#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vfb s VAL 2 N 0.00 5.03 -0.03 -0.39 1.01 -1.26 -3.67 120.40 121.09 1vfb s VAL 2 Ca 0.00 1.36 0.04 0.00 0.00 0.00 0.00 61.98 63.38 1vfb s VAL 2 Cb 0.00 -4.01 -0.00 0.00 0.00 0.00 0.00 36.38 32.37 1vfb s VAL 2 CO 0.00 0.19 -0.13 -1.10 0.00 0.00 0.00 175.10 174.07 1vfb s GLN 3 N 1.24 1.23 -0.03 2.72 -1.52 -0.08 -4.99 119.66 118.24 1vfb s GLN 3 Ca 0.34 -0.45 0.03 0.00 -1.95 0.00 0.00 55.36 53.34 1vfb s GLN 3 Cb -0.17 -1.14 0.00 0.00 -0.22 0.00 0.00 33.01 31.49 1vfb s GLN 3 CO 0.15 0.21 -0.12 -0.51 -0.25 0.00 0.00 175.29 174.77 1vfb s LEU 4 N -0.02 1.82 -0.04 2.90 1.02 -1.26 -1.15 118.68 121.94 1vfb s LEU 4 Ca -0.00 -0.25 -0.01 0.00 0.02 0.00 0.00 54.13 53.88 1vfb s LEU 4 Cb -0.08 -0.71 0.03 0.00 0.02 0.00 0.00 46.19 45.45 1vfb s LEU 4 CO 0.01 0.09 0.03 -1.10 0.02 0.00 0.00 176.35 175.40 1vfb s GLN 5 N 0.17 0.14 0.18 1.70 -0.21 -0.49 -4.16 119.66 116.98 1vfb s GLN 5 Ca -0.04 0.25 -0.10 0.00 0.02 0.00 0.00 55.36 55.49 1vfb s GLN 5 Cb -0.10 -0.58 -0.07 0.00 1.00 0.00 0.00 33.01 33.26 1vfb s GLN 5 CO 0.01 -0.27 0.51 -1.21 -2.12 0.00 0.00 175.29 172.21 1vfb s GLU 6 N 1.82 3.82 -0.01 2.91 8.01 -1.26 -0.76 118.70 133.23 1vfb s GLU 6 Ca 0.01 0.27 -0.00 0.00 0.01 0.00 0.00 54.97 55.26 1vfb s GLU 6 Cb -0.12 -2.78 0.02 0.00 -4.31 0.00 0.00 34.13 26.93 1vfb s GLU 6 CO -0.03 0.40 0.03 -1.12 0.01 0.00 0.00 175.26 174.55 1vfb s SER 7 N -2.14 0.02 0.35 -0.19 0.01 0.12 -4.83 113.70 107.04 1vfb s SER 7 Ca 0.42 0.05 -0.05 0.00 1.31 0.00 0.00 55.95 57.68 1vfb s SER 7 Cb -0.13 -0.01 0.02 0.00 0.21 0.00 0.00 66.02 66.12 1vfb s SER 7 CO 0.21 -0.07 0.56 0.61 0.41 0.00 0.00 173.24 174.95 1vfb n GLY 8 N 3.62 1.81 0.18 3.44 0.00 -1.26 -0.94 105.19 112.04 1vfb n GLY 8 Ca -0.20 -1.50 0.13 0.00 0.00 0.00 0.00 46.02 44.45 1vfb n GLY 8 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vfb h PRO 9 N 0.00 0.00 0.00 1.61 0.13 -1.91 -3.48 132.00 128.35 1vfb h PRO 9 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1vfb h PRO 9 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1vfb h PRO 9 CO 0.37 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.55 1vfb n GLY 10 N 0.74 1.63 2.89 1.56 0.00 -1.26 -4.83 105.19 105.91 1vfb n GLY 10 Ca 0.03 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.84 1vfb n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1vfb s LEU 11 N 0.00 1.79 -0.00 0.99 2.96 -1.26 -0.89 118.68 122.27 1vfb s LEU 11 Ca 0.00 -0.04 -0.08 0.00 -0.22 0.00 0.00 54.13 53.79 1vfb s LEU 11 Cb 0.00 -0.14 0.00 0.00 0.50 0.00 0.00 46.19 46.55 1vfb s LEU 11 CO 0.00 -0.00 0.16 0.68 -1.32 0.00 0.00 176.35 175.86 1vfb s VAL 12 N 0.21 0.08 0.22 1.68 -7.23 -0.73 -4.96 120.40 109.66 1vfb s VAL 12 Ca -0.02 -0.64 -0.07 0.00 -1.81 0.00 0.00 61.98 59.44 1vfb s VAL 12 Cb -0.04 -0.44 -0.06 0.00 0.56 0.00 0.00 36.38 36.39 1vfb s VAL 12 CO -0.01 -0.35 0.49 0.00 -0.31 0.00 0.00 175.10 174.93 1vfb s ALA 13 N -1.31 3.65 0.61 1.32 0.00 -1.26 -0.92 121.76 123.85 1vfb s ALA 13 Ca -0.14 -0.43 0.25 0.00 0.00 0.00 0.00 51.96 51.64 1vfb s ALA 13 Cb -0.07 -2.30 1.02 0.00 0.00 0.00 0.00 23.12 21.76 1vfb s ALA 13 CO 0.02 0.50 1.46 -1.35 0.00 0.00 0.00 175.76 176.39 1vfb h PRO 14 N 2.44 0.00 0.00 0.00 0.11 -1.79 -0.36 132.00 132.39 1vfb h PRO 14 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1vfb h PRO 14 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1vfb h PRO 14 CO 0.70 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.92 1vfb n SER 15 N -3.27 0.00 -4.82 -2.05 7.64 -1.26 -4.22 113.62 105.64 1vfb n SER 15 Ca 0.16 0.02 -0.22 0.00 1.01 0.00 0.00 58.87 59.84 1vfb n SER 15 Cb 1.21 -0.32 -0.04 0.00 -1.01 0.00 0.00 64.21 64.04 1vfb n SER 15 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1vfb s GLN 16 N -2.64 2.78 -0.10 1.43 -0.21 -0.15 -5.08 119.66 115.69 1vfb s GLN 16 Ca 0.21 -1.20 -0.06 0.00 0.02 0.00 0.00 55.36 54.33 1vfb s GLN 16 Cb 0.16 -2.49 -0.04 0.00 1.00 0.00 0.00 33.01 31.65 1vfb s GLN 16 CO 0.38 0.25 0.13 -1.12 -2.12 0.00 0.00 175.29 172.82 1vfb s SER 17 N -3.90 6.29 -0.01 5.90 0.01 -1.26 -4.53 113.70 116.21 1vfb s SER 17 Ca 0.36 0.42 -0.21 0.00 1.31 0.00 0.00 55.95 57.84 1vfb s SER 17 Cb -0.07 -2.01 -0.05 0.00 0.21 0.00 0.00 66.02 64.10 1vfb s SER 17 CO 0.25 0.39 0.61 -0.22 0.41 0.00 0.00 173.24 174.68 1vfb s LEU 18 N -1.16 4.41 -0.07 2.44 2.96 0.11 -4.94 118.68 122.44 1vfb s LEU 18 Ca 0.17 1.18 0.02 0.00 -0.22 0.00 0.00 54.13 55.28 1vfb s LEU 18 Cb -0.12 -2.95 0.01 0.00 0.50 0.00 0.00 46.19 43.63 1vfb s LEU 18 CO 0.06 0.08 -0.13 -0.55 -1.32 0.00 0.00 176.35 174.49 1vfb s SER 19 N -0.11 1.87 -0.00 3.68 0.15 -1.26 -0.69 113.70 117.35 1vfb s SER 19 Ca 0.32 -0.32 0.06 0.00 0.70 0.00 0.00 55.95 56.72 1vfb s SER 19 Cb -0.18 -0.86 -0.02 0.00 -1.71 0.00 0.00 66.02 63.25 1vfb s SER 19 CO 0.18 0.03 -0.20 -0.63 1.20 0.00 0.00 173.24 173.82 1vfb s ILE 20 N 0.70 1.58 -0.07 6.45 1.01 -0.21 -4.45 121.20 126.21 1vfb s ILE 20 Ca -0.14 -0.93 -0.01 0.00 0.00 0.00 0.00 60.65 59.58 1vfb s ILE 20 Cb -0.16 -1.33 -0.03 0.00 0.01 0.00 0.00 42.46 40.95 1vfb s ILE 20 CO 0.03 0.38 -0.02 -0.89 0.00 0.00 0.00 174.94 174.45 1vfb s THR 21 N -0.55 4.14 -0.25 2.92 2.01 -0.12 -1.71 115.64 122.07 1vfb s THR 21 Ca 0.08 -0.36 -0.01 0.00 0.31 0.00 0.00 61.69 61.71 1vfb s THR 21 Cb -0.08 -2.74 0.03 0.00 0.01 0.00 0.00 72.50 69.72 1vfb s THR 21 CO -0.00 0.57 -0.07 0.00 -0.69 0.00 0.00 174.62 174.43 1vfb s THR 23 N 1.28 4.90 0.27 0.00 2.01 0.06 -1.31 115.64 122.86 1vfb s THR 23 Ca -0.02 0.02 0.09 0.00 0.31 0.00 0.00 61.69 62.09 1vfb s THR 23 Cb -0.17 -3.25 -0.04 0.00 0.01 0.00 0.00 72.50 69.04 1vfb s THR 23 CO -0.04 0.40 0.03 0.68 -0.69 0.00 0.00 174.62 175.00 1vfb s VAL 24 N 0.78 3.52 0.04 3.82 -7.23 -0.45 -1.40 120.40 119.47 1vfb s VAL 24 Ca 0.05 -1.84 -0.19 0.00 -1.81 0.00 0.00 61.98 58.19 1vfb s VAL 24 Cb -0.13 -2.92 0.04 0.00 0.56 0.00 0.00 36.38 33.93 1vfb s VAL 24 CO 0.02 -0.36 0.43 -0.94 -0.31 0.00 0.00 175.10 173.95 1vfb s SER 25 N -3.71 -0.32 0.00 4.85 1.04 -0.30 -4.88 113.70 110.38 1vfb s SER 25 Ca 0.32 0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.82 1vfb s SER 25 Cb -0.06 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.49 1vfb s SER 25 CO 0.21 -0.65 0.00 0.61 0.98 0.00 0.00 173.24 174.38 1vfb n GLY 26 N 0.57 0.65 3.40 7.32 0.00 -1.24 -0.90 105.19 114.99 1vfb n GLY 26 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 1vfb n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1vfb s PHE 27 N -2.36 -0.20 0.07 1.61 -0.71 -1.26 -4.66 117.98 110.47 1vfb s PHE 27 Ca 0.00 -0.11 -0.15 0.00 -1.04 0.00 0.00 56.93 55.63 1vfb s PHE 27 Cb 0.00 0.34 -0.06 0.00 -1.21 0.00 0.00 43.02 42.08 1vfb s PHE 27 CO 0.00 -0.80 0.48 0.45 -1.34 0.00 0.00 175.22 174.01 1vfb s SER 28 N -2.83 6.84 0.15 1.98 0.15 -1.26 -4.98 113.70 113.76 1vfb s SER 28 Ca 0.05 1.03 0.23 0.00 0.70 0.00 0.00 55.95 57.96 1vfb s SER 28 Cb 0.01 -2.27 0.90 0.00 -1.71 0.00 0.00 66.02 62.95 1vfb s SER 28 CO -0.09 0.23 1.71 0.18 1.20 0.00 0.00 173.24 176.47 1vfb n LEU 29 N 1.36 0.47 0.17 3.45 4.77 -1.26 -2.47 117.00 123.49 1vfb n LEU 29 Ca -0.10 0.58 0.04 0.00 -0.03 0.00 0.00 56.01 56.50 1vfb n LEU 29 Cb 0.52 -0.48 0.23 0.00 -2.33 0.00 0.00 43.42 41.35 1vfb n LEU 29 CO 0.40 -0.31 0.59 0.71 -1.33 0.00 0.00 177.39 177.45 1vfb h THR 30 N 0.00 0.93 -0.02 -5.08 1.35 -1.94 -3.30 112.91 104.85 1vfb h THR 30 Ca 0.00 -1.82 0.00 0.00 -0.55 0.00 0.00 66.41 64.04 1vfb h THR 30 Cb 0.46 2.12 0.00 0.00 -1.73 0.00 0.00 68.15 69.00 1vfb h THR 30 CO 0.00 0.44 -0.24 0.61 -0.25 0.00 0.00 175.52 176.08 1vfb n GLY 31 N 0.57 0.20 3.08 5.82 0.00 -1.03 -4.37 105.19 109.46 1vfb n GLY 31 Ca 0.00 -0.59 -0.09 0.00 0.00 0.00 0.00 46.02 45.34 1vfb n GLY 31 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vfb s TYR 32 N -2.28 0.25 0.37 1.61 1.51 -1.23 -4.91 117.35 112.67 1vfb s TYR 32 Ca 0.25 -0.57 -0.01 0.00 -1.01 0.00 0.00 57.07 55.73 1vfb s TYR 32 Cb 0.19 -0.18 -0.03 0.00 -0.11 0.00 0.00 41.96 41.82 1vfb s TYR 32 CO 0.45 -0.32 0.59 0.20 -1.11 0.00 0.00 175.55 175.37 1vfb s GLY 33 N -2.04 1.41 -0.08 0.71 0.00 -1.10 -3.18 107.32 103.04 1vfb s GLY 33 Ca -0.06 -0.80 0.03 0.00 0.00 0.00 0.00 44.72 43.88 1vfb s GLY 33 CO -0.04 -0.72 -0.16 0.14 0.00 0.00 0.00 173.10 172.32 1vfb s VAL 34 N -2.38 1.41 0.21 1.40 1.01 -0.20 -0.62 120.40 121.23 1vfb s VAL 34 Ca 0.42 -0.64 0.07 0.00 0.00 0.00 0.00 61.98 61.83 1vfb s VAL 34 Cb -0.10 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 1vfb s VAL 34 CO 0.37 0.42 0.12 0.20 0.00 0.00 0.00 175.10 176.21 1vfb s ASN 35 N 0.60 5.26 -0.07 3.32 0.02 -0.13 -1.79 114.94 122.15 1vfb s ASN 35 Ca -0.15 -0.29 0.04 0.00 -1.02 0.00 0.00 52.86 51.44 1vfb s ASN 35 Cb -0.16 -1.28 0.00 0.00 0.02 0.00 0.00 41.25 39.83 1vfb s ASN 35 CO 0.05 0.02 -0.19 0.26 0.02 0.00 0.00 177.10 177.26 1vfb s TRP 36 N -1.97 2.01 -0.01 2.20 0.52 -0.40 -1.38 118.94 119.92 1vfb s TRP 36 Ca 0.31 -0.70 0.02 0.00 0.02 0.00 0.00 56.10 55.75 1vfb s TRP 36 Cb -0.09 -1.36 -0.00 0.00 -1.15 0.00 0.00 33.47 30.87 1vfb s TRP 36 CO 0.23 -0.27 -0.06 0.08 0.02 0.00 0.00 176.95 176.95 1vfb s VAL 37 N 0.24 0.44 0.28 4.03 1.01 -0.24 -1.11 120.40 125.05 1vfb s VAL 37 Ca -0.11 -0.23 0.08 0.00 0.00 0.00 0.00 61.98 61.72 1vfb s VAL 37 Cb -0.15 -0.38 -0.06 0.00 0.00 0.00 0.00 36.38 35.80 1vfb s VAL 37 CO 0.05 0.13 -0.09 0.00 0.00 0.00 0.00 175.10 175.19 1vfb s ARG 38 N -0.09 1.57 -0.21 2.72 1.70 -0.09 -0.26 118.95 124.29 1vfb s ARG 38 Ca 0.02 -1.78 -0.05 0.00 -0.47 0.00 0.00 55.73 53.45 1vfb s ARG 38 Cb -0.03 -1.29 0.07 0.00 -0.57 0.00 0.00 34.95 33.13 1vfb s ARG 38 CO -0.00 0.10 0.10 -1.14 -1.08 0.00 0.00 175.30 173.28 1vfb s GLN 39 N -3.68 0.12 0.77 3.89 0.74 0.31 -0.67 119.66 121.14 1vfb s GLN 39 Ca 0.29 -0.23 -0.14 0.00 0.05 0.00 0.00 55.36 55.33 1vfb s GLN 39 Cb 0.02 -1.64 0.06 0.00 1.10 0.00 0.00 33.01 32.55 1vfb s GLN 39 CO 0.12 -0.78 1.19 -2.14 -0.55 0.00 0.00 175.29 173.14 1vfb s PRO 40 N 2.11 1.89 -0.23 1.67 0.02 -1.26 -1.45 135.00 137.75 1vfb s PRO 40 Ca 0.04 1.69 -0.39 0.00 0.02 0.00 0.00 61.00 62.36 1vfb s PRO 40 Cb -0.16 -1.81 -0.15 0.00 0.02 0.00 0.00 34.50 32.40 1vfb s PRO 40 CO -0.17 -2.01 1.75 -2.30 -0.33 0.00 0.00 177.00 173.93 1vfb n PRO 41 N -3.10 1.34 -2.40 5.54 -0.02 -1.26 -0.72 135.00 134.38 1vfb n PRO 41 Ca 0.13 0.49 -0.18 0.00 -2.02 0.00 0.00 63.50 61.92 1vfb n PRO 41 Cb 0.51 -2.20 -0.01 0.00 -0.02 0.00 0.00 33.50 31.77 1vfb n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vfb n GLY 42 N 4.16 -0.46 3.31 -1.23 0.00 -1.26 -4.97 105.19 104.73 1vfb n GLY 42 Ca 0.25 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 1vfb n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1vfb n LYS 43 N -2.93 0.88 -2.39 1.61 4.01 0.10 -5.16 118.16 114.28 1vfb n LYS 43 Ca -0.21 -3.34 -0.24 0.00 -0.51 0.00 0.00 58.31 54.00 1vfb n LYS 43 Cb 0.66 0.86 0.14 0.00 -0.51 0.00 0.00 35.03 36.18 1vfb n LYS 43 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1vfb n GLY 44 N -0.53 0.11 3.80 0.72 0.00 -1.26 -4.66 105.19 103.37 1vfb n GLY 44 Ca -0.18 -1.95 -0.35 0.00 0.00 0.00 0.00 46.02 43.54 1vfb n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vfb s LEU 45 N 0.00 4.19 -0.08 0.99 1.43 -1.26 -4.25 118.68 119.70 1vfb s LEU 45 Ca 0.68 1.71 0.01 0.00 -1.03 0.00 0.00 54.13 55.50 1vfb s LEU 45 Cb -0.03 -4.15 0.02 0.00 0.03 0.00 0.00 46.19 42.05 1vfb s LEU 45 CO 0.46 -0.16 -0.08 -0.70 0.23 0.00 0.00 176.35 176.09 1vfb s GLU 46 N -2.48 1.39 0.05 1.70 2.12 0.15 -4.99 118.70 116.65 1vfb s GLU 46 Ca 0.54 -0.26 -0.30 0.00 0.36 0.00 0.00 54.97 55.31 1vfb s GLU 46 Cb -0.15 -1.33 -0.05 0.00 0.26 0.00 0.00 34.13 32.87 1vfb s GLU 46 CO 0.19 -0.13 1.02 -0.46 -0.54 0.00 0.00 175.26 175.35 1vfb s TRP 47 N 1.19 3.65 -0.21 5.30 -0.00 -1.26 -0.92 118.94 126.70 1vfb s TRP 47 Ca -0.05 1.65 0.06 0.00 -0.00 0.00 0.00 56.10 57.75 1vfb s TRP 47 Cb -0.14 -3.17 -0.17 0.00 -0.00 0.00 0.00 33.47 29.99 1vfb s TRP 47 CO -0.02 -0.23 -0.12 1.28 -0.00 0.00 0.00 176.95 177.86 1vfb n LEU 48 N 3.50 2.08 0.00 5.86 4.77 -0.27 -4.64 117.00 128.29 1vfb n LEU 48 Ca 0.05 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1vfb n LEU 48 Cb 0.49 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1vfb n LEU 48 CO 0.53 0.74 0.00 0.61 -1.33 0.00 0.00 177.39 177.93 1vfb n GLY 49 N 2.29 -2.20 3.61 -0.72 0.00 -1.19 -1.21 105.19 105.78 1vfb n GLY 49 Ca -0.36 -1.32 -0.09 0.00 0.00 0.00 0.00 46.02 44.25 1vfb n GLY 49 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1vfb s MET 50 N -1.97 1.50 -0.06 1.61 0.23 -0.12 -1.27 119.30 119.22 1vfb s MET 50 Ca 0.00 -0.92 -0.00 0.00 -1.03 0.00 0.00 55.69 53.74 1vfb s MET 50 Cb 0.00 0.54 0.03 0.00 -1.53 0.00 0.00 34.83 33.87 1vfb s MET 50 CO 0.00 -0.65 -0.01 -1.50 -2.03 0.00 0.00 175.02 170.83 1vfb s ILE 51 N -3.89 0.37 0.82 3.16 2.07 -0.74 -2.07 121.20 120.91 1vfb s ILE 51 Ca 0.11 0.06 -0.11 0.00 -1.41 0.00 0.00 60.65 59.29 1vfb s ILE 51 Cb -0.02 -0.48 0.08 0.00 0.13 0.00 0.00 42.46 42.17 1vfb s ILE 51 CO 0.00 0.23 1.10 0.26 -1.91 0.00 0.00 174.94 174.62 1vfb s TRP 52 N 1.52 2.70 0.36 3.50 0.52 -0.18 -1.04 118.94 126.32 1vfb s TRP 52 Ca -0.02 1.18 0.09 0.00 0.02 0.00 0.00 56.10 57.37 1vfb s TRP 52 Cb -0.13 -3.13 0.83 0.00 -1.15 0.00 0.00 33.47 29.88 1vfb s TRP 52 CO -0.03 -1.93 1.86 0.78 0.02 0.00 0.00 176.95 177.66 1vfb h GLY 53 N -1.20 1.21 0.86 0.98 0.00 -1.74 0.24 103.07 103.42 1vfb h GLY 53 Ca -0.48 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 46.56 1vfb h GLY 53 CO 0.58 0.08 0.00 2.09 0.00 0.00 0.00 176.54 179.29 1vfb n ASP 54 N -4.57 0.00 0.00 0.19 5.68 -1.26 -4.44 116.55 112.16 1vfb n ASP 54 Ca 0.18 -1.13 0.00 0.00 -0.50 0.00 0.00 54.79 53.34 1vfb n ASP 54 Cb 0.48 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.46 1vfb n ASP 54 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1vfb n GLY 55 N 0.90 1.04 3.77 6.12 0.00 0.07 -5.05 105.19 112.04 1vfb n GLY 55 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 1vfb n GLY 55 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vfb s ASN 56 N -2.35 6.05 0.17 1.61 -0.87 -1.26 -4.76 114.94 113.52 1vfb s ASN 56 Ca 0.00 2.31 0.11 0.00 -1.57 0.00 0.00 52.86 53.71 1vfb s ASN 56 Cb 0.00 -2.60 -0.04 0.00 -0.02 0.00 0.00 41.25 38.59 1vfb s ASN 56 CO 0.00 -1.00 -0.25 0.42 -2.57 0.00 0.00 177.10 173.70 1vfb s THR 57 N -1.57 2.32 -0.02 1.60 -4.23 -1.26 -1.01 115.64 111.47 1vfb s THR 57 Ca 0.66 -1.92 -0.03 0.00 -1.18 0.00 0.00 61.69 59.22 1vfb s THR 57 Cb -0.28 -2.08 0.00 0.00 1.34 0.00 0.00 72.50 71.48 1vfb s THR 57 CO 0.34 -0.03 0.06 -1.81 -0.54 0.00 0.00 174.62 172.64 1vfb s ASP 58 N -2.42 -0.03 0.12 3.99 1.01 -0.88 -5.00 116.67 113.46 1vfb s ASP 58 Ca 0.18 0.03 0.05 0.00 0.71 0.00 0.00 52.55 53.52 1vfb s ASP 58 Cb -0.09 0.14 -0.04 0.00 1.01 0.00 0.00 42.92 43.95 1vfb s ASP 58 CO 0.08 -0.09 -0.13 -0.31 0.21 0.00 0.00 175.17 174.94 1vfb s TYR 59 N -0.27 1.31 0.20 4.23 2.02 -1.26 -0.94 117.35 122.63 1vfb s TYR 59 Ca -0.03 -0.59 -0.32 0.00 -0.37 0.00 0.00 57.07 55.75 1vfb s TYR 59 Cb -0.02 -0.69 -0.13 0.00 -0.40 0.00 0.00 41.96 40.72 1vfb s TYR 59 CO 0.00 0.11 1.53 -1.71 -1.57 0.00 0.00 175.55 173.91 1vfb n ASN 60 N 0.48 3.11 -0.22 2.29 2.85 -0.35 -4.87 115.26 118.55 1vfb n ASN 60 Ca -0.15 1.11 -0.01 0.00 -0.11 0.00 0.00 54.58 55.42 1vfb n ASN 60 Cb 0.57 -1.45 0.11 0.00 1.24 0.00 0.00 39.78 40.25 1vfb n ASN 60 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 1vfb h SER 61 N 5.30 0.44 0.98 1.20 0.02 -1.93 -1.06 113.55 118.48 1vfb h SER 61 Ca -0.45 0.05 -0.11 0.00 -0.84 0.00 0.00 61.79 60.44 1vfb h SER 61 Cb 1.25 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.75 1vfb h SER 61 CO 0.84 0.27 -0.53 0.00 -1.14 0.00 0.00 176.83 176.27 1vfb h ALA 62 N 1.38 0.83 -0.01 3.77 0.00 -1.99 -3.28 119.26 119.95 1vfb h ALA 62 Ca 0.31 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1vfb h ALA 62 Cb 0.28 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1vfb h ALA 62 CO -0.23 0.66 -0.29 1.28 0.00 0.00 0.00 179.25 180.67 1vfb n LEU 63 N -3.48 1.78 -0.33 0.00 4.32 -0.98 -4.65 117.00 113.67 1vfb n LEU 63 Ca 0.00 -0.80 0.20 0.00 -0.02 0.00 0.00 56.01 55.39 1vfb n LEU 63 Cb 0.64 0.00 0.45 0.00 -1.62 0.00 0.00 43.42 42.89 1vfb n LEU 63 CO 0.40 0.33 1.20 0.50 -1.22 0.00 0.00 177.39 178.60 1vfb h LYS 64 N 2.09 0.48 0.00 3.23 3.64 -1.27 -1.31 116.57 123.42 1vfb h LYS 64 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1vfb h LYS 64 Cb 0.59 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 1vfb h LYS 64 CO 0.00 0.32 0.00 0.66 -2.27 0.00 0.00 179.45 178.16 1vfb h SER 65 N 0.50 0.00 -0.00 4.20 4.64 -1.86 -3.04 113.55 117.98 1vfb h SER 65 Ca 0.60 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.92 1vfb h SER 65 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1vfb h SER 65 CO -0.35 0.00 -0.55 0.54 -0.87 0.00 0.00 176.83 175.60 1vfb n ARG 66 N -2.48 2.57 -4.24 4.77 1.74 -0.51 -5.00 116.66 113.51 1vfb n ARG 66 Ca 0.02 -0.13 -0.29 0.00 -0.77 0.00 0.00 57.85 56.67 1vfb n ARG 66 Cb 0.26 -1.13 -0.10 0.00 -1.02 0.00 0.00 32.46 30.47 1vfb n ARG 66 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1vfb s LEU 67 N -2.47 2.97 -0.19 0.55 1.43 -1.13 -1.54 118.68 118.30 1vfb s LEU 67 Ca 0.06 -0.44 -0.08 0.00 -1.03 0.00 0.00 54.13 52.65 1vfb s LEU 67 Cb 0.10 -1.77 0.08 0.00 0.03 0.00 0.00 46.19 44.63 1vfb s LEU 67 CO 0.50 0.17 0.41 -0.55 0.23 0.00 0.00 176.35 177.11 1vfb s SER 68 N -2.24 -0.31 -0.06 2.29 0.15 -0.46 -4.93 113.70 108.13 1vfb s SER 68 Ca 0.21 0.95 0.04 0.00 0.70 0.00 0.00 55.95 57.84 1vfb s SER 68 Cb -0.11 1.14 -0.02 0.00 -1.71 0.00 0.00 66.02 65.32 1vfb s SER 68 CO 0.13 -0.22 -0.16 -0.63 1.20 0.00 0.00 173.24 173.56 1vfb s ILE 69 N 2.22 2.90 0.26 6.45 1.01 -1.26 -0.31 121.20 132.47 1vfb s ILE 69 Ca -0.04 -0.77 -0.05 0.00 0.00 0.00 0.00 60.65 59.79 1vfb s ILE 69 Cb -0.11 -2.14 -0.02 0.00 0.01 0.00 0.00 42.46 40.21 1vfb s ILE 69 CO -0.13 0.58 0.35 -0.94 0.00 0.00 0.00 174.94 174.80 1vfb s SER 70 N -0.50 0.34 0.06 3.58 1.04 -0.76 -4.98 113.70 112.48 1vfb s SER 70 Ca 0.07 -1.27 -0.11 0.00 0.48 0.00 0.00 55.95 55.12 1vfb s SER 70 Cb -0.12 0.53 0.01 0.00 0.10 0.00 0.00 66.02 66.54 1vfb s SER 70 CO 0.01 -1.07 0.24 -1.59 0.98 0.00 0.00 173.24 171.81 1vfb s LYS 71 N -3.81 0.79 -0.30 4.02 -2.85 -1.26 -0.56 119.74 115.78 1vfb s LYS 71 Ca 0.31 -0.69 0.03 0.00 -1.00 0.00 0.00 55.97 54.62 1vfb s LYS 71 Cb 0.02 0.33 0.08 0.00 -2.06 0.00 0.00 37.83 36.20 1vfb s LYS 71 CO 0.14 -0.25 -0.04 0.34 0.10 0.00 0.00 175.35 175.64 1vfb s ASP 72 N -2.35 4.59 0.33 0.03 -1.08 0.10 -5.00 116.67 113.29 1vfb s ASP 72 Ca -0.02 -1.74 0.03 0.00 -0.52 0.00 0.00 52.55 50.30 1vfb s ASP 72 Cb 0.01 -1.58 0.57 0.00 -1.46 0.00 0.00 42.92 40.46 1vfb s ASP 72 CO -0.06 -0.28 1.88 0.78 0.52 0.00 0.00 175.17 178.01 1vfb h ASN 73 N 7.70 0.56 0.16 -0.34 2.35 -1.98 -2.07 115.58 121.97 1vfb h ASN 73 Ca -0.12 -0.10 -0.20 0.00 -0.55 0.00 0.00 56.30 55.34 1vfb h ASN 73 Cb 1.03 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 39.25 1vfb h ASN 73 CO 0.49 0.59 -0.76 0.77 -1.65 0.00 0.00 177.43 176.88 1vfb h SER 74 N 0.59 0.60 0.91 5.81 4.64 -1.95 -2.95 113.55 121.20 1vfb h SER 74 Ca 0.13 -0.40 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1vfb h SER 74 Cb 0.29 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1vfb h SER 74 CO 0.00 1.16 0.00 0.29 -0.87 0.00 0.00 176.83 177.41 1vfb n LYS 75 N -3.86 0.01 -3.64 4.77 5.02 -1.10 -4.92 118.16 114.44 1vfb n LYS 75 Ca -0.05 0.06 -0.24 0.00 -2.02 0.00 0.00 58.31 56.05 1vfb n LYS 75 Cb 0.73 -1.51 0.07 0.00 -0.02 0.00 0.00 35.03 34.30 1vfb n LYS 75 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1vfb n SER 76 N -1.52 -5.24 -4.21 4.39 7.64 -0.81 -4.90 113.62 108.97 1vfb n SER 76 Ca 0.06 -0.61 -0.23 0.00 1.01 0.00 0.00 58.87 59.11 1vfb n SER 76 Cb 0.31 -4.78 -0.13 0.00 -1.01 0.00 0.00 64.21 58.59 1vfb n SER 76 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1vfb s GLN 77 N -6.23 1.12 0.03 1.43 -0.21 -1.03 -1.35 119.66 113.42 1vfb s GLN 77 Ca 0.49 -0.92 0.07 0.00 0.02 0.00 0.00 55.36 55.02 1vfb s GLN 77 Cb -0.23 -1.21 -0.02 0.00 1.00 0.00 0.00 33.01 32.55 1vfb s GLN 77 CO 0.75 0.30 -0.20 0.08 -2.12 0.00 0.00 175.29 174.10 1vfb s VAL 78 N -0.93 1.62 -0.03 1.09 1.01 -0.43 -0.72 120.40 122.01 1vfb s VAL 78 Ca 0.04 -1.09 0.05 0.00 0.00 0.00 0.00 61.98 60.98 1vfb s VAL 78 Cb -0.09 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.89 1vfb s VAL 78 CO 0.02 0.27 -0.17 -0.36 0.00 0.00 0.00 175.10 174.86 1vfb s PHE 79 N -0.70 1.64 -0.16 5.22 0.08 0.28 -0.80 117.98 123.53 1vfb s PHE 79 Ca 0.07 -0.38 -0.01 0.00 0.12 0.00 0.00 56.93 56.73 1vfb s PHE 79 Cb -0.08 -1.08 -0.01 0.00 -0.57 0.00 0.00 43.02 41.28 1vfb s PHE 79 CO 0.01 -0.09 -0.10 -1.17 -0.10 0.00 0.00 175.22 173.77 1vfb s LEU 80 N -0.22 2.77 -0.06 -0.37 2.96 -0.70 -1.83 118.68 121.24 1vfb s LEU 80 Ca 0.02 -0.35 0.06 0.00 -0.22 0.00 0.00 54.13 53.65 1vfb s LEU 80 Cb -0.09 -1.65 -0.01 0.00 0.50 0.00 0.00 46.19 44.94 1vfb s LEU 80 CO 0.01 0.11 -0.25 -0.54 -1.32 0.00 0.00 176.35 174.36 1vfb s LYS 81 N 0.69 2.60 -0.00 1.98 1.02 0.58 -1.04 119.74 125.57 1vfb s LYS 81 Ca -0.05 -0.90 0.01 0.00 0.02 0.00 0.00 55.97 55.05 1vfb s LYS 81 Cb -0.15 -2.17 -0.00 0.00 -0.52 0.00 0.00 37.83 34.98 1vfb s LYS 81 CO 0.02 0.36 -0.03 1.41 -0.92 0.00 0.00 175.35 176.19 1vfb s MET 82 N -0.11 0.28 0.38 1.68 1.75 0.13 -1.36 119.30 122.06 1vfb s MET 82 Ca -0.05 -0.12 0.06 0.00 -1.25 0.00 0.00 55.69 54.33 1vfb s MET 82 Cb -0.14 -0.27 -0.02 0.00 2.84 0.00 0.00 34.83 37.23 1vfb s MET 82 CO 0.04 0.07 0.23 0.54 -0.65 0.00 0.00 175.02 175.26 1vfb s ASN 83 N -0.08 2.27 -1.27 1.11 2.20 -0.59 0.10 114.94 118.68 1vfb s ASN 83 Ca 0.01 -1.77 -0.04 0.00 -0.94 0.00 0.00 52.86 50.12 1vfb s ASN 83 Cb -0.01 0.59 -0.01 0.00 -2.00 0.00 0.00 41.25 39.82 1vfb s ASN 83 CO -0.00 -1.05 0.69 -1.20 -2.94 0.00 0.00 177.10 172.60 1vfb n SER 84 N -1.58 -2.19 -4.77 3.54 7.64 -1.26 -4.84 113.62 110.16 1vfb n SER 84 Ca 0.02 -0.88 -0.39 0.00 1.01 0.00 0.00 58.87 58.64 1vfb n SER 84 Cb 0.63 -3.87 -0.02 0.00 -1.01 0.00 0.00 64.21 59.94 1vfb n SER 84 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1vfb s LEU 85 N -6.58 4.25 0.18 -3.43 1.43 -1.26 -5.06 118.68 108.21 1vfb s LEU 85 Ca 0.12 2.43 0.06 0.00 -1.03 0.00 0.00 54.13 55.71 1vfb s LEU 85 Cb -0.04 -3.93 -0.05 0.00 0.03 0.00 0.00 46.19 42.20 1vfb s LEU 85 CO 0.83 -0.65 -0.11 -1.00 0.23 0.00 0.00 176.35 175.64 1vfb s HIS 86 N -1.34 1.51 0.37 0.29 3.76 -1.26 -4.59 115.29 114.03 1vfb s HIS 86 Ca 0.55 -0.69 0.35 0.00 -0.15 0.00 0.00 55.06 55.12 1vfb s HIS 86 Cb -0.33 -0.75 1.70 0.00 1.11 0.00 0.00 32.58 34.31 1vfb s HIS 86 CO 0.42 0.20 2.12 1.79 -0.85 0.00 0.00 174.74 178.43 1vfb h THR 87 N 2.64 0.19 0.00 1.30 1.35 -1.86 -1.87 112.91 114.67 1vfb h THR 87 Ca -0.37 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 1vfb h THR 87 Cb 1.21 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 68.95 1vfb h THR 87 CO 0.63 0.04 0.00 0.47 -0.25 0.00 0.00 175.52 176.41 1vfb n ASP 88 N -3.26 0.00 -0.19 5.36 8.00 -1.26 -1.86 116.55 123.33 1vfb n ASP 88 Ca -0.01 -0.57 0.15 0.00 0.71 0.00 0.00 54.79 55.07 1vfb n ASP 88 Cb 0.22 -0.05 0.72 0.00 -0.02 0.00 0.00 41.12 41.99 1vfb n ASP 88 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1vfb n ASP 89 N -1.05 0.62 -4.67 -2.24 8.00 -0.70 -4.86 116.55 111.64 1vfb n ASP 89 Ca 0.15 -1.06 -0.42 0.00 0.71 0.00 0.00 54.79 54.17 1vfb n ASP 89 Cb 0.09 -0.02 -0.03 0.00 -0.02 0.00 0.00 41.12 41.15 1vfb n ASP 89 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1vfb s THR 90 N -2.12 3.54 0.08 -3.53 2.01 -0.78 -4.82 115.64 110.02 1vfb s THR 90 Ca 0.40 0.74 -0.27 0.00 0.31 0.00 0.00 61.69 62.88 1vfb s THR 90 Cb 0.21 -3.48 0.09 0.00 0.01 0.00 0.00 72.50 69.33 1vfb s THR 90 CO 0.38 -0.05 1.14 0.00 -0.69 0.00 0.00 174.62 175.41 1vfb s ALA 91 N 3.66 -1.97 -0.14 7.40 0.00 -0.74 -4.47 121.76 125.51 1vfb s ALA 91 Ca 0.72 0.18 -0.15 0.00 0.00 0.00 0.00 51.96 52.70 1vfb s ALA 91 Cb -0.34 0.62 -0.05 0.00 0.00 0.00 0.00 23.12 23.36 1vfb s ALA 91 CO 0.29 -1.07 0.37 0.50 0.00 0.00 0.00 175.76 175.85 1vfb s ARG 92 N -2.50 4.26 -0.08 0.00 3.52 -0.53 -0.50 118.95 123.12 1vfb s ARG 92 Ca 0.18 0.25 0.00 0.00 -0.13 0.00 0.00 55.73 56.03 1vfb s ARG 92 Cb 0.01 -3.42 -0.03 0.00 -1.56 0.00 0.00 34.95 29.95 1vfb s ARG 92 CO 0.01 0.23 -0.06 0.71 -0.81 0.00 0.00 175.30 175.38 1vfb s TYR 93 N 0.44 2.98 -0.01 5.12 1.51 0.24 -0.53 117.35 127.08 1vfb s TYR 93 Ca 0.21 0.02 0.03 0.00 -1.01 0.00 0.00 57.07 56.31 1vfb s TYR 93 Cb -0.14 -1.74 -0.00 0.00 -0.11 0.00 0.00 41.96 39.96 1vfb s TYR 93 CO 0.07 0.32 -0.10 0.71 -1.11 0.00 0.00 175.55 175.44 1vfb s TYR 94 N -0.72 0.91 0.04 2.71 2.02 0.64 -1.21 117.35 121.74 1vfb s TYR 94 Ca 0.11 -0.19 0.01 0.00 -0.37 0.00 0.00 57.07 56.63 1vfb s TYR 94 Cb -0.11 -0.61 -0.04 0.00 -0.40 0.00 0.00 41.96 40.80 1vfb s TYR 94 CO 0.02 -0.04 0.11 0.00 -1.57 0.00 0.00 175.55 174.07 1vfb s ALA 96 N -1.33 -0.26 0.14 0.00 0.00 -0.48 -1.35 121.76 118.48 1vfb s ALA 96 Ca 0.28 0.32 -0.30 0.00 0.00 0.00 0.00 51.96 52.26 1vfb s ALA 96 Cb -0.12 -0.19 -0.07 0.00 0.00 0.00 0.00 23.12 22.73 1vfb s ALA 96 CO 0.20 -0.06 1.16 0.50 0.00 0.00 0.00 175.76 177.56 1vfb s ARG 97 N 0.14 4.51 -0.21 0.00 3.52 0.57 -0.96 118.95 126.51 1vfb s ARG 97 Ca -0.01 1.79 -0.09 0.00 -0.13 0.00 0.00 55.73 57.29 1vfb s ARG 97 Cb -0.02 -3.29 -0.05 0.00 -1.56 0.00 0.00 34.95 30.04 1vfb s ARG 97 CO -0.00 -0.08 0.12 -2.00 -0.81 0.00 0.00 175.30 172.52 1vfb s GLU 98 N 0.12 4.07 -0.25 5.12 2.12 0.21 -1.85 118.70 128.23 1vfb s GLU 98 Ca 0.53 -0.28 0.01 0.00 0.36 0.00 0.00 54.97 55.60 1vfb s GLU 98 Cb -0.30 -3.40 0.07 0.00 0.26 0.00 0.00 34.13 30.76 1vfb s GLU 98 CO 0.34 0.20 -0.04 0.50 -0.54 0.00 0.00 175.26 175.72 1vfb s ARG 99 N 0.62 1.58 -1.24 4.30 3.52 -0.39 -2.70 118.95 124.65 1vfb s ARG 99 Ca 0.06 -1.11 -0.24 0.00 -0.13 0.00 0.00 55.73 54.31 1vfb s ARG 99 Cb -0.12 -2.63 0.02 0.00 -1.56 0.00 0.00 34.95 30.66 1vfb s ARG 99 CO 0.01 -0.66 0.64 -3.47 -0.81 0.00 0.00 175.30 171.01 1vfb n ASP 100 N 4.62 -3.74 -2.57 -2.12 2.03 -1.26 -2.80 116.55 110.70 1vfb n ASP 100 Ca -0.10 -1.17 -0.17 0.00 0.52 0.00 0.00 54.79 53.87 1vfb n ASP 100 Cb 0.43 -2.41 0.05 0.00 -0.72 0.00 0.00 41.12 38.47 1vfb n ASP 100 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1vfb n TYR 101 N -4.65 -1.87 -3.67 -0.67 4.01 -1.26 -5.04 117.16 104.01 1vfb n TYR 101 Ca -0.14 0.61 -0.15 0.00 -0.16 0.00 0.00 57.90 58.06 1vfb n TYR 101 Cb 0.60 -3.80 -0.08 0.00 -0.31 0.00 0.00 39.34 35.75 1vfb n TYR 101 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 1vfb s ARG 102 N -5.76 0.80 -0.59 -0.72 3.03 -1.12 -5.11 118.95 109.49 1vfb s ARG 102 Ca 0.36 0.05 -0.16 0.00 2.03 0.00 0.00 55.73 58.00 1vfb s ARG 102 Cb -0.16 0.37 0.14 0.00 -1.03 0.00 0.00 34.95 34.27 1vfb s ARG 102 CO 0.44 -0.23 0.55 -0.51 -1.13 0.00 0.00 175.30 174.43 1vfb s LEU 103 N -1.14 6.23 0.15 -1.89 1.43 -1.26 -1.26 118.68 120.93 1vfb s LEU 103 Ca -0.11 -1.90 0.20 0.00 -1.03 0.00 0.00 54.13 51.28 1vfb s LEU 103 Cb -0.03 -2.22 -0.06 0.00 0.03 0.00 0.00 46.19 43.92 1vfb s LEU 103 CO 0.06 -0.83 0.96 -2.24 0.23 0.00 0.00 176.35 174.53 1vfb h ASP 104 N 8.74 0.00 -3.68 2.29 2.03 -1.72 -3.46 116.42 120.63 1vfb h ASP 104 Ca -0.24 0.00 -0.33 0.00 -0.73 0.00 0.00 57.03 55.73 1vfb h ASP 104 Cb 1.09 0.00 -0.31 0.00 -0.83 0.00 0.00 39.33 39.28 1vfb h ASP 104 CO 1.00 0.26 -0.75 -0.31 -1.03 0.00 0.00 179.24 178.41 1vfb s TYR 105 N -3.17 0.40 0.06 4.15 2.02 -1.25 -5.01 117.35 114.56 1vfb s TYR 105 Ca -0.01 -0.06 0.07 0.00 -0.37 0.00 0.00 57.07 56.69 1vfb s TYR 105 Cb 0.09 -0.36 -0.03 0.00 -0.40 0.00 0.00 41.96 41.26 1vfb s TYR 105 CO 0.80 -0.08 -0.20 -1.58 -1.57 0.00 0.00 175.55 172.92 1vfb s TRP 106 N 0.44 1.71 0.99 2.71 0.52 -1.26 -0.32 118.94 123.74 1vfb s TRP 106 Ca -0.05 -0.39 -0.17 0.00 0.02 0.00 0.00 56.10 55.52 1vfb s TRP 106 Cb -0.08 -0.99 0.22 0.00 -1.15 0.00 0.00 33.47 31.47 1vfb s TRP 106 CO -0.01 0.12 1.32 0.20 0.02 0.00 0.00 176.95 178.61 1vfb s GLY 107 N -1.44 1.79 0.44 0.98 0.00 -0.46 -4.68 107.32 103.94 1vfb s GLY 107 Ca 0.06 -1.24 0.24 0.00 0.00 0.00 0.00 44.72 43.78 1vfb s GLY 107 CO 0.03 -0.44 1.66 1.46 0.00 0.00 0.00 173.10 175.81 1vfb h GLN 108 N -1.75 0.00 0.00 2.90 4.20 -1.90 -3.46 115.11 115.10 1vfb h GLN 108 Ca -0.44 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.27 1vfb h GLN 108 Cb 1.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.01 1vfb h GLN 108 CO 0.35 0.07 0.00 0.41 -0.67 0.00 0.00 178.83 178.99 1vfb n GLY 109 N 0.92 0.80 3.20 3.46 0.00 -1.26 -5.02 105.19 107.29 1vfb n GLY 109 Ca 0.03 -1.76 -0.26 0.00 0.00 0.00 0.00 46.02 44.03 1vfb n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vfb s THR 110 N -2.98 1.51 -0.01 2.61 2.01 -0.35 -4.80 115.64 113.63 1vfb s THR 110 Ca 0.00 -0.86 -0.23 0.00 0.31 0.00 0.00 61.69 60.92 1vfb s THR 110 Cb 0.00 -1.26 -0.05 0.00 0.01 0.00 0.00 72.50 71.20 1vfb s THR 110 CO 0.00 0.39 0.67 -0.89 -0.69 0.00 0.00 174.62 174.11 1vfb s THR 111 N -0.49 4.90 -0.08 -0.82 2.01 -1.26 -0.60 115.64 119.30 1vfb s THR 111 Ca 0.07 1.41 0.03 0.00 0.31 0.00 0.00 61.69 63.52 1vfb s THR 111 Cb -0.07 -4.02 0.01 0.00 0.01 0.00 0.00 72.50 68.42 1vfb s THR 111 CO -0.00 0.35 -0.19 -0.22 -0.69 0.00 0.00 174.62 173.87 1vfb s LEU 112 N 0.13 1.89 -0.13 4.42 2.96 0.34 -4.08 118.68 124.22 1vfb s LEU 112 Ca 0.35 -0.43 -0.01 0.00 -0.22 0.00 0.00 54.13 53.82 1vfb s LEU 112 Cb -0.19 -1.13 -0.02 0.00 0.50 0.00 0.00 46.19 45.35 1vfb s LEU 112 CO 0.19 0.11 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.34 1vfb s THR 113 N 0.45 3.40 -0.28 3.68 2.01 -0.07 -1.79 115.64 123.05 1vfb s THR 113 Ca -0.16 -0.54 -0.11 0.00 0.31 0.00 0.00 61.69 61.18 1vfb s THR 113 Cb -0.17 -2.44 -0.05 0.00 0.01 0.00 0.00 72.50 69.85 1vfb s THR 113 CO 0.06 0.53 0.20 -0.69 -0.69 0.00 0.00 174.62 174.03 1vfb s VAL 114 N 0.16 5.30 0.00 3.82 1.01 -1.26 -1.78 120.40 127.65 1vfb s VAL 114 Ca -0.05 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.11 1vfb s VAL 114 Cb -0.14 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.69 1vfb s VAL 114 CO 0.04 0.24 0.00 -1.54 0.00 0.00 0.00 175.10 173.84 1vfb n SER 115 N 5.07 0.00 -0.34 3.32 3.41 -0.10 -4.67 113.62 120.32 1vfb n SER 115 Ca -0.14 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.62 1vfb n SER 115 Cb 0.52 0.00 0.65 0.00 -0.26 0.00 0.00 64.21 65.11 1vfb n SER 115 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68