#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dp9 n ASP -1 N 0.00 -6.95 -4.82 7.83 4.64 -1.26 -5.02 116.55 110.97 2dp9 n ASP -1 Ca 0.00 -0.42 -0.27 0.00 -1.38 0.00 0.00 54.79 52.72 2dp9 n ASP -1 Cb 0.00 -4.70 -0.05 0.00 -1.04 0.00 0.00 41.12 35.33 2dp9 n ASP -1 CO 0.00 0.00 0.00 -0.31 -0.82 0.00 0.00 177.20 176.07 2dp9 s TYR 0 N -3.14 3.21 -0.20 -0.67 4.12 -1.26 -5.03 117.35 114.37 2dp9 s TYR 0 Ca 0.16 0.02 0.05 0.00 0.02 0.00 0.00 57.07 57.32 2dp9 s TYR 0 Cb -0.03 -1.56 -0.21 0.00 -1.52 0.00 0.00 41.96 38.64 2dp9 s TYR 0 CO 0.78 0.52 0.03 -0.12 0.02 0.00 0.00 175.55 176.78 2dp9 n MET 1 N -0.22 0.68 -2.77 -0.62 0.00 -1.26 -4.95 117.12 107.98 2dp9 n MET 1 Ca -0.08 0.15 -0.33 0.00 -0.00 0.00 0.00 57.70 57.44 2dp9 n MET 1 Cb 0.54 -1.58 -0.06 0.00 0.00 0.00 0.00 33.22 32.12 2dp9 n MET 1 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 175.97 174.14 2dp9 s GLU 2 N -2.53 4.11 0.14 2.12 4.04 -1.26 -5.09 118.70 120.23 2dp9 s GLU 2 Ca -0.24 0.98 0.08 0.00 0.04 0.00 0.00 54.97 55.83 2dp9 s GLU 2 Cb 0.08 -2.22 -0.04 0.00 0.02 0.00 0.00 34.13 31.97 2dp9 s GLU 2 CO 0.71 -0.06 -0.19 1.03 -1.84 0.00 0.00 175.26 174.91 2dp9 s ARG 3 N -3.39 1.19 0.46 -4.83 1.81 -1.26 -5.13 118.95 107.80 2dp9 s ARG 3 Ca 0.60 -1.30 -0.24 0.00 -1.72 0.00 0.00 55.73 53.07 2dp9 s ARG 3 Cb -0.09 -1.30 -0.07 0.00 -0.45 0.00 0.00 34.95 33.03 2dp9 s ARG 3 CO 0.19 0.28 1.25 -1.25 -0.68 0.00 0.00 175.30 175.09 2dp9 s PRO 4 N -2.45 3.70 0.13 3.54 0.04 -1.26 -4.95 135.00 133.75 2dp9 s PRO 4 Ca 0.11 2.01 0.18 0.00 0.04 0.00 0.00 61.00 63.35 2dp9 s PRO 4 Cb -0.07 -2.50 -0.07 0.00 0.04 0.00 0.00 34.50 31.90 2dp9 s PRO 4 CO 0.05 -0.67 0.97 0.87 0.04 0.00 0.00 177.00 178.27 2dp9 h LYS 5 N 2.15 0.00 -6.53 4.56 1.57 -2.00 -3.47 116.57 112.85 2dp9 h LYS 5 Ca -0.50 0.00 -0.64 0.00 -1.87 0.00 0.00 60.65 57.64 2dp9 h LYS 5 Cb 1.26 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 33.33 2dp9 h LYS 5 CO 0.60 0.23 -0.86 -0.51 -0.57 0.00 0.00 179.45 178.35 2dp9 s LEU 6 N -5.76 2.25 0.20 2.94 1.43 -1.26 -5.06 118.68 113.40 2dp9 s LEU 6 Ca -0.01 -0.65 0.07 0.00 -1.03 0.00 0.00 54.13 52.50 2dp9 s LEU 6 Cb 0.09 -1.11 -0.05 0.00 0.03 0.00 0.00 46.19 45.15 2dp9 s LEU 6 CO 0.79 0.17 -0.12 -0.83 0.23 0.00 0.00 176.35 176.59 2dp9 s GLY 7 N -1.64 1.36 -0.07 -3.19 0.00 -1.26 -0.82 107.32 101.70 2dp9 s GLY 7 Ca 0.10 -1.64 0.04 0.00 0.00 0.00 0.00 44.72 43.23 2dp9 s GLY 7 CO 0.04 -1.71 -0.19 -2.27 0.00 0.00 0.00 173.10 168.96 2dp9 s LEU 8 N -3.29 1.93 -0.24 0.66 2.96 0.13 -4.86 118.68 115.97 2dp9 s LEU 8 Ca 0.22 -0.44 -0.29 0.00 -0.22 0.00 0.00 54.13 53.40 2dp9 s LEU 8 Cb 0.01 -1.15 0.01 0.00 0.50 0.00 0.00 46.19 45.56 2dp9 s LEU 8 CO 0.06 0.14 1.07 -0.63 -1.32 0.00 0.00 176.35 175.66 2dp9 s ILE 9 N 0.28 4.61 -0.05 6.68 1.01 -1.26 -0.65 121.20 131.82 2dp9 s ILE 9 Ca -0.12 1.94 0.03 0.00 0.00 0.00 0.00 60.65 62.50 2dp9 s ILE 9 Cb -0.15 -4.30 0.00 0.00 0.01 0.00 0.00 42.46 38.02 2dp9 s ILE 9 CO 0.05 -0.23 -0.16 -0.69 0.00 0.00 0.00 174.94 173.92 2dp9 s VAL 10 N 3.31 1.34 0.48 2.92 1.01 0.15 -4.93 120.40 124.68 2dp9 s VAL 10 Ca 0.45 -0.64 -0.17 0.00 0.00 0.00 0.00 61.98 61.62 2dp9 s VAL 10 Cb -0.15 -1.18 -0.09 0.00 0.00 0.00 0.00 36.38 34.96 2dp9 s VAL 10 CO 0.08 0.39 0.95 -0.13 0.00 0.00 0.00 175.10 176.40 2dp9 s ARG 11 N 0.28 4.01 0.61 2.72 1.81 -1.26 -4.24 118.95 122.87 2dp9 s ARG 11 Ca -0.09 0.94 -0.14 0.00 -1.72 0.00 0.00 55.73 54.72 2dp9 s ARG 11 Cb -0.13 -2.18 -0.03 0.00 -0.45 0.00 0.00 34.95 32.15 2dp9 s ARG 11 CO 0.03 -0.17 1.05 -1.21 -0.68 0.00 0.00 175.30 174.32 2dp9 s GLU 12 N -3.78 3.33 0.00 3.54 0.41 -1.26 -1.54 118.70 119.39 2dp9 s GLU 12 Ca 0.59 1.08 0.30 0.00 -0.41 0.00 0.00 54.97 56.53 2dp9 s GLU 12 Cb -0.10 -2.04 1.44 0.00 -1.78 0.00 0.00 34.13 31.66 2dp9 s GLU 12 CO 0.26 -0.79 1.98 -0.35 -0.49 0.00 0.00 175.26 175.87 2dp9 n PRO 13 N -2.28 0.79 -0.36 0.39 -0.04 -1.26 -4.84 135.00 127.41 2dp9 n PRO 13 Ca 0.08 -0.19 0.01 0.00 -0.04 0.00 0.00 63.50 63.36 2dp9 n PRO 13 Cb 0.53 -1.50 0.15 0.00 -0.04 0.00 0.00 33.50 32.64 2dp9 n PRO 13 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2dp9 h TYR 14 N 0.45 1.18 -0.19 0.54 0.99 -1.72 -1.77 116.97 116.45 2dp9 h TYR 14 Ca 0.00 0.03 0.03 0.00 2.00 0.00 0.00 58.73 60.79 2dp9 h TYR 14 Cb 0.27 -0.39 -0.03 0.00 1.00 0.00 0.00 36.73 37.58 2dp9 h TYR 14 CO 0.00 0.65 0.00 0.00 -0.00 0.00 0.00 178.16 178.81 2dp9 h ALA 15 N 1.42 0.17 -0.53 3.88 0.00 -1.50 -1.67 119.26 121.02 2dp9 h ALA 15 Ca 0.40 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.29 2dp9 h ALA 15 Cb 0.07 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2dp9 h ALA 15 CO -0.14 -0.43 0.05 0.77 0.00 0.00 0.00 179.25 179.49 2dp9 h SER 16 N 0.06 0.88 -0.74 0.00 0.02 -1.79 -2.21 113.55 109.77 2dp9 h SER 16 Ca 0.09 -0.28 0.04 0.00 -0.84 0.00 0.00 61.79 60.80 2dp9 h SER 16 Cb 0.11 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 62.37 2dp9 h SER 16 CO -0.15 0.94 0.49 -0.07 -1.14 0.00 0.00 176.83 176.90 2dp9 h LEU 17 N 0.79 0.77 0.56 5.07 3.38 -1.06 -0.16 115.31 124.65 2dp9 h LEU 17 Ca 0.16 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 2dp9 h LEU 17 Cb 0.46 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 41.04 2dp9 h LEU 17 CO 0.02 0.52 -0.27 0.40 0.09 0.00 0.00 178.44 179.20 2dp9 h ILE 18 N 0.89 0.00 0.00 1.22 2.04 -1.04 0.20 117.51 120.81 2dp9 h ILE 18 Ca 0.30 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.74 2dp9 h ILE 18 Cb 0.08 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.16 2dp9 h ILE 18 CO -0.09 0.00 0.00 -0.37 0.00 0.00 0.00 178.15 177.69 2dp9 h VAL 19 N -1.17 0.00 -0.14 1.67 -1.51 -1.29 0.45 116.25 114.26 2dp9 h VAL 19 Ca -0.08 -0.19 0.00 0.00 -1.23 0.00 0.00 66.70 65.20 2dp9 h VAL 19 Cb 0.58 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 30.91 2dp9 h VAL 19 CO 0.13 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 176.94 2dp9 n ASP 20 N -3.05 1.56 -0.19 4.19 10.43 -0.08 -2.26 116.55 127.15 2dp9 n ASP 20 Ca -0.02 -1.66 -0.02 0.00 2.57 0.00 0.00 54.79 55.66 2dp9 n ASP 20 Cb 0.16 -0.09 -0.01 0.00 1.84 0.00 0.00 41.12 43.02 2dp9 n ASP 20 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2dp9 n GLY 21 N 1.12 0.58 0.04 0.44 0.00 0.15 -4.93 105.19 102.59 2dp9 n GLY 21 Ca 0.16 -0.56 0.11 0.00 0.00 0.00 0.00 46.02 45.74 2dp9 n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dp9 n ARG 22 N -2.65 0.46 -3.94 1.61 1.74 0.60 -4.82 116.66 109.65 2dp9 n ARG 22 Ca -0.02 -0.03 -0.30 0.00 -0.77 0.00 0.00 57.85 56.72 2dp9 n ARG 22 Cb 0.11 -1.62 -0.16 0.00 -1.02 0.00 0.00 32.46 29.78 2dp9 n ARG 22 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2dp9 s LYS 23 N -3.32 1.60 0.00 5.56 2.20 -0.65 -4.88 119.74 120.24 2dp9 s LYS 23 Ca -0.01 -1.03 0.23 0.00 -0.36 0.00 0.00 55.97 54.80 2dp9 s LYS 23 Cb 0.13 -2.60 0.09 0.00 -1.51 0.00 0.00 37.83 33.95 2dp9 s LYS 23 CO 0.83 -0.62 1.12 1.33 -0.36 0.00 0.00 175.35 177.65 2dp9 n VAL 24 N 4.66 0.01 -4.39 4.02 0.24 -0.93 -4.45 118.33 117.49 2dp9 n VAL 24 Ca -0.11 -0.02 -0.33 0.00 -2.04 0.00 0.00 64.34 61.84 2dp9 n VAL 24 Cb 0.44 0.63 -0.16 0.00 -1.47 0.00 0.00 33.84 33.28 2dp9 n VAL 24 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 2dp9 s TRP 25 N -3.02 2.74 -0.24 6.34 0.52 -0.57 0.14 118.94 124.86 2dp9 s TRP 25 Ca 0.09 -1.42 -0.06 0.00 0.02 0.00 0.00 56.10 54.73 2dp9 s TRP 25 Cb 0.17 -1.88 -0.02 0.00 -1.15 0.00 0.00 33.47 30.59 2dp9 s TRP 25 CO 0.79 -0.68 0.02 -2.00 0.02 0.00 0.00 176.95 175.11 2dp9 s GLU 26 N 1.04 3.52 -0.08 4.98 2.56 -0.37 -4.33 118.70 126.02 2dp9 s GLU 26 Ca -0.01 -0.55 -0.26 0.00 0.00 0.00 0.00 54.97 54.15 2dp9 s GLU 26 Cb -0.14 -3.20 -0.03 0.00 2.00 0.00 0.00 34.13 32.76 2dp9 s GLU 26 CO -0.06 -0.20 0.82 0.42 -0.56 0.00 0.00 175.26 175.68 2dp9 s ILE 27 N 1.56 4.94 0.06 -3.70 -1.09 -1.26 -0.41 121.20 121.30 2dp9 s ILE 27 Ca 0.06 1.68 -0.03 0.00 -2.23 0.00 0.00 60.65 60.13 2dp9 s ILE 27 Cb -0.15 -4.15 -0.03 0.00 -1.58 0.00 0.00 42.46 36.55 2dp9 s ILE 27 CO 0.01 0.15 0.03 -0.13 -1.23 0.00 0.00 174.94 173.77 2dp9 s ARG 28 N 1.29 0.66 0.17 2.79 1.81 -0.58 -4.99 118.95 120.10 2dp9 s ARG 28 Ca 0.42 -1.11 0.25 0.00 -1.72 0.00 0.00 55.73 53.56 2dp9 s ARG 28 Cb -0.18 0.24 0.91 0.00 -0.45 0.00 0.00 34.95 35.47 2dp9 s ARG 28 CO 0.19 -0.15 1.75 0.54 -0.68 0.00 0.00 175.30 176.95 2dp9 n ARG 29 N 0.14 0.17 -4.07 3.54 1.74 -1.26 -0.74 116.66 116.19 2dp9 n ARG 29 Ca -0.15 0.24 -0.09 0.00 -0.77 0.00 0.00 57.85 57.08 2dp9 n ARG 29 Cb 0.61 -1.74 -0.09 0.00 -1.02 0.00 0.00 32.46 30.22 2dp9 n ARG 29 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2dp9 s ARG 30 N -3.14 0.91 0.74 5.56 0.52 -1.26 -4.76 118.95 117.52 2dp9 s ARG 30 Ca 0.09 -1.29 -0.06 0.00 -0.52 0.00 0.00 55.73 53.94 2dp9 s ARG 30 Cb 0.12 0.28 0.09 0.00 0.52 0.00 0.00 34.95 35.96 2dp9 s ARG 30 CO 0.49 -0.27 1.04 0.15 0.02 0.00 0.00 175.30 176.73 2dp9 s LYS 31 N -3.99 1.87 -0.03 3.54 1.02 -1.26 -4.81 119.74 116.08 2dp9 s LYS 31 Ca 0.18 -0.50 -0.20 0.00 0.02 0.00 0.00 55.97 55.46 2dp9 s LYS 31 Cb 0.06 -2.18 0.04 0.00 -0.52 0.00 0.00 37.83 35.23 2dp9 s LYS 31 CO -0.02 -1.43 0.43 -0.08 -0.92 0.00 0.00 175.35 173.33 2dp9 s THR 32 N -3.29 0.04 -2.73 2.17 -1.32 -1.26 -4.87 115.64 104.39 2dp9 s THR 32 Ca 0.63 -0.31 0.22 0.00 -1.21 0.00 0.00 61.69 61.02 2dp9 s THR 32 Cb -0.08 -0.74 0.16 0.00 -1.51 0.00 0.00 72.50 70.33 2dp9 s THR 32 CO 0.45 -0.17 1.20 0.54 -2.21 0.00 0.00 174.62 174.43 2dp9 n ARG 33 N 1.19 2.04 -1.85 7.08 1.74 -1.26 -4.87 116.66 120.75 2dp9 n ARG 33 Ca -0.21 -1.75 -0.41 0.00 -0.77 0.00 0.00 57.85 54.71 2dp9 n ARG 33 Cb 0.56 -1.43 -0.01 0.00 -1.02 0.00 0.00 32.46 30.55 2dp9 n ARG 33 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 2dp9 s HIS 34 N -1.94 2.79 0.03 -1.55 2.46 -1.26 -4.99 115.29 110.83 2dp9 s HIS 34 Ca 0.25 0.92 0.02 0.00 0.47 0.00 0.00 55.06 56.72 2dp9 s HIS 34 Cb 0.19 -3.99 -0.02 0.00 -0.13 0.00 0.00 32.58 28.62 2dp9 s HIS 34 CO 0.31 -3.23 -0.07 1.03 -2.47 0.00 0.00 174.74 170.32 2dp9 s ARG 35 N -0.79 0.47 0.00 2.88 1.81 -1.26 -4.84 118.95 117.22 2dp9 s ARG 35 Ca 0.60 -0.63 0.00 0.00 -1.72 0.00 0.00 55.73 53.98 2dp9 s ARG 35 Cb -0.46 -0.26 0.00 0.00 -0.45 0.00 0.00 34.95 33.78 2dp9 s ARG 35 CO 0.50 0.05 0.00 0.41 -0.68 0.00 0.00 175.30 175.57 2dp9 n GLY 36 N 1.76 -1.00 3.63 -3.53 0.00 -0.17 -4.91 105.19 100.97 2dp9 n GLY 36 Ca -0.21 -2.18 -0.38 0.00 0.00 0.00 0.00 46.02 43.25 2dp9 n GLY 36 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dp9 n PRO 37 N -0.07 1.08 -3.63 1.61 -0.04 -1.26 -0.84 135.00 131.85 2dp9 n PRO 37 Ca 0.00 0.41 -0.11 0.00 -0.04 0.00 0.00 63.50 63.76 2dp9 n PRO 37 Cb 0.00 -2.18 -0.11 0.00 -0.04 0.00 0.00 33.50 31.17 2dp9 n PRO 37 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2dp9 s LEU 38 N -1.85 -0.49 0.44 1.53 2.96 0.39 -4.77 118.68 116.89 2dp9 s LEU 38 Ca 0.73 0.74 -0.23 0.00 -0.22 0.00 0.00 54.13 55.14 2dp9 s LEU 38 Cb -0.44 1.04 -0.08 0.00 0.50 0.00 0.00 46.19 47.21 2dp9 s LEU 38 CO 0.49 -0.24 1.13 -0.83 -1.32 0.00 0.00 176.35 175.58 2dp9 s GLY 39 N 2.52 2.77 -0.37 7.98 0.00 0.00 -1.95 107.32 118.28 2dp9 s GLY 39 Ca 0.01 0.87 -0.10 0.00 0.00 0.00 0.00 44.72 45.50 2dp9 s GLY 39 CO -0.11 1.32 0.20 -0.42 0.00 0.00 0.00 173.10 174.09 2dp9 s ILE 40 N -1.57 4.42 -0.27 0.90 -1.09 -0.33 0.18 121.20 123.44 2dp9 s ILE 40 Ca 0.61 -0.96 -0.11 0.00 -2.23 0.00 0.00 60.65 57.96 2dp9 s ILE 40 Cb -0.27 -3.50 -0.05 0.00 -1.58 0.00 0.00 42.46 37.07 2dp9 s ILE 40 CO 0.33 -0.26 0.17 -0.69 -1.23 0.00 0.00 174.94 173.26 2dp9 s VAL 41 N 1.52 5.22 -0.04 2.92 1.01 0.18 -2.14 120.40 129.06 2dp9 s VAL 41 Ca 0.01 0.14 0.01 0.00 0.00 0.00 0.00 61.98 62.14 2dp9 s VAL 41 Cb -0.20 -3.47 0.02 0.00 0.00 0.00 0.00 36.38 32.73 2dp9 s VAL 41 CO 0.06 0.28 -0.05 -0.55 0.00 0.00 0.00 175.10 174.84 2dp9 s SER 42 N 1.61 0.92 -1.46 3.32 0.15 -0.12 -0.67 113.70 117.44 2dp9 s SER 42 Ca 0.07 -0.13 -0.06 0.00 0.70 0.00 0.00 55.95 56.53 2dp9 s SER 42 Cb -0.15 -0.41 0.03 0.00 -1.71 0.00 0.00 66.02 63.77 2dp9 s SER 42 CO 0.09 -0.03 0.56 0.61 1.20 0.00 0.00 173.24 175.67 2dp9 n GLY 43 N 3.89 -0.51 2.21 9.45 0.00 -1.26 -1.59 105.19 117.38 2dp9 n GLY 43 Ca -0.24 0.12 -0.03 0.00 0.00 0.00 0.00 46.02 45.87 2dp9 n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dp9 n GLY 44 N -1.40 0.58 3.08 -0.02 0.00 -1.26 -5.02 105.19 101.15 2dp9 n GLY 44 Ca -0.08 -0.39 -0.20 0.00 0.00 0.00 0.00 46.02 45.35 2dp9 n GLY 44 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dp9 s ARG 45 N -1.46 0.92 -0.55 1.61 1.81 -0.62 -2.84 118.95 117.83 2dp9 s ARG 45 Ca 0.00 -0.49 -0.23 0.00 -1.72 0.00 0.00 55.73 53.29 2dp9 s ARG 45 Cb 0.00 -0.90 0.05 0.00 -0.45 0.00 0.00 34.95 33.65 2dp9 s ARG 45 CO 0.00 0.24 0.88 -1.17 -0.68 0.00 0.00 175.30 174.57 2dp9 s LEU 46 N -0.47 4.28 0.08 2.53 2.96 0.17 -0.94 118.68 127.30 2dp9 s LEU 46 Ca 0.04 -0.49 0.23 0.00 -0.22 0.00 0.00 54.13 53.68 2dp9 s LEU 46 Cb -0.05 -2.73 0.05 0.00 0.50 0.00 0.00 46.19 43.95 2dp9 s LEU 46 CO -0.00 -1.18 1.02 2.30 -1.32 0.00 0.00 176.35 177.18 2dp9 n ILE 47 N 6.07 0.27 -1.69 6.68 -5.35 -0.91 -0.73 119.36 123.70 2dp9 n ILE 47 Ca -0.00 -0.33 0.00 0.00 -0.27 0.00 0.00 62.75 62.15 2dp9 n ILE 47 Cb 0.47 0.03 0.00 0.00 -1.74 0.00 0.00 39.64 38.40 2dp9 n ILE 47 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dp9 n GLY 48 N 1.32 -0.64 3.83 3.28 0.00 -1.25 -0.40 105.19 111.33 2dp9 n GLY 48 Ca 0.01 -0.55 -0.06 0.00 0.00 0.00 0.00 46.02 45.42 2dp9 n GLY 48 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2dp9 s GLN 49 N -0.46 1.60 0.14 1.61 -2.07 -0.78 -1.19 119.66 118.51 2dp9 s GLN 49 Ca 0.00 -0.89 -0.16 0.00 -1.82 0.00 0.00 55.36 52.49 2dp9 s GLN 49 Cb 0.00 0.54 0.03 0.00 -1.09 0.00 0.00 33.01 32.50 2dp9 s GLN 49 CO 0.00 -0.73 0.42 0.00 -1.32 0.00 0.00 175.29 173.65 2dp9 s ALA 50 N -3.69 -0.91 -0.21 2.60 0.00 -0.82 -1.67 121.76 117.05 2dp9 s ALA 50 Ca 0.12 -0.09 -0.13 0.00 0.00 0.00 0.00 51.96 51.86 2dp9 s ALA 50 Cb -0.04 0.72 -0.05 0.00 0.00 0.00 0.00 23.12 23.75 2dp9 s ALA 50 CO 0.06 -0.67 0.27 -0.51 0.00 0.00 0.00 175.76 174.91 2dp9 s ASP 51 N -2.82 6.29 -0.44 0.00 -0.00 -0.06 -0.46 116.67 119.18 2dp9 s ASP 51 Ca 0.04 0.33 -0.22 0.00 -0.00 0.00 0.00 52.55 52.70 2dp9 s ASP 51 Cb 0.01 -2.16 0.02 0.00 -0.00 0.00 0.00 42.92 40.79 2dp9 s ASP 51 CO -0.11 0.02 0.74 -0.22 -0.00 0.00 0.00 175.17 175.60 2dp9 s LEU 52 N 1.04 4.32 0.00 1.23 2.96 -0.02 -1.88 118.68 126.34 2dp9 s LEU 52 Ca 0.13 -0.14 0.12 0.00 -0.22 0.00 0.00 54.13 54.02 2dp9 s LEU 52 Cb -0.14 -2.89 0.02 0.00 0.50 0.00 0.00 46.19 43.69 2dp9 s LEU 52 CO 0.05 -0.85 0.75 1.33 -1.32 0.00 0.00 176.35 176.32 2dp9 n VAL 53 N 6.01 0.00 0.00 1.68 0.24 -0.49 -1.00 118.33 124.77 2dp9 n VAL 53 Ca 0.01 -0.41 0.00 0.00 -2.04 0.00 0.00 64.34 61.90 2dp9 n VAL 53 Cb 0.48 1.17 0.00 0.00 -1.47 0.00 0.00 33.84 34.02 2dp9 n VAL 53 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dp9 n GLY 54 N 0.91 0.51 2.89 7.63 0.00 -1.23 -5.01 105.19 110.88 2dp9 n GLY 54 Ca 0.06 -0.83 -0.21 0.00 0.00 0.00 0.00 46.02 45.04 2dp9 n GLY 54 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dp9 s VAL 55 N -2.00 0.56 0.10 1.61 1.01 -1.26 -0.14 120.40 120.28 2dp9 s VAL 55 Ca 0.00 -0.12 0.04 0.00 0.00 0.00 0.00 61.98 61.90 2dp9 s VAL 55 Cb 0.00 -0.59 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 2dp9 s VAL 55 CO 0.00 0.24 0.06 -1.61 0.00 0.00 0.00 175.10 173.79 2dp9 s GLU 56 N 1.04 2.76 0.00 2.72 0.41 0.21 -4.96 118.70 120.88 2dp9 s GLU 56 Ca -0.09 -0.78 0.00 0.00 -0.41 0.00 0.00 54.97 53.68 2dp9 s GLU 56 Cb -0.14 -2.64 0.00 0.00 -1.78 0.00 0.00 34.13 29.57 2dp9 s GLU 56 CO -0.01 0.54 0.00 0.41 -0.49 0.00 0.00 175.26 175.71 2dp9 n GLY 57 N 0.33 0.88 3.78 -1.39 0.00 -1.26 -0.90 105.19 106.64 2dp9 n GLY 57 Ca -0.09 -2.08 -0.34 0.00 0.00 0.00 0.00 46.02 43.51 2dp9 n GLY 57 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dp9 s PRO 58 N -1.10 3.42 0.25 1.61 0.04 -1.26 -5.06 135.00 132.90 2dp9 s PRO 58 Ca 0.00 1.47 0.11 0.00 0.04 0.00 0.00 61.00 62.62 2dp9 s PRO 58 Cb 0.00 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.47 2dp9 s PRO 58 CO 0.00 -0.77 -0.14 -0.06 0.04 0.00 0.00 177.00 176.07 2dp9 s PHE 59 N -1.97 2.44 0.32 0.56 0.40 0.16 -4.91 117.98 114.97 2dp9 s PHE 59 Ca 0.70 -0.29 0.07 0.00 -0.60 0.00 0.00 56.93 56.80 2dp9 s PHE 59 Cb -0.20 -1.10 -0.03 0.00 0.51 0.00 0.00 43.02 42.20 2dp9 s PHE 59 CO 0.28 0.64 0.31 -1.54 0.70 0.00 0.00 175.22 175.60 2dp9 s SER 60 N -3.36 5.50 0.23 1.36 1.04 -1.26 -1.51 113.70 115.70 2dp9 s SER 60 Ca 0.28 -0.37 -0.07 0.00 0.48 0.00 0.00 55.95 56.28 2dp9 s SER 60 Cb -0.06 -1.14 0.28 0.00 0.10 0.00 0.00 66.02 65.20 2dp9 s SER 60 CO 0.16 -0.30 1.87 0.58 0.98 0.00 0.00 173.24 176.52 2dp9 h VAL 61 N 1.22 1.10 -0.69 5.02 2.07 -1.97 -2.20 116.25 120.81 2dp9 h VAL 61 Ca -0.46 -0.35 0.07 0.00 0.82 0.00 0.00 66.70 66.78 2dp9 h VAL 61 Cb 1.25 -0.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.96 2dp9 h VAL 61 CO 0.58 0.19 0.38 -0.33 0.02 0.00 0.00 177.57 178.40 2dp9 h GLU 62 N 1.02 0.67 -0.08 1.57 3.07 -2.00 -1.81 114.58 117.01 2dp9 h GLU 62 Ca 0.35 -0.04 -0.06 0.00 -0.50 0.00 0.00 59.36 59.11 2dp9 h GLU 62 Cb 0.06 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 27.81 2dp9 h GLU 62 CO -0.14 0.44 -0.22 0.93 -1.40 0.00 0.00 179.01 178.63 2dp9 h GLU 63 N 0.69 0.14 -0.07 2.33 5.08 -1.80 -2.94 114.58 118.01 2dp9 h GLU 63 Ca 0.31 -0.04 -0.20 0.00 -1.00 0.00 0.00 59.36 58.44 2dp9 h GLU 63 Cb 0.22 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 2dp9 h GLU 63 CO -0.20 0.36 -0.79 -0.07 -1.00 0.00 0.00 179.01 177.31 2dp9 h LEU 64 N 0.13 0.57 -1.79 1.33 3.38 -0.99 -3.09 115.31 114.85 2dp9 h LEU 64 Ca 0.02 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2dp9 h LEU 64 Cb 0.47 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2dp9 h LEU 64 CO 0.03 1.15 0.00 -0.07 0.09 0.00 0.00 178.44 179.65 2dp9 h LEU 65 N 0.31 0.00 -0.06 1.67 3.38 -1.21 0.38 115.31 119.77 2dp9 h LEU 65 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2dp9 h LEU 65 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 2dp9 h LEU 65 CO 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 178.44 178.66 2dp9 n ALA 66 N -1.85 2.60 -2.57 1.53 0.00 -1.17 -3.39 120.51 115.67 2dp9 n ALA 66 Ca -0.02 -0.19 -0.08 0.00 0.00 0.00 0.00 53.44 53.15 2dp9 n ALA 66 Cb 0.04 -1.47 0.04 0.00 0.00 0.00 0.00 19.45 18.06 2dp9 n ALA 66 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2dp9 n HIS 67 N -1.10 1.76 -0.32 0.00 8.25 0.13 -4.90 115.22 119.04 2dp9 n HIS 67 Ca 0.18 -2.18 0.11 0.00 -0.26 0.00 0.00 57.72 55.56 2dp9 n HIS 67 Cb 0.20 -0.27 0.28 0.00 1.12 0.00 0.00 29.99 31.32 2dp9 n HIS 67 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 2dp9 h GLN 68 N 2.48 0.63 0.00 -0.41 5.75 -1.56 -0.33 115.11 121.67 2dp9 h GLN 68 Ca 0.03 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 2dp9 h GLN 68 Cb 1.35 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 29.76 2dp9 h GLN 68 CO 0.38 0.42 -0.05 1.05 -2.65 0.00 0.00 178.83 177.97 2dp9 h GLU 69 N 0.65 0.00 0.13 1.69 9.09 -1.91 0.14 114.58 124.38 2dp9 h GLU 69 Ca 0.53 0.00 -0.30 0.00 0.05 0.00 0.00 59.36 59.64 2dp9 h GLU 69 Cb 0.82 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.92 2dp9 h GLU 69 CO -0.40 0.05 -1.41 0.87 0.05 0.00 0.00 179.01 178.18 2dp9 h LYS 70 N 0.00 0.28 0.00 1.06 1.57 -1.39 -3.40 116.57 114.69 2dp9 h LYS 70 Ca -0.00 -0.48 -0.05 0.00 -1.87 0.00 0.00 60.65 58.25 2dp9 h LYS 70 Cb 0.31 0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 2dp9 h LYS 70 CO 0.01 1.18 -1.50 -2.39 -0.57 0.00 0.00 179.45 176.18 2dp9 n HIS 71 N -3.51 0.00 -2.82 -1.35 1.44 -1.16 -1.52 115.22 106.31 2dp9 n HIS 71 Ca -0.13 0.00 -0.19 0.00 -2.01 0.00 0.00 57.72 55.38 2dp9 n HIS 71 Cb 1.04 -0.29 0.01 0.00 0.12 0.00 0.00 29.99 30.86 2dp9 n HIS 71 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2dp9 n LEU 72 N -1.99 -1.82 -4.74 2.39 4.77 0.49 -4.94 117.00 111.15 2dp9 n LEU 72 Ca -0.06 -0.12 -0.35 0.00 -0.03 0.00 0.00 56.01 55.45 2dp9 n LEU 72 Cb 0.42 -2.52 -0.08 0.00 -2.33 0.00 0.00 43.42 38.90 2dp9 n LEU 72 CO 0.20 0.03 -0.20 0.00 -1.33 0.00 0.00 177.39 176.09 2dp9 s ALA 73 N -2.93 3.65 0.27 -1.18 0.00 -1.26 -5.07 121.76 115.25 2dp9 s ALA 73 Ca 0.18 -0.70 -0.30 0.00 0.00 0.00 0.00 51.96 51.15 2dp9 s ALA 73 Cb -0.09 -2.03 -0.11 0.00 0.00 0.00 0.00 23.12 20.89 2dp9 s ALA 73 CO 0.22 0.29 1.50 -1.21 0.00 0.00 0.00 175.76 176.56 2dp9 s GLU 74 N -0.03 4.21 0.23 0.00 0.41 -1.26 -4.86 118.70 117.40 2dp9 s GLU 74 Ca 0.09 2.41 -0.07 0.00 -0.41 0.00 0.00 54.97 56.99 2dp9 s GLU 74 Cb -0.12 -3.07 0.35 0.00 -1.78 0.00 0.00 34.13 29.51 2dp9 s GLU 74 CO 0.00 -0.50 1.76 1.49 -0.49 0.00 0.00 175.26 177.52 2dp9 h GLU 75 N 4.85 0.49 -0.56 1.61 4.81 -1.99 0.38 114.58 124.18 2dp9 h GLU 75 Ca -0.47 -0.03 0.08 0.00 -0.13 0.00 0.00 59.36 58.82 2dp9 h GLU 75 Cb 1.22 -0.11 -0.07 0.00 0.63 0.00 0.00 28.75 30.42 2dp9 h GLU 75 CO 0.77 0.33 0.19 0.00 -0.73 0.00 0.00 179.01 179.57 2dp9 h ALA 76 N 1.46 0.69 -0.15 2.92 0.00 -2.00 -1.10 119.26 121.07 2dp9 h ALA 76 Ca 0.35 0.08 -0.16 0.00 0.00 0.00 0.00 54.91 55.18 2dp9 h ALA 76 Cb 0.44 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2dp9 h ALA 76 CO -0.31 -0.22 -0.59 0.74 0.00 0.00 0.00 179.25 178.87 2dp9 h PHE 77 N 0.36 0.64 0.31 0.00 0.05 -1.65 -2.44 116.94 114.22 2dp9 h PHE 77 Ca 0.28 -0.24 -0.01 0.00 3.82 0.00 0.00 57.97 61.81 2dp9 h PHE 77 Cb 0.33 -0.12 0.00 0.00 2.00 0.00 0.00 35.95 38.17 2dp9 h PHE 77 CO -0.18 0.97 -0.16 -0.07 -0.18 0.00 0.00 178.31 178.69 2dp9 h LEU 78 N 0.38 -0.39 -0.46 1.54 3.38 -0.19 0.61 115.31 120.17 2dp9 h LEU 78 Ca -0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2dp9 h LEU 78 Cb 1.14 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 2dp9 h LEU 78 CO 0.11 -0.27 0.29 0.03 0.09 0.00 0.00 178.44 178.69 2dp9 h ARG 79 N -0.44 0.62 0.00 1.13 3.08 -1.28 0.31 114.38 117.80 2dp9 h ARG 79 Ca -0.04 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 2dp9 h ARG 79 Cb 0.35 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 2dp9 h ARG 79 CO 0.06 0.44 -0.13 0.00 -1.07 0.00 0.00 179.97 179.27 2dp9 h ALA 80 N 1.15 1.41 0.00 0.04 0.00 -1.30 -1.92 119.26 118.64 2dp9 h ALA 80 Ca 0.17 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2dp9 h ALA 80 Cb -0.03 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2dp9 h ALA 80 CO -0.03 0.16 -0.14 -0.92 0.00 0.00 0.00 179.25 178.31 2dp9 h TYR 81 N 0.00 0.00 -0.62 0.00 3.20 0.03 -3.37 116.97 116.21 2dp9 h TYR 81 Ca -0.00 0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.00 2dp9 h TYR 81 Cb 0.30 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.54 2dp9 h TYR 81 CO 0.00 0.04 0.43 0.00 -1.64 0.00 0.00 178.16 176.99 2dp9 h ALA 82 N -0.97 2.21 -6.04 1.82 0.00 -0.43 -3.46 119.26 112.39 2dp9 h ALA 82 Ca -0.00 -0.01 -0.41 0.00 0.00 0.00 0.00 54.91 54.48 2dp9 h ALA 82 Cb 0.17 -0.03 0.06 0.00 0.00 0.00 0.00 17.79 17.99 2dp9 h ALA 82 CO -0.00 -0.37 -0.80 1.63 0.00 0.00 0.00 179.25 179.71 2dp9 n LYS 83 N -4.44 -5.49 -2.00 0.00 4.76 -0.72 -1.44 118.16 108.82 2dp9 n LYS 83 Ca 0.11 0.67 -0.19 0.00 -2.87 0.00 0.00 58.31 56.03 2dp9 n LYS 83 Cb 0.50 -5.39 -0.04 0.00 -1.84 0.00 0.00 35.03 28.27 2dp9 n LYS 83 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2dp9 n ASP 84 N -3.03 -5.33 -4.34 4.39 2.03 -1.26 -4.99 116.55 104.02 2dp9 n ASP 84 Ca -0.22 0.19 -0.19 0.00 0.52 0.00 0.00 54.79 55.08 2dp9 n ASP 84 Cb 0.64 -4.42 -0.10 0.00 -0.72 0.00 0.00 41.12 36.52 2dp9 n ASP 84 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2dp9 s GLU 85 N -4.34 1.31 0.56 -0.67 2.02 -0.52 -5.13 118.70 111.92 2dp9 s GLU 85 Ca 0.00 -1.53 -0.21 0.00 0.02 0.00 0.00 54.97 53.25 2dp9 s GLU 85 Cb 0.00 -1.18 -0.05 0.00 0.10 0.00 0.00 34.13 33.00 2dp9 s GLU 85 CO 0.00 0.21 1.24 -2.30 0.02 0.00 0.00 175.26 174.43 2dp9 n PRO 86 N -0.16 1.42 -4.31 0.39 -0.02 -1.26 -4.78 135.00 126.28 2dp9 n PRO 86 Ca -0.10 0.53 -0.18 0.00 -2.02 0.00 0.00 63.50 61.73 2dp9 n PRO 86 Cb 0.59 -2.44 -0.10 0.00 -0.02 0.00 0.00 33.50 31.53 2dp9 n PRO 86 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2dp9 s LEU 87 N -3.00 2.50 0.19 2.45 1.43 -0.57 -4.81 118.68 116.87 2dp9 s LEU 87 Ca 0.73 -0.94 0.08 0.00 -1.03 0.00 0.00 54.13 52.97 2dp9 s LEU 87 Cb -0.42 -0.63 -0.04 0.00 0.03 0.00 0.00 46.19 45.12 2dp9 s LEU 87 CO 0.48 -0.16 -0.16 -0.31 0.23 0.00 0.00 176.35 176.43 2dp9 s TYR 88 N -2.66 1.77 -0.21 0.29 1.51 0.09 0.35 117.35 118.49 2dp9 s TYR 88 Ca 0.17 -0.52 0.01 0.00 -1.01 0.00 0.00 57.07 55.73 2dp9 s TYR 88 Cb -0.02 -0.84 0.04 0.00 -0.11 0.00 0.00 41.96 41.03 2dp9 s TYR 88 CO 0.05 0.37 -0.13 0.00 -1.11 0.00 0.00 175.55 174.73 2dp9 s ALA 89 N -2.62 2.23 -0.24 3.71 0.00 -0.07 -1.53 121.76 123.23 2dp9 s ALA 89 Ca 0.20 -1.34 -0.28 0.00 0.00 0.00 0.00 51.96 50.54 2dp9 s ALA 89 Cb -0.03 -1.33 0.01 0.00 0.00 0.00 0.00 23.12 21.77 2dp9 s ALA 89 CO 0.07 -0.78 0.99 -1.58 0.00 0.00 0.00 175.76 174.46 2dp9 s TRP 90 N 1.30 3.31 -0.18 0.00 0.52 0.46 -0.62 118.94 123.72 2dp9 s TRP 90 Ca -0.01 1.35 -0.26 0.00 0.02 0.00 0.00 56.10 57.20 2dp9 s TRP 90 Cb -0.16 -3.26 -0.01 0.00 -1.15 0.00 0.00 33.47 28.89 2dp9 s TRP 90 CO -0.09 -0.49 0.88 0.08 0.02 0.00 0.00 176.95 177.35 2dp9 s VAL 91 N 3.16 4.83 0.16 4.03 1.01 0.81 -1.23 120.40 133.17 2dp9 s VAL 91 Ca 0.42 1.73 0.10 0.00 0.00 0.00 0.00 61.98 64.23 2dp9 s VAL 91 Cb -0.15 -4.18 -0.04 0.00 0.00 0.00 0.00 36.38 32.01 2dp9 s VAL 91 CO 0.07 -0.02 -0.19 -0.76 0.00 0.00 0.00 175.10 174.20 2dp9 s LEU 92 N 2.41 2.62 0.24 3.92 1.43 0.12 -1.40 118.68 128.02 2dp9 s LEU 92 Ca 0.40 -0.69 -0.16 0.00 -1.03 0.00 0.00 54.13 52.64 2dp9 s LEU 92 Cb -0.16 -1.40 0.01 0.00 0.03 0.00 0.00 46.19 44.67 2dp9 s LEU 92 CO 0.11 0.14 0.54 -1.83 0.23 0.00 0.00 176.35 175.55 2dp9 s GLU 93 N -2.47 1.54 -1.45 1.70 -1.05 -0.79 -4.71 118.70 111.47 2dp9 s GLU 93 Ca 0.20 -1.06 -0.07 0.00 -0.15 0.00 0.00 54.97 53.88 2dp9 s GLU 93 Cb -0.09 0.52 0.04 0.00 -0.44 0.00 0.00 34.13 34.15 2dp9 s GLU 93 CO 0.11 -0.66 0.64 0.09 0.95 0.00 0.00 175.26 176.39 2dp9 n ASN 94 N -0.38 -5.21 -4.77 0.83 3.02 -1.26 -0.88 115.26 106.60 2dp9 n ASN 94 Ca -0.05 -0.38 -0.39 0.00 -0.03 0.00 0.00 54.58 53.73 2dp9 n ASN 94 Cb 0.61 -4.22 -0.06 0.00 -0.61 0.00 0.00 39.78 35.50 2dp9 n ASN 94 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dp9 s ALA 95 N -3.11 3.34 0.07 5.41 0.00 -1.26 -4.47 121.76 121.73 2dp9 s ALA 95 Ca 0.39 0.48 -0.16 0.00 0.00 0.00 0.00 51.96 52.66 2dp9 s ALA 95 Cb -0.19 -3.10 0.03 0.00 0.00 0.00 0.00 23.12 19.87 2dp9 s ALA 95 CO 0.48 0.23 0.38 -0.59 0.00 0.00 0.00 175.76 176.26 2dp9 s PHE 96 N -1.32 -0.20 -0.17 0.00 -0.71 -0.67 -4.47 117.98 110.44 2dp9 s PHE 96 Ca 0.42 0.05 -0.11 0.00 -1.04 0.00 0.00 56.93 56.25 2dp9 s PHE 96 Cb -0.22 0.19 -0.05 0.00 -1.21 0.00 0.00 43.02 41.73 2dp9 s PHE 96 CO 0.27 -0.59 0.20 0.50 -1.34 0.00 0.00 175.22 174.26 2dp9 s ARG 97 N -2.91 4.09 0.46 1.99 3.52 -0.96 -1.87 118.95 123.28 2dp9 s ARG 97 Ca -0.03 -0.08 -0.24 0.00 -0.13 0.00 0.00 55.73 55.26 2dp9 s ARG 97 Cb 0.00 -3.38 -0.07 0.00 -1.56 0.00 0.00 34.95 29.94 2dp9 s ARG 97 CO -0.06 0.37 1.25 0.71 -0.81 0.00 0.00 175.30 176.76 2dp9 s TYR 98 N 0.13 2.74 0.28 5.12 2.02 0.47 -4.89 117.35 123.21 2dp9 s TYR 98 Ca 0.12 1.46 0.01 0.00 -0.37 0.00 0.00 57.07 58.30 2dp9 s TYR 98 Cb -0.12 -3.56 0.63 0.00 -0.40 0.00 0.00 41.96 38.51 2dp9 s TYR 98 CO 0.01 -1.98 1.71 1.05 -1.57 0.00 0.00 175.55 174.77 2dp9 h GLU 99 N 2.13 0.42 -4.17 -0.62 9.09 -1.97 -3.38 114.58 116.07 2dp9 h GLU 99 Ca -0.50 -0.03 -0.45 0.00 0.05 0.00 0.00 59.36 58.44 2dp9 h GLU 99 Cb 1.26 -0.09 -0.34 0.00 -1.65 0.00 0.00 28.75 27.92 2dp9 h GLU 99 CO 0.60 0.28 -0.79 0.15 0.05 0.00 0.00 179.01 179.30 2dp9 s LYS 100 N -5.94 1.11 0.33 1.06 1.02 -1.26 -5.12 119.74 110.94 2dp9 s LYS 100 Ca -0.12 -0.19 -0.29 0.00 0.02 0.00 0.00 55.97 55.39 2dp9 s LYS 100 Cb 0.24 -1.05 -0.10 0.00 -0.52 0.00 0.00 37.83 36.39 2dp9 s LYS 100 CO 0.77 -0.07 1.38 -1.25 -0.92 0.00 0.00 175.35 175.26 2dp9 s PRO 101 N 0.94 4.28 0.10 -1.68 0.04 -1.26 -4.96 135.00 132.45 2dp9 s PRO 101 Ca -0.10 2.33 -0.04 0.00 0.04 0.00 0.00 61.00 63.22 2dp9 s PRO 101 Cb -0.15 -3.05 -0.05 0.00 0.04 0.00 0.00 34.50 31.30 2dp9 s PRO 101 CO 0.00 -0.32 0.32 -0.51 0.04 0.00 0.00 177.00 176.54 2dp9 s LEU 102 N -1.67 4.31 0.22 -3.56 2.01 0.09 -4.88 118.68 115.20 2dp9 s LEU 102 Ca 0.51 0.51 -0.29 0.00 0.01 0.00 0.00 54.13 54.87 2dp9 s LEU 102 Cb -0.42 -3.11 -0.09 0.00 0.01 0.00 0.00 46.19 42.59 2dp9 s LEU 102 CO 0.54 0.12 0.92 -2.28 1.01 0.00 0.00 176.35 176.66 2dp9 s HIS 103 N -1.55 3.96 -0.10 0.29 5.65 -1.26 0.44 115.29 122.71 2dp9 s HIS 103 Ca 0.37 1.88 0.02 0.00 0.25 0.00 0.00 55.06 57.57 2dp9 s HIS 103 Cb -0.13 -2.96 -0.01 0.00 -1.18 0.00 0.00 32.58 28.30 2dp9 s HIS 103 CO 0.24 0.44 -0.16 0.08 -0.65 0.00 0.00 174.74 174.69 2dp9 s VAL 104 N -1.06 2.83 -0.02 0.89 1.01 -1.13 -4.81 120.40 118.11 2dp9 s VAL 104 Ca 0.41 -0.76 -0.39 0.00 0.00 0.00 0.00 61.98 61.24 2dp9 s VAL 104 Cb -0.25 -2.15 -0.18 0.00 0.00 0.00 0.00 36.38 33.80 2dp9 s VAL 104 CO 0.31 0.55 1.31 -0.81 0.00 0.00 0.00 175.10 176.46 2dp9 n PRO 105 N 3.21 0.68 -1.51 2.72 -0.04 -1.26 -4.86 135.00 133.94 2dp9 n PRO 105 Ca -0.18 0.25 -0.30 0.00 -0.04 0.00 0.00 63.50 63.23 2dp9 n PRO 105 Cb 0.53 -1.84 0.10 0.00 -0.04 0.00 0.00 33.50 32.25 2dp9 n PRO 105 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2dp9 s ARG 106 N 0.82 1.85 0.62 0.54 1.81 -1.26 -4.28 118.95 119.06 2dp9 s ARG 106 Ca 0.90 0.61 -0.16 0.00 -1.72 0.00 0.00 55.73 55.36 2dp9 s ARG 106 Cb -1.11 -1.89 -0.02 0.00 -0.45 0.00 0.00 34.95 31.48 2dp9 s ARG 106 CO 0.55 -1.78 1.10 1.03 -0.68 0.00 0.00 175.30 175.51 2dp9 s ARG 107 N -5.14 3.04 0.00 3.54 0.52 -1.26 -1.53 118.95 118.11 2dp9 s ARG 107 Ca 0.61 1.36 0.26 0.00 -0.52 0.00 0.00 55.73 57.45 2dp9 s ARG 107 Cb -0.15 -1.98 0.63 0.00 0.52 0.00 0.00 34.95 33.97 2dp9 s ARG 107 CO 0.54 -1.06 1.51 -0.35 0.02 0.00 0.00 175.30 175.97 2dp9 n PRO 108 N -2.15 1.99 0.24 3.54 -0.04 -1.26 -4.80 135.00 132.52 2dp9 n PRO 108 Ca 0.10 -1.43 0.08 0.00 -0.04 0.00 0.00 63.50 62.20 2dp9 n PRO 108 Cb 0.52 -1.47 0.58 0.00 -0.04 0.00 0.00 33.50 33.09 2dp9 n PRO 108 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2dp9 h GLY 109 N 4.79 0.00 -6.26 0.55 0.00 -1.89 -3.44 103.07 96.83 2dp9 h GLY 109 Ca 0.00 0.00 -0.74 0.00 0.00 0.00 0.00 47.33 46.59 2dp9 h GLY 109 CO 0.00 0.00 0.85 -2.13 0.00 0.00 0.00 176.54 175.26 2dp9 n ARG 110 N -4.15 1.13 -2.82 4.80 0.63 -0.58 -4.91 116.66 110.76 2dp9 n ARG 110 Ca -0.02 0.41 -0.41 0.00 -0.92 0.00 0.00 57.85 56.91 2dp9 n ARG 110 Cb 0.23 -2.09 -0.04 0.00 0.45 0.00 0.00 32.46 31.01 2dp9 n ARG 110 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2dp9 s VAL 111 N 3.23 4.90 0.02 5.15 1.01 -1.26 -4.96 120.40 128.48 2dp9 s VAL 111 Ca 0.97 1.83 0.07 0.00 0.00 0.00 0.00 61.98 64.85 2dp9 s VAL 111 Cb -1.07 -4.22 -0.02 0.00 0.00 0.00 0.00 36.38 31.07 2dp9 s VAL 111 CO 0.64 0.14 -0.22 -0.04 0.00 0.00 0.00 175.10 175.62 2dp9 s MET 112 N 1.31 1.58 0.06 2.72 1.00 -1.26 -5.12 119.30 119.58 2dp9 s MET 112 Ca 0.45 -0.88 0.08 0.00 0.00 0.00 0.00 55.69 55.34 2dp9 s MET 112 Cb -0.19 -1.63 -0.03 0.00 0.00 0.00 0.00 34.83 32.98 2dp9 s MET 112 CO 0.21 0.43 -0.21 -0.06 0.00 0.00 0.00 175.02 175.39 2dp9 s PHE 113 N -0.67 2.47 0.03 -0.03 0.08 -1.26 -5.11 117.98 113.49 2dp9 s PHE 113 Ca 0.08 -0.31 -0.26 0.00 0.12 0.00 0.00 56.93 56.57 2dp9 s PHE 113 Cb -0.09 -1.42 -0.05 0.00 -0.57 0.00 0.00 43.02 40.90 2dp9 s PHE 113 CO 0.01 0.24 0.79 0.08 -0.10 0.00 0.00 175.22 176.24 2dp9 s VAL 114 N -0.93 4.77 -0.35 -0.44 1.01 -1.26 -5.01 120.40 118.20 2dp9 s VAL 114 Ca 0.14 1.68 -0.29 0.00 0.00 0.00 0.00 61.98 63.51 2dp9 s VAL 114 Cb -0.10 -4.14 0.01 0.00 0.00 0.00 0.00 36.38 32.15 2dp9 s VAL 114 CO 0.05 0.32 1.21 -0.62 0.00 0.00 0.00 175.10 176.06 2dp9 s ASP 115 N 0.19 6.71 0.00 3.32 3.68 -1.26 -4.87 116.67 124.43 2dp9 s ASP 115 Ca 0.40 0.97 0.20 0.00 2.13 0.00 0.00 52.55 56.26 2dp9 s ASP 115 Cb -0.20 -2.54 0.49 0.00 -1.45 0.00 0.00 42.92 39.21 2dp9 s ASP 115 CO 0.23 -1.09 1.41 0.18 0.13 0.00 0.00 175.17 176.03 2dp9 n LEU 116 N 7.57 3.54 0.33 -1.34 4.77 -1.26 -4.58 117.00 126.03 2dp9 n LEU 116 Ca 0.14 -1.79 0.21 0.00 -0.03 0.00 0.00 56.01 54.54 2dp9 n LEU 116 Cb 0.47 -0.34 1.13 0.00 -2.33 0.00 0.00 43.42 42.35 2dp9 n LEU 116 CO 0.64 0.84 1.17 0.77 -1.33 0.00 0.00 177.39 179.48 2dp9 h SER 117 N 3.90 0.00 -0.08 -1.43 4.64 -1.97 -2.33 113.55 116.28 2dp9 h SER 117 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2dp9 h SER 117 Cb 0.93 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 2dp9 h SER 117 CO 0.00 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.34 2dp9 n GLU 118 N -3.30 1.79 -1.72 4.77 -0.58 -1.26 -4.62 120.64 115.71 2dp9 n GLU 118 Ca -0.03 -1.73 -0.43 0.00 -0.42 0.00 0.00 57.16 54.56 2dp9 n GLU 118 Cb 0.08 -1.38 -0.02 0.00 -0.57 0.00 0.00 31.44 29.55 2dp9 n GLU 118 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2dp9 n VAL 119 N 1.10 0.84 -2.54 2.62 0.31 -0.88 -4.91 118.33 114.88 2dp9 n VAL 119 Ca 0.12 -0.21 -0.41 0.00 -0.01 0.00 0.00 64.34 63.83 2dp9 n VAL 119 Cb 0.49 -1.84 -0.03 0.00 -0.91 0.00 0.00 33.84 31.55 2dp9 n VAL 119 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2dp9 s ARG 120 N -0.23 3.39 0.00 5.55 1.81 -1.26 -5.15 118.95 123.07 2dp9 s ARG 120 Ca 0.67 -0.72 0.29 0.00 -1.72 0.00 0.00 55.73 54.25 2dp9 s ARG 120 Cb -0.54 -4.86 1.71 0.00 -0.45 0.00 0.00 34.95 30.81 2dp9 s ARG 120 CO 0.46 -2.22 2.05 0.91 -0.68 0.00 0.00 175.30 175.82