#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 -0.39 -0.29 7.83 1.47 -1.26 -5.13 116.67 118.89 2kvz s ASP 2 Ca 0.00 -0.02 -0.01 0.00 1.18 0.00 0.00 52.55 53.69 2kvz s ASP 2 Cb 0.00 0.43 0.10 0.00 -0.34 0.00 0.00 42.92 43.10 2kvz s ASP 2 CO 0.00 -0.70 0.09 -0.36 0.68 0.00 0.00 175.17 174.89 2kvz s PHE 3 N -3.24 1.45 0.00 2.11 0.08 -1.26 -5.09 117.98 112.03 2kvz s PHE 3 Ca 0.05 -1.53 0.00 0.00 0.12 0.00 0.00 56.93 55.57 2kvz s PHE 3 Cb -0.01 -1.53 0.00 0.00 -0.57 0.00 0.00 43.02 40.91 2kvz s PHE 3 CO -0.09 -0.84 0.00 0.41 -0.10 0.00 0.00 175.22 174.60 2kvz n GLY 4 N 4.92 -0.35 3.45 4.36 0.00 -1.26 -5.17 105.19 111.14 2kvz n GLY 4 Ca -0.03 -1.34 -0.22 0.00 0.00 0.00 0.00 46.02 44.43 2kvz n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kvz s LYS 5 N -1.94 1.62 -0.37 1.61 1.02 -1.26 -5.07 119.74 115.35 2kvz s LYS 5 Ca 0.00 -1.87 -0.38 0.00 0.02 0.00 0.00 55.97 53.74 2kvz s LYS 5 Cb 0.00 -0.99 -0.14 0.00 -0.52 0.00 0.00 37.83 36.19 2kvz s LYS 5 CO 0.00 -0.11 2.10 -2.30 -0.92 0.00 0.00 175.35 174.13 2kvz n PRO 6 N -0.66 0.87 -2.51 -1.68 -0.02 -1.26 -4.89 135.00 124.85 2kvz n PRO 6 Ca -0.04 0.26 -0.43 0.00 -2.02 0.00 0.00 63.50 61.27 2kvz n PRO 6 Cb 0.65 -2.20 -0.02 0.00 -0.02 0.00 0.00 33.50 31.91 2kvz n PRO 6 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2kvz s ASN 7 N 6.38 6.72 -0.21 2.55 3.84 -1.26 -5.00 114.94 127.97 2kvz s ASN 7 Ca 1.10 1.01 -0.02 0.00 0.21 0.00 0.00 52.86 55.16 2kvz s ASN 7 Cb -1.03 -2.54 -0.00 0.00 -0.55 0.00 0.00 41.25 37.13 2kvz s ASN 7 CO 0.55 -1.07 -0.09 -1.10 -2.79 0.00 0.00 177.10 172.60 2kvz s GLN 8 N 4.10 3.26 -0.55 0.43 -0.21 -1.25 -2.74 119.66 122.71 2kvz s GLN 8 Ca 0.52 -0.69 -0.19 0.00 0.02 0.00 0.00 55.36 55.03 2kvz s GLN 8 Cb -0.13 -2.87 0.09 0.00 1.00 0.00 0.00 33.01 31.09 2kvz s GLN 8 CO 0.23 -0.19 0.64 0.08 -2.12 0.00 0.00 175.29 173.93 2kvz s VAL 9 N 1.39 4.89 -0.49 1.09 1.01 -0.17 -1.87 120.40 126.26 2kvz s VAL 9 Ca 0.05 -0.86 -0.20 0.00 0.00 0.00 0.00 61.98 60.97 2kvz s VAL 9 Cb -0.14 -4.39 0.05 0.00 0.00 0.00 0.00 36.38 31.90 2kvz s VAL 9 CO -0.06 -0.96 0.67 -0.89 0.00 0.00 0.00 175.10 173.85 2kvz s THR 10 N 2.53 4.80 -0.52 3.92 2.01 0.13 -1.00 115.64 127.51 2kvz s THR 10 Ca 0.12 -0.22 -0.23 0.00 0.31 0.00 0.00 61.69 61.66 2kvz s THR 10 Cb -0.23 -4.30 0.04 0.00 0.01 0.00 0.00 72.50 68.02 2kvz s THR 10 CO 0.08 -0.78 0.85 -0.69 -0.69 0.00 0.00 174.62 173.39 2kvz s VAL 11 N 2.84 4.53 -0.07 3.82 1.01 0.26 0.27 120.40 133.06 2kvz s VAL 11 Ca 0.19 0.19 -0.13 0.00 0.00 0.00 0.00 61.98 62.23 2kvz s VAL 11 Cb -0.17 -4.45 -0.05 0.00 0.00 0.00 0.00 36.38 31.72 2kvz s VAL 11 CO 0.15 -0.96 0.34 0.20 0.00 0.00 0.00 175.10 174.82 2kvz s ASN 12 N 2.64 6.63 -0.43 3.32 0.01 0.71 -0.48 114.94 127.34 2kvz s ASN 12 Ca 0.28 0.75 -0.10 0.00 -0.71 0.00 0.00 52.86 53.08 2kvz s ASN 12 Cb -0.13 -2.21 0.08 0.00 0.41 0.00 0.00 41.25 39.40 2kvz s ASN 12 CO 0.19 0.26 0.29 -0.31 -1.51 0.00 0.00 177.10 176.02 2kvz s TYR 13 N -0.54 3.34 0.23 2.20 2.02 -1.26 -0.04 117.35 123.30 2kvz s TYR 13 Ca 0.21 -1.52 0.06 0.00 -0.37 0.00 0.00 57.07 55.45 2kvz s TYR 13 Cb -0.15 -3.08 -0.04 0.00 -0.40 0.00 0.00 41.96 38.30 2kvz s TYR 13 CO 0.09 -0.87 0.22 -0.51 -1.57 0.00 0.00 175.55 172.91 2kvz s LEU 14 N 1.44 3.92 -0.07 -1.29 1.43 0.11 -0.43 118.68 123.78 2kvz s LEU 14 Ca 0.04 -0.17 -0.03 0.00 -1.03 0.00 0.00 54.13 52.94 2kvz s LEU 14 Cb -0.24 -2.46 -0.01 0.00 0.03 0.00 0.00 46.19 43.51 2kvz s LEU 14 CO 0.02 -0.03 -0.07 -0.78 0.23 0.00 0.00 176.35 175.73 2kvz h ASP 15 N 1.59 0.00 0.00 2.29 1.82 -1.68 0.38 116.42 120.82 2kvz h ASP 15 Ca -0.49 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.15 2kvz h ASP 15 Cb 1.23 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.24 2kvz h ASP 15 CO 0.61 0.38 0.00 1.21 -1.61 0.00 0.00 179.24 179.83 2kvz n GLU 16 N -3.58 0.00 0.00 0.28 2.13 -1.26 -3.31 120.64 114.89 2kvz n GLU 16 Ca -0.03 0.00 0.03 0.00 0.66 0.00 0.00 57.16 57.82 2kvz n GLU 16 Cb 0.10 0.00 0.16 0.00 0.27 0.00 0.00 31.44 31.96 2kvz n GLU 16 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 2kvz n ASN 17 N -0.18 0.00 -0.44 4.31 0.23 -1.26 -4.79 115.26 113.13 2kvz n ASN 17 Ca 0.00 -0.91 -0.06 0.00 -0.53 0.00 0.00 54.58 53.08 2kvz n ASN 17 Cb 0.00 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 37.68 2kvz n ASN 17 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 2kvz n ASN 18 N -0.65 -4.71 -4.70 0.53 5.15 -1.26 -4.98 115.26 104.63 2kvz n ASN 18 Ca 0.04 0.14 -0.36 0.00 -0.60 0.00 0.00 54.58 53.80 2kvz n ASN 18 Cb 0.02 -2.72 -0.08 0.00 -0.53 0.00 0.00 39.78 36.47 2kvz n ASN 18 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2kvz s THR 19 N -1.87 5.32 -0.39 -0.44 2.01 -1.26 -4.99 115.64 114.02 2kvz s THR 19 Ca 0.00 0.43 -0.28 0.00 0.31 0.00 0.00 61.69 62.15 2kvz s THR 19 Cb 0.00 -3.59 -0.01 0.00 0.01 0.00 0.00 72.50 68.91 2kvz s THR 19 CO 0.00 0.36 1.66 -0.44 -0.69 0.00 0.00 174.62 175.51 2kvz s SER 20 N 0.69 6.01 0.11 3.53 0.01 -1.26 -3.20 113.70 119.59 2kvz s SER 20 Ca 0.13 1.03 0.25 0.00 1.31 0.00 0.00 55.95 58.67 2kvz s SER 20 Cb -0.13 -2.53 0.57 0.00 0.21 0.00 0.00 66.02 64.14 2kvz s SER 20 CO 0.04 -1.66 1.50 2.30 0.41 0.00 0.00 173.24 175.83 2kvz n ILE 21 N 7.27 0.32 -4.12 1.44 -5.35 0.42 -4.86 119.36 114.48 2kvz n ILE 21 Ca 0.20 -0.20 -0.12 0.00 -0.27 0.00 0.00 62.75 62.35 2kvz n ILE 21 Cb 0.48 -0.21 -0.11 0.00 -1.74 0.00 0.00 39.64 38.06 2kvz n ILE 21 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2kvz s ALA 22 N -3.11 0.80 0.37 -1.28 0.00 -1.20 -5.09 121.76 112.25 2kvz s ALA 22 Ca 0.09 -1.04 -0.28 0.00 0.00 0.00 0.00 51.96 50.73 2kvz s ALA 22 Cb 0.14 0.08 -0.11 0.00 0.00 0.00 0.00 23.12 23.23 2kvz s ALA 22 CO 0.67 -0.10 1.38 -0.35 0.00 0.00 0.00 175.76 177.36 2kvz n PRO 23 N 0.79 2.36 -1.77 0.00 -0.04 -1.26 -4.25 135.00 130.82 2kvz n PRO 23 Ca -0.18 0.83 -0.42 0.00 -0.04 0.00 0.00 63.50 63.69 2kvz n PRO 23 Cb 0.57 -2.49 -0.03 0.00 -0.04 0.00 0.00 33.50 31.51 2kvz n PRO 23 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2kvz s SER 24 N -0.25 6.48 -0.46 3.54 0.01 -1.26 -4.71 113.70 117.04 2kvz s SER 24 Ca 0.55 2.67 -0.16 0.00 1.31 0.00 0.00 55.95 60.32 2kvz s SER 24 Cb -0.52 -2.56 0.06 0.00 0.21 0.00 0.00 66.02 63.21 2kvz s SER 24 CO 0.63 -0.98 0.40 -0.22 0.41 0.00 0.00 173.24 173.48 2kvz s LEU 25 N 2.91 5.45 -0.16 2.44 2.96 0.37 -4.90 118.68 127.75 2kvz s LEU 25 Ca 0.80 -1.19 0.00 0.00 -0.22 0.00 0.00 54.13 53.52 2kvz s LEU 25 Cb -0.44 -2.21 -0.00 0.00 0.50 0.00 0.00 46.19 44.04 2kvz s LEU 25 CO 0.36 -0.64 -0.15 -0.72 -1.32 0.00 0.00 176.35 173.88 2kvz s TYR 26 N 1.77 2.79 0.36 5.38 1.13 -1.26 0.91 117.35 128.43 2kvz s TYR 26 Ca 0.06 -1.05 -0.01 0.00 -1.41 0.00 0.00 57.07 54.66 2kvz s TYR 26 Cb -0.23 -1.90 -0.04 0.00 -1.10 0.00 0.00 41.96 38.70 2kvz s TYR 26 CO 0.08 -0.48 0.58 -0.51 -2.51 0.00 0.00 175.55 172.71 2kvz s LEU 27 N 0.85 3.97 -0.08 -3.49 1.43 -0.17 -4.85 118.68 116.34 2kvz s LEU 27 Ca -0.05 0.54 -0.01 0.00 -1.03 0.00 0.00 54.13 53.58 2kvz s LEU 27 Cb -0.15 -3.41 0.03 0.00 0.03 0.00 0.00 46.19 42.69 2kvz s LEU 27 CO -0.01 -0.32 0.00 -0.44 0.23 0.00 0.00 176.35 175.82 2kvz s SER 28 N -3.94 1.65 0.02 2.29 0.01 -1.25 -1.00 113.70 111.48 2kvz s SER 28 Ca 0.41 -0.12 0.00 0.00 1.31 0.00 0.00 55.95 57.55 2kvz s SER 28 Cb -0.10 -0.44 -0.00 0.00 0.21 0.00 0.00 66.02 65.69 2kvz s SER 28 CO 0.37 -0.20 0.02 0.61 0.41 0.00 0.00 173.24 174.45 2kvz n GLY 29 N 5.15 3.76 3.98 3.44 0.00 -1.11 -4.98 105.19 115.43 2kvz n GLY 29 Ca -0.07 -1.62 -0.20 0.00 0.00 0.00 0.00 46.02 44.13 2kvz n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2kvz s LEU 30 N 0.00 3.49 0.21 0.99 1.43 -1.26 -4.20 118.68 119.34 2kvz s LEU 30 Ca 0.03 -0.05 -0.31 0.00 -1.03 0.00 0.00 54.13 52.77 2kvz s LEU 30 Cb 0.00 -2.87 -0.10 0.00 0.03 0.00 0.00 46.19 43.25 2kvz s LEU 30 CO 0.02 -0.92 1.49 0.12 0.23 0.00 0.00 176.35 177.29 2kvz s PHE 31 N -2.59 3.04 -1.12 0.29 5.36 -1.26 -2.30 117.98 119.41 2kvz s PHE 31 Ca 0.54 0.87 0.00 0.00 -0.96 0.00 0.00 56.93 57.38 2kvz s PHE 31 Cb -0.10 -3.86 0.00 0.00 -0.34 0.00 0.00 43.02 38.72 2kvz s PHE 31 CO 0.37 -2.95 0.00 -1.71 -1.46 0.00 0.00 175.22 169.47 2kvz n ASN 32 N 3.03 -4.69 -4.82 6.13 5.15 0.09 -4.91 115.26 115.24 2kvz n ASN 32 Ca 0.10 0.26 -0.38 0.00 -0.60 0.00 0.00 54.58 53.96 2kvz n ASN 32 Cb 0.40 -3.11 -0.06 0.00 -0.53 0.00 0.00 39.78 36.47 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 -2.74 4.17 0.06 1.20 2.12 -0.97 -4.70 118.70 117.83 2kvz s GLU 33 Ca 0.00 0.71 -0.30 0.00 0.36 0.00 0.00 54.97 55.73 2kvz s GLU 33 Cb 0.00 -3.17 -0.05 0.00 0.26 0.00 0.00 34.13 31.18 2kvz s GLU 33 CO 0.00 0.60 1.07 0.00 -0.54 0.00 0.00 175.26 176.39 2kvz s ALA 34 N -1.19 3.28 0.14 6.30 0.00 -1.26 -0.14 121.76 128.89 2kvz s ALA 34 Ca 0.31 0.69 0.07 0.00 0.00 0.00 0.00 51.96 53.03 2kvz s ALA 34 Cb -0.19 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.52 2kvz s ALA 34 CO 0.19 -0.28 -0.15 1.52 0.00 0.00 0.00 175.76 177.04 2kvz s TYR 35 N 0.77 1.53 0.14 0.00 1.13 0.25 -4.93 117.35 116.23 2kvz s TYR 35 Ca 0.54 -0.55 0.07 0.00 -1.41 0.00 0.00 57.07 55.71 2kvz s TYR 35 Cb -0.25 -0.78 -0.04 0.00 -1.10 0.00 0.00 41.96 39.79 2kvz s TYR 35 CO 0.29 0.21 -0.15 1.21 -2.51 0.00 0.00 175.55 174.60 2kvz s ASN 36 N -2.64 2.20 -0.31 -0.18 2.47 -1.26 -2.23 114.94 112.99 2kvz s ASN 36 Ca 0.12 -0.86 -0.08 0.00 0.42 0.00 0.00 52.86 52.46 2kvz s ASN 36 Cb -0.04 -0.09 0.01 0.00 -1.45 0.00 0.00 41.25 39.68 2kvz s ASN 36 CO 0.04 -0.14 0.11 -0.69 -3.72 0.00 0.00 177.10 172.70 2kvz s VAL 37 N -2.31 4.17 -0.34 -5.21 1.01 -1.26 -4.93 120.40 111.52 2kvz s VAL 37 Ca 0.13 -0.66 -0.28 0.00 0.00 0.00 0.00 61.98 61.17 2kvz s VAL 37 Cb -0.04 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 2kvz s VAL 37 CO 0.04 0.03 2.07 -2.84 0.00 0.00 0.00 175.10 174.41 2kvz s PRO 38 N 1.53 2.98 -0.47 2.72 0.02 -1.26 -4.94 135.00 135.58 2kvz s PRO 38 Ca 0.03 1.58 -0.28 0.00 0.02 0.00 0.00 61.00 62.36 2kvz s PRO 38 Cb -0.17 -4.35 0.03 0.00 0.02 0.00 0.00 34.50 30.02 2kvz s PRO 38 CO 0.04 -2.28 1.06 1.41 -0.33 0.00 0.00 177.00 176.90 2kvz s MET 39 N 6.50 3.66 -0.09 5.54 1.75 -1.26 -5.02 119.30 130.38 2kvz s MET 39 Ca 0.90 0.42 -0.12 0.00 -1.25 0.00 0.00 55.69 55.64 2kvz s MET 39 Cb -0.25 -3.91 -0.05 0.00 2.84 0.00 0.00 34.83 33.46 2kvz s MET 39 CO 0.32 -1.32 0.29 0.15 -0.65 0.00 0.00 175.02 173.80 2kvz s LYS 40 N 4.18 3.86 -0.45 4.11 1.02 -1.26 -5.06 119.74 126.15 2kvz s LYS 40 Ca 0.44 0.14 -0.14 0.00 0.02 0.00 0.00 55.97 56.43 2kvz s LYS 40 Cb -0.08 -3.27 0.07 0.00 -0.52 0.00 0.00 37.83 34.03 2kvz s LYS 40 CO 0.30 0.59 0.36 0.21 -0.92 0.00 0.00 175.35 175.88 2kvz s LYS 41 N -0.60 2.90 0.56 1.68 2.20 -1.26 -5.03 119.74 120.19 2kvz s LYS 41 Ca 0.19 -1.35 -0.18 0.00 -0.36 0.00 0.00 55.97 54.27 2kvz s LYS 41 Cb -0.14 -4.04 -0.05 0.00 -1.51 0.00 0.00 37.83 32.09 2kvz s LYS 41 CO 0.07 -0.99 1.09 0.42 -0.36 0.00 0.00 175.35 175.59 2kvz s ILE 42 N 1.60 3.44 -0.70 5.43 1.01 -1.26 -4.85 121.20 125.86 2kvz s ILE 42 Ca 0.04 0.81 -0.27 0.00 0.00 0.00 0.00 60.65 61.23 2kvz s ILE 42 Cb -0.24 -3.30 -0.14 0.00 0.01 0.00 0.00 42.46 38.79 2kvz s ILE 42 CO 0.06 -0.28 2.49 1.17 0.00 0.00 0.00 174.94 178.38 2kvz n LYS 43 N -1.60 0.62 -2.23 2.79 4.81 -1.26 -1.75 118.16 119.54 2kvz n LYS 43 Ca 0.10 -0.09 -0.02 0.00 -0.87 0.00 0.00 58.31 57.44 2kvz n LYS 43 Cb 0.52 -2.75 0.01 0.00 0.02 0.00 0.00 35.03 32.83 2kvz n LYS 43 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2kvz n GLY 44 N 6.21 0.40 3.15 3.14 0.00 -1.26 -4.94 105.19 111.89 2kvz n GLY 44 Ca 0.48 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.97 2kvz n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2kvz s TYR 45 N -3.04 0.85 -0.02 1.61 1.51 -0.72 0.30 117.35 117.84 2kvz s TYR 45 Ca 0.01 -0.86 -0.01 0.00 -1.01 0.00 0.00 57.07 55.20 2kvz s TYR 45 Cb -0.00 -0.49 0.01 0.00 -0.11 0.00 0.00 41.96 41.36 2kvz s TYR 45 CO 0.09 -0.15 0.05 0.99 -1.11 0.00 0.00 175.55 175.42 2kvz s THR 46 N -3.30 -0.02 0.38 -0.71 2.01 0.12 -4.67 115.64 109.44 2kvz s THR 46 Ca 0.08 0.06 0.08 0.00 0.31 0.00 0.00 61.69 62.23 2kvz s THR 46 Cb 0.03 -0.08 0.31 0.00 0.01 0.00 0.00 72.50 72.76 2kvz s THR 46 CO -0.04 0.03 1.95 0.25 -0.69 0.00 0.00 174.62 176.11 2kvz h LEU 47 N 6.45 0.59 0.00 4.42 5.85 -1.87 0.35 115.31 131.11 2kvz h LEU 47 Ca -0.31 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.42 2kvz h LEU 47 Cb 1.18 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.10 2kvz h LEU 47 CO 0.48 0.37 0.00 -0.11 -0.34 0.00 0.00 178.44 178.83 2kvz n LEU 48 N -4.49 0.00 -3.74 2.25 7.94 -1.26 -4.38 117.00 113.32 2kvz n LEU 48 Ca 0.11 0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 54.92 2kvz n LEU 48 Cb 0.30 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.20 2kvz n LEU 48 CO 0.33 0.00 0.12 -1.59 -1.11 0.00 0.00 177.39 175.14 2kvz s LYS 49 N 0.00 1.11 -0.46 1.96 -2.85 -1.26 -5.11 119.74 113.13 2kvz s LYS 49 Ca 0.00 -0.84 -0.08 0.00 -1.00 0.00 0.00 55.97 54.05 2kvz s LYS 49 Cb 0.00 0.45 0.12 0.00 -2.06 0.00 0.00 37.83 36.33 2kvz s LYS 49 CO 0.00 -0.43 0.31 0.71 0.10 0.00 0.00 175.35 176.04 2kvz s TYR 50 N -3.85 3.46 -0.71 1.78 2.02 -1.26 -4.63 117.35 114.15 2kvz s TYR 50 Ca 0.07 -1.98 0.26 0.00 -0.37 0.00 0.00 57.07 55.05 2kvz s TYR 50 Cb 0.02 -3.42 0.78 0.00 -0.40 0.00 0.00 41.96 38.94 2kvz s TYR 50 CO -0.08 -0.99 1.77 0.22 -1.57 0.00 0.00 175.55 174.90 2kvz h ASP 51 N 8.37 0.00 -4.12 2.29 3.58 -1.97 -3.44 116.42 121.13 2kvz h ASP 51 Ca -0.19 0.00 -0.43 0.00 0.42 0.00 0.00 57.03 56.83 2kvz h ASP 51 Cb 1.07 0.00 -0.28 0.00 1.72 0.00 0.00 39.33 41.83 2kvz h ASP 51 CO 0.82 0.00 -0.79 -0.94 -2.88 0.00 0.00 179.24 175.45 2kvz s SER 52 N -4.63 1.30 -0.00 2.28 1.04 -1.26 -5.06 113.70 107.37 2kvz s SER 52 Ca 0.10 -0.22 -0.30 0.00 0.48 0.00 0.00 55.95 56.01 2kvz s SER 52 Cb 0.12 -0.14 -0.03 0.00 0.10 0.00 0.00 66.02 66.07 2kvz s SER 52 CO 0.60 0.12 1.02 -1.61 0.98 0.00 0.00 173.24 174.35 2kvz s GLU 53 N -0.33 4.52 0.40 4.02 2.02 -1.26 -5.03 118.70 123.03 2kvz s GLU 53 Ca 0.04 1.47 0.08 0.00 0.02 0.00 0.00 54.97 56.57 2kvz s GLU 53 Cb -0.05 -3.46 -0.02 0.00 0.10 0.00 0.00 34.13 30.71 2kvz s GLU 53 CO -0.00 -0.12 0.38 0.96 0.02 0.00 0.00 175.26 176.50 2kvz s ILE 54 N 1.16 2.91 -0.04 -1.63 -4.36 -1.26 -4.96 121.20 113.02 2kvz s ILE 54 Ca 0.53 -1.31 -0.03 0.00 -0.26 0.00 0.00 60.65 59.58 2kvz s ILE 54 Cb -0.22 -3.05 0.01 0.00 1.25 0.00 0.00 42.46 40.46 2kvz s ILE 54 CO 0.27 -0.04 0.07 -0.11 0.24 0.00 0.00 174.94 175.36 2kvz n LEU 55 N -1.54 -5.37 0.00 0.37 7.94 -1.26 -5.01 117.00 112.12 2kvz n LEU 55 Ca 0.03 2.02 0.00 0.00 -1.11 0.00 0.00 56.01 56.94 2kvz n LEU 55 Cb 0.61 -2.71 0.00 0.00 0.53 0.00 0.00 43.42 41.85 2kvz n LEU 55 CO 0.42 -2.50 0.00 0.61 -1.11 0.00 0.00 177.39 174.81 2kvz n GLY 56 N 1.35 1.44 3.29 -3.96 0.00 -0.95 -5.02 105.19 101.35 2kvz n GLY 56 Ca -0.11 0.02 -0.26 0.00 0.00 0.00 0.00 46.02 45.68 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 0.69 1.81 -0.31 1.61 -7.23 -1.26 -0.58 120.40 115.13 2kvz s VAL 57 Ca 0.00 -1.46 -0.27 0.00 -1.81 0.00 0.00 61.98 58.44 2kvz s VAL 57 Cb 0.00 -1.61 -0.05 0.00 0.56 0.00 0.00 36.38 35.28 2kvz s VAL 57 CO 0.00 0.08 2.22 -0.36 -0.31 0.00 0.00 175.10 176.73 2kvz s PHE 58 N -1.00 1.21 0.57 2.82 0.08 0.81 -4.81 117.98 117.65 2kvz s PHE 58 Ca 0.08 0.83 -0.15 0.00 0.12 0.00 0.00 56.93 57.82 2kvz s PHE 58 Cb -0.10 -3.86 -0.05 0.00 -0.57 0.00 0.00 43.02 38.44 2kvz s PHE 58 CO 0.04 -3.52 1.02 0.99 -0.10 0.00 0.00 175.22 173.65 2kvz s THR 59 N 9.27 4.29 0.55 0.64 2.01 -1.26 -0.73 115.64 130.40 2kvz s THR 59 Ca 0.97 1.01 0.24 0.00 0.31 0.00 0.00 61.69 64.22 2kvz s THR 59 Cb -0.27 -3.61 0.31 0.00 0.01 0.00 0.00 72.50 68.95 2kvz s THR 59 CO 0.32 -0.71 2.20 -0.33 -0.69 0.00 0.00 174.62 175.41 2kvz h GLU 60 N 0.46 0.00 -5.76 4.92 5.08 -1.97 -3.40 114.58 113.91 2kvz h GLU 60 Ca -0.46 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.30 2kvz h GLU 60 Cb 1.20 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.36 2kvz h GLU 60 CO 0.60 0.01 0.41 -1.54 -1.00 0.00 0.00 179.01 177.49 2kvz s SER 61 N -6.54 6.80 -0.09 1.42 1.04 -1.26 -5.00 113.70 110.08 2kvz s SER 61 Ca -0.05 1.00 -0.37 0.00 0.48 0.00 0.00 55.95 57.01 2kvz s SER 61 Cb 0.16 -2.42 -0.14 0.00 0.10 0.00 0.00 66.02 63.71 2kvz s SER 61 CO 0.60 -0.48 1.70 -2.65 0.98 0.00 0.00 173.24 173.39 2kvz n PRO 62 N 5.86 1.65 -3.21 4.02 -0.02 -1.26 -4.92 135.00 137.11 2kvz n PRO 62 Ca 0.04 0.60 -0.39 0.00 -2.02 0.00 0.00 63.50 61.73 2kvz n PRO 62 Cb 0.48 -2.34 -0.06 0.00 -0.02 0.00 0.00 33.50 31.55 2kvz n PRO 62 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2kvz s GLN 63 N 2.80 4.20 -0.62 -0.52 -0.21 -0.78 -4.99 119.66 119.53 2kvz s GLN 63 Ca 0.91 0.47 -0.13 0.00 0.02 0.00 0.00 55.36 56.63 2kvz s GLN 63 Cb -0.86 -3.56 0.16 0.00 1.00 0.00 0.00 33.01 29.74 2kvz s GLN 63 CO 0.54 -0.17 0.54 0.99 -2.12 0.00 0.00 175.29 175.07 2kvz s THR 64 N 1.69 4.99 -0.37 -0.19 2.01 -1.26 0.20 115.64 122.70 2kvz s THR 64 Ca 0.25 -1.99 -0.17 0.00 0.31 0.00 0.00 61.69 60.09 2kvz s THR 64 Cb -0.16 -4.18 0.00 0.00 0.01 0.00 0.00 72.50 68.18 2kvz s THR 64 CO 0.10 -0.90 0.48 -0.63 -0.69 0.00 0.00 174.62 172.97 2kvz s ILE 65 N 0.96 5.05 -0.51 1.82 1.01 0.14 -4.97 121.20 124.70 2kvz s ILE 65 Ca 0.09 0.12 -0.21 0.00 0.00 0.00 0.00 60.65 60.65 2kvz s ILE 65 Cb -0.22 -3.97 0.05 0.00 0.01 0.00 0.00 42.46 38.33 2kvz s ILE 65 CO -0.02 -0.26 0.73 0.20 0.00 0.00 0.00 174.94 175.59 2kvz s ASN 66 N 1.79 6.28 -0.05 3.58 0.01 -1.26 -0.21 114.94 125.08 2kvz s ASN 66 Ca 0.16 -0.64 -0.10 0.00 -0.71 0.00 0.00 52.86 51.57 2kvz s ASN 66 Cb -0.16 -2.34 -0.05 0.00 0.41 0.00 0.00 41.25 39.11 2kvz s ASN 66 CO 0.13 -0.98 0.28 -0.63 -1.51 0.00 0.00 177.10 174.39 2kvz s ILE 67 N 3.09 5.26 -0.09 0.60 -1.09 0.94 -4.53 121.20 125.39 2kvz s ILE 67 Ca 0.21 0.50 0.04 0.00 -2.23 0.00 0.00 60.65 59.17 2kvz s ILE 67 Cb -0.16 -3.56 -0.01 0.00 -1.58 0.00 0.00 42.46 37.15 2kvz s ILE 67 CO 0.15 0.57 -0.23 -0.63 -1.23 0.00 0.00 174.94 173.58 2kvz s ILE 68 N -1.09 2.20 -0.14 2.92 1.01 -1.26 0.09 121.20 124.93 2kvz s ILE 68 Ca 0.20 -0.99 -0.02 0.00 0.00 0.00 0.00 60.65 59.85 2kvz s ILE 68 Cb -0.14 -1.83 0.04 0.00 0.01 0.00 0.00 42.46 40.53 2kvz s ILE 68 CO 0.10 0.56 -0.01 -0.31 0.00 0.00 0.00 174.94 175.28 2kvz s TYR 69 N 0.13 1.11 0.24 3.97 2.02 0.13 -4.16 117.35 120.79 2kvz s TYR 69 Ca -0.12 -0.68 -0.04 0.00 -0.37 0.00 0.00 57.07 55.86 2kvz s TYR 69 Cb -0.16 -1.04 -0.05 0.00 -0.40 0.00 0.00 41.96 40.31 2kvz s TYR 69 CO 0.06 -0.51 0.48 -0.65 -1.57 0.00 0.00 175.55 173.37 2kvz s GLN 70 N 1.83 3.62 -0.16 -0.62 -0.21 0.12 -4.01 119.66 120.24 2kvz s GLN 70 Ca 0.02 -0.07 -0.29 0.00 0.02 0.00 0.00 55.36 55.04 2kvz s GLN 70 Cb -0.15 -2.73 -0.05 0.00 1.00 0.00 0.00 33.01 31.09 2kvz s GLN 70 CO -0.07 0.31 1.96 0.15 -2.12 0.00 0.00 175.29 175.52 2kvz s LYS 71 N -3.28 3.60 0.38 2.91 1.02 -1.26 0.11 119.74 123.22 2kvz s LYS 71 Ca 0.42 2.05 0.18 0.00 0.02 0.00 0.00 55.97 58.64 2kvz s LYS 71 Cb -0.11 -4.21 0.73 0.00 -0.52 0.00 0.00 37.83 33.71 2kvz s LYS 71 CO 0.28 -1.56 1.77 -0.22 -0.92 0.00 0.00 175.35 174.70 2kvz h LYS 72 N 12.52 0.00 -3.53 1.68 3.64 -0.42 -3.39 116.57 127.06 2kvz h LYS 72 Ca -0.41 0.00 -0.62 0.00 -1.27 0.00 0.00 60.65 58.36 2kvz h LYS 72 Cb 1.21 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 32.63 2kvz h LYS 72 CO 0.97 0.38 -0.73 0.00 -2.27 0.00 0.00 179.45 177.80 2kvz s ALA 73 N -3.76 2.26 0.12 5.00 0.00 -1.25 -4.99 121.76 119.15 2kvz s ALA 73 Ca -0.01 -2.40 -0.11 0.00 0.00 0.00 0.00 51.96 49.44 2kvz s ALA 73 Cb 0.12 -1.86 -0.06 0.00 0.00 0.00 0.00 23.12 21.32 2kvz s ALA 73 CO 0.69 -1.87 0.47 -1.25 0.00 0.00 0.00 175.76 173.81 2kvz s PRO 74 N 0.76 3.85 0.89 0.00 0.04 -1.26 -5.09 135.00 134.19 2kvz s PRO 74 Ca 0.14 0.30 -0.11 0.00 0.04 0.00 0.00 61.00 61.37 2kvz s PRO 74 Cb -0.21 -2.93 0.13 0.00 0.04 0.00 0.00 34.50 31.52 2kvz s PRO 74 CO -0.09 0.50 1.09 -1.21 0.04 0.00 0.00 177.00 177.33 2kvz s GLU 75 N -2.05 1.25 0.01 4.56 2.02 -1.26 -4.93 118.70 118.31 2kvz s GLU 75 Ca 0.37 1.01 0.28 0.00 0.02 0.00 0.00 54.97 56.64 2kvz s GLU 75 Cb -0.14 -1.79 1.08 0.00 0.10 0.00 0.00 34.13 33.38 2kvz s GLU 75 CO 0.19 -2.30 1.83 1.04 0.02 0.00 0.00 175.26 176.04 2kvz n GLN 76 N -3.95 0.02 -0.13 1.61 6.02 -1.26 -3.12 117.38 116.58 2kvz n GLN 76 Ca 0.08 0.01 0.02 0.00 -0.01 0.00 0.00 57.00 57.10 2kvz n GLN 76 Cb 0.54 -1.52 0.08 0.00 1.02 0.00 0.00 30.24 30.36 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 -1.52 2.61 -3.78 -1.58 0.00 -1.26 -4.83 120.51 110.15 2kvz n ALA 77 Ca 0.07 -0.34 -0.07 0.00 0.00 0.00 0.00 53.44 53.10 2kvz n ALA 77 Cb 0.35 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.77 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 -0.83 -0.30 0.11 0.00 2.96 -1.18 -5.19 118.68 114.26 2kvz s LEU 78 Ca 0.11 -0.49 0.04 0.00 -0.22 0.00 0.00 54.13 53.58 2kvz s LEU 78 Cb 0.07 2.63 -0.04 0.00 0.50 0.00 0.00 46.19 49.35 2kvz s LEU 78 CO 0.06 -1.23 -0.11 -1.61 -1.32 0.00 0.00 176.35 172.14 2kvz s GLU 79 N -3.80 0.93 0.40 1.98 2.02 -1.26 -4.72 118.70 114.24 2kvz s GLU 79 Ca 0.10 -1.23 0.21 0.00 0.02 0.00 0.00 54.97 54.07 2kvz s GLU 79 Cb -0.05 -0.64 0.28 0.00 0.10 0.00 0.00 34.13 33.82 2kvz s GLU 79 CO 0.03 0.10 1.57 1.25 0.02 0.00 0.00 175.26 178.23 2kvz h HIS 80 N 3.42 0.00 -0.99 1.61 -0.00 -1.99 -3.26 115.15 113.94 2kvz h HIS 80 Ca -0.38 0.00 0.07 0.00 -0.00 0.00 0.00 60.37 60.07 2kvz h HIS 80 Cb 1.19 0.00 -0.07 0.00 -0.00 0.00 0.00 27.41 28.53 2kvz h HIS 80 CO 0.64 0.14 0.64 1.25 -0.00 0.00 0.00 177.93 180.59 2kvz h HIS 81 N 0.00 1.16 -3.28 5.26 6.17 -2.03 -3.37 115.15 119.06 2kvz h HIS 81 Ca -0.00 0.03 -0.51 0.00 0.71 0.00 0.00 60.37 60.60 2kvz h HIS 81 Cb 1.10 -0.38 -0.40 0.00 2.52 0.00 0.00 27.41 30.25 2kvz h HIS 81 CO 0.00 0.59 -0.76 -1.58 0.71 0.00 0.00 177.93 176.88 2kvz s HIS 82 N -6.00 1.03 0.00 5.26 5.04 -1.23 -5.14 115.29 114.26 2kvz s HIS 82 Ca -0.12 -0.83 0.00 0.00 -1.54 0.00 0.00 55.06 52.57 2kvz s HIS 82 Cb 0.20 -1.02 0.00 0.00 0.04 0.00 0.00 32.58 31.80 2kvz s HIS 82 CO 0.81 -0.59 0.00 0.72 -2.34 0.00 0.00 174.74 173.34 2kvz n HIS 83 N 5.05 -3.37 0.79 3.88 -0.00 -1.26 -4.35 115.22 115.95 2kvz n HIS 83 Ca -0.09 0.00 0.10 0.00 -0.00 0.00 0.00 57.72 57.73 2kvz n HIS 83 Cb 0.47 0.00 0.46 0.00 -0.00 0.00 0.00 29.99 30.92 2kvz n HIS 83 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2kvz n HIS 84 N -1.70 0.00 -0.63 4.41 8.25 -1.26 -5.07 115.22 119.22 2kvz n HIS 84 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2kvz n HIS 84 Cb 0.00 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 30.69 2kvz n HIS 84 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70