#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dvi s ASP 1 N 0.00 7.19 -0.18 3.42 1.11 -1.26 -4.83 116.67 122.13 3dvi s ASP 1 Ca 0.00 1.63 -0.01 0.00 0.18 0.00 0.00 52.55 54.35 3dvi s ASP 1 Cb 0.00 -2.56 -0.01 0.00 1.07 0.00 0.00 42.92 41.43 3dvi s ASP 1 CO 0.00 -0.48 -0.11 -0.63 1.18 0.00 0.00 175.17 175.13 3dvi s ILE 2 N 2.00 2.99 -0.17 0.77 1.01 -1.26 -4.97 121.20 121.57 3dvi s ILE 2 Ca 0.51 -0.65 -0.07 0.00 0.00 0.00 0.00 60.65 60.44 3dvi s ILE 2 Cb -0.20 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.92 3dvi s ILE 2 CO 0.20 0.49 0.08 -1.10 0.00 0.00 0.00 174.94 174.61 3dvi s GLN 3 N 0.98 3.84 -0.16 2.79 1.11 -1.26 -4.60 119.66 122.36 3dvi s GLN 3 Ca -0.01 -0.28 -0.05 0.00 0.01 0.00 0.00 55.36 55.02 3dvi s GLN 3 Cb -0.15 -3.22 -0.03 0.00 -1.01 0.00 0.00 33.01 28.61 3dvi s GLN 3 CO -0.01 0.41 -0.00 -1.64 0.01 0.00 0.00 175.29 174.05 3dvi s MET 4 N 0.00 3.71 0.24 2.91 -1.94 -1.26 -1.07 119.30 121.89 3dvi s MET 4 Ca 0.07 -0.45 0.09 0.00 -1.71 0.00 0.00 55.69 53.69 3dvi s MET 4 Cb -0.12 -3.00 -0.04 0.00 2.01 0.00 0.00 34.83 33.68 3dvi s MET 4 CO 0.00 0.29 0.02 0.95 -0.01 0.00 0.00 175.02 176.28 3dvi s THR 5 N 0.25 3.65 -0.13 2.05 -4.23 -0.33 -4.34 115.64 112.56 3dvi s THR 5 Ca -0.00 -1.72 -0.11 0.00 -1.18 0.00 0.00 61.69 58.68 3dvi s THR 5 Cb -0.13 -2.92 0.04 0.00 1.34 0.00 0.00 72.50 70.82 3dvi s THR 5 CO 0.02 -0.30 0.34 -1.58 -0.54 0.00 0.00 174.62 172.56 3dvi s GLN 6 N -3.50 0.38 -0.02 3.99 0.74 -1.26 -1.14 119.66 118.84 3dvi s GLN 6 Ca 0.30 0.52 -0.10 0.00 0.05 0.00 0.00 55.36 56.13 3dvi s GLN 6 Cb -0.07 0.14 0.01 0.00 1.10 0.00 0.00 33.01 34.19 3dvi s GLN 6 CO 0.20 -0.07 0.22 -1.12 -0.55 0.00 0.00 175.29 173.97 3dvi s SER 7 N 0.43 -0.11 0.70 6.67 0.01 -0.30 -4.44 113.70 116.66 3dvi s SER 7 Ca -0.02 0.05 -0.08 0.00 1.31 0.00 0.00 55.95 57.21 3dvi s SER 7 Cb -0.04 0.31 0.04 0.00 0.21 0.00 0.00 66.02 66.54 3dvi s SER 7 CO -0.02 -0.33 1.03 -2.16 0.41 0.00 0.00 173.24 172.17 3dvi s PRO 8 N -1.01 2.46 0.31 12.44 0.04 -1.26 -0.70 135.00 147.27 3dvi s PRO 8 Ca -0.11 0.01 0.09 0.00 0.04 0.00 0.00 61.00 61.03 3dvi s PRO 8 Cb -0.05 -2.13 0.49 0.00 0.04 0.00 0.00 34.50 32.85 3dvi s PRO 8 CO 0.02 -1.13 1.70 0.77 0.04 0.00 0.00 177.00 178.40 3dvi h SER 9 N -0.59 0.12 -5.04 6.66 0.02 -1.79 -3.40 113.55 109.53 3dvi h SER 9 Ca -0.45 -0.05 -0.11 0.00 -0.84 0.00 0.00 61.79 60.34 3dvi h SER 9 Cb 1.29 -0.03 -0.18 0.00 0.14 0.00 0.00 62.40 63.62 3dvi h SER 9 CO 0.62 0.57 -0.33 -0.94 -1.14 0.00 0.00 176.83 175.62 3dvi s SER 10 N -6.89 -0.07 -0.06 3.07 1.04 -1.26 -1.34 113.70 108.19 3dvi s SER 10 Ca -0.03 -0.19 -0.13 0.00 0.48 0.00 0.00 55.95 56.08 3dvi s SER 10 Cb 0.13 0.31 0.03 0.00 0.10 0.00 0.00 66.02 66.59 3dvi s SER 10 CO 0.76 -0.53 0.30 -0.22 0.98 0.00 0.00 173.24 174.53 3dvi s LEU 11 N -1.84 0.86 -0.14 2.42 2.96 0.08 -4.89 118.68 118.13 3dvi s LEU 11 Ca -0.08 0.31 -0.01 0.00 -0.22 0.00 0.00 54.13 54.13 3dvi s LEU 11 Cb -0.03 1.16 0.04 0.00 0.50 0.00 0.00 46.19 47.86 3dvi s LEU 11 CO -0.01 -0.30 -0.04 -0.55 -1.32 0.00 0.00 176.35 174.13 3dvi s SER 12 N -0.68 2.49 0.36 3.68 0.15 -1.26 -1.02 113.70 117.41 3dvi s SER 12 Ca -0.08 -0.50 0.05 0.00 0.70 0.00 0.00 55.95 56.12 3dvi s SER 12 Cb -0.04 -0.79 -0.03 0.00 -1.71 0.00 0.00 66.02 63.45 3dvi s SER 12 CO 0.02 -0.18 0.20 0.00 1.20 0.00 0.00 173.24 174.48 3dvi s ALA 13 N 1.72 2.30 0.18 5.45 0.00 -0.32 -4.49 121.76 126.60 3dvi s ALA 13 Ca 0.02 -1.66 0.08 0.00 0.00 0.00 0.00 51.96 50.40 3dvi s ALA 13 Cb -0.14 1.13 -0.04 0.00 0.00 0.00 0.00 23.12 24.07 3dvi s ALA 13 CO -0.07 -0.51 -0.02 -1.12 0.00 0.00 0.00 175.76 174.04 3dvi s SER 14 N -3.46 4.65 0.27 0.00 0.01 -1.26 0.01 113.70 113.91 3dvi s SER 14 Ca 0.33 -0.45 -0.31 0.00 1.31 0.00 0.00 55.95 56.83 3dvi s SER 14 Cb 0.03 -0.94 -0.12 0.00 0.21 0.00 0.00 66.02 65.19 3dvi s SER 14 CO 0.20 0.08 1.52 0.52 0.41 0.00 0.00 173.24 175.98 3dvi n VAL 15 N -0.15 0.93 0.00 3.43 0.31 -1.26 -0.96 118.33 120.63 3dvi n VAL 15 Ca -0.10 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 3dvi n VAL 15 Cb 0.55 -1.75 0.00 0.00 -0.91 0.00 0.00 33.84 31.73 3dvi n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3dvi n GLY 16 N 2.25 2.96 3.78 2.92 0.00 0.57 -4.91 105.19 112.77 3dvi n GLY 16 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 3dvi n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3dvi s ASP 17 N -1.17 5.14 -0.14 1.61 1.01 -0.14 -3.95 116.67 119.04 3dvi s ASP 17 Ca 0.00 1.92 -0.13 0.00 0.71 0.00 0.00 52.55 55.05 3dvi s ASP 17 Cb 0.00 -2.54 -0.05 0.00 1.01 0.00 0.00 42.92 41.34 3dvi s ASP 17 CO 0.00 -1.60 0.28 -0.60 0.21 0.00 0.00 175.17 173.45 3dvi s ARG 18 N -4.27 4.11 -0.05 8.23 3.52 -1.26 -0.36 118.95 128.87 3dvi s ARG 18 Ca 0.65 0.08 0.05 0.00 -0.13 0.00 0.00 55.73 56.38 3dvi s ARG 18 Cb -0.19 -3.37 -0.02 0.00 -1.56 0.00 0.00 34.95 29.81 3dvi s ARG 18 CO 0.44 0.36 -0.19 0.08 -0.81 0.00 0.00 175.30 175.18 3dvi s VAL 19 N 0.09 2.59 -0.07 7.11 1.01 -0.06 -4.99 120.40 126.09 3dvi s VAL 19 Ca 0.17 -0.89 0.04 0.00 0.00 0.00 0.00 61.98 61.30 3dvi s VAL 19 Cb -0.13 -1.98 0.00 0.00 0.00 0.00 0.00 36.38 34.27 3dvi s VAL 19 CO 0.05 0.58 -0.19 -0.89 0.00 0.00 0.00 175.10 174.65 3dvi s THR 20 N -0.46 1.60 -0.01 3.92 2.01 -1.26 -1.24 115.64 120.20 3dvi s THR 20 Ca 0.05 -0.77 0.07 0.00 0.31 0.00 0.00 61.69 61.34 3dvi s THR 20 Cb -0.12 -1.39 -0.02 0.00 0.01 0.00 0.00 72.50 70.98 3dvi s THR 20 CO 0.01 0.46 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.56 3dvi s ILE 21 N 0.30 1.67 0.17 1.82 1.01 0.58 -4.68 121.20 122.07 3dvi s ILE 21 Ca -0.12 -0.91 0.11 0.00 0.00 0.00 0.00 60.65 59.73 3dvi s ILE 21 Cb -0.15 -1.39 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 3dvi s ILE 21 CO 0.05 0.47 -0.23 0.42 0.00 0.00 0.00 174.94 175.65 3dvi s THR 22 N -0.50 2.47 0.14 2.92 -4.23 0.12 -0.30 115.64 116.25 3dvi s THR 22 Ca 0.08 -1.90 0.08 0.00 -1.18 0.00 0.00 61.69 58.77 3dvi s THR 22 Cb -0.08 -2.17 -0.04 0.00 1.34 0.00 0.00 72.50 71.55 3dvi s THR 22 CO -0.01 -0.06 -0.18 0.00 -0.54 0.00 0.00 174.62 173.83 3dvi s GLN 24 N -2.53 0.93 0.13 0.00 0.74 -0.29 -1.11 119.66 117.54 3dvi s GLN 24 Ca 0.12 -0.15 -0.10 0.00 0.05 0.00 0.00 55.36 55.27 3dvi s GLN 24 Cb -0.07 -0.89 -0.06 0.00 1.10 0.00 0.00 33.01 33.09 3dvi s GLN 24 CO 0.05 -0.05 0.46 0.00 -0.55 0.00 0.00 175.29 175.20 3dvi s ALA 25 N 0.82 3.66 -1.12 1.58 0.00 0.40 -1.18 121.76 125.92 3dvi s ALA 25 Ca -0.12 -0.31 0.24 0.00 0.00 0.00 0.00 51.96 51.77 3dvi s ALA 25 Cb -0.14 -2.35 1.10 0.00 0.00 0.00 0.00 23.12 21.72 3dvi s ALA 25 CO 0.01 0.54 1.79 -1.13 0.00 0.00 0.00 175.76 176.97 3dvi n SER 26 N 0.58 0.00 -3.90 0.00 3.41 -0.23 -4.79 113.62 108.68 3dvi n SER 26 Ca -0.05 0.34 -0.09 0.00 -0.26 0.00 0.00 58.87 58.81 3dvi n SER 26 Cb 0.52 -0.44 -0.05 0.00 -0.26 0.00 0.00 64.21 63.98 3dvi n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dvi s GLN 27 N -2.88 1.49 0.11 4.33 -2.07 -1.26 -4.96 119.66 114.41 3dvi s GLN 27 Ca 0.15 -1.10 -0.31 0.00 -1.82 0.00 0.00 55.36 52.28 3dvi s GLN 27 Cb 0.16 0.49 -0.09 0.00 -1.09 0.00 0.00 33.01 32.49 3dvi s GLN 27 CO 0.42 -0.62 1.53 0.34 -1.32 0.00 0.00 175.29 175.64 3dvi s ASP 28 N -2.96 6.68 -0.12 12.60 -1.08 -1.26 -4.73 116.67 125.80 3dvi s ASP 28 Ca 0.17 2.45 0.17 0.00 -0.52 0.00 0.00 52.55 54.82 3dvi s ASP 28 Cb -0.01 -2.58 0.27 0.00 -1.46 0.00 0.00 42.92 39.14 3dvi s ASP 28 CO 0.04 -0.79 1.14 2.30 0.52 0.00 0.00 175.17 178.38 3dvi n ILE 29 N 4.25 1.71 -0.18 4.11 -5.35 0.12 -5.02 119.36 119.00 3dvi n ILE 29 Ca 0.14 -2.07 0.00 0.00 -0.27 0.00 0.00 62.75 60.54 3dvi n ILE 29 Cb 0.41 -0.16 0.00 0.00 -1.74 0.00 0.00 39.64 38.14 3dvi n ILE 29 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 3dvi n SER 30 N -1.29 0.00 -1.18 7.28 7.64 -1.25 -1.68 113.62 123.15 3dvi n SER 30 Ca 0.15 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 60.00 3dvi n SER 30 Cb 0.65 0.00 0.21 0.00 -1.01 0.00 0.00 64.21 64.06 3dvi n SER 30 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 3dvi n ASN 31 N 1.59 2.91 -4.15 6.43 6.94 -1.26 -0.45 115.26 127.26 3dvi n ASN 31 Ca 0.00 -3.58 -0.43 0.00 -0.02 0.00 0.00 54.58 50.55 3dvi n ASN 31 Cb 0.00 -0.63 0.00 0.00 -2.36 0.00 0.00 39.78 36.79 3dvi n ASN 31 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 3dvi n TYR 32 N -0.98 3.90 -3.76 -2.53 0.53 -0.68 -2.65 117.16 110.99 3dvi n TYR 32 Ca 0.32 -3.06 -0.13 0.00 -1.02 0.00 0.00 57.90 54.01 3dvi n TYR 32 Cb 1.05 -2.04 -0.13 0.00 -1.03 0.00 0.00 39.34 37.18 3dvi n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.02 0.00 0.00 176.86 174.67 3dvi s LEU 33 N 0.58 0.80 0.11 7.72 2.96 -1.26 -1.49 118.68 128.10 3dvi s LEU 33 Ca 0.41 0.38 0.08 0.00 -0.22 0.00 0.00 54.13 54.77 3dvi s LEU 33 Cb 0.04 0.53 -0.04 0.00 0.50 0.00 0.00 46.19 47.22 3dvi s LEU 33 CO 0.01 -0.13 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.14 3dvi s ILE 34 N 0.90 3.11 -0.14 6.68 1.01 0.13 -0.20 121.20 132.69 3dvi s ILE 34 Ca -0.07 -1.38 -0.00 0.00 0.00 0.00 0.00 60.65 59.20 3dvi s ILE 34 Cb -0.08 -2.44 -0.01 0.00 0.01 0.00 0.00 42.46 39.94 3dvi s ILE 34 CO -0.05 0.11 -0.13 0.26 0.00 0.00 0.00 174.94 175.13 3dvi s TRP 35 N -1.18 2.81 0.14 3.97 0.52 -0.51 -0.45 118.94 124.24 3dvi s TRP 35 Ca 0.20 -0.79 0.08 0.00 0.02 0.00 0.00 56.10 55.61 3dvi s TRP 35 Cb -0.11 -1.88 -0.04 0.00 -1.15 0.00 0.00 33.47 30.29 3dvi s TRP 35 CO 0.12 -0.32 -0.12 0.71 0.02 0.00 0.00 176.95 177.36 3dvi s TYR 36 N 0.58 2.64 -0.12 -1.98 2.02 0.72 -1.21 117.35 119.99 3dvi s TYR 36 Ca -0.08 -0.21 -0.03 0.00 -0.37 0.00 0.00 57.07 56.38 3dvi s TYR 36 Cb -0.16 -1.35 -0.03 0.00 -0.40 0.00 0.00 41.96 40.02 3dvi s TYR 36 CO 0.03 0.45 -0.03 -1.14 -1.57 0.00 0.00 175.55 173.29 3dvi s GLN 37 N -2.41 3.35 -0.09 -0.62 0.74 -0.07 -1.19 119.66 119.37 3dvi s GLN 37 Ca 0.22 -0.49 -0.00 0.00 0.05 0.00 0.00 55.36 55.14 3dvi s GLN 37 Cb -0.10 -2.84 0.02 0.00 1.10 0.00 0.00 33.01 31.19 3dvi s GLN 37 CO 0.13 0.43 -0.06 -1.14 -0.55 0.00 0.00 175.29 174.10 3dvi s GLN 38 N -0.16 1.29 0.18 1.67 0.74 0.69 0.01 119.66 124.08 3dvi s GLN 38 Ca 0.03 -0.19 -0.01 0.00 0.05 0.00 0.00 55.36 55.25 3dvi s GLN 38 Cb -0.13 -1.35 -0.04 0.00 1.10 0.00 0.00 33.01 32.59 3dvi s GLN 38 CO 0.02 -0.21 0.37 0.15 -0.55 0.00 0.00 175.29 175.07 3dvi s LYS 39 N 1.52 3.52 0.34 1.67 1.02 -1.26 -1.41 119.74 125.13 3dvi s LYS 39 Ca 0.00 -0.35 -0.29 0.00 0.02 0.00 0.00 55.97 55.36 3dvi s LYS 39 Cb -0.13 -2.86 -0.11 0.00 -0.52 0.00 0.00 37.83 34.20 3dvi s LYS 39 CO -0.05 0.43 1.56 -2.30 -0.92 0.00 0.00 175.35 174.07 3dvi n PRO 40 N -0.52 2.73 -0.98 -1.68 -0.02 -1.26 -1.47 135.00 131.79 3dvi n PRO 40 Ca -0.05 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 3dvi n PRO 40 Cb 0.53 -2.73 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 3dvi n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dvi n GLY 41 N 1.34 0.34 3.38 -1.23 0.00 -1.26 -5.02 105.19 102.74 3dvi n GLY 41 Ca 0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 3dvi n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dvi s LYS 42 N -0.75 1.42 0.72 1.61 -0.14 -0.54 -5.16 119.74 116.91 3dvi s LYS 42 Ca 0.00 -1.55 -0.12 0.00 -1.36 0.00 0.00 55.97 52.94 3dvi s LYS 42 Cb 0.00 -1.47 0.03 0.00 -1.68 0.00 0.00 37.83 34.71 3dvi s LYS 42 CO 0.00 0.29 1.08 0.00 -0.76 0.00 0.00 175.35 175.96 3dvi s ALA 43 N -2.31 2.45 0.30 5.17 0.00 -1.26 -4.56 121.76 121.55 3dvi s ALA 43 Ca 0.21 0.25 -0.30 0.00 0.00 0.00 0.00 51.96 52.13 3dvi s ALA 43 Cb -0.05 -3.25 -0.11 0.00 0.00 0.00 0.00 23.12 19.72 3dvi s ALA 43 CO 0.09 -1.47 1.53 -2.14 0.00 0.00 0.00 175.76 173.77 3dvi s PRO 44 N -4.79 4.16 -0.20 0.00 0.02 -1.26 -4.68 135.00 128.25 3dvi s PRO 44 Ca 0.61 2.51 -0.08 0.00 0.02 0.00 0.00 61.00 64.05 3dvi s PRO 44 Cb -0.16 -3.03 -0.04 0.00 0.02 0.00 0.00 34.50 31.28 3dvi s PRO 44 CO 0.53 -0.55 0.09 0.21 -0.33 0.00 0.00 177.00 176.94 3dvi s LYS 45 N -0.85 4.00 0.03 5.54 2.20 0.10 -4.95 119.74 125.81 3dvi s LYS 45 Ca 0.60 -0.32 -0.30 0.00 -0.36 0.00 0.00 55.97 55.58 3dvi s LYS 45 Cb -0.46 -3.32 -0.07 0.00 -1.51 0.00 0.00 37.83 32.48 3dvi s LYS 45 CO 0.50 0.20 1.53 -1.17 -0.36 0.00 0.00 175.35 176.05 3dvi s LEU 46 N 0.59 4.34 -0.15 5.43 2.96 -1.26 -0.89 118.68 129.70 3dvi s LEU 46 Ca 0.05 2.28 -0.04 0.00 -0.22 0.00 0.00 54.13 56.21 3dvi s LEU 46 Cb -0.13 -3.56 -0.08 0.00 0.50 0.00 0.00 46.19 42.93 3dvi s LEU 46 CO 0.01 -0.81 -0.16 0.18 -1.32 0.00 0.00 176.35 174.25 3dvi n LEU 47 N 5.58 1.96 -4.01 -0.68 4.32 -0.35 -4.91 117.00 118.90 3dvi n LEU 47 Ca 0.15 0.06 -0.19 0.00 -0.02 0.00 0.00 56.01 56.01 3dvi n LEU 47 Cb 0.42 -0.47 -0.15 0.00 -1.62 0.00 0.00 43.42 41.60 3dvi n LEU 47 CO 0.61 0.51 -0.43 -0.63 -1.22 0.00 0.00 177.39 176.23 3dvi s ILE 48 N -2.28 0.70 0.17 -0.08 -1.09 -1.05 -2.46 121.20 115.11 3dvi s ILE 48 Ca -0.20 -0.36 0.07 0.00 -2.23 0.00 0.00 60.65 57.93 3dvi s ILE 48 Cb 0.07 -0.60 -0.04 0.00 -1.58 0.00 0.00 42.46 40.30 3dvi s ILE 48 CO 0.29 0.20 -0.14 -0.72 -1.23 0.00 0.00 174.94 173.35 3dvi s TYR 49 N -0.10 1.59 -1.51 3.97 1.13 -0.20 -1.42 117.35 120.81 3dvi s TYR 49 Ca 0.02 -0.58 -0.04 0.00 -1.41 0.00 0.00 57.07 55.06 3dvi s TYR 49 Cb -0.05 -0.78 0.04 0.00 -1.10 0.00 0.00 41.96 40.08 3dvi s TYR 49 CO -0.00 0.26 0.39 -0.25 -2.51 0.00 0.00 175.55 173.44 3dvi n ASP 50 N -0.04 -0.60 0.00 -0.18 8.00 -0.89 -1.25 116.55 121.60 3dvi n ASP 50 Ca -0.11 -1.08 0.00 0.00 0.71 0.00 0.00 54.79 54.31 3dvi n ASP 50 Cb 0.59 -2.60 0.00 0.00 -0.02 0.00 0.00 41.12 39.09 3dvi n ASP 50 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dvi n ALA 51 N -4.43 0.00 -0.48 2.24 0.00 0.73 -4.12 120.51 114.44 3dvi n ALA 51 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.21 3dvi n ALA 51 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 3dvi n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3dvi n SER 52 N 1.28 0.10 -4.59 0.00 3.41 -1.18 -2.78 113.62 109.86 3dvi n SER 52 Ca 0.00 -0.62 -0.42 0.00 -0.26 0.00 0.00 58.87 57.57 3dvi n SER 52 Cb 0.00 0.07 -0.06 0.00 -0.26 0.00 0.00 64.21 63.96 3dvi n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3dvi s ASN 53 N -0.07 6.54 -0.24 4.04 -0.87 -0.38 -4.57 114.94 119.38 3dvi s ASN 53 Ca 0.00 0.39 -0.29 0.00 -1.57 0.00 0.00 52.86 51.39 3dvi s ASN 53 Cb 0.00 -2.37 0.01 0.00 -0.02 0.00 0.00 41.25 38.86 3dvi s ASN 53 CO 0.00 -0.63 1.13 -0.22 -2.57 0.00 0.00 177.10 174.81 3dvi s LEU 54 N 2.89 4.06 0.28 0.60 2.96 -1.26 -1.03 118.68 127.18 3dvi s LEU 54 Ca 0.29 1.36 -0.29 0.00 -0.22 0.00 0.00 54.13 55.27 3dvi s LEU 54 Cb -0.14 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 42.91 3dvi s LEU 54 CO 0.14 -0.78 1.35 -0.70 -1.32 0.00 0.00 176.35 175.04 3dvi s GLU 55 N 3.46 4.34 0.15 1.98 2.56 -1.03 -4.95 118.70 125.21 3dvi s GLU 55 Ca 0.48 2.21 -0.34 0.00 0.00 0.00 0.00 54.97 57.32 3dvi s GLU 55 Cb -0.16 -3.11 -0.15 0.00 2.00 0.00 0.00 34.13 32.71 3dvi s GLU 55 CO 0.12 -0.27 1.33 2.41 -0.56 0.00 0.00 175.26 178.29 3dvi n THR 56 N 1.64 0.45 0.00 -1.70 -1.04 -1.26 -1.70 114.28 110.66 3dvi n THR 56 Ca 0.03 -0.11 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 3dvi n THR 56 Cb 0.42 -1.04 0.00 0.00 -1.82 0.00 0.00 70.33 67.88 3dvi n THR 56 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3dvi n GLY 57 N 2.44 2.31 3.74 3.41 0.00 -1.26 -5.05 105.19 110.78 3dvi n GLY 57 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 3dvi n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dvi s VAL 58 N -2.31 4.94 0.49 1.61 1.01 -0.69 -5.02 120.40 120.43 3dvi s VAL 58 Ca 0.00 1.34 -0.23 0.00 0.00 0.00 0.00 61.98 63.09 3dvi s VAL 58 Cb 0.00 -3.98 -0.08 0.00 0.00 0.00 0.00 36.38 32.32 3dvi s VAL 58 CO 0.00 0.36 1.24 -2.65 0.00 0.00 0.00 175.10 174.05 3dvi n PRO 59 N 3.09 1.67 0.10 2.72 -0.02 -1.26 -4.87 135.00 136.43 3dvi n PRO 59 Ca -0.05 0.61 0.08 0.00 -2.02 0.00 0.00 63.50 62.12 3dvi n PRO 59 Cb 0.51 -2.40 0.40 0.00 -0.02 0.00 0.00 33.50 31.99 3dvi n PRO 59 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3dvi n SER 60 N -0.30 0.39 0.11 2.55 3.41 -1.26 -2.21 113.62 116.31 3dvi n SER 60 Ca 0.09 0.64 0.10 0.00 -0.26 0.00 0.00 58.87 59.44 3dvi n SER 60 Cb 0.42 -0.71 0.46 0.00 -0.26 0.00 0.00 64.21 64.12 3dvi n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3dvi n ARG 61 N -1.98 0.14 -3.62 4.33 1.85 -1.26 -4.64 116.66 111.48 3dvi n ARG 61 Ca 0.01 0.45 -0.37 0.00 -1.00 0.00 0.00 57.85 56.94 3dvi n ARG 61 Cb 0.11 -1.81 -0.06 0.00 -1.05 0.00 0.00 32.46 29.64 3dvi n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3dvi s PHE 62 N -3.30 3.63 0.18 2.89 0.40 -0.94 -0.62 117.98 120.21 3dvi s PHE 62 Ca 0.03 0.76 -0.12 0.00 -0.60 0.00 0.00 56.93 57.00 3dvi s PHE 62 Cb 0.08 -2.20 0.00 0.00 0.51 0.00 0.00 43.02 41.41 3dvi s PHE 62 CO 0.30 0.57 0.37 -1.54 0.70 0.00 0.00 175.22 175.63 3dvi s SER 63 N -0.69 -0.07 0.08 1.36 1.04 -0.54 -4.96 113.70 109.92 3dvi s SER 63 Ca 0.19 -0.73 -0.13 0.00 0.48 0.00 0.00 55.95 55.76 3dvi s SER 63 Cb -0.14 0.49 0.02 0.00 0.10 0.00 0.00 66.02 66.48 3dvi s SER 63 CO 0.08 -0.96 0.29 -0.83 0.98 0.00 0.00 173.24 172.81 3dvi s GLY 64 N -2.93 -0.10 0.21 7.32 0.00 -1.26 -0.63 107.32 109.92 3dvi s GLY 64 Ca 0.14 -0.20 -0.13 0.00 0.00 0.00 0.00 44.72 44.53 3dvi s GLY 64 CO -0.01 -0.42 0.45 -1.35 0.00 0.00 0.00 173.10 171.77 3dvi s SER 65 N -2.51 -0.11 0.00 1.64 1.04 -0.02 -4.15 113.70 109.59 3dvi s SER 65 Ca 0.00 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 55.67 3dvi s SER 65 Cb 0.02 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.68 3dvi s SER 65 CO -0.08 -1.05 0.00 0.61 0.98 0.00 0.00 173.24 173.70 3dvi n GLY 66 N -0.33 4.14 3.39 7.32 0.00 -1.26 -1.13 105.19 117.33 3dvi n GLY 66 Ca -0.06 -1.44 -0.09 0.00 0.00 0.00 0.00 46.02 44.43 3dvi n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dvi s SER 67 N 0.00 -0.64 0.00 1.61 0.15 -1.26 -4.67 113.70 108.89 3dvi s SER 67 Ca 0.00 1.11 0.00 0.00 0.70 0.00 0.00 55.95 57.76 3dvi s SER 67 Cb 0.00 1.05 0.00 0.00 -1.71 0.00 0.00 66.02 65.36 3dvi s SER 67 CO 0.00 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.84 3dvi n GLY 68 N 4.41 1.49 0.00 9.45 0.00 0.40 -4.66 105.19 116.28 3dvi n GLY 68 Ca -0.21 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.00 3dvi n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3dvi n THR 69 N 0.00 0.00 -4.37 2.61 -2.24 -1.26 -0.70 114.28 108.32 3dvi n THR 69 Ca 0.00 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.44 3dvi n THR 69 Cb 0.00 0.14 -0.14 0.00 -2.10 0.00 0.00 70.33 68.23 3dvi n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3dvi s ASP 70 N -1.63 4.19 0.08 3.42 1.01 -1.26 -0.45 116.67 122.02 3dvi s ASP 70 Ca 0.00 -0.34 0.06 0.00 0.71 0.00 0.00 52.55 52.99 3dvi s ASP 70 Cb 0.00 -1.68 -0.03 0.00 1.01 0.00 0.00 42.92 42.22 3dvi s ASP 70 CO 0.00 0.09 -0.17 -0.36 0.21 0.00 0.00 175.17 174.94 3dvi s PHE 71 N 0.81 1.48 -0.02 4.23 0.08 -0.26 -4.04 117.98 120.25 3dvi s PHE 71 Ca -0.03 -0.43 0.04 0.00 0.12 0.00 0.00 56.93 56.62 3dvi s PHE 71 Cb -0.15 -0.83 -0.01 0.00 -0.57 0.00 0.00 43.02 41.47 3dvi s PHE 71 CO 0.01 0.12 -0.12 0.99 -0.10 0.00 0.00 175.22 176.12 3dvi s THR 72 N -1.17 0.99 -0.07 0.64 2.01 -0.28 -1.41 115.64 116.35 3dvi s THR 72 Ca 0.02 -0.52 0.04 0.00 0.31 0.00 0.00 61.69 61.55 3dvi s THR 72 Cb -0.10 -0.84 -0.00 0.00 0.01 0.00 0.00 72.50 71.57 3dvi s THR 72 CO 0.03 0.29 -0.20 0.12 -0.69 0.00 0.00 174.62 174.17 3dvi s PHE 73 N -0.14 2.06 0.00 4.92 5.36 0.59 -0.84 117.98 129.93 3dvi s PHE 73 Ca 0.02 -0.70 0.04 0.00 -0.96 0.00 0.00 56.93 55.33 3dvi s PHE 73 Cb -0.06 -1.39 -0.01 0.00 -0.34 0.00 0.00 43.02 41.21 3dvi s PHE 73 CO 0.00 -0.27 -0.14 0.99 -1.46 0.00 0.00 175.22 174.35 3dvi s THR 74 N 0.18 1.08 -0.29 0.12 2.01 0.19 -0.31 115.64 118.62 3dvi s THR 74 Ca -0.10 -0.67 -0.00 0.00 0.31 0.00 0.00 61.69 61.23 3dvi s THR 74 Cb -0.15 -0.92 0.06 0.00 0.01 0.00 0.00 72.50 71.51 3dvi s THR 74 CO 0.05 0.23 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.56 3dvi s ILE 75 N -0.44 2.75 0.39 1.82 1.01 -0.37 -1.47 121.20 124.89 3dvi s ILE 75 Ca 0.04 -1.52 -0.18 0.00 0.00 0.00 0.00 60.65 58.99 3dvi s ILE 75 Cb -0.06 -2.62 -0.10 0.00 0.01 0.00 0.00 42.46 39.69 3dvi s ILE 75 CO -0.00 -0.13 0.87 -0.44 0.00 0.00 0.00 174.94 175.24 3dvi s SER 76 N 1.22 6.86 -1.05 3.58 0.01 0.21 -0.88 113.70 123.65 3dvi s SER 76 Ca -0.05 1.53 -0.20 0.00 1.31 0.00 0.00 55.95 58.53 3dvi s SER 76 Cb -0.20 -2.47 0.02 0.00 0.21 0.00 0.00 66.02 63.58 3dvi s SER 76 CO -0.03 -0.31 0.67 -0.24 0.41 0.00 0.00 173.24 173.74 3dvi n SER 77 N -0.58 -4.66 -4.56 2.44 2.88 -1.09 -4.77 113.62 103.28 3dvi n SER 77 Ca 0.06 -1.11 -0.49 0.00 -1.33 0.00 0.00 58.87 55.99 3dvi n SER 77 Cb 0.54 -1.99 -0.04 0.00 -0.75 0.00 0.00 64.21 61.96 3dvi n SER 77 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3dvi n LEU 78 N -4.00 1.23 -4.66 2.46 7.94 0.51 -4.50 117.00 115.98 3dvi n LEU 78 Ca -0.18 1.15 -0.24 0.00 -1.11 0.00 0.00 56.01 55.63 3dvi n LEU 78 Cb 0.61 -1.18 -0.07 0.00 0.53 0.00 0.00 43.42 43.31 3dvi n LEU 78 CO 0.69 -1.48 -0.32 -1.10 -1.11 0.00 0.00 177.39 174.07 3dvi s GLN 79 N -0.51 2.36 0.43 1.96 -1.52 -1.26 -0.32 119.66 120.79 3dvi s GLN 79 Ca 0.72 -1.32 0.16 0.00 -1.95 0.00 0.00 55.36 52.97 3dvi s GLN 79 Cb -0.87 -2.23 1.06 0.00 -0.22 0.00 0.00 33.01 30.75 3dvi s GLN 79 CO 0.54 0.39 1.91 -1.35 -0.25 0.00 0.00 175.29 176.52 3dvi h PRO 80 N 2.05 0.40 0.00 2.91 0.11 -1.99 0.10 132.00 135.58 3dvi h PRO 80 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3dvi h PRO 80 Cb 1.24 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3dvi h PRO 80 CO 0.60 0.26 0.00 -0.85 -0.21 0.00 0.00 178.00 177.80 3dvi n GLU 81 N -4.48 0.52 0.00 1.05 0.00 -1.26 -2.91 120.64 113.55 3dvi n GLU 81 Ca 0.15 0.03 0.15 0.00 0.00 0.00 0.00 57.16 57.50 3dvi n GLU 81 Cb 0.56 -1.50 0.79 0.00 0.00 0.00 0.00 31.44 31.30 3dvi n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3dvi n ASP 82 N -1.18 0.10 -4.69 -1.84 8.00 0.02 -4.84 116.55 112.12 3dvi n ASP 82 Ca 0.15 -0.51 -0.42 0.00 0.71 0.00 0.00 54.79 54.72 3dvi n ASP 82 Cb 0.16 -0.16 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 3dvi n ASP 82 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3dvi s ILE 83 N -2.36 3.21 0.00 0.53 1.01 -1.15 -4.87 121.20 117.57 3dvi s ILE 83 Ca 0.35 0.62 0.00 0.00 0.00 0.00 0.00 60.65 61.62 3dvi s ILE 83 Cb 0.21 -3.40 0.00 0.00 0.01 0.00 0.00 42.46 39.28 3dvi s ILE 83 CO 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 174.94 175.37 3dvi n ALA 84 N 5.66 0.00 -2.71 9.38 0.00 -1.14 -4.88 120.51 126.82 3dvi n ALA 84 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.25 3dvi n ALA 84 Cb 0.41 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.76 3dvi n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3dvi s THR 85 N -2.00 4.23 -0.07 0.00 2.01 -0.50 -0.73 115.64 118.58 3dvi s THR 85 Ca 0.00 -0.27 0.02 0.00 0.31 0.00 0.00 61.69 61.75 3dvi s THR 85 Cb 0.00 -2.79 -0.02 0.00 0.01 0.00 0.00 72.50 69.69 3dvi s THR 85 CO 0.00 0.58 -0.12 -0.31 -0.69 0.00 0.00 174.62 174.08 3dvi s TYR 86 N -0.66 2.78 -0.01 4.92 2.02 0.15 -0.23 117.35 126.33 3dvi s TYR 86 Ca 0.10 -0.22 0.03 0.00 -0.37 0.00 0.00 57.07 56.62 3dvi s TYR 86 Cb -0.12 -1.70 -0.01 0.00 -0.40 0.00 0.00 41.96 39.74 3dvi s TYR 86 CO 0.02 0.14 -0.10 0.71 -1.57 0.00 0.00 175.55 174.75 3dvi s TYR 87 N -0.51 0.90 0.26 2.71 2.02 -0.33 -1.08 117.35 121.32 3dvi s TYR 87 Ca 0.07 -0.18 -0.07 0.00 -0.37 0.00 0.00 57.07 56.51 3dvi s TYR 87 Cb -0.12 -0.60 -0.06 0.00 -0.40 0.00 0.00 41.96 40.78 3dvi s TYR 87 CO 0.02 -0.03 0.55 0.00 -1.57 0.00 0.00 175.55 174.51 3dvi s GLN 89 N -3.17 -0.01 0.06 0.00 0.74 0.40 -1.17 119.66 116.51 3dvi s GLN 89 Ca 0.46 0.18 -0.05 0.00 0.05 0.00 0.00 55.36 56.00 3dvi s GLN 89 Cb -0.11 -0.19 -0.05 0.00 1.10 0.00 0.00 33.01 33.76 3dvi s GLN 89 CO 0.26 -0.14 0.29 1.14 -0.55 0.00 0.00 175.29 176.29 3dvi s GLN 90 N 0.88 3.57 -0.17 1.67 1.03 -0.41 -0.69 119.66 125.54 3dvi s GLN 90 Ca -0.07 -0.15 0.22 0.00 0.04 0.00 0.00 55.36 55.40 3dvi s GLN 90 Cb -0.10 -3.00 0.45 0.00 0.03 0.00 0.00 33.01 30.38 3dvi s GLN 90 CO -0.03 0.59 1.16 2.48 -2.54 0.00 0.00 175.29 176.95 3dvi n TYR 91 N 0.66 0.52 -2.49 9.60 4.11 -0.55 -3.24 117.16 125.76 3dvi n TYR 91 Ca -0.07 -1.51 -0.36 0.00 -0.00 0.00 0.00 57.90 55.96 3dvi n TYR 91 Cb 0.52 -0.02 -0.03 0.00 -0.00 0.00 0.00 39.34 39.81 3dvi n TYR 91 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.86 175.28 3dvi s HIS 92 N -2.10 3.14 0.00 -3.48 2.46 -1.26 -4.81 115.29 109.24 3dvi s HIS 92 Ca 0.26 1.61 0.00 0.00 0.47 0.00 0.00 55.06 57.40 3dvi s HIS 92 Cb 0.34 -3.16 0.00 0.00 -0.13 0.00 0.00 32.58 29.63 3dvi s HIS 92 CO -0.09 -0.84 0.00 0.09 -2.47 0.00 0.00 174.74 171.44 3dvi n ASN 93 N -0.34 0.00 -4.78 9.88 3.02 -1.26 -4.73 115.26 117.06 3dvi n ASN 93 Ca 0.06 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.36 3dvi n ASN 93 Cb 0.50 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.61 3dvi n ASN 93 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3dvi s LEU 94 N 0.00 3.71 0.85 3.41 1.43 -1.26 -5.12 118.68 121.70 3dvi s LEU 94 Ca 0.00 -0.21 -0.15 0.00 -1.03 0.00 0.00 54.13 52.74 3dvi s LEU 94 Cb 0.00 -2.31 -0.04 0.00 0.03 0.00 0.00 46.19 43.88 3dvi s LEU 94 CO 0.00 0.05 0.19 -2.65 0.23 0.00 0.00 176.35 174.18 3dvi n PRO 95 N -0.46 -0.01 -2.32 1.29 -0.02 -1.26 -4.62 135.00 127.60 3dvi n PRO 95 Ca -0.08 0.03 -0.41 0.00 -2.02 0.00 0.00 63.50 61.01 3dvi n PRO 95 Cb 0.55 -1.64 -0.03 0.00 -0.02 0.00 0.00 33.50 32.36 3dvi n PRO 95 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 3dvi s PRO 96 N -2.86 4.44 -0.97 0.52 0.02 -1.26 -5.03 135.00 129.84 3dvi s PRO 96 Ca 0.57 1.93 -0.17 0.00 0.02 0.00 0.00 61.00 63.34 3dvi s PRO 96 Cb -0.27 -3.25 0.15 0.00 0.02 0.00 0.00 34.50 31.15 3dvi s PRO 96 CO 0.67 -0.20 1.14 0.71 -0.33 0.00 0.00 177.00 178.99 3dvi s TYR 97 N 0.30 3.30 0.47 6.54 4.12 -1.26 -4.73 117.35 126.07 3dvi s TYR 97 Ca 0.56 -1.63 -0.21 0.00 0.02 0.00 0.00 57.07 55.81 3dvi s TYR 97 Cb -0.34 -4.22 -0.09 0.00 -1.52 0.00 0.00 41.96 35.80 3dvi s TYR 97 CO 0.35 -1.40 1.04 0.95 0.02 0.00 0.00 175.55 176.51 3dvi s THR 98 N 2.08 3.79 0.03 -0.71 -4.23 -1.20 -4.58 115.64 110.82 3dvi s THR 98 Ca 0.33 1.16 0.00 0.00 -1.18 0.00 0.00 61.69 62.00 3dvi s THR 98 Cb -0.05 -3.50 -0.04 0.00 1.34 0.00 0.00 72.50 70.25 3dvi s THR 98 CO -0.08 -0.19 0.13 -0.36 -0.54 0.00 0.00 174.62 173.58 3dvi s PHE 99 N -1.92 3.36 0.68 3.99 0.08 -1.26 -1.28 117.98 121.63 3dvi s PHE 99 Ca 0.65 0.21 -0.14 0.00 0.12 0.00 0.00 56.93 57.77 3dvi s PHE 99 Cb -0.17 -1.73 0.01 0.00 -0.57 0.00 0.00 43.02 40.56 3dvi s PHE 99 CO 0.21 0.57 1.10 0.20 -0.10 0.00 0.00 175.22 177.20 3dvi s GLY 100 N -2.13 2.00 0.00 4.36 0.00 -0.32 -4.55 107.32 106.68 3dvi s GLY 100 Ca 0.28 0.43 0.11 0.00 0.00 0.00 0.00 44.72 45.54 3dvi s GLY 100 CO 0.20 0.78 1.35 -1.55 0.00 0.00 0.00 173.10 173.88 3dvi n PRO 101 N -2.71 0.00 0.00 2.90 -0.04 -1.26 -4.65 135.00 129.24 3dvi n PRO 101 Ca 0.10 0.31 0.00 0.00 -0.04 0.00 0.00 63.50 63.87 3dvi n PRO 101 Cb 0.52 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 3dvi n PRO 101 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dvi n GLY 102 N -0.38 2.48 2.84 0.55 0.00 -1.26 -5.03 105.19 104.39 3dvi n GLY 102 Ca 0.03 -1.88 -0.25 0.00 0.00 0.00 0.00 46.02 43.92 3dvi n GLY 102 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dvi s THR 103 N -2.77 0.72 -0.33 2.61 2.01 -0.24 -4.51 115.64 113.13 3dvi s THR 103 Ca 0.00 -0.10 -0.20 0.00 0.31 0.00 0.00 61.69 61.70 3dvi s THR 103 Cb 0.00 -0.81 -0.01 0.00 0.01 0.00 0.00 72.50 71.69 3dvi s THR 103 CO 0.00 0.31 0.59 -0.75 -0.69 0.00 0.00 174.62 174.08 3dvi s LYS 104 N 1.83 3.78 -0.20 4.92 2.20 -0.45 -0.67 119.74 131.14 3dvi s LYS 104 Ca 0.05 0.11 -0.07 0.00 -0.36 0.00 0.00 55.97 55.70 3dvi s LYS 104 Cb -0.12 -3.77 -0.04 0.00 -1.51 0.00 0.00 37.83 32.39 3dvi s LYS 104 CO -0.07 -0.62 0.05 -1.17 -0.36 0.00 0.00 175.35 173.18 3dvi s LEU 105 N 2.57 3.61 0.22 5.43 2.96 0.09 -0.74 118.68 132.82 3dvi s LEU 105 Ca 0.23 -0.05 0.09 0.00 -0.22 0.00 0.00 54.13 54.18 3dvi s LEU 105 Cb -0.15 -1.93 -0.05 0.00 0.50 0.00 0.00 46.19 44.57 3dvi s LEU 105 CO 0.13 0.10 -0.16 -1.83 -1.32 0.00 0.00 176.35 173.27 3dvi s GLU 106 N 0.81 1.41 -0.07 1.98 -1.05 -0.19 -2.87 118.70 118.73 3dvi s GLU 106 Ca 0.03 -1.63 -0.30 0.00 -0.15 0.00 0.00 54.97 52.92 3dvi s GLU 106 Cb -0.14 -1.28 -0.04 0.00 -0.44 0.00 0.00 34.13 32.24 3dvi s GLU 106 CO 0.02 0.22 1.33 0.42 0.95 0.00 0.00 175.26 178.20 3dvi s ILE 107 N -2.85 4.03 0.00 1.83 -1.09 -1.26 -1.18 121.20 120.69 3dvi s ILE 107 Ca 0.24 1.34 0.00 0.00 -2.23 0.00 0.00 60.65 60.00 3dvi s ILE 107 Cb -0.02 -3.86 0.00 0.00 -1.58 0.00 0.00 42.46 37.00 3dvi s ILE 107 CO 0.09 -0.05 0.00 1.17 -1.23 0.00 0.00 174.94 174.92