#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 3.72 0.17 -0.61 1.09 -1.26 -4.95 121.20 119.36 2w9p s ILE 5 Ca 0.00 0.86 -0.30 0.00 -1.10 0.00 0.00 60.65 60.11 2w9p s ILE 5 Cb 0.00 -3.59 -0.08 0.00 -1.06 0.00 0.00 42.46 37.73 2w9p s ILE 5 CO 0.00 -0.11 1.30 0.54 -0.10 0.00 0.00 174.94 176.57 2w9p s VAL 6 N 4.16 3.35 0.18 2.92 0.11 -0.21 -4.76 120.40 126.14 2w9p s VAL 6 Ca 0.70 1.06 -0.31 0.00 -2.93 0.00 0.00 61.98 60.51 2w9p s VAL 6 Cb -0.30 -3.68 -0.09 0.00 -1.53 0.00 0.00 36.38 30.78 2w9p s VAL 6 CO 0.27 0.14 1.41 0.54 -3.33 0.00 0.00 175.10 174.13 2w9p s ASN 7 N 0.54 6.76 0.01 3.54 6.03 -1.26 -1.03 114.94 129.52 2w9p s ASN 7 Ca 0.58 2.49 -0.08 0.00 -1.03 0.00 0.00 52.86 54.82 2w9p s ASN 7 Cb -0.35 -2.60 -0.05 0.00 -3.03 0.00 0.00 41.25 35.21 2w9p s ASN 7 CO 0.35 -0.66 0.29 -0.69 -2.03 0.00 0.00 177.10 174.36 2w9p s VAL 8 N 0.53 5.27 -0.28 3.54 1.01 -0.23 -4.90 120.40 125.34 2w9p s VAL 8 Ca 0.62 0.25 0.12 0.00 0.00 0.00 0.00 61.98 62.97 2w9p s VAL 8 Cb -0.39 -3.58 0.72 0.00 0.00 0.00 0.00 36.38 33.13 2w9p s VAL 8 CO 0.36 0.38 1.72 -2.65 0.00 0.00 0.00 175.10 174.91 2w9p n PRO 9 N 1.18 3.79 -2.77 2.72 -0.02 -1.26 -4.60 135.00 134.05 2w9p n PRO 9 Ca -0.11 -3.08 -0.09 0.00 -2.02 0.00 0.00 63.50 58.19 2w9p n PRO 9 Cb 0.53 -2.15 0.06 0.00 -0.02 0.00 0.00 33.50 31.91 2w9p n PRO 9 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2w9p n ASN 10 N -0.08 -2.57 0.13 2.55 2.04 -1.26 -5.04 115.26 111.04 2w9p n ASN 10 Ca 0.34 -3.40 0.18 0.00 -0.44 0.00 0.00 54.58 51.26 2w9p n ASN 10 Cb 1.25 1.74 0.77 0.00 -2.53 0.00 0.00 39.78 41.01 2w9p n ASN 10 CO 0.00 0.00 0.00 1.55 -0.44 0.00 0.00 177.26 178.37 2w9p h PRO 11 N 3.68 0.00 -0.63 -0.53 0.13 -1.91 -0.80 132.00 131.94 2w9p h PRO 11 Ca -0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 2w9p h PRO 11 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 2w9p h PRO 11 CO 0.28 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.14 2w9p n ASN 12 N -3.94 3.98 -4.75 1.44 4.13 -1.26 -4.52 115.26 110.33 2w9p n ASN 12 Ca 0.05 -2.36 -0.41 0.00 1.68 0.00 0.00 54.58 53.53 2w9p n ASN 12 Cb 0.46 -0.52 -0.02 0.00 -1.54 0.00 0.00 39.78 38.15 2w9p n ASN 12 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 2w9p s ASN 13 N -0.82 6.56 0.39 6.41 0.02 -0.31 -4.68 114.94 122.51 2w9p s ASN 13 Ca 0.42 2.77 0.14 0.00 -1.02 0.00 0.00 52.86 55.17 2w9p s ASN 13 Cb 0.27 -2.63 0.77 0.00 0.02 0.00 0.00 41.25 39.68 2w9p s ASN 13 CO 0.20 -0.77 1.34 0.71 0.02 0.00 0.00 177.10 178.60 2w9p h THR 14 N 3.46 0.00 -0.00 1.60 1.35 -1.91 -0.02 112.91 117.39 2w9p h THR 14 Ca -0.46 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.39 2w9p h THR 14 Cb 1.22 0.31 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 2w9p h THR 14 CO 0.78 0.00 -0.03 0.50 -0.25 0.00 0.00 175.52 176.51 2w9p h LYS 15 N 0.00 0.03 -0.72 4.72 1.63 -1.96 -0.53 116.57 119.74 2w9p h LYS 15 Ca 0.00 -0.03 0.04 0.00 -0.85 0.00 0.00 60.65 59.81 2w9p h LYS 15 Cb 0.74 0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 32.33 2w9p h LYS 15 CO 0.00 0.73 0.44 0.74 -3.45 0.00 0.00 179.45 177.91 2w9p h PHE 16 N -0.66 0.81 -0.58 1.91 0.05 -1.37 -0.63 116.94 116.46 2w9p h PHE 16 Ca -0.00 0.02 -0.07 0.00 3.82 0.00 0.00 57.97 61.74 2w9p h PHE 16 Cb 0.74 -0.26 -0.02 0.00 2.00 0.00 0.00 35.95 38.40 2w9p h PHE 16 CO 0.17 0.44 0.10 1.96 -0.18 0.00 0.00 178.31 180.80 2w9p h GLN 17 N 0.83 0.97 -0.99 1.51 4.20 -1.15 -0.63 115.11 119.86 2w9p h GLN 17 Ca 0.30 -0.26 0.03 0.00 0.06 0.00 0.00 58.65 58.78 2w9p h GLN 17 Cb 0.08 -0.11 -0.06 0.00 0.30 0.00 0.00 27.48 27.69 2w9p h GLN 17 CO -0.13 0.92 0.65 0.93 -0.67 0.00 0.00 178.83 180.52 2w9p h GLU 18 N 0.87 1.24 -0.46 1.46 5.08 -0.29 0.58 114.58 123.05 2w9p h GLU 18 Ca 0.18 -0.07 0.09 0.00 -1.00 0.00 0.00 59.36 58.56 2w9p h GLU 18 Cb 0.42 -0.28 -0.08 0.00 0.50 0.00 0.00 28.75 29.31 2w9p h GLU 18 CO 0.01 0.82 -0.08 -0.07 -1.00 0.00 0.00 179.01 178.69 2w9p h LEU 19 N 1.27 -0.36 0.07 1.33 4.07 -0.56 -0.39 115.31 120.75 2w9p h LEU 19 Ca 0.39 0.13 -0.00 0.00 0.08 0.00 0.00 57.88 58.48 2w9p h LEU 19 Cb -0.03 0.26 0.00 0.00 1.08 0.00 0.00 40.66 41.97 2w9p h LEU 19 CO -0.11 -0.13 -0.04 0.00 -1.08 0.00 0.00 178.44 177.08 2w9p h ALA 20 N 1.45 -0.10 0.00 1.53 0.00 0.61 -0.21 119.26 122.53 2w9p h ALA 20 Ca 0.23 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2w9p h ALA 20 Cb 0.35 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2w9p h ALA 20 CO -0.45 -0.46 0.00 0.00 0.00 0.00 0.00 179.25 178.34 2w9p h ARG 21 N -0.30 0.00 0.05 0.00 3.08 -1.03 -0.13 114.38 116.06 2w9p h ARG 21 Ca -0.01 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.93 2w9p h ARG 21 Cb 0.26 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.32 2w9p h ARG 21 CO 0.02 0.00 -0.46 0.35 -1.07 0.00 0.00 179.97 178.81 2w9p h PHE 22 N 0.00 0.36 -0.40 3.04 3.57 -0.37 -0.35 116.94 122.79 2w9p h PHE 22 Ca 0.00 -0.23 0.02 0.00 3.53 0.00 0.00 57.97 61.29 2w9p h PHE 22 Cb 0.24 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.93 2w9p h PHE 22 CO 0.00 1.12 0.27 0.00 -2.23 0.00 0.00 178.31 177.47 2w9p h ALA 23 N 0.15 1.81 -0.11 2.41 0.00 0.50 0.20 119.26 124.22 2w9p h ALA 23 Ca -0.07 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 2w9p h ALA 23 Cb 1.29 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.95 2w9p h ALA 23 CO 0.09 0.15 -0.65 0.82 0.00 0.00 0.00 179.25 179.66 2w9p h ILE 24 N 0.46 1.33 -0.69 0.00 2.04 -1.20 -0.70 117.51 118.76 2w9p h ILE 24 Ca 0.16 -1.92 0.14 0.00 1.00 0.00 0.00 64.86 64.23 2w9p h ILE 24 Cb 0.07 2.15 -0.10 0.00 -0.74 0.00 0.00 36.82 38.20 2w9p h ILE 24 CO -0.04 0.59 0.18 -0.61 0.00 0.00 0.00 178.15 178.27 2w9p h GLN 25 N 0.28 0.28 0.07 2.37 -0.00 0.79 0.03 115.11 118.94 2w9p h GLN 25 Ca -0.05 -0.02 0.02 0.00 -0.00 0.00 0.00 58.65 58.60 2w9p h GLN 25 Cb 1.29 -0.06 -0.03 0.00 0.00 0.00 0.00 27.48 28.68 2w9p h GLN 25 CO 0.13 0.19 -0.22 0.22 0.00 0.00 0.00 178.83 179.16 2w9p h ASP 26 N 0.29 -0.62 0.57 -0.69 1.82 -1.05 -1.05 116.42 115.70 2w9p h ASP 26 Ca 0.38 0.08 -0.02 0.00 -0.39 0.00 0.00 57.03 57.08 2w9p h ASP 26 Cb 0.60 0.24 -0.02 0.00 0.68 0.00 0.00 39.33 40.83 2w9p h ASP 26 CO -0.45 -0.29 -0.49 0.22 -1.61 0.00 0.00 179.24 176.61 2w9p h TYR 27 N -0.38 -1.35 -0.54 0.28 3.20 -0.04 -0.88 116.97 117.25 2w9p h TYR 27 Ca 0.04 0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.01 2w9p h TYR 27 Cb 0.42 0.51 -0.11 0.00 1.54 0.00 0.00 36.73 39.10 2w9p h TYR 27 CO -0.23 -0.68 -0.36 -0.91 -1.64 0.00 0.00 178.16 174.34 2w9p h ASN 28 N -1.04 -1.25 0.46 -2.11 4.21 -0.97 -0.14 115.58 114.74 2w9p h ASN 28 Ca -0.07 0.23 -0.16 0.00 1.21 0.00 0.00 56.30 57.51 2w9p h ASN 28 Cb 0.89 0.59 -0.01 0.00 -1.12 0.00 0.00 38.32 38.67 2w9p h ASN 28 CO -0.02 -0.32 -0.68 0.11 -1.29 0.00 0.00 177.43 175.23 2w9p h LYS 29 N -0.21 0.19 0.00 0.81 6.56 -1.15 0.26 116.57 123.03 2w9p h LYS 29 Ca 0.20 -0.15 -0.05 0.00 -1.06 0.00 0.00 60.65 59.59 2w9p h LYS 29 Cb 0.56 0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 32.24 2w9p h LYS 29 CO -0.65 0.80 -0.25 -0.22 -2.06 0.00 0.00 179.45 177.07 2w9p h LYS 30 N 0.14 0.00 -0.22 3.15 3.64 -0.38 -2.81 116.57 120.08 2w9p h LYS 30 Ca -0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2w9p h LYS 30 Cb 1.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 2w9p h LYS 30 CO 0.10 0.25 0.00 1.04 -2.27 0.00 0.00 179.45 178.57 2w9p n GLN 31 N -3.52 1.88 -3.66 1.90 1.13 -0.14 -4.97 117.38 110.00 2w9p n GLN 31 Ca -0.01 -1.75 -0.27 0.00 -1.94 0.00 0.00 57.00 53.04 2w9p n GLN 31 Cb 0.40 -1.30 -0.03 0.00 0.11 0.00 0.00 30.24 29.43 2w9p n GLN 31 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2w9p n ASN 32 N 0.77 -2.67 -4.10 1.08 4.13 -0.10 -4.96 115.26 109.41 2w9p n ASN 32 Ca 0.11 -0.56 -0.23 0.00 1.68 0.00 0.00 54.58 55.58 2w9p n ASN 32 Cb 0.41 -2.26 -0.15 0.00 -1.54 0.00 0.00 39.78 36.23 2w9p n ASN 32 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2w9p s ALA 33 N -2.91 1.24 0.71 5.41 0.00 -0.17 -5.00 121.76 121.04 2w9p s ALA 33 Ca 0.50 -0.60 -0.11 0.00 0.00 0.00 0.00 51.96 51.75 2w9p s ALA 33 Cb -0.28 -0.36 0.01 0.00 0.00 0.00 0.00 23.12 22.49 2w9p s ALA 33 CO 0.62 0.27 1.06 -1.58 0.00 0.00 0.00 175.76 176.13 2w9p s HIS 34 N -0.16 3.11 -0.30 0.00 2.46 -1.26 -4.07 115.29 115.06 2w9p s HIS 34 Ca 0.02 1.36 -0.14 0.00 0.47 0.00 0.00 55.06 56.77 2w9p s HIS 34 Cb -0.08 -2.91 0.16 0.00 -0.13 0.00 0.00 32.58 29.62 2w9p s HIS 34 CO 0.00 -1.28 0.92 -1.17 -2.47 0.00 0.00 174.74 170.74 2w9p s LEU 35 N -5.55 -0.69 0.17 8.88 2.96 -1.26 -4.59 118.68 118.60 2w9p s LEU 35 Ca 0.58 0.96 -0.18 0.00 -0.22 0.00 0.00 54.13 55.26 2w9p s LEU 35 Cb -0.14 1.79 -0.08 0.00 0.50 0.00 0.00 46.19 48.27 2w9p s LEU 35 CO 0.55 -0.13 0.65 -1.61 -1.32 0.00 0.00 176.35 174.49 2w9p s GLU 36 N 2.52 4.19 0.32 1.98 2.02 -0.24 -4.97 118.70 124.52 2w9p s GLU 36 Ca -0.03 0.76 -0.16 0.00 0.02 0.00 0.00 54.97 55.55 2w9p s GLU 36 Cb -0.07 -2.97 -0.09 0.00 0.10 0.00 0.00 34.13 31.09 2w9p s GLU 36 CO -0.18 0.47 0.76 0.12 0.02 0.00 0.00 175.26 176.44 2w9p s PHE 37 N -1.42 3.40 0.03 1.61 5.99 -1.26 -1.16 117.98 125.17 2w9p s PHE 37 Ca 0.39 1.27 0.00 0.00 0.00 0.00 0.00 56.93 58.59 2w9p s PHE 37 Cb -0.17 -2.57 0.00 0.00 0.00 0.00 0.00 43.02 40.28 2w9p s PHE 37 CO 0.20 0.10 0.00 0.28 -0.00 0.00 0.00 175.22 175.81 2w9p n VAL 38 N -0.27 0.20 -3.61 3.12 0.31 -0.34 -4.67 118.33 113.08 2w9p n VAL 38 Ca 0.03 0.07 -0.08 0.00 -0.01 0.00 0.00 64.34 64.35 2w9p n VAL 38 Cb 0.53 -0.96 -0.06 0.00 -0.91 0.00 0.00 33.84 32.44 2w9p n VAL 38 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2w9p s GLU 39 N -1.19 0.45 0.24 5.55 4.04 -0.26 -5.00 118.70 122.53 2w9p s GLU 39 Ca 0.00 0.26 -0.30 0.00 0.04 0.00 0.00 54.97 54.97 2w9p s GLU 39 Cb 0.00 0.21 -0.10 0.00 0.02 0.00 0.00 34.13 34.26 2w9p s GLU 39 CO 0.00 -0.11 1.49 -0.80 -1.84 0.00 0.00 175.26 174.01 2w9p s ASN 40 N -0.57 6.58 -0.23 0.83 0.01 -1.26 -0.96 114.94 119.33 2w9p s ASN 40 Ca 0.02 2.72 -0.17 0.00 -0.71 0.00 0.00 52.86 54.72 2w9p s ASN 40 Cb -0.02 -2.62 -0.13 0.00 0.41 0.00 0.00 41.25 38.88 2w9p s ASN 40 CO -0.04 -0.77 -0.13 0.18 -1.51 0.00 0.00 177.10 174.84 2w9p n LEU 41 N 2.57 1.91 -4.04 0.60 4.32 0.01 -4.73 117.00 117.64 2w9p n LEU 41 Ca 0.08 0.40 -0.14 0.00 -0.02 0.00 0.00 56.01 56.33 2w9p n LEU 41 Cb 0.39 -0.87 -0.12 0.00 -1.62 0.00 0.00 43.42 41.20 2w9p n LEU 41 CO 0.61 0.27 -0.41 0.20 -1.22 0.00 0.00 177.39 176.85 2w9p s ASN 42 N -6.92 0.86 -0.04 -1.43 0.02 -0.30 -4.92 114.94 102.21 2w9p s ASN 42 Ca -0.32 -0.41 -0.00 0.00 -1.02 0.00 0.00 52.86 51.11 2w9p s ASN 42 Cb 0.09 -0.01 0.03 0.00 0.02 0.00 0.00 41.25 41.38 2w9p s ASN 42 CO 0.49 -0.10 0.01 -0.69 0.02 0.00 0.00 177.10 176.83 2w9p s VAL 43 N -0.97 0.17 0.01 1.60 1.01 -1.26 -0.87 120.40 120.10 2w9p s VAL 43 Ca -0.05 0.16 0.05 0.00 0.00 0.00 0.00 61.98 62.13 2w9p s VAL 43 Cb -0.07 -0.31 -0.02 0.00 0.00 0.00 0.00 36.38 35.98 2w9p s VAL 43 CO 0.00 0.18 -0.15 -0.54 0.00 0.00 0.00 175.10 174.59 2w9p s LYS 44 N 1.46 1.09 0.04 2.72 1.02 -0.24 -1.07 119.74 124.77 2w9p s LYS 44 Ca -0.04 -0.65 0.08 0.00 0.02 0.00 0.00 55.97 55.38 2w9p s LYS 44 Cb -0.13 -1.08 -0.03 0.00 -0.52 0.00 0.00 37.83 36.07 2w9p s LYS 44 CO -0.03 0.28 -0.23 -1.21 -0.92 0.00 0.00 175.35 173.25 2w9p s GLU 45 N -0.74 1.92 -0.11 1.68 2.02 -0.20 -1.04 118.70 122.22 2w9p s GLU 45 Ca 0.04 -1.05 -0.09 0.00 0.02 0.00 0.00 54.97 53.88 2w9p s GLU 45 Cb -0.07 -2.08 0.03 0.00 0.10 0.00 0.00 34.13 32.12 2w9p s GLU 45 CO 0.00 0.53 0.30 -1.14 0.02 0.00 0.00 175.26 174.97 2w9p s GLN 46 N -1.33 0.33 -0.37 1.61 0.74 -0.32 -1.05 119.66 119.27 2w9p s GLN 46 Ca 0.13 0.46 -0.26 0.00 0.05 0.00 0.00 55.36 55.74 2w9p s GLN 46 Cb -0.10 0.11 0.02 0.00 1.10 0.00 0.00 33.01 34.14 2w9p s GLN 46 CO 0.03 -0.07 0.94 0.08 -0.55 0.00 0.00 175.29 175.73 2w9p s VAL 47 N 0.41 4.56 0.00 1.34 1.01 -1.26 -0.94 120.40 125.52 2w9p s VAL 47 Ca -0.02 1.20 0.00 0.00 0.00 0.00 0.00 61.98 63.16 2w9p s VAL 47 Cb -0.04 -4.35 0.00 0.00 0.00 0.00 0.00 36.38 31.99 2w9p s VAL 47 CO -0.02 -0.56 0.00 0.52 0.00 0.00 0.00 175.10 175.04 2w9p n VAL 48 N 6.02 0.00 -2.84 2.92 0.31 -1.26 -4.96 118.33 118.52 2w9p n VAL 48 Ca 0.07 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.23 2w9p n VAL 48 Cb 0.48 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 33.41 2w9p n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2w9p n ALA 49 N -3.00 3.41 0.00 3.52 0.00 -1.26 -4.86 120.51 118.32 2w9p n ALA 49 Ca 0.00 -3.62 0.00 0.00 0.00 0.00 0.00 53.44 49.82 2w9p n ALA 49 Cb 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 18.61 2w9p n ALA 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w9p n GLY 50 N -0.05 0.53 3.35 0.00 0.00 -1.26 -4.97 105.19 102.79 2w9p n GLY 50 Ca 0.22 -0.52 -0.15 0.00 0.00 0.00 0.00 46.02 45.57 2w9p n GLY 50 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2w9p s ILE 51 N 0.00 0.04 -0.12 -0.61 2.07 -0.14 -4.73 121.20 117.70 2w9p s ILE 51 Ca 0.00 -0.31 0.02 0.00 -1.41 0.00 0.00 60.65 58.95 2w9p s ILE 51 Cb 0.00 -0.82 0.01 0.00 0.13 0.00 0.00 42.46 41.79 2w9p s ILE 51 CO 0.00 -0.17 -0.16 -0.32 -1.91 0.00 0.00 174.94 172.38 2w9p s MET 52 N -1.54 2.38 -0.13 3.50 -2.45 -0.12 -0.77 119.30 120.18 2w9p s MET 52 Ca -0.11 -0.62 -0.04 0.00 -1.25 0.00 0.00 55.69 53.67 2w9p s MET 52 Cb -0.03 -2.03 -0.03 0.00 1.25 0.00 0.00 34.83 33.99 2w9p s MET 52 CO 0.05 -0.08 0.02 0.71 1.05 0.00 0.00 175.02 176.77 2w9p s TYR 53 N 1.03 3.19 -0.55 4.11 1.51 -0.42 -1.18 117.35 125.04 2w9p s TYR 53 Ca -0.05 0.09 -0.02 0.00 -1.01 0.00 0.00 57.07 56.08 2w9p s TYR 53 Cb -0.15 -1.91 0.14 0.00 -0.11 0.00 0.00 41.96 39.93 2w9p s TYR 53 CO -0.03 0.30 0.35 0.71 -1.11 0.00 0.00 175.55 175.77 2w9p s TYR 54 N -0.29 3.44 -0.31 2.71 1.51 -0.21 -1.09 117.35 123.11 2w9p s TYR 54 Ca 0.07 -2.69 -0.09 0.00 -1.01 0.00 0.00 57.07 53.35 2w9p s TYR 54 Cb -0.12 -3.16 0.00 0.00 -0.11 0.00 0.00 41.96 38.57 2w9p s TYR 54 CO 0.02 -0.87 0.13 0.42 -1.11 0.00 0.00 175.55 174.14 2w9p s ILE 55 N 0.26 4.33 -0.08 2.71 1.01 -0.10 -1.07 121.20 128.26 2w9p s ILE 55 Ca 0.14 -0.57 -0.12 0.00 0.00 0.00 0.00 60.65 60.11 2w9p s ILE 55 Cb -0.21 -3.24 -0.05 0.00 0.01 0.00 0.00 42.46 38.97 2w9p s ILE 55 CO -0.03 0.05 0.28 0.42 0.00 0.00 0.00 174.94 175.65 2w9p s THR 56 N 1.56 5.27 -0.13 2.92 -4.23 -0.05 -0.89 115.64 120.09 2w9p s THR 56 Ca 0.04 0.53 -0.07 0.00 -1.18 0.00 0.00 61.69 61.01 2w9p s THR 56 Cb -0.17 -3.58 0.05 0.00 1.34 0.00 0.00 72.50 70.14 2w9p s THR 56 CO 0.05 0.55 0.31 -1.48 -0.54 0.00 0.00 174.62 173.51 2w9p s LEU 57 N -0.71 0.24 0.01 4.79 2.34 -0.26 -0.81 118.68 124.28 2w9p s LEU 57 Ca 0.19 0.66 -0.26 0.00 0.06 0.00 0.00 54.13 54.78 2w9p s LEU 57 Cb -0.14 0.96 -0.05 0.00 -0.56 0.00 0.00 46.19 46.41 2w9p s LEU 57 CO 0.08 -0.17 0.79 0.00 -1.06 0.00 0.00 176.35 175.98 2w9p s ALA 58 N 1.28 3.32 -0.08 1.48 0.00 -0.14 -1.15 121.76 126.47 2w9p s ALA 58 Ca -0.09 0.29 -0.03 0.00 0.00 0.00 0.00 51.96 52.13 2w9p s ALA 58 Cb -0.09 -3.05 0.05 0.00 0.00 0.00 0.00 23.12 20.02 2w9p s ALA 58 CO -0.10 -0.04 0.16 0.00 0.00 0.00 0.00 175.76 175.78 2w9p s ALA 59 N 0.39 -0.16 -0.35 0.00 0.00 -0.17 -1.10 121.76 120.38 2w9p s ALA 59 Ca 0.41 0.56 -0.27 0.00 0.00 0.00 0.00 51.96 52.66 2w9p s ALA 59 Cb -0.20 -0.79 0.01 0.00 0.00 0.00 0.00 23.12 22.15 2w9p s ALA 59 CO 0.23 -0.53 0.98 0.95 0.00 0.00 0.00 175.76 177.38 2w9p s THR 60 N 2.21 4.56 0.30 0.00 -4.23 -0.30 -0.87 115.64 117.30 2w9p s THR 60 Ca 0.02 1.39 -0.29 0.00 -1.18 0.00 0.00 61.69 61.63 2w9p s THR 60 Cb -0.12 -4.36 -0.10 0.00 1.34 0.00 0.00 72.50 69.26 2w9p s THR 60 CO -0.06 -0.51 1.22 -0.62 -0.54 0.00 0.00 174.62 174.11 2w9p s ASP 61 N 1.80 6.99 0.00 3.99 2.15 0.08 -1.08 116.67 130.61 2w9p s ASP 61 Ca 0.41 2.49 0.00 0.00 0.43 0.00 0.00 52.55 55.87 2w9p s ASP 61 Cb -0.12 -2.64 0.00 0.00 -0.30 0.00 0.00 42.92 39.86 2w9p s ASP 61 CO 0.18 -0.37 0.56 0.47 -0.17 0.00 0.00 175.17 175.83 2w9p n ASP 62 N 1.15 0.00 -0.02 -0.34 8.00 -1.26 -1.06 116.55 123.01 2w9p n ASP 62 Ca 0.00 0.08 0.00 0.00 0.71 0.00 0.00 54.79 55.58 2w9p n ASP 62 Cb 0.43 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.45 2w9p n ASP 62 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2w9p n ALA 63 N -1.06 2.33 -2.23 2.24 0.00 -1.26 -4.77 120.51 115.76 2w9p n ALA 63 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 2w9p n ALA 63 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.46 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 0.33 0.27 2.83 0.00 0.00 -0.61 -5.05 105.19 102.95 2w9p n GLY 64 Ca 0.00 -0.65 -0.15 0.00 0.00 0.00 0.00 46.02 45.23 2w9p n GLY 64 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2w9p s LYS 65 N -4.46 0.01 -0.06 1.61 -2.85 -0.23 -5.02 119.74 108.74 2w9p s LYS 65 Ca 0.03 0.27 -0.30 0.00 -1.00 0.00 0.00 55.97 54.97 2w9p s LYS 65 Cb -0.01 -0.23 -0.04 0.00 -2.06 0.00 0.00 37.83 35.48 2w9p s LYS 65 CO 0.03 -0.18 1.42 0.21 0.10 0.00 0.00 175.35 176.93 2w9p s LYS 66 N 1.18 4.24 -0.10 1.78 2.20 -1.26 -0.74 119.74 127.05 2w9p s LYS 66 Ca -0.08 1.92 -0.02 0.00 -0.36 0.00 0.00 55.97 57.43 2w9p s LYS 66 Cb -0.12 -3.74 -0.03 0.00 -1.51 0.00 0.00 37.83 32.43 2w9p s LYS 66 CO -0.04 -0.68 -0.01 0.15 -0.36 0.00 0.00 175.35 174.41 2w9p s LYS 67 N 3.14 3.13 -0.38 4.03 -0.14 -0.05 -4.89 119.74 124.58 2w9p s LYS 67 Ca 0.63 -0.44 -0.07 0.00 -1.36 0.00 0.00 55.97 54.74 2w9p s LYS 67 Cb -0.29 -2.82 0.06 0.00 -1.68 0.00 0.00 37.83 33.11 2w9p s LYS 67 CO 0.24 0.60 0.18 0.42 -0.76 0.00 0.00 175.35 176.02 2w9p s ILE 68 N -0.59 3.90 0.38 2.17 1.01 -1.26 -0.99 121.20 125.81 2w9p s ILE 68 Ca 0.10 -1.34 0.04 0.00 0.00 0.00 0.00 60.65 59.44 2w9p s ILE 68 Cb -0.12 -3.33 -0.01 0.00 0.01 0.00 0.00 42.46 39.02 2w9p s ILE 68 CO 0.02 -0.37 0.55 -0.31 0.00 0.00 0.00 174.94 174.84 2w9p s TYR 69 N 1.38 3.17 -0.22 3.97 2.02 -0.30 -0.98 117.35 126.40 2w9p s TYR 69 Ca 0.01 -0.02 -0.04 0.00 -0.37 0.00 0.00 57.07 56.66 2w9p s TYR 69 Cb -0.21 -2.12 0.07 0.00 -0.40 0.00 0.00 41.96 39.30 2w9p s TYR 69 CO 0.02 -0.14 0.08 0.21 -1.57 0.00 0.00 175.55 174.14 2w9p s LYS 70 N -4.33 0.37 -0.04 -0.62 2.36 0.03 -1.10 119.74 116.40 2w9p s LYS 70 Ca 0.46 -0.41 -0.04 0.00 -2.55 0.00 0.00 55.97 53.44 2w9p s LYS 70 Cb -0.10 -1.81 -0.04 0.00 -1.05 0.00 0.00 37.83 34.84 2w9p s LYS 70 CO 0.34 -0.77 0.15 0.00 1.55 0.00 0.00 175.35 176.62 2w9p s ALA 71 N 1.97 3.88 -0.17 3.13 0.00 -0.07 -1.01 121.76 129.49 2w9p s ALA 71 Ca 0.03 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.26 2w9p s ALA 71 Cb -0.17 -1.86 0.03 0.00 0.00 0.00 0.00 23.12 21.12 2w9p s ALA 71 CO -0.16 0.70 -0.11 0.15 0.00 0.00 0.00 175.76 176.34 2w9p s LYS 72 N -1.63 2.03 -0.12 0.00 1.02 -0.22 -0.92 119.74 119.90 2w9p s LYS 72 Ca 0.23 -0.65 0.01 0.00 0.02 0.00 0.00 55.97 55.58 2w9p s LYS 72 Cb -0.12 -2.18 0.02 0.00 -0.52 0.00 0.00 37.83 35.02 2w9p s LYS 72 CO 0.14 -0.34 -0.14 0.42 -0.92 0.00 0.00 175.35 174.51 2w9p s ILE 73 N 1.48 1.43 -0.55 2.17 1.01 -0.25 -0.97 121.20 125.53 2w9p s ILE 73 Ca 0.02 -0.58 -0.24 0.00 0.00 0.00 0.00 60.65 59.85 2w9p s ILE 73 Cb -0.14 -1.34 0.04 0.00 0.01 0.00 0.00 42.46 41.03 2w9p s ILE 73 CO -0.09 0.43 0.92 0.86 0.00 0.00 0.00 174.94 177.06 2w9p s TRP 74 N 1.25 2.81 -0.17 3.97 -0.00 0.07 -1.30 118.94 125.57 2w9p s TRP 74 Ca -0.01 -0.07 -0.07 0.00 -0.00 0.00 0.00 56.10 55.94 2w9p s TRP 74 Cb -0.14 -4.04 -0.04 0.00 -0.00 0.00 0.00 33.47 29.25 2w9p s TRP 74 CO -0.05 -1.33 0.07 0.08 -0.00 0.00 0.00 176.95 175.71 2w9p s VAL 75 N 3.85 4.85 -0.67 5.86 1.01 0.05 -1.02 120.40 134.33 2w9p s VAL 75 Ca 0.29 -0.02 0.05 0.00 0.00 0.00 0.00 61.98 62.30 2w9p s VAL 75 Cb -0.13 -3.17 0.16 0.00 0.00 0.00 0.00 36.38 33.24 2w9p s VAL 75 CO 0.18 0.48 0.46 -0.54 0.00 0.00 0.00 175.10 175.68 2w9p s LYS 76 N 0.21 2.37 0.13 2.72 1.02 -0.18 -0.97 119.74 125.04 2w9p s LYS 76 Ca 0.05 -3.22 -0.31 0.00 0.02 0.00 0.00 55.97 52.51 2w9p s LYS 76 Cb -0.12 -3.38 -0.07 0.00 -0.52 0.00 0.00 37.83 33.74 2w9p s LYS 76 CO 0.00 -1.26 1.57 1.49 -0.92 0.00 0.00 175.35 176.23 2w9p h GLU 77 N 5.57 -0.47 0.00 1.68 4.57 -1.87 0.31 114.58 124.37 2w9p h GLU 77 Ca 0.11 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.32 2w9p h GLU 77 Cb 0.78 0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.47 2w9p h GLU 77 CO 0.71 -0.31 0.10 0.11 -1.18 0.00 0.00 179.01 178.43 2w9p h TRP 78 N -0.49 0.00 0.00 0.92 5.08 -1.94 -3.04 115.95 116.48 2w9p h TRP 78 Ca 0.07 0.00 -0.12 0.00 1.08 0.00 0.00 58.89 59.92 2w9p h TRP 78 Cb 0.64 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.78 2w9p h TRP 78 CO -0.56 0.00 -1.26 -1.91 -1.28 0.00 0.00 178.44 173.42 2w9p n GLU 79 N -3.01 0.53 0.00 0.12 2.13 -0.24 -5.02 120.64 115.15 2w9p n GLU 79 Ca -0.03 0.31 0.00 0.00 0.66 0.00 0.00 57.16 58.10 2w9p n GLU 79 Cb 0.16 -1.52 0.00 0.00 0.27 0.00 0.00 31.44 30.35 2w9p n GLU 79 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 2w9p n ASP 80 N -4.44 0.00 -4.76 4.31 3.85 0.93 -5.13 116.55 111.32 2w9p n ASP 80 Ca -0.23 0.00 -0.35 0.00 -0.71 0.00 0.00 54.79 53.51 2w9p n ASP 80 Cb 0.56 0.00 0.04 0.00 -1.35 0.00 0.00 41.12 40.37 2w9p n ASP 80 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.20 176.31 2w9p s PHE 81 N 0.00 2.46 -0.27 2.11 5.36 -0.29 -4.78 117.98 122.57 2w9p s PHE 81 Ca 0.00 1.55 -0.09 0.00 -0.96 0.00 0.00 56.93 57.43 2w9p s PHE 81 Cb 0.00 -3.34 0.12 0.00 -0.34 0.00 0.00 43.02 39.46 2w9p s PHE 81 CO 0.00 -1.98 0.58 -1.59 -1.46 0.00 0.00 175.22 170.77 2w9p s LYS 82 N -3.65 0.51 -0.18 10.12 -2.85 -1.25 -1.01 119.74 121.42 2w9p s LYS 82 Ca 0.73 1.32 0.01 0.00 -1.00 0.00 0.00 55.97 57.03 2w9p s LYS 82 Cb -0.26 0.71 0.02 0.00 -2.06 0.00 0.00 37.83 36.24 2w9p s LYS 82 CO 0.36 -0.23 -0.20 0.21 0.10 0.00 0.00 175.35 175.59 2w9p s LYS 83 N 2.82 2.94 -0.33 1.78 2.47 -0.18 -4.97 119.74 124.27 2w9p s LYS 83 Ca -0.04 -0.82 -0.29 0.00 -1.56 0.00 0.00 55.97 53.27 2w9p s LYS 83 Cb -0.12 -2.54 0.01 0.00 -1.46 0.00 0.00 37.83 33.71 2w9p s LYS 83 CO -0.17 -0.21 1.24 0.08 0.16 0.00 0.00 175.35 176.44 2w9p s VAL 84 N 1.30 4.22 0.00 4.02 1.01 -1.26 -0.75 120.40 128.95 2w9p s VAL 84 Ca 0.05 1.37 0.07 0.00 0.00 0.00 0.00 61.98 63.47 2w9p s VAL 84 Cb -0.13 -4.26 -0.24 0.00 0.00 0.00 0.00 36.38 31.75 2w9p s VAL 84 CO -0.13 -0.54 0.83 0.58 0.00 0.00 0.00 175.10 175.84 2w9p h VAL 85 N 5.96 1.11 -2.88 2.92 2.07 -1.42 -3.48 116.25 120.52 2w9p h VAL 85 Ca -0.25 -2.87 -0.13 0.00 0.82 0.00 0.00 66.70 64.27 2w9p h VAL 85 Cb 1.09 2.60 -0.24 0.00 -1.52 0.00 0.00 31.29 33.22 2w9p h VAL 85 CO 1.04 0.70 -0.28 -0.70 0.02 0.00 0.00 177.57 178.35 2w9p s GLU 86 N -2.63 0.47 -0.35 1.57 2.12 -0.99 -4.96 118.70 113.93 2w9p s GLU 86 Ca -0.05 0.38 0.01 0.00 0.36 0.00 0.00 54.97 55.67 2w9p s GLU 86 Cb 0.08 0.23 0.14 0.00 0.26 0.00 0.00 34.13 34.84 2w9p s GLU 86 CO 0.83 -0.08 0.30 0.12 -0.54 0.00 0.00 175.26 175.89 2w9p s PHE 87 N -0.09 0.03 0.44 5.30 2.19 -1.26 -1.05 117.98 123.54 2w9p s PHE 87 Ca -0.02 -0.99 0.06 0.00 0.33 0.00 0.00 56.93 56.30 2w9p s PHE 87 Cb -0.03 -0.60 -0.05 0.00 -1.31 0.00 0.00 43.02 41.03 2w9p s PHE 87 CO 0.01 -0.91 0.08 -1.59 1.83 0.00 0.00 175.22 174.64 2w9p s LYS 88 N 1.48 2.11 -0.01 10.12 -2.85 -0.18 -4.93 119.74 125.48 2w9p s LYS 88 Ca 0.16 -2.10 0.03 0.00 -1.00 0.00 0.00 55.97 53.05 2w9p s LYS 88 Cb -0.17 -1.74 -0.03 0.00 -2.06 0.00 0.00 37.83 33.83 2w9p s LYS 88 CO -0.08 -0.18 -0.07 -1.17 0.10 0.00 0.00 175.35 173.95 2w9p s LEU 89 N -3.84 3.15 0.00 2.77 2.96 -1.26 -0.79 118.68 121.67 2w9p s LEU 89 Ca 0.30 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 54.08 2w9p s LEU 89 Cb 0.06 -1.78 0.00 0.00 0.50 0.00 0.00 46.19 44.96 2w9p s LEU 89 CO 0.16 0.30 0.06 1.33 -1.32 0.00 0.00 176.35 176.88