#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 4.64 -0.11 2.03 1.01 -1.24 -4.55 120.40 122.18 1m7t s VAL 2 Ca 0.00 1.16 -0.04 0.00 0.00 0.00 0.00 61.98 63.10 1m7t s VAL 2 Cb 0.00 -3.82 0.05 0.00 0.00 0.00 0.00 36.38 32.62 1m7t s VAL 2 CO 0.00 0.20 0.22 -1.59 0.00 0.00 0.00 175.10 173.92 1m7t s LYS 3 N -2.02 0.11 0.06 2.72 -2.85 -1.25 -5.01 119.74 111.51 1m7t s LYS 3 Ca 0.42 0.63 -0.31 0.00 -1.00 0.00 0.00 55.97 55.72 1m7t s LYS 3 Cb -0.16 -0.14 -0.06 0.00 -2.06 0.00 0.00 37.83 35.42 1m7t s LYS 3 CO 0.20 -0.27 1.20 -1.14 0.10 0.00 0.00 175.35 175.45 1m7t s GLN 4 N 2.14 4.43 -0.41 1.78 0.74 -1.26 -3.02 119.66 124.07 1m7t s GLN 4 Ca -0.00 1.78 -0.12 0.00 0.05 0.00 0.00 55.36 57.06 1m7t s GLN 4 Cb -0.12 -3.34 0.04 0.00 1.10 0.00 0.00 33.01 30.69 1m7t s GLN 4 CO -0.07 -0.26 0.27 0.42 -0.55 0.00 0.00 175.29 175.09 1m7t s ILE 5 N 1.05 4.80 -0.28 -2.34 1.09 0.65 -4.93 121.20 121.23 1m7t s ILE 5 Ca 0.59 -0.92 0.14 0.00 -1.10 0.00 0.00 60.65 59.36 1m7t s ILE 5 Cb -0.30 -3.74 0.81 0.00 -1.06 0.00 0.00 42.46 38.17 1m7t s ILE 5 CO 0.29 -0.35 1.74 -0.62 -0.10 0.00 0.00 174.94 175.90 1m7t n GLU 6 N 5.06 4.79 -3.58 2.79 1.02 -1.26 -3.82 120.64 125.63 1m7t n GLU 6 Ca -0.11 -3.15 -0.11 0.00 -0.02 0.00 0.00 57.16 53.77 1m7t n GLU 6 Cb 0.45 -2.24 -0.04 0.00 -0.02 0.00 0.00 31.44 29.60 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 -0.85 -0.32 0.33 1.62 0.01 -1.26 -4.42 113.70 108.81 1m7t s SER 7 Ca 0.54 -0.25 0.14 0.00 1.31 0.00 0.00 55.95 57.69 1m7t s SER 7 Cb 0.41 0.51 0.55 0.00 0.21 0.00 0.00 66.02 67.70 1m7t s SER 7 CO 0.16 -0.89 1.70 0.50 0.41 0.00 0.00 173.24 175.12 1m7t h LYS 8 N 2.27 0.00 0.01 12.44 3.11 -1.93 -2.99 116.57 129.49 1m7t h LYS 8 Ca -0.34 0.00 -0.21 0.00 -2.81 0.00 0.00 60.65 57.29 1m7t h LYS 8 Cb 1.27 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 32.47 1m7t h LYS 8 CO 0.44 0.48 -1.00 1.15 -2.81 0.00 0.00 179.45 177.72 1m7t h THR 9 N 0.00 1.68 -0.60 1.00 2.02 -1.99 -3.28 112.91 111.73 1m7t h THR 9 Ca -0.00 -3.30 -0.10 0.00 0.77 0.00 0.00 66.41 63.78 1m7t h THR 9 Cb 0.93 2.81 -0.02 0.00 -1.74 0.00 0.00 68.15 70.13 1m7t h THR 9 CO 0.06 0.95 -0.00 0.00 0.37 0.00 0.00 175.52 176.90 1m7t h ALA 10 N 0.98 0.86 -0.67 6.16 0.00 -1.93 -1.21 119.26 123.45 1m7t h ALA 10 Ca -0.02 -0.31 0.05 0.00 0.00 0.00 0.00 54.91 54.62 1m7t h ALA 10 Cb 1.75 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 19.27 1m7t h ALA 10 CO 0.14 0.66 0.39 0.35 0.00 0.00 0.00 179.25 180.79 1m7t h PHE 11 N 0.96 0.73 -0.39 0.00 3.57 -1.59 0.27 116.94 120.48 1m7t h PHE 11 Ca 0.17 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.64 1m7t h PHE 11 Cb 0.55 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 1m7t h PHE 11 CO 0.04 0.38 0.05 1.96 -2.23 0.00 0.00 178.31 178.51 1m7t h GLN 12 N 0.75 0.66 -0.44 1.11 1.08 -1.58 -1.55 115.11 115.14 1m7t h GLN 12 Ca 0.29 -0.18 0.03 0.00 -1.45 0.00 0.00 58.65 57.33 1m7t h GLN 12 Cb 0.11 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.43 1m7t h GLN 12 CO -0.15 0.72 0.24 0.93 -0.95 0.00 0.00 178.83 179.63 1m7t h GLU 13 N 0.50 0.47 -0.15 1.46 5.08 -0.25 -0.59 114.58 121.12 1m7t h GLU 13 Ca 0.12 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.38 1m7t h GLU 13 Cb 0.39 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1m7t h GLU 13 CO 0.01 0.31 -0.21 0.00 -1.00 0.00 0.00 179.01 178.12 1m7t h ALA 14 N 1.21 1.37 -0.42 3.43 0.00 -0.40 -2.62 119.26 121.83 1m7t h ALA 14 Ca 0.18 -0.27 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 1m7t h ALA 14 Cb 0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1m7t h ALA 14 CO -0.10 0.44 -0.25 -0.07 0.00 0.00 0.00 179.25 179.27 1m7t h LEU 15 N 0.23 0.89 -1.39 0.00 3.38 -0.43 -2.22 115.31 115.77 1m7t h LEU 15 Ca 0.04 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 1m7t h LEU 15 Cb 0.52 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1m7t h LEU 15 CO 0.03 1.09 0.28 0.44 0.09 0.00 0.00 178.44 180.37 1m7t h ASP 16 N 0.74 0.61 1.44 -0.43 3.32 -0.76 -0.33 116.42 121.01 1m7t h ASP 16 Ca 0.09 -0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.06 1m7t h ASP 16 Cb 0.79 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.18 1m7t h ASP 16 CO 0.07 0.49 -0.21 0.00 -1.72 0.00 0.00 179.24 177.87 1m7t h ALA 17 N 1.61 0.91 -0.28 3.45 0.00 -1.34 -3.16 119.26 120.45 1m7t h ALA 17 Ca 0.18 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1m7t h ALA 17 Cb 0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1m7t h ALA 17 CO -0.03 0.26 -0.16 0.00 0.00 0.00 0.00 179.25 179.31 1m7t h ALA 18 N 1.79 1.19 -0.81 0.00 0.00 -0.44 -3.47 119.26 117.53 1m7t h ALA 18 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1m7t h ALA 18 Cb 0.98 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1m7t h ALA 18 CO 0.03 0.52 0.00 0.41 0.00 0.00 0.00 179.25 180.20 1m7t n GLY 19 N -0.55 3.79 0.87 0.00 0.00 -1.12 -0.70 105.19 107.48 1m7t n GLY 19 Ca 0.00 0.10 0.10 0.00 0.00 0.00 0.00 46.02 46.23 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 6.49 2.59 -4.81 1.61 -0.08 -1.26 -3.83 116.55 117.26 1m7t n ASP 20 Ca 0.00 -1.89 -0.33 0.00 -1.51 0.00 0.00 54.79 51.05 1m7t n ASP 20 Cb 0.00 -0.22 -0.06 0.00 2.34 0.00 0.00 41.12 43.17 1m7t n ASP 20 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1m7t s LYS 21 N -1.55 4.18 0.11 -0.67 1.02 0.13 -4.88 119.74 118.08 1m7t s LYS 21 Ca 0.35 1.17 -0.30 0.00 0.02 0.00 0.00 55.97 57.21 1m7t s LYS 21 Cb 0.19 -2.19 -0.06 0.00 -0.52 0.00 0.00 37.83 35.25 1m7t s LYS 21 CO 0.27 -0.08 1.10 -1.17 -0.92 0.00 0.00 175.35 174.55 1m7t s LEU 22 N -3.18 4.44 -0.31 3.17 2.96 -1.26 -4.57 118.68 119.93 1m7t s LEU 22 Ca 0.62 1.98 -0.05 0.00 -0.22 0.00 0.00 54.13 56.47 1m7t s LEU 22 Cb -0.11 -3.59 0.04 0.00 0.50 0.00 0.00 46.19 43.03 1m7t s LEU 22 CO 0.15 -0.28 0.05 -0.69 -1.32 0.00 0.00 176.35 174.25 1m7t s VAL 23 N 0.33 3.49 -0.32 1.68 1.01 0.47 -0.88 120.40 126.18 1m7t s VAL 23 Ca 0.52 -1.11 -0.09 0.00 0.00 0.00 0.00 61.98 61.30 1m7t s VAL 23 Cb -0.28 -2.93 0.01 0.00 0.00 0.00 0.00 36.38 33.18 1m7t s VAL 23 CO 0.32 -0.07 0.14 0.54 0.00 0.00 0.00 175.10 176.03 1m7t s VAL 24 N 1.37 4.36 0.33 2.92 0.11 -0.99 1.00 120.40 129.50 1m7t s VAL 24 Ca -0.02 -0.63 0.06 0.00 -2.93 0.00 0.00 61.98 58.46 1m7t s VAL 24 Cb -0.19 -3.29 -0.06 0.00 -1.53 0.00 0.00 36.38 31.30 1m7t s VAL 24 CO 0.01 -0.01 -0.02 0.68 -3.33 0.00 0.00 175.10 172.43 1m7t s VAL 25 N 1.56 1.70 -0.03 2.04 -7.23 0.22 -3.10 120.40 115.56 1m7t s VAL 25 Ca 0.03 -2.08 0.02 0.00 -1.81 0.00 0.00 61.98 58.13 1m7t s VAL 25 Cb -0.18 -2.67 0.01 0.00 0.56 0.00 0.00 36.38 34.10 1m7t s VAL 25 CO 0.05 -0.16 -0.06 -0.62 -0.31 0.00 0.00 175.10 174.01 1m7t s ASP 26 N -3.53 0.91 -0.44 4.85 -1.08 -1.22 -0.10 116.67 116.05 1m7t s ASP 26 Ca 0.33 -0.13 -0.17 0.00 -0.52 0.00 0.00 52.55 52.05 1m7t s ASP 26 Cb 0.06 -0.30 0.03 0.00 -1.46 0.00 0.00 42.92 41.25 1m7t s ASP 26 CO 0.15 0.01 0.45 -0.36 0.52 0.00 0.00 175.17 175.94 1m7t s PHE 27 N 0.42 3.16 0.00 -5.34 0.40 0.27 -2.31 117.98 114.58 1m7t s PHE 27 Ca -0.05 -0.47 0.00 0.00 -0.60 0.00 0.00 56.93 55.80 1m7t s PHE 27 Cb -0.09 -3.00 0.00 0.00 0.51 0.00 0.00 43.02 40.43 1m7t s PHE 27 CO 0.00 -0.76 0.00 -1.13 0.70 0.00 0.00 175.22 174.04 1m7t n SER 28 N 5.61 1.57 -3.69 1.36 3.41 -0.99 -2.57 113.62 118.32 1m7t n SER 28 Ca -0.08 -0.94 -0.12 0.00 -0.26 0.00 0.00 58.87 57.46 1m7t n SER 28 Cb 0.47 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.35 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 -0.90 0.17 7.33 0.00 -1.26 -2.62 121.76 122.49 1m7t s ALA 29 Ca 0.00 0.21 -0.05 0.00 0.00 0.00 0.00 51.96 52.12 1m7t s ALA 29 Cb 0.00 0.34 0.06 0.00 0.00 0.00 0.00 23.12 23.52 1m7t s ALA 29 CO 0.00 -0.44 1.47 1.15 0.00 0.00 0.00 175.76 177.94 1m7t h THR 30 N 3.08 1.32 -0.28 0.00 2.02 -2.01 -2.86 112.91 114.17 1m7t h THR 30 Ca -0.31 -1.82 0.00 0.00 0.77 0.00 0.00 66.41 65.05 1m7t h THR 30 Cb 1.20 1.78 0.00 0.00 -1.74 0.00 0.00 68.15 69.40 1m7t h THR 30 CO 0.44 0.57 0.00 -2.67 0.37 0.00 0.00 175.52 174.23 1m7t n TRP 31 N -3.96 0.44 -3.22 3.16 4.27 -1.26 -4.91 117.44 111.96 1m7t n TRP 31 Ca -0.04 -0.21 -0.28 0.00 -3.89 0.00 0.00 57.50 53.09 1m7t n TRP 31 Cb 0.62 -0.03 -0.02 0.00 -1.36 0.00 0.00 31.31 30.51 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 -1.25 -0.28 0.34 0.00 0.00 -1.26 -4.63 105.19 98.11 1m7t n GLY 33 Ca -0.02 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.19 1m7t n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1m7t h PRO 34 N 0.00 0.00 -0.64 1.61 0.13 -1.97 -1.87 132.00 129.26 1m7t h PRO 34 Ca 0.00 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.16 1m7t h PRO 34 Cb 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 1m7t h PRO 34 CO 0.00 0.00 0.40 0.00 -0.23 0.00 0.00 178.00 178.17 1m7t h LYS 36 N 0.79 0.00 0.00 0.00 1.57 -1.59 -2.60 116.57 114.74 1m7t h LYS 36 Ca 0.25 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.99 1m7t h LYS 36 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1m7t h LYS 36 CO -0.10 0.01 -0.21 0.52 -0.57 0.00 0.00 179.45 179.10 1m7t h MET 37 N 0.00 0.00 0.00 3.15 2.86 -1.27 -2.97 114.93 116.70 1m7t h MET 37 Ca -0.00 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.53 1m7t h MET 37 Cb 0.43 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.07 1m7t h MET 37 CO 0.00 0.21 -0.98 0.82 1.06 0.00 0.00 176.91 178.02 1m7t h ILE 38 N 0.00 0.49 -0.32 -1.22 1.08 -1.42 -3.38 117.51 112.74 1m7t h ILE 38 Ca -0.00 -1.82 0.07 0.00 -0.39 0.00 0.00 64.86 62.72 1m7t h ILE 38 Cb 0.74 2.05 -0.08 0.00 -3.07 0.00 0.00 36.82 36.46 1m7t h ILE 38 CO 0.03 0.28 -0.24 0.50 -0.69 0.00 0.00 178.15 178.03 1m7t h LYS 39 N 0.00 -0.20 -0.50 2.37 3.64 -1.54 0.38 116.57 120.71 1m7t h LYS 39 Ca -0.08 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.41 1m7t h LYS 39 Cb 1.39 0.05 -0.08 0.00 -0.41 0.00 0.00 32.23 33.17 1m7t h LYS 39 CO 0.04 -0.13 0.06 -1.35 -2.27 0.00 0.00 179.45 175.79 1m7t h PRO 40 N -0.21 0.17 0.00 1.90 0.11 -1.73 -1.83 132.00 130.41 1m7t h PRO 40 Ca 0.16 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 66.11 1m7t h PRO 40 Cb 0.46 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.51 1m7t h PRO 40 CO -0.44 0.11 -0.72 0.74 -0.21 0.00 0.00 178.00 177.49 1m7t h PHE 41 N 0.18 0.00 -0.29 0.65 0.04 -1.67 -3.05 116.94 112.79 1m7t h PHE 41 Ca 0.26 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.99 1m7t h PHE 41 Cb 0.37 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.51 1m7t h PHE 41 CO -0.27 0.69 0.03 0.35 -0.60 0.00 0.00 178.31 178.51 1m7t h PHE 42 N 0.00 0.54 -0.44 -0.55 3.57 0.21 -2.45 116.94 117.82 1m7t h PHE 42 Ca -0.01 -0.08 -0.11 0.00 3.53 0.00 0.00 57.97 61.30 1m7t h PHE 42 Cb 1.54 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 40.12 1m7t h PHE 42 CO 0.00 0.61 -0.14 1.25 -2.23 0.00 0.00 178.31 177.80 1m7t h HIS 43 N 0.31 0.99 -0.50 0.41 2.76 -1.43 -2.88 115.15 114.80 1m7t h HIS 43 Ca 0.09 -0.22 0.01 0.00 -2.20 0.00 0.00 60.37 58.04 1m7t h HIS 43 Cb 0.38 -0.24 -0.03 0.00 1.55 0.00 0.00 27.41 29.07 1m7t h HIS 43 CO 0.03 0.99 0.33 1.03 -1.30 0.00 0.00 177.93 179.01 1m7t h SER 44 N 0.71 0.57 -0.91 3.26 0.87 -1.49 -2.29 113.55 114.27 1m7t h SER 44 Ca 0.11 -0.01 0.03 0.00 -1.23 0.00 0.00 61.79 60.69 1m7t h SER 44 Cb 0.69 -0.14 -0.05 0.00 -0.44 0.00 0.00 62.40 62.46 1m7t h SER 44 CO 0.05 0.41 0.59 -0.07 -0.53 0.00 0.00 176.83 177.28 1m7t h LEU 45 N 0.67 0.98 -2.13 2.23 3.38 -1.41 -0.37 115.31 118.66 1m7t h LEU 45 Ca 0.19 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.23 1m7t h LEU 45 Cb -0.06 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 1m7t h LEU 45 CO -0.05 0.68 0.28 0.28 0.09 0.00 0.00 178.44 179.72 1m7t h SER 46 N 1.15 0.00 1.20 -0.43 0.02 -1.19 0.35 113.55 114.65 1m7t h SER 46 Ca 0.36 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.29 1m7t h SER 46 Cb -0.01 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.53 1m7t h SER 46 CO -0.12 0.00 -0.81 -0.08 -1.14 0.00 0.00 176.83 174.69 1m7t h GLU 47 N 0.00 0.00 0.00 3.45 4.81 -0.92 -3.32 114.58 118.60 1m7t h GLU 47 Ca 0.13 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1m7t h GLU 47 Cb 0.68 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.06 1m7t h GLU 47 CO -0.00 0.05 -1.50 1.17 -0.73 0.00 0.00 179.01 178.00 1m7t n LYS 48 N -2.82 0.60 -3.30 1.92 4.81 0.27 -4.70 118.16 114.95 1m7t n LYS 48 Ca -0.00 -0.05 -0.47 0.00 -0.87 0.00 0.00 58.31 56.93 1m7t n LYS 48 Cb 0.58 -1.65 -0.03 0.00 0.02 0.00 0.00 35.03 33.95 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 -3.43 3.62 -0.36 5.64 1.51 0.99 -4.93 117.35 120.39 1m7t s TYR 49 Ca -0.04 -1.80 -0.04 0.00 -1.01 0.00 0.00 57.07 54.18 1m7t s TYR 49 Cb 0.12 -3.85 0.01 0.00 -0.11 0.00 0.00 41.96 38.14 1m7t s TYR 49 CO 0.85 -1.03 2.86 0.45 -1.11 0.00 0.00 175.55 177.57 1m7t n SER 50 N 4.41 6.24 0.00 2.29 2.88 -1.26 -3.81 113.62 124.37 1m7t n SER 50 Ca 0.09 -3.06 0.00 0.00 -1.33 0.00 0.00 58.87 54.57 1m7t n SER 50 Cb 0.46 -1.25 0.00 0.00 -0.75 0.00 0.00 64.21 62.67 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 1.13 0.00 -4.91 -3.46 5.15 -1.26 -5.13 115.26 106.77 1m7t n ASN 51 Ca 0.46 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 54.16 1m7t n ASN 51 Cb 0.62 0.04 -0.03 0.00 -0.53 0.00 0.00 39.78 39.88 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 -1.12 5.06 -0.32 3.44 -7.23 -1.25 -4.26 120.40 114.72 1m7t s VAL 52 Ca 0.00 -0.05 -0.09 0.00 -1.81 0.00 0.00 61.98 60.03 1m7t s VAL 52 Cb 0.00 -3.74 0.00 0.00 0.56 0.00 0.00 36.38 33.21 1m7t s VAL 52 CO 0.00 -0.30 0.14 -0.51 -0.31 0.00 0.00 175.10 174.12 1m7t s ILE 53 N -2.05 4.42 -0.34 -0.62 1.10 -0.06 -4.83 121.20 118.82 1m7t s ILE 53 Ca 0.43 -0.58 -0.16 0.00 -0.51 0.00 0.00 60.65 59.83 1m7t s ILE 53 Cb -0.11 -3.30 -0.01 0.00 0.15 0.00 0.00 42.46 39.19 1m7t s ILE 53 CO 0.30 0.01 0.39 -0.36 -2.11 0.00 0.00 174.94 173.17 1m7t s PHE 54 N 1.57 3.21 0.28 3.50 0.40 -1.26 -2.34 117.98 123.34 1m7t s PHE 54 Ca 0.03 0.06 0.04 0.00 -0.60 0.00 0.00 56.93 56.46 1m7t s PHE 54 Cb -0.17 -2.70 -0.06 0.00 0.51 0.00 0.00 43.02 40.60 1m7t s PHE 54 CO 0.05 -0.43 0.01 -0.48 0.70 0.00 0.00 175.22 175.08 1m7t s LEU 55 N 2.08 2.24 -0.16 -0.37 0.05 -1.18 -3.68 118.68 117.67 1m7t s LEU 55 Ca 0.13 -1.28 0.02 0.00 0.05 0.00 0.00 54.13 53.05 1m7t s LEU 55 Cb -0.16 -0.39 0.02 0.00 -2.05 0.00 0.00 46.19 43.60 1m7t s LEU 55 CO 0.12 -0.51 -0.21 -0.70 -0.55 0.00 0.00 176.35 174.50 1m7t s GLU 56 N -3.85 3.01 -0.19 1.48 2.56 -1.17 -3.43 118.70 117.11 1m7t s GLU 56 Ca 0.32 -0.84 -0.01 0.00 0.00 0.00 0.00 54.97 54.45 1m7t s GLU 56 Cb 0.06 -2.52 0.01 0.00 2.00 0.00 0.00 34.13 33.68 1m7t s GLU 56 CO 0.12 -0.13 -0.14 0.08 -0.56 0.00 0.00 175.26 174.64 1m7t s VAL 57 N 1.09 2.58 -0.29 3.70 1.01 -0.98 -0.26 120.40 127.26 1m7t s VAL 57 Ca -0.00 -0.76 -0.11 0.00 0.00 0.00 0.00 61.98 61.10 1m7t s VAL 57 Cb -0.14 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 1m7t s VAL 57 CO -0.08 0.49 0.19 1.51 0.00 0.00 0.00 175.10 177.22 1m7t s ASP 58 N 1.35 5.99 0.53 3.32 -4.77 -1.25 -2.33 116.67 119.51 1m7t s ASP 58 Ca 0.05 -0.08 0.36 0.00 -3.30 0.00 0.00 52.55 49.58 1m7t s ASP 58 Cb -0.14 -2.12 1.90 0.00 -1.09 0.00 0.00 42.92 41.48 1m7t s ASP 58 CO -0.09 -0.08 2.09 1.62 0.70 0.00 0.00 175.17 179.41 1m7t h VAL 59 N 5.39 0.00 -0.67 2.11 3.04 -1.75 0.88 116.25 125.25 1m7t h VAL 59 Ca -0.35 -0.04 -0.07 0.00 -1.01 0.00 0.00 66.70 65.24 1m7t h VAL 59 Cb 1.18 0.85 -0.03 0.00 -2.01 0.00 0.00 31.29 31.29 1m7t h VAL 59 CO 0.56 0.00 0.15 -0.78 -1.01 0.00 0.00 177.57 176.49 1m7t h ASP 60 N 0.00 1.02 0.00 3.17 1.82 -1.93 -2.05 116.42 118.46 1m7t h ASP 60 Ca 0.00 -0.22 -0.37 0.00 -0.39 0.00 0.00 57.03 56.05 1m7t h ASP 60 Cb 0.04 -0.27 -0.07 0.00 0.68 0.00 0.00 39.33 39.72 1m7t h ASP 60 CO 0.00 0.99 -2.38 0.47 -1.61 0.00 0.00 179.24 176.71 1m7t n ASP 61 N -4.23 0.89 -2.37 2.28 9.92 -0.57 -4.44 116.55 118.03 1m7t n ASP 61 Ca 0.05 -0.05 -0.30 0.00 -0.53 0.00 0.00 54.79 53.95 1m7t n ASP 61 Cb 0.26 0.45 0.04 0.00 -0.64 0.00 0.00 41.12 41.23 1m7t n ASP 61 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1m7t n ALA 62 N -2.93 6.10 0.54 2.24 0.00 0.30 -4.28 120.51 122.48 1m7t n ALA 62 Ca -0.37 -3.09 0.07 0.00 0.00 0.00 0.00 53.44 50.05 1m7t n ALA 62 Cb 1.08 -1.78 0.33 0.00 0.00 0.00 0.00 19.45 19.07 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 -0.24 0.02 0.01 0.00 -0.06 -0.77 -2.44 117.38 113.91 1m7t n GLN 63 Ca 0.51 0.23 0.05 0.00 -2.00 0.00 0.00 57.00 55.78 1m7t n GLN 63 Cb 0.53 -1.50 -0.11 0.00 -4.06 0.00 0.00 30.24 25.11 1m7t n GLN 63 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 1m7t n ASP 64 N -1.48 0.43 -0.02 1.69 8.00 -1.26 -4.16 116.55 119.75 1m7t n ASP 64 Ca 0.04 0.18 -0.16 0.00 0.71 0.00 0.00 54.79 55.56 1m7t n ASP 64 Cb 0.17 0.97 -0.12 0.00 -0.02 0.00 0.00 41.12 42.12 1m7t n ASP 64 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 1m7t h VAL 65 N 0.00 1.60 -0.09 2.53 -1.51 -1.84 -3.28 116.25 113.66 1m7t h VAL 65 Ca -0.13 -2.16 0.04 0.00 -1.23 0.00 0.00 66.70 63.21 1m7t h VAL 65 Cb 1.36 3.01 -0.06 0.00 -2.13 0.00 0.00 31.29 33.47 1m7t h VAL 65 CO 0.02 0.59 -0.45 0.00 -1.23 0.00 0.00 177.57 176.50 1m7t h ALA 66 N 0.16 -0.68 -0.73 5.19 0.00 -1.74 -0.19 119.26 121.28 1m7t h ALA 66 Ca -0.04 -0.03 0.21 0.00 0.00 0.00 0.00 54.91 55.05 1m7t h ALA 66 Cb 1.13 0.82 -0.03 0.00 0.00 0.00 0.00 17.79 19.71 1m7t h ALA 66 CO 0.06 -0.97 0.58 -1.35 0.00 0.00 0.00 179.25 177.57 1m7t h PRO 67 N -0.54 0.00 0.00 0.00 0.11 -1.72 1.12 132.00 130.96 1m7t h PRO 67 Ca 0.06 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.17 1m7t h PRO 67 Cb 0.65 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.76 1m7t h PRO 67 CO -0.38 0.00 -0.00 0.87 -0.21 0.00 0.00 178.00 178.28 1m7t h LYS 68 N 0.00 0.00 -0.01 1.05 1.57 -1.10 -3.19 116.57 114.89 1m7t h LYS 68 Ca 0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.12 1m7t h LYS 68 Cb 1.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.81 1m7t h LYS 68 CO -0.00 0.00 -0.21 0.66 -0.57 0.00 0.00 179.45 179.33 1m7t n TYR 69 N -3.10 0.00 -2.86 -1.35 4.01 0.33 -5.01 117.16 109.18 1m7t n TYR 69 Ca 0.03 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.61 1m7t n TYR 69 Cb 0.44 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.50 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 0.88 -0.16 3.74 2.72 0.00 0.17 -4.98 105.19 107.57 1m7t n GLY 70 Ca 0.04 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 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 3.90 -0.41 -0.61 1.01 -1.13 -4.98 121.20 115.96 1m7t s ILE 71 Ca 0.24 1.65 0.09 0.00 0.00 0.00 0.00 60.65 62.64 1m7t s ILE 71 Cb -0.11 -4.05 0.32 0.00 0.01 0.00 0.00 42.46 38.62 1m7t s ILE 71 CO 0.30 0.29 0.81 -1.14 0.00 0.00 0.00 174.94 175.20 1m7t n ARG 72 N 2.34 0.92 0.00 2.79 0.63 -1.26 -4.83 116.66 117.25 1m7t n ARG 72 Ca 0.02 -2.84 0.00 0.00 -0.92 0.00 0.00 57.85 54.12 1m7t n ARG 72 Cb 0.46 -1.43 0.00 0.00 0.45 0.00 0.00 32.46 31.94 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 0.62 1.00 3.09 5.14 0.00 -1.26 -5.14 105.19 108.64 1m7t n GLY 73 Ca 0.18 -0.70 -0.13 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.00 -0.01 -0.22 -0.61 -4.36 -1.26 -3.74 121.20 109.00 1m7t s ILE 74 Ca 0.00 0.04 -0.20 0.00 -0.26 0.00 0.00 60.65 60.23 1m7t s ILE 74 Cb 0.00 -0.33 -0.02 0.00 1.25 0.00 0.00 42.46 43.35 1m7t s ILE 74 CO 0.00 0.02 0.61 -2.16 0.24 0.00 0.00 174.94 173.64 1m7t s PRO 75 N 0.42 4.16 0.07 0.37 0.05 -1.26 -4.58 135.00 134.22 1m7t s PRO 75 Ca -0.02 0.55 -0.23 0.00 0.05 0.00 0.00 61.00 61.35 1m7t s PRO 75 Cb -0.04 -3.61 -0.06 0.00 0.05 0.00 0.00 34.50 30.84 1m7t s PRO 75 CO -0.02 -0.29 0.68 0.99 0.05 0.00 0.00 177.00 178.41 1m7t s THR 76 N 2.10 4.69 -0.21 1.26 2.01 -1.06 -1.72 115.64 122.71 1m7t s THR 76 Ca 0.27 1.47 -0.05 0.00 0.31 0.00 0.00 61.69 63.68 1m7t s THR 76 Cb -0.16 -4.03 -0.02 0.00 0.01 0.00 0.00 72.50 68.30 1m7t s THR 76 CO 0.09 0.45 0.00 -0.22 -0.69 0.00 0.00 174.62 174.26 1m7t s LEU 77 N -0.56 3.20 -0.07 4.42 2.96 0.32 0.94 118.68 129.90 1m7t s LEU 77 Ca 0.34 -0.25 0.03 0.00 -0.22 0.00 0.00 54.13 54.03 1m7t s LEU 77 Cb -0.20 -1.82 -0.02 0.00 0.50 0.00 0.00 46.19 44.65 1m7t s LEU 77 CO 0.21 0.03 -0.16 -0.76 -1.32 0.00 0.00 176.35 174.36 1m7t s LEU 78 N 1.22 2.63 -0.17 -0.68 1.43 0.85 -0.28 118.68 123.68 1m7t s LEU 78 Ca 0.03 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 52.86 1m7t s LEU 78 Cb -0.15 -1.54 0.01 0.00 0.03 0.00 0.00 46.19 44.54 1m7t s LEU 78 CO 0.01 0.28 -0.16 -0.76 0.23 0.00 0.00 176.35 175.95 1m7t s LEU 79 N -0.34 2.37 0.07 1.79 2.01 -0.27 0.69 118.68 125.01 1m7t s LEU 79 Ca 0.03 -0.53 0.07 0.00 0.01 0.00 0.00 54.13 53.71 1m7t s LEU 79 Cb -0.13 -1.54 -0.04 0.00 0.01 0.00 0.00 46.19 44.50 1m7t s LEU 79 CO 0.02 0.05 -0.16 -0.36 1.01 0.00 0.00 176.35 176.91 1m7t s PHE 80 N 1.02 2.60 -0.20 0.29 0.40 0.28 -0.92 117.98 121.45 1m7t s PHE 80 Ca -0.02 -0.23 -0.04 0.00 -0.60 0.00 0.00 56.93 56.05 1m7t s PHE 80 Cb -0.15 -1.43 0.09 0.00 0.51 0.00 0.00 43.02 42.05 1m7t s PHE 80 CO -0.04 0.34 0.25 0.21 0.70 0.00 0.00 175.22 176.68 1m7t s LYS 81 N -1.81 0.21 -1.22 0.44 2.20 0.24 -0.40 119.74 119.41 1m7t s LYS 81 Ca 0.17 0.35 -0.03 0.00 -0.36 0.00 0.00 55.97 56.10 1m7t s LYS 81 Cb -0.11 -0.88 0.00 0.00 -1.51 0.00 0.00 37.83 35.34 1m7t s LYS 81 CO 0.08 -0.59 1.03 0.09 -0.36 0.00 0.00 175.35 175.61 1m7t n ASN 82 N 5.33 -3.51 0.00 1.43 5.03 -1.25 -1.91 115.26 120.38 1m7t n ASN 82 Ca -0.05 -0.57 0.00 0.00 0.87 0.00 0.00 54.58 54.82 1m7t n ASN 82 Cb 0.50 -4.96 0.00 0.00 -1.02 0.00 0.00 39.78 34.29 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 -1.42 0.63 3.23 7.41 0.00 -1.26 -4.99 105.19 108.79 1m7t n GLY 83 Ca -0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.37 1.85 -0.11 1.61 2.12 -0.80 -5.09 118.70 117.90 1m7t s GLU 84 Ca 0.00 -0.77 -0.29 0.00 0.36 0.00 0.00 54.97 54.27 1m7t s GLU 84 Cb 0.00 -1.74 -0.05 0.00 0.26 0.00 0.00 34.13 32.61 1m7t s GLU 84 CO 0.00 0.43 1.66 0.08 -0.54 0.00 0.00 175.26 176.89 1m7t s VAL 85 N -0.41 3.60 -0.94 3.70 1.01 -1.26 0.83 120.40 126.94 1m7t s VAL 85 Ca 0.06 0.71 0.10 0.00 0.00 0.00 0.00 61.98 62.85 1m7t s VAL 85 Cb -0.09 -3.52 0.27 0.00 0.00 0.00 0.00 36.38 33.03 1m7t s VAL 85 CO 0.00 -0.13 1.19 0.00 0.00 0.00 0.00 175.10 176.16 1m7t n ALA 86 N 7.73 2.21 -3.63 5.51 0.00 -0.10 -4.89 120.51 127.34 1m7t n ALA 86 Ca 0.18 -1.07 -0.07 0.00 0.00 0.00 0.00 53.44 52.48 1m7t n ALA 86 Cb 0.44 -0.41 -0.07 0.00 0.00 0.00 0.00 19.45 19.41 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 -0.99 -2.06 -0.03 0.00 0.00 -1.14 -5.00 121.76 112.53 1m7t s ALA 87 Ca 0.21 1.78 0.00 0.00 0.00 0.00 0.00 51.96 53.95 1m7t s ALA 87 Cb 0.11 -1.47 0.03 0.00 0.00 0.00 0.00 23.12 21.79 1m7t s ALA 87 CO 0.15 -0.20 0.01 -0.08 0.00 0.00 0.00 175.76 175.63 1m7t s THR 88 N -0.08 0.18 -0.02 0.00 -1.32 -1.26 -1.12 115.64 112.02 1m7t s THR 88 Ca 0.04 0.12 0.04 0.00 -1.21 0.00 0.00 61.69 60.68 1m7t s THR 88 Cb -0.04 -0.29 -0.00 0.00 -1.51 0.00 0.00 72.50 70.65 1m7t s THR 88 CO -0.09 0.16 -0.12 -0.75 -2.21 0.00 0.00 174.62 171.61 1m7t s LYS 89 N 1.22 1.14 0.07 7.08 2.36 0.61 -5.01 119.74 127.20 1m7t s LYS 89 Ca -0.07 -0.44 0.09 0.00 -2.55 0.00 0.00 55.97 53.00 1m7t s LYS 89 Cb -0.13 -1.07 -0.03 0.00 -1.05 0.00 0.00 37.83 35.55 1m7t s LYS 89 CO -0.02 0.22 -0.25 0.08 1.55 0.00 0.00 175.35 176.94 1m7t s VAL 90 N -0.10 2.33 0.00 4.02 1.01 -1.26 0.12 120.40 126.52 1m7t s VAL 90 Ca 0.01 -1.46 0.00 0.00 0.00 0.00 0.00 61.98 60.54 1m7t s VAL 90 Cb -0.07 -1.96 0.00 0.00 0.00 0.00 0.00 36.38 34.35 1m7t s VAL 90 CO 0.00 0.27 0.00 0.61 0.00 0.00 0.00 175.10 175.99 1m7t n GLY 91 N 1.46 -2.27 3.59 4.51 0.00 -0.70 -4.94 105.19 106.84 1m7t n GLY 91 Ca -0.17 -1.47 -0.29 0.00 0.00 0.00 0.00 46.02 44.09 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 -2.48 0.38 0.02 4.61 0.00 -1.26 -4.65 121.76 118.37 1m7t s ALA 92 Ca 0.00 -0.46 -0.01 0.00 0.00 0.00 0.00 51.96 51.49 1m7t s ALA 92 Cb 0.00 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 20.03 1m7t s ALA 92 CO 0.00 -3.37 0.05 1.47 0.00 0.00 0.00 175.76 173.92 1m7t n LEU 93 N -4.57 0.00 -4.79 0.00 -0.00 -1.26 -5.07 117.00 101.30 1m7t n LEU 93 Ca 0.06 -0.14 -0.22 0.00 -0.00 0.00 0.00 56.01 55.71 1m7t n LEU 93 Cb 0.57 0.22 -0.05 0.00 -0.00 0.00 0.00 43.42 44.16 1m7t n LEU 93 CO 0.55 -0.05 -0.13 -0.44 -0.00 0.00 0.00 177.39 177.32 1m7t s SER 94 N -1.13 4.88 0.45 1.45 0.01 -1.26 -4.98 113.70 113.12 1m7t s SER 94 Ca 0.01 -0.72 0.13 0.00 1.31 0.00 0.00 55.95 56.69 1m7t s SER 94 Cb -0.00 -0.75 1.06 0.00 0.21 0.00 0.00 66.02 66.53 1m7t s SER 94 CO 0.01 -0.39 2.03 0.50 0.41 0.00 0.00 173.24 175.80 1m7t h LYS 95 N 1.37 0.33 0.01 12.44 3.64 -1.99 -0.60 116.57 131.77 1m7t h LYS 95 Ca -0.44 -0.02 -0.19 0.00 -1.27 0.00 0.00 60.65 58.73 1m7t h LYS 95 Cb 1.25 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.98 1m7t h LYS 95 CO 0.62 0.22 -0.90 0.78 -2.27 0.00 0.00 179.45 177.90 1m7t h GLY 96 N 0.34 0.05 1.91 5.01 0.00 -1.98 -2.44 103.07 105.96 1m7t h GLY 96 Ca 0.19 -0.11 -0.19 0.00 0.00 0.00 0.00 47.33 47.22 1m7t h GLY 96 CO -0.04 0.09 -0.91 1.46 0.00 0.00 0.00 176.54 177.14 1m7t h GLN 97 N 0.02 0.08 0.06 4.80 4.20 -1.67 -0.40 115.11 122.20 1m7t h GLN 97 Ca -0.02 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.59 1m7t h GLN 97 Cb 1.57 0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.38 1m7t h GLN 97 CO 0.12 0.93 -0.03 1.25 -0.67 0.00 0.00 178.83 180.43 1m7t h LEU 98 N 0.04 -0.06 -0.44 1.46 6.46 -1.19 -1.69 115.31 119.88 1m7t h LEU 98 Ca -0.03 -0.51 -0.03 0.00 -0.12 0.00 0.00 57.88 57.20 1m7t h LEU 98 Cb 1.57 0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 41.50 1m7t h LEU 98 CO 0.13 0.50 0.17 0.50 -0.62 0.00 0.00 178.44 179.12 1m7t h LYS 99 N -0.66 0.67 -0.74 1.25 3.64 -1.51 -0.48 116.57 118.74 1m7t h LYS 99 Ca -0.01 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1m7t h LYS 99 Cb 0.57 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.24 1m7t h LYS 99 CO 0.01 0.63 0.46 1.05 -2.27 0.00 0.00 179.45 179.33 1m7t h GLU 100 N 0.58 1.00 -0.80 1.90 -0.00 -1.14 0.17 114.58 116.29 1m7t h GLU 100 Ca 0.15 -0.09 -0.03 0.00 -0.00 0.00 0.00 59.36 59.39 1m7t h GLU 100 Cb 0.21 -0.21 -0.04 0.00 -0.00 0.00 0.00 28.75 28.71 1m7t h GLU 100 CO -0.01 0.70 0.38 0.35 -0.00 0.00 0.00 179.01 180.44 1m7t h PHE 101 N 1.02 1.16 0.64 2.06 3.57 -1.04 -1.35 116.94 123.00 1m7t h PHE 101 Ca 0.27 -0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 1m7t h PHE 101 Cb -0.05 -0.36 0.01 0.00 2.79 0.00 0.00 35.95 38.34 1m7t h PHE 101 CO -0.01 0.85 -0.31 -0.07 -2.23 0.00 0.00 178.31 176.54 1m7t h LEU 102 N 1.14 -0.73 -1.80 0.59 3.38 -0.27 -2.50 115.31 115.12 1m7t h LEU 102 Ca 0.28 0.03 0.33 0.00 0.09 0.00 0.00 57.88 58.60 1m7t h LEU 102 Cb 0.12 0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 1m7t h LEU 102 CO -0.03 -0.44 0.80 -0.78 0.09 0.00 0.00 178.44 178.08 1m7t h ASP 103 N -1.02 0.13 0.85 -0.43 3.58 -0.65 1.56 116.42 120.44 1m7t h ASP 103 Ca -0.09 0.03 -0.06 0.00 0.42 0.00 0.00 57.03 57.33 1m7t h ASP 103 Cb 0.66 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.71 1m7t h ASP 103 CO 0.14 0.02 -0.27 0.00 -2.88 0.00 0.00 179.24 176.25 1m7t h ALA 104 N 1.47 1.03 0.00 -0.78 0.00 -0.99 -3.28 119.26 116.71 1m7t h ALA 104 Ca 0.58 -0.25 -0.19 0.00 0.00 0.00 0.00 54.91 55.05 1m7t h ALA 104 Cb 2.07 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 19.78 1m7t h ALA 104 CO -0.10 0.34 -1.79 -1.71 0.00 0.00 0.00 179.25 175.99 1m7t n ASN 105 N -3.47 2.07 -4.61 0.00 5.15 0.33 -4.94 115.26 109.80 1m7t n ASN 105 Ca -0.00 0.00 -0.43 0.00 -0.60 0.00 0.00 54.58 53.55 1m7t n ASN 105 Cb 0.45 0.87 -0.02 0.00 -0.53 0.00 0.00 39.78 40.55 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 -4.77 3.70 0.00 1.20 0.20 0.45 -5.04 118.68 114.42 1m7t s LEU 106 Ca -0.06 1.36 0.00 0.00 0.69 0.00 0.00 54.13 56.12 1m7t s LEU 106 Cb 0.04 -3.53 0.00 0.00 -0.43 0.00 0.00 46.19 42.27 1m7t s LEU 106 CO 0.49 -1.44 0.00 1.33 -0.29 0.00 0.00 176.35 176.44