#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bci n SER 17 N 0.00 0.02 -4.68 9.48 3.41 -1.24 -4.68 113.62 115.92 1bci n SER 17 Ca 0.00 -0.18 -0.35 0.00 -0.26 0.00 0.00 58.87 58.08 1bci n SER 17 Cb 0.00 0.24 -0.09 0.00 -0.26 0.00 0.00 64.21 64.10 1bci n SER 17 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1bci s HIS 18 N -0.24 3.32 -0.33 7.33 5.65 -0.60 -4.92 115.29 125.50 1bci s HIS 18 Ca 0.00 0.18 -0.25 0.00 0.25 0.00 0.00 55.06 55.24 1bci s HIS 18 Cb 0.00 -2.10 0.01 0.00 -1.18 0.00 0.00 32.58 29.30 1bci s HIS 18 CO 0.00 0.22 0.87 0.15 -0.65 0.00 0.00 174.74 175.33 1bci s LYS 19 N 0.32 3.92 -0.19 2.88 1.02 -0.32 -1.09 119.74 126.28 1bci s LYS 19 Ca 0.05 0.63 0.00 0.00 0.02 0.00 0.00 55.97 56.67 1bci s LYS 19 Cb -0.12 -3.76 0.05 0.00 -0.52 0.00 0.00 37.83 33.48 1bci s LYS 19 CO -0.01 -0.81 -0.07 0.12 -0.92 0.00 0.00 175.35 173.67 1bci s PHE 20 N 3.22 2.06 -0.09 3.18 5.36 -0.58 -1.35 117.98 129.77 1bci s PHE 20 Ca 0.36 -1.38 0.02 0.00 -0.96 0.00 0.00 56.93 54.97 1bci s PHE 20 Cb -0.13 -1.47 -0.02 0.00 -0.34 0.00 0.00 43.02 41.06 1bci s PHE 20 CO 0.15 -0.69 -0.13 0.99 -1.46 0.00 0.00 175.22 174.08 1bci s THR 21 N 1.51 3.08 0.19 0.12 2.01 -0.85 -0.12 115.64 121.59 1bci s THR 21 Ca -0.01 -0.68 0.11 0.00 0.31 0.00 0.00 61.69 61.41 1bci s THR 21 Cb -0.16 -2.25 -0.04 0.00 0.01 0.00 0.00 72.50 70.05 1bci s THR 21 CO -0.08 0.56 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.49 1bci s VAL 22 N -0.20 2.25 -0.31 3.82 1.01 -0.92 -0.82 120.40 125.24 1bci s VAL 22 Ca 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 61.98 59.97 1bci s VAL 22 Cb -0.13 -2.07 0.14 0.00 0.00 0.00 0.00 36.38 34.32 1bci s VAL 22 CO 0.03 -0.15 0.29 -0.69 0.00 0.00 0.00 175.10 174.58 1bci s VAL 23 N -1.74 -0.33 -0.33 2.92 1.01 0.10 -0.75 120.40 121.27 1bci s VAL 23 Ca 0.20 -0.68 -0.28 0.00 0.00 0.00 0.00 61.98 61.22 1bci s VAL 23 Cb -0.08 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 1bci s VAL 23 CO 0.09 -0.54 2.02 0.68 0.00 0.00 0.00 175.10 177.35 1bci s VAL 24 N 2.08 3.25 0.00 2.92 -7.23 -0.76 -1.47 120.40 119.19 1bci s VAL 24 Ca 0.11 0.24 0.00 0.00 -1.81 0.00 0.00 61.98 60.52 1bci s VAL 24 Cb -0.15 -3.38 0.00 0.00 0.56 0.00 0.00 36.38 33.41 1bci s VAL 24 CO -0.26 -0.27 0.00 -0.11 -0.31 0.00 0.00 175.10 174.16 1bci n LEU 25 N 11.66 1.44 -4.22 1.32 -0.00 -0.70 0.15 117.00 126.66 1bci n LEU 25 Ca 0.27 0.26 -0.16 0.00 -0.00 0.00 0.00 56.01 56.38 1bci n LEU 25 Cb 0.48 -0.26 -0.08 0.00 -0.00 0.00 0.00 43.42 43.55 1bci n LEU 25 CO 0.68 -0.26 -0.12 0.00 -0.00 0.00 0.00 177.39 177.69 1bci s ARG 26 N -0.52 1.55 -0.45 1.96 1.70 -1.07 -1.51 118.95 120.61 1bci s ARG 26 Ca 0.00 -1.81 0.04 0.00 -0.47 0.00 0.00 55.73 53.49 1bci s ARG 26 Cb 0.00 0.32 0.25 0.00 -0.57 0.00 0.00 34.95 34.95 1bci s ARG 26 CO 0.00 -0.57 0.96 0.00 -1.08 0.00 0.00 175.30 174.61 1bci n ALA 27 N -0.47 -1.94 -2.30 7.88 0.00 -1.23 -2.35 120.51 120.09 1bci n ALA 27 Ca 0.04 -1.13 -0.12 0.00 0.00 0.00 0.00 53.44 52.23 1bci n ALA 27 Cb 0.64 -1.78 0.07 0.00 0.00 0.00 0.00 19.45 18.37 1bci n ALA 27 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1bci n THR 28 N 1.68 0.00 -2.80 0.00 -2.24 0.46 -4.16 114.28 107.22 1bci n THR 28 Ca 0.08 -0.77 -0.08 0.00 -2.27 0.00 0.00 64.05 61.00 1bci n THR 28 Cb 0.64 -1.21 -0.01 0.00 -2.10 0.00 0.00 70.33 67.65 1bci n THR 28 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1bci n LYS 29 N -2.03 -2.65 -2.07 -0.78 5.02 0.36 -2.18 118.16 113.83 1bci n LYS 29 Ca 0.09 0.11 -0.43 0.00 -2.02 0.00 0.00 58.31 56.06 1bci n LYS 29 Cb 0.31 -4.65 -0.03 0.00 -0.02 0.00 0.00 35.03 30.64 1bci n LYS 29 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1bci s VAL 30 N -2.28 3.63 0.56 -0.18 0.11 -1.13 -3.16 120.40 117.95 1bci s VAL 30 Ca 0.13 0.70 -0.04 0.00 -2.93 0.00 0.00 61.98 59.84 1bci s VAL 30 Cb -0.07 -3.66 0.01 0.00 -1.53 0.00 0.00 36.38 31.13 1bci s VAL 30 CO 0.16 -0.29 0.84 -0.89 -3.33 0.00 0.00 175.10 171.59 1bci s THR 31 N 5.44 3.62 0.00 5.04 2.01 -1.26 -4.78 115.64 125.71 1bci s THR 31 Ca 0.74 -0.17 0.00 0.00 0.31 0.00 0.00 61.69 62.57 1bci s THR 31 Cb -0.25 -3.41 0.00 0.00 0.01 0.00 0.00 72.50 68.84 1bci s THR 31 CO 0.30 -0.39 0.00 1.17 -0.69 0.00 0.00 174.62 175.02 1bci n LYS 32 N -2.46 0.00 0.00 4.92 4.81 -1.26 -5.04 118.16 119.13 1bci n LYS 32 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 1bci n LYS 32 Cb 0.58 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.63 1bci n LYS 32 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1bci n GLY 33 N -1.14 0.69 0.14 3.14 0.00 -1.26 -4.82 105.19 101.93 1bci n GLY 33 Ca 0.00 -1.70 0.07 0.00 0.00 0.00 0.00 46.02 44.39 1bci n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bci h ALA 34 N 0.00 0.68 -0.06 4.61 0.00 -2.00 -3.28 119.26 119.21 1bci h ALA 34 Ca 0.00 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.62 1bci h ALA 34 Cb 0.00 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1bci h ALA 34 CO 0.00 0.36 -0.32 0.74 0.00 0.00 0.00 179.25 180.03 1bci h PHE 35 N 0.00 -0.96 0.00 0.00 0.04 -1.99 -0.92 116.94 113.12 1bci h PHE 35 Ca -0.04 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1bci h PHE 35 Cb 1.23 0.42 -0.00 0.00 2.20 0.00 0.00 35.95 39.80 1bci h PHE 35 CO 0.00 -0.33 -0.04 0.78 -0.60 0.00 0.00 178.31 178.13 1bci h GLY 36 N -0.36 0.00 1.64 -1.45 0.00 -1.88 -2.66 103.07 98.36 1bci h GLY 36 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1bci h GLY 36 CO -0.25 0.00 0.00 1.34 0.00 0.00 0.00 176.54 177.63 1bci n ASP 37 N -3.14 0.00 -0.28 0.19 -0.08 -0.42 -3.46 116.55 109.35 1bci n ASP 37 Ca 0.01 0.11 0.10 0.00 -1.51 0.00 0.00 54.79 53.50 1bci n ASP 37 Cb 0.34 -0.32 0.25 0.00 2.34 0.00 0.00 41.12 43.73 1bci n ASP 37 CO 0.00 0.00 0.00 0.24 0.12 0.00 0.00 177.20 177.56 1bci h MET 38 N 0.00 0.31 0.04 -0.67 2.86 -0.98 -2.55 114.93 113.94 1bci h MET 38 Ca 0.00 -0.02 -0.38 0.00 -2.06 0.00 0.00 59.70 57.24 1bci h MET 38 Cb 0.19 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.73 1bci h MET 38 CO 0.00 0.21 -2.28 1.28 1.06 0.00 0.00 176.91 177.18 1bci n LEU 39 N -5.12 2.75 0.00 1.22 4.77 -1.23 -5.08 117.00 114.31 1bci n LEU 39 Ca 0.19 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1bci n LEU 39 Cb 0.58 -0.98 0.00 0.00 -2.33 0.00 0.00 43.42 40.69 1bci n LEU 39 CO 0.12 0.86 0.00 -0.67 -1.33 0.00 0.00 177.39 176.37 1bci n ASP 40 N -3.45 0.00 -3.44 -1.43 2.03 -0.96 -5.10 116.55 104.19 1bci n ASP 40 Ca -0.41 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 54.57 1bci n ASP 40 Cb 0.99 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.39 1bci n ASP 40 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1bci n THR 41 N -0.22 0.37 -0.79 5.18 -1.04 -1.26 -3.27 114.28 113.25 1bci n THR 41 Ca 0.00 -0.40 -0.26 0.00 -2.04 0.00 0.00 64.05 61.35 1bci n THR 41 Cb 0.00 0.00 0.02 0.00 -1.82 0.00 0.00 70.33 68.53 1bci n THR 41 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1bci n PRO 42 N 1.11 0.00 -3.79 -2.82 -0.01 -1.26 -0.65 135.00 127.58 1bci n PRO 42 Ca 0.08 0.00 -0.36 0.00 -0.01 0.00 0.00 63.50 63.21 1bci n PRO 42 Cb 0.34 -0.70 -0.12 0.00 -0.01 0.00 0.00 33.50 33.01 1bci n PRO 42 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 175.50 174.98 1bci s ASP 43 N -0.70 5.22 0.43 2.55 1.11 -1.26 0.23 116.67 124.24 1bci s ASP 43 Ca 0.34 -1.86 -0.24 0.00 0.18 0.00 0.00 52.55 50.97 1bci s ASP 43 Cb -0.24 -1.82 -0.08 0.00 1.07 0.00 0.00 42.92 41.85 1bci s ASP 43 CO 0.52 -0.49 1.18 -2.16 1.18 0.00 0.00 175.17 175.39 1bci s PRO 44 N 1.18 3.90 -0.30 8.23 0.04 -0.83 -0.42 135.00 146.80 1bci s PRO 44 Ca 0.06 1.83 -0.17 0.00 0.04 0.00 0.00 61.00 62.76 1bci s PRO 44 Cb -0.22 -2.55 0.18 0.00 0.04 0.00 0.00 34.50 31.96 1bci s PRO 44 CO -0.03 -0.45 1.16 -0.47 0.04 0.00 0.00 177.00 177.25 1bci s TYR 45 N -1.47 -0.29 0.50 0.56 6.14 -0.85 -2.42 117.35 119.52 1bci s TYR 45 Ca 0.60 0.54 -0.02 0.00 0.64 0.00 0.00 57.07 58.84 1bci s TYR 45 Cb -0.30 0.18 0.00 0.00 0.42 0.00 0.00 41.96 42.25 1bci s TYR 45 CO 0.37 -0.15 0.75 0.08 0.64 0.00 0.00 175.55 177.25 1bci s VAL 46 N 1.67 3.89 -0.30 3.14 1.01 -0.80 -1.17 120.40 127.85 1bci s VAL 46 Ca -0.05 -0.31 -0.01 0.00 0.00 0.00 0.00 61.98 61.62 1bci s VAL 46 Cb -0.03 -3.48 0.13 0.00 0.00 0.00 0.00 36.38 33.01 1bci s VAL 46 CO -0.14 -0.39 0.27 -0.70 0.00 0.00 0.00 175.10 174.14 1bci s GLU 47 N -4.71 0.32 -0.37 2.72 2.12 -0.02 -2.25 118.70 116.51 1bci s GLU 47 Ca 0.50 -0.27 -0.24 0.00 0.36 0.00 0.00 54.97 55.32 1bci s GLU 47 Cb -0.10 -0.76 0.01 0.00 0.26 0.00 0.00 34.13 33.54 1bci s GLU 47 CO 0.41 -1.04 0.83 -1.17 -0.54 0.00 0.00 175.26 173.74 1bci s LEU 48 N 2.25 4.09 0.03 2.70 2.96 0.41 -0.56 118.68 130.57 1bci s LEU 48 Ca 0.10 0.39 0.05 0.00 -0.22 0.00 0.00 54.13 54.45 1bci s LEU 48 Cb -0.14 -3.09 -0.02 0.00 0.50 0.00 0.00 46.19 43.43 1bci s LEU 48 CO -0.32 -0.78 -0.16 -0.36 -1.32 0.00 0.00 176.35 173.41 1bci s PHE 49 N 3.23 1.40 0.12 5.38 0.40 -0.30 -1.49 117.98 126.72 1bci s PHE 49 Ca 0.33 -0.34 0.00 0.00 -0.60 0.00 0.00 56.93 56.33 1bci s PHE 49 Cb -0.13 -0.85 -0.04 0.00 0.51 0.00 0.00 43.02 42.51 1bci s PHE 49 CO 0.18 0.04 0.00 0.42 0.70 0.00 0.00 175.22 176.56 1bci s ILE 50 N -0.74 0.38 -0.39 0.64 1.01 -0.95 0.65 121.20 121.81 1bci s ILE 50 Ca 0.04 -1.91 0.01 0.00 0.00 0.00 0.00 60.65 58.79 1bci s ILE 50 Cb -0.08 -1.89 0.13 0.00 0.01 0.00 0.00 42.46 40.63 1bci s ILE 50 CO 0.01 -0.65 0.19 -0.44 0.00 0.00 0.00 174.94 174.05 1bci s SER 51 N -3.05 3.65 0.00 3.58 0.01 -1.06 -4.59 113.70 112.24 1bci s SER 51 Ca 0.18 -2.26 0.00 0.00 1.31 0.00 0.00 55.95 55.18 1bci s SER 51 Cb 0.07 -0.88 0.00 0.00 0.21 0.00 0.00 66.02 65.42 1bci s SER 51 CO -0.01 -0.32 0.00 1.07 0.41 0.00 0.00 173.24 174.39 1bci n THR 52 N 4.01 0.00 -2.38 1.44 5.66 -1.26 -2.47 114.28 119.29 1bci n THR 52 Ca 0.06 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.80 1bci n THR 52 Cb 0.37 0.00 0.04 0.00 -1.55 0.00 0.00 70.33 69.19 1bci n THR 52 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1bci s THR 53 N 0.00 3.37 0.17 1.09 -1.32 -1.26 -4.88 115.64 112.80 1bci s THR 53 Ca 0.00 -0.08 -0.23 0.00 -1.21 0.00 0.00 61.69 60.17 1bci s THR 53 Cb 0.00 -3.35 0.07 0.00 -1.51 0.00 0.00 72.50 67.71 1bci s THR 53 CO 0.00 -0.36 1.59 -0.65 -2.21 0.00 0.00 174.62 172.99 1bci h PRO 54 N -0.23 -0.22 -0.38 7.08 0.11 -2.00 -3.37 132.00 132.99 1bci h PRO 54 Ca -0.45 0.01 -0.21 0.00 0.11 0.00 0.00 66.00 65.46 1bci h PRO 54 Cb 1.27 0.05 -0.15 0.00 0.11 0.00 0.00 31.00 32.27 1bci h PRO 54 CO 0.60 -0.14 -0.51 -0.25 -0.21 0.00 0.00 178.00 177.49 1bci n ASP 55 N -5.42 -2.99 -4.31 -2.05 8.00 -1.26 -5.06 116.55 103.46 1bci n ASP 55 Ca 0.02 -3.17 -0.43 0.00 0.71 0.00 0.00 54.79 51.93 1bci n ASP 55 Cb 0.35 1.74 0.00 0.00 -0.02 0.00 0.00 41.12 43.19 1bci n ASP 55 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1bci n SER 56 N 2.06 4.68 -3.40 -2.24 3.41 -1.26 -4.78 113.62 112.08 1bci n SER 56 Ca 0.12 -2.91 -0.27 0.00 -0.26 0.00 0.00 58.87 55.56 1bci n SER 56 Cb 0.60 -1.70 -0.08 0.00 -0.26 0.00 0.00 64.21 62.78 1bci n SER 56 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1bci n ARG 57 N 7.35 2.18 -4.00 4.33 5.12 -1.26 -2.24 116.66 128.13 1bci n ARG 57 Ca 0.48 -4.41 -0.25 0.00 -1.93 0.00 0.00 57.85 51.75 1bci n ARG 57 Cb 0.43 -2.08 -0.05 0.00 -1.16 0.00 0.00 32.46 29.61 1bci n ARG 57 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1bci s LYS 58 N -2.20 2.29 0.14 5.56 1.02 -0.56 -5.02 119.74 120.97 1bci s LYS 58 Ca 0.38 -1.87 -0.24 0.00 0.02 0.00 0.00 55.97 54.26 1bci s LYS 58 Cb 0.14 -2.06 0.08 0.00 -0.52 0.00 0.00 37.83 35.48 1bci s LYS 58 CO -0.04 -0.27 1.06 -0.98 -0.92 0.00 0.00 175.35 174.20 1bci s ARG 59 N -4.04 1.10 -0.21 1.68 1.70 -1.26 -0.44 118.95 117.48 1bci s ARG 59 Ca 0.38 -0.67 0.01 0.00 -0.47 0.00 0.00 55.73 54.99 1bci s ARG 59 Cb 0.01 0.33 0.04 0.00 -0.57 0.00 0.00 34.95 34.76 1bci s ARG 59 CO 0.22 -0.51 -0.15 0.95 -1.08 0.00 0.00 175.30 174.73 1bci s THR 60 N -2.55 1.95 -0.76 4.99 -4.23 -0.95 -4.88 115.64 109.22 1bci s THR 60 Ca 0.18 -1.14 -0.23 0.00 -1.18 0.00 0.00 61.69 59.33 1bci s THR 60 Cb -0.01 -1.92 0.07 0.00 1.34 0.00 0.00 72.50 71.98 1bci s THR 60 CO 0.03 0.27 1.09 -0.13 -0.54 0.00 0.00 174.62 175.35 1bci s ARG 61 N 1.28 3.26 0.00 3.99 0.52 -1.26 -1.91 118.95 124.82 1bci s ARG 61 Ca -0.01 -0.93 0.00 0.00 -0.52 0.00 0.00 55.73 54.27 1bci s ARG 61 Cb -0.16 -4.46 0.00 0.00 0.52 0.00 0.00 34.95 30.86 1bci s ARG 61 CO -0.09 -1.90 0.00 1.58 0.02 0.00 0.00 175.30 174.90 1bci n HIS 62 N 7.89 0.00 -3.37 -0.53 -0.00 -1.26 -5.05 115.22 112.91 1bci n HIS 62 Ca 0.06 0.00 -0.01 0.00 0.46 0.00 0.00 57.72 58.23 1bci n HIS 62 Cb 0.47 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.35 1bci n HIS 62 CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 1bci n PHE 63 N 0.00 -0.86 -3.17 1.57 3.72 -1.01 -5.03 117.46 112.67 1bci n PHE 63 Ca 0.00 -0.22 -0.18 0.00 -0.05 0.00 0.00 57.45 57.00 1bci n PHE 63 Cb 0.00 0.11 0.01 0.00 -0.94 0.00 0.00 39.48 38.65 1bci n PHE 63 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1bci s ASN 64 N -1.34 5.77 -0.22 4.37 2.20 -1.26 -1.97 114.94 122.48 1bci s ASN 64 Ca 0.03 -0.27 -0.13 0.00 -0.94 0.00 0.00 52.86 51.55 1bci s ASN 64 Cb -0.01 -0.95 0.02 0.00 -2.00 0.00 0.00 41.25 38.32 1bci s ASN 64 CO 0.01 -0.65 0.26 -0.46 -2.94 0.00 0.00 177.10 173.32 1bci n ASN 65 N -1.81 -6.61 0.00 3.54 6.94 0.14 -4.83 115.26 112.63 1bci n ASN 65 Ca 0.04 0.41 0.00 0.00 -0.02 0.00 0.00 54.58 55.01 1bci n ASN 65 Cb 0.59 -2.55 0.00 0.00 -2.36 0.00 0.00 39.78 35.46 1bci n ASN 65 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 1bci n ASP 66 N 0.61 0.00 -0.40 0.53 8.00 -0.50 -4.93 116.55 119.85 1bci n ASP 66 Ca -0.01 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.53 1bci n ASP 66 Cb 0.48 0.00 0.11 0.00 -0.02 0.00 0.00 41.12 41.69 1bci n ASP 66 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 1bci n ILE 67 N 0.00 1.25 -2.67 0.53 -5.35 -1.26 -3.89 119.36 107.96 1bci n ILE 67 Ca 0.00 -1.23 -0.08 0.00 -0.27 0.00 0.00 62.75 61.17 1bci n ILE 67 Cb 0.00 0.34 0.05 0.00 -1.74 0.00 0.00 39.64 38.28 1bci n ILE 67 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1bci n ASN 68 N -0.14 0.79 -4.86 7.28 3.02 -1.26 0.14 115.26 120.23 1bci n ASN 68 Ca 0.09 -2.64 -0.29 0.00 -0.03 0.00 0.00 54.58 51.71 1bci n ASN 68 Cb 0.45 -0.23 0.10 0.00 -0.61 0.00 0.00 39.78 39.49 1bci n ASN 68 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1bci s PRO 69 N -2.48 1.84 -0.17 3.52 0.04 -1.26 -4.90 135.00 131.59 1bci s PRO 69 Ca 0.26 0.26 -0.06 0.00 0.04 0.00 0.00 61.00 61.50 1bci s PRO 69 Cb 0.44 -1.92 0.08 0.00 0.04 0.00 0.00 34.50 33.14 1bci s PRO 69 CO 0.01 -1.71 0.35 0.08 0.04 0.00 0.00 177.00 175.78 1bci s VAL 70 N -3.42 -0.55 -0.21 -0.36 1.01 -1.26 -3.57 120.40 112.03 1bci s VAL 70 Ca 0.62 0.20 -0.06 0.00 0.00 0.00 0.00 61.98 62.74 1bci s VAL 70 Cb -0.12 -0.59 -0.11 0.00 0.00 0.00 0.00 36.38 35.56 1bci s VAL 70 CO 0.51 0.07 -0.24 0.79 0.00 0.00 0.00 175.10 176.24 1bci n TRP 71 N 5.37 0.00 -4.38 5.22 8.01 -0.95 -4.99 117.44 125.72 1bci n TRP 71 Ca -0.07 0.00 -0.39 0.00 -1.31 0.00 0.00 57.50 55.73 1bci n TRP 71 Cb 0.50 -0.78 -0.06 0.00 -2.01 0.00 0.00 31.31 28.96 1bci n TRP 71 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.69 176.95 1bci n ASN 72 N -3.60 -2.07 -4.66 -0.99 6.94 0.40 -4.89 115.26 106.40 1bci n ASN 72 Ca -0.40 -1.15 -0.38 0.00 -0.02 0.00 0.00 54.58 52.63 1bci n ASN 72 Cb 0.84 -2.10 -0.08 0.00 -2.36 0.00 0.00 39.78 36.08 1bci n ASN 72 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1bci s GLU 73 N -7.11 4.14 -0.43 -3.83 2.02 -0.74 -4.86 118.70 107.88 1bci s GLU 73 Ca 0.69 0.10 -0.16 0.00 0.02 0.00 0.00 54.97 55.62 1bci s GLU 73 Cb -0.39 -3.55 0.04 0.00 0.10 0.00 0.00 34.13 30.32 1bci s GLU 73 CO 0.98 -0.05 0.35 0.99 0.02 0.00 0.00 175.26 177.56 1bci s THR 74 N 1.35 5.22 -0.22 3.63 2.01 -1.26 -1.83 115.64 124.54 1bci s THR 74 Ca 0.16 -0.73 -0.08 0.00 0.31 0.00 0.00 61.69 61.36 1bci s THR 74 Cb -0.15 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.32 1bci s THR 74 CO 0.07 -0.41 0.09 -0.36 -0.69 0.00 0.00 174.62 173.32 1bci s PHE 75 N 1.75 3.19 0.49 4.92 0.08 0.07 -4.95 117.98 123.53 1bci s PHE 75 Ca 0.06 -0.09 -0.18 0.00 0.12 0.00 0.00 56.93 56.84 1bci s PHE 75 Cb -0.20 -2.18 -0.09 0.00 -0.57 0.00 0.00 43.02 39.98 1bci s PHE 75 CO 0.10 -0.07 0.98 -2.00 -0.10 0.00 0.00 175.22 174.12 1bci s GLU 76 N 1.03 4.01 -0.39 0.44 2.12 -1.26 -2.15 118.70 122.49 1bci s GLU 76 Ca 0.05 1.06 0.04 0.00 0.36 0.00 0.00 54.97 56.48 1bci s GLU 76 Cb -0.14 -2.14 0.16 0.00 0.26 0.00 0.00 34.13 32.27 1bci s GLU 76 CO 0.03 -0.22 0.44 -0.06 -0.54 0.00 0.00 175.26 174.91 1bci s PHE 77 N -2.40 -0.61 -0.68 5.30 0.08 0.83 -4.95 117.98 115.55 1bci s PHE 77 Ca 0.61 -0.64 -0.21 0.00 0.12 0.00 0.00 56.93 56.81 1bci s PHE 77 Cb -0.10 -0.24 0.08 0.00 -0.57 0.00 0.00 43.02 42.19 1bci s PHE 77 CO 0.24 -1.02 0.94 0.42 -0.10 0.00 0.00 175.22 175.69 1bci s ILE 78 N 1.44 4.47 0.09 0.64 1.01 -1.26 -1.53 121.20 126.06 1bci s ILE 78 Ca 0.18 -0.64 0.02 0.00 0.00 0.00 0.00 60.65 60.21 1bci s ILE 78 Cb -0.12 -4.66 -0.04 0.00 0.01 0.00 0.00 42.46 37.65 1bci s ILE 78 CO -0.04 -1.41 -0.07 -1.48 0.00 0.00 0.00 174.94 171.95 1bci s LEU 79 N 3.63 2.48 0.09 2.97 0.05 -0.25 -4.58 118.68 123.07 1bci s LEU 79 Ca 0.21 -0.94 -0.30 0.00 0.05 0.00 0.00 54.13 53.15 1bci s LEU 79 Cb -0.17 -0.11 -0.06 0.00 -2.05 0.00 0.00 46.19 43.81 1bci s LEU 79 CO 0.07 -0.42 1.08 -1.81 -0.55 0.00 0.00 176.35 174.73 1bci s ASP 80 N -2.85 7.26 -0.20 1.48 1.01 -1.26 -1.56 116.67 120.56 1bci s ASP 80 Ca 0.09 1.93 0.02 0.00 0.71 0.00 0.00 52.55 55.30 1bci s ASP 80 Cb 0.03 -2.59 0.32 0.00 1.01 0.00 0.00 42.92 41.69 1bci s ASP 80 CO -0.04 -0.29 1.38 -0.81 0.21 0.00 0.00 175.17 175.63 1bci n PRO 81 N 3.27 1.74 0.06 8.23 -0.04 -1.26 -4.05 135.00 142.95 1bci n PRO 81 Ca 0.05 -1.40 -0.06 0.00 -0.04 0.00 0.00 63.50 62.05 1bci n PRO 81 Cb 0.48 -1.59 -0.10 0.00 -0.04 0.00 0.00 33.50 32.25 1bci n PRO 81 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1bci h ASN 82 N 0.64 0.00 -0.15 3.54 -0.26 -1.94 -3.46 115.58 113.95 1bci h ASN 82 Ca 0.26 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.00 1bci h ASN 82 Cb 1.78 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 39.04 1bci h ASN 82 CO 0.48 0.92 0.00 1.67 -1.06 0.00 0.00 177.43 179.43 1bci n GLN 83 N -3.26 1.35 -2.95 0.81 7.27 -1.26 -4.96 117.38 114.39 1bci n GLN 83 Ca -0.03 0.00 -0.42 0.00 0.07 0.00 0.00 57.00 56.62 1bci n GLN 83 Cb 0.93 0.00 0.01 0.00 2.41 0.00 0.00 30.24 33.59 1bci n GLN 83 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1bci n GLU 84 N 0.00 4.63 -1.53 3.69 2.13 -1.26 -4.93 120.64 123.37 1bci n GLU 84 Ca 0.00 -4.58 -0.20 0.00 0.66 0.00 0.00 57.16 53.04 1bci n GLU 84 Cb 0.00 -2.50 -0.15 0.00 0.27 0.00 0.00 31.44 29.06 1bci n GLU 84 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1bci n ASN 85 N 1.06 0.18 -4.13 4.31 4.13 -1.19 -4.51 115.26 115.11 1bci n ASN 85 Ca 0.30 -0.92 -0.38 0.00 1.68 0.00 0.00 54.58 55.26 1bci n ASN 85 Cb 0.32 -1.08 -0.09 0.00 -1.54 0.00 0.00 39.78 37.39 1bci n ASN 85 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1bci s VAL 86 N 7.36 3.88 -0.72 2.41 1.01 -1.03 -1.28 120.40 132.03 1bci s VAL 86 Ca 1.14 -2.73 -0.26 0.00 0.00 0.00 0.00 61.98 60.13 1bci s VAL 86 Cb -0.53 -3.53 -0.13 0.00 0.00 0.00 0.00 36.38 32.19 1bci s VAL 86 CO 0.34 -0.86 2.42 -0.11 0.00 0.00 0.00 175.10 176.88 1bci n LEU 87 N 3.76 1.84 -4.40 3.92 7.94 -0.58 -2.57 117.00 126.91 1bci n LEU 87 Ca 0.06 -1.21 -0.45 0.00 -1.11 0.00 0.00 56.01 53.30 1bci n LEU 87 Cb 0.39 -1.61 -0.01 0.00 0.53 0.00 0.00 43.42 42.72 1bci n LEU 87 CO 0.34 -2.33 0.91 -1.61 -1.11 0.00 0.00 177.39 173.59 1bci s GLU 88 N 8.73 3.87 0.69 1.96 2.02 0.21 -2.19 118.70 133.99 1bci s GLU 88 Ca 0.96 -2.49 -0.07 0.00 0.02 0.00 0.00 54.97 53.38 1bci s GLU 88 Cb -0.17 -4.75 0.05 0.00 0.10 0.00 0.00 34.13 29.36 1bci s GLU 88 CO 0.14 -1.53 1.01 0.42 0.02 0.00 0.00 175.26 175.32 1bci s ILE 89 N 0.84 2.53 -0.30 -1.63 1.09 -0.22 -1.15 121.20 122.36 1bci s ILE 89 Ca 0.31 -0.18 -0.01 0.00 -1.10 0.00 0.00 60.65 59.67 1bci s ILE 89 Cb -0.07 -3.09 0.19 0.00 -1.06 0.00 0.00 42.46 38.43 1bci s ILE 89 CO -0.07 -0.10 0.64 -0.89 -0.10 0.00 0.00 174.94 174.43 1bci s THR 90 N -3.23 -0.94 -0.47 2.92 2.01 0.28 -2.33 115.64 113.89 1bci s THR 90 Ca 0.59 0.00 -0.27 0.00 0.31 0.00 0.00 61.69 62.32 1bci s THR 90 Cb -0.11 -0.99 0.03 0.00 0.01 0.00 0.00 72.50 71.44 1bci s THR 90 CO 0.45 0.00 1.02 -0.22 -0.69 0.00 0.00 174.62 175.18 1bci s LEU 91 N 2.86 3.85 0.00 4.42 1.98 -0.45 -0.84 118.68 130.50 1bci s LEU 91 Ca 0.18 0.26 0.00 0.00 -2.89 0.00 0.00 54.13 51.68 1bci s LEU 91 Cb -0.14 -3.35 0.00 0.00 0.66 0.00 0.00 46.19 43.37 1bci s LEU 91 CO -0.21 -1.14 0.00 0.23 -1.89 0.00 0.00 176.35 173.34 1bci n MET 92 N 7.46 1.32 -4.07 1.98 2.81 -0.32 -2.09 117.12 124.21 1bci n MET 92 Ca 0.09 -2.04 -0.33 0.00 -1.81 0.00 0.00 57.70 53.61 1bci n MET 92 Cb 0.49 0.54 -0.15 0.00 -0.71 0.00 0.00 33.22 33.38 1bci n MET 92 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1bci s ASP 93 N -2.54 4.01 -0.38 7.83 2.15 0.16 -2.01 116.67 125.89 1bci s ASP 93 Ca 0.00 -1.10 -0.28 0.00 0.43 0.00 0.00 52.55 51.59 1bci s ASP 93 Cb -0.00 -1.54 -0.00 0.00 -0.30 0.00 0.00 42.92 41.08 1bci s ASP 93 CO 0.00 -0.12 1.60 0.00 -0.17 0.00 0.00 175.17 176.48 1bci s ALA 94 N 1.19 2.94 0.00 3.66 0.00 0.44 -1.95 121.76 128.04 1bci s ALA 94 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 51.96 51.93 1bci s ALA 94 Cb -0.17 -3.99 0.00 0.00 0.00 0.00 0.00 23.12 18.96 1bci s ALA 94 CO -0.08 -2.55 0.00 0.09 0.00 0.00 0.00 175.76 173.22 1bci n ASN 95 N 9.60 0.07 -0.20 0.00 4.13 -1.26 -4.65 115.26 122.95 1bci n ASN 95 Ca 0.19 -0.56 0.05 0.00 1.68 0.00 0.00 54.58 55.94 1bci n ASN 95 Cb 0.48 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.71 1bci n ASN 95 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1bci n TYR 96 N -0.54 0.00 0.01 3.10 4.11 -1.26 -4.78 117.16 117.79 1bci n TYR 96 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.90 1bci n TYR 96 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.34 1bci n TYR 96 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.86 178.19 1bci n VAL 97 N -0.34 0.03 -3.72 -3.48 0.24 -1.26 -5.09 118.33 104.70 1bci n VAL 97 Ca 0.04 0.01 -0.13 0.00 -2.04 0.00 0.00 64.34 62.22 1bci n VAL 97 Cb 0.20 -0.91 -0.13 0.00 -1.47 0.00 0.00 33.84 31.53 1bci n VAL 97 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1bci s MET 98 N -2.00 0.19 0.80 7.34 -1.94 -1.26 -5.15 119.30 117.28 1bci s MET 98 Ca 0.00 0.56 -0.13 0.00 -1.71 0.00 0.00 55.69 54.41 1bci s MET 98 Cb 0.00 -0.11 0.08 0.00 2.01 0.00 0.00 34.83 36.80 1bci s MET 98 CO 0.00 -0.18 1.17 -0.51 -0.01 0.00 0.00 175.02 175.49 1bci s ASP 99 N 1.42 3.83 -0.20 3.03 1.01 -1.26 -4.44 116.67 120.05 1bci s ASP 99 Ca -0.08 2.21 -0.01 0.00 0.71 0.00 0.00 52.55 55.38 1bci s ASP 99 Cb -0.11 -2.57 0.06 0.00 1.01 0.00 0.00 42.92 41.31 1bci s ASP 99 CO -0.08 -2.50 -0.01 -1.61 0.21 0.00 0.00 175.17 171.17 1bci s GLU 100 N -4.31 1.10 0.23 8.23 0.41 -0.82 -4.95 118.70 118.58 1bci s GLU 100 Ca 0.70 -0.62 -0.30 0.00 -0.41 0.00 0.00 54.97 54.34 1bci s GLU 100 Cb -0.25 -2.23 -0.09 0.00 -1.78 0.00 0.00 34.13 29.78 1bci s GLU 100 CO 0.51 -0.59 1.36 0.99 -0.49 0.00 0.00 175.26 177.04 1bci s THR 101 N 1.67 2.95 -0.13 3.63 2.01 -1.26 -0.66 115.64 123.85 1bci s THR 101 Ca -0.02 0.81 -0.00 0.00 0.31 0.00 0.00 61.69 62.78 1bci s THR 101 Cb -0.17 -3.52 -0.08 0.00 0.01 0.00 0.00 72.50 68.74 1bci s THR 101 CO -0.07 0.13 -0.12 0.18 -0.69 0.00 0.00 174.62 174.05 1bci n LEU 102 N 2.30 2.66 -3.42 4.42 4.77 -0.89 -4.91 117.00 121.94 1bci n LEU 102 Ca 0.06 -0.03 0.01 0.00 -0.03 0.00 0.00 56.01 56.02 1bci n LEU 102 Cb 0.42 -0.43 -0.04 0.00 -2.33 0.00 0.00 43.42 41.04 1bci n LEU 102 CO 0.59 0.64 0.49 -0.83 -1.33 0.00 0.00 177.39 176.95 1bci s GLY 103 N -5.21 -0.39 0.45 -0.72 0.00 -0.89 -4.92 107.32 95.64 1bci s GLY 103 Ca -0.17 2.78 0.08 0.00 0.00 0.00 0.00 44.72 47.40 1bci s GLY 103 CO 0.28 3.25 0.48 -1.08 0.00 0.00 0.00 173.10 176.03 1bci s THR 104 N 2.63 2.57 0.03 0.90 -1.32 -1.26 -1.35 115.64 117.83 1bci s THR 104 Ca -0.02 -1.24 -0.09 0.00 -1.21 0.00 0.00 61.69 59.14 1bci s THR 104 Cb -0.08 -2.80 0.00 0.00 -1.51 0.00 0.00 72.50 68.11 1bci s THR 104 CO -0.18 0.00 0.18 0.00 -2.21 0.00 0.00 174.62 172.41 1bci s ALA 105 N -2.50 -0.35 -0.03 11.08 0.00 -0.98 -4.92 121.76 124.06 1bci s ALA 105 Ca 0.50 -0.24 -0.01 0.00 0.00 0.00 0.00 51.96 52.21 1bci s ALA 105 Cb -0.05 0.22 0.02 0.00 0.00 0.00 0.00 23.12 23.31 1bci s ALA 105 CO 0.30 -0.31 0.06 0.95 0.00 0.00 0.00 175.76 176.75 1bci s THR 106 N -2.19 -0.03 -0.18 0.00 -4.23 -1.25 -1.05 115.64 106.70 1bci s THR 106 Ca -0.08 0.12 -0.05 0.00 -1.18 0.00 0.00 61.69 60.50 1bci s THR 106 Cb -0.03 -0.11 0.09 0.00 1.34 0.00 0.00 72.50 73.79 1bci s THR 106 CO -0.02 0.05 0.34 0.12 -0.54 0.00 0.00 174.62 174.57 1bci s PHE 107 N 0.66 -0.62 -0.47 3.99 2.19 -0.93 -4.96 117.98 117.83 1bci s PHE 107 Ca -0.05 1.08 -0.28 0.00 0.33 0.00 0.00 56.93 58.01 1bci s PHE 107 Cb -0.07 0.07 -0.00 0.00 -1.31 0.00 0.00 43.02 41.70 1bci s PHE 107 CO -0.02 -0.49 1.59 0.99 1.83 0.00 0.00 175.22 179.12 1bci s THR 108 N 2.50 3.66 -0.26 0.12 2.01 -1.26 -1.52 115.64 120.89 1bci s THR 108 Ca 0.03 0.60 0.22 0.00 0.31 0.00 0.00 61.69 62.86 1bci s THR 108 Cb -0.13 -4.09 0.04 0.00 0.01 0.00 0.00 72.50 68.33 1bci s THR 108 CO -0.12 -0.83 1.11 1.62 -0.69 0.00 0.00 174.62 175.72 1bci h VAL 109 N 6.60 0.01 -0.03 3.82 3.04 -1.57 -3.34 116.25 124.77 1bci h VAL 109 Ca -0.29 -1.01 0.01 0.00 -1.01 0.00 0.00 66.70 64.40 1bci h VAL 109 Cb 1.13 1.57 -0.00 0.00 -2.01 0.00 0.00 31.29 31.98 1bci h VAL 109 CO 1.12 0.00 0.21 0.77 -1.01 0.00 0.00 177.57 178.67 1bci h SER 110 N 0.00 0.00 -2.56 3.17 4.64 -1.88 -3.11 113.55 113.81 1bci h SER 110 Ca -0.00 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.72 1bci h SER 110 Cb 1.01 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.70 1bci h SER 110 CO 0.00 0.00 -0.81 -1.54 -0.87 0.00 0.00 176.83 173.61 1bci n SER 111 N -3.08 1.25 -3.92 4.97 3.41 -1.25 -5.00 113.62 109.99 1bci n SER 111 Ca -0.02 -2.81 -0.25 0.00 -0.26 0.00 0.00 58.87 55.53 1bci n SER 111 Cb 0.27 -0.65 -0.08 0.00 -0.26 0.00 0.00 64.21 63.50 1bci n SER 111 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1bci s MET 112 N -0.88 1.93 -1.05 4.33 -1.94 -1.18 -5.01 119.30 115.51 1bci s MET 112 Ca 0.31 -2.17 -0.03 0.00 -1.71 0.00 0.00 55.69 52.09 1bci s MET 112 Cb 0.04 -0.39 0.25 0.00 2.01 0.00 0.00 34.83 36.73 1bci s MET 112 CO -0.16 -0.54 2.08 1.63 -0.01 0.00 0.00 175.02 178.01 1bci n LYS 113 N -0.88 4.68 -1.36 2.03 4.01 -1.26 -5.02 118.16 120.36 1bci n LYS 113 Ca -0.03 -4.03 -0.41 0.00 -0.51 0.00 0.00 58.31 53.33 1bci n LYS 113 Cb 0.64 -2.47 0.01 0.00 -0.51 0.00 0.00 35.03 32.70 1bci n LYS 113 CO 0.00 0.00 0.00 1.55 -1.11 0.00 0.00 177.40 177.84 1bci n VAL 114 N 0.45 1.14 0.00 -0.18 3.14 -1.26 -4.51 118.33 117.11 1bci n VAL 114 Ca 0.52 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 61.40 1bci n VAL 114 Cb 0.27 -0.25 0.00 0.00 -1.06 0.00 0.00 33.84 32.81 1bci n VAL 114 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1bci n GLY 115 N 2.11 0.48 1.77 7.55 0.00 -1.18 -4.98 105.19 110.93 1bci n GLY 115 Ca 0.11 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.09 1bci n GLY 115 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1bci n GLU 116 N 0.00 0.53 -1.89 1.61 2.13 -1.26 -5.00 120.64 116.77 1bci n GLU 116 Ca 0.00 -1.05 -0.29 0.00 0.66 0.00 0.00 57.16 56.48 1bci n GLU 116 Cb 0.00 1.31 0.14 0.00 0.27 0.00 0.00 31.44 33.16 1bci n GLU 116 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1bci s LYS 117 N -2.04 1.20 -0.23 5.31 2.20 -1.26 -2.46 119.74 122.45 1bci s LYS 117 Ca 0.07 -0.15 -0.04 0.00 -0.36 0.00 0.00 55.97 55.49 1bci s LYS 117 Cb -0.02 -1.89 0.09 0.00 -1.51 0.00 0.00 37.83 34.50 1bci s LYS 117 CO 0.06 -2.08 0.17 0.15 -0.36 0.00 0.00 175.35 173.29 1bci s LYS 118 N -5.73 0.17 -0.90 4.03 -0.14 0.12 -4.82 119.74 112.48 1bci s LYS 118 Ca 0.68 -0.10 -0.20 0.00 -1.36 0.00 0.00 55.97 54.99 1bci s LYS 118 Cb -0.07 -1.29 0.10 0.00 -1.68 0.00 0.00 37.83 34.89 1bci s LYS 118 CO 0.51 -0.80 1.16 -1.21 -0.76 0.00 0.00 175.35 174.26 1bci s GLU 119 N 2.23 3.51 -0.30 1.68 2.02 -1.26 -2.09 118.70 124.49 1bci s GLU 119 Ca 0.06 -1.46 -0.21 0.00 0.02 0.00 0.00 54.97 53.39 1bci s GLU 119 Cb -0.16 -4.87 -0.01 0.00 0.10 0.00 0.00 34.13 29.19 1bci s GLU 119 CO -0.20 -1.87 0.65 0.08 0.02 0.00 0.00 175.26 173.94 1bci s VAL 120 N 3.41 4.92 -0.59 2.63 1.01 -0.88 -4.93 120.40 125.96 1bci s VAL 120 Ca 0.34 0.92 -0.26 0.00 0.00 0.00 0.00 61.98 62.97 1bci s VAL 120 Cb -0.06 -4.02 0.04 0.00 0.00 0.00 0.00 36.38 32.34 1bci s VAL 120 CO -0.06 -0.15 1.08 -2.16 0.00 0.00 0.00 175.10 173.81 1bci s PRO 121 N 2.66 3.37 -0.44 2.72 0.04 -1.26 -2.49 135.00 139.59 1bci s PRO 121 Ca 0.26 -0.10 -0.03 0.00 0.04 0.00 0.00 61.00 61.17 1bci s PRO 121 Cb -0.15 -4.07 0.12 0.00 0.04 0.00 0.00 34.50 30.44 1bci s PRO 121 CO 0.12 -1.66 0.24 -0.06 0.04 0.00 0.00 177.00 175.67 1bci s PHE 122 N 4.55 3.56 -0.17 0.56 0.08 -0.68 -5.00 117.98 120.88 1bci s PHE 122 Ca 0.35 -2.47 -0.07 0.00 0.12 0.00 0.00 56.93 54.86 1bci s PHE 122 Cb -0.10 -3.22 -0.04 0.00 -0.57 0.00 0.00 43.02 39.09 1bci s PHE 122 CO 0.20 -0.95 0.08 0.42 -0.10 0.00 0.00 175.22 174.87 1bci s ILE 123 N 0.97 4.95 -0.06 0.64 1.01 -1.26 -1.28 121.20 126.16 1bci s ILE 123 Ca 0.09 0.02 -0.04 0.00 0.00 0.00 0.00 60.65 60.72 1bci s ILE 123 Cb -0.22 -3.22 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 1bci s ILE 123 CO -0.04 0.48 0.13 -0.36 0.00 0.00 0.00 174.94 175.16 1bci s PHE 124 N 0.13 3.49 0.00 3.97 0.08 -0.80 -4.79 117.98 120.06 1bci s PHE 124 Ca 0.06 0.39 0.00 0.00 0.12 0.00 0.00 56.93 57.50 1bci s PHE 124 Cb -0.12 -1.86 0.00 0.00 -0.57 0.00 0.00 43.02 40.47 1bci s PHE 124 CO 0.00 0.65 0.00 0.09 -0.10 0.00 0.00 175.22 175.87 1bci n ASN 125 N 1.52 0.00 0.00 1.36 3.02 -1.26 -2.11 115.26 117.79 1bci n ASN 125 Ca -0.16 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.39 1bci n ASN 125 Cb 0.54 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.71 1bci n ASN 125 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1bci n GLN 126 N 0.00 0.00 0.04 3.52 10.64 -1.26 -4.95 117.38 125.36 1bci n GLN 126 Ca 0.00 0.00 0.08 0.00 -1.83 0.00 0.00 57.00 55.25 1bci n GLN 126 Cb 0.00 0.00 -0.08 0.00 -0.86 0.00 0.00 30.24 29.30 1bci n GLN 126 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.06 176.56 1bci n VAL 127 N -1.33 0.58 -2.14 -0.39 0.24 -1.23 -4.92 118.33 109.14 1bci n VAL 127 Ca 0.00 -0.58 -0.42 0.00 -2.04 0.00 0.00 64.34 61.30 1bci n VAL 127 Cb 0.00 -0.31 -0.03 0.00 -1.47 0.00 0.00 33.84 32.03 1bci n VAL 127 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1bci s THR 128 N -3.27 3.11 -0.09 3.34 2.01 -0.89 -4.51 115.64 115.33 1bci s THR 128 Ca -0.04 0.86 -0.01 0.00 0.31 0.00 0.00 61.69 62.81 1bci s THR 128 Cb 0.11 -3.55 0.03 0.00 0.01 0.00 0.00 72.50 69.09 1bci s THR 128 CO 0.84 0.10 -0.04 -0.70 -0.69 0.00 0.00 174.62 174.13 1bci s GLU 129 N 0.44 1.05 -0.16 4.92 2.56 -0.93 -1.90 118.70 124.68 1bci s GLU 129 Ca 0.61 -0.07 -0.04 0.00 0.00 0.00 0.00 54.97 55.47 1bci s GLU 129 Cb -0.38 -1.26 0.06 0.00 2.00 0.00 0.00 34.13 34.55 1bci s GLU 129 CO 0.35 -0.28 0.08 1.41 -0.56 0.00 0.00 175.26 176.26 1bci s MET 130 N 1.82 0.18 -0.20 4.30 -2.45 -0.40 -0.41 119.30 122.14 1bci s MET 130 Ca 0.05 -0.12 -0.12 0.00 -1.25 0.00 0.00 55.69 54.25 1bci s MET 130 Cb -0.12 -1.79 -0.05 0.00 1.25 0.00 0.00 34.83 34.12 1bci s MET 130 CO -0.06 -0.64 0.20 0.08 1.05 0.00 0.00 175.02 175.65 1bci s VAL 131 N 2.08 5.36 -0.22 10.11 1.01 -0.99 -1.69 120.40 136.05 1bci s VAL 131 Ca 0.02 0.32 0.01 0.00 0.00 0.00 0.00 61.98 62.33 1bci s VAL 131 Cb -0.16 -3.54 0.03 0.00 0.00 0.00 0.00 36.38 32.72 1bci s VAL 131 CO -0.08 0.39 -0.14 -0.22 0.00 0.00 0.00 175.10 175.04 1bci s LEU 132 N 0.63 2.78 -0.46 3.92 2.96 -1.04 -1.72 118.68 125.76 1bci s LEU 132 Ca 0.11 -0.95 -0.17 0.00 -0.22 0.00 0.00 54.13 52.91 1bci s LEU 132 Cb -0.12 -1.54 0.05 0.00 0.50 0.00 0.00 46.19 45.08 1bci s LEU 132 CO 0.02 -0.09 0.44 -1.61 -1.32 0.00 0.00 176.35 173.79 1bci s GLU 133 N 1.23 3.03 -0.09 1.98 2.02 -0.54 -2.08 118.70 124.26 1bci s GLU 133 Ca -0.01 -1.06 0.03 0.00 0.02 0.00 0.00 54.97 53.95 1bci s GLU 133 Cb -0.16 -4.06 0.01 0.00 0.10 0.00 0.00 34.13 30.02 1bci s GLU 133 CO -0.09 -0.98 -0.17 0.00 0.02 0.00 0.00 175.26 174.04 1bci s MET 134 N 1.97 2.29 -0.09 1.61 0.23 -0.89 0.01 119.30 124.43 1bci s MET 134 Ca 0.08 -0.61 0.01 0.00 -1.03 0.00 0.00 55.69 54.14 1bci s MET 134 Cb -0.21 -1.83 -0.03 0.00 -1.53 0.00 0.00 34.83 31.23 1bci s MET 134 CO 0.10 0.05 -0.09 -1.54 -2.03 0.00 0.00 175.02 171.51 1bci s SER 135 N 0.64 4.39 0.09 -1.18 1.04 0.00 0.16 113.70 118.85 1bci s SER 135 Ca -0.14 -0.14 0.01 0.00 0.48 0.00 0.00 55.95 56.16 1bci s SER 135 Cb -0.16 -1.28 -0.04 0.00 0.10 0.00 0.00 66.02 64.64 1bci s SER 135 CO 0.04 0.29 0.21 -0.22 0.98 0.00 0.00 173.24 174.54 1bci s LEU 136 N -0.37 4.26 -0.02 2.42 2.96 -1.03 -2.01 118.68 124.89 1bci s LEU 136 Ca 0.05 0.19 -0.30 0.00 -0.22 0.00 0.00 54.13 53.85 1bci s LEU 136 Cb -0.12 -2.86 0.11 0.00 0.50 0.00 0.00 46.19 43.81 1bci s LEU 136 CO 0.02 0.13 0.97 -1.61 -1.32 0.00 0.00 176.35 174.54 1bci s GLU 137 N -2.73 0.75 0.00 1.98 2.02 -0.46 -3.12 118.70 117.14 1bci s GLU 137 Ca 0.34 -0.30 0.00 0.00 0.02 0.00 0.00 54.97 55.03 1bci s GLU 137 Cb -0.12 0.33 0.00 0.00 0.10 0.00 0.00 34.13 34.44 1bci s GLU 137 CO 0.27 -0.33 0.00 1.33 0.02 0.00 0.00 175.26 176.55