#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dl0 n SER 2 N 0.00 0.00 -0.85 1.61 7.64 -1.26 -4.86 113.62 115.90 2dl0 n SER 2 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2dl0 n SER 2 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2dl0 n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dl0 n SER 3 N 2.93 -4.60 0.00 6.43 2.88 -1.26 -5.11 113.62 114.89 2dl0 n SER 3 Ca 0.00 1.02 0.00 0.00 -1.33 0.00 0.00 58.87 58.56 2dl0 n SER 3 Cb 0.00 -2.30 0.00 0.00 -0.75 0.00 0.00 64.21 61.16 2dl0 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dl0 n GLY 4 N -2.09 4.16 3.41 0.46 0.00 -1.26 -5.19 105.19 104.69 2dl0 n GLY 4 Ca 0.00 -0.64 -0.15 0.00 0.00 0.00 0.00 46.02 45.23 2dl0 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dl0 s SER 5 N 1.65 -0.48 0.60 1.61 0.01 -1.26 -5.18 113.70 110.65 2dl0 s SER 5 Ca 0.00 0.32 0.03 0.00 1.31 0.00 0.00 55.95 57.61 2dl0 s SER 5 Cb 0.00 0.49 0.08 0.00 0.21 0.00 0.00 66.02 66.79 2dl0 s SER 5 CO 0.00 -0.66 0.83 -0.55 0.41 0.00 0.00 173.24 173.26 2dl0 s SER 6 N -1.69 4.96 0.00 2.44 0.15 -1.26 -5.11 113.70 113.20 2dl0 s SER 6 Ca -0.08 -0.39 0.00 0.00 0.70 0.00 0.00 55.95 56.18 2dl0 s SER 6 Cb -0.01 -0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.03 2dl0 s SER 6 CO 0.02 -1.39 0.00 0.61 1.20 0.00 0.00 173.24 173.68 2dl0 n GLY 7 N -2.42 1.15 1.23 9.45 0.00 -1.26 -5.14 105.19 108.21 2dl0 n GLY 7 Ca 0.12 -0.06 0.15 0.00 0.00 0.00 0.00 46.02 46.23 2dl0 n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dl0 n GLY 8 N 3.96 -1.95 0.00 -0.02 0.00 -1.26 -5.00 105.19 100.92 2dl0 n GLY 8 Ca 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.17 2dl0 n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dl0 n GLY 9 N -3.74 3.62 3.53 -0.02 0.00 -1.26 -5.10 105.19 102.23 2dl0 n GLY 9 Ca -0.02 -0.52 -0.43 0.00 0.00 0.00 0.00 46.02 45.04 2dl0 n GLY 9 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dl0 s LEU 10 N 0.00 4.21 -0.20 0.99 0.20 -1.26 -5.02 118.68 117.60 2dl0 s LEU 10 Ca 0.00 -0.21 -0.01 0.00 0.69 0.00 0.00 54.13 54.60 2dl0 s LEU 10 Cb 0.00 -2.92 0.01 0.00 -0.43 0.00 0.00 46.19 42.84 2dl0 s LEU 10 CO 0.00 -1.04 -0.12 0.42 -0.29 0.00 0.00 176.35 175.32 2dl0 s THR 11 N 3.54 2.66 0.00 3.68 -4.23 -1.26 -5.06 115.64 114.97 2dl0 s THR 11 Ca 0.30 -0.77 0.00 0.00 -1.18 0.00 0.00 61.69 60.04 2dl0 s THR 11 Cb -0.12 -2.19 0.00 0.00 1.34 0.00 0.00 72.50 71.53 2dl0 s THR 11 CO 0.21 0.46 0.00 -1.84 -0.54 0.00 0.00 174.62 172.91 2dl0 n GLU 12 N 4.69 -0.01 -2.51 3.99 0.28 -1.26 -4.49 120.64 121.33 2dl0 n GLU 12 Ca -0.19 0.01 -0.42 0.00 -0.16 0.00 0.00 57.16 56.39 2dl0 n GLU 12 Cb 0.50 -0.01 -0.03 0.00 1.43 0.00 0.00 31.44 33.33 2dl0 n GLU 12 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2dl0 s ILE 13 N -0.02 4.33 -0.36 3.84 -1.09 -1.26 -5.00 121.20 121.63 2dl0 s ILE 13 Ca 0.00 1.66 -0.22 0.00 -2.23 0.00 0.00 60.65 59.87 2dl0 s ILE 13 Cb 0.00 -4.07 0.01 0.00 -1.58 0.00 0.00 42.46 36.82 2dl0 s ILE 13 CO 0.00 0.10 0.71 0.00 -1.23 0.00 0.00 174.94 174.52 2dl0 n ARG 15 N 6.23 -3.81 -4.36 0.00 3.00 -1.26 -5.03 116.66 111.42 2dl0 n ARG 15 Ca 0.01 2.83 -0.25 0.00 -0.00 0.00 0.00 57.85 60.44 2dl0 n ARG 15 Cb 0.48 -3.75 -0.13 0.00 0.00 0.00 0.00 32.46 29.06 2dl0 n ARG 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 2dl0 s LYS 16 N -0.46 1.19 0.97 -0.14 -2.85 -1.26 -5.15 119.74 112.05 2dl0 s LYS 16 Ca -0.09 -1.13 -0.12 0.00 -1.00 0.00 0.00 55.97 53.63 2dl0 s LYS 16 Cb 0.01 -1.45 0.17 0.00 -2.06 0.00 0.00 37.83 34.50 2dl0 s LYS 16 CO 0.24 0.34 1.09 -1.25 0.10 0.00 0.00 175.35 175.87 2dl0 s PRO 17 N -1.78 0.66 -0.29 1.78 0.04 -1.26 -5.07 135.00 129.07 2dl0 s PRO 17 Ca 0.07 0.61 0.05 0.00 0.04 0.00 0.00 61.00 61.77 2dl0 s PRO 17 Cb -0.10 -1.76 0.20 0.00 0.04 0.00 0.00 34.50 32.89 2dl0 s PRO 17 CO 0.04 -2.60 0.61 0.08 0.04 0.00 0.00 177.00 175.17 2dl0 s VAL 18 N -2.95 -0.96 -0.39 -0.36 1.01 -1.26 -5.03 120.40 110.46 2dl0 s VAL 18 Ca 0.65 0.00 -0.14 0.00 0.00 0.00 0.00 61.98 62.49 2dl0 s VAL 18 Cb -0.18 -0.97 0.02 0.00 0.00 0.00 0.00 36.38 35.25 2dl0 s VAL 18 CO 0.57 0.00 0.52 -1.20 0.00 0.00 0.00 175.10 174.99 2dl0 n SER 19 N 5.41 -7.51 -0.11 3.32 7.64 -1.26 -4.95 113.62 116.15 2dl0 n SER 19 Ca 0.05 0.55 -0.13 0.00 1.01 0.00 0.00 58.87 60.35 2dl0 n SER 19 Cb 0.54 -5.07 -0.01 0.00 -1.01 0.00 0.00 64.21 58.66 2dl0 n SER 19 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2dl0 h PRO 20 N 1.91 0.92 0.00 1.43 0.13 -1.95 -3.47 132.00 130.96 2dl0 h PRO 20 Ca 0.00 -0.48 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2dl0 h PRO 20 Cb 0.86 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.01 2dl0 h PRO 20 CO 0.18 1.14 0.00 0.41 -0.23 0.00 0.00 178.00 179.49 2dl0 n GLY 21 N 0.12 3.24 3.06 1.56 0.00 -1.26 -4.99 105.19 106.92 2dl0 n GLY 21 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 2dl0 n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dl0 s ILE 23 N 1.03 5.15 -0.23 0.00 1.01 -1.26 -4.95 121.20 121.95 2dl0 s ILE 23 Ca 0.01 0.81 -0.06 0.00 0.00 0.00 0.00 60.65 61.42 2dl0 s ILE 23 Cb -0.20 -3.78 -0.12 0.00 0.01 0.00 0.00 42.46 38.38 2dl0 s ILE 23 CO -0.06 0.21 -0.26 -0.24 0.00 0.00 0.00 174.94 174.60 2dl0 n SER 24 N 4.67 1.92 -3.43 3.58 2.88 -1.26 -5.01 113.62 116.97 2dl0 n SER 24 Ca -0.07 0.12 -0.21 0.00 -1.33 0.00 0.00 58.87 57.38 2dl0 n SER 24 Cb 0.51 -0.54 -0.07 0.00 -0.75 0.00 0.00 64.21 63.36 2dl0 n SER 24 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dl0 n SER 25 N -3.67 0.63 -0.01 -3.46 2.88 -1.26 -4.90 113.62 103.83 2dl0 n SER 25 Ca -0.43 -2.95 -0.09 0.00 -1.33 0.00 0.00 58.87 54.07 2dl0 n SER 25 Cb 0.86 1.10 -0.06 0.00 -0.75 0.00 0.00 64.21 65.36 2dl0 n SER 25 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2dl0 h VAL 26 N 1.71 0.00 -0.81 2.46 2.07 -1.86 -2.34 116.25 117.48 2dl0 h VAL 26 Ca -0.26 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.35 2dl0 h VAL 26 Cb 1.08 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.74 2dl0 h VAL 26 CO 0.41 0.00 -0.41 -1.20 0.02 0.00 0.00 177.57 176.38 2dl0 n SER 27 N -4.22 -0.72 -0.30 0.57 7.64 -1.26 0.17 113.62 115.49 2dl0 n SER 27 Ca -0.03 1.43 0.13 0.00 1.01 0.00 0.00 58.87 61.41 2dl0 n SER 27 Cb 0.22 -0.24 0.30 0.00 -1.01 0.00 0.00 64.21 63.48 2dl0 n SER 27 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2dl0 h ASP 28 N 0.00 0.25 -0.06 6.43 3.32 -1.84 0.27 116.42 124.80 2dl0 h ASP 28 Ca 0.19 0.16 -0.17 0.00 0.02 0.00 0.00 57.03 57.23 2dl0 h ASP 28 Cb 0.40 0.17 -0.00 0.00 0.22 0.00 0.00 39.33 40.11 2dl0 h ASP 28 CO -0.78 -0.04 -0.57 -0.25 -1.72 0.00 0.00 179.24 175.88 2dl0 h TRP 29 N 0.35 0.82 -0.30 4.55 7.01 0.20 -2.50 115.95 126.09 2dl0 h TRP 29 Ca 0.56 -0.30 -0.03 0.00 2.11 0.00 0.00 58.89 61.22 2dl0 h TRP 29 Cb 1.08 -0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 27.97 2dl0 h TRP 29 CO -0.17 1.07 0.04 -0.07 -2.79 0.00 0.00 178.44 176.52 2dl0 h LEU 30 N 0.49 0.40 -0.10 0.65 3.38 0.26 -2.54 115.31 117.85 2dl0 h LEU 30 Ca 0.00 -0.06 -0.24 0.00 0.09 0.00 0.00 57.88 57.67 2dl0 h LEU 30 Cb 1.14 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.80 2dl0 h LEU 30 CO 0.11 0.44 -0.99 0.40 0.09 0.00 0.00 178.44 178.49 2dl0 h ILE 31 N 0.43 1.36 0.00 1.22 2.04 -0.89 0.27 117.51 121.94 2dl0 h ILE 31 Ca 0.10 -2.39 0.00 0.00 1.00 0.00 0.00 64.86 63.56 2dl0 h ILE 31 Cb 0.23 2.43 0.00 0.00 -0.74 0.00 0.00 36.82 38.73 2dl0 h ILE 31 CO 0.00 0.72 0.00 -1.28 0.00 0.00 0.00 178.15 177.60 2dl0 h SER 32 N 0.28 0.00 0.00 1.72 0.87 -1.04 -1.80 113.55 113.58 2dl0 h SER 32 Ca -0.10 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.44 2dl0 h SER 32 Cb 1.64 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.60 2dl0 h SER 32 CO 0.18 0.00 -2.01 2.30 -0.53 0.00 0.00 176.83 176.77 2dl0 n ILE 33 N -2.84 0.07 -0.25 2.23 -5.35 -1.05 -4.94 119.36 107.22 2dl0 n ILE 33 Ca -0.01 -0.51 0.00 0.00 -0.27 0.00 0.00 62.75 61.96 2dl0 n ILE 33 Cb 0.15 -0.02 0.00 0.00 -1.74 0.00 0.00 39.64 38.04 2dl0 n ILE 33 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dl0 n GLY 34 N 1.30 1.23 2.55 3.28 0.00 -0.68 -5.01 105.19 107.86 2dl0 n GLY 34 Ca -0.05 -0.18 -0.16 0.00 0.00 0.00 0.00 46.02 45.62 2dl0 n GLY 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dl0 n LEU 35 N 0.00 3.01 0.03 0.99 4.77 0.89 -4.85 117.00 121.83 2dl0 n LEU 35 Ca 0.00 -4.32 0.08 0.00 -0.03 0.00 0.00 56.01 51.74 2dl0 n LEU 35 Cb 0.04 0.03 0.34 0.00 -2.33 0.00 0.00 43.42 41.50 2dl0 n LEU 35 CO 0.00 1.82 0.75 -0.81 -1.33 0.00 0.00 177.39 177.82 2dl0 n PRO 36 N -0.33 0.04 0.25 3.23 -0.04 -1.14 -2.62 135.00 134.40 2dl0 n PRO 36 Ca 0.23 0.29 0.12 0.00 -0.04 0.00 0.00 63.50 64.11 2dl0 n PRO 36 Cb 0.77 -1.58 0.65 0.00 -0.04 0.00 0.00 33.50 33.29 2dl0 n PRO 36 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dl0 h MET 37 N 0.00 0.00 0.00 0.54 -0.00 -1.90 -2.00 114.93 111.57 2dl0 h MET 37 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2dl0 h MET 37 Cb 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.87 2dl0 h MET 37 CO 0.00 0.15 -0.52 1.88 -0.00 0.00 0.00 176.91 178.43 2dl0 h TYR 38 N 0.00 0.00 -0.89 -0.10 0.05 -1.91 -3.39 116.97 110.74 2dl0 h TYR 38 Ca -0.00 0.00 0.08 0.00 0.05 0.00 0.00 58.73 58.86 2dl0 h TYR 38 Cb 0.47 0.00 -0.11 0.00 1.01 0.00 0.00 36.73 38.10 2dl0 h TYR 38 CO 0.00 0.00 -0.53 0.00 -1.05 0.00 0.00 178.16 176.58 2dl0 n ALA 39 N -1.87 -0.57 0.20 3.88 0.00 -0.75 0.71 120.51 122.11 2dl0 n ALA 39 Ca 0.03 0.76 0.07 0.00 0.00 0.00 0.00 53.44 54.30 2dl0 n ALA 39 Cb 0.45 -0.10 0.40 0.00 0.00 0.00 0.00 19.45 20.21 2dl0 n ALA 39 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2dl0 h GLY 40 N 0.00 0.00 0.58 0.00 0.00 -1.77 -2.42 103.07 99.46 2dl0 h GLY 40 Ca 0.14 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.44 2dl0 h GLY 40 CO -0.84 0.00 -0.28 -0.84 0.00 0.00 0.00 176.54 174.58 2dl0 h THR 41 N 0.00 0.00 -0.95 4.70 2.02 0.09 -2.34 112.91 116.43 2dl0 h THR 41 Ca -0.00 -0.29 0.01 0.00 0.77 0.00 0.00 66.41 66.90 2dl0 h THR 41 Cb 0.79 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.16 2dl0 h THR 41 CO 0.04 0.00 0.63 -0.07 0.37 0.00 0.00 175.52 176.49 2dl0 h LEU 42 N -1.07 1.09 -1.58 2.58 3.38 -0.47 -1.73 115.31 117.50 2dl0 h LEU 42 Ca -0.08 -0.03 0.07 0.00 0.09 0.00 0.00 57.88 57.94 2dl0 h LEU 42 Cb 0.60 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 2dl0 h LEU 42 CO 0.13 0.79 0.39 -1.28 0.09 0.00 0.00 178.44 178.56 2dl0 h SER 43 N 1.28 0.44 0.33 -0.43 0.87 -1.42 0.48 113.55 115.11 2dl0 h SER 43 Ca 0.35 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.74 2dl0 h SER 43 Cb -0.14 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.72 2dl0 h SER 43 CO -0.08 0.28 -0.71 0.74 -0.53 0.00 0.00 176.83 176.54 2dl0 h THR 44 N 0.50 1.40 0.00 2.23 2.02 -0.75 -2.98 112.91 115.33 2dl0 h THR 44 Ca 0.26 -2.15 0.00 0.00 0.77 0.00 0.00 66.41 65.29 2dl0 h THR 44 Cb 0.37 2.12 0.00 0.00 -1.74 0.00 0.00 68.15 68.89 2dl0 h THR 44 CO -0.07 0.64 0.00 0.00 0.37 0.00 0.00 175.52 176.46 2dl0 h ALA 45 N 1.02 1.00 0.00 6.16 0.00 -0.80 -3.46 119.26 123.18 2dl0 h ALA 45 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2dl0 h ALA 45 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2dl0 h ALA 45 CO 0.12 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.78 2dl0 n GLY 46 N 0.34 1.39 3.56 0.00 0.00 -0.74 -5.06 105.19 104.67 2dl0 n GLY 46 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 2dl0 n GLY 46 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dl0 s PHE 47 N -1.15 1.61 0.00 1.61 0.08 0.02 -4.56 117.98 115.59 2dl0 s PHE 47 Ca 0.00 0.97 0.00 0.00 0.12 0.00 0.00 56.93 58.02 2dl0 s PHE 47 Cb 0.00 -3.91 0.00 0.00 -0.57 0.00 0.00 43.02 38.54 2dl0 s PHE 47 CO 0.00 -1.86 0.00 0.45 -0.10 0.00 0.00 175.22 173.71 2dl0 n SER 48 N 14.75 0.72 -4.61 1.36 2.88 -1.26 -3.29 113.62 124.17 2dl0 n SER 48 Ca 0.38 -0.40 -0.31 0.00 -1.33 0.00 0.00 58.87 57.21 2dl0 n SER 48 Cb 0.48 0.94 -0.10 0.00 -0.75 0.00 0.00 64.21 64.78 2dl0 n SER 48 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2dl0 s THR 49 N -1.09 3.65 -2.00 2.46 -4.23 -1.26 -4.68 115.64 108.49 2dl0 s THR 49 Ca 0.00 -0.96 0.22 0.00 -1.18 0.00 0.00 61.69 59.77 2dl0 s THR 49 Cb 0.00 -2.66 0.63 0.00 1.34 0.00 0.00 72.50 71.81 2dl0 s THR 49 CO 0.00 0.25 1.75 0.18 -0.54 0.00 0.00 174.62 176.27 2dl0 n LEU 50 N 1.10 0.00 0.08 4.79 4.77 -1.26 -3.06 117.00 123.42 2dl0 n LEU 50 Ca -0.14 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.74 2dl0 n LEU 50 Cb 0.52 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.52 2dl0 n LEU 50 CO 0.33 0.00 0.11 -1.28 -1.33 0.00 0.00 177.39 175.23 2dl0 h SER 51 N 0.00 0.22 1.50 -1.43 0.87 -2.00 -3.23 113.55 109.48 2dl0 h SER 51 Ca 0.00 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.34 2dl0 h SER 51 Cb 0.00 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 61.89 2dl0 h SER 51 CO 0.00 1.12 -0.35 1.56 -0.53 0.00 0.00 176.83 178.63 2dl0 h GLN 52 N 0.06 0.00 0.70 2.24 4.20 -1.92 -3.34 115.11 117.05 2dl0 h GLN 52 Ca -0.06 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.62 2dl0 h GLN 52 Cb 1.75 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.53 2dl0 h GLN 52 CO 0.16 0.00 -0.40 0.28 -0.67 0.00 0.00 178.83 178.20 2dl0 h VAL 53 N 0.00 0.20 0.00 -0.54 2.07 -1.67 -1.86 116.25 114.45 2dl0 h VAL 53 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2dl0 h VAL 53 Cb 0.93 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 2dl0 h VAL 53 CO 0.00 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.78 2dl0 n PRO 54 N -5.54 0.25 -0.34 1.57 -0.04 -1.25 -2.13 135.00 127.51 2dl0 n PRO 54 Ca -0.14 0.12 0.07 0.00 -0.04 0.00 0.00 63.50 63.52 2dl0 n PRO 54 Cb 0.43 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.58 2dl0 n PRO 54 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dl0 n SER 55 N -1.24 2.88 -4.10 3.54 2.88 -0.85 -4.45 113.62 112.28 2dl0 n SER 55 Ca 0.08 -3.22 -0.29 0.00 -1.33 0.00 0.00 58.87 54.11 2dl0 n SER 55 Cb 0.11 -0.51 0.25 0.00 -0.75 0.00 0.00 64.21 63.31 2dl0 n SER 55 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2dl0 n LEU 56 N -1.03 -1.66 -3.63 2.46 4.77 -0.76 -4.99 117.00 112.15 2dl0 n LEU 56 Ca 0.20 -0.35 -0.11 0.00 -0.03 0.00 0.00 56.01 55.72 2dl0 n LEU 56 Cb 0.79 -1.09 -0.07 0.00 -2.33 0.00 0.00 43.42 40.71 2dl0 n LEU 56 CO 0.08 -3.58 0.58 -0.55 -1.33 0.00 0.00 177.39 172.60 2dl0 s SER 57 N -2.37 -0.60 0.28 -1.43 0.15 -1.26 -4.98 113.70 103.48 2dl0 s SER 57 Ca 0.63 1.14 0.05 0.00 0.70 0.00 0.00 55.95 58.48 2dl0 s SER 57 Cb -0.18 1.17 0.78 0.00 -1.71 0.00 0.00 66.02 66.07 2dl0 s SER 57 CO 0.62 -0.20 1.37 1.57 1.20 0.00 0.00 173.24 177.80 2dl0 n HIS 58 N 2.57 0.66 -0.07 3.44 -0.00 -1.26 0.12 115.22 120.68 2dl0 n HIS 58 Ca -0.14 1.05 -0.13 0.00 0.46 0.00 0.00 57.72 58.96 2dl0 n HIS 58 Cb 0.56 -1.22 -0.06 0.00 -0.12 0.00 0.00 29.99 29.15 2dl0 n HIS 58 CO 0.00 0.00 0.00 1.15 0.46 0.00 0.00 176.34 177.95 2dl0 h THR 59 N 0.00 1.32 -0.82 3.57 2.02 -1.98 -1.52 112.91 115.50 2dl0 h THR 59 Ca 0.58 -1.37 0.14 0.00 0.77 0.00 0.00 66.41 66.52 2dl0 h THR 59 Cb 1.28 1.72 -0.09 0.00 -1.74 0.00 0.00 68.15 69.32 2dl0 h THR 59 CO -0.79 0.42 0.41 0.00 0.37 0.00 0.00 175.52 175.93 2dl0 h LEU 61 N 0.60 0.77 -1.00 0.00 3.38 -1.14 -3.19 115.31 114.73 2dl0 h LEU 61 Ca 0.44 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2dl0 h LEU 61 Cb 0.61 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.08 2dl0 h LEU 61 CO -0.36 1.36 0.62 1.56 0.09 0.00 0.00 178.44 181.71 2dl0 h GLN 62 N 0.38 1.30 -0.50 1.13 1.08 -0.15 -1.17 115.11 117.18 2dl0 h GLN 62 Ca -0.08 -0.09 -0.03 0.00 -1.45 0.00 0.00 58.65 57.00 2dl0 h GLN 62 Cb 1.53 -0.28 -0.02 0.00 -0.05 0.00 0.00 27.48 28.65 2dl0 h GLN 62 CO 0.17 0.88 0.19 0.93 -0.95 0.00 0.00 178.83 180.05 2dl0 h GLU 63 N 1.33 0.73 -0.08 1.46 4.39 -0.91 -2.19 114.58 119.31 2dl0 h GLU 63 Ca 0.35 -0.11 -0.12 0.00 0.34 0.00 0.00 59.36 59.83 2dl0 h GLU 63 Cb -0.12 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.39 2dl0 h GLU 63 CO -0.07 0.61 -0.49 0.00 -1.16 0.00 0.00 179.01 177.89 2dl0 h ALA 64 N 1.50 1.03 0.00 3.43 0.00 -1.36 -3.47 119.26 120.39 2dl0 h ALA 64 Ca 0.17 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2dl0 h ALA 64 Cb 0.16 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2dl0 h ALA 64 CO -0.02 0.65 0.00 0.41 0.00 0.00 0.00 179.25 180.29 2dl0 n GLY 65 N -0.01 0.04 3.67 0.00 0.00 -0.82 -4.98 105.19 103.08 2dl0 n GLY 65 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 2dl0 n GLY 65 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dl0 s ILE 66 N -0.81 4.59 0.00 -0.61 1.01 -0.51 -4.85 121.20 120.01 2dl0 s ILE 66 Ca 0.00 1.91 0.00 0.00 0.00 0.00 0.00 60.65 62.56 2dl0 s ILE 66 Cb 0.00 -4.23 0.00 0.00 0.01 0.00 0.00 42.46 38.24 2dl0 s ILE 66 CO 0.00 -0.13 0.00 0.35 0.00 0.00 0.00 174.94 175.16 2dl0 n THR 67 N 5.16 0.00 -1.53 2.92 -2.24 -1.26 -3.50 114.28 113.82 2dl0 n THR 67 Ca 0.12 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.70 2dl0 n THR 67 Cb 0.46 -0.70 -0.13 0.00 -2.10 0.00 0.00 70.33 67.86 2dl0 n THR 67 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2dl0 n GLU 68 N -1.75 0.35 -0.17 -0.78 0.00 -1.26 -4.70 120.64 112.32 2dl0 n GLU 68 Ca 0.00 -0.41 0.29 0.00 0.00 0.00 0.00 57.16 57.04 2dl0 n GLU 68 Cb 0.38 -2.52 0.59 0.00 0.00 0.00 0.00 31.44 29.90 2dl0 n GLU 68 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 2dl0 h GLU 69 N 12.56 0.00 -0.14 3.44 5.08 -1.98 0.60 114.58 134.15 2dl0 h GLU 69 Ca -0.01 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 2dl0 h GLU 69 Cb 1.09 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.34 2dl0 h GLU 69 CO 1.28 0.00 -0.06 0.00 -1.00 0.00 0.00 179.01 179.23 2dl0 h ARG 70 N 0.00 0.29 0.04 2.33 2.47 -2.00 -2.34 114.38 115.17 2dl0 h ARG 70 Ca 0.45 -0.12 -0.21 0.00 -1.26 0.00 0.00 59.98 58.83 2dl0 h ARG 70 Cb 2.40 -0.01 0.02 0.00 -1.65 0.00 0.00 29.97 30.73 2dl0 h ARG 70 CO -0.00 0.61 -0.86 0.45 0.56 0.00 0.00 179.97 180.72 2dl0 h HIS 71 N -0.04 0.80 -0.77 3.04 3.86 -0.27 -2.95 115.15 118.81 2dl0 h HIS 71 Ca 0.03 -0.46 0.11 0.00 -1.16 0.00 0.00 60.37 58.89 2dl0 h HIS 71 Cb 0.52 -0.08 -0.08 0.00 1.06 0.00 0.00 27.41 28.83 2dl0 h HIS 71 CO 0.06 1.30 0.39 0.82 0.86 0.00 0.00 177.93 181.36 2dl0 h ILE 72 N 0.07 0.80 -0.17 2.45 2.04 -1.00 0.71 117.51 122.42 2dl0 h ILE 72 Ca -0.12 -0.21 -0.12 0.00 1.00 0.00 0.00 64.86 65.40 2dl0 h ILE 72 Cb 1.56 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 2dl0 h ILE 72 CO 0.17 0.11 -0.43 0.03 0.00 0.00 0.00 178.15 178.03 2dl0 h ARG 73 N 0.62 0.40 -0.24 2.37 3.08 -1.49 -2.27 114.38 116.85 2dl0 h ARG 73 Ca 0.39 -0.21 -0.05 0.00 0.07 0.00 0.00 59.98 60.19 2dl0 h ARG 73 Cb 0.47 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 2dl0 h ARG 73 CO -0.31 0.76 -0.03 -0.22 -1.07 0.00 0.00 179.97 179.10 2dl0 h LYS 74 N 0.33 0.44 -0.50 0.04 3.64 -0.93 -0.97 116.57 118.62 2dl0 h LYS 74 Ca 0.03 -0.16 -0.03 0.00 -1.27 0.00 0.00 60.65 59.21 2dl0 h LYS 74 Cb 0.90 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.67 2dl0 h LYS 74 CO 0.08 0.65 0.19 -0.07 -2.27 0.00 0.00 179.45 178.02 2dl0 h LEU 75 N 0.20 0.70 -0.88 5.20 3.38 -0.89 0.23 115.31 123.24 2dl0 h LEU 75 Ca 0.06 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 2dl0 h LEU 75 Cb 0.47 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 2dl0 h LEU 75 CO 0.02 0.69 0.10 -0.07 0.09 0.00 0.00 178.44 179.27 2dl0 h LEU 76 N 0.67 0.88 -0.20 1.67 3.38 -1.37 0.35 115.31 120.70 2dl0 h LEU 76 Ca 0.16 -0.19 -0.22 0.00 0.09 0.00 0.00 57.88 57.73 2dl0 h LEU 76 Cb 0.22 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.74 2dl0 h LEU 76 CO -0.01 0.89 -0.81 -1.28 0.09 0.00 0.00 178.44 177.31 2dl0 h SER 77 N 0.88 0.82 0.35 -0.43 0.87 -0.90 -2.47 113.55 112.68 2dl0 h SER 77 Ca 0.18 -0.56 -0.18 0.00 -1.23 0.00 0.00 61.79 60.00 2dl0 h SER 77 Cb 0.38 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 2dl0 h SER 77 CO 0.01 1.35 -0.75 0.00 -0.53 0.00 0.00 176.83 176.91 2dl0 h ALA 78 N 0.63 0.62 -0.41 6.23 0.00 -0.36 -2.99 119.26 122.98 2dl0 h ALA 78 Ca -0.06 -0.63 -0.12 0.00 0.00 0.00 0.00 54.91 54.10 2dl0 h ALA 78 Cb 1.43 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 2dl0 h ALA 78 CO 0.16 0.79 -0.23 0.00 0.00 0.00 0.00 179.25 179.97 2dl0 h ALA 79 N 0.99 0.58 0.00 0.00 0.00 -0.31 -2.77 119.26 117.74 2dl0 h ALA 79 Ca -0.03 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 2dl0 h ALA 79 Cb 1.32 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 2dl0 h ALA 79 CO 0.12 0.57 -0.12 0.00 0.00 0.00 0.00 179.25 179.82 2dl0 h ARG 80 N 0.70 0.00 -0.01 0.00 3.08 -1.46 -1.56 114.38 115.13 2dl0 h ARG 80 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2dl0 h ARG 80 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.85 2dl0 h ARG 80 CO 0.07 0.12 -0.16 1.28 -1.07 0.00 0.00 179.97 180.21 2dl0 n LEU 81 N -3.44 0.88 -4.55 3.04 4.77 -1.07 -4.77 117.00 111.85 2dl0 n LEU 81 Ca -0.01 -0.20 -0.40 0.00 -0.03 0.00 0.00 56.01 55.37 2dl0 n LEU 81 Cb 0.29 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 2dl0 n LEU 81 CO 0.30 0.16 1.33 0.12 -1.33 0.00 0.00 177.39 177.97 2dl0 s PHE 82 N -2.40 2.05 -0.73 -1.77 5.36 -0.59 -4.95 117.98 114.96 2dl0 s PHE 82 Ca 0.29 0.27 -0.21 0.00 -0.96 0.00 0.00 56.93 56.32 2dl0 s PHE 82 Cb 0.20 -4.43 0.09 0.00 -0.34 0.00 0.00 43.02 38.54 2dl0 s PHE 82 CO 0.47 -2.16 0.97 0.21 -1.46 0.00 0.00 175.22 173.25 2dl0 s LYS 83 N 6.21 3.24 0.36 10.12 2.20 -1.26 -4.91 119.74 135.71 2dl0 s LYS 83 Ca 0.47 -1.18 -0.26 0.00 -0.36 0.00 0.00 55.97 54.64 2dl0 s LYS 83 Cb -0.10 -4.44 -0.09 0.00 -1.51 0.00 0.00 37.83 31.69 2dl0 s LYS 83 CO 0.17 -1.76 1.08 -0.51 -0.36 0.00 0.00 175.35 173.97 2dl0 s LEU 84 N 3.44 4.27 0.51 5.43 1.43 -1.26 -5.02 118.68 127.49 2dl0 s LEU 84 Ca 0.24 2.15 -0.21 0.00 -1.03 0.00 0.00 54.13 55.27 2dl0 s LEU 84 Cb -0.14 -4.00 -0.06 0.00 0.03 0.00 0.00 46.19 42.01 2dl0 s LEU 84 CO 0.04 -0.42 1.14 -2.16 0.23 0.00 0.00 176.35 175.18 2dl0 s PRO 85 N -2.16 3.51 0.11 1.29 0.04 -1.26 -4.98 135.00 131.54 2dl0 s PRO 85 Ca 0.54 1.67 -0.31 0.00 0.04 0.00 0.00 61.00 62.94 2dl0 s PRO 85 Cb -0.26 -2.16 -0.08 0.00 0.04 0.00 0.00 34.50 32.05 2dl0 s PRO 85 CO 0.33 -0.73 1.37 -1.25 0.04 0.00 0.00 177.00 176.75 2dl0 s PRO 86 N -3.06 4.33 -0.06 0.56 0.04 -1.26 -4.36 135.00 131.19 2dl0 s PRO 86 Ca 0.69 2.04 -0.01 0.00 0.04 0.00 0.00 61.00 63.76 2dl0 s PRO 86 Cb -0.26 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 31.02 2dl0 s PRO 86 CO 0.30 -0.42 0.05 0.41 0.04 0.00 0.00 177.00 177.37 2dl0 n GLY 87 N 3.47 -1.92 0.00 0.56 0.00 -1.26 -4.91 105.19 101.12 2dl0 n GLY 87 Ca 0.11 -0.02 0.07 0.00 0.00 0.00 0.00 46.02 46.18 2dl0 n GLY 87 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dl0 n PRO 88 N -0.18 0.02 -1.55 1.61 -0.04 -1.26 -4.05 135.00 129.55 2dl0 n PRO 88 Ca 0.01 0.24 -0.00 0.00 -0.04 0.00 0.00 63.50 63.71 2dl0 n PRO 88 Cb 0.03 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.01 2dl0 n PRO 88 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2dl0 n GLU 89 N -1.48 0.13 -3.62 0.54 4.07 -1.26 -5.16 120.64 113.87 2dl0 n GLU 89 Ca 0.04 -0.12 -0.00 0.00 -0.06 0.00 0.00 57.16 57.01 2dl0 n GLU 89 Cb 0.16 0.07 -0.01 0.00 -0.06 0.00 0.00 31.44 31.60 2dl0 n GLU 89 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2dl0 s ALA 90 N 0.01 -2.32 0.69 4.31 0.00 -1.26 -5.17 121.76 118.03 2dl0 s ALA 90 Ca 0.01 1.64 -0.11 0.00 0.00 0.00 0.00 51.96 53.50 2dl0 s ALA 90 Cb 0.04 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.94 2dl0 s ALA 90 CO -0.01 -0.70 1.09 -1.64 0.00 0.00 0.00 175.76 174.49 2dl0 s MET 91 N -2.00 2.99 0.00 0.00 -1.94 -1.26 -4.33 119.30 112.76 2dl0 s MET 91 Ca 0.13 0.52 0.04 0.00 -1.71 0.00 0.00 55.69 54.67 2dl0 s MET 91 Cb 0.02 -2.03 -0.01 0.00 2.01 0.00 0.00 34.83 34.81 2dl0 s MET 91 CO -0.04 -0.96 -0.13 -1.54 -0.01 0.00 0.00 175.02 172.34 2dl0 s SER 92 N -4.32 1.58 0.00 3.03 1.04 -1.26 -4.82 113.70 108.95 2dl0 s SER 92 Ca 0.58 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.71 2dl0 s SER 92 Cb -0.11 -0.16 0.00 0.00 0.10 0.00 0.00 66.02 65.85 2dl0 s SER 92 CO 0.52 0.13 0.00 0.61 0.98 0.00 0.00 173.24 175.48 2dl0 n GLY 93 N 2.55 1.37 0.20 7.32 0.00 -1.26 -4.90 105.19 110.48 2dl0 n GLY 93 Ca -0.15 -0.34 -0.13 0.00 0.00 0.00 0.00 46.02 45.40 2dl0 n GLY 93 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dl0 h PRO 94 N 0.00 0.66 -5.63 1.61 0.13 -2.06 -3.46 132.00 123.25 2dl0 h PRO 94 Ca 0.00 -0.35 -0.63 0.00 -0.87 0.00 0.00 66.00 64.15 2dl0 h PRO 94 Cb 0.00 0.01 -0.13 0.00 0.13 0.00 0.00 31.00 31.01 2dl0 h PRO 94 CO 0.00 0.96 -0.60 0.45 -0.23 0.00 0.00 178.00 178.58 2dl0 s SER 95 N -6.50 3.85 0.33 1.44 0.15 -1.26 -5.16 113.70 106.55 2dl0 s SER 95 Ca -0.13 -1.38 0.08 0.00 0.70 0.00 0.00 55.95 55.23 2dl0 s SER 95 Cb 0.08 -0.36 -0.04 0.00 -1.71 0.00 0.00 66.02 63.99 2dl0 s SER 95 CO 0.82 -0.47 0.13 -0.94 1.20 0.00 0.00 173.24 173.99 2dl0 s SER 96 N -3.71 4.70 0.00 5.45 1.04 -1.26 -4.69 113.70 115.23 2dl0 s SER 96 Ca 0.34 -0.75 0.00 0.00 0.48 0.00 0.00 55.95 56.03 2dl0 s SER 96 Cb 0.10 -0.76 0.00 0.00 0.10 0.00 0.00 66.02 65.46 2dl0 s SER 96 CO 0.17 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 174.74