#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b86 n THR 2 N 0.00 0.00 -3.86 2.03 -2.24 -1.26 -4.86 114.28 104.09 2b86 n THR 2 Ca 0.00 -0.21 -0.36 0.00 -2.27 0.00 0.00 64.05 61.21 2b86 n THR 2 Cb 0.00 0.40 -0.08 0.00 -2.10 0.00 0.00 70.33 68.55 2b86 n THR 2 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2b86 s GLU 3 N -2.07 3.85 -0.11 -0.78 2.02 -1.26 -5.09 118.70 115.27 2b86 s GLU 3 Ca 0.37 -0.23 -0.09 0.00 0.02 0.00 0.00 54.97 55.05 2b86 s GLU 3 Cb 0.21 -3.28 -0.04 0.00 0.10 0.00 0.00 34.13 31.12 2b86 s GLU 3 CO 0.36 0.47 0.19 -1.21 0.02 0.00 0.00 175.26 175.08 2b86 s GLU 4 N -0.14 3.62 -0.14 1.61 2.02 -1.26 -4.87 118.70 119.54 2b86 s GLU 4 Ca 0.10 -0.05 -0.02 0.00 0.02 0.00 0.00 54.97 55.02 2b86 s GLU 4 Cb -0.12 -3.23 -0.02 0.00 0.10 0.00 0.00 34.13 30.87 2b86 s GLU 4 CO 0.00 0.70 -0.08 0.08 0.02 0.00 0.00 175.26 175.99 2b86 s VAL 5 N -0.85 3.52 -0.25 2.63 1.01 -0.68 -5.00 120.40 120.78 2b86 s VAL 5 Ca 0.16 -0.49 -0.08 0.00 0.00 0.00 0.00 61.98 61.56 2b86 s VAL 5 Cb -0.13 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 2b86 s VAL 5 CO 0.05 0.51 0.11 -0.63 0.00 0.00 0.00 175.10 175.13 2b86 s ILE 6 N 0.30 4.66 0.17 2.22 1.01 -1.26 0.44 121.20 128.74 2b86 s ILE 6 Ca -0.06 -0.06 0.03 0.00 0.00 0.00 0.00 60.65 60.56 2b86 s ILE 6 Cb -0.15 -3.18 -0.05 0.00 0.01 0.00 0.00 42.46 39.09 2b86 s ILE 6 CO 0.04 0.32 -0.05 0.68 0.00 0.00 0.00 174.94 175.93 2b86 s VAL 7 N 1.53 0.99 -0.15 2.92 -7.23 -0.74 -4.24 120.40 113.48 2b86 s VAL 7 Ca 0.06 -2.03 0.01 0.00 -1.81 0.00 0.00 61.98 58.21 2b86 s VAL 7 Cb -0.15 -2.02 0.02 0.00 0.56 0.00 0.00 36.38 34.79 2b86 s VAL 7 CO 0.06 -0.59 -0.16 -0.63 -0.31 0.00 0.00 175.10 173.47 2b86 s ILE 8 N -3.45 1.67 0.04 -0.62 1.01 -1.24 -1.22 121.20 117.39 2b86 s ILE 8 Ca 0.21 -0.70 -0.30 0.00 0.00 0.00 0.00 60.65 59.85 2b86 s ILE 8 Cb 0.04 -1.55 -0.05 0.00 0.01 0.00 0.00 42.46 40.92 2b86 s ILE 8 CO 0.03 0.47 1.19 0.00 0.00 0.00 0.00 174.94 176.63 2b86 s ALA 9 N 1.39 3.40 -1.61 9.38 0.00 -0.21 -3.93 121.76 130.18 2b86 s ALA 9 Ca 0.04 0.80 0.24 0.00 0.00 0.00 0.00 51.96 53.04 2b86 s ALA 9 Cb -0.13 -3.45 0.28 0.00 0.00 0.00 0.00 23.12 19.82 2b86 s ALA 9 CO -0.10 -0.48 1.26 1.63 0.00 0.00 0.00 175.76 178.07 2b86 n LYS 10 N 4.13 0.69 -3.79 0.00 5.02 -1.22 -2.72 118.16 120.28 2b86 n LYS 10 Ca 0.09 -0.51 -0.13 0.00 -2.02 0.00 0.00 58.31 55.75 2b86 n LYS 10 Cb 0.47 -1.49 -0.11 0.00 -0.02 0.00 0.00 35.03 33.88 2b86 n LYS 10 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2b86 s TRP 11 N -2.66 -0.24 -0.07 2.13 0.51 -1.21 -4.64 118.94 112.76 2b86 s TRP 11 Ca 0.17 0.57 -0.30 0.00 -2.12 0.00 0.00 56.10 54.42 2b86 s TRP 11 Cb 0.18 0.08 -0.04 0.00 -0.81 0.00 0.00 33.47 32.88 2b86 s TRP 11 CO 0.63 -0.19 1.41 0.34 -0.51 0.00 0.00 176.95 178.63 2b86 s ASP 12 N -0.20 6.85 -0.02 2.95 3.68 -1.26 -3.68 116.67 124.99 2b86 s ASP 12 Ca -0.03 2.00 0.05 0.00 2.13 0.00 0.00 52.55 56.69 2b86 s ASP 12 Cb -0.03 -2.55 -0.01 0.00 -1.45 0.00 0.00 42.92 38.89 2b86 s ASP 12 CO 0.01 -0.78 -0.16 -0.47 0.13 0.00 0.00 175.17 173.90 2b86 s TYR 13 N 3.15 1.49 -0.09 -5.34 6.14 -0.84 -4.85 117.35 117.01 2b86 s TYR 13 Ca 0.63 -0.33 -0.09 0.00 0.64 0.00 0.00 57.07 57.92 2b86 s TYR 13 Cb -0.28 -0.98 -0.04 0.00 0.42 0.00 0.00 41.96 41.07 2b86 s TYR 13 CO 0.23 -0.07 0.21 0.99 0.64 0.00 0.00 175.55 177.55 2b86 s THR 14 N -0.22 5.39 0.09 4.34 2.01 -1.26 -1.40 115.64 124.59 2b86 s THR 14 Ca 0.03 0.36 -0.35 0.00 0.31 0.00 0.00 61.69 62.04 2b86 s THR 14 Cb -0.08 -3.48 -0.14 0.00 0.01 0.00 0.00 72.50 68.81 2b86 s THR 14 CO 0.00 0.60 1.58 0.00 -0.69 0.00 0.00 174.62 176.12 2b86 n ALA 15 N 2.00 0.72 0.07 7.40 0.00 -1.26 -4.86 120.51 124.59 2b86 n ALA 15 Ca -0.18 0.43 0.04 0.00 0.00 0.00 0.00 53.44 53.73 2b86 n ALA 15 Cb 0.54 -2.31 0.44 0.00 0.00 0.00 0.00 19.45 18.12 2b86 n ALA 15 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2b86 h GLN 16 N 6.20 0.38 -4.69 0.00 4.15 -1.89 -3.44 115.11 115.82 2b86 h GLN 16 Ca -0.46 -0.04 -0.24 0.00 0.77 0.00 0.00 58.65 58.67 2b86 h GLN 16 Cb 1.28 -0.08 -0.15 0.00 0.21 0.00 0.00 27.48 28.74 2b86 h GLN 16 CO 0.88 0.33 -0.68 -0.65 -1.93 0.00 0.00 178.83 176.77 2b86 s GLN 17 N -5.19 0.94 0.37 1.69 -0.21 -1.26 -5.05 119.66 110.96 2b86 s GLN 17 Ca -0.07 -1.42 0.05 0.00 0.02 0.00 0.00 55.36 53.94 2b86 s GLN 17 Cb 0.17 -0.19 0.73 0.00 1.00 0.00 0.00 33.01 34.71 2b86 s GLN 17 CO 0.73 -0.08 2.01 -0.44 -2.12 0.00 0.00 175.29 175.38 2b86 h ASP 18 N 2.86 0.64 0.60 5.90 3.45 -2.01 -0.83 116.42 127.03 2b86 h ASP 18 Ca -0.36 -0.01 -0.00 0.00 0.43 0.00 0.00 57.03 57.09 2b86 h ASP 18 Cb 1.18 -0.15 -0.00 0.00 -0.56 0.00 0.00 39.33 39.80 2b86 h ASP 18 CO 0.64 0.45 -0.01 0.06 -1.57 0.00 0.00 179.24 178.80 2b86 h GLN 19 N 0.75 0.00 0.00 3.56 3.07 -1.96 -3.43 115.11 117.09 2b86 h GLN 19 Ca 0.24 0.00 -0.44 0.00 0.09 0.00 0.00 58.65 58.54 2b86 h GLN 19 Cb 0.03 0.00 0.16 0.00 0.08 0.00 0.00 27.48 27.76 2b86 h GLN 19 CO -0.06 0.01 0.38 0.39 0.09 0.00 0.00 178.83 179.64 2b86 n GLU 20 N -3.12 -1.14 -4.79 0.06 -0.58 -0.32 -4.05 120.64 106.70 2b86 n GLU 20 Ca -0.01 -2.16 -0.30 0.00 -0.42 0.00 0.00 57.16 54.27 2b86 n GLU 20 Cb 0.21 -1.28 -0.14 0.00 -0.57 0.00 0.00 31.44 29.66 2b86 n GLU 20 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2b86 s LEU 21 N 0.00 2.20 0.24 -4.62 2.96 -1.26 -4.68 118.68 113.52 2b86 s LEU 21 Ca 0.74 -0.62 -0.17 0.00 -0.22 0.00 0.00 54.13 53.86 2b86 s LEU 21 Cb -0.02 -1.26 -0.08 0.00 0.50 0.00 0.00 46.19 45.33 2b86 s LEU 21 CO 0.52 0.24 0.69 -1.81 -1.32 0.00 0.00 176.35 174.67 2b86 s ASP 22 N -1.41 6.92 0.21 3.68 -0.00 -1.26 -4.05 116.67 120.76 2b86 s ASP 22 Ca 0.12 1.30 0.04 0.00 -0.00 0.00 0.00 52.55 54.01 2b86 s ASP 22 Cb -0.10 -2.38 -0.05 0.00 -0.00 0.00 0.00 42.92 40.39 2b86 s ASP 22 CO 0.03 -0.03 -0.03 0.27 -0.00 0.00 0.00 175.17 175.41 2b86 s ILE 23 N -1.65 1.08 0.38 0.77 -4.36 -0.49 -4.98 121.20 111.94 2b86 s ILE 23 Ca 0.45 -2.04 0.07 0.00 -0.26 0.00 0.00 60.65 58.87 2b86 s ILE 23 Cb -0.14 -2.23 -0.07 0.00 1.25 0.00 0.00 42.46 41.26 2b86 s ILE 23 CO 0.20 -0.42 -0.00 -0.54 0.24 0.00 0.00 174.94 174.42 2b86 s LYS 24 N -3.83 1.87 0.31 0.37 1.02 -1.26 -1.98 119.74 116.23 2b86 s LYS 24 Ca 0.26 -2.03 0.24 0.00 0.02 0.00 0.00 55.97 54.46 2b86 s LYS 24 Cb 0.05 -1.50 1.10 0.00 -0.52 0.00 0.00 37.83 36.96 2b86 s LYS 24 CO 0.07 -0.04 1.74 1.57 -0.92 0.00 0.00 175.35 177.77 2b86 h LYS 25 N 1.89 0.00 0.00 1.68 2.10 -1.77 -3.09 116.57 117.39 2b86 h LYS 25 Ca -0.43 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.16 2b86 h LYS 25 Cb 1.24 0.00 -0.13 0.00 -0.90 0.00 0.00 32.23 32.44 2b86 h LYS 25 CO 0.77 0.00 -0.67 0.09 -2.00 0.00 0.00 179.45 177.64 2b86 n ASN 26 N -2.34 0.45 -4.87 7.07 4.13 -1.10 -3.32 115.26 115.28 2b86 n ASN 26 Ca 0.01 -2.07 -0.37 0.00 1.68 0.00 0.00 54.58 53.83 2b86 n ASN 26 Cb 0.18 -0.25 -0.06 0.00 -1.54 0.00 0.00 39.78 38.11 2b86 n ASN 26 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 2b86 s GLU 27 N -0.15 3.52 -0.24 3.52 2.56 -1.17 -4.90 118.70 121.84 2b86 s GLU 27 Ca 0.13 -0.13 -0.18 0.00 0.00 0.00 0.00 54.97 54.80 2b86 s GLU 27 Cb 0.15 -3.21 -0.03 0.00 2.00 0.00 0.00 34.13 33.04 2b86 s GLU 27 CO -0.06 0.73 0.49 1.03 -0.56 0.00 0.00 175.26 176.90 2b86 s ARG 28 N -0.91 4.10 0.11 4.30 0.52 -1.26 -1.04 118.95 124.77 2b86 s ARG 28 Ca 0.15 0.31 0.08 0.00 -0.52 0.00 0.00 55.73 55.74 2b86 s ARG 28 Cb -0.12 -3.62 -0.04 0.00 0.52 0.00 0.00 34.95 31.69 2b86 s ARG 28 CO 0.04 -0.27 -0.12 -0.51 0.02 0.00 0.00 175.30 174.45 2b86 s LEU 29 N 2.05 2.94 -0.35 2.53 2.01 -0.36 -4.93 118.68 122.58 2b86 s LEU 29 Ca 0.21 -0.44 -0.11 0.00 0.01 0.00 0.00 54.13 53.79 2b86 s LEU 29 Cb -0.15 -1.75 0.00 0.00 0.01 0.00 0.00 46.19 44.30 2b86 s LEU 29 CO 0.09 0.18 0.21 0.26 1.01 0.00 0.00 176.35 178.09 2b86 s TRP 30 N -1.21 3.21 0.31 0.29 0.51 -1.08 -1.80 118.94 119.19 2b86 s TRP 30 Ca 0.20 -0.58 -0.27 0.00 -2.12 0.00 0.00 56.10 53.34 2b86 s TRP 30 Cb -0.11 -2.44 -0.10 0.00 -0.81 0.00 0.00 33.47 30.02 2b86 s TRP 30 CO 0.13 -0.49 0.97 -0.51 -0.51 0.00 0.00 176.95 176.54 2b86 s LEU 31 N 1.63 4.39 -0.10 2.99 1.43 0.17 0.65 118.68 129.84 2b86 s LEU 31 Ca 0.04 1.93 0.11 0.00 -1.03 0.00 0.00 54.13 55.18 2b86 s LEU 31 Cb -0.18 -3.93 -0.16 0.00 0.03 0.00 0.00 46.19 41.95 2b86 s LEU 31 CO 0.08 -0.09 0.09 0.18 0.23 0.00 0.00 176.35 176.83 2b86 n LEU 32 N 0.69 0.00 -3.51 1.79 4.32 0.85 -1.68 117.00 119.46 2b86 n LEU 32 Ca 0.01 0.00 -0.01 0.00 -0.02 0.00 0.00 56.01 56.00 2b86 n LEU 32 Cb 0.49 0.25 -0.04 0.00 -1.62 0.00 0.00 43.42 42.50 2b86 n LEU 32 CO 0.46 0.25 0.20 -0.62 -1.22 0.00 0.00 177.39 176.47 2b86 s ASP 33 N -4.34 -1.10 0.00 -1.43 3.68 -1.24 -4.79 116.67 107.45 2b86 s ASP 33 Ca -0.06 1.31 0.16 0.00 2.13 0.00 0.00 52.55 56.08 2b86 s ASP 33 Cb 0.05 2.16 0.17 0.00 -1.45 0.00 0.00 42.92 43.85 2b86 s ASP 33 CO 0.51 -0.23 1.05 -0.90 0.13 0.00 0.00 175.17 175.73 2b86 n ASP 34 N 5.44 2.46 -0.11 -0.34 5.68 -1.26 -3.12 116.55 125.30 2b86 n ASP 34 Ca -0.09 -1.71 -0.07 0.00 -0.50 0.00 0.00 54.79 52.42 2b86 n ASP 34 Cb 0.50 -0.05 0.09 0.00 -1.14 0.00 0.00 41.12 40.52 2b86 n ASP 34 CO 0.00 0.00 0.00 -1.28 -1.33 0.00 0.00 177.20 174.59 2b86 h SER 35 N 3.03 0.82 -4.23 -1.12 0.87 -1.95 -3.45 113.55 107.51 2b86 h SER 35 Ca 0.00 -0.27 -0.50 0.00 -1.23 0.00 0.00 61.79 59.79 2b86 h SER 35 Cb 0.68 -0.22 0.05 0.00 -0.44 0.00 0.00 62.40 62.47 2b86 h SER 35 CO 0.00 0.98 0.37 -0.54 -0.53 0.00 0.00 176.83 177.11 2b86 s LYS 36 N -4.72 3.62 0.27 2.24 1.02 -1.26 -4.96 119.74 115.95 2b86 s LYS 36 Ca -0.10 0.69 -0.02 0.00 0.02 0.00 0.00 55.97 56.56 2b86 s LYS 36 Cb 0.13 -2.13 0.43 0.00 -0.52 0.00 0.00 37.83 35.75 2b86 s LYS 36 CO 0.83 -0.49 1.88 1.79 -0.92 0.00 0.00 175.35 178.44 2b86 h THR 37 N -0.14 1.07 -3.16 2.17 1.35 -1.96 -3.38 112.91 108.86 2b86 h THR 37 Ca -0.45 -0.39 -0.61 0.00 -0.55 0.00 0.00 66.41 64.41 2b86 h THR 37 Cb 1.19 -0.18 -0.09 0.00 -1.73 0.00 0.00 68.15 67.33 2b86 h THR 37 CO 0.62 0.21 -0.37 0.26 -0.25 0.00 0.00 175.52 175.99 2b86 s TRP 38 N -6.02 3.50 -0.14 4.73 0.52 -1.26 -4.80 118.94 115.48 2b86 s TRP 38 Ca -0.12 0.58 -0.06 0.00 0.02 0.00 0.00 56.10 56.51 2b86 s TRP 38 Cb 0.20 -2.24 -0.04 0.00 -1.15 0.00 0.00 33.47 30.24 2b86 s TRP 38 CO 0.81 0.37 0.09 -1.58 0.02 0.00 0.00 176.95 176.66 2b86 s TRP 39 N 0.05 3.41 -0.03 -1.98 0.52 -1.25 -4.88 118.94 114.78 2b86 s TRP 39 Ca 0.15 0.34 -0.15 0.00 0.02 0.00 0.00 56.10 56.47 2b86 s TRP 39 Cb -0.13 -1.96 -0.05 0.00 -1.15 0.00 0.00 33.47 30.17 2b86 s TRP 39 CO 0.04 0.51 0.40 0.50 0.02 0.00 0.00 176.95 178.42 2b86 s ARG 40 N -0.54 3.99 0.10 4.98 3.52 -1.18 0.18 118.95 130.01 2b86 s ARG 40 Ca 0.11 0.38 -0.04 0.00 -0.13 0.00 0.00 55.73 56.06 2b86 s ARG 40 Cb -0.12 -3.27 -0.03 0.00 -1.56 0.00 0.00 34.95 29.98 2b86 s ARG 40 CO 0.02 0.58 0.08 0.54 -0.81 0.00 0.00 175.30 175.72 2b86 s VAL 41 N -0.71 0.14 0.02 7.11 0.11 -0.20 -0.11 120.40 126.77 2b86 s VAL 41 Ca 0.23 -1.67 0.07 0.00 -2.93 0.00 0.00 61.98 57.68 2b86 s VAL 41 Cb -0.16 -1.71 -0.02 0.00 -1.53 0.00 0.00 36.38 32.96 2b86 s VAL 41 CO 0.12 -0.66 -0.20 -0.60 -3.33 0.00 0.00 175.10 170.43 2b86 s ARG 42 N -3.96 1.42 0.33 1.54 3.52 0.21 -2.10 118.95 119.91 2b86 s ARG 42 Ca 0.14 -0.85 0.08 0.00 -0.13 0.00 0.00 55.73 54.96 2b86 s ARG 42 Cb 0.07 -1.48 -0.04 0.00 -1.56 0.00 0.00 34.95 31.94 2b86 s ARG 42 CO -0.05 0.39 0.16 1.21 -0.81 0.00 0.00 175.30 176.20 2b86 s ASN 43 N -0.95 4.80 0.62 -2.12 2.47 -0.57 -2.63 114.94 116.56 2b86 s ASN 43 Ca 0.07 -0.70 0.36 0.00 0.42 0.00 0.00 52.86 53.01 2b86 s ASN 43 Cb -0.08 -0.80 2.04 0.00 -1.45 0.00 0.00 41.25 40.96 2b86 s ASN 43 CO 0.01 -0.28 2.29 0.00 -3.72 0.00 0.00 177.10 175.39 2b86 h ALA 44 N 1.51 1.28 0.00 1.71 0.00 -1.91 -0.15 119.26 121.70 2b86 h ALA 44 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2b86 h ALA 44 Cb 1.25 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2b86 h ALA 44 CO 0.62 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.88 2b86 n ALA 45 N -2.22 2.53 -1.94 0.00 0.00 -1.26 -4.86 120.51 112.77 2b86 n ALA 45 Ca -0.03 -0.09 -0.13 0.00 0.00 0.00 0.00 53.44 53.20 2b86 n ALA 45 Cb 0.09 -1.23 -0.02 0.00 0.00 0.00 0.00 19.45 18.29 2b86 n ALA 45 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2b86 n ASN 46 N -0.73 -4.20 -4.44 0.00 3.02 -0.07 -5.00 115.26 103.84 2b86 n ASN 46 Ca 0.11 0.10 -0.34 0.00 -0.03 0.00 0.00 54.58 54.42 2b86 n ASN 46 Cb 0.05 -3.20 -0.13 0.00 -0.61 0.00 0.00 39.78 35.89 2b86 n ASN 46 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2b86 s ARG 47 N -4.10 3.56 0.15 3.52 3.52 -1.25 -4.93 118.95 119.42 2b86 s ARG 47 Ca 0.00 -0.57 0.10 0.00 -0.13 0.00 0.00 55.73 55.13 2b86 s ARG 47 Cb 0.00 -2.90 -0.04 0.00 -1.56 0.00 0.00 34.95 30.45 2b86 s ARG 47 CO 0.00 0.14 -0.22 0.95 -0.81 0.00 0.00 175.30 175.35 2b86 s THR 48 N 0.62 2.02 0.15 4.11 -4.23 -1.26 -1.52 115.64 115.53 2b86 s THR 48 Ca -0.03 -1.82 -0.25 0.00 -1.18 0.00 0.00 61.69 58.41 2b86 s THR 48 Cb -0.15 -1.88 0.07 0.00 1.34 0.00 0.00 72.50 71.89 2b86 s THR 48 CO 0.02 -0.12 1.03 -0.83 -0.54 0.00 0.00 174.62 174.18 2b86 s GLY 49 N -2.36 -0.13 -0.44 3.99 0.00 -0.89 -4.72 107.32 102.77 2b86 s GLY 49 Ca 0.14 0.02 -0.14 0.00 0.00 0.00 0.00 44.72 44.74 2b86 s GLY 49 CO 0.07 0.86 0.34 -0.19 0.00 0.00 0.00 173.10 174.18 2b86 s TYR 50 N -2.80 3.25 -0.23 1.90 1.51 -1.26 -1.04 117.35 118.69 2b86 s TYR 50 Ca 0.16 -0.87 0.02 0.00 -1.01 0.00 0.00 57.07 55.37 2b86 s TYR 50 Cb -0.01 -2.90 0.04 0.00 -0.11 0.00 0.00 41.96 38.98 2b86 s TYR 50 CO 0.03 -0.72 -0.14 0.08 -1.11 0.00 0.00 175.55 173.69 2b86 s VAL 51 N 1.63 2.17 0.00 0.71 1.01 0.13 -4.65 120.40 121.40 2b86 s VAL 51 Ca 0.04 -1.35 -0.01 0.00 0.00 0.00 0.00 61.98 60.65 2b86 s VAL 51 Cb -0.22 -2.14 -0.06 0.00 0.00 0.00 0.00 36.38 33.96 2b86 s VAL 51 CO 0.07 0.19 2.00 -0.81 0.00 0.00 0.00 175.10 176.56 2b86 n PRO 52 N 4.51 1.03 -2.09 2.72 -0.04 -1.26 -3.81 135.00 136.05 2b86 n PRO 52 Ca -0.17 -0.23 -0.28 0.00 -0.04 0.00 0.00 63.50 62.79 2b86 n PRO 52 Cb 0.45 -1.32 -0.05 0.00 -0.04 0.00 0.00 33.50 32.54 2b86 n PRO 52 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2b86 s SER 53 N 2.06 5.24 0.24 3.54 1.04 -1.26 -4.75 113.70 119.81 2b86 s SER 53 Ca 0.15 -0.90 0.21 0.00 0.48 0.00 0.00 55.95 55.89 2b86 s SER 53 Cb 0.07 -2.57 0.94 0.00 0.10 0.00 0.00 66.02 64.57 2b86 s SER 53 CO 0.00 -2.69 1.63 0.59 0.98 0.00 0.00 173.24 173.76 2b86 n ASN 54 N 13.60 0.54 0.18 7.02 5.03 -1.26 -2.50 115.26 137.87 2b86 n ASN 54 Ca 0.40 0.67 0.13 0.00 0.87 0.00 0.00 54.58 56.65 2b86 n ASN 54 Cb 0.47 -0.77 0.65 0.00 -1.02 0.00 0.00 39.78 39.11 2b86 n ASN 54 CO 0.00 0.00 0.00 1.88 -1.83 0.00 0.00 177.26 177.31 2b86 h TYR 55 N 0.00 0.00 -3.32 3.10 0.05 -1.93 -3.42 116.97 111.45 2b86 h TYR 55 Ca 0.00 0.00 -0.67 0.00 0.05 0.00 0.00 58.73 58.11 2b86 h TYR 55 Cb 0.23 0.00 -0.14 0.00 1.01 0.00 0.00 36.73 37.83 2b86 h TYR 55 CO 0.00 0.00 -0.63 0.54 -1.05 0.00 0.00 178.16 177.02 2b86 s VAL 56 N -3.58 4.29 0.10 -2.88 0.11 -1.04 -3.63 120.40 113.77 2b86 s VAL 56 Ca -0.02 -0.37 0.07 0.00 -2.93 0.00 0.00 61.98 58.73 2b86 s VAL 56 Cb 0.07 -2.85 -0.03 0.00 -1.53 0.00 0.00 36.38 32.04 2b86 s VAL 56 CO 0.26 0.52 -0.17 -0.70 -3.33 0.00 0.00 175.10 171.67 2b86 s GLU 57 N -1.15 1.03 0.31 1.54 2.12 -1.25 -5.00 118.70 116.29 2b86 s GLU 57 Ca 0.16 -1.14 -0.29 0.00 0.36 0.00 0.00 54.97 54.06 2b86 s GLU 57 Cb -0.11 -1.14 -0.10 0.00 0.26 0.00 0.00 34.13 33.04 2b86 s GLU 57 CO 0.06 0.25 1.23 1.03 -0.54 0.00 0.00 175.26 177.29 2b86 s ARG 58 N -2.08 4.46 0.00 4.30 0.52 -1.26 -3.67 118.95 121.21 2b86 s ARG 58 Ca 0.05 2.07 0.00 0.00 -0.52 0.00 0.00 55.73 57.33 2b86 s ARG 58 Cb -0.09 -3.11 0.00 0.00 0.52 0.00 0.00 34.95 32.27 2b86 s ARG 58 CO 0.04 -0.05 0.00 0.36 0.02 0.00 0.00 175.30 175.67