#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jun n GLU 115 N 0.00 1.21 -4.42 0.00 4.07 -1.26 -5.06 120.64 115.19 2jun n GLU 115 Ca 0.00 -2.96 -0.22 0.00 -0.06 0.00 0.00 57.16 53.92 2jun n GLU 115 Cb 0.00 -1.16 -0.10 0.00 -0.06 0.00 0.00 31.44 30.12 2jun n GLU 115 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2jun s LYS 116 N -2.29 1.54 0.13 5.31 1.02 -1.26 -5.12 119.74 119.07 2jun s LYS 116 Ca 0.37 -1.70 -0.26 0.00 0.02 0.00 0.00 55.97 54.40 2jun s LYS 116 Cb 0.38 -1.48 -0.07 0.00 -0.52 0.00 0.00 37.83 36.14 2jun s LYS 116 CO -0.09 0.25 0.79 0.54 -0.92 0.00 0.00 175.35 175.91 2jun s VAL 117 N -2.72 4.46 0.13 3.17 0.11 -1.26 -5.05 120.40 119.24 2jun s VAL 117 Ca 0.27 1.71 -0.16 0.00 -2.93 0.00 0.00 61.98 60.87 2jun s VAL 117 Cb -0.03 -4.15 -0.07 0.00 -1.53 0.00 0.00 36.38 30.61 2jun s VAL 117 CO 0.12 0.47 0.57 -0.76 -3.33 0.00 0.00 175.10 172.17 2jun s LEU 118 N -0.80 4.39 -0.44 2.54 1.43 -1.26 -2.68 118.68 121.86 2jun s LEU 118 Ca 0.37 1.16 -0.30 0.00 -1.03 0.00 0.00 54.13 54.34 2jun s LEU 118 Cb -0.23 -3.20 -0.09 0.00 0.03 0.00 0.00 46.19 42.70 2jun s LEU 118 CO 0.26 0.14 2.34 0.00 0.23 0.00 0.00 176.35 179.32 2jun h GLN 120 N 15.63 0.00 -0.99 0.00 4.15 -1.88 -2.51 115.11 129.51 2jun h GLN 120 Ca -0.27 0.00 -0.66 0.00 0.77 0.00 0.00 58.65 58.49 2jun h GLN 120 Cb 1.28 0.00 -0.30 0.00 0.21 0.00 0.00 27.48 28.68 2jun h GLN 120 CO 1.10 0.11 0.80 1.19 -1.93 0.00 0.00 178.83 180.10 2jun n PHE 121 N -3.61 3.20 -4.77 3.99 3.01 -1.26 -4.94 117.46 113.09 2jun n PHE 121 Ca -0.02 -2.93 -0.31 0.00 1.01 0.00 0.00 57.45 55.20 2jun n PHE 121 Cb 0.23 -1.38 -0.13 0.00 -0.01 0.00 0.00 39.48 38.19 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 1.86 3.19 -0.10 0.00 2.03 -1.26 -4.84 116.55 117.44 2jun n ASP 123 Ca -0.16 -2.95 -0.20 0.00 0.52 0.00 0.00 54.79 52.00 2jun n ASP 123 Cb 0.52 -0.43 -0.12 0.00 -0.72 0.00 0.00 41.12 40.37 2jun n ASP 123 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 2jun h GLN 124 N 2.48 0.00 -5.25 -0.67 4.20 -1.96 -3.50 115.11 110.42 2jun h GLN 124 Ca 0.11 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 2jun h GLN 124 Cb 1.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.11 2jun h GLN 124 CO 0.51 0.98 -0.91 -3.47 -0.67 0.00 0.00 178.83 175.27 2jun n ASP 125 N -4.48 -7.94 -4.77 1.46 2.03 -1.26 -4.79 116.55 96.80 2jun n ASP 125 Ca -0.26 1.20 -0.31 0.00 0.52 0.00 0.00 54.79 55.93 2jun n ASP 125 Cb 0.62 -5.13 0.08 0.00 -0.72 0.00 0.00 41.12 35.97 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 -1.81 2.36 0.38 -0.67 0.04 -1.26 -5.17 135.00 128.88 2jun s PRO 126 Ca 0.05 1.21 0.01 0.00 0.04 0.00 0.00 61.00 62.32 2jun s PRO 126 Cb -0.01 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.60 2jun s PRO 126 CO 0.75 -1.57 0.58 0.00 0.04 0.00 0.00 177.00 176.80 2jun s ALA 127 N -2.80 3.81 0.75 8.56 0.00 -1.26 -4.99 121.76 125.83 2jun s ALA 127 Ca 0.62 -1.07 -0.01 0.00 0.00 0.00 0.00 51.96 51.50 2jun s ALA 127 Cb -0.18 -2.04 0.14 0.00 0.00 0.00 0.00 23.12 21.04 2jun s ALA 127 CO 0.53 -0.16 1.03 -1.14 0.00 0.00 0.00 175.76 176.02 2jun s GLN 128 N -4.38 1.52 0.18 0.00 0.74 -1.26 -4.91 119.66 111.54 2jun s GLN 128 Ca 0.44 -1.16 0.05 0.00 0.05 0.00 0.00 55.36 54.74 2jun s GLN 128 Cb -0.10 -2.30 -0.04 0.00 1.10 0.00 0.00 33.01 31.68 2jun s GLN 128 CO 0.36 -1.58 0.19 0.16 -0.55 0.00 0.00 175.29 173.87 2jun s ASP 129 N -4.79 5.73 -0.25 6.67 -4.77 -1.26 -0.46 116.67 117.54 2jun s ASP 129 Ca 0.68 -0.07 -0.25 0.00 -3.30 0.00 0.00 52.55 49.60 2jun s ASP 129 Cb -0.04 -1.56 -0.00 0.00 -1.09 0.00 0.00 42.92 40.23 2jun s ASP 129 CO 0.45 0.04 0.87 0.00 0.70 0.00 0.00 175.17 177.24 2jun s ALA 130 N -1.81 3.64 -0.09 2.11 0.00 -1.09 -4.29 121.76 120.23 2jun s ALA 130 Ca 0.32 -0.10 0.08 0.00 0.00 0.00 0.00 51.96 52.26 2jun s ALA 130 Cb -0.10 -3.35 -0.11 0.00 0.00 0.00 0.00 23.12 19.56 2jun s ALA 130 CO 0.25 -1.00 0.03 1.33 0.00 0.00 0.00 175.76 176.37 2jun n VAL 131 N 5.32 0.63 -3.69 0.00 0.24 -1.14 -4.64 118.33 115.06 2jun n VAL 131 Ca 0.07 -0.39 -0.21 0.00 -2.04 0.00 0.00 64.34 61.77 2jun n VAL 131 Cb 0.47 -0.76 -0.03 0.00 -1.47 0.00 0.00 33.84 32.06 2jun n VAL 131 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2jun s LYS 132 N -2.22 2.78 -0.20 7.34 1.02 -0.99 -4.30 119.74 123.18 2jun s LYS 132 Ca -0.05 -1.27 -0.11 0.00 0.02 0.00 0.00 55.97 54.57 2jun s LYS 132 Cb 0.03 -2.54 0.07 0.00 -0.52 0.00 0.00 37.83 34.86 2jun s LYS 132 CO 0.38 0.04 0.48 0.99 -0.92 0.00 0.00 175.35 176.32 2jun s THR 133 N -2.30 -0.03 -0.23 2.17 2.01 -1.26 -2.28 115.64 113.72 2jun s THR 133 Ca 0.43 0.07 -0.08 0.00 0.31 0.00 0.00 61.69 62.42 2jun s THR 133 Cb -0.06 -0.71 -0.04 0.00 0.01 0.00 0.00 72.50 71.69 2jun s THR 133 CO 0.28 0.03 0.10 0.00 -0.69 0.00 0.00 174.62 174.34 2jun h VAL 135 N 5.21 1.30 0.00 0.00 -1.51 -1.83 -0.69 116.25 118.73 2jun h VAL 135 Ca -0.37 -1.77 -0.00 0.00 -1.23 0.00 0.00 66.70 63.32 2jun h VAL 135 Cb 1.17 1.71 -0.00 0.00 -2.13 0.00 0.00 31.29 32.04 2jun h VAL 135 CO 0.63 0.56 -0.02 0.74 -1.23 0.00 0.00 177.57 178.25 2jun h THR 136 N 0.55 0.07 0.00 7.19 2.02 -1.94 -2.06 112.91 118.74 2jun h THR 136 Ca 0.01 -0.46 -0.10 0.00 0.77 0.00 0.00 66.41 66.63 2jun h THR 136 Cb 1.13 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 68.95 2jun h THR 136 CO 0.11 0.02 -1.71 0.00 0.37 0.00 0.00 175.52 174.32 2jun n GLU 138 N -2.58 -3.44 -3.74 0.00 2.13 -0.28 -5.00 120.64 107.73 2jun n GLU 138 Ca -0.09 0.75 -0.14 0.00 0.66 0.00 0.00 57.16 58.34 2jun n GLU 138 Cb 0.72 -5.23 -0.09 0.00 0.27 0.00 0.00 31.44 27.12 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 -3.01 0.04 -0.22 6.31 1.01 -1.15 -5.06 120.40 118.32 2jun s VAL 139 Ca 0.20 -0.34 -0.07 0.00 0.00 0.00 0.00 61.98 61.77 2jun s VAL 139 Cb -0.09 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.64 2jun s VAL 139 CO 0.24 -0.19 0.05 -0.55 0.00 0.00 0.00 175.10 174.65 2jun s SER 140 N -1.00 5.15 0.38 3.32 0.15 -1.26 -2.69 113.70 117.74 2jun s SER 140 Ca -0.11 -0.14 0.05 0.00 0.70 0.00 0.00 55.95 56.46 2jun s SER 140 Cb -0.04 -1.90 -0.02 0.00 -1.71 0.00 0.00 66.02 62.35 2jun s SER 140 CO 0.04 0.04 0.19 -1.22 1.20 0.00 0.00 173.24 173.50 2jun n TYR 141 N 4.41 -0.21 -2.77 3.44 4.01 -0.96 -4.82 117.16 120.25 2jun n TYR 141 Ca -0.16 -2.66 -0.28 0.00 -0.16 0.00 0.00 57.90 54.64 2jun n TYR 141 Cb 0.52 0.10 -0.01 0.00 -0.31 0.00 0.00 39.34 39.64 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 0.55 0.58 -0.04 0.00 3.58 -1.90 0.20 116.42 119.39 2jun h ASP 143 Ca -0.47 0.10 0.01 0.00 0.42 0.00 0.00 57.03 57.09 2jun h ASP 143 Cb 1.20 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 42.24 2jun h ASP 143 CO 0.62 0.20 -0.20 -0.08 -2.88 0.00 0.00 179.24 176.91 2jun h GLU 144 N 0.63 -0.21 -0.84 0.28 4.81 -1.94 0.16 114.58 117.48 2jun h GLU 144 Ca 0.52 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.78 2jun h GLU 144 Cb 0.81 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.20 2jun h GLU 144 CO -0.40 -0.14 0.56 0.00 -0.73 0.00 0.00 179.01 178.30 2jun h LEU 146 N 1.13 0.15 -0.03 0.00 7.12 0.30 0.30 115.31 124.27 2jun h LEU 146 Ca 0.31 0.03 -0.17 0.00 0.13 0.00 0.00 57.88 58.18 2jun h LEU 146 Cb -0.12 0.01 0.01 0.00 -0.53 0.00 0.00 40.66 40.03 2jun h LEU 146 CO -0.07 0.02 -0.66 0.50 -0.13 0.00 0.00 178.44 178.10 2jun h LYS 147 N 0.13 0.50 0.54 1.25 3.64 0.60 -2.78 116.57 120.44 2jun h LYS 147 Ca 0.57 -0.50 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 2jun h LYS 147 Cb 1.99 0.13 0.01 0.00 -0.41 0.00 0.00 32.23 33.95 2jun h LYS 147 CO -0.11 1.14 -0.26 0.00 -2.27 0.00 0.00 179.45 177.95 2jun h ALA 148 N 0.38 -0.72 -0.88 5.00 0.00 -0.44 -3.13 119.26 119.48 2jun h ALA 148 Ca -0.07 -0.19 0.21 0.00 0.00 0.00 0.00 54.91 54.86 2jun h ALA 148 Cb 1.34 0.28 -0.06 0.00 0.00 0.00 0.00 17.79 19.36 2jun h ALA 148 CO 0.13 -0.73 0.59 0.00 0.00 0.00 0.00 179.25 179.25 2jun h THR 149 N -1.08 0.65 -3.60 0.00 1.03 -0.84 -3.22 112.91 105.85 2jun h THR 149 Ca -0.07 -0.10 -0.73 0.00 -0.01 0.00 0.00 66.41 65.50 2jun h THR 149 Cb 0.62 0.34 -0.33 0.00 -1.07 0.00 0.00 68.15 67.71 2jun h THR 149 CO 0.12 0.05 -0.17 -1.00 -0.01 0.00 0.00 175.52 174.52 2jun s HIS 150 N -5.30 3.60 0.51 0.00 3.76 -1.05 -5.07 115.29 111.74 2jun s HIS 150 Ca -0.07 -2.57 -0.21 0.00 -0.15 0.00 0.00 55.06 52.06 2jun s HIS 150 Cb 0.22 -3.40 -0.07 0.00 1.11 0.00 0.00 32.58 30.45 2jun s HIS 150 CO 0.78 -0.87 1.15 -1.25 -0.85 0.00 0.00 174.74 173.69 2jun s PRO 151 N -0.25 3.53 -0.59 8.40 0.04 -1.22 -4.71 135.00 140.21 2jun s PRO 151 Ca 0.19 1.69 -0.29 0.00 0.04 0.00 0.00 61.00 62.63 2jun s PRO 151 Cb -0.15 -2.18 -0.12 0.00 0.04 0.00 0.00 34.50 32.09 2jun s PRO 151 CO -0.06 -0.72 2.45 0.09 0.04 0.00 0.00 177.00 178.80 2jun n ASN 152 N -0.95 1.80 0.00 6.66 3.02 -1.26 -4.66 115.26 119.87 2jun n ASN 152 Ca 0.10 -0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.49 2jun n ASN 152 Cb 0.50 -1.36 0.00 0.00 -0.61 0.00 0.00 39.78 38.31 2jun n ASN 152 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2jun n LYS 153 N 8.74 3.06 -0.96 3.52 5.02 -1.26 -5.07 118.16 131.20 2jun n LYS 153 Ca 0.45 -0.19 -0.34 0.00 -2.02 0.00 0.00 58.31 56.21 2jun n LYS 153 Cb 0.36 -0.66 0.10 0.00 -0.02 0.00 0.00 35.03 34.81 2jun n LYS 153 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 2jun n LYS 154 N -0.49 -0.08 -2.25 1.97 2.85 -1.26 -4.24 118.16 114.65 2jun n LYS 154 Ca 0.00 0.02 -0.39 0.00 -1.05 0.00 0.00 58.31 56.89 2jun n LYS 154 Cb 0.01 -1.75 -0.02 0.00 -0.65 0.00 0.00 35.03 32.62 2jun n LYS 154 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 2jun s PRO 155 N -3.17 4.10 -0.57 -1.58 0.04 -1.26 -4.90 135.00 127.66 2jun s PRO 155 Ca 0.58 1.92 -0.07 0.00 0.04 0.00 0.00 61.00 63.46 2jun s PRO 155 Cb -0.25 -2.75 0.01 0.00 0.04 0.00 0.00 34.50 31.54 2jun s PRO 155 CO 0.66 -0.30 0.63 1.19 0.04 0.00 0.00 177.00 179.22 2jun n PHE 156 N 0.21 -3.10 0.32 0.56 3.72 -1.26 -4.84 117.46 113.06 2jun n PHE 156 Ca 0.03 1.22 0.20 0.00 -0.05 0.00 0.00 57.45 58.85 2jun n PHE 156 Cb 0.45 -4.01 1.05 0.00 -0.94 0.00 0.00 39.48 36.04 2jun n PHE 156 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2jun h THR 157 N 1.13 0.11 0.00 4.37 1.03 -1.91 -3.45 112.91 114.19 2jun h THR 157 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.40 2jun h THR 157 Cb 0.98 0.90 0.00 0.00 -1.07 0.00 0.00 68.15 68.96 2jun h THR 157 CO 0.24 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 176.36 2jun n GLY 158 N -1.18 0.81 3.14 2.99 0.00 -1.26 -4.86 105.19 104.83 2jun n GLY 158 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.10 2.70 0.14 1.61 3.76 -1.26 -5.07 115.29 115.07 2jun s HIS 159 Ca 0.00 -1.48 0.02 0.00 -0.15 0.00 0.00 55.06 53.45 2jun s HIS 159 Cb 0.00 -1.85 -0.04 0.00 1.11 0.00 0.00 32.58 31.80 2jun s HIS 159 CO 0.00 -0.70 0.27 1.03 -0.85 0.00 0.00 174.74 174.49 2jun s ARG 160 N 1.05 3.43 0.15 1.40 1.81 -1.26 -5.07 118.95 120.45 2jun s ARG 160 Ca -0.01 -0.58 0.03 0.00 -1.72 0.00 0.00 55.73 53.44 2jun s ARG 160 Cb -0.14 -2.97 -0.01 0.00 -0.45 0.00 0.00 34.95 31.38 2jun s ARG 160 CO -0.07 0.53 0.09 1.28 -0.68 0.00 0.00 175.30 176.45 2jun n LEU 161 N -0.44 0.00 -4.13 2.53 4.32 -1.26 -2.86 117.00 115.15 2jun n LEU 161 Ca -0.07 -1.28 -0.38 0.00 -0.02 0.00 0.00 56.01 54.26 2jun n LEU 161 Cb 0.54 0.58 -0.09 0.00 -1.62 0.00 0.00 43.42 42.83 2jun n LEU 161 CO 0.49 -0.21 0.08 -0.63 -1.22 0.00 0.00 177.39 175.90 2jun s ILE 162 N -2.40 3.96 -0.63 -0.08 1.09 -1.17 -4.79 121.20 117.17 2jun s ILE 162 Ca 0.13 -2.80 -0.07 0.00 -1.10 0.00 0.00 60.65 56.81 2jun s ILE 162 Cb 0.01 -3.56 0.01 0.00 -1.06 0.00 0.00 42.46 37.85 2jun s ILE 162 CO 0.09 -0.88 0.66 1.21 -0.10 0.00 0.00 174.94 175.92 2jun n GLU 163 N 3.66 -1.71 -1.09 2.79 2.13 -1.26 -4.39 120.64 120.76 2jun n GLU 163 Ca 0.07 1.68 -0.30 0.00 0.66 0.00 0.00 57.16 59.27 2jun n GLU 163 Cb 0.39 -5.48 0.23 0.00 0.27 0.00 0.00 31.44 26.86 2jun n GLU 163 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 2jun s PRO 164 N -2.94 -1.06 -0.73 5.31 0.04 -1.26 -4.77 135.00 129.59 2jun s PRO 164 Ca 0.10 -0.01 0.04 0.00 0.04 0.00 0.00 61.00 61.17 2jun s PRO 164 Cb -0.03 -1.61 0.22 0.00 0.04 0.00 0.00 34.50 33.13 2jun s PRO 164 CO 0.77 -3.61 0.72 0.44 0.04 0.00 0.00 177.00 175.35 2jun n ILE 165 N -4.70 2.41 -0.53 0.56 -5.35 -1.26 -5.08 119.36 105.40 2jun n ILE 165 Ca 0.12 -5.14 -0.03 0.00 -0.27 0.00 0.00 62.75 57.44 2jun n ILE 165 Cb 0.59 -2.17 0.02 0.00 -1.74 0.00 0.00 39.64 36.35 2jun n ILE 165 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 2jun n PRO 166 N 1.45 -1.21 -0.13 6.28 -0.04 -1.26 -4.92 135.00 135.18 2jun n PRO 166 Ca 0.25 -0.15 -0.05 0.00 -0.04 0.00 0.00 63.50 63.52 2jun n PRO 166 Cb 0.38 -0.14 0.02 0.00 -0.04 0.00 0.00 33.50 33.72 2jun n PRO 166 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 2jun h ASP 167 N -1.17 -0.38 0.00 3.54 2.03 -2.04 -3.45 116.42 114.95 2jun h ASP 167 Ca -0.04 0.12 0.00 0.00 -0.73 0.00 0.00 57.03 56.39 2jun h ASP 167 Cb 0.11 0.25 0.00 0.00 -0.83 0.00 0.00 39.33 38.86 2jun h ASP 167 CO 0.02 -0.13 0.00 -0.24 -1.03 0.00 0.00 179.24 177.86 2jun n SER 168 N -5.31 0.00 -1.17 4.15 2.88 -1.26 -5.17 113.62 107.74 2jun n SER 168 Ca 0.03 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.67 2jun n SER 168 Cb 0.22 0.38 -0.03 0.00 -0.75 0.00 0.00 64.21 64.03 2jun n SER 168 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2jun n HIS 169 N -2.20 -2.89 -1.56 0.66 8.25 -1.26 -4.74 115.22 111.49 2jun n HIS 169 Ca 0.00 1.00 -0.40 0.00 -0.26 0.00 0.00 57.72 58.06 2jun n HIS 169 Cb 0.00 -1.75 0.02 0.00 1.12 0.00 0.00 29.99 29.38 2jun n HIS 169 CO 0.00 0.00 0.00 1.51 0.64 0.00 0.00 176.34 178.49 2jun n ILE 170 N -3.11 2.59 0.09 1.59 3.06 -1.26 -4.91 119.36 117.41 2jun n ILE 170 Ca 0.01 -0.50 -0.10 0.00 -2.50 0.00 0.00 62.75 59.65 2jun n ILE 170 Cb 0.37 -0.97 -0.06 0.00 0.54 0.00 0.00 39.64 39.52 2jun n ILE 170 CO 0.00 0.00 0.00 -0.09 -2.50 0.00 0.00 176.55 173.96 2jun h ARG 171 N 0.95 -0.47 -5.52 9.51 2.43 -2.07 -3.38 114.38 115.84 2jun h ARG 171 Ca -0.45 0.03 -0.62 0.00 -0.81 0.00 0.00 59.98 58.13 2jun h ARG 171 Cb 1.36 0.11 -0.13 0.00 -0.42 0.00 0.00 29.97 30.89 2jun h ARG 171 CO 0.53 -0.31 0.17 0.20 -1.51 0.00 0.00 179.97 179.05 2jun s GLY 172 N -1.71 1.75 0.57 2.80 0.00 -1.26 -5.05 107.32 104.42 2jun s GLY 172 Ca -0.10 -0.76 -0.15 0.00 0.00 0.00 0.00 44.72 43.71 2jun s GLY 172 CO 0.36 1.51 1.02 1.08 0.00 0.00 0.00 173.10 177.07 2jun s LEU 173 N 2.71 3.47 0.42 0.66 1.43 -1.26 -5.08 118.68 121.03 2jun s LEU 173 Ca 0.25 1.63 0.07 0.00 -1.03 0.00 0.00 54.13 55.06 2jun s LEU 173 Cb -0.14 -4.51 -0.04 0.00 0.03 0.00 0.00 46.19 41.53 2jun s LEU 173 CO 0.14 -0.90 0.28 -0.32 0.23 0.00 0.00 176.35 175.78 2jun s MET 174 N -4.34 2.38 1.06 1.70 1.75 -1.26 -4.20 119.30 116.39 2jun s MET 174 Ca 0.60 -1.69 -0.18 0.00 -1.25 0.00 0.00 55.69 53.17 2jun s MET 174 Cb -0.12 -2.19 0.25 0.00 2.84 0.00 0.00 34.83 35.60 2jun s MET 174 CO 0.39 -0.16 1.29 0.00 -0.65 0.00 0.00 175.02 175.89 2jun h LEU 176 N -2.01 -1.01 -4.84 0.00 5.85 -1.97 -3.37 115.31 107.97 2jun h LEU 176 Ca -0.44 0.04 -0.45 0.00 0.84 0.00 0.00 57.88 57.87 2jun h LEU 176 Cb 1.23 0.27 -0.41 0.00 0.37 0.00 0.00 40.66 42.12 2jun h LEU 176 CO 0.31 -0.70 -1.02 1.21 -0.34 0.00 0.00 178.44 177.91 2jun n GLU 177 N -5.13 2.01 -3.41 1.25 2.13 -1.26 -4.95 120.64 111.27 2jun n GLU 177 Ca -0.14 -3.73 -0.27 0.00 0.66 0.00 0.00 57.16 53.67 2jun n GLU 177 Cb 0.45 -1.63 -0.10 0.00 0.27 0.00 0.00 31.44 30.43 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 -0.21 -0.77 0.09 4.31 8.25 -1.26 -4.95 115.22 120.68 2jun n HIS 178 Ca 0.21 -3.34 -0.12 0.00 -0.26 0.00 0.00 57.72 54.20 2jun n HIS 178 Cb 0.75 0.23 -0.11 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 0.20 0.00 -0.41 -0.00 -1.92 -3.21 114.58 114.85 2jun h GLU 179 Ca 0.26 -0.31 -0.03 0.00 -0.00 0.00 0.00 59.36 59.28 2jun h GLU 179 Cb 0.90 0.11 -0.00 0.00 -0.00 0.00 0.00 28.75 29.76 2jun h GLU 179 CO 0.39 1.12 -0.16 0.22 -0.00 0.00 0.00 179.01 180.57 2jun h ASP 180 N 0.07 0.00 -3.30 3.06 3.58 -2.02 -3.40 116.42 114.41 2jun h ASP 180 Ca -0.09 0.00 -0.54 0.00 0.42 0.00 0.00 57.03 56.82 2jun h ASP 180 Cb 1.83 0.00 -0.38 0.00 1.72 0.00 0.00 39.33 42.50 2jun h ASP 180 CO 0.17 0.16 -0.79 -0.70 -2.88 0.00 0.00 179.24 175.20 2jun s GLU 181 N -3.79 1.38 0.78 0.28 -6.30 -1.21 -5.14 118.70 104.70 2jun s GLU 181 Ca -0.00 -0.45 -0.09 0.00 -2.50 0.00 0.00 54.97 51.94 2jun s GLU 181 Cb 0.11 -1.90 0.10 0.00 0.00 0.00 0.00 34.13 32.44 2jun s GLU 181 CO 0.60 -0.41 1.10 0.15 0.02 0.00 0.00 175.26 176.73 2jun s LYS 182 N 1.67 1.77 -0.21 4.30 1.02 -1.26 -4.55 119.74 122.47 2jun s LYS 182 Ca 0.01 -0.34 -0.29 0.00 0.02 0.00 0.00 55.97 55.37 2jun s LYS 182 Cb -0.15 -2.09 0.01 0.00 -0.52 0.00 0.00 37.83 35.08 2jun s LYS 182 CO -0.08 -1.57 1.03 0.14 -0.92 0.00 0.00 175.35 173.96 2jun s VAL 183 N -3.42 4.70 -0.01 3.17 -7.23 -1.26 -4.53 120.40 111.82 2jun s VAL 183 Ca 0.64 2.03 0.13 0.00 -1.81 0.00 0.00 61.98 62.97 2jun s VAL 183 Cb -0.09 -4.31 0.22 0.00 0.56 0.00 0.00 36.38 32.76 2jun s VAL 183 CO 0.47 -0.14 1.09 0.59 -0.31 0.00 0.00 175.10 176.80 2jun n ASN 184 N 6.07 0.62 -3.81 4.85 3.02 -0.78 -4.90 115.26 120.33 2jun n ASN 184 Ca 0.11 -2.13 -0.15 0.00 -0.03 0.00 0.00 54.58 52.39 2jun n ASN 184 Cb 0.47 -0.27 -0.09 0.00 -0.61 0.00 0.00 39.78 39.28 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 -0.26 1.47 -0.01 3.52 -1.94 0.85 -4.79 119.30 118.13 2jun s MET 185 Ca 0.18 -1.76 0.00 0.00 -1.71 0.00 0.00 55.69 52.40 2jun s MET 185 Cb 0.20 0.31 0.01 0.00 2.01 0.00 0.00 34.83 37.37 2jun s MET 185 CO -0.08 -0.53 0.01 -0.47 -0.01 0.00 0.00 175.02 173.94 2jun s TYR 186 N -3.81 0.09 -0.13 -0.03 6.14 -1.26 -0.82 117.35 117.53 2jun s TYR 186 Ca 0.38 0.04 -0.05 0.00 0.64 0.00 0.00 57.07 58.08 2jun s TYR 186 Cb 0.04 -0.16 -0.04 0.00 0.42 0.00 0.00 41.96 42.23 2jun s TYR 186 CO 0.18 -0.05 0.04 0.00 0.64 0.00 0.00 175.55 176.37 2jun h VAL 188 N 4.47 1.47 -0.84 0.00 2.07 -1.75 0.25 116.25 121.92 2jun h VAL 188 Ca -0.45 -2.28 0.24 0.00 0.82 0.00 0.00 66.70 65.04 2jun h VAL 188 Cb 1.19 2.95 -0.03 0.00 -1.52 0.00 0.00 31.29 33.88 2jun h VAL 188 CO 0.61 0.50 0.60 0.74 0.02 0.00 0.00 177.57 180.05 2jun h THR 189 N -1.00 0.58 0.00 2.57 2.02 -1.96 -0.26 112.91 114.86 2jun h THR 189 Ca -0.12 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 2jun h THR 189 Cb 1.10 0.58 -0.00 0.00 -1.74 0.00 0.00 68.15 68.09 2jun h THR 189 CO -0.07 0.00 -1.73 0.47 0.37 0.00 0.00 175.52 174.56 2jun n ASP 190 N -4.28 1.43 -2.07 4.18 8.00 -1.25 -4.79 116.55 117.77 2jun n ASP 190 Ca 0.17 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.49 2jun n ASP 190 Cb 0.91 1.67 -0.01 0.00 -0.02 0.00 0.00 41.12 43.67 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 -2.07 -5.24 -4.18 -2.24 2.03 0.84 -4.55 116.55 101.15 2jun n ASP 191 Ca -0.04 -0.03 -0.25 0.00 0.52 0.00 0.00 54.79 54.99 2jun n ASP 191 Cb 0.44 -4.30 -0.08 0.00 -0.72 0.00 0.00 41.12 36.45 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 -4.92 1.91 0.22 -0.67 -0.21 -0.89 -4.64 119.66 110.45 2jun s GLN 192 Ca 0.01 -2.15 -0.10 0.00 0.02 0.00 0.00 55.36 53.14 2jun s GLN 192 Cb -0.01 -0.67 -0.07 0.00 1.00 0.00 0.00 33.01 33.27 2jun s GLN 192 CO 0.01 -0.44 0.54 -0.51 -2.12 0.00 0.00 175.29 172.77 2jun s LEU 193 N -3.60 4.19 0.32 2.90 1.43 -1.26 -0.27 118.68 122.38 2jun s LEU 193 Ca 0.25 0.91 -0.05 0.00 -1.03 0.00 0.00 54.13 54.20 2jun s LEU 193 Cb 0.03 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.63 2jun s LEU 193 CO 0.14 -0.05 0.47 0.27 0.23 0.00 0.00 176.35 177.41 2jun s ILE 194 N -1.78 0.00 0.09 -0.59 -4.36 0.00 -4.61 121.20 109.96 2jun s ILE 194 Ca 0.46 -1.55 0.05 0.00 -0.26 0.00 0.00 60.65 59.35 2jun s ILE 194 Cb -0.12 -2.56 -0.04 0.00 1.25 0.00 0.00 42.46 41.00 2jun s ILE 194 CO 0.21 0.00 -0.03 0.00 0.24 0.00 0.00 174.94 175.36 2jun h ALA 196 N 3.52 2.30 0.00 0.00 0.00 -1.89 0.21 119.26 123.41 2jun h ALA 196 Ca -0.48 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 2jun h ALA 196 Cb 1.17 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 2jun h ALA 196 CO 0.57 -0.48 -0.06 1.25 0.00 0.00 0.00 179.25 180.53 2jun h LEU 197 N 0.00 0.00 0.23 0.00 5.85 -1.94 0.13 115.31 119.58 2jun h LEU 197 Ca 0.18 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.57 2jun h LEU 197 Cb 0.74 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.80 2jun h LEU 197 CO -0.00 0.06 -1.45 0.00 -0.34 0.00 0.00 178.44 176.71 2jun h LYS 199 N 0.13 0.00 0.05 0.00 3.64 -1.28 -1.95 116.57 117.16 2jun h LYS 199 Ca -0.24 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.14 2jun h LYS 199 Cb 2.14 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.96 2jun h LYS 199 CO 0.26 0.31 -0.02 1.25 -2.27 0.00 0.00 179.45 178.98 2jun h LEU 200 N 0.00 -0.05 -1.09 5.20 5.85 -1.02 -3.32 115.31 120.87 2jun h LEU 200 Ca -0.00 -0.53 0.17 0.00 0.84 0.00 0.00 57.88 58.35 2jun h LEU 200 Cb 0.94 0.01 -0.09 0.00 0.37 0.00 0.00 40.66 41.89 2jun h LEU 200 CO 0.04 0.67 0.61 0.58 -0.34 0.00 0.00 178.44 180.00 2jun h VAL 201 N -0.94 0.77 0.00 1.05 2.07 -1.53 -3.46 116.25 114.21 2jun h VAL 201 Ca -0.01 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.25 2jun h VAL 201 Cb 0.59 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 2jun h VAL 201 CO 0.01 0.14 0.00 0.61 0.02 0.00 0.00 177.57 178.35 2jun n GLY 202 N -1.37 1.22 0.44 2.17 0.00 -1.13 -4.99 105.19 101.54 2jun n GLY 202 Ca 0.21 0.00 0.26 0.00 0.00 0.00 0.00 46.02 46.50 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 0.01 -0.16 1.61 3.08 -1.65 -1.99 114.38 115.28 2jun h ARG 203 Ca 0.00 -0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.86 2jun h ARG 203 Cb 0.00 -0.00 -0.33 0.00 0.08 0.00 0.00 29.97 29.71 2jun h ARG 203 CO 0.00 0.00 -0.96 0.72 -1.07 0.00 0.00 179.97 178.67 2jun n HIS 204 N -4.30 0.50 0.11 3.04 8.25 -0.99 -4.89 115.22 116.94 2jun n HIS 204 Ca 0.16 -1.18 -0.13 0.00 -0.26 0.00 0.00 57.72 56.32 2jun n HIS 204 Cb 0.87 -0.20 -0.08 0.00 1.12 0.00 0.00 29.99 31.70 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 1.47 -0.29 0.00 -0.41 3.08 -1.48 -2.94 114.38 113.80 2jun h ARG 205 Ca -0.13 0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.94 2jun h ARG 205 Cb 1.58 0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.70 2jun h ARG 205 CO 0.15 0.05 0.00 -0.25 -1.07 0.00 0.00 179.97 178.85 2jun n ASP 206 N -5.06 0.00 -4.81 7.04 9.92 -1.26 -4.78 116.55 117.60 2jun n ASP 206 Ca -0.09 0.37 -0.34 0.00 -0.53 0.00 0.00 54.79 54.21 2jun n ASP 206 Cb 0.25 -0.45 -0.06 0.00 -0.64 0.00 0.00 41.12 40.23 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 -2.89 3.21 -0.46 1.24 3.76 -1.11 -5.02 115.29 114.01 2jun s HIS 207 Ca 0.12 1.61 -0.17 0.00 -0.15 0.00 0.00 55.06 56.47 2jun s HIS 207 Cb 0.13 -2.95 0.05 0.00 1.11 0.00 0.00 32.58 30.93 2jun s HIS 207 CO 0.34 -0.39 0.44 -1.14 -0.85 0.00 0.00 174.74 173.15 2jun s GLN 208 N -3.12 3.03 0.48 1.40 0.74 -1.26 -5.03 119.66 115.91 2jun s GLN 208 Ca 0.63 -1.10 0.06 0.00 0.05 0.00 0.00 55.36 55.00 2jun s GLN 208 Cb -0.13 -4.08 -0.00 0.00 1.10 0.00 0.00 33.01 29.90 2jun s GLN 208 CO 0.17 -1.01 0.31 0.14 -0.55 0.00 0.00 175.29 174.34 2jun s VAL 209 N 1.96 1.96 -0.10 1.34 -7.23 -1.26 -2.34 120.40 114.73 2jun s VAL 209 Ca 0.08 -1.56 0.03 0.00 -1.81 0.00 0.00 61.98 58.71 2jun s VAL 209 Cb -0.21 -2.52 0.01 0.00 0.56 0.00 0.00 36.38 34.22 2jun s VAL 209 CO 0.09 0.00 -0.18 0.00 -0.31 0.00 0.00 175.10 174.70 2jun s ALA 210 N -2.68 1.81 -0.61 1.32 0.00 -1.19 -5.01 121.76 115.40 2jun s ALA 210 Ca 0.36 -0.78 -0.23 0.00 0.00 0.00 0.00 51.96 51.31 2jun s ALA 210 Cb -0.00 -0.78 0.06 0.00 0.00 0.00 0.00 23.12 22.40 2jun s ALA 210 CO 0.21 0.10 0.95 0.00 0.00 0.00 0.00 175.76 177.02 2jun s ALA 211 N 0.66 3.13 -0.60 0.00 0.00 -1.26 -4.35 121.76 119.35 2jun s ALA 211 Ca -0.13 -1.61 -0.21 0.00 0.00 0.00 0.00 51.96 50.01 2jun s ALA 211 Cb -0.16 -3.80 0.07 0.00 0.00 0.00 0.00 23.12 19.23 2jun s ALA 211 CO 0.03 -2.61 0.83 -1.17 0.00 0.00 0.00 175.76 172.84 2jun s LEU 212 N 3.99 4.74 0.04 0.00 0.20 -1.26 -4.97 118.68 121.42 2jun s LEU 212 Ca 0.25 -1.02 -0.28 0.00 0.69 0.00 0.00 54.13 53.77 2jun s LEU 212 Cb -0.15 -2.45 0.10 0.00 -0.43 0.00 0.00 46.19 43.26 2jun s LEU 212 CO 0.14 -1.22 1.14 -0.44 -0.29 0.00 0.00 176.35 175.67 2jun s SER 213 N 3.38 -0.12 0.00 3.68 0.01 -1.26 -5.10 113.70 114.29 2jun s SER 213 Ca 0.19 -0.23 0.32 0.00 1.31 0.00 0.00 55.95 57.54 2jun s SER 213 Cb -0.19 0.30 1.90 0.00 0.21 0.00 0.00 66.02 68.24 2jun s SER 213 CO 0.11 -0.55 2.22 -0.62 0.41 0.00 0.00 173.24 174.81