#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kzr s ARG 2 N 0.00 3.16 -0.01 -0.99 0.52 -1.26 -2.53 118.95 117.83 2kzr s ARG 2 Ca 0.00 -0.93 0.01 0.00 -0.52 0.00 0.00 55.73 54.29 2kzr s ARG 2 Cb 0.00 -2.72 0.01 0.00 0.52 0.00 0.00 34.95 32.76 2kzr s ARG 2 CO 0.00 0.39 -0.02 0.08 0.02 0.00 0.00 175.30 175.77 2kzr s VAL 3 N -2.07 0.18 -0.61 3.52 1.01 -0.65 -1.12 120.40 120.65 2kzr s VAL 3 Ca 0.34 -0.04 -0.11 0.00 0.00 0.00 0.00 61.98 62.18 2kzr s VAL 3 Cb -0.08 -0.19 0.16 0.00 0.00 0.00 0.00 36.38 36.26 2kzr s VAL 3 CO 0.27 0.08 0.50 -0.13 0.00 0.00 0.00 175.10 175.83 2kzr s ARG 4 N 0.29 2.89 -0.64 2.72 0.52 -0.42 -0.96 118.95 123.34 2kzr s ARG 4 Ca -0.03 -2.09 -0.25 0.00 -0.52 0.00 0.00 55.73 52.85 2kzr s ARG 4 Cb -0.05 -4.09 0.05 0.00 0.52 0.00 0.00 34.95 31.37 2kzr s ARG 4 CO -0.01 -1.24 1.08 0.00 0.02 0.00 0.00 175.30 175.16 2kzr s LYS 6 N 4.65 3.21 -0.31 0.00 2.47 -0.43 -2.02 119.74 127.31 2kzr s LYS 6 Ca 0.31 -0.30 0.03 0.00 -1.56 0.00 0.00 55.97 54.44 2kzr s LYS 6 Cb -0.12 -4.30 0.09 0.00 -1.46 0.00 0.00 37.83 32.04 2kzr s LYS 6 CO 0.16 -2.17 0.03 0.00 0.16 0.00 0.00 175.35 173.53 2kzr s ALA 7 N 5.75 2.52 -1.92 3.13 0.00 -0.90 -0.61 121.76 129.73 2kzr s ALA 7 Ca 0.37 -2.16 0.00 0.00 0.00 0.00 0.00 51.96 50.16 2kzr s ALA 7 Cb -0.07 -1.80 0.00 0.00 0.00 0.00 0.00 23.12 21.24 2kzr s ALA 7 CO 0.13 -1.57 0.00 1.63 0.00 0.00 0.00 175.76 175.95 2kzr n LYS 8 N 4.42 -1.58 0.00 0.00 5.02 -1.26 -1.07 118.16 123.70 2kzr n LYS 8 Ca -0.01 1.08 0.00 0.00 -2.02 0.00 0.00 58.31 57.36 2kzr n LYS 8 Cb 0.42 -5.64 0.00 0.00 -0.02 0.00 0.00 35.03 29.79 2kzr n LYS 8 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2kzr n GLY 9 N -0.82 2.78 3.55 0.72 0.00 -1.26 -5.03 105.19 105.13 2kzr n GLY 9 Ca -0.23 -0.38 -0.40 0.00 0.00 0.00 0.00 46.02 45.01 2kzr n GLY 9 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2kzr s GLY 10 N -1.91 0.68 -0.08 -0.02 0.00 -0.23 -5.00 107.32 100.76 2kzr s GLY 10 Ca 0.00 -1.23 -0.26 0.00 0.00 0.00 0.00 44.72 43.23 2kzr s GLY 10 CO 0.00 2.90 0.84 -1.59 0.00 0.00 0.00 173.10 175.26 2kzr s THR 11 N 6.81 4.93 0.06 0.90 2.01 -1.26 -2.11 115.64 126.98 2kzr s THR 11 Ca 0.46 1.72 0.05 0.00 0.31 0.00 0.00 61.69 64.23 2kzr s THR 11 Cb -0.09 -4.17 -0.03 0.00 0.01 0.00 0.00 72.50 68.23 2kzr s THR 11 CO 0.14 0.14 -0.13 -1.00 -0.69 0.00 0.00 174.62 173.08 2kzr s HIS 12 N 1.36 1.13 -0.37 4.92 3.76 -0.85 -4.94 115.29 120.29 2kzr s HIS 12 Ca 0.43 -0.45 -0.15 0.00 -0.15 0.00 0.00 55.06 54.74 2kzr s HIS 12 Cb -0.18 -0.64 -0.00 0.00 1.11 0.00 0.00 32.58 32.86 2kzr s HIS 12 CO 0.19 0.03 0.31 -1.17 -0.85 0.00 0.00 174.74 173.26 2kzr s LEU 13 N -1.62 4.67 -0.14 0.89 1.98 -1.26 -1.13 118.68 122.08 2kzr s LEU 13 Ca -0.03 -0.51 -0.21 0.00 -2.89 0.00 0.00 54.13 50.50 2kzr s LEU 13 Cb -0.10 -2.23 -0.03 0.00 0.66 0.00 0.00 46.19 44.49 2kzr s LEU 13 CO 0.02 -0.36 0.59 -0.76 -1.89 0.00 0.00 176.35 173.95 2kzr s LEU 14 N 1.85 4.23 0.28 -0.68 1.02 -0.13 -4.96 118.68 120.29 2kzr s LEU 14 Ca 0.08 0.91 0.09 0.00 0.02 0.00 0.00 54.13 55.23 2kzr s LEU 14 Cb -0.17 -2.87 -0.04 0.00 0.02 0.00 0.00 46.19 43.13 2kzr s LEU 14 CO 0.11 -0.14 0.07 -1.10 0.02 0.00 0.00 176.35 175.32 2kzr s GLN 15 N 1.17 2.43 0.00 1.70 1.11 -1.26 -1.63 119.66 123.18 2kzr s GLN 15 Ca 0.30 -1.39 0.00 0.00 0.01 0.00 0.00 55.36 54.28 2kzr s GLN 15 Cb -0.16 -2.24 0.00 0.00 -1.01 0.00 0.00 33.01 29.60 2kzr s GLN 15 CO 0.12 0.30 0.00 0.41 0.01 0.00 0.00 175.29 176.13 2kzr n GLY 16 N -1.02 0.82 3.58 3.09 0.00 -1.24 -5.04 105.19 105.38 2kzr n GLY 16 Ca -0.06 -0.63 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 2kzr n GLY 16 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2kzr s LEU 17 N -0.28 4.23 0.53 0.99 2.01 -1.05 -4.95 118.68 120.15 2kzr s LEU 17 Ca 0.00 0.20 -0.01 0.00 0.01 0.00 0.00 54.13 54.33 2kzr s LEU 17 Cb 0.00 -2.68 0.01 0.00 0.01 0.00 0.00 46.19 43.53 2kzr s LEU 17 CO 0.00 -0.46 0.77 -0.44 1.01 0.00 0.00 176.35 177.23 2kzr s SER 18 N 1.70 5.54 0.51 2.29 0.01 -1.26 -0.10 113.70 122.39 2kzr s SER 18 Ca 0.22 0.29 0.26 0.00 1.31 0.00 0.00 55.95 58.02 2kzr s SER 18 Cb -0.15 -1.33 1.38 0.00 0.21 0.00 0.00 66.02 66.12 2kzr s SER 18 CO 0.13 -0.97 2.06 0.28 0.41 0.00 0.00 173.24 175.14 2kzr h SER 19 N 0.12 0.00 -0.17 2.44 0.02 -1.99 -2.78 113.55 111.19 2kzr h SER 19 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2kzr h SER 19 Cb 1.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.81 2kzr h SER 19 CO 0.57 0.13 0.00 -2.11 -1.14 0.00 0.00 176.83 174.28 2kzr n ARG 20 N -3.73 1.93 -1.65 3.45 1.85 -1.26 -3.75 116.66 113.49 2kzr n ARG 20 Ca -0.02 -1.38 -0.44 0.00 -1.00 0.00 0.00 57.85 55.01 2kzr n ARG 20 Cb 0.24 -1.44 -0.03 0.00 -1.05 0.00 0.00 32.46 30.18 2kzr n ARG 20 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2kzr n THR 21 N 0.62 0.67 -2.12 8.89 -1.04 -1.05 -4.68 114.28 115.57 2kzr n THR 21 Ca 0.17 -0.17 -0.17 0.00 -2.04 0.00 0.00 64.05 61.84 2kzr n THR 21 Cb 0.41 -2.24 0.10 0.00 -1.82 0.00 0.00 70.33 66.78 2kzr n THR 21 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2kzr n ARG 22 N 7.52 -0.28 0.27 -2.82 1.74 -1.26 -1.99 116.66 119.84 2kzr n ARG 22 Ca 0.22 -1.61 -0.17 0.00 -0.77 0.00 0.00 57.85 55.53 2kzr n ARG 22 Cb 0.38 -0.63 -0.09 0.00 -1.02 0.00 0.00 32.46 31.10 2kzr n ARG 22 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2kzr h LEU 23 N 0.00 -1.29 -2.21 0.55 6.46 -0.97 -0.47 115.31 117.37 2kzr h LEU 23 Ca -0.25 0.10 0.05 0.00 -0.12 0.00 0.00 57.88 57.67 2kzr h LEU 23 Cb 0.79 0.43 -0.01 0.00 -0.73 0.00 0.00 40.66 41.14 2kzr h LEU 23 CO 0.22 -0.62 0.25 0.08 -0.62 0.00 0.00 178.44 177.75 2kzr h ARG 24 N -0.93 0.00 0.00 1.25 0.11 -1.86 0.14 114.38 113.09 2kzr h ARG 24 Ca -0.06 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 59.89 2kzr h ARG 24 Cb 0.81 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.87 2kzr h ARG 24 CO -0.06 0.00 -0.87 0.93 0.10 0.00 0.00 179.97 180.07 2kzr h GLU 25 N 0.00 0.00 0.27 0.08 4.39 -1.84 -3.20 114.58 114.29 2kzr h GLU 25 Ca 0.09 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.78 2kzr h GLU 25 Cb 0.58 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 2kzr h GLU 25 CO -0.00 0.61 -0.13 1.25 -1.16 0.00 0.00 179.01 179.58 2kzr h LEU 26 N -1.00 -0.31 -1.80 1.33 7.12 -0.65 -0.32 115.31 119.68 2kzr h LEU 26 Ca -0.19 0.01 0.00 0.00 0.13 0.00 0.00 57.88 57.83 2kzr h LEU 26 Cb 0.95 0.08 0.00 0.00 -0.53 0.00 0.00 40.66 41.16 2kzr h LEU 26 CO -0.12 -0.15 0.00 1.56 -0.13 0.00 0.00 178.44 179.61 2kzr h GLN 27 N -0.52 0.00 -0.19 1.25 4.20 -1.19 -1.68 115.11 116.98 2kzr h GLN 27 Ca -0.04 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.49 2kzr h GLN 27 Cb 0.28 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.06 2kzr h GLN 27 CO 0.06 0.00 -0.61 0.78 -0.67 0.00 0.00 178.83 178.39 2kzr h GLY 28 N 1.33 0.72 1.24 3.46 0.00 -1.51 -2.00 103.07 106.31 2kzr h GLY 28 Ca 0.00 -0.89 -0.17 0.00 0.00 0.00 0.00 47.33 46.27 2kzr h GLY 28 CO 0.00 0.80 -0.50 1.46 0.00 0.00 0.00 176.54 178.30 2kzr h GLN 29 N 0.49 0.80 -0.88 4.80 4.20 -0.17 -3.07 115.11 121.28 2kzr h GLN 29 Ca -0.01 -0.48 0.01 0.00 0.06 0.00 0.00 58.65 58.23 2kzr h GLN 29 Cb 1.19 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.97 2kzr h GLN 29 CO 0.12 1.11 0.58 0.82 -0.67 0.00 0.00 178.83 180.80 2kzr h ILE 30 N 0.63 1.22 0.00 2.54 2.04 -1.37 0.16 117.51 122.73 2kzr h ILE 30 Ca 0.03 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 2kzr h ILE 30 Cb 1.08 -0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.09 2kzr h ILE 30 CO 0.11 0.22 -0.03 0.00 0.00 0.00 0.00 178.15 178.44 2kzr h ALA 31 N 1.45 1.41 0.05 1.87 0.00 -1.27 -1.65 119.26 121.13 2kzr h ALA 31 Ca 0.33 -0.03 -0.34 0.00 0.00 0.00 0.00 54.91 54.86 2kzr h ALA 31 Cb -0.12 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 2kzr h ALA 31 CO -0.07 0.04 -2.00 0.00 0.00 0.00 0.00 179.25 177.22 2kzr n ALA 32 N -2.29 1.22 0.02 0.00 0.00 -0.48 -3.46 120.51 115.53 2kzr n ALA 32 Ca -0.03 -0.79 -0.01 0.00 0.00 0.00 0.00 53.44 52.61 2kzr n ALA 32 Cb 0.13 -0.62 -0.01 0.00 0.00 0.00 0.00 19.45 18.95 2kzr n ALA 32 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2kzr h ILE 33 N 0.03 0.00 0.00 0.00 1.08 -0.32 -3.39 117.51 114.91 2kzr h ILE 33 Ca -0.41 -0.08 0.00 0.00 -0.39 0.00 0.00 64.86 63.98 2kzr h ILE 33 Cb 2.03 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.78 2kzr h ILE 33 CO 0.06 0.00 -1.33 1.07 -0.69 0.00 0.00 178.15 177.26 2kzr n THR 34 N -2.41 0.14 -0.66 -0.27 5.66 -0.66 -4.98 114.28 111.09 2kzr n THR 34 Ca -0.01 -0.32 0.00 0.00 -3.05 0.00 0.00 64.05 60.67 2kzr n THR 34 Cb 0.03 0.20 0.00 0.00 -1.55 0.00 0.00 70.33 69.01 2kzr n THR 34 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2kzr n GLY 35 N 1.33 0.66 3.57 1.09 0.00 -1.01 -5.03 105.19 105.81 2kzr n GLY 35 Ca 0.00 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 2kzr n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2kzr s ILE 36 N -2.00 4.58 0.47 -0.61 -1.09 -1.25 -4.91 121.20 116.39 2kzr s ILE 36 Ca 0.00 0.82 -0.24 0.00 -2.23 0.00 0.00 60.65 59.00 2kzr s ILE 36 Cb 0.00 -4.35 -0.08 0.00 -1.58 0.00 0.00 42.46 36.45 2kzr s ILE 36 CO 0.00 -0.67 1.22 0.00 -1.23 0.00 0.00 174.94 174.26 2kzr n ALA 37 N 6.85 1.09 0.27 9.38 0.00 -1.26 -3.33 120.51 133.51 2kzr n ALA 37 Ca 0.05 0.19 0.16 0.00 0.00 0.00 0.00 53.44 53.85 2kzr n ALA 37 Cb 0.48 -2.24 0.91 0.00 0.00 0.00 0.00 19.45 18.60 2kzr n ALA 37 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2kzr h PRO 38 N 1.67 0.00 -0.82 0.00 0.13 -1.92 0.39 132.00 131.46 2kzr h PRO 38 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2kzr h PRO 38 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2kzr h PRO 38 CO 0.58 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.76 2kzr n GLY 39 N -1.33 2.06 0.00 1.56 0.00 -1.26 -3.43 105.19 102.79 2kzr n GLY 39 Ca -0.01 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2kzr n GLY 39 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2kzr n SER 40 N 0.25 0.41 -3.98 1.61 7.64 0.13 -4.81 113.62 114.87 2kzr n SER 40 Ca 0.11 -1.19 -0.09 0.00 1.01 0.00 0.00 58.87 58.72 2kzr n SER 40 Cb 0.62 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.74 2kzr n SER 40 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kzr s GLN 41 N -0.19 0.88 0.13 1.43 -2.07 -1.21 -0.95 119.66 117.67 2kzr s GLN 41 Ca 0.00 -1.14 0.01 0.00 -1.82 0.00 0.00 55.36 52.41 2kzr s GLN 41 Cb 0.00 0.31 -0.00 0.00 -1.09 0.00 0.00 33.01 32.22 2kzr s GLN 41 CO 0.00 -0.27 0.04 0.54 -1.32 0.00 0.00 175.29 174.28 2kzr n ARG 42 N -0.06 0.92 -3.80 9.60 1.74 -1.26 -4.90 116.66 118.90 2kzr n ARG 42 Ca -0.11 -1.05 -0.36 0.00 -0.77 0.00 0.00 57.85 55.55 2kzr n ARG 42 Cb 0.62 0.54 -0.12 0.00 -1.02 0.00 0.00 32.46 32.48 2kzr n ARG 42 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2kzr s ILE 43 N -1.95 3.38 -0.08 0.55 -1.09 -0.98 -4.63 121.20 116.40 2kzr s ILE 43 Ca 0.06 -1.52 0.03 0.00 -2.23 0.00 0.00 60.65 56.99 2kzr s ILE 43 Cb 0.00 -3.06 -0.02 0.00 -1.58 0.00 0.00 42.46 37.81 2kzr s ILE 43 CO 0.04 -0.33 -0.17 -0.76 -1.23 0.00 0.00 174.94 172.49 2kzr s LEU 44 N 1.27 2.51 0.49 2.97 1.43 -1.25 -3.01 118.68 123.09 2kzr s LEU 44 Ca 0.00 -0.35 0.06 0.00 -1.03 0.00 0.00 54.13 52.81 2kzr s LEU 44 Cb -0.21 -1.52 0.00 0.00 0.03 0.00 0.00 46.19 44.49 2kzr s LEU 44 CO -0.01 0.24 0.29 0.68 0.23 0.00 0.00 176.35 177.79 2kzr s VAL 45 N -0.12 1.89 0.21 -1.59 -7.23 -1.25 -0.70 120.40 111.61 2kzr s VAL 45 Ca -0.03 -1.59 -0.08 0.00 -1.81 0.00 0.00 61.98 58.47 2kzr s VAL 45 Cb -0.14 -2.48 0.15 0.00 0.56 0.00 0.00 36.38 34.48 2kzr s VAL 45 CO 0.04 0.00 1.77 1.23 -0.31 0.00 0.00 175.10 177.83 2kzr h GLY 46 N 1.04 0.95 -1.75 2.32 0.00 -1.84 -3.43 103.07 100.36 2kzr h GLY 46 Ca -0.40 -0.18 -0.48 0.00 0.00 0.00 0.00 47.33 46.27 2kzr h GLY 46 CO 0.63 0.04 0.14 -2.52 0.00 0.00 0.00 176.54 174.83 2kzr s TYR 47 N -6.08 3.34 -0.49 5.60 -0.85 -1.26 -4.99 117.35 112.63 2kzr s TYR 47 Ca -0.13 0.67 -0.38 0.00 -0.52 0.00 0.00 57.07 56.71 2kzr s TYR 47 Cb 0.17 -2.58 -0.15 0.00 0.38 0.00 0.00 41.96 39.78 2kzr s TYR 47 CO 0.75 -0.63 2.23 -2.30 -1.52 0.00 0.00 175.55 174.08 2kzr n PRO 48 N -2.46 0.51 -2.14 -3.49 -0.02 -1.26 -4.96 135.00 121.18 2kzr n PRO 48 Ca 0.03 0.13 -0.27 0.00 -2.02 0.00 0.00 63.50 61.37 2kzr n PRO 48 Cb 0.57 -2.00 0.10 0.00 -0.02 0.00 0.00 33.50 32.15 2kzr n PRO 48 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2kzr s PRO 49 N 6.51 1.79 -0.05 0.52 0.05 -1.26 -5.01 135.00 137.55 2kzr s PRO 49 Ca 1.16 -0.32 0.20 0.00 0.05 0.00 0.00 61.00 62.09 2kzr s PRO 49 Cb -1.14 -2.09 0.64 0.00 0.05 0.00 0.00 34.50 31.97 2kzr s PRO 49 CO 0.55 -1.56 1.55 0.39 0.05 0.00 0.00 177.00 177.98 2kzr n GLU 50 N -3.15 3.13 -2.91 4.56 -0.58 -1.26 -4.99 120.64 115.45 2kzr n GLU 50 Ca 0.10 -2.70 -0.08 0.00 -0.42 0.00 0.00 57.16 54.06 2kzr n GLU 50 Cb 0.60 -1.67 0.01 0.00 -0.57 0.00 0.00 31.44 29.81 2kzr n GLU 50 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2kzr s LEU 52 N -2.11 3.31 -0.82 0.00 1.43 -1.17 -4.95 118.68 114.37 2kzr s LEU 52 Ca 0.16 -0.89 -0.24 0.00 -1.03 0.00 0.00 54.13 52.13 2kzr s LEU 52 Cb -0.04 -2.56 0.06 0.00 0.03 0.00 0.00 46.19 43.68 2kzr s LEU 52 CO 0.72 -1.71 1.23 -1.81 0.23 0.00 0.00 176.35 175.00 2kzr s ASP 53 N 4.43 6.31 -0.54 2.29 1.11 -1.26 -2.32 116.67 126.69 2kzr s ASP 53 Ca 0.41 -1.05 -0.27 0.00 0.18 0.00 0.00 52.55 51.82 2kzr s ASP 53 Cb -0.04 -2.51 -0.02 0.00 1.07 0.00 0.00 42.92 41.42 2kzr s ASP 53 CO 0.04 -1.56 1.81 -0.76 1.18 0.00 0.00 175.17 175.88 2kzr s LEU 54 N 4.74 3.35 -0.09 1.23 1.02 -1.26 -4.84 118.68 122.84 2kzr s LEU 54 Ca 0.34 0.57 -0.01 0.00 0.02 0.00 0.00 54.13 55.05 2kzr s LEU 54 Cb -0.08 -2.81 -0.26 0.00 0.02 0.00 0.00 46.19 43.06 2kzr s LEU 54 CO 0.04 -2.17 0.50 0.77 0.02 0.00 0.00 176.35 175.52 2kzr h SER 55 N 14.18 0.31 -3.27 2.29 4.64 -2.01 -3.47 113.55 126.23 2kzr h SER 55 Ca -0.28 -0.66 -0.59 0.00 -0.47 0.00 0.00 61.79 59.79 2kzr h SER 55 Cb 1.16 -0.10 -0.10 0.00 -0.31 0.00 0.00 62.40 63.05 2kzr h SER 55 CO 1.17 1.59 -0.32 -0.62 -0.87 0.00 0.00 176.83 177.78 2kzr s ASP 56 N -6.79 6.46 0.45 4.97 2.15 -1.26 -5.00 116.67 117.66 2kzr s ASP 56 Ca -0.16 0.54 0.20 0.00 0.43 0.00 0.00 52.55 53.55 2kzr s ASP 56 Cb 0.07 -2.19 1.07 0.00 -0.30 0.00 0.00 42.92 41.58 2kzr s ASP 56 CO 0.80 0.11 1.95 0.08 -0.17 0.00 0.00 175.17 177.94 2kzr h ARG 57 N 6.56 0.00 -0.01 4.34 -0.00 -1.99 -3.02 114.38 120.26 2kzr h ARG 57 Ca -0.42 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.56 2kzr h ARG 57 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.14 2kzr h ARG 57 CO 0.75 0.23 -0.18 -3.47 -0.00 0.00 0.00 179.97 177.30 2kzr n ASP 58 N -3.90 1.55 -4.70 0.08 2.03 -1.26 -2.65 116.55 107.71 2kzr n ASP 58 Ca -0.02 -1.31 -0.42 0.00 0.52 0.00 0.00 54.79 53.56 2kzr n ASP 58 Cb 0.31 0.13 -0.03 0.00 -0.72 0.00 0.00 41.12 40.81 2kzr n ASP 58 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2kzr s ILE 59 N -2.28 3.18 0.56 5.18 2.07 -1.14 -4.75 121.20 124.02 2kzr s ILE 59 Ca 0.28 0.74 0.08 0.00 -1.41 0.00 0.00 60.65 60.34 2kzr s ILE 59 Cb 0.20 -3.47 0.08 0.00 0.13 0.00 0.00 42.46 39.39 2kzr s ILE 59 CO 0.44 0.02 0.77 0.42 -1.91 0.00 0.00 174.94 174.69 2kzr s THR 60 N 1.91 2.29 -1.01 4.00 -4.23 -1.26 -1.35 115.64 115.98 2kzr s THR 60 Ca 0.68 -0.96 0.15 0.00 -1.18 0.00 0.00 61.69 60.38 2kzr s THR 60 Cb -0.38 -2.33 0.13 0.00 1.34 0.00 0.00 72.50 71.26 2kzr s THR 60 CO 0.30 0.00 1.47 0.18 -0.54 0.00 0.00 174.62 176.03 2kzr n LEU 61 N -2.23 0.00 0.22 4.79 4.77 -0.84 -1.71 117.00 122.00 2kzr n LEU 61 Ca 0.14 0.49 0.08 0.00 -0.03 0.00 0.00 56.01 56.70 2kzr n LEU 61 Cb 0.61 -0.49 0.50 0.00 -2.33 0.00 0.00 43.42 41.71 2kzr n LEU 61 CO 0.40 -0.24 0.81 1.23 -1.33 0.00 0.00 177.39 178.26 2kzr h GLY 62 N 2.55 0.00 0.00 -0.72 0.00 -1.89 -3.34 103.07 99.68 2kzr h GLY 62 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.05 2kzr h GLY 62 CO 0.00 0.00 -1.58 1.22 0.00 0.00 0.00 176.54 176.18 2kzr n ASP 63 N -3.64 1.89 -4.64 0.19 9.92 -0.69 -4.88 116.55 114.70 2kzr n ASP 63 Ca -0.01 0.41 -0.40 0.00 -0.53 0.00 0.00 54.79 54.26 2kzr n ASP 63 Cb 0.38 -0.91 -0.07 0.00 -0.64 0.00 0.00 41.12 39.88 2kzr n ASP 63 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2kzr s LEU 64 N -7.79 4.09 -1.02 0.64 2.01 -0.98 -4.99 118.68 110.64 2kzr s LEU 64 Ca -0.31 0.66 -0.22 0.00 0.01 0.00 0.00 54.13 54.27 2kzr s LEU 64 Cb 0.08 -2.76 -0.11 0.00 0.01 0.00 0.00 46.19 43.42 2kzr s LEU 64 CO 0.54 -0.27 1.92 -0.81 1.01 0.00 0.00 176.35 178.74 2kzr n PRO 65 N 5.29 1.67 -3.15 1.29 -0.04 -1.26 -4.47 135.00 134.33 2kzr n PRO 65 Ca -0.03 -2.26 -0.39 0.00 -0.04 0.00 0.00 63.50 60.78 2kzr n PRO 65 Cb 0.50 -3.37 -0.05 0.00 -0.04 0.00 0.00 33.50 30.53 2kzr n PRO 65 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2kzr s ILE 66 N 8.03 5.02 0.21 0.52 1.09 -1.26 -4.95 121.20 129.86 2kzr s ILE 66 Ca 0.63 1.29 0.11 0.00 -1.10 0.00 0.00 60.65 61.57 2kzr s ILE 66 Cb 0.06 -3.96 -0.04 0.00 -1.06 0.00 0.00 42.46 37.45 2kzr s ILE 66 CO 0.12 0.32 -0.18 -1.10 -0.10 0.00 0.00 174.94 174.00 2kzr s GLN 67 N 0.43 1.73 -0.32 2.79 -0.21 -1.26 -5.03 119.66 117.79 2kzr s GLN 67 Ca 0.33 -1.51 -0.29 0.00 0.02 0.00 0.00 55.36 53.92 2kzr s GLN 67 Cb -0.17 -1.93 -0.01 0.00 1.00 0.00 0.00 33.01 31.90 2kzr s GLN 67 CO 0.16 0.39 1.61 0.45 -2.12 0.00 0.00 175.29 175.78 2kzr s SER 68 N -2.95 6.20 0.00 5.90 0.15 -1.26 -2.07 113.70 119.68 2kzr s SER 68 Ca 0.24 1.25 0.00 0.00 0.70 0.00 0.00 55.95 58.14 2kzr s SER 68 Cb -0.07 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 2kzr s SER 68 CO 0.13 -1.47 0.00 0.61 1.20 0.00 0.00 173.24 173.71 2kzr n GLY 69 N 5.05 0.68 3.87 9.45 0.00 -0.28 -4.80 105.19 119.17 2kzr n GLY 69 Ca 0.19 -0.43 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 2kzr n GLY 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2kzr s ASP 70 N -2.39 6.33 -0.84 1.61 2.15 -0.88 -4.65 116.67 118.00 2kzr s ASP 70 Ca 0.00 1.36 -0.20 0.00 0.43 0.00 0.00 52.55 54.13 2kzr s ASP 70 Cb 0.00 -2.44 0.10 0.00 -0.30 0.00 0.00 42.92 40.29 2kzr s ASP 70 CO 0.00 -0.74 1.09 -0.32 -0.17 0.00 0.00 175.17 175.02 2kzr s MET 71 N -4.82 3.42 -0.63 4.34 -2.45 -1.26 -1.30 119.30 116.60 2kzr s MET 71 Ca 0.54 -1.38 -0.20 0.00 -1.25 0.00 0.00 55.69 53.40 2kzr s MET 71 Cb -0.11 -4.70 0.10 0.00 1.25 0.00 0.00 34.83 31.37 2kzr s MET 71 CO 0.47 -1.82 0.81 -0.51 1.05 0.00 0.00 175.02 175.02 2kzr s LEU 72 N 3.34 5.06 -0.68 4.11 2.01 -0.40 -2.35 118.68 129.77 2kzr s LEU 72 Ca 0.30 -1.33 -0.27 0.00 0.01 0.00 0.00 54.13 52.84 2kzr s LEU 72 Cb -0.09 -2.34 0.01 0.00 0.01 0.00 0.00 46.19 43.77 2kzr s LEU 72 CO -0.02 -1.22 1.52 -0.63 1.01 0.00 0.00 176.35 177.01 2kzr s ILE 73 N 3.12 3.57 -0.67 -0.59 1.09 0.12 -1.32 121.20 126.53 2kzr s ILE 73 Ca 0.16 0.34 -0.27 0.00 -1.10 0.00 0.00 60.65 59.77 2kzr s ILE 73 Cb -0.21 -4.50 0.03 0.00 -1.06 0.00 0.00 42.46 36.72 2kzr s ILE 73 CO 0.07 -1.45 1.30 -0.69 -0.10 0.00 0.00 174.94 174.07 2kzr s VAL 74 N 7.11 3.79 0.60 2.92 1.01 0.22 -3.84 120.40 132.21 2kzr s VAL 74 Ca 0.49 0.57 -0.14 0.00 0.00 0.00 0.00 61.98 62.89 2kzr s VAL 74 Cb -0.10 -4.76 -0.04 0.00 0.00 0.00 0.00 36.38 31.48 2kzr s VAL 74 CO 0.18 -1.59 1.03 -1.83 0.00 0.00 0.00 175.10 172.90 2kzr s GLU 75 N 5.57 3.43 -0.25 2.72 -1.05 -1.26 -3.99 118.70 123.87 2kzr s GLU 75 Ca 0.41 1.01 0.01 0.00 -0.15 0.00 0.00 54.97 56.24 2kzr s GLU 75 Cb -0.08 -2.06 0.04 0.00 -0.44 0.00 0.00 34.13 31.59 2kzr s GLU 75 CO 0.19 -0.70 -0.11 -2.00 0.95 0.00 0.00 175.26 173.59 2kzr s GLU 76 N -4.49 2.55 0.35 -4.83 2.12 -1.25 -4.09 118.70 109.07 2kzr s GLU 76 Ca 0.60 -1.15 0.25 0.00 0.36 0.00 0.00 54.97 55.03 2kzr s GLU 76 Cb -0.13 -2.88 0.59 0.00 0.26 0.00 0.00 34.13 31.97 2kzr s GLU 76 CO 0.43 -0.46 1.69 0.22 -0.54 0.00 0.00 175.26 176.60 2kzr h ASP 77 N 7.89 0.00 -1.87 -1.70 3.58 -1.43 -3.48 116.42 119.42 2kzr h ASP 77 Ca -0.28 0.00 -0.27 0.00 0.42 0.00 0.00 57.03 56.90 2kzr h ASP 77 Cb 1.08 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.11 2kzr h ASP 77 CO 0.53 0.00 -0.34 0.00 -2.88 0.00 0.00 179.24 176.55 2kzr n GLN 78 N -2.76 -1.08 0.03 0.28 6.02 -1.26 -4.95 117.38 113.66 2kzr n GLN 78 Ca 0.04 0.68 -0.11 0.00 -0.01 0.00 0.00 57.00 57.60 2kzr n GLN 78 Cb 0.47 -4.92 -0.04 0.00 1.02 0.00 0.00 30.24 26.77 2kzr n GLN 78 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 2kzr h THR 79 N 0.00 0.38 -5.77 5.09 2.02 -1.90 -3.48 112.91 109.25 2kzr h THR 79 Ca -0.32 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 66.66 2kzr h THR 79 Cb 1.22 0.38 0.04 0.00 -1.74 0.00 0.00 68.15 68.05 2kzr h THR 79 CO 0.38 0.00 -0.48 0.54 0.37 0.00 0.00 175.52 176.33 2kzr n ARG 80 N -5.38 -1.48 -1.87 6.66 1.74 -1.26 -5.02 116.66 110.04 2kzr n ARG 80 Ca -0.04 1.10 -0.30 0.00 -0.77 0.00 0.00 57.85 57.84 2kzr n ARG 80 Cb 0.30 -4.87 0.04 0.00 -1.02 0.00 0.00 32.46 26.91 2kzr n ARG 80 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2kzr s PRO 81 N -4.04 2.97 -1.00 5.56 0.04 -1.26 -4.96 135.00 132.31 2kzr s PRO 81 Ca 0.14 0.52 -0.23 0.00 0.04 0.00 0.00 61.00 61.47 2kzr s PRO 81 Cb -0.04 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 2kzr s PRO 81 CO 0.79 -0.97 1.83 0.21 0.04 0.00 0.00 177.00 178.90 2kzr s LYS 82 N -5.32 2.86 -0.02 4.56 2.47 -1.26 -4.95 119.74 118.07 2kzr s LYS 82 Ca 0.58 -0.73 -0.10 0.00 -1.56 0.00 0.00 55.97 54.16 2kzr s LYS 82 Cb -0.11 -5.19 -0.05 0.00 -1.46 0.00 0.00 37.83 31.02 2kzr s LYS 82 CO 0.52 -3.17 0.30 0.00 0.16 0.00 0.00 175.35 173.16 2kzr s ALA 83 N 8.80 3.79 -0.00 3.13 0.00 -1.26 -5.12 121.76 131.10 2kzr s ALA 83 Ca 0.64 -0.45 -0.01 0.00 0.00 0.00 0.00 51.96 52.13 2kzr s ALA 83 Cb -0.04 -2.17 -0.00 0.00 0.00 0.00 0.00 23.12 20.91 2kzr s ALA 83 CO 0.00 0.58 0.02 -1.54 0.00 0.00 0.00 175.76 174.82 2kzr s SER 84 N -1.33 0.03 0.65 0.00 1.04 -1.26 -5.04 113.70 107.79 2kzr s SER 84 Ca 0.24 -0.07 0.43 0.00 0.48 0.00 0.00 55.95 57.02 2kzr s SER 84 Cb -0.14 0.07 2.30 0.00 0.10 0.00 0.00 66.02 68.34 2kzr s SER 84 CO 0.12 -0.08 2.33 1.55 0.98 0.00 0.00 173.24 178.15 2kzr h PRO 85 N 5.76 0.00 0.00 4.02 0.13 -2.06 -3.57 132.00 136.28 2kzr h PRO 85 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2kzr h PRO 85 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2kzr h PRO 85 CO 0.47 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.68