#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 0.65 0.08 1.61 0.15 -1.26 -5.11 113.70 109.82 2eny s SER 2 Ca 0.00 -0.32 -0.36 0.00 0.70 0.00 0.00 55.95 55.97 2eny s SER 2 Cb 0.00 -0.01 -0.18 0.00 -1.71 0.00 0.00 66.02 64.12 2eny s SER 2 CO 0.00 -0.08 1.07 -0.24 1.20 0.00 0.00 173.24 175.18 2eny n SER 3 N 2.21 0.40 0.00 5.45 2.88 -1.26 -4.80 113.62 118.50 2eny n SER 3 Ca -0.18 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.50 2eny n SER 3 Cb 0.57 -1.03 0.00 0.00 -0.75 0.00 0.00 64.21 62.99 2eny n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2eny n GLY 4 N 1.87 1.02 3.16 0.46 0.00 -1.26 -5.15 105.19 105.30 2eny n GLY 4 Ca 0.18 -1.86 -0.11 0.00 0.00 0.00 0.00 46.02 44.23 2eny n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eny s SER 5 N 0.00 1.17 -0.21 1.61 0.01 -1.26 -5.14 113.70 109.88 2eny s SER 5 Ca 0.00 -0.95 -0.21 0.00 1.31 0.00 0.00 55.95 56.10 2eny s SER 5 Cb 0.00 0.08 0.06 0.00 0.21 0.00 0.00 66.02 66.37 2eny s SER 5 CO 0.00 -0.42 0.59 -0.44 0.41 0.00 0.00 173.24 173.38 2eny s SER 6 N -2.88 -0.61 0.00 2.44 0.01 -1.26 -5.04 113.70 106.36 2eny s SER 6 Ca 0.10 1.16 0.00 0.00 1.31 0.00 0.00 55.95 58.52 2eny s SER 6 Cb 0.03 1.18 0.00 0.00 0.21 0.00 0.00 66.02 67.44 2eny s SER 6 CO -0.04 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.00 2eny n GLY 7 N 2.68 0.13 3.82 3.44 0.00 -1.26 -5.15 105.19 108.85 2eny n GLY 7 Ca -0.14 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 2eny n GLY 7 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2eny s HIS 8 N -1.08 2.98 -0.06 1.61 4.02 -1.26 -5.04 115.29 116.46 2eny s HIS 8 Ca 0.00 1.25 -0.14 0.00 1.02 0.00 0.00 55.06 57.20 2eny s HIS 8 Cb 0.00 -3.02 -0.05 0.00 -1.02 0.00 0.00 32.58 28.49 2eny s HIS 8 CO 0.00 -1.51 0.36 0.08 1.02 0.00 0.00 174.74 174.69 2eny s VAL 9 N -3.12 5.16 0.04 -0.90 1.01 -1.26 -5.08 120.40 116.24 2eny s VAL 9 Ca 0.59 0.72 -0.16 0.00 0.00 0.00 0.00 61.98 63.13 2eny s VAL 9 Cb -0.14 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.60 2eny s VAL 9 CO 0.54 0.53 0.37 -0.83 0.00 0.00 0.00 175.10 175.71 2eny s GLY 10 N -0.64 -0.21 0.28 4.51 0.00 -1.26 -5.09 107.32 104.91 2eny s GLY 10 Ca 0.22 0.20 -0.30 0.00 0.00 0.00 0.00 44.72 44.84 2eny s GLY 10 CO 0.10 -0.04 1.29 1.39 0.00 0.00 0.00 173.10 175.84 2eny n ILE 11 N 0.57 1.45 -0.03 0.90 5.41 -1.26 -3.70 119.36 122.70 2eny n ILE 11 Ca -0.19 -0.36 -0.00 0.00 1.00 0.00 0.00 62.75 63.20 2eny n ILE 11 Cb 0.59 -1.39 -0.08 0.00 -0.71 0.00 0.00 39.64 38.05 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 1.11 0.37 -3.66 1.39 5.66 -1.22 -4.78 114.28 113.15 2eny n THR 12 Ca 0.09 -0.34 -0.32 0.00 -3.05 0.00 0.00 64.05 60.43 2eny n THR 12 Cb 0.33 -0.28 -0.08 0.00 -1.55 0.00 0.00 70.33 68.74 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 -2.14 2.46 -0.83 1.09 3.00 -1.07 -5.03 118.16 115.63 2eny n LYS 13 Ca -0.10 -4.52 -0.32 0.00 -0.00 0.00 0.00 58.31 53.37 2eny n LYS 13 Cb 0.58 -2.35 0.14 0.00 0.00 0.00 0.00 35.03 33.39 2eny n LYS 13 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2eny n ARG 14 N 1.90 -0.24 -0.89 1.64 1.85 -1.26 -3.62 116.66 116.04 2eny n ARG 14 Ca 0.23 -0.01 -0.31 0.00 -1.00 0.00 0.00 57.85 56.76 2eny n ARG 14 Cb 0.37 -2.17 0.14 0.00 -1.05 0.00 0.00 32.46 29.75 2eny n ARG 14 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2eny s LEU 15 N -4.07 2.85 -0.01 2.89 1.43 -1.26 -4.96 118.68 115.55 2eny s LEU 15 Ca 0.64 2.04 0.03 0.00 -1.03 0.00 0.00 54.13 55.81 2eny s LEU 15 Cb -0.24 -4.51 -0.00 0.00 0.03 0.00 0.00 46.19 41.46 2eny s LEU 15 CO 0.60 -2.77 -0.10 -1.59 0.23 0.00 0.00 176.35 172.72 2eny s LYS 16 N -4.74 0.86 0.19 1.70 -2.85 -1.26 -4.87 119.74 108.78 2eny s LYS 16 Ca 0.65 -0.34 -0.32 0.00 -1.00 0.00 0.00 55.97 54.96 2eny s LYS 16 Cb -0.21 -0.82 -0.15 0.00 -2.06 0.00 0.00 37.83 34.59 2eny s LYS 16 CO 0.57 0.17 1.18 2.41 0.10 0.00 0.00 175.35 179.79 2eny n THR 17 N 3.01 0.97 -4.03 3.79 -1.04 -1.26 -4.70 114.28 111.02 2eny n THR 17 Ca -0.15 -0.24 -0.22 0.00 -2.04 0.00 0.00 64.05 61.40 2eny n THR 17 Cb 0.56 -0.93 -0.05 0.00 -1.82 0.00 0.00 70.33 68.09 2eny n THR 17 CO 0.00 0.00 0.00 -0.32 -0.64 0.00 0.00 175.07 174.11 2eny s MET 18 N -0.45 2.72 -0.25 -2.82 1.75 0.49 -4.94 119.30 115.80 2eny s MET 18 Ca 0.72 -1.24 -0.04 0.00 -1.25 0.00 0.00 55.69 53.88 2eny s MET 18 Cb -0.82 -2.44 0.13 0.00 2.84 0.00 0.00 34.83 34.54 2eny s MET 18 CO 0.52 0.26 0.46 -2.00 -0.65 0.00 0.00 175.02 173.61 2eny s GLU 19 N -3.88 0.41 0.16 4.11 -6.30 -1.26 -1.14 118.70 110.80 2eny s GLU 19 Ca 0.36 0.86 -0.07 0.00 -2.50 0.00 0.00 54.97 53.62 2eny s GLU 19 Cb -0.06 0.09 -0.02 0.00 0.00 0.00 0.00 34.13 34.14 2eny s GLU 19 CO 0.25 -0.48 0.24 0.14 0.02 0.00 0.00 175.26 175.42 2eny s VAL 20 N 2.66 0.07 0.22 3.70 -7.23 -0.58 -5.00 120.40 114.24 2eny s VAL 20 Ca 0.09 -1.50 -0.16 0.00 -1.81 0.00 0.00 61.98 58.60 2eny s VAL 20 Cb -0.14 -1.90 -0.08 0.00 0.56 0.00 0.00 36.38 34.82 2eny s VAL 20 CO -0.16 -0.31 0.65 -0.22 -0.31 0.00 0.00 175.10 174.74 2eny s LEU 21 N -2.99 4.27 0.19 1.32 1.98 -1.26 -2.98 118.68 119.21 2eny s LEU 21 Ca 0.19 1.23 -0.33 0.00 -2.89 0.00 0.00 54.13 52.33 2eny s LEU 21 Cb 0.04 -3.59 -0.13 0.00 0.66 0.00 0.00 46.19 43.17 2eny s LEU 21 CO 0.01 -0.00 1.57 1.21 -1.89 0.00 0.00 176.35 177.25 2eny n GLU 22 N 0.45 2.23 0.00 1.98 2.13 0.45 -1.96 120.64 125.93 2eny n GLU 22 Ca -0.02 0.80 0.00 0.00 0.66 0.00 0.00 57.16 58.60 2eny n GLU 22 Cb 0.52 -2.56 0.00 0.00 0.27 0.00 0.00 31.44 29.66 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 3.22 2.31 1.88 8.31 0.00 -1.15 -4.71 105.19 115.05 2eny n GLY 23 Ca 0.16 -0.22 -0.16 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.74 -4.22 1.61 -0.58 -0.83 -4.66 120.64 110.22 2eny n GLU 24 Ca 0.00 -0.96 -0.30 0.00 -0.42 0.00 0.00 57.16 55.48 2eny n GLU 24 Cb 0.00 -0.82 -0.17 0.00 -0.57 0.00 0.00 31.44 29.89 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 -3.18 2.66 -0.03 1.62 1.04 -1.26 -3.88 113.70 110.67 2eny s SER 25 Ca 0.38 -0.48 0.07 0.00 0.48 0.00 0.00 55.95 56.39 2eny s SER 25 Cb -0.03 -1.18 -0.02 0.00 0.10 0.00 0.00 66.02 64.89 2eny s SER 25 CO 0.28 -0.02 -0.23 0.00 0.98 0.00 0.00 173.24 174.26 2eny s SER 27 N -0.64 2.03 1.13 0.00 0.01 -1.26 -0.56 113.70 114.41 2eny s SER 27 Ca 0.10 -0.26 -0.18 0.00 1.31 0.00 0.00 55.95 56.92 2eny s SER 27 Cb -0.10 -0.69 0.26 0.00 0.21 0.00 0.00 66.02 65.70 2eny s SER 27 CO -0.01 -0.16 1.13 0.49 0.41 0.00 0.00 173.24 175.11 2eny n PHE 28 N 5.02 -3.92 -3.72 2.43 3.01 -1.17 -4.87 117.46 114.24 2eny n PHE 28 Ca -0.10 -1.02 -0.13 0.00 1.01 0.00 0.00 57.45 57.21 2eny n PHE 28 Cb 0.50 -1.04 -0.10 0.00 -0.01 0.00 0.00 39.48 38.83 2eny n PHE 28 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 2eny s GLU 29 N -5.53 0.49 -0.11 -1.08 2.02 -1.26 -3.77 118.70 109.46 2eny s GLU 29 Ca 0.69 0.63 -0.04 0.00 0.02 0.00 0.00 54.97 56.27 2eny s GLU 29 Cb -0.05 0.21 0.06 0.00 0.10 0.00 0.00 34.13 34.45 2eny s GLU 29 CO 0.51 -0.07 0.23 0.00 0.02 0.00 0.00 175.26 175.94 2eny s VAL 31 N 2.33 2.29 0.24 0.00 1.01 -1.24 -1.44 120.40 123.60 2eny s VAL 31 Ca 0.01 -2.35 0.05 0.00 0.00 0.00 0.00 61.98 59.69 2eny s VAL 31 Cb -0.12 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 33.97 2eny s VAL 31 CO -0.08 -0.44 -0.04 -0.76 0.00 0.00 0.00 175.10 173.78 2eny s LEU 32 N -3.45 2.37 0.09 3.92 1.02 -1.24 -2.61 118.68 118.78 2eny s LEU 32 Ca 0.28 -1.18 -0.22 0.00 0.02 0.00 0.00 54.13 53.03 2eny s LEU 32 Cb -0.04 -0.46 -0.12 0.00 0.02 0.00 0.00 46.19 45.59 2eny s LEU 32 CO 0.13 -0.40 1.70 -1.28 0.02 0.00 0.00 176.35 176.52 2eny h SER 33 N 2.42 0.11 -3.87 2.29 0.87 -1.89 -3.45 113.55 110.03 2eny h SER 33 Ca -0.39 -0.06 -0.51 0.00 -1.23 0.00 0.00 61.79 59.61 2eny h SER 33 Cb 1.22 -0.03 -0.19 0.00 -0.44 0.00 0.00 62.40 62.97 2eny h SER 33 CO 0.65 0.14 -0.79 -2.28 -0.53 0.00 0.00 176.83 174.02 2eny s HIS 34 N -5.95 1.70 0.11 2.24 5.65 -1.26 -5.09 115.29 112.68 2eny s HIS 34 Ca -0.13 -0.47 -0.27 0.00 0.25 0.00 0.00 55.06 54.43 2eny s HIS 34 Cb 0.07 -0.88 -0.06 0.00 -1.18 0.00 0.00 32.58 30.52 2eny s HIS 34 CO 0.68 0.25 0.86 -2.00 -0.65 0.00 0.00 174.74 173.87 2eny s GLU 35 N -2.48 4.62 -0.22 2.88 2.12 -1.26 -4.97 118.70 119.39 2eny s GLU 35 Ca 0.11 1.26 -0.08 0.00 0.36 0.00 0.00 54.97 56.63 2eny s GLU 35 Cb -0.07 -3.34 -0.11 0.00 0.26 0.00 0.00 34.13 30.87 2eny s GLU 35 CO 0.05 0.33 -0.26 0.45 -0.54 0.00 0.00 175.26 175.29 2eny n SER 36 N 2.47 1.81 -4.06 -1.70 2.88 -1.26 -4.98 113.62 108.79 2eny n SER 36 Ca -0.01 0.16 -0.34 0.00 -1.33 0.00 0.00 58.87 57.35 2eny n SER 36 Cb 0.49 -0.57 -0.06 0.00 -0.75 0.00 0.00 64.21 63.32 2eny n SER 36 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2eny n ALA 37 N -3.76 -1.11 -0.02 -1.46 0.00 -1.26 -4.70 120.51 108.20 2eny n ALA 37 Ca -0.43 -0.17 -0.03 0.00 0.00 0.00 0.00 53.44 52.82 2eny n ALA 37 Cb 0.84 -2.07 -0.01 0.00 0.00 0.00 0.00 19.45 18.21 2eny n ALA 37 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2eny n SER 38 N -2.15 2.43 -4.56 0.00 3.41 -1.26 -5.07 113.62 106.43 2eny n SER 38 Ca 0.09 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.45 2eny n SER 38 Cb 0.44 -0.07 -0.09 0.00 -0.26 0.00 0.00 64.21 64.22 2eny n SER 38 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2eny s ASP 39 N -4.68 4.17 1.11 4.04 1.01 -1.26 -5.14 116.67 115.92 2eny s ASP 39 Ca -0.04 -0.63 -0.09 0.00 0.71 0.00 0.00 52.55 52.49 2eny s ASP 39 Cb 0.01 -0.67 0.13 0.00 1.01 0.00 0.00 42.92 43.41 2eny s ASP 39 CO 0.07 0.09 0.47 -0.81 0.21 0.00 0.00 175.17 175.20 2eny n PRO 40 N -0.06 -1.92 -4.26 8.23 -0.04 -1.26 -4.73 135.00 130.95 2eny n PRO 40 Ca -0.10 -0.75 -0.26 0.00 -0.04 0.00 0.00 63.50 62.35 2eny n PRO 40 Cb 0.56 -0.70 -0.08 0.00 -0.04 0.00 0.00 33.50 33.24 2eny n PRO 40 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2eny s ALA 41 N -3.00 3.55 -0.23 0.55 0.00 -1.26 -3.97 121.76 117.40 2eny s ALA 41 Ca 0.30 -2.04 -0.03 0.00 0.00 0.00 0.00 51.96 50.19 2eny s ALA 41 Cb -0.03 -0.25 0.12 0.00 0.00 0.00 0.00 23.12 22.96 2eny s ALA 41 CO 0.23 -0.16 0.32 1.41 0.00 0.00 0.00 175.76 177.56 2eny s MET 42 N -3.87 0.29 -0.11 0.00 1.75 0.35 -4.98 119.30 112.73 2eny s MET 42 Ca 0.38 0.44 0.01 0.00 -1.25 0.00 0.00 55.69 55.26 2eny s MET 42 Cb 0.05 -0.70 -0.02 0.00 2.84 0.00 0.00 34.83 37.00 2eny s MET 42 CO 0.20 -0.63 -0.14 -1.58 -0.65 0.00 0.00 175.02 172.22 2eny s TRP 43 N 2.47 2.77 -0.20 4.11 0.52 -1.26 -0.20 118.94 127.15 2eny s TRP 43 Ca 0.10 -0.57 -0.04 0.00 0.02 0.00 0.00 56.10 55.61 2eny s TRP 43 Cb -0.15 -1.79 0.07 0.00 -1.15 0.00 0.00 33.47 30.45 2eny s TRP 43 CO -0.14 -0.14 0.09 0.95 0.02 0.00 0.00 176.95 177.73 2eny s THR 44 N 0.12 0.02 -0.69 2.01 -4.23 -0.60 0.85 115.64 113.12 2eny s THR 44 Ca -0.07 -0.35 -0.10 0.00 -1.18 0.00 0.00 61.69 59.99 2eny s THR 44 Cb -0.15 -0.73 0.18 0.00 1.34 0.00 0.00 72.50 73.14 2eny s THR 44 CO 0.05 -0.36 0.59 0.54 -0.54 0.00 0.00 174.62 174.89 2eny s VAL 45 N 2.08 4.84 -0.16 2.29 0.11 -1.22 -1.52 120.40 126.83 2eny s VAL 45 Ca 0.03 -2.39 -0.14 0.00 -2.93 0.00 0.00 61.98 56.55 2eny s VAL 45 Cb -0.16 -4.07 0.02 0.00 -1.53 0.00 0.00 36.38 30.64 2eny s VAL 45 CO -0.14 -0.93 0.23 0.61 -3.33 0.00 0.00 175.10 171.54 2eny n GLY 46 N 4.12 0.07 0.00 6.54 0.00 -0.85 -4.45 105.19 110.62 2eny n GLY 46 Ca 0.06 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.48 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 0.39 0.75 2.01 -0.02 0.00 -1.26 -4.85 105.19 102.21 2eny n GLY 47 Ca -0.03 0.05 0.01 0.00 0.00 0.00 0.00 46.02 46.04 2eny n GLY 47 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2eny n LYS 48 N 0.00 0.13 -2.54 1.61 2.85 -1.26 -5.11 118.16 113.85 2eny n LYS 48 Ca 0.00 -0.46 -0.42 0.00 -1.05 0.00 0.00 58.31 56.38 2eny n LYS 48 Cb 0.00 0.71 -0.02 0.00 -0.65 0.00 0.00 35.03 35.07 2eny n LYS 48 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 2eny s THR 49 N -2.13 3.97 0.48 0.58 2.01 -1.26 -3.40 115.64 115.90 2eny s THR 49 Ca 0.15 0.87 0.02 0.00 0.31 0.00 0.00 61.69 63.04 2eny s THR 49 Cb -0.01 -4.65 0.01 0.00 0.01 0.00 0.00 72.50 67.86 2eny s THR 49 CO 0.00 -1.28 0.69 0.68 -0.69 0.00 0.00 174.62 174.02 2eny s VAL 50 N 5.16 3.36 0.00 3.82 -7.23 0.25 -4.81 120.40 120.95 2eny s VAL 50 Ca 0.45 -0.65 0.00 0.00 -1.81 0.00 0.00 61.98 59.97 2eny s VAL 50 Cb -0.08 -3.23 0.00 0.00 0.56 0.00 0.00 36.38 33.63 2eny s VAL 50 CO 0.26 -0.15 0.00 0.61 -0.31 0.00 0.00 175.10 175.51 2eny n GLY 51 N -2.13 3.88 0.11 2.32 0.00 -1.26 -4.01 105.19 104.11 2eny n GLY 51 Ca 0.05 -0.59 -0.21 0.00 0.00 0.00 0.00 46.02 45.26 2eny n GLY 51 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2eny h SER 52 N 1.09 0.12 -1.78 1.61 0.87 -1.88 -3.19 113.55 110.40 2eny h SER 52 Ca 0.00 -0.66 -0.52 0.00 -1.23 0.00 0.00 61.79 59.37 2eny h SER 52 Cb 0.00 -0.04 0.17 0.00 -0.44 0.00 0.00 62.40 62.09 2eny h SER 52 CO 0.00 1.52 -1.14 -1.54 -0.53 0.00 0.00 176.83 175.14 2eny n SER 53 N -4.24 -3.64 -0.16 6.23 3.41 -1.26 -4.84 113.62 109.12 2eny n SER 53 Ca -0.29 0.51 -0.08 0.00 -0.26 0.00 0.00 58.87 58.74 2eny n SER 53 Cb 0.75 -0.74 0.01 0.00 -0.26 0.00 0.00 64.21 63.97 2eny n SER 53 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2eny h SER 54 N -0.17 0.63 0.29 4.04 0.02 -2.03 -3.27 113.55 113.07 2eny h SER 54 Ca -0.37 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 60.43 2eny h SER 54 Cb 1.26 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 63.64 2eny h SER 54 CO 0.34 0.60 -0.18 0.03 -1.14 0.00 0.00 176.83 176.48 2eny h ARG 55 N 0.62 -0.43 -6.21 3.45 3.08 -1.94 -3.41 114.38 109.55 2eny h ARG 55 Ca 0.16 0.03 -0.56 0.00 0.07 0.00 0.00 59.98 59.68 2eny h ARG 55 Cb 0.14 0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.25 2eny h ARG 55 CO -0.02 -0.28 0.68 -0.06 -1.07 0.00 0.00 179.97 179.22 2eny s PHE 56 N -4.05 3.35 -0.23 3.04 0.40 -1.23 -3.71 117.98 115.54 2eny s PHE 56 Ca -0.07 1.44 0.02 0.00 -0.60 0.00 0.00 56.93 57.72 2eny s PHE 56 Cb 0.01 -3.28 0.05 0.00 0.51 0.00 0.00 43.02 40.31 2eny s PHE 56 CO 0.22 -0.62 -0.11 -1.14 0.70 0.00 0.00 175.22 174.27 2eny s GLN 57 N 2.48 2.21 -0.76 0.44 0.74 -0.74 -4.02 119.66 120.01 2eny s GLN 57 Ca 0.49 -1.12 -0.15 0.00 0.05 0.00 0.00 55.36 54.63 2eny s GLN 57 Cb -0.19 -2.70 0.18 0.00 1.10 0.00 0.00 33.01 31.40 2eny s GLN 57 CO 0.15 -0.49 0.75 0.00 -0.55 0.00 0.00 175.29 175.15 2eny s ALA 58 N 1.23 3.84 0.49 1.58 0.00 -1.21 -0.48 121.76 127.22 2eny s ALA 58 Ca -0.05 -2.98 -0.20 0.00 0.00 0.00 0.00 51.96 48.73 2eny s ALA 58 Cb -0.18 -3.53 -0.08 0.00 0.00 0.00 0.00 23.12 19.32 2eny s ALA 58 CO -0.07 -2.32 1.02 0.95 0.00 0.00 0.00 175.76 175.34 2eny s THR 59 N 1.02 3.96 -0.39 0.00 -4.23 -0.68 -4.95 115.64 110.37 2eny s THR 59 Ca 0.16 1.17 0.04 0.00 -1.18 0.00 0.00 61.69 61.88 2eny s THR 59 Cb -0.15 -3.49 0.11 0.00 1.34 0.00 0.00 72.50 70.31 2eny s THR 59 CO -0.05 -0.31 0.12 -0.60 -0.54 0.00 0.00 174.62 173.24 2eny s ARG 60 N -3.36 1.54 -0.22 3.99 3.52 -1.26 -3.05 118.95 120.11 2eny s ARG 60 Ca 0.65 -2.02 -0.02 0.00 -0.13 0.00 0.00 55.73 54.21 2eny s ARG 60 Cb -0.14 -3.10 0.01 0.00 -1.56 0.00 0.00 34.95 30.15 2eny s ARG 60 CO 0.21 -1.00 -0.08 -0.65 -0.81 0.00 0.00 175.30 172.97 2eny s GLN 61 N 0.61 3.15 1.88 5.12 -1.52 -1.07 -5.04 119.66 122.79 2eny s GLN 61 Ca 0.13 -0.76 0.00 0.00 -1.95 0.00 0.00 55.36 52.78 2eny s GLN 61 Cb -0.21 -2.93 0.00 0.00 -0.22 0.00 0.00 33.01 29.65 2eny s GLN 61 CO -0.07 -0.26 0.00 0.41 -0.25 0.00 0.00 175.29 175.12 2eny n GLY 62 N 4.73 1.82 1.74 3.09 0.00 -1.26 -0.89 105.19 114.42 2eny n GLY 62 Ca -0.18 -0.30 -0.14 0.00 0.00 0.00 0.00 46.02 45.39 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 14.00 1.73 -4.21 1.61 1.85 -1.26 -4.85 116.66 125.54 2eny n ARG 63 Ca 0.00 -1.63 -0.16 0.00 -1.00 0.00 0.00 57.85 55.06 2eny n ARG 63 Cb 0.00 -1.64 -0.14 0.00 -1.05 0.00 0.00 32.46 29.63 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 -1.82 0.54 -0.11 2.89 2.20 -0.06 -3.73 119.74 119.63 2eny s LYS 64 Ca 0.31 -0.32 0.02 0.00 -0.36 0.00 0.00 55.97 55.62 2eny s LYS 64 Cb 0.26 -0.49 -0.01 0.00 -1.51 0.00 0.00 37.83 36.08 2eny s LYS 64 CO 0.04 0.13 -0.18 0.71 -0.36 0.00 0.00 175.35 175.69 2eny s TYR 65 N -0.34 2.70 -0.19 4.03 2.02 -0.52 -2.60 117.35 122.46 2eny s TYR 65 Ca 0.01 -0.76 0.00 0.00 -0.37 0.00 0.00 57.07 55.95 2eny s TYR 65 Cb -0.04 -1.77 0.04 0.00 -0.40 0.00 0.00 41.96 39.79 2eny s TYR 65 CO -0.00 -0.26 -0.09 0.42 -1.57 0.00 0.00 175.55 174.04 2eny s ILE 66 N 0.26 1.50 -0.59 2.71 1.09 -1.17 -1.85 121.20 123.14 2eny s ILE 66 Ca -0.12 -0.88 -0.17 0.00 -1.10 0.00 0.00 60.65 58.38 2eny s ILE 66 Cb -0.16 -1.59 0.13 0.00 -1.06 0.00 0.00 42.46 39.78 2eny s ILE 66 CO 0.06 0.18 0.62 -0.22 -0.10 0.00 0.00 174.94 175.48 2eny s LEU 67 N 1.46 5.90 -0.07 2.97 2.96 -1.25 -1.69 118.68 128.96 2eny s LEU 67 Ca -0.00 -1.73 -0.30 0.00 -0.22 0.00 0.00 54.13 51.88 2eny s LEU 67 Cb -0.16 -2.25 -0.03 0.00 0.50 0.00 0.00 46.19 44.25 2eny s LEU 67 CO -0.08 -0.94 1.29 -0.69 -1.32 0.00 0.00 176.35 174.61 2eny s VAL 68 N 1.93 4.09 -0.35 1.68 1.01 0.37 -3.03 120.40 126.10 2eny s VAL 68 Ca 0.08 1.40 -0.09 0.00 0.00 0.00 0.00 61.98 63.37 2eny s VAL 68 Cb -0.25 -3.90 0.02 0.00 0.00 0.00 0.00 36.38 32.25 2eny s VAL 68 CO 0.03 -0.04 0.16 -0.69 0.00 0.00 0.00 175.10 174.56 2eny s VAL 69 N 2.69 4.32 0.08 2.92 1.01 0.28 -1.80 120.40 129.91 2eny s VAL 69 Ca 0.58 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 61.67 2eny s VAL 69 Cb -0.26 -3.38 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 2eny s VAL 69 CO 0.22 -0.16 0.29 -0.13 0.00 0.00 0.00 175.10 175.32 2eny s ARG 70 N 1.52 3.55 -1.48 2.72 1.81 -1.24 -3.11 118.95 122.71 2eny s ARG 70 Ca 0.01 -0.21 -0.05 0.00 -1.72 0.00 0.00 55.73 53.77 2eny s ARG 70 Cb -0.19 -2.97 0.02 0.00 -0.45 0.00 0.00 34.95 31.36 2eny s ARG 70 CO 0.05 0.56 0.51 0.39 -0.68 0.00 0.00 175.30 176.13 2eny n GLU 71 N 0.41 -4.18 -1.49 3.54 1.02 -1.26 -4.79 120.64 113.90 2eny n GLU 71 Ca -0.05 0.79 -0.60 0.00 -0.02 0.00 0.00 57.16 57.27 2eny n GLU 71 Cb 0.52 -5.59 -0.10 0.00 -0.02 0.00 0.00 31.44 26.25 2eny n GLU 71 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2eny n ALA 72 N -3.39 -0.10 -2.95 0.62 0.00 -1.25 -4.80 120.51 108.65 2eny n ALA 72 Ca -0.10 0.26 -0.22 0.00 0.00 0.00 0.00 53.44 53.38 2eny n ALA 72 Cb 0.60 -2.14 -0.02 0.00 0.00 0.00 0.00 19.45 17.89 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 5.06 3.91 0.30 0.00 0.00 -1.26 -2.94 121.76 126.84 2eny s ALA 73 Ca 1.11 -1.19 0.14 0.00 0.00 0.00 0.00 51.96 52.02 2eny s ALA 73 Cb -1.32 -1.71 0.65 0.00 0.00 0.00 0.00 23.12 20.74 2eny s ALA 73 CO 0.67 0.32 1.76 -1.00 0.00 0.00 0.00 175.76 177.51 2eny h PRO 74 N 1.46 0.00 -0.34 0.00 0.13 -1.90 -3.11 132.00 128.25 2eny h PRO 74 Ca -0.51 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.48 2eny h PRO 74 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 2eny h PRO 74 CO 0.63 0.43 -0.34 1.03 -0.23 0.00 0.00 178.00 179.51 2eny h SER 75 N 0.00 0.89 -0.57 1.44 0.87 -1.95 -3.01 113.55 111.21 2eny h SER 75 Ca -0.00 -0.47 0.08 0.00 -1.23 0.00 0.00 61.79 60.17 2eny h SER 75 Cb 0.82 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 62.50 2eny h SER 75 CO 0.06 1.18 0.38 0.44 -0.53 0.00 0.00 176.83 178.35 2eny h ASP 76 N 0.61 0.38 -1.19 6.23 3.32 -1.87 -3.42 116.42 120.49 2eny h ASP 76 Ca 0.05 0.01 -0.73 0.00 0.02 0.00 0.00 57.03 56.38 2eny h ASP 76 Cb 0.93 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.40 2eny h ASP 76 CO 0.09 0.24 1.11 0.00 -1.72 0.00 0.00 179.24 178.96 2eny n ALA 77 N -2.51 0.23 -1.00 3.45 0.00 -1.14 -4.50 120.51 115.05 2eny n ALA 77 Ca 0.09 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.75 2eny n ALA 77 Cb 0.33 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.48 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 5.36 -1.95 3.34 0.00 0.00 -1.18 -4.97 105.19 105.79 2eny n GLY 78 Ca 0.35 0.69 -0.12 0.00 0.00 0.00 0.00 46.02 46.94 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 0.00 0.49 -0.27 1.61 2.12 -1.26 -3.92 118.70 117.47 2eny s GLU 79 Ca 0.00 0.75 -0.05 0.00 0.36 0.00 0.00 54.97 56.03 2eny s GLU 79 Cb 0.00 0.13 0.02 0.00 0.26 0.00 0.00 34.13 34.53 2eny s GLU 79 CO 0.00 -0.11 0.02 0.08 -0.54 0.00 0.00 175.26 174.71 2eny s VAL 80 N 0.86 3.51 -0.23 3.70 1.01 0.10 -2.00 120.40 127.34 2eny s VAL 80 Ca -0.05 -0.83 -0.06 0.00 0.00 0.00 0.00 61.98 61.04 2eny s VAL 80 Cb -0.06 -2.80 -0.02 0.00 0.00 0.00 0.00 36.38 33.50 2eny s VAL 80 CO -0.07 0.13 0.03 -0.69 0.00 0.00 0.00 175.10 174.50 2eny s VAL 81 N 1.43 4.06 -0.24 2.92 1.01 -0.57 -1.64 120.40 127.36 2eny s VAL 81 Ca 0.02 -0.27 -0.02 0.00 0.00 0.00 0.00 61.98 61.71 2eny s VAL 81 Cb -0.17 -2.87 0.02 0.00 0.00 0.00 0.00 36.38 33.37 2eny s VAL 81 CO -0.00 0.39 -0.07 0.12 0.00 0.00 0.00 175.10 175.53 2eny s PHE 82 N 1.35 3.03 0.00 5.22 5.36 -1.21 -1.56 117.98 130.18 2eny s PHE 82 Ca 0.05 -1.51 0.04 0.00 -0.96 0.00 0.00 56.93 54.55 2eny s PHE 82 Cb -0.15 -2.05 -0.03 0.00 -0.34 0.00 0.00 43.02 40.45 2eny s PHE 82 CO 0.02 -0.72 -0.09 -1.12 -1.46 0.00 0.00 175.22 171.85 2eny s SER 83 N 1.33 4.43 -0.22 6.13 0.01 0.72 -1.30 113.70 124.81 2eny s SER 83 Ca 0.01 -0.20 -0.15 0.00 1.31 0.00 0.00 55.95 56.93 2eny s SER 83 Cb -0.16 -0.98 0.06 0.00 0.21 0.00 0.00 66.02 65.15 2eny s SER 83 CO -0.05 0.28 0.55 0.54 0.41 0.00 0.00 173.24 174.97 2eny s VAL 84 N -0.96 -0.01 -0.79 3.43 0.11 -0.34 -0.49 120.40 121.35 2eny s VAL 84 Ca 0.16 0.03 -0.07 0.00 -2.93 0.00 0.00 61.98 59.17 2eny s VAL 84 Cb -0.11 -0.79 0.07 0.00 -1.53 0.00 0.00 36.38 34.02 2eny s VAL 84 CO 0.06 0.01 0.23 -2.11 -3.33 0.00 0.00 175.10 169.97 2eny n ARG 85 N 3.77 -2.47 0.00 1.54 1.85 -1.25 0.46 116.66 120.55 2eny n ARG 85 Ca -0.19 0.18 0.00 0.00 -1.00 0.00 0.00 57.85 56.84 2eny n ARG 85 Cb 0.57 -4.75 0.00 0.00 -1.05 0.00 0.00 32.46 27.22 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 3.06 3.36 2.89 0.00 -1.26 -5.05 105.19 107.39 2eny n GLY 86 Ca 0.01 -0.86 -0.33 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.06 -3.65 0.99 4.77 0.17 -5.01 117.00 113.21 2eny n LEU 87 Ca 0.00 0.29 -0.07 0.00 -0.03 0.00 0.00 56.01 56.19 2eny n LEU 87 Cb 0.00 -1.14 -0.08 0.00 -2.33 0.00 0.00 43.42 39.88 2eny n LEU 87 CO 0.00 -3.90 0.29 -0.89 -1.33 0.00 0.00 177.39 171.56 2eny s THR 88 N -2.34 -0.06 0.52 -5.08 2.01 -1.26 -1.20 115.64 108.23 2eny s THR 88 Ca 0.55 0.02 0.01 0.00 0.31 0.00 0.00 61.69 62.57 2eny s THR 88 Cb -0.20 -0.93 0.01 0.00 0.01 0.00 0.00 72.50 71.39 2eny s THR 88 CO 0.69 0.01 0.08 -0.24 -0.69 0.00 0.00 174.62 174.47 2eny n SER 89 N 4.38 3.29 -3.88 3.53 2.88 -0.42 -4.98 113.62 118.42 2eny n SER 89 Ca -0.20 -3.18 -0.10 0.00 -1.33 0.00 0.00 58.87 54.06 2eny n SER 89 Cb 0.58 0.28 -0.09 0.00 -0.75 0.00 0.00 64.21 64.22 2eny n SER 89 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2eny s LYS 90 N -3.93 0.56 0.22 -1.46 1.02 -1.26 -3.31 119.74 111.59 2eny s LYS 90 Ca 0.06 -0.56 -0.22 0.00 0.02 0.00 0.00 55.97 55.27 2eny s LYS 90 Cb -0.00 0.23 0.04 0.00 -0.52 0.00 0.00 37.83 37.58 2eny s LYS 90 CO 0.04 -0.14 0.66 0.00 -0.92 0.00 0.00 175.35 174.98 2eny s ALA 91 N -2.03 -1.40 -0.11 5.17 0.00 -0.65 -4.42 121.76 118.32 2eny s ALA 91 Ca -0.10 0.08 0.03 0.00 0.00 0.00 0.00 51.96 51.97 2eny s ALA 91 Cb -0.04 0.87 0.01 0.00 0.00 0.00 0.00 23.12 23.96 2eny s ALA 91 CO -0.02 -0.90 -0.21 -1.12 0.00 0.00 0.00 175.76 173.51 2eny s SER 92 N -2.84 2.84 -0.17 0.00 0.01 -1.26 -0.72 113.70 111.56 2eny s SER 92 Ca 0.06 -0.52 -0.05 0.00 1.31 0.00 0.00 55.95 56.75 2eny s SER 92 Cb -0.03 -1.30 -0.03 0.00 0.21 0.00 0.00 66.02 64.86 2eny s SER 92 CO -0.03 0.10 -0.01 -0.22 0.41 0.00 0.00 173.24 173.49 2eny s LEU 93 N 0.64 3.39 -0.29 2.44 2.96 -1.25 -0.38 118.68 126.19 2eny s LEU 93 Ca -0.13 -0.09 -0.03 0.00 -0.22 0.00 0.00 54.13 53.66 2eny s LEU 93 Cb -0.16 -1.83 0.04 0.00 0.50 0.00 0.00 46.19 44.73 2eny s LEU 93 CO 0.03 0.15 0.01 -0.63 -1.32 0.00 0.00 176.35 174.59 2eny s ILE 94 N 0.49 3.20 -0.27 6.68 1.01 -0.29 -3.12 121.20 128.90 2eny s ILE 94 Ca -0.01 -1.15 0.03 0.00 0.00 0.00 0.00 60.65 59.52 2eny s ILE 94 Cb -0.14 -2.75 0.07 0.00 0.01 0.00 0.00 42.46 39.65 2eny s ILE 94 CO 0.02 -0.00 -0.05 -0.69 0.00 0.00 0.00 174.94 174.22 2eny s VAL 95 N 1.33 1.99 0.13 2.92 1.01 -1.26 -1.53 120.40 124.99 2eny s VAL 95 Ca -0.02 -1.68 -0.23 0.00 0.00 0.00 0.00 61.98 60.04 2eny s VAL 95 Cb -0.18 -2.23 -0.07 0.00 0.00 0.00 0.00 36.38 33.90 2eny s VAL 95 CO -0.01 -0.20 0.71 -0.13 0.00 0.00 0.00 175.10 175.47 2eny s ARG 96 N 1.15 4.45 0.50 2.72 1.81 -1.16 -4.25 118.95 124.17 2eny s ARG 96 Ca -0.03 1.02 -0.20 0.00 -1.72 0.00 0.00 55.73 54.80 2eny s ARG 96 Cb -0.19 -3.26 -0.08 0.00 -0.45 0.00 0.00 34.95 30.96 2eny s ARG 96 CO -0.07 0.57 1.05 -1.83 -0.68 0.00 0.00 175.30 174.34 2eny s GLU 97 N -1.05 3.73 0.28 3.54 -1.05 -1.26 -0.41 118.70 122.48 2eny s GLU 97 Ca 0.34 1.39 -0.04 0.00 -0.15 0.00 0.00 54.97 56.50 2eny s GLU 97 Cb -0.22 -2.08 -0.05 0.00 -0.44 0.00 0.00 34.13 31.34 2eny s GLU 97 CO 0.24 -0.50 0.54 -0.98 0.95 0.00 0.00 175.26 175.51 2eny s ARG 98 N -3.27 3.62 -0.34 -4.83 1.04 -1.26 -4.84 118.95 109.07 2eny s ARG 98 Ca 0.68 -0.03 0.03 0.00 -1.04 0.00 0.00 55.73 55.36 2eny s ARG 98 Cb -0.17 -2.66 0.10 0.00 -2.04 0.00 0.00 34.95 30.17 2eny s ARG 98 CO 0.21 0.23 0.06 0.45 -0.04 0.00 0.00 175.30 176.21 2eny s SER 99 N -3.18 4.82 0.83 -2.89 0.15 -1.26 -5.06 113.70 107.10 2eny s SER 99 Ca 0.43 -2.03 0.00 0.00 0.70 0.00 0.00 55.95 55.06 2eny s SER 99 Cb -0.11 -1.66 0.00 0.00 -1.71 0.00 0.00 66.02 62.55 2eny s SER 99 CO 0.30 -0.38 0.00 0.61 1.20 0.00 0.00 173.24 174.97 2eny n GLY 100 N 4.34 0.89 0.18 9.45 0.00 -1.26 -3.41 105.19 115.38 2eny n GLY 100 Ca 0.00 -0.81 0.03 0.00 0.00 0.00 0.00 46.02 45.24 2eny n GLY 100 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eny h PRO 101 N 0.00 0.00 -7.13 1.61 0.13 -2.07 -3.44 132.00 121.10 2eny h PRO 101 Ca 0.00 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.66 2eny h PRO 101 Cb 0.00 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.15 2eny h PRO 101 CO 0.00 0.43 0.37 -1.54 -0.23 0.00 0.00 178.00 177.03 2eny s SER 102 N -6.75 6.38 -0.24 1.44 1.04 -1.22 -5.07 113.70 109.28 2eny s SER 102 Ca -0.02 1.77 -0.12 0.00 0.48 0.00 0.00 55.95 58.07 2eny s SER 102 Cb 0.13 -2.54 0.08 0.00 0.10 0.00 0.00 66.02 63.80 2eny s SER 102 CO 0.72 -0.75 0.56 -0.55 0.98 0.00 0.00 173.24 174.20 2eny s SER 103 N -2.47 -0.75 0.00 7.02 0.15 -1.26 -4.19 113.70 112.20 2eny s SER 103 Ca 0.63 1.27 0.00 0.00 0.70 0.00 0.00 55.95 58.55 2eny s SER 103 Cb -0.13 1.36 0.00 0.00 -1.71 0.00 0.00 66.02 65.53 2eny s SER 103 CO 0.25 -0.22 0.16 0.61 1.20 0.00 0.00 173.24 175.24