#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f06 n ASN -1 N 0.00 0.00 0.00 -3.46 6.94 -1.26 -5.15 115.26 112.33 2f06 n ASN -1 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 2f06 n ASN -1 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 2f06 n ASN -1 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2f06 n ALA 0 N 0.00 0.00 -1.09 -2.53 0.00 -1.26 -5.05 120.51 110.58 2f06 n ALA 0 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2f06 n ALA 0 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.44 2f06 n ALA 0 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2f06 n VAL 2 N -2.00 0.00 -4.05 0.00 0.31 -1.26 -1.34 118.33 109.99 2f06 n VAL 2 Ca 0.00 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.07 2f06 n VAL 2 Cb 0.00 -0.36 -0.05 0.00 -0.91 0.00 0.00 33.84 32.53 2f06 n VAL 2 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2f06 s ALA 3 N -0.01 3.68 -0.24 3.52 0.00 0.80 -4.69 121.76 124.81 2f06 s ALA 3 Ca 0.00 -1.19 -0.18 0.00 0.00 0.00 0.00 51.96 50.60 2f06 s ALA 3 Cb 0.00 -1.47 -0.03 0.00 0.00 0.00 0.00 23.12 21.62 2f06 s ALA 3 CO 0.00 0.49 0.49 0.15 0.00 0.00 0.00 175.76 176.89 2f06 s LYS 4 N -3.21 4.11 -0.15 0.00 1.02 -1.26 -1.72 119.74 118.53 2f06 s LYS 4 Ca 0.32 0.31 -0.06 0.00 0.02 0.00 0.00 55.97 56.56 2f06 s LYS 4 Cb -0.10 -3.61 -0.04 0.00 -0.52 0.00 0.00 37.83 33.56 2f06 s LYS 4 CO 0.25 -0.25 0.06 -1.14 -0.92 0.00 0.00 175.35 173.35 2f06 s GLN 5 N 1.98 3.70 0.06 1.68 0.74 0.74 -4.72 119.66 123.83 2f06 s GLN 5 Ca 0.21 -0.33 -0.26 0.00 0.05 0.00 0.00 55.36 55.04 2f06 s GLN 5 Cb -0.15 -3.12 -0.06 0.00 1.10 0.00 0.00 33.01 30.78 2f06 s GLN 5 CO 0.09 0.44 0.79 -0.51 -0.55 0.00 0.00 175.29 175.55 2f06 s LEU 6 N -0.09 4.46 -0.22 3.68 1.43 -0.06 -1.03 118.68 126.85 2f06 s LEU 6 Ca 0.07 1.50 -0.03 0.00 -1.03 0.00 0.00 54.13 54.64 2f06 s LEU 6 Cb -0.12 -3.27 0.01 0.00 0.03 0.00 0.00 46.19 42.83 2f06 s LEU 6 CO 0.01 0.02 -0.07 -0.44 0.23 0.00 0.00 176.35 176.10 2f06 s SER 7 N -0.11 4.15 -0.16 2.29 0.01 0.50 -0.66 113.70 119.72 2f06 s SER 7 Ca 0.39 -0.57 0.02 0.00 1.31 0.00 0.00 55.95 57.10 2f06 s SER 7 Cb -0.21 -1.68 0.01 0.00 0.21 0.00 0.00 66.02 64.35 2f06 s SER 7 CO 0.24 -0.05 -0.20 -0.63 0.41 0.00 0.00 173.24 173.00 2f06 s ILE 8 N 1.41 2.16 -0.34 1.44 1.01 0.24 -0.82 121.20 126.30 2f06 s ILE 8 Ca 0.04 -0.93 -0.29 0.00 0.00 0.00 0.00 60.65 59.47 2f06 s ILE 8 Cb -0.15 -1.88 0.01 0.00 0.01 0.00 0.00 42.46 40.45 2f06 s ILE 8 CO -0.05 0.54 1.15 0.12 0.00 0.00 0.00 174.94 176.70 2f06 s PHE 9 N 0.97 2.96 -0.40 3.97 5.36 -0.52 -0.69 117.98 129.62 2f06 s PHE 9 Ca -0.03 1.02 -0.11 0.00 -0.96 0.00 0.00 56.93 56.85 2f06 s PHE 9 Cb -0.15 -3.89 0.05 0.00 -0.34 0.00 0.00 43.02 38.70 2f06 s PHE 9 CO -0.05 -1.13 0.24 -0.51 -1.46 0.00 0.00 175.22 172.31 2f06 s LEU 10 N 4.01 4.95 0.00 6.12 1.43 -0.31 -4.55 118.68 130.33 2f06 s LEU 10 Ca 0.49 -1.21 -0.16 0.00 -1.03 0.00 0.00 54.13 52.21 2f06 s LEU 10 Cb -0.13 -2.02 0.23 0.00 0.03 0.00 0.00 46.19 44.30 2f06 s LEU 10 CO 0.20 -0.46 1.20 -1.84 0.23 0.00 0.00 176.35 175.68 2f06 n GLU 11 N 4.98 -1.62 0.00 1.70 0.28 -1.26 -2.28 120.64 122.44 2f06 n GLU 11 Ca -0.11 -1.86 0.00 0.00 -0.16 0.00 0.00 57.16 55.03 2f06 n GLU 11 Cb 0.45 -1.34 0.00 0.00 1.43 0.00 0.00 31.44 31.98 2f06 n GLU 11 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 2f06 n ASN 12 N -4.02 0.00 0.00 -1.84 4.05 -1.26 -4.64 115.26 107.55 2f06 n ASN 12 Ca 0.15 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.18 2f06 n ASN 12 Cb 0.54 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.55 2f06 n ASN 12 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 2f06 n LYS 13 N 13.38 0.00 0.00 1.20 4.76 -1.26 -4.46 118.16 131.78 2f06 n LYS 13 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2f06 n LYS 13 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2f06 n LYS 13 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2f06 n SER 14 N 0.00 0.00 0.00 4.39 3.41 -1.26 -4.87 113.62 115.29 2f06 n SER 14 Ca 0.00 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.61 2f06 n SER 14 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2f06 n SER 14 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2f06 n GLY 15 N 0.00 -0.28 0.13 5.00 0.00 -1.26 -5.07 105.19 103.71 2f06 n GLY 15 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.71 2f06 n GLY 15 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2f06 h ARG 16 N 0.00 0.00 -0.59 1.61 2.47 -1.89 -3.06 114.38 112.91 2f06 h ARG 16 Ca 0.00 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.65 2f06 h ARG 16 Cb 0.00 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.30 2f06 h ARG 16 CO 0.00 0.63 0.08 1.25 0.56 0.00 0.00 179.97 182.49 2f06 h LEU 17 N 0.00 0.93 -0.03 3.04 5.85 -1.92 -1.19 115.31 121.99 2f06 h LEU 17 Ca -0.01 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.50 2f06 h LEU 17 Cb 1.37 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 42.15 2f06 h LEU 17 CO 0.08 0.94 0.01 0.74 -0.34 0.00 0.00 178.44 179.87 2f06 h THR 18 N 0.91 1.19 -1.00 1.05 2.02 -1.96 -1.51 112.91 113.62 2f06 h THR 18 Ca 0.18 -0.58 0.16 0.00 0.77 0.00 0.00 66.41 66.94 2f06 h THR 18 Cb 0.42 1.52 -0.10 0.00 -1.74 0.00 0.00 68.15 68.26 2f06 h THR 18 CO 0.01 0.16 0.61 -0.33 0.37 0.00 0.00 175.52 176.34 2f06 h GLU 19 N -0.17 0.82 -0.49 6.66 5.08 -1.52 0.14 114.58 125.09 2f06 h GLU 19 Ca 0.01 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 2f06 h GLU 19 Cb 0.25 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 2f06 h GLU 19 CO 0.00 0.54 0.07 0.28 -1.00 0.00 0.00 179.01 178.90 2f06 h VAL 20 N 0.84 1.25 0.00 3.13 2.07 -0.89 -0.29 116.25 122.37 2f06 h VAL 20 Ca 0.54 -0.95 -0.11 0.00 0.82 0.00 0.00 66.70 67.00 2f06 h VAL 20 Cb 0.73 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2f06 h VAL 20 CO -0.34 0.34 -0.51 0.71 0.02 0.00 0.00 177.57 177.78 2f06 h THR 21 N 0.70 1.32 0.07 2.57 1.35 -0.56 -2.33 112.91 116.03 2f06 h THR 21 Ca 0.15 -1.79 -0.00 0.00 -0.55 0.00 0.00 66.41 64.21 2f06 h THR 21 Cb 0.41 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.81 2f06 h THR 21 CO 0.01 0.50 -0.03 -0.33 -0.25 0.00 0.00 175.52 175.42 2f06 h GLU 22 N 0.00 -0.09 -0.85 4.72 5.08 -0.37 -0.63 114.58 122.45 2f06 h GLU 22 Ca -0.01 0.01 0.15 0.00 -1.00 0.00 0.00 59.36 58.51 2f06 h GLU 22 Cb 0.94 0.02 -0.15 0.00 0.50 0.00 0.00 28.75 30.06 2f06 h GLU 22 CO 0.07 0.16 -0.31 0.28 -1.00 0.00 0.00 179.01 178.21 2f06 h VAL 23 N -0.34 0.09 -0.46 3.13 2.07 -1.01 -1.54 116.25 118.19 2f06 h VAL 23 Ca -0.01 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.42 2f06 h VAL 23 Cb 0.30 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 2f06 h VAL 23 CO 0.02 0.00 -0.08 -0.07 0.02 0.00 0.00 177.57 177.45 2f06 h LEU 24 N -0.04 0.86 -0.87 2.57 3.38 -1.40 -3.02 115.31 116.79 2f06 h LEU 24 Ca 0.35 -0.35 0.07 0.00 0.09 0.00 0.00 57.88 58.04 2f06 h LEU 24 Cb 0.60 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.05 2f06 h LEU 24 CO -0.88 1.01 0.54 0.00 0.09 0.00 0.00 178.44 179.20 2f06 h ALA 25 N 0.88 1.21 0.00 1.53 0.00 -0.95 -1.64 119.26 120.30 2f06 h ALA 25 Ca 0.12 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 2f06 h ALA 25 Cb 0.62 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2f06 h ALA 25 CO 0.04 0.27 -0.18 -0.22 0.00 0.00 0.00 179.25 179.15 2f06 h LYS 26 N 0.97 0.00 -0.07 0.00 3.64 -1.16 -1.80 116.57 118.15 2f06 h LYS 26 Ca 0.39 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 2f06 h LYS 26 Cb 0.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2f06 h LYS 26 CO -0.19 0.18 0.00 0.39 -2.27 0.00 0.00 179.45 177.57 2f06 n GLU 27 N -3.93 1.64 -3.70 1.90 -0.58 -0.97 -4.92 120.64 110.08 2f06 n GLU 27 Ca -0.02 -0.94 -0.24 0.00 -0.42 0.00 0.00 57.16 55.53 2f06 n GLU 27 Cb 0.27 -1.45 0.05 0.00 -0.57 0.00 0.00 31.44 29.75 2f06 n GLU 27 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2f06 n ASN 28 N 0.15 -3.92 -4.60 1.62 4.05 -0.67 -4.98 115.26 106.90 2f06 n ASN 28 Ca 0.18 -0.70 -0.38 0.00 0.45 0.00 0.00 54.58 54.13 2f06 n ASN 28 Cb 0.33 -4.43 -0.10 0.00 1.23 0.00 0.00 39.78 36.81 2f06 n ASN 28 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2f06 s ILE 29 N -3.41 5.27 0.15 -1.44 1.01 -0.65 -5.03 121.20 117.11 2f06 s ILE 29 Ca 0.38 0.30 -0.25 0.00 0.00 0.00 0.00 60.65 61.08 2f06 s ILE 29 Cb -0.18 -3.58 -0.08 0.00 0.01 0.00 0.00 42.46 38.63 2f06 s ILE 29 CO 0.78 0.23 0.77 0.21 0.00 0.00 0.00 174.94 176.93 2f06 s ASN 30 N 1.63 7.36 -0.14 3.58 2.47 -1.26 -4.32 114.94 124.26 2f06 s ASN 30 Ca 0.10 1.61 -0.20 0.00 0.42 0.00 0.00 52.86 54.78 2f06 s ASN 30 Cb -0.16 -2.49 -0.03 0.00 -1.45 0.00 0.00 41.25 37.12 2f06 s ASN 30 CO 0.10 0.19 0.59 -0.76 -3.72 0.00 0.00 177.10 173.50 2f06 s LEU 31 N -1.03 4.23 -0.15 3.21 1.43 -1.26 -0.15 118.68 124.96 2f06 s LEU 31 Ca 0.36 0.90 0.02 0.00 -1.03 0.00 0.00 54.13 54.38 2f06 s LEU 31 Cb -0.23 -2.86 -0.23 0.00 0.03 0.00 0.00 46.19 42.90 2f06 s LEU 31 CO 0.26 -0.14 0.24 -1.20 0.23 0.00 0.00 176.35 175.73 2f06 n SER 32 N 4.29 1.60 -3.64 2.29 7.64 0.77 -4.97 113.62 121.61 2f06 n SER 32 Ca -0.03 0.13 -0.08 0.00 1.01 0.00 0.00 58.87 59.90 2f06 n SER 32 Cb 0.51 -0.38 -0.07 0.00 -1.01 0.00 0.00 64.21 63.26 2f06 n SER 32 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2f06 s ALA 33 N -2.55 -1.98 0.21 -0.43 0.00 -1.13 -4.93 121.76 110.96 2f06 s ALA 33 Ca -0.21 2.17 -0.10 0.00 0.00 0.00 0.00 51.96 53.82 2f06 s ALA 33 Cb 0.07 -1.45 -0.01 0.00 0.00 0.00 0.00 23.12 21.74 2f06 s ALA 33 CO 0.74 -0.33 0.37 -0.48 0.00 0.00 0.00 175.76 176.07 2f06 s LEU 34 N 0.99 0.61 -0.28 0.00 0.05 -1.26 0.89 118.68 119.68 2f06 s LEU 34 Ca -0.05 -0.93 -0.17 0.00 0.05 0.00 0.00 54.13 53.03 2f06 s LEU 34 Cb -0.05 1.43 0.10 0.00 -2.05 0.00 0.00 46.19 45.63 2f06 s LEU 34 CO -0.11 -1.01 0.78 0.00 -0.55 0.00 0.00 176.35 175.45 2f06 s ILE 36 N 1.44 5.36 -0.47 0.00 1.01 -1.26 -0.68 121.20 126.59 2f06 s ILE 36 Ca -0.09 0.27 -0.17 0.00 0.00 0.00 0.00 60.65 60.67 2f06 s ILE 36 Cb -0.05 -3.52 0.06 0.00 0.01 0.00 0.00 42.46 38.96 2f06 s ILE 36 CO -0.17 0.37 0.45 0.00 0.00 0.00 0.00 174.94 175.60 2f06 s ALA 37 N 0.79 3.49 0.22 9.38 0.00 0.70 -4.92 121.76 131.43 2f06 s ALA 37 Ca 0.10 -1.92 0.09 0.00 0.00 0.00 0.00 51.96 50.22 2f06 s ALA 37 Cb -0.13 -3.13 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 2f06 s ALA 37 CO 0.03 -1.77 -0.02 -1.21 0.00 0.00 0.00 175.76 172.79 2f06 s GLU 38 N 1.96 2.29 0.29 0.00 2.02 -1.26 -1.01 118.70 122.99 2f06 s GLU 38 Ca 0.08 -1.30 0.01 0.00 0.02 0.00 0.00 54.97 53.78 2f06 s GLU 38 Cb -0.22 -2.22 -0.00 0.00 0.10 0.00 0.00 34.13 31.79 2f06 s GLU 38 CO 0.09 0.40 0.02 0.27 0.02 0.00 0.00 175.26 176.07 2f06 n ASN 39 N -0.52 2.37 0.27 -0.19 0.23 0.33 -5.00 115.26 112.76 2f06 n ASN 39 Ca -0.08 -2.33 0.18 0.00 -0.53 0.00 0.00 54.58 51.82 2f06 n ASN 39 Cb 0.57 0.32 0.93 0.00 -2.08 0.00 0.00 39.78 39.53 2f06 n ASN 39 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2f06 h ALA 40 N 1.22 1.52 0.00 -2.53 0.00 -2.02 -3.22 119.26 114.23 2f06 h ALA 40 Ca -0.24 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.49 2f06 h ALA 40 Cb 0.75 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 2f06 h ALA 40 CO 0.39 -0.19 -1.69 -0.25 0.00 0.00 0.00 179.25 177.51 2f06 n ASP 41 N -3.53 3.03 -3.49 0.00 8.00 -1.26 -5.07 116.55 114.23 2f06 n ASP 41 Ca -0.01 -0.06 -0.14 0.00 0.71 0.00 0.00 54.79 55.30 2f06 n ASP 41 Cb 0.24 -0.12 -0.05 0.00 -0.02 0.00 0.00 41.12 41.16 2f06 n ASP 41 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2f06 s PHE 42 N -2.24 0.97 0.30 1.24 -0.71 -1.22 -4.40 117.98 111.92 2f06 s PHE 42 Ca -0.15 -1.21 0.10 0.00 -1.04 0.00 0.00 56.93 54.62 2f06 s PHE 42 Cb 0.04 -0.10 -0.06 0.00 -1.21 0.00 0.00 43.02 41.69 2f06 s PHE 42 CO 0.29 -1.05 -0.12 0.20 -1.34 0.00 0.00 175.22 173.20 2f06 s GLY 43 N -3.19 1.98 -0.21 1.99 0.00 -0.97 -0.51 107.32 106.41 2f06 s GLY 43 Ca 0.30 -1.96 -0.01 0.00 0.00 0.00 0.00 44.72 43.05 2f06 s GLY 43 CO 0.18 -1.96 -0.12 -0.42 0.00 0.00 0.00 173.10 170.78 2f06 s ILE 44 N -2.69 2.61 -0.37 0.90 1.09 -0.18 -1.16 121.20 121.40 2f06 s ILE 44 Ca 0.30 -0.86 -0.29 0.00 -1.10 0.00 0.00 60.65 58.71 2f06 s ILE 44 Cb 0.00 -2.20 0.02 0.00 -1.06 0.00 0.00 42.46 39.23 2f06 s ILE 44 CO 0.14 0.41 1.17 -0.22 -0.10 0.00 0.00 174.94 176.34 2f06 s LEU 45 N 1.34 3.81 -0.11 2.97 2.96 0.13 -0.22 118.68 129.56 2f06 s LEU 45 Ca 0.04 0.89 -0.15 0.00 -0.22 0.00 0.00 54.13 54.69 2f06 s LEU 45 Cb -0.14 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.95 2f06 s LEU 45 CO -0.08 -1.08 0.37 -0.13 -1.32 0.00 0.00 176.35 174.11 2f06 s ARG 46 N 4.10 4.17 -0.12 1.98 0.52 0.15 -0.59 118.95 129.17 2f06 s ARG 46 Ca 0.50 0.28 -0.06 0.00 -0.52 0.00 0.00 55.73 55.93 2f06 s ARG 46 Cb -0.12 -3.37 0.05 0.00 0.52 0.00 0.00 34.95 32.03 2f06 s ARG 46 CO 0.23 0.34 0.27 0.20 0.02 0.00 0.00 175.30 176.36 2f06 s GLY 47 N 0.10 -0.16 -0.31 -3.53 0.00 0.16 -1.08 107.32 102.49 2f06 s GLY 47 Ca 0.21 1.05 -0.12 0.00 0.00 0.00 0.00 44.72 45.86 2f06 s GLY 47 CO 0.08 1.42 0.22 -0.42 0.00 0.00 0.00 173.10 174.40 2f06 s ILE 48 N 1.46 5.29 0.43 0.90 -1.09 0.26 -0.88 121.20 127.56 2f06 s ILE 48 Ca -0.08 -0.04 0.06 0.00 -2.23 0.00 0.00 60.65 58.37 2f06 s ILE 48 Cb -0.10 -3.64 -0.06 0.00 -1.58 0.00 0.00 42.46 37.07 2f06 s ILE 48 CO -0.09 0.10 0.05 0.68 -1.23 0.00 0.00 174.94 174.45 2f06 s VAL 49 N 1.75 1.93 0.11 2.92 -7.23 -1.26 -0.16 120.40 118.45 2f06 s VAL 49 Ca 0.07 -1.93 0.19 0.00 -1.81 0.00 0.00 61.98 58.50 2f06 s VAL 49 Cb -0.17 -2.86 0.13 0.00 0.56 0.00 0.00 36.38 34.05 2f06 s VAL 49 CO 0.11 0.00 1.69 0.77 -0.31 0.00 0.00 175.10 177.36 2f06 h SER 50 N 1.62 0.00 -2.19 4.85 4.64 -0.62 -3.39 113.55 118.46 2f06 h SER 50 Ca -0.44 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.40 2f06 h SER 50 Cb 1.25 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 63.00 2f06 h SER 50 CO 0.77 0.38 -0.80 -0.62 -0.87 0.00 0.00 176.83 175.69 2f06 s ASP 51 N -6.41 1.60 0.40 4.97 -1.08 -1.26 -4.85 116.67 110.04 2f06 s ASP 51 Ca 0.01 -2.19 0.07 0.00 -0.52 0.00 0.00 52.55 49.92 2f06 s ASP 51 Cb 0.10 0.09 0.81 0.00 -1.46 0.00 0.00 42.92 42.47 2f06 s ASP 51 CO 0.69 -0.23 2.00 1.55 0.52 0.00 0.00 175.17 179.70 2f06 h PRO 52 N 6.50 0.47 -0.23 4.34 0.13 -1.92 -1.32 132.00 139.97 2f06 h PRO 52 Ca 0.11 -0.05 -0.11 0.00 -0.87 0.00 0.00 66.00 65.08 2f06 h PRO 52 Cb 0.99 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 32.03 2f06 h PRO 52 CO 0.25 0.38 -0.28 -0.44 -0.23 0.00 0.00 178.00 177.68 2f06 h ASP 53 N 0.47 0.65 -0.44 1.44 3.32 -1.98 0.16 116.42 120.04 2f06 h ASP 53 Ca 0.12 -0.50 -0.04 0.00 0.02 0.00 0.00 57.03 56.63 2f06 h ASP 53 Cb 0.09 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 2f06 h ASP 53 CO -0.01 1.01 0.11 0.50 -1.72 0.00 0.00 179.24 179.12 2f06 h LYS 54 N 0.29 0.71 -0.04 3.56 3.64 -1.98 -2.18 116.57 120.58 2f06 h LYS 54 Ca 0.03 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 2f06 h LYS 54 Cb 0.85 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.58 2f06 h LYS 54 CO 0.07 0.71 0.02 0.00 -2.27 0.00 0.00 179.45 177.98 2f06 h ALA 55 N 0.97 0.05 -0.54 5.00 0.00 -1.13 -1.92 119.26 121.69 2f06 h ALA 55 Ca 0.14 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.13 2f06 h ALA 55 Cb 0.32 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.02 2f06 h ALA 55 CO 0.00 -0.45 0.13 -0.92 0.00 0.00 0.00 179.25 178.01 2f06 h TYR 56 N 0.03 0.20 -0.23 0.00 3.20 -0.64 -1.19 116.97 118.34 2f06 h TYR 56 Ca 0.01 0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.76 2f06 h TYR 56 Cb 0.01 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 2f06 h TYR 56 CO -0.07 0.00 -0.49 -0.22 -1.64 0.00 0.00 178.16 175.75 2f06 h LYS 57 N 0.27 0.63 -0.26 1.82 3.64 -1.23 -1.55 116.57 119.88 2f06 h LYS 57 Ca 0.27 -0.37 0.02 0.00 -1.27 0.00 0.00 60.65 59.30 2f06 h LYS 57 Cb 0.37 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 2f06 h LYS 57 CO -0.34 0.98 0.13 0.00 -2.27 0.00 0.00 179.45 177.94 2f06 h ALA 58 N 0.96 0.32 -0.03 5.00 0.00 -1.15 -0.76 119.26 123.59 2f06 h ALA 58 Ca 0.02 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2f06 h ALA 58 Cb 1.03 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 2f06 h ALA 58 CO 0.10 -0.26 0.02 -0.07 0.00 0.00 0.00 179.25 179.03 2f06 h LEU 59 N 0.28 0.04 -0.92 0.00 3.38 -1.14 -0.66 115.31 116.29 2f06 h LEU 59 Ca 0.11 -0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.15 2f06 h LEU 59 Cb 0.03 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.70 2f06 h LEU 59 CO -0.07 0.04 0.57 0.11 0.09 0.00 0.00 178.44 179.17 2f06 h LYS 60 N 0.03 0.95 -0.70 1.13 1.79 -1.21 -0.74 116.57 117.82 2f06 h LYS 60 Ca 0.01 -0.06 -0.00 0.00 -2.18 0.00 0.00 60.65 58.42 2f06 h LYS 60 Cb 0.01 -0.21 -0.03 0.00 -1.58 0.00 0.00 32.23 30.41 2f06 h LYS 60 CO -0.00 0.63 0.42 -0.44 -1.08 0.00 0.00 179.45 178.98 2f06 h ASP 61 N 0.98 0.83 -0.34 0.86 3.32 -0.88 -1.93 116.42 119.25 2f06 h ASP 61 Ca 0.42 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.43 2f06 h ASP 61 Cb 0.29 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.63 2f06 h ASP 61 CO -0.21 0.64 0.00 0.59 -1.72 0.00 0.00 179.24 178.53 2f06 n ASN 62 N -4.40 2.11 -0.60 6.45 3.02 -0.28 -4.94 115.26 116.64 2f06 n ASN 62 Ca 0.07 -2.07 -0.06 0.00 -0.03 0.00 0.00 54.58 52.49 2f06 n ASN 62 Cb 0.07 -0.29 -0.01 0.00 -0.61 0.00 0.00 39.78 38.93 2f06 n ASN 62 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2f06 n HIS 63 N 0.50 -0.17 -2.93 3.10 8.25 -0.73 -5.03 115.22 118.22 2f06 n HIS 63 Ca 0.12 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.24 2f06 n HIS 63 Cb 0.36 -1.66 -0.07 0.00 1.12 0.00 0.00 29.99 29.75 2f06 n HIS 63 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2f06 s PHE 64 N -2.27 3.45 -0.33 4.41 0.08 -0.35 -5.00 117.98 117.96 2f06 s PHE 64 Ca 0.00 1.52 -0.22 0.00 0.12 0.00 0.00 56.93 58.34 2f06 s PHE 64 Cb 0.00 -2.75 0.00 0.00 -0.57 0.00 0.00 43.02 39.70 2f06 s PHE 64 CO 0.00 0.06 0.73 0.00 -0.10 0.00 0.00 175.22 175.92 2f06 s ALA 65 N -1.93 3.49 0.01 5.36 0.00 -1.26 -4.24 121.76 123.18 2f06 s ALA 65 Ca 0.55 -0.60 0.03 0.00 0.00 0.00 0.00 51.96 51.94 2f06 s ALA 65 Cb -0.12 -3.26 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 2f06 s ALA 65 CO 0.17 -1.28 -0.09 0.08 0.00 0.00 0.00 175.76 174.64 2f06 s VAL 66 N 2.90 0.67 0.11 0.00 1.01 -1.26 -1.44 120.40 122.38 2f06 s VAL 66 Ca 0.29 -0.52 0.05 0.00 0.00 0.00 0.00 61.98 61.80 2f06 s VAL 66 Cb -0.14 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 2f06 s VAL 66 CO 0.14 0.08 -0.13 0.20 0.00 0.00 0.00 175.10 175.39 2f06 s ASN 67 N -0.50 1.80 -0.10 3.32 0.01 -0.00 -4.96 114.94 114.51 2f06 s ASN 67 Ca 0.01 -0.78 -0.02 0.00 -0.71 0.00 0.00 52.86 51.36 2f06 s ASN 67 Cb -0.05 -0.04 -0.03 0.00 0.41 0.00 0.00 41.25 41.54 2f06 s ASN 67 CO 0.00 -0.17 -0.02 -0.63 -1.51 0.00 0.00 177.10 174.78 2f06 s ILE 68 N -2.09 4.14 0.07 0.60 1.01 -1.26 -0.37 121.20 123.30 2f06 s ILE 68 Ca 0.06 -0.30 0.08 0.00 0.00 0.00 0.00 60.65 60.49 2f06 s ILE 68 Cb -0.05 -2.75 -0.03 0.00 0.01 0.00 0.00 42.46 39.64 2f06 s ILE 68 CO 0.02 0.58 -0.21 -0.89 0.00 0.00 0.00 174.94 174.44 2f06 s THR 69 N -0.62 1.69 0.04 2.92 2.01 -0.20 -4.94 115.64 116.55 2f06 s THR 69 Ca 0.10 -1.38 -0.27 0.00 0.31 0.00 0.00 61.69 60.45 2f06 s THR 69 Cb -0.12 -1.51 -0.05 0.00 0.01 0.00 0.00 72.50 70.84 2f06 s THR 69 CO 0.02 0.07 0.85 -1.81 -0.69 0.00 0.00 174.62 173.06 2f06 s ASP 70 N -1.56 7.30 0.22 3.53 1.01 -1.26 -0.19 116.67 125.72 2f06 s ASP 70 Ca 0.07 1.56 0.00 0.00 0.71 0.00 0.00 52.55 54.89 2f06 s ASP 70 Cb -0.09 -2.51 -0.04 0.00 1.01 0.00 0.00 42.92 41.28 2f06 s ASP 70 CO 0.03 -0.07 0.14 0.68 0.21 0.00 0.00 175.17 176.16 2f06 s VAL 71 N 0.23 0.09 -0.02 -1.27 -7.23 -0.70 -4.84 120.40 106.66 2f06 s VAL 71 Ca 0.43 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.63 2f06 s VAL 71 Cb -0.21 -2.52 -0.00 0.00 0.56 0.00 0.00 36.38 34.21 2f06 s VAL 71 CO 0.25 0.00 -0.10 0.54 -0.31 0.00 0.00 175.10 175.48 2f06 s VAL 72 N -4.03 0.85 -0.13 1.32 0.11 -0.43 -0.14 120.40 117.95 2f06 s VAL 72 Ca 0.39 -0.42 -0.07 0.00 -2.93 0.00 0.00 61.98 58.94 2f06 s VAL 72 Cb 0.07 -0.73 -0.04 0.00 -1.53 0.00 0.00 36.38 34.14 2f06 s VAL 72 CO 0.14 0.25 0.14 -0.83 -3.33 0.00 0.00 175.10 171.47 2f06 s GLY 73 N -0.01 2.15 0.15 6.54 0.00 -1.26 -0.33 107.32 114.56 2f06 s GLY 73 Ca 0.00 -0.64 0.04 0.00 0.00 0.00 0.00 44.72 44.12 2f06 s GLY 73 CO 0.00 -0.34 -0.08 -0.26 0.00 0.00 0.00 173.10 172.42 2f06 s ILE 74 N -0.93 1.03 -0.02 0.90 -4.36 0.57 0.09 121.20 118.47 2f06 s ILE 74 Ca 0.15 -2.03 0.06 0.00 -0.26 0.00 0.00 60.65 58.56 2f06 s ILE 74 Cb -0.12 -1.88 -0.01 0.00 1.25 0.00 0.00 42.46 41.70 2f06 s ILE 74 CO 0.04 -0.71 -0.20 -0.55 0.24 0.00 0.00 174.94 173.76 2f06 s SER 75 N -3.16 2.34 0.21 4.36 0.15 -0.42 -0.23 113.70 116.95 2f06 s SER 75 Ca 0.17 -0.37 -0.01 0.00 0.70 0.00 0.00 55.95 56.45 2f06 s SER 75 Cb 0.04 -0.38 -0.04 0.00 -1.71 0.00 0.00 66.02 63.93 2f06 s SER 75 CO 0.01 0.22 0.13 0.00 1.20 0.00 0.00 173.24 174.80 2f06 n PRO 77 N -0.29 1.62 -2.09 0.00 -0.02 -1.26 -1.06 135.00 131.90 2f06 n PRO 77 Ca 0.02 0.60 -0.41 0.00 -2.02 0.00 0.00 63.50 61.68 2f06 n PRO 77 Cb 0.66 -2.53 -0.00 0.00 -0.02 0.00 0.00 33.50 31.61 2f06 n PRO 77 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2f06 n ASN 78 N -0.94 6.49 -4.09 2.55 5.15 -0.70 -4.55 115.26 119.17 2f06 n ASN 78 Ca 0.11 -3.07 -0.11 0.00 -0.60 0.00 0.00 54.58 50.91 2f06 n ASN 78 Cb 0.45 -1.45 -0.11 0.00 -0.53 0.00 0.00 39.78 38.14 2f06 n ASN 78 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2f06 s VAL 79 N 0.04 0.48 0.22 3.44 -7.23 -1.26 -4.92 120.40 111.17 2f06 s VAL 79 Ca 0.48 -1.49 -0.32 0.00 -1.81 0.00 0.00 61.98 58.85 2f06 s VAL 79 Cb 0.14 -1.10 -0.14 0.00 0.56 0.00 0.00 36.38 35.84 2f06 s VAL 79 CO -0.04 -0.68 1.32 -2.65 -0.31 0.00 0.00 175.10 172.74 2f06 n PRO 80 N 0.71 1.75 -0.71 4.82 -0.02 -1.26 -2.81 135.00 137.49 2f06 n PRO 80 Ca -0.18 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 2f06 n PRO 80 Cb 0.58 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 2f06 n PRO 80 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2f06 n GLY 81 N 2.09 0.89 0.06 -1.23 0.00 -1.26 -4.92 105.19 100.83 2f06 n GLY 81 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 2f06 n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f06 h ALA 82 N 0.00 0.01 -0.75 4.61 0.00 -1.81 -2.16 119.26 119.16 2f06 h ALA 82 Ca 0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 2f06 h ALA 82 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2f06 h ALA 82 CO 0.00 -0.13 0.33 1.25 0.00 0.00 0.00 179.25 180.70 2f06 h LEU 83 N -0.68 1.00 -0.95 0.00 5.85 -1.85 -2.70 115.31 115.98 2f06 h LEU 83 Ca -0.00 -0.15 0.26 0.00 0.84 0.00 0.00 57.88 58.83 2f06 h LEU 83 Cb 0.72 -0.26 -0.13 0.00 0.37 0.00 0.00 40.66 41.36 2f06 h LEU 83 CO 0.00 0.88 0.47 0.00 -0.34 0.00 0.00 178.44 179.45 2f06 h ALA 84 N 1.17 1.66 -0.19 1.25 0.00 -1.94 -1.50 119.26 119.69 2f06 h ALA 84 Ca 0.25 0.17 -0.13 0.00 0.00 0.00 0.00 54.91 55.21 2f06 h ALA 84 Cb 0.16 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2f06 h ALA 84 CO -0.03 -0.41 -0.38 -0.22 0.00 0.00 0.00 179.25 178.21 2f06 h LYS 85 N 0.40 0.59 -0.57 0.00 3.64 -1.05 -2.27 116.57 117.31 2f06 h LYS 85 Ca 0.63 -0.38 0.02 0.00 -1.27 0.00 0.00 60.65 59.64 2f06 h LYS 85 Cb 1.29 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 33.13 2f06 h LYS 85 CO -0.56 1.00 0.36 0.28 -2.27 0.00 0.00 179.45 178.26 2f06 h VAL 86 N 0.26 1.11 0.00 2.00 2.07 -1.30 -1.60 116.25 118.79 2f06 h VAL 86 Ca 0.01 -0.25 -0.11 0.00 0.82 0.00 0.00 66.70 67.16 2f06 h VAL 86 Cb 0.98 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 2f06 h VAL 86 CO 0.08 0.13 -0.54 -0.07 0.02 0.00 0.00 177.57 177.20 2f06 h LEU 87 N 0.73 0.00 -0.16 2.57 3.38 -1.24 -1.99 115.31 118.60 2f06 h LEU 87 Ca 0.22 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.96 2f06 h LEU 87 Cb -0.03 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.72 2f06 h LEU 87 CO -0.07 0.54 -0.92 1.23 0.09 0.00 0.00 178.44 179.31 2f06 h GLY 88 N 1.99 0.61 0.81 0.83 0.00 -1.16 0.21 103.07 106.36 2f06 h GLY 88 Ca -0.01 -1.00 0.03 0.00 0.00 0.00 0.00 47.33 46.35 2f06 h GLY 88 CO 0.07 0.89 0.14 0.74 0.00 0.00 0.00 176.54 178.37 2f06 h PHE 89 N 0.33 0.25 -0.10 5.60 0.04 -0.84 -1.05 116.94 121.17 2f06 h PHE 89 Ca -0.08 0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.68 2f06 h PHE 89 Cb 1.55 -0.07 -0.00 0.00 2.20 0.00 0.00 35.95 39.63 2f06 h PHE 89 CO 0.07 0.13 -0.04 -0.07 -0.60 0.00 0.00 178.31 177.80 2f06 h LEU 90 N 0.30 0.20 -0.92 1.54 3.38 -1.07 -3.06 115.31 115.68 2f06 h LEU 90 Ca 0.13 -0.40 -0.09 0.00 0.09 0.00 0.00 57.88 57.61 2f06 h LEU 90 Cb 0.07 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2f06 h LEU 90 CO -0.11 0.56 -0.22 0.77 0.09 0.00 0.00 178.44 179.53 2f06 h SER 91 N -0.16 0.54 -0.14 -0.43 4.64 -0.54 -1.03 113.55 116.43 2f06 h SER 91 Ca 0.02 -0.18 0.04 0.00 -0.47 0.00 0.00 61.79 61.21 2f06 h SER 91 Cb 0.48 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 2f06 h SER 91 CO 0.01 0.76 0.24 0.00 -0.87 0.00 0.00 176.83 176.97 2f06 h ALA 92 N 1.29 1.62 -0.49 5.18 0.00 -1.12 0.31 119.26 126.04 2f06 h ALA 92 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2f06 h ALA 92 Cb 0.65 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2f06 h ALA 92 CO 0.05 -0.31 0.00 0.39 0.00 0.00 0.00 179.25 179.38 2f06 n GLU 93 N -3.47 3.14 -1.70 0.00 -0.58 -0.61 -4.98 120.64 112.44 2f06 n GLU 93 Ca 0.01 -2.55 -0.12 0.00 -0.42 0.00 0.00 57.16 54.08 2f06 n GLU 93 Cb 0.34 -1.61 -0.03 0.00 -0.57 0.00 0.00 31.44 29.57 2f06 n GLU 93 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2f06 n GLY 94 N 0.74 0.72 3.49 0.62 0.00 0.10 -5.01 105.19 105.85 2f06 n GLY 94 Ca 0.20 -0.44 -0.39 0.00 0.00 0.00 0.00 46.02 45.39 2f06 n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f06 s VAL 95 N -2.50 4.85 0.22 1.61 1.01 -0.49 -4.99 120.40 120.11 2f06 s VAL 95 Ca 0.00 -0.22 0.08 0.00 0.00 0.00 0.00 61.98 61.84 2f06 s VAL 95 Cb 0.00 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 2f06 s VAL 95 CO 0.00 0.13 0.07 0.72 0.00 0.00 0.00 175.10 176.02 2f06 s PHE 96 N 1.67 2.92 -0.26 5.22 -0.71 -1.26 -3.63 117.98 121.93 2f06 s PHE 96 Ca 0.06 -0.14 -0.21 0.00 -1.04 0.00 0.00 56.93 55.61 2f06 s PHE 96 Cb -0.17 -1.35 -0.02 0.00 -1.21 0.00 0.00 43.02 40.27 2f06 s PHE 96 CO 0.08 0.55 0.64 0.42 -1.34 0.00 0.00 175.22 175.57 2f06 s ILE 97 N -2.01 4.97 -0.03 -4.49 -1.09 -1.26 0.49 121.20 117.78 2f06 s ILE 97 Ca 0.30 1.15 -0.24 0.00 -2.23 0.00 0.00 60.65 59.64 2f06 s ILE 97 Cb -0.08 -3.95 -0.17 0.00 -1.58 0.00 0.00 42.46 36.67 2f06 s ILE 97 CO 0.21 0.01 1.08 -0.33 -1.23 0.00 0.00 174.94 174.68 2f06 h GLU 98 N 7.90 -0.19 0.00 2.79 5.08 -0.81 -3.47 114.58 125.88 2f06 h GLU 98 Ca -0.26 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.09 2f06 h GLU 98 Cb 1.12 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 2f06 h GLU 98 CO 0.78 0.24 0.01 2.48 -1.00 0.00 0.00 179.01 181.52 2f06 n TYR 99 N -4.95 -0.95 -3.52 4.33 4.11 -1.15 -5.04 117.16 109.98 2f06 n TYR 99 Ca -0.08 -0.33 -0.15 0.00 -0.00 0.00 0.00 57.90 57.33 2f06 n TYR 99 Cb 0.26 0.12 -0.05 0.00 -0.00 0.00 0.00 39.34 39.67 2f06 n TYR 99 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.86 178.38 2f06 s TYR 101 N -6.55 -0.57 -0.13 -3.48 1.13 -0.65 -0.71 117.35 106.38 2f06 s TYR 101 Ca 0.03 0.92 -0.30 0.00 -1.41 0.00 0.00 57.07 56.32 2f06 s TYR 101 Cb -0.01 0.44 0.12 0.00 -1.10 0.00 0.00 41.96 41.41 2f06 s TYR 101 CO 0.02 -0.56 0.97 -1.54 -2.51 0.00 0.00 175.55 171.93 2f06 s SER 102 N -1.34 -0.38 0.05 -0.18 1.04 -1.26 -0.96 113.70 110.68 2f06 s SER 102 Ca -0.07 0.34 0.04 0.00 0.48 0.00 0.00 55.95 56.74 2f06 s SER 102 Cb -0.00 0.33 -0.03 0.00 0.10 0.00 0.00 66.02 66.42 2f06 s SER 102 CO 0.06 -0.40 -0.11 -0.36 0.98 0.00 0.00 173.24 173.40 2f06 s PHE 103 N -1.48 0.96 0.15 5.02 0.40 -1.11 -5.02 117.98 116.90 2f06 s PHE 103 Ca -0.01 -0.46 -0.30 0.00 -0.60 0.00 0.00 56.93 55.56 2f06 s PHE 103 Cb -0.01 -0.55 -0.08 0.00 0.51 0.00 0.00 43.02 42.89 2f06 s PHE 103 CO 0.00 -0.01 1.27 0.00 0.70 0.00 0.00 175.22 177.18 2f06 s ALA 104 N -1.25 3.48 -0.43 5.36 0.00 -1.26 -1.86 121.76 125.81 2f06 s ALA 104 Ca -0.05 1.01 0.03 0.00 0.00 0.00 0.00 51.96 52.95 2f06 s ALA 104 Cb -0.10 -3.46 0.12 0.00 0.00 0.00 0.00 23.12 19.68 2f06 s ALA 104 CO 0.01 -0.48 0.17 1.21 0.00 0.00 0.00 175.76 176.68 2f06 s ASN 105 N 0.58 4.29 0.68 0.00 3.84 0.72 -4.95 114.94 120.10 2f06 s ASN 105 Ca 0.58 -2.53 0.00 0.00 0.21 0.00 0.00 52.86 51.12 2f06 s ASN 105 Cb -0.34 -1.43 0.00 0.00 -0.55 0.00 0.00 41.25 38.93 2f06 s ASN 105 CO 0.34 -0.30 0.00 -3.20 -2.79 0.00 0.00 177.10 171.15 2f06 n ASN 106 N 3.73 0.00 0.04 -4.21 5.15 -1.26 -1.45 115.26 117.26 2f06 n ASN 106 Ca 0.05 0.00 0.13 0.00 -0.60 0.00 0.00 54.58 54.15 2f06 n ASN 106 Cb 0.37 0.00 0.35 0.00 -0.53 0.00 0.00 39.78 39.97 2f06 n ASN 106 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2f06 n ASN 107 N 6.56 0.49 -3.84 1.20 5.03 -1.26 -4.79 115.26 118.66 2f06 n ASN 107 Ca 0.00 0.22 -0.23 0.00 0.87 0.00 0.00 54.58 55.43 2f06 n ASN 107 Cb 0.00 -0.18 -0.05 0.00 -1.02 0.00 0.00 39.78 38.52 2f06 n ASN 107 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 2f06 n VAL 108 N -1.83 0.00 -3.94 2.41 0.24 -0.53 -1.73 118.33 112.96 2f06 n VAL 108 Ca 0.05 -1.86 -0.13 0.00 -2.04 0.00 0.00 64.34 60.37 2f06 n VAL 108 Cb 0.39 0.47 -0.14 0.00 -1.47 0.00 0.00 33.84 33.08 2f06 n VAL 108 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2f06 s ALA 109 N -2.74 0.10 -0.16 2.33 0.00 -0.23 -0.20 121.76 120.87 2f06 s ALA 109 Ca 0.05 -0.05 -0.07 0.00 0.00 0.00 0.00 51.96 51.89 2f06 s ALA 109 Cb 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.06 2f06 s ALA 109 CO 0.04 0.03 0.07 -0.80 0.00 0.00 0.00 175.76 175.09 2f06 s ASN 110 N -0.03 5.69 -0.07 0.00 -0.87 -0.78 -1.81 114.94 117.08 2f06 s ASN 110 Ca 0.00 0.15 0.01 0.00 -1.57 0.00 0.00 52.86 51.46 2f06 s ASN 110 Cb -0.00 -1.90 0.02 0.00 -0.02 0.00 0.00 41.25 39.34 2f06 s ASN 110 CO -0.00 0.24 -0.08 -0.69 -2.57 0.00 0.00 177.10 174.00 2f06 s VAL 111 N -0.05 0.88 -0.23 1.60 1.01 0.68 -2.75 120.40 121.54 2f06 s VAL 111 Ca 0.07 -0.30 -0.11 0.00 0.00 0.00 0.00 61.98 61.64 2f06 s VAL 111 Cb -0.12 -0.86 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 2f06 s VAL 111 CO 0.01 0.31 0.17 -0.69 0.00 0.00 0.00 175.10 174.90 2f06 s VAL 112 N 1.01 5.36 -0.07 2.92 1.01 -0.14 -0.32 120.40 130.18 2f06 s VAL 112 Ca -0.09 0.21 0.06 0.00 0.00 0.00 0.00 61.98 62.16 2f06 s VAL 112 Cb -0.15 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 32.72 2f06 s VAL 112 CO -0.00 0.35 -0.25 -0.63 0.00 0.00 0.00 175.10 174.58 2f06 s ILE 113 N 0.97 2.08 -0.46 2.22 -1.09 0.55 -1.64 121.20 123.83 2f06 s ILE 113 Ca 0.08 -1.05 -0.06 0.00 -2.23 0.00 0.00 60.65 57.40 2f06 s ILE 113 Cb -0.13 -1.76 0.12 0.00 -1.58 0.00 0.00 42.46 39.11 2f06 s ILE 113 CO 0.04 0.57 0.29 -0.60 -1.23 0.00 0.00 174.94 174.01 2f06 s ARG 114 N -0.07 2.27 0.58 2.79 6.06 0.11 -1.32 118.95 129.37 2f06 s ARG 114 Ca -0.06 -1.88 -0.10 0.00 -2.50 0.00 0.00 55.73 51.19 2f06 s ARG 114 Cb -0.15 -3.75 -0.04 0.00 0.06 0.00 0.00 34.95 31.08 2f06 s ARG 114 CO 0.05 -1.14 0.96 -1.25 -2.50 0.00 0.00 175.30 171.43 2f06 s PRO 115 N 1.09 3.60 0.36 5.12 0.04 -1.26 -0.15 135.00 143.80 2f06 s PRO 115 Ca 0.08 0.61 0.03 0.00 0.04 0.00 0.00 61.00 61.77 2f06 s PRO 115 Cb -0.24 -2.16 0.67 0.00 0.04 0.00 0.00 34.50 32.81 2f06 s PRO 115 CO -0.03 -0.47 2.01 0.66 0.04 0.00 0.00 177.00 179.21 2f06 h SER 116 N -0.14 0.67 -4.58 6.66 4.64 -0.30 -3.43 113.55 117.08 2f06 h SER 116 Ca -0.45 -0.03 -0.44 0.00 -0.47 0.00 0.00 61.79 60.41 2f06 h SER 116 Cb 1.19 -0.17 -0.11 0.00 -0.31 0.00 0.00 62.40 63.00 2f06 h SER 116 CO 0.62 0.50 -0.42 -3.20 -0.87 0.00 0.00 176.83 173.46 2f06 n ASN 117 N -4.43 -0.35 0.00 4.97 2.85 -1.26 -5.00 115.26 112.03 2f06 n ASN 117 Ca 0.05 -2.97 0.00 0.00 -0.11 0.00 0.00 54.58 51.56 2f06 n ASN 117 Cb 0.06 1.42 0.00 0.00 1.24 0.00 0.00 39.78 42.50 2f06 n ASN 117 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 2f06 n ASP 119 N -1.78 0.00 -0.08 1.20 8.00 -1.26 -1.90 116.55 120.73 2f06 n ASP 119 Ca 0.05 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.48 2f06 n ASP 119 Cb 0.54 0.00 0.11 0.00 -0.02 0.00 0.00 41.12 41.75 2f06 n ASP 119 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2f06 h LYS 120 N 0.00 0.75 -0.13 -1.24 1.63 -1.99 -2.45 116.57 113.13 2f06 h LYS 120 Ca 0.00 -0.28 -0.00 0.00 -0.85 0.00 0.00 60.65 59.52 2f06 h LYS 120 Cb 0.00 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.58 2f06 h LYS 120 CO 0.00 0.88 0.08 0.00 -3.45 0.00 0.00 179.45 176.96 2f06 h ILE 122 N 0.15 1.25 0.28 0.00 2.04 -1.80 -2.31 117.51 117.12 2f06 h ILE 122 Ca 0.05 -1.09 -0.00 0.00 1.00 0.00 0.00 64.86 64.82 2f06 h ILE 122 Cb 0.03 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 2f06 h ILE 122 CO -0.01 0.37 -0.24 -0.08 0.00 0.00 0.00 178.15 178.19 2f06 h GLU 123 N 0.63 -0.52 -0.32 2.37 4.81 -1.22 -1.87 114.58 118.46 2f06 h GLU 123 Ca 0.11 0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.41 2f06 h GLU 123 Cb 0.53 0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.00 2f06 h GLU 123 CO 0.03 -0.34 0.14 0.28 -0.73 0.00 0.00 179.01 178.38 2f06 h VAL 124 N -0.54 0.95 -0.40 0.32 2.07 -1.19 -1.40 116.25 116.05 2f06 h VAL 124 Ca -0.01 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 2f06 h VAL 124 Cb 0.48 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 2f06 h VAL 124 CO -0.03 0.05 0.15 -0.07 0.02 0.00 0.00 177.57 177.70 2f06 h LEU 125 N 0.29 0.55 -0.16 2.57 3.38 -1.32 0.27 115.31 120.90 2f06 h LEU 125 Ca 0.14 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2f06 h LEU 125 Cb 0.08 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2f06 h LEU 125 CO -0.12 0.58 0.08 0.11 0.09 0.00 0.00 178.44 179.17 2f06 h LYS 126 N 0.50 0.23 -0.52 1.13 1.57 -1.17 -0.02 116.57 118.27 2f06 h LYS 126 Ca 0.13 -0.03 0.10 0.00 -1.87 0.00 0.00 60.65 58.97 2f06 h LYS 126 Cb 0.21 -0.04 -0.08 0.00 0.08 0.00 0.00 32.23 32.40 2f06 h LYS 126 CO -0.01 0.27 0.07 1.49 -0.57 0.00 0.00 179.45 180.71 2f06 h GLU 127 N 0.13 0.20 -0.55 3.15 4.22 -0.86 -1.04 114.58 119.82 2f06 h GLU 127 Ca 0.05 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.48 2f06 h GLU 127 Cb 0.12 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2f06 h GLU 127 CO -0.01 0.13 0.00 1.63 -2.18 0.00 0.00 179.01 178.58 2f06 n LYS 128 N -5.16 1.87 -2.88 1.92 4.76 0.93 -4.90 118.16 114.70 2f06 n LYS 128 Ca 0.06 -0.89 -0.21 0.00 -2.87 0.00 0.00 58.31 54.40 2f06 n LYS 128 Cb 0.27 -1.46 0.01 0.00 -1.84 0.00 0.00 35.03 32.02 2f06 n LYS 128 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2f06 n LYS 129 N 0.18 -3.54 -2.38 1.97 4.76 -0.39 -4.97 118.16 113.78 2f06 n LYS 129 Ca 0.08 0.79 -0.41 0.00 -2.87 0.00 0.00 58.31 55.90 2f06 n LYS 129 Cb 0.37 -5.55 -0.03 0.00 -1.84 0.00 0.00 35.03 27.97 2f06 n LYS 129 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2f06 s VAL 130 N -3.01 3.60 -0.32 -0.18 1.01 -0.09 -4.98 120.40 116.42 2f06 s VAL 130 Ca 0.21 1.34 -0.28 0.00 0.00 0.00 0.00 61.98 63.25 2f06 s VAL 130 Cb -0.10 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.40 2f06 s VAL 130 CO 0.27 0.21 1.83 -0.62 0.00 0.00 0.00 175.10 176.79 2f06 s ASP 131 N 0.13 5.86 0.33 3.32 2.15 -1.25 -4.68 116.67 122.53 2f06 s ASP 131 Ca 0.53 1.34 -0.08 0.00 0.43 0.00 0.00 52.55 54.77 2f06 s ASP 131 Cb -0.32 -2.52 -0.06 0.00 -0.30 0.00 0.00 42.92 39.71 2f06 s ASP 131 CO 0.36 -1.73 0.64 -0.76 -0.17 0.00 0.00 175.17 173.52 2f06 s LEU 132 N 6.99 3.98 -0.17 -1.34 1.43 -1.26 -1.30 118.68 127.01 2f06 s LEU 132 Ca 0.81 0.91 -0.10 0.00 -1.03 0.00 0.00 54.13 54.72 2f06 s LEU 132 Cb -0.23 -3.74 -0.05 0.00 0.03 0.00 0.00 46.19 42.20 2f06 s LEU 132 CO 0.34 -0.26 0.15 -0.76 0.23 0.00 0.00 176.35 176.05 2f06 s LEU 133 N -3.58 4.27 0.63 1.79 1.43 0.11 -4.82 118.68 118.51 2f06 s LEU 133 Ca 0.47 0.34 -0.18 0.00 -1.03 0.00 0.00 54.13 53.73 2f06 s LEU 133 Cb -0.11 -2.12 -0.02 0.00 0.03 0.00 0.00 46.19 43.97 2f06 s LEU 133 CO 0.29 0.24 1.20 0.00 0.23 0.00 0.00 176.35 178.32 2f06 n ALA 134 N 3.05 0.89 -0.29 4.21 0.00 -1.26 -4.46 120.51 122.64 2f06 n ALA 134 Ca -0.17 0.01 0.03 0.00 0.00 0.00 0.00 53.44 53.31 2f06 n ALA 134 Cb 0.53 -2.27 0.17 0.00 0.00 0.00 0.00 19.45 17.89 2f06 n ALA 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2f06 h ALA 135 N 0.55 1.20 -0.26 0.00 0.00 -1.49 -1.12 119.26 118.13 2f06 h ALA 135 Ca -0.50 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 2f06 h ALA 135 Cb 1.35 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2f06 h ALA 135 CO 0.52 0.09 0.12 0.66 0.00 0.00 0.00 179.25 180.65 2f06 h SER 136 N 0.79 0.32 -0.56 0.00 4.64 -1.90 -1.79 113.55 115.06 2f06 h SER 136 Ca 0.40 -0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.66 2f06 h SER 136 Cb 0.38 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.37 2f06 h SER 136 CO -0.25 0.29 0.17 0.44 -0.87 0.00 0.00 176.83 176.61 2f06 h ASP 137 N 0.36 0.81 -0.37 4.97 3.32 -1.56 -3.03 116.42 120.92 2f06 h ASP 137 Ca 0.09 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 2f06 h ASP 137 Cb 0.06 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 2f06 h ASP 137 CO -0.01 0.80 0.18 0.25 -1.72 0.00 0.00 179.24 178.74 2f06 h LEU 138 N 0.78 0.48 0.00 1.55 5.85 -0.99 -2.87 115.31 120.11 2f06 h LEU 138 Ca 0.18 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2f06 h LEU 138 Cb 0.28 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.19 2f06 h LEU 138 CO -0.01 0.46 0.00 -1.22 -0.34 0.00 0.00 178.44 177.34 2f06 n TYR 139 N -4.73 0.00 -1.40 1.25 4.01 -0.74 -3.09 117.16 112.46 2f06 n TYR 139 Ca -0.01 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.81 2f06 n TYR 139 Cb 0.10 -0.48 0.14 0.00 -0.31 0.00 0.00 39.34 38.80 2f06 n TYR 139 CO 0.00 0.00 0.00 0.36 -0.46 0.00 0.00 176.86 176.76 2f06 n LYS 140 N -1.48 1.19 0.00 -0.72 2.85 -1.09 -3.68 118.16 115.23 2f06 n LYS 140 Ca 0.01 -2.63 0.03 0.00 -1.05 0.00 0.00 58.31 54.67 2f06 n LYS 140 Cb 0.06 -1.36 0.16 0.00 -0.65 0.00 0.00 35.03 33.23 2f06 n LYS 140 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63