#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dsp s GLU 2 N 0.00 2.52 0.00 -1.24 0.41 -1.26 -5.19 118.70 113.95 2dsp s GLU 2 Ca 0.00 -1.55 0.00 0.00 -0.41 0.00 0.00 54.97 53.01 2dsp s GLU 2 Cb 0.00 -2.50 0.00 0.00 -1.78 0.00 0.00 34.13 29.85 2dsp s GLU 2 CO 0.00 -0.42 0.00 0.00 -0.49 0.00 0.00 175.26 174.35 2dsp n ALA 3 N -1.82 0.00 -2.65 5.21 0.00 -1.26 -5.13 120.51 114.86 2dsp n ALA 3 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.08 2dsp n ALA 3 Cb 0.61 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.03 2dsp n ALA 3 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2dsp s ILE 4 N 0.00 4.72 0.25 0.00 -1.09 -1.26 -5.04 121.20 118.79 2dsp s ILE 4 Ca 0.00 1.83 0.11 0.00 -2.23 0.00 0.00 60.65 60.36 2dsp s ILE 4 Cb 0.00 -4.25 -0.05 0.00 -1.58 0.00 0.00 42.46 36.58 2dsp s ILE 4 CO 0.00 -0.17 -0.20 -1.00 -1.23 0.00 0.00 174.94 172.34 2dsp s HIS 5 N 3.11 2.21 0.64 3.97 3.76 -1.26 -5.14 115.29 122.58 2dsp s HIS 5 Ca 0.41 -0.37 -0.18 0.00 -0.15 0.00 0.00 55.06 54.77 2dsp s HIS 5 Cb -0.15 -0.99 -0.03 0.00 1.11 0.00 0.00 32.58 32.52 2dsp s HIS 5 CO 0.07 0.62 1.02 0.00 -0.85 0.00 0.00 174.74 175.61 2dsp s PRO 7 N -3.00 2.71 0.41 0.00 0.04 -1.26 -4.95 135.00 128.94 2dsp s PRO 7 Ca 0.77 2.10 -0.25 0.00 0.04 0.00 0.00 61.00 63.66 2dsp s PRO 7 Cb -0.39 -1.95 -0.08 0.00 0.04 0.00 0.00 34.50 32.11 2dsp s PRO 7 CO 0.46 -1.48 1.22 -1.25 0.04 0.00 0.00 177.00 175.99 2dsp s PRO 8 N -3.26 4.00 0.23 0.56 0.04 -1.26 -5.00 135.00 130.31 2dsp s PRO 8 Ca 0.80 1.97 -0.30 0.00 0.04 0.00 0.00 61.00 63.51 2dsp s PRO 8 Cb -0.38 -2.70 -0.09 0.00 0.04 0.00 0.00 34.50 31.37 2dsp s PRO 8 CO 0.41 -0.41 1.23 0.00 0.04 0.00 0.00 177.00 178.27 2dsp s SER 10 N -0.08 6.34 0.23 0.00 1.04 -1.26 -5.02 113.70 114.96 2dsp s SER 10 Ca 0.52 0.21 -0.07 0.00 0.48 0.00 0.00 55.95 57.08 2dsp s SER 10 Cb -0.35 -1.93 0.28 0.00 0.10 0.00 0.00 66.02 64.13 2dsp s SER 10 CO 0.40 0.01 1.83 -0.08 0.98 0.00 0.00 173.24 176.38 2dsp h GLU 11 N 1.94 0.82 -0.07 4.02 4.81 -1.99 -1.76 114.58 122.35 2dsp h GLU 11 Ca -0.49 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 58.72 2dsp h GLU 11 Cb 1.20 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 30.37 2dsp h GLU 11 CO 0.67 0.54 -0.08 1.05 -0.73 0.00 0.00 179.01 180.46 2dsp h GLU 12 N 0.84 -0.11 0.30 1.92 4.11 -2.00 -2.47 114.58 117.17 2dsp h GLU 12 Ca 0.34 0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.76 2dsp h GLU 12 Cb 0.16 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2dsp h GLU 12 CO -0.17 -0.07 -0.14 0.87 0.07 0.00 0.00 179.01 179.56 2dsp h LYS 13 N -0.11 -0.38 -0.96 1.06 1.57 -1.92 -3.25 116.57 112.56 2dsp h LYS 13 Ca 0.06 0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.92 2dsp h LYS 13 Cb 0.19 0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.53 2dsp h LYS 13 CO -0.13 -0.23 0.62 -0.07 -0.57 0.00 0.00 179.45 179.06 2dsp h LEU 14 N -0.43 1.00 -2.53 2.94 3.38 -1.25 -0.39 115.31 118.04 2dsp h LEU 14 Ca -0.04 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2dsp h LEU 14 Cb 0.33 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 2dsp h LEU 14 CO 0.07 0.65 -0.02 0.00 0.09 0.00 0.00 178.44 179.23 2dsp h ALA 15 N 1.43 1.17 0.01 1.53 0.00 -1.50 -1.69 119.26 120.21 2dsp h ALA 15 Ca 0.41 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 55.11 2dsp h ALA 15 Cb 0.12 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2dsp h ALA 15 CO -0.16 0.02 -0.87 0.00 0.00 0.00 0.00 179.25 178.24 2dsp h ARG 16 N 0.00 0.14 -6.19 0.00 3.08 -1.10 -3.47 114.38 106.85 2dsp h ARG 16 Ca -0.00 -0.16 -0.69 0.00 0.07 0.00 0.00 59.98 59.20 2dsp h ARG 16 Cb 0.11 0.05 0.08 0.00 0.08 0.00 0.00 29.97 30.28 2dsp h ARG 16 CO 0.00 0.93 0.09 0.00 -1.07 0.00 0.00 179.97 179.91 2dsp s ARG 18 N -0.35 4.00 -0.04 0.00 3.52 -1.26 -5.04 118.95 119.77 2dsp s ARG 18 Ca 0.77 0.10 -0.31 0.00 -0.13 0.00 0.00 55.73 56.15 2dsp s ARG 18 Cb -0.98 -3.67 -0.10 0.00 -1.56 0.00 0.00 34.95 28.65 2dsp s ARG 18 CO 0.54 -0.32 1.98 -2.30 -0.81 0.00 0.00 175.30 174.39 2dsp n PRO 19 N 5.41 2.50 -2.34 5.12 -0.02 -1.26 -4.82 135.00 139.59 2dsp n PRO 19 Ca -0.07 0.90 -0.34 0.00 -2.02 0.00 0.00 63.50 61.96 2dsp n PRO 19 Cb 0.50 -2.90 -0.01 0.00 -0.02 0.00 0.00 33.50 31.07 2dsp n PRO 19 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2dsp s PRO 20 N 4.59 3.52 -0.17 0.52 0.04 -1.26 -5.00 135.00 137.24 2dsp s PRO 20 Ca 0.92 1.45 -0.13 0.00 0.04 0.00 0.00 61.00 63.28 2dsp s PRO 20 Cb -0.52 -2.04 -0.05 0.00 0.04 0.00 0.00 34.50 31.93 2dsp s PRO 20 CO 0.45 -0.68 0.25 0.54 0.04 0.00 0.00 177.00 177.60 2dsp s VAL 21 N -1.96 5.33 -0.33 -0.36 0.11 -1.26 -4.52 120.40 117.42 2dsp s VAL 21 Ca 0.69 0.45 -0.01 0.00 -2.93 0.00 0.00 61.98 60.18 2dsp s VAL 21 Cb -0.20 -3.59 0.00 0.00 -1.53 0.00 0.00 36.38 31.07 2dsp s VAL 21 CO 0.25 0.40 0.10 0.61 -3.33 0.00 0.00 175.10 173.14 2dsp n GLY 22 N 3.43 0.38 3.79 6.54 0.00 -1.26 -4.96 105.19 113.11 2dsp n GLY 22 Ca -0.13 -0.61 -0.37 0.00 0.00 0.00 0.00 46.02 44.91 2dsp n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dsp h GLU 24 N 5.76 0.28 -4.75 0.00 5.08 -1.96 -3.46 114.58 115.53 2dsp h GLU 24 Ca -0.47 -0.31 -0.31 0.00 -1.00 0.00 0.00 59.36 57.27 2dsp h GLU 24 Cb 1.19 0.09 -0.21 0.00 0.50 0.00 0.00 28.75 30.32 2dsp h GLU 24 CO 0.68 1.01 -0.74 -1.83 -1.00 0.00 0.00 179.01 177.13 2dsp s GLU 25 N -3.13 0.60 -0.04 2.33 -1.05 -1.26 -5.08 118.70 111.07 2dsp s GLU 25 Ca -0.15 -0.82 -0.11 0.00 -0.15 0.00 0.00 54.97 53.74 2dsp s GLU 25 Cb 0.02 -0.42 -0.05 0.00 -0.44 0.00 0.00 34.13 33.24 2dsp s GLU 25 CO 0.78 0.08 0.31 -0.51 0.95 0.00 0.00 175.26 176.87 2dsp s LEU 26 N -1.65 4.43 0.27 1.83 1.43 -1.26 -2.00 118.68 121.73 2dsp s LEU 26 Ca -0.08 0.76 0.02 0.00 -1.03 0.00 0.00 54.13 53.81 2dsp s LEU 26 Cb -0.10 -2.43 -0.05 0.00 0.03 0.00 0.00 46.19 43.63 2dsp s LEU 26 CO 0.01 0.34 0.06 0.68 0.23 0.00 0.00 176.35 177.67 2dsp s VAL 27 N -1.09 0.84 0.62 -1.59 -7.23 -1.05 -4.89 120.40 106.00 2dsp s VAL 27 Ca 0.21 -2.01 -0.12 0.00 -1.81 0.00 0.00 61.98 58.26 2dsp s VAL 27 Cb -0.15 -2.61 -0.04 0.00 0.56 0.00 0.00 36.38 34.15 2dsp s VAL 27 CO 0.11 -0.08 1.03 -0.60 -0.31 0.00 0.00 175.10 175.25 2dsp s ARG 28 N -3.96 3.54 0.72 4.82 3.52 -1.26 -2.18 118.95 124.15 2dsp s ARG 28 Ca 0.35 0.82 -0.16 0.00 -0.13 0.00 0.00 55.73 56.61 2dsp s ARG 28 Cb 0.08 -2.07 0.02 0.00 -1.56 0.00 0.00 34.95 31.41 2dsp s ARG 28 CO 0.13 -0.62 1.07 0.39 -0.81 0.00 0.00 175.30 175.46 2dsp n GLU 29 N -2.63 0.57 -1.66 5.12 1.02 0.12 -4.54 120.64 118.64 2dsp n GLU 29 Ca 0.06 0.25 -0.39 0.00 -0.02 0.00 0.00 57.16 57.06 2dsp n GLU 29 Cb 0.54 -2.31 0.03 0.00 -0.02 0.00 0.00 31.44 29.68 2dsp n GLU 29 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 2dsp n PRO 30 N -2.09 1.36 0.00 3.49 -0.02 -1.26 -4.39 135.00 132.10 2dsp n PRO 30 Ca 0.14 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 2dsp n PRO 30 Cb 0.49 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 2dsp n PRO 30 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dsp n GLY 31 N 1.06 2.32 1.28 -1.23 0.00 -1.26 -2.90 105.19 104.47 2dsp n GLY 31 Ca 0.11 -0.33 0.09 0.00 0.00 0.00 0.00 46.02 45.88 2dsp n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dsp n GLY 33 N 0.96 0.40 0.03 0.00 0.00 -1.14 -4.90 105.19 100.52 2dsp n GLY 33 Ca 0.22 0.30 0.11 0.00 0.00 0.00 0.00 46.02 46.65 2dsp n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dsp s ALA 36 N -3.54 2.22 0.39 0.00 0.00 -1.26 0.13 121.76 119.70 2dsp s ALA 36 Ca 0.02 -1.58 0.05 0.00 0.00 0.00 0.00 51.96 50.45 2dsp s ALA 36 Cb -0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 2dsp s ALA 36 CO 0.01 0.28 0.20 0.95 0.00 0.00 0.00 175.76 177.20 2dsp s THR 37 N -2.07 0.32 0.58 0.00 -4.23 -0.93 -4.66 115.64 104.66 2dsp s THR 37 Ca 0.19 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 58.53 2dsp s THR 37 Cb -0.06 -2.36 -0.04 0.00 1.34 0.00 0.00 72.50 71.38 2dsp s THR 37 CO 0.08 0.00 1.09 0.00 -0.54 0.00 0.00 174.62 175.25 2dsp s ALA 39 N -2.15 3.38 0.41 0.00 0.00 -0.85 -4.64 121.76 117.90 2dsp s ALA 39 Ca 0.68 0.25 -0.26 0.00 0.00 0.00 0.00 51.96 52.63 2dsp s ALA 39 Cb -0.20 -2.97 -0.09 0.00 0.00 0.00 0.00 23.12 19.87 2dsp s ALA 39 CO 0.33 0.06 1.29 -0.51 0.00 0.00 0.00 175.76 176.93 2dsp s LEU 40 N -0.00 4.21 0.00 0.00 1.43 0.11 -4.73 118.68 119.70 2dsp s LEU 40 Ca 0.38 2.63 0.01 0.00 -1.03 0.00 0.00 54.13 56.12 2dsp s LEU 40 Cb -0.20 -3.91 0.01 0.00 0.03 0.00 0.00 46.19 42.12 2dsp s LEU 40 CO 0.22 -0.84 0.08 0.61 0.23 0.00 0.00 176.35 176.65 2dsp n GLY 41 N 0.67 2.07 3.69 -3.19 0.00 -1.26 -0.28 105.19 106.89 2dsp n GLY 41 Ca 0.04 -2.15 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 2dsp n GLY 41 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dsp s LEU 42 N 0.00 4.39 0.00 0.99 2.96 -1.26 -3.16 118.68 122.60 2dsp s LEU 42 Ca 0.06 2.74 0.00 0.00 -0.22 0.00 0.00 54.13 56.70 2dsp s LEU 42 Cb -0.00 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.12 2dsp s LEU 42 CO 0.04 -0.99 0.00 0.61 -1.32 0.00 0.00 176.35 174.69 2dsp n GLY 43 N 4.18 0.89 3.80 7.98 0.00 -0.44 -4.97 105.19 116.63 2dsp n GLY 43 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 2dsp n GLY 43 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dsp s MET 44 N -0.46 4.38 0.23 1.61 1.00 -1.19 -4.64 119.30 120.24 2dsp s MET 44 Ca 0.00 1.08 -0.31 0.00 0.00 0.00 0.00 55.69 56.45 2dsp s MET 44 Cb 0.00 -2.78 -0.13 0.00 0.00 0.00 0.00 34.83 31.92 2dsp s MET 44 CO 0.00 0.30 1.43 -2.30 0.00 0.00 0.00 175.02 174.45 2dsp n PRO 45 N 0.51 2.06 -3.90 2.03 -0.02 -1.26 -1.88 135.00 132.53 2dsp n PRO 45 Ca 0.00 0.73 -0.09 0.00 -2.02 0.00 0.00 63.50 62.13 2dsp n PRO 45 Cb 0.51 -2.41 -0.05 0.00 -0.02 0.00 0.00 33.50 31.53 2dsp n PRO 45 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2dsp n GLY 47 N -0.33 -0.71 0.29 0.00 0.00 -1.26 0.08 105.19 103.27 2dsp n GLY 47 Ca -0.06 -0.67 0.01 0.00 0.00 0.00 0.00 46.02 45.29 2dsp n GLY 47 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2dsp h VAL 48 N 0.00 1.18 -0.17 1.61 2.07 -0.83 -3.12 116.25 116.99 2dsp h VAL 48 Ca 0.00 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.89 2dsp h VAL 48 Cb 0.00 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2dsp h VAL 48 CO 0.00 0.23 0.00 -1.22 0.02 0.00 0.00 177.57 176.60 2dsp n TYR 49 N -4.33 0.22 -2.18 1.57 4.02 -1.26 -4.54 117.16 110.66 2dsp n TYR 49 Ca 0.02 -0.34 -0.27 0.00 -0.01 0.00 0.00 57.90 57.31 2dsp n TYR 49 Cb 0.19 -0.02 0.11 0.00 -0.02 0.00 0.00 39.34 39.60 2dsp n TYR 49 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2dsp s THR 50 N -0.89 2.15 0.91 -0.72 -4.23 -1.18 -4.94 115.64 106.73 2dsp s THR 50 Ca 0.14 -0.24 -0.10 0.00 -1.18 0.00 0.00 61.69 60.31 2dsp s THR 50 Cb 0.08 -2.91 0.14 0.00 1.34 0.00 0.00 72.50 71.15 2dsp s THR 50 CO 0.11 0.00 1.13 -2.84 -0.54 0.00 0.00 174.62 172.48 2dsp s PRO 51 N -5.43 1.06 0.48 3.99 0.02 -1.26 -4.54 135.00 129.32 2dsp s PRO 51 Ca 0.65 1.47 -0.20 0.00 0.02 0.00 0.00 61.00 62.94 2dsp s PRO 51 Cb -0.08 -1.74 -0.09 0.00 0.02 0.00 0.00 34.50 32.61 2dsp s PRO 51 CO 0.47 -2.57 1.01 1.03 -0.33 0.00 0.00 177.00 176.61 2dsp s ARG 52 N -4.67 3.90 0.58 5.54 0.52 -1.26 -4.74 118.95 118.82 2dsp s ARG 52 Ca 0.66 1.28 -0.18 0.00 -0.52 0.00 0.00 55.73 56.96 2dsp s ARG 52 Cb -0.22 -2.12 -0.04 0.00 0.52 0.00 0.00 34.95 33.09 2dsp s ARG 52 CO 0.58 -0.33 1.14 0.00 0.02 0.00 0.00 175.30 176.71 2dsp s GLY 54 N -1.90 1.59 0.79 0.00 0.00 0.61 -4.73 107.32 103.68 2dsp s GLY 54 Ca 0.72 0.02 -0.14 0.00 0.00 0.00 0.00 44.72 45.33 2dsp s GLY 54 CO 0.31 0.64 1.11 -1.14 0.00 0.00 0.00 173.10 174.02 2dsp n SER 55 N -4.59 0.75 -0.16 1.64 3.41 -1.26 -1.95 113.62 111.46 2dsp n SER 55 Ca 0.06 0.59 -0.02 0.00 -0.26 0.00 0.00 58.87 59.24 2dsp n SER 55 Cb 0.54 -1.47 -0.01 0.00 -0.26 0.00 0.00 64.21 63.01 2dsp n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dsp n GLY 56 N 0.73 0.34 3.00 5.00 0.00 -1.26 -5.00 105.19 108.00 2dsp n GLY 56 Ca 0.13 -0.05 -0.20 0.00 0.00 0.00 0.00 46.02 45.90 2dsp n GLY 56 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dsp s LEU 57 N -0.47 1.79 -0.02 0.99 1.43 -0.82 -4.25 118.68 117.33 2dsp s LEU 57 Ca 0.00 -0.18 0.06 0.00 -1.03 0.00 0.00 54.13 52.97 2dsp s LEU 57 Cb 0.00 -0.54 -0.03 0.00 0.03 0.00 0.00 46.19 45.66 2dsp s LEU 57 CO 0.00 0.06 -0.18 -0.60 0.23 0.00 0.00 176.35 175.86 2dsp s ARG 58 N 0.19 2.30 -0.08 1.70 3.52 -0.40 -4.67 118.95 121.50 2dsp s ARG 58 Ca -0.03 -0.83 -0.30 0.00 -0.13 0.00 0.00 55.73 54.45 2dsp s ARG 58 Cb -0.08 -2.25 -0.03 0.00 -1.56 0.00 0.00 34.95 31.03 2dsp s ARG 58 CO 0.00 0.59 1.30 0.00 -0.81 0.00 0.00 175.30 176.38 2dsp s TYR 60 N 2.81 -0.19 -0.01 0.00 5.04 -0.47 -4.93 117.35 119.60 2dsp s TYR 60 Ca 0.58 0.46 -0.30 0.00 -2.44 0.00 0.00 57.07 55.38 2dsp s TYR 60 Cb -0.26 0.06 -0.04 0.00 0.35 0.00 0.00 41.96 42.07 2dsp s TYR 60 CO 0.21 -0.09 1.18 -1.25 -1.34 0.00 0.00 175.55 174.26 2dsp s PRO 61 N 0.14 4.40 0.01 4.97 0.04 -1.26 -1.06 135.00 142.25 2dsp s PRO 61 Ca -0.00 1.69 -0.05 0.00 0.04 0.00 0.00 61.00 62.68 2dsp s PRO 61 Cb -0.02 -3.47 -0.02 0.00 0.04 0.00 0.00 34.50 31.03 2dsp s PRO 61 CO -0.00 -0.34 1.07 -1.35 0.04 0.00 0.00 177.00 176.42 2dsp h PRO 62 N 7.16 -0.11 0.00 0.56 0.11 -1.93 -3.47 132.00 134.32 2dsp h PRO 62 Ca -0.38 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2dsp h PRO 62 Cb 1.19 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2dsp h PRO 62 CO 0.84 -0.07 0.00 0.41 -0.21 0.00 0.00 178.00 178.97 2dsp n GLY 64 N -1.07 2.62 3.72 -0.55 0.00 -1.26 -5.02 105.19 103.63 2dsp n GLY 64 Ca -0.01 -0.64 -0.35 0.00 0.00 0.00 0.00 46.02 45.01 2dsp n GLY 64 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dsp s VAL 65 N 0.00 2.10 0.20 1.61 -7.23 -1.26 -4.97 120.40 110.85 2dsp s VAL 65 Ca 0.00 0.05 -0.05 0.00 -1.81 0.00 0.00 61.98 60.17 2dsp s VAL 65 Cb 0.00 -2.72 -0.00 0.00 0.56 0.00 0.00 36.38 34.22 2dsp s VAL 65 CO 0.00 -0.02 1.57 1.05 -0.31 0.00 0.00 175.10 177.39 2dsp h GLU 66 N -0.19 0.73 -2.73 4.82 -0.00 -2.03 -3.39 114.58 111.79 2dsp h GLU 66 Ca -0.48 -0.35 -0.60 0.00 -0.00 0.00 0.00 59.36 57.92 2dsp h GLU 66 Cb 1.31 -0.01 -0.40 0.00 -0.00 0.00 0.00 28.75 29.66 2dsp h GLU 66 CO 0.50 0.96 -0.78 0.15 -0.00 0.00 0.00 179.01 179.84 2dsp s LYS 67 N -4.40 1.58 0.24 1.06 1.02 -1.26 -5.01 119.74 112.96 2dsp s LYS 67 Ca -0.09 -2.59 -0.06 0.00 0.02 0.00 0.00 55.97 53.25 2dsp s LYS 67 Cb 0.12 -2.33 0.31 0.00 -0.52 0.00 0.00 37.83 35.40 2dsp s LYS 67 CO 0.84 -1.32 1.87 -1.35 -0.92 0.00 0.00 175.35 174.48 2dsp h PRO 68 N 5.68 1.05 -0.42 -1.68 0.11 -1.98 -2.03 132.00 132.73 2dsp h PRO 68 Ca 0.18 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.19 2dsp h PRO 68 Cb 0.85 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.70 2dsp h PRO 68 CO 0.52 0.70 0.10 -0.07 -0.21 0.00 0.00 178.00 179.04 2dsp h LEU 69 N 1.08 0.64 -0.82 2.35 3.38 -1.98 -1.89 115.31 118.07 2dsp h LEU 69 Ca 0.37 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 2dsp h LEU 69 Cb 0.07 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2dsp h LEU 69 CO -0.14 0.71 -0.20 0.45 0.09 0.00 0.00 178.44 179.35 2dsp h HIS 70 N 0.54 0.00 -0.00 1.13 3.86 -1.91 -0.11 115.15 118.66 2dsp h HIS 70 Ca 0.13 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.17 2dsp h HIS 70 Cb 0.32 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.77 2dsp h HIS 70 CO 0.02 0.20 -0.79 1.79 0.86 0.00 0.00 177.93 180.02 2dsp h THR 71 N 0.00 1.55 -0.11 2.45 1.35 -1.19 -1.80 112.91 115.15 2dsp h THR 71 Ca -0.00 -2.64 -0.14 0.00 -0.55 0.00 0.00 66.41 63.07 2dsp h THR 71 Cb 0.85 2.43 -0.01 0.00 -1.73 0.00 0.00 68.15 69.69 2dsp h THR 71 CO 0.03 0.76 -0.55 -0.07 -0.25 0.00 0.00 175.52 175.43 2dsp h LEU 72 N 0.02 0.37 -0.73 3.87 3.38 -0.91 0.12 115.31 121.42 2dsp h LEU 72 Ca -0.01 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 2dsp h LEU 72 Cb 1.39 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 42.00 2dsp h LEU 72 CO 0.11 0.85 0.12 0.24 0.09 0.00 0.00 178.44 179.85 2dsp h MET 73 N 0.26 1.09 -0.55 1.13 2.86 -0.85 0.18 114.93 119.04 2dsp h MET 73 Ca 0.00 -0.28 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 2dsp h MET 73 Cb 1.05 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.57 2dsp h MET 73 CO 0.09 0.99 0.00 0.72 1.06 0.00 0.00 176.91 179.77 2dsp n HIS 74 N -4.22 0.84 -1.17 -0.22 8.25 -0.69 -4.36 115.22 113.65 2dsp n HIS 74 Ca 0.05 -0.36 -0.06 0.00 -0.26 0.00 0.00 57.72 57.09 2dsp n HIS 74 Cb 0.28 -0.11 -0.03 0.00 1.12 0.00 0.00 29.99 31.25 2dsp n HIS 74 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dsp n GLY 75 N 0.98 0.81 1.62 -1.41 0.00 -1.09 -4.89 105.19 101.21 2dsp n GLY 75 Ca 0.16 -0.45 0.07 0.00 0.00 0.00 0.00 46.02 45.80 2dsp n GLY 75 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dsp n GLN 76 N -2.32 4.06 -2.32 1.61 3.00 0.38 -2.74 117.38 119.05 2dsp n GLN 76 Ca -0.06 -2.67 -0.26 0.00 -0.01 0.00 0.00 57.00 54.00 2dsp n GLN 76 Cb 0.26 -2.05 0.13 0.00 0.00 0.00 0.00 30.24 28.58 2dsp n GLN 76 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 2dsp s GLY 77 N -0.73 1.76 0.03 1.08 0.00 0.11 -4.76 107.32 104.81 2dsp s GLY 77 Ca 0.47 -1.48 0.04 0.00 0.00 0.00 0.00 44.72 43.75 2dsp s GLY 77 CO 0.17 -0.85 -0.13 0.54 0.00 0.00 0.00 173.10 172.83 2dsp s VAL 78 N -3.42 1.04 -0.20 1.40 0.11 -0.22 -0.49 120.40 118.61 2dsp s VAL 78 Ca 0.69 -0.94 -0.29 0.00 -2.93 0.00 0.00 61.98 58.51 2dsp s VAL 78 Cb -0.05 -0.94 -0.03 0.00 -1.53 0.00 0.00 36.38 33.82 2dsp s VAL 78 CO 0.47 0.01 1.69 0.00 -3.33 0.00 0.00 175.10 173.94 2dsp s MET 80 N 4.81 2.24 0.71 0.00 -1.94 -0.13 -1.32 119.30 123.68 2dsp s MET 80 Ca 0.75 -0.88 -0.15 0.00 -1.71 0.00 0.00 55.69 53.70 2dsp s MET 80 Cb -0.27 -2.28 0.03 0.00 2.01 0.00 0.00 34.83 34.32 2dsp s MET 80 CO 0.31 0.57 1.19 -1.21 -0.01 0.00 0.00 175.02 175.86 2dsp s GLU 81 N -1.32 2.30 0.35 2.03 8.01 -1.26 -1.28 118.70 127.53 2dsp s GLU 81 Ca 0.15 1.70 0.03 0.00 0.01 0.00 0.00 54.97 56.85 2dsp s GLU 81 Cb -0.11 -1.86 0.63 0.00 -4.31 0.00 0.00 34.13 28.49 2dsp s GLU 81 CO 0.05 -1.69 1.96 1.25 0.01 0.00 0.00 175.26 176.83 2dsp h LEU 82 N -0.17 0.63 -1.13 1.80 5.85 -1.95 -2.92 115.31 117.42 2dsp h LEU 82 Ca -0.48 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.19 2dsp h LEU 82 Cb 1.29 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 42.11 2dsp h LEU 82 CO 0.51 0.54 0.54 0.00 -0.34 0.00 0.00 178.44 179.69 2dsp h ALA 83 N 1.56 1.36 -0.27 1.25 0.00 -1.96 -1.36 119.26 119.85 2dsp h ALA 83 Ca 0.18 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 2dsp h ALA 83 Cb 0.07 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2dsp h ALA 83 CO -0.02 0.58 -0.35 1.49 0.00 0.00 0.00 179.25 180.95 2dsp h GLU 84 N 1.16 0.71 -0.26 0.00 4.81 -1.91 -1.99 114.58 117.10 2dsp h GLU 84 Ca 0.31 -0.40 0.04 0.00 -0.13 0.00 0.00 59.36 59.17 2dsp h GLU 84 Cb -0.10 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.27 2dsp h GLU 84 CO -0.06 1.02 0.03 0.82 -0.73 0.00 0.00 179.01 180.09 2dsp h ILE 85 N 0.44 0.86 -0.91 2.32 2.04 -1.38 -0.98 117.51 119.89 2dsp h ILE 85 Ca 0.03 -0.04 0.01 0.00 1.00 0.00 0.00 64.86 65.86 2dsp h ILE 85 Cb 0.93 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 37.69 2dsp h ILE 85 CO 0.08 0.02 0.60 -0.08 0.00 0.00 0.00 178.15 178.78 2dsp h GLU 86 N 0.12 1.19 -0.63 2.37 4.81 -1.21 0.14 114.58 121.37 2dsp h GLU 86 Ca 0.12 -0.07 0.03 0.00 -0.13 0.00 0.00 59.36 59.31 2dsp h GLU 86 Cb 0.14 -0.27 -0.04 0.00 0.63 0.00 0.00 28.75 29.21 2dsp h GLU 86 CO -0.17 0.78 0.39 0.00 -0.73 0.00 0.00 179.01 179.28 2dsp h ALA 87 N 1.34 0.82 0.36 2.92 0.00 -0.97 -1.64 119.26 122.08 2dsp h ALA 87 Ca 0.34 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 2dsp h ALA 87 Cb -0.12 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.48 2dsp h ALA 87 CO -0.08 0.13 -0.17 0.82 0.00 0.00 0.00 179.25 179.95 2dsp h ILE 88 N 0.76 0.64 -0.03 0.00 2.04 -0.55 -3.09 117.51 117.28 2dsp h ILE 88 Ca 0.25 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 2dsp h ILE 88 Cb 0.02 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 2dsp h ILE 88 CO -0.10 0.08 -0.12 0.06 0.00 0.00 0.00 178.15 178.07 2dsp h GLN 89 N -0.73 0.05 0.00 2.37 3.07 -0.95 0.10 115.11 119.03 2dsp h GLN 89 Ca -0.05 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.68 2dsp h GLN 89 Cb 0.50 -0.01 0.00 0.00 0.08 0.00 0.00 27.48 28.05 2dsp h GLN 89 CO 0.08 0.17 0.00 0.39 0.09 0.00 0.00 178.83 179.56 2dsp n GLU 90 N -4.38 0.03 0.00 0.06 1.02 -0.62 -2.84 120.64 113.90 2dsp n GLU 90 Ca -0.02 0.20 0.09 0.00 -0.02 0.00 0.00 57.16 57.40 2dsp n GLU 90 Cb 0.20 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.03 2dsp n GLU 90 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2dsp n SER 91 N -1.48 1.02 -0.75 1.62 3.41 0.35 -5.08 113.62 112.71 2dsp n SER 91 Ca 0.05 -1.01 0.13 0.00 -0.26 0.00 0.00 58.87 57.77 2dsp n SER 91 Cb 0.19 0.92 0.29 0.00 -0.26 0.00 0.00 64.21 65.35 2dsp n SER 91 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06