 -0.35 2.19 4.35 4.64 4.91 4.48 377 S B 0.76 -0.47 2.12 4.37 4.61 4.49 4.48 378 S B 0.76 -0.66 1.91 4.19 4.40 4.37 4.41 379 S B 0.77 -0.81 1.84 4.15 4.33 4.31 4.25 380 S B 0.78 -0.80 1.87 4.19 4.34 4.28 4.50 381 S B 0.78 -0.81 1.88 4.28 4.40 4.33 4.38 382 C B 0.79 -0.56 2.08 4.51 4.63 4.93 4.42 383 C B 0.79 -0.22 2.17 4.65 4.76 4.55 4.61 384 C E 0.79 0.10 2.27 4.73 4.84 4.60 5.10 385 H E 0.80 0.03 2.11 4.59 4.70 4.76 4.78 386 H E 0.79 -0.08 2.06 4.55 4.67 4.62 4.54 387 H E 0.80 -0.11 2.14 4.56 4.68 4.98 4.53 388 H B 0.79 -0.40 2.12 4.55 4.66 4.61 5.08 389 H B 0.79 -0.56 2.06 4.48 4.60 4.51 4.80 390 H E 0.79 -0.39 2.09 4.50 4.64 4.51 4.51 391 H E 0.79 -0.50 2.13 4.53 4.67 4.53 4.82 392 H B 0.79 -0.69 2.06 4.48 4.61 4.53 4.88 393 H B 0.79 -0.55 2.12 4.44 4.59 4.52 4.51 394 H E 0.79 -0.36 2.19 4.48 4.65 4.53 5.02 395 H E 0.80 -0.40 2.11 4.47 4.64 4.54 4.84 396 H B 0.80 -0.50 2.11 4.41 4.58 4.53 4.98 397 H E 0.80 -0.34 2.04 4.41 4.60 5.03 5.06 398 H E 0.80 -0.13 2.15 4.46 4.67 4.68 5.03 399 H B 0.80 -0.17 2.12 4.44 4.64 4.69 5.08 400 H B 0.80 -0.12 2.20 4.40 4.61 4.58 4.99 401 H E 0.79 0.32 2.29 4.46 4.71 4.62 5.05 402 C E 0.79 0.72 2.32 4.59 4.83 5.34 5.29 403 C E 0.75 0.88 2.33 4.53 4.77 5.61 5.38 404 C E 0.80 1.04 2.28 4.41 4.67 5.28 5.38 405 C E 0.73 1.11 2.35 4.46 4.71 6.18 5.24 406 C E 0.67 1.18 2.45 4.51 4.81 6.23 5.47 407 C E 0.73 1.31 2.39 4.40 4.74 5.71 5.50 408 C E 0.70 1.35 2.37 4.38 4.74 5.11 5.24 409 C E 0.70 1.17 2.34 4.37 4.69 5.33 5.14 410 C B 0.77 0.78 2.13 4.22 4.51 5.11 5.31 411 C E 0.79 0.58 2.14 4.17 4.49 5.02 5.47 412 C B 0.80 0.16 2.13 4.17 4.45 4.65 4.51 413 C E 0.80 -0.10 2.08 4.12 4.40 4.80 4.54 414 C B 0.80 -0.28 2.09 4.09 4.37 4.92 4.41 415 C B 0.80 -0.50 2.05 4.20 4.44 4.52 4.47 416 C B 0.81 -0.56 1.95 4.15 4.36 4.48 4.65 417 S B 0.79 -0.70 1.76 3.93 4.10 4.30 4.23 418 S B 0.81 -0.79 1.66 3.85 4.03 4.23 4.16 419 S B 0.81 -0.82 1.59 3.87 4.06 4.46 4.15 420 S B 0.80 -0.68 2.59 3.86 4.09 4.26 4.25 421 S B 0.80 -0.51 3.27 3.88 4.13 4.29 4.29 422 S B 0.80 -0.36 3.50 4.03 4.29 4.36 4.27 423 C E 0.80 0.09 4.42 4.28 4.58 4.63 4.73 424 C E 0.79 0.22 2.58 4.40 4.68 4.72 4.82 425 C E 0.79 0.17 2.27 4.41 4.69 4.70 5.06 426 C E 0.79 -0.17 2.53 4.39 4.63 4.67 4.95 427 S B 0.79 -0.61 2.19 3.97 4.18 4.31 4.22 428 S B 0.79 -0.85 1.73 3.95 4.13 4.27 4.12 429 S B 0.79 -1.00 1.70 3.95 4.11 4.25 4.18 430 S B 0.81 -0.98 1.57 3.86 4.05 4.20 4.14 431 S B 0.81 -0.78 1.68 3.84 4.04 4.19 4.14 432 S B 0.80 -0.66 1.65 3.80 4.06 4.22 4.16 433 S B 0.81 -0.24 1.79 3.79 4.08 4.23 4.16 434 S E 0.81 0.06 1.83 3.76 4.10 4.26 4.18 435 S B 0.81 0.01 1.83 3.77 4.14 4.32 4.22 436 C E 0.80 0.35 2.38 4.15 4.58 4.66 4.63 437 C E 0.81 0.51 2.38 4.16 4.61 4.79 4.58 438 C E 0.75 0.54 2.48 4.26 4.69 4.90 4.91 439 C E 0.79 0.22 2.53 4.19 4.63 4.73 4.67 440 S E 0.81 -0.15 2.02 3.88 4.31 4.40 4.28 441 S B 0.80 -0.60 1.75 3.75 4.11 4.39 4.20 442 S B 0.80 -0.63 1.76 3.78 4.11 4.47 4.18 443 S B 0.79 -0.85 1.77 3.82 4.10 4.20 4.11 444 S B 0.79 -0.98 1.72 3.87 4.10 4.17 4.10 445 S B 0.80 -1.08 1.70 3.96 4.16 4.14 4.16 446 S B 0.81 -1.07 1.65 3.99 4.15 4.80 4.15 447 S B 0.81 -0.88 1.77 4.14 4.28 4.97 4.25 448 C B 0.81 -0.68 2.09 4.28 4.45 4.73 4.97 449 C B 0.81 -0.59 2.15 4.36 4.56 4.58 5.17 450 C E 0.81 -0.40 2.05 4.30 4.54 5.14 4.62 451 S E 0.81 -0.35 1.72 3.88 4.16 4.27 4.14 452 S E 0.81 -0.22 1.82 3.79 4.11 4.18 4.48 453 S E 0.81 -0.34 1.95 3.83 4.19 4.28 4.49 454 S B 0.81 -0.47 1.84 3.86 4.22 4.32 4.21 455 S E 0.80 -0.02 1.99 3.95 4.34 4.52 4.32 456 H B 0.77 -0.29 2.19 4.20 4.54 4.86 4.63 457 H E 0.77 -0.07 2.24 4.24 4.59 4.97 5.01 458 H E 0.79 -0.12 2.14 4.23 4.54 5.03 5.31 459 H B 0.77 -0.36 2.20 4.33 4.59 5.04 4.61 460 C E 0.78 -0.13 2.17 4.37 4.60 5.04 4.70 461 C E 0.79 -0.07 2.17 4.39 4.57 5.15 4.53 462 C B 0.79 -0.21 2.03 4.36 4.52 5.05 4.54 463 C E 0.79 -0.05 2.04 4.43 4.58 4.99 5.06 464 H E 0.78 0.26 2.06 4.50 4.63 4.98 4.98 465 H E 0.77 0.15 2.08 4.57 4.70 5.20 5.21 466 H B 0.77 -0.13 2.18 4.54 4.67 4.93 4.97 467 C B 0.73 0.03 2.18 4.55 4.68 4.84 4.66 468 C E 0.46 0.00 2.61 4.92 5.04 5.25 5.01 469 C E 0.45 0.04 2.53 4.99 5.11 5.23 5.61 470 C E 0.71 -0.08 2.13 4.64 4.76 5.02 5.18 471 C B 0.81 -0.41 2.19 4.50 4.61 4.90 4.82 472 C B 0.81 -0.56 2.10 4.47 4.59 4.65 5.32 473 C B 0.81 -0.60 2.19 4.40 4.52 5.12 5.02 474 C B 0.81 -0.73 1.95 4.29 4.42 4.78 4.61 475 S B 0.81 -0.85 1.75 4.14 4.28 4.25 4.56 476 S B 0.81 -0.79 1.71 4.03 4.18 4.47 4.56 477 S B 0.81 -0.80 1.76 3.99 4.18 4.13 4.09 478 S B 0.80 -0.95 1.86 4.05 4.24 4.47 4.11 479 S B 0.79 -0.88 1.87 4.08 4.30 4.21 4.21 480 S B 0.79 -0.77 1.87 4.14 4.36 4.24 4.23 481 C B 0.79 -0.63 2.37 4.63 4.85 4.69 4.68 482 C B 0.78 -0.45 2.40 4.65 4.88 4.70 4.61 483 S B 0.78 -0.42 2.00 4.22 4.48 4.66 4.29 484 S B 0.78 -0.17 2.00 4.17 4.47 4.50 4.26 485 C B 0.71 0.04 2.47 4.59 4.90 4.90 4.65 486 C B 0.77 0.33 2.55 4.63 4.84 5.24 4.60 487 C E 0.71 0.99 2.70 4.68 5.16 5.52 4.68 488 C E 0.59 1.21 2.83 4.83 5.32 5.13 5.18 489 C E 0.69 0.91 3.00 5.15 5.62 5.11 5.05 490 C E 0.75 0.63 3.73 5.81 6.15 5.12 5.98 491 C B 0.78 0.22 3.92 5.77 6.43 4.85 5.81 492 H B 0.78 0.11 3.76 5.72 6.60 4.94 5.06 493 H E 0.78 0.20 3.73 5.50 6.30 4.76 5.08 494 H E 0.78 0.06 3.69 5.66 6.09 4.67 5.01 495 H B 0.78 -0.28 3.67 5.56 6.33 4.65 4.59 496 H B 0.78 -0.34 3.72 5.66 6.53 4.74 4.59 497 H E 0.78 -0.22 3.68 5.57 6.15 4.70 4.95 498 H B 0.76 -0.41 3.68 5.66 6.15 4.67 5.10 499 H B 0.77 -0.49 3.70 5.65 6.47 4.64 4.96 500 H E 0.77 -0.34 3.56 5.46 6.26 4.63 4.94 501 H E 0.77 -0.06 3.51 5.72 5.96 4.98 4.97 502 H B 0.75 -0.16 3.79 6.55 6.61 4.92 5.29 503 H B 0.77 -0.28 2.30 4.71 4.84 4.95 4.94 504 C E 0.77 -0.02 2.34 4.66 4.67 5.17 4.95 505 C E 0.77 0.12 2.22 4.53 4.72 5.02 4.92 506 C B 0.77 -0.14 2.27 4.61 4.78 4.96 4.88 507 S E 0.78 -0.29 1.90 4.26 4.40 4.58 4.74 508 S B 0.78 -0.48 1.80 4.18 4.32 4.21 4.28 509 S B 0.78 -0.64 1.77 4.22 4.35 4.21 4.27 510 S B 0.78 -0.78 1.88 4.21 4.35 4.47 4.60 511 S B 0.78 -0.67 1.94 4.25 4.40 4.34 4.79 512 S B 0.79 -0.68 2.00 4.22 4.38 4.27 4.91 513 S B 0.79 -0.48 1.92 4.24 4.43 4.30 4.91 514 S B 0.78 -0.28 1.95 4.25 4.44 4.33 4.69 515 S E 0.78 -0.08 2.02 4.27 4.47 4.35 4.74 516 C E 0.78 0.21 2.31 4.49 4.72 4.58 4.85 517 C E 0.79 0.45 2.42 4.58 4.83 5.21 5.74 518 C E 0.79 0.21 2.37 4.52 4.76 5.01 4.69 519 S B 0.79 -0.21 2.10 4.30 4.50 4.42 5.05 520 S B 0.79 -0.62 1.91 4.23 4.42 4.42 4.68 521 S B 0.79 -0.78 1.87 4.16 4.36 4.22 4.23 522 S B 0.79 -0.96 1.97 4.17 4.35 4.21 4.22 523 S B 0.79 -0.85 1.88 4.19 4.37 4.29 4.22 524 S B 0.79 -0.78 1.78 4.17 4.34 4.20 4.51 525 S B 0.78 -0.59 1.84 4.21 4.37 4.23 4.23 526 S B 0.77 -0.22 1.95 4.26 4.41 4.29 4.38 527 C E 0.74 0.33 2.33 4.75 4.89 4.75 5.53 528 C B 0.74 0.62 2.35 4.77 4.91 5.08 5.81 529 C E 0.78 0.71 2.35 4.72 4.88 4.92 5.31 530 C E 0.79 0.57 2.36 4.71 4.86 4.78 5.14 531 C E 0.79 0.18 2.26 4.62 4.79 5.10 5.27 532 C B 0.80 -0.15 2.16 4.52 4.70 4.93 4.86 533 H B 0.79 -0.55 2.17 4.47 4.67 5.04 4.97 534 H B 0.80 -0.51 2.22 4.46 4.68 4.75 4.46 535 H E 0.80 -0.25 2.19 4.50 4.73 4.57 4.47 536 H E 0.79 -0.21 2.19 4.48 4.71 4.85 4.47 537 H B 0.78 -0.38 2.20 4.45 4.72 4.60 4.49 538 H B 0.78 -0.26 2.26 4.50 4.78 4.62 4.50 539 H E 0.78 0.30 2.28 4.53 4.81 4.65 4.52 540 C E 0.76 0.41 2.43 4.65 4.96 5.03 5.34 541 C B 0.78 -0.10 2.35 4.54 4.87 5.20 5.20 542 C B 0.73 -0.32 2.39 4.56 4.89 5.27 4.63 543 S B 0.76 -0.47 2.04 4.22 4.53 4.44 4.27 544 S B 0.76 -0.21 2.03 4.20 4.51 4.60 4.28 545 C B 0.70 -0.19 2.45 4.65 4.93 4.82 4.55 546 C E 0.67 -0.03 2.50 4.66 4.94 4.75 4.86 547 C E 0.54 0.11 2.83 4.97 5.24 5.01 4.89 548 C B 0.48 0.06 2.90 5.09 5.35 5.11 4.99 549 C E 0.46 0.10 2.98 5.18 5.44 5.57 5.09 550 C E 0.44 0.30 3.05 5.26 5.51 5.21 5.24 551 H E 0.43 0.26 3.15 5.37 5.61 5.44 5.16 552 H E 0.43 -0.02 2.98 5.33 5.54 5.51 5.46 553 H B 0.42 -0.21 3.02 5.23 5.52 5.17 5.43 554 H E 0.42 0.08 3.12 5.27 5.50 5.26 5.19 555 H E 0.41 0.16 3.04 5.27 5.49 5.19 5.48 556 H B 0.40 -0.26 2.99 5.22 5.43 5.18 5.25 557 H B 0.40 -0.35 3.00 5.21 5.45 5.19 5.21 558 H E 0.40 -0.07 3.04 5.25 5.49 5.25 5.53 559 H E 0.40 -0.03 2.96 5.21 5.44 5.19 5.35 560 H B 0.40 -0.33 2.91 5.16 5.40 5.19 5.07 561 H E 0.40 -0.08 2.97 5.18 5.45 5.21 5.33 562 H E 0.40 0.04 2.95 5.20 5.47 5.46 5.29 563 H B 0.40 -0.19 2.89 5.14 5.40 5.19 5.06 564 H B 0.40 0.03 2.91 5.12 5.41 5.46 5.07 565 H E 0.41 0.62 3.09 5.15 5.46 5.46 5.14 566 H E 0.42 0.89 2.99 5.12 5.42 5.70 5.54 567 H B 0.42 0.82 3.18 5.42 5.71 5.50 5.35 568 H E 0.29 0.60 4.30 6.43 6.70 6.51 6.21 569 C E 0.29 1.13 4.69 6.65 7.25 7.06 6.75 570 C E 0.27 1.70 5.76 7.86 8.37 8.23 7.84 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).