#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b0w s ILE 2 N 0.00 4.80 -0.12 5.18 1.01 -1.26 -5.01 121.20 125.79 1b0w s ILE 2 Ca 0.00 1.88 -0.15 0.00 0.00 0.00 0.00 60.65 62.38 1b0w s ILE 2 Cb 0.00 -4.24 -0.05 0.00 0.01 0.00 0.00 42.46 38.18 1b0w s ILE 2 CO 0.00 -0.03 0.37 -1.58 0.00 0.00 0.00 174.94 173.70 1b0w s GLN 3 N 2.34 4.20 -0.14 2.79 2.00 -1.26 -4.75 119.66 124.84 1b0w s GLN 3 Ca 0.43 0.26 -0.00 0.00 -2.00 0.00 0.00 55.36 54.05 1b0w s GLN 3 Cb -0.17 -3.39 -0.01 0.00 0.80 0.00 0.00 33.01 30.24 1b0w s GLN 3 CO 0.13 0.31 -0.13 -1.64 -0.50 0.00 0.00 175.29 173.46 1b0w s MET 4 N 0.20 3.36 -0.20 1.67 -1.94 -1.26 -0.82 119.30 120.31 1b0w s MET 4 Ca 0.21 -0.69 -0.01 0.00 -1.71 0.00 0.00 55.69 53.48 1b0w s MET 4 Cb -0.14 -2.65 0.00 0.00 2.01 0.00 0.00 34.83 34.05 1b0w s MET 4 CO 0.08 0.16 -0.12 0.99 -0.01 0.00 0.00 175.02 176.11 1b0w s THR 5 N 0.49 2.73 0.05 2.05 2.01 -0.09 -4.47 115.64 118.40 1b0w s THR 5 Ca -0.09 -0.71 0.08 0.00 0.31 0.00 0.00 61.69 61.28 1b0w s THR 5 Cb -0.16 -2.20 -0.03 0.00 0.01 0.00 0.00 72.50 70.12 1b0w s THR 5 CO 0.04 0.48 -0.22 -1.58 -0.69 0.00 0.00 174.62 172.66 1b0w s GLN 6 N 1.33 1.92 -0.04 4.92 0.74 -1.26 -0.18 119.66 127.09 1b0w s GLN 6 Ca 0.04 -1.05 -0.07 0.00 0.05 0.00 0.00 55.36 54.33 1b0w s GLN 6 Cb -0.14 -2.09 0.01 0.00 1.10 0.00 0.00 33.01 31.90 1b0w s GLN 6 CO -0.07 0.52 0.17 0.45 -0.55 0.00 0.00 175.29 175.81 1b0w s SER 7 N -1.38 -0.11 0.86 6.67 0.15 0.54 -4.69 113.70 115.74 1b0w s SER 7 Ca 0.13 0.14 -0.09 0.00 0.70 0.00 0.00 55.95 56.84 1b0w s SER 7 Cb -0.10 0.31 0.18 0.00 -1.71 0.00 0.00 66.02 64.69 1b0w s SER 7 CO 0.04 -0.19 1.18 -2.84 1.20 0.00 0.00 173.24 172.63 1b0w s PRO 8 N -0.50 1.02 0.20 5.44 0.02 -1.26 -1.01 135.00 138.90 1b0w s PRO 8 Ca -0.06 -0.81 0.08 0.00 0.02 0.00 0.00 61.00 60.23 1b0w s PRO 8 Cb -0.04 -2.07 0.07 0.00 0.02 0.00 0.00 34.50 32.49 1b0w s PRO 8 CO 0.01 -2.03 1.44 0.77 -0.33 0.00 0.00 177.00 176.86 1b0w h SER 9 N -1.16 0.03 -4.22 2.53 0.02 -1.84 -3.39 113.55 105.52 1b0w h SER 9 Ca -0.40 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1b0w h SER 9 Cb 1.24 -0.01 -0.22 0.00 0.14 0.00 0.00 62.40 63.55 1b0w h SER 9 CO 0.37 0.83 0.32 -0.94 -1.14 0.00 0.00 176.83 176.26 1b0w s SER 10 N -6.80 -0.56 0.18 3.07 1.04 -1.26 -1.26 113.70 108.11 1b0w s SER 10 Ca -0.01 0.82 -0.06 0.00 0.48 0.00 0.00 55.95 57.19 1b0w s SER 10 Cb 0.11 0.74 -0.02 0.00 0.10 0.00 0.00 66.02 66.95 1b0w s SER 10 CO 0.79 -0.38 0.23 -1.48 0.98 0.00 0.00 173.24 173.39 1b0w s LEU 11 N -0.56 1.06 -0.03 2.42 -0.00 -0.21 -4.91 118.68 116.45 1b0w s LEU 11 Ca -0.04 -1.07 0.00 0.00 -0.00 0.00 0.00 54.13 53.02 1b0w s LEU 11 Cb -0.02 0.92 0.03 0.00 -0.00 0.00 0.00 46.19 47.11 1b0w s LEU 11 CO 0.03 -0.89 0.01 -0.44 -0.00 0.00 0.00 176.35 175.06 1b0w s SER 12 N -3.04 0.33 0.23 1.48 0.01 -1.26 -1.46 113.70 109.99 1b0w s SER 12 Ca 0.25 -0.00 0.01 0.00 1.31 0.00 0.00 55.95 57.51 1b0w s SER 12 Cb 0.04 -0.17 -0.04 0.00 0.21 0.00 0.00 66.02 66.06 1b0w s SER 12 CO 0.05 -0.11 0.15 0.00 0.41 0.00 0.00 173.24 173.73 1b0w s ALA 13 N 1.07 1.36 0.29 1.44 0.00 -1.01 -4.78 121.76 120.14 1b0w s ALA 13 Ca -0.09 -1.77 -0.02 0.00 0.00 0.00 0.00 51.96 50.08 1b0w s ALA 13 Cb -0.13 1.36 -0.04 0.00 0.00 0.00 0.00 23.12 24.31 1b0w s ALA 13 CO -0.02 -0.58 0.51 -1.12 0.00 0.00 0.00 175.76 174.55 1b0w s SER 14 N -3.22 6.38 0.29 0.00 0.01 -1.26 0.73 113.70 116.63 1b0w s SER 14 Ca 0.39 0.54 -0.30 0.00 1.31 0.00 0.00 55.95 57.89 1b0w s SER 14 Cb 0.06 -2.07 -0.12 0.00 0.21 0.00 0.00 66.02 64.10 1b0w s SER 14 CO 0.15 -0.19 1.56 1.33 0.41 0.00 0.00 173.24 176.49 1b0w n VAL 15 N -1.18 1.07 0.00 3.43 0.24 -1.26 -1.06 118.33 119.58 1b0w n VAL 15 Ca -0.04 -0.27 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 1b0w n VAL 15 Cb 0.55 -1.89 0.00 0.00 -1.47 0.00 0.00 33.84 31.03 1b0w n VAL 15 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1b0w n GLY 16 N 2.06 2.69 3.75 7.63 0.00 0.14 -4.87 105.19 116.59 1b0w n GLY 16 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 1b0w n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1b0w s ASP 17 N 0.09 4.56 0.10 1.61 1.01 -0.22 -4.05 116.67 119.76 1b0w s ASP 17 Ca 0.00 2.04 -0.19 0.00 0.71 0.00 0.00 52.55 55.11 1b0w s ASP 17 Cb 0.00 -2.55 -0.07 0.00 1.01 0.00 0.00 42.92 41.31 1b0w s ASP 17 CO 0.00 -2.00 0.58 -0.60 0.21 0.00 0.00 175.17 173.36 1b0w s ARG 18 N -4.33 4.17 -0.06 8.23 3.52 -1.24 -0.65 118.95 128.59 1b0w s ARG 18 Ca 0.67 0.71 0.03 0.00 -0.13 0.00 0.00 55.73 57.01 1b0w s ARG 18 Cb -0.21 -3.15 0.01 0.00 -1.56 0.00 0.00 34.95 30.03 1b0w s ARG 18 CO 0.48 0.59 -0.13 0.08 -0.81 0.00 0.00 175.30 175.51 1b0w s VAL 19 N -1.21 1.16 -0.08 7.11 1.01 0.12 -4.98 120.40 123.53 1b0w s VAL 19 Ca 0.32 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 61.82 1b0w s VAL 19 Cb -0.19 -1.05 0.00 0.00 0.00 0.00 0.00 36.38 35.15 1b0w s VAL 19 CO 0.19 0.36 -0.18 -0.89 0.00 0.00 0.00 175.10 174.58 1b0w s THR 20 N 0.55 1.60 0.04 3.92 2.01 -1.26 -0.37 115.64 122.13 1b0w s THR 20 Ca -0.13 -0.76 0.06 0.00 0.31 0.00 0.00 61.69 61.17 1b0w s THR 20 Cb -0.15 -1.41 -0.02 0.00 0.01 0.00 0.00 72.50 70.93 1b0w s THR 20 CO 0.03 0.46 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.62 1b0w s ILE 21 N 0.43 1.37 0.14 1.82 1.01 -0.11 -4.77 121.20 121.10 1b0w s ILE 21 Ca -0.15 -1.06 0.07 0.00 0.00 0.00 0.00 60.65 59.51 1b0w s ILE 21 Cb -0.16 -1.21 -0.04 0.00 0.01 0.00 0.00 42.46 41.06 1b0w s ILE 21 CO 0.06 0.12 -0.16 0.42 0.00 0.00 0.00 174.94 175.38 1b0w s THR 22 N -0.79 1.56 -0.03 2.92 -4.23 -0.18 -0.58 115.64 114.32 1b0w s THR 22 Ca 0.05 -1.82 0.00 0.00 -1.18 0.00 0.00 61.69 58.74 1b0w s THR 22 Cb -0.08 -1.69 0.03 0.00 1.34 0.00 0.00 72.50 72.10 1b0w s THR 22 CO 0.01 -0.37 0.01 0.00 -0.54 0.00 0.00 174.62 173.74 1b0w s GLN 24 N 1.14 2.64 -0.06 0.00 -0.21 0.75 -0.24 119.66 123.67 1b0w s GLN 24 Ca -0.08 -0.63 0.01 0.00 0.02 0.00 0.00 55.36 54.68 1b0w s GLN 24 Cb -0.13 -2.53 -0.03 0.00 1.00 0.00 0.00 33.01 31.32 1b0w s GLN 24 CO -0.02 0.64 -0.07 0.00 -2.12 0.00 0.00 175.29 173.71 1b0w s ALA 25 N -0.87 2.98 -1.53 6.09 0.00 0.40 -0.92 121.76 127.92 1b0w s ALA 25 Ca 0.14 -0.90 0.13 0.00 0.00 0.00 0.00 51.96 51.33 1b0w s ALA 25 Cb -0.11 -1.22 0.68 0.00 0.00 0.00 0.00 23.12 22.47 1b0w s ALA 25 CO 0.03 0.58 1.31 -1.13 0.00 0.00 0.00 175.76 176.55 1b0w n SER 26 N 2.17 0.00 -3.64 0.00 3.41 0.00 -4.72 113.62 110.84 1b0w n SER 26 Ca -0.18 0.01 -0.10 0.00 -0.26 0.00 0.00 58.87 58.34 1b0w n SER 26 Cb 0.53 -0.24 -0.03 0.00 -0.26 0.00 0.00 64.21 64.21 1b0w n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1b0w s GLN 27 N -2.47 1.33 -0.23 4.33 -2.07 -1.26 -4.93 119.66 114.35 1b0w s GLN 27 Ca 0.14 -0.73 -0.29 0.00 -1.82 0.00 0.00 55.36 52.66 1b0w s GLN 27 Cb 0.09 0.54 -0.03 0.00 -1.09 0.00 0.00 33.01 32.51 1b0w s GLN 27 CO 0.19 -0.57 1.87 0.34 -1.32 0.00 0.00 175.29 175.80 1b0w s ASP 28 N -2.83 5.98 -0.18 12.60 2.15 -1.26 -4.69 116.67 128.44 1b0w s ASP 28 Ca 0.06 1.67 0.10 0.00 0.43 0.00 0.00 52.55 54.81 1b0w s ASP 28 Cb -0.01 -2.52 0.61 0.00 -0.30 0.00 0.00 42.92 40.70 1b0w s ASP 28 CO -0.07 -1.58 1.44 2.30 -0.17 0.00 0.00 175.17 177.10 1b0w n ILE 29 N 7.03 2.08 -4.22 4.11 -5.35 -1.07 -4.95 119.36 116.99 1b0w n ILE 29 Ca 0.23 -1.05 -0.37 0.00 -0.27 0.00 0.00 62.75 61.29 1b0w n ILE 29 Cb 0.45 -0.34 -0.03 0.00 -1.74 0.00 0.00 39.64 37.98 1b0w n ILE 29 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1b0w n SER 30 N 0.45 -3.16 -0.03 7.28 7.64 -1.26 -0.66 113.62 123.88 1b0w n SER 30 Ca 0.21 -1.00 -0.00 0.00 1.01 0.00 0.00 58.87 59.09 1b0w n SER 30 Cb 0.97 -2.60 -0.00 0.00 -1.01 0.00 0.00 64.21 61.57 1b0w n SER 30 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1b0w n ASP 31 N -2.60 -4.93 -4.16 6.43 8.00 -1.26 -4.90 116.55 113.12 1b0w n ASP 31 Ca 0.08 0.01 -0.43 0.00 0.71 0.00 0.00 54.79 55.17 1b0w n ASP 31 Cb 0.48 -2.47 0.00 0.00 -0.02 0.00 0.00 41.12 39.12 1b0w n ASP 31 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1b0w n TYR 32 N -2.36 4.07 -4.49 1.24 4.01 0.16 -2.36 117.16 117.44 1b0w n TYR 32 Ca -0.00 -2.95 -0.21 0.00 -0.16 0.00 0.00 57.90 54.58 1b0w n TYR 32 Cb 0.33 -2.48 -0.14 0.00 -0.31 0.00 0.00 39.34 36.74 1b0w n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1b0w s LEU 33 N 2.64 2.07 0.03 7.72 2.96 -1.26 -1.93 118.68 130.91 1b0w s LEU 33 Ca 0.48 -0.30 0.06 0.00 -0.22 0.00 0.00 54.13 54.16 1b0w s LEU 33 Cb 0.08 -0.62 -0.02 0.00 0.50 0.00 0.00 46.19 46.12 1b0w s LEU 33 CO -0.00 0.11 -0.17 -0.51 -1.32 0.00 0.00 176.35 174.46 1b0w s ILE 34 N -0.47 1.37 -0.13 6.68 -1.16 -0.05 -0.36 121.20 127.08 1b0w s ILE 34 Ca 0.04 -1.02 -0.01 0.00 -0.51 0.00 0.00 60.65 59.14 1b0w s ILE 34 Cb -0.06 -1.20 -0.02 0.00 0.61 0.00 0.00 42.46 41.80 1b0w s ILE 34 CO 0.00 0.15 -0.10 0.26 -2.81 0.00 0.00 174.94 172.44 1b0w s TRP 35 N -0.74 2.87 0.36 3.50 0.52 -0.21 -0.75 118.94 124.49 1b0w s TRP 35 Ca 0.05 -0.50 0.08 0.00 0.02 0.00 0.00 56.10 55.75 1b0w s TRP 35 Cb -0.08 -1.86 -0.06 0.00 -1.15 0.00 0.00 33.47 30.33 1b0w s TRP 35 CO 0.01 -0.12 0.04 0.71 0.02 0.00 0.00 176.95 177.61 1b0w s TYR 36 N 0.25 2.55 -0.06 -1.98 2.02 0.16 -1.68 117.35 118.61 1b0w s TYR 36 Ca -0.07 -0.50 0.03 0.00 -0.37 0.00 0.00 57.07 56.16 1b0w s TYR 36 Cb -0.15 -1.62 0.00 0.00 -0.40 0.00 0.00 41.96 39.79 1b0w s TYR 36 CO 0.05 0.42 -0.16 -1.14 -1.57 0.00 0.00 175.55 173.14 1b0w s GLN 37 N -3.75 1.96 -0.29 -0.62 0.74 0.26 -2.47 119.66 115.50 1b0w s GLN 37 Ca 0.36 -0.57 0.00 0.00 0.05 0.00 0.00 55.36 55.21 1b0w s GLN 37 Cb 0.02 -1.61 0.09 0.00 1.10 0.00 0.00 33.01 32.60 1b0w s GLN 37 CO 0.20 0.14 0.04 -1.14 -0.55 0.00 0.00 175.29 173.98 1b0w s GLN 38 N 0.36 1.10 0.59 1.67 0.74 0.54 0.61 119.66 125.27 1b0w s GLN 38 Ca -0.11 -1.18 -0.14 0.00 0.05 0.00 0.00 55.36 53.99 1b0w s GLN 38 Cb -0.14 -2.42 -0.05 0.00 1.10 0.00 0.00 33.01 31.50 1b0w s GLN 38 CO 0.04 -0.85 1.02 0.15 -0.55 0.00 0.00 175.29 175.10 1b0w s LYS 39 N 1.42 3.60 -0.35 1.67 1.02 -1.26 -1.64 119.74 124.20 1b0w s LYS 39 Ca 0.05 0.91 -0.40 0.00 0.02 0.00 0.00 55.97 56.55 1b0w s LYS 39 Cb -0.18 -2.08 -0.15 0.00 -0.52 0.00 0.00 37.83 34.89 1b0w s LYS 39 CO -0.15 -0.56 1.91 -0.11 -0.92 0.00 0.00 175.35 175.51 1b0w n LEU 40 N -2.27 1.96 -0.01 3.17 7.94 -1.26 -1.42 117.00 125.11 1b0w n LEU 40 Ca 0.07 0.86 -0.00 0.00 -1.11 0.00 0.00 56.01 55.83 1b0w n LEU 40 Cb 0.54 -1.11 -0.00 0.00 0.53 0.00 0.00 43.42 43.38 1b0w n LEU 40 CO 0.52 -0.59 -0.00 0.61 -1.11 0.00 0.00 177.39 176.82 1b0w n GLY 41 N 5.29 0.46 3.59 -3.96 0.00 -1.26 -5.03 105.19 104.29 1b0w n GLY 41 Ca 0.35 -0.05 -0.27 0.00 0.00 0.00 0.00 46.02 46.05 1b0w n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b0w s LYS 42 N -0.24 1.91 0.55 1.61 1.02 -0.51 -5.13 119.74 118.94 1b0w s LYS 42 Ca 0.00 -2.07 -0.13 0.00 0.02 0.00 0.00 55.97 53.79 1b0w s LYS 42 Cb 0.00 -1.54 -0.06 0.00 -0.52 0.00 0.00 37.83 35.71 1b0w s LYS 42 CO 0.00 -0.06 0.97 0.00 -0.92 0.00 0.00 175.35 175.35 1b0w s ALA 43 N -2.78 3.13 0.46 5.17 0.00 -1.26 -4.61 121.76 121.86 1b0w s ALA 43 Ca 0.35 -0.01 -0.25 0.00 0.00 0.00 0.00 51.96 52.05 1b0w s ALA 43 Cb 0.09 -3.03 -0.08 0.00 0.00 0.00 0.00 23.12 20.10 1b0w s ALA 43 CO 0.18 -0.41 1.41 -2.14 0.00 0.00 0.00 175.76 174.79 1b0w s PRO 44 N -4.56 3.64 -0.11 0.00 0.02 -1.26 -4.54 135.00 128.18 1b0w s PRO 44 Ca 0.56 2.38 0.03 0.00 0.02 0.00 0.00 61.00 63.99 1b0w s PRO 44 Cb -0.10 -2.61 0.01 0.00 0.02 0.00 0.00 34.50 31.81 1b0w s PRO 44 CO 0.42 -0.84 -0.21 1.21 -0.33 0.00 0.00 177.00 177.24 1b0w s ASN 45 N -0.58 2.91 0.19 2.53 3.84 0.20 -4.88 114.94 119.16 1b0w s ASN 45 Ca 0.62 -0.54 -0.30 0.00 0.21 0.00 0.00 52.86 52.85 1b0w s ASN 45 Cb -0.43 -1.33 -0.09 0.00 -0.55 0.00 0.00 41.25 38.85 1b0w s ASN 45 CO 0.55 0.11 1.33 -0.22 -2.79 0.00 0.00 177.10 176.08 1b0w s LEU 46 N 0.60 4.41 -0.07 3.21 0.20 -1.26 -0.58 118.68 125.19 1b0w s LEU 46 Ca -0.13 2.42 -0.01 0.00 0.69 0.00 0.00 54.13 57.09 1b0w s LEU 46 Cb -0.17 -3.61 -0.04 0.00 -0.43 0.00 0.00 46.19 41.95 1b0w s LEU 46 CO 0.04 -0.56 -0.07 0.18 -0.29 0.00 0.00 176.35 175.65 1b0w n LEU 47 N 2.77 1.84 -3.96 -0.68 4.77 -0.68 -4.86 117.00 116.20 1b0w n LEU 47 Ca 0.07 0.02 -0.14 0.00 -0.03 0.00 0.00 56.01 55.93 1b0w n LEU 47 Cb 0.42 -0.21 -0.13 0.00 -2.33 0.00 0.00 43.42 41.17 1b0w n LEU 47 CO 0.58 0.39 -0.39 -0.63 -1.33 0.00 0.00 177.39 176.02 1b0w s ILE 48 N -2.13 0.31 0.28 -0.08 1.01 -1.18 -0.05 121.20 119.36 1b0w s ILE 48 Ca -0.09 -0.44 0.02 0.00 0.00 0.00 0.00 60.65 60.14 1b0w s ILE 48 Cb 0.03 -0.32 -0.04 0.00 0.01 0.00 0.00 42.46 42.14 1b0w s ILE 48 CO 0.13 -0.09 0.13 -0.72 0.00 0.00 0.00 174.94 174.39 1b0w s TYR 49 N -0.52 1.55 -1.34 3.97 1.13 -0.70 -1.04 117.35 120.39 1b0w s TYR 49 Ca -0.03 -1.28 -0.04 0.00 -1.41 0.00 0.00 57.07 54.30 1b0w s TYR 49 Cb -0.04 -0.87 0.02 0.00 -1.10 0.00 0.00 41.96 39.97 1b0w s TYR 49 CO -0.00 -0.44 0.30 -3.47 -2.51 0.00 0.00 175.55 169.43 1b0w n ASP 50 N -0.70 -4.66 0.00 -0.18 2.03 -0.66 -1.50 116.55 110.88 1b0w n ASP 50 Ca 0.00 -0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.18 1b0w n ASP 50 Cb 0.66 -3.86 0.00 0.00 -0.72 0.00 0.00 41.12 37.19 1b0w n ASP 50 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1b0w n ALA 51 N -2.93 0.00 -0.68 -1.67 0.00 0.51 -4.07 120.51 111.67 1b0w n ALA 51 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1b0w n ALA 51 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 1b0w n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1b0w n SER 52 N 1.11 0.34 -4.58 0.00 3.41 -1.18 -3.96 113.62 108.76 1b0w n SER 52 Ca 0.00 -1.02 -0.41 0.00 -0.26 0.00 0.00 58.87 57.18 1b0w n SER 52 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 1b0w n SER 52 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1b0w s THR 53 N -0.02 5.04 0.62 6.66 -1.32 -0.56 -4.54 115.64 121.51 1b0w s THR 53 Ca 0.00 0.55 -0.19 0.00 -1.21 0.00 0.00 61.69 60.84 1b0w s THR 53 Cb 0.00 -3.90 -0.02 0.00 -1.51 0.00 0.00 72.50 67.07 1b0w s THR 53 CO 0.00 -0.08 1.27 -0.76 -2.21 0.00 0.00 174.62 172.84 1b0w s LEU 54 N 2.35 3.64 0.51 9.08 1.02 -1.26 -1.73 118.68 132.29 1b0w s LEU 54 Ca 0.19 2.56 -0.12 0.00 0.02 0.00 0.00 54.13 56.78 1b0w s LEU 54 Cb -0.15 -4.57 -0.06 0.00 0.02 0.00 0.00 46.19 41.43 1b0w s LEU 54 CO 0.12 -1.81 0.92 -0.70 0.02 0.00 0.00 176.35 174.90 1b0w s GLU 55 N -3.30 3.77 0.02 1.70 2.56 0.92 -4.88 118.70 119.49 1b0w s GLU 55 Ca 0.79 0.70 -0.30 0.00 0.00 0.00 0.00 54.97 56.16 1b0w s GLU 55 Cb -0.35 -2.21 -0.06 0.00 2.00 0.00 0.00 34.13 33.50 1b0w s GLU 55 CO 0.38 -0.28 1.46 0.95 -0.56 0.00 0.00 175.26 177.21 1b0w s THR 56 N -2.72 3.54 0.00 -1.70 -4.23 -1.26 -2.71 115.64 106.57 1b0w s THR 56 Ca 0.55 0.94 0.00 0.00 -1.18 0.00 0.00 61.69 62.00 1b0w s THR 56 Cb -0.10 -3.61 0.00 0.00 1.34 0.00 0.00 72.50 70.13 1b0w s THR 56 CO 0.39 -0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.07 1b0w n GLY 57 N 3.73 1.63 3.74 3.99 0.00 -1.26 -5.10 105.19 111.92 1b0w n GLY 57 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1b0w n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1b0w s VAL 58 N -2.08 4.20 0.95 1.61 1.01 -1.10 -5.04 120.40 119.95 1b0w s VAL 58 Ca 0.00 2.05 -0.10 0.00 0.00 0.00 0.00 61.98 63.93 1b0w s VAL 58 Cb 0.00 -4.31 0.16 0.00 0.00 0.00 0.00 36.38 32.24 1b0w s VAL 58 CO 0.00 0.42 1.13 -2.84 0.00 0.00 0.00 175.10 173.82 1b0w s PRO 59 N -0.75 0.76 0.44 2.72 0.02 -1.26 -4.91 135.00 132.02 1b0w s PRO 59 Ca 0.43 1.46 0.25 0.00 0.02 0.00 0.00 61.00 63.17 1b0w s PRO 59 Cb -0.25 -1.70 0.59 0.00 0.02 0.00 0.00 34.50 33.15 1b0w s PRO 59 CO 0.32 -2.78 1.70 0.77 -0.33 0.00 0.00 177.00 176.68 1b0w h SER 60 N -1.97 0.00 0.17 2.53 0.02 -2.01 -3.25 113.55 109.04 1b0w h SER 60 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1b0w h SER 60 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 1b0w h SER 60 CO 0.43 0.00 0.00 0.08 -1.14 0.00 0.00 176.83 176.20 1b0w h ARG 61 N 0.00 0.00 -5.66 3.45 0.11 -1.93 -3.42 114.38 106.93 1b0w h ARG 61 Ca 0.00 0.00 -0.63 0.00 0.10 0.00 0.00 59.98 59.45 1b0w h ARG 61 Cb 0.87 0.00 -0.08 0.00 1.11 0.00 0.00 29.97 31.87 1b0w h ARG 61 CO 0.00 0.00 -0.38 -0.06 0.10 0.00 0.00 179.97 179.63 1b0w s PHE 62 N -3.79 3.58 0.11 4.08 0.08 -1.23 -0.45 117.98 120.37 1b0w s PHE 62 Ca -0.03 0.63 -0.16 0.00 0.12 0.00 0.00 56.93 57.50 1b0w s PHE 62 Cb 0.10 -2.13 0.03 0.00 -0.57 0.00 0.00 43.02 40.45 1b0w s PHE 62 CO 0.34 0.57 0.38 -1.54 -0.10 0.00 0.00 175.22 174.87 1b0w s SER 63 N -0.59 -0.21 0.01 1.36 1.04 0.62 -4.98 113.70 110.95 1b0w s SER 63 Ca 0.17 -0.32 0.01 0.00 0.48 0.00 0.00 55.95 56.29 1b0w s SER 63 Cb -0.13 0.46 -0.01 0.00 0.10 0.00 0.00 66.02 66.44 1b0w s SER 63 CO 0.06 -0.83 -0.04 -0.83 0.98 0.00 0.00 173.24 172.58 1b0w s GLY 64 N -2.74 0.23 0.31 7.32 0.00 -1.26 0.02 107.32 111.20 1b0w s GLY 64 Ca 0.02 -0.29 0.01 0.00 0.00 0.00 0.00 44.72 44.46 1b0w s GLY 64 CO -0.11 -0.29 0.35 -1.35 0.00 0.00 0.00 173.10 171.69 1b0w s SER 65 N -0.47 1.07 0.00 1.64 1.04 -0.66 -4.33 113.70 111.98 1b0w s SER 65 Ca -0.02 -1.56 0.00 0.00 0.48 0.00 0.00 55.95 54.85 1b0w s SER 65 Cb -0.04 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.66 1b0w s SER 65 CO -0.00 -1.13 0.00 0.61 0.98 0.00 0.00 173.24 173.70 1b0w n GLY 66 N -0.54 1.11 3.74 7.32 0.00 -1.26 -1.87 105.19 113.69 1b0w n GLY 66 Ca 0.04 -2.29 -0.01 0.00 0.00 0.00 0.00 46.02 43.76 1b0w n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b0w s SER 67 N 0.00 -0.10 1.19 1.61 1.04 -1.17 -4.97 113.70 111.29 1b0w s SER 67 Ca 0.00 -0.35 0.00 0.00 0.48 0.00 0.00 55.95 56.08 1b0w s SER 67 Cb 0.00 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.49 1b0w s SER 67 CO 0.00 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 174.13 1b0w n GLY 68 N -0.53 0.50 0.00 7.32 0.00 -1.26 -2.66 105.19 108.56 1b0w n GLY 68 Ca -0.06 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.56 1b0w n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1b0w n THR 69 N 0.00 0.00 -3.96 2.61 -2.24 -1.26 -2.61 114.28 106.81 1b0w n THR 69 Ca 0.00 -0.35 -0.35 0.00 -2.27 0.00 0.00 64.05 61.09 1b0w n THR 69 Cb 0.00 0.89 -0.14 0.00 -2.10 0.00 0.00 70.33 68.98 1b0w n THR 69 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1b0w s GLU 70 N -1.03 3.32 -0.00 -0.78 0.41 -1.09 -0.45 118.70 119.08 1b0w s GLU 70 Ca 0.00 -0.66 0.06 0.00 -0.41 0.00 0.00 54.97 53.96 1b0w s GLU 70 Cb 0.00 -2.93 -0.02 0.00 -1.78 0.00 0.00 34.13 29.40 1b0w s GLU 70 CO 0.00 -0.19 -0.18 0.71 -0.49 0.00 0.00 175.26 175.11 1b0w s TYR 71 N 1.41 1.62 0.04 1.61 2.02 0.66 -3.07 117.35 121.64 1b0w s TYR 71 Ca 0.05 -0.32 0.08 0.00 -0.37 0.00 0.00 57.07 56.51 1b0w s TYR 71 Cb -0.14 -1.03 -0.03 0.00 -0.40 0.00 0.00 41.96 40.37 1b0w s TYR 71 CO -0.04 -0.01 -0.23 0.95 -1.57 0.00 0.00 175.55 174.65 1b0w s THR 72 N -0.50 1.85 -0.11 -0.71 -4.23 -0.78 0.05 115.64 111.21 1b0w s THR 72 Ca 0.07 -1.24 0.03 0.00 -1.18 0.00 0.00 61.69 59.38 1b0w s THR 72 Cb -0.07 -1.59 0.00 0.00 1.34 0.00 0.00 72.50 72.18 1b0w s THR 72 CO -0.00 0.30 -0.23 0.12 -0.54 0.00 0.00 174.62 174.28 1b0w s PHE 73 N -0.76 2.51 -0.02 3.99 5.36 0.26 -1.66 117.98 127.66 1b0w s PHE 73 Ca 0.09 -1.09 0.06 0.00 -0.96 0.00 0.00 56.93 55.04 1b0w s PHE 73 Cb -0.09 -1.69 -0.01 0.00 -0.34 0.00 0.00 43.02 40.88 1b0w s PHE 73 CO 0.02 -0.46 -0.22 0.99 -1.46 0.00 0.00 175.22 174.08 1b0w s THR 74 N 0.49 1.75 -0.31 0.12 2.01 0.10 -0.93 115.64 118.87 1b0w s THR 74 Ca -0.16 -0.94 -0.02 0.00 0.31 0.00 0.00 61.69 60.89 1b0w s THR 74 Cb -0.17 -1.46 0.06 0.00 0.01 0.00 0.00 72.50 70.93 1b0w s THR 74 CO 0.06 0.50 0.02 -0.63 -0.69 0.00 0.00 174.62 173.88 1b0w s ILE 75 N -0.42 2.98 0.29 1.82 1.01 0.50 -0.27 121.20 127.12 1b0w s ILE 75 Ca 0.06 -1.49 0.10 0.00 0.00 0.00 0.00 60.65 59.31 1b0w s ILE 75 Cb -0.09 -2.77 0.01 0.00 0.01 0.00 0.00 42.46 39.61 1b0w s ILE 75 CO 0.00 -0.19 1.66 0.77 0.00 0.00 0.00 174.94 177.19 1b0w h SER 76 N 7.99 0.07 -2.63 3.58 4.64 -1.03 0.35 113.55 126.52 1b0w h SER 76 Ca -0.20 -0.04 -0.36 0.00 -0.47 0.00 0.00 61.79 60.73 1b0w h SER 76 Cb 1.06 -0.02 -0.37 0.00 -0.31 0.00 0.00 62.40 62.76 1b0w h SER 76 CO 0.55 0.59 -0.66 -0.55 -0.87 0.00 0.00 176.83 175.89 1b0w s SER 77 N -6.88 1.69 -0.02 4.97 0.15 -1.24 -3.71 113.70 108.66 1b0w s SER 77 Ca -0.02 -0.38 -0.30 0.00 0.70 0.00 0.00 55.95 55.95 1b0w s SER 77 Cb 0.13 0.23 -0.04 0.00 -1.71 0.00 0.00 66.02 64.62 1b0w s SER 77 CO 0.76 -0.34 1.24 -0.22 1.20 0.00 0.00 173.24 175.88 1b0w s LEU 78 N 2.28 4.31 0.20 3.45 2.96 0.17 -4.72 118.68 127.33 1b0w s LEU 78 Ca 0.06 1.93 0.09 0.00 -0.22 0.00 0.00 54.13 55.99 1b0w s LEU 78 Cb -0.16 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 1b0w s LEU 78 CO -0.14 -0.59 -0.10 -1.10 -1.32 0.00 0.00 176.35 173.10 1b0w s GLN 79 N 1.98 2.01 0.55 1.98 -0.21 -1.26 0.23 119.66 124.95 1b0w s GLN 79 Ca 0.58 -1.34 0.28 0.00 0.02 0.00 0.00 55.36 54.90 1b0w s GLN 79 Cb -0.27 -2.10 1.46 0.00 1.00 0.00 0.00 33.01 33.10 1b0w s GLN 79 CO 0.25 0.42 1.94 -1.35 -2.12 0.00 0.00 175.29 174.42 1b0w h PRO 80 N 2.77 0.00 -0.00 2.91 0.11 -1.99 0.16 132.00 135.96 1b0w h PRO 80 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1b0w h PRO 80 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1b0w h PRO 80 CO 0.55 0.00 -0.02 -0.85 -0.21 0.00 0.00 178.00 177.47 1b0w n GLU 81 N -4.11 0.82 0.00 1.05 0.00 -1.26 -3.29 120.64 113.85 1b0w n GLU 81 Ca 0.12 -0.10 0.14 0.00 0.00 0.00 0.00 57.16 57.32 1b0w n GLU 81 Cb 0.72 -1.50 0.56 0.00 0.00 0.00 0.00 31.44 31.23 1b0w n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1b0w n ASP 82 N -1.01 0.87 -4.62 -1.84 8.00 0.05 -4.85 116.55 113.15 1b0w n ASP 82 Ca 0.19 -0.99 -0.43 0.00 0.71 0.00 0.00 54.79 54.28 1b0w n ASP 82 Cb 0.19 0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.27 1b0w n ASP 82 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1b0w s ILE 83 N -2.28 3.32 0.07 0.53 1.01 -1.21 -4.88 121.20 117.76 1b0w s ILE 83 Ca 0.33 0.35 -0.26 0.00 0.00 0.00 0.00 60.65 61.07 1b0w s ILE 83 Cb 0.20 -3.36 0.09 0.00 0.01 0.00 0.00 42.46 39.40 1b0w s ILE 83 CO 0.43 -0.18 1.18 0.00 0.00 0.00 0.00 174.94 176.37 1b0w s ALA 84 N 6.47 -2.09 -0.19 9.38 0.00 -1.19 -4.78 121.76 129.37 1b0w s ALA 84 Ca 0.85 -0.15 -0.07 0.00 0.00 0.00 0.00 51.96 52.60 1b0w s ALA 84 Cb -0.30 0.85 -0.04 0.00 0.00 0.00 0.00 23.12 23.64 1b0w s ALA 84 CO 0.34 -1.11 0.05 0.99 0.00 0.00 0.00 175.76 176.03 1b0w s THR 85 N -2.06 4.58 -0.03 0.00 2.01 -0.65 -1.31 115.64 118.19 1b0w s THR 85 Ca 0.27 -0.10 -0.01 0.00 0.31 0.00 0.00 61.69 62.16 1b0w s THR 85 Cb -0.02 -3.07 -0.04 0.00 0.01 0.00 0.00 72.50 69.38 1b0w s THR 85 CO 0.02 0.44 0.05 -0.31 -0.69 0.00 0.00 174.62 174.13 1b0w s TYR 86 N 0.60 3.23 0.07 4.92 1.51 0.49 -0.34 117.35 127.83 1b0w s TYR 86 Ca 0.02 0.19 0.04 0.00 -1.01 0.00 0.00 57.07 56.32 1b0w s TYR 86 Cb -0.13 -1.74 -0.03 0.00 -0.11 0.00 0.00 41.96 39.95 1b0w s TYR 86 CO 0.02 0.53 -0.11 0.71 -1.11 0.00 0.00 175.55 175.58 1b0w s TYR 87 N -1.10 1.04 0.12 2.71 2.02 -1.03 -0.12 117.35 120.99 1b0w s TYR 87 Ca 0.20 -0.52 0.08 0.00 -0.37 0.00 0.00 57.07 56.45 1b0w s TYR 87 Cb -0.12 -0.59 -0.04 0.00 -0.40 0.00 0.00 41.96 40.82 1b0w s TYR 87 CO 0.10 0.01 -0.12 0.00 -1.57 0.00 0.00 175.55 173.97 1b0w s GLN 89 N -2.28 0.13 -0.02 0.00 0.74 0.07 -1.01 119.66 117.30 1b0w s GLN 89 Ca 0.21 0.43 -0.14 0.00 0.05 0.00 0.00 55.36 55.91 1b0w s GLN 89 Cb -0.11 -0.16 -0.05 0.00 1.10 0.00 0.00 33.01 33.79 1b0w s GLN 89 CO 0.13 -0.17 0.37 1.14 -0.55 0.00 0.00 175.29 176.21 1b0w s GLN 90 N 1.23 3.87 -0.22 1.67 1.03 -0.80 -0.87 119.66 125.58 1b0w s GLN 90 Ca -0.09 0.33 0.14 0.00 0.04 0.00 0.00 55.36 55.78 1b0w s GLN 90 Cb -0.11 -3.22 0.45 0.00 0.03 0.00 0.00 33.01 30.15 1b0w s GLN 90 CO -0.07 0.69 1.19 2.48 -2.54 0.00 0.00 175.29 177.03 1b0w n TYR 91 N 1.91 1.19 0.06 9.60 4.11 -0.81 -3.41 117.16 129.80 1b0w n TYR 91 Ca -0.15 -1.71 -0.20 0.00 -0.00 0.00 0.00 57.90 55.84 1b0w n TYR 91 Cb 0.53 -0.27 -0.14 0.00 -0.00 0.00 0.00 39.34 39.47 1b0w n TYR 91 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 176.86 177.08 1b0w h ASP 92 N 1.67 0.62 -3.92 9.48 3.58 -1.85 -3.47 116.42 122.54 1b0w h ASP 92 Ca 0.08 -0.87 -0.18 0.00 0.42 0.00 0.00 57.03 56.48 1b0w h ASP 92 Cb 1.37 -0.20 -0.26 0.00 1.72 0.00 0.00 39.33 41.96 1b0w h ASP 92 CO 0.32 1.44 -0.51 -0.62 -2.88 0.00 0.00 179.24 176.99 1b0w s ASP 93 N -7.09 -0.17 0.34 2.28 2.15 -1.26 -5.13 116.67 107.79 1b0w s ASP 93 Ca -0.12 0.30 -0.26 0.00 0.43 0.00 0.00 52.55 52.90 1b0w s ASP 93 Cb 0.03 0.35 -0.10 0.00 -0.30 0.00 0.00 42.92 42.90 1b0w s ASP 93 CO 0.87 -0.09 0.97 -0.76 -0.17 0.00 0.00 175.17 175.98 1b0w s LEU 94 N -0.06 4.31 0.31 -1.34 1.43 -1.26 -3.78 118.68 118.29 1b0w s LEU 94 Ca -0.02 1.90 -0.27 0.00 -1.03 0.00 0.00 54.13 54.71 1b0w s LEU 94 Cb -0.02 -4.03 -0.09 0.00 0.03 0.00 0.00 46.19 42.07 1b0w s LEU 94 CO 0.00 -0.16 1.01 -2.16 0.23 0.00 0.00 176.35 175.28 1b0w s PRO 95 N -2.12 4.57 -0.04 1.29 0.04 -1.26 -4.93 135.00 132.54 1b0w s PRO 95 Ca 0.51 1.55 -0.30 0.00 0.04 0.00 0.00 61.00 62.81 1b0w s PRO 95 Cb -0.20 -2.97 -0.05 0.00 0.04 0.00 0.00 34.50 31.32 1b0w s PRO 95 CO 0.25 0.22 1.54 0.71 0.04 0.00 0.00 177.00 179.76 1b0w s TYR 96 N -1.39 2.36 0.07 0.56 2.02 -1.25 -4.73 117.35 114.99 1b0w s TYR 96 Ca 0.48 0.47 0.05 0.00 -0.37 0.00 0.00 57.07 57.70 1b0w s TYR 96 Cb -0.25 -3.80 -0.04 0.00 -0.40 0.00 0.00 41.96 37.47 1b0w s TYR 96 CO 0.32 -3.22 -0.05 0.95 -1.57 0.00 0.00 175.55 171.98 1b0w s THR 97 N 3.41 3.75 0.13 -0.71 -4.23 -1.22 -4.96 115.64 111.80 1b0w s THR 97 Ca 0.69 -0.99 0.06 0.00 -1.18 0.00 0.00 61.69 60.27 1b0w s THR 97 Cb -0.32 -2.73 -0.04 0.00 1.34 0.00 0.00 72.50 70.75 1b0w s THR 97 CO 0.27 0.20 0.00 -0.36 -0.54 0.00 0.00 174.62 174.20 1b0w s PHE 98 N -1.19 2.93 1.12 3.99 0.40 -1.26 -1.90 117.98 122.07 1b0w s PHE 98 Ca 0.22 -0.08 -0.17 0.00 -0.60 0.00 0.00 56.93 56.30 1b0w s PHE 98 Cb -0.11 -1.47 0.25 0.00 0.51 0.00 0.00 43.02 42.20 1b0w s PHE 98 CO 0.14 0.49 1.14 0.20 0.70 0.00 0.00 175.22 177.89 1b0w s GLY 99 N -2.61 1.61 0.02 4.36 0.00 -0.18 -4.64 107.32 105.88 1b0w s GLY 99 Ca 0.26 -0.88 0.28 0.00 0.00 0.00 0.00 44.72 44.38 1b0w s GLY 99 CO 0.18 -0.07 1.88 -0.18 0.00 0.00 0.00 173.10 174.92 1b0w n GLN 100 N -4.48 0.02 0.00 2.90 0.00 -1.26 -4.74 117.38 109.82 1b0w n GLN 100 Ca 0.12 0.04 0.00 0.00 -0.00 0.00 0.00 57.00 57.16 1b0w n GLN 100 Cb 0.59 -1.53 0.00 0.00 0.00 0.00 0.00 30.24 29.31 1b0w n GLN 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1b0w n GLY 101 N 1.37 0.91 2.75 1.69 0.00 -1.26 -5.03 105.19 105.62 1b0w n GLY 101 Ca 0.07 -1.72 -0.23 0.00 0.00 0.00 0.00 46.02 44.13 1b0w n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1b0w s THR 102 N -2.83 0.32 -0.28 2.61 2.01 0.83 -4.46 115.64 113.84 1b0w s THR 102 Ca 0.00 0.09 -0.22 0.00 0.31 0.00 0.00 61.69 61.88 1b0w s THR 102 Cb 0.00 -0.53 -0.01 0.00 0.01 0.00 0.00 72.50 71.97 1b0w s THR 102 CO 0.00 0.20 0.70 -0.75 -0.69 0.00 0.00 174.62 174.08 1b0w s LYS 103 N 1.99 4.03 -0.16 4.92 2.20 -0.39 -0.38 119.74 131.96 1b0w s LYS 103 Ca 0.04 0.56 -0.03 0.00 -0.36 0.00 0.00 55.97 56.18 1b0w s LYS 103 Cb -0.13 -3.69 -0.02 0.00 -1.51 0.00 0.00 37.83 32.48 1b0w s LYS 103 CO -0.05 -0.54 -0.06 0.14 -0.36 0.00 0.00 175.35 174.48 1b0w s VAL 104 N 2.70 3.62 0.46 4.02 -7.23 -0.42 -1.04 120.40 122.50 1b0w s VAL 104 Ca 0.29 -0.45 0.05 0.00 -1.81 0.00 0.00 61.98 60.06 1b0w s VAL 104 Cb -0.15 -2.58 -0.04 0.00 0.56 0.00 0.00 36.38 34.17 1b0w s VAL 104 CO 0.10 0.49 0.11 -1.61 -0.31 0.00 0.00 175.10 173.87 1b0w s GLU 105 N 0.56 2.14 -0.18 4.82 2.02 -0.54 -3.14 118.70 124.38 1b0w s GLU 105 Ca -0.04 -2.10 -0.04 0.00 0.02 0.00 0.00 54.97 52.81 1b0w s GLU 105 Cb -0.15 -1.77 -0.02 0.00 0.10 0.00 0.00 34.13 32.30 1b0w s GLU 105 CO 0.03 -0.23 -0.04 0.42 0.02 0.00 0.00 175.26 175.46 1b0w s ILE 106 N -2.73 3.66 0.44 -1.63 -1.09 -1.26 -2.41 121.20 116.18 1b0w s ILE 106 Ca 0.28 -0.42 -0.23 0.00 -2.23 0.00 0.00 60.65 58.05 1b0w s ILE 106 Cb 0.04 -2.63 -0.08 0.00 -1.58 0.00 0.00 42.46 38.22 1b0w s ILE 106 CO 0.15 0.46 1.11 -0.75 -1.23 0.00 0.00 174.94 174.68 1b0w s LYS 107 N 0.84 3.89 0.00 2.79 2.36 0.22 -4.84 119.74 125.00 1b0w s LYS 107 Ca -0.01 1.63 0.00 0.00 -2.55 0.00 0.00 55.97 55.04 1b0w s LYS 107 Cb -0.15 -2.40 0.00 0.00 -1.05 0.00 0.00 37.83 34.23 1b0w s LYS 107 CO 0.02 -0.41 0.00 0.54 1.55 0.00 0.00 175.35 177.05