#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 4.51 0.00 1.61 0.01 -1.26 -5.05 113.70 113.52 1x3u s SER 127 Ca 0.00 -0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.16 1x3u s SER 127 Cb 0.00 -1.30 0.00 0.00 0.21 0.00 0.00 66.02 64.93 1x3u s SER 127 CO 0.00 0.30 0.00 1.41 0.41 0.00 0.00 173.24 175.36 1x3u n HIS 128 N 2.64 0.00 -2.56 2.43 -0.00 -1.26 -4.82 115.22 111.64 1x3u n HIS 128 Ca -0.18 0.00 -0.05 0.00 -0.00 0.00 0.00 57.72 57.50 1x3u n HIS 128 Cb 0.53 0.00 0.01 0.00 -0.00 0.00 0.00 29.99 30.52 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 0.00 -1.61 0.00 -0.41 1.56 -1.26 -5.05 117.12 110.35 1x3u n MET 129 Ca 0.00 1.62 0.00 0.00 -0.27 0.00 0.00 57.70 59.05 1x3u n MET 129 Cb 0.00 -4.69 0.00 0.00 2.15 0.00 0.00 33.22 30.68 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 -0.65 0.00 -4.30 6.12 9.92 -1.26 -5.07 116.55 121.30 1x3u n ASP 130 Ca 0.07 0.00 -0.26 0.00 -0.53 0.00 0.00 54.79 54.07 1x3u n ASP 130 Cb 0.39 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.73 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 -1.00 2.74 0.01 -2.24 1.01 -1.26 -5.05 116.67 110.88 1x3u s ASP 131 Ca 0.00 -0.64 -0.05 0.00 0.71 0.00 0.00 52.55 52.57 1x3u s ASP 131 Cb 0.00 -0.19 -0.02 0.00 1.01 0.00 0.00 42.92 43.72 1x3u s ASP 131 CO 0.00 0.13 1.08 0.00 0.21 0.00 0.00 175.17 176.59 1x3u h ALA 132 N 4.35 -0.64 -0.86 5.23 0.00 -1.94 -2.02 119.26 123.38 1x3u h ALA 132 Ca -0.46 -0.02 0.17 0.00 0.00 0.00 0.00 54.91 54.60 1x3u h ALA 132 Cb 1.17 0.49 -0.06 0.00 0.00 0.00 0.00 17.79 19.39 1x3u h ALA 132 CO 0.41 -0.66 0.57 -0.97 0.00 0.00 0.00 179.25 178.60 1x3u h ASN 133 N -0.11 0.50 -0.60 0.00 -0.00 -1.89 0.29 115.58 113.76 1x3u h ASN 133 Ca -0.00 0.04 0.17 0.00 -0.00 0.00 0.00 56.30 56.51 1x3u h ASN 133 Cb 0.11 -0.06 -0.02 0.00 -0.00 0.00 0.00 38.32 38.35 1x3u h ASN 133 CO -0.04 0.23 0.50 -0.78 -0.00 0.00 0.00 177.43 177.35 1x3u h ASP 134 N 0.52 0.00 0.66 1.15 1.82 -1.79 0.58 116.42 119.35 1x3u h ASP 134 Ca 0.44 0.00 -0.27 0.00 -0.39 0.00 0.00 57.03 56.81 1x3u h ASP 134 Cb 0.93 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.92 1x3u h ASP 134 CO -0.18 0.00 -1.34 0.40 -1.61 0.00 0.00 179.24 176.51 1x3u h ILE 135 N 0.00 1.34 -0.02 2.25 5.03 -0.03 -1.80 117.51 124.28 1x3u h ILE 135 Ca 0.29 -3.02 -0.01 0.00 -0.12 0.00 0.00 64.86 62.00 1x3u h ILE 135 Cb 1.29 2.77 -0.00 0.00 -3.03 0.00 0.00 36.82 37.85 1x3u h ILE 135 CO -0.00 0.83 -0.01 0.03 -0.68 0.00 0.00 178.15 178.32 1x3u h ARG 136 N 0.04 0.05 0.00 2.37 3.08 0.11 1.60 114.38 121.63 1x3u h ARG 136 Ca -0.16 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 59.81 1x3u h ARG 136 Cb 1.93 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.97 1x3u h ARG 136 CO 0.15 0.47 -0.27 0.00 -1.07 0.00 0.00 179.97 179.24 1x3u h ALA 137 N 0.58 1.27 0.00 0.04 0.00 -0.53 -2.40 119.26 118.23 1x3u h ALA 137 Ca 0.00 -0.25 -0.18 0.00 0.00 0.00 0.00 54.91 54.49 1x3u h ALA 137 Cb 0.45 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1x3u h ALA 137 CO 0.00 0.34 -1.19 -0.09 0.00 0.00 0.00 179.25 178.32 1x3u h ARG 138 N 0.00 0.00 -0.85 0.00 2.43 -1.11 -3.18 114.38 111.67 1x3u h ARG 138 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1x3u h ARG 138 Cb 0.59 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.10 1x3u h ARG 138 CO 0.04 0.46 0.48 -0.07 -1.51 0.00 0.00 179.97 179.37 1x3u h LEU 139 N 0.00 1.05 -0.05 3.80 3.38 0.29 -1.31 115.31 122.46 1x3u h LEU 139 Ca -0.12 -0.08 -0.24 0.00 0.09 0.00 0.00 57.88 57.53 1x3u h LEU 139 Cb 1.63 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 42.11 1x3u h LEU 139 CO 0.07 0.83 -1.07 1.56 0.09 0.00 0.00 178.44 179.92 1x3u h GLN 140 N 1.18 0.24 0.00 1.13 1.08 -1.64 -3.06 115.11 114.05 1x3u h GLN 140 Ca 0.30 -0.34 -0.01 0.00 -1.45 0.00 0.00 58.65 57.16 1x3u h GLN 140 Cb 0.00 0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 27.55 1x3u h GLN 140 CO -0.05 1.10 -0.04 1.79 -0.95 0.00 0.00 178.83 180.68 1x3u h THR 141 N 0.10 0.21 0.00 -0.54 1.35 -1.41 -3.30 112.91 109.32 1x3u h THR 141 Ca -0.09 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 1x3u h THR 141 Cb 1.76 1.24 0.00 0.00 -1.73 0.00 0.00 68.15 69.42 1x3u h THR 141 CO 0.17 0.04 0.00 0.18 -0.25 0.00 0.00 175.52 175.66 1x3u n LEU 142 N -3.31 0.00 0.00 3.87 4.77 -0.54 -5.04 117.00 116.75 1x3u n LEU 142 Ca -0.02 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 1x3u n LEU 142 Cb 0.19 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1x3u n LEU 142 CO 0.26 0.00 0.00 -1.20 -1.33 0.00 0.00 177.39 175.12 1x3u n SER 143 N -0.40 0.00 0.26 -1.43 7.64 -1.25 -4.94 113.62 113.51 1x3u n SER 143 Ca 0.00 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.01 1x3u n SER 143 Cb 0.00 0.00 0.72 0.00 -1.01 0.00 0.00 64.21 63.92 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 0.00 1.43 4.81 -1.95 -1.74 114.58 117.13 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 0.12 -0.55 0.00 -0.73 0.00 0.00 179.01 177.85 1x3u h ARG 145 N 0.00 0.00 -0.95 1.92 2.47 -1.96 -3.08 114.38 112.78 1x3u h ARG 145 Ca -0.00 0.00 0.13 0.00 -1.26 0.00 0.00 59.98 58.85 1x3u h ARG 145 Cb 0.34 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 28.59 1x3u h ARG 145 CO 0.02 0.55 0.60 1.05 0.56 0.00 0.00 179.97 182.75 1x3u h GLU 146 N 0.00 0.83 0.07 0.04 -0.00 -1.62 0.84 114.58 114.74 1x3u h GLU 146 Ca -0.01 -0.05 -0.29 0.00 -0.00 0.00 0.00 59.36 59.02 1x3u h GLU 146 Cb 1.27 -0.19 -0.02 0.00 -0.00 0.00 0.00 28.75 29.81 1x3u h GLU 146 CO 0.07 0.55 -1.49 0.07 -0.00 0.00 0.00 179.01 178.21 1x3u h ARG 147 N 0.85 0.14 0.51 1.06 -0.00 -1.67 -2.74 114.38 112.53 1x3u h ARG 147 Ca 0.48 -0.24 -0.03 0.00 -0.00 0.00 0.00 59.98 60.19 1x3u h ARG 147 Cb 0.60 0.09 0.01 0.00 -0.00 0.00 0.00 29.97 30.66 1x3u h ARG 147 CO -0.24 0.94 -0.25 1.96 -0.00 0.00 0.00 179.97 182.39 1x3u h GLN 148 N 0.04 -0.66 0.79 0.08 1.08 -1.17 -2.71 115.11 112.56 1x3u h GLN 148 Ca -0.21 0.05 -0.03 0.00 -1.45 0.00 0.00 58.65 57.00 1x3u h GLN 148 Cb 1.97 0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 29.54 1x3u h GLN 148 CO 0.13 -0.44 -0.50 0.28 -0.95 0.00 0.00 178.83 177.35 1x3u h VAL 149 N -1.13 0.00 0.00 -0.54 2.07 0.48 -2.73 116.25 114.41 1x3u h VAL 149 Ca -0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1x3u h VAL 149 Cb 0.53 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 1x3u h VAL 149 CO 0.12 0.00 0.00 -0.11 0.02 0.00 0.00 177.57 177.60 1x3u n LEU 150 N -5.59 0.00 0.01 2.57 7.94 -1.03 0.19 117.00 121.08 1x3u n LEU 150 Ca -0.15 0.78 0.21 0.00 -1.11 0.00 0.00 56.01 55.75 1x3u n LEU 150 Cb 0.50 -0.28 0.55 0.00 0.53 0.00 0.00 43.42 44.72 1x3u n LEU 150 CO 0.34 -0.28 1.19 0.77 -1.11 0.00 0.00 177.39 178.30 1x3u h SER 151 N 0.00 0.00 0.37 1.96 4.64 -1.58 1.92 113.55 120.86 1x3u h SER 151 Ca 0.00 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.00 1x3u h SER 151 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 1x3u h SER 151 CO 0.00 0.00 -1.77 0.00 -0.87 0.00 0.00 176.83 174.19 1x3u h ALA 152 N 0.91 0.59 0.00 5.18 0.00 -0.87 -3.33 119.26 121.74 1x3u h ALA 152 Ca 0.28 -1.39 -0.11 0.00 0.00 0.00 0.00 54.91 53.69 1x3u h ALA 152 Cb 1.92 0.53 -0.02 0.00 0.00 0.00 0.00 17.79 20.22 1x3u h ALA 152 CO -0.00 1.43 -0.54 0.28 0.00 0.00 0.00 179.25 180.42 1x3u h VAL 153 N 0.03 1.14 0.00 0.00 2.07 1.35 -2.99 116.25 117.86 1x3u h VAL 153 Ca -0.32 -2.02 -0.01 0.00 0.82 0.00 0.00 66.70 65.18 1x3u h VAL 153 Cb 2.02 2.17 -0.00 0.00 -1.52 0.00 0.00 31.29 33.95 1x3u h VAL 153 CO 0.09 0.53 -0.03 -0.37 0.02 0.00 0.00 177.57 177.82 1x3u h VAL 154 N 0.00 0.97 0.09 2.57 -1.51 0.19 -2.76 116.25 115.81 1x3u h VAL 154 Ca -0.01 -0.09 -0.35 0.00 -1.23 0.00 0.00 66.70 65.03 1x3u h VAL 154 Cb 1.12 1.05 -0.03 0.00 -2.13 0.00 0.00 31.29 31.30 1x3u h VAL 154 CO 0.07 0.02 -1.98 0.00 -1.23 0.00 0.00 177.57 174.46 1x3u n ALA 155 N -2.51 1.06 -0.31 5.19 0.00 -1.18 -5.01 120.51 117.75 1x3u n ALA 155 Ca -0.03 -0.68 0.00 0.00 0.00 0.00 0.00 53.44 52.73 1x3u n ALA 155 Cb 0.11 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 18.89 1x3u n ALA 155 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x3u n GLY 156 N 1.92 1.72 3.83 0.00 0.00 -1.04 -5.10 105.19 106.51 1x3u n GLY 156 Ca -0.30 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.01 2.60 1.07 0.99 1.43 -1.23 -5.03 118.68 118.50 1x3u s LEU 157 Ca 0.00 1.20 -0.12 0.00 -1.03 0.00 0.00 54.13 54.18 1x3u s LEU 157 Cb 0.00 -3.81 0.23 0.00 0.03 0.00 0.00 46.19 42.64 1x3u s LEU 157 CO 0.00 -1.88 1.08 -2.84 0.23 0.00 0.00 176.35 172.93 1x3u s PRO 158 N -5.24 -0.20 0.53 1.29 0.02 -1.26 -4.77 135.00 125.38 1x3u s PRO 158 Ca 0.61 1.16 0.28 0.00 0.02 0.00 0.00 61.00 63.06 1x3u s PRO 158 Cb -0.13 -1.61 1.52 0.00 0.02 0.00 0.00 34.50 34.29 1x3u s PRO 158 CO 0.53 -3.33 2.10 -0.91 -0.33 0.00 0.00 177.00 175.06 1x3u h ASN 159 N -2.36 0.00 0.00 2.53 4.21 -1.96 -2.28 115.58 115.72 1x3u h ASN 159 Ca -0.54 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 56.96 1x3u h ASN 159 Cb 1.31 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.51 1x3u h ASN 159 CO 0.46 0.10 -0.11 0.50 -1.29 0.00 0.00 177.43 177.09 1x3u h LYS 160 N 0.00 0.00 -0.93 0.81 1.63 -1.90 -2.99 116.57 113.20 1x3u h LYS 160 Ca -0.00 0.00 0.22 0.00 -0.85 0.00 0.00 60.65 60.02 1x3u h LYS 160 Cb 0.28 0.00 -0.12 0.00 -0.60 0.00 0.00 32.23 31.79 1x3u h LYS 160 CO 0.01 0.34 0.46 1.03 -3.45 0.00 0.00 179.45 177.85 1x3u h SER 161 N -1.00 0.46 0.89 4.20 0.87 -1.90 0.64 113.55 117.72 1x3u h SER 161 Ca -0.02 0.14 -0.04 0.00 -1.23 0.00 0.00 61.79 60.64 1x3u h SER 161 Cb 0.40 0.09 0.01 0.00 -0.44 0.00 0.00 62.40 62.46 1x3u h SER 161 CO -0.01 0.05 -0.43 0.40 -0.53 0.00 0.00 176.83 176.31 1x3u h ILE 162 N 0.48 0.00 -0.97 2.23 2.04 -1.54 1.19 117.51 120.94 1x3u h ILE 162 Ca 0.58 -0.05 0.09 0.00 1.00 0.00 0.00 64.86 66.48 1x3u h ILE 162 Cb 1.08 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 37.09 1x3u h ILE 162 CO -0.50 0.00 0.62 0.00 0.00 0.00 0.00 178.15 178.27 1x3u h ALA 163 N -1.40 1.52 0.00 1.87 0.00 -1.13 -0.64 119.26 119.48 1x3u h ALA 163 Ca -0.12 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1x3u h ALA 163 Cb 0.92 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1x3u h ALA 163 CO 0.20 0.29 -0.20 1.88 0.00 0.00 0.00 179.25 181.43 1x3u h TYR 164 N 1.03 0.00 -0.00 0.00 -1.99 0.38 1.23 116.97 117.62 1x3u h TYR 164 Ca 0.45 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.18 1x3u h TYR 164 Cb 0.35 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.08 1x3u h TYR 164 CO -0.00 0.00 -0.17 -3.47 -0.00 0.00 0.00 178.16 174.51 1x3u n ASP 165 N -2.87 0.19 -1.13 3.88 2.03 0.41 -3.72 116.55 115.33 1x3u n ASP 165 Ca 0.03 0.19 -0.00 0.00 0.52 0.00 0.00 54.79 55.54 1x3u n ASP 165 Cb 0.52 -0.23 0.14 0.00 -0.72 0.00 0.00 41.12 40.83 1x3u n ASP 165 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1x3u n LEU 166 N -1.48 2.81 -3.10 -2.67 4.77 -0.87 -4.93 117.00 111.54 1x3u n LEU 166 Ca 0.07 -3.72 -0.21 0.00 -0.03 0.00 0.00 56.01 52.12 1x3u n LEU 166 Cb 0.33 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1x3u n LEU 166 CO 0.30 1.38 -0.06 -0.67 -1.33 0.00 0.00 177.39 177.01 1x3u n ASP 167 N -0.76 -4.15 -4.75 -1.43 2.03 -1.24 -4.92 116.55 101.34 1x3u n ASP 167 Ca 0.21 -0.24 -0.27 0.00 0.52 0.00 0.00 54.79 55.01 1x3u n ASP 167 Cb 0.82 -3.43 -0.07 0.00 -0.72 0.00 0.00 41.12 37.72 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 -2.90 1.97 -0.04 5.18 -1.09 0.42 -5.02 121.20 119.73 1x3u s ILE 168 Ca 0.29 -1.77 -0.01 0.00 -2.23 0.00 0.00 60.65 56.94 1x3u s ILE 168 Cb -0.15 -2.74 -0.04 0.00 -1.58 0.00 0.00 42.46 37.95 1x3u s ILE 168 CO 0.36 0.00 0.02 -0.94 -1.23 0.00 0.00 174.94 173.15 1x3u s SER 169 N -3.92 5.33 0.56 3.58 1.04 -1.23 -3.46 113.70 115.59 1x3u s SER 169 Ca 0.33 0.10 0.25 0.00 0.48 0.00 0.00 55.95 57.11 1x3u s SER 169 Cb 0.04 -1.48 1.53 0.00 0.10 0.00 0.00 66.02 66.20 1x3u s SER 169 CO 0.18 0.32 2.11 1.55 0.98 0.00 0.00 173.24 178.39 1x3u h PRO 170 N 4.63 0.00 0.00 4.02 0.13 -1.85 0.59 132.00 139.52 1x3u h PRO 170 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1x3u h PRO 170 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1x3u h PRO 170 CO 0.57 0.00 -0.24 0.07 -0.23 0.00 0.00 178.00 178.17 1x3u h ARG 171 N 0.00 0.00 0.06 0.86 0.11 -1.95 -3.16 114.38 110.31 1x3u h ARG 171 Ca 0.09 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.97 1x3u h ARG 171 Cb 0.41 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.51 1x3u h ARG 171 CO -0.00 0.00 -0.80 1.15 0.10 0.00 0.00 179.97 180.42 1x3u h THR 172 N 0.00 1.42 -0.17 0.08 2.02 -0.25 -3.04 112.91 112.98 1x3u h THR 172 Ca 0.00 -2.28 -0.03 0.00 0.77 0.00 0.00 66.41 64.86 1x3u h THR 172 Cb 0.95 2.77 -0.01 0.00 -1.74 0.00 0.00 68.15 70.12 1x3u h THR 172 CO 0.00 0.67 -0.05 -0.37 0.37 0.00 0.00 175.52 176.14 1x3u h VAL 173 N -0.09 1.14 -0.73 3.16 -1.51 -1.35 0.86 116.25 117.74 1x3u h VAL 173 Ca -0.12 -0.58 0.02 0.00 -1.23 0.00 0.00 66.70 64.80 1x3u h VAL 173 Cb 1.53 1.08 -0.04 0.00 -2.13 0.00 0.00 31.29 31.73 1x3u h VAL 173 CO 0.15 0.19 0.47 -0.33 -1.23 0.00 0.00 177.57 176.82 1x3u h GLU 174 N 0.24 0.90 0.27 5.19 4.39 -1.54 1.13 114.58 125.16 1x3u h GLU 174 Ca 0.05 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1x3u h GLU 174 Cb 0.25 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 1x3u h GLU 174 CO 0.01 0.60 -0.13 0.28 -1.16 0.00 0.00 179.01 178.61 1x3u h VAL 175 N 0.93 0.39 -0.00 3.13 2.07 -1.04 -3.05 116.25 118.68 1x3u h VAL 175 Ca 0.28 -0.87 0.01 0.00 0.82 0.00 0.00 66.70 66.94 1x3u h VAL 175 Cb -0.03 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 1x3u h VAL 175 CO -0.09 0.10 -0.22 0.45 0.02 0.00 0.00 177.57 177.83 1x3u h HIS 176 N -1.01 -0.66 -0.71 1.57 3.86 0.86 -0.20 115.15 118.86 1x3u h HIS 176 Ca -0.04 0.02 0.07 0.00 -1.16 0.00 0.00 60.37 59.26 1x3u h HIS 176 Cb 0.44 0.29 -0.09 0.00 1.06 0.00 0.00 27.41 29.11 1x3u h HIS 176 CO 0.04 -0.24 -0.45 -0.09 0.86 0.00 0.00 177.93 178.05 1x3u h ARG 177 N -0.28 -0.04 -0.44 2.45 2.43 0.12 1.69 114.38 120.31 1x3u h ARG 177 Ca 0.01 0.00 0.13 0.00 -0.81 0.00 0.00 59.98 59.31 1x3u h ARG 177 Cb 0.30 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 1x3u h ARG 177 CO -0.15 -0.03 0.43 0.00 -1.51 0.00 0.00 179.97 178.71 1x3u h ALA 178 N 0.09 2.19 0.05 2.80 0.00 -1.40 0.83 119.26 123.82 1x3u h ALA 178 Ca 0.11 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 1x3u h ALA 178 Cb 0.34 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1x3u h ALA 178 CO -0.69 -0.65 -0.52 -0.97 0.00 0.00 0.00 179.25 176.42 1x3u h ASN 179 N 0.00 0.17 -0.34 0.00 -0.73 0.35 -2.78 115.58 112.25 1x3u h ASN 179 Ca 0.21 -0.91 -0.04 0.00 1.87 0.00 0.00 56.30 57.43 1x3u h ASN 179 Cb 1.06 -0.05 -0.01 0.00 0.27 0.00 0.00 38.32 39.58 1x3u h ASN 179 CO -0.00 1.23 0.06 0.58 -0.37 0.00 0.00 177.43 178.93 1x3u h VAL 180 N -0.76 1.23 -0.55 2.57 2.07 0.34 0.75 116.25 121.90 1x3u h VAL 180 Ca -0.11 -0.80 -0.03 0.00 0.82 0.00 0.00 66.70 66.59 1x3u h VAL 180 Cb 1.29 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 32.14 1x3u h VAL 180 CO 0.02 0.27 0.23 0.24 0.02 0.00 0.00 177.57 178.35 1x3u h MET 181 N 0.39 0.78 0.02 1.57 2.86 0.46 -1.47 114.93 119.54 1x3u h MET 181 Ca 0.10 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1x3u h MET 181 Cb 0.33 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.85 1x3u h MET 181 CO 0.00 0.63 -0.01 0.00 1.06 0.00 0.00 176.91 178.60 1x3u h ALA 182 N 1.48 -0.02 -0.48 6.32 0.00 -1.18 -2.41 119.26 122.96 1x3u h ALA 182 Ca 0.19 -0.38 0.10 0.00 0.00 0.00 0.00 54.91 54.82 1x3u h ALA 182 Cb 0.13 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.85 1x3u h ALA 182 CO -0.02 -0.10 -0.07 0.87 0.00 0.00 0.00 179.25 179.93 1x3u h LYS 183 N -0.85 0.05 0.00 0.00 1.57 0.60 0.48 116.57 118.41 1x3u h LYS 183 Ca -0.00 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1x3u h LYS 183 Cb 0.76 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.06 1x3u h LYS 183 CO 0.00 0.03 -0.03 0.52 -0.57 0.00 0.00 179.45 179.41 1x3u h MET 184 N 0.05 0.00 -0.28 3.15 2.86 -1.38 -3.46 114.93 115.87 1x3u h MET 184 Ca 0.24 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.77 1x3u h MET 184 Cb 0.36 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.99 1x3u h MET 184 CO -0.46 0.03 -0.10 1.63 1.06 0.00 0.00 176.91 179.07 1x3u n LYS 185 N -3.49 -0.36 0.00 1.72 5.02 0.17 -4.89 118.16 116.33 1x3u n LYS 185 Ca -0.02 0.65 0.00 0.00 -2.02 0.00 0.00 58.31 56.91 1x3u n LYS 185 Cb 0.13 -4.37 0.00 0.00 -0.02 0.00 0.00 35.03 30.77 1x3u n LYS 185 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1x3u n ALA 186 N 0.93 0.00 0.00 7.82 0.00 -0.92 -4.33 120.51 124.01 1x3u n ALA 186 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1x3u n ALA 186 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.65 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 -0.19 0.00 -4.11 0.00 -0.00 -1.26 -4.93 118.16 107.67 1x3u n LYS 187 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.18 1x3u n LYS 187 Cb 0.00 -0.65 -0.06 0.00 -0.00 0.00 0.00 35.03 34.31 1x3u n LYS 187 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1x3u s SER 188 N -4.09 0.48 0.10 -5.58 0.15 -1.26 -5.04 113.70 98.46 1x3u s SER 188 Ca 0.00 -1.32 -0.33 0.00 0.70 0.00 0.00 55.95 54.99 1x3u s SER 188 Cb 0.00 0.55 -0.14 0.00 -1.71 0.00 0.00 66.02 64.73 1x3u s SER 188 CO 0.00 -1.11 1.58 -0.07 1.20 0.00 0.00 173.24 174.84 1x3u h LEU 189 N 2.29 -1.33 -0.86 3.45 3.38 -2.00 -2.16 115.31 118.08 1x3u h LEU 189 Ca -0.29 0.13 0.22 0.00 0.09 0.00 0.00 57.88 58.03 1x3u h LEU 189 Cb 1.24 0.47 -0.15 0.00 0.09 0.00 0.00 40.66 42.32 1x3u h LEU 189 CO 0.41 -0.57 0.14 -0.65 0.09 0.00 0.00 178.44 177.86 1x3u h PRO 190 N -0.81 0.14 -0.24 1.13 0.11 -1.98 -0.70 132.00 129.65 1x3u h PRO 190 Ca -0.02 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.14 1x3u h PRO 190 Cb 0.76 -0.03 -0.08 0.00 0.11 0.00 0.00 31.00 31.77 1x3u h PRO 190 CO -0.17 0.09 -0.40 1.25 -0.21 0.00 0.00 178.00 178.56 1x3u h HIS 191 N 0.14 -1.16 0.00 0.65 2.76 -1.80 0.50 115.15 116.25 1x3u h HIS 191 Ca 0.52 0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.74 1x3u h HIS 191 Cb 1.02 0.54 0.00 0.00 1.55 0.00 0.00 27.41 30.53 1x3u h HIS 191 CO -0.35 -0.45 0.00 1.28 -1.30 0.00 0.00 177.93 177.11 1x3u n LEU 192 N -5.42 0.00 -0.26 0.26 4.77 -0.29 0.10 117.00 116.15 1x3u n LEU 192 Ca -0.02 0.99 -0.01 0.00 -0.03 0.00 0.00 56.01 56.94 1x3u n LEU 192 Cb 0.35 -0.49 0.06 0.00 -2.33 0.00 0.00 43.42 41.01 1x3u n LEU 192 CO 0.10 -0.49 0.66 0.58 -1.33 0.00 0.00 177.39 176.91 1x3u h VAL 193 N 0.00 0.17 -0.27 4.08 2.07 -1.33 1.51 116.25 122.48 1x3u h VAL 193 Ca 0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 1x3u h VAL 193 Cb 0.00 0.17 -0.05 0.00 -1.52 0.00 0.00 31.29 29.89 1x3u h VAL 193 CO 0.00 0.00 -0.02 0.03 0.02 0.00 0.00 177.57 177.60 1x3u h ARG 194 N -0.06 0.05 0.00 1.57 3.08 0.49 0.73 114.38 120.24 1x3u h ARG 194 Ca 0.32 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.36 1x3u h ARG 194 Cb 0.57 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.61 1x3u h ARG 194 CO -0.79 0.03 -0.05 0.52 -1.07 0.00 0.00 179.97 178.62 1x3u h MET 195 N 0.05 0.00 0.08 0.04 2.86 0.40 0.61 114.93 118.97 1x3u h MET 195 Ca 0.13 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.77 1x3u h MET 195 Cb 0.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.84 1x3u h MET 195 CO -0.24 0.05 -0.04 0.00 1.06 0.00 0.00 176.91 177.74 1x3u h ALA 196 N 1.95 -0.11 -0.25 6.32 0.00 0.65 -2.05 119.26 125.78 1x3u h ALA 196 Ca -0.00 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 1x3u h ALA 196 Cb 0.37 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1x3u h ALA 196 CO 0.01 -0.22 -0.23 -0.07 0.00 0.00 0.00 179.25 178.74 1x3u h LEU 197 N -0.80 0.63 -1.98 0.00 3.38 0.47 1.44 115.31 118.44 1x3u h LEU 197 Ca -0.01 -0.47 0.20 0.00 0.09 0.00 0.00 57.88 57.69 1x3u h LEU 197 Cb 0.59 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1x3u h LEU 197 CO 0.02 0.96 0.54 0.00 0.09 0.00 0.00 178.44 180.06 1x3u h ALA 198 N 0.68 2.59 -3.00 1.53 0.00 0.12 -3.33 119.26 117.85 1x3u h ALA 198 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1x3u h ALA 198 Cb 0.78 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1x3u h ALA 198 CO 0.06 -0.90 0.00 0.41 0.00 0.00 0.00 179.25 178.82 1x3u n GLY 199 N -1.64 -0.28 0.00 0.00 0.00 -0.77 -4.73 105.19 97.77 1x3u n GLY 199 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 2.71 0.00 2.17 -0.02 0.00 0.18 -4.86 105.19 105.37 1x3u n GLY 200 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1x3u n GLY 200 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1x3u n PHE 201 N -0.31 0.58 -4.68 1.61 3.01 0.44 -4.85 117.46 113.25 1x3u n PHE 201 Ca 0.00 -1.66 -0.33 0.00 1.01 0.00 0.00 57.45 56.47 1x3u n PHE 201 Cb 0.00 -1.51 -0.12 0.00 -0.01 0.00 0.00 39.48 37.84 1x3u n PHE 201 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1x3u s GLY 202 N 1.40 1.64 1.14 1.37 0.00 -1.22 -3.32 107.32 108.33 1x3u s GLY 202 Ca 0.63 -0.90 -0.18 0.00 0.00 0.00 0.00 44.72 44.27 1x3u s GLY 202 CO -0.08 -0.58 0.22 -1.05 0.00 0.00 0.00 173.10 171.61 1x3u n PRO 203 N 2.52 -2.13 0.00 2.90 -0.02 -1.26 -4.95 135.00 132.06 1x3u n PRO 203 Ca -0.18 -0.61 0.13 0.00 -2.02 0.00 0.00 63.50 60.82 1x3u n PRO 203 Cb 0.53 -1.71 0.35 0.00 -0.02 0.00 0.00 33.50 32.64 1x3u n PRO 203 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91