#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vh3 s ALA 3 N 0.00 1.48 -0.13 0.00 0.00 -1.26 -4.51 121.76 117.33 2vh3 s ALA 3 Ca 0.00 -0.95 -0.37 0.00 0.00 0.00 0.00 51.96 50.64 2vh3 s ALA 3 Cb 0.00 -1.24 -0.14 0.00 0.00 0.00 0.00 23.12 21.74 2vh3 s ALA 3 CO 0.00 -1.04 1.73 0.00 0.00 0.00 0.00 175.76 176.45 2vh3 n SER 5 N 5.28 1.05 -4.07 0.00 3.41 -1.26 -5.02 113.62 113.00 2vh3 n SER 5 Ca 0.23 -1.02 -0.08 0.00 -0.26 0.00 0.00 58.87 57.74 2vh3 n SER 5 Cb 0.21 0.40 -0.10 0.00 -0.26 0.00 0.00 64.21 64.45 2vh3 n SER 5 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2vh3 s PHE 6 N -0.95 0.51 0.62 7.33 -0.12 -1.26 -4.98 117.98 119.13 2vh3 s PHE 6 Ca 0.06 -0.92 -0.13 0.00 -0.05 0.00 0.00 56.93 55.88 2vh3 s PHE 6 Cb 0.05 -0.36 -0.03 0.00 -0.63 0.00 0.00 43.02 42.05 2vh3 s PHE 6 CO 0.14 -0.31 1.04 -1.25 -0.05 0.00 0.00 175.22 174.80 2vh3 s PRO 7 N -3.31 3.40 0.76 1.99 0.04 -1.26 -4.90 135.00 131.73 2vh3 s PRO 7 Ca 0.02 0.96 -0.13 0.00 0.04 0.00 0.00 61.00 61.90 2vh3 s PRO 7 Cb 0.03 -2.05 0.06 0.00 0.04 0.00 0.00 34.50 32.58 2vh3 s PRO 7 CO -0.07 -0.73 1.13 -1.25 0.04 0.00 0.00 177.00 176.12 2vh3 s PRO 8 N -4.66 2.13 0.46 0.56 0.04 -1.24 -4.81 135.00 127.48 2vh3 s PRO 8 Ca 0.59 1.42 -0.24 0.00 0.04 0.00 0.00 61.00 62.81 2vh3 s PRO 8 Cb -0.13 -1.86 -0.07 0.00 0.04 0.00 0.00 34.50 32.47 2vh3 s PRO 8 CO 0.46 -1.78 1.26 0.45 0.04 0.00 0.00 177.00 177.43 2vh3 s SER 9 N -2.76 6.04 0.14 6.66 0.15 0.16 -4.94 113.70 119.16 2vh3 s SER 9 Ca 0.66 2.53 0.25 0.00 0.70 0.00 0.00 55.95 60.10 2vh3 s SER 9 Cb -0.22 -2.62 0.94 0.00 -1.71 0.00 0.00 66.02 62.41 2vh3 s SER 9 CO 0.50 -1.03 1.78 -0.62 1.20 0.00 0.00 173.24 175.08 2vh3 n GLU 10 N -0.36 0.15 -2.83 5.44 1.02 -1.26 -4.17 120.64 118.63 2vh3 n GLU 10 Ca 0.07 0.19 -0.22 0.00 -0.02 0.00 0.00 57.16 57.17 2vh3 n GLU 10 Cb 0.46 -1.70 -0.02 0.00 -0.02 0.00 0.00 31.44 30.16 2vh3 n GLU 10 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 2vh3 n ILE 11 N -1.98 1.88 0.26 -3.67 -5.35 -1.26 -4.93 119.36 104.31 2vh3 n ILE 11 Ca 0.05 -4.82 0.11 0.00 -0.27 0.00 0.00 62.75 57.82 2vh3 n ILE 11 Cb 0.35 -0.80 0.71 0.00 -1.74 0.00 0.00 39.64 38.15 2vh3 n ILE 11 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 2vh3 h PRO 12 N 2.88 0.00 -0.00 6.28 0.13 -1.85 -1.04 132.00 138.40 2vh3 h PRO 12 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2vh3 h PRO 12 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 2vh3 h PRO 12 CO 0.71 0.09 -0.00 0.41 -0.23 0.00 0.00 178.00 178.98 2vh3 n GLY 13 N -1.03 -1.48 3.77 1.56 0.00 -1.26 -1.09 105.19 105.66 2vh3 n GLY 13 Ca -0.02 -0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.51 2vh3 n GLY 13 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2vh3 s SER 14 N -2.97 7.33 0.54 1.61 0.15 -0.39 -4.94 113.70 115.03 2vh3 s SER 14 Ca 0.15 1.92 0.36 0.00 0.70 0.00 0.00 55.95 59.08 2vh3 s SER 14 Cb 0.19 -2.59 1.78 0.00 -1.71 0.00 0.00 66.02 63.69 2vh3 s SER 14 CO 0.53 -0.07 2.08 0.11 1.20 0.00 0.00 173.24 177.09 2vh3 h LYS 15 N 3.36 0.00 -0.11 5.44 1.57 -1.91 -2.31 116.57 122.60 2vh3 h LYS 15 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 2vh3 h LYS 15 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.51 2vh3 h LYS 15 CO 0.65 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.92 2vh3 n GLU 16 N -2.87 1.88 -0.11 3.15 1.02 -1.26 -4.62 120.64 117.83 2vh3 n GLU 16 Ca -0.01 -1.30 -0.06 0.00 -0.02 0.00 0.00 57.16 55.77 2vh3 n GLU 16 Cb 0.15 -1.45 0.02 0.00 -0.02 0.00 0.00 31.44 30.14 2vh3 n GLU 16 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2vh3 h LEU 18 N 0.27 0.86 -1.00 0.00 3.38 -1.83 -0.85 115.31 116.14 2vh3 h LEU 18 Ca 0.17 -0.56 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 2vh3 h LEU 18 Cb 0.16 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 2vh3 h LEU 18 CO -0.18 1.26 0.45 0.00 0.09 0.00 0.00 178.44 180.06 2vh3 h ALA 19 N 0.62 1.24 -0.47 1.53 0.00 -1.61 -0.73 119.26 119.84 2vh3 h ALA 19 Ca -0.00 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 2vh3 h ALA 19 Cb 1.13 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2vh3 h ALA 19 CO 0.11 0.62 -0.17 1.49 0.00 0.00 0.00 179.25 181.30 2vh3 h GLU 20 N 1.16 0.92 -0.58 0.00 4.22 -0.77 -1.15 114.58 118.38 2vh3 h GLU 20 Ca 0.29 -0.36 -0.06 0.00 0.08 0.00 0.00 59.36 59.31 2vh3 h GLU 20 Cb 0.03 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 2vh3 h GLU 20 CO -0.05 1.02 0.11 0.00 -2.18 0.00 0.00 179.01 177.91 2vh3 h ALA 21 N 0.99 1.11 -0.54 2.92 0.00 -0.69 -1.16 119.26 121.87 2vh3 h ALA 21 Ca 0.12 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 2vh3 h ALA 21 Cb 0.71 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2vh3 h ALA 21 CO 0.05 0.59 0.08 1.25 0.00 0.00 0.00 179.25 181.23 2vh3 h LEU 22 N 0.87 0.87 -0.63 0.00 5.85 -0.95 -0.77 115.31 120.55 2vh3 h LEU 22 Ca 0.18 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 2vh3 h LEU 22 Cb 0.36 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 2vh3 h LEU 22 CO 0.01 0.91 0.30 -0.61 -0.34 0.00 0.00 178.44 178.71 2vh3 h GLN 23 N 0.79 0.90 0.00 1.25 4.15 -0.77 -3.30 115.11 118.13 2vh3 h GLN 23 Ca 0.16 -0.13 -0.21 0.00 0.77 0.00 0.00 58.65 59.25 2vh3 h GLN 23 Cb 0.42 -0.16 -0.03 0.00 0.21 0.00 0.00 27.48 27.91 2vh3 h GLN 23 CO 0.01 0.72 -1.38 0.87 -1.93 0.00 0.00 178.83 177.13 2vh3 h LYS 24 N 0.86 0.00 -4.69 1.69 1.79 -1.06 -3.46 116.57 111.70 2vh3 h LYS 24 Ca 0.22 0.00 -0.63 0.00 -2.18 0.00 0.00 60.65 58.06 2vh3 h LYS 24 Cb 0.12 0.00 -0.36 0.00 -1.58 0.00 0.00 32.23 30.40 2vh3 h LYS 24 CO -0.03 0.44 -0.82 -1.01 -1.08 0.00 0.00 179.45 176.95 2vh3 s HIS 25 N -2.80 2.52 0.31 -1.35 3.76 -0.31 -5.00 115.29 112.42 2vh3 s HIS 25 Ca -0.02 -1.62 0.01 0.00 -0.15 0.00 0.00 55.06 53.28 2vh3 s HIS 25 Cb 0.08 -1.70 0.55 0.00 1.11 0.00 0.00 32.58 32.62 2vh3 s HIS 25 CO 0.81 -0.76 1.94 1.96 -0.85 0.00 0.00 174.74 177.85 2vh3 h GLN 26 N 7.96 0.97 -0.59 1.40 4.20 -1.86 -2.09 115.11 125.09 2vh3 h GLN 26 Ca -0.31 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.31 2vh3 h GLN 26 Cb 1.10 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 28.64 2vh3 h GLN 26 CO 0.51 0.64 0.26 0.78 -0.67 0.00 0.00 178.83 180.35 2vh3 h GLY 27 N 1.00 0.90 1.51 3.46 0.00 -1.94 0.23 103.07 108.22 2vh3 h GLY 27 Ca 0.34 -0.43 -0.19 0.00 0.00 0.00 0.00 47.33 47.05 2vh3 h GLY 27 CO -0.11 0.41 -0.71 -2.75 0.00 0.00 0.00 176.54 173.39 2vh3 h PHE 28 N 0.83 0.65 -0.44 5.60 3.57 -1.72 -2.46 116.94 122.98 2vh3 h PHE 28 Ca 0.20 -0.28 -0.00 0.00 3.53 0.00 0.00 57.97 61.42 2vh3 h PHE 28 Cb 0.12 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 2vh3 h PHE 28 CO 0.01 1.04 0.26 0.87 -2.23 0.00 0.00 178.31 178.26 2vh3 h LYS 29 N 0.34 0.59 -0.06 1.11 1.57 -0.86 -0.32 116.57 118.94 2vh3 h LYS 29 Ca -0.03 -0.06 0.03 0.00 -1.87 0.00 0.00 60.65 58.73 2vh3 h LYS 29 Cb 1.28 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 33.43 2vh3 h LYS 29 CO 0.13 0.44 -0.16 0.87 -0.57 0.00 0.00 179.45 180.16 2vh3 h LYS 30 N 0.58 -0.22 -0.14 3.15 1.57 -0.42 0.25 116.57 121.33 2vh3 h LYS 30 Ca 0.16 0.02 -0.12 0.00 -1.87 0.00 0.00 60.65 58.83 2vh3 h LYS 30 Cb 0.00 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 2vh3 h LYS 30 CO -0.03 -0.15 -0.44 0.87 -0.57 0.00 0.00 179.45 179.13 2vh3 h LYS 31 N -0.23 0.34 -0.21 3.15 1.79 -1.35 -0.77 116.57 119.29 2vh3 h LYS 31 Ca 0.07 -0.17 -0.06 0.00 -2.18 0.00 0.00 60.65 58.31 2vh3 h LYS 31 Cb 0.33 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.98 2vh3 h LYS 31 CO -0.20 0.72 -0.09 0.77 -1.08 0.00 0.00 179.45 179.57 2vh3 h SER 32 N 0.28 0.44 0.22 0.86 0.02 -0.67 -1.87 113.55 112.84 2vh3 h SER 32 Ca 0.02 -0.40 -0.18 0.00 -0.84 0.00 0.00 61.79 60.39 2vh3 h SER 32 Cb 0.89 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.31 2vh3 h SER 32 CO 0.07 0.75 -0.69 1.88 -1.14 0.00 0.00 176.83 177.70 2vh3 h TYR 33 N 0.14 0.56 -0.71 3.45 0.99 -0.47 -1.86 116.97 119.06 2vh3 h TYR 33 Ca 0.05 -0.23 0.03 0.00 2.00 0.00 0.00 58.73 60.57 2vh3 h TYR 33 Cb 0.58 -0.09 -0.04 0.00 1.00 0.00 0.00 36.73 38.17 2vh3 h TYR 33 CO 0.06 0.98 0.45 0.00 -0.00 0.00 0.00 178.16 179.65 2vh3 h ALA 34 N 0.96 0.93 -0.70 3.88 0.00 -1.14 -1.25 119.26 121.94 2vh3 h ALA 34 Ca -0.02 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.91 2vh3 h ALA 34 Cb 1.25 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 2vh3 h ALA 34 CO 0.12 0.23 0.41 1.25 0.00 0.00 0.00 179.25 181.26 2vh3 h LEU 35 N 0.87 0.63 -0.18 0.00 5.85 -0.97 -0.84 115.31 120.68 2vh3 h LEU 35 Ca 0.28 0.02 0.01 0.00 0.84 0.00 0.00 57.88 59.03 2vh3 h LEU 35 Cb 0.02 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 2vh3 h LEU 35 CO -0.11 0.42 0.11 0.40 -0.34 0.00 0.00 178.44 178.92 2vh3 h ILE 36 N 0.77 1.03 -0.51 4.05 2.04 -0.79 0.92 117.51 125.02 2vh3 h ILE 36 Ca 0.30 -0.08 0.04 0.00 1.00 0.00 0.00 64.86 66.13 2vh3 h ILE 36 Cb 0.13 0.78 -0.04 0.00 -0.74 0.00 0.00 36.82 36.96 2vh3 h ILE 36 CO -0.16 0.04 0.26 0.00 0.00 0.00 0.00 178.15 178.29 2vh3 h ALA 38 N 1.27 0.99 -0.58 0.00 0.00 -0.79 -2.62 119.26 117.53 2vh3 h ALA 38 Ca 0.22 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2vh3 h ALA 38 Cb 0.13 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2vh3 h ALA 38 CO -0.15 0.67 0.36 -0.92 0.00 0.00 0.00 179.25 179.21 2vh3 h TYR 39 N 1.12 0.76 0.00 0.00 3.20 -0.35 -1.87 116.97 119.83 2vh3 h TYR 39 Ca 0.24 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.11 2vh3 h TYR 39 Cb 0.31 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.33 2vh3 h TYR 39 CO 0.03 0.51 -0.02 -0.07 -1.64 0.00 0.00 178.16 176.97 2vh3 h LEU 40 N 0.79 0.00 -3.21 2.82 3.38 -0.80 -1.46 115.31 116.83 2vh3 h LEU 40 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2vh3 h LEU 40 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2vh3 h LEU 40 CO -0.04 0.02 0.00 0.59 0.09 0.00 0.00 178.44 179.10 2vh3 n ASN 41 N -4.27 4.42 -0.25 -0.43 3.02 -0.99 -4.73 115.26 112.03 2vh3 n ASN 41 Ca -0.03 -2.62 0.04 0.00 -0.03 0.00 0.00 54.58 51.95 2vh3 n ASN 41 Cb 0.10 -0.53 0.17 0.00 -0.61 0.00 0.00 39.78 38.91 2vh3 n ASN 41 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 2vh3 h TYR 42 N 3.14 0.53 0.00 3.10 3.20 -0.44 -1.91 116.97 124.58 2vh3 h TYR 42 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2vh3 h TYR 42 Cb 1.43 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 39.58 2vh3 h TYR 42 CO 0.67 0.10 0.00 0.87 -1.64 0.00 0.00 178.16 178.16 2vh3 h LYS 43 N 0.47 0.00 0.00 1.82 1.57 -1.84 -1.99 116.57 116.60 2vh3 h LYS 43 Ca 0.40 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 2vh3 h LYS 43 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 2vh3 h LYS 43 CO -0.37 0.00 -0.78 0.39 -0.57 0.00 0.00 179.45 178.12 2vh3 n GLU 44 N -2.82 2.01 -3.18 3.15 1.02 -0.77 -4.89 120.64 115.16 2vh3 n GLU 44 Ca -0.00 -0.01 -0.02 0.00 -0.02 0.00 0.00 57.16 57.10 2vh3 n GLU 44 Cb 0.19 -1.21 -0.02 0.00 -0.02 0.00 0.00 31.44 30.38 2vh3 n GLU 44 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2vh3 s ASP 45 N -2.50 -1.15 0.25 1.62 -1.08 -0.76 -5.01 116.67 108.05 2vh3 s ASP 45 Ca 0.05 -1.03 0.09 0.00 -0.52 0.00 0.00 52.55 51.14 2vh3 s ASP 45 Cb 0.11 1.75 0.28 0.00 -1.46 0.00 0.00 42.92 43.60 2vh3 s ASP 45 CO 0.60 -0.17 1.57 0.00 0.52 0.00 0.00 175.17 177.70 2vh3 h ALA 46 N 6.75 0.89 -0.43 3.66 0.00 -1.81 -3.13 119.26 125.19 2vh3 h ALA 46 Ca 0.05 -0.60 -0.08 0.00 0.00 0.00 0.00 54.91 54.28 2vh3 h ALA 46 Cb 1.15 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2vh3 h ALA 46 CO 0.10 0.82 -0.05 0.93 0.00 0.00 0.00 179.25 181.05 2vh3 h GLU 47 N 0.02 0.79 -0.59 0.00 5.08 -1.95 -0.06 114.58 117.89 2vh3 h GLU 47 Ca -0.01 -0.28 -0.00 0.00 -1.00 0.00 0.00 59.36 58.07 2vh3 h GLU 47 Cb 1.17 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.34 2vh3 h GLU 47 CO 0.09 0.89 0.35 -0.97 -1.00 0.00 0.00 179.01 178.37 2vh3 h ASN 48 N 0.62 0.71 -0.45 1.42 -1.24 -1.97 -0.74 115.58 113.93 2vh3 h ASN 48 Ca 0.11 -0.06 0.01 0.00 0.71 0.00 0.00 56.30 57.07 2vh3 h ASN 48 Cb 0.57 -0.18 -0.03 0.00 0.73 0.00 0.00 38.32 39.41 2vh3 h ASN 48 CO 0.03 0.57 0.28 0.22 -1.29 0.00 0.00 177.43 177.24 2vh3 h TYR 49 N 0.79 0.53 -0.67 0.67 3.20 -1.42 -0.19 116.97 119.88 2vh3 h TYR 49 Ca 0.21 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.12 2vh3 h TYR 49 Cb -0.01 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.04 2vh3 h TYR 49 CO -0.02 0.32 0.42 0.93 -1.64 0.00 0.00 178.16 178.18 2vh3 h GLU 50 N 0.57 0.81 -0.07 1.82 5.08 -0.48 0.15 114.58 122.46 2vh3 h GLU 50 Ca 0.17 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 2vh3 h GLU 50 Cb -0.03 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.03 2vh3 h GLU 50 CO -0.06 0.54 0.02 0.00 -1.00 0.00 0.00 179.01 178.51 2vh3 h ARG 51 N 0.84 0.12 -0.57 2.33 3.08 -0.94 -1.36 114.38 117.87 2vh3 h ARG 51 Ca 0.27 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.29 2vh3 h ARG 51 Cb 0.00 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.01 2vh3 h ARG 51 CO -0.10 0.29 0.36 0.00 -1.07 0.00 0.00 179.97 179.46 2vh3 h ALA 52 N 0.82 1.58 -0.37 0.04 0.00 -0.66 -0.28 119.26 120.37 2vh3 h ALA 52 Ca 0.02 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 2vh3 h ALA 52 Cb 0.22 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2vh3 h ALA 52 CO -0.00 0.39 -0.29 0.00 0.00 0.00 0.00 179.25 179.35 2vh3 h ALA 53 N 1.63 0.54 -0.69 0.00 0.00 -0.53 0.02 119.26 120.24 2vh3 h ALA 53 Ca 0.21 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 2vh3 h ALA 53 Cb -0.07 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2vh3 h ALA 53 CO -0.04 0.57 0.17 0.93 0.00 0.00 0.00 179.25 180.88 2vh3 h GLU 54 N 0.66 1.09 -0.45 0.00 5.08 -0.81 0.12 114.58 120.27 2vh3 h GLU 54 Ca 0.07 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.14 2vh3 h GLU 54 Cb 0.87 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 2vh3 h GLU 54 CO 0.08 0.95 0.15 -0.44 -1.00 0.00 0.00 179.01 178.75 2vh3 h ASP 55 N 1.03 0.66 -0.52 1.42 3.32 -0.86 -1.59 116.42 119.87 2vh3 h ASP 55 Ca 0.22 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 2vh3 h ASP 55 Cb 0.35 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 2vh3 h ASP 55 CO 0.00 0.68 0.29 0.15 -1.72 0.00 0.00 179.24 178.64 2vh3 h PHE 56 N 0.59 0.72 -0.82 4.55 3.57 -0.56 -0.79 116.94 124.21 2vh3 h PHE 56 Ca 0.15 -0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.71 2vh3 h PHE 56 Cb 0.26 -0.23 -0.07 0.00 2.79 0.00 0.00 35.95 38.70 2vh3 h PHE 56 CO 0.01 0.53 0.48 -0.44 -2.23 0.00 0.00 178.31 176.66 2vh3 h ASP 57 N 0.70 0.70 -0.33 0.41 3.32 -0.54 0.14 116.42 120.83 2vh3 h ASP 57 Ca 0.18 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.24 2vh3 h ASP 57 Cb 0.05 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2vh3 h ASP 57 CO -0.03 0.42 0.09 -1.28 -1.72 0.00 0.00 179.24 176.72 2vh3 h SER 58 N 0.82 0.48 -0.38 6.45 0.87 -0.82 -2.07 113.55 118.90 2vh3 h SER 58 Ca 0.38 -0.22 -0.03 0.00 -1.23 0.00 0.00 61.79 60.70 2vh3 h SER 58 Cb 0.30 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.11 2vh3 h SER 58 CO -0.22 0.57 0.15 0.00 -0.53 0.00 0.00 176.83 176.80 2vh3 h ALA 59 N 0.93 1.44 -0.78 6.23 0.00 -0.25 -2.03 119.26 124.80 2vh3 h ALA 59 Ca 0.10 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2vh3 h ALA 59 Cb 0.27 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 2vh3 h ALA 59 CO -0.00 0.42 0.35 0.28 0.00 0.00 0.00 179.25 180.30 2vh3 h VAL 60 N 0.63 1.25 -0.98 0.00 2.07 -0.46 -1.95 116.25 116.81 2vh3 h VAL 60 Ca 0.15 -0.75 0.01 0.00 0.82 0.00 0.00 66.70 66.93 2vh3 h VAL 60 Cb 0.17 0.29 -0.05 0.00 -1.52 0.00 0.00 31.29 30.19 2vh3 h VAL 60 CO -0.01 0.31 0.65 0.11 0.02 0.00 0.00 177.57 178.65 2vh3 h LYS 61 N 1.11 1.28 -0.16 1.57 1.57 -0.71 -1.68 116.57 119.56 2vh3 h LYS 61 Ca 0.26 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 2vh3 h LYS 61 Cb 0.16 -0.29 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 2vh3 h LYS 61 CO -0.03 0.85 0.07 0.00 -0.57 0.00 0.00 179.45 179.77 2vh3 h THR 63 N 0.22 1.19 0.00 0.00 1.35 -0.84 -3.30 112.91 111.53 2vh3 h THR 63 Ca 0.06 -1.37 0.00 0.00 -0.55 0.00 0.00 66.41 64.55 2vh3 h THR 63 Cb 0.05 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.22 2vh3 h THR 63 CO -0.01 0.38 0.00 0.61 -0.25 0.00 0.00 175.52 176.25 2vh3 n GLY 64 N -0.30 0.71 3.77 5.82 0.00 -0.91 0.39 105.19 114.67 2vh3 n GLY 64 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2vh3 n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vh3 h LYS 66 N 3.61 0.21 -6.83 0.00 1.57 -1.45 -3.46 116.57 110.21 2vh3 h LYS 66 Ca -0.50 -0.24 -0.55 0.00 -1.87 0.00 0.00 60.65 57.50 2vh3 h LYS 66 Cb 1.23 0.07 0.10 0.00 0.08 0.00 0.00 32.23 33.72 2vh3 h LYS 66 CO 0.69 0.98 0.69 -1.91 -0.57 0.00 0.00 179.45 179.34 2vh3 n GLU 67 N -3.64 2.46 -3.68 3.15 2.13 -1.26 -4.98 120.64 114.82 2vh3 n GLU 67 Ca -0.04 0.87 -0.37 0.00 0.66 0.00 0.00 57.16 58.28 2vh3 n GLU 67 Cb 0.83 -2.55 -0.06 0.00 0.27 0.00 0.00 31.44 29.93 2vh3 n GLU 67 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2vh3 s GLY 68 N -0.07 2.33 -0.42 8.31 0.00 -1.26 -5.06 107.32 111.16 2vh3 s GLY 68 Ca 0.56 -0.42 0.02 0.00 0.00 0.00 0.00 44.72 44.88 2vh3 s GLY 68 CO 0.60 -0.13 0.19 0.14 0.00 0.00 0.00 173.10 173.90 2vh3 s VAL 69 N -1.11 1.64 -0.51 1.40 1.01 -1.26 -5.04 120.40 116.53 2vh3 s VAL 69 Ca 0.21 -2.46 -0.26 0.00 0.00 0.00 0.00 61.98 59.48 2vh3 s VAL 69 Cb -0.14 -2.17 0.03 0.00 0.00 0.00 0.00 36.38 34.10 2vh3 s VAL 69 CO 0.10 -0.80 1.01 -0.62 0.00 0.00 0.00 175.10 174.79 2vh3 s ASP 70 N 0.54 6.46 0.17 3.32 -1.08 -1.26 -4.88 116.67 119.94 2vh3 s ASP 70 Ca 0.15 0.03 0.26 0.00 -0.52 0.00 0.00 52.55 52.47 2vh3 s ASP 70 Cb -0.23 -2.48 0.90 0.00 -1.46 0.00 0.00 42.92 39.66 2vh3 s ASP 70 CO -0.05 -1.21 1.80 0.18 0.52 0.00 0.00 175.17 176.41 2vh3 n LEU 71 N 7.57 0.64 -4.07 -1.34 4.77 -1.26 -4.45 117.00 118.86 2vh3 n LEU 71 Ca 0.06 0.56 -0.31 0.00 -0.03 0.00 0.00 56.01 56.29 2vh3 n LEU 71 Cb 0.48 -0.37 -0.01 0.00 -2.33 0.00 0.00 43.42 41.19 2vh3 n LEU 71 CO 0.66 -0.16 -0.06 1.41 -1.33 0.00 0.00 177.39 177.91 2vh3 n HIS 72 N -2.10 -1.84 0.32 -1.77 8.25 -1.26 -4.36 115.22 112.46 2vh3 n HIS 72 Ca 0.06 0.81 0.15 0.00 -0.26 0.00 0.00 57.72 58.48 2vh3 n HIS 72 Cb 0.40 -3.43 0.66 0.00 1.12 0.00 0.00 29.99 28.73 2vh3 n HIS 72 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 2vh3 h GLU 73 N -1.73 0.00 -0.29 -0.41 9.09 -1.92 -1.12 114.58 118.21 2vh3 h GLU 73 Ca -0.60 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.81 2vh3 h GLU 73 Cb 1.38 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.48 2vh3 h GLU 73 CO 0.71 0.00 0.00 0.41 0.05 0.00 0.00 179.01 180.18 2vh3 n GLY 74 N -0.24 1.16 2.95 1.06 0.00 -1.26 -4.61 105.19 104.25 2vh3 n GLY 74 Ca 0.01 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 2vh3 n GLY 74 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2vh3 s ASN 75 N -1.54 4.45 0.37 1.61 3.84 -0.42 -4.99 114.94 118.25 2vh3 s ASN 75 Ca 0.36 -2.49 0.17 0.00 0.21 0.00 0.00 52.86 51.11 2vh3 s ASN 75 Cb 0.21 -1.53 1.09 0.00 -0.55 0.00 0.00 41.25 40.46 2vh3 s ASN 75 CO 0.30 -0.32 1.72 -0.65 -2.79 0.00 0.00 177.10 175.36 2vh3 h PRO 76 N 7.15 0.38 0.00 0.43 0.11 -1.87 0.78 132.00 138.97 2vh3 h PRO 76 Ca -0.06 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.03 2vh3 h PRO 76 Cb 0.96 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.99 2vh3 h PRO 76 CO 0.58 0.25 0.00 1.05 -0.21 0.00 0.00 178.00 179.67 2vh3 h GLU 77 N 0.39 0.00 -0.05 1.05 4.11 -1.94 -3.08 114.58 115.06 2vh3 h GLU 77 Ca 0.66 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.09 2vh3 h GLU 77 Cb 1.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.85 2vh3 h GLU 77 CO -0.41 0.00 0.00 1.28 0.07 0.00 0.00 179.01 179.95 2vh3 n LEU 78 N -3.06 1.85 -0.25 3.06 4.77 0.20 -4.68 117.00 118.89 2vh3 n LEU 78 Ca 0.01 -1.17 -0.03 0.00 -0.03 0.00 0.00 56.01 54.79 2vh3 n LEU 78 Cb 0.30 -0.03 0.08 0.00 -2.33 0.00 0.00 43.42 41.44 2vh3 n LEU 78 CO 0.27 0.39 1.14 0.40 -1.33 0.00 0.00 177.39 178.26 2vh3 h ILE 79 N 1.58 1.08 -0.11 -0.08 1.08 -1.29 -0.57 117.51 119.19 2vh3 h ILE 79 Ca 0.00 -0.29 -0.01 0.00 -0.39 0.00 0.00 64.86 64.17 2vh3 h ILE 79 Cb 0.39 0.16 -0.00 0.00 -3.07 0.00 0.00 36.82 34.30 2vh3 h ILE 79 CO 0.00 0.15 0.03 -0.33 -0.69 0.00 0.00 178.15 177.32 2vh3 h GLU 80 N 0.84 0.17 -0.49 2.37 3.07 -1.83 -0.24 114.58 118.47 2vh3 h GLU 80 Ca 0.29 -0.04 -0.05 0.00 -0.50 0.00 0.00 59.36 59.06 2vh3 h GLU 80 Cb 0.05 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 27.91 2vh3 h GLU 80 CO -0.12 0.32 0.09 1.05 -1.40 0.00 0.00 179.01 178.95 2vh3 h GLU 81 N -0.01 0.76 -0.55 2.33 4.11 -1.80 -0.13 114.58 119.28 2vh3 h GLU 81 Ca 0.03 -0.16 -0.08 0.00 0.07 0.00 0.00 59.36 59.23 2vh3 h GLU 81 Cb 0.22 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2vh3 h GLU 81 CO -0.00 0.71 0.05 0.78 0.07 0.00 0.00 179.01 180.62 2vh3 h GLY 82 N 0.94 1.01 1.46 1.06 0.00 -0.85 -1.25 103.07 105.44 2vh3 h GLY 82 Ca 0.16 -0.70 -0.14 0.00 0.00 0.00 0.00 47.33 46.64 2vh3 h GLY 82 CO 0.00 0.65 -0.44 -2.75 0.00 0.00 0.00 176.54 174.01 2vh3 h PHE 83 N 0.82 0.70 -0.32 5.60 3.57 -0.68 -1.66 116.94 124.98 2vh3 h PHE 83 Ca 0.16 -0.22 -0.07 0.00 3.53 0.00 0.00 57.97 61.38 2vh3 h PHE 83 Cb 0.47 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 2vh3 h PHE 83 CO 0.03 0.92 -0.09 0.93 -2.23 0.00 0.00 178.31 177.88 2vh3 h GLU 84 N 0.47 0.53 -0.54 1.11 5.08 -0.79 -0.64 114.58 119.80 2vh3 h GLU 84 Ca 0.03 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 2vh3 h GLU 84 Cb 0.96 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.12 2vh3 h GLU 84 CO 0.09 0.62 0.16 -0.22 -1.00 0.00 0.00 179.01 178.65 2vh3 h LYS 85 N 0.49 0.85 -0.37 2.33 1.63 -0.93 -0.64 116.57 119.93 2vh3 h LYS 85 Ca 0.10 -0.19 0.07 0.00 -0.85 0.00 0.00 60.65 59.77 2vh3 h LYS 85 Cb 0.45 -0.12 -0.06 0.00 -0.60 0.00 0.00 32.23 31.90 2vh3 h LYS 85 CO 0.02 0.78 -0.01 0.35 -3.45 0.00 0.00 179.45 177.15 2vh3 h PHE 86 N 0.75 -0.04 -0.68 1.91 3.57 -0.80 0.34 116.94 121.99 2vh3 h PHE 86 Ca 0.17 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.62 2vh3 h PHE 86 Cb 0.30 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 2vh3 h PHE 86 CO 0.02 -0.08 0.12 -0.07 -2.23 0.00 0.00 178.31 176.07 2vh3 h LEU 87 N 0.09 1.06 -0.27 0.59 3.38 -0.78 -1.57 115.31 117.81 2vh3 h LEU 87 Ca 0.18 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 2vh3 h LEU 87 Cb 0.26 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2vh3 h LEU 87 CO -0.31 1.04 -0.11 0.00 0.09 0.00 0.00 178.44 179.15 2vh3 h ALA 88 N 1.08 0.38 -0.35 1.53 0.00 -0.89 0.42 119.26 121.42 2vh3 h ALA 88 Ca 0.21 -0.30 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 2vh3 h ALA 88 Cb 0.42 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2vh3 h ALA 88 CO 0.01 0.24 -0.30 0.77 0.00 0.00 0.00 179.25 179.97 2vh3 h SER 89 N 0.30 0.77 0.02 0.00 0.02 -0.77 -2.89 113.55 111.00 2vh3 h SER 89 Ca 0.06 -0.31 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2vh3 h SER 89 Cb 0.61 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.93 2vh3 h SER 89 CO 0.04 1.02 -0.05 0.18 -1.14 0.00 0.00 176.83 176.87 2vh3 n LEU 90 N -4.08 1.75 -3.53 5.07 4.32 -0.60 -3.85 117.00 116.07 2vh3 n LEU 90 Ca -0.01 -0.57 -0.21 0.00 -0.02 0.00 0.00 56.01 55.20 2vh3 n LEU 90 Cb 0.47 -0.02 0.08 0.00 -1.62 0.00 0.00 43.42 42.34 2vh3 n LEU 90 CO 0.45 0.30 0.17 0.29 -1.22 0.00 0.00 177.39 177.38 2vh3 n LYS 91 N 0.28 -7.21 -3.65 3.23 5.02 -0.41 -4.57 118.16 110.86 2vh3 n LYS 91 Ca 0.17 0.83 -0.36 0.00 -2.02 0.00 0.00 58.31 56.92 2vh3 n LYS 91 Cb 0.41 -5.85 -0.09 0.00 -0.02 0.00 0.00 35.03 29.48 2vh3 n LYS 91 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2vh3 s ILE 92 N -3.35 5.36 0.08 -0.18 1.01 0.00 -5.04 121.20 119.09 2vh3 s ILE 92 Ca 0.29 0.25 -0.31 0.00 0.00 0.00 0.00 60.65 60.88 2vh3 s ILE 92 Cb -0.13 -3.52 -0.06 0.00 0.01 0.00 0.00 42.46 38.76 2vh3 s ILE 92 CO 0.73 0.37 1.26 -0.62 0.00 0.00 0.00 174.94 176.69 2vh3 s ASP 93 N 0.81 6.99 0.58 3.58 -1.08 -1.26 -4.65 116.67 121.64 2vh3 s ASP 93 Ca 0.09 2.13 0.27 0.00 -0.52 0.00 0.00 52.55 54.53 2vh3 s ASP 93 Cb -0.13 -2.58 1.72 0.00 -1.46 0.00 0.00 42.92 40.47 2vh3 s ASP 93 CO 0.03 -0.53 2.22 -0.09 0.52 0.00 0.00 175.17 177.32 2vh3 h ARG 94 N 6.75 0.00 0.00 4.34 2.43 -1.97 0.31 114.38 126.23 2vh3 h ARG 94 Ca -0.42 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.74 2vh3 h ARG 94 Cb 1.21 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.76 2vh3 h ARG 94 CO 0.83 0.00 -0.07 0.87 -1.51 0.00 0.00 179.97 180.08 2vh3 h LYS 95 N 0.00 0.00 -0.01 0.20 1.57 -2.05 -3.03 116.57 113.24 2vh3 h LYS 95 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2vh3 h LYS 95 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2vh3 h LYS 95 CO -0.00 0.07 -0.02 0.00 -0.57 0.00 0.00 179.45 178.94 2vh3 n ALA 96 N -2.19 2.63 -0.06 3.86 0.00 0.10 -4.47 120.51 120.36 2vh3 n ALA 96 Ca -0.01 -0.40 -0.08 0.00 0.00 0.00 0.00 53.44 52.95 2vh3 n ALA 96 Cb 0.23 -1.22 -0.01 0.00 0.00 0.00 0.00 19.45 18.44 2vh3 n ALA 96 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2vh3 h LEU 97 N 1.88 0.04 -0.21 0.00 3.38 -1.63 -1.12 115.31 117.65 2vh3 h LEU 97 Ca 0.00 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.03 2vh3 h LEU 97 Cb 0.42 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 2vh3 h LEU 97 CO 0.00 0.05 0.04 1.23 0.09 0.00 0.00 178.44 179.85 2vh3 h GLY 98 N 0.16 0.23 0.97 0.83 0.00 -1.85 -1.53 103.07 101.88 2vh3 h GLY 98 Ca 0.12 -0.01 0.01 0.00 0.00 0.00 0.00 47.33 47.44 2vh3 h GLY 98 CO -0.14 -0.00 0.12 0.23 0.00 0.00 0.00 176.54 176.74 2vh3 h SER 99 N 0.12 0.20 -0.71 0.19 0.87 -1.77 -1.79 113.55 110.66 2vh3 h SER 99 Ca 0.10 -0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.60 2vh3 h SER 99 Cb 0.09 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 61.98 2vh3 h SER 99 CO -0.13 0.15 0.22 -0.07 -0.53 0.00 0.00 176.83 176.47 2vh3 h LEU 100 N 0.25 1.04 -0.41 2.23 3.38 -1.04 -1.81 115.31 118.95 2vh3 h LEU 100 Ca 0.08 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2vh3 h LEU 100 Cb -0.01 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 2vh3 h LEU 100 CO -0.03 0.97 0.27 0.00 0.09 0.00 0.00 178.44 179.74 2vh3 h THR 102 N 0.55 0.50 0.00 0.00 1.35 -0.68 -1.12 112.91 113.51 2vh3 h THR 102 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.01 2vh3 h THR 102 Cb -0.05 0.96 0.00 0.00 -1.73 0.00 0.00 68.15 67.33 2vh3 h THR 102 CO -0.03 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.42 2vh3 n LEU 103 N -3.82 0.52 -0.33 3.87 4.77 -0.64 -3.50 117.00 117.87 2vh3 n LEU 103 Ca -0.02 0.56 0.06 0.00 -0.03 0.00 0.00 56.01 56.58 2vh3 n LEU 103 Cb 0.14 -0.42 0.21 0.00 -2.33 0.00 0.00 43.42 41.02 2vh3 n LEU 103 CO 0.27 -0.20 1.18 0.15 -1.33 0.00 0.00 177.39 177.46 2vh3 h PHE 104 N 0.00 0.99 -0.96 -1.77 3.57 -1.08 -0.71 116.94 116.98 2vh3 h PHE 104 Ca 0.00 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.61 2vh3 h PHE 104 Cb 0.58 -0.30 -0.07 0.00 2.79 0.00 0.00 35.95 38.95 2vh3 h PHE 104 CO 0.00 0.37 0.62 0.37 -2.23 0.00 0.00 178.31 177.44 2vh3 h GLN 105 N 0.87 1.03 -0.28 1.11 -0.00 -1.75 -2.33 115.11 113.76 2vh3 h GLN 105 Ca 0.46 -0.06 -0.17 0.00 -0.00 0.00 0.00 58.65 58.88 2vh3 h GLN 105 Cb 0.48 -0.23 -0.00 0.00 0.00 0.00 0.00 27.48 27.72 2vh3 h GLN 105 CO -0.27 0.68 -0.49 -0.22 0.00 0.00 0.00 178.83 178.53 2vh3 h LYS 106 N 1.06 0.76 -1.78 1.69 3.64 -1.37 -3.33 116.57 117.24 2vh3 h LYS 106 Ca 0.42 -0.45 -0.29 0.00 -1.27 0.00 0.00 60.65 59.06 2vh3 h LYS 106 Cb 0.26 0.04 -0.11 0.00 -0.41 0.00 0.00 32.23 32.00 2vh3 h LYS 106 CO -0.18 1.08 0.23 1.28 -2.27 0.00 0.00 179.45 179.59 2vh3 n LEU 107 N -4.01 6.12 -3.64 5.20 4.77 -0.56 -5.04 117.00 119.84 2vh3 n LEU 107 Ca -0.03 -3.32 -0.03 0.00 -0.03 0.00 0.00 56.01 52.60 2vh3 n LEU 107 Cb 0.59 -1.16 -0.07 0.00 -2.33 0.00 0.00 43.42 40.45 2vh3 n LEU 107 CO 0.48 1.37 0.82 0.00 -1.33 0.00 0.00 177.39 178.74 2vh3 s ALA 109 N -1.11 -2.30 0.08 -1.18 0.00 -1.25 -4.96 121.76 111.05 2vh3 s ALA 109 Ca 0.37 2.02 0.07 0.00 0.00 0.00 0.00 51.96 54.42 2vh3 s ALA 109 Cb 0.25 -1.73 -0.03 0.00 0.00 0.00 0.00 23.12 21.61 2vh3 s ALA 109 CO -0.06 -0.29 -0.18 0.96 0.00 0.00 0.00 175.76 176.20 2vh3 s ILE 110 N 0.89 1.45 0.93 0.00 -4.36 -1.26 -4.37 121.20 114.47 2vh3 s ILE 110 Ca -0.04 -1.40 -0.12 0.00 -0.26 0.00 0.00 60.65 58.83 2vh3 s ILE 110 Cb -0.04 -1.34 0.15 0.00 1.25 0.00 0.00 42.46 42.48 2vh3 s ILE 110 CO -0.12 -0.10 1.09 -2.84 0.24 0.00 0.00 174.94 173.21 2vh3 s PRO 111 N -1.76 0.99 0.00 0.37 0.02 -1.26 -5.21 135.00 128.16 2vh3 s PRO 111 Ca 0.03 0.78 0.00 0.00 0.02 0.00 0.00 61.00 61.83 2vh3 s PRO 111 Cb -0.10 -1.78 0.00 0.00 0.02 0.00 0.00 34.50 32.64 2vh3 s PRO 111 CO 0.03 -2.41 0.00 -2.39 -0.33 0.00 0.00 177.00 171.90