#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kzr n ARG 2 N 0.00 3.04 -2.53 -0.99 3.00 -1.26 -4.42 116.66 113.50 2kzr n ARG 2 Ca 0.00 -2.47 -0.43 0.00 -0.01 0.00 0.00 57.85 54.94 2kzr n ARG 2 Cb 0.00 -3.15 -0.02 0.00 0.00 0.00 0.00 32.46 29.29 2kzr n ARG 2 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2kzr s VAL 3 N 2.97 4.46 -0.16 1.55 1.01 -1.18 -3.12 120.40 125.94 2kzr s VAL 3 Ca 0.53 1.76 -0.16 0.00 0.00 0.00 0.00 61.98 64.11 2kzr s VAL 3 Cb 0.15 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 2kzr s VAL 3 CO -0.08 -0.16 0.39 -0.13 0.00 0.00 0.00 175.10 175.13 2kzr s ARG 4 N 3.37 4.26 -0.27 2.72 0.52 -0.83 -1.21 118.95 127.52 2kzr s ARG 4 Ca 0.50 0.26 0.01 0.00 -0.52 0.00 0.00 55.73 55.98 2kzr s ARG 4 Cb -0.19 -3.47 0.05 0.00 0.52 0.00 0.00 34.95 31.87 2kzr s ARG 4 CO 0.11 0.11 -0.08 0.00 0.02 0.00 0.00 175.30 175.46 2kzr s LYS 6 N 1.19 4.40 0.17 0.00 2.47 -0.05 -1.54 119.74 126.38 2kzr s LYS 6 Ca -0.06 1.68 -0.06 0.00 -1.56 0.00 0.00 55.97 55.98 2kzr s LYS 6 Cb -0.19 -3.47 0.02 0.00 -1.46 0.00 0.00 37.83 32.73 2kzr s LYS 6 CO -0.04 -0.34 0.33 0.00 0.16 0.00 0.00 175.35 175.46 2kzr n ALA 7 N 4.60 -0.71 -2.06 3.13 0.00 -0.87 -1.04 120.51 123.56 2kzr n ALA 7 Ca 0.10 -0.56 -0.42 0.00 0.00 0.00 0.00 53.44 52.56 2kzr n ALA 7 Cb 0.47 0.45 -0.03 0.00 0.00 0.00 0.00 19.45 20.33 2kzr n ALA 7 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2kzr s LYS 8 N -2.06 4.25 0.00 0.00 1.02 -1.26 -1.82 119.74 119.87 2kzr s LYS 8 Ca 0.07 2.18 0.00 0.00 0.02 0.00 0.00 55.97 58.25 2kzr s LYS 8 Cb -0.02 -3.41 0.00 0.00 -0.52 0.00 0.00 37.83 33.88 2kzr s LYS 8 CO 0.05 -0.59 0.00 0.41 -0.92 0.00 0.00 175.35 174.30 2kzr n GLY 9 N 3.73 0.47 0.00 -3.33 0.00 -1.26 -5.02 105.19 99.78 2kzr n GLY 9 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.52 -1.03 3.60 -0.02 0.00 -0.75 -4.95 105.19 100.51 2kzr n GLY 10 Ca 0.00 -2.11 -0.40 0.00 0.00 0.00 0.00 46.02 43.51 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 0.00 5.12 0.06 2.61 2.01 -1.26 -2.05 115.64 122.14 2kzr s THR 11 Ca 0.00 0.56 -0.14 0.00 0.31 0.00 0.00 61.69 62.43 2kzr s THR 11 Cb 0.00 -3.78 -0.06 0.00 0.01 0.00 0.00 72.50 68.67 2kzr s THR 11 CO 0.00 0.06 0.45 -1.00 -0.69 0.00 0.00 174.62 173.44 2kzr s HIS 12 N 2.17 3.67 -0.44 4.92 3.76 -0.59 -4.90 115.29 123.87 2kzr s HIS 12 Ca 0.17 0.98 -0.12 0.00 -0.15 0.00 0.00 55.06 55.93 2kzr s HIS 12 Cb -0.16 -2.29 0.07 0.00 1.11 0.00 0.00 32.58 31.32 2kzr s HIS 12 CO 0.10 0.56 0.33 -1.17 -0.85 0.00 0.00 174.74 173.70 2kzr s LEU 13 N -1.52 5.37 0.10 0.89 1.98 -1.26 -1.28 118.68 122.96 2kzr s LEU 13 Ca 0.30 -1.40 -0.22 0.00 -2.89 0.00 0.00 54.13 49.92 2kzr s LEU 13 Cb -0.16 -2.09 -0.07 0.00 0.66 0.00 0.00 46.19 44.54 2kzr s LEU 13 CO 0.17 -0.59 0.67 -0.76 -1.89 0.00 0.00 176.35 173.94 2kzr s LEU 14 N 1.54 4.54 0.33 -0.68 1.02 -0.35 -4.98 118.68 120.10 2kzr s LEU 14 Ca 0.03 1.41 0.10 0.00 0.02 0.00 0.00 54.13 55.69 2kzr s LEU 14 Cb -0.23 -3.07 -0.06 0.00 0.02 0.00 0.00 46.19 42.84 2kzr s LEU 14 CO 0.04 0.21 -0.09 -1.10 0.02 0.00 0.00 176.35 175.43 2kzr s GLN 15 N -0.94 1.85 0.00 1.70 -1.52 -1.26 -3.07 119.66 116.41 2kzr s GLN 15 Ca 0.32 -1.88 0.00 0.00 -1.95 0.00 0.00 55.36 51.85 2kzr s GLN 15 Cb -0.21 -1.75 0.00 0.00 -0.22 0.00 0.00 33.01 30.83 2kzr s GLN 15 CO 0.22 0.17 0.00 0.41 -0.25 0.00 0.00 175.29 175.84 2kzr n GLY 16 N -0.80 0.63 3.57 3.09 0.00 -1.26 -5.02 105.19 105.40 2kzr n GLY 16 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 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 0.00 3.78 0.72 0.99 2.01 -1.26 -5.00 118.68 119.91 2kzr s LEU 17 Ca 0.00 0.13 -0.07 0.00 0.01 0.00 0.00 54.13 54.20 2kzr s LEU 17 Cb 0.00 -3.23 0.06 0.00 0.01 0.00 0.00 46.19 43.04 2kzr s LEU 17 CO 0.00 -1.25 1.04 -0.55 1.01 0.00 0.00 176.35 176.60 2kzr s SER 18 N 2.59 4.77 0.51 2.29 0.15 -1.26 -3.51 113.70 119.23 2kzr s SER 18 Ca 0.40 0.50 0.29 0.00 0.70 0.00 0.00 55.95 57.84 2kzr s SER 18 Cb -0.09 -1.12 1.26 0.00 -1.71 0.00 0.00 66.02 64.36 2kzr s SER 18 CO 0.26 -1.64 1.96 0.28 1.20 0.00 0.00 173.24 175.30 2kzr h SER 19 N -0.66 0.00 -0.30 5.45 0.02 -1.98 -3.11 113.55 112.97 2kzr h SER 19 Ca -0.45 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.43 2kzr h SER 19 Cb 1.32 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.82 2kzr h SER 19 CO 0.61 0.12 -0.00 -2.11 -1.14 0.00 0.00 176.83 174.30 2kzr n ARG 20 N -3.32 2.51 -1.76 3.45 1.85 -1.26 -2.74 116.66 115.39 2kzr n ARG 20 Ca -0.00 -2.95 -0.42 0.00 -1.00 0.00 0.00 57.85 53.48 2kzr n ARG 20 Cb 0.33 -1.84 -0.03 0.00 -1.05 0.00 0.00 32.46 29.88 2kzr n ARG 20 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2kzr s THR 21 N -2.98 3.19 1.06 8.89 2.01 -1.18 -4.76 115.64 121.88 2kzr s THR 21 Ca 0.43 0.18 -0.14 0.00 0.31 0.00 0.00 61.69 62.47 2kzr s THR 21 Cb 0.36 -3.28 0.22 0.00 0.01 0.00 0.00 72.50 69.82 2kzr s THR 21 CO 0.06 -0.19 1.10 -0.13 -0.69 0.00 0.00 174.62 174.77 2kzr s ARG 22 N 6.37 -0.07 0.14 4.92 0.52 -1.26 -2.45 118.95 127.12 2kzr s ARG 22 Ca 0.91 0.33 -0.27 0.00 -0.52 0.00 0.00 55.73 56.18 2kzr s ARG 22 Cb -0.26 -1.70 -0.03 0.00 0.52 0.00 0.00 34.95 33.48 2kzr s ARG 22 CO 0.33 -3.03 1.60 1.25 0.02 0.00 0.00 175.30 175.47 2kzr h LEU 23 N -2.10 -1.13 -1.26 2.53 5.85 -1.25 0.18 115.31 118.14 2kzr h LEU 23 Ca -0.52 0.16 0.24 0.00 0.84 0.00 0.00 57.88 58.60 2kzr h LEU 23 Cb 1.32 0.48 -0.10 0.00 0.37 0.00 0.00 40.66 42.73 2kzr h LEU 23 CO 0.52 -0.38 0.64 0.08 -0.34 0.00 0.00 178.44 178.95 2kzr h ARG 24 N -0.42 0.47 0.11 1.25 0.11 -1.89 -1.17 114.38 112.85 2kzr h ARG 24 Ca 0.09 -0.03 -0.32 0.00 0.10 0.00 0.00 59.98 59.83 2kzr h ARG 24 Cb 0.58 -0.11 -0.01 0.00 1.11 0.00 0.00 29.97 31.54 2kzr h ARG 24 CO -0.39 0.31 -1.63 0.93 0.10 0.00 0.00 179.97 179.30 2kzr h GLU 25 N 0.49 0.23 0.11 0.08 4.39 -1.73 -2.89 114.58 115.26 2kzr h GLU 25 Ca 0.59 -0.40 -0.01 0.00 0.34 0.00 0.00 59.36 59.89 2kzr h GLU 25 Cb 1.33 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 30.13 2kzr h GLU 25 CO -0.33 1.07 -0.05 1.25 -1.16 0.00 0.00 179.01 179.79 2kzr h LEU 26 N 0.06 -0.12 -1.80 1.33 7.12 -0.16 -1.85 115.31 119.90 2kzr h LEU 26 Ca -0.28 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.74 2kzr h LEU 26 Cb 2.02 0.03 0.00 0.00 -0.53 0.00 0.00 40.66 42.18 2kzr h LEU 26 CO 0.14 0.06 0.00 1.56 -0.13 0.00 0.00 178.44 180.07 2kzr h GLN 27 N -0.43 0.00 -0.51 1.25 4.20 -1.46 -1.56 115.11 116.60 2kzr h GLN 27 Ca -0.01 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.57 2kzr h GLN 27 Cb 0.11 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 2kzr h GLN 27 CO 0.02 0.00 -0.18 0.78 -0.67 0.00 0.00 178.83 178.79 2kzr h GLY 28 N 1.51 1.11 0.76 3.46 0.00 -1.56 -1.65 103.07 106.69 2kzr h GLY 28 Ca 0.00 -0.95 -0.11 0.00 0.00 0.00 0.00 47.33 46.27 2kzr h GLY 28 CO 0.00 0.87 -0.36 1.46 0.00 0.00 0.00 176.54 178.51 2kzr h GLN 29 N 0.89 0.41 -0.96 4.80 4.20 -0.43 -3.15 115.11 120.86 2kzr h GLN 29 Ca 0.12 -0.31 0.02 0.00 0.06 0.00 0.00 58.65 58.54 2kzr h GLN 29 Cb 0.76 0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.55 2kzr h GLN 29 CO 0.06 0.94 0.63 0.82 -0.67 0.00 0.00 178.83 180.62 2kzr h ILE 30 N -0.04 1.20 0.00 2.54 2.04 -1.39 0.14 117.51 122.00 2kzr h ILE 30 Ca -0.02 -0.43 -0.01 0.00 1.00 0.00 0.00 64.86 65.40 2kzr h ILE 30 Cb 1.00 -0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 36.91 2kzr h ILE 30 CO 0.08 0.23 -0.07 0.00 0.00 0.00 0.00 178.15 178.39 2kzr h ALA 31 N 1.42 1.44 0.01 1.87 0.00 -1.34 -1.81 119.26 120.85 2kzr h ALA 31 Ca 0.37 -0.06 -0.32 0.00 0.00 0.00 0.00 54.91 54.90 2kzr h ALA 31 Cb -0.07 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 2kzr h ALA 31 CO -0.10 0.08 -1.94 0.00 0.00 0.00 0.00 179.25 177.29 2kzr n ALA 32 N -2.32 1.44 0.04 0.00 0.00 -0.36 -3.30 120.51 116.00 2kzr n ALA 32 Ca -0.02 -0.91 -0.02 0.00 0.00 0.00 0.00 53.44 52.48 2kzr n ALA 32 Cb 0.16 -0.63 -0.01 0.00 0.00 0.00 0.00 19.45 18.97 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 0.01 0.00 -0.00 0.00 1.08 -0.41 -3.39 117.51 114.80 2kzr h ILE 33 Ca -0.38 -0.54 0.00 0.00 -0.39 0.00 0.00 64.86 63.55 2kzr h ILE 33 Cb 2.07 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.82 2kzr h ILE 33 CO 0.06 0.00 -0.89 1.07 -0.69 0.00 0.00 178.15 177.70 2kzr n THR 34 N -3.94 0.00 -1.09 -0.27 5.66 -0.72 -5.00 114.28 108.92 2kzr n THR 34 Ca -0.02 -0.05 -0.01 0.00 -3.05 0.00 0.00 64.05 60.92 2kzr n THR 34 Cb 0.06 1.00 -0.00 0.00 -1.55 0.00 0.00 70.33 69.84 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 1.45 0.45 3.70 1.09 0.00 -1.10 -5.01 105.19 105.76 2kzr n GLY 35 Ca 0.04 -1.03 -0.39 0.00 0.00 0.00 0.00 46.02 44.63 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 -2.04 5.12 0.31 -0.61 -1.09 -1.26 -4.97 121.20 116.66 2kzr s ILE 36 Ca 0.00 1.08 -0.29 0.00 -2.23 0.00 0.00 60.65 59.21 2kzr s ILE 36 Cb 0.00 -3.88 -0.13 0.00 -1.58 0.00 0.00 42.46 36.87 2kzr s ILE 36 CO 0.00 0.25 1.28 0.00 -1.23 0.00 0.00 174.94 175.23 2kzr n ALA 37 N 4.15 1.04 -0.34 9.38 0.00 -1.26 -3.72 120.51 129.76 2kzr n ALA 37 Ca -0.05 0.38 0.10 0.00 0.00 0.00 0.00 53.44 53.87 2kzr n ALA 37 Cb 0.51 -2.22 0.29 0.00 0.00 0.00 0.00 19.45 18.03 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 2.84 0.85 -0.84 0.00 0.13 -1.88 -0.28 132.00 132.82 2kzr h PRO 38 Ca -0.45 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 64.58 2kzr h PRO 38 Cb 1.29 -0.19 -0.03 0.00 0.13 0.00 0.00 31.00 32.20 2kzr h PRO 38 CO 0.65 0.56 0.07 0.41 -0.23 0.00 0.00 178.00 179.46 2kzr n GLY 39 N -1.36 2.44 0.00 1.56 0.00 -1.26 -3.23 105.19 103.33 2kzr n GLY 39 Ca 0.20 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 0.18 0.37 -4.12 1.61 7.64 -0.13 -4.66 113.62 114.50 2kzr n SER 40 Ca 0.17 -0.68 -0.20 0.00 1.01 0.00 0.00 58.87 59.16 2kzr n SER 40 Cb 0.79 0.39 -0.14 0.00 -1.01 0.00 0.00 64.21 64.24 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 -0.39 0.96 0.38 1.43 1.03 -1.13 -1.46 119.66 120.48 2kzr s GLN 41 Ca 0.00 -0.65 0.06 0.00 0.04 0.00 0.00 55.36 54.81 2kzr s GLN 41 Cb 0.00 -0.95 -0.02 0.00 0.03 0.00 0.00 33.01 32.07 2kzr s GLN 41 CO 0.00 0.24 0.21 1.03 -2.54 0.00 0.00 175.29 174.23 2kzr s ARG 42 N -0.85 1.86 -0.81 9.60 0.52 -1.26 -4.89 118.95 123.13 2kzr s ARG 42 Ca 0.03 -2.12 -0.17 0.00 -0.52 0.00 0.00 55.73 52.95 2kzr s ARG 42 Cb -0.07 -0.13 0.16 0.00 0.52 0.00 0.00 34.95 35.42 2kzr s ARG 42 CO 0.01 -0.58 0.90 0.42 0.02 0.00 0.00 175.30 176.06 2kzr s ILE 43 N -3.32 5.06 0.08 1.52 -1.09 -1.25 -4.52 121.20 117.69 2kzr s ILE 43 Ca 0.31 -1.75 0.05 0.00 -2.23 0.00 0.00 60.65 57.04 2kzr s ILE 43 Cb 0.02 -4.60 -0.04 0.00 -1.58 0.00 0.00 42.46 36.26 2kzr s ILE 43 CO 0.21 -1.25 -0.03 -0.76 -1.23 0.00 0.00 174.94 171.88 2kzr s LEU 44 N 1.80 3.32 0.39 2.97 1.43 -1.25 -4.12 118.68 123.21 2kzr s LEU 44 Ca 0.22 -0.23 0.05 0.00 -1.03 0.00 0.00 54.13 53.15 2kzr s LEU 44 Cb -0.11 -2.06 -0.02 0.00 0.03 0.00 0.00 46.19 44.03 2kzr s LEU 44 CO -0.05 0.19 0.20 0.68 0.23 0.00 0.00 176.35 177.59 2kzr s VAL 45 N -1.25 0.31 -1.90 -1.59 -7.23 -1.26 -0.92 120.40 106.55 2kzr s VAL 45 Ca 0.24 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.41 2kzr s VAL 45 Cb -0.11 -2.36 0.00 0.00 0.56 0.00 0.00 36.38 34.47 2kzr s VAL 45 CO 0.16 0.00 0.71 0.61 -0.31 0.00 0.00 175.10 176.27 2kzr n GLY 46 N -0.84 -0.56 3.17 2.32 0.00 -1.21 -4.70 105.19 103.37 2kzr n GLY 46 Ca -0.01 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.90 0.33 -0.52 1.61 1.13 -1.26 -5.12 117.35 111.63 2kzr s TYR 47 Ca 0.00 -0.79 -0.42 0.00 -1.41 0.00 0.00 57.07 54.44 2kzr s TYR 47 Cb 0.00 -0.19 -0.19 0.00 -1.10 0.00 0.00 41.96 40.48 2kzr s TYR 47 CO 0.00 -0.50 2.12 -2.30 -2.51 0.00 0.00 175.55 172.36 2kzr n PRO 48 N -0.02 0.00 -0.41 -3.49 -0.02 -1.26 -4.97 135.00 124.83 2kzr n PRO 48 Ca -0.14 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.29 2kzr n PRO 48 Cb 0.62 -1.47 0.04 0.00 -0.02 0.00 0.00 33.50 32.67 2kzr n PRO 48 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2kzr n PRO 49 N 7.39 -0.22 -0.07 0.52 -0.02 -1.26 -5.02 135.00 136.33 2kzr n PRO 49 Ca 0.54 -0.41 0.05 0.00 -2.02 0.00 0.00 63.50 61.66 2kzr n PRO 49 Cb -0.03 -0.26 0.06 0.00 -0.02 0.00 0.00 33.50 33.25 2kzr n PRO 49 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2kzr n GLU 50 N -1.54 1.81 -3.15 -0.52 -0.58 -1.26 -5.02 120.64 110.38 2kzr n GLU 50 Ca 0.03 -1.89 -0.09 0.00 -0.42 0.00 0.00 57.16 54.80 2kzr n GLU 50 Cb 0.11 -1.16 0.01 0.00 -0.57 0.00 0.00 31.44 29.83 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 -3.68 3.54 -0.21 0.00 1.43 -1.26 -5.00 118.68 113.51 2kzr s LEU 52 Ca 0.09 0.67 -0.13 0.00 -1.03 0.00 0.00 54.13 53.73 2kzr s LEU 52 Cb -0.02 -3.43 -0.05 0.00 0.03 0.00 0.00 46.19 42.72 2kzr s LEU 52 CO 0.79 -1.49 0.26 -0.62 0.23 0.00 0.00 176.35 175.52 2kzr s ASP 53 N 3.95 6.29 -1.11 2.29 -1.08 -1.26 -3.76 116.67 121.99 2kzr s ASP 53 Ca 0.58 0.33 -0.08 0.00 -0.52 0.00 0.00 52.55 52.86 2kzr s ASP 53 Cb -0.12 -2.16 0.28 0.00 -1.46 0.00 0.00 42.92 39.46 2kzr s ASP 53 CO 0.31 0.04 1.15 0.18 0.52 0.00 0.00 175.17 177.37 2kzr n LEU 54 N 4.12 5.59 0.13 -1.34 4.32 -1.26 -4.82 117.00 123.75 2kzr n LEU 54 Ca -0.12 -5.06 -0.01 0.00 -0.02 0.00 0.00 56.01 50.80 2kzr n LEU 54 Cb 0.52 -1.45 0.12 0.00 -1.62 0.00 0.00 43.42 40.99 2kzr n LEU 54 CO 0.38 1.39 0.45 0.28 -1.22 0.00 0.00 177.39 178.67 2kzr h SER 55 N 6.50 0.00 -4.14 -1.43 0.02 -2.03 -3.45 113.55 109.02 2kzr h SER 55 Ca 0.18 0.00 -0.46 0.00 -0.84 0.00 0.00 61.79 60.67 2kzr h SER 55 Cb 0.84 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.39 2kzr h SER 55 CO 1.05 0.64 0.37 -0.62 -1.14 0.00 0.00 176.83 177.13 2kzr s ASP 56 N -6.67 6.57 -0.15 3.07 2.15 -1.26 -5.01 116.67 115.36 2kzr s ASP 56 Ca 0.00 1.68 0.15 0.00 0.43 0.00 0.00 52.55 54.81 2kzr s ASP 56 Cb 0.11 -2.53 -0.21 0.00 -0.30 0.00 0.00 42.92 39.99 2kzr s ASP 56 CO 0.76 -0.62 0.08 -2.11 -0.17 0.00 0.00 175.17 173.11 2kzr n ARG 57 N -1.29 1.21 0.02 4.34 0.00 -1.26 -4.36 116.66 115.32 2kzr n ARG 57 Ca 0.07 -0.02 0.12 0.00 -0.00 0.00 0.00 57.85 58.02 2kzr n ARG 57 Cb 0.54 -1.43 0.22 0.00 -0.00 0.00 0.00 32.46 31.78 2kzr n ARG 57 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 2kzr n ASP 58 N -2.58 0.56 -4.70 2.89 2.03 -1.26 -4.06 116.55 109.43 2kzr n ASP 58 Ca -0.25 -0.12 -0.44 0.00 0.52 0.00 0.00 54.79 54.50 2kzr n ASP 58 Cb 1.00 0.25 -0.02 0.00 -0.72 0.00 0.00 41.12 41.63 2kzr n ASP 58 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kzr n ILE 59 N -1.72 0.81 -4.56 5.18 3.06 -1.26 -4.74 119.36 116.13 2kzr n ILE 59 Ca 0.05 -0.20 -0.32 0.00 -2.50 0.00 0.00 62.75 59.78 2kzr n ILE 59 Cb 0.37 -1.66 -0.06 0.00 0.54 0.00 0.00 39.64 38.84 2kzr n ILE 59 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 2kzr s THR 60 N 0.14 1.22 -0.59 9.51 -4.23 -1.26 -1.09 115.64 119.34 2kzr s THR 60 Ca 0.68 -1.87 0.20 0.00 -1.18 0.00 0.00 61.69 59.52 2kzr s THR 60 Cb -0.60 -2.09 0.21 0.00 1.34 0.00 0.00 72.50 71.36 2kzr s THR 60 CO 0.47 0.00 1.62 0.18 -0.54 0.00 0.00 174.62 176.35 2kzr n LEU 61 N -1.41 0.48 0.16 4.79 4.77 -1.02 -2.07 117.00 122.69 2kzr n LEU 61 Ca -0.16 0.63 0.03 0.00 -0.03 0.00 0.00 56.01 56.48 2kzr n LEU 61 Cb 0.66 -0.58 0.41 0.00 -2.33 0.00 0.00 43.42 41.58 2kzr n LEU 61 CO 0.38 -0.53 0.86 1.23 -1.33 0.00 0.00 177.39 177.99 2kzr h GLY 62 N 1.98 0.14 0.00 -0.72 0.00 -1.83 -3.30 103.07 99.34 2kzr h GLY 62 Ca 0.00 -0.09 -0.05 0.00 0.00 0.00 0.00 47.33 47.19 2kzr h GLY 62 CO 0.00 0.09 -0.39 -1.80 0.00 0.00 0.00 176.54 174.44 2kzr h ASP 63 N 0.13 0.00 -4.13 0.19 1.82 -1.77 -3.48 116.42 109.18 2kzr h ASP 63 Ca 0.02 -0.32 -0.49 0.00 -0.39 0.00 0.00 57.03 55.86 2kzr h ASP 63 Cb 0.42 0.00 0.06 0.00 0.68 0.00 0.00 39.33 40.50 2kzr h ASP 63 CO 0.03 0.87 0.40 -0.76 -1.61 0.00 0.00 179.24 178.17 2kzr s LEU 64 N -8.25 3.65 0.00 2.28 2.01 -1.14 -4.93 118.68 112.30 2kzr s LEU 64 Ca -0.14 1.99 0.00 0.00 0.01 0.00 0.00 54.13 55.99 2kzr s LEU 64 Cb 0.01 -4.56 0.00 0.00 0.01 0.00 0.00 46.19 41.65 2kzr s LEU 64 CO 0.33 -1.16 0.26 -2.65 1.01 0.00 0.00 176.35 174.14 2kzr n PRO 65 N -1.58 0.45 -2.34 1.29 -0.02 -1.26 -4.78 135.00 126.77 2kzr n PRO 65 Ca 0.10 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.15 2kzr n PRO 65 Cb 0.52 -1.23 -0.02 0.00 -0.02 0.00 0.00 33.50 32.74 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 -0.74 4.06 0.46 4.25 1.09 -1.26 -4.95 121.20 124.10 2kzr s ILE 66 Ca 0.00 1.22 0.05 0.00 -1.10 0.00 0.00 60.65 60.82 2kzr s ILE 66 Cb 0.00 -3.98 -0.04 0.00 -1.06 0.00 0.00 42.46 37.37 2kzr s ILE 66 CO 0.00 -0.32 0.05 -1.10 -0.10 0.00 0.00 174.94 173.46 2kzr s GLN 67 N 4.08 2.10 -0.59 2.79 -0.21 -1.26 -4.83 119.66 121.75 2kzr s GLN 67 Ca 0.60 -2.20 -0.27 0.00 0.02 0.00 0.00 55.36 53.51 2kzr s GLN 67 Cb -0.21 -1.66 -0.01 0.00 1.00 0.00 0.00 33.01 32.13 2kzr s GLN 67 CO 0.22 -0.22 1.76 -1.12 -2.12 0.00 0.00 175.29 173.81 2kzr s SER 68 N -3.83 5.51 0.00 5.90 0.01 -1.26 -2.18 113.70 117.84 2kzr s SER 68 Ca 0.24 0.38 0.00 0.00 1.31 0.00 0.00 55.95 57.87 2kzr s SER 68 Cb 0.05 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.75 2kzr s SER 68 CO 0.13 -2.19 0.00 0.61 0.41 0.00 0.00 173.24 172.20 2kzr n GLY 69 N 5.59 0.68 3.87 3.44 0.00 -1.18 -4.84 105.19 112.74 2kzr n GLY 69 Ca 0.18 -0.60 -0.31 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.55 5.72 -0.45 1.61 2.15 -0.93 -4.72 116.67 117.50 2kzr s ASP 70 Ca 0.00 1.30 -0.13 0.00 0.43 0.00 0.00 52.55 54.15 2kzr s ASP 70 Cb 0.00 -2.21 0.08 0.00 -0.30 0.00 0.00 42.92 40.49 2kzr s ASP 70 CO 0.00 -1.19 0.34 -0.32 -0.17 0.00 0.00 175.17 173.84 2kzr s MET 71 N -5.25 2.82 -0.35 4.34 -2.45 -1.26 -1.97 119.30 115.18 2kzr s MET 71 Ca 0.57 -1.42 -0.10 0.00 -1.25 0.00 0.00 55.69 53.49 2kzr s MET 71 Cb -0.11 -3.99 0.02 0.00 1.25 0.00 0.00 34.83 31.99 2kzr s MET 71 CO 0.53 -1.01 0.17 -0.51 1.05 0.00 0.00 175.02 175.25 2kzr s LEU 72 N 1.55 4.44 -0.77 4.11 2.01 -0.53 -3.36 118.68 126.12 2kzr s LEU 72 Ca 0.04 -0.84 -0.25 0.00 0.01 0.00 0.00 54.13 53.09 2kzr s LEU 72 Cb -0.24 -1.99 0.05 0.00 0.01 0.00 0.00 46.19 44.02 2kzr s LEU 72 CO 0.04 -0.31 1.21 -0.63 1.01 0.00 0.00 176.35 177.68 2kzr s ILE 73 N 1.55 3.98 -0.55 -0.59 1.09 -0.10 -0.87 121.20 125.71 2kzr s ILE 73 Ca 0.03 -0.10 -0.28 0.00 -1.10 0.00 0.00 60.65 59.20 2kzr s ILE 73 Cb -0.18 -4.87 0.01 0.00 -1.06 0.00 0.00 42.46 36.36 2kzr s ILE 73 CO 0.06 -1.74 1.48 -0.69 -0.10 0.00 0.00 174.94 173.94 2kzr s VAL 74 N 4.97 3.73 0.83 2.92 1.01 -0.21 -3.92 120.40 129.74 2kzr s VAL 74 Ca 0.33 0.62 -0.12 0.00 0.00 0.00 0.00 61.98 62.81 2kzr s VAL 74 Cb -0.09 -4.35 0.09 0.00 0.00 0.00 0.00 36.38 32.03 2kzr s VAL 74 CO 0.08 -1.10 1.13 -1.83 0.00 0.00 0.00 175.10 173.38 2kzr s GLU 75 N 5.64 1.81 -0.25 2.72 -1.05 -1.26 -4.52 118.70 121.79 2kzr s GLU 75 Ca 0.55 0.40 -0.03 0.00 -0.15 0.00 0.00 54.97 55.74 2kzr s GLU 75 Cb -0.12 -1.91 0.08 0.00 -0.44 0.00 0.00 34.13 31.75 2kzr s GLU 75 CO 0.25 -1.76 0.10 -2.00 0.95 0.00 0.00 175.26 172.80 2kzr s GLU 76 N -5.30 0.36 0.26 -4.83 2.12 -1.23 -4.05 118.70 106.04 2kzr s GLU 76 Ca 0.62 -0.53 0.25 0.00 0.36 0.00 0.00 54.97 55.67 2kzr s GLU 76 Cb -0.14 -1.65 0.70 0.00 0.26 0.00 0.00 34.13 33.30 2kzr s GLU 76 CO 0.53 -0.87 1.73 0.22 -0.54 0.00 0.00 175.26 176.33 2kzr h ASP 77 N 8.31 0.00 -2.17 -1.70 3.58 -1.63 -3.48 116.42 119.34 2kzr h ASP 77 Ca -0.17 -0.00 -0.35 0.00 0.42 0.00 0.00 57.03 56.92 2kzr h ASP 77 Cb 1.06 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 42.07 2kzr h ASP 77 CO 0.40 0.00 -0.43 0.00 -2.88 0.00 0.00 179.24 176.33 2kzr n GLN 78 N -2.43 -1.37 -0.23 0.28 6.02 -1.26 -4.93 117.38 113.46 2kzr n GLN 78 Ca 0.05 0.90 -0.05 0.00 -0.01 0.00 0.00 57.00 57.90 2kzr n GLN 78 Cb 0.45 -5.33 0.11 0.00 1.02 0.00 0.00 30.24 26.49 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 1.25 -6.74 5.09 2.02 -1.89 -3.48 112.91 109.16 2kzr h THR 79 Ca -0.41 -0.82 -0.49 0.00 0.77 0.00 0.00 66.41 65.46 2kzr h THR 79 Cb 1.28 0.45 -0.00 0.00 -1.74 0.00 0.00 68.15 68.13 2kzr h THR 79 CO 0.50 0.33 -1.04 -2.11 0.37 0.00 0.00 175.52 173.56 2kzr n ARG 80 N -4.27 -1.26 -2.91 6.66 1.85 -1.26 -4.98 116.66 110.49 2kzr n ARG 80 Ca 0.06 0.58 -0.41 0.00 -1.00 0.00 0.00 57.85 57.09 2kzr n ARG 80 Cb 0.20 -2.12 -0.04 0.00 -1.05 0.00 0.00 32.46 29.46 2kzr n ARG 80 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2kzr s PRO 81 N -5.26 4.49 -0.50 2.89 0.05 -1.26 -4.98 135.00 130.43 2kzr s PRO 81 Ca 0.08 1.11 -0.02 0.00 0.05 0.00 0.00 61.00 62.22 2kzr s PRO 81 Cb -0.04 -3.45 0.30 0.00 0.05 0.00 0.00 34.50 31.36 2kzr s PRO 81 CO 0.86 0.03 2.09 1.63 0.05 0.00 0.00 177.00 181.66 2kzr n LYS 82 N 3.78 2.26 -0.22 4.56 5.02 -1.26 -4.45 118.16 127.85 2kzr n LYS 82 Ca 0.02 -2.42 -0.07 0.00 -2.02 0.00 0.00 58.31 53.81 2kzr n LYS 82 Cb 0.51 -1.96 0.03 0.00 -0.02 0.00 0.00 35.03 33.59 2kzr n LYS 82 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2kzr h ALA 83 N 1.89 0.79 -2.21 7.82 0.00 -2.04 -3.38 119.26 122.13 2kzr h ALA 83 Ca 0.44 -0.17 -0.48 0.00 0.00 0.00 0.00 54.91 54.70 2kzr h ALA 83 Cb 0.81 -0.24 -0.35 0.00 0.00 0.00 0.00 17.79 18.01 2kzr h ALA 83 CO 1.14 0.41 -0.80 -1.54 0.00 0.00 0.00 179.25 178.45 2kzr s SER 84 N -6.11 1.68 -0.05 0.00 1.04 -1.26 -5.05 113.70 103.94 2kzr s SER 84 Ca -0.13 -2.18 -0.10 0.00 0.48 0.00 0.00 55.95 54.02 2kzr s SER 84 Cb 0.13 0.07 -0.06 0.00 0.10 0.00 0.00 66.02 66.26 2kzr s SER 84 CO 0.80 -0.24 0.44 -0.65 0.98 0.00 0.00 173.24 174.57 2kzr h PRO 85 N 6.55 -0.35 0.00 4.02 0.11 -1.87 -3.47 132.00 136.99 2kzr h PRO 85 Ca 0.11 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.24 2kzr h PRO 85 Cb 0.99 0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2kzr h PRO 85 CO 0.25 -0.24 0.00 0.43 -0.21 0.00 0.00 178.00 178.23