#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vov n ARG 3 N 0.00 0.00 -0.32 0.00 3.00 -1.26 -4.93 116.66 113.16 1vov n ARG 3 Ca 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 57.85 57.99 1vov n ARG 3 Cb 0.00 -0.11 0.38 0.00 0.00 0.00 0.00 32.46 32.73 1vov n ARG 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1vov h ARG 4 N 0.00 0.64 -4.28 5.56 3.08 -2.14 -3.43 114.38 113.81 1vov h ARG 4 Ca 0.00 -0.04 -0.20 0.00 0.07 0.00 0.00 59.98 59.81 1vov h ARG 4 Cb 0.00 -0.14 -0.20 0.00 0.08 0.00 0.00 29.97 29.71 1vov h ARG 4 CO 0.00 0.42 -0.71 1.03 -1.07 0.00 0.00 179.97 179.64 1vov s ARG 5 N -5.71 0.48 0.00 0.04 0.52 -1.26 -5.02 118.95 108.00 1vov s ARG 5 Ca -0.10 -0.81 0.21 0.00 -0.52 0.00 0.00 55.73 54.50 1vov s ARG 5 Cb 0.24 -0.04 -0.06 0.00 0.52 0.00 0.00 34.95 35.61 1vov s ARG 5 CO 0.80 -0.02 1.00 -2.13 0.02 0.00 0.00 175.30 174.96 1vov n ARG 6 N 1.19 1.11 0.00 3.54 0.63 -1.26 -4.99 116.66 116.88 1vov n ARG 6 Ca -0.21 -0.75 0.00 0.00 -0.92 0.00 0.00 57.85 55.97 1vov n ARG 6 Cb 0.56 -1.44 0.00 0.00 0.45 0.00 0.00 32.46 32.03 1vov n ARG 6 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1vov n ALA 7 N -0.36 0.00 -3.55 5.13 0.00 -1.26 -4.82 120.51 115.66 1vov n ALA 7 Ca 0.08 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.32 1vov n ALA 7 Cb 0.41 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.72 1vov n ALA 7 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1vov s GLU 8 N 0.00 0.14 0.37 0.00 2.02 -1.26 -5.14 118.70 114.83 1vov s GLU 8 Ca 0.00 0.18 -0.26 0.00 0.02 0.00 0.00 54.97 54.91 1vov s GLU 8 Cb 0.00 -1.24 -0.11 0.00 0.10 0.00 0.00 34.13 32.87 1vov s GLU 8 CO 0.00 -0.61 1.17 0.28 0.02 0.00 0.00 175.26 176.12 1vov n VAL 9 N 5.31 2.25 -3.34 2.63 0.31 -1.26 -4.96 118.33 119.26 1vov n VAL 9 Ca -0.06 -0.50 -0.39 0.00 -0.01 0.00 0.00 64.34 63.38 1vov n VAL 9 Cb 0.49 -1.37 -0.08 0.00 -0.91 0.00 0.00 33.84 31.97 1vov n VAL 9 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1vov s ARG 10 N -1.94 4.10 0.01 5.55 0.52 -1.26 -5.02 118.95 120.91 1vov s ARG 10 Ca 0.59 0.19 -0.30 0.00 -0.52 0.00 0.00 55.73 55.70 1vov s ARG 10 Cb -0.57 -3.60 -0.08 0.00 0.52 0.00 0.00 34.95 31.21 1vov s ARG 10 CO 0.59 -0.19 1.93 -0.65 0.02 0.00 0.00 175.30 177.00 1vov s GLN 11 N 1.80 4.10 0.54 3.54 1.11 -1.26 -4.91 119.66 124.59 1vov s GLN 11 Ca 0.19 2.53 -0.21 0.00 0.01 0.00 0.00 55.36 57.87 1vov s GLN 11 Cb -0.15 -4.15 -0.06 0.00 -1.01 0.00 0.00 33.01 27.64 1vov s GLN 11 CO 0.09 -0.99 1.08 1.28 0.01 0.00 0.00 175.29 176.76 1vov n LEU 12 N 7.66 3.86 -4.58 2.90 4.32 -1.26 -4.86 117.00 125.05 1vov n LEU 12 Ca 0.20 0.91 -0.41 0.00 -0.02 0.00 0.00 56.01 56.70 1vov n LEU 12 Cb 0.41 -1.43 -0.03 0.00 -1.62 0.00 0.00 43.42 40.76 1vov n LEU 12 CO 0.67 -1.42 1.67 -1.10 -1.22 0.00 0.00 177.39 175.99 1vov s GLN 13 N -2.58 2.91 1.04 3.23 -1.52 -1.26 -4.92 119.66 116.56 1vov s GLN 13 Ca 0.71 1.26 -0.18 0.00 -1.95 0.00 0.00 55.36 55.19 1vov s GLN 13 Cb -0.45 -4.34 0.06 0.00 -0.22 0.00 0.00 33.01 28.06 1vov s GLN 13 CO 0.50 -2.37 -0.22 -0.35 -0.25 0.00 0.00 175.29 172.60 1vov n PRO 14 N 8.78 -1.45 -0.81 2.91 -0.04 -1.26 -4.91 135.00 138.22 1vov n PRO 14 Ca 0.25 -0.42 -0.29 0.00 -0.04 0.00 0.00 63.50 63.01 1vov n PRO 14 Cb 0.49 -1.46 0.21 0.00 -0.04 0.00 0.00 33.50 32.70 1vov n PRO 14 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1vov s ASP 15 N -1.68 1.96 0.00 3.54 3.68 -0.85 -4.74 116.67 118.57 1vov s ASP 15 Ca 0.44 1.51 0.00 0.00 2.13 0.00 0.00 52.55 56.63 1vov s ASP 15 Cb -0.05 -2.21 0.00 0.00 -1.45 0.00 0.00 42.92 39.21 1vov s ASP 15 CO 0.54 -3.59 0.00 0.18 0.13 0.00 0.00 175.17 172.43 1vov n LEU 16 N -4.51 0.28 0.22 -1.34 7.99 -1.26 -3.46 117.00 114.93 1vov n LEU 16 Ca 0.05 0.00 0.07 0.00 -0.01 0.00 0.00 56.01 56.13 1vov n LEU 16 Cb 0.55 0.00 0.51 0.00 -0.11 0.00 0.00 43.42 44.37 1vov n LEU 16 CO 0.56 0.05 0.83 0.58 -1.51 0.00 0.00 177.39 177.89 1vov h VAL 17 N 0.00 0.88 0.00 4.08 2.07 -2.00 -3.32 116.25 117.96 1vov h VAL 17 Ca 0.00 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 66.54 1vov h VAL 17 Cb 1.00 1.58 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 1vov h VAL 17 CO 0.00 0.25 -0.61 -1.22 0.02 0.00 0.00 177.57 176.01 1vov n TYR 18 N -3.80 0.00 -2.18 1.57 4.02 -1.26 -5.10 117.16 110.40 1vov n TYR 18 Ca -0.01 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.87 1vov n TYR 18 Cb 0.35 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.67 1vov n TYR 18 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1vov n GLY 19 N 1.78 -3.06 3.44 2.72 0.00 -1.22 -5.00 105.19 103.86 1vov n GLY 19 Ca 0.00 0.26 0.02 0.00 0.00 0.00 0.00 46.02 46.30 1vov n GLY 19 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1vov s ASP 20 N -1.12 -0.17 0.13 1.61 -1.08 -1.25 -4.75 116.67 110.03 1vov s ASP 20 Ca 0.03 0.24 -0.16 0.00 -0.52 0.00 0.00 52.55 52.15 1vov s ASP 20 Cb -0.01 1.13 -0.02 0.00 -1.46 0.00 0.00 42.92 42.57 1vov s ASP 20 CO 0.43 -0.04 1.65 -0.37 0.52 0.00 0.00 175.17 177.36 1vov h VAL 21 N 5.08 1.21 -0.30 1.11 -1.51 -1.91 -2.15 116.25 117.79 1vov h VAL 21 Ca -0.20 -0.69 0.09 0.00 -1.23 0.00 0.00 66.70 64.66 1vov h VAL 21 Cb 1.14 0.94 -0.01 0.00 -2.13 0.00 0.00 31.29 31.24 1vov h VAL 21 CO 0.15 0.24 0.40 -0.07 -1.23 0.00 0.00 177.57 177.05 1vov h LEU 22 N 0.47 0.00 0.13 4.19 4.07 -1.98 0.26 115.31 122.45 1vov h LEU 22 Ca 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.08 1vov h LEU 22 Cb 0.25 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.99 1vov h LEU 22 CO -0.00 0.00 -0.06 0.58 -1.08 0.00 0.00 178.44 177.88 1vov h VAL 23 N 0.00 0.00 0.00 1.22 2.07 -1.85 -3.21 116.25 114.48 1vov h VAL 23 Ca 0.14 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1vov h VAL 23 Cb 0.93 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1vov h VAL 23 CO -0.00 0.00 0.00 0.35 0.02 0.00 0.00 177.57 177.94 1vov n THR 24 N -3.65 0.46 0.00 2.57 -2.24 -0.95 -3.55 114.28 106.93 1vov n THR 24 Ca -0.02 0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1vov n THR 24 Cb 0.07 -1.00 0.00 0.00 -2.10 0.00 0.00 70.33 67.30 1vov n THR 24 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vov n ALA 25 N -1.15 0.00 -0.05 6.98 0.00 0.88 -1.34 120.51 125.84 1vov n ALA 25 Ca 0.04 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.61 1vov n ALA 25 Cb 0.04 0.05 0.54 0.00 0.00 0.00 0.00 19.45 20.07 1vov n ALA 25 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1vov h PHE 26 N 0.00 0.35 -0.95 0.00 3.57 -1.73 -1.09 116.94 117.08 1vov h PHE 26 Ca 0.00 0.01 0.19 0.00 3.53 0.00 0.00 57.97 61.69 1vov h PHE 26 Cb 0.00 -0.11 -0.11 0.00 2.79 0.00 0.00 35.95 38.52 1vov h PHE 26 CO 0.00 0.16 0.54 0.82 -2.23 0.00 0.00 178.31 177.61 1vov h ILE 27 N 0.33 0.68 -0.91 1.41 2.04 -1.59 0.57 117.51 120.03 1vov h ILE 27 Ca 0.26 -0.23 0.15 0.00 1.00 0.00 0.00 64.86 66.03 1vov h ILE 27 Cb 0.57 -0.06 -0.07 0.00 -0.74 0.00 0.00 36.82 36.52 1vov h ILE 27 CO -0.06 0.12 0.58 0.78 0.00 0.00 0.00 178.15 179.58 1vov h ASN 28 N 0.68 0.66 0.50 1.72 2.35 0.11 -0.27 115.58 121.34 1vov h ASN 28 Ca 0.55 0.05 -0.29 0.00 -0.55 0.00 0.00 56.30 56.06 1vov h ASN 28 Cb 0.87 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 39.12 1vov h ASN 28 CO -0.40 0.32 -1.63 0.11 -1.65 0.00 0.00 177.43 174.18 1vov h LYS 29 N 0.70 0.07 -0.18 0.81 1.79 -0.60 -3.29 116.57 115.87 1vov h LYS 29 Ca 0.47 -0.12 0.05 0.00 -2.18 0.00 0.00 60.65 58.87 1vov h LYS 29 Cb 0.76 0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.45 1vov h LYS 29 CO -0.22 0.75 0.16 0.82 -1.08 0.00 0.00 179.45 179.88 1vov h ILE 30 N 0.02 0.66 -0.50 1.86 2.04 0.11 -3.37 117.51 118.33 1vov h ILE 30 Ca -0.26 0.00 -0.21 0.00 1.00 0.00 0.00 64.86 65.39 1vov h ILE 30 Cb 1.99 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 38.91 1vov h ILE 30 CO 0.10 0.00 0.58 -0.32 0.00 0.00 0.00 178.15 178.51 1vov s MET 31 N -4.81 2.16 0.31 2.37 1.75 -0.23 -4.93 119.30 115.92 1vov s MET 31 Ca -0.05 -0.36 -0.29 0.00 -1.25 0.00 0.00 55.69 53.74 1vov s MET 31 Cb 0.17 -5.04 -0.10 0.00 2.84 0.00 0.00 34.83 32.70 1vov s MET 31 CO 0.61 -4.03 1.33 -0.98 -0.65 0.00 0.00 175.02 171.30 1vov s ARG 32 N 7.46 4.34 0.00 4.11 1.70 -1.26 -3.72 118.95 131.59 1vov s ARG 32 Ca 0.76 2.22 0.00 0.00 -0.47 0.00 0.00 55.73 58.23 1vov s ARG 32 Cb -0.06 -3.09 0.00 0.00 -0.57 0.00 0.00 34.95 31.23 1vov s ARG 32 CO 0.07 -0.23 0.00 -0.25 -1.08 0.00 0.00 175.30 173.81 1vov n ASP 33 N 1.22 0.00 0.00 -2.89 8.00 -1.26 -4.02 116.55 117.60 1vov n ASP 33 Ca 0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.52 1vov n ASP 33 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.52 1vov n ASP 33 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vov n GLY 34 N 0.00 -0.14 2.59 0.44 0.00 -1.24 -5.14 105.19 101.69 1vov n GLY 34 Ca 0.00 -0.04 -0.26 0.00 0.00 0.00 0.00 46.02 45.71 1vov n GLY 34 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vov s LYS 35 N 0.00 0.16 0.00 1.61 2.20 -1.26 -5.01 119.74 117.45 1vov s LYS 35 Ca 0.00 -0.32 0.04 0.00 -0.36 0.00 0.00 55.97 55.33 1vov s LYS 35 Cb 0.00 -1.31 0.19 0.00 -1.51 0.00 0.00 37.83 35.20 1vov s LYS 35 CO 0.00 -0.90 1.02 1.17 -0.36 0.00 0.00 175.35 176.28 1vov n LYS 36 N 5.27 0.04 -0.08 4.03 4.81 -1.26 -2.46 118.16 128.50 1vov n LYS 36 Ca -0.06 0.31 -0.23 0.00 -0.87 0.00 0.00 58.31 57.47 1vov n LYS 36 Cb 0.45 -1.50 -0.12 0.00 0.02 0.00 0.00 35.03 33.88 1vov n LYS 36 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1vov n ASN 37 N -1.36 1.98 -0.05 3.14 4.05 -1.26 -3.35 115.26 118.41 1vov n ASN 37 Ca 0.02 0.26 -0.06 0.00 0.45 0.00 0.00 54.58 55.25 1vov n ASN 37 Cb 0.04 -0.83 -0.04 0.00 1.23 0.00 0.00 39.78 40.18 1vov n ASN 37 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 1vov h LEU 38 N -0.53 -0.76 -1.66 1.20 5.85 -1.92 0.88 115.31 118.38 1vov h LEU 38 Ca -0.47 0.10 0.10 0.00 0.84 0.00 0.00 57.88 58.44 1vov h LEU 38 Cb 1.67 0.31 -0.03 0.00 0.37 0.00 0.00 40.66 42.98 1vov h LEU 38 CO -0.14 -0.17 0.39 0.00 -0.34 0.00 0.00 178.44 178.18 1vov h ALA 39 N -0.82 2.03 0.00 1.25 0.00 -1.78 0.32 119.26 120.26 1vov h ALA 39 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1vov h ALA 39 Cb 0.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1vov h ALA 39 CO -0.23 -0.16 0.00 0.00 0.00 0.00 0.00 179.25 178.86 1vov n ALA 40 N -2.52 2.28 0.00 0.00 0.00 0.20 -2.99 120.51 117.47 1vov n ALA 40 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1vov n ALA 40 Cb 0.37 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.82 1vov n ALA 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1vov n ARG 41 N -0.16 1.16 0.00 0.00 1.74 0.10 -4.78 116.66 114.72 1vov n ARG 41 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1vov n ARG 41 Cb 0.12 -0.67 0.00 0.00 -1.02 0.00 0.00 32.46 30.89 1vov n ARG 41 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1vov n ILE 42 N -1.13 0.00 0.07 0.55 5.41 -0.59 -2.62 119.36 121.05 1vov n ILE 42 Ca 0.00 0.00 0.05 0.00 1.00 0.00 0.00 62.75 63.80 1vov n ILE 42 Cb 0.17 -0.22 -0.07 0.00 -0.71 0.00 0.00 39.64 38.81 1vov n ILE 42 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 1vov n PHE 43 N -0.42 0.00 0.66 1.39 3.01 -1.26 -4.15 117.46 116.68 1vov n PHE 43 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1vov n PHE 43 Cb 0.02 -0.17 0.00 0.00 -0.01 0.00 0.00 39.48 39.31 1vov n PHE 43 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1vov n TYR 44 N -1.71 0.00 0.00 1.38 4.02 -1.08 -2.79 117.16 116.98 1vov n TYR 44 Ca -0.01 -0.23 0.00 0.00 -0.01 0.00 0.00 57.90 57.65 1vov n TYR 44 Cb 0.22 -0.16 0.00 0.00 -0.02 0.00 0.00 39.34 39.38 1vov n TYR 44 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1vov n ASP 45 N 0.52 0.00 -0.08 7.72 5.75 -1.26 -4.82 116.55 124.38 1vov n ASP 45 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 54.79 54.71 1vov n ASP 45 Cb 0.28 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.36 1vov n ASP 45 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1vov h ALA 46 N 0.00 0.23 -0.46 2.12 0.00 -1.68 0.40 119.26 119.87 1vov h ALA 46 Ca 0.00 0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 1vov h ALA 46 Cb 0.00 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1vov h ALA 46 CO 0.00 -0.44 -0.21 0.00 0.00 0.00 0.00 179.25 178.60 1vov h LYS 48 N 0.79 0.00 0.29 0.00 1.57 -1.65 -1.08 116.57 116.50 1vov h LYS 48 Ca 0.10 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 1vov h LYS 48 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.10 1vov h LYS 48 CO 0.06 0.01 -0.14 0.82 -0.57 0.00 0.00 179.45 179.64 1vov h ILE 49 N 0.00 0.72 0.14 1.86 2.04 -0.42 0.58 117.51 122.42 1vov h ILE 49 Ca -0.00 -0.03 -0.00 0.00 1.00 0.00 0.00 64.86 65.82 1vov h ILE 49 Cb 0.12 0.74 -0.00 0.00 -0.74 0.00 0.00 36.82 36.94 1vov h ILE 49 CO 0.00 0.01 -0.09 0.40 0.00 0.00 0.00 178.15 178.46 1vov h ILE 50 N -0.41 0.79 -0.12 -0.67 2.04 -1.28 -0.22 117.51 117.65 1vov h ILE 50 Ca -0.04 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.86 1vov h ILE 50 Cb 0.31 0.79 -0.00 0.00 -0.74 0.00 0.00 36.82 37.18 1vov h ILE 50 CO 0.07 0.00 0.22 -0.61 0.00 0.00 0.00 178.15 177.83 1vov h GLN 51 N -0.23 0.00 0.00 2.37 -0.00 -1.03 -2.92 115.11 113.30 1vov h GLN 51 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 1vov h GLN 51 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.68 1vov h GLN 51 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 178.83 179.22 1vov n GLU 52 N -3.41 0.00 -0.16 1.69 1.02 0.20 -4.75 120.64 115.23 1vov n GLU 52 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1vov n GLU 52 Cb 0.32 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 31.77 1vov n GLU 52 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1vov n LYS 53 N 0.00 -0.09 -2.64 3.49 4.01 -0.32 -4.08 118.16 118.54 1vov n LYS 53 Ca 0.00 0.65 -0.41 0.00 -0.51 0.00 0.00 58.31 58.04 1vov n LYS 53 Cb 0.00 -0.97 -0.04 0.00 -0.51 0.00 0.00 35.03 33.51 1vov n LYS 53 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 1vov s THR 54 N -5.43 4.42 -2.00 -0.18 2.01 -1.10 -4.90 115.64 108.46 1vov s THR 54 Ca -0.06 1.89 0.00 0.00 0.31 0.00 0.00 61.69 63.83 1vov s THR 54 Cb 0.09 -4.21 0.01 0.00 0.01 0.00 0.00 72.50 68.40 1vov s THR 54 CO 0.31 0.23 0.16 0.61 -0.69 0.00 0.00 174.62 175.24 1vov n GLY 55 N 2.55 -0.04 3.24 4.40 0.00 -1.26 -4.46 105.19 109.62 1vov n GLY 55 Ca 0.04 -0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 1vov n GLY 55 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1vov s GLN 56 N -2.00 1.00 0.58 1.61 1.11 -1.26 -5.09 119.66 115.61 1vov s GLN 56 Ca 0.00 -1.22 -0.18 0.00 0.01 0.00 0.00 55.36 53.98 1vov s GLN 56 Cb 0.00 -0.89 -0.04 0.00 -1.01 0.00 0.00 33.01 31.07 1vov s GLN 56 CO 0.00 0.17 1.10 -1.21 0.01 0.00 0.00 175.29 175.37 1vov s GLU 57 N -2.60 3.23 0.39 2.91 2.02 -1.26 -3.06 118.70 120.32 1vov s GLU 57 Ca 0.08 1.46 0.12 0.00 0.02 0.00 0.00 54.97 56.65 1vov s GLU 57 Cb -0.05 -2.00 0.91 0.00 0.10 0.00 0.00 34.13 33.09 1vov s GLU 57 CO 0.03 -0.92 1.90 -1.00 0.02 0.00 0.00 175.26 175.29 1vov h PRO 58 N 0.77 0.56 -0.94 0.39 0.13 -1.81 -2.24 132.00 128.86 1vov h PRO 58 Ca -0.49 -0.03 0.24 0.00 -0.87 0.00 0.00 66.00 64.85 1vov h PRO 58 Cb 1.25 -0.13 -0.06 0.00 0.13 0.00 0.00 31.00 32.19 1vov h PRO 58 CO 0.56 0.37 0.64 1.25 -0.23 0.00 0.00 178.00 180.59 1vov h LEU 59 N 0.58 0.26 -0.35 1.56 5.85 -1.92 0.31 115.31 121.60 1vov h LEU 59 Ca 0.40 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.15 1vov h LEU 59 Cb 0.72 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.73 1vov h LEU 59 CO -0.15 0.09 0.00 0.29 -0.34 0.00 0.00 178.44 178.33 1vov n LYS 60 N -4.44 0.08 -2.03 1.25 4.76 -0.84 -3.87 118.16 113.07 1vov n LYS 60 Ca 0.20 0.36 -0.42 0.00 -2.87 0.00 0.00 58.31 55.58 1vov n LYS 60 Cb 0.84 -1.67 0.00 0.00 -1.84 0.00 0.00 35.03 32.36 1vov n LYS 60 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1vov n VAL 61 N -1.83 4.01 0.00 -0.18 0.31 0.11 -4.83 118.33 115.92 1vov n VAL 61 Ca 0.02 -3.76 0.00 0.00 -0.01 0.00 0.00 64.34 60.59 1vov n VAL 61 Cb 0.17 -2.46 0.00 0.00 -0.91 0.00 0.00 33.84 30.64 1vov n VAL 61 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 1vov n PHE 62 N 4.68 0.00 0.09 3.52 7.35 -1.25 -4.46 117.46 127.39 1vov n PHE 62 Ca 0.47 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.16 1vov n PHE 62 Cb 0.36 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.19 1vov n PHE 62 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1vov n LYS 63 N 0.00 0.78 0.24 -4.13 5.02 -1.26 -4.09 118.16 114.72 1vov n LYS 63 Ca 0.00 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.36 1vov n LYS 63 Cb 0.00 -1.11 0.58 0.00 -0.02 0.00 0.00 35.03 34.48 1vov n LYS 63 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 1vov h GLN 64 N 1.16 0.00 0.50 1.97 5.75 -1.92 -2.53 115.11 120.04 1vov h GLN 64 Ca 0.00 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.48 1vov h GLN 64 Cb 0.78 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.34 1vov h GLN 64 CO 0.00 0.14 -0.24 0.00 -2.65 0.00 0.00 178.83 176.08 1vov h ALA 65 N 1.86 -1.04 -1.07 3.38 0.00 -1.91 -2.79 119.26 117.70 1vov h ALA 65 Ca -0.00 -0.15 0.29 0.00 0.00 0.00 0.00 54.91 55.05 1vov h ALA 65 Cb 0.26 0.26 -0.11 0.00 0.00 0.00 0.00 17.79 18.20 1vov h ALA 65 CO 0.02 -0.99 0.67 0.28 0.00 0.00 0.00 179.25 179.23 1vov h VAL 66 N -0.76 0.45 0.40 0.00 2.07 -1.83 -0.68 116.25 115.90 1vov h VAL 66 Ca -0.07 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 1vov h VAL 66 Cb 0.52 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 1vov h VAL 66 CO 0.11 0.07 -0.38 -0.08 0.02 0.00 0.00 177.57 177.31 1vov h GLU 67 N 0.37 -0.77 -0.00 1.57 4.57 -1.30 -2.64 114.58 116.38 1vov h GLU 67 Ca 0.65 0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.88 1vov h GLU 67 Cb 1.63 0.17 0.00 0.00 -0.16 0.00 0.00 28.75 30.40 1vov h GLU 67 CO -0.37 -0.51 -0.05 0.09 -1.18 0.00 0.00 179.01 176.99 1vov n ASN 68 N -5.48 0.20 -2.46 1.04 3.02 -0.70 -3.99 115.26 106.90 1vov n ASN 68 Ca -0.10 -0.43 -0.20 0.00 -0.03 0.00 0.00 54.58 53.82 1vov n ASN 68 Cb 0.38 -0.16 0.01 0.00 -0.61 0.00 0.00 39.78 39.40 1vov n ASN 68 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1vov n VAL 69 N -1.11 2.02 -3.62 2.41 0.31 -0.35 -4.31 118.33 113.68 1vov n VAL 69 Ca 0.15 -4.22 -0.27 0.00 -0.01 0.00 0.00 64.34 59.99 1vov n VAL 69 Cb 0.24 -0.61 -0.10 0.00 -0.91 0.00 0.00 33.84 32.46 1vov n VAL 69 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1vov n LYS 70 N -0.45 1.75 0.00 5.55 5.02 -1.03 -4.65 118.16 124.35 1vov n LYS 70 Ca 0.31 -4.27 0.00 0.00 -2.02 0.00 0.00 58.31 52.33 1vov n LYS 70 Cb 0.77 -2.11 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 1vov n LYS 70 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1vov n PRO 71 N 1.67 -0.14 0.00 1.97 -0.04 -1.26 -5.02 135.00 132.18 1vov n PRO 71 Ca 0.25 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.71 1vov n PRO 71 Cb 0.40 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.86 1vov n PRO 71 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1vov n ARG 72 N -1.07 -0.02 -3.92 0.54 1.74 -1.26 -5.00 116.66 107.67 1vov n ARG 72 Ca 0.00 -0.41 -0.22 0.00 -0.77 0.00 0.00 57.85 56.44 1vov n ARG 72 Cb 0.00 -0.91 -0.05 0.00 -1.02 0.00 0.00 32.46 30.48 1vov n ARG 72 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1vov n MET 73 N -0.11 0.93 -3.53 5.56 2.81 -1.26 -4.61 117.12 116.90 1vov n MET 73 Ca 0.00 -2.69 -0.04 0.00 -1.81 0.00 0.00 57.70 53.16 1vov n MET 73 Cb 0.01 0.99 0.02 0.00 -0.71 0.00 0.00 33.22 33.54 1vov n MET 73 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 1vov n GLU 74 N -0.84 0.70 -3.75 0.03 0.28 -1.26 -4.93 120.64 110.86 1vov n GLU 74 Ca -0.11 -1.51 -0.37 0.00 -0.16 0.00 0.00 57.16 55.02 1vov n GLU 74 Cb 0.47 1.98 -0.11 0.00 1.43 0.00 0.00 31.44 35.20 1vov n GLU 74 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1vov s VAL 75 N -2.15 4.75 0.00 3.84 1.01 -1.26 -4.32 120.40 122.26 1vov s VAL 75 Ca 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.13 1vov s VAL 75 Cb -0.03 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.13 1vov s VAL 75 CO 0.07 0.34 0.00 0.54 0.00 0.00 0.00 175.10 176.04 1vov n ARG 76 N 4.66 0.00 -3.50 2.72 1.74 -1.26 -5.02 116.66 115.99 1vov n ARG 76 Ca -0.16 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.78 1vov n ARG 76 Cb 0.52 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.91 1vov n ARG 76 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1vov s SER 77 N 0.70 -0.56 -0.28 0.55 0.15 -1.26 -3.96 113.70 109.04 1vov s SER 77 Ca 0.00 0.31 -0.23 0.00 0.70 0.00 0.00 55.95 56.73 1vov s SER 77 Cb 0.00 0.55 0.11 0.00 -1.71 0.00 0.00 66.02 64.97 1vov s SER 77 CO 0.00 -0.77 0.92 -0.60 1.20 0.00 0.00 173.24 174.00 1vov s ARG 78 N -2.45 0.58 0.27 5.44 3.52 -1.26 -4.73 118.95 120.32 1vov s ARG 78 Ca -0.05 0.75 0.03 0.00 -0.13 0.00 0.00 55.73 56.33 1vov s ARG 78 Cb -0.01 0.25 -0.03 0.00 -1.56 0.00 0.00 34.95 33.60 1vov s ARG 78 CO -0.01 -0.08 0.43 1.03 -0.81 0.00 0.00 175.30 175.85 1vov s ARG 79 N 0.55 3.47 0.00 5.12 0.52 -1.26 -4.15 118.95 123.19 1vov s ARG 79 Ca -0.00 -0.55 0.00 0.00 -0.52 0.00 0.00 55.73 54.66 1vov s ARG 79 Cb -0.05 -2.81 0.00 0.00 0.52 0.00 0.00 34.95 32.61 1vov s ARG 79 CO -0.07 0.33 0.00 0.28 0.02 0.00 0.00 175.30 175.86 1vov n VAL 80 N -1.40 0.00 0.00 3.52 0.31 -1.26 -5.06 118.33 114.44 1vov n VAL 80 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 1vov n VAL 80 Cb 0.56 -0.62 0.00 0.00 -0.91 0.00 0.00 33.84 32.87 1vov n VAL 80 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1vov n GLY 81 N 2.94 0.00 0.00 2.92 0.00 -1.26 -5.00 105.19 104.78 1vov n GLY 81 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1vov n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vov n GLY 82 N 0.00 0.10 3.36 -0.02 0.00 -1.26 -5.16 105.19 102.21 1vov n GLY 82 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1vov n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vov s ALA 83 N 0.00 1.98 -0.19 4.61 0.00 -1.26 -5.15 121.76 121.75 1vov s ALA 83 Ca 0.00 -1.82 -0.02 0.00 0.00 0.00 0.00 51.96 50.12 1vov s ALA 83 Cb 0.00 0.98 0.06 0.00 0.00 0.00 0.00 23.12 24.16 1vov s ALA 83 CO 0.00 -0.43 0.02 1.21 0.00 0.00 0.00 175.76 176.55 1vov s ASN 84 N -3.38 2.99 -0.07 0.00 3.84 -1.26 -4.15 114.94 112.91 1vov s ASN 84 Ca 0.36 -0.84 -0.01 0.00 0.21 0.00 0.00 52.86 52.58 1vov s ASN 84 Cb 0.07 -0.69 0.03 0.00 -0.55 0.00 0.00 41.25 40.11 1vov s ASN 84 CO 0.15 -0.29 0.00 -0.31 -2.79 0.00 0.00 177.10 173.87 1vov s TYR 85 N 1.79 0.63 -0.26 0.43 4.12 -1.26 -5.09 117.35 117.70 1vov s TYR 85 Ca -0.01 -0.14 -0.37 0.00 0.02 0.00 0.00 57.07 56.57 1vov s TYR 85 Cb -0.17 -0.76 -0.13 0.00 -1.52 0.00 0.00 41.96 39.38 1vov s TYR 85 CO -0.08 -0.31 1.97 1.04 0.02 0.00 0.00 175.55 178.19 1vov n GLN 86 N 5.06 1.40 -3.51 -0.62 6.02 -1.26 -4.20 117.38 120.27 1vov n GLN 86 Ca -0.09 0.47 -0.42 0.00 -0.01 0.00 0.00 57.00 56.96 1vov n GLN 86 Cb 0.50 -2.40 -0.08 0.00 1.02 0.00 0.00 30.24 29.28 1vov n GLN 86 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1vov s VAL 87 N 5.25 4.40 0.64 5.09 1.01 -1.25 -4.93 120.40 130.61 1vov s VAL 87 Ca 1.02 -1.81 -0.10 0.00 0.00 0.00 0.00 61.98 61.09 1vov s VAL 87 Cb -0.88 -3.88 -0.01 0.00 0.00 0.00 0.00 36.38 31.61 1vov s VAL 87 CO 0.55 -0.80 1.01 -2.16 0.00 0.00 0.00 175.10 173.70 1vov s PRO 88 N 1.31 3.14 0.00 2.72 0.04 -1.26 -4.33 135.00 136.62 1vov s PRO 88 Ca 0.06 0.44 0.00 0.00 0.04 0.00 0.00 61.00 61.54 1vov s PRO 88 Cb -0.26 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.16 1vov s PRO 88 CO -0.01 -0.77 0.00 0.00 0.04 0.00 0.00 177.00 176.27 1vov n MET 89 N -2.79 0.00 -1.58 4.56 0.00 -1.26 -4.66 117.12 111.39 1vov n MET 89 Ca 0.06 0.00 -0.53 0.00 0.00 0.00 0.00 57.70 57.23 1vov n MET 89 Cb 0.56 0.00 -0.06 0.00 0.00 0.00 0.00 33.22 33.72 1vov n MET 89 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 1vov n GLU 90 N 0.00 1.00 -4.22 3.17 2.13 -1.26 -4.56 120.64 116.89 1vov n GLU 90 Ca 0.00 0.36 -0.34 0.00 0.66 0.00 0.00 57.16 57.84 1vov n GLU 90 Cb 0.00 -1.97 -0.08 0.00 0.27 0.00 0.00 31.44 29.65 1vov n GLU 90 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1vov s VAL 91 N 0.37 4.53 0.04 6.31 1.01 -1.26 -4.99 120.40 126.41 1vov s VAL 91 Ca 0.84 -0.32 0.08 0.00 0.00 0.00 0.00 61.98 62.59 1vov s VAL 91 Cb -0.99 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 1vov s VAL 91 CO 0.48 0.49 -0.24 -0.94 0.00 0.00 0.00 175.10 174.89 1vov s SER 92 N -1.29 2.82 0.43 3.32 1.04 -1.26 -4.99 113.70 113.77 1vov s SER 92 Ca 0.18 -0.54 0.30 0.00 0.48 0.00 0.00 55.95 56.36 1vov s SER 92 Cb -0.12 -0.25 1.49 0.00 0.10 0.00 0.00 66.02 67.24 1vov s SER 92 CO 0.07 0.22 1.90 1.55 0.98 0.00 0.00 173.24 177.96 1vov h PRO 93 N 4.90 0.00 -0.63 4.02 0.13 -1.99 -2.97 132.00 135.45 1vov h PRO 93 Ca -0.44 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.75 1vov h PRO 93 Cb 1.15 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.19 1vov h PRO 93 CO 0.44 0.00 -0.52 -0.09 -0.23 0.00 0.00 178.00 177.60 1vov h ARG 94 N 0.00 -0.18 0.00 0.86 9.65 -2.03 -2.54 114.38 120.15 1vov h ARG 94 Ca 0.00 0.01 -0.21 0.00 -1.10 0.00 0.00 59.98 58.68 1vov h ARG 94 Cb 0.14 0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 28.73 1vov h ARG 94 CO 0.00 -0.12 -1.47 -0.09 2.80 0.00 0.00 179.97 181.09 1vov h ARG 95 N -0.18 0.00 -0.98 0.20 2.43 -1.98 -3.36 114.38 110.50 1vov h ARG 95 Ca 0.10 0.00 0.28 0.00 -0.81 0.00 0.00 59.98 59.56 1vov h ARG 95 Cb 0.45 0.00 -0.14 0.00 -0.42 0.00 0.00 29.97 29.86 1vov h ARG 95 CO -0.69 0.38 0.51 1.96 -1.51 0.00 0.00 179.97 180.63 1vov h GLN 96 N 0.00 0.36 -0.07 0.20 4.20 -1.32 0.42 115.11 118.90 1vov h GLN 96 Ca -0.19 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.52 1vov h GLN 96 Cb 1.73 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 29.39 1vov h GLN 96 CO 0.06 0.24 -0.12 -0.56 -0.67 0.00 0.00 178.83 177.78 1vov h GLN 97 N 0.37 -0.16 -0.04 1.46 3.07 -1.62 0.51 115.11 118.70 1vov h GLN 97 Ca 0.67 0.01 -0.03 0.00 0.09 0.00 0.00 58.65 59.40 1vov h GLN 97 Cb 1.44 0.04 0.00 0.00 0.08 0.00 0.00 27.48 29.03 1vov h GLN 97 CO -0.58 -0.10 -0.07 0.77 0.09 0.00 0.00 178.83 178.93 1vov h SER 98 N -0.16 0.14 -0.01 0.06 0.02 -1.07 -3.14 113.55 109.39 1vov h SER 98 Ca 0.07 -0.56 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 1vov h SER 98 Cb 0.26 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.76 1vov h SER 98 CO -0.17 0.67 0.01 -0.07 -1.14 0.00 0.00 176.83 176.12 1vov h LEU 99 N -0.39 0.00 0.00 5.07 3.38 -0.18 -1.53 115.31 121.66 1vov h LEU 99 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1vov h LEU 99 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1vov h LEU 99 CO 0.02 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.55 1vov n ALA 100 N -2.37 1.12 0.36 1.53 0.00 0.18 -0.03 120.51 121.29 1vov n ALA 100 Ca -0.03 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.45 1vov n ALA 100 Cb 0.09 -0.99 0.03 0.00 0.00 0.00 0.00 19.45 18.58 1vov n ALA 100 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1vov n LEU 101 N -1.37 1.67 0.24 0.00 4.77 -0.58 -4.72 117.00 117.01 1vov n LEU 101 Ca 0.00 -0.99 -0.09 0.00 -0.03 0.00 0.00 56.01 54.90 1vov n LEU 101 Cb 0.00 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 1vov n LEU 101 CO 0.00 0.33 0.46 -0.09 -1.33 0.00 0.00 177.39 176.76 1vov h ARG 102 N 1.63 -0.59 -1.06 3.23 2.43 -0.56 -3.09 114.38 116.37 1vov h ARG 102 Ca 0.00 0.04 0.29 0.00 -0.81 0.00 0.00 59.98 59.50 1vov h ARG 102 Cb 0.35 0.13 -0.12 0.00 -0.42 0.00 0.00 29.97 29.92 1vov h ARG 102 CO 0.00 -0.39 0.65 -1.49 -1.51 0.00 0.00 179.97 177.23 1vov h TRP 103 N -0.67 0.79 -0.83 2.20 6.55 -1.85 0.14 115.95 122.28 1vov h TRP 103 Ca -0.06 0.03 0.20 0.00 0.95 0.00 0.00 58.89 60.01 1vov h TRP 103 Cb 0.47 -0.22 -0.13 0.00 -0.86 0.00 0.00 29.16 28.42 1vov h TRP 103 CO 0.10 -0.01 0.24 -0.07 -1.05 0.00 0.00 178.44 177.65 1vov h LEU 104 N 0.40 0.06 0.04 -4.49 3.38 -1.83 0.48 115.31 113.36 1vov h LEU 104 Ca 0.66 0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.80 1vov h LEU 104 Cb 1.57 0.22 -0.00 0.00 0.09 0.00 0.00 40.66 42.54 1vov h LEU 104 CO -0.41 -0.08 -0.05 0.58 0.09 0.00 0.00 178.44 178.57 1vov h VAL 105 N 0.27 0.00 -0.67 1.22 2.07 -0.75 -0.91 116.25 117.47 1vov h VAL 105 Ca 0.50 0.00 0.12 0.00 0.82 0.00 0.00 66.70 68.14 1vov h VAL 105 Cb 0.95 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.68 1vov h VAL 105 CO -0.58 0.00 0.45 0.06 0.02 0.00 0.00 177.57 177.52 1vov h GLN 106 N -0.09 0.41 0.00 1.57 -0.00 -1.53 0.53 115.11 116.01 1vov h GLN 106 Ca -0.01 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.62 1vov h GLN 106 Cb 0.08 -0.09 0.00 0.00 -0.00 0.00 0.00 27.48 27.47 1vov h GLN 106 CO -0.01 0.27 0.00 0.00 -0.00 0.00 0.00 178.83 179.09 1vov n ALA 107 N -2.52 2.43 -0.51 0.06 0.00 0.16 -2.32 120.51 117.81 1vov n ALA 107 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1vov n ALA 107 Cb 0.43 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.85 1vov n ALA 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vov n ALA 108 N -0.53 1.48 -0.48 0.00 0.00 0.18 -4.91 120.51 116.24 1vov n ALA 108 Ca 0.02 -0.72 0.00 0.00 0.00 0.00 0.00 53.44 52.73 1vov n ALA 108 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.46 1vov n ALA 108 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1vov n ASN 109 N -0.23 0.00 -4.57 0.00 3.02 -0.97 -4.89 115.26 107.61 1vov n ASN 109 Ca 0.00 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.29 1vov n ASN 109 Cb 0.37 -0.02 -0.06 0.00 -0.61 0.00 0.00 39.78 39.46 1vov n ASN 109 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1vov s GLN 110 N -0.52 2.32 -0.02 3.52 -1.52 -1.17 -4.86 119.66 117.42 1vov s GLN 110 Ca 0.00 -0.78 -0.00 0.00 -1.95 0.00 0.00 55.36 52.62 1vov s GLN 110 Cb 0.00 -5.15 0.02 0.00 -0.22 0.00 0.00 33.01 27.66 1vov s GLN 110 CO 0.00 -4.02 0.03 1.03 -0.25 0.00 0.00 175.29 172.08 1vov s ARG 111 N 6.94 -0.01 -0.00 2.91 0.52 -1.26 -4.92 118.95 123.11 1vov s ARG 111 Ca 0.71 0.14 0.00 0.00 -0.52 0.00 0.00 55.73 56.06 1vov s ARG 111 Cb -0.03 -0.16 0.01 0.00 0.52 0.00 0.00 34.95 35.29 1vov s ARG 111 CO 0.10 -0.11 0.93 -0.35 0.02 0.00 0.00 175.30 175.89 1vov n PRO 112 N 3.80 1.02 0.00 3.54 -0.04 -1.26 -4.80 135.00 137.26 1vov n PRO 112 Ca -0.22 -0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.21 1vov n PRO 112 Cb 0.54 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.91 1vov n PRO 112 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1vov n GLU 113 N 0.41 1.20 0.00 0.54 -0.58 -1.26 -5.18 120.64 115.77 1vov n GLU 113 Ca 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 1vov n GLU 113 Cb 0.47 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.34 1vov n GLU 113 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1vov n ARG 114 N 0.00 2.33 -0.79 3.49 1.74 -1.26 -5.09 116.66 117.07 1vov n ARG 114 Ca 0.00 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.74 1vov n ARG 114 Cb 0.00 0.00 0.12 0.00 -1.02 0.00 0.00 32.46 31.56 1vov n ARG 114 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1vov n ARG 115 N 0.00 -0.95 -0.05 5.56 3.00 -1.26 -4.48 116.66 118.48 1vov n ARG 115 Ca 0.00 -0.26 -0.12 0.00 -0.01 0.00 0.00 57.85 57.45 1vov n ARG 115 Cb 0.00 -1.49 -0.07 0.00 0.00 0.00 0.00 32.46 30.90 1vov n ARG 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1vov h ALA 116 N -1.67 -0.62 -0.88 7.54 0.00 -1.98 -1.98 119.26 119.66 1vov h ALA 116 Ca -0.48 0.00 0.09 0.00 0.00 0.00 0.00 54.91 54.52 1vov h ALA 116 Cb 1.36 0.88 -0.11 0.00 0.00 0.00 0.00 17.79 19.92 1vov h ALA 116 CO 0.32 -0.95 -0.49 0.00 0.00 0.00 0.00 179.25 178.13 1vov n ALA 117 N -2.99 -0.49 -0.15 0.00 0.00 -1.26 0.19 120.51 115.80 1vov n ALA 117 Ca -0.03 0.77 -0.06 0.00 0.00 0.00 0.00 53.44 54.12 1vov n ALA 117 Cb 0.36 -0.17 0.03 0.00 0.00 0.00 0.00 19.45 19.67 1vov n ALA 117 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1vov h VAL 118 N 0.00 1.03 -0.68 0.00 2.07 -1.77 -2.48 116.25 114.43 1vov h VAL 118 Ca 0.17 -0.19 0.03 0.00 0.82 0.00 0.00 66.70 67.53 1vov h VAL 118 Cb 0.39 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 1vov h VAL 118 CO -0.84 0.10 0.42 0.03 0.02 0.00 0.00 177.57 177.31 1vov h ARG 119 N 0.55 0.80 0.38 1.57 3.08 0.23 -0.82 114.38 120.17 1vov h ARG 119 Ca 0.19 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 1vov h ARG 119 Cb 0.03 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 29.87 1vov h ARG 119 CO -0.10 0.53 -0.52 0.82 -1.07 0.00 0.00 179.97 179.64 1vov h ILE 120 N 0.83 0.00 -0.00 2.04 2.04 0.17 -1.30 117.51 121.29 1vov h ILE 120 Ca 0.27 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.16 1vov h ILE 120 Cb 0.02 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.04 1vov h ILE 120 CO -0.11 0.00 -0.41 0.00 0.00 0.00 0.00 178.15 177.64 1vov h ALA 121 N -0.79 -0.64 0.00 1.87 0.00 -1.26 0.92 119.26 119.35 1vov h ALA 121 Ca -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1vov h ALA 121 Cb 0.84 0.72 0.00 0.00 0.00 0.00 0.00 17.79 19.35 1vov h ALA 121 CO -0.14 -0.94 0.00 0.72 0.00 0.00 0.00 179.25 178.89 1vov n HIS 122 N -5.45 0.00 0.00 0.00 8.25 -0.33 -2.47 115.22 115.23 1vov n HIS 122 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 1vov n HIS 122 Cb 0.37 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.47 1vov n HIS 122 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1vov n GLU 123 N -0.41 0.98 0.14 -0.41 4.07 0.22 -4.68 120.64 120.55 1vov n GLU 123 Ca 0.00 0.00 -0.15 0.00 -0.06 0.00 0.00 57.16 56.95 1vov n GLU 123 Cb 0.01 -0.70 -0.08 0.00 -0.06 0.00 0.00 31.44 30.61 1vov n GLU 123 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1vov h LEU 124 N 0.00 -1.25 -2.50 4.31 3.38 0.11 0.04 115.31 119.39 1vov h LEU 124 Ca 0.00 0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1vov h LEU 124 Cb 0.41 0.46 -0.00 0.00 0.09 0.00 0.00 40.66 41.62 1vov h LEU 124 CO 0.00 -0.51 -0.01 -0.03 0.09 0.00 0.00 178.44 177.98 1vov h MET 125 N -0.70 0.00 -1.33 1.13 4.05 -1.82 -2.38 114.93 113.89 1vov h MET 125 Ca 0.01 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 1vov h MET 125 Cb 0.70 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.50 1vov h MET 125 CO -0.22 0.01 0.00 -0.25 0.23 0.00 0.00 176.91 176.69 1vov n ASP 126 N -3.21 3.37 -2.69 1.39 9.92 -0.00 -3.92 116.55 121.41 1vov n ASP 126 Ca -0.02 -1.97 -0.20 0.00 -0.53 0.00 0.00 54.79 52.06 1vov n ASP 126 Cb 0.14 -0.62 -0.00 0.00 -0.64 0.00 0.00 41.12 40.00 1vov n ASP 126 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1vov n ALA 127 N 0.81 4.15 -1.04 2.24 0.00 -0.90 -4.59 120.51 121.19 1vov n ALA 127 Ca 0.00 -3.92 0.00 0.00 0.00 0.00 0.00 53.44 49.52 1vov n ALA 127 Cb 0.46 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 19.18 1vov n ALA 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vov n ALA 128 N -0.23 0.66 -0.46 0.00 0.00 -1.25 -4.83 120.51 114.39 1vov n ALA 128 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1vov n ALA 128 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.12 1vov n ALA 128 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1vov n GLU 129 N 0.00 0.00 0.00 0.00 -0.58 -1.26 -4.94 120.64 113.86 1vov n GLU 129 Ca 0.00 0.35 0.00 0.00 -0.42 0.00 0.00 57.16 57.09 1vov n GLU 129 Cb 0.00 -1.27 0.00 0.00 -0.57 0.00 0.00 31.44 29.60 1vov n GLU 129 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1vov n GLY 130 N -0.81 -1.75 3.11 0.62 0.00 -1.26 -5.02 105.19 100.08 1vov n GLY 130 Ca 0.00 0.56 -0.33 0.00 0.00 0.00 0.00 46.02 46.25 1vov n GLY 130 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vov s LYS 131 N 0.00 2.85 0.00 1.61 -2.85 -1.26 -4.70 119.74 115.39 1vov s LYS 131 Ca 0.00 -0.93 0.00 0.00 -1.00 0.00 0.00 55.97 54.04 1vov s LYS 131 Cb 0.00 -2.64 0.00 0.00 -2.06 0.00 0.00 37.83 33.13 1vov s LYS 131 CO 0.00 -0.28 0.00 0.41 0.10 0.00 0.00 175.35 175.58 1vov n GLY 132 N 4.59 0.24 0.00 0.59 0.00 -1.26 -4.74 105.19 104.60 1vov n GLY 132 Ca -0.20 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1vov n GLY 132 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vov n GLY 133 N 0.00 -0.01 0.00 -0.02 0.00 -1.26 -4.52 105.19 99.38 1vov n GLY 133 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1vov n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vov n ALA 134 N -1.69 0.00 -0.23 4.61 0.00 -1.26 -1.40 120.51 120.53 1vov n ALA 134 Ca -0.00 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.64 1vov n ALA 134 Cb 0.19 0.00 0.53 0.00 0.00 0.00 0.00 19.45 20.17 1vov n ALA 134 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1vov h VAL 135 N 0.00 0.67 0.00 0.00 2.07 -1.86 0.42 116.25 117.54 1vov h VAL 135 Ca 0.00 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1vov h VAL 135 Cb 0.00 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 1vov h VAL 135 CO 0.00 0.07 0.00 1.17 0.02 0.00 0.00 177.57 178.83 1vov n LYS 136 N -4.49 0.00 0.01 1.57 0.00 -1.24 -0.35 118.16 113.65 1vov n LYS 136 Ca 0.19 0.47 0.14 0.00 0.00 0.00 0.00 58.31 59.11 1vov n LYS 136 Cb 0.72 -1.30 0.59 0.00 0.00 0.00 0.00 35.03 35.03 1vov n LYS 136 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 1vov h LYS 137 N 0.00 0.19 -0.07 1.64 1.57 -0.85 -2.06 116.57 117.00 1vov h LYS 137 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1vov h LYS 137 Cb 0.00 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.26 1vov h LYS 137 CO 0.00 0.13 0.04 -0.22 -0.57 0.00 0.00 179.45 178.83 1vov h LYS 138 N 0.20 0.09 0.00 3.15 3.11 0.18 -2.20 116.57 121.10 1vov h LYS 138 Ca 0.22 -0.01 -0.06 0.00 -2.81 0.00 0.00 60.65 58.00 1vov h LYS 138 Cb 0.60 -0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.81 1vov h LYS 138 CO -0.04 0.06 -0.27 0.93 -2.81 0.00 0.00 179.45 177.32 1vov h GLU 139 N 0.09 0.00 -0.01 1.90 5.08 0.01 -2.74 114.58 118.91 1vov h GLU 139 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1vov h GLU 139 Cb -0.01 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 1vov h GLU 139 CO -0.01 0.27 0.00 -0.44 -1.00 0.00 0.00 179.01 177.84 1vov h ASP 140 N 0.00 0.01 -0.38 1.42 3.32 -1.05 -1.25 116.42 118.49 1vov h ASP 140 Ca -0.00 -0.01 0.11 0.00 0.02 0.00 0.00 57.03 57.15 1vov h ASP 140 Cb 0.49 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.02 1vov h ASP 140 CO 0.04 0.02 0.31 0.58 -1.72 0.00 0.00 179.24 178.46 1vov h VAL 141 N -0.00 0.64 -0.07 -1.35 2.07 -1.11 0.21 116.25 116.64 1vov h VAL 141 Ca 0.00 0.00 -0.16 0.00 0.82 0.00 0.00 66.70 67.36 1vov h VAL 141 Cb 0.01 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 1vov h VAL 141 CO -0.00 0.00 -0.65 -0.33 0.02 0.00 0.00 177.57 176.61 1vov h GLU 142 N 0.00 0.28 0.00 1.57 5.08 -1.13 -2.31 114.58 118.07 1vov h GLU 142 Ca 0.18 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1vov h GLU 142 Cb 0.79 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.08 1vov h GLU 142 CO -0.00 0.84 0.00 0.54 -1.00 0.00 0.00 179.01 179.39 1vov n ARG 143 N -3.85 0.14 -1.07 2.33 1.74 0.74 -3.14 116.66 113.55 1vov n ARG 143 Ca -0.03 0.45 -0.18 0.00 -0.77 0.00 0.00 57.85 57.32 1vov n ARG 143 Cb 0.65 -1.81 -0.14 0.00 -1.02 0.00 0.00 32.46 30.15 1vov n ARG 143 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1vov n MET 144 N -2.07 2.39 0.00 5.56 2.81 -0.87 -4.59 117.12 120.35 1vov n MET 144 Ca 0.01 -1.27 0.00 0.00 -1.81 0.00 0.00 57.70 54.63 1vov n MET 144 Cb 0.16 -2.18 0.00 0.00 -0.71 0.00 0.00 33.22 30.49 1vov n MET 144 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1vov n ALA 145 N 2.75 0.00 -0.96 3.04 0.00 -1.19 -4.74 120.51 119.42 1vov n ALA 145 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1vov n ALA 145 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.21 1vov n ALA 145 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1vov n GLU 146 N 0.00 0.00 -0.11 0.00 -0.58 -1.26 -1.45 120.64 117.24 1vov n GLU 146 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1vov n GLU 146 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1vov n GLU 146 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1vov n ALA 147 N 7.75 2.75 0.00 0.62 0.00 -1.26 -0.71 120.51 129.66 1vov n ALA 147 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1vov n ALA 147 Cb 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1vov n ALA 147 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1vov n ASN 148 N 0.77 0.00 0.22 0.00 3.02 -0.53 -4.88 115.26 113.86 1vov n ASN 148 Ca 0.00 0.00 0.14 0.00 -0.03 0.00 0.00 54.58 54.69 1vov n ASN 148 Cb 0.46 0.00 0.76 0.00 -0.61 0.00 0.00 39.78 40.39 1vov n ASN 148 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 1vov h ARG 149 N 0.00 0.00 0.00 3.52 2.43 -1.01 -0.26 114.38 119.06 1vov h ARG 149 Ca 0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1vov h ARG 149 Cb 0.00 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1vov h ARG 149 CO 0.00 0.00 -0.08 0.00 -1.51 0.00 0.00 179.97 178.38 1vov h ALA 150 N 1.95 0.98 0.00 2.80 0.00 -1.90 -3.27 119.26 119.83 1vov h ALA 150 Ca 0.00 -0.07 -0.69 0.00 0.00 0.00 0.00 54.91 54.15 1vov h ALA 150 Cb 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1vov h ALA 150 CO 0.00 0.10 3.36 0.66 0.00 0.00 0.00 179.25 183.37 1vov n TYR 151 N -3.17 3.08 0.10 0.00 0.53 -0.11 -3.94 117.16 113.65 1vov n TYR 151 Ca 0.01 -2.98 0.00 0.00 -1.02 0.00 0.00 57.90 53.92 1vov n TYR 151 Cb 0.42 -2.50 0.00 0.00 -1.03 0.00 0.00 39.34 36.23 1vov n TYR 151 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1vov n ALA 152 N 5.25 3.00 -0.25 -0.72 0.00 -1.23 -4.28 120.51 122.27 1vov n ALA 152 Ca 0.61 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 54.00 1vov n ALA 152 Cb 0.33 0.09 0.05 0.00 0.00 0.00 0.00 19.45 19.92 1vov n ALA 152 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1vov h HIS 153 N 0.00 0.91 -2.27 0.00 2.07 -1.86 -3.35 115.15 110.65 1vov h HIS 153 Ca 0.00 -0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 56.99 1vov h HIS 153 Cb 0.00 -0.30 -0.03 0.00 2.57 0.00 0.00 27.41 29.65 1vov h HIS 153 CO 0.00 0.62 1.32 0.71 -3.07 0.00 0.00 177.93 177.51 1vov s TYR 154 N -5.98 1.73 -0.05 6.12 4.12 -1.26 -4.75 117.35 117.28 1vov s TYR 154 Ca -0.13 0.76 0.06 0.00 0.02 0.00 0.00 57.07 57.77 1vov s TYR 154 Cb 0.14 -4.09 -0.08 0.00 -1.52 0.00 0.00 41.96 36.41 1vov s TYR 154 CO 0.78 -2.51 0.04 0.54 0.02 0.00 0.00 175.55 174.43 1vov n ARG 155 N 8.87 2.47 -0.52 -0.62 1.74 -1.26 -4.90 116.66 122.44 1vov n ARG 155 Ca 0.22 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 1vov n ARG 155 Cb 0.50 -1.15 0.00 0.00 -1.02 0.00 0.00 32.46 30.79 1vov n ARG 155 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02