#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jwu s THR 2 N 0.00 2.37 -0.16 4.28 2.01 -1.26 -1.73 115.64 121.15 2jwu s THR 2 Ca 0.00 -1.05 -0.08 0.00 0.31 0.00 0.00 61.69 60.87 2jwu s THR 2 Cb 0.00 -2.12 -0.04 0.00 0.01 0.00 0.00 72.50 70.34 2jwu s THR 2 CO 0.00 0.35 0.11 -0.31 -0.69 0.00 0.00 174.62 174.09 2jwu s TYR 3 N 1.28 3.43 -0.08 4.92 2.02 0.39 -4.83 117.35 124.48 2jwu s TYR 3 Ca 0.01 0.35 0.02 0.00 -0.37 0.00 0.00 57.07 57.09 2jwu s TYR 3 Cb -0.15 -2.05 -0.02 0.00 -0.40 0.00 0.00 41.96 39.34 2jwu s TYR 3 CO -0.09 0.43 -0.15 0.21 -1.57 0.00 0.00 175.55 174.38 2jwu s LYS 4 N -0.17 2.86 -0.02 -0.62 2.20 -1.01 0.87 119.74 123.85 2jwu s LYS 4 Ca 0.10 -0.71 0.01 0.00 -0.36 0.00 0.00 55.97 55.00 2jwu s LYS 4 Cb -0.12 -2.45 0.02 0.00 -1.51 0.00 0.00 37.83 33.77 2jwu s LYS 4 CO 0.01 0.44 -0.01 -1.17 -0.36 0.00 0.00 175.35 174.25 2jwu s LEU 5 N -0.24 1.49 -0.04 5.43 2.96 -0.97 0.42 118.68 127.74 2jwu s LEU 5 Ca 0.01 -0.03 0.01 0.00 -0.22 0.00 0.00 54.13 53.90 2jwu s LEU 5 Cb -0.13 -0.18 0.02 0.00 0.50 0.00 0.00 46.19 46.40 2jwu s LEU 5 CO 0.03 -0.05 -0.04 0.27 -1.32 0.00 0.00 176.35 175.24 2jwu s ILE 6 N 0.59 0.50 -0.08 6.68 -5.25 -0.97 -1.90 121.20 120.78 2jwu s ILE 6 Ca -0.06 -0.12 0.04 0.00 -0.99 0.00 0.00 60.65 59.52 2jwu s ILE 6 Cb -0.09 -0.52 -0.01 0.00 2.95 0.00 0.00 42.46 44.79 2jwu s ILE 6 CO -0.01 0.21 -0.21 -0.76 -1.79 0.00 0.00 174.94 172.37 2jwu s LEU 7 N 0.78 2.28 -0.10 0.37 1.02 -0.14 -2.44 118.68 120.45 2jwu s LEU 7 Ca -0.10 -0.45 0.04 0.00 0.02 0.00 0.00 54.13 53.64 2jwu s LEU 7 Cb -0.13 -1.45 -0.00 0.00 0.02 0.00 0.00 46.19 44.63 2jwu s LEU 7 CO 0.00 0.23 -0.24 0.20 0.02 0.00 0.00 176.35 176.56 2jwu s ASN 8 N -0.06 3.03 0.47 2.29 0.01 -1.01 -2.14 114.94 117.53 2jwu s ASN 8 Ca -0.06 -0.55 0.00 0.00 -0.71 0.00 0.00 52.86 51.55 2jwu s ASN 8 Cb -0.14 -1.35 -0.00 0.00 0.41 0.00 0.00 41.25 40.17 2jwu s ASN 8 CO 0.05 0.16 0.01 0.18 -1.51 0.00 0.00 177.10 175.98 2jwu n LEU 9 N 3.50 0.00 -1.92 0.60 4.77 -1.07 -1.10 117.00 121.77 2jwu n LEU 9 Ca -0.19 -2.99 -0.07 0.00 -0.03 0.00 0.00 56.01 52.74 2jwu n LEU 9 Cb 0.53 0.37 0.27 0.00 -2.33 0.00 0.00 43.42 42.26 2jwu n LEU 9 CO 0.28 -0.42 1.00 1.17 -1.33 0.00 0.00 177.39 178.08 2jwu n LYS 10 N -1.17 3.39 0.00 3.23 4.81 -1.24 -4.42 118.16 122.76 2jwu n LYS 10 Ca -0.19 -2.77 0.00 0.00 -0.87 0.00 0.00 58.31 54.48 2jwu n LYS 10 Cb 0.60 -2.13 0.00 0.00 0.02 0.00 0.00 35.03 33.52 2jwu n LYS 10 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2jwu n GLN 11 N -0.17 0.00 -4.08 1.64 6.02 -1.26 -5.13 117.38 114.40 2jwu n GLN 11 Ca 0.39 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 57.24 2jwu n GLN 11 Cb 1.32 -0.08 -0.13 0.00 1.02 0.00 0.00 30.24 32.37 2jwu n GLN 11 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jwu s ALA 12 N -1.57 0.45 -0.16 -1.58 0.00 -1.26 -5.14 121.76 112.49 2jwu s ALA 12 Ca 0.00 -0.51 0.01 0.00 0.00 0.00 0.00 51.96 51.46 2jwu s ALA 12 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.12 2jwu s ALA 12 CO 0.00 0.01 -0.17 0.15 0.00 0.00 0.00 175.76 175.76 2jwu s LYS 13 N -0.94 3.16 -0.03 0.00 1.02 -1.26 -2.61 119.74 119.06 2jwu s LYS 13 Ca -0.06 -0.77 0.05 0.00 0.02 0.00 0.00 55.97 55.21 2jwu s LYS 13 Cb -0.06 -2.60 -0.01 0.00 -0.52 0.00 0.00 37.83 34.64 2jwu s LYS 13 CO 0.00 -0.03 -0.17 -1.21 -0.92 0.00 0.00 175.35 173.02 2jwu s GLU 14 N 0.91 1.63 -0.06 1.68 0.41 -0.91 -5.04 118.70 117.33 2jwu s GLU 14 Ca -0.04 -0.60 -0.07 0.00 -0.41 0.00 0.00 54.97 53.85 2jwu s GLU 14 Cb -0.15 -1.47 0.02 0.00 -1.78 0.00 0.00 34.13 30.75 2jwu s GLU 14 CO -0.02 0.28 0.19 -1.21 -0.49 0.00 0.00 175.26 174.00 2jwu s GLU 15 N -0.10 0.29 0.37 1.61 2.02 -1.26 -0.96 118.70 120.67 2jwu s GLU 15 Ca -0.00 0.12 -0.10 0.00 0.02 0.00 0.00 54.97 55.01 2jwu s GLU 15 Cb -0.10 0.13 0.03 0.00 0.10 0.00 0.00 34.13 34.30 2jwu s GLU 15 CO 0.01 -0.05 0.66 0.00 0.02 0.00 0.00 175.26 175.90 2jwu s ALA 16 N -0.23 -0.07 -0.02 5.21 0.00 -0.80 -5.03 121.76 120.82 2jwu s ALA 16 Ca -0.03 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.84 2jwu s ALA 16 Cb -0.03 0.88 0.02 0.00 0.00 0.00 0.00 23.12 23.99 2jwu s ALA 16 CO 0.01 -0.90 -0.01 -1.50 0.00 0.00 0.00 175.76 173.36 2jwu s ILE 17 N -2.59 0.15 -0.02 0.00 1.10 -1.26 -2.28 121.20 116.30 2jwu s ILE 17 Ca 0.22 0.03 0.02 0.00 -0.51 0.00 0.00 60.65 60.41 2jwu s ILE 17 Cb -0.03 -0.21 0.00 0.00 0.15 0.00 0.00 42.46 42.37 2jwu s ILE 17 CO 0.16 0.10 -0.07 -0.54 -2.11 0.00 0.00 174.94 172.47 2jwu s LYS 18 N 0.61 0.73 -0.00 3.50 -0.14 0.25 -4.98 119.74 119.70 2jwu s LYS 18 Ca -0.06 -0.26 -0.16 0.00 -1.36 0.00 0.00 55.97 54.14 2jwu s LYS 18 Cb -0.09 -0.70 -0.06 0.00 -1.68 0.00 0.00 37.83 35.30 2jwu s LYS 18 CO -0.01 0.12 0.44 -1.83 -0.76 0.00 0.00 175.35 173.30 2jwu s GLU 19 N 0.07 4.01 0.22 1.68 -1.05 -1.26 0.15 118.70 122.52 2jwu s GLU 19 Ca -0.01 0.46 0.03 0.00 -0.15 0.00 0.00 54.97 55.30 2jwu s GLU 19 Cb -0.06 -3.25 -0.01 0.00 -0.44 0.00 0.00 34.13 30.37 2jwu s GLU 19 CO -0.00 0.62 0.23 1.28 0.95 0.00 0.00 175.26 178.34 2jwu n LEU 20 N 2.03 0.00 -0.10 1.83 4.77 -0.70 -4.84 117.00 119.99 2jwu n LEU 20 Ca -0.13 -2.03 -0.23 0.00 -0.03 0.00 0.00 56.01 53.59 2jwu n LEU 20 Cb 0.52 1.30 -0.12 0.00 -2.33 0.00 0.00 43.42 42.79 2jwu n LEU 20 CO 0.39 -0.38 -1.04 1.33 -1.33 0.00 0.00 177.39 176.36 2jwu n VAL 21 N -0.41 1.58 -4.28 4.08 0.24 -1.26 0.75 118.33 119.04 2jwu n VAL 21 Ca 0.04 -0.38 -0.17 0.00 -2.04 0.00 0.00 64.34 61.78 2jwu n VAL 21 Cb 0.40 -1.80 -0.06 0.00 -1.47 0.00 0.00 33.84 30.91 2jwu n VAL 21 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2jwu n ASP 22 N -3.93 -0.12 0.08 -1.34 2.03 -1.26 -4.59 116.55 107.42 2jwu n ASP 22 Ca -0.42 -2.78 -0.23 0.00 0.52 0.00 0.00 54.79 51.89 2jwu n ASP 22 Cb 0.89 1.22 -0.15 0.00 -0.72 0.00 0.00 41.12 42.36 2jwu n ASP 22 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jwu h ALA 23 N 1.79 0.03 -0.59 -1.67 0.00 -1.97 -2.54 119.26 114.30 2jwu h ALA 23 Ca -0.21 -0.99 0.12 0.00 0.00 0.00 0.00 54.91 53.83 2jwu h ALA 23 Cb 0.98 0.33 -0.11 0.00 0.00 0.00 0.00 17.79 18.99 2jwu h ALA 23 CO 0.31 0.79 -0.17 0.00 0.00 0.00 0.00 179.25 180.19 2jwu h ALA 24 N 0.08 0.35 -0.33 0.00 0.00 -1.99 0.90 119.26 118.28 2jwu h ALA 24 Ca -0.28 0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 2jwu h ALA 24 Cb 1.98 0.48 -0.00 0.00 0.00 0.00 0.00 17.79 20.25 2jwu h ALA 24 CO 0.18 -0.45 -0.35 1.15 0.00 0.00 0.00 179.25 179.78 2jwu h THR 25 N -0.02 1.29 -0.11 0.00 2.02 -2.00 -2.80 112.91 111.29 2jwu h THR 25 Ca 0.28 -1.52 0.04 0.00 0.77 0.00 0.00 66.41 65.98 2jwu h THR 25 Cb 0.45 1.51 -0.06 0.00 -1.74 0.00 0.00 68.15 68.31 2jwu h THR 25 CO -0.62 0.50 -0.30 0.00 0.37 0.00 0.00 175.52 175.47 2jwu h ALA 26 N 0.73 -0.35 -1.01 6.16 0.00 -0.36 0.30 119.26 124.73 2jwu h ALA 26 Ca 0.05 0.02 0.26 0.00 0.00 0.00 0.00 54.91 55.23 2jwu h ALA 26 Cb 0.93 0.56 -0.08 0.00 0.00 0.00 0.00 17.79 19.21 2jwu h ALA 26 CO 0.09 -0.78 0.67 0.93 0.00 0.00 0.00 179.25 180.15 2jwu h GLU 27 N -0.38 0.33 0.06 0.00 5.08 0.74 1.78 114.58 122.19 2jwu h GLU 27 Ca 0.09 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2jwu h GLU 27 Cb 0.52 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2jwu h GLU 27 CO -0.33 0.22 -0.03 -0.22 -1.00 0.00 0.00 179.01 177.66 2jwu h LYS 28 N 0.34 -0.07 0.42 2.33 1.63 -0.27 -1.66 116.57 119.29 2jwu h LYS 28 Ca 0.55 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 60.33 2jwu h LYS 28 Cb 1.49 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 33.14 2jwu h LYS 28 CO -0.22 0.37 -0.20 -0.92 -3.45 0.00 0.00 179.45 175.03 2jwu h TYR 29 N -0.54 -0.52 -0.28 1.91 5.03 0.12 -2.71 116.97 119.98 2jwu h TYR 29 Ca -0.01 -0.01 0.07 0.00 2.58 0.00 0.00 58.73 61.36 2jwu h TYR 29 Cb 0.48 0.17 -0.07 0.00 1.55 0.00 0.00 36.73 38.86 2jwu h TYR 29 CO 0.08 -0.28 -0.22 0.74 -1.32 0.00 0.00 178.16 177.16 2jwu h PHE 30 N -1.12 -0.57 -0.22 -3.82 0.04 0.25 0.01 116.94 111.51 2jwu h PHE 30 Ca -0.06 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.75 2jwu h PHE 30 Cb 0.47 0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.91 2jwu h PHE 30 CO 0.01 -0.30 0.14 -0.22 -0.60 0.00 0.00 178.31 177.34 2jwu h LYS 31 N -0.20 0.30 -0.08 1.51 3.64 -1.41 -0.85 116.57 119.47 2jwu h LYS 31 Ca 0.15 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.39 2jwu h LYS 31 Cb 0.44 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 2jwu h LYS 31 CO -0.40 0.20 -0.48 -0.07 -2.27 0.00 0.00 179.45 176.44 2jwu h LEU 32 N 0.31 0.22 -0.01 5.20 4.07 -0.72 -1.96 115.31 122.42 2jwu h LEU 32 Ca 0.08 -0.10 -0.01 0.00 0.08 0.00 0.00 57.88 57.93 2jwu h LEU 32 Cb -0.02 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 41.66 2jwu h LEU 32 CO -0.02 0.66 -0.02 0.22 -1.08 0.00 0.00 178.44 178.20 2jwu h TYR 33 N 0.16 0.04 0.00 1.13 5.03 0.23 -1.55 116.97 122.01 2jwu h TYR 33 Ca 0.01 -0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.28 2jwu h TYR 33 Cb 0.90 -0.01 -0.00 0.00 1.55 0.00 0.00 36.73 39.17 2jwu h TYR 33 CO 0.01 0.63 -0.11 0.00 -1.32 0.00 0.00 178.16 177.38 2jwu h ALA 34 N 0.40 1.39 0.00 1.82 0.00 -1.31 0.65 119.26 122.21 2jwu h ALA 34 Ca -0.00 -0.10 -0.20 0.00 0.00 0.00 0.00 54.91 54.61 2jwu h ALA 34 Cb 0.63 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 2jwu h ALA 34 CO 0.01 0.13 -1.22 -0.91 0.00 0.00 0.00 179.25 177.26 2jwu h ASN 35 N 0.00 0.00 0.10 0.00 2.35 -1.33 -3.06 115.58 113.64 2jwu h ASN 35 Ca -0.00 0.00 -0.36 0.00 -0.55 0.00 0.00 56.30 55.39 2jwu h ASN 35 Cb 0.27 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.62 2jwu h ASN 35 CO 0.01 0.78 -2.02 0.00 -1.65 0.00 0.00 177.43 174.55 2jwu n ALA 36 N -2.40 0.96 0.03 -0.83 0.00 -0.59 -4.64 120.51 113.04 2jwu n ALA 36 Ca -0.07 -0.66 -0.01 0.00 0.00 0.00 0.00 53.44 52.70 2jwu n ALA 36 Cb 0.90 -0.58 -0.01 0.00 0.00 0.00 0.00 19.45 19.76 2jwu n ALA 36 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2jwu h LYS 37 N -0.03 -0.09 0.00 0.00 1.79 0.13 -3.49 116.57 114.89 2jwu h LYS 37 Ca -0.45 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.03 2jwu h LYS 37 Cb 1.96 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 32.63 2jwu h LYS 37 CO 0.04 -0.06 0.00 0.25 -1.08 0.00 0.00 179.45 178.60 2jwu n THR 38 N -2.63 0.00 -2.92 -0.16 -2.24 -1.15 -5.07 114.28 100.10 2jwu n THR 38 Ca -0.01 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.58 2jwu n THR 38 Cb 0.04 -0.48 0.04 0.00 -2.10 0.00 0.00 70.33 67.82 2jwu n THR 38 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2jwu s VAL 39 N 1.66 2.65 -0.25 2.28 -7.23 -1.24 -4.27 120.40 114.00 2jwu s VAL 39 Ca 0.00 -0.91 -0.10 0.00 -1.81 0.00 0.00 61.98 59.16 2jwu s VAL 39 Cb 0.00 -2.74 -0.05 0.00 0.56 0.00 0.00 36.38 34.15 2jwu s VAL 39 CO 0.00 0.00 0.15 -0.70 -0.31 0.00 0.00 175.10 174.24 2jwu s GLU 40 N -4.57 3.99 0.00 4.82 2.12 -1.26 -4.73 118.70 119.06 2jwu s GLU 40 Ca 0.58 -0.31 0.00 0.00 0.36 0.00 0.00 54.97 55.60 2jwu s GLU 40 Cb -0.09 -3.54 0.00 0.00 0.26 0.00 0.00 34.13 30.77 2jwu s GLU 40 CO 0.36 -0.03 0.00 0.41 -0.54 0.00 0.00 175.26 175.47 2jwu n GLY 41 N 4.54 5.21 3.70 -1.50 0.00 -1.24 -4.91 105.19 110.99 2jwu n GLY 41 Ca -0.15 -0.79 -0.32 0.00 0.00 0.00 0.00 46.02 44.75 2jwu n GLY 41 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jwu s VAL 42 N 3.14 2.23 -0.19 1.61 -7.23 0.17 -4.75 120.40 115.38 2jwu s VAL 42 Ca 0.00 0.09 -0.03 0.00 -1.81 0.00 0.00 61.98 60.23 2jwu s VAL 42 Cb 0.00 -2.39 0.06 0.00 0.56 0.00 0.00 36.38 34.61 2jwu s VAL 42 CO 0.00 -0.08 0.06 0.26 -0.31 0.00 0.00 175.10 175.02 2jwu s TRP 43 N -2.37 0.76 -0.26 2.82 0.52 -1.26 -2.35 118.94 116.80 2jwu s TRP 43 Ca 0.70 -0.71 0.03 0.00 0.02 0.00 0.00 56.10 56.14 2jwu s TRP 43 Cb -0.25 -0.93 0.06 0.00 -1.15 0.00 0.00 33.47 31.19 2jwu s TRP 43 CO 0.53 -0.59 -0.09 0.95 0.02 0.00 0.00 176.95 177.76 2jwu s THR 44 N 1.95 2.05 0.37 2.01 -4.23 0.31 -4.98 115.64 113.11 2jwu s THR 44 Ca 0.00 -1.59 -0.05 0.00 -1.18 0.00 0.00 61.69 58.87 2jwu s THR 44 Cb -0.17 -2.20 -0.05 0.00 1.34 0.00 0.00 72.50 71.42 2jwu s THR 44 CO -0.09 -0.07 0.66 -0.47 -0.54 0.00 0.00 174.62 174.11 2jwu s TYR 45 N 1.15 3.50 -0.20 3.99 5.04 -1.26 -0.21 117.35 129.36 2jwu s TYR 45 Ca -0.08 0.73 0.01 0.00 -2.44 0.00 0.00 57.07 55.30 2jwu s TYR 45 Cb -0.20 -2.20 0.04 0.00 0.35 0.00 0.00 41.96 39.96 2jwu s TYR 45 CO -0.05 -0.01 -0.10 0.15 -1.34 0.00 0.00 175.55 174.20 2jwu s LYS 46 N -4.02 1.98 -0.29 4.97 -0.14 0.12 -4.94 119.74 117.43 2jwu s LYS 46 Ca 0.46 -0.84 0.04 0.00 -1.36 0.00 0.00 55.97 54.27 2jwu s LYS 46 Cb -0.10 -2.41 0.48 0.00 -1.68 0.00 0.00 37.83 34.12 2jwu s LYS 46 CO 0.35 -0.44 1.59 -0.25 -0.76 0.00 0.00 175.35 175.84 2jwu n ASP 47 N 4.69 3.65 -0.07 2.83 8.00 -1.26 -2.36 116.55 132.02 2jwu n ASP 47 Ca -0.14 -3.04 -0.06 0.00 0.71 0.00 0.00 54.79 52.26 2jwu n ASP 47 Cb 0.46 -0.72 -0.13 0.00 -0.02 0.00 0.00 41.12 40.71 2jwu n ASP 47 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2jwu n GLU 48 N -0.47 1.20 -0.92 -1.24 -0.58 -1.26 -4.76 120.64 112.61 2jwu n GLU 48 Ca 0.38 -0.03 -0.05 0.00 -0.42 0.00 0.00 57.16 57.04 2jwu n GLU 48 Cb 1.25 -1.42 -0.05 0.00 -0.57 0.00 0.00 31.44 30.65 2jwu n GLU 48 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 2jwu n THR 49 N -2.54 0.00 -3.08 2.62 -1.04 -1.26 -5.06 114.28 103.93 2jwu n THR 49 Ca -0.23 -0.07 -0.14 0.00 -2.04 0.00 0.00 64.05 61.57 2jwu n THR 49 Cb 0.95 0.43 0.01 0.00 -1.82 0.00 0.00 70.33 69.91 2jwu n THR 49 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2jwu n LYS 50 N 0.03 -2.07 -3.73 -2.82 4.01 -1.11 -4.74 118.16 107.74 2jwu n LYS 50 Ca -0.19 1.80 -0.15 0.00 -0.51 0.00 0.00 58.31 59.26 2jwu n LYS 50 Cb 0.69 -4.76 -0.15 0.00 -0.51 0.00 0.00 35.03 30.30 2jwu n LYS 50 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 2jwu s THR 51 N -2.46 -0.10 0.05 -0.18 2.01 -1.00 -2.40 115.64 111.56 2jwu s THR 51 Ca 0.22 0.25 -0.06 0.00 0.31 0.00 0.00 61.69 62.41 2jwu s THR 51 Cb -0.05 -0.20 -0.05 0.00 0.01 0.00 0.00 72.50 72.21 2jwu s THR 51 CO 0.80 0.10 0.31 -0.36 -0.69 0.00 0.00 174.62 174.78 2jwu s PHE 52 N 1.46 3.55 -0.20 4.92 0.40 0.17 0.14 117.98 128.43 2jwu s PHE 52 Ca -0.05 0.59 -0.05 0.00 -0.60 0.00 0.00 56.93 56.82 2jwu s PHE 52 Cb -0.12 -2.01 0.07 0.00 0.51 0.00 0.00 43.02 41.46 2jwu s PHE 52 CO -0.05 0.56 0.10 0.99 0.70 0.00 0.00 175.22 177.52 2jwu s THR 53 N -1.40 -0.09 -0.01 0.64 2.01 0.71 -2.29 115.64 115.20 2jwu s THR 53 Ca 0.32 -0.29 0.07 0.00 0.31 0.00 0.00 61.69 62.10 2jwu s THR 53 Cb -0.13 -0.66 -0.02 0.00 0.01 0.00 0.00 72.50 71.70 2jwu s THR 53 CO 0.19 -0.37 -0.23 0.54 -0.69 0.00 0.00 174.62 174.06 2jwu s VAL 54 N 2.14 1.79 0.06 3.82 0.11 -1.02 0.11 120.40 127.41 2jwu s VAL 54 Ca 0.04 -1.00 0.03 0.00 -2.93 0.00 0.00 61.98 58.11 2jwu s VAL 54 Cb -0.16 -1.50 -0.03 0.00 -1.53 0.00 0.00 36.38 33.16 2jwu s VAL 54 CO -0.15 0.48 -0.09 -0.89 -3.33 0.00 0.00 175.10 171.12 2jwu s THR 55 N -0.56 0.69 0.00 5.04 2.01 -0.99 -2.40 115.64 119.42 2jwu s THR 55 Ca 0.09 -1.32 0.00 0.00 0.31 0.00 0.00 61.69 60.77 2jwu s THR 55 Cb -0.09 -0.93 0.00 0.00 0.01 0.00 0.00 72.50 71.49 2jwu s THR 55 CO -0.01 -0.47 0.00 1.21 -0.69 0.00 0.00 174.62 174.67