#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cfi n GLN 3 N 0.00 0.00 -3.82 7.34 6.02 -1.25 -4.47 117.38 121.20 3cfi n GLN 3 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.69 3cfi n GLN 3 Cb 0.00 0.00 -0.14 0.00 1.02 0.00 0.00 30.24 31.12 3cfi n GLN 3 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3cfi s LEU 4 N 0.00 3.13 -0.20 1.08 1.43 -1.26 -1.26 118.68 121.61 3cfi s LEU 4 Ca 0.00 -2.10 -0.06 0.00 -1.03 0.00 0.00 54.13 50.94 3cfi s LEU 4 Cb 0.00 -1.15 -0.03 0.00 0.03 0.00 0.00 46.19 45.04 3cfi s LEU 4 CO 0.00 -0.36 0.03 -1.58 0.23 0.00 0.00 176.35 174.68 3cfi s GLN 5 N 1.00 3.77 0.66 1.70 2.00 -1.06 -3.74 119.66 123.99 3cfi s GLN 5 Ca 0.12 -0.44 -0.01 0.00 -2.00 0.00 0.00 55.36 53.03 3cfi s GLN 5 Cb -0.20 -3.16 0.09 0.00 0.80 0.00 0.00 33.01 30.53 3cfi s GLN 5 CO -0.13 0.10 0.92 -1.21 -0.50 0.00 0.00 175.29 174.48 3cfi s GLU 6 N 0.81 2.03 0.29 1.67 8.01 -1.26 -0.01 118.70 130.24 3cfi s GLU 6 Ca 0.02 -0.86 -0.13 0.00 0.01 0.00 0.00 54.97 54.01 3cfi s GLU 6 Cb -0.14 -2.35 0.01 0.00 -4.31 0.00 0.00 34.13 27.34 3cfi s GLU 6 CO 0.02 -1.18 0.57 -1.12 0.01 0.00 0.00 175.26 173.57 3cfi s SER 7 N -4.60 0.07 -0.01 -0.19 0.01 0.41 -4.86 113.70 104.53 3cfi s SER 7 Ca 0.62 -1.01 -0.00 0.00 1.31 0.00 0.00 55.95 56.88 3cfi s SER 7 Cb -0.08 0.67 0.00 0.00 0.21 0.00 0.00 66.02 66.82 3cfi s SER 7 CO 0.42 -1.30 0.01 0.61 0.41 0.00 0.00 173.24 173.40 3cfi n GLY 8 N -0.45 0.80 0.00 3.44 0.00 -1.26 -2.54 105.19 105.17 3cfi n GLY 8 Ca -0.03 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.38 3cfi n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfi n GLY 9 N -0.66 0.39 3.46 -0.02 0.00 -1.26 -4.61 105.19 102.49 3cfi n GLY 9 Ca -0.00 -0.06 0.05 0.00 0.00 0.00 0.00 46.02 46.01 3cfi n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfi n GLY 10 N 4.40 -1.87 3.40 -0.02 0.00 -0.90 -4.82 105.19 105.39 3cfi n GLY 10 Ca 0.00 -1.31 -0.31 0.00 0.00 0.00 0.00 46.02 44.41 3cfi n GLY 10 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3cfi s LEU 11 N 0.00 2.41 0.04 0.99 0.05 -1.26 -3.21 118.68 117.70 3cfi s LEU 11 Ca 0.00 -0.48 0.00 0.00 0.05 0.00 0.00 54.13 53.70 3cfi s LEU 11 Cb 0.00 -1.42 -0.03 0.00 -2.05 0.00 0.00 46.19 42.69 3cfi s LEU 11 CO 0.00 0.27 -0.04 0.68 -0.55 0.00 0.00 176.35 176.71 3cfi s VAL 12 N -0.85 0.26 0.54 1.48 -7.23 -1.04 -5.01 120.40 108.55 3cfi s VAL 12 Ca 0.13 -1.36 -0.17 0.00 -1.81 0.00 0.00 61.98 58.77 3cfi s VAL 12 Cb -0.10 -0.90 -0.06 0.00 0.56 0.00 0.00 36.38 35.88 3cfi s VAL 12 CO 0.03 -0.70 1.03 -1.10 -0.31 0.00 0.00 175.10 174.05 3cfi s GLN 13 N -2.60 3.63 0.19 4.82 1.11 -1.26 -4.22 119.66 121.33 3cfi s GLN 13 Ca -0.04 1.17 -0.33 0.00 0.01 0.00 0.00 55.36 56.17 3cfi s GLN 13 Cb -0.02 -2.08 -0.13 0.00 -1.01 0.00 0.00 33.01 29.77 3cfi s GLN 13 CO -0.04 -0.55 1.59 -2.30 0.01 0.00 0.00 175.29 173.99 3cfi n PRO 14 N -1.61 2.30 -0.07 2.91 -0.02 -1.26 -1.43 135.00 135.81 3cfi n PRO 14 Ca 0.08 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 3cfi n PRO 14 Cb 0.53 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 3cfi n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cfi n GLY 15 N 3.30 1.03 3.85 -1.23 0.00 0.22 -4.96 105.19 107.40 3cfi n GLY 15 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 3cfi n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3cfi s GLY 16 N -1.87 1.58 0.27 -0.02 0.00 -0.51 -4.12 107.32 102.64 3cfi s GLY 16 Ca 0.00 -0.60 0.09 0.00 0.00 0.00 0.00 44.72 44.21 3cfi s GLY 16 CO 0.00 -0.07 0.03 -0.56 0.00 0.00 0.00 173.10 172.50 3cfi s SER 17 N -4.32 4.71 -0.18 1.64 0.01 -1.26 -2.07 113.70 112.23 3cfi s SER 17 Ca 0.63 -0.59 -0.27 0.00 1.31 0.00 0.00 55.95 57.03 3cfi s SER 17 Cb -0.13 -0.93 0.07 0.00 0.21 0.00 0.00 66.02 65.24 3cfi s SER 17 CO 0.51 -0.02 0.68 -0.22 0.41 0.00 0.00 173.24 174.60 3cfi s LEU 18 N -3.71 -0.63 -0.29 2.44 2.96 0.10 -5.02 118.68 114.54 3cfi s LEU 18 Ca 0.32 1.12 0.02 0.00 -0.22 0.00 0.00 54.13 55.36 3cfi s LEU 18 Cb -0.06 2.43 0.07 0.00 0.50 0.00 0.00 46.19 49.12 3cfi s LEU 18 CO 0.21 -0.39 -0.05 -0.60 -1.32 0.00 0.00 176.35 174.20 3cfi s ARG 19 N -0.26 2.16 0.36 1.98 3.52 -1.26 0.21 118.95 125.65 3cfi s ARG 19 Ca -0.04 -1.43 -0.25 0.00 -0.13 0.00 0.00 55.73 53.88 3cfi s ARG 19 Cb -0.03 -3.03 -0.10 0.00 -1.56 0.00 0.00 34.95 30.23 3cfi s ARG 19 CO 0.04 -0.65 0.97 -0.51 -0.81 0.00 0.00 175.30 174.34 3cfi s LEU 20 N 1.11 4.22 0.22 -0.88 1.43 -0.66 -4.63 118.68 119.48 3cfi s LEU 20 Ca -0.05 1.86 0.08 0.00 -1.03 0.00 0.00 54.13 54.99 3cfi s LEU 20 Cb -0.20 -4.14 -0.05 0.00 0.03 0.00 0.00 46.19 41.83 3cfi s LEU 20 CO -0.05 -0.22 -0.14 -0.44 0.23 0.00 0.00 176.35 175.74 3cfi s SER 21 N -1.70 2.65 -0.17 2.29 0.01 -1.05 -1.36 113.70 114.37 3cfi s SER 21 Ca 0.54 -1.04 -0.05 0.00 1.31 0.00 0.00 55.95 56.71 3cfi s SER 21 Cb -0.18 -0.15 0.07 0.00 0.21 0.00 0.00 66.02 65.97 3cfi s SER 21 CO 0.23 -0.18 0.13 0.00 0.41 0.00 0.00 173.24 173.83 3cfi s ALA 23 N 2.20 3.19 0.02 0.00 0.00 0.99 -2.05 121.76 126.09 3cfi s ALA 23 Ca 0.03 -0.23 -0.13 0.00 0.00 0.00 0.00 51.96 51.64 3cfi s ALA 23 Cb -0.16 -3.87 -0.06 0.00 0.00 0.00 0.00 23.12 19.04 3cfi s ALA 23 CO -0.09 -2.15 0.40 0.00 0.00 0.00 0.00 175.76 173.91 3cfi s ALA 24 N 4.70 3.71 0.02 0.00 0.00 -0.42 -2.58 121.76 127.19 3cfi s ALA 24 Ca 0.54 -0.28 -0.28 0.00 0.00 0.00 0.00 51.96 51.94 3cfi s ALA 24 Cb -0.11 -2.34 0.08 0.00 0.00 0.00 0.00 23.12 20.75 3cfi s ALA 24 CO 0.29 0.51 0.70 -1.54 0.00 0.00 0.00 175.76 175.72 3cfi s SER 25 N -1.27 -0.57 0.00 0.00 1.04 -0.39 -4.85 113.70 107.66 3cfi s SER 25 Ca 0.26 0.37 0.00 0.00 0.48 0.00 0.00 55.95 57.06 3cfi s SER 25 Cb -0.16 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.49 3cfi s SER 25 CO 0.14 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.26 3cfi n GLY 26 N 0.33 0.66 3.68 7.32 0.00 -1.26 -3.95 105.19 111.97 3cfi n GLY 26 Ca -0.16 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 3cfi n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3cfi s PHE 27 N -2.53 -0.19 -1.08 1.61 -0.71 -1.26 -5.07 117.98 108.76 3cfi s PHE 27 Ca 0.00 -0.19 -0.20 0.00 -1.04 0.00 0.00 56.93 55.50 3cfi s PHE 27 Cb 0.00 0.56 -0.07 0.00 -1.21 0.00 0.00 43.02 42.30 3cfi s PHE 27 CO 0.00 -1.07 1.98 0.00 -1.34 0.00 0.00 175.22 174.79 3cfi n ALA 28 N -0.41 3.65 -0.29 1.99 0.00 -1.26 -4.80 120.51 119.40 3cfi n ALA 28 Ca -0.07 -3.47 0.11 0.00 0.00 0.00 0.00 53.44 50.00 3cfi n ALA 28 Cb 0.61 -3.58 0.26 0.00 0.00 0.00 0.00 19.45 16.73 3cfi n ALA 28 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3cfi h PHE 29 N 7.69 0.32 -0.23 0.00 3.57 -1.97 -1.74 116.94 124.57 3cfi h PHE 29 Ca 0.43 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.98 3cfi h PHE 29 Cb 0.73 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.45 3cfi h PHE 29 CO 1.31 -0.18 0.15 0.77 -2.23 0.00 0.00 178.31 178.13 3cfi h SER 30 N 0.22 0.27 0.00 0.41 0.02 -1.90 -2.09 113.55 110.48 3cfi h SER 30 Ca 0.51 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.45 3cfi h SER 30 Cb 0.99 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.46 3cfi h SER 30 CO -0.62 0.20 -0.01 0.61 -1.14 0.00 0.00 176.83 175.87 3cfi n GLY 31 N -1.49 -0.24 3.84 -3.77 0.00 -0.65 -4.80 105.19 98.08 3cfi n GLY 31 Ca 0.00 -0.39 -0.33 0.00 0.00 0.00 0.00 46.02 45.31 3cfi n GLY 31 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3cfi s TYR 32 N -2.03 3.40 0.01 1.61 2.02 -0.79 -4.88 117.35 116.69 3cfi s TYR 32 Ca 0.39 0.25 -0.25 0.00 -0.37 0.00 0.00 57.07 57.10 3cfi s TYR 32 Cb 0.21 -1.76 -0.05 0.00 -0.40 0.00 0.00 41.96 39.96 3cfi s TYR 32 CO 0.35 0.59 0.75 0.00 -1.57 0.00 0.00 175.55 175.67 3cfi s ALA 33 N -1.31 3.35 0.27 3.71 0.00 -1.26 -4.17 121.76 122.35 3cfi s ALA 33 Ca 0.27 0.25 0.12 0.00 0.00 0.00 0.00 51.96 52.59 3cfi s ALA 33 Cb -0.12 -2.99 -0.05 0.00 0.00 0.00 0.00 23.12 19.95 3cfi s ALA 33 CO 0.19 0.01 -0.17 -1.64 0.00 0.00 0.00 175.76 174.14 3cfi s MET 34 N 0.24 1.77 0.15 0.00 1.00 0.03 0.04 119.30 122.53 3cfi s MET 34 Ca 0.39 -1.69 -0.08 0.00 0.00 0.00 0.00 55.69 54.31 3cfi s MET 34 Cb -0.20 -1.84 -0.01 0.00 0.00 0.00 0.00 34.83 32.78 3cfi s MET 34 CO 0.22 0.34 0.25 -1.54 0.00 0.00 0.00 175.02 174.28 3cfi s SER 35 N -3.48 0.08 -0.06 3.03 1.04 0.73 0.46 113.70 115.51 3cfi s SER 35 Ca 0.30 -0.87 0.04 0.00 0.48 0.00 0.00 55.95 55.89 3cfi s SER 35 Cb -0.05 0.41 -0.02 0.00 0.10 0.00 0.00 66.02 66.45 3cfi s SER 35 CO 0.15 -0.85 -0.17 0.26 0.98 0.00 0.00 173.24 173.61 3cfi s TRP 36 N -3.96 2.62 0.03 5.02 0.52 0.50 -1.65 118.94 122.03 3cfi s TRP 36 Ca 0.16 -0.34 0.04 0.00 0.02 0.00 0.00 56.10 55.98 3cfi s TRP 36 Cb 0.04 -1.63 -0.02 0.00 -1.15 0.00 0.00 33.47 30.71 3cfi s TRP 36 CO -0.01 0.05 -0.11 0.08 0.02 0.00 0.00 176.95 176.97 3cfi s VAL 37 N -0.50 0.84 0.13 4.03 1.01 0.57 -1.48 120.40 125.01 3cfi s VAL 37 Ca 0.06 -0.87 0.05 0.00 0.00 0.00 0.00 61.98 61.22 3cfi s VAL 37 Cb -0.12 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 3cfi s VAL 37 CO 0.01 -0.07 -0.13 0.00 0.00 0.00 0.00 175.10 174.92 3cfi s ARG 38 N -1.06 1.04 -0.32 2.72 1.70 -0.17 0.18 118.95 123.04 3cfi s ARG 38 Ca -0.01 -1.31 0.00 0.00 -0.47 0.00 0.00 55.73 53.94 3cfi s ARG 38 Cb -0.07 -0.82 0.10 0.00 -0.57 0.00 0.00 34.95 33.59 3cfi s ARG 38 CO 0.01 0.14 0.09 -1.14 -1.08 0.00 0.00 175.30 173.32 3cfi s GLN 39 N -3.00 0.87 0.55 3.89 -0.44 -0.45 -0.37 119.66 120.71 3cfi s GLN 39 Ca 0.11 -1.25 -0.17 0.00 -2.50 0.00 0.00 55.36 51.54 3cfi s GLN 39 Cb -0.03 -2.23 -0.06 0.00 -1.64 0.00 0.00 33.01 29.06 3cfi s GLN 39 CO 0.02 -0.98 1.05 0.00 0.50 0.00 0.00 175.29 175.88 3cfi s ALA 40 N 1.44 2.80 0.21 1.58 0.00 -1.26 -1.41 121.76 125.12 3cfi s ALA 40 Ca 0.10 0.46 -0.31 0.00 0.00 0.00 0.00 51.96 52.21 3cfi s ALA 40 Cb -0.18 -3.23 -0.10 0.00 0.00 0.00 0.00 23.12 19.61 3cfi s ALA 40 CO -0.21 -0.60 1.53 -1.25 0.00 0.00 0.00 175.76 175.23 3cfi s PRO 41 N -3.78 4.22 0.00 0.00 0.04 -1.26 -2.02 135.00 132.20 3cfi s PRO 41 Ca 0.65 2.37 0.00 0.00 0.04 0.00 0.00 61.00 64.06 3cfi s PRO 41 Cb -0.16 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.26 3cfi s PRO 41 CO 0.31 -0.55 0.00 0.41 0.04 0.00 0.00 177.00 177.20 3cfi n GLY 42 N 3.11 0.60 3.16 0.56 0.00 -1.26 -5.04 105.19 106.32 3cfi n GLY 42 Ca 0.11 -0.02 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 3cfi n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cfi s LYS 43 N -0.24 0.82 0.79 1.61 1.02 -0.86 -5.17 119.74 117.71 3cfi s LYS 43 Ca 0.00 -1.31 -0.13 0.00 0.02 0.00 0.00 55.97 54.54 3cfi s LYS 43 Cb 0.00 -0.20 0.19 0.00 -0.52 0.00 0.00 37.83 37.30 3cfi s LYS 43 CO 0.00 -0.02 0.93 0.41 -0.92 0.00 0.00 175.35 175.75 3cfi n GLY 44 N 0.02 -1.86 3.75 -3.33 0.00 -1.26 -4.52 105.19 97.98 3cfi n GLY 44 Ca -0.13 -1.62 -0.41 0.00 0.00 0.00 0.00 46.02 43.86 3cfi n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cfi s LEU 45 N 0.00 4.42 -0.02 0.99 2.01 -1.26 -4.45 118.68 120.37 3cfi s LEU 45 Ca 0.55 2.51 0.02 0.00 0.01 0.00 0.00 54.13 57.22 3cfi s LEU 45 Cb -0.03 -3.62 0.00 0.00 0.01 0.00 0.00 46.19 42.55 3cfi s LEU 45 CO 0.40 -0.55 -0.06 -0.70 1.01 0.00 0.00 176.35 176.45 3cfi s GLU 46 N -0.59 0.65 0.14 1.70 2.12 0.50 -5.00 118.70 118.23 3cfi s GLU 46 Ca 0.55 -0.20 -0.30 0.00 0.36 0.00 0.00 54.97 55.38 3cfi s GLU 46 Cb -0.38 -0.64 -0.08 0.00 0.26 0.00 0.00 34.13 33.29 3cfi s GLU 46 CO 0.42 0.07 1.28 -0.46 -0.54 0.00 0.00 175.26 176.04 3cfi s TRP 47 N 0.21 3.33 -0.13 5.30 -0.00 -1.26 -1.00 118.94 125.39 3cfi s TRP 47 Ca -0.02 1.20 -0.15 0.00 -0.00 0.00 0.00 56.10 57.13 3cfi s TRP 47 Cb -0.07 -3.55 -0.05 0.00 -0.00 0.00 0.00 33.47 29.80 3cfi s TRP 47 CO -0.00 -1.75 -0.29 0.28 -0.00 0.00 0.00 176.95 175.19 3cfi n VAL 48 N 3.29 1.45 -3.90 5.86 0.31 -0.55 -4.82 118.33 119.98 3cfi n VAL 48 Ca 0.08 0.18 -0.09 0.00 -0.01 0.00 0.00 64.34 64.50 3cfi n VAL 48 Cb 0.44 -2.22 -0.06 0.00 -0.91 0.00 0.00 33.84 31.09 3cfi n VAL 48 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3cfi s SER 49 N -5.92 -0.09 -0.08 4.52 0.15 -1.00 -1.96 113.70 109.32 3cfi s SER 49 Ca -0.24 -0.76 -0.18 0.00 0.70 0.00 0.00 55.95 55.47 3cfi s SER 49 Cb 0.03 0.52 0.04 0.00 -1.71 0.00 0.00 66.02 64.90 3cfi s SER 49 CO 0.36 -1.01 0.42 -0.83 1.20 0.00 0.00 173.24 173.38 3cfi s GLY 50 N -2.95 -0.29 -0.07 9.45 0.00 -0.46 -0.37 107.32 112.63 3cfi s GLY 50 Ca 0.16 0.83 0.02 0.00 0.00 0.00 0.00 44.72 45.73 3cfi s GLY 50 CO 0.01 0.61 -0.13 -1.50 0.00 0.00 0.00 173.10 172.09 3cfi s ILE 51 N -0.73 1.23 0.80 0.90 2.07 0.17 -0.94 121.20 124.71 3cfi s ILE 51 Ca -0.08 -0.53 -0.12 0.00 -1.41 0.00 0.00 60.65 58.51 3cfi s ILE 51 Cb -0.04 -1.12 0.08 0.00 0.13 0.00 0.00 42.46 41.51 3cfi s ILE 51 CO 0.04 0.38 1.14 0.20 -1.91 0.00 0.00 174.94 174.79 3cfi s ASN 52 N 0.66 4.52 0.39 4.50 -0.87 0.99 -0.79 114.94 124.34 3cfi s ASN 52 Ca -0.14 0.95 0.09 0.00 -1.57 0.00 0.00 52.86 52.19 3cfi s ASN 52 Cb -0.16 -1.55 0.80 0.00 -0.02 0.00 0.00 41.25 40.32 3cfi s ASN 52 CO 0.04 -1.91 1.93 0.08 -2.57 0.00 0.00 177.10 174.67 3cfi h ARG 53 N -1.06 0.26 0.00 -0.60 0.11 -1.87 -2.63 114.38 108.59 3cfi h ARG 53 Ca -0.47 -0.05 -0.04 0.00 0.10 0.00 0.00 59.98 59.52 3cfi h ARG 53 Cb 1.31 -0.04 -0.01 0.00 1.11 0.00 0.00 29.97 32.34 3cfi h ARG 53 CO 0.64 0.37 -0.17 0.38 0.10 0.00 0.00 179.97 181.29 3cfi h ASP 54 N 0.25 0.00 0.00 0.08 2.03 -1.93 -3.48 116.42 113.37 3cfi h ASP 54 Ca 0.05 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.35 3cfi h ASP 54 Cb 0.33 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.83 3cfi h ASP 54 CO 0.02 0.17 0.00 0.61 -1.03 0.00 0.00 179.24 179.00 3cfi n GLY 55 N 1.00 1.65 3.75 7.15 0.00 -0.99 -5.11 105.19 112.64 3cfi n GLY 55 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 3cfi n GLY 55 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3cfi n SER 56 N 0.00 3.14 -4.56 1.61 7.64 -1.26 -4.66 113.62 115.52 3cfi n SER 56 Ca 0.00 1.12 -0.26 0.00 1.01 0.00 0.00 58.87 60.74 3cfi n SER 56 Cb 0.00 -1.58 -0.10 0.00 -1.01 0.00 0.00 64.21 61.52 3cfi n SER 56 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3cfi s THR 57 N -1.19 2.21 -0.12 0.44 -4.23 -1.26 -0.01 115.64 111.49 3cfi s THR 57 Ca 0.61 -2.16 -0.16 0.00 -1.18 0.00 0.00 61.69 58.80 3cfi s THR 57 Cb -0.47 -2.72 0.04 0.00 1.34 0.00 0.00 72.50 70.69 3cfi s THR 57 CO 0.58 -0.16 0.42 -0.94 -0.54 0.00 0.00 174.62 173.97 3cfi s SER 58 N -3.63 -0.40 0.03 3.99 1.04 -0.11 -4.99 113.70 109.63 3cfi s SER 58 Ca 0.33 0.66 0.02 0.00 0.48 0.00 0.00 55.95 57.44 3cfi s SER 58 Cb 0.04 0.71 -0.02 0.00 0.10 0.00 0.00 66.02 66.85 3cfi s SER 58 CO 0.17 -0.26 -0.07 -0.31 0.98 0.00 0.00 173.24 173.76 3cfi s TYR 59 N -0.26 0.57 0.48 5.02 2.02 -1.26 -1.35 117.35 122.56 3cfi s TYR 59 Ca -0.04 -0.47 -0.21 0.00 -0.37 0.00 0.00 57.07 55.98 3cfi s TYR 59 Cb -0.03 -0.35 -0.08 0.00 -0.40 0.00 0.00 41.96 41.10 3cfi s TYR 59 CO 0.02 -0.10 1.06 0.95 -1.57 0.00 0.00 175.55 175.91 3cfi s THR 60 N -1.28 3.68 0.17 -0.71 -4.23 -0.83 -4.79 115.64 107.65 3cfi s THR 60 Ca -0.10 1.09 -0.17 0.00 -1.18 0.00 0.00 61.69 61.33 3cfi s THR 60 Cb -0.09 -3.46 0.11 0.00 1.34 0.00 0.00 72.50 70.39 3cfi s THR 60 CO 0.00 -0.18 1.65 0.00 -0.54 0.00 0.00 174.62 175.55 3cfi h ALA 61 N 1.68 0.22 -0.90 3.99 0.00 -1.96 0.33 119.26 122.63 3cfi h ALA 61 Ca -0.49 0.16 0.13 0.00 0.00 0.00 0.00 54.91 54.71 3cfi h ALA 61 Cb 1.23 0.39 -0.07 0.00 0.00 0.00 0.00 17.79 19.33 3cfi h ALA 61 CO 0.59 -0.49 0.58 -1.35 0.00 0.00 0.00 179.25 178.58 3cfi h PRO 62 N -0.05 0.73 0.00 0.00 0.11 -1.98 -2.90 132.00 127.91 3cfi h PRO 62 Ca 0.21 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.27 3cfi h PRO 62 Cb 0.36 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.31 3cfi h PRO 62 CO -0.46 0.48 -1.14 0.28 -0.21 0.00 0.00 178.00 176.95 3cfi n VAL 63 N -4.56 0.40 -1.56 3.15 0.31 -0.13 -4.95 118.33 111.00 3cfi n VAL 63 Ca 0.17 -0.46 -0.43 0.00 -0.01 0.00 0.00 64.34 63.61 3cfi n VAL 63 Cb 0.43 -0.15 -0.00 0.00 -0.91 0.00 0.00 33.84 33.20 3cfi n VAL 63 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3cfi n LYS 64 N -2.42 1.15 0.00 5.55 5.02 0.99 -2.28 118.16 126.17 3cfi n LYS 64 Ca -0.00 0.41 0.00 0.00 -2.02 0.00 0.00 58.31 56.70 3cfi n LYS 64 Cb 0.52 -1.80 0.00 0.00 -0.02 0.00 0.00 35.03 33.73 3cfi n LYS 64 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3cfi n GLY 65 N 1.35 2.24 0.17 0.72 0.00 -1.26 -4.68 105.19 103.73 3cfi n GLY 65 Ca 0.10 -0.16 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 3cfi n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cfi n ARG 66 N 0.00 0.57 -3.02 1.61 1.74 -1.12 -4.96 116.66 111.47 3cfi n ARG 66 Ca 0.00 0.22 -0.34 0.00 -0.77 0.00 0.00 57.85 56.96 3cfi n ARG 66 Cb 0.00 -1.45 -0.06 0.00 -1.02 0.00 0.00 32.46 29.93 3cfi n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3cfi s PHE 67 N -2.48 3.43 -0.05 -1.55 2.99 -0.97 -3.07 117.98 116.28 3cfi s PHE 67 Ca -0.36 1.39 -0.02 0.00 0.00 0.00 0.00 56.93 57.95 3cfi s PHE 67 Cb 0.13 -2.66 0.03 0.00 0.00 0.00 0.00 43.02 40.52 3cfi s PHE 67 CO 0.49 0.10 0.05 0.99 -0.00 0.00 0.00 175.22 176.84 3cfi s THR 68 N -1.92 0.02 -0.02 0.64 2.01 -0.23 -4.88 115.64 111.27 3cfi s THR 68 Ca 0.54 0.33 -0.14 0.00 0.31 0.00 0.00 61.69 62.73 3cfi s THR 68 Cb -0.12 -0.26 -0.05 0.00 0.01 0.00 0.00 72.50 72.07 3cfi s THR 68 CO 0.17 0.19 0.39 -0.51 -0.69 0.00 0.00 174.62 174.17 3cfi s ILE 69 N 2.12 5.08 0.24 1.82 -1.16 -1.26 -0.79 121.20 127.24 3cfi s ILE 69 Ca 0.05 0.79 -0.15 0.00 -0.51 0.00 0.00 60.65 60.83 3cfi s ILE 69 Cb -0.12 -3.69 0.00 0.00 0.61 0.00 0.00 42.46 39.26 3cfi s ILE 69 CO -0.04 0.57 0.51 -0.94 -2.81 0.00 0.00 174.94 172.23 3cfi s SER 70 N -0.97 -0.14 -0.03 4.50 1.04 -1.01 -5.01 113.70 112.09 3cfi s SER 70 Ca 0.23 -0.81 -0.06 0.00 0.48 0.00 0.00 55.95 55.80 3cfi s SER 70 Cb -0.16 0.60 0.01 0.00 0.10 0.00 0.00 66.02 66.56 3cfi s SER 70 CO 0.12 -1.14 0.14 0.00 0.98 0.00 0.00 173.24 173.34 3cfi s ARG 71 N -3.98 0.31 -0.35 4.02 1.70 -1.26 -0.43 118.95 118.96 3cfi s ARG 71 Ca 0.18 -0.07 0.02 0.00 -0.47 0.00 0.00 55.73 55.39 3cfi s ARG 71 Cb -0.01 0.13 0.10 0.00 -0.57 0.00 0.00 34.95 34.60 3cfi s ARG 71 CO 0.06 -0.06 0.08 0.34 -1.08 0.00 0.00 175.30 174.64 3cfi s ASP 72 N -0.58 4.89 0.44 -2.89 2.15 0.69 -4.98 116.67 116.38 3cfi s ASP 72 Ca -0.07 -1.99 0.29 0.00 0.43 0.00 0.00 52.55 51.21 3cfi s ASP 72 Cb -0.04 -1.68 1.07 0.00 -0.30 0.00 0.00 42.92 41.96 3cfi s ASP 72 CO 0.01 -0.40 1.85 0.78 -0.17 0.00 0.00 175.17 177.23 3cfi h ASN 73 N 7.78 0.00 0.14 -0.34 2.35 -1.97 -0.35 115.58 123.20 3cfi h ASN 73 Ca -0.09 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.65 3cfi h ASN 73 Cb 1.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.40 3cfi h ASN 73 CO 0.57 0.00 -0.07 0.00 -1.65 0.00 0.00 177.43 176.28 3cfi h ALA 74 N 2.10 -0.19 -0.02 -0.83 0.00 -1.96 -3.30 119.26 115.05 3cfi h ALA 74 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3cfi h ALA 74 Cb 0.58 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3cfi h ALA 74 CO 0.00 -0.41 -0.04 1.17 0.00 0.00 0.00 179.25 179.96 3cfi n LYS 75 N -5.00 1.95 -3.42 0.00 3.00 -1.20 -4.99 118.16 108.51 3cfi n LYS 75 Ca -0.09 -1.47 -0.22 0.00 -0.00 0.00 0.00 58.31 56.54 3cfi n LYS 75 Cb 0.23 -1.47 0.06 0.00 0.00 0.00 0.00 35.03 33.85 3cfi n LYS 75 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 3cfi n ASN 76 N 0.76 -6.15 -4.00 3.14 3.02 -0.21 -4.79 115.26 107.03 3cfi n ASN 76 Ca 0.15 -0.83 -0.23 0.00 -0.03 0.00 0.00 54.58 53.65 3cfi n ASN 76 Cb 0.49 -4.49 -0.16 0.00 -0.61 0.00 0.00 39.78 35.01 3cfi n ASN 76 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3cfi s ILE 77 N -3.42 0.94 -0.14 2.41 1.01 -0.75 -1.30 121.20 119.95 3cfi s ILE 77 Ca 0.47 -0.39 -0.06 0.00 0.00 0.00 0.00 60.65 60.67 3cfi s ILE 77 Cb -0.10 -0.86 -0.04 0.00 0.01 0.00 0.00 42.46 41.46 3cfi s ILE 77 CO 0.79 0.30 0.08 -0.22 0.00 0.00 0.00 174.94 175.89 3cfi s LEU 78 N 0.56 3.99 0.23 2.97 2.96 -0.87 -0.22 118.68 128.29 3cfi s LEU 78 Ca -0.11 0.24 0.10 0.00 -0.22 0.00 0.00 54.13 54.15 3cfi s LEU 78 Cb -0.14 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.53 3cfi s LEU 78 CO 0.02 0.30 -0.12 -0.31 -1.32 0.00 0.00 176.35 174.92 3cfi s TYR 79 N -0.40 2.51 -0.29 5.38 2.02 0.43 -0.59 117.35 126.41 3cfi s TYR 79 Ca 0.10 -0.27 -0.04 0.00 -0.37 0.00 0.00 57.07 56.49 3cfi s TYR 79 Cb -0.12 -1.16 0.10 0.00 -0.40 0.00 0.00 41.96 40.38 3cfi s TYR 79 CO 0.02 0.59 0.13 -1.17 -1.57 0.00 0.00 175.55 173.55 3cfi s LEU 80 N -3.20 0.52 -0.51 -1.29 2.96 -0.47 -2.41 118.68 114.28 3cfi s LEU 80 Ca 0.27 -1.27 -0.29 0.00 -0.22 0.00 0.00 54.13 52.63 3cfi s LEU 80 Cb -0.07 -0.33 0.03 0.00 0.50 0.00 0.00 46.19 46.31 3cfi s LEU 80 CO 0.16 -0.44 1.22 -1.58 -1.32 0.00 0.00 176.35 174.39 3cfi s GLN 81 N 2.10 3.59 -0.26 1.98 2.00 0.03 -1.66 119.66 127.44 3cfi s GLN 81 Ca 0.09 0.49 -0.10 0.00 -2.00 0.00 0.00 55.36 53.83 3cfi s GLN 81 Cb -0.16 -3.98 -0.05 0.00 0.80 0.00 0.00 33.01 29.62 3cfi s GLN 81 CO -0.37 -1.57 0.16 -1.64 -0.50 0.00 0.00 175.29 171.38 3cfi s MET 82 N 4.80 3.95 0.19 1.67 -1.94 0.13 -1.06 119.30 127.04 3cfi s MET 82 Ca 0.48 -0.32 0.11 0.00 -1.71 0.00 0.00 55.69 54.25 3cfi s MET 82 Cb -0.08 -3.58 -0.04 0.00 2.01 0.00 0.00 34.83 33.14 3cfi s MET 82 CO 0.29 -0.10 -0.23 1.21 -0.01 0.00 0.00 175.02 176.19 3cfi s ASN 83 N 1.51 3.30 -1.35 3.03 3.84 -1.17 -0.72 114.94 123.37 3cfi s ASN 83 Ca 0.07 -0.88 -0.02 0.00 0.21 0.00 0.00 52.86 52.24 3cfi s ASN 83 Cb -0.15 -0.24 -0.00 0.00 -0.55 0.00 0.00 41.25 40.31 3cfi s ASN 83 CO 0.08 0.09 0.53 -1.54 -2.79 0.00 0.00 177.10 173.47 3cfi n SER 84 N 0.21 -1.07 -4.66 -4.21 3.41 -1.23 -4.65 113.62 101.43 3cfi n SER 84 Ca -0.12 -0.96 -0.42 0.00 -0.26 0.00 0.00 58.87 57.10 3cfi n SER 84 Cb 0.56 -3.35 -0.03 0.00 -0.26 0.00 0.00 64.21 61.14 3cfi n SER 84 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3cfi s LEU 85 N -6.83 4.26 0.36 1.04 2.96 -0.88 -4.67 118.68 114.91 3cfi s LEU 85 Ca 0.05 2.06 0.01 0.00 -0.22 0.00 0.00 54.13 56.03 3cfi s LEU 85 Cb -0.02 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 43.11 3cfi s LEU 85 CO 0.87 -0.90 0.56 -0.13 -1.32 0.00 0.00 176.35 175.43 3cfi s ARG 86 N 3.93 3.44 0.44 1.98 0.52 -1.26 -0.61 118.95 127.39 3cfi s ARG 86 Ca 0.68 -0.35 0.14 0.00 -0.52 0.00 0.00 55.73 55.68 3cfi s ARG 86 Cb -0.30 -2.65 1.04 0.00 0.52 0.00 0.00 34.95 33.56 3cfi s ARG 86 CO 0.26 0.11 1.99 -1.35 0.02 0.00 0.00 175.30 176.32 3cfi h PRO 87 N 0.72 0.38 0.00 3.54 0.11 -1.95 -2.00 132.00 132.80 3cfi h PRO 87 Ca -0.49 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 3cfi h PRO 87 Cb 1.22 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 3cfi h PRO 87 CO 0.61 0.25 -0.01 1.05 -0.21 0.00 0.00 178.00 179.69 3cfi h GLU 88 N 0.39 0.00 0.00 1.05 4.11 -1.95 -1.68 114.58 116.51 3cfi h GLU 88 Ca 0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.69 3cfi h GLU 88 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 3cfi h GLU 88 CO -0.07 0.01 0.00 -0.25 0.07 0.00 0.00 179.01 178.77 3cfi n ASP 89 N -3.25 0.37 -4.54 3.06 8.00 -0.75 -4.81 116.55 114.63 3cfi n ASP 89 Ca -0.02 0.55 -0.47 0.00 0.71 0.00 0.00 54.79 55.56 3cfi n ASP 89 Cb 0.13 -0.64 -0.05 0.00 -0.02 0.00 0.00 41.12 40.53 3cfi n ASP 89 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3cfi n THR 90 N -1.86 0.31 -3.78 -3.53 -1.04 -0.63 -4.87 114.28 98.87 3cfi n THR 90 Ca 0.05 -0.34 -0.04 0.00 -2.04 0.00 0.00 64.05 61.69 3cfi n THR 90 Cb 0.33 -2.10 -0.01 0.00 -1.82 0.00 0.00 70.33 66.73 3cfi n THR 90 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3cfi s ALA 91 N 7.41 -1.58 -0.44 2.41 0.00 -0.49 -4.20 121.76 124.87 3cfi s ALA 91 Ca 1.04 0.02 -0.22 0.00 0.00 0.00 0.00 51.96 52.80 3cfi s ALA 91 Cb -0.60 0.67 0.02 0.00 0.00 0.00 0.00 23.12 23.22 3cfi s ALA 91 CO 0.43 -1.05 0.71 0.08 0.00 0.00 0.00 175.76 175.93 3cfi s VAL 92 N -3.25 4.75 -0.26 0.00 1.01 -0.50 -2.01 120.40 120.13 3cfi s VAL 92 Ca 0.13 0.28 -0.20 0.00 0.00 0.00 0.00 61.98 62.19 3cfi s VAL 92 Cb -0.02 -4.25 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 3cfi s VAL 92 CO 0.03 -0.64 0.62 -0.31 0.00 0.00 0.00 175.10 174.80 3cfi s TYR 93 N 3.03 3.27 0.06 5.22 1.51 -0.46 -1.34 117.35 128.64 3cfi s TYR 93 Ca 0.26 0.76 0.03 0.00 -1.01 0.00 0.00 57.07 57.11 3cfi s TYR 93 Cb -0.13 -2.86 -0.04 0.00 -0.11 0.00 0.00 41.96 38.82 3cfi s TYR 93 CO 0.20 -0.35 0.03 0.71 -1.11 0.00 0.00 175.55 175.03 3cfi s TYR 94 N 2.51 3.09 -0.17 2.71 1.51 0.46 -1.78 117.35 125.69 3cfi s TYR 94 Ca 0.25 0.04 -0.04 0.00 -1.01 0.00 0.00 57.07 56.31 3cfi s TYR 94 Cb -0.15 -1.60 -0.03 0.00 -0.11 0.00 0.00 41.96 40.07 3cfi s TYR 94 CO 0.09 0.49 -0.02 0.00 -1.11 0.00 0.00 175.55 175.00 3cfi s ALA 96 N 0.47 -0.04 0.47 0.00 0.00 -0.66 -0.49 121.76 121.52 3cfi s ALA 96 Ca -0.03 -0.78 -0.20 0.00 0.00 0.00 0.00 51.96 50.95 3cfi s ALA 96 Cb -0.14 0.53 -0.09 0.00 0.00 0.00 0.00 23.12 23.42 3cfi s ALA 96 CO 0.02 -0.51 1.02 0.15 0.00 0.00 0.00 175.76 176.45 3cfi s LYS 97 N -3.89 3.89 -0.08 0.00 1.02 -0.53 -0.19 119.74 119.95 3cfi s LYS 97 Ca 0.08 1.32 0.03 0.00 0.02 0.00 0.00 55.97 57.42 3cfi s LYS 97 Cb 0.05 -2.12 -0.02 0.00 -0.52 0.00 0.00 37.83 35.22 3cfi s LYS 97 CO -0.09 -0.35 -0.15 -0.46 -0.92 0.00 0.00 175.35 173.38 3cfi s TRP 98 N -2.01 2.72 -2.38 3.18 -0.00 0.11 -1.50 118.94 119.06 3cfi s TRP 98 Ca 0.66 -0.38 0.24 0.00 -0.00 0.00 0.00 56.10 56.63 3cfi s TRP 98 Cb -0.15 -1.70 0.27 0.00 -0.00 0.00 0.00 33.47 31.89 3cfi s TRP 98 CO 0.19 0.01 1.28 1.28 -0.00 0.00 0.00 176.95 179.71 3cfi n LEU 99 N 2.79 2.18 0.00 5.86 4.77 -0.50 -4.48 117.00 127.61 3cfi n LEU 99 Ca -0.18 -0.75 0.00 0.00 -0.03 0.00 0.00 56.01 55.06 3cfi n LEU 99 Cb 0.52 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 3cfi n LEU 99 CO 0.27 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.32 3cfi n GLY 100 N 1.36 1.75 0.00 -0.72 0.00 -1.26 -4.97 105.19 101.36 3cfi n GLY 100 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3cfi n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfi n GLY 101 N -0.95 0.51 0.35 -0.02 0.00 -1.26 -4.97 105.19 98.85 3cfi n GLY 101 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 3cfi n GLY 101 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cfi n ARG 102 N 0.00 1.32 -4.60 1.61 1.74 -1.26 -5.01 116.66 110.46 3cfi n ARG 102 Ca 0.00 -2.80 -0.34 0.00 -0.77 0.00 0.00 57.85 53.94 3cfi n ARG 102 Cb 0.00 -1.46 -0.11 0.00 -1.02 0.00 0.00 32.46 29.87 3cfi n ARG 102 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3cfi s ASP 103 N -2.93 4.70 0.37 0.55 1.01 -1.26 -4.62 116.67 114.49 3cfi s ASP 103 Ca 0.33 -0.01 0.03 0.00 0.71 0.00 0.00 52.55 53.62 3cfi s ASP 103 Cb 0.31 -1.19 -0.04 0.00 1.01 0.00 0.00 42.92 43.01 3cfi s ASP 103 CO -0.02 0.36 0.10 -1.66 0.21 0.00 0.00 175.17 174.17 3cfi s TRP 104 N -0.82 1.82 0.12 4.23 -2.14 -1.26 -1.41 118.94 119.49 3cfi s TRP 104 Ca 0.12 -1.17 -0.25 0.00 2.66 0.00 0.00 56.10 57.46 3cfi s TRP 104 Cb -0.11 -1.18 0.07 0.00 -3.10 0.00 0.00 33.47 29.15 3cfi s TRP 104 CO 0.01 -0.20 0.87 1.52 -2.66 0.00 0.00 176.95 176.50 3cfi s TYR 105 N -3.28 -0.24 -1.23 1.66 -0.85 -0.56 -4.89 117.35 107.95 3cfi s TYR 105 Ca 0.29 -0.02 -0.12 0.00 -0.52 0.00 0.00 57.07 56.70 3cfi s TYR 105 Cb 0.05 0.61 -0.01 0.00 0.38 0.00 0.00 41.96 42.99 3cfi s TYR 105 CO 0.15 -0.80 0.68 -0.25 -1.52 0.00 0.00 175.55 173.81 3cfi n ASP 106 N -0.39 -3.41 -4.77 -0.18 8.00 -1.26 -1.46 116.55 113.08 3cfi n ASP 106 Ca -0.08 -0.98 -0.40 0.00 0.71 0.00 0.00 54.79 54.04 3cfi n ASP 106 Cb 0.61 -3.45 -0.03 0.00 -0.02 0.00 0.00 41.12 38.24 3cfi n ASP 106 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3cfi s ARG 107 N -6.09 4.45 0.93 -1.24 3.52 -1.26 -4.18 118.95 115.08 3cfi s ARG 107 Ca 0.28 2.03 -0.16 0.00 -0.13 0.00 0.00 55.73 57.75 3cfi s ARG 107 Cb -0.10 -3.09 0.22 0.00 -1.56 0.00 0.00 34.95 30.42 3cfi s ARG 107 CO 0.86 -0.04 1.10 0.41 -0.81 0.00 0.00 175.30 176.82 3cfi n GLY 108 N 0.94 -1.89 0.19 8.12 0.00 0.35 -4.99 105.19 107.92 3cfi n GLY 108 Ca -0.00 -1.63 -0.17 0.00 0.00 0.00 0.00 46.02 44.22 3cfi n GLY 108 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3cfi h GLN 109 N 0.00 0.64 0.00 1.61 1.08 -1.88 -3.44 115.11 113.12 3cfi h GLN 109 Ca -0.37 -0.61 0.00 0.00 -1.45 0.00 0.00 58.65 56.22 3cfi h GLN 109 Cb 1.06 0.16 0.00 0.00 -0.05 0.00 0.00 27.48 28.64 3cfi h GLN 109 CO 0.26 1.22 0.00 0.41 -0.95 0.00 0.00 178.83 179.77 3cfi n GLY 110 N 0.88 1.99 3.01 3.46 0.00 -1.26 -4.97 105.19 108.30 3cfi n GLY 110 Ca -0.08 -1.97 -0.16 0.00 0.00 0.00 0.00 46.02 43.81 3cfi n GLY 110 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3cfi s THR 111 N -2.50 0.52 -0.24 2.61 -4.23 -0.73 -4.78 115.64 106.30 3cfi s THR 111 Ca 0.00 -0.54 -0.25 0.00 -1.18 0.00 0.00 61.69 59.72 3cfi s THR 111 Cb 0.00 -0.49 -0.00 0.00 1.34 0.00 0.00 72.50 73.35 3cfi s THR 111 CO 0.00 -0.03 0.85 -1.58 -0.54 0.00 0.00 174.62 173.32 3cfi s GLN 112 N -0.62 4.19 -0.17 3.99 2.00 -1.26 -1.35 119.66 126.44 3cfi s GLN 112 Ca -0.01 0.98 -0.02 0.00 -2.00 0.00 0.00 55.36 54.31 3cfi s GLN 112 Cb -0.05 -3.64 -0.01 0.00 0.80 0.00 0.00 33.01 30.11 3cfi s GLN 112 CO 0.00 -0.52 -0.10 0.08 -0.50 0.00 0.00 175.29 174.25 3cfi s VAL 113 N 2.85 3.16 -0.06 1.34 1.01 -0.85 -2.11 120.40 125.74 3cfi s VAL 113 Ca 0.36 -0.60 -0.02 0.00 0.00 0.00 0.00 61.98 61.72 3cfi s VAL 113 Cb -0.15 -2.37 0.04 0.00 0.00 0.00 0.00 36.38 33.89 3cfi s VAL 113 CO 0.07 0.49 0.12 0.28 0.00 0.00 0.00 175.10 176.06 3cfi s THR 114 N 0.80 -0.09 0.00 3.92 -1.32 -1.20 -1.40 115.64 116.36 3cfi s THR 114 Ca -0.03 0.23 0.00 0.00 -1.21 0.00 0.00 61.69 60.68 3cfi s THR 114 Cb -0.15 -0.21 0.00 0.00 -1.51 0.00 0.00 72.50 70.63 3cfi s THR 114 CO 0.01 0.10 0.16 1.33 -2.21 0.00 0.00 174.62 174.00