#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m7t s VAL 2 N 0.00 2.49 -0.12 2.03 1.01 -1.25 -4.85 120.40 119.71 1m7t s VAL 2 Ca 0.00 0.39 -0.05 0.00 0.00 0.00 0.00 61.98 62.32 1m7t s VAL 2 Cb 0.00 -3.21 0.06 0.00 0.00 0.00 0.00 36.38 33.23 1m7t s VAL 2 CO 0.00 0.02 0.26 -1.59 0.00 0.00 0.00 175.10 173.79 1m7t s LYS 3 N -2.64 0.17 0.10 2.72 -2.85 -1.25 -5.01 119.74 110.98 1m7t s LYS 3 Ca 0.65 0.68 -0.30 0.00 -1.00 0.00 0.00 55.97 55.99 1m7t s LYS 3 Cb -0.37 -0.07 -0.06 0.00 -2.06 0.00 0.00 37.83 35.27 1m7t s LYS 3 CO 0.45 -0.24 1.13 -1.14 0.10 0.00 0.00 175.35 175.65 1m7t s GLN 4 N 2.02 4.51 -0.45 1.78 0.74 -1.26 -3.02 119.66 123.99 1m7t s GLN 4 Ca -0.02 1.71 -0.15 0.00 0.05 0.00 0.00 55.36 56.94 1m7t s GLN 4 Cb -0.11 -3.33 0.06 0.00 1.10 0.00 0.00 33.01 30.72 1m7t s GLN 4 CO -0.09 -0.10 0.36 0.42 -0.55 0.00 0.00 175.29 175.34 1m7t s ILE 5 N 0.52 5.22 -0.33 -2.34 1.09 0.68 -4.92 121.20 121.12 1m7t s ILE 5 Ca 0.54 -0.94 0.11 0.00 -1.10 0.00 0.00 60.65 59.26 1m7t s ILE 5 Cb -0.28 -4.05 0.72 0.00 -1.06 0.00 0.00 42.46 37.78 1m7t s ILE 5 CO 0.31 -0.49 1.64 -0.62 -0.10 0.00 0.00 174.94 175.69 1m7t n GLU 6 N 5.18 4.19 -3.55 2.79 1.02 -1.26 -4.01 120.64 125.00 1m7t n GLU 6 Ca -0.12 -2.80 -0.12 0.00 -0.02 0.00 0.00 57.16 54.10 1m7t n GLU 6 Cb 0.45 -2.17 -0.04 0.00 -0.02 0.00 0.00 31.44 29.66 1m7t n GLU 6 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1m7t s SER 7 N -0.74 -0.38 0.33 1.62 0.15 -1.26 -4.61 113.70 108.81 1m7t s SER 7 Ca 0.49 -0.13 0.16 0.00 0.70 0.00 0.00 55.95 57.17 1m7t s SER 7 Cb 0.38 0.52 0.50 0.00 -1.71 0.00 0.00 66.02 65.71 1m7t s SER 7 CO 0.14 -0.87 1.65 0.50 1.20 0.00 0.00 173.24 175.86 1m7t h LYS 8 N 2.31 0.00 0.05 5.44 3.11 -1.92 -2.97 116.57 122.59 1m7t h LYS 8 Ca -0.33 0.00 -0.24 0.00 -2.81 0.00 0.00 60.65 57.27 1m7t h LYS 8 Cb 1.27 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 32.48 1m7t h LYS 8 CO 0.43 0.47 -1.09 1.15 -2.81 0.00 0.00 179.45 177.60 1m7t h THR 9 N 0.00 1.62 -0.37 1.00 2.02 -1.99 -3.27 112.91 111.92 1m7t h THR 9 Ca -0.00 -3.24 -0.09 0.00 0.77 0.00 0.00 66.41 63.84 1m7t h THR 9 Cb 1.04 2.87 -0.02 0.00 -1.74 0.00 0.00 68.15 70.30 1m7t h THR 9 CO 0.06 0.94 -0.15 0.00 0.37 0.00 0.00 175.52 176.74 1m7t h ALA 10 N 0.83 1.05 -0.78 6.16 0.00 -1.93 -1.96 119.26 122.63 1m7t h ALA 10 Ca -0.06 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 54.57 1m7t h ALA 10 Cb 1.84 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 19.42 1m7t h ALA 10 CO 0.16 0.58 0.49 0.35 0.00 0.00 0.00 179.25 180.82 1m7t h PHE 11 N 0.61 0.91 -0.49 0.00 3.57 -1.57 0.79 116.94 120.75 1m7t h PHE 11 Ca 0.10 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.54 1m7t h PHE 11 Cb 0.60 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 1m7t h PHE 11 CO 0.03 0.50 -0.03 1.96 -2.23 0.00 0.00 178.31 178.54 1m7t h GLN 12 N 0.93 0.88 -0.18 1.11 1.08 -1.57 -1.61 115.11 115.75 1m7t h GLN 12 Ca 0.32 -0.30 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 1m7t h GLN 12 Cb 0.06 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.41 1m7t h GLN 12 CO -0.13 0.93 0.12 0.93 -0.95 0.00 0.00 178.83 179.73 1m7t h GLU 13 N 0.74 0.24 -0.24 1.46 5.08 -0.53 -0.59 114.58 120.74 1m7t h GLU 13 Ca 0.13 -0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.40 1m7t h GLU 13 Cb 0.55 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1m7t h GLU 13 CO 0.03 0.16 -0.18 0.00 -1.00 0.00 0.00 179.01 178.01 1m7t h ALA 14 N 1.07 1.23 -0.65 3.43 0.00 -0.83 -1.94 119.26 121.57 1m7t h ALA 14 Ca 0.07 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 1m7t h ALA 14 Cb -0.03 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1m7t h ALA 14 CO -0.02 0.50 0.14 -0.07 0.00 0.00 0.00 179.25 179.81 1m7t h LEU 15 N 0.39 1.01 -1.50 0.00 3.38 -0.84 -1.99 115.31 115.75 1m7t h LEU 15 Ca 0.07 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 1m7t h LEU 15 Cb 0.55 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1m7t h LEU 15 CO 0.04 0.99 -0.24 0.44 0.09 0.00 0.00 178.44 179.75 1m7t h ASP 16 N 0.98 0.00 -0.07 -0.43 3.32 -0.69 -2.68 116.42 116.86 1m7t h ASP 16 Ca 0.20 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.25 1m7t h ASP 16 Cb 0.39 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.93 1m7t h ASP 16 CO 0.01 0.24 0.03 0.00 -1.72 0.00 0.00 179.24 177.80 1m7t h ALA 17 N 1.76 0.08 0.34 3.45 0.00 -0.59 -3.29 119.26 121.01 1m7t h ALA 17 Ca -0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1m7t h ALA 17 Cb 0.53 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1m7t h ALA 17 CO 0.03 -0.33 -0.17 0.00 0.00 0.00 0.00 179.25 178.79 1m7t h ALA 18 N 0.87 -0.74 0.00 0.00 0.00 -1.44 -3.47 119.26 114.48 1m7t h ALA 18 Ca 0.02 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1m7t h ALA 18 Cb 0.17 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1m7t h ALA 18 CO -0.00 -0.70 0.00 0.41 0.00 0.00 0.00 179.25 178.96 1m7t n GLY 19 N -0.11 2.17 0.05 0.00 0.00 -1.02 -3.63 105.19 102.65 1m7t n GLY 19 Ca -0.06 -0.11 0.11 0.00 0.00 0.00 0.00 46.02 45.97 1m7t n GLY 19 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1m7t n ASP 20 N 5.35 0.55 -4.81 1.61 2.03 -1.26 -2.12 116.55 117.89 1m7t n ASP 20 Ca 0.00 -0.05 -0.32 0.00 0.52 0.00 0.00 54.79 54.94 1m7t n ASP 20 Cb 0.00 0.96 0.03 0.00 -0.72 0.00 0.00 41.12 41.39 1m7t n ASP 20 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1m7t s LYS 21 N -3.30 3.12 0.10 -0.67 1.02 -1.24 -4.81 119.74 113.96 1m7t s LYS 21 Ca 0.00 1.05 -0.30 0.00 0.02 0.00 0.00 55.97 56.75 1m7t s LYS 21 Cb 0.13 -2.01 -0.06 0.00 -0.52 0.00 0.00 37.83 35.37 1m7t s LYS 21 CO 0.82 -0.96 0.98 -1.17 -0.92 0.00 0.00 175.35 174.10 1m7t s LEU 22 N -5.09 4.48 -0.30 3.17 2.96 -1.26 -4.55 118.68 118.09 1m7t s LEU 22 Ca 0.60 1.80 -0.02 0.00 -0.22 0.00 0.00 54.13 56.30 1m7t s LEU 22 Cb -0.15 -3.59 0.05 0.00 0.50 0.00 0.00 46.19 43.00 1m7t s LEU 22 CO 0.47 -0.11 0.00 -0.69 -1.32 0.00 0.00 176.35 174.70 1m7t s VAL 23 N 0.15 3.04 -0.31 1.68 1.01 0.02 -0.76 120.40 125.22 1m7t s VAL 23 Ca 0.48 -1.34 -0.08 0.00 0.00 0.00 0.00 61.98 61.04 1m7t s VAL 23 Cb -0.24 -2.73 0.00 0.00 0.00 0.00 0.00 36.38 33.42 1m7t s VAL 23 CO 0.30 -0.09 0.12 0.54 0.00 0.00 0.00 175.10 175.97 1m7t s VAL 24 N 1.27 4.31 0.33 2.92 0.11 -0.96 0.92 120.40 129.30 1m7t s VAL 24 Ca -0.05 -0.56 0.07 0.00 -2.93 0.00 0.00 61.98 58.51 1m7t s VAL 24 Cb -0.19 -3.22 -0.07 0.00 -1.53 0.00 0.00 36.38 31.37 1m7t s VAL 24 CO -0.01 0.06 -0.04 0.68 -3.33 0.00 0.00 175.10 172.46 1m7t s VAL 25 N 1.56 1.84 -0.04 2.04 -7.23 0.17 -3.19 120.40 115.54 1m7t s VAL 25 Ca 0.04 -2.10 0.02 0.00 -1.81 0.00 0.00 61.98 58.12 1m7t s VAL 25 Cb -0.17 -2.68 0.01 0.00 0.56 0.00 0.00 36.38 34.10 1m7t s VAL 25 CO 0.04 -0.16 -0.09 -0.62 -0.31 0.00 0.00 175.10 173.97 1m7t s ASP 26 N -3.56 1.30 -0.39 4.85 -1.08 -1.22 -0.56 116.67 116.02 1m7t s ASP 26 Ca 0.33 -0.20 -0.16 0.00 -0.52 0.00 0.00 52.55 51.99 1m7t s ASP 26 Cb 0.05 -0.52 0.01 0.00 -1.46 0.00 0.00 42.92 41.00 1m7t s ASP 26 CO 0.15 0.02 0.37 -0.36 0.52 0.00 0.00 175.17 175.87 1m7t s PHE 27 N 0.57 3.20 0.03 -5.34 0.40 0.28 -2.44 117.98 114.68 1m7t s PHE 27 Ca -0.10 -0.32 0.00 0.00 -0.60 0.00 0.00 56.93 55.91 1m7t s PHE 27 Cb -0.13 -2.72 0.00 0.00 0.51 0.00 0.00 43.02 40.68 1m7t s PHE 27 CO 0.01 -0.57 0.01 0.45 0.70 0.00 0.00 175.22 175.82 1m7t n SER 28 N 5.39 1.82 -3.69 1.36 2.88 -1.01 -2.19 113.62 118.19 1m7t n SER 28 Ca -0.09 -1.11 -0.12 0.00 -1.33 0.00 0.00 58.87 56.21 1m7t n SER 28 Cb 0.48 0.01 -0.06 0.00 -0.75 0.00 0.00 64.21 63.89 1m7t n SER 28 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1m7t s ALA 29 N -2.05 -0.89 0.18 -1.46 0.00 -1.26 -2.37 121.76 113.92 1m7t s ALA 29 Ca 0.00 0.17 -0.03 0.00 0.00 0.00 0.00 51.96 52.10 1m7t s ALA 29 Cb -0.00 0.37 0.07 0.00 0.00 0.00 0.00 23.12 23.56 1m7t s ALA 29 CO 0.00 -0.46 1.45 1.15 0.00 0.00 0.00 175.76 177.91 1m7t h THR 30 N 3.01 1.35 -0.19 0.00 2.02 -2.00 -3.01 112.91 114.08 1m7t h THR 30 Ca -0.32 -1.98 0.00 0.00 0.77 0.00 0.00 66.41 64.88 1m7t h THR 30 Cb 1.21 1.96 0.00 0.00 -1.74 0.00 0.00 68.15 69.58 1m7t h THR 30 CO 0.45 0.61 0.00 -2.67 0.37 0.00 0.00 175.52 174.27 1m7t n TRP 31 N -3.90 0.31 -3.66 3.16 4.27 -1.26 -4.88 117.44 111.49 1m7t n TRP 31 Ca -0.04 -0.14 -0.24 0.00 -3.89 0.00 0.00 57.50 53.19 1m7t n TRP 31 Cb 0.67 -0.03 -0.02 0.00 -1.36 0.00 0.00 31.31 30.56 1m7t n TRP 31 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1m7t n GLY 33 N -1.31 -0.15 0.31 0.00 0.00 -1.26 -4.67 105.19 98.10 1m7t n GLY 33 Ca -0.06 -0.04 0.18 0.00 0.00 0.00 0.00 46.02 46.10 1m7t n GLY 33 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1m7t h PRO 34 N -0.13 0.00 -0.58 1.61 0.11 -1.98 -2.41 132.00 128.62 1m7t h PRO 34 Ca 0.00 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.13 1m7t h PRO 34 Cb 0.13 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.20 1m7t h PRO 34 CO 0.00 0.00 0.36 0.00 -0.21 0.00 0.00 178.00 178.15 1m7t h LYS 36 N 0.70 0.00 0.00 0.00 1.57 -1.70 -2.52 116.57 114.63 1m7t h LYS 36 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1m7t h LYS 36 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1m7t h LYS 36 CO -0.09 0.16 0.00 0.52 -0.57 0.00 0.00 179.45 179.47 1m7t h MET 37 N 0.00 0.00 0.00 3.15 2.86 -1.37 -2.34 114.93 117.23 1m7t h MET 37 Ca -0.00 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 1m7t h MET 37 Cb 0.38 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 1m7t h MET 37 CO 0.02 0.00 -0.75 0.82 1.06 0.00 0.00 176.91 178.06 1m7t h ILE 38 N 0.00 0.21 0.11 -1.22 1.08 -1.48 -3.39 117.51 112.82 1m7t h ILE 38 Ca 0.00 -1.34 0.02 0.00 -0.39 0.00 0.00 64.86 63.14 1m7t h ILE 38 Cb 0.31 1.85 -0.05 0.00 -3.07 0.00 0.00 36.82 35.86 1m7t h ILE 38 CO 0.00 0.12 -0.51 0.11 -0.69 0.00 0.00 178.15 177.18 1m7t h LYS 39 N 0.00 -0.70 -0.73 2.37 1.57 -1.53 0.51 116.57 118.05 1m7t h LYS 39 Ca -0.03 0.05 0.15 0.00 -1.87 0.00 0.00 60.65 58.95 1m7t h LYS 39 Cb 1.16 0.16 -0.10 0.00 0.08 0.00 0.00 32.23 33.53 1m7t h LYS 39 CO 0.02 -0.47 0.23 -1.00 -0.57 0.00 0.00 179.45 177.66 1m7t h PRO 40 N -0.73 0.33 0.04 3.15 0.13 -1.75 -0.02 132.00 133.15 1m7t h PRO 40 Ca 0.00 -0.02 -0.22 0.00 -0.87 0.00 0.00 66.00 64.89 1m7t h PRO 40 Cb 0.74 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 31.78 1m7t h PRO 40 CO -0.29 0.22 -1.02 0.74 -0.23 0.00 0.00 178.00 177.42 1m7t h PHE 41 N 0.34 0.19 -0.29 1.56 0.04 -1.71 -2.92 116.94 114.15 1m7t h PHE 41 Ca 0.41 -0.13 -0.04 0.00 2.80 0.00 0.00 57.97 61.01 1m7t h PHE 41 Cb 0.66 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.79 1m7t h PHE 41 CO -0.22 1.05 0.02 0.35 -0.60 0.00 0.00 178.31 178.91 1m7t h PHE 42 N 0.04 0.55 -0.48 -0.55 3.57 0.91 -2.69 116.94 118.28 1m7t h PHE 42 Ca -0.05 -0.09 -0.10 0.00 3.53 0.00 0.00 57.97 61.26 1m7t h PHE 42 Cb 1.74 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 40.32 1m7t h PHE 42 CO 0.02 0.63 -0.11 1.25 -2.23 0.00 0.00 178.31 177.88 1m7t h HIS 43 N 0.31 0.98 -0.73 0.41 2.76 -1.12 -2.93 115.15 114.83 1m7t h HIS 43 Ca 0.09 -0.19 0.01 0.00 -2.20 0.00 0.00 60.37 58.08 1m7t h HIS 43 Cb 0.40 -0.25 -0.04 0.00 1.55 0.00 0.00 27.41 29.08 1m7t h HIS 43 CO 0.03 0.94 0.48 0.77 -1.30 0.00 0.00 177.93 178.85 1m7t h SER 44 N 0.80 0.82 -0.68 3.26 0.02 -1.43 -2.37 113.55 113.97 1m7t h SER 44 Ca 0.13 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1m7t h SER 44 Cb 0.63 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 1m7t h SER 44 CO 0.04 0.59 0.41 -0.07 -1.14 0.00 0.00 176.83 176.66 1m7t h LEU 45 N 0.97 0.82 -2.09 5.07 3.38 -1.35 -1.45 115.31 120.65 1m7t h LEU 45 Ca 0.27 -0.06 0.09 0.00 0.09 0.00 0.00 57.88 58.27 1m7t h LEU 45 Cb -0.08 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 1m7t h LEU 45 CO -0.07 0.63 0.33 0.77 0.09 0.00 0.00 178.44 180.19 1m7t h SER 46 N 0.93 0.00 1.13 -0.43 4.64 -1.25 0.62 113.55 119.18 1m7t h SER 46 Ca 0.24 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.48 1m7t h SER 46 Cb -0.03 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.04 1m7t h SER 46 CO -0.05 0.00 -0.92 -0.08 -0.87 0.00 0.00 176.83 174.92 1m7t h GLU 47 N 0.00 0.00 0.00 4.77 4.81 -1.14 -3.31 114.58 119.71 1m7t h GLU 47 Ca 0.14 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1m7t h GLU 47 Cb 0.79 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.17 1m7t h GLU 47 CO -0.00 0.21 -1.35 1.17 -0.73 0.00 0.00 179.01 178.31 1m7t n LYS 48 N -2.93 0.57 -3.34 1.92 4.81 0.56 -4.65 118.16 115.10 1m7t n LYS 48 Ca -0.03 -0.01 -0.46 0.00 -0.87 0.00 0.00 58.31 56.94 1m7t n LYS 48 Cb 0.69 -1.68 -0.02 0.00 0.02 0.00 0.00 35.03 34.04 1m7t n LYS 48 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1m7t s TYR 49 N -3.39 3.87 -0.41 5.64 1.51 0.19 -4.92 117.35 119.84 1m7t s TYR 49 Ca -0.02 -2.15 -0.05 0.00 -1.01 0.00 0.00 57.07 53.84 1m7t s TYR 49 Cb 0.12 -3.82 -0.04 0.00 -0.11 0.00 0.00 41.96 38.11 1m7t s TYR 49 CO 0.83 -0.98 3.02 -1.13 -1.11 0.00 0.00 175.55 176.18 1m7t n SER 50 N 3.70 6.26 0.00 2.29 3.41 -1.26 -3.69 113.62 124.33 1m7t n SER 50 Ca 0.16 -2.96 0.00 0.00 -0.26 0.00 0.00 58.87 55.81 1m7t n SER 50 Cb 0.45 -1.31 0.00 0.00 -0.26 0.00 0.00 64.21 63.10 1m7t n SER 50 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1m7t n ASN 51 N 1.50 0.00 -4.91 4.04 5.15 -1.26 -5.13 115.26 114.65 1m7t n ASN 51 Ca 0.49 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 54.19 1m7t n ASN 51 Cb 0.63 0.09 -0.03 0.00 -0.53 0.00 0.00 39.78 39.94 1m7t n ASN 51 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1m7t s VAL 52 N -1.26 5.07 -0.33 3.44 -7.23 -1.24 -4.36 120.40 114.49 1m7t s VAL 52 Ca 0.00 -0.05 -0.10 0.00 -1.81 0.00 0.00 61.98 60.02 1m7t s VAL 52 Cb 0.00 -3.73 0.00 0.00 0.56 0.00 0.00 36.38 33.21 1m7t s VAL 52 CO 0.00 -0.28 0.18 -0.51 -0.31 0.00 0.00 175.10 174.18 1m7t s ILE 53 N -2.02 4.68 -0.31 -0.62 1.10 0.06 -4.87 121.20 119.21 1m7t s ILE 53 Ca 0.42 -0.51 -0.15 0.00 -0.51 0.00 0.00 60.65 59.91 1m7t s ILE 53 Cb -0.11 -3.45 -0.02 0.00 0.15 0.00 0.00 42.46 39.03 1m7t s ILE 53 CO 0.30 -0.02 0.35 -0.36 -2.11 0.00 0.00 174.94 173.09 1m7t s PHE 54 N 1.61 3.22 0.22 3.50 0.40 -1.26 -2.26 117.98 123.42 1m7t s PHE 54 Ca 0.04 0.14 0.04 0.00 -0.60 0.00 0.00 56.93 56.55 1m7t s PHE 54 Cb -0.18 -2.61 -0.05 0.00 0.51 0.00 0.00 43.02 40.69 1m7t s PHE 54 CO 0.07 -0.34 -0.02 -0.48 0.70 0.00 0.00 175.22 175.15 1m7t s LEU 55 N 2.02 2.25 -0.25 -0.37 0.05 -1.19 -3.76 118.68 117.42 1m7t s LEU 55 Ca 0.12 -1.19 -0.03 0.00 0.05 0.00 0.00 54.13 53.08 1m7t s LEU 55 Cb -0.16 -0.31 0.02 0.00 -2.05 0.00 0.00 46.19 43.68 1m7t s LEU 55 CO 0.11 -0.47 -0.02 -0.70 -0.55 0.00 0.00 176.35 174.71 1m7t s GLU 56 N -3.84 3.00 -0.24 1.48 2.12 -1.17 -3.38 118.70 116.67 1m7t s GLU 56 Ca 0.27 -0.88 -0.02 0.00 0.36 0.00 0.00 54.97 54.69 1m7t s GLU 56 Cb 0.05 -3.08 0.02 0.00 0.26 0.00 0.00 34.13 31.38 1m7t s GLU 56 CO 0.08 -0.37 -0.05 0.08 -0.54 0.00 0.00 175.26 174.46 1m7t s VAL 57 N 1.39 3.05 -0.28 3.70 1.01 -1.02 -0.23 120.40 128.03 1m7t s VAL 57 Ca 0.02 -0.87 -0.12 0.00 0.00 0.00 0.00 61.98 61.01 1m7t s VAL 57 Cb -0.16 -2.50 -0.05 0.00 0.00 0.00 0.00 36.38 33.67 1m7t s VAL 57 CO -0.03 0.25 0.22 -0.62 0.00 0.00 0.00 175.10 174.93 1m7t s ASP 58 N 1.37 6.07 0.66 3.32 2.15 -1.26 -2.39 116.67 126.59 1m7t s ASP 58 Ca 0.02 0.05 0.44 0.00 0.43 0.00 0.00 52.55 53.49 1m7t s ASP 58 Cb -0.16 -2.14 2.34 0.00 -0.30 0.00 0.00 42.92 42.67 1m7t s ASP 58 CO -0.04 -0.07 2.34 1.62 -0.17 0.00 0.00 175.17 178.85 1m7t h VAL 59 N 5.36 0.00 -0.83 1.11 3.04 -1.72 0.97 116.25 124.19 1m7t h VAL 59 Ca -0.34 -0.05 -0.02 0.00 -1.01 0.00 0.00 66.70 65.28 1m7t h VAL 59 Cb 1.18 1.05 -0.04 0.00 -2.01 0.00 0.00 31.29 31.47 1m7t h VAL 59 CO 0.57 0.00 0.44 -0.78 -1.01 0.00 0.00 177.57 176.79 1m7t h ASP 60 N 0.00 1.05 0.00 3.17 3.58 -1.93 -1.58 116.42 120.71 1m7t h ASP 60 Ca -0.00 -0.11 -0.37 0.00 0.42 0.00 0.00 57.03 56.97 1m7t h ASP 60 Cb 0.05 -0.27 -0.07 0.00 1.72 0.00 0.00 39.33 40.76 1m7t h ASP 60 CO 0.00 0.85 -2.40 0.47 -2.88 0.00 0.00 179.24 175.28 1m7t n ASP 61 N -4.38 0.75 -2.32 2.28 8.00 -0.65 -4.42 116.55 115.82 1m7t n ASP 61 Ca 0.08 -0.05 -0.28 0.00 0.71 0.00 0.00 54.79 55.25 1m7t n ASP 61 Cb 0.10 0.50 0.03 0.00 -0.02 0.00 0.00 41.12 41.74 1m7t n ASP 61 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1m7t n ALA 62 N -2.92 6.01 0.59 2.24 0.00 0.33 -4.36 120.51 122.39 1m7t n ALA 62 Ca -0.37 -2.91 0.08 0.00 0.00 0.00 0.00 53.44 50.24 1m7t n ALA 62 Cb 1.09 -1.76 0.36 0.00 0.00 0.00 0.00 19.45 19.15 1m7t n ALA 62 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1m7t n GLN 63 N -0.09 0.00 0.03 0.00 7.27 -0.60 -2.51 117.38 121.48 1m7t n GLN 63 Ca 0.48 0.21 0.08 0.00 0.07 0.00 0.00 57.00 57.84 1m7t n GLN 63 Cb 0.54 -1.50 -0.10 0.00 2.41 0.00 0.00 30.24 31.59 1m7t n GLN 63 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1m7t n ASP 64 N -1.50 0.40 -0.02 1.69 9.92 -1.26 -4.17 116.55 121.61 1m7t n ASP 64 Ca 0.04 0.16 -0.16 0.00 -0.53 0.00 0.00 54.79 54.30 1m7t n ASP 64 Cb 0.20 1.17 -0.13 0.00 -0.64 0.00 0.00 41.12 41.71 1m7t n ASP 64 CO 0.00 0.00 0.00 -0.37 0.13 0.00 0.00 177.20 176.96 1m7t h VAL 65 N 0.00 1.67 -0.09 2.53 -1.51 -1.84 -3.31 116.25 113.71 1m7t h VAL 65 Ca -0.06 -2.35 0.03 0.00 -1.23 0.00 0.00 66.70 63.10 1m7t h VAL 65 Cb 1.16 3.24 -0.06 0.00 -2.13 0.00 0.00 31.29 33.50 1m7t h VAL 65 CO 0.01 0.63 -0.47 0.00 -1.23 0.00 0.00 177.57 176.51 1m7t h ALA 66 N 0.07 -0.73 -0.73 5.19 0.00 -1.74 -0.12 119.26 121.19 1m7t h ALA 66 Ca -0.05 -0.04 0.21 0.00 0.00 0.00 0.00 54.91 55.03 1m7t h ALA 66 Cb 1.21 0.86 -0.03 0.00 0.00 0.00 0.00 17.79 19.83 1m7t h ALA 66 CO 0.06 -1.00 0.60 -1.35 0.00 0.00 0.00 179.25 177.56 1m7t h PRO 67 N -0.56 0.00 0.00 0.00 0.11 -1.73 1.15 132.00 130.97 1m7t h PRO 67 Ca 0.05 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.08 1m7t h PRO 67 Cb 0.67 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.76 1m7t h PRO 67 CO -0.39 0.00 -0.39 -0.22 -0.21 0.00 0.00 178.00 176.79 1m7t h LYS 68 N 0.00 0.00 -0.01 1.05 3.64 -1.12 -3.16 116.57 116.98 1m7t h LYS 68 Ca 0.35 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.73 1m7t h LYS 68 Cb 1.55 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.37 1m7t h LYS 68 CO -0.00 0.39 -0.36 0.66 -2.27 0.00 0.00 179.45 177.87 1m7t n TYR 69 N -3.45 0.00 -2.87 1.91 4.01 0.32 -5.01 117.16 112.07 1m7t n TYR 69 Ca 0.00 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.59 1m7t n TYR 69 Cb 0.55 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.61 1m7t n TYR 69 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1m7t n GLY 70 N 1.09 -0.10 3.74 2.72 0.00 0.30 -4.99 105.19 107.96 1m7t n GLY 70 Ca 0.05 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 1m7t n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1m7t s ILE 71 N -3.02 3.71 -0.39 -0.61 1.01 -1.14 -4.96 121.20 115.80 1m7t s ILE 71 Ca 0.24 1.52 0.11 0.00 0.00 0.00 0.00 60.65 62.52 1m7t s ILE 71 Cb -0.11 -3.97 0.38 0.00 0.01 0.00 0.00 42.46 38.77 1m7t s ILE 71 CO 0.30 0.28 1.08 -1.14 0.00 0.00 0.00 174.94 175.46 1m7t n ARG 72 N 2.12 1.09 0.00 2.79 0.63 -1.26 -4.82 116.66 117.20 1m7t n ARG 72 Ca 0.02 -2.46 0.00 0.00 -0.92 0.00 0.00 57.85 54.49 1m7t n ARG 72 Cb 0.45 -0.91 0.00 0.00 0.45 0.00 0.00 32.46 32.45 1m7t n ARG 72 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1m7t n GLY 73 N -0.03 -0.48 3.87 5.14 0.00 -1.26 -5.15 105.19 107.28 1m7t n GLY 73 Ca 0.08 0.81 -0.27 0.00 0.00 0.00 0.00 46.02 46.64 1m7t n GLY 73 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1m7t s ILE 74 N 0.00 4.91 -0.35 -0.61 -4.36 -1.26 -2.98 121.20 116.55 1m7t s ILE 74 Ca 0.00 -0.85 -0.29 0.00 -0.26 0.00 0.00 60.65 59.25 1m7t s ILE 74 Cb 0.00 -3.50 0.01 0.00 1.25 0.00 0.00 42.46 40.22 1m7t s ILE 74 CO 0.00 -0.07 1.21 -2.16 0.24 0.00 0.00 174.94 174.16 1m7t s PRO 75 N -3.09 3.90 0.06 0.37 0.04 -1.26 -4.56 135.00 130.46 1m7t s PRO 75 Ca 0.33 1.05 -0.23 0.00 0.04 0.00 0.00 61.00 62.19 1m7t s PRO 75 Cb -0.11 -3.85 -0.06 0.00 0.04 0.00 0.00 34.50 30.52 1m7t s PRO 75 CO 0.26 -1.14 0.70 0.99 0.04 0.00 0.00 177.00 177.85 1m7t s THR 76 N 4.26 4.70 -0.21 1.26 2.01 -0.93 -1.42 115.64 125.31 1m7t s THR 76 Ca 0.52 1.49 -0.06 0.00 0.31 0.00 0.00 61.69 63.95 1m7t s THR 76 Cb -0.13 -4.04 -0.03 0.00 0.01 0.00 0.00 72.50 68.31 1m7t s THR 76 CO 0.23 0.44 0.03 -0.76 -0.69 0.00 0.00 174.62 173.87 1m7t s LEU 77 N -0.48 3.36 -0.07 4.42 1.02 0.34 0.99 118.68 128.27 1m7t s LEU 77 Ca 0.35 -0.18 0.04 0.00 0.02 0.00 0.00 54.13 54.35 1m7t s LEU 77 Cb -0.20 -1.87 -0.02 0.00 0.02 0.00 0.00 46.19 44.12 1m7t s LEU 77 CO 0.22 0.04 -0.18 -0.76 0.02 0.00 0.00 176.35 175.69 1m7t s LEU 78 N 1.14 2.51 -0.17 1.79 1.43 0.28 0.46 118.68 126.12 1m7t s LEU 78 Ca 0.03 -0.33 -0.00 0.00 -1.03 0.00 0.00 54.13 52.80 1m7t s LEU 78 Cb -0.14 -1.51 0.00 0.00 0.03 0.00 0.00 46.19 44.57 1m7t s LEU 78 CO 0.02 0.27 -0.14 -0.76 0.23 0.00 0.00 176.35 175.97 1m7t s LEU 79 N -0.29 2.48 0.03 1.79 2.01 0.22 0.43 118.68 125.35 1m7t s LEU 79 Ca 0.01 -0.49 0.06 0.00 0.01 0.00 0.00 54.13 53.72 1m7t s LEU 79 Cb -0.13 -1.58 -0.03 0.00 0.01 0.00 0.00 46.19 44.46 1m7t s LEU 79 CO 0.03 0.05 -0.13 -0.36 1.01 0.00 0.00 176.35 176.94 1m7t s PHE 80 N 1.02 2.69 -0.20 0.29 0.40 0.26 -0.72 117.98 121.72 1m7t s PHE 80 Ca -0.01 -0.17 -0.04 0.00 -0.60 0.00 0.00 56.93 56.11 1m7t s PHE 80 Cb -0.15 -1.52 0.09 0.00 0.51 0.00 0.00 43.02 41.96 1m7t s PHE 80 CO -0.03 0.30 0.25 0.21 0.70 0.00 0.00 175.22 176.65 1m7t s LYS 81 N -1.46 0.20 -1.18 0.44 2.20 0.29 -0.80 119.74 119.43 1m7t s LYS 81 Ca 0.16 0.32 -0.04 0.00 -0.36 0.00 0.00 55.97 56.05 1m7t s LYS 81 Cb -0.11 -0.96 0.00 0.00 -1.51 0.00 0.00 37.83 35.26 1m7t s LYS 81 CO 0.06 -0.61 1.01 0.09 -0.36 0.00 0.00 175.35 175.55 1m7t n ASN 82 N 5.33 -3.94 0.00 1.43 5.03 -0.90 -1.88 115.26 120.32 1m7t n ASN 82 Ca -0.05 -0.54 0.00 0.00 0.87 0.00 0.00 54.58 54.86 1m7t n ASN 82 Cb 0.50 -4.74 0.00 0.00 -1.02 0.00 0.00 39.78 34.51 1m7t n ASN 82 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1m7t n GLY 83 N -1.49 0.56 3.22 7.41 0.00 -1.26 -4.99 105.19 108.64 1m7t n GLY 83 Ca -0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.62 1m7t n GLY 83 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1m7t s GLU 84 N -0.45 1.62 -0.08 1.61 2.12 -0.79 -5.10 118.70 117.64 1m7t s GLU 84 Ca 0.00 -0.74 -0.30 0.00 0.36 0.00 0.00 54.97 54.29 1m7t s GLU 84 Cb 0.00 -1.58 -0.04 0.00 0.26 0.00 0.00 34.13 32.76 1m7t s GLU 84 CO 0.00 0.43 1.50 0.08 -0.54 0.00 0.00 175.26 176.73 1m7t s VAL 85 N -0.50 3.80 -0.56 3.70 1.01 -1.26 0.10 120.40 126.69 1m7t s VAL 85 Ca 0.08 1.01 0.06 0.00 0.00 0.00 0.00 61.98 63.13 1m7t s VAL 85 Cb -0.08 -3.65 0.16 0.00 0.00 0.00 0.00 36.38 32.81 1m7t s VAL 85 CO -0.01 -0.07 1.09 0.00 0.00 0.00 0.00 175.10 176.10 1m7t n ALA 86 N 6.68 2.15 -3.64 5.51 0.00 0.10 -4.89 120.51 126.42 1m7t n ALA 86 Ca 0.16 -1.01 -0.04 0.00 0.00 0.00 0.00 53.44 52.55 1m7t n ALA 86 Cb 0.43 -0.24 -0.07 0.00 0.00 0.00 0.00 19.45 19.57 1m7t n ALA 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1m7t s ALA 87 N -0.94 -2.23 -0.05 0.00 0.00 -1.18 -4.99 121.76 112.37 1m7t s ALA 87 Ca 0.12 1.88 -0.00 0.00 0.00 0.00 0.00 51.96 53.96 1m7t s ALA 87 Cb 0.07 -1.70 0.03 0.00 0.00 0.00 0.00 23.12 21.51 1m7t s ALA 87 CO 0.09 -0.22 -0.00 0.99 0.00 0.00 0.00 175.76 176.62 1m7t s THR 88 N 0.49 0.31 0.05 0.00 2.01 -1.26 -0.61 115.64 116.62 1m7t s THR 88 Ca 0.01 0.08 0.07 0.00 0.31 0.00 0.00 61.69 62.16 1m7t s THR 88 Cb -0.04 -0.42 -0.03 0.00 0.01 0.00 0.00 72.50 72.02 1m7t s THR 88 CO -0.12 0.21 -0.21 -0.54 -0.69 0.00 0.00 174.62 173.28 1m7t s LYS 89 N 1.45 1.36 0.07 4.92 -0.14 0.17 -4.98 119.74 122.59 1m7t s LYS 89 Ca -0.03 -0.95 0.10 0.00 -1.36 0.00 0.00 55.97 53.72 1m7t s LYS 89 Cb -0.13 -1.48 -0.03 0.00 -1.68 0.00 0.00 37.83 34.51 1m7t s LYS 89 CO -0.03 0.38 -0.26 0.08 -0.76 0.00 0.00 175.35 174.76 1m7t s VAL 90 N -0.82 2.24 0.08 3.17 1.01 -1.26 0.13 120.40 124.94 1m7t s VAL 90 Ca 0.07 -1.47 0.00 0.00 0.00 0.00 0.00 61.98 60.58 1m7t s VAL 90 Cb -0.09 -1.91 0.00 0.00 0.00 0.00 0.00 36.38 34.38 1m7t s VAL 90 CO 0.02 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.02 1m7t n GLY 91 N 1.52 -2.66 3.47 4.51 0.00 -0.51 -4.93 105.19 106.59 1m7t n GLY 91 Ca -0.17 -1.40 -0.30 0.00 0.00 0.00 0.00 46.02 44.15 1m7t n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m7t s ALA 92 N -3.08 -0.07 -0.15 4.61 0.00 -1.26 -4.68 121.76 117.12 1m7t s ALA 92 Ca 0.00 -0.74 -0.30 0.00 0.00 0.00 0.00 51.96 50.91 1m7t s ALA 92 Cb 0.00 -2.98 0.13 0.00 0.00 0.00 0.00 23.12 20.28 1m7t s ALA 92 CO 0.00 -3.98 1.04 -0.48 0.00 0.00 0.00 175.76 172.34 1m7t s LEU 93 N -7.31 -0.30 1.31 0.00 2.34 -1.26 -5.07 118.68 108.38 1m7t s LEU 93 Ca 0.69 0.23 -0.21 0.00 0.06 0.00 0.00 54.13 54.90 1m7t s LEU 93 Cb -0.14 1.75 0.33 0.00 -0.56 0.00 0.00 46.19 47.57 1m7t s LEU 93 CO 0.58 -0.35 1.05 -0.55 -1.06 0.00 0.00 176.35 176.02 1m7t s SER 94 N -1.51 0.01 0.30 1.48 0.15 -1.26 -4.82 113.70 108.04 1m7t s SER 94 Ca 0.02 0.65 0.13 0.00 0.70 0.00 0.00 55.95 57.45 1m7t s SER 94 Cb -0.01 -0.88 0.42 0.00 -1.71 0.00 0.00 66.02 63.84 1m7t s SER 94 CO -0.02 -4.69 1.63 0.50 1.20 0.00 0.00 173.24 171.86 1m7t h LYS 95 N -2.96 0.00 0.02 5.44 3.64 -2.00 -2.83 116.57 117.88 1m7t h LYS 95 Ca -0.43 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 58.75 1m7t h LYS 95 Cb 1.31 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.11 1m7t h LYS 95 CO 0.29 0.56 -0.93 0.78 -2.27 0.00 0.00 179.45 177.88 1m7t h GLY 96 N 2.03 0.13 1.85 5.01 0.00 -1.99 -2.46 103.07 107.65 1m7t h GLY 96 Ca -0.01 -0.26 -0.20 0.00 0.00 0.00 0.00 47.33 46.87 1m7t h GLY 96 CO 0.07 0.23 -0.90 1.46 0.00 0.00 0.00 176.54 177.40 1m7t h GLN 97 N 0.05 0.13 0.05 4.80 4.20 -1.91 -0.46 115.11 121.98 1m7t h GLN 97 Ca -0.04 -0.15 -0.00 0.00 0.06 0.00 0.00 58.65 58.52 1m7t h GLN 97 Cb 1.60 0.05 0.00 0.00 0.30 0.00 0.00 27.48 29.43 1m7t h GLN 97 CO 0.13 0.94 -0.02 1.25 -0.67 0.00 0.00 178.83 180.46 1m7t h LEU 98 N 0.06 -0.06 -0.54 1.46 6.46 -1.54 -1.28 115.31 119.87 1m7t h LEU 98 Ca -0.04 -0.49 -0.03 0.00 -0.12 0.00 0.00 57.88 57.20 1m7t h LEU 98 Cb 1.55 0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 41.48 1m7t h LEU 98 CO 0.13 0.48 0.21 0.50 -0.62 0.00 0.00 178.44 179.14 1m7t h LYS 99 N -0.62 0.81 -0.60 1.25 3.64 -1.51 -0.83 116.57 118.72 1m7t h LYS 99 Ca -0.01 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.20 1m7t h LYS 99 Cb 0.54 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.20 1m7t h LYS 99 CO 0.01 0.71 0.31 1.05 -2.27 0.00 0.00 179.45 179.26 1m7t h GLU 100 N 0.74 0.85 -0.82 1.90 -0.00 -1.13 0.12 114.58 116.24 1m7t h GLU 100 Ca 0.18 -0.12 -0.02 0.00 -0.00 0.00 0.00 59.36 59.40 1m7t h GLU 100 Cb 0.21 -0.16 -0.04 0.00 -0.00 0.00 0.00 28.75 28.76 1m7t h GLU 100 CO -0.01 0.67 0.42 0.35 -0.00 0.00 0.00 179.01 180.44 1m7t h PHE 101 N 0.82 1.15 0.69 2.06 3.57 -0.99 -1.39 116.94 122.83 1m7t h PHE 101 Ca 0.21 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.64 1m7t h PHE 101 Cb 0.09 -0.36 0.01 0.00 2.79 0.00 0.00 35.95 38.47 1m7t h PHE 101 CO -0.00 0.81 -0.33 -0.07 -2.23 0.00 0.00 178.31 176.49 1m7t h LEU 102 N 1.16 -0.78 -1.78 0.59 3.38 -0.53 -2.60 115.31 114.74 1m7t h LEU 102 Ca 0.29 0.03 0.32 0.00 0.09 0.00 0.00 57.88 58.60 1m7t h LEU 102 Cb 0.07 0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 1m7t h LEU 102 CO -0.04 -0.43 0.79 -0.78 0.09 0.00 0.00 178.44 178.07 1m7t h ASP 103 N -1.18 0.15 0.76 -0.43 1.82 -0.71 1.42 116.42 118.24 1m7t h ASP 103 Ca -0.09 0.03 -0.07 0.00 -0.39 0.00 0.00 57.03 56.50 1m7t h ASP 103 Cb 0.71 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.72 1m7t h ASP 103 CO 0.15 0.02 -0.34 0.00 -1.61 0.00 0.00 179.24 177.46 1m7t h ALA 104 N 1.48 1.06 0.00 -0.78 0.00 -1.05 -2.42 119.26 117.55 1m7t h ALA 104 Ca 0.58 -0.31 -0.17 0.00 0.00 0.00 0.00 54.91 55.01 1m7t h ALA 104 Cb 2.03 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.73 1m7t h ALA 104 CO -0.11 0.43 -1.86 -1.71 0.00 0.00 0.00 179.25 176.00 1m7t n ASN 105 N -3.59 1.59 0.00 0.00 5.15 0.31 -4.51 115.26 114.22 1m7t n ASN 105 Ca -0.01 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 53.85 1m7t n ASN 105 Cb 0.47 1.13 -0.00 0.00 -0.53 0.00 0.00 39.78 40.85 1m7t n ASN 105 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 1m7t h LEU 106 N 0.00 0.71 0.00 1.20 6.46 0.14 -3.50 115.31 120.33 1m7t h LEU 106 Ca -0.25 -0.44 0.00 0.00 -0.12 0.00 0.00 57.88 57.08 1m7t h LEU 106 Cb 1.45 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 41.17 1m7t h LEU 106 CO 0.01 1.19 0.00 1.33 -0.62 0.00 0.00 178.44 180.36