#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sap n VAL 2 N 0.00 0.50 -1.19 3.17 3.14 -1.26 -4.92 118.33 117.76 1sap n VAL 2 Ca 0.00 -0.97 -0.29 0.00 -2.96 0.00 0.00 64.34 60.12 1sap n VAL 2 Cb 0.00 0.48 0.16 0.00 -1.06 0.00 0.00 33.84 33.41 1sap n VAL 2 CO 0.00 0.00 0.00 -1.59 -6.46 0.00 0.00 176.83 168.78 1sap s LYS 3 N -0.74 0.79 -0.50 1.45 -2.85 -1.26 -4.69 119.74 111.94 1sap s LYS 3 Ca 0.19 0.64 -0.22 0.00 -1.00 0.00 0.00 55.97 55.59 1sap s LYS 3 Cb 0.20 -1.77 0.04 0.00 -2.06 0.00 0.00 37.83 34.24 1sap s LYS 3 CO -0.06 -2.52 0.76 0.08 0.10 0.00 0.00 175.35 173.72 1sap s VAL 4 N -2.96 4.67 0.15 1.79 1.01 0.56 -4.81 120.40 120.82 1sap s VAL 4 Ca 0.64 0.04 -0.30 0.00 0.00 0.00 0.00 61.98 62.36 1sap s VAL 4 Cb -0.18 -4.36 -0.07 0.00 0.00 0.00 0.00 36.38 31.76 1sap s VAL 4 CO 0.57 -0.85 1.00 -0.54 0.00 0.00 0.00 175.10 175.28 1sap s LYS 5 N 3.21 4.69 0.00 2.72 1.02 -1.26 -0.79 119.74 129.33 1sap s LYS 5 Ca 0.24 1.54 0.00 0.00 0.02 0.00 0.00 55.97 57.77 1sap s LYS 5 Cb -0.15 -3.33 0.00 0.00 -0.52 0.00 0.00 37.83 33.83 1sap s LYS 5 CO 0.18 0.22 0.00 1.97 -0.92 0.00 0.00 175.35 176.80 1sap n PHE 6 N 2.44 0.00 -3.81 3.18 -1.74 0.98 -4.98 117.46 113.54 1sap n PHE 6 Ca 0.02 0.00 -0.13 0.00 -0.56 0.00 0.00 57.45 56.77 1sap n PHE 6 Cb 0.48 0.00 -0.14 0.00 1.52 0.00 0.00 39.48 41.33 1sap n PHE 6 CO 0.00 0.00 0.00 -1.59 -0.56 0.00 0.00 176.76 174.61 1sap s LYS 7 N 2.15 0.03 0.12 3.97 -2.85 -1.26 -0.85 119.74 121.05 1sap s LYS 7 Ca 0.00 0.16 -0.26 0.00 -1.00 0.00 0.00 55.97 54.87 1sap s LYS 7 Cb 0.00 -0.10 0.07 0.00 -2.06 0.00 0.00 37.83 35.75 1sap s LYS 7 CO 0.00 -0.09 1.00 -0.47 0.10 0.00 0.00 175.35 175.89 1sap s TYR 8 N 0.56 -0.13 -0.59 1.78 5.04 -0.51 -4.79 117.35 118.71 1sap s TYR 8 Ca -0.04 -0.13 0.00 0.00 -2.44 0.00 0.00 57.07 54.45 1sap s TYR 8 Cb -0.06 0.62 0.00 0.00 0.35 0.00 0.00 41.96 42.87 1sap s TYR 8 CO -0.02 -0.73 0.00 0.36 -1.34 0.00 0.00 175.55 173.82 1sap n LYS 9 N -0.45 -2.53 -2.73 4.97 -0.00 -1.26 -0.58 118.16 115.58 1sap n LYS 9 Ca -0.06 0.33 -0.19 0.00 -0.00 0.00 0.00 58.31 58.39 1sap n LYS 9 Cb 0.61 -4.87 0.02 0.00 -0.00 0.00 0.00 35.03 30.78 1sap n LYS 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1sap n GLY 10 N -0.65 -0.35 3.28 2.58 0.00 -1.26 -5.00 105.19 103.79 1sap n GLY 10 Ca -0.08 -0.05 -0.12 0.00 0.00 0.00 0.00 46.02 45.77 1sap n GLY 10 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1sap n GLU 11 N -3.28 0.79 -2.32 1.61 2.13 0.25 -5.15 120.64 114.66 1sap n GLU 11 Ca -0.13 -2.48 -0.36 0.00 0.66 0.00 0.00 57.16 54.85 1sap n GLU 11 Cb 0.62 2.56 -0.01 0.00 0.27 0.00 0.00 31.44 34.88 1sap n GLU 11 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 1sap s GLU 12 N -2.55 3.66 -0.00 5.31 -6.30 -1.26 -1.43 118.70 116.12 1sap s GLU 12 Ca 0.24 1.64 0.00 0.00 -2.50 0.00 0.00 54.97 54.34 1sap s GLU 12 Cb -0.02 -2.23 0.01 0.00 0.00 0.00 0.00 34.13 31.88 1sap s GLU 12 CO 0.17 -0.60 0.00 0.21 0.02 0.00 0.00 175.26 175.06 1sap s LYS 13 N -2.96 0.04 -0.12 4.30 2.36 -0.03 -4.72 119.74 118.61 1sap s LYS 13 Ca 0.67 0.02 0.02 0.00 -2.55 0.00 0.00 55.97 54.13 1sap s LYS 13 Cb -0.25 -0.09 -0.00 0.00 -1.05 0.00 0.00 37.83 36.44 1sap s LYS 13 CO 0.29 -0.02 -0.20 -1.21 1.55 0.00 0.00 175.35 175.76 1sap s GLU 14 N 0.20 3.13 -0.03 4.03 2.02 -1.26 -0.01 118.70 126.78 1sap s GLU 14 Ca -0.02 -0.82 0.04 0.00 0.02 0.00 0.00 54.97 54.20 1sap s GLU 14 Cb -0.03 -2.45 -0.00 0.00 0.10 0.00 0.00 34.13 31.75 1sap s GLU 14 CO -0.01 0.11 -0.15 0.08 0.02 0.00 0.00 175.26 175.32 1sap s VAL 15 N 0.53 1.22 0.26 2.63 1.01 0.02 -4.90 120.40 121.17 1sap s VAL 15 Ca -0.12 -0.61 -0.10 0.00 0.00 0.00 0.00 61.98 61.14 1sap s VAL 15 Cb -0.17 -1.05 -0.07 0.00 0.00 0.00 0.00 36.38 35.09 1sap s VAL 15 CO 0.04 0.36 0.59 -0.62 0.00 0.00 0.00 175.10 175.47 1sap s ASP 16 N 0.01 6.62 0.38 3.32 2.15 -1.26 -0.32 116.67 127.57 1sap s ASP 16 Ca -0.02 0.96 0.17 0.00 0.43 0.00 0.00 52.55 54.09 1sap s ASP 16 Cb -0.10 -2.24 1.07 0.00 -0.30 0.00 0.00 42.92 41.35 1sap s ASP 16 CO 0.01 -0.12 1.76 0.71 -0.17 0.00 0.00 175.17 177.36 1sap h THR 17 N 1.89 0.51 -1.15 1.71 1.35 -1.96 0.39 112.91 115.65 1sap h THR 17 Ca -0.47 -0.14 0.33 0.00 -0.55 0.00 0.00 66.41 65.57 1sap h THR 17 Cb 1.17 0.05 -0.06 0.00 -1.73 0.00 0.00 68.15 67.58 1sap h THR 17 CO 0.68 0.08 0.80 0.77 -0.25 0.00 0.00 175.52 177.60 1sap h SER 18 N 0.42 0.14 0.16 5.36 4.64 -2.02 -0.48 113.55 121.77 1sap h SER 18 Ca 0.62 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.97 1sap h SER 18 Cb 1.49 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.59 1sap h SER 18 CO -0.34 0.02 -0.89 0.29 -0.87 0.00 0.00 176.83 175.03 1sap n LYS 19 N -4.33 0.03 -2.63 4.77 5.02 0.13 -4.99 118.16 116.15 1sap n LYS 19 Ca 0.26 -0.01 -0.41 0.00 -2.02 0.00 0.00 58.31 56.13 1sap n LYS 19 Cb 1.15 -1.51 -0.04 0.00 -0.02 0.00 0.00 35.03 34.62 1sap n LYS 19 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1sap s ILE 20 N -3.02 4.30 -0.20 -0.18 1.01 -0.19 0.27 121.20 123.18 1sap s ILE 20 Ca 0.08 1.88 0.01 0.00 0.00 0.00 0.00 60.65 62.62 1sap s ILE 20 Cb 0.16 -4.20 -0.13 0.00 0.01 0.00 0.00 42.46 38.30 1sap s ILE 20 CO 0.82 0.27 -0.19 1.17 0.00 0.00 0.00 174.94 177.02 1sap n LYS 21 N 2.85 0.50 -3.51 2.79 3.00 0.07 -4.90 118.16 118.97 1sap n LYS 21 Ca 0.03 0.12 -0.15 0.00 -0.00 0.00 0.00 58.31 58.32 1sap n LYS 21 Cb 0.48 -1.39 -0.05 0.00 0.00 0.00 0.00 35.03 34.07 1sap n LYS 21 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1sap s LYS 22 N -2.40 1.01 -0.02 1.64 2.36 -0.56 -4.94 119.74 116.83 1sap s LYS 22 Ca -0.27 0.07 -0.02 0.00 -2.55 0.00 0.00 55.97 53.20 1sap s LYS 22 Cb 0.07 0.47 0.00 0.00 -1.05 0.00 0.00 37.83 37.33 1sap s LYS 22 CO 0.46 -0.35 0.05 0.54 1.55 0.00 0.00 175.35 177.60 1sap s VAL 23 N -1.77 0.01 0.31 4.02 0.11 -1.26 -0.86 120.40 120.95 1sap s VAL 23 Ca -0.06 -0.05 -0.16 0.00 -2.93 0.00 0.00 61.98 58.78 1sap s VAL 23 Cb -0.00 -0.10 0.02 0.00 -1.53 0.00 0.00 36.38 34.77 1sap s VAL 23 CO 0.03 -0.02 0.66 -1.66 -3.33 0.00 0.00 175.10 170.78 1sap s TRP 24 N -0.05 0.14 -0.37 1.54 -2.14 0.38 -4.94 118.94 113.50 1sap s TRP 24 Ca -0.01 -0.62 -0.19 0.00 2.66 0.00 0.00 56.10 57.95 1sap s TRP 24 Cb -0.01 0.55 0.00 0.00 -3.10 0.00 0.00 33.47 30.91 1sap s TRP 24 CO 0.00 -1.26 0.54 1.03 -2.66 0.00 0.00 176.95 174.60 1sap s ARG 25 N -3.42 3.53 -1.32 3.25 1.81 -1.26 -0.85 118.95 120.69 1sap s ARG 25 Ca 0.17 -0.22 -0.16 0.00 -1.72 0.00 0.00 55.73 53.79 1sap s ARG 25 Cb -0.04 -3.84 0.02 0.00 -0.45 0.00 0.00 34.95 30.63 1sap s ARG 25 CO 0.10 -0.73 2.05 1.55 -0.68 0.00 0.00 175.30 177.59 1sap n VAL 26 N 5.52 3.30 0.00 3.52 3.14 0.67 -4.85 118.33 129.63 1sap n VAL 26 Ca -0.04 -3.07 0.00 0.00 -2.96 0.00 0.00 64.34 58.27 1sap n VAL 26 Cb 0.49 -2.48 0.00 0.00 -1.06 0.00 0.00 33.84 30.78 1sap n VAL 26 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1sap n GLY 27 N 4.58 0.44 0.13 7.55 0.00 -1.26 -1.88 105.19 114.75 1sap n GLY 27 Ca 0.51 0.62 -0.21 0.00 0.00 0.00 0.00 46.02 46.93 1sap n GLY 27 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sap h LYS 28 N 0.00 0.42 -6.17 1.61 1.57 -2.01 -3.48 116.57 108.51 1sap h LYS 28 Ca 0.00 -0.65 -0.61 0.00 -1.87 0.00 0.00 60.65 57.52 1sap h LYS 28 Cb 0.00 0.23 -0.08 0.00 0.08 0.00 0.00 32.23 32.46 1sap h LYS 28 CO 0.00 1.29 -0.58 -1.64 -0.57 0.00 0.00 179.45 177.96 1sap s MET 29 N -2.65 2.93 -0.14 3.15 -1.94 -0.79 -4.82 119.30 115.05 1sap s MET 29 Ca -0.12 -0.74 -0.29 0.00 -1.71 0.00 0.00 55.69 52.83 1sap s MET 29 Cb 0.03 -2.72 -0.01 0.00 2.01 0.00 0.00 34.83 34.14 1sap s MET 29 CO 0.87 0.54 1.09 0.08 -0.01 0.00 0.00 175.02 177.59 1sap s VAL 30 N -1.54 4.58 -0.06 -6.03 1.01 -0.17 -0.24 120.40 117.95 1sap s VAL 30 Ca 0.30 1.88 0.06 0.00 0.00 0.00 0.00 61.98 64.22 1sap s VAL 30 Cb -0.11 -4.21 -0.01 0.00 0.00 0.00 0.00 36.38 32.04 1sap s VAL 30 CO 0.23 -0.07 -0.24 -0.94 0.00 0.00 0.00 175.10 174.08 1sap s SER 31 N 1.32 3.18 0.12 3.32 1.04 -0.03 -1.20 113.70 121.45 1sap s SER 31 Ca 0.49 -0.49 0.01 0.00 0.48 0.00 0.00 55.95 56.45 1sap s SER 31 Cb -0.19 -0.91 -0.04 0.00 0.10 0.00 0.00 66.02 64.98 1sap s SER 31 CO 0.15 0.24 -0.03 0.72 0.98 0.00 0.00 173.24 175.30 1sap s PHE 32 N -0.15 0.95 -0.08 5.02 -0.71 0.20 -0.47 117.98 122.74 1sap s PHE 32 Ca -0.04 -0.99 0.00 0.00 -1.04 0.00 0.00 56.93 54.86 1sap s PHE 32 Cb -0.14 -0.55 -0.03 0.00 -1.21 0.00 0.00 43.02 41.09 1sap s PHE 32 CO 0.04 -0.22 -0.07 0.95 -1.34 0.00 0.00 175.22 174.57 1sap s THR 33 N -3.70 3.67 0.22 -4.49 -4.23 -0.04 -0.88 115.64 106.19 1sap s THR 33 Ca 0.16 -0.48 0.04 0.00 -1.18 0.00 0.00 61.69 60.23 1sap s THR 33 Cb 0.06 -2.52 -0.05 0.00 1.34 0.00 0.00 72.50 71.33 1sap s THR 33 CO -0.02 0.58 -0.01 -0.72 -0.54 0.00 0.00 174.62 173.91 1sap s TYR 34 N -0.57 1.51 0.07 3.99 -0.85 -0.42 -0.75 117.35 120.34 1sap s TYR 34 Ca 0.08 -0.91 0.03 0.00 -0.52 0.00 0.00 57.07 55.75 1sap s TYR 34 Cb -0.12 -0.86 -0.04 0.00 0.38 0.00 0.00 41.96 41.32 1sap s TYR 34 CO 0.02 -0.04 0.09 0.34 -1.52 0.00 0.00 175.55 174.44 1sap s ASP 35 N -3.28 5.60 -0.25 -0.18 -1.08 0.14 -1.36 116.67 116.25 1sap s ASP 35 Ca 0.27 0.02 -0.01 0.00 -0.52 0.00 0.00 52.55 52.31 1sap s ASP 35 Cb 0.05 -1.53 0.08 0.00 -1.46 0.00 0.00 42.92 40.06 1sap s ASP 35 CO 0.08 0.18 0.04 -0.62 0.52 0.00 0.00 175.17 175.36 1sap s ASP 36 N -2.36 3.58 -1.73 -0.34 2.15 0.56 -4.85 116.67 113.67 1sap s ASP 36 Ca 0.29 -1.24 -0.18 0.00 0.43 0.00 0.00 52.55 51.85 1sap s ASP 36 Cb -0.12 -0.84 0.17 0.00 -0.30 0.00 0.00 42.92 41.82 1sap s ASP 36 CO 0.22 -0.33 0.69 -0.46 -0.17 0.00 0.00 175.17 175.12 1sap n ASN 37 N 4.88 -2.63 0.00 -0.34 6.94 -1.26 -1.72 115.26 121.13 1sap n ASN 37 Ca -0.07 -1.08 0.00 0.00 -0.02 0.00 0.00 54.58 53.41 1sap n ASN 37 Cb 0.44 -2.43 0.00 0.00 -2.36 0.00 0.00 39.78 35.43 1sap n ASN 37 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1sap n GLY 38 N -1.38 2.00 3.88 4.83 0.00 -1.26 -5.07 105.19 108.18 1sap n GLY 38 Ca 0.05 -0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 1sap n GLY 38 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sap s LYS 39 N 0.00 3.76 0.00 1.61 -2.85 -0.70 -5.09 119.74 116.47 1sap s LYS 39 Ca 0.00 0.44 0.00 0.00 -1.00 0.00 0.00 55.97 55.41 1sap s LYS 39 Cb 0.00 -2.40 0.00 0.00 -2.06 0.00 0.00 37.83 33.37 1sap s LYS 39 CO 0.00 -0.04 0.00 2.41 0.10 0.00 0.00 175.35 177.82 1sap n THR 40 N -1.35 0.00 0.00 3.79 -1.04 -1.26 -0.33 114.28 114.09 1sap n THR 40 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1sap n THR 40 Cb 0.54 -1.93 0.00 0.00 -1.82 0.00 0.00 70.33 67.12 1sap n THR 40 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1sap n GLY 41 N 5.00 1.67 3.35 3.41 0.00 -0.46 -4.46 105.19 113.69 1sap n GLY 41 Ca 0.00 -0.71 -0.33 0.00 0.00 0.00 0.00 46.02 44.98 1sap n GLY 41 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1sap s ARG 42 N -2.00 3.07 0.29 1.61 3.52 -1.26 -1.30 118.95 122.89 1sap s ARG 42 Ca 0.00 -0.75 0.09 0.00 -0.13 0.00 0.00 55.73 54.94 1sap s ARG 42 Cb 0.00 -2.47 -0.06 0.00 -1.56 0.00 0.00 34.95 30.86 1sap s ARG 42 CO 0.00 0.30 -0.12 0.20 -0.81 0.00 0.00 175.30 174.87 1sap s GLY 43 N 0.10 1.93 0.03 8.12 0.00 -0.06 -4.93 107.32 112.51 1sap s GLY 43 Ca -0.08 -1.94 -0.27 0.00 0.00 0.00 0.00 44.72 42.43 1sap s GLY 43 CO 0.05 -1.93 0.79 0.00 0.00 0.00 0.00 173.10 172.01 1sap s ALA 44 N -2.74 -1.76 0.12 3.20 0.00 -1.26 -0.63 121.76 118.70 1sap s ALA 44 Ca 0.30 0.94 -0.13 0.00 0.00 0.00 0.00 51.96 53.08 1sap s ALA 44 Cb 0.01 0.40 0.02 0.00 0.00 0.00 0.00 23.12 23.55 1sap s ALA 44 CO 0.14 -0.64 0.32 0.08 0.00 0.00 0.00 175.76 175.65 1sap s VAL 45 N -2.91 0.09 -0.12 0.00 1.01 -0.34 -4.72 120.40 113.41 1sap s VAL 45 Ca 0.01 -0.91 -0.09 0.00 0.00 0.00 0.00 61.98 61.00 1sap s VAL 45 Cb -0.01 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 1sap s VAL 45 CO -0.07 -0.43 0.17 -0.44 0.00 0.00 0.00 175.10 174.33 1sap s SER 46 N -2.85 6.41 0.28 3.32 0.01 -1.26 -1.00 113.70 118.60 1sap s SER 46 Ca 0.06 0.49 -0.05 0.00 1.31 0.00 0.00 55.95 57.76 1sap s SER 46 Cb 0.03 -2.10 0.53 0.00 0.21 0.00 0.00 66.02 64.69 1sap s SER 46 CO -0.10 0.35 1.49 -0.62 0.41 0.00 0.00 173.24 174.78 1sap n GLU 47 N 2.26 -0.08 -0.11 12.44 4.71 -1.26 -0.82 120.64 137.78 1sap n GLU 47 Ca -0.18 1.47 0.26 0.00 -0.01 0.00 0.00 57.16 58.70 1sap n GLU 47 Cb 0.54 -2.24 0.72 0.00 -1.01 0.00 0.00 31.44 29.45 1sap n GLU 47 CO 0.00 0.00 0.00 1.57 0.09 0.00 0.00 177.13 178.79 1sap h LYS 48 N 0.00 0.00 0.00 3.49 2.10 -2.00 -0.65 116.57 119.51 1sap h LYS 48 Ca 0.49 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 59.09 1sap h LYS 48 Cb 0.84 0.00 -0.11 0.00 -0.90 0.00 0.00 32.23 32.06 1sap h LYS 48 CO -0.96 0.00 -0.63 -0.40 -2.00 0.00 0.00 179.45 175.46 1sap n ASP 49 N -4.13 1.50 -4.25 7.07 5.75 0.00 -4.97 116.55 117.51 1sap n ASP 49 Ca 0.15 -3.26 -0.43 0.00 -0.01 0.00 0.00 54.79 51.24 1sap n ASP 49 Cb 0.87 -0.45 -0.06 0.00 -1.03 0.00 0.00 41.12 40.46 1sap n ASP 49 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1sap s ALA 50 N -2.20 3.73 0.74 2.12 0.00 -0.25 -4.84 121.76 121.07 1sap s ALA 50 Ca 0.35 -2.96 -0.15 0.00 0.00 0.00 0.00 51.96 49.20 1sap s ALA 50 Cb 0.36 -3.13 0.03 0.00 0.00 0.00 0.00 23.12 20.37 1sap s ALA 50 CO -0.09 -2.10 1.05 -0.35 0.00 0.00 0.00 175.76 174.27 1sap n PRO 51 N 4.37 0.46 -0.27 0.00 -0.04 -1.26 -4.61 135.00 133.64 1sap n PRO 51 Ca 0.02 0.22 -0.01 0.00 -0.04 0.00 0.00 63.50 63.68 1sap n PRO 51 Cb 0.42 -2.30 0.05 0.00 -0.04 0.00 0.00 33.50 31.63 1sap n PRO 51 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1sap h LYS 52 N -0.38 -0.06 -0.84 0.54 3.64 -1.98 -1.72 116.57 115.76 1sap h LYS 52 Ca -0.47 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 1sap h LYS 52 Cb 1.32 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 33.12 1sap h LYS 52 CO 0.47 -0.04 0.54 1.49 -2.27 0.00 0.00 179.45 179.64 1sap h GLU 53 N -0.07 1.12 -0.52 1.90 4.22 -1.92 0.42 114.58 119.74 1sap h GLU 53 Ca 0.32 -0.08 -0.01 0.00 0.08 0.00 0.00 59.36 59.67 1sap h GLU 53 Cb 0.58 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1sap h GLU 53 CO -0.81 0.75 0.29 1.25 -2.18 0.00 0.00 179.01 178.32 1sap h LEU 54 N 1.15 0.64 -0.22 1.64 5.85 -1.61 -1.21 115.31 121.55 1sap h LEU 54 Ca 0.31 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.96 1sap h LEU 54 Cb -0.11 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.74 1sap h LEU 54 CO -0.06 0.54 0.10 -0.07 -0.34 0.00 0.00 178.44 178.61 1sap h LEU 55 N 0.69 0.14 -0.47 2.25 3.38 -0.97 -1.55 115.31 118.78 1sap h LEU 55 Ca 0.18 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.24 1sap h LEU 55 Cb 0.04 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 1sap h LEU 55 CO -0.03 0.11 0.12 -0.78 0.09 0.00 0.00 178.44 177.95 1sap h ASP 56 N 0.21 0.07 0.24 -0.43 3.58 0.93 1.50 116.42 122.53 1sap h ASP 56 Ca 0.09 0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.60 1sap h ASP 56 Cb 0.04 0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.17 1sap h ASP 56 CO -0.07 0.07 -0.12 0.24 -2.88 0.00 0.00 179.24 176.48 1sap h MET 57 N 0.27 -0.31 0.00 0.28 2.86 -1.22 -1.92 114.93 114.88 1sap h MET 57 Ca 0.23 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 1sap h MET 57 Cb 0.27 0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.00 1sap h MET 57 CO -0.27 -0.08 0.00 1.25 1.06 0.00 0.00 176.91 178.86 1sap h LEU 58 N -0.50 0.00 0.04 1.22 7.12 -0.42 -3.28 115.31 119.50 1sap h LEU 58 Ca -0.03 0.00 -0.07 0.00 0.13 0.00 0.00 57.88 57.91 1sap h LEU 58 Cb 0.37 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 40.51 1sap h LEU 58 CO 0.05 0.00 -0.29 0.00 -0.13 0.00 0.00 178.44 178.07 1sap h ALA 59 N 2.00 -0.03 -0.53 1.25 0.00 0.29 0.25 119.26 122.49 1sap h ALA 59 Ca 0.00 -0.56 0.07 0.00 0.00 0.00 0.00 54.91 54.43 1sap h ALA 59 Cb 0.03 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 1sap h ALA 59 CO 0.00 0.13 0.21 0.07 0.00 0.00 0.00 179.25 179.65 1sap h ARG 60 N -0.73 0.38 0.44 0.00 0.11 -1.58 0.77 114.38 113.77 1sap h ARG 60 Ca -0.05 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 60.00 1sap h ARG 60 Cb 1.20 -0.09 -0.02 0.00 1.11 0.00 0.00 29.97 32.18 1sap h ARG 60 CO 0.05 0.25 -0.38 0.00 0.10 0.00 0.00 179.97 180.00 1sap h ALA 61 N 1.35 -0.86 -0.19 0.08 0.00 -1.58 -0.34 119.26 117.72 1sap h ALA 61 Ca 0.26 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1sap h ALA 61 Cb 0.27 0.53 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1sap h ALA 61 CO -0.25 -1.02 0.10 1.49 0.00 0.00 0.00 179.25 179.57 1sap h GLU 62 N -0.82 0.27 -0.19 0.00 4.81 -0.29 -0.30 114.58 118.06 1sap h GLU 62 Ca -0.04 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1sap h GLU 62 Cb 0.72 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 1sap h GLU 62 CO -0.03 0.28 0.12 0.00 -0.73 0.00 0.00 179.01 178.65 1sap h ARG 63 N 0.18 0.25 -0.23 1.92 3.08 -0.83 0.18 114.38 118.93 1sap h ARG 63 Ca 0.06 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.14 1sap h ARG 63 Cb 0.10 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.05 1sap h ARG 63 CO -0.01 0.18 -0.07 1.49 -1.07 0.00 0.00 179.97 180.49 1sap h GLU 64 N 0.25 -0.03 -0.23 0.04 4.81 -0.83 -2.68 114.58 115.91 1sap h GLU 64 Ca 0.07 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1sap h GLU 64 Cb -0.01 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1sap h GLU 64 CO -0.01 -0.02 0.11 0.87 -0.73 0.00 0.00 179.01 179.23 1sap h LYS 65 N -0.03 0.33 -0.02 1.92 1.57 -0.82 -3.51 116.57 116.01 1sap h LYS 65 Ca 0.11 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1sap h LYS 65 Cb 0.20 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1sap h LYS 65 CO -0.25 0.33 0.00 1.63 -0.57 0.00 0.00 179.45 180.59