#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vb6 n ILE 21 N 0.00 0.81 0.05 -0.61 0.13 -1.26 -3.27 119.36 115.21 1vb6 n ILE 21 Ca 0.00 0.17 -0.05 0.00 -1.10 0.00 0.00 62.75 61.77 1vb6 n ILE 21 Cb 0.00 -1.02 0.15 0.00 -0.84 0.00 0.00 39.64 37.93 1vb6 n ILE 21 CO 0.00 0.00 0.00 -0.26 2.80 0.00 0.00 176.55 179.09 1vb6 h PHE 22 N 0.00 0.47 0.18 9.51 0.04 -2.06 -1.79 116.94 123.28 1vb6 h PHE 22 Ca 0.00 -0.14 -0.01 0.00 2.80 0.00 0.00 57.97 60.62 1vb6 h PHE 22 Cb 0.38 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.43 1vb6 h PHE 22 CO 0.00 0.77 -0.09 0.35 -0.60 0.00 0.00 178.31 178.74 1vb6 h PHE 23 N 0.32 -0.22 -0.86 -0.55 3.04 -2.00 -2.85 116.94 113.82 1vb6 h PHE 23 Ca 0.02 -0.01 0.08 0.00 3.98 0.00 0.00 57.97 62.05 1vb6 h PHE 23 Cb 0.90 0.07 -0.06 0.00 2.56 0.00 0.00 35.95 39.43 1vb6 h PHE 23 CO 0.03 0.09 0.56 -1.35 -2.02 0.00 0.00 178.31 175.61 1vb6 h PRO 24 N -0.54 0.86 -0.72 6.41 0.11 -1.72 0.23 132.00 136.62 1vb6 h PRO 24 Ca -0.02 -0.05 0.05 0.00 0.11 0.00 0.00 66.00 66.09 1vb6 h PRO 24 Cb 0.41 -0.19 -0.04 0.00 0.11 0.00 0.00 31.00 31.28 1vb6 h PRO 24 CO 0.04 0.57 0.47 0.00 -0.21 0.00 0.00 178.00 178.87 1vb6 h ALA 25 N 1.56 1.67 0.13 -0.75 0.00 -1.20 0.52 119.26 121.18 1vb6 h ALA 25 Ca 0.39 -0.03 -0.36 0.00 0.00 0.00 0.00 54.91 54.91 1vb6 h ALA 25 Cb 0.34 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1vb6 h ALA 25 CO -0.15 0.23 -1.98 -0.07 0.00 0.00 0.00 179.25 177.29 1vb6 h LEU 26 N 0.79 0.42 -0.50 0.00 3.38 -1.06 -3.22 115.31 115.12 1vb6 h LEU 26 Ca 0.30 -0.94 0.02 0.00 0.09 0.00 0.00 57.88 57.35 1vb6 h LEU 26 Cb 0.19 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1vb6 h LEU 26 CO -0.10 1.84 0.30 -0.08 0.09 0.00 0.00 178.44 180.50 1vb6 h GLU 27 N 0.07 0.59 -0.58 1.13 4.57 -0.38 -2.37 114.58 117.62 1vb6 h GLU 27 Ca -0.42 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 1vb6 h GLU 27 Cb 2.04 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 30.50 1vb6 h GLU 27 CO 0.10 0.39 0.00 1.04 -1.18 0.00 0.00 179.01 179.36 1vb6 n GLN 28 N -4.79 2.66 -2.16 1.92 6.02 0.16 -4.32 117.38 116.86 1vb6 n GLN 28 Ca 0.03 -1.85 -0.36 0.00 -0.01 0.00 0.00 57.00 54.81 1vb6 n GLN 28 Cb 0.06 -1.62 0.01 0.00 1.02 0.00 0.00 30.24 29.71 1vb6 n GLN 28 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1vb6 s ASN 29 N -0.81 5.69 0.42 1.08 3.84 -0.89 -4.91 114.94 119.36 1vb6 s ASN 29 Ca 0.33 2.32 0.22 0.00 0.21 0.00 0.00 52.86 55.95 1vb6 s ASN 29 Cb 0.21 -2.60 0.82 0.00 -0.55 0.00 0.00 41.25 39.13 1vb6 s ASN 29 CO 0.17 -1.25 1.79 0.00 -2.79 0.00 0.00 177.10 175.02 1vb6 h MET 30 N 1.41 0.00 -6.49 0.43 -0.00 -1.90 -3.42 114.93 104.96 1vb6 h MET 30 Ca -0.50 0.00 -0.53 0.00 -0.00 0.00 0.00 59.70 58.67 1vb6 h MET 30 Cb 1.27 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 32.84 1vb6 h MET 30 CO 0.57 0.27 0.08 -1.64 -0.00 0.00 0.00 176.91 176.19 1vb6 s MET 31 N -3.60 4.28 0.40 -0.10 -1.94 -1.26 -4.88 119.30 112.18 1vb6 s MET 31 Ca 0.01 0.87 -0.26 0.00 -1.71 0.00 0.00 55.69 54.60 1vb6 s MET 31 Cb 0.10 -3.00 -0.09 0.00 2.01 0.00 0.00 34.83 33.85 1vb6 s MET 31 CO 0.65 0.47 1.24 0.20 -0.01 0.00 0.00 175.02 177.58 1vb6 s GLY 32 N -1.49 2.91 -0.08 -0.03 0.00 0.47 -4.70 107.32 104.40 1vb6 s GLY 32 Ca 0.39 1.12 0.00 0.00 0.00 0.00 0.00 44.72 46.24 1vb6 s GLY 32 CO 0.21 1.68 -0.07 0.00 0.00 0.00 0.00 173.10 174.93 1vb6 s ALA 33 N -1.31 1.08 -0.12 3.20 0.00 -1.26 -0.10 121.76 123.25 1vb6 s ALA 33 Ca 0.56 -0.35 -0.00 0.00 0.00 0.00 0.00 51.96 52.17 1vb6 s ALA 33 Cb -0.35 -0.70 0.02 0.00 0.00 0.00 0.00 23.12 22.09 1vb6 s ALA 33 CO 0.45 -0.21 -0.10 0.08 0.00 0.00 0.00 175.76 175.98 1vb6 s VAL 34 N 1.33 1.24 -0.12 0.00 1.01 -0.51 -2.46 120.40 120.89 1vb6 s VAL 34 Ca -0.03 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.53 1vb6 s VAL 34 Cb -0.14 -1.21 -0.01 0.00 0.00 0.00 0.00 36.38 35.02 1vb6 s VAL 34 CO -0.03 0.40 -0.14 -0.22 0.00 0.00 0.00 175.10 175.11 1vb6 s LEU 35 N 1.58 2.66 0.07 3.92 2.96 -0.53 -0.88 118.68 128.45 1vb6 s LEU 35 Ca 0.04 -0.34 0.09 0.00 -0.22 0.00 0.00 54.13 53.70 1vb6 s LEU 35 Cb -0.13 -1.59 -0.03 0.00 0.50 0.00 0.00 46.19 44.94 1vb6 s LEU 35 CO -0.09 0.18 -0.23 0.27 -1.32 0.00 0.00 176.35 175.16 1vb6 s ILE 36 N 0.27 2.45 0.13 6.68 -4.36 -0.46 -0.44 121.20 125.48 1vb6 s ILE 36 Ca -0.10 -1.40 -0.01 0.00 -0.26 0.00 0.00 60.65 58.87 1vb6 s ILE 36 Cb -0.16 -2.03 0.03 0.00 1.25 0.00 0.00 42.46 41.55 1vb6 s ILE 36 CO 0.06 0.28 0.18 -0.46 0.24 0.00 0.00 174.94 175.23 1vb6 n ASN 37 N 1.44 0.10 0.22 4.36 0.23 -0.31 -2.46 115.26 118.85 1vb6 n ASN 37 Ca -0.17 -1.12 0.15 0.00 -0.53 0.00 0.00 54.58 52.92 1vb6 n ASN 37 Cb 0.52 -0.13 0.81 0.00 -2.08 0.00 0.00 39.78 38.91 1vb6 n ASN 37 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1vb6 h GLU 38 N 0.00 0.00 -0.63 -3.83 9.09 -1.90 -1.06 114.58 116.25 1vb6 h GLU 38 Ca -0.06 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.35 1vb6 h GLU 38 Cb 0.18 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.28 1vb6 h GLU 38 CO 0.05 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.20 1vb6 n ASN 39 N -3.98 5.24 -2.03 3.06 5.03 -1.26 -4.93 115.26 116.39 1vb6 n ASN 39 Ca 0.00 -2.66 -0.20 0.00 0.87 0.00 0.00 54.58 52.60 1vb6 n ASN 39 Cb 0.24 -0.63 -0.03 0.00 -1.02 0.00 0.00 39.78 38.34 1vb6 n ASN 39 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1vb6 n ASP 40 N 0.94 -5.56 -4.86 6.41 8.00 -0.40 -4.94 116.55 116.14 1vb6 n ASP 40 Ca 0.27 0.13 -0.37 0.00 0.71 0.00 0.00 54.79 55.53 1vb6 n ASP 40 Cb 1.03 -4.65 -0.06 0.00 -0.02 0.00 0.00 41.12 37.42 1vb6 n ASP 40 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1vb6 s GLU 41 N -4.60 3.75 -0.15 -1.24 2.02 -1.26 -1.20 118.70 116.03 1vb6 s GLU 41 Ca 0.00 0.20 -0.29 0.00 0.02 0.00 0.00 54.97 54.89 1vb6 s GLU 41 Cb 0.00 -3.14 -0.02 0.00 0.10 0.00 0.00 34.13 31.07 1vb6 s GLU 41 CO 0.00 0.67 1.25 0.08 0.02 0.00 0.00 175.26 177.27 1vb6 s VAL 42 N -1.18 4.28 -0.49 2.63 1.01 0.07 -1.16 120.40 125.56 1vb6 s VAL 42 Ca 0.25 1.56 0.11 0.00 0.00 0.00 0.00 61.98 63.90 1vb6 s VAL 42 Cb -0.15 -4.01 -0.12 0.00 0.00 0.00 0.00 36.38 32.11 1vb6 s VAL 42 CO 0.13 -0.11 0.45 1.15 0.00 0.00 0.00 175.10 176.72 1vb6 n MET 43 N 6.33 3.34 -3.71 2.72 0.00 0.42 -0.39 117.12 125.83 1vb6 n MET 43 Ca 0.13 -0.00 -0.11 0.00 0.00 0.00 0.00 57.70 57.71 1vb6 n MET 43 Cb 0.45 -1.02 -0.11 0.00 0.00 0.00 0.00 33.22 32.55 1vb6 n MET 43 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 175.97 176.09 1vb6 s PHE 44 N -2.04 -0.54 -0.29 3.17 5.36 -1.17 -4.95 117.98 117.53 1vb6 s PHE 44 Ca 0.04 1.20 0.02 0.00 -0.96 0.00 0.00 56.93 57.23 1vb6 s PHE 44 Cb 0.08 0.22 0.16 0.00 -0.34 0.00 0.00 43.02 43.14 1vb6 s PHE 44 CO 0.44 -0.29 0.40 0.12 -1.46 0.00 0.00 175.22 174.43 1vb6 s PHE 45 N 0.94 -0.95 0.85 10.12 5.36 -1.25 -1.45 117.98 131.60 1vb6 s PHE 45 Ca -0.06 0.29 -0.12 0.00 -0.96 0.00 0.00 56.93 56.08 1vb6 s PHE 45 Cb -0.06 -0.18 0.11 0.00 -0.34 0.00 0.00 43.02 42.54 1vb6 s PHE 45 CO -0.08 -0.97 1.17 0.54 -1.46 0.00 0.00 175.22 174.42 1vb6 s ASN 46 N 2.53 4.07 0.36 6.13 4.22 -1.03 -4.73 114.94 126.49 1vb6 s ASN 46 Ca 0.10 0.83 0.08 0.00 -2.14 0.00 0.00 52.86 51.73 1vb6 s ASN 46 Cb -0.13 -1.34 0.79 0.00 1.28 0.00 0.00 41.25 41.85 1vb6 s ASN 46 CO -0.30 -2.18 1.90 -0.65 -2.04 0.00 0.00 177.10 173.83 1vb6 h PRO 47 N -1.25 0.70 -0.44 3.55 0.11 -1.93 -0.61 132.00 132.14 1vb6 h PRO 47 Ca -0.48 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.55 1vb6 h PRO 47 Cb 1.33 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1vb6 h PRO 47 CO 0.64 0.46 0.11 0.00 -0.21 0.00 0.00 178.00 179.00 1vb6 h ALA 48 N 1.60 1.38 -0.26 -0.75 0.00 -1.84 -1.52 119.26 117.87 1vb6 h ALA 48 Ca 0.40 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.99 1vb6 h ALA 48 Cb 0.55 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1vb6 h ALA 48 CO -0.16 0.45 -0.47 0.00 0.00 0.00 0.00 179.25 179.06 1vb6 h ALA 49 N 1.49 0.68 -0.73 0.00 0.00 -1.43 -2.12 119.26 117.15 1vb6 h ALA 49 Ca 0.15 -0.48 0.03 0.00 0.00 0.00 0.00 54.91 54.61 1vb6 h ALA 49 Cb 0.23 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 1vb6 h ALA 49 CO -0.00 0.67 0.46 0.93 0.00 0.00 0.00 179.25 181.31 1vb6 h GLU 50 N 0.55 0.87 -0.55 0.00 5.08 -0.41 -1.01 114.58 119.11 1vb6 h GLU 50 Ca 0.03 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.26 1vb6 h GLU 50 Cb 1.03 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 1vb6 h GLU 50 CO 0.10 0.58 0.06 -0.22 -1.00 0.00 0.00 179.01 178.52 1vb6 h LYS 51 N 0.90 0.93 -0.09 2.33 3.11 -1.15 0.14 116.57 122.75 1vb6 h LYS 51 Ca 0.29 -0.27 -0.01 0.00 -2.81 0.00 0.00 60.65 57.85 1vb6 h LYS 51 Cb 0.02 -0.10 -0.00 0.00 -1.00 0.00 0.00 32.23 31.15 1vb6 h LYS 51 CO -0.11 0.91 0.01 -0.07 -2.81 0.00 0.00 179.45 177.39 1vb6 h LEU 52 N 0.82 0.14 0.00 5.20 3.38 -0.91 -3.33 115.31 120.60 1vb6 h LEU 52 Ca 0.16 -0.27 -0.20 0.00 0.09 0.00 0.00 57.88 57.66 1vb6 h LEU 52 Cb 0.46 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1vb6 h LEU 52 CO 0.02 0.37 -1.21 -0.50 0.09 0.00 0.00 178.44 177.21 1vb6 h TRP 53 N -0.10 0.00 0.00 1.13 6.55 -1.22 -3.44 115.95 118.86 1vb6 h TRP 53 Ca 0.03 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.87 1vb6 h TRP 53 Cb 0.29 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.59 1vb6 h TRP 53 CO 0.02 0.81 0.00 0.41 -1.05 0.00 0.00 178.44 178.63 1vb6 n GLY 54 N 1.40 0.59 3.49 1.49 0.00 0.49 -0.56 105.19 112.09 1vb6 n GLY 54 Ca -0.07 -0.63 -0.31 0.00 0.00 0.00 0.00 46.02 45.02 1vb6 n GLY 54 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vb6 s TYR 55 N -2.00 2.61 0.24 1.61 2.02 -1.19 -4.65 117.35 115.98 1vb6 s TYR 55 Ca 0.00 -0.23 -0.13 0.00 -0.37 0.00 0.00 57.07 56.35 1vb6 s TYR 55 Cb 0.00 -1.46 -0.08 0.00 -0.40 0.00 0.00 41.96 40.02 1vb6 s TYR 55 CO 0.00 0.30 0.61 0.15 -1.57 0.00 0.00 175.55 175.04 1vb6 s LYS 56 N -1.59 3.92 0.55 -0.62 1.02 -1.26 -4.30 119.74 117.46 1vb6 s LYS 56 Ca 0.16 0.46 0.26 0.00 0.02 0.00 0.00 55.97 56.87 1vb6 s LYS 56 Cb -0.11 -2.66 1.46 0.00 -0.52 0.00 0.00 37.83 36.00 1vb6 s LYS 56 CO 0.07 0.31 2.02 0.07 -0.92 0.00 0.00 175.35 176.90 1vb6 h ARG 57 N 2.73 0.00 0.00 1.68 0.11 -1.93 0.16 114.38 117.14 1vb6 h ARG 57 Ca -0.48 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.60 1vb6 h ARG 57 Cb 1.18 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.26 1vb6 h ARG 57 CO 0.67 0.00 -0.04 0.93 0.10 0.00 0.00 179.97 181.63 1vb6 h GLU 58 N 0.00 0.00 -0.00 0.08 3.07 -1.94 0.60 114.58 116.39 1vb6 h GLU 58 Ca 0.19 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.05 1vb6 h GLU 58 Cb 0.85 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 1vb6 h GLU 58 CO -0.00 0.04 -0.40 0.39 -1.40 0.00 0.00 179.01 177.64 1vb6 n GLU 59 N -3.90 0.42 -0.03 2.33 1.02 0.57 -4.55 120.64 116.50 1vb6 n GLU 59 Ca -0.03 -0.25 -0.05 0.00 -0.02 0.00 0.00 57.16 56.81 1vb6 n GLU 59 Cb 0.13 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.03 1vb6 n GLU 59 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1vb6 n VAL 60 N -1.07 0.29 -1.64 2.62 0.31 -0.41 -4.90 118.33 113.54 1vb6 n VAL 60 Ca 0.09 -0.09 -0.49 0.00 -0.01 0.00 0.00 64.34 63.83 1vb6 n VAL 60 Cb 0.34 -1.22 -0.05 0.00 -0.91 0.00 0.00 33.84 32.01 1vb6 n VAL 60 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1vb6 n ILE 61 N -3.00 0.06 0.00 2.52 2.08 0.07 -0.91 119.36 120.18 1vb6 n ILE 61 Ca -0.10 -0.01 0.00 0.00 0.56 0.00 0.00 62.75 63.20 1vb6 n ILE 61 Cb 0.58 -1.23 0.00 0.00 -0.75 0.00 0.00 39.64 38.24 1vb6 n ILE 61 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1vb6 n GLY 62 N 3.15 2.09 3.99 7.39 0.00 0.48 -4.99 105.19 117.29 1vb6 n GLY 62 Ca 0.19 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.01 1vb6 n GLY 62 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vb6 s ASN 63 N -2.70 5.35 0.41 1.61 0.01 -0.09 -4.74 114.94 114.80 1vb6 s ASN 63 Ca 0.00 -0.16 -0.24 0.00 -0.71 0.00 0.00 52.86 51.75 1vb6 s ASN 63 Cb 0.00 -0.76 -0.09 0.00 0.41 0.00 0.00 41.25 40.81 1vb6 s ASN 63 CO 0.00 -1.06 1.07 0.20 -1.51 0.00 0.00 177.10 175.81 1vb6 s ASN 64 N -4.42 6.65 0.56 -1.22 0.02 -1.26 -0.76 114.94 114.52 1vb6 s ASN 64 Ca 0.57 2.09 0.27 0.00 -1.02 0.00 0.00 52.86 54.77 1vb6 s ASN 64 Cb -0.10 -2.59 1.51 0.00 0.02 0.00 0.00 41.25 40.09 1vb6 s ASN 64 CO 0.37 -0.57 2.03 -0.29 0.02 0.00 0.00 177.10 178.66 1vb6 h ILE 65 N 2.14 0.57 -1.05 0.60 6.09 -1.50 -2.26 117.51 122.10 1vb6 h ILE 65 Ca -0.48 0.00 0.27 0.00 -1.37 0.00 0.00 64.86 63.28 1vb6 h ILE 65 Cb 1.22 0.77 -0.10 0.00 0.47 0.00 0.00 36.82 39.18 1vb6 h ILE 65 CO 0.62 0.00 0.67 0.44 -3.07 0.00 0.00 178.15 176.80 1vb6 h ASP 66 N 0.00 0.47 0.59 2.19 3.32 -1.91 0.83 116.42 121.91 1vb6 h ASP 66 Ca 0.17 0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.31 1vb6 h ASP 66 Cb 0.79 0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.36 1vb6 h ASP 66 CO -0.00 0.07 0.00 0.00 -1.72 0.00 0.00 179.24 177.59 1vb6 h MET 67 N 0.41 0.00 -0.01 3.56 -0.00 -1.80 -2.48 114.93 114.61 1vb6 h MET 67 Ca 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.32 1vb6 h MET 67 Cb 1.52 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 33.12 1vb6 h MET 67 CO -0.34 0.00 -0.59 1.28 -0.00 0.00 0.00 176.91 177.26 1vb6 n LEU 68 N -2.86 1.20 -4.76 -0.10 4.77 0.28 -4.92 117.00 110.61 1vb6 n LEU 68 Ca -0.00 -0.42 -0.39 0.00 -0.03 0.00 0.00 56.01 55.16 1vb6 n LEU 68 Cb 0.20 -0.08 -0.05 0.00 -2.33 0.00 0.00 43.42 41.16 1vb6 n LEU 68 CO 0.22 0.25 0.37 -0.63 -1.33 0.00 0.00 177.39 176.27 1vb6 s ILE 69 N -2.75 4.78 0.35 -0.08 -1.09 -0.94 -4.79 121.20 116.69 1vb6 s ILE 69 Ca 0.15 1.41 -0.27 0.00 -2.23 0.00 0.00 60.65 59.72 1vb6 s ILE 69 Cb 0.18 -4.01 -0.12 0.00 -1.58 0.00 0.00 42.46 36.93 1vb6 s ILE 69 CO 0.68 0.43 1.08 -2.65 -1.23 0.00 0.00 174.94 173.24 1vb6 n PRO 70 N 2.53 1.55 -0.31 2.79 -0.02 -1.26 -4.69 135.00 135.58 1vb6 n PRO 70 Ca -0.06 0.55 0.10 0.00 -2.02 0.00 0.00 63.50 62.07 1vb6 n PRO 70 Cb 0.50 -2.05 0.27 0.00 -0.02 0.00 0.00 33.50 32.21 1vb6 n PRO 70 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vb6 h ARG 71 N 1.95 0.57 0.00 -0.52 3.08 -1.95 0.61 114.38 118.13 1vb6 h ARG 71 Ca -0.43 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.58 1vb6 h ARG 71 Cb 1.32 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.25 1vb6 h ARG 71 CO 0.60 0.38 0.00 -0.40 -1.07 0.00 0.00 179.97 179.48 1vb6 n ASP 72 N -4.90 0.00 -0.13 7.04 3.85 -1.26 -2.54 116.55 118.62 1vb6 n ASP 72 Ca 0.20 -0.12 0.04 0.00 -0.71 0.00 0.00 54.79 54.20 1vb6 n ASP 72 Cb 0.53 -0.24 -0.02 0.00 -1.35 0.00 0.00 41.12 40.05 1vb6 n ASP 72 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1vb6 n LEU 73 N -1.24 0.86 0.03 -2.12 4.77 0.13 -4.58 117.00 114.86 1vb6 n LEU 73 Ca 0.11 -0.67 0.09 0.00 -0.03 0.00 0.00 56.01 55.52 1vb6 n LEU 73 Cb 0.15 0.00 0.53 0.00 -2.33 0.00 0.00 43.42 41.77 1vb6 n LEU 73 CO 0.16 0.18 1.15 0.03 -1.33 0.00 0.00 177.39 177.58 1vb6 h ARG 74 N 0.63 0.31 0.00 3.23 3.08 -1.07 -0.29 114.38 120.27 1vb6 h ARG 74 Ca 0.00 -0.02 -0.09 0.00 0.07 0.00 0.00 59.98 59.94 1vb6 h ARG 74 Cb 0.26 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1vb6 h ARG 74 CO 0.00 0.21 -0.42 -1.35 -1.07 0.00 0.00 179.97 177.34 1vb6 h PRO 75 N 0.32 0.00 0.00 0.04 0.11 -1.81 -3.34 132.00 127.32 1vb6 h PRO 75 Ca 0.17 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.06 1vb6 h PRO 75 Cb 0.28 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.35 1vb6 h PRO 75 CO -0.04 0.42 -2.14 0.00 -0.21 0.00 0.00 178.00 176.03 1vb6 n ALA 76 N -2.46 1.95 -0.35 -0.75 0.00 -0.72 -4.63 120.51 113.56 1vb6 n ALA 76 Ca -0.02 -0.96 -0.03 0.00 0.00 0.00 0.00 53.44 52.43 1vb6 n ALA 76 Cb 0.45 -0.32 0.10 0.00 0.00 0.00 0.00 19.45 19.67 1vb6 n ALA 76 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1vb6 h HIS 77 N 0.00 1.20 -0.73 0.00 6.17 -1.20 -3.02 115.15 117.57 1vb6 h HIS 77 Ca -0.33 0.02 0.13 0.00 0.71 0.00 0.00 60.37 60.89 1vb6 h HIS 77 Cb 1.72 -0.40 -0.09 0.00 2.52 0.00 0.00 27.41 31.16 1vb6 h HIS 77 CO 0.00 0.77 0.30 -1.35 0.71 0.00 0.00 177.93 178.36 1vb6 h PRO 78 N 1.28 0.45 0.00 5.26 0.11 -1.82 -0.43 132.00 136.85 1vb6 h PRO 78 Ca 0.34 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.35 1vb6 h PRO 78 Cb -0.11 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 30.88 1vb6 h PRO 78 CO -0.07 0.30 -0.37 0.93 -0.21 0.00 0.00 178.00 178.58 1vb6 h GLU 79 N 0.47 0.00 -0.26 1.05 4.39 -1.83 -1.41 114.58 116.99 1vb6 h GLU 79 Ca 0.39 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.09 1vb6 h GLU 79 Cb 0.55 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.19 1vb6 h GLU 79 CO -0.37 0.37 0.15 1.88 -1.16 0.00 0.00 179.01 179.88 1vb6 h TYR 80 N 0.00 0.34 0.17 4.33 0.99 -1.03 -1.06 116.97 120.72 1vb6 h TYR 80 Ca -0.00 -0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.71 1vb6 h TYR 80 Cb 0.75 -0.11 0.00 0.00 1.00 0.00 0.00 36.73 38.37 1vb6 h TYR 80 CO 0.00 0.27 -0.08 0.82 -0.00 0.00 0.00 178.16 179.17 1vb6 h ILE 81 N 0.32 0.94 -0.40 -2.88 2.04 -1.24 -2.87 117.51 113.42 1vb6 h ILE 81 Ca 0.09 -0.77 0.08 0.00 1.00 0.00 0.00 64.86 65.26 1vb6 h ILE 81 Cb 0.03 1.40 -0.09 0.00 -0.74 0.00 0.00 36.82 37.42 1vb6 h ILE 81 CO -0.02 0.17 -0.20 -0.09 0.00 0.00 0.00 178.15 178.02 1vb6 h ARG 82 N -0.63 -0.12 -0.35 2.37 2.43 -1.21 0.37 114.38 117.24 1vb6 h ARG 82 Ca -0.02 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1vb6 h ARG 82 Cb 0.46 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.02 1vb6 h ARG 82 CO 0.04 -0.08 0.18 0.45 -1.51 0.00 0.00 179.97 179.05 1vb6 h HIS 83 N -0.13 0.47 -0.17 2.20 3.86 -1.26 -1.59 115.15 118.54 1vb6 h HIS 83 Ca 0.19 -0.00 -0.20 0.00 -1.16 0.00 0.00 60.37 59.20 1vb6 h HIS 83 Cb 0.42 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.74 1vb6 h HIS 83 CO -0.43 0.35 -0.71 -0.97 0.86 0.00 0.00 177.93 177.03 1vb6 h ASN 84 N 0.49 0.83 -0.04 2.45 -0.73 -0.89 -3.29 115.58 114.41 1vb6 h ASN 84 Ca 0.13 -0.52 -0.00 0.00 1.87 0.00 0.00 56.30 57.78 1vb6 h ASN 84 Cb 0.04 -0.24 -0.00 0.00 0.27 0.00 0.00 38.32 38.39 1vb6 h ASN 84 CO -0.02 1.30 0.02 0.03 -0.37 0.00 0.00 177.43 178.39 1vb6 h ARG 85 N 0.51 0.06 -5.19 6.67 3.08 -0.44 -3.32 114.38 115.75 1vb6 h ARG 85 Ca -0.03 -0.01 -0.66 0.00 0.07 0.00 0.00 59.98 59.35 1vb6 h ARG 85 Cb 1.31 -0.01 -0.16 0.00 0.08 0.00 0.00 29.97 31.20 1vb6 h ARG 85 CO 0.14 0.18 -0.05 -1.83 -1.07 0.00 0.00 179.97 177.34 1vb6 s GLU 86 N -5.64 3.43 0.00 0.04 -1.05 -0.65 -3.75 118.70 111.08 1vb6 s GLU 86 Ca -0.14 -0.34 0.00 0.00 -0.15 0.00 0.00 54.97 54.34 1vb6 s GLU 86 Cb 0.05 -3.87 0.00 0.00 -0.44 0.00 0.00 34.13 29.87 1vb6 s GLU 86 CO 0.67 -0.77 0.00 0.41 0.95 0.00 0.00 175.26 176.52 1vb6 n GLY 87 N 4.92 1.09 2.18 -3.83 0.00 -1.26 -4.76 105.19 103.54 1vb6 n GLY 87 Ca -0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.85 1vb6 n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vb6 n GLY 88 N -0.36 1.04 0.00 -0.02 0.00 -1.25 -5.09 105.19 99.51 1vb6 n GLY 88 Ca 0.00 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 43.97 1vb6 n GLY 88 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1vb6 n GLU 93 N -1.95 0.00 -3.61 1.61 -0.00 -1.26 -5.15 120.64 110.28 1vb6 n GLU 93 Ca 0.09 0.00 -0.08 0.00 -0.00 0.00 0.00 57.16 57.17 1vb6 n GLU 93 Cb 0.33 0.00 -0.06 0.00 -0.00 0.00 0.00 31.44 31.72 1vb6 n GLU 93 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 1vb6 s GLY 94 N 0.00 -0.10 -0.13 -1.84 0.00 -1.26 -2.42 107.32 101.57 1vb6 s GLY 94 Ca 0.00 2.51 -0.30 0.00 0.00 0.00 0.00 44.72 46.93 1vb6 s GLY 94 CO 0.00 1.37 0.82 -3.16 0.00 0.00 0.00 173.10 172.13 1vb6 s MET 95 N -0.60 0.84 -0.09 2.90 0.23 -1.09 -5.03 119.30 116.45 1vb6 s MET 95 Ca 0.02 0.31 0.03 0.00 -1.03 0.00 0.00 55.69 55.03 1vb6 s MET 95 Cb -0.02 0.40 0.01 0.00 -1.53 0.00 0.00 34.83 33.68 1vb6 s MET 95 CO -0.04 -0.24 -0.19 0.45 -2.03 0.00 0.00 175.02 172.97 1vb6 s SER 96 N -0.91 2.63 0.24 -1.18 0.15 -1.26 -1.79 113.70 111.57 1vb6 s SER 96 Ca -0.06 -0.47 -0.22 0.00 0.70 0.00 0.00 55.95 55.90 1vb6 s SER 96 Cb -0.01 -1.20 0.04 0.00 -1.71 0.00 0.00 66.02 63.13 1vb6 s SER 96 CO 0.05 0.10 0.69 0.00 1.20 0.00 0.00 173.24 175.28 1vb6 s ARG 97 N 0.54 1.61 0.06 5.44 3.03 -0.88 -4.98 118.95 123.76 1vb6 s ARG 97 Ca -0.16 -0.81 -0.24 0.00 2.03 0.00 0.00 55.73 56.55 1vb6 s ARG 97 Cb -0.17 0.60 -0.06 0.00 -1.03 0.00 0.00 34.95 34.29 1vb6 s ARG 97 CO 0.06 -0.73 0.73 -1.21 -1.13 0.00 0.00 175.30 173.02 1vb6 s GLU 98 N -3.84 4.47 0.07 3.89 2.02 -1.26 -0.88 118.70 123.16 1vb6 s GLU 98 Ca 0.08 1.02 0.05 0.00 0.02 0.00 0.00 54.97 56.13 1vb6 s GLU 98 Cb -0.04 -3.33 -0.03 0.00 0.10 0.00 0.00 34.13 30.82 1vb6 s GLU 98 CO 0.00 0.37 -0.13 -0.51 0.02 0.00 0.00 175.26 175.01 1vb6 s LEU 99 N -0.34 2.28 -0.34 1.80 1.43 0.07 -4.94 118.68 118.65 1vb6 s LEU 99 Ca 0.36 -0.62 -0.19 0.00 -1.03 0.00 0.00 54.13 52.65 1vb6 s LEU 99 Cb -0.21 -0.46 -0.00 0.00 0.03 0.00 0.00 46.19 45.55 1vb6 s LEU 99 CO 0.23 -0.10 0.57 -1.58 0.23 0.00 0.00 176.35 175.69 1vb6 s GLN 100 N -1.79 3.68 -0.05 1.70 0.74 -1.26 -1.16 119.66 121.51 1vb6 s GLN 100 Ca -0.02 -0.03 -0.15 0.00 0.05 0.00 0.00 55.36 55.21 1vb6 s GLN 100 Cb -0.10 -3.80 -0.05 0.00 1.10 0.00 0.00 33.01 30.17 1vb6 s GLN 100 CO 0.02 -0.66 0.38 -1.17 -0.55 0.00 0.00 175.29 173.31 1vb6 s LEU 101 N 2.52 4.40 -0.23 3.68 0.20 0.09 -4.83 118.68 124.51 1vb6 s LEU 101 Ca 0.21 0.83 -0.07 0.00 0.69 0.00 0.00 54.13 55.80 1vb6 s LEU 101 Cb -0.15 -2.53 -0.03 0.00 -0.43 0.00 0.00 46.19 43.05 1vb6 s LEU 101 CO 0.14 0.24 0.05 -0.70 -0.29 0.00 0.00 176.35 175.79 1vb6 s GLU 102 N -0.55 3.68 0.84 1.98 2.12 -1.26 -1.24 118.70 124.27 1vb6 s GLU 102 Ca 0.22 -0.47 -0.13 0.00 0.36 0.00 0.00 54.97 54.95 1vb6 s GLU 102 Cb -0.15 -3.24 0.10 0.00 0.26 0.00 0.00 34.13 31.09 1vb6 s GLU 102 CO 0.11 -0.08 1.19 0.15 -0.54 0.00 0.00 175.26 176.09 1vb6 s LYS 103 N 1.31 1.68 0.28 4.30 1.02 0.21 -4.82 119.74 123.72 1vb6 s LYS 103 Ca 0.05 0.07 0.00 0.00 0.02 0.00 0.00 55.97 56.10 1vb6 s LYS 103 Cb -0.15 -1.92 0.51 0.00 -0.52 0.00 0.00 37.83 35.75 1vb6 s LYS 103 CO 0.03 -1.78 1.84 -0.22 -0.92 0.00 0.00 175.35 174.30 1vb6 h LYS 104 N -1.19 1.00 -0.01 1.68 3.64 -1.09 -0.97 116.57 119.63 1vb6 h LYS 104 Ca -0.46 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 1vb6 h LYS 104 Cb 1.32 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 1vb6 h LYS 104 CO 0.62 0.66 0.00 -0.40 -2.27 0.00 0.00 179.45 178.06 1vb6 n ASP 105 N -4.60 0.13 0.00 4.20 3.85 -1.26 -4.90 116.55 113.97 1vb6 n ASP 105 Ca 0.18 -1.25 0.00 0.00 -0.71 0.00 0.00 54.79 53.01 1vb6 n ASP 105 Cb 0.31 -0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.08 1vb6 n ASP 105 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1vb6 n GLY 106 N 0.91 2.42 3.77 6.12 0.00 -0.37 -5.05 105.19 113.00 1vb6 n GLY 106 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 1vb6 n GLY 106 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1vb6 s SER 107 N -1.48 5.28 0.04 1.61 1.04 -1.26 -4.67 113.70 114.26 1vb6 s SER 107 Ca 0.00 2.05 0.08 0.00 0.48 0.00 0.00 55.95 58.56 1vb6 s SER 107 Cb 0.00 -2.56 -0.03 0.00 0.10 0.00 0.00 66.02 63.53 1vb6 s SER 107 CO 0.00 -1.51 -0.22 -0.54 0.98 0.00 0.00 173.24 171.94 1vb6 s LYS 108 N -3.87 1.52 0.02 4.02 1.02 -1.26 -0.62 119.74 120.58 1vb6 s LYS 108 Ca 0.69 -0.99 0.01 0.00 0.02 0.00 0.00 55.97 55.70 1vb6 s LYS 108 Cb -0.21 -1.65 -0.02 0.00 -0.52 0.00 0.00 37.83 35.43 1vb6 s LYS 108 CO 0.37 0.42 -0.05 0.96 -0.92 0.00 0.00 175.35 176.14 1vb6 s ILE 109 N -0.79 0.30 0.11 2.17 -4.36 -0.38 -4.98 121.20 113.27 1vb6 s ILE 109 Ca 0.09 -0.82 -0.23 0.00 -0.26 0.00 0.00 60.65 59.42 1vb6 s ILE 109 Cb -0.09 -0.38 -0.07 0.00 1.25 0.00 0.00 42.46 43.17 1vb6 s ILE 109 CO 0.02 -0.35 0.70 0.26 0.24 0.00 0.00 174.94 175.81 1vb6 s TRP 110 N -1.16 3.84 0.28 1.37 0.52 -1.26 -0.73 118.94 121.80 1vb6 s TRP 110 Ca -0.10 1.47 0.02 0.00 0.02 0.00 0.00 56.10 57.51 1vb6 s TRP 110 Cb -0.08 -2.68 -0.03 0.00 -1.15 0.00 0.00 33.47 29.53 1vb6 s TRP 110 CO -0.00 0.50 0.25 0.95 0.02 0.00 0.00 176.95 178.67 1vb6 s THR 111 N -0.95 0.00 -0.08 2.01 -4.23 -0.31 -0.59 115.64 111.48 1vb6 s THR 111 Ca 0.34 -1.94 0.04 0.00 -1.18 0.00 0.00 61.69 58.95 1vb6 s THR 111 Cb -0.21 -2.50 -0.00 0.00 1.34 0.00 0.00 72.50 71.12 1vb6 s THR 111 CO 0.23 0.00 -0.22 -0.60 -0.54 0.00 0.00 174.62 173.49 1vb6 s ARG 112 N -3.71 2.68 -0.10 3.99 3.52 0.38 -0.75 118.95 124.96 1vb6 s ARG 112 Ca 0.38 -0.81 0.00 0.00 -0.13 0.00 0.00 55.73 55.18 1vb6 s ARG 112 Cb 0.04 -2.10 -0.02 0.00 -1.56 0.00 0.00 34.95 31.30 1vb6 s ARG 112 CO 0.20 0.21 -0.10 -0.06 -0.81 0.00 0.00 175.30 174.73 1vb6 s PHE 113 N 0.25 2.85 -0.35 5.12 0.40 -0.06 -1.42 117.98 124.77 1vb6 s PHE 113 Ca -0.14 -0.34 0.01 0.00 -0.60 0.00 0.00 56.93 55.86 1vb6 s PHE 113 Cb -0.16 -1.79 0.09 0.00 0.51 0.00 0.00 43.02 41.67 1vb6 s PHE 113 CO 0.07 0.02 0.08 0.00 0.70 0.00 0.00 175.22 176.09 1vb6 s ALA 114 N -0.13 2.94 -0.12 5.36 0.00 0.25 -2.08 121.76 127.99 1vb6 s ALA 114 Ca -0.00 -2.36 -0.13 0.00 0.00 0.00 0.00 51.96 49.47 1vb6 s ALA 114 Cb -0.13 -2.08 -0.05 0.00 0.00 0.00 0.00 23.12 20.86 1vb6 s ALA 114 CO 0.03 -1.62 0.30 -1.17 0.00 0.00 0.00 175.76 173.30 1vb6 s LEU 115 N 1.05 4.31 -0.04 0.00 2.96 -0.74 -1.02 118.68 125.20 1vb6 s LEU 115 Ca 0.06 0.61 0.02 0.00 -0.22 0.00 0.00 54.13 54.60 1vb6 s LEU 115 Cb -0.20 -2.39 0.01 0.00 0.50 0.00 0.00 46.19 44.10 1vb6 s LEU 115 CO -0.05 0.18 -0.11 -0.44 -1.32 0.00 0.00 176.35 174.61 1vb6 s SER 116 N -0.04 1.49 -0.10 3.68 0.01 -0.14 -2.68 113.70 115.92 1vb6 s SER 116 Ca 0.18 -0.24 -0.23 0.00 1.31 0.00 0.00 55.95 56.97 1vb6 s SER 116 Cb -0.14 -0.54 -0.03 0.00 0.21 0.00 0.00 66.02 65.52 1vb6 s SER 116 CO 0.06 0.05 0.69 -0.75 0.41 0.00 0.00 173.24 173.71 1vb6 s LYS 117 N 0.41 4.38 -0.20 12.44 2.20 -1.02 -1.01 119.74 136.95 1vb6 s LYS 117 Ca -0.08 0.83 0.01 0.00 -0.36 0.00 0.00 55.97 56.38 1vb6 s LYS 117 Cb -0.12 -3.48 0.04 0.00 -1.51 0.00 0.00 37.83 32.75 1vb6 s LYS 117 CO 0.02 -0.03 -0.15 0.08 -0.36 0.00 0.00 175.35 174.91 1vb6 s VAL 118 N 1.13 1.91 -0.26 4.02 1.01 0.70 -4.83 120.40 124.09 1vb6 s VAL 118 Ca 0.36 -1.07 -0.10 0.00 0.00 0.00 0.00 61.98 61.16 1vb6 s VAL 118 Cb -0.17 -1.87 -0.05 0.00 0.00 0.00 0.00 36.38 34.30 1vb6 s VAL 118 CO 0.16 0.31 0.15 -0.44 0.00 0.00 0.00 175.10 175.28 1vb6 s SER 119 N 1.30 5.89 -0.14 3.32 0.01 -1.26 0.09 113.70 122.90 1vb6 s SER 119 Ca 0.00 0.01 -0.12 0.00 1.31 0.00 0.00 55.95 57.15 1vb6 s SER 119 Cb -0.15 -2.07 0.04 0.00 0.21 0.00 0.00 66.02 64.04 1vb6 s SER 119 CO -0.10 0.01 0.37 0.00 0.41 0.00 0.00 173.24 173.93 1vb6 s ALA 120 N 1.41 -0.91 -1.53 1.44 0.00 -0.52 -4.93 121.76 116.72 1vb6 s ALA 120 Ca 0.07 1.12 -0.05 0.00 0.00 0.00 0.00 51.96 53.10 1vb6 s ALA 120 Cb -0.15 -0.66 0.04 0.00 0.00 0.00 0.00 23.12 22.35 1vb6 s ALA 120 CO 0.07 -0.19 0.36 0.39 0.00 0.00 0.00 175.76 176.39 1vb6 n GLU 121 N 3.19 -2.37 -1.01 0.00 1.02 -1.26 -0.59 120.64 119.63 1vb6 n GLU 121 Ca -0.16 0.28 -0.00 0.00 -0.02 0.00 0.00 57.16 57.27 1vb6 n GLU 121 Cb 0.57 -4.33 -0.00 0.00 -0.02 0.00 0.00 31.44 27.65 1vb6 n GLU 121 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vb6 n GLY 122 N -2.02 0.26 3.40 0.62 0.00 -1.26 -5.00 105.19 101.18 1vb6 n GLY 122 Ca -0.23 -0.01 -0.25 0.00 0.00 0.00 0.00 46.02 45.52 1vb6 n GLY 122 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vb6 s LYS 123 N -1.14 1.46 -0.25 1.61 1.02 0.24 -5.12 119.74 117.56 1vb6 s LYS 123 Ca 0.00 -1.50 -0.06 0.00 0.02 0.00 0.00 55.97 54.43 1vb6 s LYS 123 Cb 0.00 -1.70 -0.02 0.00 -0.52 0.00 0.00 37.83 35.59 1vb6 s LYS 123 CO 0.00 0.36 0.04 0.08 -0.92 0.00 0.00 175.35 174.91 1vb6 s VAL 124 N -1.80 4.00 0.41 3.17 1.01 -1.26 -1.43 120.40 124.50 1vb6 s VAL 124 Ca 0.20 -0.32 0.07 0.00 0.00 0.00 0.00 61.98 61.93 1vb6 s VAL 124 Cb -0.07 -2.88 -0.07 0.00 0.00 0.00 0.00 36.38 33.36 1vb6 s VAL 124 CO 0.09 0.34 0.09 -0.31 0.00 0.00 0.00 175.10 175.31 1vb6 s TYR 125 N 1.56 2.56 -0.01 5.22 1.51 0.11 -3.56 117.35 124.75 1vb6 s TYR 125 Ca 0.06 -0.63 0.00 0.00 -1.01 0.00 0.00 57.07 55.49 1vb6 s TYR 125 Cb -0.15 -1.86 0.01 0.00 -0.11 0.00 0.00 41.96 39.86 1vb6 s TYR 125 CO 0.01 0.33 -0.01 0.71 -1.11 0.00 0.00 175.55 175.49 1vb6 s TYR 126 N -2.66 0.22 -0.15 2.71 1.51 -1.03 -0.22 117.35 117.74 1vb6 s TYR 126 Ca 0.38 -0.00 0.01 0.00 -1.01 0.00 0.00 57.07 56.45 1vb6 s TYR 126 Cb 0.07 -0.25 0.00 0.00 -0.11 0.00 0.00 41.96 41.68 1vb6 s TYR 126 CO 0.20 -0.06 -0.19 -1.17 -1.11 0.00 0.00 175.55 173.22 1vb6 s LEU 127 N 0.51 2.27 -0.18 -1.29 2.96 -0.18 -1.35 118.68 121.42 1vb6 s LEU 127 Ca -0.05 -0.55 -0.04 0.00 -0.22 0.00 0.00 54.13 53.27 1vb6 s LEU 127 Cb -0.07 -1.50 -0.02 0.00 0.50 0.00 0.00 46.19 45.09 1vb6 s LEU 127 CO -0.01 0.08 -0.02 0.00 -1.32 0.00 0.00 176.35 175.08 1vb6 s ALA 128 N 0.83 3.00 -0.19 5.97 0.00 -0.06 -0.97 121.76 130.33 1vb6 s ALA 128 Ca -0.06 -0.93 -0.06 0.00 0.00 0.00 0.00 51.96 50.91 1vb6 s ALA 128 Cb -0.15 -1.68 -0.03 0.00 0.00 0.00 0.00 23.12 21.26 1vb6 s ALA 128 CO -0.01 -0.02 0.02 -0.51 0.00 0.00 0.00 175.76 175.23 1vb6 s LEU 129 N 0.78 3.41 -0.02 0.00 1.43 -0.18 -1.42 118.68 122.67 1vb6 s LEU 129 Ca -0.01 -0.12 0.08 0.00 -1.03 0.00 0.00 54.13 53.05 1vb6 s LEU 129 Cb -0.14 -1.86 -0.02 0.00 0.03 0.00 0.00 46.19 44.19 1vb6 s LEU 129 CO 0.02 0.10 -0.25 -0.69 0.23 0.00 0.00 176.35 175.75 1vb6 s VAL 130 N 0.82 2.13 0.03 -1.59 1.01 0.85 -0.59 120.40 123.07 1vb6 s VAL 130 Ca 0.01 -1.08 0.04 0.00 0.00 0.00 0.00 61.98 60.95 1vb6 s VAL 130 Cb -0.14 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 1vb6 s VAL 130 CO 0.02 0.58 -0.11 -0.60 0.00 0.00 0.00 175.10 174.99 1vb6 s ARG 131 N -0.62 0.73 0.39 2.72 3.52 -0.51 -0.40 118.95 124.78 1vb6 s ARG 131 Ca 0.10 -0.68 -0.26 0.00 -0.13 0.00 0.00 55.73 54.76 1vb6 s ARG 131 Cb -0.10 -0.66 -0.09 0.00 -1.56 0.00 0.00 34.95 32.54 1vb6 s ARG 131 CO -0.01 0.16 1.28 0.34 -0.81 0.00 0.00 175.30 176.26 1vb6 s ASP 132 N -1.13 6.43 0.00 -2.12 2.15 -1.26 -0.47 116.67 120.27 1vb6 s ASP 132 Ca -0.02 2.60 0.00 0.00 0.43 0.00 0.00 52.55 55.56 1vb6 s ASP 132 Cb -0.08 -2.64 0.00 0.00 -0.30 0.00 0.00 42.92 39.91 1vb6 s ASP 132 CO 0.01 -0.76 0.08 0.00 -0.17 0.00 0.00 175.17 174.32