#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k33 s VAL 2 N 0.00 0.01 -0.31 5.18 0.11 -1.10 -4.94 120.40 119.35 2k33 s VAL 2 Ca 0.00 -1.00 0.03 0.00 -2.93 0.00 0.00 61.98 58.08 2k33 s VAL 2 Cb 0.00 -1.88 0.09 0.00 -1.53 0.00 0.00 36.38 33.06 2k33 s VAL 2 CO 0.00 -0.04 0.02 -0.63 -3.33 0.00 0.00 175.10 171.12 2k33 s ILE 3 N -3.92 1.98 -0.05 7.04 1.01 -1.26 0.55 121.20 126.54 2k33 s ILE 3 Ca 0.13 -1.99 -0.31 0.00 0.00 0.00 0.00 60.65 58.48 2k33 s ILE 3 Cb -0.03 -2.39 -0.09 0.00 0.01 0.00 0.00 42.46 39.96 2k33 s ILE 3 CO 0.04 -0.48 2.01 -0.38 0.00 0.00 0.00 174.94 176.13 2k33 n ILE 4 N 4.41 0.63 -4.19 2.92 5.41 0.08 -4.96 119.36 123.65 2k33 n ILE 4 Ca -0.01 -0.19 -0.14 0.00 1.00 0.00 0.00 62.75 63.40 2k33 n ILE 4 Cb 0.42 -2.23 -0.11 0.00 -0.71 0.00 0.00 39.64 37.01 2k33 n ILE 4 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2k33 s LYS 5 N 4.79 0.88 1.05 0.38 1.02 -1.26 -3.98 119.74 122.63 2k33 s LYS 5 Ca 0.93 -1.21 -0.18 0.00 0.02 0.00 0.00 55.97 55.53 2k33 s LYS 5 Cb -0.50 -0.55 0.26 0.00 -0.52 0.00 0.00 37.83 36.53 2k33 s LYS 5 CO 0.44 0.08 0.94 -0.35 -0.92 0.00 0.00 175.35 175.53 2k33 n PRO 6 N 0.43 -2.85 0.00 -1.68 -0.04 -1.18 -4.93 135.00 124.76 2k33 n PRO 6 Ca -0.15 -1.50 0.05 0.00 -0.04 0.00 0.00 63.50 61.86 2k33 n PRO 6 Cb 0.58 -1.40 -0.00 0.00 -0.04 0.00 0.00 33.50 32.63 2k33 n PRO 6 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2k33 n GLN 7 N -4.37 2.11 -4.12 0.54 7.27 -1.26 -4.28 117.38 113.27 2k33 n GLN 7 Ca 0.13 -0.59 -0.15 0.00 0.07 0.00 0.00 57.00 56.46 2k33 n GLN 7 Cb 0.50 -1.09 -0.06 0.00 2.41 0.00 0.00 30.24 32.01 2k33 n GLN 7 CO 0.00 0.00 0.00 0.14 0.07 0.00 0.00 177.06 177.27 2k33 s VAL 8 N -1.41 0.00 -0.19 1.69 -7.23 -1.26 -4.93 120.40 107.07 2k33 s VAL 8 Ca 0.08 -1.69 -0.04 0.00 -1.81 0.00 0.00 61.98 58.52 2k33 s VAL 8 Cb 0.08 -2.55 -0.02 0.00 0.56 0.00 0.00 36.38 34.45 2k33 s VAL 8 CO 0.27 0.00 -0.03 -0.44 -0.31 0.00 0.00 175.10 174.59 2k33 s SER 9 N -3.23 4.62 0.00 4.85 0.01 -1.26 -3.36 113.70 115.33 2k33 s SER 9 Ca 0.32 -0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.33 2k33 s SER 9 Cb 0.01 -1.78 0.00 0.00 0.21 0.00 0.00 66.02 64.46 2k33 s SER 9 CO 0.19 0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.52 2k33 n GLY 10 N 4.23 1.90 2.88 3.44 0.00 -0.92 -4.43 105.19 112.29 2k33 n GLY 10 Ca -0.17 0.21 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 2k33 n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k33 s VAL 11 N 1.62 0.18 0.33 1.61 1.01 -1.01 -1.34 120.40 122.80 2k33 s VAL 11 Ca 0.00 -0.03 -0.28 0.00 0.00 0.00 0.00 61.98 61.67 2k33 s VAL 11 Cb 0.00 -0.20 -0.13 0.00 0.00 0.00 0.00 36.38 36.05 2k33 s VAL 11 CO 0.00 0.09 1.19 -0.38 0.00 0.00 0.00 175.10 176.00 2k33 n ILE 12 N 3.43 2.05 -0.04 2.22 2.08 -0.99 -1.18 119.36 126.92 2k33 n ILE 12 Ca -0.18 -0.50 -0.06 0.00 0.56 0.00 0.00 62.75 62.57 2k33 n ILE 12 Cb 0.56 -1.38 -0.05 0.00 -0.75 0.00 0.00 39.64 38.02 2k33 n ILE 12 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 2k33 n VAL 13 N 0.23 0.52 -3.80 1.39 0.31 0.12 -2.29 118.33 114.80 2k33 n VAL 13 Ca 0.06 -0.22 -0.01 0.00 -0.01 0.00 0.00 64.34 64.16 2k33 n VAL 13 Cb 0.35 -0.82 0.00 0.00 -0.91 0.00 0.00 33.84 32.46 2k33 n VAL 13 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2k33 s ASN 14 N -4.66 -0.05 -0.32 4.52 2.47 -1.23 -4.88 114.94 110.79 2k33 s ASN 14 Ca -0.10 -0.39 -0.02 0.00 0.42 0.00 0.00 52.86 52.77 2k33 s ASN 14 Cb 0.03 0.35 0.12 0.00 -1.45 0.00 0.00 41.25 40.29 2k33 s ASN 14 CO 0.23 -0.67 0.18 -0.54 -3.72 0.00 0.00 177.10 172.59 2k33 s LYS 15 N -2.47 0.35 -1.44 0.43 1.02 -1.26 -1.47 119.74 114.90 2k33 s LYS 15 Ca 0.19 -0.83 -0.08 0.00 0.02 0.00 0.00 55.97 55.26 2k33 s LYS 15 Cb 0.00 -1.16 -0.04 0.00 -0.52 0.00 0.00 37.83 36.11 2k33 s LYS 15 CO 0.01 -1.10 2.83 1.28 -0.92 0.00 0.00 175.35 177.45 2k33 n LEU 16 N 4.74 8.36 -3.66 3.17 4.77 0.14 -4.83 117.00 129.70 2k33 n LEU 16 Ca 0.02 -4.45 -0.09 0.00 -0.03 0.00 0.00 56.01 51.45 2k33 n LEU 16 Cb 0.40 -1.49 -0.02 0.00 -2.33 0.00 0.00 43.42 39.98 2k33 n LEU 16 CO 0.08 2.05 0.42 0.72 -1.33 0.00 0.00 177.39 179.33 2k33 s PHE 17 N 1.10 -0.33 0.35 -1.77 -0.71 -1.23 -3.93 117.98 111.45 2k33 s PHE 17 Ca 0.65 -0.01 0.04 0.00 -1.04 0.00 0.00 56.93 56.58 2k33 s PHE 17 Cb 0.19 0.61 -0.06 0.00 -1.21 0.00 0.00 43.02 42.55 2k33 s PHE 17 CO -0.07 -1.04 0.05 0.15 -1.34 0.00 0.00 175.22 172.98 2k33 s LYS 18 N -3.84 1.73 -0.53 1.99 -0.14 -1.26 -5.08 119.74 112.62 2k33 s LYS 18 Ca 0.07 -1.98 -0.24 0.00 -1.36 0.00 0.00 55.97 52.46 2k33 s LYS 18 Cb -0.03 -0.98 0.04 0.00 -1.68 0.00 0.00 37.83 35.18 2k33 s LYS 18 CO -0.03 -0.19 0.90 0.00 -0.76 0.00 0.00 175.35 175.27 2k33 s ALA 19 N -3.19 3.20 0.00 5.17 0.00 -1.26 -3.65 121.76 122.02 2k33 s ALA 19 Ca 0.35 -1.21 0.00 0.00 0.00 0.00 0.00 51.96 51.09 2k33 s ALA 19 Cb 0.08 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.53 2k33 s ALA 19 CO 0.15 -2.28 0.00 0.41 0.00 0.00 0.00 175.76 174.04 2k33 n GLY 20 N 5.09 0.91 3.97 0.00 0.00 -0.40 -4.96 105.19 109.80 2k33 n GLY 20 Ca 0.02 -0.39 -0.21 0.00 0.00 0.00 0.00 46.02 45.43 2k33 n GLY 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k33 s ASP 21 N -2.37 5.86 0.11 1.61 2.15 -1.24 -4.86 116.67 117.93 2k33 s ASP 21 Ca 0.00 0.11 -0.29 0.00 0.43 0.00 0.00 52.55 52.79 2k33 s ASP 21 Cb 0.00 -1.40 -0.06 0.00 -0.30 0.00 0.00 42.92 41.16 2k33 s ASP 21 CO 0.00 -0.62 0.93 -0.54 -0.17 0.00 0.00 175.17 174.76 2k33 s LYS 22 N -4.43 4.68 0.13 4.34 1.02 -1.26 -2.53 119.74 121.69 2k33 s LYS 22 Ca 0.47 1.39 0.06 0.00 0.02 0.00 0.00 55.97 57.91 2k33 s LYS 22 Cb -0.10 -3.36 -0.04 0.00 -0.52 0.00 0.00 37.83 33.81 2k33 s LYS 22 CO 0.35 0.26 0.03 0.08 -0.92 0.00 0.00 175.35 175.15 2k33 s VAL 23 N -0.14 4.04 0.49 3.17 1.01 0.66 -4.95 120.40 124.68 2k33 s VAL 23 Ca 0.45 -1.13 0.05 0.00 0.00 0.00 0.00 61.98 61.35 2k33 s VAL 23 Cb -0.23 -2.99 -0.01 0.00 0.00 0.00 0.00 36.38 33.15 2k33 s VAL 23 CO 0.29 0.00 0.19 -0.54 0.00 0.00 0.00 175.10 175.04 2k33 s LYS 24 N -2.66 2.21 -1.10 2.72 -0.14 -1.26 -1.65 119.74 117.85 2k33 s LYS 24 Ca 0.27 -2.10 -0.21 0.00 -1.36 0.00 0.00 55.97 52.57 2k33 s LYS 24 Cb -0.11 -1.86 0.06 0.00 -1.68 0.00 0.00 37.83 34.25 2k33 s LYS 24 CO 0.20 -0.37 1.53 0.15 -0.76 0.00 0.00 175.35 176.09 2k33 s LYS 25 N -4.02 3.72 0.00 1.68 1.02 -1.26 -3.16 119.74 117.71 2k33 s LYS 25 Ca 0.26 -1.42 0.00 0.00 0.02 0.00 0.00 55.97 54.83 2k33 s LYS 25 Cb 0.01 -5.40 0.00 0.00 -0.52 0.00 0.00 37.83 31.93 2k33 s LYS 25 CO 0.15 -2.21 0.00 0.41 -0.92 0.00 0.00 175.35 172.79 2k33 n GLY 26 N 6.36 1.25 3.72 -3.33 0.00 0.43 -4.96 105.19 108.66 2k33 n GLY 26 Ca 0.38 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.98 2k33 n GLY 26 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2k33 s GLN 27 N -0.31 4.56 0.34 1.61 0.74 -1.19 -4.49 119.66 120.92 2k33 s GLN 27 Ca 0.00 1.53 -0.29 0.00 0.05 0.00 0.00 55.36 56.66 2k33 s GLN 27 Cb 0.00 -3.40 -0.11 0.00 1.10 0.00 0.00 33.01 30.60 2k33 s GLN 27 CO 0.00 -0.04 1.39 0.99 -0.55 0.00 0.00 175.29 177.08 2k33 s THR 28 N 0.72 2.45 0.00 -0.34 2.01 -1.26 -1.28 115.64 117.93 2k33 s THR 28 Ca 0.52 0.44 0.00 0.00 0.31 0.00 0.00 61.69 62.97 2k33 s THR 28 Cb -0.24 -3.28 0.00 0.00 0.01 0.00 0.00 72.50 68.99 2k33 s THR 28 CO 0.29 0.10 0.00 0.18 -0.69 0.00 0.00 174.62 174.51 2k33 n LEU 29 N 0.79 0.43 -4.40 4.42 4.77 -0.78 -4.54 117.00 117.70 2k33 n LEU 29 Ca 0.01 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.79 2k33 n LEU 29 Cb 0.41 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.39 2k33 n LEU 29 CO 0.61 0.07 -0.31 -0.36 -1.33 0.00 0.00 177.39 176.07 2k33 s PHE 30 N -1.16 1.80 -0.15 -1.77 0.08 -0.96 0.25 117.98 116.07 2k33 s PHE 30 Ca 0.00 -0.90 -0.14 0.00 0.12 0.00 0.00 56.93 56.01 2k33 s PHE 30 Cb 0.00 -1.10 0.04 0.00 -0.57 0.00 0.00 43.02 41.39 2k33 s PHE 30 CO 0.00 0.03 0.40 0.42 -0.10 0.00 0.00 175.22 175.97 2k33 s ILE 31 N -3.30 -0.00 -0.03 0.64 1.01 -0.54 0.34 121.20 119.31 2k33 s ILE 31 Ca 0.32 0.00 -0.02 0.00 0.00 0.00 0.00 60.65 60.96 2k33 s ILE 31 Cb 0.07 -0.56 0.02 0.00 0.01 0.00 0.00 42.46 42.00 2k33 s ILE 31 CO 0.12 0.00 0.07 -0.63 0.00 0.00 0.00 174.94 174.50 2k33 s ILE 32 N 0.22 -0.03 -0.20 2.92 1.01 0.04 0.12 121.20 125.27 2k33 s ILE 32 Ca -0.00 0.12 -0.09 0.00 0.00 0.00 0.00 60.65 60.68 2k33 s ILE 32 Cb -0.03 -0.13 -0.04 0.00 0.01 0.00 0.00 42.46 42.27 2k33 s ILE 32 CO 0.00 0.05 0.10 -0.70 0.00 0.00 0.00 174.94 174.39 2k33 s GLU 33 N 0.68 4.01 0.52 2.79 -6.30 -0.33 0.16 118.70 120.22 2k33 s GLU 33 Ca -0.05 -0.32 -0.21 0.00 -2.50 0.00 0.00 54.97 51.89 2k33 s GLU 33 Cb -0.07 -3.33 -0.06 0.00 0.00 0.00 0.00 34.13 30.67 2k33 s GLU 33 CO -0.03 0.20 1.16 -0.65 0.02 0.00 0.00 175.26 175.96 2k33 s GLN 34 N 0.61 3.45 0.00 4.30 1.11 -1.25 -2.40 119.66 125.47 2k33 s GLN 34 Ca 0.05 1.73 0.00 0.00 0.01 0.00 0.00 55.36 57.15 2k33 s GLN 34 Cb -0.13 -2.15 0.00 0.00 -1.01 0.00 0.00 33.01 29.72 2k33 s GLN 34 CO 0.01 -0.80 0.00 -3.47 0.01 0.00 0.00 175.29 171.04 2k33 n ASP 35 N -1.02 0.00 0.29 5.90 2.03 -1.26 -4.87 116.55 117.62 2k33 n ASP 35 Ca 0.10 0.00 0.18 0.00 0.52 0.00 0.00 54.79 55.60 2k33 n ASP 35 Cb 0.49 0.00 0.86 0.00 -0.72 0.00 0.00 41.12 41.75 2k33 n ASP 35 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 2k33 h GLN 36 N 0.00 0.00 -0.01 -0.67 4.20 -1.91 -3.26 115.11 113.47 2k33 h GLN 36 Ca 0.00 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.72 2k33 h GLN 36 Cb 0.00 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 2k33 h GLN 36 CO 0.00 0.02 -0.12 0.00 -0.67 0.00 0.00 178.83 178.06 2k33 h ALA 37 N 1.98 -0.58 0.00 3.87 0.00 -1.96 -3.47 119.26 119.10 2k33 h ALA 37 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2k33 h ALA 37 Cb 0.34 0.62 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2k33 h ALA 37 CO 0.00 -0.61 0.00 0.43 0.00 0.00 0.00 179.25 179.07 2k33 n SER 38 N -3.15 0.00 0.09 0.00 7.64 -1.23 -5.02 113.62 111.95 2k33 n SER 38 Ca -0.02 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.75 2k33 n SER 38 Cb 0.08 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.21 2k33 n SER 38 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2k33 h LYS 39 N 0.00 -0.27 -0.06 1.43 1.79 -1.91 -3.15 116.57 114.40 2k33 h LYS 39 Ca 0.00 0.02 0.02 0.00 -2.18 0.00 0.00 60.65 58.51 2k33 h LYS 39 Cb 0.00 0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 30.71 2k33 h LYS 39 CO 0.00 0.12 0.07 0.22 -1.08 0.00 0.00 179.45 178.78 2k33 h ASP 40 N -0.83 0.00 0.00 0.86 3.58 -1.99 -3.20 116.42 114.84 2k33 h ASP 40 Ca -0.03 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.42 2k33 h ASP 40 Cb 0.51 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.56 2k33 h ASP 40 CO 0.05 0.00 0.00 0.33 -2.88 0.00 0.00 179.24 176.74 2k33 n PHE 41 N -3.85 0.00 0.00 0.28 7.35 -1.19 -4.72 117.46 115.32 2k33 n PHE 41 Ca -0.01 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.68 2k33 n PHE 41 Cb 0.17 -0.13 0.00 0.00 0.35 0.00 0.00 39.48 39.87 2k33 n PHE 41 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 2k33 n ASN 42 N -1.14 0.00 -2.64 -2.13 4.05 -1.21 -4.74 115.26 107.45 2k33 n ASN 42 Ca 0.00 0.00 -0.14 0.00 0.45 0.00 0.00 54.58 54.89 2k33 n ASN 42 Cb 0.00 0.00 -0.00 0.00 1.23 0.00 0.00 39.78 41.01 2k33 n ASN 42 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 177.26 173.07 2k33 n ARG 43 N 0.00 -2.58 -2.96 1.20 0.00 -1.26 -4.94 116.66 106.13 2k33 n ARG 43 Ca 0.00 0.52 -0.18 0.00 -0.00 0.00 0.00 57.85 58.19 2k33 n ARG 43 Cb 0.00 -5.14 0.03 0.00 0.00 0.00 0.00 32.46 27.35 2k33 n ARG 43 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2k33 s SER 44 N -2.18 5.40 -0.01 6.15 0.15 -1.26 -5.09 113.70 116.87 2k33 s SER 44 Ca 0.09 -0.49 -0.01 0.00 0.70 0.00 0.00 55.95 56.23 2k33 s SER 44 Cb -0.04 -0.39 -0.00 0.00 -1.71 0.00 0.00 66.02 63.87 2k33 s SER 44 CO 0.11 -1.01 -0.02 0.29 1.20 0.00 0.00 173.24 173.80 2k33 n LYS 45 N -2.06 0.03 -3.03 5.44 4.01 -1.26 -5.14 118.16 116.16 2k33 n LYS 45 Ca 0.10 0.02 0.00 0.00 -0.51 0.00 0.00 58.31 57.93 2k33 n LYS 45 Cb 0.60 -0.57 0.00 0.00 -0.51 0.00 0.00 35.03 34.55 2k33 n LYS 45 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2k33 n ALA 46 N -2.61 0.00 -3.36 7.82 0.00 -1.26 -5.13 120.51 115.97 2k33 n ALA 46 Ca -0.01 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.35 2k33 n ALA 46 Cb 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.40 2k33 n ALA 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k33 s LEU 47 N 0.00 -0.67 0.00 0.00 1.43 -1.26 -4.83 118.68 113.35 2k33 s LEU 47 Ca 0.00 0.30 0.00 0.00 -1.03 0.00 0.00 54.13 53.40 2k33 s LEU 47 Cb 0.00 1.18 0.00 0.00 0.03 0.00 0.00 46.19 47.40 2k33 s LEU 47 CO 0.00 -0.29 0.00 2.22 0.23 0.00 0.00 176.35 178.51 2k33 n PHE 48 N 5.37 -0.57 0.00 0.29 1.16 -1.26 -4.66 117.46 117.79 2k33 n PHE 48 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.54 2k33 n PHE 48 Cb 0.50 0.03 0.00 0.00 -1.61 0.00 0.00 39.48 38.40 2k33 n PHE 48 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 2k33 n SER 49 N -3.87 0.00 -2.86 5.98 2.88 -1.26 -3.89 113.62 110.61 2k33 n SER 49 Ca 0.00 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.15 2k33 n SER 49 Cb 0.00 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 63.50 2k33 n SER 49 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2k33 n GLN 50 N 0.00 2.74 -3.15 -1.46 7.27 -1.26 -4.82 117.38 116.71 2k33 n GLN 50 Ca 0.00 -3.50 -0.20 0.00 0.07 0.00 0.00 57.00 53.37 2k33 n GLN 50 Cb 0.00 -2.27 -0.00 0.00 2.41 0.00 0.00 30.24 30.37 2k33 n GLN 50 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 2k33 n SER 51 N -0.58 -3.59 -0.01 1.69 7.64 -1.26 -4.84 113.62 112.67 2k33 n SER 51 Ca 0.55 -0.24 -0.13 0.00 1.01 0.00 0.00 58.87 60.06 2k33 n SER 51 Cb 0.28 -3.00 -0.07 0.00 -1.01 0.00 0.00 64.21 60.40 2k33 n SER 51 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k33 h ALA 52 N 0.97 -0.70 -3.26 -0.43 0.00 -1.88 -3.43 119.26 110.53 2k33 h ALA 52 Ca -0.38 -0.03 -0.23 0.00 0.00 0.00 0.00 54.91 54.27 2k33 h ALA 52 Cb 1.26 0.88 -0.31 0.00 0.00 0.00 0.00 17.79 19.62 2k33 h ALA 52 CO 0.47 -0.99 -0.58 0.42 0.00 0.00 0.00 179.25 178.57 2k33 s ILE 53 N -5.82 -0.04 -0.74 0.00 1.01 -1.26 -4.87 121.20 109.47 2k33 s ILE 53 Ca -0.15 0.15 -0.26 0.00 0.00 0.00 0.00 60.65 60.38 2k33 s ILE 53 Cb 0.09 -0.24 -0.09 0.00 0.01 0.00 0.00 42.46 42.22 2k33 s ILE 53 CO 0.63 0.06 2.25 -0.55 0.00 0.00 0.00 174.94 177.33 2k33 s SER 54 N 0.98 4.42 0.56 3.58 0.15 -1.26 -4.67 113.70 117.46 2k33 s SER 54 Ca -0.07 0.10 0.37 0.00 0.70 0.00 0.00 55.95 57.04 2k33 s SER 54 Cb -0.10 -2.54 1.49 0.00 -1.71 0.00 0.00 66.02 63.17 2k33 s SER 54 CO -0.05 -3.28 1.72 0.06 1.20 0.00 0.00 173.24 172.88 2k33 h GLN 55 N 13.91 0.00 -5.38 5.44 -0.00 -1.98 -2.94 115.11 124.16 2k33 h GLN 55 Ca -0.05 0.00 -0.25 0.00 -0.00 0.00 0.00 58.65 58.35 2k33 h GLN 55 Cb 1.07 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.53 2k33 h GLN 55 CO 1.10 0.00 0.98 0.36 -0.00 0.00 0.00 178.83 181.27 2k33 n LYS 56 N -3.94 0.64 -3.38 0.06 2.85 -1.26 -2.30 118.16 110.83 2k33 n LYS 56 Ca 0.26 -0.38 -0.24 0.00 -1.05 0.00 0.00 58.31 56.90 2k33 n LYS 56 Cb 1.32 -3.16 -0.00 0.00 -0.65 0.00 0.00 35.03 32.55 2k33 n LYS 56 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2k33 n GLU 57 N 8.54 -3.57 -0.72 -1.58 1.02 -1.26 -4.90 120.64 118.16 2k33 n GLU 57 Ca 0.47 0.51 -0.33 0.00 -0.02 0.00 0.00 57.16 57.78 2k33 n GLU 57 Cb 0.41 -5.24 0.15 0.00 -0.02 0.00 0.00 31.44 26.75 2k33 n GLU 57 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 2k33 n TYR 58 N -4.02 -1.39 -3.91 -0.32 4.11 -0.97 -4.97 117.16 105.69 2k33 n TYR 58 Ca -0.02 0.23 -0.35 0.00 -0.00 0.00 0.00 57.90 57.76 2k33 n TYR 58 Cb 0.55 -1.53 -0.14 0.00 -0.00 0.00 0.00 39.34 38.22 2k33 n TYR 58 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 2k33 s ASP 59 N -1.70 4.33 0.59 9.48 1.11 -1.26 -4.97 116.67 124.25 2k33 s ASP 59 Ca 0.53 -0.48 0.29 0.00 0.18 0.00 0.00 52.55 53.07 2k33 s ASP 59 Cb -0.08 -1.73 1.61 0.00 1.07 0.00 0.00 42.92 43.79 2k33 s ASP 59 CO 0.66 -0.05 2.03 0.77 1.18 0.00 0.00 175.17 179.76 2k33 h SER 60 N 8.11 0.00 0.65 0.27 4.64 -1.93 0.31 113.55 125.59 2k33 h SER 60 Ca -0.40 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2k33 h SER 60 Cb 1.15 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2k33 h SER 60 CO 0.60 0.00 -0.01 -1.28 -0.87 0.00 0.00 176.83 175.27 2k33 h SER 61 N 0.00 0.00 -0.02 4.97 0.87 -2.01 -1.69 113.55 115.67 2k33 h SER 61 Ca 0.12 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 2k33 h SER 61 Cb 0.71 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.67 2k33 h SER 61 CO -0.00 0.01 -0.04 0.00 -0.53 0.00 0.00 176.83 176.27 2k33 n LEU 62 N -3.12 2.55 -3.96 2.23 -0.00 0.11 -4.80 117.00 110.00 2k33 n LEU 62 Ca -0.01 -0.98 -0.31 0.00 -0.00 0.00 0.00 56.01 54.72 2k33 n LEU 62 Cb 0.23 0.00 -0.15 0.00 -0.00 0.00 0.00 43.42 43.50 2k33 n LEU 62 CO 0.25 0.44 -0.31 0.00 -0.00 0.00 0.00 177.39 177.77 2k33 s ALA 63 N -1.69 2.72 1.00 1.47 0.00 -0.64 -5.04 121.76 119.59 2k33 s ALA 63 Ca 0.22 -2.49 0.00 0.00 0.00 0.00 0.00 51.96 49.70 2k33 s ALA 63 Cb 0.16 -1.94 0.00 0.00 0.00 0.00 0.00 23.12 21.35 2k33 s ALA 63 CO 0.27 -1.73 0.00 2.41 0.00 0.00 0.00 175.76 176.71 2k33 n THR 64 N 4.20 0.00 -3.56 0.00 -1.04 -1.26 -4.51 114.28 108.11 2k33 n THR 64 Ca 0.03 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.84 2k33 n THR 64 Cb 0.41 -1.12 0.05 0.00 -1.82 0.00 0.00 70.33 67.85 2k33 n THR 64 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2k33 n LEU 65 N 0.00 -3.73 -4.27 -4.42 4.32 -1.26 -4.93 117.00 102.72 2k33 n LEU 65 Ca 0.00 -0.79 -0.33 0.00 -0.02 0.00 0.00 56.01 54.86 2k33 n LEU 65 Cb 0.00 -2.82 0.14 0.00 -1.62 0.00 0.00 43.42 39.12 2k33 n LEU 65 CO 0.00 0.35 -0.65 0.47 -1.22 0.00 0.00 177.39 176.34 2k33 n ASP 66 N -3.05 -2.55 -3.97 -1.43 9.92 -1.26 -4.88 116.55 109.33 2k33 n ASP 66 Ca -0.22 0.00 -0.21 0.00 -0.53 0.00 0.00 54.79 53.83 2k33 n ASP 66 Cb 0.65 -0.95 -0.16 0.00 -0.64 0.00 0.00 41.12 40.02 2k33 n ASP 66 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 2k33 s HIS 67 N -2.24 1.04 -0.46 1.24 3.76 -1.26 -3.86 115.29 113.52 2k33 s HIS 67 Ca 0.53 -0.32 -0.18 0.00 -0.15 0.00 0.00 55.06 54.95 2k33 s HIS 67 Cb -0.12 -0.79 0.04 0.00 1.11 0.00 0.00 32.58 32.82 2k33 s HIS 67 CO 0.67 -0.18 0.49 0.99 -0.85 0.00 0.00 174.74 175.86 2k33 s THR 68 N 0.57 5.05 -0.21 1.30 2.01 0.12 -4.95 115.64 119.53 2k33 s THR 68 Ca -0.10 -0.53 -0.24 0.00 0.31 0.00 0.00 61.69 61.13 2k33 s THR 68 Cb -0.13 -4.14 -0.01 0.00 0.01 0.00 0.00 72.50 68.23 2k33 s THR 68 CO 0.01 -0.57 0.80 -1.83 -0.69 0.00 0.00 174.62 172.35 2k33 s GLU 69 N 2.20 4.23 -0.61 4.92 -1.05 -1.26 -0.78 118.70 126.34 2k33 s GLU 69 Ca 0.12 0.93 -0.26 0.00 -0.15 0.00 0.00 54.97 55.61 2k33 s GLU 69 Cb -0.19 -3.61 0.04 0.00 -0.44 0.00 0.00 34.13 29.93 2k33 s GLU 69 CO 0.12 -0.41 1.09 0.42 0.95 0.00 0.00 175.26 177.42 2k33 s ILE 70 N 2.45 4.14 0.37 1.83 1.09 0.15 -4.96 121.20 126.27 2k33 s ILE 70 Ca 0.35 0.41 0.01 0.00 -1.10 0.00 0.00 60.65 60.32 2k33 s ILE 70 Cb -0.16 -4.69 -0.03 0.00 -1.06 0.00 0.00 42.46 36.53 2k33 s ILE 70 CO 0.10 -1.37 0.57 -1.59 -0.10 0.00 0.00 174.94 172.55 2k33 s LYS 71 N 4.61 3.38 0.22 2.79 -2.85 -1.26 -1.86 119.74 124.77 2k33 s LYS 71 Ca 0.34 -0.40 -0.20 0.00 -1.00 0.00 0.00 55.97 54.71 2k33 s LYS 71 Cb -0.11 -2.65 -0.08 0.00 -2.06 0.00 0.00 37.83 32.93 2k33 s LYS 71 CO 0.19 0.06 0.73 0.00 0.10 0.00 0.00 175.35 176.43 2k33 s ALA 72 N -2.36 3.41 -0.00 0.59 0.00 -0.41 -4.90 121.76 118.09 2k33 s ALA 72 Ca 0.42 0.18 -0.24 0.00 0.00 0.00 0.00 51.96 52.32 2k33 s ALA 72 Cb -0.10 -2.84 -0.19 0.00 0.00 0.00 0.00 23.12 20.00 2k33 s ALA 72 CO 0.36 0.32 1.29 -1.00 0.00 0.00 0.00 175.76 176.74 2k33 h PRO 73 N 3.48 0.10 -3.93 0.00 0.13 -1.92 0.12 132.00 129.99 2k33 h PRO 73 Ca -0.48 -0.05 -0.12 0.00 -0.87 0.00 0.00 66.00 64.48 2k33 h PRO 73 Cb 1.19 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.16 2k33 h PRO 73 CO 0.65 0.56 -0.55 -0.59 -0.23 0.00 0.00 178.00 177.84 2k33 s PHE 74 N -4.28 0.28 0.79 1.56 -0.71 -1.26 -4.31 117.98 110.05 2k33 s PHE 74 Ca -0.15 -0.67 -0.13 0.00 -1.04 0.00 0.00 56.93 54.94 2k33 s PHE 74 Cb 0.03 -0.20 0.20 0.00 -1.21 0.00 0.00 43.02 41.84 2k33 s PHE 74 CO 0.70 -0.39 0.45 -0.40 -1.34 0.00 0.00 175.22 174.23 2k33 n ASP 75 N 0.50 -3.05 0.00 1.98 5.75 -1.23 -4.62 116.55 115.89 2k33 n ASP 75 Ca -0.17 -0.45 0.00 0.00 -0.01 0.00 0.00 54.79 54.16 2k33 n ASP 75 Cb 0.60 -0.55 0.00 0.00 -1.03 0.00 0.00 41.12 40.14 2k33 n ASP 75 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2k33 n GLY 76 N -2.80 0.38 3.36 6.12 0.00 -0.66 -4.86 105.19 106.73 2k33 n GLY 76 Ca 0.07 -1.78 -0.31 0.00 0.00 0.00 0.00 46.02 44.00 2k33 n GLY 76 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k33 s THR 77 N -1.69 2.30 0.05 2.61 2.01 -0.96 -0.25 115.64 119.71 2k33 s THR 77 Ca 0.00 -1.12 0.06 0.00 0.31 0.00 0.00 61.69 60.93 2k33 s THR 77 Cb 0.00 -1.86 -0.04 0.00 0.01 0.00 0.00 72.50 70.62 2k33 s THR 77 CO 0.00 0.51 -0.11 -0.51 -0.69 0.00 0.00 174.62 173.81 2k33 s ILE 78 N -0.71 3.29 0.00 1.82 2.07 -1.05 -0.75 121.20 125.88 2k33 s ILE 78 Ca 0.11 -1.07 0.00 0.00 -1.41 0.00 0.00 60.65 58.28 2k33 s ILE 78 Cb -0.10 -2.46 0.00 0.00 0.13 0.00 0.00 42.46 40.03 2k33 s ILE 78 CO 0.01 0.28 0.00 0.61 -1.91 0.00 0.00 174.94 173.92 2k33 n GLY 79 N 1.26 1.16 3.75 1.50 0.00 -1.00 -1.27 105.19 110.58 2k33 n GLY 79 Ca -0.15 -1.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.04 2k33 n GLY 79 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k33 s ASP 80 N -1.00 5.36 0.60 1.61 2.15 -1.26 -3.66 116.67 120.47 2k33 s ASP 80 Ca 0.00 -0.08 -0.19 0.00 0.43 0.00 0.00 52.55 52.71 2k33 s ASP 80 Cb 0.00 -1.38 -0.03 0.00 -0.30 0.00 0.00 42.92 41.20 2k33 s ASP 80 CO 0.00 0.16 1.25 0.00 -0.17 0.00 0.00 175.17 176.41 2k33 s ALA 81 N -1.41 2.54 -0.22 3.66 0.00 -1.26 -4.47 121.76 120.61 2k33 s ALA 81 Ca 0.28 1.11 0.02 0.00 0.00 0.00 0.00 51.96 53.38 2k33 s ALA 81 Cb -0.12 -3.50 -0.15 0.00 0.00 0.00 0.00 23.12 19.36 2k33 s ALA 81 CO 0.21 -1.30 -0.19 1.28 0.00 0.00 0.00 175.76 175.76 2k33 n LEU 82 N -1.57 2.84 -5.00 0.00 4.77 0.11 -4.95 117.00 113.20 2k33 n LEU 82 Ca 0.14 -0.11 -0.21 0.00 -0.03 0.00 0.00 56.01 55.80 2k33 n LEU 82 Cb 0.48 -0.72 0.04 0.00 -2.33 0.00 0.00 43.42 40.89 2k33 n LEU 82 CO 0.46 0.86 0.26 0.68 -1.33 0.00 0.00 177.39 178.32 2k33 s VAL 83 N -2.45 2.16 0.51 4.08 -7.23 -1.26 -5.05 120.40 111.17 2k33 s VAL 83 Ca -0.29 -1.10 0.03 0.00 -1.81 0.00 0.00 61.98 58.80 2k33 s VAL 83 Cb 0.08 -2.27 0.03 0.00 0.56 0.00 0.00 36.38 34.78 2k33 s VAL 83 CO 0.53 0.00 0.23 -0.46 -0.31 0.00 0.00 175.10 175.09 2k33 n ASN 84 N -2.09 2.96 -4.85 4.85 0.23 -1.26 -5.09 115.26 110.02 2k33 n ASN 84 Ca 0.11 -2.96 -0.35 0.00 -0.53 0.00 0.00 54.58 50.86 2k33 n ASN 84 Cb 0.62 0.12 -0.06 0.00 -2.08 0.00 0.00 39.78 38.38 2k33 n ASN 84 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 2k33 s ILE 85 N -2.68 4.85 0.00 1.53 1.01 -1.26 -4.04 121.20 120.60 2k33 s ILE 85 Ca 0.18 0.80 0.00 0.00 0.00 0.00 0.00 60.65 61.63 2k33 s ILE 85 Cb -0.01 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.74 2k33 s ILE 85 CO 0.11 0.17 0.00 0.61 0.00 0.00 0.00 174.94 175.84 2k33 n GLY 86 N 0.60 0.45 3.46 6.18 0.00 -0.97 -4.97 105.19 109.94 2k33 n GLY 86 Ca -0.04 -0.60 -0.32 0.00 0.00 0.00 0.00 46.02 45.05 2k33 n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k33 s ASP 87 N -2.55 3.90 0.45 1.61 -1.08 -1.26 -4.87 116.67 112.89 2k33 s ASP 87 Ca 0.00 -0.25 -0.24 0.00 -0.52 0.00 0.00 52.55 51.55 2k33 s ASP 87 Cb 0.00 -0.77 -0.07 0.00 -1.46 0.00 0.00 42.92 40.62 2k33 s ASP 87 CO 0.00 0.33 1.23 -0.47 0.52 0.00 0.00 175.17 176.79 2k33 s TYR 88 N -0.74 2.79 0.05 -5.34 6.14 -1.26 -2.34 117.35 116.64 2k33 s TYR 88 Ca 0.12 1.48 -0.19 0.00 0.64 0.00 0.00 57.07 59.12 2k33 s TYR 88 Cb -0.11 -3.52 0.04 0.00 0.42 0.00 0.00 41.96 38.79 2k33 s TYR 88 CO 0.01 -1.86 0.44 0.14 0.64 0.00 0.00 175.55 174.93 2k33 s VAL 89 N -1.42 0.05 0.54 3.14 -7.23 -0.45 -4.95 120.40 110.08 2k33 s VAL 89 Ca 0.62 -0.39 -0.09 0.00 -1.81 0.00 0.00 61.98 60.31 2k33 s VAL 89 Cb -0.33 -0.96 0.12 0.00 0.56 0.00 0.00 36.38 35.77 2k33 s VAL 89 CO 0.41 -0.22 0.73 -1.20 -0.31 0.00 0.00 175.10 174.51 2k33 n SER 90 N 0.46 0.06 0.00 4.85 7.64 -1.26 -2.17 113.62 123.19 2k33 n SER 90 Ca -0.18 -1.27 0.00 0.00 1.01 0.00 0.00 58.87 58.43 2k33 n SER 90 Cb 0.60 -0.56 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 2k33 n SER 90 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k33 n ALA 91 N -3.47 0.00 0.94 -0.43 0.00 -1.21 -4.13 120.51 112.21 2k33 n ALA 91 Ca -0.12 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.44 2k33 n ALA 91 Cb 0.32 0.00 0.28 0.00 0.00 0.00 0.00 19.45 20.05 2k33 n ALA 91 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2k33 n SER 92 N -0.49 2.55 0.02 0.00 2.88 -1.26 -3.08 113.62 114.23 2k33 n SER 92 Ca 0.00 -1.84 0.11 0.00 -1.33 0.00 0.00 58.87 55.81 2k33 n SER 92 Cb 0.00 -0.10 -0.04 0.00 -0.75 0.00 0.00 64.21 63.32 2k33 n SER 92 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2k33 n THR 93 N 0.94 0.12 -3.16 2.46 -1.04 -1.26 -4.84 114.28 107.49 2k33 n THR 93 Ca 0.17 -0.25 -0.42 0.00 -2.04 0.00 0.00 64.05 61.51 2k33 n THR 93 Cb 0.49 0.29 -0.07 0.00 -1.82 0.00 0.00 70.33 69.23 2k33 n THR 93 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 2k33 s THR 94 N -3.22 4.94 -0.45 12.58 -1.32 -1.25 -4.87 115.64 122.04 2k33 s THR 94 Ca 0.02 0.49 -0.13 0.00 -1.21 0.00 0.00 61.69 60.87 2k33 s THR 94 Cb 0.14 -4.04 0.08 0.00 -1.51 0.00 0.00 72.50 67.18 2k33 s THR 94 CO 0.83 -0.28 0.34 -1.83 -2.21 0.00 0.00 174.62 171.47 2k33 s GLU 95 N 2.59 2.80 -0.05 7.08 -1.05 -1.26 -4.63 118.70 124.18 2k33 s GLU 95 Ca 0.22 -1.43 -0.03 0.00 -0.15 0.00 0.00 54.97 53.58 2k33 s GLU 95 Cb -0.15 -3.98 -0.01 0.00 -0.44 0.00 0.00 34.13 29.55 2k33 s GLU 95 CO 0.14 -1.02 -0.06 1.28 0.95 0.00 0.00 175.26 176.56 2k33 n LEU 96 N 5.07 0.58 -4.24 1.83 7.99 -1.26 -4.58 117.00 122.39 2k33 n LEU 96 Ca -0.11 0.36 -0.14 0.00 -0.01 0.00 0.00 56.01 56.11 2k33 n LEU 96 Cb 0.43 -0.62 -0.10 0.00 -0.11 0.00 0.00 43.42 43.02 2k33 n LEU 96 CO 0.44 -0.49 -0.40 0.54 -1.51 0.00 0.00 177.39 175.97 2k33 s VAL 97 N -1.41 1.05 0.21 4.08 0.11 -1.26 0.08 120.40 123.26 2k33 s VAL 97 Ca -0.05 -2.03 0.11 0.00 -2.93 0.00 0.00 61.98 57.08 2k33 s VAL 97 Cb 0.01 -1.87 -0.05 0.00 -1.53 0.00 0.00 36.38 32.95 2k33 s VAL 97 CO 0.07 -0.73 -0.23 0.00 -3.33 0.00 0.00 175.10 170.89 2k33 s ARG 98 N -3.78 1.53 -0.01 1.54 1.70 -1.26 -0.74 118.95 117.93 2k33 s ARG 98 Ca 0.17 -1.57 -0.06 0.00 -0.47 0.00 0.00 55.73 53.81 2k33 s ARG 98 Cb 0.03 -1.80 -0.04 0.00 -0.57 0.00 0.00 34.95 32.57 2k33 s ARG 98 CO 0.00 0.38 0.23 0.54 -1.08 0.00 0.00 175.30 175.37 2k33 s VAL 99 N -1.85 5.36 0.26 4.99 0.11 0.19 -2.38 120.40 127.08 2k33 s VAL 99 Ca 0.22 0.08 0.01 0.00 -2.93 0.00 0.00 61.98 59.37 2k33 s VAL 99 Cb -0.07 -3.54 -0.05 0.00 -1.53 0.00 0.00 36.38 31.19 2k33 s VAL 99 CO 0.11 0.38 0.11 0.28 -3.33 0.00 0.00 175.10 172.65 2k33 s THR 100 N -1.27 0.49 0.00 5.04 -1.32 0.07 -0.05 115.64 118.60 2k33 s THR 100 Ca 0.26 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.74 2k33 s THR 100 Cb -0.13 -2.61 0.00 0.00 -1.51 0.00 0.00 72.50 68.25 2k33 s THR 100 CO 0.15 0.00 0.00 -3.20 -2.21 0.00 0.00 174.62 169.36 2k33 n ASN 101 N -0.54 -2.55 -0.80 8.08 5.15 -1.26 -2.26 115.26 121.08 2k33 n ASN 101 Ca 0.00 0.00 0.01 0.00 -0.60 0.00 0.00 54.58 53.99 2k33 n ASN 101 Cb 0.66 0.00 -0.00 0.00 -0.53 0.00 0.00 39.78 39.91 2k33 n ASN 101 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 2k33 n LEU 102 N 0.00 0.00 -4.70 1.20 7.94 -1.26 -4.87 117.00 115.31 2k33 n LEU 102 Ca 0.00 0.09 -0.28 0.00 -1.11 0.00 0.00 56.01 54.71 2k33 n LEU 102 Cb 0.00 -0.25 -0.07 0.00 0.53 0.00 0.00 43.42 43.63 2k33 n LEU 102 CO 0.00 -1.24 -0.31 0.20 -1.11 0.00 0.00 177.39 174.93 2k33 s ASN 103 N -4.15 5.01 1.21 1.96 0.01 -1.26 -5.13 114.94 112.60 2k33 s ASN 103 Ca 0.00 -0.25 -0.20 0.00 -0.71 0.00 0.00 52.86 51.70 2k33 s ASN 103 Cb 0.00 -1.17 0.29 0.00 0.41 0.00 0.00 41.25 40.78 2k33 s ASN 103 CO 0.00 0.12 1.11 -2.16 -1.51 0.00 0.00 177.10 174.66 2k33 s PRO 104 N -2.70 -1.32 -0.03 -0.60 0.04 -1.26 -5.09 135.00 124.04 2k33 s PRO 104 Ca 0.27 -0.10 -0.05 0.00 0.04 0.00 0.00 61.00 61.16 2k33 s PRO 104 Cb -0.10 -1.59 0.01 0.00 0.04 0.00 0.00 34.50 32.85 2k33 s PRO 104 CO 0.19 -3.77 0.12 0.42 0.04 0.00 0.00 177.00 174.00 2k33 s ILE 105 N -3.01 0.03 -0.04 0.56 -1.09 -1.26 -5.03 121.20 111.36 2k33 s ILE 105 Ca 0.71 -0.23 0.01 0.00 -2.23 0.00 0.00 60.65 58.92 2k33 s ILE 105 Cb -0.09 -0.25 0.04 0.00 -1.58 0.00 0.00 42.46 40.59 2k33 s ILE 105 CO 0.56 -0.13 0.75 0.00 -1.23 0.00 0.00 174.94 174.90 2k33 n TYR 106 N 2.54 -0.22 -3.63 3.97 4.11 -1.26 -5.14 117.16 117.53 2k33 n TYR 106 Ca -0.16 -0.46 -0.03 0.00 -0.00 0.00 0.00 57.90 57.25 2k33 n TYR 106 Cb 0.58 0.54 -0.03 0.00 -0.00 0.00 0.00 39.34 40.43 2k33 n TYR 106 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2k33 s ALA 107 N 0.01 -2.14 -0.90 -3.48 0.00 -1.26 -5.05 121.76 108.95 2k33 s ALA 107 Ca 0.01 1.85 -0.06 0.00 0.00 0.00 0.00 51.96 53.76 2k33 s ALA 107 Cb 0.05 -0.90 -0.01 0.00 0.00 0.00 0.00 23.12 22.26 2k33 s ALA 107 CO -0.01 -0.40 0.73 -3.47 0.00 0.00 0.00 175.76 172.60 2k33 n ASP 108 N 0.25 -6.39 0.00 0.00 2.03 -1.26 -5.01 116.55 106.17 2k33 n ASP 108 Ca 0.02 -0.59 0.00 0.00 0.52 0.00 0.00 54.79 54.74 2k33 n ASP 108 Cb 0.58 -3.99 0.00 0.00 -0.72 0.00 0.00 41.12 36.99 2k33 n ASP 108 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k33 n GLY 109 N -1.66 -0.17 0.13 0.27 0.00 -1.26 -4.86 105.19 97.64 2k33 n GLY 109 Ca -0.10 -0.20 -0.00 0.00 0.00 0.00 0.00 46.02 45.71 2k33 n GLY 109 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2k33 h SER 110 N 0.00 0.00 -1.56 1.61 0.87 -2.07 -3.45 113.55 108.95 2k33 h SER 110 Ca 0.00 0.00 -0.49 0.00 -1.23 0.00 0.00 61.79 60.07 2k33 h SER 110 Cb 0.00 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 61.93 2k33 h SER 110 CO 0.00 0.63 -0.39 -1.38 -0.53 0.00 0.00 176.83 175.16 2k33 s HIS 111 N -3.29 2.73 0.22 2.24 0.00 -1.26 -5.13 115.29 110.80 2k33 s HIS 111 Ca 0.00 -0.47 0.00 0.00 -3.00 0.00 0.00 55.06 51.59 2k33 s HIS 111 Cb 0.11 -2.12 -0.04 0.00 -4.00 0.00 0.00 32.58 26.53 2k33 s HIS 111 CO 0.75 -0.07 0.41 -1.01 -1.00 0.00 0.00 174.74 173.82 2k33 s HIS 112 N -2.46 3.48 0.41 0.38 0.09 -1.26 -4.76 115.29 111.17 2k33 s HIS 112 Ca 0.47 0.30 -0.27 0.00 -0.00 0.00 0.00 55.06 55.57 2k33 s HIS 112 Cb -0.03 -1.83 -0.10 0.00 -0.00 0.00 0.00 32.58 30.62 2k33 s HIS 112 CO 0.28 0.36 1.43 -3.38 -0.00 0.00 0.00 174.74 173.43 2k33 s HIS 113 N -1.93 2.58 -0.30 1.40 -3.43 -1.26 -5.01 115.29 107.34 2k33 s HIS 113 Ca 0.38 1.24 -0.14 0.00 -0.80 0.00 0.00 55.06 55.74 2k33 s HIS 113 Cb -0.11 -3.93 0.17 0.00 -1.43 0.00 0.00 32.58 27.28 2k33 s HIS 113 CO 0.30 -2.82 1.00 -1.58 -2.00 0.00 0.00 174.74 169.64 2k33 s HIS 114 N -1.17 -0.65 1.19 0.38 2.46 -1.26 -5.17 115.29 111.08 2k33 s HIS 114 Ca 0.56 1.02 -0.16 0.00 0.47 0.00 0.00 55.06 56.94 2k33 s HIS 114 Cb -0.44 0.35 0.23 0.00 -0.13 0.00 0.00 32.58 32.59 2k33 s HIS 114 CO 0.58 -0.33 0.58 -2.39 -2.47 0.00 0.00 174.74 170.72 2k33 n HIS 115 N 5.05 -1.70 -1.91 3.88 1.44 -1.26 -5.30 115.22 115.43 2k33 n HIS 115 Ca -0.08 -0.13 0.00 0.00 -2.01 0.00 0.00 57.72 55.50 2k33 n HIS 115 Cb 0.53 -1.58 0.00 0.00 0.12 0.00 0.00 29.99 29.05 2k33 n HIS 115 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11