#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1czp s THR 2 N 0.00 1.01 -0.11 0.00 2.01 -1.26 -1.63 115.64 115.67 1czp s THR 2 Ca 0.00 -0.32 -0.04 0.00 0.31 0.00 0.00 61.69 61.65 1czp s THR 2 Cb 0.00 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 1czp s THR 2 CO 0.00 0.36 0.04 -0.36 -0.69 0.00 0.00 174.62 173.96 1czp s PHE 3 N 1.43 3.27 -0.03 4.92 0.08 0.03 -4.87 117.98 122.80 1czp s PHE 3 Ca -0.00 0.24 -0.30 0.00 0.12 0.00 0.00 56.93 56.98 1czp s PHE 3 Cb -0.13 -1.86 -0.03 0.00 -0.57 0.00 0.00 43.02 40.42 1czp s PHE 3 CO -0.05 0.48 1.09 0.21 -0.10 0.00 0.00 175.22 176.84 1czp s LYS 4 N -0.73 4.45 -0.06 0.44 2.20 -1.26 -0.41 119.74 124.37 1czp s LYS 4 Ca 0.12 1.55 0.02 0.00 -0.36 0.00 0.00 55.97 57.30 1czp s LYS 4 Cb -0.12 -3.48 0.01 0.00 -1.51 0.00 0.00 37.83 32.74 1czp s LYS 4 CO 0.02 -0.25 -0.11 0.54 -0.36 0.00 0.00 175.35 175.19 1czp s VAL 5 N 1.56 1.02 -0.27 4.02 0.11 -0.09 -0.90 120.40 125.85 1czp s VAL 5 Ca 0.53 -0.41 -0.09 0.00 -2.93 0.00 0.00 61.98 59.08 1czp s VAL 5 Cb -0.23 -0.94 -0.04 0.00 -1.53 0.00 0.00 36.38 33.64 1czp s VAL 5 CO 0.24 0.33 0.14 -0.89 -3.33 0.00 0.00 175.10 171.59 1czp s THR 6 N 0.70 4.86 -0.27 5.04 2.01 0.19 -0.79 115.64 127.38 1czp s THR 6 Ca -0.14 -0.00 -0.15 0.00 0.31 0.00 0.00 61.69 61.71 1czp s THR 6 Cb -0.15 -3.31 -0.04 0.00 0.01 0.00 0.00 72.50 69.01 1czp s THR 6 CO 0.03 0.28 0.37 -0.76 -0.69 0.00 0.00 174.62 173.85 1czp s LEU 7 N 1.69 4.04 -0.21 4.42 1.43 0.93 -0.97 118.68 130.01 1czp s LEU 7 Ca 0.07 0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 53.44 1czp s LEU 7 Cb -0.16 -2.42 0.01 0.00 0.03 0.00 0.00 46.19 43.65 1czp s LEU 7 CO 0.08 -0.18 -0.11 -0.63 0.23 0.00 0.00 176.35 175.73 1czp s ILE 8 N 2.06 2.72 -0.52 -0.59 1.01 -0.11 -0.79 121.20 124.99 1czp s ILE 8 Ca 0.15 -0.79 -0.13 0.00 0.00 0.00 0.00 60.65 59.88 1czp s ILE 8 Cb -0.16 -2.24 0.13 0.00 0.01 0.00 0.00 42.46 40.20 1czp s ILE 8 CO 0.10 0.42 0.45 0.21 0.00 0.00 0.00 174.94 176.12 1czp s ASN 9 N 1.37 6.00 0.29 3.58 3.04 -0.09 -0.69 114.94 128.45 1czp s ASN 9 Ca 0.04 -1.88 0.09 0.00 0.04 0.00 0.00 52.86 51.16 1czp s ASN 9 Cb -0.14 -2.13 0.45 0.00 -1.54 0.00 0.00 41.25 37.89 1czp s ASN 9 CO -0.08 -0.78 1.68 -0.33 -3.04 0.00 0.00 177.10 174.55 1czp h GLU 10 N 8.67 0.10 0.00 0.43 5.08 -1.83 0.33 114.58 127.36 1czp h GLU 10 Ca -0.25 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 57.96 1czp h GLU 10 Cb 1.09 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 1czp h GLU 10 CO 0.96 0.59 -0.43 0.00 -1.00 0.00 0.00 179.01 179.13 1czp h ALA 11 N 1.40 1.13 0.00 3.43 0.00 -1.91 -2.92 119.26 120.39 1czp h ALA 11 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1czp h ALA 11 Cb 0.92 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1czp h ALA 11 CO 0.07 0.53 -1.15 0.39 0.00 0.00 0.00 179.25 179.10 1czp n GLU 12 N -3.79 0.12 -3.32 0.00 -0.58 -1.02 -4.99 120.64 107.06 1czp n GLU 12 Ca -0.01 -0.03 -0.17 0.00 -0.42 0.00 0.00 57.16 56.53 1czp n GLU 12 Cb 0.49 -1.51 0.08 0.00 -0.57 0.00 0.00 31.44 29.93 1czp n GLU 12 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1czp n GLY 13 N 1.45 -0.29 3.49 0.62 0.00 0.11 -5.04 105.19 105.53 1czp n GLY 13 Ca 0.03 0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 1czp n GLY 13 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1czp s THR 14 N -3.30 2.89 -0.13 2.61 -4.23 -0.81 -4.98 115.64 107.69 1czp s THR 14 Ca 0.18 -1.44 0.00 0.00 -1.18 0.00 0.00 61.69 59.25 1czp s THR 14 Cb -0.08 -2.32 0.02 0.00 1.34 0.00 0.00 72.50 71.47 1czp s THR 14 CO 0.64 0.13 -0.12 -0.75 -0.54 0.00 0.00 174.62 173.97 1czp s LYS 15 N -2.07 2.07 -0.08 3.99 2.20 -1.26 -0.91 119.74 123.68 1czp s LYS 15 Ca 0.18 -0.47 0.04 0.00 -0.36 0.00 0.00 55.97 55.35 1czp s LYS 15 Cb -0.11 -1.93 0.00 0.00 -1.51 0.00 0.00 37.83 34.29 1czp s LYS 15 CO 0.10 -0.22 -0.19 -1.01 -0.36 0.00 0.00 175.35 173.66 1czp s HIS 16 N 1.48 2.10 -0.19 4.03 3.76 0.03 -4.98 115.29 121.53 1czp s HIS 16 Ca 0.03 -0.79 -0.07 0.00 -0.15 0.00 0.00 55.06 54.08 1czp s HIS 16 Cb -0.13 -1.43 -0.04 0.00 1.11 0.00 0.00 32.58 32.09 1czp s HIS 16 CO -0.09 -0.33 0.04 -2.00 -0.85 0.00 0.00 174.74 171.52 1czp s GLU 17 N 0.37 3.86 0.30 1.40 2.12 -1.26 -0.05 118.70 125.45 1czp s GLU 17 Ca -0.15 -0.40 0.06 0.00 0.36 0.00 0.00 54.97 54.84 1czp s GLU 17 Cb -0.16 -3.18 -0.06 0.00 0.26 0.00 0.00 34.13 30.99 1czp s GLU 17 CO 0.06 0.19 -0.02 0.96 -0.54 0.00 0.00 175.26 175.91 1czp s ILE 18 N 0.58 1.56 -0.14 -3.70 -4.36 0.03 -4.99 121.20 110.18 1czp s ILE 18 Ca 0.02 -2.08 0.01 0.00 -0.26 0.00 0.00 60.65 58.34 1czp s ILE 18 Cb -0.13 -2.59 0.00 0.00 1.25 0.00 0.00 42.46 40.99 1czp s ILE 18 CO 0.02 -0.20 -0.18 -1.61 0.24 0.00 0.00 174.94 173.21 1czp s GLU 19 N -3.77 3.15 -0.16 0.37 0.41 -1.26 -0.91 118.70 116.53 1czp s GLU 19 Ca 0.32 -0.79 0.00 0.00 -0.41 0.00 0.00 54.97 54.09 1czp s GLU 19 Cb 0.06 -2.53 0.03 0.00 -1.78 0.00 0.00 34.13 29.90 1czp s GLU 19 CO 0.13 0.04 -0.11 0.08 -0.49 0.00 0.00 175.26 174.91 1czp s VAL 20 N 0.73 1.44 0.57 2.63 1.01 0.45 -4.93 120.40 122.31 1czp s VAL 20 Ca -0.08 -0.65 -0.20 0.00 0.00 0.00 0.00 61.98 61.05 1czp s VAL 20 Cb -0.16 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 1czp s VAL 20 CO 0.01 0.34 1.05 -2.65 0.00 0.00 0.00 175.10 173.85 1czp n PRO 21 N 4.79 1.08 0.12 2.72 -0.02 -1.26 -0.79 135.00 141.64 1czp n PRO 21 Ca -0.15 0.41 0.09 0.00 -2.02 0.00 0.00 63.50 61.83 1czp n PRO 21 Cb 0.49 -2.23 0.45 0.00 -0.02 0.00 0.00 33.50 32.19 1czp n PRO 21 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1czp n ASP 22 N -0.70 0.47 -0.61 2.55 5.68 -0.64 -1.77 116.55 121.52 1czp n ASP 22 Ca 0.13 0.68 0.05 0.00 -0.50 0.00 0.00 54.79 55.15 1czp n ASP 22 Cb 0.46 -0.75 0.19 0.00 -1.14 0.00 0.00 41.12 39.88 1czp n ASP 22 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1czp n ASP 23 N -2.09 2.20 -4.17 -1.12 3.85 -1.26 -4.69 116.55 109.27 1czp n ASP 23 Ca 0.00 -3.61 -0.23 0.00 -0.71 0.00 0.00 54.79 50.24 1czp n ASP 23 Cb 0.09 -0.53 -0.14 0.00 -1.35 0.00 0.00 41.12 39.19 1czp n ASP 23 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 1czp s GLU 24 N -3.12 1.22 0.45 0.11 2.12 -0.73 -5.11 118.70 113.64 1czp s GLU 24 Ca 0.38 -0.72 -0.23 0.00 0.36 0.00 0.00 54.97 54.76 1czp s GLU 24 Cb 0.35 -1.24 -0.07 0.00 0.26 0.00 0.00 34.13 33.43 1czp s GLU 24 CO -0.02 0.32 1.17 0.71 -0.54 0.00 0.00 175.26 176.91 1czp s TYR 25 N -0.61 2.88 0.17 5.30 2.02 -1.26 -4.40 117.35 121.45 1czp s TYR 25 Ca 0.05 1.53 -0.14 0.00 -0.37 0.00 0.00 57.07 58.14 1czp s TYR 25 Cb -0.07 -3.39 0.10 0.00 -0.40 0.00 0.00 41.96 38.20 1czp s TYR 25 CO 0.00 -1.52 1.77 0.82 -1.57 0.00 0.00 175.55 175.05 1czp h ILE 26 N 1.92 0.92 -0.42 2.71 2.04 -1.09 -2.57 117.51 121.03 1czp h ILE 26 Ca -0.49 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.24 1czp h ILE 26 Cb 1.25 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 1czp h ILE 26 CO 0.60 0.07 0.27 0.25 0.00 0.00 0.00 178.15 179.35 1czp h LEU 27 N 0.38 0.48 -0.77 1.44 5.85 -1.68 -0.86 115.31 120.16 1czp h LEU 27 Ca 0.20 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.92 1czp h LEU 27 Cb 0.14 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 1czp h LEU 27 CO -0.17 0.36 0.50 0.44 -0.34 0.00 0.00 178.44 179.23 1czp h ASP 28 N 0.56 0.85 -0.37 1.25 3.45 -1.78 -1.74 116.42 118.64 1czp h ASP 28 Ca 0.15 -0.01 -0.07 0.00 0.43 0.00 0.00 57.03 57.53 1czp h ASP 28 Cb -0.05 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 38.50 1czp h ASP 28 CO -0.03 0.60 -0.03 0.00 -1.57 0.00 0.00 179.24 178.20 1czp h ALA 29 N 1.30 0.50 -0.29 3.45 0.00 -1.13 -1.64 119.26 121.46 1czp h ALA 29 Ca 0.29 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.97 1czp h ALA 29 Cb -0.05 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1czp h ALA 29 CO -0.09 0.31 0.06 0.00 0.00 0.00 0.00 179.25 179.53 1czp h ALA 30 N 0.85 0.31 -0.52 0.00 0.00 -0.85 -1.64 119.26 117.41 1czp h ALA 30 Ca 0.10 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1czp h ALA 30 Cb 0.51 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1czp h ALA 30 CO 0.03 -0.35 0.21 0.93 0.00 0.00 0.00 179.25 180.07 1czp h GLU 31 N 0.17 0.77 -0.25 0.00 5.08 -1.19 -0.34 114.58 118.82 1czp h GLU 31 Ca 0.13 -0.14 0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1czp h GLU 31 Cb 0.14 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1czp h GLU 31 CO -0.17 0.68 0.17 0.93 -1.00 0.00 0.00 179.01 179.62 1czp h GLU 32 N 0.70 0.23 -0.27 2.33 5.08 -0.95 -1.64 114.58 120.06 1czp h GLU 32 Ca 0.17 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1czp h GLU 32 Cb 0.19 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1czp h GLU 32 CO -0.02 0.15 0.00 1.04 -1.00 0.00 0.00 179.01 179.19 1czp n GLN 33 N -4.50 1.78 0.00 2.33 6.02 -0.65 -4.91 117.38 117.46 1czp n GLN 33 Ca 0.02 -1.20 0.00 0.00 -0.01 0.00 0.00 57.00 55.80 1czp n GLN 33 Cb 0.15 -1.33 0.00 0.00 1.02 0.00 0.00 30.24 30.08 1czp n GLN 33 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1czp n GLY 34 N 1.10 0.99 3.05 1.08 0.00 -0.61 -5.05 105.19 105.74 1czp n GLY 34 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1czp n GLY 34 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1czp s TYR 35 N -2.00 3.61 0.29 1.61 2.02 -0.20 -5.00 117.35 117.68 1czp s TYR 35 Ca 0.00 -2.73 -0.29 0.00 -0.37 0.00 0.00 57.07 53.68 1czp s TYR 35 Cb 0.00 -2.69 -0.10 0.00 -0.40 0.00 0.00 41.96 38.77 1czp s TYR 35 CO 0.00 -0.93 1.28 -0.51 -1.57 0.00 0.00 175.55 173.82 1czp s ASP 36 N 1.07 6.88 0.04 2.29 1.01 -1.26 -3.09 116.67 123.61 1czp s ASP 36 Ca 0.05 2.56 -0.00 0.00 0.71 0.00 0.00 52.55 55.87 1czp s ASP 36 Cb -0.20 -2.64 -0.03 0.00 1.01 0.00 0.00 42.92 41.07 1czp s ASP 36 CO -0.07 -0.47 -0.04 -0.76 0.21 0.00 0.00 175.17 174.05 1czp s LEU 37 N -1.32 2.39 0.45 1.23 1.43 -1.26 -5.04 118.68 116.55 1czp s LEU 37 Ca 0.50 -0.79 -0.25 0.00 -1.03 0.00 0.00 54.13 52.56 1czp s LEU 37 Cb -0.38 0.11 -0.08 0.00 0.03 0.00 0.00 46.19 45.88 1czp s LEU 37 CO 0.47 -0.45 1.31 -2.16 0.23 0.00 0.00 176.35 175.75 1czp s PRO 38 N -2.87 3.74 0.12 1.29 0.04 -1.26 -5.01 135.00 131.03 1czp s PRO 38 Ca -0.02 2.15 -0.25 0.00 0.04 0.00 0.00 61.00 62.92 1czp s PRO 38 Cb 0.00 -2.59 0.07 0.00 0.04 0.00 0.00 34.50 32.02 1czp s PRO 38 CO -0.06 -0.68 0.79 -0.59 0.04 0.00 0.00 177.00 176.50 1czp s PHE 39 N -1.31 -0.34 0.00 0.56 -0.71 -1.26 -3.87 117.98 111.05 1czp s PHE 39 Ca 0.61 0.10 0.00 0.00 -1.04 0.00 0.00 56.93 56.61 1czp s PHE 39 Cb -0.38 0.59 0.00 0.00 -1.21 0.00 0.00 43.02 42.02 1czp s PHE 39 CO 0.47 -0.79 0.00 0.45 -1.34 0.00 0.00 175.22 174.01 1czp n SER 40 N -0.36 0.00 0.12 1.98 2.88 -1.26 -4.94 113.62 112.04 1czp n SER 40 Ca -0.10 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.43 1czp n SER 40 Cb 0.62 0.01 0.09 0.00 -0.75 0.00 0.00 64.21 64.19 1czp n SER 40 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1czp n ARG 42 N -3.55 -1.83 -0.03 0.00 1.74 -1.26 -4.83 116.66 106.90 1czp n ARG 42 Ca -0.00 0.81 0.00 0.00 -0.77 0.00 0.00 57.85 57.89 1czp n ARG 42 Cb 0.71 -5.35 0.01 0.00 -1.02 0.00 0.00 32.46 26.80 1czp n ARG 42 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1czp n ALA 43 N -1.37 1.43 -1.29 7.54 0.00 -1.26 -4.90 120.51 120.67 1czp n ALA 43 Ca -0.18 -0.77 -0.06 0.00 0.00 0.00 0.00 53.44 52.43 1czp n ALA 43 Cb 0.61 -0.05 -0.02 0.00 0.00 0.00 0.00 19.45 19.99 1czp n ALA 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1czp n GLY 44 N -0.21 0.76 0.25 0.00 0.00 -1.26 -4.77 105.19 99.95 1czp n GLY 44 Ca 0.01 -0.76 0.08 0.00 0.00 0.00 0.00 46.02 45.35 1czp n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1czp n ALA 45 N 0.82 2.61 -0.19 4.61 0.00 -1.26 -0.91 120.51 126.20 1czp n ALA 45 Ca -0.06 -2.73 0.00 0.00 0.00 0.00 0.00 53.44 50.65 1czp n ALA 45 Cb 0.24 -0.38 0.00 0.00 0.00 0.00 0.00 19.45 19.31 1czp n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1czp n SER 47 N 0.00 0.00 -0.11 0.00 3.41 -1.26 -4.93 113.62 110.73 1czp n SER 47 Ca 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 58.87 58.62 1czp n SER 47 Cb 0.00 0.00 0.29 0.00 -0.26 0.00 0.00 64.21 64.24 1czp n SER 47 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1czp h THR 48 N 0.00 1.18 -0.37 6.66 2.02 -1.95 -2.38 112.91 118.07 1czp h THR 48 Ca 0.00 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 66.72 1czp h THR 48 Cb 0.00 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 1czp h THR 48 CO 0.00 0.20 0.00 0.00 0.37 0.00 0.00 175.52 176.09 1czp s ALA 50 N -1.78 3.33 0.36 0.00 0.00 -0.89 -2.98 121.76 119.80 1czp s ALA 50 Ca 0.30 1.42 0.03 0.00 0.00 0.00 0.00 51.96 53.72 1czp s ALA 50 Cb 0.20 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 1czp s ALA 50 CO 0.14 -1.04 0.10 0.20 0.00 0.00 0.00 175.76 175.15 1czp s GLY 51 N -0.49 2.29 -0.10 0.00 0.00 0.38 -1.49 107.32 107.91 1czp s GLY 51 Ca 0.58 -1.62 -0.00 0.00 0.00 0.00 0.00 44.72 43.67 1czp s GLY 51 CO 0.56 -1.79 -0.07 1.25 0.00 0.00 0.00 173.10 173.05 1czp s LYS 52 N -3.82 1.40 0.35 2.90 2.20 0.44 -0.94 119.74 122.27 1czp s LYS 52 Ca 0.30 -0.22 -0.29 0.00 -0.36 0.00 0.00 55.97 55.40 1czp s LYS 52 Cb 0.05 -1.45 -0.11 0.00 -1.51 0.00 0.00 37.83 34.81 1czp s LYS 52 CO 0.15 -0.22 1.51 -0.51 -0.36 0.00 0.00 175.35 175.92 1czp s LEU 53 N 1.56 4.33 -0.26 5.43 1.43 0.31 -0.42 118.68 131.06 1czp s LEU 53 Ca 0.02 3.00 -0.10 0.00 -1.03 0.00 0.00 54.13 56.01 1czp s LEU 53 Cb -0.13 -3.66 -0.15 0.00 0.03 0.00 0.00 46.19 42.29 1czp s LEU 53 CO -0.06 -0.87 -0.25 0.52 0.23 0.00 0.00 176.35 175.93 1czp n VAL 54 N 1.05 1.53 -3.72 -1.59 0.31 0.82 -4.87 118.33 111.86 1czp n VAL 54 Ca 0.03 -0.42 -0.10 0.00 -0.01 0.00 0.00 64.34 63.84 1czp n VAL 54 Cb 0.39 -1.76 -0.06 0.00 -0.91 0.00 0.00 33.84 31.49 1czp n VAL 54 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1czp s SER 55 N -7.17 -0.11 0.00 4.52 1.04 -1.00 -4.97 113.70 106.01 1czp s SER 55 Ca -0.36 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 55.69 1czp s SER 55 Cb 0.12 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.65 1czp s SER 55 CO 0.54 -0.76 0.00 0.61 0.98 0.00 0.00 173.24 174.61 1czp n GLY 56 N 0.02 -0.27 3.23 7.32 0.00 -1.26 -1.52 105.19 112.71 1czp n GLY 56 Ca -0.16 -1.85 -0.16 0.00 0.00 0.00 0.00 46.02 43.85 1czp n GLY 56 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1czp s THR 57 N -1.22 1.19 0.09 2.61 -4.23 -1.26 -4.97 115.64 107.85 1czp s THR 57 Ca 0.00 -1.77 0.01 0.00 -1.18 0.00 0.00 61.69 58.75 1czp s THR 57 Cb 0.00 -1.55 -0.04 0.00 1.34 0.00 0.00 72.50 72.25 1czp s THR 57 CO 0.00 -0.53 -0.06 0.68 -0.54 0.00 0.00 174.62 174.17 1czp s VAL 58 N -2.48 0.65 -0.40 2.29 -7.23 -1.26 -0.91 120.40 111.06 1czp s VAL 58 Ca 0.10 -1.92 -0.07 0.00 -1.81 0.00 0.00 61.98 58.28 1czp s VAL 58 Cb -0.03 -1.66 0.08 0.00 0.56 0.00 0.00 36.38 35.33 1czp s VAL 58 CO 0.02 -0.88 0.21 -0.62 -0.31 0.00 0.00 175.10 173.52 1czp s ASP 59 N -3.02 5.47 -0.33 4.85 2.15 0.34 -4.83 116.67 121.31 1czp s ASP 59 Ca 0.11 -1.57 0.06 0.00 0.43 0.00 0.00 52.55 51.59 1czp s ASP 59 Cb 0.05 -1.92 0.46 0.00 -0.30 0.00 0.00 42.92 41.21 1czp s ASP 59 CO -0.05 -0.50 1.29 0.00 -0.17 0.00 0.00 175.17 175.74 1czp n GLN 60 N 4.82 3.37 0.05 4.34 10.64 -1.26 -1.21 117.38 138.12 1czp n GLN 60 Ca -0.09 -4.01 0.19 0.00 -1.83 0.00 0.00 57.00 51.26 1czp n GLN 60 Cb 0.43 -2.23 0.70 0.00 -0.86 0.00 0.00 30.24 28.28 1czp n GLN 60 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.06 176.00 1czp h SER 61 N 2.07 0.00 0.94 2.61 0.02 -1.93 0.04 113.55 117.29 1czp h SER 61 Ca 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 1czp h SER 61 Cb 1.44 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.98 1czp h SER 61 CO 0.80 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.96 1czp n ASP 62 N -4.28 0.55 -4.77 3.07 10.43 -1.26 -4.86 116.55 115.43 1czp n ASP 62 Ca 0.08 0.60 -0.33 0.00 2.57 0.00 0.00 54.79 57.71 1czp n ASP 62 Cb 0.54 -0.73 0.05 0.00 1.84 0.00 0.00 41.12 42.82 1czp n ASP 62 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1czp s GLN 63 N -3.18 2.83 0.00 -1.24 1.03 -0.00 -4.70 119.66 114.39 1czp s GLN 63 Ca 0.07 1.36 0.00 0.00 0.04 0.00 0.00 55.36 56.83 1czp s GLN 63 Cb 0.11 -1.96 0.00 0.00 0.03 0.00 0.00 33.01 31.19 1czp s GLN 63 CO 0.45 -1.22 0.00 -1.13 -2.54 0.00 0.00 175.29 170.84 1czp n SER 64 N -2.44 0.00 0.08 12.60 3.41 -0.08 -4.93 113.62 122.25 1czp n SER 64 Ca 0.10 -0.01 -0.20 0.00 -0.26 0.00 0.00 58.87 58.50 1czp n SER 64 Cb 0.52 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.32 1czp n SER 64 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1czp h PHE 65 N 0.00 0.63 -3.88 7.33 3.57 -1.68 -3.46 116.94 119.45 1czp h PHE 65 Ca 0.00 -0.46 -0.51 0.00 3.53 0.00 0.00 57.97 60.53 1czp h PHE 65 Cb 0.01 -0.03 0.04 0.00 2.79 0.00 0.00 35.95 38.76 1czp h PHE 65 CO 0.00 1.53 0.52 -0.51 -2.23 0.00 0.00 178.31 177.61 1czp s LEU 66 N -7.19 4.38 0.76 0.59 1.43 -1.26 -5.02 118.68 112.38 1czp s LEU 66 Ca -0.12 2.37 -0.09 0.00 -1.03 0.00 0.00 54.13 55.26 1czp s LEU 66 Cb 0.06 -3.80 0.09 0.00 0.03 0.00 0.00 46.19 42.56 1czp s LEU 66 CO 0.86 -0.43 1.09 1.51 0.23 0.00 0.00 176.35 179.62 1czp s ASP 67 N -0.93 4.50 0.40 2.29 1.47 -1.26 -4.87 116.67 118.27 1czp s ASP 67 Ca 0.50 0.47 0.12 0.00 1.18 0.00 0.00 52.55 54.82 1czp s ASP 67 Cb -0.32 -0.98 0.83 0.00 -0.34 0.00 0.00 42.92 42.10 1czp s ASP 67 CO 0.42 -1.83 1.91 -2.24 0.68 0.00 0.00 175.17 174.10 1czp h ASP 68 N -0.84 0.06 -0.32 2.11 2.03 -1.99 -1.22 116.42 116.25 1czp h ASP 68 Ca -0.44 -0.02 -0.18 0.00 -0.73 0.00 0.00 57.03 55.66 1czp h ASP 68 Cb 1.31 -0.02 -0.00 0.00 -0.83 0.00 0.00 39.33 39.79 1czp h ASP 68 CO 0.58 0.31 -0.48 0.44 -1.03 0.00 0.00 179.24 179.06 1czp h ASP 69 N 0.06 0.99 -0.66 4.15 3.32 -1.99 -1.44 116.42 120.85 1czp h ASP 69 Ca 0.01 -0.50 -0.04 0.00 0.02 0.00 0.00 57.03 56.52 1czp h ASP 69 Cb 0.47 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 1czp h ASP 69 CO 0.03 1.30 0.24 1.56 -1.72 0.00 0.00 179.24 180.65 1czp h GLN 70 N 0.71 1.00 -0.33 3.56 4.20 -1.80 -1.12 115.11 121.33 1czp h GLN 70 Ca 0.03 -0.20 -0.01 0.00 0.06 0.00 0.00 58.65 58.54 1czp h GLN 70 Cb 1.09 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.70 1czp h GLN 70 CO 0.11 0.85 0.18 0.82 -0.67 0.00 0.00 178.83 180.12 1czp h ILE 71 N 0.93 1.13 -0.12 2.54 2.04 -1.20 -1.85 117.51 120.99 1czp h ILE 71 Ca 0.22 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 1czp h ILE 71 Cb 0.25 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 1czp h ILE 71 CO -0.01 0.14 0.05 -0.08 0.00 0.00 0.00 178.15 178.24 1czp h GLU 72 N 0.40 0.15 0.00 2.37 4.81 -0.92 -1.45 114.58 119.95 1czp h GLU 72 Ca 0.11 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1czp h GLU 72 Cb 0.06 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.41 1czp h GLU 72 CO -0.02 0.13 0.00 0.00 -0.73 0.00 0.00 179.01 178.39 1czp n ALA 73 N -2.52 2.19 0.00 2.92 0.00 -0.45 -4.90 120.51 117.75 1czp n ALA 73 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1czp n ALA 73 Cb 0.11 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.16 1czp n ALA 73 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1czp n GLY 74 N 0.90 0.83 3.77 0.00 0.00 -0.55 -4.85 105.19 105.29 1czp n GLY 74 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 1czp n GLY 74 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1czp s TYR 75 N -2.00 3.34 -0.01 1.61 2.02 -0.73 -0.53 117.35 121.05 1czp s TYR 75 Ca 0.00 1.65 0.01 0.00 -0.37 0.00 0.00 57.07 58.36 1czp s TYR 75 Cb 0.00 -3.20 0.01 0.00 -0.40 0.00 0.00 41.96 38.36 1czp s TYR 75 CO 0.00 -0.67 -0.02 0.08 -1.57 0.00 0.00 175.55 173.37 1czp s VAL 76 N -1.47 0.20 -0.54 0.71 1.01 -0.11 -4.52 120.40 115.67 1czp s VAL 76 Ca 0.54 -0.06 -0.20 0.00 0.00 0.00 0.00 61.98 62.25 1czp s VAL 76 Cb -0.26 -0.21 0.06 0.00 0.00 0.00 0.00 36.38 35.98 1czp s VAL 76 CO 0.33 0.08 0.74 -0.76 0.00 0.00 0.00 175.10 175.49 1czp s LEU 77 N 0.24 4.79 0.62 3.92 1.43 -1.26 -0.47 118.68 127.95 1czp s LEU 77 Ca -0.02 -0.88 0.38 0.00 -1.03 0.00 0.00 54.13 52.57 1czp s LEU 77 Cb -0.05 -2.50 2.03 0.00 0.03 0.00 0.00 46.19 45.70 1czp s LEU 77 CO -0.01 -1.05 2.25 0.71 0.23 0.00 0.00 176.35 178.49 1czp h THR 78 N 5.92 0.19 0.00 5.49 1.35 -1.89 -1.98 112.91 121.98 1czp h THR 78 Ca -0.28 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 1czp h THR 78 Cb 1.09 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.63 1czp h THR 78 CO 1.03 0.02 0.00 0.00 -0.25 0.00 0.00 175.52 176.32 1czp n VAL 80 N -2.58 0.88 -3.86 0.00 0.24 -0.77 -4.83 118.33 107.42 1czp n VAL 80 Ca 0.02 -1.14 -0.36 0.00 -2.04 0.00 0.00 64.34 60.82 1czp n VAL 80 Cb 0.29 0.19 -0.13 0.00 -1.47 0.00 0.00 33.84 32.72 1czp n VAL 80 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1czp s ALA 81 N -1.34 3.09 -0.06 2.33 0.00 -1.09 -4.34 121.76 120.35 1czp s ALA 81 Ca 0.17 -1.09 -0.20 0.00 0.00 0.00 0.00 51.96 50.84 1czp s ALA 81 Cb 0.16 -1.95 -0.05 0.00 0.00 0.00 0.00 23.12 21.28 1czp s ALA 81 CO -0.00 -0.38 0.55 0.71 0.00 0.00 0.00 175.76 176.63 1czp s TYR 82 N 1.42 3.60 0.36 0.00 2.02 -0.35 -0.95 117.35 123.45 1czp s TYR 82 Ca 0.05 1.06 -0.26 0.00 -0.37 0.00 0.00 57.07 57.55 1czp s TYR 82 Cb -0.15 -2.59 -0.09 0.00 -0.40 0.00 0.00 41.96 38.73 1czp s TYR 82 CO 0.02 0.26 1.15 -1.25 -1.57 0.00 0.00 175.55 174.16 1czp s PRO 83 N 0.23 4.24 0.00 -1.71 0.04 -1.26 -0.50 135.00 136.04 1czp s PRO 83 Ca 0.29 1.82 0.02 0.00 0.04 0.00 0.00 61.00 63.18 1czp s PRO 83 Cb -0.17 -2.82 0.05 0.00 0.04 0.00 0.00 34.50 31.61 1czp s PRO 83 CO 0.14 -0.15 1.03 0.25 0.04 0.00 0.00 177.00 178.31 1czp n THR 84 N 0.39 0.97 -3.82 1.26 -2.24 -0.09 -4.72 114.28 106.03 1czp n THR 84 Ca 0.03 -0.99 -0.08 0.00 -2.27 0.00 0.00 64.05 60.74 1czp n THR 84 Cb 0.46 0.51 0.02 0.00 -2.10 0.00 0.00 70.33 69.22 1czp n THR 84 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1czp s SER 85 N -0.98 -0.04 0.40 3.42 1.04 -1.21 -4.86 113.70 111.48 1czp s SER 85 Ca 0.04 -1.00 -0.27 0.00 0.48 0.00 0.00 55.95 55.21 1czp s SER 85 Cb 0.02 0.79 -0.10 0.00 0.10 0.00 0.00 66.02 66.83 1czp s SER 85 CO 0.03 -1.54 1.41 0.47 0.98 0.00 0.00 173.24 174.58 1czp n ASP 86 N -1.22 3.32 -4.12 7.02 8.00 -1.26 -4.68 116.55 123.60 1czp n ASP 86 Ca -0.07 1.17 -0.22 0.00 0.71 0.00 0.00 54.79 56.39 1czp n ASP 86 Cb 0.60 -1.58 -0.14 0.00 -0.02 0.00 0.00 41.12 39.97 1czp n ASP 86 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1czp s VAL 87 N -1.15 1.13 -0.15 2.53 1.01 -0.08 -4.02 120.40 119.67 1czp s VAL 87 Ca 0.57 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.82 1czp s VAL 87 Cb -0.49 -0.97 0.01 0.00 0.00 0.00 0.00 36.38 34.93 1czp s VAL 87 CO 0.61 0.22 -0.19 -0.69 0.00 0.00 0.00 175.10 175.05 1czp s VAL 88 N -0.51 2.33 -0.02 2.92 1.01 -0.58 -0.64 120.40 124.93 1czp s VAL 88 Ca 0.04 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1czp s VAL 88 Cb -0.06 -1.96 0.02 0.00 0.00 0.00 0.00 36.38 34.37 1czp s VAL 88 CO 0.00 0.53 0.00 -0.51 0.00 0.00 0.00 175.10 175.12 1czp s ILE 89 N 0.86 0.10 -0.06 2.22 2.07 -0.14 -0.12 121.20 126.13 1czp s ILE 89 Ca -0.05 0.06 -0.29 0.00 -1.41 0.00 0.00 60.65 58.96 1czp s ILE 89 Cb -0.15 -0.17 -0.02 0.00 0.13 0.00 0.00 42.46 42.25 1czp s ILE 89 CO -0.02 0.09 0.94 -1.10 -1.91 0.00 0.00 174.94 172.94 1czp s GLN 90 N 0.62 4.47 0.67 3.50 -0.21 0.44 -0.93 119.66 128.21 1czp s GLN 90 Ca -0.06 1.30 0.02 0.00 0.02 0.00 0.00 55.36 56.64 1czp s GLN 90 Cb -0.08 -3.50 0.11 0.00 1.00 0.00 0.00 33.01 30.53 1czp s GLN 90 CO -0.01 -0.15 0.92 0.95 -2.12 0.00 0.00 175.29 174.88 1czp s THR 91 N 1.42 2.22 -1.34 -0.19 -4.23 0.13 -0.42 115.64 113.23 1czp s THR 91 Ca 0.48 -0.69 -0.08 0.00 -1.18 0.00 0.00 61.69 60.21 1czp s THR 91 Cb -0.19 -2.53 0.01 0.00 1.34 0.00 0.00 72.50 71.13 1czp s THR 91 CO 0.22 0.00 1.17 1.41 -0.54 0.00 0.00 174.62 176.88 1czp n HIS 92 N -2.64 -2.83 -0.37 3.99 8.25 -1.20 -4.66 115.22 115.76 1czp n HIS 92 Ca 0.14 1.01 0.12 0.00 -0.26 0.00 0.00 57.72 58.73 1czp n HIS 92 Cb 0.61 -5.02 0.32 0.00 1.12 0.00 0.00 29.99 27.02 1czp n HIS 92 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1czp n LYS 93 N -4.93 2.73 -0.35 -0.41 4.76 -0.56 -4.53 118.16 114.88 1czp n LYS 93 Ca -0.01 -2.67 0.15 0.00 -2.87 0.00 0.00 58.31 52.90 1czp n LYS 93 Cb 0.57 -1.57 0.34 0.00 -1.84 0.00 0.00 35.03 32.53 1czp n LYS 93 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 1czp h GLU 94 N 4.31 0.68 0.00 1.97 4.81 -1.77 0.08 114.58 124.66 1czp h GLU 94 Ca 0.00 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1czp h GLU 94 Cb 0.99 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.22 1czp h GLU 94 CO 0.00 0.45 -0.01 1.05 -0.73 0.00 0.00 179.01 179.77 1czp h GLU 95 N 0.70 0.00 0.00 1.92 9.09 -1.92 -1.15 114.58 123.22 1czp h GLU 95 Ca 0.60 0.00 -0.05 0.00 0.05 0.00 0.00 59.36 59.97 1czp h GLU 95 Cb 1.01 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.11 1czp h GLU 95 CO -0.41 0.01 -0.22 -0.44 0.05 0.00 0.00 179.01 178.00 1czp h ASP 96 N 0.00 0.00 -0.07 3.06 5.19 -1.32 -3.06 116.42 120.22 1czp h ASP 96 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1czp h ASP 96 Cb 0.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.71 1czp h ASP 96 CO 0.00 0.22 0.00 0.18 -3.12 0.00 0.00 179.24 176.52 1czp n LEU 97 N -3.99 0.52 0.00 1.55 4.77 -0.44 -5.21 117.00 114.20 1czp n LEU 97 Ca -0.02 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.72 1czp n LEU 97 Cb 0.29 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1czp n LEU 97 CO 0.35 0.12 0.05 -1.22 -1.33 0.00 0.00 177.39 175.36