#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oxg s ASP 2 N 0.00 6.08 -1.33 0.00 1.01 -1.26 -4.19 116.67 116.98 2oxg s ASP 2 Ca 0.00 2.24 -0.07 0.00 0.71 0.00 0.00 52.55 55.43 2oxg s ASP 2 Cb 0.00 -2.59 0.01 0.00 1.01 0.00 0.00 42.92 41.34 2oxg s ASP 2 CO 0.00 -0.98 0.98 0.47 0.21 0.00 0.00 175.17 175.85 2oxg n ASP 3 N -0.71 -6.08 -4.47 0.27 10.43 -1.26 -4.89 116.55 109.83 2oxg n ASP 3 Ca 0.08 -0.45 -0.44 0.00 2.57 0.00 0.00 54.79 56.56 2oxg n ASP 3 Cb 0.49 -4.75 -0.00 0.00 1.84 0.00 0.00 41.12 38.69 2oxg n ASP 3 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2oxg s ALA 4 N -3.26 3.87 -0.35 2.24 0.00 -1.26 -4.67 121.76 118.33 2oxg s ALA 4 Ca 0.48 -3.25 -0.17 0.00 0.00 0.00 0.00 51.96 49.02 2oxg s ALA 4 Cb -0.21 -4.15 -0.00 0.00 0.00 0.00 0.00 23.12 18.75 2oxg s ALA 4 CO 0.60 -2.84 0.47 0.15 0.00 0.00 0.00 175.76 174.14 2oxg s LYS 5 N 1.91 3.58 0.51 0.00 1.02 -1.26 -4.79 119.74 120.72 2oxg s LYS 5 Ca 0.42 -0.27 -0.20 0.00 0.02 0.00 0.00 55.97 55.95 2oxg s LYS 5 Cb -0.03 -3.82 -0.07 0.00 -0.52 0.00 0.00 37.83 33.40 2oxg s LYS 5 CO -0.01 -0.62 1.09 -2.14 -0.92 0.00 0.00 175.35 172.75 2oxg s PRO 6 N 2.27 3.58 -0.04 -1.68 0.02 -1.26 -2.01 135.00 135.87 2oxg s PRO 6 Ca 0.16 1.49 -0.02 0.00 0.02 0.00 0.00 61.00 62.66 2oxg s PRO 6 Cb -0.16 -2.05 0.03 0.00 0.02 0.00 0.00 34.50 32.34 2oxg s PRO 6 CO 0.13 -0.64 0.05 0.50 -0.33 0.00 0.00 177.00 176.71 2oxg s ARG 7 N -3.25 -0.01 0.10 5.54 3.52 0.34 -4.96 118.95 120.22 2oxg s ARG 7 Ca 0.70 0.35 0.10 0.00 -0.13 0.00 0.00 55.73 56.76 2oxg s ARG 7 Cb -0.20 -0.56 -0.04 0.00 -1.56 0.00 0.00 34.95 32.60 2oxg s ARG 7 CO 0.23 -0.33 -0.26 0.08 -0.81 0.00 0.00 175.30 174.21 2oxg s VAL 8 N 2.15 2.26 -0.11 7.11 1.01 -1.26 -0.60 120.40 130.95 2oxg s VAL 8 Ca 0.05 -1.63 -0.00 0.00 0.00 0.00 0.00 61.98 60.40 2oxg s VAL 8 Cb -0.12 -1.96 0.02 0.00 0.00 0.00 0.00 36.38 34.32 2oxg s VAL 8 CO -0.03 0.18 -0.07 -0.54 0.00 0.00 0.00 175.10 174.64 2oxg s LYS 9 N -1.80 1.46 -0.19 2.72 1.02 0.14 -5.01 119.74 118.07 2oxg s LYS 9 Ca 0.13 -0.23 -0.20 0.00 0.02 0.00 0.00 55.97 55.70 2oxg s LYS 9 Cb -0.10 -1.53 0.05 0.00 -0.52 0.00 0.00 37.83 35.73 2oxg s LYS 9 CO 0.05 -0.26 0.55 0.54 -0.92 0.00 0.00 175.35 175.31 2oxg s VAL 10 N 1.70 0.00 0.37 3.17 0.11 -1.26 -1.29 120.40 123.19 2oxg s VAL 10 Ca 0.04 -0.02 -0.27 0.00 -2.93 0.00 0.00 61.98 58.81 2oxg s VAL 10 Cb -0.13 -0.78 -0.12 0.00 -1.53 0.00 0.00 36.38 33.83 2oxg s VAL 10 CO -0.08 -0.01 1.18 -2.65 -3.33 0.00 0.00 175.10 170.21 2oxg n PRO 11 N 2.60 1.79 0.04 1.54 -0.02 -1.26 -4.89 135.00 134.80 2oxg n PRO 11 Ca -0.14 0.63 0.13 0.00 -2.02 0.00 0.00 63.50 62.10 2oxg n PRO 11 Cb 0.56 -2.20 0.54 0.00 -0.02 0.00 0.00 33.50 32.38 2oxg n PRO 11 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2oxg n SER 12 N 0.66 0.27 -3.85 2.55 3.41 -1.26 -4.85 113.62 110.55 2oxg n SER 12 Ca 0.07 0.53 -0.09 0.00 -0.26 0.00 0.00 58.87 59.12 2oxg n SER 12 Cb 0.37 -0.60 -0.07 0.00 -0.26 0.00 0.00 64.21 63.65 2oxg n SER 12 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2oxg s SER 13 N -3.50 0.08 0.09 4.04 1.04 -1.26 -0.59 113.70 113.59 2oxg s SER 13 Ca 0.12 -0.65 -0.18 0.00 0.48 0.00 0.00 55.95 55.73 2oxg s SER 13 Cb 0.16 0.36 0.04 0.00 0.10 0.00 0.00 66.02 66.68 2oxg s SER 13 CO 0.54 -0.76 0.42 0.00 0.98 0.00 0.00 173.24 174.42 2oxg s ALA 14 N -3.87 -1.02 0.40 5.32 0.00 -0.34 -4.92 121.76 117.35 2oxg s ALA 14 Ca 0.06 0.17 -0.23 0.00 0.00 0.00 0.00 51.96 51.96 2oxg s ALA 14 Cb 0.04 0.53 -0.09 0.00 0.00 0.00 0.00 23.12 23.60 2oxg s ALA 14 CO -0.10 -0.56 1.01 0.15 0.00 0.00 0.00 175.76 176.26 2oxg s LYS 15 N -3.13 4.20 0.06 0.00 3.01 -1.26 -0.51 119.74 122.11 2oxg s LYS 15 Ca -0.01 1.38 -0.34 0.00 -1.01 0.00 0.00 55.97 55.99 2oxg s LYS 15 Cb 0.00 -2.45 -0.13 0.00 -1.01 0.00 0.00 37.83 34.24 2oxg s LYS 15 CO -0.07 -0.08 1.68 0.00 0.51 0.00 0.00 175.35 177.39 2oxg n ALA 16 N -0.19 1.09 -0.33 5.17 0.00 -0.90 -1.22 120.51 124.12 2oxg n ALA 16 Ca 0.05 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.88 2oxg n ALA 16 Cb 0.51 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.56 2oxg n ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oxg n GLY 17 N 3.75 0.98 3.80 0.00 0.00 0.72 -4.98 105.19 109.46 2oxg n GLY 17 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 2oxg n GLY 17 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2oxg s GLU 18 N -0.51 4.02 -0.03 1.61 2.12 -0.35 -4.59 118.70 120.97 2oxg s GLU 18 Ca 0.00 1.37 -0.24 0.00 0.36 0.00 0.00 54.97 56.46 2oxg s GLU 18 Cb 0.00 -2.29 -0.04 0.00 0.26 0.00 0.00 34.13 32.06 2oxg s GLU 18 CO 0.00 -0.24 0.72 0.99 -0.54 0.00 0.00 175.26 176.19 2oxg s THR 19 N -1.89 4.94 0.08 -1.70 2.01 -1.26 -1.18 115.64 116.64 2oxg s THR 19 Ca 0.63 1.49 0.10 0.00 0.31 0.00 0.00 61.69 64.22 2oxg s THR 19 Cb -0.17 -4.06 -0.03 0.00 0.01 0.00 0.00 72.50 68.25 2oxg s THR 19 CO 0.21 0.30 -0.25 0.68 -0.69 0.00 0.00 174.62 174.87 2oxg s VAL 20 N 0.47 2.09 -0.02 3.82 -7.23 -0.06 -4.97 120.40 114.50 2oxg s VAL 20 Ca 0.38 -1.52 -0.21 0.00 -1.81 0.00 0.00 61.98 58.81 2oxg s VAL 20 Cb -0.19 -1.82 -0.05 0.00 0.56 0.00 0.00 36.38 34.88 2oxg s VAL 20 CO 0.20 0.20 0.61 -0.89 -0.31 0.00 0.00 175.10 174.91 2oxg s THR 21 N -0.94 4.95 -0.11 5.32 2.01 -1.26 -0.91 115.64 124.70 2oxg s THR 21 Ca 0.12 1.27 0.00 0.00 0.31 0.00 0.00 61.69 63.39 2oxg s THR 21 Cb -0.10 -3.95 -0.02 0.00 0.01 0.00 0.00 72.50 68.44 2oxg s THR 21 CO 0.04 0.38 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.55 2oxg s VAL 22 N 0.04 3.25 -0.09 3.82 1.01 0.29 -4.49 120.40 124.22 2oxg s VAL 22 Ca 0.32 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.72 2oxg s VAL 22 Cb -0.18 -2.35 0.01 0.00 0.00 0.00 0.00 36.38 33.86 2oxg s VAL 22 CO 0.17 0.55 -0.18 -0.54 0.00 0.00 0.00 175.10 175.09 2oxg s LYS 23 N -0.06 2.44 -0.05 2.72 1.02 -0.42 -1.92 119.74 123.48 2oxg s LYS 23 Ca -0.02 -0.66 -0.00 0.00 0.02 0.00 0.00 55.97 55.31 2oxg s LYS 23 Cb -0.14 -1.92 0.03 0.00 -0.52 0.00 0.00 37.83 35.28 2oxg s LYS 23 CO 0.04 0.08 -0.01 0.00 -0.92 0.00 0.00 175.35 174.54 2oxg s ALA 24 N 0.57 0.53 0.09 5.17 0.00 0.14 -0.68 121.76 127.57 2oxg s ALA 24 Ca -0.15 0.01 0.08 0.00 0.00 0.00 0.00 51.96 51.90 2oxg s ALA 24 Cb -0.17 -0.52 -0.03 0.00 0.00 0.00 0.00 23.12 22.40 2oxg s ALA 24 CO 0.05 -0.23 -0.21 -1.17 0.00 0.00 0.00 175.76 174.20 2oxg s LEU 25 N 1.42 2.27 -0.01 0.00 1.98 0.23 -0.82 118.68 123.76 2oxg s LEU 25 Ca -0.04 -0.65 -0.03 0.00 -2.89 0.00 0.00 54.13 50.52 2oxg s LEU 25 Cb -0.13 -0.91 -0.00 0.00 0.66 0.00 0.00 46.19 45.81 2oxg s LEU 25 CO -0.03 0.08 0.06 -0.51 -1.89 0.00 0.00 176.35 174.07 2oxg s ILE 26 N -1.08 0.06 -0.14 6.68 2.07 -0.99 -0.51 121.20 127.29 2oxg s ILE 26 Ca 0.07 -0.46 -0.29 0.00 -1.41 0.00 0.00 60.65 58.56 2oxg s ILE 26 Cb -0.10 -0.24 -0.01 0.00 0.13 0.00 0.00 42.46 42.24 2oxg s ILE 26 CO 0.04 -0.25 1.07 -0.94 -1.91 0.00 0.00 174.94 172.95 2oxg s SER 27 N -0.78 7.14 -0.28 4.50 1.04 -0.85 -3.20 113.70 121.27 2oxg s SER 27 Ca -0.09 1.55 -0.20 0.00 0.48 0.00 0.00 55.95 57.69 2oxg s SER 27 Cb -0.05 -2.55 0.10 0.00 0.10 0.00 0.00 66.02 63.62 2oxg s SER 27 CO 0.00 -0.57 0.85 -2.28 0.98 0.00 0.00 173.24 172.22 2oxg s HIS 28 N 2.54 -0.74 0.41 5.02 5.04 -1.26 -4.03 115.29 122.26 2oxg s HIS 28 Ca 0.49 1.62 0.09 0.00 -1.54 0.00 0.00 55.06 55.71 2oxg s HIS 28 Cb -0.19 0.42 0.85 0.00 0.04 0.00 0.00 32.58 33.70 2oxg s HIS 28 CO 0.15 -0.36 1.99 0.87 -2.34 0.00 0.00 174.74 175.05 2oxg h LYS 29 N 5.62 0.35 -6.10 2.88 1.57 -1.94 0.08 116.57 119.02 2oxg h LYS 29 Ca -0.29 -0.05 -0.43 0.00 -1.87 0.00 0.00 60.65 58.02 2oxg h LYS 29 Cb 1.19 -0.06 0.04 0.00 0.08 0.00 0.00 32.23 33.48 2oxg h LYS 29 CO 0.13 0.34 -0.80 -1.33 -0.57 0.00 0.00 179.45 177.22 2oxg n MET 30 N -4.38 -5.32 -1.68 3.15 2.81 -1.26 -4.54 117.12 105.90 2oxg n MET 30 Ca 0.01 0.64 -0.46 0.00 -1.81 0.00 0.00 57.70 56.08 2oxg n MET 30 Cb 0.17 -5.33 -0.04 0.00 -0.71 0.00 0.00 33.22 27.31 2oxg n MET 30 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 2oxg n GLU 31 N -4.40 2.41 0.11 0.03 4.07 -1.03 -4.83 120.64 117.00 2oxg n GLU 31 Ca -0.20 0.88 0.05 0.00 -0.06 0.00 0.00 57.16 57.83 2oxg n GLU 31 Cb 0.63 -2.74 0.01 0.00 -0.06 0.00 0.00 31.44 29.28 2oxg n GLU 31 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 2oxg h SER 32 N 8.75 0.00 0.00 4.31 4.64 -1.86 -0.04 113.55 129.35 2oxg h SER 32 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2oxg h SER 32 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2oxg h SER 32 CO 0.94 0.33 0.00 0.61 -0.87 0.00 0.00 176.83 177.83 2oxg n GLY 33 N 1.25 0.57 0.01 -0.77 0.00 -1.24 -4.52 105.19 100.49 2oxg n GLY 33 Ca -0.02 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.10 2oxg n GLY 33 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2oxg n GLN 34 N -2.00 0.49 -2.90 1.61 1.13 -1.26 -4.61 117.38 109.84 2oxg n GLN 34 Ca 0.00 -0.13 -0.39 0.00 -1.94 0.00 0.00 57.00 54.53 2oxg n GLN 34 Cb 0.00 -1.50 -0.06 0.00 0.11 0.00 0.00 30.24 28.79 2oxg n GLN 34 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 2oxg s ARG 35 N -3.31 4.66 -0.12 -1.09 3.52 -1.26 -4.90 118.95 116.45 2oxg s ARG 35 Ca -0.03 1.27 -0.05 0.00 -0.13 0.00 0.00 55.73 56.79 2oxg s ARG 35 Cb 0.14 -3.25 -0.04 0.00 -1.56 0.00 0.00 34.95 30.25 2oxg s ARG 35 CO 0.87 0.54 0.08 0.15 -0.81 0.00 0.00 175.30 176.14 2oxg s LYS 36 N -1.20 3.38 0.06 5.12 1.02 -1.26 -0.24 119.74 126.61 2oxg s LYS 36 Ca 0.38 -0.26 -0.01 0.00 0.02 0.00 0.00 55.97 56.10 2oxg s LYS 36 Cb -0.24 -3.06 0.01 0.00 -0.52 0.00 0.00 37.83 34.03 2oxg s LYS 36 CO 0.28 0.66 0.06 -0.40 -0.92 0.00 0.00 175.35 175.04 2oxg n ASP 37 N 2.31 -0.48 -0.32 2.83 3.85 0.97 -4.84 116.55 120.87 2oxg n ASP 37 Ca -0.19 -0.80 0.02 0.00 -0.71 0.00 0.00 54.79 53.11 2oxg n ASP 37 Cb 0.54 -0.05 0.16 0.00 -1.35 0.00 0.00 41.12 40.42 2oxg n ASP 37 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2oxg h ALA 38 N -2.01 1.24 -0.45 2.12 0.00 -2.00 -1.68 119.26 116.49 2oxg h ALA 38 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2oxg h ALA 38 Cb 0.06 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2oxg h ALA 38 CO 0.02 0.26 0.00 -0.25 0.00 0.00 0.00 179.25 179.27 2oxg n ASP 39 N -4.63 3.48 0.00 0.00 8.00 -1.26 -4.90 116.55 117.24 2oxg n ASP 39 Ca 0.14 -2.32 0.00 0.00 0.71 0.00 0.00 54.79 53.31 2oxg n ASP 39 Cb 0.22 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 40.83 2oxg n ASP 39 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2oxg n GLY 40 N 0.86 0.61 3.83 0.44 0.00 -0.63 -5.03 105.19 105.27 2oxg n GLY 40 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 2oxg n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oxg s LYS 41 N -0.15 4.03 0.36 1.61 0.00 -1.26 -4.73 119.74 119.61 2oxg s LYS 41 Ca 0.00 0.55 -0.28 0.00 0.00 0.00 0.00 55.97 56.24 2oxg s LYS 41 Cb 0.00 -3.18 -0.10 0.00 0.00 0.00 0.00 37.83 34.54 2oxg s LYS 41 CO 0.00 0.64 1.37 -0.51 0.00 0.00 0.00 175.35 176.85 2oxg s LEU 42 N -1.23 4.36 -0.21 2.77 1.43 -1.26 -0.02 118.68 124.51 2oxg s LEU 42 Ca 0.28 2.81 -0.13 0.00 -1.03 0.00 0.00 54.13 56.06 2oxg s LEU 42 Cb -0.18 -3.70 -0.05 0.00 0.03 0.00 0.00 46.19 42.30 2oxg s LEU 42 CO 0.17 -0.70 0.26 -0.63 0.23 0.00 0.00 176.35 175.67 2oxg s ILE 43 N -1.15 5.30 0.53 -0.59 1.01 0.67 -4.83 121.20 122.14 2oxg s ILE 43 Ca 0.51 0.42 -0.22 0.00 0.00 0.00 0.00 60.65 61.37 2oxg s ILE 43 Cb -0.42 -3.60 -0.06 0.00 0.01 0.00 0.00 42.46 38.40 2oxg s ILE 43 CO 0.56 0.33 1.33 -2.65 0.00 0.00 0.00 174.94 174.51 2oxg n PRO 44 N 4.19 1.70 -1.72 2.79 -0.02 -1.26 -3.58 135.00 137.10 2oxg n PRO 44 Ca -0.12 0.62 -0.41 0.00 -2.02 0.00 0.00 63.50 61.57 2oxg n PRO 44 Cb 0.52 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 2oxg n PRO 44 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2oxg n ARG 45 N -0.87 2.22 -3.18 -0.52 0.63 -1.26 -4.35 116.66 109.32 2oxg n ARG 45 Ca 0.10 0.78 0.02 0.00 -0.92 0.00 0.00 57.85 57.83 2oxg n ARG 45 Cb 0.44 -2.46 -0.01 0.00 0.45 0.00 0.00 32.46 30.88 2oxg n ARG 45 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2oxg s SER 46 N -0.35 -1.20 0.34 6.15 0.15 -0.03 -4.91 113.70 113.86 2oxg s SER 46 Ca 0.57 0.28 0.05 0.00 0.70 0.00 0.00 55.95 57.56 2oxg s SER 46 Cb -0.52 1.90 -0.07 0.00 -1.71 0.00 0.00 66.02 65.62 2oxg s SER 46 CO 0.61 -0.30 0.02 0.27 1.20 0.00 0.00 173.24 175.04 2oxg s ILE 47 N 2.78 1.54 -0.03 6.45 -4.36 -1.26 -2.46 121.20 123.87 2oxg s ILE 47 Ca 0.13 -2.03 -0.30 0.00 -0.26 0.00 0.00 60.65 58.19 2oxg s ILE 47 Cb -0.12 -2.79 -0.04 0.00 1.25 0.00 0.00 42.46 40.76 2oxg s ILE 47 CO -0.25 -0.06 1.21 -0.63 0.24 0.00 0.00 174.94 175.46 2oxg s ILE 48 N -3.05 4.18 -1.60 8.37 1.01 -1.26 -0.34 121.20 128.51 2oxg s ILE 48 Ca 0.35 1.53 0.15 0.00 0.00 0.00 0.00 60.65 62.68 2oxg s ILE 48 Cb 0.08 -3.98 0.05 0.00 0.01 0.00 0.00 42.46 38.62 2oxg s ILE 48 CO 0.16 0.02 0.89 -0.46 0.00 0.00 0.00 174.94 175.55 2oxg n ASN 49 N 4.95 1.86 -3.61 3.58 0.23 0.40 -4.69 115.26 117.98 2oxg n ASN 49 Ca 0.11 -1.43 -0.13 0.00 -0.53 0.00 0.00 54.58 52.59 2oxg n ASN 49 Cb 0.46 0.27 -0.07 0.00 -2.08 0.00 0.00 39.78 38.36 2oxg n ASN 49 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 2oxg s ARG 50 N -1.57 0.79 -0.03 -3.83 3.52 -1.23 -0.80 118.95 115.80 2oxg s ARG 50 Ca 0.15 0.77 0.02 0.00 -0.13 0.00 0.00 55.73 56.54 2oxg s ARG 50 Cb 0.12 0.38 0.01 0.00 -1.56 0.00 0.00 34.95 33.91 2oxg s ARG 50 CO 0.29 -0.13 -0.07 0.12 -0.81 0.00 0.00 175.30 174.70 2oxg s PHE 51 N 0.05 0.87 0.08 5.12 5.36 -0.45 -0.93 117.98 128.07 2oxg s PHE 51 Ca -0.01 -0.23 0.07 0.00 -0.96 0.00 0.00 56.93 55.80 2oxg s PHE 51 Cb -0.04 -0.66 -0.03 0.00 -0.34 0.00 0.00 43.02 41.95 2oxg s PHE 51 CO 0.01 -0.13 -0.19 0.95 -1.46 0.00 0.00 175.22 174.39 2oxg s THR 52 N 0.45 1.55 -0.08 0.12 -4.23 0.22 -0.25 115.64 113.43 2oxg s THR 52 Ca -0.07 -1.38 0.01 0.00 -1.18 0.00 0.00 61.69 59.07 2oxg s THR 52 Cb -0.11 -1.41 0.02 0.00 1.34 0.00 0.00 72.50 72.34 2oxg s THR 52 CO 0.01 -0.02 -0.10 0.00 -0.54 0.00 0.00 174.62 173.96 2oxg s GLU 54 N 1.02 1.72 -0.22 0.00 2.02 -0.10 -0.03 118.70 123.13 2oxg s GLU 54 Ca -0.08 -1.17 -0.00 0.00 0.02 0.00 0.00 54.97 53.74 2oxg s GLU 54 Cb -0.15 -2.00 0.02 0.00 0.10 0.00 0.00 34.13 32.11 2oxg s GLU 54 CO -0.00 0.50 -0.13 -1.17 0.02 0.00 0.00 175.26 174.47 2oxg s LEU 55 N -1.59 2.70 -1.53 1.80 2.96 0.29 -0.67 118.68 122.64 2oxg s LEU 55 Ca 0.13 -0.77 -0.13 0.00 -0.22 0.00 0.00 54.13 53.14 2oxg s LEU 55 Cb -0.10 -1.58 0.09 0.00 0.50 0.00 0.00 46.19 45.10 2oxg s LEU 55 CO 0.04 -0.06 0.95 0.59 -1.32 0.00 0.00 176.35 176.55 2oxg n ASN 56 N 4.63 -4.44 0.00 3.68 5.03 -0.17 -1.55 115.26 122.45 2oxg n ASN 56 Ca -0.18 -0.80 0.00 0.00 0.87 0.00 0.00 54.58 54.46 2oxg n ASN 56 Cb 0.48 -3.80 0.00 0.00 -1.02 0.00 0.00 39.78 35.45 2oxg n ASN 56 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2oxg n GLY 57 N -1.67 0.98 3.41 7.41 0.00 -1.26 -5.02 105.19 109.04 2oxg n GLY 57 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 2oxg n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oxg s VAL 58 N -3.91 3.23 0.29 1.61 1.01 -0.59 -5.05 120.40 116.98 2oxg s VAL 58 Ca 0.00 -0.61 -0.29 0.00 0.00 0.00 0.00 61.98 61.08 2oxg s VAL 58 Cb 0.00 -2.36 -0.10 0.00 0.00 0.00 0.00 36.38 33.92 2oxg s VAL 58 CO 0.00 0.53 1.45 0.21 0.00 0.00 0.00 175.10 177.29 2oxg s ASN 59 N 0.19 6.58 -0.16 3.32 3.84 -1.26 -0.54 114.94 126.91 2oxg s ASN 59 Ca -0.07 2.78 -0.14 0.00 0.21 0.00 0.00 52.86 55.65 2oxg s ASN 59 Cb -0.15 -2.64 -0.05 0.00 -0.55 0.00 0.00 41.25 37.87 2oxg s ASN 59 CO 0.05 -0.73 -0.27 0.52 -2.79 0.00 0.00 177.10 173.87 2oxg n VAL 60 N 1.72 1.41 -4.14 -5.21 0.31 0.96 -4.85 118.33 108.53 2oxg n VAL 60 Ca 0.05 0.18 -0.09 0.00 -0.01 0.00 0.00 64.34 64.47 2oxg n VAL 60 Cb 0.40 -2.34 -0.10 0.00 -0.91 0.00 0.00 33.84 30.89 2oxg n VAL 60 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2oxg s VAL 61 N -2.58 0.53 -0.09 2.52 1.01 -1.11 -5.01 120.40 115.67 2oxg s VAL 61 Ca -0.22 -1.88 -0.03 0.00 0.00 0.00 0.00 61.98 59.85 2oxg s VAL 61 Cb 0.03 -1.61 0.04 0.00 0.00 0.00 0.00 36.38 34.84 2oxg s VAL 61 CO 0.33 -0.91 0.07 -0.62 0.00 0.00 0.00 175.10 173.97 2oxg s ASP 62 N -2.98 1.66 -0.18 3.32 -1.08 -1.26 -1.66 116.67 114.49 2oxg s ASP 62 Ca 0.10 -0.21 -0.01 0.00 -0.52 0.00 0.00 52.55 51.91 2oxg s ASP 62 Cb 0.06 -0.20 -0.00 0.00 -1.46 0.00 0.00 42.92 41.32 2oxg s ASP 62 CO -0.06 -0.29 -0.12 -0.69 0.52 0.00 0.00 175.17 174.53 2oxg s VAL 63 N 2.15 2.85 -0.23 1.11 1.01 0.66 -4.99 120.40 122.96 2oxg s VAL 63 Ca 0.04 -0.69 -0.22 0.00 0.00 0.00 0.00 61.98 61.11 2oxg s VAL 63 Cb -0.14 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.99 2oxg s VAL 63 CO -0.06 0.49 0.70 0.00 0.00 0.00 0.00 175.10 176.23 2oxg s ALA 64 N 1.04 3.59 -0.13 5.51 0.00 -1.26 -1.34 121.76 129.17 2oxg s ALA 64 Ca -0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 51.96 51.67 2oxg s ALA 64 Cb -0.15 -3.10 -0.02 0.00 0.00 0.00 0.00 23.12 19.85 2oxg s ALA 64 CO -0.03 -0.76 -0.08 0.42 0.00 0.00 0.00 175.76 175.32 2oxg s ILE 65 N 2.40 3.57 0.43 0.00 1.01 0.02 -4.96 121.20 123.66 2oxg s ILE 65 Ca 0.30 -0.48 0.07 0.00 0.00 0.00 0.00 60.65 60.54 2oxg s ILE 65 Cb -0.16 -2.52 -0.03 0.00 0.01 0.00 0.00 42.46 39.76 2oxg s ILE 65 CO 0.09 0.52 0.28 -1.81 0.00 0.00 0.00 174.94 174.02 2oxg s ASP 66 N 0.15 4.68 0.28 3.58 -0.00 -1.26 -4.49 116.67 119.61 2oxg s ASP 66 Ca -0.04 -0.98 0.20 0.00 -0.00 0.00 0.00 52.55 51.73 2oxg s ASP 66 Cb -0.14 -0.41 1.03 0.00 -0.00 0.00 0.00 42.92 43.40 2oxg s ASP 66 CO 0.04 -0.65 1.61 -2.65 -0.00 0.00 0.00 175.17 173.51 2oxg n PRO 67 N -1.41 0.13 0.00 8.23 -0.02 -1.26 -1.59 135.00 139.08 2oxg n PRO 67 Ca 0.00 0.59 0.14 0.00 -2.02 0.00 0.00 63.50 62.22 2oxg n PRO 67 Cb 0.63 -1.90 0.71 0.00 -0.02 0.00 0.00 33.50 32.93 2oxg n PRO 67 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2oxg n ALA 68 N -1.75 2.43 -1.77 3.55 0.00 -1.26 -4.75 120.51 116.96 2oxg n ALA 68 Ca -0.01 -0.13 -0.39 0.00 0.00 0.00 0.00 53.44 52.92 2oxg n ALA 68 Cb 0.06 -1.48 -0.02 0.00 0.00 0.00 0.00 19.45 18.01 2oxg n ALA 68 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2oxg s VAL 69 N -2.71 3.02 0.82 0.00 1.01 -0.62 -4.97 120.40 116.95 2oxg s VAL 69 Ca 0.24 0.90 -0.11 0.00 0.00 0.00 0.00 61.98 63.01 2oxg s VAL 69 Cb 0.20 -3.52 0.09 0.00 0.00 0.00 0.00 36.38 33.14 2oxg s VAL 69 CO 0.48 0.12 1.10 -0.94 0.00 0.00 0.00 175.10 175.86 2oxg s SER 70 N -0.95 3.98 0.30 3.32 1.04 -1.26 -4.97 113.70 115.17 2oxg s SER 70 Ca 0.55 1.86 -0.27 0.00 0.48 0.00 0.00 55.95 58.57 2oxg s SER 70 Cb -0.33 -2.49 -0.14 0.00 0.10 0.00 0.00 66.02 63.16 2oxg s SER 70 CO 0.43 -2.37 0.77 0.41 0.98 0.00 0.00 173.24 173.45 2oxg n THR 71 N -3.74 1.95 -3.23 2.02 -1.04 -1.26 -3.25 114.28 105.73 2oxg n THR 71 Ca 0.09 -0.50 -0.08 0.00 -2.04 0.00 0.00 64.05 61.53 2oxg n THR 71 Cb 0.53 -0.63 0.01 0.00 -1.82 0.00 0.00 70.33 68.42 2oxg n THR 71 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2oxg n ASN 72 N 1.42 -7.07 -4.73 8.00 3.02 0.02 -4.83 115.26 111.08 2oxg n ASN 72 Ca 0.12 -0.35 -0.42 0.00 -0.03 0.00 0.00 54.58 53.90 2oxg n ASN 72 Cb 0.32 -4.68 -0.01 0.00 -0.61 0.00 0.00 39.78 34.81 2oxg n ASN 72 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2oxg n PRO 73 N -2.27 2.40 -4.82 3.52 -0.04 -1.19 -4.60 135.00 128.00 2oxg n PRO 73 Ca -0.06 0.84 -0.27 0.00 -0.04 0.00 0.00 63.50 63.97 2oxg n PRO 73 Cb 0.55 -2.51 -0.17 0.00 -0.04 0.00 0.00 33.50 31.33 2oxg n PRO 73 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 2oxg s TYR 74 N -0.90 1.80 -0.01 0.54 5.04 -1.26 -2.34 117.35 120.22 2oxg s TYR 74 Ca 0.56 -0.64 0.03 0.00 -2.44 0.00 0.00 57.07 54.58 2oxg s TYR 74 Cb -0.53 -1.25 -0.01 0.00 0.35 0.00 0.00 41.96 40.52 2oxg s TYR 74 CO 0.60 -0.28 -0.08 -0.06 -1.34 0.00 0.00 175.55 174.39 2oxg s PHE 75 N 0.39 0.74 -0.00 4.97 0.40 0.00 -5.00 117.98 119.49 2oxg s PHE 75 Ca -0.12 -0.14 0.03 0.00 -0.60 0.00 0.00 56.93 56.09 2oxg s PHE 75 Cb -0.15 -0.48 -0.01 0.00 0.51 0.00 0.00 43.02 42.89 2oxg s PHE 75 CO 0.05 -0.01 -0.09 -2.00 0.70 0.00 0.00 175.22 173.86 2oxg s GLU 76 N -0.18 0.72 0.16 0.44 2.12 -1.26 -0.69 118.70 120.01 2oxg s GLU 76 Ca 0.03 -0.36 -0.23 0.00 0.36 0.00 0.00 54.97 54.78 2oxg s GLU 76 Cb -0.03 -0.69 0.08 0.00 0.26 0.00 0.00 34.13 33.75 2oxg s GLU 76 CO -0.00 0.19 1.06 -0.59 -0.54 0.00 0.00 175.26 175.38 2oxg s PHE 77 N -0.29 0.06 -0.06 5.30 -0.12 -0.81 -5.01 117.98 117.06 2oxg s PHE 77 Ca 0.03 -0.42 0.03 0.00 -0.05 0.00 0.00 56.93 56.51 2oxg s PHE 77 Cb -0.04 0.68 0.01 0.00 -0.63 0.00 0.00 43.02 43.04 2oxg s PHE 77 CO -0.00 -0.85 -0.13 -0.51 -0.05 0.00 0.00 175.22 173.68 2oxg s ASP 78 N -3.43 1.85 0.04 1.98 1.01 -1.26 -0.55 116.67 116.32 2oxg s ASP 78 Ca 0.22 -0.31 0.06 0.00 0.71 0.00 0.00 52.55 53.23 2oxg s ASP 78 Cb -0.02 -0.79 -0.03 0.00 1.01 0.00 0.00 42.92 43.09 2oxg s ASP 78 CO 0.04 0.06 -0.11 0.00 0.21 0.00 0.00 175.17 175.37 2oxg s ALA 79 N 0.53 2.87 -0.30 5.23 0.00 -0.09 -4.95 121.76 125.05 2oxg s ALA 79 Ca -0.13 -1.14 -0.16 0.00 0.00 0.00 0.00 51.96 50.54 2oxg s ALA 79 Cb -0.15 -0.94 -0.02 0.00 0.00 0.00 0.00 23.12 22.01 2oxg s ALA 79 CO 0.04 0.61 0.43 0.21 0.00 0.00 0.00 175.76 177.05 2oxg s LYS 80 N -1.65 3.85 -0.55 0.00 2.20 -1.26 -0.88 119.74 121.45 2oxg s LYS 80 Ca 0.18 -0.04 -0.16 0.00 -0.36 0.00 0.00 55.97 55.58 2oxg s LYS 80 Cb -0.11 -3.72 0.13 0.00 -1.51 0.00 0.00 37.83 32.62 2oxg s LYS 80 CO 0.09 -0.43 0.53 0.08 -0.36 0.00 0.00 175.35 175.26 2oxg s VAL 81 N 2.18 5.16 -0.17 4.02 1.01 -0.33 -4.89 120.40 127.39 2oxg s VAL 81 Ca 0.16 -1.45 0.18 0.00 0.00 0.00 0.00 61.98 60.88 2oxg s VAL 81 Cb -0.16 -4.36 -0.06 0.00 0.00 0.00 0.00 36.38 31.80 2oxg s VAL 81 CO 0.11 -0.90 0.99 0.44 0.00 0.00 0.00 175.10 175.73 2oxg h ASP 82 N 8.92 0.00 -5.00 3.32 3.32 -1.89 0.20 116.42 125.29 2oxg h ASP 82 Ca -0.30 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.73 2oxg h ASP 82 Cb 1.10 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.52 2oxg h ASP 82 CO 1.05 0.40 0.20 0.00 -1.72 0.00 0.00 179.24 179.17 2oxg s ALA 83 N -3.05 -1.60 0.73 3.45 0.00 -1.26 -4.44 121.76 115.60 2oxg s ALA 83 Ca -0.01 0.56 -0.15 0.00 0.00 0.00 0.00 51.96 52.36 2oxg s ALA 83 Cb 0.09 0.79 0.04 0.00 0.00 0.00 0.00 23.12 24.03 2oxg s ALA 83 CO 0.79 -0.72 1.24 0.00 0.00 0.00 0.00 175.76 177.07 2oxg s ALA 84 N -3.48 2.10 0.00 0.00 0.00 -1.26 -4.86 121.76 114.26 2oxg s ALA 84 Ca -0.00 0.99 0.00 0.00 0.00 0.00 0.00 51.96 52.95 2oxg s ALA 84 Cb -0.01 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.60 2oxg s ALA 84 CO -0.11 -1.95 0.00 0.41 0.00 0.00 0.00 175.76 174.12 2oxg n GLY 85 N 0.62 -0.57 3.37 0.00 0.00 -0.11 -5.00 105.19 103.50 2oxg n GLY 85 Ca 0.14 0.07 -0.15 0.00 0.00 0.00 0.00 46.02 46.08 2oxg n GLY 85 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2oxg s GLU 86 N 0.00 0.90 0.05 1.61 -1.05 -1.26 -0.66 118.70 118.29 2oxg s GLU 86 Ca 0.00 -0.10 -0.19 0.00 -0.15 0.00 0.00 54.97 54.53 2oxg s GLU 86 Cb 0.00 0.41 -0.06 0.00 -0.44 0.00 0.00 34.13 34.04 2oxg s GLU 86 CO 0.00 -0.29 0.54 -0.06 0.95 0.00 0.00 175.26 176.40 2oxg s PHE 87 N -1.73 3.77 -0.12 4.83 0.40 0.29 -1.00 117.98 124.42 2oxg s PHE 87 Ca -0.10 1.21 0.03 0.00 -0.60 0.00 0.00 56.93 57.47 2oxg s PHE 87 Cb -0.02 -2.48 0.01 0.00 0.51 0.00 0.00 43.02 41.04 2oxg s PHE 87 CO 0.04 0.56 -0.20 0.21 0.70 0.00 0.00 175.22 176.52 2oxg s LYS 88 N -0.95 2.73 -0.11 0.44 2.20 0.15 -1.25 119.74 122.95 2oxg s LYS 88 Ca 0.28 -0.75 -0.00 0.00 -0.36 0.00 0.00 55.97 55.13 2oxg s LYS 88 Cb -0.19 -2.21 -0.02 0.00 -1.51 0.00 0.00 37.83 33.90 2oxg s LYS 88 CO 0.18 0.01 -0.09 -0.06 -0.36 0.00 0.00 175.35 175.02 2oxg s PHE 89 N 0.77 2.88 -0.04 4.03 0.40 0.51 -0.92 117.98 125.62 2oxg s PHE 89 Ca -0.09 -0.34 0.01 0.00 -0.60 0.00 0.00 56.93 55.92 2oxg s PHE 89 Cb -0.16 -1.81 0.02 0.00 0.51 0.00 0.00 43.02 41.57 2oxg s PHE 89 CO 0.00 0.01 -0.05 0.99 0.70 0.00 0.00 175.22 176.87 2oxg s THR 90 N -0.06 0.57 -0.05 0.64 2.01 -0.28 -1.24 115.64 117.24 2oxg s THR 90 Ca -0.01 -0.18 0.07 0.00 0.31 0.00 0.00 61.69 61.88 2oxg s THR 90 Cb -0.14 -0.57 -0.01 0.00 0.01 0.00 0.00 72.50 71.79 2oxg s THR 90 CO 0.03 0.22 -0.25 0.26 -0.69 0.00 0.00 174.62 174.19 2oxg s TRP 91 N 0.68 2.39 -0.22 4.92 0.51 0.16 -0.61 118.94 126.76 2oxg s TRP 91 Ca -0.09 -0.64 -0.04 0.00 -2.12 0.00 0.00 56.10 53.20 2oxg s TRP 91 Cb -0.12 -1.56 -0.01 0.00 -0.81 0.00 0.00 33.47 30.96 2oxg s TRP 91 CO 0.00 -0.17 -0.03 0.71 -0.51 0.00 0.00 176.95 176.96 2oxg s TYR 92 N -0.28 2.97 0.10 -1.98 1.51 -0.11 -0.84 117.35 118.73 2oxg s TYR 92 Ca -0.00 -0.86 -0.18 0.00 -1.01 0.00 0.00 57.07 55.02 2oxg s TYR 92 Cb -0.13 -2.12 -0.07 0.00 -0.11 0.00 0.00 41.96 39.53 2oxg s TYR 92 CO 0.02 -0.52 0.58 0.34 -1.11 0.00 0.00 175.55 174.87 2oxg s ASP 93 N 1.48 7.02 0.48 2.29 3.68 -0.27 -0.45 116.67 130.89 2oxg s ASP 93 Ca 0.06 1.24 0.28 0.00 2.13 0.00 0.00 52.55 56.26 2oxg s ASP 93 Cb -0.14 -2.35 1.35 0.00 -1.45 0.00 0.00 42.92 40.33 2oxg s ASP 93 CO -0.02 0.22 1.79 0.44 0.13 0.00 0.00 175.17 177.73 2oxg h ASP 94 N 4.24 0.20 -0.01 -0.34 3.32 -0.99 -1.09 116.42 121.74 2oxg h ASP 94 Ca -0.49 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2oxg h ASP 94 Cb 1.21 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2oxg h ASP 94 CO 0.64 0.03 0.00 -0.90 -1.72 0.00 0.00 179.24 177.29 2oxg n ASP 95 N -4.39 0.13 0.00 6.45 5.68 -1.26 -4.86 116.55 118.29 2oxg n ASP 95 Ca 0.25 -1.39 0.00 0.00 -0.50 0.00 0.00 54.79 53.15 2oxg n ASP 95 Cb 1.07 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 41.04 2oxg n ASP 95 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2oxg n GLY 96 N 0.84 0.66 3.78 6.12 0.00 -0.41 -4.96 105.19 111.22 2oxg n GLY 96 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 2oxg n GLY 96 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2oxg s SER 97 N -2.17 5.23 -0.06 1.61 0.01 -1.26 -4.86 113.70 112.20 2oxg s SER 97 Ca 0.00 1.96 0.02 0.00 1.31 0.00 0.00 55.95 59.23 2oxg s SER 97 Cb 0.00 -2.55 0.02 0.00 0.21 0.00 0.00 66.02 63.70 2oxg s SER 97 CO 0.00 -1.55 -0.09 -0.69 0.41 0.00 0.00 173.24 171.32 2oxg s VAL 98 N -2.38 0.94 -0.01 3.43 1.01 -1.26 -1.11 120.40 121.02 2oxg s VAL 98 Ca 0.66 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 62.32 2oxg s VAL 98 Cb -0.19 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.26 2oxg s VAL 98 CO 0.41 0.32 -0.08 -0.31 0.00 0.00 0.00 175.10 175.44 2oxg s TYR 99 N 0.83 2.85 0.04 5.22 2.02 -0.02 -4.97 117.35 123.32 2oxg s TYR 99 Ca -0.12 -0.06 0.00 0.00 -0.37 0.00 0.00 57.07 56.53 2oxg s TYR 99 Cb -0.15 -1.61 -0.03 0.00 -0.40 0.00 0.00 41.96 39.77 2oxg s TYR 99 CO 0.02 0.34 -0.04 -1.21 -1.57 0.00 0.00 175.55 173.09 2oxg s GLU 100 N -1.29 0.45 -0.05 -0.62 2.02 -1.26 -0.67 118.70 117.29 2oxg s GLU 100 Ca 0.16 -0.80 -0.09 0.00 0.02 0.00 0.00 54.97 54.26 2oxg s GLU 100 Cb -0.11 0.02 0.02 0.00 0.10 0.00 0.00 34.13 34.16 2oxg s GLU 100 CO 0.06 -0.04 0.22 0.34 0.02 0.00 0.00 175.26 175.86 2oxg s ASP 101 N -1.86 -0.15 0.00 -0.19 3.68 -0.37 -4.94 116.67 112.84 2oxg s ASP 101 Ca -0.09 0.19 0.05 0.00 2.13 0.00 0.00 52.55 54.83 2oxg s ASP 101 Cb -0.06 0.36 -0.02 0.00 -1.45 0.00 0.00 42.92 41.76 2oxg s ASP 101 CO -0.03 -0.24 -0.17 -0.69 0.13 0.00 0.00 175.17 174.17 2oxg s VAL 102 N -0.62 1.34 -0.07 1.11 1.01 -1.26 -0.37 120.40 121.55 2oxg s VAL 102 Ca -0.07 -0.81 -0.00 0.00 0.00 0.00 0.00 61.98 61.10 2oxg s VAL 102 Cb -0.04 -1.13 0.02 0.00 0.00 0.00 0.00 36.38 35.23 2oxg s VAL 102 CO 0.01 0.31 -0.03 -0.75 0.00 0.00 0.00 175.10 174.65 2oxg s LYS 103 N -0.57 0.82 0.56 2.72 2.47 -0.38 -4.99 119.74 120.37 2oxg s LYS 103 Ca 0.06 -0.03 -0.17 0.00 -1.56 0.00 0.00 55.97 54.27 2oxg s LYS 103 Cb -0.07 -1.00 -0.05 0.00 -1.46 0.00 0.00 37.83 35.26 2oxg s LYS 103 CO -0.00 -0.20 1.07 -1.25 0.16 0.00 0.00 175.35 175.12 2oxg s PRO 104 N 1.50 3.39 -0.01 4.03 0.04 -1.26 -0.55 135.00 142.13 2oxg s PRO 104 Ca -0.02 1.34 0.01 0.00 0.04 0.00 0.00 61.00 62.36 2oxg s PRO 104 Cb -0.13 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.39 2oxg s PRO 104 CO -0.03 -0.77 -0.01 -1.50 0.04 0.00 0.00 177.00 174.72 2oxg s ILE 105 N -2.20 0.18 0.11 0.56 2.07 0.17 -4.75 121.20 117.33 2oxg s ILE 105 Ca 0.66 -0.01 -0.01 0.00 -1.41 0.00 0.00 60.65 59.88 2oxg s ILE 105 Cb -0.18 -0.21 -0.04 0.00 0.13 0.00 0.00 42.46 42.15 2oxg s ILE 105 CO 0.31 0.10 0.28 0.00 -1.91 0.00 0.00 174.94 173.72 2oxg s ALA 106 N 0.45 3.93 0.11 1.50 0.00 0.24 -0.94 121.76 127.06 2oxg s ALA 106 Ca -0.04 -0.79 0.10 0.00 0.00 0.00 0.00 51.96 51.23 2oxg s ALA 106 Cb -0.07 -1.92 -0.04 0.00 0.00 0.00 0.00 23.12 21.10 2oxg s ALA 106 CO -0.01 0.72 -0.25 0.08 0.00 0.00 0.00 175.76 176.29 2oxg s VAL 107 N -1.61 2.35 0.00 0.00 1.01 -1.26 -1.20 120.40 119.69 2oxg s VAL 107 Ca 0.37 -1.65 0.00 0.00 0.00 0.00 0.00 61.98 60.70 2oxg s VAL 107 Cb -0.12 -2.03 0.00 0.00 0.00 0.00 0.00 36.38 34.23 2oxg s VAL 107 CO 0.27 0.14 0.00 0.00 0.00 0.00 0.00 175.10 175.51