#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fvt n ALA 2 N 0.00 0.00 0.58 3.04 0.00 -1.26 -4.21 120.51 118.66 2fvt n ALA 2 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 2fvt n ALA 2 Cb 0.00 0.00 0.26 0.00 0.00 0.00 0.00 19.45 19.71 2fvt n ALA 2 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2fvt n GLN 3 N -0.40 2.27 0.00 0.00 6.02 -1.26 -3.48 117.38 120.53 2fvt n GLN 3 Ca 0.00 -1.92 0.09 0.00 -0.01 0.00 0.00 57.00 55.16 2fvt n GLN 3 Cb 0.00 -1.47 -0.02 0.00 1.02 0.00 0.00 30.24 29.77 2fvt n GLN 3 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2fvt n ARG 4 N 1.13 1.41 -3.36 -1.09 1.74 -1.26 -4.72 116.66 110.50 2fvt n ARG 4 Ca 0.18 -0.76 -0.46 0.00 -0.77 0.00 0.00 57.85 56.05 2fvt n ARG 4 Cb 0.52 -1.37 -0.02 0.00 -1.02 0.00 0.00 32.46 30.57 2fvt n ARG 4 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2fvt s SER 5 N -2.25 6.80 0.15 0.55 0.01 -1.23 -4.41 113.70 113.32 2fvt s SER 5 Ca 0.14 -2.97 0.00 0.00 1.31 0.00 0.00 55.95 54.44 2fvt s SER 5 Cb 0.15 -2.18 0.00 0.00 0.21 0.00 0.00 66.02 64.20 2fvt s SER 5 CO 0.52 -0.48 0.00 1.21 0.41 0.00 0.00 173.24 174.91 2fvt n GLU 6 N 3.57 0.00 -2.25 12.44 4.07 -1.26 -4.96 120.64 132.24 2fvt n GLU 6 Ca 0.16 0.00 -0.00 0.00 -0.06 0.00 0.00 57.16 57.26 2fvt n GLU 6 Cb 0.44 0.00 -0.00 0.00 -0.06 0.00 0.00 31.44 31.82 2fvt n GLU 6 CO 0.00 0.00 0.00 -0.89 -0.06 0.00 0.00 177.13 176.18 2fvt n ILE 7 N -2.78 -8.29 -0.83 6.31 5.41 -1.26 -4.89 119.36 113.03 2fvt n ILE 7 Ca 0.00 1.18 -0.14 0.00 1.00 0.00 0.00 62.75 64.78 2fvt n ILE 7 Cb 0.00 -5.81 0.03 0.00 -0.71 0.00 0.00 39.64 33.15 2fvt n ILE 7 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2fvt n PRO 8 N 0.46 1.70 -3.50 0.38 -0.04 -1.26 -4.86 135.00 127.87 2fvt n PRO 8 Ca -0.01 -1.37 -0.42 0.00 -0.04 0.00 0.00 63.50 61.66 2fvt n PRO 8 Cb 0.01 -1.54 -0.08 0.00 -0.04 0.00 0.00 33.50 31.86 2fvt n PRO 8 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2fvt s HIS 9 N -1.59 3.37 -0.11 0.54 2.46 -1.26 -5.06 115.29 113.64 2fvt s HIS 9 Ca 0.27 -1.65 -0.07 0.00 0.47 0.00 0.00 55.06 54.08 2fvt s HIS 9 Cb 0.21 -3.45 -0.04 0.00 -0.13 0.00 0.00 32.58 29.17 2fvt s HIS 9 CO -0.00 -0.96 0.16 -0.06 -2.47 0.00 0.00 174.74 171.41 2fvt s PHE 10 N 1.44 3.61 -0.02 3.88 0.08 -1.26 -5.06 117.98 120.64 2fvt s PHE 10 Ca 0.05 0.56 -0.18 0.00 0.12 0.00 0.00 56.93 57.48 2fvt s PHE 10 Cb -0.26 -1.96 -0.05 0.00 -0.57 0.00 0.00 43.02 40.17 2fvt s PHE 10 CO 0.01 0.73 0.50 -1.25 -0.10 0.00 0.00 175.22 175.11 2fvt s PRO 11 N -1.07 4.19 -0.25 0.24 0.04 -1.26 -3.46 135.00 133.43 2fvt s PRO 11 Ca 0.16 0.56 -0.14 0.00 0.04 0.00 0.00 61.00 61.62 2fvt s PRO 11 Cb -0.12 -3.32 0.02 0.00 0.04 0.00 0.00 34.50 31.12 2fvt s PRO 11 CO 0.05 0.44 0.29 -2.13 0.04 0.00 0.00 177.00 175.69 2fvt n ARG 12 N 2.57 -1.67 -3.98 4.56 0.63 -1.26 -4.99 116.66 112.53 2fvt n ARG 12 Ca -0.10 1.54 -0.31 0.00 -0.92 0.00 0.00 57.85 58.06 2fvt n ARG 12 Cb 0.51 -2.78 -0.15 0.00 0.45 0.00 0.00 32.46 30.49 2fvt n ARG 12 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2fvt s THR 13 N -1.49 1.87 -0.20 5.15 2.01 -1.26 -4.93 115.64 116.80 2fvt s THR 13 Ca 0.15 -1.67 0.17 0.00 0.31 0.00 0.00 61.69 60.65 2fvt s THR 13 Cb -0.02 -2.17 0.46 0.00 0.01 0.00 0.00 72.50 70.77 2fvt s THR 13 CO 0.52 -0.26 1.34 0.00 -0.69 0.00 0.00 174.62 175.53 2fvt n ALA 14 N 4.50 2.77 -3.76 7.40 0.00 -1.26 -4.95 120.51 125.21 2fvt n ALA 14 Ca -0.08 -2.32 -0.34 0.00 0.00 0.00 0.00 53.44 50.71 2fvt n ALA 14 Cb 0.43 -0.61 -0.15 0.00 0.00 0.00 0.00 19.45 19.12 2fvt n ALA 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fvt s ALA 15 N -2.73 2.64 -0.09 0.00 0.00 -1.26 -4.92 121.76 115.39 2fvt s ALA 15 Ca 0.38 -1.32 0.04 0.00 0.00 0.00 0.00 51.96 51.07 2fvt s ALA 15 Cb 0.31 -1.57 -0.00 0.00 0.00 0.00 0.00 23.12 21.87 2fvt s ALA 15 CO 0.08 -0.59 -0.24 0.42 0.00 0.00 0.00 175.76 175.43 2fvt s ILE 16 N 1.36 2.03 0.04 0.00 1.01 -1.26 -5.04 121.20 119.34 2fvt s ILE 16 Ca 0.03 -1.01 -0.11 0.00 0.00 0.00 0.00 60.65 59.56 2fvt s ILE 16 Cb -0.15 -1.75 0.01 0.00 0.01 0.00 0.00 42.46 40.58 2fvt s ILE 16 CO -0.06 0.56 0.24 -0.62 0.00 0.00 0.00 174.94 175.05 2fvt s ASP 17 N 0.28 -0.03 -0.27 3.58 -1.08 -1.26 -5.05 116.67 112.84 2fvt s ASP 17 Ca -0.17 -0.30 -0.02 0.00 -0.52 0.00 0.00 52.55 51.54 2fvt s ASP 17 Cb -0.17 0.32 0.01 0.00 -1.46 0.00 0.00 42.92 41.61 2fvt s ASP 17 CO 0.08 -0.59 0.04 0.00 0.52 0.00 0.00 175.17 175.22 2fvt n ALA 18 N 0.62 -3.41 -3.21 3.66 0.00 -1.26 -3.49 120.51 113.42 2fvt n ALA 18 Ca -0.19 0.76 -0.33 0.00 0.00 0.00 0.00 53.44 53.68 2fvt n ALA 18 Cb 0.59 -1.54 -0.15 0.00 0.00 0.00 0.00 19.45 18.35 2fvt n ALA 18 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2fvt s TYR 19 N -1.43 2.79 0.00 0.00 5.04 -1.26 -1.31 117.35 121.18 2fvt s TYR 19 Ca -0.04 -0.79 0.00 0.00 -2.44 0.00 0.00 57.07 53.79 2fvt s TYR 19 Cb 0.00 -1.86 0.00 0.00 0.35 0.00 0.00 41.96 40.45 2fvt s TYR 19 CO 0.73 -0.31 0.00 0.41 -1.34 0.00 0.00 175.55 175.04 2fvt n GLY 20 N 3.73 2.13 3.55 8.97 0.00 0.22 -4.99 105.19 118.81 2fvt n GLY 20 Ca -0.18 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 44.86 2fvt n GLY 20 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2fvt s LYS 21 N 0.00 2.57 0.00 1.61 2.47 -1.26 -1.63 119.74 123.50 2fvt s LYS 21 Ca 0.00 0.62 0.00 0.00 -1.56 0.00 0.00 55.97 55.03 2fvt s LYS 21 Cb 0.00 -4.45 0.00 0.00 -1.46 0.00 0.00 37.83 31.92 2fvt s LYS 21 CO 0.00 -2.83 0.00 0.41 0.16 0.00 0.00 175.35 173.09 2fvt n GLY 22 N 5.81 0.56 5.99 5.54 0.00 -1.26 -4.71 105.19 117.11 2fvt n GLY 22 Ca 0.23 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.57 2fvt n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fvt n GLY 23 N -2.73 1.81 3.07 -0.02 0.00 -0.64 -2.73 105.19 103.95 2fvt n GLY 23 Ca 0.00 -0.26 -0.32 0.00 0.00 0.00 0.00 46.02 45.44 2fvt n GLY 23 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2fvt s PHE 24 N 0.00 2.74 -0.64 1.61 0.08 -1.02 -0.61 117.98 120.15 2fvt s PHE 24 Ca 0.00 -1.74 -0.09 0.00 0.12 0.00 0.00 56.93 55.22 2fvt s PHE 24 Cb 0.00 -1.82 0.17 0.00 -0.57 0.00 0.00 43.02 40.80 2fvt s PHE 24 CO 0.00 -0.79 0.51 -0.47 -0.10 0.00 0.00 175.22 174.37 2fvt s TYR 25 N 1.29 3.52 -0.17 0.36 5.04 -0.43 0.04 117.35 127.01 2fvt s TYR 25 Ca 0.00 -2.19 -0.00 0.00 -2.44 0.00 0.00 57.07 52.44 2fvt s TYR 25 Cb -0.15 -3.50 0.04 0.00 0.35 0.00 0.00 41.96 38.69 2fvt s TYR 25 CO -0.10 -0.94 -0.06 -0.59 -1.34 0.00 0.00 175.55 172.52 2fvt s PHE 26 N 0.50 1.80 0.00 4.97 -0.71 -1.22 -4.20 117.98 119.12 2fvt s PHE 26 Ca 0.13 -1.15 0.00 0.00 -1.04 0.00 0.00 56.93 54.87 2fvt s PHE 26 Cb -0.19 -1.36 0.00 0.00 -1.21 0.00 0.00 43.02 40.26 2fvt s PHE 26 CO -0.04 -0.63 0.00 0.00 -1.34 0.00 0.00 175.22 173.21 2fvt n ALA 27 N 4.85 0.00 -0.25 1.99 0.00 -1.26 -3.96 120.51 121.88 2fvt n ALA 27 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2fvt n ALA 27 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 2fvt n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fvt n GLY 28 N 0.00 -0.82 3.46 0.00 0.00 -1.26 -5.03 105.19 101.54 2fvt n GLY 28 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2fvt n GLY 28 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2fvt s MET 29 N -1.31 1.55 -0.50 1.61 0.00 -1.25 -5.11 119.30 114.28 2fvt s MET 29 Ca 0.00 -1.48 -0.28 0.00 0.00 0.00 0.00 55.69 53.93 2fvt s MET 29 Cb 0.00 0.41 0.03 0.00 0.00 0.00 0.00 34.83 35.27 2fvt s MET 29 CO 0.00 -0.62 1.09 -1.12 0.00 0.00 0.00 175.02 174.38 2fvt s SER 30 N -3.11 6.54 -0.55 -1.18 0.01 -1.26 -3.42 113.70 110.73 2fvt s SER 30 Ca 0.29 0.24 -0.20 0.00 1.31 0.00 0.00 55.95 57.59 2fvt s SER 30 Cb 0.01 -2.52 0.07 0.00 0.21 0.00 0.00 66.02 63.79 2fvt s SER 30 CO 0.13 -1.26 0.72 -2.28 0.41 0.00 0.00 173.24 170.95 2fvt s HIS 31 N 4.39 2.97 -0.35 2.43 5.04 0.11 -4.84 115.29 125.03 2fvt s HIS 31 Ca 0.43 -0.57 -0.29 0.00 -1.54 0.00 0.00 55.06 53.10 2fvt s HIS 31 Cb -0.08 -3.79 0.01 0.00 0.04 0.00 0.00 32.58 28.77 2fvt s HIS 31 CO 0.28 -1.19 1.21 -1.14 -2.34 0.00 0.00 174.74 171.56 2fvt s GLN 32 N 2.95 3.89 0.00 2.88 -0.44 -1.10 -2.42 119.66 125.41 2fvt s GLN 32 Ca 0.17 1.02 0.00 0.00 -2.50 0.00 0.00 55.36 54.05 2fvt s GLN 32 Cb -0.19 -3.85 0.00 0.00 -1.64 0.00 0.00 33.01 27.32 2fvt s GLN 32 CO 0.11 -1.15 0.00 0.41 0.50 0.00 0.00 175.29 175.16 2fvt n GLY 33 N 4.36 0.64 3.83 2.59 0.00 -1.26 -5.05 105.19 110.30 2fvt n GLY 33 Ca 0.13 -1.86 -0.38 0.00 0.00 0.00 0.00 46.02 43.92 2fvt n GLY 33 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2fvt s SER 34 N -1.59 6.87 -0.14 1.61 0.15 -1.23 -2.30 113.70 117.06 2fvt s SER 34 Ca 0.00 1.04 0.00 0.00 0.70 0.00 0.00 55.95 57.70 2fvt s SER 34 Cb 0.00 -2.28 -0.01 0.00 -1.71 0.00 0.00 66.02 62.02 2fvt s SER 34 CO 0.00 0.29 -0.15 -0.76 1.20 0.00 0.00 173.24 173.82 2fvt s LEU 35 N -1.21 2.56 -0.63 3.45 1.43 0.20 -2.48 118.68 122.00 2fvt s LEU 35 Ca 0.27 -0.42 -0.14 0.00 -1.03 0.00 0.00 54.13 52.81 2fvt s LEU 35 Cb -0.17 -1.58 0.16 0.00 0.03 0.00 0.00 46.19 44.63 2fvt s LEU 35 CO 0.16 0.12 0.57 -0.22 0.23 0.00 0.00 176.35 177.20 2fvt s LEU 36 N 0.62 6.27 -0.89 1.79 0.20 -0.12 -1.05 118.68 125.50 2fvt s LEU 36 Ca -0.08 -2.17 -0.25 0.00 0.69 0.00 0.00 54.13 52.32 2fvt s LEU 36 Cb -0.16 -2.17 0.03 0.00 -0.43 0.00 0.00 46.19 43.47 2fvt s LEU 36 CO 0.03 -0.72 1.47 -0.36 -0.29 0.00 0.00 176.35 176.48 2fvt s PHE 37 N 1.00 2.33 0.64 5.38 0.40 0.91 -0.82 117.98 127.81 2fvt s PHE 37 Ca 0.09 -0.34 -0.12 0.00 -0.60 0.00 0.00 56.93 55.96 2fvt s PHE 37 Cb -0.22 -4.58 -0.02 0.00 0.51 0.00 0.00 43.02 38.71 2fvt s PHE 37 CO -0.02 -1.99 1.04 -0.51 0.70 0.00 0.00 175.22 174.45 2fvt s LEU 38 N 5.97 3.27 0.00 -0.37 1.43 -0.63 -0.77 118.68 127.58 2fvt s LEU 38 Ca 0.46 1.60 -0.01 0.00 -1.03 0.00 0.00 54.13 55.15 2fvt s LEU 38 Cb -0.04 -4.50 -0.05 0.00 0.03 0.00 0.00 46.19 41.63 2fvt s LEU 38 CO 0.01 -1.17 1.39 -2.65 0.23 0.00 0.00 176.35 174.16 2fvt n PRO 39 N -2.69 0.68 0.08 1.29 -0.02 -1.25 -3.15 135.00 129.95 2fvt n PRO 39 Ca 0.07 -0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 2fvt n PRO 39 Cb 0.54 -1.46 0.00 0.00 -0.02 0.00 0.00 33.50 32.55 2fvt n PRO 39 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2fvt n ASP 40 N 2.18 -1.50 -4.16 2.55 2.03 -1.26 -4.34 116.55 112.05 2fvt n ASP 40 Ca 0.09 0.45 -0.10 0.00 0.52 0.00 0.00 54.79 55.74 2fvt n ASP 40 Cb 0.32 1.62 -0.10 0.00 -0.72 0.00 0.00 41.12 42.25 2fvt n ASP 40 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2fvt s ALA 41 N -2.00 0.92 -0.29 -1.67 0.00 -1.19 -4.00 121.76 113.54 2fvt s ALA 41 Ca 0.00 -1.46 -0.19 0.00 0.00 0.00 0.00 51.96 50.30 2fvt s ALA 41 Cb 0.00 0.71 -0.01 0.00 0.00 0.00 0.00 23.12 23.81 2fvt s ALA 41 CO 0.00 -0.43 0.59 0.08 0.00 0.00 0.00 175.76 176.00 2fvt s VAL 42 N -3.94 4.99 0.49 0.00 1.01 -1.22 -1.60 120.40 120.12 2fvt s VAL 42 Ca 0.22 0.86 0.04 0.00 0.00 0.00 0.00 61.98 63.10 2fvt s VAL 42 Cb 0.07 -3.94 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 2fvt s VAL 42 CO 0.01 -0.06 0.16 0.26 0.00 0.00 0.00 175.10 175.46 2fvt s TRP 43 N 2.49 1.99 0.01 5.22 0.52 -0.00 -4.52 118.94 124.65 2fvt s TRP 43 Ca 0.24 -0.83 0.01 0.00 0.02 0.00 0.00 56.10 55.54 2fvt s TRP 43 Cb -0.15 -1.78 -0.04 0.00 -1.15 0.00 0.00 33.47 30.35 2fvt s TRP 43 CO 0.11 0.03 0.05 0.20 0.02 0.00 0.00 176.95 177.36 2fvt s GLY 44 N -3.99 1.97 -0.17 0.98 0.00 -1.26 -0.95 107.32 103.91 2fvt s GLY 44 Ca 0.23 -0.92 -0.02 0.00 0.00 0.00 0.00 44.72 44.00 2fvt s GLY 44 CO 0.13 -0.81 0.02 0.86 0.00 0.00 0.00 173.10 173.30 2fvt s TRP 45 N -1.19 1.02 -1.33 1.90 -0.00 -1.03 -4.69 118.94 113.61 2fvt s TRP 45 Ca 0.23 -0.74 -0.15 0.00 -0.00 0.00 0.00 56.10 55.45 2fvt s TRP 45 Cb -0.12 -1.01 0.09 0.00 -0.00 0.00 0.00 33.47 32.44 2fvt s TRP 45 CO 0.14 -0.55 1.86 -3.47 -0.00 0.00 0.00 176.95 174.93 2fvt n ASP 46 N 5.05 4.68 -3.49 5.86 -0.08 -1.26 -3.58 116.55 123.74 2fvt n ASP 46 Ca -0.09 -2.94 -0.29 0.00 -1.51 0.00 0.00 54.79 49.96 2fvt n ASP 46 Cb 0.48 -1.65 -0.12 0.00 2.34 0.00 0.00 41.12 42.17 2fvt n ASP 46 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2fvt s VAL 47 N 2.80 0.25 -0.33 5.18 1.01 -1.26 -4.99 120.40 123.06 2fvt s VAL 47 Ca 0.47 -1.75 0.22 0.00 0.00 0.00 0.00 61.98 60.93 2fvt s VAL 47 Cb 0.07 -1.19 0.16 0.00 0.00 0.00 0.00 36.38 35.41 2fvt s VAL 47 CO 0.00 -0.97 1.32 0.71 0.00 0.00 0.00 175.10 176.16 2fvt h THR 48 N 5.11 0.05 -3.40 3.92 1.35 -1.91 -3.39 112.91 114.64 2fvt h THR 48 Ca 0.04 -1.08 -0.65 0.00 -0.55 0.00 0.00 66.41 64.17 2fvt h THR 48 Cb 0.97 1.79 -0.36 0.00 -1.73 0.00 0.00 68.15 68.82 2fvt h THR 48 CO 0.29 0.03 -0.83 -0.54 -0.25 0.00 0.00 175.52 174.22 2fvt s LYS 49 N -3.26 2.46 0.61 4.72 1.02 -1.26 -4.34 119.74 119.69 2fvt s LYS 49 Ca 0.03 -0.97 0.32 0.00 0.02 0.00 0.00 55.97 55.37 2fvt s LYS 49 Cb 0.07 -2.59 1.84 0.00 -0.52 0.00 0.00 37.83 36.63 2fvt s LYS 49 CO 0.73 -0.38 2.18 -1.35 -0.92 0.00 0.00 175.35 175.61 2fvt h PRO 50 N 7.91 0.00 0.00 -1.68 0.11 -1.93 -1.60 132.00 134.80 2fvt h PRO 50 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2fvt h PRO 50 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2fvt h PRO 50 CO 0.53 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.25 2fvt h GLU 51 N 0.00 0.00 -0.64 1.05 5.08 -1.98 -2.32 114.58 115.76 2fvt h GLU 51 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2fvt h GLU 51 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2fvt h GLU 51 CO -0.00 0.00 0.00 0.94 -1.00 0.00 0.00 179.01 178.95 2fvt n GLN 52 N -2.62 3.48 -2.15 2.33 -0.06 -0.60 -4.90 117.38 112.85 2fvt n GLN 52 Ca 0.00 -2.53 -0.42 0.00 -2.00 0.00 0.00 57.00 52.05 2fvt n GLN 52 Cb 0.21 -1.85 -0.03 0.00 -4.06 0.00 0.00 30.24 24.51 2fvt n GLN 52 CO 0.00 0.00 0.00 0.42 -0.20 0.00 0.00 177.06 177.28 2fvt s ILE 53 N -1.86 3.69 0.22 1.69 1.01 -0.88 -4.81 121.20 120.27 2fvt s ILE 53 Ca 0.45 0.97 -0.11 0.00 0.00 0.00 0.00 60.65 61.96 2fvt s ILE 53 Cb 0.29 -3.62 -0.01 0.00 0.01 0.00 0.00 42.46 39.13 2fvt s ILE 53 CO 0.21 -0.05 0.40 -0.62 0.00 0.00 0.00 174.94 174.88 2fvt s ASP 54 N 2.47 -0.04 0.43 3.58 2.15 -1.26 -5.01 116.67 118.98 2fvt s ASP 54 Ca 0.67 -0.95 0.11 0.00 0.43 0.00 0.00 52.55 52.81 2fvt s ASP 54 Cb -0.31 0.53 0.96 0.00 -0.30 0.00 0.00 42.92 43.80 2fvt s ASP 54 CO 0.26 -1.05 2.02 0.03 -0.17 0.00 0.00 175.17 176.26 2fvt h ARG 55 N 2.36 0.45 -0.42 4.34 3.08 -1.95 0.21 114.38 122.46 2fvt h ARG 55 Ca -0.29 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.72 2fvt h ARG 55 Cb 1.25 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 31.18 2fvt h ARG 55 CO 0.40 0.30 0.19 -0.92 -1.07 0.00 0.00 179.97 178.87 2fvt h TYR 56 N 0.46 0.61 -0.00 3.04 3.20 -1.96 -0.89 116.97 121.43 2fvt h TYR 56 Ca 0.22 -0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.93 2fvt h TYR 56 Cb 0.28 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 2fvt h TYR 56 CO -0.00 0.51 -0.60 0.77 -1.64 0.00 0.00 178.16 177.20 2fvt h SER 57 N 0.53 0.01 -0.13 -2.11 0.02 -1.52 -2.84 113.55 107.50 2fvt h SER 57 Ca 0.14 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 2fvt h SER 57 Cb 0.14 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.68 2fvt h SER 57 CO -0.02 0.61 0.00 0.18 -1.14 0.00 0.00 176.83 176.46 2fvt n LEU 58 N -3.83 1.21 -0.06 5.07 4.77 0.63 -3.96 117.00 120.83 2fvt n LEU 58 Ca -0.01 -0.52 0.08 0.00 -0.03 0.00 0.00 56.01 55.53 2fvt n LEU 58 Cb 0.60 -0.09 0.45 0.00 -2.33 0.00 0.00 43.42 42.05 2fvt n LEU 58 CO 0.42 0.26 1.18 -0.61 -1.33 0.00 0.00 177.39 177.31 2fvt h GLN 59 N 1.57 0.50 0.00 3.23 4.15 -0.91 0.24 115.11 123.89 2fvt h GLN 59 Ca 0.00 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.39 2fvt h GLN 59 Cb 0.34 -0.11 -0.00 0.00 0.21 0.00 0.00 27.48 27.92 2fvt h GLN 59 CO 0.00 0.33 -0.02 -0.09 -1.93 0.00 0.00 178.83 177.12 2fvt h ARG 60 N 0.52 0.00 0.06 1.69 2.43 -1.81 -2.27 114.38 114.99 2fvt h ARG 60 Ca 0.23 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 59.09 2fvt h ARG 60 Cb 0.25 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 2fvt h ARG 60 CO -0.06 0.02 -1.70 0.28 -1.51 0.00 0.00 179.97 177.00 2fvt n VAL 61 N -3.13 1.65 -0.23 0.20 0.31 0.58 -4.19 118.33 113.52 2fvt n VAL 61 Ca 0.00 -0.35 0.09 0.00 -0.01 0.00 0.00 64.34 64.08 2fvt n VAL 61 Cb 0.29 -1.88 0.36 0.00 -0.91 0.00 0.00 33.84 31.71 2fvt n VAL 61 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2fvt h PHE 62 N -0.48 0.80 0.00 3.52 0.04 -0.73 -0.83 116.94 119.25 2fvt h PHE 62 Ca -0.41 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.36 2fvt h PHE 62 Cb 1.67 -0.26 -0.00 0.00 2.20 0.00 0.00 35.95 39.56 2fvt h PHE 62 CO 0.08 0.36 -0.09 0.22 -0.60 0.00 0.00 178.31 178.28 2fvt h ASP 63 N 0.74 0.00 -0.04 2.17 3.58 -1.58 -2.61 116.42 118.68 2fvt h ASP 63 Ca 0.38 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.81 2fvt h ASP 63 Cb 0.49 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.53 2fvt h ASP 63 CO -0.15 0.09 -0.43 0.59 -2.88 0.00 0.00 179.24 176.46 2fvt n ASN 64 N -3.85 1.83 0.16 2.28 3.02 -0.36 -4.77 115.26 113.57 2fvt n ASN 64 Ca -0.02 -3.85 0.08 0.00 -0.03 0.00 0.00 54.58 50.76 2fvt n ASN 64 Cb 0.19 -0.54 0.58 0.00 -0.61 0.00 0.00 39.78 39.40 2fvt n ASN 64 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2fvt h ALA 65 N 0.95 1.95 -0.36 5.41 0.00 -1.03 -0.42 119.26 125.76 2fvt h ALA 65 Ca 0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2fvt h ALA 65 Cb 1.07 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2fvt h ALA 65 CO 0.04 0.03 0.05 -0.97 0.00 0.00 0.00 179.25 178.40 2fvt h ASN 66 N 0.16 0.49 0.92 0.00 -0.73 -1.86 -2.79 115.58 111.78 2fvt h ASN 66 Ca 0.07 -0.08 -0.11 0.00 1.87 0.00 0.00 56.30 58.05 2fvt h ASN 66 Cb 0.07 -0.13 -0.02 0.00 0.27 0.00 0.00 38.32 38.51 2fvt h ASN 66 CO -0.01 0.52 -1.14 0.00 -0.37 0.00 0.00 177.43 176.43 2fvt h ALA 67 N 1.54 0.62 -2.31 1.57 0.00 -1.52 -3.43 119.26 115.74 2fvt h ALA 67 Ca 0.12 -0.52 -0.75 0.00 0.00 0.00 0.00 54.91 53.75 2fvt h ALA 67 Cb 0.26 0.15 -0.26 0.00 0.00 0.00 0.00 17.79 17.94 2fvt h ALA 67 CO 0.00 0.58 -0.25 0.42 0.00 0.00 0.00 179.25 180.01 2fvt s ILE 68 N -3.07 4.94 -0.16 0.00 1.01 -0.46 -4.21 121.20 119.25 2fvt s ILE 68 Ca -0.01 -1.68 -0.16 0.00 0.00 0.00 0.00 60.65 58.81 2fvt s ILE 68 Cb 0.09 -4.18 -0.12 0.00 0.01 0.00 0.00 42.46 38.25 2fvt s ILE 68 CO 0.79 -0.86 0.13 -0.78 0.00 0.00 0.00 174.94 174.22 2fvt h ASP 69 N 8.66 0.00 -3.63 3.58 1.82 -1.42 -3.41 116.42 122.02 2fvt h ASP 69 Ca -0.24 -0.34 -0.65 0.00 -0.39 0.00 0.00 57.03 55.41 2fvt h ASP 69 Cb 1.09 0.00 -0.23 0.00 0.68 0.00 0.00 39.33 40.87 2fvt h ASP 69 CO 0.96 1.06 -0.63 -0.89 -1.61 0.00 0.00 179.24 178.14 2fvt s THR 70 N -2.21 4.26 -0.35 2.25 2.01 -1.10 -1.06 115.64 119.44 2fvt s THR 70 Ca -0.19 -0.21 -0.04 0.00 0.31 0.00 0.00 61.69 61.56 2fvt s THR 70 Cb 0.03 -3.00 0.07 0.00 0.01 0.00 0.00 72.50 69.60 2fvt s THR 70 CO 0.41 0.33 0.10 -0.22 -0.69 0.00 0.00 174.62 174.55 2fvt s LEU 71 N 1.60 4.48 -0.21 4.42 2.96 -0.05 0.08 118.68 131.97 2fvt s LEU 71 Ca 0.06 -1.47 -0.15 0.00 -0.22 0.00 0.00 54.13 52.35 2fvt s LEU 71 Cb -0.15 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 2fvt s LEU 71 CO 0.03 -0.38 0.38 -0.63 -1.32 0.00 0.00 176.35 174.43 2fvt s ILE 72 N 1.27 5.21 -0.13 6.68 1.01 0.73 -0.40 121.20 135.57 2fvt s ILE 72 Ca 0.00 0.66 -0.01 0.00 0.00 0.00 0.00 60.65 61.30 2fvt s ILE 72 Cb -0.21 -3.71 -0.02 0.00 0.01 0.00 0.00 42.46 38.53 2fvt s ILE 72 CO -0.01 0.26 -0.11 -0.69 0.00 0.00 0.00 174.94 174.39 2fvt s VAL 73 N 1.31 3.26 -0.42 2.92 1.01 0.71 0.25 120.40 129.44 2fvt s VAL 73 Ca 0.18 -0.59 -0.04 0.00 0.00 0.00 0.00 61.98 61.53 2fvt s VAL 73 Cb -0.15 -2.38 0.11 0.00 0.00 0.00 0.00 36.38 33.96 2fvt s VAL 73 CO 0.08 0.52 0.23 -0.83 0.00 0.00 0.00 175.10 175.09 2fvt s GLY 74 N 0.31 1.99 0.08 4.51 0.00 0.15 -0.33 107.32 114.03 2fvt s GLY 74 Ca -0.09 -2.49 -0.15 0.00 0.00 0.00 0.00 44.72 41.99 2fvt s GLY 74 CO 0.05 1.03 1.34 -0.91 0.00 0.00 0.00 173.10 174.61 2fvt h THR 75 N 6.31 1.32 0.00 0.90 1.35 -1.17 -0.72 112.91 120.89 2fvt h THR 75 Ca -0.15 -1.65 0.00 0.00 -0.55 0.00 0.00 66.41 64.06 2fvt h THR 75 Cb 1.05 1.83 0.00 0.00 -1.73 0.00 0.00 68.15 69.31 2fvt h THR 75 CO 0.73 0.52 0.00 0.61 -0.25 0.00 0.00 175.52 177.12 2fvt n GLY 76 N 0.41 2.47 0.12 5.82 0.00 -1.26 -4.65 105.19 108.10 2fvt n GLY 76 Ca -0.06 -0.51 -0.05 0.00 0.00 0.00 0.00 46.02 45.40 2fvt n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fvt h ALA 77 N 0.00 -1.02 -2.85 4.61 0.00 -1.92 -3.42 119.26 114.66 2fvt h ALA 77 Ca 0.00 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 2fvt h ALA 77 Cb 0.00 0.12 -0.09 0.00 0.00 0.00 0.00 17.79 17.82 2fvt h ALA 77 CO 0.00 -1.00 -0.15 0.16 0.00 0.00 0.00 179.25 178.26 2fvt s ASP 78 N -2.54 0.17 -0.85 0.00 1.47 -1.26 -5.08 116.67 108.58 2fvt s ASP 78 Ca -0.04 -1.10 -0.25 0.00 1.18 0.00 0.00 52.55 52.33 2fvt s ASP 78 Cb 0.00 0.61 -0.01 0.00 -0.34 0.00 0.00 42.92 43.18 2fvt s ASP 78 CO 0.13 -1.19 1.71 -0.69 0.68 0.00 0.00 175.17 175.82 2fvt s VAL 79 N -3.70 3.59 -0.40 2.11 1.01 -1.26 -4.74 120.40 117.01 2fvt s VAL 79 Ca 0.25 -0.25 -0.23 0.00 0.00 0.00 0.00 61.98 61.75 2fvt s VAL 79 Cb -0.00 -4.38 0.02 0.00 0.00 0.00 0.00 36.38 32.01 2fvt s VAL 79 CO 0.12 -1.32 0.77 0.86 0.00 0.00 0.00 175.10 175.54 2fvt s TRP 80 N 7.99 3.06 -0.33 5.22 -0.00 -1.26 -5.02 118.94 128.60 2fvt s TRP 80 Ca 0.59 0.36 -0.18 0.00 -0.00 0.00 0.00 56.10 56.86 2fvt s TRP 80 Cb -0.06 -3.50 -0.01 0.00 -0.00 0.00 0.00 33.47 29.90 2fvt s TRP 80 CO 0.03 -0.84 0.53 0.42 -0.00 0.00 0.00 176.95 177.09 2fvt s ILE 81 N 3.16 5.01 0.57 5.86 1.01 -1.26 -4.92 121.20 130.63 2fvt s ILE 81 Ca 0.30 0.51 -0.20 0.00 0.00 0.00 0.00 60.65 61.26 2fvt s ILE 81 Cb -0.13 -3.94 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 2fvt s ILE 81 CO 0.19 -0.15 1.24 0.00 0.00 0.00 0.00 174.94 176.23 2fvt s ALA 82 N 2.41 2.64 0.69 9.38 0.00 -1.26 -4.97 121.76 130.65 2fvt s ALA 82 Ca 0.20 1.10 -0.17 0.00 0.00 0.00 0.00 51.96 53.09 2fvt s ALA 82 Cb -0.15 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 19.47 2fvt s ALA 82 CO 0.12 -1.19 0.87 -2.30 0.00 0.00 0.00 175.76 173.27 2fvt n PRO 83 N -1.35 0.55 -0.28 0.00 -0.02 -1.26 -4.73 135.00 127.90 2fvt n PRO 83 Ca 0.12 0.24 -0.05 0.00 -2.02 0.00 0.00 63.50 61.79 2fvt n PRO 83 Cb 0.48 -2.12 0.06 0.00 -0.02 0.00 0.00 33.50 31.90 2fvt n PRO 83 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 2fvt h ARG 84 N -0.10 1.07 -0.65 -0.52 2.43 -1.98 -1.42 114.38 113.20 2fvt h ARG 84 Ca -0.47 -0.12 0.12 0.00 -0.81 0.00 0.00 59.98 58.70 2fvt h ARG 84 Cb 1.35 -0.21 -0.09 0.00 -0.42 0.00 0.00 29.97 30.60 2fvt h ARG 84 CO 0.47 0.79 0.20 1.96 -1.51 0.00 0.00 179.97 181.87 2fvt h GLN 85 N 1.06 0.33 -0.05 0.20 7.50 -1.98 0.64 115.11 122.82 2fvt h GLN 85 Ca 0.27 -0.02 -0.07 0.00 0.50 0.00 0.00 58.65 59.34 2fvt h GLN 85 Cb 0.02 -0.07 0.00 0.00 0.05 0.00 0.00 27.48 27.48 2fvt h GLN 85 CO -0.04 0.22 -0.22 1.25 -1.50 0.00 0.00 178.83 178.53 2fvt h LEU 86 N 0.34 0.29 -0.61 1.46 5.85 -1.83 -2.32 115.31 118.49 2fvt h LEU 86 Ca 0.35 -0.65 -0.11 0.00 0.84 0.00 0.00 57.88 58.31 2fvt h LEU 86 Cb 0.51 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 2fvt h LEU 86 CO -0.39 0.88 -0.09 -0.09 -0.34 0.00 0.00 178.44 178.41 2fvt h ARG 87 N -0.29 1.00 -0.02 1.25 2.43 -0.74 -2.60 114.38 115.40 2fvt h ARG 87 Ca -0.01 -0.36 -0.13 0.00 -0.81 0.00 0.00 59.98 58.67 2fvt h ARG 87 Cb 0.87 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.34 2fvt h ARG 87 CO 0.05 1.04 -0.59 1.49 -1.51 0.00 0.00 179.97 180.44 2fvt h GLU 88 N 0.90 0.08 -0.69 0.20 4.81 0.20 -2.15 114.58 117.93 2fvt h GLU 88 Ca 0.14 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 2fvt h GLU 88 Cb 0.65 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.01 2fvt h GLU 88 CO 0.04 0.65 0.29 0.00 -0.73 0.00 0.00 179.01 179.27 2fvt h ALA 89 N 1.33 0.89 -0.14 2.92 0.00 -1.13 0.41 119.26 123.55 2fvt h ALA 89 Ca -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2fvt h ALA 89 Cb 1.07 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2fvt h ALA 89 CO 0.08 0.50 0.05 -0.07 0.00 0.00 0.00 179.25 179.81 2fvt h LEU 90 N 0.97 0.20 -0.78 0.00 3.38 -1.20 -2.88 115.31 115.00 2fvt h LEU 90 Ca 0.23 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2fvt h LEU 90 Cb 0.18 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2fvt h LEU 90 CO -0.02 0.32 -0.07 -0.09 0.09 0.00 0.00 178.44 178.67 2fvt h ARG 91 N 0.07 0.00 0.00 1.13 2.43 -1.13 -0.95 114.38 115.93 2fvt h ARG 91 Ca 0.05 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 2fvt h ARG 91 Cb 0.19 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.73 2fvt h ARG 91 CO -0.00 0.07 -0.13 0.78 -1.51 0.00 0.00 179.97 179.18 2fvt h GLY 92 N 2.86 0.00 0.00 2.80 0.00 0.02 -3.34 103.07 105.41 2fvt h GLY 92 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2fvt h GLY 92 CO 0.01 0.00 0.00 -0.62 0.00 0.00 0.00 176.54 175.93 2fvt n VAL 93 N -3.38 0.00 -1.29 4.60 0.31 -0.86 -5.01 118.33 112.71 2fvt n VAL 93 Ca -0.01 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.32 2fvt n VAL 93 Cb 0.32 -0.32 -0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2fvt n VAL 93 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2fvt n ASN 94 N -0.82 -0.04 -4.31 4.52 4.05 -0.99 -5.13 115.26 112.54 2fvt n ASN 94 Ca 0.00 -0.27 -0.36 0.00 0.45 0.00 0.00 54.58 54.40 2fvt n ASN 94 Cb 0.00 0.01 -0.13 0.00 1.23 0.00 0.00 39.78 40.89 2fvt n ASN 94 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2fvt s VAL 95 N 0.00 3.63 -0.45 3.44 1.01 -0.42 -4.56 120.40 123.04 2fvt s VAL 95 Ca 0.00 -0.69 -0.24 0.00 0.00 0.00 0.00 61.98 61.05 2fvt s VAL 95 Cb 0.00 -2.81 0.02 0.00 0.00 0.00 0.00 36.38 33.59 2fvt s VAL 95 CO 0.00 0.19 0.84 -0.69 0.00 0.00 0.00 175.10 175.44 2fvt s VAL 96 N 1.46 4.59 -0.52 2.92 1.01 -0.22 -2.59 120.40 127.05 2fvt s VAL 96 Ca 0.03 0.58 -0.25 0.00 0.00 0.00 0.00 61.98 62.35 2fvt s VAL 96 Cb -0.16 -4.35 0.04 0.00 0.00 0.00 0.00 36.38 31.90 2fvt s VAL 96 CO -0.00 -0.74 0.94 -0.22 0.00 0.00 0.00 175.10 175.08 2fvt s LEU 97 N 3.45 4.04 -0.44 3.92 2.96 -1.26 -0.87 118.68 130.49 2fvt s LEU 97 Ca 0.33 -0.18 -0.07 0.00 -0.22 0.00 0.00 54.13 53.98 2fvt s LEU 97 Cb -0.11 -2.96 0.11 0.00 0.50 0.00 0.00 46.19 43.72 2fvt s LEU 97 CO 0.24 -1.18 0.28 -0.62 -1.32 0.00 0.00 176.35 173.75 2fvt s ASP 98 N 2.65 5.54 -0.28 3.68 2.15 0.47 -5.01 116.67 125.88 2fvt s ASP 98 Ca 0.33 -1.83 -0.10 0.00 0.43 0.00 0.00 52.55 51.38 2fvt s ASP 98 Cb -0.12 -1.95 -0.04 0.00 -0.30 0.00 0.00 42.92 40.52 2fvt s ASP 98 CO 0.22 -0.60 0.15 -0.89 -0.17 0.00 0.00 175.17 173.87 2fvt s THR 99 N 1.31 4.90 0.08 1.71 2.01 -1.26 -0.21 115.64 124.19 2fvt s THR 99 Ca 0.05 -0.03 0.02 0.00 0.31 0.00 0.00 61.69 62.04 2fvt s THR 99 Cb -0.24 -3.35 -0.01 0.00 0.01 0.00 0.00 72.50 68.91 2fvt s THR 99 CO -0.01 0.24 0.07 0.23 -0.69 0.00 0.00 174.62 174.46 2fvt n MET 100 N 5.01 0.19 -2.03 4.92 2.81 0.55 -4.90 117.12 123.67 2fvt n MET 100 Ca -0.15 -0.82 -0.30 0.00 -1.81 0.00 0.00 57.70 54.63 2fvt n MET 100 Cb 0.51 0.64 0.01 0.00 -0.71 0.00 0.00 33.22 33.68 2fvt n MET 100 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2fvt s GLN 101 N -2.34 3.50 0.28 0.03 -0.21 -1.26 -0.71 119.66 118.95 2fvt s GLN 101 Ca 0.09 0.60 -0.01 0.00 0.02 0.00 0.00 55.36 56.05 2fvt s GLN 101 Cb 0.00 -2.14 0.44 0.00 1.00 0.00 0.00 33.01 32.32 2fvt s GLN 101 CO 0.07 -0.55 1.90 1.15 -2.12 0.00 0.00 175.29 175.73 2fvt h THR 102 N -0.25 1.10 0.03 -0.19 2.02 -1.81 -1.40 112.91 112.42 2fvt h THR 102 Ca -0.45 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 66.34 2fvt h THR 102 Cb 1.20 -0.14 -0.00 0.00 -1.74 0.00 0.00 68.15 67.46 2fvt h THR 102 CO 0.62 0.21 -0.05 1.23 0.37 0.00 0.00 175.52 177.90 2fvt h GLY 103 N 1.14 -0.96 1.35 2.16 0.00 -1.93 0.19 103.07 105.02 2fvt h GLY 103 Ca 0.41 0.42 0.06 0.00 0.00 0.00 0.00 47.33 48.22 2fvt h GLY 103 CO -0.15 -0.35 0.29 -0.56 0.00 0.00 0.00 176.54 175.76 2fvt h PRO 104 N -0.09 0.30 -0.10 4.80 0.13 -1.95 -2.07 132.00 133.02 2fvt h PRO 104 Ca -0.00 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2fvt h PRO 104 Cb 0.08 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 31.14 2fvt h PRO 104 CO -0.02 0.20 0.05 0.00 -0.23 0.00 0.00 178.00 178.00 2fvt h ALA 105 N 1.77 0.13 -0.22 -0.56 0.00 -0.95 0.19 119.26 119.62 2fvt h ALA 105 Ca 0.19 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.05 2fvt h ALA 105 Cb 0.36 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2fvt h ALA 105 CO -0.04 -0.30 0.06 0.82 0.00 0.00 0.00 179.25 179.79 2fvt h ILE 106 N 0.03 0.93 -0.07 0.00 2.04 -0.13 -0.22 117.51 120.09 2fvt h ILE 106 Ca 0.03 -0.05 0.03 0.00 1.00 0.00 0.00 64.86 65.87 2fvt h ILE 106 Cb 0.13 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 2fvt h ILE 106 CO -0.00 0.03 -0.10 -0.09 0.00 0.00 0.00 178.15 177.99 2fvt h ARG 107 N 0.16 -0.13 -0.34 2.37 2.43 -1.22 0.36 114.38 118.01 2fvt h ARG 107 Ca 0.10 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 2fvt h ARG 107 Cb 0.08 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 2fvt h ARG 107 CO -0.11 -0.09 0.18 1.15 -1.51 0.00 0.00 179.97 179.59 2fvt h THR 108 N -0.14 1.15 -0.24 0.20 2.02 -0.76 -2.41 112.91 112.73 2fvt h THR 108 Ca 0.06 -0.41 -0.05 0.00 0.77 0.00 0.00 66.41 66.79 2fvt h THR 108 Cb 0.22 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 2fvt h THR 108 CO -0.15 0.15 -0.03 0.22 0.37 0.00 0.00 175.52 176.08 2fvt h TYR 109 N 0.42 0.50 -0.33 3.16 3.20 -0.80 -0.32 116.97 122.81 2fvt h TYR 109 Ca 0.12 -0.10 0.06 0.00 3.14 0.00 0.00 58.73 61.95 2fvt h TYR 109 Cb 0.09 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.21 2fvt h TYR 109 CO -0.02 0.66 0.22 -0.97 -1.64 0.00 0.00 178.16 176.41 2fvt h ASN 110 N 0.21 0.17 0.00 -2.11 -1.24 -0.16 0.11 115.58 112.55 2fvt h ASN 110 Ca 0.06 -0.00 -0.07 0.00 0.71 0.00 0.00 56.30 57.01 2fvt h ASN 110 Cb 0.48 -0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.48 2fvt h ASN 110 CO 0.02 0.11 -0.43 0.40 -1.29 0.00 0.00 177.43 176.24 2fvt h ILE 111 N 0.19 0.99 0.00 2.57 2.04 -1.31 -3.38 117.51 118.61 2fvt h ILE 111 Ca 0.15 -1.88 0.00 0.00 1.00 0.00 0.00 64.86 64.12 2fvt h ILE 111 Cb 0.34 2.01 0.00 0.00 -0.74 0.00 0.00 36.82 38.43 2fvt h ILE 111 CO -0.02 0.33 0.00 -0.03 0.00 0.00 0.00 178.15 178.43 2fvt h MET 112 N -1.00 0.00 0.00 2.37 4.05 -0.69 0.14 114.93 119.79 2fvt h MET 112 Ca -0.10 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.32 2fvt h MET 112 Cb 0.84 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.64 2fvt h MET 112 CO -0.06 0.00 0.00 0.97 0.23 0.00 0.00 176.91 178.05 2fvt h ILE 113 N 0.00 0.00 0.00 1.77 6.09 -0.98 -2.81 117.51 121.59 2fvt h ILE 113 Ca 0.00 -0.57 0.00 0.00 -1.37 0.00 0.00 64.86 62.92 2fvt h ILE 113 Cb 0.49 1.51 0.00 0.00 0.47 0.00 0.00 36.82 39.28 2fvt h ILE 113 CO 0.00 0.00 0.00 1.23 -3.07 0.00 0.00 178.15 176.31 2fvt h GLY 114 N 3.09 0.00 0.02 8.18 0.00 -1.14 -3.26 103.07 109.96 2fvt h GLY 114 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2fvt h GLY 114 CO 0.00 0.00 -0.01 0.83 0.00 0.00 0.00 176.54 177.36 2fvt h GLU 115 N 0.00 -0.03 0.00 4.80 3.07 -1.61 -3.49 114.58 117.32 2fvt h GLU 115 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2fvt h GLU 115 Cb 0.58 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.49 2fvt h GLU 115 CO 0.00 -0.02 0.00 2.89 -1.40 0.00 0.00 179.01 180.48 2fvt n ARG 116 N -2.10 0.00 -3.06 2.33 1.85 -1.23 -5.18 116.66 109.27 2fvt n ARG 116 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2fvt n ARG 116 Cb 0.01 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.42 2fvt n ARG 116 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 2fvt n ARG 117 N -1.69 -0.64 -1.09 2.89 1.85 -1.26 -4.96 116.66 111.76 2fvt n ARG 117 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 57.85 56.82 2fvt n ARG 117 Cb 0.00 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.40 2fvt n ARG 117 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 2fvt n ARG 118 N 0.00 -0.40 -5.05 2.89 1.85 -1.26 -5.02 116.66 109.68 2fvt n ARG 118 Ca 0.00 0.45 -0.32 0.00 -1.00 0.00 0.00 57.85 56.98 2fvt n ARG 118 Cb 0.00 -4.01 -0.16 0.00 -1.05 0.00 0.00 32.46 27.24 2fvt n ARG 118 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2fvt s VAL 119 N -2.01 2.50 0.09 8.89 0.11 -1.26 -1.36 120.40 127.35 2fvt s VAL 119 Ca 0.00 -0.88 0.09 0.00 -2.93 0.00 0.00 61.98 58.26 2fvt s VAL 119 Cb 0.00 -1.98 -0.04 0.00 -1.53 0.00 0.00 36.38 32.83 2fvt s VAL 119 CO 0.00 0.55 -0.23 0.00 -3.33 0.00 0.00 175.10 172.10 2fvt s ALA 120 N 0.08 2.48 -0.18 1.54 0.00 0.11 -3.83 121.76 121.96 2fvt s ALA 120 Ca -0.09 -1.33 -0.00 0.00 0.00 0.00 0.00 51.96 50.54 2fvt s ALA 120 Cb -0.15 -0.55 0.04 0.00 0.00 0.00 0.00 23.12 22.46 2fvt s ALA 120 CO 0.05 0.56 -0.07 0.00 0.00 0.00 0.00 175.76 176.31 2fvt s ALA 121 N -0.99 1.65 -0.71 0.00 0.00 0.05 -0.20 121.76 121.56 2fvt s ALA 121 Ca 0.15 -0.96 -0.17 0.00 0.00 0.00 0.00 51.96 50.98 2fvt s ALA 121 Cb -0.10 -1.18 0.15 0.00 0.00 0.00 0.00 23.12 21.99 2fvt s ALA 121 CO 0.06 -0.82 0.74 0.00 0.00 0.00 0.00 175.76 175.74 2fvt s ALA 122 N 1.56 3.69 -0.45 0.00 0.00 0.14 -0.06 121.76 126.64 2fvt s ALA 122 Ca -0.00 -2.76 -0.16 0.00 0.00 0.00 0.00 51.96 49.04 2fvt s ALA 122 Cb -0.16 -3.54 0.04 0.00 0.00 0.00 0.00 23.12 19.47 2fvt s ALA 122 CO -0.08 -2.34 0.41 -0.51 0.00 0.00 0.00 175.76 173.25 2fvt s LEU 123 N 1.56 5.19 -0.30 0.00 1.43 -0.22 -0.67 118.68 125.68 2fvt s LEU 123 Ca 0.15 -0.98 -0.20 0.00 -1.03 0.00 0.00 54.13 52.06 2fvt s LEU 123 Cb -0.18 -2.27 -0.01 0.00 0.03 0.00 0.00 46.19 43.76 2fvt s LEU 123 CO -0.02 -0.61 0.64 -0.63 0.23 0.00 0.00 176.35 175.96 2fvt s ILE 124 N 1.92 4.94 -0.05 -0.59 1.01 -0.28 -0.63 121.20 127.52 2fvt s ILE 124 Ca 0.08 0.91 -0.29 0.00 0.00 0.00 0.00 60.65 61.35 2fvt s ILE 124 Cb -0.20 -4.00 -0.02 0.00 0.01 0.00 0.00 42.46 38.25 2fvt s ILE 124 CO 0.10 -0.12 0.96 0.00 0.00 0.00 0.00 174.94 175.88 2fvt s ALA 125 N 2.61 3.28 0.03 9.38 0.00 -0.97 -4.48 121.76 131.61 2fvt s ALA 125 Ca 0.26 0.42 -0.30 0.00 0.00 0.00 0.00 51.96 52.34 2fvt s ALA 125 Cb -0.15 -3.34 -0.08 0.00 0.00 0.00 0.00 23.12 19.56 2fvt s ALA 125 CO 0.11 -0.38 1.72 0.14 0.00 0.00 0.00 175.76 177.36 2fvt s VAL 126 N 1.41 3.16 -0.67 0.00 -7.23 -1.26 -4.29 120.40 111.52 2fvt s VAL 126 Ca 0.49 0.44 -0.26 0.00 -1.81 0.00 0.00 61.98 60.84 2fvt s VAL 126 Cb -0.20 -3.28 -0.07 0.00 0.56 0.00 0.00 36.38 33.40 2fvt s VAL 126 CO 0.23 -0.02 2.16 -2.16 -0.31 0.00 0.00 175.10 175.00 2fvt s PRO 127 N 3.36 2.23 -1.01 4.82 0.04 -1.26 -4.80 135.00 138.38 2fvt s PRO 127 Ca 0.77 0.64 -0.23 0.00 0.04 0.00 0.00 61.00 62.22 2fvt s PRO 127 Cb -0.39 -4.67 0.04 0.00 0.04 0.00 0.00 34.50 29.52 2fvt s PRO 127 CO 0.33 -3.40 1.53 -1.17 0.04 0.00 0.00 177.00 174.34 2fvt s LEU 128 N 11.45 3.46 -0.03 -3.56 0.20 -1.26 -4.62 118.68 124.32 2fvt s LEU 128 Ca 0.82 -1.36 0.02 0.00 0.69 0.00 0.00 54.13 54.31 2fvt s LEU 128 Cb -0.13 -2.57 -0.03 0.00 -0.43 0.00 0.00 46.19 43.03 2fvt s LEU 128 CO 0.15 -1.70 0.01 -1.84 -0.29 0.00 0.00 176.35 172.68 2fvt n GLU 129 N 8.87 3.39 -2.92 1.98 0.28 -1.26 -5.06 120.64 125.92 2fvt n GLU 129 Ca 0.35 -0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 57.24 2fvt n GLU 129 Cb 0.50 -1.07 -0.03 0.00 1.43 0.00 0.00 31.44 32.28 2fvt n GLU 129 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2fvt n HIS 130 N -2.13 0.20 -4.61 -1.84 8.25 -1.26 -5.17 115.22 108.66 2fvt n HIS 130 Ca -0.05 -0.95 -0.28 0.00 -0.26 0.00 0.00 57.72 56.19 2fvt n HIS 130 Cb 0.59 -0.05 -0.11 0.00 1.12 0.00 0.00 29.99 31.55 2fvt n HIS 130 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2fvt s HIS 131 N -1.94 2.35 -0.20 4.41 3.76 -1.26 -5.07 115.29 117.34 2fvt s HIS 131 Ca 0.05 -0.75 0.02 0.00 -0.15 0.00 0.00 55.06 54.22 2fvt s HIS 131 Cb 0.00 -1.68 -0.21 0.00 1.11 0.00 0.00 32.58 31.81 2fvt s HIS 131 CO 0.03 0.35 0.01 0.72 -0.85 0.00 0.00 174.74 175.01 2fvt n HIS 132 N -0.96 0.41 0.00 1.40 8.25 -1.26 -4.97 115.22 118.09 2fvt n HIS 132 Ca -0.06 0.09 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 2fvt n HIS 132 Cb 0.67 -1.06 0.00 0.00 1.12 0.00 0.00 29.99 30.72 2fvt n HIS 132 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2fvt n HIS 133 N -3.26 0.00 0.00 4.41 -0.00 -1.26 -1.92 115.22 113.18 2fvt n HIS 133 Ca -0.39 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.33 2fvt n HIS 133 Cb 1.03 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 31.02 2fvt n HIS 133 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2fvt n HIS 134 N 0.00 0.00 -1.71 1.57 1.44 -1.26 -5.38 115.22 109.88 2fvt n HIS 134 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2fvt n HIS 134 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 2fvt n HIS 134 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11