#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 -0.55 -3.78 3.04 0.00 -1.26 -4.95 120.51 113.02 2kvs n ALA 2 Ca 0.00 0.17 -0.09 0.00 0.00 0.00 0.00 53.44 53.52 2kvs n ALA 2 Cb 0.00 -2.07 0.02 0.00 0.00 0.00 0.00 19.45 17.41 2kvs n ALA 2 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2kvs s GLY 3 N -2.19 0.41 -0.47 0.00 0.00 -1.26 -5.12 107.32 98.69 2kvs s GLY 3 Ca 0.00 -0.78 0.04 0.00 0.00 0.00 0.00 44.72 43.98 2kvs s GLY 3 CO 0.00 -0.33 0.88 2.09 0.00 0.00 0.00 173.10 175.74 2kvs n ASP 4 N -1.44 -2.84 0.32 1.64 5.75 -1.26 -4.99 116.55 113.73 2kvs n ASP 4 Ca -0.08 -2.81 -0.19 0.00 -0.01 0.00 0.00 54.79 51.70 2kvs n ASP 4 Cb 0.60 1.60 -0.10 0.00 -1.03 0.00 0.00 41.12 42.19 2kvs n ASP 4 CO 0.00 0.00 0.00 -0.65 -0.11 0.00 0.00 177.20 176.44 2kvs h PRO 5 N 4.31 -1.01 -3.66 0.11 0.11 -1.89 -3.46 132.00 126.51 2kvs h PRO 5 Ca -0.07 0.07 -0.28 0.00 0.11 0.00 0.00 66.00 65.83 2kvs h PRO 5 Cb 1.09 0.23 -0.01 0.00 0.11 0.00 0.00 31.00 32.42 2kvs h PRO 5 CO 0.12 -0.68 -0.37 -1.33 -0.21 0.00 0.00 178.00 175.54 2kvs n MET 6 N -5.58 -2.12 -0.12 1.05 2.81 -1.25 -4.86 117.12 107.05 2kvs n MET 6 Ca -0.13 0.69 -0.05 0.00 -1.81 0.00 0.00 57.70 56.41 2kvs n MET 6 Cb 0.47 -5.30 0.03 0.00 -0.71 0.00 0.00 33.22 27.71 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 -0.01 0.70 -0.92 2.03 1.35 -1.89 -0.48 112.91 113.69 2kvs h THR 7 Ca -0.34 -0.04 0.14 0.00 -0.55 0.00 0.00 66.41 65.63 2kvs h THR 7 Cb 1.25 0.59 -0.09 0.00 -1.73 0.00 0.00 68.15 68.17 2kvs h THR 7 CO 0.40 0.02 0.53 0.15 -0.25 0.00 0.00 175.52 176.37 2kvs h PHE 8 N 0.11 0.95 0.54 4.73 3.57 -1.95 -1.05 116.94 123.83 2kvs h PHE 8 Ca 0.19 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.70 2kvs h PHE 8 Cb 0.28 -0.28 0.01 0.00 2.79 0.00 0.00 35.95 38.74 2kvs h PHE 8 CO -0.27 0.29 -0.26 -0.92 -2.23 0.00 0.00 178.31 174.93 2kvs h TYR 9 N 0.78 -0.67 -0.72 0.41 3.20 -1.48 -0.58 116.97 117.91 2kvs h TYR 9 Ca 0.49 -0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.37 2kvs h TYR 9 Cb 0.61 0.22 -0.04 0.00 1.54 0.00 0.00 36.73 39.06 2kvs h TYR 9 CO -0.04 -0.41 0.48 -0.97 -1.64 0.00 0.00 178.16 175.57 2kvs h ASN 10 N -0.73 0.76 -0.02 -2.11 -1.24 -1.14 -1.91 115.58 109.19 2kvs h ASN 10 Ca -0.07 -0.01 -0.00 0.00 0.71 0.00 0.00 56.30 56.93 2kvs h ASN 10 Cb 0.56 -0.18 -0.00 0.00 0.73 0.00 0.00 38.32 39.43 2kvs h ASN 10 CO 0.12 0.52 0.01 0.15 -1.29 0.00 0.00 177.43 176.94 2kvs h PHE 11 N 0.88 0.03 0.00 0.67 3.57 -0.92 -3.11 116.94 118.06 2kvs h PHE 11 Ca 0.29 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.79 2kvs h PHE 11 Cb 0.06 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.79 2kvs h PHE 11 CO -0.00 0.21 0.00 0.97 -2.23 0.00 0.00 178.31 177.26 2kvs h ILE 12 N -0.16 0.00 -0.91 1.41 6.09 -0.80 -3.16 117.51 119.98 2kvs h ILE 12 Ca 0.01 -0.51 0.18 0.00 -1.37 0.00 0.00 64.86 63.16 2kvs h ILE 12 Cb 0.19 1.43 -0.07 0.00 0.47 0.00 0.00 36.82 38.84 2kvs h ILE 12 CO -0.00 0.00 0.59 0.24 -3.07 0.00 0.00 178.15 175.91 2kvs h MET 13 N 0.00 0.56 -1.00 2.19 2.86 -1.28 -0.70 114.93 117.56 2kvs h MET 13 Ca 0.00 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.62 2kvs h MET 13 Cb 0.60 -0.13 -0.05 0.00 0.06 0.00 0.00 31.60 32.08 2kvs h MET 13 CO 0.00 0.37 0.67 0.78 1.06 0.00 0.00 176.91 179.79 2kvs h GLY 14 N 0.58 1.42 2.00 8.32 0.00 -1.71 -1.32 103.07 112.35 2kvs h GLY 14 Ca 0.48 -0.52 0.00 0.00 0.00 0.00 0.00 47.33 47.28 2kvs h GLY 14 CO -0.22 0.51 0.00 0.69 0.00 0.00 0.00 176.54 177.52 2kvs n PHE 15 N -4.39 0.47 0.05 5.60 3.01 -0.32 -2.86 117.46 119.01 2kvs n PHE 15 Ca 0.12 0.15 0.01 0.00 1.01 0.00 0.00 57.45 58.73 2kvs n PHE 15 Cb 0.02 -0.74 -0.07 0.00 -0.01 0.00 0.00 39.48 38.68 2kvs n PHE 15 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 2kvs h GLN 16 N 0.00 0.00 0.38 -1.08 -0.00 -0.72 -3.26 115.11 110.43 2kvs h GLN 16 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.64 2kvs h GLN 16 Cb 0.53 0.00 -0.02 0.00 0.00 0.00 0.00 27.48 27.99 2kvs h GLN 16 CO 0.00 0.31 -0.40 -0.97 0.00 0.00 0.00 178.83 177.76 2kvs h ASN 17 N 0.00 -1.11 -3.70 -0.69 -0.73 -1.14 -3.37 115.58 104.84 2kvs h ASN 17 Ca -0.14 0.09 -0.63 0.00 1.87 0.00 0.00 56.30 57.49 2kvs h ASN 17 Cb 1.55 0.37 -0.15 0.00 0.27 0.00 0.00 38.32 40.36 2kvs h ASN 17 CO 0.05 -0.52 -0.21 1.51 -0.37 0.00 0.00 177.43 177.88 2kvs s ASP 18 N -3.92 6.27 -0.69 1.15 -4.77 -1.26 -5.00 116.67 108.45 2kvs s ASP 18 Ca -0.14 0.27 -0.26 0.00 -3.30 0.00 0.00 52.55 49.12 2kvs s ASP 18 Cb 0.03 -2.22 -0.11 0.00 -1.09 0.00 0.00 42.92 39.54 2kvs s ASP 18 CO 0.47 -0.21 2.39 0.20 0.70 0.00 0.00 175.17 178.72 2kvs s ASN 19 N 1.64 4.12 0.21 2.11 -0.87 -1.26 -4.84 114.94 116.05 2kvs s ASN 19 Ca 0.15 0.38 0.03 0.00 -1.57 0.00 0.00 52.86 51.85 2kvs s ASN 19 Cb -0.16 -2.53 -0.03 0.00 -0.02 0.00 0.00 41.25 38.50 2kvs s ASN 19 CO 0.10 -3.50 0.35 0.42 -2.57 0.00 0.00 177.10 171.90 2kvs s THR 20 N 13.73 5.26 0.62 1.60 -4.23 -1.23 -4.98 115.64 126.42 2kvs s THR 20 Ca 0.93 -0.72 0.32 0.00 -1.18 0.00 0.00 61.69 61.04 2kvs s THR 20 Cb -0.14 -3.79 0.36 0.00 1.34 0.00 0.00 72.50 70.27 2kvs s THR 20 CO 0.14 -0.23 2.10 1.55 -0.54 0.00 0.00 174.62 177.64 2kvs h PRO 21 N 1.66 0.00 0.15 3.99 0.13 -1.92 -0.11 132.00 135.91 2kvs h PRO 21 Ca -0.50 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.30 2kvs h PRO 21 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2kvs h PRO 21 CO 0.65 0.00 -1.71 0.74 -0.23 0.00 0.00 178.00 177.45 2kvs h PHE 22 N 0.00 0.57 0.00 1.56 0.04 -1.90 -3.34 116.94 113.86 2kvs h PHE 22 Ca 0.05 -0.41 -0.00 0.00 2.80 0.00 0.00 57.97 60.41 2kvs h PHE 22 Cb 0.47 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.60 2kvs h PHE 22 CO 0.00 1.56 -0.00 0.78 -0.60 0.00 0.00 178.31 180.05 2kvs h GLY 23 N 1.21 0.00 0.97 -1.45 0.00 -1.11 -1.37 103.07 101.32 2kvs h GLY 23 Ca -0.32 0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.09 2kvs h GLY 23 CO 0.16 0.00 0.47 -2.22 0.00 0.00 0.00 176.54 174.95 2kvs h ILE 24 N 0.00 0.97 -0.40 2.60 1.08 -1.56 -1.51 117.51 118.69 2kvs h ILE 24 Ca -0.00 -0.23 0.02 0.00 -0.39 0.00 0.00 64.86 64.26 2kvs h ILE 24 Cb 0.07 0.24 -0.03 0.00 -3.07 0.00 0.00 36.82 34.03 2kvs h ILE 24 CO 0.00 0.12 0.22 0.25 -0.69 0.00 0.00 178.15 178.05 2kvs h LEU 25 N 0.67 0.35 -0.75 1.44 7.12 -1.48 -1.72 115.31 120.94 2kvs h LEU 25 Ca 0.32 0.01 0.04 0.00 0.13 0.00 0.00 57.88 58.38 2kvs h LEU 25 Cb 0.38 -0.06 -0.05 0.00 -0.53 0.00 0.00 40.66 40.40 2kvs h LEU 25 CO -0.11 0.25 0.47 0.00 -0.13 0.00 0.00 178.44 178.92 2kvs h ALA 26 N 1.19 0.99 -0.44 1.25 0.00 -1.42 -0.45 119.26 120.38 2kvs h ALA 26 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2kvs h ALA 26 Cb 0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2kvs h ALA 26 CO -0.09 0.25 0.29 1.49 0.00 0.00 0.00 179.25 181.19 2kvs h GLU 27 N 0.90 0.58 -0.20 0.00 4.57 -0.98 -2.44 114.58 117.01 2kvs h GLU 27 Ca 0.31 -0.03 -0.11 0.00 -1.18 0.00 0.00 59.36 58.34 2kvs h GLU 27 Cb 0.04 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 28.50 2kvs h GLU 27 CO -0.12 0.38 -0.30 1.25 -1.18 0.00 0.00 179.01 179.04 2kvs h HIS 28 N 0.59 0.68 0.00 0.92 2.76 -0.92 -3.01 115.15 116.17 2kvs h HIS 28 Ca 0.16 -0.23 -0.01 0.00 -2.20 0.00 0.00 60.37 58.09 2kvs h HIS 28 Cb -0.07 -0.13 -0.00 0.00 1.55 0.00 0.00 27.41 28.76 2kvs h HIS 28 CO -0.05 0.95 -0.06 -0.39 -1.30 0.00 0.00 177.93 177.09 2kvs h VAL 29 N 0.23 0.35 -0.42 5.26 -1.51 -1.05 0.63 116.25 119.74 2kvs h VAL 29 Ca 0.02 -0.31 -0.11 0.00 -1.23 0.00 0.00 66.70 65.06 2kvs h VAL 29 Cb 0.87 1.23 -0.01 0.00 -2.13 0.00 0.00 31.29 31.24 2kvs h VAL 29 CO 0.07 0.05 -0.20 -1.28 -1.23 0.00 0.00 177.57 174.98 2kvs h SER 30 N 0.00 0.83 0.30 4.19 0.87 -1.31 -2.14 113.55 116.29 2kvs h SER 30 Ca -0.00 -0.29 -0.01 0.00 -1.23 0.00 0.00 61.79 60.25 2kvs h SER 30 Cb 0.22 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 2kvs h SER 30 CO 0.01 1.01 -0.15 -0.08 -0.53 0.00 0.00 176.83 177.09 2kvs h GLU 31 N 0.72 -0.39 0.00 2.24 4.81 -0.80 -2.67 114.58 118.49 2kvs h GLU 31 Ca 0.10 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 2kvs h GLU 31 Cb 0.72 0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.19 2kvs h GLU 31 CO 0.06 -0.21 0.00 -0.25 -0.73 0.00 0.00 179.01 177.88 2kvs n ASP 32 N -5.23 0.00 0.16 1.04 9.92 -0.74 -2.79 116.55 118.91 2kvs n ASP 32 Ca -0.10 -0.13 0.06 0.00 -0.53 0.00 0.00 54.79 54.09 2kvs n ASP 32 Cb 0.20 -0.14 0.53 0.00 -0.64 0.00 0.00 41.12 41.08 2kvs n ASP 32 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 2kvs h LYS 33 N 0.00 0.18 -0.83 -1.24 3.11 -1.01 -0.94 116.57 115.84 2kvs h LYS 33 Ca 0.00 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.82 2kvs h LYS 33 Cb 0.05 -0.04 0.00 0.00 -1.00 0.00 0.00 32.23 31.24 2kvs h LYS 33 CO 0.00 0.17 0.00 0.00 -2.81 0.00 0.00 179.45 176.81 2kvs n ALA 34 N -2.51 2.67 -2.38 5.00 0.00 -1.12 -4.81 120.51 117.37 2kvs n ALA 34 Ca -0.01 -0.27 -0.29 0.00 0.00 0.00 0.00 53.44 52.88 2kvs n ALA 34 Cb 0.12 -1.02 -0.16 0.00 0.00 0.00 0.00 19.45 18.40 2kvs n ALA 34 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2kvs s PHE 35 N -1.33 2.05 -0.63 0.00 5.36 -0.36 -5.07 117.98 117.99 2kvs s PHE 35 Ca 0.08 -0.39 -0.29 0.00 -0.96 0.00 0.00 56.93 55.37 2kvs s PHE 35 Cb 0.06 -1.31 -0.12 0.00 -0.34 0.00 0.00 43.02 41.30 2kvs s PHE 35 CO 0.03 -0.03 2.48 -0.35 -1.46 0.00 0.00 175.22 175.88 2kvs n PRO 36 N 2.50 0.72 0.01 10.12 -0.04 -1.26 -4.63 135.00 142.42 2kvs n PRO 36 Ca -0.16 0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 2kvs n PRO 36 Cb 0.52 -2.68 0.00 0.00 -0.04 0.00 0.00 33.50 31.31 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 8.73 0.00 -3.52 0.54 1.74 -1.26 -5.09 116.66 117.80 2kvs n ARG 37 Ca 0.47 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 57.36 2kvs n ARG 37 Cb 0.33 -0.27 0.02 0.00 -1.02 0.00 0.00 32.46 31.52 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 -2.82 -3.81 -4.44 0.55 4.32 -1.26 -4.88 117.00 104.65 2kvs n LEU 38 Ca 0.00 -0.69 -0.44 0.00 -0.02 0.00 0.00 56.01 54.85 2kvs n LEU 38 Cb 0.25 -2.44 -0.02 0.00 -1.62 0.00 0.00 43.42 39.60 2kvs n LEU 38 CO 0.00 -0.08 1.05 -1.61 -1.22 0.00 0.00 177.39 175.53 2kvs s GLU 39 N -4.66 3.75 -0.22 3.23 2.02 -1.26 -4.72 118.70 116.85 2kvs s GLU 39 Ca 0.16 -2.07 -0.16 0.00 0.02 0.00 0.00 54.97 52.92 2kvs s GLU 39 Cb -0.06 -4.91 -0.09 0.00 0.10 0.00 0.00 34.13 29.17 2kvs s GLU 39 CO 0.84 -1.72 -0.30 0.39 0.02 0.00 0.00 175.26 174.48 2kvs n GLU 40 N 6.02 0.55 -1.87 1.61 1.02 -1.26 -3.81 120.64 122.90 2kvs n GLU 40 Ca 0.27 0.28 -0.42 0.00 -0.02 0.00 0.00 57.16 57.26 2kvs n GLU 40 Cb 0.47 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.37 2kvs n GLU 40 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2kvs s ARG 41 N -2.66 4.17 0.62 3.49 0.52 -1.26 -4.84 118.95 118.98 2kvs s ARG 41 Ca -0.32 2.37 0.33 0.00 -0.52 0.00 0.00 55.73 57.59 2kvs s ARG 41 Cb 0.08 -3.99 1.84 0.00 0.52 0.00 0.00 34.95 33.40 2kvs s ARG 41 CO 0.45 -0.87 2.14 0.45 0.02 0.00 0.00 175.30 177.48 2kvs h HIS 42 N 9.75 0.00 0.09 -0.53 3.86 -1.94 -1.58 115.15 124.80 2kvs h HIS 42 Ca -0.44 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 58.52 2kvs h HIS 42 Cb 1.20 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.67 2kvs h HIS 42 CO 0.90 0.00 -1.20 0.37 0.86 0.00 0.00 177.93 178.86 2kvs h GLN 43 N 0.00 0.19 -0.79 2.45 -0.00 -1.97 -3.37 115.11 111.62 2kvs h GLN 43 Ca 0.05 -0.33 0.02 0.00 -0.00 0.00 0.00 58.65 58.38 2kvs h GLN 43 Cb 0.39 0.12 -0.04 0.00 0.00 0.00 0.00 27.48 27.95 2kvs h GLN 43 CO -0.00 1.15 0.52 -0.39 0.00 0.00 0.00 178.83 180.11 2kvs h VAL 44 N 0.05 1.18 -0.88 2.39 -1.51 -1.68 -1.91 116.25 113.90 2kvs h VAL 44 Ca -0.11 -0.36 0.10 0.00 -1.23 0.00 0.00 66.70 65.10 2kvs h VAL 44 Cb 1.92 0.05 -0.06 0.00 -2.13 0.00 0.00 31.29 31.06 2kvs h VAL 44 CO 0.18 0.19 0.57 0.40 -1.23 0.00 0.00 177.57 177.68 2kvs h ILE 45 N 1.04 0.97 -0.28 7.19 2.04 -1.72 -0.21 117.51 126.54 2kvs h ILE 45 Ca 0.30 -0.30 -0.05 0.00 1.00 0.00 0.00 64.86 65.82 2kvs h ILE 45 Cb -0.07 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.02 2kvs h ILE 45 CO -0.07 0.16 -0.02 -0.09 0.00 0.00 0.00 178.15 178.12 2kvs h ARG 46 N 0.86 0.43 -0.25 2.37 2.43 -1.57 -2.78 114.38 115.88 2kvs h ARG 46 Ca 0.41 -0.09 -0.03 0.00 -0.81 0.00 0.00 59.98 59.46 2kvs h ARG 46 Cb 0.41 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 2kvs h ARG 46 CO -0.17 0.48 0.03 0.00 -1.51 0.00 0.00 179.97 178.80 2kvs h ALA 47 N 1.57 0.33 -0.08 2.80 0.00 -1.05 -1.52 119.26 121.30 2kvs h ALA 47 Ca 0.09 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.85 2kvs h ALA 47 Cb 0.31 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 2kvs h ALA 47 CO 0.01 0.02 -0.20 1.88 0.00 0.00 0.00 179.25 180.97 2kvs h TYR 48 N 0.22 -0.51 0.31 0.00 0.05 -1.25 -2.61 116.97 113.18 2kvs h TYR 48 Ca 0.07 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.86 2kvs h TYR 48 Cb 0.35 0.24 0.00 0.00 1.01 0.00 0.00 36.73 38.33 2kvs h TYR 48 CO 0.02 -0.27 -0.15 -0.39 -1.05 0.00 0.00 178.16 176.32 2kvs h VAL 49 N -0.28 0.55 0.00 -2.88 -1.51 -1.49 -2.97 116.25 107.68 2kvs h VAL 49 Ca 0.08 -0.75 -0.01 0.00 -1.23 0.00 0.00 66.70 64.79 2kvs h VAL 49 Cb 0.39 0.86 -0.00 0.00 -2.13 0.00 0.00 31.29 30.41 2kvs h VAL 49 CO -0.24 0.12 -0.04 0.24 -1.23 0.00 0.00 177.57 176.42 2kvs h MET 50 N -0.91 0.00 0.18 5.19 2.86 -1.34 0.40 114.93 121.31 2kvs h MET 50 Ca -0.04 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.26 2kvs h MET 50 Cb 0.52 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.19 2kvs h MET 50 CO 0.07 0.04 -1.66 1.03 1.06 0.00 0.00 176.91 177.46 2kvs h SER 51 N 0.00 0.60 -0.01 1.22 0.87 -1.55 -3.40 113.55 111.29 2kvs h SER 51 Ca -0.00 -0.83 0.00 0.00 -1.23 0.00 0.00 61.79 59.73 2kvs h SER 51 Cb 0.27 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 2kvs h SER 51 CO 0.01 1.69 -0.19 0.59 -0.53 0.00 0.00 176.83 178.40 2kvs n ASN 52 N -3.58 1.25 -4.36 6.23 3.02 -0.95 -4.99 115.26 111.87 2kvs n ASN 52 Ca -0.21 -1.12 -0.32 0.00 -0.03 0.00 0.00 54.58 52.90 2kvs n ASN 52 Cb 1.07 0.44 -0.15 0.00 -0.61 0.00 0.00 39.78 40.53 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 -1.31 2.46 -0.13 3.10 1.51 0.14 -5.02 117.35 118.10 2kvs s TYR 53 Ca 0.08 -0.36 0.10 0.00 -1.01 0.00 0.00 57.07 55.88 2kvs s TYR 53 Cb 0.08 -1.55 -0.15 0.00 -0.11 0.00 0.00 41.96 40.23 2kvs s TYR 53 CO 0.24 0.02 0.01 0.25 -1.11 0.00 0.00 175.55 174.96 2kvs n THR 54 N 2.43 0.90 -1.59 -0.71 -2.24 -1.26 -4.67 114.28 107.13 2kvs n THR 54 Ca -0.16 -0.52 -0.45 0.00 -2.27 0.00 0.00 64.05 60.65 2kvs n THR 54 Cb 0.51 -0.73 -0.04 0.00 -2.10 0.00 0.00 70.33 67.97 2kvs n THR 54 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2kvs n ASP 55 N -2.57 3.20 -0.25 3.42 8.00 -1.26 -4.86 116.55 122.24 2kvs n ASP 55 Ca -0.23 0.47 0.10 0.00 0.71 0.00 0.00 54.79 55.84 2kvs n ASP 55 Cb 0.90 -1.46 0.36 0.00 -0.02 0.00 0.00 41.12 40.90 2kvs n ASP 55 CO 0.00 0.00 0.00 0.45 -0.39 0.00 0.00 177.20 177.26 2kvs h HIS 56 N 12.93 0.82 -0.88 1.24 3.86 -1.98 0.24 115.15 131.38 2kvs h HIS 56 Ca -0.41 0.02 0.13 0.00 -1.16 0.00 0.00 60.37 58.96 2kvs h HIS 56 Cb 1.26 -0.26 -0.07 0.00 1.06 0.00 0.00 27.41 29.40 2kvs h HIS 56 CO 0.94 0.36 0.57 1.96 0.86 0.00 0.00 177.93 182.61 2kvs h GLN 57 N 0.74 0.70 0.16 2.45 1.08 -1.94 0.96 115.11 119.26 2kvs h GLN 57 Ca 0.40 -0.04 -0.35 0.00 -1.45 0.00 0.00 58.65 57.21 2kvs h GLN 57 Cb 0.53 -0.16 0.00 0.00 -0.05 0.00 0.00 27.48 27.81 2kvs h GLN 57 CO -0.17 0.46 -1.79 -0.07 -0.95 0.00 0.00 178.83 176.32 2kvs h LEU 58 N 0.72 0.53 0.45 1.46 3.38 -1.44 -3.27 115.31 117.14 2kvs h LEU 58 Ca 0.43 -0.93 -0.02 0.00 0.09 0.00 0.00 57.88 57.45 2kvs h LEU 58 Cb 0.64 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2kvs h LEU 58 CO -0.19 1.79 -0.22 0.40 0.09 0.00 0.00 178.44 180.32 2kvs h ILE 59 N 0.05 0.55 -0.47 1.22 1.08 -0.74 -2.71 117.51 116.50 2kvs h ILE 59 Ca -0.37 -0.14 0.08 0.00 -0.39 0.00 0.00 64.86 64.04 2kvs h ILE 59 Cb 2.04 0.62 -0.06 0.00 -3.07 0.00 0.00 36.82 36.35 2kvs h ILE 59 CO 0.14 0.03 0.10 -0.33 -0.69 0.00 0.00 178.15 177.40 2kvs h GLU 60 N -0.69 0.24 -0.12 2.37 4.39 -1.00 0.25 114.58 120.01 2kvs h GLU 60 Ca -0.06 -0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.66 2kvs h GLU 60 Cb 0.51 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 29.06 2kvs h GLU 60 CO 0.10 0.16 -0.14 1.15 -1.16 0.00 0.00 179.01 179.12 2kvs h THR 61 N 0.24 0.63 -0.01 1.13 2.02 -1.60 0.10 112.91 115.42 2kvs h THR 61 Ca 0.23 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.41 2kvs h THR 61 Cb 0.30 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 67.33 2kvs h THR 61 CO -0.30 0.00 0.00 0.74 0.37 0.00 0.00 175.52 176.34 2kvs h THR 62 N -0.17 1.23 -0.97 3.16 2.02 -1.16 0.37 112.91 117.40 2kvs h THR 62 Ca 0.09 -0.68 0.15 0.00 0.77 0.00 0.00 66.41 66.73 2kvs h THR 62 Cb 0.30 1.67 -0.09 0.00 -1.74 0.00 0.00 68.15 68.29 2kvs h THR 62 CO -0.23 0.18 0.61 -1.13 0.37 0.00 0.00 175.52 175.33 2kvs h ASN 63 N -0.26 0.80 0.05 4.18 -1.24 -0.79 -1.88 115.58 116.45 2kvs h ASN 63 Ca 0.00 0.06 -0.00 0.00 0.71 0.00 0.00 56.30 57.07 2kvs h ASN 63 Cb 0.29 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 39.25 2kvs h ASN 63 CO 0.00 0.38 -0.03 -0.09 -1.29 0.00 0.00 177.43 176.40 2kvs h ARG 64 N 0.83 -0.07 -0.81 6.67 2.43 -0.66 -3.28 114.38 119.49 2kvs h ARG 64 Ca 0.51 0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.77 2kvs h ARG 64 Cb 0.69 0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 30.18 2kvs h ARG 64 CO -0.28 0.51 0.46 0.00 -1.51 0.00 0.00 179.97 179.15 2kvs h ALA 65 N -0.25 1.15 -0.78 2.80 0.00 -0.71 -0.67 119.26 120.81 2kvs h ALA 65 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2kvs h ALA 65 Cb 0.62 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 2kvs h ALA 65 CO 0.01 0.08 0.49 0.82 0.00 0.00 0.00 179.25 180.65 2kvs h ILE 66 N 0.77 1.21 -0.05 0.00 2.04 -1.50 -1.69 117.51 118.29 2kvs h ILE 66 Ca 0.39 -0.43 0.01 0.00 1.00 0.00 0.00 64.86 65.84 2kvs h ILE 66 Cb 0.36 0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.53 2kvs h ILE 66 CO -0.25 0.21 0.04 0.28 0.00 0.00 0.00 178.15 178.44 2kvs h SER 67 N 1.06 0.00 0.11 1.72 0.02 -1.18 -1.31 113.55 113.98 2kvs h SER 67 Ca 0.28 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.23 2kvs h SER 67 Cb -0.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.46 2kvs h SER 67 CO -0.06 0.00 -0.05 -0.07 -1.14 0.00 0.00 176.83 175.51 2kvs h LEU 68 N 0.00 -0.12 -0.89 5.07 -0.00 -1.17 0.15 115.31 118.34 2kvs h LEU 68 Ca 0.02 -0.27 0.00 0.00 -0.00 0.00 0.00 57.88 57.63 2kvs h LEU 68 Cb 0.11 0.03 0.00 0.00 -0.00 0.00 0.00 40.66 40.80 2kvs h LEU 68 CO -0.00 0.21 0.00 -1.22 -0.00 0.00 0.00 178.44 177.43 2kvs n TYR 69 N -5.01 0.21 0.00 1.13 4.01 -0.71 -0.90 117.16 115.90 2kvs n TYR 69 Ca -0.09 -0.08 0.00 0.00 -0.16 0.00 0.00 57.90 57.57 2kvs n TYR 69 Cb 0.21 -0.08 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 2kvs n TYR 69 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 2kvs n MET 70 N -0.05 0.00 0.23 -0.72 2.81 -0.58 -4.73 117.12 114.08 2kvs n MET 70 Ca 0.04 0.00 -0.15 0.00 -1.81 0.00 0.00 57.70 55.77 2kvs n MET 70 Cb 0.24 0.00 -0.08 0.00 -0.71 0.00 0.00 33.22 32.67 2kvs n MET 70 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2kvs h ALA 71 N 0.00 -0.54 -0.75 3.04 0.00 -0.89 0.84 119.26 120.96 2kvs h ALA 71 Ca 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2kvs h ALA 71 Cb 0.00 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2kvs h ALA 71 CO 0.00 -0.78 0.37 -0.97 0.00 0.00 0.00 179.25 177.86 2kvs h ASN 72 N -0.58 0.97 -0.94 0.00 -0.73 -1.33 -1.66 115.58 111.32 2kvs h ASN 72 Ca -0.06 -0.13 0.05 0.00 1.87 0.00 0.00 56.30 58.04 2kvs h ASN 72 Cb 0.44 -0.25 -0.06 0.00 0.27 0.00 0.00 38.32 38.72 2kvs h ASN 72 CO 0.09 0.82 0.61 0.25 -0.37 0.00 0.00 177.43 178.83 2kvs h LEU 73 N 1.05 0.98 -1.50 0.34 5.85 -0.82 -0.12 115.31 121.09 2kvs h LEU 73 Ca 0.26 -0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.94 2kvs h LEU 73 Cb 0.10 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 2kvs h LEU 73 CO -0.03 0.66 -0.07 -0.33 -0.34 0.00 0.00 178.44 178.32 2kvs h GLU 74 N 1.13 0.23 0.00 1.25 5.08 0.03 -0.82 114.58 121.49 2kvs h GLU 74 Ca 0.39 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.66 2kvs h GLU 74 Cb 0.09 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2kvs h GLU 74 CO -0.13 0.32 -0.19 0.45 -1.00 0.00 0.00 179.01 178.46 2kvs h HIS 75 N 0.23 0.00 -0.04 4.33 3.86 -0.18 0.90 115.15 124.25 2kvs h HIS 75 Ca 0.05 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.26 2kvs h HIS 75 Cb 0.28 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.75 2kvs h HIS 75 CO 0.00 0.19 0.00 1.58 0.86 0.00 0.00 177.93 180.57 2kvs n HIS 76 N -3.45 0.05 0.11 2.45 -0.00 -0.32 -4.42 115.22 109.65 2kvs n HIS 76 Ca -0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 57.72 57.69 2kvs n HIS 76 Cb 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.36 2kvs n HIS 76 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2kvs n HIS 77 N -0.50 -2.55 -2.81 1.57 -0.00 -1.06 -5.08 115.22 104.78 2kvs n HIS 77 Ca 0.11 0.58 -0.02 0.00 -0.00 0.00 0.00 57.72 58.39 2kvs n HIS 77 Cb 0.09 1.48 0.01 0.00 -0.00 0.00 0.00 29.99 31.57 2kvs n HIS 77 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2kvs n HIS 78 N -3.07 -3.03 -1.30 1.57 -0.00 0.31 -5.04 115.22 104.65 2kvs n HIS 78 Ca 0.00 -0.21 -0.06 0.00 -0.00 0.00 0.00 57.72 57.46 2kvs n HIS 78 Cb 0.00 -0.06 0.22 0.00 -0.00 0.00 0.00 29.99 30.14 2kvs n HIS 78 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2kvs n HIS 79 N -1.23 1.52 1.46 4.41 8.25 -1.26 -4.06 115.22 124.31 2kvs n HIS 79 Ca 0.02 -1.49 0.12 0.00 -0.26 0.00 0.00 57.72 56.10 2kvs n HIS 79 Cb 0.06 -0.56 0.69 0.00 1.12 0.00 0.00 29.99 31.31 2kvs n HIS 79 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56