#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wfw s SER 2 N 0.00 4.46 -0.72 1.61 0.01 -1.26 -5.05 113.70 112.74 1wfw s SER 2 Ca 0.00 -0.38 -0.02 0.00 1.31 0.00 0.00 55.95 56.86 1wfw s SER 2 Cb 0.00 -1.77 0.18 0.00 0.21 0.00 0.00 66.02 64.64 1wfw s SER 2 CO 0.00 -0.03 0.55 -0.44 0.41 0.00 0.00 173.24 173.73 1wfw s SER 3 N 1.50 5.45 -0.13 2.44 0.01 -1.26 -4.83 113.70 116.89 1wfw s SER 3 Ca 0.06 -3.20 -0.04 0.00 1.31 0.00 0.00 55.95 54.07 1wfw s SER 3 Cb -0.14 -1.86 0.01 0.00 0.21 0.00 0.00 66.02 64.23 1wfw s SER 3 CO -0.02 -0.29 0.16 0.61 0.41 0.00 0.00 173.24 174.11 1wfw n GLY 4 N 3.01 -1.29 3.62 3.44 0.00 -1.26 -5.02 105.19 107.70 1wfw n GLY 4 Ca 0.13 0.27 -0.38 0.00 0.00 0.00 0.00 46.02 46.03 1wfw n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wfw s SER 5 N -1.34 6.21 -0.01 1.61 1.04 -1.26 -5.07 113.70 114.87 1wfw s SER 5 Ca 0.07 0.23 0.05 0.00 0.48 0.00 0.00 55.95 56.78 1wfw s SER 5 Cb -0.02 -2.17 -0.01 0.00 0.10 0.00 0.00 66.02 63.91 1wfw s SER 5 CO 0.24 -0.09 -0.17 -0.94 0.98 0.00 0.00 173.24 173.26 1wfw s SER 6 N 1.47 2.05 0.13 7.02 1.04 -1.26 -5.13 113.70 119.02 1wfw s SER 6 Ca 0.12 -0.32 -0.24 0.00 0.48 0.00 0.00 55.95 56.00 1wfw s SER 6 Cb -0.15 -0.24 0.08 0.00 0.10 0.00 0.00 66.02 65.81 1wfw s SER 6 CO 0.09 0.21 1.10 -0.83 0.98 0.00 0.00 173.24 174.79 1wfw s GLY 7 N -0.40 0.01 -0.10 7.32 0.00 -1.26 -5.06 107.32 107.83 1wfw s GLY 7 Ca 0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 44.72 44.60 1wfw s GLY 7 CO -0.01 2.84 -0.05 -0.56 0.00 0.00 0.00 173.10 175.33 1wfw s SER 8 N -3.44 4.80 -0.25 1.64 0.01 -1.26 -5.00 113.70 110.20 1wfw s SER 8 Ca 0.22 -0.03 -0.13 0.00 1.31 0.00 0.00 55.95 57.32 1wfw s SER 8 Cb -0.02 -1.45 -0.04 0.00 0.21 0.00 0.00 66.02 64.72 1wfw s SER 8 CO 0.03 0.29 0.28 -0.89 0.41 0.00 0.00 173.24 173.37 1wfw s THR 9 N -0.40 5.25 0.08 1.44 2.01 -1.26 -1.00 115.64 121.76 1wfw s THR 9 Ca 0.06 0.41 0.10 0.00 0.31 0.00 0.00 61.69 62.56 1wfw s THR 9 Cb -0.12 -3.62 -0.03 0.00 0.01 0.00 0.00 72.50 68.74 1wfw s THR 9 CO 0.02 0.24 -0.25 -0.04 -0.69 0.00 0.00 174.62 173.90 1wfw s MET 10 N 1.64 1.70 -0.11 4.92 1.00 -0.93 -3.11 119.30 124.40 1wfw s MET 10 Ca 0.12 -1.18 -0.00 0.00 0.00 0.00 0.00 55.69 54.63 1wfw s MET 10 Cb -0.15 -1.98 -0.02 0.00 0.00 0.00 0.00 34.83 32.67 1wfw s MET 10 CO 0.09 0.49 -0.09 0.99 0.00 0.00 0.00 175.02 176.50 1wfw s THR 11 N -0.92 3.42 0.14 2.05 2.01 -0.87 -1.52 115.64 119.95 1wfw s THR 11 Ca 0.13 -0.55 -0.31 0.00 0.31 0.00 0.00 61.69 61.27 1wfw s THR 11 Cb -0.10 -2.43 -0.10 0.00 0.01 0.00 0.00 72.50 69.88 1wfw s THR 11 CO 0.04 0.54 1.71 -0.69 -0.69 0.00 0.00 174.62 175.53 1wfw s VAL 12 N -0.07 2.57 -0.30 3.82 1.01 0.50 -2.78 120.40 125.16 1wfw s VAL 12 Ca -0.01 0.23 0.21 0.00 0.00 0.00 0.00 61.98 62.41 1wfw s VAL 12 Cb -0.14 -3.15 -0.30 0.00 0.00 0.00 0.00 36.38 32.80 1wfw s VAL 12 CO 0.03 0.01 0.58 2.30 0.00 0.00 0.00 175.10 178.02 1wfw n ILE 13 N 4.43 0.00 -3.80 2.22 -5.35 0.11 -0.27 119.36 116.70 1wfw n ILE 13 Ca 0.16 -0.35 -0.12 0.00 -0.27 0.00 0.00 62.75 62.17 1wfw n ILE 13 Cb 0.38 0.30 -0.09 0.00 -1.74 0.00 0.00 39.64 38.49 1wfw n ILE 13 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1wfw s LYS 14 N -3.31 0.63 0.48 6.28 1.02 -1.26 -4.75 119.74 118.83 1wfw s LYS 14 Ca -0.03 -0.30 -0.23 0.00 0.02 0.00 0.00 55.97 55.43 1wfw s LYS 14 Cb 0.14 0.27 -0.07 0.00 -0.52 0.00 0.00 37.83 37.66 1wfw s LYS 14 CO 0.87 -0.17 1.24 0.34 -0.92 0.00 0.00 175.35 176.71 1wfw s ASP 15 N -1.44 5.87 0.09 2.83 2.15 -1.26 -4.10 116.67 120.81 1wfw s ASP 15 Ca -0.13 2.50 -0.02 0.00 0.43 0.00 0.00 52.55 55.32 1wfw s ASP 15 Cb -0.05 -2.62 -0.03 0.00 -0.30 0.00 0.00 42.92 39.91 1wfw s ASP 15 CO 0.03 -1.14 0.05 -0.47 -0.17 0.00 0.00 175.17 173.46 1wfw s TYR 16 N -1.44 0.61 -0.06 -5.34 5.04 0.27 -4.94 117.35 111.50 1wfw s TYR 16 Ca 0.66 -1.07 0.04 0.00 -2.44 0.00 0.00 57.07 54.26 1wfw s TYR 16 Cb -0.33 -0.37 -0.00 0.00 0.35 0.00 0.00 41.96 41.60 1wfw s TYR 16 CO 0.40 -0.47 -0.19 0.71 -1.34 0.00 0.00 175.55 174.66 1wfw s TYR 17 N -3.97 1.91 -0.51 4.97 2.02 -1.26 -2.94 117.35 117.57 1wfw s TYR 17 Ca 0.14 -0.62 -0.28 0.00 -0.37 0.00 0.00 57.07 55.95 1wfw s TYR 17 Cb 0.07 -1.29 -0.01 0.00 -0.40 0.00 0.00 41.96 40.33 1wfw s TYR 17 CO -0.05 -0.23 1.67 0.00 -1.57 0.00 0.00 175.55 175.37 1wfw s ALA 18 N 0.15 2.62 0.08 3.71 0.00 -1.26 -4.84 121.76 122.23 1wfw s ALA 18 Ca -0.08 -0.38 0.03 0.00 0.00 0.00 0.00 51.96 51.53 1wfw s ALA 18 Cb -0.14 -4.14 -0.24 0.00 0.00 0.00 0.00 23.12 18.61 1wfw s ALA 18 CO 0.04 -3.15 1.15 -0.07 0.00 0.00 0.00 175.76 173.73 1wfw h LEU 19 N 14.35 0.15 -9.43 0.00 -0.00 -1.93 -3.46 115.31 115.00 1wfw h LEU 19 Ca -0.28 -0.18 -0.66 0.00 -0.00 0.00 0.00 57.88 56.76 1wfw h LEU 19 Cb 1.14 -0.05 -0.12 0.00 -0.00 0.00 0.00 40.66 41.62 1wfw h LEU 19 CO 1.15 1.14 -0.62 -0.54 -0.00 0.00 0.00 178.44 179.57 1wfw s LYS 20 N -2.68 2.90 0.31 1.13 -0.14 -1.26 -5.00 119.74 115.00 1wfw s LYS 20 Ca -0.02 -0.55 0.06 0.00 -1.36 0.00 0.00 55.97 54.10 1wfw s LYS 20 Cb 0.09 -2.75 0.86 0.00 -1.68 0.00 0.00 37.83 34.35 1wfw s LYS 20 CO 0.84 0.64 1.63 0.93 -0.76 0.00 0.00 175.35 178.63 1wfw h GLU 21 N 4.32 0.16 -0.15 1.68 5.08 -2.03 0.23 114.58 123.86 1wfw h GLU 21 Ca -0.49 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 57.84 1wfw h GLU 21 Cb 1.18 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 1wfw h GLU 21 CO 0.59 0.10 0.03 -0.97 -1.00 0.00 0.00 179.01 177.76 1wfw h ASN 22 N 0.16 0.24 -3.34 1.42 -0.73 -1.94 -3.44 115.58 107.94 1wfw h ASN 22 Ca 0.63 -0.25 -0.54 0.00 1.87 0.00 0.00 56.30 58.01 1wfw h ASN 22 Cb 1.37 -0.06 0.21 0.00 0.27 0.00 0.00 38.32 40.10 1wfw h ASN 22 CO -0.72 0.43 -0.57 -0.62 -0.37 0.00 0.00 177.43 175.58 1wfw n GLU 23 N -4.80 -0.17 -4.13 6.67 1.02 0.81 -4.07 120.64 115.97 1wfw n GLU 23 Ca -0.05 -0.01 -0.15 0.00 -0.02 0.00 0.00 57.16 56.93 1wfw n GLU 23 Cb 0.18 -1.83 -0.11 0.00 -0.02 0.00 0.00 31.44 29.65 1wfw n GLU 23 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1wfw s ILE 24 N -2.30 0.84 0.30 -3.67 -4.36 -1.25 -4.78 121.20 105.99 1wfw s ILE 24 Ca 0.58 -1.28 -0.28 0.00 -0.26 0.00 0.00 60.65 59.41 1wfw s ILE 24 Cb -0.23 -0.94 -0.09 0.00 1.25 0.00 0.00 42.46 42.44 1wfw s ILE 24 CO 0.66 -0.36 1.00 0.00 0.24 0.00 0.00 174.94 176.48 1wfw s VAL 26 N -1.40 0.09 0.15 0.00 -7.23 -1.15 -4.98 120.40 105.89 1wfw s VAL 26 Ca 0.48 -0.75 0.09 0.00 -1.81 0.00 0.00 61.98 60.00 1wfw s VAL 26 Cb -0.24 -0.83 -0.04 0.00 0.56 0.00 0.00 36.38 35.82 1wfw s VAL 26 CO 0.31 -0.41 -0.21 -0.55 -0.31 0.00 0.00 175.10 173.93 1wfw s SER 27 N -1.90 2.87 -0.28 4.85 0.15 -1.26 -0.56 113.70 117.57 1wfw s SER 27 Ca -0.07 -0.81 -0.40 0.00 0.70 0.00 0.00 55.95 55.37 1wfw s SER 27 Cb -0.02 -0.18 -0.15 0.00 -1.71 0.00 0.00 66.02 63.96 1wfw s SER 27 CO -0.02 0.04 1.79 1.67 1.20 0.00 0.00 173.24 177.93 1wfw n GLN 28 N 0.55 1.20 0.00 5.44 7.27 -1.26 -1.76 117.38 128.82 1wfw n GLN 28 Ca -0.15 0.43 0.00 0.00 0.07 0.00 0.00 57.00 57.35 1wfw n GLN 28 Cb 0.56 -2.15 0.00 0.00 2.41 0.00 0.00 30.24 31.05 1wfw n GLN 28 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1wfw n GLY 29 N 4.42 3.41 3.36 1.69 0.00 0.63 -4.96 105.19 113.74 1wfw n GLY 29 Ca 0.28 -1.04 -0.36 0.00 0.00 0.00 0.00 46.02 44.90 1wfw n GLY 29 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wfw n GLU 30 N 0.00 0.09 -4.58 1.61 -0.58 -0.72 -4.50 120.64 111.96 1wfw n GLU 30 Ca 0.00 0.06 -0.23 0.00 -0.42 0.00 0.00 57.16 56.57 1wfw n GLU 30 Cb 0.00 -1.62 -0.16 0.00 -0.57 0.00 0.00 31.44 29.09 1wfw n GLU 30 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1wfw s VAL 31 N -2.04 1.07 0.19 2.62 1.01 -1.26 -0.37 120.40 121.62 1wfw s VAL 31 Ca 0.59 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 62.09 1wfw s VAL 31 Cb -0.31 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.12 1wfw s VAL 31 CO 0.65 0.32 0.11 1.33 0.00 0.00 0.00 175.10 177.51 1wfw n VAL 32 N 3.33 0.00 -3.97 2.92 0.24 -0.58 -4.67 118.33 115.60 1wfw n VAL 32 Ca -0.19 -1.23 -0.26 0.00 -2.04 0.00 0.00 64.34 60.62 1wfw n VAL 32 Cb 0.53 0.52 -0.17 0.00 -1.47 0.00 0.00 33.84 33.25 1wfw n VAL 32 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1wfw s GLN 33 N -2.75 1.52 0.33 7.34 1.11 -1.19 -2.18 119.66 123.83 1wfw s GLN 33 Ca 0.15 -0.26 -0.29 0.00 0.01 0.00 0.00 55.36 54.97 1wfw s GLN 33 Cb 0.01 -1.55 -0.10 0.00 -1.01 0.00 0.00 33.01 30.35 1wfw s GLN 33 CO 0.11 -0.24 1.28 0.08 0.01 0.00 0.00 175.29 176.53 1wfw s VAL 34 N 1.61 2.81 0.00 1.09 1.01 -0.17 -1.39 120.40 125.36 1wfw s VAL 34 Ca 0.03 0.81 0.00 0.00 0.00 0.00 0.00 61.98 62.82 1wfw s VAL 34 Cb -0.13 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.74 1wfw s VAL 34 CO -0.07 0.19 0.00 0.18 0.00 0.00 0.00 175.10 175.40 1wfw n LEU 35 N 0.82 1.97 0.00 3.92 4.77 0.28 -4.09 117.00 124.67 1wfw n LEU 35 Ca -0.00 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.99 1wfw n LEU 35 Cb 0.42 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.52 1wfw n LEU 35 CO 0.58 0.33 0.86 0.00 -1.33 0.00 0.00 177.39 177.83 1wfw n ALA 36 N -2.33 -2.82 -2.46 -1.18 0.00 -1.22 -4.98 120.51 105.52 1wfw n ALA 36 Ca 0.00 -0.70 -0.25 0.00 0.00 0.00 0.00 53.44 52.49 1wfw n ALA 36 Cb 0.50 0.20 -0.11 0.00 0.00 0.00 0.00 19.45 20.04 1wfw n ALA 36 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1wfw s VAL 37 N -2.06 2.45 0.30 0.00 1.01 -1.26 0.30 120.40 121.13 1wfw s VAL 37 Ca 0.24 -2.28 0.10 0.00 0.00 0.00 0.00 61.98 60.04 1wfw s VAL 37 Cb -0.01 -2.25 -0.05 0.00 0.00 0.00 0.00 36.38 34.07 1wfw s VAL 37 CO 0.01 -0.30 -0.08 0.21 0.00 0.00 0.00 175.10 174.93 1wfw s ASN 38 N -3.23 4.03 0.64 3.32 2.47 0.19 -4.90 114.94 117.46 1wfw s ASN 38 Ca 0.27 -0.93 0.40 0.00 0.42 0.00 0.00 52.86 53.02 1wfw s ASN 38 Cb -0.06 -0.52 2.23 0.00 -1.45 0.00 0.00 41.25 41.46 1wfw s ASN 38 CO 0.13 -0.06 2.34 1.56 -3.72 0.00 0.00 177.10 177.35 1wfw h GLN 39 N 2.02 0.00 -0.80 0.43 7.50 -2.02 0.02 115.11 122.26 1wfw h GLN 39 Ca -0.42 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.73 1wfw h GLN 39 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.78 1wfw h GLN 39 CO 0.63 0.00 0.00 1.04 -1.50 0.00 0.00 178.83 179.00 1wfw n GLN 40 N -3.34 2.19 -2.69 1.46 6.02 -1.26 -4.84 117.38 114.91 1wfw n GLN 40 Ca -0.03 -1.00 -0.19 0.00 -0.01 0.00 0.00 57.00 55.77 1wfw n GLN 40 Cb 0.07 -1.69 0.02 0.00 1.02 0.00 0.00 30.24 29.66 1wfw n GLN 40 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1wfw n ASN 41 N 0.20 -5.55 -4.76 1.08 3.02 -0.01 -5.00 115.26 104.25 1wfw n ASN 41 Ca 0.09 -0.16 -0.30 0.00 -0.03 0.00 0.00 54.58 54.19 1wfw n ASN 41 Cb 0.52 -4.47 -0.07 0.00 -0.61 0.00 0.00 39.78 35.15 1wfw n ASN 41 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1wfw s MET 42 N -5.30 2.81 -0.27 3.52 -1.94 -1.22 -4.33 119.30 112.57 1wfw s MET 42 Ca 0.16 -0.76 -0.03 0.00 -1.71 0.00 0.00 55.69 53.35 1wfw s MET 42 Cb -0.07 -2.67 0.03 0.00 2.01 0.00 0.00 34.83 34.13 1wfw s MET 42 CO 0.20 0.54 -0.02 0.00 -0.01 0.00 0.00 175.02 175.73 1wfw s LEU 44 N 1.35 3.41 0.07 0.00 2.96 0.15 -1.86 118.68 124.76 1wfw s LEU 44 Ca -0.00 1.01 0.06 0.00 -0.22 0.00 0.00 54.13 54.98 1wfw s LEU 44 Cb -0.17 -2.98 -0.04 0.00 0.50 0.00 0.00 46.19 43.50 1wfw s LEU 44 CO -0.02 -2.20 -0.11 0.68 -1.32 0.00 0.00 176.35 173.37 1wfw s VAL 45 N 8.88 3.29 -0.31 1.68 -7.23 -0.84 0.98 120.40 126.86 1wfw s VAL 45 Ca 0.82 -1.15 -0.11 0.00 -1.81 0.00 0.00 61.98 59.73 1wfw s VAL 45 Cb -0.19 -2.49 -0.02 0.00 0.56 0.00 0.00 36.38 34.25 1wfw s VAL 45 CO 0.28 0.22 0.18 -0.47 -0.31 0.00 0.00 175.10 175.00 1wfw s TYR 46 N -1.11 3.19 -0.47 2.82 6.14 -0.48 -0.62 117.35 126.83 1wfw s TYR 46 Ca 0.19 -0.39 -0.19 0.00 0.64 0.00 0.00 57.07 57.32 1wfw s TYR 46 Cb -0.11 -2.39 0.04 0.00 0.42 0.00 0.00 41.96 39.92 1wfw s TYR 46 CO 0.10 -0.39 0.60 -1.14 0.64 0.00 0.00 175.55 175.35 1wfw s GLN 47 N 1.66 3.17 0.71 4.97 0.74 0.37 -3.18 119.66 128.10 1wfw s GLN 47 Ca 0.05 -0.69 -0.13 0.00 0.05 0.00 0.00 55.36 54.64 1wfw s GLN 47 Cb -0.17 -4.02 0.02 0.00 1.10 0.00 0.00 33.01 29.94 1wfw s GLN 47 CO 0.08 -1.08 1.10 -1.25 -0.55 0.00 0.00 175.29 173.59 1wfw s PRO 48 N 2.60 2.56 -0.15 1.67 0.04 -1.26 -0.24 135.00 140.23 1wfw s PRO 48 Ca 0.17 1.30 -0.30 0.00 0.04 0.00 0.00 61.00 62.21 1wfw s PRO 48 Cb -0.17 -1.93 -0.14 0.00 0.04 0.00 0.00 34.50 32.30 1wfw s PRO 48 CO 0.15 -1.42 0.90 0.00 0.04 0.00 0.00 177.00 176.66 1wfw n ALA 49 N -2.89 -1.96 -2.79 8.56 0.00 -1.26 -4.47 120.51 115.70 1wfw n ALA 49 Ca 0.10 0.39 -0.10 0.00 0.00 0.00 0.00 53.44 53.83 1wfw n ALA 49 Cb 0.52 -1.27 -0.07 0.00 0.00 0.00 0.00 19.45 18.63 1wfw n ALA 49 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1wfw s SER 50 N 0.88 0.01 0.21 0.00 0.01 0.13 -4.82 113.70 110.11 1wfw s SER 50 Ca 0.67 -1.07 -0.10 0.00 1.31 0.00 0.00 55.95 56.76 1wfw s SER 50 Cb -0.95 0.50 0.18 0.00 0.21 0.00 0.00 66.02 65.95 1wfw s SER 50 CO 0.47 -1.01 1.86 0.44 0.41 0.00 0.00 173.24 175.41 1wfw h ASP 51 N 2.41 0.78 -0.53 2.44 5.19 -1.99 -2.55 116.42 122.18 1wfw h ASP 51 Ca -0.30 -0.01 -0.04 0.00 -0.62 0.00 0.00 57.03 56.06 1wfw h ASP 51 Cb 1.25 -0.18 -0.02 0.00 0.18 0.00 0.00 39.33 40.55 1wfw h ASP 51 CO 0.43 0.55 0.18 0.45 -3.12 0.00 0.00 179.24 177.73 1wfw h HIS 52 N 0.93 0.84 -2.04 4.55 3.86 -1.98 -3.46 115.15 117.85 1wfw h HIS 52 Ca 0.28 -0.08 0.01 0.00 -1.16 0.00 0.00 60.37 59.42 1wfw h HIS 52 Cb -0.04 -0.25 -0.19 0.00 1.06 0.00 0.00 27.41 28.00 1wfw h HIS 52 CO -0.03 0.71 0.34 -1.54 0.86 0.00 0.00 177.93 178.27 1wfw s SER 53 N -6.08 -0.52 1.21 2.45 1.04 -0.96 -5.16 113.70 105.67 1wfw s SER 53 Ca -0.13 0.43 -0.17 0.00 0.48 0.00 0.00 55.95 56.56 1wfw s SER 53 Cb 0.12 0.45 0.25 0.00 0.10 0.00 0.00 66.02 66.95 1wfw s SER 53 CO 0.79 -0.58 0.91 -0.81 0.98 0.00 0.00 173.24 174.53 1wfw n PRO 54 N 0.52 -2.78 -1.63 4.02 -0.04 -1.25 0.18 135.00 134.02 1wfw n PRO 54 Ca -0.15 -1.46 -0.54 0.00 -0.04 0.00 0.00 63.50 61.31 1wfw n PRO 54 Cb 0.59 -1.36 -0.07 0.00 -0.04 0.00 0.00 33.50 32.62 1wfw n PRO 54 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wfw n ALA 55 N -4.55 0.33 -3.62 0.55 0.00 -1.26 -4.31 120.51 107.65 1wfw n ALA 55 Ca -0.17 0.26 -0.13 0.00 0.00 0.00 0.00 53.44 53.40 1wfw n ALA 55 Cb 0.49 -2.35 -0.07 0.00 0.00 0.00 0.00 19.45 17.52 1wfw n ALA 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wfw s ALA 56 N 4.60 -1.83 -0.10 0.00 0.00 0.67 -4.86 121.76 120.23 1wfw s ALA 56 Ca 1.01 1.89 -0.13 0.00 0.00 0.00 0.00 51.96 54.73 1wfw s ALA 56 Cb -0.96 -1.08 -0.05 0.00 0.00 0.00 0.00 23.12 21.03 1wfw s ALA 56 CO 0.59 -0.32 0.30 -2.00 0.00 0.00 0.00 175.76 174.34 1wfw s GLU 57 N 0.09 3.98 -0.04 0.00 -6.30 -1.26 -0.48 118.70 114.69 1wfw s GLU 57 Ca -0.01 0.15 -0.13 0.00 -2.50 0.00 0.00 54.97 52.48 1wfw s GLU 57 Cb -0.04 -3.31 0.02 0.00 0.00 0.00 0.00 34.13 30.80 1wfw s GLU 57 CO 0.00 0.49 0.29 0.20 0.02 0.00 0.00 175.26 176.27 1wfw s GLY 58 N -0.33 -0.15 0.23 -1.50 0.00 0.21 -4.84 107.32 100.94 1wfw s GLY 58 Ca 0.18 0.40 -0.27 0.00 0.00 0.00 0.00 44.72 45.04 1wfw s GLY 58 CO 0.07 0.22 0.87 -0.98 0.00 0.00 0.00 173.10 173.28 1wfw s TRP 59 N -0.98 3.89 0.02 1.90 0.52 -1.26 -1.98 118.94 121.05 1wfw s TRP 59 Ca -0.11 1.76 -0.01 0.00 0.02 0.00 0.00 56.10 57.76 1wfw s TRP 59 Cb -0.05 -2.87 -0.02 0.00 -1.15 0.00 0.00 33.47 29.38 1wfw s TRP 59 CO 0.03 0.43 0.00 0.14 0.02 0.00 0.00 176.95 177.57 1wfw s VAL 60 N -1.26 0.11 -0.26 4.03 -7.23 -0.77 -3.82 120.40 111.19 1wfw s VAL 60 Ca 0.41 -0.87 -0.29 0.00 -1.81 0.00 0.00 61.98 59.42 1wfw s VAL 60 Cb -0.23 -0.29 -0.02 0.00 0.56 0.00 0.00 36.38 36.40 1wfw s VAL 60 CO 0.28 -0.48 1.64 -2.16 -0.31 0.00 0.00 175.10 174.07 1wfw s PRO 61 N -1.45 3.68 0.64 4.82 0.04 -1.26 -0.90 135.00 140.58 1wfw s PRO 61 Ca -0.16 1.55 0.14 0.00 0.04 0.00 0.00 61.00 62.57 1wfw s PRO 61 Cb -0.10 -4.07 0.64 0.00 0.04 0.00 0.00 34.50 31.01 1wfw s PRO 61 CO -0.01 -1.44 1.32 0.78 0.04 0.00 0.00 177.00 177.69 1wfw h GLY 62 N 12.16 0.00 0.57 0.56 0.00 -1.91 0.22 103.07 114.65 1wfw h GLY 62 Ca -0.33 0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.08 1wfw h GLY 62 CO 1.01 0.00 0.37 0.23 0.00 0.00 0.00 176.54 178.15 1wfw h SER 63 N 0.00 0.51 -0.25 0.19 0.87 -1.91 0.13 113.55 113.08 1wfw h SER 63 Ca 0.13 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 1wfw h SER 63 Cb 1.89 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.80 1wfw h SER 63 CO -0.00 0.31 0.00 2.30 -0.53 0.00 0.00 176.83 178.91 1wfw n ILE 64 N -4.82 0.54 -4.38 2.23 -5.35 0.76 -4.85 119.36 103.49 1wfw n ILE 64 Ca 0.10 -0.40 -0.31 0.00 -0.27 0.00 0.00 62.75 61.87 1wfw n ILE 64 Cb 0.23 0.01 -0.10 0.00 -1.74 0.00 0.00 39.64 38.04 1wfw n ILE 64 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1wfw s LEU 65 N -1.00 3.14 0.03 7.28 1.43 0.44 -0.71 118.68 129.29 1wfw s LEU 65 Ca 0.18 -0.22 -0.07 0.00 -1.03 0.00 0.00 54.13 52.99 1wfw s LEU 65 Cb 0.11 -1.85 -0.01 0.00 0.03 0.00 0.00 46.19 44.48 1wfw s LEU 65 CO 0.10 0.24 0.13 0.00 0.23 0.00 0.00 176.35 177.05 1wfw s ALA 66 N -1.08 -0.18 -0.79 4.21 0.00 -1.12 -4.91 121.76 117.89 1wfw s ALA 66 Ca 0.19 -0.42 -0.25 0.00 0.00 0.00 0.00 51.96 51.47 1wfw s ALA 66 Cb -0.11 0.24 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 1wfw s ALA 66 CO 0.10 -0.31 1.92 -1.25 0.00 0.00 0.00 175.76 176.22 1wfw s PRO 67 N -2.42 2.57 -0.11 0.00 0.04 -1.26 -2.04 135.00 131.78 1wfw s PRO 67 Ca -0.06 0.05 -0.33 0.00 0.04 0.00 0.00 61.00 60.69 1wfw s PRO 67 Cb -0.02 -4.81 -0.11 0.00 0.04 0.00 0.00 34.50 29.60 1wfw s PRO 67 CO -0.04 -3.15 1.95 0.34 0.04 0.00 0.00 177.00 176.14 1wfw n PHE 68 N 13.57 2.27 -0.16 0.56 7.35 -1.18 -4.86 117.46 135.01 1wfw n PHE 68 Ca 0.33 -0.04 -0.05 0.00 -0.76 0.00 0.00 57.45 56.92 1wfw n PHE 68 Cb 0.49 -2.68 0.04 0.00 0.35 0.00 0.00 39.48 37.68 1wfw n PHE 68 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 1wfw h SER 69 N 10.11 0.40 0.00 -2.13 0.87 -1.91 -3.49 113.55 117.41 1wfw h SER 69 Ca -0.47 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 1wfw h SER 69 Cb 1.27 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1wfw h SER 69 CO 0.95 0.28 0.00 0.61 -0.53 0.00 0.00 176.83 178.15 1wfw n GLY 70 N -1.24 -0.70 3.57 5.77 0.00 -1.26 -4.85 105.19 106.48 1wfw n GLY 70 Ca 0.03 -2.04 -0.27 0.00 0.00 0.00 0.00 46.02 43.74 1wfw n GLY 70 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wfw s PRO 71 N 0.00 2.53 -0.30 1.61 0.04 -1.26 -4.77 135.00 132.84 1wfw s PRO 71 Ca 0.00 -0.70 -0.11 0.00 0.04 0.00 0.00 61.00 60.24 1wfw s PRO 71 Cb 0.00 -5.15 0.18 0.00 0.04 0.00 0.00 34.50 29.57 1wfw s PRO 71 CO 0.00 -3.66 0.97 0.45 0.04 0.00 0.00 177.00 174.80 1wfw s SER 72 N 7.32 -0.61 -0.31 6.66 0.15 -1.26 -5.13 113.70 120.51 1wfw s SER 72 Ca 0.69 0.34 0.01 0.00 0.70 0.00 0.00 55.95 57.69 1wfw s SER 72 Cb -0.04 1.50 0.10 0.00 -1.71 0.00 0.00 66.02 65.86 1wfw s SER 72 CO 0.06 -0.11 0.07 -0.94 1.20 0.00 0.00 173.24 173.52 1wfw s SER 73 N 2.94 4.22 0.00 5.45 1.04 -1.26 -5.06 113.70 121.03 1wfw s SER 73 Ca 0.05 -1.75 0.00 0.00 0.48 0.00 0.00 55.95 54.73 1wfw s SER 73 Cb -0.10 -1.11 0.00 0.00 0.10 0.00 0.00 66.02 64.91 1wfw s SER 73 CO -0.14 -0.39 0.00 0.61 0.98 0.00 0.00 173.24 174.30