#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 2.89 -2.68 -0.99 1.74 -1.26 -4.08 116.66 112.27 2kzr n ARG 2 Ca 0.00 -2.63 -0.41 0.00 -0.77 0.00 0.00 57.85 54.03 2kzr n ARG 2 Cb 0.00 -3.27 -0.04 0.00 -1.02 0.00 0.00 32.46 28.13 2kzr n ARG 2 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2kzr s VAL 3 N 3.09 4.53 0.18 1.55 1.01 -0.58 -3.71 120.40 126.47 2kzr s VAL 3 Ca 0.47 1.99 -0.25 0.00 0.00 0.00 0.00 61.98 64.19 2kzr s VAL 3 Cb 0.14 -4.27 -0.08 0.00 0.00 0.00 0.00 36.38 32.17 2kzr s VAL 3 CO -0.09 0.25 0.78 -0.13 0.00 0.00 0.00 175.10 175.91 2kzr s ARG 4 N 0.36 4.53 -0.37 2.72 0.52 -0.59 -0.98 118.95 125.14 2kzr s ARG 4 Ca 0.50 1.13 0.02 0.00 -0.52 0.00 0.00 55.73 56.86 2kzr s ARG 4 Cb -0.24 -3.19 0.11 0.00 0.52 0.00 0.00 34.95 32.16 2kzr s ARG 4 CO 0.30 0.53 0.12 0.00 0.02 0.00 0.00 175.30 176.27 2kzr s LYS 6 N 0.88 3.33 -0.12 0.00 2.47 -0.05 -0.47 119.74 125.78 2kzr s LYS 6 Ca 0.13 -0.03 0.01 0.00 -1.56 0.00 0.00 55.97 54.51 2kzr s LYS 6 Cb -0.20 -4.11 0.02 0.00 -1.46 0.00 0.00 37.83 32.08 2kzr s LYS 6 CO -0.11 -1.94 -0.12 0.00 0.16 0.00 0.00 175.35 173.33 2kzr s ALA 7 N 5.38 1.59 -1.17 3.13 0.00 -0.57 -0.67 121.76 129.45 2kzr s ALA 7 Ca 0.38 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.65 2kzr s ALA 7 Cb -0.08 -0.89 0.00 0.00 0.00 0.00 0.00 23.12 22.15 2kzr s ALA 7 CO 0.19 -0.25 0.00 1.63 0.00 0.00 0.00 175.76 177.34 2kzr n LYS 8 N 4.54 -1.09 -0.06 0.00 5.02 -1.26 -1.18 118.16 124.14 2kzr n LYS 8 Ca -0.17 0.85 0.00 0.00 -2.02 0.00 0.00 58.31 56.97 2kzr n LYS 8 Cb 0.51 -4.94 0.00 0.00 -0.02 0.00 0.00 35.03 30.57 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 -0.98 1.27 3.59 0.72 0.00 -1.26 -5.05 105.19 103.49 2kzr n GLY 9 Ca -0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.93 1.92 0.15 -0.02 0.00 -0.33 -5.07 107.32 102.03 2kzr s GLY 10 Ca 0.00 -1.02 -0.30 0.00 0.00 0.00 0.00 44.72 43.40 2kzr s GLY 10 CO 0.00 0.75 0.96 -1.59 0.00 0.00 0.00 173.10 173.21 2kzr s THR 11 N 1.85 4.38 0.51 0.90 2.01 -1.26 -1.51 115.64 122.51 2kzr s THR 11 Ca 0.09 2.07 0.02 0.00 0.31 0.00 0.00 61.69 64.19 2kzr s THR 11 Cb -0.16 -4.32 -0.01 0.00 0.01 0.00 0.00 72.50 68.02 2kzr s THR 11 CO 0.11 0.37 0.05 -1.00 -0.69 0.00 0.00 174.62 173.45 2kzr s HIS 12 N -0.32 1.87 -0.17 4.92 3.76 0.38 -4.92 115.29 120.81 2kzr s HIS 12 Ca 0.45 -0.93 -0.04 0.00 -0.15 0.00 0.00 55.06 54.39 2kzr s HIS 12 Cb -0.24 -1.65 0.08 0.00 1.11 0.00 0.00 32.58 31.88 2kzr s HIS 12 CO 0.30 0.16 0.25 -1.17 -0.85 0.00 0.00 174.74 173.43 2kzr s LEU 13 N -3.92 -0.23 -0.42 0.89 1.98 -1.26 -1.51 118.68 114.21 2kzr s LEU 13 Ca 0.10 0.15 -0.11 0.00 -2.89 0.00 0.00 54.13 51.38 2kzr s LEU 13 Cb 0.01 0.57 0.07 0.00 0.66 0.00 0.00 46.19 47.50 2kzr s LEU 13 CO 0.06 -0.29 0.28 -0.76 -1.89 0.00 0.00 176.35 173.74 2kzr s LEU 14 N 2.38 5.17 0.27 -0.68 1.02 -0.16 -4.93 118.68 121.75 2kzr s LEU 14 Ca 0.05 -1.38 0.24 0.00 0.02 0.00 0.00 54.13 53.06 2kzr s LEU 14 Cb -0.14 -2.03 0.36 0.00 0.02 0.00 0.00 46.19 44.40 2kzr s LEU 14 CO -0.11 -0.53 1.45 1.56 0.02 0.00 0.00 176.35 178.74 2kzr h GLN 15 N 8.48 0.00 -0.97 1.70 4.20 -1.85 -1.53 115.11 125.13 2kzr h GLN 15 Ca -0.24 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.43 2kzr h GLN 15 Cb 1.09 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.85 2kzr h GLN 15 CO 0.77 0.00 0.04 0.41 -0.67 0.00 0.00 178.83 179.38 2kzr n GLY 16 N 1.22 1.99 3.39 3.46 0.00 -1.26 -4.36 105.19 109.63 2kzr n GLY 16 Ca 0.03 -0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.40 3.07 0.43 0.99 1.43 -1.26 -5.05 118.68 117.90 2kzr s LEU 17 Ca 0.07 -0.28 0.07 0.00 -1.03 0.00 0.00 54.13 52.96 2kzr s LEU 17 Cb 0.06 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.47 2kzr s LEU 17 CO 0.02 0.05 0.20 -0.44 0.23 0.00 0.00 176.35 176.41 2kzr s SER 18 N 1.06 4.44 0.24 2.29 0.01 -1.26 -1.61 113.70 118.86 2kzr s SER 18 Ca 0.01 -1.12 -0.06 0.00 1.31 0.00 0.00 55.95 56.09 2kzr s SER 18 Cb -0.15 -0.32 0.30 0.00 0.21 0.00 0.00 66.02 66.06 2kzr s SER 18 CO 0.01 -0.63 1.86 -1.28 0.41 0.00 0.00 173.24 173.61 2kzr h SER 19 N 1.34 0.88 -0.38 2.44 0.87 -1.98 -2.62 113.55 114.09 2kzr h SER 19 Ca -0.42 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.14 2kzr h SER 19 Cb 1.26 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 2kzr h SER 19 CO 0.69 0.58 0.00 0.54 -0.53 0.00 0.00 176.83 178.11 2kzr n ARG 20 N -4.59 3.01 -2.08 2.24 5.12 -1.26 -3.00 116.66 116.10 2kzr n ARG 20 Ca 0.12 -1.85 -0.42 0.00 -1.93 0.00 0.00 57.85 53.76 2kzr n ARG 20 Cb 0.14 -1.79 -0.03 0.00 -1.16 0.00 0.00 32.46 29.62 2kzr n ARG 20 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2kzr s THR 21 N -1.88 3.56 0.98 0.55 2.01 -0.99 -4.83 115.64 115.04 2kzr s THR 21 Ca 0.33 0.83 -0.16 0.00 0.31 0.00 0.00 61.69 63.00 2kzr s THR 21 Cb 0.23 -3.54 0.20 0.00 0.01 0.00 0.00 72.50 69.40 2kzr s THR 21 CO 0.13 -0.04 1.28 -0.13 -0.69 0.00 0.00 174.62 175.17 2kzr s ARG 22 N 3.27 0.52 0.13 4.92 0.52 -1.26 -2.26 118.95 124.78 2kzr s ARG 22 Ca 0.69 -0.31 -0.21 0.00 -0.52 0.00 0.00 55.73 55.39 2kzr s ARG 22 Cb -0.33 -1.82 -0.01 0.00 0.52 0.00 0.00 34.95 33.30 2kzr s ARG 22 CO 0.28 -2.51 1.68 1.25 0.02 0.00 0.00 175.30 176.02 2kzr h LEU 23 N -1.71 -0.33 -1.83 2.53 6.46 -0.96 0.06 115.31 119.53 2kzr h LEU 23 Ca -0.45 0.08 -0.01 0.00 -0.12 0.00 0.00 57.88 57.37 2kzr h LEU 23 Cb 1.25 0.18 -0.00 0.00 -0.73 0.00 0.00 40.66 41.36 2kzr h LEU 23 CO 0.40 -0.13 -0.05 0.08 -0.62 0.00 0.00 178.44 178.12 2kzr h ARG 24 N -0.08 0.05 0.08 1.25 0.11 -1.87 0.79 114.38 114.70 2kzr h ARG 24 Ca 0.10 -0.00 -0.12 0.00 0.10 0.00 0.00 59.98 60.06 2kzr h ARG 24 Cb 0.24 -0.01 0.01 0.00 1.11 0.00 0.00 29.97 31.32 2kzr h ARG 24 CO -0.24 0.10 -0.55 0.93 0.10 0.00 0.00 179.97 180.31 2kzr h GLU 25 N 0.05 0.18 0.15 0.08 3.07 -1.87 -3.22 114.58 113.01 2kzr h GLU 25 Ca 0.01 -0.31 -0.01 0.00 -0.50 0.00 0.00 59.36 58.56 2kzr h GLU 25 Cb 0.12 0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 2kzr h GLU 25 CO 0.01 1.15 -0.07 1.25 -1.40 0.00 0.00 179.01 179.94 2kzr h LEU 26 N -0.62 -0.17 -1.93 1.33 7.12 0.06 0.10 115.31 121.20 2kzr h LEU 26 Ca -0.10 0.01 -0.00 0.00 0.13 0.00 0.00 57.88 57.91 2kzr h LEU 26 Cb 1.40 0.04 -0.00 0.00 -0.53 0.00 0.00 40.66 41.58 2kzr h LEU 26 CO 0.08 -0.11 -0.02 1.56 -0.13 0.00 0.00 178.44 179.82 2kzr h GLN 27 N -0.22 0.00 -0.19 1.25 4.20 -1.14 -1.93 115.11 117.07 2kzr h GLN 27 Ca -0.02 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.50 2kzr h GLN 27 Cb 0.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.93 2kzr h GLN 27 CO 0.03 0.02 -0.63 0.78 -0.67 0.00 0.00 178.83 178.36 2kzr h GLY 28 N 1.35 0.77 1.22 3.46 0.00 -1.54 -2.08 103.07 106.25 2kzr h GLY 28 Ca -0.00 -0.96 -0.23 0.00 0.00 0.00 0.00 47.33 46.13 2kzr h GLY 28 CO 0.00 0.86 -0.84 1.46 0.00 0.00 0.00 176.54 178.02 2kzr h GLN 29 N 0.51 0.75 -0.95 4.80 4.20 -0.11 -2.97 115.11 121.33 2kzr h GLN 29 Ca -0.01 -0.65 0.06 0.00 0.06 0.00 0.00 58.65 58.11 2kzr h GLN 29 Cb 1.22 0.15 -0.06 0.00 0.30 0.00 0.00 27.48 29.09 2kzr h GLN 29 CO 0.13 1.25 0.61 0.82 -0.67 0.00 0.00 178.83 180.97 2kzr h ILE 30 N 0.49 1.09 0.00 2.54 2.04 -1.41 0.21 117.51 122.46 2kzr h ILE 30 Ca -0.07 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.39 2kzr h ILE 30 Cb 1.47 -0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.42 2kzr h ILE 30 CO 0.17 0.20 -0.06 0.00 0.00 0.00 0.00 178.15 178.46 2kzr h ALA 31 N 1.43 1.34 0.03 1.87 0.00 -1.29 -0.94 119.26 121.69 2kzr h ALA 31 Ca 0.41 -0.06 -0.32 0.00 0.00 0.00 0.00 54.91 54.94 2kzr h ALA 31 Cb 0.14 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 2kzr h ALA 31 CO -0.17 0.08 -1.86 0.00 0.00 0.00 0.00 179.25 177.30 2kzr n ALA 32 N -2.27 1.37 -0.02 0.00 0.00 -0.37 -3.44 120.51 115.78 2kzr n ALA 32 Ca -0.02 -0.80 -0.00 0.00 0.00 0.00 0.00 53.44 52.62 2kzr n ALA 32 Cb 0.17 -0.73 -0.00 0.00 0.00 0.00 0.00 19.45 18.89 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 -0.26 -3.40 117.51 114.94 2kzr h ILE 33 Ca -0.35 -0.45 0.00 0.00 -0.39 0.00 0.00 64.86 63.67 2kzr h ILE 33 Cb 2.04 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.79 2kzr h ILE 33 CO 0.07 0.00 -1.55 1.07 -0.69 0.00 0.00 178.15 177.05 2kzr n THR 34 N -3.26 0.02 -0.61 -0.27 5.66 -0.42 -5.00 114.28 110.40 2kzr n THR 34 Ca -0.00 -0.30 0.00 0.00 -3.05 0.00 0.00 64.05 60.70 2kzr n THR 34 Cb 0.00 0.38 0.00 0.00 -1.55 0.00 0.00 70.33 69.16 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 1.35 0.79 3.66 1.09 0.00 -0.84 -5.02 105.19 106.23 2kzr n GLY 35 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 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 -3.06 4.56 0.44 -0.61 -1.09 -1.25 -4.87 121.20 115.31 2kzr s ILE 36 Ca 0.00 1.87 -0.25 0.00 -2.23 0.00 0.00 60.65 60.04 2kzr s ILE 36 Cb 0.00 -4.24 -0.09 0.00 -1.58 0.00 0.00 42.46 36.55 2kzr s ILE 36 CO 0.00 -0.20 1.40 0.00 -1.23 0.00 0.00 174.94 174.91 2kzr n ALA 37 N 6.47 1.90 0.16 9.38 0.00 -1.26 -3.61 120.51 133.55 2kzr n ALA 37 Ca 0.13 0.26 0.16 0.00 0.00 0.00 0.00 53.44 53.99 2kzr n ALA 37 Cb 0.46 -2.37 0.75 0.00 0.00 0.00 0.00 19.45 18.30 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 2.28 0.00 -0.91 0.00 0.13 -1.89 0.10 132.00 131.71 2kzr h PRO 38 Ca -0.50 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.36 2kzr h PRO 38 Cb 1.27 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.25 2kzr h PRO 38 CO 0.61 0.00 0.34 0.41 -0.23 0.00 0.00 178.00 179.12 2kzr n GLY 39 N -1.50 3.44 0.00 1.56 0.00 -1.26 -3.76 105.19 103.67 2kzr n GLY 39 Ca 0.03 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.30 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 -0.35 0.00 -3.78 1.61 7.64 0.34 -4.95 113.62 114.13 2kzr n SER 40 Ca 0.36 -1.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.12 2kzr n SER 40 Cb 1.23 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 64.34 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 0.00 0.61 0.23 1.43 1.03 -1.13 -1.36 119.66 120.48 2kzr s GLN 41 Ca 0.00 -0.18 0.02 0.00 0.04 0.00 0.00 55.36 55.24 2kzr s GLN 41 Cb 0.00 0.27 -0.01 0.00 0.03 0.00 0.00 33.01 33.30 2kzr s GLN 41 CO 0.00 -0.16 0.07 0.54 -2.54 0.00 0.00 175.29 173.20 2kzr n ARG 42 N 1.43 0.81 -3.59 9.60 3.00 -1.26 -4.87 116.66 121.78 2kzr n ARG 42 Ca -0.21 -1.94 -0.41 0.00 -0.01 0.00 0.00 57.85 55.28 2kzr n ARG 42 Cb 0.56 0.98 -0.11 0.00 0.00 0.00 0.00 32.46 33.89 2kzr n ARG 42 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2kzr s ILE 43 N -2.35 4.57 0.14 0.55 -1.09 -1.26 -4.31 121.20 117.45 2kzr s ILE 43 Ca 0.10 -0.89 0.10 0.00 -2.23 0.00 0.00 60.65 57.73 2kzr s ILE 43 Cb 0.00 -3.57 -0.04 0.00 -1.58 0.00 0.00 42.46 37.28 2kzr s ILE 43 CO 0.07 -0.26 -0.23 -0.76 -1.23 0.00 0.00 174.94 172.53 2kzr s LEU 44 N 1.55 2.36 0.33 2.97 1.43 -1.20 -4.38 118.68 121.73 2kzr s LEU 44 Ca 0.02 -0.78 0.03 0.00 -1.03 0.00 0.00 54.13 52.37 2kzr s LEU 44 Cb -0.19 -1.06 -0.04 0.00 0.03 0.00 0.00 46.19 44.92 2kzr s LEU 44 CO 0.07 0.10 0.12 0.68 0.23 0.00 0.00 176.35 177.55 2kzr s VAL 45 N -1.38 0.62 0.15 -1.59 -7.23 -1.26 -0.73 120.40 108.97 2kzr s VAL 45 Ca 0.14 -2.00 -0.18 0.00 -1.81 0.00 0.00 61.98 58.13 2kzr s VAL 45 Cb -0.09 -2.55 0.02 0.00 0.56 0.00 0.00 36.38 34.32 2kzr s VAL 45 CO 0.07 0.00 1.71 1.23 -0.31 0.00 0.00 175.10 177.80 2kzr h GLY 46 N 2.11 0.31 -1.49 2.32 0.00 -1.88 -3.42 103.07 101.01 2kzr h GLY 46 Ca -0.36 0.02 -0.50 0.00 0.00 0.00 0.00 47.33 46.49 2kzr h GLY 46 CO 0.58 -0.06 0.40 -2.52 0.00 0.00 0.00 176.54 174.95 2kzr s TYR 47 N -6.18 3.52 -0.64 5.60 1.13 -1.26 -4.95 117.35 114.57 2kzr s TYR 47 Ca -0.13 1.36 -0.34 0.00 -1.41 0.00 0.00 57.07 56.55 2kzr s TYR 47 Cb 0.12 -2.76 -0.16 0.00 -1.10 0.00 0.00 41.96 38.06 2kzr s TYR 47 CO 0.70 -0.64 2.40 -2.30 -2.51 0.00 0.00 175.55 173.20 2kzr n PRO 48 N -2.39 0.46 -2.42 -3.49 -0.02 -1.26 -4.95 135.00 120.93 2kzr n PRO 48 Ca 0.06 0.08 -0.31 0.00 -2.02 0.00 0.00 63.50 61.31 2kzr n PRO 48 Cb 0.54 -2.08 -0.02 0.00 -0.02 0.00 0.00 33.50 31.92 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 7.52 3.75 0.42 0.52 0.04 -1.26 -5.00 135.00 140.98 2kzr s PRO 49 Ca 1.19 0.65 0.23 0.00 0.04 0.00 0.00 61.00 63.11 2kzr s PRO 49 Cb -1.02 -2.23 0.62 0.00 0.04 0.00 0.00 34.50 31.91 2kzr s PRO 49 CO 0.49 -0.28 1.70 0.93 0.04 0.00 0.00 177.00 179.88 2kzr h GLU 50 N 0.57 0.00 -3.48 4.56 4.39 -1.92 -3.47 114.58 115.23 2kzr h GLU 50 Ca -0.46 0.00 -0.29 0.00 0.34 0.00 0.00 59.36 58.95 2kzr h GLU 50 Cb 1.19 0.00 0.05 0.00 -0.10 0.00 0.00 28.75 29.89 2kzr h GLU 50 CO 0.62 0.20 -0.44 0.00 -1.16 0.00 0.00 179.01 178.23 2kzr n LEU 52 N -3.05 -1.44 -4.54 0.00 -0.00 -1.26 -4.90 117.00 101.81 2kzr n LEU 52 Ca -0.07 1.06 -0.43 0.00 -0.00 0.00 0.00 56.01 56.58 2kzr n LEU 52 Cb 0.58 -0.92 -0.04 0.00 -0.00 0.00 0.00 43.42 43.04 2kzr n LEU 52 CO 0.35 -3.09 0.79 -0.62 -0.00 0.00 0.00 177.39 174.82 2kzr s ASP 53 N -0.98 6.39 -0.77 1.45 2.15 -1.26 -4.70 116.67 118.95 2kzr s ASP 53 Ca 0.62 -0.20 -0.23 0.00 0.43 0.00 0.00 52.55 53.18 2kzr s ASP 53 Cb -0.87 -2.45 0.07 0.00 -0.30 0.00 0.00 42.92 39.37 2kzr s ASP 53 CO 0.56 -1.22 1.11 -0.76 -0.17 0.00 0.00 175.17 174.69 2kzr s LEU 54 N 4.03 4.21 -0.14 -1.34 1.02 -1.26 -4.76 118.68 120.43 2kzr s LEU 54 Ca 0.33 -1.17 0.01 0.00 0.02 0.00 0.00 54.13 53.33 2kzr s LEU 54 Cb -0.11 -2.46 -0.09 0.00 0.02 0.00 0.00 46.19 43.55 2kzr s LEU 54 CO 0.21 -1.44 -0.12 -0.24 0.02 0.00 0.00 176.35 174.78 2kzr n SER 55 N 7.90 2.88 -4.78 2.29 2.88 -1.26 -5.03 113.62 118.50 2kzr n SER 55 Ca 0.07 -0.07 -0.37 0.00 -1.33 0.00 0.00 58.87 57.17 2kzr n SER 55 Cb 0.47 -0.20 -0.04 0.00 -0.75 0.00 0.00 64.21 63.69 2kzr n SER 55 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2kzr s ASP 56 N -5.35 6.87 -0.04 -3.46 2.15 -1.26 -4.98 116.67 110.60 2kzr s ASP 56 Ca -0.19 2.04 0.21 0.00 0.43 0.00 0.00 52.55 55.04 2kzr s ASP 56 Cb 0.05 -2.59 -0.32 0.00 -0.30 0.00 0.00 42.92 39.76 2kzr s ASP 56 CO 0.33 -0.41 0.44 -2.11 -0.17 0.00 0.00 175.17 173.25 2kzr n ARG 57 N 0.12 0.65 0.21 4.34 0.00 -1.26 -4.22 116.66 116.50 2kzr n ARG 57 Ca 0.04 -0.18 0.12 0.00 -0.00 0.00 0.00 57.85 57.83 2kzr n ARG 57 Cb 0.49 -1.51 0.22 0.00 -0.00 0.00 0.00 32.46 31.66 2kzr n ARG 57 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 2kzr h ASP 58 N 0.00 0.00 -2.37 2.89 3.58 -1.98 -3.19 116.42 115.36 2kzr h ASP 58 Ca -0.04 0.00 -0.56 0.00 0.42 0.00 0.00 57.03 56.86 2kzr h ASP 58 Cb 1.05 0.00 0.04 0.00 1.72 0.00 0.00 39.33 42.15 2kzr h ASP 58 CO 0.00 0.00 1.01 0.00 -2.88 0.00 0.00 179.24 177.38 2kzr n ILE 59 N -3.02 0.27 -3.56 2.25 3.06 -1.26 -4.74 119.36 112.35 2kzr n ILE 59 Ca 0.04 -0.05 -0.23 0.00 -2.50 0.00 0.00 62.75 60.01 2kzr n ILE 59 Cb 0.51 -1.91 0.00 0.00 0.54 0.00 0.00 39.64 38.79 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 2.31 2.09 -1.89 9.51 -4.23 -1.26 -0.83 115.64 121.34 2kzr s THR 60 Ca 0.82 -1.32 0.22 0.00 -1.18 0.00 0.00 61.69 60.24 2kzr s THR 60 Cb -0.57 -2.41 0.59 0.00 1.34 0.00 0.00 72.50 71.45 2kzr s THR 60 CO 0.39 0.00 1.71 0.18 -0.54 0.00 0.00 174.62 176.37 2kzr n LEU 61 N -1.82 0.00 -0.07 4.79 4.77 -0.96 -1.36 117.00 122.35 2kzr n LEU 61 Ca 0.04 0.05 -0.13 0.00 -0.03 0.00 0.00 56.01 55.95 2kzr n LEU 61 Cb 0.63 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.65 2kzr n LEU 61 CO 0.40 -0.02 0.47 1.23 -1.33 0.00 0.00 177.39 178.14 2kzr h GLY 62 N 3.52 0.89 0.08 -0.72 0.00 -1.88 -3.37 103.07 101.59 2kzr h GLY 62 Ca 0.00 -1.01 -0.29 0.00 0.00 0.00 0.00 47.33 46.03 2kzr h GLY 62 CO 0.00 0.91 -1.56 1.34 0.00 0.00 0.00 176.54 177.23 2kzr n ASP 63 N -4.01 1.91 -4.77 0.19 2.03 -0.90 -4.93 116.55 106.08 2kzr n ASP 63 Ca -0.04 0.37 -0.41 0.00 0.52 0.00 0.00 54.79 55.23 2kzr n ASP 63 Cb 0.61 -0.92 -0.00 0.00 -0.72 0.00 0.00 41.12 40.08 2kzr n ASP 63 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2kzr n LEU 64 N -4.26 4.73 -1.77 -2.67 4.77 -0.46 -4.90 117.00 112.42 2kzr n LEU 64 Ca -0.36 1.22 -0.06 0.00 -0.03 0.00 0.00 56.01 56.78 2kzr n LEU 64 Cb 0.76 -1.62 -0.08 0.00 -2.33 0.00 0.00 43.42 40.15 2kzr n LEU 64 CO 0.20 0.16 1.27 -2.65 -1.33 0.00 0.00 177.39 175.04 2kzr n PRO 65 N 0.71 1.45 -3.28 3.23 -0.02 -1.26 -4.62 135.00 131.20 2kzr n PRO 65 Ca 0.02 -0.49 -0.40 0.00 -2.02 0.00 0.00 63.50 60.62 2kzr n PRO 65 Cb 0.39 -1.51 -0.08 0.00 -0.02 0.00 0.00 33.50 32.28 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 0.59 5.09 0.37 4.25 1.09 -1.26 -4.93 121.20 126.40 2kzr s ILE 66 Ca 0.33 0.74 0.08 0.00 -1.10 0.00 0.00 60.65 60.70 2kzr s ILE 66 Cb 0.16 -3.81 -0.06 0.00 -1.06 0.00 0.00 42.46 37.69 2kzr s ILE 66 CO 0.00 0.08 0.04 -1.10 -0.10 0.00 0.00 174.94 173.86 2kzr s GLN 67 N 2.25 2.07 -0.28 2.79 -1.52 -1.26 -4.86 119.66 118.85 2kzr s GLN 67 Ca 0.19 -1.84 -0.28 0.00 -1.95 0.00 0.00 55.36 51.48 2kzr s GLN 67 Cb -0.16 -1.88 -0.03 0.00 -0.22 0.00 0.00 33.01 30.72 2kzr s GLN 67 CO 0.10 0.05 1.98 -1.54 -0.25 0.00 0.00 175.29 175.63 2kzr s SER 68 N -3.75 5.70 -0.00 5.90 1.04 -1.26 -2.18 113.70 119.14 2kzr s SER 68 Ca 0.36 1.55 0.00 0.00 0.48 0.00 0.00 55.95 58.34 2kzr s SER 68 Cb 0.03 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.63 2kzr s SER 68 CO 0.20 -1.82 0.00 0.61 0.98 0.00 0.00 173.24 173.20 2kzr n GLY 69 N 5.57 0.46 3.83 7.32 0.00 -1.24 -4.93 105.19 116.21 2kzr n GLY 69 Ca 0.26 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.01 5.73 -0.64 1.61 2.15 -0.93 -4.37 116.67 118.21 2kzr s ASP 70 Ca 0.00 1.58 -0.24 0.00 0.43 0.00 0.00 52.55 54.32 2kzr s ASP 70 Cb 0.00 -2.49 0.05 0.00 -0.30 0.00 0.00 42.92 40.18 2kzr s ASP 70 CO 0.00 -1.20 1.01 -0.32 -0.17 0.00 0.00 175.17 174.49 2kzr s MET 71 N -4.94 3.20 -0.35 4.34 -2.45 -1.26 -1.54 119.30 116.30 2kzr s MET 71 Ca 0.58 -0.54 -0.12 0.00 -1.25 0.00 0.00 55.69 54.35 2kzr s MET 71 Cb -0.13 -4.16 0.00 0.00 1.25 0.00 0.00 34.83 31.79 2kzr s MET 71 CO 0.52 -1.77 0.22 -0.51 1.05 0.00 0.00 175.02 174.53 2kzr s LEU 72 N 4.32 4.59 -0.66 4.11 2.01 -0.45 -2.42 118.68 130.17 2kzr s LEU 72 Ca 0.27 -0.67 -0.22 0.00 0.01 0.00 0.00 54.13 53.51 2kzr s LEU 72 Cb -0.14 -2.08 0.07 0.00 0.01 0.00 0.00 46.19 44.05 2kzr s LEU 72 CO 0.14 -0.30 0.95 -0.63 1.01 0.00 0.00 176.35 177.52 2kzr s ILE 73 N 1.65 4.35 -0.55 -0.59 1.09 0.09 -0.87 121.20 126.37 2kzr s ILE 73 Ca 0.05 -0.41 -0.28 0.00 -1.10 0.00 0.00 60.65 58.90 2kzr s ILE 73 Cb -0.18 -4.68 0.02 0.00 -1.06 0.00 0.00 42.46 36.56 2kzr s ILE 73 CO 0.08 -1.44 1.38 -0.69 -0.10 0.00 0.00 174.94 174.18 2kzr s VAL 74 N 3.97 3.83 0.47 2.92 1.01 0.16 -3.26 120.40 129.50 2kzr s VAL 74 Ca 0.22 0.73 -0.21 0.00 0.00 0.00 0.00 61.98 62.72 2kzr s VAL 74 Cb -0.17 -4.45 -0.09 0.00 0.00 0.00 0.00 36.38 31.67 2kzr s VAL 74 CO 0.10 -1.15 1.01 -1.83 0.00 0.00 0.00 175.10 173.23 2kzr s GLU 75 N 5.37 3.94 -0.39 2.72 -1.05 -1.26 -3.97 118.70 124.06 2kzr s GLU 75 Ca 0.52 1.30 -0.06 0.00 -0.15 0.00 0.00 54.97 56.58 2kzr s GLU 75 Cb -0.11 -2.14 0.08 0.00 -0.44 0.00 0.00 34.13 31.53 2kzr s GLU 75 CO 0.26 -0.31 0.18 -2.00 0.95 0.00 0.00 175.26 174.34 2kzr s GLU 76 N -3.19 2.41 0.00 -4.83 2.12 -1.26 -4.14 118.70 109.81 2kzr s GLU 76 Ca 0.65 -1.49 0.25 0.00 0.36 0.00 0.00 54.97 54.74 2kzr s GLU 76 Cb -0.14 -3.58 1.26 0.00 0.26 0.00 0.00 34.13 31.92 2kzr s GLU 76 CO 0.18 -0.89 1.83 -3.47 -0.54 0.00 0.00 175.26 172.37 2kzr n ASP 77 N 4.76 0.00 0.00 -1.70 2.03 -0.46 -4.96 116.55 116.22 2kzr n ASP 77 Ca -0.09 -0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.13 2kzr n ASP 77 Cb 0.43 -0.27 0.00 0.00 -0.72 0.00 0.00 41.12 40.55 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 -1.27 0.00 0.00 -0.67 6.02 -1.26 -4.86 117.38 115.33 2kzr n GLN 78 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 2kzr n GLN 78 Cb 0.19 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.45 2kzr n GLN 78 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 2kzr n THR 79 N 0.00 0.00 -2.23 5.09 5.66 -1.26 -4.75 114.28 116.79 2kzr n THR 79 Ca 0.00 0.00 -0.03 0.00 -3.05 0.00 0.00 64.05 60.97 2kzr n THR 79 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 2kzr n THR 79 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2kzr n ARG 80 N 0.00 -1.02 0.00 1.09 5.12 -1.26 -5.10 116.66 115.49 2kzr n ARG 80 Ca 0.00 1.22 0.00 0.00 -1.93 0.00 0.00 57.85 57.14 2kzr n ARG 80 Cb 0.00 -3.65 0.00 0.00 -1.16 0.00 0.00 32.46 27.65 2kzr n ARG 80 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 2kzr n PRO 81 N -0.75 2.58 0.03 5.56 -0.04 -1.26 -4.95 135.00 136.16 2kzr n PRO 81 Ca 0.04 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.53 2kzr n PRO 81 Cb 0.33 0.00 0.41 0.00 -0.04 0.00 0.00 33.50 34.20 2kzr n PRO 81 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2kzr h LYS 82 N 0.00 0.48 0.00 0.54 1.57 -2.01 -3.46 116.57 113.69 2kzr h LYS 82 Ca 0.00 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2kzr h LYS 82 Cb 0.00 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.21 2kzr h LYS 82 CO 0.00 0.37 0.00 0.00 -0.57 0.00 0.00 179.45 179.25 2kzr n ALA 83 N -2.48 0.00 -2.55 3.86 0.00 -1.26 -4.66 120.51 113.41 2kzr n ALA 83 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.04 2kzr n ALA 83 Cb 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.49 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 -1.15 6.37 0.00 0.00 0.01 -1.26 -4.86 113.70 112.81 2kzr s SER 84 Ca 0.00 -0.02 0.29 0.00 1.31 0.00 0.00 55.95 57.53 2kzr s SER 84 Cb 0.00 -2.31 1.34 0.00 0.21 0.00 0.00 66.02 65.26 2kzr s SER 84 CO 0.00 -0.61 1.97 -0.81 0.41 0.00 0.00 173.24 174.20 2kzr n PRO 85 N 6.02 0.18 0.00 12.44 -0.04 -1.26 -5.22 135.00 147.11 2kzr n PRO 85 Ca -0.02 -0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.54 2kzr n PRO 85 Cb 0.48 -1.50 0.62 0.00 -0.04 0.00 0.00 33.50 33.06 2kzr n PRO 85 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33