#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 -0.76 -6.77 0.00 5.08 -2.07 -3.41 114.58 106.64 2jun h GLU 115 Ca 0.00 0.05 -0.49 0.00 -1.00 0.00 0.00 59.36 57.92 2jun h GLU 115 Cb 0.00 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2jun h GLU 115 CO 0.00 -0.51 0.39 0.15 -1.00 0.00 0.00 179.01 178.04 2jun s LYS 116 N -5.89 4.79 0.11 2.33 1.02 -1.26 -5.01 119.74 115.83 2jun s LYS 116 Ca -0.17 1.59 -0.30 0.00 0.02 0.00 0.00 55.97 57.11 2jun s LYS 116 Cb 0.06 -3.25 -0.07 0.00 -0.52 0.00 0.00 37.83 34.06 2jun s LYS 116 CO 0.62 0.42 1.17 0.54 -0.92 0.00 0.00 175.35 177.17 2jun s VAL 117 N -1.18 3.92 0.32 3.17 0.11 -1.26 -5.01 120.40 120.48 2jun s VAL 117 Ca 0.42 1.49 -0.25 0.00 -2.93 0.00 0.00 61.98 60.71 2jun s VAL 117 Cb -0.28 -3.95 -0.10 0.00 -1.53 0.00 0.00 36.38 30.52 2jun s VAL 117 CO 0.35 0.18 0.92 -0.76 -3.33 0.00 0.00 175.10 172.46 2jun s LEU 118 N 0.43 4.30 -0.43 2.54 1.43 -1.26 -2.66 118.68 123.04 2jun s LEU 118 Ca 0.55 1.78 -0.30 0.00 -1.03 0.00 0.00 54.13 55.13 2jun s LEU 118 Cb -0.30 -4.02 -0.10 0.00 0.03 0.00 0.00 46.19 41.80 2jun s LEU 118 CO 0.32 -0.09 2.32 0.00 0.23 0.00 0.00 176.35 179.14 2jun h GLN 120 N 15.13 0.00 -0.96 0.00 4.15 -1.88 -2.51 115.11 129.05 2jun h GLN 120 Ca -0.27 0.00 -0.65 0.00 0.77 0.00 0.00 58.65 58.50 2jun h GLN 120 Cb 1.29 0.00 -0.31 0.00 0.21 0.00 0.00 27.48 28.67 2jun h GLN 120 CO 1.08 0.07 0.63 0.34 -1.93 0.00 0.00 178.83 179.02 2jun n PHE 121 N -3.39 3.15 -4.95 3.99 7.35 -1.26 -4.94 117.46 117.40 2jun n PHE 121 Ca -0.01 -2.87 -0.32 0.00 -0.76 0.00 0.00 57.45 53.48 2jun n PHE 121 Cb 0.22 -1.28 -0.14 0.00 0.35 0.00 0.00 39.48 38.63 2jun n PHE 121 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2jun n ASP 123 N 2.27 3.11 -0.10 0.00 2.03 -1.26 -4.84 116.55 117.75 2jun n ASP 123 Ca -0.17 -3.06 -0.22 0.00 0.52 0.00 0.00 54.79 51.86 2jun n ASP 123 Cb 0.52 -0.46 -0.11 0.00 -0.72 0.00 0.00 41.12 40.35 2jun n ASP 123 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jun n GLN 124 N -0.43 0.56 -2.63 -0.67 6.02 -1.26 -5.04 117.38 113.93 2jun n GLN 124 Ca 0.24 0.57 -0.02 0.00 -0.01 0.00 0.00 57.00 57.78 2jun n GLN 124 Cb 0.80 -1.74 0.00 0.00 1.02 0.00 0.00 30.24 30.32 2jun n GLN 124 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2jun n ASP 125 N -4.43 -7.43 -4.77 1.08 -0.08 -1.26 -4.80 116.55 94.86 2jun n ASP 125 Ca -0.32 1.07 -0.31 0.00 -1.51 0.00 0.00 54.79 53.72 2jun n ASP 125 Cb 0.68 -4.93 0.09 0.00 2.34 0.00 0.00 41.12 39.29 2jun n ASP 125 CO 0.00 0.00 0.00 -2.16 0.12 0.00 0.00 177.20 175.16 2jun s PRO 126 N -1.75 2.31 0.54 -0.67 0.04 -1.26 -5.17 135.00 129.04 2jun s PRO 126 Ca 0.06 1.19 -0.01 0.00 0.04 0.00 0.00 61.00 62.28 2jun s PRO 126 Cb -0.02 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.64 2jun s PRO 126 CO 0.70 -1.61 0.79 0.00 0.04 0.00 0.00 177.00 176.92 2jun s ALA 127 N -2.86 3.67 0.69 8.56 0.00 -1.26 -4.98 121.76 125.58 2jun s ALA 127 Ca 0.62 -1.09 0.03 0.00 0.00 0.00 0.00 51.96 51.52 2jun s ALA 127 Cb -0.17 -2.24 0.13 0.00 0.00 0.00 0.00 23.12 20.83 2jun s ALA 127 CO 0.55 -0.69 0.95 1.04 0.00 0.00 0.00 175.76 177.60 2jun n GLN 128 N -2.36 0.13 -4.04 0.00 6.02 -1.26 -4.94 117.38 110.93 2jun n GLN 128 Ca 0.05 -2.92 -0.31 0.00 -0.01 0.00 0.00 57.00 53.81 2jun n GLN 128 Cb 0.59 -0.52 -0.06 0.00 1.02 0.00 0.00 30.24 31.26 2jun n GLN 128 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 177.06 176.21 2jun s ASP 129 N -4.97 5.70 -0.26 1.08 -4.77 -1.26 -0.42 116.67 111.76 2jun s ASP 129 Ca 0.66 0.07 -0.17 0.00 -3.30 0.00 0.00 52.55 49.81 2jun s ASP 129 Cb -0.04 -1.60 -0.03 0.00 -1.09 0.00 0.00 42.92 40.16 2jun s ASP 129 CO 0.43 0.20 0.46 0.00 0.70 0.00 0.00 175.17 176.95 2jun s ALA 130 N -1.36 3.58 -0.16 2.11 0.00 -1.09 -4.47 121.76 120.37 2jun s ALA 130 Ca 0.29 -0.69 0.10 0.00 0.00 0.00 0.00 51.96 51.66 2jun s ALA 130 Cb -0.12 -2.82 -0.15 0.00 0.00 0.00 0.00 23.12 20.03 2jun s ALA 130 CO 0.21 -0.71 0.29 1.33 0.00 0.00 0.00 175.76 176.89 2jun n VAL 131 N 5.14 0.00 -4.29 0.00 0.24 -1.21 -4.65 118.33 113.56 2jun n VAL 131 Ca -0.06 -0.25 -0.24 0.00 -2.04 0.00 0.00 64.34 61.75 2jun n VAL 131 Cb 0.50 0.49 -0.08 0.00 -1.47 0.00 0.00 33.84 33.28 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 -2.49 2.14 -0.19 7.34 1.02 -1.07 -4.37 119.74 122.12 2jun s LYS 132 Ca -0.01 -1.71 -0.11 0.00 0.02 0.00 0.00 55.97 54.16 2jun s LYS 132 Cb 0.07 -1.98 0.06 0.00 -0.52 0.00 0.00 37.83 35.47 2jun s LYS 132 CO 0.43 0.12 0.47 0.99 -0.92 0.00 0.00 175.35 176.44 2jun s THR 133 N -2.50 -0.03 -0.20 2.17 2.01 -1.26 -1.98 115.64 113.85 2jun s THR 133 Ca 0.35 0.08 -0.09 0.00 0.31 0.00 0.00 61.69 62.34 2jun s THR 133 Cb -0.00 -0.69 -0.05 0.00 0.01 0.00 0.00 72.50 71.77 2jun s THR 133 CO 0.20 0.03 0.12 0.00 -0.69 0.00 0.00 174.62 174.28 2jun h VAL 135 N 4.72 1.45 -0.01 0.00 2.07 -1.84 -0.77 116.25 121.87 2jun h VAL 135 Ca -0.40 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 65.80 2jun h VAL 135 Cb 1.15 2.35 -0.00 0.00 -1.52 0.00 0.00 31.29 33.27 2jun h VAL 135 CO 0.75 0.34 0.08 0.74 0.02 0.00 0.00 177.57 179.50 2jun h THR 136 N -0.56 0.04 0.00 2.57 2.02 -1.95 0.25 112.91 115.28 2jun h THR 136 Ca 0.00 0.00 -0.19 0.00 0.77 0.00 0.00 66.41 66.99 2jun h THR 136 Cb 0.56 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 2jun h THR 136 CO 0.00 0.00 -1.71 0.00 0.37 0.00 0.00 175.52 174.18 2jun n GLU 138 N -2.76 -1.83 -3.75 0.00 2.13 0.89 -4.99 120.64 110.33 2jun n GLU 138 Ca -0.14 0.77 -0.13 0.00 0.66 0.00 0.00 57.16 58.32 2jun n GLU 138 Cb 0.87 -5.18 -0.08 0.00 0.27 0.00 0.00 31.44 27.31 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 -2.86 0.06 -0.27 6.31 1.01 -1.14 -5.05 120.40 118.45 2jun s VAL 139 Ca 0.05 -0.46 -0.11 0.00 0.00 0.00 0.00 61.98 61.46 2jun s VAL 139 Cb -0.02 -0.66 -0.05 0.00 0.00 0.00 0.00 36.38 35.65 2jun s VAL 139 CO 0.06 -0.25 0.18 -0.55 0.00 0.00 0.00 175.10 174.54 2jun s SER 140 N -1.38 6.02 0.48 3.32 0.15 -1.26 -2.54 113.70 118.48 2jun s SER 140 Ca -0.13 0.01 0.02 0.00 0.70 0.00 0.00 55.95 56.55 2jun s SER 140 Cb -0.05 -2.11 -0.02 0.00 -1.71 0.00 0.00 66.02 62.14 2jun s SER 140 CO 0.04 -0.02 0.04 -0.31 1.20 0.00 0.00 173.24 174.19 2jun s TYR 141 N 1.60 1.85 0.53 3.44 2.02 -0.84 -4.57 117.35 121.37 2jun s TYR 141 Ca 0.07 -1.05 0.08 0.00 -0.37 0.00 0.00 57.07 55.81 2jun s TYR 141 Cb -0.15 -1.49 0.06 0.00 -0.40 0.00 0.00 41.96 39.98 2jun s TYR 141 CO 0.09 0.08 0.72 0.00 -1.57 0.00 0.00 175.55 174.88 2jun h ASP 143 N 0.30 0.84 0.15 0.00 3.58 -1.94 0.14 116.42 119.49 2jun h ASP 143 Ca -0.34 -0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.10 2jun h ASP 143 Cb 1.28 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 42.13 2jun h ASP 143 CO 0.43 0.59 -0.20 -0.08 -2.88 0.00 0.00 179.24 177.09 2jun h GLU 144 N 0.99 -0.35 -0.77 0.28 4.81 -1.95 0.15 114.58 117.75 2jun h GLU 144 Ca 0.30 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.64 2jun h GLU 144 Cb -0.03 0.08 -0.07 0.00 0.63 0.00 0.00 28.75 29.36 2jun h GLU 144 CO -0.09 -0.23 0.42 0.00 -0.73 0.00 0.00 179.01 178.38 2jun h LEU 146 N 0.73 0.00 -0.01 0.00 5.85 -0.22 0.35 115.31 122.00 2jun h LEU 146 Ca 0.37 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.87 2jun h LEU 146 Cb 0.32 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 2jun h LEU 146 CO -0.24 0.00 -1.02 0.50 -0.34 0.00 0.00 178.44 177.34 2jun h LYS 147 N 0.00 0.05 0.12 1.25 3.64 0.24 0.13 116.57 121.99 2jun h LYS 147 Ca 0.18 -0.08 -0.16 0.00 -1.27 0.00 0.00 60.65 59.32 2jun h LYS 147 Cb 0.95 0.03 0.02 0.00 -0.41 0.00 0.00 32.23 32.81 2jun h LYS 147 CO -0.00 1.02 -0.71 0.00 -2.27 0.00 0.00 179.45 177.49 2jun h ALA 148 N 0.94 -0.08 0.16 5.00 0.00 -0.17 -3.24 119.26 121.88 2jun h ALA 148 Ca -0.03 -0.67 -0.29 0.00 0.00 0.00 0.00 54.91 53.91 2jun h ALA 148 Cb 1.77 0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.67 2jun h ALA 148 CO 0.14 0.33 -1.32 1.79 0.00 0.00 0.00 179.25 180.19 2jun h THR 149 N -0.46 1.43 -3.19 0.00 1.35 -0.96 -3.40 112.91 107.68 2jun h THR 149 Ca -0.12 -2.97 -0.63 0.00 -0.55 0.00 0.00 66.41 62.14 2jun h THR 149 Cb 1.55 2.97 -0.41 0.00 -1.73 0.00 0.00 68.15 70.53 2jun h THR 149 CO 0.13 0.87 -0.67 -1.00 -0.25 0.00 0.00 175.52 174.60 2jun s HIS 150 N -2.64 2.72 1.03 4.73 3.76 0.44 -5.07 115.29 120.26 2jun s HIS 150 Ca -0.05 -2.89 -0.13 0.00 -0.15 0.00 0.00 55.06 51.83 2jun s HIS 150 Cb 0.06 -2.42 0.21 0.00 1.11 0.00 0.00 32.58 31.54 2jun s HIS 150 CO 0.90 -0.74 1.09 -1.25 -0.85 0.00 0.00 174.74 173.89 2jun s PRO 151 N -0.15 0.14 -0.48 8.40 0.04 -1.22 -4.08 135.00 137.64 2jun s PRO 151 Ca 0.18 0.42 -0.30 0.00 0.04 0.00 0.00 61.00 61.35 2jun s PRO 151 Cb -0.23 -1.71 -0.10 0.00 0.04 0.00 0.00 34.50 32.50 2jun s PRO 151 CO -0.02 -2.90 2.37 0.27 0.04 0.00 0.00 177.00 176.76 2jun n ASN 152 N -4.28 2.12 -0.63 6.66 6.94 -1.26 -4.58 115.26 120.22 2jun n ASN 152 Ca 0.06 -0.05 -0.01 0.00 -0.02 0.00 0.00 54.58 54.56 2jun n ASN 152 Cb 0.58 -1.40 -0.01 0.00 -2.36 0.00 0.00 39.78 36.59 2jun n ASN 152 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2jun n LYS 153 N 8.68 0.00 -1.71 -3.83 5.02 -1.26 -5.09 118.16 119.98 2jun n LYS 153 Ca 0.41 -0.37 -0.31 0.00 -2.02 0.00 0.00 58.31 56.02 2jun n LYS 153 Cb 0.37 0.05 0.03 0.00 -0.02 0.00 0.00 35.03 35.46 2jun n LYS 153 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2jun s LYS 154 N 0.00 3.19 1.00 1.97 -2.85 -1.26 -1.97 119.74 119.82 2jun s LYS 154 Ca 0.01 0.84 -0.12 0.00 -1.00 0.00 0.00 55.97 55.70 2jun s LYS 154 Cb 0.01 -2.03 0.19 0.00 -2.06 0.00 0.00 37.83 33.95 2jun s LYS 154 CO -0.01 -0.89 1.09 -1.25 0.10 0.00 0.00 175.35 174.40 2jun s PRO 155 N -5.11 0.38 0.00 1.78 0.04 -1.26 -4.81 135.00 126.02 2jun s PRO 155 Ca 0.57 0.51 0.00 0.00 0.04 0.00 0.00 61.00 62.12 2jun s PRO 155 Cb -0.13 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.68 2jun s PRO 155 CO 0.54 -2.76 0.00 0.34 0.04 0.00 0.00 177.00 175.16 2jun n PHE 156 N -4.19 0.00 -1.07 0.56 -0.00 -1.26 -4.47 117.46 107.03 2jun n PHE 156 Ca 0.05 0.00 -0.02 0.00 -0.00 0.00 0.00 57.45 57.48 2jun n PHE 156 Cb 0.57 0.00 -0.01 0.00 -0.00 0.00 0.00 39.48 40.04 2jun n PHE 156 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 2jun n THR 157 N 0.00 0.00 0.00 -2.13 -2.24 -0.83 -1.86 114.28 107.21 2jun n THR 157 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2jun n THR 157 Cb 0.00 -0.90 0.00 0.00 -2.10 0.00 0.00 70.33 67.33 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 -0.07 2.74 3.72 3.38 0.00 -1.26 -4.81 105.19 108.89 2jun n GLY 158 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.05 2.08 0.26 1.61 3.76 -0.78 -5.15 115.29 115.01 2jun s HIS 159 Ca 0.00 -0.86 0.05 0.00 -0.15 0.00 0.00 55.06 54.11 2jun s HIS 159 Cb 0.00 -1.68 -0.03 0.00 1.11 0.00 0.00 32.58 31.98 2jun s HIS 159 CO 0.00 0.27 0.38 0.50 -0.85 0.00 0.00 174.74 175.04 2jun s ARG 160 N -3.84 3.39 0.30 1.40 3.52 -1.26 -4.74 118.95 117.71 2jun s ARG 160 Ca 0.16 -0.80 -0.15 0.00 -0.13 0.00 0.00 55.73 54.81 2jun s ARG 160 Cb 0.04 -2.88 0.06 0.00 -1.56 0.00 0.00 34.95 30.61 2jun s ARG 160 CO 0.09 0.36 0.77 1.28 -0.81 0.00 0.00 175.30 176.99 2jun n LEU 161 N -1.45 0.00 -3.92 -0.88 4.77 -1.26 -3.01 117.00 111.25 2jun n LEU 161 Ca -0.07 -2.02 -0.30 0.00 -0.03 0.00 0.00 56.01 53.58 2jun n LEU 161 Cb 0.57 3.18 -0.15 0.00 -2.33 0.00 0.00 43.42 44.68 2jun n LEU 161 CO 0.44 -0.67 -0.39 -0.63 -1.33 0.00 0.00 177.39 174.81 2jun s ILE 162 N -2.17 1.56 -0.83 -0.08 1.09 -1.26 -4.81 121.20 114.71 2jun s ILE 162 Ca 0.16 -1.48 -0.03 0.00 -1.10 0.00 0.00 60.65 58.21 2jun s ILE 162 Cb -0.04 -1.95 -0.00 0.00 -1.06 0.00 0.00 42.46 39.41 2jun s ILE 162 CO 0.09 -0.31 0.69 1.21 -0.10 0.00 0.00 174.94 176.52 2jun n GLU 163 N 4.62 -1.42 -0.24 2.79 2.13 -1.26 -4.75 120.64 122.51 2jun n GLU 163 Ca -0.07 1.12 -0.07 0.00 0.66 0.00 0.00 57.16 58.81 2jun n GLU 163 Cb 0.43 -4.51 0.06 0.00 0.27 0.00 0.00 31.44 27.69 2jun n GLU 163 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 2jun n PRO 164 N -2.37 -1.51 -3.09 5.31 -0.04 -1.26 -4.69 135.00 127.35 2jun n PRO 164 Ca -0.11 -0.40 -0.04 0.00 -0.04 0.00 0.00 63.50 62.91 2jun n PRO 164 Cb 0.58 -0.37 0.00 0.00 -0.04 0.00 0.00 33.50 33.66 2jun n PRO 164 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 2jun n ILE 165 N -3.05 -9.75 -0.64 0.52 5.41 -1.26 -5.01 119.36 105.58 2jun n ILE 165 Ca 0.03 -0.03 -0.08 0.00 1.00 0.00 0.00 62.75 63.68 2jun n ILE 165 Cb 0.13 -6.66 0.07 0.00 -0.71 0.00 0.00 39.64 32.47 2jun n ILE 165 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2jun n PRO 166 N -1.56 -1.60 -3.04 0.38 -0.04 -1.26 -4.62 135.00 123.26 2jun n PRO 166 Ca -0.00 -0.47 -0.13 0.00 -0.04 0.00 0.00 63.50 62.85 2jun n PRO 166 Cb 0.51 -0.44 0.06 0.00 -0.04 0.00 0.00 33.50 33.59 2jun n PRO 166 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2jun n ASP 167 N -3.51 -5.13 -3.51 3.54 8.00 -1.26 -5.03 116.55 109.65 2jun n ASP 167 Ca 0.04 -0.59 -0.23 0.00 0.71 0.00 0.00 54.79 54.72 2jun n ASP 167 Cb 0.16 -4.50 -0.14 0.00 -0.02 0.00 0.00 41.12 36.62 2jun n ASP 167 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2jun s SER 168 N -3.51 2.30 -0.19 -2.24 0.15 -1.26 -4.99 113.70 103.95 2jun s SER 168 Ca 0.31 -0.73 0.14 0.00 0.70 0.00 0.00 55.95 56.37 2jun s SER 168 Cb -0.04 0.05 0.44 0.00 -1.71 0.00 0.00 66.02 64.76 2jun s SER 168 CO 0.63 -0.38 1.19 1.57 1.20 0.00 0.00 173.24 177.45 2jun n HIS 169 N 5.29 0.71 -0.07 3.44 -0.00 -1.26 -4.56 115.22 118.77 2jun n HIS 169 Ca -0.05 -1.50 -0.07 0.00 0.46 0.00 0.00 57.72 56.56 2jun n HIS 169 Cb 0.47 -0.25 -0.02 0.00 -0.12 0.00 0.00 29.99 30.07 2jun n HIS 169 CO 0.00 0.00 0.00 -0.89 0.46 0.00 0.00 176.34 175.91 2jun n ILE 170 N -0.64 1.18 -0.00 3.57 5.41 -1.26 -4.90 119.36 122.71 2jun n ILE 170 Ca 0.20 0.22 -0.00 0.00 1.00 0.00 0.00 62.75 64.17 2jun n ILE 170 Cb 0.86 -2.14 -0.01 0.00 -0.71 0.00 0.00 39.64 37.64 2jun n ILE 170 CO 0.00 0.00 0.00 -2.11 0.00 0.00 0.00 176.55 174.44 2jun n ARG 171 N -4.02 3.16 0.00 0.38 1.85 -1.26 -5.15 116.66 111.62 2jun n ARG 171 Ca -0.11 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.74 2jun n ARG 171 Cb 0.39 -1.02 0.00 0.00 -1.05 0.00 0.00 32.46 30.78 2jun n ARG 171 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2jun n GLY 172 N 3.04 2.24 3.83 2.89 0.00 -1.26 -5.09 105.19 110.84 2jun n GLY 172 Ca -0.02 -1.94 -0.22 0.00 0.00 0.00 0.00 46.02 43.84 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 3.34 0.42 0.99 1.43 -1.26 -5.09 118.68 118.51 2jun s LEU 173 Ca 0.00 -0.79 0.08 0.00 -1.03 0.00 0.00 54.13 52.38 2jun s LEU 173 Cb 0.00 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 2jun s LEU 173 CO 0.00 -0.57 0.31 -0.32 0.23 0.00 0.00 176.35 176.00 2jun s MET 174 N -4.04 2.42 1.05 1.70 1.75 -1.26 -4.19 119.30 116.72 2jun s MET 174 Ca 0.45 -1.66 -0.18 0.00 -1.25 0.00 0.00 55.69 53.06 2jun s MET 174 Cb -0.02 -2.23 0.24 0.00 2.84 0.00 0.00 34.83 35.67 2jun s MET 174 CO 0.26 -0.17 1.29 0.00 -0.65 0.00 0.00 175.02 175.75 2jun h LEU 176 N -1.99 -1.02 -4.85 0.00 5.85 -1.96 -3.37 115.31 107.98 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 42.13 2jun h LEU 176 CO 0.32 -0.71 -1.02 1.21 -0.34 0.00 0.00 178.44 177.90 2jun n GLU 177 N -5.19 2.01 -3.39 1.25 2.13 -1.26 -4.95 120.64 111.25 2jun n GLU 177 Ca -0.14 -3.74 -0.27 0.00 0.66 0.00 0.00 57.16 53.66 2jun n GLU 177 Cb 0.46 -1.64 -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 -0.21 -0.96 0.09 4.31 8.25 -1.26 -4.95 115.22 120.49 2jun n HIS 178 Ca 0.21 -3.30 -0.13 0.00 -0.26 0.00 0.00 57.72 54.24 2jun n HIS 178 Cb 0.75 0.27 -0.11 0.00 1.12 0.00 0.00 29.99 32.02 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 5.62 0.22 0.00 -0.41 -0.00 -1.92 -3.22 114.58 114.87 2jun h GLU 179 Ca 0.27 -0.34 -0.03 0.00 -0.00 0.00 0.00 59.36 59.25 2jun h GLU 179 Cb 0.91 0.12 -0.00 0.00 -0.00 0.00 0.00 28.75 29.78 2jun h GLU 179 CO 0.37 1.14 -0.16 0.22 -0.00 0.00 0.00 179.01 180.58 2jun h ASP 180 N 0.08 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 -0.55 0.00 0.42 0.00 0.00 57.03 56.81 2jun h ASP 180 Cb 1.84 0.00 -0.38 0.00 1.72 0.00 0.00 39.33 42.52 2jun h ASP 180 CO 0.18 0.16 -0.79 -0.70 -2.88 0.00 0.00 179.24 175.20 2jun s GLU 181 N -3.86 1.43 0.80 0.28 -6.30 -1.21 -5.14 118.70 104.71 2jun s GLU 181 Ca -0.01 -0.47 -0.10 0.00 -2.50 0.00 0.00 54.97 51.89 2jun s GLU 181 Cb 0.11 -1.93 0.10 0.00 0.00 0.00 0.00 34.13 32.41 2jun s GLU 181 CO 0.60 -0.41 1.14 0.15 0.02 0.00 0.00 175.26 176.76 2jun s LYS 182 N 1.65 1.74 -0.20 4.30 1.02 -1.26 -4.56 119.74 122.44 2jun s LYS 182 Ca 0.01 -0.22 -0.29 0.00 0.02 0.00 0.00 55.97 55.50 2jun s LYS 182 Cb -0.15 -2.03 0.00 0.00 -0.52 0.00 0.00 37.83 35.13 2jun s LYS 182 CO -0.08 -1.64 1.03 0.14 -0.92 0.00 0.00 175.35 173.89 2jun s VAL 183 N -3.50 4.70 -0.02 3.17 -7.23 -1.26 -4.53 120.40 111.73 2jun s VAL 183 Ca 0.64 2.03 0.07 0.00 -1.81 0.00 0.00 61.98 62.91 2jun s VAL 183 Cb -0.09 -4.31 0.12 0.00 0.56 0.00 0.00 36.38 32.66 2jun s VAL 183 CO 0.48 -0.13 1.05 -3.20 -0.31 0.00 0.00 175.10 172.99 2jun n ASN 184 N 5.97 0.52 -4.02 4.85 2.85 -0.38 -4.90 115.26 120.15 2jun n ASN 184 Ca 0.11 -2.20 -0.18 0.00 -0.11 0.00 0.00 54.58 52.20 2jun n ASN 184 Cb 0.47 -0.26 -0.09 0.00 1.24 0.00 0.00 39.78 41.14 2jun n ASN 184 CO 0.00 0.00 0.00 -0.04 -2.11 0.00 0.00 177.26 175.11 2jun s MET 185 N -0.47 1.55 -0.03 1.20 -1.94 0.85 -4.83 119.30 115.63 2jun s MET 185 Ca 0.11 -1.88 -0.01 0.00 -1.71 0.00 0.00 55.69 52.20 2jun s MET 185 Cb 0.11 -0.08 0.02 0.00 2.01 0.00 0.00 34.83 36.90 2jun s MET 185 CO -0.03 -0.44 0.07 -0.47 -0.01 0.00 0.00 175.02 174.15 2jun s TYR 186 N -3.66 -0.05 -0.13 -0.03 5.04 -1.26 -1.07 117.35 116.19 2jun s TYR 186 Ca 0.36 0.23 -0.05 0.00 -2.44 0.00 0.00 57.07 55.17 2jun s TYR 186 Cb 0.05 -0.11 -0.04 0.00 0.35 0.00 0.00 41.96 42.22 2jun s TYR 186 CO 0.17 -0.09 0.04 0.00 -1.34 0.00 0.00 175.55 174.33 2jun h VAL 188 N 4.49 1.35 -0.70 0.00 2.07 -1.80 0.25 116.25 121.91 2jun h VAL 188 Ca -0.44 -2.18 0.20 0.00 0.82 0.00 0.00 66.70 65.10 2jun h VAL 188 Cb 1.19 2.72 -0.03 0.00 -1.52 0.00 0.00 31.29 33.65 2jun h VAL 188 CO 0.62 0.46 0.54 0.74 0.02 0.00 0.00 177.57 179.94 2jun h THR 189 N -1.00 0.56 0.00 2.57 2.02 -1.96 -0.43 112.91 114.67 2jun h THR 189 Ca -0.12 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.02 2jun h THR 189 Cb 1.04 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 68.06 2jun h THR 189 CO -0.07 0.00 -1.78 0.47 0.37 0.00 0.00 175.52 174.51 2jun n ASP 190 N -4.17 1.33 -2.10 4.18 8.00 -1.25 -4.65 116.55 117.88 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 43.50 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 -2.14 -5.18 -4.16 -2.24 2.03 0.84 -4.44 116.55 101.26 2jun n ASP 191 Ca -0.06 -0.06 -0.25 0.00 0.52 0.00 0.00 54.79 54.94 2jun n ASP 191 Cb 0.51 -4.22 -0.08 0.00 -0.72 0.00 0.00 41.12 36.61 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 -4.99 1.90 0.21 -0.67 -0.21 -0.90 -4.61 119.66 110.38 2jun s GLN 192 Ca 0.05 -2.15 -0.05 0.00 0.02 0.00 0.00 55.36 53.23 2jun s GLN 192 Cb -0.02 -0.63 -0.05 0.00 1.00 0.00 0.00 33.01 33.30 2jun s GLN 192 CO 0.06 -0.45 0.46 -0.51 -2.12 0.00 0.00 175.29 172.73 2jun s LEU 193 N -3.59 4.18 0.00 2.90 1.43 -1.26 -0.34 118.68 122.00 2jun s LEU 193 Ca 0.25 0.63 -0.03 0.00 -1.03 0.00 0.00 54.13 53.95 2jun s LEU 193 Cb 0.03 -3.40 0.01 0.00 0.03 0.00 0.00 46.19 42.86 2jun s LEU 193 CO 0.14 -0.06 0.53 2.30 0.23 0.00 0.00 176.35 179.50 2jun n ILE 194 N -0.41 0.00 -4.25 -0.59 -5.35 -0.23 -4.76 119.36 103.77 2jun n ILE 194 Ca -0.02 -1.78 -0.29 0.00 -0.27 0.00 0.00 62.75 60.40 2jun n ILE 194 Cb 0.53 1.13 -0.10 0.00 -1.74 0.00 0.00 39.64 39.46 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 3.34 2.25 0.00 0.00 0.00 -1.89 0.19 119.26 123.15 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 1.18 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2jun h ALA 196 CO 0.52 -0.40 -0.05 1.25 0.00 0.00 0.00 179.25 180.57 2jun h LEU 197 N 0.00 0.00 0.23 0.00 5.85 -1.95 -0.62 115.31 118.82 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 41.69 2jun h LEU 197 CO -0.00 0.05 -1.45 0.00 -0.34 0.00 0.00 178.44 176.70 2jun h LYS 199 N 0.13 0.00 0.06 0.00 3.64 -1.27 -2.06 116.57 117.07 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 0.38 -0.03 1.25 -2.27 0.00 0.00 179.45 179.04 2jun h LEU 200 N 0.00 -0.07 -1.14 5.20 6.46 -1.16 -3.31 115.31 121.30 2jun h LEU 200 Ca -0.00 -0.57 0.16 0.00 -0.12 0.00 0.00 57.88 57.35 2jun h LEU 200 Cb 0.95 0.02 -0.09 0.00 -0.73 0.00 0.00 40.66 40.81 2jun h LEU 200 CO 0.05 0.64 0.61 0.58 -0.62 0.00 0.00 178.44 179.70 2jun h VAL 201 N -0.89 0.79 0.00 1.05 2.07 -1.53 -3.46 116.25 114.28 2jun h VAL 201 Ca -0.01 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.25 2jun h VAL 201 Cb 0.63 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.35 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 -1.38 1.28 0.44 2.17 0.00 -1.13 -4.99 105.19 101.58 2jun n GLY 202 Ca 0.20 0.00 0.26 0.00 0.00 0.00 0.00 46.02 46.48 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 0.06 -0.66 1.61 3.08 -1.66 -2.43 114.38 114.38 2jun h ARG 203 Ca 0.00 -0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.73 2jun h ARG 203 Cb 0.00 -0.01 -0.40 0.00 0.08 0.00 0.00 29.97 29.63 2jun h ARG 203 CO 0.00 0.04 -1.11 0.72 -1.07 0.00 0.00 179.97 178.55 2jun n HIS 204 N -4.33 1.42 -0.07 3.04 8.25 -1.03 -4.90 115.22 117.61 2jun n HIS 204 Ca 0.17 -2.37 -0.12 0.00 -0.26 0.00 0.00 57.72 55.14 2jun n HIS 204 Cb 0.86 -0.28 -0.11 0.00 1.12 0.00 0.00 29.99 31.58 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 2.69 0.00 0.00 -0.41 3.08 -1.57 -3.30 114.38 114.87 2jun h ARG 205 Ca -0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2jun h ARG 205 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 2jun h ARG 205 CO 0.34 0.81 0.00 -3.47 -1.07 0.00 0.00 179.97 176.59 2jun n ASP 206 N -4.64 0.00 -4.81 7.04 -0.08 -1.26 -4.81 116.55 107.99 2jun n ASP 206 Ca -0.09 0.03 -0.34 0.00 -1.51 0.00 0.00 54.79 52.89 2jun n ASP 206 Cb 0.40 -0.32 -0.06 0.00 2.34 0.00 0.00 41.12 43.48 2jun n ASP 206 CO 0.00 0.00 0.00 -1.00 0.12 0.00 0.00 177.20 176.32 2jun s HIS 207 N -2.64 3.20 -0.68 -0.67 3.76 -1.24 -5.00 115.29 112.02 2jun s HIS 207 Ca 0.21 1.60 -0.19 0.00 -0.15 0.00 0.00 55.06 56.54 2jun s HIS 207 Cb 0.16 -2.94 0.11 0.00 1.11 0.00 0.00 32.58 31.02 2jun s HIS 207 CO 0.38 -0.38 0.82 -1.14 -0.85 0.00 0.00 174.74 173.57 2jun s GLN 208 N -3.14 3.19 0.47 1.40 0.74 -1.26 -5.03 119.66 116.03 2jun s GLN 208 Ca 0.63 -1.40 0.06 0.00 0.05 0.00 0.00 55.36 54.71 2jun s GLN 208 Cb -0.12 -4.37 -0.01 0.00 1.10 0.00 0.00 33.01 29.60 2jun s GLN 208 CO 0.16 -1.61 0.27 0.14 -0.55 0.00 0.00 175.29 173.71 2jun s VAL 209 N 2.73 2.02 -0.03 1.34 -7.23 -1.26 -2.69 120.40 115.26 2jun s VAL 209 Ca 0.17 -1.60 0.07 0.00 -1.81 0.00 0.00 61.98 58.81 2jun s VAL 209 Cb -0.19 -2.61 -0.02 0.00 0.56 0.00 0.00 36.38 34.12 2jun s VAL 209 CO 0.03 0.00 -0.25 0.00 -0.31 0.00 0.00 175.10 174.57 2jun s ALA 210 N -2.67 2.10 -0.43 1.32 0.00 -1.19 -5.02 121.76 115.86 2jun s ALA 210 Ca 0.36 -1.06 -0.08 0.00 0.00 0.00 0.00 51.96 51.19 2jun s ALA 210 Cb 0.00 -0.58 0.09 0.00 0.00 0.00 0.00 23.12 22.63 2jun s ALA 210 CO 0.21 0.47 0.27 0.00 0.00 0.00 0.00 175.76 176.71 2jun s ALA 211 N -0.41 3.29 -0.53 0.00 0.00 -1.26 -4.30 121.76 118.55 2jun s ALA 211 Ca 0.04 -2.31 -0.19 0.00 0.00 0.00 0.00 51.96 49.50 2jun s ALA 211 Cb -0.11 -2.65 0.07 0.00 0.00 0.00 0.00 23.12 20.43 2jun s ALA 211 CO 0.01 -1.74 0.63 -1.17 0.00 0.00 0.00 175.76 173.49 2jun s LEU 212 N 1.36 5.12 0.26 0.00 2.96 -1.26 -5.04 118.68 122.08 2jun s LEU 212 Ca 0.04 -1.07 0.09 0.00 -0.22 0.00 0.00 54.13 52.97 2jun s LEU 212 Cb -0.24 -2.39 -0.05 0.00 0.50 0.00 0.00 46.19 44.01 2jun s LEU 212 CO 0.00 -0.93 -0.15 -0.94 -1.32 0.00 0.00 176.35 173.02 2jun s SER 213 N 2.92 3.11 0.00 3.68 1.04 -1.26 -5.13 113.70 118.07 2jun s SER 213 Ca 0.13 -1.07 0.00 0.00 0.48 0.00 0.00 55.95 55.49 2jun s SER 213 Cb -0.21 -0.23 0.00 0.00 0.10 0.00 0.00 66.02 65.69 2jun s SER 213 CO 0.10 -0.12 0.00 -0.62 0.98 0.00 0.00 173.24 173.58