#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2knf n ASN -3 N 0.00 1.43 -0.60 4.04 5.15 -1.26 -4.93 115.26 119.10 2knf n ASN -3 Ca 0.00 -1.14 -0.08 0.00 -0.60 0.00 0.00 54.58 52.76 2knf n ASN -3 Cb 0.00 0.33 -0.03 0.00 -0.53 0.00 0.00 39.78 39.55 2knf n ASN -3 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2knf n ALA -2 N -0.46 -0.12 -2.58 5.20 0.00 -1.26 -4.89 120.51 116.39 2knf n ALA -2 Ca 0.10 0.13 -0.41 0.00 0.00 0.00 0.00 53.44 53.26 2knf n ALA -2 Cb 0.40 -1.32 0.02 0.00 0.00 0.00 0.00 19.45 18.54 2knf n ALA -2 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2knf n ASP -1 N -0.49 7.39 -3.73 0.00 2.03 -1.26 -3.20 116.55 117.29 2knf n ASP -1 Ca -0.08 -3.69 -0.13 0.00 0.52 0.00 0.00 54.79 51.42 2knf n ASP -1 Cb 0.41 -1.17 -0.08 0.00 -0.72 0.00 0.00 41.12 39.57 2knf n ASP -1 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2knf s MET 2 N -1.95 3.47 -0.39 0.00 0.23 0.28 -4.15 119.30 116.79 2knf s MET 2 Ca -0.09 -0.50 -0.02 0.00 -1.03 0.00 0.00 55.69 54.06 2knf s MET 2 Cb -0.03 -2.77 0.10 0.00 -1.53 0.00 0.00 34.83 30.61 2knf s MET 2 CO 0.01 0.29 0.17 -0.06 -2.03 0.00 0.00 175.02 173.39 2knf s PHE 3 N -2.14 3.60 0.00 3.16 0.40 -1.26 0.16 117.98 121.90 2knf s PHE 3 Ca 0.38 -2.47 0.00 0.00 -0.60 0.00 0.00 56.93 54.23 2knf s PHE 3 Cb -0.10 -3.11 0.00 0.00 0.51 0.00 0.00 43.02 40.32 2knf s PHE 3 CO 0.33 -0.96 0.00 0.41 0.70 0.00 0.00 175.22 175.70 2knf n GLY 4 N 4.54 1.90 0.19 4.36 0.00 -1.26 -3.30 105.19 111.63 2knf n GLY 4 Ca -0.02 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.69 2knf n GLY 4 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2knf h ASN 5 N 0.00 0.00 0.00 1.61 2.35 -1.91 -3.46 115.58 114.17 2knf h ASN 5 Ca 0.00 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2knf h ASN 5 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 2knf h ASN 5 CO 0.00 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.39 2knf n GLY 6 N 1.13 1.26 0.08 2.83 0.00 -1.21 -1.85 105.19 107.43 2knf n GLY 6 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 2knf n GLY 6 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2knf h LYS 7 N 0.82 -0.08 -0.94 1.61 1.57 -1.73 -2.41 116.57 115.40 2knf h LYS 7 Ca 0.00 0.01 -0.39 0.00 -1.87 0.00 0.00 60.65 58.39 2knf h LYS 7 Cb 0.00 0.02 -0.24 0.00 0.08 0.00 0.00 32.23 32.09 2knf h LYS 7 CO 0.00 0.26 0.50 0.41 -0.57 0.00 0.00 179.45 180.05 2knf n GLY 8 N -0.19 4.02 3.56 3.86 0.00 -1.26 -4.72 105.19 110.47 2knf n GLY 8 Ca -0.08 -0.95 -0.40 0.00 0.00 0.00 0.00 46.02 44.59 2knf n GLY 8 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2knf s TYR 9 N -2.90 1.72 -0.56 1.61 5.04 -1.03 -4.49 117.35 116.74 2knf s TYR 9 Ca 0.51 0.76 0.01 0.00 -2.44 0.00 0.00 57.07 55.91 2knf s TYR 9 Cb 0.42 -4.10 0.45 0.00 0.35 0.00 0.00 41.96 39.08 2knf s TYR 9 CO 0.11 -2.43 1.76 0.54 -1.34 0.00 0.00 175.55 174.19 2knf n ARG 10 N 8.97 2.99 0.00 4.97 5.12 -1.26 -4.84 116.66 132.61 2knf n ARG 10 Ca 0.21 -3.59 0.00 0.00 -1.93 0.00 0.00 57.85 52.54 2knf n ARG 10 Cb 0.51 -2.29 0.00 0.00 -1.16 0.00 0.00 32.46 29.52 2knf n ARG 10 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2knf n GLY 11 N -0.83 1.08 0.76 -0.13 0.00 -1.19 -4.74 105.19 100.12 2knf n GLY 11 Ca 0.56 -1.77 -0.01 0.00 0.00 0.00 0.00 46.02 44.81 2knf n GLY 11 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2knf n LYS 12 N 0.00 0.00 -2.19 1.61 0.00 -1.26 -4.82 118.16 111.49 2knf n LYS 12 Ca 0.00 -0.80 -0.41 0.00 -0.00 0.00 0.00 58.31 57.10 2knf n LYS 12 Cb 0.00 -0.04 -0.03 0.00 -0.00 0.00 0.00 35.03 34.96 2knf n LYS 12 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2knf s ARG 13 N 0.00 4.39 -0.19 -1.58 1.81 -1.26 -4.85 118.95 117.26 2knf s ARG 13 Ca 0.05 2.10 0.22 0.00 -1.72 0.00 0.00 55.73 56.38 2knf s ARG 13 Cb 0.06 -3.16 0.48 0.00 -0.45 0.00 0.00 34.95 31.88 2knf s ARG 13 CO -0.03 -0.23 1.14 1.33 -0.68 0.00 0.00 175.30 176.84 2knf n VAL 14 N 2.12 1.11 -3.71 3.52 0.24 -1.26 0.43 118.33 120.79 2knf n VAL 14 Ca 0.04 -2.57 -0.11 0.00 -2.04 0.00 0.00 64.34 59.66 2knf n VAL 14 Cb 0.42 0.90 -0.10 0.00 -1.47 0.00 0.00 33.84 33.59 2knf n VAL 14 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2knf s THR 15 N -2.87 -0.02 0.07 3.34 2.01 -1.26 -0.87 115.64 116.04 2knf s THR 15 Ca 0.32 0.06 -0.01 0.00 0.31 0.00 0.00 61.69 62.37 2knf s THR 15 Cb 0.35 -0.61 0.02 0.00 0.01 0.00 0.00 72.50 72.27 2knf s THR 15 CO -0.07 0.02 0.07 0.35 -0.69 0.00 0.00 174.62 174.31 2knf n THR 16 N 3.78 0.00 0.30 -0.82 -2.24 0.39 -3.64 114.28 112.06 2knf n THR 16 Ca -0.20 -0.04 0.18 0.00 -2.27 0.00 0.00 64.05 61.72 2knf n THR 16 Cb 0.56 -1.37 0.93 0.00 -2.10 0.00 0.00 70.33 68.35 2knf n THR 16 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 2knf h VAL 17 N -1.38 0.19 0.00 2.28 -1.51 0.14 0.80 116.25 116.77 2knf h VAL 17 Ca -0.03 -0.28 0.00 0.00 -1.23 0.00 0.00 66.70 65.17 2knf h VAL 17 Cb 0.08 1.22 0.00 0.00 -2.13 0.00 0.00 31.29 30.46 2knf h VAL 17 CO 0.02 0.03 -0.70 0.35 -1.23 0.00 0.00 177.57 176.04 2knf n THR 18 N -3.29 0.03 -0.85 7.19 -2.24 -1.26 -4.92 114.28 108.94 2knf n THR 18 Ca -0.02 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 2knf n THR 18 Cb 0.18 0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.82 2knf n THR 18 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2knf n GLY 19 N 1.48 0.55 3.67 3.38 0.00 0.27 -5.02 105.19 109.52 2knf n GLY 19 Ca 0.05 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 2knf n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2knf s THR 20 N -2.00 3.91 0.20 2.61 2.01 -1.26 -4.44 115.64 116.67 2knf s THR 20 Ca 0.00 1.15 -0.32 0.00 0.31 0.00 0.00 61.69 62.83 2knf s THR 20 Cb 0.00 -3.74 -0.15 0.00 0.01 0.00 0.00 72.50 68.62 2knf s THR 20 CO 0.00 -0.08 1.26 -2.65 -0.69 0.00 0.00 174.62 172.46 2knf n PRO 21 N 6.51 1.52 -2.54 4.92 -0.02 -1.26 -0.46 135.00 143.67 2knf n PRO 21 Ca 0.15 0.54 -0.39 0.00 -2.02 0.00 0.00 63.50 61.78 2knf n PRO 21 Cb 0.44 -2.10 -0.05 0.00 -0.02 0.00 0.00 33.50 31.77 2knf n PRO 21 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2knf s GLN 23 N -1.71 1.56 -0.05 0.00 0.74 0.40 -4.66 119.66 115.94 2knf s GLN 23 Ca 0.48 0.64 -0.30 0.00 0.05 0.00 0.00 55.36 56.23 2knf s GLN 23 Cb -0.28 -1.86 -0.03 0.00 1.10 0.00 0.00 33.01 31.94 2knf s GLN 23 CO 0.36 -1.98 1.15 -0.51 -0.55 0.00 0.00 175.29 173.75 2knf s ASP 24 N -3.74 7.12 0.54 6.67 1.01 -1.26 -4.34 116.67 122.67 2knf s ASP 24 Ca 0.62 1.77 0.26 0.00 0.71 0.00 0.00 52.55 55.91 2knf s ASP 24 Cb -0.16 -2.56 1.42 0.00 1.01 0.00 0.00 42.92 42.63 2knf s ASP 24 CO 0.55 -0.52 2.00 -0.50 0.21 0.00 0.00 175.17 176.91 2knf h TRP 25 N 7.26 0.00 0.00 4.23 4.06 -1.22 0.30 115.95 130.58 2knf h TRP 25 Ca -0.35 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.56 2knf h TRP 25 Cb 1.17 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.32 2knf h TRP 25 CO 0.72 0.00 -0.20 0.00 -3.56 0.00 0.00 178.44 175.40 2knf h ALA 26 N 1.72 0.91 -2.78 1.49 0.00 -1.88 -3.37 119.26 115.34 2knf h ALA 26 Ca 0.24 -0.18 -0.59 0.00 0.00 0.00 0.00 54.91 54.37 2knf h ALA 26 Cb 0.99 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 2knf h ALA 26 CO -0.00 0.25 -0.40 0.00 0.00 0.00 0.00 179.25 179.10 2knf s ALA 27 N -3.31 3.89 -0.42 0.00 0.00 0.11 -4.95 121.76 117.08 2knf s ALA 27 Ca 0.04 -0.71 0.05 0.00 0.00 0.00 0.00 51.96 51.33 2knf s ALA 27 Cb 0.08 -1.98 0.59 0.00 0.00 0.00 0.00 23.12 21.80 2knf s ALA 27 CO 0.67 0.72 1.77 1.04 0.00 0.00 0.00 175.76 179.95 2knf n GLN 28 N 0.10 2.21 -3.68 0.00 1.13 -1.26 -4.58 117.38 111.30 2knf n GLN 28 Ca -0.04 -3.14 -0.13 0.00 -1.94 0.00 0.00 57.00 51.75 2knf n GLN 28 Cb 0.52 -2.08 -0.13 0.00 0.11 0.00 0.00 30.24 28.66 2knf n GLN 28 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2knf s GLU 29 N -3.36 0.18 -0.12 -1.09 2.02 -1.26 -1.42 118.70 113.65 2knf s GLU 29 Ca 0.54 0.70 0.02 0.00 0.02 0.00 0.00 54.97 56.25 2knf s GLU 29 Cb 0.46 -0.04 0.23 0.00 0.10 0.00 0.00 34.13 34.88 2knf s GLU 29 CO 0.06 -0.24 1.18 -0.35 0.02 0.00 0.00 175.26 175.92 2knf n PRO 30 N 4.98 1.66 -3.85 0.39 -0.04 -1.26 -4.65 135.00 132.23 2knf n PRO 30 Ca -0.12 -0.99 -0.29 0.00 -0.04 0.00 0.00 63.50 62.06 2knf n PRO 30 Cb 0.51 -1.49 -0.16 0.00 -0.04 0.00 0.00 33.50 32.32 2knf n PRO 30 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2knf s HIS 31 N -1.21 1.94 -0.16 0.54 3.76 -1.13 -4.99 115.29 114.02 2knf s HIS 31 Ca 0.18 -1.52 -0.29 0.00 -0.15 0.00 0.00 55.06 53.28 2knf s HIS 31 Cb 0.15 -1.47 -0.00 0.00 1.11 0.00 0.00 32.58 32.36 2knf s HIS 31 CO 0.04 -0.74 1.06 0.50 -0.85 0.00 0.00 174.74 174.75 2knf s ARG 32 N 1.55 4.33 -0.32 1.40 3.00 -0.51 -4.11 118.95 124.29 2knf s ARG 32 Ca -0.02 1.42 0.02 0.00 -1.00 0.00 0.00 55.73 56.15 2knf s ARG 32 Cb -0.18 -3.61 0.15 0.00 0.00 0.00 0.00 34.95 31.32 2knf s ARG 32 CO -0.09 -0.50 0.38 -3.38 0.00 0.00 0.00 175.30 171.71 2knf s HIS 33 N 2.70 -0.73 0.00 5.12 -3.43 -1.26 -4.97 115.29 112.71 2knf s HIS 33 Ca 0.47 -0.09 0.00 0.00 -0.80 0.00 0.00 55.06 54.64 2knf s HIS 33 Cb -0.18 -0.28 0.00 0.00 -1.43 0.00 0.00 32.58 30.70 2knf s HIS 33 CO 0.13 -0.98 1.41 0.43 -2.00 0.00 0.00 174.74 173.73 2knf n SER 34 N 5.03 3.91 -3.85 7.38 7.64 -1.26 -4.69 113.62 127.78 2knf n SER 34 Ca 0.03 -2.08 -0.12 0.00 1.01 0.00 0.00 58.87 57.71 2knf n SER 34 Cb 0.48 -0.77 -0.12 0.00 -1.01 0.00 0.00 64.21 62.79 2knf n SER 34 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2knf s ILE 35 N 0.13 0.02 -1.34 0.44 -4.36 -1.26 -4.84 121.20 110.00 2knf s ILE 35 Ca 0.00 -0.19 -0.02 0.00 -0.26 0.00 0.00 60.65 60.18 2knf s ILE 35 Cb 0.00 -0.22 -0.00 0.00 1.25 0.00 0.00 42.46 43.49 2knf s ILE 35 CO 0.00 -0.11 0.56 0.49 0.24 0.00 0.00 174.94 176.12 2knf n PHE 36 N 2.64 -1.77 -3.00 1.37 3.72 -1.26 -5.01 117.46 114.14 2knf n PHE 36 Ca -0.15 0.75 -0.19 0.00 -0.05 0.00 0.00 57.45 57.81 2knf n PHE 36 Cb 0.58 -3.96 0.05 0.00 -0.94 0.00 0.00 39.48 35.22 2knf n PHE 36 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2knf s THR 37 N -3.81 2.40 0.42 4.37 -4.23 -1.26 -4.77 115.64 108.76 2knf s THR 37 Ca 0.05 -0.98 0.37 0.00 -1.18 0.00 0.00 61.69 59.95 2knf s THR 37 Cb -0.02 -2.42 0.39 0.00 1.34 0.00 0.00 72.50 71.80 2knf s THR 37 CO 0.86 0.00 2.17 -0.65 -0.54 0.00 0.00 174.62 176.46 2knf h PRO 38 N 0.28 0.00 0.00 3.99 0.11 -1.75 -2.18 132.00 132.45 2knf h PRO 38 Ca -0.33 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.65 2knf h PRO 38 Cb 1.29 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.37 2knf h PRO 38 CO 0.42 0.03 -2.12 0.39 -0.21 0.00 0.00 178.00 176.51 2knf n GLU 39 N -3.23 0.68 0.09 1.05 1.02 -1.26 -3.05 120.64 115.95 2knf n GLU 39 Ca -0.02 -0.13 0.12 0.00 -0.02 0.00 0.00 57.16 57.11 2knf n GLU 39 Cb 0.19 -1.51 0.01 0.00 -0.02 0.00 0.00 31.44 30.11 2knf n GLU 39 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2knf n THR 40 N -2.43 0.56 -3.17 2.62 -2.24 -1.20 -4.44 114.28 103.99 2knf n THR 40 Ca -0.14 -0.50 -0.21 0.00 -2.27 0.00 0.00 64.05 60.92 2knf n THR 40 Cb 0.77 -0.28 -0.04 0.00 -2.10 0.00 0.00 70.33 68.68 2knf n THR 40 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2knf n ASN 41 N -2.57 1.35 0.00 3.42 4.13 -0.82 -4.90 115.26 115.86 2knf n ASN 41 Ca 0.00 -3.06 0.01 0.00 1.68 0.00 0.00 54.58 53.22 2knf n ASN 41 Cb 0.53 -0.62 0.06 0.00 -1.54 0.00 0.00 39.78 38.21 2knf n ASN 41 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 2knf n PRO 42 N 0.49 0.68 -0.00 3.52 -0.04 -1.17 -2.20 135.00 136.28 2knf n PRO 42 Ca 0.25 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.76 2knf n PRO 42 Cb 0.58 -1.05 -0.06 0.00 -0.04 0.00 0.00 33.50 32.94 2knf n PRO 42 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2knf n ARG 43 N -0.55 3.07 -0.24 0.54 1.85 -1.26 -4.43 116.66 115.64 2knf n ARG 43 Ca 0.02 -0.02 0.09 0.00 -1.00 0.00 0.00 57.85 56.94 2knf n ARG 43 Cb 0.01 -1.01 0.22 0.00 -1.05 0.00 0.00 32.46 30.63 2knf n ARG 43 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2knf n ALA 44 N -1.36 2.33 -3.44 2.89 0.00 -0.93 -4.97 120.51 115.02 2knf n ALA 44 Ca 0.01 -1.13 -0.19 0.00 0.00 0.00 0.00 53.44 52.12 2knf n ALA 44 Cb 0.17 -0.71 0.08 0.00 0.00 0.00 0.00 19.45 18.99 2knf n ALA 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2knf n GLY 45 N 1.17 -0.38 3.55 0.00 0.00 -1.25 -4.76 105.19 103.52 2knf n GLY 45 Ca 0.18 0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.92 2knf n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2knf s LEU 46 N -6.51 3.31 -0.10 0.99 1.02 -1.26 -4.97 118.68 111.16 2knf s LEU 46 Ca 0.29 -0.81 -0.00 0.00 0.02 0.00 0.00 54.13 53.63 2knf s LEU 46 Cb -0.13 -2.56 -0.02 0.00 0.02 0.00 0.00 46.19 43.50 2knf s LEU 46 CO 0.68 -1.72 -0.09 -1.83 0.02 0.00 0.00 176.35 173.42 2knf s GLU 47 N 5.43 3.09 6.11 1.70 -1.05 -1.26 -4.00 118.70 128.72 2knf s GLU 47 Ca 0.39 -0.60 0.00 0.00 -0.15 0.00 0.00 54.97 54.61 2knf s GLU 47 Cb -0.05 -2.64 0.00 0.00 -0.44 0.00 0.00 34.13 30.99 2knf s GLU 47 CO 0.06 0.45 0.00 1.63 0.95 0.00 0.00 175.26 178.35 2knf n LYS 48 N 2.87 0.00 -0.12 -4.83 4.76 -1.26 -2.49 118.16 117.09 2knf n LYS 48 Ca -0.18 0.00 0.02 0.00 -2.87 0.00 0.00 58.31 55.28 2knf n LYS 48 Cb 0.53 0.00 0.03 0.00 -1.84 0.00 0.00 35.03 33.74 2knf n LYS 48 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 2knf n ASN 49 N 8.16 0.98 -4.73 4.39 6.94 -1.26 -0.71 115.26 129.02 2knf n ASN 49 Ca 0.00 -1.88 -0.42 0.00 -0.02 0.00 0.00 54.58 52.27 2knf n ASN 49 Cb 0.00 -0.12 -0.03 0.00 -2.36 0.00 0.00 39.78 37.27 2knf n ASN 49 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 2knf s TYR 50 N -0.80 3.09 0.61 -2.53 2.02 -1.04 -4.60 117.35 114.09 2knf s TYR 50 Ca 0.06 0.94 -0.18 0.00 -0.37 0.00 0.00 57.07 57.52 2knf s TYR 50 Cb 0.05 -3.80 -0.05 0.00 -0.40 0.00 0.00 41.96 37.76 2knf s TYR 50 CO 0.01 -2.72 0.95 0.00 -1.57 0.00 0.00 175.55 172.21 2knf s ARG 52 N -2.76 1.20 -0.61 0.00 1.81 -0.43 -4.74 118.95 113.42 2knf s ARG 52 Ca 0.76 -0.84 0.05 0.00 -1.72 0.00 0.00 55.73 53.98 2knf s ARG 52 Cb -0.41 0.47 0.17 0.00 -0.45 0.00 0.00 34.95 34.73 2knf s ARG 52 CO 0.47 -0.48 0.43 1.21 -0.68 0.00 0.00 175.30 176.25 2knf s ASN 53 N -2.85 3.87 0.60 0.23 3.84 -0.94 -1.02 114.94 118.67 2knf s ASN 53 Ca 0.07 -3.56 0.37 0.00 0.21 0.00 0.00 52.86 49.95 2knf s ASN 53 Cb 0.01 -1.29 1.86 0.00 -0.55 0.00 0.00 41.25 41.27 2knf s ASN 53 CO -0.07 -0.12 2.18 -0.65 -2.79 0.00 0.00 177.10 175.65 2knf h PRO 54 N 5.56 0.00 0.01 0.43 0.11 -1.88 -1.71 132.00 134.52 2knf h PRO 54 Ca 0.16 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.98 2knf h PRO 54 Cb 0.81 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.87 2knf h PRO 54 CO 0.62 0.02 -1.69 0.22 -0.21 0.00 0.00 178.00 176.96 2knf h ASP 55 N 0.00 0.03 -4.37 -2.05 3.58 -1.97 -3.48 116.42 108.16 2knf h ASP 55 Ca -0.00 -0.07 -0.29 0.00 0.42 0.00 0.00 57.03 57.09 2knf h ASP 55 Cb 0.25 -0.01 0.10 0.00 1.72 0.00 0.00 39.33 41.38 2knf h ASP 55 CO 0.00 1.06 -0.48 0.61 -2.88 0.00 0.00 179.24 177.55 2knf n GLY 56 N 1.57 -0.13 3.53 -0.78 0.00 -0.64 -4.95 105.19 103.79 2knf n GLY 56 Ca -0.17 -0.02 -0.54 0.00 0.00 0.00 0.00 46.02 45.29 2knf n GLY 56 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2knf n ASP 57 N -1.70 0.59 0.00 1.61 -0.08 -1.26 -4.79 116.55 110.92 2knf n ASP 57 Ca -0.00 1.14 0.06 0.00 -1.51 0.00 0.00 54.79 54.48 2knf n ASP 57 Cb 0.55 -1.05 0.36 0.00 2.34 0.00 0.00 41.12 43.31 2knf n ASP 57 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 2knf n VAL 58 N 1.67 0.00 -0.02 5.18 0.31 -1.26 -1.60 118.33 122.61 2knf n VAL 58 Ca 0.19 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.58 2knf n VAL 58 Cb 0.15 -0.58 -0.16 0.00 -0.91 0.00 0.00 33.84 32.35 2knf n VAL 58 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2knf n GLY 59 N 0.07 -1.03 0.00 2.92 0.00 -1.26 -4.98 105.19 100.91 2knf n GLY 59 Ca 0.09 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2knf n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2knf n GLY 60 N 1.36 0.80 3.84 -0.02 0.00 -0.63 -5.07 105.19 105.47 2knf n GLY 60 Ca -0.10 -2.13 -0.31 0.00 0.00 0.00 0.00 46.02 43.49 2knf n GLY 60 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2knf s PRO 61 N -1.00 3.18 0.10 1.61 0.04 -0.77 -4.54 135.00 133.62 2knf s PRO 61 Ca 0.00 0.88 -0.01 0.00 0.04 0.00 0.00 61.00 61.92 2knf s PRO 61 Cb 0.00 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.52 2knf s PRO 61 CO 0.00 -0.90 0.15 -2.67 0.04 0.00 0.00 177.00 173.61 2knf n TRP 62 N -2.98 -0.75 -3.86 0.56 4.27 -0.19 -0.96 117.44 113.53 2knf n TRP 62 Ca 0.07 -0.69 -0.03 0.00 -3.89 0.00 0.00 57.50 52.96 2knf n TRP 62 Cb 0.54 0.17 0.02 0.00 -1.36 0.00 0.00 31.31 30.67 2knf n TRP 62 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2knf s TYR 64 N -2.49 3.54 0.04 0.00 2.02 -1.26 -1.83 117.35 117.36 2knf s TYR 64 Ca 0.21 0.47 -0.01 0.00 -0.37 0.00 0.00 57.07 57.36 2knf s TYR 64 Cb -0.02 -1.91 -0.04 0.00 -0.40 0.00 0.00 41.96 39.59 2knf s TYR 64 CO 0.05 0.70 0.21 0.95 -1.57 0.00 0.00 175.55 175.88 2knf s THR 65 N -1.05 5.40 -1.50 -0.71 -4.23 -0.56 0.15 115.64 113.14 2knf s THR 65 Ca 0.16 -0.29 0.00 0.00 -1.18 0.00 0.00 61.69 60.38 2knf s THR 65 Cb -0.12 -3.60 0.00 0.00 1.34 0.00 0.00 72.50 70.12 2knf s THR 65 CO 0.06 0.20 0.64 0.35 -0.54 0.00 0.00 174.62 175.33 2knf n THR 66 N 0.51 0.00 -3.61 3.99 -2.24 -0.25 -4.54 114.28 108.15 2knf n THR 66 Ca -0.07 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.33 2knf n THR 66 Cb 0.52 -0.25 -0.11 0.00 -2.10 0.00 0.00 70.33 68.38 2knf n THR 66 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2knf s ASN 67 N -0.65 5.90 0.00 3.42 2.47 -1.26 -4.82 114.94 120.00 2knf s ASN 67 Ca 0.00 -0.06 0.05 0.00 0.42 0.00 0.00 52.86 53.27 2knf s ASN 67 Cb 0.00 -2.09 0.30 0.00 -1.45 0.00 0.00 41.25 38.00 2knf s ASN 67 CO 0.00 -0.06 0.75 -2.65 -3.72 0.00 0.00 177.10 171.42 2knf n PRO 68 N 5.04 0.47 -0.07 0.43 -0.02 -1.26 -2.48 135.00 137.12 2knf n PRO 68 Ca -0.14 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.17 2knf n PRO 68 Cb 0.52 -1.17 -0.13 0.00 -0.02 0.00 0.00 33.50 32.70 2knf n PRO 68 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2knf h ARG 69 N 0.00 0.03 -3.73 -0.52 2.47 -1.96 -3.47 114.38 107.20 2knf h ARG 69 Ca 0.00 -0.05 -0.28 0.00 -1.26 0.00 0.00 59.98 58.38 2knf h ARG 69 Cb 0.00 0.02 -0.31 0.00 -1.65 0.00 0.00 29.97 28.03 2knf h ARG 69 CO 0.00 1.03 -0.73 -1.59 0.56 0.00 0.00 179.97 179.23 2knf s LYS 70 N -2.27 0.09 0.20 0.04 0.00 -1.03 -5.05 119.74 111.71 2knf s LYS 70 Ca -0.21 0.05 -0.08 0.00 0.00 0.00 0.00 55.97 55.73 2knf s LYS 70 Cb -0.01 -0.21 0.12 0.00 0.00 0.00 0.00 37.83 37.73 2knf s LYS 70 CO 0.68 -0.07 1.71 1.25 0.00 0.00 0.00 175.35 178.93 2knf h LEU 71 N 6.70 1.08 -8.26 2.77 5.85 -1.89 -3.39 115.31 118.17 2knf h LEU 71 Ca -0.35 -0.24 -0.15 0.00 0.84 0.00 0.00 57.88 57.98 2knf h LEU 71 Cb 1.17 -0.29 -0.14 0.00 0.37 0.00 0.00 40.66 41.77 2knf h LEU 71 CO 0.49 1.04 -0.51 -0.72 -0.34 0.00 0.00 178.44 178.41 2knf s TYR 72 N -5.27 0.64 0.27 1.25 1.13 -1.26 -1.49 117.35 112.61 2knf s TYR 72 Ca -0.12 -1.02 -0.21 0.00 -1.41 0.00 0.00 57.07 54.31 2knf s TYR 72 Cb 0.15 -0.30 0.04 0.00 -1.10 0.00 0.00 41.96 40.75 2knf s TYR 72 CO 0.85 -0.59 0.81 0.34 -2.51 0.00 0.00 175.55 174.45 2knf s ASP 73 N -3.00 -0.17 0.31 -0.18 2.15 -0.76 -4.84 116.67 110.17 2knf s ASP 73 Ca 0.20 -0.67 -0.03 0.00 0.43 0.00 0.00 52.55 52.47 2knf s ASP 73 Cb 0.06 0.69 -0.05 0.00 -0.30 0.00 0.00 42.92 43.32 2knf s ASP 73 CO -0.00 -1.30 0.55 -0.31 -0.17 0.00 0.00 175.17 173.95 2knf s TYR 74 N -3.35 3.49 0.42 -5.34 1.51 -1.26 -1.43 117.35 111.38 2knf s TYR 74 Ca 0.13 0.56 0.08 0.00 -1.01 0.00 0.00 57.07 56.83 2knf s TYR 74 Cb -0.05 -2.05 -0.01 0.00 -0.11 0.00 0.00 41.96 39.75 2knf s TYR 74 CO 0.07 0.15 0.44 0.00 -1.11 0.00 0.00 175.55 175.10 2knf n ASP 76 N -1.65 4.95 -4.43 0.00 -0.08 -1.24 -4.52 116.55 109.59 2knf n ASP 76 Ca 0.05 -3.51 -0.33 0.00 -1.51 0.00 0.00 54.79 49.49 2knf n ASP 76 Cb 0.61 -0.86 -0.13 0.00 2.34 0.00 0.00 41.12 43.08 2knf n ASP 76 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2knf s VAL 77 N -3.11 3.45 0.90 5.18 0.11 -1.26 -5.04 120.40 120.64 2knf s VAL 77 Ca 0.39 -0.51 -0.11 0.00 -2.93 0.00 0.00 61.98 58.82 2knf s VAL 77 Cb 0.15 -2.49 0.13 0.00 -1.53 0.00 0.00 36.38 32.65 2knf s VAL 77 CO -0.01 0.51 1.11 -2.16 -3.33 0.00 0.00 175.10 171.21 2knf s PRO 78 N 0.40 1.17 -0.31 1.54 0.04 -1.26 -4.62 135.00 131.96 2knf s PRO 78 Ca -0.07 1.26 -0.29 0.00 0.04 0.00 0.00 61.00 61.94 2knf s PRO 78 Cb -0.15 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2knf s PRO 78 CO 0.04 -2.43 1.31 -1.14 0.04 0.00 0.00 177.00 174.82 2knf s GLN 79 N -4.74 3.88 0.07 4.56 2.00 -1.26 -0.56 119.66 123.61 2knf s GLN 79 Ca 0.65 1.21 -0.15 0.00 -2.00 0.00 0.00 55.36 55.07 2knf s GLN 79 Cb -0.21 -3.89 -0.20 0.00 0.80 0.00 0.00 33.01 29.51 2knf s GLN 79 CO 0.58 -1.17 1.22 0.00 -0.50 0.00 0.00 175.29 175.42 2knf n ALA 81 N -2.61 6.06 -0.51 0.00 0.00 -1.11 -4.99 120.51 117.34 2knf n ALA 81 Ca -0.09 -1.66 0.00 0.00 0.00 0.00 0.00 53.44 51.68 2knf n ALA 81 Cb 0.77 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 18.09 2knf n ALA 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50