#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eny s SER 2 N 0.00 -0.69 -1.36 1.61 0.15 -1.26 -4.96 113.70 107.20 2eny s SER 2 Ca 0.00 1.04 -0.08 0.00 0.70 0.00 0.00 55.95 57.61 2eny s SER 2 Cb 0.00 1.47 0.01 0.00 -1.71 0.00 0.00 66.02 65.80 2eny s SER 2 CO 0.00 -0.16 1.15 -1.20 1.20 0.00 0.00 173.24 174.23 2eny n SER 3 N 4.32 -5.75 -3.33 5.45 7.64 -1.26 -4.99 113.62 115.70 2eny n SER 3 Ca -0.16 -0.57 -0.03 0.00 1.01 0.00 0.00 58.87 59.12 2eny n SER 3 Cb 0.56 -4.95 -0.05 0.00 -1.01 0.00 0.00 64.21 58.76 2eny n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2eny s GLY 4 N -3.44 -0.66 0.03 0.23 0.00 -1.26 -5.16 107.32 97.06 2eny s GLY 4 Ca 0.52 1.46 -0.27 0.00 0.00 0.00 0.00 44.72 46.44 2eny s GLY 4 CO 0.74 2.94 0.76 -0.56 0.00 0.00 0.00 173.10 176.98 2eny s SER 5 N 2.70 -0.49 0.04 1.64 0.01 -1.26 -4.81 113.70 111.53 2eny s SER 5 Ca 0.13 0.17 0.06 0.00 1.31 0.00 0.00 55.95 57.62 2eny s SER 5 Cb -0.15 0.48 -0.02 0.00 0.21 0.00 0.00 66.02 66.54 2eny s SER 5 CO -0.18 -0.71 -0.17 -0.44 0.41 0.00 0.00 173.24 172.15 2eny s SER 6 N -2.19 1.99 -0.74 2.44 0.01 -1.26 -5.09 113.70 108.86 2eny s SER 6 Ca -0.00 -0.46 -0.26 0.00 1.31 0.00 0.00 55.95 56.54 2eny s SER 6 Cb -0.01 -0.15 0.04 0.00 0.21 0.00 0.00 66.02 66.11 2eny s SER 6 CO -0.06 0.10 1.21 -0.83 0.41 0.00 0.00 173.24 174.07 2eny s GLY 7 N -1.08 1.03 -0.80 3.44 0.00 -1.26 -4.89 107.32 103.77 2eny s GLY 7 Ca 0.04 -1.55 -0.00 0.00 0.00 0.00 0.00 44.72 43.21 2eny s GLY 7 CO 0.01 2.51 1.77 1.42 0.00 0.00 0.00 173.10 178.81 2eny n HIS 8 N 8.92 3.08 -1.66 1.90 -0.00 -1.26 -5.03 115.22 121.18 2eny n HIS 8 Ca 0.03 -2.60 -0.60 0.00 -0.00 0.00 0.00 57.72 54.56 2eny n HIS 8 Cb 0.48 -0.96 -0.08 0.00 -0.00 0.00 0.00 29.99 29.44 2eny n HIS 8 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 2eny n VAL 9 N -0.43 0.10 0.00 1.59 0.31 -1.26 -4.89 118.33 113.75 2eny n VAL 9 Ca 0.49 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.80 2eny n VAL 9 Cb 0.32 -0.70 0.00 0.00 -0.91 0.00 0.00 33.84 32.55 2eny n VAL 9 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2eny n GLY 10 N 3.26 0.70 3.70 2.92 0.00 -1.26 -5.01 105.19 109.49 2eny n GLY 10 Ca 0.25 -0.73 -0.58 0.00 0.00 0.00 0.00 46.02 44.96 2eny n GLY 10 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2eny n ILE 11 N -0.08 0.24 0.82 -0.61 5.41 -1.26 -1.11 119.36 122.76 2eny n ILE 11 Ca 0.00 -0.04 0.10 0.00 1.00 0.00 0.00 62.75 63.80 2eny n ILE 11 Cb 0.00 -1.10 -0.12 0.00 -0.71 0.00 0.00 39.64 37.71 2eny n ILE 11 CO 0.00 0.00 0.00 1.07 0.00 0.00 0.00 176.55 177.62 2eny n THR 12 N 4.24 0.00 -3.74 1.39 5.66 -1.10 -4.74 114.28 115.99 2eny n THR 12 Ca 0.26 -0.08 -0.30 0.00 -3.05 0.00 0.00 64.05 60.87 2eny n THR 12 Cb 0.12 0.87 -0.15 0.00 -1.55 0.00 0.00 70.33 69.62 2eny n THR 12 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 2eny s LYS 13 N -2.97 0.73 0.85 1.09 2.20 -1.22 -4.97 119.74 115.45 2eny s LYS 13 Ca 0.06 -1.10 -0.14 0.00 -0.36 0.00 0.00 55.97 54.43 2eny s LYS 13 Cb 0.15 -2.00 0.01 0.00 -1.51 0.00 0.00 37.83 34.47 2eny s LYS 13 CO 0.83 -0.99 0.48 0.54 -0.36 0.00 0.00 175.35 175.85 2eny n ARG 14 N 4.82 -0.02 -1.02 4.03 3.00 -1.26 -4.18 116.66 122.03 2eny n ARG 14 Ca -0.02 0.04 -0.29 0.00 -0.01 0.00 0.00 57.85 57.58 2eny n ARG 14 Cb 0.42 -1.87 0.20 0.00 0.00 0.00 0.00 32.46 31.22 2eny n ARG 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2eny s LEU 15 N -0.85 1.24 -0.01 0.55 1.43 -1.26 -4.96 118.68 114.82 2eny s LEU 15 Ca 0.61 1.16 0.05 0.00 -1.03 0.00 0.00 54.13 54.92 2eny s LEU 15 Cb -0.27 -3.21 -0.01 0.00 0.03 0.00 0.00 46.19 42.73 2eny s LEU 15 CO 0.63 -3.53 -0.15 -0.75 0.23 0.00 0.00 176.35 172.78 2eny s LYS 16 N -4.91 1.22 -0.05 1.70 2.20 -1.26 -5.04 119.74 113.60 2eny s LYS 16 Ca 0.67 -0.53 -0.30 0.00 -0.36 0.00 0.00 55.97 55.45 2eny s LYS 16 Cb -0.19 -1.17 -0.04 0.00 -1.51 0.00 0.00 37.83 34.93 2eny s LYS 16 CO 0.59 0.31 1.24 0.99 -0.36 0.00 0.00 175.35 178.12 2eny s THR 17 N -0.32 4.17 -0.20 3.43 2.01 -1.26 -4.79 115.64 118.67 2eny s THR 17 Ca 0.05 1.50 -0.08 0.00 0.31 0.00 0.00 61.69 63.47 2eny s THR 17 Cb -0.06 -3.96 -0.04 0.00 0.01 0.00 0.00 72.50 68.45 2eny s THR 17 CO -0.00 -0.01 0.08 -0.04 -0.69 0.00 0.00 174.62 173.96 2eny s MET 18 N 2.30 3.94 -0.30 4.92 1.00 -1.18 -5.03 119.30 124.96 2eny s MET 18 Ca 0.57 -0.35 0.01 0.00 0.00 0.00 0.00 55.69 55.92 2eny s MET 18 Cb -0.26 -3.28 0.06 0.00 0.00 0.00 0.00 34.83 31.36 2eny s MET 18 CO 0.22 0.18 -0.03 -2.00 0.00 0.00 0.00 175.02 173.39 2eny s GLU 19 N 0.65 2.23 0.24 2.03 -6.30 -1.26 -2.39 118.70 113.89 2eny s GLU 19 Ca 0.04 -1.40 0.03 0.00 -2.50 0.00 0.00 54.97 51.14 2eny s GLU 19 Cb -0.13 -3.09 -0.01 0.00 0.00 0.00 0.00 34.13 30.90 2eny s GLU 19 CO 0.01 -0.66 0.11 1.33 0.02 0.00 0.00 175.26 176.08 2eny n VAL 20 N 4.51 0.00 -4.12 3.70 0.24 -1.02 -5.04 118.33 116.60 2eny n VAL 20 Ca -0.11 -1.48 -0.27 0.00 -2.04 0.00 0.00 64.34 60.44 2eny n VAL 20 Cb 0.43 0.59 -0.06 0.00 -1.47 0.00 0.00 33.84 33.32 2eny n VAL 20 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2eny s LEU 21 N 0.00 3.64 0.14 1.34 2.96 -1.26 -2.87 118.68 122.63 2eny s LEU 21 Ca 0.16 -0.20 -0.33 0.00 -0.22 0.00 0.00 54.13 53.54 2eny s LEU 21 Cb 0.01 -2.28 -0.13 0.00 0.50 0.00 0.00 46.19 44.29 2eny s LEU 21 CO 0.11 0.09 1.67 1.21 -1.32 0.00 0.00 176.35 178.11 2eny n GLU 22 N -0.17 2.35 0.00 1.98 2.13 0.17 -1.79 120.64 125.31 2eny n GLU 22 Ca -0.09 0.85 0.00 0.00 0.66 0.00 0.00 57.16 58.58 2eny n GLU 22 Cb 0.54 -2.66 0.00 0.00 0.27 0.00 0.00 31.44 29.60 2eny n GLU 22 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2eny n GLY 23 N 3.72 2.16 3.75 8.31 0.00 -1.26 -4.72 105.19 117.15 2eny n GLY 23 Ca 0.17 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2eny n GLY 23 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2eny s GLU 24 N 0.00 0.99 -0.14 1.61 2.02 -0.74 -4.67 118.70 117.77 2eny s GLU 24 Ca 0.00 0.39 -0.01 0.00 0.02 0.00 0.00 54.97 55.37 2eny s GLU 24 Cb 0.00 -1.81 -0.02 0.00 0.10 0.00 0.00 34.13 32.40 2eny s GLU 24 CO 0.00 -2.32 -0.09 -1.54 0.02 0.00 0.00 175.26 171.33 2eny s SER 25 N -3.83 4.35 0.42 -0.19 1.04 -1.26 -3.51 113.70 110.71 2eny s SER 25 Ca 0.64 -0.23 0.07 0.00 0.48 0.00 0.00 55.95 56.90 2eny s SER 25 Cb -0.16 -1.65 -0.07 0.00 0.10 0.00 0.00 66.02 64.24 2eny s SER 25 CO 0.55 0.18 0.04 0.00 0.98 0.00 0.00 173.24 174.98 2eny s SER 27 N -3.75 -0.53 0.08 0.00 0.01 -1.26 0.35 113.70 108.60 2eny s SER 27 Ca 0.34 1.01 0.09 0.00 1.31 0.00 0.00 55.95 58.70 2eny s SER 27 Cb 0.09 1.01 -0.04 0.00 0.21 0.00 0.00 66.02 67.29 2eny s SER 27 CO 0.18 -0.18 -0.20 -0.36 0.41 0.00 0.00 173.24 173.09 2eny s PHE 28 N 0.37 2.48 0.08 2.43 0.40 -1.07 -4.95 117.98 117.73 2eny s PHE 28 Ca -0.01 -0.30 0.04 0.00 -0.60 0.00 0.00 56.93 56.07 2eny s PHE 28 Cb -0.04 -1.38 -0.03 0.00 0.51 0.00 0.00 43.02 42.08 2eny s PHE 28 CO -0.01 0.29 -0.12 -1.83 0.70 0.00 0.00 175.22 174.25 2eny s GLU 29 N -1.74 0.79 -0.15 0.44 -1.05 -1.26 -0.24 118.70 115.50 2eny s GLU 29 Ca 0.15 -0.99 -0.05 0.00 -0.15 0.00 0.00 54.97 53.93 2eny s GLU 29 Cb -0.10 -0.68 0.07 0.00 -0.44 0.00 0.00 34.13 32.98 2eny s GLU 29 CO 0.07 0.14 0.29 0.00 0.95 0.00 0.00 175.26 176.71 2eny s VAL 31 N 2.46 5.33 0.05 0.00 1.01 -1.26 -0.85 120.40 127.14 2eny s VAL 31 Ca 0.01 -0.30 0.07 0.00 0.00 0.00 0.00 61.98 61.76 2eny s VAL 31 Cb -0.12 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 2eny s VAL 31 CO -0.10 0.10 -0.18 -0.76 0.00 0.00 0.00 175.10 174.17 2eny s LEU 32 N -2.59 2.63 0.23 3.92 1.43 -0.50 -2.71 118.68 121.09 2eny s LEU 32 Ca 0.36 -0.43 -0.07 0.00 -1.03 0.00 0.00 54.13 52.96 2eny s LEU 32 Cb -0.13 -1.53 0.38 0.00 0.03 0.00 0.00 46.19 44.94 2eny s LEU 32 CO 0.27 0.25 1.71 0.77 0.23 0.00 0.00 176.35 179.58 2eny h SER 33 N 4.44 0.08 -4.38 2.29 4.64 -1.41 -3.43 113.55 115.78 2eny h SER 33 Ca -0.48 0.12 -0.31 0.00 -0.47 0.00 0.00 61.79 60.65 2eny h SER 33 Cb 1.16 0.15 -0.17 0.00 -0.31 0.00 0.00 62.40 63.22 2eny h SER 33 CO 0.48 0.02 -0.73 -2.28 -0.87 0.00 0.00 176.83 173.46 2eny s HIS 34 N -6.07 1.05 0.46 4.77 5.65 -1.26 -4.99 115.29 114.90 2eny s HIS 34 Ca -0.13 -0.70 -0.22 0.00 0.25 0.00 0.00 55.06 54.27 2eny s HIS 34 Cb 0.19 -0.57 -0.08 0.00 -1.18 0.00 0.00 32.58 30.94 2eny s HIS 34 CO 0.75 -0.01 1.10 -1.83 -0.65 0.00 0.00 174.74 174.09 2eny s GLU 35 N -2.99 3.81 0.03 2.88 -1.05 -1.26 -4.85 118.70 115.27 2eny s GLU 35 Ca 0.07 1.57 0.09 0.00 -0.15 0.00 0.00 54.97 56.55 2eny s GLU 35 Cb -0.01 -2.30 -0.03 0.00 -0.44 0.00 0.00 34.13 31.35 2eny s GLU 35 CO -0.01 -0.46 -0.26 -1.12 0.95 0.00 0.00 175.26 174.37 2eny s SER 36 N -1.64 3.07 -0.11 0.83 0.01 -1.26 -5.10 113.70 109.50 2eny s SER 36 Ca 0.64 -0.55 -0.05 0.00 1.31 0.00 0.00 55.95 57.30 2eny s SER 36 Cb -0.23 -0.30 -0.04 0.00 0.21 0.00 0.00 66.02 65.67 2eny s SER 36 CO 0.28 0.27 0.08 0.00 0.41 0.00 0.00 173.24 174.28 2eny s ALA 37 N -0.74 3.63 -1.35 1.44 0.00 -1.26 -4.41 121.76 119.07 2eny s ALA 37 Ca 0.11 -0.71 -0.10 0.00 0.00 0.00 0.00 51.96 51.26 2eny s ALA 37 Cb -0.10 -1.79 0.07 0.00 0.00 0.00 0.00 23.12 21.31 2eny s ALA 37 CO 0.01 0.58 0.55 0.43 0.00 0.00 0.00 175.76 177.32 2eny n SER 38 N 2.15 -3.99 -4.20 0.00 7.64 -1.26 -4.90 113.62 109.07 2eny n SER 38 Ca -0.19 -0.43 -0.41 0.00 1.01 0.00 0.00 58.87 58.85 2eny n SER 38 Cb 0.54 -3.28 -0.06 0.00 -1.01 0.00 0.00 64.21 60.41 2eny n SER 38 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2eny s ASP 39 N -2.78 6.10 -0.08 6.43 -4.77 -1.26 -5.05 116.67 115.25 2eny s ASP 39 Ca 0.42 -3.09 -0.30 0.00 -3.30 0.00 0.00 52.55 46.29 2eny s ASP 39 Cb -0.22 -2.01 -0.04 0.00 -1.09 0.00 0.00 42.92 39.55 2eny s ASP 39 CO 0.52 -0.38 1.51 -2.16 0.70 0.00 0.00 175.17 175.37 2eny s PRO 40 N -0.43 4.21 0.48 2.11 0.04 -1.26 -4.76 135.00 135.38 2eny s PRO 40 Ca 0.21 2.01 -0.03 0.00 0.04 0.00 0.00 61.00 63.23 2eny s PRO 40 Cb -0.13 -3.88 -0.02 0.00 0.04 0.00 0.00 34.50 30.51 2eny s PRO 40 CO -0.08 -0.78 0.75 0.00 0.04 0.00 0.00 177.00 176.93 2eny s ALA 41 N 3.72 3.52 -0.02 8.56 0.00 -1.26 -4.20 121.76 132.08 2eny s ALA 41 Ca 0.67 -0.77 -0.02 0.00 0.00 0.00 0.00 51.96 51.84 2eny s ALA 41 Cb -0.30 -2.39 0.01 0.00 0.00 0.00 0.00 23.12 20.44 2eny s ALA 41 CO 0.25 -0.42 0.06 1.41 0.00 0.00 0.00 175.76 177.05 2eny s MET 42 N -4.69 0.05 -0.13 0.00 1.75 -0.58 -5.02 119.30 110.68 2eny s MET 42 Ca 0.48 0.11 -0.02 0.00 -1.25 0.00 0.00 55.69 55.02 2eny s MET 42 Cb -0.10 -0.03 -0.02 0.00 2.84 0.00 0.00 34.83 37.51 2eny s MET 42 CO 0.42 -0.04 -0.08 -1.58 -0.65 0.00 0.00 175.02 173.08 2eny s TRP 43 N 0.28 2.93 -0.29 4.11 0.52 -1.26 -2.68 118.94 122.54 2eny s TRP 43 Ca -0.02 -0.38 -0.01 0.00 0.02 0.00 0.00 56.10 55.71 2eny s TRP 43 Cb -0.03 -1.88 0.09 0.00 -1.15 0.00 0.00 33.47 30.51 2eny s TRP 43 CO -0.01 -0.05 0.09 0.95 0.02 0.00 0.00 176.95 177.95 2eny s THR 44 N 0.18 0.78 -0.17 2.01 -4.23 -1.13 -2.33 115.64 110.75 2eny s THR 44 Ca -0.04 -1.25 -0.01 0.00 -1.18 0.00 0.00 61.69 59.20 2eny s THR 44 Cb -0.14 -1.55 -0.01 0.00 1.34 0.00 0.00 72.50 72.14 2eny s THR 44 CO 0.04 -0.62 -0.11 0.54 -0.54 0.00 0.00 174.62 173.93 2eny s VAL 45 N 1.68 3.02 0.00 2.29 0.11 -1.25 -2.64 120.40 123.60 2eny s VAL 45 Ca 0.08 -0.64 0.00 0.00 -2.93 0.00 0.00 61.98 58.49 2eny s VAL 45 Cb -0.17 -2.31 0.00 0.00 -1.53 0.00 0.00 36.38 32.37 2eny s VAL 45 CO -0.24 0.49 0.00 0.61 -3.33 0.00 0.00 175.10 172.63 2eny n GLY 46 N 4.15 2.08 0.00 6.54 0.00 -1.24 -4.05 105.19 112.66 2eny n GLY 46 Ca -0.19 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.43 2eny n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eny n GLY 47 N 0.00 0.03 3.64 -0.02 0.00 -1.26 -4.93 105.19 102.65 2eny n GLY 47 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 2eny n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eny s LYS 48 N 0.00 0.46 0.29 1.61 -2.85 -1.26 -5.15 119.74 112.84 2eny s LYS 48 Ca 0.00 0.60 -0.30 0.00 -1.00 0.00 0.00 55.97 55.27 2eny s LYS 48 Cb 0.00 0.20 -0.11 0.00 -2.06 0.00 0.00 37.83 35.86 2eny s LYS 48 CO 0.00 -0.06 1.55 0.99 0.10 0.00 0.00 175.35 177.93 2eny s THR 49 N 0.50 2.21 0.10 3.79 2.01 -1.26 -3.85 115.64 119.14 2eny s THR 49 Ca 0.00 0.18 0.09 0.00 0.31 0.00 0.00 61.69 62.28 2eny s THR 49 Cb -0.05 -3.12 -0.04 0.00 0.01 0.00 0.00 72.50 69.31 2eny s THR 49 CO -0.09 0.03 -0.24 0.68 -0.69 0.00 0.00 174.62 174.31 2eny s VAL 50 N -0.06 2.00 0.00 3.82 -7.23 -0.99 -5.00 120.40 112.94 2eny s VAL 50 Ca 0.62 -1.58 0.00 0.00 -1.81 0.00 0.00 61.98 59.20 2eny s VAL 50 Cb -0.46 -1.77 0.00 0.00 0.56 0.00 0.00 36.38 34.71 2eny s VAL 50 CO 0.48 0.08 0.00 0.61 -0.31 0.00 0.00 175.10 175.96 2eny n GLY 51 N 1.17 0.00 3.34 2.32 0.00 -1.26 -4.48 105.19 106.29 2eny n GLY 51 Ca -0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 2eny n GLY 51 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2eny s SER 52 N 0.00 5.36 0.52 1.61 1.04 -0.53 -4.89 113.70 116.81 2eny s SER 52 Ca 0.00 -0.86 0.42 0.00 0.48 0.00 0.00 55.95 55.99 2eny s SER 52 Cb 0.00 -1.92 1.44 0.00 0.10 0.00 0.00 66.02 65.64 2eny s SER 52 CO 0.00 -0.27 1.39 -0.24 0.98 0.00 0.00 173.24 175.10 2eny n SER 53 N 4.89 0.00 0.00 7.02 2.88 -1.22 -1.77 113.62 125.43 2eny n SER 53 Ca -0.13 0.87 0.00 0.00 -1.33 0.00 0.00 58.87 58.28 2eny n SER 53 Cb 0.47 -0.41 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 2eny n SER 53 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2eny n SER 54 N -3.62 0.00 -0.03 -3.46 7.64 -1.26 -4.45 113.62 108.43 2eny n SER 54 Ca 0.37 0.83 -0.07 0.00 1.01 0.00 0.00 58.87 61.01 2eny n SER 54 Cb 1.77 -0.33 -0.03 0.00 -1.01 0.00 0.00 64.21 64.62 2eny n SER 54 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2eny n ARG 55 N -2.24 0.15 -2.98 1.43 1.85 -0.76 -4.92 116.66 109.19 2eny n ARG 55 Ca 0.00 0.06 -0.44 0.00 -1.00 0.00 0.00 57.85 56.47 2eny n ARG 55 Cb 0.00 -0.87 -0.04 0.00 -1.05 0.00 0.00 32.46 30.50 2eny n ARG 55 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2eny s PHE 56 N -2.13 2.85 -0.73 2.89 0.08 -0.73 -2.81 117.98 117.41 2eny s PHE 56 Ca -0.10 -0.80 -0.07 0.00 0.12 0.00 0.00 56.93 56.09 2eny s PHE 56 Cb 0.03 -4.17 0.19 0.00 -0.57 0.00 0.00 43.02 38.50 2eny s PHE 56 CO 0.13 -1.48 0.59 -1.14 -0.10 0.00 0.00 175.22 173.22 2eny s GLN 57 N 3.34 3.01 -0.24 0.44 2.00 -1.20 -1.46 119.66 125.55 2eny s GLN 57 Ca 0.18 -2.59 -0.29 0.00 -2.00 0.00 0.00 55.36 50.66 2eny s GLN 57 Cb -0.19 -4.00 -0.03 0.00 0.80 0.00 0.00 33.01 29.59 2eny s GLN 57 CO 0.07 -1.22 1.82 0.00 -0.50 0.00 0.00 175.29 175.46 2eny s ALA 58 N -0.14 3.05 0.23 1.58 0.00 -1.26 -3.41 121.76 121.81 2eny s ALA 58 Ca 0.18 0.52 0.07 0.00 0.00 0.00 0.00 51.96 52.74 2eny s ALA 58 Cb -0.16 -3.95 -0.04 0.00 0.00 0.00 0.00 23.12 18.97 2eny s ALA 58 CO -0.06 -2.32 0.16 0.95 0.00 0.00 0.00 175.76 174.49 2eny s THR 59 N 6.32 4.37 -0.19 0.00 -4.23 -0.04 -5.03 115.64 116.85 2eny s THR 59 Ca 0.81 -1.36 -0.04 0.00 -1.18 0.00 0.00 61.69 59.93 2eny s THR 59 Cb -0.27 -3.32 0.06 0.00 1.34 0.00 0.00 72.50 70.31 2eny s THR 59 CO 0.33 -0.29 0.06 -0.60 -0.54 0.00 0.00 174.62 173.59 2eny s ARG 60 N -3.63 0.40 -0.48 3.99 3.52 -1.26 -2.51 118.95 118.98 2eny s ARG 60 Ca 0.32 -0.31 -0.05 0.00 -0.13 0.00 0.00 55.73 55.57 2eny s ARG 60 Cb -0.08 -1.97 0.13 0.00 -1.56 0.00 0.00 34.95 31.47 2eny s ARG 60 CO 0.24 -0.68 0.30 -0.65 -0.81 0.00 0.00 175.30 173.71 2eny s GLN 61 N 1.97 2.28 5.15 5.12 -1.52 0.51 -4.99 119.66 128.19 2eny s GLN 61 Ca 0.01 -1.96 0.00 0.00 -1.95 0.00 0.00 55.36 51.45 2eny s GLN 61 Cb -0.17 -3.73 0.00 0.00 -0.22 0.00 0.00 33.01 28.90 2eny s GLN 61 CO -0.10 -1.13 0.00 0.41 -0.25 0.00 0.00 175.29 174.22 2eny n GLY 62 N 4.44 2.61 2.00 3.09 0.00 -1.26 -0.23 105.19 115.83 2eny n GLY 62 Ca -0.01 0.33 -0.14 0.00 0.00 0.00 0.00 46.02 46.21 2eny n GLY 62 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2eny n ARG 63 N 6.87 2.79 -4.23 1.61 1.85 -1.26 -4.84 116.66 119.45 2eny n ARG 63 Ca 0.00 -2.72 -0.17 0.00 -1.00 0.00 0.00 57.85 53.97 2eny n ARG 63 Cb 0.00 -2.09 -0.13 0.00 -1.05 0.00 0.00 32.46 29.19 2eny n ARG 63 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 2eny s LYS 64 N -2.83 0.66 -0.11 2.89 2.20 0.68 -1.41 119.74 121.81 2eny s LYS 64 Ca 0.50 -0.52 0.00 0.00 -0.36 0.00 0.00 55.97 55.60 2eny s LYS 64 Cb 0.41 -0.59 0.02 0.00 -1.51 0.00 0.00 37.83 36.16 2eny s LYS 64 CO 0.11 0.15 -0.10 0.71 -0.36 0.00 0.00 175.35 175.85 2eny s TYR 65 N -0.66 1.66 0.05 4.03 1.51 -0.03 -0.36 117.35 123.55 2eny s TYR 65 Ca -0.01 -0.81 0.09 0.00 -1.01 0.00 0.00 57.07 55.33 2eny s TYR 65 Cb -0.06 -1.29 -0.03 0.00 -0.11 0.00 0.00 41.96 40.47 2eny s TYR 65 CO 0.00 -0.50 -0.25 0.42 -1.11 0.00 0.00 175.55 174.12 2eny s ILE 66 N 1.40 2.03 -0.34 2.71 1.09 -1.05 -0.55 121.20 126.49 2eny s ILE 66 Ca 0.00 -1.38 0.02 0.00 -1.10 0.00 0.00 60.65 58.20 2eny s ILE 66 Cb -0.13 -1.75 0.10 0.00 -1.06 0.00 0.00 42.46 39.62 2eny s ILE 66 CO -0.06 0.30 0.08 -0.22 -0.10 0.00 0.00 174.94 174.94 2eny s LEU 67 N -1.30 3.87 -0.64 2.97 2.96 0.67 -0.86 118.68 126.35 2eny s LEU 67 Ca 0.11 -2.04 -0.26 0.00 -0.22 0.00 0.00 54.13 51.72 2eny s LEU 67 Cb -0.10 -1.36 -0.04 0.00 0.50 0.00 0.00 46.19 45.19 2eny s LEU 67 CO 0.02 -0.38 2.02 -0.69 -1.32 0.00 0.00 176.35 176.00 2eny s VAL 68 N 1.07 3.27 -0.27 1.68 1.01 -1.22 -2.60 120.40 123.35 2eny s VAL 68 Ca 0.11 0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.87 2eny s VAL 68 Cb -0.19 -3.70 0.01 0.00 0.00 0.00 0.00 36.38 32.50 2eny s VAL 68 CO -0.13 -0.68 1.06 -0.69 0.00 0.00 0.00 175.10 174.66 2eny s VAL 69 N 10.21 4.60 0.15 2.92 1.01 0.16 -3.23 120.40 136.21 2eny s VAL 69 Ca 0.75 1.90 0.11 0.00 0.00 0.00 0.00 61.98 64.74 2eny s VAL 69 Cb -0.13 -4.35 -0.04 0.00 0.00 0.00 0.00 36.38 31.86 2eny s VAL 69 CO 0.18 -0.30 -0.26 -0.13 0.00 0.00 0.00 175.10 174.59 2eny s ARG 70 N 3.40 1.45 -0.99 2.72 0.52 -1.12 -1.14 118.95 123.79 2eny s ARG 70 Ca 0.45 -1.39 -0.01 0.00 -0.52 0.00 0.00 55.73 54.26 2eny s ARG 70 Cb -0.14 -1.90 0.00 0.00 0.52 0.00 0.00 34.95 33.44 2eny s ARG 70 CO 0.10 0.44 0.83 0.39 0.02 0.00 0.00 175.30 177.08 2eny n GLU 71 N 0.72 -5.51 -0.78 3.54 -0.58 -1.26 -4.72 120.64 112.04 2eny n GLU 71 Ca -0.16 0.68 -0.33 0.00 -0.42 0.00 0.00 57.16 56.93 2eny n GLU 71 Cb 0.54 -5.22 0.13 0.00 -0.57 0.00 0.00 31.44 26.31 2eny n GLU 71 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2eny n ALA 72 N -3.67 -2.60 -3.22 0.62 0.00 -1.23 -4.94 120.51 105.46 2eny n ALA 72 Ca -0.20 -0.64 -0.13 0.00 0.00 0.00 0.00 53.44 52.47 2eny n ALA 72 Cb 0.62 -1.80 -0.08 0.00 0.00 0.00 0.00 19.45 18.19 2eny n ALA 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2eny s ALA 73 N -2.40 -0.86 -0.17 0.00 0.00 -1.26 -3.98 121.76 113.09 2eny s ALA 73 Ca 0.57 0.35 0.29 0.00 0.00 0.00 0.00 51.96 53.17 2eny s ALA 73 Cb -0.21 0.13 1.20 0.00 0.00 0.00 0.00 23.12 24.24 2eny s ALA 73 CO 0.67 -0.31 1.86 -1.00 0.00 0.00 0.00 175.76 176.98 2eny h PRO 74 N 3.63 0.00 0.04 0.00 0.13 -1.91 -3.15 132.00 130.75 2eny h PRO 74 Ca -0.30 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.70 2eny h PRO 74 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 2eny h PRO 74 CO 0.41 0.00 -0.64 0.66 -0.23 0.00 0.00 178.00 178.20 2eny h SER 75 N 0.00 0.15 -0.98 1.44 4.64 -1.96 -3.33 113.55 113.50 2eny h SER 75 Ca 0.00 -0.86 0.18 0.00 -0.47 0.00 0.00 61.79 60.64 2eny h SER 75 Cb 0.43 -0.05 -0.09 0.00 -0.31 0.00 0.00 62.40 62.37 2eny h SER 75 CO 0.00 1.28 0.61 0.44 -0.87 0.00 0.00 176.83 178.29 2eny h ASP 76 N -0.77 0.72 -1.32 4.97 5.19 -1.94 -3.42 116.42 119.85 2eny h ASP 76 Ca -0.15 0.08 -0.77 0.00 -0.62 0.00 0.00 57.03 55.57 2eny h ASP 76 Cb 1.30 -0.05 0.03 0.00 0.18 0.00 0.00 39.33 40.79 2eny h ASP 76 CO -0.01 0.28 0.51 0.00 -3.12 0.00 0.00 179.24 176.91 2eny n ALA 77 N -2.37 -1.56 0.01 3.45 0.00 -1.21 -3.73 120.51 115.09 2eny n ALA 77 Ca 0.22 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.16 2eny n ALA 77 Cb 0.57 -2.00 0.00 0.00 0.00 0.00 0.00 19.45 18.03 2eny n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2eny n GLY 78 N 3.00 -2.01 3.28 0.00 0.00 -1.26 -4.97 105.19 103.23 2eny n GLY 78 Ca 0.24 0.66 0.03 0.00 0.00 0.00 0.00 46.02 46.95 2eny n GLY 78 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2eny s GLU 79 N -1.15 0.21 -0.20 1.61 2.12 -1.26 -4.67 118.70 115.36 2eny s GLU 79 Ca 0.00 0.49 -0.23 0.00 0.36 0.00 0.00 54.97 55.58 2eny s GLU 79 Cb 0.00 0.29 -0.02 0.00 0.26 0.00 0.00 34.13 34.66 2eny s GLU 79 CO 0.00 -0.11 0.76 0.08 -0.54 0.00 0.00 175.26 175.44 2eny s VAL 80 N 2.49 4.92 -0.18 3.70 1.01 0.12 -4.10 120.40 128.37 2eny s VAL 80 Ca -0.01 1.45 0.01 0.00 0.00 0.00 0.00 61.98 63.43 2eny s VAL 80 Cb -0.06 -4.06 0.02 0.00 0.00 0.00 0.00 36.38 32.28 2eny s VAL 80 CO -0.16 0.03 -0.20 -0.69 0.00 0.00 0.00 175.10 174.09 2eny s VAL 81 N 2.22 2.02 -0.33 2.92 1.01 -1.08 0.15 120.40 127.32 2eny s VAL 81 Ca 0.34 -0.92 -0.09 0.00 0.00 0.00 0.00 61.98 61.31 2eny s VAL 81 Cb -0.16 -1.83 0.02 0.00 0.00 0.00 0.00 36.38 34.41 2eny s VAL 81 CO 0.11 0.53 0.14 0.12 0.00 0.00 0.00 175.10 176.00 2eny s PHE 82 N 1.27 3.21 -0.16 5.22 5.36 -1.07 -2.82 117.98 128.99 2eny s PHE 82 Ca 0.04 -1.01 -0.02 0.00 -0.96 0.00 0.00 56.93 54.97 2eny s PHE 82 Cb -0.13 -2.34 -0.02 0.00 -0.34 0.00 0.00 43.02 40.19 2eny s PHE 82 CO -0.12 -0.62 -0.07 0.45 -1.46 0.00 0.00 175.22 173.40 2eny s SER 83 N 1.51 4.43 -0.05 6.13 0.15 -1.09 0.62 113.70 125.40 2eny s SER 83 Ca 0.02 -0.25 -0.06 0.00 0.70 0.00 0.00 55.95 56.36 2eny s SER 83 Cb -0.18 -1.71 0.01 0.00 -1.71 0.00 0.00 66.02 62.43 2eny s SER 83 CO 0.05 0.13 0.16 0.54 1.20 0.00 0.00 173.24 175.32 2eny s VAL 84 N 0.57 0.01 -0.03 4.45 0.11 -0.46 -1.52 120.40 123.54 2eny s VAL 84 Ca -0.05 -0.12 -0.00 0.00 -2.93 0.00 0.00 61.98 58.88 2eny s VAL 84 Cb -0.15 -0.27 0.00 0.00 -1.53 0.00 0.00 36.38 34.44 2eny s VAL 84 CO 0.03 -0.07 0.01 -2.11 -3.33 0.00 0.00 175.10 169.63 2eny n ARG 85 N 2.73 -2.57 0.00 1.54 1.85 -1.26 0.12 116.66 119.07 2eny n ARG 85 Ca -0.14 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.71 2eny n ARG 85 Cb 0.58 -3.63 0.00 0.00 -1.05 0.00 0.00 32.46 28.36 2eny n ARG 85 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2eny n GLY 86 N -0.41 3.12 3.20 2.89 0.00 -1.26 -5.06 105.19 107.66 2eny n GLY 86 Ca 0.00 -0.85 -0.35 0.00 0.00 0.00 0.00 46.02 44.83 2eny n GLY 86 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2eny n LEU 87 N 0.00 -2.94 -3.72 0.99 4.77 0.33 -4.98 117.00 111.44 2eny n LEU 87 Ca 0.00 0.17 -0.12 0.00 -0.03 0.00 0.00 56.01 56.04 2eny n LEU 87 Cb 0.00 -0.93 -0.11 0.00 -2.33 0.00 0.00 43.42 40.05 2eny n LEU 87 CO 0.00 -4.30 0.02 -0.89 -1.33 0.00 0.00 177.39 170.89 2eny s THR 88 N -2.18 -0.02 0.45 -5.08 2.01 -1.25 -1.35 115.64 108.22 2eny s THR 88 Ca 0.48 0.07 0.05 0.00 0.31 0.00 0.00 61.69 62.60 2eny s THR 88 Cb -0.15 -0.54 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 2eny s THR 88 CO 0.73 0.03 0.12 -0.55 -0.69 0.00 0.00 174.62 174.25 2eny s SER 89 N 0.92 4.23 -0.03 3.53 0.15 0.20 -4.91 113.70 117.79 2eny s SER 89 Ca -0.06 -1.33 -0.11 0.00 0.70 0.00 0.00 55.95 55.16 2eny s SER 89 Cb -0.06 -0.09 0.02 0.00 -1.71 0.00 0.00 66.02 64.18 2eny s SER 89 CO -0.07 -0.67 0.24 -0.54 1.20 0.00 0.00 173.24 173.40 2eny s LYS 90 N -3.89 0.52 0.21 5.44 3.01 -1.25 -2.61 119.74 121.17 2eny s LYS 90 Ca 0.29 -0.14 -0.23 0.00 -1.01 0.00 0.00 55.97 54.89 2eny s LYS 90 Cb 0.04 0.23 0.04 0.00 -1.01 0.00 0.00 37.83 37.13 2eny s LYS 90 CO 0.16 -0.13 0.81 0.00 0.51 0.00 0.00 175.35 176.70 2eny s ALA 91 N -1.01 -1.43 -0.05 5.17 0.00 0.12 -4.63 121.76 119.93 2eny s ALA 91 Ca -0.11 -0.03 0.04 0.00 0.00 0.00 0.00 51.96 51.86 2eny s ALA 91 Cb -0.05 0.76 -0.02 0.00 0.00 0.00 0.00 23.12 23.80 2eny s ALA 91 CO 0.02 -1.01 -0.15 -1.12 0.00 0.00 0.00 175.76 173.51 2eny s SER 92 N -2.90 3.95 -0.51 0.00 0.01 -1.26 0.14 113.70 113.12 2eny s SER 92 Ca 0.10 -0.22 0.04 0.00 1.31 0.00 0.00 55.95 57.18 2eny s SER 92 Cb -0.04 -0.84 0.13 0.00 0.21 0.00 0.00 66.02 65.48 2eny s SER 92 CO 0.03 0.34 0.25 -0.22 0.41 0.00 0.00 173.24 174.05 2eny s LEU 93 N -0.67 4.24 -0.18 2.44 2.96 -1.26 -3.07 118.68 123.13 2eny s LEU 93 Ca 0.10 -2.98 -0.29 0.00 -0.22 0.00 0.00 54.13 50.74 2eny s LEU 93 Cb -0.11 -1.61 -0.01 0.00 0.50 0.00 0.00 46.19 44.96 2eny s LEU 93 CO 0.01 -0.23 1.30 -0.63 -1.32 0.00 0.00 176.35 175.47 2eny s ILE 94 N -0.24 4.20 -0.27 6.68 1.01 -1.01 -4.22 121.20 127.35 2eny s ILE 94 Ca 0.17 1.43 0.00 0.00 0.00 0.00 0.00 60.65 62.26 2eny s ILE 94 Cb -0.26 -3.98 0.08 0.00 0.01 0.00 0.00 42.46 38.31 2eny s ILE 94 CO -0.00 -0.19 0.01 -0.69 0.00 0.00 0.00 174.94 174.07 2eny s VAL 95 N 3.72 1.36 0.30 2.92 1.01 -1.26 -2.44 120.40 126.02 2eny s VAL 95 Ca 0.57 -1.36 -0.16 0.00 0.00 0.00 0.00 61.98 61.02 2eny s VAL 95 Cb -0.22 -1.81 -0.09 0.00 0.00 0.00 0.00 36.38 34.26 2eny s VAL 95 CO 0.17 -0.34 0.74 -0.13 0.00 0.00 0.00 175.10 175.55 2eny s ARG 96 N 1.43 4.07 0.06 2.72 1.81 -1.14 -4.60 118.95 123.30 2eny s ARG 96 Ca 0.01 0.73 -0.18 0.00 -1.72 0.00 0.00 55.73 54.57 2eny s ARG 96 Cb -0.18 -2.52 -0.06 0.00 -0.45 0.00 0.00 34.95 31.73 2eny s ARG 96 CO -0.11 0.20 0.53 -2.00 -0.68 0.00 0.00 175.30 173.24 2eny s GLU 97 N -2.76 4.13 -0.66 3.54 2.12 -1.26 0.46 118.70 124.27 2eny s GLU 97 Ca 0.52 0.66 -0.22 0.00 0.36 0.00 0.00 54.97 56.29 2eny s GLU 97 Cb -0.12 -3.23 0.08 0.00 0.26 0.00 0.00 34.13 31.13 2eny s GLU 97 CO 0.18 0.65 0.93 0.50 -0.54 0.00 0.00 175.26 176.98 2eny s ARG 98 N -1.13 3.12 -0.21 4.30 3.52 -1.26 -4.84 118.95 122.45 2eny s ARG 98 Ca 0.28 -0.95 -0.14 0.00 -0.13 0.00 0.00 55.73 54.79 2eny s ARG 98 Cb -0.19 -4.26 -0.19 0.00 -1.56 0.00 0.00 34.95 28.75 2eny s ARG 98 CO 0.18 -1.77 0.06 0.43 -0.81 0.00 0.00 175.30 173.38 2eny n SER 99 N 7.45 1.96 0.00 -2.12 7.64 -1.26 -5.09 113.62 122.20 2eny n SER 99 Ca -0.04 0.29 0.00 0.00 1.01 0.00 0.00 58.87 60.13 2eny n SER 99 Cb 0.45 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 2eny n SER 99 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eny n GLY 100 N 1.61 -1.51 3.64 0.23 0.00 -1.26 -5.11 105.19 102.79 2eny n GLY 100 Ca -0.39 0.60 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 2eny n GLY 100 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eny s PRO 101 N 0.00 3.92 0.05 1.61 0.04 -1.26 -5.01 135.00 134.35 2eny s PRO 101 Ca 0.00 1.77 0.07 0.00 0.04 0.00 0.00 61.00 62.88 2eny s PRO 101 Cb 0.00 -4.00 -0.03 0.00 0.04 0.00 0.00 34.50 30.52 2eny s PRO 101 CO 0.00 -1.14 -0.21 -1.12 0.04 0.00 0.00 177.00 174.57 2eny s SER 102 N 3.80 2.50 0.07 6.66 0.01 -1.26 -5.15 113.70 120.33 2eny s SER 102 Ca 0.70 -0.53 0.01 0.00 1.31 0.00 0.00 55.95 57.44 2eny s SER 102 Cb -0.26 -0.20 -0.04 0.00 0.21 0.00 0.00 66.02 65.73 2eny s SER 102 CO 0.28 0.16 -0.06 -0.44 0.41 0.00 0.00 173.24 173.58 2eny s SER 103 N -1.22 0.89 0.00 2.44 0.01 -1.26 -5.26 113.70 109.30 2eny s SER 103 Ca 0.07 -0.86 0.00 0.00 1.31 0.00 0.00 55.95 56.48 2eny s SER 103 Cb -0.09 0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.24 2eny s SER 103 CO 0.02 -0.41 0.00 0.61 0.41 0.00 0.00 173.24 173.87