#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kvz s ASP 2 N 0.00 5.74 -0.52 7.83 2.15 -1.26 -5.05 116.67 125.56 2kvz s ASP 2 Ca 0.00 -1.15 -0.15 0.00 0.43 0.00 0.00 52.55 51.68 2kvz s ASP 2 Cb 0.00 -2.02 0.12 0.00 -0.30 0.00 0.00 42.92 40.72 2kvz s ASP 2 CO 0.00 -0.44 0.47 -0.36 -0.17 0.00 0.00 175.17 174.67 2kvz s PHE 3 N 1.53 3.27 0.56 -5.34 0.08 -1.26 -5.06 117.98 111.76 2kvz s PHE 3 Ca 0.02 -1.30 -0.18 0.00 0.12 0.00 0.00 56.93 55.58 2kvz s PHE 3 Cb -0.20 -3.67 -0.05 0.00 -0.57 0.00 0.00 43.02 38.52 2kvz s PHE 3 CO 0.06 -0.99 1.11 0.20 -0.10 0.00 0.00 175.22 175.50 2kvz s GLY 4 N 3.35 2.51 -0.41 4.36 0.00 -1.26 -4.99 107.32 110.88 2kvz s GLY 4 Ca 0.03 0.73 -0.21 0.00 0.00 0.00 0.00 44.72 45.28 2kvz s GLY 4 CO 0.03 1.08 0.66 0.54 0.00 0.00 0.00 173.10 175.41 2kvz s LYS 5 N -3.47 3.44 0.36 2.90 1.02 -1.26 -4.88 119.74 117.85 2kvz s LYS 5 Ca 0.71 -0.18 0.20 0.00 0.02 0.00 0.00 55.97 56.71 2kvz s LYS 5 Cb -0.22 -3.90 0.21 0.00 -0.52 0.00 0.00 37.83 33.40 2kvz s LYS 5 CO 0.30 -0.92 1.49 -1.35 -0.92 0.00 0.00 175.35 173.95 2kvz h PRO 6 N 8.74 0.00 -4.78 -1.68 0.11 -1.91 -3.40 132.00 129.09 2kvz h PRO 6 Ca -0.26 0.00 -0.71 0.00 0.11 0.00 0.00 66.00 65.15 2kvz h PRO 6 Cb 1.10 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.12 2kvz h PRO 6 CO 0.88 0.18 2.39 0.27 -0.21 0.00 0.00 178.00 181.51 2kvz n ASN 7 N -3.11 4.63 -3.91 -2.05 6.94 -1.23 -1.76 115.26 114.77 2kvz n ASN 7 Ca 0.03 -2.92 -0.11 0.00 -0.02 0.00 0.00 54.58 51.55 2kvz n ASN 7 Cb 0.61 -1.66 -0.12 0.00 -2.36 0.00 0.00 39.78 36.25 2kvz n ASN 7 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2kvz s GLN 8 N 3.03 0.22 -0.27 -3.83 -2.07 -1.26 -4.41 119.66 111.07 2kvz s GLN 8 Ca 0.48 -0.28 -0.04 0.00 -1.82 0.00 0.00 55.36 53.71 2kvz s GLN 8 Cb 0.07 0.09 0.02 0.00 -1.09 0.00 0.00 33.01 32.10 2kvz s GLN 8 CO 0.00 -0.04 0.00 0.08 -1.32 0.00 0.00 175.29 174.02 2kvz s VAL 9 N -0.78 3.37 -0.40 3.63 1.01 -0.93 -2.15 120.40 124.14 2kvz s VAL 9 Ca -0.09 -0.89 -0.15 0.00 0.00 0.00 0.00 61.98 60.86 2kvz s VAL 9 Cb -0.05 -2.73 0.01 0.00 0.00 0.00 0.00 36.38 33.61 2kvz s VAL 9 CO -0.00 0.13 0.29 -0.89 0.00 0.00 0.00 175.10 174.63 2kvz s THR 10 N 1.40 5.24 -0.19 3.92 2.01 0.37 -0.41 115.64 127.98 2kvz s THR 10 Ca 0.01 -0.60 -0.22 0.00 0.31 0.00 0.00 61.69 61.19 2kvz s THR 10 Cb -0.17 -3.88 -0.02 0.00 0.01 0.00 0.00 72.50 68.43 2kvz s THR 10 CO -0.01 -0.26 0.69 -0.69 -0.69 0.00 0.00 174.62 173.66 2kvz s VAL 11 N 1.68 4.97 -0.36 3.82 1.01 0.74 -0.70 120.40 131.57 2kvz s VAL 11 Ca 0.05 1.32 -0.10 0.00 0.00 0.00 0.00 61.98 63.25 2kvz s VAL 11 Cb -0.19 -4.00 0.03 0.00 0.00 0.00 0.00 36.38 32.22 2kvz s VAL 11 CO 0.10 0.08 0.18 0.20 0.00 0.00 0.00 175.10 175.66 2kvz s ASN 12 N 1.20 5.63 -0.72 3.32 0.01 0.85 -1.37 114.94 123.86 2kvz s ASN 12 Ca 0.32 -0.98 -0.24 0.00 -0.71 0.00 0.00 52.86 51.24 2kvz s ASN 12 Cb -0.16 -1.99 0.06 0.00 0.41 0.00 0.00 41.25 39.57 2kvz s ASN 12 CO 0.11 -0.36 1.13 -0.31 -1.51 0.00 0.00 177.10 176.16 2kvz s TYR 13 N 1.53 2.53 0.16 2.20 2.02 -1.26 -0.46 117.35 124.07 2kvz s TYR 13 Ca 0.02 -0.41 0.03 0.00 -0.37 0.00 0.00 57.07 56.34 2kvz s TYR 13 Cb -0.19 -4.45 -0.04 0.00 -0.40 0.00 0.00 41.96 36.88 2kvz s TYR 13 CO 0.06 -1.83 0.26 -0.51 -1.57 0.00 0.00 175.55 171.96 2kvz s LEU 14 N 4.72 4.24 0.00 -1.29 1.43 0.56 -0.26 118.68 128.08 2kvz s LEU 14 Ca 0.29 0.11 0.00 0.00 -1.03 0.00 0.00 54.13 53.50 2kvz s LEU 14 Cb -0.12 -2.81 0.00 0.00 0.03 0.00 0.00 46.19 43.29 2kvz s LEU 14 CO 0.10 0.04 0.00 -0.67 0.23 0.00 0.00 176.35 176.05 2kvz n ASP 15 N -0.59 0.00 0.10 2.29 -0.08 -0.06 0.38 116.55 118.59 2kvz n ASP 15 Ca -0.07 -0.50 -0.03 0.00 -1.51 0.00 0.00 54.79 52.68 2kvz n ASP 15 Cb 0.54 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.98 2kvz n ASP 15 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 2kvz h GLU 16 N 0.00 0.00 0.00 -0.67 4.81 -1.88 -1.30 114.58 115.54 2kvz h GLU 16 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2kvz h GLU 16 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2kvz h GLU 16 CO 0.00 0.80 0.00 0.27 -0.73 0.00 0.00 179.01 179.35 2kvz n ASN 17 N -3.38 0.00 -0.81 1.04 6.94 -1.26 -4.88 115.26 112.91 2kvz n ASN 17 Ca 0.00 -0.73 -0.11 0.00 -0.02 0.00 0.00 54.58 53.73 2kvz n ASN 17 Cb 0.83 -0.05 -0.05 0.00 -2.36 0.00 0.00 39.78 38.15 2kvz n ASN 17 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2kvz n ASN 18 N -1.05 -4.30 -4.82 0.53 3.02 -0.49 -5.00 115.26 103.14 2kvz n ASN 18 Ca 0.20 0.26 -0.38 0.00 -0.03 0.00 0.00 54.58 54.63 2kvz n ASN 18 Cb 0.12 -2.74 -0.06 0.00 -0.61 0.00 0.00 39.78 36.49 2kvz n ASN 18 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2kvz s THR 19 N -2.39 4.81 -0.30 3.41 2.01 -1.26 -4.62 115.64 117.30 2kvz s THR 19 Ca 0.00 1.10 -0.28 0.00 0.31 0.00 0.00 61.69 62.82 2kvz s THR 19 Cb 0.00 -3.84 -0.04 0.00 0.01 0.00 0.00 72.50 68.63 2kvz s THR 19 CO 0.00 0.52 2.06 -0.44 -0.69 0.00 0.00 174.62 176.07 2kvz s SER 20 N -1.19 5.51 0.15 3.53 0.01 -1.26 -0.88 113.70 119.58 2kvz s SER 20 Ca 0.29 1.52 0.01 0.00 1.31 0.00 0.00 55.95 59.08 2kvz s SER 20 Cb -0.18 -2.52 -0.05 0.00 0.21 0.00 0.00 66.02 63.48 2kvz s SER 20 CO 0.18 -1.98 1.35 0.16 0.41 0.00 0.00 173.24 173.36 2kvz h ILE 21 N 7.06 1.49 -2.64 1.44 3.07 -0.93 -3.45 117.51 123.55 2kvz h ILE 21 Ca -0.36 -2.65 -0.59 0.00 1.55 0.00 0.00 64.86 62.81 2kvz h ILE 21 Cb 1.21 2.51 -0.11 0.00 -0.27 0.00 0.00 36.82 40.16 2kvz h ILE 21 CO 1.02 0.78 -0.66 0.00 -1.05 0.00 0.00 178.15 178.23 2kvz s ALA 22 N -3.16 3.14 0.58 0.16 0.00 -1.21 -5.10 121.76 116.17 2kvz s ALA 22 Ca -0.03 -1.50 -0.20 0.00 0.00 0.00 0.00 51.96 50.23 2kvz s ALA 22 Cb 0.10 -0.86 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 2kvz s ALA 22 CO 0.84 0.39 1.23 -0.35 0.00 0.00 0.00 175.76 177.87 2kvz n PRO 23 N -0.40 1.33 -1.84 0.00 -0.04 -1.26 -4.49 135.00 128.30 2kvz n PRO 23 Ca -0.09 0.50 -0.42 0.00 -0.04 0.00 0.00 63.50 63.45 2kvz n PRO 23 Cb 0.57 -2.44 -0.03 0.00 -0.04 0.00 0.00 33.50 31.56 2kvz n PRO 23 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2kvz s SER 24 N -1.11 6.55 -0.51 3.54 1.04 -1.26 -4.74 113.70 117.21 2kvz s SER 24 Ca 0.75 2.49 -0.23 0.00 0.48 0.00 0.00 55.95 59.44 2kvz s SER 24 Cb -0.41 -2.54 0.04 0.00 0.10 0.00 0.00 66.02 63.21 2kvz s SER 24 CO 0.47 -0.97 0.82 -0.22 0.98 0.00 0.00 173.24 174.31 2kvz s LEU 25 N 3.86 4.36 -0.75 2.42 1.98 -0.47 -4.89 118.68 125.19 2kvz s LEU 25 Ca 0.80 -0.43 -0.22 0.00 -2.89 0.00 0.00 54.13 51.39 2kvz s LEU 25 Cb -0.39 -2.76 0.08 0.00 0.66 0.00 0.00 46.19 43.77 2kvz s LEU 25 CO 0.35 -1.06 1.06 -0.31 -1.89 0.00 0.00 176.35 174.51 2kvz s TYR 26 N 3.44 2.73 -0.02 5.38 1.51 -1.26 -0.18 117.35 128.95 2kvz s TYR 26 Ca 0.26 -0.72 -0.26 0.00 -1.01 0.00 0.00 57.07 55.35 2kvz s TYR 26 Cb -0.14 -4.35 -0.04 0.00 -0.11 0.00 0.00 41.96 37.32 2kvz s TYR 26 CO 0.18 -1.67 0.79 -1.17 -1.11 0.00 0.00 175.55 172.57 2kvz s LEU 27 N 3.97 4.36 0.19 -1.29 2.96 0.45 -4.96 118.68 124.36 2kvz s LEU 27 Ca 0.27 1.38 0.05 0.00 -0.22 0.00 0.00 54.13 55.61 2kvz s LEU 27 Cb -0.12 -3.25 -0.04 0.00 0.50 0.00 0.00 46.19 43.29 2kvz s LEU 27 CO 0.05 -0.12 0.22 -0.94 -1.32 0.00 0.00 176.35 174.24 2kvz s SER 28 N 0.64 5.86 0.00 3.68 1.04 -1.26 -2.20 113.70 121.45 2kvz s SER 28 Ca 0.41 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.80 2kvz s SER 28 Cb -0.19 -1.62 0.00 0.00 0.10 0.00 0.00 66.02 64.31 2kvz s SER 28 CO 0.22 0.02 0.00 0.61 0.98 0.00 0.00 173.24 175.07 2kvz n GLY 29 N -0.75 0.90 3.63 7.32 0.00 -1.26 -5.00 105.19 110.03 2kvz n GLY 29 Ca -0.08 -0.92 -0.23 0.00 0.00 0.00 0.00 46.02 44.80 2kvz n GLY 29 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2kvz n LEU 30 N 0.00 0.00 -4.77 0.99 4.77 -1.26 -4.84 117.00 111.89 2kvz n LEU 30 Ca 0.00 -1.87 -0.41 0.00 -0.03 0.00 0.00 56.01 53.70 2kvz n LEU 30 Cb 0.00 -0.66 -0.02 0.00 -2.33 0.00 0.00 43.42 40.41 2kvz n LEU 30 CO 0.00 -1.03 0.97 0.12 -1.33 0.00 0.00 177.39 176.12 2kvz s PHE 31 N -3.02 3.04 -1.25 -1.77 5.36 -1.26 -2.58 117.98 116.51 2kvz s PHE 31 Ca 0.63 1.42 0.00 0.00 -0.96 0.00 0.00 56.93 58.03 2kvz s PHE 31 Cb -0.03 -3.67 0.00 0.00 -0.34 0.00 0.00 43.02 38.98 2kvz s PHE 31 CO 0.42 -1.84 0.00 -1.71 -1.46 0.00 0.00 175.22 170.64 2kvz n ASN 32 N 0.75 -4.39 -4.64 6.13 5.15 -0.51 -4.93 115.26 112.83 2kvz n ASN 32 Ca 0.00 0.02 -0.43 0.00 -0.60 0.00 0.00 54.58 53.58 2kvz n ASN 32 Cb 0.42 -3.50 -0.03 0.00 -0.53 0.00 0.00 39.78 36.14 2kvz n ASN 32 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 2kvz s GLU 33 N -4.55 4.13 -0.41 1.20 2.56 -1.07 -4.79 118.70 115.78 2kvz s GLU 33 Ca 0.00 1.07 -0.26 0.00 0.00 0.00 0.00 54.97 55.78 2kvz s GLU 33 Cb 0.00 -3.69 0.02 0.00 2.00 0.00 0.00 34.13 32.46 2kvz s GLU 33 CO 0.00 -0.72 0.92 0.00 -0.56 0.00 0.00 175.26 174.90 2kvz s ALA 34 N 3.28 3.34 0.40 6.30 0.00 -1.26 -2.11 121.76 131.71 2kvz s ALA 34 Ca 0.41 -0.59 0.07 0.00 0.00 0.00 0.00 51.96 51.85 2kvz s ALA 34 Cb -0.14 -3.58 -0.06 0.00 0.00 0.00 0.00 23.12 19.34 2kvz s ALA 34 CO 0.11 -1.79 0.10 1.52 0.00 0.00 0.00 175.76 175.70 2kvz s TYR 35 N 3.59 2.57 -0.14 0.00 1.13 -1.25 -5.08 117.35 118.16 2kvz s TYR 35 Ca 0.38 -0.60 -0.00 0.00 -1.41 0.00 0.00 57.07 55.44 2kvz s TYR 35 Cb -0.11 -1.84 -0.01 0.00 -1.10 0.00 0.00 41.96 38.90 2kvz s TYR 35 CO 0.22 0.31 -0.14 -0.80 -2.51 0.00 0.00 175.55 172.63 2kvz s ASN 36 N -3.81 3.87 -0.37 -0.18 -0.87 -1.26 -4.80 114.94 107.52 2kvz s ASN 36 Ca 0.38 -0.39 -0.27 0.00 -1.57 0.00 0.00 52.86 51.01 2kvz s ASN 36 Cb 0.06 -1.59 0.02 0.00 -0.02 0.00 0.00 41.25 39.71 2kvz s ASN 36 CO 0.21 0.12 0.97 -0.69 -2.57 0.00 0.00 177.10 175.14 2kvz s VAL 37 N 0.59 4.55 -0.04 1.60 1.01 -1.26 -5.02 120.40 121.83 2kvz s VAL 37 Ca -0.08 1.30 -0.30 0.00 0.00 0.00 0.00 61.98 62.90 2kvz s VAL 37 Cb -0.16 -4.37 -0.03 0.00 0.00 0.00 0.00 36.38 31.83 2kvz s VAL 37 CO 0.03 -0.56 1.01 -2.84 0.00 0.00 0.00 175.10 172.75 2kvz s PRO 38 N 3.57 4.49 0.14 2.72 0.02 -1.26 -5.06 135.00 139.63 2kvz s PRO 38 Ca 0.40 1.44 0.04 0.00 0.02 0.00 0.00 61.00 62.90 2kvz s PRO 38 Cb -0.12 -3.49 -0.04 0.00 0.02 0.00 0.00 34.50 30.88 2kvz s PRO 38 CO 0.19 -0.18 0.16 -1.64 -0.33 0.00 0.00 177.00 175.20 2kvz s MET 39 N 1.43 3.04 -0.04 5.54 -1.94 -1.26 -5.10 119.30 120.98 2kvz s MET 39 Ca 0.51 -0.76 -0.02 0.00 -1.71 0.00 0.00 55.69 53.72 2kvz s MET 39 Cb -0.21 -2.75 0.03 0.00 2.01 0.00 0.00 34.83 33.91 2kvz s MET 39 CO 0.24 0.51 0.05 0.15 -0.01 0.00 0.00 175.02 175.97 2kvz s LYS 40 N -2.98 -0.06 -0.79 2.03 1.02 -1.26 -5.09 119.74 112.61 2kvz s LYS 40 Ca 0.32 0.35 -0.15 0.00 0.02 0.00 0.00 55.97 56.50 2kvz s LYS 40 Cb -0.11 -0.48 0.19 0.00 -0.52 0.00 0.00 37.83 36.92 2kvz s LYS 40 CO 0.25 -0.31 0.76 0.15 -0.92 0.00 0.00 175.35 175.28 2kvz s LYS 41 N 2.00 3.50 -0.20 1.68 1.02 -1.26 -4.93 119.74 121.55 2kvz s LYS 41 Ca 0.03 -2.25 -0.29 0.00 0.02 0.00 0.00 55.97 53.47 2kvz s LYS 41 Cb -0.12 -4.45 -0.00 0.00 -0.52 0.00 0.00 37.83 32.74 2kvz s LYS 41 CO -0.03 -1.35 1.14 0.42 -0.92 0.00 0.00 175.35 174.61 2kvz s ILE 42 N 0.69 4.49 -1.22 2.17 1.01 -1.26 -2.92 121.20 124.17 2kvz s ILE 42 Ca 0.17 1.81 0.00 0.00 0.00 0.00 0.00 60.65 62.63 2kvz s ILE 42 Cb -0.13 -4.17 0.00 0.00 0.01 0.00 0.00 42.46 38.18 2kvz s ILE 42 CO -0.07 -0.16 0.00 0.29 0.00 0.00 0.00 174.94 175.00 2kvz n LYS 43 N 6.46 -1.38 -1.90 2.79 5.02 -1.26 -0.89 118.16 126.99 2kvz n LYS 43 Ca 0.13 0.88 -0.08 0.00 -2.02 0.00 0.00 58.31 57.22 2kvz n LYS 43 Cb 0.45 -5.13 -0.01 0.00 -0.02 0.00 0.00 35.03 30.33 2kvz n LYS 43 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2kvz n GLY 44 N -0.40 0.29 3.53 0.72 0.00 -1.15 -4.97 105.19 103.22 2kvz n GLY 44 Ca -0.11 -0.59 -0.46 0.00 0.00 0.00 0.00 46.02 44.85 2kvz n GLY 44 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2kvz n TYR 45 N -3.68 0.72 -3.17 1.61 4.02 -0.07 -4.91 117.16 111.69 2kvz n TYR 45 Ca -0.09 0.79 -0.41 0.00 -0.01 0.00 0.00 57.90 58.18 2kvz n TYR 45 Cb 0.49 -2.16 -0.07 0.00 -0.02 0.00 0.00 39.34 37.58 2kvz n TYR 45 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2kvz s THR 46 N -1.00 4.98 0.07 -0.72 2.01 -1.02 -4.79 115.64 115.17 2kvz s THR 46 Ca 0.61 0.79 -0.31 0.00 0.31 0.00 0.00 61.69 63.09 2kvz s THR 46 Cb -0.78 -3.95 -0.09 0.00 0.01 0.00 0.00 72.50 67.70 2kvz s THR 46 CO 0.58 -0.09 1.75 -0.22 -0.69 0.00 0.00 174.62 175.96 2kvz s LEU 47 N 2.50 4.38 0.02 4.42 2.96 -1.26 0.78 118.68 132.48 2kvz s LEU 47 Ca 0.23 2.57 -0.28 0.00 -0.22 0.00 0.00 54.13 56.43 2kvz s LEU 47 Cb -0.15 -3.56 -0.15 0.00 0.50 0.00 0.00 46.19 42.83 2kvz s LEU 47 CO 0.11 -0.95 1.15 0.25 -1.32 0.00 0.00 176.35 175.59 2kvz h LEU 48 N 9.07 -0.84 0.00 -0.68 5.85 -1.03 -3.45 115.31 124.23 2kvz h LEU 48 Ca -0.44 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.30 2kvz h LEU 48 Cb 1.21 0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.46 2kvz h LEU 48 CO 0.94 -0.47 0.00 1.17 -0.34 0.00 0.00 178.44 179.74 2kvz n LYS 49 N -5.43 0.00 -3.41 1.25 4.81 -1.25 -5.07 118.16 109.05 2kvz n LYS 49 Ca -0.12 0.00 -0.38 0.00 -0.87 0.00 0.00 58.31 56.94 2kvz n LYS 49 Cb 0.39 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.38 2kvz n LYS 49 CO 0.00 0.00 0.00 1.52 1.17 0.00 0.00 177.40 180.09 2kvz s TYR 50 N -2.00 3.67 -0.70 5.64 1.13 -1.26 -4.37 117.35 119.45 2kvz s TYR 50 Ca 0.00 1.00 0.25 0.00 -1.41 0.00 0.00 57.07 56.91 2kvz s TYR 50 Cb 0.00 -2.40 0.50 0.00 -1.10 0.00 0.00 41.96 38.96 2kvz s TYR 50 CO 0.00 0.48 1.46 -0.40 -2.51 0.00 0.00 175.55 174.58 2kvz n ASP 51 N 2.40 0.69 -4.10 -0.18 5.75 -1.26 -4.79 116.55 115.05 2kvz n ASP 51 Ca -0.11 0.22 -0.21 0.00 -0.01 0.00 0.00 54.79 54.67 2kvz n ASP 51 Cb 0.52 -0.08 -0.15 0.00 -1.03 0.00 0.00 41.12 40.38 2kvz n ASP 51 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2kvz s SER 52 N -4.16 1.53 0.25 -1.12 0.15 -1.26 -5.11 113.70 103.98 2kvz s SER 52 Ca 0.08 -0.29 -0.31 0.00 0.70 0.00 0.00 55.95 56.13 2kvz s SER 52 Cb 0.14 -0.15 -0.12 0.00 -1.71 0.00 0.00 66.02 64.18 2kvz s SER 52 CO 0.68 0.12 1.66 -0.62 1.20 0.00 0.00 173.24 176.28 2kvz n GLU 53 N 2.54 2.74 0.04 5.44 1.02 -1.26 -4.90 120.64 126.26 2kvz n GLU 53 Ca -0.15 0.98 0.11 0.00 -0.02 0.00 0.00 57.16 58.08 2kvz n GLU 53 Cb 0.55 -2.80 -0.05 0.00 -0.02 0.00 0.00 31.44 29.13 2kvz n GLU 53 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 2kvz n ILE 54 N 2.99 0.24 -2.24 -3.67 -5.35 -1.26 -4.78 119.36 105.29 2kvz n ILE 54 Ca 0.12 -0.40 -0.38 0.00 -0.27 0.00 0.00 62.75 61.81 2kvz n ILE 54 Cb 0.36 0.01 -0.03 0.00 -1.74 0.00 0.00 39.64 38.24 2kvz n ILE 54 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 2kvz s LEU 55 N -4.49 3.25 0.00 7.28 2.96 -1.26 -4.86 118.68 121.56 2kvz s LEU 55 Ca -0.01 -0.10 0.00 0.00 -0.22 0.00 0.00 54.13 53.80 2kvz s LEU 55 Cb 0.13 -2.54 0.00 0.00 0.50 0.00 0.00 46.19 44.27 2kvz s LEU 55 CO 0.83 -2.18 0.00 0.61 -1.32 0.00 0.00 176.35 174.29 2kvz n GLY 56 N 5.75 3.66 3.22 7.98 0.00 -1.26 -5.12 105.19 119.41 2kvz n GLY 56 Ca 0.17 -1.01 -0.19 0.00 0.00 0.00 0.00 46.02 44.99 2kvz n GLY 56 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2kvz s VAL 57 N -2.34 1.29 0.13 1.61 -7.23 -1.26 -3.85 120.40 108.75 2kvz s VAL 57 Ca 0.00 -1.53 -0.33 0.00 -1.81 0.00 0.00 61.98 58.31 2kvz s VAL 57 Cb 0.00 -1.35 -0.12 0.00 0.56 0.00 0.00 36.38 35.47 2kvz s VAL 57 CO 0.00 -0.29 1.72 0.49 -0.31 0.00 0.00 175.10 176.70 2kvz n PHE 58 N 0.90 2.48 -4.21 2.82 3.01 -0.90 -4.81 117.46 116.76 2kvz n PHE 58 Ca -0.18 0.07 -0.29 0.00 1.01 0.00 0.00 57.45 58.06 2kvz n PHE 58 Cb 0.55 -2.64 -0.03 0.00 -0.01 0.00 0.00 39.48 37.36 2kvz n PHE 58 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 2kvz s THR 59 N 1.84 1.43 -2.02 4.37 2.01 -1.26 -1.42 115.64 120.58 2kvz s THR 59 Ca 0.80 -1.67 0.09 0.00 0.31 0.00 0.00 61.69 61.22 2kvz s THR 59 Cb -0.59 -2.10 0.24 0.00 0.01 0.00 0.00 72.50 70.06 2kvz s THR 59 CO 0.38 0.00 1.31 -0.62 -0.69 0.00 0.00 174.62 175.00 2kvz n GLU 60 N -1.61 1.12 -5.15 4.92 1.02 -1.26 -3.56 120.64 116.12 2kvz n GLU 60 Ca -0.08 -0.19 -0.31 0.00 -0.02 0.00 0.00 57.16 56.56 2kvz n GLU 60 Cb 0.65 -1.15 -0.17 0.00 -0.02 0.00 0.00 31.44 30.75 2kvz n GLU 60 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2kvz s SER 61 N -1.24 2.92 -0.16 1.62 1.04 -1.26 -4.60 113.70 112.03 2kvz s SER 61 Ca 0.14 -0.52 -0.29 0.00 0.48 0.00 0.00 55.95 55.76 2kvz s SER 61 Cb 0.07 -1.25 -0.06 0.00 0.10 0.00 0.00 66.02 64.87 2kvz s SER 61 CO 0.11 0.16 2.16 -2.65 0.98 0.00 0.00 173.24 174.00 2kvz n PRO 62 N 3.47 2.17 -3.99 4.02 -0.02 -0.72 -4.68 135.00 135.24 2kvz n PRO 62 Ca -0.19 0.66 -0.35 0.00 -2.02 0.00 0.00 63.50 61.59 2kvz n PRO 62 Cb 0.53 -3.16 -0.06 0.00 -0.02 0.00 0.00 33.50 30.78 2kvz n PRO 62 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 2kvz s GLN 63 N 5.88 3.32 -0.07 -0.52 0.74 -0.92 -5.00 119.66 123.10 2kvz s GLN 63 Ca 0.98 -0.26 0.03 0.00 0.05 0.00 0.00 55.36 56.17 2kvz s GLN 63 Cb -0.38 -3.07 0.00 0.00 1.10 0.00 0.00 33.01 30.67 2kvz s GLN 63 CO 0.37 0.73 -0.17 -0.08 -0.55 0.00 0.00 175.29 175.59 2kvz s THR 64 N -1.09 1.50 -0.36 -0.34 -1.32 -1.26 -0.48 115.64 112.29 2kvz s THR 64 Ca 0.18 -0.71 -0.13 0.00 -1.21 0.00 0.00 61.69 59.82 2kvz s THR 64 Cb -0.12 -1.31 -0.01 0.00 -1.51 0.00 0.00 72.50 69.55 2kvz s THR 64 CO 0.08 0.43 0.26 -0.63 -2.21 0.00 0.00 174.62 172.56 2kvz s ILE 65 N 0.37 5.28 -0.83 5.08 1.01 0.12 -4.94 121.20 127.29 2kvz s ILE 65 Ca -0.12 -0.32 -0.22 0.00 0.00 0.00 0.00 60.65 59.98 2kvz s ILE 65 Cb -0.15 -3.77 0.08 0.00 0.01 0.00 0.00 42.46 38.63 2kvz s ILE 65 CO 0.05 -0.09 1.15 0.20 0.00 0.00 0.00 174.94 176.24 2kvz s ASN 66 N 1.71 6.38 -0.61 3.58 0.01 -1.26 -0.11 114.94 124.65 2kvz s ASN 66 Ca 0.06 -1.36 -0.18 0.00 -0.71 0.00 0.00 52.86 50.67 2kvz s ASN 66 Cb -0.18 -2.46 0.11 0.00 0.41 0.00 0.00 41.25 39.14 2kvz s ASN 66 CO 0.10 -1.38 0.70 -0.63 -1.51 0.00 0.00 177.10 174.38 2kvz s ILE 67 N 3.99 4.89 -0.36 0.60 1.01 0.39 -4.62 121.20 127.11 2kvz s ILE 67 Ca 0.32 -1.13 -0.19 0.00 0.00 0.00 0.00 60.65 59.64 2kvz s ILE 67 Cb -0.09 -4.48 0.00 0.00 0.01 0.00 0.00 42.46 37.90 2kvz s ILE 67 CO 0.01 -1.11 0.58 -0.63 0.00 0.00 0.00 174.94 173.79 2kvz s ILE 68 N 2.46 4.94 -0.20 2.92 1.01 -1.26 -0.32 121.20 130.74 2kvz s ILE 68 Ca 0.11 0.44 -0.10 0.00 0.00 0.00 0.00 60.65 61.10 2kvz s ILE 68 Cb -0.24 -4.04 -0.05 0.00 0.01 0.00 0.00 42.46 38.14 2kvz s ILE 68 CO 0.05 -0.30 0.14 -0.31 0.00 0.00 0.00 174.94 174.52 2kvz s TYR 69 N 2.58 3.40 0.03 3.97 2.02 0.16 -0.35 117.35 129.16 2kvz s TYR 69 Ca 0.22 0.33 -0.17 0.00 -0.37 0.00 0.00 57.07 57.07 2kvz s TYR 69 Cb -0.15 -2.18 -0.06 0.00 -0.40 0.00 0.00 41.96 39.17 2kvz s TYR 69 CO 0.14 0.26 0.50 -1.14 -1.57 0.00 0.00 175.55 173.74 2kvz s GLN 70 N 0.45 4.08 -0.33 -0.62 0.74 0.23 -3.15 119.66 121.06 2kvz s GLN 70 Ca 0.08 0.59 -0.28 0.00 0.05 0.00 0.00 55.36 55.80 2kvz s GLN 70 Cb -0.11 -3.24 -0.03 0.00 1.10 0.00 0.00 33.01 30.73 2kvz s GLN 70 CO -0.01 0.64 1.90 0.21 -0.55 0.00 0.00 175.29 177.48 2kvz s LYS 71 N -1.03 3.21 0.30 1.67 2.20 -1.26 -2.42 119.74 122.40 2kvz s LYS 71 Ca 0.27 1.49 -0.29 0.00 -0.36 0.00 0.00 55.97 57.07 2kvz s LYS 71 Cb -0.18 -4.25 -0.10 0.00 -1.51 0.00 0.00 37.83 31.79 2kvz s LYS 71 CO 0.16 -2.01 1.26 -1.59 -0.36 0.00 0.00 175.35 172.82 2kvz s LYS 72 N 5.96 4.42 0.26 4.03 -2.85 -1.26 -4.98 119.74 125.32 2kvz s LYS 72 Ca 0.83 2.10 -0.21 0.00 -1.00 0.00 0.00 55.97 57.69 2kvz s LYS 72 Cb -0.24 -3.12 -0.09 0.00 -2.06 0.00 0.00 37.83 32.33 2kvz s LYS 72 CO 0.33 -0.11 0.79 0.00 0.10 0.00 0.00 175.35 176.46 2kvz s ALA 73 N -0.94 3.34 0.06 0.59 0.00 -1.26 -4.99 121.76 118.56 2kvz s ALA 73 Ca 0.49 0.26 -0.34 0.00 0.00 0.00 0.00 51.96 52.38 2kvz s ALA 73 Cb -0.38 -2.93 -0.13 0.00 0.00 0.00 0.00 23.12 19.69 2kvz s ALA 73 CO 0.48 0.28 1.71 -2.30 0.00 0.00 0.00 175.76 175.93 2kvz n PRO 74 N 0.56 2.22 -0.92 0.00 -0.02 -1.26 -4.96 135.00 130.62 2kvz n PRO 74 Ca -0.00 0.81 -0.29 0.00 -2.02 0.00 0.00 63.50 61.99 2kvz n PRO 74 Cb 0.51 -2.61 0.20 0.00 -0.02 0.00 0.00 33.50 31.58 2kvz n PRO 74 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2kvz s GLU 75 N 2.25 0.02 0.07 -0.52 2.02 -1.26 -4.83 118.70 116.44 2kvz s GLU 75 Ca 0.84 0.71 0.13 0.00 0.02 0.00 0.00 54.97 56.67 2kvz s GLU 75 Cb -0.67 -1.67 0.57 0.00 0.10 0.00 0.00 34.13 32.46 2kvz s GLU 75 CO 0.43 -3.06 1.41 1.04 0.02 0.00 0.00 175.26 175.10 2kvz n GLN 76 N -4.43 0.04 0.00 1.61 6.02 -1.26 -0.54 117.38 118.82 2kvz n GLN 76 Ca 0.05 0.37 0.13 0.00 -0.01 0.00 0.00 57.00 57.54 2kvz n GLN 76 Cb 0.56 -1.60 0.45 0.00 1.02 0.00 0.00 30.24 30.67 2kvz n GLN 76 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2kvz n ALA 77 N -1.57 2.99 -3.44 -1.58 0.00 -1.26 -4.77 120.51 110.88 2kvz n ALA 77 Ca 0.02 -0.27 -0.34 0.00 0.00 0.00 0.00 53.44 52.85 2kvz n ALA 77 Cb 0.13 -1.27 -0.15 0.00 0.00 0.00 0.00 19.45 18.17 2kvz n ALA 77 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2kvz s LEU 78 N -2.81 2.62 0.31 0.00 2.96 0.30 -5.12 118.68 116.95 2kvz s LEU 78 Ca 0.18 -0.43 0.08 0.00 -0.22 0.00 0.00 54.13 53.74 2kvz s LEU 78 Cb 0.19 -1.62 -0.03 0.00 0.50 0.00 0.00 46.19 45.23 2kvz s LEU 78 CO 0.58 0.07 0.23 -1.61 -1.32 0.00 0.00 176.35 174.30 2kvz s GLU 79 N 0.92 2.70 0.08 1.98 0.41 -1.26 -4.63 118.70 118.90 2kvz s GLU 79 Ca -0.03 -1.28 -0.14 0.00 -0.41 0.00 0.00 54.97 53.11 2kvz s GLU 79 Cb -0.15 -2.44 -0.20 0.00 -1.78 0.00 0.00 34.13 29.56 2kvz s GLU 79 CO -0.01 0.19 1.22 1.25 -0.49 0.00 0.00 175.26 177.42 2kvz h HIS 80 N 1.38 1.00 -3.99 1.61 -0.00 -1.99 -3.45 115.15 109.71 2kvz h HIS 80 Ca -0.45 -0.50 -0.37 0.00 -0.00 0.00 0.00 60.37 59.05 2kvz h HIS 80 Cb 1.25 -0.13 -0.24 0.00 -0.00 0.00 0.00 27.41 28.29 2kvz h HIS 80 CO 0.56 1.33 -0.77 -1.58 -0.00 0.00 0.00 177.93 177.47 2kvz s HIS 81 N -3.49 0.93 0.32 5.26 5.65 -1.26 -5.16 115.29 117.54 2kvz s HIS 81 Ca -0.11 -0.36 0.09 0.00 0.25 0.00 0.00 55.06 54.94 2kvz s HIS 81 Cb 0.07 -0.55 -0.05 0.00 -1.18 0.00 0.00 32.58 30.87 2kvz s HIS 81 CO 0.90 -0.01 0.05 -1.01 -0.65 0.00 0.00 174.74 174.02 2kvz s HIS 82 N -0.91 2.63 -0.41 3.88 0.09 0.14 -5.01 115.29 115.69 2kvz s HIS 82 Ca -0.02 -0.37 0.23 0.00 -0.00 0.00 0.00 55.06 54.90 2kvz s HIS 82 Cb -0.08 -1.47 0.28 0.00 -0.00 0.00 0.00 32.58 31.32 2kvz s HIS 82 CO 0.01 0.46 1.46 0.45 -0.00 0.00 0.00 174.74 177.13 2kvz h HIS 83 N 1.74 0.00 -0.00 1.40 3.86 -2.02 -3.17 115.15 116.95 2kvz h HIS 83 Ca -0.43 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.78 2kvz h HIS 83 Cb 1.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.72 2kvz h HIS 83 CO 0.67 0.00 -0.77 0.72 0.86 0.00 0.00 177.93 179.41 2kvz n HIS 84 N -2.91 0.00 -1.95 2.45 8.25 -1.26 -5.35 115.22 114.44 2kvz n HIS 84 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 2kvz n HIS 84 Cb 0.53 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.59 2kvz n HIS 84 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70