%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% % 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 2 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: Jianyi Yang and Yang zhang, ResQ: A unified algorithm for estimating B-factor and residue-specific quality of protein structure prediction, submitted, (2014). #RES SS SA COV BFP RBF RSQ_1 RSQ_2 RSQ_3 1 C E 0.36 1.59 40.40 26.43 17.99 15.22 2 C E 0.44 1.06 35.72 25.50 15.47 13.12 3 C B 0.40 0.29 28.90 23.26 13.66 11.59 4 C B 0.42 -0.06 25.86 23.73 12.63 11.33 5 C B 0.44 -0.09 25.58 24.96 12.07 10.42 6 C B 0.44 -0.18 24.79 23.90 10.29 9.08 7 C B 0.41 -0.25 24.18 23.26 10.37 9.36 8 C B 0.39 -0.27 23.99 21.58 10.41 9.00 9 H B 0.47 -0.33 23.46 21.46 11.12 8.44 10 H B 0.47 -0.41 22.76 19.29 10.22 8.07 11 H B 0.51 -0.50 22.00 18.76 7.70 7.28 12 H B 0.53 -0.51 21.85 17.67 8.68 6.88 13 H B 0.53 -0.50 22.02 18.53 10.97 7.69 14 H B 0.56 -0.43 22.62 18.14 10.20 8.30 15 C B 0.53 -0.43 22.56 16.87 10.12 8.89 16 C B 0.52 -0.34 23.41 17.66 13.32 11.94 17 C B 0.55 -0.34 23.43 16.97 14.26 14.32 18 C B 0.55 -0.34 23.41 14.33 13.14 14.63 19 C B 0.53 -0.41 22.73 13.11 11.37 12.98 20 C B 0.57 -0.46 22.34 10.83 8.72 10.36 21 C B 0.61 -0.52 21.80 11.84 5.13 7.32 22 H B 0.61 -0.55 21.54 11.89 5.09 5.55 23 H B 0.62 -0.58 21.31 11.00 4.93 5.38 24 H B 0.59 -0.62 20.90 8.65 5.06 5.61 25 H B 0.55 -0.55 21.51 7.71 5.12 5.74 26 H B 0.61 -0.57 21.41 7.11 5.00 5.47 27 H B 0.62 -0.63 20.86 8.11 4.75 5.25 28 H B 0.66 -0.62 20.91 7.24 4.69 5.35 29 H B 0.68 -0.57 21.39 7.83 4.78 5.51 30 H B 0.67 -0.67 20.48 8.21 4.69 5.23 31 H B 0.71 -0.66 20.61 8.09 4.52 5.15 32 H B 0.71 -0.50 22.02 8.04 4.63 5.34 33 H B 0.71 -0.48 22.20 8.55 4.57 5.30 34 H B 0.68 -0.62 20.92 8.39 4.51 5.19 35 H B 0.69 -0.52 21.78 8.18 4.54 5.29 36 H E 0.73 -0.30 23.73 8.18 4.64 5.45 37 H E 0.72 -0.35 23.29 6.51 4.59 5.20 38 H B 0.66 -0.47 22.21 5.96 4.63 5.36 39 H B 0.72 -0.39 22.92 5.33 4.73 5.53 40 H B 0.72 -0.41 22.79 4.77 4.97 5.55 41 H B 0.64 -0.57 21.36 4.97 5.02 5.46 42 H B 0.68 -0.59 21.22 4.56 4.96 5.55 43 H E 0.69 -0.49 22.06 4.24 4.66 5.23 44 H B 0.74 -0.64 20.74 4.31 4.63 5.33 45 H B 0.73 -0.69 20.35 3.88 4.72 5.08 46 H B 0.72 -0.58 21.30 3.55 4.63 4.91 47 H B 0.71 -0.57 21.39 3.71 4.82 5.19 48 H B 0.68 -0.56 21.49 3.41 4.79 5.05 49 H B 0.68 -0.53 21.69 3.85 4.85 4.98 50 H B 0.68 -0.26 24.11 4.16 4.91 5.19 51 H B 0.68 -0.28 23.88 4.28 4.96 5.13 52 H B 0.71 -0.31 23.67 4.48 5.07 4.95 53 H B 0.65 -0.34 23.35 5.27 5.68 5.63 54 C B 0.73 -0.12 25.33 5.59 6.06 5.93 55 C E 0.67 0.03 26.62 6.00 7.39 8.16 56 C E 0.68 0.03 26.62 5.89 8.32 9.11 57 C B 0.66 -0.03 26.08 6.16 8.31 9.67 58 C B 0.66 -0.05 25.94 5.69 9.03 8.42 59 C B 0.64 -0.23 24.38 5.69 8.79 7.97 60 C B 0.65 -0.29 23.80 4.99 8.15 8.74 61 H B 0.69 -0.35 23.29 4.64 6.74 8.69 62 H B 0.69 -0.45 22.38 4.54 5.40 7.34 63 H B 0.71 -0.47 22.27 4.65 4.99 7.13 64 H B 0.71 -0.52 21.84 4.16 5.02 6.88 65 H B 0.70 -0.58 21.31 4.54 4.97 5.88 66 H B 0.71 -0.56 21.41 4.34 4.93 5.63 67 H E 0.72 -0.42 22.66 4.69 5.12 5.87 68 H B 0.69 -0.48 22.12 4.89 5.25 5.23 69 H B 0.69 -0.52 21.83 5.59 5.12 5.13 70 H E 0.69 -0.33 23.43 5.57 5.34 5.34 71 H E 0.68 -0.29 23.80 5.71 5.32 5.32 72 H B 0.71 -0.47 22.23 4.74 5.43 5.20 73 H E 0.65 -0.42 22.68 6.04 5.14 5.25 74 H B 0.73 -0.46 22.30 6.07 5.02 5.24 75 H B 0.72 -0.60 21.14 6.85 4.97 5.28 76 H B 0.71 -0.59 21.21 5.81 4.81 5.14 77 H B 0.72 -0.46 22.31 5.27 4.91 5.26 78 H E 0.72 -0.43 22.60 5.00 4.81 5.25 79 H B 0.71 -0.48 22.14 3.84 4.72 5.18 80 H B 0.68 -0.48 22.12 3.93 4.78 5.29 81 H E 0.68 -0.34 23.39 3.80 4.74 5.28 82 H E 0.67 -0.38 23.03 3.57 4.65 5.32 83 H B 0.69 -0.44 22.55 3.54 4.74 5.17 84 H E 0.68 -0.30 23.78 3.73 4.58 5.25 85 H E 0.69 -0.34 23.38 3.74 4.69 5.38 86 H B 0.69 -0.53 21.68 3.53 4.53 5.21 87 H B 0.72 -0.59 21.16 3.68 4.52 5.21 88 H E 0.73 -0.46 22.30 3.41 4.51 5.32 89 H B 0.75 -0.55 21.52 3.14 4.50 5.30 90 H B 0.72 -0.60 21.14 3.23 4.55 5.27 91 H E 0.75 -0.46 22.30 3.37 4.49 5.37 92 H B 0.75 -0.53 21.75 3.04 4.55 5.45 93 H B 0.76 -0.65 20.71 2.86 4.45 5.35 94 H B 0.76 -0.64 20.72 3.03 4.42 5.45 95 H B 0.76 -0.69 20.29 3.01 4.55 5.49 96 H B 0.78 -0.73 19.94 2.64 4.45 5.50 97 H B 0.78 -0.69 20.33 2.71 4.41 5.36 98 H B 0.77 -0.64 20.79 2.84 4.55 5.53 99 H B 0.78 -0.60 21.12 2.60 4.63 5.61 100 H B 0.75 -0.62 20.92 2.56 4.54 5.63 101 H B 0.68 -0.56 21.46 2.53 4.67 5.52 102 H B 0.68 -0.54 21.60 2.53 4.83 5.65 103 H B 0.70 -0.49 22.09 2.15 4.66 5.71 104 C B 0.65 -0.39 22.93 2.23 4.88 5.66 105 C B 0.61 -0.32 23.56 2.49 5.58 5.56 106 C E 0.57 -0.15 25.03 2.50 6.45 6.19 107 C B 0.57 -0.16 24.96 2.58 6.67 6.66 108 H E 0.72 -0.22 24.42 2.53 6.02 5.82 109 H B 0.70 -0.34 23.41 2.56 5.58 5.63 110 H B 0.72 -0.47 22.26 2.45 5.13 5.38 111 H E 0.72 -0.41 22.79 2.28 5.03 5.33 112 H B 0.70 -0.42 22.67 2.18 5.47 5.51 113 H B 0.77 -0.38 23.05 2.29 5.07 5.20 114 H E 0.71 -0.26 24.11 2.23 4.90 5.36 115 H E 0.70 -0.26 24.10 2.16 5.39 5.47 116 H B 0.70 -0.38 23.03 2.12 5.46 5.49 117 H B 0.71 -0.56 21.46 2.28 5.14 5.36 118 H B 0.72 -0.64 20.74 2.36 5.66 5.49 119 H B 0.72 -0.63 20.87 2.39 5.97 5.73 120 H B 0.74 -0.71 20.16 2.56 5.66 5.58 121 H B 0.73 -0.65 20.63 2.52 5.88 5.60 122 H B 0.72 -0.59 21.22 2.61 6.00 6.15 123 H B 0.75 -0.49 22.06 2.90 6.22 6.77 124 C B 0.61 -0.36 23.20 3.43 7.08 9.82 125 C B 0.67 -0.30 23.78 3.31 6.19 11.92 126 C B 0.74 -0.22 24.44 2.99 8.02 13.04 127 C B 0.74 -0.14 25.18 2.74 8.84 12.39 128 C B 0.71 -0.14 25.17 4.84 8.59 12.81 129 C B 0.74 -0.08 25.66 5.89 7.35 10.75 130 C B 0.79 -0.12 25.32 4.20 7.17 9.79 131 C B 0.76 -0.18 24.80 4.21 9.05 10.77 132 H B 0.82 -0.28 23.92 4.53 7.85 9.50 133 H B 0.80 -0.35 23.28 4.70 6.56 7.68 134 H B 0.77 -0.33 23.52 5.40 7.33 7.79 135 H E 0.76 -0.20 24.66 5.00 7.76 9.08 136 H B 0.78 -0.24 24.28 4.40 6.72 8.27 137 H B 0.78 -0.18 24.81 3.92 6.22 7.54 138 H E 0.80 -0.12 25.32 3.91 5.40 7.19 139 H E 0.83 -0.16 24.98 3.21 5.37 6.70 140 H B 0.79 -0.26 24.06 2.77 5.27 5.93 141 H E 0.82 -0.22 24.41 2.26 5.11 5.55 142 H E 0.80 -0.19 24.74 2.34 5.06 5.53 143 H B 0.80 -0.32 23.59 2.41 5.05 5.12 144 H E 0.80 -0.28 23.96 2.29 4.79 5.09 145 H B 0.83 -0.28 23.88 2.18 4.56 5.08 146 H E 0.84 -0.30 23.74 2.29 4.75 5.09 147 H B 0.86 -0.40 22.84 2.17 4.60 4.80 148 H B 0.88 -0.46 22.37 2.06 4.70 4.72 149 H B 0.90 -0.47 22.23 2.05 4.64 4.80 150 H B 0.90 -0.59 21.20 2.03 4.71 4.85 151 H B 0.90 -0.55 21.53 2.02 4.62 4.65 152 H B 0.93 -0.44 22.55 2.02 5.01 4.69 153 C B 0.93 -0.38 23.05 2.08 7.45 4.82 154 C B 0.93 -0.36 23.26 2.27 6.53 4.77 155 C B 0.94 -0.20 24.61 2.29 7.83 5.21 156 C E 0.94 -0.12 25.29 2.35 8.47 5.14 157 C B 0.95 -0.14 25.12 2.15 9.52 4.99 158 C B 0.95 -0.23 24.34 2.16 9.45 5.17 159 C E 0.96 -0.19 24.71 2.24 8.56 5.05 160 C B 0.97 -0.21 24.57 2.40 7.22 5.32 161 C B 0.97 -0.30 23.78 2.56 4.26 5.54 162 C B 0.96 -0.21 24.51 2.90 4.60 5.71 163 C E 0.95 -0.17 24.86 3.16 4.83 6.13 164 C E 0.95 -0.17 24.89 2.81 4.77 5.66 165 C B 0.93 -0.27 24.02 3.02 4.59 5.50 166 C B 0.93 -0.27 24.00 2.72 4.46 5.17 167 C B 0.93 -0.23 24.32 3.09 4.31 5.16 168 C B 0.93 -0.22 24.45 3.14 4.45 5.19 169 C B 0.95 -0.14 25.15 2.79 4.81 5.34 170 C E 0.94 -0.08 25.67 2.82 5.17 5.41 171 C B 0.94 -0.05 25.94 2.49 5.17 5.81 172 C E 0.97 -0.00 26.36 2.55 5.09 5.83 173 C E 0.94 0.00 26.42 2.55 4.83 5.70 174 C E 0.94 0.00 26.39 2.30 4.61 7.53 175 C E 0.93 -0.00 26.34 2.11 4.60 9.06 176 C E 0.86 -0.08 25.71 2.66 5.17 9.59 177 C E 0.87 -0.08 25.65 2.66 4.97 8.99 178 C E 0.85 -0.12 25.29 2.89 4.87 8.42 179 C B 0.88 -0.19 24.69 2.86 5.06 7.61 180 C B 0.88 -0.23 24.37 2.71 5.07 6.75 181 C E 0.88 -0.21 24.49 2.53 4.87 6.26 182 C E 0.88 -0.25 24.22 2.67 5.04 6.10 183 C B 0.88 -0.29 23.83 4.56 5.00 5.71 184 C B 0.88 -0.31 23.62 4.54 4.99 5.50 185 C B 0.86 -0.27 24.04 6.43 5.02 5.32 186 C B 0.86 -0.23 24.37 7.30 5.14 5.21 187 C B 0.87 -0.26 24.06 7.48 4.97 5.24 188 C B 0.87 -0.32 23.58 7.80 4.79 5.05 189 C B 0.85 -0.27 24.00 7.75 4.92 5.31 190 C B 0.87 -0.28 23.93 6.59 4.96 5.62 191 C E 0.87 -0.22 24.46 8.45 5.02 5.46 192 C E 0.86 -0.14 25.18 7.61 5.14 5.65 193 C E 0.84 -0.14 25.12 7.72 5.10 5.77 194 C E 0.85 -0.09 25.55 6.90 5.23 5.89 195 C B 0.86 -0.23 24.36 7.31 5.36 5.94 196 C B 0.87 -0.32 23.57 6.58 5.42 6.03 197 C B 0.86 -0.40 22.83 6.09 5.78 5.89 198 C B 0.87 -0.45 22.46 6.81 5.54 5.50 199 C B 0.86 -0.42 22.66 6.27 5.84 5.49 200 C B 0.84 -0.34 23.40 5.71 5.74 5.32 201 C B 0.82 -0.29 23.87 5.84 5.46 5.37 202 C B 0.82 -0.29 23.87 6.80 5.43 5.38 203 C B 0.83 -0.26 24.13 6.34 5.36 5.53 204 C B 0.83 -0.22 24.45 5.56 5.28 5.54 205 C B 0.83 -0.20 24.58 5.52 5.16 5.73 206 C B 0.82 -0.17 24.90 4.67 5.23 5.72 207 C B 0.83 -0.20 24.62 4.59 4.99 6.19 208 C B 0.85 -0.24 24.25 4.44 5.18 6.12 209 C B 0.83 -0.22 24.46 3.96 5.32 6.64 210 C B 0.83 -0.21 24.57 3.26 5.35 6.55 211 C B 0.82 -0.22 24.41 3.11 5.19 6.21 212 C B 0.82 -0.20 24.63 3.95 5.07 6.27 213 C E 0.82 -0.15 25.04 5.88 5.31 6.33 214 C B 0.80 -0.18 24.83 5.58 5.36 6.14 215 C B 0.83 -0.17 24.85 4.37 5.29 5.90 216 C E 0.83 -0.15 25.05 4.04 5.20 5.80 217 C B 0.83 -0.21 24.52 3.58 5.03 5.54 218 C B 0.83 -0.21 24.52 2.83 5.02 5.68 219 C B 0.82 -0.29 23.87 2.86 4.96 5.61 220 C B 0.82 -0.36 23.20 3.45 4.89 5.73 221 C B 0.82 -0.41 22.81 3.47 4.98 5.78 222 C B 0.83 -0.36 23.21 3.12 5.02 5.57 223 C B 0.83 -0.35 23.34 3.43 4.86 5.84 224 C B 0.80 -0.30 23.73 3.90 4.86 5.83 225 C B 0.82 -0.26 24.05 3.82 5.06 5.91 226 C B 0.83 -0.23 24.35 3.65 5.07 5.85 227 C B 0.83 -0.32 23.60 4.27 5.01 5.71 228 C B 0.82 -0.31 23.68 4.71 4.91 5.79 229 C B 0.85 -0.33 23.45 5.18 4.90 5.75 230 C B 0.85 -0.31 23.64 4.87 4.94 5.62 231 C B 0.83 -0.22 24.46 5.76 4.89 5.76 232 C B 0.85 -0.20 24.60 4.99 4.83 5.96 233 C B 0.85 -0.19 24.69 4.57 4.85 5.73 234 C B 0.86 -0.22 24.47 5.14 4.82 5.76 235 C B 0.86 -0.25 24.20 4.97 4.85 7.06 236 C B 0.86 -0.30 23.74 5.19 4.85 7.19 237 C B 0.85 -0.30 23.70 4.17 5.02 7.58 238 C B 0.85 -0.32 23.59 4.50 5.17 8.65 239 C B 0.84 -0.40 22.89 3.13 5.21 8.33 240 C B 0.83 -0.30 23.76 2.85 5.27 8.18 241 C B 0.86 -0.23 24.32 2.92 5.23 8.46 242 C B 0.85 -0.22 24.45 2.47 5.29 8.77 243 C B 0.86 -0.22 24.41 2.60 5.20 8.88 244 C B 0.87 -0.29 23.86 2.88 5.16 9.30 245 C B 0.86 -0.31 23.67 3.15 5.10 9.20 246 C B 0.86 -0.28 23.90 3.12 4.94 9.54 247 C B 0.86 -0.30 23.76 2.80 4.65 8.82 248 C B 0.85 -0.24 24.23 2.60 4.68 8.23 249 C E 0.84 -0.19 24.75 2.33 4.63 7.25 250 C B 0.85 -0.19 24.71 2.39 4.53 4.74 251 C E 0.82 -0.12 25.33 2.30 4.79 4.77 252 C E 0.81 -0.07 25.74 2.19 4.98 5.02 253 C E 0.82 -0.07 25.80 2.26 5.21 4.99 254 C B 0.82 -0.06 25.86 2.23 5.30 5.01 255 C E 0.82 -0.05 25.95 2.25 5.46 5.21 256 C E 0.83 -0.05 25.96 2.25 5.79 5.11 257 C E 0.83 -0.09 25.59 2.08 6.04 5.18 258 C E 0.86 -0.15 25.08 2.02 6.02 5.21 259 C B 0.85 -0.21 24.51 2.60 6.02 5.26 260 C B 0.86 -0.24 24.27 2.61 6.00 5.34 261 C B 0.87 -0.24 24.28 2.18 5.89 5.32 262 C B 0.84 -0.21 24.52 2.22 5.89 5.48 263 C B 0.83 -0.16 24.93 2.31 6.85 5.55 264 C E 0.83 -0.08 25.68 2.55 7.38 5.34 265 C B 0.84 -0.02 26.22 2.65 7.54 5.59 266 C E 0.84 0.01 26.46 2.52 6.53 5.33 267 C E 0.85 0.08 27.08 2.77 6.72 5.39 268 C E 0.84 0.03 26.63 2.83 6.23 5.11 269 C E 0.84 -0.06 25.87 2.81 6.33 5.04 270 C E 0.84 -0.14 25.19 2.49 5.33 4.90 271 C B 0.84 -0.21 24.57 2.75 5.41 4.99 272 C B 0.85 -0.25 24.21 2.83 5.36 4.90 273 C B 0.85 -0.21 24.52 3.09 5.60 5.12 274 C B 0.85 -0.21 24.57 2.66 6.47 5.05 275 C B 0.84 -0.18 24.82 2.59 7.27 5.39 276 C B 0.84 -0.17 24.90 2.76 6.10 5.44 277 C B 0.84 -0.16 24.96 3.09 5.93 5.43 278 C B 0.84 -0.18 24.77 3.33 6.41 5.44 279 C B 0.84 -0.20 24.58 2.94 6.15 5.33 280 C B 0.84 -0.19 24.71 3.01 6.06 5.21 281 C B 0.86 -0.22 24.43 2.86 5.58 5.12 282 C E 0.84 -0.20 24.65 2.61 5.56 5.11 283 C B 0.84 -0.21 24.53 2.61 5.30 5.03 284 C B 0.85 -0.21 24.57 2.48 5.30 4.99 285 C E 0.84 -0.21 24.55 2.69 4.98 4.94 286 C E 0.85 -0.22 24.47 2.68 4.84 4.82 287 C B 0.85 -0.28 23.88 2.77 4.86 4.82 288 C B 0.84 -0.27 24.02 2.48 5.20 4.90 289 C E 0.86 -0.24 24.27 2.43 5.39 5.08 290 C B 0.87 -0.25 24.19 3.61 5.47 5.34 291 C E 0.86 -0.22 24.41 2.59 5.55 5.60 292 C B 0.83 -0.25 24.15 2.09 5.46 5.43 293 C B 0.83 -0.28 23.92 1.62 5.23 5.28 294 C B 0.83 -0.32 23.53 1.59 4.94 4.99 295 C B 0.84 -0.28 23.96 1.54 5.02 4.98 296 C E 0.85 -0.21 24.57 1.48 4.72 4.97 297 C B 0.86 -0.25 24.22 1.31 4.66 4.83 298 C B 0.85 -0.26 24.09 1.45 4.66 4.78 299 C B 0.85 -0.30 23.72 1.46 4.70 4.87 300 C B 0.85 -0.31 23.69 1.46 5.04 5.04 301 C B 0.86 -0.20 24.58 1.45 5.17 5.18 302 C B 0.85 -0.17 24.84 1.41 5.22 5.15 303 C B 0.85 -0.12 25.33 1.51 5.45 5.24 304 C B 0.85 -0.14 25.12 1.43 5.55 5.25 305 C E 0.84 -0.17 24.89 1.51 5.56 5.04 306 C E 0.84 -0.16 24.93 1.42 5.07 5.05 307 C B 0.84 -0.22 24.44 1.31 4.86 4.93 308 C B 0.84 -0.26 24.08 1.32 4.80 4.96 309 C B 0.84 -0.25 24.16 1.27 4.91 5.18 310 C B 0.83 -0.29 23.80 1.38 5.12 5.13 311 C B 0.85 -0.29 23.87 1.40 5.30 5.56 312 C B 0.85 -0.30 23.72 1.34 5.38 5.40 313 C B 0.85 -0.36 23.22 1.53 5.62 5.68 314 C B 0.85 -0.31 23.64 1.47 5.76 5.44 315 C B 0.85 -0.31 23.70 1.47 5.53 5.29 316 C B 0.85 -0.33 23.50 1.59 5.55 5.33 317 C B 0.84 -0.28 23.91 1.65 5.29 5.05 318 C B 0.85 -0.23 24.37 2.06 5.08 5.07 319 C B 0.85 -0.21 24.55 2.08 4.93 4.91 320 C B 0.84 -0.16 24.93 1.80 5.19 5.02 321 C B 0.85 -0.21 24.54 2.00 5.17 5.00 322 C B 0.83 -0.19 24.70 1.75 5.45 5.03 323 C B 0.83 -0.17 24.89 2.02 5.20 5.20 324 C B 0.83 -0.17 24.92 1.81 5.55 5.20 325 C E 0.86 -0.11 25.43 1.61 5.36 4.95 326 C E 0.86 -0.17 24.86 1.51 5.39 5.03 327 C B 0.84 -0.27 24.01 1.70 5.12 5.04 328 C B 0.85 -0.28 23.91 1.53 4.78 4.98 329 C B 0.85 -0.32 23.53 1.53 4.85 5.02 330 C E 0.85 -0.26 24.11 1.74 4.96 5.01 331 C B 0.85 -0.30 23.73 1.66 5.18 5.09 332 C B 0.86 -0.28 23.89 1.48 5.06 5.27 333 C E 0.83 -0.11 25.38 1.61 5.18 5.20 334 C E 0.85 -0.13 25.22 1.67 5.28 5.19 335 C E 0.84 -0.12 25.30 1.62 5.12 4.99 336 C E 0.85 -0.14 25.14 1.64 4.97 5.00 337 C E 0.87 -0.27 24.00 1.69 4.93 4.87 338 C B 0.87 -0.35 23.28 1.77 4.95 4.85 339 C B 0.87 -0.41 22.79 1.72 5.05 4.96 340 C E 0.87 -0.24 24.25 1.75 5.41 5.01 341 C E 0.85 -0.15 25.05 2.07 5.56 5.14 342 C E 0.82 -0.18 24.79 2.00 5.78 5.28 343 C E 0.83 -0.10 25.47 2.20 5.67 5.27 344 C B 0.86 -0.07 25.80 2.18 5.83 5.35 345 C E 0.84 0.06 26.90 2.42 6.01 5.56 346 C E 0.82 0.18 27.93 2.71 6.08 5.48 347 C E 0.82 0.03 26.61 4.51 5.90 5.56 348 C E 0.82 -0.18 24.76 4.93 5.73 5.41 349 S B 0.75 -0.46 22.32 6.23 5.50 5.57 350 S B 0.79 -0.63 20.86 6.58 5.34 5.52 351 S B 0.77 -0.70 20.26 7.32 5.23 5.41 352 S B 0.78 -0.68 20.42 6.77 5.26 5.52 353 S B 0.79 -0.71 20.13 6.86 5.22 5.60 354 S B 0.84 -0.59 21.23 5.43 5.24 5.57 355 C B 0.83 -0.48 22.19 3.83 5.47 5.58 356 C B 0.82 -0.43 22.59 3.06 5.58 5.78 357 C B 0.82 -0.48 22.18 2.93 9.08 5.53 358 C B 0.83 -0.51 21.88 2.91 10.70 5.40 359 H B 0.82 -0.55 21.54 3.00 10.97 5.08 360 H B 0.79 -0.62 20.95 2.85 11.58 5.05 361 H B 0.72 -0.59 21.17 2.73 12.77 5.10 362 H B 0.76 -0.48 22.14 2.81 12.34 4.94 363 H E 0.75 -0.39 22.93 2.66 12.65 5.07 364 H B 0.74 -0.42 22.69 2.60 13.83 4.90 365 H B 0.73 -0.39 22.96 2.51 14.45 5.05 366 H E 0.72 -0.27 24.02 2.58 15.12 5.09 367 H E 0.72 -0.23 24.33 2.48 15.65 5.07 368 H B 0.72 -0.30 23.71 2.35 16.57 5.17 369 H B 0.72 -0.23 24.39 2.29 16.41 5.14 370 H E 0.73 0.05 26.86 2.40 14.72 5.32 371 C E 0.75 0.15 27.70 2.38 13.04 5.23 372 C E 0.71 0.16 27.78 2.37 11.91 5.12 373 C E 0.73 0.24 28.49 2.26 9.96 6.44 374 C E 0.81 0.19 28.09 2.31 8.04 6.20 375 C E 0.78 0.16 27.77 2.51 7.01 6.19 376 C E 0.81 0.20 28.16 2.80 6.73 5.99 377 C B 0.82 0.08 27.11 2.79 6.50 5.80 378 C E 0.82 0.10 27.23 2.44 6.46 5.58 379 C E 0.82 0.07 27.00 2.42 6.17 5.61 380 C E 0.82 0.01 26.49 2.66 6.20 5.58 381 C B 0.74 -0.11 25.39 2.77 6.08 5.37 382 C B 0.75 -0.19 24.73 2.28 5.68 5.38 383 C B 0.72 -0.29 23.81 2.44 5.69 5.17 384 S B 0.68 -0.36 23.20 2.33 5.53 5.24 385 S B 0.76 -0.48 22.17 2.05 5.14 5.17 386 S B 0.75 -0.46 22.33 2.76 5.09 5.15 387 C B 0.76 -0.38 23.04 2.27 5.19 5.06 388 C B 0.76 -0.31 23.63 2.49 5.15 5.15 389 C B 0.76 -0.21 24.54 2.33 4.94 5.04 390 C B 0.75 -0.09 25.60 2.30 5.08 5.01 391 C B 0.76 -0.04 26.06 2.30 5.03 5.27 392 C B 0.75 -0.08 25.66 2.27 5.18 5.26 393 C B 0.67 -0.12 25.30 2.29 5.03 5.20 394 C B 0.75 -0.15 25.02 2.07 5.12 4.93 395 C B 0.73 -0.24 24.28 2.56 5.41 5.05 396 C B 0.74 -0.32 23.60 2.00 5.44 4.93 397 C B 0.76 -0.33 23.49 2.14 5.84 5.03 398 C B 0.75 -0.29 23.82 2.30 5.86 4.99 399 C B 0.75 -0.21 24.53 2.44 5.60 5.14 400 C B 0.68 -0.11 25.38 2.86 5.94 5.30 401 C E 0.68 -0.03 26.16 2.86 5.74 5.48 402 C B 0.68 -0.12 25.35 2.53 5.93 5.45 403 C B 0.68 -0.17 24.89 2.55 5.39 5.27 404 C B 0.68 -0.19 24.74 2.87 5.51 5.15 405 C B 0.71 -0.26 24.13 2.84 5.22 5.11 406 C B 0.69 -0.30 23.71 2.80 5.36 5.19 407 C B 0.71 -0.31 23.65 4.42 5.48 5.30 408 C B 0.72 -0.28 23.89 7.22 5.13 5.13 409 C B 0.74 -0.17 24.90 7.82 5.26 5.22 410 C B 0.76 -0.12 25.31 6.42 5.26 5.38 411 C E 0.77 0.01 26.43 4.01 5.35 5.30 412 C B 0.78 -0.01 26.28 2.54 5.47 5.15 413 C E 0.78 0.09 27.14 2.61 5.56 5.19 414 C B 0.78 0.02 26.58 2.57 5.43 5.15 415 C B 0.78 0.02 26.55 2.21 5.53 5.18 416 C E 0.78 0.07 27.00 2.43 5.60 5.20 417 C B 0.78 0.09 27.17 2.13 5.90 5.26 418 C E 0.77 0.34 29.38 2.15 6.34 5.49 419 C E 0.78 0.25 28.57 1.94 8.16 5.70 420 C E 0.71 0.12 27.45 1.96 7.90 5.65 421 C B 0.63 -0.16 25.00 2.01 7.92 5.24 422 S E 0.66 -0.18 24.77 1.64 6.11 5.24 423 S B 0.66 -0.41 22.74 1.60 5.66 5.15 424 S B 0.67 -0.48 22.17 1.65 5.23 4.97 425 S B 0.67 -0.55 21.56 1.68 5.23 5.07 426 S B 0.68 -0.57 21.41 2.02 4.98 4.78 427 S B 0.68 -0.55 21.57 1.87 5.21 5.11 428 S B 0.68 -0.43 22.64 1.78 5.44 5.24 429 C B 0.63 -0.32 23.55 2.08 5.65 5.19 430 C B 0.60 -0.20 24.62 2.17 5.56 5.46 431 C B 0.62 -0.18 24.83 2.06 5.40 5.21 432 C B 0.63 -0.23 24.37 2.69 4.96 5.12 433 C B 0.59 -0.26 24.13 2.63 5.05 5.02 434 C B 0.57 -0.19 24.69 2.94 5.53 5.43 435 C B 0.62 -0.08 25.67 3.13 5.69 5.28 436 C B 0.56 -0.11 25.39 3.56 5.91 5.76 437 C B 0.57 -0.02 26.23 2.30 6.21 5.75 438 C E 0.58 0.06 26.87 2.33 6.68 5.99 439 C B 0.57 -0.11 25.44 2.24 6.67 5.91 440 C B 0.57 -0.25 24.17 2.08 6.57 5.75 441 C B 0.58 -0.37 23.15 2.02 6.07 5.38 442 C B 0.62 -0.47 22.27 1.79 6.75 5.12 443 H B 0.60 -0.55 21.58 1.85 9.11 5.18 444 H B 0.61 -0.60 21.12 1.96 10.82 5.18 445 H B 0.60 -0.59 21.19 1.75 10.20 5.04 446 H B 0.63 -0.53 21.75 1.63 10.22 4.97 447 H B 0.67 -0.56 21.50 1.51 9.93 7.25 448 H B 0.67 -0.56 21.44 1.66 10.32 9.78 449 H B 0.69 -0.56 21.43 1.66 9.27 11.34 450 H B 0.72 -0.58 21.27 1.66 8.73 12.40 451 H B 0.71 -0.58 21.27 1.73 8.81 12.69 452 H B 0.70 -0.61 20.97 1.54 8.94 12.44 453 H B 0.70 -0.60 21.13 1.74 9.05 12.46 454 H B 0.72 -0.56 21.47 1.49 8.11 13.65 455 H B 0.70 -0.47 22.23 1.78 6.35 13.18 456 H B 0.69 -0.39 22.96 1.83 4.82 11.65 457 C B 0.66 -0.25 24.22 1.97 5.20 11.06 458 C B 0.68 -0.01 26.33 2.27 5.46 10.99 459 C E 0.68 0.12 27.46 2.22 5.92 9.10 460 C B 0.65 0.02 26.55 2.04 5.90 5.73 461 C B 0.66 0.12 27.40 2.37 5.37 5.57 462 C B 0.68 0.09 27.13 2.36 5.52 5.81 463 C B 0.68 0.13 27.51 2.13 5.37 5.83 464 C E 0.66 0.22 28.31 2.32 5.52 5.67 465 H B 0.62 0.16 27.83 2.70 5.64 5.48 466 H E 0.62 0.35 29.47 2.67 5.63 5.51 467 H E 0.65 0.23 28.42 2.93 5.84 5.42 468 C B 0.65 0.13 27.54 2.97 5.96 5.33 469 C E 0.66 0.19 28.02 3.68 5.93 5.42 470 C E 0.68 0.14 27.61 3.47 6.00 5.45 471 C B 0.64 -0.05 25.91 3.50 5.81 5.36 472 C E 0.63 -0.01 26.26 2.69 5.57 5.33 473 C E 0.64 -0.02 26.22 2.57 5.36 5.40 474 C B 0.65 -0.02 26.17 2.61 5.49 5.44 475 C E 0.68 0.23 28.43 2.28 5.24 5.47 476 C E 0.68 0.43 30.19 3.27 5.18 5.55 477 C E 0.70 0.49 30.69 2.29 5.12 5.52 478 C E 0.68 0.62 31.87 1.96 5.46 5.72 479 C E 0.69 0.49 30.73 1.81 5.48 5.65 480 C B 0.71 0.20 28.14 1.86 5.28 5.64 481 C E 0.72 0.01 26.46 1.63 5.25 5.45 482 S B 0.72 -0.35 23.34 1.79 5.25 5.28 483 S B 0.69 -0.50 21.96 1.46 4.95 5.11 484 S B 0.68 -0.63 20.88 1.49 5.09 5.26 485 S B 0.65 -0.64 20.76 1.43 5.05 5.11 486 S B 0.64 -0.55 21.54 1.65 5.19 5.23 487 S B 0.64 -0.46 22.37 1.75 5.33 5.46 488 C B 0.57 -0.15 25.04 2.12 5.71 5.60 489 C B 0.57 0.15 27.73 2.39 6.29 6.02 490 C E 0.55 0.48 30.60 2.55 6.31 5.95 491 C E 0.50 0.27 28.79 2.48 6.58 6.19 492 C B 0.48 -0.02 26.20 2.33 8.00 6.13 493 C B 0.53 -0.24 24.24 2.68 7.45 5.75 494 H B 0.48 -0.41 22.78 2.69 7.95 5.39 495 H B 0.52 -0.43 22.64 2.25 7.33 5.68 496 H B 0.50 -0.34 23.35 2.35 6.41 5.52 497 H B 0.48 -0.38 23.05 2.22 6.04 5.56 498 H B 0.49 -0.36 23.24 2.15 5.86 5.69 499 H B 0.49 -0.20 24.58 1.97 5.78 5.57 500 H E 0.48 -0.19 24.67 1.90 5.64 5.50 501 H B 0.49 -0.29 23.80 1.98 5.73 5.65 502 C B 0.53 -0.20 24.60 1.98 5.90 5.73 503 C B 0.55 -0.23 24.32 2.20 6.03 5.72 504 C B 0.57 -0.17 24.89 2.17 6.43 5.81 505 C B 0.57 -0.01 26.32 3.99 6.57 6.07 506 H E 0.57 0.07 27.02 5.38 6.61 5.81 507 H B 0.53 -0.14 25.15 6.57 6.71 6.02 508 H B 0.61 -0.32 23.60 4.59 6.88 5.85 509 H B 0.62 -0.31 23.68 4.53 7.10 5.97 510 H E 0.62 -0.16 24.93 3.58 8.06 6.09 511 H B 0.63 -0.25 24.20 5.23 8.25 6.18 512 H B 0.62 -0.24 24.29 6.46 9.50 5.74 513 C E 0.60 0.04 26.71 7.47 10.11 5.69 514 C E 0.57 0.11 27.36 8.58 9.05 5.54 515 C E 0.56 0.10 27.23 9.04 7.19 8.72 516 C B 0.55 -0.16 24.95 5.78 6.66 10.37 517 S E 0.50 -0.25 24.18 5.41 5.20 12.13 518 S B 0.49 -0.39 22.97 4.63 5.08 12.25 519 S B 0.50 -0.50 21.97 4.38 6.33 10.68 520 S B 0.53 -0.45 22.43 4.86 6.36 11.43 521 C B 0.51 -0.35 23.30 5.38 6.31 12.98 522 C B 0.48 -0.30 23.78 5.13 6.84 13.04 523 C B 0.51 -0.22 24.41 5.23 6.64 13.90 524 C B 0.49 -0.11 25.42 4.17 6.54 14.50 525 C B 0.49 0.05 26.86 3.91 6.46 15.80 526 C B 0.46 0.13 27.56 4.01 5.24 17.95 527 C E 0.47 0.31 29.11 2.65 5.32 19.36 528 C B 0.47 0.24 28.47 3.65 5.08 20.63 529 C E 0.47 0.28 28.80 4.52 5.18 22.21 530 C B 0.47 0.27 28.78 4.19 5.28 22.12 531 C E 0.47 0.38 29.75 3.18 5.22 21.18 532 C E 0.47 0.20 28.11 3.37 5.14 19.82 533 C B 0.48 0.02 26.57 3.07 5.15 18.84 534 C B 0.49 -0.08 25.72 2.31 5.23 16.95 535 C B 0.48 -0.14 25.16 2.36 5.38 15.27 536 C B 0.50 -0.15 25.07 3.12 5.33 13.47 537 C B 0.51 -0.08 25.72 4.30 5.60 12.20 538 C B 0.52 -0.05 25.92 6.84 5.82 11.46 539 C B 0.51 -0.01 26.27 8.58 5.89 10.33 540 C E 0.51 0.10 27.25 8.03 5.94 9.42 541 C E 0.51 0.11 27.33 6.84 6.01 8.36 542 C B 0.50 0.09 27.21 6.66 7.06 6.91 543 C E 0.53 0.08 27.11 5.73 7.21 6.57 544 H B 0.50 -0.10 25.48 5.90 6.59 6.48 545 H B 0.50 -0.03 26.15 5.86 6.61 6.10 546 H E 0.50 0.06 26.93 5.73 6.24 6.19 547 H B 0.50 -0.05 25.91 5.81 6.34 6.31 548 H B 0.51 -0.06 25.84 4.98 5.99 6.08 549 H E 0.50 0.04 26.76 4.74 5.99 6.11 550 H E 0.51 0.02 26.51 5.28 5.92 6.22 551 H B 0.51 -0.24 24.28 4.70 5.98 6.27 552 H B 0.51 -0.24 24.30 4.18 5.98 6.05 553 H E 0.51 -0.04 25.99 4.50 5.93 5.98 554 H B 0.47 -0.08 25.65 4.41 5.99 6.35 555 H B 0.47 -0.15 25.09 3.58 5.93 6.29 556 H B 0.47 -0.05 25.90 3.67 6.03 6.12 557 H E 0.47 0.12 27.39 3.54 6.07 6.44 558 C B 0.47 0.14 27.58 3.16 5.97 6.62 559 H B 0.45 -0.02 26.25 4.75 6.01 6.42 560 H E 0.44 0.15 27.66 4.75 6.16 6.46 561 H B 0.43 0.10 27.29 3.37 6.23 6.93 562 H B 0.43 -0.01 26.28 3.80 5.94 6.90 563 H B 0.45 0.02 26.58 4.42 6.24 6.64 564 H E 0.44 0.28 28.83 3.83 6.24 6.96 565 H E 0.45 0.26 28.63 3.28 6.12 7.29 566 H B 0.46 0.18 27.95 4.26 6.06 7.36 567 C B 0.45 0.34 29.38 4.36 6.45 9.18 568 C E 0.43 0.51 30.82 4.33 5.66 10.92 569 C B 0.42 0.53 31.01 4.46 5.60 13.38 570 C E 0.42 0.69 32.45 4.41 5.71 15.14 571 C E 0.38 0.70 32.50 3.59 5.83 16.57 572 C E 0.36 0.73 32.78 3.56 5.80 15.53 573 C E 0.34 0.72 32.70 3.06 5.94 17.09 574 C B 0.33 0.61 31.71 3.38 6.18 18.00 575 C E 0.34 0.67 32.25 3.40 6.12 17.18 576 C E 0.34 0.56 31.29 3.61 6.16 16.63 577 C B 0.33 0.71 32.63 3.65 6.26 18.42 578 C E 0.33 1.06 35.68 4.22 6.39 19.71 579 C E 0.31 1.46 39.22 4.44 6.40 19.68 580 C E 0.33 2.07 44.62 4.97 6.56 20.84 RES: Residue number SS: Predicted secondary structure: C - random coil; H - alpha-helix; S - beta-strand SA: Predicted solevent 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 RBF: Predicted raw 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 predictions: Jianyi Yang and Yang zhang, ResQ: A unified algorithm for estimating B-factor and residue-specific quality of protein structure prediction, submitted, (2014).