#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 1.51 -0.02 1.61 1.04 -1.26 -5.06 113.70 111.53 2eny s SER 2 Ca 0.00 -0.31 -0.25 0.00 0.48 0.00 0.00 55.95 55.87 2eny s SER 2 Cb 0.00 -0.14 -0.20 0.00 0.10 0.00 0.00 66.02 65.78 2eny s SER 2 CO 0.00 0.11 1.27 -1.28 0.98 0.00 0.00 173.24 174.31 2eny h SER 3 N 5.51 -0.03 -3.55 7.02 0.87 -2.12 -3.45 113.55 117.80 2eny h SER 3 Ca -0.35 -0.43 -0.43 0.00 -1.23 0.00 0.00 61.79 59.35 2eny h SER 3 Cb 1.17 0.01 0.19 0.00 -0.44 0.00 0.00 62.40 63.33 2eny h SER 3 CO 0.47 0.42 0.10 -0.83 -0.53 0.00 0.00 176.83 176.47 2eny s GLY 4 N -3.10 1.55 -0.09 5.77 0.00 -1.26 -5.07 107.32 105.11 2eny s GLY 4 Ca -0.15 -0.56 -0.04 0.00 0.00 0.00 0.00 44.72 43.97 2eny s GLY 4 CO 0.65 0.20 0.20 -0.45 0.00 0.00 0.00 173.10 173.71 2eny s SER 5 N -3.38 0.10 -0.27 1.64 0.15 -1.26 -5.15 113.70 105.53 2eny s SER 5 Ca 0.68 0.42 -0.25 0.00 0.70 0.00 0.00 55.95 57.50 2eny s SER 5 Cb -0.17 0.35 0.10 0.00 -1.71 0.00 0.00 66.02 64.60 2eny s SER 5 CO 0.59 -0.19 0.92 -0.94 1.20 0.00 0.00 173.24 174.82 2eny s SER 6 N 1.63 -0.55 0.00 5.45 1.04 -1.26 -5.16 113.70 114.85 2eny s SER 6 Ca -0.05 1.05 0.00 0.00 0.48 0.00 0.00 55.95 57.43 2eny s SER 6 Cb -0.11 1.05 0.00 0.00 0.10 0.00 0.00 66.02 67.06 2eny s SER 6 CO -0.07 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.56 2eny n GLY 7 N 2.30 0.92 3.14 7.32 0.00 -1.26 -5.01 105.19 112.60 2eny n GLY 7 Ca -0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.64 2eny n GLY 7 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2eny n HIS 8 N 0.00 -2.01 -4.39 1.61 -0.00 -1.26 -5.03 115.22 104.14 2eny n HIS 8 Ca 0.00 0.02 -0.29 0.00 -0.00 0.00 0.00 57.72 57.45 2eny n HIS 8 Cb 0.00 -1.45 -0.06 0.00 -0.00 0.00 0.00 29.99 28.48 2eny n HIS 8 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.34 176.48 2eny s VAL 9 N -2.14 1.58 -0.28 1.59 -7.23 -1.26 -5.15 120.40 107.50 2eny s VAL 9 Ca 0.46 -1.80 -0.15 0.00 -1.81 0.00 0.00 61.98 58.69 2eny s VAL 9 Cb -0.08 -2.38 0.09 0.00 0.56 0.00 0.00 36.38 34.57 2eny s VAL 9 CO 0.50 0.00 0.69 -0.83 -0.31 0.00 0.00 175.10 175.14 2eny s GLY 10 N -3.98 -0.65 0.05 2.32 0.00 -1.26 -5.09 107.32 98.71 2eny s GLY 10 Ca 0.23 2.42 -0.34 0.00 0.00 0.00 0.00 44.72 47.03 2eny s GLY 10 CO 0.13 2.56 0.86 1.39 0.00 0.00 0.00 173.10 178.04 2eny n ILE 11 N 4.57 0.50 -0.10 0.90 5.41 -1.26 -4.25 119.36 125.13 2eny n ILE 11 Ca -0.18 -0.13 -0.10 0.00 1.00 0.00 0.00 62.75 63.34 2eny n ILE 11 Cb 0.57 0.00 -0.15 0.00 -0.71 0.00 0.00 39.64 39.34 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 1.02 1.36 -3.21 1.39 5.66 -1.26 -4.64 114.28 114.60 2eny n THR 12 Ca 0.18 -0.83 -0.32 0.00 -3.05 0.00 0.00 64.05 60.04 2eny n THR 12 Cb 0.12 -0.51 -0.05 0.00 -1.55 0.00 0.00 70.33 68.34 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 -2.75 3.27 -1.59 1.09 4.81 -1.26 -5.07 118.16 116.66 2eny n LYS 13 Ca -0.33 -4.67 -0.40 0.00 -0.87 0.00 0.00 58.31 52.04 2eny n LYS 13 Cb 1.14 -2.33 0.03 0.00 0.02 0.00 0.00 35.03 33.89 2eny n LYS 13 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 2eny n ARG 14 N 0.76 1.06 -0.83 1.64 1.85 -1.26 -4.02 116.66 115.85 2eny n ARG 14 Ca 0.30 0.39 -0.33 0.00 -1.00 0.00 0.00 57.85 57.21 2eny n ARG 14 Cb 0.38 -2.03 0.11 0.00 -1.05 0.00 0.00 32.46 29.87 2eny n ARG 14 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2eny n LEU 15 N 0.07 -1.18 -4.18 2.89 4.77 -1.26 -5.02 117.00 113.09 2eny n LEU 15 Ca 0.11 0.30 -0.21 0.00 -0.03 0.00 0.00 56.01 56.19 2eny n LEU 15 Cb 0.43 -1.13 -0.13 0.00 -2.33 0.00 0.00 43.42 40.26 2eny n LEU 15 CO 0.53 -4.04 -0.48 -0.75 -1.33 0.00 0.00 177.39 171.33 2eny s LYS 16 N -3.37 0.98 -0.06 3.23 2.36 -1.26 -4.94 119.74 116.68 2eny s LYS 16 Ca 0.54 -0.88 -0.30 0.00 -2.55 0.00 0.00 55.97 52.79 2eny s LYS 16 Cb -0.21 -1.03 -0.06 0.00 -1.05 0.00 0.00 37.83 35.48 2eny s LYS 16 CO 0.70 0.25 1.71 0.99 1.55 0.00 0.00 175.35 180.55 2eny s THR 17 N -0.99 3.50 0.49 3.43 2.01 -1.26 -4.76 115.64 118.07 2eny s THR 17 Ca 0.02 0.60 0.03 0.00 0.31 0.00 0.00 61.69 62.65 2eny s THR 17 Cb -0.09 -3.41 0.09 0.00 0.01 0.00 0.00 72.50 69.11 2eny s THR 17 CO 0.02 -0.08 0.68 0.23 -0.69 0.00 0.00 174.62 174.78 2eny n MET 18 N 7.29 0.34 -3.15 4.92 2.81 -1.20 -5.02 117.12 123.12 2eny n MET 18 Ca 0.18 -2.15 0.04 0.00 -1.81 0.00 0.00 57.70 53.96 2eny n MET 18 Cb 0.43 -0.36 -0.01 0.00 -0.71 0.00 0.00 33.22 32.57 2eny n MET 18 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2eny s GLU 19 N -4.21 0.50 0.41 0.03 2.12 -1.26 -3.82 118.70 112.46 2eny s GLU 19 Ca 0.48 0.85 0.05 0.00 0.36 0.00 0.00 54.97 56.71 2eny s GLU 19 Cb -0.03 0.47 -0.02 0.00 0.26 0.00 0.00 34.13 34.81 2eny s GLU 19 CO 0.31 -0.58 0.17 0.14 -0.54 0.00 0.00 175.26 174.76 2eny s VAL 20 N 2.87 0.40 -0.03 3.70 -7.23 -1.08 -5.04 120.40 114.00 2eny s VAL 20 Ca 0.17 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.38 2eny s VAL 20 Cb -0.14 -2.33 -0.03 0.00 0.56 0.00 0.00 36.38 34.45 2eny s VAL 20 CO -0.20 0.00 -0.13 -0.22 -0.31 0.00 0.00 175.10 174.24 2eny s LEU 21 N -3.58 2.83 -0.22 1.32 2.96 -1.26 -2.68 118.68 118.05 2eny s LEU 21 Ca 0.26 -0.21 -0.41 0.00 -0.22 0.00 0.00 54.13 53.55 2eny s LEU 21 Cb 0.02 -1.61 -0.18 0.00 0.50 0.00 0.00 46.19 44.92 2eny s LEU 21 CO 0.18 0.32 1.53 1.21 -1.32 0.00 0.00 176.35 178.27 2eny n GLU 22 N 2.04 0.70 0.00 1.98 2.13 0.78 -0.71 120.64 127.55 2eny n GLU 22 Ca -0.17 0.25 0.00 0.00 0.66 0.00 0.00 57.16 57.91 2eny n GLU 22 Cb 0.52 -1.86 0.00 0.00 0.27 0.00 0.00 31.44 30.38 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 3.43 1.71 3.74 8.31 0.00 -1.18 -4.64 105.19 116.56 2eny n GLY 23 Ca 0.25 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.01 0.39 -0.08 1.61 0.41 0.11 -4.63 118.70 116.49 2eny s GLU 24 Ca 0.00 0.15 0.02 0.00 -0.41 0.00 0.00 54.97 54.73 2eny s GLU 24 Cb 0.00 -1.76 0.01 0.00 -1.78 0.00 0.00 34.13 30.60 2eny s GLU 24 CO 0.00 -2.68 -0.13 -1.54 -0.49 0.00 0.00 175.26 170.41 2eny s SER 25 N -4.01 2.05 0.37 -0.19 1.04 -1.26 -3.52 113.70 108.18 2eny s SER 25 Ca 0.67 -0.35 0.02 0.00 0.48 0.00 0.00 55.95 56.77 2eny s SER 25 Cb -0.13 -0.93 -0.01 0.00 0.10 0.00 0.00 66.02 65.06 2eny s SER 25 CO 0.55 0.03 0.07 0.00 0.98 0.00 0.00 173.24 174.86 2eny s SER 27 N -3.13 -0.82 -0.13 0.00 1.04 -1.26 -0.55 113.70 108.85 2eny s SER 27 Ca 0.09 1.33 -0.16 0.00 0.48 0.00 0.00 55.95 57.70 2eny s SER 27 Cb 0.00 1.27 -0.05 0.00 0.10 0.00 0.00 66.02 67.35 2eny s SER 27 CO 0.07 -0.23 0.38 -0.36 0.98 0.00 0.00 173.24 174.08 2eny s PHE 28 N 1.67 3.51 -0.08 5.02 0.08 -1.20 -4.89 117.98 122.09 2eny s PHE 28 Ca -0.09 0.76 0.01 0.00 0.12 0.00 0.00 56.93 57.72 2eny s PHE 28 Cb -0.07 -2.42 -0.03 0.00 -0.57 0.00 0.00 43.02 39.94 2eny s PHE 28 CO -0.18 0.25 -0.08 -1.21 -0.10 0.00 0.00 175.22 173.90 2eny s GLU 29 N 0.38 2.89 -0.04 0.44 2.02 -1.26 -2.23 118.70 120.90 2eny s GLU 29 Ca 0.21 -0.58 -0.00 0.00 0.02 0.00 0.00 54.97 54.62 2eny s GLU 29 Cb -0.14 -2.60 0.03 0.00 0.10 0.00 0.00 34.13 31.51 2eny s GLU 29 CO 0.07 0.56 0.00 0.00 0.02 0.00 0.00 175.26 175.91 2eny s VAL 31 N 1.43 4.01 -0.02 0.00 1.01 -1.26 -1.78 120.40 123.80 2eny s VAL 31 Ca -0.04 -1.34 0.08 0.00 0.00 0.00 0.00 61.98 60.68 2eny s VAL 31 Cb -0.13 -3.05 -0.02 0.00 0.00 0.00 0.00 36.38 33.18 2eny s VAL 31 CO -0.03 -0.15 -0.25 -0.76 0.00 0.00 0.00 175.10 173.91 2eny s LEU 32 N -3.11 2.05 0.20 3.92 1.43 -1.11 -4.06 118.68 118.00 2eny s LEU 32 Ca 0.29 -0.46 -0.15 0.00 -1.03 0.00 0.00 54.13 52.79 2eny s LEU 32 Cb -0.09 -1.31 0.21 0.00 0.03 0.00 0.00 46.19 45.03 2eny s LEU 32 CO 0.21 0.31 1.62 -1.28 0.23 0.00 0.00 176.35 177.44 2eny h SER 33 N 5.52 -0.63 -2.82 2.29 0.87 -1.90 -3.40 113.55 113.48 2eny h SER 33 Ca -0.42 0.19 -0.65 0.00 -1.23 0.00 0.00 61.79 59.68 2eny h SER 33 Cb 1.12 0.40 -0.07 0.00 -0.44 0.00 0.00 62.40 63.42 2eny h SER 33 CO 0.47 -0.22 -0.50 -1.00 -0.53 0.00 0.00 176.83 175.05 2eny s HIS 34 N -6.21 3.52 0.92 2.24 3.76 -1.26 -5.06 115.29 113.20 2eny s HIS 34 Ca -0.14 0.38 -0.15 0.00 -0.15 0.00 0.00 55.06 55.00 2eny s HIS 34 Cb 0.19 -1.84 -0.04 0.00 1.11 0.00 0.00 32.58 31.99 2eny s HIS 34 CO 0.73 0.65 0.02 0.39 -0.85 0.00 0.00 174.74 175.68 2eny n GLU 35 N 1.27 -0.11 -3.37 1.40 1.02 -1.26 -4.92 120.64 114.67 2eny n GLU 35 Ca -0.14 -0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.61 2eny n GLU 35 Cb 0.53 -1.55 -0.08 0.00 -0.02 0.00 0.00 31.44 30.32 2eny n GLU 35 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2eny s SER 36 N -1.59 6.34 -1.03 1.62 0.01 -1.26 -5.00 113.70 112.79 2eny s SER 36 Ca 0.53 0.40 -0.03 0.00 1.31 0.00 0.00 55.95 58.16 2eny s SER 36 Cb -0.23 -2.23 0.30 0.00 0.21 0.00 0.00 66.02 64.08 2eny s SER 36 CO 0.71 -0.16 1.41 0.00 0.41 0.00 0.00 173.24 175.61 2eny n ALA 37 N 5.06 5.10 -3.87 1.44 0.00 -1.26 -4.77 120.51 122.20 2eny n ALA 37 Ca -0.08 -4.80 -0.28 0.00 0.00 0.00 0.00 53.44 48.28 2eny n ALA 37 Cb 0.51 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.79 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 1.20 -2.06 -4.89 0.00 3.41 -1.26 -4.95 113.62 105.07 2eny n SER 38 Ca 0.27 -1.03 -0.33 0.00 -0.26 0.00 0.00 58.87 57.52 2eny n SER 38 Cb 0.34 -3.09 -0.05 0.00 -0.26 0.00 0.00 64.21 61.15 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 -4.05 6.47 0.61 4.04 1.11 -1.26 -5.09 116.67 118.51 2eny s ASP 39 Ca 0.17 0.52 -0.17 0.00 0.18 0.00 0.00 52.55 53.26 2eny s ASP 39 Cb -0.07 -2.07 -0.02 0.00 1.07 0.00 0.00 42.92 41.83 2eny s ASP 39 CO 0.88 0.19 1.12 -2.16 1.18 0.00 0.00 175.17 176.38 2eny s PRO 40 N -2.09 3.01 -0.11 8.23 0.04 -1.26 -5.06 135.00 137.76 2eny s PRO 40 Ca 0.32 1.48 -0.04 0.00 0.04 0.00 0.00 61.00 62.80 2eny s PRO 40 Cb -0.13 -1.97 0.06 0.00 0.04 0.00 0.00 34.50 32.50 2eny s PRO 40 CO 0.20 -1.10 0.21 0.00 0.04 0.00 0.00 177.00 176.35 2eny s ALA 41 N -2.12 -0.35 -0.74 8.56 0.00 -1.26 -4.40 121.76 121.45 2eny s ALA 41 Ca 0.69 0.71 -0.05 0.00 0.00 0.00 0.00 51.96 53.31 2eny s ALA 41 Cb -0.22 -0.94 0.19 0.00 0.00 0.00 0.00 23.12 22.15 2eny s ALA 41 CO 0.36 -0.64 0.60 1.41 0.00 0.00 0.00 175.76 177.49 2eny s MET 42 N 2.35 2.97 -0.06 0.00 1.75 -1.18 -5.05 119.30 120.09 2eny s MET 42 Ca 0.02 -2.71 -0.30 0.00 -1.25 0.00 0.00 55.69 51.46 2eny s MET 42 Cb -0.12 -3.94 -0.06 0.00 2.84 0.00 0.00 34.83 33.55 2eny s MET 42 CO -0.07 -1.22 1.77 -1.58 -0.65 0.00 0.00 175.02 173.27 2eny s TRP 43 N -0.36 1.75 -0.24 4.11 0.52 -1.26 -3.60 118.94 119.87 2eny s TRP 43 Ca 0.20 0.08 0.02 0.00 0.02 0.00 0.00 56.10 56.42 2eny s TRP 43 Cb -0.15 -4.01 0.04 0.00 -1.15 0.00 0.00 33.47 28.20 2eny s TRP 43 CO -0.06 -4.21 -0.13 0.95 0.02 0.00 0.00 176.95 173.52 2eny s THR 44 N 4.57 2.23 -0.44 2.01 -4.23 0.31 -1.41 115.64 118.68 2eny s THR 44 Ca 0.79 -1.36 0.04 0.00 -1.18 0.00 0.00 61.69 59.98 2eny s THR 44 Cb -0.35 -2.19 0.12 0.00 1.34 0.00 0.00 72.50 71.42 2eny s THR 44 CO 0.33 0.16 0.17 0.54 -0.54 0.00 0.00 174.62 175.28 2eny s VAL 45 N 1.18 2.38 0.00 2.29 0.11 -1.20 0.48 120.40 125.65 2eny s VAL 45 Ca -0.04 -2.86 0.00 0.00 -2.93 0.00 0.00 61.98 56.15 2eny s VAL 45 Cb -0.18 -2.70 0.00 0.00 -1.53 0.00 0.00 36.38 31.97 2eny s VAL 45 CO -0.07 -0.72 0.00 0.61 -3.33 0.00 0.00 175.10 171.59 2eny n GLY 46 N 3.62 1.01 0.00 6.54 0.00 -0.92 -4.65 105.19 110.79 2eny n GLY 46 Ca 0.05 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 0.18 3.62 -0.02 0.00 -1.26 -4.95 105.19 102.75 2eny n GLY 47 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 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 0.33 0.72 1.61 -2.85 -1.26 -5.15 119.74 113.14 2eny s LYS 48 Ca 0.00 0.16 -0.14 0.00 -1.00 0.00 0.00 55.97 54.99 2eny s LYS 48 Cb 0.00 0.16 0.03 0.00 -2.06 0.00 0.00 37.83 35.96 2eny s LYS 48 CO 0.00 -0.09 1.14 -0.08 0.10 0.00 0.00 175.35 176.43 2eny s THR 49 N -0.70 2.83 0.17 3.79 -1.32 -1.26 -3.21 115.64 115.93 2eny s THR 49 Ca 0.04 0.37 0.02 0.00 -1.21 0.00 0.00 61.69 60.90 2eny s THR 49 Cb -0.02 -2.85 -0.05 0.00 -1.51 0.00 0.00 72.50 68.07 2eny s THR 49 CO -0.05 -0.26 -0.01 0.68 -2.21 0.00 0.00 174.62 172.77 2eny s VAL 50 N -2.32 0.75 0.00 5.08 -7.23 -0.50 -4.95 120.40 111.23 2eny s VAL 50 Ca 0.69 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.87 2eny s VAL 50 Cb -0.23 -2.07 0.00 0.00 0.56 0.00 0.00 36.38 34.64 2eny s VAL 50 CO 0.46 -0.53 0.00 0.61 -0.31 0.00 0.00 175.10 175.33 2eny n GLY 51 N -0.23 0.00 2.37 2.32 0.00 -1.26 -4.64 105.19 103.75 2eny n GLY 51 Ca -0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 2eny n GLY 51 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2eny n SER 52 N 0.00 -3.60 0.04 1.61 2.88 -0.97 -4.93 113.62 108.65 2eny n SER 52 Ca 0.00 -0.66 -0.20 0.00 -1.33 0.00 0.00 58.87 56.68 2eny n SER 52 Cb 0.00 -0.74 -0.11 0.00 -0.75 0.00 0.00 64.21 62.61 2eny n SER 52 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2eny h SER 53 N -3.22 0.84 0.00 -3.46 0.87 -2.03 -3.41 113.55 103.14 2eny h SER 53 Ca -0.29 -0.76 0.00 0.00 -1.23 0.00 0.00 61.79 59.50 2eny h SER 53 Cb 0.99 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.69 2eny h SER 53 CO 0.18 1.49 -0.27 -1.20 -0.53 0.00 0.00 176.83 176.50 2eny n SER 54 N -3.92 0.38 -0.02 6.23 7.64 -1.26 -4.83 113.62 117.84 2eny n SER 54 Ca -0.11 0.16 -0.01 0.00 1.01 0.00 0.00 58.87 59.92 2eny n SER 54 Cb 0.86 -0.04 -0.01 0.00 -1.01 0.00 0.00 64.21 64.02 2eny n SER 54 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2eny n ARG 55 N -3.22 -0.02 -3.60 1.43 0.63 -1.26 -3.43 116.66 107.18 2eny n ARG 55 Ca 0.00 0.75 -0.40 0.00 -0.92 0.00 0.00 57.85 57.28 2eny n ARG 55 Cb 0.13 -1.13 -0.09 0.00 0.45 0.00 0.00 32.46 31.83 2eny n ARG 55 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2eny s PHE 56 N -3.18 3.47 -0.58 -0.14 0.08 -1.26 -0.89 117.98 115.49 2eny s PHE 56 Ca -0.01 -2.02 -0.14 0.00 0.12 0.00 0.00 56.93 54.89 2eny s PHE 56 Cb 0.01 -3.44 0.14 0.00 -0.57 0.00 0.00 43.02 39.16 2eny s PHE 56 CO 0.03 -0.99 0.51 -1.14 -0.10 0.00 0.00 175.22 173.54 2eny s GLN 57 N 1.25 2.97 -0.93 0.44 2.00 -0.64 -2.29 119.66 122.46 2eny s GLN 57 Ca 0.07 -1.88 -0.20 0.00 -2.00 0.00 0.00 55.36 51.35 2eny s GLN 57 Cb -0.25 -4.22 0.11 0.00 0.80 0.00 0.00 33.01 29.45 2eny s GLN 57 CO -0.02 -1.29 1.18 0.00 -0.50 0.00 0.00 175.29 174.66 2eny s ALA 58 N 1.25 3.23 0.33 1.58 0.00 -1.26 -1.15 121.76 125.74 2eny s ALA 58 Ca 0.07 -2.62 -0.09 0.00 0.00 0.00 0.00 51.96 49.32 2eny s ALA 58 Cb -0.25 -4.13 -0.06 0.00 0.00 0.00 0.00 23.12 18.67 2eny s ALA 58 CO -0.00 -3.09 0.67 0.95 0.00 0.00 0.00 175.76 174.28 2eny s THR 59 N 3.20 4.87 -0.27 0.00 -4.23 0.54 -4.95 115.64 114.79 2eny s THR 59 Ca 0.35 0.47 0.02 0.00 -1.18 0.00 0.00 61.69 61.35 2eny s THR 59 Cb -0.05 -3.70 0.07 0.00 1.34 0.00 0.00 72.50 70.17 2eny s THR 59 CO -0.08 -0.35 -0.05 -0.60 -0.54 0.00 0.00 174.62 173.00 2eny s ARG 60 N -3.49 1.84 -0.28 3.99 3.52 -1.26 -1.97 118.95 121.30 2eny s ARG 60 Ca 0.49 -1.33 -0.02 0.00 -0.13 0.00 0.00 55.73 54.73 2eny s ARG 60 Cb -0.11 -2.82 0.04 0.00 -1.56 0.00 0.00 34.95 30.50 2eny s ARG 60 CO 0.27 -0.67 -0.02 -0.65 -0.81 0.00 0.00 175.30 173.42 2eny s GLN 61 N 1.17 2.59 1.88 5.12 -1.52 -0.17 -5.02 119.66 123.70 2eny s GLN 61 Ca -0.03 -1.16 0.00 0.00 -1.95 0.00 0.00 55.36 52.22 2eny s GLN 61 Cb -0.19 -3.11 0.00 0.00 -0.22 0.00 0.00 33.01 29.48 2eny s GLN 61 CO -0.07 -0.54 0.00 0.41 -0.25 0.00 0.00 175.29 174.84 2eny n GLY 62 N 4.64 2.38 1.00 3.09 0.00 -1.26 0.39 105.19 115.44 2eny n GLY 62 Ca -0.14 -0.13 -0.01 0.00 0.00 0.00 0.00 46.02 45.74 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 -4.18 1.61 1.85 -1.26 -4.55 116.66 125.86 2eny n ARG 63 Ca 0.00 -0.75 -0.11 0.00 -1.00 0.00 0.00 57.85 55.99 2eny n ARG 63 Cb 0.00 -1.55 -0.10 0.00 -1.05 0.00 0.00 32.46 29.76 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 -1.21 0.86 0.09 2.89 2.20 0.16 -2.77 119.74 121.96 2eny s LYS 64 Ca 0.13 -1.34 0.04 0.00 -0.36 0.00 0.00 55.97 54.44 2eny s LYS 64 Cb 0.11 -0.25 -0.03 0.00 -1.51 0.00 0.00 37.83 36.14 2eny s LYS 64 CO 0.03 -0.01 -0.11 0.71 -0.36 0.00 0.00 175.35 175.62 2eny s TYR 65 N -3.57 1.07 -0.08 4.03 1.51 -0.73 -1.00 117.35 118.57 2eny s TYR 65 Ca 0.12 -0.62 -0.03 0.00 -1.01 0.00 0.00 57.07 55.53 2eny s TYR 65 Cb 0.05 -0.59 0.04 0.00 -0.11 0.00 0.00 41.96 41.36 2eny s TYR 65 CO -0.04 0.01 0.15 0.42 -1.11 0.00 0.00 175.55 174.98 2eny s ILE 66 N -2.24 -0.22 -0.57 2.71 1.09 -0.83 -2.21 121.20 118.92 2eny s ILE 66 Ca 0.04 0.33 -0.05 0.00 -1.10 0.00 0.00 60.65 59.87 2eny s ILE 66 Cb -0.04 -0.28 0.15 0.00 -1.06 0.00 0.00 42.46 41.23 2eny s ILE 66 CO 0.00 0.14 0.41 -0.22 -0.10 0.00 0.00 174.94 175.17 2eny s LEU 67 N 2.11 5.46 -0.01 2.97 2.96 -0.94 -0.34 118.68 130.89 2eny s LEU 67 Ca 0.01 -2.51 -0.30 0.00 -0.22 0.00 0.00 54.13 51.11 2eny s LEU 67 Cb -0.12 -1.91 -0.07 0.00 0.50 0.00 0.00 46.19 44.60 2eny s LEU 67 CO -0.06 -0.48 1.66 -0.69 -1.32 0.00 0.00 176.35 175.46 2eny s VAL 68 N 0.44 3.40 -0.39 1.68 1.01 -0.30 -3.26 120.40 122.98 2eny s VAL 68 Ca 0.13 0.63 -0.09 0.00 0.00 0.00 0.00 61.98 62.65 2eny s VAL 68 Cb -0.21 -3.40 0.06 0.00 0.00 0.00 0.00 36.38 32.83 2eny s VAL 68 CO -0.04 -0.04 0.21 -0.69 0.00 0.00 0.00 175.10 174.55 2eny s VAL 69 N 3.54 4.21 0.20 2.92 1.01 0.29 -1.63 120.40 130.93 2eny s VAL 69 Ca 0.74 -1.23 0.00 0.00 0.00 0.00 0.00 61.98 61.49 2eny s VAL 69 Cb -0.36 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 2eny s VAL 69 CO 0.31 -0.38 0.37 -0.13 0.00 0.00 0.00 175.10 175.27 2eny s ARG 70 N 1.45 3.50 -1.23 2.72 1.81 -0.07 -2.76 118.95 124.37 2eny s ARG 70 Ca 0.02 -0.42 -0.04 0.00 -1.72 0.00 0.00 55.73 53.57 2eny s ARG 70 Cb -0.21 -2.86 -0.01 0.00 -0.45 0.00 0.00 34.95 31.41 2eny s ARG 70 CO 0.03 0.42 0.77 0.39 -0.68 0.00 0.00 175.30 176.23 2eny n GLU 71 N -0.73 -4.07 -1.69 3.54 -0.58 -1.26 -4.82 120.64 111.04 2eny n GLU 71 Ca -0.05 0.65 -0.45 0.00 -0.42 0.00 0.00 57.16 56.89 2eny n GLU 71 Cb 0.54 -5.16 -0.04 0.00 -0.57 0.00 0.00 31.44 26.21 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 -4.09 1.80 -2.52 0.62 0.00 -1.23 -4.89 120.51 110.20 2eny n ALA 72 Ca -0.23 0.38 -0.26 0.00 0.00 0.00 0.00 53.44 53.33 2eny n ALA 72 Cb 0.66 -2.47 -0.10 0.00 0.00 0.00 0.00 19.45 17.54 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 1.85 2.81 -1.63 0.00 0.00 -1.26 -3.09 121.76 120.44 2eny s ALA 73 Ca 0.81 -1.57 0.15 0.00 0.00 0.00 0.00 51.96 51.35 2eny s ALA 73 Cb -0.60 -0.57 0.81 0.00 0.00 0.00 0.00 23.12 22.77 2eny s ALA 73 CO 0.38 0.43 1.38 -0.35 0.00 0.00 0.00 175.76 177.61 2eny n PRO 74 N 0.00 0.31 -0.09 0.00 -0.04 -1.26 -2.46 135.00 131.46 2eny n PRO 74 Ca -0.11 0.09 -0.12 0.00 -0.04 0.00 0.00 63.50 63.33 2eny n PRO 74 Cb 0.56 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.37 2eny n PRO 74 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2eny n SER 75 N -1.18 0.69 0.19 3.54 7.64 -1.26 -4.27 113.62 118.97 2eny n SER 75 Ca 0.09 0.05 0.04 0.00 1.01 0.00 0.00 58.87 60.06 2eny n SER 75 Cb 0.09 0.42 0.39 0.00 -1.01 0.00 0.00 64.21 64.10 2eny n SER 75 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2eny h ASP 76 N 0.00 0.00 -1.65 6.43 3.32 -1.86 -3.44 116.42 119.22 2eny h ASP 76 Ca -0.50 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.40 2eny h ASP 76 Cb 2.13 0.00 0.08 0.00 0.22 0.00 0.00 39.33 41.76 2eny h ASP 76 CO 0.02 0.35 -0.07 0.00 -1.72 0.00 0.00 179.24 177.82 2eny n ALA 77 N -2.42 -2.07 0.00 3.45 0.00 -1.22 -4.39 120.51 113.86 2eny n ALA 77 Ca -0.02 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.82 2eny n ALA 77 Cb 0.41 -0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.80 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 -1.99 2.35 3.53 0.00 0.00 -1.08 -4.81 105.19 103.19 2eny n GLY 78 Ca 0.05 -0.77 -0.14 0.00 0.00 0.00 0.00 46.02 45.16 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 0.89 -0.23 1.61 2.56 -1.26 -4.21 118.70 118.07 2eny s GLU 79 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 54.97 55.12 2eny s GLU 79 Cb 0.00 0.42 0.06 0.00 2.00 0.00 0.00 34.13 36.61 2eny s GLU 79 CO 0.00 -0.29 -0.05 0.08 -0.56 0.00 0.00 175.26 174.44 2eny s VAL 80 N -1.41 1.44 -0.11 3.70 1.01 0.15 -2.16 120.40 123.02 2eny s VAL 80 Ca -0.06 -1.12 -0.03 0.00 0.00 0.00 0.00 61.98 60.77 2eny s VAL 80 Cb -0.00 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.64 2eny s VAL 80 CO 0.05 -0.08 -0.00 -0.69 0.00 0.00 0.00 175.10 174.37 2eny s VAL 81 N 1.44 4.24 -0.24 2.92 1.01 0.18 -0.97 120.40 128.98 2eny s VAL 81 Ca -0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 61.98 61.67 2eny s VAL 81 Cb -0.18 -2.81 0.07 0.00 0.00 0.00 0.00 36.38 33.46 2eny s VAL 81 CO -0.07 0.57 0.01 0.12 0.00 0.00 0.00 175.10 175.73 2eny s PHE 82 N -0.49 1.87 0.14 5.22 5.36 0.22 -0.53 117.98 129.76 2eny s PHE 82 Ca 0.09 -1.50 -0.13 0.00 -0.96 0.00 0.00 56.93 54.42 2eny s PHE 82 Cb -0.12 -1.48 -0.07 0.00 -0.34 0.00 0.00 43.02 41.02 2eny s PHE 82 CO 0.02 -0.75 0.52 0.45 -1.46 0.00 0.00 175.22 174.00 2eny s SER 83 N 1.57 6.78 -0.29 6.13 0.15 -1.24 -1.32 113.70 125.48 2eny s SER 83 Ca -0.01 1.01 -0.16 0.00 0.70 0.00 0.00 55.95 57.50 2eny s SER 83 Cb -0.18 -2.26 0.15 0.00 -1.71 0.00 0.00 66.02 62.01 2eny s SER 83 CO -0.10 0.11 0.98 0.54 1.20 0.00 0.00 173.24 175.96 2eny s VAL 84 N -1.46 -0.05 -1.14 4.45 0.11 0.14 -3.10 120.40 119.35 2eny s VAL 84 Ca 0.37 0.00 -0.15 0.00 -2.93 0.00 0.00 61.98 59.28 2eny s VAL 84 Cb -0.15 -1.00 0.15 0.00 -1.53 0.00 0.00 36.38 33.85 2eny s VAL 84 CO 0.19 0.00 0.36 -2.11 -3.33 0.00 0.00 175.10 170.21 2eny n ARG 85 N 3.82 -1.52 0.00 1.54 1.85 -1.26 0.21 116.66 121.30 2eny n ARG 85 Ca -0.18 0.08 0.00 0.00 -1.00 0.00 0.00 57.85 56.76 2eny n ARG 85 Cb 0.57 -4.41 0.00 0.00 -1.05 0.00 0.00 32.46 27.57 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 -0.83 2.76 3.75 2.89 0.00 -1.26 -5.03 105.19 107.47 2eny n GLY 86 Ca 0.07 -0.48 -0.37 0.00 0.00 0.00 0.00 46.02 45.24 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 3.78 -0.10 0.99 1.43 0.57 -5.03 118.68 120.32 2eny s LEU 87 Ca 0.00 2.56 -0.03 0.00 -1.03 0.00 0.00 54.13 55.63 2eny s LEU 87 Cb 0.00 -4.42 0.05 0.00 0.03 0.00 0.00 46.19 41.85 2eny s LEU 87 CO 0.00 -1.55 0.14 -0.89 0.23 0.00 0.00 176.35 174.28 2eny s THR 88 N -1.44 -0.23 -0.21 5.49 2.01 -1.26 0.26 115.64 120.27 2eny s THR 88 Ca 0.74 0.27 -0.06 0.00 0.31 0.00 0.00 61.69 62.95 2eny s THR 88 Cb -0.35 -0.34 -0.03 0.00 0.01 0.00 0.00 72.50 71.79 2eny s THR 88 CO 0.40 0.08 0.03 -0.55 -0.69 0.00 0.00 174.62 173.89 2eny s SER 89 N 2.26 5.06 0.26 3.53 0.15 -0.43 -4.89 113.70 119.64 2eny s SER 89 Ca 0.04 -0.15 0.06 0.00 0.70 0.00 0.00 55.95 56.60 2eny s SER 89 Cb -0.13 -1.88 -0.03 0.00 -1.71 0.00 0.00 66.02 62.27 2eny s SER 89 CO -0.06 0.06 0.30 -0.54 1.20 0.00 0.00 173.24 174.19 2eny s LYS 90 N 1.06 3.15 0.26 5.44 1.02 -1.26 -0.61 119.74 128.82 2eny s LYS 90 Ca 0.03 -0.94 -0.20 0.00 0.02 0.00 0.00 55.97 54.88 2eny s LYS 90 Cb -0.14 -2.72 0.06 0.00 -0.52 0.00 0.00 37.83 34.50 2eny s LYS 90 CO 0.02 0.36 0.90 0.00 -0.92 0.00 0.00 175.35 175.72 2eny s ALA 91 N -2.08 -1.25 -0.12 5.17 0.00 -0.14 -4.58 121.76 118.75 2eny s ALA 91 Ca 0.35 -0.41 0.03 0.00 0.00 0.00 0.00 51.96 51.92 2eny s ALA 91 Cb -0.08 0.72 0.01 0.00 0.00 0.00 0.00 23.12 23.76 2eny s ALA 91 CO 0.27 -1.03 -0.20 -1.12 0.00 0.00 0.00 175.76 173.68 2eny s SER 92 N -3.16 2.83 -0.23 0.00 0.01 -1.26 -0.67 113.70 111.22 2eny s SER 92 Ca 0.17 -0.52 -0.08 0.00 1.31 0.00 0.00 55.95 56.83 2eny s SER 92 Cb -0.04 -1.30 -0.03 0.00 0.21 0.00 0.00 66.02 64.86 2eny s SER 92 CO 0.07 0.07 0.08 -0.22 0.41 0.00 0.00 173.24 173.65 2eny s LEU 93 N 0.76 3.61 -0.15 2.44 2.96 -1.26 -3.22 118.68 123.82 2eny s LEU 93 Ca -0.10 -0.09 -0.04 0.00 -0.22 0.00 0.00 54.13 53.67 2eny s LEU 93 Cb -0.16 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.55 2eny s LEU 93 CO 0.01 0.03 0.00 -0.63 -1.32 0.00 0.00 176.35 174.44 2eny s ILE 94 N 1.21 4.25 -0.11 6.68 1.01 -1.25 -2.62 121.20 130.37 2eny s ILE 94 Ca 0.05 -0.24 -0.03 0.00 0.00 0.00 0.00 60.65 60.43 2eny s ILE 94 Cb -0.14 -2.86 0.04 0.00 0.01 0.00 0.00 42.46 39.51 2eny s ILE 94 CO 0.04 0.51 0.06 -0.69 0.00 0.00 0.00 174.94 174.85 2eny s VAL 95 N 0.06 0.07 -0.23 2.92 1.01 -1.26 -2.62 120.40 120.34 2eny s VAL 95 Ca 0.02 0.06 -0.08 0.00 0.00 0.00 0.00 61.98 61.98 2eny s VAL 95 Cb -0.13 -0.47 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 2eny s VAL 95 CO 0.02 -0.00 0.10 -0.13 0.00 0.00 0.00 175.10 175.09 2eny s ARG 96 N 2.08 3.87 0.60 2.72 1.81 -1.09 -4.76 118.95 124.18 2eny s ARG 96 Ca 0.03 -0.38 -0.18 0.00 -1.72 0.00 0.00 55.73 53.49 2eny s ARG 96 Cb -0.14 -3.37 -0.03 0.00 -0.45 0.00 0.00 34.95 30.96 2eny s ARG 96 CO -0.06 0.01 1.15 -1.83 -0.68 0.00 0.00 175.30 173.89 2eny s GLU 97 N 1.12 3.02 -0.09 3.54 -1.05 -1.26 -0.15 118.70 123.83 2eny s GLU 97 Ca 0.05 1.63 -0.13 0.00 -0.15 0.00 0.00 54.97 56.37 2eny s GLU 97 Cb -0.14 -1.96 -0.11 0.00 -0.44 0.00 0.00 34.13 31.49 2eny s GLU 97 CO 0.04 -1.12 0.46 0.00 0.95 0.00 0.00 175.26 175.59 2eny h ARG 98 N 0.72 -0.12 -6.04 -4.83 3.08 -1.96 -3.46 114.38 101.76 2eny h ARG 98 Ca -0.49 0.01 -0.41 0.00 0.07 0.00 0.00 59.98 59.15 2eny h ARG 98 Cb 1.27 0.03 0.06 0.00 0.08 0.00 0.00 29.97 31.41 2eny h ARG 98 CO 0.55 0.22 -0.80 0.43 -1.07 0.00 0.00 179.97 179.30 2eny n SER 99 N -4.83 -2.23 0.00 7.04 7.64 -1.26 -4.96 113.62 115.02 2eny n SER 99 Ca -0.05 -0.76 0.00 0.00 1.01 0.00 0.00 58.87 59.07 2eny n SER 99 Cb 0.20 -4.25 0.00 0.00 -1.01 0.00 0.00 64.21 59.14 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 -1.55 1.90 3.55 0.23 0.00 -1.26 -5.10 105.19 102.96 2eny n GLY 100 Ca -0.22 -0.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.59 2.61 -0.54 1.61 0.04 -1.26 -4.94 135.00 130.92 2eny s PRO 101 Ca 0.00 0.46 -0.12 0.00 0.04 0.00 0.00 61.00 61.38 2eny s PRO 101 Cb 0.00 -4.50 0.14 0.00 0.04 0.00 0.00 34.50 30.18 2eny s PRO 101 CO 0.00 -2.85 0.46 0.45 0.04 0.00 0.00 177.00 175.10 2eny s SER 102 N 8.12 5.98 0.73 6.66 0.15 -1.26 -5.07 113.70 129.02 2eny s SER 102 Ca 0.68 -2.00 -0.14 0.00 0.70 0.00 0.00 55.95 55.19 2eny s SER 102 Cb -0.12 -2.10 0.04 0.00 -1.71 0.00 0.00 66.02 62.13 2eny s SER 102 CO 0.17 -0.73 1.14 -0.94 1.20 0.00 0.00 173.24 174.09 2eny s SER 103 N 2.87 4.42 0.00 5.45 1.04 -1.26 -5.25 113.70 120.97 2eny s SER 103 Ca 0.07 2.12 0.27 0.00 0.48 0.00 0.00 55.95 58.88 2eny s SER 103 Cb -0.26 -2.56 0.84 0.00 0.10 0.00 0.00 66.02 64.15 2eny s SER 103 CO -0.00 -2.10 1.63 0.61 0.98 0.00 0.00 173.24 174.36