#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 4.11 -0.08 2.03 1.01 -1.23 -4.12 120.40 122.13 1m7t s VAL 2 Ca 0.00 -1.01 -0.03 0.00 0.00 0.00 0.00 61.98 60.94 1m7t s VAL 2 Cb 0.00 -2.99 0.04 0.00 0.00 0.00 0.00 36.38 33.44 1m7t s VAL 2 CO 0.00 0.08 0.15 -1.59 0.00 0.00 0.00 175.10 173.74 1m7t s LYS 3 N -2.46 0.06 -0.18 2.72 -2.85 -1.23 -4.97 119.74 110.83 1m7t s LYS 3 Ca 0.27 0.48 -0.29 0.00 -1.00 0.00 0.00 55.97 55.42 1m7t s LYS 3 Cb -0.11 -0.23 -0.01 0.00 -2.06 0.00 0.00 37.83 35.42 1m7t s LYS 3 CO 0.19 -0.24 1.20 -1.14 0.10 0.00 0.00 175.35 175.46 1m7t s GLN 4 N 1.79 4.24 -0.35 1.78 0.74 -1.26 -2.90 119.66 123.70 1m7t s GLN 4 Ca -0.02 1.58 -0.12 0.00 0.05 0.00 0.00 55.36 56.85 1m7t s GLN 4 Cb -0.12 -3.73 -0.00 0.00 1.10 0.00 0.00 33.01 30.27 1m7t s GLN 4 CO -0.06 -0.68 0.23 0.42 -0.55 0.00 0.00 175.29 174.65 1m7t s ILE 5 N 3.37 5.03 -0.91 -2.34 1.09 -0.92 -4.93 121.20 121.60 1m7t s ILE 5 Ca 0.52 -0.44 0.17 0.00 -1.10 0.00 0.00 60.65 59.80 1m7t s ILE 5 Cb -0.20 -3.66 0.73 0.00 -1.06 0.00 0.00 42.46 38.27 1m7t s ILE 5 CO 0.13 -0.09 1.65 -0.62 -0.10 0.00 0.00 174.94 175.91 1m7t n GLU 6 N 5.08 3.96 -3.65 2.79 1.02 -1.26 -4.07 120.64 124.51 1m7t n GLU 6 Ca -0.12 -2.94 -0.10 0.00 -0.02 0.00 0.00 57.16 53.97 1m7t n GLU 6 Cb 0.48 -1.97 -0.05 0.00 -0.02 0.00 0.00 31.44 29.89 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 -0.93 -0.22 0.40 1.62 0.01 -1.26 -4.44 113.70 108.87 1m7t s SER 7 Ca 0.51 -0.34 0.22 0.00 1.31 0.00 0.00 55.95 57.65 1m7t s SER 7 Cb 0.35 0.47 0.58 0.00 0.21 0.00 0.00 66.02 67.63 1m7t s SER 7 CO 0.22 -0.86 1.68 0.50 0.41 0.00 0.00 173.24 175.19 1m7t h LYS 8 N 2.37 0.00 0.00 12.44 3.64 -1.93 -2.88 116.57 130.21 1m7t h LYS 8 Ca -0.34 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 58.84 1m7t h LYS 8 Cb 1.25 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.05 1m7t h LYS 8 CO 0.47 0.26 -0.97 1.15 -2.27 0.00 0.00 179.45 178.09 1m7t h THR 9 N 0.00 1.70 -0.39 1.00 2.02 -2.00 -3.21 112.91 112.03 1m7t h THR 9 Ca -0.00 -3.33 -0.11 0.00 0.77 0.00 0.00 66.41 63.74 1m7t h THR 9 Cb 0.98 2.80 -0.01 0.00 -1.74 0.00 0.00 68.15 70.17 1m7t h THR 9 CO 0.03 0.95 -0.21 0.00 0.37 0.00 0.00 175.52 176.67 1m7t h ALA 10 N 1.03 0.54 -0.22 6.16 0.00 -1.93 -1.92 119.26 122.92 1m7t h ALA 10 Ca -0.01 -0.37 0.04 0.00 0.00 0.00 0.00 54.91 54.57 1m7t h ALA 10 Cb 1.72 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.34 1m7t h ALA 10 CO 0.13 0.51 -0.00 0.35 0.00 0.00 0.00 179.25 180.23 1m7t h PHE 11 N 0.62 -0.02 -0.66 0.00 3.57 -1.56 0.39 116.94 119.29 1m7t h PHE 11 Ca 0.08 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 1m7t h PHE 11 Cb 0.76 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.51 1m7t h PHE 11 CO 0.06 -0.04 0.35 1.96 -2.23 0.00 0.00 178.31 178.41 1m7t h GLN 12 N 0.07 0.91 -0.49 1.11 1.08 -1.55 -0.72 115.11 115.52 1m7t h GLN 12 Ca 0.11 -0.10 -0.02 0.00 -1.45 0.00 0.00 58.65 57.19 1m7t h GLN 12 Cb 0.14 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.36 1m7t h GLN 12 CO -0.18 0.68 0.24 0.93 -0.95 0.00 0.00 178.83 179.56 1m7t h GLU 13 N 0.92 0.70 -0.08 1.46 5.08 -0.20 -1.91 114.58 120.55 1m7t h GLU 13 Ca 0.23 -0.10 -0.15 0.00 -1.00 0.00 0.00 59.36 58.34 1m7t h GLU 13 Cb 0.04 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1m7t h GLU 13 CO -0.04 0.58 -0.61 0.00 -1.00 0.00 0.00 179.01 177.94 1m7t h ALA 14 N 1.09 0.81 -0.67 3.43 0.00 0.19 -3.15 119.26 120.96 1m7t h ALA 14 Ca 0.17 -0.55 -0.07 0.00 0.00 0.00 0.00 54.91 54.47 1m7t h ALA 14 Cb 0.10 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1m7t h ALA 14 CO -0.02 0.73 0.17 -0.07 0.00 0.00 0.00 179.25 180.05 1m7t h LEU 15 N 0.20 1.02 -1.95 0.00 3.38 -0.91 -2.08 115.31 114.98 1m7t h LEU 15 Ca -0.01 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 1m7t h LEU 15 Cb 1.12 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.60 1m7t h LEU 15 CO 0.10 0.99 -0.05 0.44 0.09 0.00 0.00 178.44 180.01 1m7t h ASP 16 N 1.01 0.00 1.39 -0.43 3.32 -1.31 -0.45 116.42 119.94 1m7t h ASP 16 Ca 0.21 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.19 1m7t h ASP 16 Cb 0.37 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1m7t h ASP 16 CO 0.00 0.05 -0.33 0.00 -1.72 0.00 0.00 179.24 177.24 1m7t h ALA 17 N 1.95 0.84 0.00 3.45 0.00 -1.38 -3.16 119.26 120.96 1m7t h ALA 17 Ca -0.00 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 1m7t h ALA 17 Cb 0.08 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1m7t h ALA 17 CO 0.01 0.41 -0.42 0.00 0.00 0.00 0.00 179.25 179.25 1m7t h ALA 18 N 1.67 0.99 -0.60 0.00 0.00 -0.64 -3.47 119.26 117.20 1m7t h ALA 18 Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1m7t h ALA 18 Cb 1.11 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1m7t h ALA 18 CO 0.04 0.52 0.00 0.41 0.00 0.00 0.00 179.25 180.22 1m7t n GLY 19 N 0.25 3.02 1.09 0.00 0.00 -1.15 0.62 105.19 109.03 1m7t n GLY 19 Ca -0.00 0.29 0.09 0.00 0.00 0.00 0.00 46.02 46.40 1m7t n GLY 19 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1m7t n ASP 20 N 6.80 3.17 -4.84 1.61 9.92 -1.26 -4.00 116.55 127.95 1m7t n ASP 20 Ca 0.00 -2.03 -0.32 0.00 -0.53 0.00 0.00 54.79 51.91 1m7t n ASP 20 Cb 0.00 -0.40 -0.06 0.00 -0.64 0.00 0.00 41.12 40.02 1m7t n ASP 20 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1m7t s LYS 21 N -1.26 4.07 -0.15 -1.24 1.02 0.20 -4.88 119.74 117.50 1m7t s LYS 21 Ca 0.39 0.88 -0.29 0.00 0.02 0.00 0.00 55.97 56.97 1m7t s LYS 21 Cb 0.21 -2.28 -0.01 0.00 -0.52 0.00 0.00 37.83 35.23 1m7t s LYS 21 CO 0.26 -0.00 1.21 -1.17 -0.92 0.00 0.00 175.35 174.72 1m7t s LEU 22 N -3.31 4.19 -0.37 3.17 2.96 -1.26 -4.55 118.68 119.51 1m7t s LEU 22 Ca 0.58 1.66 -0.13 0.00 -0.22 0.00 0.00 54.13 56.02 1m7t s LEU 22 Cb -0.10 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.06 1m7t s LEU 22 CO 0.19 -0.70 0.25 -0.69 -1.32 0.00 0.00 176.35 174.08 1m7t s VAL 23 N 3.13 5.01 -0.22 1.68 1.01 0.28 -1.90 120.40 129.40 1m7t s VAL 23 Ca 0.53 -0.58 -0.06 0.00 0.00 0.00 0.00 61.98 61.87 1m7t s VAL 23 Cb -0.21 -3.72 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 1m7t s VAL 23 CO 0.15 -0.18 0.02 0.54 0.00 0.00 0.00 175.10 175.63 1m7t s VAL 24 N 1.65 3.98 0.01 2.92 0.11 -1.13 0.81 120.40 128.75 1m7t s VAL 24 Ca 0.04 -0.29 0.03 0.00 -2.93 0.00 0.00 61.98 58.83 1m7t s VAL 24 Cb -0.18 -2.82 -0.01 0.00 -1.53 0.00 0.00 36.38 31.83 1m7t s VAL 24 CO 0.09 0.40 -0.09 0.68 -3.33 0.00 0.00 175.10 172.84 1m7t s VAL 25 N 1.30 0.73 -0.15 2.04 -7.23 0.10 -3.42 120.40 113.77 1m7t s VAL 25 Ca 0.04 -0.54 -0.04 0.00 -1.81 0.00 0.00 61.98 59.63 1m7t s VAL 25 Cb -0.15 -0.64 -0.03 0.00 0.56 0.00 0.00 36.38 36.12 1m7t s VAL 25 CO 0.01 0.10 -0.01 -0.62 -0.31 0.00 0.00 175.10 174.27 1m7t s ASP 26 N -0.50 5.01 -0.42 4.85 2.15 -1.23 0.78 116.67 127.32 1m7t s ASP 26 Ca 0.02 -0.06 -0.18 0.00 0.43 0.00 0.00 52.55 52.76 1m7t s ASP 26 Cb -0.05 -1.78 0.02 0.00 -0.30 0.00 0.00 42.92 40.81 1m7t s ASP 26 CO 0.00 0.19 0.45 -0.36 -0.17 0.00 0.00 175.17 175.29 1m7t s PHE 27 N 0.23 3.16 0.00 -5.34 0.40 0.12 -1.97 117.98 114.57 1m7t s PHE 27 Ca -0.01 -0.33 0.00 0.00 -0.60 0.00 0.00 56.93 56.00 1m7t s PHE 27 Cb -0.13 -2.93 0.00 0.00 0.51 0.00 0.00 43.02 40.47 1m7t s PHE 27 CO 0.02 -0.71 0.00 -1.13 0.70 0.00 0.00 175.22 174.11 1m7t n SER 28 N 5.66 1.89 -3.69 1.36 3.41 -0.97 -2.36 113.62 118.91 1m7t n SER 28 Ca -0.07 -0.88 -0.12 0.00 -0.26 0.00 0.00 58.87 57.55 1m7t n SER 28 Cb 0.47 0.00 -0.06 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 -0.86 0.17 7.33 0.00 -1.26 -2.44 121.76 122.70 1m7t s ALA 29 Ca 0.00 0.11 -0.06 0.00 0.00 0.00 0.00 51.96 52.00 1m7t s ALA 29 Cb 0.00 0.42 0.06 0.00 0.00 0.00 0.00 23.12 23.59 1m7t s ALA 29 CO 0.00 -0.48 1.50 1.15 0.00 0.00 0.00 175.76 177.92 1m7t h THR 30 N 2.92 1.29 -0.24 0.00 2.02 -2.01 -2.83 112.91 114.06 1m7t h THR 30 Ca -0.32 -1.67 0.00 0.00 0.77 0.00 0.00 66.41 65.19 1m7t h THR 30 Cb 1.21 1.59 0.00 0.00 -1.74 0.00 0.00 68.15 69.21 1m7t h THR 30 CO 0.45 0.54 0.00 -2.67 0.37 0.00 0.00 175.52 174.21 1m7t n TRP 31 N -4.01 0.36 -3.90 3.16 4.27 -1.26 -4.85 117.44 111.21 1m7t n TRP 31 Ca -0.03 -0.17 -0.37 0.00 -3.89 0.00 0.00 57.50 53.04 1m7t n TRP 31 Cb 0.57 -0.02 -0.06 0.00 -1.36 0.00 0.00 31.31 30.45 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 1.91 -0.56 0.48 0.00 0.00 -1.26 -4.33 105.19 101.42 1m7t n GLY 33 Ca -0.19 -0.13 0.29 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.44 0.07 -0.99 1.61 0.11 -1.98 0.17 132.00 130.55 1m7t h PRO 34 Ca 0.00 -0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.15 1m7t h PRO 34 Cb 0.38 -0.01 -0.06 0.00 0.11 0.00 0.00 31.00 31.42 1m7t h PRO 34 CO 0.00 0.04 0.65 0.00 -0.21 0.00 0.00 178.00 178.48 1m7t h LYS 36 N 1.24 0.00 0.00 0.00 1.57 -0.86 -2.82 116.57 115.71 1m7t h LYS 36 Ca 0.40 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.17 1m7t h LYS 36 Cb 0.02 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 1m7t h LYS 36 CO -0.13 0.34 -0.03 0.52 -0.57 0.00 0.00 179.45 179.58 1m7t h MET 37 N 0.00 0.00 0.00 3.15 2.86 -1.05 -2.26 114.93 117.63 1m7t h MET 37 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1m7t h MET 37 Cb 0.80 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.46 1m7t h MET 37 CO 0.04 0.03 -0.71 0.82 1.06 0.00 0.00 176.91 178.15 1m7t h ILE 38 N 0.00 0.00 -0.05 -1.22 1.08 -1.37 -3.37 117.51 112.58 1m7t h ILE 38 Ca -0.00 -0.82 0.04 0.00 -0.39 0.00 0.00 64.86 63.69 1m7t h ILE 38 Cb 0.47 1.43 -0.05 0.00 -3.07 0.00 0.00 36.82 35.60 1m7t h ILE 38 CO 0.00 0.00 -0.30 0.50 -0.69 0.00 0.00 178.15 177.67 1m7t h LYS 39 N 0.00 -0.40 -0.49 2.37 3.64 -1.44 0.70 116.57 120.95 1m7t h LYS 39 Ca 0.00 0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.51 1m7t h LYS 39 Cb 0.91 0.09 -0.10 0.00 -0.41 0.00 0.00 32.23 32.72 1m7t h LYS 39 CO 0.00 -0.27 -0.21 -1.35 -2.27 0.00 0.00 179.45 175.36 1m7t h PRO 40 N -0.41 -0.09 -0.03 1.90 0.11 -1.72 0.39 132.00 132.14 1m7t h PRO 40 Ca 0.08 0.01 -0.22 0.00 0.11 0.00 0.00 66.00 65.97 1m7t h PRO 40 Cb 0.53 0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.66 1m7t h PRO 40 CO -0.29 -0.06 -0.89 0.74 -0.21 0.00 0.00 178.00 177.29 1m7t h PHE 41 N -0.10 0.66 -0.26 0.65 0.04 -1.69 -1.83 116.94 114.41 1m7t h PHE 41 Ca 0.23 -0.34 -0.03 0.00 2.80 0.00 0.00 57.97 60.64 1m7t h PHE 41 Cb 0.46 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.51 1m7t h PHE 41 CO -0.49 1.15 0.05 0.35 -0.60 0.00 0.00 178.31 178.77 1m7t h PHE 42 N 0.27 0.44 -0.43 -0.55 3.57 0.10 -1.46 116.94 118.89 1m7t h PHE 42 Ca -0.07 -0.06 -0.09 0.00 3.53 0.00 0.00 57.97 61.28 1m7t h PHE 42 Cb 1.52 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 40.12 1m7t h PHE 42 CO 0.06 0.51 -0.09 1.25 -2.23 0.00 0.00 178.31 177.81 1m7t h HIS 43 N 0.24 0.92 -0.31 0.41 2.76 -0.29 -2.87 115.15 116.01 1m7t h HIS 43 Ca 0.08 -0.19 0.00 0.00 -2.20 0.00 0.00 60.37 58.06 1m7t h HIS 43 Cb 0.30 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 29.02 1m7t h HIS 43 CO 0.02 0.93 0.20 0.77 -1.30 0.00 0.00 177.93 178.54 1m7t h SER 44 N 0.65 0.36 -0.86 3.26 0.02 -1.26 -1.72 113.55 114.01 1m7t h SER 44 Ca 0.11 -0.02 0.14 0.00 -0.84 0.00 0.00 61.79 61.18 1m7t h SER 44 Cb 0.62 -0.09 -0.07 0.00 0.14 0.00 0.00 62.40 63.01 1m7t h SER 44 CO 0.04 0.28 0.56 -0.07 -1.14 0.00 0.00 176.83 176.50 1m7t h LEU 45 N 0.41 0.59 -2.25 5.07 3.38 -1.23 0.47 115.31 121.75 1m7t h LEU 45 Ca 0.11 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.16 1m7t h LEU 45 Cb -0.03 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1m7t h LEU 45 CO -0.02 0.30 0.14 -1.28 0.09 0.00 0.00 178.44 177.66 1m7t h SER 46 N 0.62 0.00 0.94 -0.43 0.87 -1.08 0.41 113.55 114.88 1m7t h SER 46 Ca 0.43 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.99 1m7t h SER 46 Cb 0.75 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.71 1m7t h SER 46 CO -0.18 0.00 -0.82 -0.08 -0.53 0.00 0.00 176.83 175.22 1m7t h GLU 47 N 0.00 0.00 0.00 2.24 4.81 0.00 -3.32 114.58 118.31 1m7t h GLU 47 Ca 0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1m7t h GLU 47 Cb 0.34 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.72 1m7t h GLU 47 CO -0.00 0.00 -1.29 1.17 -0.73 0.00 0.00 179.01 178.16 1m7t n LYS 48 N -2.42 0.33 -3.51 1.92 4.81 0.25 -4.67 118.16 114.87 1m7t n LYS 48 Ca 0.02 -0.05 -0.41 0.00 -0.87 0.00 0.00 58.31 56.99 1m7t n LYS 48 Cb 0.50 -1.56 -0.04 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 -3.24 3.87 0.00 5.64 1.51 0.12 -4.92 117.35 120.32 1m7t s TYR 49 Ca 0.01 -2.65 -0.02 0.00 -1.01 0.00 0.00 57.07 53.41 1m7t s TYR 49 Cb 0.15 -3.52 -0.08 0.00 -0.11 0.00 0.00 41.96 38.40 1m7t s TYR 49 CO 0.85 -0.87 2.35 0.45 -1.11 0.00 0.00 175.55 177.22 1m7t n SER 50 N 3.02 4.95 0.00 2.29 2.88 -1.26 -3.10 113.62 122.39 1m7t n SER 50 Ca 0.18 -2.34 0.00 0.00 -1.33 0.00 0.00 58.87 55.37 1m7t n SER 50 Cb 0.40 -1.14 0.00 0.00 -0.75 0.00 0.00 64.21 62.72 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 1.85 0.00 -4.95 -3.46 5.15 -1.26 -5.13 115.26 107.46 1m7t n ASN 51 Ca 0.13 0.00 -0.25 0.00 -0.60 0.00 0.00 54.58 53.85 1m7t n ASN 51 Cb 0.59 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.81 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 -0.92 5.29 -0.34 3.44 -7.23 -1.18 -4.18 120.40 115.28 1m7t s VAL 52 Ca 0.00 -0.68 -0.10 0.00 -1.81 0.00 0.00 61.98 59.39 1m7t s VAL 52 Cb 0.00 -3.76 0.01 0.00 0.56 0.00 0.00 36.38 33.18 1m7t s VAL 52 CO 0.00 -0.16 0.17 -0.51 -0.31 0.00 0.00 175.10 174.30 1m7t s ILE 53 N -1.82 4.59 -0.33 -0.62 1.10 -0.80 -4.86 121.20 118.46 1m7t s ILE 53 Ca 0.35 -0.61 -0.13 0.00 -0.51 0.00 0.00 60.65 59.76 1m7t s ILE 53 Cb -0.11 -3.43 -0.02 0.00 0.15 0.00 0.00 42.46 39.05 1m7t s ILE 53 CO 0.29 -0.06 0.25 -0.36 -2.11 0.00 0.00 174.94 172.95 1m7t s PHE 54 N 1.59 3.23 0.27 3.50 0.40 -1.26 -2.82 117.98 122.88 1m7t s PHE 54 Ca 0.03 -0.10 0.03 0.00 -0.60 0.00 0.00 56.93 56.29 1m7t s PHE 54 Cb -0.18 -2.48 -0.06 0.00 0.51 0.00 0.00 43.02 40.81 1m7t s PHE 54 CO 0.06 -0.32 0.04 -0.48 0.70 0.00 0.00 175.22 175.22 1m7t s LEU 55 N 1.77 2.06 -0.13 -0.37 0.05 -1.22 -3.49 118.68 117.35 1m7t s LEU 55 Ca 0.07 -1.31 0.02 0.00 0.05 0.00 0.00 54.13 52.97 1m7t s LEU 55 Cb -0.17 -0.24 0.01 0.00 -2.05 0.00 0.00 46.19 43.74 1m7t s LEU 55 CO 0.11 -0.59 -0.20 -0.70 -0.55 0.00 0.00 176.35 174.42 1m7t s GLU 56 N -3.91 2.78 -0.26 1.48 2.12 -1.14 -3.50 118.70 116.27 1m7t s GLU 56 Ca 0.33 -0.77 -0.04 0.00 0.36 0.00 0.00 54.97 54.86 1m7t s GLU 56 Cb 0.07 -2.27 0.01 0.00 0.26 0.00 0.00 34.13 32.20 1m7t s GLU 56 CO 0.12 -0.03 -0.01 0.08 -0.54 0.00 0.00 175.26 174.88 1m7t s VAL 57 N 0.87 3.36 -0.34 3.70 1.01 -0.83 -2.16 120.40 126.00 1m7t s VAL 57 Ca -0.07 -0.79 -0.18 0.00 0.00 0.00 0.00 61.98 60.94 1m7t s VAL 57 Cb -0.15 -2.68 -0.01 0.00 0.00 0.00 0.00 36.38 33.55 1m7t s VAL 57 CO -0.02 0.21 0.50 1.51 0.00 0.00 0.00 175.10 177.30 1m7t s ASP 58 N 1.42 6.32 0.62 3.32 -4.77 -1.26 -2.29 116.67 120.02 1m7t s ASP 58 Ca 0.02 -0.00 0.37 0.00 -3.30 0.00 0.00 52.55 49.64 1m7t s ASP 58 Cb -0.16 -2.26 2.06 0.00 -1.09 0.00 0.00 42.92 41.47 1m7t s ASP 58 CO -0.02 -0.46 2.28 1.62 0.70 0.00 0.00 175.17 179.29 1m7t h VAL 59 N 5.59 0.24 -0.69 2.11 3.04 -1.75 0.72 116.25 125.52 1m7t h VAL 59 Ca -0.28 -0.09 -0.03 0.00 -1.01 0.00 0.00 66.70 65.29 1m7t h VAL 59 Cb 1.13 1.07 -0.03 0.00 -2.01 0.00 0.00 31.29 31.45 1m7t h VAL 59 CO 0.76 0.01 0.31 -0.78 -1.01 0.00 0.00 177.57 176.87 1m7t h ASP 60 N 0.00 0.90 0.00 3.17 1.82 -1.92 -3.10 116.42 117.28 1m7t h ASP 60 Ca -0.00 -0.11 -0.39 0.00 -0.39 0.00 0.00 57.03 56.15 1m7t h ASP 60 Cb 0.07 -0.23 -0.07 0.00 0.68 0.00 0.00 39.33 39.78 1m7t h ASP 60 CO 0.00 0.77 -2.42 0.47 -1.61 0.00 0.00 179.24 176.46 1m7t n ASP 61 N -4.32 2.03 -2.75 2.28 9.92 -0.51 -4.55 116.55 118.65 1m7t n ASP 61 Ca 0.06 -0.02 -0.29 0.00 -0.53 0.00 0.00 54.79 54.01 1m7t n ASP 61 Cb 0.15 -0.48 -0.06 0.00 -0.64 0.00 0.00 41.12 40.09 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 -3.45 6.64 0.67 2.24 0.00 0.24 -4.52 120.51 122.33 1m7t n ALA 62 Ca -0.45 -3.17 0.11 0.00 0.00 0.00 0.00 53.44 49.93 1m7t n ALA 62 Cb 0.94 -2.46 0.46 0.00 0.00 0.00 0.00 19.45 18.39 1m7t n ALA 62 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1m7t n GLN 63 N 1.62 0.07 0.01 0.00 6.02 -1.17 -2.85 117.38 121.09 1m7t n GLN 63 Ca 0.54 0.19 -0.10 0.00 -0.01 0.00 0.00 57.00 57.63 1m7t n GLN 63 Cb 0.50 -1.61 -0.14 0.00 1.02 0.00 0.00 30.24 30.02 1m7t n GLN 63 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 1m7t h ASP 64 N 0.00 0.06 0.02 1.08 5.19 -1.90 -3.35 116.42 117.52 1m7t h ASP 64 Ca 0.00 -0.11 -0.09 0.00 -0.62 0.00 0.00 57.03 56.22 1m7t h ASP 64 Cb 0.43 -0.02 0.01 0.00 0.18 0.00 0.00 39.33 39.93 1m7t h ASP 64 CO 0.00 1.09 -0.35 -0.37 -3.12 0.00 0.00 179.24 176.50 1m7t h VAL 65 N 0.01 1.55 -0.25 -1.35 -1.51 -1.90 -3.34 116.25 109.46 1m7t h VAL 65 Ca -0.22 -2.08 0.06 0.00 -1.23 0.00 0.00 66.70 63.23 1m7t h VAL 65 Cb 1.96 2.86 -0.08 0.00 -2.13 0.00 0.00 31.29 33.90 1m7t h VAL 65 CO 0.10 0.57 -0.35 0.00 -1.23 0.00 0.00 177.57 176.67 1m7t h ALA 66 N 0.22 -0.34 -0.36 5.19 0.00 -1.69 -2.04 119.26 120.24 1m7t h ALA 66 Ca -0.05 0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.02 1m7t h ALA 66 Cb 1.13 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 19.61 1m7t h ALA 66 CO 0.07 -0.80 0.29 -1.35 0.00 0.00 0.00 179.25 177.46 1m7t h PRO 67 N -0.35 0.00 0.00 0.00 0.11 -1.72 -0.06 132.00 129.98 1m7t h PRO 67 Ca 0.12 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.13 1m7t h PRO 67 Cb 0.56 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.65 1m7t h PRO 67 CO -0.45 0.00 -0.50 0.87 -0.21 0.00 0.00 178.00 177.71 1m7t h LYS 68 N 0.00 0.00 -0.00 1.05 1.57 -1.49 -3.15 116.57 114.55 1m7t h LYS 68 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1m7t h LYS 68 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.07 1m7t h LYS 68 CO -0.00 0.50 -0.94 0.66 -0.57 0.00 0.00 179.45 179.10 1m7t n TYR 69 N -3.43 0.00 -3.02 -1.35 4.01 -0.46 -4.99 117.16 107.92 1m7t n TYR 69 Ca 0.00 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.62 1m7t n TYR 69 Cb 0.64 -0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.71 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 1.49 0.16 3.71 2.72 0.00 -0.16 -4.99 105.19 108.12 1m7t n GLY 70 Ca 0.05 -0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 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 -3.13 4.36 -0.40 -0.61 1.01 -1.07 -4.96 121.20 116.40 1m7t s ILE 71 Ca 0.29 1.69 0.09 0.00 0.00 0.00 0.00 60.65 62.73 1m7t s ILE 71 Cb -0.13 -4.09 0.30 0.00 0.01 0.00 0.00 42.46 38.56 1m7t s ILE 71 CO 0.36 0.10 0.70 -1.14 0.00 0.00 0.00 174.94 174.96 1m7t n ARG 72 N 4.17 0.86 0.00 2.79 0.63 -1.26 -4.82 116.66 119.03 1m7t n ARG 72 Ca 0.08 -3.05 0.00 0.00 -0.92 0.00 0.00 57.85 53.96 1m7t n ARG 72 Cb 0.48 -1.43 0.00 0.00 0.45 0.00 0.00 32.46 31.95 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 0.84 2.89 3.70 5.14 0.00 -1.26 -5.16 105.19 111.33 1m7t n GLY 73 Ca 0.20 0.05 -0.27 0.00 0.00 0.00 0.00 46.02 46.00 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 3.97 -0.02 -0.61 -4.36 -1.26 -3.67 121.20 115.25 1m7t s ILE 74 Ca 0.00 -1.23 -0.28 0.00 -0.26 0.00 0.00 60.65 58.88 1m7t s ILE 74 Cb 0.00 -2.97 -0.03 0.00 1.25 0.00 0.00 42.46 40.70 1m7t s ILE 74 CO 0.00 -0.05 0.90 -2.84 0.24 0.00 0.00 174.94 173.19 1m7t s PRO 75 N -2.80 4.52 -0.12 0.37 0.02 -1.26 -4.73 135.00 131.00 1m7t s PRO 75 Ca 0.28 1.26 -0.06 0.00 0.02 0.00 0.00 61.00 62.50 1m7t s PRO 75 Cb -0.10 -3.46 -0.04 0.00 0.02 0.00 0.00 34.50 30.92 1m7t s PRO 75 CO 0.20 -0.02 0.10 0.99 -0.33 0.00 0.00 177.00 177.94 1m7t s THR 76 N 0.96 5.16 -0.29 0.99 2.01 -0.99 -0.88 115.64 122.59 1m7t s THR 76 Ca 0.48 0.08 -0.05 0.00 0.31 0.00 0.00 61.69 62.50 1m7t s THR 76 Cb -0.20 -3.25 0.02 0.00 0.01 0.00 0.00 72.50 69.08 1m7t s THR 76 CO 0.25 0.59 0.05 -0.76 -0.69 0.00 0.00 174.62 174.07 1m7t s LEU 77 N -0.79 3.81 -0.16 4.42 1.02 0.24 0.11 118.68 127.32 1m7t s LEU 77 Ca 0.13 -0.84 -0.06 0.00 0.02 0.00 0.00 54.13 53.38 1m7t s LEU 77 Cb -0.12 -1.83 -0.04 0.00 0.02 0.00 0.00 46.19 44.23 1m7t s LEU 77 CO 0.03 -0.21 0.04 -0.76 0.02 0.00 0.00 176.35 175.47 1m7t s LEU 78 N 1.44 3.71 -0.24 1.79 1.43 0.23 -0.79 118.68 126.25 1m7t s LEU 78 Ca 0.01 0.07 -0.03 0.00 -1.03 0.00 0.00 54.13 53.15 1m7t s LEU 78 Cb -0.18 -1.92 0.01 0.00 0.03 0.00 0.00 46.19 44.14 1m7t s LEU 78 CO 0.01 0.21 -0.04 -0.76 0.23 0.00 0.00 176.35 176.00 1m7t s LEU 79 N 0.14 3.12 -0.05 1.79 2.01 0.14 0.01 118.68 125.85 1m7t s LEU 79 Ca 0.03 -0.64 0.02 0.00 0.01 0.00 0.00 54.13 53.56 1m7t s LEU 79 Cb -0.13 -1.72 -0.03 0.00 0.01 0.00 0.00 46.19 44.33 1m7t s LEU 79 CO 0.01 -0.09 -0.10 -0.36 1.01 0.00 0.00 176.35 176.83 1m7t s PHE 80 N 1.41 2.84 -0.23 0.29 0.40 0.24 0.42 117.98 123.36 1m7t s PHE 80 Ca 0.03 -0.06 -0.04 0.00 -0.60 0.00 0.00 56.93 56.26 1m7t s PHE 80 Cb -0.16 -1.66 0.08 0.00 0.51 0.00 0.00 43.02 41.80 1m7t s PHE 80 CO -0.03 0.29 0.14 0.21 0.70 0.00 0.00 175.22 176.53 1m7t s LYS 81 N -0.91 0.14 -0.81 0.44 2.20 0.23 -0.56 119.74 120.48 1m7t s LYS 81 Ca 0.13 -0.20 -0.02 0.00 -0.36 0.00 0.00 55.97 55.53 1m7t s LYS 81 Cb -0.11 -1.42 0.00 0.00 -1.51 0.00 0.00 37.83 34.79 1m7t s LYS 81 CO 0.02 -0.82 0.68 0.09 -0.36 0.00 0.00 175.35 174.97 1m7t n ASN 82 N 5.28 -2.84 0.00 1.43 5.03 -1.26 -2.48 115.26 120.42 1m7t n ASN 82 Ca -0.06 -0.39 0.00 0.00 0.87 0.00 0.00 54.58 55.00 1m7t n ASN 82 Cb 0.46 -3.48 0.00 0.00 -1.02 0.00 0.00 39.78 35.74 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 -1.20 0.20 3.26 7.41 0.00 -1.26 -4.96 105.19 108.65 1m7t n GLY 83 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.09 3.11 -0.14 1.61 2.12 -1.03 -5.06 118.70 118.22 1m7t s GLU 84 Ca 0.00 -0.83 -0.34 0.00 0.36 0.00 0.00 54.97 54.16 1m7t s GLU 84 Cb 0.00 -2.38 -0.11 0.00 0.26 0.00 0.00 34.13 31.90 1m7t s GLU 84 CO 0.00 0.20 1.97 1.55 -0.54 0.00 0.00 175.26 178.44 1m7t n VAL 85 N 3.49 0.51 1.04 3.70 3.14 -1.26 0.77 118.33 129.73 1m7t n VAL 85 Ca -0.19 -0.17 0.11 0.00 -2.96 0.00 0.00 64.34 61.13 1m7t n VAL 85 Cb 0.53 -1.94 0.06 0.00 -1.06 0.00 0.00 33.84 31.43 1m7t n VAL 85 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1m7t n ALA 86 N 7.75 3.87 -3.63 1.55 0.00 1.41 -4.79 120.51 126.66 1m7t n ALA 86 Ca 0.26 -0.55 -0.04 0.00 0.00 0.00 0.00 53.44 53.12 1m7t n ALA 86 Cb 0.31 -0.89 -0.05 0.00 0.00 0.00 0.00 19.45 18.82 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 -2.72 -2.10 0.08 0.00 0.00 -0.77 -4.96 121.76 111.28 1m7t s ALA 87 Ca 0.15 1.83 0.07 0.00 0.00 0.00 0.00 51.96 54.01 1m7t s ALA 87 Cb 0.18 -1.42 -0.03 0.00 0.00 0.00 0.00 23.12 21.85 1m7t s ALA 87 CO 0.68 -0.24 -0.19 -0.08 0.00 0.00 0.00 175.76 175.94 1m7t s THR 88 N -0.91 1.50 -0.14 0.00 -1.32 -1.26 0.28 115.64 113.78 1m7t s THR 88 Ca 0.07 -1.37 -0.09 0.00 -1.21 0.00 0.00 61.69 59.10 1m7t s THR 88 Cb -0.01 -1.36 0.05 0.00 -1.51 0.00 0.00 72.50 69.66 1m7t s THR 88 CO -0.07 -0.04 0.35 -0.75 -2.21 0.00 0.00 174.62 171.90 1m7t s LYS 89 N -1.65 0.34 0.06 7.08 2.36 0.02 -4.99 119.74 122.97 1m7t s LYS 89 Ca 0.04 0.66 0.07 0.00 -2.55 0.00 0.00 55.97 54.19 1m7t s LYS 89 Cb -0.10 -0.01 -0.04 0.00 -1.05 0.00 0.00 37.83 36.64 1m7t s LYS 89 CO 0.03 -0.14 -0.15 0.08 1.55 0.00 0.00 175.35 176.72 1m7t s VAL 90 N 1.11 3.00 0.00 4.02 1.01 -1.26 0.80 120.40 129.07 1m7t s VAL 90 Ca -0.08 -1.21 0.00 0.00 0.00 0.00 0.00 61.98 60.69 1m7t s VAL 90 Cb -0.08 -2.31 0.00 0.00 0.00 0.00 0.00 36.38 33.99 1m7t s VAL 90 CO -0.09 0.26 0.00 0.61 0.00 0.00 0.00 175.10 175.88 1m7t n GLY 91 N 1.26 -2.18 3.69 4.51 0.00 -0.06 -4.96 105.19 107.45 1m7t n GLY 91 Ca -0.15 -1.49 -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 -2.84 1.07 0.35 4.61 0.00 -1.26 -4.71 121.76 118.97 1m7t s ALA 92 Ca 0.00 -0.34 -0.15 0.00 0.00 0.00 0.00 51.96 51.47 1m7t s ALA 92 Cb 0.00 -3.12 0.04 0.00 0.00 0.00 0.00 23.12 20.04 1m7t s ALA 92 CO 0.00 -2.75 0.72 -0.48 0.00 0.00 0.00 175.76 173.24 1m7t s LEU 93 N -6.41 0.12 0.69 0.00 2.34 -1.26 -5.09 118.68 109.07 1m7t s LEU 93 Ca 0.65 -1.09 -0.01 0.00 0.06 0.00 0.00 54.13 53.74 1m7t s LEU 93 Cb -0.18 2.58 0.10 0.00 -0.56 0.00 0.00 46.19 48.13 1m7t s LEU 93 CO 0.57 -1.55 0.96 -0.44 -1.06 0.00 0.00 176.35 174.84 1m7t s SER 94 N -3.06 4.53 0.29 1.48 0.01 -1.26 -4.97 113.70 110.72 1m7t s SER 94 Ca 0.17 -0.21 0.09 0.00 1.31 0.00 0.00 55.95 57.32 1m7t s SER 94 Cb -0.04 -0.29 0.43 0.00 0.21 0.00 0.00 66.02 66.33 1m7t s SER 94 CO 0.12 -1.72 1.66 0.50 0.41 0.00 0.00 173.24 174.21 1m7t h LYS 95 N -0.45 0.08 0.01 12.44 3.64 -2.00 -2.73 116.57 127.56 1m7t h LYS 95 Ca -0.38 -0.05 -0.20 0.00 -1.27 0.00 0.00 60.65 58.75 1m7t h LYS 95 Cb 1.28 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.08 1m7t h LYS 95 CO 0.44 0.59 -0.91 0.78 -2.27 0.00 0.00 179.45 178.08 1m7t h GLY 96 N 1.53 0.14 1.95 5.01 0.00 -1.99 -2.57 103.07 107.15 1m7t h GLY 96 Ca -0.00 -0.28 -0.16 0.00 0.00 0.00 0.00 47.33 46.89 1m7t h GLY 96 CO 0.07 0.24 -0.77 1.46 0.00 0.00 0.00 176.54 177.55 1m7t h GLN 97 N 0.06 0.04 0.04 4.80 4.20 -1.94 -1.28 115.11 121.04 1m7t h GLN 97 Ca -0.04 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.63 1m7t h GLN 97 Cb 1.57 0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.36 1m7t h GLN 97 CO 0.13 0.79 -0.02 1.25 -0.67 0.00 0.00 178.83 180.31 1m7t h LEU 98 N 0.03 -0.05 -0.48 1.46 6.46 -1.52 -2.11 115.31 119.10 1m7t h LEU 98 Ca -0.01 -0.57 0.00 0.00 -0.12 0.00 0.00 57.88 57.18 1m7t h LEU 98 Cb 1.35 0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 41.27 1m7t h LEU 98 CO 0.10 0.58 0.31 0.50 -0.62 0.00 0.00 178.44 179.32 1m7t h LYS 99 N -0.71 0.64 -0.91 1.25 3.64 -1.52 -1.49 116.57 117.47 1m7t h LYS 99 Ca -0.01 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1m7t h LYS 99 Cb 0.62 -0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.25 1m7t h LYS 99 CO 0.01 0.43 0.60 1.05 -2.27 0.00 0.00 179.45 179.28 1m7t h GLU 100 N 0.65 1.19 -0.70 1.90 -0.00 -1.30 -0.38 114.58 115.94 1m7t h GLU 100 Ca 0.18 -0.07 -0.03 0.00 -0.00 0.00 0.00 59.36 59.44 1m7t h GLU 100 Cb -0.06 -0.27 -0.03 0.00 -0.00 0.00 0.00 28.75 28.39 1m7t h GLU 100 CO -0.04 0.79 0.33 0.35 -0.00 0.00 0.00 179.01 180.44 1m7t h PHE 101 N 1.23 1.01 0.36 2.06 3.57 -0.69 -2.19 116.94 122.28 1m7t h PHE 101 Ca 0.34 -0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.77 1m7t h PHE 101 Cb -0.12 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.31 1m7t h PHE 101 CO -0.00 0.75 -0.17 -0.07 -2.23 0.00 0.00 178.31 176.59 1m7t h LEU 102 N 0.97 -0.41 -1.66 0.59 3.38 -0.59 -2.51 115.31 115.09 1m7t h LEU 102 Ca 0.24 -0.15 0.36 0.00 0.09 0.00 0.00 57.88 58.42 1m7t h LEU 102 Cb 0.13 0.11 -0.08 0.00 0.09 0.00 0.00 40.66 40.90 1m7t h LEU 102 CO -0.03 -0.01 0.84 -0.78 0.09 0.00 0.00 178.44 178.56 1m7t h ASP 103 N -0.89 0.20 1.13 -0.43 1.82 -1.07 1.42 116.42 118.60 1m7t h ASP 103 Ca -0.05 0.06 -0.06 0.00 -0.39 0.00 0.00 57.03 56.59 1m7t h ASP 103 Cb 0.54 0.03 -0.01 0.00 0.68 0.00 0.00 39.33 40.57 1m7t h ASP 103 CO 0.08 -0.01 -0.28 0.00 -1.61 0.00 0.00 179.24 177.42 1m7t h ALA 104 N 1.48 0.94 0.00 -0.78 0.00 -1.14 -3.34 119.26 116.43 1m7t h ALA 104 Ca 0.66 -0.25 -0.18 0.00 0.00 0.00 0.00 54.91 55.14 1m7t h ALA 104 Cb 2.21 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.92 1m7t h ALA 104 CO -0.19 0.35 -1.74 -1.71 0.00 0.00 0.00 179.25 175.95 1m7t n ASN 105 N -3.34 2.22 0.00 0.00 5.15 0.39 -4.51 115.26 115.17 1m7t n ASN 105 Ca 0.01 0.00 0.03 0.00 -0.60 0.00 0.00 54.58 54.02 1m7t n ASN 105 Cb 0.51 0.88 0.21 0.00 -0.53 0.00 0.00 39.78 40.85 1m7t n ASN 105 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1m7t n LEU 106 N -2.35 0.00 -0.55 1.20 0.00 0.39 -5.03 117.00 110.66 1m7t n LEU 106 Ca -0.16 0.00 0.14 0.00 0.00 0.00 0.00 56.01 55.99 1m7t n LEU 106 Cb 0.79 0.00 0.46 0.00 0.00 0.00 0.00 43.42 44.67 1m7t n LEU 106 CO 0.24 0.00 0.83 1.33 0.00 0.00 0.00 177.39 179.80