#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1azq s VAL 2 N 0.00 2.51 -0.12 2.03 1.01 -1.26 -5.05 120.40 119.52 1azq s VAL 2 Ca 0.00 -1.15 -0.15 0.00 0.00 0.00 0.00 61.98 60.68 1azq s VAL 2 Cb 0.00 -2.27 -0.05 0.00 0.00 0.00 0.00 36.38 34.06 1azq s VAL 2 CO 0.00 0.23 0.37 -0.54 0.00 0.00 0.00 175.10 175.16 1azq s LYS 3 N 1.26 4.22 -0.22 2.72 3.01 -1.26 -0.85 119.74 128.63 1azq s LYS 3 Ca -0.01 0.27 -0.06 0.00 -1.01 0.00 0.00 55.97 55.16 1azq s LYS 3 Cb -0.17 -3.39 -0.03 0.00 -1.01 0.00 0.00 37.83 33.24 1azq s LYS 3 CO -0.07 0.29 0.02 0.08 0.51 0.00 0.00 175.35 176.19 1azq s VAL 4 N 0.26 4.10 -0.13 3.17 1.01 0.11 -4.89 120.40 124.04 1azq s VAL 4 Ca 0.21 -0.26 -0.09 0.00 0.00 0.00 0.00 61.98 61.85 1azq s VAL 4 Cb -0.14 -2.87 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 1azq s VAL 4 CO 0.08 0.40 0.17 -0.54 0.00 0.00 0.00 175.10 175.21 1azq s LYS 5 N 1.17 3.66 0.10 2.72 1.02 -1.26 -0.54 119.74 126.60 1azq s LYS 5 Ca 0.03 -0.08 -0.25 0.00 0.02 0.00 0.00 55.97 55.69 1azq s LYS 5 Cb -0.14 -3.25 0.07 0.00 -0.52 0.00 0.00 37.83 33.99 1azq s LYS 5 CO 0.02 0.66 0.62 -0.59 -0.92 0.00 0.00 175.35 175.14 1azq s PHE 6 N -0.71 -0.57 -0.21 3.18 -0.71 0.68 -4.97 117.98 114.68 1azq s PHE 6 Ca 0.15 0.55 -0.05 0.00 -1.04 0.00 0.00 56.93 56.53 1azq s PHE 6 Cb -0.12 0.52 -0.02 0.00 -1.21 0.00 0.00 43.02 42.18 1azq s PHE 6 CO 0.04 -0.78 -0.00 0.21 -1.34 0.00 0.00 175.22 173.34 1azq s LYS 7 N -3.06 3.58 -0.07 1.99 2.20 -1.26 0.16 119.74 123.28 1azq s LYS 7 Ca -0.02 -0.54 0.00 0.00 -0.36 0.00 0.00 55.97 55.05 1azq s LYS 7 Cb -0.01 -3.07 0.02 0.00 -1.51 0.00 0.00 37.83 33.26 1azq s LYS 7 CO -0.07 -0.03 -0.05 -0.47 -0.36 0.00 0.00 175.35 174.37 1azq s TYR 8 N 1.11 1.00 -1.32 4.03 5.04 0.63 -4.75 117.35 123.08 1azq s TYR 8 Ca 0.02 -0.37 -0.06 0.00 -2.44 0.00 0.00 57.07 54.23 1azq s TYR 8 Cb -0.14 -0.90 0.01 0.00 0.35 0.00 0.00 41.96 41.28 1azq s TYR 8 CO 0.01 -0.32 1.08 1.63 -1.34 0.00 0.00 175.55 176.61 1azq n LYS 9 N 4.56 -7.18 0.00 4.97 4.76 -1.26 -1.99 118.16 122.01 1azq n LYS 9 Ca -0.16 0.81 0.00 0.00 -2.87 0.00 0.00 58.31 56.08 1azq n LYS 9 Cb 0.50 -5.81 0.00 0.00 -1.84 0.00 0.00 35.03 27.88 1azq n LYS 9 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1azq n GLY 10 N -1.67 2.08 3.76 0.72 0.00 -1.26 -4.95 105.19 103.86 1azq n GLY 10 Ca -0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 1azq n GLY 10 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1azq s GLU 11 N 0.00 4.50 -0.02 1.61 2.12 -0.84 -5.01 118.70 121.06 1azq s GLU 11 Ca 0.00 1.07 -0.24 0.00 0.36 0.00 0.00 54.97 56.15 1azq s GLU 11 Cb 0.00 -3.33 -0.04 0.00 0.26 0.00 0.00 34.13 31.02 1azq s GLU 11 CO 0.00 0.39 0.75 -2.00 -0.54 0.00 0.00 175.26 173.85 1azq s GLU 12 N -0.43 4.46 0.26 4.30 2.56 -1.26 -0.27 118.70 128.32 1azq s GLU 12 Ca 0.37 0.99 0.04 0.00 0.00 0.00 0.00 54.97 56.38 1azq s GLU 12 Cb -0.21 -3.41 -0.06 0.00 2.00 0.00 0.00 34.13 32.45 1azq s GLU 12 CO 0.24 0.15 -0.01 0.15 -0.56 0.00 0.00 175.26 175.22 1azq s LYS 13 N 0.46 1.44 -0.07 4.30 -0.14 0.42 -4.96 119.74 121.20 1azq s LYS 13 Ca 0.39 -1.74 -0.03 0.00 -1.36 0.00 0.00 55.97 53.23 1azq s LYS 13 Cb -0.19 -0.80 0.04 0.00 -1.68 0.00 0.00 37.83 35.20 1azq s LYS 13 CO 0.21 -0.07 0.16 -2.00 -0.76 0.00 0.00 175.35 172.88 1azq s GLU 14 N -3.83 0.11 0.01 1.68 -6.30 -1.26 -0.23 118.70 108.88 1azq s GLU 14 Ca 0.30 0.36 -0.01 0.00 -2.50 0.00 0.00 54.97 53.13 1azq s GLU 14 Cb 0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 34.13 34.04 1azq s GLU 14 CO 0.11 -0.14 0.00 0.54 0.02 0.00 0.00 175.26 175.78 1azq s VAL 15 N 1.03 0.06 0.15 3.70 0.11 0.29 -4.92 120.40 120.83 1azq s VAL 15 Ca -0.08 -0.53 -0.26 0.00 -2.93 0.00 0.00 61.98 58.18 1azq s VAL 15 Cb -0.10 -0.18 -0.08 0.00 -1.53 0.00 0.00 36.38 34.49 1azq s VAL 15 CO -0.05 -0.29 0.80 -0.62 -3.33 0.00 0.00 175.10 171.61 1azq s ASP 16 N -0.86 7.40 0.62 3.54 2.15 -1.26 0.09 116.67 128.36 1azq s ASP 16 Ca -0.09 1.66 0.40 0.00 0.43 0.00 0.00 52.55 54.94 1azq s ASP 16 Cb -0.06 -2.51 2.16 0.00 -0.30 0.00 0.00 42.92 42.21 1azq s ASP 16 CO -0.00 0.17 2.21 0.71 -0.17 0.00 0.00 175.17 178.09 1azq h THR 17 N 3.44 0.00 0.00 1.71 1.35 -1.37 -0.87 112.91 117.17 1azq h THR 17 Ca -0.46 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 1azq h THR 17 Cb 1.21 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 1azq h THR 17 CO 0.67 0.00 0.00 0.77 -0.25 0.00 0.00 175.52 176.71 1azq h SER 18 N 0.00 0.00 0.06 5.36 4.64 -1.92 -2.66 113.55 119.03 1azq h SER 18 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1azq h SER 18 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1azq h SER 18 CO 0.00 0.00 -0.50 0.29 -0.87 0.00 0.00 176.83 175.75 1azq n LYS 19 N -2.47 0.93 -2.33 4.77 4.76 -0.33 -4.92 118.16 118.58 1azq n LYS 19 Ca 0.03 -0.73 -0.43 0.00 -2.87 0.00 0.00 58.31 54.32 1azq n LYS 19 Cb 0.33 -1.48 -0.02 0.00 -1.84 0.00 0.00 35.03 32.01 1azq n LYS 19 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1azq s ILE 20 N -2.57 4.08 -0.14 -0.18 1.01 -1.00 -1.03 121.20 121.37 1azq s ILE 20 Ca 0.18 1.27 -0.24 0.00 0.00 0.00 0.00 60.65 61.86 1azq s ILE 20 Cb 0.18 -3.93 -0.25 0.00 0.01 0.00 0.00 42.46 38.47 1azq s ILE 20 CO 0.60 -0.24 0.63 0.11 0.00 0.00 0.00 174.94 176.04 1azq h LYS 21 N 9.01 0.08 -4.07 2.79 1.57 -0.87 -3.48 116.57 121.60 1azq h LYS 21 Ca -0.29 -0.13 -0.20 0.00 -1.87 0.00 0.00 60.65 58.16 1azq h LYS 21 Cb 1.12 0.05 -0.22 0.00 0.08 0.00 0.00 32.23 33.25 1azq h LYS 21 CO 0.99 1.06 -0.71 0.21 -0.57 0.00 0.00 179.45 180.43 1azq s LYS 22 N -2.32 0.31 0.01 3.15 2.20 -1.19 -4.98 119.74 116.93 1azq s LYS 22 Ca -0.21 -0.54 0.01 0.00 -0.36 0.00 0.00 55.97 54.88 1azq s LYS 22 Cb 0.01 -0.00 -0.01 0.00 -1.51 0.00 0.00 37.83 36.31 1azq s LYS 22 CO 0.70 -0.02 -0.05 0.08 -0.36 0.00 0.00 175.35 175.70 1azq s VAL 23 N -1.19 0.32 0.10 4.02 1.01 -1.26 -1.64 120.40 121.76 1azq s VAL 23 Ca -0.12 -0.54 -0.23 0.00 0.00 0.00 0.00 61.98 61.09 1azq s VAL 23 Cb -0.08 -0.34 0.06 0.00 0.00 0.00 0.00 36.38 36.01 1azq s VAL 23 CO -0.01 -0.15 0.57 -1.66 0.00 0.00 0.00 175.10 173.85 1azq s TRP 24 N -0.69 -0.49 -0.12 5.22 -2.14 -0.32 -4.92 118.94 115.49 1azq s TRP 24 Ca -0.05 0.40 -0.06 0.00 2.66 0.00 0.00 56.10 59.06 1azq s TRP 24 Cb -0.05 0.45 -0.04 0.00 -3.10 0.00 0.00 33.47 30.73 1azq s TRP 24 CO -0.00 -0.76 0.09 0.50 -2.66 0.00 0.00 176.95 174.13 1azq s ARG 25 N -3.16 3.39 -0.39 3.25 3.52 -1.26 -0.86 118.95 123.44 1azq s ARG 25 Ca -0.02 -0.23 0.01 0.00 -0.13 0.00 0.00 55.73 55.36 1azq s ARG 25 Cb -0.00 -3.09 0.14 0.00 -1.56 0.00 0.00 34.95 30.44 1azq s ARG 25 CO -0.08 0.69 0.23 0.08 -0.81 0.00 0.00 175.30 175.42 1azq s VAL 26 N -0.81 0.66 0.00 7.11 1.01 0.35 -4.95 120.40 123.78 1azq s VAL 26 Ca 0.13 -2.11 0.00 0.00 0.00 0.00 0.00 61.98 60.00 1azq s VAL 26 Cb -0.12 -1.47 0.00 0.00 0.00 0.00 0.00 36.38 34.79 1azq s VAL 26 CO 0.03 -0.97 0.00 0.61 0.00 0.00 0.00 175.10 174.77 1azq n GLY 27 N 3.77 2.03 1.14 4.51 0.00 -1.26 -1.63 105.19 113.74 1azq n GLY 27 Ca 0.12 -0.39 0.09 0.00 0.00 0.00 0.00 46.02 45.84 1azq n GLY 27 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1azq n LYS 28 N 12.80 2.50 -4.10 1.61 5.02 -1.26 -4.90 118.16 129.83 1azq n LYS 28 Ca 0.00 -2.18 -0.34 0.00 -2.02 0.00 0.00 58.31 53.77 1azq n LYS 28 Cb 0.00 -1.51 -0.07 0.00 -0.02 0.00 0.00 35.03 33.43 1azq n LYS 28 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 1azq s MET 29 N -1.27 3.12 -0.28 1.97 1.75 -0.65 -1.72 119.30 122.21 1azq s MET 29 Ca 0.40 -0.43 -0.02 0.00 -1.25 0.00 0.00 55.69 54.39 1azq s MET 29 Cb 0.22 -2.90 0.04 0.00 2.84 0.00 0.00 34.83 35.03 1azq s MET 29 CO 0.26 0.67 -0.02 0.08 -0.65 0.00 0.00 175.02 175.36 1azq s VAL 30 N -1.15 2.95 0.20 10.11 1.01 -0.28 -0.49 120.40 132.74 1azq s VAL 30 Ca 0.21 -1.25 0.04 0.00 0.00 0.00 0.00 61.98 60.99 1azq s VAL 30 Cb -0.12 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 1azq s VAL 30 CO 0.12 0.01 0.27 -0.44 0.00 0.00 0.00 175.10 175.06 1azq s SER 31 N 1.28 6.07 0.21 3.32 0.01 -0.04 -1.56 113.70 123.00 1azq s SER 31 Ca -0.03 0.02 -0.23 0.00 1.31 0.00 0.00 55.95 57.02 1azq s SER 31 Cb -0.19 -1.74 0.04 0.00 0.21 0.00 0.00 66.02 64.35 1azq s SER 31 CO -0.02 0.00 0.82 0.72 0.41 0.00 0.00 173.24 175.16 1azq s PHE 32 N -1.88 -0.19 0.07 2.43 -0.71 -0.31 -1.18 117.98 116.22 1azq s PHE 32 Ca 0.33 -0.19 0.06 0.00 -1.04 0.00 0.00 56.93 56.10 1azq s PHE 32 Cb -0.10 0.67 -0.03 0.00 -1.21 0.00 0.00 43.02 42.35 1azq s PHE 32 CO 0.27 -1.03 -0.16 0.95 -1.34 0.00 0.00 175.22 173.91 1azq s THR 33 N -3.63 1.23 0.15 -4.49 -4.23 -0.65 -1.68 115.64 102.33 1azq s THR 33 Ca 0.11 -1.33 -0.02 0.00 -1.18 0.00 0.00 61.69 59.26 1azq s THR 33 Cb -0.04 -1.16 -0.03 0.00 1.34 0.00 0.00 72.50 72.60 1azq s THR 33 CO 0.04 -0.18 0.11 -0.72 -0.54 0.00 0.00 174.62 173.33 1azq s TYR 34 N -1.22 0.84 -0.65 3.99 1.13 -0.81 -0.14 117.35 120.49 1azq s TYR 34 Ca -0.00 -1.18 -0.28 0.00 -1.41 0.00 0.00 57.07 54.20 1azq s TYR 34 Cb -0.10 -0.42 0.02 0.00 -1.10 0.00 0.00 41.96 40.37 1azq s TYR 34 CO 0.03 -0.58 1.31 0.34 -2.51 0.00 0.00 175.55 174.14 1azq s ASP 35 N -3.06 6.19 -0.56 -0.18 -1.08 -0.19 0.04 116.67 117.84 1azq s ASP 35 Ca 0.26 -0.10 -0.03 0.00 -0.52 0.00 0.00 52.55 52.16 1azq s ASP 35 Cb 0.07 -2.55 0.18 0.00 -1.46 0.00 0.00 42.92 39.15 1azq s ASP 35 CO 0.03 -1.74 2.46 -0.67 0.52 0.00 0.00 175.17 175.78 1azq n ASP 36 N 9.32 6.83 -2.85 -0.34 2.03 0.16 -4.74 116.55 126.96 1azq n ASP 36 Ca 0.07 -3.40 -0.01 0.00 0.52 0.00 0.00 54.79 51.98 1azq n ASP 36 Cb 0.49 -1.16 0.00 0.00 -0.72 0.00 0.00 41.12 39.74 1azq n ASP 36 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1azq n ASN 37 N 0.34 -6.92 0.00 1.67 5.15 -1.26 -3.44 115.26 110.81 1azq n ASN 37 Ca 0.49 -0.10 0.00 0.00 -0.60 0.00 0.00 54.58 54.38 1azq n ASN 37 Cb 0.47 -4.70 0.00 0.00 -0.53 0.00 0.00 39.78 35.03 1azq n ASN 37 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1azq n GLY 38 N -1.63 2.06 3.77 8.20 0.00 -1.26 -4.96 105.19 111.36 1azq n GLY 38 Ca -0.00 -0.38 -0.39 0.00 0.00 0.00 0.00 46.02 45.25 1azq n GLY 38 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1azq s LYS 39 N 0.00 4.39 -0.14 1.61 -2.85 -1.22 -4.99 119.74 116.55 1azq s LYS 39 Ca 0.00 1.70 -0.26 0.00 -1.00 0.00 0.00 55.97 56.41 1azq s LYS 39 Cb 0.00 -2.88 -0.02 0.00 -2.06 0.00 0.00 37.83 32.87 1azq s LYS 39 CO 0.00 0.02 0.85 0.99 0.10 0.00 0.00 175.35 177.31 1azq s THR 40 N -1.38 4.88 0.45 3.79 2.01 -1.26 0.37 115.64 124.50 1azq s THR 40 Ca 0.51 1.70 0.02 0.00 0.31 0.00 0.00 61.69 64.23 1azq s THR 40 Cb -0.28 -4.17 0.00 0.00 0.01 0.00 0.00 72.50 68.07 1azq s THR 40 CO 0.36 0.06 0.65 -0.83 -0.69 0.00 0.00 174.62 174.17 1azq s GLY 41 N 1.09 1.65 0.03 4.40 0.00 0.11 -4.85 107.32 109.75 1azq s GLY 41 Ca 0.41 -1.22 0.05 0.00 0.00 0.00 0.00 44.72 43.95 1azq s GLY 41 CO 0.15 -1.04 -0.14 0.50 0.00 0.00 0.00 173.10 172.56 1azq s ARG 42 N -4.52 0.98 0.16 2.90 0.52 -1.26 -1.92 118.95 115.80 1azq s ARG 42 Ca 0.50 -0.75 -0.24 0.00 -0.52 0.00 0.00 55.73 54.73 1azq s ARG 42 Cb -0.10 -0.99 0.06 0.00 0.52 0.00 0.00 34.95 34.44 1azq s ARG 42 CO 0.37 0.25 0.76 0.20 0.02 0.00 0.00 175.30 176.89 1azq s GLY 43 N -1.07 -0.36 -0.15 -3.53 0.00 -0.68 -4.98 107.32 96.56 1azq s GLY 43 Ca 0.02 0.29 -0.28 0.00 0.00 0.00 0.00 44.72 44.75 1azq s GLY 43 CO 0.01 0.09 0.70 0.00 0.00 0.00 0.00 173.10 173.90 1azq s ALA 44 N -3.59 -1.78 0.15 3.20 0.00 -1.26 -1.17 121.76 117.32 1azq s ALA 44 Ca 0.07 1.63 -0.00 0.00 0.00 0.00 0.00 51.96 53.66 1azq s ALA 44 Cb -0.03 -0.52 -0.04 0.00 0.00 0.00 0.00 23.12 22.53 1azq s ALA 44 CO -0.04 -0.36 0.04 0.14 0.00 0.00 0.00 175.76 175.55 1azq s VAL 45 N -0.50 0.26 0.37 0.00 -7.23 -0.60 -4.73 120.40 107.97 1azq s VAL 45 Ca -0.06 -1.93 -0.26 0.00 -1.81 0.00 0.00 61.98 57.92 1azq s VAL 45 Cb -0.02 -2.09 -0.09 0.00 0.56 0.00 0.00 36.38 34.74 1azq s VAL 45 CO 0.06 -0.45 1.11 -0.55 -0.31 0.00 0.00 175.10 174.96 1azq s SER 46 N -3.09 6.78 0.57 4.85 0.15 -1.26 -1.13 113.70 120.57 1azq s SER 46 Ca 0.25 2.22 0.27 0.00 0.70 0.00 0.00 55.95 59.39 1azq s SER 46 Cb 0.07 -2.61 1.54 0.00 -1.71 0.00 0.00 66.02 63.31 1azq s SER 46 CO 0.03 -0.48 2.04 -0.08 1.20 0.00 0.00 173.24 175.95 1azq h GLU 47 N 2.86 0.00 0.00 5.44 4.81 -1.67 0.29 114.58 126.31 1azq h GLU 47 Ca -0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1azq h GLU 47 Cb 1.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1azq h GLU 47 CO 0.63 0.00 -0.02 0.87 -0.73 0.00 0.00 179.01 179.76 1azq h LYS 48 N 0.00 0.00 -0.41 1.92 1.79 -1.90 -3.22 116.57 114.75 1azq h LYS 48 Ca 0.14 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 1azq h LYS 48 Cb 0.70 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.35 1azq h LYS 48 CO -0.00 0.00 0.00 -0.25 -1.08 0.00 0.00 179.45 178.12 1azq n ASP 49 N -3.04 3.27 -4.73 0.86 8.00 0.96 -4.95 116.55 116.92 1azq n ASP 49 Ca 0.04 -1.96 -0.37 0.00 0.71 0.00 0.00 54.79 53.21 1azq n ASP 49 Cb 0.52 -0.27 -0.07 0.00 -0.02 0.00 0.00 41.12 41.29 1azq n ASP 49 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1azq s ALA 50 N -1.46 3.55 0.52 2.24 0.00 -0.92 -4.84 121.76 120.84 1azq s ALA 50 Ca 0.39 -0.34 -0.21 0.00 0.00 0.00 0.00 51.96 51.80 1azq s ALA 50 Cb 0.22 -2.49 -0.06 0.00 0.00 0.00 0.00 23.12 20.79 1azq s ALA 50 CO 0.31 0.08 1.22 -1.25 0.00 0.00 0.00 175.76 176.12 1azq s PRO 51 N 0.45 3.39 0.33 0.00 0.04 -1.26 -4.87 135.00 133.08 1azq s PRO 51 Ca 0.21 1.89 0.11 0.00 0.04 0.00 0.00 61.00 63.25 1azq s PRO 51 Cb -0.14 -2.23 0.97 0.00 0.04 0.00 0.00 34.50 33.14 1azq s PRO 51 CO 0.07 -0.88 1.67 -0.22 0.04 0.00 0.00 177.00 177.68 1azq h LYS 52 N 1.57 0.34 -0.91 4.56 3.64 -1.98 0.59 116.57 124.39 1azq h LYS 52 Ca -0.50 -0.02 0.15 0.00 -1.27 0.00 0.00 60.65 59.01 1azq h LYS 52 Cb 1.27 -0.08 -0.07 0.00 -0.41 0.00 0.00 32.23 32.94 1azq h LYS 52 CO 0.58 0.23 0.58 1.49 -2.27 0.00 0.00 179.45 180.06 1azq h GLU 53 N 0.35 0.68 -0.11 1.90 4.81 -1.99 0.70 114.58 120.92 1azq h GLU 53 Ca 0.68 -0.04 -0.20 0.00 -0.13 0.00 0.00 59.36 59.67 1azq h GLU 53 Cb 1.47 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.69 1azq h GLU 53 CO -0.59 0.45 -0.76 1.25 -0.73 0.00 0.00 179.01 178.64 1azq h LEU 54 N 0.70 0.68 -1.28 1.64 5.85 -1.23 -2.54 115.31 119.12 1azq h LEU 54 Ca 0.46 -0.45 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 1azq h LEU 54 Cb 0.75 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 1azq h LEU 54 CO -0.22 1.22 -0.35 -0.07 -0.34 0.00 0.00 178.44 178.68 1azq h LEU 55 N 0.39 0.00 -0.29 2.25 3.38 -1.06 -1.92 115.31 118.07 1azq h LEU 55 Ca -0.04 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.73 1azq h LEU 55 Cb 1.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.11 1azq h LEU 55 CO 0.14 0.35 -0.66 0.44 0.09 0.00 0.00 178.44 178.80 1azq h ASP 56 N 0.00 0.85 -0.05 -0.43 5.19 -0.74 -1.99 116.42 119.25 1azq h ASP 56 Ca -0.00 -0.51 -0.07 0.00 -0.62 0.00 0.00 57.03 55.83 1azq h ASP 56 Cb 0.66 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.91 1azq h ASP 56 CO 0.05 1.29 -0.16 0.24 -3.12 0.00 0.00 179.24 177.53 1azq h MET 57 N 0.54 0.39 -0.21 3.56 2.86 -1.22 -1.07 114.93 119.78 1azq h MET 57 Ca -0.02 -0.11 -0.12 0.00 -2.06 0.00 0.00 59.70 57.39 1azq h MET 57 Cb 1.27 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.89 1azq h MET 57 CO 0.14 0.55 -0.34 1.25 1.06 0.00 0.00 176.91 179.57 1azq h LEU 58 N 0.36 0.66 -0.55 1.22 5.85 -1.21 -2.04 115.31 119.60 1azq h LEU 58 Ca 0.07 -0.53 0.02 0.00 0.84 0.00 0.00 57.88 58.28 1azq h LEU 58 Cb 0.50 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 1azq h LEU 58 CO 0.03 1.06 0.34 0.00 -0.34 0.00 0.00 178.44 179.53 1azq h ALA 59 N 0.62 0.70 0.00 1.25 0.00 -1.21 -0.31 119.26 120.31 1azq h ALA 59 Ca 0.02 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1azq h ALA 59 Cb 0.92 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1azq h ALA 59 CO 0.08 0.08 -0.31 0.00 0.00 0.00 0.00 179.25 179.10 1azq h ARG 60 N 0.69 0.00 -0.35 0.00 3.08 -1.17 -2.85 114.38 113.77 1azq h ARG 60 Ca 0.21 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.11 1azq h ARG 60 Cb -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 1azq h ARG 60 CO -0.07 0.31 -0.38 0.00 -1.07 0.00 0.00 179.97 178.76 1azq h ALA 61 N 1.69 0.66 0.00 0.04 0.00 -0.38 -2.87 119.26 118.40 1azq h ALA 61 Ca -0.00 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1azq h ALA 61 Cb 0.59 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1azq h ALA 61 CO 0.04 0.67 0.00 0.93 0.00 0.00 0.00 179.25 180.89 1azq h GLU 62 N 0.69 0.00 0.00 0.00 5.08 -0.90 -2.93 114.58 116.53 1azq h GLU 62 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1azq h GLU 62 Cb 0.95 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.20 1azq h GLU 62 CO 0.09 0.00 -1.04 0.54 -1.00 0.00 0.00 179.01 177.59 1azq n ARG 63 N -2.94 0.41 -1.63 2.33 1.74 -1.10 -4.98 116.66 110.49 1azq n ARG 63 Ca 0.01 0.03 -0.42 0.00 -0.77 0.00 0.00 57.85 56.70 1azq n ARG 63 Cb 0.27 -1.66 0.01 0.00 -1.02 0.00 0.00 32.46 30.06 1azq n ARG 63 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1azq n GLU 64 N -2.20 1.46 -2.73 5.56 1.02 -1.11 -5.02 120.64 117.62 1azq n GLU 64 Ca 0.01 0.52 -0.07 0.00 -0.02 0.00 0.00 57.16 57.60 1azq n GLU 64 Cb 0.48 -2.09 -0.02 0.00 -0.02 0.00 0.00 31.44 29.78 1azq n GLU 64 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 1azq n LYS 65 N 0.17 0.47 -0.93 3.49 2.85 -1.26 -5.10 118.16 117.85 1azq n LYS 65 Ca 0.09 -1.07 0.00 0.00 -1.05 0.00 0.00 58.31 56.28 1azq n LYS 65 Cb 0.39 0.73 0.00 0.00 -0.65 0.00 0.00 35.03 35.50 1azq n LYS 65 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98