#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eny h SER 2 N 0.00 0.58 -3.55 1.61 0.02 -1.98 -3.39 113.55 106.85 2eny h SER 2 Ca 0.00 -0.68 -0.61 0.00 -0.84 0.00 0.00 61.79 59.66 2eny h SER 2 Cb 0.00 -0.17 -0.12 0.00 0.14 0.00 0.00 62.40 62.24 2eny h SER 2 CO 0.00 1.17 -0.06 -0.44 -1.14 0.00 0.00 176.83 176.36 2eny s SER 3 N -6.69 6.46 0.00 3.07 0.01 -1.26 -4.41 113.70 110.88 2eny s SER 3 Ca -0.13 0.55 0.00 0.00 1.31 0.00 0.00 55.95 57.68 2eny s SER 3 Cb 0.05 -2.27 0.00 0.00 0.21 0.00 0.00 66.02 64.00 2eny s SER 3 CO 0.82 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.86 2eny n GLY 4 N 4.22 2.62 3.51 3.44 0.00 -1.26 -5.04 105.19 112.68 2eny n GLY 4 Ca -0.05 -0.77 -0.11 0.00 0.00 0.00 0.00 46.02 45.09 2eny n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eny s SER 5 N 0.00 -0.43 -1.08 1.61 0.15 -1.26 -5.10 113.70 107.59 2eny s SER 5 Ca 0.00 0.17 -0.10 0.00 0.70 0.00 0.00 55.95 56.72 2eny s SER 5 Cb 0.00 0.42 0.26 0.00 -1.71 0.00 0.00 66.02 64.99 2eny s SER 5 CO 0.00 -0.61 1.09 -0.55 1.20 0.00 0.00 173.24 174.37 2eny s SER 6 N -2.08 7.21 0.18 5.45 0.15 -1.26 -4.56 113.70 118.79 2eny s SER 6 Ca 0.01 -3.39 0.11 0.00 0.70 0.00 0.00 55.95 53.39 2eny s SER 6 Cb -0.01 -2.23 -0.04 0.00 -1.71 0.00 0.00 66.02 62.03 2eny s SER 6 CO -0.05 -0.38 -0.25 -0.83 1.20 0.00 0.00 173.24 172.93 2eny s GLY 7 N 1.62 1.68 -0.11 9.45 0.00 -1.26 -5.13 107.32 113.56 2eny s GLY 7 Ca 0.30 -1.60 -0.07 0.00 0.00 0.00 0.00 44.72 43.35 2eny s GLY 7 CO -0.07 -1.62 0.15 -2.38 0.00 0.00 0.00 173.10 169.18 2eny s HIS 8 N -1.53 3.61 0.29 1.90 0.00 -1.26 -4.83 115.29 113.46 2eny s HIS 8 Ca 0.19 0.55 -0.01 0.00 -3.00 0.00 0.00 55.06 52.79 2eny s HIS 8 Cb -0.08 -1.96 -0.02 0.00 -4.00 0.00 0.00 32.58 26.52 2eny s HIS 8 CO 0.09 0.73 0.34 0.54 -1.00 0.00 0.00 174.74 175.45 2eny s VAL 9 N -1.04 0.00 -0.56 -5.38 0.11 -1.26 -5.13 120.40 107.14 2eny s VAL 9 Ca 0.16 -1.76 0.00 0.00 -2.93 0.00 0.00 61.98 57.44 2eny s VAL 9 Cb -0.12 -2.50 0.00 0.00 -1.53 0.00 0.00 36.38 32.22 2eny s VAL 9 CO 0.05 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.43 2eny n GLY 10 N -0.48 -0.73 3.52 6.54 0.00 -1.26 -5.10 105.19 107.69 2eny n GLY 10 Ca 0.02 -0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.30 2eny n GLY 10 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2eny s ILE 11 N -3.76 4.43 -0.12 -0.61 1.01 -1.26 -1.70 121.20 119.19 2eny s ILE 11 Ca 0.00 -0.15 0.15 0.00 0.00 0.00 0.00 60.65 60.66 2eny s ILE 11 Cb 0.00 -3.02 -0.24 0.00 0.01 0.00 0.00 42.46 39.21 2eny s ILE 11 CO 0.00 0.41 0.40 1.07 0.00 0.00 0.00 174.94 176.82 2eny n THR 12 N 4.19 1.48 -3.47 2.92 5.66 -1.23 -4.59 114.28 119.25 2eny n THR 12 Ca -0.16 -0.82 -0.33 0.00 -3.05 0.00 0.00 64.05 59.69 2eny n THR 12 Cb 0.52 -0.76 -0.06 0.00 -1.55 0.00 0.00 70.33 68.48 2eny n THR 12 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 2eny n LYS 13 N -2.90 2.87 -1.76 1.09 3.00 -1.13 -5.06 118.16 114.26 2eny n LYS 13 Ca -0.24 -4.57 -0.38 0.00 -0.00 0.00 0.00 58.31 53.12 2eny n LYS 13 Cb 1.09 -2.36 0.04 0.00 0.00 0.00 0.00 35.03 33.80 2eny n LYS 13 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 2eny s ARG 14 N -2.09 3.09 0.20 1.64 1.70 -1.26 -3.60 118.95 118.63 2eny s ARG 14 Ca 0.33 2.25 -0.31 0.00 -0.47 0.00 0.00 55.73 57.52 2eny s ARG 14 Cb 0.04 -2.23 -0.15 0.00 -0.57 0.00 0.00 34.95 32.03 2eny s ARG 14 CO -0.04 -1.24 1.10 1.28 -1.08 0.00 0.00 175.30 175.32 2eny n LEU 15 N -1.09 1.45 -4.75 -1.89 4.77 -1.26 -4.96 117.00 109.27 2eny n LEU 15 Ca 0.11 1.15 -0.35 0.00 -0.03 0.00 0.00 56.01 56.88 2eny n LEU 15 Cb 0.45 -1.22 -0.08 0.00 -2.33 0.00 0.00 43.42 40.24 2eny n LEU 15 CO 0.53 -1.40 -0.26 -0.75 -1.33 0.00 0.00 177.39 174.17 2eny s LYS 16 N -0.68 3.13 0.32 3.23 2.20 -1.26 -4.65 119.74 122.02 2eny s LYS 16 Ca 0.69 -0.33 -0.29 0.00 -0.36 0.00 0.00 55.97 55.68 2eny s LYS 16 Cb -0.82 -2.92 -0.12 0.00 -1.51 0.00 0.00 37.83 32.46 2eny s LYS 16 CO 0.54 0.72 1.54 2.41 -0.36 0.00 0.00 175.35 180.20 2eny n THR 17 N 1.99 1.36 -4.45 3.43 -1.04 -1.26 -4.81 114.28 109.49 2eny n THR 17 Ca -0.18 -0.34 -0.26 0.00 -2.04 0.00 0.00 64.05 61.22 2eny n THR 17 Cb 0.54 -1.92 -0.13 0.00 -1.82 0.00 0.00 70.33 67.00 2eny n THR 17 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 2eny s MET 18 N -1.05 1.32 -0.19 -2.82 -1.94 -1.19 -5.02 119.30 108.40 2eny s MET 18 Ca 0.61 -1.16 0.01 0.00 -1.71 0.00 0.00 55.69 53.44 2eny s MET 18 Cb -0.50 -1.61 0.03 0.00 2.01 0.00 0.00 34.83 34.76 2eny s MET 18 CO 0.54 0.39 -0.15 -1.21 -0.01 0.00 0.00 175.02 174.58 2eny s GLU 19 N -1.73 2.51 0.20 2.03 8.01 -1.26 -1.58 118.70 126.88 2eny s GLU 19 Ca 0.09 -0.89 0.03 0.00 0.01 0.00 0.00 54.97 54.21 2eny s GLU 19 Cb -0.10 -2.52 -0.01 0.00 -4.31 0.00 0.00 34.13 27.19 2eny s GLU 19 CO 0.04 -0.33 0.11 1.33 0.01 0.00 0.00 175.26 176.41 2eny n VAL 20 N 4.62 0.00 -4.23 2.63 0.24 -1.02 -5.03 118.33 115.54 2eny n VAL 20 Ca -0.18 -1.27 -0.30 0.00 -2.04 0.00 0.00 64.34 60.55 2eny n VAL 20 Cb 0.48 0.53 -0.09 0.00 -1.47 0.00 0.00 33.84 33.29 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 3.27 -0.01 1.34 2.96 -1.26 -2.86 118.68 122.11 2eny s LEU 21 Ca 0.15 -0.24 -0.37 0.00 -0.22 0.00 0.00 54.13 53.46 2eny s LEU 21 Cb 0.01 -2.00 -0.15 0.00 0.50 0.00 0.00 46.19 44.55 2eny s LEU 21 CO 0.11 0.20 1.57 1.21 -1.32 0.00 0.00 176.35 178.11 2eny n GLU 22 N 0.82 1.50 0.00 1.98 2.13 -0.02 -1.46 120.64 125.59 2eny n GLU 22 Ca -0.13 0.55 0.00 0.00 0.66 0.00 0.00 57.16 58.24 2eny n GLU 22 Cb 0.52 -2.25 0.00 0.00 0.27 0.00 0.00 31.44 29.98 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 3.39 2.93 3.06 8.31 0.00 0.32 -4.71 105.19 118.49 2eny n GLY 23 Ca 0.21 -0.77 -0.21 0.00 0.00 0.00 0.00 46.02 45.25 2eny n GLY 23 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2eny n GLU 24 N 0.00 -2.15 -4.97 1.61 -0.58 -0.54 -4.15 120.64 109.87 2eny n GLU 24 Ca 0.00 -0.63 -0.30 0.00 -0.42 0.00 0.00 57.16 55.81 2eny n GLU 24 Cb 0.00 -1.50 -0.15 0.00 -0.57 0.00 0.00 31.44 29.22 2eny n GLU 24 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2eny s SER 25 N -1.94 3.12 0.00 1.62 1.04 -1.26 -3.04 113.70 113.24 2eny s SER 25 Ca 0.39 -0.57 0.03 0.00 0.48 0.00 0.00 55.95 56.29 2eny s SER 25 Cb -0.06 -0.29 -0.01 0.00 0.10 0.00 0.00 66.02 65.75 2eny s SER 25 CO 0.40 0.27 -0.10 0.00 0.98 0.00 0.00 173.24 174.78 2eny s SER 27 N -0.49 4.24 0.35 0.00 1.04 -1.26 -0.55 113.70 117.03 2eny s SER 27 Ca 0.02 -0.26 0.07 0.00 0.48 0.00 0.00 55.95 56.26 2eny s SER 27 Cb -0.05 -1.62 -0.02 0.00 0.10 0.00 0.00 66.02 64.43 2eny s SER 27 CO -0.00 0.18 0.35 -0.36 0.98 0.00 0.00 173.24 174.39 2eny s PHE 28 N 0.29 2.90 -0.11 5.02 0.08 -1.20 -4.96 117.98 120.00 2eny s PHE 28 Ca -0.08 -0.32 -0.09 0.00 0.12 0.00 0.00 56.93 56.56 2eny s PHE 28 Cb -0.15 -1.92 0.04 0.00 -0.57 0.00 0.00 43.02 40.42 2eny s PHE 28 CO 0.05 0.07 0.29 -1.21 -0.10 0.00 0.00 175.22 174.32 2eny s GLU 29 N -4.06 0.31 -0.16 0.44 2.02 -1.26 -3.06 118.70 112.93 2eny s GLU 29 Ca 0.43 0.48 -0.04 0.00 0.02 0.00 0.00 54.97 55.87 2eny s GLU 29 Cb -0.06 0.07 0.05 0.00 0.10 0.00 0.00 34.13 34.29 2eny s GLU 29 CO 0.28 -0.09 0.06 0.00 0.02 0.00 0.00 175.26 175.54 2eny s VAL 31 N 2.04 5.34 -0.01 0.00 1.01 -1.24 -2.66 120.40 124.89 2eny s VAL 31 Ca 0.02 0.24 -0.14 0.00 0.00 0.00 0.00 61.98 62.10 2eny s VAL 31 Cb -0.16 -3.53 -0.06 0.00 0.00 0.00 0.00 36.38 32.64 2eny s VAL 31 CO -0.08 0.33 0.39 -0.76 0.00 0.00 0.00 175.10 174.98 2eny s LEU 32 N 1.11 4.46 0.26 3.92 1.43 -1.18 -2.86 118.68 125.83 2eny s LEU 32 Ca 0.09 0.92 -0.03 0.00 -1.03 0.00 0.00 54.13 54.07 2eny s LEU 32 Cb -0.14 -2.56 0.56 0.00 0.03 0.00 0.00 46.19 44.07 2eny s LEU 32 CO 0.05 0.32 1.64 -1.28 0.23 0.00 0.00 176.35 177.31 2eny h SER 33 N 4.67 -0.20 -0.88 2.29 0.87 -1.67 -3.42 113.55 115.22 2eny h SER 33 Ca -0.52 0.20 -0.49 0.00 -1.23 0.00 0.00 61.79 59.75 2eny h SER 33 Cb 1.22 0.31 0.01 0.00 -0.44 0.00 0.00 62.40 63.51 2eny h SER 33 CO 0.61 -0.17 -0.16 -1.00 -0.53 0.00 0.00 176.83 175.59 2eny s HIS 34 N -6.04 1.68 -0.16 2.24 3.76 -1.26 -5.05 115.29 110.46 2eny s HIS 34 Ca -0.13 -0.69 -0.18 0.00 -0.15 0.00 0.00 55.06 53.91 2eny s HIS 34 Cb 0.24 -2.19 -0.04 0.00 1.11 0.00 0.00 32.58 31.70 2eny s HIS 34 CO 0.76 -0.92 0.48 -1.21 -0.85 0.00 0.00 174.74 173.01 2eny s GLU 35 N -4.55 4.27 -0.34 1.40 2.02 -1.26 -4.86 118.70 115.39 2eny s GLU 35 Ca 0.56 0.41 -0.09 0.00 0.02 0.00 0.00 54.97 55.87 2eny s GLU 35 Cb -0.06 -3.49 0.02 0.00 0.10 0.00 0.00 34.13 30.70 2eny s GLU 35 CO 0.35 0.03 0.15 -1.54 0.02 0.00 0.00 175.26 174.27 2eny s SER 36 N 0.85 5.49 0.09 -0.19 1.04 -1.26 -4.87 113.70 114.85 2eny s SER 36 Ca 0.25 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.84 2eny s SER 36 Cb -0.15 -1.96 0.00 0.00 0.10 0.00 0.00 66.02 64.01 2eny s SER 36 CO 0.10 -0.29 0.00 0.00 0.98 0.00 0.00 173.24 174.03 2eny n ALA 37 N 4.94 3.00 -1.23 5.32 0.00 -1.26 -4.85 120.51 126.42 2eny n ALA 37 Ca -0.13 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.10 2eny n ALA 37 Cb 0.47 0.15 -0.05 0.00 0.00 0.00 0.00 19.45 20.02 2eny n ALA 37 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2eny n SER 38 N -3.02 6.22 -3.68 0.00 2.88 -1.26 -4.82 113.62 109.94 2eny n SER 38 Ca 0.00 -3.02 -0.11 0.00 -1.33 0.00 0.00 58.87 54.41 2eny n SER 38 Cb 0.11 -1.22 -0.09 0.00 -0.75 0.00 0.00 64.21 62.27 2eny n SER 38 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2eny s ASP 39 N 0.65 -0.62 0.88 -3.46 1.01 -1.26 -5.11 116.67 108.75 2eny s ASP 39 Ca 0.51 1.12 -0.11 0.00 0.71 0.00 0.00 52.55 54.78 2eny s ASP 39 Cb 0.32 1.07 0.12 0.00 1.01 0.00 0.00 42.92 45.44 2eny s ASP 39 CO -0.13 -0.20 1.09 -2.16 0.21 0.00 0.00 175.17 173.99 2eny s PRO 40 N 0.83 1.38 -0.10 8.23 0.04 -1.26 -4.86 135.00 139.26 2eny s PRO 40 Ca -0.04 0.87 0.01 0.00 0.04 0.00 0.00 61.00 61.87 2eny s PRO 40 Cb -0.05 -1.82 0.02 0.00 0.04 0.00 0.00 34.50 32.69 2eny s PRO 40 CO -0.07 -2.17 -0.10 0.00 0.04 0.00 0.00 177.00 174.71 2eny s ALA 41 N -2.93 1.32 -0.59 8.56 0.00 -1.26 -3.60 121.76 123.26 2eny s ALA 41 Ca 0.63 -0.51 -0.06 0.00 0.00 0.00 0.00 51.96 52.02 2eny s ALA 41 Cb -0.18 -0.79 0.15 0.00 0.00 0.00 0.00 23.12 22.31 2eny s ALA 41 CO 0.57 -0.22 0.44 1.41 0.00 0.00 0.00 175.76 177.96 2eny s MET 42 N 1.31 2.64 -0.04 0.00 1.75 0.87 -5.03 119.30 120.80 2eny s MET 42 Ca -0.02 -2.23 -0.29 0.00 -1.25 0.00 0.00 55.69 51.89 2eny s MET 42 Cb -0.14 -3.88 -0.03 0.00 2.84 0.00 0.00 34.83 33.63 2eny s MET 42 CO -0.04 -1.19 0.96 -1.58 -0.65 0.00 0.00 175.02 172.52 2eny s TRP 43 N 0.49 3.61 -0.27 4.11 0.52 -1.26 -1.23 118.94 124.91 2eny s TRP 43 Ca 0.13 1.62 -0.01 0.00 0.02 0.00 0.00 56.10 57.86 2eny s TRP 43 Cb -0.20 -3.11 0.09 0.00 -1.15 0.00 0.00 33.47 29.09 2eny s TRP 43 CO -0.04 -0.06 0.07 0.95 0.02 0.00 0.00 176.95 177.89 2eny s THR 44 N 1.26 0.76 -0.32 2.01 -4.23 0.19 -2.46 115.64 112.86 2eny s THR 44 Ca 0.50 -1.11 -0.06 0.00 -1.18 0.00 0.00 61.69 59.84 2eny s THR 44 Cb -0.20 -1.45 0.03 0.00 1.34 0.00 0.00 72.50 72.22 2eny s THR 44 CO 0.24 -0.51 0.08 0.54 -0.54 0.00 0.00 174.62 174.44 2eny s VAL 45 N 1.70 3.78 0.00 2.29 0.11 -1.23 0.32 120.40 127.37 2eny s VAL 45 Ca 0.06 -0.98 0.00 0.00 -2.93 0.00 0.00 61.98 58.13 2eny s VAL 45 Cb -0.17 -3.06 0.00 0.00 -1.53 0.00 0.00 36.38 31.61 2eny s VAL 45 CO -0.20 -0.07 0.00 0.61 -3.33 0.00 0.00 175.10 172.12 2eny n GLY 46 N 4.82 2.23 0.00 6.54 0.00 -1.23 -4.01 105.19 113.54 2eny n GLY 46 Ca -0.13 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.54 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 0.09 3.27 -0.02 0.00 -1.26 -4.86 105.19 102.42 2eny n GLY 47 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2eny n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eny s LYS 48 N 0.00 0.80 -0.27 1.61 1.02 -1.26 -5.13 119.74 116.51 2eny s LYS 48 Ca 0.00 -0.34 -0.29 0.00 0.02 0.00 0.00 55.97 55.36 2eny s LYS 48 Cb 0.00 0.35 0.01 0.00 -0.52 0.00 0.00 37.83 37.67 2eny s LYS 48 CO 0.00 -0.25 1.16 0.99 -0.92 0.00 0.00 175.35 176.32 2eny s THR 49 N -2.10 4.41 0.39 2.17 2.01 -1.26 -3.57 115.64 117.69 2eny s THR 49 Ca -0.08 1.65 0.08 0.00 0.31 0.00 0.00 61.69 63.65 2eny s THR 49 Cb -0.02 -4.26 -0.05 0.00 0.01 0.00 0.00 72.50 68.17 2eny s THR 49 CO -0.00 -0.37 0.13 0.68 -0.69 0.00 0.00 174.62 174.37 2eny s VAL 50 N 3.72 2.43 0.00 3.82 -7.23 -1.03 -4.93 120.40 117.18 2eny s VAL 50 Ca 0.49 -1.78 0.00 0.00 -1.81 0.00 0.00 61.98 58.89 2eny s VAL 50 Cb -0.15 -2.95 0.00 0.00 0.56 0.00 0.00 36.38 33.83 2eny s VAL 50 CO 0.15 -0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.49 2eny n GLY 51 N -1.15 1.48 3.52 2.32 0.00 -1.26 -4.46 105.19 105.64 2eny n GLY 51 Ca -0.02 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 2eny n GLY 51 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2eny n SER 52 N 0.00 -0.05 -1.53 1.61 7.64 -1.26 -4.22 113.62 115.82 2eny n SER 52 Ca 0.00 0.93 -0.08 0.00 1.01 0.00 0.00 58.87 60.73 2eny n SER 52 Cb 0.00 -1.22 0.04 0.00 -1.01 0.00 0.00 64.21 62.02 2eny n SER 52 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2eny n SER 53 N 0.81 4.49 -0.01 6.43 3.41 -1.26 -2.66 113.62 124.84 2eny n SER 53 Ca 0.11 -2.62 -0.01 0.00 -0.26 0.00 0.00 58.87 56.09 2eny n SER 53 Cb 0.40 -0.82 -0.01 0.00 -0.26 0.00 0.00 64.21 63.52 2eny n SER 53 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2eny n SER 54 N 0.38 4.46 0.00 4.04 7.64 -1.26 -4.88 113.62 123.99 2eny n SER 54 Ca 0.18 -0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.05 2eny n SER 54 Cb 0.71 0.43 0.00 0.00 -1.01 0.00 0.00 64.21 64.33 2eny n SER 54 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2eny n ARG 55 N -2.16 0.00 -3.84 1.43 5.12 -1.23 -5.00 116.66 110.97 2eny n ARG 55 Ca -0.03 0.00 -0.27 0.00 -1.93 0.00 0.00 57.85 55.62 2eny n ARG 55 Cb 0.55 -0.85 -0.17 0.00 -1.16 0.00 0.00 32.46 30.83 2eny n ARG 55 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 2eny s PHE 56 N -1.98 1.42 -1.14 -1.55 0.40 -1.09 -2.32 117.98 111.72 2eny s PHE 56 Ca 0.00 -0.91 -0.16 0.00 -0.60 0.00 0.00 56.93 55.26 2eny s PHE 56 Cb 0.00 -1.18 0.15 0.00 0.51 0.00 0.00 43.02 42.49 2eny s PHE 56 CO 0.00 -0.58 1.39 -1.14 0.70 0.00 0.00 175.22 175.59 2eny s GLN 57 N 1.73 3.95 -0.47 0.44 2.00 -1.22 -3.99 119.66 122.10 2eny s GLN 57 Ca 0.01 -2.28 -0.28 0.00 -2.00 0.00 0.00 55.36 50.80 2eny s GLN 57 Cb -0.15 -5.08 0.01 0.00 0.80 0.00 0.00 33.01 28.59 2eny s GLN 57 CO -0.07 -1.83 1.42 0.00 -0.50 0.00 0.00 175.29 174.31 2eny s ALA 58 N 2.20 2.94 0.30 1.58 0.00 -1.26 -3.72 121.76 123.80 2eny s ALA 58 Ca 0.41 -0.34 0.08 0.00 0.00 0.00 0.00 51.96 52.12 2eny s ALA 58 Cb -0.03 -4.00 -0.04 0.00 0.00 0.00 0.00 23.12 19.05 2eny s ALA 58 CO -0.02 -2.61 0.14 0.95 0.00 0.00 0.00 175.76 174.22 2eny s THR 59 N 5.74 3.52 -0.23 0.00 -4.23 -0.96 -5.02 115.64 114.46 2eny s THR 59 Ca 0.59 -1.64 0.01 0.00 -1.18 0.00 0.00 61.69 59.47 2eny s THR 59 Cb -0.13 -3.07 0.06 0.00 1.34 0.00 0.00 72.50 70.70 2eny s THR 59 CO 0.30 -0.27 -0.06 -0.60 -0.54 0.00 0.00 174.62 173.45 2eny s ARG 60 N -3.82 1.72 -0.37 3.99 3.52 -1.26 -3.35 118.95 119.38 2eny s ARG 60 Ca 0.36 -0.99 0.01 0.00 -0.13 0.00 0.00 55.73 54.97 2eny s ARG 60 Cb -0.05 -2.58 0.11 0.00 -1.56 0.00 0.00 34.95 30.86 2eny s ARG 60 CO 0.23 -0.57 0.12 -1.14 -0.81 0.00 0.00 175.30 173.13 2eny s GLN 61 N 1.37 1.72 2.33 5.12 2.00 -0.05 -5.02 119.66 127.13 2eny s GLN 61 Ca -0.05 -1.86 0.00 0.00 -2.00 0.00 0.00 55.36 51.44 2eny s GLN 61 Cb -0.19 -3.38 0.00 0.00 0.80 0.00 0.00 33.01 30.25 2eny s GLN 61 CO -0.06 -1.00 0.00 0.41 -0.50 0.00 0.00 175.29 174.14 2eny n GLY 62 N 4.39 1.87 1.87 2.59 0.00 -1.26 0.64 105.19 115.30 2eny n GLY 62 Ca 0.01 0.49 -0.20 0.00 0.00 0.00 0.00 46.02 46.32 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 2.30 2.33 -3.81 1.61 1.85 -1.26 -4.24 116.66 115.44 2eny n ARG 63 Ca 0.00 -3.24 -0.13 0.00 -1.00 0.00 0.00 57.85 53.48 2eny n ARG 63 Cb 0.00 -2.09 -0.12 0.00 -1.05 0.00 0.00 32.46 29.20 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 -3.43 0.21 0.23 2.89 2.20 0.21 -3.11 119.74 118.95 2eny s LYS 64 Ca 0.54 0.26 0.10 0.00 -0.36 0.00 0.00 55.97 56.51 2eny s LYS 64 Cb 0.46 0.10 -0.04 0.00 -1.51 0.00 0.00 37.83 36.83 2eny s LYS 64 CO 0.04 -0.03 -0.08 0.71 -0.36 0.00 0.00 175.35 175.63 2eny s TYR 65 N 0.13 2.60 -0.09 4.03 1.51 -1.09 -0.87 117.35 123.58 2eny s TYR 65 Ca -0.00 -0.24 -0.03 0.00 -1.01 0.00 0.00 57.07 55.78 2eny s TYR 65 Cb -0.02 -1.20 0.05 0.00 -0.11 0.00 0.00 41.96 40.69 2eny s TYR 65 CO 0.00 0.59 0.16 0.42 -1.11 0.00 0.00 175.55 175.62 2eny s ILE 66 N -2.10 -0.26 -0.54 2.71 1.09 -1.21 -3.22 121.20 117.66 2eny s ILE 66 Ca 0.28 0.35 -0.01 0.00 -1.10 0.00 0.00 60.65 60.17 2eny s ILE 66 Cb -0.07 -0.30 0.14 0.00 -1.06 0.00 0.00 42.46 41.17 2eny s ILE 66 CO 0.17 0.15 0.34 -0.22 -0.10 0.00 0.00 174.94 175.27 2eny s LEU 67 N 2.28 5.04 -0.62 2.97 2.96 -1.17 -2.27 118.68 127.86 2eny s LEU 67 Ca 0.03 -2.67 -0.26 0.00 -0.22 0.00 0.00 54.13 51.00 2eny s LEU 67 Cb -0.12 -1.80 -0.03 0.00 0.50 0.00 0.00 46.19 44.74 2eny s LEU 67 CO -0.06 -0.38 1.95 -0.69 -1.32 0.00 0.00 176.35 175.85 2eny s VAL 68 N 0.20 3.31 -0.86 1.68 1.01 -1.24 -3.24 120.40 121.25 2eny s VAL 68 Ca 0.15 0.12 -0.25 0.00 0.00 0.00 0.00 61.98 62.00 2eny s VAL 68 Cb -0.22 -3.80 0.04 0.00 0.00 0.00 0.00 36.38 32.40 2eny s VAL 68 CO -0.03 -0.78 1.35 -0.69 0.00 0.00 0.00 175.10 174.95 2eny s VAL 69 N 9.69 3.82 -1.95 2.92 1.01 0.29 -3.39 120.40 132.80 2eny s VAL 69 Ca 0.72 -0.12 0.30 0.00 0.00 0.00 0.00 61.98 62.88 2eny s VAL 69 Cb -0.13 -4.97 0.83 0.00 0.00 0.00 0.00 36.38 32.11 2eny s VAL 69 CO 0.19 -1.88 2.12 0.54 0.00 0.00 0.00 175.10 176.07 2eny n ARG 70 N 9.12 0.90 -3.74 2.72 1.74 -0.98 -1.79 116.66 124.64 2eny n ARG 70 Ca 0.16 0.00 -0.28 0.00 -0.77 0.00 0.00 57.85 56.96 2eny n ARG 70 Cb 0.50 -1.50 -0.16 0.00 -1.02 0.00 0.00 32.46 30.27 2eny n ARG 70 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2eny s GLU 71 N -2.05 0.67 -0.67 5.56 2.12 -1.26 -4.77 118.70 118.29 2eny s GLU 71 Ca 0.44 -0.46 0.05 0.00 0.36 0.00 0.00 54.97 55.36 2eny s GLU 71 Cb 0.21 -2.11 0.17 0.00 0.26 0.00 0.00 34.13 32.65 2eny s GLU 71 CO 0.36 -0.66 0.47 0.00 -0.54 0.00 0.00 175.26 174.89 2eny s ALA 72 N 1.84 3.59 0.40 6.30 0.00 -1.17 -4.97 121.76 127.76 2eny s ALA 72 Ca -0.01 -3.69 -0.01 0.00 0.00 0.00 0.00 51.96 48.25 2eny s ALA 72 Cb -0.17 -2.12 -0.03 0.00 0.00 0.00 0.00 23.12 20.80 2eny s ALA 72 CO -0.09 -2.08 0.63 0.00 0.00 0.00 0.00 175.76 174.22 2eny s ALA 73 N -1.26 3.64 -2.00 0.00 0.00 -1.26 -0.52 121.76 120.36 2eny s ALA 73 Ca 0.25 -0.86 0.13 0.00 0.00 0.00 0.00 51.96 51.48 2eny s ALA 73 Cb -0.05 -2.22 0.79 0.00 0.00 0.00 0.00 23.12 21.64 2eny s ALA 73 CO -0.16 -0.19 1.21 -0.35 0.00 0.00 0.00 175.76 176.28 2eny n PRO 74 N -1.97 0.48 -0.11 0.00 -0.04 -1.26 -2.51 135.00 129.60 2eny n PRO 74 Ca -0.02 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.31 2eny n PRO 74 Cb 0.56 -1.43 -0.13 0.00 -0.04 0.00 0.00 33.50 32.47 2eny n PRO 74 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2eny n SER 75 N -0.93 1.38 0.23 3.54 2.88 -1.26 -4.36 113.62 115.10 2eny n SER 75 Ca 0.10 -0.07 0.10 0.00 -1.33 0.00 0.00 58.87 57.66 2eny n SER 75 Cb 0.05 0.22 0.54 0.00 -0.75 0.00 0.00 64.21 64.27 2eny n SER 75 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2eny h ASP 76 N 0.00 0.00 -2.49 -3.46 3.32 -1.89 -3.43 116.42 108.48 2eny h ASP 76 Ca -0.52 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 55.97 2eny h ASP 76 Cb 1.97 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.51 2eny h ASP 76 CO -0.03 0.22 1.22 0.00 -1.72 0.00 0.00 179.24 178.92 2eny s ALA 77 N -3.94 3.31 0.03 3.45 0.00 -1.22 -4.39 121.76 119.01 2eny s ALA 77 Ca -0.01 0.83 0.00 0.00 0.00 0.00 0.00 51.96 52.78 2eny s ALA 77 Cb 0.12 -3.87 0.00 0.00 0.00 0.00 0.00 23.12 19.37 2eny s ALA 77 CO 0.63 -1.91 0.00 0.41 0.00 0.00 0.00 175.76 174.89 2eny n GLY 78 N 4.74 -1.84 3.15 0.00 0.00 -1.22 -4.96 105.19 105.07 2eny n GLY 78 Ca 0.21 0.64 0.05 0.00 0.00 0.00 0.00 46.02 46.92 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 -1.45 0.34 -0.10 1.61 2.12 -1.26 -4.39 118.70 115.57 2eny s GLU 79 Ca 0.00 0.61 -0.24 0.00 0.36 0.00 0.00 54.97 55.70 2eny s GLU 79 Cb 0.00 0.34 -0.03 0.00 0.26 0.00 0.00 34.13 34.70 2eny s GLU 79 CO 0.00 -0.37 0.73 0.08 -0.54 0.00 0.00 175.26 175.16 2eny s VAL 80 N 2.91 5.00 0.02 3.70 1.01 0.10 -3.52 120.40 129.62 2eny s VAL 80 Ca 0.08 1.48 0.08 0.00 0.00 0.00 0.00 61.98 63.62 2eny s VAL 80 Cb -0.12 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 2eny s VAL 80 CO -0.15 0.18 -0.23 -0.69 0.00 0.00 0.00 175.10 174.20 2eny s VAL 81 N 1.25 2.33 -0.16 2.92 1.01 0.15 -1.29 120.40 126.62 2eny s VAL 81 Ca 0.37 -1.21 -0.03 0.00 0.00 0.00 0.00 61.98 61.12 2eny s VAL 81 Cb -0.17 -1.90 0.05 0.00 0.00 0.00 0.00 36.38 34.36 2eny s VAL 81 CO 0.16 0.44 0.04 0.12 0.00 0.00 0.00 175.10 175.87 2eny s PHE 82 N -0.77 0.70 -0.22 5.22 5.36 -0.99 -0.63 117.98 126.65 2eny s PHE 82 Ca 0.12 -0.54 -0.10 0.00 -0.96 0.00 0.00 56.93 55.45 2eny s PHE 82 Cb -0.10 -0.87 -0.05 0.00 -0.34 0.00 0.00 43.02 41.65 2eny s PHE 82 CO 0.02 -0.51 0.15 0.45 -1.46 0.00 0.00 175.22 173.87 2eny s SER 83 N 1.96 6.17 -0.10 6.13 0.15 -0.37 -1.43 113.70 126.22 2eny s SER 83 Ca 0.01 0.18 -0.06 0.00 0.70 0.00 0.00 55.95 56.78 2eny s SER 83 Cb -0.16 -2.10 0.04 0.00 -1.71 0.00 0.00 66.02 62.09 2eny s SER 83 CO -0.07 0.12 0.24 0.54 1.20 0.00 0.00 173.24 175.26 2eny s VAL 84 N 0.72 -0.03 -0.82 4.45 0.11 -0.28 -0.09 120.40 124.46 2eny s VAL 84 Ca 0.08 0.09 -0.08 0.00 -2.93 0.00 0.00 61.98 59.14 2eny s VAL 84 Cb -0.12 -0.36 0.08 0.00 -1.53 0.00 0.00 36.38 34.45 2eny s VAL 84 CO 0.01 0.04 0.25 -2.11 -3.33 0.00 0.00 175.10 169.97 2eny n ARG 85 N 3.77 -2.36 0.00 1.54 1.85 -1.24 0.17 116.66 120.40 2eny n ARG 85 Ca -0.21 0.16 0.00 0.00 -1.00 0.00 0.00 57.85 56.80 2eny n ARG 85 Cb 0.55 -4.72 0.00 0.00 -1.05 0.00 0.00 32.46 27.24 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 -0.79 2.84 3.60 2.89 0.00 -1.26 -5.04 105.19 107.43 2eny n GLY 86 Ca 0.02 -0.29 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 2eny n GLY 86 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2eny s LEU 87 N 0.00 1.97 -0.16 0.99 1.43 0.45 -5.03 118.68 118.33 2eny s LEU 87 Ca 0.00 1.86 -0.10 0.00 -1.03 0.00 0.00 54.13 54.86 2eny s LEU 87 Cb 0.00 -4.05 0.05 0.00 0.03 0.00 0.00 46.19 42.22 2eny s LEU 87 CO 0.00 -3.52 0.39 -0.89 0.23 0.00 0.00 176.35 172.56 2eny s THR 88 N -2.59 -0.02 0.26 5.49 2.01 -1.26 -1.12 115.64 118.41 2eny s THR 88 Ca 0.67 0.07 0.11 0.00 0.31 0.00 0.00 61.69 62.85 2eny s THR 88 Cb -0.23 -0.57 -0.05 0.00 0.01 0.00 0.00 72.50 71.66 2eny s THR 88 CO 0.61 0.03 -0.13 -0.55 -0.69 0.00 0.00 174.62 173.88 2eny s SER 89 N 1.04 3.94 0.01 3.53 0.15 -0.52 -4.94 113.70 116.92 2eny s SER 89 Ca -0.07 -0.86 0.01 0.00 0.70 0.00 0.00 55.95 55.73 2eny s SER 89 Cb -0.07 -0.50 -0.01 0.00 -1.71 0.00 0.00 66.02 63.73 2eny s SER 89 CO -0.09 0.04 -0.04 -0.54 1.20 0.00 0.00 173.24 173.82 2eny s LYS 90 N -3.47 0.28 0.06 5.44 3.01 -1.26 -2.36 119.74 121.44 2eny s LYS 90 Ca 0.30 -0.32 -0.19 0.00 -1.01 0.00 0.00 55.97 54.75 2eny s LYS 90 Cb -0.06 -0.14 0.04 0.00 -1.01 0.00 0.00 37.83 36.66 2eny s LYS 90 CO 0.16 0.03 0.43 0.00 0.51 0.00 0.00 175.35 176.48 2eny s ALA 91 N -0.60 -1.05 -0.26 5.17 0.00 -0.41 -4.33 121.76 120.28 2eny s ALA 91 Ca -0.05 0.30 -0.09 0.00 0.00 0.00 0.00 51.96 52.13 2eny s ALA 91 Cb -0.05 0.41 -0.04 0.00 0.00 0.00 0.00 23.12 23.44 2eny s ALA 91 CO -0.00 -0.49 0.12 -1.12 0.00 0.00 0.00 175.76 174.26 2eny s SER 92 N -2.12 5.53 -0.15 0.00 0.01 -1.26 0.02 113.70 115.72 2eny s SER 92 Ca -0.04 -0.11 -0.07 0.00 1.31 0.00 0.00 55.95 57.04 2eny s SER 92 Cb -0.00 -2.01 -0.04 0.00 0.21 0.00 0.00 66.02 64.18 2eny s SER 92 CO -0.04 -0.03 0.09 -0.22 0.41 0.00 0.00 173.24 173.45 2eny s LEU 93 N 1.63 4.05 -0.11 2.44 2.96 -1.26 -3.16 118.68 125.22 2eny s LEU 93 Ca 0.07 0.24 -0.00 0.00 -0.22 0.00 0.00 54.13 54.21 2eny s LEU 93 Cb -0.15 -2.01 -0.02 0.00 0.50 0.00 0.00 46.19 44.51 2eny s LEU 93 CO 0.07 0.27 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.64 2eny s ILE 94 N -0.22 3.34 -0.22 6.68 1.09 -0.62 -3.37 121.20 127.88 2eny s ILE 94 Ca 0.09 -0.57 -0.04 0.00 -1.10 0.00 0.00 60.65 59.02 2eny s ILE 94 Cb -0.12 -2.40 0.08 0.00 -1.06 0.00 0.00 42.46 38.96 2eny s ILE 94 CO 0.01 0.54 0.10 -0.69 -0.10 0.00 0.00 174.94 174.80 2eny s VAL 95 N 0.01 -0.01 -0.19 2.92 1.01 -1.26 -2.43 120.40 120.45 2eny s VAL 95 Ca -0.03 -0.45 -0.20 0.00 0.00 0.00 0.00 61.98 61.30 2eny s VAL 95 Cb -0.14 -0.79 -0.03 0.00 0.00 0.00 0.00 36.38 35.42 2eny s VAL 95 CO 0.04 -0.46 0.61 -0.13 0.00 0.00 0.00 175.10 175.15 2eny s ARG 96 N 2.09 4.22 0.91 2.72 1.81 -1.14 -4.58 118.95 124.98 2eny s ARG 96 Ca 0.05 0.58 -0.13 0.00 -1.72 0.00 0.00 55.73 54.50 2eny s ARG 96 Cb -0.16 -3.57 0.02 0.00 -0.45 0.00 0.00 34.95 30.79 2eny s ARG 96 CO -0.20 -0.20 0.40 -0.85 -0.68 0.00 0.00 175.30 173.77 2eny n GLU 97 N 4.93 -0.18 -4.06 3.54 0.28 -1.26 -0.84 120.64 123.05 2eny n GLU 97 Ca -0.02 -0.01 -0.22 0.00 -0.16 0.00 0.00 57.16 56.75 2eny n GLU 97 Cb 0.50 -1.84 -0.04 0.00 1.43 0.00 0.00 31.44 31.49 2eny n GLU 97 CO 0.00 0.00 0.00 -0.98 -0.16 0.00 0.00 177.13 175.99 2eny s ARG 98 N -3.46 2.81 -0.20 3.44 1.70 -1.26 -4.68 118.95 117.29 2eny s ARG 98 Ca 0.58 -1.16 -0.04 0.00 -0.47 0.00 0.00 55.73 54.64 2eny s ARG 98 Cb -0.23 -2.50 0.09 0.00 -0.57 0.00 0.00 34.95 31.75 2eny s ARG 98 CO 0.66 0.32 0.23 0.45 -1.08 0.00 0.00 175.30 175.88 2eny s SER 99 N -3.86 1.33 0.77 -2.89 0.15 -1.26 -5.09 113.70 102.85 2eny s SER 99 Ca 0.35 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.79 2eny s SER 99 Cb -0.07 0.41 0.00 0.00 -1.71 0.00 0.00 66.02 64.65 2eny s SER 99 CO 0.25 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 174.97 2eny n GLY 100 N 5.32 -2.93 3.66 9.45 0.00 -1.26 -4.84 105.19 114.58 2eny n GLY 100 Ca -0.05 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.57 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 -2.32 4.19 0.26 1.61 0.04 -1.26 -4.91 135.00 132.61 2eny s PRO 101 Ca 0.00 2.00 -0.03 0.00 0.04 0.00 0.00 61.00 63.00 2eny s PRO 101 Cb 0.00 -3.91 0.54 0.00 0.04 0.00 0.00 34.50 31.16 2eny s PRO 101 CO 0.00 -0.81 1.65 1.03 0.04 0.00 0.00 177.00 178.90 2eny h SER 102 N 9.13 -0.16 -3.58 6.66 0.87 -2.07 -3.41 113.55 121.00 2eny h SER 102 Ca -0.35 0.19 -0.44 0.00 -1.23 0.00 0.00 61.79 59.96 2eny h SER 102 Cb 1.15 0.29 -0.16 0.00 -0.44 0.00 0.00 62.40 63.24 2eny h SER 102 CO 0.96 -0.14 -0.75 -0.55 -0.53 0.00 0.00 176.83 175.82 2eny s SER 103 N -5.16 2.35 0.00 6.23 0.15 -1.26 -5.31 113.70 110.70 2eny s SER 103 Ca -0.13 -0.94 0.00 0.00 0.70 0.00 0.00 55.95 55.59 2eny s SER 103 Cb 0.23 -0.11 0.00 0.00 -1.71 0.00 0.00 66.02 64.44 2eny s SER 103 CO 0.76 -0.16 0.34 0.61 1.20 0.00 0.00 173.24 175.99