#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 1.51 -0.01 -0.99 1.70 -1.26 -3.15 118.95 116.74 2kzr s ARG 2 Ca 0.00 -1.18 0.04 0.00 -0.47 0.00 0.00 55.73 54.11 2kzr s ARG 2 Cb 0.00 -2.64 -0.01 0.00 -0.57 0.00 0.00 34.95 31.74 2kzr s ARG 2 CO 0.00 -0.71 -0.12 0.08 -1.08 0.00 0.00 175.30 173.47 2kzr s VAL 3 N 1.32 0.95 0.41 4.99 1.01 -1.03 -1.05 120.40 126.99 2kzr s VAL 3 Ca -0.01 -0.50 -0.12 0.00 0.00 0.00 0.00 61.98 61.35 2kzr s VAL 3 Cb -0.19 -0.80 -0.07 0.00 0.00 0.00 0.00 36.38 35.32 2kzr s VAL 3 CO -0.09 0.27 0.80 -0.13 0.00 0.00 0.00 175.10 175.95 2kzr s ARG 4 N -0.19 3.86 -0.19 2.72 0.52 -0.79 -0.91 118.95 123.97 2kzr s ARG 4 Ca 0.03 0.60 -0.01 0.00 -0.52 0.00 0.00 55.73 55.82 2kzr s ARG 4 Cb -0.06 -2.35 0.05 0.00 0.52 0.00 0.00 34.95 33.11 2kzr s ARG 4 CO -0.00 -0.04 -0.02 0.00 0.02 0.00 0.00 175.30 175.27 2kzr s LYS 6 N 1.68 3.52 0.33 0.00 2.47 -0.28 -2.26 119.74 125.21 2kzr s LYS 6 Ca -0.01 0.19 -0.01 0.00 -1.56 0.00 0.00 55.97 54.58 2kzr s LYS 6 Cb -0.17 -3.98 -0.00 0.00 -1.46 0.00 0.00 37.83 32.22 2kzr s LYS 6 CO -0.07 -1.49 0.43 0.00 0.16 0.00 0.00 175.35 174.38 2kzr s ALA 7 N 4.40 0.94 0.37 3.13 0.00 -1.20 -0.58 121.76 128.82 2kzr s ALA 7 Ca 0.40 -1.60 0.05 0.00 0.00 0.00 0.00 51.96 50.81 2kzr s ALA 7 Cb -0.09 1.22 0.72 0.00 0.00 0.00 0.00 23.12 24.97 2kzr s ALA 7 CO 0.26 -0.76 1.99 0.87 0.00 0.00 0.00 175.76 178.12 2kzr h LYS 8 N 2.14 0.62 -0.98 0.00 1.79 -1.91 -2.56 116.57 115.68 2kzr h LYS 8 Ca -0.28 -0.06 -0.07 0.00 -2.18 0.00 0.00 60.65 58.06 2kzr h LYS 8 Cb 1.24 -0.13 -0.04 0.00 -1.58 0.00 0.00 32.23 31.72 2kzr h LYS 8 CO 0.39 0.47 0.09 0.41 -1.08 0.00 0.00 179.45 179.72 2kzr n GLY 9 N -1.29 2.26 0.00 3.86 0.00 -1.26 -4.98 105.19 103.78 2kzr n GLY 9 Ca 0.03 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2kzr n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kzr n GLY 10 N 0.17 0.01 3.46 -0.02 0.00 -0.96 -4.83 105.19 103.01 2kzr n GLY 10 Ca 0.10 -1.80 -0.43 0.00 0.00 0.00 0.00 46.02 43.89 2kzr n GLY 10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kzr s THR 11 N -2.01 4.54 0.58 2.61 2.01 -1.26 -3.26 115.64 118.84 2kzr s THR 11 Ca 0.00 -0.29 0.09 0.00 0.31 0.00 0.00 61.69 61.81 2kzr s THR 11 Cb 0.00 -4.53 0.09 0.00 0.01 0.00 0.00 72.50 68.07 2kzr s THR 11 CO 0.00 -1.16 0.75 -1.00 -0.69 0.00 0.00 174.62 172.52 2kzr s HIS 12 N 3.52 1.33 -0.23 4.92 3.76 -0.96 -4.91 115.29 122.72 2kzr s HIS 12 Ca 0.21 -0.77 -0.03 0.00 -0.15 0.00 0.00 55.06 54.33 2kzr s HIS 12 Cb -0.17 -2.15 0.07 0.00 1.11 0.00 0.00 32.58 31.44 2kzr s HIS 12 CO 0.13 -1.12 0.07 -1.17 -0.85 0.00 0.00 174.74 171.80 2kzr s LEU 13 N -4.64 1.23 -0.33 0.89 0.20 -1.26 -1.25 118.68 113.52 2kzr s LEU 13 Ca 0.58 -1.05 -0.28 0.00 0.69 0.00 0.00 54.13 54.07 2kzr s LEU 13 Cb -0.05 -0.58 -0.03 0.00 -0.43 0.00 0.00 46.19 45.10 2kzr s LEU 13 CO 0.37 -0.36 1.93 -0.76 -0.29 0.00 0.00 176.35 177.24 2kzr s LEU 14 N 1.87 3.47 -0.03 -0.68 2.01 -0.08 -4.88 118.68 120.35 2kzr s LEU 14 Ca 0.03 1.35 -0.22 0.00 0.01 0.00 0.00 54.13 55.30 2kzr s LEU 14 Cb -0.17 -3.39 -0.25 0.00 0.01 0.00 0.00 46.19 42.39 2kzr s LEU 14 CO -0.16 -1.87 1.02 1.56 1.01 0.00 0.00 176.35 177.90 2kzr h GLN 15 N 13.84 0.28 -3.28 1.70 1.08 -1.85 -2.73 115.11 124.16 2kzr h GLN 15 Ca -0.34 -0.34 -0.73 0.00 -1.45 0.00 0.00 58.65 55.79 2kzr h GLN 15 Cb 1.19 0.11 -0.09 0.00 -0.05 0.00 0.00 27.48 28.64 2kzr h GLN 15 CO 1.04 1.06 2.72 0.41 -0.95 0.00 0.00 178.83 183.11 2kzr n GLY 16 N 1.21 4.72 3.34 3.46 0.00 -1.26 -4.53 105.19 112.12 2kzr n GLY 16 Ca -0.11 -1.86 -0.32 0.00 0.00 0.00 0.00 46.02 43.73 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 -0.11 2.24 0.00 0.99 1.43 -1.19 -5.04 118.68 117.00 2kzr s LEU 17 Ca 0.51 -0.41 0.01 0.00 -1.03 0.00 0.00 54.13 53.21 2kzr s LEU 17 Cb 0.15 -1.41 0.01 0.00 0.03 0.00 0.00 46.19 44.97 2kzr s LEU 17 CO -0.05 0.30 0.12 -1.20 0.23 0.00 0.00 176.35 175.75 2kzr n SER 18 N 2.57 2.69 0.07 2.29 7.64 -1.26 -0.61 113.62 127.01 2kzr n SER 18 Ca -0.17 -2.50 -0.08 0.00 1.01 0.00 0.00 58.87 57.14 2kzr n SER 18 Cb 0.52 0.14 0.05 0.00 -1.01 0.00 0.00 64.21 63.91 2kzr n SER 18 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2kzr h SER 19 N 0.71 0.36 -0.72 6.43 0.02 -1.99 -3.29 113.55 115.06 2kzr h SER 19 Ca -0.28 -0.23 -0.33 0.00 -0.84 0.00 0.00 61.79 60.10 2kzr h SER 19 Cb 0.91 -0.11 -0.20 0.00 0.14 0.00 0.00 62.40 63.15 2kzr h SER 19 CO 0.46 0.96 0.33 0.54 -1.14 0.00 0.00 176.83 177.97 2kzr n ARG 20 N -3.81 2.48 -1.96 3.45 1.74 -1.26 -2.86 116.66 114.44 2kzr n ARG 20 Ca -0.03 -3.07 -0.41 0.00 -0.77 0.00 0.00 57.85 53.57 2kzr n ARG 20 Cb 0.70 -2.07 -0.03 0.00 -1.02 0.00 0.00 32.46 30.04 2kzr n ARG 20 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2kzr s THR 21 N -3.20 3.38 1.24 0.55 2.01 -1.24 -4.82 115.64 113.56 2kzr s THR 21 Ca 0.52 0.32 -0.19 0.00 0.31 0.00 0.00 61.69 62.66 2kzr s THR 21 Cb 0.44 -3.68 0.30 0.00 0.01 0.00 0.00 72.50 69.57 2kzr s THR 21 CO 0.08 -0.55 1.04 -0.13 -0.69 0.00 0.00 174.62 174.37 2kzr s ARG 22 N 6.45 -1.54 0.09 4.92 0.52 -1.26 -2.44 118.95 125.69 2kzr s ARG 22 Ca 0.77 0.20 -0.33 0.00 -0.52 0.00 0.00 55.73 55.85 2kzr s ARG 22 Cb -0.18 -1.54 -0.15 0.00 0.52 0.00 0.00 34.95 33.60 2kzr s ARG 22 CO 0.28 -3.98 1.60 1.25 0.02 0.00 0.00 175.30 174.47 2kzr h LEU 23 N -2.78 -1.07 -1.54 2.53 6.46 -0.69 0.75 115.31 118.98 2kzr h LEU 23 Ca -0.48 0.08 0.24 0.00 -0.12 0.00 0.00 57.88 57.60 2kzr h LEU 23 Cb 1.32 0.35 -0.07 0.00 -0.73 0.00 0.00 40.66 41.53 2kzr h LEU 23 CO 0.38 -0.57 0.65 0.08 -0.62 0.00 0.00 178.44 178.36 2kzr h ARG 24 N -0.86 0.32 0.02 1.25 0.11 -1.87 0.44 114.38 113.78 2kzr h ARG 24 Ca -0.05 -0.02 -0.00 0.00 0.10 0.00 0.00 59.98 60.01 2kzr h ARG 24 Cb 0.75 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.75 2kzr h ARG 24 CO -0.03 0.21 -0.01 0.93 0.10 0.00 0.00 179.97 181.17 2kzr h GLU 25 N 0.33 -0.03 0.13 0.08 4.39 -1.81 -3.20 114.58 114.48 2kzr h GLU 25 Ca 0.52 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 60.21 2kzr h GLU 25 Cb 1.43 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 30.09 2kzr h GLU 25 CO -0.19 0.70 -0.06 1.25 -1.16 0.00 0.00 179.01 179.55 2kzr h LEU 26 N -0.83 -0.15 -1.99 1.33 7.12 -0.11 -1.88 115.31 118.80 2kzr h LEU 26 Ca -0.00 0.01 -0.00 0.00 0.13 0.00 0.00 57.88 58.01 2kzr h LEU 26 Cb 0.74 0.04 -0.00 0.00 -0.53 0.00 0.00 40.66 40.91 2kzr h LEU 26 CO 0.00 -0.03 -0.01 1.56 -0.13 0.00 0.00 178.44 179.83 2kzr h GLN 27 N -0.32 0.00 -0.03 1.25 4.20 -1.17 -1.47 115.11 117.57 2kzr h GLN 27 Ca -0.02 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.46 2kzr h GLN 27 Cb 0.13 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.92 2kzr h GLN 27 CO 0.03 0.01 -0.91 0.78 -0.67 0.00 0.00 178.83 178.07 2kzr h GLY 28 N 1.30 0.57 1.17 3.46 0.00 -1.60 -2.30 103.07 105.66 2kzr h GLY 28 Ca -0.00 -0.95 -0.17 0.00 0.00 0.00 0.00 47.33 46.21 2kzr h GLY 28 CO 0.00 0.84 -0.48 1.46 0.00 0.00 0.00 176.54 178.36 2kzr h GLN 29 N 0.31 0.89 -0.55 4.80 4.20 -0.43 -2.91 115.11 121.42 2kzr h GLN 29 Ca -0.08 -0.52 -0.04 0.00 0.06 0.00 0.00 58.65 58.07 2kzr h GLN 29 Cb 1.54 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 29.34 2kzr h GLN 29 CO 0.17 1.17 0.20 0.82 -0.67 0.00 0.00 178.83 180.51 2kzr h ILE 30 N 0.70 1.21 0.00 2.54 2.04 -1.40 0.58 117.51 123.18 2kzr h ILE 30 Ca 0.03 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.20 2kzr h ILE 30 Cb 1.08 0.57 -0.00 0.00 -0.74 0.00 0.00 36.82 37.73 2kzr h ILE 30 CO 0.11 0.26 -0.08 0.00 0.00 0.00 0.00 178.15 178.44 2kzr h ALA 31 N 1.42 1.50 0.00 1.87 0.00 -1.30 -1.12 119.26 121.63 2kzr h ALA 31 Ca 0.19 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 2kzr h ALA 31 Cb 0.19 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2kzr h ALA 31 CO -0.01 0.10 -1.28 0.00 0.00 0.00 0.00 179.25 178.05 2kzr n ALA 32 N -2.36 2.22 -0.03 0.00 0.00 -0.43 -3.28 120.51 116.64 2kzr n ALA 32 Ca -0.02 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.00 2kzr n ALA 32 Cb 0.17 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.62 2kzr n ALA 32 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2kzr n ILE 33 N -2.76 0.00 1.03 0.00 2.08 0.06 -4.64 119.36 115.12 2kzr n ILE 33 Ca -0.06 0.48 0.11 0.00 0.56 0.00 0.00 62.75 63.85 2kzr n ILE 33 Cb 0.71 -1.45 0.01 0.00 -0.75 0.00 0.00 39.64 38.16 2kzr n ILE 33 CO 0.00 0.00 0.00 1.07 0.56 0.00 0.00 176.55 178.18 2kzr n THR 34 N -2.02 0.00 -1.11 1.39 5.66 -0.48 -4.96 114.28 112.76 2kzr n THR 34 Ca 0.00 -0.10 -0.04 0.00 -3.05 0.00 0.00 64.05 60.86 2kzr n THR 34 Cb 0.00 0.93 -0.02 0.00 -1.55 0.00 0.00 70.33 69.70 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 1.46 0.67 3.45 1.09 0.00 -1.19 -4.37 105.19 106.30 2kzr n GLY 35 Ca 0.07 -0.82 -0.43 0.00 0.00 0.00 0.00 46.02 44.83 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 -2.12 5.17 0.78 -0.61 -1.09 -1.25 -4.97 121.20 117.10 2kzr s ILE 36 Ca 0.00 -0.66 -0.14 0.00 -2.23 0.00 0.00 60.65 57.62 2kzr s ILE 36 Cb 0.00 -4.05 0.06 0.00 -1.58 0.00 0.00 42.46 36.89 2kzr s ILE 36 CO 0.00 -0.46 1.21 0.00 -1.23 0.00 0.00 174.94 174.46 2kzr s ALA 37 N 1.89 1.95 0.48 9.38 0.00 -1.26 -3.18 121.76 131.02 2kzr s ALA 37 Ca 0.08 0.88 0.19 0.00 0.00 0.00 0.00 51.96 53.11 2kzr s ALA 37 Cb -0.20 -3.49 1.21 0.00 0.00 0.00 0.00 23.12 20.64 2kzr s ALA 37 CO 0.10 -2.14 2.01 -1.00 0.00 0.00 0.00 175.76 174.73 2kzr h PRO 38 N -0.64 0.18 -0.14 0.00 0.13 -1.89 0.66 132.00 130.30 2kzr h PRO 38 Ca -0.47 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2kzr h PRO 38 Cb 1.30 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2kzr h PRO 38 CO 0.48 0.12 0.00 0.41 -0.23 0.00 0.00 178.00 178.78 2kzr n GLY 39 N -1.57 0.36 0.43 1.56 0.00 -1.26 -3.43 105.19 101.28 2kzr n GLY 39 Ca 0.08 -0.46 0.07 0.00 0.00 0.00 0.00 46.02 45.71 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 0.42 1.80 -3.98 1.61 7.64 0.19 -4.80 113.62 116.50 2kzr n SER 40 Ca 0.17 -1.40 -0.09 0.00 1.01 0.00 0.00 58.87 58.56 2kzr n SER 40 Cb 0.37 0.29 -0.08 0.00 -1.01 0.00 0.00 64.21 63.78 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 -1.57 0.90 0.23 1.43 1.03 -1.04 -0.55 119.66 120.10 2kzr s GLN 41 Ca 0.14 -1.16 0.01 0.00 0.04 0.00 0.00 55.36 54.40 2kzr s GLN 41 Cb 0.12 0.31 -0.00 0.00 0.03 0.00 0.00 33.01 33.47 2kzr s GLN 41 CO 0.30 -0.28 0.27 0.54 -2.54 0.00 0.00 175.29 173.58 2kzr n ARG 42 N -0.08 0.39 -3.64 9.60 1.74 -1.26 -4.84 116.66 118.57 2kzr n ARG 42 Ca -0.11 -1.97 -0.40 0.00 -0.77 0.00 0.00 57.85 54.61 2kzr n ARG 42 Cb 0.63 1.79 -0.12 0.00 -1.02 0.00 0.00 32.46 33.74 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 -2.76 4.36 0.27 0.55 -1.09 -1.21 -4.11 121.20 117.21 2kzr s ILE 43 Ca 0.22 -0.89 0.11 0.00 -2.23 0.00 0.00 60.65 57.85 2kzr s ILE 43 Cb 0.00 -3.43 -0.05 0.00 -1.58 0.00 0.00 42.46 37.40 2kzr s ILE 43 CO 0.15 -0.19 -0.19 -0.76 -1.23 0.00 0.00 174.94 172.73 2kzr s LEU 44 N 1.52 2.59 0.33 2.97 2.01 -1.03 -3.67 118.68 123.39 2kzr s LEU 44 Ca 0.01 -1.03 0.03 0.00 0.01 0.00 0.00 54.13 53.15 2kzr s LEU 44 Cb -0.19 -1.01 -0.04 0.00 0.01 0.00 0.00 46.19 44.96 2kzr s LEU 44 CO 0.06 -0.01 0.11 0.68 1.01 0.00 0.00 176.35 178.20 2kzr s VAL 45 N -2.61 0.66 -1.49 -1.59 -7.23 -1.26 -1.05 120.40 105.83 2kzr s VAL 45 Ca 0.29 -2.00 0.28 0.00 -1.81 0.00 0.00 61.98 58.74 2kzr s VAL 45 Cb -0.04 -2.56 0.53 0.00 0.56 0.00 0.00 36.38 34.87 2kzr s VAL 45 CO 0.13 0.00 1.98 0.61 -0.31 0.00 0.00 175.10 177.51 2kzr n GLY 46 N -0.68 -1.18 3.67 2.32 0.00 -1.26 -4.72 105.19 103.34 2kzr n GLY 46 Ca -0.02 -0.14 -0.23 0.00 0.00 0.00 0.00 46.02 45.63 2kzr n GLY 46 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2kzr s TYR 47 N -2.51 2.65 -0.38 1.61 -0.85 -1.26 -5.07 117.35 111.55 2kzr s TYR 47 Ca 0.28 -0.34 -0.35 0.00 -0.52 0.00 0.00 57.07 56.14 2kzr s TYR 47 Cb 0.19 -1.43 -0.12 0.00 0.38 0.00 0.00 41.96 40.98 2kzr s TYR 47 CO 0.42 0.48 2.22 -0.35 -1.52 0.00 0.00 175.55 176.80 2kzr n PRO 48 N -1.00 1.03 -2.09 -3.49 -0.04 -1.26 -4.97 135.00 123.18 2kzr n PRO 48 Ca -0.05 0.27 -0.27 0.00 -0.04 0.00 0.00 63.50 63.41 2kzr n PRO 48 Cb 0.61 -2.46 0.08 0.00 -0.04 0.00 0.00 33.50 31.68 2kzr n PRO 48 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2kzr s PRO 49 N 6.40 2.13 0.00 0.54 0.04 -1.26 -4.99 135.00 137.86 2kzr s PRO 49 Ca 1.10 -0.10 0.18 0.00 0.04 0.00 0.00 61.00 62.21 2kzr s PRO 49 Cb -0.85 -2.09 0.67 0.00 0.04 0.00 0.00 34.50 32.28 2kzr s PRO 49 CO 0.48 -1.36 1.49 0.39 0.04 0.00 0.00 177.00 178.04 2kzr n GLU 50 N -3.06 1.63 -2.92 4.56 -0.58 -1.26 -4.95 120.64 114.06 2kzr n GLU 50 Ca 0.08 -0.96 -0.10 0.00 -0.42 0.00 0.00 57.16 55.77 2kzr n GLU 50 Cb 0.61 -1.34 0.01 0.00 -0.57 0.00 0.00 31.44 30.15 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 -2.26 3.28 -0.38 0.00 1.43 -1.24 -4.96 118.68 114.56 2kzr s LEU 52 Ca 0.19 -0.56 -0.28 0.00 -1.03 0.00 0.00 54.13 52.46 2kzr s LEU 52 Cb -0.04 -2.56 0.02 0.00 0.03 0.00 0.00 46.19 43.64 2kzr s LEU 52 CO 0.75 -2.06 1.03 -0.62 0.23 0.00 0.00 176.35 175.67 2kzr s ASP 53 N 5.91 6.75 -1.16 2.29 2.15 -1.26 -3.31 116.67 128.04 2kzr s ASP 53 Ca 0.52 0.71 -0.21 0.00 0.43 0.00 0.00 52.55 54.00 2kzr s ASP 53 Cb -0.07 -2.51 0.05 0.00 -0.30 0.00 0.00 42.92 40.09 2kzr s ASP 53 CO 0.07 -0.96 1.62 -0.76 -0.17 0.00 0.00 175.17 174.97 2kzr s LEU 54 N 3.77 3.65 -0.00 -1.34 1.02 -1.26 -4.82 118.68 119.69 2kzr s LEU 54 Ca 0.43 -1.93 -0.25 0.00 0.02 0.00 0.00 54.13 52.40 2kzr s LEU 54 Cb -0.11 -2.58 -0.19 0.00 0.02 0.00 0.00 46.19 43.34 2kzr s LEU 54 CO 0.21 -1.42 1.33 0.77 0.02 0.00 0.00 176.35 177.26 2kzr h SER 55 N 8.74 -0.04 -4.28 2.29 4.64 -2.02 -3.45 113.55 119.44 2kzr h SER 55 Ca 0.32 -0.37 -0.50 0.00 -0.47 0.00 0.00 61.79 60.77 2kzr h SER 55 Cb 0.94 0.01 0.07 0.00 -0.31 0.00 0.00 62.40 63.11 2kzr h SER 55 CO 1.43 0.36 0.38 -0.62 -0.87 0.00 0.00 176.83 177.51 2kzr s ASP 56 N -5.54 5.82 -0.11 4.97 2.15 -1.26 -5.01 116.67 117.68 2kzr s ASP 56 Ca -0.15 1.64 0.05 0.00 0.43 0.00 0.00 52.55 54.52 2kzr s ASP 56 Cb 0.02 -2.50 -0.24 0.00 -0.30 0.00 0.00 42.92 39.90 2kzr s ASP 56 CO 0.65 -1.15 0.38 -2.11 -0.17 0.00 0.00 175.17 172.78 2kzr n ARG 57 N -2.51 0.69 0.00 4.34 1.85 -1.26 -4.22 116.66 115.55 2kzr n ARG 57 Ca 0.08 0.23 0.12 0.00 -1.00 0.00 0.00 57.85 57.28 2kzr n ARG 57 Cb 0.53 -1.70 0.26 0.00 -1.05 0.00 0.00 32.46 30.50 2kzr n ARG 57 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 2kzr n ASP 58 N -3.19 1.73 -4.74 2.89 2.03 -1.26 -3.56 116.55 110.44 2kzr n ASP 58 Ca -0.28 -1.38 -0.42 0.00 0.52 0.00 0.00 54.79 53.24 2kzr n ASP 58 Cb 1.06 0.18 -0.02 0.00 -0.72 0.00 0.00 41.12 41.62 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 -2.31 2.11 0.45 5.18 2.07 -1.26 -4.57 121.20 122.88 2kzr s ILE 59 Ca 0.26 0.09 0.04 0.00 -1.41 0.00 0.00 60.65 59.63 2kzr s ILE 59 Cb 0.19 -3.06 0.04 0.00 0.13 0.00 0.00 42.46 39.77 2kzr s ILE 59 CO 0.46 0.01 0.37 0.35 -1.91 0.00 0.00 174.94 174.22 2kzr n THR 60 N 2.75 0.00 0.78 4.00 -2.24 -1.26 -0.27 114.28 118.04 2kzr n THR 60 Ca 0.10 -1.75 0.11 0.00 -2.27 0.00 0.00 64.05 60.24 2kzr n THR 60 Cb 0.37 -0.17 0.48 0.00 -2.10 0.00 0.00 70.33 68.91 2kzr n THR 60 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2kzr n LEU 61 N 0.00 0.01 0.24 3.22 4.77 -1.02 -2.04 117.00 122.17 2kzr n LEU 61 Ca 0.00 0.50 0.11 0.00 -0.03 0.00 0.00 56.01 56.59 2kzr n LEU 61 Cb 0.51 -0.50 0.59 0.00 -2.33 0.00 0.00 43.42 41.69 2kzr n LEU 61 CO 0.30 -0.11 0.88 1.23 -1.33 0.00 0.00 177.39 178.36 2kzr h GLY 62 N 3.91 0.00 0.00 -0.72 0.00 -1.86 -3.35 103.07 101.05 2kzr h GLY 62 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2kzr h GLY 62 CO 0.00 0.00 -0.64 1.22 0.00 0.00 0.00 176.54 177.12 2kzr n ASP 63 N -3.60 1.83 -4.71 0.19 9.92 -0.87 -4.92 116.55 114.39 2kzr n ASP 63 Ca -0.01 0.58 -0.42 0.00 -0.53 0.00 0.00 54.79 54.41 2kzr n ASP 63 Cb 0.32 -0.86 -0.03 0.00 -0.64 0.00 0.00 41.12 39.91 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 -8.16 4.37 -0.97 0.64 2.01 -1.04 -4.94 118.68 110.59 2kzr s LEU 64 Ca -0.18 1.79 -0.26 0.00 0.01 0.00 0.00 54.13 55.50 2kzr s LEU 64 Cb 0.03 -3.57 -0.21 0.00 0.01 0.00 0.00 46.19 42.44 2kzr s LEU 64 CO 0.27 -0.35 2.00 -2.65 1.01 0.00 0.00 176.35 176.63 2kzr n PRO 65 N 3.96 0.57 -3.69 1.29 -0.02 -1.26 -4.62 135.00 131.23 2kzr n PRO 65 Ca 0.07 -1.84 -0.39 0.00 -2.02 0.00 0.00 63.50 59.33 2kzr n PRO 65 Cb 0.49 -3.67 -0.12 0.00 -0.02 0.00 0.00 33.50 30.19 2kzr n PRO 65 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2kzr s ILE 66 N 13.86 4.01 0.16 4.25 1.09 -1.26 -4.99 121.20 138.32 2kzr s ILE 66 Ca 0.75 -1.15 0.04 0.00 -1.10 0.00 0.00 60.65 59.19 2kzr s ILE 66 Cb -0.00 -3.31 -0.04 0.00 -1.06 0.00 0.00 42.46 38.05 2kzr s ILE 66 CO 0.19 -0.27 0.20 -1.10 -0.10 0.00 0.00 174.94 173.87 2kzr s GLN 67 N 1.43 3.13 -0.50 2.79 -1.52 -1.26 -4.96 119.66 118.77 2kzr s GLN 67 Ca 0.00 -0.76 -0.26 0.00 -1.95 0.00 0.00 55.36 52.39 2kzr s GLN 67 Cb -0.20 -2.78 -0.05 0.00 -0.22 0.00 0.00 33.01 29.76 2kzr s GLN 67 CO 0.03 0.50 2.24 -1.54 -0.25 0.00 0.00 175.29 176.27 2kzr s SER 68 N -3.18 4.75 -0.03 5.90 1.04 -1.26 -2.01 113.70 118.91 2kzr s SER 68 Ca 0.32 0.95 -0.00 0.00 0.48 0.00 0.00 55.95 57.71 2kzr s SER 68 Cb -0.10 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.51 2kzr s SER 68 CO 0.26 -2.67 0.02 0.61 0.98 0.00 0.00 173.24 172.44 2kzr n GLY 69 N 5.90 0.62 3.81 7.32 0.00 -0.22 -4.98 105.19 117.63 2kzr n GLY 69 Ca 0.32 -0.54 -0.23 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.02 4.75 -0.48 1.61 2.15 -0.85 -4.89 116.67 115.94 2kzr s ASP 70 Ca 0.01 -0.89 -0.14 0.00 0.43 0.00 0.00 52.55 51.95 2kzr s ASP 70 Cb -0.00 -0.54 0.09 0.00 -0.30 0.00 0.00 42.92 42.17 2kzr s ASP 70 CO 0.02 -0.58 0.39 -0.32 -0.17 0.00 0.00 175.17 174.50 2kzr s MET 71 N -4.01 2.85 -0.31 4.34 -2.45 -1.26 -1.89 119.30 116.56 2kzr s MET 71 Ca 0.44 -1.51 -0.09 0.00 -1.25 0.00 0.00 55.69 53.29 2kzr s MET 71 Cb 0.00 -4.08 0.00 0.00 1.25 0.00 0.00 34.83 32.01 2kzr s MET 71 CO 0.25 -1.10 0.13 -0.51 1.05 0.00 0.00 175.02 174.84 2kzr s LEU 72 N 1.55 4.07 -0.50 4.11 2.01 -0.92 -4.17 118.68 124.83 2kzr s LEU 72 Ca 0.04 -0.65 -0.27 0.00 0.01 0.00 0.00 54.13 53.25 2kzr s LEU 72 Cb -0.26 -1.95 0.03 0.00 0.01 0.00 0.00 46.19 44.02 2kzr s LEU 72 CO 0.04 -0.21 1.07 -0.63 1.01 0.00 0.00 176.35 177.62 2kzr s ILE 73 N 1.56 4.26 -0.32 -0.59 1.09 -0.22 -1.12 121.20 125.86 2kzr s ILE 73 Ca 0.03 0.92 -0.27 0.00 -1.10 0.00 0.00 60.65 60.24 2kzr s ILE 73 Cb -0.17 -4.58 0.01 0.00 -1.06 0.00 0.00 42.46 36.66 2kzr s ILE 73 CO 0.05 -1.04 0.95 -0.69 -0.10 0.00 0.00 174.94 174.10 2kzr s VAL 74 N 4.31 4.62 0.77 2.92 1.01 0.25 -2.47 120.40 131.82 2kzr s VAL 74 Ca 0.42 1.46 -0.10 0.00 0.00 0.00 0.00 61.98 63.76 2kzr s VAL 74 Cb -0.09 -4.31 0.08 0.00 0.00 0.00 0.00 36.38 32.06 2kzr s VAL 74 CO 0.28 -0.40 1.11 -1.83 0.00 0.00 0.00 175.10 174.26 2kzr s GLU 75 N 3.37 2.03 -0.17 2.72 -1.05 -1.26 -4.25 118.70 120.08 2kzr s GLU 75 Ca 0.40 -0.06 -0.01 0.00 -0.15 0.00 0.00 54.97 55.15 2kzr s GLU 75 Cb -0.13 -2.04 0.04 0.00 -0.44 0.00 0.00 34.13 31.56 2kzr s GLU 75 CO 0.15 -1.47 -0.04 -2.00 0.95 0.00 0.00 175.26 172.84 2kzr s GLU 76 N -5.45 1.35 0.03 -4.83 2.12 -1.24 -4.22 118.70 106.46 2kzr s GLU 76 Ca 0.62 -0.52 0.20 0.00 0.36 0.00 0.00 54.97 55.63 2kzr s GLU 76 Cb -0.11 -2.02 -0.18 0.00 0.26 0.00 0.00 34.13 32.08 2kzr s GLU 76 CO 0.47 -0.46 0.66 -3.47 -0.54 0.00 0.00 175.26 171.93 2kzr n ASP 77 N 4.89 0.46 -2.60 -1.70 2.03 0.29 -5.01 116.55 114.90 2kzr n ASP 77 Ca -0.11 0.19 -0.19 0.00 0.52 0.00 0.00 54.79 55.20 2kzr n ASP 77 Cb 0.47 0.95 0.04 0.00 -0.72 0.00 0.00 41.12 41.86 2kzr n ASP 77 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kzr n GLN 78 N -2.61 -4.48 0.27 -0.67 6.02 -1.26 -4.92 117.38 109.73 2kzr n GLN 78 Ca -0.09 0.74 0.15 0.00 -0.01 0.00 0.00 57.00 57.79 2kzr n GLN 78 Cb 0.72 -5.27 0.74 0.00 1.02 0.00 0.00 30.24 27.45 2kzr n GLN 78 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2kzr h THR 79 N -1.34 0.33 -5.65 5.09 1.03 -1.91 -3.48 112.91 106.98 2kzr h THR 79 Ca -0.44 -0.57 -0.11 0.00 -0.01 0.00 0.00 66.41 65.28 2kzr h THR 79 Cb 1.30 1.42 0.00 0.00 -1.07 0.00 0.00 68.15 69.81 2kzr h THR 79 CO 0.47 0.09 -0.55 0.54 -0.01 0.00 0.00 175.52 176.05 2kzr n ARG 80 N -3.36 -1.98 -1.95 0.00 5.12 -1.26 -5.00 116.66 108.23 2kzr n ARG 80 Ca -0.01 1.74 -0.29 0.00 -1.93 0.00 0.00 57.85 57.36 2kzr n ARG 80 Cb 0.27 -4.79 0.10 0.00 -1.16 0.00 0.00 32.46 26.88 2kzr n ARG 80 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2kzr s PRO 81 N -2.88 1.77 -0.72 5.56 0.04 -1.26 -4.96 135.00 132.55 2kzr s PRO 81 Ca 0.19 -0.04 -0.26 0.00 0.04 0.00 0.00 61.00 60.94 2kzr s PRO 81 Cb -0.04 -1.96 -0.05 0.00 0.04 0.00 0.00 34.50 32.48 2kzr s PRO 81 CO 0.79 -1.69 2.02 0.21 0.04 0.00 0.00 177.00 178.38 2kzr s LYS 82 N -5.59 2.41 0.00 4.56 2.47 -1.26 -4.80 119.74 117.53 2kzr s LYS 82 Ca 0.64 0.37 0.29 0.00 -1.56 0.00 0.00 55.97 55.70 2kzr s LYS 82 Cb -0.10 -4.70 1.20 0.00 -1.46 0.00 0.00 37.83 32.77 2kzr s LYS 82 CO 0.49 -3.24 1.90 0.00 0.16 0.00 0.00 175.35 174.66 2kzr n ALA 83 N 14.28 2.41 -3.47 3.13 0.00 -1.26 -4.53 120.51 131.06 2kzr n ALA 83 Ca 0.33 -0.12 -0.40 0.00 0.00 0.00 0.00 53.44 53.24 2kzr n ALA 83 Cb 0.50 -1.45 -0.09 0.00 0.00 0.00 0.00 19.45 18.41 2kzr n ALA 83 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2kzr s SER 84 N -2.99 5.66 0.28 0.00 0.01 -1.26 -4.97 113.70 110.42 2kzr s SER 84 Ca 0.14 -1.78 0.21 0.00 1.31 0.00 0.00 55.95 55.83 2kzr s SER 84 Cb 0.19 -1.99 1.03 0.00 0.21 0.00 0.00 66.02 65.46 2kzr s SER 84 CO 0.54 -0.64 1.64 -0.81 0.41 0.00 0.00 173.24 174.39 2kzr n PRO 85 N 4.90 0.15 0.00 12.44 -0.04 -1.26 -5.26 135.00 145.92 2kzr n PRO 85 Ca -0.08 0.54 0.00 0.00 -0.04 0.00 0.00 63.50 63.92 2kzr n PRO 85 Cb 0.41 -1.90 0.00 0.00 -0.04 0.00 0.00 33.50 31.98 2kzr n PRO 85 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91