#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 0.45 -0.09 1.12 1.01 -1.24 -3.33 120.40 118.31 1m7t s VAL 2 Ca 0.00 -0.72 -0.04 0.00 0.00 0.00 0.00 61.98 61.22 1m7t s VAL 2 Cb 0.00 -0.47 0.05 0.00 0.00 0.00 0.00 36.38 35.96 1m7t s VAL 2 CO 0.00 -0.19 0.19 -1.59 0.00 0.00 0.00 175.10 173.50 1m7t s LYS 3 N -0.99 0.07 0.05 2.72 -2.85 -1.25 -5.00 119.74 112.48 1m7t s LYS 3 Ca -0.06 0.59 -0.30 0.00 -1.00 0.00 0.00 55.97 55.20 1m7t s LYS 3 Cb -0.07 -0.20 -0.05 0.00 -2.06 0.00 0.00 37.83 35.45 1m7t s LYS 3 CO 0.00 -0.29 1.18 -1.14 0.10 0.00 0.00 175.35 175.21 1m7t s GLN 4 N 2.21 4.43 -0.43 1.78 0.74 -1.26 -3.03 119.66 124.11 1m7t s GLN 4 Ca 0.01 1.74 -0.14 0.00 0.05 0.00 0.00 55.36 57.02 1m7t s GLN 4 Cb -0.12 -3.37 0.04 0.00 1.10 0.00 0.00 33.01 30.66 1m7t s GLN 4 CO -0.07 -0.26 0.32 0.42 -0.55 0.00 0.00 175.29 175.15 1m7t s ILE 5 N 1.15 5.10 -0.56 -2.34 1.09 0.25 -4.92 121.20 120.96 1m7t s ILE 5 Ca 0.58 -0.86 0.16 0.00 -1.10 0.00 0.00 60.65 59.42 1m7t s ILE 5 Cb -0.28 -3.93 0.80 0.00 -1.06 0.00 0.00 42.46 37.99 1m7t s ILE 5 CO 0.29 -0.40 1.72 -0.62 -0.10 0.00 0.00 174.94 175.83 1m7t n GLU 6 N 5.14 4.54 -3.62 2.79 1.02 -1.26 -4.01 120.64 125.23 1m7t n GLU 6 Ca -0.12 -3.09 -0.11 0.00 -0.02 0.00 0.00 57.16 53.82 1m7t n GLU 6 Cb 0.46 -2.15 -0.05 0.00 -0.02 0.00 0.00 31.44 29.67 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 -0.82 -0.29 0.38 1.62 0.01 -1.26 -4.55 113.70 108.79 1m7t s SER 7 Ca 0.54 -0.16 0.19 0.00 1.31 0.00 0.00 55.95 57.82 1m7t s SER 7 Cb 0.39 0.47 0.71 0.00 0.21 0.00 0.00 66.02 67.80 1m7t s SER 7 CO 0.19 -0.79 1.75 0.50 0.41 0.00 0.00 173.24 175.30 1m7t h LYS 8 N 2.56 0.00 0.03 12.44 3.64 -1.93 -2.86 116.57 130.46 1m7t h LYS 8 Ca -0.33 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 58.83 1m7t h LYS 8 Cb 1.24 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.04 1m7t h LYS 8 CO 0.45 0.36 -1.05 1.15 -2.27 0.00 0.00 179.45 178.10 1m7t h THR 9 N 0.00 1.66 -0.35 1.00 2.02 -1.99 -3.28 112.91 111.96 1m7t h THR 9 Ca -0.00 -3.29 -0.10 0.00 0.77 0.00 0.00 66.41 63.79 1m7t h THR 9 Cb 0.86 2.85 -0.02 0.00 -1.74 0.00 0.00 68.15 70.10 1m7t h THR 9 CO 0.05 0.95 -0.18 0.00 0.37 0.00 0.00 175.52 176.71 1m7t h ALA 10 N 0.91 1.03 -0.71 6.16 0.00 -1.91 -1.23 119.26 123.51 1m7t h ALA 10 Ca -0.04 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.55 1m7t h ALA 10 Cb 1.80 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 19.40 1m7t h ALA 10 CO 0.15 0.58 0.47 0.35 0.00 0.00 0.00 179.25 180.80 1m7t h PHE 11 N 0.59 0.89 -0.30 0.00 3.57 -1.58 0.23 116.94 120.33 1m7t h PHE 11 Ca 0.09 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 1m7t h PHE 11 Cb 0.63 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 1m7t h PHE 11 CO 0.03 0.56 -0.04 1.96 -2.23 0.00 0.00 178.31 178.58 1m7t h GLN 12 N 0.96 0.56 -0.42 1.11 1.08 -1.58 -1.70 115.11 115.12 1m7t h GLN 12 Ca 0.26 -0.20 0.03 0.00 -1.45 0.00 0.00 58.65 57.29 1m7t h GLN 12 Cb -0.10 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.25 1m7t h GLN 12 CO -0.06 0.73 0.22 0.93 -0.95 0.00 0.00 178.83 179.70 1m7t h GLU 13 N 0.34 0.43 -0.04 1.46 5.08 -0.59 -0.96 114.58 120.31 1m7t h GLU 13 Ca 0.08 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 1m7t h GLU 13 Cb 0.51 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 1m7t h GLU 13 CO 0.02 0.29 -0.33 0.00 -1.00 0.00 0.00 179.01 177.99 1m7t h ALA 14 N 1.21 1.38 -0.37 3.43 0.00 -0.52 -2.70 119.26 121.70 1m7t h ALA 14 Ca 0.17 -0.32 -0.15 0.00 0.00 0.00 0.00 54.91 54.61 1m7t h ALA 14 Cb 0.06 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1m7t h ALA 14 CO -0.11 0.45 -0.37 -0.07 0.00 0.00 0.00 179.25 179.16 1m7t h LEU 15 N 0.07 0.91 -1.57 0.00 3.38 -0.52 -2.21 115.31 115.37 1m7t h LEU 15 Ca 0.01 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.56 1m7t h LEU 15 Cb 0.62 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1m7t h LEU 15 CO 0.05 1.18 0.13 -0.78 0.09 0.00 0.00 178.44 179.10 1m7t h ASP 16 N 0.71 0.37 1.38 -0.43 3.58 -0.89 -0.45 116.42 120.70 1m7t h ASP 16 Ca 0.06 -0.03 -0.07 0.00 0.42 0.00 0.00 57.03 57.42 1m7t h ASP 16 Cb 0.94 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.89 1m7t h ASP 16 CO 0.09 0.33 -0.31 0.00 -2.88 0.00 0.00 179.24 176.47 1m7t h ALA 17 N 1.73 0.85 -0.17 -0.78 0.00 -1.29 -3.19 119.26 116.42 1m7t h ALA 17 Ca 0.11 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 1m7t h ALA 17 Cb 0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1m7t h ALA 17 CO -0.01 0.39 -0.29 0.00 0.00 0.00 0.00 179.25 179.34 1m7t h ALA 18 N 1.69 1.19 -0.90 0.00 0.00 -0.46 -3.47 119.26 117.31 1m7t h ALA 18 Ca -0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1m7t h ALA 18 Cb 1.09 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1m7t h ALA 18 CO 0.04 0.53 0.00 0.41 0.00 0.00 0.00 179.25 180.23 1m7t n GLY 19 N -0.41 4.05 1.03 0.00 0.00 -1.13 -0.77 105.19 107.96 1m7t n GLY 19 Ca -0.01 0.12 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 7.53 3.03 -4.80 1.61 2.03 -1.26 -3.95 116.55 120.73 1m7t n ASP 20 Ca 0.00 -1.96 -0.35 0.00 0.52 0.00 0.00 54.79 53.01 1m7t n ASP 20 Cb 0.00 -0.31 -0.06 0.00 -0.72 0.00 0.00 41.12 40.02 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 -1.37 4.28 0.14 -0.67 1.02 0.05 -4.85 119.74 118.34 1m7t s LYS 21 Ca 0.38 1.24 -0.30 0.00 0.02 0.00 0.00 55.97 57.31 1m7t s LYS 21 Cb 0.21 -2.38 -0.07 0.00 -0.52 0.00 0.00 37.83 35.07 1m7t s LYS 21 CO 0.28 0.01 1.09 -1.17 -0.92 0.00 0.00 175.35 174.64 1m7t s LEU 22 N -2.85 4.47 -0.31 3.17 2.96 -1.26 -4.51 118.68 120.35 1m7t s LEU 22 Ca 0.59 2.02 0.00 0.00 -0.22 0.00 0.00 54.13 56.52 1m7t s LEU 22 Cb -0.14 -3.60 0.07 0.00 0.50 0.00 0.00 46.19 43.02 1m7t s LEU 22 CO 0.18 -0.24 0.00 -0.69 -1.32 0.00 0.00 176.35 174.29 1m7t s VAL 23 N 0.04 2.72 -0.33 1.68 1.01 0.33 -0.43 120.40 125.42 1m7t s VAL 23 Ca 0.50 -1.67 -0.12 0.00 0.00 0.00 0.00 61.98 60.70 1m7t s VAL 23 Cb -0.28 -2.67 -0.01 0.00 0.00 0.00 0.00 36.38 33.42 1m7t s VAL 23 CO 0.33 -0.23 0.21 0.54 0.00 0.00 0.00 175.10 175.95 1m7t s VAL 24 N 1.15 5.02 0.36 2.92 0.11 -1.06 0.94 120.40 129.84 1m7t s VAL 24 Ca -0.02 -0.33 0.07 0.00 -2.93 0.00 0.00 61.98 58.77 1m7t s VAL 24 Cb -0.20 -3.59 -0.07 0.00 -1.53 0.00 0.00 36.38 30.99 1m7t s VAL 24 CO -0.03 -0.00 -0.01 0.68 -3.33 0.00 0.00 175.10 172.40 1m7t s VAL 25 N 1.68 1.82 -0.03 2.04 -7.23 0.22 -3.31 120.40 115.60 1m7t s VAL 25 Ca 0.05 -2.06 0.01 0.00 -1.81 0.00 0.00 61.98 58.18 1m7t s VAL 25 Cb -0.17 -2.80 0.01 0.00 0.56 0.00 0.00 36.38 33.98 1m7t s VAL 25 CO 0.09 -0.09 -0.05 -0.62 -0.31 0.00 0.00 175.10 174.12 1m7t s ASP 26 N -3.60 0.78 -0.41 4.85 -1.08 -1.23 -0.09 116.67 115.88 1m7t s ASP 26 Ca 0.34 -0.11 -0.17 0.00 -0.52 0.00 0.00 52.55 52.09 1m7t s ASP 26 Cb 0.07 -0.27 0.02 0.00 -1.46 0.00 0.00 42.92 41.28 1m7t s ASP 26 CO 0.16 -0.00 0.43 -0.36 0.52 0.00 0.00 175.17 175.92 1m7t s PHE 27 N 0.47 3.17 0.00 -5.34 0.40 0.20 -2.47 117.98 114.41 1m7t s PHE 27 Ca -0.06 -0.32 0.00 0.00 -0.60 0.00 0.00 56.93 55.95 1m7t s PHE 27 Cb -0.09 -2.87 0.00 0.00 0.51 0.00 0.00 43.02 40.57 1m7t s PHE 27 CO -0.00 -0.67 0.00 -1.13 0.70 0.00 0.00 175.22 174.12 1m7t n SER 28 N 5.58 1.94 -3.69 1.36 3.41 -1.05 -2.56 113.62 118.61 1m7t n SER 28 Ca -0.07 -0.84 -0.12 0.00 -0.26 0.00 0.00 58.87 57.57 1m7t n SER 28 Cb 0.48 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 -0.90 0.19 7.33 0.00 -1.26 -2.52 121.76 122.60 1m7t s ALA 29 Ca 0.00 0.19 -0.02 0.00 0.00 0.00 0.00 51.96 52.13 1m7t s ALA 29 Cb 0.00 0.36 0.13 0.00 0.00 0.00 0.00 23.12 23.60 1m7t s ALA 29 CO 0.00 -0.45 1.51 1.15 0.00 0.00 0.00 175.76 177.97 1m7t h THR 30 N 3.04 1.33 -0.23 0.00 2.02 -2.01 -2.70 112.91 114.36 1m7t h THR 30 Ca -0.32 -1.80 0.00 0.00 0.77 0.00 0.00 66.41 65.06 1m7t h THR 30 Cb 1.21 1.79 0.00 0.00 -1.74 0.00 0.00 68.15 69.40 1m7t h THR 30 CO 0.44 0.56 0.00 -2.67 0.37 0.00 0.00 175.52 174.22 1m7t n TRP 31 N -3.95 0.36 -2.91 3.16 4.27 -1.26 -4.90 117.44 112.21 1m7t n TRP 31 Ca -0.03 -0.17 -0.28 0.00 -3.89 0.00 0.00 57.50 53.13 1m7t n TRP 31 Cb 0.60 -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 -1.72 -0.19 0.30 0.00 0.00 -1.26 -4.70 105.19 97.62 1m7t n GLY 33 Ca -0.00 -0.07 0.19 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.22 0.00 -0.99 1.61 0.11 -1.98 -2.61 132.00 127.93 1m7t h PRO 34 Ca 0.00 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.14 1m7t h PRO 34 Cb 0.22 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.27 1m7t h PRO 34 CO 0.00 0.03 0.65 0.00 -0.21 0.00 0.00 178.00 178.47 1m7t h LYS 36 N 1.28 0.00 0.00 0.00 1.57 -1.74 -2.65 116.57 115.03 1m7t h LYS 36 Ca 0.39 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 59.10 1m7t h LYS 36 Cb -0.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1m7t h LYS 36 CO -0.11 0.00 -0.33 0.52 -0.57 0.00 0.00 179.45 178.96 1m7t h MET 37 N 0.00 0.00 0.00 3.15 2.86 -1.07 -3.15 114.93 116.72 1m7t h MET 37 Ca 0.00 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.51 1m7t h MET 37 Cb 0.37 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.01 1m7t h MET 37 CO 0.00 0.33 -1.01 0.82 1.06 0.00 0.00 176.91 178.10 1m7t h ILE 38 N 0.00 0.58 -0.43 -1.22 1.08 -1.49 -3.38 117.51 112.65 1m7t h ILE 38 Ca -0.00 -1.97 0.09 0.00 -0.39 0.00 0.00 64.86 62.59 1m7t h ILE 38 Cb 0.96 2.13 -0.09 0.00 -3.07 0.00 0.00 36.82 36.75 1m7t h ILE 38 CO 0.04 0.33 -0.17 0.50 -0.69 0.00 0.00 178.15 178.16 1m7t h LYS 39 N 0.00 -0.07 -0.28 2.37 3.64 -1.58 1.03 116.57 121.68 1m7t h LYS 39 Ca -0.09 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.33 1m7t h LYS 39 Cb 1.45 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 33.25 1m7t h LYS 39 CO 0.05 -0.05 0.08 -1.35 -2.27 0.00 0.00 179.45 175.91 1m7t h PRO 40 N -0.08 0.19 0.03 1.90 0.11 -1.73 -1.11 132.00 131.31 1m7t h PRO 40 Ca 0.21 -0.01 -0.23 0.00 0.11 0.00 0.00 66.00 66.08 1m7t h PRO 40 Cb 0.40 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.44 1m7t h PRO 40 CO -0.49 0.12 -1.09 0.74 -0.21 0.00 0.00 178.00 177.08 1m7t h PHE 41 N 0.19 0.10 -0.25 0.65 0.04 -1.66 -2.94 116.94 113.08 1m7t h PHE 41 Ca 0.13 -0.07 -0.04 0.00 2.80 0.00 0.00 57.97 60.78 1m7t h PHE 41 Cb 0.11 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.25 1m7t h PHE 41 CO -0.15 1.06 -0.02 0.35 -0.60 0.00 0.00 178.31 178.96 1m7t h PHE 42 N 0.02 0.49 -0.55 -0.55 3.57 0.12 -2.52 116.94 117.52 1m7t h PHE 42 Ca -0.05 -0.09 -0.10 0.00 3.53 0.00 0.00 57.97 61.25 1m7t h PHE 42 Cb 1.82 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 40.42 1m7t h PHE 42 CO 0.01 0.63 -0.07 1.25 -2.23 0.00 0.00 178.31 177.91 1m7t h HIS 43 N 0.21 1.10 -0.69 0.41 2.76 -1.31 -2.87 115.15 114.77 1m7t h HIS 43 Ca 0.07 -0.21 -0.00 0.00 -2.20 0.00 0.00 60.37 58.03 1m7t h HIS 43 Cb 0.45 -0.28 -0.03 0.00 1.55 0.00 0.00 27.41 29.09 1m7t h HIS 43 CO 0.04 1.01 0.42 0.77 -1.30 0.00 0.00 177.93 178.87 1m7t h SER 44 N 0.90 0.82 -0.56 3.26 0.02 -1.46 -2.59 113.55 113.94 1m7t h SER 44 Ca 0.15 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1m7t h SER 44 Cb 0.62 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 1m7t h SER 44 CO 0.04 0.63 0.37 -0.07 -1.14 0.00 0.00 176.83 176.66 1m7t h LEU 45 N 0.93 0.65 -2.02 5.07 3.38 -1.35 -1.03 115.31 120.96 1m7t h LEU 45 Ca 0.25 -0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.29 1m7t h LEU 45 Cb -0.04 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1m7t h LEU 45 CO -0.05 0.48 0.40 0.77 0.09 0.00 0.00 178.44 180.13 1m7t h SER 46 N 0.76 0.00 1.21 -0.43 4.64 -1.24 0.59 113.55 119.07 1m7t h SER 46 Ca 0.20 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.47 1m7t h SER 46 Cb -0.07 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 1m7t h SER 46 CO -0.04 0.00 -0.82 -0.33 -0.87 0.00 0.00 176.83 174.77 1m7t h GLU 47 N 0.00 0.00 0.00 4.77 5.08 -1.08 -3.30 114.58 120.05 1m7t h GLU 47 Ca 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1m7t h GLU 47 Cb 0.95 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.20 1m7t h GLU 47 CO -0.00 0.13 -1.43 1.17 -1.00 0.00 0.00 179.01 177.88 1m7t n LYS 48 N -2.89 0.58 -3.28 2.33 4.81 0.13 -4.70 118.16 115.13 1m7t n LYS 48 Ca -0.01 -0.03 -0.46 0.00 -0.87 0.00 0.00 58.31 56.93 1m7t n LYS 48 Cb 0.64 -1.66 -0.03 0.00 0.02 0.00 0.00 35.03 33.99 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 -3.40 3.56 -0.48 5.64 1.51 0.16 -4.93 117.35 119.41 1m7t s TYR 49 Ca -0.03 -1.74 -0.04 0.00 -1.01 0.00 0.00 57.07 54.25 1m7t s TYR 49 Cb 0.12 -3.86 0.05 0.00 -0.11 0.00 0.00 41.96 38.16 1m7t s TYR 49 CO 0.84 -1.05 2.80 0.45 -1.11 0.00 0.00 175.55 177.48 1m7t n SER 50 N 4.57 6.50 0.00 2.29 2.88 -1.26 -3.83 113.62 124.77 1m7t n SER 50 Ca 0.07 -3.17 0.00 0.00 -1.33 0.00 0.00 58.87 54.44 1m7t n SER 50 Cb 0.45 -1.25 0.00 0.00 -0.75 0.00 0.00 64.21 62.66 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 1.01 0.00 -4.91 -3.46 2.85 -1.26 -5.13 115.26 104.36 1m7t n ASN 51 Ca 0.49 0.00 -0.29 0.00 -0.11 0.00 0.00 54.58 54.68 1m7t n ASN 51 Cb 0.55 0.09 -0.03 0.00 1.24 0.00 0.00 39.78 41.63 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 -1.27 5.06 -0.30 3.44 -7.23 -1.25 -4.28 120.40 114.57 1m7t s VAL 52 Ca 0.00 -0.02 -0.08 0.00 -1.81 0.00 0.00 61.98 60.07 1m7t s VAL 52 Cb 0.00 -3.72 -0.00 0.00 0.56 0.00 0.00 36.38 33.21 1m7t s VAL 52 CO 0.00 -0.27 0.12 -0.51 -0.31 0.00 0.00 175.10 174.13 1m7t s ILE 53 N -2.01 4.35 -0.33 -0.62 1.10 0.43 -4.95 121.20 119.16 1m7t s ILE 53 Ca 0.43 -0.50 -0.15 0.00 -0.51 0.00 0.00 60.65 59.91 1m7t s ILE 53 Cb -0.11 -3.21 -0.02 0.00 0.15 0.00 0.00 42.46 39.27 1m7t s ILE 53 CO 0.29 0.09 0.36 -0.36 -2.11 0.00 0.00 174.94 173.21 1m7t s PHE 54 N 1.57 3.21 0.29 3.50 0.40 -1.21 -2.55 117.98 123.19 1m7t s PHE 54 Ca 0.04 0.02 0.05 0.00 -0.60 0.00 0.00 56.93 56.44 1m7t s PHE 54 Cb -0.17 -2.66 -0.06 0.00 0.51 0.00 0.00 43.02 40.64 1m7t s PHE 54 CO 0.05 -0.41 -0.01 -0.48 0.70 0.00 0.00 175.22 175.07 1m7t s LEU 55 N 2.02 2.34 -0.20 -0.37 0.05 -1.21 -3.72 118.68 117.59 1m7t s LEU 55 Ca 0.12 -1.26 -0.00 0.00 0.05 0.00 0.00 54.13 53.04 1m7t s LEU 55 Cb -0.16 -0.48 0.02 0.00 -2.05 0.00 0.00 46.19 43.51 1m7t s LEU 55 CO 0.12 -0.47 -0.15 -0.70 -0.55 0.00 0.00 176.35 174.60 1m7t s GLU 56 N -3.81 2.98 -0.22 1.48 2.56 -1.17 -3.56 118.70 116.97 1m7t s GLU 56 Ca 0.32 -0.85 -0.01 0.00 0.00 0.00 0.00 54.97 54.42 1m7t s GLU 56 Cb 0.06 -2.73 0.02 0.00 2.00 0.00 0.00 34.13 33.48 1m7t s GLU 56 CO 0.12 -0.26 -0.11 0.08 -0.56 0.00 0.00 175.26 174.53 1m7t s VAL 57 N 1.31 2.66 -0.28 3.70 1.01 -1.03 -0.58 120.40 127.19 1m7t s VAL 57 Ca 0.03 -0.88 -0.12 0.00 0.00 0.00 0.00 61.98 61.02 1m7t s VAL 57 Cb -0.14 -2.24 -0.05 0.00 0.00 0.00 0.00 36.38 33.95 1m7t s VAL 57 CO -0.10 0.38 0.22 1.51 0.00 0.00 0.00 175.10 177.11 1m7t s ASP 58 N 1.34 6.06 0.51 3.32 -4.77 -1.26 -2.52 116.67 119.36 1m7t s ASP 58 Ca 0.03 0.04 0.35 0.00 -3.30 0.00 0.00 52.55 49.67 1m7t s ASP 58 Cb -0.15 -2.13 1.84 0.00 -1.09 0.00 0.00 42.92 41.39 1m7t s ASP 58 CO -0.07 -0.07 2.06 1.62 0.70 0.00 0.00 175.17 179.41 1m7t h VAL 59 N 5.36 0.00 -0.79 2.11 3.04 -1.74 0.80 116.25 125.04 1m7t h VAL 59 Ca -0.35 -0.05 -0.05 0.00 -1.01 0.00 0.00 66.70 65.25 1m7t h VAL 59 Cb 1.19 0.84 -0.03 0.00 -2.01 0.00 0.00 31.29 31.28 1m7t h VAL 59 CO 0.57 0.00 0.30 -0.78 -1.01 0.00 0.00 177.57 176.65 1m7t h ASP 60 N 0.00 1.10 0.05 3.17 1.82 -1.93 -1.12 116.42 119.51 1m7t h ASP 60 Ca 0.00 -0.18 -0.37 0.00 -0.39 0.00 0.00 57.03 56.08 1m7t h ASP 60 Cb 0.05 -0.29 -0.06 0.00 0.68 0.00 0.00 39.33 39.71 1m7t h ASP 60 CO 0.00 0.98 -2.35 0.47 -1.61 0.00 0.00 179.24 176.74 1m7t n ASP 61 N -4.27 1.32 -2.23 2.28 8.00 -0.62 -4.42 116.55 116.61 1m7t n ASP 61 Ca 0.07 -0.02 -0.27 0.00 0.71 0.00 0.00 54.79 55.28 1m7t n ASP 61 Cb 0.20 -0.01 0.04 0.00 -0.02 0.00 0.00 41.12 41.33 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 -3.03 5.88 0.47 2.24 0.00 0.27 -4.41 120.51 121.93 1m7t n ALA 62 Ca -0.39 -2.75 0.08 0.00 0.00 0.00 0.00 53.44 50.39 1m7t n ALA 62 Cb 1.05 -1.68 0.35 0.00 0.00 0.00 0.00 19.45 19.18 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 -0.16 0.05 0.05 0.00 7.27 -0.43 -2.32 117.38 121.84 1m7t n GLN 63 Ca 0.47 0.30 0.07 0.00 0.07 0.00 0.00 57.00 57.91 1m7t n GLN 63 Cb 0.58 -1.59 -0.07 0.00 2.41 0.00 0.00 30.24 31.56 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 0.61 0.00 1.69 9.92 -1.26 -4.17 116.55 121.65 1m7t n ASP 64 Ca 0.03 0.25 -0.18 0.00 -0.53 0.00 0.00 54.79 54.36 1m7t n ASP 64 Cb 0.18 0.77 -0.14 0.00 -0.64 0.00 0.00 41.12 41.29 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 1.58 -0.16 2.53 -1.51 -1.83 -3.31 116.25 113.55 1m7t h VAL 65 Ca -0.07 -2.46 0.05 0.00 -1.23 0.00 0.00 66.70 62.98 1m7t h VAL 65 Cb 1.21 3.23 -0.07 0.00 -2.13 0.00 0.00 31.29 33.54 1m7t h VAL 65 CO 0.01 0.67 -0.40 0.00 -1.23 0.00 0.00 177.57 176.62 1m7t h ALA 66 N 0.04 -0.53 -0.72 5.19 0.00 -1.73 0.50 119.26 122.01 1m7t h ALA 66 Ca -0.10 0.00 0.21 0.00 0.00 0.00 0.00 54.91 55.02 1m7t h ALA 66 Cb 1.42 0.76 -0.03 0.00 0.00 0.00 0.00 17.79 19.94 1m7t h ALA 66 CO 0.09 -0.89 0.59 -1.35 0.00 0.00 0.00 179.25 177.69 1m7t h PRO 67 N -0.46 0.00 0.00 0.00 0.11 -1.73 1.14 132.00 131.07 1m7t h PRO 67 Ca 0.09 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.12 1m7t h PRO 67 Cb 0.61 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.71 1m7t h PRO 67 CO -0.41 0.00 -0.34 -0.22 -0.21 0.00 0.00 178.00 176.82 1m7t h LYS 68 N 0.00 0.00 -0.01 1.05 3.64 -1.00 -3.16 116.57 117.10 1m7t h LYS 68 Ca 0.34 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.72 1m7t h LYS 68 Cb 1.52 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.34 1m7t h LYS 68 CO -0.00 0.34 -0.38 0.66 -2.27 0.00 0.00 179.45 177.79 1m7t n TYR 69 N -3.37 0.00 -3.14 1.91 4.01 0.31 -5.01 117.16 111.87 1m7t n TYR 69 Ca 0.01 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.58 1m7t n TYR 69 Cb 0.54 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.62 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 1.12 -0.09 3.73 2.72 0.00 0.30 -4.98 105.19 107.99 1m7t n GLY 70 Ca 0.04 -0.06 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 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 -3.16 4.13 -0.35 -0.61 1.01 -1.12 -4.94 121.20 116.15 1m7t s ILE 71 Ca 0.36 1.68 0.14 0.00 0.00 0.00 0.00 60.65 62.83 1m7t s ILE 71 Cb -0.16 -4.08 0.43 0.00 0.01 0.00 0.00 42.46 38.67 1m7t s ILE 71 CO 0.44 0.22 1.16 -1.14 0.00 0.00 0.00 174.94 175.62 1m7t n ARG 72 N 3.10 1.21 -3.15 2.79 3.00 -1.26 -4.83 116.66 117.53 1m7t n ARG 72 Ca 0.05 -2.55 0.06 0.00 -0.00 0.00 0.00 57.85 55.41 1m7t n ARG 72 Cb 0.47 -0.66 -0.00 0.00 0.00 0.00 0.00 32.46 32.27 1m7t n ARG 72 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1m7t s GLY 73 N -2.23 -0.76 0.07 5.14 0.00 -1.26 -5.15 107.32 103.13 1m7t s GLY 73 Ca 0.24 2.36 0.01 0.00 0.00 0.00 0.00 44.72 47.33 1m7t s GLY 73 CO -0.03 4.10 0.17 -0.26 0.00 0.00 0.00 173.10 177.07 1m7t s ILE 74 N 2.97 5.10 -0.36 0.90 -4.36 -1.26 -2.59 121.20 121.59 1m7t s ILE 74 Ca 0.22 -0.52 -0.29 0.00 -0.26 0.00 0.00 60.65 59.80 1m7t s ILE 74 Cb -0.03 -3.48 0.02 0.00 1.25 0.00 0.00 42.46 40.22 1m7t s ILE 74 CO -0.20 0.13 1.16 -2.84 0.24 0.00 0.00 174.94 173.44 1m7t s PRO 75 N -2.47 3.91 0.03 0.37 0.02 -1.26 -4.62 135.00 130.98 1m7t s PRO 75 Ca 0.33 0.97 -0.23 0.00 0.02 0.00 0.00 61.00 62.08 1m7t s PRO 75 Cb -0.13 -3.83 -0.06 0.00 0.02 0.00 0.00 34.50 30.51 1m7t s PRO 75 CO 0.26 -1.12 0.70 0.99 -0.33 0.00 0.00 177.00 177.50 1m7t s THR 76 N 4.12 4.79 -0.19 0.99 2.01 -1.06 -1.70 115.64 124.59 1m7t s THR 76 Ca 0.49 1.47 -0.05 0.00 0.31 0.00 0.00 61.69 63.91 1m7t s THR 76 Cb -0.12 -4.04 -0.03 0.00 0.01 0.00 0.00 72.50 68.33 1m7t s THR 76 CO 0.22 0.40 0.01 -0.76 -0.69 0.00 0.00 174.62 173.80 1m7t s LEU 77 N -0.17 3.34 -0.08 4.42 1.02 0.27 0.63 118.68 128.11 1m7t s LEU 77 Ca 0.35 -0.15 0.04 0.00 0.02 0.00 0.00 54.13 54.40 1m7t s LEU 77 Cb -0.20 -1.84 -0.01 0.00 0.02 0.00 0.00 46.19 44.16 1m7t s LEU 77 CO 0.21 0.09 -0.22 -0.76 0.02 0.00 0.00 176.35 175.70 1m7t s LEU 78 N 0.82 2.26 -0.16 1.79 1.43 0.87 0.16 118.68 125.84 1m7t s LEU 78 Ca 0.01 -0.45 -0.02 0.00 -1.03 0.00 0.00 54.13 52.64 1m7t s LEU 78 Cb -0.14 -1.44 -0.01 0.00 0.03 0.00 0.00 46.19 44.63 1m7t s LEU 78 CO 0.02 0.23 -0.10 -0.76 0.23 0.00 0.00 176.35 175.97 1m7t s LEU 79 N -0.06 2.77 0.08 1.79 2.01 0.83 0.73 118.68 126.83 1m7t s LEU 79 Ca -0.06 -0.36 0.09 0.00 0.01 0.00 0.00 54.13 53.82 1m7t s LEU 79 Cb -0.14 -1.66 -0.03 0.00 0.01 0.00 0.00 46.19 44.36 1m7t s LEU 79 CO 0.05 0.09 -0.24 -0.36 1.01 0.00 0.00 176.35 176.90 1m7t s PHE 80 N 0.79 2.40 -0.20 0.29 0.08 0.27 -1.02 117.98 120.58 1m7t s PHE 80 Ca -0.04 -0.35 -0.04 0.00 0.12 0.00 0.00 56.93 56.62 1m7t s PHE 80 Cb -0.15 -1.36 0.09 0.00 -0.57 0.00 0.00 43.02 41.03 1m7t s PHE 80 CO 0.01 0.25 0.21 0.21 -0.10 0.00 0.00 175.22 175.80 1m7t s LYS 81 N -1.62 0.18 -1.22 0.44 2.20 0.28 -0.51 119.74 119.48 1m7t s LYS 81 Ca 0.14 0.20 -0.03 0.00 -0.36 0.00 0.00 55.97 55.92 1m7t s LYS 81 Cb -0.10 -1.21 0.00 0.00 -1.51 0.00 0.00 37.83 35.01 1m7t s LYS 81 CO 0.05 -0.64 1.04 0.09 -0.36 0.00 0.00 175.35 175.53 1m7t n ASN 82 N 5.32 -3.57 0.00 1.43 5.03 -1.25 -1.83 115.26 120.39 1m7t n ASN 82 Ca -0.06 -0.58 0.00 0.00 0.87 0.00 0.00 54.58 54.82 1m7t n ASN 82 Cb 0.49 -4.98 0.00 0.00 -1.02 0.00 0.00 39.78 34.28 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 -1.43 1.18 3.32 7.41 0.00 -1.26 -4.98 105.19 109.42 1m7t n GLY 83 Ca -0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 1m7t n GLY 83 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1m7t s GLU 84 N -0.20 2.81 -0.16 1.61 4.04 -0.76 -5.09 118.70 120.96 1m7t s GLU 84 Ca 0.00 -0.81 -0.29 0.00 0.04 0.00 0.00 54.97 53.91 1m7t s GLU 84 Cb 0.00 -2.33 -0.04 0.00 0.02 0.00 0.00 34.13 31.78 1m7t s GLU 84 CO 0.00 0.36 1.67 0.54 -1.84 0.00 0.00 175.26 175.99 1m7t s VAL 85 N -0.07 3.60 -0.93 1.83 0.11 -1.26 0.10 120.40 123.79 1m7t s VAL 85 Ca -0.05 0.70 0.12 0.00 -2.93 0.00 0.00 61.98 59.82 1m7t s VAL 85 Cb -0.14 -3.57 0.36 0.00 -1.53 0.00 0.00 36.38 31.50 1m7t s VAL 85 CO 0.04 -0.20 1.30 0.00 -3.33 0.00 0.00 175.10 172.92 1m7t n ALA 86 N 8.21 2.29 -3.65 1.54 0.00 -0.19 -4.90 120.51 123.82 1m7t n ALA 86 Ca 0.19 -1.28 -0.03 0.00 0.00 0.00 0.00 53.44 52.32 1m7t n ALA 86 Cb 0.44 -0.51 -0.07 0.00 0.00 0.00 0.00 19.45 19.32 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 -1.20 -2.26 -0.04 0.00 0.00 -1.17 -5.00 121.76 112.09 1m7t s ALA 87 Ca 0.27 1.83 -0.01 0.00 0.00 0.00 0.00 51.96 54.05 1m7t s ALA 87 Cb 0.16 -1.74 0.03 0.00 0.00 0.00 0.00 23.12 21.56 1m7t s ALA 87 CO 0.16 -0.19 0.01 0.99 0.00 0.00 0.00 175.76 176.74 1m7t s THR 88 N 0.38 0.18 0.05 0.00 2.01 -1.26 -0.12 115.64 116.88 1m7t s THR 88 Ca 0.02 0.17 0.08 0.00 0.31 0.00 0.00 61.69 62.27 1m7t s THR 88 Cb -0.04 -0.33 -0.03 0.00 0.01 0.00 0.00 72.50 72.11 1m7t s THR 88 CO -0.13 0.19 -0.23 -0.54 -0.69 0.00 0.00 174.62 173.22 1m7t s LYS 89 N 1.56 1.53 0.08 4.92 -0.14 0.12 -5.00 119.74 122.81 1m7t s LYS 89 Ca -0.02 -1.03 0.10 0.00 -1.36 0.00 0.00 55.97 53.65 1m7t s LYS 89 Cb -0.13 -1.69 -0.03 0.00 -1.68 0.00 0.00 37.83 34.30 1m7t s LYS 89 CO -0.03 0.43 -0.26 0.08 -0.76 0.00 0.00 175.35 174.81 1m7t s VAL 90 N -0.83 2.22 0.08 3.17 1.01 -1.26 0.95 120.40 125.74 1m7t s VAL 90 Ca 0.09 -1.53 0.00 0.00 0.00 0.00 0.00 61.98 60.54 1m7t s VAL 90 Cb -0.09 -1.91 0.00 0.00 0.00 0.00 0.00 36.38 34.37 1m7t s VAL 90 CO 0.02 0.25 0.00 0.61 0.00 0.00 0.00 175.10 175.99 1m7t n GLY 91 N 1.42 -2.74 3.77 4.51 0.00 -0.69 -4.91 105.19 106.54 1m7t n GLY 91 Ca -0.17 -1.38 -0.40 0.00 0.00 0.00 0.00 46.02 44.06 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 -3.25 3.38 0.09 4.61 0.00 -1.26 -4.76 121.76 120.57 1m7t s ALA 92 Ca 0.00 1.06 0.06 0.00 0.00 0.00 0.00 51.96 53.08 1m7t s ALA 92 Cb 0.00 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.69 1m7t s ALA 92 CO 0.00 -0.44 -0.15 -0.48 0.00 0.00 0.00 175.76 174.68 1m7t s LEU 93 N -1.84 2.31 1.35 0.00 2.34 -1.26 -5.11 118.68 116.46 1m7t s LEU 93 Ca 0.49 -0.67 -0.22 0.00 0.06 0.00 0.00 54.13 53.79 1m7t s LEU 93 Cb -0.35 -0.60 0.34 0.00 -0.56 0.00 0.00 46.19 45.03 1m7t s LEU 93 CO 0.45 -0.06 1.01 -0.55 -1.06 0.00 0.00 176.35 176.13 1m7t s SER 94 N -1.92 -0.38 0.25 1.48 0.15 -1.26 -4.78 113.70 107.24 1m7t s SER 94 Ca 0.02 0.70 0.05 0.00 0.70 0.00 0.00 55.95 57.42 1m7t s SER 94 Cb -0.09 -0.96 0.30 0.00 -1.71 0.00 0.00 66.02 63.56 1m7t s SER 94 CO 0.03 -4.93 1.59 0.50 1.20 0.00 0.00 173.24 171.63 1m7t h LYS 95 N -3.13 0.23 0.01 5.44 3.64 -1.99 -2.63 116.57 118.13 1m7t h LYS 95 Ca -0.43 -0.14 -0.19 0.00 -1.27 0.00 0.00 60.65 58.62 1m7t h LYS 95 Cb 1.32 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.13 1m7t h LYS 95 CO 0.28 0.73 -0.89 0.78 -2.27 0.00 0.00 179.45 178.08 1m7t h GLY 96 N 1.43 0.08 1.88 5.01 0.00 -1.99 -2.46 103.07 107.02 1m7t h GLY 96 Ca -0.00 -0.15 -0.19 0.00 0.00 0.00 0.00 47.33 46.99 1m7t h GLY 96 CO 0.09 0.13 -0.88 1.46 0.00 0.00 0.00 176.54 177.34 1m7t h GLN 97 N 0.03 0.10 0.05 4.80 4.20 -1.90 -1.67 115.11 120.73 1m7t h GLN 97 Ca -0.02 -0.12 -0.00 0.00 0.06 0.00 0.00 58.65 58.56 1m7t h GLN 97 Cb 1.54 0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.36 1m7t h GLN 97 CO 0.12 0.91 -0.03 1.25 -0.67 0.00 0.00 178.83 180.42 1m7t h LEU 98 N 0.05 -0.06 -0.77 1.46 6.46 -1.50 -2.39 115.31 118.56 1m7t h LEU 98 Ca -0.03 -0.51 -0.01 0.00 -0.12 0.00 0.00 57.88 57.21 1m7t h LEU 98 Cb 1.53 0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 41.44 1m7t h LEU 98 CO 0.13 0.51 0.46 0.50 -0.62 0.00 0.00 178.44 179.41 1m7t h LYS 99 N -0.66 1.06 -0.81 1.25 3.64 -1.51 -1.26 116.57 118.27 1m7t h LYS 99 Ca -0.01 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.25 1m7t h LYS 99 Cb 0.57 -0.22 -0.04 0.00 -0.41 0.00 0.00 32.23 32.13 1m7t h LYS 99 CO 0.01 0.76 0.42 1.05 -2.27 0.00 0.00 179.45 179.42 1m7t h GLU 100 N 1.06 1.14 -0.61 1.90 -0.00 -1.36 0.29 114.58 117.01 1m7t h GLU 100 Ca 0.28 -0.14 -0.04 0.00 -0.00 0.00 0.00 59.36 59.46 1m7t h GLU 100 Cb -0.02 -0.22 -0.03 0.00 -0.00 0.00 0.00 28.75 28.49 1m7t h GLU 100 CO -0.05 0.86 0.24 0.35 -0.00 0.00 0.00 179.01 180.41 1m7t h PHE 101 N 1.14 0.93 0.57 2.06 3.57 -0.87 -0.60 116.94 123.75 1m7t h PHE 101 Ca 0.28 -0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 1m7t h PHE 101 Cb 0.06 -0.28 0.01 0.00 2.79 0.00 0.00 35.95 38.53 1m7t h PHE 101 CO 0.01 0.74 -0.27 -0.07 -2.23 0.00 0.00 178.31 176.49 1m7t h LEU 102 N 0.85 -0.65 -1.51 0.59 3.38 -0.58 -2.28 115.31 115.12 1m7t h LEU 102 Ca 0.20 -0.03 0.28 0.00 0.09 0.00 0.00 57.88 58.42 1m7t h LEU 102 Cb 0.21 0.17 -0.08 0.00 0.09 0.00 0.00 40.66 41.04 1m7t h LEU 102 CO -0.02 -0.27 0.70 -0.78 0.09 0.00 0.00 178.44 178.17 1m7t h ASP 103 N -1.10 0.34 1.38 -0.43 1.82 -0.42 1.24 116.42 119.24 1m7t h ASP 103 Ca -0.08 0.07 -0.01 0.00 -0.39 0.00 0.00 57.03 56.62 1m7t h ASP 103 Cb 0.64 0.01 -0.00 0.00 0.68 0.00 0.00 39.33 40.66 1m7t h ASP 103 CO 0.13 0.06 -0.04 0.00 -1.61 0.00 0.00 179.24 177.78 1m7t h ALA 104 N 1.58 0.99 0.00 -0.78 0.00 -0.95 -3.33 119.26 116.78 1m7t h ALA 104 Ca 0.58 -0.04 -0.21 0.00 0.00 0.00 0.00 54.91 55.25 1m7t h ALA 104 Cb 1.66 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.40 1m7t h ALA 104 CO -0.23 0.05 -1.78 -1.71 0.00 0.00 0.00 179.25 175.58 1m7t n ASN 105 N -3.13 2.47 -4.63 0.00 5.15 0.24 -4.95 115.26 110.42 1m7t n ASN 105 Ca 0.02 -0.03 -0.43 0.00 -0.60 0.00 0.00 54.58 53.54 1m7t n ASN 105 Cb 0.41 0.43 -0.03 0.00 -0.53 0.00 0.00 39.78 40.07 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 -5.17 3.84 0.00 1.20 1.98 0.36 -5.05 118.68 115.84 1m7t s LEU 106 Ca -0.10 1.59 0.00 0.00 -2.89 0.00 0.00 54.13 52.73 1m7t s LEU 106 Cb 0.04 -3.53 0.00 0.00 0.66 0.00 0.00 46.19 43.36 1m7t s LEU 106 CO 0.41 -1.32 0.00 1.33 -1.89 0.00 0.00 176.35 174.88