#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y8m s THR 2 N 0.00 1.42 -0.79 1.12 -4.23 -1.26 -4.81 115.64 107.09 1y8m s THR 2 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 1y8m s THR 2 Cb 0.00 -2.27 0.00 0.00 1.34 0.00 0.00 72.50 71.57 1y8m s THR 2 CO 0.00 0.00 0.52 2.29 -0.54 0.00 0.00 174.62 176.89 1y8m n LYS 3 N -5.21 0.86 -3.90 3.99 2.85 -1.26 -4.76 118.16 110.73 1y8m n LYS 3 Ca 0.12 0.00 -0.35 0.00 -1.05 0.00 0.00 58.31 57.03 1y8m n LYS 3 Cb 0.60 -1.35 -0.09 0.00 -0.65 0.00 0.00 35.03 33.54 1y8m n LYS 3 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1y8m s VAL 4 N -0.76 5.10 -0.46 0.58 1.01 -1.26 -5.02 120.40 119.60 1y8m s VAL 4 Ca 0.00 0.07 0.03 0.00 0.00 0.00 0.00 61.98 62.08 1y8m s VAL 4 Cb 0.00 -3.29 0.21 0.00 0.00 0.00 0.00 36.38 33.29 1y8m s VAL 4 CO 0.00 0.48 0.88 -0.90 0.00 0.00 0.00 175.10 175.56 1y8m n ASP 5 N 3.24 -2.74 0.00 3.32 5.75 -1.26 -5.11 116.55 119.76 1y8m n ASP 5 Ca -0.17 -2.36 0.00 0.00 -0.01 0.00 0.00 54.79 52.25 1y8m n ASP 5 Cb 0.53 1.43 0.00 0.00 -1.03 0.00 0.00 41.12 42.05 1y8m n ASP 5 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 1y8m n PHE 6 N 2.62 0.00 -2.77 2.11 3.72 -1.26 -4.86 117.46 117.03 1y8m n PHE 6 Ca 0.14 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.14 1y8m n PHE 6 Cb 0.60 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 39.08 1y8m n PHE 6 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 1y8m s TRP 7 N 0.00 3.97 0.62 1.38 0.51 -1.26 -5.04 118.94 119.12 1y8m s TRP 7 Ca 0.00 1.89 -0.10 0.00 -2.12 0.00 0.00 56.10 55.77 1y8m s TRP 7 Cb 0.00 -2.97 0.16 0.00 -0.81 0.00 0.00 33.47 29.85 1y8m s TRP 7 CO 0.00 0.45 0.36 -0.35 -0.51 0.00 0.00 176.95 176.90 1y8m n PRO 8 N 1.59 -3.03 -3.99 4.98 -0.04 -1.26 -5.05 135.00 128.21 1y8m n PRO 8 Ca -0.02 -0.60 -0.27 0.00 -0.04 0.00 0.00 63.50 62.57 1y8m n PRO 8 Cb 0.47 -0.81 -0.01 0.00 -0.04 0.00 0.00 33.50 33.11 1y8m n PRO 8 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1y8m s THR 9 N -1.45 1.60 0.12 0.52 -4.23 -1.26 -5.01 115.64 105.93 1y8m s THR 9 Ca 0.28 -1.55 0.20 0.00 -1.18 0.00 0.00 61.69 59.44 1y8m s THR 9 Cb -0.05 -2.15 0.16 0.00 1.34 0.00 0.00 72.50 71.81 1y8m s THR 9 CO 0.23 0.00 1.73 0.25 -0.54 0.00 0.00 174.62 176.30 1y8m h LEU 10 N 0.82 0.00 -1.29 4.79 5.85 -1.96 -2.68 115.31 120.83 1y8m h LEU 10 Ca -0.38 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.27 1y8m h LEU 10 Cb 1.30 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 1y8m h LEU 10 CO 0.59 0.34 -0.33 0.11 -0.34 0.00 0.00 178.44 178.81 1y8m h LYS 11 N 0.00 0.05 0.00 1.25 6.56 -2.03 -1.72 116.57 120.67 1y8m h LYS 11 Ca -0.00 -0.02 -0.01 0.00 -1.06 0.00 0.00 60.65 59.56 1y8m h LYS 11 Cb 0.90 -0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.55 1y8m h LYS 11 CO 0.04 0.37 -0.04 -0.44 -2.06 0.00 0.00 179.45 177.32 1y8m h ASP 12 N 0.04 0.00 0.19 0.86 5.19 -1.87 -1.09 116.42 119.75 1y8m h ASP 12 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1y8m h ASP 12 Cb 0.60 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.11 1y8m h ASP 12 CO 0.04 0.04 0.00 0.00 -3.12 0.00 0.00 179.24 176.21 1y8m h ALA 13 N 1.96 1.00 0.01 3.45 0.00 -1.42 -2.92 119.26 121.34 1y8m h ALA 13 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1y8m h ALA 13 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1y8m h ALA 13 CO 0.01 0.00 -0.00 1.88 0.00 0.00 0.00 179.25 181.13 1y8m h TYR 14 N 0.00 -0.01 0.00 0.00 -1.99 -1.35 -3.44 116.97 110.18 1y8m h TYR 14 Ca 0.00 -0.00 -0.28 0.00 2.00 0.00 0.00 58.73 60.44 1y8m h TYR 14 Cb 0.10 0.00 -0.06 0.00 2.00 0.00 0.00 36.73 38.77 1y8m h TYR 14 CO 0.00 0.28 1.15 0.39 -0.00 0.00 0.00 178.16 179.98 1y8m n GLU 15 N -4.74 0.00 -2.01 4.88 1.02 -1.10 -4.78 120.64 113.91 1y8m n GLU 15 Ca -0.03 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.72 1y8m n GLU 15 Cb 0.14 -0.84 0.00 0.00 -0.02 0.00 0.00 31.44 30.73 1y8m n GLU 15 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1y8m s PRO 16 N 5.23 3.79 0.22 3.49 0.05 -1.26 -4.96 135.00 141.55 1y8m s PRO 16 Ca 0.84 2.15 0.02 0.00 0.05 0.00 0.00 61.00 64.06 1y8m s PRO 16 Cb -0.71 -2.63 -0.04 0.00 0.05 0.00 0.00 34.50 31.18 1y8m s PRO 16 CO 0.32 -0.64 0.38 -0.51 0.05 0.00 0.00 177.00 176.60 1y8m s LEU 17 N -2.70 4.25 0.32 -3.56 1.43 -1.26 -5.09 118.68 112.06 1y8m s LEU 17 Ca 0.60 0.27 -0.11 0.00 -1.03 0.00 0.00 54.13 53.86 1y8m s LEU 17 Cb -0.38 -3.05 -0.07 0.00 0.03 0.00 0.00 46.19 42.72 1y8m s LEU 17 CO 0.48 -0.06 0.67 -0.31 0.23 0.00 0.00 176.35 177.36 1y8m s TYR 18 N -1.93 3.42 0.62 0.29 2.02 -1.26 -4.95 117.35 115.56 1y8m s TYR 18 Ca 0.37 1.01 0.38 0.00 -0.37 0.00 0.00 57.07 58.46 1y8m s TYR 18 Cb -0.10 -2.39 2.15 0.00 -0.40 0.00 0.00 41.96 41.22 1y8m s TYR 18 CO 0.30 0.09 2.31 -1.00 -1.57 0.00 0.00 175.55 175.68 1y8m h PRO 19 N 1.99 0.00 0.19 -1.71 0.13 -2.00 -2.82 132.00 127.78 1y8m h PRO 19 Ca -0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1y8m h PRO 19 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1y8m h PRO 19 CO 0.66 0.00 -0.09 0.37 -0.23 0.00 0.00 178.00 178.71 1y8m h GLN 20 N 0.00 -0.24 -0.38 0.86 4.15 -2.01 -2.85 115.11 114.64 1y8m h GLN 20 Ca -0.00 0.02 0.11 0.00 0.77 0.00 0.00 58.65 59.55 1y8m h GLN 20 Cb 0.03 0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.76 1y8m h GLN 20 CO 0.00 0.16 0.30 1.96 -1.93 0.00 0.00 178.83 179.32 1y8m h GLN 21 N -0.78 0.00 -0.08 1.69 1.08 -1.90 0.18 115.11 115.30 1y8m h GLN 21 Ca -0.03 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.05 1y8m h GLN 21 Cb 0.51 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.93 1y8m h GLN 21 CO 0.04 0.00 -0.50 1.25 -0.95 0.00 0.00 178.83 178.67 1y8m h LEU 22 N 0.00 0.22 -0.60 1.46 5.85 -1.43 -2.87 115.31 117.93 1y8m h LEU 22 Ca 0.18 -0.11 -0.15 0.00 0.84 0.00 0.00 57.88 58.65 1y8m h LEU 22 Cb 0.78 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 1y8m h LEU 22 CO -0.00 0.68 -0.70 -0.08 -0.34 0.00 0.00 178.44 178.00 1y8m h GLU 23 N 0.16 0.00 0.13 1.25 4.81 -0.41 -2.97 114.58 117.56 1y8m h GLU 23 Ca 0.01 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1y8m h GLU 23 Cb 0.94 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.33 1y8m h GLU 23 CO 0.08 0.70 -0.06 0.82 -0.73 0.00 0.00 179.01 179.81 1y8m h ILE 24 N 0.00 0.91 -0.11 2.32 2.04 -1.25 -0.61 117.51 120.82 1y8m h ILE 24 Ca -0.01 -0.17 0.02 0.00 1.00 0.00 0.00 64.86 65.71 1y8m h ILE 24 Cb 1.24 1.02 -0.00 0.00 -0.74 0.00 0.00 36.82 38.33 1y8m h ILE 24 CO 0.09 0.04 0.07 -0.07 0.00 0.00 0.00 178.15 178.29 1y8m h LEU 25 N -0.26 0.03 -0.31 1.44 3.38 -1.54 -1.34 115.31 116.71 1y8m h LEU 25 Ca -0.02 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.80 1y8m h LEU 25 Cb 0.20 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 1y8m h LEU 25 CO 0.03 0.02 -0.40 -0.09 0.09 0.00 0.00 178.44 178.09 1y8m h ARG 26 N 0.03 0.82 -0.65 1.13 2.43 -1.18 -1.78 114.38 115.18 1y8m h ARG 26 Ca 0.05 -0.46 0.04 0.00 -0.81 0.00 0.00 59.98 58.79 1y8m h ARG 26 Cb 0.15 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.69 1y8m h ARG 26 CO -0.00 1.10 0.39 1.96 -1.51 0.00 0.00 179.97 181.90 1y8m h GLN 27 N 0.59 0.72 -0.26 0.20 1.08 -0.01 0.51 115.11 117.95 1y8m h GLN 27 Ca 0.04 -0.04 -0.08 0.00 -1.45 0.00 0.00 58.65 57.12 1y8m h GLN 27 Cb 0.99 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 28.24 1y8m h GLN 27 CO 0.09 0.48 -0.18 0.37 -0.95 0.00 0.00 178.83 178.64 1y8m h GLN 28 N 0.74 0.45 0.03 1.46 5.75 -1.32 0.53 115.11 122.75 1y8m h GLN 28 Ca 0.28 -0.14 -0.00 0.00 -0.15 0.00 0.00 58.65 58.63 1y8m h GLN 28 Cb 0.09 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.60 1y8m h GLN 28 CO -0.14 0.62 -0.01 0.28 -2.65 0.00 0.00 178.83 176.93 1y8m h VAL 29 N 0.41 1.42 -0.37 2.39 2.07 -0.27 -2.90 116.25 118.99 1y8m h VAL 29 Ca 0.07 -1.57 -0.08 0.00 0.82 0.00 0.00 66.70 65.95 1y8m h VAL 29 Cb 0.55 2.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.75 1y8m h VAL 29 CO 0.04 0.39 -0.07 0.58 0.02 0.00 0.00 177.57 178.53 1y8m h VAL 30 N -0.74 1.27 -0.04 2.57 2.07 0.03 0.26 116.25 121.66 1y8m h VAL 30 Ca -0.00 -1.13 0.01 0.00 0.82 0.00 0.00 66.70 66.40 1y8m h VAL 30 Cb 0.67 1.25 -0.00 0.00 -1.52 0.00 0.00 31.29 31.68 1y8m h VAL 30 CO 0.01 0.37 0.05 0.77 0.02 0.00 0.00 177.57 178.79 1y8m h SER 31 N 0.50 0.00 0.54 0.57 4.64 -0.02 0.82 113.55 120.59 1y8m h SER 31 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1y8m h SER 31 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1y8m h SER 31 CO 0.03 0.00 -0.35 -0.62 -0.87 0.00 0.00 176.83 175.03 1y8m n GLU 32 N -3.88 0.18 0.00 4.77 1.02 -1.00 -4.88 120.64 116.85 1y8m n GLU 32 Ca -0.02 -0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.03 1y8m n GLU 32 Cb 0.14 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 1y8m n GLU 32 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1y8m n GLY 33 N 1.46 1.53 7.00 0.62 0.00 0.27 -4.16 105.19 111.91 1y8m n GLY 33 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1y8m n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y8m n GLY 34 N 0.00 3.16 0.29 -0.02 0.00 0.88 -2.59 105.19 106.90 1y8m n GLY 34 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 46.02 46.08 1y8m n GLY 34 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1y8m h PRO 35 N 0.00 0.81 0.00 1.61 0.11 -1.95 0.94 132.00 133.53 1y8m h PRO 35 Ca 0.00 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1y8m h PRO 35 Cb 0.00 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 30.93 1y8m h PRO 35 CO 0.00 0.54 0.00 0.25 -0.21 0.00 0.00 178.00 178.58 1y8m n THR 36 N -4.69 0.00 -1.37 -1.15 -2.24 -1.07 -4.78 114.28 98.98 1y8m n THR 36 Ca 0.10 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.57 1y8m n THR 36 Cb 0.15 -0.34 0.08 0.00 -2.10 0.00 0.00 70.33 68.12 1y8m n THR 36 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1y8m s ALA 37 N -2.00 2.32 0.89 6.98 0.00 0.32 -4.75 121.76 125.51 1y8m s ALA 37 Ca 0.04 0.15 -0.11 0.00 0.00 0.00 0.00 51.96 52.03 1y8m s ALA 37 Cb 0.02 -3.22 0.11 0.00 0.00 0.00 0.00 23.12 20.02 1y8m s ALA 37 CO 0.03 -1.66 1.06 0.25 0.00 0.00 0.00 175.76 175.44 1y8m n THR 38 N -3.43 0.61 -0.18 0.00 -2.24 -1.26 -4.87 114.28 102.91 1y8m n THR 38 Ca 0.08 -0.09 -0.07 0.00 -2.27 0.00 0.00 64.05 61.70 1y8m n THR 38 Cb 0.54 -1.00 0.02 0.00 -2.10 0.00 0.00 70.33 67.78 1y8m n THR 38 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1y8m h ILE 39 N -1.55 1.18 -0.53 2.28 2.04 -1.94 -1.69 117.51 117.30 1y8m h ILE 39 Ca -0.44 -0.45 0.15 0.00 1.00 0.00 0.00 64.86 65.13 1y8m h ILE 39 Cb 1.28 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.86 1y8m h ILE 39 CO 0.42 0.19 0.47 1.56 0.00 0.00 0.00 178.15 180.78 1y8m h GLN 40 N 0.70 0.00 -0.14 2.37 4.20 -1.99 -0.52 115.11 119.72 1y8m h GLN 40 Ca 0.18 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.86 1y8m h GLN 40 Cb 0.05 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 1y8m h GLN 40 CO -0.03 0.00 -0.05 0.77 -0.67 0.00 0.00 178.83 178.85 1y8m h SER 41 N 0.00 0.28 0.15 1.46 0.02 -1.64 -2.76 113.55 111.06 1y8m h SER 41 Ca 0.25 -0.39 -0.16 0.00 -0.84 0.00 0.00 61.79 60.65 1y8m h SER 41 Cb 1.18 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.63 1y8m h SER 41 CO -0.00 0.61 -0.58 0.03 -1.14 0.00 0.00 176.83 175.74 1y8m h ARG 42 N -0.04 0.44 0.10 3.45 -0.00 -1.19 -2.44 114.38 114.71 1y8m h ARG 42 Ca 0.03 -0.29 0.02 0.00 -0.50 0.00 0.00 59.98 59.24 1y8m h ARG 42 Cb 0.49 0.04 -0.04 0.00 0.00 0.00 0.00 29.97 30.46 1y8m h ARG 42 CO 0.02 0.90 -0.30 0.35 0.00 0.00 0.00 179.97 180.94 1y8m h PHE 43 N 0.34 -0.82 -0.61 3.04 3.04 -1.09 0.93 116.94 121.77 1y8m h PHE 43 Ca -0.00 0.02 -0.07 0.00 3.98 0.00 0.00 57.97 61.90 1y8m h PHE 43 Cb 1.12 0.35 -0.03 0.00 2.56 0.00 0.00 35.95 39.95 1y8m h PHE 43 CO 0.04 -0.40 0.09 -0.91 -2.02 0.00 0.00 178.31 175.11 1y8m h ASN 44 N -0.51 0.95 -0.22 0.41 2.35 -1.51 -2.04 115.58 115.00 1y8m h ASN 44 Ca 0.04 -0.22 0.03 0.00 -0.55 0.00 0.00 56.30 55.60 1y8m h ASN 44 Cb 0.55 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 1y8m h ASN 44 CO -0.19 0.95 0.15 0.22 -1.65 0.00 0.00 177.43 176.91 1y8m h TYR 45 N 0.93 0.17 -0.04 1.19 3.20 -0.86 -0.41 116.97 121.16 1y8m h TYR 45 Ca 0.19 0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.92 1y8m h TYR 45 Cb 0.41 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 1y8m h TYR 45 CO 0.03 0.10 -0.63 0.00 -1.64 0.00 0.00 178.16 176.02 1y8m h ALA 46 N 1.88 0.86 -0.05 1.82 0.00 -0.11 -3.06 119.26 120.60 1y8m h ALA 46 Ca 0.09 -0.56 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 1y8m h ALA 46 Cb 0.15 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1y8m h ALA 46 CO -0.02 0.75 -0.03 2.35 0.00 0.00 0.00 179.25 182.31 1y8m h TRP 47 N 0.12 0.13 -0.99 0.00 2.91 -0.86 -2.20 115.95 115.06 1y8m h TRP 47 Ca -0.01 -0.03 0.12 0.00 1.13 0.00 0.00 58.89 60.10 1y8m h TRP 47 Cb 1.13 -0.03 -0.09 0.00 -0.51 0.00 0.00 29.16 29.67 1y8m h TRP 47 CO 0.02 0.50 0.61 0.78 -1.03 0.00 0.00 178.44 179.32 1y8m h GLY 48 N -0.28 1.62 1.92 2.65 0.00 -1.48 0.63 103.07 108.12 1y8m h GLY 48 Ca 0.01 -0.41 -0.09 0.00 0.00 0.00 0.00 47.33 46.84 1y8m h GLY 48 CO 0.01 0.14 -0.41 1.41 0.00 0.00 0.00 176.54 177.68 1y8m h LEU 49 N 0.95 0.10 -0.82 3.11 3.38 -1.42 -2.65 115.31 117.96 1y8m h LEU 49 Ca 0.49 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 58.30 1y8m h LEU 49 Cb 0.51 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1y8m h LEU 49 CO -0.27 0.50 -0.58 0.40 0.09 0.00 0.00 178.44 178.58 1y8m h ILE 50 N 0.08 1.42 0.00 1.22 1.08 -0.26 -2.84 117.51 118.21 1y8m h ILE 50 Ca 0.01 -2.00 -0.10 0.00 -0.39 0.00 0.00 64.86 62.38 1y8m h ILE 50 Cb 0.77 2.07 -0.01 0.00 -3.07 0.00 0.00 36.82 36.58 1y8m h ILE 50 CO 0.06 0.57 -0.47 0.50 -0.69 0.00 0.00 178.15 178.12 1y8m h LYS 51 N 0.01 0.00 -6.66 2.37 1.63 -1.00 -3.46 116.57 109.47 1y8m h LYS 51 Ca -0.01 0.00 -0.58 0.00 -0.85 0.00 0.00 60.65 59.22 1y8m h LYS 51 Cb 1.04 0.00 0.17 0.00 -0.60 0.00 0.00 32.23 32.84 1y8m h LYS 51 CO 0.08 0.47 -0.16 0.45 -3.45 0.00 0.00 179.45 176.84 1y8m n SER 52 N -3.55 -0.25 0.04 4.20 2.88 -1.09 -4.53 113.62 111.32 1y8m n SER 52 Ca -0.00 0.76 -0.07 0.00 -1.33 0.00 0.00 58.87 58.22 1y8m n SER 52 Cb 0.58 -1.27 -0.12 0.00 -0.75 0.00 0.00 64.21 62.64 1y8m n SER 52 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1y8m h THR 53 N 0.30 1.40 -4.01 2.46 1.35 -1.88 -3.45 112.91 109.08 1y8m h THR 53 Ca -0.47 -3.14 -0.49 0.00 -0.55 0.00 0.00 66.41 61.76 1y8m h THR 53 Cb 1.38 2.69 0.05 0.00 -1.73 0.00 0.00 68.15 70.54 1y8m h THR 53 CO 0.48 0.80 0.45 -1.81 -0.25 0.00 0.00 175.52 175.19 1y8m s ASP 54 N -6.49 6.32 0.36 5.36 1.11 -1.26 -4.92 116.67 117.15 1y8m s ASP 54 Ca -0.01 2.17 0.25 0.00 0.18 0.00 0.00 52.55 55.14 1y8m s ASP 54 Cb 0.09 -2.59 0.58 0.00 1.07 0.00 0.00 42.92 42.07 1y8m s ASP 54 CO 0.82 -0.80 1.69 1.62 1.18 0.00 0.00 175.17 179.68 1y8m h VAL 55 N 1.87 0.00 0.06 -1.27 3.04 -1.97 -3.19 116.25 114.79 1y8m h VAL 55 Ca -0.49 -0.77 -0.00 0.00 -1.01 0.00 0.00 66.70 64.43 1y8m h VAL 55 Cb 1.24 1.76 0.00 0.00 -2.01 0.00 0.00 31.29 32.28 1y8m h VAL 55 CO 0.60 0.00 -0.03 0.78 -1.01 0.00 0.00 177.57 177.92 1y8m h ASN 56 N 0.00 -0.07 -0.19 3.17 -0.26 -1.97 -0.79 115.58 115.47 1y8m h ASN 56 Ca 0.00 -0.03 -0.09 0.00 -0.56 0.00 0.00 56.30 55.62 1y8m h ASN 56 Cb 0.86 0.02 -0.00 0.00 -1.06 0.00 0.00 38.32 38.14 1y8m h ASN 56 CO 0.00 -0.01 -0.23 0.44 -1.06 0.00 0.00 177.43 176.57 1y8m h ASP 57 N -0.12 0.54 -0.95 5.81 3.32 -1.85 -2.96 116.42 120.22 1y8m h ASP 57 Ca -0.01 -0.50 0.12 0.00 0.02 0.00 0.00 57.03 56.67 1y8m h ASP 57 Cb 0.10 -0.15 -0.08 0.00 0.22 0.00 0.00 39.33 39.42 1y8m h ASP 57 CO 0.01 0.93 0.60 -0.33 -1.72 0.00 0.00 179.24 178.74 1y8m h GLU 58 N 0.17 0.87 0.00 3.56 5.08 -1.41 0.88 114.58 123.73 1y8m h GLU 58 Ca 0.03 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.26 1y8m h GLU 58 Cb 0.79 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 1y8m h GLU 58 CO 0.06 0.57 -0.37 0.00 -1.00 0.00 0.00 179.01 178.27 1y8m h ARG 59 N 0.89 0.00 -0.15 2.33 3.08 -1.06 -2.48 114.38 117.00 1y8m h ARG 59 Ca 0.46 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 60.36 1y8m h ARG 59 Cb 0.52 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 1y8m h ARG 59 CO -0.23 0.37 -0.57 1.25 -1.07 0.00 0.00 179.97 179.73 1y8m h LEU 60 N 0.00 0.51 -0.63 3.04 5.85 -0.68 -2.94 115.31 120.46 1y8m h LEU 60 Ca -0.00 -0.28 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 1y8m h LEU 60 Cb 0.72 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 1y8m h LEU 60 CO 0.05 0.97 0.21 1.23 -0.34 0.00 0.00 178.44 180.56 1y8m h GLY 61 N 1.18 1.04 0.93 3.75 0.00 -0.91 -2.63 103.07 106.42 1y8m h GLY 61 Ca 0.00 -0.60 -0.01 0.00 0.00 0.00 0.00 47.33 46.72 1y8m h GLY 61 CO 0.10 0.56 0.13 -2.08 0.00 0.00 0.00 176.54 175.26 1y8m h VAL 62 N 0.89 1.16 -0.78 4.60 2.07 -1.42 0.41 116.25 123.18 1y8m h VAL 62 Ca 0.20 -0.48 0.12 0.00 0.82 0.00 0.00 66.70 67.37 1y8m h VAL 62 Cb 0.27 0.93 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 1y8m h VAL 62 CO -0.01 0.17 0.51 0.50 0.02 0.00 0.00 177.57 178.76 1y8m h LYS 63 N 0.34 0.57 0.00 1.57 3.64 -1.34 0.37 116.57 121.72 1y8m h LYS 63 Ca 0.10 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.35 1y8m h LYS 63 Cb 0.14 -0.13 0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1y8m h LYS 63 CO -0.01 0.38 -0.37 0.82 -2.27 0.00 0.00 179.45 177.99 1y8m h ILE 64 N 0.58 1.51 -0.13 2.00 2.04 -1.04 -2.19 117.51 120.28 1y8m h ILE 64 Ca 0.38 -2.01 0.02 0.00 1.00 0.00 0.00 64.86 64.24 1y8m h ILE 64 Cb 0.65 2.74 -0.01 0.00 -0.74 0.00 0.00 36.82 39.46 1y8m h ILE 64 CO -0.14 0.56 0.09 -0.07 0.00 0.00 0.00 178.15 178.59 1y8m h LEU 65 N -0.38 0.08 0.05 1.44 3.38 -0.14 0.21 115.31 119.95 1y8m h LEU 65 Ca -0.05 -0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.68 1y8m h LEU 65 Cb 1.12 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.84 1y8m h LEU 65 CO 0.07 0.05 -1.16 0.74 0.09 0.00 0.00 178.44 178.24 1y8m h THR 66 N 0.09 1.55 -0.17 0.22 2.02 -0.96 -1.89 112.91 113.77 1y8m h THR 66 Ca 0.06 -3.23 -0.11 0.00 0.77 0.00 0.00 66.41 63.90 1y8m h THR 66 Cb 0.11 2.84 0.00 0.00 -1.74 0.00 0.00 68.15 69.37 1y8m h THR 66 CO -0.01 0.91 -0.31 0.44 0.37 0.00 0.00 175.52 176.92 1y8m h ASP 67 N 0.03 0.57 0.54 4.18 3.32 -0.61 -2.44 116.42 122.01 1y8m h ASP 67 Ca -0.08 -0.54 -0.10 0.00 0.02 0.00 0.00 57.03 56.32 1y8m h ASP 67 Cb 1.87 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 41.24 1y8m h ASP 67 CO 0.15 1.00 -0.49 0.40 -1.72 0.00 0.00 179.24 178.59 1y8m h ILE 68 N 0.16 1.29 -0.27 0.35 2.04 -1.08 -2.10 117.51 117.90 1y8m h ILE 68 Ca 0.01 -1.69 -0.03 0.00 1.00 0.00 0.00 64.86 64.15 1y8m h ILE 68 Cb 0.90 1.93 -0.01 0.00 -0.74 0.00 0.00 36.82 38.90 1y8m h ILE 68 CO 0.07 0.48 0.05 0.22 0.00 0.00 0.00 178.15 178.97 1y8m h TYR 69 N 0.00 0.46 0.00 1.37 5.03 -1.20 1.51 116.97 124.14 1y8m h TYR 69 Ca -0.00 -0.06 -0.07 0.00 2.58 0.00 0.00 58.73 61.18 1y8m h TYR 69 Cb 0.89 -0.13 -0.01 0.00 1.55 0.00 0.00 36.73 39.03 1y8m h TYR 69 CO 0.00 0.53 -0.33 0.87 -1.32 0.00 0.00 178.16 177.91 1y8m h LYS 70 N 0.26 0.00 0.00 1.82 1.57 -1.32 -3.28 116.57 115.62 1y8m h LYS 70 Ca 0.08 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.55 1y8m h LYS 70 Cb 0.31 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.56 1y8m h LYS 70 CO 0.00 0.33 -2.19 -1.91 -0.57 0.00 0.00 179.45 175.11 1y8m n GLU 71 N -3.40 0.67 -3.87 3.15 2.13 -0.80 -4.75 120.64 113.78 1y8m n GLU 71 Ca 0.00 0.03 -0.32 0.00 0.66 0.00 0.00 57.16 57.53 1y8m n GLU 71 Cb 0.52 -1.58 -0.12 0.00 0.27 0.00 0.00 31.44 30.53 1y8m n GLU 71 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1y8m s ALA 72 N -2.63 3.38 0.00 4.31 0.00 0.52 -5.04 121.76 122.29 1y8m s ALA 72 Ca -0.09 -3.21 0.00 0.00 0.00 0.00 0.00 51.96 48.66 1y8m s ALA 72 Cb 0.07 -2.33 0.00 0.00 0.00 0.00 0.00 23.12 20.86 1y8m s ALA 72 CO 0.84 -2.02 0.00 0.39 0.00 0.00 0.00 175.76 174.96 1y8m n GLU 73 N 3.34 0.00 0.00 0.00 4.71 -1.26 -3.10 120.64 124.33 1y8m n GLU 73 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.21 1y8m n GLU 73 Cb 0.35 -0.06 0.00 0.00 -1.01 0.00 0.00 31.44 30.72 1y8m n GLU 73 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 1y8m n SER 74 N 0.00 0.00 0.00 1.62 2.88 -1.26 0.54 113.62 117.40 1y8m n SER 74 Ca 0.00 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.55 1y8m n SER 74 Cb 0.00 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 63.51 1y8m n SER 74 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1y8m n ARG 75 N -3.36 0.09 0.08 -1.46 5.12 -1.22 -2.16 116.66 113.75 1y8m n ARG 75 Ca 0.00 0.00 -0.05 0.00 -1.93 0.00 0.00 57.85 55.87 1y8m n ARG 75 Cb 0.00 -1.28 0.11 0.00 -1.16 0.00 0.00 32.46 30.13 1y8m n ARG 75 CO 0.00 0.00 0.00 0.07 -1.93 0.00 0.00 177.63 175.77 1y8m h ARG 76 N 0.00 0.25 -0.39 5.56 0.11 1.36 -3.01 114.38 118.25 1y8m h ARG 76 Ca 0.00 -0.17 0.08 0.00 0.10 0.00 0.00 59.98 59.98 1y8m h ARG 76 Cb 0.00 0.03 -0.07 0.00 1.11 0.00 0.00 29.97 31.04 1y8m h ARG 76 CO 0.00 0.79 -0.06 0.00 0.10 0.00 0.00 179.97 180.80 1y8m h ARG 77 N 0.18 0.03 -0.09 0.08 3.08 -1.63 0.41 114.38 116.45 1y8m h ARG 77 Ca -0.01 -0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.95 1y8m h ARG 77 Cb 1.13 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 1y8m h ARG 77 CO 0.10 0.02 -0.36 1.49 -1.07 0.00 0.00 179.97 180.15 1y8m h GLU 78 N 0.04 0.17 -0.22 0.04 4.81 -1.80 -3.03 114.58 114.60 1y8m h GLU 78 Ca 0.19 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 59.24 1y8m h GLU 78 Cb 0.28 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 1y8m h GLU 78 CO -0.37 0.52 -0.28 0.00 -0.73 0.00 0.00 179.01 178.15 1y8m h LEU 80 N 0.27 0.60 -0.12 0.00 3.38 -0.17 0.96 115.31 120.24 1y8m h LEU 80 Ca 0.03 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 1y8m h LEU 80 Cb 0.86 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1y8m h LEU 80 CO 0.07 0.33 -0.13 0.22 0.09 0.00 0.00 178.44 179.01 1y8m h TYR 81 N 0.72 0.36 -0.41 1.13 3.20 -1.48 -2.54 116.97 117.94 1y8m h TYR 81 Ca 0.40 -0.11 -0.09 0.00 3.14 0.00 0.00 58.73 62.06 1y8m h TYR 81 Cb 0.41 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 1y8m h TYR 81 CO -0.08 0.72 -0.13 1.88 -1.64 0.00 0.00 178.16 178.92 1y8m h TYR 82 N -0.11 0.81 -0.45 -3.82 -1.99 -0.65 -2.53 116.97 108.23 1y8m h TYR 82 Ca 0.02 -0.15 -0.05 0.00 2.00 0.00 0.00 58.73 60.54 1y8m h TYR 82 Cb 0.67 -0.21 -0.02 0.00 2.00 0.00 0.00 36.73 39.17 1y8m h TYR 82 CO 0.09 0.82 0.07 -0.07 -0.00 0.00 0.00 178.16 179.07 1y8m h LEU 83 N 0.67 0.66 -0.56 3.88 3.38 0.94 0.11 115.31 124.38 1y8m h LEU 83 Ca 0.11 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1y8m h LEU 83 Cb 0.60 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1y8m h LEU 83 CO 0.04 0.69 0.32 0.74 0.09 0.00 0.00 178.44 180.31 1y8m h THR 84 N 0.68 1.18 0.06 0.22 2.02 -1.03 0.62 112.91 116.66 1y8m h THR 84 Ca 0.15 -0.45 -0.00 0.00 0.77 0.00 0.00 66.41 66.87 1y8m h THR 84 Cb 0.32 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 1y8m h THR 84 CO 0.01 0.19 -0.03 0.40 0.37 0.00 0.00 175.52 176.46 1y8m h ILE 85 N 0.76 1.24 -0.39 3.11 2.04 -1.15 0.85 117.51 123.97 1y8m h ILE 85 Ca 0.20 -1.19 -0.00 0.00 1.00 0.00 0.00 64.86 64.87 1y8m h ILE 85 Cb 0.03 2.00 -0.02 0.00 -0.74 0.00 0.00 36.82 38.09 1y8m h ILE 85 CO -0.03 0.29 0.24 1.23 0.00 0.00 0.00 178.15 179.88 1y8m h GLY 86 N -0.63 0.55 1.67 5.37 0.00 -0.73 -1.75 103.07 107.54 1y8m h GLY 86 Ca -0.01 -0.22 -0.09 0.00 0.00 0.00 0.00 47.33 47.00 1y8m h GLY 86 CO 0.01 0.22 -0.28 0.00 0.00 0.00 0.00 176.54 176.49 1y8m h TYR 88 N 0.34 0.21 0.00 0.00 3.20 -0.28 -1.31 116.97 119.12 1y8m h TYR 88 Ca 0.05 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 1y8m h TYR 88 Cb 0.68 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.89 1y8m h TYR 88 CO 0.02 0.49 -0.12 -0.22 -1.64 0.00 0.00 178.16 176.69 1y8m h LYS 89 N -0.14 0.00 0.00 1.82 3.64 -1.32 -3.25 116.57 117.32 1y8m h LYS 89 Ca 0.02 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 1y8m h LYS 89 Cb 0.43 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1y8m h LYS 89 CO 0.01 0.12 -0.30 -0.07 -2.27 0.00 0.00 179.45 176.95 1y8m h LEU 90 N 0.00 0.00 0.00 5.20 3.38 -1.12 -3.48 115.31 119.30 1y8m h LEU 90 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1y8m h LEU 90 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1y8m h LEU 90 CO 0.02 0.15 0.00 0.61 0.09 0.00 0.00 178.44 179.30 1y8m n GLY 91 N 1.15 1.98 2.54 0.83 0.00 -1.01 -5.01 105.19 105.67 1y8m n GLY 91 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 1y8m n GLY 91 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1y8m n GLU 92 N -0.20 4.40 0.28 1.61 -0.58 -0.53 -4.68 120.64 120.94 1y8m n GLU 92 Ca 0.00 -3.58 0.18 0.00 -0.42 0.00 0.00 57.16 53.35 1y8m n GLU 92 Cb 0.00 -2.51 0.85 0.00 -0.57 0.00 0.00 31.44 29.21 1y8m n GLU 92 CO 0.00 0.00 0.00 1.88 -0.48 0.00 0.00 177.13 178.53 1y8m h TYR 93 N 4.21 0.00 -0.12 -0.32 -1.99 -1.85 -2.79 116.97 114.12 1y8m h TYR 93 Ca 0.62 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 61.35 1y8m h TYR 93 Cb 0.35 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.08 1y8m h TYR 93 CO 1.51 0.00 0.06 0.66 -0.00 0.00 0.00 178.16 180.39 1y8m h SER 94 N 0.00 0.15 0.50 3.88 4.64 -1.91 -1.72 113.55 119.09 1y8m h SER 94 Ca 0.00 -0.08 -0.13 0.00 -0.47 0.00 0.00 61.79 61.10 1y8m h SER 94 Cb 0.30 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.34 1y8m h SER 94 CO 0.00 0.19 -0.60 0.24 -0.87 0.00 0.00 176.83 175.79 1y8m h MET 95 N 0.09 0.09 -0.45 4.77 2.86 -1.90 -3.01 114.93 117.38 1y8m h MET 95 Ca 0.04 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1y8m h MET 95 Cb 0.07 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.72 1y8m h MET 95 CO -0.01 0.66 0.28 0.00 1.06 0.00 0.00 176.91 178.90 1y8m h ALA 96 N 1.33 0.58 0.01 6.32 0.00 -1.21 -0.73 119.26 125.55 1y8m h ALA 96 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1y8m h ALA 96 Cb 1.07 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1y8m h ALA 96 CO 0.08 -0.02 -0.01 -0.22 0.00 0.00 0.00 179.25 179.09 1y8m h LYS 97 N 0.57 -0.01 -0.02 0.00 3.64 -1.19 0.11 116.57 119.66 1y8m h LYS 97 Ca 0.18 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.45 1y8m h LYS 97 Cb -0.02 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1y8m h LYS 97 CO -0.07 -0.01 -0.49 0.07 -2.27 0.00 0.00 179.45 176.68 1y8m h ARG 98 N -0.01 0.04 0.07 1.90 0.11 -1.46 -1.48 114.38 113.55 1y8m h ARG 98 Ca 0.00 -0.02 -0.00 0.00 0.10 0.00 0.00 59.98 60.06 1y8m h ARG 98 Cb 0.01 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.10 1y8m h ARG 98 CO -0.00 0.52 -0.04 1.88 0.10 0.00 0.00 179.97 182.44 1y8m h TYR 99 N 0.03 -0.09 -0.25 4.08 0.05 -0.91 -2.94 116.97 116.95 1y8m h TYR 99 Ca -0.00 -0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.76 1y8m h TYR 99 Cb 0.88 0.03 -0.01 0.00 1.01 0.00 0.00 36.73 38.64 1y8m h TYR 99 CO 0.00 0.47 0.09 -0.24 -1.05 0.00 0.00 178.16 177.43 1y8m h VAL 100 N -0.80 1.11 -0.45 -2.88 3.04 -1.00 -2.18 116.25 113.08 1y8m h VAL 100 Ca -0.01 -0.35 -0.01 0.00 -1.01 0.00 0.00 66.70 65.32 1y8m h VAL 100 Cb 0.61 0.83 -0.02 0.00 -2.01 0.00 0.00 31.29 30.70 1y8m h VAL 100 CO 0.02 0.13 0.24 -0.78 -1.01 0.00 0.00 177.57 176.17 1y8m h ASP 101 N 0.34 0.57 -0.29 3.17 3.58 -1.29 0.07 116.42 122.57 1y8m h ASP 101 Ca 0.09 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.44 1y8m h ASP 101 Cb 0.09 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 1y8m h ASP 101 CO -0.01 0.51 0.19 0.74 -2.88 0.00 0.00 179.24 177.79 1y8m h THR 102 N 0.59 1.07 -0.52 2.25 2.02 -1.21 0.12 112.91 117.23 1y8m h THR 102 Ca 0.16 -0.13 -0.05 0.00 0.77 0.00 0.00 66.41 67.16 1y8m h THR 102 Cb 0.07 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 1y8m h THR 102 CO -0.02 0.07 0.15 0.25 0.37 0.00 0.00 175.52 176.33 1y8m h LEU 103 N 0.39 0.77 -1.18 2.58 5.85 -1.21 -2.63 115.31 119.88 1y8m h LEU 103 Ca 0.11 -0.22 -0.08 0.00 0.84 0.00 0.00 57.88 58.53 1y8m h LEU 103 Cb -0.04 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 1y8m h LEU 103 CO -0.03 0.79 -0.40 0.15 -0.34 0.00 0.00 178.44 178.61 1y8m h PHE 104 N 0.72 0.00 -0.43 1.25 3.57 -0.69 -3.00 116.94 118.35 1y8m h PHE 104 Ca 0.17 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 1y8m h PHE 104 Cb 0.30 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.02 1y8m h PHE 104 CO 0.02 0.40 0.21 1.49 -2.23 0.00 0.00 178.31 178.20 1y8m h GLU 105 N 0.00 0.61 0.00 1.11 4.22 -0.40 -3.36 114.58 116.76 1y8m h GLU 105 Ca -0.00 -0.09 0.00 0.00 0.08 0.00 0.00 59.36 59.35 1y8m h GLU 105 Cb 0.73 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1y8m h GLU 105 CO 0.05 0.52 0.00 0.72 -2.18 0.00 0.00 179.01 178.12 1y8m n HIS 106 N -4.68 0.00 -0.16 0.92 8.25 -1.13 -4.84 115.22 113.58 1y8m n HIS 106 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1y8m n HIS 106 Cb 0.11 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.22 1y8m n HIS 106 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1y8m n GLU 107 N 0.00 0.00 -1.55 -0.41 2.13 -1.26 -5.12 120.64 114.43 1y8m n GLU 107 Ca 0.00 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.43 1y8m n GLU 107 Cb 0.00 0.00 0.03 0.00 0.27 0.00 0.00 31.44 31.74 1y8m n GLU 107 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1y8m n ARG 108 N 0.00 0.86 -2.03 5.31 5.12 -1.26 -4.92 116.66 119.74 1y8m n ARG 108 Ca 0.00 0.32 0.00 0.00 -1.93 0.00 0.00 57.85 56.24 1y8m n ARG 108 Cb 0.00 -1.91 0.03 0.00 -1.16 0.00 0.00 32.46 29.42 1y8m n ARG 108 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1y8m n ASN 109 N 0.22 0.49 -4.71 0.55 3.02 -1.26 -4.90 115.26 108.67 1y8m n ASN 109 Ca 0.12 -2.04 -0.42 0.00 -0.03 0.00 0.00 54.58 52.21 1y8m n ASN 109 Cb 0.44 -0.11 -0.03 0.00 -0.61 0.00 0.00 39.78 39.47 1y8m n ASN 109 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1y8m s ASN 110 N -2.30 6.90 0.25 6.41 -0.87 -1.26 -4.85 114.94 119.23 1y8m s ASN 110 Ca 0.22 2.22 0.08 0.00 -1.57 0.00 0.00 52.86 53.81 1y8m s ASN 110 Cb 0.31 -2.58 0.43 0.00 -0.02 0.00 0.00 41.25 39.40 1y8m s ASN 110 CO -0.09 -0.61 1.08 0.29 -2.57 0.00 0.00 177.10 175.20 1y8m n LYS 111 N 4.07 0.06 0.08 -0.60 5.02 -1.26 -0.13 118.16 125.40 1y8m n LYS 111 Ca 0.11 0.48 -0.13 0.00 -2.02 0.00 0.00 58.31 56.74 1y8m n LYS 111 Cb 0.44 -2.05 -0.07 0.00 -0.02 0.00 0.00 35.03 33.32 1y8m n LYS 111 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1y8m h GLN 112 N 0.00 0.32 0.06 1.97 1.08 -1.98 -2.04 115.11 114.51 1y8m h GLN 112 Ca 0.00 -0.40 -0.00 0.00 -1.45 0.00 0.00 58.65 56.80 1y8m h GLN 112 Cb 0.74 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 28.30 1y8m h GLN 112 CO 0.00 1.12 -0.03 0.28 -0.95 0.00 0.00 178.83 179.25 1y8m h VAL 113 N 0.15 1.25 -0.65 -0.54 2.07 -0.90 0.33 116.25 117.97 1y8m h VAL 113 Ca -0.09 -1.21 0.07 0.00 0.82 0.00 0.00 66.70 66.29 1y8m h VAL 113 Cb 1.70 2.02 -0.04 0.00 -1.52 0.00 0.00 31.29 33.46 1y8m h VAL 113 CO 0.17 0.29 0.43 1.23 0.02 0.00 0.00 177.57 179.71 1y8m h GLY 114 N -0.64 0.77 0.56 2.17 0.00 -1.62 0.14 103.07 104.45 1y8m h GLY 114 Ca -0.01 -0.24 -0.11 0.00 0.00 0.00 0.00 47.33 46.98 1y8m h GLY 114 CO 0.01 0.17 -0.43 0.00 0.00 0.00 0.00 176.54 176.29 1y8m h ALA 115 N 1.66 0.02 -0.25 3.60 0.00 -1.25 -2.72 119.26 120.32 1y8m h ALA 115 Ca 0.29 -0.54 0.02 0.00 0.00 0.00 0.00 54.91 54.68 1y8m h ALA 115 Cb 0.36 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1y8m h ALA 115 CO -0.09 0.21 0.11 1.25 0.00 0.00 0.00 179.25 180.73 1y8m h LEU 116 N -0.39 0.15 -2.03 0.00 5.85 0.29 -0.26 115.31 118.92 1y8m h LEU 116 Ca -0.06 0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.75 1y8m h LEU 116 Cb 1.20 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 1y8m h LEU 116 CO 0.08 0.12 0.18 0.50 -0.34 0.00 0.00 178.44 178.99 1y8m h LYS 117 N 0.24 0.00 -0.14 1.25 3.64 -0.82 -0.67 116.57 120.08 1y8m h LYS 117 Ca 0.11 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.43 1y8m h LYS 117 Cb 0.05 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1y8m h LYS 117 CO -0.09 0.00 -0.16 1.03 -2.27 0.00 0.00 179.45 177.96 1y8m h SER 118 N 0.00 0.22 -0.10 4.20 0.87 -0.71 0.12 113.55 118.15 1y8m h SER 118 Ca 0.12 -0.05 -0.10 0.00 -1.23 0.00 0.00 61.79 60.53 1y8m h SER 118 Cb 0.48 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 1y8m h SER 118 CO -0.00 0.40 -0.33 0.24 -0.53 0.00 0.00 176.83 176.61 1y8m h MET 119 N 0.21 0.40 0.19 2.24 2.86 -0.97 0.63 114.93 120.50 1y8m h MET 119 Ca 0.04 -0.29 -0.01 0.00 -2.06 0.00 0.00 59.70 57.38 1y8m h MET 119 Cb 0.42 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.13 1y8m h MET 119 CO 0.03 0.92 -0.09 0.28 1.06 0.00 0.00 176.91 179.10 1y8m h VAL 120 N -0.05 0.84 -0.24 -2.22 2.07 -1.36 0.17 116.25 115.46 1y8m h VAL 120 Ca -0.01 -0.12 -0.13 0.00 0.82 0.00 0.00 66.70 67.26 1y8m h VAL 120 Cb 0.95 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 1y8m h VAL 120 CO 0.07 0.03 -0.39 -0.33 0.02 0.00 0.00 177.57 176.97 1y8m h GLU 121 N -0.32 0.54 -0.35 1.57 5.08 -0.83 -0.24 114.58 120.03 1y8m h GLU 121 Ca -0.03 -0.26 -0.15 0.00 -1.00 0.00 0.00 59.36 57.92 1y8m h GLU 121 Cb 0.24 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1y8m h GLU 121 CO 0.04 0.84 -0.36 -0.44 -1.00 0.00 0.00 179.01 178.09 1y8m h ASP 122 N 0.45 0.92 0.00 1.42 5.19 -0.72 0.14 116.42 123.82 1y8m h ASP 122 Ca 0.04 -0.47 -0.18 0.00 -0.62 0.00 0.00 57.03 55.80 1y8m h ASP 122 Cb 0.87 -0.26 -0.00 0.00 0.18 0.00 0.00 39.33 40.12 1y8m h ASP 122 CO 0.07 1.20 -0.62 0.50 -3.12 0.00 0.00 179.24 177.28 1y8m h LYS 123 N 0.66 0.61 0.00 3.56 1.63 -0.57 -3.00 116.57 119.46 1y8m h LYS 123 Ca 0.05 -0.42 -0.15 0.00 -0.85 0.00 0.00 60.65 59.28 1y8m h LYS 123 Cb 0.95 0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 32.62 1y8m h LYS 123 CO 0.09 1.04 -0.73 0.82 -3.45 0.00 0.00 179.45 177.22 1y8m h ILE 124 N 0.45 1.45 -0.49 2.00 2.04 -0.97 -2.98 117.51 119.00 1y8m h ILE 124 Ca -0.01 -2.55 0.02 0.00 1.00 0.00 0.00 64.86 63.32 1y8m h ILE 124 Cb 1.19 2.40 -0.03 0.00 -0.74 0.00 0.00 36.82 39.65 1y8m h ILE 124 CO 0.12 0.71 0.33 1.56 0.00 0.00 0.00 178.15 180.87 1y8m h GLN 125 N 0.00 0.58 -0.21 2.37 4.20 -0.59 -1.15 115.11 120.32 1y8m h GLN 125 Ca -0.01 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.59 1y8m h GLN 125 Cb 1.35 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.99 1y8m h GLN 125 CO 0.09 0.38 -0.18 0.87 -0.67 0.00 0.00 178.83 179.33 1y8m h LYS 126 N 0.60 0.50 -0.76 1.46 1.57 -1.44 -3.04 116.57 115.46 1y8m h LYS 126 Ca 0.19 -0.25 0.13 0.00 -1.87 0.00 0.00 60.65 58.85 1y8m h LYS 126 Cb 0.04 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.26 1y8m h LYS 126 CO -0.05 0.82 0.33 0.93 -0.57 0.00 0.00 179.45 180.92 1y8m h GLU 127 N 0.18 0.49 0.00 3.15 4.39 -1.22 -3.42 114.58 118.15 1y8m h GLU 127 Ca 0.04 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1y8m h GLU 127 Cb 0.72 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 1y8m h GLU 127 CO 0.05 0.32 0.00 0.25 -1.16 0.00 0.00 179.01 178.47 1y8m n THR 128 N -4.95 0.00 -2.68 1.13 -2.24 -0.54 -4.52 114.28 100.48 1y8m n THR 128 Ca 0.14 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.85 1y8m n THR 128 Cb 0.39 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.61 1y8m n THR 128 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1y8m n LEU 129 N 0.00 -0.14 -4.23 3.22 0.00 -1.26 -4.84 117.00 109.75 1y8m n LEU 129 Ca 0.00 0.15 -0.27 0.00 0.00 0.00 0.00 56.01 55.88 1y8m n LEU 129 Cb 0.00 -1.01 0.24 0.00 0.00 0.00 0.00 43.42 42.66 1y8m n LEU 129 CO 0.00 0.02 0.20 0.29 0.00 0.00 0.00 177.39 177.90 1y8m n LYS 130 N -2.53 -3.44 0.00 1.96 5.02 -1.26 -4.90 118.16 113.01 1y8m n LYS 130 Ca 0.02 -1.01 0.00 0.00 -2.02 0.00 0.00 58.31 55.30 1y8m n LYS 130 Cb 0.44 -1.85 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 1y8m n LYS 130 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1y8m n GLY 131 N 1.85 -1.82 3.81 0.72 0.00 -1.26 -5.13 105.19 103.36 1y8m n GLY 131 Ca 0.08 0.62 -0.36 0.00 0.00 0.00 0.00 46.02 46.36 1y8m n GLY 131 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1y8m s VAL 132 N 0.00 4.42 0.05 1.61 -7.23 -1.26 -5.02 120.40 112.98 1y8m s VAL 132 Ca 0.00 1.48 -0.30 0.00 -1.81 0.00 0.00 61.98 61.35 1y8m s VAL 132 Cb 0.00 -3.86 -0.05 0.00 0.56 0.00 0.00 36.38 33.03 1y8m s VAL 132 CO 0.00 0.09 1.02 0.54 -0.31 0.00 0.00 175.10 176.44 1y8m s VAL 133 N -1.67 4.55 0.24 1.32 0.11 -1.26 -5.01 120.40 118.68 1y8m s VAL 133 Ca 0.49 1.92 -0.30 0.00 -2.93 0.00 0.00 61.98 61.16 1y8m s VAL 133 Cb -0.16 -4.23 -0.09 0.00 -1.53 0.00 0.00 36.38 30.37 1y8m s VAL 133 CO 0.21 0.20 1.00 0.54 -3.33 0.00 0.00 175.10 173.72 1y8m s VAL 134 N 0.66 3.89 -0.52 2.04 0.11 -1.26 -4.97 120.40 120.36 1y8m s VAL 134 Ca 0.52 1.88 -0.28 0.00 -2.93 0.00 0.00 61.98 61.16 1y8m s VAL 134 Cb -0.24 -4.20 0.02 0.00 -1.53 0.00 0.00 36.38 30.43 1y8m s VAL 134 CO 0.29 0.44 1.37 0.00 -3.33 0.00 0.00 175.10 173.87 1y8m s ALA 135 N -1.07 2.91 0.00 1.54 0.00 -1.26 -4.97 121.76 118.90 1y8m s ALA 135 Ca 0.43 -0.54 0.00 0.00 0.00 0.00 0.00 51.96 51.85 1y8m s ALA 135 Cb -0.28 -4.04 0.00 0.00 0.00 0.00 0.00 23.12 18.80 1y8m s ALA 135 CO 0.35 -2.72 0.00 0.41 0.00 0.00 0.00 175.76 173.80 1y8m n GLY 136 N 5.16 -0.92 0.00 0.00 0.00 -1.26 -4.96 105.19 103.21 1y8m n GLY 136 Ca 0.13 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1y8m n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y8m n GLY 137 N 2.87 0.54 2.08 -0.02 0.00 -1.26 -4.63 105.19 104.77 1y8m n GLY 137 Ca 0.00 -0.04 -0.14 0.00 0.00 0.00 0.00 46.02 45.84 1y8m n GLY 137 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1y8m n VAL 138 N 0.00 2.93 -0.09 1.61 0.24 -1.26 -4.27 118.33 117.48 1y8m n VAL 138 Ca 0.00 -1.51 -0.19 0.00 -2.04 0.00 0.00 64.34 60.60 1y8m n VAL 138 Cb 0.00 -2.04 -0.11 0.00 -1.47 0.00 0.00 33.84 30.22 1y8m n VAL 138 CO 0.00 0.00 0.00 -0.74 -2.14 0.00 0.00 176.83 173.95 1y8m h HIS 139 N 3.50 0.00 -2.37 6.34 6.17 -1.93 -3.42 115.15 123.44 1y8m h HIS 139 Ca 0.26 0.00 -0.63 0.00 0.71 0.00 0.00 60.37 60.71 1y8m h HIS 139 Cb 1.25 0.00 -0.14 0.00 2.52 0.00 0.00 27.41 31.04 1y8m h HIS 139 CO 1.75 1.28 0.80 -1.58 0.71 0.00 0.00 177.93 180.89 1y8m s HIS 140 N -2.31 2.71 0.00 5.26 5.04 -1.26 -4.96 115.29 119.78 1y8m s HIS 140 Ca -0.25 -0.72 0.00 0.00 -1.54 0.00 0.00 55.06 52.55 1y8m s HIS 140 Cb 0.03 -4.38 0.00 0.00 0.04 0.00 0.00 32.58 28.27 1y8m s HIS 140 CO 0.60 -1.70 0.00 0.72 -2.34 0.00 0.00 174.74 172.01 1y8m n HIS 141 N 7.79 0.00 -0.26 3.88 8.25 -1.26 -5.01 115.22 128.60 1y8m n HIS 141 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 1y8m n HIS 141 Cb 0.47 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.58 1y8m n HIS 141 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1y8m n HIS 142 N 0.00 0.00 -3.50 4.41 -0.00 -1.26 -5.15 115.22 109.72 1y8m n HIS 142 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 57.72 57.74 1y8m n HIS 142 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 29.99 29.99 1y8m n HIS 142 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1y8m n HIS 143 N 0.00 -1.91 -1.58 4.41 -0.00 -1.26 -5.34 115.22 109.55 1y8m n HIS 143 Ca 0.00 0.14 0.00 0.00 -0.00 0.00 0.00 57.72 57.86 1y8m n HIS 143 Cb 0.00 -0.06 0.00 0.00 -0.00 0.00 0.00 29.99 29.93 1y8m n HIS 143 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92