#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 -0.75 -0.42 1.61 1.04 -1.26 -5.11 113.70 108.81 2eny s SER 2 Ca 0.00 1.16 -0.42 0.00 0.48 0.00 0.00 55.95 57.16 2eny s SER 2 Cb 0.00 1.47 -0.17 0.00 0.10 0.00 0.00 66.02 67.42 2eny s SER 2 CO 0.00 -0.18 1.92 -1.20 0.98 0.00 0.00 173.24 174.76 2eny n SER 3 N 4.30 1.54 -4.55 7.02 7.64 -1.26 -4.84 113.62 123.48 2eny n SER 3 Ca -0.17 0.86 -0.42 0.00 1.01 0.00 0.00 58.87 60.15 2eny n SER 3 Cb 0.56 -1.02 -0.03 0.00 -1.01 0.00 0.00 64.21 62.71 2eny n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2eny s GLY 4 N 4.88 1.18 0.26 0.23 0.00 -1.26 -4.96 107.32 107.64 2eny s GLY 4 Ca 1.09 -1.15 -0.15 0.00 0.00 0.00 0.00 44.72 44.50 2eny s GLY 4 CO 0.67 2.37 0.56 -0.56 0.00 0.00 0.00 173.10 176.13 2eny s SER 5 N 3.16 -0.15 -0.29 1.64 0.01 -1.26 -5.17 113.70 111.64 2eny s SER 5 Ca 0.36 -0.83 -0.13 0.00 1.31 0.00 0.00 55.95 56.67 2eny s SER 5 Cb -0.10 0.63 0.12 0.00 0.21 0.00 0.00 66.02 66.89 2eny s SER 5 CO 0.20 -1.21 0.73 -0.44 0.41 0.00 0.00 173.24 172.93 2eny s SER 6 N -2.99 -0.98 0.00 2.44 0.01 -1.26 -5.15 113.70 105.78 2eny s SER 6 Ca 0.19 1.41 0.00 0.00 1.31 0.00 0.00 55.95 58.86 2eny s SER 6 Cb -0.02 1.91 0.00 0.00 0.21 0.00 0.00 66.02 68.11 2eny s SER 6 CO 0.08 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.14 2eny n GLY 7 N 4.97 1.98 3.81 3.44 0.00 -1.26 -5.02 105.19 113.11 2eny n GLY 7 Ca -0.14 0.14 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.08 -1.47 1.61 -0.00 -1.26 -4.83 115.22 107.19 2eny n HIS 8 Ca 0.00 0.87 -0.49 0.00 -0.00 0.00 0.00 57.72 58.10 2eny n HIS 8 Cb 0.00 -4.19 -0.04 0.00 -0.00 0.00 0.00 29.99 25.76 2eny n HIS 8 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 2eny n VAL 9 N -4.47 1.55 -3.50 1.59 0.31 -1.26 -4.97 118.33 107.59 2eny n VAL 9 Ca -0.15 -0.39 -0.12 0.00 -0.01 0.00 0.00 64.34 63.67 2eny n VAL 9 Cb 0.61 -0.29 -0.03 0.00 -0.91 0.00 0.00 33.84 33.22 2eny n VAL 9 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2eny s GLY 10 N -0.64 -0.51 0.06 2.92 0.00 -1.26 -5.07 107.32 102.82 2eny s GLY 10 Ca 0.68 0.44 -0.30 0.00 0.00 0.00 0.00 44.72 45.54 2eny s GLY 10 CO 0.56 0.13 1.84 -0.42 0.00 0.00 0.00 173.10 175.21 2eny s ILE 11 N -3.40 2.92 -0.06 0.90 -1.09 -1.26 -3.58 121.20 115.64 2eny s ILE 11 Ca -0.00 0.18 0.01 0.00 -2.23 0.00 0.00 60.65 58.61 2eny s ILE 11 Cb -0.00 -3.12 -0.25 0.00 -1.58 0.00 0.00 42.46 37.51 2eny s ILE 11 CO -0.10 -0.01 0.62 0.71 -1.23 0.00 0.00 174.94 174.94 2eny h THR 12 N 5.17 0.86 -2.49 2.92 1.35 -1.89 -3.42 112.91 115.42 2eny h THR 12 Ca -0.46 -2.61 -0.60 0.00 -0.55 0.00 0.00 66.41 62.20 2eny h THR 12 Cb 1.22 2.55 -0.40 0.00 -1.73 0.00 0.00 68.15 69.79 2eny h THR 12 CO 0.94 0.74 -0.82 1.17 -0.25 0.00 0.00 175.52 177.30 2eny n LYS 13 N -3.32 1.12 -0.71 4.72 4.81 -1.12 -5.02 118.16 118.64 2eny n LYS 13 Ca -0.22 -3.80 -0.32 0.00 -0.87 0.00 0.00 58.31 53.10 2eny n LYS 13 Cb 1.05 -1.86 0.16 0.00 0.02 0.00 0.00 35.03 34.40 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 2.02 -0.83 -0.83 1.64 1.85 -1.26 -2.77 116.66 116.47 2eny n ARG 14 Ca 0.25 -0.20 -0.29 0.00 -1.00 0.00 0.00 57.85 56.62 2eny n ARG 14 Cb 0.44 -1.98 0.21 0.00 -1.05 0.00 0.00 32.46 30.08 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 -3.11 1.36 0.01 2.89 1.43 -1.26 -4.86 118.68 115.13 2eny s LEU 15 Ca 0.60 1.45 0.03 0.00 -1.03 0.00 0.00 54.13 55.17 2eny s LEU 15 Cb -0.20 -3.53 -0.01 0.00 0.03 0.00 0.00 46.19 42.48 2eny s LEU 15 CO 0.65 -3.62 -0.08 -0.54 0.23 0.00 0.00 176.35 172.99 2eny s LYS 16 N -4.69 0.62 0.09 1.70 -0.14 -1.26 -4.90 119.74 111.17 2eny s LYS 16 Ca 0.67 -0.38 -0.31 0.00 -1.36 0.00 0.00 55.97 54.59 2eny s LYS 16 Cb -0.22 -0.57 -0.09 0.00 -1.68 0.00 0.00 37.83 35.27 2eny s LYS 16 CO 0.61 0.15 1.64 0.99 -0.76 0.00 0.00 175.35 177.98 2eny s THR 17 N -0.41 2.92 0.24 2.17 2.01 -1.26 -4.76 115.64 116.55 2eny s THR 17 Ca 0.01 0.47 0.08 0.00 0.31 0.00 0.00 61.69 62.55 2eny s THR 17 Cb -0.04 -3.30 -0.04 0.00 0.01 0.00 0.00 72.50 69.13 2eny s THR 17 CO -0.00 0.01 0.09 -0.32 -0.69 0.00 0.00 174.62 173.71 2eny s MET 18 N 2.27 2.61 -0.22 4.92 1.75 -1.12 -5.01 119.30 124.51 2eny s MET 18 Ca 0.73 -1.19 -0.04 0.00 -1.25 0.00 0.00 55.69 53.95 2eny s MET 18 Cb -0.41 -2.39 0.07 0.00 2.84 0.00 0.00 34.83 34.95 2eny s MET 18 CO 0.32 0.40 0.09 -2.00 -0.65 0.00 0.00 175.02 173.18 2eny s GLU 19 N -3.60 0.28 0.32 4.11 -6.30 -1.26 -1.42 118.70 110.82 2eny s GLU 19 Ca 0.31 -0.36 0.02 0.00 -2.50 0.00 0.00 54.97 52.44 2eny s GLU 19 Cb -0.08 -1.72 -0.01 0.00 0.00 0.00 0.00 34.13 32.32 2eny s GLU 19 CO 0.22 -0.79 0.06 1.33 0.02 0.00 0.00 175.26 176.10 2eny n VAL 20 N 5.19 0.00 -4.59 3.70 0.24 -0.96 -5.03 118.33 116.87 2eny n VAL 20 Ca -0.07 -1.66 -0.33 0.00 -2.04 0.00 0.00 64.34 60.24 2eny n VAL 20 Cb 0.46 0.48 -0.11 0.00 -1.47 0.00 0.00 33.84 33.20 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 3.11 -0.32 1.34 2.96 -1.26 -2.29 118.68 122.22 2eny s LEU 21 Ca 0.08 -0.09 -0.40 0.00 -0.22 0.00 0.00 54.13 53.50 2eny s LEU 21 Cb 0.00 -1.72 -0.15 0.00 0.50 0.00 0.00 46.19 44.83 2eny s LEU 21 CO 0.06 0.33 1.87 1.21 -1.32 0.00 0.00 176.35 178.50 2eny n GLU 22 N 1.98 1.02 0.00 1.98 2.13 0.56 -0.36 120.64 127.96 2eny n GLU 22 Ca -0.17 0.35 0.00 0.00 0.66 0.00 0.00 57.16 58.00 2eny n GLU 22 Cb 0.53 -2.12 0.00 0.00 0.27 0.00 0.00 31.44 30.12 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 4.97 1.56 3.65 8.31 0.00 -1.26 -4.36 105.19 118.06 2eny n GLY 23 Ca 0.32 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.06 -1.08 -0.03 1.61 2.02 0.52 -4.72 118.70 116.95 2eny s GLU 24 Ca 0.00 -0.20 0.01 0.00 0.02 0.00 0.00 54.97 54.80 2eny s GLU 24 Cb 0.00 -1.62 0.02 0.00 0.10 0.00 0.00 34.13 32.63 2eny s GLU 24 CO 0.00 -3.59 -0.02 -1.54 0.02 0.00 0.00 175.26 170.13 2eny s SER 25 N -4.13 0.62 0.30 -0.19 1.04 -1.26 -3.97 113.70 106.11 2eny s SER 25 Ca 0.72 -0.07 0.01 0.00 0.48 0.00 0.00 55.95 57.09 2eny s SER 25 Cb -0.08 -0.31 -0.00 0.00 0.10 0.00 0.00 66.02 65.73 2eny s SER 25 CO 0.55 -0.07 0.04 0.00 0.98 0.00 0.00 173.24 174.74 2eny s SER 27 N -2.71 -0.13 0.98 0.00 1.04 -1.26 -1.19 113.70 110.43 2eny s SER 27 Ca 0.06 0.51 -0.16 0.00 0.48 0.00 0.00 55.95 56.84 2eny s SER 27 Cb 0.00 1.34 0.19 0.00 0.10 0.00 0.00 66.02 67.66 2eny s SER 27 CO 0.04 -0.28 1.25 -0.36 0.98 0.00 0.00 173.24 174.87 2eny s PHE 28 N 2.61 1.66 -0.18 5.02 0.40 -0.86 -4.85 117.98 121.77 2eny s PHE 28 Ca 0.11 0.45 -0.13 0.00 -0.60 0.00 0.00 56.93 56.75 2eny s PHE 28 Cb -0.15 -3.86 0.05 0.00 0.51 0.00 0.00 43.02 39.57 2eny s PHE 28 CO -0.16 -2.73 0.47 -1.21 0.70 0.00 0.00 175.22 172.29 2eny s GLU 29 N -5.71 0.50 -0.16 0.44 2.02 -1.26 -2.85 118.70 111.68 2eny s GLU 29 Ca 0.71 0.76 -0.05 0.00 0.02 0.00 0.00 54.97 56.42 2eny s GLU 29 Cb -0.07 0.13 0.08 0.00 0.10 0.00 0.00 34.13 34.37 2eny s GLU 29 CO 0.53 -0.11 0.28 0.00 0.02 0.00 0.00 175.26 175.97 2eny s VAL 31 N 2.43 4.98 0.01 0.00 1.01 -1.12 -0.62 120.40 127.10 2eny s VAL 31 Ca 0.03 -0.28 0.07 0.00 0.00 0.00 0.00 61.98 61.80 2eny s VAL 31 Cb -0.13 -3.28 -0.03 0.00 0.00 0.00 0.00 36.38 32.94 2eny s VAL 31 CO -0.10 0.38 -0.20 -0.76 0.00 0.00 0.00 175.10 174.42 2eny s LEU 32 N -1.70 2.48 0.33 3.92 1.43 -1.17 -2.80 118.68 121.16 2eny s LEU 32 Ca 0.23 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.93 2eny s LEU 32 Cb -0.12 -1.46 0.59 0.00 0.03 0.00 0.00 46.19 45.22 2eny s LEU 32 CO 0.14 0.28 1.97 -1.28 0.23 0.00 0.00 176.35 177.70 2eny h SER 33 N 4.89 0.80 -4.53 2.29 0.87 -1.92 -3.43 113.55 112.52 2eny h SER 33 Ca -0.46 -0.01 -0.47 0.00 -1.23 0.00 0.00 61.79 59.62 2eny h SER 33 Cb 1.15 -0.19 0.11 0.00 -0.44 0.00 0.00 62.40 63.02 2eny h SER 33 CO 0.47 0.56 0.38 -2.28 -0.53 0.00 0.00 176.83 175.44 2eny s HIS 34 N -5.80 2.85 0.32 2.24 5.65 -1.26 -5.03 115.29 114.25 2eny s HIS 34 Ca -0.11 0.78 -0.27 0.00 0.25 0.00 0.00 55.06 55.71 2eny s HIS 34 Cb 0.18 -3.47 -0.10 0.00 -1.18 0.00 0.00 32.58 28.02 2eny s HIS 34 CO 0.78 -1.92 0.98 -2.00 -0.65 0.00 0.00 174.74 171.93 2eny s GLU 35 N -5.51 4.56 0.76 2.88 2.56 -1.26 -5.01 118.70 117.68 2eny s GLU 35 Ca 0.62 1.43 -0.11 0.00 0.00 0.00 0.00 54.97 56.91 2eny s GLU 35 Cb -0.12 -2.87 0.17 0.00 2.00 0.00 0.00 34.13 33.31 2eny s GLU 35 CO 0.50 0.24 1.03 0.45 -0.56 0.00 0.00 175.26 176.92 2eny n SER 36 N 0.66 0.26 -3.70 -1.70 2.88 -1.26 -4.34 113.62 106.41 2eny n SER 36 Ca 0.02 -1.48 -0.28 0.00 -1.33 0.00 0.00 58.87 55.80 2eny n SER 36 Cb 0.49 -0.77 0.03 0.00 -0.75 0.00 0.00 64.21 63.21 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 -3.56 -1.21 0.00 -1.46 0.00 -1.26 -4.82 120.51 108.20 2eny n ALA 37 Ca -0.17 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2eny n ALA 37 Cb 0.47 -4.25 0.00 0.00 0.00 0.00 0.00 19.45 15.67 2eny n ALA 37 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2eny n SER 38 N -2.72 3.98 -3.95 0.00 7.64 -1.26 -5.09 113.62 112.23 2eny n SER 38 Ca 0.02 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.81 2eny n SER 38 Cb 0.54 0.51 -0.09 0.00 -1.01 0.00 0.00 64.21 64.16 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 -2.32 0.23 -0.12 6.43 1.11 -1.26 -5.12 116.67 115.62 2eny s ASP 39 Ca 0.00 -0.67 -0.29 0.00 0.18 0.00 0.00 52.55 51.77 2eny s ASP 39 Cb 0.00 0.25 -0.04 0.00 1.07 0.00 0.00 42.92 44.20 2eny s ASP 39 CO 0.00 -0.59 1.54 -2.16 1.18 0.00 0.00 175.17 175.14 2eny s PRO 40 N -3.23 4.12 0.12 8.23 0.04 -1.26 -4.85 135.00 138.17 2eny s PRO 40 Ca 0.00 1.94 -0.06 0.00 0.04 0.00 0.00 61.00 62.93 2eny s PRO 40 Cb 0.02 -3.93 -0.06 0.00 0.04 0.00 0.00 34.50 30.58 2eny s PRO 40 CO -0.07 -0.89 0.37 0.00 0.04 0.00 0.00 177.00 176.44 2eny s ALA 41 N 4.10 3.78 -0.05 8.56 0.00 -1.26 -4.34 121.76 132.55 2eny s ALA 41 Ca 0.68 -0.53 -0.00 0.00 0.00 0.00 0.00 51.96 52.11 2eny s ALA 41 Cb -0.28 -2.15 0.03 0.00 0.00 0.00 0.00 23.12 20.71 2eny s ALA 41 CO 0.25 0.65 -0.02 1.41 0.00 0.00 0.00 175.76 178.05 2eny s MET 42 N -2.43 0.67 -0.25 0.00 1.75 -1.14 -5.08 119.30 112.83 2eny s MET 42 Ca 0.38 0.01 -0.07 0.00 -1.25 0.00 0.00 55.69 54.76 2eny s MET 42 Cb -0.13 -0.86 -0.03 0.00 2.84 0.00 0.00 34.83 36.66 2eny s MET 42 CO 0.23 -0.19 0.07 -1.58 -0.65 0.00 0.00 175.02 172.90 2eny s TRP 43 N 1.39 3.08 -0.24 4.11 0.52 -1.26 -2.89 118.94 123.66 2eny s TRP 43 Ca -0.04 -0.44 0.02 0.00 0.02 0.00 0.00 56.10 55.66 2eny s TRP 43 Cb -0.13 -2.23 0.06 0.00 -1.15 0.00 0.00 33.47 30.01 2eny s TRP 43 CO -0.03 -0.36 -0.08 0.95 0.02 0.00 0.00 176.95 177.45 2eny s THR 44 N 1.61 1.80 -0.27 2.01 -4.23 -0.05 -3.57 115.64 112.93 2eny s THR 44 Ca 0.06 -1.34 0.00 0.00 -1.18 0.00 0.00 61.69 59.23 2eny s THR 44 Cb -0.15 -1.97 0.05 0.00 1.34 0.00 0.00 72.50 71.77 2eny s THR 44 CO 0.03 -0.02 -0.07 0.54 -0.54 0.00 0.00 174.62 174.56 2eny s VAL 45 N 1.28 2.57 0.00 2.29 0.11 -1.25 -0.26 120.40 125.15 2eny s VAL 45 Ca -0.06 -1.41 0.00 0.00 -2.93 0.00 0.00 61.98 57.58 2eny s VAL 45 Cb -0.19 -2.45 0.00 0.00 -1.53 0.00 0.00 36.38 32.22 2eny s VAL 45 CO -0.06 0.01 0.00 0.61 -3.33 0.00 0.00 175.10 172.33 2eny n GLY 46 N 4.55 1.55 0.00 6.54 0.00 -0.26 -3.92 105.19 113.64 2eny n GLY 46 Ca -0.14 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 0.05 3.38 -0.02 0.00 -1.26 -4.97 105.19 102.37 2eny n GLY 47 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 0.63 -0.87 1.61 1.02 -1.25 -5.10 119.74 115.77 2eny s LYS 48 Ca 0.00 0.54 -0.25 0.00 0.02 0.00 0.00 55.97 56.28 2eny s LYS 48 Cb 0.00 0.30 0.04 0.00 -0.52 0.00 0.00 37.83 37.65 2eny s LYS 48 CO 0.00 -0.10 1.39 0.99 -0.92 0.00 0.00 175.35 176.71 2eny s THR 49 N -0.06 3.80 0.49 2.17 2.01 -1.26 -3.89 115.64 118.91 2eny s THR 49 Ca -0.03 -0.17 -0.07 0.00 0.31 0.00 0.00 61.69 61.74 2eny s THR 49 Cb -0.03 -4.94 -0.04 0.00 0.01 0.00 0.00 72.50 67.49 2eny s THR 49 CO 0.02 -1.85 0.81 0.68 -0.69 0.00 0.00 174.62 173.59 2eny s VAL 50 N 5.56 4.87 0.00 3.82 -7.23 -1.23 -4.75 120.40 121.44 2eny s VAL 50 Ca 0.42 0.34 0.00 0.00 -1.81 0.00 0.00 61.98 60.93 2eny s VAL 50 Cb -0.04 -3.85 0.00 0.00 0.56 0.00 0.00 36.38 33.05 2eny s VAL 50 CO 0.03 -0.85 0.00 0.61 -0.31 0.00 0.00 175.10 174.58 2eny n GLY 51 N -2.20 2.33 1.96 2.32 0.00 -1.24 -4.71 105.19 103.65 2eny n GLY 51 Ca 0.01 -0.27 -0.07 0.00 0.00 0.00 0.00 46.02 45.69 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 2.74 -0.14 1.61 7.64 -1.26 -4.50 113.62 119.71 2eny n SER 52 Ca 0.00 -2.98 0.01 0.00 1.01 0.00 0.00 58.87 56.92 2eny n SER 52 Cb 0.00 -0.41 0.03 0.00 -1.01 0.00 0.00 64.21 62.82 2eny n SER 52 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2eny n SER 53 N -0.57 2.15 -1.46 6.43 2.88 -1.26 -4.98 113.62 116.82 2eny n SER 53 Ca 0.22 -1.96 -0.09 0.00 -1.33 0.00 0.00 58.87 55.72 2eny n SER 53 Cb 0.89 -0.05 0.02 0.00 -0.75 0.00 0.00 64.21 64.33 2eny n SER 53 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2eny n SER 54 N -0.26 -3.46 -3.64 -3.46 2.88 -1.26 -5.02 113.62 99.39 2eny n SER 54 Ca 0.02 -0.15 -0.03 0.00 -1.33 0.00 0.00 58.87 57.39 2eny n SER 54 Cb 0.28 -2.24 -0.07 0.00 -0.75 0.00 0.00 64.21 61.43 2eny n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2eny s ARG 55 N -5.16 0.30 -1.31 -1.46 1.70 -1.26 -4.61 118.95 107.15 2eny s ARG 55 Ca 0.16 0.47 -0.03 0.00 -0.47 0.00 0.00 55.73 55.86 2eny s ARG 55 Cb -0.07 0.09 0.01 0.00 -0.57 0.00 0.00 34.95 34.41 2eny s ARG 55 CO 0.19 -0.05 0.89 1.19 -1.08 0.00 0.00 175.30 176.44 2eny n PHE 56 N 3.11 -2.17 -2.32 5.89 3.01 0.15 -3.80 117.46 121.32 2eny n PHE 56 Ca -0.16 0.90 -0.40 0.00 1.01 0.00 0.00 57.45 58.80 2eny n PHE 56 Cb 0.57 -4.64 -0.03 0.00 -0.01 0.00 0.00 39.48 35.36 2eny n PHE 56 CO 0.00 0.00 0.00 -1.14 1.01 0.00 0.00 176.76 176.63 2eny s GLN 57 N -5.91 4.48 -0.36 -1.08 0.74 -0.31 -3.61 119.66 113.61 2eny s GLN 57 Ca 0.16 1.97 -0.15 0.00 0.05 0.00 0.00 55.36 57.39 2eny s GLN 57 Cb -0.08 -3.10 -0.01 0.00 1.10 0.00 0.00 33.01 30.93 2eny s GLN 57 CO 0.78 0.01 0.35 0.00 -0.55 0.00 0.00 175.29 175.88 2eny s ALA 58 N -1.18 3.49 0.30 1.58 0.00 -1.26 -0.87 121.76 123.82 2eny s ALA 58 Ca 0.47 -1.30 0.06 0.00 0.00 0.00 0.00 51.96 51.19 2eny s ALA 58 Cb -0.35 -2.83 -0.02 0.00 0.00 0.00 0.00 23.12 19.92 2eny s ALA 58 CO 0.45 -1.14 0.40 0.95 0.00 0.00 0.00 175.76 176.42 2eny s THR 59 N 1.97 4.34 -0.28 0.00 -4.23 -1.13 -5.03 115.64 111.27 2eny s THR 59 Ca 0.10 -1.08 0.02 0.00 -1.18 0.00 0.00 61.69 59.56 2eny s THR 59 Cb -0.17 -3.50 0.06 0.00 1.34 0.00 0.00 72.50 70.24 2eny s THR 59 CO 0.12 -0.22 -0.06 -0.60 -0.54 0.00 0.00 174.62 173.32 2eny s ARG 60 N -4.07 2.19 -0.08 3.99 3.52 -1.26 -4.03 118.95 119.21 2eny s ARG 60 Ca 0.41 -1.40 0.01 0.00 -0.13 0.00 0.00 55.73 54.61 2eny s ARG 60 Cb -0.09 -3.02 0.02 0.00 -1.56 0.00 0.00 34.95 30.31 2eny s ARG 60 CO 0.29 -0.64 -0.08 -1.14 -0.81 0.00 0.00 175.30 172.93 2eny s GLN 61 N 1.11 1.36 0.00 5.12 -0.44 -1.21 -5.04 119.66 120.56 2eny s GLN 61 Ca -0.05 -0.24 0.00 0.00 -2.50 0.00 0.00 55.36 52.57 2eny s GLN 61 Cb -0.20 -1.32 0.00 0.00 -1.64 0.00 0.00 33.01 29.85 2eny s GLN 61 CO -0.04 -0.14 0.00 0.41 0.50 0.00 0.00 175.29 176.02 2eny n GLY 62 N 4.42 0.58 0.00 2.59 0.00 -1.26 -0.07 105.19 111.46 2eny n GLY 62 Ca -0.18 0.77 0.00 0.00 0.00 0.00 0.00 46.02 46.61 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 1.11 -4.92 1.61 0.00 -1.26 -4.43 116.66 108.77 2eny n ARG 63 Ca 0.00 -0.87 -0.33 0.00 -0.00 0.00 0.00 57.85 56.65 2eny n ARG 63 Cb 0.00 -0.69 -0.15 0.00 -0.00 0.00 0.00 32.46 31.63 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 -0.37 3.08 -0.22 2.89 2.20 0.90 -3.03 119.74 125.19 2eny s LYS 64 Ca 0.00 -0.74 -0.15 0.00 -0.36 0.00 0.00 55.97 54.72 2eny s LYS 64 Cb 0.00 -2.48 -0.04 0.00 -1.51 0.00 0.00 37.83 33.79 2eny s LYS 64 CO 0.00 0.31 0.34 0.71 -0.36 0.00 0.00 175.35 176.35 2eny s TYR 65 N 0.09 3.34 -0.31 4.03 2.02 0.21 -3.31 117.35 123.42 2eny s TYR 65 Ca -0.07 0.50 -0.05 0.00 -0.37 0.00 0.00 57.07 57.08 2eny s TYR 65 Cb -0.15 -2.48 0.03 0.00 -0.40 0.00 0.00 41.96 38.96 2eny s TYR 65 CO 0.05 -0.03 0.06 0.42 -1.57 0.00 0.00 175.55 174.49 2eny s ILE 66 N 1.37 3.62 -0.53 2.71 1.09 -1.26 -1.36 121.20 126.84 2eny s ILE 66 Ca 0.16 -1.01 -0.22 0.00 -1.10 0.00 0.00 60.65 58.47 2eny s ILE 66 Cb -0.15 -2.97 0.04 0.00 -1.06 0.00 0.00 42.46 38.33 2eny s ILE 66 CO 0.07 -0.04 0.83 -0.22 -0.10 0.00 0.00 174.94 175.49 2eny s LEU 67 N 1.40 4.38 -0.72 2.97 2.96 -1.13 -2.85 118.68 125.70 2eny s LEU 67 Ca -0.01 -0.50 -0.27 0.00 -0.22 0.00 0.00 54.13 53.13 2eny s LEU 67 Cb -0.18 -2.72 0.02 0.00 0.50 0.00 0.00 46.19 43.80 2eny s LEU 67 CO 0.01 -1.09 1.46 -0.69 -1.32 0.00 0.00 176.35 174.72 2eny s VAL 68 N 3.48 3.62 -0.39 1.68 1.01 -0.05 -2.04 120.40 127.72 2eny s VAL 68 Ca 0.26 0.29 -0.27 0.00 0.00 0.00 0.00 61.98 62.25 2eny s VAL 68 Cb -0.15 -4.64 0.02 0.00 0.00 0.00 0.00 36.38 31.61 2eny s VAL 68 CO 0.17 -1.59 1.02 -0.69 0.00 0.00 0.00 175.10 174.01 2eny s VAL 69 N 6.69 4.46 -0.02 2.92 1.01 -0.33 0.29 120.40 135.43 2eny s VAL 69 Ca 0.45 1.34 0.05 0.00 0.00 0.00 0.00 61.98 63.82 2eny s VAL 69 Cb -0.09 -4.43 -0.01 0.00 0.00 0.00 0.00 36.38 31.85 2eny s VAL 69 CO 0.15 -0.65 -0.18 -0.13 0.00 0.00 0.00 175.10 174.29 2eny s ARG 70 N 3.78 1.50 -0.80 2.72 0.52 -1.26 -2.58 118.95 122.83 2eny s ARG 70 Ca 0.43 -0.64 -0.03 0.00 -0.52 0.00 0.00 55.73 54.96 2eny s ARG 70 Cb -0.11 -1.43 0.00 0.00 0.52 0.00 0.00 34.95 33.94 2eny s ARG 70 CO 0.21 0.37 0.42 0.39 0.02 0.00 0.00 175.30 176.71 2eny n GLU 71 N 2.70 -3.14 -0.81 3.54 -0.58 -1.26 -4.36 120.64 116.73 2eny n GLU 71 Ca -0.15 0.47 -0.35 0.00 -0.42 0.00 0.00 57.16 56.71 2eny n GLU 71 Cb 0.54 -4.42 0.11 0.00 -0.57 0.00 0.00 31.44 27.10 2eny n GLU 71 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2eny n ALA 72 N -3.08 -4.67 -3.33 0.62 0.00 -1.25 -4.92 120.51 103.87 2eny n ALA 72 Ca -0.04 -1.23 -0.13 0.00 0.00 0.00 0.00 53.44 52.04 2eny n ALA 72 Cb 0.55 -1.28 -0.04 0.00 0.00 0.00 0.00 19.45 18.69 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 -2.16 -1.44 0.14 0.00 0.00 -1.26 -4.11 121.76 112.93 2eny s ALA 73 Ca 0.48 0.52 0.33 0.00 0.00 0.00 0.00 51.96 53.29 2eny s ALA 73 Cb -0.05 0.64 1.36 0.00 0.00 0.00 0.00 23.12 25.06 2eny s ALA 73 CO 0.67 -0.64 1.98 -1.00 0.00 0.00 0.00 175.76 176.77 2eny h PRO 74 N 2.36 0.00 0.04 0.00 0.13 -1.95 -3.21 132.00 129.36 2eny h PRO 74 Ca -0.32 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2eny h PRO 74 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2eny h PRO 74 CO 0.40 0.03 -0.02 0.66 -0.23 0.00 0.00 178.00 178.85 2eny h SER 75 N 0.00 -0.04 -1.00 1.44 4.64 -1.96 -3.30 113.55 113.33 2eny h SER 75 Ca -0.00 -0.62 0.27 0.00 -0.47 0.00 0.00 61.79 60.97 2eny h SER 75 Cb 0.51 0.01 -0.13 0.00 -0.31 0.00 0.00 62.40 62.48 2eny h SER 75 CO 0.00 0.72 0.59 0.44 -0.87 0.00 0.00 176.83 177.71 2eny h ASP 76 N -0.92 0.62 -0.55 4.97 3.32 -1.95 -3.41 116.42 118.49 2eny h ASP 76 Ca -0.01 0.16 -0.81 0.00 0.02 0.00 0.00 57.03 56.39 2eny h ASP 76 Cb 0.66 0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.26 2eny h ASP 76 CO 0.01 0.02 0.94 0.00 -1.72 0.00 0.00 179.24 178.49 2eny n ALA 77 N -2.30 -0.65 0.01 3.45 0.00 -1.22 -4.33 120.51 115.46 2eny n ALA 77 Ca 0.29 0.35 0.00 0.00 0.00 0.00 0.00 53.44 54.08 2eny n ALA 77 Cb 0.83 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 18.34 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 5.38 -1.99 3.63 0.00 0.00 -1.22 -5.00 105.19 105.99 2eny n GLY 78 Ca 0.40 0.68 -0.07 0.00 0.00 0.00 0.00 46.02 47.03 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 -1.22 0.39 -0.47 1.61 2.56 -1.26 -4.32 118.70 115.99 2eny s GLU 79 Ca 0.00 0.39 -0.01 0.00 0.00 0.00 0.00 54.97 55.34 2eny s GLU 79 Cb 0.00 0.19 0.12 0.00 2.00 0.00 0.00 34.13 36.44 2eny s GLU 79 CO 0.00 -0.06 0.26 0.08 -0.56 0.00 0.00 175.26 174.98 2eny s VAL 80 N -0.05 3.23 -0.07 3.70 1.01 0.47 -1.11 120.40 127.59 2eny s VAL 80 Ca 0.04 -2.45 -0.19 0.00 0.00 0.00 0.00 61.98 59.37 2eny s VAL 80 Cb -0.04 -3.20 -0.05 0.00 0.00 0.00 0.00 36.38 33.09 2eny s VAL 80 CO -0.08 -0.74 0.53 -0.69 0.00 0.00 0.00 175.10 174.12 2eny s VAL 81 N 0.65 5.07 -0.21 2.92 1.01 0.64 -3.24 120.40 127.24 2eny s VAL 81 Ca 0.12 1.09 -0.02 0.00 0.00 0.00 0.00 61.98 63.16 2eny s VAL 81 Cb -0.22 -3.87 0.07 0.00 0.00 0.00 0.00 36.38 32.36 2eny s VAL 81 CO -0.04 0.37 0.03 0.12 0.00 0.00 0.00 175.10 175.58 2eny s PHE 82 N 0.23 1.30 -0.16 5.22 5.36 -0.66 -0.87 117.98 128.40 2eny s PHE 82 Ca 0.29 -1.09 -0.07 0.00 -0.96 0.00 0.00 56.93 55.10 2eny s PHE 82 Cb -0.16 -1.18 -0.04 0.00 -0.34 0.00 0.00 43.02 41.29 2eny s PHE 82 CO 0.14 -0.67 0.06 0.45 -1.46 0.00 0.00 175.22 173.74 2eny s SER 83 N 1.77 5.67 -0.05 6.13 0.15 -1.14 -0.94 113.70 125.29 2eny s SER 83 Ca -0.00 0.13 0.01 0.00 0.70 0.00 0.00 55.95 56.79 2eny s SER 83 Cb -0.17 -1.92 0.02 0.00 -1.71 0.00 0.00 66.02 62.24 2eny s SER 83 CO -0.10 0.23 -0.06 0.54 1.20 0.00 0.00 173.24 175.05 2eny s VAL 84 N 0.05 0.63 -0.52 4.45 0.11 -0.38 -2.86 120.40 121.88 2eny s VAL 84 Ca 0.06 -0.18 -0.07 0.00 -2.93 0.00 0.00 61.98 58.86 2eny s VAL 84 Cb -0.12 -0.63 0.07 0.00 -1.53 0.00 0.00 36.38 34.16 2eny s VAL 84 CO 0.01 0.24 0.16 -2.11 -3.33 0.00 0.00 175.10 170.08 2eny n ARG 85 N 4.01 -1.77 0.00 1.54 -4.01 -1.26 0.52 116.66 115.68 2eny n ARG 85 Ca -0.25 0.04 0.00 0.00 -1.04 0.00 0.00 57.85 56.60 2eny n ARG 85 Cb 0.51 -3.20 0.00 0.00 -3.04 0.00 0.00 32.46 26.73 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 -0.56 2.92 3.10 2.89 0.00 -1.26 -5.08 105.19 107.19 2eny n GLY 86 Ca 0.03 -0.82 -0.36 0.00 0.00 0.00 0.00 46.02 44.86 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 -3.07 -3.55 0.99 4.77 0.18 -4.95 117.00 111.38 2eny n LEU 87 Ca 0.00 0.01 -0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2eny n LEU 87 Cb 0.00 -0.70 -0.04 0.00 -2.33 0.00 0.00 43.42 40.35 2eny n LEU 87 CO 0.00 -3.18 0.41 -0.89 -1.33 0.00 0.00 177.39 172.39 2eny s THR 88 N -2.08 -0.77 -0.02 -5.08 2.01 -1.26 -1.25 115.64 107.19 2eny s THR 88 Ca 0.43 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.43 2eny s THR 88 Cb -0.01 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 2eny s THR 88 CO 0.68 0.00 0.01 -0.94 -0.69 0.00 0.00 174.62 173.68 2eny s SER 89 N 2.68 5.21 -0.02 3.53 1.04 -0.12 -4.93 113.70 121.11 2eny s SER 89 Ca -0.05 0.05 0.08 0.00 0.48 0.00 0.00 55.95 56.51 2eny s SER 89 Cb -0.09 -1.41 -0.02 0.00 0.10 0.00 0.00 66.02 64.60 2eny s SER 89 CO -0.18 0.31 -0.25 -0.54 0.98 0.00 0.00 173.24 173.55 2eny s LYS 90 N -1.40 2.04 0.04 4.02 3.01 -1.26 -1.65 119.74 124.53 2eny s LYS 90 Ca 0.18 -0.91 -0.18 0.00 -1.01 0.00 0.00 55.97 54.05 2eny s LYS 90 Cb -0.12 -1.98 0.04 0.00 -1.01 0.00 0.00 37.83 34.76 2eny s LYS 90 CO 0.09 0.54 0.41 0.00 0.51 0.00 0.00 175.35 176.90 2eny s ALA 91 N -0.60 -1.00 -0.14 5.17 0.00 -1.20 -4.60 121.76 119.39 2eny s ALA 91 Ca 0.10 0.31 -0.05 0.00 0.00 0.00 0.00 51.96 52.32 2eny s ALA 91 Cb -0.10 0.33 -0.04 0.00 0.00 0.00 0.00 23.12 23.32 2eny s ALA 91 CO -0.01 -0.45 0.04 -1.12 0.00 0.00 0.00 175.76 174.22 2eny s SER 92 N -1.97 5.48 -0.20 0.00 0.01 -1.26 -0.39 113.70 115.36 2eny s SER 92 Ca -0.06 0.11 -0.02 0.00 1.31 0.00 0.00 55.95 57.29 2eny s SER 92 Cb -0.01 -1.80 -0.00 0.00 0.21 0.00 0.00 66.02 64.41 2eny s SER 92 CO -0.02 0.26 -0.09 -0.22 0.41 0.00 0.00 173.24 173.58 2eny s LEU 93 N -0.16 2.72 -0.17 2.44 2.96 -1.26 -2.79 118.68 122.41 2eny s LEU 93 Ca 0.06 -0.43 -0.08 0.00 -0.22 0.00 0.00 54.13 53.46 2eny s LEU 93 Cb -0.12 -1.67 -0.04 0.00 0.50 0.00 0.00 46.19 44.85 2eny s LEU 93 CO 0.02 0.01 0.10 -0.63 -1.32 0.00 0.00 176.35 174.52 2eny s ILE 94 N 1.28 5.10 -0.16 6.68 1.09 -0.51 -3.39 121.20 131.29 2eny s ILE 94 Ca 0.03 0.07 -0.02 0.00 -1.10 0.00 0.00 60.65 59.64 2eny s ILE 94 Cb -0.14 -3.29 0.05 0.00 -1.06 0.00 0.00 42.46 38.02 2eny s ILE 94 CO -0.04 0.49 0.01 -0.69 -0.10 0.00 0.00 174.94 174.61 2eny s VAL 95 N 0.03 0.62 -0.15 2.92 1.01 -1.26 -2.26 120.40 121.30 2eny s VAL 95 Ca 0.08 -0.43 -0.17 0.00 0.00 0.00 0.00 61.98 61.45 2eny s VAL 95 Cb -0.12 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 2eny s VAL 95 CO 0.00 -0.04 0.44 -0.13 0.00 0.00 0.00 175.10 175.37 2eny s ARG 96 N 1.83 4.27 0.39 2.72 1.81 -0.97 -4.70 118.95 124.31 2eny s ARG 96 Ca 0.01 0.34 -0.25 0.00 -1.72 0.00 0.00 55.73 54.11 2eny s ARG 96 Cb -0.16 -3.47 -0.12 0.00 -0.45 0.00 0.00 34.95 30.75 2eny s ARG 96 CO -0.07 0.08 0.93 -0.85 -0.68 0.00 0.00 175.30 174.71 2eny n GLU 97 N 3.99 1.21 -1.73 3.54 0.28 -1.26 -0.32 120.64 126.34 2eny n GLU 97 Ca -0.08 0.43 -0.18 0.00 -0.16 0.00 0.00 57.16 57.17 2eny n GLU 97 Cb 0.51 -1.91 -0.08 0.00 1.43 0.00 0.00 31.44 31.40 2eny n GLU 97 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 2eny s ARG 98 N -1.85 1.74 -0.62 3.44 3.52 -1.26 -4.69 118.95 119.22 2eny s ARG 98 Ca 0.62 -0.16 -0.07 0.00 -0.13 0.00 0.00 55.73 55.99 2eny s ARG 98 Cb -0.59 -4.96 0.16 0.00 -1.56 0.00 0.00 34.95 28.00 2eny s ARG 98 CO 0.57 -4.56 0.48 0.45 -0.81 0.00 0.00 175.30 171.44 2eny s SER 99 N 9.06 5.74 0.20 -2.12 0.15 -1.26 -5.03 113.70 120.43 2eny s SER 99 Ca 0.82 -2.51 0.00 0.00 0.70 0.00 0.00 55.95 54.96 2eny s SER 99 Cb -0.08 -1.98 0.00 0.00 -1.71 0.00 0.00 66.02 62.25 2eny s SER 99 CO 0.10 -0.52 0.00 0.61 1.20 0.00 0.00 173.24 174.64 2eny n GLY 100 N 4.06 -1.10 3.69 9.45 0.00 -1.26 -4.60 105.19 115.42 2eny n GLY 100 Ca 0.04 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.13 4.26 -0.18 1.61 0.04 -1.26 -5.01 135.00 132.33 2eny s PRO 101 Ca 0.00 2.02 0.01 0.00 0.04 0.00 0.00 61.00 63.07 2eny s PRO 101 Cb 0.00 -3.61 0.03 0.00 0.04 0.00 0.00 34.50 30.96 2eny s PRO 101 CO 0.00 -0.62 -0.13 0.45 0.04 0.00 0.00 177.00 176.74 2eny s SER 102 N 2.05 3.10 -0.36 6.66 0.15 -1.26 -5.10 113.70 118.94 2eny s SER 102 Ca 0.66 -0.70 -0.28 0.00 0.70 0.00 0.00 55.95 56.32 2eny s SER 102 Cb -0.32 -1.26 0.02 0.00 -1.71 0.00 0.00 66.02 62.75 2eny s SER 102 CO 0.27 -0.09 1.04 -0.44 1.20 0.00 0.00 173.24 175.23 2eny s SER 103 N 1.41 6.81 0.00 5.45 0.01 -1.26 -5.19 113.70 120.93 2eny s SER 103 Ca 0.02 0.82 0.00 0.00 1.31 0.00 0.00 55.95 58.10 2eny s SER 103 Cb -0.14 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.56 2eny s SER 103 CO -0.10 -0.94 0.00 0.61 0.41 0.00 0.00 173.24 173.22