#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2va1 s ARG 2 N 0.00 0.09 -0.15 3.17 1.70 -1.26 -5.15 118.95 117.35 2va1 s ARG 2 Ca 0.00 0.28 -0.04 0.00 -0.47 0.00 0.00 55.73 55.50 2va1 s ARG 2 Cb 0.00 -0.57 -0.03 0.00 -0.57 0.00 0.00 34.95 33.78 2va1 s ARG 2 CO 0.00 -0.29 -0.03 0.15 -1.08 0.00 0.00 175.30 174.05 2va1 s LYS 3 N 1.91 3.68 0.28 3.89 1.02 -1.26 -4.88 119.74 124.38 2va1 s LYS 3 Ca 0.02 -0.50 0.03 0.00 0.02 0.00 0.00 55.97 55.54 2va1 s LYS 3 Cb -0.12 -2.93 -0.03 0.00 -0.52 0.00 0.00 37.83 34.22 2va1 s LYS 3 CO -0.03 0.26 0.44 -0.65 -0.92 0.00 0.00 175.35 174.45 2va1 s GLN 4 N 0.32 3.45 -0.18 1.68 -1.52 -1.25 -4.73 119.66 117.42 2va1 s GLN 4 Ca -0.03 -0.60 -0.07 0.00 -1.95 0.00 0.00 55.36 52.71 2va1 s GLN 4 Cb -0.14 -2.80 -0.04 0.00 -0.22 0.00 0.00 33.01 29.81 2va1 s GLN 4 CO 0.03 0.31 0.05 1.03 -0.25 0.00 0.00 175.29 176.46 2va1 s ARG 5 N -4.12 3.93 0.05 2.91 0.52 -1.26 -1.33 118.95 119.65 2va1 s ARG 5 Ca 0.37 -0.37 0.04 0.00 -0.52 0.00 0.00 55.73 55.25 2va1 s ARG 5 Cb -0.09 -3.17 -0.03 0.00 0.52 0.00 0.00 34.95 32.18 2va1 s ARG 5 CO 0.32 0.28 -0.12 0.96 0.02 0.00 0.00 175.30 176.75 2va1 s ILE 6 N 0.34 0.96 -0.16 1.52 -4.36 -0.60 -3.53 121.20 115.38 2va1 s ILE 6 Ca 0.02 -1.14 -0.03 0.00 -0.26 0.00 0.00 60.65 59.24 2va1 s ILE 6 Cb -0.13 -0.93 -0.02 0.00 1.25 0.00 0.00 42.46 42.63 2va1 s ILE 6 CO 0.00 -0.19 -0.06 -0.69 0.24 0.00 0.00 174.94 174.25 2va1 s VAL 7 N -1.15 3.65 -0.27 8.37 1.01 -0.91 -1.17 120.40 129.92 2va1 s VAL 7 Ca -0.03 -0.44 -0.07 0.00 0.00 0.00 0.00 61.98 61.45 2va1 s VAL 7 Cb -0.09 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.68 2va1 s VAL 7 CO 0.02 0.49 0.06 -0.63 0.00 0.00 0.00 175.10 175.03 2va1 s ILE 8 N 0.54 4.00 -0.35 2.22 1.01 0.44 -0.27 121.20 128.80 2va1 s ILE 8 Ca -0.04 -0.49 -0.25 0.00 0.00 0.00 0.00 60.65 59.87 2va1 s ILE 8 Cb -0.15 -2.97 0.01 0.00 0.01 0.00 0.00 42.46 39.36 2va1 s ILE 8 CO 0.03 0.21 0.88 -0.75 0.00 0.00 0.00 174.94 175.30 2va1 s LYS 9 N 1.54 3.88 -0.32 2.79 2.20 -0.67 -1.61 119.74 127.54 2va1 s LYS 9 Ca 0.04 0.58 -0.01 0.00 -0.36 0.00 0.00 55.97 56.22 2va1 s LYS 9 Cb -0.16 -3.78 0.07 0.00 -1.51 0.00 0.00 37.83 32.45 2va1 s LYS 9 CO 0.02 -0.85 0.02 0.42 -0.36 0.00 0.00 175.35 174.60 2va1 s ILE 10 N 3.28 2.83 0.83 5.43 1.01 0.08 -3.83 121.20 130.83 2va1 s ILE 10 Ca 0.36 -1.65 -0.11 0.00 0.00 0.00 0.00 60.65 59.25 2va1 s ILE 10 Cb -0.13 -2.74 0.09 0.00 0.01 0.00 0.00 42.46 39.70 2va1 s ILE 10 CO 0.16 -0.25 1.10 -0.94 0.00 0.00 0.00 174.94 175.01 2va1 s SER 11 N 1.29 3.97 0.32 3.58 1.04 -1.26 -1.11 113.70 121.53 2va1 s SER 11 Ca -0.02 1.77 0.02 0.00 0.48 0.00 0.00 55.95 58.20 2va1 s SER 11 Cb -0.20 -2.43 0.58 0.00 0.10 0.00 0.00 66.02 64.07 2va1 s SER 11 CO -0.03 -2.37 1.94 1.23 0.98 0.00 0.00 173.24 174.99 2va1 h GLY 12 N -1.36 1.17 1.73 7.32 0.00 -1.92 -2.59 103.07 107.41 2va1 h GLY 12 Ca -0.45 -0.38 0.02 0.00 0.00 0.00 0.00 47.33 46.52 2va1 h GLY 12 CO 0.51 0.30 0.11 0.00 0.00 0.00 0.00 176.54 177.46 2va1 h ALA 13 N 1.54 1.57 0.00 3.60 0.00 -1.92 -1.24 119.26 122.81 2va1 h ALA 13 Ca 0.34 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2va1 h ALA 13 Cb 0.14 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2va1 h ALA 13 CO -0.11 -0.16 0.00 0.00 0.00 0.00 0.00 179.25 178.98 2va1 n LEU 15 N -2.60 1.31 -4.39 0.00 4.77 -0.47 -4.63 117.00 111.00 2va1 n LEU 15 Ca 0.01 -0.63 -0.32 0.00 -0.03 0.00 0.00 56.01 55.04 2va1 n LEU 15 Cb 0.25 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.20 2va1 n LEU 15 CO 0.22 0.27 -0.48 -0.75 -1.33 0.00 0.00 177.39 175.33 2va1 s LYS 16 N -2.45 2.74 -0.21 3.23 2.20 -1.16 0.36 119.74 124.46 2va1 s LYS 16 Ca 0.11 -0.75 -0.16 0.00 -0.36 0.00 0.00 55.97 54.81 2va1 s LYS 16 Cb 0.14 -2.38 -0.08 0.00 -1.51 0.00 0.00 37.83 34.00 2va1 s LYS 16 CO 0.62 0.45 -0.30 0.94 -0.36 0.00 0.00 175.35 176.70 2va1 n GLN 17 N 2.80 0.54 -4.16 4.03 -0.06 -1.26 -4.92 117.38 114.35 2va1 n GLN 17 Ca -0.17 0.28 -0.15 0.00 -2.00 0.00 0.00 57.00 54.96 2va1 n GLN 17 Cb 0.52 -1.50 -0.07 0.00 -4.06 0.00 0.00 30.24 25.14 2va1 n GLN 17 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2va1 s ASN 18 N -6.45 0.80 0.12 1.69 2.20 -1.26 -5.06 114.94 106.98 2va1 s ASN 18 Ca -0.31 -1.46 0.19 0.00 -0.94 0.00 0.00 52.86 50.34 2va1 s ASN 18 Cb 0.07 0.56 0.80 0.00 -2.00 0.00 0.00 41.25 40.68 2va1 s ASN 18 CO 0.44 -1.10 1.59 0.47 -2.94 0.00 0.00 177.10 175.56 2va1 n ASP 19 N -1.03 0.32 0.21 3.54 9.92 -1.26 -2.88 116.55 125.37 2va1 n ASP 19 Ca 0.03 0.58 0.06 0.00 -0.53 0.00 0.00 54.79 54.92 2va1 n ASP 19 Cb 0.63 -0.64 0.47 0.00 -0.64 0.00 0.00 41.12 40.93 2va1 n ASP 19 CO 0.00 0.00 0.00 0.77 0.13 0.00 0.00 177.20 178.10 2va1 h SER 20 N 0.00 0.00 -3.49 -2.24 4.64 -2.02 -3.43 113.55 107.01 2va1 h SER 20 Ca 0.00 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 2va1 h SER 20 Cb 0.32 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 62.08 2va1 h SER 20 CO 0.00 0.28 -0.67 -0.55 -0.87 0.00 0.00 176.83 175.02 2va1 s SER 21 N -6.69 -0.01 0.37 4.97 0.15 -1.14 -5.04 113.70 106.32 2va1 s SER 21 Ca -0.03 0.15 0.09 0.00 0.70 0.00 0.00 55.95 56.86 2va1 s SER 21 Cb 0.14 0.04 0.73 0.00 -1.71 0.00 0.00 66.02 65.21 2va1 s SER 21 CO 0.68 -0.13 1.87 0.16 1.20 0.00 0.00 173.24 177.02 2va1 h ILE 22 N 6.15 1.21 -3.33 6.45 3.07 -1.83 -3.41 117.51 125.81 2va1 h ILE 22 Ca -0.44 -0.96 -0.55 0.00 1.55 0.00 0.00 64.86 64.46 2va1 h ILE 22 Cb 1.13 1.35 -0.34 0.00 -0.27 0.00 0.00 36.82 38.69 2va1 h ILE 22 CO 0.46 0.29 -0.83 -0.63 -1.05 0.00 0.00 178.15 176.39 2va1 s ILE 23 N -4.56 1.33 -0.19 0.16 1.01 -1.26 -4.29 121.20 113.40 2va1 s ILE 23 Ca -0.05 -0.56 -0.12 0.00 0.00 0.00 0.00 60.65 59.92 2va1 s ILE 23 Cb 0.15 -1.22 -0.05 0.00 0.01 0.00 0.00 42.46 41.35 2va1 s ILE 23 CO 0.74 0.40 0.22 -0.62 0.00 0.00 0.00 174.94 175.68 2va1 s ASP 24 N 0.86 6.31 0.22 3.58 3.68 0.16 -4.96 116.67 126.52 2va1 s ASP 24 Ca -0.10 0.35 -0.05 0.00 2.13 0.00 0.00 52.55 54.88 2va1 s ASP 24 Cb -0.15 -2.14 0.21 0.00 -1.45 0.00 0.00 42.92 39.39 2va1 s ASP 24 CO 0.01 0.12 1.68 2.19 0.13 0.00 0.00 175.17 179.30 2va1 h PHE 25 N 6.81 0.95 -0.40 -5.34 -5.15 -1.99 -2.21 116.94 109.60 2va1 h PHE 25 Ca -0.40 -0.17 -0.12 0.00 -0.20 0.00 0.00 57.97 57.07 2va1 h PHE 25 Cb 1.16 -0.24 -0.01 0.00 0.22 0.00 0.00 35.95 37.08 2va1 h PHE 25 CO 0.60 0.90 -0.24 -0.84 -2.00 0.00 0.00 178.31 176.74 2va1 h ILE 26 N 0.78 1.28 -0.22 0.88 3.07 -1.96 -1.33 117.51 120.01 2va1 h ILE 26 Ca 0.13 -1.39 -0.02 0.00 1.55 0.00 0.00 64.86 65.13 2va1 h ILE 26 Cb 0.58 1.31 -0.01 0.00 -0.27 0.00 0.00 36.82 38.43 2va1 h ILE 26 CO 0.04 0.47 0.05 0.11 -1.05 0.00 0.00 178.15 177.77 2va1 h LYS 27 N 0.68 0.35 -0.28 0.16 1.79 -1.88 -0.83 116.57 116.56 2va1 h LYS 27 Ca 0.08 -0.08 -0.12 0.00 -2.18 0.00 0.00 60.65 58.35 2va1 h LYS 27 Cb 0.81 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.40 2va1 h LYS 27 CO 0.07 0.47 -0.33 0.97 -1.08 0.00 0.00 179.45 179.54 2va1 h ILE 28 N 0.18 1.29 -0.29 1.86 2.10 -1.43 -1.77 117.51 119.44 2va1 h ILE 28 Ca 0.07 -1.46 -0.15 0.00 1.08 0.00 0.00 64.86 64.40 2va1 h ILE 28 Cb 0.27 1.43 -0.01 0.00 -1.09 0.00 0.00 36.82 37.43 2va1 h ILE 28 CO 0.00 0.47 -0.44 0.78 -1.08 0.00 0.00 178.15 177.88 2va1 h ASN 29 N 0.51 0.79 -0.71 2.19 2.35 -1.20 -0.70 115.58 118.83 2va1 h ASN 29 Ca 0.06 -0.38 -0.04 0.00 -0.55 0.00 0.00 56.30 55.40 2va1 h ASN 29 Cb 0.82 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.94 2va1 h ASN 29 CO 0.07 1.12 0.30 -0.78 -1.65 0.00 0.00 177.43 176.48 2va1 h ASP 30 N 0.59 0.96 -0.33 5.81 3.58 -1.04 0.04 116.42 126.02 2va1 h ASP 30 Ca 0.04 -0.16 -0.01 0.00 0.42 0.00 0.00 57.03 57.32 2va1 h ASP 30 Cb 0.99 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 41.78 2va1 h ASP 30 CO 0.09 0.85 0.17 0.25 -2.88 0.00 0.00 179.24 177.73 2va1 h LEU 31 N 1.00 0.42 -0.95 2.28 5.85 -1.18 -2.27 115.31 120.46 2va1 h LEU 31 Ca 0.24 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 2va1 h LEU 31 Cb 0.18 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 2va1 h LEU 31 CO -0.02 0.40 0.47 0.00 -0.34 0.00 0.00 178.44 178.95 2va1 h ALA 32 N 1.03 1.20 -0.53 1.25 0.00 -0.86 -1.31 119.26 120.04 2va1 h ALA 32 Ca 0.11 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2va1 h ALA 32 Cb 0.08 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 2va1 h ALA 32 CO -0.02 0.65 0.32 1.49 0.00 0.00 0.00 179.25 181.69 2va1 h GLU 33 N 1.21 0.62 -0.38 0.00 4.81 -0.79 0.02 114.58 120.08 2va1 h GLU 33 Ca 0.31 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.45 2va1 h GLU 33 Cb 0.03 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 2va1 h GLU 33 CO -0.05 0.41 0.03 1.96 -0.73 0.00 0.00 179.01 180.64 2va1 h GLN 34 N 0.64 0.64 -0.84 1.92 4.20 -1.05 -2.83 115.11 117.79 2va1 h GLN 34 Ca 0.21 -0.19 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 2va1 h GLN 34 Cb 0.00 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.68 2va1 h GLN 34 CO -0.08 0.73 0.40 0.82 -0.67 0.00 0.00 178.83 180.02 2va1 h ILE 35 N 0.47 1.26 -0.37 2.54 2.04 -1.03 -0.81 117.51 121.61 2va1 h ILE 35 Ca 0.11 -0.72 0.08 0.00 1.00 0.00 0.00 64.86 65.32 2va1 h ILE 35 Cb 0.41 0.18 -0.07 0.00 -0.74 0.00 0.00 36.82 36.60 2va1 h ILE 35 CO 0.01 0.31 -0.11 -0.08 0.00 0.00 0.00 178.15 178.28 2va1 h GLU 36 N 1.20 -0.02 -0.30 2.37 4.22 -0.86 0.14 114.58 121.32 2va1 h GLU 36 Ca 0.29 0.00 -0.07 0.00 0.08 0.00 0.00 59.36 59.66 2va1 h GLU 36 Cb 0.12 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 2va1 h GLU 36 CO -0.04 -0.02 -0.07 0.87 -2.18 0.00 0.00 179.01 177.58 2va1 h LYS 37 N -0.02 0.58 -0.46 1.92 1.79 -1.24 -3.18 116.57 115.96 2va1 h LYS 37 Ca 0.18 -0.22 -0.07 0.00 -2.18 0.00 0.00 60.65 58.36 2va1 h LYS 37 Cb 0.30 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.90 2va1 h LYS 37 CO -0.40 0.77 0.00 0.82 -1.08 0.00 0.00 179.45 179.56 2va1 h ILE 38 N 0.35 1.24 0.00 1.86 2.04 -0.83 -2.92 117.51 119.25 2va1 h ILE 38 Ca 0.08 -0.97 0.00 0.00 1.00 0.00 0.00 64.86 64.97 2va1 h ILE 38 Cb 0.56 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 2va1 h ILE 38 CO 0.03 0.34 0.00 -1.54 0.00 0.00 0.00 178.15 176.98 2va1 n SER 39 N -4.22 0.17 0.15 1.72 3.41 0.46 -1.33 113.62 113.97 2va1 n SER 39 Ca 0.02 0.55 0.03 0.00 -0.26 0.00 0.00 58.87 59.21 2va1 n SER 39 Cb 0.29 -0.58 0.15 0.00 -0.26 0.00 0.00 64.21 63.80 2va1 n SER 39 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2va1 h LYS 40 N 0.00 0.00 0.00 4.33 1.57 -1.61 -3.36 116.57 117.51 2va1 h LYS 40 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2va1 h LYS 40 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 2va1 h LYS 40 CO 0.00 0.51 -0.88 1.63 -0.57 0.00 0.00 179.45 180.14 2va1 n LYS 41 N -3.39 2.18 -4.15 3.15 5.02 -0.60 -4.47 118.16 115.90 2va1 n LYS 41 Ca 0.01 -0.04 -0.14 0.00 -2.02 0.00 0.00 58.31 56.12 2va1 n LYS 41 Cb 0.66 -1.01 -0.11 0.00 -0.02 0.00 0.00 35.03 34.55 2va1 n LYS 41 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2va1 s TYR 42 N -2.11 0.97 -0.33 2.13 1.51 -0.44 -3.84 117.35 115.23 2va1 s TYR 42 Ca -0.00 -0.64 -0.22 0.00 -1.01 0.00 0.00 57.07 55.20 2va1 s TYR 42 Cb 0.05 -0.54 0.00 0.00 -0.11 0.00 0.00 41.96 41.35 2va1 s TYR 42 CO 0.28 -0.03 0.74 0.42 -1.11 0.00 0.00 175.55 175.85 2va1 s ILE 43 N -2.26 4.82 -0.23 2.71 1.01 -0.44 -4.37 121.20 122.44 2va1 s ILE 43 Ca 0.02 0.96 -0.08 0.00 0.00 0.00 0.00 60.65 61.56 2va1 s ILE 43 Cb -0.04 -4.13 -0.03 0.00 0.01 0.00 0.00 42.46 38.27 2va1 s ILE 43 CO -0.00 -0.29 0.08 -0.69 0.00 0.00 0.00 174.94 174.03 2va1 s VAL 44 N 2.90 4.54 -0.16 2.92 1.01 -1.26 -1.56 120.40 128.77 2va1 s VAL 44 Ca 0.30 -0.10 -0.03 0.00 0.00 0.00 0.00 61.98 62.14 2va1 s VAL 44 Cb -0.14 -3.10 -0.02 0.00 0.00 0.00 0.00 36.38 33.12 2va1 s VAL 44 CO 0.14 0.37 -0.05 -0.44 0.00 0.00 0.00 175.10 175.12 2va1 s SER 45 N 1.21 4.58 -0.19 3.32 0.01 -0.32 -1.09 113.70 121.21 2va1 s SER 45 Ca 0.05 -0.21 -0.07 0.00 1.31 0.00 0.00 55.95 57.03 2va1 s SER 45 Cb -0.14 -1.75 -0.04 0.00 0.21 0.00 0.00 66.02 64.30 2va1 s SER 45 CO 0.04 0.13 0.04 -0.63 0.41 0.00 0.00 173.24 173.23 2va1 s ILE 46 N 0.59 4.49 -0.24 1.44 -1.09 0.20 -0.42 121.20 126.17 2va1 s ILE 46 Ca -0.04 -0.13 -0.03 0.00 -2.23 0.00 0.00 60.65 58.22 2va1 s ILE 46 Cb -0.15 -3.03 0.01 0.00 -1.58 0.00 0.00 42.46 37.72 2va1 s ILE 46 CO 0.03 0.44 -0.04 -0.69 -1.23 0.00 0.00 174.94 173.44 2va1 s VAL 47 N 0.63 3.12 -0.02 2.92 1.01 -0.64 0.27 120.40 127.70 2va1 s VAL 47 Ca 0.02 -0.83 -0.03 0.00 0.00 0.00 0.00 61.98 61.14 2va1 s VAL 47 Cb -0.13 -2.53 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 2va1 s VAL 47 CO 0.02 0.26 0.18 -0.76 0.00 0.00 0.00 175.10 174.80 2va1 s LEU 48 N 1.39 4.36 0.60 3.92 1.43 -1.22 -0.74 118.68 128.41 2va1 s LEU 48 Ca 0.02 0.35 0.05 0.00 -1.03 0.00 0.00 54.13 53.53 2va1 s LEU 48 Cb -0.16 -2.57 0.08 0.00 0.03 0.00 0.00 46.19 43.57 2va1 s LEU 48 CO -0.04 0.27 0.82 -0.83 0.23 0.00 0.00 176.35 176.81 2va1 s GLY 49 N -1.88 1.78 -0.07 -3.19 0.00 -0.27 -4.87 107.32 98.82 2va1 s GLY 49 Ca 0.26 -1.87 0.11 0.00 0.00 0.00 0.00 44.72 43.22 2va1 s GLY 49 CO 0.18 -1.43 1.06 0.61 0.00 0.00 0.00 173.10 173.51 2va1 n GLY 50 N -2.39 3.09 0.32 0.20 0.00 -1.26 -4.00 105.19 101.15 2va1 n GLY 50 Ca 0.14 -0.65 0.17 0.00 0.00 0.00 0.00 46.02 45.68 2va1 n GLY 50 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2va1 h GLY 51 N 0.00 0.00 2.00 -0.02 0.00 -1.88 0.28 103.07 103.46 2va1 h GLY 51 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2va1 h GLY 51 CO 0.00 0.00 -0.07 3.45 0.00 0.00 0.00 176.54 179.92 2va1 h ASN 52 N 0.00 0.00 0.00 0.19 -1.07 -1.89 -3.35 115.58 109.46 2va1 h ASN 52 Ca 0.03 0.00 -0.10 0.00 0.07 0.00 0.00 56.30 56.30 2va1 h ASN 52 Cb 0.20 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 36.44 2va1 h ASN 52 CO -0.00 0.07 -1.37 -0.38 0.07 0.00 0.00 177.43 175.81 2va1 n ILE 53 N -3.25 0.37 -4.35 6.14 5.41 -0.26 -4.78 119.36 118.64 2va1 n ILE 53 Ca -0.01 -0.13 -0.20 0.00 1.00 0.00 0.00 62.75 63.42 2va1 n ILE 53 Cb 0.28 -1.04 -0.15 0.00 -0.71 0.00 0.00 39.64 38.01 2va1 n ILE 53 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 176.55 177.41 2va1 s TRP 54 N -2.13 0.87 0.11 1.39 -0.11 0.84 -5.12 118.94 114.79 2va1 s TRP 54 Ca -0.09 -0.20 0.02 0.00 1.22 0.00 0.00 56.10 57.05 2va1 s TRP 54 Cb 0.03 -0.62 -0.04 0.00 -1.50 0.00 0.00 33.47 31.34 2va1 s TRP 54 CO 0.14 -0.08 -0.07 0.50 -4.62 0.00 0.00 176.95 172.81 2va1 s ARG 55 N 0.16 0.88 0.46 5.86 6.06 -1.26 -3.46 118.95 127.65 2va1 s ARG 55 Ca -0.02 -1.36 0.14 0.00 -2.50 0.00 0.00 55.73 51.99 2va1 s ARG 55 Cb -0.08 -0.29 1.06 0.00 0.06 0.00 0.00 34.95 35.70 2va1 s ARG 55 CO 0.00 0.00 2.04 0.78 -2.50 0.00 0.00 175.30 175.63 2va1 h GLY 56 N 2.94 0.08 1.38 8.12 0.00 -1.97 -2.95 103.07 110.66 2va1 h GLY 56 Ca -0.36 -0.04 -0.09 0.00 0.00 0.00 0.00 47.33 46.85 2va1 h GLY 56 CO 0.64 0.04 -0.11 1.48 0.00 0.00 0.00 176.54 178.58 2va1 h SER 57 N 0.07 0.72 -0.31 0.19 4.64 -2.01 -2.75 113.55 114.12 2va1 h SER 57 Ca 0.02 -0.21 -0.11 0.00 -0.47 0.00 0.00 61.79 61.01 2va1 h SER 57 Cb 0.18 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.06 2va1 h SER 57 CO 0.01 0.86 -0.19 0.40 -0.87 0.00 0.00 176.83 177.05 2va1 h ILE 58 N 0.67 1.27 -0.89 0.95 2.04 -1.95 -2.77 117.51 116.82 2va1 h ILE 58 Ca 0.11 -1.29 0.03 0.00 1.00 0.00 0.00 64.86 64.72 2va1 h ILE 58 Cb 0.58 1.16 -0.05 0.00 -0.74 0.00 0.00 36.82 37.77 2va1 h ILE 58 CO 0.04 0.43 0.58 0.00 0.00 0.00 0.00 178.15 179.20 2va1 h ALA 59 N 1.10 1.17 -0.07 1.87 0.00 -1.47 -1.27 119.26 120.59 2va1 h ALA 59 Ca 0.10 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2va1 h ALA 59 Cb 0.69 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2va1 h ALA 59 CO 0.05 0.45 0.04 0.87 0.00 0.00 0.00 179.25 180.66 2va1 h LYS 60 N 1.14 0.09 -0.75 0.00 1.79 -1.38 0.13 116.57 117.59 2va1 h LYS 60 Ca 0.35 -0.01 0.04 0.00 -2.18 0.00 0.00 60.65 58.85 2va1 h LYS 60 Cb -0.02 -0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 30.56 2va1 h LYS 60 CO -0.11 0.13 0.49 0.93 -1.08 0.00 0.00 179.45 179.81 2va1 h GLU 61 N 0.03 0.85 -0.25 3.15 5.08 -1.20 -1.56 114.58 120.68 2va1 h GLU 61 Ca 0.02 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2va1 h GLU 61 Cb 0.06 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.12 2va1 h GLU 61 CO -0.00 0.57 0.00 1.28 -1.00 0.00 0.00 179.01 179.85 2va1 n LEU 62 N -4.46 1.57 -3.95 1.33 4.32 -0.51 -4.92 117.00 110.38 2va1 n LEU 62 Ca 0.10 -0.74 -0.26 0.00 -0.02 0.00 0.00 56.01 55.09 2va1 n LEU 62 Cb 0.15 -0.16 -0.02 0.00 -1.62 0.00 0.00 43.42 41.77 2va1 n LEU 62 CO 0.34 0.37 -0.23 -0.67 -1.22 0.00 0.00 177.39 175.98 2va1 n ASP 63 N 0.32 -0.59 -4.63 -1.43 4.64 -0.59 -4.93 116.55 109.33 2va1 n ASP 63 Ca 0.12 -1.02 -0.37 0.00 -1.38 0.00 0.00 54.79 52.14 2va1 n ASP 63 Cb 0.27 -3.00 -0.10 0.00 -1.04 0.00 0.00 41.12 37.25 2va1 n ASP 63 CO 0.00 0.00 0.00 -0.32 -0.82 0.00 0.00 177.20 176.06 2va1 s MET 64 N -6.56 4.01 0.80 -0.67 1.75 0.41 -5.04 119.30 114.01 2va1 s MET 64 Ca 0.04 -0.30 -0.11 0.00 -1.25 0.00 0.00 55.69 54.07 2va1 s MET 64 Cb -0.01 -3.55 0.08 0.00 2.84 0.00 0.00 34.83 34.18 2va1 s MET 64 CO 0.89 -0.01 1.11 0.16 -0.65 0.00 0.00 175.02 176.52 2va1 s ASP 65 N 1.26 4.11 0.28 1.11 -4.77 -1.26 -4.69 116.67 112.70 2va1 s ASP 65 Ca 0.07 1.96 -0.02 0.00 -3.30 0.00 0.00 52.55 51.26 2va1 s ASP 65 Cb -0.14 -2.54 0.39 0.00 -1.09 0.00 0.00 42.92 39.54 2va1 s ASP 65 CO 0.06 -2.31 1.85 -0.09 0.70 0.00 0.00 175.17 175.38 2va1 h ARG 66 N -1.20 0.90 -0.63 2.11 9.65 -1.98 -1.48 114.38 121.74 2va1 h ARG 66 Ca -0.44 -0.16 0.07 0.00 -1.10 0.00 0.00 59.98 58.36 2va1 h ARG 66 Cb 1.25 -0.15 -0.06 0.00 -1.39 0.00 0.00 29.97 29.62 2va1 h ARG 66 CO 0.49 0.76 0.31 -0.91 2.80 0.00 0.00 179.97 183.41 2va1 h ASN 67 N 0.88 0.42 -0.04 -3.80 2.35 -1.99 -1.00 115.58 112.39 2va1 h ASN 67 Ca 0.20 0.05 -0.24 0.00 -0.55 0.00 0.00 56.30 55.76 2va1 h ASN 67 Cb 0.22 -0.02 0.02 0.00 0.05 0.00 0.00 38.32 38.58 2va1 h ASN 67 CO -0.01 0.26 -0.90 0.25 -1.65 0.00 0.00 177.43 175.38 2va1 h LEU 68 N 0.56 0.87 -0.39 1.61 5.85 -1.85 -2.99 115.31 118.96 2va1 h LEU 68 Ca 0.30 -0.71 0.02 0.00 0.84 0.00 0.00 57.88 58.33 2va1 h LEU 68 Cb 0.27 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 2va1 h LEU 68 CO -0.23 1.45 0.21 0.00 -0.34 0.00 0.00 178.44 179.54 2va1 h ALA 69 N 0.43 0.49 0.00 1.25 0.00 -0.99 -1.62 119.26 118.82 2va1 h ALA 69 Ca -0.10 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 2va1 h ALA 69 Cb 1.55 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 2va1 h ALA 69 CO 0.18 -0.13 -0.32 -0.44 0.00 0.00 0.00 179.25 178.54 2va1 h ASP 70 N 0.43 0.00 -0.38 0.00 3.32 -1.28 -2.42 116.42 116.09 2va1 h ASP 70 Ca 0.16 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.13 2va1 h ASP 70 Cb 0.04 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 2va1 h ASP 70 CO -0.09 0.32 -0.05 0.78 -1.72 0.00 0.00 179.24 178.47 2va1 h ASN 71 N 0.00 0.78 -0.47 6.45 -0.26 -1.22 -1.67 115.58 119.18 2va1 h ASN 71 Ca -0.00 -0.21 -0.01 0.00 -0.56 0.00 0.00 56.30 55.51 2va1 h ASN 71 Cb 0.57 -0.21 -0.02 0.00 -1.06 0.00 0.00 38.32 37.60 2va1 h ASN 71 CO 0.04 0.88 0.25 0.24 -1.06 0.00 0.00 177.43 177.77 2va1 h MET 72 N 0.73 0.67 -0.87 0.81 2.86 -0.86 -2.48 114.93 115.78 2va1 h MET 72 Ca 0.13 -0.09 0.03 0.00 -2.06 0.00 0.00 59.70 57.72 2va1 h MET 72 Cb 0.52 -0.13 -0.05 0.00 0.06 0.00 0.00 31.60 32.01 2va1 h MET 72 CO 0.03 0.54 0.58 0.78 1.06 0.00 0.00 176.91 179.89 2va1 h GLY 73 N 0.62 1.24 1.02 8.32 0.00 -1.24 -1.47 103.07 111.56 2va1 h GLY 73 Ca 0.16 -0.44 -0.06 0.00 0.00 0.00 0.00 47.33 47.00 2va1 h GLY 73 CO -0.02 0.39 0.16 -0.33 0.00 0.00 0.00 176.54 176.74 2va1 h MET 74 N 1.12 0.96 -0.56 4.80 2.07 -1.00 -1.92 114.93 120.40 2va1 h MET 74 Ca 0.34 -0.22 -0.08 0.00 -2.07 0.00 0.00 59.70 57.67 2va1 h MET 74 Cb -0.02 -0.13 -0.02 0.00 -1.87 0.00 0.00 31.60 29.55 2va1 h MET 74 CO -0.09 0.87 0.04 0.52 1.07 0.00 0.00 176.91 179.32 2va1 h MET 75 N 0.88 0.94 -0.81 1.72 2.86 -1.09 -2.73 114.93 116.69 2va1 h MET 75 Ca 0.19 -0.26 0.05 0.00 -2.06 0.00 0.00 59.70 57.63 2va1 h MET 75 Cb 0.33 -0.11 -0.06 0.00 0.06 0.00 0.00 31.60 31.83 2va1 h MET 75 CO -0.00 0.90 0.51 0.00 1.06 0.00 0.00 176.91 179.38 2va1 h ALA 76 N 1.16 1.10 -0.27 6.32 0.00 -0.94 -2.41 119.26 124.22 2va1 h ALA 76 Ca 0.17 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 2va1 h ALA 76 Cb 0.46 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2va1 h ALA 76 CO 0.02 0.28 -0.17 1.79 0.00 0.00 0.00 179.25 181.16 2va1 h THR 77 N 0.95 1.24 -0.47 0.00 1.35 -1.10 -2.19 112.91 112.69 2va1 h THR 77 Ca 0.34 -1.10 -0.03 0.00 -0.55 0.00 0.00 66.41 65.08 2va1 h THR 77 Cb 0.10 1.23 -0.02 0.00 -1.73 0.00 0.00 68.15 67.73 2va1 h THR 77 CO -0.15 0.35 0.20 0.40 -0.25 0.00 0.00 175.52 176.07 2va1 h ILE 78 N 0.43 1.20 -0.09 6.82 2.04 -1.16 0.37 117.51 127.12 2va1 h ILE 78 Ca 0.07 -0.62 0.02 0.00 1.00 0.00 0.00 64.86 65.33 2va1 h ILE 78 Cb 0.55 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 2va1 h ILE 78 CO 0.04 0.23 -0.02 0.40 0.00 0.00 0.00 178.15 178.80 2va1 h ILE 79 N 0.62 0.92 -0.83 -0.67 2.04 -1.21 -0.84 117.51 117.53 2va1 h ILE 79 Ca 0.16 -0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.05 2va1 h ILE 79 Cb 0.18 0.91 -0.05 0.00 -0.74 0.00 0.00 36.82 37.12 2va1 h ILE 79 CO -0.01 0.00 0.53 0.78 0.00 0.00 0.00 178.15 179.45 2va1 h ASN 80 N 0.01 0.88 -0.66 1.72 2.35 -1.17 -2.09 115.58 116.63 2va1 h ASN 80 Ca 0.04 -0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 2va1 h ASN 80 Cb 0.06 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.21 2va1 h ASN 80 CO -0.09 0.60 0.34 1.23 -1.65 0.00 0.00 177.43 177.86 2va1 h GLY 81 N 1.03 1.00 1.66 2.83 0.00 0.19 -1.04 103.07 108.74 2va1 h GLY 81 Ca 0.33 -0.47 -0.13 0.00 0.00 0.00 0.00 47.33 47.06 2va1 h GLY 81 CO -0.12 0.45 -0.46 1.41 0.00 0.00 0.00 176.54 177.82 2va1 h LEU 82 N 0.90 0.40 -0.35 3.11 3.38 -0.97 -1.62 115.31 120.15 2va1 h LEU 82 Ca 0.23 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 2va1 h LEU 82 Cb 0.08 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2va1 h LEU 82 CO -0.03 0.81 0.02 0.00 0.09 0.00 0.00 178.44 179.32 2va1 h ALA 83 N 1.21 0.47 -0.56 1.53 0.00 -1.07 -1.91 119.26 118.93 2va1 h ALA 83 Ca 0.02 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 2va1 h ALA 83 Cb 0.93 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2va1 h ALA 83 CO 0.08 0.22 0.17 1.25 0.00 0.00 0.00 179.25 180.96 2va1 h LEU 84 N 0.43 0.83 -0.58 0.00 6.46 -1.12 -2.17 115.31 119.16 2va1 h LEU 84 Ca 0.10 -0.21 0.04 0.00 -0.12 0.00 0.00 57.88 57.69 2va1 h LEU 84 Cb 0.42 -0.22 -0.04 0.00 -0.73 0.00 0.00 40.66 40.09 2va1 h LEU 84 CO 0.01 0.83 0.32 -0.08 -0.62 0.00 0.00 178.44 178.90 2va1 h GLU 85 N 0.80 0.60 -0.28 1.25 4.81 -1.23 -0.67 114.58 119.86 2va1 h GLU 85 Ca 0.18 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.40 2va1 h GLU 85 Cb 0.30 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 2va1 h GLU 85 CO -0.00 0.40 0.09 -0.97 -0.73 0.00 0.00 179.01 177.80 2va1 h ASN 86 N 0.62 0.10 -0.85 1.04 -1.24 -1.16 0.97 115.58 115.07 2va1 h ASN 86 Ca 0.25 0.03 -0.00 0.00 0.71 0.00 0.00 56.30 57.28 2va1 h ASN 86 Cb 0.11 0.02 -0.04 0.00 0.73 0.00 0.00 38.32 39.13 2va1 h ASN 86 CO -0.14 0.09 0.52 0.00 -1.29 0.00 0.00 177.43 176.61 2va1 h ALA 87 N 1.18 1.31 -0.10 1.57 0.00 -0.94 -2.42 119.26 119.86 2va1 h ALA 87 Ca 0.12 -0.09 -0.19 0.00 0.00 0.00 0.00 54.91 54.75 2va1 h ALA 87 Cb 0.09 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 2va1 h ALA 87 CO -0.13 0.60 -0.73 -0.07 0.00 0.00 0.00 179.25 178.92 2va1 h LEU 88 N 1.17 0.59 -0.88 0.00 3.38 -0.80 -3.22 115.31 115.56 2va1 h LEU 88 Ca 0.31 -0.38 0.04 0.00 0.09 0.00 0.00 57.88 57.94 2va1 h LEU 88 Cb -0.06 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 40.46 2va1 h LEU 88 CO -0.06 1.13 0.56 0.78 0.09 0.00 0.00 178.44 180.95 2va1 h ASN 89 N 0.35 0.92 0.23 -0.43 2.35 -0.51 -1.68 115.58 116.81 2va1 h ASN 89 Ca -0.03 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.71 2va1 h ASN 89 Cb 1.31 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 39.48 2va1 h ASN 89 CO 0.13 0.62 -0.02 0.45 -1.65 0.00 0.00 177.43 176.97 2va1 h HIS 90 N 1.07 0.00 -0.69 1.19 3.86 -1.45 -1.18 115.15 117.95 2va1 h HIS 90 Ca 0.36 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.57 2va1 h HIS 90 Cb 0.06 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.53 2va1 h HIS 90 CO -0.02 0.02 0.00 1.28 0.86 0.00 0.00 177.93 180.06 2va1 n LEU 91 N -3.25 4.07 -2.59 2.43 4.77 -0.69 -4.96 117.00 116.78 2va1 n LEU 91 Ca -0.02 -2.10 -0.20 0.00 -0.03 0.00 0.00 56.01 53.66 2va1 n LEU 91 Cb 0.13 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 2va1 n LEU 91 CO 0.23 0.94 -0.18 0.59 -1.33 0.00 0.00 177.39 177.64 2va1 n ASN 92 N 1.47 -5.53 -4.69 -1.43 3.02 -0.44 -4.98 115.26 102.68 2va1 n ASN 92 Ca 0.24 -0.06 -0.41 0.00 -0.03 0.00 0.00 54.58 54.32 2va1 n ASN 92 Cb 0.67 -4.58 -0.04 0.00 -0.61 0.00 0.00 39.78 35.22 2va1 n ASN 92 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2va1 s VAL 93 N -2.99 4.93 -0.15 2.41 1.01 -0.84 -5.01 120.40 119.76 2va1 s VAL 93 Ca 0.09 1.61 -0.29 0.00 0.00 0.00 0.00 61.98 63.38 2va1 s VAL 93 Cb -0.04 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 2va1 s VAL 93 CO 0.11 0.10 1.66 0.21 0.00 0.00 0.00 175.10 177.18 2va1 s ASN 94 N 1.05 6.46 0.01 3.32 2.47 -1.26 -4.38 114.94 122.60 2va1 s ASN 94 Ca 0.39 1.90 -0.05 0.00 0.42 0.00 0.00 52.86 55.51 2va1 s ASN 94 Cb -0.17 -2.53 -0.00 0.00 -1.45 0.00 0.00 41.25 37.09 2va1 s ASN 94 CO 0.15 -1.15 0.10 0.28 -3.72 0.00 0.00 177.10 172.76 2va1 s THR 95 N 4.86 0.09 -0.05 -5.21 -1.32 -1.26 -0.96 115.64 111.79 2va1 s THR 95 Ca 0.74 -0.76 -0.03 0.00 -1.21 0.00 0.00 61.69 60.42 2va1 s THR 95 Cb -0.29 -0.41 0.02 0.00 -1.51 0.00 0.00 72.50 70.32 2va1 s THR 95 CO 0.29 -0.42 0.12 -0.51 -2.21 0.00 0.00 174.62 171.90 2va1 s ILE 96 N -1.45 -0.02 -0.30 5.08 2.07 -0.33 -4.90 121.20 121.35 2va1 s ILE 96 Ca -0.15 0.06 -0.16 0.00 -1.41 0.00 0.00 60.65 59.00 2va1 s ILE 96 Cb -0.08 -0.19 -0.02 0.00 0.13 0.00 0.00 42.46 42.30 2va1 s ILE 96 CO 0.01 0.03 0.41 -0.69 -1.91 0.00 0.00 174.94 172.78 2va1 s VAL 97 N 0.43 5.13 -0.23 4.00 1.01 -1.26 -0.78 120.40 128.70 2va1 s VAL 97 Ca -0.03 0.44 -0.03 0.00 0.00 0.00 0.00 61.98 62.37 2va1 s VAL 97 Cb -0.04 -3.79 0.01 0.00 0.00 0.00 0.00 36.38 32.55 2va1 s VAL 97 CO -0.02 0.03 -0.07 -0.76 0.00 0.00 0.00 175.10 174.28 2va1 s LEU 98 N 2.14 2.91 -0.09 3.92 1.43 0.25 -2.41 118.68 126.83 2va1 s LEU 98 Ca 0.16 -0.58 -0.03 0.00 -1.03 0.00 0.00 54.13 52.65 2va1 s LEU 98 Cb -0.16 -1.68 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 2va1 s LEU 98 CO 0.11 -0.06 0.02 -0.55 0.23 0.00 0.00 176.35 176.10 2va1 s SER 99 N 1.41 5.40 0.49 2.29 0.15 0.67 -1.37 113.70 122.74 2va1 s SER 99 Ca 0.04 0.18 0.28 0.00 0.70 0.00 0.00 55.95 57.16 2va1 s SER 99 Cb -0.15 -1.57 1.00 0.00 -1.71 0.00 0.00 66.02 63.59 2va1 s SER 99 CO -0.05 0.37 1.85 0.00 1.20 0.00 0.00 173.24 176.62 2va1 h ALA 100 N 5.20 0.99 -3.36 5.45 0.00 -1.49 0.24 119.26 126.29 2va1 h ALA 100 Ca -0.51 -0.08 -0.65 0.00 0.00 0.00 0.00 54.91 53.67 2va1 h ALA 100 Cb 1.20 -0.01 -0.24 0.00 0.00 0.00 0.00 17.79 18.73 2va1 h ALA 100 CO 0.55 0.11 -0.72 0.96 0.00 0.00 0.00 179.25 180.15 2va1 s ILE 101 N -3.56 3.41 0.08 0.00 -4.36 -1.26 -4.56 121.20 110.95 2va1 s ILE 101 Ca 0.02 -0.54 -0.31 0.00 -0.26 0.00 0.00 60.65 59.57 2va1 s ILE 101 Cb 0.09 -2.45 -0.09 0.00 1.25 0.00 0.00 42.46 41.26 2va1 s ILE 101 CO 0.60 0.52 1.65 -0.75 0.24 0.00 0.00 174.94 177.20 2va1 s LYS 102 N 0.24 4.20 -0.50 0.37 2.36 -1.26 -4.89 119.74 120.26 2va1 s LYS 102 Ca -0.06 2.34 0.06 0.00 -2.55 0.00 0.00 55.97 55.76 2va1 s LYS 102 Cb -0.15 -3.55 0.21 0.00 -1.05 0.00 0.00 37.83 33.29 2va1 s LYS 102 CO 0.04 -0.72 0.81 0.00 1.55 0.00 0.00 175.35 177.03 2va1 h ASP 104 N 4.58 0.14 0.91 0.00 3.45 -1.92 -0.69 116.42 122.88 2va1 h ASP 104 Ca -0.02 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.44 2va1 h ASP 104 Cb 1.09 -0.03 0.00 0.00 -0.56 0.00 0.00 39.33 39.83 2va1 h ASP 104 CO 0.12 0.08 0.00 0.50 -1.57 0.00 0.00 179.24 178.37 2va1 h LYS 105 N 0.16 0.00 0.00 3.56 1.63 -2.02 -3.36 116.57 116.53 2va1 h LYS 105 Ca 0.22 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.02 2va1 h LYS 105 Cb 0.65 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.28 2va1 h LYS 105 CO -0.03 0.00 -0.92 1.28 -3.45 0.00 0.00 179.45 176.33 2va1 n LEU 106 N -2.58 2.42 -4.03 5.20 4.32 -0.50 -5.12 117.00 116.71 2va1 n LEU 106 Ca 0.02 0.00 -0.08 0.00 -0.02 0.00 0.00 56.01 55.93 2va1 n LEU 106 Cb 0.28 0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 41.98 2va1 n LEU 106 CO 0.23 0.40 -0.28 0.68 -1.22 0.00 0.00 177.39 177.20 2va1 s VAL 107 N -1.93 0.19 0.41 4.08 -7.23 -0.38 -5.06 120.40 110.48 2va1 s VAL 107 Ca 0.00 -1.64 -0.14 0.00 -1.81 0.00 0.00 61.98 58.38 2va1 s VAL 107 Cb 0.00 -1.50 -0.08 0.00 0.56 0.00 0.00 36.38 35.36 2va1 s VAL 107 CO 0.00 -0.88 0.83 -1.00 -0.31 0.00 0.00 175.10 173.74 2va1 s HIS 108 N -3.91 3.42 0.06 2.82 3.76 -1.01 -3.99 115.29 116.43 2va1 s HIS 108 Ca 0.07 1.24 -0.22 0.00 -0.15 0.00 0.00 55.06 56.00 2va1 s HIS 108 Cb 0.07 -2.58 -0.06 0.00 1.11 0.00 0.00 32.58 31.12 2va1 s HIS 108 CO -0.10 -0.11 0.67 -2.00 -0.85 0.00 0.00 174.74 172.36 2va1 s GLU 109 N -3.60 4.39 0.28 1.40 2.12 -1.26 -0.24 118.70 121.79 2va1 s GLU 109 Ca 0.55 0.91 -0.29 0.00 0.36 0.00 0.00 54.97 56.49 2va1 s GLU 109 Cb -0.10 -3.31 -0.09 0.00 0.26 0.00 0.00 34.13 30.88 2va1 s GLU 109 CO 0.26 0.43 1.07 -1.54 -0.54 0.00 0.00 175.26 174.94 2va1 s SER 110 N -0.50 7.32 0.16 -1.70 1.04 0.83 -4.64 113.70 116.21 2va1 s SER 110 Ca 0.34 2.20 -0.24 0.00 0.48 0.00 0.00 55.95 58.72 2va1 s SER 110 Cb -0.20 -2.62 0.06 0.00 0.10 0.00 0.00 66.02 63.36 2va1 s SER 110 CO 0.21 -0.10 0.82 -0.94 0.98 0.00 0.00 173.24 174.21 2va1 s SER 111 N -0.97 -0.30 0.17 7.02 1.04 -1.26 -4.89 113.70 114.51 2va1 s SER 111 Ca 0.44 -0.31 -0.16 0.00 0.48 0.00 0.00 55.95 56.40 2va1 s SER 111 Cb -0.30 0.55 0.12 0.00 0.10 0.00 0.00 66.02 66.49 2va1 s SER 111 CO 0.39 -0.98 1.67 0.00 0.98 0.00 0.00 173.24 175.30 2va1 h ALA 112 N 2.00 0.33 -0.02 5.32 0.00 -2.00 -1.14 119.26 123.75 2va1 h ALA 112 Ca -0.24 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2va1 h ALA 112 Cb 1.25 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 19.33 2va1 h ALA 112 CO 0.28 -0.43 0.02 -0.91 0.00 0.00 0.00 179.25 178.20 2va1 h ASN 113 N 0.04 0.03 -0.13 0.00 2.35 -1.99 -2.21 115.58 113.67 2va1 h ASN 113 Ca 0.21 -0.01 -0.11 0.00 -0.55 0.00 0.00 56.30 55.84 2va1 h ASN 113 Cb 0.32 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 2va1 h ASN 113 CO -0.41 0.03 -0.28 0.78 -1.65 0.00 0.00 177.43 175.89 2va1 h ASN 114 N 0.03 0.61 0.16 5.81 2.35 -1.82 0.06 115.58 122.78 2va1 h ASN 114 Ca 0.01 -0.23 -0.01 0.00 -0.55 0.00 0.00 56.30 55.53 2va1 h ASN 114 Cb 0.00 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.21 2va1 h ASN 114 CO -0.00 0.86 -0.08 0.40 -1.65 0.00 0.00 177.43 176.96 2va1 h ILE 115 N 0.52 0.93 -0.61 2.81 2.04 -1.22 -0.87 117.51 121.11 2va1 h ILE 115 Ca 0.07 -0.41 0.09 0.00 1.00 0.00 0.00 64.86 65.61 2va1 h ILE 115 Cb 0.75 1.18 -0.07 0.00 -0.74 0.00 0.00 36.82 37.94 2va1 h ILE 115 CO 0.06 0.10 0.22 0.50 0.00 0.00 0.00 178.15 179.03 2va1 h LYS 116 N -0.41 0.39 -0.71 2.37 3.64 -1.20 0.11 116.57 120.76 2va1 h LYS 116 Ca -0.02 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.29 2va1 h LYS 116 Cb 0.32 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 2va1 h LYS 116 CO 0.04 0.26 0.26 -0.22 -2.27 0.00 0.00 179.45 177.51 2va1 h LYS 117 N 0.40 1.06 -0.11 1.90 3.64 -0.93 -1.84 116.57 120.70 2va1 h LYS 117 Ca 0.31 -0.20 -0.16 0.00 -1.27 0.00 0.00 60.65 59.33 2va1 h LYS 117 Cb 0.38 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 2va1 h LYS 117 CO -0.31 0.88 -0.61 0.00 -2.27 0.00 0.00 179.45 177.14 2va1 h ALA 118 N 1.24 0.75 -0.22 5.00 0.00 -0.40 -2.61 119.26 123.02 2va1 h ALA 118 Ca 0.23 -0.55 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 2va1 h ALA 118 Cb 0.24 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2va1 h ALA 118 CO -0.02 0.72 0.00 0.82 0.00 0.00 0.00 179.25 180.78 2va1 h ILE 119 N 0.27 1.25 -0.69 0.00 2.04 -0.80 -0.49 117.51 119.10 2va1 h ILE 119 Ca -0.01 -0.88 0.05 0.00 1.00 0.00 0.00 64.86 65.03 2va1 h ILE 119 Cb 1.14 1.40 -0.05 0.00 -0.74 0.00 0.00 36.82 38.57 2va1 h ILE 119 CO 0.10 0.27 0.41 -0.33 0.00 0.00 0.00 178.15 178.60 2va1 h GLU 120 N 0.15 0.74 0.00 2.37 5.08 -1.33 0.17 114.58 121.76 2va1 h GLU 120 Ca 0.06 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2va1 h GLU 120 Cb 0.40 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.48 2va1 h GLU 120 CO 0.01 0.49 0.00 1.63 -1.00 0.00 0.00 179.01 180.14 2va1 n LYS 121 N -4.74 0.17 -3.89 2.33 5.02 -0.99 -4.92 118.16 111.15 2va1 n LYS 121 Ca 0.08 0.12 -0.27 0.00 -2.02 0.00 0.00 58.31 56.22 2va1 n LYS 121 Cb 0.15 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 33.67 2va1 n LYS 121 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2va1 n GLU 122 N -1.38 -4.76 -2.83 1.97 1.02 0.05 -4.98 120.64 109.72 2va1 n GLU 122 Ca 0.08 0.55 -0.34 0.00 -0.02 0.00 0.00 57.16 57.43 2va1 n GLU 122 Cb 0.20 -5.21 -0.07 0.00 -0.02 0.00 0.00 31.44 26.34 2va1 n GLU 122 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2va1 s GLN 123 N -6.44 4.27 -0.07 3.49 -0.21 -0.27 -4.90 119.66 115.53 2va1 s GLN 123 Ca 0.37 1.13 -0.30 0.00 0.02 0.00 0.00 55.36 56.58 2va1 s GLN 123 Cb -0.19 -2.29 -0.04 0.00 1.00 0.00 0.00 33.01 31.49 2va1 s GLN 123 CO 0.84 0.03 1.36 0.08 -2.12 0.00 0.00 175.29 175.49 2va1 s VAL 124 N -2.08 3.96 -0.33 1.09 1.01 -0.14 -4.61 120.40 119.31 2va1 s VAL 124 Ca 0.60 1.26 -0.16 0.00 0.00 0.00 0.00 61.98 63.67 2va1 s VAL 124 Cb -0.11 -3.81 -0.01 0.00 0.00 0.00 0.00 36.38 32.45 2va1 s VAL 124 CO 0.15 -0.05 0.43 -0.04 0.00 0.00 0.00 175.10 175.59 2va1 s MET 125 N 2.96 3.71 -0.50 2.72 1.00 -0.25 -1.19 119.30 127.75 2va1 s MET 125 Ca 0.61 -0.18 -0.16 0.00 0.00 0.00 0.00 55.69 55.96 2va1 s MET 125 Cb -0.28 -3.77 0.08 0.00 0.00 0.00 0.00 34.83 30.87 2va1 s MET 125 CO 0.23 -0.51 0.46 0.42 0.00 0.00 0.00 175.02 175.62 2va1 s ILE 126 N 2.20 5.16 0.03 2.53 1.01 0.04 0.58 121.20 132.74 2va1 s ILE 126 Ca 0.16 -1.06 -0.23 0.00 0.00 0.00 0.00 60.65 59.52 2va1 s ILE 126 Cb -0.16 -4.21 -0.06 0.00 0.01 0.00 0.00 42.46 38.05 2va1 s ILE 126 CO 0.12 -0.69 0.69 -0.36 0.00 0.00 0.00 174.94 174.69 2va1 s PHE 127 N 1.83 3.72 0.02 3.97 0.40 0.14 -0.58 117.98 127.48 2va1 s PHE 127 Ca 0.06 1.36 -0.02 0.00 -0.60 0.00 0.00 56.93 57.73 2va1 s PHE 127 Cb -0.25 -2.72 -0.02 0.00 0.51 0.00 0.00 43.02 40.55 2va1 s PHE 127 CO 0.07 0.33 0.01 0.08 0.70 0.00 0.00 175.22 176.40 2va1 s VAL 128 N -0.20 0.12 -1.35 -0.44 1.01 -0.47 -3.45 120.40 115.63 2va1 s VAL 128 Ca 0.35 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.35 2va1 s VAL 128 Cb -0.20 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 35.72 2va1 s VAL 128 CO 0.21 -0.54 0.00 0.00 0.00 0.00 0.00 175.10 174.77 2va1 n ALA 129 N 1.37 -0.35 -0.83 5.51 0.00 -1.26 -1.48 120.51 123.47 2va1 n ALA 129 Ca -0.22 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2va1 n ALA 129 Cb 0.56 -1.63 0.00 0.00 0.00 0.00 0.00 19.45 18.38 2va1 n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2va1 n GLY 130 N -1.09 3.89 0.52 0.00 0.00 -1.26 -1.65 105.19 105.59 2va1 n GLY 130 Ca -0.16 0.13 0.08 0.00 0.00 0.00 0.00 46.02 46.06 2va1 n GLY 130 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2va1 n THR 131 N 0.00 0.00 -1.00 2.61 -2.24 -1.26 -4.50 114.28 107.89 2va1 n THR 131 Ca 0.00 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 2va1 n THR 131 Cb 0.00 1.27 0.00 0.00 -2.10 0.00 0.00 70.33 69.50 2va1 n THR 131 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2va1 n GLY 132 N 0.99 0.67 3.29 3.38 0.00 -0.66 -4.90 105.19 107.96 2va1 n GLY 132 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.84 2va1 n GLY 132 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2va1 s PHE 133 N -2.68 1.93 0.91 1.61 0.40 -1.26 -5.00 117.98 113.88 2va1 s PHE 133 Ca 0.00 -0.39 -0.12 0.00 -0.60 0.00 0.00 56.93 55.81 2va1 s PHE 133 Cb 0.00 -1.10 0.14 0.00 0.51 0.00 0.00 43.02 42.57 2va1 s PHE 133 CO 0.00 0.17 1.13 -1.25 0.70 0.00 0.00 175.22 175.97 2va1 s PRO 134 N -1.57 1.14 -0.83 0.24 0.04 -1.26 -4.21 135.00 128.55 2va1 s PRO 134 Ca 0.08 0.32 0.00 0.00 0.04 0.00 0.00 61.00 61.44 2va1 s PRO 134 Cb -0.10 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.61 2va1 s PRO 134 CO 0.03 -2.20 0.00 0.66 0.04 0.00 0.00 177.00 175.53 2va1 n TYR 135 N -3.78 -0.22 -4.91 0.56 4.02 -1.26 -5.03 117.16 106.54 2va1 n TYR 135 Ca 0.06 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.66 2va1 n TYR 135 Cb 0.59 -2.01 -0.15 0.00 -0.02 0.00 0.00 39.34 37.76 2va1 n TYR 135 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 2va1 s PHE 136 N -2.38 2.25 0.38 -0.72 0.40 -1.26 -5.14 117.98 111.50 2va1 s PHE 136 Ca 0.00 -0.41 0.05 0.00 -0.60 0.00 0.00 56.93 55.97 2va1 s PHE 136 Cb 0.00 -1.36 -0.01 0.00 0.51 0.00 0.00 43.02 42.17 2va1 s PHE 136 CO 0.00 0.11 0.54 0.95 0.70 0.00 0.00 175.22 177.51 2va1 s THR 137 N -0.78 3.96 0.31 0.64 -4.23 -1.26 -5.00 115.64 109.28 2va1 s THR 137 Ca 0.11 -0.86 0.04 0.00 -1.18 0.00 0.00 61.69 59.81 2va1 s THR 137 Cb -0.10 -3.40 0.30 0.00 1.34 0.00 0.00 72.50 70.64 2va1 s THR 137 CO 0.02 -0.19 1.85 0.74 -0.54 0.00 0.00 174.62 176.50 2va1 h THR 138 N 0.73 0.89 -0.42 3.99 2.02 -1.99 -2.15 112.91 115.97 2va1 h THR 138 Ca -0.45 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 66.42 2va1 h THR 138 Cb 1.26 -0.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 2va1 h THR 138 CO 0.54 0.16 0.23 0.44 0.37 0.00 0.00 175.52 177.25 2va1 h ASP 139 N 0.88 0.52 -0.87 4.18 3.32 -1.99 -0.44 116.42 122.02 2va1 h ASP 139 Ca 0.47 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.43 2va1 h ASP 139 Cb 0.56 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.94 2va1 h ASP 139 CO -0.24 0.47 0.56 0.28 -1.72 0.00 0.00 179.24 178.59 2va1 h SER 140 N 0.54 1.01 -0.64 6.45 0.02 -1.80 -0.96 113.55 118.17 2va1 h SER 140 Ca 0.15 -0.04 -0.08 0.00 -0.84 0.00 0.00 61.79 60.98 2va1 h SER 140 Cb 0.06 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.32 2va1 h SER 140 CO -0.02 0.75 0.09 0.00 -1.14 0.00 0.00 176.83 176.51 2va1 h ALA 142 N 1.03 1.11 -0.32 0.00 0.00 -0.60 0.94 119.26 121.42 2va1 h ALA 142 Ca 0.19 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 2va1 h ALA 142 Cb 0.45 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2va1 h ALA 142 CO 0.02 0.32 0.08 0.00 0.00 0.00 0.00 179.25 179.67 2va1 h ALA 143 N 1.36 0.42 -0.45 0.00 0.00 -0.81 -1.04 119.26 118.74 2va1 h ALA 143 Ca 0.34 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 2va1 h ALA 143 Cb 0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2va1 h ALA 143 CO -0.14 0.08 0.16 0.82 0.00 0.00 0.00 179.25 180.17 2va1 h ILE 144 N 0.36 1.22 -0.33 0.00 1.08 -0.85 -1.63 117.51 117.35 2va1 h ILE 144 Ca 0.10 -0.70 -0.09 0.00 -0.39 0.00 0.00 64.86 63.79 2va1 h ILE 144 Cb 0.29 0.82 -0.02 0.00 -3.07 0.00 0.00 36.82 34.84 2va1 h ILE 144 CO 0.00 0.25 -0.16 0.03 -0.69 0.00 0.00 178.15 177.58 2va1 h ARG 145 N 0.59 0.60 -0.17 2.37 2.47 -0.78 -0.02 114.38 119.44 2va1 h ARG 145 Ca 0.15 -0.20 -0.01 0.00 -1.26 0.00 0.00 59.98 58.65 2va1 h ARG 145 Cb 0.24 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.50 2va1 h ARG 145 CO -0.01 0.74 0.05 0.00 0.56 0.00 0.00 179.97 181.32 2va1 h ALA 146 N 1.28 0.22 -0.34 0.04 0.00 -0.93 -0.31 119.26 119.22 2va1 h ALA 146 Ca 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2va1 h ALA 146 Cb 0.59 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2va1 h ALA 146 CO 0.04 -0.15 0.22 0.00 0.00 0.00 0.00 179.25 179.36 2va1 h ALA 147 N 0.87 0.43 -0.83 0.00 0.00 -1.15 0.42 119.26 118.99 2va1 h ALA 147 Ca 0.06 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2va1 h ALA 147 Cb 0.23 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2va1 h ALA 147 CO -0.00 -0.11 0.37 1.49 0.00 0.00 0.00 179.25 181.00 2va1 h GLU 148 N 0.46 1.22 -0.07 0.00 4.81 -0.85 -2.21 114.58 117.94 2va1 h GLU 148 Ca 0.12 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 2va1 h GLU 148 Cb -0.05 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.12 2va1 h GLU 148 CO -0.03 0.96 0.00 0.25 -0.73 0.00 0.00 179.01 179.46 2va1 n THR 149 N -4.29 0.07 -3.65 0.32 -2.24 -0.14 -4.94 114.28 99.41 2va1 n THR 149 Ca 0.08 -0.31 -0.25 0.00 -2.27 0.00 0.00 64.05 61.31 2va1 n THR 149 Cb 0.16 0.56 0.07 0.00 -2.10 0.00 0.00 70.33 69.02 2va1 n THR 149 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2va1 n GLU 150 N 0.35 -7.35 -3.03 -0.78 1.02 -0.38 -4.98 120.64 105.48 2va1 n GLU 150 Ca 0.18 0.78 -0.40 0.00 -0.02 0.00 0.00 57.16 57.70 2va1 n GLU 150 Cb 0.38 -5.80 -0.05 0.00 -0.02 0.00 0.00 31.44 25.95 2va1 n GLU 150 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2va1 s SER 151 N -3.43 6.99 0.06 1.62 0.01 0.13 -4.74 113.70 114.34 2va1 s SER 151 Ca 0.54 1.19 0.26 0.00 1.31 0.00 0.00 55.95 59.25 2va1 s SER 151 Cb -0.24 -2.42 0.70 0.00 0.21 0.00 0.00 66.02 64.27 2va1 s SER 151 CO 0.75 -0.13 1.58 -1.54 0.41 0.00 0.00 173.24 174.30 2va1 n SER 152 N 3.86 0.47 -3.84 2.44 3.41 -1.23 -4.47 113.62 114.26 2va1 n SER 152 Ca -0.01 0.16 -0.12 0.00 -0.26 0.00 0.00 58.87 58.64 2va1 n SER 152 Cb 0.51 -0.12 -0.13 0.00 -0.26 0.00 0.00 64.21 64.21 2va1 n SER 152 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 2va1 s ILE 153 N -3.06 -0.00 -0.20 -1.33 2.07 -1.26 -0.48 121.20 116.93 2va1 s ILE 153 Ca 0.10 0.02 -0.04 0.00 -1.41 0.00 0.00 60.65 59.32 2va1 s ILE 153 Cb 0.16 -0.11 -0.02 0.00 0.13 0.00 0.00 42.46 42.62 2va1 s ILE 153 CO 0.65 0.01 -0.03 -0.63 -1.91 0.00 0.00 174.94 173.02 2va1 s ILE 154 N 0.12 3.64 -0.41 2.00 1.01 0.46 -2.14 121.20 125.88 2va1 s ILE 154 Ca -0.01 -0.42 -0.28 0.00 0.00 0.00 0.00 60.65 59.94 2va1 s ILE 154 Cb -0.01 -2.64 0.02 0.00 0.01 0.00 0.00 42.46 39.84 2va1 s ILE 154 CO -0.00 0.44 1.08 -0.76 0.00 0.00 0.00 174.94 175.69 2va1 s LEU 155 N 1.12 3.81 -0.96 2.97 1.43 0.62 -0.56 118.68 127.11 2va1 s LEU 155 Ca 0.02 0.67 -0.11 0.00 -1.03 0.00 0.00 54.13 53.67 2va1 s LEU 155 Cb -0.15 -3.49 0.25 0.00 0.03 0.00 0.00 46.19 42.83 2va1 s LEU 155 CO 0.00 -1.06 0.92 -0.04 0.23 0.00 0.00 176.35 176.40 2va1 s MET 156 N 4.01 3.86 -0.06 1.70 -1.94 0.37 -1.68 119.30 125.57 2va1 s MET 156 Ca 0.45 -2.83 -0.30 0.00 -1.71 0.00 0.00 55.69 51.31 2va1 s MET 156 Cb -0.10 -4.47 -0.05 0.00 2.01 0.00 0.00 34.83 32.22 2va1 s MET 156 CO 0.24 -1.27 1.53 0.20 -0.01 0.00 0.00 175.02 175.71 2va1 s GLY 157 N 1.72 1.62 -0.00 -0.03 0.00 -1.25 -2.59 107.32 106.78 2va1 s GLY 157 Ca 0.24 0.85 -0.00 0.00 0.00 0.00 0.00 44.72 45.81 2va1 s GLY 157 CO -0.09 2.82 0.07 0.54 0.00 0.00 0.00 173.10 176.44 2va1 s LYS 158 N 3.50 3.03 -0.94 2.90 -0.14 0.71 -4.79 119.74 124.00 2va1 s LYS 158 Ca 0.68 -0.50 -0.18 0.00 -1.36 0.00 0.00 55.97 54.60 2va1 s LYS 158 Cb -0.31 -2.84 0.14 0.00 -1.68 0.00 0.00 37.83 33.14 2va1 s LYS 158 CO 0.26 0.64 1.12 -0.80 -0.76 0.00 0.00 175.35 175.82 2va1 s ASN 159 N -1.73 6.67 0.00 2.83 0.01 -1.26 -1.08 114.94 120.37 2va1 s ASN 159 Ca 0.23 -2.15 0.00 0.00 -0.71 0.00 0.00 52.86 50.22 2va1 s ASN 159 Cb -0.12 -2.39 0.00 0.00 0.41 0.00 0.00 41.25 39.15 2va1 s ASN 159 CO 0.14 -1.01 0.00 0.61 -1.51 0.00 0.00 177.10 175.33 2va1 n GLY 160 N 5.30 1.67 3.77 0.66 0.00 -1.26 -5.03 105.19 110.30 2va1 n GLY 160 Ca 0.24 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 2va1 n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2va1 s VAL 161 N -1.90 5.29 -0.10 1.61 1.01 -1.26 -5.00 120.40 120.06 2va1 s VAL 161 Ca 0.00 0.53 0.24 0.00 0.00 0.00 0.00 61.98 62.74 2va1 s VAL 161 Cb 0.00 -3.60 0.26 0.00 0.00 0.00 0.00 36.38 33.04 2va1 s VAL 161 CO 0.00 0.47 1.71 0.44 0.00 0.00 0.00 175.10 177.72 2va1 h ASP 162 N 6.01 0.00 0.00 3.32 5.19 -1.92 -3.12 116.42 125.90 2va1 h ASP 162 Ca -0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 2va1 h ASP 162 Cb 1.19 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.70 2va1 h ASP 162 CO 0.70 0.18 0.00 0.61 -3.12 0.00 0.00 179.24 177.61 2va1 n GLY 163 N 0.63 -0.56 3.37 2.75 0.00 -1.26 -3.87 105.19 106.24 2va1 n GLY 163 Ca 0.02 0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.98 2va1 n GLY 163 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2va1 s VAL 164 N -0.05 3.54 0.00 1.61 1.01 -1.26 -4.93 120.40 120.32 2va1 s VAL 164 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.53 2va1 s VAL 164 Cb 0.00 -2.59 0.00 0.00 0.00 0.00 0.00 36.38 33.79 2va1 s VAL 164 CO 0.00 0.44 0.00 -1.22 0.00 0.00 0.00 175.10 174.32 2va1 n TYR 165 N 4.37 0.00 -0.79 5.22 4.01 -1.26 -1.58 117.16 127.13 2va1 n TYR 165 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 2va1 n TYR 165 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.54 2va1 n TYR 165 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2va1 n ASP 166 N 0.00 0.28 0.00 7.72 9.92 -1.25 -4.90 116.55 128.31 2va1 n ASP 166 Ca 0.00 -1.07 0.00 0.00 -0.53 0.00 0.00 54.79 53.19 2va1 n ASP 166 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 2va1 n ASP 166 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 2va1 n SER 167 N -0.04 0.00 -3.07 -2.24 2.88 -1.26 -5.02 113.62 104.87 2va1 n SER 167 Ca 0.00 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.38 2va1 n SER 167 Cb 0.29 0.28 -0.04 0.00 -0.75 0.00 0.00 64.21 63.99 2va1 n SER 167 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2va1 n ALA 175 N -1.94 0.58 -3.23 -1.46 0.00 -1.26 -5.22 120.51 107.98 2va1 n ALA 175 Ca 0.00 -2.17 -0.32 0.00 0.00 0.00 0.00 53.44 50.95 2va1 n ALA 175 Cb 0.00 -1.10 -0.17 0.00 0.00 0.00 0.00 19.45 18.18 2va1 n ALA 175 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2va1 s GLN 176 N 0.31 3.10 -0.10 0.00 0.00 -1.26 -5.12 119.66 116.58 2va1 s GLN 176 Ca 0.32 -0.85 -0.19 0.00 -0.00 0.00 0.00 55.36 54.64 2va1 s GLN 176 Cb 0.06 -2.36 -0.04 0.00 0.00 0.00 0.00 33.01 30.66 2va1 s GLN 176 CO -0.14 0.17 0.50 0.12 0.00 0.00 0.00 175.29 175.95 2va1 s PHE 177 N 0.37 3.53 -0.15 9.60 5.36 -1.26 -3.97 117.98 131.47 2va1 s PHE 177 Ca -0.17 0.94 -0.11 0.00 -0.96 0.00 0.00 56.93 56.64 2va1 s PHE 177 Cb -0.18 -2.57 -0.05 0.00 -0.34 0.00 0.00 43.02 39.89 2va1 s PHE 177 CO 0.08 0.19 0.21 0.71 -1.46 0.00 0.00 175.22 174.94 2va1 s TYR 178 N 0.54 3.51 -0.03 10.12 1.51 -0.61 -4.99 117.35 127.39 2va1 s TYR 178 Ca 0.27 0.53 0.01 0.00 -1.01 0.00 0.00 57.07 56.88 2va1 s TYR 178 Cb -0.16 -2.17 -0.26 0.00 -0.11 0.00 0.00 41.96 39.27 2va1 s TYR 178 CO 0.11 0.43 0.71 1.49 -1.11 0.00 0.00 175.55 177.18 2va1 h GLU 179 N 6.03 0.17 -2.78 -0.62 4.57 -1.89 -3.40 114.58 116.64 2va1 h GLU 179 Ca -0.46 -0.28 -0.15 0.00 -1.18 0.00 0.00 59.36 57.29 2va1 h GLU 179 Cb 1.18 0.11 -0.28 0.00 -0.16 0.00 0.00 28.75 29.60 2va1 h GLU 179 CO 0.70 0.95 -0.37 -1.58 -1.18 0.00 0.00 179.01 177.52 2va1 s HIS 180 N -2.60 -0.50 0.07 0.92 2.46 -1.26 -1.11 115.29 113.26 2va1 s HIS 180 Ca -0.10 1.11 0.02 0.00 0.47 0.00 0.00 55.06 56.55 2va1 s HIS 180 Cb 0.07 0.18 -0.03 0.00 -0.13 0.00 0.00 32.58 32.67 2va1 s HIS 180 CO 0.82 -0.31 -0.07 0.96 -2.47 0.00 0.00 174.74 173.68 2va1 s ILE 181 N 1.38 0.55 0.42 0.89 -4.36 -0.46 -4.97 121.20 114.65 2va1 s ILE 181 Ca -0.09 -1.49 -0.10 0.00 -0.26 0.00 0.00 60.65 58.71 2va1 s ILE 181 Cb -0.09 -1.12 -0.06 0.00 1.25 0.00 0.00 42.46 42.44 2va1 s ILE 181 CO -0.11 -0.65 0.78 -0.89 0.24 0.00 0.00 174.94 174.31 2va1 s THR 182 N -2.54 4.81 0.29 8.37 2.01 -1.26 -1.97 115.64 125.34 2va1 s THR 182 Ca 0.00 0.55 -0.01 0.00 0.31 0.00 0.00 61.69 62.54 2va1 s THR 182 Cb -0.02 -3.76 0.27 0.00 0.01 0.00 0.00 72.50 69.01 2va1 s THR 182 CO -0.03 -0.58 1.91 -0.26 -0.69 0.00 0.00 174.62 174.97 2va1 h PHE 183 N 1.07 1.12 -0.28 4.92 -1.00 -1.69 0.12 116.94 121.19 2va1 h PHE 183 Ca -0.47 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.33 2va1 h PHE 183 Cb 1.19 -0.37 -0.01 0.00 3.61 0.00 0.00 35.95 40.37 2va1 h PHE 183 CO 0.60 0.61 0.15 -0.91 -1.61 0.00 0.00 178.31 177.16 2va1 h ASN 184 N 1.12 0.35 -0.28 2.17 -0.26 -1.94 -2.79 115.58 113.94 2va1 h ASN 184 Ca 0.39 -0.08 -0.01 0.00 -0.56 0.00 0.00 56.30 56.04 2va1 h ASN 184 Cb 0.11 -0.09 -0.02 0.00 -1.06 0.00 0.00 38.32 37.27 2va1 h ASN 184 CO -0.14 0.33 0.16 -0.03 -1.06 0.00 0.00 177.43 176.69 2va1 h MET 185 N 0.34 0.42 0.36 0.81 4.05 -1.78 -2.96 114.93 116.17 2va1 h MET 185 Ca 0.10 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.46 2va1 h MET 185 Cb 0.06 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 30.77 2va1 h MET 185 CO -0.02 0.32 -0.17 0.00 0.23 0.00 0.00 176.91 177.28 2va1 h ALA 186 N 1.75 -1.03 0.00 0.39 0.00 -0.51 -3.14 119.26 116.71 2va1 h ALA 186 Ca 0.11 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2va1 h ALA 186 Cb 0.04 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2va1 h ALA 186 CO -0.02 -1.00 -0.04 1.37 0.00 0.00 0.00 179.25 179.56 2va1 h LEU 187 N -0.52 0.00 -0.78 0.00 8.10 -1.59 -2.58 115.31 117.94 2va1 h LEU 187 Ca -0.05 0.00 -0.04 0.00 0.11 0.00 0.00 57.88 57.91 2va1 h LEU 187 Cb 0.37 0.00 -0.04 0.00 -0.44 0.00 0.00 40.66 40.55 2va1 h LEU 187 CO 0.08 0.04 0.35 0.74 -4.11 0.00 0.00 178.44 175.54 2va1 h THR 188 N 0.00 1.25 -0.22 0.15 2.02 -1.59 -2.40 112.91 112.12 2va1 h THR 188 Ca -0.00 -0.75 0.00 0.00 0.77 0.00 0.00 66.41 66.43 2va1 h THR 188 Cb 0.55 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 67.26 2va1 h THR 188 CO 0.01 0.31 0.00 0.00 0.37 0.00 0.00 175.52 176.21 2va1 n GLN 189 N -4.34 1.82 -2.03 6.66 3.00 -0.98 -4.89 117.38 116.62 2va1 n GLN 189 Ca 0.07 -0.93 -0.17 0.00 -0.01 0.00 0.00 57.00 55.96 2va1 n GLN 189 Cb 0.16 -1.39 -0.04 0.00 0.00 0.00 0.00 30.24 28.97 2va1 n GLN 189 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 2va1 n ASN 190 N 0.21 -4.87 -4.78 1.08 4.05 -0.90 -4.95 115.26 105.10 2va1 n ASN 190 Ca 0.08 0.22 -0.37 0.00 0.45 0.00 0.00 54.58 54.97 2va1 n ASN 190 Cb 0.33 -4.20 -0.03 0.00 1.23 0.00 0.00 39.78 37.11 2va1 n ASN 190 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 2va1 s LEU 191 N -5.20 4.16 -0.92 1.20 1.43 -1.15 -4.98 118.68 113.22 2va1 s LEU 191 Ca 0.00 2.15 -0.00 0.00 -1.03 0.00 0.00 54.13 55.24 2va1 s LEU 191 Cb 0.00 -4.13 0.30 0.00 0.03 0.00 0.00 46.19 42.39 2va1 s LEU 191 CO 0.00 -0.57 1.33 1.17 0.23 0.00 0.00 176.35 178.51 2va1 n LYS 192 N -0.03 4.10 0.18 1.70 4.81 -1.26 -4.64 118.16 123.01 2va1 n LYS 192 Ca 0.05 -4.64 -0.12 0.00 -0.87 0.00 0.00 58.31 52.72 2va1 n LYS 192 Cb 0.48 -2.42 -0.07 0.00 0.02 0.00 0.00 35.03 33.05 2va1 n LYS 192 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2va1 h VAL 193 N 3.08 0.50 -4.07 3.15 2.07 -1.94 -3.46 116.25 115.58 2va1 h VAL 193 Ca 0.26 -0.64 -0.36 0.00 0.82 0.00 0.00 66.70 66.78 2va1 h VAL 193 Cb 0.55 0.76 -0.14 0.00 -1.52 0.00 0.00 31.29 30.94 2va1 h VAL 193 CO 1.14 0.10 -0.59 -0.04 0.02 0.00 0.00 177.57 178.20 2va1 s MET 194 N -4.26 1.46 0.81 1.57 -1.94 -1.26 -5.13 119.30 110.54 2va1 s MET 194 Ca -0.13 -1.81 -0.12 0.00 -1.71 0.00 0.00 55.69 51.92 2va1 s MET 194 Cb 0.02 -0.05 0.08 0.00 2.01 0.00 0.00 34.83 36.89 2va1 s MET 194 CO 0.47 -0.40 1.15 0.16 -0.01 0.00 0.00 175.02 176.39 2va1 s ASP 195 N -3.31 3.80 0.34 3.03 -4.77 -1.26 -4.78 116.67 109.72 2va1 s ASP 195 Ca 0.37 2.15 0.06 0.00 -3.30 0.00 0.00 52.55 51.83 2va1 s ASP 195 Cb 0.06 -2.56 0.73 0.00 -1.09 0.00 0.00 42.92 40.06 2va1 s ASP 195 CO 0.16 -2.51 1.89 0.00 0.70 0.00 0.00 175.17 175.40 2va1 h ALA 196 N -1.10 1.73 -0.13 2.11 0.00 -1.99 -2.01 119.26 117.86 2va1 h ALA 196 Ca -0.45 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 2va1 h ALA 196 Cb 1.27 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2va1 h ALA 196 CO 0.47 0.08 0.06 1.15 0.00 0.00 0.00 179.25 181.00 2va1 h THR 197 N 0.79 1.14 -0.67 0.00 2.02 -1.99 -1.12 112.91 113.08 2va1 h THR 197 Ca 0.41 -0.41 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2va1 h THR 197 Cb 0.52 1.18 -0.03 0.00 -1.74 0.00 0.00 68.15 68.07 2va1 h THR 197 CO -0.18 0.13 0.37 0.00 0.37 0.00 0.00 175.52 176.20 2va1 h ALA 198 N 0.91 0.86 -0.12 6.16 0.00 -1.76 -1.31 119.26 123.99 2va1 h ALA 198 Ca 0.04 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.87 2va1 h ALA 198 Cb 0.15 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2va1 h ALA 198 CO -0.00 0.37 -0.02 -0.07 0.00 0.00 0.00 179.25 179.52 2va1 h LEU 199 N 0.92 -0.10 -0.35 0.00 4.07 -1.25 -1.26 115.31 117.34 2va1 h LEU 199 Ca 0.24 0.03 0.04 0.00 0.08 0.00 0.00 57.88 58.27 2va1 h LEU 199 Cb 0.04 0.07 -0.04 0.00 1.08 0.00 0.00 40.66 41.81 2va1 h LEU 199 CO -0.04 -0.03 0.12 0.00 -1.08 0.00 0.00 178.44 177.41 2va1 h ALA 200 N 1.12 0.40 -0.55 1.53 0.00 -0.93 -1.20 119.26 119.63 2va1 h ALA 200 Ca 0.06 0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.05 2va1 h ALA 200 Cb 0.08 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2va1 h ALA 200 CO -0.12 -0.27 0.30 -0.07 0.00 0.00 0.00 179.25 179.09 2va1 h LEU 201 N 0.27 0.46 -0.64 0.00 4.07 -1.08 -0.08 115.31 118.31 2va1 h LEU 201 Ca 0.16 0.02 -0.09 0.00 0.08 0.00 0.00 57.88 58.05 2va1 h LEU 201 Cb 0.13 -0.07 -0.02 0.00 1.08 0.00 0.00 40.66 41.78 2va1 h LEU 201 CO -0.16 0.31 0.05 0.00 -1.08 0.00 0.00 178.44 177.56 2va1 h GLN 203 N 1.00 0.26 -0.39 0.00 4.15 -0.93 0.22 115.11 119.42 2va1 h GLN 203 Ca 0.19 -0.08 0.04 0.00 0.77 0.00 0.00 58.65 59.56 2va1 h GLN 203 Cb 0.50 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.15 2va1 h GLN 203 CO 0.02 0.48 0.26 0.93 -1.93 0.00 0.00 178.83 178.59 2va1 h GLU 204 N 0.00 0.37 -0.27 1.69 5.08 -1.00 -2.88 114.58 117.57 2va1 h GLU 204 Ca 0.04 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2va1 h GLU 204 Cb 0.36 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2va1 h GLU 204 CO 0.01 0.25 0.00 0.09 -1.00 0.00 0.00 179.01 178.35 2va1 n ASN 205 N -4.48 3.20 -3.65 1.42 3.02 -1.04 -5.00 115.26 108.73 2va1 n ASN 205 Ca 0.04 -2.44 -0.21 0.00 -0.03 0.00 0.00 54.58 51.94 2va1 n ASN 205 Cb 0.18 -0.34 0.05 0.00 -0.61 0.00 0.00 39.78 39.05 2va1 n ASN 205 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2va1 n ASN 206 N -0.04 -2.02 -4.55 6.41 2.85 -0.47 -4.98 115.26 112.45 2va1 n ASN 206 Ca 0.15 -0.75 -0.35 0.00 -0.11 0.00 0.00 54.58 53.51 2va1 n ASN 206 Cb 0.60 -4.36 -0.11 0.00 1.24 0.00 0.00 39.78 37.15 2va1 n ASN 206 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2va1 s ILE 207 N -3.54 4.54 0.30 -1.44 1.01 0.65 -4.87 121.20 117.85 2va1 s ILE 207 Ca 0.10 -0.11 -0.05 0.00 0.00 0.00 0.00 60.65 60.58 2va1 s ILE 207 Cb -0.05 -3.07 -0.05 0.00 0.01 0.00 0.00 42.46 39.30 2va1 s ILE 207 CO 0.79 0.42 0.58 0.20 0.00 0.00 0.00 174.94 176.92 2va1 s ASN 208 N 0.82 6.45 -0.00 3.58 0.01 0.36 -4.60 114.94 121.57 2va1 s ASN 208 Ca 0.03 0.76 0.03 0.00 -0.71 0.00 0.00 52.86 52.97 2va1 s ASN 208 Cb -0.14 -2.16 -0.03 0.00 0.41 0.00 0.00 41.25 39.33 2va1 s ASN 208 CO 0.02 -0.22 -0.07 -0.76 -1.51 0.00 0.00 177.10 174.57 2va1 s LEU 209 N -3.58 3.17 -0.43 0.60 1.43 0.12 -0.41 118.68 119.58 2va1 s LEU 209 Ca 0.45 -0.13 0.03 0.00 -1.03 0.00 0.00 54.13 53.44 2va1 s LEU 209 Cb -0.11 -1.80 0.12 0.00 0.03 0.00 0.00 46.19 44.43 2va1 s LEU 209 CO 0.30 0.29 0.18 -0.22 0.23 0.00 0.00 176.35 177.13 2va1 s LEU 210 N -1.36 3.89 -0.11 1.79 0.20 0.28 -0.57 118.68 122.80 2va1 s LEU 210 Ca 0.17 -2.55 -0.21 0.00 0.69 0.00 0.00 54.13 52.23 2va1 s LEU 210 Cb -0.11 -1.43 -0.04 0.00 -0.43 0.00 0.00 46.19 44.18 2va1 s LEU 210 CO 0.07 -0.30 0.59 -0.69 -0.29 0.00 0.00 176.35 175.73 2va1 s VAL 211 N 0.37 5.11 0.29 1.68 1.01 -0.02 -0.48 120.40 128.36 2va1 s VAL 211 Ca 0.15 1.19 -0.14 0.00 0.00 0.00 0.00 61.98 63.17 2va1 s VAL 211 Cb -0.23 -3.93 0.01 0.00 0.00 0.00 0.00 36.38 32.24 2va1 s VAL 211 CO -0.05 0.27 0.59 0.72 0.00 0.00 0.00 175.10 176.63 2va1 s PHE 212 N 0.87 0.26 -0.36 5.22 -0.12 -1.07 -0.93 117.98 121.86 2va1 s PHE 212 Ca 0.31 -0.68 -0.23 0.00 -0.05 0.00 0.00 56.93 56.27 2va1 s PHE 212 Cb -0.16 0.39 0.01 0.00 -0.63 0.00 0.00 43.02 42.63 2va1 s PHE 212 CO 0.14 -1.16 0.80 1.21 -0.05 0.00 0.00 175.22 176.15 2va1 s ASN 213 N -3.03 6.58 0.24 1.98 2.47 -1.18 -0.21 114.94 121.80 2va1 s ASN 213 Ca 0.19 0.42 0.23 0.00 0.42 0.00 0.00 52.86 54.12 2va1 s ASN 213 Cb -0.03 -2.40 0.17 0.00 -1.45 0.00 0.00 41.25 37.54 2va1 s ASN 213 CO 0.10 -0.73 1.25 -0.29 -3.72 0.00 0.00 177.10 173.71 2va1 h ILE 214 N 5.74 0.00 -0.01 -5.21 2.10 -1.39 -3.33 117.51 115.40 2va1 h ILE 214 Ca -0.24 -0.89 -0.06 0.00 1.08 0.00 0.00 64.86 64.75 2va1 h ILE 214 Cb 1.09 1.54 -0.01 0.00 -1.09 0.00 0.00 36.82 38.35 2va1 h ILE 214 CO 0.91 0.00 -0.26 0.44 -1.08 0.00 0.00 178.15 178.16 2va1 h ASP 215 N 0.00 0.02 -3.97 2.19 5.19 -1.92 -3.44 116.42 114.48 2va1 h ASP 215 Ca 0.00 -0.00 -0.53 0.00 -0.62 0.00 0.00 57.03 55.87 2va1 h ASP 215 Cb 0.95 -0.00 0.10 0.00 0.18 0.00 0.00 39.33 40.55 2va1 h ASP 215 CO 0.00 0.28 0.65 -0.75 -3.12 0.00 0.00 179.24 176.30 2va1 s LYS 216 N -4.45 3.80 0.17 3.56 2.20 -1.25 -4.95 119.74 118.82 2va1 s LYS 216 Ca -0.04 2.28 -0.33 0.00 -0.36 0.00 0.00 55.97 57.52 2va1 s LYS 216 Cb 0.15 -2.68 -0.14 0.00 -1.51 0.00 0.00 37.83 33.65 2va1 s LYS 216 CO 0.71 -0.68 1.52 -2.30 -0.36 0.00 0.00 175.35 174.25 2va1 n PRO 217 N -0.08 2.04 -1.95 4.03 -0.02 -1.26 -2.53 135.00 135.23 2va1 n PRO 217 Ca 0.05 0.73 -0.20 0.00 -2.02 0.00 0.00 63.50 62.06 2va1 n PRO 217 Cb 0.43 -2.47 -0.05 0.00 -0.02 0.00 0.00 33.50 31.39 2va1 n PRO 217 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2va1 n ASN 218 N 3.06 -5.52 -0.15 2.55 5.15 -1.26 -4.90 115.26 114.19 2va1 n ASN 218 Ca 0.16 0.25 -0.07 0.00 -0.60 0.00 0.00 54.58 54.32 2va1 n ASN 218 Cb 0.29 -4.66 0.02 0.00 -0.53 0.00 0.00 39.78 34.89 2va1 n ASN 218 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2va1 h ALA 219 N 0.44 0.57 -0.33 5.20 0.00 -1.78 -1.10 119.26 122.25 2va1 h ALA 219 Ca -0.44 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.37 2va1 h ALA 219 Cb 1.32 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2va1 h ALA 219 CO 0.58 -0.02 -0.14 0.82 0.00 0.00 0.00 179.25 180.49 2va1 h ILE 220 N 0.56 1.29 -0.48 0.00 2.04 -1.89 -1.81 117.51 117.22 2va1 h ILE 220 Ca 0.17 -1.23 -0.02 0.00 1.00 0.00 0.00 64.86 64.78 2va1 h ILE 220 Cb -0.02 1.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 2va1 h ILE 220 CO -0.07 0.40 0.22 0.58 0.00 0.00 0.00 178.15 179.29 2va1 h VAL 221 N 0.45 1.19 -0.35 1.67 2.07 -1.86 -3.14 116.25 116.29 2va1 h VAL 221 Ca 0.08 -0.57 -0.13 0.00 0.82 0.00 0.00 66.70 66.90 2va1 h VAL 221 Cb 0.66 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 2va1 h VAL 221 CO 0.04 0.22 -0.30 0.44 0.02 0.00 0.00 177.57 177.99 2va1 h ASP 222 N 0.64 0.78 0.68 0.57 3.32 -1.07 -2.88 116.42 118.46 2va1 h ASP 222 Ca 0.17 -0.31 -0.07 0.00 0.02 0.00 0.00 57.03 56.83 2va1 h ASP 222 Cb 0.14 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2va1 h ASP 222 CO -0.02 1.03 -0.34 -0.37 -1.72 0.00 0.00 179.24 177.82 2va1 h VAL 223 N 0.64 0.91 0.00 -1.35 -1.51 -1.36 0.22 116.25 113.80 2va1 h VAL 223 Ca 0.07 -1.33 -0.04 0.00 -1.23 0.00 0.00 66.70 64.17 2va1 h VAL 223 Cb 0.83 1.80 -0.01 0.00 -2.13 0.00 0.00 31.29 31.78 2va1 h VAL 223 CO 0.07 0.33 -0.19 -0.07 -1.23 0.00 0.00 177.57 176.48 2va1 h LEU 224 N 0.00 0.00 -2.32 4.19 3.38 -1.48 -2.53 115.31 116.55 2va1 h LEU 224 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2va1 h LEU 224 Cb 0.77 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.52 2va1 h LEU 224 CO 0.04 0.19 0.00 -0.62 0.09 0.00 0.00 178.44 178.14 2va1 n GLU 225 N -3.22 2.51 -2.39 1.13 1.02 -0.87 -4.96 120.64 113.87 2va1 n GLU 225 Ca 0.02 -2.26 -0.20 0.00 -0.02 0.00 0.00 57.16 54.69 2va1 n GLU 225 Cb 0.51 -1.51 -0.01 0.00 -0.02 0.00 0.00 31.44 30.41 2va1 n GLU 225 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2va1 n LYS 226 N 1.30 -1.71 0.04 3.49 5.02 -0.58 -4.92 118.16 120.80 2va1 n LYS 226 Ca 0.21 1.00 -0.05 0.00 -2.02 0.00 0.00 58.31 57.45 2va1 n LYS 226 Cb 0.54 -5.66 -0.10 0.00 -0.02 0.00 0.00 35.03 29.80 2va1 n LYS 226 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2va1 h LYS 227 N 0.00 0.00 0.00 1.97 1.57 -0.86 -3.48 116.57 115.77 2va1 h LYS 227 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 2va1 h LYS 227 Cb 1.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.67 2va1 h LYS 227 CO 0.58 0.61 0.00 0.09 -0.57 0.00 0.00 179.45 180.16 2va1 n ASN 228 N -3.14 1.27 -4.69 0.86 3.02 -1.26 -5.04 115.26 106.28 2va1 n ASN 228 Ca -0.07 -0.28 -0.42 0.00 -0.03 0.00 0.00 54.58 53.78 2va1 n ASN 228 Cb 0.92 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 40.07 2va1 n ASN 228 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2va1 s LYS 229 N 0.70 4.41 0.18 3.52 1.02 -1.26 -5.03 119.74 123.28 2va1 s LYS 229 Ca 0.00 1.49 -0.15 0.00 0.02 0.00 0.00 55.97 57.34 2va1 s LYS 229 Cb 0.00 -3.53 0.02 0.00 -0.52 0.00 0.00 37.83 33.80 2va1 s LYS 229 CO 0.00 -0.33 0.44 1.52 -0.92 0.00 0.00 175.35 176.06 2va1 s TYR 230 N 1.95 0.03 -0.06 3.18 1.13 -1.26 -4.56 117.35 117.76 2va1 s TYR 230 Ca 0.51 -0.38 0.06 0.00 -1.41 0.00 0.00 57.07 55.85 2va1 s TYR 230 Cb -0.21 0.24 -0.01 0.00 -1.10 0.00 0.00 41.96 40.89 2va1 s TYR 230 CO 0.20 -0.83 -0.24 0.99 -2.51 0.00 0.00 175.55 173.16 2va1 s THR 231 N -3.89 2.00 -0.13 -3.49 2.01 -0.10 -4.60 115.64 107.43 2va1 s THR 231 Ca 0.11 -1.03 -0.11 0.00 0.31 0.00 0.00 61.69 60.97 2va1 s THR 231 Cb 0.01 -1.70 -0.05 0.00 0.01 0.00 0.00 72.50 70.77 2va1 s THR 231 CO -0.03 0.55 0.22 -0.63 -0.69 0.00 0.00 174.62 174.05 2va1 s ILE 232 N -0.05 5.36 -0.23 1.82 1.01 -0.26 -0.84 121.20 128.01 2va1 s ILE 232 Ca -0.06 0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.98 2va1 s ILE 232 Cb -0.14 -3.53 0.03 0.00 0.01 0.00 0.00 42.46 38.83 2va1 s ILE 232 CO 0.04 0.51 -0.12 -0.69 0.00 0.00 0.00 174.94 174.69 2va1 s VAL 233 N -0.31 2.49 0.08 2.92 1.01 0.26 -1.36 120.40 125.49 2va1 s VAL 233 Ca 0.15 -1.08 0.01 0.00 0.00 0.00 0.00 61.98 61.07 2va1 s VAL 233 Cb -0.13 -2.22 -0.00 0.00 0.00 0.00 0.00 36.38 34.02 2va1 s VAL 233 CO 0.04 0.29 0.04 -1.54 0.00 0.00 0.00 175.10 173.93 2va1 n SER 234 N 4.62 0.44 -0.61 3.32 3.41 -0.83 -0.70 113.62 123.26 2va1 n SER 234 Ca -0.18 -1.45 0.13 0.00 -0.26 0.00 0.00 58.87 57.12 2va1 n SER 234 Cb 0.47 0.28 0.41 0.00 -0.26 0.00 0.00 64.21 65.11 2va1 n SER 234 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17