#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 0.77 -0.06 1.61 1.04 -1.26 -5.16 113.70 110.64 1wfp s SER 2 Ca 0.00 -0.52 -0.30 0.00 0.48 0.00 0.00 55.95 55.61 1wfp s SER 2 Cb 0.00 0.04 0.08 0.00 0.10 0.00 0.00 66.02 66.24 1wfp s SER 2 CO 0.00 -0.20 0.75 -0.55 0.98 0.00 0.00 173.24 174.22 1wfp s SER 3 N -1.48 -0.58 0.00 7.02 0.15 -1.26 -5.19 113.70 112.37 1wfp s SER 3 Ca -0.10 0.60 0.00 0.00 0.70 0.00 0.00 55.95 57.15 1wfp s SER 3 Cb -0.09 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.70 1wfp s SER 3 CO 0.00 -0.57 0.00 0.61 1.20 0.00 0.00 173.24 174.48 1wfp n GLY 4 N 0.78 5.93 2.90 9.45 0.00 -1.26 -5.17 105.19 117.81 1wfp n GLY 4 Ca -0.17 -1.72 -0.13 0.00 0.00 0.00 0.00 46.02 44.00 1wfp n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wfp s SER 5 N 0.63 0.18 0.90 1.61 0.01 -1.26 -5.16 113.70 110.61 1wfp s SER 5 Ca 0.00 -0.03 -0.13 0.00 1.31 0.00 0.00 55.95 57.11 1wfp s SER 5 Cb 0.00 -0.02 0.18 0.00 0.21 0.00 0.00 66.02 66.39 1wfp s SER 5 CO 0.00 0.02 1.24 -0.44 0.41 0.00 0.00 173.24 174.47 1wfp s SER 6 N -0.03 3.47 0.10 2.44 0.01 -1.26 -5.10 113.70 113.33 1wfp s SER 6 Ca 0.01 0.18 -0.16 0.00 1.31 0.00 0.00 55.95 57.28 1wfp s SER 6 Cb -0.01 -0.32 0.06 0.00 0.21 0.00 0.00 66.02 65.96 1wfp s SER 6 CO -0.00 -2.49 0.76 0.61 0.41 0.00 0.00 173.24 172.53 1wfp n GLY 7 N -3.54 0.72 3.61 3.44 0.00 -1.26 -5.18 105.19 102.98 1wfp n GLY 7 Ca 0.15 -1.07 -0.23 0.00 0.00 0.00 0.00 46.02 44.87 1wfp n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wfp s THR 8 N -2.18 3.20 0.12 2.61 -4.23 -1.26 -5.05 115.64 108.84 1wfp s THR 8 Ca 0.17 -2.00 -0.27 0.00 -1.18 0.00 0.00 61.69 58.41 1wfp s THR 8 Cb -0.02 -2.75 -0.08 0.00 1.34 0.00 0.00 72.50 70.99 1wfp s THR 8 CO 0.03 -0.36 1.45 0.03 -0.54 0.00 0.00 174.62 175.24 1wfp h ARG 9 N 1.94 -0.24 -4.81 3.99 3.08 -2.08 -3.43 114.38 112.83 1wfp h ARG 9 Ca -0.43 0.02 -0.27 0.00 0.07 0.00 0.00 59.98 59.36 1wfp h ARG 9 Cb 1.25 0.05 -0.16 0.00 0.08 0.00 0.00 29.97 31.19 1wfp h ARG 9 CO 0.61 -0.16 -0.71 0.20 -1.07 0.00 0.00 179.97 178.84 1wfp s GLY 10 N -2.16 0.83 -0.27 0.04 0.00 -1.26 -5.07 107.32 99.44 1wfp s GLY 10 Ca -0.11 -1.29 0.16 0.00 0.00 0.00 0.00 44.72 43.48 1wfp s GLY 10 CO 0.51 -1.38 1.15 0.61 0.00 0.00 0.00 173.10 173.99 1wfp n GLY 11 N 0.20 3.75 0.38 0.20 0.00 -1.26 -4.91 105.19 103.55 1wfp n GLY 11 Ca -0.14 -1.74 -0.02 0.00 0.00 0.00 0.00 46.02 44.13 1wfp n GLY 11 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1wfp h ASP 12 N 2.39 -1.47 -3.23 1.61 2.03 -2.00 -3.35 116.42 112.39 1wfp h ASP 12 Ca 0.07 0.31 -0.57 0.00 -0.73 0.00 0.00 57.03 56.11 1wfp h ASP 12 Cb 1.39 0.76 -0.06 0.00 -0.83 0.00 0.00 39.33 40.59 1wfp h ASP 12 CO 0.42 -0.29 0.55 -0.44 -1.03 0.00 0.00 179.24 178.46 1wfp s SER 13 N -5.35 7.08 -0.30 4.15 0.01 -1.26 -4.99 113.70 113.03 1wfp s SER 13 Ca -0.14 1.33 -0.09 0.00 1.31 0.00 0.00 55.95 58.36 1wfp s SER 13 Cb 0.19 -2.51 0.18 0.00 0.21 0.00 0.00 66.02 64.10 1wfp s SER 13 CO 0.71 -0.49 0.91 0.00 0.41 0.00 0.00 173.24 174.78 1wfp s ALA 14 N 2.40 -3.13 -1.05 1.44 0.00 -1.26 -5.07 121.76 115.10 1wfp s ALA 14 Ca 0.43 1.52 -0.06 0.00 0.00 0.00 0.00 51.96 53.84 1wfp s ALA 14 Cb -0.17 -2.44 0.27 0.00 0.00 0.00 0.00 23.12 20.78 1wfp s ALA 14 CO 0.12 -1.49 1.07 0.00 0.00 0.00 0.00 175.76 175.45 1wfp n ALA 15 N 5.43 4.23 -3.63 0.00 0.00 -1.26 -4.96 120.51 120.31 1wfp n ALA 15 Ca -0.04 -4.67 -0.05 0.00 0.00 0.00 0.00 53.44 48.68 1wfp n ALA 15 Cb 0.53 -2.22 -0.06 0.00 0.00 0.00 0.00 19.45 17.71 1wfp n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wfp s ALA 16 N -1.52 -2.10 1.22 0.00 0.00 -1.26 -4.76 121.76 113.34 1wfp s ALA 16 Ca 0.30 1.76 -0.20 0.00 0.00 0.00 0.00 51.96 53.82 1wfp s ALA 16 Cb -0.07 -1.50 0.29 0.00 0.00 0.00 0.00 23.12 21.84 1wfp s ALA 16 CO -0.07 -0.19 1.11 -1.25 0.00 0.00 0.00 175.76 175.36 1wfp s PRO 17 N -0.31 -1.36 0.27 0.00 0.04 -1.26 -4.77 135.00 127.62 1wfp s PRO 17 Ca 0.05 -0.11 -0.25 0.00 0.04 0.00 0.00 61.00 60.74 1wfp s PRO 17 Cb -0.03 -1.58 -0.16 0.00 0.04 0.00 0.00 34.50 32.76 1wfp s PRO 17 CO -0.09 -3.79 0.34 1.47 0.04 0.00 0.00 177.00 174.96 1wfp n LEU 18 N -4.81 -1.84 -3.38 -3.56 -0.00 -1.26 -2.47 117.00 99.68 1wfp n LEU 18 Ca 0.14 0.97 -0.17 0.00 -0.00 0.00 0.00 56.01 56.95 1wfp n LEU 18 Cb 0.60 -0.90 0.07 0.00 -0.00 0.00 0.00 43.42 43.19 1wfp n LEU 18 CO 0.44 -3.37 0.05 -0.67 -0.00 0.00 0.00 177.39 173.84 1wfp n ASP 19 N 2.07 -4.22 -4.77 1.45 2.03 -1.26 -4.97 116.55 106.88 1wfp n ASP 19 Ca 0.15 -0.70 -0.33 0.00 0.52 0.00 0.00 54.79 54.43 1wfp n ASP 19 Cb 0.30 -5.00 0.04 0.00 -0.72 0.00 0.00 41.12 35.74 1wfp n ASP 19 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1wfp s PRO 20 N -5.00 2.89 0.00 -0.67 0.04 -1.03 -5.06 135.00 126.17 1wfp s PRO 20 Ca 0.23 1.43 0.00 0.00 0.04 0.00 0.00 61.00 62.70 1wfp s PRO 20 Cb -0.04 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1wfp s PRO 20 CO 0.75 -1.19 0.00 -0.35 0.04 0.00 0.00 177.00 176.25 1wfp n PRO 21 N -2.24 -0.13 -1.20 0.56 -0.04 -1.26 -4.86 135.00 125.84 1wfp n PRO 21 Ca 0.11 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.38 1wfp n PRO 21 Cb 0.52 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.87 1wfp n PRO 21 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1wfp n LYS 22 N -0.85 2.14 -2.75 0.54 5.02 -1.26 -4.85 118.16 116.15 1wfp n LYS 22 Ca 0.00 -1.58 -0.42 0.00 -2.02 0.00 0.00 58.31 54.29 1wfp n LYS 22 Cb 0.00 -2.02 -0.03 0.00 -0.02 0.00 0.00 35.03 32.96 1wfp n LYS 22 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1wfp s SER 23 N 1.22 6.52 0.12 4.39 1.04 -1.26 -4.76 113.70 120.98 1wfp s SER 23 Ca 0.60 -1.66 0.22 0.00 0.48 0.00 0.00 55.95 55.60 1wfp s SER 23 Cb 0.34 -2.48 -0.09 0.00 0.10 0.00 0.00 66.02 63.88 1wfp s SER 23 CO -0.10 -1.31 0.88 1.07 0.98 0.00 0.00 173.24 174.76 1wfp n THR 24 N 6.15 0.39 -3.67 2.02 5.66 -1.26 -4.94 114.28 118.64 1wfp n THR 24 Ca 0.25 -0.50 -0.20 0.00 -3.05 0.00 0.00 64.05 60.54 1wfp n THR 24 Cb 0.50 -0.19 -0.03 0.00 -1.55 0.00 0.00 70.33 69.06 1wfp n THR 24 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1wfp s ALA 25 N -3.39 3.99 -0.34 1.79 0.00 -1.26 -5.07 121.76 117.47 1wfp s ALA 25 Ca -0.02 -1.62 -0.28 0.00 0.00 0.00 0.00 51.96 50.04 1wfp s ALA 25 Cb 0.11 -1.31 0.02 0.00 0.00 0.00 0.00 23.12 21.94 1wfp s ALA 25 CO 0.83 -0.03 1.03 0.99 0.00 0.00 0.00 175.76 178.58 1wfp s THR 26 N -2.29 4.51 0.07 0.00 2.01 -1.26 -5.00 115.64 113.69 1wfp s THR 26 Ca 0.43 1.54 -0.06 0.00 0.31 0.00 0.00 61.69 63.91 1wfp s THR 26 Cb -0.07 -4.40 -0.01 0.00 0.01 0.00 0.00 72.50 68.03 1wfp s THR 26 CO 0.28 -0.53 0.12 -0.13 -0.69 0.00 0.00 174.62 173.67 1wfp s ARG 27 N 3.65 0.76 1.06 4.92 0.52 -1.26 -2.05 118.95 126.55 1wfp s ARG 27 Ca 0.43 -1.02 -0.24 0.00 -0.52 0.00 0.00 55.73 54.38 1wfp s ARG 27 Cb -0.12 0.30 -0.06 0.00 0.52 0.00 0.00 34.95 35.59 1wfp s ARG 27 CO 0.17 -0.21 -0.84 0.00 0.02 0.00 0.00 175.30 174.44 1wfp n LEU 29 N 1.14 0.25 -0.08 0.00 7.94 -0.89 -3.19 117.00 122.18 1wfp n LEU 29 Ca -0.01 -0.17 -0.11 0.00 -1.11 0.00 0.00 56.01 54.61 1wfp n LEU 29 Cb 0.69 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.57 1wfp n LEU 29 CO 0.47 0.06 -1.00 -1.20 -1.11 0.00 0.00 177.39 174.62 1wfp n SER 30 N -1.82 2.73 -0.46 1.96 7.64 -1.26 -4.64 113.62 117.76 1wfp n SER 30 Ca -0.01 -0.07 0.07 0.00 1.01 0.00 0.00 58.87 59.87 1wfp n SER 30 Cb 0.36 -0.25 0.04 0.00 -1.01 0.00 0.00 64.21 63.35 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 0.46 -2.30 -4.84 0.00 4.13 -1.19 -4.84 115.26 106.68 1wfp n ASN 32 Ca 0.07 -1.11 -0.37 0.00 1.68 0.00 0.00 54.58 54.85 1wfp n ASN 32 Cb 0.32 -2.29 -0.06 0.00 -1.54 0.00 0.00 39.78 36.21 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 -7.05 3.95 -0.53 3.52 2.20 -1.26 -4.47 119.74 116.10 1wfp s LYS 33 Ca 0.68 0.44 -0.32 0.00 -0.36 0.00 0.00 55.97 56.41 1wfp s LYS 33 Cb -0.38 -3.14 -0.13 0.00 -1.51 0.00 0.00 37.83 32.67 1wfp s LYS 33 CO 0.97 0.63 2.36 1.17 -0.36 0.00 0.00 175.35 180.12 1wfp n LYS 34 N 1.49 0.82 -0.00 4.03 3.00 -1.26 0.01 118.16 126.25 1wfp n LYS 34 Ca -0.11 0.15 0.05 0.00 -0.00 0.00 0.00 58.31 58.40 1wfp n LYS 34 Cb 0.52 -2.49 -0.07 0.00 0.00 0.00 0.00 35.03 32.98 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 7.47 0.00 0.00 3.15 0.24 -0.87 -4.90 118.33 123.42 1wfp n VAL 35 Ca 0.46 -0.25 0.00 0.00 -2.04 0.00 0.00 64.34 62.51 1wfp n VAL 35 Cb 0.26 0.63 0.00 0.00 -1.47 0.00 0.00 33.84 33.26 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 1.55 1.47 0.09 7.63 0.00 -0.88 0.19 105.19 115.25 1wfp n GLY 36 Ca 0.00 0.38 -0.10 0.00 0.00 0.00 0.00 46.02 46.30 1wfp n GLY 36 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1wfp n VAL 37 N 0.00 1.58 0.33 1.61 3.14 -1.26 -4.03 118.33 119.69 1wfp n VAL 37 Ca 0.00 -0.79 0.21 0.00 -2.96 0.00 0.00 64.34 60.80 1wfp n VAL 37 Cb 0.00 -0.99 1.15 0.00 -1.06 0.00 0.00 33.84 32.94 1wfp n VAL 37 CO 0.00 0.00 0.00 0.71 -6.46 0.00 0.00 176.83 171.08 1wfp h THR 38 N 0.01 0.12 -1.83 1.55 1.35 -1.15 -3.44 112.91 109.51 1wfp h THR 38 Ca -0.36 -0.02 -0.50 0.00 -0.55 0.00 0.00 66.41 64.99 1wfp h THR 38 Cb 2.06 1.01 0.24 0.00 -1.73 0.00 0.00 68.15 69.74 1wfp h THR 38 CO 0.06 0.00 -1.87 0.61 -0.25 0.00 0.00 175.52 174.08 1wfp n GLY 39 N -1.10 -3.04 2.88 5.82 0.00 0.13 -4.79 105.19 105.08 1wfp n GLY 39 Ca -0.03 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.11 2.15 0.50 1.61 0.40 0.81 -4.89 117.98 116.46 1wfp s PHE 40 Ca 0.45 -1.68 -0.23 0.00 -0.60 0.00 0.00 56.93 54.87 1wfp s PHE 40 Cb -0.04 -1.59 -0.07 0.00 0.51 0.00 0.00 43.02 41.82 1wfp s PHE 40 CO 0.69 -0.77 1.22 1.17 0.70 0.00 0.00 175.22 178.23 1wfp n LYS 41 N 4.73 1.62 -4.46 0.44 3.00 -1.26 -2.47 118.16 119.77 1wfp n LYS 41 Ca -0.09 0.59 -0.22 0.00 -0.00 0.00 0.00 58.31 58.58 1wfp n LYS 41 Cb 0.44 -2.38 -0.10 0.00 0.00 0.00 0.00 35.03 32.99 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 2.22 0.00 -0.40 0.00 3.08 -1.95 0.92 114.38 118.24 1wfp h ARG 43 Ca -0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.65 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 0.68 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 179.58 1wfp n GLY 45 N 0.40 0.65 3.79 0.00 0.00 0.32 -4.96 105.19 105.38 1wfp n GLY 45 Ca 0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 1wfp n GLY 45 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wfp s SER 46 N -2.33 4.85 -0.15 1.61 0.01 -1.24 -4.86 113.70 111.59 1wfp s SER 46 Ca 0.00 -0.76 -0.02 0.00 1.31 0.00 0.00 55.95 56.48 1wfp s SER 46 Cb 0.00 -0.70 -0.02 0.00 0.21 0.00 0.00 66.02 65.51 1wfp s SER 46 CO 0.00 -0.43 -0.09 -0.89 0.41 0.00 0.00 173.24 172.24 1wfp s THR 47 N -2.44 3.36 0.43 1.44 2.01 -1.26 -0.93 115.64 118.25 1wfp s THR 47 Ca 0.41 -0.54 0.03 0.00 0.31 0.00 0.00 61.69 61.90 1wfp s THR 47 Cb -0.02 -2.45 -0.03 0.00 0.01 0.00 0.00 72.50 70.01 1wfp s THR 47 CO 0.25 0.50 0.07 -0.36 -0.69 0.00 0.00 174.62 174.39 1wfp s PHE 48 N 0.49 1.88 0.27 4.92 0.40 -1.03 -2.10 117.98 122.81 1wfp s PHE 48 Ca -0.07 -1.10 0.06 0.00 -0.60 0.00 0.00 56.93 55.22 1wfp s PHE 48 Cb -0.15 -1.37 -0.02 0.00 0.51 0.00 0.00 43.02 41.99 1wfp s PHE 48 CO 0.04 -0.04 0.39 0.00 0.70 0.00 0.00 175.22 176.31 1wfp h GLY 50 N 1.10 0.00 0.00 0.00 0.00 -1.95 0.78 103.07 103.00 1wfp h GLY 50 Ca -0.50 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 46.77 1wfp h GLY 50 CO 0.59 0.00 -0.36 -0.84 0.00 0.00 0.00 176.54 175.93 1wfp h THR 51 N 0.00 1.45 -0.83 4.70 2.02 -2.01 -3.36 112.91 114.89 1wfp h THR 51 Ca 0.11 -2.23 -0.45 0.00 0.77 0.00 0.00 66.41 64.62 1wfp h THR 51 Cb 1.71 2.88 -0.26 0.00 -1.74 0.00 0.00 68.15 70.74 1wfp h THR 51 CO -0.00 0.49 0.46 1.41 0.37 0.00 0.00 175.52 178.25 1wfp n HIS 52 N -4.57 2.58 0.09 3.16 -0.00 0.67 -4.49 115.22 112.66 1wfp n HIS 52 Ca -0.16 -1.92 -0.05 0.00 -0.00 0.00 0.00 57.72 55.59 1wfp n HIS 52 Cb 0.51 -0.87 0.01 0.00 -0.00 0.00 0.00 29.99 29.64 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 1.13 0.04 -6.79 -0.41 0.11 0.25 -3.39 114.38 105.32 1wfp h ARG 53 Ca 0.53 -0.05 -0.49 0.00 0.10 0.00 0.00 59.98 60.06 1wfp h ARG 53 Cb 2.33 0.01 -0.02 0.00 1.11 0.00 0.00 29.97 33.41 1wfp h ARG 53 CO 0.97 0.85 0.12 0.71 0.10 0.00 0.00 179.97 182.72 1wfp s TYR 54 N -3.15 3.40 -0.01 4.08 2.02 -1.26 -4.88 117.35 117.55 1wfp s TYR 54 Ca -0.01 1.18 -0.25 0.00 -0.37 0.00 0.00 57.07 57.63 1wfp s TYR 54 Cb 0.11 -2.52 -0.19 0.00 -0.40 0.00 0.00 41.96 38.95 1wfp s TYR 54 CO 0.80 0.01 1.28 -1.00 -1.57 0.00 0.00 175.55 175.07 1wfp h PRO 55 N 1.90 0.05 -1.16 -1.71 0.13 -1.87 -2.99 132.00 126.35 1wfp h PRO 55 Ca -0.48 -0.03 0.33 0.00 -0.87 0.00 0.00 66.00 64.96 1wfp h PRO 55 Cb 1.18 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.22 1wfp h PRO 55 CO 0.65 0.52 0.78 1.05 -0.23 0.00 0.00 178.00 180.77 1wfp h GLU 56 N -0.42 0.21 0.00 0.86 4.11 -1.98 0.88 114.58 118.23 1wfp h GLU 56 Ca 0.00 -0.01 -0.19 0.00 0.07 0.00 0.00 59.36 59.24 1wfp h GLU 56 Cb 0.51 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1wfp h GLU 56 CO 0.00 0.14 -0.88 0.77 0.07 0.00 0.00 179.01 179.11 1wfp h SER 57 N 0.21 0.03 -3.35 3.06 0.02 -1.92 -3.43 113.55 108.18 1wfp h SER 57 Ca 0.64 -0.03 -0.57 0.00 -0.84 0.00 0.00 61.79 60.99 1wfp h SER 57 Cb 1.99 -0.01 -0.38 0.00 0.14 0.00 0.00 62.40 64.15 1wfp h SER 57 CO -0.23 0.89 -0.80 -1.38 -1.14 0.00 0.00 176.83 174.17 1wfp s HIS 58 N -3.02 1.90 -0.86 3.45 -3.43 0.30 -5.04 115.29 108.58 1wfp s HIS 58 Ca -0.00 -1.23 -0.20 0.00 -0.80 0.00 0.00 55.06 52.83 1wfp s HIS 58 Cb 0.11 -1.40 -0.22 0.00 -1.43 0.00 0.00 32.58 29.64 1wfp s HIS 58 CO 0.80 -0.65 2.36 0.39 -2.00 0.00 0.00 174.74 175.64 1wfp n GLU 59 N 4.82 0.33 -1.63 -0.38 -0.58 -1.23 -4.55 120.64 117.42 1wfp n GLU 59 Ca -0.13 -0.29 -0.43 0.00 -0.42 0.00 0.00 57.16 55.89 1wfp n GLU 59 Cb 0.47 -2.33 -0.03 0.00 -0.57 0.00 0.00 31.44 28.99 1wfp n GLU 59 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wfp h GLN 61 N 13.94 -0.30 -6.34 0.00 1.08 -1.99 -3.44 115.11 118.06 1wfp h GLN 61 Ca -0.43 0.02 -0.64 0.00 -1.45 0.00 0.00 58.65 56.15 1wfp h GLN 61 Cb 1.24 0.07 0.09 0.00 -0.05 0.00 0.00 27.48 28.82 1wfp h GLN 61 CO 0.96 -0.14 0.15 0.34 -0.95 0.00 0.00 178.83 179.19 1wfp n PHE 62 N -5.19 1.12 -1.86 2.96 7.35 -1.26 -4.84 117.46 115.74 1wfp n PHE 62 Ca -0.09 0.72 -0.42 0.00 -0.76 0.00 0.00 57.45 56.90 1wfp n PHE 62 Cb 0.17 -2.24 -0.03 0.00 0.35 0.00 0.00 39.48 37.73 1wfp n PHE 62 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1wfp s ASP 63 N -0.25 6.51 0.83 -2.13 -1.08 -1.26 -4.95 116.67 114.34 1wfp s ASP 63 Ca 0.68 2.69 -0.12 0.00 -0.52 0.00 0.00 52.55 55.28 1wfp s ASP 63 Cb -0.82 -2.59 0.10 0.00 -1.46 0.00 0.00 42.92 38.15 1wfp s ASP 63 CO 0.55 -0.89 1.19 -0.36 0.52 0.00 0.00 175.17 176.18 1wfp s PHE 64 N 1.46 2.72 0.04 -5.34 0.08 -1.26 -5.00 117.98 110.67 1wfp s PHE 64 Ca 0.73 0.65 -0.25 0.00 0.12 0.00 0.00 56.93 58.18 1wfp s PHE 64 Cb -0.45 -3.57 -0.17 0.00 -0.57 0.00 0.00 43.02 38.25 1wfp s PHE 64 CO 0.32 -1.89 1.51 -0.22 -0.10 0.00 0.00 175.22 174.84 1wfp h LYS 65 N -1.11 -0.06 0.00 0.44 1.63 -2.04 -3.45 116.57 111.97 1wfp h LYS 65 Ca -0.46 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.35 1wfp h LYS 65 Cb 1.31 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.96 1wfp h LYS 65 CO 0.61 0.16 0.00 0.41 -3.45 0.00 0.00 179.45 177.18 1wfp n GLY 66 N -0.54 0.00 1.50 5.01 0.00 -1.26 -5.04 105.19 104.87 1wfp n GLY 66 Ca -0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.81 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 2.48 -3.86 1.61 3.14 -1.26 -4.91 118.33 115.52 1wfp n VAL 67 Ca 0.00 -3.73 -0.30 0.00 -2.96 0.00 0.00 64.34 57.35 1wfp n VAL 67 Cb 0.00 -0.78 -0.14 0.00 -1.06 0.00 0.00 33.84 31.86 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 -3.46 2.79 -0.18 1.55 0.00 -1.26 -5.09 121.76 116.10 1wfp s ALA 68 Ca 0.47 -2.91 -0.15 0.00 0.00 0.00 0.00 51.96 49.37 1wfp s ALA 68 Cb 0.40 -2.03 -0.04 0.00 0.00 0.00 0.00 23.12 21.45 1wfp s ALA 68 CO -0.00 -2.00 0.33 -1.54 0.00 0.00 0.00 175.76 172.56 1wfp s SER 69 N 0.11 6.43 -0.53 0.00 1.04 -1.26 -5.03 113.70 114.46 1wfp s SER 69 Ca 0.16 0.50 0.06 0.00 0.48 0.00 0.00 55.95 57.15 1wfp s SER 69 Cb -0.25 -2.20 0.21 0.00 0.10 0.00 0.00 66.02 63.88 1wfp s SER 69 CO -0.01 0.03 0.51 0.61 0.98 0.00 0.00 173.24 175.35 1wfp n GLY 70 N 3.65 3.34 0.20 7.32 0.00 -1.26 -4.92 105.19 113.52 1wfp n GLY 70 Ca -0.10 -2.00 0.06 0.00 0.00 0.00 0.00 46.02 43.98 1wfp n GLY 70 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wfp h PRO 71 N 4.85 0.00 -6.19 1.61 0.13 -2.05 -3.44 132.00 126.91 1wfp h PRO 71 Ca 0.18 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.74 1wfp h PRO 71 Cb 0.81 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 31.75 1wfp h PRO 71 CO 0.58 0.33 -0.80 -1.54 -0.23 0.00 0.00 178.00 176.33 1wfp s SER 72 N -6.49 2.88 0.94 1.44 1.04 -1.26 -5.13 113.70 107.12 1wfp s SER 72 Ca -0.01 -0.83 -0.10 0.00 0.48 0.00 0.00 55.95 55.49 1wfp s SER 72 Cb 0.12 -0.18 0.16 0.00 0.10 0.00 0.00 66.02 66.22 1wfp s SER 72 CO 0.68 0.03 1.13 -1.20 0.98 0.00 0.00 173.24 174.86 1wfp n SER 73 N 0.44 0.18 0.00 7.02 7.64 -1.26 -5.20 113.62 122.43 1wfp n SER 73 Ca -0.14 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.12 1wfp n SER 73 Cb 0.56 -1.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.30 1wfp n SER 73 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64