#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ib7 s LYS 5 N 0.00 3.26 -0.36 1.45 2.47 -1.26 -5.01 119.74 120.28 1ib7 s LYS 5 Ca 0.00 -0.69 -0.13 0.00 -1.56 0.00 0.00 55.97 53.59 1ib7 s LYS 5 Cb 0.00 -2.88 -0.00 0.00 -1.46 0.00 0.00 37.83 33.48 1ib7 s LYS 5 CO 0.00 -0.21 0.25 0.71 0.16 0.00 0.00 175.35 176.26 1ib7 s TYR 6 N 1.42 3.23 0.05 4.03 2.02 -1.24 -0.56 117.35 126.30 1ib7 s TYR 6 Ca 0.05 -0.39 0.01 0.00 -0.37 0.00 0.00 57.07 56.37 1ib7 s TYR 6 Cb -0.14 -2.50 -0.04 0.00 -0.40 0.00 0.00 41.96 38.88 1ib7 s TYR 6 CO -0.06 -0.45 0.14 0.71 -1.57 0.00 0.00 175.55 174.32 1ib7 s TYR 7 N 1.69 3.36 0.39 2.71 2.02 0.68 -4.72 117.35 123.48 1ib7 s TYR 7 Ca 0.05 0.19 -0.24 0.00 -0.37 0.00 0.00 57.07 56.70 1ib7 s TYR 7 Cb -0.18 -1.71 -0.09 0.00 -0.40 0.00 0.00 41.96 39.58 1ib7 s TYR 7 CO 0.10 0.56 1.02 0.99 -1.57 0.00 0.00 175.55 176.65 1ib7 s THR 8 N -1.40 3.88 0.51 -0.71 2.01 -1.26 0.22 115.64 118.88 1ib7 s THR 8 Ca 0.30 1.42 0.27 0.00 0.31 0.00 0.00 61.69 63.99 1ib7 s THR 8 Cb -0.12 -3.72 0.27 0.00 0.01 0.00 0.00 72.50 68.93 1ib7 s THR 8 CO 0.23 -0.01 1.80 0.17 -0.69 0.00 0.00 174.62 176.12 1ib7 h LEU 9 N 2.52 0.00 -1.27 4.42 -0.00 -1.95 0.69 115.31 119.73 1ib7 h LEU 9 Ca -0.48 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 57.33 1ib7 h LEU 9 Cb 1.21 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.86 1ib7 h LEU 9 CO 0.62 0.00 -0.30 -0.08 -0.00 0.00 0.00 178.44 178.69 1ib7 h GLU 10 N 0.00 0.11 0.00 0.17 4.22 -2.00 -3.11 114.58 113.98 1ib7 h GLU 10 Ca 0.00 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.40 1ib7 h GLU 10 Cb 0.62 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1ib7 h GLU 10 CO 0.00 0.40 0.00 -1.91 -2.18 0.00 0.00 179.01 175.32 1ib7 n GLU 11 N -4.15 0.00 -0.20 1.92 4.07 0.24 -1.75 120.64 120.77 1ib7 n GLU 11 Ca -0.02 0.21 0.11 0.00 -0.06 0.00 0.00 57.16 57.41 1ib7 n GLU 11 Cb 0.37 -1.17 0.22 0.00 -0.06 0.00 0.00 31.44 30.80 1ib7 n GLU 11 CO 0.00 0.00 0.00 0.44 -0.06 0.00 0.00 177.13 177.51 1ib7 n ILE 12 N -1.14 -0.25 0.00 6.31 -0.00 -1.24 0.10 119.36 123.14 1ib7 n ILE 12 Ca 0.00 1.27 0.00 0.00 -0.00 0.00 0.00 62.75 64.02 1ib7 n ILE 12 Cb 0.00 -1.90 0.00 0.00 -0.00 0.00 0.00 39.64 37.74 1ib7 n ILE 12 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1ib7 n GLN 13 N -4.63 0.00 0.23 6.28 1.13 -1.15 -1.66 117.38 117.58 1ib7 n GLN 13 Ca 0.16 0.45 0.17 0.00 -1.94 0.00 0.00 57.00 55.84 1ib7 n GLN 13 Cb 0.53 -1.32 0.77 0.00 0.11 0.00 0.00 30.24 30.32 1ib7 n GLN 13 CO 0.00 0.00 0.00 1.57 -1.44 0.00 0.00 177.06 177.19 1ib7 h LYS 14 N 0.00 0.00 -1.66 -1.09 2.10 0.46 0.14 116.57 116.52 1ib7 h LYS 14 Ca 0.00 0.00 -0.63 0.00 -2.00 0.00 0.00 60.65 58.02 1ib7 h LYS 14 Cb 0.00 0.00 -0.24 0.00 -0.90 0.00 0.00 32.23 31.09 1ib7 h LYS 14 CO 0.00 0.00 0.79 0.72 -2.00 0.00 0.00 179.45 178.96 1ib7 n HIS 15 N -3.21 2.58 -1.17 0.07 8.25 0.28 -4.35 115.22 117.67 1ib7 n HIS 15 Ca 0.02 -2.40 0.01 0.00 -0.26 0.00 0.00 57.72 55.09 1ib7 n HIS 15 Cb 0.50 -1.28 0.24 0.00 1.12 0.00 0.00 29.99 30.58 1ib7 n HIS 15 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1ib7 n LYS 16 N -0.24 2.60 -4.56 -0.41 0.00 0.49 -2.07 118.16 113.97 1ib7 n LYS 16 Ca 0.52 -3.00 -0.27 0.00 0.00 0.00 0.00 58.31 55.56 1ib7 n LYS 16 Cb 0.46 -1.89 -0.11 0.00 0.00 0.00 0.00 35.03 33.49 1ib7 n LYS 16 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1ib7 s ASP 17 N -2.02 3.92 0.18 3.14 1.01 -1.21 -4.88 116.67 116.80 1ib7 s ASP 17 Ca 0.45 -1.32 -0.14 0.00 0.71 0.00 0.00 52.55 52.26 1ib7 s ASP 17 Cb 0.38 -0.40 0.11 0.00 1.01 0.00 0.00 42.92 44.01 1ib7 s ASP 17 CO 0.06 -0.43 1.80 0.28 0.21 0.00 0.00 175.17 177.10 1ib7 h SER 18 N 1.77 0.44 -0.75 0.27 0.02 -1.98 -2.10 113.55 111.23 1ib7 h SER 18 Ca -0.44 0.01 0.13 0.00 -0.84 0.00 0.00 61.79 60.66 1ib7 h SER 18 Cb 1.24 -0.08 -0.14 0.00 0.14 0.00 0.00 62.40 63.57 1ib7 h SER 18 CO 0.79 0.31 -0.31 0.11 -1.14 0.00 0.00 176.83 176.59 1ib7 h LYS 19 N 0.56 -0.07 -3.02 3.45 1.79 -1.96 -3.31 116.57 114.02 1ib7 h LYS 19 Ca 0.21 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 58.11 1ib7 h LYS 19 Cb 0.06 0.02 -0.40 0.00 -1.58 0.00 0.00 32.23 30.33 1ib7 h LYS 19 CO -0.11 -0.05 -0.78 -1.12 -1.08 0.00 0.00 179.45 176.31 1ib7 s SER 20 N -5.24 3.58 -0.38 0.86 0.01 -0.89 -4.96 113.70 106.69 1ib7 s SER 20 Ca -0.14 -1.84 -0.15 0.00 1.31 0.00 0.00 55.95 55.13 1ib7 s SER 20 Cb 0.19 -0.64 0.00 0.00 0.21 0.00 0.00 66.02 65.79 1ib7 s SER 20 CO 0.72 -0.37 0.33 -0.89 0.41 0.00 0.00 173.24 173.44 1ib7 s THR 21 N 1.41 5.21 0.24 1.44 2.01 -0.84 -3.31 115.64 121.79 1ib7 s THR 21 Ca 0.13 -0.33 0.11 0.00 0.31 0.00 0.00 61.69 61.91 1ib7 s THR 21 Cb -0.20 -3.88 -0.05 0.00 0.01 0.00 0.00 72.50 68.39 1ib7 s THR 21 CO -0.18 -0.22 -0.17 0.26 -0.69 0.00 0.00 174.62 173.62 1ib7 s TRP 22 N 1.87 2.40 -0.23 4.92 0.52 -0.88 -2.73 118.94 124.82 1ib7 s TRP 22 Ca 0.08 -0.31 -0.09 0.00 0.02 0.00 0.00 56.10 55.81 1ib7 s TRP 22 Cb -0.18 -1.11 0.09 0.00 -1.15 0.00 0.00 33.47 31.13 1ib7 s TRP 22 CO 0.11 0.61 0.50 0.54 0.02 0.00 0.00 176.95 178.73 1ib7 s VAL 23 N -2.12 -0.54 -0.23 4.03 0.11 -1.18 -0.96 120.40 119.50 1ib7 s VAL 23 Ca 0.27 0.10 -0.29 0.00 -2.93 0.00 0.00 61.98 59.13 1ib7 s VAL 23 Cb -0.07 -0.77 -0.03 0.00 -1.53 0.00 0.00 36.38 33.99 1ib7 s VAL 23 CO 0.14 0.04 1.68 -0.63 -3.33 0.00 0.00 175.10 173.00 1ib7 s ILE 24 N 2.35 3.61 -0.16 7.04 1.01 -1.22 -0.47 121.20 133.35 1ib7 s ILE 24 Ca -0.05 0.67 0.00 0.00 0.00 0.00 0.00 60.65 61.28 1ib7 s ILE 24 Cb -0.11 -3.65 0.03 0.00 0.01 0.00 0.00 42.46 38.74 1ib7 s ILE 24 CO -0.15 -0.30 -0.13 -0.76 0.00 0.00 0.00 174.94 173.60 1ib7 s LEU 25 N 5.60 1.80 -1.16 2.97 1.02 0.25 -3.09 118.68 126.07 1ib7 s LEU 25 Ca 0.74 -0.58 -0.31 0.00 0.02 0.00 0.00 54.13 54.00 1ib7 s LEU 25 Cb -0.25 -1.17 0.04 0.00 0.02 0.00 0.00 46.19 44.84 1ib7 s LEU 25 CO 0.31 -0.09 0.67 1.41 0.02 0.00 0.00 176.35 178.67 1ib7 n HIS 26 N 4.76 -1.45 -3.82 0.29 8.25 -1.26 0.28 115.22 122.27 1ib7 n HIS 26 Ca -0.16 0.15 -0.24 0.00 -0.26 0.00 0.00 57.72 57.21 1ib7 n HIS 26 Cb 0.49 -2.74 0.01 0.00 1.12 0.00 0.00 29.99 28.87 1ib7 n HIS 26 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1ib7 n HIS 27 N -4.75 -1.78 -3.23 4.41 1.44 -1.26 -4.95 115.22 105.10 1ib7 n HIS 27 Ca -0.14 0.75 0.04 0.00 -2.01 0.00 0.00 57.72 56.36 1ib7 n HIS 27 Cb 0.58 -3.96 -0.02 0.00 0.12 0.00 0.00 29.99 26.71 1ib7 n HIS 27 CO 0.00 0.00 0.00 0.21 -2.81 0.00 0.00 176.34 173.74 1ib7 s LYS 28 N -6.25 0.29 0.34 -1.40 2.47 0.14 -4.65 119.74 110.69 1ib7 s LYS 28 Ca 0.06 0.58 -0.27 0.00 -1.56 0.00 0.00 55.97 54.77 1ib7 s LYS 28 Cb -0.02 0.33 -0.09 0.00 -1.46 0.00 0.00 37.83 36.59 1ib7 s LYS 28 CO 0.86 -0.24 1.17 0.14 0.16 0.00 0.00 175.35 177.43 1ib7 s VAL 29 N 2.78 3.20 -0.28 4.02 -7.23 -0.80 0.86 120.40 122.95 1ib7 s VAL 29 Ca 0.02 1.11 0.00 0.00 -1.81 0.00 0.00 61.98 61.31 1ib7 s VAL 29 Cb -0.10 -3.67 0.05 0.00 0.56 0.00 0.00 36.38 33.23 1ib7 s VAL 29 CO -0.15 0.19 -0.05 -0.31 -0.31 0.00 0.00 175.10 174.48 1ib7 s TYR 30 N -1.29 3.27 -1.33 2.82 1.51 0.38 -4.27 117.35 118.44 1ib7 s TYR 30 Ca 0.51 -2.06 -0.17 0.00 -1.01 0.00 0.00 57.07 54.34 1ib7 s TYR 30 Cb -0.33 -2.03 0.05 0.00 -0.11 0.00 0.00 41.96 39.54 1ib7 s TYR 30 CO 0.42 -0.83 1.89 -3.47 -1.11 0.00 0.00 175.55 172.44 1ib7 n ASP 31 N 4.55 4.54 -2.07 2.29 -0.08 -0.91 -3.13 116.55 121.74 1ib7 n ASP 31 Ca -0.14 -2.89 -0.24 0.00 -1.51 0.00 0.00 54.79 50.02 1ib7 n ASP 31 Cb 0.43 -1.71 0.06 0.00 2.34 0.00 0.00 41.12 42.23 1ib7 n ASP 31 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ib7 n LEU 32 N 7.94 6.95 0.02 -2.67 -0.00 -1.10 -4.53 117.00 123.60 1ib7 n LEU 32 Ca 0.50 -3.69 -0.12 0.00 -0.00 0.00 0.00 56.01 52.70 1ib7 n LEU 32 Cb 0.44 -1.02 -0.07 0.00 -0.00 0.00 0.00 43.42 42.77 1ib7 n LEU 32 CO 0.81 1.31 0.84 0.74 -0.00 0.00 0.00 177.39 181.09 1ib7 h THR 33 N 0.99 1.08 -0.45 1.47 2.02 -1.85 0.76 112.91 116.93 1ib7 h THR 33 Ca 0.43 -0.24 -0.10 0.00 0.77 0.00 0.00 66.41 67.27 1ib7 h THR 33 Cb 0.92 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.49 1ib7 h THR 33 CO 1.10 0.07 -0.10 0.11 0.37 0.00 0.00 175.52 177.07 1ib7 h LYS 34 N -0.04 0.87 -0.83 6.66 6.56 -1.91 -2.44 116.57 125.44 1ib7 h LYS 34 Ca 0.01 -0.33 -0.04 0.00 -1.06 0.00 0.00 60.65 59.23 1ib7 h LYS 34 Cb 0.09 -0.05 -0.03 0.00 -0.57 0.00 0.00 32.23 31.67 1ib7 h LYS 34 CO -0.00 0.96 0.06 0.98 -2.06 0.00 0.00 179.45 179.39 1ib7 n TYR 35 N -4.27 1.13 -0.03 -1.35 9.36 -1.09 -4.13 117.16 116.78 1ib7 n TYR 35 Ca -0.00 -0.50 -0.13 0.00 3.32 0.00 0.00 57.90 60.59 1ib7 n TYR 35 Cb 0.37 -0.36 -0.10 0.00 -0.63 0.00 0.00 39.34 38.62 1ib7 n TYR 35 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 1ib7 h LEU 36 N 1.83 -0.03 -0.06 2.98 7.12 0.11 -2.49 115.31 124.77 1ib7 h LEU 36 Ca 0.05 -0.66 0.00 0.00 0.13 0.00 0.00 57.88 57.40 1ib7 h LEU 36 Cb 1.36 0.01 0.00 0.00 -0.53 0.00 0.00 40.66 41.50 1ib7 h LEU 36 CO 0.30 0.68 -0.35 -1.84 -0.13 0.00 0.00 178.44 177.11 1ib7 n GLU 37 N -4.76 0.12 0.12 1.25 0.28 -1.26 -3.49 120.64 112.90 1ib7 n GLU 37 Ca -0.09 -0.06 0.06 0.00 -0.16 0.00 0.00 57.16 56.92 1ib7 n GLU 37 Cb 0.34 -1.50 0.02 0.00 1.43 0.00 0.00 31.44 31.73 1ib7 n GLU 37 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 1ib7 h GLU 38 N 0.14 0.00 -6.28 3.44 4.57 -1.72 -3.47 114.58 111.26 1ib7 h GLU 38 Ca 0.00 0.00 -0.67 0.00 -1.18 0.00 0.00 59.36 57.51 1ib7 h GLU 38 Cb 0.49 0.00 0.04 0.00 -0.16 0.00 0.00 28.75 29.12 1ib7 h GLU 38 CO 0.00 0.23 0.68 1.58 -1.18 0.00 0.00 179.01 180.32 1ib7 n HIS 39 N -2.98 1.85 0.13 0.92 -0.00 -0.94 -4.85 115.22 109.35 1ib7 n HIS 39 Ca -0.01 0.49 -0.01 0.00 0.46 0.00 0.00 57.72 58.65 1ib7 n HIS 39 Cb 0.68 -2.43 0.11 0.00 -0.12 0.00 0.00 29.99 28.23 1ib7 n HIS 39 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1ib7 h PRO 40 N 5.89 0.00 0.12 1.57 0.13 -1.91 -3.35 132.00 134.44 1ib7 h PRO 40 Ca -0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1ib7 h PRO 40 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1ib7 h PRO 40 CO 0.86 0.67 -0.06 0.78 -0.23 0.00 0.00 178.00 180.02 1ib7 h GLY 41 N 2.35 -0.16 -4.87 1.56 0.00 -1.99 -3.49 103.07 96.48 1ib7 h GLY 41 Ca -0.01 0.06 0.16 0.00 0.00 0.00 0.00 47.33 47.54 1ib7 h GLY 41 CO 0.09 -0.06 0.75 -0.32 0.00 0.00 0.00 176.54 177.00 1ib7 s GLY 42 N -1.53 -0.04 0.26 4.60 0.00 -1.26 -5.02 107.32 104.33 1ib7 s GLY 42 Ca -0.02 2.57 0.23 0.00 0.00 0.00 0.00 44.72 47.50 1ib7 s GLY 42 CO 0.07 1.21 1.34 1.05 0.00 0.00 0.00 173.10 176.76 1ib7 h GLU 43 N 2.50 0.00 0.00 2.90 4.11 -1.82 -3.35 114.58 118.93 1ib7 h GLU 43 Ca -0.15 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.20 1ib7 h GLU 43 Cb 1.18 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 1ib7 h GLU 43 CO 0.24 0.00 -0.51 1.49 0.07 0.00 0.00 179.01 180.31 1ib7 h GLU 44 N 0.00 0.00 -1.75 1.06 4.81 -1.95 -2.78 114.58 113.97 1ib7 h GLU 44 Ca 0.00 0.00 0.51 0.00 -0.13 0.00 0.00 59.36 59.74 1ib7 h GLU 44 Cb 0.92 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 30.23 1ib7 h GLU 44 CO 0.00 0.59 1.38 -0.24 -0.73 0.00 0.00 179.01 180.01 1ib7 h VAL 45 N -1.00 0.01 0.00 0.32 3.04 -1.96 2.07 116.25 118.73 1ib7 h VAL 45 Ca -0.11 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.58 1ib7 h VAL 45 Cb 0.79 0.01 0.00 0.00 -2.01 0.00 0.00 31.29 30.08 1ib7 h VAL 45 CO -0.07 0.00 -0.22 -0.07 -1.01 0.00 0.00 177.57 176.21 1ib7 h LEU 46 N 0.00 0.00 0.44 3.16 3.38 -1.70 -3.34 115.31 117.26 1ib7 h LEU 46 Ca 0.83 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.79 1ib7 h LEU 46 Cb 3.58 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 44.31 1ib7 h LEU 46 CO -0.01 0.53 -0.35 0.03 0.09 0.00 0.00 178.44 178.73 1ib7 h ARG 47 N -0.85 -0.76 -0.71 1.13 3.08 -0.12 1.11 114.38 117.27 1ib7 h ARG 47 Ca 0.00 0.05 0.22 0.00 0.07 0.00 0.00 59.98 60.32 1ib7 h ARG 47 Cb 0.22 0.17 -0.13 0.00 0.08 0.00 0.00 29.97 30.31 1ib7 h ARG 47 CO 0.00 -0.50 0.10 -1.91 -1.07 0.00 0.00 179.97 176.58 1ib7 n GLU 48 N -5.47 -0.05 -2.54 0.04 4.07 0.66 0.41 120.64 117.76 1ib7 n GLU 48 Ca -0.11 1.04 -0.17 0.00 -0.06 0.00 0.00 57.16 57.86 1ib7 n GLU 48 Cb 0.37 -1.70 0.02 0.00 -0.06 0.00 0.00 31.44 30.06 1ib7 n GLU 48 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1ib7 n GLN 49 N -4.88 2.40 0.00 5.31 10.64 -0.87 -4.93 117.38 125.04 1ib7 n GLN 49 Ca 0.19 -3.89 0.00 0.00 -1.83 0.00 0.00 57.00 51.47 1ib7 n GLN 49 Cb 0.63 -1.80 0.00 0.00 -0.86 0.00 0.00 30.24 28.21 1ib7 n GLN 49 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ib7 n ALA 50 N -0.35 0.00 -0.54 2.61 0.00 0.38 -3.93 120.51 118.68 1ib7 n ALA 50 Ca 0.25 0.00 0.44 0.00 0.00 0.00 0.00 53.44 54.12 1ib7 n ALA 50 Cb 0.77 0.00 0.73 0.00 0.00 0.00 0.00 19.45 20.95 1ib7 n ALA 50 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1ib7 h GLY 51 N 0.00 0.65 0.00 0.00 0.00 -1.10 -3.33 103.07 99.29 1ib7 h GLY 51 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1ib7 h GLY 51 CO 0.00 -0.20 0.00 0.61 0.00 0.00 0.00 176.54 176.95 1ib7 n GLY 52 N -1.71 -3.51 2.86 4.60 0.00 -1.25 -4.48 105.19 101.70 1ib7 n GLY 52 Ca 0.39 -0.83 -0.29 0.00 0.00 0.00 0.00 46.02 45.30 1ib7 n GLY 52 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ib7 s ASP 53 N -2.02 3.30 -0.16 1.61 2.15 -1.26 -3.46 116.67 116.83 1ib7 s ASP 53 Ca 0.00 -0.94 0.17 0.00 0.43 0.00 0.00 52.55 52.20 1ib7 s ASP 53 Cb 0.00 -0.92 0.47 0.00 -0.30 0.00 0.00 42.92 42.17 1ib7 s ASP 53 CO 0.00 -0.25 1.36 0.00 -0.17 0.00 0.00 175.17 176.11 1ib7 n ALA 54 N 4.85 2.81 0.07 3.66 0.00 -1.23 -4.73 120.51 125.93 1ib7 n ALA 54 Ca -0.11 -2.29 -0.14 0.00 0.00 0.00 0.00 53.44 50.90 1ib7 n ALA 54 Cb 0.46 -0.63 -0.09 0.00 0.00 0.00 0.00 19.45 19.19 1ib7 n ALA 54 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1ib7 h THR 55 N 1.46 0.00 -0.59 0.00 2.02 -1.91 1.43 112.91 115.32 1ib7 h THR 55 Ca 0.00 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.09 1ib7 h THR 55 Cb 1.31 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 1ib7 h THR 55 CO 0.17 0.00 0.01 -0.33 0.37 0.00 0.00 175.52 175.74 1ib7 h GLU 56 N -0.62 1.03 0.00 6.66 5.08 -1.91 0.38 114.58 125.20 1ib7 h GLU 56 Ca 0.00 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1ib7 h GLU 56 Cb 0.65 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1ib7 h GLU 56 CO -0.28 1.01 0.00 0.09 -1.00 0.00 0.00 179.01 178.83 1ib7 n ASN 57 N -4.22 0.44 -0.13 1.42 3.02 -0.89 0.19 115.26 115.09 1ib7 n ASN 57 Ca 0.03 0.64 -0.18 0.00 -0.03 0.00 0.00 54.58 55.03 1ib7 n ASN 57 Cb 0.34 -0.72 -0.12 0.00 -0.61 0.00 0.00 39.78 38.66 1ib7 n ASN 57 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1ib7 n PHE 58 N -2.02 0.01 0.05 3.10 7.35 0.49 -4.12 117.46 122.32 1ib7 n PHE 58 Ca 0.01 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.62 1ib7 n PHE 58 Cb 0.14 -1.00 -0.12 0.00 0.35 0.00 0.00 39.48 38.84 1ib7 n PHE 58 CO 0.00 0.00 0.00 1.05 -0.76 0.00 0.00 176.76 177.05 1ib7 h GLU 59 N -0.03 0.02 -0.58 -4.13 -0.00 0.11 -3.22 114.58 106.74 1ib7 h GLU 59 Ca -0.58 -0.03 0.00 0.00 -0.00 0.00 0.00 59.36 58.75 1ib7 h GLU 59 Cb 1.89 0.01 -0.03 0.00 -0.00 0.00 0.00 28.75 30.63 1ib7 h GLU 59 CO -0.10 0.95 0.37 0.22 -0.00 0.00 0.00 179.01 180.45 1ib7 h ASP 60 N 0.01 0.68 0.64 3.06 1.82 0.19 0.80 116.42 123.62 1ib7 h ASP 60 Ca -0.06 -0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.55 1ib7 h ASP 60 Cb 1.82 -0.17 0.00 0.00 0.68 0.00 0.00 39.33 41.66 1ib7 h ASP 60 CO 0.13 0.51 0.00 -0.37 -1.61 0.00 0.00 179.24 177.90 1ib7 h VAL 61 N 0.79 0.00 -4.98 2.25 -1.51 -1.71 -3.47 116.25 107.62 1ib7 h VAL 61 Ca 0.21 -0.28 0.00 0.00 -1.23 0.00 0.00 66.70 65.41 1ib7 h VAL 61 Cb -0.06 1.12 0.00 0.00 -2.13 0.00 0.00 31.29 30.22 1ib7 h VAL 61 CO -0.04 0.00 -0.63 0.61 -1.23 0.00 0.00 177.57 176.28 1ib7 n GLY 62 N -0.31 -2.46 3.76 5.19 0.00 0.27 -4.94 105.19 106.70 1ib7 n GLY 62 Ca 0.00 0.82 -0.40 0.00 0.00 0.00 0.00 46.02 46.44 1ib7 n GLY 62 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ib7 s HIS 63 N -2.03 3.37 0.77 1.61 3.76 -1.25 -5.03 115.29 116.49 1ib7 s HIS 63 Ca 0.13 1.59 -0.10 0.00 -0.15 0.00 0.00 55.06 56.53 1ib7 s HIS 63 Cb -0.04 -3.43 0.07 0.00 1.11 0.00 0.00 32.58 30.29 1ib7 s HIS 63 CO 0.69 -1.05 1.11 -1.12 -0.85 0.00 0.00 174.74 173.52 1ib7 s SER 64 N -0.74 4.63 0.22 1.40 0.01 -1.26 -4.89 113.70 113.07 1ib7 s SER 64 Ca 0.46 0.64 -0.08 0.00 1.31 0.00 0.00 55.95 58.28 1ib7 s SER 64 Cb -0.35 -1.20 0.35 0.00 0.21 0.00 0.00 66.02 65.04 1ib7 s SER 64 CO 0.45 -1.78 1.69 0.74 0.41 0.00 0.00 173.24 174.75 1ib7 h THR 65 N -0.87 0.56 -1.00 1.44 2.02 -2.00 0.19 112.91 113.26 1ib7 h THR 65 Ca -0.45 -0.08 0.39 0.00 0.77 0.00 0.00 66.41 67.03 1ib7 h THR 65 Cb 1.32 0.31 -0.17 0.00 -1.74 0.00 0.00 68.15 67.87 1ib7 h THR 65 CO 0.64 0.04 0.50 -0.78 0.37 0.00 0.00 175.52 176.29 1ib7 h ASP 66 N 0.23 0.29 -0.14 4.18 3.58 -2.01 1.50 116.42 124.05 1ib7 h ASP 66 Ca 0.35 0.25 -0.05 0.00 0.42 0.00 0.00 57.03 58.00 1ib7 h ASP 66 Cb 0.56 0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.87 1ib7 h ASP 66 CO -0.47 -0.37 -0.11 0.00 -2.88 0.00 0.00 179.24 175.41 1ib7 h ALA 67 N 1.96 0.20 -0.93 -0.78 0.00 -0.98 -2.89 119.26 115.84 1ib7 h ALA 67 Ca 0.80 -0.30 0.27 0.00 0.00 0.00 0.00 54.91 55.68 1ib7 h ALA 67 Cb 2.03 -0.04 -0.16 0.00 0.00 0.00 0.00 17.79 19.61 1ib7 h ALA 67 CO -0.75 0.04 0.15 -0.09 0.00 0.00 0.00 179.25 178.60 1ib7 h ARG 68 N -0.05 0.08 0.04 0.00 2.43 0.24 1.18 114.38 118.31 1ib7 h ARG 68 Ca 0.03 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1ib7 h ARG 68 Cb 0.61 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 1ib7 h ARG 68 CO 0.03 0.05 -0.02 0.93 -1.51 0.00 0.00 179.97 179.45 1ib7 h GLU 69 N 0.08 -0.06 0.34 0.20 4.39 -1.26 -2.12 114.58 116.16 1ib7 h GLU 69 Ca 0.60 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 60.28 1ib7 h GLU 69 Cb 1.26 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.93 1ib7 h GLU 69 CO -0.80 0.16 -0.16 -0.07 -1.16 0.00 0.00 179.01 176.98 1ib7 h LEU 70 N -0.27 -0.38 -0.70 1.33 4.07 -0.00 0.11 115.31 119.47 1ib7 h LEU 70 Ca -0.01 0.01 0.10 0.00 0.08 0.00 0.00 57.88 58.06 1ib7 h LEU 70 Cb 0.24 0.10 -0.11 0.00 1.08 0.00 0.00 40.66 41.98 1ib7 h LEU 70 CO 0.01 -0.27 -0.30 -1.54 -1.08 0.00 0.00 178.44 175.26 1ib7 n SER 71 N -3.27 -0.52 0.05 -0.43 3.41 0.36 0.23 113.62 113.46 1ib7 n SER 71 Ca -0.06 1.22 -0.11 0.00 -0.26 0.00 0.00 58.87 59.66 1ib7 n SER 71 Cb 0.18 -0.25 -0.06 0.00 -0.26 0.00 0.00 64.21 63.82 1ib7 n SER 71 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1ib7 h LYS 72 N 0.00 -0.13 -0.08 4.33 1.79 -1.30 -0.93 116.57 120.25 1ib7 h LYS 72 Ca 0.21 0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.71 1ib7 h LYS 72 Cb 0.39 0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.06 1ib7 h LYS 72 CO -0.68 -0.09 0.06 1.15 -1.08 0.00 0.00 179.45 178.81 1ib7 h THR 73 N -0.14 0.96 -1.00 -0.16 2.02 0.50 -1.18 112.91 113.91 1ib7 h THR 73 Ca 0.03 0.00 -0.68 0.00 0.77 0.00 0.00 66.41 66.53 1ib7 h THR 73 Cb 0.17 0.96 -0.29 0.00 -1.74 0.00 0.00 68.15 67.24 1ib7 h THR 73 CO -0.07 0.00 0.87 -1.22 0.37 0.00 0.00 175.52 175.47 1ib7 n TYR 74 N -4.51 3.23 -4.87 3.16 4.02 0.63 -4.93 117.16 113.89 1ib7 n TYR 74 Ca -0.01 -3.01 -0.33 0.00 -0.01 0.00 0.00 57.90 54.54 1ib7 n TYR 74 Cb 0.17 -1.44 -0.13 0.00 -0.02 0.00 0.00 39.34 37.92 1ib7 n TYR 74 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 176.86 174.35 1ib7 s ILE 75 N -4.79 3.12 0.00 -0.72 2.07 -0.45 -2.13 121.20 118.30 1ib7 s ILE 75 Ca 0.65 -0.70 0.00 0.00 -1.41 0.00 0.00 60.65 59.19 1ib7 s ILE 75 Cb 0.51 -2.22 0.00 0.00 0.13 0.00 0.00 42.46 40.87 1ib7 s ILE 75 CO -0.01 0.59 0.00 2.30 -1.91 0.00 0.00 174.94 175.91 1ib7 n ILE 76 N 2.31 0.00 -1.47 2.00 -0.00 -1.26 -4.98 119.36 115.97 1ib7 n ILE 76 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.58 1ib7 n ILE 76 Cb 0.52 -0.49 0.00 0.00 -0.00 0.00 0.00 39.64 39.67 1ib7 n ILE 76 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1ib7 n GLY 77 N 2.86 -1.74 3.83 3.28 0.00 -1.26 -4.47 105.19 107.69 1ib7 n GLY 77 Ca 0.00 -1.11 -0.22 0.00 0.00 0.00 0.00 46.02 44.69 1ib7 n GLY 77 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ib7 s GLU 78 N -1.59 2.43 0.11 1.61 -1.05 0.27 -1.90 118.70 118.59 1ib7 s GLU 78 Ca 0.00 -1.64 0.04 0.00 -0.15 0.00 0.00 54.97 53.22 1ib7 s GLU 78 Cb 0.00 -2.25 -0.04 0.00 -0.44 0.00 0.00 34.13 31.40 1ib7 s GLU 78 CO 0.00 -0.17 0.12 -0.48 0.95 0.00 0.00 175.26 175.68 1ib7 s LEU 79 N -4.06 3.87 -0.53 1.83 -0.00 -1.26 -0.23 118.68 118.29 1ib7 s LEU 79 Ca 0.46 -0.03 -0.39 0.00 -0.00 0.00 0.00 54.13 54.17 1ib7 s LEU 79 Cb -0.01 -2.51 -0.18 0.00 -0.00 0.00 0.00 46.19 43.49 1ib7 s LEU 79 CO 0.26 0.13 2.07 1.57 -0.00 0.00 0.00 176.35 180.38 1ib7 n HIS 80 N 0.08 1.01 1.51 3.48 -0.00 0.58 -4.71 115.22 117.17 1ib7 n HIS 80 Ca -0.08 0.67 0.11 0.00 -0.00 0.00 0.00 57.72 58.42 1ib7 n HIS 80 Cb 0.53 -2.15 0.66 0.00 -0.00 0.00 0.00 29.99 29.03 1ib7 n HIS 80 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 1ib7 n PRO 81 N 7.13 0.75 0.00 1.57 -0.04 -1.26 -2.56 135.00 140.60 1ib7 n PRO 81 Ca 0.53 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.81 1ib7 n PRO 81 Cb -0.03 -1.46 -0.12 0.00 -0.04 0.00 0.00 33.50 31.85 1ib7 n PRO 81 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1ib7 h ASP 82 N 0.00 0.45 0.32 3.54 3.58 -1.98 -3.19 116.42 119.15 1ib7 h ASP 82 Ca 0.00 -0.80 0.00 0.00 0.42 0.00 0.00 57.03 56.65 1ib7 h ASP 82 Cb 0.00 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 40.91 1ib7 h ASP 82 CO 0.00 1.20 -0.41 0.47 -2.88 0.00 0.00 179.24 177.62 1ib7 n ASP 83 N -4.26 0.85 -0.01 2.28 8.00 -1.16 -3.87 116.55 118.38 1ib7 n ASP 83 Ca -0.11 -0.65 -0.11 0.00 0.71 0.00 0.00 54.79 54.63 1ib7 n ASP 83 Cb 0.66 0.25 0.02 0.00 -0.02 0.00 0.00 41.12 42.03 1ib7 n ASP 83 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 1ib7 h ARG 84 N 0.68 0.63 -1.77 -1.24 2.43 -1.52 -3.13 114.38 110.47 1ib7 h ARG 84 Ca 0.00 -0.42 -0.45 0.00 -0.81 0.00 0.00 59.98 58.30 1ib7 h ARG 84 Cb 0.51 0.06 -0.17 0.00 -0.42 0.00 0.00 29.97 29.95 1ib7 h ARG 84 CO 0.00 1.04 0.43 0.45 -1.51 0.00 0.00 179.97 180.39 1ib7 n SER 85 N -3.95 6.55 0.19 -3.80 2.88 -1.21 -4.33 113.62 109.96 1ib7 n SER 85 Ca -0.04 -3.19 0.09 0.00 -1.33 0.00 0.00 58.87 54.39 1ib7 n SER 85 Cb 0.64 -1.15 0.16 0.00 -0.75 0.00 0.00 64.21 63.10 1ib7 n SER 85 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1ib7 h LYS 86 N 2.38 0.00 0.00 -1.46 3.64 -1.78 -3.30 116.57 116.05 1ib7 h LYS 86 Ca 0.37 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.73 1ib7 h LYS 86 Cb 0.79 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1ib7 h LYS 86 CO 0.88 0.20 -0.17 0.82 -2.27 0.00 0.00 179.45 178.91 1ib7 h ILE 87 N 0.00 0.87 0.00 2.00 5.03 -1.88 -3.53 117.51 120.00 1ib7 h ILE 87 Ca -0.00 -1.70 0.00 0.00 -0.12 0.00 0.00 64.86 63.04 1ib7 h ILE 87 Cb 1.11 1.70 0.00 0.00 -3.03 0.00 0.00 36.82 36.59 1ib7 h ILE 87 CO 0.03 0.30 0.00 0.00 -0.68 0.00 0.00 178.15 177.79