#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kvs s ALA 2 N 0.00 2.46 0.00 3.04 0.00 -1.26 -4.77 121.76 121.23 2kvs s ALA 2 Ca 0.00 -2.19 0.00 0.00 0.00 0.00 0.00 51.96 49.77 2kvs s ALA 2 Cb 0.00 -4.58 0.00 0.00 0.00 0.00 0.00 23.12 18.54 2kvs s ALA 2 CO 0.00 -4.04 0.00 0.41 0.00 0.00 0.00 175.76 172.13 2kvs n GLY 3 N 6.46 0.97 2.81 0.00 0.00 -1.26 -5.07 105.19 109.11 2kvs n GLY 3 Ca 0.39 -1.89 -0.15 0.00 0.00 0.00 0.00 46.02 44.38 2kvs n GLY 3 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2kvs s ASP 4 N -4.00 1.25 0.00 1.61 -1.08 -1.26 -4.97 116.67 108.22 2kvs s ASP 4 Ca 0.00 -0.70 0.29 0.00 -0.52 0.00 0.00 52.55 51.62 2kvs s ASP 4 Cb 0.00 0.70 1.37 0.00 -1.46 0.00 0.00 42.92 43.53 2kvs s ASP 4 CO 0.00 -0.37 1.97 -2.65 0.52 0.00 0.00 175.17 174.64 2kvs n PRO 5 N 5.25 0.27 -0.00 4.34 -0.02 -1.26 -3.90 135.00 139.69 2kvs n PRO 5 Ca -0.00 0.01 0.10 0.00 -2.02 0.00 0.00 63.50 61.60 2kvs n PRO 5 Cb 0.47 -1.50 0.61 0.00 -0.02 0.00 0.00 33.50 33.06 2kvs n PRO 5 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2kvs n MET 6 N -1.36 1.03 -0.34 -0.52 2.81 -1.26 -3.99 117.12 113.50 2kvs n MET 6 Ca 0.11 -0.05 0.23 0.00 -1.81 0.00 0.00 57.70 56.19 2kvs n MET 6 Cb 0.26 -1.33 0.50 0.00 -0.71 0.00 0.00 33.22 31.94 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 0.10 0.49 -0.23 2.03 1.35 -1.99 0.28 112.91 114.94 2kvs h THR 7 Ca 0.00 -0.14 0.04 0.00 -0.55 0.00 0.00 66.41 65.76 2kvs h THR 7 Cb 0.02 0.06 -0.04 0.00 -1.73 0.00 0.00 68.15 66.47 2kvs h THR 7 CO 0.00 0.07 0.00 0.15 -0.25 0.00 0.00 175.52 175.50 2kvs h PHE 8 N 0.39 -0.00 -0.55 4.73 3.57 -1.93 -1.36 116.94 121.79 2kvs h PHE 8 Ca 0.62 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 62.07 2kvs h PHE 8 Cb 1.55 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 40.31 2kvs h PHE 8 CO -0.00 -0.03 0.07 -0.92 -2.23 0.00 0.00 178.31 175.19 2kvs h TYR 9 N 0.08 1.00 -0.84 0.41 3.20 -0.89 -2.82 116.97 117.12 2kvs h TYR 9 Ca 0.11 -0.15 0.11 0.00 3.14 0.00 0.00 58.73 61.94 2kvs h TYR 9 Cb 0.13 -0.27 -0.06 0.00 1.54 0.00 0.00 36.73 38.07 2kvs h TYR 9 CO -0.18 0.89 0.54 -0.97 -1.64 0.00 0.00 178.16 176.80 2kvs h ASN 10 N 0.82 0.69 0.55 -2.11 -1.24 -0.54 -0.71 115.58 113.04 2kvs h ASN 10 Ca 0.17 0.02 -0.03 0.00 0.71 0.00 0.00 56.30 57.17 2kvs h ASN 10 Cb 0.45 -0.12 0.01 0.00 0.73 0.00 0.00 38.32 39.38 2kvs h ASN 10 CO 0.02 0.39 -0.26 0.15 -1.29 0.00 0.00 177.43 176.44 2kvs h PHE 11 N 0.75 -0.69 0.00 0.67 3.57 -1.00 -3.13 116.94 117.12 2kvs h PHE 11 Ca 0.39 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.84 2kvs h PHE 11 Cb 0.50 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.46 2kvs h PHE 11 CO -0.00 -0.37 -0.20 0.97 -2.23 0.00 0.00 178.31 176.49 2kvs h ILE 12 N -0.92 0.95 -0.08 1.41 6.09 -1.40 -1.46 117.51 122.11 2kvs h ILE 12 Ca -0.08 -0.72 0.02 0.00 -1.37 0.00 0.00 64.86 62.72 2kvs h ILE 12 Cb 0.63 1.41 -0.00 0.00 0.47 0.00 0.00 36.82 39.32 2kvs h ILE 12 CO 0.12 0.19 0.09 0.24 -3.07 0.00 0.00 178.15 175.72 2kvs h MET 13 N 0.00 0.00 0.00 2.19 2.86 -1.08 -0.26 114.93 118.64 2kvs h MET 13 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2kvs h MET 13 Cb 0.39 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.05 2kvs h MET 13 CO 0.03 0.00 0.00 0.78 1.06 0.00 0.00 176.91 178.78 2kvs h GLY 14 N 0.00 0.00 -0.39 8.32 0.00 -1.24 -2.86 103.07 106.89 2kvs h GLY 14 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 2kvs h GLY 14 CO -0.00 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.23 2kvs n PHE 15 N -2.47 0.17 0.19 5.60 3.72 -0.14 -4.71 117.46 119.83 2kvs n PHE 15 Ca 0.02 -0.61 0.12 0.00 -0.05 0.00 0.00 57.45 56.92 2kvs n PHE 15 Cb 0.24 -0.08 0.13 0.00 -0.94 0.00 0.00 39.48 38.83 2kvs n PHE 15 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 2kvs h GLN 16 N 0.57 0.00 -1.64 -1.08 5.75 -1.24 -3.37 115.11 114.10 2kvs h GLN 16 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2kvs h GLN 16 Cb 0.71 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.26 2kvs h GLN 16 CO 0.02 0.01 0.00 -1.71 -2.65 0.00 0.00 178.83 174.50 2kvs n ASN 17 N -3.02 4.46 -3.60 -0.69 4.05 -1.26 -4.71 115.26 110.49 2kvs n ASN 17 Ca 0.03 -2.25 -0.14 0.00 0.45 0.00 0.00 54.58 52.67 2kvs n ASN 17 Cb 0.54 -0.89 -0.07 0.00 1.23 0.00 0.00 39.78 40.59 2kvs n ASN 17 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 2kvs s ASP 18 N 1.64 -0.65 -0.85 1.20 2.15 -1.26 -5.09 116.67 113.81 2kvs s ASP 18 Ca 0.00 1.10 -0.25 0.00 0.43 0.00 0.00 52.55 53.83 2kvs s ASP 18 Cb 0.00 1.06 -0.10 0.00 -0.30 0.00 0.00 42.92 43.58 2kvs s ASP 18 CO 0.00 -0.33 2.19 0.20 -0.17 0.00 0.00 175.17 177.06 2kvs s ASN 19 N -0.14 4.46 -0.06 -0.34 0.01 -1.26 -4.87 114.94 112.74 2kvs s ASN 19 Ca -0.02 -0.31 0.05 0.00 -0.71 0.00 0.00 52.86 51.86 2kvs s ASN 19 Cb -0.03 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.06 2kvs s ASN 19 CO 0.02 -3.37 -0.21 0.42 -1.51 0.00 0.00 177.10 172.45 2kvs s THR 20 N 12.66 1.75 0.66 1.60 -4.23 -1.26 -5.01 115.64 121.81 2kvs s THR 20 Ca 0.82 -0.89 0.38 0.00 -1.18 0.00 0.00 61.69 60.82 2kvs s THR 20 Cb -0.10 -1.50 0.39 0.00 1.34 0.00 0.00 72.50 72.63 2kvs s THR 20 CO 0.04 0.49 2.19 -0.65 -0.54 0.00 0.00 174.62 176.16 2kvs h PRO 21 N 6.25 0.00 0.18 3.99 0.11 -2.00 -2.24 132.00 138.29 2kvs h PRO 21 Ca -0.31 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.53 2kvs h PRO 21 Cb 1.18 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.32 2kvs h PRO 21 CO 0.47 0.00 -1.24 0.74 -0.21 0.00 0.00 178.00 177.77 2kvs h PHE 22 N 0.00 0.71 -0.03 0.65 -1.00 -1.95 -3.31 116.94 112.02 2kvs h PHE 22 Ca 0.01 -0.52 0.01 0.00 2.81 0.00 0.00 57.97 60.28 2kvs h PHE 22 Cb 0.28 -0.03 -0.00 0.00 3.61 0.00 0.00 35.95 39.81 2kvs h PHE 22 CO 0.00 1.48 0.08 0.78 -1.61 0.00 0.00 178.31 179.03 2kvs h GLY 23 N -0.02 0.00 1.30 -1.45 0.00 -1.70 -0.87 103.07 100.34 2kvs h GLY 23 Ca -0.23 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.17 2kvs h GLY 23 CO 0.19 0.00 0.28 -2.22 0.00 0.00 0.00 176.54 174.79 2kvs h ILE 24 N 0.00 0.42 -0.00 2.60 2.04 -1.63 -0.81 117.51 120.12 2kvs h ILE 24 Ca 0.01 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.88 2kvs h ILE 24 Cb 0.17 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 2kvs h ILE 24 CO -0.00 0.00 -0.06 0.25 0.00 0.00 0.00 178.15 178.34 2kvs h LEU 25 N 0.00 -0.16 -0.89 1.44 7.12 -1.38 0.22 115.31 121.67 2kvs h LEU 25 Ca 0.12 0.03 0.01 0.00 0.13 0.00 0.00 57.88 58.16 2kvs h LEU 25 Cb 0.68 0.07 -0.04 0.00 -0.53 0.00 0.00 40.66 40.83 2kvs h LEU 25 CO -0.00 -0.08 0.59 0.00 -0.13 0.00 0.00 178.44 178.81 2kvs h ALA 26 N 0.90 1.13 0.09 1.25 0.00 -1.35 -1.29 119.26 119.99 2kvs h ALA 26 Ca 0.02 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2kvs h ALA 26 Cb 0.13 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 2kvs h ALA 26 CO -0.06 0.52 -0.06 1.49 0.00 0.00 0.00 179.25 181.15 2kvs h GLU 27 N 1.20 -0.14 -0.48 0.00 4.81 -1.19 -2.28 114.58 116.49 2kvs h GLU 27 Ca 0.33 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.54 2kvs h GLU 27 Cb -0.13 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 2kvs h GLU 27 CO -0.07 -0.09 0.18 1.25 -0.73 0.00 0.00 179.01 179.55 2kvs h HIS 28 N -0.15 0.74 0.00 0.92 2.76 -0.11 0.26 115.15 119.57 2kvs h HIS 28 Ca -0.01 -0.06 -0.07 0.00 -2.20 0.00 0.00 60.37 58.04 2kvs h HIS 28 Cb 0.12 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 28.85 2kvs h HIS 28 CO -0.08 0.63 -0.31 -0.39 -1.30 0.00 0.00 177.93 176.47 2kvs h VAL 29 N 0.64 1.21 -0.12 5.26 -1.51 -1.29 -1.03 116.25 119.41 2kvs h VAL 29 Ca 0.16 -1.08 -0.16 0.00 -1.23 0.00 0.00 66.70 64.39 2kvs h VAL 29 Cb 0.21 1.58 -0.01 0.00 -2.13 0.00 0.00 31.29 30.94 2kvs h VAL 29 CO -0.01 0.31 -0.60 -1.28 -1.23 0.00 0.00 177.57 174.75 2kvs h SER 30 N 0.00 0.46 -0.56 4.19 0.87 -0.73 -2.04 113.55 115.75 2kvs h SER 30 Ca -0.00 -0.26 -0.03 0.00 -1.23 0.00 0.00 61.79 60.27 2kvs h SER 30 Cb 0.56 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.36 2kvs h SER 30 CO 0.04 0.95 0.24 -0.08 -0.53 0.00 0.00 176.83 177.45 2kvs h GLU 31 N 0.30 0.82 0.00 2.24 4.81 0.25 -3.35 114.58 119.64 2kvs h GLU 31 Ca -0.01 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 2kvs h GLU 31 Cb 1.14 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.38 2kvs h GLU 31 CO 0.10 0.70 0.00 -3.47 -0.73 0.00 0.00 179.01 175.61 2kvs n ASP 32 N -4.52 0.00 0.00 1.04 2.03 -0.46 -4.99 116.55 109.64 2kvs n ASP 32 Ca 0.03 0.30 0.00 0.00 0.52 0.00 0.00 54.79 55.64 2kvs n ASP 32 Cb 0.15 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.55 2kvs n ASP 32 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2kvs n LYS 33 N -0.34 0.00 -0.97 -0.67 5.02 -0.95 -5.03 118.16 115.23 2kvs n LYS 33 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2kvs n LYS 33 Cb 0.00 -0.03 0.00 0.00 -0.02 0.00 0.00 35.03 34.98 2kvs n LYS 33 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2kvs n ALA 34 N -2.37 0.00 -2.67 7.82 0.00 -0.81 -4.85 120.51 117.63 2kvs n ALA 34 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 2kvs n ALA 34 Cb 0.00 -0.87 -0.08 0.00 0.00 0.00 0.00 19.45 18.51 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 -1.48 3.37 -0.25 0.00 5.36 -1.26 -5.00 117.98 118.72 2kvs s PHE 35 Ca 0.00 0.57 -0.29 0.00 -0.96 0.00 0.00 56.93 56.25 2kvs s PHE 35 Cb 0.00 -2.49 -0.06 0.00 -0.34 0.00 0.00 43.02 40.13 2kvs s PHE 35 CO 0.00 0.00 2.23 -2.30 -1.46 0.00 0.00 175.22 173.70 2kvs n PRO 36 N 4.44 1.80 -0.09 10.12 -0.02 -1.26 -4.83 135.00 145.16 2kvs n PRO 36 Ca -0.09 0.48 -0.12 0.00 -2.02 0.00 0.00 63.50 61.75 2kvs n PRO 36 Cb 0.51 -3.15 -0.11 0.00 -0.02 0.00 0.00 33.50 30.73 2kvs n PRO 36 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2kvs n ARG 37 N 8.72 0.85 0.00 -0.52 1.74 -1.26 -4.93 116.66 121.25 2kvs n ARG 37 Ca 0.32 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.47 2kvs n ARG 37 Cb 0.43 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.46 2kvs n ARG 37 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2kvs n LEU 38 N -2.90 0.00 -3.30 0.55 0.00 -1.26 -5.00 117.00 105.08 2kvs n LEU 38 Ca -0.32 0.00 -0.35 0.00 0.00 0.00 0.00 56.01 55.34 2kvs n LEU 38 Cb 0.94 0.00 -0.03 0.00 0.00 0.00 0.00 43.42 44.33 2kvs n LEU 38 CO 0.26 0.00 3.07 -1.84 0.00 0.00 0.00 177.39 178.87 2kvs n GLU 39 N -0.87 3.18 0.13 1.96 0.00 -1.26 -4.43 120.64 119.35 2kvs n GLU 39 Ca 0.00 -2.01 0.13 0.00 0.00 0.00 0.00 57.16 55.28 2kvs n GLU 39 Cb 0.00 -2.73 0.44 0.00 0.00 0.00 0.00 31.44 29.15 2kvs n GLU 39 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.13 178.18 2kvs h GLU 40 N 5.47 0.00 -4.75 3.44 4.11 -1.94 -3.43 114.58 117.47 2kvs h GLU 40 Ca 0.75 0.00 -0.67 0.00 0.07 0.00 0.00 59.36 59.51 2kvs h GLU 40 Cb 0.27 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 29.34 2kvs h GLU 40 CO 1.70 0.00 -0.48 1.03 0.07 0.00 0.00 179.01 181.34 2kvs s ARG 41 N -3.22 3.56 0.56 1.06 0.52 -1.26 -4.84 118.95 115.32 2kvs s ARG 41 Ca 0.08 -0.59 0.25 0.00 -0.52 0.00 0.00 55.73 54.95 2kvs s ARG 41 Cb 0.11 -3.79 1.49 0.00 0.52 0.00 0.00 34.95 33.27 2kvs s ARG 41 CO 0.52 -0.41 2.06 0.45 0.02 0.00 0.00 175.30 177.93 2kvs h HIS 42 N 8.47 0.00 -0.69 -0.53 3.86 -1.95 -2.29 115.15 122.02 2kvs h HIS 42 Ca -0.32 0.00 0.08 0.00 -1.16 0.00 0.00 60.37 58.97 2kvs h HIS 42 Cb 1.16 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 29.57 2kvs h HIS 42 CO 0.68 0.00 0.37 0.37 0.86 0.00 0.00 177.93 180.20 2kvs h GLN 43 N 0.00 0.63 0.00 2.45 4.15 -1.97 -2.57 115.11 117.80 2kvs h GLN 43 Ca 0.14 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.51 2kvs h GLN 43 Cb 0.65 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 28.20 2kvs h GLN 43 CO -0.00 0.42 -0.05 -0.39 -1.93 0.00 0.00 178.83 176.88 2kvs h VAL 44 N 0.65 0.10 -0.43 2.39 -1.51 -1.82 -3.26 116.25 112.37 2kvs h VAL 44 Ca 0.33 -0.92 0.05 0.00 -1.23 0.00 0.00 66.70 64.93 2kvs h VAL 44 Cb 0.28 1.84 -0.05 0.00 -2.13 0.00 0.00 31.29 31.23 2kvs h VAL 44 CO -0.22 0.05 0.15 0.40 -1.23 0.00 0.00 177.57 176.71 2kvs h ILE 45 N 0.00 0.86 -0.93 7.19 1.08 -1.55 -0.29 117.51 123.87 2kvs h ILE 45 Ca -0.00 -0.11 0.07 0.00 -0.39 0.00 0.00 64.86 64.44 2kvs h ILE 45 Cb 0.84 0.52 -0.06 0.00 -3.07 0.00 0.00 36.82 35.05 2kvs h ILE 45 CO 0.01 0.06 0.60 -0.09 -0.69 0.00 0.00 178.15 178.03 2kvs h ARG 46 N 0.31 1.01 -0.35 2.37 1.12 -1.67 -2.53 114.38 114.63 2kvs h ARG 46 Ca 0.20 -0.06 -0.07 0.00 -1.11 0.00 0.00 59.98 58.94 2kvs h ARG 46 Cb 0.20 -0.23 -0.01 0.00 -0.01 0.00 0.00 29.97 29.92 2kvs h ARG 46 CO -0.21 0.67 -0.06 0.00 -3.11 0.00 0.00 179.97 177.26 2kvs h ALA 47 N 1.51 0.48 -0.03 2.80 0.00 -1.35 -3.11 119.26 119.57 2kvs h ALA 47 Ca 0.41 -0.28 0.03 0.00 0.00 0.00 0.00 54.91 55.06 2kvs h ALA 47 Cb 0.24 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 2kvs h ALA 47 CO -0.16 0.31 -0.50 1.88 0.00 0.00 0.00 179.25 180.77 2kvs h TYR 48 N 0.46 -1.47 -0.64 0.00 0.05 -0.66 0.12 116.97 114.83 2kvs h TYR 48 Ca 0.09 0.05 -0.01 0.00 0.05 0.00 0.00 58.73 58.91 2kvs h TYR 48 Cb 0.55 0.65 -0.03 0.00 1.01 0.00 0.00 36.73 38.90 2kvs h TYR 48 CO 0.05 -0.55 0.35 -0.39 -1.05 0.00 0.00 178.16 176.56 2kvs h VAL 49 N -0.63 1.21 0.00 -2.88 -1.51 -1.63 -1.50 116.25 109.31 2kvs h VAL 49 Ca 0.03 -0.53 -0.07 0.00 -1.23 0.00 0.00 66.70 64.90 2kvs h VAL 49 Cb 0.70 0.38 -0.01 0.00 -2.13 0.00 0.00 31.29 30.23 2kvs h VAL 49 CO -0.37 0.23 -0.35 0.24 -1.23 0.00 0.00 177.57 176.09 2kvs h MET 50 N 0.87 0.00 -0.21 5.19 2.86 -1.44 0.13 114.93 122.34 2kvs h MET 50 Ca 0.22 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 2kvs h MET 50 Cb 0.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.71 2kvs h MET 50 CO -0.04 0.35 0.00 0.45 1.06 0.00 0.00 176.91 178.74 2kvs n SER 51 N -3.59 2.57 0.04 1.22 2.88 0.39 -4.68 113.62 112.45 2kvs n SER 51 Ca -0.00 -1.85 0.00 0.00 -1.33 0.00 0.00 58.87 55.69 2kvs n SER 51 Cb 0.48 -0.13 0.00 0.00 -0.75 0.00 0.00 64.21 63.81 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 0.94 0.09 -4.78 -3.46 3.02 -0.61 -5.03 115.26 105.43 2kvs n ASN 52 Ca 0.17 0.12 -0.37 0.00 -0.03 0.00 0.00 54.58 54.47 2kvs n ASN 52 Cb 0.49 0.05 -0.02 0.00 -0.61 0.00 0.00 39.78 39.68 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 3.05 -0.86 3.10 2.02 0.01 -4.95 117.35 118.42 2kvs s TYR 53 Ca 0.00 1.58 0.14 0.00 -0.37 0.00 0.00 57.07 58.42 2kvs s TYR 53 Cb 0.00 -3.28 -0.11 0.00 -0.40 0.00 0.00 41.96 38.17 2kvs s TYR 53 CO 0.00 -1.13 0.66 -2.37 -1.57 0.00 0.00 175.55 171.14 2kvs n THR 54 N -0.26 0.00 -1.99 -0.71 5.66 -1.26 -4.65 114.28 111.08 2kvs n THR 54 Ca 0.06 -0.22 -0.42 0.00 -3.05 0.00 0.00 64.05 60.42 2kvs n THR 54 Cb 0.48 1.05 -0.03 0.00 -1.55 0.00 0.00 70.33 70.29 2kvs n THR 54 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2kvs s ASP 55 N -2.17 5.77 0.30 1.09 1.11 -1.26 -4.88 116.67 116.62 2kvs s ASP 55 Ca 0.07 1.18 0.03 0.00 0.18 0.00 0.00 52.55 54.01 2kvs s ASP 55 Cb 0.11 -2.53 0.61 0.00 1.07 0.00 0.00 42.92 42.18 2kvs s ASP 55 CO 0.52 -1.83 1.86 -0.74 1.18 0.00 0.00 175.17 176.16 2kvs h HIS 56 N 13.35 1.05 -0.62 4.23 2.76 -1.99 -0.99 115.15 132.94 2kvs h HIS 56 Ca -0.32 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 57.82 2kvs h HIS 56 Cb 1.17 -0.34 -0.03 0.00 1.55 0.00 0.00 27.41 29.77 2kvs h HIS 56 CO 0.97 0.44 0.19 1.96 -1.30 0.00 0.00 177.93 180.18 2kvs h GLN 57 N 0.94 0.96 -0.31 5.26 7.50 -1.91 0.38 115.11 127.93 2kvs h GLN 57 Ca 0.46 -0.21 -0.12 0.00 0.50 0.00 0.00 58.65 59.29 2kvs h GLN 57 Cb 0.48 -0.14 -0.01 0.00 0.05 0.00 0.00 27.48 27.87 2kvs h GLN 57 CO -0.23 0.86 -0.27 -0.07 -1.50 0.00 0.00 178.83 177.63 2kvs h LEU 58 N 0.89 0.77 0.42 1.46 3.38 -1.59 -2.74 115.31 117.91 2kvs h LEU 58 Ca 0.20 -0.46 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 2kvs h LEU 58 Cb 0.30 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2kvs h LEU 58 CO -0.01 1.07 -0.20 0.40 0.09 0.00 0.00 178.44 179.79 2kvs h ILE 59 N 0.49 0.50 -0.72 1.22 2.04 -1.16 -3.08 117.51 116.80 2kvs h ILE 59 Ca 0.06 -0.46 0.09 0.00 1.00 0.00 0.00 64.86 65.54 2kvs h ILE 59 Cb 0.83 0.70 -0.07 0.00 -0.74 0.00 0.00 36.82 37.54 2kvs h ILE 59 CO 0.07 0.07 0.37 -0.08 0.00 0.00 0.00 178.15 178.58 2kvs h GLU 60 N -0.87 0.61 -0.90 2.37 4.81 -1.00 0.31 114.58 119.92 2kvs h GLU 60 Ca -0.06 -0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.21 2kvs h GLU 60 Cb 0.56 -0.14 -0.06 0.00 0.63 0.00 0.00 28.75 29.74 2kvs h GLU 60 CO 0.10 0.40 0.59 1.15 -0.73 0.00 0.00 179.01 180.52 2kvs h THR 61 N 0.63 1.04 0.39 0.32 2.02 -1.56 -1.09 112.91 114.65 2kvs h THR 61 Ca 0.35 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 2kvs h THR 61 Cb 0.36 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.73 2kvs h THR 61 CO -0.26 0.18 -0.19 0.74 0.37 0.00 0.00 175.52 176.36 2kvs h THR 62 N 0.99 0.54 -0.54 3.16 2.02 -0.85 0.09 112.91 118.33 2kvs h THR 62 Ca 0.40 -0.53 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 2kvs h THR 62 Cb 0.26 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.41 2kvs h THR 62 CO -0.16 0.09 0.27 -0.55 0.37 0.00 0.00 175.52 175.54 2kvs h ASN 63 N -0.86 0.67 -0.84 4.18 -1.07 -1.41 -0.17 115.58 116.07 2kvs h ASN 63 Ca -0.05 -0.06 -0.01 0.00 0.07 0.00 0.00 56.30 56.25 2kvs h ASN 63 Cb 0.54 -0.17 -0.04 0.00 -2.07 0.00 0.00 38.32 36.58 2kvs h ASN 63 CO 0.09 0.56 0.49 -0.09 0.07 0.00 0.00 177.43 178.55 2kvs h ARG 64 N 0.75 1.16 0.40 4.14 1.12 -1.14 -1.42 114.38 119.40 2kvs h ARG 64 Ca 0.19 -0.12 -0.02 0.00 -1.11 0.00 0.00 59.98 58.92 2kvs h ARG 64 Cb 0.06 -0.23 0.00 0.00 -0.01 0.00 0.00 29.97 29.79 2kvs h ARG 64 CO -0.03 0.83 -0.19 0.00 -3.11 0.00 0.00 179.97 177.47 2kvs h ALA 65 N 1.26 -0.73 -0.27 2.80 0.00 0.06 -2.98 119.26 119.40 2kvs h ALA 65 Ca 0.30 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.13 2kvs h ALA 65 Cb -0.01 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 2kvs h ALA 65 CO -0.05 -0.69 0.04 0.82 0.00 0.00 0.00 179.25 179.36 2kvs h ILE 66 N -0.82 0.85 0.13 0.00 1.08 -1.13 0.40 117.51 118.02 2kvs h ILE 66 Ca -0.06 -0.05 -0.01 0.00 -0.39 0.00 0.00 64.86 64.36 2kvs h ILE 66 Cb 0.42 0.70 0.00 0.00 -3.07 0.00 0.00 36.82 34.87 2kvs h ILE 66 CO 0.09 0.02 -0.06 -1.28 -0.69 0.00 0.00 178.15 176.23 2kvs h SER 67 N 0.13 -0.15 0.33 1.72 0.87 -1.41 -2.12 113.55 112.92 2kvs h SER 67 Ca 0.13 -0.11 -0.08 0.00 -1.23 0.00 0.00 61.79 60.50 2kvs h SER 67 Cb 0.15 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 2kvs h SER 67 CO -0.18 0.02 -0.35 -0.07 -0.53 0.00 0.00 176.83 175.72 2kvs h LEU 68 N -0.32 0.03 0.31 2.23 -0.00 -1.46 -0.59 115.31 115.51 2kvs h LEU 68 Ca -0.02 -0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.84 2kvs h LEU 68 Cb 0.26 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 40.91 2kvs h LEU 68 CO 0.03 0.38 -0.15 0.22 -0.00 0.00 0.00 178.44 178.92 2kvs h TYR 69 N 0.03 -0.39 -0.25 1.13 3.20 -0.66 0.12 116.97 120.14 2kvs h TYR 69 Ca 0.00 -0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.73 2kvs h TYR 69 Cb 0.63 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.01 2kvs h TYR 69 CO 0.00 -0.20 -0.37 0.00 -1.64 0.00 0.00 178.16 175.95 2kvs h MET 70 N -0.48 0.57 -0.58 1.82 -0.00 -1.31 -1.26 114.93 113.69 2kvs h MET 70 Ca -0.04 -0.28 -0.06 0.00 -0.00 0.00 0.00 59.70 59.32 2kvs h MET 70 Cb 0.36 -0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 31.94 2kvs h MET 70 CO 0.07 0.86 0.11 0.00 -0.00 0.00 0.00 176.91 177.95 2kvs h ALA 71 N 1.12 1.10 -0.05 -3.00 0.00 -1.01 -1.45 119.26 115.97 2kvs h ALA 71 Ca 0.05 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 2kvs h ALA 71 Cb 0.86 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 2kvs h ALA 71 CO 0.07 0.59 -0.04 -0.97 0.00 0.00 0.00 179.25 178.91 2kvs h ASN 72 N 0.88 0.11 -0.85 0.00 -0.73 -0.65 -3.25 115.58 111.08 2kvs h ASN 72 Ca 0.18 -0.46 0.16 0.00 1.87 0.00 0.00 56.30 58.05 2kvs h ASN 72 Cb 0.36 -0.03 -0.10 0.00 0.27 0.00 0.00 38.32 38.82 2kvs h ASN 72 CO 0.01 0.55 0.41 0.25 -0.37 0.00 0.00 177.43 178.28 2kvs h LEU 73 N -0.33 0.45 0.19 0.34 7.12 -1.03 0.41 115.31 122.47 2kvs h LEU 73 Ca 0.01 0.11 0.01 0.00 0.13 0.00 0.00 57.88 58.13 2kvs h LEU 73 Cb 0.52 0.05 -0.04 0.00 -0.53 0.00 0.00 40.66 40.65 2kvs h LEU 73 CO 0.01 0.15 -0.53 -0.08 -0.13 0.00 0.00 178.44 177.86 2kvs h GLU 74 N 0.55 -0.78 0.00 1.25 4.22 -1.30 0.08 114.58 118.59 2kvs h GLU 74 Ca 0.48 0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.97 2kvs h GLU 74 Cb 0.75 0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2kvs h GLU 74 CO -0.41 -0.52 0.00 0.45 -2.18 0.00 0.00 179.01 176.35 2kvs h HIS 75 N -0.81 0.00 -0.00 0.92 3.86 -1.43 0.16 115.15 117.86 2kvs h HIS 75 Ca -0.02 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.02 2kvs h HIS 75 Cb 0.79 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.24 2kvs h HIS 75 CO -0.42 0.00 -0.80 1.25 0.86 0.00 0.00 177.93 178.82 2kvs h HIS 76 N 0.00 0.11 0.00 2.45 2.76 0.51 -3.19 115.15 117.79 2kvs h HIS 76 Ca 0.00 -0.06 -0.12 0.00 -2.20 0.00 0.00 60.37 57.99 2kvs h HIS 76 Cb 0.59 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.52 2kvs h HIS 76 CO 0.00 0.85 -1.58 1.58 -1.30 0.00 0.00 177.93 177.48 2kvs n HIS 77 N -3.64 0.65 -1.78 5.26 -0.00 -0.05 -4.70 115.22 110.95 2kvs n HIS 77 Ca -0.02 0.21 -0.43 0.00 -0.00 0.00 0.00 57.72 57.48 2kvs n HIS 77 Cb 0.77 -0.93 -0.03 0.00 -0.00 0.00 0.00 29.99 29.80 2kvs n HIS 77 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2kvs s HIS 78 N -3.09 1.46 -0.98 1.57 5.04 0.55 -2.78 115.29 117.07 2kvs s HIS 78 Ca -0.04 0.46 -0.06 0.00 -1.54 0.00 0.00 55.06 53.88 2kvs s HIS 78 Cb 0.10 -4.02 -0.05 0.00 0.04 0.00 0.00 32.58 28.65 2kvs s HIS 78 CO 0.83 -3.79 0.85 1.58 -2.34 0.00 0.00 174.74 171.87 2kvs n HIS 79 N 10.50 -2.53 -1.99 3.88 -0.00 -1.26 -4.90 115.22 118.92 2kvs n HIS 79 Ca 0.26 0.88 0.00 0.00 -0.00 0.00 0.00 57.72 58.86 2kvs n HIS 79 Cb 0.45 -4.03 0.00 0.00 -0.00 0.00 0.00 29.99 26.41 2kvs n HIS 79 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92