#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cru s SER 2 N 0.00 -0.32 0.26 1.61 0.15 -1.26 -5.19 113.70 108.95 2cru s SER 2 Ca 0.00 0.14 -0.20 0.00 0.70 0.00 0.00 55.95 56.59 2cru s SER 2 Cb 0.00 0.31 0.06 0.00 -1.71 0.00 0.00 66.02 64.68 2cru s SER 2 CO 0.00 -0.45 0.92 -0.44 1.20 0.00 0.00 173.24 174.47 2cru s SER 3 N -1.93 -0.03 0.00 5.45 0.01 -1.26 -5.18 113.70 110.76 2cru s SER 3 Ca 0.03 -0.82 0.00 0.00 1.31 0.00 0.00 55.95 56.47 2cru s SER 3 Cb -0.01 0.65 0.00 0.00 0.21 0.00 0.00 66.02 66.87 2cru s SER 3 CO -0.05 -1.27 0.00 0.61 0.41 0.00 0.00 173.24 172.94 2cru n GLY 4 N -0.60 5.13 3.60 3.44 0.00 -1.26 -5.19 105.19 110.31 2cru n GLY 4 Ca -0.05 -0.72 -0.07 0.00 0.00 0.00 0.00 46.02 45.17 2cru n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cru s SER 5 N 1.10 -0.24 0.49 1.61 1.04 -1.26 -5.19 113.70 111.25 2cru s SER 5 Ca 0.00 0.24 0.07 0.00 0.48 0.00 0.00 55.95 56.74 2cru s SER 5 Cb 0.00 0.21 0.01 0.00 0.10 0.00 0.00 66.02 66.34 2cru s SER 5 CO 0.00 -0.24 0.42 -0.94 0.98 0.00 0.00 173.24 173.45 2cru s SER 6 N -1.21 4.83 0.00 7.02 1.04 -1.26 -5.15 113.70 118.98 2cru s SER 6 Ca 0.03 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 55.46 2cru s SER 6 Cb -0.01 -0.05 0.00 0.00 0.10 0.00 0.00 66.02 66.07 2cru s SER 6 CO -0.02 -0.91 0.00 0.61 0.98 0.00 0.00 173.24 173.89 2cru n GLY 7 N -1.69 1.57 3.58 7.32 0.00 -1.26 -5.15 105.19 109.56 2cru n GLY 7 Ca 0.02 -1.78 -0.15 0.00 0.00 0.00 0.00 46.02 44.11 2cru n GLY 7 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2cru s LEU 8 N 0.00 -0.65 0.25 0.99 2.96 -1.26 -5.15 118.68 115.82 2cru s LEU 8 Ca 0.00 1.01 -0.30 0.00 -0.22 0.00 0.00 54.13 54.63 2cru s LEU 8 Cb 0.00 2.39 -0.09 0.00 0.50 0.00 0.00 46.19 48.99 2cru s LEU 8 CO 0.00 -0.39 1.16 -0.60 -1.32 0.00 0.00 176.35 175.20 2cru s ARG 9 N -0.39 4.55 0.31 1.98 3.52 -1.26 -5.04 118.95 122.61 2cru s ARG 9 Ca -0.04 1.89 0.05 0.00 -0.13 0.00 0.00 55.73 57.49 2cru s ARG 9 Cb -0.03 -3.19 -0.06 0.00 -1.56 0.00 0.00 34.95 30.11 2cru s ARG 9 CO 0.04 0.05 0.01 1.03 -0.81 0.00 0.00 175.30 175.63 2cru s ARG 10 N -1.08 1.61 -0.22 5.12 0.52 -1.26 -5.16 118.95 118.49 2cru s ARG 10 Ca 0.48 -1.86 -0.10 0.00 -0.52 0.00 0.00 55.73 53.73 2cru s ARG 10 Cb -0.33 -0.98 0.08 0.00 0.52 0.00 0.00 34.95 34.24 2cru s ARG 10 CO 0.41 -0.10 0.49 1.14 0.02 0.00 0.00 175.30 177.26 2cru s GLN 11 N -3.83 0.44 -0.14 3.54 -2.07 -1.26 -5.15 119.66 111.20 2cru s GLN 11 Ca 0.33 1.05 -0.06 0.00 -1.82 0.00 0.00 55.36 54.87 2cru s GLN 11 Cb 0.07 0.26 0.06 0.00 -1.09 0.00 0.00 33.01 32.31 2cru s GLN 11 CO 0.14 -0.20 0.29 1.03 -1.32 0.00 0.00 175.29 175.23 2cru s ARG 12 N 2.10 0.21 -0.00 9.60 0.52 -1.26 -5.16 118.95 124.95 2cru s ARG 12 Ca -0.06 0.74 -0.21 0.00 -0.52 0.00 0.00 55.73 55.67 2cru s ARG 12 Cb -0.10 -0.01 0.04 0.00 0.52 0.00 0.00 34.95 35.41 2cru s ARG 12 CO -0.15 -0.24 0.47 -0.51 0.02 0.00 0.00 175.30 174.89 2cru s LEU 13 N 2.06 0.19 0.01 2.53 1.43 -1.26 -5.18 118.68 118.47 2cru s LEU 13 Ca -0.03 0.27 -0.11 0.00 -1.03 0.00 0.00 54.13 53.23 2cru s LEU 13 Cb -0.11 1.85 0.01 0.00 0.03 0.00 0.00 46.19 47.97 2cru s LEU 13 CO -0.09 -0.58 0.22 0.00 0.23 0.00 0.00 176.35 176.13 2cru s ALA 14 N -1.67 -0.51 0.44 4.21 0.00 -1.26 -5.14 121.76 117.83 2cru s ALA 14 Ca -0.10 -0.03 -0.23 0.00 0.00 0.00 0.00 51.96 51.61 2cru s ALA 14 Cb -0.02 0.17 -0.11 0.00 0.00 0.00 0.00 23.12 23.16 2cru s ALA 14 CO 0.04 -0.29 0.77 -1.91 0.00 0.00 0.00 175.76 174.37 2cru n GLU 15 N 1.08 0.90 -4.58 0.00 2.13 -1.26 -4.99 120.64 113.92 2cru n GLU 15 Ca -0.21 0.33 -0.31 0.00 0.66 0.00 0.00 57.16 57.63 2cru n GLU 15 Cb 0.57 -1.78 -0.12 0.00 0.27 0.00 0.00 31.44 30.38 2cru n GLU 15 CO 0.00 0.00 0.00 -0.48 -0.41 0.00 0.00 177.13 176.24 2cru s LEU 16 N 0.47 2.74 -0.13 4.31 0.05 -1.26 -5.12 118.68 119.74 2cru s LEU 16 Ca 0.65 -0.37 -0.01 0.00 0.05 0.00 0.00 54.13 54.44 2cru s LEU 16 Cb -0.56 -1.60 0.03 0.00 -2.05 0.00 0.00 46.19 42.01 2cru s LEU 16 CO 0.56 0.25 -0.05 -1.10 -0.55 0.00 0.00 176.35 175.47 2cru s GLN 17 N -1.50 1.32 0.34 1.48 -1.52 -1.26 -5.13 119.66 113.39 2cru s GLN 17 Ca 0.16 -0.32 0.03 0.00 -1.95 0.00 0.00 55.36 53.28 2cru s GLN 17 Cb -0.11 -1.70 -0.04 0.00 -0.22 0.00 0.00 33.01 30.94 2cru s GLN 17 CO 0.06 -0.36 0.12 0.00 -0.25 0.00 0.00 175.29 174.86 2cru s ALA 18 N 1.72 2.37 0.59 6.09 0.00 -1.26 -5.17 121.76 126.11 2cru s ALA 18 Ca 0.03 -1.66 -0.02 0.00 0.00 0.00 0.00 51.96 50.31 2cru s ALA 18 Cb -0.14 0.88 0.04 0.00 0.00 0.00 0.00 23.12 23.90 2cru s ALA 18 CO -0.08 -0.39 0.86 -1.59 0.00 0.00 0.00 175.76 174.55 2cru s LYS 19 N -3.82 2.53 0.27 0.00 -2.85 -1.26 -4.98 119.74 109.62 2cru s LYS 19 Ca 0.32 -0.49 -0.00 0.00 -1.00 0.00 0.00 55.97 54.79 2cru s LYS 19 Cb 0.05 -2.37 0.59 0.00 -2.06 0.00 0.00 37.83 34.05 2cru s LYS 19 CO 0.16 -0.84 1.70 0.45 0.10 0.00 0.00 175.35 176.92 2cru h HIS 20 N -0.14 0.50 -3.28 1.78 3.86 -2.08 -3.38 115.15 112.41 2cru h HIS 20 Ca -0.44 0.04 -0.56 0.00 -1.16 0.00 0.00 60.37 58.25 2cru h HIS 20 Cb 1.29 -0.09 -0.05 0.00 1.06 0.00 0.00 27.41 29.62 2cru h HIS 20 CO 0.38 -0.04 0.49 0.20 0.86 0.00 0.00 177.93 179.82 2cru s GLY 21 N -3.67 2.30 -0.13 2.45 0.00 -1.26 -5.01 107.32 102.00 2cru s GLY 21 Ca -0.12 0.27 -0.30 0.00 0.00 0.00 0.00 44.72 44.56 2cru s GLY 21 CO 0.77 1.80 0.98 0.51 0.00 0.00 0.00 173.10 177.16 2cru s ASP 22 N 1.09 -0.36 0.00 1.64 1.47 -1.26 -5.01 116.67 114.24 2cru s ASP 22 Ca 0.45 0.31 0.12 0.00 1.18 0.00 0.00 52.55 54.61 2cru s ASP 22 Cb -0.18 0.32 0.73 0.00 -0.34 0.00 0.00 42.92 43.45 2cru s ASP 22 CO 0.16 -0.40 1.16 -0.81 0.68 0.00 0.00 175.17 175.97 2cru n PRO 23 N 0.50 0.49 -0.32 2.11 -0.04 -1.26 -3.98 135.00 132.50 2cru n PRO 23 Ca -0.10 0.00 0.19 0.00 -0.04 0.00 0.00 63.50 63.56 2cru n PRO 23 Cb 0.59 -1.39 0.37 0.00 -0.04 0.00 0.00 33.50 33.03 2cru n PRO 23 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2cru n GLY 24 N -0.01 -1.12 0.40 0.55 0.00 -1.26 -0.53 105.19 103.22 2cru n GLY 24 Ca 0.09 0.88 -0.06 0.00 0.00 0.00 0.00 46.02 46.93 2cru n GLY 24 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2cru h ASP 25 N 0.00 -1.76 -0.98 1.61 1.82 -2.01 0.59 116.42 115.69 2cru h ASP 25 Ca 0.65 0.31 0.34 0.00 -0.39 0.00 0.00 57.03 57.94 2cru h ASP 25 Cb 1.49 0.83 -0.17 0.00 0.68 0.00 0.00 39.33 42.17 2cru h ASP 25 CO -0.85 -0.27 0.39 0.00 -1.61 0.00 0.00 179.24 176.91 2cru h ALA 26 N 0.89 1.77 -0.23 -0.78 0.00 -1.15 0.47 119.26 120.22 2cru h ALA 26 Ca 0.24 0.26 -0.06 0.00 0.00 0.00 0.00 54.91 55.35 2cru h ALA 26 Cb 0.51 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2cru h ALA 26 CO -0.92 -0.71 -0.08 0.00 0.00 0.00 0.00 179.25 177.54 2cru h ALA 27 N 1.93 0.32 -0.69 0.00 0.00 0.07 -2.89 119.26 117.99 2cru h ALA 27 Ca 0.72 -0.28 0.13 0.00 0.00 0.00 0.00 54.91 55.48 2cru h ALA 27 Cb 1.72 -0.08 -0.13 0.00 0.00 0.00 0.00 17.79 19.30 2cru h ALA 27 CO -0.74 0.14 -0.28 0.37 0.00 0.00 0.00 179.25 178.74 2cru h GLN 28 N 0.19 -0.08 -0.26 0.00 5.75 0.69 0.56 115.11 121.96 2cru h GLN 28 Ca 0.05 0.01 -0.05 0.00 -0.15 0.00 0.00 58.65 58.51 2cru h GLN 28 Cb 0.56 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.11 2cru h GLN 28 CO 0.03 -0.05 -0.04 1.96 -2.65 0.00 0.00 178.83 178.08 2cru h GLN 29 N -0.08 0.40 -0.46 1.69 4.20 -1.48 -2.38 115.11 117.00 2cru h GLN 29 Ca 0.30 -0.08 -0.13 0.00 0.06 0.00 0.00 58.65 58.79 2cru h GLN 29 Cb 0.55 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 2cru h GLN 29 CO -0.75 0.46 -0.23 1.49 -0.67 0.00 0.00 178.83 179.13 2cru h GLU 30 N 0.38 0.97 0.82 1.46 4.81 0.13 -1.63 114.58 121.53 2cru h GLU 30 Ca 0.08 -0.43 -0.04 0.00 -0.13 0.00 0.00 59.36 58.85 2cru h GLU 30 Cb 0.32 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.68 2cru h GLU 30 CO 0.01 1.10 -0.40 0.00 -0.73 0.00 0.00 179.01 178.99 2cru h ALA 31 N 0.85 -1.12 -0.76 2.92 0.00 -0.09 -2.75 119.26 118.31 2cru h ALA 31 Ca 0.10 -0.24 0.11 0.00 0.00 0.00 0.00 54.91 54.88 2cru h ALA 31 Cb 0.81 0.43 -0.08 0.00 0.00 0.00 0.00 17.79 18.95 2cru h ALA 31 CO 0.07 -1.04 0.39 1.57 0.00 0.00 0.00 179.25 180.23 2cru h LYS 32 N -1.28 0.61 -0.18 0.00 2.10 -1.51 -2.46 116.57 113.85 2cru h LYS 32 Ca -0.11 -0.04 0.04 0.00 -2.00 0.00 0.00 60.65 58.55 2cru h LYS 32 Cb 0.85 -0.14 -0.07 0.00 -0.90 0.00 0.00 32.23 31.97 2cru h LYS 32 CO 0.19 0.40 -0.45 1.25 -2.00 0.00 0.00 179.45 178.84 2cru h HIS 33 N 0.62 -1.31 -0.66 0.07 2.76 -1.26 -1.47 115.15 113.90 2cru h HIS 33 Ca 0.39 0.05 0.14 0.00 -2.20 0.00 0.00 60.37 58.75 2cru h HIS 33 Cb 0.45 0.60 -0.11 0.00 1.55 0.00 0.00 27.41 29.89 2cru h HIS 33 CO -0.10 -0.49 0.00 0.00 -1.30 0.00 0.00 177.93 176.04 2cru h ARG 34 N -0.48 0.11 -1.30 5.26 2.47 -1.13 0.19 114.38 119.50 2cru h ARG 34 Ca 0.08 -0.01 0.41 0.00 -1.26 0.00 0.00 59.98 59.20 2cru h ARG 34 Cb 0.63 -0.02 -0.12 0.00 -1.65 0.00 0.00 29.97 28.81 2cru h ARG 34 CO -0.44 0.07 0.85 1.49 0.56 0.00 0.00 179.97 182.50 2cru h GLU 35 N 0.11 0.12 -0.00 0.04 4.22 -1.07 1.64 114.58 119.64 2cru h GLU 35 Ca 0.35 -0.01 -0.18 0.00 0.08 0.00 0.00 59.36 59.60 2cru h GLU 35 Cb 0.58 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 2cru h GLU 35 CO -0.57 0.08 -0.83 0.00 -2.18 0.00 0.00 179.01 175.51 2cru h ALA 36 N 1.57 0.61 -0.18 2.92 0.00 -0.53 -2.51 119.26 121.13 2cru h ALA 36 Ca 0.78 -0.72 -0.21 0.00 0.00 0.00 0.00 54.91 54.76 2cru h ALA 36 Cb 2.45 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 20.15 2cru h ALA 36 CO -0.36 0.95 -0.73 0.93 0.00 0.00 0.00 179.25 180.04 2cru h GLU 37 N 0.06 0.80 0.09 0.00 4.39 0.25 -2.64 114.58 117.53 2cru h GLU 37 Ca -0.03 -0.62 -0.00 0.00 0.34 0.00 0.00 59.36 59.05 2cru h GLU 37 Cb 1.45 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 30.22 2cru h GLU 37 CO 0.12 1.23 -0.04 0.52 -1.16 0.00 0.00 179.01 179.68 2cru h MET 38 N 0.57 -0.11 -0.97 2.33 2.86 -1.01 -2.81 114.93 115.78 2cru h MET 38 Ca -0.04 0.01 0.11 0.00 -2.06 0.00 0.00 59.70 57.72 2cru h MET 38 Cb 1.35 0.03 -0.08 0.00 0.06 0.00 0.00 31.60 32.96 2cru h MET 38 CO 0.15 0.29 0.62 0.07 1.06 0.00 0.00 176.91 179.10 2cru h ARG 39 N -0.54 0.93 0.58 1.72 0.11 -1.54 0.33 114.38 115.98 2cru h ARG 39 Ca -0.01 -0.06 -0.03 0.00 0.10 0.00 0.00 59.98 59.99 2cru h ARG 39 Cb 0.45 -0.21 0.00 0.00 1.11 0.00 0.00 29.97 31.32 2cru h ARG 39 CO 0.02 0.62 -0.31 -0.91 0.10 0.00 0.00 179.97 179.48 2cru h ASN 40 N 0.96 -0.76 0.45 0.08 2.35 -1.43 -2.04 115.58 115.19 2cru h ASN 40 Ca 0.47 0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 56.24 2cru h ASN 40 Cb 0.47 0.21 0.00 0.00 0.05 0.00 0.00 38.32 39.06 2cru h ASN 40 CO -0.24 -0.51 -0.22 -1.28 -1.65 0.00 0.00 177.43 173.54 2cru h SER 41 N -0.83 -0.51 -1.33 5.81 0.87 -1.18 -2.26 113.55 114.12 2cru h SER 41 Ca -0.07 -0.09 0.39 0.00 -1.23 0.00 0.00 61.79 60.78 2cru h SER 41 Cb 0.66 0.13 -0.05 0.00 -0.44 0.00 0.00 62.40 62.69 2cru h SER 41 CO 0.10 -0.18 1.08 0.40 -0.53 0.00 0.00 176.83 177.70 2cru h ILE 42 N -0.87 0.18 0.13 2.23 2.04 -0.40 1.21 117.51 122.04 2cru h ILE 42 Ca -0.06 0.00 -0.30 0.00 1.00 0.00 0.00 64.86 65.49 2cru h ILE 42 Cb 0.57 0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 2cru h ILE 42 CO 0.10 0.00 -1.48 -0.07 0.00 0.00 0.00 178.15 176.70 2cru h LEU 43 N 0.00 0.44 -0.58 1.44 3.38 -1.10 -2.91 115.31 115.99 2cru h LEU 43 Ca 0.63 -0.57 -0.15 0.00 0.09 0.00 0.00 57.88 57.88 2cru h LEU 43 Cb 2.78 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 43.37 2cru h LEU 43 CO -0.01 1.47 -0.71 0.00 0.09 0.00 0.00 178.44 179.29 2cru h ALA 44 N 0.46 0.82 0.02 1.53 0.00 0.19 -1.12 119.26 121.16 2cru h ALA 44 Ca -0.23 -0.63 -0.24 0.00 0.00 0.00 0.00 54.91 53.81 2cru h ALA 44 Cb 2.02 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 19.72 2cru h ALA 44 CO 0.18 0.86 -1.01 -0.56 0.00 0.00 0.00 179.25 178.73 2cru h GLN 45 N 0.03 0.45 0.00 0.00 3.07 -0.59 -3.20 115.11 114.88 2cru h GLN 45 Ca -0.01 -0.51 0.00 0.00 0.09 0.00 0.00 58.65 58.22 2cru h GLN 45 Cb 1.25 0.15 0.00 0.00 0.08 0.00 0.00 27.48 28.96 2cru h GLN 45 CO 0.10 1.16 -0.26 -0.39 0.09 0.00 0.00 178.83 179.53 2cru h VAL 46 N 0.24 0.00 -3.62 1.86 -1.51 -1.50 -3.42 116.25 108.29 2cru h VAL 46 Ca -0.10 -0.58 -0.68 0.00 -1.23 0.00 0.00 66.70 64.11 2cru h VAL 46 Cb 1.65 1.41 -0.31 0.00 -2.13 0.00 0.00 31.29 31.92 2cru h VAL 46 CO 0.18 0.00 -0.70 -0.76 -1.23 0.00 0.00 177.57 175.06 2cru s LEU 47 N -4.69 3.61 0.59 4.19 1.43 -0.43 -1.15 118.68 122.23 2cru s LEU 47 Ca 0.08 -0.99 -0.18 0.00 -1.03 0.00 0.00 54.13 52.00 2cru s LEU 47 Cb 0.12 -1.73 -0.04 0.00 0.03 0.00 0.00 46.19 44.57 2cru s LEU 47 CO 0.66 -0.20 1.16 -0.62 0.23 0.00 0.00 176.35 177.58 2cru s ASP 48 N 1.34 5.37 0.36 2.29 2.15 -0.28 -4.52 116.67 123.38 2cru s ASP 48 Ca -0.01 2.24 0.25 0.00 0.43 0.00 0.00 52.55 55.46 2cru s ASP 48 Cb -0.18 -2.58 1.25 0.00 -0.30 0.00 0.00 42.92 41.10 2cru s ASP 48 CO -0.02 -1.46 1.34 1.67 -0.17 0.00 0.00 175.17 176.53 2cru n GLN 49 N -1.62 -0.04 0.08 4.34 7.27 -1.26 -0.38 117.38 125.76 2cru n GLN 49 Ca 0.12 1.10 -0.03 0.00 0.07 0.00 0.00 57.00 58.26 2cru n GLN 49 Cb 0.51 -2.12 -0.01 0.00 2.41 0.00 0.00 30.24 31.02 2cru n GLN 49 CO 0.00 0.00 0.00 0.77 0.07 0.00 0.00 177.06 177.90 2cru h SER 50 N 0.00 -0.17 -0.79 1.69 0.02 -1.88 -3.09 113.55 109.34 2cru h SER 50 Ca 0.75 0.01 0.14 0.00 -0.84 0.00 0.00 61.79 61.84 2cru h SER 50 Cb 2.30 0.04 -0.09 0.00 0.14 0.00 0.00 62.40 64.79 2cru h SER 50 CO -0.47 -0.10 0.37 0.00 -1.14 0.00 0.00 176.83 175.49 2cru h ALA 51 N -1.88 1.14 -0.88 3.77 0.00 -1.11 -2.40 119.26 117.91 2cru h ALA 51 Ca -0.02 0.09 0.10 0.00 0.00 0.00 0.00 54.91 55.09 2cru h ALA 51 Cb 0.15 0.02 -0.13 0.00 0.00 0.00 0.00 17.79 17.84 2cru h ALA 51 CO 0.03 -0.13 -0.50 -0.09 0.00 0.00 0.00 179.25 178.56 2cru h ARG 52 N 0.55 -0.07 -0.03 0.00 9.65 -0.75 -1.95 114.38 121.78 2cru h ARG 52 Ca 0.43 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.31 2cru h ARG 52 Cb 0.60 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.19 2cru h ARG 52 CO -0.36 -0.05 -0.04 0.00 2.80 0.00 0.00 179.97 182.32 2cru h ALA 53 N 0.73 -0.36 -0.46 2.80 0.00 -1.34 -2.61 119.26 118.02 2cru h ALA 53 Ca 0.21 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.16 2cru h ALA 53 Cb 0.50 0.71 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 2cru h ALA 53 CO -0.88 -0.38 -0.27 -2.13 0.00 0.00 0.00 179.25 175.58 2cru n ARG 54 N -2.88 -0.20 -0.28 0.00 3.00 -0.84 0.13 116.66 115.59 2cru n ARG 54 Ca -0.00 1.07 0.27 0.00 -0.00 0.00 0.00 57.85 59.18 2cru n ARG 54 Cb 0.03 -1.58 0.50 0.00 0.00 0.00 0.00 32.46 31.41 2cru n ARG 54 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 2cru n LEU 55 N -4.05 0.27 -0.09 6.15 7.94 -0.80 0.19 117.00 126.61 2cru n LEU 55 Ca 0.01 1.46 -0.13 0.00 -1.11 0.00 0.00 56.01 56.25 2cru n LEU 55 Cb 0.12 -0.70 -0.04 0.00 0.53 0.00 0.00 43.42 43.33 2cru n LEU 55 CO -0.07 -1.63 0.62 -1.28 -1.11 0.00 0.00 177.39 173.92 2cru h SER 56 N 0.00 0.65 -0.81 1.96 0.87 0.14 -3.04 113.55 113.32 2cru h SER 56 Ca 0.73 -0.44 0.08 0.00 -1.23 0.00 0.00 61.79 60.93 2cru h SER 56 Cb 1.90 -0.18 -0.07 0.00 -0.44 0.00 0.00 62.40 63.62 2cru h SER 56 CO -0.69 0.95 0.48 -0.55 -0.53 0.00 0.00 176.83 176.49 2cru h ASN 57 N 0.35 0.71 0.14 6.23 -1.07 0.29 -0.18 115.58 122.05 2cru h ASN 57 Ca 0.05 0.04 -0.03 0.00 0.07 0.00 0.00 56.30 56.43 2cru h ASN 57 Cb 0.74 -0.11 -0.00 0.00 -2.07 0.00 0.00 38.32 36.88 2cru h ASN 57 CO 0.05 0.43 -0.12 0.25 0.07 0.00 0.00 177.43 178.11 2cru h LEU 58 N 0.83 0.00 -0.45 6.14 5.85 -1.23 -1.35 115.31 125.10 2cru h LEU 58 Ca 0.38 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.10 2cru h LEU 58 Cb 0.28 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.31 2cru h LEU 58 CO -0.21 0.12 0.00 0.00 -0.34 0.00 0.00 178.44 178.01 2cru n ALA 59 N -2.48 1.08 -0.07 1.25 0.00 -0.08 -0.38 120.51 119.83 2cru n ALA 59 Ca -0.03 0.06 -0.06 0.00 0.00 0.00 0.00 53.44 53.42 2cru n ALA 59 Cb 0.20 -1.12 -0.02 0.00 0.00 0.00 0.00 19.45 18.51 2cru n ALA 59 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2cru n LEU 60 N -1.75 1.69 -0.32 0.00 4.77 -0.51 -4.02 117.00 116.86 2cru n LEU 60 Ca -0.00 0.48 -0.04 0.00 -0.03 0.00 0.00 56.01 56.41 2cru n LEU 60 Cb 0.03 -0.79 0.08 0.00 -2.33 0.00 0.00 43.42 40.41 2cru n LEU 60 CO 0.04 -0.40 1.15 1.62 -1.33 0.00 0.00 177.39 178.48 2cru h VAL 61 N -0.91 1.26 -0.69 4.08 3.04 -1.56 -3.42 116.25 118.04 2cru h VAL 61 Ca 0.00 -0.65 0.13 0.00 -1.01 0.00 0.00 66.70 65.17 2cru h VAL 61 Cb 0.65 0.10 -0.21 0.00 -2.01 0.00 0.00 31.29 29.82 2cru h VAL 61 CO 0.00 0.29 -0.16 -1.59 -1.01 0.00 0.00 177.57 175.10 2cru s LYS 62 N -5.81 0.39 0.19 4.17 -2.85 0.49 -5.04 119.74 111.28 2cru s LYS 62 Ca -0.13 0.54 -0.05 0.00 -1.00 0.00 0.00 55.97 55.33 2cru s LYS 62 Cb 0.16 0.28 0.11 0.00 -2.06 0.00 0.00 37.83 36.33 2cru s LYS 62 CO 0.83 -0.58 1.54 -1.00 0.10 0.00 0.00 175.35 176.24 2cru h PRO 63 N 7.85 0.70 -0.37 1.78 0.13 -1.68 -3.32 132.00 137.08 2cru h PRO 63 Ca -0.12 -0.37 0.03 0.00 -0.87 0.00 0.00 66.00 64.68 2cru h PRO 63 Cb 1.18 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.27 2cru h PRO 63 CO 0.07 0.98 -0.22 -1.91 -0.23 0.00 0.00 178.00 176.70 2cru n GLU 64 N -4.03 -0.16 -0.08 0.86 2.13 -1.26 -0.62 120.64 117.48 2cru n GLU 64 Ca -0.02 1.07 -0.07 0.00 0.66 0.00 0.00 57.16 58.79 2cru n GLU 64 Cb 0.54 -1.59 -0.01 0.00 0.27 0.00 0.00 31.44 30.65 2cru n GLU 64 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 2cru h LYS 65 N 0.00 -0.22 -0.73 5.31 1.79 -1.94 -1.99 116.57 118.79 2cru h LYS 65 Ca 0.06 0.02 0.12 0.00 -2.18 0.00 0.00 60.65 58.66 2cru h LYS 65 Cb 0.15 0.05 -0.13 0.00 -1.58 0.00 0.00 32.23 30.72 2cru h LYS 65 CO -0.35 -0.15 -0.37 1.15 -1.08 0.00 0.00 179.45 178.65 2cru h THR 66 N -0.23 0.10 -0.03 -0.16 2.02 -0.96 -0.30 112.91 113.35 2cru h THR 66 Ca 0.16 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.36 2cru h THR 66 Cb 0.49 0.10 -0.04 0.00 -1.74 0.00 0.00 68.15 66.96 2cru h THR 66 CO -0.46 0.00 -0.38 0.11 0.37 0.00 0.00 175.52 175.16 2cru h LYS 67 N -0.12 -0.43 -0.42 6.66 1.57 -0.33 0.19 116.57 123.70 2cru h LYS 67 Ca 0.26 0.03 0.07 0.00 -1.87 0.00 0.00 60.65 59.14 2cru h LYS 67 Cb 0.56 0.10 -0.09 0.00 0.08 0.00 0.00 32.23 32.88 2cru h LYS 67 CO -0.79 -0.29 -0.47 0.00 -0.57 0.00 0.00 179.45 177.34 2cru h ALA 68 N -0.72 -0.52 -0.67 3.86 0.00 -1.05 0.17 119.26 120.33 2cru h ALA 68 Ca 0.01 0.05 0.13 0.00 0.00 0.00 0.00 54.91 55.10 2cru h ALA 68 Cb 0.49 0.97 -0.09 0.00 0.00 0.00 0.00 17.79 19.16 2cru h ALA 68 CO -0.27 -0.92 0.19 0.28 0.00 0.00 0.00 179.25 178.54 2cru h VAL 69 N -0.34 0.63 0.23 0.00 2.07 -0.73 0.47 116.25 118.57 2cru h VAL 69 Ca 0.12 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 2cru h VAL 69 Cb 0.59 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 2cru h VAL 69 CO -0.59 0.06 -0.11 -0.33 0.02 0.00 0.00 177.57 176.62 2cru h GLU 70 N 0.32 -0.29 0.00 1.57 5.08 0.11 -2.20 114.58 119.17 2cru h GLU 70 Ca 0.36 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.71 2cru h GLU 70 Cb 0.55 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 2cru h GLU 70 CO -0.42 -0.19 -0.14 -0.91 -1.00 0.00 0.00 179.01 176.35 2cru h ASN 71 N -0.31 0.00 -0.56 1.42 2.35 0.02 -2.45 115.58 116.05 2cru h ASN 71 Ca -0.03 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.62 2cru h ASN 71 Cb 0.24 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 2cru h ASN 71 CO 0.05 0.14 -0.05 0.22 -1.65 0.00 0.00 177.43 176.14 2cru h TYR 72 N 0.00 1.14 0.04 1.19 3.20 0.50 -3.07 116.97 119.97 2cru h TYR 72 Ca -0.00 -0.21 -0.00 0.00 3.14 0.00 0.00 58.73 61.65 2cru h TYR 72 Cb 0.35 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.33 2cru h TYR 72 CO 0.00 1.03 -0.02 -0.07 -1.64 0.00 0.00 178.16 177.46 2cru h LEU 73 N 0.94 -0.05 -0.90 2.82 3.38 -0.97 -3.18 115.31 117.34 2cru h LEU 73 Ca 0.16 -0.53 0.08 0.00 0.09 0.00 0.00 57.88 57.68 2cru h LEU 73 Cb 0.61 0.01 -0.11 0.00 0.09 0.00 0.00 40.66 41.26 2cru h LEU 73 CO 0.04 0.52 -0.57 0.40 0.09 0.00 0.00 178.44 178.92 2cru h ILE 74 N -0.65 0.00 -0.34 1.22 2.04 -1.49 0.25 117.51 118.55 2cru h ILE 74 Ca -0.01 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.92 2cru h ILE 74 Cb 0.57 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.57 2cru h ILE 74 CO 0.01 0.00 -0.36 1.56 0.00 0.00 0.00 178.15 179.36 2cru h GLN 75 N -0.05 -0.30 -0.97 2.37 4.20 -1.64 0.60 115.11 119.32 2cru h GLN 75 Ca 0.14 0.02 0.14 0.00 0.06 0.00 0.00 58.65 59.02 2cru h GLN 75 Cb 0.42 0.07 -0.08 0.00 0.30 0.00 0.00 27.48 28.19 2cru h GLN 75 CO -0.87 -0.20 0.61 0.52 -0.67 0.00 0.00 178.83 178.22 2cru h MET 76 N -0.32 0.83 0.10 1.46 2.86 -1.00 -1.91 114.93 116.96 2cru h MET 76 Ca 0.14 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.73 2cru h MET 76 Cb 0.56 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 32.03 2cru h MET 76 CO -0.51 0.55 -0.07 0.00 1.06 0.00 0.00 176.91 177.94 2cru h ALA 77 N 1.58 -0.16 -0.47 6.32 0.00 0.16 -1.17 119.26 125.51 2cru h ALA 77 Ca 0.50 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.47 2cru h ALA 77 Cb 0.65 0.09 -0.10 0.00 0.00 0.00 0.00 17.79 18.43 2cru h ALA 77 CO -0.27 -0.60 -0.30 0.00 0.00 0.00 0.00 179.25 178.09 2cru h ARG 78 N -0.18 -0.18 0.00 0.00 3.08 -0.47 0.33 114.38 116.96 2cru h ARG 78 Ca -0.01 0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 2cru h ARG 78 Cb 0.16 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 2cru h ARG 78 CO -0.00 -0.12 -0.13 1.88 -1.07 0.00 0.00 179.97 180.53 2cru h TYR 79 N -0.19 0.00 -0.45 3.04 0.05 -1.36 -3.46 116.97 114.60 2cru h TYR 79 Ca 0.21 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.99 2cru h TYR 79 Cb 0.52 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.26 2cru h TYR 79 CO -0.55 0.13 0.00 0.41 -1.05 0.00 0.00 178.16 177.10 2cru n GLY 80 N -1.00 0.99 0.13 3.88 0.00 0.12 -5.00 105.19 104.29 2cru n GLY 80 Ca -0.02 -0.44 -0.20 0.00 0.00 0.00 0.00 46.02 45.36 2cru n GLY 80 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2cru h GLN 81 N 0.00 0.33 -6.15 1.61 4.20 -1.58 -3.46 115.11 110.07 2cru h GLN 81 Ca 0.00 -0.56 -0.64 0.00 0.06 0.00 0.00 58.65 57.51 2cru h GLN 81 Cb 0.60 0.21 0.01 0.00 0.30 0.00 0.00 27.48 28.60 2cru h GLN 81 CO 0.00 1.22 1.22 1.28 -0.67 0.00 0.00 178.83 181.87 2cru n LEU 82 N -3.52 2.98 -0.02 1.46 4.32 -1.26 -4.86 117.00 116.09 2cru n LEU 82 Ca -0.20 0.74 -0.13 0.00 -0.02 0.00 0.00 56.01 56.40 2cru n LEU 82 Cb 1.06 -1.34 -0.08 0.00 -1.62 0.00 0.00 43.42 41.43 2cru n LEU 82 CO 0.52 -0.35 0.69 0.28 -1.22 0.00 0.00 177.39 177.31 2cru h SER 83 N 10.63 0.09 -5.05 -1.43 0.02 -1.99 -3.47 113.55 112.34 2cru h SER 83 Ca -0.42 -0.38 -0.01 0.00 -0.84 0.00 0.00 61.79 60.14 2cru h SER 83 Cb 1.29 -0.03 -0.10 0.00 0.14 0.00 0.00 62.40 63.70 2cru h SER 83 CO 0.97 0.45 0.10 -1.83 -1.14 0.00 0.00 176.83 175.38 2cru s GLU 84 N -4.70 1.38 0.13 3.45 -1.05 -1.26 -5.13 118.70 111.52 2cru s GLU 84 Ca -0.15 -0.75 -0.28 0.00 -0.15 0.00 0.00 54.97 53.64 2cru s GLU 84 Cb 0.03 0.55 -0.16 0.00 -0.44 0.00 0.00 34.13 34.11 2cru s GLU 84 CO 0.69 -0.59 0.60 1.63 0.95 0.00 0.00 175.26 178.53 2cru n LYS 85 N -0.36 0.00 -3.02 -4.83 5.02 -1.26 -4.88 118.16 108.83 2cru n LYS 85 Ca -0.12 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.78 2cru n LYS 85 Cb 0.63 -1.02 -0.05 0.00 -0.02 0.00 0.00 35.03 34.57 2cru n LYS 85 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2cru s VAL 86 N -0.66 4.69 0.25 -0.18 1.01 -0.30 -4.80 120.40 120.41 2cru s VAL 86 Ca 0.64 1.58 0.06 0.00 0.00 0.00 0.00 61.98 64.26 2cru s VAL 86 Cb -0.92 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 31.34 2cru s VAL 86 CO 0.51 0.41 0.30 -0.94 0.00 0.00 0.00 175.10 175.37 2cru s SER 87 N -0.30 5.97 0.27 3.32 1.04 -1.26 -1.13 113.70 121.61 2cru s SER 87 Ca 0.37 -0.08 0.05 0.00 0.48 0.00 0.00 55.95 56.77 2cru s SER 87 Cb -0.21 -1.64 0.74 0.00 0.10 0.00 0.00 66.02 65.02 2cru s SER 87 CO 0.23 -0.08 1.30 1.21 0.98 0.00 0.00 173.24 176.88 2cru n GLU 88 N -1.33 -0.06 0.05 4.02 2.13 -1.26 -0.89 120.64 123.30 2cru n GLU 88 Ca -0.08 1.22 -0.03 0.00 0.66 0.00 0.00 57.16 58.93 2cru n GLU 88 Cb 0.57 -1.99 -0.01 0.00 0.27 0.00 0.00 31.44 30.28 2cru n GLU 88 CO 0.00 0.00 0.00 0.37 -0.41 0.00 0.00 177.13 177.09 2cru h GLN 89 N 0.00 -0.15 -0.56 5.31 4.15 -1.97 -2.54 115.11 119.34 2cru h GLN 89 Ca 0.55 0.01 0.08 0.00 0.77 0.00 0.00 58.65 60.06 2cru h GLN 89 Cb 1.22 0.03 -0.10 0.00 0.21 0.00 0.00 27.48 28.85 2cru h GLN 89 CO -0.75 -0.10 -0.46 0.78 -1.93 0.00 0.00 178.83 176.37 2cru h GLY 90 N -0.16 -0.56 -0.38 2.39 0.00 -1.40 -2.40 103.07 100.55 2cru h GLY 90 Ca -0.01 0.60 0.03 0.00 0.00 0.00 0.00 47.33 47.95 2cru h GLY 90 CO 0.00 -0.15 -0.23 -2.00 0.00 0.00 0.00 176.54 174.17 2cru h LEU 91 N -0.25 -0.83 -1.00 3.11 5.85 -1.27 0.40 115.31 121.32 2cru h LEU 91 Ca 0.16 0.13 0.32 0.00 0.84 0.00 0.00 57.88 59.33 2cru h LEU 91 Cb 0.56 0.37 -0.18 0.00 0.37 0.00 0.00 40.66 41.78 2cru h LEU 91 CO -0.68 -0.09 0.18 -0.38 -0.34 0.00 0.00 178.44 177.13 2cru n ILE 92 N -3.87 -0.42 0.05 4.05 5.41 -0.93 0.23 119.36 123.89 2cru n ILE 92 Ca 0.01 2.14 -0.02 0.00 1.00 0.00 0.00 62.75 65.88 2cru n ILE 92 Cb 0.10 -3.23 0.23 0.00 -0.71 0.00 0.00 39.64 36.03 2cru n ILE 92 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2cru h GLU 93 N 0.00 0.37 0.04 0.38 4.39 -0.07 -3.12 114.58 116.57 2cru h GLU 93 Ca 0.68 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 60.24 2cru h GLU 93 Cb 1.56 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 30.19 2cru h GLU 93 CO -0.89 0.63 -0.02 0.82 -1.16 0.00 0.00 179.01 178.40 2cru h ILE 94 N 0.33 1.04 -1.02 3.13 2.04 0.52 -2.62 117.51 120.93 2cru h ILE 94 Ca 0.05 -0.24 0.25 0.00 1.00 0.00 0.00 64.86 65.92 2cru h ILE 94 Cb 0.68 1.20 -0.09 0.00 -0.74 0.00 0.00 36.82 37.88 2cru h ILE 94 CO 0.05 0.06 0.66 -0.07 0.00 0.00 0.00 178.15 178.85 2cru h LEU 95 N -0.15 0.42 -1.54 1.44 4.07 -1.27 0.94 115.31 119.22 2cru h LEU 95 Ca -0.00 0.07 -0.01 0.00 0.08 0.00 0.00 57.88 58.02 2cru h LEU 95 Cb 0.14 -0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.87 2cru h LEU 95 CO 0.01 0.11 0.01 0.29 -1.08 0.00 0.00 178.44 177.77 2cru n LYS 96 N -4.58 1.69 0.00 1.13 4.01 -0.99 -3.69 118.16 115.73 2cru n LYS 96 Ca 0.24 -0.58 0.00 0.00 -0.51 0.00 0.00 58.31 57.46 2cru n LYS 96 Cb 0.85 -1.61 0.00 0.00 -0.51 0.00 0.00 35.03 33.76 2cru n LYS 96 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 2cru n LYS 97 N 0.12 0.00 0.28 1.97 5.02 0.32 -4.44 118.16 121.43 2cru n LYS 97 Ca 0.06 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.47 2cru n LYS 97 Cb 0.45 -0.65 0.82 0.00 -0.02 0.00 0.00 35.03 35.63 2cru n LYS 97 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 2cru h VAL 98 N 0.00 0.67 0.00 -0.18 3.04 -1.41 0.46 116.25 118.84 2cru h VAL 98 Ca 0.00 -0.07 -0.08 0.00 -1.01 0.00 0.00 66.70 65.55 2cru h VAL 98 Cb 0.54 1.04 -0.01 0.00 -2.01 0.00 0.00 31.29 30.85 2cru h VAL 98 CO 0.00 0.02 -0.84 -0.24 -1.01 0.00 0.00 177.57 175.49 2cru n SER 99 N -4.02 1.84 -0.04 3.17 2.88 -1.25 -4.50 113.62 111.71 2cru n SER 99 Ca -0.03 0.54 -0.08 0.00 -1.33 0.00 0.00 58.87 57.97 2cru n SER 99 Cb 0.10 -0.87 -0.02 0.00 -0.75 0.00 0.00 64.21 62.67 2cru n SER 99 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 2cru h GLN 100 N -1.00 -0.16 -4.63 -1.46 5.75 -1.76 -3.45 115.11 108.40 2cru h GLN 100 Ca -0.11 0.01 -0.27 0.00 -0.15 0.00 0.00 58.65 58.13 2cru h GLN 100 Cb 0.80 0.04 -0.04 0.00 1.07 0.00 0.00 27.48 29.35 2cru h GLN 100 CO -0.07 -0.11 -0.37 0.94 -2.65 0.00 0.00 178.83 176.57 2cru n GLN 101 N -5.32 -2.77 -3.85 1.69 7.27 0.15 -4.86 117.38 109.69 2cru n GLN 101 Ca -0.01 0.47 -0.05 0.00 0.07 0.00 0.00 57.00 57.48 2cru n GLN 101 Cb 0.24 -5.10 0.02 0.00 2.41 0.00 0.00 30.24 27.81 2cru n GLN 101 CO 0.00 0.00 0.00 -0.08 0.07 0.00 0.00 177.06 177.05 2cru s THR 102 N -2.66 0.00 -0.21 1.69 -1.32 -1.26 -5.06 115.64 106.82 2cru s THR 102 Ca 0.16 -0.75 0.15 0.00 -1.21 0.00 0.00 61.69 60.04 2cru s THR 102 Cb -0.08 -2.90 0.45 0.00 -1.51 0.00 0.00 72.50 68.46 2cru s THR 102 CO 0.20 0.00 1.18 -1.84 -2.21 0.00 0.00 174.62 171.95 2cru n GLU 103 N -0.64 1.99 -0.09 7.08 -0.00 -1.26 -4.80 120.64 122.91 2cru n GLU 103 Ca -0.05 -3.39 -0.22 0.00 -0.00 0.00 0.00 57.16 53.50 2cru n GLU 103 Cb 0.60 -1.54 -0.12 0.00 -0.00 0.00 0.00 31.44 30.38 2cru n GLU 103 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 2cru h LYS 104 N 1.71 0.02 -5.36 3.44 3.11 -1.97 -3.48 116.57 114.05 2cru h LYS 104 Ca 0.05 -0.04 -0.44 0.00 -2.81 0.00 0.00 60.65 57.41 2cru h LYS 104 Cb 1.40 0.02 -0.24 0.00 -1.00 0.00 0.00 32.23 32.40 2cru h LYS 104 CO 0.30 1.02 -0.79 -0.08 -2.81 0.00 0.00 179.45 177.09 2cru s THR 105 N -2.38 1.14 -0.15 1.00 -1.32 -1.26 -5.07 115.64 107.60 2cru s THR 105 Ca -0.28 -1.10 -0.15 0.00 -1.21 0.00 0.00 61.69 58.95 2cru s THR 105 Cb 0.06 -1.05 -0.12 0.00 -1.51 0.00 0.00 72.50 69.88 2cru s THR 105 CO 0.61 -0.05 0.18 0.71 -2.21 0.00 0.00 174.62 173.85 2cru h THR 106 N 4.43 0.65 -1.75 5.08 1.35 -1.95 -3.49 112.91 117.23 2cru h THR 106 Ca -0.39 -1.63 0.02 0.00 -0.55 0.00 0.00 66.41 63.87 2cru h THR 106 Cb 1.18 1.36 -0.24 0.00 -1.73 0.00 0.00 68.15 68.72 2cru h THR 106 CO 0.43 0.22 0.34 0.28 -0.25 0.00 0.00 175.52 176.54 2cru s THR 107 N -2.12 0.00 -0.10 6.82 -1.32 -1.26 -5.08 115.64 112.58 2cru s THR 107 Ca -0.16 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 60.28 2cru s THR 107 Cb 0.02 -1.00 0.05 0.00 -1.51 0.00 0.00 72.50 70.06 2cru s THR 107 CO 0.38 0.00 0.14 -0.69 -2.21 0.00 0.00 174.62 172.24 2cru s VAL 108 N 0.11 -0.21 -0.01 5.08 1.01 -1.26 -5.14 120.40 119.98 2cru s VAL 108 Ca 0.01 0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.23 2cru s VAL 108 Cb -0.04 -0.36 0.00 0.00 0.00 0.00 0.00 36.38 35.98 2cru s VAL 108 CO -0.03 0.04 -0.03 -1.59 0.00 0.00 0.00 175.10 173.50 2cru s LYS 109 N 2.25 0.29 -0.14 2.72 -2.85 -1.26 -5.14 119.74 115.61 2cru s LYS 109 Ca 0.04 -0.09 0.02 0.00 -1.00 0.00 0.00 55.97 54.94 2cru s LYS 109 Cb -0.13 -0.31 0.01 0.00 -2.06 0.00 0.00 37.83 35.34 2cru s LYS 109 CO -0.07 0.04 -0.21 0.12 0.10 0.00 0.00 175.35 175.33 2cru s PHE 110 N 0.11 2.61 0.35 1.78 5.36 -1.26 -5.13 117.98 121.80 2cru s PHE 110 Ca -0.01 -1.35 0.08 0.00 -0.96 0.00 0.00 56.93 54.70 2cru s PHE 110 Cb -0.03 -1.79 -0.04 0.00 -0.34 0.00 0.00 43.02 40.82 2cru s PHE 110 CO -0.00 -0.63 0.15 0.54 -1.46 0.00 0.00 175.22 173.82 2cru s ASN 111 N 0.91 4.64 -0.27 6.13 2.20 -1.26 -5.14 114.94 122.16 2cru s ASN 111 Ca -0.05 -0.81 -0.09 0.00 -0.94 0.00 0.00 52.86 50.97 2cru s ASN 111 Cb -0.15 -0.69 0.12 0.00 -2.00 0.00 0.00 41.25 38.53 2cru s ASN 111 CO -0.04 -0.33 0.57 -0.60 -2.94 0.00 0.00 177.10 173.76 2cru s ARG 112 N -3.86 0.49 0.07 3.55 3.52 -1.26 -5.17 118.95 116.30 2cru s ARG 112 Ca 0.38 1.31 0.01 0.00 -0.13 0.00 0.00 55.73 57.29 2cru s ARG 112 Cb -0.02 0.68 -0.04 0.00 -1.56 0.00 0.00 34.95 34.02 2cru s ARG 112 CO 0.23 -0.23 -0.05 -1.12 -0.81 0.00 0.00 175.30 173.32 2cru s SER 113 N 2.80 0.80 -0.49 -2.12 0.01 -1.26 -5.11 113.70 108.34 2cru s SER 113 Ca -0.04 -0.95 0.06 0.00 1.31 0.00 0.00 55.95 56.34 2cru s SER 113 Cb -0.12 0.13 0.23 0.00 0.21 0.00 0.00 66.02 66.47 2cru s SER 113 CO -0.17 -0.49 0.82 0.61 0.41 0.00 0.00 173.24 174.42 2cru n GLY 114 N 0.21 0.01 0.22 3.44 0.00 -1.26 -5.00 105.19 102.81 2cru n GLY 114 Ca -0.14 0.14 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 2cru n GLY 114 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cru h PRO 115 N 4.29 0.55 -6.00 1.61 0.13 -2.07 -3.44 132.00 127.07 2cru h PRO 115 Ca -0.08 -0.29 -0.72 0.00 -0.87 0.00 0.00 66.00 64.04 2cru h PRO 115 Cb 1.04 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.16 2cru h PRO 115 CO 0.25 0.88 1.36 0.43 -0.23 0.00 0.00 178.00 180.69 2cru n SER 116 N -4.01 1.46 0.04 1.44 7.64 -1.26 -4.75 113.62 114.18 2cru n SER 116 Ca -0.02 0.55 0.00 0.00 1.01 0.00 0.00 58.87 60.41 2cru n SER 116 Cb 0.53 -1.08 0.00 0.00 -1.01 0.00 0.00 64.21 62.65 2cru n SER 116 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2cru n SER 117 N 8.65 0.80 0.00 6.43 7.64 -1.26 -5.28 113.62 130.60 2cru n SER 117 Ca 0.48 0.12 0.00 0.00 1.01 0.00 0.00 58.87 60.48 2cru n SER 117 Cb 0.10 -0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.07 2cru n SER 117 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64