#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kvs h ALA 2 N 0.00 1.04 -2.92 3.17 0.00 -2.01 -3.35 119.26 115.19 2kvs h ALA 2 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2kvs h ALA 2 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2kvs h ALA 2 CO 0.00 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.68 2kvs n GLY 3 N -0.59 1.39 3.10 0.00 0.00 -1.26 -4.99 105.19 102.84 2kvs n GLY 3 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.97 2kvs n GLY 3 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2kvs s ASP 4 N -1.06 -0.88 -0.16 1.61 1.47 -1.26 -5.06 116.67 111.34 2kvs s ASP 4 Ca 0.00 -0.98 -0.13 0.00 1.18 0.00 0.00 52.55 52.62 2kvs s ASP 4 Cb 0.00 1.62 -0.08 0.00 -0.34 0.00 0.00 42.92 44.12 2kvs s ASP 4 CO 0.00 -0.19 -0.02 1.55 0.68 0.00 0.00 175.17 177.18 2kvs h PRO 5 N 7.01 0.00 -1.02 2.11 0.13 -1.82 -3.42 132.00 135.00 2kvs h PRO 5 Ca 0.05 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.95 2kvs h PRO 5 Cb 1.15 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.14 2kvs h PRO 5 CO 0.12 0.34 0.29 -1.33 -0.23 0.00 0.00 178.00 177.19 2kvs n MET 6 N -4.57 1.56 -0.02 0.86 2.81 -1.26 -4.42 117.12 112.09 2kvs n MET 6 Ca -0.15 -1.33 -0.10 0.00 -1.81 0.00 0.00 57.70 54.31 2kvs n MET 6 Cb 0.39 -1.52 -0.04 0.00 -0.71 0.00 0.00 33.22 31.33 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 0.46 0.95 -1.02 2.03 1.35 -1.97 -2.33 112.91 112.38 2kvs h THR 7 Ca 0.28 -0.03 0.26 0.00 -0.55 0.00 0.00 66.41 66.37 2kvs h THR 7 Cb 1.80 0.85 -0.12 0.00 -1.73 0.00 0.00 68.15 68.95 2kvs h THR 7 CO 0.50 0.02 0.61 0.15 -0.25 0.00 0.00 175.52 176.54 2kvs h PHE 8 N 0.09 0.94 -0.68 4.73 3.57 -1.96 -0.37 116.94 123.26 2kvs h PHE 8 Ca 0.06 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 2kvs h PHE 8 Cb 0.05 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 2kvs h PHE 8 CO -0.12 0.03 0.29 -0.92 -2.23 0.00 0.00 178.31 175.36 2kvs h TYR 9 N 0.51 0.99 0.00 0.41 3.20 -1.76 -2.26 116.97 118.06 2kvs h TYR 9 Ca 0.65 -0.05 -0.13 0.00 3.14 0.00 0.00 58.73 62.34 2kvs h TYR 9 Cb 1.35 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 39.30 2kvs h TYR 9 CO -0.01 0.75 -0.64 -0.97 -1.64 0.00 0.00 178.16 175.65 2kvs h ASN 10 N 0.97 0.00 -0.26 -2.11 -1.24 -1.09 -2.75 115.58 109.10 2kvs h ASN 10 Ca 0.23 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.22 2kvs h ASN 10 Cb 0.16 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.20 2kvs h ASN 10 CO -0.02 0.61 0.08 0.15 -1.29 0.00 0.00 177.43 176.95 2kvs h PHE 11 N 0.00 0.42 -0.00 0.67 3.57 -0.67 -2.91 116.94 118.02 2kvs h PHE 11 Ca -0.01 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.44 2kvs h PHE 11 Cb 1.47 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 40.09 2kvs h PHE 11 CO 0.00 0.46 -0.20 1.51 -2.23 0.00 0.00 178.31 177.85 2kvs n ILE 12 N -4.74 0.00 -2.00 1.41 0.13 -0.93 -4.89 119.36 108.35 2kvs n ILE 12 Ca -0.03 -0.00 -0.41 0.00 -1.10 0.00 0.00 62.75 61.21 2kvs n ILE 12 Cb 0.16 -0.18 -0.02 0.00 -0.84 0.00 0.00 39.64 38.76 2kvs n ILE 12 CO 0.00 0.00 0.00 -0.32 2.80 0.00 0.00 176.55 179.03 2kvs s MET 13 N -2.96 4.26 0.00 9.51 1.75 -1.04 -2.86 119.30 127.96 2kvs s MET 13 Ca 0.14 2.33 0.00 0.00 -1.25 0.00 0.00 55.69 56.91 2kvs s MET 13 Cb 0.18 -3.07 0.00 0.00 2.84 0.00 0.00 34.83 34.79 2kvs s MET 13 CO 0.59 -0.37 0.00 0.41 -0.65 0.00 0.00 175.02 175.00 2kvs n GLY 14 N 1.41 3.10 0.28 2.11 0.00 -1.26 -4.83 105.19 106.01 2kvs n GLY 14 Ca 0.03 -0.88 0.03 0.00 0.00 0.00 0.00 46.02 45.21 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 0.40 0.00 1.61 0.04 -1.88 -1.09 116.94 116.02 2kvs h PHE 15 Ca 0.00 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.75 2kvs h PHE 15 Cb 0.00 -0.13 -0.00 0.00 2.20 0.00 0.00 35.95 38.02 2kvs h PHE 15 CO 0.00 0.33 -0.06 0.37 -0.60 0.00 0.00 178.31 178.35 2kvs h GLN 16 N 0.41 0.00 -0.00 1.51 5.75 -1.88 -2.33 115.11 118.56 2kvs h GLN 16 Ca 0.10 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.60 2kvs h GLN 16 Cb 0.10 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.65 2kvs h GLN 16 CO -0.01 0.06 -0.02 0.09 -2.65 0.00 0.00 178.83 176.29 2kvs n ASN 17 N -3.49 0.05 -4.14 -0.69 4.13 -0.41 -4.75 115.26 105.95 2kvs n ASN 17 Ca -0.02 0.05 -0.24 0.00 1.68 0.00 0.00 54.58 56.06 2kvs n ASN 17 Cb 0.18 -0.33 -0.15 0.00 -1.54 0.00 0.00 39.78 37.94 2kvs n ASN 17 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2kvs s ASP 18 N -2.73 1.90 -0.95 6.41 2.15 -0.88 -5.06 116.67 117.51 2kvs s ASP 18 Ca 0.23 -0.30 -0.25 0.00 0.43 0.00 0.00 52.55 52.65 2kvs s ASP 18 Cb 0.20 -0.21 -0.14 0.00 -0.30 0.00 0.00 42.92 42.47 2kvs s ASP 18 CO 0.49 0.19 2.17 0.20 -0.17 0.00 0.00 175.17 178.06 2kvs s ASN 19 N -0.41 4.13 0.17 -0.34 0.01 -1.26 -4.76 114.94 112.47 2kvs s ASN 19 Ca 0.06 -0.61 0.09 0.00 -0.71 0.00 0.00 52.86 51.68 2kvs s ASN 19 Cb -0.06 -2.57 -0.04 0.00 0.41 0.00 0.00 41.25 38.98 2kvs s ASN 19 CO -0.01 -3.84 -0.18 0.42 -1.51 0.00 0.00 177.10 171.99 2kvs s THR 20 N 14.12 1.83 0.53 1.60 -4.23 -1.26 -5.03 115.64 123.19 2kvs s THR 20 Ca 0.82 -1.94 0.24 0.00 -1.18 0.00 0.00 61.69 59.63 2kvs s THR 20 Cb -0.08 -1.86 0.37 0.00 1.34 0.00 0.00 72.50 72.27 2kvs s THR 20 CO 0.10 -0.33 2.03 -0.65 -0.54 0.00 0.00 174.62 175.23 2kvs h PRO 21 N 3.21 0.00 0.00 3.99 0.11 -1.95 -0.63 132.00 136.73 2kvs h PRO 21 Ca -0.42 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.64 2kvs h PRO 21 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2kvs h PRO 21 CO 0.52 0.00 -0.24 0.74 -0.21 0.00 0.00 178.00 178.81 2kvs h PHE 22 N 0.00 0.00 -0.09 0.65 0.04 -1.94 -2.80 116.94 112.80 2kvs h PHE 22 Ca 0.20 0.00 0.03 0.00 2.80 0.00 0.00 57.97 60.99 2kvs h PHE 22 Cb 0.80 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.95 2kvs h PHE 22 CO 0.00 0.24 0.11 0.78 -0.60 0.00 0.00 178.31 178.84 2kvs h GLY 23 N 0.91 0.00 1.66 -1.45 0.00 -1.34 -0.72 103.07 102.13 2kvs h GLY 23 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.23 2kvs h GLY 23 CO 0.03 0.00 -0.28 -2.22 0.00 0.00 0.00 176.54 174.07 2kvs h ILE 24 N 0.00 1.27 0.08 2.60 1.08 -1.64 -0.41 117.51 120.48 2kvs h ILE 24 Ca 0.04 -1.28 -0.19 0.00 -0.39 0.00 0.00 64.86 63.04 2kvs h ILE 24 Cb 0.27 1.42 -0.00 0.00 -3.07 0.00 0.00 36.82 35.44 2kvs h ILE 24 CO -0.00 0.40 -0.94 0.25 -0.69 0.00 0.00 178.15 177.17 2kvs h LEU 25 N 0.35 0.25 -0.53 1.44 7.12 -1.37 -3.32 115.31 119.25 2kvs h LEU 25 Ca 0.05 -0.85 0.04 0.00 0.13 0.00 0.00 57.88 57.24 2kvs h LEU 25 Cb 0.68 -0.08 -0.04 0.00 -0.53 0.00 0.00 40.66 40.68 2kvs h LEU 25 CO 0.05 1.41 0.30 0.00 -0.13 0.00 0.00 178.44 180.07 2kvs h ALA 26 N -0.08 0.69 0.00 1.25 0.00 -1.22 -1.17 119.26 118.72 2kvs h ALA 26 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2kvs h ALA 26 Cb 1.49 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2kvs h ALA 26 CO 0.02 -0.02 0.00 1.49 0.00 0.00 0.00 179.25 180.74 2kvs h GLU 27 N 0.58 0.00 0.12 0.00 4.81 -1.23 -1.95 114.58 116.91 2kvs h GLU 27 Ca 0.22 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 59.09 2kvs h GLU 27 Cb 0.08 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 2kvs h GLU 27 CO -0.13 0.00 -2.02 1.58 -0.73 0.00 0.00 179.01 177.71 2kvs n HIS 28 N -2.29 1.21 0.26 0.92 -0.00 -0.52 -3.37 115.22 111.43 2kvs n HIS 28 Ca 0.00 0.26 0.15 0.00 0.46 0.00 0.00 57.72 58.58 2kvs n HIS 28 Cb 0.13 -1.16 0.66 0.00 -0.12 0.00 0.00 29.99 29.51 2kvs n HIS 28 CO 0.00 0.00 0.00 -0.39 0.46 0.00 0.00 176.34 176.41 2kvs h VAL 29 N 0.07 0.28 -0.64 3.57 -1.51 -0.84 -0.86 116.25 116.32 2kvs h VAL 29 Ca -0.43 -0.68 0.00 0.00 -1.23 0.00 0.00 66.70 64.36 2kvs h VAL 29 Cb 2.03 1.53 0.00 0.00 -2.13 0.00 0.00 31.29 32.72 2kvs h VAL 29 CO 0.08 0.09 0.00 -0.24 -1.23 0.00 0.00 177.57 176.27 2kvs n SER 30 N -3.28 3.45 -0.06 4.19 2.88 -0.78 -4.56 113.62 115.45 2kvs n SER 30 Ca -0.00 -2.00 -0.05 0.00 -1.33 0.00 0.00 58.87 55.49 2kvs n SER 30 Cb 0.32 -0.43 -0.02 0.00 -0.75 0.00 0.00 64.21 63.33 2kvs n SER 30 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2kvs n GLU 31 N 1.39 0.35 -3.58 -1.46 2.13 -0.33 -4.87 120.64 114.27 2kvs n GLU 31 Ca 0.22 0.31 -0.40 0.00 0.66 0.00 0.00 57.16 57.94 2kvs n GLU 31 Cb 0.54 -1.31 -0.08 0.00 0.27 0.00 0.00 31.44 30.87 2kvs n GLU 31 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2kvs s ASP 32 N -5.25 5.70 0.00 4.31 2.15 -1.19 -4.80 116.67 117.59 2kvs s ASP 32 Ca -0.16 -2.18 0.10 0.00 0.43 0.00 0.00 52.55 50.73 2kvs s ASP 32 Cb 0.02 -1.99 0.10 0.00 -0.30 0.00 0.00 42.92 40.76 2kvs s ASP 32 CO 0.23 -0.61 0.87 0.29 -0.17 0.00 0.00 175.17 175.78 2kvs n LYS 33 N 4.52 0.70 0.06 4.34 5.02 -1.26 -4.63 118.16 126.91 2kvs n LYS 33 Ca -0.02 -1.20 0.07 0.00 -2.02 0.00 0.00 58.31 55.14 2kvs n LYS 33 Cb 0.41 -1.19 0.51 0.00 -0.02 0.00 0.00 35.03 34.74 2kvs n LYS 33 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2kvs h ALA 34 N 1.88 1.88 -2.42 7.82 0.00 -2.01 -3.39 119.26 123.02 2kvs h ALA 34 Ca 0.00 -0.02 -0.62 0.00 0.00 0.00 0.00 54.91 54.27 2kvs h ALA 34 Cb 0.45 -0.10 -0.13 0.00 0.00 0.00 0.00 17.79 18.02 2kvs h ALA 34 CO 0.00 0.08 0.12 0.12 0.00 0.00 0.00 179.25 179.57 2kvs s PHE 35 N -5.34 3.22 -0.33 0.00 5.36 -1.26 -5.01 117.98 114.61 2kvs s PHE 35 Ca -0.07 0.56 -0.27 0.00 -0.96 0.00 0.00 56.93 56.19 2kvs s PHE 35 Cb 0.18 -2.96 -0.05 0.00 -0.34 0.00 0.00 43.02 39.85 2kvs s PHE 35 CO 0.72 -0.46 2.25 -2.14 -1.46 0.00 0.00 175.22 174.13 2kvs s PRO 36 N 2.57 2.76 0.00 10.12 0.02 -1.26 -4.90 135.00 144.31 2kvs s PRO 36 Ca 0.24 1.73 0.00 0.00 0.02 0.00 0.00 61.00 63.00 2kvs s PRO 36 Cb -0.15 -4.44 0.00 0.00 0.02 0.00 0.00 34.50 29.93 2kvs s PRO 36 CO 0.12 -2.53 0.00 0.54 -0.33 0.00 0.00 177.00 174.80 2kvs n ARG 37 N 8.85 0.00 -2.25 5.54 5.12 -1.26 -4.93 116.66 127.72 2kvs n ARG 37 Ca 0.32 0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 56.11 2kvs n ARG 37 Cb 0.49 -0.09 -0.01 0.00 -1.16 0.00 0.00 32.46 31.68 2kvs n ARG 37 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2kvs n LEU 38 N -0.30 -1.11 0.15 0.55 7.99 -1.26 -4.82 117.00 118.21 2kvs n LEU 38 Ca 0.00 0.21 0.10 0.00 -0.01 0.00 0.00 56.01 56.31 2kvs n LEU 38 Cb 0.00 -2.11 0.60 0.00 -0.11 0.00 0.00 43.42 41.81 2kvs n LEU 38 CO 0.00 -0.22 1.11 1.05 -1.51 0.00 0.00 177.39 177.82 2kvs h GLU 39 N 0.00 0.11 0.00 3.23 9.09 -1.92 -3.38 114.58 121.71 2kvs h GLU 39 Ca -0.29 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.12 2kvs h GLU 39 Cb 1.15 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 28.22 2kvs h GLU 39 CO 0.35 0.07 0.00 -1.91 0.05 0.00 0.00 179.01 177.58 2kvs n GLU 40 N -4.50 0.00 -2.28 1.06 2.13 -1.26 -4.93 120.64 110.86 2kvs n GLU 40 Ca 0.01 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.44 2kvs n GLU 40 Cb 0.19 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 31.88 2kvs n GLU 40 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2kvs s ARG 41 N 0.00 4.13 -0.08 5.31 0.52 -1.26 -4.61 118.95 122.96 2kvs s ARG 41 Ca 0.00 1.89 -0.25 0.00 -0.52 0.00 0.00 55.73 56.84 2kvs s ARG 41 Cb 0.00 -2.76 -0.27 0.00 0.52 0.00 0.00 34.95 32.44 2kvs s ARG 41 CO 0.00 -0.27 0.88 0.45 0.02 0.00 0.00 175.30 176.39 2kvs h HIS 42 N 2.81 0.26 -0.81 -0.53 3.86 -1.95 -3.38 115.15 115.41 2kvs h HIS 42 Ca -0.49 -0.17 0.10 0.00 -1.16 0.00 0.00 60.37 58.65 2kvs h HIS 42 Cb 1.23 -0.02 -0.06 0.00 1.06 0.00 0.00 27.41 29.63 2kvs h HIS 42 CO 0.55 1.09 0.53 0.37 0.86 0.00 0.00 177.93 181.33 2kvs h GLN 43 N -0.65 0.73 0.00 2.45 4.15 -1.94 -2.47 115.11 117.38 2kvs h GLN 43 Ca -0.06 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.31 2kvs h GLN 43 Cb 1.22 -0.16 -0.00 0.00 0.21 0.00 0.00 27.48 28.75 2kvs h GLN 43 CO 0.07 0.48 -0.07 -0.39 -1.93 0.00 0.00 178.83 176.99 2kvs h VAL 44 N 0.75 0.23 0.00 2.39 -1.51 -2.00 -3.15 116.25 112.94 2kvs h VAL 44 Ca 0.38 -0.55 -0.05 0.00 -1.23 0.00 0.00 66.70 65.25 2kvs h VAL 44 Cb 0.46 1.44 -0.01 0.00 -2.13 0.00 0.00 31.29 31.05 2kvs h VAL 44 CO -0.15 0.07 -0.25 0.40 -1.23 0.00 0.00 177.57 176.41 2kvs h ILE 45 N 0.00 0.84 -0.90 7.19 2.04 -1.67 -3.21 117.51 121.81 2kvs h ILE 45 Ca -0.00 -0.98 0.09 0.00 1.00 0.00 0.00 64.86 64.96 2kvs h ILE 45 Cb 0.43 1.59 -0.06 0.00 -0.74 0.00 0.00 36.82 38.04 2kvs h ILE 45 CO 0.01 0.24 0.58 -0.09 0.00 0.00 0.00 178.15 178.90 2kvs h ARG 46 N 0.00 0.92 0.00 2.37 2.43 -1.75 -2.68 114.38 115.66 2kvs h ARG 46 Ca -0.00 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2kvs h ARG 46 Cb 0.57 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 2kvs h ARG 46 CO 0.03 0.61 0.00 0.00 -1.51 0.00 0.00 179.97 179.10 2kvs h ALA 47 N 1.54 1.00 0.08 2.80 0.00 -1.82 -2.45 119.26 120.41 2kvs h ALA 47 Ca 0.41 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 55.12 2kvs h ALA 47 Cb 0.33 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2kvs h ALA 47 CO -0.17 0.00 -1.00 1.88 0.00 0.00 0.00 179.25 179.97 2kvs h TYR 48 N 0.00 0.30 -0.21 0.00 0.05 -1.72 -3.38 116.97 112.02 2kvs h TYR 48 Ca 0.00 -0.22 -0.11 0.00 0.05 0.00 0.00 58.73 58.44 2kvs h TYR 48 Cb 0.05 -0.01 -0.00 0.00 1.01 0.00 0.00 36.73 37.78 2kvs h TYR 48 CO 0.00 1.39 -0.32 -0.39 -1.05 0.00 0.00 178.16 177.79 2kvs h VAL 49 N -0.57 1.33 0.00 -2.88 -1.51 -1.66 -2.88 116.25 108.07 2kvs h VAL 49 Ca -0.22 -1.53 -0.67 0.00 -1.23 0.00 0.00 66.70 63.05 2kvs h VAL 49 Cb 1.52 1.82 -0.00 0.00 -2.13 0.00 0.00 31.29 32.49 2kvs h VAL 49 CO 0.02 0.47 3.36 0.23 -1.23 0.00 0.00 177.57 180.42 2kvs n MET 50 N -4.32 3.07 0.01 5.19 2.81 -0.94 -2.54 117.12 120.41 2kvs n MET 50 Ca -0.05 -2.31 0.00 0.00 -1.81 0.00 0.00 57.70 53.53 2kvs n MET 50 Cb 0.48 -3.00 0.00 0.00 -0.71 0.00 0.00 33.22 29.99 2kvs n MET 50 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2kvs n SER 51 N 5.00 -0.17 -0.03 7.83 2.88 -1.24 -4.85 113.62 123.04 2kvs n SER 51 Ca 0.63 0.50 -0.21 0.00 -1.33 0.00 0.00 58.87 58.46 2kvs n SER 51 Cb 0.31 0.62 -0.13 0.00 -0.75 0.00 0.00 64.21 64.26 2kvs n SER 51 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 2kvs h ASN 52 N 0.00 0.27 -3.55 -3.46 2.35 -1.56 -3.46 115.58 106.17 2kvs h ASN 52 Ca 0.00 -0.79 -0.62 0.00 -0.55 0.00 0.00 56.30 54.35 2kvs h ASN 52 Cb 0.00 -0.09 -0.14 0.00 0.05 0.00 0.00 38.32 38.15 2kvs h ASN 52 CO 0.00 1.59 -0.44 -0.31 -1.65 0.00 0.00 177.43 176.62 2kvs s TYR 53 N -2.45 3.33 -0.18 1.19 2.02 -1.05 -5.00 117.35 115.21 2kvs s TYR 53 Ca -0.23 0.31 -0.24 0.00 -0.37 0.00 0.00 57.07 56.55 2kvs s TYR 53 Cb 0.05 -2.32 -0.22 0.00 -0.40 0.00 0.00 41.96 39.07 2kvs s TYR 53 CO 0.72 0.06 0.42 1.79 -1.57 0.00 0.00 175.55 176.97 2kvs h THR 54 N 5.00 1.21 -3.97 -0.71 1.35 -1.90 -3.41 112.91 110.48 2kvs h THR 54 Ca -0.38 -2.25 -0.54 0.00 -0.55 0.00 0.00 66.41 62.69 2kvs h THR 54 Cb 1.17 2.64 0.11 0.00 -1.73 0.00 0.00 68.15 70.34 2kvs h THR 54 CO 0.67 0.44 0.70 -0.62 -0.25 0.00 0.00 175.52 176.47 2kvs s ASP 55 N -6.66 6.08 0.45 5.36 -1.08 -1.26 -4.91 116.67 114.65 2kvs s ASP 55 Ca -0.25 2.90 0.11 0.00 -0.52 0.00 0.00 52.55 54.79 2kvs s ASP 55 Cb 0.03 -2.65 1.01 0.00 -1.46 0.00 0.00 42.92 39.84 2kvs s ASP 55 CO 0.64 -1.04 2.08 1.12 0.52 0.00 0.00 175.17 178.49 2kvs h HIS 56 N 2.57 0.34 -0.03 -5.34 2.07 -2.00 -3.03 115.15 109.73 2kvs h HIS 56 Ca -0.51 0.01 -0.00 0.00 -2.85 0.00 0.00 60.37 57.02 2kvs h HIS 56 Cb 1.26 -0.12 -0.00 0.00 2.57 0.00 0.00 27.41 31.12 2kvs h HIS 56 CO 0.51 0.21 0.02 1.96 -3.07 0.00 0.00 177.93 177.56 2kvs h GLN 57 N 0.37 0.05 -0.65 5.12 1.08 -1.99 0.13 115.11 119.21 2kvs h GLN 57 Ca 0.12 -0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.26 2kvs h GLN 57 Cb 0.03 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.42 2kvs h GLN 57 CO -0.03 0.14 0.20 -0.07 -0.95 0.00 0.00 178.83 178.13 2kvs h LEU 58 N -0.05 0.92 0.12 1.46 3.38 -1.92 -1.51 115.31 117.71 2kvs h LEU 58 Ca 0.01 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 2kvs h LEU 58 Cb 0.10 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.62 2kvs h LEU 58 CO -0.00 0.86 -0.06 0.40 0.09 0.00 0.00 178.44 179.73 2kvs h ILE 59 N 0.95 1.06 -0.15 1.22 2.04 -1.45 -3.19 117.51 117.99 2kvs h ILE 59 Ca 0.21 -0.83 0.03 0.00 1.00 0.00 0.00 64.86 65.27 2kvs h ILE 59 Cb 0.27 1.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 2kvs h ILE 59 CO -0.01 0.20 -0.01 -0.33 0.00 0.00 0.00 178.15 177.99 2kvs h GLU 60 N -0.56 0.03 -0.94 2.37 4.39 -0.67 -0.46 114.58 118.75 2kvs h GLU 60 Ca -0.02 -0.00 0.27 0.00 0.34 0.00 0.00 59.36 59.95 2kvs h GLU 60 Cb 0.44 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.05 2kvs h GLU 60 CO 0.03 0.02 0.68 1.15 -1.16 0.00 0.00 179.01 179.73 2kvs h THR 61 N 0.03 0.51 0.00 1.13 2.02 -1.36 -0.05 112.91 115.19 2kvs h THR 61 Ca 0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.25 2kvs h THR 61 Cb 0.10 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 67.03 2kvs h THR 61 CO -0.13 0.00 -0.28 0.74 0.37 0.00 0.00 175.52 176.21 2kvs h THR 62 N 0.00 0.00 0.00 3.16 2.02 -1.31 -3.37 112.91 113.41 2kvs h THR 62 Ca 0.45 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.91 2kvs h THR 62 Cb 1.81 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 68.22 2kvs h THR 62 CO -0.00 0.00 -0.06 -0.55 0.37 0.00 0.00 175.52 175.28 2kvs h ASN 63 N -0.70 0.00 -0.05 4.18 -0.00 -1.02 -2.91 115.58 115.08 2kvs h ASN 63 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 56.30 56.29 2kvs h ASN 63 Cb 0.28 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.60 2kvs h ASN 63 CO 0.00 0.06 -0.02 -0.09 -0.00 0.00 0.00 177.43 177.38 2kvs h ARG 64 N 0.00 0.09 -0.66 4.14 2.43 -1.22 -1.90 114.38 117.26 2kvs h ARG 64 Ca -0.00 -0.04 0.11 0.00 -0.81 0.00 0.00 59.98 59.24 2kvs h ARG 64 Cb 0.42 -0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 29.89 2kvs h ARG 64 CO 0.01 0.46 0.25 0.00 -1.51 0.00 0.00 179.97 179.18 2kvs h ALA 65 N 0.63 0.88 -0.51 2.80 0.00 -1.68 0.52 119.26 121.90 2kvs h ALA 65 Ca 0.01 0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.10 2kvs h ALA 65 Cb 0.43 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 2kvs h ALA 65 CO 0.01 -0.19 0.09 0.82 0.00 0.00 0.00 179.25 179.98 2kvs h ILE 66 N 0.43 0.70 -0.38 0.00 2.04 -1.48 -0.41 117.51 118.41 2kvs h ILE 66 Ca 0.34 -0.08 -0.00 0.00 1.00 0.00 0.00 64.86 66.12 2kvs h ILE 66 Cb 0.45 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 2kvs h ILE 66 CO -0.34 0.04 0.22 -1.28 0.00 0.00 0.00 178.15 176.79 2kvs h SER 67 N 0.23 0.46 -0.57 1.72 0.87 -0.24 -2.49 113.55 113.52 2kvs h SER 67 Ca 0.26 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.74 2kvs h SER 67 Cb 0.36 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.17 2kvs h SER 67 CO -0.34 0.40 0.35 -0.07 -0.53 0.00 0.00 176.83 176.63 2kvs h LEU 68 N 0.49 0.69 -1.59 2.23 4.07 -0.55 -1.80 115.31 118.85 2kvs h LEU 68 Ca 0.13 -0.06 0.07 0.00 0.08 0.00 0.00 57.88 58.11 2kvs h LEU 68 Cb 0.03 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 41.56 2kvs h LEU 68 CO -0.02 0.55 0.39 1.88 -1.08 0.00 0.00 178.44 180.15 2kvs h TYR 69 N 0.77 0.51 0.24 1.13 0.05 -0.88 0.94 116.97 119.72 2kvs h TYR 69 Ca 0.21 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.99 2kvs h TYR 69 Cb -0.02 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 37.56 2kvs h TYR 69 CO -0.02 0.26 -0.12 0.52 -1.05 0.00 0.00 178.16 177.75 2kvs h MET 70 N 0.49 -0.31 -0.92 4.88 2.86 -0.93 -2.73 114.93 118.26 2kvs h MET 70 Ca 0.26 0.02 0.09 0.00 -2.06 0.00 0.00 59.70 58.01 2kvs h MET 70 Cb 0.38 0.07 -0.07 0.00 0.06 0.00 0.00 31.60 32.04 2kvs h MET 70 CO -0.07 -0.21 0.57 0.00 1.06 0.00 0.00 176.91 178.25 2kvs h ALA 71 N -1.72 1.33 0.66 6.32 0.00 -1.23 -1.16 119.26 123.47 2kvs h ALA 71 Ca -0.03 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2kvs h ALA 71 Cb 0.25 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.84 2kvs h ALA 71 CO 0.05 0.23 -0.32 -0.97 0.00 0.00 0.00 179.25 178.24 2kvs h ASN 72 N 0.95 -0.76 -0.13 0.00 -0.73 -0.94 -2.72 115.58 111.27 2kvs h ASN 72 Ca 0.44 0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.62 2kvs h ASN 72 Cb 0.34 0.20 -0.01 0.00 0.27 0.00 0.00 38.32 39.12 2kvs h ASN 72 CO -0.23 -0.51 0.08 0.25 -0.37 0.00 0.00 177.43 176.66 2kvs h LEU 73 N -0.94 0.16 -0.39 0.34 7.12 -1.17 0.20 115.31 120.61 2kvs h LEU 73 Ca -0.09 -0.02 0.07 0.00 0.13 0.00 0.00 57.88 57.97 2kvs h LEU 73 Cb 0.70 -0.04 -0.07 0.00 -0.53 0.00 0.00 40.66 40.73 2kvs h LEU 73 CO 0.15 0.13 -0.02 -0.33 -0.13 0.00 0.00 178.44 178.25 2kvs h GLU 74 N 0.16 0.08 0.14 1.25 4.39 -1.25 -2.08 114.58 117.27 2kvs h GLU 74 Ca 0.05 -0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.45 2kvs h GLU 74 Cb 0.00 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 2kvs h GLU 74 CO -0.01 0.05 -1.42 0.45 -1.16 0.00 0.00 179.01 176.92 2kvs h HIS 75 N 0.08 0.53 -0.99 4.33 3.86 -1.42 -3.11 115.15 118.44 2kvs h HIS 75 Ca 0.19 -0.38 0.03 0.00 -1.16 0.00 0.00 60.37 59.05 2kvs h HIS 75 Cb 0.28 -0.02 -0.06 0.00 1.06 0.00 0.00 27.41 28.67 2kvs h HIS 75 CO -0.28 1.37 0.65 1.25 0.86 0.00 0.00 177.93 181.78 2kvs h HIS 76 N 0.08 1.21 -0.01 2.45 -0.00 -0.79 -1.08 115.15 117.02 2kvs h HIS 76 Ca -0.21 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.19 2kvs h HIS 76 Cb 2.02 -0.41 0.00 0.00 -0.00 0.00 0.00 27.41 29.02 2kvs h HIS 76 CO 0.07 0.71 -0.14 -2.39 -0.00 0.00 0.00 177.93 176.18 2kvs n HIS 77 N -4.43 0.00 -3.61 5.26 1.44 -0.80 -5.05 115.22 108.03 2kvs n HIS 77 Ca 0.13 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 55.91 2kvs n HIS 77 Cb 0.09 -0.12 -0.02 0.00 0.12 0.00 0.00 29.99 30.06 2kvs n HIS 77 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2kvs n HIS 78 N -0.68 -2.56 -0.56 -1.40 8.25 -0.41 -4.74 115.22 113.12 2kvs n HIS 78 Ca 0.15 0.63 0.00 0.00 -0.26 0.00 0.00 57.72 58.24 2kvs n HIS 78 Cb 0.30 -0.99 0.00 0.00 1.12 0.00 0.00 29.99 30.43 2kvs n HIS 78 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2kvs n HIS 79 N -2.74 0.00 -1.21 4.41 -0.00 -1.26 -4.84 115.22 109.58 2kvs n HIS 79 Ca 0.00 -0.02 0.00 0.00 0.46 0.00 0.00 57.72 58.16 2kvs n HIS 79 Cb 0.23 -0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.10 2kvs n HIS 79 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38