#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b5d s ILE 2 N 0.00 4.69 0.69 3.17 1.09 -1.26 -5.02 121.20 124.56 1b5d s ILE 2 Ca 0.00 1.98 -0.17 0.00 -1.10 0.00 0.00 60.65 61.37 1b5d s ILE 2 Cb 0.00 -4.28 0.00 0.00 -1.06 0.00 0.00 42.46 37.12 1b5d s ILE 2 CO 0.00 0.26 1.12 -0.24 -0.10 0.00 0.00 174.94 175.98 1b5d n SER 3 N 3.25 1.16 -4.51 3.58 2.88 -1.26 -4.91 113.62 113.81 1b5d n SER 3 Ca 0.03 0.73 -0.42 0.00 -1.33 0.00 0.00 58.87 57.88 1b5d n SER 3 Cb 0.50 -1.47 -0.03 0.00 -0.75 0.00 0.00 64.21 62.46 1b5d n SER 3 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1b5d s ASP 4 N -1.57 6.57 0.42 -3.46 1.11 -1.26 -5.00 116.67 113.48 1b5d s ASP 4 Ca 0.77 -1.74 0.03 0.00 0.18 0.00 0.00 52.55 51.78 1b5d s ASP 4 Cb -0.36 -2.49 -0.00 0.00 1.07 0.00 0.00 42.92 41.14 1b5d s ASP 4 CO 0.46 -1.30 0.61 -0.44 1.18 0.00 0.00 175.17 175.68 1b5d s SER 5 N 4.35 5.84 0.92 0.27 0.01 -1.26 -5.09 113.70 118.74 1b5d s SER 5 Ca 0.40 0.10 -0.10 0.00 1.31 0.00 0.00 55.95 57.66 1b5d s SER 5 Cb -0.02 -1.38 0.15 0.00 0.21 0.00 0.00 66.02 64.98 1b5d s SER 5 CO -0.09 -0.64 1.12 -0.04 0.41 0.00 0.00 173.24 174.00 1b5d s MET 6 N -4.44 1.02 0.44 12.44 -1.94 -1.26 -4.76 119.30 120.81 1b5d s MET 6 Ca 0.48 1.38 0.07 0.00 -1.71 0.00 0.00 55.69 55.90 1b5d s MET 6 Cb -0.10 -1.74 -0.03 0.00 2.01 0.00 0.00 34.83 34.97 1b5d s MET 6 CO 0.36 -2.57 0.24 0.95 -0.01 0.00 0.00 175.02 173.98 1b5d s THR 7 N -2.69 2.23 0.36 2.05 -4.23 -1.26 -0.67 115.64 111.43 1b5d s THR 7 Ca 0.66 -1.61 0.05 0.00 -1.18 0.00 0.00 61.69 59.61 1b5d s THR 7 Cb -0.22 -2.84 0.29 0.00 1.34 0.00 0.00 72.50 71.07 1b5d s THR 7 CO 0.58 0.00 1.96 0.58 -0.54 0.00 0.00 174.62 177.20 1b5d h VAL 8 N 1.25 1.03 -0.70 2.29 2.07 -1.95 -2.08 116.25 118.17 1b5d h VAL 8 Ca -0.42 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 1b5d h VAL 8 Cb 1.26 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 1b5d h VAL 8 CO 0.66 0.14 0.37 -0.33 0.02 0.00 0.00 177.57 178.43 1b5d h GLU 9 N 0.78 0.97 -0.16 1.57 4.39 -1.95 -0.69 114.58 119.48 1b5d h GLU 9 Ca 0.31 -0.11 -0.20 0.00 0.34 0.00 0.00 59.36 59.70 1b5d h GLU 9 Cb 0.23 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 1b5d h GLU 9 CO -0.10 0.72 -0.71 0.93 -1.16 0.00 0.00 179.01 178.69 1b5d h GLU 10 N 0.97 0.69 -0.88 2.33 5.08 -1.79 -2.72 114.58 118.27 1b5d h GLU 10 Ca 0.25 -0.53 0.06 0.00 -1.00 0.00 0.00 59.36 58.14 1b5d h GLU 10 Cb 0.04 0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.33 1b5d h GLU 10 CO -0.04 1.15 0.55 0.82 -1.00 0.00 0.00 179.01 180.49 1b5d h ILE 11 N 0.49 1.05 -0.33 3.13 1.08 -0.91 -1.57 117.51 120.44 1b5d h ILE 11 Ca -0.03 -0.34 0.03 0.00 -0.39 0.00 0.00 64.86 64.12 1b5d h ILE 11 Cb 1.31 -0.04 -0.03 0.00 -3.07 0.00 0.00 36.82 34.99 1b5d h ILE 11 CO 0.14 0.18 0.15 0.03 -0.69 0.00 0.00 178.15 177.97 1b5d h ARG 12 N 1.00 0.31 -0.46 2.37 3.08 -1.06 -1.34 114.38 118.29 1b5d h ARG 12 Ca 0.38 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.44 1b5d h ARG 12 Cb 0.17 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.11 1b5d h ARG 12 CO -0.17 0.21 0.25 1.25 -1.07 0.00 0.00 179.97 180.43 1b5d h LEU 13 N 0.32 0.37 -0.99 3.04 5.85 -1.14 -1.00 115.31 121.76 1b5d h LEU 13 Ca 0.14 0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.79 1b5d h LEU 13 Cb 0.07 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1b5d h LEU 13 CO -0.11 0.26 -0.24 0.45 -0.34 0.00 0.00 178.44 178.46 1b5d h HIS 14 N 0.49 0.49 -0.22 1.25 3.86 -1.01 -0.66 115.15 119.35 1b5d h HIS 14 Ca 0.19 -0.10 -0.15 0.00 -1.16 0.00 0.00 60.37 59.16 1b5d h HIS 14 Cb 0.07 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 1b5d h HIS 14 CO -0.09 0.65 -0.47 -0.07 0.86 0.00 0.00 177.93 178.81 1b5d h LEU 15 N 0.39 0.61 -1.02 2.43 3.38 -1.07 -1.22 115.31 118.81 1b5d h LEU 15 Ca 0.06 -0.29 -0.09 0.00 0.09 0.00 0.00 57.88 57.64 1b5d h LEU 15 Cb 0.64 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1b5d h LEU 15 CO 0.05 0.98 -0.30 1.23 0.09 0.00 0.00 178.44 180.49 1b5d h GLY 16 N 1.06 0.36 0.95 0.83 0.00 -0.72 -2.23 103.07 103.31 1b5d h GLY 16 Ca 0.03 -0.30 -0.11 0.00 0.00 0.00 0.00 47.33 46.95 1b5d h GLY 16 CO 0.09 0.27 -0.26 1.41 0.00 0.00 0.00 176.54 178.06 1b5d h LEU 17 N 0.29 0.71 -1.01 3.11 4.07 -0.91 -2.20 115.31 119.37 1b5d h LEU 17 Ca 0.04 -0.47 -0.03 0.00 0.08 0.00 0.00 57.88 57.51 1b5d h LEU 17 Cb 0.68 -0.20 -0.04 0.00 1.08 0.00 0.00 40.66 42.19 1b5d h LEU 17 CO 0.05 1.03 0.37 0.00 -1.08 0.00 0.00 178.44 178.81 1b5d h ALA 18 N 0.70 1.23 -0.29 1.53 0.00 -1.04 -1.53 119.26 119.86 1b5d h ALA 18 Ca 0.05 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.63 1b5d h ALA 18 Cb 0.82 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1b5d h ALA 18 CO 0.07 0.60 -0.55 1.25 0.00 0.00 0.00 179.25 180.61 1b5d h LEU 19 N 1.07 0.98 -1.29 0.00 5.85 -1.42 -0.82 115.31 119.68 1b5d h LEU 19 Ca 0.26 -0.53 0.04 0.00 0.84 0.00 0.00 57.88 58.49 1b5d h LEU 19 Cb 0.09 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 1b5d h LEU 19 CO -0.04 1.33 0.50 0.50 -0.34 0.00 0.00 178.44 180.39 1b5d h LYS 20 N 0.67 0.90 -0.23 1.25 3.64 -0.99 -1.88 116.57 119.94 1b5d h LYS 20 Ca 0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1b5d h LYS 20 Cb 1.16 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.78 1b5d h LYS 20 CO 0.12 0.59 0.00 0.39 -2.27 0.00 0.00 179.45 178.29 1b5d n GLU 21 N -4.45 1.95 -3.83 1.90 1.02 -0.61 -4.94 120.64 111.68 1b5d n GLU 21 Ca 0.10 -1.44 -0.27 0.00 -0.02 0.00 0.00 57.16 55.53 1b5d n GLU 21 Cb 0.12 -1.42 0.03 0.00 -0.02 0.00 0.00 31.44 30.15 1b5d n GLU 21 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1b5d n LYS 22 N 0.66 -5.63 -2.14 3.49 4.01 -0.71 -4.88 118.16 112.97 1b5d n LYS 22 Ca 0.17 0.63 -0.42 0.00 -0.51 0.00 0.00 58.31 58.17 1b5d n LYS 22 Cb 0.41 -5.45 0.00 0.00 -0.51 0.00 0.00 35.03 29.47 1b5d n LYS 22 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 1b5d n ASP 23 N -2.91 4.40 -4.88 4.39 -0.08 -0.35 -4.97 116.55 112.15 1b5d n ASP 23 Ca -0.05 -2.89 -0.33 0.00 -1.51 0.00 0.00 54.79 50.02 1b5d n ASP 23 Cb 0.57 -1.69 -0.05 0.00 2.34 0.00 0.00 41.12 42.29 1b5d n ASP 23 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 1b5d s PHE 24 N 3.50 3.51 -0.02 -0.67 0.08 -1.26 -4.44 117.98 118.68 1b5d s PHE 24 Ca 0.50 0.68 0.02 0.00 0.12 0.00 0.00 56.93 58.25 1b5d s PHE 24 Cb 0.09 -2.09 0.00 0.00 -0.57 0.00 0.00 43.02 40.46 1b5d s PHE 24 CO -0.01 0.45 -0.09 0.08 -0.10 0.00 0.00 175.22 175.55 1b5d s VAL 25 N -1.58 0.77 -0.27 -0.44 1.01 0.11 -4.94 120.40 115.05 1b5d s VAL 25 Ca 0.39 -0.36 -0.27 0.00 0.00 0.00 0.00 61.98 61.74 1b5d s VAL 25 Cb -0.13 -0.68 0.01 0.00 0.00 0.00 0.00 36.38 35.58 1b5d s VAL 25 CO 0.22 0.24 0.97 -0.69 0.00 0.00 0.00 175.10 175.84 1b5d s VAL 26 N 0.16 4.67 0.93 2.92 1.01 -1.26 0.11 120.40 128.94 1b5d s VAL 26 Ca -0.03 1.72 -0.11 0.00 0.00 0.00 0.00 61.98 63.56 1b5d s VAL 26 Cb -0.08 -4.28 0.15 0.00 0.00 0.00 0.00 36.38 32.17 1b5d s VAL 26 CO 0.00 -0.27 1.09 -0.62 0.00 0.00 0.00 175.10 175.31 1b5d s ASP 27 N 1.43 3.06 0.52 3.32 2.15 0.25 -4.90 116.67 122.49 1b5d s ASP 27 Ca 0.41 1.63 0.27 0.00 0.43 0.00 0.00 52.55 55.29 1b5d s ASP 27 Cb -0.14 -2.28 1.40 0.00 -0.30 0.00 0.00 42.92 41.60 1b5d s ASP 27 CO 0.10 -2.92 2.05 0.07 -0.17 0.00 0.00 175.17 174.30 1b5d h LYS 28 N -1.74 0.00 0.00 4.34 2.10 -1.96 -0.43 116.57 118.88 1b5d h LYS 28 Ca -0.50 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.15 1b5d h LYS 28 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 1b5d h LYS 28 CO 0.51 0.13 0.00 0.25 -2.00 0.00 0.00 179.45 178.34 1b5d n THR 29 N -3.61 0.17 -0.09 0.07 -2.24 -1.26 -4.88 114.28 102.44 1b5d n THR 29 Ca -0.02 0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1b5d n THR 29 Cb 0.26 -0.61 0.00 0.00 -2.10 0.00 0.00 70.33 67.88 1b5d n THR 29 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1b5d n GLY 30 N 1.02 0.53 3.89 3.38 0.00 -0.17 -5.07 105.19 108.77 1b5d n GLY 30 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1b5d n GLY 30 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b5d s VAL 31 N -2.25 4.98 0.42 1.61 0.11 -1.26 -4.71 120.40 119.31 1b5d s VAL 31 Ca 0.00 0.24 -0.23 0.00 -2.93 0.00 0.00 61.98 59.06 1b5d s VAL 31 Cb 0.00 -3.69 -0.09 0.00 -1.53 0.00 0.00 36.38 31.07 1b5d s VAL 31 CO 0.00 -0.25 1.05 -0.54 -3.33 0.00 0.00 175.10 172.04 1b5d s LYS 32 N -3.31 4.06 0.05 1.54 1.02 -1.26 0.84 119.74 122.68 1b5d s LYS 32 Ca 0.46 1.49 0.03 0.00 0.02 0.00 0.00 55.97 57.97 1b5d s LYS 32 Cb -0.11 -2.43 -0.03 0.00 -0.52 0.00 0.00 37.83 34.75 1b5d s LYS 32 CO 0.27 -0.23 -0.10 0.95 -0.92 0.00 0.00 175.35 175.31 1b5d s THR 33 N -1.73 0.77 0.34 2.17 -4.23 0.12 -1.44 115.64 111.64 1b5d s THR 33 Ca 0.60 -1.12 0.03 0.00 -1.18 0.00 0.00 61.69 60.02 1b5d s THR 33 Cb -0.21 -0.79 -0.02 0.00 1.34 0.00 0.00 72.50 72.82 1b5d s THR 33 CO 0.26 -0.29 0.51 0.27 -0.54 0.00 0.00 174.62 174.84 1b5d s ILE 34 N -1.27 4.72 -0.28 2.99 -4.36 -0.94 0.06 121.20 122.14 1b5d s ILE 34 Ca -0.06 -0.71 -0.25 0.00 -0.26 0.00 0.00 60.65 59.37 1b5d s ILE 34 Cb -0.10 -3.70 0.10 0.00 1.25 0.00 0.00 42.46 40.01 1b5d s ILE 34 CO 0.01 -0.38 0.87 -0.70 0.24 0.00 0.00 174.94 174.99 1b5d s GLU 35 N -4.25 0.67 -0.15 0.37 2.12 -1.26 -1.27 118.70 114.93 1b5d s GLU 35 Ca 0.41 0.81 0.01 0.00 0.36 0.00 0.00 54.97 56.56 1b5d s GLU 35 Cb -0.09 0.32 0.00 0.00 0.26 0.00 0.00 34.13 34.62 1b5d s GLU 35 CO 0.34 -0.08 -0.19 0.42 -0.54 0.00 0.00 175.26 175.21 1b5d s ILE 36 N 0.33 2.35 -0.05 -3.70 1.01 0.26 -4.99 121.20 116.41 1b5d s ILE 36 Ca 0.01 -0.88 -0.15 0.00 0.00 0.00 0.00 60.65 59.64 1b5d s ILE 36 Cb -0.05 -1.97 -0.05 0.00 0.01 0.00 0.00 42.46 40.40 1b5d s ILE 36 CO -0.03 0.53 0.39 -0.63 0.00 0.00 0.00 174.94 175.20 1b5d s ILE 37 N 0.81 5.12 -1.47 2.92 -1.09 -1.26 -1.61 121.20 124.62 1b5d s ILE 37 Ca -0.06 0.79 -0.01 0.00 -2.23 0.00 0.00 60.65 59.13 1b5d s ILE 37 Cb -0.15 -3.70 0.00 0.00 -1.58 0.00 0.00 42.46 37.02 1b5d s ILE 37 CO -0.01 0.51 0.16 0.61 -1.23 0.00 0.00 174.94 174.98 1b5d n GLY 38 N 2.33 -0.36 3.73 6.18 0.00 -0.42 -4.96 105.19 111.68 1b5d n GLY 38 Ca -0.13 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 1b5d n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b5d n ALA 39 N -2.30 1.85 -3.67 4.61 0.00 -0.80 -4.84 120.51 115.36 1b5d n ALA 39 Ca -0.18 0.37 -0.15 0.00 0.00 0.00 0.00 53.44 53.48 1b5d n ALA 39 Cb 0.64 -2.35 -0.14 0.00 0.00 0.00 0.00 19.45 17.60 1b5d n ALA 39 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1b5d s SER 40 N 0.02 0.49 0.05 0.00 0.15 -1.25 -1.06 113.70 112.09 1b5d s SER 40 Ca 0.59 0.46 -0.18 0.00 0.70 0.00 0.00 55.95 57.52 1b5d s SER 40 Cb -0.54 0.47 0.03 0.00 -1.71 0.00 0.00 66.02 64.28 1b5d s SER 40 CO 0.58 -0.24 0.40 0.72 1.20 0.00 0.00 173.24 175.90 1b5d s PHE 41 N 2.26 -0.25 -0.11 3.44 -0.71 -0.65 -3.98 117.98 117.97 1b5d s PHE 41 Ca 0.01 0.20 -0.30 0.00 -1.04 0.00 0.00 56.93 55.80 1b5d s PHE 41 Cb -0.12 0.21 -0.01 0.00 -1.21 0.00 0.00 43.02 41.89 1b5d s PHE 41 CO -0.07 -0.57 1.06 0.08 -1.34 0.00 0.00 175.22 174.38 1b5d s VAL 42 N -2.52 4.64 -1.19 -2.49 1.01 0.15 -0.01 120.40 119.99 1b5d s VAL 42 Ca -0.05 1.93 -0.20 0.00 0.00 0.00 0.00 61.98 63.65 1b5d s VAL 42 Cb -0.01 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 32.15 1b5d s VAL 42 CO -0.03 -0.02 1.75 0.00 0.00 0.00 0.00 175.10 176.80 1b5d s ALA 43 N 2.25 2.74 -2.43 5.51 0.00 -0.01 -3.80 121.76 126.02 1b5d s ALA 43 Ca 0.50 -2.52 0.23 0.00 0.00 0.00 0.00 51.96 50.16 1b5d s ALA 43 Cb -0.19 -4.63 0.42 0.00 0.00 0.00 0.00 23.12 18.72 1b5d s ALA 43 CO 0.17 -3.91 1.40 -0.40 0.00 0.00 0.00 175.76 173.02 1b5d n ASP 44 N 10.27 3.47 -4.09 0.00 5.75 -1.26 -4.66 116.55 126.03 1b5d n ASP 44 Ca 0.44 -1.99 -0.11 0.00 -0.01 0.00 0.00 54.79 53.13 1b5d n ASP 44 Cb 0.47 -0.25 -0.11 0.00 -1.03 0.00 0.00 41.12 40.20 1b5d n ASP 44 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1b5d s GLU 45 N -1.46 0.60 0.00 0.11 2.02 -1.26 -5.00 118.70 113.70 1b5d s GLU 45 Ca 0.39 -0.98 0.25 0.00 0.02 0.00 0.00 54.97 54.65 1b5d s GLU 45 Cb 0.23 -0.12 1.19 0.00 0.10 0.00 0.00 34.13 35.54 1b5d s GLU 45 CO 0.31 -0.01 1.81 -0.35 0.02 0.00 0.00 175.26 177.04 1b5d n PRO 46 N 0.81 1.39 -3.62 0.39 -0.04 -1.26 -4.87 135.00 127.80 1b5d n PRO 46 Ca -0.18 -0.57 -0.10 0.00 -0.04 0.00 0.00 63.50 62.61 1b5d n PRO 46 Cb 0.58 -1.43 -0.02 0.00 -0.04 0.00 0.00 33.50 32.59 1b5d n PRO 46 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1b5d s PHE 47 N -1.95 -0.38 -0.05 0.54 -0.71 -1.26 -4.49 117.98 109.68 1b5d s PHE 47 Ca 0.37 0.06 -0.07 0.00 -1.04 0.00 0.00 56.93 56.25 1b5d s PHE 47 Cb 0.19 0.63 -0.02 0.00 -1.21 0.00 0.00 43.02 42.60 1b5d s PHE 47 CO 0.30 -1.02 -0.13 -0.89 -1.34 0.00 0.00 175.22 172.13 1b5d n ILE 48 N -0.42 0.84 -4.33 -4.49 5.41 -1.26 -5.05 119.36 110.06 1b5d n ILE 48 Ca -0.11 0.27 -0.21 0.00 1.00 0.00 0.00 62.75 63.70 1b5d n ILE 48 Cb 0.62 -1.77 -0.11 0.00 -0.71 0.00 0.00 39.64 37.67 1b5d n ILE 48 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1b5d s PHE 49 N -1.94 1.78 0.00 1.39 0.08 -1.26 -4.94 117.98 113.08 1b5d s PHE 49 Ca -0.11 -0.49 0.00 0.00 0.12 0.00 0.00 56.93 56.45 1b5d s PHE 49 Cb 0.02 -0.87 0.00 0.00 -0.57 0.00 0.00 43.02 41.59 1b5d s PHE 49 CO 0.16 0.33 0.00 0.41 -0.10 0.00 0.00 175.22 176.02 1b5d n GLY 50 N 0.18 -1.60 3.43 4.36 0.00 0.69 -4.68 105.19 107.57 1b5d n GLY 50 Ca -0.12 -2.07 -0.29 0.00 0.00 0.00 0.00 46.02 43.54 1b5d n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b5d s ALA 51 N -2.00 2.50 -0.16 4.61 0.00 -1.26 -4.54 121.76 120.91 1b5d s ALA 51 Ca 0.00 -1.42 -0.29 0.00 0.00 0.00 0.00 51.96 50.25 1b5d s ALA 51 Cb 0.00 -0.49 -0.00 0.00 0.00 0.00 0.00 23.12 22.62 1b5d s ALA 51 CO 0.00 0.56 1.06 -0.51 0.00 0.00 0.00 175.76 176.87 1b5d s LEU 52 N -2.08 4.18 -0.65 0.00 1.43 -1.26 -5.00 118.68 115.29 1b5d s LEU 52 Ca 0.16 1.50 -0.02 0.00 -1.03 0.00 0.00 54.13 54.73 1b5d s LEU 52 Cb -0.10 -3.55 0.17 0.00 0.03 0.00 0.00 46.19 42.74 1b5d s LEU 52 CO 0.08 -0.58 0.47 0.21 0.23 0.00 0.00 176.35 176.75 1b5d s ASN 53 N 1.24 5.23 0.51 2.29 3.04 -1.26 -4.94 114.94 121.06 1b5d s ASN 53 Ca 0.47 -2.99 0.29 0.00 0.04 0.00 0.00 52.86 50.67 1b5d s ASN 53 Cb -0.18 -1.84 1.33 0.00 -1.54 0.00 0.00 41.25 39.02 1b5d s ASN 53 CO 0.13 -0.33 1.99 0.44 -3.04 0.00 0.00 177.10 176.28 1b5d h ASP 54 N 6.83 0.00 0.09 -4.21 3.32 -2.00 -2.69 116.42 117.77 1b5d h ASP 54 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1b5d h ASP 54 Cb 0.93 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.48 1b5d h ASP 54 CO 0.72 0.12 -0.05 -0.08 -1.72 0.00 0.00 179.24 178.23 1b5d h GLU 55 N 0.00 -0.12 -0.32 3.56 4.22 -2.00 -2.26 114.58 117.66 1b5d h GLU 55 Ca -0.00 0.01 -0.04 0.00 0.08 0.00 0.00 59.36 59.41 1b5d h GLU 55 Cb 0.50 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1b5d h GLU 55 CO 0.02 0.06 0.06 -0.92 -2.18 0.00 0.00 179.01 176.04 1b5d h TYR 56 N -0.29 0.56 -0.78 0.92 3.20 -1.92 -2.72 116.97 115.94 1b5d h TYR 56 Ca -0.01 -0.08 0.06 0.00 3.14 0.00 0.00 58.73 61.84 1b5d h TYR 56 Cb 0.24 -0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.31 1b5d h TYR 56 CO -0.02 0.60 0.51 0.82 -1.64 0.00 0.00 178.16 178.43 1b5d h ILE 57 N 0.35 1.04 -0.37 1.81 2.04 -1.53 -1.02 117.51 119.83 1b5d h ILE 57 Ca 0.10 -0.29 -0.14 0.00 1.00 0.00 0.00 64.86 65.53 1b5d h ILE 57 Cb 0.34 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 1b5d h ILE 57 CO 0.01 0.15 -0.33 -0.61 0.00 0.00 0.00 178.15 177.37 1b5d h GLN 58 N 0.84 0.82 -0.63 2.37 5.75 -1.20 0.20 115.11 123.26 1b5d h GLN 58 Ca 0.33 -0.39 -0.08 0.00 -0.15 0.00 0.00 58.65 58.36 1b5d h GLN 58 Cb 0.24 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.75 1b5d h GLN 58 CO -0.11 1.03 0.09 0.00 -2.65 0.00 0.00 178.83 177.19 1b5d h ARG 59 N 0.69 1.04 -0.06 1.69 3.08 -1.03 -1.58 114.38 118.22 1b5d h ARG 59 Ca 0.07 -0.27 -0.14 0.00 0.07 0.00 0.00 59.98 59.71 1b5d h ARG 59 Cb 0.88 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.79 1b5d h ARG 59 CO 0.08 0.96 -0.60 1.49 -1.07 0.00 0.00 179.97 180.83 1b5d h GLU 60 N 0.97 0.19 -0.60 0.04 4.81 -0.99 -1.87 114.58 117.13 1b5d h GLU 60 Ca 0.19 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1b5d h GLU 60 Cb 0.43 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.80 1b5d h GLU 60 CO 0.01 0.73 0.32 1.25 -0.73 0.00 0.00 179.01 180.60 1b5d h LEU 61 N 0.14 0.76 -0.93 1.64 5.85 -0.70 -0.83 115.31 121.25 1b5d h LEU 61 Ca -0.01 -0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.54 1b5d h LEU 61 Cb 1.09 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 1b5d h LEU 61 CO 0.09 0.64 0.02 -0.33 -0.34 0.00 0.00 178.44 178.52 1b5d h GLU 62 N 0.81 0.80 -0.39 1.25 4.39 -0.94 -1.06 114.58 119.45 1b5d h GLU 62 Ca 0.21 -0.21 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 1b5d h GLU 62 Cb 0.06 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 1b5d h GLU 62 CO -0.03 0.80 0.10 2.35 -1.16 0.00 0.00 179.01 181.06 1b5d h TRP 63 N 0.76 0.65 -0.82 4.33 7.01 -1.06 -2.24 115.95 124.58 1b5d h TRP 63 Ca 0.15 -0.08 0.02 0.00 2.11 0.00 0.00 58.89 61.09 1b5d h TRP 63 Cb 0.43 -0.18 -0.04 0.00 -2.10 0.00 0.00 29.16 27.26 1b5d h TRP 63 CO 0.02 0.62 0.54 1.88 -2.79 0.00 0.00 178.44 178.71 1b5d h TYR 64 N 0.48 1.01 -0.21 2.65 0.05 -0.87 -2.45 116.97 117.63 1b5d h TYR 64 Ca 0.12 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.90 1b5d h TYR 64 Cb 0.30 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 37.69 1b5d h TYR 64 CO 0.02 0.61 -0.01 0.87 -1.05 0.00 0.00 178.16 178.60 1b5d h LYS 65 N 1.07 0.31 0.00 4.88 1.57 -0.96 -0.89 116.57 122.56 1b5d h LYS 65 Ca 0.31 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 59.00 1b5d h LYS 65 Cb -0.07 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 1b5d h LYS 65 CO -0.09 0.35 -0.18 0.66 -0.57 0.00 0.00 179.45 179.63 1b5d h SER 66 N 0.31 0.00 -0.90 0.86 4.64 -0.94 -3.47 113.55 114.05 1b5d h SER 66 Ca 0.07 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.10 1b5d h SER 66 Cb 0.22 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.21 1b5d h SER 66 CO 0.01 0.18 -0.28 0.29 -0.87 0.00 0.00 176.83 176.15 1b5d n LYS 67 N -3.32 -1.02 -2.78 4.77 5.02 -0.34 -4.97 118.16 115.52 1b5d n LYS 67 Ca 0.00 0.95 -0.41 0.00 -2.02 0.00 0.00 58.31 56.84 1b5d n LYS 67 Cb 0.41 -5.09 -0.05 0.00 -0.02 0.00 0.00 35.03 30.29 1b5d n LYS 67 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1b5d s SER 68 N -2.77 7.46 -0.07 4.39 0.15 -1.25 -4.54 113.70 117.07 1b5d s SER 68 Ca 0.00 1.74 0.12 0.00 0.70 0.00 0.00 55.95 58.51 1b5d s SER 68 Cb 0.00 -2.57 0.45 0.00 -1.71 0.00 0.00 66.02 62.19 1b5d s SER 68 CO 0.00 -0.03 1.31 0.18 1.20 0.00 0.00 173.24 175.90 1b5d n LEU 69 N 2.65 3.13 -4.34 3.45 4.77 -1.26 -4.80 117.00 120.60 1b5d n LEU 69 Ca 0.01 -1.58 -0.33 0.00 -0.03 0.00 0.00 56.01 54.09 1b5d n LEU 69 Cb 0.49 -0.45 -0.15 0.00 -2.33 0.00 0.00 43.42 40.98 1b5d n LEU 69 CO 0.50 0.55 -0.48 -0.36 -1.33 0.00 0.00 177.39 176.27 1b5d s PHE 70 N -1.71 2.73 -0.47 -1.77 0.40 -1.26 -0.44 117.98 115.46 1b5d s PHE 70 Ca 0.32 -0.71 0.25 0.00 -0.60 0.00 0.00 56.93 56.19 1b5d s PHE 70 Cb 0.20 -1.79 0.96 0.00 0.51 0.00 0.00 43.02 42.90 1b5d s PHE 70 CO 0.16 -0.24 1.76 -0.39 0.70 0.00 0.00 175.22 177.21 1b5d h VAL 71 N 5.40 0.00 0.00 -0.44 -1.51 -1.58 -2.78 116.25 115.34 1b5d h VAL 71 Ca -0.25 -0.36 -0.04 0.00 -1.23 0.00 0.00 66.70 64.82 1b5d h VAL 71 Cb 1.21 1.20 -0.01 0.00 -2.13 0.00 0.00 31.29 31.57 1b5d h VAL 71 CO 0.53 0.00 -0.18 0.50 -1.23 0.00 0.00 177.57 177.19 1b5d h LYS 72 N 0.00 0.00 0.00 5.19 3.64 -1.96 -2.76 116.57 120.69 1b5d h LYS 72 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1b5d h LYS 72 Cb 0.50 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1b5d h LYS 72 CO 0.00 0.18 0.00 -0.25 -2.27 0.00 0.00 179.45 177.11 1b5d n ASP 73 N -3.33 0.00 -4.69 4.20 8.00 -1.05 -4.71 116.55 114.98 1b5d n ASP 73 Ca 0.00 -0.91 -0.42 0.00 0.71 0.00 0.00 54.79 54.17 1b5d n ASP 73 Cb 0.41 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.48 1b5d n ASP 73 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1b5d s ILE 74 N -2.00 3.53 0.12 0.53 1.01 -1.04 -4.72 121.20 118.63 1b5d s ILE 74 Ca 0.37 0.91 -0.35 0.00 0.00 0.00 0.00 60.65 61.59 1b5d s ILE 74 Cb 0.17 -3.59 -0.14 0.00 0.01 0.00 0.00 42.46 38.91 1b5d s ILE 74 CO 0.29 -0.01 1.56 -2.65 0.00 0.00 0.00 174.94 174.12 1b5d n PRO 75 N 5.57 1.95 0.00 2.79 -0.02 -1.26 -4.58 135.00 139.44 1b5d n PRO 75 Ca 0.14 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 1b5d n PRO 75 Cb 0.43 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1b5d n PRO 75 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b5d n GLY 76 N 3.34 -0.81 3.65 -1.23 0.00 -1.26 -4.75 105.19 104.14 1b5d n GLY 76 Ca 0.18 -1.33 -0.43 0.00 0.00 0.00 0.00 46.02 44.45 1b5d n GLY 76 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1b5d s GLU 77 N 0.00 4.15 0.10 1.61 2.12 -1.26 -4.98 118.70 120.44 1b5d s GLU 77 Ca 0.00 1.77 -0.31 0.00 0.36 0.00 0.00 54.97 56.79 1b5d s GLU 77 Cb 0.00 -3.86 -0.09 0.00 0.26 0.00 0.00 34.13 30.44 1b5d s GLU 77 CO 0.00 -0.83 1.70 0.99 -0.54 0.00 0.00 175.26 176.57 1b5d s THR 78 N 3.88 2.80 0.55 -1.70 2.01 -1.26 -4.96 115.64 116.96 1b5d s THR 78 Ca 0.62 0.33 -0.21 0.00 0.31 0.00 0.00 61.69 62.73 1b5d s THR 78 Cb -0.25 -3.21 -0.05 0.00 0.01 0.00 0.00 72.50 69.00 1b5d s THR 78 CO 0.21 0.00 1.34 -2.65 -0.69 0.00 0.00 174.62 172.83 1b5d n PRO 79 N 5.38 1.64 0.24 4.92 -0.02 -1.26 -4.86 135.00 141.03 1b5d n PRO 79 Ca 0.16 0.61 0.07 0.00 -2.02 0.00 0.00 63.50 62.32 1b5d n PRO 79 Cb 0.39 -2.56 0.57 0.00 -0.02 0.00 0.00 33.50 31.88 1b5d n PRO 79 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1b5d h LYS 80 N 1.36 0.00 -0.13 -0.52 2.10 -1.99 -1.70 116.57 115.69 1b5d h LYS 80 Ca -0.51 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.12 1b5d h LYS 80 Cb 1.31 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.63 1b5d h LYS 80 CO 0.57 0.15 -0.04 -0.84 -2.00 0.00 0.00 179.45 177.29 1b5d h ILE 81 N 0.00 1.12 0.00 0.07 3.07 -2.00 -0.08 117.51 119.69 1b5d h ILE 81 Ca -0.00 -0.47 -0.19 0.00 1.55 0.00 0.00 64.86 65.75 1b5d h ILE 81 Cb 0.29 1.06 -0.03 0.00 -0.27 0.00 0.00 36.82 37.88 1b5d h ILE 81 CO 0.02 0.15 -1.01 -0.50 -1.05 0.00 0.00 178.15 175.76 1b5d h TRP 82 N 0.19 0.00 -0.28 0.16 4.06 -1.69 -3.27 115.95 115.12 1b5d h TRP 82 Ca 0.04 0.00 -0.15 0.00 2.06 0.00 0.00 58.89 60.84 1b5d h TRP 82 Cb 0.20 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.36 1b5d h TRP 82 CO 0.00 0.81 -0.42 1.96 -3.56 0.00 0.00 178.44 177.23 1b5d h GLN 83 N 0.00 0.77 0.00 0.49 4.20 -0.81 -2.97 115.11 116.79 1b5d h GLN 83 Ca -0.07 -0.46 0.00 0.00 0.06 0.00 0.00 58.65 58.18 1b5d h GLN 83 Cb 1.67 0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.49 1b5d h GLN 83 CO 0.09 1.09 0.00 0.00 -0.67 0.00 0.00 178.83 179.34 1b5d n GLN 84 N -4.15 0.23 0.00 1.46 10.64 -0.15 -2.88 117.38 122.54 1b5d n GLN 84 Ca -0.04 0.34 0.08 0.00 -1.83 0.00 0.00 57.00 55.54 1b5d n GLN 84 Cb 0.55 -1.86 -0.09 0.00 -0.86 0.00 0.00 30.24 27.99 1b5d n GLN 84 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.06 175.51 1b5d n VAL 85 N -2.28 0.00 -2.10 -0.39 0.31 -1.22 -4.81 118.33 107.84 1b5d n VAL 85 Ca 0.04 -0.12 -0.29 0.00 -0.01 0.00 0.00 64.34 63.95 1b5d n VAL 85 Cb 0.32 1.02 0.03 0.00 -0.91 0.00 0.00 33.84 34.30 1b5d n VAL 85 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1b5d s ALA 86 N -2.55 3.11 1.04 3.52 0.00 -1.12 -1.18 121.76 124.58 1b5d s ALA 86 Ca 0.07 -0.37 -0.08 0.00 0.00 0.00 0.00 51.96 51.58 1b5d s ALA 86 Cb 0.13 -2.89 0.11 0.00 0.00 0.00 0.00 23.12 20.47 1b5d s ALA 86 CO 0.67 -0.83 0.54 -1.13 0.00 0.00 0.00 175.76 175.01 1b5d n SER 87 N -2.74 -0.56 0.28 0.00 3.41 0.80 -4.29 113.62 110.52 1b5d n SER 87 Ca 0.05 -1.04 0.18 0.00 -0.26 0.00 0.00 58.87 57.80 1b5d n SER 87 Cb 0.56 -0.44 0.71 0.00 -0.26 0.00 0.00 64.21 64.78 1b5d n SER 87 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1b5d h SER 88 N -1.16 0.00 -0.57 4.04 4.64 -1.72 -1.96 113.55 116.82 1b5d h SER 88 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1b5d h SER 88 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1b5d h SER 88 CO 0.13 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.38 1b5d n LYS 89 N -3.09 2.73 -0.93 4.77 5.02 -1.26 -4.96 118.16 120.44 1b5d n LYS 89 Ca 0.00 -2.41 0.00 0.00 -2.02 0.00 0.00 58.31 53.88 1b5d n LYS 89 Cb 0.29 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 1b5d n LYS 89 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1b5d n GLY 90 N 1.25 0.44 3.87 0.72 0.00 -0.74 -4.97 105.19 105.77 1b5d n GLY 90 Ca 0.20 -0.86 -0.33 0.00 0.00 0.00 0.00 46.02 45.03 1b5d n GLY 90 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1b5d s GLU 91 N -1.57 3.79 0.21 1.61 2.12 -1.26 -1.45 118.70 122.15 1b5d s GLU 91 Ca 0.00 0.22 0.03 0.00 0.36 0.00 0.00 54.97 55.58 1b5d s GLU 91 Cb 0.00 -2.78 -0.01 0.00 0.26 0.00 0.00 34.13 31.60 1b5d s GLU 91 CO 0.00 0.40 0.11 0.44 -0.54 0.00 0.00 175.26 175.68 1b5d n ILE 92 N 0.19 0.00 -0.06 -3.70 -6.64 0.42 -0.14 119.36 109.43 1b5d n ILE 92 Ca -0.02 -1.35 -0.08 0.00 -1.77 0.00 0.00 62.75 59.52 1b5d n ILE 92 Cb 0.52 0.56 -0.06 0.00 -1.44 0.00 0.00 39.64 39.22 1b5d n ILE 92 CO 0.00 0.00 0.00 0.59 -1.77 0.00 0.00 176.55 175.37 1b5d n ASN 93 N -1.96 2.93 -2.65 7.28 3.02 -1.26 -4.86 115.26 117.77 1b5d n ASN 93 Ca -0.00 -0.06 -0.27 0.00 -0.03 0.00 0.00 54.58 54.22 1b5d n ASN 93 Cb 0.34 -0.05 -0.07 0.00 -0.61 0.00 0.00 39.78 39.39 1b5d n ASN 93 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1b5d n SER 94 N -2.79 6.70 -4.53 6.41 7.64 -1.26 -4.82 113.62 120.96 1b5d n SER 94 Ca -0.22 -3.00 -0.43 0.00 1.01 0.00 0.00 58.87 56.24 1b5d n SER 94 Cb 0.75 -1.32 -0.06 0.00 -1.01 0.00 0.00 64.21 62.57 1b5d n SER 94 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1b5d s ASN 95 N 0.83 6.36 0.39 6.43 3.84 -1.26 -4.95 114.94 126.58 1b5d s ASN 95 Ca 0.60 -0.21 0.21 0.00 0.21 0.00 0.00 52.86 53.67 1b5d s ASN 95 Cb 0.32 -2.33 0.72 0.00 -0.55 0.00 0.00 41.25 39.41 1b5d s ASN 95 CO -0.14 -0.77 1.75 1.88 -2.79 0.00 0.00 177.10 177.03 1b5d h TYR 96 N 8.82 0.00 -0.31 0.43 0.05 -1.91 -1.95 116.97 122.10 1b5d h TYR 96 Ca -0.25 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.50 1b5d h TYR 96 Cb 1.10 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.82 1b5d h TYR 96 CO 0.74 0.32 0.10 0.78 -1.05 0.00 0.00 178.16 179.06 1b5d h GLY 97 N 2.20 0.52 0.53 3.88 0.00 -1.92 -1.16 103.07 107.12 1b5d h GLY 97 Ca -0.00 -0.30 0.09 0.00 0.00 0.00 0.00 47.33 47.12 1b5d h GLY 97 CO 0.04 0.28 0.43 -0.25 0.00 0.00 0.00 176.54 177.04 1b5d h TRP 98 N 0.35 0.78 -0.50 5.60 7.01 -1.63 0.75 115.95 128.32 1b5d h TRP 98 Ca 0.10 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.12 1b5d h TRP 98 Cb 0.23 -0.23 -0.02 0.00 -2.10 0.00 0.00 29.16 27.03 1b5d h TRP 98 CO 0.00 0.32 0.26 0.00 -2.79 0.00 0.00 178.44 176.23 1b5d h ALA 99 N 1.43 0.64 0.00 2.65 0.00 -0.78 -1.51 119.26 121.70 1b5d h ALA 99 Ca 0.37 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1b5d h ALA 99 Cb 0.34 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1b5d h ALA 99 CO -0.24 0.18 -1.45 0.44 0.00 0.00 0.00 179.25 178.18 1b5d n ILE 100 N -4.64 0.34 0.21 0.00 -5.35 -0.49 -4.49 119.36 104.94 1b5d n ILE 100 Ca 0.02 -0.52 0.03 0.00 -0.27 0.00 0.00 62.75 62.01 1b5d n ILE 100 Cb 0.10 -0.18 -0.04 0.00 -1.74 0.00 0.00 39.64 37.78 1b5d n ILE 100 CO 0.00 0.00 0.00 0.79 -1.76 0.00 0.00 176.55 175.58 1b5d n TRP 101 N -2.48 0.00 -2.66 4.28 8.01 0.24 -0.88 117.44 123.95 1b5d n TRP 101 Ca -0.02 0.00 -0.37 0.00 -1.31 0.00 0.00 57.50 55.80 1b5d n TRP 101 Cb 0.56 -0.05 -0.05 0.00 -2.01 0.00 0.00 31.31 29.76 1b5d n TRP 101 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13 1b5d s SER 102 N -1.98 7.11 0.39 -0.99 0.15 -0.57 -4.87 113.70 112.94 1b5d s SER 102 Ca 0.01 1.96 0.27 0.00 0.70 0.00 0.00 55.95 58.89 1b5d s SER 102 Cb 0.05 -2.59 0.88 0.00 -1.71 0.00 0.00 66.02 62.65 1b5d s SER 102 CO 0.27 -0.23 1.78 1.05 1.20 0.00 0.00 173.24 177.31 1b5d h GLU 103 N 2.99 0.00 -0.03 5.44 -0.00 -1.95 -2.54 114.58 118.49 1b5d h GLU 103 Ca -0.47 0.00 -0.07 0.00 -0.00 0.00 0.00 59.36 58.81 1b5d h GLU 103 Cb 1.20 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.94 1b5d h GLU 103 CO 0.64 0.00 -0.33 -0.44 -0.00 0.00 0.00 179.01 178.88 1b5d h ASP 104 N 0.00 0.05 -0.75 3.06 3.32 -1.91 -2.11 116.42 118.09 1b5d h ASP 104 Ca 0.00 -0.02 -0.26 0.00 0.02 0.00 0.00 57.03 56.78 1b5d h ASP 104 Cb 0.67 -0.01 -0.15 0.00 0.22 0.00 0.00 39.33 40.05 1b5d h ASP 104 CO 0.00 0.38 0.31 -3.20 -1.72 0.00 0.00 179.24 175.01 1b5d n ASN 105 N -4.13 4.52 -1.80 6.45 5.15 -1.14 -4.96 115.26 119.35 1b5d n ASN 105 Ca -0.02 -3.31 -0.14 0.00 -0.60 0.00 0.00 54.58 50.51 1b5d n ASN 105 Cb 0.38 -0.75 0.01 0.00 -0.53 0.00 0.00 39.78 38.89 1b5d n ASN 105 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1b5d n TYR 106 N -0.38 -0.92 -3.24 1.20 4.02 -0.79 -4.20 117.16 112.84 1b5d n TYR 106 Ca 0.43 0.14 -0.15 0.00 -0.01 0.00 0.00 57.90 58.31 1b5d n TYR 106 Cb 1.40 -3.15 0.07 0.00 -0.02 0.00 0.00 39.34 37.64 1b5d n TYR 106 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1b5d n ALA 107 N -2.18 -2.24 0.03 -0.72 0.00 -0.97 -4.86 120.51 109.57 1b5d n ALA 107 Ca -0.13 0.07 -0.12 0.00 0.00 0.00 0.00 53.44 53.25 1b5d n ALA 107 Cb 0.61 -4.45 -0.08 0.00 0.00 0.00 0.00 19.45 15.53 1b5d n ALA 107 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1b5d h GLN 108 N -1.30 -0.01 -0.09 0.00 1.08 -1.68 -1.84 115.11 111.27 1b5d h GLN 108 Ca -0.58 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 56.63 1b5d h GLN 108 Cb 1.31 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.73 1b5d h GLN 108 CO 0.44 0.12 0.04 -0.92 -0.95 0.00 0.00 178.83 177.56 1b5d h TYR 109 N -0.14 0.07 -0.53 2.96 3.20 -1.34 -1.92 116.97 119.26 1b5d h TYR 109 Ca -0.00 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.80 1b5d h TYR 109 Cb 0.14 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.37 1b5d h TYR 109 CO -0.03 0.04 0.03 -0.44 -1.64 0.00 0.00 178.16 176.12 1b5d h ASP 110 N 0.08 0.83 0.15 -2.11 3.32 -1.77 -1.11 116.42 115.82 1b5d h ASP 110 Ca 0.03 -0.20 -0.22 0.00 0.02 0.00 0.00 57.03 56.66 1b5d h ASP 110 Cb 0.01 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 39.34 1b5d h ASP 110 CO -0.03 0.88 -0.88 0.24 -1.72 0.00 0.00 179.24 177.73 1b5d h MET 111 N 0.82 0.55 -0.20 3.56 2.86 -1.20 -1.46 114.93 119.86 1b5d h MET 111 Ca 0.16 -0.52 -0.10 0.00 -2.06 0.00 0.00 59.70 57.18 1b5d h MET 111 Cb 0.44 0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.22 1b5d h MET 111 CO 0.02 1.15 -0.31 0.00 1.06 0.00 0.00 176.91 178.83 1b5d h LEU 113 N 0.34 1.01 -0.52 0.00 5.85 -1.13 -1.99 115.31 118.87 1b5d h LEU 113 Ca 0.04 -0.41 -0.15 0.00 0.84 0.00 0.00 57.88 58.21 1b5d h LEU 113 Cb 0.71 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 1b5d h LEU 113 CO 0.05 1.19 -0.40 0.00 -0.34 0.00 0.00 178.44 178.95 1b5d h ALA 114 N 0.85 0.70 0.36 1.25 0.00 -1.13 -0.57 119.26 120.71 1b5d h ALA 114 Ca 0.10 -0.45 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 1b5d h ALA 114 Cb 0.82 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1b5d h ALA 114 CO 0.07 0.67 -0.17 1.49 0.00 0.00 0.00 179.25 181.30 1b5d h GLU 115 N 0.62 -0.46 0.00 0.00 4.57 -1.21 -2.42 114.58 115.67 1b5d h GLU 115 Ca 0.05 0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.21 1b5d h GLU 115 Cb 0.96 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.64 1b5d h GLU 115 CO 0.09 -0.27 -0.23 -0.07 -1.18 0.00 0.00 179.01 177.35 1b5d h LEU 116 N -0.54 0.00 -0.42 1.64 3.38 -1.30 -0.17 115.31 117.90 1b5d h LEU 116 Ca -0.05 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 1b5d h LEU 116 Cb 0.40 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1b5d h LEU 116 CO 0.08 0.23 -0.52 1.23 0.09 0.00 0.00 178.44 179.55 1b5d h GLY 117 N 1.63 0.00 0.70 0.83 0.00 -1.05 -3.08 103.07 102.10 1b5d h GLY 117 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 46.97 1b5d h GLY 117 CO 0.03 0.00 -1.93 -1.61 0.00 0.00 0.00 176.54 173.03 1b5d h GLN 118 N 0.00 0.29 -3.01 4.80 4.15 -0.94 -3.44 115.11 116.96 1b5d h GLN 118 Ca -0.01 -0.50 -0.55 0.00 0.77 0.00 0.00 58.65 58.37 1b5d h GLN 118 Cb 1.23 0.18 -0.40 0.00 0.21 0.00 0.00 27.48 28.70 1b5d h GLN 118 CO 0.07 1.22 -0.77 1.21 -1.93 0.00 0.00 178.83 178.63 1b5d s ASN 119 N -7.08 3.67 0.59 -0.69 3.04 -0.12 -5.01 114.94 109.34 1b5d s ASN 119 Ca -0.20 -1.44 0.30 0.00 0.04 0.00 0.00 52.86 51.56 1b5d s ASN 119 Cb 0.06 -0.51 1.80 0.00 -1.54 0.00 0.00 41.25 41.06 1b5d s ASN 119 CO 0.79 -0.43 2.21 -0.65 -3.04 0.00 0.00 177.10 175.98 1b5d h PRO 120 N 8.25 0.00 -0.01 0.43 0.11 -1.78 -1.71 132.00 137.28 1b5d h PRO 120 Ca -0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 1b5d h PRO 120 Cb 1.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1b5d h PRO 120 CO 0.44 0.00 -0.04 -0.25 -0.21 0.00 0.00 178.00 177.95 1b5d n ASP 121 N -3.79 1.30 -4.64 -2.05 8.00 -1.26 -4.06 116.55 110.05 1b5d n ASP 121 Ca -0.02 -1.35 -0.43 0.00 0.71 0.00 0.00 54.79 53.70 1b5d n ASP 121 Cb 0.16 0.02 -0.00 0.00 -0.02 0.00 0.00 41.12 41.27 1b5d n ASP 121 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1b5d n SER 122 N -0.05 1.95 -0.65 -2.24 2.88 -0.64 -4.92 113.62 109.94 1b5d n SER 122 Ca 0.18 1.16 0.13 0.00 -1.33 0.00 0.00 58.87 59.01 1b5d n SER 122 Cb 0.33 -1.39 0.27 0.00 -0.75 0.00 0.00 64.21 62.67 1b5d n SER 122 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1b5d n ARG 123 N 0.49 1.78 -0.49 -1.46 1.74 -1.26 -4.27 116.66 113.19 1b5d n ARG 123 Ca 0.07 -1.30 0.09 0.00 -0.77 0.00 0.00 57.85 55.94 1b5d n ARG 123 Cb 0.36 -1.47 0.32 0.00 -1.02 0.00 0.00 32.46 30.64 1b5d n ARG 123 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1b5d n ARG 124 N 0.53 3.16 -2.71 5.56 1.74 -1.26 -4.86 116.66 118.82 1b5d n ARG 124 Ca 0.15 -2.54 -0.42 0.00 -0.77 0.00 0.00 57.85 54.27 1b5d n ARG 124 Cb 0.47 -1.73 -0.03 0.00 -1.02 0.00 0.00 32.46 30.15 1b5d n ARG 124 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1b5d s GLY 125 N -0.91 1.27 -0.06 -0.13 0.00 -1.26 -4.95 107.32 101.28 1b5d s GLY 125 Ca 0.46 -1.90 -0.12 0.00 0.00 0.00 0.00 44.72 43.16 1b5d s GLY 125 CO 0.25 2.36 0.29 -1.50 0.00 0.00 0.00 173.10 174.51 1b5d s ILE 126 N 4.58 0.03 -0.27 0.90 2.07 -1.26 -0.51 121.20 126.74 1b5d s ILE 126 Ca 0.32 -0.27 -0.03 0.00 -1.41 0.00 0.00 60.65 59.27 1b5d s ILE 126 Cb -0.09 -0.51 0.03 0.00 0.13 0.00 0.00 42.46 42.02 1b5d s ILE 126 CO 0.05 -0.15 -0.01 -0.04 -1.91 0.00 0.00 174.94 172.88 1b5d s MET 127 N -0.61 2.83 -0.46 3.50 -1.94 0.16 -4.55 119.30 118.22 1b5d s MET 127 Ca -0.07 -1.00 -0.19 0.00 -1.71 0.00 0.00 55.69 52.72 1b5d s MET 127 Cb -0.04 -3.13 0.04 0.00 2.01 0.00 0.00 34.83 33.71 1b5d s MET 127 CO 0.02 -0.45 0.58 0.42 -0.01 0.00 0.00 175.02 175.57 1b5d s ILE 128 N 1.36 4.92 -0.14 2.53 1.01 -1.26 -1.02 121.20 128.60 1b5d s ILE 128 Ca -0.00 -0.25 -0.18 0.00 0.00 0.00 0.00 60.65 60.22 1b5d s ILE 128 Cb -0.17 -4.19 -0.15 0.00 0.01 0.00 0.00 42.46 37.95 1b5d s ILE 128 CO -0.02 -0.62 0.39 1.88 0.00 0.00 0.00 174.94 176.57 1b5d h TYR 129 N 8.88 0.00 -4.25 3.97 -1.99 -1.48 -3.48 116.97 118.62 1b5d h TYR 129 Ca -0.26 0.00 -0.46 0.00 2.00 0.00 0.00 58.73 60.01 1b5d h TYR 129 Cb 1.10 0.00 0.13 0.00 2.00 0.00 0.00 36.73 39.96 1b5d h TYR 129 CO 0.70 0.68 0.40 -0.08 -0.00 0.00 0.00 178.16 179.87 1b5d s THR 130 N -2.03 2.01 0.01 -2.88 -1.32 -1.05 -4.98 115.64 105.40 1b5d s THR 130 Ca -0.14 -0.02 -0.16 0.00 -1.21 0.00 0.00 61.69 60.16 1b5d s THR 130 Cb -0.01 -2.99 0.03 0.00 -1.51 0.00 0.00 72.50 68.02 1b5d s THR 130 CO 0.43 0.00 0.34 0.00 -2.21 0.00 0.00 174.62 173.18 1b5d s ARG 131 N -5.70 0.76 0.29 7.08 1.70 -1.26 -5.06 118.95 116.76 1b5d s ARG 131 Ca 0.68 -0.28 0.04 0.00 -0.47 0.00 0.00 55.73 55.70 1b5d s ARG 131 Cb -0.07 0.34 0.65 0.00 -0.57 0.00 0.00 34.95 35.30 1b5d s ARG 131 CO 0.51 -0.23 1.80 -1.35 -1.08 0.00 0.00 175.30 174.95 1b5d h PRO 132 N 3.53 0.84 0.00 3.89 0.11 -2.04 -1.39 132.00 136.94 1b5d h PRO 132 Ca -0.30 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1b5d h PRO 132 Cb 1.18 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1b5d h PRO 132 CO 0.42 0.55 0.00 -1.13 -0.21 0.00 0.00 178.00 177.64 1b5d n SER 133 N -4.71 0.00 0.30 -2.05 3.41 -1.26 -2.63 113.62 106.68 1b5d n SER 133 Ca 0.21 -0.01 0.20 0.00 -0.26 0.00 0.00 58.87 59.02 1b5d n SER 133 Cb 0.48 -0.24 1.08 0.00 -0.26 0.00 0.00 64.21 65.27 1b5d n SER 133 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 1b5d h MET 134 N 0.00 0.00 0.00 4.33 -1.53 -1.65 0.72 114.93 116.80 1b5d h MET 134 Ca 0.00 0.00 -0.02 0.00 -3.44 0.00 0.00 59.70 56.24 1b5d h MET 134 Cb 0.11 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.16 1b5d h MET 134 CO 0.00 0.00 -0.10 1.96 0.14 0.00 0.00 176.91 178.91 1b5d h GLN 135 N 0.00 0.00 0.00 0.39 1.08 -1.73 -3.02 115.11 111.83 1b5d h GLN 135 Ca 0.00 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.02 1b5d h GLN 135 Cb 0.01 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.41 1b5d h GLN 135 CO 0.00 0.10 -1.76 1.19 -0.95 0.00 0.00 178.83 177.41 1b5d n PHE 136 N -4.18 0.00 0.45 2.96 3.72 -0.05 -4.69 117.46 115.67 1b5d n PHE 136 Ca -0.03 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.51 1b5d n PHE 136 Cb 0.18 -0.53 0.41 0.00 -0.94 0.00 0.00 39.48 38.60 1b5d n PHE 136 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1b5d h ASP 137 N 0.00 0.00 0.70 4.37 3.32 -0.91 -3.35 116.42 120.56 1b5d h ASP 137 Ca -0.27 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.78 1b5d h ASP 137 Cb 1.55 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.10 1b5d h ASP 137 CO 0.01 0.00 -0.02 0.10 -1.72 0.00 0.00 179.24 177.61 1b5d h TYR 138 N 0.00 0.00 0.00 4.55 -0.00 -1.75 -2.91 116.97 116.87 1b5d h TYR 138 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 58.73 58.67 1b5d h TYR 138 Cb 0.67 0.00 -0.13 0.00 -0.00 0.00 0.00 36.73 37.27 1b5d h TYR 138 CO 0.00 0.02 -0.65 0.27 -0.00 0.00 0.00 178.16 177.80 1b5d n ASN 139 N -3.15 1.44 -4.71 0.10 6.94 -1.25 -0.65 115.26 113.98 1b5d n ASN 139 Ca -0.01 -3.12 -0.43 0.00 -0.02 0.00 0.00 54.58 51.00 1b5d n ASN 139 Cb 0.25 -0.43 -0.03 0.00 -2.36 0.00 0.00 39.78 37.20 1b5d n ASN 139 CO 0.00 0.00 0.00 1.17 -1.03 0.00 0.00 177.26 177.40 1b5d n LYS 140 N -0.54 2.57 -2.23 -3.83 4.81 -1.10 -1.29 118.16 116.54 1b5d n LYS 140 Ca 0.14 0.92 -0.12 0.00 -0.87 0.00 0.00 58.31 58.38 1b5d n LYS 140 Cb 0.84 -2.74 -0.02 0.00 0.02 0.00 0.00 35.03 33.14 1b5d n LYS 140 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1b5d n ASP 141 N 3.58 -3.80 0.00 3.14 8.00 -1.26 -1.47 116.55 124.74 1b5d n ASP 141 Ca 0.15 0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.87 1b5d n ASP 141 Cb 0.33 -3.29 0.00 0.00 -0.02 0.00 0.00 41.12 38.14 1b5d n ASP 141 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1b5d n GLY 142 N -0.70 0.49 3.79 0.44 0.00 -0.41 -2.13 105.19 106.67 1b5d n GLY 142 Ca -0.14 -0.51 -0.30 0.00 0.00 0.00 0.00 46.02 45.07 1b5d n GLY 142 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1b5d s MET 143 N -0.97 2.10 -0.50 1.61 0.23 -0.54 -4.60 119.30 116.63 1b5d s MET 143 Ca 0.00 0.79 0.03 0.00 -1.03 0.00 0.00 55.69 55.49 1b5d s MET 143 Cb 0.00 -1.91 0.16 0.00 -1.53 0.00 0.00 34.83 31.55 1b5d s MET 143 CO 0.00 -1.65 0.34 0.45 -2.03 0.00 0.00 175.02 172.13 1b5d s SER 144 N -3.73 3.19 -0.40 -1.18 0.15 -0.32 -3.91 113.70 107.50 1b5d s SER 144 Ca 0.61 -3.07 0.04 0.00 0.70 0.00 0.00 55.95 54.23 1b5d s SER 144 Cb -0.15 -0.96 0.17 0.00 -1.71 0.00 0.00 66.02 63.36 1b5d s SER 144 CO 0.55 -0.19 0.44 -0.62 1.20 0.00 0.00 173.24 174.62 1b5d s ASP 145 N -0.18 0.65 -0.35 5.45 2.15 0.18 -4.82 116.67 119.74 1b5d s ASP 145 Ca 0.25 -1.85 -0.17 0.00 0.43 0.00 0.00 52.55 51.21 1b5d s ASP 145 Cb -0.10 0.66 -0.00 0.00 -0.30 0.00 0.00 42.92 43.18 1b5d s ASP 145 CO -0.11 -0.20 0.45 0.12 -0.17 0.00 0.00 175.17 175.26 1b5d s PHE 146 N 1.10 3.19 -0.39 -5.34 2.19 -1.26 -4.46 117.98 113.01 1b5d s PHE 146 Ca 0.22 0.06 -0.44 0.00 0.33 0.00 0.00 56.93 57.10 1b5d s PHE 146 Cb -0.09 -2.83 -0.18 0.00 -1.31 0.00 0.00 43.02 38.62 1b5d s PHE 146 CO -0.06 -0.51 1.66 -0.12 1.83 0.00 0.00 175.22 178.02 1b5d n MET 147 N 5.59 0.56 0.05 10.12 0.00 -1.26 -4.89 117.12 127.30 1b5d n MET 147 Ca -0.07 0.21 -0.09 0.00 -0.00 0.00 0.00 57.70 57.74 1b5d n MET 147 Cb 0.49 -1.79 -0.13 0.00 0.00 0.00 0.00 33.22 31.79 1b5d n MET 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1b5d s THR 149 N -2.68 5.18 -0.08 0.00 2.01 -1.26 -0.19 115.64 118.63 1b5d s THR 149 Ca -0.02 0.80 -0.04 0.00 0.31 0.00 0.00 61.69 62.75 1b5d s THR 149 Cb 0.09 -3.76 -0.01 0.00 0.01 0.00 0.00 72.50 68.82 1b5d s THR 149 CO 0.83 0.26 -0.07 0.78 -0.69 0.00 0.00 174.62 175.73 1b5d h ASN 150 N 7.23 0.00 -5.06 3.53 2.35 -0.99 -3.29 115.58 119.35 1b5d h ASN 150 Ca -0.37 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.27 1b5d h ASN 150 Cb 1.16 0.00 -0.18 0.00 0.05 0.00 0.00 38.32 39.35 1b5d h ASN 150 CO 0.73 0.40 -0.42 0.42 -1.65 0.00 0.00 177.43 176.91 1b5d s THR 151 N -1.61 0.11 -0.12 2.81 -4.23 -1.08 -1.37 115.64 110.15 1b5d s THR 151 Ca -0.06 -0.87 0.00 0.00 -1.18 0.00 0.00 61.69 59.58 1b5d s THR 151 Cb 0.01 -0.83 0.02 0.00 1.34 0.00 0.00 72.50 73.04 1b5d s THR 151 CO 0.09 -0.48 -0.10 -0.69 -0.54 0.00 0.00 174.62 172.90 1b5d s VAL 152 N -2.36 1.16 -0.01 2.29 1.01 -0.19 -0.83 120.40 121.48 1b5d s VAL 152 Ca -0.07 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 1b5d s VAL 152 Cb -0.02 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 1b5d s VAL 152 CO -0.03 0.39 0.09 -1.58 0.00 0.00 0.00 175.10 173.96 1b5d s GLN 153 N 1.54 3.08 -0.13 2.72 0.74 -0.40 0.36 119.66 127.58 1b5d s GLN 153 Ca 0.03 -0.48 0.02 0.00 0.05 0.00 0.00 55.36 54.99 1b5d s GLN 153 Cb -0.13 -2.87 0.01 0.00 1.10 0.00 0.00 33.01 31.12 1b5d s GLN 153 CO -0.07 0.65 -0.20 0.71 -0.55 0.00 0.00 175.29 175.82 1b5d s TYR 154 N -1.20 2.50 -0.14 1.67 2.02 0.34 -0.36 117.35 122.18 1b5d s TYR 154 Ca 0.23 -1.24 0.00 0.00 -0.37 0.00 0.00 57.07 55.69 1b5d s TYR 154 Cb -0.12 -1.72 0.02 0.00 -0.40 0.00 0.00 41.96 39.74 1b5d s TYR 154 CO 0.14 -0.58 -0.13 -0.51 -1.57 0.00 0.00 175.55 172.90 1b5d s LEU 155 N 0.85 1.59 -0.38 -1.29 1.43 -0.15 -4.48 118.68 116.25 1b5d s LEU 155 Ca -0.07 -0.45 -0.19 0.00 -1.03 0.00 0.00 54.13 52.38 1b5d s LEU 155 Cb -0.15 -1.11 0.01 0.00 0.03 0.00 0.00 46.19 44.96 1b5d s LEU 155 CO -0.02 -0.07 0.56 -0.63 0.23 0.00 0.00 176.35 176.43 1b5d s ILE 156 N 1.53 4.95 -0.02 -0.59 1.01 -1.26 -0.64 121.20 126.18 1b5d s ILE 156 Ca 0.05 0.27 -0.00 0.00 0.00 0.00 0.00 60.65 60.97 1b5d s ILE 156 Cb -0.13 -4.05 0.03 0.00 0.01 0.00 0.00 42.46 38.32 1b5d s ILE 156 CO -0.10 -0.35 0.04 -0.13 0.00 0.00 0.00 174.94 174.40 1b5d s ARG 157 N 2.53 -0.03 -1.45 2.79 1.81 -0.46 -4.65 118.95 119.49 1b5d s ARG 157 Ca 0.20 0.21 -0.12 0.00 -1.72 0.00 0.00 55.73 54.30 1b5d s ARG 157 Cb -0.15 -0.25 0.05 0.00 -0.45 0.00 0.00 34.95 34.14 1b5d s ARG 157 CO 0.15 -0.18 1.09 -0.25 -0.68 0.00 0.00 175.30 175.43 1b5d n ASP 158 N 4.23 -5.61 -1.13 0.23 8.00 -1.26 -1.95 116.55 119.06 1b5d n ASP 158 Ca -0.27 -0.66 -0.14 0.00 0.71 0.00 0.00 54.79 54.42 1b5d n ASP 158 Cb 0.50 -4.44 -0.06 0.00 -0.02 0.00 0.00 41.12 37.10 1b5d n ASP 158 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1b5d n LYS 159 N -4.85 -1.61 -4.87 -1.24 5.02 -1.26 -4.96 118.16 104.39 1b5d n LYS 159 Ca 0.03 0.99 -0.33 0.00 -2.02 0.00 0.00 58.31 56.98 1b5d n LYS 159 Cb 0.54 -5.39 -0.13 0.00 -0.02 0.00 0.00 35.03 30.03 1b5d n LYS 159 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1b5d s LYS 160 N -3.21 2.58 -0.36 1.97 1.02 -0.82 -1.00 119.74 119.92 1b5d s LYS 160 Ca 0.00 -0.69 -0.13 0.00 0.02 0.00 0.00 55.97 55.17 1b5d s LYS 160 Cb 0.00 -2.41 -0.00 0.00 -0.52 0.00 0.00 37.83 34.90 1b5d s LYS 160 CO 0.00 0.59 0.25 0.42 -0.92 0.00 0.00 175.35 175.70 1b5d s ILE 161 N -0.65 5.20 -0.09 2.17 1.01 0.20 -1.35 121.20 127.68 1b5d s ILE 161 Ca 0.10 -0.40 -0.12 0.00 0.00 0.00 0.00 60.65 60.23 1b5d s ILE 161 Cb -0.11 -3.75 -0.05 0.00 0.01 0.00 0.00 42.46 38.56 1b5d s ILE 161 CO 0.01 -0.11 0.29 0.20 0.00 0.00 0.00 174.94 175.33 1b5d s ASN 162 N 1.69 6.56 -0.19 3.58 0.01 0.19 0.05 114.94 126.82 1b5d s ASN 162 Ca 0.05 0.66 -0.07 0.00 -0.71 0.00 0.00 52.86 52.79 1b5d s ASN 162 Cb -0.18 -2.17 -0.04 0.00 0.41 0.00 0.00 41.25 39.27 1b5d s ASN 162 CO 0.10 0.27 0.06 0.00 -1.51 0.00 0.00 177.10 176.02 1b5d s ALA 163 N -0.52 3.36 -0.35 0.60 0.00 -0.13 -0.97 121.76 123.75 1b5d s ALA 163 Ca 0.19 -0.81 -0.06 0.00 0.00 0.00 0.00 51.96 51.27 1b5d s ALA 163 Cb -0.14 -1.95 0.05 0.00 0.00 0.00 0.00 23.12 21.08 1b5d s ALA 163 CO 0.07 0.06 0.13 0.08 0.00 0.00 0.00 175.76 176.10 1b5d s VAL 164 N 0.59 3.72 -0.29 0.00 1.01 0.51 -0.51 120.40 125.43 1b5d s VAL 164 Ca 0.03 -1.29 -0.13 0.00 0.00 0.00 0.00 61.98 60.59 1b5d s VAL 164 Cb -0.13 -3.18 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 1b5d s VAL 164 CO 0.01 -0.27 0.29 -0.69 0.00 0.00 0.00 175.10 174.44 1b5d s VAL 165 N 1.36 5.23 -0.36 2.92 1.01 0.02 -1.27 120.40 129.32 1b5d s VAL 165 Ca -0.00 0.28 -0.06 0.00 0.00 0.00 0.00 61.98 62.20 1b5d s VAL 165 Cb -0.20 -3.65 0.06 0.00 0.00 0.00 0.00 36.38 32.58 1b5d s VAL 165 CO 0.02 0.14 0.14 0.21 0.00 0.00 0.00 175.10 175.61 1b5d s ASN 166 N 1.71 5.34 0.04 3.32 2.47 -0.01 -0.71 114.94 127.10 1b5d s ASN 166 Ca 0.11 -1.34 0.05 0.00 0.42 0.00 0.00 52.86 52.10 1b5d s ASN 166 Cb -0.16 -1.87 -0.04 0.00 -1.45 0.00 0.00 41.25 37.73 1b5d s ASN 166 CO 0.11 -0.39 -0.09 -0.04 -3.72 0.00 0.00 177.10 172.96 1b5d s MET 167 N 1.36 2.35 0.06 0.43 -1.94 0.50 -0.34 119.30 121.73 1b5d s MET 167 Ca 0.00 -0.86 -0.12 0.00 -1.71 0.00 0.00 55.69 53.00 1b5d s MET 167 Cb -0.21 -2.40 -0.27 0.00 2.01 0.00 0.00 34.83 33.96 1b5d s MET 167 CO 0.01 0.56 1.12 -0.09 -0.01 0.00 0.00 175.02 176.62 1b5d h ARG 168 N 4.22 0.54 -2.18 2.03 2.43 -0.87 0.04 114.38 120.60 1b5d h ARG 168 Ca -0.48 -0.75 -0.04 0.00 -0.81 0.00 0.00 59.98 57.89 1b5d h ARG 168 Cb 1.16 0.25 -0.22 0.00 -0.42 0.00 0.00 29.97 30.75 1b5d h ARG 168 CO 0.53 1.34 -0.01 0.45 -1.51 0.00 0.00 179.97 180.76 1b5d s SER 169 N -7.37 -0.74 -0.21 -3.80 0.15 -1.24 -1.60 113.70 98.89 1b5d s SER 169 Ca -0.08 1.32 -0.07 0.00 0.70 0.00 0.00 55.95 57.82 1b5d s SER 169 Cb 0.06 1.27 0.10 0.00 -1.71 0.00 0.00 66.02 65.74 1b5d s SER 169 CO 0.92 -0.22 0.42 0.21 1.20 0.00 0.00 173.24 175.77 1b5d s ASN 170 N 0.88 -0.25 0.07 5.45 3.04 -0.72 -4.78 114.94 118.64 1b5d s ASN 170 Ca -0.04 0.94 -0.31 0.00 0.04 0.00 0.00 52.86 53.49 1b5d s ASN 170 Cb -0.05 1.36 -0.07 0.00 -1.54 0.00 0.00 41.25 40.95 1b5d s ASN 170 CO -0.07 -0.24 1.39 -0.62 -3.04 0.00 0.00 177.10 174.52 1b5d s ASP 171 N 2.62 6.84 0.24 -4.21 2.15 -1.26 -2.12 116.67 120.92 1b5d s ASP 171 Ca -0.00 2.25 -0.06 0.00 0.43 0.00 0.00 52.55 55.17 1b5d s ASP 171 Cb -0.12 -2.58 0.25 0.00 -0.30 0.00 0.00 42.92 40.17 1b5d s ASP 171 CO -0.13 -0.67 1.82 0.58 -0.17 0.00 0.00 175.17 176.60 1b5d h VAL 172 N 4.50 1.25 0.00 1.11 2.07 -1.36 -0.41 116.25 123.41 1b5d h VAL 172 Ca -0.41 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.37 1b5d h VAL 172 Cb 1.20 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 1b5d h VAL 172 CO 0.88 0.31 -0.21 0.58 0.02 0.00 0.00 177.57 179.15 1b5d h VAL 173 N 1.11 0.00 0.08 2.57 2.07 -1.83 -3.37 116.25 116.88 1b5d h VAL 173 Ca 0.26 -0.98 -0.32 0.00 0.82 0.00 0.00 66.70 66.48 1b5d h VAL 173 Cb 0.16 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.91 1b5d h VAL 173 CO -0.03 0.00 -1.75 0.49 0.02 0.00 0.00 177.57 176.30 1b5d n PHE 174 N -4.66 1.18 0.23 1.57 3.72 -1.26 -4.26 117.46 113.97 1b5d n PHE 174 Ca -0.03 0.33 -0.15 0.00 -0.05 0.00 0.00 57.45 57.54 1b5d n PHE 174 Cb 0.11 -1.14 -0.08 0.00 -0.94 0.00 0.00 39.48 37.42 1b5d n PHE 174 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1b5d h GLY 175 N 0.35 -0.55 1.00 1.37 0.00 -1.74 -2.60 103.07 100.89 1b5d h GLY 175 Ca -0.40 0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.14 1b5d h GLY 175 CO -0.02 -0.20 0.38 -2.75 0.00 0.00 0.00 176.54 173.95 1b5d h PHE 176 N -0.57 0.77 -0.42 5.60 3.57 -1.24 0.21 116.94 124.86 1b5d h PHE 176 Ca -0.05 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.45 1b5d h PHE 176 Cb 0.43 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 1b5d h PHE 176 CO -0.04 0.51 0.24 -0.09 -2.23 0.00 0.00 178.31 176.70 1b5d h ARG 177 N 0.81 0.58 -0.19 1.11 2.43 -1.73 0.25 114.38 117.65 1b5d h ARG 177 Ca 0.22 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.21 1b5d h ARG 177 Cb -0.05 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 1b5d h ARG 177 CO -0.04 0.45 -0.35 -0.91 -1.51 0.00 0.00 179.97 177.61 1b5d h ASN 178 N 0.55 0.63 -0.24 -3.80 2.35 -1.14 -2.68 115.58 111.26 1b5d h ASN 178 Ca 0.15 -0.54 -0.13 0.00 -0.55 0.00 0.00 56.30 55.23 1b5d h ASN 178 Cb 0.04 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 1b5d h ASN 178 CO -0.03 1.05 -0.31 0.44 -1.65 0.00 0.00 177.43 176.94 1b5d h ASP 179 N 0.23 0.77 -0.25 5.81 3.32 -0.46 -2.09 116.42 123.75 1b5d h ASP 179 Ca 0.01 -0.31 -0.02 0.00 0.02 0.00 0.00 57.03 56.73 1b5d h ASP 179 Cb 0.94 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 1b5d h ASP 179 CO 0.08 1.02 0.09 0.22 -1.72 0.00 0.00 179.24 178.93 1b5d h TYR 180 N 0.63 0.40 -0.96 4.55 3.20 -0.55 -1.23 116.97 123.01 1b5d h TYR 180 Ca 0.07 -0.04 0.11 0.00 3.14 0.00 0.00 58.73 62.02 1b5d h TYR 180 Cb 0.83 -0.12 -0.08 0.00 1.54 0.00 0.00 36.73 38.91 1b5d h TYR 180 CO 0.04 0.43 0.61 0.00 -1.64 0.00 0.00 178.16 177.61 1b5d h ALA 181 N 0.92 1.58 -0.11 1.82 0.00 -1.29 0.69 119.26 122.88 1b5d h ALA 181 Ca 0.08 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1b5d h ALA 181 Cb 0.21 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1b5d h ALA 181 CO -0.00 0.19 -0.04 2.35 0.00 0.00 0.00 179.25 181.74 1b5d h TRP 182 N 0.94 0.25 -0.22 0.00 2.91 -1.20 -1.71 115.95 116.92 1b5d h TRP 182 Ca 0.47 -0.06 -0.12 0.00 1.13 0.00 0.00 58.89 60.30 1b5d h TRP 182 Cb 0.47 -0.06 -0.01 0.00 -0.51 0.00 0.00 29.16 29.05 1b5d h TRP 182 CO -0.00 0.56 -0.38 1.96 -1.03 0.00 0.00 178.44 179.55 1b5d h GLN 183 N -0.13 0.48 -0.28 2.65 1.08 -0.69 -1.59 115.11 116.63 1b5d h GLN 183 Ca 0.02 -0.23 -0.01 0.00 -1.45 0.00 0.00 58.65 56.98 1b5d h GLN 183 Cb 0.49 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.90 1b5d h GLN 183 CO 0.01 0.79 0.13 -0.22 -0.95 0.00 0.00 178.83 178.59 1b5d h LYS 184 N 0.41 0.40 -0.38 1.46 1.63 -0.88 -1.15 116.57 118.06 1b5d h LYS 184 Ca 0.04 -0.06 0.08 0.00 -0.85 0.00 0.00 60.65 59.86 1b5d h LYS 184 Cb 0.85 -0.07 -0.07 0.00 -0.60 0.00 0.00 32.23 32.33 1b5d h LYS 184 CO 0.07 0.40 -0.10 -0.92 -3.45 0.00 0.00 179.45 175.45 1b5d h TYR 185 N 0.31 -0.22 -0.30 1.91 3.20 -1.02 -0.36 116.97 120.49 1b5d h TYR 185 Ca 0.09 0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.85 1b5d h TYR 185 Cb 0.13 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 1b5d h TYR 185 CO -0.02 -0.17 -0.41 0.28 -1.64 0.00 0.00 178.16 176.20 1b5d h VAL 186 N -0.01 1.29 -0.19 1.81 2.07 -1.16 -1.34 116.25 118.72 1b5d h VAL 186 Ca 0.18 -1.59 -0.00 0.00 0.82 0.00 0.00 66.70 66.11 1b5d h VAL 186 Cb 0.29 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 1b5d h VAL 186 CO -0.40 0.51 0.10 0.25 0.02 0.00 0.00 177.57 178.06 1b5d h LEU 187 N 0.60 0.24 -0.99 2.57 5.85 -0.76 -0.21 115.31 122.61 1b5d h LEU 187 Ca 0.05 -0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.71 1b5d h LEU 187 Cb 0.96 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.87 1b5d h LEU 187 CO 0.09 0.27 0.65 0.44 -0.34 0.00 0.00 178.44 179.55 1b5d h ASP 188 N 0.19 1.07 -0.36 1.25 3.32 -0.97 -1.41 116.42 119.51 1b5d h ASP 188 Ca 0.07 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 1b5d h ASP 188 Cb 0.09 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1b5d h ASP 188 CO -0.01 0.72 0.15 0.50 -1.72 0.00 0.00 179.24 178.88 1b5d h LYS 189 N 1.23 0.53 -0.49 3.56 3.11 -0.87 -1.95 116.57 121.70 1b5d h LYS 189 Ca 0.40 -0.09 -0.03 0.00 -2.81 0.00 0.00 60.65 58.12 1b5d h LYS 189 Cb 0.05 -0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 31.17 1b5d h LYS 189 CO -0.14 0.51 0.17 1.25 -2.81 0.00 0.00 179.45 178.43 1b5d h LEU 190 N 0.43 0.69 -0.31 5.20 5.85 -0.48 -0.86 115.31 125.83 1b5d h LEU 190 Ca 0.12 -0.19 0.05 0.00 0.84 0.00 0.00 57.88 58.70 1b5d h LEU 190 Cb 0.17 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 1b5d h LEU 190 CO -0.01 0.69 0.03 0.58 -0.34 0.00 0.00 178.44 179.39 1b5d h VAL 191 N 0.65 0.81 -0.44 1.05 2.07 -1.18 -1.04 116.25 118.16 1b5d h VAL 191 Ca 0.16 -0.04 0.04 0.00 0.82 0.00 0.00 66.70 67.68 1b5d h VAL 191 Cb 0.23 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 1b5d h VAL 191 CO -0.01 0.02 0.21 0.28 0.02 0.00 0.00 177.57 178.09 1b5d h SER 192 N 0.13 0.29 -0.12 0.57 0.02 -0.93 0.28 113.55 113.79 1b5d h SER 192 Ca 0.15 0.03 -0.13 0.00 -0.84 0.00 0.00 61.79 60.99 1b5d h SER 192 Cb 0.18 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 1b5d h SER 192 CO -0.22 0.21 -0.36 0.44 -1.14 0.00 0.00 176.83 175.75 1b5d h ASP 193 N 0.42 0.67 -0.29 3.07 5.19 -0.87 -0.04 116.42 124.58 1b5d h ASP 193 Ca 0.19 -0.28 -0.17 0.00 -0.62 0.00 0.00 57.03 56.15 1b5d h ASP 193 Cb 0.12 -0.19 -0.00 0.00 0.18 0.00 0.00 39.33 39.44 1b5d h ASP 193 CO -0.15 0.97 -0.47 -0.07 -3.12 0.00 0.00 179.24 176.41 1b5d h LEU 194 N 0.53 0.91 -1.06 1.55 3.38 -0.85 -2.91 115.31 116.86 1b5d h LEU 194 Ca 0.05 -0.52 -0.08 0.00 0.09 0.00 0.00 57.88 57.42 1b5d h LEU 194 Cb 0.87 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1b5d h LEU 194 CO 0.08 1.25 -0.18 0.78 0.09 0.00 0.00 178.44 180.45 1b5d h ASN 195 N 0.59 0.44 0.94 -0.43 2.35 -0.78 -2.31 115.58 116.38 1b5d h ASN 195 Ca 0.02 -0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 55.62 1b5d h ASN 195 Cb 1.07 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 39.32 1b5d h ASN 195 CO 0.11 0.64 -0.11 0.00 -1.65 0.00 0.00 177.43 176.42 1b5d h ALA 196 N 1.40 1.03 0.00 -0.83 0.00 -0.99 -2.76 119.26 117.10 1b5d h ALA 196 Ca 0.07 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1b5d h ALA 196 Cb 0.56 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1b5d h ALA 196 CO 0.04 0.14 -0.34 0.78 0.00 0.00 0.00 179.25 179.86 1b5d h GLY 197 N 1.99 0.00 -5.28 0.00 0.00 -1.21 -3.45 103.07 95.13 1b5d h GLY 197 Ca -0.00 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.43 1b5d h GLY 197 CO 0.01 0.00 -0.09 -0.35 0.00 0.00 0.00 176.54 176.11 1b5d s ASP 198 N -6.36 -1.09 0.06 0.19 -1.08 -1.04 -5.05 116.67 102.30 1b5d s ASP 198 Ca 0.05 1.30 0.23 0.00 -0.52 0.00 0.00 52.55 53.61 1b5d s ASP 198 Cb 0.07 2.16 0.95 0.00 -1.46 0.00 0.00 42.92 44.64 1b5d s ASP 198 CO 0.72 -0.21 1.73 -1.54 0.52 0.00 0.00 175.17 176.40 1b5d n SER 199 N 5.38 0.18 -0.02 -0.34 3.41 -1.24 -2.32 113.62 118.67 1b5d n SER 199 Ca -0.09 0.53 0.13 0.00 -0.26 0.00 0.00 58.87 59.17 1b5d n SER 199 Cb 0.50 -0.57 0.37 0.00 -0.26 0.00 0.00 64.21 64.24 1b5d n SER 199 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1b5d n THR 200 N -1.68 0.00 0.15 6.66 -2.24 -1.26 -4.19 114.28 111.71 1b5d n THR 200 Ca 0.05 -0.01 -0.14 0.00 -2.27 0.00 0.00 64.05 61.68 1b5d n THR 200 Cb 0.28 0.06 -0.08 0.00 -2.10 0.00 0.00 70.33 68.49 1b5d n THR 200 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1b5d h ARG 201 N 0.11 -0.36 -6.00 -0.78 3.08 -1.80 -3.47 114.38 105.17 1b5d h ARG 201 Ca 0.00 0.02 -0.44 0.00 0.07 0.00 0.00 59.98 59.64 1b5d h ARG 201 Cb 0.49 0.08 0.05 0.00 0.08 0.00 0.00 29.97 30.67 1b5d h ARG 201 CO 0.00 -0.09 -0.71 1.04 -1.07 0.00 0.00 179.97 179.14 1b5d n GLN 202 N -5.15 -6.63 -1.42 0.04 1.13 -1.26 -4.96 117.38 99.13 1b5d n GLN 202 Ca -0.10 0.72 -0.32 0.00 -1.94 0.00 0.00 57.00 55.36 1b5d n GLN 202 Cb 0.24 -5.69 0.08 0.00 0.11 0.00 0.00 30.24 24.98 1b5d n GLN 202 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 1b5d s TYR 203 N -3.30 2.62 0.05 1.08 2.02 -1.26 -4.94 117.35 113.61 1b5d s TYR 203 Ca 0.61 1.55 0.01 0.00 -0.37 0.00 0.00 57.07 58.87 1b5d s TYR 203 Cb -0.29 -3.08 -0.03 0.00 -0.40 0.00 0.00 41.96 38.17 1b5d s TYR 203 CO 0.76 -1.74 -0.06 0.21 -1.57 0.00 0.00 175.55 173.15 1b5d s LYS 204 N -4.66 0.53 0.12 -0.62 2.20 -0.17 -4.98 119.74 112.16 1b5d s LYS 204 Ca 0.63 -0.86 -0.31 0.00 -0.36 0.00 0.00 55.97 55.07 1b5d s LYS 204 Cb -0.18 -0.11 -0.09 0.00 -1.51 0.00 0.00 37.83 35.94 1b5d s LYS 204 CO 0.52 -0.01 1.55 0.00 -0.36 0.00 0.00 175.35 177.05 1b5d s ALA 205 N -2.03 3.71 0.00 3.13 0.00 -1.26 -0.63 121.76 124.68 1b5d s ALA 205 Ca -0.06 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.16 1b5d s ALA 205 Cb -0.06 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1b5d s ALA 205 CO -0.02 -0.84 0.00 0.41 0.00 0.00 0.00 175.76 175.31 1b5d n GLY 206 N 3.76 1.70 3.83 0.00 0.00 0.11 -4.71 105.19 109.88 1b5d n GLY 206 Ca 0.14 -1.54 -0.36 0.00 0.00 0.00 0.00 46.02 44.26 1b5d n GLY 206 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1b5d s SER 207 N -1.00 6.92 -0.36 1.61 0.01 -1.26 -4.88 113.70 114.75 1b5d s SER 207 Ca 0.00 1.20 -0.12 0.00 1.31 0.00 0.00 55.95 58.34 1b5d s SER 207 Cb 0.00 -2.34 0.01 0.00 0.21 0.00 0.00 66.02 63.90 1b5d s SER 207 CO 0.00 0.10 0.23 -0.63 0.41 0.00 0.00 173.24 173.35 1b5d s ILE 208 N -1.44 4.97 -0.23 1.44 1.01 -1.26 -0.95 121.20 124.73 1b5d s ILE 208 Ca 0.38 -0.53 -0.13 0.00 0.00 0.00 0.00 60.65 60.37 1b5d s ILE 208 Cb -0.16 -3.66 -0.04 0.00 0.01 0.00 0.00 42.46 38.61 1b5d s ILE 208 CO 0.20 -0.13 0.29 -0.63 0.00 0.00 0.00 174.94 174.67 1b5d s ILE 209 N 1.65 5.26 -0.33 2.92 1.01 0.34 -0.83 121.20 131.21 1b5d s ILE 209 Ca 0.05 0.46 -0.10 0.00 0.00 0.00 0.00 60.65 61.05 1b5d s ILE 209 Cb -0.18 -3.63 0.01 0.00 0.01 0.00 0.00 42.46 38.67 1b5d s ILE 209 CO 0.09 0.27 0.17 0.86 0.00 0.00 0.00 174.94 176.33 1b5d s TRP 210 N 1.35 3.20 -0.23 3.97 -0.11 0.99 -0.80 118.94 127.32 1b5d s TRP 210 Ca 0.13 -0.72 -0.03 0.00 1.22 0.00 0.00 56.10 56.71 1b5d s TRP 210 Cb -0.14 -2.39 0.00 0.00 -1.50 0.00 0.00 33.47 29.44 1b5d s TRP 210 CO 0.07 -0.53 -0.06 -0.80 -4.62 0.00 0.00 176.95 171.01 1b5d s ASN 211 N 1.59 4.20 -0.11 5.86 0.01 0.12 -1.64 114.94 124.97 1b5d s ASN 211 Ca 0.04 -0.56 0.01 0.00 -0.71 0.00 0.00 52.86 51.64 1b5d s ASN 211 Cb -0.18 -1.70 0.02 0.00 0.41 0.00 0.00 41.25 39.80 1b5d s ASN 211 CO 0.06 -0.05 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.77 1b5d s VAL 212 N 1.42 1.41 0.09 1.60 1.01 -0.22 -0.37 120.40 125.33 1b5d s VAL 212 Ca 0.04 -0.58 -0.34 0.00 0.00 0.00 0.00 61.98 61.10 1b5d s VAL 212 Cb -0.15 -1.31 -0.16 0.00 0.00 0.00 0.00 36.38 34.76 1b5d s VAL 212 CO -0.04 0.43 1.59 1.23 0.00 0.00 0.00 175.10 178.30 1b5d h GLY 213 N 7.54 -1.08 -7.57 4.51 0.00 -0.93 -2.08 103.07 103.46 1b5d h GLY 213 Ca -0.32 0.49 -0.61 0.00 0.00 0.00 0.00 47.33 46.89 1b5d h GLY 213 CO 0.48 -0.36 -0.78 -0.45 0.00 0.00 0.00 176.54 175.44 1b5d s SER 214 N -4.42 3.89 -0.34 0.19 0.15 -0.62 -1.30 113.70 111.25 1b5d s SER 214 Ca -0.18 -1.29 -0.12 0.00 0.70 0.00 0.00 55.95 55.06 1b5d s SER 214 Cb 0.05 -1.15 -0.01 0.00 -1.71 0.00 0.00 66.02 63.19 1b5d s SER 214 CO 0.62 -0.27 0.22 -0.22 1.20 0.00 0.00 173.24 174.79 1b5d s LEU 215 N 1.40 4.45 0.09 3.45 2.96 -0.64 -1.76 118.68 128.64 1b5d s LEU 215 Ca -0.02 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 53.44 1b5d s LEU 215 Cb -0.19 -2.11 -0.04 0.00 0.50 0.00 0.00 46.19 44.36 1b5d s LEU 215 CO -0.08 -0.23 -0.07 -1.38 -1.32 0.00 0.00 176.35 173.26 1b5d s HIS 216 N 1.70 0.87 -0.11 5.38 -3.43 -0.90 -0.58 115.29 118.22 1b5d s HIS 216 Ca 0.06 -0.83 0.03 0.00 -0.80 0.00 0.00 55.06 53.51 1b5d s HIS 216 Cb -0.17 -0.50 -0.01 0.00 -1.43 0.00 0.00 32.58 30.47 1b5d s HIS 216 CO 0.10 -0.13 -0.20 0.08 -2.00 0.00 0.00 174.74 172.59 1b5d s VAL 217 N -3.19 2.41 0.56 -5.38 1.01 -0.40 -0.84 120.40 114.57 1b5d s VAL 217 Ca 0.08 -0.89 -0.16 0.00 0.00 0.00 0.00 61.98 61.01 1b5d s VAL 217 Cb 0.02 -1.96 -0.06 0.00 0.00 0.00 0.00 36.38 34.39 1b5d s VAL 217 CO -0.04 0.55 1.02 -0.31 0.00 0.00 0.00 175.10 176.33 1b5d s TYR 218 N 0.33 3.21 0.58 5.22 2.02 -1.26 -2.21 117.35 125.24 1b5d s TYR 218 Ca -0.16 1.49 0.28 0.00 -0.37 0.00 0.00 57.07 58.31 1b5d s TYR 218 Cb -0.17 -2.91 1.71 0.00 -0.40 0.00 0.00 41.96 40.19 1b5d s TYR 218 CO 0.08 -0.77 2.21 0.66 -1.57 0.00 0.00 175.55 176.16 1b5d h SER 219 N 0.66 0.00 0.83 2.29 4.64 -1.61 0.56 113.55 120.91 1b5d h SER 219 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1b5d h SER 219 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1b5d h SER 219 CO 0.59 0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 174.44 1b5d n ARG 220 N -3.94 0.15 -0.17 4.77 1.85 -1.26 -2.44 116.66 115.61 1b5d n ARG 220 Ca -0.02 0.31 0.06 0.00 -1.00 0.00 0.00 57.85 57.20 1b5d n ARG 220 Cb 0.14 -1.75 0.15 0.00 -1.05 0.00 0.00 32.46 29.96 1b5d n ARG 220 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1b5d n HIS 221 N -2.01 0.46 0.10 2.89 8.25 0.18 -4.61 115.22 120.48 1b5d n HIS 221 Ca 0.03 -0.48 0.05 0.00 -0.26 0.00 0.00 57.72 57.07 1b5d n HIS 221 Cb 0.26 -0.02 0.50 0.00 1.12 0.00 0.00 29.99 31.84 1b5d n HIS 221 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 1b5d h PHE 222 N 2.11 0.31 0.00 4.41 0.04 -1.46 -1.79 116.94 120.56 1b5d h PHE 222 Ca 0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 1b5d h PHE 222 Cb 0.73 -0.10 -0.00 0.00 2.20 0.00 0.00 35.95 38.77 1b5d h PHE 222 CO 0.23 0.22 -0.09 0.10 -0.60 0.00 0.00 178.31 178.17 1b5d h TYR 223 N 0.33 0.00 -0.11 -0.55 -0.00 -1.81 -0.91 116.97 113.92 1b5d h TYR 223 Ca 0.09 0.00 -0.04 0.00 -0.00 0.00 0.00 58.73 58.78 1b5d h TYR 223 Cb 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 36.73 1b5d h TYR 223 CO 0.00 0.09 -0.09 -0.07 -0.00 0.00 0.00 178.16 178.09 1b5d h LEU 224 N 0.00 0.26 -0.34 0.10 3.38 -1.67 -0.99 115.31 116.05 1b5d h LEU 224 Ca -0.00 -0.46 -0.00 0.00 0.09 0.00 0.00 57.88 57.50 1b5d h LEU 224 Cb 0.20 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1b5d h LEU 224 CO 0.01 0.67 0.19 0.58 0.09 0.00 0.00 178.44 179.98 1b5d h VAL 225 N -0.14 1.13 -0.47 1.22 2.07 -1.48 -1.96 116.25 116.61 1b5d h VAL 225 Ca 0.02 -0.31 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 1b5d h VAL 225 Cb 0.59 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 1b5d h VAL 225 CO 0.02 0.13 0.29 -0.78 0.02 0.00 0.00 177.57 177.24 1b5d h ASP 226 N 0.43 0.56 -0.41 0.57 3.58 -1.20 -0.18 116.42 119.76 1b5d h ASP 226 Ca 0.12 -0.05 -0.05 0.00 0.42 0.00 0.00 57.03 57.47 1b5d h ASP 226 Cb 0.03 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 40.93 1b5d h ASP 226 CO -0.02 0.45 0.06 -0.74 -2.88 0.00 0.00 179.24 176.10 1b5d h HIS 227 N 0.62 0.73 -0.51 0.28 2.76 -1.12 -2.24 115.15 115.68 1b5d h HIS 227 Ca 0.17 -0.11 0.00 0.00 -2.20 0.00 0.00 60.37 58.24 1b5d h HIS 227 Cb -0.01 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 28.72 1b5d h HIS 227 CO -0.03 0.72 0.33 2.35 -1.30 0.00 0.00 177.93 180.00 1b5d h TRP 228 N 0.54 0.66 -0.83 5.26 7.01 -1.15 -0.61 115.95 126.82 1b5d h TRP 228 Ca 0.12 0.01 0.14 0.00 2.11 0.00 0.00 58.89 61.27 1b5d h TRP 228 Cb 0.39 -0.22 -0.09 0.00 -2.10 0.00 0.00 29.16 27.13 1b5d h TRP 228 CO 0.03 0.42 0.42 2.35 -2.79 0.00 0.00 178.44 178.88 1b5d h TRP 229 N 0.70 0.75 0.14 2.65 2.91 -0.76 0.34 115.95 122.67 1b5d h TRP 229 Ca 0.19 0.03 -0.31 0.00 1.13 0.00 0.00 58.89 59.94 1b5d h TRP 229 Cb -0.06 -0.21 0.03 0.00 -0.51 0.00 0.00 29.16 28.41 1b5d h TRP 229 CO -0.04 0.19 -1.28 0.87 -1.03 0.00 0.00 178.44 177.15 1b5d h LYS 230 N 0.62 0.61 0.00 2.65 1.57 -1.13 -3.42 116.57 117.48 1b5d h LYS 230 Ca 0.45 -0.85 -0.03 0.00 -1.87 0.00 0.00 60.65 58.35 1b5d h LYS 230 Cb 0.61 0.28 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 1b5d h LYS 230 CO -0.35 1.39 -1.12 0.25 -0.57 0.00 0.00 179.45 179.04 1b5d n THR 231 N -3.78 0.10 -0.25 -0.16 -2.24 -0.26 -5.03 114.28 102.67 1b5d n THR 231 Ca -0.14 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 1b5d n THR 231 Cb 1.00 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 1b5d n THR 231 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1b5d n GLY 232 N 2.77 0.71 3.71 3.38 0.00 0.12 -5.02 105.19 110.86 1b5d n GLY 232 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1b5d n GLY 232 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1b5d s GLU 233 N -0.68 4.50 0.00 1.61 2.02 -1.26 -4.96 118.70 119.93 1b5d s GLU 233 Ca 0.00 1.16 0.26 0.00 0.02 0.00 0.00 54.97 56.41 1b5d s GLU 233 Cb 0.00 -3.46 1.29 0.00 0.10 0.00 0.00 34.13 32.07 1b5d s GLU 233 CO 0.00 -0.00 1.86 0.25 0.02 0.00 0.00 175.26 177.39 1b5d n THR 234 N 3.86 0.04 -3.71 3.63 -2.24 -1.26 -3.48 114.28 111.12 1b5d n THR 234 Ca 0.03 -0.14 -0.13 0.00 -2.27 0.00 0.00 64.05 61.54 1b5d n THR 234 Cb 0.51 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.65 1b5d n THR 234 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1b5d s HIS 235 N -1.96 -0.55 0.07 4.78 5.65 -1.26 -0.22 115.29 121.80 1b5d s HIS 235 Ca 0.38 1.31 0.01 0.00 0.25 0.00 0.00 55.06 57.02 1b5d s HIS 235 Cb 0.19 0.20 -0.04 0.00 -1.18 0.00 0.00 32.58 31.75 1b5d s HIS 235 CO 0.31 -0.27 -0.06 0.42 -0.65 0.00 0.00 174.74 174.49 1b5d s ILE 236 N 0.39 0.56 0.24 0.89 1.09 -1.26 -5.03 121.20 118.07 1b5d s ILE 236 Ca -0.01 -1.69 -0.30 0.00 -1.10 0.00 0.00 60.65 57.55 1b5d s ILE 236 Cb -0.04 -1.36 -0.09 0.00 -1.06 0.00 0.00 42.46 39.91 1b5d s ILE 236 CO -0.01 -0.77 1.24 -0.55 -0.10 0.00 0.00 174.94 174.75 1b5d s SER 237 N -2.64 6.99 0.61 3.58 0.15 -1.26 -4.91 113.70 116.21 1b5d s SER 237 Ca 0.05 2.39 0.32 0.00 0.70 0.00 0.00 55.95 59.41 1b5d s SER 237 Cb 0.02 -2.62 1.84 0.00 -1.71 0.00 0.00 66.02 63.55 1b5d s SER 237 CO -0.04 -0.42 2.19 0.50 1.20 0.00 0.00 173.24 176.67 1b5d h LYS 238 N 4.65 0.00 0.10 5.44 1.63 -2.00 -1.62 116.57 124.77 1b5d h LYS 238 Ca -0.46 0.00 -0.27 0.00 -0.85 0.00 0.00 60.65 59.08 1b5d h LYS 238 Cb 1.22 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.85 1b5d h LYS 238 CO 0.72 0.00 -1.18 0.87 -3.45 0.00 0.00 179.45 176.41 1b5d h LYS 239 N 0.00 0.32 0.00 1.90 1.57 -2.01 -3.24 116.57 115.11 1b5d h LYS 239 Ca 0.04 -0.48 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1b5d h LYS 239 Cb 0.24 0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1b5d h LYS 239 CO -0.00 1.20 -0.02 -0.44 -0.57 0.00 0.00 179.45 179.62 1b5d h ASP 240 N 0.12 0.00 -3.74 0.86 5.19 -1.70 -3.46 116.42 113.68 1b5d h ASP 240 Ca -0.13 -0.01 -0.51 0.00 -0.62 0.00 0.00 57.03 55.76 1b5d h ASP 240 Cb 1.88 0.00 0.03 0.00 0.18 0.00 0.00 39.33 41.43 1b5d h ASP 240 CO 0.20 0.00 0.56 -0.47 -3.12 0.00 0.00 179.24 176.41 1b5d s TYR 241 N -3.12 3.35 -0.03 4.55 5.04 -0.92 -4.99 117.35 121.23 1b5d s TYR 241 Ca 0.10 1.52 0.01 0.00 -2.44 0.00 0.00 57.07 56.26 1b5d s TYR 241 Cb 0.11 -3.47 0.02 0.00 0.35 0.00 0.00 41.96 38.98 1b5d s TYR 241 CO 0.61 -1.20 -0.01 0.54 -1.34 0.00 0.00 175.55 174.15 1b5d s VAL 242 N -0.87 0.26 -5.00 3.14 0.11 -1.26 -5.03 120.40 111.76 1b5d s VAL 242 Ca 0.48 0.03 0.00 0.00 -2.93 0.00 0.00 61.98 59.56 1b5d s VAL 242 Cb -0.35 -0.34 0.00 0.00 -1.53 0.00 0.00 36.38 34.16 1b5d s VAL 242 CO 0.44 0.16 0.00 0.61 -3.33 0.00 0.00 175.10 172.98 1b5d n GLY 243 N 4.07 -2.28 0.20 6.54 0.00 -1.26 -5.00 105.19 107.46 1b5d n GLY 243 Ca -0.26 -1.38 0.14 0.00 0.00 0.00 0.00 46.02 44.51 1b5d n GLY 243 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1b5d n LYS 244 N -0.92 0.94 -1.00 1.61 2.85 -1.26 -3.25 118.16 117.13 1b5d n LYS 244 Ca 0.00 -0.40 -0.08 0.00 -1.05 0.00 0.00 58.31 56.78 1b5d n LYS 244 Cb 0.00 -1.49 0.28 0.00 -0.65 0.00 0.00 35.03 33.16 1b5d n LYS 244 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1b5d n TYR 245 N -0.68 2.42 0.00 5.58 4.01 -1.26 -5.13 117.16 122.11 1b5d n TYR 245 Ca 0.16 -1.22 0.00 0.00 -0.16 0.00 0.00 57.90 56.68 1b5d n TYR 245 Cb 0.29 -0.70 0.00 0.00 -0.31 0.00 0.00 39.34 38.62 1b5d n TYR 245 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40