#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wfp s SER 2 N 0.00 0.19 0.08 1.61 0.01 -1.26 -5.17 113.70 109.17 1wfp s SER 2 Ca 0.00 -0.53 0.01 0.00 1.31 0.00 0.00 55.95 56.75 1wfp s SER 2 Cb 0.00 0.21 -0.04 0.00 0.21 0.00 0.00 66.02 66.40 1wfp s SER 2 CO 0.00 -0.48 0.18 -0.55 0.41 0.00 0.00 173.24 172.80 1wfp s SER 3 N -2.04 6.08 0.00 2.44 0.15 -1.26 -5.09 113.70 113.98 1wfp s SER 3 Ca -0.06 0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.74 1wfp s SER 3 Cb -0.02 -1.79 0.00 0.00 -1.71 0.00 0.00 66.02 62.50 1wfp s SER 3 CO -0.04 0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.16 1wfp n GLY 4 N 0.19 2.39 3.56 9.45 0.00 -1.26 -5.18 105.19 114.33 1wfp n GLY 4 Ca -0.06 -0.60 -0.15 0.00 0.00 0.00 0.00 46.02 45.20 1wfp n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wfp s SER 5 N 0.00 -0.60 -0.20 1.61 0.15 -1.26 -5.17 113.70 108.23 1wfp s SER 5 Ca 0.00 0.80 -0.12 0.00 0.70 0.00 0.00 55.95 57.33 1wfp s SER 5 Cb 0.00 0.69 0.06 0.00 -1.71 0.00 0.00 66.02 65.06 1wfp s SER 5 CO 0.00 -0.45 0.50 -0.94 1.20 0.00 0.00 173.24 173.55 1wfp s SER 6 N -0.77 -0.64 -0.17 5.45 1.04 -1.26 -5.17 113.70 112.19 1wfp s SER 6 Ca -0.06 1.08 -0.29 0.00 0.48 0.00 0.00 55.95 57.16 1wfp s SER 6 Cb -0.01 0.97 0.12 0.00 0.10 0.00 0.00 66.02 67.20 1wfp s SER 6 CO 0.05 -0.20 0.98 -0.83 0.98 0.00 0.00 173.24 174.22 1wfp s GLY 7 N 1.34 -0.27 0.07 7.32 0.00 -1.26 -5.17 107.32 109.35 1wfp s GLY 7 Ca -0.09 2.08 0.08 0.00 0.00 0.00 0.00 44.72 46.80 1wfp s GLY 7 CO -0.13 1.14 -0.22 -0.51 0.00 0.00 0.00 173.10 173.38 1wfp s THR 8 N -0.92 1.80 0.01 0.90 -4.23 -1.26 -5.15 115.64 106.80 1wfp s THR 8 Ca -0.02 -1.37 0.02 0.00 -1.18 0.00 0.00 61.69 59.15 1wfp s THR 8 Cb -0.01 -1.58 -0.01 0.00 1.34 0.00 0.00 72.50 72.24 1wfp s THR 8 CO 0.01 0.15 -0.07 -0.13 -0.54 0.00 0.00 174.62 174.04 1wfp s ARG 9 N -1.45 0.55 0.00 3.99 0.52 -1.26 -5.11 118.95 116.19 1wfp s ARG 9 Ca 0.08 -0.38 0.00 0.00 -0.52 0.00 0.00 55.73 54.92 1wfp s ARG 9 Cb -0.09 -0.49 0.00 0.00 0.52 0.00 0.00 34.95 34.89 1wfp s ARG 9 CO 0.03 0.13 0.00 0.41 0.02 0.00 0.00 175.30 175.88 1wfp n GLY 10 N 2.55 0.92 2.58 -3.53 0.00 -1.26 -4.90 105.19 101.55 1wfp n GLY 10 Ca -0.15 -1.94 -0.33 0.00 0.00 0.00 0.00 46.02 43.60 1wfp n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wfp n GLY 11 N 0.00 5.85 0.07 -0.02 0.00 -1.26 -4.71 105.19 105.12 1wfp n GLY 11 Ca 0.00 -2.59 -0.13 0.00 0.00 0.00 0.00 46.02 43.30 1wfp n GLY 11 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1wfp h ASP 12 N 2.63 -0.00 -0.75 1.61 3.58 -2.00 -3.46 116.42 118.03 1wfp h ASP 12 Ca 0.45 -0.89 -0.63 0.00 0.42 0.00 0.00 57.03 56.38 1wfp h ASP 12 Cb 0.63 0.00 0.02 0.00 1.72 0.00 0.00 39.33 41.70 1wfp h ASP 12 CO 1.15 0.93 0.29 -0.24 -2.88 0.00 0.00 179.24 178.49 1wfp n SER 13 N -4.64 0.46 -0.08 2.28 2.88 -1.26 -4.86 113.62 108.40 1wfp n SER 13 Ca -0.09 0.88 -0.14 0.00 -1.33 0.00 0.00 58.87 58.20 1wfp n SER 13 Cb 0.43 -0.68 -0.07 0.00 -0.75 0.00 0.00 64.21 63.14 1wfp n SER 13 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wfp n ALA 14 N 2.10 1.72 -3.45 -1.46 0.00 -1.26 -5.02 120.51 113.13 1wfp n ALA 14 Ca 0.19 -0.70 -0.13 0.00 0.00 0.00 0.00 53.44 52.80 1wfp n ALA 14 Cb 0.01 0.17 -0.14 0.00 0.00 0.00 0.00 19.45 19.49 1wfp n ALA 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wfp s ALA 15 N -2.33 -0.25 -0.21 0.00 0.00 -1.26 -5.09 121.76 112.62 1wfp s ALA 15 Ca -0.23 0.52 -0.27 0.00 0.00 0.00 0.00 51.96 51.97 1wfp s ALA 15 Cb 0.07 -0.34 0.11 0.00 0.00 0.00 0.00 23.12 22.96 1wfp s ALA 15 CO 0.36 -0.11 0.94 0.00 0.00 0.00 0.00 175.76 176.95 1wfp s ALA 16 N 0.73 -1.91 0.80 0.00 0.00 -1.26 -4.69 121.76 115.42 1wfp s ALA 16 Ca -0.06 1.73 -0.11 0.00 0.00 0.00 0.00 51.96 53.52 1wfp s ALA 16 Cb -0.07 -0.99 0.07 0.00 0.00 0.00 0.00 23.12 22.13 1wfp s ALA 16 CO -0.03 -0.29 1.09 -1.25 0.00 0.00 0.00 175.76 175.28 1wfp s PRO 17 N -0.38 2.06 -0.60 0.00 0.04 -1.26 -4.86 135.00 130.00 1wfp s PRO 17 Ca -0.01 1.10 -0.27 0.00 0.04 0.00 0.00 61.00 61.86 1wfp s PRO 17 Cb -0.03 -1.88 -0.11 0.00 0.04 0.00 0.00 34.50 32.53 1wfp s PRO 17 CO -0.01 -1.76 2.48 -0.11 0.04 0.00 0.00 177.00 177.64 1wfp n LEU 18 N -3.59 1.86 -3.95 -3.56 0.00 -1.26 -4.89 117.00 101.61 1wfp n LEU 18 Ca 0.09 -0.32 -0.09 0.00 0.00 0.00 0.00 56.01 55.69 1wfp n LEU 18 Cb 0.53 -1.43 -0.09 0.00 0.00 0.00 0.00 43.42 42.43 1wfp n LEU 18 CO 0.54 -1.35 -0.24 -1.81 0.00 0.00 0.00 177.39 174.53 1wfp s ASP 19 N 11.34 0.23 0.98 1.96 1.01 -1.26 -5.17 116.67 125.76 1wfp s ASP 19 Ca 1.07 -0.62 -0.12 0.00 0.71 0.00 0.00 52.55 53.59 1wfp s ASP 19 Cb -0.44 0.22 0.17 0.00 1.01 0.00 0.00 42.92 43.88 1wfp s ASP 19 CO 0.32 -0.52 1.09 -2.16 0.21 0.00 0.00 175.17 174.11 1wfp s PRO 20 N -2.83 0.62 0.00 8.23 0.04 -1.26 -4.90 135.00 134.89 1wfp s PRO 20 Ca -0.03 0.59 0.14 0.00 0.04 0.00 0.00 61.00 61.75 1wfp s PRO 20 Cb 0.00 -1.75 0.86 0.00 0.04 0.00 0.00 34.50 33.65 1wfp s PRO 20 CO -0.06 -2.62 1.27 -0.35 0.04 0.00 0.00 177.00 175.28 1wfp n PRO 21 N -4.11 0.49 -0.31 0.56 -0.04 -1.26 -3.43 135.00 126.90 1wfp n PRO 21 Ca 0.06 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.54 1wfp n PRO 21 Cb 0.57 -1.46 0.16 0.00 -0.04 0.00 0.00 33.50 32.73 1wfp n PRO 21 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1wfp h LYS 22 N 0.00 0.86 -1.66 0.54 2.10 -2.06 -3.45 116.57 112.91 1wfp h LYS 22 Ca 0.00 -0.05 0.07 0.00 -2.00 0.00 0.00 60.65 58.67 1wfp h LYS 22 Cb 0.00 -0.19 -0.22 0.00 -0.90 0.00 0.00 32.23 30.92 1wfp h LYS 22 CO 0.00 0.57 0.52 -1.54 -2.00 0.00 0.00 179.45 177.00 1wfp s SER 23 N -5.69 -0.39 -0.07 7.07 1.04 -1.22 -5.18 113.70 109.27 1wfp s SER 23 Ca -0.12 0.39 -0.05 0.00 0.48 0.00 0.00 55.95 56.64 1wfp s SER 23 Cb 0.19 0.33 0.02 0.00 0.10 0.00 0.00 66.02 66.66 1wfp s SER 23 CO 0.79 -0.39 0.17 0.42 0.98 0.00 0.00 173.24 175.21 1wfp s THR 24 N -1.31 -0.01 0.35 2.02 -4.23 -1.26 -4.75 115.64 106.44 1wfp s THR 24 Ca -0.02 0.04 0.00 0.00 -1.18 0.00 0.00 61.69 60.54 1wfp s THR 24 Cb -0.00 -0.25 -0.00 0.00 1.34 0.00 0.00 72.50 73.58 1wfp s THR 24 CO 0.01 0.02 0.44 0.00 -0.54 0.00 0.00 174.62 174.54 1wfp s ALA 25 N 0.35 1.07 -0.19 3.99 0.00 -1.26 -5.12 121.76 120.61 1wfp s ALA 25 Ca -0.02 -1.68 0.01 0.00 0.00 0.00 0.00 51.96 50.27 1wfp s ALA 25 Cb -0.04 1.23 0.04 0.00 0.00 0.00 0.00 23.12 24.36 1wfp s ALA 25 CO -0.01 -0.76 -0.11 0.99 0.00 0.00 0.00 175.76 175.87 1wfp s THR 26 N -3.07 1.59 0.21 0.00 2.01 -1.26 -4.73 115.64 110.38 1wfp s THR 26 Ca 0.33 -0.90 -0.00 0.00 0.31 0.00 0.00 61.69 61.43 1wfp s THR 26 Cb 0.00 -1.63 -0.04 0.00 0.01 0.00 0.00 72.50 70.84 1wfp s THR 26 CO 0.23 0.22 0.15 -0.13 -0.69 0.00 0.00 174.62 174.40 1wfp s ARG 27 N 1.43 1.27 1.11 4.92 0.52 -1.26 -1.82 118.95 125.12 1wfp s ARG 27 Ca 0.00 -1.67 -0.12 0.00 -0.52 0.00 0.00 55.73 53.43 1wfp s ARG 27 Cb -0.15 0.28 0.25 0.00 0.52 0.00 0.00 34.95 35.85 1wfp s ARG 27 CO -0.09 -0.42 1.06 0.00 0.02 0.00 0.00 175.30 175.87 1wfp n LEU 29 N -4.79 0.89 -0.02 0.00 7.94 -0.93 -3.09 117.00 117.00 1wfp n LEU 29 Ca 0.05 -0.47 -0.03 0.00 -1.11 0.00 0.00 56.01 54.45 1wfp n LEU 29 Cb 0.53 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 44.47 1wfp n LEU 29 CO 0.55 0.22 -0.64 -1.20 -1.11 0.00 0.00 177.39 175.22 1wfp n SER 30 N -1.51 3.10 -0.74 1.96 7.64 -1.26 -4.71 113.62 118.09 1wfp n SER 30 Ca 0.03 -0.01 0.08 0.00 1.01 0.00 0.00 58.87 59.99 1wfp n SER 30 Cb 0.32 -0.07 0.11 0.00 -1.01 0.00 0.00 64.21 63.56 1wfp n SER 30 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wfp n ASN 32 N 0.95 -1.72 -4.83 0.00 4.13 -1.18 -4.81 115.26 107.80 1wfp n ASN 32 Ca 0.12 -0.93 -0.36 0.00 1.68 0.00 0.00 54.58 55.08 1wfp n ASN 32 Cb 0.44 -1.52 -0.06 0.00 -1.54 0.00 0.00 39.78 37.10 1wfp n ASN 32 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1wfp s LYS 33 N -6.84 4.08 -0.45 3.52 2.20 -1.26 -4.45 119.74 116.53 1wfp s LYS 33 Ca 0.69 0.62 -0.27 0.00 -0.36 0.00 0.00 55.97 56.65 1wfp s LYS 33 Cb -0.40 -2.96 -0.07 0.00 -1.51 0.00 0.00 37.83 32.89 1wfp s LYS 33 CO 0.84 0.48 2.39 1.17 -0.36 0.00 0.00 175.35 179.87 1wfp n LYS 34 N 0.91 1.18 -0.01 4.03 3.00 -1.26 0.23 118.16 126.24 1wfp n LYS 34 Ca -0.05 0.09 0.09 0.00 -0.00 0.00 0.00 58.31 58.44 1wfp n LYS 34 Cb 0.51 -3.36 -0.14 0.00 0.00 0.00 0.00 35.03 32.04 1wfp n LYS 34 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 1wfp n VAL 35 N 7.94 0.00 0.00 3.15 0.24 -0.85 -4.94 118.33 123.88 1wfp n VAL 35 Ca 0.37 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 1wfp n VAL 35 Cb 0.51 0.14 0.00 0.00 -1.47 0.00 0.00 33.84 33.03 1wfp n VAL 35 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wfp n GLY 36 N 1.45 2.11 0.12 7.63 0.00 -0.75 -0.76 105.19 114.99 1wfp n GLY 36 Ca -0.03 0.43 -0.21 0.00 0.00 0.00 0.00 46.02 46.21 1wfp n GLY 36 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1wfp h VAL 37 N 0.00 0.98 -1.10 1.61 3.04 -1.95 -3.34 116.25 115.49 1wfp h VAL 37 Ca 0.00 -2.30 0.32 0.00 -1.01 0.00 0.00 66.70 63.71 1wfp h VAL 37 Cb 0.00 2.54 -0.04 0.00 -2.01 0.00 0.00 31.29 31.78 1wfp h VAL 37 CO 0.00 0.58 0.88 0.71 -1.01 0.00 0.00 177.57 178.73 1wfp h THR 38 N -0.56 0.31 -1.72 3.17 1.35 -1.72 -3.43 112.91 110.30 1wfp h THR 38 Ca -0.32 0.00 -0.49 0.00 -0.55 0.00 0.00 66.41 65.06 1wfp h THR 38 Cb 1.57 0.36 0.19 0.00 -1.73 0.00 0.00 68.15 68.54 1wfp h THR 38 CO -0.04 0.00 -1.40 0.61 -0.25 0.00 0.00 175.52 174.43 1wfp n GLY 39 N -1.73 -3.61 3.13 5.82 0.00 0.06 -4.91 105.19 103.96 1wfp n GLY 39 Ca 0.24 -0.51 -0.35 0.00 0.00 0.00 0.00 46.02 45.39 1wfp n GLY 39 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wfp s PHE 40 N -1.72 3.51 0.57 1.61 0.40 0.43 -4.92 117.98 117.85 1wfp s PHE 40 Ca 0.39 -2.29 -0.20 0.00 -0.60 0.00 0.00 56.93 54.24 1wfp s PHE 40 Cb -0.25 -2.88 -0.05 0.00 0.51 0.00 0.00 43.02 40.35 1wfp s PHE 40 CO 0.67 -0.92 1.06 1.17 0.70 0.00 0.00 175.22 177.89 1wfp n LYS 41 N 4.58 1.12 -4.51 0.44 3.00 -1.26 -2.98 118.16 118.55 1wfp n LYS 41 Ca -0.05 0.42 -0.24 0.00 -0.00 0.00 0.00 58.31 58.44 1wfp n LYS 41 Cb 0.42 -2.24 -0.11 0.00 0.00 0.00 0.00 35.03 33.10 1wfp n LYS 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1wfp h ARG 43 N 2.05 0.00 0.00 0.00 3.08 -1.95 0.40 114.38 117.96 1wfp h ARG 43 Ca -0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.63 1wfp h ARG 43 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.29 1wfp h ARG 43 CO 0.72 0.00 -0.03 0.00 -1.07 0.00 0.00 179.97 179.59 1wfp n GLY 45 N 1.45 2.96 3.20 0.00 0.00 0.14 -4.91 105.19 108.03 1wfp n GLY 45 Ca 0.07 -0.65 -0.30 0.00 0.00 0.00 0.00 46.02 45.13 1wfp n GLY 45 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wfp n SER 46 N 0.88 -2.60 -4.11 1.61 7.64 -1.26 -4.41 113.62 111.37 1wfp n SER 46 Ca 0.00 -0.20 -0.29 0.00 1.01 0.00 0.00 58.87 59.39 1wfp n SER 46 Cb 0.00 -0.88 -0.17 0.00 -1.01 0.00 0.00 64.21 62.15 1wfp n SER 46 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1wfp s THR 47 N -2.18 1.62 0.45 0.44 2.01 -1.26 -2.46 115.64 114.26 1wfp s THR 47 Ca 0.51 -0.75 0.04 0.00 0.31 0.00 0.00 61.69 61.80 1wfp s THR 47 Cb -0.09 -1.44 -0.05 0.00 0.01 0.00 0.00 72.50 70.94 1wfp s THR 47 CO 0.59 0.46 0.01 -0.36 -0.69 0.00 0.00 174.62 174.63 1wfp s PHE 48 N 0.61 2.20 0.70 4.92 0.40 -1.16 -2.18 117.98 123.47 1wfp s PHE 48 Ca -0.14 -0.82 0.02 0.00 -0.60 0.00 0.00 56.93 55.39 1wfp s PHE 48 Cb -0.16 -1.67 0.13 0.00 0.51 0.00 0.00 43.02 41.83 1wfp s PHE 48 CO 0.05 0.32 0.96 0.00 0.70 0.00 0.00 175.22 177.25 1wfp n GLY 50 N -2.64 -0.42 0.09 0.00 0.00 -1.26 -0.36 105.19 100.59 1wfp n GLY 50 Ca 0.17 -0.07 -0.10 0.00 0.00 0.00 0.00 46.02 46.02 1wfp n GLY 50 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1wfp n THR 51 N -1.06 1.09 -1.33 2.61 -1.04 -1.26 -4.56 114.28 108.73 1wfp n THR 51 Ca 0.08 -0.56 0.04 0.00 -2.04 0.00 0.00 64.05 61.57 1wfp n THR 51 Cb 0.05 -0.86 0.20 0.00 -1.82 0.00 0.00 70.33 67.90 1wfp n THR 51 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1wfp n HIS 52 N -2.79 0.49 0.00 -1.42 -0.00 -0.95 -4.68 115.22 105.88 1wfp n HIS 52 Ca -0.29 -1.31 -0.05 0.00 -0.00 0.00 0.00 57.72 56.06 1wfp n HIS 52 Cb 0.94 -0.31 0.15 0.00 -0.00 0.00 0.00 29.99 30.77 1wfp n HIS 52 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.34 176.41 1wfp h ARG 53 N 0.89 0.52 -7.10 -0.41 0.11 -0.94 -3.41 114.38 104.04 1wfp h ARG 53 Ca 0.07 -0.23 -0.47 0.00 0.10 0.00 0.00 59.98 59.44 1wfp h ARG 53 Cb 1.28 -0.01 0.03 0.00 1.11 0.00 0.00 29.97 32.38 1wfp h ARG 53 CO 0.16 0.79 0.38 0.71 0.10 0.00 0.00 179.97 182.11 1wfp s TYR 54 N -4.36 3.00 0.01 4.08 1.51 -1.26 -4.91 117.35 115.41 1wfp s TYR 54 Ca -0.07 1.56 -0.23 0.00 -1.01 0.00 0.00 57.07 57.32 1wfp s TYR 54 Cb 0.13 -3.05 -0.17 0.00 -0.11 0.00 0.00 41.96 38.75 1wfp s TYR 54 CO 0.81 -0.88 1.30 -1.00 -1.11 0.00 0.00 175.55 174.67 1wfp h PRO 55 N 1.34 0.17 -0.95 -1.71 0.13 -1.86 -3.01 132.00 126.12 1wfp h PRO 55 Ca -0.49 -0.09 0.27 0.00 -0.87 0.00 0.00 66.00 64.82 1wfp h PRO 55 Cb 1.22 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 1wfp h PRO 55 CO 0.59 0.61 0.67 1.05 -0.23 0.00 0.00 178.00 180.69 1wfp h GLU 56 N -0.26 0.05 0.00 0.86 4.11 -1.97 0.54 114.58 117.92 1wfp h GLU 56 Ca 0.01 -0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.25 1wfp h GLU 56 Cb 0.58 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 1wfp h GLU 56 CO 0.02 0.04 -0.89 0.77 0.07 0.00 0.00 179.01 179.01 1wfp h SER 57 N 0.06 0.00 -3.31 3.06 0.02 -1.90 -3.43 113.55 108.05 1wfp h SER 57 Ca 0.46 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.86 1wfp h SER 57 Cb 1.73 0.00 -0.38 0.00 0.14 0.00 0.00 62.40 63.90 1wfp h SER 57 CO -0.04 0.89 -0.79 -1.38 -1.14 0.00 0.00 176.83 174.37 1wfp s HIS 58 N -2.92 1.66 -0.87 3.45 -3.43 0.19 -5.04 115.29 108.33 1wfp s HIS 58 Ca 0.01 -1.04 -0.21 0.00 -0.80 0.00 0.00 55.06 53.02 1wfp s HIS 58 Cb 0.10 -1.30 -0.22 0.00 -1.43 0.00 0.00 32.58 29.73 1wfp s HIS 58 CO 0.80 -0.60 2.38 0.39 -2.00 0.00 0.00 174.74 175.71 1wfp n GLU 59 N 4.89 0.29 -1.63 -0.38 1.02 -1.24 -4.60 120.64 118.98 1wfp n GLU 59 Ca -0.12 -0.21 -0.43 0.00 -0.02 0.00 0.00 57.16 56.39 1wfp n GLU 59 Cb 0.48 -2.13 -0.03 0.00 -0.02 0.00 0.00 31.44 29.74 1wfp n GLU 59 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wfp h GLN 61 N 12.95 0.30 -6.25 0.00 1.08 -1.98 -3.42 115.11 117.79 1wfp h GLN 61 Ca -0.45 -0.07 -0.58 0.00 -1.45 0.00 0.00 58.65 56.10 1wfp h GLN 61 Cb 1.24 -0.04 0.01 0.00 -0.05 0.00 0.00 27.48 28.64 1wfp h GLN 61 CO 0.95 0.42 1.24 0.34 -0.95 0.00 0.00 178.83 180.83 1wfp n PHE 62 N -4.79 2.33 -1.63 2.96 7.35 -1.26 -4.86 117.46 117.55 1wfp n PHE 62 Ca -0.04 -0.18 -0.43 0.00 -0.76 0.00 0.00 57.45 56.04 1wfp n PHE 62 Cb 0.16 -2.73 -0.03 0.00 0.35 0.00 0.00 39.48 37.23 1wfp n PHE 62 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 1wfp n ASP 63 N 7.98 3.73 -4.71 -2.13 8.00 -1.26 -4.89 116.55 123.27 1wfp n ASP 63 Ca 0.23 0.56 -0.42 0.00 0.71 0.00 0.00 54.79 55.88 1wfp n ASP 63 Cb 0.37 -1.54 -0.03 0.00 -0.02 0.00 0.00 41.12 39.89 1wfp n ASP 63 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1wfp s PHE 64 N 6.34 2.86 -0.48 1.24 0.08 -1.26 -2.75 117.98 124.01 1wfp s PHE 64 Ca 0.95 0.51 -0.06 0.00 0.12 0.00 0.00 56.93 58.44 1wfp s PHE 64 Cb -0.39 -3.96 0.06 0.00 -0.57 0.00 0.00 43.02 38.16 1wfp s PHE 64 CO 0.39 -3.64 0.15 1.63 -0.10 0.00 0.00 175.22 173.65 1wfp n LYS 65 N 4.44 -1.96 0.00 0.44 5.02 -1.26 -1.79 118.16 123.05 1wfp n LYS 65 Ca 0.15 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.47 1wfp n LYS 65 Cb 0.39 -3.53 0.00 0.00 -0.02 0.00 0.00 35.03 31.87 1wfp n LYS 65 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wfp n GLY 66 N -0.57 1.43 3.58 0.72 0.00 -1.11 -4.94 105.19 104.31 1wfp n GLY 66 Ca 0.03 -0.03 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1wfp n GLY 66 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1wfp n VAL 67 N 0.00 2.01 -3.98 1.61 3.14 -0.74 -4.89 118.33 115.49 1wfp n VAL 67 Ca 0.00 -0.50 -0.13 0.00 -2.96 0.00 0.00 64.34 60.75 1wfp n VAL 67 Cb 0.00 -0.97 -0.14 0.00 -1.06 0.00 0.00 33.84 31.67 1wfp n VAL 67 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1wfp s ALA 68 N -1.07 0.16 0.00 1.55 0.00 -1.26 -3.98 121.76 117.16 1wfp s ALA 68 Ca 0.59 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.45 1wfp s ALA 68 Cb -0.70 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 22.38 1wfp s ALA 68 CO 0.60 0.03 0.00 0.43 0.00 0.00 0.00 175.76 176.82 1wfp n SER 69 N 2.98 1.29 -1.47 0.00 7.64 -1.26 -5.12 113.62 117.69 1wfp n SER 69 Ca -0.13 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.75 1wfp n SER 69 Cb 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 1wfp n SER 69 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wfp n GLY 70 N 2.78 -0.82 3.63 0.23 0.00 -1.26 -4.97 105.19 104.78 1wfp n GLY 70 Ca 0.00 -0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.46 1wfp n GLY 70 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wfp s PRO 71 N -0.92 3.76 0.18 1.61 0.04 -1.26 -5.00 135.00 133.41 1wfp s PRO 71 Ca 0.00 1.63 -0.19 0.00 0.04 0.00 0.00 61.00 62.48 1wfp s PRO 71 Cb 0.00 -4.04 -0.08 0.00 0.04 0.00 0.00 34.50 30.42 1wfp s PRO 71 CO 0.00 -1.33 0.68 -1.12 0.04 0.00 0.00 177.00 175.26 1wfp s SER 72 N 4.33 7.05 -0.61 6.66 0.01 -1.26 -5.02 113.70 124.86 1wfp s SER 72 Ca 0.72 1.36 -0.25 0.00 1.31 0.00 0.00 55.95 59.08 1wfp s SER 72 Cb -0.24 -2.39 0.04 0.00 0.21 0.00 0.00 66.02 63.63 1wfp s SER 72 CO 0.29 0.10 1.05 -0.55 0.41 0.00 0.00 173.24 174.54 1wfp s SER 73 N -1.54 6.30 0.00 2.44 0.15 -1.26 -5.31 113.70 114.47 1wfp s SER 73 Ca 0.39 -0.40 0.00 0.00 0.70 0.00 0.00 55.95 56.64 1wfp s SER 73 Cb -0.17 -2.47 0.00 0.00 -1.71 0.00 0.00 66.02 61.66 1wfp s SER 73 CO 0.21 -1.42 0.35 0.61 1.20 0.00 0.00 173.24 174.20