#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jun h GLU 115 N 0.00 -0.20 -6.19 0.00 4.81 -2.08 -3.47 114.58 107.46 2jun h GLU 115 Ca 0.00 0.01 -0.48 0.00 -0.13 0.00 0.00 59.36 58.77 2jun h GLU 115 Cb 0.00 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 2jun h GLU 115 CO 0.00 -0.13 -0.46 0.15 -0.73 0.00 0.00 179.01 177.83 2jun s LYS 116 N -2.21 3.27 -0.01 1.92 1.02 -1.26 -5.05 119.74 117.43 2jun s LYS 116 Ca -0.03 -0.85 -0.24 0.00 0.02 0.00 0.00 55.97 54.86 2jun s LYS 116 Cb 0.00 -2.78 -0.05 0.00 -0.52 0.00 0.00 37.83 34.49 2jun s LYS 116 CO 0.09 0.42 0.74 0.54 -0.92 0.00 0.00 175.35 176.22 2jun s VAL 117 N -2.02 4.89 0.21 3.17 0.11 -1.26 -5.06 120.40 120.44 2jun s VAL 117 Ca 0.34 1.55 -0.16 0.00 -2.93 0.00 0.00 61.98 60.78 2jun s VAL 117 Cb -0.09 -4.08 -0.08 0.00 -1.53 0.00 0.00 36.38 30.60 2jun s VAL 117 CO 0.28 0.31 0.64 -0.76 -3.33 0.00 0.00 175.10 172.24 2jun s LEU 118 N 0.36 4.28 -0.43 2.54 1.43 -1.26 -2.67 118.68 122.92 2jun s LEU 118 Ca 0.38 1.22 -0.29 0.00 -1.03 0.00 0.00 54.13 54.41 2jun s LEU 118 Cb -0.19 -3.56 -0.09 0.00 0.03 0.00 0.00 46.19 42.38 2jun s LEU 118 CO 0.21 0.01 2.34 0.00 0.23 0.00 0.00 176.35 179.13 2jun h GLN 120 N 15.79 0.00 -0.99 0.00 4.15 -1.87 -2.51 115.11 129.68 2jun h GLN 120 Ca -0.28 0.00 -0.67 0.00 0.77 0.00 0.00 58.65 58.47 2jun h GLN 120 Cb 1.28 0.00 -0.29 0.00 0.21 0.00 0.00 27.48 28.67 2jun h GLN 120 CO 1.09 0.12 0.83 1.19 -1.93 0.00 0.00 178.83 180.13 2jun n PHE 121 N -3.69 3.22 -4.90 3.99 3.01 -1.26 -4.93 117.46 112.90 2jun n PHE 121 Ca -0.02 -2.98 -0.33 0.00 1.01 0.00 0.00 57.45 55.14 2jun n PHE 121 Cb 0.23 -1.41 -0.14 0.00 -0.01 0.00 0.00 39.48 38.15 2jun n PHE 121 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2jun n ASP 123 N 2.90 3.08 -0.05 0.00 -0.08 -1.26 -4.83 116.55 116.31 2jun n ASP 123 Ca -0.18 -3.09 -0.22 0.00 -1.51 0.00 0.00 54.79 49.79 2jun n ASP 123 Cb 0.52 -0.47 -0.13 0.00 2.34 0.00 0.00 41.12 43.39 2jun n ASP 123 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 2jun h GLN 124 N 2.68 0.14 -4.78 -0.67 4.20 -1.95 -3.50 115.11 111.23 2jun h GLN 124 Ca 0.10 -0.23 0.00 0.00 0.06 0.00 0.00 58.65 58.58 2jun h GLN 124 Cb 1.16 0.09 0.00 0.00 0.30 0.00 0.00 27.48 29.03 2jun h GLN 124 CO 0.61 1.11 -0.68 -3.47 -0.67 0.00 0.00 178.83 175.72 2jun n ASP 125 N -4.00 -6.91 -4.77 1.46 2.03 -1.26 -4.80 116.55 98.30 2jun n ASP 125 Ca -0.31 0.94 -0.31 0.00 0.52 0.00 0.00 54.79 55.63 2jun n ASP 125 Cb 0.85 -4.56 0.09 0.00 -0.72 0.00 0.00 41.12 36.78 2jun n ASP 125 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2jun s PRO 126 N -1.64 2.30 1.00 -0.67 0.04 -1.26 -5.17 135.00 129.61 2jun s PRO 126 Ca 0.06 1.19 -0.17 0.00 0.04 0.00 0.00 61.00 62.13 2jun s PRO 126 Cb -0.02 -1.90 0.23 0.00 0.04 0.00 0.00 34.50 32.85 2jun s PRO 126 CO 0.64 -1.61 1.36 0.00 0.04 0.00 0.00 177.00 177.42 2jun s ALA 127 N -2.85 2.10 0.56 8.56 0.00 -1.26 -4.96 121.76 123.92 2jun s ALA 127 Ca 0.62 -1.33 0.07 0.00 0.00 0.00 0.00 51.96 51.31 2jun s ALA 127 Cb -0.17 -2.73 0.07 0.00 0.00 0.00 0.00 23.12 20.28 2jun s ALA 127 CO 0.55 -2.65 0.58 0.94 0.00 0.00 0.00 175.76 175.18 2jun n GLN 128 N -3.90 0.65 -4.88 0.00 7.27 -1.26 -4.95 117.38 110.32 2jun n GLN 128 Ca 0.17 -3.28 -0.33 0.00 0.07 0.00 0.00 57.00 53.64 2jun n GLN 128 Cb 0.59 0.10 -0.13 0.00 2.41 0.00 0.00 30.24 33.21 2jun n GLN 128 CO 0.00 0.00 0.00 0.16 0.07 0.00 0.00 177.06 177.29 2jun s ASP 129 N -4.36 4.03 0.00 1.69 -4.77 -1.26 -0.42 116.67 111.58 2jun s ASP 129 Ca 0.44 -0.21 -0.30 0.00 -3.30 0.00 0.00 52.55 49.18 2jun s ASP 129 Cb -0.03 -0.93 -0.06 0.00 -1.09 0.00 0.00 42.92 40.81 2jun s ASP 129 CO 0.28 0.33 1.44 0.00 0.70 0.00 0.00 175.17 177.92 2jun s ALA 130 N -0.62 3.60 -0.10 2.11 0.00 -1.09 -4.49 121.76 121.17 2jun s ALA 130 Ca 0.09 0.92 0.07 0.00 0.00 0.00 0.00 51.96 53.04 2jun s ALA 130 Cb -0.11 -3.62 -0.11 0.00 0.00 0.00 0.00 23.12 19.28 2jun s ALA 130 CO 0.01 -0.97 -0.01 1.55 0.00 0.00 0.00 175.76 176.35 2jun n VAL 131 N 4.72 0.68 -4.60 0.00 3.14 -1.13 -4.67 118.33 116.48 2jun n VAL 131 Ca 0.14 -0.38 -0.27 0.00 -2.96 0.00 0.00 64.34 60.87 2jun n VAL 131 Cb 0.43 -0.80 -0.11 0.00 -1.06 0.00 0.00 33.84 32.31 2jun n VAL 131 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 2jun s LYS 132 N -2.24 1.92 -0.14 1.45 1.02 -1.09 -4.37 119.74 116.29 2jun s LYS 132 Ca -0.08 -2.10 -0.07 0.00 0.02 0.00 0.00 55.97 53.74 2jun s LYS 132 Cb 0.03 -1.47 0.05 0.00 -0.52 0.00 0.00 37.83 35.93 2jun s LYS 132 CO 0.37 -0.11 0.32 0.99 -0.92 0.00 0.00 175.35 176.01 2jun s THR 133 N -2.84 -0.04 -0.12 2.17 2.01 -1.26 -2.19 115.64 113.37 2jun s THR 133 Ca 0.33 0.12 -0.13 0.00 0.31 0.00 0.00 61.69 62.33 2jun s THR 133 Cb 0.09 -0.49 -0.05 0.00 0.01 0.00 0.00 72.50 72.06 2jun s THR 133 CO 0.16 0.05 0.28 0.00 -0.69 0.00 0.00 174.62 174.43 2jun h VAL 135 N 4.34 1.40 -0.05 0.00 2.07 -1.66 -1.25 116.25 121.09 2jun h VAL 135 Ca -0.46 -1.64 0.01 0.00 0.82 0.00 0.00 66.70 65.43 2jun h VAL 135 Cb 1.19 2.45 -0.00 0.00 -1.52 0.00 0.00 31.29 33.41 2jun h VAL 135 CO 0.69 0.40 0.14 0.74 0.02 0.00 0.00 177.57 179.56 2jun h THR 136 N -0.80 0.17 0.00 2.57 2.02 -1.93 0.26 112.91 115.20 2jun h THR 136 Ca -0.00 0.00 -0.24 0.00 0.77 0.00 0.00 66.41 66.93 2jun h THR 136 Cb 0.69 0.87 -0.04 0.00 -1.74 0.00 0.00 68.15 67.93 2jun h THR 136 CO 0.01 0.00 -1.71 0.00 0.37 0.00 0.00 175.52 174.18 2jun n GLU 138 N -2.90 -3.04 -3.74 0.00 2.13 0.91 -5.00 120.64 109.00 2jun n GLU 138 Ca -0.16 0.70 -0.14 0.00 0.66 0.00 0.00 57.16 58.22 2jun n GLU 138 Cb 0.97 -5.07 -0.08 0.00 0.27 0.00 0.00 31.44 27.52 2jun n GLU 138 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2jun s VAL 139 N -2.95 0.05 -0.26 6.31 1.01 -1.13 -5.06 120.40 118.37 2jun s VAL 139 Ca 0.17 -0.45 -0.10 0.00 0.00 0.00 0.00 61.98 61.60 2jun s VAL 139 Cb -0.07 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 2jun s VAL 139 CO 0.21 -0.25 0.14 -0.55 0.00 0.00 0.00 175.10 174.65 2jun s SER 140 N -1.38 5.71 0.46 3.32 0.15 -1.26 -2.57 113.70 118.13 2jun s SER 140 Ca -0.13 -0.07 0.03 0.00 0.70 0.00 0.00 55.95 56.48 2jun s SER 140 Cb -0.04 -2.05 -0.01 0.00 -1.71 0.00 0.00 66.02 62.21 2jun s SER 140 CO 0.04 -0.03 0.10 -1.22 1.20 0.00 0.00 173.24 173.33 2jun n TYR 141 N 4.92 0.49 -2.93 3.44 4.01 -0.93 -4.64 117.16 121.52 2jun n TYR 141 Ca -0.15 -2.67 -0.19 0.00 -0.16 0.00 0.00 57.90 54.73 2jun n TYR 141 Cb 0.52 -0.12 0.04 0.00 -0.31 0.00 0.00 39.34 39.48 2jun n TYR 141 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2jun h ASP 143 N 0.26 0.60 0.06 0.00 3.58 -1.93 0.14 116.42 119.13 2jun h ASP 143 Ca -0.36 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.09 2jun h ASP 143 Cb 1.28 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 42.19 2jun h ASP 143 CO 0.44 0.43 -0.13 -0.08 -2.88 0.00 0.00 179.24 177.01 2jun h GLU 144 N 0.72 -0.20 -0.47 0.28 4.81 -1.95 0.15 114.58 117.92 2jun h GLU 144 Ca 0.22 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.54 2jun h GLU 144 Cb -0.03 0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.33 2jun h GLU 144 CO -0.08 -0.14 0.08 0.00 -0.73 0.00 0.00 179.01 178.15 2jun h LEU 146 N 0.21 0.13 -0.22 0.00 5.85 -0.29 0.34 115.31 121.33 2jun h LEU 146 Ca 0.23 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.91 2jun h LEU 146 Cb 0.31 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.34 2jun h LEU 146 CO -0.31 0.02 -0.14 0.50 -0.34 0.00 0.00 178.44 178.16 2jun h LYS 147 N 0.11 0.48 -0.10 1.25 3.64 0.22 0.74 116.57 122.91 2jun h LYS 147 Ca 0.58 -0.23 -0.05 0.00 -1.27 0.00 0.00 60.65 59.68 2jun h LYS 147 Cb 2.08 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.89 2jun h LYS 147 CO -0.10 0.78 -0.15 0.00 -2.27 0.00 0.00 179.45 177.71 2jun h ALA 148 N 0.69 0.15 -0.50 5.00 0.00 -0.33 -3.27 119.26 120.99 2jun h ALA 148 Ca 0.04 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 2jun h ALA 148 Cb 0.66 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2jun h ALA 148 CO 0.04 0.04 0.18 1.79 0.00 0.00 0.00 179.25 181.30 2jun h THR 149 N -0.17 1.22 -3.61 0.00 1.35 -0.75 -3.36 112.91 107.60 2jun h THR 149 Ca 0.01 -0.72 -0.73 0.00 -0.55 0.00 0.00 66.41 64.42 2jun h THR 149 Cb 0.71 0.75 -0.31 0.00 -1.73 0.00 0.00 68.15 67.57 2jun h THR 149 CO 0.03 0.27 -0.20 -1.00 -0.25 0.00 0.00 175.52 174.37 2jun s HIS 150 N -5.47 3.54 0.09 4.73 3.76 0.25 -5.07 115.29 117.11 2jun s HIS 150 Ca -0.13 -2.33 -0.02 0.00 -0.15 0.00 0.00 55.06 52.43 2jun s HIS 150 Cb 0.11 -3.47 0.02 0.00 1.11 0.00 0.00 32.58 30.36 2jun s HIS 150 CO 0.78 -0.92 0.08 -0.35 -0.85 0.00 0.00 174.74 173.48 2jun n PRO 151 N 3.86 -1.19 -0.91 8.40 -0.04 -1.24 -4.56 135.00 139.31 2jun n PRO 151 Ca 0.08 -0.13 0.12 0.00 -0.04 0.00 0.00 63.50 63.53 2jun n PRO 151 Cb 0.42 -0.12 -0.03 0.00 -0.04 0.00 0.00 33.50 33.72 2jun n PRO 151 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2jun n ASN 152 N -3.14 -7.48 0.00 3.54 4.05 -1.26 -4.51 115.26 106.46 2jun n ASN 152 Ca 0.01 0.98 0.00 0.00 0.45 0.00 0.00 54.58 56.02 2jun n ASN 152 Cb 0.04 -2.76 0.00 0.00 1.23 0.00 0.00 39.78 38.30 2jun n ASN 152 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 177.26 175.38 2jun n LYS 153 N -3.38 0.20 0.00 1.20 4.81 -1.26 -4.91 118.16 114.82 2jun n LYS 153 Ca 0.01 -0.41 0.00 0.00 -0.87 0.00 0.00 58.31 57.04 2jun n LYS 153 Cb 0.42 -0.57 0.00 0.00 0.02 0.00 0.00 35.03 34.89 2jun n LYS 153 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 2jun n LYS 154 N -0.04 0.00 -0.07 1.64 2.85 -1.26 -4.79 118.16 116.48 2jun n LYS 154 Ca 0.00 0.00 -0.11 0.00 -1.05 0.00 0.00 58.31 57.15 2jun n LYS 154 Cb 0.36 0.00 0.02 0.00 -0.65 0.00 0.00 35.03 34.76 2jun n LYS 154 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 177.40 176.35 2jun h PRO 155 N 0.00 0.79 -0.06 -1.58 0.13 -1.99 -3.40 132.00 125.90 2jun h PRO 155 Ca 0.00 -0.42 -0.18 0.00 -0.87 0.00 0.00 66.00 64.53 2jun h PRO 155 Cb 0.00 0.02 -0.18 0.00 0.13 0.00 0.00 31.00 30.96 2jun h PRO 155 CO 0.00 1.05 -0.38 1.19 -0.23 0.00 0.00 178.00 179.63 2jun n PHE 156 N -4.04 -1.63 -1.80 1.56 3.72 -1.26 -4.97 117.46 109.04 2jun n PHE 156 Ca -0.02 -1.78 -0.12 0.00 -0.05 0.00 0.00 57.45 55.48 2jun n PHE 156 Cb 0.54 1.33 -0.03 0.00 -0.94 0.00 0.00 39.48 40.38 2jun n PHE 156 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2jun n THR 157 N -1.43 -0.24 -1.88 4.37 -2.24 -1.26 -0.98 114.28 110.62 2jun n THR 157 Ca -0.15 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.51 2jun n THR 157 Cb 0.87 -1.42 -0.03 0.00 -2.10 0.00 0.00 70.33 67.64 2jun n THR 157 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jun n GLY 158 N -0.47 0.37 3.30 3.38 0.00 -1.26 -4.88 105.19 105.64 2jun n GLY 158 Ca -0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 2jun n GLY 158 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2jun s HIS 159 N -2.32 2.14 -0.12 1.61 3.76 -0.15 -5.13 115.29 115.07 2jun s HIS 159 Ca 0.00 -0.40 -0.07 0.00 -0.15 0.00 0.00 55.06 54.44 2jun s HIS 159 Cb 0.00 -1.32 -0.04 0.00 1.11 0.00 0.00 32.58 32.33 2jun s HIS 159 CO 0.00 0.05 0.13 1.03 -0.85 0.00 0.00 174.74 175.10 2jun s ARG 160 N -0.94 3.45 0.00 1.40 0.52 -1.26 -4.91 118.95 117.21 2jun s ARG 160 Ca 0.10 -0.15 0.00 0.00 -0.52 0.00 0.00 55.73 55.16 2jun s ARG 160 Cb -0.09 -3.18 0.00 0.00 0.52 0.00 0.00 34.95 32.20 2jun s ARG 160 CO 0.01 0.75 0.00 1.28 0.02 0.00 0.00 175.30 177.36 2jun n LEU 161 N 2.07 0.00 -4.16 2.53 4.32 -1.26 -1.81 117.00 118.70 2jun n LEU 161 Ca -0.20 0.00 -0.38 0.00 -0.02 0.00 0.00 56.01 55.41 2jun n LEU 161 Cb 0.55 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.24 2jun n LEU 161 CO 0.31 0.00 -0.11 -0.63 -1.22 0.00 0.00 177.39 175.74 2jun s ILE 162 N -2.09 3.65 -0.71 -0.08 1.09 -1.23 -4.74 121.20 117.09 2jun s ILE 162 Ca 0.00 -1.94 -0.01 0.00 -1.10 0.00 0.00 60.65 57.60 2jun s ILE 162 Cb 0.00 -3.45 -0.01 0.00 -1.06 0.00 0.00 42.46 37.94 2jun s ILE 162 CO 0.00 -0.72 0.66 -0.62 -0.10 0.00 0.00 174.94 174.17 2jun n GLU 163 N 4.72 -1.32 0.21 2.79 -0.58 -1.26 -4.81 120.64 120.39 2jun n GLU 163 Ca -0.05 1.33 0.15 0.00 -0.42 0.00 0.00 57.16 58.17 2jun n GLU 163 Cb 0.41 -5.40 0.61 0.00 -0.57 0.00 0.00 31.44 26.49 2jun n GLU 163 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2jun h PRO 164 N 0.23 0.00 -2.22 3.49 0.13 -1.96 -3.33 132.00 128.34 2jun h PRO 164 Ca -0.07 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.48 2jun h PRO 164 Cb 1.04 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.77 2jun h PRO 164 CO 0.29 0.00 -0.93 0.44 -0.23 0.00 0.00 178.00 177.57 2jun n ILE 165 N -2.67 -0.05 0.22 -3.56 -5.35 -1.26 -4.93 119.36 101.76 2jun n ILE 165 Ca 0.01 -4.17 0.09 0.00 -0.27 0.00 0.00 62.75 58.41 2jun n ILE 165 Cb 0.26 -1.93 0.49 0.00 -1.74 0.00 0.00 39.64 36.72 2jun n ILE 165 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 2jun h PRO 166 N 4.56 0.00 -6.46 6.28 0.13 -1.96 -3.44 132.00 131.11 2jun h PRO 166 Ca 0.15 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.74 2jun h PRO 166 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 2jun h PRO 166 CO 0.53 0.24 0.63 0.16 -0.23 0.00 0.00 178.00 179.33 2jun s ASP 167 N -6.28 7.02 0.22 1.44 -4.77 -1.26 -4.73 116.67 108.31 2jun s ASP 167 Ca -0.01 2.04 0.01 0.00 -3.30 0.00 0.00 52.55 51.30 2jun s ASP 167 Cb 0.11 -2.58 -0.00 0.00 -1.09 0.00 0.00 42.92 39.37 2jun s ASP 167 CO 0.64 -0.54 0.26 -0.24 0.70 0.00 0.00 175.17 176.00 2jun n SER 168 N 4.25 -0.72 0.00 2.11 2.88 -1.26 -5.09 113.62 115.79 2jun n SER 168 Ca 0.10 -2.28 0.00 0.00 -1.33 0.00 0.00 58.87 55.36 2jun n SER 168 Cb 0.45 1.42 0.00 0.00 -0.75 0.00 0.00 64.21 65.33 2jun n SER 168 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2jun n HIS 169 N -0.38 0.00 0.01 0.66 -0.00 -1.26 -4.89 115.22 109.35 2jun n HIS 169 Ca 0.02 0.00 -0.02 0.00 0.46 0.00 0.00 57.72 58.18 2jun n HIS 169 Cb 0.38 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 30.24 2jun n HIS 169 CO 0.00 0.00 0.00 0.82 0.46 0.00 0.00 176.34 177.62 2jun h ILE 170 N 0.00 0.00 -3.22 3.57 5.03 -2.03 -3.50 117.51 117.37 2jun h ILE 170 Ca 0.00 -0.84 -0.12 0.00 -0.12 0.00 0.00 64.86 63.78 2jun h ILE 170 Cb 0.67 0.00 -0.02 0.00 -3.03 0.00 0.00 36.82 34.44 2jun h ILE 170 CO 0.00 0.00 0.08 -1.14 -0.68 0.00 0.00 178.15 176.41 2jun n ARG 171 N -4.70 0.82 0.00 2.37 3.00 -1.26 -5.17 116.66 111.71 2jun n ARG 171 Ca -0.02 -2.11 0.00 0.00 -0.00 0.00 0.00 57.85 55.72 2jun n ARG 171 Cb 0.05 2.35 0.00 0.00 0.00 0.00 0.00 32.46 34.86 2jun n ARG 171 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2jun n GLY 172 N -0.47 -3.11 3.46 5.14 0.00 -1.26 -4.66 105.19 104.29 2jun n GLY 172 Ca -0.04 -1.25 -0.22 0.00 0.00 0.00 0.00 46.02 44.50 2jun n GLY 172 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jun s LEU 173 N 0.00 2.50 0.41 0.99 1.02 -1.26 -5.00 118.68 117.35 2jun s LEU 173 Ca 0.00 -1.23 0.08 0.00 0.02 0.00 0.00 54.13 53.00 2jun s LEU 173 Cb 0.00 -0.67 -0.03 0.00 0.02 0.00 0.00 46.19 45.51 2jun s LEU 173 CO 0.00 -0.36 0.32 -0.04 0.02 0.00 0.00 176.35 176.28 2jun s MET 174 N -3.73 2.44 1.23 1.70 -1.94 -1.26 -4.34 119.30 113.40 2jun s MET 174 Ca 0.31 -1.63 -0.21 0.00 -1.71 0.00 0.00 55.69 52.46 2jun s MET 174 Cb 0.05 -2.26 0.30 0.00 2.01 0.00 0.00 34.83 34.93 2jun s MET 174 CO 0.13 -0.17 1.13 0.00 -0.01 0.00 0.00 175.02 176.11 2jun h LEU 176 N -2.66 -1.01 -4.82 0.00 5.85 -1.96 -3.37 115.31 107.33 2jun h LEU 176 Ca -0.42 0.04 -0.45 0.00 0.84 0.00 0.00 57.88 57.89 2jun h LEU 176 Cb 1.28 0.27 -0.41 0.00 0.37 0.00 0.00 40.66 42.17 2jun h LEU 176 CO 0.28 -0.69 -1.02 1.21 -0.34 0.00 0.00 178.44 177.88 2jun n GLU 177 N -5.12 2.00 -3.42 1.25 2.13 -1.26 -4.95 120.64 111.25 2jun n GLU 177 Ca -0.14 -3.72 -0.27 0.00 0.66 0.00 0.00 57.16 53.69 2jun n GLU 177 Cb 0.45 -1.62 -0.10 0.00 0.27 0.00 0.00 31.44 30.44 2jun n GLU 177 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 2jun n HIS 178 N -0.22 -0.66 0.08 4.31 8.25 -1.26 -4.95 115.22 120.78 2jun n HIS 178 Ca 0.20 -3.37 -0.11 0.00 -0.26 0.00 0.00 57.72 54.18 2jun n HIS 178 Cb 0.76 0.21 -0.09 0.00 1.12 0.00 0.00 29.99 31.99 2jun n HIS 178 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 2jun h GLU 179 N 5.61 0.16 0.00 -0.41 -0.00 -1.92 -3.20 114.58 114.82 2jun h GLU 179 Ca 0.26 -0.24 -0.03 0.00 -0.00 0.00 0.00 59.36 59.35 2jun h GLU 179 Cb 0.90 0.08 -0.00 0.00 -0.00 0.00 0.00 28.75 29.73 2jun h GLU 179 CO 0.39 1.07 -0.16 0.22 -0.00 0.00 0.00 179.01 180.53 2jun h ASP 180 N 0.06 0.00 -3.29 3.06 3.58 -2.02 -3.40 116.42 114.41 2jun h ASP 180 Ca -0.07 0.00 -0.52 0.00 0.42 0.00 0.00 57.03 56.86 2jun h ASP 180 Cb 1.76 0.00 -0.38 0.00 1.72 0.00 0.00 39.33 42.43 2jun h ASP 180 CO 0.16 0.16 -0.78 -0.70 -2.88 0.00 0.00 179.24 175.19 2jun s GLU 181 N -3.82 1.18 0.81 0.28 -6.30 -1.21 -5.14 118.70 104.51 2jun s GLU 181 Ca -0.01 -0.35 -0.09 0.00 -2.50 0.00 0.00 54.97 52.02 2jun s GLU 181 Cb 0.11 -1.78 0.13 0.00 0.00 0.00 0.00 34.13 32.59 2jun s GLU 181 CO 0.60 -0.42 1.14 0.15 0.02 0.00 0.00 175.26 176.76 2jun s LYS 182 N 1.74 1.48 -0.24 4.30 1.02 -1.26 -4.54 119.74 122.25 2jun s LYS 182 Ca 0.02 -0.46 -0.29 0.00 0.02 0.00 0.00 55.97 55.26 2jun s LYS 182 Cb -0.15 -2.06 0.01 0.00 -0.52 0.00 0.00 37.83 35.11 2jun s LYS 182 CO -0.07 -1.76 1.04 0.14 -0.92 0.00 0.00 175.35 173.78 2jun s VAL 183 N -3.50 4.67 -0.01 3.17 -7.23 -1.26 -4.52 120.40 111.72 2jun s VAL 183 Ca 0.67 2.01 0.08 0.00 -1.81 0.00 0.00 61.98 62.93 2jun s VAL 183 Cb -0.07 -4.32 0.14 0.00 0.56 0.00 0.00 36.38 32.70 2jun s VAL 183 CO 0.48 -0.20 1.06 0.59 -0.31 0.00 0.00 175.10 176.72 2jun n ASN 184 N 6.35 0.44 -3.96 4.85 3.02 -0.61 -4.90 115.26 120.45 2jun n ASN 184 Ca 0.12 -2.10 -0.17 0.00 -0.03 0.00 0.00 54.58 52.39 2jun n ASN 184 Cb 0.46 -0.25 -0.09 0.00 -0.61 0.00 0.00 39.78 39.29 2jun n ASN 184 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2jun s MET 185 N -0.23 1.54 -0.02 3.52 -1.94 0.86 -4.60 119.30 118.43 2jun s MET 185 Ca 0.12 -1.87 -0.01 0.00 -1.71 0.00 0.00 55.69 52.22 2jun s MET 185 Cb 0.13 0.01 0.02 0.00 2.01 0.00 0.00 34.83 37.01 2jun s MET 185 CO -0.05 -0.46 0.05 -0.47 -0.01 0.00 0.00 175.02 174.08 2jun s TYR 186 N -3.69 -0.02 -0.14 -0.03 5.04 -1.26 -1.12 117.35 116.13 2jun s TYR 186 Ca 0.37 0.16 -0.05 0.00 -2.44 0.00 0.00 57.07 55.12 2jun s TYR 186 Cb 0.05 -0.13 -0.04 0.00 0.35 0.00 0.00 41.96 42.20 2jun s TYR 186 CO 0.18 -0.08 0.04 0.00 -1.34 0.00 0.00 175.55 174.35 2jun h VAL 188 N 4.53 1.27 -0.69 0.00 2.07 -1.81 0.25 116.25 121.87 2jun h VAL 188 Ca -0.44 -2.05 0.20 0.00 0.82 0.00 0.00 66.70 65.23 2jun h VAL 188 Cb 1.19 2.50 -0.03 0.00 -1.52 0.00 0.00 31.29 33.43 2jun h VAL 188 CO 0.62 0.43 0.54 0.74 0.02 0.00 0.00 177.57 179.92 2jun h THR 189 N -1.00 0.55 0.00 2.57 2.02 -1.96 -0.11 112.91 114.98 2jun h THR 189 Ca -0.07 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.03 2jun h THR 189 Cb 0.89 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 2jun h THR 189 CO -0.04 0.00 -1.91 0.47 0.37 0.00 0.00 175.52 174.40 2jun n ASP 190 N -4.16 0.85 -2.07 4.18 8.00 -1.25 -4.59 116.55 117.51 2jun n ASP 190 Ca 0.14 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.46 2jun n ASP 190 Cb 0.80 1.59 -0.00 0.00 -0.02 0.00 0.00 41.12 43.49 2jun n ASP 190 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2jun n ASP 191 N -2.26 -5.15 -4.04 -2.24 2.03 0.85 -4.24 116.55 101.50 2jun n ASP 191 Ca -0.10 -0.05 -0.24 0.00 0.52 0.00 0.00 54.79 54.93 2jun n ASP 191 Cb 0.62 -4.20 -0.08 0.00 -0.72 0.00 0.00 41.12 36.74 2jun n ASP 191 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 2jun s GLN 192 N -4.96 1.84 0.17 -0.67 -0.21 -0.92 -4.62 119.66 110.29 2jun s GLN 192 Ca 0.04 -2.10 -0.06 0.00 0.02 0.00 0.00 55.36 53.25 2jun s GLN 192 Cb -0.02 -0.45 -0.06 0.00 1.00 0.00 0.00 33.01 33.48 2jun s GLN 192 CO 0.04 -0.47 0.43 -0.51 -2.12 0.00 0.00 175.29 172.66 2jun s LEU 193 N -3.54 4.24 0.00 2.90 1.43 -1.26 -0.44 118.68 122.01 2jun s LEU 193 Ca 0.28 0.70 -0.02 0.00 -1.03 0.00 0.00 54.13 54.06 2jun s LEU 193 Cb 0.03 -3.41 0.01 0.00 0.03 0.00 0.00 46.19 42.86 2jun s LEU 193 CO 0.16 0.02 0.51 2.30 0.23 0.00 0.00 176.35 179.58 2jun n ILE 194 N 0.07 0.00 -4.18 -0.59 -5.35 -0.27 -4.86 119.36 104.17 2jun n ILE 194 Ca -0.02 -1.84 -0.30 0.00 -0.27 0.00 0.00 62.75 60.33 2jun n ILE 194 Cb 0.52 1.14 -0.09 0.00 -1.74 0.00 0.00 39.64 39.47 2jun n ILE 194 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jun h ALA 196 N 3.55 2.25 0.00 0.00 0.00 -1.89 0.17 119.26 123.34 2jun h ALA 196 Ca -0.48 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 2jun h ALA 196 Cb 1.17 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 2jun h ALA 196 CO 0.56 -0.41 -0.04 1.25 0.00 0.00 0.00 179.25 180.61 2jun h LEU 197 N 0.00 0.00 0.24 0.00 5.85 -1.94 -0.17 115.31 119.28 2jun h LEU 197 Ca 0.15 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.54 2jun h LEU 197 Cb 0.63 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.70 2jun h LEU 197 CO -0.00 0.04 -1.47 0.00 -0.34 0.00 0.00 178.44 176.68 2jun h LYS 199 N 0.14 0.00 0.04 0.00 3.64 -1.29 -2.04 116.57 117.06 2jun h LYS 199 Ca -0.25 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.13 2jun h LYS 199 Cb 2.15 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.97 2jun h LYS 199 CO 0.26 0.35 -0.02 1.25 -2.27 0.00 0.00 179.45 179.02 2jun h LEU 200 N 0.00 -0.05 -1.04 5.20 6.46 -1.08 -3.31 115.31 121.49 2jun h LEU 200 Ca -0.00 -0.63 0.16 0.00 -0.12 0.00 0.00 57.88 57.29 2jun h LEU 200 Cb 0.94 0.01 -0.09 0.00 -0.73 0.00 0.00 40.66 40.79 2jun h LEU 200 CO 0.05 0.70 0.62 0.58 -0.62 0.00 0.00 178.44 179.76 2jun h VAL 201 N -0.89 0.80 0.00 1.05 2.07 -1.53 -3.46 116.25 114.30 2jun h VAL 201 Ca -0.01 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.22 2jun h VAL 201 Cb 0.67 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 2jun h VAL 201 CO 0.01 0.16 0.00 0.61 0.02 0.00 0.00 177.57 178.36 2jun n GLY 202 N -1.35 1.15 0.44 2.17 0.00 -1.14 -4.99 105.19 101.47 2jun n GLY 202 Ca 0.21 0.00 0.26 0.00 0.00 0.00 0.00 46.02 46.49 2jun n GLY 202 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2jun h ARG 203 N 0.00 0.02 -0.29 1.61 3.08 -1.65 -2.20 114.38 114.95 2jun h ARG 203 Ca 0.00 -0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.82 2jun h ARG 203 Cb 0.00 -0.00 -0.38 0.00 0.08 0.00 0.00 29.97 29.67 2jun h ARG 203 CO 0.00 0.01 -1.03 0.72 -1.07 0.00 0.00 179.97 178.60 2jun n HIS 204 N -4.31 0.89 0.13 3.04 8.25 -1.05 -4.90 115.22 117.28 2jun n HIS 204 Ca 0.16 -1.55 -0.12 0.00 -0.26 0.00 0.00 57.72 55.95 2jun n HIS 204 Cb 0.86 -0.21 -0.08 0.00 1.12 0.00 0.00 29.99 31.68 2jun n HIS 204 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2jun h ARG 205 N 1.93 -0.36 0.00 -0.41 3.08 -1.49 -3.06 114.38 114.07 2jun h ARG 205 Ca -0.12 0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.96 2jun h ARG 205 Cb 1.49 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.62 2jun h ARG 205 CO 0.19 -0.01 0.00 -0.25 -1.07 0.00 0.00 179.97 178.83 2jun n ASP 206 N -5.08 0.00 -4.74 7.04 9.92 -1.26 -4.80 116.55 117.64 2jun n ASP 206 Ca -0.09 -0.19 -0.41 0.00 -0.53 0.00 0.00 54.79 53.58 2jun n ASP 206 Cb 0.26 -0.25 -0.04 0.00 -0.64 0.00 0.00 41.12 40.45 2jun n ASP 206 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 2jun s HIS 207 N -2.50 3.73 -0.68 1.24 3.76 -1.16 -4.99 115.29 114.69 2jun s HIS 207 Ca 0.27 1.72 -0.26 0.00 -0.15 0.00 0.00 55.06 56.64 2jun s HIS 207 Cb 0.18 -3.15 0.04 0.00 1.11 0.00 0.00 32.58 30.76 2jun s HIS 207 CO 0.39 -0.15 1.15 -1.14 -0.85 0.00 0.00 174.74 174.14 2jun s GLN 208 N -0.29 3.21 0.53 1.40 0.74 -1.26 -5.00 119.66 119.00 2jun s GLN 208 Ca 0.47 -0.37 0.05 0.00 0.05 0.00 0.00 55.36 55.57 2jun s GLN 208 Cb -0.26 -4.17 0.03 0.00 1.10 0.00 0.00 33.01 29.71 2jun s GLN 208 CO 0.32 -1.95 0.32 0.14 -0.55 0.00 0.00 175.29 173.58 2jun s VAL 209 N 5.02 1.58 -0.08 1.34 -7.23 -1.26 -2.76 120.40 117.01 2jun s VAL 209 Ca 0.32 -1.59 0.02 0.00 -1.81 0.00 0.00 61.98 58.92 2jun s VAL 209 Cb -0.11 -2.18 0.01 0.00 0.56 0.00 0.00 36.38 34.67 2jun s VAL 209 CO 0.15 0.00 -0.14 0.00 -0.31 0.00 0.00 175.10 174.80 2jun s ALA 210 N -2.78 1.45 -0.41 1.32 0.00 -1.19 -5.01 121.76 115.14 2jun s ALA 210 Ca 0.29 -0.54 -0.27 0.00 0.00 0.00 0.00 51.96 51.44 2jun s ALA 210 Cb -0.01 -0.64 0.02 0.00 0.00 0.00 0.00 23.12 22.48 2jun s ALA 210 CO 0.18 0.10 1.00 0.00 0.00 0.00 0.00 175.76 177.04 2jun s ALA 211 N 0.68 3.32 -0.17 0.00 0.00 -1.26 -4.26 121.76 120.07 2jun s ALA 211 Ca -0.14 -0.47 -0.14 0.00 0.00 0.00 0.00 51.96 51.21 2jun s ALA 211 Cb -0.16 -3.67 -0.22 0.00 0.00 0.00 0.00 23.12 19.07 2jun s ALA 211 CO 0.04 -1.85 0.24 1.28 0.00 0.00 0.00 175.76 175.47 2jun n LEU 212 N 7.14 2.26 -4.73 0.00 4.32 -1.26 -4.91 117.00 119.81 2jun n LEU 212 Ca 0.09 0.30 -0.42 0.00 -0.02 0.00 0.00 56.01 55.96 2jun n LEU 212 Cb 0.48 -1.03 -0.02 0.00 -1.62 0.00 0.00 43.42 41.23 2jun n LEU 212 CO 0.63 0.58 1.24 -1.54 -1.22 0.00 0.00 177.39 177.07 2jun n SER 213 N -3.95 3.75 0.00 -1.43 3.41 -1.26 -5.21 113.62 108.93 2jun n SER 213 Ca -0.34 1.13 0.00 0.00 -0.26 0.00 0.00 58.87 59.41 2jun n SER 213 Cb 0.87 -1.57 0.00 0.00 -0.26 0.00 0.00 64.21 63.25 2jun n SER 213 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09