#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wh4 n LYS 3 N 0.00 -2.13 -1.71 0.54 4.81 -1.26 -4.94 118.16 113.47 2wh4 n LYS 3 Ca 0.00 1.89 -0.38 0.00 -0.87 0.00 0.00 58.31 58.95 2wh4 n LYS 3 Cb 0.00 -3.45 0.06 0.00 0.02 0.00 0.00 35.03 31.66 2wh4 n LYS 3 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 2wh4 n MET 4 N 0.52 1.19 -3.75 1.64 2.81 -1.26 -5.00 117.12 113.27 2wh4 n MET 4 Ca -0.05 0.46 -0.33 0.00 -1.81 0.00 0.00 57.70 55.96 2wh4 n MET 4 Cb 0.08 -2.46 -0.05 0.00 -0.71 0.00 0.00 33.22 30.08 2wh4 n MET 4 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2wh4 s LYS 5 N -3.13 3.58 0.07 0.03 1.02 -1.26 -4.86 119.74 115.18 2wh4 s LYS 5 Ca 0.79 -0.13 -0.30 0.00 0.02 0.00 0.00 55.97 56.35 2wh4 s LYS 5 Cb -0.40 -3.00 -0.05 0.00 -0.52 0.00 0.00 37.83 33.86 2wh4 s LYS 5 CO 0.44 0.59 0.99 0.95 -0.92 0.00 0.00 175.35 177.39 2wh4 s THR 6 N -1.44 4.59 -0.62 2.17 -4.23 -1.26 -4.90 115.64 109.95 2wh4 s THR 6 Ca 0.33 2.01 -0.26 0.00 -1.18 0.00 0.00 61.69 62.58 2wh4 s THR 6 Cb -0.13 -4.29 -0.03 0.00 1.34 0.00 0.00 72.50 69.40 2wh4 s THR 6 CO 0.21 0.24 1.90 -2.28 -0.54 0.00 0.00 174.62 174.15 2wh4 s HIS 7 N 0.44 1.63 0.17 3.99 2.46 -0.84 -4.87 115.29 118.27 2wh4 s HIS 7 Ca 0.50 0.83 -0.15 0.00 0.47 0.00 0.00 55.06 56.71 2wh4 s HIS 7 Cb -0.23 -4.05 0.13 0.00 -0.13 0.00 0.00 32.58 28.30 2wh4 s HIS 7 CO 0.29 -2.29 1.72 0.87 -2.47 0.00 0.00 174.74 172.86 2wh4 h LYS 8 N 15.05 0.20 -1.00 2.88 1.79 -1.92 -0.89 116.57 132.68 2wh4 h LYS 8 Ca -0.24 -0.01 0.26 0.00 -2.18 0.00 0.00 60.65 58.48 2wh4 h LYS 8 Cb 1.16 -0.04 -0.07 0.00 -1.58 0.00 0.00 32.23 31.69 2wh4 h LYS 8 CO 1.21 0.13 0.67 0.78 -1.08 0.00 0.00 179.45 181.17 2wh4 h GLY 9 N 0.20 0.75 0.22 3.86 0.00 -1.95 0.86 103.07 107.02 2wh4 h GLY 9 Ca 0.21 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 2wh4 h GLY 9 CO -0.28 -0.06 -0.06 0.00 0.00 0.00 0.00 176.54 176.14 2wh4 h ALA 10 N 1.58 -0.18 -0.82 3.60 0.00 -1.58 -3.26 119.26 118.59 2wh4 h ALA 10 Ca 0.53 -0.20 0.20 0.00 0.00 0.00 0.00 54.91 55.44 2wh4 h ALA 10 Cb 1.55 0.07 -0.13 0.00 0.00 0.00 0.00 17.79 19.28 2wh4 h ALA 10 CO -0.18 -0.21 0.23 -0.22 0.00 0.00 0.00 179.25 178.87 2wh4 h LYS 11 N -0.96 0.26 0.00 0.00 3.64 -0.45 0.34 116.57 119.41 2wh4 h LYS 11 Ca -0.02 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2wh4 h LYS 11 Cb 0.46 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 2wh4 h LYS 11 CO 0.03 0.17 0.00 1.63 -2.27 0.00 0.00 179.45 179.01 2wh4 n LYS 12 N -5.17 0.26 -0.55 1.90 5.02 0.29 -3.61 118.16 116.30 2wh4 n LYS 12 Ca 0.18 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.46 2wh4 n LYS 12 Cb 0.58 -1.19 -0.02 0.00 -0.02 0.00 0.00 35.03 34.38 2wh4 n LYS 12 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 2wh4 n ARG 13 N -0.69 0.00 -3.64 1.97 1.85 0.12 -5.02 116.66 111.24 2wh4 n ARG 13 Ca 0.02 -0.23 -0.11 0.00 -1.00 0.00 0.00 57.85 56.54 2wh4 n ARG 13 Cb 0.01 0.14 -0.07 0.00 -1.05 0.00 0.00 32.46 31.49 2wh4 n ARG 13 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2wh4 s VAL 14 N 0.00 -0.00 0.37 8.89 0.11 -0.90 -4.72 120.40 124.15 2wh4 s VAL 14 Ca 0.00 0.00 0.07 0.00 -2.93 0.00 0.00 61.98 59.12 2wh4 s VAL 14 Cb 0.00 -0.99 -0.01 0.00 -1.53 0.00 0.00 36.38 33.85 2wh4 s VAL 14 CO 0.00 0.00 0.44 -0.54 -3.33 0.00 0.00 175.10 171.67 2wh4 s LYS 15 N 1.00 2.85 -0.20 1.54 1.02 -0.91 -4.70 119.74 120.34 2wh4 s LYS 15 Ca -0.05 -1.23 -0.03 0.00 0.02 0.00 0.00 55.97 54.68 2wh4 s LYS 15 Cb -0.05 -2.65 0.06 0.00 -0.52 0.00 0.00 37.83 34.67 2wh4 s LYS 15 CO -0.09 -0.06 0.05 -1.50 -0.92 0.00 0.00 175.35 172.82 2wh4 s ILE 16 N -2.30 0.43 1.20 2.17 2.07 -1.26 -2.12 121.20 121.40 2wh4 s ILE 16 Ca 0.47 -0.55 -0.17 0.00 -1.41 0.00 0.00 60.65 58.99 2wh4 s ILE 16 Cb -0.08 -1.00 0.29 0.00 0.13 0.00 0.00 42.46 41.80 2wh4 s ILE 16 CO 0.30 -0.26 1.04 0.42 -1.91 0.00 0.00 174.94 174.53 2wh4 s THR 17 N 1.89 1.69 0.13 4.00 -4.23 0.12 -4.81 115.64 114.44 2wh4 s THR 17 Ca 0.00 0.00 -0.18 0.00 -1.18 0.00 0.00 61.69 60.33 2wh4 s THR 17 Cb -0.17 -2.30 -0.03 0.00 1.34 0.00 0.00 72.50 71.34 2wh4 s THR 17 CO -0.10 0.00 1.76 0.00 -0.54 0.00 0.00 174.62 175.74 2wh4 h ALA 18 N -2.65 0.38 0.00 3.99 0.00 -2.01 -0.35 119.26 118.63 2wh4 h ALA 18 Ca -0.51 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2wh4 h ALA 18 Cb 1.32 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2wh4 h ALA 18 CO 0.42 -0.11 0.00 0.43 0.00 0.00 0.00 179.25 179.99 2wh4 n SER 19 N -4.84 0.00 -0.38 0.00 7.64 -1.26 -4.83 113.62 109.95 2wh4 n SER 19 Ca -0.02 0.50 0.00 0.00 1.01 0.00 0.00 58.87 60.37 2wh4 n SER 19 Cb 0.05 -0.50 0.00 0.00 -1.01 0.00 0.00 64.21 62.75 2wh4 n SER 19 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wh4 n GLY 20 N -0.20 0.96 3.81 0.23 0.00 -0.14 -5.08 105.19 104.78 2wh4 n GLY 20 Ca 0.03 -0.51 -0.28 0.00 0.00 0.00 0.00 46.02 45.26 2wh4 n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wh4 s LYS 21 N -3.75 2.98 -0.24 1.61 1.02 -1.26 -4.86 119.74 115.24 2wh4 s LYS 21 Ca 0.00 -0.77 -0.06 0.00 0.02 0.00 0.00 55.97 55.15 2wh4 s LYS 21 Cb 0.00 -2.72 -0.02 0.00 -0.52 0.00 0.00 37.83 34.57 2wh4 s LYS 21 CO 0.00 0.52 0.04 0.08 -0.92 0.00 0.00 175.35 175.07 2wh4 s VAL 22 N -1.64 4.11 -0.20 3.17 1.01 -1.26 -0.70 120.40 124.89 2wh4 s VAL 22 Ca 0.31 -0.24 -0.05 0.00 0.00 0.00 0.00 61.98 62.00 2wh4 s VAL 22 Cb -0.11 -2.91 -0.02 0.00 0.00 0.00 0.00 36.38 33.34 2wh4 s VAL 22 CO 0.24 0.37 -0.01 -0.69 0.00 0.00 0.00 175.10 175.01 2wh4 s VAL 23 N 1.49 3.89 0.30 2.92 1.01 -0.90 -2.15 120.40 126.96 2wh4 s VAL 23 Ca 0.06 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.70 2wh4 s VAL 23 Cb -0.15 -2.75 -0.00 0.00 0.00 0.00 0.00 36.38 33.48 2wh4 s VAL 23 CO 0.02 0.44 0.02 0.00 0.00 0.00 0.00 175.10 175.57 2wh4 n ALA 24 N 4.20 0.28 -3.00 5.51 0.00 -0.53 -2.14 120.51 124.83 2wh4 n ALA 24 Ca -0.17 -1.38 -0.36 0.00 0.00 0.00 0.00 53.44 51.53 2wh4 n ALA 24 Cb 0.52 0.78 -0.12 0.00 0.00 0.00 0.00 19.45 20.63 2wh4 n ALA 24 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2wh4 s MET 25 N -3.09 3.72 -0.01 0.00 -1.94 -1.26 -0.09 119.30 116.63 2wh4 s MET 25 Ca 0.02 -0.45 -0.37 0.00 -1.71 0.00 0.00 55.69 53.18 2wh4 s MET 25 Cb 0.00 -3.28 -0.18 0.00 2.01 0.00 0.00 34.83 33.38 2wh4 s MET 25 CO 0.02 -0.08 0.99 1.63 -0.01 0.00 0.00 175.02 177.57 2wh4 n LYS 26 N 4.58 0.00 -2.06 2.03 4.76 -1.24 -4.91 118.16 121.32 2wh4 n LYS 26 Ca -0.16 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 54.98 2wh4 n LYS 26 Cb 0.52 -1.37 0.02 0.00 -1.84 0.00 0.00 35.03 32.35 2wh4 n LYS 26 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2wh4 s THR 27 N 0.04 4.45 -0.17 -0.18 -4.23 -1.26 -4.72 115.64 109.56 2wh4 s THR 27 Ca 0.84 0.61 -0.03 0.00 -1.18 0.00 0.00 61.69 61.93 2wh4 s THR 27 Cb -1.17 -3.77 0.00 0.00 1.34 0.00 0.00 72.50 68.91 2wh4 s THR 27 CO 0.53 -0.94 0.19 0.61 -0.54 0.00 0.00 174.62 174.46 2wh4 n GLY 28 N -2.69 -0.74 0.00 3.99 0.00 -1.26 -4.99 105.19 99.50 2wh4 n GLY 28 Ca 0.05 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.23 2wh4 n GLY 28 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2wh4 n LYS 29 N -0.81 0.00 -1.09 1.61 4.81 -1.26 -4.95 118.16 116.47 2wh4 n LYS 29 Ca 0.02 0.00 -0.22 0.00 -0.87 0.00 0.00 58.31 57.24 2wh4 n LYS 29 Cb 0.30 0.00 0.14 0.00 0.02 0.00 0.00 35.03 35.50 2wh4 n LYS 29 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 2wh4 n ARG 30 N 0.00 2.14 0.00 1.64 0.00 -1.26 -4.77 116.66 114.41 2wh4 n ARG 30 Ca 0.00 -2.64 0.00 0.00 -0.00 0.00 0.00 57.85 55.21 2wh4 n ARG 30 Cb 0.00 -2.03 0.00 0.00 0.00 0.00 0.00 32.46 30.43 2wh4 n ARG 30 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 2wh4 n HIS 31 N -0.87 0.00 0.08 -0.14 -0.00 -1.26 -4.93 115.22 108.10 2wh4 n HIS 31 Ca 0.52 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.70 2wh4 n HIS 31 Cb 1.37 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 31.24 2wh4 n HIS 31 CO 0.00 0.00 0.00 1.47 0.46 0.00 0.00 176.34 178.27 2wh4 n LEU 32 N 0.00 0.00 -4.28 0.27 -0.00 -1.26 -4.40 117.00 107.33 2wh4 n LEU 32 Ca 0.00 0.12 -0.38 0.00 -0.00 0.00 0.00 56.01 55.75 2wh4 n LEU 32 Cb 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 43.44 2wh4 n LEU 32 CO 0.00 -0.12 -0.54 -3.20 -0.00 0.00 0.00 177.39 173.52 2wh4 n ASN 33 N -1.32 -3.28 0.00 1.45 4.05 -1.26 -4.64 115.26 110.26 2wh4 n ASN 33 Ca 0.00 0.60 0.00 0.00 0.45 0.00 0.00 54.58 55.63 2wh4 n ASN 33 Cb 0.60 -0.93 0.00 0.00 1.23 0.00 0.00 39.78 40.68 2wh4 n ASN 33 CO 0.00 0.00 0.00 1.87 -3.05 0.00 0.00 177.26 176.08 2wh4 n TRP 34 N -1.76 0.00 -3.82 1.20 -0.00 -1.26 -4.99 117.44 106.81 2wh4 n TRP 34 Ca 0.07 0.00 -0.29 0.00 -0.00 0.00 0.00 57.50 57.29 2wh4 n TRP 34 Cb 0.49 0.00 -0.13 0.00 -0.00 0.00 0.00 31.31 31.67 2wh4 n TRP 34 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 177.69 176.55 2wh4 s GLN 35 N 0.00 1.93 -0.03 5.87 0.74 -1.26 -5.02 119.66 121.89 2wh4 s GLN 35 Ca 0.00 -2.75 0.03 0.00 0.05 0.00 0.00 55.36 52.69 2wh4 s GLN 35 Cb 0.00 -2.95 -0.00 0.00 1.10 0.00 0.00 33.01 31.16 2wh4 s GLN 35 CO 0.00 -1.23 -0.11 0.15 -0.55 0.00 0.00 175.29 173.55 2wh4 s LYS 36 N -0.62 1.11 0.94 1.67 1.02 -1.26 -5.13 119.74 117.47 2wh4 s LYS 36 Ca 0.22 -0.39 -0.16 0.00 0.02 0.00 0.00 55.97 55.66 2wh4 s LYS 36 Cb -0.13 -1.03 -0.14 0.00 -0.52 0.00 0.00 37.83 36.01 2wh4 s LYS 36 CO -0.09 0.17 -0.78 -1.13 -0.92 0.00 0.00 175.35 172.59 2wh4 n SER 37 N 3.15 -5.61 -0.10 2.83 3.41 -1.26 -4.64 113.62 111.41 2wh4 n SER 37 Ca -0.17 0.16 -0.09 0.00 -0.26 0.00 0.00 58.87 58.51 2wh4 n SER 37 Cb 0.54 -0.71 -0.02 0.00 -0.26 0.00 0.00 64.21 63.77 2wh4 n SER 37 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2wh4 h GLY 38 N -0.94 0.49 0.07 5.00 0.00 -2.00 -2.15 103.07 103.54 2wh4 h GLY 38 Ca -0.41 -0.24 0.12 0.00 0.00 0.00 0.00 47.33 46.79 2wh4 h GLY 38 CO 0.22 0.23 0.07 1.70 0.00 0.00 0.00 176.54 178.76 2wh4 h LYS 39 N 0.38 0.18 0.00 4.80 3.64 -1.95 0.12 116.57 123.74 2wh4 h LYS 39 Ca 0.11 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2wh4 h LYS 39 Cb 0.12 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 2wh4 h LYS 39 CO -0.01 0.12 0.00 0.39 -2.27 0.00 0.00 179.45 177.68 2wh4 n GLU 40 N -5.20 0.00 -0.16 1.90 -0.58 -0.82 -1.02 120.64 114.76 2wh4 n GLU 40 Ca 0.09 0.43 -0.09 0.00 -0.42 0.00 0.00 57.16 57.17 2wh4 n GLU 40 Cb 0.34 -0.96 0.00 0.00 -0.57 0.00 0.00 31.44 30.25 2wh4 n GLU 40 CO 0.00 0.00 0.00 -0.84 -0.48 0.00 0.00 177.13 175.81 2wh4 h ILE 41 N 0.00 1.23 0.00 -3.67 3.07 -1.48 -2.63 117.51 114.02 2wh4 h ILE 41 Ca 0.00 -0.77 0.00 0.00 1.55 0.00 0.00 64.86 65.64 2wh4 h ILE 41 Cb 0.00 0.85 0.00 0.00 -0.27 0.00 0.00 36.82 37.40 2wh4 h ILE 41 CO 0.00 0.28 0.15 -0.09 -1.05 0.00 0.00 178.15 177.44 2wh4 h ARG 42 N 0.62 0.00 -2.41 0.16 1.12 -0.67 -2.90 114.38 110.29 2wh4 h ARG 42 Ca 0.15 0.00 -0.80 0.00 -1.11 0.00 0.00 59.98 58.22 2wh4 h ARG 42 Cb 0.28 0.00 -0.28 0.00 -0.01 0.00 0.00 29.97 29.96 2wh4 h ARG 42 CO -0.00 0.00 0.92 0.94 -3.11 0.00 0.00 179.97 178.71 2wh4 n GLN 43 N -2.21 5.14 -3.41 0.20 7.27 -0.18 -4.79 117.38 119.39 2wh4 n GLN 43 Ca -0.01 -4.65 -0.27 0.00 0.07 0.00 0.00 57.00 52.14 2wh4 n GLN 43 Cb 0.18 -2.47 -0.10 0.00 2.41 0.00 0.00 30.24 30.27 2wh4 n GLN 43 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 2wh4 n LYS 44 N 0.27 0.58 -4.39 3.69 4.01 -1.10 -4.98 118.16 116.25 2wh4 n LYS 44 Ca 0.41 -3.40 -0.28 0.00 -0.51 0.00 0.00 58.31 54.53 2wh4 n LYS 44 Cb 0.28 -1.67 -0.07 0.00 -0.51 0.00 0.00 35.03 33.05 2wh4 n LYS 44 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 2wh4 s GLY 45 N -0.48 2.57 1.13 0.72 0.00 -1.26 -4.82 107.32 105.17 2wh4 s GLY 45 Ca 0.33 -1.60 -0.18 0.00 0.00 0.00 0.00 44.72 43.27 2wh4 s GLY 45 CO -0.17 -2.04 0.20 0.54 0.00 0.00 0.00 173.10 171.63 2wh4 n ARG 46 N -1.24 -2.14 -3.84 2.90 1.74 -1.26 -3.58 116.66 109.23 2wh4 n ARG 46 Ca -0.07 -0.62 -0.07 0.00 -0.77 0.00 0.00 57.85 56.32 2wh4 n ARG 46 Cb 0.66 -1.67 -0.01 0.00 -1.02 0.00 0.00 32.46 30.41 2wh4 n ARG 46 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 2wh4 s LYS 47 N -3.62 1.81 -0.26 5.56 -2.85 0.87 -4.77 119.74 116.49 2wh4 s LYS 47 Ca 0.52 -1.04 -0.10 0.00 -1.00 0.00 0.00 55.97 54.35 2wh4 s LYS 47 Cb -0.11 0.59 -0.05 0.00 -2.06 0.00 0.00 37.83 36.21 2wh4 s LYS 47 CO 0.56 -0.83 0.15 -0.06 0.10 0.00 0.00 175.35 175.27 2wh4 s PHE 48 N -3.58 3.22 0.33 1.78 0.08 -1.26 -1.46 117.98 117.09 2wh4 s PHE 48 Ca 0.12 0.04 -0.10 0.00 0.12 0.00 0.00 56.93 57.11 2wh4 s PHE 48 Cb -0.05 -2.30 -0.07 0.00 -0.57 0.00 0.00 43.02 40.03 2wh4 s PHE 48 CO 0.07 -0.12 0.67 0.08 -0.10 0.00 0.00 175.22 175.83 2wh4 s VAL 49 N 1.45 4.84 -0.02 -0.44 1.01 -0.91 -5.00 120.40 121.32 2wh4 s VAL 49 Ca 0.07 0.55 -0.05 0.00 0.00 0.00 0.00 61.98 62.55 2wh4 s VAL 49 Cb -0.15 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.55 2wh4 s VAL 49 CO 0.07 -0.31 0.10 -0.22 0.00 0.00 0.00 175.10 174.74 2wh4 s LEU 50 N -3.38 1.65 0.00 3.92 2.96 -1.26 -4.58 118.68 117.98 2wh4 s LEU 50 Ca 0.50 -0.03 0.00 0.00 -0.22 0.00 0.00 54.13 54.37 2wh4 s LEU 50 Cb -0.11 0.46 0.00 0.00 0.50 0.00 0.00 46.19 47.04 2wh4 s LEU 50 CO 0.26 -0.20 0.00 0.00 -1.32 0.00 0.00 176.35 175.09 2wh4 n ALA 51 N 2.24 0.00 0.00 5.97 0.00 -1.26 -4.50 120.51 122.96 2wh4 n ALA 51 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2wh4 n ALA 51 Cb 0.57 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.89 2wh4 n ALA 51 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2wh4 n LYS 52 N -0.81 3.59 0.17 0.00 3.00 -1.26 -4.61 118.16 118.24 2wh4 n LYS 52 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 58.31 58.33 2wh4 n LYS 52 Cb 0.20 -0.97 0.32 0.00 0.00 0.00 0.00 35.03 34.58 2wh4 n LYS 52 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 2wh4 h PRO 53 N 0.00 0.00 -0.32 1.64 0.13 -1.83 0.19 132.00 131.81 2wh4 h PRO 53 Ca 0.00 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 65.22 2wh4 h PRO 53 Cb 0.94 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.06 2wh4 h PRO 53 CO 0.00 0.43 0.56 0.93 -0.23 0.00 0.00 178.00 179.69 2wh4 h GLU 54 N 0.00 0.00 0.00 0.86 5.08 -1.93 0.57 114.58 119.16 2wh4 h GLU 54 Ca -0.00 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 2wh4 h GLU 54 Cb 0.80 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 2wh4 h GLU 54 CO 0.06 0.00 -1.00 0.00 -1.00 0.00 0.00 179.01 177.07 2wh4 n ALA 55 N -2.11 0.74 -0.33 3.43 0.00 -0.15 -3.75 120.51 118.34 2wh4 n ALA 55 Ca 0.06 -0.66 0.14 0.00 0.00 0.00 0.00 53.44 52.98 2wh4 n ALA 55 Cb 0.70 -0.02 0.28 0.00 0.00 0.00 0.00 19.45 20.41 2wh4 n ALA 55 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2wh4 n GLU 56 N -4.50 -0.08 0.04 0.00 4.07 0.48 -0.53 120.64 120.13 2wh4 n GLU 56 Ca -0.17 1.43 -0.13 0.00 -0.06 0.00 0.00 57.16 58.23 2wh4 n GLU 56 Cb 0.48 -2.27 -0.09 0.00 -0.06 0.00 0.00 31.44 29.50 2wh4 n GLU 56 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2wh4 h ARG 57 N 0.00 -0.11 -1.19 5.31 3.08 -0.16 -2.69 114.38 118.61 2wh4 h ARG 57 Ca 0.58 0.01 0.35 0.00 0.07 0.00 0.00 59.98 60.98 2wh4 h ARG 57 Cb 1.19 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 31.22 2wh4 h ARG 57 CO -0.90 0.28 1.04 0.82 -1.07 0.00 0.00 179.97 180.15 2wh4 h ILE 58 N -0.52 0.17 0.00 2.04 1.08 -0.90 1.32 117.51 120.70 2wh4 h ILE 58 Ca -0.01 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.46 2wh4 h ILE 58 Cb 0.44 0.22 0.00 0.00 -3.07 0.00 0.00 36.82 34.41 2wh4 h ILE 58 CO 0.02 0.00 0.00 0.29 -0.69 0.00 0.00 178.15 177.77 2wh4 n LYS 59 N -3.72 0.16 -2.93 2.37 5.02 -0.81 -3.84 118.16 114.41 2wh4 n LYS 59 Ca 0.26 0.02 -0.24 0.00 -2.02 0.00 0.00 58.31 56.33 2wh4 n LYS 59 Cb 1.42 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.90 2wh4 n LYS 59 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2wh4 n LEU 60 N -1.42 3.45 0.00 -0.35 4.77 0.45 -1.98 117.00 121.93 2wh4 n LEU 60 Ca 0.09 -5.36 0.00 0.00 -0.03 0.00 0.00 56.01 50.72 2wh4 n LEU 60 Cb 0.29 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 2wh4 n LEU 60 CO 0.24 2.29 0.00 0.00 -1.33 0.00 0.00 177.39 178.59 2wh4 n LEU 61 N -0.14 0.00 -0.30 2.23 -0.00 -1.25 -3.01 117.00 114.53 2wh4 n LEU 61 Ca 0.29 0.00 0.10 0.00 -0.00 0.00 0.00 56.01 56.41 2wh4 n LEU 61 Cb 0.51 0.00 0.27 0.00 -0.00 0.00 0.00 43.42 44.20 2wh4 n LEU 61 CO 0.30 0.00 1.07 -0.07 -0.00 0.00 0.00 177.39 178.70 2wh4 h LEU 62 N 0.00 0.43 -1.97 1.47 3.38 -1.95 0.41 115.31 117.08 2wh4 h LEU 62 Ca 0.00 0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.12 2wh4 h LEU 62 Cb 0.00 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 2wh4 h LEU 62 CO 0.00 0.11 0.37 1.55 0.09 0.00 0.00 178.44 180.56 2wh4 h PRO 63 N 0.51 0.00 -1.77 1.13 0.13 -1.97 -3.46 132.00 126.57 2wh4 h PRO 63 Ca 0.51 0.00 0.19 0.00 -0.87 0.00 0.00 66.00 65.84 2wh4 h PRO 63 Cb 0.86 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.94 2wh4 h PRO 63 CO -0.45 0.00 -0.31 0.66 -0.23 0.00 0.00 178.00 177.67 2wh4 n TYR 64 N -3.10 -1.83 0.00 1.56 4.02 0.14 -5.16 117.16 112.79 2wh4 n TYR 64 Ca 0.00 0.93 0.00 0.00 -0.01 0.00 0.00 57.90 58.82 2wh4 n TYR 64 Cb 0.45 -1.66 0.00 0.00 -0.02 0.00 0.00 39.34 38.10 2wh4 n TYR 64 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94