#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i7b s HIS 5 N 0.00 3.19 -0.04 0.00 5.04 -1.26 -5.02 115.29 117.21 1i7b s HIS 5 Ca 0.00 1.00 -0.04 0.00 -1.54 0.00 0.00 55.06 54.49 1i7b s HIS 5 Cb 0.00 -3.71 0.01 0.00 0.04 0.00 0.00 32.58 28.92 1i7b s HIS 5 CO 0.00 -2.41 0.10 0.12 -2.34 0.00 0.00 174.74 170.21 1i7b s PHE 6 N 0.64 -0.11 -0.06 3.88 5.36 -1.26 -5.14 117.98 121.29 1i7b s PHE 6 Ca 0.62 0.27 0.01 0.00 -0.96 0.00 0.00 56.93 56.86 1i7b s PHE 6 Cb -0.38 0.04 0.02 0.00 -0.34 0.00 0.00 43.02 42.35 1i7b s PHE 6 CO 0.35 -0.06 -0.05 0.12 -1.46 0.00 0.00 175.22 174.12 1i7b s PHE 7 N 0.03 0.85 -0.73 10.12 5.36 -1.26 -5.10 117.98 127.26 1i7b s PHE 7 Ca -0.00 -0.27 -0.23 0.00 -0.96 0.00 0.00 56.93 55.47 1i7b s PHE 7 Cb -0.01 -0.76 0.07 0.00 -0.34 0.00 0.00 43.02 41.98 1i7b s PHE 7 CO 0.00 -0.24 1.07 -2.00 -1.46 0.00 0.00 175.22 172.59 1i7b s GLU 8 N 1.11 3.21 0.30 10.12 2.56 -1.26 -4.88 118.70 129.85 1i7b s GLU 8 Ca -0.08 -0.83 0.08 0.00 0.00 0.00 0.00 54.97 54.15 1i7b s GLU 8 Cb -0.14 -4.36 0.45 0.00 2.00 0.00 0.00 34.13 32.08 1i7b s GLU 8 CO -0.01 -1.90 1.68 0.78 -0.56 0.00 0.00 175.26 175.25 1i7b h GLY 9 N 11.68 0.14 -5.28 -1.50 0.00 -2.08 -3.44 103.07 102.60 1i7b h GLY 9 Ca -0.21 -0.15 -0.59 0.00 0.00 0.00 0.00 47.33 46.38 1i7b h GLY 9 CO 1.21 0.13 0.96 2.41 0.00 0.00 0.00 176.54 181.25 1i7b n THR 10 N -3.96 0.28 -3.68 4.70 -1.04 -1.26 -4.96 114.28 104.36 1i7b n THR 10 Ca -0.02 -0.05 -0.22 0.00 -2.04 0.00 0.00 64.05 61.72 1i7b n THR 10 Cb 0.52 -1.76 -0.02 0.00 -1.82 0.00 0.00 70.33 67.26 1i7b n THR 10 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1i7b s GLU 11 N 2.40 3.44 -0.17 -2.82 8.01 -1.26 -5.09 118.70 123.20 1i7b s GLU 11 Ca 0.85 -0.58 -0.07 0.00 0.01 0.00 0.00 54.97 55.17 1i7b s GLU 11 Cb -0.65 -2.78 -0.04 0.00 -4.31 0.00 0.00 34.13 26.34 1i7b s GLU 11 CO 0.43 0.28 0.08 0.15 0.01 0.00 0.00 175.26 176.21 1i7b s LYS 12 N -4.14 3.87 -0.10 1.61 1.02 -1.26 -5.10 119.74 115.64 1i7b s LYS 12 Ca 0.37 -0.30 0.02 0.00 0.02 0.00 0.00 55.97 56.08 1i7b s LYS 12 Cb -0.09 -3.21 0.02 0.00 -0.52 0.00 0.00 37.83 34.02 1i7b s LYS 12 CO 0.32 0.38 -0.14 -1.17 -0.92 0.00 0.00 175.35 173.82 1i7b s LEU 13 N 0.09 1.68 -0.10 3.17 2.96 -1.26 -5.12 118.68 120.09 1i7b s LEU 13 Ca 0.06 -0.40 0.03 0.00 -0.22 0.00 0.00 54.13 53.60 1i7b s LEU 13 Cb -0.12 -1.04 0.00 0.00 0.50 0.00 0.00 46.19 45.53 1i7b s LEU 13 CO 0.00 0.01 -0.22 -0.22 -1.32 0.00 0.00 176.35 174.61 1i7b s LEU 14 N 0.99 2.02 -0.07 -0.68 2.96 -1.26 -5.11 118.68 117.53 1i7b s LEU 14 Ca -0.07 -0.53 0.01 0.00 -0.22 0.00 0.00 54.13 53.32 1i7b s LEU 14 Cb -0.15 -1.32 0.02 0.00 0.50 0.00 0.00 46.19 45.24 1i7b s LEU 14 CO -0.01 0.12 -0.05 -0.70 -1.32 0.00 0.00 176.35 174.38 1i7b s GLU 15 N 0.50 1.06 -0.04 1.98 2.12 -1.26 -5.14 118.70 117.93 1i7b s GLU 15 Ca -0.16 -0.14 0.01 0.00 0.36 0.00 0.00 54.97 55.05 1i7b s GLU 15 Cb -0.17 -1.10 0.02 0.00 0.26 0.00 0.00 34.13 33.14 1i7b s GLU 15 CO 0.06 -0.14 -0.05 0.08 -0.54 0.00 0.00 175.26 174.67 1i7b s VAL 16 N 1.23 0.55 -0.20 3.70 1.01 -1.26 -5.12 120.40 120.31 1i7b s VAL 16 Ca -0.06 -0.16 -0.05 0.00 0.00 0.00 0.00 61.98 61.71 1i7b s VAL 16 Cb -0.14 -0.55 -0.02 0.00 0.00 0.00 0.00 36.38 35.67 1i7b s VAL 16 CO -0.02 0.21 0.00 0.26 0.00 0.00 0.00 175.10 175.56 1i7b s TRP 17 N 0.69 3.04 0.31 5.22 0.52 -1.26 -5.11 118.94 122.36 1i7b s TRP 17 Ca -0.09 -0.44 0.07 0.00 0.02 0.00 0.00 56.10 55.65 1i7b s TRP 17 Cb -0.12 -2.08 -0.02 0.00 -1.15 0.00 0.00 33.47 30.10 1i7b s TRP 17 CO 0.00 -0.23 0.39 -0.06 0.02 0.00 0.00 176.95 177.08 1i7b s PHE 18 N 0.97 3.13 0.21 -1.98 0.40 -1.26 -5.13 117.98 114.32 1i7b s PHE 18 Ca 0.02 -0.20 -0.23 0.00 -0.60 0.00 0.00 56.93 55.93 1i7b s PHE 18 Cb -0.14 -1.84 0.05 0.00 0.51 0.00 0.00 43.02 41.60 1i7b s PHE 18 CO 0.02 0.15 0.70 -1.54 0.70 0.00 0.00 175.22 175.25 1i7b s SER 19 N -4.08 -0.38 -0.15 1.36 1.04 -1.26 -5.16 113.70 105.08 1i7b s SER 19 Ca 0.41 -0.33 -0.01 0.00 0.48 0.00 0.00 55.95 56.50 1i7b s SER 19 Cb -0.08 0.64 -0.02 0.00 0.10 0.00 0.00 66.02 66.66 1i7b s SER 19 CO 0.29 -1.13 -0.10 -0.60 0.98 0.00 0.00 173.24 172.69 1i7b s ARG 20 N -3.76 3.45 0.16 4.02 3.52 -1.26 -5.01 118.95 120.08 1i7b s ARG 20 Ca 0.07 -0.64 -0.15 0.00 -0.13 0.00 0.00 55.73 54.88 1i7b s ARG 20 Cb -0.03 -2.74 0.08 0.00 -1.56 0.00 0.00 34.95 30.70 1i7b s ARG 20 CO -0.02 0.17 1.77 0.37 -0.81 0.00 0.00 175.30 176.78 1i7b h GLN 21 N 6.87 0.35 0.00 5.12 4.15 -2.03 -3.47 115.11 126.10 1i7b h GLN 21 Ca -0.29 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.11 1i7b h GLN 21 Cb 1.20 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.81 1i7b h GLN 21 CO 0.58 0.23 0.00 0.94 -1.93 0.00 0.00 178.83 178.66 1i7b n GLN 22 N -4.96 0.00 -0.34 1.69 -0.06 -1.26 -5.37 117.38 107.09 1i7b n GLN 22 Ca 0.02 0.00 -0.04 0.00 -2.00 0.00 0.00 57.00 54.99 1i7b n GLN 22 Cb 0.12 0.00 -0.05 0.00 -4.06 0.00 0.00 30.24 26.25 1i7b n GLN 22 CO 0.00 0.00 0.00 -0.35 -0.20 0.00 0.00 177.06 176.51 1i7b n PRO 23 N 0.00 0.67 0.00 3.69 -0.04 -1.26 -5.28 135.00 132.78 1i7b n PRO 23 Ca 0.00 -0.30 0.00 0.00 -0.04 0.00 0.00 63.50 63.16 1i7b n PRO 23 Cb 0.00 -1.61 0.00 0.00 -0.04 0.00 0.00 33.50 31.85 1i7b n PRO 23 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1i7b n GLN 27 N 2.61 1.00 0.00 0.54 7.27 -1.26 -5.33 117.38 122.21 1i7b n GLN 27 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.20 1i7b n GLN 27 Cb 0.31 -0.67 0.00 0.00 2.41 0.00 0.00 30.24 32.29 1i7b n GLN 27 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1i7b n GLY 28 N 1.60 -1.09 0.17 1.69 0.00 -1.26 -4.62 105.19 101.67 1i7b n GLY 28 Ca 0.00 -1.63 0.03 0.00 0.00 0.00 0.00 46.02 44.42 1i7b n GLY 28 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1i7b h SER 29 N 0.00 0.00 -0.44 1.61 4.64 -2.04 -3.47 113.55 113.85 1i7b h SER 29 Ca 0.00 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.13 1i7b h SER 29 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.02 1i7b h SER 29 CO 0.00 0.47 -0.17 0.61 -0.87 0.00 0.00 176.83 176.87 1i7b n GLY 30 N 0.46 1.07 3.02 -0.77 0.00 -1.26 -4.99 105.19 102.73 1i7b n GLY 30 Ca 0.00 -0.62 -0.13 0.00 0.00 0.00 0.00 46.02 45.27 1i7b n GLY 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1i7b s ASP 31 N -2.90 0.33 0.55 1.61 -1.08 -1.26 -5.04 116.67 108.88 1i7b s ASP 31 Ca 0.00 0.57 0.24 0.00 -0.52 0.00 0.00 52.55 52.84 1i7b s ASP 31 Cb 0.00 0.81 1.49 0.00 -1.46 0.00 0.00 42.92 43.77 1i7b s ASP 31 CO 0.00 -0.25 2.13 -0.07 0.52 0.00 0.00 175.17 177.50 1i7b h LEU 32 N 8.26 0.00 -0.22 -1.34 3.38 -2.00 -1.86 115.31 121.54 1i7b h LEU 32 Ca -0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1i7b h LEU 32 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1i7b h LEU 32 CO 0.15 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.22 1i7b n ARG 33 N -4.19 0.04 0.16 1.13 1.74 -1.26 -2.01 116.66 112.26 1i7b n ARG 33 Ca 0.01 0.40 0.01 0.00 -0.77 0.00 0.00 57.85 57.50 1i7b n ARG 33 Cb 0.25 -1.59 0.27 0.00 -1.02 0.00 0.00 32.46 30.37 1i7b n ARG 33 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1i7b h THR 34 N 0.00 1.31 -2.28 0.55 2.02 -1.77 -3.43 112.91 109.31 1i7b h THR 34 Ca 0.00 -1.71 -0.57 0.00 0.77 0.00 0.00 66.41 64.90 1i7b h THR 34 Cb 0.14 1.93 0.04 0.00 -1.74 0.00 0.00 68.15 68.53 1i7b h THR 34 CO 0.00 0.48 1.01 -0.38 0.37 0.00 0.00 175.52 177.00 1i7b n ILE 35 N -3.89 0.33 -1.21 3.11 5.41 -0.85 -4.94 119.36 117.32 1i7b n ILE 35 Ca -0.01 -0.06 -0.31 0.00 1.00 0.00 0.00 62.75 63.37 1i7b n ILE 35 Cb 0.52 -1.87 0.10 0.00 -0.71 0.00 0.00 39.64 37.68 1i7b n ILE 35 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1i7b s PRO 36 N 2.61 2.07 0.29 0.38 0.02 -1.26 -4.94 135.00 134.16 1i7b s PRO 36 Ca 0.84 1.16 -0.01 0.00 0.02 0.00 0.00 61.00 63.01 1i7b s PRO 36 Cb -0.61 -1.88 0.42 0.00 0.02 0.00 0.00 34.50 32.46 1i7b s PRO 36 CO 0.42 -1.77 1.84 -0.09 -0.33 0.00 0.00 177.00 177.07 1i7b h ARG 37 N -1.22 0.83 -0.63 5.54 9.65 -1.95 -2.54 114.38 124.05 1i7b h ARG 37 Ca -0.44 -0.16 0.03 0.00 -1.10 0.00 0.00 59.98 58.31 1i7b h ARG 37 Cb 1.24 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 29.65 1i7b h ARG 37 CO 0.51 0.73 0.42 0.66 2.80 0.00 0.00 179.97 185.08 1i7b h SER 38 N 0.81 0.66 0.29 -3.80 4.64 -2.00 -0.80 113.55 113.35 1i7b h SER 38 Ca 0.18 -0.01 -0.18 0.00 -0.47 0.00 0.00 61.79 61.31 1i7b h SER 38 Cb 0.25 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 1i7b h SER 38 CO -0.01 0.46 -0.74 -0.33 -0.87 0.00 0.00 176.83 175.34 1i7b h GLU 39 N 0.76 0.37 -0.47 4.77 4.39 -1.84 -2.52 114.58 120.05 1i7b h GLU 39 Ca 0.25 -0.31 -0.13 0.00 0.34 0.00 0.00 59.36 59.50 1i7b h GLU 39 Cb 0.05 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1i7b h GLU 39 CO -0.07 0.96 -0.22 -1.49 -1.16 0.00 0.00 179.01 177.03 1i7b h TRP 40 N 0.25 1.12 -0.87 4.33 -0.00 -1.14 -1.58 115.95 118.06 1i7b h TRP 40 Ca -0.03 -0.27 0.01 0.00 -0.00 0.00 0.00 58.89 58.60 1i7b h TRP 40 Cb 1.32 -0.26 -0.04 0.00 -0.00 0.00 0.00 29.16 30.17 1i7b h TRP 40 CO 0.04 1.09 0.57 -0.44 -0.00 0.00 0.00 178.44 179.70 1i7b h ASP 41 N 0.84 1.00 -0.20 -3.49 3.32 -1.10 -0.37 116.42 116.41 1i7b h ASP 41 Ca 0.11 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.07 1i7b h ASP 41 Cb 0.79 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 1i7b h ASP 41 CO 0.07 0.72 -0.10 0.40 -1.72 0.00 0.00 179.24 178.61 1i7b h ILE 42 N 1.17 1.31 -0.94 0.35 2.04 -1.31 -2.89 117.51 117.24 1i7b h ILE 42 Ca 0.32 -1.17 0.01 0.00 1.00 0.00 0.00 64.86 65.02 1i7b h ILE 42 Cb -0.14 1.64 -0.05 0.00 -0.74 0.00 0.00 36.82 37.54 1i7b h ILE 42 CO -0.07 0.35 0.61 0.25 0.00 0.00 0.00 178.15 179.30 1i7b h LEU 43 N 0.13 1.10 -1.35 1.44 6.46 -0.95 -2.66 115.31 119.47 1i7b h LEU 43 Ca 0.05 -0.04 -0.03 0.00 -0.12 0.00 0.00 57.88 57.73 1i7b h LEU 43 Cb 0.59 -0.27 -0.00 0.00 -0.73 0.00 0.00 40.66 40.24 1i7b h LEU 43 CO 0.03 0.81 -0.16 -0.07 -0.62 0.00 0.00 178.44 178.43 1i7b h LEU 44 N 1.29 0.00 -1.16 2.25 3.38 -1.03 -3.11 115.31 116.92 1i7b h LEU 44 Ca 0.34 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.30 1i7b h LEU 44 Cb -0.13 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1i7b h LEU 44 CO -0.07 0.16 0.38 0.11 0.09 0.00 0.00 178.44 179.11 1i7b h LYS 45 N 0.00 0.96 0.00 1.13 1.57 -1.25 -1.13 116.57 117.85 1i7b h LYS 45 Ca -0.00 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1i7b h LYS 45 Cb 0.62 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 1i7b h LYS 45 CO 0.02 0.71 -0.01 -0.44 -0.57 0.00 0.00 179.45 179.16 1i7b h ASP 46 N 0.97 0.00 0.96 0.86 3.45 -1.66 -2.38 116.42 118.62 1i7b h ASP 46 Ca 0.25 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.71 1i7b h ASP 46 Cb 0.03 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.80 1i7b h ASP 46 CO -0.04 0.01 -0.77 0.58 -1.57 0.00 0.00 179.24 177.45 1i7b h VAL 47 N 0.00 0.00 -2.51 -1.35 2.07 -1.35 -3.48 116.25 109.63 1i7b h VAL 47 Ca -0.00 -0.72 -0.11 0.00 0.82 0.00 0.00 66.70 66.68 1i7b h VAL 47 Cb 0.58 1.28 0.04 0.00 -1.52 0.00 0.00 31.29 31.67 1i7b h VAL 47 CO 0.00 0.00 -0.20 0.00 0.02 0.00 0.00 177.57 177.39 1i7b n GLN 48 N -2.39 -2.28 -4.03 1.57 6.02 -0.60 -5.06 117.38 110.62 1i7b n GLN 48 Ca 0.02 0.24 -0.11 0.00 -0.01 0.00 0.00 57.00 57.14 1i7b n GLN 48 Cb 0.49 -3.49 -0.05 0.00 1.02 0.00 0.00 30.24 28.21 1i7b n GLN 48 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1i7b s SER 50 N -3.10 -0.11 0.07 0.00 1.04 -0.23 -4.11 113.70 107.27 1i7b s SER 50 Ca 0.26 -0.70 -0.30 0.00 0.48 0.00 0.00 55.95 55.69 1i7b s SER 50 Cb -0.00 0.52 -0.05 0.00 0.10 0.00 0.00 66.02 66.59 1i7b s SER 50 CO 0.13 -0.99 0.97 -0.63 0.98 0.00 0.00 173.24 173.69 1i7b s ILE 51 N -3.93 4.64 0.00 -1.02 1.01 -1.26 -1.14 121.20 119.50 1i7b s ILE 51 Ca 0.14 2.06 0.00 0.00 0.00 0.00 0.00 60.65 62.86 1i7b s ILE 51 Cb 0.01 -4.32 0.00 0.00 0.01 0.00 0.00 42.46 38.16 1i7b s ILE 51 CO -0.00 0.25 0.12 2.30 0.00 0.00 0.00 174.94 177.61 1i7b n ILE 52 N 3.23 0.00 -3.57 2.92 -5.35 -0.31 -4.94 119.36 111.34 1i7b n ILE 52 Ca 0.04 -0.44 -0.16 0.00 -0.27 0.00 0.00 62.75 61.92 1i7b n ILE 52 Cb 0.50 1.03 -0.06 0.00 -1.74 0.00 0.00 39.64 39.36 1i7b n ILE 52 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1i7b s SER 53 N -0.65 -0.67 -0.01 7.28 0.15 -1.14 -4.97 113.70 113.69 1i7b s SER 53 Ca 0.00 0.96 -0.01 0.00 0.70 0.00 0.00 55.95 57.61 1i7b s SER 53 Cb 0.00 0.87 0.01 0.00 -1.71 0.00 0.00 66.02 65.19 1i7b s SER 53 CO 0.00 -0.45 0.02 -0.69 1.20 0.00 0.00 173.24 173.33 1i7b s VAL 54 N -0.57 -0.02 -0.05 4.45 1.01 -1.26 -1.35 120.40 122.61 1i7b s VAL 54 Ca -0.06 0.06 -0.02 0.00 0.00 0.00 0.00 61.98 61.96 1i7b s VAL 54 Cb -0.02 -0.05 0.04 0.00 0.00 0.00 0.00 36.38 36.34 1i7b s VAL 54 CO 0.06 0.02 0.09 -0.89 0.00 0.00 0.00 175.10 174.38 1i7b s THR 55 N 0.29 -0.10 0.04 3.92 2.01 -0.13 -5.01 115.64 116.67 1i7b s THR 55 Ca -0.02 0.27 0.07 0.00 0.31 0.00 0.00 61.69 62.32 1i7b s THR 55 Cb -0.03 -0.17 -0.03 0.00 0.01 0.00 0.00 72.50 72.27 1i7b s THR 55 CO -0.01 0.11 -0.19 -0.54 -0.69 0.00 0.00 174.62 173.30 1i7b s LYS 56 N 1.51 2.04 0.30 4.92 1.02 -1.26 -0.68 119.74 127.58 1i7b s LYS 56 Ca -0.04 -1.00 0.02 0.00 0.02 0.00 0.00 55.97 54.97 1i7b s LYS 56 Cb -0.12 -2.16 -0.05 0.00 -0.52 0.00 0.00 37.83 34.97 1i7b s LYS 56 CO -0.04 0.54 0.09 0.95 -0.92 0.00 0.00 175.35 175.97 1i7b s THR 57 N -0.91 0.72 0.24 2.17 -4.23 -0.52 -5.02 115.64 108.10 1i7b s THR 57 Ca 0.14 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.61 1i7b s THR 57 Cb -0.10 -2.65 0.21 0.00 1.34 0.00 0.00 72.50 71.30 1i7b s THR 57 CO 0.05 0.00 1.75 0.44 -0.54 0.00 0.00 174.62 176.32 1i7b h ASP 58 N 2.24 0.40 0.65 3.99 3.32 -2.05 -3.07 116.42 121.89 1i7b h ASP 58 Ca -0.38 0.09 -0.11 0.00 0.02 0.00 0.00 57.03 56.65 1i7b h ASP 58 Cb 1.25 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.81 1i7b h ASP 58 CO 0.62 0.19 -1.44 0.29 -1.72 0.00 0.00 179.24 177.18 1i7b n LYS 59 N -4.92 0.63 -3.57 3.56 5.02 -1.26 -5.01 118.16 112.60 1i7b n LYS 59 Ca 0.14 0.12 -0.13 0.00 -2.02 0.00 0.00 58.31 56.42 1i7b n LYS 59 Cb 0.37 -1.76 -0.05 0.00 -0.02 0.00 0.00 35.03 33.58 1i7b n LYS 59 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1i7b s GLN 60 N -3.10 1.07 -0.13 1.97 -2.07 -1.16 -5.15 119.66 111.09 1i7b s GLN 60 Ca -0.03 -0.37 0.02 0.00 -1.82 0.00 0.00 55.36 53.16 1i7b s GLN 60 Cb 0.09 0.48 -0.00 0.00 -1.09 0.00 0.00 33.01 32.50 1i7b s GLN 60 CO 0.82 -0.40 -0.19 -1.21 -1.32 0.00 0.00 175.29 172.98 1i7b s GLU 61 N -2.89 3.15 -0.06 9.60 2.02 -1.26 -1.45 118.70 127.82 1i7b s GLU 61 Ca -0.03 -0.80 0.02 0.00 0.02 0.00 0.00 54.97 54.18 1i7b s GLU 61 Cb -0.00 -2.47 -0.03 0.00 0.10 0.00 0.00 34.13 31.74 1i7b s GLU 61 CO -0.05 0.12 -0.11 0.00 0.02 0.00 0.00 175.26 175.24 1i7b s ALA 62 N 0.52 2.82 -0.00 5.21 0.00 0.14 -4.99 121.76 125.47 1i7b s ALA 62 Ca -0.12 -0.93 0.05 0.00 0.00 0.00 0.00 51.96 50.96 1i7b s ALA 62 Cb -0.17 -1.10 -0.02 0.00 0.00 0.00 0.00 23.12 21.84 1i7b s ALA 62 CO 0.05 0.56 -0.17 0.71 0.00 0.00 0.00 175.76 176.90 1i7b s TYR 63 N -0.74 1.53 -0.17 0.00 1.51 -1.26 -0.95 117.35 117.26 1i7b s TYR 63 Ca 0.11 -0.30 -0.07 0.00 -1.01 0.00 0.00 57.07 55.80 1i7b s TYR 63 Cb -0.11 -0.96 -0.04 0.00 -0.11 0.00 0.00 41.96 40.74 1i7b s TYR 63 CO 0.01 -0.00 0.07 0.08 -1.11 0.00 0.00 175.55 174.59 1i7b s VAL 64 N -0.49 4.85 0.38 0.71 1.01 -0.46 -4.99 120.40 121.40 1i7b s VAL 64 Ca 0.06 -0.02 0.08 0.00 0.00 0.00 0.00 61.98 62.10 1i7b s VAL 64 Cb -0.07 -3.17 -0.05 0.00 0.00 0.00 0.00 36.38 33.09 1i7b s VAL 64 CO -0.00 0.48 0.14 -0.76 0.00 0.00 0.00 175.10 174.96 1i7b s LEU 65 N 0.21 3.15 0.14 3.92 1.43 -1.26 -1.16 118.68 125.11 1i7b s LEU 65 Ca 0.05 -0.95 -0.19 0.00 -1.03 0.00 0.00 54.13 52.01 1i7b s LEU 65 Cb -0.12 -1.54 0.05 0.00 0.03 0.00 0.00 46.19 44.60 1i7b s LEU 65 CO 0.00 -0.41 0.48 -0.94 0.23 0.00 0.00 176.35 175.72 1i7b s SER 66 N -3.86 -0.37 0.00 2.29 1.04 -0.29 -4.86 113.70 107.64 1i7b s SER 66 Ca 0.39 -0.18 0.30 0.00 0.48 0.00 0.00 55.95 56.94 1i7b s SER 66 Cb 0.01 0.52 1.43 0.00 0.10 0.00 0.00 66.02 68.09 1i7b s SER 66 CO 0.22 -0.90 1.96 -0.62 0.98 0.00 0.00 173.24 174.89