#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 3.88 -0.09 2.03 1.01 -1.24 -4.71 120.40 121.28 1m7t s VAL 2 Ca 0.00 1.43 -0.03 0.00 0.00 0.00 0.00 61.98 63.38 1m7t s VAL 2 Cb 0.00 -3.73 0.05 0.00 0.00 0.00 0.00 36.38 32.69 1m7t s VAL 2 CO 0.00 -0.00 0.16 -1.59 0.00 0.00 0.00 175.10 173.67 1m7t s LYS 3 N -2.48 0.04 0.06 2.72 0.00 -1.25 -5.00 119.74 113.82 1m7t s LYS 3 Ca 0.57 0.57 -0.31 0.00 0.00 0.00 0.00 55.97 56.80 1m7t s LYS 3 Cb -0.20 -0.28 -0.06 0.00 0.00 0.00 0.00 37.83 37.29 1m7t s LYS 3 CO 0.25 -0.31 1.23 -1.14 0.00 0.00 0.00 175.35 175.38 1m7t s GLN 4 N 2.30 4.41 -0.42 1.78 0.74 -1.26 -3.07 119.66 124.14 1m7t s GLN 4 Ca 0.03 1.81 -0.14 0.00 0.05 0.00 0.00 55.36 57.12 1m7t s GLN 4 Cb -0.12 -3.35 0.04 0.00 1.10 0.00 0.00 33.01 30.68 1m7t s GLN 4 CO -0.06 -0.30 0.30 0.42 -0.55 0.00 0.00 175.29 175.10 1m7t s ILE 5 N 1.17 4.97 -0.32 -2.34 1.09 0.31 -4.93 121.20 121.17 1m7t s ILE 5 Ca 0.59 -0.89 0.13 0.00 -1.10 0.00 0.00 60.65 59.39 1m7t s ILE 5 Cb -0.30 -3.85 0.78 0.00 -1.06 0.00 0.00 42.46 38.03 1m7t s ILE 5 CO 0.29 -0.38 1.69 -0.62 -0.10 0.00 0.00 174.94 175.82 1m7t n GLU 6 N 5.10 4.69 -3.61 2.79 1.02 -1.26 -4.04 120.64 125.33 1m7t n GLU 6 Ca -0.11 -2.99 -0.11 0.00 -0.02 0.00 0.00 57.16 53.92 1m7t n GLU 6 Cb 0.45 -2.22 -0.05 0.00 -0.02 0.00 0.00 31.44 29.61 1m7t n GLU 6 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1m7t s SER 7 N -0.74 -0.29 0.30 1.62 0.01 -1.26 -4.52 113.70 108.82 1m7t s SER 7 Ca 0.52 -0.20 0.12 0.00 1.31 0.00 0.00 55.95 57.70 1m7t s SER 7 Cb 0.39 0.48 0.47 0.00 0.21 0.00 0.00 66.02 67.57 1m7t s SER 7 CO 0.15 -0.83 1.67 0.50 0.41 0.00 0.00 173.24 175.14 1m7t h LYS 8 N 2.45 0.00 0.03 12.44 3.64 -1.92 -3.01 116.57 130.19 1m7t h LYS 8 Ca -0.33 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 58.82 1m7t h LYS 8 Cb 1.25 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.05 1m7t h LYS 8 CO 0.45 0.54 -1.07 1.15 -2.27 0.00 0.00 179.45 178.25 1m7t h THR 9 N 0.00 1.65 -0.37 1.00 2.02 -1.99 -3.28 112.91 111.94 1m7t h THR 9 Ca -0.01 -3.34 -0.07 0.00 0.77 0.00 0.00 66.41 63.77 1m7t h THR 9 Cb 0.99 2.86 -0.02 0.00 -1.74 0.00 0.00 68.15 70.24 1m7t h THR 9 CO 0.07 0.95 -0.05 0.00 0.37 0.00 0.00 175.52 176.86 1m7t h ALA 10 N 0.91 1.21 -0.63 6.16 0.00 -1.93 -2.19 119.26 122.79 1m7t h ALA 10 Ca -0.04 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.63 1m7t h ALA 10 Cb 1.82 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 19.41 1m7t h ALA 10 CO 0.14 0.51 0.40 0.35 0.00 0.00 0.00 179.25 180.66 1m7t h PHE 11 N 0.58 0.76 -0.74 0.00 3.57 -1.59 -0.50 116.94 119.03 1m7t h PHE 11 Ca 0.11 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.57 1m7t h PHE 11 Cb 0.44 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.90 1m7t h PHE 11 CO 0.02 0.45 0.21 1.96 -2.23 0.00 0.00 178.31 178.73 1m7t h GLN 12 N 0.81 1.15 -0.16 1.11 1.08 -1.58 -1.23 115.11 116.29 1m7t h GLN 12 Ca 0.24 -0.26 0.01 0.00 -1.45 0.00 0.00 58.65 57.20 1m7t h GLN 12 Cb -0.03 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.22 1m7t h GLN 12 CO -0.08 0.99 0.06 0.93 -0.95 0.00 0.00 178.83 179.78 1m7t h GLU 13 N 1.10 0.14 -0.24 1.46 5.08 -0.66 0.33 114.58 121.79 1m7t h GLU 13 Ca 0.24 -0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.51 1m7t h GLU 13 Cb 0.33 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 1m7t h GLU 13 CO -0.00 0.09 -0.20 0.00 -1.00 0.00 0.00 179.01 177.90 1m7t h ALA 14 N 1.09 1.21 -0.53 3.43 0.00 -0.97 -2.27 119.26 121.22 1m7t h ALA 14 Ca 0.07 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.57 1m7t h ALA 14 Cb 0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1m7t h ALA 14 CO -0.06 0.51 -0.08 -0.07 0.00 0.00 0.00 179.25 179.55 1m7t h LEU 15 N 0.39 0.98 -1.32 0.00 3.38 -0.71 -2.61 115.31 115.42 1m7t h LEU 15 Ca 0.07 -0.34 -0.07 0.00 0.09 0.00 0.00 57.88 57.63 1m7t h LEU 15 Cb 0.57 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1m7t h LEU 15 CO 0.04 1.09 -0.33 -0.78 0.09 0.00 0.00 178.44 178.55 1m7t h ASP 16 N 0.86 0.00 -0.11 -0.43 3.58 -0.69 -2.61 116.42 117.02 1m7t h ASP 16 Ca 0.14 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.58 1m7t h ASP 16 Cb 0.63 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.68 1m7t h ASP 16 CO 0.04 0.33 0.04 0.00 -2.88 0.00 0.00 179.24 176.77 1m7t h ALA 17 N 1.67 0.14 0.32 -0.78 0.00 -1.02 -3.30 119.26 116.29 1m7t h ALA 17 Ca -0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1m7t h ALA 17 Cb 0.63 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1m7t h ALA 17 CO 0.04 -0.27 -0.15 0.00 0.00 0.00 0.00 179.25 178.87 1m7t h ALA 18 N 0.88 -0.71 0.00 0.00 0.00 -1.46 -3.47 119.26 114.50 1m7t h ALA 18 Ca 0.04 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1m7t h ALA 18 Cb 0.18 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1m7t h ALA 18 CO -0.00 -0.68 0.00 0.41 0.00 0.00 0.00 179.25 178.97 1m7t n GLY 19 N -0.05 2.36 0.05 0.00 0.00 -0.99 -3.60 105.19 102.96 1m7t n GLY 19 Ca -0.05 -0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.05 1m7t n GLY 19 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1m7t n ASP 20 N 5.18 0.44 -4.81 1.61 5.68 -1.26 -2.28 116.55 121.11 1m7t n ASP 20 Ca 0.00 0.04 -0.33 0.00 -0.50 0.00 0.00 54.79 54.00 1m7t n ASP 20 Cb 0.00 1.21 0.00 0.00 -1.14 0.00 0.00 41.12 41.19 1m7t n ASP 20 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1m7t s LYS 21 N -3.39 3.40 0.16 0.11 1.02 -1.24 -4.82 119.74 114.99 1m7t s LYS 21 Ca -0.03 1.16 -0.30 0.00 0.02 0.00 0.00 55.97 56.82 1m7t s LYS 21 Cb 0.13 -2.05 -0.07 0.00 -0.52 0.00 0.00 37.83 35.32 1m7t s LYS 21 CO 0.85 -0.74 0.99 -1.17 -0.92 0.00 0.00 175.35 174.36 1m7t s LEU 22 N -4.46 4.53 -0.32 3.17 2.96 -1.25 -4.58 118.68 118.73 1m7t s LEU 22 Ca 0.63 1.91 0.00 0.00 -0.22 0.00 0.00 54.13 56.45 1m7t s LEU 22 Cb -0.15 -3.60 0.07 0.00 0.50 0.00 0.00 46.19 43.01 1m7t s LEU 22 CO 0.37 -0.06 0.02 -0.69 -1.32 0.00 0.00 176.35 174.66 1m7t s VAL 23 N -0.32 2.73 -0.28 1.68 1.01 -0.26 -0.85 120.40 124.10 1m7t s VAL 23 Ca 0.46 -1.72 -0.10 0.00 0.00 0.00 0.00 61.98 60.62 1m7t s VAL 23 Cb -0.26 -2.70 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 1m7t s VAL 23 CO 0.32 -0.27 0.15 0.54 0.00 0.00 0.00 175.10 175.84 1m7t s VAL 24 N 1.14 4.89 0.30 2.92 0.11 -1.12 0.82 120.40 129.46 1m7t s VAL 24 Ca -0.01 -0.04 0.05 0.00 -2.93 0.00 0.00 61.98 59.05 1m7t s VAL 24 Cb -0.20 -3.35 -0.06 0.00 -1.53 0.00 0.00 36.38 31.23 1m7t s VAL 24 CO -0.04 0.24 0.01 0.68 -3.33 0.00 0.00 175.10 172.66 1m7t s VAL 25 N 1.69 1.38 -0.02 2.04 -7.23 0.23 -3.41 120.40 115.08 1m7t s VAL 25 Ca 0.06 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 58.21 1m7t s VAL 25 Cb -0.16 -2.63 0.00 0.00 0.56 0.00 0.00 36.38 34.16 1m7t s VAL 25 CO 0.08 -0.15 -0.07 -0.62 -0.31 0.00 0.00 175.10 174.02 1m7t s ASP 26 N -3.46 1.03 -0.39 4.85 2.15 -1.24 -0.37 116.67 119.23 1m7t s ASP 26 Ca 0.33 -0.16 -0.14 0.00 0.43 0.00 0.00 52.55 53.01 1m7t s ASP 26 Cb 0.07 -0.27 0.01 0.00 -0.30 0.00 0.00 42.92 42.43 1m7t s ASP 26 CO 0.13 0.05 0.27 -0.36 -0.17 0.00 0.00 175.17 175.09 1m7t s PHE 27 N 0.21 3.24 0.00 -5.34 0.40 0.25 -2.39 117.98 114.35 1m7t s PHE 27 Ca -0.03 -0.59 0.00 0.00 -0.60 0.00 0.00 56.93 55.71 1m7t s PHE 27 Cb -0.08 -2.54 0.00 0.00 0.51 0.00 0.00 43.02 40.91 1m7t s PHE 27 CO 0.00 -0.56 0.00 -1.13 0.70 0.00 0.00 175.22 174.24 1m7t n SER 28 N 5.12 1.86 -3.68 1.36 3.41 -1.07 -2.31 113.62 118.31 1m7t n SER 28 Ca -0.11 -0.79 -0.13 0.00 -0.26 0.00 0.00 58.87 57.58 1m7t n SER 28 Cb 0.47 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.36 1m7t n SER 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1m7t s ALA 29 N -2.00 -0.96 0.21 7.33 0.00 -1.26 -2.62 121.76 122.46 1m7t s ALA 29 Ca 0.00 0.30 0.02 0.00 0.00 0.00 0.00 51.96 52.28 1m7t s ALA 29 Cb 0.00 0.30 0.18 0.00 0.00 0.00 0.00 23.12 23.60 1m7t s ALA 29 CO 0.00 -0.43 1.52 1.79 0.00 0.00 0.00 175.76 178.65 1m7t h THR 30 N 3.13 1.37 -0.26 0.00 1.35 -2.02 -2.90 112.91 113.59 1m7t h THR 30 Ca -0.31 -1.97 0.00 0.00 -0.55 0.00 0.00 66.41 63.58 1m7t h THR 30 Cb 1.20 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 69.59 1m7t h THR 30 CO 0.43 0.59 0.00 -2.67 -0.25 0.00 0.00 175.52 173.62 1m7t n TRP 31 N -3.88 0.37 -3.50 4.73 4.27 -1.26 -4.90 117.44 113.26 1m7t n TRP 31 Ca -0.03 -0.18 -0.25 0.00 -3.89 0.00 0.00 57.50 53.15 1m7t n TRP 31 Cb 0.63 -0.01 -0.02 0.00 -1.36 0.00 0.00 31.31 30.55 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 -1.38 -0.28 0.29 0.00 0.00 -1.26 -4.58 105.19 97.97 1m7t n GLY 33 Ca -0.05 -0.09 0.16 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.26 0.00 -0.51 1.61 0.11 -1.98 -2.79 132.00 128.18 1m7t h PRO 34 Ca 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 1m7t h PRO 34 Cb 0.26 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.35 1m7t h PRO 34 CO 0.00 0.06 0.27 0.00 -0.21 0.00 0.00 178.00 178.12 1m7t h LYS 36 N 0.67 0.00 0.00 0.00 1.57 -1.74 -2.36 116.57 114.71 1m7t h LYS 36 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1m7t h LYS 36 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1m7t h LYS 36 CO -0.03 0.18 0.00 0.52 -0.57 0.00 0.00 179.45 179.56 1m7t h MET 37 N 0.00 0.00 0.00 3.15 2.86 -1.45 -2.53 114.93 116.96 1m7t h MET 37 Ca -0.00 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 1m7t h MET 37 Cb 0.37 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 1m7t h MET 37 CO 0.02 0.00 -0.88 0.82 1.06 0.00 0.00 176.91 177.94 1m7t h ILE 38 N 0.00 0.27 0.10 -1.22 1.08 -1.45 -3.39 117.51 112.90 1m7t h ILE 38 Ca 0.00 -1.46 0.01 0.00 -0.39 0.00 0.00 64.86 63.02 1m7t h ILE 38 Cb 0.29 1.87 -0.05 0.00 -3.07 0.00 0.00 36.82 35.86 1m7t h ILE 38 CO 0.00 0.15 -0.51 0.11 -0.69 0.00 0.00 178.15 177.21 1m7t h LYS 39 N 0.00 -0.69 -0.77 2.37 1.57 -1.56 0.58 116.57 118.06 1m7t h LYS 39 Ca -0.05 0.05 0.18 0.00 -1.87 0.00 0.00 60.65 58.96 1m7t h LYS 39 Cb 1.22 0.16 -0.13 0.00 0.08 0.00 0.00 32.23 33.56 1m7t h LYS 39 CO 0.02 -0.46 0.10 -1.00 -0.57 0.00 0.00 179.45 177.54 1m7t h PRO 40 N -0.72 0.16 0.06 3.15 0.13 -1.75 0.15 132.00 133.18 1m7t h PRO 40 Ca -0.00 -0.01 -0.24 0.00 -0.87 0.00 0.00 66.00 64.87 1m7t h PRO 40 Cb 0.73 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.81 1m7t h PRO 40 CO -0.29 0.11 -1.14 0.74 -0.23 0.00 0.00 178.00 177.19 1m7t h PHE 41 N 0.17 0.23 -0.29 1.56 0.04 -1.71 -2.73 116.94 114.22 1m7t h PHE 41 Ca 0.44 -0.17 -0.06 0.00 2.80 0.00 0.00 57.97 60.98 1m7t h PHE 41 Cb 0.79 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.92 1m7t h PHE 41 CO -0.35 1.14 -0.06 0.35 -0.60 0.00 0.00 178.31 178.79 1m7t h PHE 42 N 0.03 0.61 -0.45 -0.55 3.57 0.12 -2.53 116.94 117.74 1m7t h PHE 42 Ca -0.08 -0.13 -0.11 0.00 3.53 0.00 0.00 57.97 61.19 1m7t h PHE 42 Cb 1.87 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 40.45 1m7t h PHE 42 CO 0.03 0.73 -0.16 1.25 -2.23 0.00 0.00 178.31 177.93 1m7t h HIS 43 N 0.31 0.96 -0.65 0.41 2.76 -0.84 -2.92 115.15 115.18 1m7t h HIS 43 Ca 0.07 -0.20 -0.00 0.00 -2.20 0.00 0.00 60.37 58.04 1m7t h HIS 43 Cb 0.53 -0.24 -0.03 0.00 1.55 0.00 0.00 27.41 29.22 1m7t h HIS 43 CO 0.05 0.95 0.40 1.03 -1.30 0.00 0.00 177.93 179.06 1m7t h SER 44 N 0.76 0.77 -1.00 3.26 0.87 -1.42 -2.28 113.55 114.51 1m7t h SER 44 Ca 0.11 -0.05 0.02 0.00 -1.23 0.00 0.00 61.79 60.64 1m7t h SER 44 Cb 0.68 -0.19 -0.05 0.00 -0.44 0.00 0.00 62.40 62.40 1m7t h SER 44 CO 0.05 0.59 0.66 -0.07 -0.53 0.00 0.00 176.83 177.53 1m7t h LEU 45 N 0.88 1.13 -2.03 2.23 3.38 -1.34 -0.90 115.31 118.65 1m7t h LEU 45 Ca 0.23 -0.02 0.13 0.00 0.09 0.00 0.00 57.88 58.31 1m7t h LEU 45 Cb -0.04 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 1m7t h LEU 45 CO -0.05 0.80 0.39 0.28 0.09 0.00 0.00 178.44 179.96 1m7t h SER 46 N 1.33 0.00 1.08 -0.43 0.02 -1.22 0.90 113.55 115.23 1m7t h SER 46 Ca 0.38 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.28 1m7t h SER 46 Cb -0.10 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 1m7t h SER 46 CO -0.10 0.00 -0.94 -0.33 -1.14 0.00 0.00 176.83 174.32 1m7t h GLU 47 N 0.00 0.00 0.00 3.45 4.39 -1.12 -3.32 114.58 117.97 1m7t h GLU 47 Ca 0.21 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.86 1m7t h GLU 47 Cb 0.99 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.63 1m7t h GLU 47 CO -0.00 0.10 -1.51 1.17 -1.16 0.00 0.00 179.01 177.61 1m7t n LYS 48 N -2.82 0.63 -3.18 2.33 4.81 0.70 -4.69 118.16 115.94 1m7t n LYS 48 Ca -0.02 0.02 -0.45 0.00 -0.87 0.00 0.00 58.31 56.99 1m7t n LYS 48 Cb 0.63 -1.70 -0.04 0.00 0.02 0.00 0.00 35.03 33.94 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 -3.29 3.20 -0.60 5.64 1.51 0.28 -4.91 117.35 119.19 1m7t s TYR 49 Ca -0.04 -1.26 -0.02 0.00 -1.01 0.00 0.00 57.07 54.73 1m7t s TYR 49 Cb 0.11 -3.96 0.31 0.00 -0.11 0.00 0.00 41.96 38.31 1m7t s TYR 49 CO 0.84 -1.20 2.16 0.45 -1.11 0.00 0.00 175.55 176.69 1m7t n SER 50 N 5.68 7.19 -0.07 2.29 2.88 -1.26 -3.92 113.62 126.40 1m7t n SER 50 Ca -0.03 -3.54 0.00 0.00 -1.33 0.00 0.00 58.87 53.96 1m7t n SER 50 Cb 0.43 -1.06 0.00 0.00 -0.75 0.00 0.00 64.21 62.83 1m7t n SER 50 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1m7t n ASN 51 N -0.25 0.00 -3.93 -3.46 2.85 -1.26 -5.14 115.26 104.08 1m7t n ASN 51 Ca 0.51 -1.03 -0.09 0.00 -0.11 0.00 0.00 54.58 53.87 1m7t n ASN 51 Cb 0.52 -0.01 -0.09 0.00 1.24 0.00 0.00 39.78 41.45 1m7t n ASN 51 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 1m7t s VAL 52 N 0.00 0.15 -0.30 3.44 -7.23 -1.25 -3.79 120.40 111.42 1m7t s VAL 52 Ca 0.00 -1.23 -0.08 0.00 -1.81 0.00 0.00 61.98 58.85 1m7t s VAL 52 Cb 0.00 -1.15 0.00 0.00 0.56 0.00 0.00 36.38 35.79 1m7t s VAL 52 CO 0.00 -0.68 0.12 -0.51 -0.31 0.00 0.00 175.10 173.71 1m7t s ILE 53 N -3.23 4.28 -0.33 -0.62 1.10 -0.03 -4.85 121.20 117.51 1m7t s ILE 53 Ca 0.00 -0.56 -0.14 0.00 -0.51 0.00 0.00 60.65 59.44 1m7t s ILE 53 Cb 0.02 -3.19 -0.02 0.00 0.15 0.00 0.00 42.46 39.42 1m7t s ILE 53 CO -0.07 0.07 0.33 -0.36 -2.11 0.00 0.00 174.94 172.80 1m7t s PHE 54 N 1.56 3.22 0.30 3.50 0.40 -1.26 -2.80 117.98 122.90 1m7t s PHE 54 Ca 0.04 -0.02 0.05 0.00 -0.60 0.00 0.00 56.93 56.39 1m7t s PHE 54 Cb -0.17 -2.61 -0.06 0.00 0.51 0.00 0.00 43.02 40.69 1m7t s PHE 54 CO 0.04 -0.39 0.02 -0.48 0.70 0.00 0.00 175.22 175.11 1m7t s LEU 55 N 1.95 2.28 -0.17 -0.37 0.05 -1.22 -3.69 118.68 117.51 1m7t s LEU 55 Ca 0.11 -1.31 0.01 0.00 0.05 0.00 0.00 54.13 52.99 1m7t s LEU 55 Cb -0.17 -0.45 0.02 0.00 -2.05 0.00 0.00 46.19 43.54 1m7t s LEU 55 CO 0.11 -0.52 -0.20 -0.70 -0.55 0.00 0.00 176.35 174.49 1m7t s GLU 56 N -3.84 3.02 -0.19 1.48 2.56 -1.17 -3.63 118.70 116.92 1m7t s GLU 56 Ca 0.33 -0.83 0.00 0.00 0.00 0.00 0.00 54.97 54.48 1m7t s GLU 56 Cb 0.07 -2.55 0.02 0.00 2.00 0.00 0.00 34.13 33.67 1m7t s GLU 56 CO 0.14 -0.15 -0.17 0.08 -0.56 0.00 0.00 175.26 174.59 1m7t s VAL 57 N 1.16 2.24 -0.27 3.70 1.01 -1.01 -0.53 120.40 126.71 1m7t s VAL 57 Ca 0.02 -0.94 -0.12 0.00 0.00 0.00 0.00 61.98 60.93 1m7t s VAL 57 Cb -0.14 -1.99 -0.05 0.00 0.00 0.00 0.00 36.38 34.21 1m7t s VAL 57 CO -0.09 0.47 0.23 -0.62 0.00 0.00 0.00 175.10 175.09 1m7t s ASP 58 N 1.30 6.09 0.63 3.32 2.15 -1.26 -2.59 116.67 126.32 1m7t s ASP 58 Ca 0.04 0.08 0.41 0.00 0.43 0.00 0.00 52.55 53.51 1m7t s ASP 58 Cb -0.14 -2.14 2.23 0.00 -0.30 0.00 0.00 42.92 42.57 1m7t s ASP 58 CO -0.11 -0.06 2.26 1.62 -0.17 0.00 0.00 175.17 178.70 1m7t h VAL 59 N 5.32 0.00 -0.79 1.11 3.04 -1.75 0.76 116.25 123.93 1m7t h VAL 59 Ca -0.35 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.30 1m7t h VAL 59 Cb 1.18 0.91 -0.04 0.00 -2.01 0.00 0.00 31.29 31.34 1m7t h VAL 59 CO 0.59 0.00 0.32 -0.78 -1.01 0.00 0.00 177.57 176.69 1m7t h ASP 60 N 0.00 1.09 0.04 3.17 3.58 -1.93 -1.73 116.42 120.64 1m7t h ASP 60 Ca 0.00 -0.17 -0.38 0.00 0.42 0.00 0.00 57.03 56.91 1m7t h ASP 60 Cb 0.06 -0.28 -0.07 0.00 1.72 0.00 0.00 39.33 40.77 1m7t h ASP 60 CO 0.00 0.96 -2.37 0.47 -2.88 0.00 0.00 179.24 175.42 1m7t n ASP 61 N -4.29 1.19 -2.47 2.28 8.00 -0.40 -4.41 116.55 116.45 1m7t n ASP 61 Ca 0.07 -0.03 -0.31 0.00 0.71 0.00 0.00 54.79 55.23 1m7t n ASP 61 Cb 0.18 0.11 0.02 0.00 -0.02 0.00 0.00 41.12 41.40 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 -3.01 6.21 0.56 2.24 0.00 0.25 -4.21 120.51 122.54 1m7t n ALA 62 Ca -0.39 -3.19 0.09 0.00 0.00 0.00 0.00 53.44 49.95 1m7t n ALA 62 Cb 1.06 -1.88 0.40 0.00 0.00 0.00 0.00 19.45 19.03 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 -0.02 0.05 0.05 0.00 7.27 -0.65 -2.61 117.38 121.47 1m7t n GLN 63 Ca 0.50 0.25 0.09 0.00 0.07 0.00 0.00 57.00 57.90 1m7t n GLN 63 Cb 0.49 -1.59 -0.07 0.00 2.41 0.00 0.00 30.24 31.47 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 -1.69 0.54 0.01 1.69 9.92 -1.26 -4.16 116.55 121.60 1m7t n ASP 64 Ca 0.04 0.22 -0.18 0.00 -0.53 0.00 0.00 54.79 54.34 1m7t n ASP 64 Cb 0.22 0.93 -0.14 0.00 -0.64 0.00 0.00 41.12 41.49 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 1.62 -0.03 2.53 -1.51 -1.85 -3.29 116.25 113.71 1m7t h VAL 65 Ca -0.05 -2.47 0.03 0.00 -1.23 0.00 0.00 66.70 62.98 1m7t h VAL 65 Cb 1.14 3.27 -0.06 0.00 -2.13 0.00 0.00 31.29 33.51 1m7t h VAL 65 CO 0.01 0.68 -0.45 0.00 -1.23 0.00 0.00 177.57 176.58 1m7t h ALA 66 N 0.05 -0.72 -0.63 5.19 0.00 -1.73 -0.62 119.26 120.79 1m7t h ALA 66 Ca -0.09 -0.05 0.18 0.00 0.00 0.00 0.00 54.91 54.96 1m7t h ALA 66 Cb 1.41 0.81 -0.03 0.00 0.00 0.00 0.00 17.79 19.99 1m7t h ALA 66 CO 0.10 -0.99 0.50 -1.35 0.00 0.00 0.00 179.25 177.51 1m7t h PRO 67 N -0.58 0.00 0.00 0.00 0.11 -1.73 0.84 132.00 130.64 1m7t h PRO 67 Ca 0.05 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.06 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 -0.35 0.00 -0.46 0.87 -0.21 0.00 0.00 178.00 177.85 1m7t h LYS 68 N 0.00 0.00 -0.02 1.05 1.57 -1.22 -3.21 116.57 114.74 1m7t h LYS 68 Ca 0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 1m7t h LYS 68 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 1m7t h LYS 68 CO -0.00 0.46 -0.17 0.66 -0.57 0.00 0.00 179.45 179.83 1m7t n TYR 69 N -3.36 0.00 -2.88 -1.35 4.01 0.23 -5.00 117.16 108.81 1m7t n TYR 69 Ca 0.01 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.59 1m7t n TYR 69 Cb 0.64 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.70 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 1.05 -0.15 3.73 2.72 0.00 0.20 -4.98 105.19 107.75 1m7t n GLY 70 Ca 0.08 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.03 4.24 -0.39 -0.61 1.01 -1.05 -4.96 121.20 116.41 1m7t s ILE 71 Ca 0.25 1.82 0.11 0.00 0.00 0.00 0.00 60.65 62.83 1m7t s ILE 71 Cb -0.11 -4.16 0.38 0.00 0.01 0.00 0.00 42.46 38.58 1m7t s ILE 71 CO 0.31 0.26 1.07 -1.14 0.00 0.00 0.00 174.94 175.44 1m7t n ARG 72 N 2.90 1.09 0.00 2.79 3.00 -1.26 -4.79 116.66 120.39 1m7t n ARG 72 Ca 0.04 -2.54 0.00 0.00 -0.00 0.00 0.00 57.85 55.35 1m7t n ARG 72 Cb 0.48 -0.93 0.00 0.00 0.00 0.00 0.00 32.46 32.01 1m7t n ARG 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1m7t n GLY 73 N -0.05 0.04 3.86 5.14 0.00 -1.26 -5.15 105.19 107.77 1m7t n GLY 73 Ca 0.08 0.71 -0.27 0.00 0.00 0.00 0.00 46.02 46.54 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 4.88 -0.34 -0.61 -4.36 -1.26 -3.07 121.20 116.45 1m7t s ILE 74 Ca 0.00 -0.83 -0.29 0.00 -0.26 0.00 0.00 60.65 59.27 1m7t s ILE 74 Cb 0.00 -3.48 0.01 0.00 1.25 0.00 0.00 42.46 40.25 1m7t s ILE 74 CO 0.00 -0.05 1.17 -2.16 0.24 0.00 0.00 174.94 174.14 1m7t s PRO 75 N -3.01 3.95 0.03 0.37 0.04 -1.26 -4.61 135.00 130.51 1m7t s PRO 75 Ca 0.32 1.05 -0.21 0.00 0.04 0.00 0.00 61.00 62.21 1m7t s PRO 75 Cb -0.11 -3.82 -0.06 0.00 0.04 0.00 0.00 34.50 30.55 1m7t s PRO 75 CO 0.26 -1.07 0.61 0.99 0.04 0.00 0.00 177.00 177.83 1m7t s THR 76 N 4.08 4.81 -0.24 1.26 2.01 -0.98 -1.70 115.64 124.88 1m7t s THR 76 Ca 0.50 1.30 -0.07 0.00 0.31 0.00 0.00 61.69 63.73 1m7t s THR 76 Cb -0.13 -3.95 -0.03 0.00 0.01 0.00 0.00 72.50 68.40 1m7t s THR 76 CO 0.21 0.46 0.05 -0.76 -0.69 0.00 0.00 174.62 173.89 1m7t s LEU 77 N -0.51 3.37 -0.09 4.42 1.02 0.29 0.86 118.68 128.03 1m7t s LEU 77 Ca 0.31 -0.21 0.01 0.00 0.02 0.00 0.00 54.13 54.26 1m7t s LEU 77 Cb -0.19 -1.89 -0.02 0.00 0.02 0.00 0.00 46.19 44.10 1m7t s LEU 77 CO 0.19 -0.01 -0.10 -0.76 0.02 0.00 0.00 176.35 175.68 1m7t s LEU 78 N 1.47 2.92 -0.14 1.79 1.43 0.50 -0.58 118.68 126.06 1m7t s LEU 78 Ca 0.06 -0.18 0.01 0.00 -1.03 0.00 0.00 54.13 52.99 1m7t s LEU 78 Cb -0.15 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.43 1m7t s LEU 78 CO 0.03 0.27 -0.18 -0.76 0.23 0.00 0.00 176.35 175.94 1m7t s LEU 79 N -0.27 2.37 0.08 1.79 2.01 -0.52 0.76 118.68 124.89 1m7t s LEU 79 Ca 0.03 -0.50 0.08 0.00 0.01 0.00 0.00 54.13 53.75 1m7t s LEU 79 Cb -0.13 -1.52 -0.04 0.00 0.01 0.00 0.00 46.19 44.51 1m7t s LEU 79 CO 0.03 0.10 -0.20 -0.36 1.01 0.00 0.00 176.35 176.92 1m7t s PHE 80 N 0.73 2.49 -0.18 0.29 0.40 0.24 -1.32 117.98 120.63 1m7t s PHE 80 Ca -0.08 -0.29 -0.04 0.00 -0.60 0.00 0.00 56.93 55.92 1m7t s PHE 80 Cb -0.16 -1.39 0.09 0.00 0.51 0.00 0.00 43.02 42.07 1m7t s PHE 80 CO 0.01 0.29 0.30 0.21 0.70 0.00 0.00 175.22 176.73 1m7t s LYS 81 N -1.71 0.23 -1.34 0.44 2.20 0.26 -1.11 119.74 118.73 1m7t s LYS 81 Ca 0.15 0.61 -0.06 0.00 -0.36 0.00 0.00 55.97 56.32 1m7t s LYS 81 Cb -0.10 -0.36 0.02 0.00 -1.51 0.00 0.00 37.83 35.87 1m7t s LYS 81 CO 0.06 -0.45 1.02 0.09 -0.36 0.00 0.00 175.35 175.71 1m7t n ASN 82 N 5.35 -3.96 0.00 1.43 5.03 -0.97 -1.39 115.26 120.75 1m7t n ASN 82 Ca -0.06 -0.65 0.00 0.00 0.87 0.00 0.00 54.58 54.74 1m7t n ASN 82 Cb 0.50 -4.70 0.00 0.00 -1.02 0.00 0.00 39.78 34.56 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 -1.63 0.43 3.20 7.41 0.00 -1.26 -4.99 105.19 108.35 1m7t n GLY 83 Ca -0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.63 1.37 -0.12 1.61 2.12 -0.48 -5.10 118.70 117.47 1m7t s GLU 84 Ca 0.00 -0.77 -0.29 0.00 0.36 0.00 0.00 54.97 54.26 1m7t s GLU 84 Cb 0.00 -1.39 -0.04 0.00 0.26 0.00 0.00 34.13 32.96 1m7t s GLU 84 CO 0.00 0.37 1.52 0.08 -0.54 0.00 0.00 175.26 176.69 1m7t s VAL 85 N -0.62 3.82 -0.41 3.70 1.01 -1.26 0.93 120.40 127.57 1m7t s VAL 85 Ca 0.06 0.99 0.08 0.00 0.00 0.00 0.00 61.98 63.12 1m7t s VAL 85 Cb -0.08 -3.67 0.22 0.00 0.00 0.00 0.00 36.38 32.86 1m7t s VAL 85 CO 0.00 -0.12 1.17 0.00 0.00 0.00 0.00 175.10 176.15 1m7t n ALA 86 N 7.17 2.23 -3.65 5.51 0.00 -0.43 -4.90 120.51 126.44 1m7t n ALA 86 Ca 0.16 -1.40 -0.04 0.00 0.00 0.00 0.00 53.44 52.16 1m7t n ALA 86 Cb 0.44 -0.31 -0.07 0.00 0.00 0.00 0.00 19.45 19.51 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 -1.43 -2.19 -0.03 0.00 0.00 -1.21 -5.00 121.76 111.89 1m7t s ALA 87 Ca 0.18 1.77 0.01 0.00 0.00 0.00 0.00 51.96 53.93 1m7t s ALA 87 Cb 0.12 -1.70 0.01 0.00 0.00 0.00 0.00 23.12 21.55 1m7t s ALA 87 CO 0.08 -0.16 -0.05 -0.08 0.00 0.00 0.00 175.76 175.55 1m7t s THR 88 N 0.20 0.53 -0.01 0.00 -1.32 -1.26 -1.45 115.64 112.34 1m7t s THR 88 Ca 0.05 -0.18 0.02 0.00 -1.21 0.00 0.00 61.69 60.37 1m7t s THR 88 Cb -0.05 -0.52 -0.00 0.00 -1.51 0.00 0.00 72.50 70.42 1m7t s THR 88 CO -0.13 0.20 -0.07 -0.75 -2.21 0.00 0.00 174.62 171.66 1m7t s LYS 89 N 0.54 0.57 0.07 7.08 2.36 0.25 -5.00 119.74 125.61 1m7t s LYS 89 Ca -0.07 -0.24 0.08 0.00 -2.55 0.00 0.00 55.97 53.19 1m7t s LYS 89 Cb -0.11 -0.56 -0.03 0.00 -1.05 0.00 0.00 37.83 36.09 1m7t s LYS 89 CO 0.00 0.14 -0.23 0.08 1.55 0.00 0.00 175.35 176.89 1m7t s VAL 90 N -0.12 1.88 0.00 4.02 1.01 -1.26 0.10 120.40 126.04 1m7t s VAL 90 Ca 0.02 -1.39 0.00 0.00 0.00 0.00 0.00 61.98 60.61 1m7t s VAL 90 Cb -0.03 -1.65 0.00 0.00 0.00 0.00 0.00 36.38 34.70 1m7t s VAL 90 CO -0.00 0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.90 1m7t n GLY 91 N 1.57 -2.20 3.73 4.51 0.00 -0.69 -4.90 105.19 107.22 1m7t n GLY 91 Ca -0.18 -1.49 -0.41 0.00 0.00 0.00 0.00 46.02 43.94 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 -2.76 3.53 0.30 4.61 0.00 -1.26 -4.68 121.76 121.50 1m7t s ALA 92 Ca 0.00 1.11 0.01 0.00 0.00 0.00 0.00 51.96 53.08 1m7t s ALA 92 Cb 0.00 -3.49 0.01 0.00 0.00 0.00 0.00 23.12 19.64 1m7t s ALA 92 CO 0.00 -0.55 0.09 1.47 0.00 0.00 0.00 175.76 176.77 1m7t n LEU 93 N 2.86 0.00 -4.75 0.00 -0.00 -1.26 -5.10 117.00 108.75 1m7t n LEU 93 Ca 0.07 -1.73 -0.22 0.00 -0.00 0.00 0.00 56.01 54.12 1m7t n LEU 93 Cb 0.43 0.12 -0.06 0.00 -0.00 0.00 0.00 43.42 43.91 1m7t n LEU 93 CO 0.58 -0.33 -0.21 -0.55 -0.00 0.00 0.00 177.39 176.89 1m7t s SER 94 N -2.68 4.93 0.35 1.45 0.15 -1.26 -4.95 113.70 111.69 1m7t s SER 94 Ca 0.07 -0.58 0.10 0.00 0.70 0.00 0.00 55.95 56.24 1m7t s SER 94 Cb -0.01 -0.94 0.85 0.00 -1.71 0.00 0.00 66.02 64.21 1m7t s SER 94 CO 0.04 -0.17 1.83 0.50 1.20 0.00 0.00 173.24 176.64 1m7t h LYS 95 N 1.57 0.64 0.00 5.44 3.64 -1.99 0.25 116.57 126.12 1m7t h LYS 95 Ca -0.45 -0.04 -0.17 0.00 -1.27 0.00 0.00 60.65 58.72 1m7t h LYS 95 Cb 1.25 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.90 1m7t h LYS 95 CO 0.61 0.42 -0.82 0.78 -2.27 0.00 0.00 179.45 178.18 1m7t h GLY 96 N 0.66 0.00 1.75 5.01 0.00 -1.99 -2.46 103.07 106.04 1m7t h GLY 96 Ca 0.51 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.62 1m7t h GLY 96 CO -0.27 0.00 -0.97 1.46 0.00 0.00 0.00 176.54 176.77 1m7t h GLN 97 N 0.00 0.21 0.04 4.80 4.20 -1.38 -1.96 115.11 121.02 1m7t h GLN 97 Ca -0.01 -0.27 -0.00 0.00 0.06 0.00 0.00 58.65 58.43 1m7t h GLN 97 Cb 1.51 0.08 0.00 0.00 0.30 0.00 0.00 27.48 29.37 1m7t h GLN 97 CO 0.11 1.03 -0.02 1.25 -0.67 0.00 0.00 178.83 180.52 1m7t h LEU 98 N 0.10 -0.05 -0.79 1.46 6.46 -0.64 -2.39 115.31 119.47 1m7t h LEU 98 Ca -0.06 -0.48 0.02 0.00 -0.12 0.00 0.00 57.88 57.23 1m7t h LEU 98 Cb 1.63 0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 41.53 1m7t h LEU 98 CO 0.15 0.48 0.51 0.50 -0.62 0.00 0.00 178.44 179.46 1m7t h LYS 99 N -0.59 1.00 -0.69 1.25 3.64 -1.52 -1.27 116.57 118.39 1m7t h LYS 99 Ca -0.01 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.28 1m7t h LYS 99 Cb 0.53 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 32.09 1m7t h LYS 99 CO 0.01 0.66 0.30 1.05 -2.27 0.00 0.00 179.45 179.19 1m7t h GLU 100 N 1.03 1.00 -0.55 1.90 -0.00 -1.39 0.88 114.58 117.45 1m7t h GLU 100 Ca 0.30 -0.16 -0.04 0.00 -0.00 0.00 0.00 59.36 59.47 1m7t h GLU 100 Cb -0.05 -0.18 -0.02 0.00 -0.00 0.00 0.00 28.75 28.50 1m7t h GLU 100 CO -0.09 0.80 0.19 0.35 -0.00 0.00 0.00 179.01 180.26 1m7t h PHE 101 N 0.99 0.87 0.58 2.06 3.57 -0.84 -0.86 116.94 123.31 1m7t h PHE 101 Ca 0.24 -0.08 -0.03 0.00 3.53 0.00 0.00 57.97 61.63 1m7t h PHE 101 Cb 0.16 -0.25 0.01 0.00 2.79 0.00 0.00 35.95 38.65 1m7t h PHE 101 CO 0.01 0.73 -0.28 -0.07 -2.23 0.00 0.00 178.31 176.47 1m7t h LEU 102 N 0.76 -0.66 -1.57 0.59 3.38 -0.68 -2.15 115.31 114.97 1m7t h LEU 102 Ca 0.18 0.02 0.29 0.00 0.09 0.00 0.00 57.88 58.46 1m7t h LEU 102 Cb 0.25 0.17 -0.08 0.00 0.09 0.00 0.00 40.66 41.10 1m7t h LEU 102 CO -0.01 -0.38 0.71 -0.78 0.09 0.00 0.00 178.44 178.07 1m7t h ASP 103 N -0.96 0.30 1.30 -0.43 3.58 -0.86 1.36 116.42 120.70 1m7t h ASP 103 Ca -0.08 0.06 -0.00 0.00 0.42 0.00 0.00 57.03 57.42 1m7t h ASP 103 Cb 0.60 0.01 -0.00 0.00 1.72 0.00 0.00 39.33 41.66 1m7t h ASP 103 CO 0.13 0.05 -0.02 0.00 -2.88 0.00 0.00 179.24 176.52 1m7t h ALA 104 N 1.56 1.00 0.00 -0.78 0.00 -1.00 -3.32 119.26 116.72 1m7t h ALA 104 Ca 0.58 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 55.25 1m7t h ALA 104 Cb 1.72 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.47 1m7t h ALA 104 CO -0.20 0.03 -1.81 -1.71 0.00 0.00 0.00 179.25 175.56 1m7t n ASN 105 N -3.11 2.77 -4.59 0.00 5.15 0.25 -4.94 115.26 110.78 1m7t n ASN 105 Ca 0.02 -0.06 -0.41 0.00 -0.60 0.00 0.00 54.58 53.52 1m7t n ASN 105 Cb 0.38 -0.04 -0.03 0.00 -0.53 0.00 0.00 39.78 39.57 1m7t n ASN 105 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1m7t s LEU 106 N -5.64 3.43 0.00 1.20 0.20 0.40 -5.07 118.68 113.19 1m7t s LEU 106 Ca -0.17 1.61 0.00 0.00 0.69 0.00 0.00 54.13 56.26 1m7t s LEU 106 Cb 0.05 -3.23 0.00 0.00 -0.43 0.00 0.00 46.19 42.57 1m7t s LEU 106 CO 0.35 -2.20 0.00 1.33 -0.29 0.00 0.00 176.35 175.54