#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x3u s SER 127 N 0.00 4.89 0.21 1.61 0.01 -1.26 -4.92 113.70 114.24 1x3u s SER 127 Ca 0.00 -0.26 0.00 0.00 1.31 0.00 0.00 55.95 57.00 1x3u s SER 127 Cb 0.00 -1.11 0.00 0.00 0.21 0.00 0.00 66.02 65.12 1x3u s SER 127 CO 0.00 0.15 0.00 1.41 0.41 0.00 0.00 173.24 175.21 1x3u n HIS 128 N 0.36 -3.84 -2.73 2.43 -0.00 -1.26 -4.90 115.22 105.28 1x3u n HIS 128 Ca -0.11 2.20 -0.04 0.00 -0.00 0.00 0.00 57.72 59.77 1x3u n HIS 128 Cb 0.53 -3.28 0.00 0.00 -0.00 0.00 0.00 29.99 27.24 1x3u n HIS 128 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.34 176.22 1x3u n MET 129 N 1.03 -2.90 0.00 -0.41 1.56 -1.19 -5.03 117.12 110.18 1x3u n MET 129 Ca 0.00 2.43 0.00 0.00 -0.27 0.00 0.00 57.70 59.86 1x3u n MET 129 Cb 0.00 -5.39 0.00 0.00 2.15 0.00 0.00 33.22 29.98 1x3u n MET 129 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 1x3u n ASP 130 N 0.23 0.00 -4.73 6.12 9.92 -1.26 -5.08 116.55 121.74 1x3u n ASP 130 Ca 0.05 0.00 -0.37 0.00 -0.53 0.00 0.00 54.79 53.94 1x3u n ASP 130 Cb 0.20 0.00 -0.07 0.00 -0.64 0.00 0.00 41.12 40.62 1x3u n ASP 130 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1x3u s ASP 131 N 0.91 6.56 0.04 -2.24 1.11 -1.26 -5.01 116.67 116.78 1x3u s ASP 131 Ca 0.00 0.66 -0.09 0.00 0.18 0.00 0.00 52.55 53.30 1x3u s ASP 131 Cb 0.00 -2.23 -0.03 0.00 1.07 0.00 0.00 42.92 41.73 1x3u s ASP 131 CO 0.00 0.07 1.16 0.00 1.18 0.00 0.00 175.17 177.58 1x3u h ALA 132 N 6.56 -0.45 -0.48 5.23 0.00 -1.95 0.17 119.26 128.34 1x3u h ALA 132 Ca -0.42 -0.00 0.14 0.00 0.00 0.00 0.00 54.91 54.63 1x3u h ALA 132 Cb 1.17 0.82 -0.02 0.00 0.00 0.00 0.00 17.79 19.76 1x3u h ALA 132 CO 0.75 -0.52 0.49 -0.91 0.00 0.00 0.00 179.25 179.05 1x3u h ASN 133 N -0.12 0.00 0.00 0.00 -0.26 -1.94 0.38 115.58 113.65 1x3u h ASN 133 Ca 0.02 0.00 -0.11 0.00 -0.56 0.00 0.00 56.30 55.65 1x3u h ASN 133 Cb 0.17 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.42 1x3u h ASN 133 CO -0.17 0.00 -0.34 -0.78 -1.06 0.00 0.00 177.43 175.08 1x3u h ASP 134 N 0.00 0.48 0.16 5.81 3.58 -1.12 -2.20 116.42 123.13 1x3u h ASP 134 Ca 0.23 -0.19 -0.01 0.00 0.42 0.00 0.00 57.03 57.48 1x3u h ASP 134 Cb 1.20 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 42.12 1x3u h ASP 134 CO -0.00 0.79 -0.08 0.40 -2.88 0.00 0.00 179.24 177.48 1x3u h ILE 135 N 0.40 0.97 -0.17 2.25 5.03 0.78 -2.33 117.51 124.45 1x3u h ILE 135 Ca 0.05 -0.91 0.05 0.00 -0.12 0.00 0.00 64.86 63.93 1x3u h ILE 135 Cb 0.79 1.50 -0.07 0.00 -3.03 0.00 0.00 36.82 36.01 1x3u h ILE 135 CO 0.06 0.20 -0.31 0.08 -0.68 0.00 0.00 178.15 177.50 1x3u h ARG 136 N -0.68 -0.35 -0.41 2.37 0.11 -1.49 1.76 114.38 115.69 1x3u h ARG 136 Ca -0.02 0.02 0.12 0.00 0.10 0.00 0.00 59.98 60.20 1x3u h ARG 136 Cb 0.49 0.08 -0.02 0.00 1.11 0.00 0.00 29.97 31.64 1x3u h ARG 136 CO 0.04 -0.23 0.44 0.00 0.10 0.00 0.00 179.97 180.31 1x3u h ALA 137 N 0.50 2.13 0.11 0.08 0.00 -1.45 0.48 119.26 121.11 1x3u h ALA 137 Ca 0.11 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.69 1x3u h ALA 137 Cb 0.53 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1x3u h ALA 137 CO -0.37 -0.65 -1.62 -0.09 0.00 0.00 0.00 179.25 176.52 1x3u h ARG 138 N 0.00 0.22 -1.40 0.00 2.43 0.10 -3.12 114.38 112.61 1x3u h ARG 138 Ca 0.20 -0.38 0.41 0.00 -0.81 0.00 0.00 59.98 59.39 1x3u h ARG 138 Cb 1.07 0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 30.71 1x3u h ARG 138 CO -0.00 1.06 1.08 -0.07 -1.51 0.00 0.00 179.97 180.53 1x3u h LEU 139 N 0.06 0.00 0.04 3.80 4.07 0.73 0.29 115.31 124.30 1x3u h LEU 139 Ca -0.27 0.00 -0.38 0.00 0.08 0.00 0.00 57.88 57.31 1x3u h LEU 139 Cb 2.02 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 43.71 1x3u h LEU 139 CO 0.14 0.00 -2.20 0.00 -1.08 0.00 0.00 178.44 175.30 1x3u n GLN 140 N -3.93 0.67 0.17 1.13 3.00 -1.15 -3.87 117.38 113.41 1x3u n GLN 140 Ca 0.31 0.25 0.18 0.00 -0.01 0.00 0.00 57.00 57.73 1x3u n GLN 140 Cb 1.52 -1.61 0.80 0.00 0.00 0.00 0.00 30.24 30.96 1x3u n GLN 140 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.06 178.85 1x3u h THR 141 N -0.20 0.43 0.00 5.09 1.35 -0.50 -3.19 112.91 115.89 1x3u h THR 141 Ca -0.52 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 1x3u h THR 141 Cb 1.85 0.78 0.00 0.00 -1.73 0.00 0.00 68.15 69.05 1x3u h THR 141 CO -0.08 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.37 1x3u n LEU 142 N -3.76 0.01 0.00 3.87 4.77 0.25 -5.05 117.00 117.09 1x3u n LEU 142 Ca 0.03 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 1x3u n LEU 142 Cb 0.41 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 1x3u n LEU 142 CO 0.27 0.00 0.00 -1.20 -1.33 0.00 0.00 177.39 175.13 1x3u n SER 143 N -0.30 0.00 -0.06 -1.43 7.64 -1.21 -4.95 113.62 113.31 1x3u n SER 143 Ca 0.00 0.00 0.25 0.00 1.01 0.00 0.00 58.87 60.13 1x3u n SER 143 Cb 0.00 0.00 0.68 0.00 -1.01 0.00 0.00 64.21 63.88 1x3u n SER 143 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1x3u h GLU 144 N 0.00 0.00 -0.48 1.43 4.81 -1.93 0.73 114.58 119.14 1x3u h GLU 144 Ca 0.00 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.12 1x3u h GLU 144 Cb 0.00 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1x3u h GLU 144 CO 0.00 0.00 -0.12 0.00 -0.73 0.00 0.00 179.01 178.16 1x3u h ARG 145 N 0.00 0.90 0.41 1.92 2.47 -1.95 -0.41 114.38 117.72 1x3u h ARG 145 Ca 0.33 -0.32 -0.02 0.00 -1.26 0.00 0.00 59.98 58.71 1x3u h ARG 145 Cb 1.70 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 29.96 1x3u h ARG 145 CO -0.00 0.97 -0.20 1.49 0.56 0.00 0.00 179.97 182.79 1x3u h GLU 146 N 0.80 -0.53 -0.33 0.04 4.22 0.14 0.12 114.58 119.04 1x3u h GLU 146 Ca 0.13 0.04 0.10 0.00 0.08 0.00 0.00 59.36 59.70 1x3u h GLU 146 Cb 0.65 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 1x3u h GLU 146 CO 0.05 -0.32 0.33 0.00 -2.18 0.00 0.00 179.01 176.89 1x3u h ARG 147 N -1.12 0.00 0.00 1.92 3.08 -1.50 0.41 114.38 117.17 1x3u h ARG 147 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1x3u h ARG 147 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.51 1x3u h ARG 147 CO 0.09 0.00 0.00 1.04 -1.07 0.00 0.00 179.97 180.03 1x3u n GLN 148 N -3.87 0.00 0.01 0.04 6.02 -0.16 -3.11 117.38 116.31 1x3u n GLN 148 Ca 0.05 0.30 0.20 0.00 -0.01 0.00 0.00 57.00 57.55 1x3u n GLN 148 Cb 0.49 -0.79 0.69 0.00 1.02 0.00 0.00 30.24 31.65 1x3u n GLN 148 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.06 175.81 1x3u h VAL 149 N 0.00 0.72 0.57 5.09 3.04 -0.71 -2.05 116.25 122.92 1x3u h VAL 149 Ca 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.66 1x3u h VAL 149 Cb 0.00 0.74 0.01 0.00 -2.01 0.00 0.00 31.29 30.02 1x3u h VAL 149 CO 0.00 0.00 -0.27 0.25 -1.01 0.00 0.00 177.57 176.54 1x3u h LEU 150 N 0.00 -0.65 -2.17 3.16 5.85 -0.34 0.68 115.31 121.85 1x3u h LEU 150 Ca 0.25 0.02 0.03 0.00 0.84 0.00 0.00 57.88 59.02 1x3u h LEU 150 Cb 1.00 0.17 -0.00 0.00 0.37 0.00 0.00 40.66 42.19 1x3u h LEU 150 CO -0.00 -0.30 0.29 0.77 -0.34 0.00 0.00 178.44 178.85 1x3u h SER 151 N -1.10 0.00 0.41 1.25 4.64 -1.42 1.11 113.55 118.44 1x3u h SER 151 Ca -0.08 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 60.93 1x3u h SER 151 Cb 0.59 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.67 1x3u h SER 151 CO 0.13 0.00 -1.60 0.00 -0.87 0.00 0.00 176.83 174.49 1x3u h ALA 152 N 1.52 0.32 0.14 5.18 0.00 -1.22 -3.32 119.26 121.88 1x3u h ALA 152 Ca 0.05 -1.16 -0.01 0.00 0.00 0.00 0.00 54.91 53.79 1x3u h ALA 152 Cb 0.62 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1x3u h ALA 152 CO -0.00 1.18 -0.07 0.28 0.00 0.00 0.00 179.25 180.65 1x3u h VAL 153 N 0.06 0.99 -1.00 0.00 2.07 0.71 -3.03 116.25 116.05 1x3u h VAL 153 Ca -0.27 -0.57 0.32 0.00 0.82 0.00 0.00 66.70 67.00 1x3u h VAL 153 Cb 2.02 1.34 -0.15 0.00 -1.52 0.00 0.00 31.29 32.98 1x3u h VAL 153 CO 0.15 0.13 0.57 -0.37 0.02 0.00 0.00 177.57 178.07 1x3u h VAL 154 N -0.46 0.30 0.11 2.57 -1.51 0.45 0.60 116.25 118.31 1x3u h VAL 154 Ca -0.02 -0.11 -0.01 0.00 -1.23 0.00 0.00 66.70 65.33 1x3u h VAL 154 Cb 0.37 -0.05 0.00 0.00 -2.13 0.00 0.00 31.29 29.47 1x3u h VAL 154 CO 0.03 0.06 -0.05 0.00 -1.23 0.00 0.00 177.57 176.38 1x3u h ALA 155 N 1.85 -0.14 0.00 5.19 0.00 -1.63 -3.48 119.26 121.05 1x3u h ALA 155 Ca 0.73 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.51 1x3u h ALA 155 Cb 1.67 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1x3u h ALA 155 CO -0.60 -0.46 0.00 0.41 0.00 0.00 0.00 179.25 178.60 1x3u n GLY 156 N -0.49 1.77 3.88 0.00 0.00 0.20 -5.12 105.19 105.42 1x3u n GLY 156 Ca -0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 1x3u n GLY 156 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x3u s LEU 157 N 0.00 3.34 0.00 0.99 1.43 -1.24 -5.07 118.68 118.13 1x3u s LEU 157 Ca 0.00 1.32 -0.01 0.00 -1.03 0.00 0.00 54.13 54.41 1x3u s LEU 157 Cb 0.00 -4.34 0.01 0.00 0.03 0.00 0.00 46.19 41.89 1x3u s LEU 157 CO 0.00 -0.79 0.02 -2.65 0.23 0.00 0.00 176.35 173.17 1x3u n PRO 158 N -2.58 -1.20 0.09 1.29 -0.02 -1.26 -4.76 135.00 126.56 1x3u n PRO 158 Ca 0.05 -0.04 0.01 0.00 -2.02 0.00 0.00 63.50 61.50 1x3u n PRO 158 Cb 0.54 -0.06 -0.03 0.00 -0.02 0.00 0.00 33.50 33.93 1x3u n PRO 158 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 1x3u h ASN 159 N -1.84 0.00 0.00 2.55 -0.73 -1.97 -3.24 115.58 110.36 1x3u h ASN 159 Ca -0.01 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.15 1x3u h ASN 159 Cb 0.04 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.63 1x3u h ASN 159 CO 0.01 0.55 -0.08 0.50 -0.37 0.00 0.00 177.43 178.04 1x3u h LYS 160 N 0.00 0.00 -0.52 6.67 3.64 -1.91 -3.13 116.57 121.33 1x3u h LYS 160 Ca -0.07 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.41 1x3u h LYS 160 Cb 1.48 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 33.20 1x3u h LYS 160 CO 0.06 0.55 -0.19 0.77 -2.27 0.00 0.00 179.45 178.37 1x3u h SER 161 N -1.00 -0.66 0.13 4.20 0.02 -1.93 0.42 113.55 114.73 1x3u h SER 161 Ca -0.02 0.17 0.02 0.00 -0.84 0.00 0.00 61.79 61.12 1x3u h SER 161 Cb 0.58 0.39 -0.05 0.00 0.14 0.00 0.00 62.40 63.47 1x3u h SER 161 CO -0.01 -0.22 -0.46 0.40 -1.14 0.00 0.00 176.83 175.40 1x3u h ILE 162 N -0.07 0.09 -0.86 3.27 2.04 -1.71 1.29 117.51 121.58 1x3u h ILE 162 Ca 0.24 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.19 1x3u h ILE 162 Cb 0.44 0.09 -0.06 0.00 -0.74 0.00 0.00 36.82 36.56 1x3u h ILE 162 CO -0.57 0.00 0.56 0.00 0.00 0.00 0.00 178.15 178.14 1x3u h ALA 163 N -0.32 1.63 0.00 1.87 0.00 -1.27 0.18 119.26 121.34 1x3u h ALA 163 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1x3u h ALA 163 Cb 0.72 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1x3u h ALA 163 CO -0.26 0.21 -0.25 0.66 0.00 0.00 0.00 179.25 179.62 1x3u n TYR 164 N -4.51 0.12 0.15 0.00 4.02 0.14 0.11 117.16 117.20 1x3u n TYR 164 Ca 0.14 0.04 0.11 0.00 -0.01 0.00 0.00 57.90 58.18 1x3u n TYR 164 Cb 0.27 -0.45 -0.01 0.00 -0.02 0.00 0.00 39.34 39.13 1x3u n TYR 164 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 1x3u n ASP 165 N -1.62 0.73 -1.50 7.72 9.92 0.44 -4.06 116.55 128.18 1x3u n ASP 165 Ca 0.06 0.24 -0.12 0.00 -0.53 0.00 0.00 54.79 54.44 1x3u n ASP 165 Cb 0.35 0.62 0.15 0.00 -0.64 0.00 0.00 41.12 41.61 1x3u n ASP 165 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1x3u n LEU 166 N -2.55 4.78 -3.64 0.64 4.77 -0.70 -4.91 117.00 115.40 1x3u n LEU 166 Ca -0.00 -4.04 -0.27 0.00 -0.03 0.00 0.00 56.01 51.67 1x3u n LEU 166 Cb 0.54 -0.63 -0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1x3u n LEU 166 CO 0.40 1.46 -0.01 -0.67 -1.33 0.00 0.00 177.39 177.24 1x3u n ASP 167 N -1.03 -3.84 -4.74 -1.43 2.03 -1.24 -4.92 116.55 101.38 1x3u n ASP 167 Ca 0.40 -0.59 -0.29 0.00 0.52 0.00 0.00 54.79 54.83 1x3u n ASP 167 Cb 1.00 -3.15 -0.07 0.00 -0.72 0.00 0.00 41.12 38.18 1x3u n ASP 167 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1x3u s ILE 168 N -3.07 1.72 -0.07 5.18 -1.09 0.30 -5.03 121.20 119.15 1x3u s ILE 168 Ca 0.52 -1.85 -0.03 0.00 -2.23 0.00 0.00 60.65 57.06 1x3u s ILE 168 Cb -0.27 -2.57 -0.04 0.00 -1.58 0.00 0.00 42.46 38.00 1x3u s ILE 168 CO 0.64 0.00 0.07 -0.94 -1.23 0.00 0.00 174.94 173.48 1x3u s SER 169 N -3.90 5.73 0.62 3.58 1.04 -1.23 -3.66 113.70 115.87 1x3u s SER 169 Ca 0.26 0.24 0.38 0.00 0.48 0.00 0.00 55.95 57.31 1x3u s SER 169 Cb 0.04 -1.70 2.09 0.00 0.10 0.00 0.00 66.02 66.54 1x3u s SER 169 CO 0.14 0.35 2.29 1.55 0.98 0.00 0.00 173.24 178.55 1x3u h PRO 170 N 4.73 0.00 0.00 4.02 0.13 -1.84 0.37 132.00 139.41 1x3u h PRO 170 Ca -0.51 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.60 1x3u h PRO 170 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1x3u h PRO 170 CO 0.58 0.01 -0.58 -0.09 -0.23 0.00 0.00 178.00 177.69 1x3u h ARG 171 N 0.00 0.00 0.04 0.86 9.65 -1.94 -3.22 114.38 119.77 1x3u h ARG 171 Ca -0.00 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1x3u h ARG 171 Cb 0.07 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.65 1x3u h ARG 171 CO 0.00 0.05 -0.02 1.15 2.80 0.00 0.00 179.97 183.95 1x3u h THR 172 N 0.00 1.34 -0.79 0.20 2.02 -0.69 -3.10 112.91 111.90 1x3u h THR 172 Ca -0.01 -1.63 0.12 0.00 0.77 0.00 0.00 66.41 65.66 1x3u h THR 172 Cb 1.06 2.36 -0.06 0.00 -1.74 0.00 0.00 68.15 69.77 1x3u h THR 172 CO 0.01 0.39 0.52 -0.37 0.37 0.00 0.00 175.52 176.43 1x3u h VAL 173 N -0.82 0.88 -0.64 3.16 -1.51 -1.44 1.40 116.25 117.28 1x3u h VAL 173 Ca -0.01 -0.21 0.07 0.00 -1.23 0.00 0.00 66.70 65.32 1x3u h VAL 173 Cb 0.68 0.22 -0.06 0.00 -2.13 0.00 0.00 31.29 30.00 1x3u h VAL 173 CO 0.01 0.11 0.33 -0.33 -1.23 0.00 0.00 177.57 176.46 1x3u h GLU 174 N 0.61 0.59 0.17 5.19 5.08 -1.58 1.28 114.58 125.92 1x3u h GLU 174 Ca 0.38 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.69 1x3u h GLU 174 Cb 0.62 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1x3u h GLU 174 CO -0.14 0.39 -0.08 0.28 -1.00 0.00 0.00 179.01 178.45 1x3u h VAL 175 N 0.60 0.00 -0.79 3.13 2.07 -0.56 -3.11 116.25 117.60 1x3u h VAL 175 Ca 0.29 -0.80 0.19 0.00 0.82 0.00 0.00 66.70 67.20 1x3u h VAL 175 Cb 0.23 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 29.87 1x3u h VAL 175 CO -0.21 0.00 0.08 0.45 0.02 0.00 0.00 177.57 177.92 1x3u h HIS 176 N -1.03 0.09 0.00 1.57 3.86 0.18 0.10 115.15 119.92 1x3u h HIS 176 Ca -0.02 0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1x3u h HIS 176 Cb 0.18 0.09 0.00 0.00 1.06 0.00 0.00 27.41 28.73 1x3u h HIS 176 CO 0.00 -0.21 0.00 -2.13 0.86 0.00 0.00 177.93 176.45 1x3u n ARG 177 N -5.29 0.00 -0.31 2.45 0.63 0.44 0.19 116.66 114.77 1x3u n ARG 177 Ca 0.16 0.54 0.35 0.00 -0.92 0.00 0.00 57.85 57.97 1x3u n ARG 177 Cb 0.52 -1.49 0.75 0.00 0.45 0.00 0.00 32.46 32.70 1x3u n ARG 177 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1x3u h ALA 178 N -1.90 3.09 0.20 5.13 0.00 -1.41 0.56 119.26 124.94 1x3u h ALA 178 Ca 0.00 -0.04 -0.31 0.00 0.00 0.00 0.00 54.91 54.56 1x3u h ALA 178 Cb 0.00 0.09 0.03 0.00 0.00 0.00 0.00 17.79 17.91 1x3u h ALA 178 CO 0.00 -1.44 -1.32 -0.97 0.00 0.00 0.00 179.25 175.52 1x3u h ASN 179 N 0.00 0.81 0.63 0.00 -0.73 -0.46 -2.86 115.58 112.98 1x3u h ASN 179 Ca 0.55 -0.89 -0.03 0.00 1.87 0.00 0.00 56.30 57.80 1x3u h ASN 179 Cb 2.23 -0.26 0.01 0.00 0.27 0.00 0.00 38.32 40.56 1x3u h ASN 179 CO -0.01 1.64 -0.30 0.58 -0.37 0.00 0.00 177.43 178.97 1x3u h VAL 180 N 0.12 0.00 -0.89 2.57 2.07 0.73 -1.42 116.25 119.42 1x3u h VAL 180 Ca -0.22 -0.04 0.16 0.00 0.82 0.00 0.00 66.70 67.42 1x3u h VAL 180 Cb 2.02 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 31.72 1x3u h VAL 180 CO 0.25 0.00 0.57 0.00 0.02 0.00 0.00 177.57 178.41 1x3u h MET 181 N -0.88 0.60 -0.93 1.57 -0.00 -1.20 1.40 114.93 115.49 1x3u h MET 181 Ca -0.09 -0.04 0.04 0.00 -0.00 0.00 0.00 59.70 59.62 1x3u h MET 181 Cb 0.65 -0.14 -0.06 0.00 -0.00 0.00 0.00 31.60 32.06 1x3u h MET 181 CO 0.14 0.40 0.60 0.00 -0.00 0.00 0.00 176.91 178.05 1x3u h ALA 182 N 1.61 1.24 0.02 -3.00 0.00 -1.28 -1.61 119.26 116.24 1x3u h ALA 182 Ca 0.45 -0.04 -0.28 0.00 0.00 0.00 0.00 54.91 55.04 1x3u h ALA 182 Cb 0.82 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 1x3u h ALA 182 CO -0.20 0.45 -1.57 0.87 0.00 0.00 0.00 179.25 178.79 1x3u h LYS 183 N 1.15 0.04 0.00 0.00 1.57 0.26 -3.30 116.57 116.29 1x3u h LYS 183 Ca 0.38 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 1x3u h LYS 183 Cb 0.03 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1x3u h LYS 183 CO -0.13 0.71 0.00 0.52 -0.57 0.00 0.00 179.45 179.98 1x3u h MET 184 N 0.01 0.00 0.00 3.15 2.86 0.22 -3.45 114.93 117.72 1x3u h MET 184 Ca -0.24 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.40 1x3u h MET 184 Cb 1.97 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.63 1x3u h MET 184 CO 0.10 0.00 0.00 1.63 1.06 0.00 0.00 176.91 179.70 1x3u n LYS 185 N -2.48 0.00 -0.07 1.72 4.76 -0.76 -4.84 118.16 116.50 1x3u n LYS 185 Ca -0.01 0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.52 1x3u n LYS 185 Cb 0.07 -2.75 0.00 0.00 -1.84 0.00 0.00 35.03 30.51 1x3u n LYS 185 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1x3u n ALA 186 N 0.56 0.00 0.00 7.82 0.00 -0.68 -3.18 120.51 125.03 1x3u n ALA 186 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1x3u n ALA 186 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1x3u n ALA 186 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1x3u n LYS 187 N -0.18 0.00 -4.63 0.00 2.85 -1.26 -4.76 118.16 110.17 1x3u n LYS 187 Ca 0.00 0.00 -0.28 0.00 -1.05 0.00 0.00 58.31 56.98 1x3u n LYS 187 Cb 0.00 -0.13 -0.09 0.00 -0.65 0.00 0.00 35.03 34.15 1x3u n LYS 187 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1x3u s SER 188 N -4.41 3.57 0.09 -5.58 0.15 -1.26 -5.01 113.70 101.24 1x3u s SER 188 Ca 0.00 -1.52 -0.22 0.00 0.70 0.00 0.00 55.95 54.91 1x3u s SER 188 Cb 0.00 0.12 -0.13 0.00 -1.71 0.00 0.00 66.02 64.30 1x3u s SER 188 CO 0.00 -0.70 1.72 0.25 1.20 0.00 0.00 173.24 175.71 1x3u h LEU 189 N 1.67 0.06 -0.46 3.45 7.12 -2.01 -2.97 115.31 122.17 1x3u h LEU 189 Ca -0.42 -0.03 0.08 0.00 0.13 0.00 0.00 57.88 57.64 1x3u h LEU 189 Cb 1.27 -0.02 -0.07 0.00 -0.53 0.00 0.00 40.66 41.32 1x3u h LEU 189 CO 0.73 0.08 0.05 -0.65 -0.13 0.00 0.00 178.44 178.52 1x3u h PRO 190 N 0.04 0.16 -0.38 5.25 0.11 -1.98 -2.68 132.00 132.52 1x3u h PRO 190 Ca 0.02 -0.01 0.07 0.00 0.11 0.00 0.00 66.00 66.19 1x3u h PRO 190 Cb 0.03 -0.04 -0.09 0.00 0.11 0.00 0.00 31.00 31.01 1x3u h PRO 190 CO -0.00 0.11 -0.40 1.25 -0.21 0.00 0.00 178.00 178.75 1x3u h HIS 191 N 0.17 -1.15 -0.12 0.65 2.76 -1.93 -0.55 115.15 114.98 1x3u h HIS 191 Ca 0.23 0.06 0.01 0.00 -2.20 0.00 0.00 60.37 58.48 1x3u h HIS 191 Cb 0.32 0.56 -0.02 0.00 1.55 0.00 0.00 27.41 29.82 1x3u h HIS 191 CO -0.26 -0.43 -0.11 -0.07 -1.30 0.00 0.00 177.93 175.77 1x3u h LEU 192 N -0.32 -0.38 -0.85 0.26 3.38 -1.39 0.12 115.31 116.13 1x3u h LEU 192 Ca 0.14 0.05 0.21 0.00 0.09 0.00 0.00 57.88 58.38 1x3u h LEU 192 Cb 0.58 0.16 -0.15 0.00 0.09 0.00 0.00 40.66 41.34 1x3u h LEU 192 CO -0.55 -0.06 0.05 0.58 0.09 0.00 0.00 178.44 178.55 1x3u h VAL 193 N -0.05 0.24 -0.85 1.22 2.07 -1.43 1.30 116.25 118.75 1x3u h VAL 193 Ca 0.02 -0.03 0.10 0.00 0.82 0.00 0.00 66.70 67.61 1x3u h VAL 193 Cb 0.10 0.13 -0.08 0.00 -1.52 0.00 0.00 31.29 29.92 1x3u h VAL 193 CO -0.14 0.02 0.49 0.03 0.02 0.00 0.00 177.57 177.99 1x3u h ARG 194 N 0.10 0.77 0.00 1.57 2.47 0.63 1.51 114.38 121.43 1x3u h ARG 194 Ca 0.49 -0.05 -0.09 0.00 -1.26 0.00 0.00 59.98 59.08 1x3u h ARG 194 Cb 0.94 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 29.08 1x3u h ARG 194 CO -0.74 0.51 -0.41 0.52 0.56 0.00 0.00 179.97 180.40 1x3u h MET 195 N 0.80 0.00 0.08 0.04 2.86 0.31 -2.66 114.93 116.35 1x3u h MET 195 Ca 0.42 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 58.05 1x3u h MET 195 Cb 0.41 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.07 1x3u h MET 195 CO -0.26 0.41 -0.04 0.00 1.06 0.00 0.00 176.91 178.09 1x3u h ALA 196 N 1.59 -0.15 -1.02 6.32 0.00 0.46 -0.19 119.26 126.26 1x3u h ALA 196 Ca -0.00 -0.02 0.26 0.00 0.00 0.00 0.00 54.91 55.15 1x3u h ALA 196 Cb 1.21 0.04 -0.12 0.00 0.00 0.00 0.00 17.79 18.91 1x3u h ALA 196 CO 0.05 -0.14 0.61 1.37 0.00 0.00 0.00 179.25 181.14 1x3u h LEU 197 N -0.63 0.61 -0.53 0.00 8.10 0.22 1.51 115.31 124.59 1x3u h LEU 197 Ca -0.01 0.14 -0.16 0.00 0.11 0.00 0.00 57.88 57.95 1x3u h LEU 197 Cb 0.08 0.04 -0.01 0.00 -0.44 0.00 0.00 40.66 40.33 1x3u h LEU 197 CO 0.02 0.07 -0.68 0.00 -4.11 0.00 0.00 178.44 173.73 1x3u h ALA 198 N 1.73 0.73 -0.58 0.17 0.00 -1.58 -3.25 119.26 116.48 1x3u h ALA 198 Ca 0.65 -0.59 -0.66 0.00 0.00 0.00 0.00 54.91 54.31 1x3u h ALA 198 Cb 1.35 -0.08 -0.13 0.00 0.00 0.00 0.00 17.79 18.93 1x3u h ALA 198 CO -0.47 0.77 1.83 0.41 0.00 0.00 0.00 179.25 181.80 1x3u n GLY 199 N 0.44 4.91 2.36 0.00 0.00 0.44 -4.71 105.19 108.63 1x3u n GLY 199 Ca -0.03 -1.98 -0.03 0.00 0.00 0.00 0.00 46.02 43.99 1x3u n GLY 199 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x3u n GLY 200 N 1.54 -0.42 1.80 -0.02 0.00 -1.13 -4.57 105.19 102.39 1x3u n GLY 200 Ca 0.59 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.41 1x3u n GLY 200 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1x3u n PHE 201 N -2.55 2.32 -4.37 1.61 7.35 0.27 -4.96 117.46 117.13 1x3u n PHE 201 Ca -0.03 -2.12 -0.19 0.00 -0.76 0.00 0.00 57.45 54.34 1x3u n PHE 201 Cb 0.48 -0.35 -0.10 0.00 0.35 0.00 0.00 39.48 39.86 1x3u n PHE 201 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1x3u s GLY 202 N -3.49 1.55 -0.49 7.13 0.00 -1.24 -2.62 107.32 108.17 1x3u s GLY 202 Ca 0.49 -1.74 -0.32 0.00 0.00 0.00 0.00 44.72 43.16 1x3u s GLY 202 CO 0.02 -1.78 2.33 -1.05 0.00 0.00 0.00 173.10 172.62 1x3u n PRO 203 N -0.44 0.92 0.00 2.90 -0.02 -1.26 -4.98 135.00 132.12 1x3u n PRO 203 Ca -0.07 0.18 0.13 0.00 -2.02 0.00 0.00 63.50 61.72 1x3u n PRO 203 Cb 0.61 -2.58 0.36 0.00 -0.02 0.00 0.00 33.50 31.87 1x3u n PRO 203 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93