#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jwd s VAL 2 N 0.00 2.54 0.35 5.18 1.01 -1.26 -5.02 120.40 123.20 2jwd s VAL 2 Ca 0.00 -0.89 0.05 0.00 0.00 0.00 0.00 61.98 61.14 2jwd s VAL 2 Cb 0.00 -1.98 0.30 0.00 0.00 0.00 0.00 36.38 34.70 2jwd s VAL 2 CO 0.00 0.57 1.93 0.44 0.00 0.00 0.00 175.10 178.04 2jwd h ASP 3 N 5.97 0.72 -0.10 3.32 3.32 -2.09 0.11 116.42 127.66 2jwd h ASP 3 Ca -0.35 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.71 2jwd h ASP 3 Cb 1.17 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.59 2jwd h ASP 3 CO 0.50 0.44 0.00 0.59 -1.72 0.00 0.00 179.24 179.05 2jwd n ASN 4 N -4.50 0.79 -0.21 6.45 5.03 -1.26 -3.94 115.26 117.63 2jwd n ASN 4 Ca 0.13 -1.68 0.06 0.00 0.87 0.00 0.00 54.58 53.96 2jwd n ASN 4 Cb 0.27 -0.06 0.33 0.00 -1.02 0.00 0.00 39.78 39.30 2jwd n ASN 4 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 2jwd h LYS 5 N 0.99 0.79 -4.79 3.52 1.63 -1.18 -3.43 116.57 114.10 2jwd h LYS 5 Ca 0.00 -0.05 -0.27 0.00 -0.85 0.00 0.00 60.65 59.48 2jwd h LYS 5 Cb 0.22 -0.18 -0.15 0.00 -0.60 0.00 0.00 32.23 31.53 2jwd h LYS 5 CO 0.00 0.52 -0.68 -0.59 -3.45 0.00 0.00 179.45 175.25 2jwd s PHE 6 N -5.72 1.12 -0.24 1.91 -0.71 -1.25 -5.08 117.98 108.01 2jwd s PHE 6 Ca -0.10 -0.95 -0.09 0.00 -1.04 0.00 0.00 56.93 54.75 2jwd s PHE 6 Cb 0.19 -0.63 -0.04 0.00 -1.21 0.00 0.00 43.02 41.33 2jwd s PHE 6 CO 0.78 -0.15 0.12 1.21 -1.34 0.00 0.00 175.22 175.84 2jwd s ASN 7 N -3.13 5.76 0.39 1.98 3.84 -1.26 -4.97 114.94 117.55 2jwd s ASN 7 Ca 0.19 0.01 0.08 0.00 0.21 0.00 0.00 52.86 53.36 2jwd s ASN 7 Cb 0.05 -2.03 0.85 0.00 -0.55 0.00 0.00 41.25 39.57 2jwd s ASN 7 CO 0.01 0.05 1.98 0.11 -2.79 0.00 0.00 177.10 176.45 2jwd h LYS 8 N 7.63 0.60 -0.65 0.43 1.57 -2.00 0.11 116.57 124.27 2jwd h LYS 8 Ca -0.37 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.40 2jwd h LYS 8 Cb 1.17 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.31 2jwd h LYS 8 CO 0.63 0.40 0.43 1.49 -0.57 0.00 0.00 179.45 181.83 2jwd h GLU 9 N 0.62 0.79 -0.83 3.15 4.81 -2.02 -0.64 114.58 120.45 2jwd h GLU 9 Ca 0.28 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.50 2jwd h GLU 9 Cb 0.30 -0.18 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 2jwd h GLU 9 CO -0.09 0.52 0.55 0.37 -0.73 0.00 0.00 179.01 179.63 2jwd h GLN 10 N 0.81 0.97 -0.88 1.92 4.15 -1.18 -1.40 115.11 119.50 2jwd h GLN 10 Ca 0.25 -0.06 0.09 0.00 0.77 0.00 0.00 58.65 59.71 2jwd h GLN 10 Cb 0.01 -0.22 -0.06 0.00 0.21 0.00 0.00 27.48 27.42 2jwd h GLN 10 CO -0.07 0.64 0.57 0.37 -1.93 0.00 0.00 178.83 178.41 2jwd h GLN 11 N 1.00 0.85 -0.96 1.69 4.15 -0.99 -0.73 115.11 120.12 2jwd h GLN 11 Ca 0.34 -0.05 0.10 0.00 0.77 0.00 0.00 58.65 59.81 2jwd h GLN 11 Cb 0.09 -0.19 -0.07 0.00 0.21 0.00 0.00 27.48 27.51 2jwd h GLN 11 CO -0.11 0.56 0.62 -0.97 -1.93 0.00 0.00 178.83 177.00 2jwd h ASN 12 N 0.87 0.90 -0.36 -0.69 -0.73 -1.22 -0.50 115.58 113.85 2jwd h ASN 12 Ca 0.40 0.03 -0.05 0.00 1.87 0.00 0.00 56.30 58.56 2jwd h ASN 12 Cb 0.40 -0.16 -0.02 0.00 0.27 0.00 0.00 38.32 38.81 2jwd h ASN 12 CO -0.17 0.52 0.08 0.00 -0.37 0.00 0.00 177.43 177.50 2jwd h ALA 13 N 1.53 1.33 -0.55 1.57 0.00 -1.18 -2.72 119.26 119.24 2jwd h ALA 13 Ca 0.45 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 55.20 2jwd h ALA 13 Cb 0.39 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 2jwd h ALA 13 CO -0.21 0.47 0.33 0.35 0.00 0.00 0.00 179.25 180.19 2jwd h PHE 14 N 0.64 0.61 -0.67 0.00 3.57 -0.97 -2.05 116.94 118.07 2jwd h PHE 14 Ca 0.14 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.67 2jwd h PHE 14 Cb 0.28 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 2jwd h PHE 14 CO 0.01 0.35 0.43 -1.49 -2.23 0.00 0.00 178.31 175.38 2jwd h TRP 15 N 0.65 0.85 -0.53 0.41 4.06 -1.33 -2.46 115.95 117.60 2jwd h TRP 15 Ca 0.22 0.02 -0.02 0.00 2.06 0.00 0.00 58.89 61.17 2jwd h TRP 15 Cb 0.03 -0.28 -0.03 0.00 -1.00 0.00 0.00 29.16 27.88 2jwd h TRP 15 CO -0.06 0.54 0.24 0.93 -3.56 0.00 0.00 178.44 176.52 2jwd h GLU 16 N 0.91 0.75 -0.58 0.49 4.39 -1.21 -1.02 114.58 118.31 2jwd h GLU 16 Ca 0.24 -0.10 -0.02 0.00 0.34 0.00 0.00 59.36 59.83 2jwd h GLU 16 Cb -0.09 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 28.39 2jwd h GLU 16 CO -0.05 0.59 0.30 0.82 -1.16 0.00 0.00 179.01 179.51 2jwd h ILE 17 N 0.74 1.20 -0.55 3.13 1.08 -1.28 -2.48 117.51 119.35 2jwd h ILE 17 Ca 0.18 -0.53 -0.05 0.00 -0.39 0.00 0.00 64.86 64.08 2jwd h ILE 17 Cb 0.10 0.48 -0.03 0.00 -3.07 0.00 0.00 36.82 34.31 2jwd h ILE 17 CO -0.02 0.22 0.16 -0.07 -0.69 0.00 0.00 178.15 177.75 2jwd h LEU 18 N 0.79 0.77 -0.47 1.44 3.38 -1.29 -3.18 115.31 116.75 2jwd h LEU 18 Ca 0.20 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 58.06 2jwd h LEU 18 Cb 0.08 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2jwd h LEU 18 CO -0.03 0.74 0.30 -0.74 0.09 0.00 0.00 178.44 178.80 2jwd h HIS 19 N 0.81 0.58 0.00 1.13 2.76 -0.74 -3.42 115.15 116.26 2jwd h HIS 19 Ca 0.18 0.01 -0.26 0.00 -2.20 0.00 0.00 60.37 58.11 2jwd h HIS 19 Cb 0.26 -0.19 -0.09 0.00 1.55 0.00 0.00 27.41 28.94 2jwd h HIS 19 CO 0.02 0.35 1.55 1.28 -1.30 0.00 0.00 177.93 179.83 2jwd n LEU 20 N -4.78 -1.26 -0.10 0.26 4.77 -1.16 -4.74 117.00 110.00 2jwd n LEU 20 Ca 0.02 -0.54 -0.07 0.00 -0.03 0.00 0.00 56.01 55.40 2jwd n LEU 20 Cb 0.03 -0.44 0.10 0.00 -2.33 0.00 0.00 43.42 40.79 2jwd n LEU 20 CO 0.34 -1.19 0.76 1.55 -1.33 0.00 0.00 177.39 177.53 2jwd h PRO 21 N 8.73 0.81 -0.44 3.23 0.13 -1.92 -3.03 132.00 139.50 2jwd h PRO 21 Ca 0.03 -0.29 0.02 0.00 -0.87 0.00 0.00 66.00 64.89 2jwd h PRO 21 Cb 0.90 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 31.95 2jwd h PRO 21 CO 1.26 0.90 0.30 -0.91 -0.23 0.00 0.00 178.00 179.32 2jwd h ASN 22 N 0.72 0.45 -3.25 1.44 2.35 -1.93 -3.43 115.58 111.94 2jwd h ASN 22 Ca 0.11 -0.01 -0.57 0.00 -0.55 0.00 0.00 56.30 55.29 2jwd h ASN 22 Cb 0.64 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.86 2jwd h ASN 22 CO 0.04 0.31 -0.11 -0.76 -1.65 0.00 0.00 177.43 175.27 2jwd s LEU 23 N -9.47 4.38 0.78 1.61 1.43 -1.15 -4.98 118.68 111.30 2jwd s LEU 23 Ca -0.08 1.05 -0.11 0.00 -1.03 0.00 0.00 54.13 53.96 2jwd s LEU 23 Cb 0.18 -3.10 0.07 0.00 0.03 0.00 0.00 46.19 43.36 2jwd s LEU 23 CO 0.73 0.16 1.15 0.54 0.23 0.00 0.00 176.35 179.16 2jwd s ASN 24 N -1.56 4.70 0.35 2.29 6.03 -1.26 -4.95 114.94 120.53 2jwd s ASN 24 Ca 0.34 0.81 0.04 0.00 -1.03 0.00 0.00 52.86 53.02 2jwd s ASN 24 Cb -0.16 -1.37 0.64 0.00 -3.03 0.00 0.00 41.25 37.34 2jwd s ASN 24 CO 0.18 -1.78 1.94 -0.33 -2.03 0.00 0.00 177.10 175.08 2jwd h GLU 25 N -0.94 0.63 -0.78 3.55 5.08 -1.98 -2.68 114.58 117.47 2jwd h GLU 25 Ca -0.46 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 57.81 2jwd h GLU 25 Cb 1.32 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.41 2jwd h GLU 25 CO 0.65 0.53 0.46 1.49 -1.00 0.00 0.00 179.01 181.14 2jwd h GLU 26 N 0.63 1.06 -0.90 2.33 4.57 -2.01 -1.70 114.58 118.55 2jwd h GLU 26 Ca 0.15 -0.10 0.01 0.00 -1.18 0.00 0.00 59.36 58.25 2jwd h GLU 26 Cb 0.15 -0.22 -0.05 0.00 -0.16 0.00 0.00 28.75 28.47 2jwd h GLU 26 CO -0.01 0.75 0.60 0.37 -1.18 0.00 0.00 179.01 179.53 2jwd h GLN 27 N 1.08 1.17 -0.71 1.92 5.75 -1.85 -1.41 115.11 121.06 2jwd h GLN 27 Ca 0.28 -0.07 0.03 0.00 -0.15 0.00 0.00 58.65 58.73 2jwd h GLN 27 Cb -0.03 -0.26 -0.04 0.00 1.07 0.00 0.00 27.48 28.22 2jwd h GLN 27 CO -0.05 0.77 0.47 0.00 -2.65 0.00 0.00 178.83 177.37 2jwd h ARG 28 N 1.20 0.86 -0.93 1.69 3.08 -1.27 -1.59 114.38 117.42 2jwd h ARG 28 Ca 0.33 -0.05 0.08 0.00 0.07 0.00 0.00 59.98 60.42 2jwd h ARG 28 Cb -0.11 -0.19 -0.07 0.00 0.08 0.00 0.00 29.97 29.68 2jwd h ARG 28 CO -0.08 0.57 0.60 -0.97 -1.07 0.00 0.00 179.97 179.02 2jwd h ASN 29 N 0.88 0.90 -0.86 7.04 -0.73 -1.04 -1.64 115.58 120.12 2jwd h ASN 29 Ca 0.27 0.02 0.06 0.00 1.87 0.00 0.00 56.30 58.53 2jwd h ASN 29 Cb 0.01 -0.17 -0.06 0.00 0.27 0.00 0.00 38.32 38.37 2jwd h ASN 29 CO -0.07 0.54 0.53 1.23 -0.37 0.00 0.00 177.43 179.29 2jwd h GLY 30 N 1.00 1.30 1.03 1.57 0.00 -1.26 -1.80 103.07 104.91 2jwd h GLY 30 Ca 0.42 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 47.30 2jwd h GLY 30 CO -0.18 0.25 0.13 0.74 0.00 0.00 0.00 176.54 177.49 2jwd h PHE 31 N 0.96 1.06 -0.58 5.60 0.04 -1.37 -3.01 116.94 119.65 2jwd h PHE 31 Ca 0.38 -0.13 -0.00 0.00 2.80 0.00 0.00 57.97 61.01 2jwd h PHE 31 Cb 0.19 -0.30 -0.03 0.00 2.20 0.00 0.00 35.95 38.01 2jwd h PHE 31 CO -0.03 0.90 0.36 0.82 -0.60 0.00 0.00 178.31 179.75 2jwd h ILE 32 N 0.92 1.17 -0.80 -0.55 1.08 -1.00 -1.92 117.51 116.41 2jwd h ILE 32 Ca 0.19 -0.35 -0.02 0.00 -0.39 0.00 0.00 64.86 64.29 2jwd h ILE 32 Cb 0.38 0.36 -0.04 0.00 -3.07 0.00 0.00 36.82 34.46 2jwd h ILE 32 CO 0.01 0.17 0.43 1.56 -0.69 0.00 0.00 178.15 179.62 2jwd h GLN 33 N 0.78 1.11 -0.65 2.37 4.20 -1.37 -1.77 115.11 119.78 2jwd h GLN 33 Ca 0.21 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 2jwd h GLN 33 Cb -0.04 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 27.49 2jwd h GLN 33 CO -0.04 0.82 0.36 0.77 -0.67 0.00 0.00 178.83 180.07 2jwd h SER 34 N 1.11 0.80 -0.99 1.46 0.02 -1.32 -2.50 113.55 112.14 2jwd h SER 34 Ca 0.28 -0.06 0.03 0.00 -0.84 0.00 0.00 61.79 61.21 2jwd h SER 34 Cb 0.04 -0.20 -0.06 0.00 0.14 0.00 0.00 62.40 62.32 2jwd h SER 34 CO -0.04 0.64 0.65 0.25 -1.14 0.00 0.00 176.83 177.18 2jwd h LEU 35 N 0.90 1.08 -0.78 5.07 5.85 -0.55 -2.15 115.31 124.73 2jwd h LEU 35 Ca 0.23 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.94 2jwd h LEU 35 Cb 0.02 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.76 2jwd h LEU 35 CO -0.04 0.75 0.48 0.50 -0.34 0.00 0.00 178.44 179.79 2jwd h LYS 36 N 1.26 1.06 -0.87 1.25 1.63 -1.33 -2.13 116.57 117.43 2jwd h LYS 36 Ca 0.39 -0.09 -0.00 0.00 -0.85 0.00 0.00 60.65 60.10 2jwd h LYS 36 Cb -0.01 -0.23 -0.04 0.00 -0.60 0.00 0.00 32.23 31.35 2jwd h LYS 36 CO -0.12 0.74 0.53 -0.44 -3.45 0.00 0.00 179.45 176.70 2jwd h ASP 37 N 1.07 1.04 -2.28 4.20 3.32 -1.37 -3.36 116.42 119.05 2jwd h ASP 37 Ca 0.28 -0.06 -0.58 0.00 0.02 0.00 0.00 57.03 56.69 2jwd h ASP 37 Cb -0.06 -0.26 -0.39 0.00 0.22 0.00 0.00 39.33 38.83 2jwd h ASP 37 CO -0.05 0.80 -0.93 0.47 -1.72 0.00 0.00 179.24 177.81 2jwd n ASP 38 N -4.42 0.78 0.08 6.45 9.92 -1.11 -4.98 116.55 123.28 2jwd n ASP 38 Ca 0.09 -2.75 0.10 0.00 -0.53 0.00 0.00 54.79 51.70 2jwd n ASP 38 Cb 0.05 -0.63 0.57 0.00 -0.64 0.00 0.00 41.12 40.48 2jwd n ASP 38 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 2jwd h PRO 39 N 4.75 0.21 -0.02 -0.24 0.13 -1.55 -1.02 132.00 134.26 2jwd h PRO 39 Ca 0.17 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.24 2jwd h PRO 39 Cb 0.84 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.92 2jwd h PRO 39 CO 0.51 0.14 -0.21 0.66 -0.23 0.00 0.00 178.00 178.87 2jwd h SER 40 N 0.22 0.04 -0.29 1.44 4.64 -1.94 -2.36 113.55 115.30 2jwd h SER 40 Ca 0.14 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2jwd h SER 40 Cb 0.28 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 2jwd h SER 40 CO -0.02 0.25 0.00 0.00 -0.87 0.00 0.00 176.83 176.19 2jwd n GLN 41 N -4.27 1.86 0.15 4.77 6.02 -0.39 -4.28 117.38 121.24 2jwd n GLN 41 Ca -0.02 -1.12 0.13 0.00 -0.01 0.00 0.00 57.00 55.98 2jwd n GLN 41 Cb 0.28 -1.34 0.65 0.00 1.02 0.00 0.00 30.24 30.84 2jwd n GLN 41 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2jwd h SER 42 N 1.73 0.02 -0.59 1.08 4.64 -1.40 0.15 113.55 119.18 2jwd h SER 42 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 2jwd h SER 42 Cb 0.54 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.60 2jwd h SER 42 CO 0.04 0.02 0.17 0.00 -0.87 0.00 0.00 176.83 176.18 2jwd h ALA 43 N 1.88 0.78 -0.87 5.18 0.00 -1.84 -2.02 119.26 122.37 2jwd h ALA 43 Ca 0.11 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.81 2jwd h ALA 43 Cb 0.40 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 2jwd h ALA 43 CO -0.00 0.46 0.57 -0.91 0.00 0.00 0.00 179.25 179.37 2jwd h ASN 44 N 0.84 1.00 -0.41 0.00 2.35 -1.06 -1.67 115.58 116.63 2jwd h ASN 44 Ca 0.19 -0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.87 2jwd h ASN 44 Cb 0.31 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 2jwd h ASN 44 CO -0.00 0.72 0.13 -0.07 -1.65 0.00 0.00 177.43 176.56 2jwd h LEU 45 N 1.18 0.66 -1.00 1.61 3.38 -0.87 -2.76 115.31 117.50 2jwd h LEU 45 Ca 0.32 -0.10 0.04 0.00 0.09 0.00 0.00 57.88 58.22 2jwd h LEU 45 Cb -0.13 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.39 2jwd h LEU 45 CO -0.07 0.64 0.66 0.25 0.09 0.00 0.00 178.44 180.01 2jwd h LEU 46 N 0.69 1.10 -0.51 1.67 6.46 -0.59 -2.04 115.31 122.10 2jwd h LEU 46 Ca 0.16 -0.01 -0.09 0.00 -0.12 0.00 0.00 57.88 57.82 2jwd h LEU 46 Cb 0.24 -0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 39.90 2jwd h LEU 46 CO -0.01 0.75 -0.03 0.00 -0.62 0.00 0.00 178.44 178.54 2jwd h ALA 47 N 1.41 0.69 -0.35 1.25 0.00 -1.44 -3.15 119.26 117.67 2jwd h ALA 47 Ca 0.40 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2jwd h ALA 47 Cb -0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2jwd h ALA 47 CO -0.12 0.53 -0.08 0.93 0.00 0.00 0.00 179.25 180.51 2jwd h GLU 48 N 0.78 0.59 -0.65 0.00 5.08 -1.39 -3.05 114.58 115.94 2jwd h GLU 48 Ca 0.14 -0.16 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 2jwd h GLU 48 Cb 0.57 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 2jwd h GLU 48 CO 0.03 0.67 0.23 0.00 -1.00 0.00 0.00 179.01 178.95 2jwd h ALA 49 N 1.37 0.85 -0.84 3.43 0.00 -1.34 -1.82 119.26 120.91 2jwd h ALA 49 Ca 0.10 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2jwd h ALA 49 Cb 0.47 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2jwd h ALA 49 CO 0.03 0.49 0.50 -0.22 0.00 0.00 0.00 179.25 180.05 2jwd h LYS 50 N 0.93 1.14 -0.73 0.00 3.64 -1.57 -2.70 116.57 117.27 2jwd h LYS 50 Ca 0.21 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2jwd h LYS 50 Cb 0.25 -0.24 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 2jwd h LYS 50 CO -0.01 0.80 0.48 -0.22 -2.27 0.00 0.00 179.45 178.23 2jwd h LYS 51 N 1.15 0.96 -0.69 1.90 1.63 -1.34 -2.68 116.57 117.50 2jwd h LYS 51 Ca 0.30 -0.06 -0.02 0.00 -0.85 0.00 0.00 60.65 60.02 2jwd h LYS 51 Cb -0.04 -0.22 -0.03 0.00 -0.60 0.00 0.00 32.23 31.34 2jwd h LYS 51 CO -0.06 0.64 0.34 1.25 -3.45 0.00 0.00 179.45 178.17 2jwd h LEU 52 N 0.99 0.88 -1.02 5.20 5.85 -1.03 -2.87 115.31 123.31 2jwd h LEU 52 Ca 0.27 -0.09 0.09 0.00 0.84 0.00 0.00 57.88 58.99 2jwd h LEU 52 Cb -0.11 -0.23 -0.08 0.00 0.37 0.00 0.00 40.66 40.62 2jwd h LEU 52 CO -0.06 0.75 0.64 -1.13 -0.34 0.00 0.00 178.44 178.30 2jwd h ASN 53 N 0.98 0.98 -0.94 1.25 -0.73 -1.25 -1.83 115.58 114.04 2jwd h ASN 53 Ca 0.24 0.03 0.03 0.00 1.87 0.00 0.00 56.30 58.46 2jwd h ASN 53 Cb 0.09 -0.18 -0.05 0.00 0.27 0.00 0.00 38.32 38.46 2jwd h ASN 53 CO -0.03 0.58 0.62 -0.78 -0.37 0.00 0.00 177.43 177.44 2jwd h ASP 54 N 1.08 1.04 -0.52 1.15 3.58 -1.53 -2.75 116.42 118.47 2jwd h ASP 54 Ca 0.46 -0.02 -0.07 0.00 0.42 0.00 0.00 57.03 57.82 2jwd h ASP 54 Cb 0.33 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 41.11 2jwd h ASP 54 CO -0.22 0.73 0.05 0.00 -2.88 0.00 0.00 179.24 176.93 2jwd h ALA 55 N 1.44 1.03 -0.89 -0.78 0.00 -1.42 -3.08 119.26 115.56 2jwd h ALA 55 Ca 0.36 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 55.04 2jwd h ALA 55 Cb -0.05 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.47 2jwd h ALA 55 CO -0.10 0.61 0.58 0.37 0.00 0.00 0.00 179.25 180.72 2jwd h GLN 56 N 0.87 1.10 -5.25 0.00 5.75 -1.37 -3.44 115.11 112.77 2jwd h GLN 56 Ca 0.17 -0.07 -0.38 0.00 -0.15 0.00 0.00 58.65 58.23 2jwd h GLN 56 Cb 0.44 -0.25 -0.14 0.00 1.07 0.00 0.00 27.48 28.60 2jwd h GLN 56 CO 0.02 0.73 -0.71 0.00 -2.65 0.00 0.00 178.83 176.21 2jwd s ALA 57 N -5.96 1.72 0.61 3.38 0.00 -1.16 -5.02 121.76 115.32 2jwd s ALA 57 Ca -0.12 -1.59 0.33 0.00 0.00 0.00 0.00 51.96 50.57 2jwd s ALA 57 Cb 0.19 0.06 1.89 0.00 0.00 0.00 0.00 23.12 25.26 2jwd s ALA 57 CO 0.80 -0.06 2.22 -1.00 0.00 0.00 0.00 175.76 177.72 2jwd h PRO 58 N 2.65 0.00 -0.01 0.00 0.13 -1.86 -3.44 132.00 129.48 2jwd h PRO 58 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2jwd h PRO 58 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2jwd h PRO 58 CO 0.63 0.00 0.00 1.17 -0.23 0.00 0.00 178.00 179.57