#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w9p s ILE 5 N 0.00 3.93 -0.12 -0.61 1.09 -1.25 -3.87 121.20 120.37 2w9p s ILE 5 Ca 0.00 0.80 -0.04 0.00 -1.10 0.00 0.00 60.65 60.31 2w9p s ILE 5 Cb 0.00 -4.67 -0.04 0.00 -1.06 0.00 0.00 42.46 36.70 2w9p s ILE 5 CO 0.00 -1.34 0.03 -0.69 -0.10 0.00 0.00 174.94 172.84 2w9p s VAL 6 N 5.32 4.56 -0.34 2.92 1.01 -0.14 -4.89 120.40 128.83 2w9p s VAL 6 Ca 0.45 -0.14 -0.21 0.00 0.00 0.00 0.00 61.98 62.08 2w9p s VAL 6 Cb -0.08 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.33 2w9p s VAL 6 CO 0.24 0.57 0.64 0.20 0.00 0.00 0.00 175.10 176.76 2w9p s ASN 7 N -0.56 6.45 -0.52 3.32 -0.87 -1.26 -1.00 114.94 120.49 2w9p s ASN 7 Ca 0.10 0.23 -0.28 0.00 -1.57 0.00 0.00 52.86 51.34 2w9p s ASN 7 Cb -0.12 -2.33 0.02 0.00 -0.02 0.00 0.00 41.25 38.80 2w9p s ASN 7 CO 0.02 -0.57 1.30 -0.69 -2.57 0.00 0.00 177.10 174.59 2w9p s VAL 8 N 2.70 3.95 -1.97 1.60 1.01 -0.22 -4.83 120.40 122.64 2w9p s VAL 8 Ca 0.25 0.88 0.21 0.00 0.00 0.00 0.00 61.98 63.32 2w9p s VAL 8 Cb -0.14 -4.51 0.58 0.00 0.00 0.00 0.00 36.38 32.30 2w9p s VAL 8 CO 0.14 -1.12 1.62 -0.81 0.00 0.00 0.00 175.10 174.93 2w9p n PRO 9 N 8.35 0.63 -2.63 2.72 -0.04 -1.26 -3.65 135.00 139.12 2w9p n PRO 9 Ca 0.12 0.01 -0.20 0.00 -0.04 0.00 0.00 63.50 63.39 2w9p n PRO 9 Cb 0.49 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.46 2w9p n PRO 9 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2w9p n ASN 10 N -1.01 3.21 0.31 3.54 0.23 -1.26 -5.00 115.26 115.26 2w9p n ASN 10 Ca 0.15 -3.29 0.17 0.00 -0.53 0.00 0.00 54.58 51.09 2w9p n ASN 10 Cb 0.08 -0.50 0.98 0.00 -2.08 0.00 0.00 39.78 38.26 2w9p n ASN 10 CO 0.00 0.00 0.00 1.55 -0.93 0.00 0.00 177.26 177.88 2w9p h PRO 11 N 2.80 0.00 -0.66 -0.53 0.13 -1.95 -0.48 132.00 131.31 2w9p h PRO 11 Ca 0.12 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.14 2w9p h PRO 11 Cb 0.99 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.05 2w9p h PRO 11 CO 0.69 0.02 0.14 0.09 -0.23 0.00 0.00 178.00 178.71 2w9p n ASN 12 N -3.53 5.31 -4.66 1.44 4.13 -1.26 -4.64 115.26 112.05 2w9p n ASN 12 Ca -0.03 -3.09 -0.40 0.00 1.68 0.00 0.00 54.58 52.74 2w9p n ASN 12 Cb 0.11 -0.72 0.02 0.00 -1.54 0.00 0.00 39.78 37.65 2w9p n ASN 12 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2w9p n ASN 13 N 0.23 1.79 0.00 6.41 3.02 -0.19 -4.64 115.26 121.88 2w9p n ASN 13 Ca 0.35 1.01 0.05 0.00 -0.03 0.00 0.00 54.58 55.96 2w9p n ASN 13 Cb 1.30 -1.44 0.23 0.00 -0.61 0.00 0.00 39.78 39.26 2w9p n ASN 13 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2w9p n THR 14 N -0.69 1.20 0.04 3.41 -1.04 -1.26 -1.02 114.28 114.92 2w9p n THR 14 Ca 0.09 0.30 -0.19 0.00 -2.04 0.00 0.00 64.05 62.22 2w9p n THR 14 Cb 0.41 -1.12 -0.09 0.00 -1.82 0.00 0.00 70.33 67.71 2w9p n THR 14 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 2w9p h LYS 15 N 0.00 0.66 -0.40 -2.82 1.63 -1.97 -0.37 116.57 113.31 2w9p h LYS 15 Ca 0.00 -0.69 -0.12 0.00 -0.85 0.00 0.00 60.65 59.00 2w9p h LYS 15 Cb 0.16 0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 31.97 2w9p h LYS 15 CO 0.00 1.28 -0.21 0.74 -3.45 0.00 0.00 179.45 177.81 2w9p h PHE 16 N 0.39 0.98 -0.34 1.91 0.05 -1.37 -0.18 116.94 118.37 2w9p h PHE 16 Ca -0.11 -0.25 0.07 0.00 3.82 0.00 0.00 57.97 61.51 2w9p h PHE 16 Cb 1.64 -0.22 -0.08 0.00 2.00 0.00 0.00 35.95 39.28 2w9p h PHE 16 CO 0.09 1.02 -0.26 0.37 -0.18 0.00 0.00 178.31 179.35 2w9p h GLN 17 N 0.66 -0.21 -0.39 1.51 -0.00 -1.14 -0.07 115.11 115.46 2w9p h GLN 17 Ca 0.09 0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 58.75 2w9p h GLN 17 Cb 0.77 0.05 -0.02 0.00 0.00 0.00 0.00 27.48 28.28 2w9p h GLN 17 CO 0.06 -0.14 0.23 0.93 0.00 0.00 0.00 178.83 179.91 2w9p h GLU 18 N -0.22 0.52 -0.14 1.69 5.08 -0.46 -0.27 114.58 120.79 2w9p h GLU 18 Ca 0.17 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.43 2w9p h GLU 18 Cb 0.48 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 2w9p h GLU 18 CO -0.47 0.38 -0.12 -0.07 -1.00 0.00 0.00 179.01 177.73 2w9p h LEU 19 N 0.53 0.34 0.22 1.33 3.38 -0.54 -0.96 115.31 119.62 2w9p h LEU 19 Ca 0.14 -0.47 0.01 0.00 0.09 0.00 0.00 57.88 57.65 2w9p h LEU 19 Cb -0.01 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2w9p h LEU 19 CO -0.03 0.74 -0.27 0.00 0.09 0.00 0.00 178.44 178.97 2w9p h ALA 20 N 0.61 -0.54 -0.85 1.53 0.00 -0.78 -0.49 119.26 118.75 2w9p h ALA 20 Ca 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2w9p h ALA 20 Cb 0.64 0.41 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 2w9p h ALA 20 CO 0.03 -0.84 0.54 0.00 0.00 0.00 0.00 179.25 178.98 2w9p h ARG 21 N -0.55 1.14 -0.79 0.00 2.47 -1.13 -0.29 114.38 115.23 2w9p h ARG 21 Ca 0.00 -0.09 -0.01 0.00 -1.26 0.00 0.00 59.98 58.63 2w9p h ARG 21 Cb 0.53 -0.25 -0.04 0.00 -1.65 0.00 0.00 29.97 28.56 2w9p h ARG 21 CO -0.09 0.77 0.46 0.35 0.56 0.00 0.00 179.97 182.02 2w9p h PHE 22 N 1.16 1.05 -0.18 3.04 3.57 -0.58 -0.07 116.94 124.93 2w9p h PHE 22 Ca 0.31 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.80 2w9p h PHE 22 Cb -0.09 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.30 2w9p h PHE 22 CO 0.00 0.72 0.11 0.00 -2.23 0.00 0.00 178.31 176.90 2w9p h ALA 23 N 1.25 0.23 0.06 2.41 0.00 0.14 -0.30 119.26 123.04 2w9p h ALA 23 Ca 0.28 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.17 2w9p h ALA 23 Cb -0.02 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 2w9p h ALA 23 CO -0.05 -0.26 -0.53 0.82 0.00 0.00 0.00 179.25 179.23 2w9p h ILE 24 N 0.21 0.00 -0.96 0.00 1.08 -0.43 0.06 117.51 117.47 2w9p h ILE 24 Ca 0.06 0.00 0.17 0.00 -0.39 0.00 0.00 64.86 64.71 2w9p h ILE 24 Cb 0.03 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 33.69 2w9p h ILE 24 CO -0.01 0.00 0.61 -0.61 -0.69 0.00 0.00 178.15 177.44 2w9p h GLN 25 N -0.71 0.67 -0.32 2.37 -0.00 -0.97 -0.22 115.11 115.94 2w9p h GLN 25 Ca 0.00 -0.04 -0.04 0.00 -0.00 0.00 0.00 58.65 58.57 2w9p h GLN 25 Cb 0.73 -0.15 -0.01 0.00 0.00 0.00 0.00 27.48 28.05 2w9p h GLN 25 CO -0.32 0.45 0.03 0.22 0.00 0.00 0.00 178.83 179.20 2w9p h ASP 26 N 0.70 0.52 0.04 -0.69 1.82 0.30 -0.50 116.42 118.61 2w9p h ASP 26 Ca 0.51 -0.28 -0.05 0.00 -0.39 0.00 0.00 57.03 56.81 2w9p h ASP 26 Cb 0.87 -0.14 -0.01 0.00 0.68 0.00 0.00 39.33 40.73 2w9p h ASP 26 CO -0.27 0.68 -0.15 0.22 -1.61 0.00 0.00 179.24 178.10 2w9p h TYR 27 N 0.35 0.25 0.63 0.28 3.20 0.40 -0.48 116.97 121.60 2w9p h TYR 27 Ca 0.09 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 2w9p h TYR 27 Cb 0.39 -0.07 0.01 0.00 1.54 0.00 0.00 36.73 38.60 2w9p h TYR 27 CO 0.03 0.39 -0.30 -0.91 -1.64 0.00 0.00 178.16 175.73 2w9p h ASN 28 N 0.23 -0.72 0.22 -2.11 -0.26 -0.48 -0.36 115.58 112.09 2w9p h ASN 28 Ca 0.04 0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.81 2w9p h ASN 28 Cb 0.41 0.19 0.00 0.00 -1.06 0.00 0.00 38.32 37.86 2w9p h ASN 28 CO 0.03 -0.44 0.00 0.29 -1.06 0.00 0.00 177.43 176.24 2w9p n LYS 29 N -4.68 0.04 0.00 0.81 4.76 -0.25 -1.01 118.16 117.84 2w9p n LYS 29 Ca -0.11 0.31 0.00 0.00 -2.87 0.00 0.00 58.31 55.64 2w9p n LYS 29 Cb 0.34 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.03 2w9p n LYS 29 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2w9p n LYS 30 N -1.42 0.00 -1.74 1.97 4.81 -0.20 -4.65 118.16 116.94 2w9p n LYS 30 Ca 0.03 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 57.10 2w9p n LYS 30 Cb 0.08 -0.44 0.03 0.00 0.02 0.00 0.00 35.03 34.71 2w9p n LYS 30 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 2w9p n GLN 31 N -2.49 2.66 -0.70 1.64 7.27 -0.16 -4.85 117.38 120.75 2w9p n GLN 31 Ca 0.00 -3.24 0.00 0.00 0.07 0.00 0.00 57.00 53.83 2w9p n GLN 31 Cb 0.00 -2.23 0.00 0.00 2.41 0.00 0.00 30.24 30.42 2w9p n GLN 31 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2w9p n ASN 32 N -0.33 -3.48 -4.49 1.69 5.03 -0.18 -4.88 115.26 108.62 2w9p n ASN 32 Ca 0.54 0.00 -0.31 0.00 0.87 0.00 0.00 54.58 55.68 2w9p n ASN 32 Cb 0.35 -2.68 0.18 0.00 -1.02 0.00 0.00 39.78 36.60 2w9p n ASN 32 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2w9p n ALA 33 N 0.87 -2.34 0.09 5.41 0.00 -0.24 -4.90 120.51 119.40 2w9p n ALA 33 Ca 0.00 -0.84 0.02 0.00 0.00 0.00 0.00 53.44 52.62 2w9p n ALA 33 Cb 0.29 -1.93 0.02 0.00 0.00 0.00 0.00 19.45 17.83 2w9p n ALA 33 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2w9p n HIS 34 N -4.28 0.03 -1.97 0.00 8.25 -1.26 -4.66 115.22 111.34 2w9p n HIS 34 Ca 0.07 -0.12 -0.32 0.00 -0.26 0.00 0.00 57.72 57.09 2w9p n HIS 34 Cb 0.55 -0.01 0.01 0.00 1.12 0.00 0.00 29.99 31.66 2w9p n HIS 34 CO 0.00 0.00 0.00 -0.48 0.64 0.00 0.00 176.34 176.50 2w9p s LEU 35 N -0.44 3.39 0.03 2.41 2.34 -1.26 -3.81 118.68 121.33 2w9p s LEU 35 Ca 0.04 1.66 0.07 0.00 0.06 0.00 0.00 54.13 55.96 2w9p s LEU 35 Cb 0.03 -4.51 -0.02 0.00 -0.56 0.00 0.00 46.19 41.13 2w9p s LEU 35 CO 0.04 -1.08 -0.20 -1.61 -1.06 0.00 0.00 176.35 172.43 2w9p s GLU 36 N -4.47 1.46 0.21 1.48 8.01 -0.15 -4.94 118.70 120.29 2w9p s GLU 36 Ca 0.60 -0.88 -0.30 0.00 0.01 0.00 0.00 54.97 54.41 2w9p s GLU 36 Cb -0.14 -1.52 -0.08 0.00 -4.31 0.00 0.00 34.13 28.08 2w9p s GLU 36 CO 0.43 0.40 1.07 0.12 0.01 0.00 0.00 175.26 177.28 2w9p s PHE 37 N -0.71 3.66 -0.02 1.61 2.19 -1.26 -0.89 117.98 122.56 2w9p s PHE 37 Ca 0.07 1.68 -0.03 0.00 0.33 0.00 0.00 56.93 58.99 2w9p s PHE 37 Cb -0.08 -3.22 -0.01 0.00 -1.31 0.00 0.00 43.02 38.39 2w9p s PHE 37 CO 0.01 -0.40 -0.07 0.28 1.83 0.00 0.00 175.22 176.88 2w9p n VAL 38 N 1.92 0.41 -3.61 3.12 0.31 -0.39 -4.87 118.33 115.22 2w9p n VAL 38 Ca 0.01 0.30 -0.13 0.00 -0.01 0.00 0.00 64.34 64.51 2w9p n VAL 38 Cb 0.46 -1.55 -0.07 0.00 -0.91 0.00 0.00 33.84 31.77 2w9p n VAL 38 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 2w9p s GLU 39 N -1.47 0.74 -0.15 5.55 2.12 -0.22 -5.01 118.70 120.26 2w9p s GLU 39 Ca -0.06 0.67 -0.28 0.00 0.36 0.00 0.00 54.97 55.67 2w9p s GLU 39 Cb 0.01 0.36 -0.01 0.00 0.26 0.00 0.00 34.13 34.74 2w9p s GLU 39 CO 0.08 -0.13 0.94 -0.80 -0.54 0.00 0.00 175.26 174.81 2w9p s ASN 40 N -0.05 7.11 -0.04 -1.70 0.02 -1.26 -0.97 114.94 118.05 2w9p s ASN 40 Ca -0.01 1.37 0.06 0.00 -1.02 0.00 0.00 52.86 53.27 2w9p s ASN 40 Cb -0.04 -2.51 -0.24 0.00 0.02 0.00 0.00 41.25 38.48 2w9p s ASN 40 CO 0.00 -0.45 0.67 -0.07 0.02 0.00 0.00 177.10 177.26 2w9p h LEU 41 N 8.31 0.13 -7.00 0.60 4.07 -1.38 -3.44 115.31 116.60 2w9p h LEU 41 Ca -0.29 -0.27 0.05 0.00 0.08 0.00 0.00 57.88 57.46 2w9p h LEU 41 Cb 1.13 -0.04 -0.24 0.00 1.08 0.00 0.00 40.66 42.58 2w9p h LEU 41 CO 0.86 1.23 0.27 0.21 -1.08 0.00 0.00 178.44 179.94 2w9p s ASN 42 N -6.44 -0.65 -0.29 -0.43 3.84 -0.40 -5.00 114.94 105.58 2w9p s ASN 42 Ca -0.08 1.12 -0.00 0.00 0.21 0.00 0.00 52.86 54.10 2w9p s ASN 42 Cb 0.08 1.21 0.09 0.00 -0.55 0.00 0.00 41.25 42.07 2w9p s ASN 42 CO 0.82 -0.18 0.06 -0.69 -2.79 0.00 0.00 177.10 174.31 2w9p s VAL 43 N 0.95 1.11 0.61 -5.21 1.01 -1.26 -0.89 120.40 116.71 2w9p s VAL 43 Ca -0.04 -1.38 -0.04 0.00 0.00 0.00 0.00 61.98 60.52 2w9p s VAL 43 Cb -0.05 -1.73 0.03 0.00 0.00 0.00 0.00 36.38 34.64 2w9p s VAL 43 CO -0.11 -0.51 0.90 -0.54 0.00 0.00 0.00 175.10 174.83 2w9p s LYS 44 N 1.52 2.59 -0.26 2.72 3.01 -0.22 -1.06 119.74 128.05 2w9p s LYS 44 Ca 0.06 -0.30 -0.17 0.00 -1.01 0.00 0.00 55.97 54.55 2w9p s LYS 44 Cb -0.18 -2.30 0.07 0.00 -1.01 0.00 0.00 37.83 34.41 2w9p s LYS 44 CO -0.18 -0.86 0.65 -2.00 0.51 0.00 0.00 175.35 173.48 2w9p s GLU 45 N -5.00 0.69 0.00 1.68 -6.30 -0.17 -1.07 118.70 108.54 2w9p s GLU 45 Ca 0.56 1.11 0.00 0.00 -2.50 0.00 0.00 54.97 54.15 2w9p s GLU 45 Cb -0.11 0.18 0.00 0.00 0.00 0.00 0.00 34.13 34.20 2w9p s GLU 45 CO 0.43 -0.14 0.00 0.00 0.02 0.00 0.00 175.26 175.57 2w9p n GLN 46 N 3.95 0.00 -0.33 4.30 10.64 -0.28 -0.97 117.38 134.69 2w9p n GLN 46 Ca -0.19 0.00 0.03 0.00 -1.83 0.00 0.00 57.00 55.01 2w9p n GLN 46 Cb 0.58 0.00 -0.02 0.00 -0.86 0.00 0.00 30.24 29.94 2w9p n GLN 46 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.06 175.51 2w9p n VAL 47 N 0.00 -0.27 -0.11 -0.39 0.31 -1.26 -1.07 118.33 115.53 2w9p n VAL 47 Ca 0.00 0.23 -0.15 0.00 -0.01 0.00 0.00 64.34 64.41 2w9p n VAL 47 Cb 0.00 -0.35 -0.10 0.00 -0.91 0.00 0.00 33.84 32.48 2w9p n VAL 47 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2w9p n VAL 48 N -2.43 1.25 0.07 2.52 0.31 -1.26 -4.54 118.33 114.25 2w9p n VAL 48 Ca -0.02 -0.47 0.04 0.00 -0.01 0.00 0.00 64.34 63.89 2w9p n VAL 48 Cb 0.15 -1.29 0.46 0.00 -0.91 0.00 0.00 33.84 32.25 2w9p n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2w9p h ALA 49 N -0.04 1.73 -3.00 3.52 0.00 -1.99 -3.47 119.26 116.01 2w9p h ALA 49 Ca -0.49 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2w9p h ALA 49 Cb 1.74 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.41 2w9p h ALA 49 CO -0.09 0.23 0.00 0.41 0.00 0.00 0.00 179.25 179.80 2w9p n GLY 50 N -1.39 0.78 3.33 0.00 0.00 -1.26 -5.04 105.19 101.61 2w9p n GLY 50 Ca 0.01 0.24 -0.32 0.00 0.00 0.00 0.00 46.02 45.95 2w9p n GLY 50 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2w9p s ILE 51 N 1.62 2.59 -0.31 -0.61 -1.09 -0.32 -4.44 121.20 118.64 2w9p s ILE 51 Ca 0.00 -0.85 -0.06 0.00 -2.23 0.00 0.00 60.65 57.51 2w9p s ILE 51 Cb 0.00 -2.02 0.02 0.00 -1.58 0.00 0.00 42.46 38.88 2w9p s ILE 51 CO 0.00 0.56 0.08 -0.32 -1.23 0.00 0.00 174.94 174.02 2w9p s MET 52 N 0.03 2.88 -0.05 2.79 -2.45 -0.23 -0.91 119.30 121.35 2w9p s MET 52 Ca -0.07 -1.00 -0.16 0.00 -1.25 0.00 0.00 55.69 53.21 2w9p s MET 52 Cb -0.15 -3.38 -0.05 0.00 1.25 0.00 0.00 34.83 32.50 2w9p s MET 52 CO 0.05 -0.53 0.43 0.71 1.05 0.00 0.00 175.02 176.73 2w9p s TYR 53 N 1.45 3.64 -0.47 4.11 2.02 -0.19 -1.12 117.35 126.78 2w9p s TYR 53 Ca 0.01 0.94 -0.01 0.00 -0.37 0.00 0.00 57.07 57.64 2w9p s TYR 53 Cb -0.18 -2.40 0.13 0.00 -0.40 0.00 0.00 41.96 39.10 2w9p s TYR 53 CO 0.02 0.44 0.25 0.71 -1.57 0.00 0.00 175.55 175.40 2w9p s TYR 54 N -0.35 3.51 -0.18 2.71 1.51 -0.23 -1.09 117.35 123.24 2w9p s TYR 54 Ca 0.24 -2.71 -0.07 0.00 -1.01 0.00 0.00 57.07 53.52 2w9p s TYR 54 Cb -0.16 -3.11 -0.04 0.00 -0.11 0.00 0.00 41.96 38.54 2w9p s TYR 54 CO 0.12 -0.90 0.05 0.42 -1.11 0.00 0.00 175.55 174.13 2w9p s ILE 55 N 0.57 4.67 -0.27 2.71 1.01 -0.36 -1.05 121.20 128.48 2w9p s ILE 55 Ca 0.12 -0.08 -0.03 0.00 0.00 0.00 0.00 60.65 60.67 2w9p s ILE 55 Cb -0.22 -3.10 0.02 0.00 0.01 0.00 0.00 42.46 39.17 2w9p s ILE 55 CO -0.04 0.46 -0.01 -0.89 0.00 0.00 0.00 174.94 174.45 2w9p s THR 56 N 0.45 3.21 0.44 2.92 2.01 -0.07 -0.98 115.64 123.62 2w9p s THR 56 Ca 0.02 -0.95 0.06 0.00 0.31 0.00 0.00 61.69 61.13 2w9p s THR 56 Cb -0.13 -2.66 -0.04 0.00 0.01 0.00 0.00 72.50 69.69 2w9p s THR 56 CO 0.01 0.14 0.17 -1.48 -0.69 0.00 0.00 174.62 172.77 2w9p s LEU 57 N 1.37 2.93 -0.09 4.42 0.05 -0.29 -1.04 118.68 126.05 2w9p s LEU 57 Ca 0.00 -1.20 -0.00 0.00 0.05 0.00 0.00 54.13 52.98 2w9p s LEU 57 Cb -0.17 -1.26 0.02 0.00 -2.05 0.00 0.00 46.19 42.73 2w9p s LEU 57 CO -0.02 -0.65 -0.05 0.00 -0.55 0.00 0.00 176.35 175.08 2w9p s ALA 58 N -2.67 1.05 0.03 1.48 0.00 -0.14 -0.94 121.76 120.57 2w9p s ALA 58 Ca 0.35 -0.34 0.00 0.00 0.00 0.00 0.00 51.96 51.97 2w9p s ALA 58 Cb 0.03 -0.76 -0.03 0.00 0.00 0.00 0.00 23.12 22.36 2w9p s ALA 58 CO 0.19 -0.32 -0.04 0.00 0.00 0.00 0.00 175.76 175.59 2w9p s ALA 59 N 1.58 0.29 -0.16 0.00 0.00 -0.19 -1.06 121.76 122.23 2w9p s ALA 59 Ca 0.01 -0.78 -0.01 0.00 0.00 0.00 0.00 51.96 51.17 2w9p s ALA 59 Cb -0.13 0.17 -0.01 0.00 0.00 0.00 0.00 23.12 23.14 2w9p s ALA 59 CO -0.05 -0.20 -0.10 -0.08 0.00 0.00 0.00 175.76 175.33 2w9p s THR 60 N -2.11 3.17 -0.46 0.00 -1.32 -0.06 -0.91 115.64 113.95 2w9p s THR 60 Ca -0.09 -0.60 -0.27 0.00 -1.21 0.00 0.00 61.69 59.52 2w9p s THR 60 Cb -0.05 -2.37 0.03 0.00 -1.51 0.00 0.00 72.50 68.60 2w9p s THR 60 CO -0.03 0.50 1.03 -0.62 -2.21 0.00 0.00 174.62 173.29 2w9p s ASP 61 N 0.66 6.59 0.00 8.08 -1.08 -0.09 -0.98 116.67 129.85 2w9p s ASP 61 Ca -0.06 0.34 0.00 0.00 -0.52 0.00 0.00 52.55 52.32 2w9p s ASP 61 Cb -0.15 -2.50 0.00 0.00 -1.46 0.00 0.00 42.92 38.81 2w9p s ASP 61 CO 0.02 -1.13 0.00 -0.67 0.52 0.00 0.00 175.17 173.91 2w9p n ASP 62 N 7.46 0.00 0.00 -0.34 -0.08 -1.25 -1.11 116.55 121.24 2w9p n ASP 62 Ca 0.09 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.37 2w9p n ASP 62 Cb 0.49 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.95 2w9p n ASP 62 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2w9p n ALA 63 N 0.00 0.00 -0.35 -1.67 0.00 -1.26 -3.87 120.51 113.35 2w9p n ALA 63 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2w9p n ALA 63 Cb 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.34 2w9p n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w9p n GLY 64 N -0.08 0.78 2.95 0.00 0.00 -1.25 -5.09 105.19 102.49 2w9p n GLY 64 Ca 0.00 -0.52 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 2w9p n GLY 64 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w9p s LYS 65 N -1.54 1.84 -0.28 1.61 3.01 -0.26 -4.99 119.74 119.14 2w9p s LYS 65 Ca 0.00 -2.44 -0.29 0.00 -1.01 0.00 0.00 55.97 52.23 2w9p s LYS 65 Cb 0.00 -3.25 -0.00 0.00 -1.01 0.00 0.00 37.83 33.57 2w9p s LYS 65 CO 0.00 -1.08 1.35 0.21 0.51 0.00 0.00 175.35 176.34 2w9p s LYS 66 N -0.02 3.92 0.27 1.68 2.20 -1.26 -0.91 119.74 125.61 2w9p s LYS 66 Ca 0.16 1.34 0.10 0.00 -0.36 0.00 0.00 55.97 57.21 2w9p s LYS 66 Cb -0.24 -3.89 -0.04 0.00 -1.51 0.00 0.00 37.83 32.14 2w9p s LYS 66 CO -0.02 -1.12 -0.04 0.15 -0.36 0.00 0.00 175.35 173.97 2w9p s LYS 67 N 4.20 2.19 0.03 4.03 1.02 -0.08 -4.96 119.74 126.16 2w9p s LYS 67 Ca 0.58 -1.47 0.07 0.00 0.02 0.00 0.00 55.97 55.17 2w9p s LYS 67 Cb -0.18 -2.10 -0.03 0.00 -0.52 0.00 0.00 37.83 35.00 2w9p s LYS 67 CO 0.23 0.36 -0.19 0.96 -0.92 0.00 0.00 175.35 175.79 2w9p s ILE 68 N -2.34 2.70 0.26 2.17 -4.36 -1.26 -1.02 121.20 117.35 2w9p s ILE 68 Ca 0.31 -1.16 0.05 0.00 -0.26 0.00 0.00 60.65 59.59 2w9p s ILE 68 Cb -0.06 -2.11 -0.06 0.00 1.25 0.00 0.00 42.46 41.48 2w9p s ILE 68 CO 0.19 0.38 -0.02 -0.31 0.24 0.00 0.00 174.94 175.42 2w9p s TYR 69 N -0.88 1.78 -0.20 1.37 2.02 -0.11 -1.06 117.35 120.27 2w9p s TYR 69 Ca 0.14 -0.83 -0.03 0.00 -0.37 0.00 0.00 57.07 55.98 2w9p s TYR 69 Cb -0.10 -1.05 0.06 0.00 -0.40 0.00 0.00 41.96 40.47 2w9p s TYR 69 CO 0.04 0.11 0.04 -1.59 -1.57 0.00 0.00 175.55 172.58 2w9p s LYS 70 N -3.81 0.63 -0.02 -0.62 -2.85 -0.20 -1.13 119.74 111.74 2w9p s LYS 70 Ca 0.30 -0.44 0.01 0.00 -1.00 0.00 0.00 55.97 54.84 2w9p s LYS 70 Cb 0.05 -2.09 -0.04 0.00 -2.06 0.00 0.00 37.83 33.70 2w9p s LYS 70 CO 0.11 -0.66 0.00 0.00 0.10 0.00 0.00 175.35 174.90 2w9p s ALA 71 N 1.86 3.29 -0.15 0.59 0.00 -0.15 -1.06 121.76 126.15 2w9p s ALA 71 Ca -0.00 -0.92 0.01 0.00 0.00 0.00 0.00 51.96 51.05 2w9p s ALA 71 Cb -0.17 -1.37 0.02 0.00 0.00 0.00 0.00 23.12 21.59 2w9p s ALA 71 CO -0.09 0.64 -0.18 0.15 0.00 0.00 0.00 175.76 176.28 2w9p s LYS 72 N -1.43 2.68 -0.10 0.00 1.02 -0.13 -1.23 119.74 120.54 2w9p s LYS 72 Ca 0.18 -0.72 0.02 0.00 0.02 0.00 0.00 55.97 55.47 2w9p s LYS 72 Cb -0.11 -2.29 0.02 0.00 -0.52 0.00 0.00 37.83 34.92 2w9p s LYS 72 CO 0.09 -0.14 -0.14 0.42 -0.92 0.00 0.00 175.35 174.66 2w9p s ILE 73 N 1.16 1.39 -0.29 2.17 1.01 -0.25 -1.03 121.20 125.36 2w9p s ILE 73 Ca -0.00 -0.58 -0.19 0.00 0.00 0.00 0.00 60.65 59.87 2w9p s ILE 73 Cb -0.14 -1.28 -0.01 0.00 0.01 0.00 0.00 42.46 41.03 2w9p s ILE 73 CO -0.07 0.42 0.58 0.86 0.00 0.00 0.00 174.94 176.73 2w9p s TRP 74 N 1.01 3.23 -0.02 3.97 -0.00 0.01 -1.02 118.94 126.11 2w9p s TRP 74 Ca -0.07 0.56 0.08 0.00 -0.00 0.00 0.00 56.10 56.67 2w9p s TRP 74 Cb -0.15 -2.89 -0.02 0.00 -0.00 0.00 0.00 33.47 30.41 2w9p s TRP 74 CO -0.01 -0.41 -0.25 0.08 -0.00 0.00 0.00 176.95 176.35 2w9p s VAL 75 N 2.48 2.11 -0.39 5.86 1.01 -0.09 -0.97 120.40 130.41 2w9p s VAL 75 Ca 0.23 -1.10 0.01 0.00 0.00 0.00 0.00 61.98 61.12 2w9p s VAL 75 Cb -0.15 -1.73 0.13 0.00 0.00 0.00 0.00 36.38 34.63 2w9p s VAL 75 CO 0.11 0.57 0.21 -0.54 0.00 0.00 0.00 175.10 175.45 2w9p s LYS 76 N -0.64 0.97 0.26 2.72 1.02 -0.21 -1.17 119.74 122.69 2w9p s LYS 76 Ca 0.10 -1.66 -0.03 0.00 0.02 0.00 0.00 55.97 54.40 2w9p s LYS 76 Cb -0.10 -1.94 0.38 0.00 -0.52 0.00 0.00 37.83 35.65 2w9p s LYS 76 CO -0.01 -1.16 1.89 0.93 -0.92 0.00 0.00 175.35 176.09 2w9p h GLU 77 N 7.00 1.17 -0.56 1.68 4.39 -1.91 -0.19 114.58 126.17 2w9p h GLU 77 Ca -0.01 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.62 2w9p h GLU 77 Cb 0.95 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 2w9p h GLU 77 CO 0.41 0.78 0.00 -2.67 -1.16 0.00 0.00 179.01 176.37 2w9p n TRP 78 N -4.48 0.00 -1.86 4.33 4.27 -1.26 -2.99 117.44 115.45 2w9p n TRP 78 Ca 0.15 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.76 2w9p n TRP 78 Cb 0.16 -0.06 0.00 0.00 -1.36 0.00 0.00 31.31 30.05 2w9p n TRP 78 CO 0.00 0.00 0.00 -1.91 -2.29 0.00 0.00 177.69 173.49 2w9p n GLU 79 N -0.11 0.00 0.00 -2.67 2.13 -0.24 -4.99 120.64 114.76 2w9p n GLU 79 Ca 0.00 -0.34 0.00 0.00 0.66 0.00 0.00 57.16 57.48 2w9p n GLU 79 Cb 0.14 -0.20 0.00 0.00 0.27 0.00 0.00 31.44 31.65 2w9p n GLU 79 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2w9p n ASP 80 N 0.00 0.00 -4.76 4.31 2.03 -0.94 -4.95 116.55 112.24 2w9p n ASP 80 Ca 0.00 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.90 2w9p n ASP 80 Cb 0.55 -0.72 -0.02 0.00 -0.72 0.00 0.00 41.12 40.22 2w9p n ASP 80 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 2w9p s PHE 81 N -1.84 3.01 -0.09 -0.67 2.19 -0.29 -4.89 117.98 115.39 2w9p s PHE 81 Ca 0.00 1.31 -0.09 0.00 0.33 0.00 0.00 56.93 58.49 2w9p s PHE 81 Cb 0.00 -3.73 0.02 0.00 -1.31 0.00 0.00 43.02 38.00 2w9p s PHE 81 CO 0.00 -2.11 0.25 0.15 1.83 0.00 0.00 175.22 175.34 2w9p s LYS 82 N -1.49 0.29 -0.22 10.12 -0.14 -1.25 -1.04 119.74 126.00 2w9p s LYS 82 Ca 0.51 0.33 -0.07 0.00 -1.36 0.00 0.00 55.97 55.38 2w9p s LYS 82 Cb -0.41 0.14 0.10 0.00 -1.68 0.00 0.00 37.83 35.99 2w9p s LYS 82 CO 0.51 -0.04 0.48 0.21 -0.76 0.00 0.00 175.35 175.75 2w9p s LYS 83 N 0.11 0.39 -0.62 1.68 2.36 -0.14 -4.95 119.74 118.56 2w9p s LYS 83 Ca -0.00 1.13 -0.25 0.00 -2.55 0.00 0.00 55.97 54.29 2w9p s LYS 83 Cb -0.02 0.45 0.04 0.00 -1.05 0.00 0.00 37.83 37.26 2w9p s LYS 83 CO 0.00 -0.25 1.07 0.08 1.55 0.00 0.00 175.35 177.81 2w9p s VAL 84 N 2.68 4.16 -1.25 4.02 1.01 -1.26 -0.81 120.40 128.95 2w9p s VAL 84 Ca -0.02 0.31 0.28 0.00 0.00 0.00 0.00 61.98 62.55 2w9p s VAL 84 Cb -0.12 -4.69 0.26 0.00 0.00 0.00 0.00 36.38 31.83 2w9p s VAL 84 CO -0.14 -1.39 1.76 1.33 0.00 0.00 0.00 175.10 176.66 2w9p n VAL 85 N 6.28 0.00 -3.58 2.92 0.24 -0.20 -4.92 118.33 119.08 2w9p n VAL 85 Ca 0.02 -0.02 -0.08 0.00 -2.04 0.00 0.00 64.34 62.22 2w9p n VAL 85 Cb 0.48 -0.14 -0.04 0.00 -1.47 0.00 0.00 33.84 32.67 2w9p n VAL 85 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2w9p s GLU 86 N -2.80 0.49 -0.47 7.34 2.12 -1.00 -4.94 118.70 119.44 2w9p s GLU 86 Ca 0.19 0.01 0.05 0.00 0.36 0.00 0.00 54.97 55.57 2w9p s GLU 86 Cb 0.19 0.23 0.19 0.00 0.26 0.00 0.00 34.13 35.00 2w9p s GLU 86 CO 0.56 -0.17 0.78 0.12 -0.54 0.00 0.00 175.26 176.00 2w9p s PHE 87 N -1.63 -1.40 0.33 5.30 5.36 -1.25 -0.96 117.98 123.74 2w9p s PHE 87 Ca 0.03 -0.36 0.03 0.00 -0.96 0.00 0.00 56.93 55.67 2w9p s PHE 87 Cb -0.01 0.27 -0.02 0.00 -0.34 0.00 0.00 43.02 42.92 2w9p s PHE 87 CO -0.03 -1.08 0.50 0.15 -1.46 0.00 0.00 175.22 173.31 2w9p s LYS 88 N 1.06 3.31 0.27 10.12 3.01 -0.22 -4.93 119.74 132.36 2w9p s LYS 88 Ca 0.27 -0.63 -0.03 0.00 -1.01 0.00 0.00 55.97 54.57 2w9p s LYS 88 Cb 0.02 -2.74 -0.05 0.00 -1.01 0.00 0.00 37.83 34.05 2w9p s LYS 88 CO -0.06 0.13 0.50 -1.17 0.51 0.00 0.00 175.35 175.25 2w9p s LEU 89 N -4.24 4.11 0.00 3.17 2.96 -1.26 -1.03 118.68 122.39 2w9p s LEU 89 Ca 0.41 0.56 0.05 0.00 -0.22 0.00 0.00 54.13 54.94 2w9p s LEU 89 Cb -0.09 -3.37 0.04 0.00 0.50 0.00 0.00 46.19 43.26 2w9p s LEU 89 CO 0.33 -0.16 0.67 0.52 -1.32 0.00 0.00 176.35 176.39