#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 6.68 0.03 7.83 2.15 -1.26 -4.98 116.67 127.12 2kvz s ASP 2 Ca 0.00 0.85 0.27 0.00 0.43 0.00 0.00 52.55 54.10 2kvz s ASP 2 Cb 0.00 -2.20 0.82 0.00 -0.30 0.00 0.00 42.92 41.24 2kvz s ASP 2 CO 0.00 0.15 1.65 0.49 -0.17 0.00 0.00 175.17 177.29 2kvz n PHE 3 N 0.87 0.12 -4.30 -5.34 3.72 -1.26 -5.03 117.46 106.24 2kvz n PHE 3 Ca -0.07 0.04 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 2kvz n PHE 3 Cb 0.52 -0.45 0.00 0.00 -0.94 0.00 0.00 39.48 38.62 2kvz n PHE 3 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2kvz n GLY 4 N 1.47 -1.64 3.00 1.37 0.00 -1.26 -4.76 105.19 103.37 2kvz n GLY 4 Ca 0.06 -1.28 -0.31 0.00 0.00 0.00 0.00 46.02 44.49 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 0.00 1.80 0.17 1.61 1.02 -1.26 -4.99 119.74 118.09 2kvz s LYS 5 Ca 0.00 -1.31 -0.09 0.00 0.02 0.00 0.00 55.97 54.59 2kvz s LYS 5 Cb 0.00 -2.80 0.05 0.00 -0.52 0.00 0.00 37.83 34.56 2kvz s LYS 5 CO 0.00 -0.67 1.58 -1.35 -0.92 0.00 0.00 175.35 173.99 2kvz h PRO 6 N 7.82 0.98 -2.78 -1.68 0.11 -1.86 -3.32 132.00 131.28 2kvz h PRO 6 Ca -0.15 -0.40 -0.58 0.00 0.11 0.00 0.00 66.00 64.98 2kvz h PRO 6 Cb 1.05 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2kvz h PRO 6 CO 0.45 1.07 2.94 0.09 -0.21 0.00 0.00 178.00 182.35 2kvz n ASN 7 N -4.12 8.05 -4.12 -2.05 3.02 -1.25 -3.05 115.26 111.74 2kvz n ASN 7 Ca 0.01 -2.59 -0.36 0.00 -0.03 0.00 0.00 54.58 51.60 2kvz n ASN 7 Cb 0.44 -1.52 -0.11 0.00 -0.61 0.00 0.00 39.78 37.98 2kvz n ASN 7 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2kvz s GLN 8 N 1.72 2.03 -0.38 3.52 0.74 -1.25 -3.44 119.66 122.60 2kvz s GLN 8 Ca 0.68 -1.81 -0.19 0.00 0.05 0.00 0.00 55.36 54.09 2kvz s GLN 8 Cb 0.21 -3.59 0.01 0.00 1.10 0.00 0.00 33.01 30.74 2kvz s GLN 8 CO -0.05 -1.07 0.58 0.08 -0.55 0.00 0.00 175.29 174.28 2kvz s VAL 9 N 1.15 4.93 -0.45 1.34 1.01 0.20 -1.07 120.40 127.51 2kvz s VAL 9 Ca 0.08 0.31 -0.15 0.00 0.00 0.00 0.00 61.98 62.21 2kvz s VAL 9 Cb -0.23 -4.07 0.05 0.00 0.00 0.00 0.00 36.38 32.14 2kvz s VAL 9 CO -0.04 -0.36 0.37 -0.89 0.00 0.00 0.00 175.10 174.18 2kvz s THR 10 N 2.59 5.23 -0.32 3.92 2.01 0.14 -0.39 115.64 128.82 2kvz s THR 10 Ca 0.21 -0.87 -0.18 0.00 0.31 0.00 0.00 61.69 61.16 2kvz s THR 10 Cb -0.15 -4.06 -0.01 0.00 0.01 0.00 0.00 72.50 68.29 2kvz s THR 10 CO 0.15 -0.49 0.51 -0.69 -0.69 0.00 0.00 174.62 173.41 2kvz s VAL 11 N 1.71 5.04 -0.18 3.82 1.01 -0.43 -0.33 120.40 131.04 2kvz s VAL 11 Ca 0.05 0.52 -0.02 0.00 0.00 0.00 0.00 61.98 62.53 2kvz s VAL 11 Cb -0.22 -3.91 -0.01 0.00 0.00 0.00 0.00 36.38 32.25 2kvz s VAL 11 CO 0.08 -0.11 -0.10 0.20 0.00 0.00 0.00 175.10 175.18 2kvz s ASN 12 N 1.69 4.05 -0.56 3.32 -0.87 -0.80 -0.75 114.94 121.01 2kvz s ASN 12 Ca 0.19 -0.40 -0.22 0.00 -1.57 0.00 0.00 52.86 50.87 2kvz s ASN 12 Cb -0.15 -1.66 0.06 0.00 -0.02 0.00 0.00 41.25 39.48 2kvz s ASN 12 CO 0.12 0.05 0.82 -0.31 -2.57 0.00 0.00 177.10 175.22 2kvz s TYR 13 N 1.03 2.87 0.15 2.20 2.02 -1.26 -1.08 117.35 123.28 2kvz s TYR 13 Ca -0.00 -0.39 0.04 0.00 -0.37 0.00 0.00 57.07 56.35 2kvz s TYR 13 Cb -0.15 -3.95 -0.04 0.00 -0.40 0.00 0.00 41.96 37.43 2kvz s TYR 13 CO -0.01 -1.31 0.19 -0.51 -1.57 0.00 0.00 175.55 172.34 2kvz s LEU 14 N 3.44 4.04 -0.08 -1.29 1.43 0.11 -0.42 118.68 125.91 2kvz s LEU 14 Ca 0.22 0.02 -0.02 0.00 -1.03 0.00 0.00 54.13 53.32 2kvz s LEU 14 Cb -0.17 -2.64 -0.01 0.00 0.03 0.00 0.00 46.19 43.40 2kvz s LEU 14 CO 0.14 0.07 0.09 -0.78 0.23 0.00 0.00 176.35 176.10 2kvz h ASP 15 N 2.40 -0.06 0.00 2.29 3.58 -1.50 0.40 116.42 123.53 2kvz h ASP 15 Ca -0.48 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.97 2kvz h ASP 15 Cb 1.19 0.02 0.00 0.00 1.72 0.00 0.00 39.33 42.26 2kvz h ASP 15 CO 0.66 0.39 0.00 1.21 -2.88 0.00 0.00 179.24 178.62 2kvz n GLU 16 N -4.63 0.00 -0.24 0.28 2.13 -1.26 -4.10 120.64 112.81 2kvz n GLU 16 Ca -0.01 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.77 2kvz n GLU 16 Cb 0.03 0.00 0.05 0.00 0.27 0.00 0.00 31.44 31.79 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 0.00 2.95 0.00 4.31 0.23 -1.26 -4.79 115.26 116.70 2kvz n ASN 17 Ca 0.00 -2.31 0.00 0.00 -0.53 0.00 0.00 54.58 51.74 2kvz n ASN 17 Cb 0.00 -0.56 0.00 0.00 -2.08 0.00 0.00 39.78 37.14 2kvz n ASN 17 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2kvz n ASN 18 N 0.16 0.00 -4.68 0.53 4.13 -1.26 -4.96 115.26 109.18 2kvz n ASN 18 Ca 0.11 0.00 -0.42 0.00 1.68 0.00 0.00 54.58 55.95 2kvz n ASN 18 Cb 0.69 -1.02 -0.03 0.00 -1.54 0.00 0.00 39.78 37.89 2kvz n ASN 18 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2kvz s THR 19 N -2.69 3.92 -0.51 3.41 2.01 -1.26 -4.89 115.64 115.63 2kvz s THR 19 Ca 0.00 1.22 -0.26 0.00 0.31 0.00 0.00 61.69 62.95 2kvz s THR 19 Cb 0.00 -3.78 0.03 0.00 0.01 0.00 0.00 72.50 68.76 2kvz s THR 19 CO 0.00 -0.05 1.02 -0.55 -0.69 0.00 0.00 174.62 174.35 2kvz s SER 20 N 2.12 6.47 0.41 3.53 0.15 -1.26 -1.58 113.70 123.55 2kvz s SER 20 Ca 0.62 0.05 0.29 0.00 0.70 0.00 0.00 55.95 57.61 2kvz s SER 20 Cb -0.28 -2.48 1.13 0.00 -1.71 0.00 0.00 66.02 62.68 2kvz s SER 20 CO 0.23 -1.21 1.85 0.16 1.20 0.00 0.00 173.24 175.46 2kvz h ILE 21 N 6.11 0.00 -4.03 6.45 3.07 -1.07 -3.41 117.51 124.63 2kvz h ILE 21 Ca -0.25 -0.43 -0.39 0.00 1.55 0.00 0.00 64.86 65.35 2kvz h ILE 21 Cb 1.07 1.33 -0.29 0.00 -0.27 0.00 0.00 36.82 38.66 2kvz h ILE 21 CO 1.09 0.00 -0.78 0.00 -1.05 0.00 0.00 178.15 177.41 2kvz s ALA 22 N -3.47 0.73 0.55 0.16 0.00 -1.23 -5.08 121.76 113.41 2kvz s ALA 22 Ca 0.03 -0.38 -0.20 0.00 0.00 0.00 0.00 51.96 51.41 2kvz s ALA 22 Cb 0.09 -0.19 -0.07 0.00 0.00 0.00 0.00 23.12 22.96 2kvz s ALA 22 CO 0.50 0.18 0.93 -0.35 0.00 0.00 0.00 175.76 177.02 2kvz n PRO 23 N 2.86 0.99 -1.67 0.00 -0.04 -1.26 -4.21 135.00 131.68 2kvz n PRO 23 Ca -0.13 0.38 -0.51 0.00 -0.04 0.00 0.00 63.50 63.19 2kvz n PRO 23 Cb 0.57 -2.09 -0.06 0.00 -0.04 0.00 0.00 33.50 31.88 2kvz n PRO 23 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2kvz n SER 24 N -0.29 2.68 -4.62 3.54 7.64 -1.26 -4.82 113.62 116.49 2kvz n SER 24 Ca 0.12 1.06 -0.41 0.00 1.01 0.00 0.00 58.87 60.65 2kvz n SER 24 Cb 0.45 -1.28 -0.06 0.00 -1.01 0.00 0.00 64.21 62.31 2kvz n SER 24 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2kvz s LEU 25 N 2.40 4.09 -0.91 -3.43 2.96 0.07 -4.93 118.68 118.94 2kvz s LEU 25 Ca 0.89 0.60 -0.21 0.00 -0.22 0.00 0.00 54.13 55.20 2kvz s LEU 25 Cb -0.85 -2.86 0.10 0.00 0.50 0.00 0.00 46.19 43.08 2kvz s LEU 25 CO 0.51 -0.43 1.19 -0.31 -1.32 0.00 0.00 176.35 175.99 2kvz s TYR 26 N 2.58 2.88 -0.75 5.38 2.02 -1.26 -1.31 117.35 126.89 2kvz s TYR 26 Ca 0.26 -1.09 -0.20 0.00 -0.37 0.00 0.00 57.07 55.67 2kvz s TYR 26 Cb -0.15 -4.40 0.11 0.00 -0.40 0.00 0.00 41.96 37.12 2kvz s TYR 26 CO 0.10 -1.64 0.95 -1.17 -1.57 0.00 0.00 175.55 172.21 2kvz s LEU 27 N 3.56 5.00 -0.08 -1.29 2.96 0.48 -4.96 118.68 124.34 2kvz s LEU 27 Ca 0.35 -1.57 0.04 0.00 -0.22 0.00 0.00 54.13 52.73 2kvz s LEU 27 Cb -0.05 -2.37 -0.01 0.00 0.50 0.00 0.00 46.19 44.26 2kvz s LEU 27 CO -0.06 -1.18 -0.23 -0.55 -1.32 0.00 0.00 176.35 173.01 2kvz s SER 28 N 3.57 3.22 0.00 3.68 0.15 -1.26 -0.63 113.70 122.43 2kvz s SER 28 Ca 0.23 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.38 2kvz s SER 28 Cb -0.14 -1.17 0.00 0.00 -1.71 0.00 0.00 66.02 63.00 2kvz s SER 28 CO 0.01 0.20 0.00 0.61 1.20 0.00 0.00 173.24 175.26 2kvz n GLY 29 N 3.24 5.71 3.92 9.45 0.00 -1.22 -5.05 105.19 121.23 2kvz n GLY 29 Ca -0.18 -0.89 -0.27 0.00 0.00 0.00 0.00 46.02 44.68 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 4.26 0.22 0.99 2.01 -1.26 -4.83 118.68 120.07 2kvz s LEU 30 Ca 0.00 0.13 -0.30 0.00 0.01 0.00 0.00 54.13 53.97 2kvz s LEU 30 Cb 0.00 -2.84 -0.10 0.00 0.01 0.00 0.00 46.19 43.26 2kvz s LEU 30 CO 0.00 0.07 1.47 0.12 1.01 0.00 0.00 176.35 179.02 2kvz s PHE 31 N -1.72 3.03 -0.55 0.29 5.36 -1.26 -3.62 117.98 119.52 2kvz s PHE 31 Ca 0.34 0.93 -0.10 0.00 -0.96 0.00 0.00 56.93 57.13 2kvz s PHE 31 Cb -0.11 -3.84 0.01 0.00 -0.34 0.00 0.00 43.02 38.74 2kvz s PHE 31 CO 0.28 -2.85 0.64 -1.71 -1.46 0.00 0.00 175.22 170.12 2kvz n ASN 32 N 2.78 -7.82 -3.66 6.13 5.15 -1.20 -4.97 115.26 111.67 2kvz n ASN 32 Ca 0.09 0.28 -0.08 0.00 -0.60 0.00 0.00 54.58 54.27 2kvz n ASN 32 Cb 0.40 -5.25 -0.09 0.00 -0.53 0.00 0.00 39.78 34.31 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 -2.78 0.39 -0.05 1.20 2.12 -1.24 -4.88 118.70 113.46 2kvz s GLU 33 Ca 0.16 1.08 -0.30 0.00 0.36 0.00 0.00 54.97 56.27 2kvz s GLU 33 Cb -0.04 0.36 -0.06 0.00 0.26 0.00 0.00 34.13 34.65 2kvz s GLU 33 CO 0.77 -0.22 1.70 0.00 -0.54 0.00 0.00 175.26 176.96 2kvz s ALA 34 N 2.43 3.59 0.49 6.30 0.00 -1.26 -1.35 121.76 131.96 2kvz s ALA 34 Ca -0.04 0.97 0.05 0.00 0.00 0.00 0.00 51.96 52.93 2kvz s ALA 34 Cb -0.11 -3.76 -0.01 0.00 0.00 0.00 0.00 23.12 19.23 2kvz s ALA 34 CO -0.14 -1.45 0.17 1.52 0.00 0.00 0.00 175.76 175.86 2kvz s TYR 35 N 4.16 2.06 0.03 0.00 1.13 -0.70 -4.98 117.35 119.05 2kvz s TYR 35 Ca 0.75 -0.80 0.04 0.00 -1.41 0.00 0.00 57.07 55.66 2kvz s TYR 35 Cb -0.34 -1.81 -0.02 0.00 -1.10 0.00 0.00 41.96 38.69 2kvz s TYR 35 CO 0.31 0.03 -0.12 -0.80 -2.51 0.00 0.00 175.55 172.45 2kvz s ASN 36 N -3.99 1.44 -0.29 -0.18 0.01 -1.26 -4.45 114.94 106.22 2kvz s ASN 36 Ca 0.26 -0.41 -0.17 0.00 -0.71 0.00 0.00 52.86 51.83 2kvz s ASN 36 Cb 0.02 -0.09 -0.02 0.00 0.41 0.00 0.00 41.25 41.57 2kvz s ASN 36 CO 0.15 0.02 0.48 -0.69 -1.51 0.00 0.00 177.10 175.55 2kvz s VAL 37 N -0.78 5.08 0.14 1.60 1.01 -1.26 -5.04 120.40 121.14 2kvz s VAL 37 Ca 0.01 0.61 -0.31 0.00 0.00 0.00 0.00 61.98 62.28 2kvz s VAL 37 Cb -0.07 -3.84 -0.09 0.00 0.00 0.00 0.00 36.38 32.37 2kvz s VAL 37 CO 0.01 -0.00 1.53 -2.84 0.00 0.00 0.00 175.10 173.80 2kvz s PRO 38 N 2.28 4.24 -0.54 2.72 0.02 -1.26 -4.98 135.00 137.48 2kvz s PRO 38 Ca 0.19 2.29 -0.16 0.00 0.02 0.00 0.00 61.00 63.33 2kvz s PRO 38 Cb -0.16 -3.23 0.12 0.00 0.02 0.00 0.00 34.50 31.26 2kvz s PRO 38 CO 0.11 -0.58 0.50 1.41 -0.33 0.00 0.00 177.00 178.11 2kvz s MET 39 N 1.31 2.99 0.08 5.54 1.75 -1.26 -5.05 119.30 124.66 2kvz s MET 39 Ca 0.69 -1.65 -0.24 0.00 -1.25 0.00 0.00 55.69 53.24 2kvz s MET 39 Cb -0.42 -4.28 -0.06 0.00 2.84 0.00 0.00 34.83 32.91 2kvz s MET 39 CO 0.31 -1.31 0.72 0.15 -0.65 0.00 0.00 175.02 174.24 2kvz s LYS 40 N 1.66 4.46 -0.21 4.11 1.02 -1.26 -5.06 119.74 124.46 2kvz s LYS 40 Ca 0.04 1.01 0.01 0.00 0.02 0.00 0.00 55.97 57.05 2kvz s LYS 40 Cb -0.29 -3.31 0.04 0.00 -0.52 0.00 0.00 37.83 33.75 2kvz s LYS 40 CO 0.04 0.43 -0.14 0.21 -0.92 0.00 0.00 175.35 174.97 2kvz s LYS 41 N -0.56 2.43 0.39 1.68 2.20 -1.26 -5.09 119.74 119.53 2kvz s LYS 41 Ca 0.35 -0.95 -0.02 0.00 -0.36 0.00 0.00 55.97 54.99 2kvz s LYS 41 Cb -0.21 -2.57 -0.03 0.00 -1.51 0.00 0.00 37.83 33.50 2kvz s LYS 41 CO 0.23 -0.38 0.63 0.42 -0.36 0.00 0.00 175.35 175.89 2kvz s ILE 42 N 1.29 5.04 -0.50 5.43 1.01 -1.26 -4.97 121.20 127.24 2kvz s ILE 42 Ca -0.01 -0.22 -0.37 0.00 0.00 0.00 0.00 60.65 60.05 2kvz s ILE 42 Cb -0.16 -3.86 -0.15 0.00 0.01 0.00 0.00 42.46 38.30 2kvz s ILE 42 CO -0.09 -0.65 2.25 1.17 0.00 0.00 0.00 174.94 177.62 2kvz n LYS 43 N -1.93 0.54 -2.36 2.79 4.81 -1.26 -2.36 118.16 118.40 2kvz n LYS 43 Ca -0.03 0.13 -0.06 0.00 -0.87 0.00 0.00 58.31 57.48 2kvz n LYS 43 Cb 0.56 -2.04 0.03 0.00 0.02 0.00 0.00 35.03 33.60 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 6.86 0.14 2.71 3.14 0.00 -1.26 -4.90 105.19 111.87 2kvz n GLY 44 Ca 0.49 -0.12 -0.24 0.00 0.00 0.00 0.00 46.02 46.15 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 -3.14 0.54 -0.12 1.61 2.02 -0.99 -0.31 117.35 116.95 2kvz s TYR 45 Ca 0.08 -0.31 -0.09 0.00 -0.37 0.00 0.00 57.07 56.38 2kvz s TYR 45 Cb -0.01 -0.78 -0.04 0.00 -0.40 0.00 0.00 41.96 40.73 2kvz s TYR 45 CO 0.27 -0.42 0.19 0.99 -1.57 0.00 0.00 175.55 175.01 2kvz s THR 46 N 2.02 5.40 -0.21 -0.71 2.01 0.14 -4.71 115.64 119.58 2kvz s THR 46 Ca 0.03 0.33 -0.29 0.00 0.31 0.00 0.00 61.69 62.07 2kvz s THR 46 Cb -0.14 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 2kvz s THR 46 CO -0.06 0.56 1.80 -0.22 -0.69 0.00 0.00 174.62 176.00 2kvz s LEU 47 N -0.62 3.81 0.06 4.42 2.96 -1.26 0.84 118.68 128.89 2kvz s LEU 47 Ca 0.15 1.74 -0.29 0.00 -0.22 0.00 0.00 54.13 55.51 2kvz s LEU 47 Cb -0.13 -3.53 -0.18 0.00 0.50 0.00 0.00 46.19 42.86 2kvz s LEU 47 CO 0.04 -1.44 1.57 0.25 -1.32 0.00 0.00 176.35 175.46 2kvz h LEU 48 N 12.50 -0.54 0.00 -0.68 5.85 -1.31 -3.46 115.31 127.67 2kvz h LEU 48 Ca -0.37 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.34 2kvz h LEU 48 Cb 1.18 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.35 2kvz h LEU 48 CO 0.99 -0.34 0.00 1.17 -0.34 0.00 0.00 178.44 179.93 2kvz n LYS 49 N -5.34 0.00 -4.06 1.25 4.81 -1.25 -5.05 118.16 108.52 2kvz n LYS 49 Ca -0.12 0.00 -0.32 0.00 -0.87 0.00 0.00 58.31 57.00 2kvz n LYS 49 Cb 0.28 0.00 -0.15 0.00 0.02 0.00 0.00 35.03 35.18 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 -1.56 3.22 0.10 5.64 1.13 -1.26 -4.30 117.35 120.31 2kvz s TYR 50 Ca 0.00 -2.21 -0.04 0.00 -1.41 0.00 0.00 57.07 53.40 2kvz s TYR 50 Cb 0.00 -1.95 -0.19 0.00 -1.10 0.00 0.00 41.96 38.72 2kvz s TYR 50 CO 0.00 -0.86 1.21 0.22 -2.51 0.00 0.00 175.55 173.61 2kvz h ASP 51 N 7.81 0.48 -3.00 -0.18 3.58 -2.00 -3.43 116.42 119.68 2kvz h ASP 51 Ca -0.22 -0.45 -0.57 0.00 0.42 0.00 0.00 57.03 56.21 2kvz h ASP 51 Cb 1.05 -0.15 -0.04 0.00 1.72 0.00 0.00 39.33 41.91 2kvz h ASP 51 CO 0.48 1.30 1.04 -0.44 -2.88 0.00 0.00 179.24 178.74 2kvz s SER 52 N -7.13 6.55 0.11 2.28 0.01 -1.26 -4.96 113.70 109.30 2kvz s SER 52 Ca -0.05 1.36 -0.32 0.00 1.31 0.00 0.00 55.95 58.26 2kvz s SER 52 Cb 0.08 -2.54 -0.11 0.00 0.21 0.00 0.00 66.02 63.66 2kvz s SER 52 CO 0.88 -1.16 1.83 -0.62 0.41 0.00 0.00 173.24 174.57 2kvz n GLU 53 N 7.47 2.71 0.05 12.44 1.02 -1.26 -4.88 120.64 138.20 2kvz n GLU 53 Ca 0.16 0.99 0.12 0.00 -0.02 0.00 0.00 57.16 58.41 2kvz n GLU 53 Cb 0.46 -2.87 0.18 0.00 -0.02 0.00 0.00 31.44 29.19 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 4.65 0.32 -2.34 -3.67 -5.35 -1.26 -4.76 119.36 106.96 2kvz n ILE 54 Ca 0.18 -0.25 -0.42 0.00 -0.27 0.00 0.00 62.75 62.00 2kvz n ILE 54 Cb 0.36 -0.10 -0.03 0.00 -1.74 0.00 0.00 39.64 38.14 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 -4.12 3.44 0.00 7.28 2.96 -1.26 -4.75 118.68 122.23 2kvz s LEU 55 Ca 0.07 0.46 0.00 0.00 -0.22 0.00 0.00 54.13 54.43 2kvz s LEU 55 Cb 0.14 -3.14 0.00 0.00 0.50 0.00 0.00 46.19 43.68 2kvz s LEU 55 CO 0.72 -1.70 0.00 0.61 -1.32 0.00 0.00 176.35 174.66 2kvz n GLY 56 N 5.26 0.59 3.78 7.98 0.00 -1.26 -5.08 105.19 116.47 2kvz n GLY 56 Ca 0.14 -0.74 -0.25 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.05 4.35 0.09 1.61 -7.23 -1.26 -1.71 120.40 114.19 2kvz s VAL 57 Ca 0.00 -1.23 -0.34 0.00 -1.81 0.00 0.00 61.98 58.60 2kvz s VAL 57 Cb 0.00 -3.25 -0.13 0.00 0.56 0.00 0.00 36.38 33.56 2kvz s VAL 57 CO 0.00 -0.18 1.70 0.49 -0.31 0.00 0.00 175.10 176.80 2kvz n PHE 58 N -0.55 2.35 -1.82 2.82 3.72 -0.46 -4.79 117.46 118.74 2kvz n PHE 58 Ca -0.08 0.13 -0.31 0.00 -0.05 0.00 0.00 57.45 57.13 2kvz n PHE 58 Cb 0.56 -2.61 0.02 0.00 -0.94 0.00 0.00 39.48 36.51 2kvz n PHE 58 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2kvz s THR 59 N 2.03 4.60 -2.17 4.37 2.01 -1.26 -3.24 115.64 121.98 2kvz s THR 59 Ca 0.83 0.84 0.28 0.00 0.31 0.00 0.00 61.69 63.95 2kvz s THR 59 Cb -0.65 -3.79 0.50 0.00 0.01 0.00 0.00 72.50 68.56 2kvz s THR 59 CO 0.41 -1.10 1.75 1.21 -0.69 0.00 0.00 174.62 176.20 2kvz n GLU 60 N -2.81 1.29 -4.67 4.92 2.13 -1.26 -3.86 120.64 116.38 2kvz n GLU 60 Ca 0.06 -0.68 -0.28 0.00 0.66 0.00 0.00 57.16 56.92 2kvz n GLU 60 Cb 0.54 -1.49 -0.14 0.00 0.27 0.00 0.00 31.44 30.62 2kvz n GLU 60 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2kvz s SER 61 N -2.18 2.86 -0.42 4.31 0.01 -1.17 -4.54 113.70 112.57 2kvz s SER 61 Ca 0.34 -0.60 -0.29 0.00 1.31 0.00 0.00 55.95 56.72 2kvz s SER 61 Cb 0.21 -0.23 -0.09 0.00 0.21 0.00 0.00 66.02 66.12 2kvz s SER 61 CO 0.40 0.19 2.34 -0.81 0.41 0.00 0.00 173.24 175.77 2kvz n PRO 62 N 1.61 1.24 -3.55 12.44 -0.04 -1.25 -4.57 135.00 140.88 2kvz n PRO 62 Ca -0.17 0.22 -0.40 0.00 -0.04 0.00 0.00 63.50 63.10 2kvz n PRO 62 Cb 0.53 -3.03 -0.11 0.00 -0.04 0.00 0.00 33.50 30.85 2kvz n PRO 62 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2kvz s GLN 63 N 7.36 3.29 -0.23 0.54 0.74 -0.23 -4.92 119.66 126.21 2kvz s GLN 63 Ca 1.04 -0.78 -0.21 0.00 0.05 0.00 0.00 55.36 55.47 2kvz s GLN 63 Cb -0.45 -3.78 -0.02 0.00 1.10 0.00 0.00 33.01 29.86 2kvz s GLN 63 CO 0.35 -0.52 0.65 0.99 -0.55 0.00 0.00 175.29 176.21 2kvz s THR 64 N 1.67 4.99 -0.23 -0.34 2.01 -1.26 0.28 115.64 122.76 2kvz s THR 64 Ca 0.05 1.19 -0.07 0.00 0.31 0.00 0.00 61.69 63.17 2kvz s THR 64 Cb -0.18 -3.95 -0.03 0.00 0.01 0.00 0.00 72.50 68.35 2kvz s THR 64 CO 0.09 0.05 0.07 -0.63 -0.69 0.00 0.00 174.62 173.52 2kvz s ILE 65 N 2.29 4.45 -0.71 1.82 1.01 0.56 -4.96 121.20 125.65 2kvz s ILE 65 Ca 0.28 -0.13 -0.24 0.00 0.00 0.00 0.00 60.65 60.56 2kvz s ILE 65 Cb -0.16 -3.06 0.06 0.00 0.01 0.00 0.00 42.46 39.31 2kvz s ILE 65 CO 0.09 0.36 1.10 0.20 0.00 0.00 0.00 174.94 176.69 2kvz s ASN 66 N 1.34 6.20 -0.59 3.58 -0.87 -1.26 -1.91 114.94 121.43 2kvz s ASN 66 Ca 0.05 -0.87 -0.18 0.00 -1.57 0.00 0.00 52.86 50.28 2kvz s ASN 66 Cb -0.15 -2.47 0.11 0.00 -0.02 0.00 0.00 41.25 38.72 2kvz s ASN 66 CO 0.04 -1.56 0.68 -0.63 -2.57 0.00 0.00 177.10 173.05 2kvz s ILE 67 N 4.61 4.88 -0.23 0.60 -1.09 -0.24 -4.77 121.20 124.96 2kvz s ILE 67 Ca 0.28 -1.09 -0.16 0.00 -2.23 0.00 0.00 60.65 57.45 2kvz s ILE 67 Cb -0.13 -4.47 -0.04 0.00 -1.58 0.00 0.00 42.46 36.24 2kvz s ILE 67 CO 0.10 -1.09 0.41 -0.63 -1.23 0.00 0.00 174.94 172.49 2kvz s ILE 68 N 2.50 5.18 -0.12 2.92 1.01 -1.26 0.09 121.20 131.51 2kvz s ILE 68 Ca 0.10 0.70 -0.03 0.00 0.00 0.00 0.00 60.65 61.42 2kvz s ILE 68 Cb -0.25 -3.73 -0.03 0.00 0.01 0.00 0.00 42.46 38.46 2kvz s ILE 68 CO 0.05 0.21 -0.01 -0.31 0.00 0.00 0.00 174.94 174.88 2kvz s TYR 69 N 1.62 3.11 -0.20 3.97 2.02 0.14 -0.83 117.35 127.18 2kvz s TYR 69 Ca 0.18 -0.02 -0.10 0.00 -0.37 0.00 0.00 57.07 56.77 2kvz s TYR 69 Cb -0.15 -1.89 -0.05 0.00 -0.40 0.00 0.00 41.96 39.47 2kvz s TYR 69 CO 0.09 0.23 0.13 -1.14 -1.57 0.00 0.00 175.55 173.28 2kvz s GLN 70 N -0.24 4.16 -0.27 -0.62 0.74 0.25 -4.40 119.66 119.29 2kvz s GLN 70 Ca 0.05 -0.22 -0.33 0.00 0.05 0.00 0.00 55.36 54.91 2kvz s GLN 70 Cb -0.12 -3.41 -0.10 0.00 1.10 0.00 0.00 33.01 30.48 2kvz s GLN 70 CO 0.02 0.32 2.13 0.36 -0.55 0.00 0.00 175.29 177.57 2kvz n LYS 71 N 3.47 1.51 0.07 1.67 0.00 -1.26 -0.68 118.16 122.94 2kvz n LYS 71 Ca -0.16 0.45 -0.05 0.00 -0.00 0.00 0.00 58.31 58.55 2kvz n LYS 71 Cb 0.52 -2.69 0.13 0.00 -0.00 0.00 0.00 35.03 32.99 2kvz n LYS 71 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 2kvz h LYS 72 N 12.38 0.30 -4.87 -1.58 3.64 -1.01 -3.46 116.57 121.96 2kvz h LYS 72 Ca -0.35 -0.19 0.01 0.00 -1.27 0.00 0.00 60.65 58.85 2kvz h LYS 72 Cb 1.29 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 33.05 2kvz h LYS 72 CO 0.99 0.77 -1.29 0.00 -2.27 0.00 0.00 179.45 177.65 2kvz n ALA 73 N -2.48 -3.60 0.18 5.00 0.00 -1.26 -4.91 120.51 113.45 2kvz n ALA 73 Ca -0.02 1.64 0.03 0.00 0.00 0.00 0.00 53.44 55.09 2kvz n ALA 73 Cb 0.59 -3.21 0.36 0.00 0.00 0.00 0.00 19.45 17.19 2kvz n ALA 73 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2kvz h PRO 74 N 3.43 0.00 -6.20 0.00 0.11 -1.95 -3.42 132.00 123.97 2kvz h PRO 74 Ca -0.34 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.21 2kvz h PRO 74 Cb 0.78 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.86 2kvz h PRO 74 CO 0.04 0.39 0.97 -1.21 -0.21 0.00 0.00 178.00 177.98 2kvz s GLU 75 N -3.98 4.21 -0.02 1.05 8.01 -1.26 -4.95 118.70 121.77 2kvz s GLU 75 Ca -0.02 1.87 -0.00 0.00 0.01 0.00 0.00 54.97 56.83 2kvz s GLU 75 Cb 0.13 -3.85 -0.00 0.00 -4.31 0.00 0.00 34.13 26.11 2kvz s GLU 75 CO 0.71 -0.76 -0.01 1.96 0.01 0.00 0.00 175.26 177.17 2kvz h GLN 76 N 8.71 0.00 0.00 1.61 4.20 -1.99 -3.47 115.11 124.17 2kvz h GLN 76 Ca -0.32 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.39 2kvz h GLN 76 Cb 1.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.91 2kvz h GLN 76 CO 0.96 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 179.12 2kvz n ALA 77 N -2.24 0.00 -2.62 3.87 0.00 -1.26 -4.99 120.51 113.27 2kvz n ALA 77 Ca -0.00 -0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 2kvz n ALA 77 Cb 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.37 2kvz n ALA 77 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2kvz s LEU 78 N -1.63 3.23 -0.35 0.00 1.43 -1.26 -5.06 118.68 115.03 2kvz s LEU 78 Ca 0.00 -0.24 -0.28 0.00 -1.03 0.00 0.00 54.13 52.58 2kvz s LEU 78 Cb 0.00 -1.95 -0.01 0.00 0.03 0.00 0.00 46.19 44.26 2kvz s LEU 78 CO 0.00 0.21 1.72 -1.61 0.23 0.00 0.00 176.35 176.90 2kvz s GLU 79 N -1.98 3.37 -0.93 1.70 2.02 -1.26 -4.93 118.70 116.70 2kvz s GLU 79 Ca 0.21 1.32 -0.24 0.00 0.02 0.00 0.00 54.97 56.28 2kvz s GLU 79 Cb -0.11 -4.17 0.04 0.00 0.10 0.00 0.00 34.13 29.99 2kvz s GLU 79 CO 0.13 -1.81 1.46 -1.01 0.02 0.00 0.00 175.26 174.05 2kvz s HIS 80 N 6.62 2.38 0.18 1.61 3.76 -1.26 -4.97 115.29 123.62 2kvz s HIS 80 Ca 0.76 -0.48 -0.31 0.00 -0.15 0.00 0.00 55.06 54.88 2kvz s HIS 80 Cb -0.20 -4.61 -0.09 0.00 1.11 0.00 0.00 32.58 28.78 2kvz s HIS 80 CO 0.33 -1.97 1.41 -1.01 -0.85 0.00 0.00 174.74 172.66 2kvz s HIS 81 N 5.70 3.15 -0.71 1.40 0.09 -1.26 -4.88 115.29 118.78 2kvz s HIS 81 Ca 0.46 0.98 0.21 0.00 -0.00 0.00 0.00 55.06 56.71 2kvz s HIS 81 Cb -0.03 -3.74 0.85 0.00 -0.00 0.00 0.00 32.58 29.66 2kvz s HIS 81 CO -0.02 -2.52 1.64 1.58 -0.00 0.00 0.00 174.74 175.42 2kvz n HIS 82 N 3.16 0.49 1.53 1.40 -0.00 -1.26 -0.22 115.22 120.31 2kvz n HIS 82 Ca 0.09 0.19 0.15 0.00 0.46 0.00 0.00 57.72 58.60 2kvz n HIS 82 Cb 0.41 -0.80 0.67 0.00 -0.12 0.00 0.00 29.99 30.15 2kvz n HIS 82 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2kvz n HIS 83 N -1.94 0.00 -4.41 1.57 -0.00 -1.26 -4.83 115.22 104.35 2kvz n HIS 83 Ca 0.03 0.00 -0.26 0.00 -0.00 0.00 0.00 57.72 57.49 2kvz n HIS 83 Cb 0.23 -0.14 -0.09 0.00 -0.00 0.00 0.00 29.99 29.99 2kvz n HIS 83 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2kvz s HIS 84 N -2.34 2.53 0.00 1.57 4.02 0.69 -5.29 115.29 116.47 2kvz s HIS 84 Ca 0.33 -0.56 0.00 0.00 1.02 0.00 0.00 55.06 55.85 2kvz s HIS 84 Cb 0.21 -1.68 0.00 0.00 -1.02 0.00 0.00 32.58 30.09 2kvz s HIS 84 CO 0.44 0.42 0.00 0.72 1.02 0.00 0.00 174.74 177.34