#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b86 s THR 2 N 0.00 4.23 0.09 2.03 2.01 -1.26 -5.03 115.64 117.72 2b86 s THR 2 Ca 0.00 2.08 -0.29 0.00 0.31 0.00 0.00 61.69 63.79 2b86 s THR 2 Cb 0.00 -4.33 -0.06 0.00 0.01 0.00 0.00 72.50 68.13 2b86 s THR 2 CO 0.00 0.43 0.93 -1.61 -0.69 0.00 0.00 174.62 173.68 2b86 s GLU 3 N -0.73 4.66 -0.13 4.92 2.02 -1.26 -5.05 118.70 123.13 2b86 s GLU 3 Ca 0.43 1.39 -0.07 0.00 0.02 0.00 0.00 54.97 56.74 2b86 s GLU 3 Cb -0.25 -3.38 -0.04 0.00 0.10 0.00 0.00 34.13 30.56 2b86 s GLU 3 CO 0.31 0.21 0.13 -1.21 0.02 0.00 0.00 175.26 174.72 2b86 s GLU 4 N 0.05 3.54 -0.09 1.61 2.02 -1.26 -4.57 118.70 119.99 2b86 s GLU 4 Ca 0.46 -0.16 0.02 0.00 0.02 0.00 0.00 54.97 55.31 2b86 s GLU 4 Cb -0.23 -3.21 -0.02 0.00 0.10 0.00 0.00 34.13 30.78 2b86 s GLU 4 CO 0.29 0.70 -0.16 0.08 0.02 0.00 0.00 175.26 176.19 2b86 s VAL 5 N -0.80 2.85 -0.27 2.63 1.01 -0.79 -4.96 120.40 120.06 2b86 s VAL 5 Ca 0.14 -0.76 -0.09 0.00 0.00 0.00 0.00 61.98 61.26 2b86 s VAL 5 Cb -0.12 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.08 2b86 s VAL 5 CO 0.03 0.55 0.14 -0.63 0.00 0.00 0.00 175.10 175.19 2b86 s ILE 6 N -0.04 4.80 0.14 2.22 1.01 -1.26 0.52 121.20 128.59 2b86 s ILE 6 Ca -0.04 -0.06 0.04 0.00 0.00 0.00 0.00 60.65 60.59 2b86 s ILE 6 Cb -0.14 -3.30 -0.04 0.00 0.01 0.00 0.00 42.46 38.98 2b86 s ILE 6 CO 0.04 0.25 -0.09 0.68 0.00 0.00 0.00 174.94 175.82 2b86 s VAL 7 N 1.68 1.08 -0.16 2.92 -7.23 -1.11 -4.17 120.40 113.42 2b86 s VAL 7 Ca 0.06 -2.04 0.01 0.00 -1.81 0.00 0.00 61.98 58.21 2b86 s VAL 7 Cb -0.16 -1.84 0.01 0.00 0.56 0.00 0.00 36.38 34.95 2b86 s VAL 7 CO 0.07 -0.75 -0.19 -0.63 -0.31 0.00 0.00 175.10 173.30 2b86 s ILE 8 N -3.38 2.31 -0.17 -0.62 -1.09 -0.64 -2.29 121.20 115.32 2b86 s ILE 8 Ca 0.16 -0.88 -0.29 0.00 -2.23 0.00 0.00 60.65 57.41 2b86 s ILE 8 Cb 0.03 -1.96 -0.01 0.00 -1.58 0.00 0.00 42.46 38.95 2b86 s ILE 8 CO -0.00 0.53 1.21 0.00 -1.23 0.00 0.00 174.94 175.45 2b86 s ALA 9 N 0.94 3.65 -1.54 9.38 0.00 -0.41 -3.22 121.76 130.56 2b86 s ALA 9 Ca -0.04 0.41 0.25 0.00 0.00 0.00 0.00 51.96 52.58 2b86 s ALA 9 Cb -0.15 -3.59 0.45 0.00 0.00 0.00 0.00 23.12 19.83 2b86 s ALA 9 CO -0.04 -1.10 1.37 1.63 0.00 0.00 0.00 175.76 177.62 2b86 n LYS 10 N 6.41 0.61 -3.85 0.00 5.02 -1.20 -2.18 118.16 122.97 2b86 n LYS 10 Ca 0.13 -0.41 -0.12 0.00 -2.02 0.00 0.00 58.31 55.89 2b86 n LYS 10 Cb 0.45 -1.49 -0.12 0.00 -0.02 0.00 0.00 35.03 33.85 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 -2.67 -0.07 -0.08 2.13 0.51 -1.20 -4.67 118.94 112.89 2b86 s TRP 11 Ca 0.18 0.16 -0.30 0.00 -2.12 0.00 0.00 56.10 54.03 2b86 s TRP 11 Cb 0.18 0.01 -0.04 0.00 -0.81 0.00 0.00 33.47 32.81 2b86 s TRP 11 CO 0.61 -0.15 1.42 0.34 -0.51 0.00 0.00 176.95 178.66 2b86 s ASP 12 N -0.48 6.84 -0.04 2.95 -1.08 -1.26 -3.60 116.67 119.99 2b86 s ASP 12 Ca -0.06 1.98 0.04 0.00 -0.52 0.00 0.00 52.55 54.00 2b86 s ASP 12 Cb -0.04 -2.54 -0.00 0.00 -1.46 0.00 0.00 42.92 38.88 2b86 s ASP 12 CO 0.01 -0.79 -0.16 -0.47 0.52 0.00 0.00 175.17 174.28 2b86 s TYR 13 N 3.31 1.56 -0.08 -5.34 6.14 -1.04 -4.86 117.35 117.05 2b86 s TYR 13 Ca 0.63 -0.44 -0.04 0.00 0.64 0.00 0.00 57.07 57.87 2b86 s TYR 13 Cb -0.28 -1.06 -0.04 0.00 0.42 0.00 0.00 41.96 41.00 2b86 s TYR 13 CO 0.23 -0.15 0.10 0.99 0.64 0.00 0.00 175.55 177.36 2b86 s THR 14 N 0.06 5.03 0.26 4.34 2.01 -1.26 -1.53 115.64 124.53 2b86 s THR 14 Ca -0.03 -0.08 -0.31 0.00 0.31 0.00 0.00 61.69 61.58 2b86 s THR 14 Cb -0.11 -3.21 -0.13 0.00 0.01 0.00 0.00 72.50 69.06 2b86 s THR 14 CO 0.02 0.53 1.44 0.00 -0.69 0.00 0.00 174.62 175.91 2b86 n ALA 15 N 1.75 1.40 1.39 7.40 0.00 -1.26 -4.88 120.51 126.31 2b86 n ALA 15 Ca -0.17 0.40 0.14 0.00 0.00 0.00 0.00 53.44 53.81 2b86 n ALA 15 Cb 0.54 -2.31 0.59 0.00 0.00 0.00 0.00 19.45 18.27 2b86 n ALA 15 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2b86 n GLN 16 N 1.96 0.68 -4.14 0.00 6.02 -1.26 -4.88 117.38 115.75 2b86 n GLN 16 Ca 0.11 -0.25 -0.12 0.00 -0.01 0.00 0.00 57.00 56.73 2b86 n GLN 16 Cb 0.33 -1.49 -0.08 0.00 1.02 0.00 0.00 30.24 30.01 2b86 n GLN 16 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2b86 s GLN 17 N -2.49 1.42 0.23 -1.09 -0.21 -1.26 -5.06 119.66 111.20 2b86 s GLN 17 Ca 0.28 -1.58 0.11 0.00 0.02 0.00 0.00 55.36 54.19 2b86 s GLN 17 Cb 0.20 0.35 0.14 0.00 1.00 0.00 0.00 33.01 34.69 2b86 s GLN 17 CO 0.48 -0.52 1.48 -0.44 -2.12 0.00 0.00 175.29 174.16 2b86 h ASP 18 N 2.43 0.00 0.62 5.90 3.45 -1.99 -3.15 116.42 123.68 2b86 h ASP 18 Ca -0.32 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.14 2b86 h ASP 18 Cb 1.25 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.02 2b86 h ASP 18 CO 0.45 0.72 -0.05 0.00 -1.57 0.00 0.00 179.24 178.80 2b86 n GLN 19 N -3.51 0.36 -2.27 3.56 10.64 -1.26 -4.87 117.38 120.03 2b86 n GLN 19 Ca -0.00 -0.04 -0.27 0.00 -1.83 0.00 0.00 57.00 54.86 2b86 n GLN 19 Cb 0.74 -1.50 0.16 0.00 -0.86 0.00 0.00 30.24 28.78 2b86 n GLN 19 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 2b86 s GLU 20 N -2.67 1.01 -0.11 2.61 2.02 -1.19 -3.60 118.70 116.77 2b86 s GLU 20 Ca 0.24 -0.84 0.02 0.00 0.02 0.00 0.00 54.97 54.42 2b86 s GLU 20 Cb 0.20 -2.08 0.01 0.00 0.10 0.00 0.00 34.13 32.36 2b86 s GLU 20 CO 0.49 -2.03 -0.17 -1.17 0.02 0.00 0.00 175.26 172.40 2b86 s LEU 21 N -5.56 1.81 0.54 1.80 2.96 -1.26 -4.42 118.68 114.55 2b86 s LEU 21 Ca 0.72 -0.45 -0.20 0.00 -0.22 0.00 0.00 54.13 53.97 2b86 s LEU 21 Cb -0.04 -1.15 -0.06 0.00 0.50 0.00 0.00 46.19 45.45 2b86 s LEU 21 CO 0.49 0.05 1.15 -1.81 -1.32 0.00 0.00 176.35 174.91 2b86 s ASP 22 N 0.83 5.69 0.18 3.68 1.01 -1.26 -4.55 116.67 122.26 2b86 s ASP 22 Ca -0.09 2.23 0.02 0.00 0.71 0.00 0.00 52.55 55.42 2b86 s ASP 22 Cb -0.16 -2.59 -0.05 0.00 1.01 0.00 0.00 42.92 41.14 2b86 s ASP 22 CO 0.01 -1.24 0.02 0.27 0.21 0.00 0.00 175.17 174.43 2b86 s ILE 23 N -1.71 0.65 0.37 0.77 -4.36 -0.58 -4.99 121.20 111.35 2b86 s ILE 23 Ca 0.72 -1.98 0.08 0.00 -0.26 0.00 0.00 60.65 59.22 2b86 s ILE 23 Cb -0.26 -2.20 -0.07 0.00 1.25 0.00 0.00 42.46 41.19 2b86 s ILE 23 CO 0.29 -0.40 -0.02 -0.54 0.24 0.00 0.00 174.94 174.50 2b86 s LYS 24 N -3.94 1.94 0.15 0.37 1.02 -1.26 -2.50 119.74 115.53 2b86 s LYS 24 Ca 0.26 -1.96 0.17 0.00 0.02 0.00 0.00 55.97 54.47 2b86 s LYS 24 Cb 0.06 -1.74 0.76 0.00 -0.52 0.00 0.00 37.83 36.40 2b86 s LYS 24 CO 0.05 0.06 1.53 0.36 -0.92 0.00 0.00 175.35 176.43 2b86 n LYS 25 N -0.91 0.10 -0.63 1.68 2.85 -1.24 -2.92 118.16 117.09 2b86 n LYS 25 Ca -0.05 0.41 0.01 0.00 -1.05 0.00 0.00 58.31 57.63 2b86 n LYS 25 Cb 0.65 -1.72 0.00 0.00 -0.65 0.00 0.00 35.03 33.31 2b86 n LYS 25 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 2b86 n ASN 26 N -1.91 0.17 -4.87 -5.58 6.94 -0.92 -3.21 115.26 105.88 2b86 n ASN 26 Ca 0.02 -2.02 -0.37 0.00 -0.02 0.00 0.00 54.58 52.20 2b86 n ASN 26 Cb 0.15 -0.22 -0.06 0.00 -2.36 0.00 0.00 39.78 37.30 2b86 n ASN 26 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 2b86 s GLU 27 N -0.04 3.58 -0.27 -3.83 2.56 -1.15 -4.89 118.70 114.66 2b86 s GLU 27 Ca 0.05 0.01 -0.12 0.00 0.00 0.00 0.00 54.97 54.91 2b86 s GLU 27 Cb 0.06 -3.17 -0.05 0.00 2.00 0.00 0.00 34.13 32.97 2b86 s GLU 27 CO -0.02 0.73 0.24 -0.98 -0.56 0.00 0.00 175.26 174.67 2b86 s ARG 28 N -1.22 3.99 0.08 4.30 1.70 -1.26 -1.29 118.95 125.24 2b86 s ARG 28 Ca 0.20 -0.21 0.07 0.00 -0.47 0.00 0.00 55.73 55.32 2b86 s ARG 28 Cb -0.13 -3.64 -0.04 0.00 -0.57 0.00 0.00 34.95 30.56 2b86 s ARG 28 CO 0.09 -0.18 -0.12 -0.51 -1.08 0.00 0.00 175.30 173.50 2b86 s LEU 29 N 1.76 2.92 -0.39 -1.89 2.01 -0.97 -4.91 118.68 117.22 2b86 s LEU 29 Ca 0.09 -0.38 -0.15 0.00 0.01 0.00 0.00 54.13 53.70 2b86 s LEU 29 Cb -0.16 -1.73 0.01 0.00 0.01 0.00 0.00 46.19 44.33 2b86 s LEU 29 CO 0.10 0.21 0.29 0.26 1.01 0.00 0.00 176.35 178.22 2b86 s TRP 30 N -1.12 3.23 0.45 0.29 0.51 -1.14 -2.76 118.94 118.41 2b86 s TRP 30 Ca 0.19 -0.49 -0.22 0.00 -2.12 0.00 0.00 56.10 53.46 2b86 s TRP 30 Cb -0.11 -2.58 -0.08 0.00 -0.81 0.00 0.00 33.47 29.89 2b86 s TRP 30 CO 0.11 -0.54 1.09 -0.51 -0.51 0.00 0.00 176.95 176.59 2b86 s LEU 31 N 1.71 4.00 -0.11 2.99 1.43 0.19 -0.69 118.68 128.21 2b86 s LEU 31 Ca 0.06 2.11 0.09 0.00 -1.03 0.00 0.00 54.13 55.35 2b86 s LEU 31 Cb -0.19 -4.32 -0.13 0.00 0.03 0.00 0.00 46.19 41.59 2b86 s LEU 31 CO 0.10 -0.75 0.02 0.18 0.23 0.00 0.00 176.35 176.13 2b86 n LEU 32 N -0.50 0.27 0.04 1.79 4.32 0.15 -1.88 117.00 121.19 2b86 n LEU 32 Ca 0.07 -0.01 0.00 0.00 -0.02 0.00 0.00 56.01 56.06 2b86 n LEU 32 Cb 0.50 0.20 0.00 0.00 -1.62 0.00 0.00 43.42 42.49 2b86 n LEU 32 CO 0.44 0.30 0.00 0.47 -1.22 0.00 0.00 177.39 177.39 2b86 n ASP 33 N -2.44 0.08 -0.87 -1.43 8.00 -1.25 -4.57 116.55 114.08 2b86 n ASP 33 Ca -0.18 0.14 -0.08 0.00 0.71 0.00 0.00 54.79 55.39 2b86 n ASP 33 Cb 0.84 0.07 -0.03 0.00 -0.02 0.00 0.00 41.12 41.97 2b86 n ASP 33 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2b86 n ASP 34 N -2.86 -3.30 0.09 -2.24 5.75 -1.26 -4.78 116.55 107.94 2b86 n ASP 34 Ca 0.00 0.19 -0.16 0.00 -0.01 0.00 0.00 54.79 54.82 2b86 n ASP 34 Cb 0.00 -2.75 -0.09 0.00 -1.03 0.00 0.00 41.12 37.24 2b86 n ASP 34 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2b86 h SER 35 N 0.00 0.52 -2.26 -1.12 0.02 -1.95 -3.47 113.55 105.30 2b86 h SER 35 Ca -0.16 -0.49 -0.46 0.00 -0.84 0.00 0.00 61.79 59.84 2b86 h SER 35 Cb 0.72 -0.17 0.07 0.00 0.14 0.00 0.00 62.40 63.16 2b86 h SER 35 CO 0.23 1.33 0.06 -0.54 -1.14 0.00 0.00 176.83 176.77 2b86 s LYS 36 N -2.96 1.96 0.55 3.45 -0.14 -1.26 -4.97 119.74 116.38 2b86 s LYS 36 Ca -0.05 -1.01 0.23 0.00 -1.36 0.00 0.00 55.97 53.78 2b86 s LYS 36 Cb 0.08 -2.38 1.52 0.00 -1.68 0.00 0.00 37.83 35.36 2b86 s LYS 36 CO 0.88 -1.21 2.17 1.15 -0.76 0.00 0.00 175.35 177.58 2b86 h THR 37 N -0.34 0.75 -3.42 2.17 2.02 -2.03 -3.38 112.91 108.69 2b86 h THR 37 Ca -0.38 0.00 -0.61 0.00 0.77 0.00 0.00 66.41 66.19 2b86 h THR 37 Cb 1.28 0.96 -0.13 0.00 -1.74 0.00 0.00 68.15 68.52 2b86 h THR 37 CO 0.44 0.00 -0.48 0.26 0.37 0.00 0.00 175.52 176.11 2b86 s TRP 38 N -4.86 3.37 -0.17 3.16 0.52 -1.26 -4.52 118.94 115.17 2b86 s TRP 38 Ca -0.05 0.30 -0.05 0.00 0.02 0.00 0.00 56.10 56.32 2b86 s TRP 38 Cb 0.16 -2.22 -0.03 0.00 -1.15 0.00 0.00 33.47 30.23 2b86 s TRP 38 CO 0.62 0.18 -0.01 -1.58 0.02 0.00 0.00 176.95 176.17 2b86 s TRP 39 N 0.70 3.06 0.03 -1.98 0.52 -1.25 -4.56 118.94 115.45 2b86 s TRP 39 Ca 0.08 -0.29 -0.21 0.00 0.02 0.00 0.00 56.10 55.70 2b86 s TRP 39 Cb -0.12 -2.01 -0.06 0.00 -1.15 0.00 0.00 33.47 30.13 2b86 s TRP 39 CO 0.01 -0.07 0.63 0.50 0.02 0.00 0.00 176.95 178.05 2b86 s ARG 40 N 0.53 4.35 0.11 4.98 3.52 -1.26 -0.00 118.95 131.18 2b86 s ARG 40 Ca -0.02 0.82 -0.07 0.00 -0.13 0.00 0.00 55.73 56.34 2b86 s ARG 40 Cb -0.14 -3.33 -0.01 0.00 -1.56 0.00 0.00 34.95 29.91 2b86 s ARG 40 CO 0.02 0.41 0.17 0.54 -0.81 0.00 0.00 175.30 175.63 2b86 s VAL 41 N -0.36 0.13 0.04 7.11 0.11 -0.35 -0.67 120.40 126.41 2b86 s VAL 41 Ca 0.32 -1.40 0.09 0.00 -2.93 0.00 0.00 61.98 58.06 2b86 s VAL 41 Cb -0.19 -1.57 -0.03 0.00 -1.53 0.00 0.00 36.38 33.06 2b86 s VAL 41 CO 0.19 -0.59 -0.25 -0.60 -3.33 0.00 0.00 175.10 170.51 2b86 s ARG 42 N -3.92 1.75 0.28 1.54 3.52 0.14 -1.92 118.95 120.35 2b86 s ARG 42 Ca 0.10 -1.06 0.10 0.00 -0.13 0.00 0.00 55.73 54.74 2b86 s ARG 42 Cb 0.05 -1.90 -0.05 0.00 -1.56 0.00 0.00 34.95 31.50 2b86 s ARG 42 CO -0.07 0.49 -0.02 1.21 -0.81 0.00 0.00 175.30 176.11 2b86 s ASN 43 N -1.17 4.37 0.66 -2.12 2.47 -0.47 -2.87 114.94 115.81 2b86 s ASN 43 Ca 0.11 -0.76 0.38 0.00 0.42 0.00 0.00 52.86 53.01 2b86 s ASN 43 Cb -0.10 -0.71 2.10 0.00 -1.45 0.00 0.00 41.25 41.09 2b86 s ASN 43 CO 0.02 -0.05 2.19 0.00 -3.72 0.00 0.00 177.10 175.54 2b86 h ALA 44 N 1.90 1.17 -0.02 1.71 0.00 -1.90 0.66 119.26 122.78 2b86 h ALA 44 Ca -0.43 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 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 0.61 -0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.73 2b86 n ALA 45 N -2.03 2.56 -1.90 0.00 0.00 -1.26 -4.86 120.51 113.03 2b86 n ALA 45 Ca -0.02 -0.12 -0.13 0.00 0.00 0.00 0.00 53.44 53.17 2b86 n ALA 45 Cb 0.20 -1.17 -0.03 0.00 0.00 0.00 0.00 19.45 18.45 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 -0.58 -4.25 -4.41 0.00 3.02 0.22 -5.00 115.26 104.25 2b86 n ASN 46 Ca 0.09 0.12 -0.34 0.00 -0.03 0.00 0.00 54.58 54.43 2b86 n ASN 46 Cb 0.06 -3.23 -0.13 0.00 -0.61 0.00 0.00 39.78 35.88 2b86 n ASN 46 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2b86 s ARG 47 N -4.03 3.50 0.12 3.52 0.52 -1.24 -4.93 118.95 116.40 2b86 s ARG 47 Ca 0.00 -0.61 0.08 0.00 -0.52 0.00 0.00 55.73 54.68 2b86 s ARG 47 Cb 0.00 -2.80 -0.04 0.00 0.52 0.00 0.00 34.95 32.63 2b86 s ARG 47 CO 0.00 0.17 -0.20 0.95 0.02 0.00 0.00 175.30 176.24 2b86 s THR 48 N 0.51 1.68 0.06 0.02 -4.23 -1.26 -1.36 115.64 111.06 2b86 s THR 48 Ca -0.06 -1.62 -0.28 0.00 -1.18 0.00 0.00 61.69 58.55 2b86 s THR 48 Cb -0.15 -1.59 0.10 0.00 1.34 0.00 0.00 72.50 72.20 2b86 s THR 48 CO 0.03 -0.14 1.17 -0.83 -0.54 0.00 0.00 174.62 174.31 2b86 s GLY 49 N -2.09 -0.25 -0.44 3.99 0.00 -0.81 -4.58 107.32 103.13 2b86 s GLY 49 Ca 0.08 0.31 -0.17 0.00 0.00 0.00 0.00 44.72 44.94 2b86 s GLY 49 CO 0.05 1.20 0.46 -0.19 0.00 0.00 0.00 173.10 174.62 2b86 s TYR 50 N -2.54 3.16 -0.22 1.90 2.02 -1.24 -1.21 117.35 119.23 2b86 s TYR 50 Ca 0.17 -0.48 0.00 0.00 -0.37 0.00 0.00 57.07 56.39 2b86 s TYR 50 Cb 0.02 -3.04 0.06 0.00 -0.40 0.00 0.00 41.96 38.59 2b86 s TYR 50 CO -0.01 -0.77 -0.05 0.14 -1.57 0.00 0.00 175.55 173.29 2b86 s VAL 51 N 2.15 1.38 0.00 0.71 -7.23 1.00 -4.53 120.40 113.88 2b86 s VAL 51 Ca 0.11 -1.04 -0.02 0.00 -1.81 0.00 0.00 61.98 59.22 2b86 s VAL 51 Cb -0.18 -1.63 -0.11 0.00 0.56 0.00 0.00 36.38 35.02 2b86 s VAL 51 CO 0.12 -0.04 1.99 -0.81 -0.31 0.00 0.00 175.10 176.05 2b86 n PRO 52 N 4.74 1.01 -2.23 4.82 -0.04 -1.26 -3.93 135.00 138.11 2b86 n PRO 52 Ca -0.12 -0.40 -0.33 0.00 -0.04 0.00 0.00 63.50 62.62 2b86 n PRO 52 Cb 0.45 -1.59 -0.04 0.00 -0.04 0.00 0.00 33.50 32.28 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 2.25 5.59 0.63 3.54 1.04 -1.26 -4.72 113.70 120.77 2b86 s SER 53 Ca 0.26 -1.77 0.38 0.00 0.48 0.00 0.00 55.95 55.31 2b86 s SER 53 Cb 0.13 -2.58 2.09 0.00 0.10 0.00 0.00 66.02 65.75 2b86 s SER 53 CO 0.00 -2.47 2.17 -0.55 0.98 0.00 0.00 173.24 173.38 2b86 h ASN 54 N 9.31 0.00 0.00 7.02 7.08 -1.96 -1.56 115.58 135.47 2b86 h ASN 54 Ca 0.27 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.49 2b86 h ASN 54 Cb 0.93 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.17 2b86 h ASN 54 CO 1.30 0.00 0.12 1.88 -2.08 0.00 0.00 177.43 178.64 2b86 h TYR 55 N 0.00 0.00 -3.52 4.14 0.05 -1.92 -3.41 116.97 112.31 2b86 h TYR 55 Ca 0.00 0.00 -0.68 0.00 0.05 0.00 0.00 58.73 58.10 2b86 h TYR 55 Cb 0.19 0.00 -0.17 0.00 1.01 0.00 0.00 36.73 37.76 2b86 h TYR 55 CO 0.00 0.00 -0.66 0.54 -1.05 0.00 0.00 178.16 176.99 2b86 s VAL 56 N -3.74 3.96 0.14 -2.88 0.11 -0.59 -3.49 120.40 113.91 2b86 s VAL 56 Ca -0.03 -0.42 0.02 0.00 -2.93 0.00 0.00 61.98 58.62 2b86 s VAL 56 Cb 0.08 -2.65 -0.04 0.00 -1.53 0.00 0.00 36.38 32.23 2b86 s VAL 56 CO 0.24 0.57 -0.03 -1.61 -3.33 0.00 0.00 175.10 170.95 2b86 s GLU 57 N -0.93 0.99 0.29 1.54 2.02 -1.20 -4.97 118.70 116.45 2b86 s GLU 57 Ca 0.13 -1.45 -0.29 0.00 0.02 0.00 0.00 54.97 53.39 2b86 s GLU 57 Cb -0.11 -0.22 -0.10 0.00 0.10 0.00 0.00 34.13 33.80 2b86 s GLU 57 CO 0.03 -0.09 1.23 0.50 0.02 0.00 0.00 175.26 176.95 2b86 s ARG 58 N -3.89 4.47 0.00 1.61 3.52 -1.26 -1.61 118.95 121.79 2b86 s ARG 58 Ca 0.19 2.04 0.00 0.00 -0.13 0.00 0.00 55.73 57.83 2b86 s ARG 58 Cb 0.06 -3.13 0.00 0.00 -1.56 0.00 0.00 34.95 30.31 2b86 s ARG 58 CO 0.00 -0.05 0.49 1.17 -0.81 0.00 0.00 175.30 176.10