#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vuv s PRO 3 N -3.63 1.47 0.40 0.00 0.02 -1.26 -4.91 135.00 127.08 2vuv s PRO 3 Ca 0.21 1.54 -0.26 0.00 0.02 0.00 0.00 61.00 62.51 2vuv s PRO 3 Cb -0.00 -1.78 -0.10 0.00 0.02 0.00 0.00 34.50 32.63 2vuv s PRO 3 CO 0.05 -2.30 1.29 -0.25 -0.33 0.00 0.00 177.00 175.46 2vuv n ASP 4 N -3.78 2.67 0.00 2.53 8.00 -1.26 -1.97 116.55 122.75 2vuv n ASP 4 Ca 0.12 1.14 0.00 0.00 0.71 0.00 0.00 54.79 56.76 2vuv n ASP 4 Cb 0.52 -1.50 0.00 0.00 -0.02 0.00 0.00 41.12 40.12 2vuv n ASP 4 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2vuv n GLY 5 N 0.78 2.61 3.88 0.44 0.00 -1.26 -5.03 105.19 106.61 2vuv n GLY 5 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 2vuv n GLY 5 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2vuv s TRP 6 N -2.43 3.48 -0.30 1.61 0.52 -0.83 -4.93 118.94 116.07 2vuv s TRP 6 Ca 0.00 1.03 -0.13 0.00 0.02 0.00 0.00 56.10 57.03 2vuv s TRP 6 Cb 0.00 -2.44 -0.04 0.00 -1.15 0.00 0.00 33.47 29.84 2vuv s TRP 6 CO 0.00 -0.15 0.25 0.99 0.02 0.00 0.00 176.95 178.07 2vuv s THR 7 N -2.44 5.26 0.28 2.01 2.01 0.84 -4.87 115.64 118.72 2vuv s THR 7 Ca 0.51 0.15 -0.28 0.00 0.31 0.00 0.00 61.69 62.38 2vuv s THR 7 Cb -0.10 -3.63 -0.09 0.00 0.01 0.00 0.00 72.50 68.68 2vuv s THR 7 CO 0.33 0.14 0.95 -1.58 -0.69 0.00 0.00 174.62 173.78 2vuv s GLN 8 N 1.84 4.73 -0.18 4.92 0.74 -1.26 -0.47 119.66 129.98 2vuv s GLN 8 Ca 0.09 1.45 -0.05 0.00 0.05 0.00 0.00 55.36 56.90 2vuv s GLN 8 Cb -0.16 -3.09 0.07 0.00 1.10 0.00 0.00 33.01 30.93 2vuv s GLN 8 CO 0.11 0.40 0.13 0.12 -0.55 0.00 0.00 175.29 175.50 2vuv s PHE 9 N -1.35 0.03 0.00 1.67 5.36 -0.00 -4.96 117.98 118.74 2vuv s PHE 9 Ca 0.45 -0.12 0.00 0.00 -0.96 0.00 0.00 56.93 56.30 2vuv s PHE 9 Cb -0.24 -0.58 0.00 0.00 -0.34 0.00 0.00 43.02 41.87 2vuv s PHE 9 CO 0.29 -0.53 0.00 1.28 -1.46 0.00 0.00 175.22 174.80 2vuv n LEU 10 N 5.29 0.00 -1.32 6.12 4.77 -1.26 -0.50 117.00 130.10 2vuv n LEU 10 Ca -0.06 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 55.96 2vuv n LEU 10 Cb 0.49 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 41.82 2vuv n LEU 10 CO 0.09 0.00 0.62 0.47 -1.33 0.00 0.00 177.39 177.25 2vuv n ASP 11 N 5.04 3.80 -4.47 -1.43 8.00 -1.26 -4.92 116.55 121.31 2vuv n ASP 11 Ca 0.00 -2.55 -0.27 0.00 0.71 0.00 0.00 54.79 52.69 2vuv n ASP 11 Cb 0.00 -0.61 -0.11 0.00 -0.02 0.00 0.00 41.12 40.38 2vuv n ASP 11 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2vuv s LEU 12 N -1.63 2.59 -0.07 0.64 1.43 0.34 -1.18 118.68 120.80 2vuv s LEU 12 Ca 0.32 -0.81 0.04 0.00 -1.03 0.00 0.00 54.13 52.65 2vuv s LEU 12 Cb 0.25 -1.29 0.00 0.00 0.03 0.00 0.00 46.19 45.18 2vuv s LEU 12 CO 0.10 0.11 -0.19 0.00 0.23 0.00 0.00 176.35 176.59 2vuv s TYR 14 N 0.31 2.33 -0.09 0.00 2.02 0.38 -0.92 117.35 121.38 2vuv s TYR 14 Ca -0.13 -0.36 -0.07 0.00 -0.37 0.00 0.00 57.07 56.13 2vuv s TYR 14 Cb -0.16 -1.21 0.02 0.00 -0.40 0.00 0.00 41.96 40.21 2vuv s TYR 14 CO 0.06 0.41 0.22 -1.50 -1.57 0.00 0.00 175.55 173.17 2vuv s ILE 15 N -1.31 -0.00 -0.11 2.71 2.07 -0.56 -0.11 121.20 123.89 2vuv s ILE 15 Ca 0.17 0.02 -0.19 0.00 -1.41 0.00 0.00 60.65 59.24 2vuv s ILE 15 Cb -0.09 -0.32 -0.04 0.00 0.13 0.00 0.00 42.46 42.14 2vuv s ILE 15 CO 0.08 0.01 0.50 -0.47 -1.91 0.00 0.00 174.94 173.15 2vuv s TYR 16 N 0.24 3.53 -0.20 3.50 5.04 -1.26 -1.09 117.35 127.11 2vuv s TYR 16 Ca -0.01 0.94 -0.02 0.00 -2.44 0.00 0.00 57.07 55.54 2vuv s TYR 16 Cb -0.02 -2.58 0.00 0.00 0.35 0.00 0.00 41.96 39.71 2vuv s TYR 16 CO -0.01 0.17 -0.11 -0.65 -1.34 0.00 0.00 175.55 173.62 2vuv s GLN 17 N 0.58 3.22 0.30 4.97 -1.52 0.20 -5.01 119.66 122.40 2vuv s GLN 17 Ca 0.27 -0.71 0.16 0.00 -1.95 0.00 0.00 55.36 53.13 2vuv s GLN 17 Cb -0.15 -2.80 0.24 0.00 -0.22 0.00 0.00 33.01 30.07 2vuv s GLN 17 CO 0.11 -0.18 1.52 0.66 -0.25 0.00 0.00 175.29 177.16 2vuv h SER 18 N 7.95 0.00 -3.44 5.90 4.64 -1.97 -1.78 113.55 124.85 2vuv h SER 18 Ca -0.42 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.34 2vuv h SER 18 Cb 1.16 0.00 0.10 0.00 -0.31 0.00 0.00 62.40 63.35 2vuv h SER 18 CO 0.61 0.48 0.69 0.00 -0.87 0.00 0.00 176.83 177.74 2vuv n ALA 19 N -2.25 1.90 -2.34 5.18 0.00 -1.26 -4.48 120.51 117.26 2vuv n ALA 19 Ca 0.01 0.36 -0.40 0.00 0.00 0.00 0.00 53.44 53.42 2vuv n ALA 19 Cb 0.68 -2.36 -0.05 0.00 0.00 0.00 0.00 19.45 17.72 2vuv n ALA 19 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2vuv s LYS 20 N -1.51 4.52 0.05 0.00 -0.14 -1.26 -4.22 119.74 117.19 2vuv s LYS 20 Ca 0.58 1.11 -0.19 0.00 -1.36 0.00 0.00 55.97 56.11 2vuv s LYS 20 Cb -0.53 -3.35 0.04 0.00 -1.68 0.00 0.00 37.83 32.31 2vuv s LYS 20 CO 0.59 0.30 0.45 0.00 -0.76 0.00 0.00 175.35 175.93 2vuv s ALA 21 N -0.15 -1.11 0.96 5.17 0.00 -0.06 -4.80 121.76 121.76 2vuv s ALA 21 Ca 0.39 0.37 -0.11 0.00 0.00 0.00 0.00 51.96 52.61 2vuv s ALA 21 Cb -0.21 0.40 0.17 0.00 0.00 0.00 0.00 23.12 23.47 2vuv s ALA 21 CO 0.24 -0.49 1.09 -1.54 0.00 0.00 0.00 175.76 175.06 2vuv s SER 22 N -2.08 2.79 0.20 0.00 1.04 -1.25 -1.71 113.70 112.68 2vuv s SER 22 Ca -0.04 1.72 -0.11 0.00 0.48 0.00 0.00 55.95 58.00 2vuv s SER 22 Cb -0.01 -2.35 0.23 0.00 0.10 0.00 0.00 66.02 64.00 2vuv s SER 22 CO -0.03 -3.11 1.75 -0.25 0.98 0.00 0.00 173.24 172.58 2vuv h TRP 23 N -1.87 0.36 -0.52 5.02 7.01 -1.37 0.14 115.95 124.71 2vuv h TRP 23 Ca -0.50 0.03 -0.10 0.00 2.11 0.00 0.00 58.89 60.43 2vuv h TRP 23 Cb 1.29 -0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 28.25 2vuv h TRP 23 CO 0.42 0.10 -0.08 0.00 -2.79 0.00 0.00 178.44 176.09 2vuv h ALA 24 N 1.38 0.88 -0.27 2.65 0.00 -1.92 -0.03 119.26 121.95 2vuv h ALA 24 Ca 0.28 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 2vuv h ALA 24 Cb 0.32 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2vuv h ALA 24 CO -0.28 0.65 -0.35 0.77 0.00 0.00 0.00 179.25 180.03 2vuv h SER 25 N 0.85 0.63 -0.41 0.00 0.02 -1.85 -1.36 113.55 111.42 2vuv h SER 25 Ca 0.14 -0.26 -0.04 0.00 -0.84 0.00 0.00 61.79 60.80 2vuv h SER 25 Cb 0.61 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.96 2vuv h SER 25 CO 0.04 0.93 0.12 0.00 -1.14 0.00 0.00 176.83 176.78 2vuv h ALA 26 N 1.11 0.54 -0.85 3.77 0.00 -0.74 -0.91 119.26 122.18 2vuv h ALA 26 Ca 0.05 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.81 2vuv h ALA 26 Cb 0.85 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 2vuv h ALA 26 CO 0.07 0.20 0.55 0.37 0.00 0.00 0.00 179.25 180.44 2vuv h GLN 27 N 0.53 1.05 -0.63 0.00 5.75 -0.81 -0.01 115.11 120.98 2vuv h GLN 27 Ca 0.13 -0.06 -0.09 0.00 -0.15 0.00 0.00 58.65 58.48 2vuv h GLN 27 Cb 0.28 -0.24 -0.02 0.00 1.07 0.00 0.00 27.48 28.57 2vuv h GLN 27 CO -0.00 0.70 0.06 1.03 -2.65 0.00 0.00 178.83 177.96 2vuv h SER 28 N 1.08 1.05 -0.56 -0.69 0.87 -1.11 -0.40 113.55 113.79 2vuv h SER 28 Ca 0.33 -0.28 -0.01 0.00 -1.23 0.00 0.00 61.79 60.60 2vuv h SER 28 Cb -0.03 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.62 2vuv h SER 28 CO -0.10 1.07 0.31 0.28 -0.53 0.00 0.00 176.83 177.85 2vuv h SER 29 N 0.99 0.71 -0.08 6.23 0.02 -0.48 -1.93 113.55 119.00 2vuv h SER 29 Ca 0.19 -0.10 -0.10 0.00 -0.84 0.00 0.00 61.79 60.94 2vuv h SER 29 Cb 0.50 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 2vuv h SER 29 CO 0.02 0.60 -0.25 0.00 -1.14 0.00 0.00 176.83 176.06 2vuv h GLN 31 N 0.45 0.79 -0.86 0.00 4.20 -0.99 0.28 115.11 118.98 2vuv h GLN 31 Ca 0.07 -0.35 -0.01 0.00 0.06 0.00 0.00 58.65 58.41 2vuv h GLN 31 Cb 0.68 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.41 2vuv h GLN 31 CO 0.05 0.98 0.50 0.00 -0.67 0.00 0.00 178.83 179.68 2vuv h ALA 32 N 1.00 1.26 0.00 3.87 0.00 -1.28 -1.06 119.26 123.05 2vuv h ALA 32 Ca 0.08 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2vuv h ALA 32 Cb 0.82 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2vuv h ALA 32 CO 0.07 0.62 0.00 1.28 0.00 0.00 0.00 179.25 181.22 2vuv n LEU 33 N -4.35 0.04 0.00 0.00 4.77 -0.92 -4.84 117.00 111.69 2vuv n LEU 33 Ca 0.09 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2vuv n LEU 33 Cb 0.08 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2vuv n LEU 33 CO 0.38 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 2vuv n GLY 34 N 0.26 0.50 0.00 -0.72 0.00 -0.40 -4.98 105.19 99.84 2vuv n GLY 34 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2vuv n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vuv n GLY 35 N -2.86 5.32 3.25 -0.02 0.00 0.04 -4.70 105.19 106.21 2vuv n GLY 35 Ca 0.00 -0.93 -0.09 0.00 0.00 0.00 0.00 46.02 45.00 2vuv n GLY 35 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2vuv s ILE 36 N 1.24 0.12 0.34 -0.61 -4.36 -0.11 -3.22 121.20 114.61 2vuv s ILE 36 Ca 0.00 -1.32 -0.28 0.00 -0.26 0.00 0.00 60.65 58.79 2vuv s ILE 36 Cb 0.00 -1.56 -0.12 0.00 1.25 0.00 0.00 42.46 42.02 2vuv s ILE 36 CO 0.00 -0.53 1.34 0.18 0.24 0.00 0.00 174.94 176.17 2vuv n LEU 37 N -0.11 3.79 -4.76 0.37 4.77 -1.26 -0.64 117.00 119.15 2vuv n LEU 37 Ca -0.12 1.21 -0.41 0.00 -0.03 0.00 0.00 56.01 56.66 2vuv n LEU 37 Cb 0.63 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.21 2vuv n LEU 37 CO 0.24 -0.35 1.09 0.00 -1.33 0.00 0.00 177.39 177.03 2vuv n ALA 38 N 0.43 2.15 -3.77 -1.18 0.00 -0.02 -4.01 120.51 114.10 2vuv n ALA 38 Ca 0.04 0.33 -0.28 0.00 0.00 0.00 0.00 53.44 53.53 2vuv n ALA 38 Cb 0.36 -2.39 -0.12 0.00 0.00 0.00 0.00 19.45 17.31 2vuv n ALA 38 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2vuv s GLU 39 N -2.13 2.02 -0.90 0.00 2.02 -1.26 -0.16 118.70 118.28 2vuv s GLU 39 Ca 0.55 -2.96 -0.25 0.00 0.02 0.00 0.00 54.97 52.33 2vuv s GLU 39 Cb -0.49 -2.89 -0.04 0.00 0.10 0.00 0.00 34.13 30.82 2vuv s GLU 39 CO 0.63 -1.30 1.91 -1.25 0.02 0.00 0.00 175.26 175.26 2vuv s PRO 40 N -0.96 2.64 -0.27 0.39 0.04 -1.26 -4.76 135.00 130.81 2vuv s PRO 40 Ca 0.26 -0.31 0.13 0.00 0.04 0.00 0.00 61.00 61.11 2vuv s PRO 40 Cb -0.04 -5.05 0.71 0.00 0.04 0.00 0.00 34.50 30.15 2vuv s PRO 40 CO -0.16 -3.26 1.68 -0.40 0.04 0.00 0.00 177.00 174.90 2vuv n ASP 41 N 13.54 4.73 -4.03 6.66 5.75 -1.26 -4.78 116.55 137.16 2vuv n ASP 41 Ca 0.39 -3.14 -0.08 0.00 -0.01 0.00 0.00 54.79 51.95 2vuv n ASP 41 Cb 0.47 -0.68 -0.10 0.00 -1.03 0.00 0.00 41.12 39.79 2vuv n ASP 41 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2vuv s THR 42 N -2.92 0.19 0.19 2.12 -4.23 -1.26 -4.65 115.64 105.07 2vuv s THR 42 Ca 0.51 -1.55 -0.13 0.00 -1.18 0.00 0.00 61.69 59.35 2vuv s THR 42 Cb 0.41 -1.31 0.10 0.00 1.34 0.00 0.00 72.50 73.04 2vuv s THR 42 CO 0.12 -0.86 1.85 0.00 -0.54 0.00 0.00 174.62 175.19 2vuv h ALA 43 N 3.28 0.77 -0.54 3.99 0.00 -1.99 -2.15 119.26 122.61 2vuv h ALA 43 Ca -0.34 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.46 2vuv h ALA 43 Cb 1.16 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 2vuv h ALA 43 CO 0.61 0.16 0.02 0.00 0.00 0.00 0.00 179.25 180.04 2vuv h GLU 45 N 0.85 0.57 -0.78 0.00 5.08 -1.90 -2.09 114.58 116.30 2vuv h GLU 45 Ca 0.16 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2vuv h GLU 45 Cb 0.48 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 2vuv h GLU 45 CO 0.02 0.38 0.50 -0.97 -1.00 0.00 0.00 179.01 177.94 2vuv h ASN 46 N 0.59 0.92 -0.71 1.42 -0.73 -0.99 -1.54 115.58 114.53 2vuv h ASN 46 Ca 0.19 -0.04 0.01 0.00 1.87 0.00 0.00 56.30 58.33 2vuv h ASN 46 Cb -0.01 -0.23 -0.04 0.00 0.27 0.00 0.00 38.32 38.31 2vuv h ASN 46 CO -0.07 0.68 0.46 -0.33 -0.37 0.00 0.00 177.43 177.80 2vuv h GLU 47 N 1.07 0.91 -0.24 6.67 5.08 -0.79 0.07 114.58 127.34 2vuv h GLU 47 Ca 0.28 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.59 2vuv h GLU 47 Cb -0.09 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 28.94 2vuv h GLU 47 CO -0.06 0.60 0.14 0.28 -1.00 0.00 0.00 179.01 178.97 2vuv h VAL 48 N 0.94 1.11 -0.50 3.13 2.07 -1.03 -1.74 116.25 120.23 2vuv h VAL 48 Ca 0.27 -0.29 -0.10 0.00 0.82 0.00 0.00 66.70 67.40 2vuv h VAL 48 Cb -0.08 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 2vuv h VAL 48 CO -0.07 0.11 -0.07 -0.07 0.02 0.00 0.00 177.57 177.49 2vuv h LEU 49 N 0.29 0.88 -0.86 2.57 3.38 -0.94 -1.18 115.31 119.45 2vuv h LEU 49 Ca 0.09 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.75 2vuv h LEU 49 Cb 0.06 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 2vuv h LEU 49 CO -0.01 0.98 0.29 0.40 0.09 0.00 0.00 178.44 180.19 2vuv h ILE 50 N 0.81 1.25 -0.75 1.22 2.04 -0.90 -0.38 117.51 120.80 2vuv h ILE 50 Ca 0.14 -0.81 -0.05 0.00 1.00 0.00 0.00 64.86 65.14 2vuv h ILE 50 Cb 0.58 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 2vuv h ILE 50 CO 0.04 0.33 0.26 -0.74 0.00 0.00 0.00 178.15 178.04 2vuv h HIS 51 N 1.10 1.19 -0.88 1.37 2.76 -1.02 -1.48 115.15 118.18 2vuv h HIS 51 Ca 0.25 -0.11 -0.00 0.00 -2.20 0.00 0.00 60.37 58.31 2vuv h HIS 51 Cb 0.22 -0.35 -0.04 0.00 1.55 0.00 0.00 27.41 28.79 2vuv h HIS 51 CO 0.02 0.92 0.54 0.52 -1.30 0.00 0.00 177.93 178.63 2vuv h MET 52 N 1.11 1.19 -0.46 5.26 2.86 -0.55 -0.94 114.93 123.39 2vuv h MET 52 Ca 0.25 -0.10 0.04 0.00 -2.06 0.00 0.00 59.70 57.83 2vuv h MET 52 Cb 0.27 -0.25 -0.04 0.00 0.06 0.00 0.00 31.60 31.64 2vuv h MET 52 CO -0.01 0.82 0.22 0.00 1.06 0.00 0.00 176.91 179.00 2vuv h LYS 54 N 0.44 0.92 0.00 0.00 1.57 -0.80 0.51 116.57 119.22 2vuv h LYS 54 Ca 0.21 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2vuv h LYS 54 Cb 0.13 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.24 2vuv h LYS 54 CO -0.16 0.62 0.00 0.39 -0.57 0.00 0.00 179.45 179.73 2vuv n GLU 55 N -4.59 0.44 -0.06 3.15 -0.58 -0.40 -2.36 120.64 116.24 2vuv n GLU 55 Ca 0.06 0.05 0.06 0.00 -0.42 0.00 0.00 57.16 56.91 2vuv n GLU 55 Cb 0.02 -1.50 0.09 0.00 -0.57 0.00 0.00 31.44 29.48 2vuv n GLU 55 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2vuv n ASN 56 N -1.20 2.29 -1.81 1.62 3.02 -0.92 -5.00 115.26 113.27 2vuv n ASN 56 Ca 0.13 -2.61 -0.14 0.00 -0.03 0.00 0.00 54.58 51.92 2vuv n ASN 56 Cb 0.15 -0.25 0.01 0.00 -0.61 0.00 0.00 39.78 39.07 2vuv n ASN 56 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vuv n GLY 57 N -0.96 -0.16 2.58 7.41 0.00 -0.97 -4.92 105.19 108.17 2vuv n GLY 57 Ca 0.10 -0.25 -0.16 0.00 0.00 0.00 0.00 46.02 45.71 2vuv n GLY 57 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2vuv n ASP 58 N -0.83 2.77 -1.17 1.61 -0.08 0.12 -4.79 116.55 114.18 2vuv n ASP 58 Ca -0.12 -3.10 0.10 0.00 -1.51 0.00 0.00 54.79 50.15 2vuv n ASP 58 Cb 0.60 -0.50 0.28 0.00 2.34 0.00 0.00 41.12 43.84 2vuv n ASP 58 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2vuv n ALA 59 N -0.25 2.44 -2.39 -1.67 0.00 -1.25 -4.64 120.51 112.76 2vuv n ALA 59 Ca 0.21 -1.34 0.00 0.00 0.00 0.00 0.00 53.44 52.32 2vuv n ALA 59 Cb 0.76 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 19.42 2vuv n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vuv n GLY 60 N 1.18 3.14 3.76 0.00 0.00 -1.26 -4.15 105.19 107.86 2vuv n GLY 60 Ca 0.21 -1.81 -0.34 0.00 0.00 0.00 0.00 46.02 44.08 2vuv n GLY 60 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vuv s SER 61 N -0.23 5.07 -1.33 1.61 1.04 -1.26 -0.40 113.70 118.19 2vuv s SER 61 Ca 0.00 2.08 -0.05 0.00 0.48 0.00 0.00 55.95 58.46 2vuv s SER 61 Cb 0.00 -2.56 0.02 0.00 0.10 0.00 0.00 66.02 63.58 2vuv s SER 61 CO 0.00 -1.66 0.97 0.49 0.98 0.00 0.00 173.24 174.02 2vuv n PHE 62 N -2.29 -2.33 -1.17 5.02 3.72 -1.26 -4.86 117.46 114.30 2vuv n PHE 62 Ca 0.11 0.93 -0.30 0.00 -0.05 0.00 0.00 57.45 58.14 2vuv n PHE 62 Cb 0.52 -4.69 0.25 0.00 -0.94 0.00 0.00 39.48 34.61 2vuv n PHE 62 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2vuv n GLY 63 N -1.58 -2.61 3.80 1.37 0.00 0.16 -4.67 105.19 101.65 2vuv n GLY 63 Ca -0.15 -1.52 -0.33 0.00 0.00 0.00 0.00 46.02 44.01 2vuv n GLY 63 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2vuv s PRO 64 N -5.55 3.60 0.51 1.61 0.04 -1.25 -4.17 135.00 129.78 2vuv s PRO 64 Ca 0.72 1.25 -0.23 0.00 0.04 0.00 0.00 61.00 62.78 2vuv s PRO 64 Cb -0.06 -2.07 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 2vuv s PRO 64 CO 0.55 -0.59 1.29 0.91 0.04 0.00 0.00 177.00 179.20 2vuv n TRP 65 N -1.52 2.11 -4.50 0.56 5.03 -0.22 -1.47 117.44 117.45 2vuv n TRP 65 Ca 0.09 0.45 -0.24 0.00 3.03 0.00 0.00 57.50 60.83 2vuv n TRP 65 Cb 0.53 -2.35 -0.11 0.00 -1.03 0.00 0.00 31.31 28.35 2vuv n TRP 65 CO 0.00 0.00 0.00 -0.51 -0.03 0.00 0.00 177.69 177.15 2vuv s LEU 66 N -2.69 2.58 -0.05 -0.99 1.43 -0.43 -2.60 118.68 115.93 2vuv s LEU 66 Ca 0.68 -1.25 0.02 0.00 -1.03 0.00 0.00 54.13 52.56 2vuv s LEU 66 Cb -0.45 -0.75 0.16 0.00 0.03 0.00 0.00 46.19 45.18 2vuv s LEU 66 CO 0.52 -0.36 0.78 0.61 0.23 0.00 0.00 176.35 178.14 2vuv n GLY 67 N -0.72 1.85 3.92 -3.19 0.00 0.77 -4.41 105.19 103.41 2vuv n GLY 67 Ca -0.05 -0.18 -0.27 0.00 0.00 0.00 0.00 46.02 45.52 2vuv n GLY 67 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vuv s GLY 68 N -0.08 1.75 -0.20 -0.02 0.00 -1.26 -1.09 107.32 106.42 2vuv s GLY 68 Ca 0.11 -0.74 -0.27 0.00 0.00 0.00 0.00 44.72 43.81 2vuv s GLY 68 CO 0.03 -0.67 0.75 -0.86 0.00 0.00 0.00 173.10 172.35 2vuv s GLN 69 N -3.54 0.86 -0.32 2.90 -2.07 -0.44 -1.62 119.66 115.43 2vuv s GLN 69 Ca 0.41 0.68 -0.20 0.00 -1.82 0.00 0.00 55.36 54.43 2vuv s GLN 69 Cb -0.11 0.41 -0.01 0.00 -1.09 0.00 0.00 33.01 32.22 2vuv s GLN 69 CO 0.30 -0.17 0.61 0.21 -1.32 0.00 0.00 175.29 174.92 2vuv s LYS 70 N -0.20 3.80 -0.12 9.60 2.20 0.58 -1.23 119.74 134.37 2vuv s LYS 70 Ca -0.03 0.16 0.00 0.00 -0.36 0.00 0.00 55.97 55.74 2vuv s LYS 70 Cb -0.03 -3.76 0.02 0.00 -1.51 0.00 0.00 37.83 32.55 2vuv s LYS 70 CO 0.03 -0.62 -0.11 0.08 -0.36 0.00 0.00 175.35 174.37 2vuv s VAL 71 N 2.59 1.30 -1.38 4.02 1.01 -0.04 -4.70 120.40 123.21 2vuv s VAL 71 Ca 0.24 -0.47 -0.07 0.00 0.00 0.00 0.00 61.98 61.67 2vuv s VAL 71 Cb -0.15 -1.25 0.01 0.00 0.00 0.00 0.00 36.38 34.99 2vuv s VAL 71 CO 0.13 0.41 0.98 0.61 0.00 0.00 0.00 175.10 177.23 2vuv n GLY 72 N 4.74 -0.50 3.13 4.51 0.00 -1.26 -2.15 105.19 113.67 2vuv n GLY 72 Ca -0.15 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2vuv n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vuv n GLY 73 N -1.83 1.93 3.34 -0.02 0.00 -1.26 -5.01 105.19 102.34 2vuv n GLY 73 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 2vuv n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vuv s ALA 74 N -3.23 2.19 0.18 4.61 0.00 -0.91 -5.07 121.76 119.53 2vuv s ALA 74 Ca 0.00 -1.27 -0.27 0.00 0.00 0.00 0.00 51.96 50.41 2vuv s ALA 74 Cb 0.00 -0.43 -0.08 0.00 0.00 0.00 0.00 23.12 22.61 2vuv s ALA 74 CO 0.00 0.51 0.85 -1.58 0.00 0.00 0.00 175.76 175.54 2vuv s TRP 75 N -0.86 3.92 0.06 0.00 0.52 -1.26 -0.86 118.94 120.47 2vuv s TRP 75 Ca 0.11 1.74 -0.10 0.00 0.02 0.00 0.00 56.10 57.87 2vuv s TRP 75 Cb -0.10 -2.87 0.01 0.00 -1.15 0.00 0.00 33.47 29.36 2vuv s TRP 75 CO 0.03 0.45 0.23 1.14 0.02 0.00 0.00 176.95 178.82 2vuv s GLN 76 N -1.00 0.79 -0.05 4.98 -2.07 -0.36 -3.92 119.66 118.03 2vuv s GLN 76 Ca 0.39 -0.72 -0.30 0.00 -1.82 0.00 0.00 55.36 52.91 2vuv s GLN 76 Cb -0.24 0.33 -0.02 0.00 -1.09 0.00 0.00 33.01 31.99 2vuv s GLN 76 CO 0.28 -0.25 0.99 -1.58 -1.32 0.00 0.00 175.29 173.42 2vuv s TRP 77 N -3.06 3.59 0.19 9.60 0.23 -0.05 -1.32 118.94 128.12 2vuv s TRP 77 Ca -0.01 1.65 0.23 0.00 -2.03 0.00 0.00 56.10 55.94 2vuv s TRP 77 Cb 0.01 -3.15 0.96 0.00 0.03 0.00 0.00 33.47 31.32 2vuv s TRP 77 CO -0.07 -0.11 1.85 0.66 0.96 0.00 0.00 176.95 180.24 2vuv h SER 78 N 6.93 0.00 -0.32 2.95 4.64 -1.44 0.23 113.55 126.54 2vuv h SER 78 Ca -0.37 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.84 2vuv h SER 78 Cb 1.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 2vuv h SER 78 CO 0.80 0.24 -0.20 0.77 -0.87 0.00 0.00 176.83 177.56 2vuv h SER 79 N 0.00 0.80 0.00 4.97 4.64 -1.93 -3.34 113.55 118.69 2vuv h SER 79 Ca -0.00 -0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 2vuv h SER 79 Cb 0.71 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2vuv h SER 79 CO 0.03 0.98 -1.32 -1.54 -0.87 0.00 0.00 176.83 174.11 2vuv n SER 80 N -4.12 3.01 0.00 4.97 3.41 -1.18 -4.99 113.62 114.72 2vuv n SER 80 Ca 0.00 -0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 2vuv n SER 80 Cb 0.42 1.35 0.00 0.00 -0.26 0.00 0.00 64.21 65.72 2vuv n SER 80 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vuv n GLY 81 N 2.00 0.31 3.76 5.00 0.00 0.80 -5.00 105.19 112.05 2vuv n GLY 81 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 2vuv n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vuv s ALA 82 N -1.63 3.39 0.79 4.61 0.00 -1.23 -4.73 121.76 122.97 2vuv s ALA 82 Ca 0.00 0.85 -0.12 0.00 0.00 0.00 0.00 51.96 52.68 2vuv s ALA 82 Cb 0.00 -3.31 0.07 0.00 0.00 0.00 0.00 23.12 19.88 2vuv s ALA 82 CO 0.00 -0.11 1.16 0.00 0.00 0.00 0.00 175.76 176.81 2vuv s ALA 83 N -1.10 1.96 0.74 0.00 0.00 -1.26 -0.87 121.76 121.23 2vuv s ALA 83 Ca 0.44 0.64 -0.13 0.00 0.00 0.00 0.00 51.96 52.90 2vuv s ALA 83 Cb -0.31 -3.41 0.05 0.00 0.00 0.00 0.00 23.12 19.44 2vuv s ALA 83 CO 0.39 -2.10 1.14 -0.06 0.00 0.00 0.00 175.76 175.14 2vuv s PHE 84 N -2.42 2.27 0.19 0.00 0.08 -1.25 -4.78 117.98 112.07 2vuv s PHE 84 Ca 0.69 1.61 0.00 0.00 0.12 0.00 0.00 56.93 59.34 2vuv s PHE 84 Cb -0.24 -3.28 0.00 0.00 -0.57 0.00 0.00 43.02 38.94 2vuv s PHE 84 CO 0.51 -2.19 0.00 -0.40 -0.10 0.00 0.00 175.22 173.04 2vuv n ASP 85 N -2.99 0.33 -4.74 1.36 5.68 -1.26 -5.03 116.55 109.90 2vuv n ASP 85 Ca 0.11 0.31 -0.41 0.00 -0.50 0.00 0.00 54.79 54.30 2vuv n ASP 85 Cb 0.52 0.09 -0.02 0.00 -1.14 0.00 0.00 41.12 40.56 2vuv n ASP 85 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 2vuv s TYR 86 N -2.00 3.06 0.02 2.11 5.04 -1.26 -5.02 117.35 119.30 2vuv s TYR 86 Ca 0.00 1.02 0.03 0.00 -2.44 0.00 0.00 57.07 55.68 2vuv s TYR 86 Cb 0.00 -3.80 -0.02 0.00 0.35 0.00 0.00 41.96 38.50 2vuv s TYR 86 CO 0.00 -2.61 -0.10 -0.51 -1.34 0.00 0.00 175.55 170.99 2vuv s LEU 87 N -0.18 2.14 -0.23 6.97 1.43 -1.26 -4.97 118.68 122.59 2vuv s LEU 87 Ca 0.60 -0.36 0.23 0.00 -1.03 0.00 0.00 54.13 53.57 2vuv s LEU 87 Cb -0.41 -0.40 0.49 0.00 0.03 0.00 0.00 46.19 45.90 2vuv s LEU 87 CO 0.41 -0.01 1.13 -1.14 0.23 0.00 0.00 176.35 176.97 2vuv n ARG 88 N 2.15 1.48 -1.73 1.70 3.00 -1.26 -5.11 116.66 116.89 2vuv n ARG 88 Ca -0.17 -3.23 -0.42 0.00 -0.00 0.00 0.00 57.85 54.02 2vuv n ARG 88 Cb 0.56 -1.33 -0.01 0.00 0.00 0.00 0.00 32.46 31.68 2vuv n ARG 88 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.63 178.54 2vuv n TRP 89 N -0.47 2.67 0.00 -0.14 7.02 -1.26 -1.49 117.44 123.76 2vuv n TRP 89 Ca 0.06 0.35 0.00 0.00 -1.02 0.00 0.00 57.50 56.89 2vuv n TRP 89 Cb 0.85 -2.54 0.00 0.00 -2.42 0.00 0.00 31.31 27.20 2vuv n TRP 89 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2vuv n GLY 90 N 1.75 -1.21 0.00 6.99 0.00 -0.25 -4.75 105.19 107.71 2vuv n GLY 90 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2vuv n GLY 90 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2vuv n ASN 92 N -0.15 0.00 -4.93 1.61 3.02 -1.26 -4.76 115.26 108.79 2vuv n ASN 92 Ca 0.00 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.26 2vuv n ASN 92 Cb 0.00 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.13 2vuv n ASN 92 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2vuv s GLU 93 N 0.00 3.45 -0.14 3.52 0.41 -1.26 -3.49 118.70 121.19 2vuv s GLU 93 Ca 0.00 -0.48 -0.29 0.00 -0.41 0.00 0.00 54.97 53.78 2vuv s GLU 93 Cb 0.00 -3.00 -0.01 0.00 -1.78 0.00 0.00 34.13 29.34 2vuv s GLU 93 CO 0.00 0.56 1.08 -1.25 -0.49 0.00 0.00 175.26 175.16 2vuv s PRO 94 N -2.81 4.35 0.00 0.39 0.04 -1.26 -4.86 135.00 130.84 2vuv s PRO 94 Ca 0.35 1.46 0.24 0.00 0.04 0.00 0.00 61.00 63.09 2vuv s PRO 94 Cb -0.12 -3.59 0.31 0.00 0.04 0.00 0.00 34.50 31.13 2vuv s PRO 94 CO 0.28 -0.47 1.29 0.27 0.04 0.00 0.00 177.00 178.42 2vuv n ASN 95 N 5.57 1.82 -3.97 6.66 6.94 -1.23 -4.99 115.26 126.07 2vuv n ASN 95 Ca 0.11 -1.39 -0.26 0.00 -0.02 0.00 0.00 54.58 53.01 2vuv n ASN 95 Cb 0.47 0.29 -0.02 0.00 -2.36 0.00 0.00 39.78 38.16 2vuv n ASN 95 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 2vuv n ASN 96 N -0.03 -0.52 -4.65 0.53 5.15 -1.26 -4.82 115.26 109.67 2vuv n ASN 96 Ca 0.11 -1.01 -0.43 0.00 -0.60 0.00 0.00 54.58 52.66 2vuv n ASN 96 Cb 0.44 -3.03 -0.03 0.00 -0.53 0.00 0.00 39.78 36.63 2vuv n ASN 96 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2vuv s SER 97 N -4.30 6.50 0.00 1.20 0.15 -1.26 -0.75 113.70 115.24 2vuv s SER 97 Ca 0.06 2.02 0.00 0.00 0.70 0.00 0.00 55.95 58.72 2vuv s SER 97 Cb -0.03 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.75 2vuv s SER 97 CO 0.89 -1.10 0.00 0.61 1.20 0.00 0.00 173.24 174.84 2vuv n GLY 98 N 4.41 1.20 2.32 9.45 0.00 -1.26 -4.25 105.19 117.05 2vuv n GLY 98 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2vuv n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vuv n GLY 99 N -2.00 0.88 1.04 -0.02 0.00 0.07 -4.88 105.19 100.28 2vuv n GLY 99 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 2vuv n GLY 99 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2vuv n ASN 100 N 0.00 1.26 -4.41 1.61 6.94 -1.26 -4.99 115.26 114.40 2vuv n ASN 100 Ca 0.00 -2.76 -0.44 0.00 -0.02 0.00 0.00 54.58 51.36 2vuv n ASN 100 Cb 0.00 -0.38 -0.03 0.00 -2.36 0.00 0.00 39.78 37.00 2vuv n ASN 100 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2vuv s GLU 101 N -1.33 3.36 0.00 -3.83 2.02 -1.26 -4.08 118.70 113.57 2vuv s GLU 101 Ca 0.33 -1.58 0.04 0.00 0.02 0.00 0.00 54.97 53.79 2vuv s GLU 101 Cb 0.35 -4.54 0.11 0.00 0.10 0.00 0.00 34.13 30.15 2vuv s GLU 101 CO -0.11 -1.65 1.03 -0.25 0.02 0.00 0.00 175.26 174.30 2vuv n ASP 102 N 6.32 2.21 -4.22 -0.19 8.00 -1.06 -4.43 116.55 123.18 2vuv n ASP 102 Ca 0.08 -1.87 -0.19 0.00 0.71 0.00 0.00 54.79 53.52 2vuv n ASP 102 Cb 0.46 -0.08 -0.12 0.00 -0.02 0.00 0.00 41.12 41.37 2vuv n ASP 102 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2vuv s LEU 104 N -2.12 4.33 0.30 0.00 2.96 -0.64 -0.82 118.68 122.69 2vuv s LEU 104 Ca 0.05 0.45 -0.06 0.00 -0.22 0.00 0.00 54.13 54.34 2vuv s LEU 104 Cb -0.07 -2.15 -0.00 0.00 0.50 0.00 0.00 46.19 44.47 2vuv s LEU 104 CO 0.03 0.31 0.45 -1.38 -1.32 0.00 0.00 176.35 174.44 2vuv s HIS 105 N -0.52 0.81 -0.08 5.38 -3.43 -0.73 -1.31 115.29 115.42 2vuv s HIS 105 Ca 0.14 -1.10 -0.22 0.00 -0.80 0.00 0.00 55.06 53.08 2vuv s HIS 105 Cb -0.12 -0.02 -0.04 0.00 -1.43 0.00 0.00 32.58 30.98 2vuv s HIS 105 CO 0.03 -1.05 0.65 0.71 -2.00 0.00 0.00 174.74 173.08 2vuv s TYR 106 N -3.47 3.56 -0.19 0.38 2.02 -0.54 -1.16 117.35 117.95 2vuv s TYR 106 Ca 0.28 1.16 -0.00 0.00 -0.37 0.00 0.00 57.07 58.14 2vuv s TYR 106 Cb 0.00 -2.75 0.05 0.00 -0.40 0.00 0.00 41.96 38.86 2vuv s TYR 106 CO 0.15 0.10 -0.05 1.21 -1.57 0.00 0.00 175.55 175.39 2vuv s ASN 107 N 0.76 3.13 -1.48 2.29 2.47 -0.03 -0.67 114.94 121.41 2vuv s ASN 107 Ca 0.35 -0.81 -0.12 0.00 0.42 0.00 0.00 52.86 52.69 2vuv s ASN 107 Cb -0.17 -0.99 0.06 0.00 -1.45 0.00 0.00 41.25 38.70 2vuv s ASN 107 CO 0.16 -0.20 1.05 0.79 -3.72 0.00 0.00 177.10 175.18 2vuv n TRP 108 N 4.82 -2.48 -1.34 0.43 7.02 0.47 -2.02 117.44 124.33 2vuv n TRP 108 Ca -0.12 0.94 -0.12 0.00 -1.02 0.00 0.00 57.50 57.18 2vuv n TRP 108 Cb 0.47 -4.29 -0.05 0.00 -2.42 0.00 0.00 31.31 25.01 2vuv n TRP 108 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2vuv n LEU 109 N -4.79 -0.70 -4.36 -0.99 4.77 -1.26 -4.97 117.00 104.70 2vuv n LEU 109 Ca 0.03 0.29 -0.18 0.00 -0.03 0.00 0.00 56.01 56.12 2vuv n LEU 109 Cb 0.54 -2.14 -0.10 0.00 -2.33 0.00 0.00 43.42 39.38 2vuv n LEU 109 CO 0.73 -0.77 -0.30 -0.94 -1.33 0.00 0.00 177.39 174.78 2vuv s SER 110 N -2.66 1.87 0.41 -1.43 1.04 -0.86 -5.00 113.70 107.07 2vuv s SER 110 Ca 0.00 -1.30 -0.25 0.00 0.48 0.00 0.00 55.95 54.88 2vuv s SER 110 Cb 0.00 0.01 -0.08 0.00 0.10 0.00 0.00 66.02 66.05 2vuv s SER 110 CO 0.00 -0.58 1.19 0.26 0.98 0.00 0.00 173.24 175.09 2vuv s TRP 111 N -3.45 3.00 -0.00 5.02 0.52 -0.56 -0.85 118.94 122.63 2vuv s TRP 111 Ca 0.33 1.53 -0.09 0.00 0.02 0.00 0.00 56.10 57.89 2vuv s TRP 111 Cb 0.07 -3.44 0.01 0.00 -1.15 0.00 0.00 33.47 28.96 2vuv s TRP 111 CO 0.12 -1.47 0.18 1.21 0.02 0.00 0.00 176.95 177.01 2vuv s ASN 112 N -1.09 -0.03 -0.04 2.95 2.47 -0.31 -1.09 114.94 117.79 2vuv s ASN 112 Ca 0.58 -0.13 -0.19 0.00 0.42 0.00 0.00 52.86 53.54 2vuv s ASN 112 Cb -0.32 0.24 -0.05 0.00 -1.45 0.00 0.00 41.25 39.67 2vuv s ASN 112 CO 0.40 -0.38 0.55 1.51 -3.72 0.00 0.00 177.10 175.45 2vuv s ASP 113 N -1.35 6.88 0.02 -4.21 -4.77 -1.26 -1.77 116.67 110.21 2vuv s ASP 113 Ca -0.14 1.05 -0.02 0.00 -3.30 0.00 0.00 52.55 50.13 2vuv s ASP 113 Cb -0.07 -2.33 -0.01 0.00 -1.09 0.00 0.00 42.92 39.41 2vuv s ASP 113 CO 0.02 0.08 0.02 -0.22 0.70 0.00 0.00 175.17 175.78 2vuv s LEU 114 N -0.00 2.03 0.31 2.11 2.96 0.00 -4.85 118.68 121.24 2vuv s LEU 114 Ca 0.29 -0.42 -0.29 0.00 -0.22 0.00 0.00 54.13 53.49 2vuv s LEU 114 Cb -0.17 0.28 -0.12 0.00 0.50 0.00 0.00 46.19 46.68 2vuv s LEU 114 CO 0.15 -0.33 1.46 -2.11 -1.32 0.00 0.00 176.35 174.20 2vuv n ARG 115 N 1.53 2.41 0.26 1.98 1.85 -1.26 -1.80 116.66 121.63 2vuv n ARG 115 Ca -0.24 0.85 0.17 0.00 -1.00 0.00 0.00 57.85 57.64 2vuv n ARG 115 Cb 0.55 -2.54 0.74 0.00 -1.05 0.00 0.00 32.46 30.16 2vuv n ARG 115 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2vuv n HIS 117 N -2.91 0.98 -1.73 0.00 8.25 -1.26 -1.26 115.22 117.29 2vuv n HIS 117 Ca 0.00 -0.64 -0.40 0.00 -0.26 0.00 0.00 57.72 56.42 2vuv n HIS 117 Cb 0.24 -0.18 0.02 0.00 1.12 0.00 0.00 29.99 31.19 2vuv n HIS 117 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 2vuv n TYR 118 N 0.49 2.34 -3.32 4.41 9.36 -0.89 -4.71 117.16 124.84 2vuv n TYR 118 Ca 0.20 0.46 -0.45 0.00 3.32 0.00 0.00 57.90 61.43 2vuv n TYR 118 Cb 0.73 -2.40 -0.07 0.00 -0.63 0.00 0.00 39.34 36.97 2vuv n TYR 118 CO 0.00 0.00 0.00 -0.65 0.22 0.00 0.00 176.86 176.43 2vuv s GLN 119 N -2.45 3.00 0.35 2.98 -1.52 -1.26 -3.96 119.66 116.79 2vuv s GLN 119 Ca 0.64 -1.38 0.08 0.00 -1.95 0.00 0.00 55.36 52.74 2vuv s GLN 119 Cb -0.46 -4.18 -0.07 0.00 -0.22 0.00 0.00 33.01 28.08 2vuv s GLN 119 CO 0.56 -1.16 -0.06 0.00 -0.25 0.00 0.00 175.29 174.38 2vuv s ALA 120 N 1.81 2.85 1.10 6.09 0.00 -0.70 -4.55 121.76 128.37 2vuv s ALA 120 Ca 0.06 -2.10 -0.14 0.00 0.00 0.00 0.00 51.96 49.77 2vuv s ALA 120 Cb -0.25 0.09 0.21 0.00 0.00 0.00 0.00 23.12 23.17 2vuv s ALA 120 CO 0.06 -0.02 0.92 0.43 0.00 0.00 0.00 175.76 177.16 2vuv n SER 121 N -0.79 -0.95 -3.55 0.00 7.64 -1.26 -0.88 113.62 113.83 2vuv n SER 121 Ca -0.05 -1.18 -0.13 0.00 1.01 0.00 0.00 58.87 58.53 2vuv n SER 121 Cb 0.64 -0.78 -0.04 0.00 -1.01 0.00 0.00 64.21 63.03 2vuv n SER 121 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 2vuv s TYR 122 N -2.85 -0.41 -0.10 1.43 -0.85 -0.67 -1.06 117.35 112.85 2vuv s TYR 122 Ca 0.56 0.33 0.03 0.00 -0.52 0.00 0.00 57.07 57.46 2vuv s TYR 122 Cb -0.04 0.38 -0.01 0.00 0.38 0.00 0.00 41.96 42.67 2vuv s TYR 122 CO 0.41 -0.70 -0.18 -0.51 -1.52 0.00 0.00 175.55 173.05 2vuv s LEU 123 N -2.32 2.47 0.19 -3.49 1.43 -1.07 -0.63 118.68 115.27 2vuv s LEU 123 Ca -0.02 -0.39 0.08 0.00 -1.03 0.00 0.00 54.13 52.77 2vuv s LEU 123 Cb -0.00 -1.52 -0.04 0.00 0.03 0.00 0.00 46.19 44.66 2vuv s LEU 123 CO -0.06 0.21 -0.01 0.00 0.23 0.00 0.00 176.35 176.72 2vuv s GLN 125 N -3.08 0.52 0.08 0.00 -2.07 0.19 -1.49 119.66 113.81 2vuv s GLN 125 Ca 0.28 -0.53 -0.07 0.00 -1.82 0.00 0.00 55.36 53.21 2vuv s GLN 125 Cb -0.09 -0.39 -0.01 0.00 -1.09 0.00 0.00 33.01 31.43 2vuv s GLN 125 CO 0.18 0.09 0.16 -0.98 -1.32 0.00 0.00 175.29 173.42 2vuv s ARG 126 N -0.97 0.82 0.27 9.60 1.70 -0.09 -0.93 118.95 129.34 2vuv s ARG 126 Ca -0.04 -1.01 -0.29 0.00 -0.47 0.00 0.00 55.73 53.92 2vuv s ARG 126 Cb -0.07 0.32 -0.09 0.00 -0.57 0.00 0.00 34.95 34.54 2vuv s ARG 126 CO 0.00 -0.25 1.22 0.00 -1.08 0.00 0.00 175.30 175.19 2vuv s ALA 127 N -3.87 3.46 0.56 7.88 0.00 -1.26 -0.40 121.76 128.13 2vuv s ALA 127 Ca 0.06 1.06 -0.21 0.00 0.00 0.00 0.00 51.96 52.87 2vuv s ALA 127 Cb 0.05 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 2vuv s ALA 127 CO -0.11 -0.41 1.28 0.00 0.00 0.00 0.00 175.76 176.52 2vuv s ALA 128 N -0.76 2.70 -2.43 0.00 0.00 -0.33 -4.76 121.76 116.18 2vuv s ALA 128 Ca 0.49 1.16 0.19 0.00 0.00 0.00 0.00 51.96 53.81 2vuv s ALA 128 Cb -0.35 -3.50 0.15 0.00 0.00 0.00 0.00 23.12 19.42 2vuv s ALA 128 CO 0.44 -1.23 1.12 0.39 0.00 0.00 0.00 175.76 176.47