#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kvj s ASP 2 N 0.00 5.14 0.16 6.12 1.01 -1.26 -4.84 116.67 123.00 1kvj s ASP 2 Ca 0.00 -3.80 0.22 0.00 0.71 0.00 0.00 52.55 49.68 1kvj s ASP 2 Cb 0.00 -1.71 0.88 0.00 1.01 0.00 0.00 42.92 43.10 1kvj s ASP 2 CO 0.00 -0.12 1.68 -0.81 0.21 0.00 0.00 175.17 176.13 1kvj n PRO 3 N 2.10 0.14 0.00 8.23 -0.04 -1.26 -4.04 135.00 140.13 1kvj n PRO 3 Ca 0.20 0.31 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 1kvj n PRO 3 Cb 0.35 -1.73 0.00 0.00 -0.04 0.00 0.00 33.50 32.08 1kvj n PRO 3 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1kvj n SER 4 N -1.98 0.00 -3.50 3.54 7.64 -1.26 -5.07 113.62 112.98 1kvj n SER 4 Ca 0.03 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.70 1kvj n SER 4 Cb 0.26 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.51 1kvj n SER 4 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 1kvj n MET 5 N -0.12 -3.02 0.00 1.43 2.81 -1.26 -4.69 117.12 112.27 1kvj n MET 5 Ca 0.00 0.69 0.00 0.00 -1.81 0.00 0.00 57.70 56.58 1kvj n MET 5 Cb 0.00 -5.18 0.00 0.00 -0.71 0.00 0.00 33.22 27.33 1kvj n MET 5 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1kvj n GLY 6 N -1.44 -0.63 0.89 3.03 0.00 -1.26 -5.17 105.19 100.62 1kvj n GLY 6 Ca -0.15 0.16 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1kvj n GLY 6 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1kvj n VAL 7 N 0.00 -0.25 -4.10 1.61 0.31 -1.26 -5.01 118.33 109.63 1kvj n VAL 7 Ca 0.00 0.43 -0.28 0.00 -0.01 0.00 0.00 64.34 64.48 1kvj n VAL 7 Cb 0.00 -0.73 -0.01 0.00 -0.91 0.00 0.00 33.84 32.19 1kvj n VAL 7 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1kvj n ASN 8 N -3.55 2.94 -3.79 4.52 4.13 0.43 -4.87 115.26 115.08 1kvj n ASN 8 Ca -0.04 -3.01 -0.14 0.00 1.68 0.00 0.00 54.58 53.07 1kvj n ASN 8 Cb 0.42 0.05 -0.15 0.00 -1.54 0.00 0.00 39.78 38.56 1kvj n ASN 8 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1kvj s SER 9 N -4.19 -0.01 -0.03 6.41 0.01 -1.26 -0.47 113.70 114.16 1kvj s SER 9 Ca 0.24 0.12 0.03 0.00 1.31 0.00 0.00 55.95 57.66 1kvj s SER 9 Cb -0.02 0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.26 1kvj s SER 9 CO 0.15 -0.10 -0.11 -0.69 0.41 0.00 0.00 173.24 172.90 1kvj s VAL 10 N 0.82 0.91 -0.21 3.43 1.01 0.43 -4.95 120.40 121.85 1kvj s VAL 10 Ca -0.07 -0.43 -0.02 0.00 0.00 0.00 0.00 61.98 61.46 1kvj s VAL 10 Cb -0.09 -0.80 0.01 0.00 0.00 0.00 0.00 36.38 35.49 1kvj s VAL 10 CO -0.03 0.28 -0.10 -0.89 0.00 0.00 0.00 175.10 174.36 1kvj s THR 11 N 0.15 2.83 0.07 3.92 2.01 -1.26 0.56 115.64 123.92 1kvj s THR 11 Ca -0.03 -0.76 0.09 0.00 0.31 0.00 0.00 61.69 61.30 1kvj s THR 11 Cb -0.09 -2.30 -0.03 0.00 0.01 0.00 0.00 72.50 70.09 1kvj s THR 11 CO 0.01 0.41 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.48 1kvj s ILE 12 N 1.38 2.39 0.14 1.82 1.01 0.54 -1.85 121.20 126.62 1kvj s ILE 12 Ca 0.04 -1.43 -0.14 0.00 0.00 0.00 0.00 60.65 59.12 1kvj s ILE 12 Cb -0.14 -1.99 -0.07 0.00 0.01 0.00 0.00 42.46 40.26 1kvj s ILE 12 CO -0.07 0.27 0.54 -0.44 0.00 0.00 0.00 174.94 175.25 1kvj s SER 13 N -1.55 6.83 -0.05 3.58 0.01 0.19 0.71 113.70 123.42 1kvj s SER 13 Ca 0.13 1.07 -0.02 0.00 1.31 0.00 0.00 55.95 58.45 1kvj s SER 13 Cb -0.10 -2.29 0.04 0.00 0.21 0.00 0.00 66.02 63.88 1kvj s SER 13 CO 0.04 0.12 0.09 0.68 0.41 0.00 0.00 173.24 174.58 1kvj s VAL 14 N -1.43 -0.10 0.34 3.43 -7.23 -0.20 0.46 120.40 115.67 1kvj s VAL 14 Ca 0.37 0.27 0.08 0.00 -1.81 0.00 0.00 61.98 60.89 1kvj s VAL 14 Cb -0.15 -0.17 -0.03 0.00 0.56 0.00 0.00 36.38 36.58 1kvj s VAL 14 CO 0.19 0.11 0.22 -0.70 -0.31 0.00 0.00 175.10 174.62 1kvj s GLU 15 N 1.52 2.54 0.00 4.82 2.56 0.37 -4.22 118.70 126.28 1kvj s GLU 15 Ca -0.04 -1.44 0.00 0.00 0.00 0.00 0.00 54.97 53.49 1kvj s GLU 15 Cb -0.12 -2.32 0.00 0.00 2.00 0.00 0.00 34.13 33.69 1kvj s GLU 15 CO -0.04 0.08 0.00 0.41 -0.56 0.00 0.00 175.26 175.15 1kvj n GLY 16 N -1.27 3.13 3.56 -1.50 0.00 -1.26 -1.64 105.19 106.22 1kvj n GLY 16 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1kvj n GLY 16 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1kvj s MET 17 N -0.40 3.03 0.00 1.61 -1.94 -1.26 -4.81 119.30 115.54 1kvj s MET 17 Ca 0.00 0.47 0.15 0.00 -1.71 0.00 0.00 55.69 54.60 1kvj s MET 17 Cb 0.00 -4.24 0.42 0.00 2.01 0.00 0.00 34.83 33.03 1kvj s MET 17 CO 0.00 -2.26 1.35 -2.37 -0.01 0.00 0.00 175.02 171.72 1kvj n THR 18 N 6.95 0.94 -3.65 2.05 5.66 -1.26 -4.67 114.28 120.30 1kvj n THR 18 Ca 0.15 -0.97 -0.02 0.00 -3.05 0.00 0.00 64.05 60.15 1kvj n THR 18 Cb 0.50 0.55 -0.07 0.00 -1.55 0.00 0.00 70.33 69.76 1kvj n THR 18 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1kvj n ASN 20 N 1.61 -0.01 -0.17 0.00 4.13 -1.26 0.17 115.26 119.72 1kvj n ASN 20 Ca -0.10 0.26 0.29 0.00 1.68 0.00 0.00 54.58 56.71 1kvj n ASN 20 Cb 0.57 -0.10 0.69 0.00 -1.54 0.00 0.00 39.78 39.40 1kvj n ASN 20 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 1kvj h SER 21 N 0.00 0.00 0.50 6.41 4.64 -1.97 1.96 113.55 125.09 1kvj h SER 21 Ca 0.10 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.12 1kvj h SER 21 Cb 0.20 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.26 1kvj h SER 21 CO -0.14 0.00 -1.60 0.00 -0.87 0.00 0.00 176.83 174.22 1kvj h VAL 23 N 0.03 1.30 -0.73 0.00 2.07 -0.27 -2.51 116.25 116.14 1kvj h VAL 23 Ca -0.25 -2.45 0.02 0.00 0.82 0.00 0.00 66.70 64.84 1kvj h VAL 23 Cb 1.98 2.63 -0.04 0.00 -1.52 0.00 0.00 31.29 34.35 1kvj h VAL 23 CO 0.11 0.75 0.48 -0.50 0.02 0.00 0.00 177.57 178.43 1kvj h TRP 24 N 0.29 0.87 -0.28 1.57 6.55 0.27 1.99 115.95 127.21 1kvj h TRP 24 Ca -0.17 0.02 -0.08 0.00 0.95 0.00 0.00 58.89 59.61 1kvj h TRP 24 Cb 1.86 -0.29 -0.02 0.00 -0.86 0.00 0.00 29.16 29.86 1kvj h TRP 24 CO 0.11 0.52 -0.16 1.15 -1.05 0.00 0.00 178.44 179.02 1kvj h THR 25 N 0.92 1.24 0.00 1.49 2.02 -1.29 0.29 112.91 117.58 1kvj h THR 25 Ca 0.28 -1.08 -0.32 0.00 0.77 0.00 0.00 66.41 66.07 1kvj h THR 25 Cb -0.00 1.19 -0.06 0.00 -1.74 0.00 0.00 68.15 67.54 1kvj h THR 25 CO -0.07 0.35 -2.01 -0.38 0.37 0.00 0.00 175.52 173.78 1kvj n ILE 26 N -4.18 1.46 0.05 3.11 -0.00 -0.39 -2.38 119.36 117.03 1kvj n ILE 26 Ca 0.00 -0.81 -0.11 0.00 -0.00 0.00 0.00 62.75 61.82 1kvj n ILE 26 Cb 0.34 -0.74 -0.00 0.00 -0.00 0.00 0.00 39.64 39.24 1kvj n ILE 26 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.55 176.47 1kvj h GLU 27 N 0.00 0.44 0.09 0.38 4.81 0.32 0.16 114.58 120.77 1kvj h GLU 27 Ca -0.39 -0.39 -0.25 0.00 -0.13 0.00 0.00 59.36 58.19 1kvj h GLU 27 Cb 2.08 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 31.55 1kvj h GLU 27 CO 0.05 1.03 -1.15 1.96 -0.73 0.00 0.00 179.01 180.17 1kvj h GLN 28 N 0.29 0.24 0.05 1.92 4.20 -0.56 -2.57 115.11 118.67 1kvj h GLN 28 Ca -0.05 -0.38 -0.00 0.00 0.06 0.00 0.00 58.65 58.28 1kvj h GLN 28 Cb 1.39 0.14 0.00 0.00 0.30 0.00 0.00 27.48 29.31 1kvj h GLN 28 CO 0.14 1.16 -0.02 1.96 -0.67 0.00 0.00 178.83 181.39 1kvj h GLN 29 N 0.08 -0.06 -0.91 1.46 1.08 -1.38 -2.07 115.11 113.31 1kvj h GLN 29 Ca -0.10 0.00 0.06 0.00 -1.45 0.00 0.00 58.65 57.16 1kvj h GLN 29 Cb 1.87 0.01 -0.06 0.00 -0.05 0.00 0.00 27.48 29.25 1kvj h GLN 29 CO 0.18 0.52 0.58 0.97 -0.95 0.00 0.00 178.83 180.13 1kvj h ILE 30 N -0.72 1.07 0.00 2.54 6.09 -0.81 1.03 117.51 126.72 1kvj h ILE 30 Ca -0.01 -0.36 -0.03 0.00 -1.37 0.00 0.00 64.86 63.09 1kvj h ILE 30 Cb 0.61 -0.08 -0.00 0.00 0.47 0.00 0.00 36.82 37.82 1kvj h ILE 30 CO 0.01 0.19 -0.15 1.23 -3.07 0.00 0.00 178.15 176.36 1kvj h GLY 31 N 1.06 0.00 -1.20 8.18 0.00 -1.48 -2.63 103.07 107.00 1kvj h GLY 31 Ca 0.39 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.66 1kvj h GLY 31 CO -0.17 0.00 -0.21 1.17 0.00 0.00 0.00 176.54 177.34 1kvj n LYS 32 N -3.86 1.76 -0.08 4.80 4.81 0.44 -4.78 118.16 121.26 1kvj n LYS 32 Ca -0.02 -3.07 -0.20 0.00 -0.87 0.00 0.00 58.31 54.15 1kvj n LYS 32 Cb 0.25 -1.68 -0.12 0.00 0.02 0.00 0.00 35.03 33.49 1kvj n LYS 32 CO 0.00 0.00 0.00 -0.24 1.17 0.00 0.00 177.40 178.33 1kvj h VAL 33 N 0.89 1.11 0.00 3.15 3.04 0.13 -3.48 116.25 121.09 1kvj h VAL 33 Ca 0.07 -2.24 0.00 0.00 -1.01 0.00 0.00 66.70 63.52 1kvj h VAL 33 Cb 1.26 2.52 0.00 0.00 -2.01 0.00 0.00 31.29 33.06 1kvj h VAL 33 CO 0.15 0.42 0.00 -3.20 -1.01 0.00 0.00 177.57 173.93 1kvj n ASN 34 N -4.40 -0.45 -3.18 3.17 2.85 -1.26 -5.07 115.26 106.92 1kvj n ASN 34 Ca -0.27 0.14 -0.22 0.00 -0.11 0.00 0.00 54.58 54.12 1kvj n ASN 34 Cb 0.67 0.67 -0.06 0.00 1.24 0.00 0.00 39.78 42.29 1kvj n ASN 34 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1kvj n GLY 35 N -1.45 2.24 2.76 8.20 0.00 -1.26 -5.03 105.19 110.65 1kvj n GLY 35 Ca 0.00 -1.25 -0.29 0.00 0.00 0.00 0.00 46.02 44.48 1kvj n GLY 35 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kvj s VAL 36 N -0.58 1.68 0.55 1.61 1.01 -1.26 -3.38 120.40 120.03 1kvj s VAL 36 Ca 0.34 -2.79 0.34 0.00 0.00 0.00 0.00 61.98 59.87 1kvj s VAL 36 Cb 0.13 -2.17 0.37 0.00 0.00 0.00 0.00 36.38 34.72 1kvj s VAL 36 CO -0.15 -0.89 2.24 0.45 0.00 0.00 0.00 175.10 176.76 1kvj h HIS 37 N 6.59 0.00 -3.21 5.22 3.86 -1.95 -3.39 115.15 122.27 1kvj h HIS 37 Ca -0.01 0.00 -0.47 0.00 -1.16 0.00 0.00 60.37 58.73 1kvj h HIS 37 Cb 0.91 0.00 -0.40 0.00 1.06 0.00 0.00 27.41 28.98 1kvj h HIS 37 CO 0.49 0.03 -0.76 -1.01 0.86 0.00 0.00 177.93 177.54 1kvj s HIS 38 N -4.34 0.60 -0.08 2.45 3.76 -1.26 -5.00 115.29 111.43 1kvj s HIS 38 Ca -0.04 -0.42 0.02 0.00 -0.15 0.00 0.00 55.06 54.47 1kvj s HIS 38 Cb 0.14 -0.82 -0.02 0.00 1.11 0.00 0.00 32.58 32.99 1kvj s HIS 38 CO 0.51 -0.47 -0.14 0.96 -0.85 0.00 0.00 174.74 174.75 1kvj s ILE 39 N 2.00 3.03 -0.17 0.60 -5.25 -1.26 -0.50 121.20 119.64 1kvj s ILE 39 Ca 0.02 -0.71 -0.07 0.00 -0.99 0.00 0.00 60.65 58.90 1kvj s ILE 39 Cb -0.15 -2.21 0.08 0.00 2.95 0.00 0.00 42.46 43.12 1kvj s ILE 39 CO -0.07 0.57 0.37 -0.75 -1.79 0.00 0.00 174.94 173.27 1kvj s LYS 40 N -0.35 0.29 0.29 0.37 2.47 0.12 -4.96 119.74 117.98 1kvj s LYS 40 Ca 0.03 0.89 0.05 0.00 -1.56 0.00 0.00 55.97 55.38 1kvj s LYS 40 Cb -0.13 0.15 -0.06 0.00 -1.46 0.00 0.00 37.83 36.33 1kvj s LYS 40 CO 0.02 -0.23 0.00 0.08 0.16 0.00 0.00 175.35 175.38 1kvj s VAL 41 N 2.21 1.33 0.00 4.02 1.01 -1.26 0.20 120.40 127.91 1kvj s VAL 41 Ca -0.03 -2.05 0.00 0.00 0.00 0.00 0.00 61.98 59.90 1kvj s VAL 41 Cb -0.11 -2.57 0.00 0.00 0.00 0.00 0.00 36.38 33.70 1kvj s VAL 41 CO -0.12 -0.18 0.00 -1.20 0.00 0.00 0.00 175.10 173.60 1kvj n SER 42 N -0.59 0.00 0.00 3.32 7.64 -0.84 -4.98 113.62 118.16 1kvj n SER 42 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.84 1kvj n SER 42 Cb 0.65 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.85 1kvj n SER 42 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1kvj n LEU 43 N 0.00 0.00 0.00 -3.43 -0.00 -1.26 -4.92 117.00 107.38 1kvj n LEU 43 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 56.01 56.13 1kvj n LEU 43 Cb 0.00 0.00 0.53 0.00 -0.00 0.00 0.00 43.42 43.95 1kvj n LEU 43 CO 0.00 0.00 0.89 -0.62 -0.00 0.00 0.00 177.39 177.66 1kvj n GLU 44 N 0.00 0.02 0.05 1.96 4.71 -1.26 -2.26 120.64 123.86 1kvj n GLU 44 Ca 0.00 0.08 0.11 0.00 -0.01 0.00 0.00 57.16 57.34 1kvj n GLU 44 Cb 0.00 -1.50 0.45 0.00 -1.01 0.00 0.00 31.44 29.38 1kvj n GLU 44 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 1kvj n GLU 45 N -1.49 0.09 -3.69 3.49 2.13 -1.26 -4.93 120.64 114.99 1kvj n GLU 45 Ca 0.06 0.21 -0.27 0.00 0.66 0.00 0.00 57.16 57.83 1kvj n GLU 45 Cb 0.28 -1.64 0.03 0.00 0.27 0.00 0.00 31.44 30.39 1kvj n GLU 45 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1kvj n LYS 46 N -1.80 -2.47 -3.65 5.31 4.76 -0.96 -4.90 118.16 114.46 1kvj n LYS 46 Ca 0.05 0.52 -0.14 0.00 -2.87 0.00 0.00 58.31 55.87 1kvj n LYS 46 Cb 0.28 -4.59 -0.07 0.00 -1.84 0.00 0.00 35.03 28.81 1kvj n LYS 46 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1kvj s ASN 47 N -3.81 -0.36 -0.04 4.39 0.01 -1.26 -1.03 114.94 112.83 1kvj s ASN 47 Ca 0.29 0.22 -0.02 0.00 -0.71 0.00 0.00 52.86 52.64 1kvj s ASN 47 Cb -0.09 0.43 0.02 0.00 0.41 0.00 0.00 41.25 42.01 1kvj s ASN 47 CO 0.84 -0.59 0.10 0.00 -1.51 0.00 0.00 177.10 175.94 1kvj s ALA 48 N -1.81 -0.18 -0.04 0.60 0.00 0.22 -1.99 121.76 118.56 1kvj s ALA 48 Ca -0.09 0.40 0.03 0.00 0.00 0.00 0.00 51.96 52.30 1kvj s ALA 48 Cb -0.02 -0.27 0.00 0.00 0.00 0.00 0.00 23.12 22.84 1kvj s ALA 48 CO 0.03 -0.09 -0.13 -0.08 0.00 0.00 0.00 175.76 175.48 1kvj s THR 49 N 0.61 1.15 0.17 0.00 -1.32 0.54 0.20 115.64 116.98 1kvj s THR 49 Ca -0.05 -0.55 -0.11 0.00 -1.21 0.00 0.00 61.69 59.78 1kvj s THR 49 Cb -0.06 -1.01 0.00 0.00 -1.51 0.00 0.00 72.50 69.92 1kvj s THR 49 CO -0.02 0.34 0.34 0.27 -2.21 0.00 0.00 174.62 173.34 1kvj s ILE 50 N 0.22 0.06 0.38 5.08 -0.00 0.19 0.15 121.20 127.27 1kvj s ILE 50 Ca -0.06 -1.22 0.08 0.00 -0.00 0.00 0.00 60.65 59.45 1kvj s ILE 50 Cb -0.11 -1.75 -0.03 0.00 -0.00 0.00 0.00 42.46 40.57 1kvj s ILE 50 CO 0.02 -0.27 0.32 0.27 -0.00 0.00 0.00 174.94 175.28 1kvj s ILE 51 N -3.94 3.05 -0.05 8.37 -5.25 0.34 0.16 121.20 123.89 1kvj s ILE 51 Ca 0.15 -1.39 -0.31 0.00 -0.99 0.00 0.00 60.65 58.11 1kvj s ILE 51 Cb 0.02 -3.08 0.11 0.00 2.95 0.00 0.00 42.46 42.47 1kvj s ILE 51 CO -0.01 -0.09 1.04 -0.72 -1.79 0.00 0.00 174.94 173.37 1kvj s TYR 52 N -2.40 -0.23 -0.18 1.37 1.13 0.38 -3.77 117.35 113.66 1kvj s TYR 52 Ca 0.44 0.10 -0.29 0.00 -1.41 0.00 0.00 57.07 55.91 1kvj s TYR 52 Cb -0.04 0.54 -0.00 0.00 -1.10 0.00 0.00 41.96 41.36 1kvj s TYR 52 CO 0.27 -0.44 1.08 0.34 -2.51 0.00 0.00 175.55 174.29 1kvj s ASP 53 N -2.47 7.10 -0.37 -0.18 -1.08 -1.22 0.16 116.67 118.63 1kvj s ASP 53 Ca 0.08 1.50 -0.27 0.00 -0.52 0.00 0.00 52.55 53.34 1kvj s ASP 53 Cb -0.01 -2.54 -0.28 0.00 -1.46 0.00 0.00 42.92 38.63 1kvj s ASP 53 CO -0.06 -0.63 1.75 -0.81 0.52 0.00 0.00 175.17 175.94 1kvj n PRO 54 N 5.99 0.67 0.00 4.34 -0.04 -1.26 -2.70 135.00 142.00 1kvj n PRO 54 Ca 0.12 -1.40 0.00 0.00 -0.04 0.00 0.00 63.50 62.18 1kvj n PRO 54 Cb 0.46 -2.72 0.00 0.00 -0.04 0.00 0.00 33.50 31.20 1kvj n PRO 54 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1kvj n LYS 55 N 7.58 0.00 -0.01 0.54 2.85 -1.26 -4.99 118.16 122.87 1kvj n LYS 55 Ca 0.48 0.00 0.03 0.00 -1.05 0.00 0.00 58.31 57.77 1kvj n LYS 55 Cb 0.41 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.73 1kvj n LYS 55 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 177.40 178.82 1kvj n LEU 56 N -1.60 0.00 -4.12 -5.58 -0.00 -1.10 -4.99 117.00 99.60 1kvj n LEU 56 Ca 0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 56.01 55.75 1kvj n LEU 56 Cb 0.00 0.03 -0.16 0.00 -0.00 0.00 0.00 43.42 43.29 1kvj n LEU 56 CO 0.00 0.03 -0.50 -1.58 -0.00 0.00 0.00 177.39 175.34 1kvj s GLN 57 N -2.55 1.90 0.18 1.47 2.00 -1.18 -4.91 119.66 116.57 1kvj s GLN 57 Ca -0.03 -0.60 -0.03 0.00 -2.00 0.00 0.00 55.36 52.70 1kvj s GLN 57 Cb 0.05 -1.60 -0.03 0.00 0.80 0.00 0.00 33.01 32.22 1kvj s GLN 57 CO 0.37 0.20 0.16 0.95 -0.50 0.00 0.00 175.29 176.46 1kvj s THR 58 N 0.19 0.03 0.53 -0.34 -4.23 -1.26 -4.57 115.64 106.00 1kvj s THR 58 Ca -0.07 -1.87 0.41 0.00 -1.18 0.00 0.00 61.69 58.98 1kvj s THR 58 Cb -0.13 -2.29 0.43 0.00 1.34 0.00 0.00 72.50 71.85 1kvj s THR 58 CO 0.03 -0.15 2.28 1.55 -0.54 0.00 0.00 174.62 177.79 1kvj h PRO 59 N 2.65 0.00 0.01 3.99 0.13 -1.86 1.08 132.00 138.01 1kvj h PRO 59 Ca -0.34 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.56 1kvj h PRO 59 Cb 1.23 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.33 1kvj h PRO 59 CO 0.53 0.01 -1.12 -0.22 -0.23 0.00 0.00 178.00 176.96 1kvj h LYS 60 N 0.00 0.03 0.00 0.86 3.11 -1.86 -1.65 116.57 117.05 1kvj h LYS 60 Ca -0.00 -0.05 -0.12 0.00 -2.81 0.00 0.00 60.65 57.67 1kvj h LYS 60 Cb 0.12 0.02 -0.02 0.00 -1.00 0.00 0.00 32.23 31.35 1kvj h LYS 60 CO 0.00 0.96 -1.31 2.41 -2.81 0.00 0.00 179.45 178.69 1kvj n THR 61 N -3.33 1.02 0.15 1.00 -1.04 -0.47 -2.04 114.28 109.57 1kvj n THR 61 Ca -0.03 -0.65 0.01 0.00 -2.04 0.00 0.00 64.05 61.33 1kvj n THR 61 Cb 0.96 -0.62 0.18 0.00 -1.82 0.00 0.00 70.33 69.03 1kvj n THR 61 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1kvj h LEU 62 N 0.00 0.00 0.00 -4.42 3.38 0.12 0.51 115.31 114.90 1kvj h LEU 62 Ca -0.12 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.61 1kvj h LEU 62 Cb 1.42 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.14 1kvj h LEU 62 CO 0.03 0.57 -1.29 -0.61 0.09 0.00 0.00 178.44 177.23 1kvj h GLN 63 N 0.00 0.01 0.00 1.13 4.15 -1.34 -1.97 115.11 117.09 1kvj h GLN 63 Ca -0.01 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1kvj h GLN 63 Cb 1.14 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.84 1kvj h GLN 63 CO 0.07 0.81 -0.10 1.05 -1.93 0.00 0.00 178.83 178.73 1kvj h GLU 64 N 0.00 0.00 0.00 1.69 4.11 -1.11 0.60 114.58 119.87 1kvj h GLU 64 Ca -0.12 0.00 -0.20 0.00 0.07 0.00 0.00 59.36 59.10 1kvj h GLU 64 Cb 1.87 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 31.09 1kvj h GLU 64 CO 0.11 0.00 -1.09 0.00 0.07 0.00 0.00 179.01 178.10 1kvj h ALA 65 N 2.10 0.52 0.21 1.06 0.00 0.03 -1.79 119.26 121.39 1kvj h ALA 65 Ca 0.00 -0.94 -0.33 0.00 0.00 0.00 0.00 54.91 53.64 1kvj h ALA 65 Cb 0.95 0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.79 1kvj h ALA 65 CO 0.00 1.18 -1.53 0.82 0.00 0.00 0.00 179.25 179.72 1kvj h ILE 66 N 0.00 1.20 0.00 0.00 2.04 -1.08 -2.58 117.51 117.09 1kvj h ILE 66 Ca -0.08 -2.71 -0.01 0.00 1.00 0.00 0.00 64.86 63.06 1kvj h ILE 66 Cb 1.74 2.92 -0.00 0.00 -0.74 0.00 0.00 36.82 40.74 1kvj h ILE 66 CO 0.10 0.84 -0.04 0.44 0.00 0.00 0.00 178.15 179.48 1kvj h ASP 67 N 0.12 0.00 -0.22 1.72 3.32 0.17 -1.41 116.42 120.11 1kvj h ASP 67 Ca -0.26 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.65 1kvj h ASP 67 Cb 2.11 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.66 1kvj h ASP 67 CO 0.23 0.04 -0.38 -0.78 -1.72 0.00 0.00 179.24 176.63 1kvj h ASP 68 N 0.00 0.72 -0.42 6.45 3.58 -1.19 -3.25 116.42 122.31 1kvj h ASP 68 Ca -0.00 -0.53 0.07 0.00 0.42 0.00 0.00 57.03 56.99 1kvj h ASP 68 Cb 0.09 -0.21 -0.06 0.00 1.72 0.00 0.00 39.33 40.87 1kvj h ASP 68 CO 0.01 1.11 0.08 0.24 -2.88 0.00 0.00 179.24 177.80 1kvj h MET 69 N 0.35 0.20 0.00 0.28 2.86 -0.85 -3.47 114.93 114.31 1kvj h MET 69 Ca 0.02 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1kvj h MET 69 Cb 0.97 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.59 1kvj h MET 69 CO 0.09 0.13 0.00 0.41 1.06 0.00 0.00 176.91 178.60 1kvj n GLY 70 N -1.26 0.96 2.98 8.32 0.00 -1.08 -5.08 105.19 110.03 1kvj n GLY 70 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 1kvj n GLY 70 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1kvj s PHE 71 N -1.34 -0.24 -0.33 1.61 0.08 -1.25 -5.00 117.98 111.52 1kvj s PHE 71 Ca 0.00 0.62 -0.40 0.00 0.12 0.00 0.00 56.93 57.27 1kvj s PHE 71 Cb 0.00 -0.02 -0.15 0.00 -0.57 0.00 0.00 43.02 42.28 1kvj s PHE 71 CO 0.00 -0.19 1.89 -3.47 -0.10 0.00 0.00 175.22 173.35 1kvj n ASP 72 N 4.19 2.10 -4.67 1.36 -0.08 -0.65 -4.52 116.55 114.27 1kvj n ASP 72 Ca -0.26 0.88 -0.30 0.00 -1.51 0.00 0.00 54.79 53.60 1kvj n ASP 72 Cb 0.52 -1.13 -0.08 0.00 2.34 0.00 0.00 41.12 42.77 1kvj n ASP 72 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1kvj s ALA 73 N 4.72 3.24 -0.36 -1.67 0.00 -1.26 0.14 121.76 126.57 1kvj s ALA 73 Ca 1.04 -1.14 0.05 0.00 0.00 0.00 0.00 51.96 51.91 1kvj s ALA 73 Cb -1.09 -1.14 0.17 0.00 0.00 0.00 0.00 23.12 21.06 1kvj s ALA 73 CO 0.63 0.69 0.50 0.54 0.00 0.00 0.00 175.76 178.12 1kvj s VAL 74 N -1.31 -0.73 0.56 0.00 0.11 0.17 -4.96 120.40 114.25 1kvj s VAL 74 Ca 0.25 -0.35 -0.19 0.00 -2.93 0.00 0.00 61.98 58.77 1kvj s VAL 74 Cb -0.12 -0.55 -0.05 0.00 -1.53 0.00 0.00 36.38 34.13 1kvj s VAL 74 CO 0.18 -0.23 1.13 0.27 -3.33 0.00 0.00 175.10 173.12 1kvj s ILE 75 N 2.02 3.16 -0.60 7.04 -4.36 -1.26 0.53 121.20 127.73 1kvj s ILE 75 Ca 0.14 0.70 0.14 0.00 -0.26 0.00 0.00 60.65 61.37 1kvj s ILE 75 Cb -0.10 -3.26 0.45 0.00 1.25 0.00 0.00 42.46 40.80 1kvj s ILE 75 CO -0.14 -0.18 1.37 1.41 0.24 0.00 0.00 174.94 177.63 1kvj n HIS 76 N -1.47 0.78 -4.34 1.37 8.25 -0.77 -4.80 115.22 114.24 1kvj n HIS 76 Ca 0.11 -0.68 -0.18 0.00 -0.26 0.00 0.00 57.72 56.71 1kvj n HIS 76 Cb 0.51 -0.18 -0.15 0.00 1.12 0.00 0.00 29.99 31.30 1kvj n HIS 76 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 1kvj s ASN 77 N -1.41 1.01 -0.12 0.41 0.02 -1.26 -4.92 114.94 108.67 1kvj s ASN 77 Ca 0.34 -0.16 -0.19 0.00 -1.02 0.00 0.00 52.86 51.84 1kvj s ASN 77 Cb 0.24 -0.11 -0.16 0.00 0.02 0.00 0.00 41.25 41.23 1kvj s ASN 77 CO 0.13 0.10 0.53 1.55 0.02 0.00 0.00 177.10 179.43 1kvj h PRO 78 N 5.91 -0.02 0.00 -0.60 0.13 -1.97 -3.45 132.00 132.01 1kvj h PRO 78 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1kvj h PRO 78 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1kvj h PRO 78 CO 0.50 0.60 0.00 -0.25 -0.23 0.00 0.00 178.00 178.62