#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rem s LEU 5 N 0.00 4.39 0.31 2.39 1.43 -1.26 -4.93 118.68 121.01 2rem s LEU 5 Ca 0.00 2.75 -0.27 0.00 -1.03 0.00 0.00 54.13 55.58 2rem s LEU 5 Cb 0.00 -3.64 -0.14 0.00 0.03 0.00 0.00 46.19 42.44 2rem s LEU 5 CO 0.00 -0.66 0.98 -2.65 0.23 0.00 0.00 176.35 174.25 2rem n PRO 6 N 1.29 1.30 -5.15 1.29 -0.02 -1.26 -4.98 135.00 127.46 2rem n PRO 6 Ca 0.03 0.46 -0.31 0.00 -2.02 0.00 0.00 63.50 61.66 2rem n PRO 6 Cb 0.41 -1.84 -0.17 0.00 -0.02 0.00 0.00 33.50 31.88 2rem n PRO 6 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2rem s VAL 7 N -1.11 1.92 0.51 -1.45 1.01 -1.26 -4.98 120.40 115.04 2rem s VAL 7 Ca 0.59 -0.97 -0.23 0.00 0.00 0.00 0.00 61.98 61.38 2rem s VAL 7 Cb -0.68 -1.64 -0.06 0.00 0.00 0.00 0.00 36.38 34.00 2rem s VAL 7 CO 0.59 0.53 1.32 0.55 0.00 0.00 0.00 175.10 178.09 2rem n VAL 8 N 3.20 3.43 0.00 2.92 3.14 -1.26 -0.55 118.33 129.21 2rem n VAL 8 Ca -0.18 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.70 2rem n VAL 8 Cb 0.52 -1.62 0.00 0.00 -1.06 0.00 0.00 33.84 31.68 2rem n VAL 8 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2rem n GLY 9 N 0.79 2.52 0.68 7.55 0.00 0.13 -4.69 105.19 112.18 2rem n GLY 9 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 2rem n GLY 9 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2rem n GLU 10 N -1.95 0.22 -0.02 1.61 1.02 -0.64 -4.86 120.64 116.02 2rem n GLU 10 Ca 0.00 0.09 0.06 0.00 -0.02 0.00 0.00 57.16 57.30 2rem n GLU 10 Cb 0.00 -0.87 -0.13 0.00 -0.02 0.00 0.00 31.44 30.42 2rem n GLU 10 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2rem n ASP 11 N -3.53 1.23 -3.57 1.62 8.00 0.29 -4.76 116.55 115.83 2rem n ASP 11 Ca -0.18 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.21 2rem n ASP 11 Cb 0.57 1.65 -0.02 0.00 -0.02 0.00 0.00 41.12 43.30 2rem n ASP 11 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2rem s TYR 12 N -3.05 -0.39 0.21 1.24 -0.85 -1.22 -0.25 117.35 113.02 2rem s TYR 12 Ca -0.06 0.11 0.07 0.00 -0.52 0.00 0.00 57.07 56.67 2rem s TYR 12 Cb 0.10 0.56 -0.05 0.00 0.38 0.00 0.00 41.96 42.95 2rem s TYR 12 CO 0.68 -0.93 -0.13 0.14 -1.52 0.00 0.00 175.55 173.79 2rem s VAL 13 N -3.80 1.65 -0.18 -3.49 -7.23 0.27 0.22 120.40 107.85 2rem s VAL 13 Ca 0.04 -2.19 -0.10 0.00 -1.81 0.00 0.00 61.98 57.93 2rem s VAL 13 Cb -0.02 -2.07 -0.05 0.00 0.56 0.00 0.00 36.38 34.81 2rem s VAL 13 CO -0.07 -0.58 0.16 -0.70 -0.31 0.00 0.00 175.10 173.60 2rem s GLU 14 N -3.67 4.08 -0.30 4.82 2.12 -1.26 -0.64 118.70 123.85 2rem s GLU 14 Ca 0.23 -0.15 -0.25 0.00 0.36 0.00 0.00 54.97 55.15 2rem s GLU 14 Cb 0.00 -3.38 0.01 0.00 0.26 0.00 0.00 34.13 31.01 2rem s GLU 14 CO 0.07 0.37 0.88 0.42 -0.54 0.00 0.00 175.26 176.46 2rem s ILE 15 N 0.15 4.71 0.24 -3.70 1.01 0.65 -4.97 121.20 119.29 2rem s ILE 15 Ca 0.10 1.39 -0.30 0.00 0.00 0.00 0.00 60.65 61.84 2rem s ILE 15 Cb -0.11 -4.23 -0.11 0.00 0.01 0.00 0.00 42.46 38.02 2rem s ILE 15 CO -0.00 -0.30 1.53 -2.16 0.00 0.00 0.00 174.94 174.01 2rem s PRO 16 N 3.15 4.20 -1.62 2.79 0.04 -1.26 -1.69 135.00 140.61 2rem s PRO 16 Ca 0.37 2.42 0.00 0.00 0.04 0.00 0.00 61.00 63.82 2rem s PRO 16 Cb -0.14 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.31 2rem s PRO 16 CO 0.13 -0.54 0.00 -0.25 0.04 0.00 0.00 177.00 176.37 2rem n ASP 17 N 2.73 -5.41 -4.77 6.66 8.00 -1.26 -4.88 116.55 117.62 2rem n ASP 17 Ca 0.09 0.05 -0.40 0.00 0.71 0.00 0.00 54.79 55.24 2rem n ASP 17 Cb 0.39 -4.53 -0.01 0.00 -0.02 0.00 0.00 41.12 36.95 2rem n ASP 17 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2rem s GLY 18 N -2.07 2.95 -0.01 0.44 0.00 -0.68 -5.02 107.32 102.93 2rem s GLY 18 Ca 0.00 1.35 0.04 0.00 0.00 0.00 0.00 44.72 46.11 2rem s GLY 18 CO 0.00 1.99 -0.12 0.50 0.00 0.00 0.00 173.10 175.47 2rem s ARG 19 N -2.10 0.96 0.83 2.90 0.52 -1.19 -4.73 118.95 116.14 2rem s ARG 19 Ca 0.54 -0.41 -0.11 0.00 -0.52 0.00 0.00 55.73 55.23 2rem s ARG 19 Cb -0.41 -0.92 0.09 0.00 0.52 0.00 0.00 34.95 34.23 2rem s ARG 19 CO 0.54 0.24 1.13 -1.25 0.02 0.00 0.00 175.30 175.99 2rem s PRO 20 N -0.23 1.70 0.29 3.54 0.04 -1.22 -4.36 135.00 134.75 2rem s PRO 20 Ca 0.04 1.42 0.01 0.00 0.04 0.00 0.00 61.00 62.51 2rem s PRO 20 Cb -0.05 -1.81 0.53 0.00 0.04 0.00 0.00 34.50 33.20 2rem s PRO 20 CO -0.00 -2.10 1.87 0.35 0.04 0.00 0.00 177.00 177.16 2rem h PHE 21 N -1.31 1.11 -3.76 0.56 3.04 -1.95 -3.43 116.94 111.20 2rem h PHE 21 Ca -0.44 0.03 -0.31 0.00 3.98 0.00 0.00 57.97 61.23 2rem h PHE 21 Cb 1.26 -0.36 -0.18 0.00 2.56 0.00 0.00 35.95 39.23 2rem h PHE 21 CO 0.53 0.52 -0.73 0.00 -2.02 0.00 0.00 178.31 176.61 2rem s ALA 22 N -5.94 1.06 0.32 2.41 0.00 -1.26 -5.12 121.76 113.22 2rem s ALA 22 Ca -0.12 -1.16 -0.27 0.00 0.00 0.00 0.00 51.96 50.41 2rem s ALA 22 Cb 0.21 0.04 -0.13 0.00 0.00 0.00 0.00 23.12 23.23 2rem s ALA 22 CO 0.81 -0.04 0.98 -2.30 0.00 0.00 0.00 175.76 175.20 2rem n PRO 23 N 0.60 1.30 -0.08 0.00 -0.02 -1.26 -4.89 135.00 130.65 2rem n PRO 23 Ca -0.16 0.46 -0.12 0.00 -2.02 0.00 0.00 63.50 61.65 2rem n PRO 23 Cb 0.58 -1.85 -0.05 0.00 -0.02 0.00 0.00 33.50 32.16 2rem n PRO 23 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2rem h LEU 24 N 1.85 0.47 -2.54 2.45 3.38 -1.95 -3.48 115.31 115.48 2rem h LEU 24 Ca -0.40 -0.39 -0.43 0.00 0.09 0.00 0.00 57.88 56.75 2rem h LEU 24 Cb 1.34 -0.13 0.06 0.00 0.09 0.00 0.00 40.66 42.03 2rem h LEU 24 CO 0.59 0.75 -0.90 0.00 0.09 0.00 0.00 178.44 178.98 2rem n ALA 25 N -2.39 -2.31 0.00 1.53 0.00 -1.26 -1.04 120.51 115.03 2rem n ALA 25 Ca -0.04 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.20 2rem n ALA 25 Cb 0.31 -3.20 0.00 0.00 0.00 0.00 0.00 19.45 16.56 2rem n ALA 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rem n GLY 26 N -1.68 2.98 3.91 0.00 0.00 -1.26 -5.02 105.19 104.11 2rem n GLY 26 Ca -0.19 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 2rem n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rem s LYS 27 N 0.00 3.59 -0.34 1.61 -0.14 -0.21 -4.95 119.74 119.29 2rem s LYS 27 Ca 0.00 0.14 -0.12 0.00 -1.36 0.00 0.00 55.97 54.63 2rem s LYS 27 Cb 0.00 -2.46 -0.01 0.00 -1.68 0.00 0.00 37.83 33.68 2rem s LYS 27 CO 0.00 -0.06 0.23 0.42 -0.76 0.00 0.00 175.35 175.18 2rem s ILE 28 N -2.52 5.08 -0.09 2.17 1.01 0.31 -4.78 121.20 122.39 2rem s ILE 28 Ca 0.46 -0.35 -0.23 0.00 0.00 0.00 0.00 60.65 60.53 2rem s ILE 28 Cb -0.10 -3.65 -0.03 0.00 0.01 0.00 0.00 42.46 38.69 2rem s ILE 28 CO 0.39 -0.04 0.68 -0.70 0.00 0.00 0.00 174.94 175.26 2rem s GLU 29 N 1.68 4.40 -0.24 2.79 2.12 -1.26 -0.44 118.70 127.75 2rem s GLU 29 Ca 0.05 0.81 0.02 0.00 0.36 0.00 0.00 54.97 56.22 2rem s GLU 29 Cb -0.18 -3.47 0.05 0.00 0.26 0.00 0.00 34.13 30.80 2rem s GLU 29 CO 0.09 0.02 -0.12 0.08 -0.54 0.00 0.00 175.26 174.79 2rem s VAL 30 N 0.98 2.04 -0.14 3.70 1.01 0.07 0.08 120.40 128.13 2rem s VAL 30 Ca 0.35 -1.42 -0.07 0.00 0.00 0.00 0.00 61.98 60.84 2rem s VAL 30 Cb -0.17 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 2rem s VAL 30 CO 0.16 0.08 0.11 -0.69 0.00 0.00 0.00 175.10 174.76 2rem s VAL 31 N 1.19 5.24 -0.28 2.92 1.01 0.32 -0.71 120.40 130.09 2rem s VAL 31 Ca -0.06 0.12 -0.08 0.00 0.00 0.00 0.00 61.98 61.96 2rem s VAL 31 Cb -0.18 -3.31 -0.01 0.00 0.00 0.00 0.00 36.38 32.87 2rem s VAL 31 CO -0.07 0.56 0.11 -0.70 0.00 0.00 0.00 175.10 175.00 2rem s GLU 32 N -0.52 3.41 -0.25 2.72 2.12 -0.41 -0.35 118.70 125.42 2rem s GLU 32 Ca 0.12 -0.65 -0.26 0.00 0.36 0.00 0.00 54.97 54.53 2rem s GLU 32 Cb -0.12 -3.43 0.00 0.00 0.26 0.00 0.00 34.13 30.84 2rem s GLU 32 CO 0.02 -0.33 0.91 0.42 -0.54 0.00 0.00 175.26 175.74 2rem s ILE 33 N 1.59 4.76 0.12 -3.70 1.01 0.74 -0.84 121.20 124.88 2rem s ILE 33 Ca 0.05 1.71 0.01 0.00 0.00 0.00 0.00 60.65 62.42 2rem s ILE 33 Cb -0.16 -4.20 -0.04 0.00 0.01 0.00 0.00 42.46 38.06 2rem s ILE 33 CO 0.04 -0.15 -0.03 0.72 0.00 0.00 0.00 174.94 175.53 2rem s PHE 34 N 3.02 0.97 -0.01 3.97 -0.12 -0.61 -1.41 117.98 123.80 2rem s PHE 34 Ca 0.38 -1.00 0.04 0.00 -0.05 0.00 0.00 56.93 56.31 2rem s PHE 34 Cb -0.15 -0.56 -0.01 0.00 -0.63 0.00 0.00 43.02 41.67 2rem s PHE 34 CO 0.08 -0.23 -0.13 0.20 -0.05 0.00 0.00 175.22 175.09 2rem s GLY 35 N -3.08 0.65 0.52 1.99 0.00 -1.26 0.89 107.32 107.03 2rem s GLY 35 Ca 0.17 -0.58 0.20 0.00 0.00 0.00 0.00 44.72 44.51 2rem s GLY 35 CO -0.01 -0.49 2.08 -0.97 0.00 0.00 0.00 173.10 173.70 2rem h TYR 36 N 5.76 0.01 0.00 1.90 0.05 -1.92 -1.94 116.97 120.83 2rem h TYR 36 Ca -0.34 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.44 2rem h TYR 36 Cb 1.17 -0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.90 2rem h TYR 36 CO 0.41 0.01 0.00 0.25 -1.05 0.00 0.00 178.16 177.78 2rem n THR 37 N -4.47 0.27 -3.02 -2.88 -2.24 -1.26 -4.75 114.28 95.94 2rem n THR 37 Ca 0.03 0.06 -0.42 0.00 -2.27 0.00 0.00 64.05 61.45 2rem n THR 37 Cb 0.32 -0.63 -0.06 0.00 -2.10 0.00 0.00 70.33 67.86 2rem n THR 37 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2rem h PRO 39 N 8.25 0.00 -0.43 0.00 0.13 -1.87 -1.88 132.00 136.20 2rem h PRO 39 Ca -0.25 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.85 2rem h PRO 39 Cb 1.10 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 2rem h PRO 39 CO 0.86 0.26 0.18 0.45 -0.23 0.00 0.00 178.00 179.52 2rem h HIS 40 N 0.00 0.65 -0.61 1.56 3.86 -1.92 -1.46 115.15 117.23 2rem h HIS 40 Ca -0.00 -0.05 0.02 0.00 -1.16 0.00 0.00 60.37 59.19 2rem h HIS 40 Cb 0.56 -0.20 -0.04 0.00 1.06 0.00 0.00 27.41 28.79 2rem h HIS 40 CO 0.00 0.56 0.38 0.00 0.86 0.00 0.00 177.93 179.73 2rem h ALA 42 N 1.26 1.09 -0.01 0.00 0.00 -1.09 -1.67 119.26 118.84 2rem h ALA 42 Ca 0.24 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.97 2rem h ALA 42 Cb 0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2rem h ALA 42 CO -0.10 0.26 -0.77 0.45 0.00 0.00 0.00 179.25 179.10 2rem h HIS 43 N 0.94 0.18 0.00 0.00 3.86 -0.59 -3.16 115.15 116.37 2rem h HIS 43 Ca 0.34 -0.09 -0.12 0.00 -1.16 0.00 0.00 60.37 59.35 2rem h HIS 43 Cb 0.12 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.55 2rem h HIS 43 CO -0.04 0.84 -0.56 0.35 0.86 0.00 0.00 177.93 179.38 2rem h PHE 44 N 0.08 0.00 -0.73 2.45 3.57 -0.61 -3.39 116.94 118.31 2rem h PHE 44 Ca -0.02 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.52 2rem h PHE 44 Cb 1.35 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 40.04 2rem h PHE 44 CO 0.02 0.56 0.44 0.22 -2.23 0.00 0.00 178.31 177.32 2rem h ASP 45 N 0.00 0.69 -0.54 0.41 3.58 -1.28 0.57 116.42 119.86 2rem h ASP 45 Ca -0.01 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.43 2rem h ASP 45 Cb 1.43 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 42.32 2rem h ASP 45 CO 0.07 0.46 0.22 0.77 -2.88 0.00 0.00 179.24 177.89 2rem h SER 46 N 0.83 0.73 -0.71 2.28 4.64 -1.80 0.48 113.55 120.00 2rem h SER 46 Ca 0.31 -0.16 -0.05 0.00 -0.47 0.00 0.00 61.79 61.42 2rem h SER 46 Cb 0.11 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 61.98 2rem h SER 46 CO -0.15 0.69 0.26 0.11 -0.87 0.00 0.00 176.83 176.88 2rem h LYS 47 N 0.73 1.08 -0.37 4.77 1.57 -1.58 -1.82 116.57 120.95 2rem h LYS 47 Ca 0.18 -0.21 -0.11 0.00 -1.87 0.00 0.00 60.65 58.64 2rem h LYS 47 Cb 0.18 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 2rem h LYS 47 CO -0.02 0.91 -0.21 1.25 -0.57 0.00 0.00 179.45 180.81 2rem h LEU 48 N 1.03 0.82 -0.68 2.94 5.85 -0.23 -1.38 115.31 123.66 2rem h LEU 48 Ca 0.23 -0.42 -0.10 0.00 0.84 0.00 0.00 57.88 58.44 2rem h LEU 48 Cb 0.25 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2rem h LEU 48 CO -0.01 1.06 -0.02 1.56 -0.34 0.00 0.00 178.44 180.68 2rem h GLN 49 N 0.58 1.00 -0.40 1.25 1.08 0.04 0.13 115.11 118.79 2rem h GLN 49 Ca 0.08 -0.32 -0.01 0.00 -1.45 0.00 0.00 58.65 56.95 2rem h GLN 49 Cb 0.77 -0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.08 2rem h GLN 49 CO 0.06 1.00 0.22 0.00 -0.95 0.00 0.00 178.83 179.15 2rem h ALA 50 N 1.05 0.52 -0.43 3.87 0.00 -1.21 -1.28 119.26 121.78 2rem h ALA 50 Ca 0.16 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.03 2rem h ALA 50 Cb 0.56 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 2rem h ALA 50 CO 0.03 0.05 0.20 2.35 0.00 0.00 0.00 179.25 181.88 2rem h TRP 51 N 0.52 0.36 -0.83 0.00 7.01 -0.91 -1.98 115.95 120.12 2rem h TRP 51 Ca 0.14 0.02 0.10 0.00 2.11 0.00 0.00 58.89 61.26 2rem h TRP 51 Cb 0.07 -0.10 -0.07 0.00 -2.10 0.00 0.00 29.16 26.95 2rem h TRP 51 CO -0.02 0.17 0.47 0.78 -2.79 0.00 0.00 178.44 177.05 2rem h GLY 52 N 0.40 1.29 2.00 2.65 0.00 -0.19 -1.55 103.07 107.68 2rem h GLY 52 Ca 0.19 -0.31 -0.05 0.00 0.00 0.00 0.00 47.33 47.16 2rem h GLY 52 CO -0.15 0.12 -0.22 0.00 0.00 0.00 0.00 176.54 176.29 2rem h ALA 53 N 1.46 1.01 -0.00 3.60 0.00 -0.76 -2.78 119.26 121.79 2rem h ALA 53 Ca 0.40 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2rem h ALA 53 Cb 0.38 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2rem h ALA 53 CO -0.25 0.28 -0.01 0.54 0.00 0.00 0.00 179.25 179.80 2rem n ARG 54 N -3.37 0.13 -2.84 0.00 1.74 -0.59 -4.95 116.66 106.77 2rem n ARG 54 Ca 0.00 -0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.75 2rem n ARG 54 Cb 0.44 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.31 2rem n ARG 54 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2rem s GLN 55 N -2.88 4.20 1.06 5.56 -1.52 -1.05 -5.05 119.66 119.99 2rem s GLN 55 Ca 0.18 1.07 -0.12 0.00 -1.95 0.00 0.00 55.36 54.54 2rem s GLN 55 Cb 0.19 -2.20 0.23 0.00 -0.22 0.00 0.00 33.01 31.01 2rem s GLN 55 CO 0.51 -0.02 1.07 0.00 -0.25 0.00 0.00 175.29 176.61 2rem s ALA 56 N -2.17 0.31 0.21 6.09 0.00 -1.26 -4.91 121.76 120.03 2rem s ALA 56 Ca 0.61 0.05 0.28 0.00 0.00 0.00 0.00 51.96 52.90 2rem s ALA 56 Cb -0.09 -3.28 1.20 0.00 0.00 0.00 0.00 23.12 20.95 2rem s ALA 56 CO 0.14 -3.36 1.94 0.87 0.00 0.00 0.00 175.76 175.35 2rem h LYS 57 N -2.28 0.00 0.00 0.00 1.57 -2.00 -2.10 116.57 111.76 2rem h LYS 57 Ca -0.55 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.23 2rem h LYS 57 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.62 2rem h LYS 57 CO 0.49 0.14 0.00 -0.40 -0.57 0.00 0.00 179.45 179.11 2rem n ASP 58 N -3.37 0.00 -4.67 0.86 5.75 -1.26 -4.67 116.55 109.19 2rem n ASP 58 Ca -0.00 0.26 -0.41 0.00 -0.01 0.00 0.00 54.79 54.63 2rem n ASP 58 Cb 0.34 -0.40 -0.05 0.00 -1.03 0.00 0.00 41.12 39.99 2rem n ASP 58 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2rem s VAL 59 N -2.80 4.93 -0.41 2.12 1.01 -0.79 0.11 120.40 124.58 2rem s VAL 59 Ca 0.14 1.50 -0.11 0.00 0.00 0.00 0.00 61.98 63.51 2rem s VAL 59 Cb 0.13 -4.08 0.05 0.00 0.00 0.00 0.00 36.38 32.49 2rem s VAL 59 CO 0.33 0.06 0.26 -0.60 0.00 0.00 0.00 175.10 175.16 2rem s ARG 60 N 2.01 2.76 -0.23 2.72 3.52 0.41 -4.90 118.95 125.24 2rem s ARG 60 Ca 0.35 -1.27 -0.14 0.00 -0.13 0.00 0.00 55.73 54.54 2rem s ARG 60 Cb -0.16 -3.82 -0.04 0.00 -1.56 0.00 0.00 34.95 29.36 2rem s ARG 60 CO 0.12 -0.86 0.34 0.12 -0.81 0.00 0.00 175.30 174.22 2rem s PHE 61 N 1.52 3.32 -0.04 5.12 5.36 -1.26 -0.75 117.98 131.25 2rem s PHE 61 Ca 0.03 0.46 0.02 0.00 -0.96 0.00 0.00 56.93 56.48 2rem s PHE 61 Cb -0.21 -2.49 0.01 0.00 -0.34 0.00 0.00 43.02 39.98 2rem s PHE 61 CO 0.05 -0.07 -0.09 0.99 -1.46 0.00 0.00 175.22 174.64 2rem s THR 62 N 1.53 0.80 -0.00 0.12 2.01 0.11 -4.98 115.64 115.23 2rem s THR 62 Ca 0.15 -0.33 -0.21 0.00 0.31 0.00 0.00 61.69 61.61 2rem s THR 62 Cb -0.15 -0.73 -0.05 0.00 0.01 0.00 0.00 72.50 71.58 2rem s THR 62 CO 0.08 0.26 0.61 -0.76 -0.69 0.00 0.00 174.62 174.12 2rem s LEU 63 N 0.43 4.42 -0.13 4.42 1.43 -1.26 -1.29 118.68 126.69 2rem s LEU 63 Ca -0.07 1.18 -0.00 0.00 -1.03 0.00 0.00 54.13 54.20 2rem s LEU 63 Cb -0.11 -2.94 0.03 0.00 0.03 0.00 0.00 46.19 43.20 2rem s LEU 63 CO 0.01 0.10 -0.08 -0.69 0.23 0.00 0.00 176.35 175.91 2rem s VAL 64 N -0.18 1.15 0.40 -1.59 1.01 -0.02 -4.94 120.40 116.23 2rem s VAL 64 Ca 0.31 -0.42 -0.25 0.00 0.00 0.00 0.00 61.98 61.62 2rem s VAL 64 Cb -0.18 -1.18 -0.09 0.00 0.00 0.00 0.00 36.38 34.93 2rem s VAL 64 CO 0.17 0.34 1.11 -2.16 0.00 0.00 0.00 175.10 174.57 2rem s PRO 65 N 1.65 4.11 -0.26 2.72 0.04 -1.26 -1.58 135.00 140.42 2rem s PRO 65 Ca 0.04 1.69 -0.29 0.00 0.04 0.00 0.00 61.00 62.48 2rem s PRO 65 Cb -0.13 -2.63 -0.01 0.00 0.04 0.00 0.00 34.50 31.77 2rem s PRO 65 CO -0.09 -0.23 1.37 0.00 0.04 0.00 0.00 177.00 178.09 2rem s ALA 66 N -1.51 3.39 -1.02 8.56 0.00 0.26 -4.76 121.76 126.67 2rem s ALA 66 Ca 0.57 0.24 -0.10 0.00 0.00 0.00 0.00 51.96 52.67 2rem s ALA 66 Cb -0.27 -3.77 0.26 0.00 0.00 0.00 0.00 23.12 19.34 2rem s ALA 66 CO 0.34 -1.73 0.99 0.08 0.00 0.00 0.00 175.76 175.44 2rem s VAL 67 N 4.44 5.81 -1.36 0.00 1.01 -1.26 -4.56 120.40 124.48 2rem s VAL 67 Ca 0.60 -3.16 0.13 0.00 0.00 0.00 0.00 61.98 59.54 2rem s VAL 67 Cb -0.19 -4.52 0.21 0.00 0.00 0.00 0.00 36.38 31.88 2rem s VAL 67 CO 0.23 -1.13 1.08 0.49 0.00 0.00 0.00 175.10 175.77 2rem n PHE 68 N 3.06 0.24 0.00 5.22 3.72 -1.26 -4.84 117.46 123.60 2rem n PHE 68 Ca 0.21 -0.23 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 2rem n PHE 68 Cb 0.41 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.94 2rem n PHE 68 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2rem n GLY 69 N 0.70 -0.22 7.00 1.37 0.00 -1.26 -4.94 105.19 107.84 2rem n GLY 69 Ca 0.10 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.24 2rem n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rem n GLY 70 N -0.34 2.88 0.26 -0.02 0.00 -1.26 -1.79 105.19 104.92 2rem n GLY 70 Ca 0.00 -0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 2rem n GLY 70 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2rem h VAL 71 N 0.00 0.46 -0.46 1.61 -1.51 -1.94 -2.89 116.25 111.53 2rem h VAL 71 Ca 0.00 -0.70 -0.05 0.00 -1.23 0.00 0.00 66.70 64.72 2rem h VAL 71 Cb 0.00 1.49 -0.02 0.00 -2.13 0.00 0.00 31.29 30.63 2rem h VAL 71 CO 0.00 0.13 0.08 -0.50 -1.23 0.00 0.00 177.57 176.06 2rem h TRP 72 N 0.00 0.72 -0.13 5.19 4.06 -1.67 -3.35 115.95 120.77 2rem h TRP 72 Ca -0.00 -0.07 -0.04 0.00 2.06 0.00 0.00 58.89 60.84 2rem h TRP 72 Cb 0.48 -0.21 -0.00 0.00 -1.00 0.00 0.00 29.16 28.42 2rem h TRP 72 CO 0.00 0.64 -0.08 -0.44 -3.56 0.00 0.00 178.44 174.99 2rem h ASP 73 N 0.68 0.30 -0.95 -3.49 5.19 -1.56 0.40 116.42 116.98 2rem h ASP 73 Ca 0.15 -0.44 0.15 0.00 -0.62 0.00 0.00 57.03 56.27 2rem h ASP 73 Cb 0.30 -0.08 -0.08 0.00 0.18 0.00 0.00 39.33 39.64 2rem h ASP 73 CO 0.00 0.67 0.60 -0.65 -3.12 0.00 0.00 179.24 176.75 2rem h PRO 74 N -0.07 0.77 0.00 3.56 0.11 -1.76 0.10 132.00 134.70 2rem h PRO 74 Ca 0.03 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 65.95 2rem h PRO 74 Cb 0.57 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.48 2rem h PRO 74 CO 0.02 0.51 -0.68 0.74 -0.21 0.00 0.00 178.00 178.38 2rem h PHE 75 N 0.79 0.00 -0.26 0.65 0.04 -1.57 0.30 116.94 116.89 2rem h PHE 75 Ca 0.49 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.25 2rem h PHE 75 Cb 0.71 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.85 2rem h PHE 75 CO -0.00 0.68 0.10 0.00 -0.60 0.00 0.00 178.31 178.49 2rem h ALA 76 N 1.32 0.34 -0.55 2.45 0.00 -0.10 -1.12 119.26 121.60 2rem h ALA 76 Ca -0.01 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 2rem h ALA 76 Cb 1.35 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 2rem h ALA 76 CO 0.09 -0.06 0.03 -0.09 0.00 0.00 0.00 179.25 179.22 2rem h ARG 77 N 0.27 0.92 0.06 0.00 2.43 -0.70 -1.69 114.38 115.67 2rem h ARG 77 Ca 0.09 -0.25 0.02 0.00 -0.81 0.00 0.00 59.98 59.03 2rem h ARG 77 Cb 0.19 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 2rem h ARG 77 CO -0.01 0.89 -0.22 0.00 -1.51 0.00 0.00 179.97 179.13 2rem h ALA 78 N 1.17 -0.33 -0.25 2.80 0.00 -0.28 0.89 119.26 123.26 2rem h ALA 78 Ca 0.17 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.12 2rem h ALA 78 Cb 0.46 0.37 -0.06 0.00 0.00 0.00 0.00 17.79 18.56 2rem h ALA 78 CO 0.02 -0.73 -0.13 -0.92 0.00 0.00 0.00 179.25 177.49 2rem h TYR 79 N -0.38 -0.30 -0.44 0.00 3.20 -0.97 -0.06 116.97 118.01 2rem h TYR 79 Ca 0.04 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 2rem h TYR 79 Cb 0.43 0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.85 2rem h TYR 79 CO -0.23 -0.19 0.22 -0.07 -1.64 0.00 0.00 178.16 176.25 2rem h LEU 80 N -0.10 0.57 -0.52 2.82 3.38 -1.04 0.11 115.31 120.53 2rem h LEU 80 Ca 0.13 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 58.00 2rem h LEU 80 Cb 0.30 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2rem h LEU 80 CO -0.31 0.53 0.33 0.00 0.09 0.00 0.00 178.44 179.08 2rem h ALA 81 N 1.07 0.67 -0.74 1.53 0.00 -0.61 0.71 119.26 121.88 2rem h ALA 81 Ca 0.15 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.08 2rem h ALA 81 Cb 0.10 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 2rem h ALA 81 CO -0.02 0.06 0.46 0.00 0.00 0.00 0.00 179.25 179.75 2rem h ALA 82 N 1.21 0.99 -0.18 0.00 0.00 -0.56 -0.13 119.26 120.59 2rem h ALA 82 Ca 0.20 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2rem h ALA 82 Cb -0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2rem h ALA 82 CO -0.07 0.22 -0.02 0.22 0.00 0.00 0.00 179.25 179.60 2rem h ASP 83 N 0.88 0.34 -0.96 0.00 3.58 -0.27 0.11 116.42 120.10 2rem h ASP 83 Ca 0.31 -0.34 0.15 0.00 0.42 0.00 0.00 57.03 57.58 2rem h ASP 83 Cb 0.07 -0.09 -0.08 0.00 1.72 0.00 0.00 39.33 40.95 2rem h ASP 83 CO -0.13 0.59 0.61 0.58 -2.88 0.00 0.00 179.24 178.00 2rem h VAL 84 N 0.07 0.82 -0.00 2.25 2.07 -0.60 -1.48 116.25 119.37 2rem h VAL 84 Ca 0.05 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.30 2rem h VAL 84 Cb 0.43 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.16 2rem h VAL 84 CO 0.01 0.14 -0.11 0.18 0.02 0.00 0.00 177.57 177.82 2rem n LEU 85 N -4.63 0.61 -0.40 2.57 4.77 -0.08 -4.92 117.00 114.92 2rem n LEU 85 Ca 0.20 -0.08 -0.04 0.00 -0.03 0.00 0.00 56.01 56.05 2rem n LEU 85 Cb 0.48 -0.14 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 2rem n LEU 85 CO 0.27 0.11 -0.05 0.61 -1.33 0.00 0.00 177.39 177.00 2rem n GLY 86 N 1.25 0.53 0.00 -0.72 0.00 -0.22 -4.92 105.19 101.12 2rem n GLY 86 Ca 0.15 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.36 2rem n GLY 86 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2rem n VAL 87 N -3.27 0.70 0.09 1.61 0.24 0.22 -4.77 118.33 113.14 2rem n VAL 87 Ca -0.05 -0.80 -0.13 0.00 -2.04 0.00 0.00 64.34 61.32 2rem n VAL 87 Cb 0.28 0.67 -0.08 0.00 -1.47 0.00 0.00 33.84 33.24 2rem n VAL 87 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2rem h ALA 88 N 0.00 -0.20 -0.65 2.33 0.00 -1.77 -2.34 119.26 116.63 2rem h ALA 88 Ca 0.00 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.78 2rem h ALA 88 Cb 0.44 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 2rem h ALA 88 CO 0.00 -0.49 0.43 0.87 0.00 0.00 0.00 179.25 180.06 2rem h LYS 89 N -0.44 0.84 0.00 0.00 1.57 -1.89 -0.45 116.57 116.20 2rem h LYS 89 Ca -0.02 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2rem h LYS 89 Cb 0.35 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.47 2rem h LYS 89 CO 0.03 0.56 0.00 0.07 -0.57 0.00 0.00 179.45 179.54 2rem h ARG 90 N 0.87 0.00 -0.02 3.15 0.11 -1.87 -3.24 114.38 113.38 2rem h ARG 90 Ca 0.24 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.32 2rem h ARG 90 Cb -0.08 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.00 2rem h ARG 90 CO -0.06 0.00 -0.03 -1.13 0.10 0.00 0.00 179.97 178.85 2rem n SER 91 N -3.07 2.00 0.19 0.08 3.41 -0.87 -4.74 113.62 110.62 2rem n SER 91 Ca 0.02 -1.50 -0.14 0.00 -0.26 0.00 0.00 58.87 56.99 2rem n SER 91 Cb 0.39 0.06 -0.08 0.00 -0.26 0.00 0.00 64.21 64.31 2rem n SER 91 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 2rem h HIS 92 N 2.41 -0.42 -0.49 7.33 2.76 -1.13 0.33 115.15 125.94 2rem h HIS 92 Ca 0.00 -0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.18 2rem h HIS 92 Cb 0.53 0.14 -0.03 0.00 1.55 0.00 0.00 27.41 29.60 2rem h HIS 92 CO 0.00 -0.15 0.30 1.15 -1.30 0.00 0.00 177.93 177.93 2rem h THR 93 N -0.65 1.07 -0.82 6.26 2.02 -1.86 -2.29 112.91 116.64 2rem h THR 93 Ca -0.05 -0.21 0.01 0.00 0.77 0.00 0.00 66.41 66.93 2rem h THR 93 Cb 0.46 0.41 -0.04 0.00 -1.74 0.00 0.00 68.15 67.24 2rem h THR 93 CO 0.08 0.11 0.54 0.00 0.37 0.00 0.00 175.52 176.62 2rem h ALA 94 N 1.21 1.42 -0.12 6.16 0.00 -1.75 0.62 119.26 126.80 2rem h ALA 94 Ca 0.19 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2rem h ALA 94 Cb -0.01 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 2rem h ALA 94 CO -0.08 0.54 0.03 1.98 0.00 0.00 0.00 179.25 181.72 2rem h MET 95 N 1.11 0.19 -0.54 0.00 -1.53 0.01 0.39 114.93 114.56 2rem h MET 95 Ca 0.30 -0.04 0.08 0.00 -3.44 0.00 0.00 59.70 56.60 2rem h MET 95 Cb -0.12 -0.03 -0.07 0.00 -0.55 0.00 0.00 31.60 30.84 2rem h MET 95 CO -0.07 0.35 0.17 0.74 0.14 0.00 0.00 176.91 178.25 2rem h PHE 96 N -0.01 0.29 -0.54 1.39 0.04 -0.95 -1.90 116.94 115.26 2rem h PHE 96 Ca 0.04 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.80 2rem h PHE 96 Cb 0.25 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.33 2rem h PHE 96 CO 0.01 0.06 0.21 1.49 -0.60 0.00 0.00 178.31 179.48 2rem h GLU 97 N 0.33 0.81 -0.88 1.51 4.81 -0.65 0.20 114.58 120.71 2rem h GLU 97 Ca 0.27 -0.15 0.10 0.00 -0.13 0.00 0.00 59.36 59.45 2rem h GLU 97 Cb 0.33 -0.13 -0.07 0.00 0.63 0.00 0.00 28.75 29.51 2rem h GLU 97 CO -0.30 0.71 0.53 0.00 -0.73 0.00 0.00 179.01 179.22 2rem h ALA 98 N 1.06 1.27 0.00 2.92 0.00 0.17 0.27 119.26 124.96 2rem h ALA 98 Ca 0.18 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2rem h ALA 98 Cb 0.20 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2rem h ALA 98 CO -0.01 0.17 -0.04 0.82 0.00 0.00 0.00 179.25 180.19 2rem h ILE 99 N 0.88 1.74 0.00 0.00 2.04 -1.03 0.23 117.51 121.37 2rem h ILE 99 Ca 0.42 -2.22 0.00 0.00 1.00 0.00 0.00 64.86 64.06 2rem h ILE 99 Cb 0.36 3.25 0.00 0.00 -0.74 0.00 0.00 36.82 39.69 2rem h ILE 99 CO -0.24 0.58 -1.68 1.41 0.00 0.00 0.00 178.15 178.22 2rem n HIS 100 N -4.61 0.23 0.01 1.37 8.25 0.69 -4.02 115.22 117.13 2rem n HIS 100 Ca -0.10 0.07 -0.03 0.00 -0.26 0.00 0.00 57.72 57.40 2rem n HIS 100 Cb 0.47 -0.58 -0.01 0.00 1.12 0.00 0.00 29.99 30.99 2rem n HIS 100 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2rem n GLU 101 N -2.30 0.08 0.10 -0.41 1.02 0.72 -4.79 120.64 115.05 2rem n GLU 101 Ca -0.02 0.03 -0.04 0.00 -0.02 0.00 0.00 57.16 57.11 2rem n GLU 101 Cb 0.55 -0.64 0.01 0.00 -0.02 0.00 0.00 31.44 31.34 2rem n GLU 101 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2rem h LYS 102 N -0.15 0.00 -3.58 3.49 1.57 -1.05 -3.48 116.57 113.38 2rem h LYS 102 Ca -0.04 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 58.34 2rem h LYS 102 Cb 0.55 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.88 2rem h LYS 102 CO -0.03 0.82 -0.55 0.41 -0.57 0.00 0.00 179.45 179.53 2rem n GLY 103 N 0.85 -0.47 0.02 3.86 0.00 -0.20 -4.91 105.19 104.35 2rem n GLY 103 Ca -0.00 0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.16 2rem n GLY 103 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2rem n SER 104 N -2.10 0.60 -3.99 1.61 3.41 0.62 -4.68 113.62 109.08 2rem n SER 104 Ca -0.18 -0.22 -0.27 0.00 -0.26 0.00 0.00 58.87 57.94 2rem n SER 104 Cb 0.65 0.40 -0.17 0.00 -0.26 0.00 0.00 64.21 64.83 2rem n SER 104 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2rem s VAL 105 N -3.07 1.24 0.49 -3.33 1.01 -1.09 -5.00 120.40 110.64 2rem s VAL 105 Ca 0.08 -0.47 -0.19 0.00 0.00 0.00 0.00 61.98 61.40 2rem s VAL 105 Cb 0.16 -1.18 -0.09 0.00 0.00 0.00 0.00 36.38 35.28 2rem s VAL 105 CO 0.74 0.39 1.00 -2.16 0.00 0.00 0.00 175.10 175.07 2rem s PRO 106 N 1.21 3.93 -0.14 2.72 0.04 -1.26 -4.18 135.00 137.31 2rem s PRO 106 Ca -0.03 1.16 -0.23 0.00 0.04 0.00 0.00 61.00 61.93 2rem s PRO 106 Cb -0.14 -2.13 -0.20 0.00 0.04 0.00 0.00 34.50 32.07 2rem s PRO 106 CO -0.04 -0.30 0.56 0.82 0.04 0.00 0.00 177.00 178.09 2rem h ILE 107 N 1.38 1.37 -3.29 0.56 2.04 -1.98 -3.40 117.51 114.19 2rem h ILE 107 Ca -0.48 -2.07 -0.53 0.00 1.00 0.00 0.00 64.86 62.78 2rem h ILE 107 Cb 1.20 2.63 0.01 0.00 -0.74 0.00 0.00 36.82 39.92 2rem h ILE 107 CO 0.60 0.46 0.59 -1.10 0.00 0.00 0.00 178.15 178.70 2rem s GLN 108 N -2.12 4.44 -1.65 2.37 -1.52 -1.26 -3.45 119.66 116.47 2rem s GLN 108 Ca -0.17 1.87 0.00 0.00 -1.95 0.00 0.00 55.36 55.11 2rem s GLN 108 Cb -0.02 -3.28 0.00 0.00 -0.22 0.00 0.00 33.01 29.49 2rem s GLN 108 CO 0.55 -0.21 0.00 0.09 -0.25 0.00 0.00 175.29 175.47 2rem n ASN 109 N 3.29 -5.02 -4.77 5.90 3.02 -1.26 -4.93 115.26 111.50 2rem n ASN 109 Ca 0.07 0.19 -0.39 0.00 -0.03 0.00 0.00 54.58 54.42 2rem n ASN 109 Cb 0.45 -4.30 0.01 0.00 -0.61 0.00 0.00 39.78 35.33 2rem n ASN 109 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2rem s VAL 110 N -2.76 2.34 0.35 2.41 0.11 -1.22 -5.02 120.40 116.62 2rem s VAL 110 Ca 0.00 0.30 0.05 0.00 -2.93 0.00 0.00 61.98 59.40 2rem s VAL 110 Cb 0.00 -3.18 -0.03 0.00 -1.53 0.00 0.00 36.38 31.64 2rem s VAL 110 CO 0.00 0.04 0.20 -0.83 -3.33 0.00 0.00 175.10 171.18 2rem s GLY 111 N -0.65 2.36 0.59 6.54 0.00 -1.26 -4.97 107.32 109.93 2rem s GLY 111 Ca 0.60 -1.70 0.29 0.00 0.00 0.00 0.00 44.72 43.90 2rem s GLY 111 CO 0.52 -1.62 2.14 -0.56 0.00 0.00 0.00 173.10 173.58 2rem h PRO 112 N 2.04 0.00 0.12 2.90 0.13 -1.97 -1.15 132.00 134.06 2rem h PRO 112 Ca -0.30 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.56 2rem h PRO 112 Cb 1.25 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.39 2rem h PRO 112 CO 0.47 0.00 -1.21 0.38 -0.23 0.00 0.00 178.00 177.41 2rem h ASP 113 N 0.00 0.48 -0.73 1.44 -0.00 -1.98 0.42 116.42 116.06 2rem h ASP 113 Ca 0.06 -0.49 -0.05 0.00 -0.00 0.00 0.00 57.03 56.56 2rem h ASP 113 Cb 0.36 -0.16 -0.03 0.00 -0.00 0.00 0.00 39.33 39.51 2rem h ASP 113 CO -0.00 1.36 0.27 -0.33 -0.00 0.00 0.00 179.24 180.54 2rem h GLU 114 N 0.11 1.11 -0.22 4.15 3.07 -1.85 -2.35 114.58 118.61 2rem h GLU 114 Ca -0.13 -0.21 -0.17 0.00 -0.50 0.00 0.00 59.36 58.35 2rem h GLU 114 Cb 1.92 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 29.65 2rem h GLU 114 CO 0.20 0.92 -0.53 -0.07 -1.40 0.00 0.00 179.01 178.14 2rem h LEU 115 N 1.08 0.84 -1.14 1.33 3.38 -1.10 -2.20 115.31 117.50 2rem h LEU 115 Ca 0.24 -0.57 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 2rem h LEU 115 Cb 0.24 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2rem h LEU 115 CO -0.02 1.25 0.39 0.00 0.09 0.00 0.00 178.44 180.16 2rem h ALA 116 N 0.61 1.35 -0.46 1.53 0.00 -0.09 -0.63 119.26 121.56 2rem h ALA 116 Ca -0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 2rem h ALA 116 Cb 1.14 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 2rem h ALA 116 CO 0.11 0.54 0.15 0.28 0.00 0.00 0.00 179.25 180.33 2rem h VAL 117 N 0.99 1.22 0.17 0.00 2.07 -1.23 0.25 116.25 119.71 2rem h VAL 117 Ca 0.25 -0.72 0.01 0.00 0.82 0.00 0.00 66.70 67.06 2rem h VAL 117 Cb 0.02 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 2rem h VAL 117 CO -0.04 0.26 -0.22 0.15 0.02 0.00 0.00 177.57 177.74 2rem h PHE 118 N 0.61 -0.57 0.00 1.57 3.57 -0.72 -2.64 116.94 118.75 2rem h PHE 118 Ca 0.15 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.63 2rem h PHE 118 Cb 0.25 0.23 -0.00 0.00 2.79 0.00 0.00 35.95 39.22 2rem h PHE 118 CO 0.01 -0.32 -0.12 1.88 -2.23 0.00 0.00 178.31 177.53 2rem h TYR 119 N -0.44 0.00 -0.53 0.41 0.05 -0.94 -1.67 116.97 113.86 2rem h TYR 119 Ca 0.01 0.00 0.15 0.00 0.05 0.00 0.00 58.73 58.95 2rem h TYR 119 Cb 0.43 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.15 2rem h TYR 119 CO -0.18 0.12 0.41 0.00 -1.05 0.00 0.00 178.16 177.46 2rem h ALA 120 N 1.88 2.43 0.00 3.88 0.00 -0.13 0.31 119.26 127.63 2rem h ALA 120 Ca -0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2rem h ALA 120 Cb 0.69 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 2rem h ALA 120 CO 0.02 -0.68 -0.05 0.78 0.00 0.00 0.00 179.25 179.31 2rem h GLY 121 N 0.00 0.00 -3.13 0.00 0.00 -1.30 -2.60 103.07 96.04 2rem h GLY 121 Ca 0.25 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.51 2rem h GLY 121 CO -0.00 0.00 0.08 -1.72 0.00 0.00 0.00 176.54 174.89 2rem n TYR 122 N -3.19 1.93 -1.00 5.60 4.01 0.11 -4.93 117.16 119.68 2rem n TYR 122 Ca 0.00 -0.93 -0.00 0.00 -0.16 0.00 0.00 57.90 56.81 2rem n TYR 122 Cb 0.30 -0.53 -0.00 0.00 -0.31 0.00 0.00 39.34 38.81 2rem n TYR 122 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2rem n GLY 123 N 0.09 0.47 3.64 2.72 0.00 -0.98 -5.01 105.19 106.12 2rem n GLY 123 Ca 0.31 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2rem n GLY 123 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2rem s VAL 124 N -1.99 4.97 0.18 1.61 1.01 -1.06 -5.01 120.40 120.12 2rem s VAL 124 Ca 0.00 1.25 -0.32 0.00 0.00 0.00 0.00 61.98 62.91 2rem s VAL 124 Cb 0.00 -3.98 -0.11 0.00 0.00 0.00 0.00 36.38 32.29 2rem s VAL 124 CO 0.00 0.04 1.74 -1.10 0.00 0.00 0.00 175.10 175.79 2rem s GLN 125 N 2.31 4.13 0.35 2.72 -1.52 -1.26 -3.69 119.66 122.70 2rem s GLN 125 Ca 0.29 2.59 0.06 0.00 -1.95 0.00 0.00 55.36 56.36 2rem s GLN 125 Cb -0.16 -3.21 0.74 0.00 -0.22 0.00 0.00 33.01 30.16 2rem s GLN 125 CO 0.09 -0.77 1.92 -1.35 -0.25 0.00 0.00 175.29 174.93 2rem h PRO 126 N 7.25 0.75 -0.40 2.91 0.11 -1.96 0.18 132.00 140.85 2rem h PRO 126 Ca -0.44 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.53 2rem h PRO 126 Cb 1.20 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 2rem h PRO 126 CO 0.95 0.50 -0.16 -0.44 -0.21 0.00 0.00 178.00 178.64 2rem h ASP 127 N 0.77 0.74 -0.41 -2.05 5.19 -1.97 -0.43 116.42 118.27 2rem h ASP 127 Ca 0.37 -0.24 -0.09 0.00 -0.62 0.00 0.00 57.03 56.46 2rem h ASP 127 Cb 0.42 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.71 2rem h ASP 127 CO -0.14 0.91 -0.08 -0.09 -3.12 0.00 0.00 179.24 176.71 2rem h ARG 128 N 0.67 0.77 -0.21 3.56 2.43 -1.51 -0.63 114.38 119.46 2rem h ARG 128 Ca 0.11 -0.29 0.04 0.00 -0.81 0.00 0.00 59.98 59.03 2rem h ARG 128 Cb 0.64 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.10 2rem h ARG 128 CO 0.04 0.89 -0.02 0.35 -1.51 0.00 0.00 179.97 179.73 2rem h PHE 129 N 0.59 -0.04 -0.44 2.20 3.57 -0.42 0.48 116.94 122.88 2rem h PHE 129 Ca 0.11 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 2rem h PHE 129 Cb 0.60 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.37 2rem h PHE 129 CO 0.05 -0.05 0.25 0.28 -2.23 0.00 0.00 178.31 176.61 2rem h VAL 130 N 0.04 1.15 -0.52 1.41 2.07 -1.01 0.24 116.25 119.62 2rem h VAL 130 Ca 0.10 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.25 2rem h VAL 130 Cb 0.13 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 2rem h VAL 130 CO -0.18 0.15 0.33 0.00 0.02 0.00 0.00 177.57 177.89 2rem h ALA 131 N 1.10 1.60 0.02 1.67 0.00 -0.96 0.23 119.26 122.92 2rem h ALA 131 Ca 0.16 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2rem h ALA 131 Cb 0.03 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.61 2rem h ALA 131 CO -0.03 0.36 -0.26 1.15 0.00 0.00 0.00 179.25 180.48 2rem h THR 132 N 0.71 1.60 -0.86 0.00 2.02 -0.10 -1.92 112.91 114.36 2rem h THR 132 Ca 0.19 -2.11 0.10 0.00 0.77 0.00 0.00 66.41 65.36 2rem h THR 132 Cb -0.05 2.97 -0.08 0.00 -1.74 0.00 0.00 68.15 69.25 2rem h THR 132 CO -0.04 0.57 0.51 0.15 0.37 0.00 0.00 175.52 177.08 2rem h PHE 133 N -0.61 0.92 -0.26 3.16 3.57 -0.37 -0.66 116.94 122.69 2rem h PHE 133 Ca -0.04 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.49 2rem h PHE 133 Cb 1.08 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.54 2rem h PHE 133 CO 0.21 0.38 0.00 0.09 -2.23 0.00 0.00 178.31 176.75 2rem n ASN 134 N -4.71 1.88 -5.00 0.41 3.02 0.05 -4.81 115.26 106.10 2rem n ASN 134 Ca 0.15 -1.84 -0.18 0.00 -0.03 0.00 0.00 54.58 52.68 2rem n ASN 134 Cb 0.29 -0.17 0.02 0.00 -0.61 0.00 0.00 39.78 39.31 2rem n ASN 134 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2rem s GLY 135 N -1.34 1.91 0.35 7.41 0.00 -0.25 -4.95 107.32 110.45 2rem s GLY 135 Ca 0.30 -1.59 0.05 0.00 0.00 0.00 0.00 44.72 43.48 2rem s GLY 135 CO 0.23 -1.37 1.91 -0.56 0.00 0.00 0.00 173.10 173.31 2rem h PRO 136 N 0.45 0.51 -0.20 2.90 0.13 -1.86 -1.82 132.00 132.11 2rem h PRO 136 Ca -0.40 -0.09 -0.04 0.00 -0.87 0.00 0.00 66.00 64.59 2rem h PRO 136 Cb 1.28 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2rem h PRO 136 CO 0.47 0.50 -0.04 1.49 -0.23 0.00 0.00 178.00 180.19 2rem h GLU 137 N 0.49 0.39 -0.64 0.86 4.57 -1.95 0.18 114.58 118.48 2rem h GLU 137 Ca 0.11 -0.15 -0.02 0.00 -1.18 0.00 0.00 59.36 58.13 2rem h GLU 137 Cb 0.26 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.80 2rem h GLU 137 CO 0.00 0.63 0.32 0.28 -1.18 0.00 0.00 179.01 179.06 2rem h VAL 138 N 0.11 1.22 -0.53 0.32 2.07 -1.74 -1.18 116.25 116.52 2rem h VAL 138 Ca 0.05 -0.59 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 2rem h VAL 138 Cb 0.48 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 2rem h VAL 138 CO 0.02 0.25 0.24 -0.08 0.02 0.00 0.00 177.57 178.01 2rem h GLU 139 N 0.88 0.77 -0.14 1.57 4.57 -1.16 0.59 114.58 121.66 2rem h GLU 139 Ca 0.22 -0.12 0.05 0.00 -1.18 0.00 0.00 59.36 58.32 2rem h GLU 139 Cb 0.10 -0.13 -0.05 0.00 -0.16 0.00 0.00 28.75 28.50 2rem h GLU 139 CO -0.03 0.65 -0.19 -0.22 -1.18 0.00 0.00 179.01 178.04 2rem h LYS 140 N 0.70 -0.23 -0.61 1.92 3.64 -0.71 0.18 116.57 121.45 2rem h LYS 140 Ca 0.18 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.53 2rem h LYS 140 Cb 0.15 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 2rem h LYS 140 CO -0.02 -0.15 0.20 0.00 -2.27 0.00 0.00 179.45 177.21 2rem h ARG 141 N -0.24 0.92 -0.32 1.90 3.08 -0.80 -0.09 114.38 118.82 2rem h ARG 141 Ca 0.10 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 2rem h ARG 141 Cb 0.39 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 2rem h ARG 141 CO -0.28 0.78 0.14 0.35 -1.07 0.00 0.00 179.97 179.90 2rem h PHE 142 N 0.89 0.48 -0.64 3.04 3.57 0.58 0.15 116.94 125.02 2rem h PHE 142 Ca 0.20 -0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.62 2rem h PHE 142 Cb 0.24 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.81 2rem h PHE 142 CO 0.02 0.44 0.20 1.96 -2.23 0.00 0.00 178.31 178.70 2rem h GLN 143 N 0.38 0.97 -0.49 1.11 1.08 -0.39 0.34 115.11 118.11 2rem h GLN 143 Ca 0.11 -0.19 -0.06 0.00 -1.45 0.00 0.00 58.65 57.06 2rem h GLN 143 Cb 0.15 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.41 2rem h GLN 143 CO -0.01 0.83 0.07 0.00 -0.95 0.00 0.00 178.83 178.77 2rem h ALA 144 N 1.28 0.65 -0.61 3.87 0.00 -0.65 0.10 119.26 123.90 2rem h ALA 144 Ca 0.21 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2rem h ALA 144 Cb 0.27 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 2rem h ALA 144 CO -0.01 0.39 0.28 0.00 0.00 0.00 0.00 179.25 179.91 2rem h ALA 145 N 0.96 0.79 -0.08 0.00 0.00 -0.46 -0.64 119.26 119.82 2rem h ALA 145 Ca 0.15 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2rem h ALA 145 Cb 0.41 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2rem h ALA 145 CO 0.01 0.36 0.03 -0.09 0.00 0.00 0.00 179.25 179.56 2rem h ARG 146 N 0.84 0.12 -0.94 0.00 2.43 -0.67 -0.96 114.38 115.20 2rem h ARG 146 Ca 0.21 -0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.44 2rem h ARG 146 Cb 0.14 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 29.60 2rem h ARG 146 CO -0.02 0.25 0.59 0.00 -1.51 0.00 0.00 179.97 179.27 2rem h ALA 147 N 0.87 1.33 -0.39 2.80 0.00 -0.67 -0.05 119.26 123.15 2rem h ALA 147 Ca 0.03 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2rem h ALA 147 Cb 0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2rem h ALA 147 CO -0.00 0.31 0.04 -0.92 0.00 0.00 0.00 179.25 178.67 2rem h TYR 148 N 1.03 0.71 -0.97 0.00 3.20 -0.85 -0.90 116.97 119.19 2rem h TYR 148 Ca 0.43 -0.11 0.01 0.00 3.14 0.00 0.00 58.73 62.19 2rem h TYR 148 Cb 0.26 -0.19 -0.05 0.00 1.54 0.00 0.00 36.73 38.30 2rem h TYR 148 CO -0.02 0.72 0.63 0.00 -1.64 0.00 0.00 178.16 177.85 2rem h ALA 149 N 0.90 1.29 -0.82 1.82 0.00 -0.63 0.23 119.26 122.05 2rem h ALA 149 Ca 0.11 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2rem h ALA 149 Cb 0.41 -0.39 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 2rem h ALA 149 CO 0.01 0.65 0.42 -0.07 0.00 0.00 0.00 179.25 180.27 2rem h LEU 150 N 1.32 1.04 -0.03 0.00 3.38 -0.58 0.20 115.31 120.65 2rem h LEU 150 Ca 0.35 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 2rem h LEU 150 Cb -0.13 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.35 2rem h LEU 150 CO -0.07 0.85 -0.06 0.50 0.09 0.00 0.00 178.44 179.75 2rem h LYS 151 N 1.15 0.08 -0.40 1.13 1.63 -0.78 -3.34 116.57 116.03 2rem h LYS 151 Ca 0.29 -0.05 -0.10 0.00 -0.85 0.00 0.00 60.65 59.93 2rem h LYS 151 Cb 0.06 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.69 2rem h LYS 151 CO -0.04 0.64 -0.15 0.28 -3.45 0.00 0.00 179.45 176.73 2rem h VAL 152 N -0.47 1.28 -5.11 2.00 2.07 -0.46 -3.46 116.25 112.10 2rem h VAL 152 Ca 0.00 -1.27 -0.23 0.00 0.82 0.00 0.00 66.70 66.02 2rem h VAL 152 Cb 0.64 1.25 0.16 0.00 -1.52 0.00 0.00 31.29 31.83 2rem h VAL 152 CO 0.01 0.42 -0.72 0.54 0.02 0.00 0.00 177.57 177.85 2rem n ARG 153 N -4.28 -3.02 -1.95 1.57 5.12 0.70 -4.94 116.66 109.86 2rem n ARG 153 Ca -0.01 0.74 -0.33 0.00 -1.93 0.00 0.00 57.85 56.32 2rem n ARG 153 Cb 0.40 -5.27 0.02 0.00 -1.16 0.00 0.00 32.46 26.45 2rem n ARG 153 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2rem s PRO 154 N -4.48 3.10 -0.49 5.56 0.04 -1.26 -5.00 135.00 132.48 2rem s PRO 154 Ca 0.28 1.35 -0.04 0.00 0.04 0.00 0.00 61.00 62.62 2rem s PRO 154 Cb -0.04 -1.99 0.13 0.00 0.04 0.00 0.00 34.50 32.64 2rem s PRO 154 CO 0.63 -1.01 0.31 0.08 0.04 0.00 0.00 177.00 177.06 2rem s VAL 155 N -2.30 3.62 0.00 -0.36 1.01 -1.26 -5.05 120.40 116.06 2rem s VAL 155 Ca 0.66 -2.30 0.00 0.00 0.00 0.00 0.00 61.98 60.35 2rem s VAL 155 Cb -0.19 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 32.77 2rem s VAL 155 CO 0.37 -0.77 0.00 0.61 0.00 0.00 0.00 175.10 175.31 2rem n GLY 156 N 4.30 -2.31 3.06 4.51 0.00 -1.26 -5.00 105.19 108.48 2rem n GLY 156 Ca 0.00 -1.54 -0.08 0.00 0.00 0.00 0.00 46.02 44.40 2rem n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2rem s THR 157 N -0.83 0.19 0.53 2.61 -4.23 -1.26 -4.26 115.64 108.39 2rem s THR 157 Ca 0.00 -1.53 -0.20 0.00 -1.18 0.00 0.00 61.69 58.78 2rem s THR 157 Cb 0.00 -1.14 -0.06 0.00 1.34 0.00 0.00 72.50 72.64 2rem s THR 157 CO 0.00 -0.85 1.11 -2.16 -0.54 0.00 0.00 174.62 172.19 2rem s PRO 158 N -3.17 3.44 -0.09 3.99 0.04 -1.26 -4.60 135.00 133.36 2rem s PRO 158 Ca -0.00 1.57 0.01 0.00 0.04 0.00 0.00 61.00 62.61 2rem s PRO 158 Cb 0.03 -2.02 0.02 0.00 0.04 0.00 0.00 34.50 32.56 2rem s PRO 158 CO -0.07 -0.77 -0.10 0.99 0.04 0.00 0.00 177.00 177.10 2rem s THR 159 N -1.81 1.04 -0.13 1.26 2.01 -0.50 -4.98 115.64 112.54 2rem s THR 159 Ca 0.72 -0.36 -0.14 0.00 0.31 0.00 0.00 61.69 62.22 2rem s THR 159 Cb -0.22 -1.01 -0.05 0.00 0.01 0.00 0.00 72.50 71.23 2rem s THR 159 CO 0.26 0.35 0.31 -0.63 -0.69 0.00 0.00 174.62 174.22 2rem s ILE 160 N 1.18 5.27 -0.10 1.82 -1.09 -1.26 -0.19 121.20 126.83 2rem s ILE 160 Ca -0.05 0.59 0.01 0.00 -2.23 0.00 0.00 60.65 58.98 2rem s ILE 160 Cb -0.14 -3.64 0.02 0.00 -1.58 0.00 0.00 42.46 37.12 2rem s ILE 160 CO -0.02 0.43 -0.12 -0.69 -1.23 0.00 0.00 174.94 173.30 2rem s VAL 161 N 0.15 1.28 -0.26 2.92 1.01 0.52 -0.44 120.40 125.59 2rem s VAL 161 Ca 0.18 -0.50 -0.10 0.00 0.00 0.00 0.00 61.98 61.56 2rem s VAL 161 Cb -0.14 -1.20 -0.05 0.00 0.00 0.00 0.00 36.38 35.00 2rem s VAL 161 CO 0.06 0.40 0.16 -0.69 0.00 0.00 0.00 175.10 175.02 2rem s VAL 162 N 1.15 5.15 -1.53 2.92 1.01 0.97 -0.52 120.40 129.54 2rem s VAL 162 Ca -0.04 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.05 2rem s VAL 162 Cb -0.14 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 32.81 2rem s VAL 162 CO -0.03 0.30 0.00 0.59 0.00 0.00 0.00 175.10 175.96 2rem n ASN 163 N 4.72 -4.41 0.00 3.32 3.02 0.11 -0.83 115.26 121.19 2rem n ASN 163 Ca -0.15 0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.67 2rem n ASN 163 Cb 0.52 -3.87 0.00 0.00 -0.61 0.00 0.00 39.78 35.81 2rem n ASN 163 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2rem n GLY 164 N -0.56 0.22 0.01 7.41 0.00 -1.26 -3.43 105.19 107.57 2rem n GLY 164 Ca -0.17 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.83 2rem n GLY 164 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2rem n ARG 165 N -0.72 2.19 -4.20 1.61 0.63 -0.01 -3.17 116.66 112.98 2rem n ARG 165 Ca 0.00 0.01 -0.31 0.00 -0.92 0.00 0.00 57.85 56.63 2rem n ARG 165 Cb 0.27 -1.07 -0.16 0.00 0.45 0.00 0.00 32.46 31.95 2rem n ARG 165 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2rem s TYR 166 N -2.06 2.40 -0.25 -0.14 1.51 -0.59 -0.25 117.35 117.96 2rem s TYR 166 Ca -0.03 -1.33 -0.07 0.00 -1.01 0.00 0.00 57.07 54.64 2rem s TYR 166 Cb 0.01 -1.70 -0.02 0.00 -0.11 0.00 0.00 41.96 40.14 2rem s TYR 166 CO 0.09 -0.68 0.06 1.41 -1.11 0.00 0.00 175.55 175.32 2rem s MET 167 N 1.26 3.54 0.32 -0.62 1.75 0.19 -0.02 119.30 125.72 2rem s MET 167 Ca 0.02 -0.55 -0.29 0.00 -1.25 0.00 0.00 55.69 53.62 2rem s MET 167 Cb -0.14 -3.29 -0.10 0.00 2.84 0.00 0.00 34.83 34.14 2rem s MET 167 CO -0.09 -0.23 1.25 0.08 -0.65 0.00 0.00 175.02 175.39 2rem s VAL 168 N 1.58 2.91 -0.52 10.11 1.01 0.42 -0.56 120.40 135.35 2rem s VAL 168 Ca 0.06 0.92 0.07 0.00 0.00 0.00 0.00 61.98 63.03 2rem s VAL 168 Cb -0.15 -3.59 0.24 0.00 0.00 0.00 0.00 36.38 32.88 2rem s VAL 168 CO 0.03 0.22 0.61 0.35 0.00 0.00 0.00 175.10 176.30 2rem n THR 169 N 0.90 0.76 -2.50 3.92 -2.24 0.65 -4.55 114.28 111.23 2rem n THR 169 Ca -0.00 -4.56 -0.27 0.00 -2.27 0.00 0.00 64.05 56.94 2rem n THR 169 Cb 0.43 -2.02 0.01 0.00 -2.10 0.00 0.00 70.33 66.65 2rem n THR 169 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2rem s GLY 170 N -1.69 1.55 0.13 3.38 0.00 -1.26 -4.38 107.32 105.05 2rem s GLY 170 Ca 0.36 -0.55 0.18 0.00 0.00 0.00 0.00 44.72 44.71 2rem s GLY 170 CO -0.08 -0.34 0.97 0.84 0.00 0.00 0.00 173.10 174.49 2rem h HIS 171 N 0.05 0.00 -2.95 1.90 2.76 -1.94 -3.46 115.15 111.50 2rem h HIS 171 Ca -0.46 0.00 0.06 0.00 -2.20 0.00 0.00 60.37 57.77 2rem h HIS 171 Cb 1.22 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 30.14 2rem h HIS 171 CO 0.55 0.42 0.26 0.16 -1.30 0.00 0.00 177.93 178.01 2rem s ASP 172 N -5.78 -0.21 0.16 3.26 3.84 -1.26 -5.04 116.67 111.65 2rem s ASP 172 Ca -0.01 -0.69 -0.15 0.00 -0.00 0.00 0.00 52.55 51.69 2rem s ASP 172 Cb 0.09 0.73 0.06 0.00 -1.38 0.00 0.00 42.92 42.42 2rem s ASP 172 CO 0.79 -1.38 1.79 -0.26 -0.00 0.00 0.00 175.17 176.12 2rem h PHE 173 N 2.00 0.42 -0.45 2.11 0.05 -1.99 0.15 116.94 119.23 2rem h PHE 173 Ca -0.22 0.02 -0.01 0.00 3.82 0.00 0.00 57.97 61.58 2rem h PHE 173 Cb 1.25 -0.13 -0.02 0.00 2.00 0.00 0.00 35.95 39.05 2rem h PHE 173 CO 0.60 0.23 0.24 0.93 -0.18 0.00 0.00 178.31 180.13 2rem h GLU 174 N 0.45 0.63 -0.57 1.51 3.07 -1.99 -1.45 114.58 116.23 2rem h GLU 174 Ca 0.17 -0.08 -0.00 0.00 -0.50 0.00 0.00 59.36 58.95 2rem h GLU 174 Cb 0.05 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 27.81 2rem h GLU 174 CO -0.10 0.51 0.34 0.22 -1.40 0.00 0.00 179.01 178.57 2rem h ASP 175 N 0.59 0.69 -0.66 1.42 -0.00 -1.89 0.02 116.42 116.59 2rem h ASP 175 Ca 0.16 -0.06 0.07 0.00 -0.00 0.00 0.00 57.03 57.20 2rem h ASP 175 Cb 0.06 -0.17 -0.06 0.00 -0.00 0.00 0.00 39.33 39.16 2rem h ASP 175 CO -0.02 0.55 0.34 0.74 -0.00 0.00 0.00 179.24 180.85 2rem h THR 176 N 0.77 0.91 -0.13 2.25 2.02 -0.34 0.71 112.91 119.09 2rem h THR 176 Ca 0.20 -0.21 -0.18 0.00 0.77 0.00 0.00 66.41 67.00 2rem h THR 176 Cb -0.01 0.24 -0.00 0.00 -1.74 0.00 0.00 68.15 66.64 2rem h THR 176 CO -0.04 0.11 -0.65 -0.07 0.37 0.00 0.00 175.52 175.25 2rem h LEU 177 N 0.61 0.57 -0.63 2.58 3.38 -0.89 -1.16 115.31 119.78 2rem h LEU 177 Ca 0.31 -0.34 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 2rem h LEU 177 Cb 0.26 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 2rem h LEU 177 CO -0.22 1.07 0.13 0.03 0.09 0.00 0.00 178.44 179.55 2rem h ARG 178 N 0.36 1.02 -0.35 1.13 3.08 -0.56 0.11 114.38 119.17 2rem h ARG 178 Ca -0.01 -0.26 -0.16 0.00 0.07 0.00 0.00 59.98 59.62 2rem h ARG 178 Cb 1.21 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 2rem h ARG 178 CO 0.12 0.94 -0.40 0.82 -1.07 0.00 0.00 179.97 180.37 2rem h ILE 179 N 0.94 1.28 -0.33 2.04 2.04 -0.75 -1.57 117.51 121.15 2rem h ILE 179 Ca 0.20 -1.57 0.00 0.00 1.00 0.00 0.00 64.86 64.48 2rem h ILE 179 Cb 0.39 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 2rem h ILE 179 CO 0.01 0.52 0.21 0.74 0.00 0.00 0.00 178.15 179.63 2rem h THR 180 N 0.70 1.10 -0.34 -0.27 2.02 -0.92 -0.80 112.91 114.39 2rem h THR 180 Ca 0.05 -0.20 0.06 0.00 0.77 0.00 0.00 66.41 67.10 2rem h THR 180 Cb 0.98 0.63 -0.06 0.00 -1.74 0.00 0.00 68.15 67.96 2rem h THR 180 CO 0.09 0.09 -0.03 0.44 0.37 0.00 0.00 175.52 176.49 2rem h ASP 181 N 0.44 -0.20 -0.35 4.18 3.32 -0.54 0.35 116.42 123.63 2rem h ASP 181 Ca 0.12 0.09 0.05 0.00 0.02 0.00 0.00 57.03 57.31 2rem h ASP 181 Cb -0.03 0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.64 2rem h ASP 181 CO -0.02 -0.06 0.08 0.22 -1.72 0.00 0.00 179.24 177.73 2rem h TYR 182 N 0.07 0.13 -0.51 4.55 5.03 -0.93 0.81 116.97 126.10 2rem h TYR 182 Ca 0.17 0.02 -0.12 0.00 2.58 0.00 0.00 58.73 61.38 2rem h TYR 182 Cb 0.24 -0.01 -0.02 0.00 1.55 0.00 0.00 36.73 38.50 2rem h TYR 182 CO -0.27 0.03 -0.14 -0.07 -1.32 0.00 0.00 178.16 176.39 2rem h LEU 183 N 0.20 1.01 -0.33 2.82 3.38 -0.55 -0.08 115.31 121.77 2rem h LEU 183 Ca 0.16 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 2rem h LEU 183 Cb 0.18 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2rem h LEU 183 CO -0.21 1.15 0.12 0.58 0.09 0.00 0.00 178.44 180.17 2rem h VAL 184 N 0.87 1.19 -0.60 1.22 2.07 -0.12 -0.76 116.25 120.12 2rem h VAL 184 Ca 0.13 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 67.00 2rem h VAL 184 Cb 0.71 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 2rem h VAL 184 CO 0.05 0.21 0.24 0.28 0.02 0.00 0.00 177.57 178.38 2rem h SER 185 N 0.38 0.79 -0.43 0.57 0.02 -0.70 -0.46 113.55 113.73 2rem h SER 185 Ca 0.11 -0.10 -0.11 0.00 -0.84 0.00 0.00 61.79 60.85 2rem h SER 185 Cb 0.22 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 2rem h SER 185 CO -0.01 0.71 -0.17 -0.09 -1.14 0.00 0.00 176.83 176.14 2rem h ARG 186 N 0.86 0.87 -0.70 3.45 2.43 -0.80 0.98 114.38 121.47 2rem h ARG 186 Ca 0.21 -0.36 0.01 0.00 -0.81 0.00 0.00 59.98 59.02 2rem h ARG 186 Cb 0.16 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.64 2rem h ARG 186 CO -0.02 1.01 0.46 0.93 -1.51 0.00 0.00 179.97 180.84 2rem h GLU 187 N 0.70 0.93 -0.41 0.20 4.39 -0.88 -0.00 114.58 119.50 2rem h GLU 187 Ca 0.10 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 2rem h GLU 187 Cb 0.72 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 2rem h GLU 187 CO 0.05 0.62 0.22 -0.09 -1.16 0.00 0.00 179.01 178.65 2rem h ARG 188 N 0.95 0.58 -0.51 2.33 2.43 -0.76 -1.70 114.38 117.69 2rem h ARG 188 Ca 0.26 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.31 2rem h ARG 188 Cb -0.10 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 2rem h ARG 188 CO -0.05 0.47 0.15 0.00 -1.51 0.00 0.00 179.97 179.02 2rem h ALA 189 N 1.07 0.68 -0.41 2.80 0.00 -0.59 -2.39 119.26 120.42 2rem h ALA 189 Ca 0.14 -0.20 0.09 0.00 0.00 0.00 0.00 54.91 54.94 2rem h ALA 189 Cb 0.07 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2rem h ALA 189 CO -0.02 0.35 0.28 0.00 0.00 0.00 0.00 179.25 179.86 2rem h ALA 190 N 1.01 2.17 0.00 0.00 0.00 -0.72 -1.56 119.26 120.16 2rem h ALA 190 Ca 0.16 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 2rem h ALA 190 Cb 0.30 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2rem h ALA 190 CO -0.00 -0.27 -0.38 0.66 0.00 0.00 0.00 179.25 179.27 2rem h SER 191 N 0.16 0.00 0.00 0.00 4.64 -0.78 -1.79 113.55 115.78 2rem h SER 191 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 2rem h SER 191 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 2rem h SER 191 CO -0.03 0.38 0.00 1.41 -0.87 0.00 0.00 176.83 177.72 2rem n HIS 192 N -4.02 0.00 0.00 4.77 8.25 -0.59 -5.13 115.22 118.50 2rem n HIS 192 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2rem n HIS 192 Cb 0.42 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.53 2rem n HIS 192 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39