#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1beb s THR 6 N 0.00 2.88 0.02 5.09 -4.23 -1.26 -4.66 115.64 113.47 1beb s THR 6 Ca 0.00 -1.04 -0.30 0.00 -1.18 0.00 0.00 61.69 59.16 1beb s THR 6 Cb 0.00 -2.92 -0.04 0.00 1.34 0.00 0.00 72.50 70.88 1beb s THR 6 CO 0.00 0.00 1.13 -0.32 -0.54 0.00 0.00 174.62 174.89 1beb s MET 7 N -4.35 4.45 -0.14 3.99 1.75 -0.26 -4.94 119.30 119.81 1beb s MET 7 Ca 0.55 1.64 -0.15 0.00 -1.25 0.00 0.00 55.69 56.48 1beb s MET 7 Cb -0.09 -3.42 -0.05 0.00 2.84 0.00 0.00 34.83 34.12 1beb s MET 7 CO 0.33 -0.23 0.35 0.15 -0.65 0.00 0.00 175.02 174.96 1beb s LYS 8 N 1.28 4.25 -0.09 4.11 -0.14 -1.26 -4.19 119.74 123.69 1beb s LYS 8 Ca 0.56 0.21 0.00 0.00 -1.36 0.00 0.00 55.97 55.38 1beb s LYS 8 Cb -0.26 -3.41 0.00 0.00 -1.68 0.00 0.00 37.83 32.48 1beb s LYS 8 CO 0.27 0.25 0.00 0.41 -0.76 0.00 0.00 175.35 175.52 1beb n GLY 9 N 3.24 0.39 3.70 -3.33 0.00 -1.26 -4.98 105.19 102.95 1beb n GLY 9 Ca -0.11 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.54 1beb n GLY 9 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1beb n LEU 10 N -0.12 3.91 -4.19 0.99 7.94 -1.26 -4.96 117.00 119.30 1beb n LEU 10 Ca -0.01 1.03 -0.39 0.00 -1.11 0.00 0.00 56.01 55.53 1beb n LEU 10 Cb 0.27 -1.54 -0.10 0.00 0.53 0.00 0.00 43.42 42.58 1beb n LEU 10 CO 0.01 0.13 -0.10 -0.62 -1.11 0.00 0.00 177.39 175.70 1beb s ASP 11 N 1.89 5.50 0.56 1.96 -1.08 -1.26 -4.82 116.67 119.42 1beb s ASP 11 Ca 0.79 -1.84 0.32 0.00 -0.52 0.00 0.00 52.55 51.30 1beb s ASP 11 Cb -0.52 -1.93 1.62 0.00 -1.46 0.00 0.00 42.92 40.63 1beb s ASP 11 CO 0.35 -0.59 2.11 -0.29 0.52 0.00 0.00 175.17 177.28 1beb h ILE 12 N 6.21 0.36 0.00 4.11 6.09 -1.93 -2.58 117.51 129.77 1beb h ILE 12 Ca -0.19 -0.43 -0.05 0.00 -1.37 0.00 0.00 64.86 62.83 1beb h ILE 12 Cb 1.07 1.31 -0.01 0.00 0.47 0.00 0.00 36.82 39.66 1beb h ILE 12 CO 0.77 0.07 -0.24 1.56 -3.07 0.00 0.00 178.15 177.24 1beb h GLN 13 N 0.00 0.00 0.00 2.19 1.08 -1.94 -3.03 115.11 113.41 1beb h GLN 13 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1beb h GLN 13 Cb 0.30 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 1beb h GLN 13 CO 0.01 0.24 0.00 1.63 -0.95 0.00 0.00 178.83 179.76 1beb n LYS 14 N -3.55 0.55 -0.15 1.46 5.02 -0.97 -3.18 118.16 117.34 1beb n LYS 14 Ca -0.01 0.02 0.12 0.00 -2.02 0.00 0.00 58.31 56.42 1beb n LYS 14 Cb 0.39 -1.50 0.19 0.00 -0.02 0.00 0.00 35.03 34.09 1beb n LYS 14 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1beb n VAL 15 N -1.20 0.42 -1.90 -0.18 0.24 -1.14 -4.86 118.33 109.71 1beb n VAL 15 Ca 0.16 -0.71 -0.41 0.00 -2.04 0.00 0.00 64.34 61.33 1beb n VAL 15 Cb 0.18 1.07 -0.02 0.00 -1.47 0.00 0.00 33.84 33.60 1beb n VAL 15 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1beb s ALA 16 N -1.53 3.65 0.00 2.33 0.00 -1.19 -4.61 121.76 120.41 1beb s ALA 16 Ca 0.36 1.46 0.00 0.00 0.00 0.00 0.00 51.96 53.78 1beb s ALA 16 Cb 0.22 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.74 1beb s ALA 16 CO 0.30 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.60 1beb n GLY 17 N 1.79 0.92 3.76 0.00 0.00 -0.71 -4.97 105.19 105.98 1beb n GLY 17 Ca 0.06 -2.09 -0.39 0.00 0.00 0.00 0.00 46.02 43.60 1beb n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1beb s THR 18 N -1.05 3.46 0.06 2.61 2.01 -1.26 -1.23 115.64 120.24 1beb s THR 18 Ca 0.00 1.39 -0.04 0.00 0.31 0.00 0.00 61.69 63.35 1beb s THR 18 Cb 0.00 -3.85 -0.02 0.00 0.01 0.00 0.00 72.50 68.63 1beb s THR 18 CO 0.00 0.27 0.05 0.26 -0.69 0.00 0.00 174.62 174.51 1beb s TRP 19 N -1.27 0.36 0.02 4.92 0.52 -1.02 -4.67 118.94 117.79 1beb s TRP 19 Ca 0.48 -0.82 0.06 0.00 0.02 0.00 0.00 56.10 55.84 1beb s TRP 19 Cb -0.30 -0.25 -0.02 0.00 -1.15 0.00 0.00 33.47 31.74 1beb s TRP 19 CO 0.39 -0.42 -0.19 0.71 0.02 0.00 0.00 176.95 177.46 1beb s TYR 20 N -3.60 1.71 -0.64 -1.98 1.51 0.13 -4.26 117.35 110.22 1beb s TYR 20 Ca 0.04 -0.35 -0.28 0.00 -1.01 0.00 0.00 57.07 55.47 1beb s TYR 20 Cb 0.05 -1.05 0.03 0.00 -0.11 0.00 0.00 41.96 40.88 1beb s TYR 20 CO -0.09 0.03 1.22 -1.12 -1.11 0.00 0.00 175.55 174.48 1beb s SER 21 N -0.84 6.34 -0.02 2.29 0.01 -1.26 -1.37 113.70 118.85 1beb s SER 21 Ca 0.07 -0.11 -0.20 0.00 1.31 0.00 0.00 55.95 57.02 1beb s SER 21 Cb -0.08 -2.55 -0.33 0.00 0.21 0.00 0.00 66.02 63.27 1beb s SER 21 CO 0.01 -1.62 0.94 0.25 0.41 0.00 0.00 173.24 173.23 1beb h LEU 22 N 12.34 0.62 -7.70 2.44 6.46 -1.41 -3.44 115.31 124.62 1beb h LEU 22 Ca -0.26 -0.93 -0.11 0.00 -0.12 0.00 0.00 57.88 56.45 1beb h LEU 22 Cb 1.05 -0.20 -0.18 0.00 -0.73 0.00 0.00 40.66 40.60 1beb h LEU 22 CO 1.22 1.51 -0.38 0.00 -0.62 0.00 0.00 178.44 180.18 1beb s ALA 23 N -2.52 -0.42 0.04 1.25 0.00 -1.12 -0.79 121.76 118.20 1beb s ALA 23 Ca -0.12 -0.20 -0.10 0.00 0.00 0.00 0.00 51.96 51.55 1beb s ALA 23 Cb 0.02 0.25 0.01 0.00 0.00 0.00 0.00 23.12 23.40 1beb s ALA 23 CO 0.88 -0.34 0.20 0.00 0.00 0.00 0.00 175.76 176.50 1beb s MET 24 N -2.35 0.70 0.02 0.00 0.23 -0.71 -0.44 119.30 116.74 1beb s MET 24 Ca -0.07 -0.61 -0.11 0.00 -1.03 0.00 0.00 55.69 53.87 1beb s MET 24 Cb -0.02 0.29 0.01 0.00 -1.53 0.00 0.00 34.83 33.58 1beb s MET 24 CO -0.03 -0.20 0.23 0.00 -2.03 0.00 0.00 175.02 173.00 1beb s ALA 25 N -2.54 -0.53 0.07 3.16 0.00 -0.20 -0.92 121.76 120.80 1beb s ALA 25 Ca -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 51.96 51.87 1beb s ALA 25 Cb -0.01 0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.27 1beb s ALA 25 CO -0.04 -0.31 -0.04 0.00 0.00 0.00 0.00 175.76 175.37 1beb s ALA 26 N -2.00 0.67 0.11 0.00 0.00 -0.68 -0.67 121.76 119.19 1beb s ALA 26 Ca -0.09 -1.24 0.16 0.00 0.00 0.00 0.00 51.96 50.79 1beb s ALA 26 Cb -0.03 0.22 0.47 0.00 0.00 0.00 0.00 23.12 23.78 1beb s ALA 26 CO -0.00 -0.31 1.63 0.66 0.00 0.00 0.00 175.76 177.74 1beb h SER 27 N 3.13 0.00 -3.33 0.00 4.64 -1.22 0.31 113.55 117.08 1beb h SER 27 Ca -0.34 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.44 1beb h SER 27 Cb 1.15 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 62.90 1beb h SER 27 CO 0.65 0.46 -0.82 -0.62 -0.87 0.00 0.00 176.83 175.63 1beb s ASP 28 N -6.49 2.05 0.34 4.97 2.15 -1.26 -3.88 116.67 114.54 1beb s ASP 28 Ca 0.01 -0.34 0.11 0.00 0.43 0.00 0.00 52.55 52.76 1beb s ASP 28 Cb 0.10 -0.91 0.92 0.00 -0.30 0.00 0.00 42.92 42.74 1beb s ASP 28 CO 0.71 -0.00 1.74 0.40 -0.17 0.00 0.00 175.17 177.85 1beb h ILE 29 N 6.01 0.55 0.00 4.11 2.04 -1.85 -1.82 117.51 126.55 1beb h ILE 29 Ca -0.31 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.36 1beb h ILE 29 Cb 1.17 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 1beb h ILE 29 CO 0.47 0.10 0.00 0.77 0.00 0.00 0.00 178.15 179.49 1beb h SER 30 N 0.56 0.00 0.67 1.72 4.64 -1.96 0.18 113.55 119.36 1beb h SER 30 Ca 0.63 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.88 1beb h SER 30 Cb 1.26 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 1beb h SER 30 CO -0.42 0.00 -0.30 -0.07 -0.87 0.00 0.00 176.83 175.16 1beb h LEU 31 N 0.00 0.00 0.00 5.97 3.38 -1.56 -3.34 115.31 119.76 1beb h LEU 31 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1beb h LEU 31 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1beb h LEU 31 CO 0.00 0.30 -0.13 0.18 0.09 0.00 0.00 178.44 178.88 1beb n LEU 32 N -3.63 0.00 -4.64 1.67 4.32 -0.89 -3.42 117.00 110.42 1beb n LEU 32 Ca -0.01 -0.27 -0.43 0.00 -0.02 0.00 0.00 56.01 55.29 1beb n LEU 32 Cb 0.42 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.20 1beb n LEU 32 CO 0.35 0.00 1.43 -0.62 -1.22 0.00 0.00 177.39 177.33 1beb s ASP 33 N -0.80 6.39 0.00 -1.43 2.15 0.58 -4.66 116.67 118.91 1beb s ASP 33 Ca 0.00 1.92 0.00 0.00 0.43 0.00 0.00 52.55 54.90 1beb s ASP 33 Cb 0.00 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.09 1beb s ASP 33 CO 0.00 -1.20 0.00 0.00 -0.17 0.00 0.00 175.17 173.80 1beb n ALA 34 N 8.25 -1.09 -0.32 3.66 0.00 -1.26 -3.79 120.51 125.96 1beb n ALA 34 Ca 0.19 0.00 0.32 0.00 0.00 0.00 0.00 53.44 53.96 1beb n ALA 34 Cb 0.44 -0.42 0.70 0.00 0.00 0.00 0.00 19.45 20.18 1beb n ALA 34 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1beb h GLN 35 N 0.00 0.08 -0.01 0.00 1.08 -1.98 0.37 115.11 114.65 1beb h GLN 35 Ca 0.00 -0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1beb h GLN 35 Cb 0.00 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.41 1beb h GLN 35 CO 0.00 0.05 -0.19 -1.13 -0.95 0.00 0.00 178.83 176.61 1beb n SER 36 N -4.28 0.75 -4.50 1.46 3.41 -1.26 -4.56 113.62 104.64 1beb n SER 36 Ca 0.25 -0.72 -0.43 0.00 -0.26 0.00 0.00 58.87 57.71 1beb n SER 36 Cb 1.16 0.03 -0.00 0.00 -0.26 0.00 0.00 64.21 65.14 1beb n SER 36 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1beb n ALA 37 N -0.81 -1.19 -2.19 7.33 0.00 0.13 -4.87 120.51 118.90 1beb n ALA 37 Ca 0.13 0.28 -0.42 0.00 0.00 0.00 0.00 53.44 53.43 1beb n ALA 37 Cb 0.32 -1.85 -0.03 0.00 0.00 0.00 0.00 19.45 17.89 1beb n ALA 37 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1beb s PRO 38 N -1.52 4.41 0.00 0.00 0.04 -1.24 -2.46 135.00 134.23 1beb s PRO 38 Ca 0.62 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.59 1beb s PRO 38 Cb -0.68 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 30.60 1beb s PRO 38 CO 0.58 -0.26 0.00 1.28 0.04 0.00 0.00 177.00 178.64 1beb n LEU 39 N 3.34 0.00 -4.54 -3.56 4.77 -1.25 -4.34 117.00 111.42 1beb n LEU 39 Ca 0.08 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.63 1beb n LEU 39 Cb 0.44 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1beb n LEU 39 CO 0.57 0.00 1.76 -0.60 -1.33 0.00 0.00 177.39 177.79 1beb s ARG 40 N -0.80 3.99 -0.02 3.23 6.06 -1.03 -4.90 118.95 125.48 1beb s ARG 40 Ca 0.00 -2.10 0.05 0.00 -2.50 0.00 0.00 55.73 51.18 1beb s ARG 40 Cb 0.00 -5.38 -0.01 0.00 0.06 0.00 0.00 34.95 29.62 1beb s ARG 40 CO 0.00 -2.11 -0.18 0.14 -2.50 0.00 0.00 175.30 170.65 1beb s VAL 41 N 3.50 1.47 -0.23 7.11 -7.23 -1.26 -4.65 120.40 119.10 1beb s VAL 41 Ca 0.50 -0.78 -0.06 0.00 -1.81 0.00 0.00 61.98 59.83 1beb s VAL 41 Cb 0.02 -1.23 -0.02 0.00 0.56 0.00 0.00 36.38 35.71 1beb s VAL 41 CO 0.04 0.42 0.02 -0.31 -0.31 0.00 0.00 175.10 174.96 1beb s TYR 42 N -0.35 3.04 0.24 2.82 2.02 -0.13 -4.94 117.35 120.04 1beb s TYR 42 Ca 0.05 -0.59 -0.30 0.00 -0.37 0.00 0.00 57.07 55.86 1beb s TYR 42 Cb -0.08 -2.17 -0.10 0.00 -0.40 0.00 0.00 41.96 39.21 1beb s TYR 42 CO -0.00 -0.40 1.41 0.08 -1.57 0.00 0.00 175.55 175.07 1beb s VAL 43 N 1.48 2.78 -0.21 0.71 1.01 -1.26 -0.05 120.40 124.85 1beb s VAL 43 Ca 0.06 0.65 -0.11 0.00 0.00 0.00 0.00 61.98 62.57 1beb s VAL 43 Cb -0.15 -3.41 -0.09 0.00 0.00 0.00 0.00 36.38 32.73 1beb s VAL 43 CO 0.01 0.10 -0.28 -0.62 0.00 0.00 0.00 175.10 174.31 1beb n GLU 44 N 2.41 0.46 -3.86 2.72 1.02 0.16 -4.23 120.64 119.32 1beb n GLU 44 Ca 0.07 0.20 -0.11 0.00 -0.02 0.00 0.00 57.16 57.29 1beb n GLU 44 Cb 0.41 -1.27 -0.10 0.00 -0.02 0.00 0.00 31.44 30.46 1beb n GLU 44 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1beb s GLU 45 N -2.41 0.51 -0.18 3.49 2.12 -1.13 -2.45 118.70 118.64 1beb s GLU 45 Ca -0.30 -0.36 -0.01 0.00 0.36 0.00 0.00 54.97 54.66 1beb s GLU 45 Cb 0.11 0.21 -0.00 0.00 0.26 0.00 0.00 34.13 34.71 1beb s GLU 45 CO 0.38 -0.12 -0.12 -0.51 -0.54 0.00 0.00 175.26 174.34 1beb s LEU 46 N -1.35 2.57 -0.33 2.70 1.02 -0.36 -0.94 118.68 121.98 1beb s LEU 46 Ca -0.14 -0.47 0.02 0.00 0.02 0.00 0.00 54.13 53.56 1beb s LEU 46 Cb -0.07 -1.61 0.10 0.00 0.02 0.00 0.00 46.19 44.63 1beb s LEU 46 CO 0.02 0.03 0.08 -0.54 0.02 0.00 0.00 176.35 175.96 1beb s LYS 47 N 1.13 1.15 0.34 1.70 1.02 0.10 -1.73 119.74 123.45 1beb s LYS 47 Ca 0.01 -1.55 -0.27 0.00 0.02 0.00 0.00 55.97 54.18 1beb s LYS 47 Cb -0.14 -2.67 -0.09 0.00 -0.52 0.00 0.00 37.83 34.41 1beb s LYS 47 CO -0.04 -0.97 1.12 -1.25 -0.92 0.00 0.00 175.35 173.29 1beb s PRO 48 N 1.18 4.37 0.34 -1.68 0.04 -1.26 -0.33 135.00 137.66 1beb s PRO 48 Ca 0.11 1.78 -0.04 0.00 0.04 0.00 0.00 61.00 62.88 1beb s PRO 48 Cb -0.18 -2.91 -0.05 0.00 0.04 0.00 0.00 34.50 31.40 1beb s PRO 48 CO -0.15 -0.03 0.61 0.95 0.04 0.00 0.00 177.00 178.42 1beb s THR 49 N -1.33 5.01 0.60 1.26 -4.23 0.02 -4.91 115.64 112.05 1beb s THR 49 Ca 0.51 -0.01 0.29 0.00 -1.18 0.00 0.00 61.69 61.30 1beb s THR 49 Cb -0.30 -3.79 0.36 0.00 1.34 0.00 0.00 72.50 70.12 1beb s THR 49 CO 0.38 -0.48 2.01 1.55 -0.54 0.00 0.00 174.62 177.54 1beb h PRO 50 N 1.19 0.00 -0.01 3.99 0.13 -1.96 -1.28 132.00 134.06 1beb h PRO 50 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1beb h PRO 50 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1beb h PRO 50 CO 0.64 0.00 -0.07 0.39 -0.23 0.00 0.00 178.00 178.73 1beb n GLU 51 N -3.62 1.21 0.00 0.86 -0.58 -1.26 -4.92 120.64 112.32 1beb n GLU 51 Ca 0.03 -0.59 0.00 0.00 -0.42 0.00 0.00 57.16 56.19 1beb n GLU 51 Cb 0.45 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 1beb n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1beb n GLY 52 N 1.20 0.67 3.95 0.62 0.00 -0.48 -5.02 105.19 106.12 1beb n GLY 52 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 1beb n GLY 52 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1beb s ASP 53 N -1.86 4.47 -0.04 1.61 1.01 -1.26 -4.50 116.67 116.10 1beb s ASP 53 Ca 0.00 0.23 0.02 0.00 0.71 0.00 0.00 52.55 53.51 1beb s ASP 53 Cb 0.00 -0.74 0.01 0.00 1.01 0.00 0.00 42.92 43.20 1beb s ASP 53 CO 0.00 -1.81 -0.07 -0.22 0.21 0.00 0.00 175.17 173.28 1beb s LEU 54 N -5.30 1.58 -0.22 1.23 2.96 -0.46 -0.80 118.68 117.66 1beb s LEU 54 Ca 0.63 -0.16 -0.07 0.00 -0.22 0.00 0.00 54.13 54.32 1beb s LEU 54 Cb -0.08 -0.50 -0.03 0.00 0.50 0.00 0.00 46.19 46.08 1beb s LEU 54 CO 0.46 0.01 0.05 -0.70 -1.32 0.00 0.00 176.35 174.84 1beb s GLU 55 N 0.55 3.73 -0.21 1.98 2.12 0.56 0.05 118.70 127.47 1beb s GLU 55 Ca -0.08 -0.45 -0.01 0.00 0.36 0.00 0.00 54.97 54.78 1beb s GLU 55 Cb -0.12 -3.24 0.01 0.00 0.26 0.00 0.00 34.13 31.05 1beb s GLU 55 CO 0.01 -0.02 -0.11 -1.50 -0.54 0.00 0.00 175.26 173.09 1beb s ILE 56 N 1.16 2.71 -0.05 -3.70 1.10 0.14 0.03 121.20 122.60 1beb s ILE 56 Ca 0.04 -0.79 -0.14 0.00 -0.51 0.00 0.00 60.65 59.25 1beb s ILE 56 Cb -0.14 -2.23 -0.05 0.00 0.15 0.00 0.00 42.46 40.18 1beb s ILE 56 CO 0.03 0.43 0.38 -0.76 -2.11 0.00 0.00 174.94 172.90 1beb s LEU 57 N 1.37 4.42 0.10 8.50 1.43 -0.11 -1.32 118.68 133.06 1beb s LEU 57 Ca 0.04 0.84 -0.04 0.00 -1.03 0.00 0.00 54.13 53.95 1beb s LEU 57 Cb -0.14 -2.52 -0.03 0.00 0.03 0.00 0.00 46.19 43.53 1beb s LEU 57 CO -0.08 0.27 0.09 -1.48 0.23 0.00 0.00 176.35 175.38 1beb s LEU 58 N -0.68 1.80 -0.09 1.79 0.05 0.20 -0.66 118.68 121.07 1beb s LEU 58 Ca 0.22 -0.98 0.01 0.00 0.05 0.00 0.00 54.13 53.43 1beb s LEU 58 Cb -0.16 0.56 -0.02 0.00 -2.05 0.00 0.00 46.19 44.52 1beb s LEU 58 CO 0.11 -0.72 -0.12 -1.10 -0.55 0.00 0.00 176.35 173.98 1beb s GLN 59 N -3.96 2.99 -0.06 1.48 -0.21 0.92 -0.62 119.66 120.20 1beb s GLN 59 Ca 0.14 -0.65 -0.03 0.00 0.02 0.00 0.00 55.36 54.84 1beb s GLN 59 Cb 0.06 -2.56 0.04 0.00 1.00 0.00 0.00 33.01 31.56 1beb s GLN 59 CO -0.05 0.44 0.14 0.21 -2.12 0.00 0.00 175.29 173.91 1beb s LYS 60 N -0.23 0.08 -0.23 2.91 2.20 0.50 -0.96 119.74 124.02 1beb s LYS 60 Ca 0.01 0.37 -0.29 0.00 -0.36 0.00 0.00 55.97 55.70 1beb s LYS 60 Cb -0.13 -0.19 -0.01 0.00 -1.51 0.00 0.00 37.83 36.00 1beb s LYS 60 CO 0.03 -0.17 1.27 -0.46 -0.36 0.00 0.00 175.35 175.66 1beb s TRP 61 N 1.21 2.80 0.00 4.03 -0.11 -1.26 -0.35 118.94 125.26 1beb s TRP 61 Ca -0.09 0.97 0.00 0.00 1.22 0.00 0.00 56.10 58.20 1beb s TRP 61 Cb -0.12 -3.68 0.00 0.00 -1.50 0.00 0.00 33.47 28.17 1beb s TRP 61 CO -0.06 -1.64 0.00 0.39 -4.62 0.00 0.00 176.95 171.03 1beb n GLU 62 N 6.93 0.00 -3.97 5.86 1.02 -0.92 -4.71 120.64 124.84 1beb n GLU 62 Ca 0.14 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.98 1beb n GLU 62 Cb 0.46 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.83 1beb n GLU 62 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1beb s ASN 63 N 0.17 6.03 0.00 1.62 2.47 -1.26 -4.90 114.94 119.07 1beb s ASN 63 Ca 0.00 0.14 0.00 0.00 0.42 0.00 0.00 52.86 53.42 1beb s ASN 63 Cb 0.00 -1.77 0.00 0.00 -1.45 0.00 0.00 41.25 38.03 1beb s ASN 63 CO 0.00 0.15 0.00 0.61 -3.72 0.00 0.00 177.10 174.14 1beb n GLY 64 N 0.24 0.00 3.76 1.21 0.00 -1.26 -4.56 105.19 104.58 1beb n GLY 64 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 1beb n GLY 64 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1beb s GLU 65 N 0.00 2.40 -0.53 1.61 2.02 -1.26 -5.02 118.70 117.91 1beb s GLU 65 Ca 0.00 1.30 -0.18 0.00 0.02 0.00 0.00 54.97 56.12 1beb s GLU 65 Cb 0.00 -1.91 0.09 0.00 0.10 0.00 0.00 34.13 32.41 1beb s GLU 65 CO 0.00 -1.55 0.58 0.00 0.02 0.00 0.00 175.26 174.30 1beb s ALA 67 N 2.24 3.27 -0.14 0.00 0.00 0.53 -4.84 121.76 122.82 1beb s ALA 67 Ca 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 51.96 51.80 1beb s ALA 67 Cb -0.24 -2.81 -0.02 0.00 0.00 0.00 0.00 23.12 20.06 1beb s ALA 67 CO 0.07 -0.34 -0.10 -1.14 0.00 0.00 0.00 175.76 174.25 1beb s GLN 68 N -4.55 3.46 0.05 0.00 0.74 -1.26 -0.37 119.66 117.74 1beb s GLN 68 Ca 0.52 -0.64 0.09 0.00 0.05 0.00 0.00 55.36 55.38 1beb s GLN 68 Cb -0.10 -2.71 -0.03 0.00 1.10 0.00 0.00 33.01 31.26 1beb s GLN 68 CO 0.42 0.22 -0.26 0.15 -0.55 0.00 0.00 175.29 175.27 1beb s LYS 69 N 0.37 1.73 -0.20 1.67 -0.14 0.21 -4.97 119.74 118.42 1beb s LYS 69 Ca -0.09 -1.13 0.02 0.00 -1.36 0.00 0.00 55.97 53.41 1beb s LYS 69 Cb -0.15 -1.95 0.03 0.00 -1.68 0.00 0.00 37.83 34.08 1beb s LYS 69 CO 0.05 0.50 -0.17 0.21 -0.76 0.00 0.00 175.35 175.18 1beb s LYS 70 N -1.33 2.73 -0.17 1.68 2.20 -1.26 -0.63 119.74 122.95 1beb s LYS 70 Ca 0.12 -0.96 -0.05 0.00 -0.36 0.00 0.00 55.97 54.72 1beb s LYS 70 Cb -0.10 -2.63 -0.03 0.00 -1.51 0.00 0.00 37.83 33.56 1beb s LYS 70 CO 0.02 -0.32 0.00 0.42 -0.36 0.00 0.00 175.35 175.12 1beb s ILE 71 N 1.25 4.19 -0.19 5.43 1.01 -0.43 -4.97 121.20 127.49 1beb s ILE 71 Ca 0.01 -0.24 -0.17 0.00 0.00 0.00 0.00 60.65 60.25 1beb s ILE 71 Cb -0.15 -2.87 -0.04 0.00 0.01 0.00 0.00 42.46 39.41 1beb s ILE 71 CO -0.11 0.47 0.43 -0.63 0.00 0.00 0.00 174.94 175.10 1beb s ILE 72 N 0.49 5.18 -0.19 2.92 1.09 -1.26 -0.68 121.20 128.74 1beb s ILE 72 Ca -0.01 0.79 -0.03 0.00 -1.10 0.00 0.00 60.65 60.30 1beb s ILE 72 Cb -0.14 -3.76 -0.01 0.00 -1.06 0.00 0.00 42.46 37.49 1beb s ILE 72 CO 0.02 0.25 -0.07 0.00 -0.10 0.00 0.00 174.94 175.04 1beb s ALA 73 N 1.29 2.76 0.00 9.38 0.00 0.11 -4.55 121.76 130.75 1beb s ALA 73 Ca 0.21 -1.08 -0.18 0.00 0.00 0.00 0.00 51.96 50.91 1beb s ALA 73 Cb -0.15 -1.56 -0.06 0.00 0.00 0.00 0.00 23.12 21.35 1beb s ALA 73 CO 0.08 -0.23 0.50 -1.21 0.00 0.00 0.00 175.76 174.90 1beb s GLU 74 N 1.14 4.14 0.82 0.00 0.41 0.67 -1.36 118.70 124.52 1beb s GLU 74 Ca 0.02 0.56 -0.11 0.00 -0.41 0.00 0.00 54.97 55.03 1beb s GLU 74 Cb -0.14 -3.28 0.09 0.00 -1.78 0.00 0.00 34.13 29.01 1beb s GLU 74 CO -0.02 0.54 1.12 -1.59 -0.49 0.00 0.00 175.26 174.82 1beb s LYS 75 N -0.66 1.80 0.00 1.61 -2.85 -1.26 -0.70 119.74 117.68 1beb s LYS 75 Ca 0.27 1.37 0.00 0.00 -1.00 0.00 0.00 55.97 56.60 1beb s LYS 75 Cb -0.17 -1.83 0.00 0.00 -2.06 0.00 0.00 37.83 33.76 1beb s LYS 75 CO 0.15 -2.01 0.00 0.25 0.10 0.00 0.00 175.35 173.84 1beb n THR 76 N -3.68 0.00 -0.23 3.79 -2.24 -1.22 -4.75 114.28 105.95 1beb n THR 76 Ca 0.10 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.86 1beb n THR 76 Cb 0.52 0.00 0.17 0.00 -2.10 0.00 0.00 70.33 68.93 1beb n THR 76 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1beb h LYS 77 N 0.00 1.03 -5.57 -0.78 1.57 -1.97 -3.39 116.57 107.45 1beb h LYS 77 Ca 0.00 -0.13 -0.61 0.00 -1.87 0.00 0.00 60.65 58.04 1beb h LYS 77 Cb 0.00 -0.20 -0.12 0.00 0.08 0.00 0.00 32.23 32.00 1beb h LYS 77 CO 0.00 0.78 0.22 0.42 -0.57 0.00 0.00 179.45 180.29 1beb s ILE 78 N -5.62 4.90 0.46 1.86 -1.09 -1.26 -4.96 121.20 115.49 1beb s ILE 78 Ca -0.11 0.97 0.24 0.00 -2.23 0.00 0.00 60.65 59.52 1beb s ILE 78 Cb 0.17 -4.03 0.44 0.00 -1.58 0.00 0.00 42.46 37.45 1beb s ILE 78 CO 0.80 -0.15 1.83 -0.65 -1.23 0.00 0.00 174.94 175.54 1beb h PRO 79 N 8.14 0.24 -0.00 2.79 0.11 -1.89 -1.24 132.00 140.14 1beb h PRO 79 Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1beb h PRO 79 Cb 1.11 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1beb h PRO 79 CO 0.82 0.16 -0.22 0.00 -0.21 0.00 0.00 178.00 178.55 1beb n ALA 80 N -2.59 2.96 -2.50 -0.75 0.00 -1.26 -4.82 120.51 111.55 1beb n ALA 80 Ca 0.22 -0.30 -0.32 0.00 0.00 0.00 0.00 53.44 53.04 1beb n ALA 80 Cb 0.91 -1.25 -0.15 0.00 0.00 0.00 0.00 19.45 18.95 1beb n ALA 80 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1beb s VAL 81 N -2.66 2.42 0.16 0.00 1.01 -0.47 -0.45 120.40 120.42 1beb s VAL 81 Ca 0.22 -0.96 0.06 0.00 0.00 0.00 0.00 61.98 61.30 1beb s VAL 81 Cb 0.19 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 1beb s VAL 81 CO 0.54 0.58 -0.12 -0.36 0.00 0.00 0.00 175.10 175.74 1beb s PHE 82 N -0.49 1.45 -0.14 5.22 0.40 -0.22 -3.41 117.98 120.79 1beb s PHE 82 Ca 0.06 -0.66 -0.04 0.00 -0.60 0.00 0.00 56.93 55.69 1beb s PHE 82 Cb -0.11 -0.71 -0.03 0.00 0.51 0.00 0.00 43.02 42.67 1beb s PHE 82 CO 0.01 0.19 0.02 0.15 0.70 0.00 0.00 175.22 176.29 1beb s LYS 83 N -3.51 3.54 0.17 0.44 -0.14 0.12 -0.81 119.74 119.55 1beb s LYS 83 Ca 0.17 -0.41 0.02 0.00 -1.36 0.00 0.00 55.97 54.40 1beb s LYS 83 Cb 0.00 -2.99 -0.05 0.00 -1.68 0.00 0.00 37.83 33.12 1beb s LYS 83 CO 0.03 0.43 -0.01 0.96 -0.76 0.00 0.00 175.35 176.00 1beb s ILE 84 N -0.11 0.75 -0.50 2.17 -4.36 -1.02 -0.23 121.20 117.90 1beb s ILE 84 Ca 0.05 -1.99 0.07 0.00 -0.26 0.00 0.00 60.65 58.52 1beb s ILE 84 Cb -0.13 -2.08 0.25 0.00 1.25 0.00 0.00 42.46 41.76 1beb s ILE 84 CO 0.02 -0.52 0.62 -0.67 0.24 0.00 0.00 174.94 174.63 1beb n ASP 85 N -0.24 1.70 -3.67 4.36 2.03 -1.26 -4.04 116.55 115.44 1beb n ASP 85 Ca -0.07 -3.01 -0.14 0.00 0.52 0.00 0.00 54.79 52.08 1beb n ASP 85 Cb 0.63 -0.65 -0.08 0.00 -0.72 0.00 0.00 41.12 40.29 1beb n ASP 85 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1beb s ALA 86 N -1.75 -1.33 -1.67 -1.67 0.00 -1.18 -4.94 121.76 109.23 1beb s ALA 86 Ca 0.37 1.31 -0.03 0.00 0.00 0.00 0.00 51.96 53.62 1beb s ALA 86 Cb 0.16 -0.59 0.00 0.00 0.00 0.00 0.00 23.12 22.69 1beb s ALA 86 CO -0.07 -0.28 0.35 1.28 0.00 0.00 0.00 175.76 177.04 1beb n LEU 87 N 2.25 -2.38 -0.40 0.00 4.77 -1.26 -0.65 117.00 119.33 1beb n LEU 87 Ca -0.16 -0.17 -0.05 0.00 -0.03 0.00 0.00 56.01 55.60 1beb n LEU 87 Cb 0.56 -2.98 -0.02 0.00 -2.33 0.00 0.00 43.42 38.65 1beb n LEU 87 CO 0.13 0.04 -0.05 0.59 -1.33 0.00 0.00 177.39 176.77 1beb n ASN 88 N -2.31 -5.22 -4.84 -1.43 4.13 -1.26 -4.94 115.26 99.38 1beb n ASN 88 Ca -0.17 0.13 -0.22 0.00 1.68 0.00 0.00 54.58 56.00 1beb n ASN 88 Cb 0.65 -3.18 -0.04 0.00 -1.54 0.00 0.00 39.78 35.67 1beb n ASN 88 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1beb s GLU 89 N -2.14 2.95 0.00 3.52 0.41 0.18 -4.59 118.70 119.03 1beb s GLU 89 Ca 0.00 -1.06 0.00 0.00 -0.41 0.00 0.00 54.97 53.50 1beb s GLU 89 Cb 0.00 -2.59 0.00 0.00 -1.78 0.00 0.00 34.13 29.76 1beb s GLU 89 CO 0.00 0.35 0.21 0.27 -0.49 0.00 0.00 175.26 175.60 1beb n ASN 90 N -1.24 0.19 -3.83 -0.19 6.94 -0.25 -3.09 115.26 113.79 1beb n ASN 90 Ca -0.07 -1.04 -0.12 0.00 -0.02 0.00 0.00 54.58 53.33 1beb n ASN 90 Cb 0.58 0.00 -0.13 0.00 -2.36 0.00 0.00 39.78 37.87 1beb n ASN 90 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1beb s LYS 91 N -0.04 0.14 -0.14 -3.83 1.02 -0.59 -2.44 119.74 113.86 1beb s LYS 91 Ca 0.00 0.18 0.01 0.00 0.02 0.00 0.00 55.97 56.18 1beb s LYS 91 Cb 0.00 0.06 -0.00 0.00 -0.52 0.00 0.00 37.83 37.36 1beb s LYS 91 CO 0.00 -0.02 -0.16 0.08 -0.92 0.00 0.00 175.35 174.32 1beb s VAL 92 N 0.12 2.65 -0.21 3.17 1.01 0.01 -1.54 120.40 125.61 1beb s VAL 92 Ca -0.00 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 1beb s VAL 92 Cb -0.01 -2.10 0.02 0.00 0.00 0.00 0.00 36.38 34.28 1beb s VAL 92 CO -0.00 0.52 -0.12 -0.76 0.00 0.00 0.00 175.10 174.74 1beb s LEU 93 N 0.66 2.69 -0.26 3.92 2.01 0.29 -1.05 118.68 126.93 1beb s LEU 93 Ca -0.08 -0.69 -0.25 0.00 0.01 0.00 0.00 54.13 53.11 1beb s LEU 93 Cb -0.16 -1.60 0.00 0.00 0.01 0.00 0.00 46.19 44.44 1beb s LEU 93 CO 0.02 -0.05 0.88 -0.69 1.01 0.00 0.00 176.35 177.52 1beb s VAL 94 N 1.34 4.77 -0.07 -1.59 1.01 0.41 -1.43 120.40 124.84 1beb s VAL 94 Ca 0.03 1.58 -0.15 0.00 0.00 0.00 0.00 61.98 63.44 1beb s VAL 94 Cb -0.15 -4.19 -0.30 0.00 0.00 0.00 0.00 36.38 31.75 1beb s VAL 94 CO -0.08 -0.17 0.68 -0.07 0.00 0.00 0.00 175.10 175.46 1beb h LEU 95 N 9.38 0.52 -7.00 3.92 4.07 -0.94 -0.67 115.31 124.58 1beb h LEU 95 Ca -0.22 -0.90 0.16 0.00 0.08 0.00 0.00 57.88 57.00 1beb h LEU 95 Cb 1.08 -0.17 -0.25 0.00 1.08 0.00 0.00 40.66 42.41 1beb h LEU 95 CO 0.91 1.65 0.74 -0.62 -1.08 0.00 0.00 178.44 180.04 1beb s ASP 96 N -7.16 -0.21 -0.21 -0.43 2.15 -1.19 -3.22 116.67 106.39 1beb s ASP 96 Ca -0.17 0.21 -0.28 0.00 0.43 0.00 0.00 52.55 52.75 1beb s ASP 96 Cb 0.04 0.17 0.12 0.00 -0.30 0.00 0.00 42.92 42.95 1beb s ASP 96 CO 0.82 -0.20 0.96 0.28 -0.17 0.00 0.00 175.17 176.86 1beb s THR 97 N -1.18 0.00 -1.28 1.71 -1.32 -1.26 -0.44 115.64 111.86 1beb s THR 97 Ca 0.04 0.00 0.16 0.00 -1.21 0.00 0.00 61.69 60.67 1beb s THR 97 Cb -0.01 -1.00 0.47 0.00 -1.51 0.00 0.00 72.50 70.45 1beb s THR 97 CO -0.03 0.00 1.39 -0.90 -2.21 0.00 0.00 174.62 172.87 1beb n ASP 98 N 1.52 3.47 0.00 8.08 5.75 -1.16 -4.98 116.55 129.23 1beb n ASP 98 Ca -0.12 -2.08 0.00 0.00 -0.01 0.00 0.00 54.79 52.58 1beb n ASP 98 Cb 0.57 -0.36 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 1beb n ASP 98 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1beb n TYR 99 N 0.92 0.00 0.03 2.11 4.01 -1.26 -4.49 117.16 118.48 1beb n TYR 99 Ca 0.18 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.93 1beb n TYR 99 Cb 0.55 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.50 1beb n TYR 99 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1beb n LYS 100 N 0.00 0.63 0.00 -0.72 5.02 -1.26 -4.80 118.16 117.02 1beb n LYS 100 Ca 0.00 0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 1beb n LYS 100 Cb 0.00 -1.78 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 1beb n LYS 100 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1beb n LYS 101 N -2.82 0.00 -4.30 1.97 0.00 -1.26 -4.78 118.16 106.97 1beb n LYS 101 Ca -0.10 0.00 -0.17 0.00 -0.00 0.00 0.00 58.31 58.05 1beb n LYS 101 Cb 0.81 -0.48 -0.10 0.00 -0.00 0.00 0.00 35.03 35.27 1beb n LYS 101 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.40 178.92 1beb s TYR 102 N -1.31 1.52 -0.17 5.58 1.13 -1.26 -0.60 117.35 122.25 1beb s TYR 102 Ca 0.00 -0.65 -0.11 0.00 -1.41 0.00 0.00 57.07 54.90 1beb s TYR 102 Cb 0.00 -0.73 0.05 0.00 -1.10 0.00 0.00 41.96 40.18 1beb s TYR 102 CO 0.00 0.24 0.42 -1.17 -2.51 0.00 0.00 175.55 172.53 1beb s LEU 103 N -3.23 0.06 -0.11 -3.49 0.20 -0.33 -2.97 118.68 108.81 1beb s LEU 103 Ca 0.20 0.89 0.03 0.00 0.69 0.00 0.00 54.13 55.93 1beb s LEU 103 Cb 0.00 1.40 -0.01 0.00 -0.43 0.00 0.00 46.19 47.16 1beb s LEU 103 CO 0.04 -0.18 -0.20 -0.76 -0.29 0.00 0.00 176.35 174.97 1beb s LEU 104 N 0.99 2.35 0.16 -0.68 1.43 0.41 -0.60 118.68 122.75 1beb s LEU 104 Ca -0.06 -0.46 -0.09 0.00 -1.03 0.00 0.00 54.13 52.50 1beb s LEU 104 Cb -0.06 -1.49 -0.01 0.00 0.03 0.00 0.00 46.19 44.66 1beb s LEU 104 CO -0.08 0.18 0.28 0.72 0.23 0.00 0.00 176.35 177.67 1beb s PHE 105 N 0.27 0.43 0.04 0.29 -0.71 -0.95 -0.32 117.98 117.02 1beb s PHE 105 Ca -0.14 -0.79 0.01 0.00 -1.04 0.00 0.00 56.93 54.98 1beb s PHE 105 Cb -0.17 -0.08 -0.03 0.00 -1.21 0.00 0.00 43.02 41.54 1beb s PHE 105 CO 0.07 -0.71 -0.06 0.00 -1.34 0.00 0.00 175.22 173.18 1beb s MET 107 N -1.90 1.93 0.13 0.00 -1.94 -0.18 -0.55 119.30 116.79 1beb s MET 107 Ca -0.09 -1.48 -0.25 0.00 -1.71 0.00 0.00 55.69 52.16 1beb s MET 107 Cb -0.07 -2.01 0.07 0.00 2.01 0.00 0.00 34.83 34.83 1beb s MET 107 CO -0.01 0.38 0.82 -1.83 -0.01 0.00 0.00 175.02 174.37 1beb s GLU 108 N -3.20 1.22 -0.34 2.03 -1.05 -0.59 -2.30 118.70 114.47 1beb s GLU 108 Ca 0.27 -0.58 -0.08 0.00 -0.15 0.00 0.00 54.97 54.43 1beb s GLU 108 Cb -0.07 0.48 0.03 0.00 -0.44 0.00 0.00 34.13 34.12 1beb s GLU 108 CO 0.15 -0.55 0.13 1.21 0.95 0.00 0.00 175.26 177.15 1beb s ASN 109 N -2.77 5.39 0.53 0.83 3.84 -1.26 -1.10 114.94 120.41 1beb s ASN 109 Ca 0.07 -0.96 0.36 0.00 0.21 0.00 0.00 52.86 52.54 1beb s ASN 109 Cb -0.02 -1.92 1.52 0.00 -0.55 0.00 0.00 41.25 40.28 1beb s ASN 109 CO -0.03 -0.30 1.77 0.77 -2.79 0.00 0.00 177.10 176.52 1beb h SER 110 N 8.29 0.06 0.29 -4.21 4.64 -1.94 0.55 113.55 121.23 1beb h SER 110 Ca -0.26 0.01 -0.05 0.00 -0.47 0.00 0.00 61.79 61.02 1beb h SER 110 Cb 1.10 0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.19 1beb h SER 110 CO 0.62 0.00 -0.25 0.00 -0.87 0.00 0.00 176.83 176.33 1beb h ALA 111 N 1.40 1.51 -0.57 5.18 0.00 -1.99 -3.38 119.26 121.40 1beb h ALA 111 Ca 0.61 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 55.14 1beb h ALA 111 Cb 2.34 -0.04 -0.15 0.00 0.00 0.00 0.00 17.79 19.94 1beb h ALA 111 CO -0.05 0.31 -0.44 -1.91 0.00 0.00 0.00 179.25 177.16 1beb n GLU 112 N -4.13 0.57 0.23 0.00 4.07 0.15 -5.03 120.64 116.51 1beb n GLU 112 Ca -0.02 -1.79 0.09 0.00 -0.06 0.00 0.00 57.16 55.37 1beb n GLU 112 Cb 0.31 -1.30 0.63 0.00 -0.06 0.00 0.00 31.44 31.03 1beb n GLU 112 CO 0.00 0.00 0.00 -1.35 -0.06 0.00 0.00 177.13 175.72 1beb h PRO 113 N 4.54 0.02 -0.05 5.31 0.11 -1.67 -2.94 132.00 137.32 1beb h PRO 113 Ca -0.02 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.05 1beb h PRO 113 Cb 1.09 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1beb h PRO 113 CO 0.10 0.01 -0.14 0.93 -0.21 0.00 0.00 178.00 178.69 1beb h GLU 114 N 0.02 0.08 -0.54 1.05 5.08 -1.96 0.11 114.58 118.43 1beb h GLU 114 Ca 0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1beb h GLU 114 Cb 0.06 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1beb h GLU 114 CO -0.00 0.22 0.00 1.04 -1.00 0.00 0.00 179.01 179.27 1beb n GLN 115 N -4.33 3.19 0.00 2.33 1.13 -1.12 -4.34 117.38 114.24 1beb n GLN 115 Ca -0.02 -2.60 0.00 0.00 -1.94 0.00 0.00 57.00 52.44 1beb n GLN 115 Cb 0.23 -1.64 0.00 0.00 0.11 0.00 0.00 30.24 28.94 1beb n GLN 115 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1beb n SER 116 N 0.87 2.25 -4.65 1.08 7.64 -0.53 -4.91 113.62 115.37 1beb n SER 116 Ca 0.21 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.66 1beb n SER 116 Cb 0.70 0.26 -0.03 0.00 -1.01 0.00 0.00 64.21 64.14 1beb n SER 116 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1beb s LEU 117 N -2.20 4.20 -0.03 -3.43 2.96 0.27 -4.33 118.68 116.12 1beb s LEU 117 Ca 0.00 1.99 0.00 0.00 -0.22 0.00 0.00 54.13 55.90 1beb s LEU 117 Cb 0.00 -3.53 0.03 0.00 0.50 0.00 0.00 46.19 43.18 1beb s LEU 117 CO 0.00 -0.97 0.01 0.54 -1.32 0.00 0.00 176.35 174.61 1beb s VAL 118 N 4.19 0.14 0.16 1.68 0.11 -0.97 -0.97 120.40 124.74 1beb s VAL 118 Ca 0.69 0.13 0.09 0.00 -2.93 0.00 0.00 61.98 59.97 1beb s VAL 118 Cb -0.29 -0.26 -0.04 0.00 -1.53 0.00 0.00 36.38 34.26 1beb s VAL 118 CO 0.26 0.15 -0.20 0.00 -3.33 0.00 0.00 175.10 171.98 1beb s GLN 120 N -2.64 0.46 -0.24 0.00 -0.21 0.30 -1.04 119.66 116.29 1beb s GLN 120 Ca 0.16 -0.75 -0.05 0.00 0.02 0.00 0.00 55.36 54.74 1beb s GLN 120 Cb -0.07 -0.09 -0.01 0.00 1.00 0.00 0.00 33.01 33.84 1beb s GLN 120 CO 0.07 -0.01 -0.00 0.00 -2.12 0.00 0.00 175.29 173.23 1beb s LEU 122 N 1.50 3.66 0.13 0.00 1.43 0.24 -0.96 118.68 124.68 1beb s LEU 122 Ca 0.05 0.16 0.09 0.00 -1.03 0.00 0.00 54.13 53.40 1beb s LEU 122 Cb -0.15 -1.88 -0.04 0.00 0.03 0.00 0.00 46.19 44.15 1beb s LEU 122 CO -0.01 0.37 -0.22 0.68 0.23 0.00 0.00 176.35 177.40 1beb s VAL 123 N -0.93 1.90 0.08 -1.59 -7.23 -0.47 -1.18 120.40 110.97 1beb s VAL 123 Ca 0.14 -1.72 -0.16 0.00 -1.81 0.00 0.00 61.98 58.44 1beb s VAL 123 Cb -0.11 -1.76 -0.14 0.00 0.56 0.00 0.00 36.38 34.93 1beb s VAL 123 CO 0.04 -0.10 1.32 0.03 -0.31 0.00 0.00 175.10 176.08 1beb h ARG 124 N 3.75 0.65 -6.35 4.82 2.47 -1.12 0.36 114.38 118.96 1beb h ARG 124 Ca -0.46 -0.45 -0.61 0.00 -1.26 0.00 0.00 59.98 57.21 1beb h ARG 124 Cb 1.19 0.07 -0.12 0.00 -1.65 0.00 0.00 29.97 29.46 1beb h ARG 124 CO 0.43 1.07 -0.67 0.95 0.56 0.00 0.00 179.97 182.31 1beb s THR 125 N -3.97 3.62 -0.86 2.04 -4.23 -1.26 -4.54 115.64 106.43 1beb s THR 125 Ca -0.12 -1.48 -0.07 0.00 -1.18 0.00 0.00 61.69 58.84 1beb s THR 125 Cb 0.07 -2.82 -0.11 0.00 1.34 0.00 0.00 72.50 70.99 1beb s THR 125 CO 0.84 -0.12 2.58 -0.81 -0.54 0.00 0.00 174.62 176.57 1beb n PRO 126 N -0.13 2.40 -4.22 3.99 -0.04 -1.26 -4.79 135.00 130.95 1beb n PRO 126 Ca -0.10 -1.47 -0.16 0.00 -0.04 0.00 0.00 63.50 61.74 1beb n PRO 126 Cb 0.55 -2.39 -0.11 0.00 -0.04 0.00 0.00 33.50 31.52 1beb n PRO 126 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1beb s GLU 127 N 2.48 0.98 -0.18 0.54 2.02 -1.26 -4.74 118.70 118.54 1beb s GLU 127 Ca 0.52 -1.29 -0.20 0.00 0.02 0.00 0.00 54.97 54.02 1beb s GLU 127 Cb 0.17 -0.69 -0.03 0.00 0.10 0.00 0.00 34.13 33.67 1beb s GLU 127 CO -0.03 0.11 0.58 0.54 0.02 0.00 0.00 175.26 176.48 1beb s VAL 128 N -2.63 5.07 -0.38 2.63 0.11 -1.26 -4.98 120.40 118.95 1beb s VAL 128 Ca 0.10 1.10 -0.10 0.00 -2.93 0.00 0.00 61.98 60.16 1beb s VAL 128 Cb -0.02 -3.90 0.04 0.00 -1.53 0.00 0.00 36.38 30.97 1beb s VAL 128 CO 0.01 0.16 0.21 -0.62 -3.33 0.00 0.00 175.10 171.54 1beb s ASP 129 N 1.10 5.69 0.49 3.54 -1.08 -1.26 -4.97 116.67 120.18 1beb s ASP 129 Ca 0.27 -1.13 0.27 0.00 -0.52 0.00 0.00 52.55 51.45 1beb s ASP 129 Cb -0.16 -2.01 1.23 0.00 -1.46 0.00 0.00 42.92 40.53 1beb s ASP 129 CO 0.11 -0.42 1.96 0.44 0.52 0.00 0.00 175.17 177.77 1beb h ASP 130 N 8.42 0.00 -0.07 -0.34 3.32 -1.99 -2.34 116.42 123.42 1beb h ASP 130 Ca -0.25 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.77 1beb h ASP 130 Cb 1.10 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.65 1beb h ASP 130 CO 0.69 0.15 -0.09 -0.33 -1.72 0.00 0.00 179.24 177.94 1beb h GLU 131 N 0.00 0.18 -0.82 3.56 4.39 -1.99 -1.55 114.58 118.34 1beb h GLU 131 Ca -0.00 -0.10 0.07 0.00 0.34 0.00 0.00 59.36 59.66 1beb h GLU 131 Cb 0.54 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.14 1beb h GLU 131 CO 0.02 0.64 0.50 0.00 -1.16 0.00 0.00 179.01 179.01 1beb h ALA 132 N 0.53 1.14 -0.50 3.43 0.00 -1.93 -1.15 119.26 120.78 1beb h ALA 132 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1beb h ALA 132 Cb 0.62 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1beb h ALA 132 CO 0.02 0.21 -0.15 -0.07 0.00 0.00 0.00 179.25 179.26 1beb h LEU 133 N 0.90 0.99 0.01 0.00 3.38 -1.40 -1.41 115.31 117.76 1beb h LEU 133 Ca 0.37 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1beb h LEU 133 Cb 0.21 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1beb h LEU 133 CO -0.19 1.12 -0.00 -0.08 0.09 0.00 0.00 178.44 179.38 1beb h GLU 134 N 0.86 -0.01 -0.88 1.13 4.81 -0.64 0.11 114.58 119.96 1beb h GLU 134 Ca 0.13 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.48 1beb h GLU 134 Cb 0.71 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 30.03 1beb h GLU 134 CO 0.05 0.01 0.57 0.87 -0.73 0.00 0.00 179.01 179.78 1beb h LYS 135 N -0.02 0.73 -0.01 1.92 6.56 -1.15 -2.09 116.57 122.51 1beb h LYS 135 Ca -0.00 -0.04 -0.00 0.00 -1.06 0.00 0.00 60.65 59.54 1beb h LYS 135 Cb 0.02 -0.16 -0.00 0.00 -0.57 0.00 0.00 32.23 31.51 1beb h LYS 135 CO 0.00 0.48 -0.00 0.35 -2.06 0.00 0.00 179.45 178.22 1beb h PHE 136 N 0.75 0.02 -0.77 -1.35 3.57 -0.36 -2.21 116.94 116.58 1beb h PHE 136 Ca 0.43 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.98 1beb h PHE 136 Cb 0.60 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.29 1beb h PHE 136 CO -0.00 0.41 0.51 -0.44 -2.23 0.00 0.00 178.31 176.56 1beb h ASP 137 N -0.37 0.75 -0.34 0.41 3.32 -0.56 -1.79 116.42 117.84 1beb h ASP 137 Ca 0.00 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 1beb h ASP 137 Cb 0.40 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 1beb h ASP 137 CO 0.00 0.50 -0.14 0.11 -1.72 0.00 0.00 179.24 177.99 1beb h LYS 138 N 0.86 0.70 0.00 3.56 1.57 -1.28 -1.58 116.57 120.40 1beb h LYS 138 Ca 0.33 -0.29 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 1beb h LYS 138 Cb 0.19 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1beb h LYS 138 CO -0.11 0.89 -0.23 0.00 -0.57 0.00 0.00 179.45 179.43 1beb h ALA 139 N 0.79 1.24 -0.01 3.86 0.00 -0.87 -2.30 119.26 121.99 1beb h ALA 139 Ca 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1beb h ALA 139 Cb 0.66 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1beb h ALA 139 CO 0.04 0.28 -0.52 1.28 0.00 0.00 0.00 179.25 180.34 1beb n LEU 140 N -3.72 1.05 0.26 0.00 4.32 -0.72 -4.32 117.00 113.88 1beb n LEU 140 Ca -0.01 -0.33 0.13 0.00 -0.02 0.00 0.00 56.01 55.78 1beb n LEU 140 Cb 0.34 -0.11 0.80 0.00 -1.62 0.00 0.00 43.42 42.83 1beb n LEU 140 CO 0.34 0.22 1.11 0.11 -1.22 0.00 0.00 177.39 177.95 1beb h LYS 141 N 0.84 0.00 0.00 3.23 1.57 -0.68 -1.74 116.57 119.78 1beb h LYS 141 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1beb h LYS 141 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.86 1beb h LYS 141 CO 0.00 0.00 -0.99 0.00 -0.57 0.00 0.00 179.45 177.89 1beb n ALA 142 N -2.41 3.50 -2.23 3.86 0.00 -1.26 -4.97 120.51 116.99 1beb n ALA 142 Ca -0.02 -0.41 -0.30 0.00 0.00 0.00 0.00 53.44 52.71 1beb n ALA 142 Cb 0.13 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.58 1beb n ALA 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1beb s LEU 143 N -3.80 3.84 -1.53 0.00 1.43 -0.66 -5.02 118.68 112.95 1beb s LEU 143 Ca 0.04 1.06 -0.09 0.00 -1.03 0.00 0.00 54.13 54.11 1beb s LEU 143 Cb 0.15 -3.94 -0.02 0.00 0.03 0.00 0.00 46.19 42.41 1beb s LEU 143 CO 0.80 -0.39 2.74 -0.81 0.23 0.00 0.00 176.35 178.91 1beb n PRO 144 N -1.35 3.87 -2.96 1.29 -0.04 -1.26 -5.00 135.00 129.56 1beb n PRO 144 Ca 0.02 -2.59 -0.40 0.00 -0.04 0.00 0.00 63.50 60.49 1beb n PRO 144 Cb 0.54 -2.80 -0.05 0.00 -0.04 0.00 0.00 33.50 31.16 1beb n PRO 144 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1beb s MET 145 N 1.34 4.51 0.00 0.54 -1.94 -1.26 -4.20 119.30 118.30 1beb s MET 145 Ca 0.63 1.10 0.02 0.00 -1.71 0.00 0.00 55.69 55.74 1beb s MET 145 Cb 0.18 -3.37 0.02 0.00 2.01 0.00 0.00 34.83 33.67 1beb s MET 145 CO -0.07 0.27 0.56 0.72 -0.01 0.00 0.00 175.02 176.49 1beb n HIS 146 N 2.82 0.00 -3.72 -0.03 8.25 0.09 -4.94 115.22 117.69 1beb n HIS 146 Ca -0.02 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.32 1beb n HIS 146 Cb 0.50 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.50 1beb n HIS 146 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 1beb s ILE 147 N -0.22 -0.02 -0.00 1.59 2.07 -1.17 -4.73 121.20 118.72 1beb s ILE 147 Ca 0.03 0.06 0.00 0.00 -1.41 0.00 0.00 60.65 59.33 1beb s ILE 147 Cb 0.02 -0.56 0.00 0.00 0.13 0.00 0.00 42.46 42.05 1beb s ILE 147 CO 0.03 0.02 -0.01 -0.60 -1.91 0.00 0.00 174.94 172.47 1beb s ARG 148 N 0.87 0.09 0.04 3.50 3.52 -1.26 -1.69 118.95 124.02 1beb s ARG 148 Ca -0.05 -0.02 0.03 0.00 -0.13 0.00 0.00 55.73 55.56 1beb s ARG 148 Cb -0.06 -0.12 -0.02 0.00 -1.56 0.00 0.00 34.95 33.19 1beb s ARG 148 CO -0.07 0.00 -0.10 -0.51 -0.81 0.00 0.00 175.30 173.82 1beb s LEU 149 N 0.11 2.19 0.00 -0.88 1.43 -0.09 -5.01 118.68 116.43 1beb s LEU 149 Ca -0.01 -0.45 0.01 0.00 -1.03 0.00 0.00 54.13 52.65 1beb s LEU 149 Cb -0.02 -0.35 -0.00 0.00 0.03 0.00 0.00 46.19 45.85 1beb s LEU 149 CO -0.00 -0.07 -0.02 -0.94 0.23 0.00 0.00 176.35 175.54 1beb s SER 150 N -1.21 0.24 0.23 2.29 1.04 -1.26 -1.74 113.70 113.29 1beb s SER 150 Ca -0.04 -0.08 0.07 0.00 0.48 0.00 0.00 55.95 56.38 1beb s SER 150 Cb -0.08 -0.02 -0.04 0.00 0.10 0.00 0.00 66.02 65.99 1beb s SER 150 CO 0.01 -0.00 0.17 -0.36 0.98 0.00 0.00 173.24 174.04 1beb s PHE 151 N -0.16 3.11 0.41 5.02 0.08 0.03 -5.00 117.98 121.46 1beb s PHE 151 Ca -0.01 -0.09 0.07 0.00 0.12 0.00 0.00 56.93 57.02 1beb s PHE 151 Cb -0.02 -1.42 0.01 0.00 -0.57 0.00 0.00 43.02 41.02 1beb s PHE 151 CO -0.00 0.52 0.57 0.54 -0.10 0.00 0.00 175.22 176.75 1beb s ASN 152 N -3.63 5.72 0.50 1.36 2.20 -1.26 -4.93 114.94 114.89 1beb s ASN 152 Ca 0.32 -0.29 0.18 0.00 -0.94 0.00 0.00 52.86 52.14 1beb s ASN 152 Cb -0.08 -0.87 1.23 0.00 -2.00 0.00 0.00 41.25 39.52 1beb s ASN 152 CO 0.24 -0.70 2.05 -0.65 -2.94 0.00 0.00 177.10 175.10 1beb h PRO 153 N 0.65 0.13 -0.09 3.55 0.11 -1.95 -0.27 132.00 134.13 1beb h PRO 153 Ca -0.42 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 1beb h PRO 153 Cb 1.27 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 1beb h PRO 153 CO 0.48 0.09 0.04 1.15 -0.21 0.00 0.00 178.00 179.55 1beb h THR 154 N 0.13 1.10 -0.13 -1.15 2.02 -1.95 -2.68 112.91 110.26 1beb h THR 154 Ca 0.16 -0.29 -0.14 0.00 0.77 0.00 0.00 66.41 66.91 1beb h THR 154 Cb 0.48 1.14 -0.01 0.00 -1.74 0.00 0.00 68.15 68.02 1beb h THR 154 CO -0.02 0.09 -0.54 1.56 0.37 0.00 0.00 175.52 176.98 1beb h GLN 155 N 0.03 0.38 -0.40 6.66 4.20 -1.76 -3.16 115.11 121.06 1beb h GLN 155 Ca 0.03 -0.24 0.10 0.00 0.06 0.00 0.00 58.65 58.61 1beb h GLN 155 Cb 0.10 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 1beb h GLN 155 CO -0.00 0.82 0.28 -0.07 -0.67 0.00 0.00 178.83 179.19 1beb h LEU 156 N 0.30 0.06 -2.16 1.46 3.38 -0.81 -2.84 115.31 114.70 1beb h LEU 156 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1beb h LEU 156 Cb 1.04 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1beb h LEU 156 CO 0.09 0.04 0.00 -1.84 0.09 0.00 0.00 178.44 176.82 1beb n GLU 157 N -4.44 2.44 -4.20 1.13 0.28 -1.03 -4.92 120.64 109.90 1beb n GLU 157 Ca 0.06 -2.14 -0.33 0.00 -0.16 0.00 0.00 57.16 54.60 1beb n GLU 157 Cb 0.43 -1.49 -0.08 0.00 1.43 0.00 0.00 31.44 31.73 1beb n GLU 157 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 1beb s GLU 158 N -1.71 2.94 0.07 3.44 2.56 -1.07 -5.07 118.70 119.86 1beb s GLU 158 Ca 0.34 -0.53 -0.34 0.00 0.00 0.00 0.00 54.97 54.45 1beb s GLU 158 Cb 0.22 -2.78 -0.13 0.00 2.00 0.00 0.00 34.13 33.44 1beb s GLU 158 CO 0.31 0.65 1.66 1.04 -0.56 0.00 0.00 175.26 178.36 1beb n GLN 159 N 1.38 2.08 -0.61 4.30 1.13 -1.26 -5.01 117.38 119.39 1beb n GLN 159 Ca -0.14 0.76 0.00 0.00 -1.94 0.00 0.00 57.00 55.67 1beb n GLN 159 Cb 0.53 -2.54 0.00 0.00 0.11 0.00 0.00 30.24 28.34 1beb n GLN 159 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62