#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w6b s THR 2 N 0.00 1.86 0.06 9.51 -4.23 -1.26 -0.93 115.64 120.65 1w6b s THR 2 Ca 0.00 -2.11 -0.05 0.00 -1.18 0.00 0.00 61.69 58.35 1w6b s THR 2 Cb 0.00 -1.99 -0.02 0.00 1.34 0.00 0.00 72.50 71.84 1w6b s THR 2 CO 0.00 -0.45 0.10 0.00 -0.54 0.00 0.00 174.62 173.72 1w6b s TYR 4 N -3.54 3.41 0.81 0.00 2.02 -1.07 -1.24 117.35 117.74 1w6b s TYR 4 Ca 0.03 1.03 -0.07 0.00 -0.37 0.00 0.00 57.07 57.69 1w6b s TYR 4 Cb 0.04 -2.39 0.15 0.00 -0.40 0.00 0.00 41.96 39.36 1w6b s TYR 4 CO -0.09 0.16 1.12 0.15 -1.57 0.00 0.00 175.55 175.31 1w6b s LYS 5 N -3.00 1.33 -0.11 -0.62 1.02 -0.84 -4.47 119.74 113.05 1w6b s LYS 5 Ca 0.51 -0.80 -0.05 0.00 0.02 0.00 0.00 55.97 55.64 1w6b s LYS 5 Cb -0.11 -2.14 -0.26 0.00 -0.52 0.00 0.00 37.83 34.80 1w6b s LYS 5 CO 0.21 -1.79 0.40 0.25 -0.92 0.00 0.00 175.35 173.49 1w6b n THR 6 N -3.18 1.78 -0.61 2.17 -2.24 -1.26 -4.66 114.28 106.27 1w6b n THR 6 Ca 0.15 -0.67 -0.30 0.00 -2.27 0.00 0.00 64.05 60.95 1w6b n THR 6 Cb 0.60 -1.69 0.20 0.00 -2.10 0.00 0.00 70.33 67.34 1w6b n THR 6 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1w6b n PRO 7 N -3.46 -1.50 -0.24 -0.78 -0.04 -1.26 -4.81 135.00 122.90 1w6b n PRO 7 Ca -0.31 -0.40 -0.02 0.00 -0.04 0.00 0.00 63.50 62.74 1w6b n PRO 7 Cb 1.05 -2.07 0.05 0.00 -0.04 0.00 0.00 33.50 32.48 1w6b n PRO 7 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1w6b h ILE 8 N -2.21 0.20 0.00 0.52 2.04 -2.05 -1.37 117.51 114.63 1w6b h ILE 8 Ca -0.53 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.30 1w6b h ILE 8 Cb 1.32 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 1w6b h ILE 8 CO 0.43 0.00 -0.02 -0.81 0.00 0.00 0.00 178.15 177.75 1w6b n PRO 9 N -5.47 0.81 -1.41 2.37 -0.04 -1.26 -4.89 135.00 125.11 1w6b n PRO 9 Ca 0.08 -0.15 -0.47 0.00 -0.04 0.00 0.00 63.50 62.91 1w6b n PRO 9 Cb 0.37 -1.33 -0.14 0.00 -0.04 0.00 0.00 33.50 32.36 1w6b n PRO 9 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1w6b n ILE 10 N 1.91 0.00 -4.52 0.52 5.41 -0.52 -4.88 119.36 117.28 1w6b n ILE 10 Ca 0.07 0.00 -0.25 0.00 1.00 0.00 0.00 62.75 63.56 1w6b n ILE 10 Cb 0.39 -0.50 -0.10 0.00 -0.71 0.00 0.00 39.64 38.72 1w6b n ILE 10 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 1w6b s THR 11 N 8.01 2.32 0.04 1.39 -4.23 -1.26 -4.81 115.64 117.10 1w6b s THR 11 Ca 1.30 -2.27 -0.15 0.00 -1.18 0.00 0.00 61.69 59.40 1w6b s THR 11 Cb -1.33 -2.55 -0.06 0.00 1.34 0.00 0.00 72.50 69.90 1w6b s THR 11 CO 0.54 -0.26 0.45 -0.94 -0.54 0.00 0.00 174.62 173.88 1w6b s SER 12 N -3.58 6.84 -0.00 3.99 1.04 -1.26 -1.98 113.70 118.76 1w6b s SER 12 Ca 0.32 1.02 -0.01 0.00 0.48 0.00 0.00 55.95 57.75 1w6b s SER 12 Cb 0.00 -2.27 -0.00 0.00 0.10 0.00 0.00 66.02 63.85 1w6b s SER 12 CO 0.16 0.27 0.02 -1.83 0.98 0.00 0.00 173.24 172.85 1w6b s GLU 13 N -1.28 0.14 0.48 4.02 -1.05 -0.37 -4.87 118.70 115.75 1w6b s GLU 13 Ca 0.27 -0.15 -0.22 0.00 -0.15 0.00 0.00 54.97 54.73 1w6b s GLU 13 Cb -0.17 0.05 -0.07 0.00 -0.44 0.00 0.00 34.13 33.51 1w6b s GLU 13 CO 0.16 -0.02 1.17 0.99 0.95 0.00 0.00 175.26 178.50 1w6b s THR 14 N -0.44 3.07 1.06 1.83 2.01 -1.26 -1.52 115.64 120.40 1w6b s THR 14 Ca -0.05 0.78 -0.17 0.00 0.31 0.00 0.00 61.69 62.56 1w6b s THR 14 Cb -0.03 -3.38 0.23 0.00 0.01 0.00 0.00 72.50 69.33 1w6b s THR 14 CO -0.00 -0.04 1.22 0.00 -0.69 0.00 0.00 174.62 175.11 1w6b s ALA 16 N -3.46 3.93 0.09 0.00 0.00 -1.26 -4.97 121.76 116.08 1w6b s ALA 16 Ca 0.72 -1.09 -0.33 0.00 0.00 0.00 0.00 51.96 51.26 1w6b s ALA 16 Cb -0.07 -1.80 -0.12 0.00 0.00 0.00 0.00 23.12 21.13 1w6b s ALA 16 CO 0.54 0.37 1.74 -0.35 0.00 0.00 0.00 175.76 178.07 1w6b n PRO 17 N -1.00 2.40 0.00 0.00 -0.04 -1.26 -1.93 135.00 133.17 1w6b n PRO 17 Ca -0.08 0.87 0.00 0.00 -0.04 0.00 0.00 63.50 64.26 1w6b n PRO 17 Cb 0.55 -2.70 0.00 0.00 -0.04 0.00 0.00 33.50 31.31 1w6b n PRO 17 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1w6b n GLY 18 N 3.95 1.80 4.00 0.55 0.00 -1.26 -5.08 105.19 109.15 1w6b n GLY 18 Ca 0.19 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 1w6b n GLY 18 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1w6b s GLN 19 N -0.11 2.84 0.00 1.61 -0.21 -0.82 -4.51 119.66 118.47 1w6b s GLN 19 Ca 0.00 -1.07 0.00 0.00 0.02 0.00 0.00 55.36 54.31 1w6b s GLN 19 Cb 0.00 -2.71 0.00 0.00 1.00 0.00 0.00 33.01 31.30 1w6b s GLN 19 CO 0.00 -0.29 0.00 -1.71 -2.12 0.00 0.00 175.29 171.17 1w6b n ASN 20 N -1.92 0.00 -4.30 5.90 5.15 -1.21 -4.82 115.26 114.07 1w6b n ASN 20 Ca 0.06 -0.75 -0.18 0.00 -0.60 0.00 0.00 54.58 53.12 1w6b n ASN 20 Cb 0.59 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.73 1w6b n ASN 20 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1w6b s LEU 21 N 0.00 2.50 0.09 1.20 1.43 -0.69 -4.77 118.68 118.44 1w6b s LEU 21 Ca 0.00 -0.95 0.08 0.00 -1.03 0.00 0.00 54.13 52.23 1w6b s LEU 21 Cb 0.00 -0.59 -0.04 0.00 0.03 0.00 0.00 46.19 45.59 1w6b s LEU 21 CO 0.00 -0.18 -0.17 0.00 0.23 0.00 0.00 176.35 176.22 1w6b s TYR 23 N -1.07 1.00 -0.25 0.00 -0.85 -0.60 -1.60 117.35 113.97 1w6b s TYR 23 Ca 0.17 -0.45 0.01 0.00 -0.52 0.00 0.00 57.07 56.28 1w6b s TYR 23 Cb -0.11 -0.57 0.06 0.00 0.38 0.00 0.00 41.96 41.72 1w6b s TYR 23 CO 0.09 0.00 -0.05 0.99 -1.52 0.00 0.00 175.55 175.06 1w6b s THR 24 N -1.23 1.63 -0.37 -3.49 2.01 0.00 -2.19 115.64 112.00 1w6b s THR 24 Ca -0.04 -1.36 -0.18 0.00 0.31 0.00 0.00 61.69 60.41 1w6b s THR 24 Cb -0.09 -1.91 0.00 0.00 0.01 0.00 0.00 72.50 70.50 1w6b s THR 24 CO 0.01 -0.16 0.52 -0.54 -0.69 0.00 0.00 174.62 173.77 1w6b s LYS 25 N 1.33 3.49 -0.22 4.92 3.01 0.58 -1.47 119.74 131.37 1w6b s LYS 25 Ca -0.04 -0.29 -0.08 0.00 -1.01 0.00 0.00 55.97 54.54 1w6b s LYS 25 Cb -0.19 -3.85 -0.04 0.00 -1.01 0.00 0.00 37.83 32.74 1w6b s LYS 25 CO -0.07 -0.73 0.10 0.95 0.51 0.00 0.00 175.35 176.11 1w6b s THR 26 N 2.41 4.83 0.22 2.17 -4.23 -0.52 -0.98 115.64 119.54 1w6b s THR 26 Ca 0.18 -0.01 -0.23 0.00 -1.18 0.00 0.00 61.69 60.46 1w6b s THR 26 Cb -0.15 -3.23 0.04 0.00 1.34 0.00 0.00 72.50 70.50 1w6b s THR 26 CO 0.14 0.38 0.82 -1.66 -0.54 0.00 0.00 174.62 173.76 1w6b s TRP 27 N 1.02 -0.18 -0.30 3.99 -2.14 -1.07 -1.16 118.94 119.11 1w6b s TRP 27 Ca 0.05 -0.21 -0.07 0.00 2.66 0.00 0.00 56.10 58.53 1w6b s TRP 27 Cb -0.14 0.67 0.17 0.00 -3.10 0.00 0.00 33.47 31.07 1w6b s TRP 27 CO 0.03 -1.04 0.73 0.00 -2.66 0.00 0.00 176.95 174.01 1w6b n ASP 29 N 5.38 0.00 0.15 0.00 -0.08 -1.26 -4.87 116.55 115.87 1w6b n ASP 29 Ca -0.06 0.00 -0.14 0.00 -1.51 0.00 0.00 54.79 53.08 1w6b n ASP 29 Cb 0.51 0.00 -0.08 0.00 2.34 0.00 0.00 41.12 43.89 1w6b n ASP 29 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1w6b h ALA 30 N 1.56 -0.34 0.00 -1.67 0.00 -1.99 -2.08 119.26 114.73 1w6b h ALA 30 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1w6b h ALA 30 Cb 0.00 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1w6b h ALA 30 CO 0.00 -0.62 0.00 0.91 0.00 0.00 0.00 179.25 179.54 1w6b n TRP 31 N -5.17 0.00 0.00 0.00 8.01 -1.26 -3.71 117.44 115.31 1w6b n TRP 31 Ca -0.10 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.09 1w6b n TRP 31 Cb 0.20 -0.28 0.00 0.00 -2.01 0.00 0.00 31.31 29.23 1w6b n TRP 31 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1w6b n GLY 33 N 1.95 1.51 0.00 0.00 0.00 -0.87 -1.29 105.19 106.50 1w6b n GLY 33 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1w6b n GLY 33 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1w6b n SER 34 N 3.24 0.00 -0.24 1.61 7.64 -1.26 -4.97 113.62 119.64 1w6b n SER 34 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1w6b n SER 34 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1w6b n SER 34 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1w6b n ARG 35 N -1.15 0.00 -1.13 1.43 1.85 -1.21 -4.98 116.66 111.47 1w6b n ARG 35 Ca 0.00 -0.35 -0.32 0.00 -1.00 0.00 0.00 57.85 56.18 1w6b n ARG 35 Cb 0.00 -0.23 -0.04 0.00 -1.05 0.00 0.00 32.46 31.14 1w6b n ARG 35 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1w6b n GLY 36 N 0.00 3.82 3.63 2.89 0.00 -0.41 -4.92 105.19 110.20 1w6b n GLY 36 Ca 0.00 -1.30 -0.49 0.00 0.00 0.00 0.00 46.02 44.24 1w6b n GLY 36 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1w6b n LYS 37 N 3.63 1.91 -4.31 1.61 5.02 -1.26 -3.50 118.16 121.25 1w6b n LYS 37 Ca 0.66 0.66 -0.29 0.00 -2.02 0.00 0.00 58.31 57.32 1w6b n LYS 37 Cb 0.26 -2.66 -0.11 0.00 -0.02 0.00 0.00 35.03 32.51 1w6b n LYS 37 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1w6b s VAL 38 N 5.15 2.83 -0.14 -0.18 0.11 -1.09 -5.05 120.40 122.03 1w6b s VAL 38 Ca 0.97 -1.57 -0.12 0.00 -2.93 0.00 0.00 61.98 58.33 1w6b s VAL 38 Cb -0.70 -2.32 0.04 0.00 -1.53 0.00 0.00 36.38 31.87 1w6b s VAL 38 CO 0.50 0.06 0.37 -0.63 -3.33 0.00 0.00 175.10 172.07 1w6b s ILE 39 N -1.25 -0.01 -0.28 7.04 1.01 -1.26 -2.59 121.20 123.87 1w6b s ILE 39 Ca 0.19 0.02 -0.05 0.00 0.00 0.00 0.00 60.65 60.81 1w6b s ILE 39 Cb -0.10 -0.53 0.02 0.00 0.01 0.00 0.00 42.46 41.86 1w6b s ILE 39 CO 0.11 0.01 0.03 -0.70 0.00 0.00 0.00 174.94 174.38 1w6b s GLU 40 N 0.41 2.94 0.14 2.79 2.56 -0.15 -4.79 118.70 122.60 1w6b s GLU 40 Ca -0.02 -0.94 0.04 0.00 0.00 0.00 0.00 54.97 54.06 1w6b s GLU 40 Cb -0.04 -3.23 -0.04 0.00 2.00 0.00 0.00 34.13 32.82 1w6b s GLU 40 CO -0.02 -0.45 0.16 -0.51 -0.56 0.00 0.00 175.26 173.88 1w6b s LEU 41 N 1.42 3.92 0.00 2.70 1.43 -1.26 -0.31 118.68 126.58 1w6b s LEU 41 Ca 0.01 -0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 1w6b s LEU 41 Cb -0.17 -2.53 0.00 0.00 0.03 0.00 0.00 46.19 43.51 1w6b s LEU 41 CO -0.00 0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.27 1w6b n GLY 42 N -0.23 -0.56 3.32 -3.19 0.00 -0.93 -4.83 105.19 98.76 1w6b n GLY 42 Ca -0.08 -0.69 -0.21 0.00 0.00 0.00 0.00 46.02 45.04 1w6b n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w6b s ALA 44 N -2.16 -1.79 0.56 0.00 0.00 0.39 -4.90 121.76 113.87 1w6b s ALA 44 Ca 0.16 1.63 0.26 0.00 0.00 0.00 0.00 51.96 54.00 1w6b s ALA 44 Cb -0.05 -0.55 1.55 0.00 0.00 0.00 0.00 23.12 24.06 1w6b s ALA 44 CO 0.06 -0.35 2.11 0.00 0.00 0.00 0.00 175.76 177.58 1w6b h ALA 45 N 3.82 1.95 -2.32 0.00 0.00 -1.86 -1.83 119.26 119.02 1w6b h ALA 45 Ca -0.27 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 1w6b h ALA 45 Cb 1.15 0.01 -0.20 0.00 0.00 0.00 0.00 17.79 18.76 1w6b h ALA 45 CO 0.24 -0.27 -0.09 0.95 0.00 0.00 0.00 179.25 180.07 1w6b s THR 46 N -4.80 0.03 -0.02 0.00 -4.23 -1.26 -4.59 115.64 100.78 1w6b s THR 46 Ca -0.05 -0.27 -0.39 0.00 -1.18 0.00 0.00 61.69 59.80 1w6b s THR 46 Cb 0.16 -0.76 -0.18 0.00 1.34 0.00 0.00 72.50 73.06 1w6b s THR 46 CO 0.61 -0.15 1.30 0.00 -0.54 0.00 0.00 174.62 175.84 1w6b s PRO 48 N 0.77 2.62 0.27 0.00 0.04 -1.26 -5.09 135.00 132.35 1w6b s PRO 48 Ca 0.89 0.47 0.08 0.00 0.04 0.00 0.00 61.00 62.49 1w6b s PRO 48 Cb -1.11 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 31.39 1w6b s PRO 48 CO 0.55 -1.21 0.12 0.95 0.04 0.00 0.00 177.00 177.44 1w6b s THR 49 N -3.33 3.86 0.24 1.26 -4.23 -1.26 -4.94 115.64 107.23 1w6b s THR 49 Ca 0.59 -1.64 0.05 0.00 -1.18 0.00 0.00 61.69 59.51 1w6b s THR 49 Cb -0.12 -3.12 -0.02 0.00 1.34 0.00 0.00 72.50 70.58 1w6b s THR 49 CO 0.52 -0.33 0.21 1.33 -0.54 0.00 0.00 174.62 175.81 1w6b n VAL 50 N -1.07 0.00 0.00 2.29 0.24 -1.26 -5.01 118.33 113.52 1w6b n VAL 50 Ca -0.06 -1.70 0.00 0.00 -2.04 0.00 0.00 64.34 60.54 1w6b n VAL 50 Cb 0.59 0.86 0.00 0.00 -1.47 0.00 0.00 33.84 33.82 1w6b n VAL 50 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 1w6b n GLU 51 N -0.45 1.77 0.00 7.34 0.28 -1.24 -5.05 120.64 123.30 1w6b n GLU 51 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.05 1w6b n GLU 51 Cb 0.43 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.30 1w6b n GLU 51 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1w6b n SER 52 N 0.00 0.00 0.29 -1.84 2.88 -1.26 -4.39 113.62 109.31 1w6b n SER 52 Ca 0.00 0.15 0.19 0.00 -1.33 0.00 0.00 58.87 57.88 1w6b n SER 52 Cb 0.00 -0.24 0.97 0.00 -0.75 0.00 0.00 64.21 64.20 1w6b n SER 52 CO 0.00 0.00 0.00 0.10 -1.23 0.00 0.00 175.04 173.91 1w6b h TYR 53 N 0.00 0.00 -2.73 0.66 -0.00 -1.99 -3.40 116.97 109.51 1w6b h TYR 53 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 58.73 58.06 1w6b h TYR 53 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 36.73 36.65 1w6b h TYR 53 CO 0.00 0.00 -0.50 -1.14 -0.00 0.00 0.00 178.16 176.52 1w6b s GLN 54 N -4.33 3.39 0.31 0.10 0.74 -1.26 -4.71 119.66 113.90 1w6b s GLN 54 Ca -0.04 -0.18 0.05 0.00 0.05 0.00 0.00 55.36 55.24 1w6b s GLN 54 Cb 0.13 -3.14 -0.06 0.00 1.10 0.00 0.00 33.01 31.04 1w6b s GLN 54 CO 0.43 0.76 -0.00 0.34 -0.55 0.00 0.00 175.29 176.27 1w6b s ASP 55 N -1.13 2.72 0.03 6.67 -1.08 -0.31 -3.71 116.67 119.86 1w6b s ASP 55 Ca 0.16 -1.29 -0.13 0.00 -0.52 0.00 0.00 52.55 50.77 1w6b s ASP 55 Cb -0.12 -0.16 0.02 0.00 -1.46 0.00 0.00 42.92 41.20 1w6b s ASP 55 CO 0.06 -0.47 0.29 -0.51 0.52 0.00 0.00 175.17 175.06 1w6b s ILE 56 N -3.10 0.08 -0.04 4.11 -1.16 -1.26 -1.44 121.20 118.40 1w6b s ILE 56 Ca 0.33 -0.67 -0.01 0.00 -0.51 0.00 0.00 60.65 59.80 1w6b s ILE 56 Cb 0.07 -0.86 0.03 0.00 0.61 0.00 0.00 42.46 42.30 1w6b s ILE 56 CO 0.14 -0.37 0.02 -0.54 -2.81 0.00 0.00 174.94 171.38 1w6b s LYS 57 N -2.28 0.23 -0.03 3.50 1.02 -0.54 -4.93 119.74 116.71 1w6b s LYS 57 Ca -0.07 0.17 -0.01 0.00 0.02 0.00 0.00 55.97 56.08 1w6b s LYS 57 Cb -0.02 -0.56 -0.04 0.00 -0.52 0.00 0.00 37.83 36.69 1w6b s LYS 57 CO -0.02 -0.22 0.06 0.00 -0.92 0.00 0.00 175.35 174.25 1w6b n SER 60 N -0.43 2.25 -3.72 0.00 2.88 -1.26 -0.26 113.62 113.08 1w6b n SER 60 Ca -0.02 -2.96 -0.13 0.00 -1.33 0.00 0.00 58.87 54.43 1w6b n SER 60 Cb 0.61 -0.38 -0.10 0.00 -0.75 0.00 0.00 64.21 63.59 1w6b n SER 60 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1w6b s THR 61 N -2.62 -0.01 0.35 2.46 -4.23 -1.26 -4.78 115.64 105.54 1w6b s THR 61 Ca 0.28 0.02 0.09 0.00 -1.18 0.00 0.00 61.69 60.90 1w6b s THR 61 Cb 0.25 -0.60 0.33 0.00 1.34 0.00 0.00 72.50 73.81 1w6b s THR 61 CO 0.03 0.01 1.83 -2.24 -0.54 0.00 0.00 174.62 173.71 1w6b h ASP 62 N 5.82 0.67 0.02 3.99 2.03 -0.97 0.29 116.42 128.27 1w6b h ASP 62 Ca -0.29 0.06 0.00 0.00 -0.73 0.00 0.00 57.03 56.07 1w6b h ASP 62 Cb 1.18 -0.07 0.00 0.00 -0.83 0.00 0.00 39.33 39.61 1w6b h ASP 62 CO 0.25 0.29 0.00 -0.78 -1.03 0.00 0.00 179.24 177.97 1w6b h ASP 63 N 0.68 0.00 -0.01 4.15 3.58 -1.96 0.79 116.42 123.65 1w6b h ASP 63 Ca 0.50 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.95 1w6b h ASP 63 Cb 0.87 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.92 1w6b h ASP 63 CO -0.26 0.00 -0.60 0.00 -2.88 0.00 0.00 179.24 175.50 1w6b n ASN 65 N -0.80 3.77 -0.69 0.00 5.15 0.27 -4.80 115.26 118.17 1w6b n ASN 65 Ca 0.05 -3.53 0.00 0.00 -0.60 0.00 0.00 54.58 50.50 1w6b n ASN 65 Cb 0.31 -0.59 0.00 0.00 -0.53 0.00 0.00 39.78 38.97 1w6b n ASN 65 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1w6b n PRO 66 N 0.05 2.36 -3.39 1.20 -0.04 -1.22 -2.59 135.00 131.37 1w6b n PRO 66 Ca 0.30 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.33 1w6b n PRO 66 Cb 0.43 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.80 1w6b n PRO 66 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1w6b s HIS 67 N 1.58 3.21 0.63 0.54 2.46 -1.26 -4.95 115.29 117.49 1w6b s HIS 67 Ca 0.00 -0.54 0.24 0.00 0.47 0.00 0.00 55.06 55.23 1w6b s HIS 67 Cb 0.00 -2.79 1.19 0.00 -0.13 0.00 0.00 32.58 30.85 1w6b s HIS 67 CO 0.00 -0.67 1.66 -1.35 -2.47 0.00 0.00 174.74 171.91 1w6b h PRO 68 N 8.69 0.00 0.70 2.88 0.11 -1.98 -2.29 132.00 140.12 1w6b h PRO 68 Ca -0.27 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.81 1w6b h PRO 68 Cb 1.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1w6b h PRO 68 CO 0.78 0.00 -0.45 -0.22 -0.21 0.00 0.00 178.00 177.90 1w6b h LYS 69 N 0.00 -1.05 0.00 1.05 1.63 -2.01 -1.61 116.57 114.58 1w6b h LYS 69 Ca 0.15 0.07 0.00 0.00 -0.85 0.00 0.00 60.65 60.02 1w6b h LYS 69 Cb 1.41 0.24 0.00 0.00 -0.60 0.00 0.00 32.23 33.28 1w6b h LYS 69 CO -0.00 -0.70 0.00 0.00 -3.45 0.00 0.00 179.45 175.30 1w6b n GLN 70 N -5.58 0.45 -4.10 1.90 10.64 -0.86 -4.70 117.38 115.12 1w6b n GLN 70 Ca -0.14 0.04 -0.32 0.00 -1.83 0.00 0.00 57.00 54.75 1w6b n GLN 70 Cb 0.46 -1.50 -0.07 0.00 -0.86 0.00 0.00 30.24 28.27 1w6b n GLN 70 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 1w6b s LYS 71 N -2.18 3.00 -0.33 2.61 -0.14 -0.61 -5.10 119.74 116.99 1w6b s LYS 71 Ca 0.23 -0.55 -0.00 0.00 -1.36 0.00 0.00 55.97 54.29 1w6b s LYS 71 Cb 0.12 -2.81 0.08 0.00 -1.68 0.00 0.00 37.83 33.53 1w6b s LYS 71 CO 0.22 0.62 0.04 0.50 -0.76 0.00 0.00 175.35 175.97 1w6b s ARG 72 N -1.90 2.09 0.00 1.68 3.52 -1.26 -4.90 118.95 118.18 1w6b s ARG 72 Ca 0.24 -1.55 0.20 0.00 -0.13 0.00 0.00 55.73 54.49 1w6b s ARG 72 Cb -0.12 -3.24 1.19 0.00 -1.56 0.00 0.00 34.95 31.21 1w6b s ARG 72 CO 0.16 -0.80 1.58 -0.35 -0.81 0.00 0.00 175.30 175.08