#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 4.42 -0.05 1.61 1.04 -1.26 -5.12 113.70 114.35 2eny s SER 2 Ca 0.00 -0.11 0.02 0.00 0.48 0.00 0.00 55.95 56.33 2eny s SER 2 Cb 0.00 -1.19 0.01 0.00 0.10 0.00 0.00 66.02 64.94 2eny s SER 2 CO 0.00 0.32 -0.08 -0.55 0.98 0.00 0.00 173.24 173.90 2eny s SER 3 N -0.54 1.31 -0.24 7.02 0.15 -1.26 -5.13 113.70 115.01 2eny s SER 3 Ca 0.08 -0.21 -0.06 0.00 0.70 0.00 0.00 55.95 56.47 2eny s SER 3 Cb -0.12 -0.56 -0.01 0.00 -1.71 0.00 0.00 66.02 63.62 2eny s SER 3 CO 0.02 0.01 0.02 -0.83 1.20 0.00 0.00 173.24 173.65 2eny s GLY 4 N 0.65 1.69 -0.17 9.45 0.00 -1.26 -5.07 107.32 112.61 2eny s GLY 4 Ca -0.11 -1.20 -0.29 0.00 0.00 0.00 0.00 44.72 43.12 2eny s GLY 4 CO 0.02 0.50 1.47 -0.56 0.00 0.00 0.00 173.10 174.52 2eny s SER 5 N 1.53 6.68 -0.02 1.64 0.01 -1.26 -4.91 113.70 117.37 2eny s SER 5 Ca 0.05 1.75 -0.24 0.00 1.31 0.00 0.00 55.95 58.82 2eny s SER 5 Cb -0.15 -2.54 -0.20 0.00 0.21 0.00 0.00 66.02 63.34 2eny s SER 5 CO 0.00 -0.98 1.17 -1.28 0.41 0.00 0.00 173.24 172.56 2eny h SER 6 N 9.39 0.16 -3.36 2.44 0.87 -2.08 -3.50 113.55 117.48 2eny h SER 6 Ca -0.32 -0.61 0.00 0.00 -1.23 0.00 0.00 61.79 59.63 2eny h SER 6 Cb 1.14 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 2eny h SER 6 CO 0.98 0.75 -0.11 0.61 -0.53 0.00 0.00 176.83 178.53 2eny n GLY 7 N 0.58 -3.78 2.81 5.77 0.00 -1.26 -5.07 105.19 104.23 2eny n GLY 7 Ca -0.08 -0.76 -0.18 0.00 0.00 0.00 0.00 46.02 45.00 2eny n GLY 7 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2eny s HIS 8 N -0.29 -0.23 0.92 1.61 5.65 -1.26 -5.16 115.29 116.53 2eny s HIS 8 Ca 0.00 0.42 -0.15 0.00 0.25 0.00 0.00 55.06 55.58 2eny s HIS 8 Cb 0.00 -0.31 0.24 0.00 -1.18 0.00 0.00 32.58 31.33 2eny s HIS 8 CO 0.00 -0.45 0.54 1.33 -0.65 0.00 0.00 174.74 175.52 2eny n VAL 9 N 5.32 0.00 -3.31 0.89 0.24 -1.26 -5.07 118.33 115.14 2eny n VAL 9 Ca -0.05 -0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.24 2eny n VAL 9 Cb 0.50 -0.63 0.00 0.00 -1.47 0.00 0.00 33.84 32.24 2eny n VAL 9 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2eny n GLY 10 N -3.59 3.16 3.78 7.63 0.00 -1.26 -5.08 105.19 109.83 2eny n GLY 10 Ca 0.09 -1.28 -0.37 0.00 0.00 0.00 0.00 46.02 44.45 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 -2.43 5.23 -0.21 -0.61 1.01 -1.26 -2.42 121.20 120.50 2eny s ILE 11 Ca 0.00 0.65 0.05 0.00 0.00 0.00 0.00 60.65 61.35 2eny s ILE 11 Cb 0.00 -3.66 -0.21 0.00 0.01 0.00 0.00 42.46 38.61 2eny s ILE 11 CO 0.00 0.46 0.00 1.07 0.00 0.00 0.00 174.94 176.48 2eny n THR 12 N 2.87 1.53 -3.48 2.92 5.66 -1.25 -4.75 114.28 117.77 2eny n THR 12 Ca -0.13 -0.67 -0.43 0.00 -3.05 0.00 0.00 64.05 59.78 2eny n THR 12 Cb 0.52 -1.24 -0.05 0.00 -1.55 0.00 0.00 70.33 68.01 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 -2.53 3.10 0.51 1.09 2.20 -1.23 -5.05 119.74 117.83 2eny s LYS 13 Ca -0.25 -2.38 -0.21 0.00 -0.36 0.00 0.00 55.97 52.77 2eny s LYS 13 Cb 0.08 -4.13 -0.06 0.00 -1.51 0.00 0.00 37.83 32.20 2eny s LYS 13 CO 0.70 -1.24 1.17 1.03 -0.36 0.00 0.00 175.35 176.64 2eny s ARG 14 N 0.28 3.50 1.36 4.03 1.81 -1.26 -3.88 118.95 124.79 2eny s ARG 14 Ca 0.15 1.76 -0.21 0.00 -1.72 0.00 0.00 55.73 55.71 2eny s ARG 14 Cb -0.16 -2.21 0.35 0.00 -0.45 0.00 0.00 34.95 32.47 2eny s ARG 14 CO -0.06 -0.76 0.96 -0.51 -0.68 0.00 0.00 175.30 174.25 2eny s LEU 15 N -3.43 -0.64 -0.22 2.53 1.43 -1.26 -5.02 118.68 112.08 2eny s LEU 15 Ca 0.69 0.93 -0.13 0.00 -1.03 0.00 0.00 54.13 54.58 2eny s LEU 15 Cb -0.28 -2.46 0.07 0.00 0.03 0.00 0.00 46.19 43.54 2eny s LEU 15 CO 0.33 -5.07 0.53 -1.59 0.23 0.00 0.00 176.35 170.78 2eny s LYS 16 N -5.01 0.55 0.05 1.70 -2.85 -1.26 -5.04 119.74 107.87 2eny s LYS 16 Ca 0.69 0.94 -0.38 0.00 -1.00 0.00 0.00 55.97 56.22 2eny s LYS 16 Cb -0.15 0.09 -0.17 0.00 -2.06 0.00 0.00 37.83 35.54 2eny s LYS 16 CO 0.59 -0.14 1.31 2.41 0.10 0.00 0.00 175.35 179.62 2eny n THR 17 N 4.02 0.01 -3.82 3.79 -1.04 -1.26 -4.84 114.28 111.15 2eny n THR 17 Ca -0.20 -0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.44 2eny n THR 17 Cb 0.57 -0.68 -0.11 0.00 -1.82 0.00 0.00 70.33 68.29 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 0.56 3.89 -0.19 -2.82 1.75 -0.95 -4.98 119.30 116.55 2eny s MET 18 Ca 0.87 -0.37 -0.02 0.00 -1.25 0.00 0.00 55.69 54.91 2eny s MET 18 Cb -1.03 -3.36 -0.01 0.00 2.84 0.00 0.00 34.83 33.27 2eny s MET 18 CO 0.50 0.04 -0.08 -2.00 -0.65 0.00 0.00 175.02 172.83 2eny s GLU 19 N 1.04 3.35 0.23 4.11 -6.30 -1.26 -1.18 118.70 118.69 2eny s GLU 19 Ca 0.05 -0.66 0.01 0.00 -2.50 0.00 0.00 54.97 51.87 2eny s GLU 19 Cb -0.14 -2.87 -0.00 0.00 0.00 0.00 0.00 34.13 31.12 2eny s GLU 19 CO 0.04 -0.08 0.28 1.33 0.02 0.00 0.00 175.26 176.84 2eny n VAL 20 N 4.42 0.00 -4.22 3.70 0.24 -1.24 -5.02 118.33 116.21 2eny n VAL 20 Ca -0.18 -1.31 -0.35 0.00 -2.04 0.00 0.00 64.34 60.45 2eny n VAL 20 Cb 0.51 0.75 -0.09 0.00 -1.47 0.00 0.00 33.84 33.54 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 3.72 0.16 1.34 0.20 -1.26 -2.54 118.68 120.30 2eny s LEU 21 Ca 0.21 0.15 -0.32 0.00 0.69 0.00 0.00 54.13 54.86 2eny s LEU 21 Cb -0.00 -1.89 -0.16 0.00 -0.43 0.00 0.00 46.19 43.71 2eny s LEU 21 CO 0.15 0.31 1.00 1.21 -0.29 0.00 0.00 176.35 178.73 2eny n GLU 22 N 2.60 0.76 0.00 1.98 2.13 0.90 -1.23 120.64 127.78 2eny n GLU 22 Ca -0.18 0.27 0.00 0.00 0.66 0.00 0.00 57.16 57.91 2eny n GLU 22 Cb 0.53 -1.65 0.00 0.00 0.27 0.00 0.00 31.44 30.59 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 1.85 3.03 3.52 8.31 0.00 -1.25 -4.66 105.19 115.99 2eny n GLY 23 Ca 0.16 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.33 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 -1.51 -0.05 1.61 0.41 -0.36 -4.44 118.70 114.35 2eny s GLU 24 Ca 0.00 0.07 0.01 0.00 -0.41 0.00 0.00 54.97 54.63 2eny s GLU 24 Cb 0.00 -1.55 0.02 0.00 -1.78 0.00 0.00 34.13 30.82 2eny s GLU 24 CO 0.00 -3.93 -0.05 -1.54 -0.49 0.00 0.00 175.26 169.25 2eny s SER 25 N -3.61 1.18 0.42 -0.19 1.04 -1.26 -3.63 113.70 107.64 2eny s SER 25 Ca 0.70 -0.15 0.04 0.00 0.48 0.00 0.00 55.95 57.01 2eny s SER 25 Cb -0.12 -0.51 -0.04 0.00 0.10 0.00 0.00 66.02 65.45 2eny s SER 25 CO 0.57 -0.06 0.06 0.00 0.98 0.00 0.00 173.24 174.79 2eny s SER 27 N -3.67 -0.22 0.68 0.00 1.04 -1.26 0.18 113.70 110.44 2eny s SER 27 Ca 0.24 0.46 -0.04 0.00 0.48 0.00 0.00 55.95 57.08 2eny s SER 27 Cb 0.05 0.38 0.07 0.00 0.10 0.00 0.00 66.02 66.62 2eny s SER 27 CO 0.12 -0.13 0.96 -0.36 0.98 0.00 0.00 173.24 174.81 2eny s PHE 28 N 0.89 2.61 -0.13 5.02 0.08 -1.24 -4.91 117.98 120.29 2eny s PHE 28 Ca -0.06 0.18 -0.09 0.00 0.12 0.00 0.00 56.93 57.08 2eny s PHE 28 Cb -0.08 -3.09 0.04 0.00 -0.57 0.00 0.00 43.02 39.33 2eny s PHE 28 CO -0.05 -1.37 0.33 -1.21 -0.10 0.00 0.00 175.22 172.81 2eny s GLU 29 N -5.13 0.34 -0.08 0.44 2.02 -1.26 -3.48 118.70 111.55 2eny s GLU 29 Ca 0.61 0.57 -0.03 0.00 0.02 0.00 0.00 54.97 56.13 2eny s GLU 29 Cb -0.09 0.05 0.04 0.00 0.10 0.00 0.00 34.13 34.23 2eny s GLU 29 CO 0.43 -0.11 0.17 0.00 0.02 0.00 0.00 175.26 175.78 2eny s VAL 31 N 1.68 3.30 0.08 0.00 1.01 -1.25 -1.76 120.40 123.46 2eny s VAL 31 Ca -0.04 -1.82 0.08 0.00 0.00 0.00 0.00 61.98 60.19 2eny s VAL 31 Cb -0.12 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.52 2eny s VAL 31 CO -0.06 -0.26 -0.16 -0.76 0.00 0.00 0.00 175.10 173.85 2eny s LEU 32 N -3.30 2.74 0.12 3.92 1.43 -1.25 -3.55 118.68 118.81 2eny s LEU 32 Ca 0.29 -0.46 -0.27 0.00 -1.03 0.00 0.00 54.13 52.65 2eny s LEU 32 Cb -0.07 -1.59 -0.06 0.00 0.03 0.00 0.00 46.19 44.50 2eny s LEU 32 CO 0.18 0.21 1.61 -1.28 0.23 0.00 0.00 176.35 177.30 2eny h SER 33 N 4.06 -0.98 -3.93 2.29 0.87 -1.80 -3.43 113.55 110.63 2eny h SER 33 Ca -0.49 0.13 -0.68 0.00 -1.23 0.00 0.00 61.79 59.52 2eny h SER 33 Cb 1.16 0.39 -0.22 0.00 -0.44 0.00 0.00 62.40 63.30 2eny h SER 33 CO 0.48 -0.39 -0.80 -2.28 -0.53 0.00 0.00 176.83 173.31 2eny s HIS 34 N -6.00 2.57 0.96 2.24 5.65 -1.26 -5.02 115.29 114.43 2eny s HIS 34 Ca -0.16 -0.25 -0.12 0.00 0.25 0.00 0.00 55.06 54.79 2eny s HIS 34 Cb 0.09 -1.46 0.18 0.00 -1.18 0.00 0.00 32.58 30.21 2eny s HIS 34 CO 0.65 0.27 0.42 0.39 -0.65 0.00 0.00 174.74 175.81 2eny n GLU 35 N 1.50 -1.37 -4.51 2.88 1.02 -1.26 -5.04 120.64 113.86 2eny n GLU 35 Ca -0.16 -0.70 -0.24 0.00 -0.02 0.00 0.00 57.16 56.04 2eny n GLU 35 Cb 0.52 -1.41 -0.09 0.00 -0.02 0.00 0.00 31.44 30.44 2eny n GLU 35 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2eny s SER 36 N -2.02 2.71 -0.26 1.62 1.04 -1.26 -5.11 113.70 110.43 2eny s SER 36 Ca 0.32 -1.52 -0.02 0.00 0.48 0.00 0.00 55.95 55.21 2eny s SER 36 Cb -0.06 0.21 0.15 0.00 0.10 0.00 0.00 66.02 66.42 2eny s SER 36 CO 0.27 -0.76 0.43 0.00 0.98 0.00 0.00 173.24 174.16 2eny s ALA 37 N -3.22 -1.37 -1.47 5.32 0.00 -1.26 -4.92 121.76 114.85 2eny s ALA 37 Ca 0.29 1.02 -0.11 0.00 0.00 0.00 0.00 51.96 53.15 2eny s ALA 37 Cb 0.06 -1.84 0.06 0.00 0.00 0.00 0.00 23.12 21.40 2eny s ALA 37 CO 0.14 -1.35 0.99 0.43 0.00 0.00 0.00 175.76 175.97 2eny n SER 38 N 5.38 -4.61 -3.76 0.00 7.64 -1.26 -4.95 113.62 112.05 2eny n SER 38 Ca -0.02 -0.74 -0.30 0.00 1.01 0.00 0.00 58.87 58.82 2eny n SER 38 Cb 0.50 -4.13 -0.13 0.00 -1.01 0.00 0.00 64.21 59.44 2eny n SER 38 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2eny s ASP 39 N -3.46 3.80 0.52 6.43 1.01 -1.26 -5.12 116.67 118.59 2eny s ASP 39 Ca 0.56 -2.64 -0.20 0.00 0.71 0.00 0.00 52.55 50.97 2eny s ASP 39 Cb -0.28 -1.14 -0.06 0.00 1.01 0.00 0.00 42.92 42.45 2eny s ASP 39 CO 0.81 -0.27 1.14 -2.16 0.21 0.00 0.00 175.17 174.90 2eny s PRO 40 N 0.31 3.48 0.65 8.23 0.04 -1.26 -4.71 135.00 141.74 2eny s PRO 40 Ca 0.17 1.66 0.05 0.00 0.04 0.00 0.00 61.00 62.92 2eny s PRO 40 Cb -0.24 -2.12 0.11 0.00 0.04 0.00 0.00 34.50 32.28 2eny s PRO 40 CO -0.01 -0.76 0.90 0.00 0.04 0.00 0.00 177.00 177.17 2eny s ALA 41 N -1.70 4.31 -0.23 8.56 0.00 -1.26 -4.21 121.76 127.22 2eny s ALA 41 Ca 0.70 -2.03 -0.03 0.00 0.00 0.00 0.00 51.96 50.59 2eny s ALA 41 Cb -0.25 -1.66 0.12 0.00 0.00 0.00 0.00 23.12 21.33 2eny s ALA 41 CO 0.29 -1.17 0.36 1.41 0.00 0.00 0.00 175.76 176.65 2eny s MET 42 N -4.89 0.32 -0.23 0.00 0.00 -0.85 -5.00 119.30 108.65 2eny s MET 42 Ca 0.65 0.55 -0.20 0.00 0.00 0.00 0.00 55.69 56.68 2eny s MET 42 Cb -0.05 -0.47 -0.02 0.00 0.00 0.00 0.00 34.83 34.28 2eny s MET 42 CO 0.42 -0.60 0.61 -1.58 0.00 0.00 0.00 175.02 173.87 2eny s TRP 43 N 2.53 3.32 -0.32 4.11 0.52 -1.26 -2.73 118.94 125.10 2eny s TRP 43 Ca 0.11 0.83 0.03 0.00 0.02 0.00 0.00 56.10 57.09 2eny s TRP 43 Cb -0.15 -2.80 0.09 0.00 -1.15 0.00 0.00 33.47 29.46 2eny s TRP 43 CO -0.15 -0.25 0.01 0.95 0.02 0.00 0.00 176.95 177.53 2eny s THR 44 N 2.23 2.31 -0.21 2.01 -4.23 -0.93 -2.40 115.64 114.41 2eny s THR 44 Ca 0.26 -2.12 -0.03 0.00 -1.18 0.00 0.00 61.69 58.62 2eny s THR 44 Cb -0.16 -2.60 -0.01 0.00 1.34 0.00 0.00 72.50 71.08 2eny s THR 44 CO 0.09 -0.44 -0.06 0.54 -0.54 0.00 0.00 174.62 174.22 2eny s VAL 45 N 0.97 3.29 0.00 2.29 0.11 -1.22 -2.47 120.40 123.37 2eny s VAL 45 Ca 0.05 -0.53 0.00 0.00 -2.93 0.00 0.00 61.98 58.57 2eny s VAL 45 Cb -0.19 -2.48 0.00 0.00 -1.53 0.00 0.00 36.38 32.17 2eny s VAL 45 CO -0.07 0.44 0.00 0.61 -3.33 0.00 0.00 175.10 172.75 2eny n GLY 46 N 4.66 1.81 0.00 6.54 0.00 -1.26 -3.90 105.19 113.04 2eny n GLY 46 Ca -0.18 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.61 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 0.00 3.48 -0.02 0.00 -1.26 -5.04 105.19 102.35 2eny n GLY 47 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 1.04 -0.24 1.61 -2.85 -1.25 -5.14 119.74 112.90 2eny s LYS 48 Ca 0.00 -0.39 -0.26 0.00 -1.00 0.00 0.00 55.97 54.32 2eny s LYS 48 Cb 0.00 0.47 -0.00 0.00 -2.06 0.00 0.00 37.83 36.24 2eny s LYS 48 CO 0.00 -0.45 0.89 0.99 0.10 0.00 0.00 175.35 176.87 2eny s THR 49 N -3.40 4.79 0.43 3.79 2.01 -1.26 -3.44 115.64 118.56 2eny s THR 49 Ca 0.04 1.68 0.04 0.00 0.31 0.00 0.00 61.69 63.76 2eny s THR 49 Cb -0.01 -4.17 0.01 0.00 0.01 0.00 0.00 72.50 68.33 2eny s THR 49 CO -0.10 -0.11 0.61 0.68 -0.69 0.00 0.00 174.62 175.00 2eny s VAL 50 N 2.95 3.52 0.00 3.82 -7.23 -1.01 -4.80 120.40 117.65 2eny s VAL 50 Ca 0.37 -0.81 0.00 0.00 -1.81 0.00 0.00 61.98 59.74 2eny s VAL 50 Cb -0.15 -3.25 0.00 0.00 0.56 0.00 0.00 36.38 33.54 2eny s VAL 50 CO 0.07 -0.13 0.00 0.61 -0.31 0.00 0.00 175.10 175.34 2eny n GLY 51 N -1.94 3.74 2.26 2.32 0.00 -1.26 -4.70 105.19 105.61 2eny n GLY 51 Ca 0.04 -0.59 -0.29 0.00 0.00 0.00 0.00 46.02 45.18 2eny n GLY 51 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2eny n SER 52 N 0.00 7.16 -3.79 1.61 3.41 -1.26 -4.74 113.62 116.02 2eny n SER 52 Ca 0.00 -3.50 -0.21 0.00 -0.26 0.00 0.00 58.87 54.90 2eny n SER 52 Cb 0.00 -1.04 -0.17 0.00 -0.26 0.00 0.00 64.21 62.74 2eny n SER 52 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2eny s SER 53 N -0.87 1.26 0.33 4.04 0.01 -1.26 -5.02 113.70 112.19 2eny s SER 53 Ca 0.52 -0.07 0.12 0.00 1.31 0.00 0.00 55.95 57.84 2eny s SER 53 Cb 0.40 -0.38 1.03 0.00 0.21 0.00 0.00 66.02 67.29 2eny s SER 53 CO -0.07 -0.16 1.65 0.77 0.41 0.00 0.00 173.24 175.84 2eny h SER 54 N 7.99 0.40 0.15 2.44 4.64 -2.01 -1.34 113.55 125.81 2eny h SER 54 Ca -0.25 0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 2eny h SER 54 Cb 1.13 0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 63.37 2eny h SER 54 CO 0.32 -0.16 -0.30 0.03 -0.87 0.00 0.00 176.83 175.85 2eny h ARG 55 N 0.28 -0.47 -6.38 4.77 -0.00 -1.93 -3.41 114.38 107.23 2eny h ARG 55 Ca 0.71 0.03 -0.55 0.00 -0.50 0.00 0.00 59.98 59.67 2eny h ARG 55 Cb 1.60 0.11 -0.04 0.00 0.00 0.00 0.00 29.97 31.64 2eny h ARG 55 CO -0.63 -0.31 0.10 -0.06 0.00 0.00 0.00 179.97 179.07 2eny s PHE 56 N -4.59 3.85 -0.45 3.04 0.40 -0.51 -1.79 117.98 117.93 2eny s PHE 56 Ca -0.10 1.48 0.02 0.00 -0.60 0.00 0.00 56.93 57.74 2eny s PHE 56 Cb 0.03 -2.68 0.14 0.00 0.51 0.00 0.00 43.02 41.02 2eny s PHE 56 CO 0.34 0.50 0.27 -1.14 0.70 0.00 0.00 175.22 175.90 2eny s GLN 57 N -0.95 1.24 -0.76 0.44 2.00 -0.58 -4.33 119.66 116.73 2eny s GLN 57 Ca 0.34 -2.06 -0.26 0.00 -2.00 0.00 0.00 55.36 51.38 2eny s GLN 57 Cb -0.21 -2.16 -0.00 0.00 0.80 0.00 0.00 33.01 31.44 2eny s GLN 57 CO 0.23 -1.21 1.66 0.00 -0.50 0.00 0.00 175.29 175.47 2eny s ALA 58 N 0.23 2.30 0.53 1.58 0.00 -1.26 -2.98 121.76 122.17 2eny s ALA 58 Ca 0.21 -1.24 -0.02 0.00 0.00 0.00 0.00 51.96 50.91 2eny s ALA 58 Cb -0.18 -4.37 0.01 0.00 0.00 0.00 0.00 23.12 18.58 2eny s ALA 58 CO -0.04 -3.87 0.78 -0.08 0.00 0.00 0.00 175.76 172.55 2eny s THR 59 N 7.80 3.42 -0.06 0.00 -1.32 -0.73 -4.98 115.64 119.78 2eny s THR 59 Ca 0.56 -0.40 0.01 0.00 -1.21 0.00 0.00 61.69 60.65 2eny s THR 59 Cb -0.08 -3.31 0.02 0.00 -1.51 0.00 0.00 72.50 67.62 2eny s THR 59 CO 0.11 -0.25 -0.06 -0.60 -2.21 0.00 0.00 174.62 171.61 2eny s ARG 60 N -4.78 1.04 -0.20 7.08 3.52 -1.26 -3.49 118.95 120.86 2eny s ARG 60 Ca 0.53 -0.16 -0.04 0.00 -0.13 0.00 0.00 55.73 55.93 2eny s ARG 60 Cb -0.10 -1.02 0.08 0.00 -1.56 0.00 0.00 34.95 32.35 2eny s ARG 60 CO 0.40 -0.09 0.15 -0.65 -0.81 0.00 0.00 175.30 174.30 2eny s GLN 61 N 1.01 0.13 2.91 5.12 -0.21 -0.84 -5.05 119.66 122.74 2eny s GLN 61 Ca -0.09 -0.05 0.00 0.00 0.02 0.00 0.00 55.36 55.24 2eny s GLN 61 Cb -0.14 -1.48 0.00 0.00 1.00 0.00 0.00 33.01 32.39 2eny s GLN 61 CO -0.00 -0.73 0.00 0.41 -2.12 0.00 0.00 175.29 172.85 2eny n GLY 62 N 5.29 0.31 0.00 3.09 0.00 -1.26 -0.22 105.19 112.40 2eny n GLY 62 Ca -0.06 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.62 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 0.00 1.46 -4.27 1.61 0.00 -1.26 -4.89 116.66 109.32 2eny n ARG 63 Ca 0.00 -0.98 -0.31 0.00 -0.00 0.00 0.00 57.85 56.56 2eny n ARG 63 Cb 0.00 -0.78 -0.09 0.00 -0.00 0.00 0.00 32.46 31.59 2eny n ARG 63 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 2eny s LYS 64 N -0.50 2.36 -0.03 2.89 2.20 0.69 -3.75 119.74 123.61 2eny s LYS 64 Ca 0.00 -0.89 0.06 0.00 -0.36 0.00 0.00 55.97 54.79 2eny s LYS 64 Cb 0.00 -2.43 -0.01 0.00 -1.51 0.00 0.00 37.83 33.88 2eny s LYS 64 CO 0.00 0.54 -0.21 0.71 -0.36 0.00 0.00 175.35 176.03 2eny s TYR 65 N -1.18 1.93 -0.11 4.03 1.51 -0.72 -1.99 117.35 120.82 2eny s TYR 65 Ca 0.21 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.85 2eny s TYR 65 Cb -0.11 -1.25 0.02 0.00 -0.11 0.00 0.00 41.96 40.51 2eny s TYR 65 CO 0.13 -0.07 -0.09 0.42 -1.11 0.00 0.00 175.55 174.82 2eny s ILE 66 N -0.37 1.13 -1.04 2.71 1.09 -1.23 -1.95 121.20 121.54 2eny s ILE 66 Ca 0.05 -0.37 -0.07 0.00 -1.10 0.00 0.00 60.65 59.16 2eny s ILE 66 Cb -0.09 -1.11 0.26 0.00 -1.06 0.00 0.00 42.46 40.45 2eny s ILE 66 CO 0.00 0.38 1.00 -0.22 -0.10 0.00 0.00 174.94 176.00 2eny s LEU 67 N 1.49 6.11 -0.05 2.97 2.96 -1.23 -1.77 118.68 129.16 2eny s LEU 67 Ca 0.02 -3.62 -0.30 0.00 -0.22 0.00 0.00 54.13 50.01 2eny s LEU 67 Cb -0.13 -2.12 -0.07 0.00 0.50 0.00 0.00 46.19 44.38 2eny s LEU 67 CO -0.07 -0.26 1.87 -0.69 -1.32 0.00 0.00 176.35 175.89 2eny s VAL 68 N -1.26 3.26 -0.24 1.68 1.01 -1.16 -3.63 120.40 120.07 2eny s VAL 68 Ca 0.29 0.30 -0.10 0.00 0.00 0.00 0.00 61.98 62.48 2eny s VAL 68 Cb -0.09 -3.22 -0.05 0.00 0.00 0.00 0.00 36.38 33.02 2eny s VAL 68 CO -0.09 -0.06 0.13 -0.69 0.00 0.00 0.00 175.10 174.40 2eny s VAL 69 N 4.94 5.11 0.15 2.92 1.01 0.13 -1.52 120.40 133.14 2eny s VAL 69 Ca 0.84 0.09 0.09 0.00 0.00 0.00 0.00 61.98 63.00 2eny s VAL 69 Cb -0.37 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 2eny s VAL 69 CO 0.36 0.35 -0.14 -0.13 0.00 0.00 0.00 175.10 175.54 2eny s ARG 70 N 1.11 1.91 -1.18 2.72 0.52 -0.74 -2.28 118.95 121.01 2eny s ARG 70 Ca 0.06 -1.23 -0.02 0.00 -0.52 0.00 0.00 55.73 54.03 2eny s ARG 70 Cb -0.14 -2.13 -0.02 0.00 0.52 0.00 0.00 34.95 33.18 2eny s ARG 70 CO 0.05 0.46 0.92 0.39 0.02 0.00 0.00 175.30 177.14 2eny n GLU 71 N 0.43 -5.09 -0.52 3.54 1.02 -1.26 -4.75 120.64 114.01 2eny n GLU 71 Ca -0.13 0.80 -0.29 0.00 -0.02 0.00 0.00 57.16 57.52 2eny n GLU 71 Cb 0.54 -5.68 0.24 0.00 -0.02 0.00 0.00 31.44 26.51 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 -3.94 -2.62 -3.43 0.62 0.00 -1.24 -4.91 120.51 104.99 2eny n ALA 72 Ca -0.23 -1.08 -0.14 0.00 0.00 0.00 0.00 53.44 52.00 2eny n ALA 72 Cb 0.66 -2.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.07 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 -2.44 -1.62 -2.00 0.00 0.00 -1.26 -3.85 121.76 110.59 2eny s ALA 73 Ca 0.68 0.69 0.13 0.00 0.00 0.00 0.00 51.96 53.46 2eny s ALA 73 Cb -0.24 0.64 0.76 0.00 0.00 0.00 0.00 23.12 24.27 2eny s ALA 73 CO 0.64 -0.66 1.18 -0.35 0.00 0.00 0.00 175.76 176.58 2eny n PRO 74 N -0.02 0.48 -0.09 0.00 -0.04 -1.26 -2.38 135.00 131.69 2eny n PRO 74 Ca -0.18 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.16 2eny n PRO 74 Cb 0.63 -1.41 -0.15 0.00 -0.04 0.00 0.00 33.50 32.53 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 -0.91 0.65 0.23 3.54 7.64 -1.26 -4.25 113.62 119.26 2eny n SER 75 Ca 0.10 0.03 0.12 0.00 1.01 0.00 0.00 58.87 60.13 2eny n SER 75 Cb 0.04 0.46 0.47 0.00 -1.01 0.00 0.00 64.21 64.17 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 -1.77 6.43 5.19 -1.89 -3.44 116.42 120.95 2eny h ASP 76 Ca -0.52 0.00 -0.62 0.00 -0.62 0.00 0.00 57.03 55.27 2eny h ASP 76 Cb 2.13 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.64 2eny h ASP 76 CO 0.01 0.15 1.32 0.00 -3.12 0.00 0.00 179.24 177.61 2eny n ALA 77 N -2.17 1.26 -1.34 3.45 0.00 -1.23 -4.59 120.51 115.89 2eny n ALA 77 Ca 0.01 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2eny n ALA 77 Cb 0.42 -2.66 0.00 0.00 0.00 0.00 0.00 19.45 17.21 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 5.46 -1.09 3.38 0.00 0.00 -1.26 -5.00 105.19 106.67 2eny n GLY 78 Ca 0.30 0.58 0.00 0.00 0.00 0.00 0.00 46.02 46.91 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 0.34 0.55 -0.24 1.61 2.12 -1.26 -4.15 118.70 117.67 2eny s GLU 79 Ca 0.00 1.20 -0.26 0.00 0.36 0.00 0.00 54.97 56.27 2eny s GLU 79 Cb 0.00 0.65 0.00 0.00 0.26 0.00 0.00 34.13 35.04 2eny s GLU 79 CO 0.00 -0.40 0.90 0.08 -0.54 0.00 0.00 175.26 175.30 2eny s VAL 80 N 2.85 4.78 -0.24 3.70 1.01 0.19 -4.18 120.40 128.51 2eny s VAL 80 Ca 0.07 1.71 -0.01 0.00 0.00 0.00 0.00 61.98 63.74 2eny s VAL 80 Cb -0.13 -4.19 0.03 0.00 0.00 0.00 0.00 36.38 32.09 2eny s VAL 80 CO -0.19 -0.12 -0.08 -0.69 0.00 0.00 0.00 175.10 174.01 2eny s VAL 81 N 2.98 2.73 0.30 2.92 1.01 -1.03 0.51 120.40 129.82 2eny s VAL 81 Ca 0.38 -1.06 0.05 0.00 0.00 0.00 0.00 61.98 61.35 2eny s VAL 81 Cb -0.15 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 33.83 2eny s VAL 81 CO 0.07 0.22 0.44 0.12 0.00 0.00 0.00 175.10 175.95 2eny s PHE 82 N 1.30 3.29 -0.02 5.22 5.36 0.41 -2.19 117.98 131.34 2eny s PHE 82 Ca 0.00 -0.08 -0.20 0.00 -0.96 0.00 0.00 56.93 55.69 2eny s PHE 82 Cb -0.16 -1.82 0.04 0.00 -0.34 0.00 0.00 43.02 40.74 2eny s PHE 82 CO -0.05 0.18 0.43 -1.54 -1.46 0.00 0.00 175.22 172.77 2eny s SER 83 N -4.08 -0.34 -0.28 6.13 1.04 -1.11 -0.47 113.70 114.59 2eny s SER 83 Ca 0.40 0.27 -0.19 0.00 0.48 0.00 0.00 55.95 56.91 2eny s SER 83 Cb -0.09 0.39 0.11 0.00 0.10 0.00 0.00 66.02 66.52 2eny s SER 83 CO 0.31 -0.51 0.86 0.54 0.98 0.00 0.00 173.24 175.42 2eny s VAL 84 N -1.34 0.00 -1.06 5.02 0.11 0.57 -2.00 120.40 121.69 2eny s VAL 84 Ca -0.12 0.00 -0.12 0.00 -2.93 0.00 0.00 61.98 58.81 2eny s VAL 84 Cb -0.03 -1.00 0.12 0.00 -1.53 0.00 0.00 36.38 33.93 2eny s VAL 84 CO 0.06 0.00 0.29 -2.11 -3.33 0.00 0.00 175.10 170.01 2eny n ARG 85 N 3.46 -0.85 0.00 1.54 -4.01 -1.26 0.24 116.66 115.77 2eny n ARG 85 Ca -0.17 0.08 0.00 0.00 -1.04 0.00 0.00 57.85 56.71 2eny n ARG 85 Cb 0.57 -2.62 0.00 0.00 -3.04 0.00 0.00 32.46 27.37 2eny n ARG 85 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2eny n GLY 86 N -1.00 3.02 3.42 2.89 0.00 -1.26 -5.05 105.19 107.21 2eny n GLY 86 Ca 0.03 -0.82 -0.36 0.00 0.00 0.00 0.00 46.02 44.87 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 0.12 -3.69 0.99 4.77 0.64 -5.02 117.00 114.82 2eny n LEU 87 Ca 0.00 0.55 -0.10 0.00 -0.03 0.00 0.00 56.01 56.43 2eny n LEU 87 Cb 0.00 -1.17 -0.10 0.00 -2.33 0.00 0.00 43.42 39.82 2eny n LEU 87 CO 0.00 -3.41 0.11 -0.89 -1.33 0.00 0.00 177.39 171.88 2eny s THR 88 N -1.96 -0.02 0.30 -5.08 2.01 -1.26 -0.32 115.64 109.32 2eny s THR 88 Ca 0.63 0.06 0.08 0.00 0.31 0.00 0.00 61.69 62.77 2eny s THR 88 Cb -0.34 -0.67 -0.06 0.00 0.01 0.00 0.00 72.50 71.44 2eny s THR 88 CO 0.61 0.03 -0.07 -0.44 -0.69 0.00 0.00 174.62 174.05 2eny s SER 89 N 1.24 3.13 0.07 3.53 0.01 0.38 -4.95 113.70 117.10 2eny s SER 89 Ca -0.08 -1.19 0.02 0.00 1.31 0.00 0.00 55.95 56.01 2eny s SER 89 Cb -0.07 -0.24 -0.03 0.00 0.21 0.00 0.00 66.02 65.89 2eny s SER 89 CO -0.12 -0.29 -0.07 -0.54 0.41 0.00 0.00 173.24 172.63 2eny s LYS 90 N -3.68 0.66 0.24 12.44 3.01 -1.26 -0.45 119.74 130.70 2eny s LYS 90 Ca 0.31 -1.01 -0.21 0.00 -1.01 0.00 0.00 55.97 54.04 2eny s LYS 90 Cb 0.03 -0.26 0.04 0.00 -1.01 0.00 0.00 37.83 36.63 2eny s LYS 90 CO 0.14 0.02 0.67 0.00 0.51 0.00 0.00 175.35 176.69 2eny s ALA 91 N -2.35 -1.33 -0.09 5.17 0.00 0.18 -4.75 121.76 118.60 2eny s ALA 91 Ca -0.00 -0.05 0.03 0.00 0.00 0.00 0.00 51.96 51.94 2eny s ALA 91 Cb -0.03 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 23.94 2eny s ALA 91 CO -0.02 -0.94 -0.18 -1.12 0.00 0.00 0.00 175.76 173.50 2eny s SER 92 N -2.86 3.63 -0.11 0.00 0.01 -1.26 0.52 113.70 113.63 2eny s SER 92 Ca 0.08 -0.38 -0.03 0.00 1.31 0.00 0.00 55.95 56.93 2eny s SER 92 Cb -0.04 -1.18 -0.03 0.00 0.21 0.00 0.00 66.02 64.98 2eny s SER 92 CO -0.00 0.23 -0.00 -0.22 0.41 0.00 0.00 173.24 173.66 2eny s LEU 93 N -0.06 3.52 0.10 2.44 2.96 -1.26 -2.25 118.68 124.13 2eny s LEU 93 Ca -0.04 0.07 0.07 0.00 -0.22 0.00 0.00 54.13 54.01 2eny s LEU 93 Cb -0.14 -1.82 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 2eny s LEU 93 CO 0.04 0.31 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.68 2eny s ILE 94 N -0.50 3.51 -0.20 6.68 -1.09 -0.32 -4.01 121.20 125.27 2eny s ILE 94 Ca 0.09 -1.22 -0.04 0.00 -2.23 0.00 0.00 60.65 57.25 2eny s ILE 94 Cb -0.12 -2.65 0.10 0.00 -1.58 0.00 0.00 42.46 38.21 2eny s ILE 94 CO 0.02 0.11 0.28 -0.69 -1.23 0.00 0.00 174.94 173.43 2eny s VAL 95 N -1.25 -0.43 -0.28 2.92 1.01 -1.26 -3.71 120.40 117.39 2eny s VAL 95 Ca 0.22 -0.04 -0.11 0.00 0.00 0.00 0.00 61.98 62.06 2eny s VAL 95 Cb -0.11 -0.69 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 2eny s VAL 95 CO 0.15 -0.13 0.18 -0.13 0.00 0.00 0.00 175.10 175.17 2eny s ARG 96 N 2.42 3.85 0.24 2.72 1.81 -1.05 -4.81 118.95 124.13 2eny s ARG 96 Ca 0.08 -0.39 -0.30 0.00 -1.72 0.00 0.00 55.73 53.40 2eny s ARG 96 Cb -0.15 -3.63 -0.10 0.00 -0.45 0.00 0.00 34.95 30.62 2eny s ARG 96 CO -0.13 -0.22 1.46 -1.83 -0.68 0.00 0.00 175.30 173.90 2eny s GLU 97 N 1.73 4.26 0.04 3.54 -1.05 -1.26 -0.07 118.70 125.89 2eny s GLU 97 Ca 0.07 2.31 -0.25 0.00 -0.15 0.00 0.00 54.97 56.95 2eny s GLU 97 Cb -0.16 -3.11 -0.14 0.00 -0.44 0.00 0.00 34.13 30.28 2eny s GLU 97 CO 0.10 -0.45 1.36 -0.09 0.95 0.00 0.00 175.26 177.13 2eny h ARG 98 N 5.21 -0.87 -6.53 -4.83 1.12 -1.96 -3.43 114.38 103.09 2eny h ARG 98 Ca -0.46 0.06 -0.60 0.00 -1.11 0.00 0.00 59.98 57.87 2eny h ARG 98 Cb 1.22 0.20 0.10 0.00 -0.01 0.00 0.00 29.97 31.47 2eny h ARG 98 CO 0.79 -0.58 0.37 0.43 -3.11 0.00 0.00 179.97 177.87 2eny n SER 99 N -4.45 2.00 0.00 -3.80 7.64 -1.26 -4.86 113.62 108.89 2eny n SER 99 Ca -0.11 1.17 0.00 0.00 1.01 0.00 0.00 58.87 60.93 2eny n SER 99 Cb 0.36 -1.35 0.00 0.00 -1.01 0.00 0.00 64.21 62.20 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 1.56 -0.53 0.16 0.23 0.00 -1.26 -4.96 105.19 100.39 2eny n GLY 100 Ca 0.10 -0.85 0.13 0.00 0.00 0.00 0.00 46.02 45.40 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 -5.22 1.61 0.13 -1.98 -3.45 132.00 123.10 2eny h PRO 101 Ca 0.00 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.53 2eny h PRO 101 Cb 0.00 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.07 2eny h PRO 101 CO 0.00 0.00 1.49 -1.13 -0.23 0.00 0.00 178.00 178.13 2eny n SER 102 N -2.39 0.48 -3.29 1.44 3.41 -1.26 -4.86 113.62 107.16 2eny n SER 102 Ca 0.02 0.39 -0.17 0.00 -0.26 0.00 0.00 58.87 58.85 2eny n SER 102 Cb 0.24 -0.87 0.16 0.00 -0.26 0.00 0.00 64.21 63.48 2eny n SER 102 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2eny n SER 103 N 8.71 -3.09 -0.13 4.04 2.88 -1.26 -5.14 113.62 119.63 2eny n SER 103 Ca 0.58 -0.49 0.02 0.00 -1.33 0.00 0.00 58.87 57.65 2eny n SER 103 Cb -0.00 -0.66 0.01 0.00 -0.75 0.00 0.00 64.21 62.81 2eny n SER 103 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42