#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kvi n ASP 2 N 0.00 2.50 0.00 7.83 9.92 -1.26 -4.84 116.55 130.71 1kvi n ASP 2 Ca 0.00 -3.17 0.11 0.00 -0.53 0.00 0.00 54.79 51.19 1kvi n ASP 2 Cb 0.00 -0.54 0.60 0.00 -0.64 0.00 0.00 41.12 40.54 1kvi n ASP 2 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 1kvi n PRO 3 N -0.09 0.56 0.13 -0.24 -0.04 -1.26 -4.60 135.00 129.45 1kvi n PRO 3 Ca 0.23 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 1kvi n PRO 3 Cb 0.67 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.63 1kvi n PRO 3 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1kvi n SER 4 N -1.08 -2.27 -3.54 3.54 7.64 -1.26 -5.04 113.62 111.60 1kvi n SER 4 Ca 0.14 0.59 -0.21 0.00 1.01 0.00 0.00 58.87 60.41 1kvi n SER 4 Cb 0.10 2.30 0.01 0.00 -1.01 0.00 0.00 64.21 65.61 1kvi n SER 4 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 1kvi n MET 5 N -3.03 -1.60 0.00 1.43 2.81 -1.26 -4.18 117.12 111.28 1kvi n MET 5 Ca 0.00 1.09 0.00 0.00 -1.81 0.00 0.00 57.70 56.98 1kvi n MET 5 Cb 0.00 -3.18 0.00 0.00 -0.71 0.00 0.00 33.22 29.33 1kvi n MET 5 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1kvi n GLY 6 N -1.38 0.76 3.39 3.03 0.00 -1.26 -5.12 105.19 104.61 1kvi n GLY 6 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 1kvi n GLY 6 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kvi s VAL 7 N -1.56 0.05 -0.05 1.61 1.01 -1.26 -3.85 120.40 116.35 1kvi s VAL 7 Ca 0.00 -0.77 -0.15 0.00 0.00 0.00 0.00 61.98 61.06 1kvi s VAL 7 Cb 0.00 -1.41 0.03 0.00 0.00 0.00 0.00 36.38 35.00 1kvi s VAL 7 CO 0.00 -0.25 0.35 0.20 0.00 0.00 0.00 175.10 175.40 1kvi s ASN 8 N -2.85 -0.28 -0.10 3.32 -0.87 -0.80 -4.81 114.94 108.55 1kvi s ASN 8 Ca 0.07 0.32 -0.03 0.00 -1.57 0.00 0.00 52.86 51.66 1kvi s ASN 8 Cb 0.01 0.46 -0.03 0.00 -0.02 0.00 0.00 41.25 41.67 1kvi s ASN 8 CO -0.07 -0.37 0.01 -0.55 -2.57 0.00 0.00 177.10 173.55 1kvi s SER 9 N -0.88 5.28 -0.07 -1.22 0.15 -1.26 -0.29 113.70 115.40 1kvi s SER 9 Ca -0.09 0.13 0.03 0.00 0.70 0.00 0.00 55.95 56.72 1kvi s SER 9 Cb -0.04 -1.56 0.00 0.00 -1.71 0.00 0.00 66.02 62.71 1kvi s SER 9 CO 0.04 0.35 -0.18 -0.69 1.20 0.00 0.00 173.24 173.95 1kvi s VAL 10 N -0.68 1.56 -0.05 4.45 1.01 0.17 -4.97 120.40 121.88 1kvi s VAL 10 Ca 0.11 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.39 1kvi s VAL 10 Cb -0.12 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.87 1kvi s VAL 10 CO 0.02 0.45 -0.16 0.42 0.00 0.00 0.00 175.10 175.83 1kvi s THR 11 N 0.40 2.92 0.16 3.92 -4.23 -1.26 -1.98 115.64 115.57 1kvi s THR 11 Ca -0.14 -0.78 -0.02 0.00 -1.18 0.00 0.00 61.69 59.58 1kvi s THR 11 Cb -0.16 -2.13 -0.04 0.00 1.34 0.00 0.00 72.50 71.52 1kvi s THR 11 CO 0.05 0.59 0.12 0.27 -0.54 0.00 0.00 174.62 175.11 1kvi s ILE 12 N -0.68 0.06 0.07 2.99 -5.25 -0.97 -2.65 121.20 114.78 1kvi s ILE 12 Ca 0.11 -1.88 -0.18 0.00 -0.99 0.00 0.00 60.65 57.71 1kvi s ILE 12 Cb -0.11 -2.20 -0.07 0.00 2.95 0.00 0.00 42.46 43.04 1kvi s ILE 12 CO 0.00 -0.27 0.54 -0.44 -1.79 0.00 0.00 174.94 172.99 1kvi s SER 13 N -3.08 6.98 -0.01 4.36 0.01 0.25 -1.66 113.70 120.55 1kvi s SER 13 Ca 0.29 1.18 0.03 0.00 1.31 0.00 0.00 55.95 58.76 1kvi s SER 13 Cb 0.07 -2.33 -0.03 0.00 0.21 0.00 0.00 66.02 63.93 1kvi s SER 13 CO 0.06 0.25 -0.06 -0.69 0.41 0.00 0.00 173.24 173.21 1kvi s VAL 14 N -1.17 3.70 0.00 3.43 1.01 -0.37 -1.47 120.40 125.53 1kvi s VAL 14 Ca 0.30 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1kvi s VAL 14 Cb -0.18 -2.60 0.00 0.00 0.00 0.00 0.00 36.38 33.60 1kvi s VAL 14 CO 0.18 0.43 0.52 1.21 0.00 0.00 0.00 175.10 177.43 1kvi n GLU 15 N 1.65 0.00 -2.84 2.72 2.13 -1.00 -4.30 120.64 119.01 1kvi n GLU 15 Ca -0.16 -0.46 -0.11 0.00 0.66 0.00 0.00 57.16 57.09 1kvi n GLU 15 Cb 0.53 0.41 0.06 0.00 0.27 0.00 0.00 31.44 32.70 1kvi n GLU 15 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1kvi n GLY 16 N 0.00 1.58 0.00 8.31 0.00 -1.24 -4.75 105.19 109.09 1kvi n GLY 16 Ca -0.13 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1kvi n GLY 16 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1kvi n MET 17 N 0.16 3.84 0.00 1.61 2.81 -1.26 -3.64 117.12 120.64 1kvi n MET 17 Ca 0.10 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.99 1kvi n MET 17 Cb 0.72 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.23 1kvi n MET 17 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1kvi n THR 18 N 0.00 0.00 -0.25 2.03 -1.04 -1.26 -5.07 114.28 108.69 1kvi n THR 18 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1kvi n THR 18 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1kvi n THR 18 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1kvi h ASN 20 N 0.00 0.00 0.00 0.00 4.21 -2.03 0.62 115.58 118.38 1kvi h ASN 20 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1kvi h ASN 20 Cb 0.00 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.20 1kvi h ASN 20 CO 0.00 0.00 0.06 -1.54 -1.29 0.00 0.00 177.43 174.66 1kvi n SER 21 N -3.41 0.11 0.00 5.81 3.41 -1.26 -2.58 113.62 115.69 1kvi n SER 21 Ca 0.15 0.50 0.00 0.00 -0.26 0.00 0.00 58.87 59.26 1kvi n SER 21 Cb 1.06 -0.51 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 1kvi n SER 21 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1kvi h VAL 23 N 0.00 1.67 -0.37 0.00 3.04 -1.83 -2.78 116.25 115.98 1kvi h VAL 23 Ca 0.00 -3.38 -0.08 0.00 -1.01 0.00 0.00 66.70 62.23 1kvi h VAL 23 Cb 0.00 2.83 -0.01 0.00 -2.01 0.00 0.00 31.29 32.10 1kvi h VAL 23 CO 0.00 0.95 -0.07 -0.50 -1.01 0.00 0.00 177.57 176.94 1kvi h TRP 24 N 0.00 0.78 -0.14 3.17 6.55 -1.62 2.08 115.95 126.77 1kvi h TRP 24 Ca -0.03 -0.16 -0.09 0.00 0.95 0.00 0.00 58.89 59.56 1kvi h TRP 24 Cb 1.79 -0.19 0.00 0.00 -0.86 0.00 0.00 29.16 29.89 1kvi h TRP 24 CO 0.00 0.84 -0.26 1.15 -1.05 0.00 0.00 178.44 179.12 1kvi h THR 25 N 0.50 1.36 0.82 1.49 2.02 -1.36 -0.24 112.91 117.50 1kvi h THR 25 Ca 0.10 -1.52 -0.04 0.00 0.77 0.00 0.00 66.41 65.72 1kvi h THR 25 Cb 0.57 2.00 0.01 0.00 -1.74 0.00 0.00 68.15 68.99 1kvi h THR 25 CO 0.03 0.45 -0.39 0.40 0.37 0.00 0.00 175.52 176.38 1kvi h ILE 26 N 0.03 0.15 -1.04 3.11 5.03 -1.40 -0.95 117.51 122.45 1kvi h ILE 26 Ca 0.01 -0.07 0.28 0.00 -0.12 0.00 0.00 64.86 64.96 1kvi h ILE 26 Cb 0.85 0.17 -0.06 0.00 -3.03 0.00 0.00 36.82 34.74 1kvi h ILE 26 CO 0.06 0.01 0.71 -0.08 -0.68 0.00 0.00 178.15 178.16 1kvi h GLU 27 N -1.16 0.18 0.37 2.37 4.81 0.34 0.43 114.58 121.92 1kvi h GLU 27 Ca -0.11 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.09 1kvi h GLU 27 Cb 0.85 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.19 1kvi h GLU 27 CO 0.18 0.12 -0.18 1.96 -0.73 0.00 0.00 179.01 180.37 1kvi h GLN 28 N 0.19 -0.48 0.28 1.92 7.50 -0.24 -1.08 115.11 123.20 1kvi h GLN 28 Ca 0.53 0.03 -0.01 0.00 0.50 0.00 0.00 58.65 59.70 1kvi h GLN 28 Cb 1.74 0.11 0.00 0.00 0.05 0.00 0.00 27.48 29.38 1kvi h GLN 28 CO -0.13 -0.16 -0.14 0.37 -1.50 0.00 0.00 178.83 177.27 1kvi h GLN 29 N -0.94 -0.36 -1.05 1.46 5.75 -0.21 -1.41 115.11 118.34 1kvi h GLN 29 Ca -0.05 0.02 0.28 0.00 -0.15 0.00 0.00 58.65 58.75 1kvi h GLN 29 Cb 0.53 0.08 -0.08 0.00 1.07 0.00 0.00 27.48 29.09 1kvi h GLN 29 CO 0.08 -0.24 0.69 0.82 -2.65 0.00 0.00 178.83 177.53 1kvi h ILE 30 N -0.94 0.51 0.00 2.39 5.03 -0.35 1.39 117.51 125.54 1kvi h ILE 30 Ca -0.04 -0.10 -0.11 0.00 -0.12 0.00 0.00 64.86 64.49 1kvi h ILE 30 Cb 0.29 0.19 -0.02 0.00 -3.03 0.00 0.00 36.82 34.25 1kvi h ILE 30 CO 0.06 0.05 -0.51 1.23 -0.68 0.00 0.00 178.15 178.31 1kvi h GLY 31 N 0.30 0.00 -0.87 5.37 0.00 -1.20 -2.78 103.07 103.89 1kvi h GLY 31 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.90 1kvi h GLY 31 CO -0.22 0.00 0.00 1.17 0.00 0.00 0.00 176.54 177.49 1kvi n LYS 32 N -3.57 1.84 0.00 4.80 4.81 0.45 -4.81 118.16 121.67 1kvi n LYS 32 Ca -0.00 -1.23 0.00 0.00 -0.87 0.00 0.00 58.31 56.21 1kvi n LYS 32 Cb 0.59 -1.47 0.00 0.00 0.02 0.00 0.00 35.03 34.18 1kvi n LYS 32 CO 0.00 0.00 0.00 1.55 1.17 0.00 0.00 177.40 180.12 1kvi n VAL 33 N 0.48 0.00 0.00 3.15 3.14 0.62 -5.00 118.33 120.73 1kvi n VAL 33 Ca 0.18 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.56 1kvi n VAL 33 Cb 0.41 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.19 1kvi n VAL 33 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1kvi n ASN 34 N 0.00 0.00 -2.79 6.55 3.02 -1.26 -4.80 115.26 115.97 1kvi n ASN 34 Ca 0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.45 1kvi n ASN 34 Cb 0.00 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.24 1kvi n ASN 34 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1kvi n GLY 35 N 0.00 0.90 3.75 7.41 0.00 -1.26 -5.07 105.19 110.92 1kvi n GLY 35 Ca 0.00 -0.19 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 1kvi n GLY 35 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1kvi n VAL 36 N 0.57 1.20 0.02 1.61 0.24 -1.26 -4.27 118.33 116.44 1kvi n VAL 36 Ca 0.09 -0.30 0.02 0.00 -2.04 0.00 0.00 64.34 62.11 1kvi n VAL 36 Cb 0.68 -1.99 -0.09 0.00 -1.47 0.00 0.00 33.84 30.97 1kvi n VAL 36 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1kvi n HIS 37 N 1.85 0.71 -3.85 6.34 8.25 -1.26 -4.95 115.22 122.32 1kvi n HIS 37 Ca 0.07 0.23 -0.09 0.00 -0.26 0.00 0.00 57.72 57.67 1kvi n HIS 37 Cb 0.37 -0.97 -0.08 0.00 1.12 0.00 0.00 29.99 30.44 1kvi n HIS 37 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1kvi s HIS 38 N -3.04 0.10 -0.30 4.41 3.76 -1.26 -4.94 115.29 114.03 1kvi s HIS 38 Ca -0.04 -0.44 -0.14 0.00 -0.15 0.00 0.00 55.06 54.28 1kvi s HIS 38 Cb 0.09 -0.04 0.15 0.00 1.11 0.00 0.00 32.58 33.89 1kvi s HIS 38 CO 0.83 -0.50 0.90 -1.50 -0.85 0.00 0.00 174.74 173.61 1kvi s ILE 39 N -3.33 -0.43 -0.11 0.60 1.10 -1.24 -2.04 121.20 115.75 1kvi s ILE 39 Ca 0.01 0.00 -0.10 0.00 -0.51 0.00 0.00 60.65 60.05 1kvi s ILE 39 Cb 0.02 -1.00 0.03 0.00 0.15 0.00 0.00 42.46 41.66 1kvi s ILE 39 CO -0.08 0.00 0.29 -1.59 -2.11 0.00 0.00 174.94 171.44 1kvi s LYS 40 N 2.19 0.34 -0.08 3.50 -2.85 -0.77 -4.99 119.74 117.09 1kvi s LYS 40 Ca -0.05 0.39 0.00 0.00 -1.00 0.00 0.00 55.97 55.31 1kvi s LYS 40 Cb -0.06 0.16 -0.03 0.00 -2.06 0.00 0.00 37.83 35.84 1kvi s LYS 40 CO -0.17 -0.04 -0.06 0.14 0.10 0.00 0.00 175.35 175.32 1kvi s VAL 41 N 0.14 3.80 -0.29 1.79 -7.23 -1.26 -2.31 120.40 115.03 1kvi s VAL 41 Ca -0.00 -0.44 -0.04 0.00 -1.81 0.00 0.00 61.98 59.69 1kvi s VAL 41 Cb -0.02 -2.57 0.03 0.00 0.56 0.00 0.00 36.38 34.38 1kvi s VAL 41 CO 0.00 0.59 0.02 -0.44 -0.31 0.00 0.00 175.10 174.97 1kvi s SER 42 N -0.73 4.89 0.19 4.85 0.01 0.11 -4.95 113.70 118.08 1kvi s SER 42 Ca 0.11 -1.03 0.24 0.00 1.31 0.00 0.00 55.95 56.58 1kvi s SER 42 Cb -0.11 -1.77 0.38 0.00 0.21 0.00 0.00 66.02 64.72 1kvi s SER 42 CO 0.02 -0.23 1.40 -0.07 0.41 0.00 0.00 173.24 174.77 1kvi h LEU 43 N 8.10 0.00 0.00 2.44 3.38 -1.98 -1.99 115.31 125.26 1kvi h LEU 43 Ca -0.27 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1kvi h LEU 43 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1kvi h LEU 43 CO 0.57 0.05 -1.01 -0.62 0.09 0.00 0.00 178.44 177.53 1kvi n GLU 44 N -2.37 0.29 0.00 1.13 -0.58 -1.26 -4.34 120.64 113.50 1kvi n GLU 44 Ca 0.03 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 1kvi n GLU 44 Cb 0.47 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.88 1kvi n GLU 44 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1kvi n GLU 45 N -1.51 0.21 -3.48 3.49 1.02 -1.24 -5.04 120.64 114.08 1kvi n GLU 45 Ca 0.03 -0.40 -0.17 0.00 -0.02 0.00 0.00 57.16 56.61 1kvi n GLU 45 Cb 0.33 -0.89 0.01 0.00 -0.02 0.00 0.00 31.44 30.87 1kvi n GLU 45 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1kvi n LYS 46 N -0.14 -1.39 -3.71 3.49 5.02 -0.75 -4.84 118.16 115.83 1kvi n LYS 46 Ca 0.00 0.96 -0.02 0.00 -2.02 0.00 0.00 58.31 57.23 1kvi n LYS 46 Cb 0.01 -4.16 -0.01 0.00 -0.02 0.00 0.00 35.03 30.85 1kvi n LYS 46 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1kvi s ASN 47 N -3.13 -0.13 -0.11 4.39 3.84 -1.18 -1.23 114.94 117.39 1kvi s ASN 47 Ca 0.14 -0.32 -0.19 0.00 0.21 0.00 0.00 52.86 52.70 1kvi s ASN 47 Cb -0.05 0.37 0.04 0.00 -0.55 0.00 0.00 41.25 41.07 1kvi s ASN 47 CO 0.83 -0.68 0.47 0.00 -2.79 0.00 0.00 177.10 174.93 1kvi s ALA 48 N -2.93 -1.20 -0.10 1.71 0.00 -0.67 -0.71 121.76 117.86 1kvi s ALA 48 Ca 0.13 1.06 0.04 0.00 0.00 0.00 0.00 51.96 53.20 1kvi s ALA 48 Cb 0.01 -0.40 0.00 0.00 0.00 0.00 0.00 23.12 22.73 1kvi s ALA 48 CO 0.00 -0.27 -0.23 0.99 0.00 0.00 0.00 175.76 176.25 1kvi s THR 49 N -0.48 2.03 0.11 0.00 2.01 -0.98 -2.28 115.64 116.05 1kvi s THR 49 Ca -0.06 -1.00 -0.09 0.00 0.31 0.00 0.00 61.69 60.85 1kvi s THR 49 Cb -0.03 -1.76 -0.00 0.00 0.01 0.00 0.00 72.50 70.72 1kvi s THR 49 CO 0.03 0.55 0.22 0.27 -0.69 0.00 0.00 174.62 175.01 1kvi s ILE 50 N 0.37 0.12 0.42 1.82 -5.25 -0.84 -1.84 121.20 116.01 1kvi s ILE 50 Ca -0.18 -1.21 0.07 0.00 -0.99 0.00 0.00 60.65 58.34 1kvi s ILE 50 Cb -0.18 -1.45 -0.05 0.00 2.95 0.00 0.00 42.46 43.73 1kvi s ILE 50 CO 0.08 -0.55 0.17 -0.63 -1.79 0.00 0.00 174.94 172.22 1kvi s ILE 51 N -3.88 2.20 -0.29 8.37 1.01 -0.86 0.42 121.20 128.16 1kvi s ILE 51 Ca 0.08 -1.72 -0.15 0.00 0.00 0.00 0.00 60.65 58.85 1kvi s ILE 51 Cb 0.04 -2.93 0.15 0.00 0.01 0.00 0.00 42.46 39.73 1kvi s ILE 51 CO -0.08 0.00 0.94 -0.72 0.00 0.00 0.00 174.94 175.08 1kvi s TYR 52 N -2.63 -0.67 -0.11 3.97 1.13 0.60 -4.10 117.35 115.54 1kvi s TYR 52 Ca 0.39 1.28 -0.29 0.00 -1.41 0.00 0.00 57.07 57.03 1kvi s TYR 52 Cb 0.04 0.40 -0.04 0.00 -1.10 0.00 0.00 41.96 41.26 1kvi s TYR 52 CO 0.21 -0.33 1.59 0.16 -2.51 0.00 0.00 175.55 174.66 1kvi s ASP 53 N 1.77 6.64 0.33 -0.18 -4.77 -1.26 -1.91 116.67 117.29 1kvi s ASP 53 Ca -0.07 2.01 0.13 0.00 -3.30 0.00 0.00 52.55 51.32 1kvi s ASP 53 Cb -0.05 -2.53 0.59 0.00 -1.09 0.00 0.00 42.92 39.83 1kvi s ASP 53 CO -0.16 -0.98 1.74 1.55 0.70 0.00 0.00 175.17 178.02 1kvi h PRO 54 N 9.62 0.00 -0.75 2.11 0.13 -1.66 -2.73 132.00 138.71 1kvi h PRO 54 Ca -0.36 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 64.99 1kvi h PRO 54 Cb 1.16 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.26 1kvi h PRO 54 CO 0.97 0.47 0.75 1.57 -0.23 0.00 0.00 178.00 181.52 1kvi h LYS 55 N 0.00 0.00 0.00 0.86 2.10 -1.90 -2.86 116.57 114.77 1kvi h LYS 55 Ca -0.00 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.56 1kvi h LYS 55 Cb 0.85 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.16 1kvi h LYS 55 CO 0.06 0.00 -1.15 1.28 -2.00 0.00 0.00 179.45 177.64 1kvi n LEU 56 N -3.67 1.76 0.00 7.07 4.77 -1.08 -5.11 117.00 120.75 1kvi n LEU 56 Ca 0.16 0.29 -0.08 0.00 -0.03 0.00 0.00 56.01 56.35 1kvi n LEU 56 Cb 1.01 -0.67 0.02 0.00 -2.33 0.00 0.00 43.42 41.44 1kvi n LEU 56 CO 0.29 -0.17 0.43 1.67 -1.33 0.00 0.00 177.39 178.28 1kvi n GLN 57 N -4.24 0.95 0.14 3.23 7.27 -1.05 -5.10 117.38 118.57 1kvi n GLN 57 Ca -0.19 -2.01 0.00 0.00 0.07 0.00 0.00 57.00 54.86 1kvi n GLN 57 Cb 0.52 2.43 0.00 0.00 2.41 0.00 0.00 30.24 35.60 1kvi n GLN 57 CO 0.00 0.00 0.00 -2.37 0.07 0.00 0.00 177.06 174.76 1kvi n THR 58 N -0.47 0.00 -0.03 1.69 5.66 -1.26 -3.47 114.28 116.39 1kvi n THR 58 Ca -0.07 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.79 1kvi n THR 58 Cb 0.52 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.19 1kvi n THR 58 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 1kvi h PRO 59 N 0.00 0.11 0.01 1.09 0.13 -1.98 -3.10 132.00 128.27 1kvi h PRO 59 Ca 0.00 -0.12 -0.24 0.00 -0.87 0.00 0.00 66.00 64.77 1kvi h PRO 59 Cb 0.00 0.03 0.01 0.00 0.13 0.00 0.00 31.00 31.17 1kvi h PRO 59 CO 0.00 0.87 -1.00 0.87 -0.23 0.00 0.00 178.00 178.50 1kvi h LYS 60 N -0.59 0.49 0.78 0.86 1.57 -1.98 -2.92 116.57 114.78 1kvi h LYS 60 Ca -0.02 -0.55 -0.04 0.00 -1.87 0.00 0.00 60.65 58.17 1kvi h LYS 60 Cb 0.92 0.16 0.01 0.00 0.08 0.00 0.00 32.23 33.40 1kvi h LYS 60 CO 0.03 1.19 -0.37 1.15 -0.57 0.00 0.00 179.45 180.87 1kvi h THR 61 N 0.27 0.04 -0.94 -0.16 2.02 -1.92 0.50 112.91 112.71 1kvi h THR 61 Ca -0.10 -0.22 0.16 0.00 0.77 0.00 0.00 66.41 67.02 1kvi h THR 61 Cb 1.65 0.06 -0.10 0.00 -1.74 0.00 0.00 68.15 68.02 1kvi h THR 61 CO 0.18 0.00 0.55 -0.07 0.37 0.00 0.00 175.52 176.55 1kvi h LEU 62 N -1.25 0.72 -0.26 2.58 4.07 -1.68 1.17 115.31 120.66 1kvi h LEU 62 Ca -0.11 0.09 -0.03 0.00 0.08 0.00 0.00 57.88 57.90 1kvi h LEU 62 Cb 0.81 -0.04 -0.01 0.00 1.08 0.00 0.00 40.66 42.49 1kvi h LEU 62 CO 0.18 0.30 0.03 -0.61 -1.08 0.00 0.00 178.44 177.25 1kvi h GLN 63 N 0.76 0.44 0.00 1.13 4.15 -1.34 -2.29 115.11 117.95 1kvi h GLN 63 Ca 0.52 -0.12 -0.06 0.00 0.77 0.00 0.00 58.65 59.75 1kvi h GLN 63 Cb 0.72 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.36 1kvi h GLN 63 CO -0.35 0.58 -0.31 1.49 -1.93 0.00 0.00 178.83 178.31 1kvi h GLU 64 N 0.23 0.00 0.28 1.69 4.81 0.21 -2.57 114.58 119.24 1kvi h GLU 64 Ca 0.08 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1kvi h GLU 64 Cb 0.36 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.74 1kvi h GLU 64 CO 0.01 0.31 -0.14 0.00 -0.73 0.00 0.00 179.01 178.46 1kvi h ALA 65 N 1.69 -0.38 -0.08 2.92 0.00 0.18 -0.93 119.26 122.67 1kvi h ALA 65 Ca -0.00 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.79 1kvi h ALA 65 Cb 0.58 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1kvi h ALA 65 CO 0.04 -0.65 -0.02 0.82 0.00 0.00 0.00 179.25 179.44 1kvi h ILE 66 N -0.51 0.91 -0.10 0.00 2.04 -1.30 0.50 117.51 119.06 1kvi h ILE 66 Ca -0.04 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.85 1kvi h ILE 66 Cb 0.38 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.37 1kvi h ILE 66 CO 0.06 0.00 0.20 -0.78 0.00 0.00 0.00 178.15 177.64 1kvi h ASP 67 N -0.01 0.00 0.88 1.72 3.58 -1.36 0.23 116.42 121.46 1kvi h ASP 67 Ca 0.04 0.00 -0.22 0.00 0.42 0.00 0.00 57.03 57.27 1kvi h ASP 67 Cb 0.07 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.09 1kvi h ASP 67 CO -0.08 0.00 -1.01 -0.78 -2.88 0.00 0.00 179.24 174.49 1kvi h ASP 68 N 0.00 0.10 -0.49 2.28 1.82 0.53 -3.26 116.42 117.40 1kvi h ASP 68 Ca 0.05 -0.10 0.00 0.00 -0.39 0.00 0.00 57.03 56.59 1kvi h ASP 68 Cb 0.45 -0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.43 1kvi h ASP 68 CO -0.00 1.04 0.00 0.23 -1.61 0.00 0.00 179.24 178.90 1kvi n MET 69 N -3.43 3.06 -1.57 0.28 2.81 0.50 -4.91 117.12 113.85 1kvi n MET 69 Ca -0.02 -2.48 -0.12 0.00 -1.81 0.00 0.00 57.70 53.27 1kvi n MET 69 Cb 0.92 -1.55 -0.04 0.00 -0.71 0.00 0.00 33.22 31.84 1kvi n MET 69 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1kvi n GLY 70 N 0.75 0.76 3.49 3.03 0.00 0.51 -4.77 105.19 108.96 1kvi n GLY 70 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 1kvi n GLY 70 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1kvi n PHE 71 N -2.10 3.10 -1.51 1.61 3.01 -0.98 -4.63 117.46 115.95 1kvi n PHE 71 Ca -0.12 -1.87 -0.15 0.00 1.01 0.00 0.00 57.45 56.32 1kvi n PHE 71 Cb 0.43 -2.51 -0.12 0.00 -0.01 0.00 0.00 39.48 37.26 1kvi n PHE 71 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1kvi n ASP 72 N 11.91 0.56 -4.47 4.37 9.92 -1.24 -4.80 116.55 132.80 1kvi n ASP 72 Ca 0.47 -1.32 -0.23 0.00 -0.53 0.00 0.00 54.79 53.18 1kvi n ASP 72 Cb 0.45 -1.28 -0.11 0.00 -0.64 0.00 0.00 41.12 39.55 1kvi n ASP 72 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1kvi s ALA 73 N 9.90 2.50 -0.17 2.24 0.00 -1.25 -2.37 121.76 132.61 1kvi s ALA 73 Ca 0.98 -2.05 0.01 0.00 0.00 0.00 0.00 51.96 50.90 1kvi s ALA 73 Cb -0.33 0.39 0.02 0.00 0.00 0.00 0.00 23.12 23.20 1kvi s ALA 73 CO 0.23 -0.18 -0.19 0.08 0.00 0.00 0.00 175.76 175.70 1kvi s VAL 74 N -3.08 1.99 0.24 0.00 1.01 -0.54 -4.84 120.40 115.18 1kvi s VAL 74 Ca 0.34 -0.90 -0.28 0.00 0.00 0.00 0.00 61.98 61.14 1kvi s VAL 74 Cb 0.07 -1.80 -0.09 0.00 0.00 0.00 0.00 36.38 34.56 1kvi s VAL 74 CO 0.15 0.53 0.90 -0.51 0.00 0.00 0.00 175.10 176.17 1kvi s ILE 75 N 1.31 4.17 -0.08 2.22 2.07 -1.26 -0.59 121.20 129.04 1kvi s ILE 75 Ca 0.05 1.94 0.12 0.00 -1.41 0.00 0.00 60.65 61.35 1kvi s ILE 75 Cb -0.13 -4.22 0.18 0.00 0.13 0.00 0.00 42.46 38.42 1kvi s ILE 75 CO -0.12 0.43 1.09 0.00 -1.91 0.00 0.00 174.94 174.43 1kvi n HIS 76 N 1.31 0.00 -3.94 3.50 1.44 -1.08 -4.97 115.22 111.48 1kvi n HIS 76 Ca -0.02 -0.63 -0.31 0.00 -2.01 0.00 0.00 57.72 54.76 1kvi n HIS 76 Cb 0.48 -0.11 -0.15 0.00 0.12 0.00 0.00 29.99 30.33 1kvi n HIS 76 CO 0.00 0.00 0.00 1.21 -2.81 0.00 0.00 176.34 174.74 1kvi s ASN 77 N -2.17 4.41 0.00 4.39 3.84 -1.26 -4.99 114.94 119.15 1kvi s ASN 77 Ca 0.20 -1.81 0.00 0.00 0.21 0.00 0.00 52.86 51.46 1kvi s ASN 77 Cb 0.18 -1.35 0.00 0.00 -0.55 0.00 0.00 41.25 39.52 1kvi s ASN 77 CO 0.02 -0.35 0.00 -0.81 -2.79 0.00 0.00 177.10 173.17 1kvi n PRO 78 N 4.49 0.00 0.00 0.43 -0.04 -1.26 -4.94 135.00 133.68 1kvi n PRO 78 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 1kvi n PRO 78 Cb 0.42 -0.18 0.00 0.00 -0.04 0.00 0.00 33.50 33.70 1kvi n PRO 78 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06