#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2clz s GLN 2 N 0.00 4.57 -0.15 6.28 -0.21 -1.26 -4.98 119.66 123.91 2clz s GLN 2 Ca 0.00 1.17 -0.06 0.00 0.02 0.00 0.00 55.36 56.50 2clz s GLN 2 Cb 0.00 -3.19 -0.04 0.00 1.00 0.00 0.00 33.01 30.78 2clz s GLN 2 CO 0.00 0.53 0.05 0.15 -2.12 0.00 0.00 175.29 173.90 2clz s LYS 3 N -1.30 3.62 -0.05 2.91 3.01 -0.87 -4.96 119.74 122.09 2clz s LYS 3 Ca 0.38 -0.33 -0.28 0.00 -1.01 0.00 0.00 55.97 54.72 2clz s LYS 3 Cb -0.22 -3.08 -0.03 0.00 -1.01 0.00 0.00 37.83 33.49 2clz s LYS 3 CO 0.26 0.47 0.92 -0.08 0.51 0.00 0.00 175.35 177.43 2clz s THR 4 N -0.19 4.88 0.53 2.17 -1.32 -1.25 -2.69 115.64 117.77 2clz s THR 4 Ca 0.07 1.91 -0.22 0.00 -1.21 0.00 0.00 61.69 62.23 2clz s THR 4 Cb -0.12 -4.25 -0.06 0.00 -1.51 0.00 0.00 72.50 66.56 2clz s THR 4 CO 0.01 0.12 1.37 -0.81 -2.21 0.00 0.00 174.62 173.11 2clz n PRO 5 N 4.29 1.80 -4.11 7.08 -0.04 -1.26 -4.52 135.00 138.24 2clz n PRO 5 Ca 0.05 0.66 -0.34 0.00 -0.04 0.00 0.00 63.50 63.83 2clz n PRO 5 Cb 0.50 -2.59 -0.07 0.00 -0.04 0.00 0.00 33.50 31.31 2clz n PRO 5 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2clz s GLN 6 N -2.80 3.11 -0.05 0.54 -1.52 0.61 -4.94 119.66 114.61 2clz s GLN 6 Ca 0.70 -0.43 0.02 0.00 -1.95 0.00 0.00 55.36 53.69 2clz s GLN 6 Cb -0.42 -2.89 0.01 0.00 -0.22 0.00 0.00 33.01 29.49 2clz s GLN 6 CO 0.51 0.67 -0.09 0.42 -0.25 0.00 0.00 175.29 176.55 2clz s ILE 7 N -1.14 0.83 -0.05 1.08 1.01 -1.26 -1.19 121.20 120.48 2clz s ILE 7 Ca 0.21 -0.33 0.05 0.00 0.00 0.00 0.00 60.65 60.58 2clz s ILE 7 Cb -0.12 -0.78 -0.00 0.00 0.01 0.00 0.00 42.46 41.57 2clz s ILE 7 CO 0.11 0.28 -0.19 -1.10 0.00 0.00 0.00 174.94 174.05 2clz s GLN 8 N 0.61 1.95 -0.12 2.79 -0.21 -0.35 -4.99 119.66 119.33 2clz s GLN 8 Ca -0.10 -0.66 0.02 0.00 0.02 0.00 0.00 55.36 54.64 2clz s GLN 8 Cb -0.13 -1.67 0.00 0.00 1.00 0.00 0.00 33.01 32.20 2clz s GLN 8 CO 0.02 0.26 -0.21 0.08 -2.12 0.00 0.00 175.29 173.32 2clz s VAL 9 N 0.04 2.28 -0.01 1.09 1.01 -1.26 -0.60 120.40 122.95 2clz s VAL 9 Ca -0.05 -0.93 -0.28 0.00 0.00 0.00 0.00 61.98 60.72 2clz s VAL 9 Cb -0.12 -1.91 0.10 0.00 0.00 0.00 0.00 36.38 34.45 2clz s VAL 9 CO 0.03 0.55 0.87 -0.72 0.00 0.00 0.00 175.10 175.82 2clz s TYR 10 N 0.55 -0.38 0.34 5.22 -0.85 -0.69 -4.53 117.35 117.01 2clz s TYR 10 Ca -0.13 0.30 -0.07 0.00 -0.52 0.00 0.00 57.07 56.66 2clz s TYR 10 Cb -0.17 0.53 -0.05 0.00 0.38 0.00 0.00 41.96 42.65 2clz s TYR 10 CO 0.04 -0.55 0.64 -1.54 -1.52 0.00 0.00 175.55 172.62 2clz s SER 11 N -2.31 6.46 0.11 -0.18 1.04 -1.26 0.49 113.70 118.05 2clz s SER 11 Ca 0.03 0.86 -0.15 0.00 0.48 0.00 0.00 55.95 57.17 2clz s SER 11 Cb -0.01 -2.21 -0.04 0.00 0.10 0.00 0.00 66.02 63.86 2clz s SER 11 CO -0.08 -0.29 1.52 -0.09 0.98 0.00 0.00 173.24 175.29 2clz h ARG 12 N 1.42 0.69 -6.44 4.02 2.43 -1.42 -3.45 114.38 111.63 2clz h ARG 12 Ca -0.48 -0.26 -0.62 0.00 -0.81 0.00 0.00 59.98 57.81 2clz h ARG 12 Cb 1.19 -0.04 -0.15 0.00 -0.42 0.00 0.00 29.97 30.55 2clz h ARG 12 CO 0.65 0.84 -0.75 -1.01 -1.51 0.00 0.00 179.97 178.19 2clz s HIS 13 N -4.81 2.51 0.13 2.20 3.76 -1.26 -5.05 115.29 112.77 2clz s HIS 13 Ca -0.13 -0.27 -0.35 0.00 -0.15 0.00 0.00 55.06 54.16 2clz s HIS 13 Cb 0.09 -1.20 -0.16 0.00 1.11 0.00 0.00 32.58 32.42 2clz s HIS 13 CO 0.80 0.54 1.32 -2.30 -0.85 0.00 0.00 174.74 174.25 2clz n PRO 14 N -0.07 1.33 -2.42 8.40 -0.02 -1.26 -4.88 135.00 136.08 2clz n PRO 14 Ca -0.10 0.48 -0.41 0.00 -2.02 0.00 0.00 63.50 61.45 2clz n PRO 14 Cb 0.56 -2.09 -0.04 0.00 -0.02 0.00 0.00 33.50 31.92 2clz n PRO 14 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2clz s PRO 15 N 0.20 4.57 -0.07 0.52 0.04 -1.26 -5.03 135.00 133.97 2clz s PRO 15 Ca 0.79 1.85 -0.00 0.00 0.04 0.00 0.00 61.00 63.68 2clz s PRO 15 Cb -0.87 -3.20 0.02 0.00 0.04 0.00 0.00 34.50 30.49 2clz s PRO 15 CO 0.48 0.08 -0.04 -2.00 0.04 0.00 0.00 177.00 175.56 2clz s GLU 16 N -1.02 0.92 0.23 4.56 2.12 -1.26 -5.12 118.70 119.13 2clz s GLU 16 Ca 0.48 -0.07 -0.32 0.00 0.36 0.00 0.00 54.97 55.42 2clz s GLU 16 Cb -0.33 -1.06 -0.13 0.00 0.26 0.00 0.00 34.13 32.87 2clz s GLU 16 CO 0.40 -0.19 1.47 0.09 -0.54 0.00 0.00 175.26 176.49 2clz n ASN 17 N 4.62 2.99 0.00 -1.70 3.02 -1.26 -1.71 115.26 121.23 2clz n ASN 17 Ca -0.16 1.13 0.00 0.00 -0.03 0.00 0.00 54.58 55.52 2clz n ASN 17 Cb 0.50 -1.45 0.00 0.00 -0.61 0.00 0.00 39.78 38.22 2clz n ASN 17 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2clz n GLY 18 N 2.45 1.77 3.58 7.41 0.00 -0.30 -5.00 105.19 115.09 2clz n GLY 18 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 2clz n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2clz s LYS 19 N -0.13 3.89 0.12 1.61 -0.14 -0.69 -4.98 119.74 119.41 2clz s LYS 19 Ca 0.00 -0.38 -0.36 0.00 -1.36 0.00 0.00 55.97 53.87 2clz s LYS 19 Cb 0.00 -3.26 -0.16 0.00 -1.68 0.00 0.00 37.83 32.73 2clz s LYS 19 CO 0.00 0.13 1.36 -2.30 -0.76 0.00 0.00 175.35 173.78 2clz n PRO 20 N 3.98 1.37 -2.87 -1.68 -0.02 -1.26 -4.20 135.00 130.32 2clz n PRO 20 Ca -0.16 0.49 -0.08 0.00 -2.02 0.00 0.00 63.50 61.73 2clz n PRO 20 Cb 0.52 -2.14 -0.03 0.00 -0.02 0.00 0.00 33.50 31.83 2clz n PRO 20 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2clz n ASN 21 N 2.61 -0.40 -4.08 2.55 2.85 0.11 -4.99 115.26 113.92 2clz n ASN 21 Ca 0.17 -1.92 -0.25 0.00 -0.11 0.00 0.00 54.58 52.47 2clz n ASN 21 Cb 0.22 0.85 -0.16 0.00 1.24 0.00 0.00 39.78 41.92 2clz n ASN 21 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2clz s ILE 22 N -2.59 1.30 -0.19 -1.44 1.01 -1.26 -1.85 121.20 116.18 2clz s ILE 22 Ca 0.16 -0.61 -0.09 0.00 0.00 0.00 0.00 60.65 60.11 2clz s ILE 22 Cb 0.00 -1.15 -0.05 0.00 0.01 0.00 0.00 42.46 41.28 2clz s ILE 22 CO 0.11 0.39 0.11 -0.22 0.00 0.00 0.00 174.94 175.33 2clz s LEU 23 N 0.37 4.09 0.04 2.97 2.96 0.19 -0.95 118.68 128.36 2clz s LEU 23 Ca -0.10 0.19 0.03 0.00 -0.22 0.00 0.00 54.13 54.02 2clz s LEU 23 Cb -0.14 -2.05 -0.04 0.00 0.50 0.00 0.00 46.19 44.46 2clz s LEU 23 CO 0.03 0.18 0.01 0.20 -1.32 0.00 0.00 176.35 175.45 2clz s ASN 24 N 0.37 5.12 -0.26 3.68 0.01 0.18 -1.63 114.94 122.40 2clz s ASN 24 Ca 0.07 -0.07 -0.00 0.00 -0.71 0.00 0.00 52.86 52.14 2clz s ASN 24 Cb -0.11 -1.30 0.08 0.00 0.41 0.00 0.00 41.25 40.32 2clz s ASN 24 CO -0.01 0.23 0.03 0.00 -1.51 0.00 0.00 177.10 175.84 2clz s TYR 26 N 1.55 3.23 -0.14 0.00 5.04 0.23 -1.25 117.35 126.02 2clz s TYR 26 Ca 0.03 0.28 0.03 0.00 -2.44 0.00 0.00 57.07 54.96 2clz s TYR 26 Cb -0.18 -2.50 0.01 0.00 0.35 0.00 0.00 41.96 39.64 2clz s TYR 26 CO -0.14 -0.21 -0.22 0.08 -1.34 0.00 0.00 175.55 173.73 2clz s VAL 27 N 1.94 2.02 0.28 3.14 1.01 -0.73 -1.22 120.40 126.85 2clz s VAL 27 Ca 0.12 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.15 2clz s VAL 27 Cb -0.16 -1.79 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 2clz s VAL 27 CO 0.10 0.54 0.10 0.42 0.00 0.00 0.00 175.10 176.27 2clz s THR 28 N 0.80 0.59 -1.68 3.92 -4.23 -0.34 -1.51 115.64 113.19 2clz s THR 28 Ca -0.08 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.41 2clz s THR 28 Cb -0.16 -2.62 0.00 0.00 1.34 0.00 0.00 72.50 71.06 2clz s THR 28 CO -0.01 0.00 0.24 0.00 -0.54 0.00 0.00 174.62 174.31 2clz n GLN 29 N -0.52 -2.97 -4.19 3.99 1.13 -1.03 -0.29 117.38 113.51 2clz n GLN 29 Ca -0.00 0.96 -0.30 0.00 -1.94 0.00 0.00 57.00 55.71 2clz n GLN 29 Cb 0.66 -5.70 -0.09 0.00 0.11 0.00 0.00 30.24 25.22 2clz n GLN 29 CO 0.00 0.00 0.00 -0.59 -1.44 0.00 0.00 177.06 175.03 2clz s PHE 30 N -3.08 2.90 -0.28 1.08 -0.71 -1.20 -3.74 117.98 112.94 2clz s PHE 30 Ca 0.12 -0.07 -0.16 0.00 -1.04 0.00 0.00 56.93 55.79 2clz s PHE 30 Cb -0.05 -1.51 0.08 0.00 -1.21 0.00 0.00 43.02 40.33 2clz s PHE 30 CO 0.15 0.45 0.69 -1.58 -1.34 0.00 0.00 175.22 173.59 2clz s HIS 31 N -1.25 -1.08 1.04 3.49 2.46 -1.10 -0.68 115.29 118.17 2clz s HIS 31 Ca 0.24 2.14 -0.12 0.00 0.47 0.00 0.00 55.06 57.79 2clz s HIS 31 Cb -0.11 0.64 0.21 0.00 -0.13 0.00 0.00 32.58 33.19 2clz s HIS 31 CO 0.16 -0.53 1.08 -1.25 -2.47 0.00 0.00 174.74 171.72 2clz s PRO 32 N 1.67 0.12 0.50 2.88 0.04 -1.26 -2.04 135.00 136.91 2clz s PRO 32 Ca -0.10 0.63 0.29 0.00 0.04 0.00 0.00 61.00 61.86 2clz s PRO 32 Cb -0.05 -1.69 1.22 0.00 0.04 0.00 0.00 34.50 34.02 2clz s PRO 32 CO -0.20 -2.97 1.94 -1.35 0.04 0.00 0.00 177.00 174.46 2clz h PRO 33 N -2.07 0.00 -6.42 0.56 0.11 -1.98 -3.44 132.00 118.76 2clz h PRO 33 Ca -0.56 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.02 2clz h PRO 33 Cb 1.33 0.00 0.03 0.00 0.11 0.00 0.00 31.00 32.46 2clz h PRO 33 CO 0.55 0.12 1.20 -1.58 -0.21 0.00 0.00 178.00 178.07 2clz s HIS 34 N -3.75 1.58 -0.05 0.65 5.65 -1.26 -4.97 115.29 113.14 2clz s HIS 34 Ca 0.00 -0.33 -0.15 0.00 0.25 0.00 0.00 55.06 54.83 2clz s HIS 34 Cb 0.10 -4.24 0.03 0.00 -1.18 0.00 0.00 32.58 27.30 2clz s HIS 34 CO 0.59 -5.39 0.35 -1.50 -0.65 0.00 0.00 174.74 168.14 2clz s ILE 35 N 3.83 0.04 -0.16 0.89 2.07 -1.26 -4.68 121.20 121.92 2clz s ILE 35 Ca 0.86 -0.32 0.01 0.00 -1.41 0.00 0.00 60.65 59.80 2clz s ILE 35 Cb -0.44 -0.62 0.02 0.00 0.13 0.00 0.00 42.46 41.55 2clz s ILE 35 CO 0.40 -0.17 -0.20 -1.61 -1.91 0.00 0.00 174.94 171.44 2clz s GLU 36 N -0.91 2.94 -0.11 3.50 2.02 -0.73 -5.01 118.70 120.40 2clz s GLU 36 Ca -0.10 -0.82 0.03 0.00 0.02 0.00 0.00 54.97 54.10 2clz s GLU 36 Cb -0.04 -2.48 0.01 0.00 0.10 0.00 0.00 34.13 31.71 2clz s GLU 36 CO 0.04 -0.15 -0.19 0.42 0.02 0.00 0.00 175.26 175.39 2clz s ILE 37 N 1.15 1.77 0.01 -1.63 1.01 -1.26 -0.55 121.20 121.70 2clz s ILE 37 Ca 0.01 -0.83 0.08 0.00 0.00 0.00 0.00 60.65 59.91 2clz s ILE 37 Cb -0.14 -1.57 -0.02 0.00 0.01 0.00 0.00 42.46 40.74 2clz s ILE 37 CO -0.09 0.50 -0.24 -1.10 0.00 0.00 0.00 174.94 174.01 2clz s GLN 38 N 0.66 1.76 -0.09 2.79 -0.21 0.12 -4.99 119.66 119.69 2clz s GLN 38 Ca -0.13 -0.94 -0.02 0.00 0.02 0.00 0.00 55.36 54.30 2clz s GLN 38 Cb -0.16 -1.81 -0.03 0.00 1.00 0.00 0.00 33.01 32.01 2clz s GLN 38 CO 0.03 0.48 -0.01 -1.64 -2.12 0.00 0.00 175.29 172.03 2clz s MET 39 N -0.88 3.02 -0.06 2.91 -1.94 -1.26 -0.41 119.30 120.68 2clz s MET 39 Ca 0.09 -0.44 0.05 0.00 -1.71 0.00 0.00 55.69 53.68 2clz s MET 39 Cb -0.09 -2.78 -0.00 0.00 2.01 0.00 0.00 34.83 33.96 2clz s MET 39 CO 0.01 0.65 -0.20 -0.51 -0.01 0.00 0.00 175.02 174.96 2clz s LEU 40 N -0.74 1.96 -0.21 -0.03 1.02 0.37 -0.42 118.68 120.63 2clz s LEU 40 Ca 0.12 -0.42 -0.02 0.00 0.02 0.00 0.00 54.13 53.82 2clz s LEU 40 Cb -0.11 -1.14 0.01 0.00 0.02 0.00 0.00 46.19 44.96 2clz s LEU 40 CO 0.02 0.17 -0.11 -0.75 0.02 0.00 0.00 176.35 175.71 2clz s LYS 41 N 0.07 3.17 -1.51 1.70 2.20 0.08 -1.21 119.74 124.25 2clz s LYS 41 Ca -0.07 -0.74 -0.14 0.00 -0.36 0.00 0.00 55.97 54.66 2clz s LYS 41 Cb -0.13 -2.83 0.11 0.00 -1.51 0.00 0.00 37.83 33.46 2clz s LYS 41 CO 0.04 -0.22 0.75 0.09 -0.36 0.00 0.00 175.35 175.64 2clz n ASN 42 N 4.71 -4.00 0.00 1.43 3.02 0.71 -1.14 115.26 120.00 2clz n ASN 42 Ca -0.19 -0.71 0.00 0.00 -0.03 0.00 0.00 54.58 53.65 2clz n ASN 42 Cb 0.50 -3.25 0.00 0.00 -0.61 0.00 0.00 39.78 36.42 2clz n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2clz n GLY 43 N -1.41 1.18 3.58 7.41 0.00 -1.26 -5.03 105.19 109.66 2clz n GLY 43 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 2clz n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2clz s LYS 44 N -0.31 3.39 0.16 1.61 -0.14 -0.29 -5.04 119.74 119.12 2clz s LYS 44 Ca 0.00 -0.46 -0.34 0.00 -1.36 0.00 0.00 55.97 53.81 2clz s LYS 44 Cb 0.00 -2.88 -0.14 0.00 -1.68 0.00 0.00 37.83 33.13 2clz s LYS 44 CO 0.00 0.44 1.54 1.17 -0.76 0.00 0.00 175.35 177.74 2clz n LYS 45 N 2.94 2.07 -2.93 1.68 4.81 -1.26 -0.74 118.16 124.73 2clz n LYS 45 Ca -0.18 0.75 -0.41 0.00 -0.87 0.00 0.00 58.31 57.60 2clz n LYS 45 Cb 0.53 -2.49 -0.04 0.00 0.02 0.00 0.00 35.03 33.04 2clz n LYS 45 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2clz s ILE 46 N 0.78 4.97 -0.02 3.15 1.01 0.44 -4.84 121.20 126.69 2clz s ILE 46 Ca 0.78 1.64 -0.21 0.00 0.00 0.00 0.00 60.65 62.85 2clz s ILE 46 Cb -0.69 -4.13 -0.13 0.00 0.01 0.00 0.00 42.46 37.51 2clz s ILE 46 CO 0.40 0.18 0.93 -0.65 0.00 0.00 0.00 174.94 175.80 2clz h PRO 47 N 6.88 -0.49 -4.98 2.79 0.11 -1.93 -3.41 132.00 130.98 2clz h PRO 47 Ca -0.39 0.03 -0.68 0.00 0.11 0.00 0.00 66.00 65.07 2clz h PRO 47 Cb 1.19 0.11 -0.18 0.00 0.11 0.00 0.00 31.00 32.23 2clz h PRO 47 CO 0.77 -0.19 0.51 0.15 -0.21 0.00 0.00 178.00 179.03 2clz s LYS 48 N -3.94 3.31 -0.17 1.05 -0.14 -1.26 -4.97 119.74 113.61 2clz s LYS 48 Ca -0.12 -1.42 0.01 0.00 -1.36 0.00 0.00 55.97 53.08 2clz s LYS 48 Cb 0.01 -4.51 0.03 0.00 -1.68 0.00 0.00 37.83 31.69 2clz s LYS 48 CO 0.41 -1.69 -0.13 0.08 -0.76 0.00 0.00 175.35 173.25 2clz s VAL 49 N 2.93 1.67 0.21 3.17 1.01 -1.26 -4.59 120.40 123.53 2clz s VAL 49 Ca 0.23 -0.84 -0.11 0.00 0.00 0.00 0.00 61.98 61.25 2clz s VAL 49 Cb -0.14 -1.64 -0.07 0.00 0.00 0.00 0.00 36.38 34.53 2clz s VAL 49 CO 0.01 0.34 0.56 -1.61 0.00 0.00 0.00 175.10 174.39 2clz s GLU 50 N 1.42 3.87 -0.04 2.72 2.02 -0.15 -4.90 118.70 123.63 2clz s GLU 50 Ca 0.02 0.36 0.07 0.00 0.02 0.00 0.00 54.97 55.44 2clz s GLU 50 Cb -0.14 -2.73 -0.01 0.00 0.10 0.00 0.00 34.13 31.34 2clz s GLU 50 CO -0.10 0.36 -0.25 -1.64 0.02 0.00 0.00 175.26 173.66 2clz s MET 51 N -2.54 2.29 0.84 1.61 -1.94 -1.26 -1.27 119.30 117.03 2clz s MET 51 Ca 0.44 -0.88 -0.11 0.00 -1.71 0.00 0.00 55.69 53.43 2clz s MET 51 Cb -0.12 -2.04 0.10 0.00 2.01 0.00 0.00 34.83 34.77 2clz s MET 51 CO 0.20 0.44 1.09 -1.54 -0.01 0.00 0.00 175.02 175.20 2clz s SER 52 N -0.33 3.91 0.57 3.03 1.04 0.17 -5.01 113.70 117.09 2clz s SER 52 Ca 0.02 1.64 -0.18 0.00 0.48 0.00 0.00 55.95 57.91 2clz s SER 52 Cb -0.12 -2.33 -0.04 0.00 0.10 0.00 0.00 66.02 63.63 2clz s SER 52 CO 0.02 -2.39 1.13 -1.81 0.98 0.00 0.00 173.24 171.17 2clz s ASP 53 N -3.39 5.57 0.27 7.02 -0.00 -1.26 -4.71 116.67 120.17 2clz s ASP 53 Ca 0.62 2.14 -0.23 0.00 -0.00 0.00 0.00 52.55 55.09 2clz s ASP 53 Cb -0.18 -2.57 -0.09 0.00 -0.00 0.00 0.00 42.92 40.08 2clz s ASP 53 CO 0.57 -1.32 0.83 -0.32 -0.00 0.00 0.00 175.17 174.92 2clz s MET 54 N -3.48 4.40 0.18 8.23 1.75 -1.26 -4.83 119.30 124.29 2clz s MET 54 Ca 0.71 1.08 0.02 0.00 -1.25 0.00 0.00 55.69 56.25 2clz s MET 54 Cb -0.23 -2.82 -0.05 0.00 2.84 0.00 0.00 34.83 34.57 2clz s MET 54 CO 0.30 0.33 0.01 -1.12 -0.65 0.00 0.00 175.02 173.89 2clz s SER 55 N -1.66 1.17 0.13 1.11 0.01 -1.13 -5.02 113.70 108.32 2clz s SER 55 Ca 0.47 -1.19 0.04 0.00 1.31 0.00 0.00 55.95 56.58 2clz s SER 55 Cb -0.17 0.13 -0.04 0.00 0.21 0.00 0.00 66.02 66.14 2clz s SER 55 CO 0.22 -0.59 -0.10 0.72 0.41 0.00 0.00 173.24 173.90 2clz s PHE 56 N -3.68 1.22 0.51 2.43 -0.12 -1.26 -1.33 117.98 115.74 2clz s PHE 56 Ca 0.25 -0.73 0.08 0.00 -0.05 0.00 0.00 56.93 56.48 2clz s PHE 56 Cb 0.06 -0.63 0.04 0.00 -0.63 0.00 0.00 43.02 41.86 2clz s PHE 56 CO 0.05 0.06 0.58 -1.12 -0.05 0.00 0.00 175.22 174.74 2clz s SER 57 N -2.97 5.10 0.63 1.98 0.01 -0.13 -4.97 113.70 113.34 2clz s SER 57 Ca 0.14 -0.83 0.41 0.00 1.31 0.00 0.00 55.95 56.98 2clz s SER 57 Cb 0.01 -0.04 2.10 0.00 0.21 0.00 0.00 66.02 68.30 2clz s SER 57 CO 0.00 -1.04 2.26 0.07 0.41 0.00 0.00 173.24 174.94 2clz h LYS 58 N 0.56 0.00 -0.14 12.44 2.10 -2.02 0.16 116.57 129.66 2clz h LYS 58 Ca -0.36 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.29 2clz h LYS 58 Cb 1.29 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.62 2clz h LYS 58 CO 0.48 0.00 0.00 -0.40 -2.00 0.00 0.00 179.45 177.54 2clz n ASP 59 N -3.12 1.04 0.00 7.07 5.75 -1.26 -4.91 116.55 121.12 2clz n ASP 59 Ca -0.02 -1.75 0.00 0.00 -0.01 0.00 0.00 54.79 53.01 2clz n ASP 59 Cb 0.14 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.14 2clz n ASP 59 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2clz n TRP 60 N -0.03 0.00 -2.52 2.11 7.02 0.55 -5.03 117.44 119.55 2clz n TRP 60 Ca 0.12 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.27 2clz n TRP 60 Cb 0.20 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 29.06 2clz n TRP 60 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 2clz s SER 61 N -3.04 6.53 0.28 -0.99 1.04 -1.26 -4.66 113.70 111.61 2clz s SER 61 Ca 0.00 1.73 0.01 0.00 0.48 0.00 0.00 55.95 58.17 2clz s SER 61 Cb 0.00 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.55 2clz s SER 61 CO 0.00 -0.65 0.47 -0.36 0.98 0.00 0.00 173.24 173.68 2clz s PHE 62 N -2.30 3.48 0.06 5.02 0.40 0.14 -0.96 117.98 123.83 2clz s PHE 62 Ca 0.63 0.29 -0.08 0.00 -0.60 0.00 0.00 56.93 57.16 2clz s PHE 62 Cb -0.12 -1.83 -0.00 0.00 0.51 0.00 0.00 43.02 41.58 2clz s PHE 62 CO 0.23 0.26 0.17 1.52 0.70 0.00 0.00 175.22 178.11 2clz s TYR 63 N -2.11 0.14 -0.06 0.36 -0.85 -0.44 -2.45 117.35 111.93 2clz s TYR 63 Ca 0.38 -0.50 -0.31 0.00 -0.52 0.00 0.00 57.07 56.13 2clz s TYR 63 Cb -0.10 -0.08 0.08 0.00 0.38 0.00 0.00 41.96 42.25 2clz s TYR 63 CO 0.32 -0.48 0.74 -1.50 -1.52 0.00 0.00 175.55 173.11 2clz s ILE 64 N -3.31 0.00 -0.17 -3.49 2.07 -0.57 -2.82 121.20 112.92 2clz s ILE 64 Ca 0.01 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.26 2clz s ILE 64 Cb 0.02 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.63 2clz s ILE 64 CO -0.08 0.00 -0.19 -0.22 -1.91 0.00 0.00 174.94 172.54 2clz s LEU 65 N -1.23 2.21 0.02 8.50 2.96 -1.26 -1.77 118.68 128.11 2clz s LEU 65 Ca -0.09 -0.60 -0.04 0.00 -0.22 0.00 0.00 54.13 53.18 2clz s LEU 65 Cb -0.00 -1.50 -0.04 0.00 0.50 0.00 0.00 46.19 45.15 2clz s LEU 65 CO 0.08 0.02 0.23 0.00 -1.32 0.00 0.00 176.35 175.36 2clz s ALA 66 N 1.15 3.92 -0.04 5.97 0.00 -0.38 -0.65 121.76 131.73 2clz s ALA 66 Ca 0.01 -0.70 -0.23 0.00 0.00 0.00 0.00 51.96 51.04 2clz s ALA 66 Cb -0.14 -1.95 0.05 0.00 0.00 0.00 0.00 23.12 21.08 2clz s ALA 66 CO -0.09 0.72 0.50 -3.38 0.00 0.00 0.00 175.76 173.52 2clz s HIS 67 N -1.37 -0.43 0.01 0.00 -3.43 -0.40 -0.21 115.29 109.47 2clz s HIS 67 Ca 0.30 0.72 -0.07 0.00 -0.80 0.00 0.00 55.06 55.20 2clz s HIS 67 Cb -0.13 0.26 0.00 0.00 -1.43 0.00 0.00 32.58 31.28 2clz s HIS 67 CO 0.20 -0.50 0.14 -0.08 -2.00 0.00 0.00 174.74 172.50 2clz s THR 68 N -1.22 0.09 0.27 -5.38 -1.32 -0.65 -0.98 115.64 106.45 2clz s THR 68 Ca -0.12 -0.76 -0.30 0.00 -1.21 0.00 0.00 61.69 59.30 2clz s THR 68 Cb -0.03 -0.55 -0.09 0.00 -1.51 0.00 0.00 72.50 70.32 2clz s THR 68 CO 0.07 -0.42 1.07 -1.61 -2.21 0.00 0.00 174.62 171.52 2clz s GLU 69 N -1.68 4.68 0.08 7.08 2.02 -1.26 -0.63 118.70 128.98 2clz s GLU 69 Ca -0.12 1.75 -0.21 0.00 0.02 0.00 0.00 54.97 56.40 2clz s GLU 69 Cb -0.06 -3.21 0.05 0.00 0.10 0.00 0.00 34.13 31.01 2clz s GLU 69 CO 0.00 0.26 0.50 -0.59 0.02 0.00 0.00 175.26 175.46 2clz s PHE 70 N -1.14 -0.38 -0.30 1.61 -0.71 -0.77 -4.86 117.98 111.42 2clz s PHE 70 Ca 0.44 0.32 0.03 0.00 -1.04 0.00 0.00 56.93 56.68 2clz s PHE 70 Cb -0.31 0.35 0.08 0.00 -1.21 0.00 0.00 43.02 41.93 2clz s PHE 70 CO 0.39 -0.68 -0.01 0.99 -1.34 0.00 0.00 175.22 174.57 2clz s THR 71 N -2.89 2.05 0.62 -4.49 2.01 -1.26 0.09 115.64 111.77 2clz s THR 71 Ca -0.03 -1.91 -0.17 0.00 0.31 0.00 0.00 61.69 59.88 2clz s THR 71 Cb -0.00 -2.37 -0.02 0.00 0.01 0.00 0.00 72.50 70.12 2clz s THR 71 CO -0.05 -0.36 1.17 -2.16 -0.69 0.00 0.00 174.62 172.53 2clz s PRO 72 N 1.08 2.85 0.36 4.92 0.04 -1.26 -4.77 135.00 138.21 2clz s PRO 72 Ca 0.02 1.68 0.04 0.00 0.04 0.00 0.00 61.00 62.78 2clz s PRO 72 Cb -0.19 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 2clz s PRO 72 CO -0.08 -1.27 0.14 0.95 0.04 0.00 0.00 177.00 176.79 2clz s THR 73 N -1.86 0.53 0.24 1.26 -4.23 -1.26 -1.14 115.64 109.17 2clz s THR 73 Ca 0.74 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 59.17 2clz s THR 73 Cb -0.27 -2.46 0.22 0.00 1.34 0.00 0.00 72.50 71.34 2clz s THR 73 CO 0.36 0.00 1.91 -0.08 -0.54 0.00 0.00 174.62 176.27 2clz h GLU 74 N 1.98 1.21 0.00 3.99 4.81 -1.98 -3.34 114.58 121.25 2clz h GLU 74 Ca -0.35 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 2clz h GLU 74 Cb 1.26 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 30.37 2clz h GLU 74 CO 0.55 0.80 -1.48 0.25 -0.73 0.00 0.00 179.01 178.40 2clz n THR 75 N -4.45 0.00 -1.93 0.32 -2.24 -1.26 -4.99 114.28 99.73 2clz n THR 75 Ca 0.10 -0.28 -0.41 0.00 -2.27 0.00 0.00 64.05 61.19 2clz n THR 75 Cb 0.02 0.29 -0.02 0.00 -2.10 0.00 0.00 70.33 68.52 2clz n THR 75 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2clz s ASP 76 N -3.34 6.56 -0.13 3.42 1.01 -1.25 -5.01 116.67 117.92 2clz s ASP 76 Ca -0.04 2.77 -0.04 0.00 0.71 0.00 0.00 52.55 55.96 2clz s ASP 76 Cb 0.08 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 41.35 2clz s ASP 76 CO 0.53 -0.77 0.01 -0.89 0.21 0.00 0.00 175.17 174.25 2clz s THR 77 N -0.08 4.31 0.07 -1.27 2.01 -1.26 -4.77 115.64 114.65 2clz s THR 77 Ca 0.60 -0.23 0.08 0.00 0.31 0.00 0.00 61.69 62.45 2clz s THR 77 Cb -0.44 -2.87 -0.03 0.00 0.01 0.00 0.00 72.50 69.17 2clz s THR 77 CO 0.46 0.54 -0.21 -0.31 -0.69 0.00 0.00 174.62 174.41 2clz s TYR 78 N -0.20 1.80 0.17 4.92 1.51 -1.26 -0.21 117.35 124.08 2clz s TYR 78 Ca 0.05 -0.39 -0.11 0.00 -1.01 0.00 0.00 57.07 55.60 2clz s TYR 78 Cb -0.12 -1.03 0.00 0.00 -0.11 0.00 0.00 41.96 40.70 2clz s TYR 78 CO 0.02 0.15 0.35 0.00 -1.11 0.00 0.00 175.55 174.95 2clz s ALA 79 N -0.97 -0.30 -0.10 3.71 0.00 -0.35 -0.64 121.76 123.12 2clz s ALA 79 Ca 0.07 -0.66 0.02 0.00 0.00 0.00 0.00 51.96 51.39 2clz s ALA 79 Cb -0.09 0.83 0.01 0.00 0.00 0.00 0.00 23.12 23.86 2clz s ALA 79 CO 0.03 -0.68 -0.17 0.00 0.00 0.00 0.00 175.76 174.94 2clz s ARG 81 N 0.73 3.35 -0.11 0.00 3.52 0.45 -0.82 118.95 126.07 2clz s ARG 81 Ca -0.12 -0.68 0.03 0.00 -0.13 0.00 0.00 55.73 54.83 2clz s ARG 81 Cb -0.16 -2.72 0.00 0.00 -1.56 0.00 0.00 34.95 30.52 2clz s ARG 81 CO 0.02 0.08 -0.23 0.08 -0.81 0.00 0.00 175.30 174.44 2clz s VAL 82 N 0.71 2.00 -0.19 7.11 1.01 0.28 -0.71 120.40 130.62 2clz s VAL 82 Ca -0.05 -0.97 -0.03 0.00 0.00 0.00 0.00 61.98 60.93 2clz s VAL 82 Cb -0.15 -1.75 -0.01 0.00 0.00 0.00 0.00 36.38 34.47 2clz s VAL 82 CO 0.02 0.54 -0.07 -0.75 0.00 0.00 0.00 175.10 174.84 2clz s LYS 83 N 0.54 3.39 -0.07 2.72 2.20 0.29 -0.54 119.74 128.26 2clz s LYS 83 Ca -0.14 -0.64 -0.13 0.00 -0.36 0.00 0.00 55.97 54.70 2clz s LYS 83 Cb -0.17 -2.88 0.03 0.00 -1.51 0.00 0.00 37.83 33.30 2clz s LYS 83 CO 0.05 -0.05 0.31 -1.58 -0.36 0.00 0.00 175.35 173.71 2clz s HIS 84 N 1.08 -0.27 0.65 4.03 2.46 -1.26 -1.78 115.29 120.20 2clz s HIS 84 Ca 0.01 0.58 0.44 0.00 0.47 0.00 0.00 55.06 56.56 2clz s HIS 84 Cb -0.15 0.10 2.40 0.00 -0.13 0.00 0.00 32.58 34.80 2clz s HIS 84 CO -0.01 -0.27 2.36 -0.44 -2.47 0.00 0.00 174.74 173.92 2clz h ASP 85 N 4.85 0.00 0.87 9.88 3.45 -1.94 -0.74 116.42 132.80 2clz h ASP 85 Ca -0.28 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.18 2clz h ASP 85 Cb 1.18 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.95 2clz h ASP 85 CO 0.35 0.00 0.00 -1.54 -1.57 0.00 0.00 179.24 176.48 2clz n SER 86 N -3.10 0.66 -4.36 6.45 3.41 -1.26 -4.75 113.62 110.66 2clz n SER 86 Ca -0.03 0.64 -0.32 0.00 -0.26 0.00 0.00 58.87 58.90 2clz n SER 86 Cb 0.08 -0.79 -0.15 0.00 -0.26 0.00 0.00 64.21 63.09 2clz n SER 86 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2clz s MET 87 N -3.25 2.43 0.38 4.33 -1.94 -0.28 -4.87 119.30 116.10 2clz s MET 87 Ca 0.06 -0.83 0.08 0.00 -1.71 0.00 0.00 55.69 53.30 2clz s MET 87 Cb 0.10 -2.23 0.78 0.00 2.01 0.00 0.00 34.83 35.49 2clz s MET 87 CO 0.43 0.52 1.93 0.00 -0.01 0.00 0.00 175.02 177.89 2clz h ALA 88 N 5.65 1.52 -2.34 3.03 0.00 -1.85 -3.44 119.26 121.82 2clz h ALA 88 Ca -0.41 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.20 2clz h ALA 88 Cb 1.15 -0.10 -0.15 0.00 0.00 0.00 0.00 17.79 18.69 2clz h ALA 88 CO 0.49 0.34 -0.62 -1.83 0.00 0.00 0.00 179.25 177.63 2clz s GLU 89 N -4.88 0.75 0.29 0.00 -1.05 -1.26 -5.13 118.70 107.42 2clz s GLU 89 Ca -0.06 -1.26 -0.30 0.00 -0.15 0.00 0.00 54.97 53.20 2clz s GLU 89 Cb 0.16 0.24 -0.11 0.00 -0.44 0.00 0.00 34.13 33.98 2clz s GLU 89 CO 0.74 -0.18 1.57 -2.14 0.95 0.00 0.00 175.26 176.19 2clz s PRO 90 N -3.95 4.14 -0.23 -4.83 0.02 -1.26 -4.85 135.00 124.03 2clz s PRO 90 Ca 0.12 2.55 -0.12 0.00 0.02 0.00 0.00 61.00 63.58 2clz s PRO 90 Cb 0.07 -3.03 -0.05 0.00 0.02 0.00 0.00 34.50 31.52 2clz s PRO 90 CO -0.06 -0.60 0.21 0.21 -0.33 0.00 0.00 177.00 176.43 2clz s LYS 91 N -0.59 4.09 -0.23 5.54 2.47 0.30 -4.88 119.74 126.44 2clz s LYS 91 Ca 0.62 -0.17 -0.06 0.00 -1.56 0.00 0.00 55.97 54.81 2clz s LYS 91 Cb -0.47 -3.54 -0.02 0.00 -1.46 0.00 0.00 37.83 32.34 2clz s LYS 91 CO 0.48 0.04 0.01 0.99 0.16 0.00 0.00 175.35 177.04 2clz s THR 92 N 1.12 3.85 -0.18 3.43 2.01 -1.26 -0.56 115.64 124.05 2clz s THR 92 Ca 0.10 -0.33 -0.02 0.00 0.31 0.00 0.00 61.69 61.75 2clz s THR 92 Cb -0.14 -2.78 -0.01 0.00 0.01 0.00 0.00 72.50 69.59 2clz s THR 92 CO 0.05 0.38 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.59 2clz s VAL 93 N 1.51 3.14 0.21 3.82 1.01 0.00 -4.96 120.40 125.13 2clz s VAL 93 Ca 0.06 -0.59 -0.20 0.00 0.00 0.00 0.00 61.98 61.25 2clz s VAL 93 Cb -0.15 -2.38 -0.08 0.00 0.00 0.00 0.00 36.38 33.77 2clz s VAL 93 CO 0.00 0.47 0.71 -0.31 0.00 0.00 0.00 175.10 175.98 2clz s TYR 94 N 1.05 3.67 0.07 5.22 2.02 -1.26 -0.99 117.35 127.12 2clz s TYR 94 Ca -0.00 1.38 -0.31 0.00 -0.37 0.00 0.00 57.07 57.77 2clz s TYR 94 Cb -0.15 -2.61 -0.06 0.00 -0.40 0.00 0.00 41.96 38.74 2clz s TYR 94 CO -0.01 0.36 1.32 -0.46 -1.57 0.00 0.00 175.55 175.19 2clz s TRP 95 N -1.48 3.23 -0.26 2.71 -0.00 0.19 -4.85 118.94 118.49 2clz s TRP 95 Ca 0.42 1.06 -0.01 0.00 -0.00 0.00 0.00 56.10 57.57 2clz s TRP 95 Cb -0.17 -3.58 0.04 0.00 -0.00 0.00 0.00 33.47 29.76 2clz s TRP 95 CO 0.21 -1.96 -0.06 0.34 -0.00 0.00 0.00 176.95 175.48 2clz s ASP 96 N 1.26 4.41 0.00 5.86 -1.08 -1.26 -4.78 116.67 121.08 2clz s ASP 96 Ca 0.62 -1.05 0.05 0.00 -0.52 0.00 0.00 52.55 51.66 2clz s ASP 96 Cb -0.33 -1.65 0.23 0.00 -1.46 0.00 0.00 42.92 39.72 2clz s ASP 96 CO 0.29 -0.16 1.12 -2.11 0.52 0.00 0.00 175.17 174.83 2clz n ARG 97 N 4.62 0.02 0.00 4.34 1.85 -1.26 -1.00 116.66 125.22 2clz n ARG 97 Ca -0.15 0.36 0.13 0.00 -1.00 0.00 0.00 57.85 57.19 2clz n ARG 97 Cb 0.45 -1.50 0.33 0.00 -1.05 0.00 0.00 32.46 30.69 2clz n ARG 97 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2clz n ASP 98 N -1.44 2.02 0.00 2.89 8.00 -1.26 -4.83 116.55 121.93 2clz n ASP 98 Ca 0.02 -1.62 0.00 0.00 0.71 0.00 0.00 54.79 53.89 2clz n ASP 98 Cb 0.06 0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.20 2clz n ASP 98 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04