#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kvz n ASP 2 N 0.00 6.24 0.00 7.83 8.00 -1.26 -4.22 116.55 133.14 2kvz n ASP 2 Ca 0.00 -3.34 0.00 0.00 0.71 0.00 0.00 54.79 52.16 2kvz n ASP 2 Cb 0.00 -1.29 0.00 0.00 -0.02 0.00 0.00 41.12 39.81 2kvz n ASP 2 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 2kvz n PHE 3 N 1.61 0.00 0.01 1.24 1.16 -1.26 -4.80 117.46 115.42 2kvz n PHE 3 Ca 0.26 0.00 0.04 0.00 -1.87 0.00 0.00 57.45 55.88 2kvz n PHE 3 Cb 0.34 0.11 0.09 0.00 -1.61 0.00 0.00 39.48 38.41 2kvz n PHE 3 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2kvz n GLY 4 N 0.00 1.77 3.05 4.97 0.00 -1.26 -4.86 105.19 108.85 2kvz n GLY 4 Ca 0.00 -0.26 -0.32 0.00 0.00 0.00 0.00 46.02 45.43 2kvz n GLY 4 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2kvz s LYS 5 N -0.90 1.67 -0.46 1.61 2.20 -1.26 -5.07 119.74 117.52 2kvz s LYS 5 Ca 0.15 -1.82 -0.28 0.00 -0.36 0.00 0.00 55.97 53.66 2kvz s LYS 5 Cb 0.08 -3.27 -0.01 0.00 -1.51 0.00 0.00 37.83 33.13 2kvz s LYS 5 CO 0.11 -0.94 1.67 -2.14 -0.36 0.00 0.00 175.35 173.70 2kvz s PRO 6 N 0.97 3.18 -0.04 4.03 0.02 -1.26 -4.50 135.00 137.40 2kvz s PRO 6 Ca 0.09 0.94 -0.30 0.00 0.02 0.00 0.00 61.00 61.75 2kvz s PRO 6 Cb -0.20 -4.20 -0.03 0.00 0.02 0.00 0.00 34.50 30.09 2kvz s PRO 6 CO -0.07 -2.06 1.05 -0.80 -0.33 0.00 0.00 177.00 174.80 2kvz s ASN 7 N 5.94 7.24 -0.15 2.53 0.01 -0.45 -4.74 114.94 125.31 2kvz s ASN 7 Ca 0.68 1.69 -0.05 0.00 -0.71 0.00 0.00 52.86 54.47 2kvz s ASN 7 Cb -0.16 -2.56 -0.03 0.00 0.41 0.00 0.00 41.25 38.90 2kvz s ASN 7 CO 0.28 -0.41 0.01 -1.10 -1.51 0.00 0.00 177.10 174.38 2kvz s GLN 8 N 1.57 3.60 -0.10 -0.60 -0.21 -1.26 -1.01 119.66 121.65 2kvz s GLN 8 Ca 0.52 -0.42 -0.23 0.00 0.02 0.00 0.00 55.36 55.25 2kvz s GLN 8 Cb -0.22 -3.00 -0.03 0.00 1.00 0.00 0.00 33.01 30.76 2kvz s GLN 8 CO 0.24 0.39 0.70 0.08 -2.12 0.00 0.00 175.29 174.57 2kvz s VAL 9 N 0.01 5.03 -0.39 1.09 1.01 0.63 -3.98 120.40 123.80 2kvz s VAL 9 Ca 0.03 1.40 -0.22 0.00 0.00 0.00 0.00 61.98 63.20 2kvz s VAL 9 Cb -0.13 -4.03 0.01 0.00 0.00 0.00 0.00 36.38 32.24 2kvz s VAL 9 CO 0.02 0.20 0.71 -0.89 0.00 0.00 0.00 175.10 175.14 2kvz s THR 10 N 1.14 4.79 -0.47 3.92 2.01 0.17 -1.09 115.64 126.12 2kvz s THR 10 Ca 0.36 0.60 -0.23 0.00 0.31 0.00 0.00 61.69 62.72 2kvz s THR 10 Cb -0.17 -4.18 0.03 0.00 0.01 0.00 0.00 72.50 68.19 2kvz s THR 10 CO 0.16 -0.46 0.82 -0.69 -0.69 0.00 0.00 174.62 173.76 2kvz s VAL 11 N 2.95 4.59 -0.37 3.82 1.01 -0.16 -0.71 120.40 131.53 2kvz s VAL 11 Ca 0.27 0.43 -0.15 0.00 0.00 0.00 0.00 61.98 62.53 2kvz s VAL 11 Cb -0.14 -4.37 0.00 0.00 0.00 0.00 0.00 36.38 31.88 2kvz s VAL 11 CO 0.17 -0.80 0.34 0.20 0.00 0.00 0.00 175.10 175.01 2kvz s ASN 12 N 2.27 6.14 -0.59 3.32 -0.87 0.63 -1.45 114.94 124.39 2kvz s ASN 12 Ca 0.31 -0.53 -0.24 0.00 -1.57 0.00 0.00 52.86 50.83 2kvz s ASN 12 Cb -0.12 -2.18 0.05 0.00 -0.02 0.00 0.00 41.25 38.98 2kvz s ASN 12 CO 0.23 -0.39 0.96 -0.31 -2.57 0.00 0.00 177.10 175.01 2kvz s TYR 13 N 1.90 2.74 0.31 2.20 1.51 -1.26 -0.72 117.35 124.02 2kvz s TYR 13 Ca 0.09 -0.17 0.05 0.00 -1.01 0.00 0.00 57.07 56.02 2kvz s TYR 13 Cb -0.17 -4.15 0.05 0.00 -0.11 0.00 0.00 41.96 37.57 2kvz s TYR 13 CO 0.11 -1.47 0.39 1.28 -1.11 0.00 0.00 175.55 174.76 2kvz n LEU 14 N 7.61 0.00 -4.56 -1.29 4.77 0.17 -1.43 117.00 122.26 2kvz n LEU 14 Ca 0.00 -1.39 -0.26 0.00 -0.03 0.00 0.00 56.01 54.33 2kvz n LEU 14 Cb 0.47 -0.19 -0.10 0.00 -2.33 0.00 0.00 43.42 41.27 2kvz n LEU 14 CO 0.64 -0.58 -0.26 -0.62 -1.33 0.00 0.00 177.39 175.24 2kvz s ASP 15 N -2.90 3.20 0.24 -1.43 -1.08 -0.67 -1.04 116.67 112.98 2kvz s ASP 15 Ca 0.30 -1.46 -0.07 0.00 -0.52 0.00 0.00 52.55 50.80 2kvz s ASP 15 Cb -0.02 -0.00 0.22 0.00 -1.46 0.00 0.00 42.92 41.65 2kvz s ASP 15 CO 0.19 -0.64 1.88 -0.08 0.52 0.00 0.00 175.17 177.03 2kvz h GLU 16 N 1.84 1.28 -0.05 4.34 4.81 -1.81 0.16 114.58 125.15 2kvz h GLU 16 Ca -0.42 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 2kvz h GLU 16 Cb 1.26 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 30.38 2kvz h GLU 16 CO 0.72 0.91 0.00 -1.71 -0.73 0.00 0.00 179.01 178.20 2kvz n ASN 17 N -4.35 0.47 -2.69 1.04 2.85 -1.26 -4.94 115.26 106.39 2kvz n ASN 17 Ca 0.10 -1.49 -0.05 0.00 -0.11 0.00 0.00 54.58 53.03 2kvz n ASN 17 Cb 0.07 -0.03 0.01 0.00 1.24 0.00 0.00 39.78 41.07 2kvz n ASN 17 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 2kvz n ASN 18 N -0.48 -7.48 -3.65 1.20 5.15 0.55 -5.08 115.26 105.46 2kvz n ASN 18 Ca 0.15 0.81 -0.15 0.00 -0.60 0.00 0.00 54.58 54.79 2kvz n ASN 18 Cb 0.14 -5.01 -0.08 0.00 -0.53 0.00 0.00 39.78 34.30 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 -2.10 0.01 -0.42 -0.44 2.01 -1.26 -4.79 115.64 108.65 2kvz s THR 19 Ca 0.14 -0.07 -0.28 0.00 0.31 0.00 0.00 61.69 61.79 2kvz s THR 19 Cb -0.04 -0.82 -0.02 0.00 0.01 0.00 0.00 72.50 71.62 2kvz s THR 19 CO 0.71 -0.04 1.89 -0.94 -0.69 0.00 0.00 174.62 175.55 2kvz s SER 20 N -0.30 5.57 0.05 3.53 1.04 -1.26 -1.67 113.70 120.66 2kvz s SER 20 Ca -0.05 1.03 0.17 0.00 0.48 0.00 0.00 55.95 57.59 2kvz s SER 20 Cb -0.03 -2.52 -0.14 0.00 0.10 0.00 0.00 66.02 63.42 2kvz s SER 20 CO 0.04 -2.01 0.79 2.30 0.98 0.00 0.00 173.24 175.33 2kvz n ILE 21 N 7.42 1.14 -4.44 -1.02 -5.35 -0.51 -4.91 119.36 111.70 2kvz n ILE 21 Ca 0.24 -0.69 -0.24 0.00 -0.27 0.00 0.00 62.75 61.79 2kvz n ILE 21 Cb 0.49 -0.69 -0.13 0.00 -1.74 0.00 0.00 39.64 37.56 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 -2.94 1.69 0.33 -1.28 0.00 -1.22 -5.10 121.76 113.24 2kvz s ALA 22 Ca -0.03 -1.11 -0.28 0.00 0.00 0.00 0.00 51.96 50.53 2kvz s ALA 22 Cb 0.09 -0.27 -0.12 0.00 0.00 0.00 0.00 23.12 22.81 2kvz s ALA 22 CO 0.81 0.35 1.32 -2.30 0.00 0.00 0.00 175.76 175.95 2kvz n PRO 23 N 1.49 2.16 -1.71 0.00 -0.02 -1.26 -4.30 135.00 131.37 2kvz n PRO 23 Ca -0.18 0.76 -0.43 0.00 -2.02 0.00 0.00 63.50 61.63 2kvz n PRO 23 Cb 0.54 -2.36 -0.03 0.00 -0.02 0.00 0.00 33.50 31.62 2kvz n PRO 23 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2kvz n SER 24 N 0.96 3.93 -4.82 2.55 7.64 -1.26 -4.78 113.62 117.84 2kvz n SER 24 Ca 0.05 1.05 -0.38 0.00 1.01 0.00 0.00 58.87 60.61 2kvz n SER 24 Cb 0.36 -1.56 -0.06 0.00 -1.01 0.00 0.00 64.21 61.94 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 1.45 4.46 -0.41 -3.43 2.96 -0.53 -4.87 118.68 118.32 2kvz s LEU 25 Ca 0.77 1.16 -0.18 0.00 -0.22 0.00 0.00 54.13 55.66 2kvz s LEU 25 Cb -0.52 -2.95 0.02 0.00 0.50 0.00 0.00 46.19 43.23 2kvz s LEU 25 CO 0.34 0.23 0.47 -0.31 -1.32 0.00 0.00 176.35 175.76 2kvz s TYR 26 N -1.21 3.16 -0.74 5.38 2.02 -1.26 -0.99 117.35 123.71 2kvz s TYR 26 Ca 0.31 -0.24 -0.16 0.00 -0.37 0.00 0.00 57.07 56.61 2kvz s TYR 26 Cb -0.18 -2.95 0.17 0.00 -0.40 0.00 0.00 41.96 38.59 2kvz s TYR 26 CO 0.18 -0.69 0.75 -1.17 -1.57 0.00 0.00 175.55 173.05 2kvz s LEU 27 N 2.27 6.14 0.04 -1.29 2.96 -0.25 -4.95 118.68 123.59 2kvz s LEU 27 Ca 0.14 -2.17 -0.30 0.00 -0.22 0.00 0.00 54.13 51.58 2kvz s LEU 27 Cb -0.16 -2.25 -0.05 0.00 0.50 0.00 0.00 46.19 44.23 2kvz s LEU 27 CO 0.14 -0.81 1.08 -0.44 -1.32 0.00 0.00 176.35 175.01 2kvz s SER 28 N 2.96 7.24 0.03 3.68 0.01 -1.26 -0.27 113.70 126.09 2kvz s SER 28 Ca 0.16 1.85 -0.00 0.00 1.31 0.00 0.00 55.95 59.27 2kvz s SER 28 Cb -0.16 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.49 2kvz s SER 28 CO -0.04 -0.34 0.04 0.61 0.41 0.00 0.00 173.24 173.92 2kvz n GLY 29 N 2.95 3.20 3.56 3.44 0.00 -0.18 -4.97 105.19 113.20 2kvz n GLY 29 Ca 0.07 -1.44 -0.26 0.00 0.00 0.00 0.00 46.02 44.39 2kvz n GLY 29 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2kvz s LEU 30 N 0.00 2.34 0.15 0.99 2.96 -1.26 -1.35 118.68 122.51 2kvz s LEU 30 Ca 0.02 -1.49 -0.33 0.00 -0.22 0.00 0.00 54.13 52.12 2kvz s LEU 30 Cb -0.00 -0.52 -0.12 0.00 0.50 0.00 0.00 46.19 46.04 2kvz s LEU 30 CO 0.02 -0.68 1.72 0.33 -1.32 0.00 0.00 176.35 176.41 2kvz n PHE 31 N -0.91 2.54 -3.15 5.38 7.35 -1.26 -3.37 117.46 124.04 2kvz n PHE 31 Ca -0.07 0.06 -0.04 0.00 -0.76 0.00 0.00 57.45 56.64 2kvz n PHE 31 Cb 0.66 -2.65 0.01 0.00 0.35 0.00 0.00 39.48 37.86 2kvz n PHE 31 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 2kvz n ASN 32 N 4.38 -7.39 -3.78 -2.13 5.15 -1.24 -4.89 115.26 105.35 2kvz n ASN 32 Ca 0.17 -0.24 -0.13 0.00 -0.60 0.00 0.00 54.58 53.79 2kvz n ASN 32 Cb 0.33 -5.00 -0.11 0.00 -0.53 0.00 0.00 39.78 34.47 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 -3.39 0.41 0.75 1.20 2.12 -1.22 -4.95 118.70 113.63 2kvz s GLU 33 Ca 0.07 0.23 -0.12 0.00 0.36 0.00 0.00 54.97 55.51 2kvz s GLU 33 Cb -0.01 0.19 0.04 0.00 0.26 0.00 0.00 34.13 34.61 2kvz s GLU 33 CO 0.76 -0.07 1.12 0.00 -0.54 0.00 0.00 175.26 176.53 2kvz s ALA 34 N -0.24 2.67 0.07 6.30 0.00 -1.26 -0.99 121.76 128.31 2kvz s ALA 34 Ca -0.04 -0.39 -0.09 0.00 0.00 0.00 0.00 51.96 51.45 2kvz s ALA 34 Cb -0.03 -3.03 -0.00 0.00 0.00 0.00 0.00 23.12 20.06 2kvz s ALA 34 CO 0.01 -1.41 0.18 1.52 0.00 0.00 0.00 175.76 176.06 2kvz s TYR 35 N -3.37 0.14 -0.11 0.00 1.13 -1.26 -4.88 117.35 108.99 2kvz s TYR 35 Ca 0.60 -0.52 0.02 0.00 -1.41 0.00 0.00 57.07 55.76 2kvz s TYR 35 Cb -0.12 -0.06 -0.01 0.00 -1.10 0.00 0.00 41.96 40.67 2kvz s TYR 35 CO 0.52 -0.51 -0.18 -0.80 -2.51 0.00 0.00 175.55 172.06 2kvz s ASN 36 N -2.66 3.58 -0.28 -0.18 0.01 -1.26 -4.83 114.94 109.31 2kvz s ASN 36 Ca 0.02 -0.43 -0.17 0.00 -0.71 0.00 0.00 52.86 51.57 2kvz s ASN 36 Cb 0.03 -1.49 -0.02 0.00 0.41 0.00 0.00 41.25 40.18 2kvz s ASN 36 CO -0.09 0.17 0.49 -0.69 -1.51 0.00 0.00 177.10 175.47 2kvz s VAL 37 N 0.31 5.08 -0.45 1.60 1.01 -1.26 -5.02 120.40 121.67 2kvz s VAL 37 Ca -0.14 0.71 -0.28 0.00 0.00 0.00 0.00 61.98 62.27 2kvz s VAL 37 Cb -0.17 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.37 2kvz s VAL 37 CO 0.07 0.03 1.67 -2.84 0.00 0.00 0.00 175.10 174.03 2kvz s PRO 38 N 2.29 3.22 0.50 2.72 0.02 -1.26 -5.00 135.00 137.48 2kvz s PRO 38 Ca 0.20 0.98 -0.17 0.00 0.02 0.00 0.00 61.00 62.02 2kvz s PRO 38 Cb -0.16 -4.19 -0.08 0.00 0.02 0.00 0.00 34.50 30.09 2kvz s PRO 38 CO 0.10 -2.01 0.99 -1.64 -0.33 0.00 0.00 177.00 174.11 2kvz s MET 39 N 5.80 3.95 0.02 5.54 -1.94 -1.26 -5.08 119.30 126.33 2kvz s MET 39 Ca 0.68 1.02 0.03 0.00 -1.71 0.00 0.00 55.69 55.71 2kvz s MET 39 Cb -0.16 -2.13 -0.02 0.00 2.01 0.00 0.00 34.83 34.53 2kvz s MET 39 CO 0.29 -0.27 -0.09 0.15 -0.01 0.00 0.00 175.02 175.09 2kvz s LYS 40 N -3.87 0.61 -0.77 2.03 1.02 -1.26 -5.08 119.74 112.42 2kvz s LYS 40 Ca 0.60 -0.55 -0.18 0.00 0.02 0.00 0.00 55.97 55.86 2kvz s LYS 40 Cb -0.10 -0.52 0.14 0.00 -0.52 0.00 0.00 37.83 36.82 2kvz s LYS 40 CO 0.28 0.12 0.88 0.21 -0.92 0.00 0.00 175.35 175.93 2kvz s LYS 41 N -0.92 3.37 0.54 1.68 2.20 -1.26 -4.91 119.74 120.43 2kvz s LYS 41 Ca -0.02 -1.70 -0.19 0.00 -0.36 0.00 0.00 55.97 53.70 2kvz s LYS 41 Cb -0.07 -4.52 -0.06 0.00 -1.51 0.00 0.00 37.83 31.67 2kvz s LYS 41 CO 0.00 -1.59 1.10 0.42 -0.36 0.00 0.00 175.35 174.93 2kvz s ILE 42 N 2.22 3.38 -0.56 5.43 1.01 -1.26 -4.83 121.20 126.59 2kvz s ILE 42 Ca 0.21 0.83 -0.27 0.00 0.00 0.00 0.00 60.65 61.42 2kvz s ILE 42 Cb -0.14 -3.32 -0.09 0.00 0.01 0.00 0.00 42.46 38.91 2kvz s ILE 42 CO -0.02 -0.22 2.45 1.17 0.00 0.00 0.00 174.94 178.32 2kvz n LYS 43 N -1.34 0.91 -0.95 2.79 4.81 -1.26 -0.36 118.16 122.77 2kvz n LYS 43 Ca 0.11 0.01 0.00 0.00 -0.87 0.00 0.00 58.31 57.56 2kvz n LYS 43 Cb 0.52 -3.14 0.00 0.00 0.02 0.00 0.00 35.03 32.42 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 6.09 0.47 3.59 3.14 0.00 -1.26 -5.00 105.19 112.22 2kvz n GLY 44 Ca 0.41 -0.95 -0.24 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.00 2.52 -0.13 1.61 1.51 0.52 -0.38 117.35 120.99 2kvz s TYR 45 Ca 0.00 -0.35 -0.08 0.00 -1.01 0.00 0.00 57.07 55.62 2kvz s TYR 45 Cb 0.00 -1.28 0.04 0.00 -0.11 0.00 0.00 41.96 40.61 2kvz s TYR 45 CO 0.00 0.58 0.32 0.99 -1.11 0.00 0.00 175.55 176.33 2kvz s THR 46 N -2.47 -0.02 -0.08 -0.71 2.01 0.77 -4.49 115.64 110.65 2kvz s THR 46 Ca 0.33 0.08 -0.30 0.00 0.31 0.00 0.00 61.69 62.11 2kvz s THR 46 Cb -0.03 -0.47 -0.08 0.00 0.01 0.00 0.00 72.50 71.93 2kvz s THR 46 CO 0.18 0.03 2.06 -0.11 -0.69 0.00 0.00 174.62 176.10 2kvz n LEU 47 N 3.81 3.69 -0.04 4.42 7.94 -1.26 0.37 117.00 135.93 2kvz n LEU 47 Ca -0.21 0.66 -0.15 0.00 -1.11 0.00 0.00 56.01 55.20 2kvz n LEU 47 Cb 0.55 -1.50 -0.08 0.00 0.53 0.00 0.00 43.42 42.92 2kvz n LEU 47 CO 0.13 -0.17 0.44 0.25 -1.11 0.00 0.00 177.39 176.93 2kvz h LEU 48 N 12.00 0.54 -7.00 -1.96 5.85 -1.67 -3.46 115.31 119.61 2kvz h LEU 48 Ca -0.46 -0.61 0.17 0.00 0.84 0.00 0.00 57.88 57.82 2kvz h LEU 48 Cb 1.25 -0.16 -0.27 0.00 0.37 0.00 0.00 40.66 41.85 2kvz h LEU 48 CO 0.95 1.05 0.77 -0.75 -0.34 0.00 0.00 178.44 180.12 2kvz s LYS 49 N -3.81 0.26 -0.88 1.25 2.20 -1.24 -5.05 119.74 112.46 2kvz s LYS 49 Ca -0.13 0.13 -0.19 0.00 -0.36 0.00 0.00 55.97 55.42 2kvz s LYS 49 Cb 0.05 0.12 0.13 0.00 -1.51 0.00 0.00 37.83 36.63 2kvz s LYS 49 CO 0.80 -0.07 1.05 -0.47 -0.36 0.00 0.00 175.35 176.31 2kvz s TYR 50 N -0.66 3.14 -1.31 4.03 6.14 -1.26 -4.03 117.35 123.39 2kvz s TYR 50 Ca 0.05 -1.36 -0.08 0.00 0.64 0.00 0.00 57.07 56.32 2kvz s TYR 50 Cb -0.02 -4.22 0.14 0.00 0.42 0.00 0.00 41.96 38.28 2kvz s TYR 50 CO -0.07 -1.44 2.07 -3.47 0.64 0.00 0.00 175.55 173.28 2kvz n ASP 51 N 6.37 5.97 -3.58 4.32 2.03 -1.26 -4.82 116.55 125.57 2kvz n ASP 51 Ca 0.19 -3.09 0.04 0.00 0.52 0.00 0.00 54.79 52.44 2kvz n ASP 51 Cb 0.48 -1.46 -0.00 0.00 -0.72 0.00 0.00 41.12 39.43 2kvz n ASP 51 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2kvz s SER 52 N 0.85 -0.01 -0.11 1.67 0.15 -1.26 -4.71 113.70 110.28 2kvz s SER 52 Ca 0.45 -0.03 0.01 0.00 0.70 0.00 0.00 55.95 57.08 2kvz s SER 52 Cb 0.13 0.03 0.02 0.00 -1.71 0.00 0.00 66.02 64.49 2kvz s SER 52 CO -0.03 -0.06 -0.12 -1.61 1.20 0.00 0.00 173.24 172.62 2kvz s GLU 53 N -2.09 1.94 -0.25 5.44 2.02 -1.26 -5.02 118.70 119.48 2kvz s GLU 53 Ca 0.16 -0.44 0.01 0.00 0.02 0.00 0.00 54.97 54.72 2kvz s GLU 53 Cb 0.07 -1.77 0.28 0.00 0.10 0.00 0.00 34.13 32.81 2kvz s GLU 53 CO -0.06 -0.16 1.64 0.44 0.02 0.00 0.00 175.26 177.15 2kvz n ILE 54 N 4.52 2.31 -4.34 -1.63 -5.35 -1.26 -4.85 119.36 108.76 2kvz n ILE 54 Ca -0.17 -1.18 -0.27 0.00 -0.27 0.00 0.00 62.75 60.86 2kvz n ILE 54 Cb 0.51 -0.96 -0.07 0.00 -1.74 0.00 0.00 39.64 37.38 2kvz n ILE 54 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2kvz s LEU 55 N -1.66 2.83 0.00 7.28 1.43 -1.26 -4.78 118.68 122.51 2kvz s LEU 55 Ca 0.29 -1.29 0.00 0.00 -1.03 0.00 0.00 54.13 52.09 2kvz s LEU 55 Cb 0.23 -1.13 0.00 0.00 0.03 0.00 0.00 46.19 45.32 2kvz s LEU 55 CO 0.03 -0.67 0.00 0.61 0.23 0.00 0.00 176.35 176.55 2kvz n GLY 56 N -1.26 -1.01 3.23 -3.19 0.00 -1.26 -5.01 105.19 96.69 2kvz n GLY 56 Ca -0.06 -2.14 -0.17 0.00 0.00 0.00 0.00 46.02 43.65 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 0.00 1.22 0.45 1.61 -7.23 -1.26 -4.18 120.40 111.01 2kvz s VAL 57 Ca 0.00 -1.72 0.16 0.00 -1.81 0.00 0.00 61.98 58.61 2kvz s VAL 57 Cb 0.00 -1.51 0.34 0.00 0.56 0.00 0.00 36.38 35.78 2kvz s VAL 57 CO 0.00 -0.47 1.97 -0.26 -0.31 0.00 0.00 175.10 176.02 2kvz h PHE 58 N 3.48 0.38 0.00 2.82 -1.00 -1.29 -3.46 116.94 117.86 2kvz h PHE 58 Ca -0.39 0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.40 2kvz h PHE 58 Cb 1.19 -0.12 0.00 0.00 3.61 0.00 0.00 35.95 40.63 2kvz h PHE 58 CO 0.65 0.17 0.00 2.41 -1.61 0.00 0.00 178.31 179.93 2kvz n THR 59 N -4.46 0.00 -1.45 -1.55 -1.04 -1.26 -2.68 114.28 101.83 2kvz n THR 59 Ca 0.11 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.18 2kvz n THR 59 Cb 0.44 0.00 0.10 0.00 -1.82 0.00 0.00 70.33 69.05 2kvz n THR 59 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2kvz n GLU 60 N 14.00 0.87 -4.34 -2.82 -0.58 -1.26 -3.72 120.64 122.78 2kvz n GLU 60 Ca 0.00 -2.14 -0.29 0.00 -0.42 0.00 0.00 57.16 54.31 2kvz n GLU 60 Cb 0.00 -1.15 -0.17 0.00 -0.57 0.00 0.00 31.44 29.56 2kvz n GLU 60 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2kvz s SER 61 N -2.31 2.56 -0.38 1.62 0.01 -1.09 -5.08 113.70 109.04 2kvz s SER 61 Ca 0.23 -0.46 -0.27 0.00 1.31 0.00 0.00 55.95 56.76 2kvz s SER 61 Cb 0.21 -1.14 -0.05 0.00 0.21 0.00 0.00 66.02 65.25 2kvz s SER 61 CO 0.00 -0.00 2.19 -2.84 0.41 0.00 0.00 173.24 173.00 2kvz s PRO 62 N 1.13 2.72 0.51 12.44 0.02 -1.26 -4.92 135.00 145.64 2kvz s PRO 62 Ca -0.03 1.56 -0.04 0.00 0.02 0.00 0.00 61.00 62.51 2kvz s PRO 62 Cb -0.14 -4.43 -0.02 0.00 0.02 0.00 0.00 34.50 29.93 2kvz s PRO 62 CO -0.04 -2.58 0.80 -0.65 -0.33 0.00 0.00 177.00 174.19 2kvz s GLN 63 N 7.04 3.25 -0.09 5.54 -0.21 -1.26 -4.88 119.66 129.05 2kvz s GLN 63 Ca 0.93 -0.01 -0.00 0.00 0.02 0.00 0.00 55.36 56.30 2kvz s GLN 63 Cb -0.23 -2.38 0.02 0.00 1.00 0.00 0.00 33.01 31.42 2kvz s GLN 63 CO 0.30 -0.37 -0.07 0.99 -2.12 0.00 0.00 175.29 174.02 2kvz s THR 64 N -2.78 0.90 -0.34 -0.19 2.01 -1.26 0.45 115.64 114.43 2kvz s THR 64 Ca 0.49 -0.24 -0.12 0.00 0.31 0.00 0.00 61.69 62.14 2kvz s THR 64 Cb -0.10 -0.92 -0.01 0.00 0.01 0.00 0.00 72.50 71.47 2kvz s THR 64 CO 0.43 0.34 0.22 -0.63 -0.69 0.00 0.00 174.62 174.29 2kvz s ILE 65 N 1.51 5.06 -0.48 1.82 -1.09 0.11 -4.96 121.20 123.18 2kvz s ILE 65 Ca 0.00 -0.31 -0.23 0.00 -2.23 0.00 0.00 60.65 57.88 2kvz s ILE 65 Cb -0.13 -3.61 0.03 0.00 -1.58 0.00 0.00 42.46 37.17 2kvz s ILE 65 CO -0.05 -0.01 0.81 0.20 -1.23 0.00 0.00 174.94 174.66 2kvz s ASN 66 N 1.68 6.37 -0.34 3.58 0.01 -1.26 -0.27 114.94 124.72 2kvz s ASN 66 Ca 0.05 -0.25 -0.07 0.00 -0.71 0.00 0.00 52.86 51.89 2kvz s ASN 66 Cb -0.17 -2.39 0.04 0.00 0.41 0.00 0.00 41.25 39.13 2kvz s ASN 66 CO 0.09 -1.00 0.11 -0.63 -1.51 0.00 0.00 177.10 174.16 2kvz s ILE 67 N 3.40 3.82 -0.33 0.60 1.01 0.10 -4.29 121.20 125.51 2kvz s ILE 67 Ca 0.29 -1.11 -0.17 0.00 0.00 0.00 0.00 60.65 59.66 2kvz s ILE 67 Cb -0.13 -3.16 -0.01 0.00 0.01 0.00 0.00 42.46 39.17 2kvz s ILE 67 CO 0.21 -0.18 0.45 -0.63 0.00 0.00 0.00 174.94 174.79 2kvz s ILE 68 N 1.41 5.08 0.07 2.92 1.01 -1.26 0.41 121.20 130.85 2kvz s ILE 68 Ca -0.01 0.32 0.03 0.00 0.00 0.00 0.00 60.65 60.98 2kvz s ILE 68 Cb -0.19 -3.88 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 2kvz s ILE 68 CO 0.03 -0.12 0.08 -0.31 0.00 0.00 0.00 174.94 174.62 2kvz s TYR 69 N 2.24 3.20 -0.15 3.97 1.51 -0.21 -1.87 117.35 126.04 2kvz s TYR 69 Ca 0.16 0.09 -0.00 0.00 -1.01 0.00 0.00 57.07 56.31 2kvz s TYR 69 Cb -0.16 -1.63 -0.00 0.00 -0.11 0.00 0.00 41.96 40.05 2kvz s TYR 69 CO 0.12 0.52 -0.14 -1.14 -1.11 0.00 0.00 175.55 173.80 2kvz s GLN 70 N -2.30 3.26 0.18 -0.62 0.74 0.16 -2.29 119.66 118.78 2kvz s GLN 70 Ca 0.28 -0.73 -0.30 0.00 0.05 0.00 0.00 55.36 54.66 2kvz s GLN 70 Cb -0.12 -2.65 -0.08 0.00 1.10 0.00 0.00 33.01 31.25 2kvz s GLN 70 CO 0.21 0.04 1.28 0.21 -0.55 0.00 0.00 175.29 176.48 2kvz s LYS 71 N 0.78 4.41 -1.23 1.67 2.20 -1.26 -0.16 119.74 126.14 2kvz s LYS 71 Ca -0.05 2.00 -0.18 0.00 -0.36 0.00 0.00 55.97 57.37 2kvz s LYS 71 Cb -0.15 -3.22 -0.01 0.00 -1.51 0.00 0.00 37.83 32.94 2kvz s LYS 71 CO 0.01 -0.24 1.98 1.63 -0.36 0.00 0.00 175.35 178.37 2kvz n LYS 72 N 2.83 2.50 -1.97 4.03 5.02 0.48 -4.90 118.16 126.14 2kvz n LYS 72 Ca 0.06 -2.64 -0.41 0.00 -2.02 0.00 0.00 58.31 53.30 2kvz n LYS 72 Cb 0.43 -3.35 -0.02 0.00 -0.02 0.00 0.00 35.03 32.07 2kvz n LYS 72 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2kvz s ALA 73 N 5.10 3.64 -0.25 7.82 0.00 -1.26 -4.87 121.76 131.93 2kvz s ALA 73 Ca 0.55 1.37 -0.37 0.00 0.00 0.00 0.00 51.96 53.51 2kvz s ALA 73 Cb 0.09 -3.57 -0.13 0.00 0.00 0.00 0.00 23.12 19.50 2kvz s ALA 73 CO 0.04 -0.79 1.93 -2.30 0.00 0.00 0.00 175.76 174.64 2kvz n PRO 74 N 2.25 1.39 -0.06 0.00 -0.02 -1.26 -4.85 135.00 132.44 2kvz n PRO 74 Ca 0.07 0.48 -0.13 0.00 -2.02 0.00 0.00 63.50 61.90 2kvz n PRO 74 Cb 0.40 -2.35 -0.00 0.00 -0.02 0.00 0.00 33.50 31.52 2kvz n PRO 74 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2kvz h GLU 75 N 9.38 0.80 -6.27 -0.52 5.08 -2.02 -3.36 114.58 117.66 2kvz h GLU 75 Ca -0.41 -0.47 -0.53 0.00 -1.00 0.00 0.00 59.36 56.95 2kvz h GLU 75 Cb 1.31 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.54 2kvz h GLU 75 CO 0.98 1.10 1.16 -0.65 -1.00 0.00 0.00 179.01 180.60 2kvz s GLN 76 N -4.18 3.09 0.15 2.33 -0.21 -1.26 -4.97 119.66 114.61 2kvz s GLN 76 Ca -0.10 0.33 0.01 0.00 0.02 0.00 0.00 55.36 55.62 2kvz s GLN 76 Cb 0.11 -4.21 0.01 0.00 1.00 0.00 0.00 33.01 29.92 2kvz s GLN 76 CO 0.87 -2.21 0.08 0.00 -2.12 0.00 0.00 175.29 171.92 2kvz n ALA 77 N 10.40 0.21 1.33 6.09 0.00 -1.26 -5.01 120.51 132.27 2kvz n ALA 77 Ca 0.12 -0.64 0.05 0.00 0.00 0.00 0.00 53.44 52.97 2kvz n ALA 77 Cb 0.50 0.29 0.17 0.00 0.00 0.00 0.00 19.45 20.41 2kvz n ALA 77 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2kvz n LEU 78 N 0.00 1.18 -4.03 0.00 4.77 -1.26 -4.83 117.00 112.83 2kvz n LEU 78 Ca -0.02 -0.57 -0.09 0.00 -0.03 0.00 0.00 56.01 55.29 2kvz n LEU 78 Cb 0.18 -0.13 -0.08 0.00 -2.33 0.00 0.00 43.42 41.05 2kvz n LEU 78 CO 0.10 0.29 -0.16 -0.70 -1.33 0.00 0.00 177.39 175.59 2kvz s GLU 79 N -1.73 1.00 0.29 3.23 2.12 -1.26 -5.04 118.70 117.31 2kvz s GLU 79 Ca 0.19 -1.26 0.25 0.00 0.36 0.00 0.00 54.97 54.51 2kvz s GLU 79 Cb 0.10 0.31 0.96 0.00 0.26 0.00 0.00 34.13 35.75 2kvz s GLU 79 CO 0.13 -0.32 1.76 0.45 -0.54 0.00 0.00 175.26 176.74 2kvz h HIS 80 N 2.73 0.00 -4.10 5.30 3.86 -1.98 -3.44 115.15 117.52 2kvz h HIS 80 Ca -0.33 0.00 -0.28 0.00 -1.16 0.00 0.00 60.37 58.60 2kvz h HIS 80 Cb 1.21 0.00 -0.15 0.00 1.06 0.00 0.00 27.41 29.53 2kvz h HIS 80 CO 0.42 0.00 -0.63 -1.01 0.86 0.00 0.00 177.93 177.57 2kvz s HIS 81 N -3.30 1.24 -0.14 2.45 3.76 -1.26 -5.05 115.29 112.99 2kvz s HIS 81 Ca 0.06 -1.20 -0.07 0.00 -0.15 0.00 0.00 55.06 53.69 2kvz s HIS 81 Cb 0.10 -0.69 -0.04 0.00 1.11 0.00 0.00 32.58 33.06 2kvz s HIS 81 CO 0.48 -0.42 0.11 -1.01 -0.85 0.00 0.00 174.74 173.05 2kvz s HIS 82 N -3.89 3.44 -1.14 1.40 0.09 -1.26 -4.91 115.29 109.02 2kvz s HIS 82 Ca 0.32 0.37 -0.22 0.00 -0.00 0.00 0.00 55.06 55.54 2kvz s HIS 82 Cb 0.07 -1.99 -0.01 0.00 -0.00 0.00 0.00 32.58 30.66 2kvz s HIS 82 CO 0.09 0.52 1.79 -1.01 -0.00 0.00 0.00 174.74 176.13 2kvz s HIS 83 N -0.50 2.29 0.00 1.40 3.76 -1.26 -1.26 115.29 119.72 2kvz s HIS 83 Ca 0.11 -0.39 0.00 0.00 -0.15 0.00 0.00 55.06 54.63 2kvz s HIS 83 Cb -0.12 -4.37 0.00 0.00 1.11 0.00 0.00 32.58 29.20 2kvz s HIS 83 CO 0.02 -1.61 0.00 1.58 -0.85 0.00 0.00 174.74 173.87 2kvz n HIS 84 N 11.47 0.00 -1.83 1.40 -0.00 -1.26 -5.31 115.22 119.70 2kvz n HIS 84 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.15 2kvz n HIS 84 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.46 2kvz n HIS 84 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06