#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kvs n ALA 2 N 0.00 0.00 -1.33 -5.12 0.00 -1.26 -5.03 120.51 107.77 2kvs n ALA 2 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 2kvs n ALA 2 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2kvs n ALA 2 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kvs n GLY 3 N -0.21 4.06 2.82 0.00 0.00 -1.26 -4.68 105.19 105.93 2kvs n GLY 3 Ca 0.00 -1.42 -0.00 0.00 0.00 0.00 0.00 46.02 44.59 2kvs n GLY 3 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kvs n ASP 4 N 4.44 -7.14 -0.71 1.61 -0.08 -1.26 -4.94 116.55 108.46 2kvs n ASP 4 Ca 0.67 1.20 0.11 0.00 -1.51 0.00 0.00 54.79 55.26 2kvs n ASP 4 Cb 0.26 -4.44 0.34 0.00 2.34 0.00 0.00 41.12 39.62 2kvs n ASP 4 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2kvs n PRO 5 N 0.96 1.95 -0.17 -0.67 -0.04 -1.26 -4.22 135.00 131.55 2kvs n PRO 5 Ca -0.03 -1.41 0.05 0.00 -0.04 0.00 0.00 63.50 62.06 2kvs n PRO 5 Cb 0.16 -1.44 0.14 0.00 -0.04 0.00 0.00 33.50 32.32 2kvs n PRO 5 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2kvs n MET 6 N 0.65 2.88 -0.29 0.54 2.81 -1.26 -4.70 117.12 117.76 2kvs n MET 6 Ca 0.17 -2.02 0.09 0.00 -1.81 0.00 0.00 57.70 54.12 2kvs n MET 6 Cb 0.42 -1.26 0.21 0.00 -0.71 0.00 0.00 33.22 31.87 2kvs n MET 6 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 2kvs h THR 7 N 1.77 0.22 -0.25 2.03 1.35 -1.91 0.12 112.91 116.23 2kvs h THR 7 Ca 0.00 -0.03 0.05 0.00 -0.55 0.00 0.00 66.41 65.89 2kvs h THR 7 Cb 0.74 0.13 -0.05 0.00 -1.73 0.00 0.00 68.15 67.24 2kvs h THR 7 CO 0.01 0.01 -0.10 0.15 -0.25 0.00 0.00 175.52 175.34 2kvs h PHE 8 N 0.08 -0.23 -0.58 4.73 3.57 -1.94 -0.16 116.94 122.41 2kvs h PHE 8 Ca 0.49 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.92 2kvs h PHE 8 Cb 0.91 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.77 2kvs h PHE 8 CO -0.46 -0.16 0.01 -0.92 -2.23 0.00 0.00 178.31 174.56 2kvs h TYR 9 N -0.06 1.09 0.00 0.41 3.20 -1.51 -2.63 116.97 117.48 2kvs h TYR 9 Ca 0.13 -0.18 -0.01 0.00 3.14 0.00 0.00 58.73 61.81 2kvs h TYR 9 Cb 0.25 -0.29 -0.00 0.00 1.54 0.00 0.00 36.73 38.23 2kvs h TYR 9 CO -0.28 0.98 -0.03 -0.97 -1.64 0.00 0.00 178.16 176.21 2kvs h ASN 10 N 0.90 0.00 0.00 -2.11 -1.24 -0.19 0.24 115.58 113.18 2kvs h ASN 10 Ca 0.16 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.17 2kvs h ASN 10 Cb 0.53 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.58 2kvs h ASN 10 CO 0.03 0.03 -0.03 0.15 -1.29 0.00 0.00 177.43 176.32 2kvs h PHE 11 N 0.00 0.00 0.00 0.67 3.57 -0.70 -3.35 116.94 117.12 2kvs h PHE 11 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2kvs h PHE 11 Cb 0.12 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.86 2kvs h PHE 11 CO 0.00 0.74 0.00 1.51 -2.23 0.00 0.00 178.31 178.33 2kvs n ILE 12 N -4.65 0.60 -1.74 1.41 0.13 -1.03 -4.82 119.36 109.26 2kvs n ILE 12 Ca -0.08 -0.06 -0.42 0.00 -1.10 0.00 0.00 62.75 61.09 2kvs n ILE 12 Cb 0.36 -0.77 -0.01 0.00 -0.84 0.00 0.00 39.64 38.38 2kvs n ILE 12 CO 0.00 0.00 0.00 0.80 2.80 0.00 0.00 176.55 180.15 2kvs n MET 13 N -2.09 2.57 0.00 9.51 1.56 0.84 -2.43 117.12 127.08 2kvs n MET 13 Ca 0.05 0.91 0.00 0.00 -0.27 0.00 0.00 57.70 58.38 2kvs n MET 13 Cb 0.34 -2.64 0.00 0.00 2.15 0.00 0.00 33.22 33.07 2kvs n MET 13 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2kvs n GLY 14 N 1.37 3.04 0.25 -5.12 0.00 -1.26 -4.81 105.19 98.66 2kvs n GLY 14 Ca 0.06 -0.84 0.10 0.00 0.00 0.00 0.00 46.02 45.33 2kvs n GLY 14 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2kvs h PHE 15 N 0.00 0.00 -0.26 1.61 -1.00 -1.81 -2.44 116.94 113.03 2kvs h PHE 15 Ca 0.00 0.00 0.08 0.00 2.81 0.00 0.00 57.97 60.86 2kvs h PHE 15 Cb 0.00 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.55 2kvs h PHE 15 CO 0.00 0.12 0.21 0.37 -1.61 0.00 0.00 178.31 177.40 2kvs h GLN 16 N 0.00 0.00 -0.08 1.51 -0.00 -1.80 -2.30 115.11 112.44 2kvs h GLN 16 Ca -0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 58.65 58.57 2kvs h GLN 16 Cb 0.26 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 27.73 2kvs h GLN 16 CO 0.02 0.00 -0.33 -0.97 0.00 0.00 0.00 178.83 177.55 2kvs h ASN 17 N 0.00 0.15 -3.31 -0.69 -1.24 -1.79 -3.42 115.58 105.27 2kvs h ASN 17 Ca 0.12 -0.05 -0.63 0.00 0.71 0.00 0.00 56.30 56.46 2kvs h ASN 17 Cb 0.54 -0.04 -0.19 0.00 0.73 0.00 0.00 38.32 39.35 2kvs h ASN 17 CO -0.00 0.47 -0.62 1.51 -1.29 0.00 0.00 177.43 177.50 2kvs s ASP 18 N -6.90 5.15 -0.83 1.15 -4.77 -0.87 -5.03 116.67 104.58 2kvs s ASP 18 Ca -0.04 -0.05 -0.25 0.00 -3.30 0.00 0.00 52.55 48.91 2kvs s ASP 18 Cb 0.14 -1.86 -0.11 0.00 -1.09 0.00 0.00 42.92 40.00 2kvs s ASP 18 CO 0.74 0.16 2.25 0.20 0.70 0.00 0.00 175.17 179.23 2kvs s ASN 19 N 0.42 4.31 0.18 2.11 0.01 -1.26 -4.04 114.94 116.67 2kvs s ASN 19 Ca -0.01 -0.19 -0.02 0.00 -0.71 0.00 0.00 52.86 51.93 2kvs s ASN 19 Cb -0.13 -2.55 -0.04 0.00 0.41 0.00 0.00 41.25 38.94 2kvs s ASN 19 CO 0.02 -3.49 0.13 0.42 -1.51 0.00 0.00 177.10 172.67 2kvs s THR 20 N 13.19 0.04 0.41 1.60 -4.23 -1.26 -4.96 115.64 120.42 2kvs s THR 20 Ca 0.85 -1.90 0.20 0.00 -1.18 0.00 0.00 61.69 59.67 2kvs s THR 20 Cb -0.11 -2.28 0.41 0.00 1.34 0.00 0.00 72.50 71.86 2kvs s THR 20 CO 0.05 -0.18 1.75 -0.65 -0.54 0.00 0.00 174.62 175.05 2kvs h PRO 21 N 2.68 0.33 -0.13 3.99 0.11 -1.96 0.99 132.00 138.00 2kvs h PRO 21 Ca -0.35 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.64 2kvs h PRO 21 Cb 1.23 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2kvs h PRO 21 CO 0.54 0.22 -0.31 0.74 -0.21 0.00 0.00 178.00 178.97 2kvs h PHE 22 N 0.34 0.57 -0.89 0.65 0.04 -1.90 -2.75 116.94 113.00 2kvs h PHE 22 Ca 0.62 -0.22 0.04 0.00 2.80 0.00 0.00 57.97 61.22 2kvs h PHE 22 Cb 1.66 -0.10 -0.06 0.00 2.20 0.00 0.00 35.95 39.65 2kvs h PHE 22 CO -0.00 0.93 0.57 0.78 -0.60 0.00 0.00 178.31 179.99 2kvs h GLY 23 N 0.05 1.32 0.95 -1.45 0.00 -1.09 -0.99 103.07 101.86 2kvs h GLY 23 Ca -0.00 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 46.88 2kvs h GLY 23 CO 0.07 0.34 0.18 -2.22 0.00 0.00 0.00 176.54 174.91 2kvs h ILE 24 N 1.08 1.19 0.07 2.60 1.08 -0.93 -0.13 117.51 122.47 2kvs h ILE 24 Ca 0.37 -0.56 0.01 0.00 -0.39 0.00 0.00 64.86 64.28 2kvs h ILE 24 Cb 0.07 0.79 -0.02 0.00 -3.07 0.00 0.00 36.82 34.59 2kvs h ILE 24 CO -0.14 0.21 -0.11 0.25 -0.69 0.00 0.00 178.15 177.67 2kvs h LEU 25 N 0.53 -0.31 -0.56 1.44 7.12 -1.14 0.16 115.31 122.54 2kvs h LEU 25 Ca 0.14 0.04 0.02 0.00 0.13 0.00 0.00 57.88 58.21 2kvs h LEU 25 Cb 0.16 0.12 -0.04 0.00 -0.53 0.00 0.00 40.66 40.37 2kvs h LEU 25 CO -0.01 -0.17 0.34 0.00 -0.13 0.00 0.00 178.44 178.47 2kvs h ALA 26 N 0.68 0.72 -0.50 1.25 0.00 -1.10 -0.88 119.26 119.43 2kvs h ALA 26 Ca 0.02 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2kvs h ALA 26 Cb 0.24 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2kvs h ALA 26 CO -0.06 0.07 0.02 1.49 0.00 0.00 0.00 179.25 180.77 2kvs h GLU 27 N 0.68 0.82 -0.26 0.00 4.81 -0.81 -2.10 114.58 117.72 2kvs h GLU 27 Ca 0.22 -0.22 -0.09 0.00 -0.13 0.00 0.00 59.36 59.15 2kvs h GLU 27 Cb 0.01 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 2kvs h GLU 27 CO -0.09 0.81 -0.17 1.25 -0.73 0.00 0.00 179.01 180.08 2kvs h HIS 28 N 0.77 0.68 0.00 0.92 2.76 -0.17 -2.93 115.15 117.18 2kvs h HIS 28 Ca 0.15 -0.18 -0.05 0.00 -2.20 0.00 0.00 60.37 58.10 2kvs h HIS 28 Cb 0.43 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.24 2kvs h HIS 28 CO 0.02 0.85 -0.22 -0.39 -1.30 0.00 0.00 177.93 176.90 2kvs h VAL 29 N 0.31 0.63 0.00 5.26 -1.51 -1.13 -1.92 116.25 117.89 2kvs h VAL 29 Ca 0.05 -0.98 -0.02 0.00 -1.23 0.00 0.00 66.70 64.52 2kvs h VAL 29 Cb 0.70 1.64 -0.00 0.00 -2.13 0.00 0.00 31.29 31.49 2kvs h VAL 29 CO 0.05 0.21 -0.09 -1.28 -1.23 0.00 0.00 177.57 175.23 2kvs h SER 30 N 0.00 0.00 1.21 4.19 0.87 -1.19 -2.09 113.55 116.54 2kvs h SER 30 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2kvs h SER 30 Cb 0.62 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.58 2kvs h SER 30 CO 0.03 0.09 0.00 -0.08 -0.53 0.00 0.00 176.83 176.34 2kvs h GLU 31 N 0.00 0.00 0.00 2.24 4.81 -1.25 -3.46 114.58 116.92 2kvs h GLU 31 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2kvs h GLU 31 Cb 0.35 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.73 2kvs h GLU 31 CO 0.01 0.00 0.00 -3.47 -0.73 0.00 0.00 179.01 174.82 2kvs n ASP 32 N -2.38 0.00 -0.15 1.04 2.03 -0.79 -4.94 116.55 111.36 2kvs n ASP 32 Ca 0.04 -0.24 0.03 0.00 0.52 0.00 0.00 54.79 55.14 2kvs n ASP 32 Cb 0.36 0.00 0.32 0.00 -0.72 0.00 0.00 41.12 41.08 2kvs n ASP 32 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 2kvs h LYS 33 N 0.00 0.80 0.00 -0.67 1.63 -1.89 -3.46 116.57 112.98 2kvs h LYS 33 Ca 0.00 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 2kvs h LYS 33 Cb 0.00 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 31.45 2kvs h LYS 33 CO 0.00 0.53 0.00 0.00 -3.45 0.00 0.00 179.45 176.53 2kvs n ALA 34 N -2.44 0.00 -2.52 5.00 0.00 -1.26 -4.98 120.51 114.31 2kvs n ALA 34 Ca 0.08 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.28 2kvs n ALA 34 Cb 0.10 -0.76 -0.12 0.00 0.00 0.00 0.00 19.45 18.66 2kvs n ALA 34 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2kvs s PHE 35 N -1.76 1.79 -0.56 0.00 0.08 -1.26 -5.07 117.98 111.20 2kvs s PHE 35 Ca 0.00 -0.43 -0.32 0.00 0.12 0.00 0.00 56.93 56.30 2kvs s PHE 35 Cb 0.00 -0.96 -0.13 0.00 -0.57 0.00 0.00 43.02 41.36 2kvs s PHE 35 CO 0.00 0.23 2.38 -0.35 -0.10 0.00 0.00 175.22 177.38 2kvs n PRO 36 N 0.92 0.74 0.00 0.24 -0.04 -1.26 -4.85 135.00 130.75 2kvs n PRO 36 Ca -0.18 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 2kvs n PRO 36 Cb 0.54 -2.43 0.00 0.00 -0.04 0.00 0.00 33.50 31.57 2kvs n PRO 36 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2kvs n ARG 37 N 8.46 0.00 -0.20 0.54 1.74 -1.26 -4.91 116.66 121.03 2kvs n ARG 37 Ca 0.47 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.66 2kvs n ARG 37 Cb 0.25 -0.52 0.01 0.00 -1.02 0.00 0.00 32.46 31.17 2kvs n ARG 37 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2kvs n LEU 38 N -2.11 0.20 -1.75 0.55 4.77 -1.26 -4.95 117.00 112.45 2kvs n LEU 38 Ca 0.00 -0.62 -0.05 0.00 -0.03 0.00 0.00 56.01 55.32 2kvs n LEU 38 Cb 0.00 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.01 2kvs n LEU 38 CO 0.00 0.15 1.17 -0.62 -1.33 0.00 0.00 177.39 176.76 2kvs n GLU 39 N -0.08 1.30 -0.02 3.23 4.71 -1.26 -4.41 120.64 124.11 2kvs n GLU 39 Ca 0.01 -0.38 -0.00 0.00 -0.01 0.00 0.00 57.16 56.77 2kvs n GLU 39 Cb 0.57 -1.42 -0.00 0.00 -1.01 0.00 0.00 31.44 29.58 2kvs n GLU 39 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 2kvs h GLU 40 N 2.08 0.00 -0.12 3.49 5.08 -1.92 -3.40 114.58 119.78 2kvs h GLU 40 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2kvs h GLU 40 Cb 1.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2kvs h GLU 40 CO 0.10 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.65 2kvs n ARG 41 N -2.87 1.94 0.00 2.33 1.74 -1.26 -4.97 116.66 113.57 2kvs n ARG 41 Ca -0.00 -1.39 0.00 0.00 -0.77 0.00 0.00 57.85 55.69 2kvs n ARG 41 Cb 0.01 -1.45 0.00 0.00 -1.02 0.00 0.00 32.46 30.00 2kvs n ARG 41 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2kvs n HIS 42 N 0.64 0.00 -0.32 -1.55 8.25 -1.26 -4.63 115.22 116.36 2kvs n HIS 42 Ca 0.17 0.00 0.25 0.00 -0.26 0.00 0.00 57.72 57.88 2kvs n HIS 42 Cb 0.43 0.00 0.55 0.00 1.12 0.00 0.00 29.99 32.09 2kvs n HIS 42 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 2kvs h GLN 43 N 0.00 0.31 -0.80 -0.41 4.15 -1.95 0.58 115.11 117.00 2kvs h GLN 43 Ca 0.00 -0.02 0.08 0.00 0.77 0.00 0.00 58.65 59.49 2kvs h GLN 43 Cb 0.00 -0.07 -0.05 0.00 0.21 0.00 0.00 27.48 27.57 2kvs h GLN 43 CO 0.00 0.20 0.52 -0.39 -1.93 0.00 0.00 178.83 177.24 2kvs h VAL 44 N 0.32 0.98 -0.87 2.39 -1.51 -1.90 -2.00 116.25 113.65 2kvs h VAL 44 Ca 0.58 -0.27 0.05 0.00 -1.23 0.00 0.00 66.70 65.83 2kvs h VAL 44 Cb 1.63 0.12 -0.06 0.00 -2.13 0.00 0.00 31.29 30.86 2kvs h VAL 44 CO -0.24 0.14 0.56 0.40 -1.23 0.00 0.00 177.57 177.20 2kvs h ILE 45 N 0.79 1.10 -0.16 7.19 2.04 -1.20 -1.67 117.51 125.59 2kvs h ILE 45 Ca 0.36 -0.36 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 2kvs h ILE 45 Cb 0.36 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 2kvs h ILE 45 CO -0.14 0.19 0.03 -0.09 0.00 0.00 0.00 178.15 178.15 2kvs h ARG 46 N 1.05 0.23 0.01 2.37 1.12 -1.46 -1.30 114.38 116.39 2kvs h ARG 46 Ca 0.36 -0.03 -0.00 0.00 -1.11 0.00 0.00 59.98 59.21 2kvs h ARG 46 Cb 0.08 -0.04 0.00 0.00 -0.01 0.00 0.00 29.97 29.99 2kvs h ARG 46 CO -0.14 0.22 -0.00 0.00 -3.11 0.00 0.00 179.97 176.94 2kvs h ALA 47 N 1.81 -0.01 -0.83 2.80 0.00 -1.30 -3.25 119.26 118.49 2kvs h ALA 47 Ca 0.06 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 2kvs h ALA 47 Cb 0.11 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 2kvs h ALA 47 CO -0.00 -0.23 0.50 1.88 0.00 0.00 0.00 179.25 181.40 2kvs h TYR 48 N -0.56 1.10 -0.14 0.00 0.05 -0.98 -2.70 116.97 113.74 2kvs h TYR 48 Ca -0.00 -0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.74 2kvs h TYR 48 Cb 0.55 -0.36 -0.01 0.00 1.01 0.00 0.00 36.73 37.92 2kvs h TYR 48 CO 0.12 0.73 -0.06 -0.39 -1.05 0.00 0.00 178.16 177.51 2kvs h VAL 49 N 1.14 1.13 0.00 -2.88 -1.51 -1.35 0.20 116.25 112.97 2kvs h VAL 49 Ca 0.30 -0.55 0.00 0.00 -1.23 0.00 0.00 66.70 65.21 2kvs h VAL 49 Cb -0.04 1.10 0.00 0.00 -2.13 0.00 0.00 31.29 30.22 2kvs h VAL 49 CO -0.06 0.18 0.00 0.24 -1.23 0.00 0.00 177.57 176.70 2kvs h MET 50 N 0.20 0.00 0.00 5.19 2.86 -1.51 0.72 114.93 122.39 2kvs h MET 50 Ca 0.05 0.00 -0.35 0.00 -2.06 0.00 0.00 59.70 57.33 2kvs h MET 50 Cb 0.25 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.84 2kvs h MET 50 CO 0.01 0.00 -2.33 0.45 1.06 0.00 0.00 176.91 176.10 2kvs n SER 51 N -2.79 0.40 -0.03 1.22 2.88 -0.34 -4.63 113.62 110.33 2kvs n SER 51 Ca 0.01 -0.01 -0.13 0.00 -1.33 0.00 0.00 58.87 57.41 2kvs n SER 51 Cb 0.30 0.85 -0.14 0.00 -0.75 0.00 0.00 64.21 64.47 2kvs n SER 51 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2kvs n ASN 52 N -2.76 1.16 -4.74 -3.46 3.02 0.54 -4.94 115.26 104.08 2kvs n ASN 52 Ca -0.33 0.26 -0.32 0.00 -0.03 0.00 0.00 54.58 54.16 2kvs n ASN 52 Cb 1.11 -0.14 -0.07 0.00 -0.61 0.00 0.00 39.78 40.07 2kvs n ASN 52 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2kvs s TYR 53 N -2.57 3.18 -0.05 3.10 2.02 0.24 -5.02 117.35 118.25 2kvs s TYR 53 Ca -0.12 0.12 0.07 0.00 -0.37 0.00 0.00 57.07 56.77 2kvs s TYR 53 Cb 0.07 -1.67 -0.11 0.00 -0.40 0.00 0.00 41.96 39.85 2kvs s TYR 53 CO 0.79 0.51 0.08 0.25 -1.57 0.00 0.00 175.55 175.62 2kvs n THR 54 N 1.03 0.32 -3.09 -0.71 -2.24 -1.26 -4.62 114.28 103.70 2kvs n THR 54 Ca -0.12 -0.27 -0.31 0.00 -2.27 0.00 0.00 64.05 61.08 2kvs n THR 54 Cb 0.52 -0.37 -0.04 0.00 -2.10 0.00 0.00 70.33 68.34 2kvs n THR 54 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2kvs s ASP 55 N -3.55 6.59 0.07 3.42 2.15 -1.26 -5.02 116.67 119.07 2kvs s ASP 55 Ca -0.03 1.07 -0.24 0.00 0.43 0.00 0.00 52.55 53.77 2kvs s ASP 55 Cb 0.03 -2.29 -0.16 0.00 -0.30 0.00 0.00 42.92 40.20 2kvs s ASP 55 CO 0.32 -0.27 1.65 0.45 -0.17 0.00 0.00 175.17 177.15 2kvs h HIS 56 N 1.78 -0.04 -0.92 -5.34 3.86 -1.99 -2.82 115.15 109.68 2kvs h HIS 56 Ca -0.47 -0.00 0.10 0.00 -1.16 0.00 0.00 60.37 58.83 2kvs h HIS 56 Cb 1.18 0.01 -0.07 0.00 1.06 0.00 0.00 27.41 29.60 2kvs h HIS 56 CO 0.61 0.06 0.59 1.96 0.86 0.00 0.00 177.93 182.01 2kvs h GLN 57 N -0.13 0.90 -0.13 2.45 7.50 -1.95 0.27 115.11 124.03 2kvs h GLN 57 Ca -0.00 -0.05 -0.13 0.00 0.50 0.00 0.00 58.65 58.96 2kvs h GLN 57 Cb 0.12 -0.20 0.00 0.00 0.05 0.00 0.00 27.48 27.45 2kvs h GLN 57 CO 0.01 0.60 -0.44 -0.07 -1.50 0.00 0.00 178.83 177.42 2kvs h LEU 58 N 0.93 0.61 0.02 1.46 3.38 -1.87 -3.17 115.31 116.66 2kvs h LEU 58 Ca 0.43 -0.61 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 2kvs h LEU 58 Cb 0.40 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2kvs h LEU 58 CO -0.19 1.12 -0.01 0.40 0.09 0.00 0.00 178.44 179.85 2kvs h ILE 59 N 0.13 1.47 -0.13 1.22 2.04 -1.14 -3.24 117.51 117.87 2kvs h ILE 59 Ca -0.02 -1.90 0.04 0.00 1.00 0.00 0.00 64.86 63.98 2kvs h ILE 59 Cb 1.07 2.68 -0.04 0.00 -0.74 0.00 0.00 36.82 39.79 2kvs h ILE 59 CO 0.09 0.46 -0.11 -0.08 0.00 0.00 0.00 178.15 178.51 2kvs h GLU 60 N -0.90 -0.13 -0.86 2.37 4.22 -0.65 -2.14 114.58 116.50 2kvs h GLU 60 Ca -0.00 0.01 0.06 0.00 0.08 0.00 0.00 59.36 59.50 2kvs h GLU 60 Cb 0.77 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 30.00 2kvs h GLU 60 CO 0.00 -0.08 0.56 1.15 -2.18 0.00 0.00 179.01 178.46 2kvs h THR 61 N -0.13 1.07 0.67 0.32 2.02 -1.71 -1.59 112.91 113.55 2kvs h THR 61 Ca 0.09 -0.34 -0.03 0.00 0.77 0.00 0.00 66.41 66.90 2kvs h THR 61 Cb 0.26 0.01 0.01 0.00 -1.74 0.00 0.00 68.15 66.68 2kvs h THR 61 CO -0.21 0.18 -0.32 0.74 0.37 0.00 0.00 175.52 176.28 2kvs h THR 62 N 0.98 0.23 -0.16 3.16 2.02 -1.42 -1.36 112.91 116.36 2kvs h THR 62 Ca 0.36 -0.24 -0.02 0.00 0.77 0.00 0.00 66.41 67.28 2kvs h THR 62 Cb 0.17 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 66.86 2kvs h THR 62 CO -0.13 0.02 -0.01 -0.55 0.37 0.00 0.00 175.52 175.23 2kvs h ASN 63 N -1.08 0.21 0.38 4.18 7.08 -1.39 -2.20 115.58 122.76 2kvs h ASN 63 Ca -0.09 -0.02 -0.01 0.00 -3.08 0.00 0.00 56.30 53.10 2kvs h ASN 63 Cb 0.72 -0.05 -0.01 0.00 -2.08 0.00 0.00 38.32 36.89 2kvs h ASN 63 CO 0.15 0.27 -0.29 -0.09 -2.08 0.00 0.00 177.43 175.38 2kvs h ARG 64 N 0.23 -0.65 -0.36 4.14 2.43 -1.20 -2.08 114.38 116.89 2kvs h ARG 64 Ca 0.06 0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.33 2kvs h ARG 64 Cb 0.18 0.15 -0.05 0.00 -0.42 0.00 0.00 29.97 29.82 2kvs h ARG 64 CO 0.00 -0.43 0.05 0.00 -1.51 0.00 0.00 179.97 178.08 2kvs h ALA 65 N -0.15 0.37 -0.85 2.80 0.00 -0.76 -2.28 119.26 118.39 2kvs h ALA 65 Ca -0.03 0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.01 2kvs h ALA 65 Cb 0.58 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 2kvs h ALA 65 CO -0.00 -0.35 0.55 0.82 0.00 0.00 0.00 179.25 180.27 2kvs h ILE 66 N 0.17 1.07 -0.58 0.00 1.08 -1.34 -2.01 117.51 115.90 2kvs h ILE 66 Ca 0.17 -0.33 -0.03 0.00 -0.39 0.00 0.00 64.86 64.28 2kvs h ILE 66 Cb 0.21 0.02 -0.03 0.00 -3.07 0.00 0.00 36.82 33.95 2kvs h ILE 66 CO -0.24 0.18 0.24 -1.28 -0.69 0.00 0.00 178.15 176.35 2kvs h SER 67 N 0.97 0.77 0.05 1.72 0.87 -0.78 -0.89 113.55 116.25 2kvs h SER 67 Ca 0.36 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.82 2kvs h SER 67 Cb 0.18 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 2kvs h SER 67 CO -0.13 0.69 0.00 0.18 -0.53 0.00 0.00 176.83 177.04 2kvs n LEU 68 N -4.33 0.00 -0.07 2.23 7.99 -0.76 -2.14 117.00 119.92 2kvs n LEU 68 Ca 0.05 0.04 -0.14 0.00 -0.01 0.00 0.00 56.01 55.95 2kvs n LEU 68 Cb 0.16 -0.04 -0.05 0.00 -0.11 0.00 0.00 43.42 43.39 2kvs n LEU 68 CO 0.39 -0.02 -0.84 -1.22 -1.51 0.00 0.00 177.39 174.19 2kvs n TYR 69 N -1.04 0.00 0.09 -1.77 4.01 -0.46 -4.46 117.16 113.52 2kvs n TYR 69 Ca 0.14 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.84 2kvs n TYR 69 Cb 0.08 -0.53 -0.02 0.00 -0.31 0.00 0.00 39.34 38.56 2kvs n TYR 69 CO 0.00 0.00 0.00 0.52 -0.46 0.00 0.00 176.86 176.92 2kvs h MET 70 N -0.68 -0.22 -0.08 -0.72 2.86 -1.21 -0.20 114.93 114.66 2kvs h MET 70 Ca -0.26 0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.42 2kvs h MET 70 Cb 1.09 0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.79 2kvs h MET 70 CO -0.16 -0.15 0.07 0.00 1.06 0.00 0.00 176.91 177.73 2kvs h ALA 71 N -1.83 1.94 0.01 6.32 0.00 -1.68 -1.84 119.26 122.18 2kvs h ALA 71 Ca -0.02 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2kvs h ALA 71 Cb 0.18 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2kvs h ALA 71 CO 0.04 -0.11 -0.00 -0.97 0.00 0.00 0.00 179.25 178.21 2kvs h ASN 72 N 0.00 -0.01 -0.11 0.00 -1.24 -1.59 -2.78 115.58 109.86 2kvs h ASN 72 Ca 0.04 -0.68 0.04 0.00 0.71 0.00 0.00 56.30 56.40 2kvs h ASN 72 Cb 0.17 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.18 2kvs h ASN 72 CO -0.00 0.68 -0.12 0.25 -1.29 0.00 0.00 177.43 176.95 2kvs h LEU 73 N -0.70 -0.39 -0.82 0.34 7.12 -0.58 -1.87 115.31 118.41 2kvs h LEU 73 Ca -0.00 0.07 0.11 0.00 0.13 0.00 0.00 57.88 58.19 2kvs h LEU 73 Cb 0.69 0.19 -0.08 0.00 -0.53 0.00 0.00 40.66 40.93 2kvs h LEU 73 CO 0.00 -0.17 0.45 -0.33 -0.13 0.00 0.00 178.44 178.26 2kvs h GLU 74 N -0.16 0.70 0.00 1.25 4.39 -1.46 0.30 114.58 119.61 2kvs h GLU 74 Ca 0.08 -0.04 -0.07 0.00 0.34 0.00 0.00 59.36 59.67 2kvs h GLU 74 Cb 0.28 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 2kvs h GLU 74 CO -0.21 0.46 -0.35 1.25 -1.16 0.00 0.00 179.01 179.01 2kvs h HIS 75 N 0.72 0.00 0.15 4.33 2.76 -1.11 0.02 115.15 122.01 2kvs h HIS 75 Ca 0.41 0.00 -0.31 0.00 -2.20 0.00 0.00 60.37 58.27 2kvs h HIS 75 Cb 0.44 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.40 2kvs h HIS 75 CO -0.07 0.35 -1.55 0.45 -1.30 0.00 0.00 177.93 175.80 2kvs h HIS 76 N 0.00 0.56 -0.12 5.26 3.86 -0.54 -3.38 115.15 120.79 2kvs h HIS 76 Ca -0.00 -0.41 -0.21 0.00 -1.16 0.00 0.00 60.37 58.59 2kvs h HIS 76 Cb 0.69 -0.02 0.01 0.00 1.06 0.00 0.00 27.41 29.15 2kvs h HIS 76 CO 0.00 1.61 -0.77 1.25 0.86 0.00 0.00 177.93 180.88 2kvs h HIS 77 N -0.13 0.88 -1.75 2.45 6.17 -0.96 -3.39 115.15 118.42 2kvs h HIS 77 Ca -0.32 -0.39 -0.49 0.00 0.71 0.00 0.00 60.37 59.88 2kvs h HIS 77 Cb 1.90 -0.13 -0.06 0.00 2.52 0.00 0.00 27.41 31.64 2kvs h HIS 77 CO 0.12 1.20 1.18 -1.58 0.71 0.00 0.00 177.93 179.55 2kvs s HIS 78 N -3.69 1.98 0.62 5.26 5.04 -0.01 -4.85 115.29 119.65 2kvs s HIS 78 Ca -0.09 0.30 0.32 0.00 -1.54 0.00 0.00 55.06 54.05 2kvs s HIS 78 Cb 0.09 -4.32 1.79 0.00 0.04 0.00 0.00 32.58 30.18 2kvs s HIS 78 CO 0.88 -2.09 2.09 1.25 -2.34 0.00 0.00 174.74 174.53 2kvs h HIS 79 N 12.18 0.00 0.00 3.88 2.76 -1.85 -3.45 115.15 128.67 2kvs h HIS 79 Ca -0.14 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.03 2kvs h HIS 79 Cb 1.08 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.04 2kvs h HIS 79 CO 1.13 0.00 0.00 1.58 -1.30 0.00 0.00 177.93 179.34