#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e1c s LEU 25 N 0.00 4.12 0.81 2.45 1.43 -1.26 -5.10 118.68 121.12 2e1c s LEU 25 Ca 0.00 0.26 -0.07 0.00 -1.03 0.00 0.00 54.13 53.28 2e1c s LEU 25 Cb 0.00 -2.03 0.14 0.00 0.03 0.00 0.00 46.19 44.33 2e1c s LEU 25 CO 0.00 0.26 1.12 1.51 0.23 0.00 0.00 176.35 179.47 2e1c s ASP 26 N -0.14 3.98 0.33 2.29 1.47 -1.26 -4.89 116.67 118.44 2e1c s ASP 26 Ca 0.09 0.02 0.04 0.00 1.18 0.00 0.00 52.55 53.88 2e1c s ASP 26 Cb -0.12 -0.32 0.65 0.00 -0.34 0.00 0.00 42.92 42.79 2e1c s ASP 26 CO 0.01 -2.14 1.90 -0.33 0.68 0.00 0.00 175.17 175.29 2e1c h GLU 27 N -0.95 0.85 0.01 2.11 4.39 -1.99 -2.58 114.58 116.42 2e1c h GLU 27 Ca -0.41 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.24 2e1c h GLU 27 Cb 1.26 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 29.72 2e1c h GLU 27 CO 0.43 0.57 -0.01 0.82 -1.16 0.00 0.00 179.01 179.66 2e1c h ILE 28 N 0.88 1.03 -1.01 3.13 1.08 -1.99 -1.30 117.51 119.33 2e1c h ILE 28 Ca 0.40 -0.11 0.06 0.00 -0.39 0.00 0.00 64.86 64.81 2e1c h ILE 28 Cb 0.38 1.10 -0.07 0.00 -3.07 0.00 0.00 36.82 35.17 2e1c h ILE 28 CO -0.17 0.03 0.65 0.44 -0.69 0.00 0.00 178.15 178.42 2e1c h ASP 29 N -0.06 1.06 -0.73 1.72 3.32 -1.84 -0.19 116.42 119.69 2e1c h ASP 29 Ca -0.00 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.99 2e1c h ASP 29 Cb 0.06 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.35 2e1c h ASP 29 CO 0.00 0.69 0.22 0.11 -1.72 0.00 0.00 179.24 178.54 2e1c h LYS 30 N 1.21 1.15 -0.17 3.56 1.57 -1.14 0.11 116.57 122.86 2e1c h LYS 30 Ca 0.43 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 2e1c h LYS 30 Cb 0.12 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 2e1c h LYS 30 CO -0.16 0.98 0.08 0.87 -0.57 0.00 0.00 179.45 180.65 2e1c h LYS 31 N 1.09 0.25 -0.27 3.15 1.57 -0.31 -0.52 116.57 121.53 2e1c h LYS 31 Ca 0.23 -0.04 0.05 0.00 -1.87 0.00 0.00 60.65 59.02 2e1c h LYS 31 Cb 0.33 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.55 2e1c h LYS 31 CO -0.00 0.31 -0.03 0.82 -0.57 0.00 0.00 179.45 179.97 2e1c h ILE 32 N 0.13 0.77 -0.86 1.86 2.04 -0.67 -1.33 117.51 119.45 2e1c h ILE 32 Ca 0.06 -0.01 -0.03 0.00 1.00 0.00 0.00 64.86 65.88 2e1c h ILE 32 Cb 0.15 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 36.91 2e1c h ILE 32 CO -0.01 0.01 0.44 0.40 0.00 0.00 0.00 178.15 178.99 2e1c h ILE 33 N 0.04 1.26 -0.65 -0.67 2.04 -0.62 -1.16 117.51 117.75 2e1c h ILE 33 Ca 0.13 -0.69 -0.04 0.00 1.00 0.00 0.00 64.86 65.25 2e1c h ILE 33 Cb 0.19 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.37 2e1c h ILE 33 CO -0.25 0.30 0.24 0.50 0.00 0.00 0.00 178.15 178.95 2e1c h LYS 34 N 1.22 0.99 -0.37 2.37 3.64 -0.63 -0.92 116.57 122.87 2e1c h LYS 34 Ca 0.30 -0.19 -0.07 0.00 -1.27 0.00 0.00 60.65 59.41 2e1c h LYS 34 Cb 0.08 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 2e1c h LYS 34 CO -0.04 0.85 -0.05 0.82 -2.27 0.00 0.00 179.45 178.75 2e1c h ILE 35 N 0.93 1.27 -0.07 2.00 2.04 -0.89 -2.81 117.51 119.99 2e1c h ILE 35 Ca 0.22 -1.09 -0.11 0.00 1.00 0.00 0.00 64.86 64.87 2e1c h ILE 35 Cb 0.24 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 2e1c h ILE 35 CO -0.01 0.36 -0.46 -0.07 0.00 0.00 0.00 178.15 177.97 2e1c h LEU 36 N 0.49 0.17 -0.45 1.44 3.38 -1.03 -1.05 115.31 118.26 2e1c h LEU 36 Ca 0.10 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 2e1c h LEU 36 Cb 0.55 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2e1c h LEU 36 CO 0.03 0.61 -0.09 1.56 0.09 0.00 0.00 178.44 180.65 2e1c h GLN 37 N 0.13 0.85 -0.59 1.13 4.20 -1.16 -2.17 115.11 117.50 2e1c h GLN 37 Ca 0.01 -0.31 -0.06 0.00 0.06 0.00 0.00 58.65 58.34 2e1c h GLN 37 Cb 0.87 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.57 2e1c h GLN 37 CO 0.07 0.95 0.13 -0.97 -0.67 0.00 0.00 178.83 178.33 2e1c h ASN 38 N 0.68 0.91 -2.03 1.46 -0.73 -1.25 -3.41 115.58 111.22 2e1c h ASN 38 Ca 0.12 -0.24 -0.29 0.00 1.87 0.00 0.00 56.30 57.76 2e1c h ASN 38 Cb 0.62 -0.24 -0.32 0.00 0.27 0.00 0.00 38.32 38.65 2e1c h ASN 38 CO 0.04 0.92 -0.61 -0.62 -0.37 0.00 0.00 177.43 176.79 2e1c s ASP 39 N -6.31 1.29 0.20 1.15 2.15 -0.42 -5.02 116.67 109.72 2e1c s ASP 39 Ca -0.12 -0.63 0.12 0.00 0.43 0.00 0.00 52.55 52.35 2e1c s ASP 39 Cb 0.13 0.68 0.68 0.00 -0.30 0.00 0.00 42.92 44.11 2e1c s ASP 39 CO 0.82 -0.38 1.36 0.61 -0.17 0.00 0.00 175.17 177.41 2e1c n GLY 40 N 5.32 -0.69 0.90 2.66 0.00 -0.83 -1.29 105.19 111.27 2e1c n GLY 40 Ca -0.01 0.12 0.09 0.00 0.00 0.00 0.00 46.02 46.21 2e1c n GLY 40 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2e1c n LYS 41 N -1.93 2.31 -1.63 1.61 5.02 -1.26 -4.99 118.16 117.28 2e1c n LYS 41 Ca -0.01 -2.07 -0.49 0.00 -2.02 0.00 0.00 58.31 53.72 2e1c n LYS 41 Cb 0.06 -1.39 -0.05 0.00 -0.02 0.00 0.00 35.03 33.63 2e1c n LYS 41 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2e1c n ALA 42 N 1.05 0.32 -1.65 7.82 0.00 -0.41 -4.91 120.51 122.73 2e1c n ALA 42 Ca 0.15 0.48 -0.32 0.00 0.00 0.00 0.00 53.44 53.75 2e1c n ALA 42 Cb 0.49 -2.23 0.02 0.00 0.00 0.00 0.00 19.45 17.74 2e1c n ALA 42 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2e1c s PRO 43 N 0.68 3.24 0.35 0.00 0.04 -1.26 -4.93 135.00 133.12 2e1c s PRO 43 Ca 0.81 1.08 0.04 0.00 0.04 0.00 0.00 61.00 62.97 2e1c s PRO 43 Cb -0.80 -2.03 0.68 0.00 0.04 0.00 0.00 34.50 32.40 2e1c s PRO 43 CO 0.42 -0.86 1.95 -0.07 0.04 0.00 0.00 177.00 178.49 2e1c h LEU 44 N 0.04 0.72 -0.38 -3.56 3.38 -1.94 -2.02 115.31 111.55 2e1c h LEU 44 Ca -0.46 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.59 2e1c h LEU 44 Cb 1.21 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.74 2e1c h LEU 44 CO 0.58 0.47 -0.02 -0.09 0.09 0.00 0.00 178.44 179.47 2e1c h ARG 45 N 0.83 0.07 0.15 1.13 2.43 -1.94 0.40 114.38 117.45 2e1c h ARG 45 Ca 0.32 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.48 2e1c h ARG 45 Cb 0.21 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2e1c h ARG 45 CO -0.11 0.05 -0.07 1.49 -1.51 0.00 0.00 179.97 179.82 2e1c h GLU 46 N 0.08 -0.20 -0.54 0.20 4.81 -1.76 -1.14 114.58 116.03 2e1c h GLU 46 Ca 0.18 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.40 2e1c h GLU 46 Cb 0.26 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 2e1c h GLU 46 CO -0.33 -0.02 0.22 0.82 -0.73 0.00 0.00 179.01 178.97 2e1c h ILE 47 N -0.34 1.20 0.27 2.32 2.04 -1.20 -1.73 117.51 120.07 2e1c h ILE 47 Ca -0.02 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.22 2e1c h ILE 47 Cb 0.27 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 2e1c h ILE 47 CO 0.03 0.24 -0.13 -1.28 0.00 0.00 0.00 178.15 177.01 2e1c h SER 48 N 0.77 -0.31 -0.62 1.72 0.87 0.01 -1.05 113.55 114.94 2e1c h SER 48 Ca 0.19 -0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.71 2e1c h SER 48 Cb 0.14 0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 62.16 2e1c h SER 48 CO -0.02 -0.19 0.31 0.11 -0.53 0.00 0.00 176.83 176.51 2e1c h LYS 49 N -0.41 0.89 -0.28 2.24 1.79 -0.96 0.13 116.57 119.96 2e1c h LYS 49 Ca -0.04 -0.12 -0.10 0.00 -2.18 0.00 0.00 60.65 58.21 2e1c h LYS 49 Cb 0.31 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.78 2e1c h LYS 49 CO 0.06 0.70 -0.25 0.82 -1.08 0.00 0.00 179.45 179.71 2e1c h ILE 50 N 0.85 1.27 0.00 1.86 1.08 -1.27 -3.13 117.51 118.16 2e1c h ILE 50 Ca 0.21 -1.29 0.00 0.00 -0.39 0.00 0.00 64.86 63.39 2e1c h ILE 50 Cb 0.10 1.32 0.00 0.00 -3.07 0.00 0.00 36.82 35.18 2e1c h ILE 50 CO -0.03 0.41 -0.92 0.35 -0.69 0.00 0.00 178.15 177.28 2e1c n THR 51 N -4.12 0.51 -0.69 -0.27 -2.24 -0.40 -4.96 114.28 102.12 2e1c n THR 51 Ca -0.00 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 2e1c n THR 51 Cb 0.41 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 2e1c n THR 51 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2e1c n GLY 52 N 1.24 0.74 3.85 3.38 0.00 0.43 -5.05 105.19 109.78 2e1c n GLY 52 Ca 0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 2e1c n GLY 52 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2e1c s LEU 53 N 0.00 3.62 0.69 0.99 1.43 -0.98 -5.01 118.68 119.43 2e1c s LEU 53 Ca 0.00 -0.47 -0.13 0.00 -1.03 0.00 0.00 54.13 52.50 2e1c s LEU 53 Cb 0.00 -2.23 0.01 0.00 0.03 0.00 0.00 46.19 44.00 2e1c s LEU 53 CO 0.00 -0.33 1.08 0.00 0.23 0.00 0.00 176.35 177.34 2e1c s ALA 54 N -2.29 2.50 0.21 4.21 0.00 -1.26 -4.39 121.76 120.75 2e1c s ALA 54 Ca 0.40 0.31 -0.09 0.00 0.00 0.00 0.00 51.96 52.58 2e1c s ALA 54 Cb -0.06 -3.25 0.16 0.00 0.00 0.00 0.00 23.12 19.97 2e1c s ALA 54 CO 0.26 -1.33 1.85 0.93 0.00 0.00 0.00 175.76 177.47 2e1c h GLU 55 N -0.45 1.07 0.00 0.00 5.08 -1.93 -1.91 114.58 116.45 2e1c h GLU 55 Ca -0.45 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 57.76 2e1c h GLU 55 Cb 1.23 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 2e1c h GLU 55 CO 0.54 0.77 -0.22 0.66 -1.00 0.00 0.00 179.01 179.76 2e1c h SER 56 N 1.08 0.00 -0.33 1.42 4.64 -1.95 0.49 113.55 118.89 2e1c h SER 56 Ca 0.28 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.49 2e1c h SER 56 Cb -0.02 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.07 2e1c h SER 56 CO -0.05 0.22 -0.22 0.74 -0.87 0.00 0.00 176.83 176.65 2e1c h THR 57 N 0.00 1.29 -0.43 2.95 2.02 -1.74 -1.82 112.91 115.19 2e1c h THR 57 Ca -0.00 -1.36 -0.13 0.00 0.77 0.00 0.00 66.41 65.69 2e1c h THR 57 Cb 0.44 1.44 -0.01 0.00 -1.74 0.00 0.00 68.15 68.27 2e1c h THR 57 CO 0.03 0.44 -0.24 0.40 0.37 0.00 0.00 175.52 176.53 2e1c h ILE 58 N 0.51 1.27 -0.51 3.11 1.08 -0.84 -1.43 117.51 120.70 2e1c h ILE 58 Ca 0.07 -1.38 0.05 0.00 -0.39 0.00 0.00 64.86 63.20 2e1c h ILE 58 Cb 0.78 1.19 -0.04 0.00 -3.07 0.00 0.00 36.82 35.68 2e1c h ILE 58 CO 0.06 0.47 0.25 -0.74 -0.69 0.00 0.00 178.15 177.50 2e1c h HIS 59 N 0.76 0.46 -0.42 1.37 2.76 -0.75 0.23 115.15 119.56 2e1c h HIS 59 Ca 0.10 0.02 -0.13 0.00 -2.20 0.00 0.00 60.37 58.16 2e1c h HIS 59 Cb 0.79 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 29.60 2e1c h HIS 59 CO 0.05 0.22 -0.23 1.49 -1.30 0.00 0.00 177.93 178.16 2e1c h GLU 60 N 0.49 0.91 -0.43 5.26 4.57 -1.20 -1.52 114.58 122.66 2e1c h GLU 60 Ca 0.22 -0.41 0.05 0.00 -1.18 0.00 0.00 59.36 58.04 2e1c h GLU 60 Cb 0.14 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.66 2e1c h GLU 60 CO -0.16 1.06 0.17 0.00 -1.18 0.00 0.00 179.01 178.91 2e1c h ARG 61 N 0.73 0.35 -0.52 1.92 2.47 -0.65 -1.02 114.38 117.66 2e1c h ARG 61 Ca 0.09 -0.02 -0.08 0.00 -1.26 0.00 0.00 59.98 58.71 2e1c h ARG 61 Cb 0.81 -0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 29.03 2e1c h ARG 61 CO 0.07 0.23 0.01 0.82 0.56 0.00 0.00 179.97 181.65 2e1c h ILE 62 N 0.36 1.26 -0.43 2.04 2.04 -0.90 -0.50 117.51 121.38 2e1c h ILE 62 Ca 0.19 -1.08 0.06 0.00 1.00 0.00 0.00 64.86 65.03 2e1c h ILE 62 Cb 0.16 0.94 -0.05 0.00 -0.74 0.00 0.00 36.82 37.13 2e1c h ILE 62 CO -0.18 0.38 0.14 -0.09 0.00 0.00 0.00 178.15 178.40 2e1c h ARG 63 N 0.78 0.29 -0.57 2.37 2.43 -0.81 -0.02 114.38 118.85 2e1c h ARG 63 Ca 0.15 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.22 2e1c h ARG 63 Cb 0.52 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 2e1c h ARG 63 CO 0.03 0.19 0.04 0.87 -1.51 0.00 0.00 179.97 179.58 2e1c h LYS 64 N 0.30 0.95 -0.28 0.20 1.57 -0.93 -0.33 116.57 118.05 2e1c h LYS 64 Ca 0.20 -0.26 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 2e1c h LYS 64 Cb 0.21 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2e1c h LYS 64 CO -0.22 0.92 -0.06 -0.07 -0.57 0.00 0.00 179.45 179.45 2e1c h LEU 65 N 0.89 0.42 -0.09 2.94 3.38 -0.37 -1.32 115.31 121.16 2e1c h LEU 65 Ca 0.17 -0.09 -0.14 0.00 0.09 0.00 0.00 57.88 57.91 2e1c h LEU 65 Cb 0.47 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 41.12 2e1c h LEU 65 CO 0.02 0.53 -0.50 0.03 0.09 0.00 0.00 178.44 178.62 2e1c h ARG 66 N 0.42 0.50 -0.39 1.13 3.08 -0.60 -1.10 114.38 117.42 2e1c h ARG 66 Ca 0.09 -0.41 0.02 0.00 0.07 0.00 0.00 59.98 59.75 2e1c h ARG 66 Cb 0.38 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.49 2e1c h ARG 66 CO 0.02 1.05 0.21 0.93 -1.07 0.00 0.00 179.97 181.10 2e1c h GLU 67 N 0.08 0.42 0.00 0.04 5.08 -0.75 -2.15 114.58 117.29 2e1c h GLU 67 Ca -0.04 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2e1c h GLU 67 Cb 1.15 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.30 2e1c h GLU 67 CO 0.10 0.28 0.00 -1.13 -1.00 0.00 0.00 179.01 177.26 2e1c n SER 68 N -4.90 0.00 0.00 1.42 3.41 -0.52 -4.89 113.62 108.13 2e1c n SER 68 Ca 0.01 -0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.39 2e1c n SER 68 Cb 0.08 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 2e1c n SER 68 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2e1c n GLY 69 N 0.63 1.23 0.11 5.00 0.00 -0.81 -4.92 105.19 106.43 2e1c n GLY 69 Ca 0.13 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.07 2e1c n GLY 69 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2e1c h VAL 70 N 0.00 0.82 -3.54 1.61 2.07 -1.48 -3.26 116.25 112.46 2e1c h VAL 70 Ca 0.00 -0.01 -0.68 0.00 0.82 0.00 0.00 66.70 66.82 2e1c h VAL 70 Cb 0.00 0.77 -0.18 0.00 -1.52 0.00 0.00 31.29 30.37 2e1c h VAL 70 CO 0.00 0.01 -0.10 -0.63 0.02 0.00 0.00 177.57 176.86 2e1c s ILE 71 N -6.20 5.01 0.18 4.57 1.01 -0.75 -4.93 121.20 120.09 2e1c s ILE 71 Ca -0.13 -0.23 -0.08 0.00 0.00 0.00 0.00 60.65 60.21 2e1c s ILE 71 Cb 0.10 -4.10 -0.00 0.00 0.01 0.00 0.00 42.46 38.47 2e1c s ILE 71 CO 0.69 -0.49 1.55 0.11 0.00 0.00 0.00 174.94 176.80 2e1c h LYS 72 N 8.78 0.87 0.00 2.79 1.57 -1.88 -3.40 116.57 125.30 2e1c h LYS 72 Ca -0.26 -0.40 0.00 0.00 -1.87 0.00 0.00 60.65 58.12 2e1c h LYS 72 Cb 1.11 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.40 2e1c h LYS 72 CO 0.83 1.05 0.00 0.36 -0.57 0.00 0.00 179.45 181.12 2e1c n LYS 73 N -4.08 0.00 -4.29 3.15 2.85 -1.26 -5.06 118.16 109.47 2e1c n LYS 73 Ca -0.01 0.00 -0.35 0.00 -1.05 0.00 0.00 58.31 56.90 2e1c n LYS 73 Cb 0.49 0.00 -0.09 0.00 -0.65 0.00 0.00 35.03 34.78 2e1c n LYS 73 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 2e1c s PHE 74 N -2.00 3.23 0.10 5.58 0.40 -1.26 -5.11 117.98 118.93 2e1c s PHE 74 Ca 0.00 0.24 -0.21 0.00 -0.60 0.00 0.00 56.93 56.36 2e1c s PHE 74 Cb 0.00 -1.81 0.06 0.00 0.51 0.00 0.00 43.02 41.78 2e1c s PHE 74 CO 0.00 0.51 0.53 -0.08 0.70 0.00 0.00 175.22 176.88 2e1c s THR 75 N -0.92 0.03 -0.18 0.64 -1.32 -1.26 -5.13 115.64 107.49 2e1c s THR 75 Ca 0.14 -0.22 -0.14 0.00 -1.21 0.00 0.00 61.69 60.26 2e1c s THR 75 Cb -0.11 -1.03 -0.04 0.00 -1.51 0.00 0.00 72.50 69.80 2e1c s THR 75 CO 0.03 -0.12 0.32 0.00 -2.21 0.00 0.00 174.62 172.64 2e1c s ALA 76 N -3.22 3.58 -0.26 11.08 0.00 -1.26 -4.98 121.76 126.71 2e1c s ALA 76 Ca -0.01 -0.51 -0.22 0.00 0.00 0.00 0.00 51.96 51.22 2e1c s ALA 76 Cb -0.00 -2.47 -0.01 0.00 0.00 0.00 0.00 23.12 20.64 2e1c s ALA 76 CO -0.08 -0.06 0.72 0.42 0.00 0.00 0.00 175.76 176.76 2e1c s ILE 77 N 0.79 4.91 -0.12 0.00 -1.09 -1.26 -5.04 121.20 119.39 2e1c s ILE 77 Ca 0.17 1.29 -0.07 0.00 -2.23 0.00 0.00 60.65 59.81 2e1c s ILE 77 Cb -0.14 -4.03 -0.04 0.00 -1.58 0.00 0.00 42.46 36.68 2e1c s ILE 77 CO 0.05 -0.05 0.15 -0.63 -1.23 0.00 0.00 174.94 173.23 2e1c s ILE 78 N 2.68 5.50 -0.24 2.92 -1.09 -1.26 -5.06 121.20 124.66 2e1c s ILE 78 Ca 0.30 0.22 -0.29 0.00 -2.23 0.00 0.00 60.65 58.66 2e1c s ILE 78 Cb -0.15 -3.41 -0.02 0.00 -1.58 0.00 0.00 42.46 37.30 2e1c s ILE 78 CO 0.09 0.62 1.56 -0.62 -1.23 0.00 0.00 174.94 175.36 2e1c s ASP 79 N -1.03 6.42 0.18 3.58 2.15 -1.26 -4.92 116.67 121.78 2e1c s ASP 79 Ca 0.15 1.54 -0.20 0.00 0.43 0.00 0.00 52.55 54.47 2e1c s ASP 79 Cb -0.12 -2.53 0.10 0.00 -0.30 0.00 0.00 42.92 40.07 2e1c s ASP 79 CO 0.04 -1.23 1.61 -0.65 -0.17 0.00 0.00 175.17 174.77 2e1c h PRO 80 N 10.50 -0.17 -0.75 4.34 0.11 -1.97 -2.08 132.00 141.98 2e1c h PRO 80 Ca -0.32 0.01 0.11 0.00 0.11 0.00 0.00 66.00 65.91 2e1c h PRO 80 Cb 1.14 0.04 -0.05 0.00 0.11 0.00 0.00 31.00 32.24 2e1c h PRO 80 CO 1.01 -0.11 0.50 0.93 -0.21 0.00 0.00 178.00 180.11 2e1c h GLU 81 N -0.17 0.57 0.00 1.05 5.08 -1.92 0.15 114.58 119.34 2e1c h GLU 81 Ca 0.21 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 2e1c h GLU 81 Cb 0.50 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 2e1c h GLU 81 CO -0.56 0.38 -0.03 0.00 -1.00 0.00 0.00 179.01 177.80 2e1c h ALA 82 N 1.63 1.15 -0.66 3.43 0.00 -1.72 -1.02 119.26 122.06 2e1c h ALA 82 Ca 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2e1c h ALA 82 Cb 0.59 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2e1c h ALA 82 CO -0.13 0.04 0.00 1.28 0.00 0.00 0.00 179.25 180.44 2e1c n LEU 83 N -3.33 3.84 0.00 0.00 4.77 0.48 -4.94 117.00 117.82 2e1c n LEU 83 Ca -0.02 -1.91 0.00 0.00 -0.03 0.00 0.00 56.01 54.05 2e1c n LEU 83 Cb 0.15 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 2e1c n LEU 83 CO 0.25 0.94 0.00 0.61 -1.33 0.00 0.00 177.39 177.86 2e1c n GLY 84 N 1.58 1.09 3.54 -0.72 0.00 -0.39 -4.98 105.19 105.32 2e1c n GLY 84 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 2e1c n GLY 84 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2e1c s TYR 85 N -2.77 2.99 -1.99 1.61 1.51 -0.90 -4.36 117.35 113.42 2e1c s TYR 85 Ca 0.00 -1.70 0.29 0.00 -1.01 0.00 0.00 57.07 54.65 2e1c s TYR 85 Cb 0.00 -4.60 1.24 0.00 -0.11 0.00 0.00 41.96 38.49 2e1c s TYR 85 CO 0.00 -1.69 1.86 -1.13 -1.11 0.00 0.00 175.55 173.48 2e1c n SER 86 N 7.55 0.77 -4.21 2.29 3.41 -1.20 -3.61 113.62 118.62 2e1c n SER 86 Ca 0.43 -0.98 -0.32 0.00 -0.26 0.00 0.00 58.87 57.73 2e1c n SER 86 Cb 0.46 -0.01 -0.17 0.00 -0.26 0.00 0.00 64.21 64.23 2e1c n SER 86 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 2e1c s MET 87 N -2.24 3.05 -0.02 4.33 -2.45 -0.75 -5.00 119.30 116.23 2e1c s MET 87 Ca 0.35 -0.86 0.02 0.00 -1.25 0.00 0.00 55.69 53.94 2e1c s MET 87 Cb 0.21 -2.36 0.01 0.00 1.25 0.00 0.00 34.83 33.93 2e1c s MET 87 CO 0.42 0.12 -0.05 -1.17 1.05 0.00 0.00 175.02 175.38 2e1c s LEU 88 N 0.50 1.68 0.12 4.11 2.96 -1.26 -1.15 118.68 125.64 2e1c s LEU 88 Ca -0.15 -0.12 -0.19 0.00 -0.22 0.00 0.00 54.13 53.46 2e1c s LEU 88 Cb -0.17 -0.38 0.05 0.00 0.50 0.00 0.00 46.19 46.19 2e1c s LEU 88 CO 0.05 0.01 0.48 0.00 -1.32 0.00 0.00 176.35 175.57 2e1c s ALA 89 N 0.36 -1.19 -0.08 5.97 0.00 -0.23 -1.49 121.76 125.10 2e1c s ALA 89 Ca -0.04 0.22 0.01 0.00 0.00 0.00 0.00 51.96 52.14 2e1c s ALA 89 Cb -0.08 0.70 -0.03 0.00 0.00 0.00 0.00 23.12 23.71 2e1c s ALA 89 CO -0.00 -0.66 -0.09 -0.06 0.00 0.00 0.00 175.76 174.95 2e1c s PHE 90 N -3.55 2.86 -0.16 0.00 0.40 0.26 -0.93 117.98 116.86 2e1c s PHE 90 Ca 0.01 -0.14 0.01 0.00 -0.60 0.00 0.00 56.93 56.21 2e1c s PHE 90 Cb 0.01 -1.72 0.02 0.00 0.51 0.00 0.00 43.02 41.83 2e1c s PHE 90 CO -0.11 0.19 -0.15 0.42 0.70 0.00 0.00 175.22 176.28 2e1c s ILE 91 N -0.55 1.68 -0.04 0.64 1.01 0.65 -0.30 121.20 124.29 2e1c s ILE 91 Ca 0.08 -0.73 -0.19 0.00 0.00 0.00 0.00 60.65 59.81 2e1c s ILE 91 Cb -0.12 -1.58 -0.05 0.00 0.01 0.00 0.00 42.46 40.72 2e1c s ILE 91 CO 0.02 0.45 0.52 -0.76 0.00 0.00 0.00 174.94 175.17 2e1c s LEU 92 N 1.44 4.38 -0.07 2.97 1.43 0.03 -0.78 118.68 128.08 2e1c s LEU 92 Ca 0.04 1.01 0.03 0.00 -1.03 0.00 0.00 54.13 54.18 2e1c s LEU 92 Cb -0.13 -2.78 0.01 0.00 0.03 0.00 0.00 46.19 43.32 2e1c s LEU 92 CO -0.11 0.11 -0.15 -0.69 0.23 0.00 0.00 176.35 175.74 2e1c s VAL 93 N -0.10 1.35 -0.18 -1.59 1.01 0.52 -1.43 120.40 119.98 2e1c s VAL 93 Ca 0.28 -0.62 -0.18 0.00 0.00 0.00 0.00 61.98 61.47 2e1c s VAL 93 Cb -0.17 -1.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 2e1c s VAL 93 CO 0.14 0.40 0.47 -0.54 0.00 0.00 0.00 175.10 175.57 2e1c s LYS 94 N 0.49 4.22 -0.03 2.72 1.02 -0.05 -0.57 119.74 127.55 2e1c s LYS 94 Ca -0.13 0.36 0.05 0.00 0.02 0.00 0.00 55.97 56.26 2e1c s LYS 94 Cb -0.15 -3.52 -0.01 0.00 -0.52 0.00 0.00 37.83 33.63 2e1c s LYS 94 CO 0.04 -0.04 -0.16 0.08 -0.92 0.00 0.00 175.35 174.36 2e1c s VAL 95 N 1.28 1.31 0.24 3.17 1.01 -1.26 0.48 120.40 126.63 2e1c s VAL 95 Ca 0.23 -0.68 -0.30 0.00 0.00 0.00 0.00 61.98 61.23 2e1c s VAL 95 Cb -0.15 -1.11 -0.10 0.00 0.00 0.00 0.00 36.38 35.02 2e1c s VAL 95 CO 0.09 0.38 1.39 -0.75 0.00 0.00 0.00 175.10 176.21 2e1c s LYS 96 N -0.16 4.31 0.22 2.72 2.20 0.77 -4.91 119.74 124.89 2e1c s LYS 96 Ca 0.01 2.23 -0.30 0.00 -0.36 0.00 0.00 55.97 57.55 2e1c s LYS 96 Cb -0.09 -3.13 -0.15 0.00 -1.51 0.00 0.00 37.83 32.95 2e1c s LYS 96 CO 0.01 -0.36 0.97 0.00 -0.36 0.00 0.00 175.35 175.61 2e1c n ALA 97 N 2.29 -1.01 -0.34 3.13 0.00 -1.26 -1.68 120.51 121.64 2e1c n ALA 97 Ca 0.06 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.93 2e1c n ALA 97 Cb 0.41 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 17.92 2e1c n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2e1c n GLY 98 N 1.64 1.80 0.78 0.00 0.00 -1.26 -4.87 105.19 103.28 2e1c n GLY 98 Ca 0.13 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.24 2e1c n GLY 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2e1c n LYS 99 N -2.00 1.78 -0.06 1.61 4.76 -0.67 -4.65 118.16 118.92 2e1c n LYS 99 Ca 0.00 -1.75 -0.08 0.00 -2.87 0.00 0.00 58.31 53.61 2e1c n LYS 99 Cb 0.00 -1.36 -0.01 0.00 -1.84 0.00 0.00 35.03 31.82 2e1c n LYS 99 CO 0.00 0.00 0.00 1.88 -1.37 0.00 0.00 177.40 177.91 2e1c h TYR 100 N 3.37 -0.00 -0.64 2.13 -1.99 -1.90 -1.17 116.97 116.78 2e1c h TYR 100 Ca 0.00 0.02 0.01 0.00 2.00 0.00 0.00 58.73 60.76 2e1c h TYR 100 Cb 0.76 0.04 -0.04 0.00 2.00 0.00 0.00 36.73 39.50 2e1c h TYR 100 CO 0.09 -0.03 0.41 0.77 -0.00 0.00 0.00 178.16 179.40 2e1c h SER 101 N 0.08 0.70 -0.21 3.88 0.02 -1.98 0.17 113.55 116.21 2e1c h SER 101 Ca 0.12 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.05 2e1c h SER 101 Cb 0.15 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 2e1c h SER 101 CO -0.20 0.50 0.08 -0.08 -1.14 0.00 0.00 176.83 175.99 2e1c h GLU 102 N 0.83 0.32 -0.19 3.45 4.57 -1.80 -0.57 114.58 121.19 2e1c h GLU 102 Ca 0.24 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.35 2e1c h GLU 102 Cb -0.05 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.48 2e1c h GLU 102 CO -0.07 0.38 0.06 0.28 -1.18 0.00 0.00 179.01 178.48 2e1c h VAL 103 N 0.19 1.18 -0.03 0.32 2.07 -0.95 -1.56 116.25 117.47 2e1c h VAL 103 Ca 0.07 -0.57 0.02 0.00 0.82 0.00 0.00 66.70 67.03 2e1c h VAL 103 Cb 0.18 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 2e1c h VAL 103 CO -0.01 0.18 -0.08 0.00 0.02 0.00 0.00 177.57 177.68 2e1c h ALA 104 N 0.88 -0.07 -1.00 1.67 0.00 -0.61 -0.99 119.26 119.15 2e1c h ALA 104 Ca 0.06 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.08 2e1c h ALA 104 Cb 0.22 0.16 -0.08 0.00 0.00 0.00 0.00 17.79 18.09 2e1c h ALA 104 CO -0.00 -0.57 0.64 1.03 0.00 0.00 0.00 179.25 180.35 2e1c h SER 105 N -0.13 0.98 -0.62 0.00 0.87 -1.04 0.46 113.55 114.07 2e1c h SER 105 Ca 0.04 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.62 2e1c h SER 105 Cb 0.19 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.94 2e1c h SER 105 CO -0.11 0.58 0.35 -1.13 -0.53 0.00 0.00 176.83 175.99 2e1c h ASN 106 N 1.09 0.76 0.05 6.23 -0.73 -0.50 -3.26 115.58 119.22 2e1c h ASN 106 Ca 0.46 -0.08 -0.07 0.00 1.87 0.00 0.00 56.30 58.48 2e1c h ASN 106 Cb 0.32 -0.19 0.01 0.00 0.27 0.00 0.00 38.32 38.72 2e1c h ASN 106 CO -0.22 0.62 -0.30 -0.07 -0.37 0.00 0.00 177.43 177.09 2e1c h LEU 107 N 0.84 0.15 -1.43 0.34 3.38 -0.19 -3.35 115.31 115.05 2e1c h LEU 107 Ca 0.22 -0.97 0.24 0.00 0.09 0.00 0.00 57.88 57.46 2e1c h LEU 107 Cb 0.02 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2e1c h LEU 107 CO -0.04 1.14 0.93 0.00 0.09 0.00 0.00 178.44 180.57 2e1c h ALA 108 N 0.01 2.67 0.00 1.53 0.00 -0.18 -0.27 119.26 123.02 2e1c h ALA 108 Ca -0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2e1c h ALA 108 Cb 1.22 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2e1c h ALA 108 CO 0.04 -1.36 0.00 0.36 0.00 0.00 0.00 179.25 178.30 2e1c n LYS 109 N -3.43 0.11 -3.61 0.00 2.85 -1.23 -4.71 118.16 108.14 2e1c n LYS 109 Ca 0.18 0.07 -0.36 0.00 -1.05 0.00 0.00 58.31 57.15 2e1c n LYS 109 Cb 1.20 -1.50 -0.08 0.00 -0.65 0.00 0.00 35.03 34.00 2e1c n LYS 109 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2e1c s TYR 110 N -2.87 3.41 0.43 5.58 1.51 -0.11 -4.98 117.35 120.31 2e1c s TYR 110 Ca 0.15 0.44 0.20 0.00 -1.01 0.00 0.00 57.07 56.85 2e1c s TYR 110 Cb 0.16 -2.29 1.18 0.00 -0.11 0.00 0.00 41.96 40.90 2e1c s TYR 110 CO 0.42 0.20 2.01 -1.00 -1.11 0.00 0.00 175.55 176.07 2e1c h PRO 111 N 6.91 0.00 0.00 -1.71 0.13 -1.88 -2.25 132.00 133.20 2e1c h PRO 111 Ca -0.40 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.70 2e1c h PRO 111 Cb 1.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 2e1c h PRO 111 CO 0.74 0.17 -0.15 0.93 -0.23 0.00 0.00 178.00 179.46 2e1c h GLU 112 N 0.00 0.00 -5.41 0.86 3.07 -1.94 -3.36 114.58 107.79 2e1c h GLU 112 Ca -0.00 0.00 -0.64 0.00 -0.50 0.00 0.00 59.36 58.22 2e1c h GLU 112 Cb 0.36 0.00 -0.15 0.00 -0.84 0.00 0.00 28.75 28.12 2e1c h GLU 112 CO 0.02 0.15 0.47 0.42 -1.40 0.00 0.00 179.01 178.67 2e1c s ILE 113 N -4.41 4.43 -0.25 3.13 1.01 -0.85 -1.06 121.20 123.20 2e1c s ILE 113 Ca -0.03 -0.31 0.22 0.00 0.00 0.00 0.00 60.65 60.53 2e1c s ILE 113 Cb 0.14 -4.61 0.02 0.00 0.01 0.00 0.00 42.46 38.03 2e1c s ILE 113 CO 0.64 -1.31 1.08 -0.37 0.00 0.00 0.00 174.94 174.98 2e1c h VAL 114 N 5.97 0.01 -3.36 2.92 -1.51 -1.44 -3.45 116.25 115.39 2e1c h VAL 114 Ca -0.28 -1.02 -0.21 0.00 -1.23 0.00 0.00 66.70 63.96 2e1c h VAL 114 Cb 1.07 1.55 -0.28 0.00 -2.13 0.00 0.00 31.29 31.50 2e1c h VAL 114 CO 1.14 0.01 -0.57 -1.61 -1.23 0.00 0.00 177.57 175.31 2e1c s GLU 115 N -3.34 0.14 -0.08 5.19 2.02 -1.12 -4.98 118.70 116.53 2e1c s GLU 115 Ca -0.00 0.24 -0.03 0.00 0.02 0.00 0.00 54.97 55.21 2e1c s GLU 115 Cb 0.09 0.00 0.04 0.00 0.10 0.00 0.00 34.13 34.36 2e1c s GLU 115 CO 0.78 -0.06 0.06 0.08 0.02 0.00 0.00 175.26 176.14 2e1c s VAL 116 N 0.39 -0.03 0.06 2.63 1.01 -1.26 -1.33 120.40 121.87 2e1c s VAL 116 Ca -0.03 0.22 0.07 0.00 0.00 0.00 0.00 61.98 62.25 2e1c s VAL 116 Cb -0.04 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 35.99 2e1c s VAL 116 CO -0.02 0.07 -0.19 -0.31 0.00 0.00 0.00 175.10 174.65 2e1c s TYR 117 N 2.13 1.65 -0.23 5.22 1.51 -0.31 -4.99 117.35 122.32 2e1c s TYR 117 Ca 0.04 -0.38 -0.10 0.00 -1.01 0.00 0.00 57.07 55.62 2e1c s TYR 117 Cb -0.13 -0.96 -0.05 0.00 -0.11 0.00 0.00 41.96 40.71 2e1c s TYR 117 CO -0.05 0.10 0.15 -2.00 -1.11 0.00 0.00 175.55 172.64 2e1c s GLU 118 N -1.35 4.05 0.24 -0.62 2.12 -1.26 -1.10 118.70 120.78 2e1c s GLU 118 Ca 0.05 -0.28 0.01 0.00 0.36 0.00 0.00 54.97 55.11 2e1c s GLU 118 Cb -0.09 -3.50 -0.05 0.00 0.26 0.00 0.00 34.13 30.76 2e1c s GLU 118 CO 0.02 0.08 0.12 0.95 -0.54 0.00 0.00 175.26 175.89 2e1c s THR 119 N 1.00 0.31 0.77 -1.70 -4.23 0.25 -4.98 115.64 107.07 2e1c s THR 119 Ca 0.07 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.53 2e1c s THR 119 Cb -0.13 -2.57 0.13 0.00 1.34 0.00 0.00 72.50 71.26 2e1c s THR 119 CO 0.04 0.00 1.07 0.42 -0.54 0.00 0.00 174.62 175.61 2e1c s THR 120 N -3.90 2.15 0.00 3.99 -4.23 -1.26 -4.46 115.64 107.92 2e1c s THR 120 Ca 0.38 -0.40 0.00 0.00 -1.18 0.00 0.00 61.69 60.49 2e1c s THR 120 Cb 0.07 -2.75 0.00 0.00 1.34 0.00 0.00 72.50 71.17 2e1c s THR 120 CO 0.13 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.82 2e1c n GLY 121 N -3.05 -1.55 0.24 3.99 0.00 -1.26 -4.61 105.19 98.95 2e1c n GLY 121 Ca 0.14 -2.17 0.08 0.00 0.00 0.00 0.00 46.02 44.06 2e1c n GLY 121 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2e1c h ASP 122 N 0.00 0.00 -2.12 1.61 3.32 -2.01 -3.42 116.42 113.79 2e1c h ASP 122 Ca 0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 2e1c h ASP 122 Cb 0.00 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.46 2e1c h ASP 122 CO 0.00 0.12 -0.62 -0.31 -1.72 0.00 0.00 179.24 176.71 2e1c s TYR 123 N -4.64 2.69 -0.04 4.55 1.51 -1.26 -4.93 117.35 115.23 2e1c s TYR 123 Ca -0.04 -0.27 0.19 0.00 -1.01 0.00 0.00 57.07 55.95 2e1c s TYR 123 Cb 0.15 -1.30 -0.30 0.00 -0.11 0.00 0.00 41.96 40.41 2e1c s TYR 123 CO 0.66 0.56 0.41 -0.25 -1.11 0.00 0.00 175.55 175.82 2e1c n ASP 124 N -0.95 0.56 -3.94 2.29 8.00 0.27 -4.52 116.55 118.26 2e1c n ASP 124 Ca -0.06 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.34 2e1c n ASP 124 Cb 0.60 1.83 -0.11 0.00 -0.02 0.00 0.00 41.12 43.41 2e1c n ASP 124 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2e1c s MET 125 N -3.30 0.27 -0.11 -1.24 -1.94 -0.40 -0.58 119.30 112.00 2e1c s MET 125 Ca -0.07 -0.45 0.03 0.00 -1.71 0.00 0.00 55.69 53.49 2e1c s MET 125 Cb 0.12 0.10 0.01 0.00 2.01 0.00 0.00 34.83 37.07 2e1c s MET 125 CO 0.80 -0.05 -0.20 0.08 -0.01 0.00 0.00 175.02 175.64 2e1c s VAL 126 N -1.13 1.85 -0.12 -6.03 1.01 -0.25 -0.35 120.40 115.37 2e1c s VAL 126 Ca -0.12 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.01 2e1c s VAL 126 Cb -0.08 -1.63 0.01 0.00 0.00 0.00 0.00 36.38 34.68 2e1c s VAL 126 CO -0.00 0.51 -0.21 -0.69 0.00 0.00 0.00 175.10 174.70 2e1c s VAL 127 N 0.65 1.93 -0.23 2.92 1.01 0.04 -1.16 120.40 125.56 2e1c s VAL 127 Ca -0.12 -0.92 -0.09 0.00 0.00 0.00 0.00 61.98 60.85 2e1c s VAL 127 Cb -0.16 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 2e1c s VAL 127 CO 0.03 0.53 0.12 -0.75 0.00 0.00 0.00 175.10 175.02 2e1c s LYS 128 N 0.64 3.95 0.02 2.72 2.20 -0.44 -0.25 119.74 128.57 2e1c s LYS 128 Ca -0.12 -0.34 0.04 0.00 -0.36 0.00 0.00 55.97 55.19 2e1c s LYS 128 Cb -0.16 -3.41 -0.01 0.00 -1.51 0.00 0.00 37.83 32.73 2e1c s LYS 128 CO 0.03 0.05 -0.12 -1.50 -0.36 0.00 0.00 175.35 173.45 2e1c s ILE 129 N 1.04 0.91 -0.08 5.43 2.07 -0.11 -1.52 121.20 128.94 2e1c s ILE 129 Ca 0.06 -0.73 0.04 0.00 -1.41 0.00 0.00 60.65 58.62 2e1c s ILE 129 Cb -0.14 -0.81 -0.00 0.00 0.13 0.00 0.00 42.46 41.64 2e1c s ILE 129 CO 0.04 0.08 -0.22 -0.13 -1.91 0.00 0.00 174.94 172.80 2e1c s ARG 130 N -0.73 2.55 0.14 3.50 0.52 -0.23 -1.07 118.95 123.64 2e1c s ARG 130 Ca 0.02 -0.79 -0.00 0.00 -0.52 0.00 0.00 55.73 54.44 2e1c s ARG 130 Cb -0.06 -2.03 -0.04 0.00 0.52 0.00 0.00 34.95 33.33 2e1c s ARG 130 CO 0.00 0.22 0.05 0.95 0.02 0.00 0.00 175.30 176.54 2e1c s THR 131 N 0.20 0.23 0.02 0.02 -4.23 -0.30 -4.62 115.64 106.96 2e1c s THR 131 Ca -0.12 -1.93 0.17 0.00 -1.18 0.00 0.00 61.69 58.64 2e1c s THR 131 Cb -0.16 -2.07 0.11 0.00 1.34 0.00 0.00 72.50 71.72 2e1c s THR 131 CO 0.06 -0.46 1.61 0.11 -0.54 0.00 0.00 174.62 175.40 2e1c h LYS 132 N 2.82 0.00 -3.14 3.99 1.57 -1.86 -1.97 116.57 117.98 2e1c h LYS 132 Ca -0.35 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.40 2e1c h LYS 132 Cb 1.20 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.49 2e1c h LYS 132 CO 0.60 0.43 0.20 0.54 -0.57 0.00 0.00 179.45 180.65 2e1c s ASN 133 N -6.43 0.04 0.36 0.86 2.20 -1.26 -4.13 114.94 106.58 2e1c s ASN 133 Ca 0.02 -1.06 0.17 0.00 -0.94 0.00 0.00 52.86 51.05 2e1c s ASN 133 Cb 0.09 0.80 0.65 0.00 -2.00 0.00 0.00 41.25 40.79 2e1c s ASN 133 CO 0.71 -1.56 1.73 0.77 -2.94 0.00 0.00 177.10 175.81 2e1c h SER 134 N 2.02 0.00 -0.42 3.54 4.64 -1.98 -2.62 113.55 118.73 2e1c h SER 134 Ca -0.29 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.00 2e1c h SER 134 Cb 1.25 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 2e1c h SER 134 CO 0.36 0.41 0.12 -0.08 -0.87 0.00 0.00 176.83 176.78 2e1c h GLU 135 N 0.00 0.66 -0.58 4.77 4.81 -1.99 0.19 114.58 122.44 2e1c h GLU 135 Ca -0.00 -0.15 -0.06 0.00 -0.13 0.00 0.00 59.36 59.02 2e1c h GLU 135 Cb 0.90 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.16 2e1c h GLU 135 CO 0.05 0.65 0.13 1.49 -0.73 0.00 0.00 179.01 180.61 2e1c h GLU 136 N 0.54 0.93 -0.82 1.92 4.81 -1.95 -1.59 114.58 118.42 2e1c h GLU 136 Ca 0.13 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 2e1c h GLU 136 Cb 0.28 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 2e1c h GLU 136 CO -0.00 0.87 0.52 1.25 -0.73 0.00 0.00 179.01 180.92 2e1c h LEU 137 N 0.84 0.97 -1.13 1.64 5.85 -1.07 -1.81 115.31 120.59 2e1c h LEU 137 Ca 0.18 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.78 2e1c h LEU 137 Cb 0.37 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 2e1c h LEU 137 CO 0.00 0.73 -0.11 0.78 -0.34 0.00 0.00 178.44 179.50 2e1c h ASN 138 N 1.12 0.45 -0.59 1.25 2.35 -0.25 -0.88 115.58 119.03 2e1c h ASN 138 Ca 0.30 -0.11 -0.04 0.00 -0.55 0.00 0.00 56.30 55.89 2e1c h ASN 138 Cb -0.08 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.14 2e1c h ASN 138 CO -0.06 0.61 0.21 0.78 -1.65 0.00 0.00 177.43 177.31 2e1c h ASN 139 N 0.44 0.85 -0.33 5.81 2.35 -0.50 -0.62 115.58 123.59 2e1c h ASN 139 Ca 0.08 -0.19 -0.07 0.00 -0.55 0.00 0.00 56.30 55.57 2e1c h ASN 139 Cb 0.47 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.60 2e1c h ASN 139 CO 0.03 0.81 -0.03 -0.26 -1.65 0.00 0.00 177.43 176.33 2e1c h PHE 140 N 0.83 0.75 -0.59 1.19 -1.00 -0.84 -0.40 116.94 116.88 2e1c h PHE 140 Ca 0.19 -0.10 -0.07 0.00 2.81 0.00 0.00 57.97 60.81 2e1c h PHE 140 Cb 0.25 -0.20 -0.02 0.00 3.61 0.00 0.00 35.95 39.59 2e1c h PHE 140 CO 0.02 0.72 0.11 -0.07 -1.61 0.00 0.00 178.31 177.48 2e1c h LEU 141 N 0.66 0.92 -0.76 1.54 3.38 -0.71 0.82 115.31 121.16 2e1c h LEU 141 Ca 0.13 -0.25 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 2e1c h LEU 141 Cb 0.45 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2e1c h LEU 141 CO 0.02 0.94 0.25 0.44 0.09 0.00 0.00 178.44 180.17 2e1c h ASP 142 N 0.87 1.09 0.38 -0.43 3.32 -0.74 -1.48 116.42 119.43 2e1c h ASP 142 Ca 0.18 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 2e1c h ASP 142 Cb 0.39 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 39.66 2e1c h ASP 142 CO 0.01 1.01 -0.18 0.25 -1.72 0.00 0.00 179.24 178.60 2e1c h LEU 143 N 1.12 -0.43 -0.46 1.55 5.85 -0.60 -2.35 115.31 120.01 2e1c h LEU 143 Ca 0.25 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.95 2e1c h LEU 143 Cb 0.30 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.39 2e1c h LEU 143 CO -0.01 -0.19 0.16 0.40 -0.34 0.00 0.00 178.44 178.47 2e1c h ILE 144 N -0.65 0.86 0.00 4.05 2.04 -0.76 -1.07 117.51 121.97 2e1c h ILE 144 Ca -0.05 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.69 2e1c h ILE 144 Cb 0.47 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.04 2e1c h ILE 144 CO 0.08 0.06 0.00 1.23 0.00 0.00 0.00 178.15 179.53 2e1c h GLY 145 N 0.34 0.00 0.95 5.37 0.00 -1.26 -2.65 103.07 105.82 2e1c h GLY 145 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 2e1c h GLY 145 CO -0.22 0.00 -0.53 -1.14 0.00 0.00 0.00 176.54 174.65 2e1c n SER 146 N -2.94 0.53 -4.72 0.19 3.41 -0.44 -4.88 113.62 104.77 2e1c n SER 146 Ca -0.00 -0.28 -0.42 0.00 -0.26 0.00 0.00 58.87 57.91 2e1c n SER 146 Cb 0.21 0.29 -0.03 0.00 -0.26 0.00 0.00 64.21 64.42 2e1c n SER 146 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2e1c s ILE 147 N -3.00 3.24 0.03 -1.33 1.01 -1.00 -4.93 121.20 115.21 2e1c s ILE 147 Ca 0.11 0.94 -0.31 0.00 0.00 0.00 0.00 60.65 61.39 2e1c s ILE 147 Cb 0.17 -3.60 -0.09 0.00 0.01 0.00 0.00 42.46 38.95 2e1c s ILE 147 CO 0.71 0.10 1.96 -2.65 0.00 0.00 0.00 174.94 175.06 2e1c n PRO 148 N 3.39 2.79 0.00 2.79 -0.02 -1.26 -1.43 135.00 141.26 2e1c n PRO 148 Ca 0.09 1.02 0.00 0.00 -2.02 0.00 0.00 63.50 62.60 2e1c n PRO 148 Cb 0.42 -2.97 0.00 0.00 -0.02 0.00 0.00 33.50 30.94 2e1c n PRO 148 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2e1c n GLY 149 N 4.52 2.05 3.67 -1.23 0.00 -1.26 -4.85 105.19 108.09 2e1c n GLY 149 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 2e1c n GLY 149 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2e1c s VAL 150 N -2.00 4.82 -2.27 1.61 1.01 -0.51 -0.16 120.40 122.89 2e1c s VAL 150 Ca 0.00 1.76 0.22 0.00 0.00 0.00 0.00 61.98 63.95 2e1c s VAL 150 Cb 0.00 -4.19 0.06 0.00 0.00 0.00 0.00 36.38 32.25 2e1c s VAL 150 CO 0.00 -0.03 1.11 -0.62 0.00 0.00 0.00 175.10 175.55 2e1c n GLU 151 N 5.54 1.63 0.00 2.72 1.02 0.18 -4.88 120.64 126.85 2e1c n GLU 151 Ca 0.07 -1.30 0.00 0.00 -0.02 0.00 0.00 57.16 55.90 2e1c n GLU 151 Cb 0.48 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 2e1c n GLU 151 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2e1c n GLY 152 N 1.33 2.68 3.17 0.62 0.00 -1.21 -4.91 105.19 106.87 2e1c n GLY 152 Ca 0.10 -0.90 -0.08 0.00 0.00 0.00 0.00 46.02 45.14 2e1c n GLY 152 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2e1c s THR 153 N -2.00 0.16 -0.05 2.61 -4.23 -1.26 -0.87 115.64 110.00 2e1c s THR 153 Ca 0.00 -1.47 -0.02 0.00 -1.18 0.00 0.00 61.69 59.02 2e1c s THR 153 Cb 0.00 -1.51 0.03 0.00 1.34 0.00 0.00 72.50 72.37 2e1c s THR 153 CO 0.00 -0.72 0.08 -2.28 -0.54 0.00 0.00 174.62 171.16 2e1c s HIS 154 N -3.91 -0.02 -0.10 3.99 5.04 -0.51 -4.97 115.29 114.81 2e1c s HIS 154 Ca 0.08 0.31 -0.12 0.00 -1.54 0.00 0.00 55.06 53.80 2e1c s HIS 154 Cb 0.06 -0.33 -0.05 0.00 0.04 0.00 0.00 32.58 32.31 2e1c s HIS 154 CO -0.09 -0.17 0.26 0.99 -2.34 0.00 0.00 174.74 173.40 2e1c s THR 155 N 1.76 5.30 -0.33 0.89 2.01 -1.26 -0.79 115.64 123.22 2e1c s THR 155 Ca -0.01 0.50 0.01 0.00 0.31 0.00 0.00 61.69 62.49 2e1c s THR 155 Cb -0.12 -3.57 0.10 0.00 0.01 0.00 0.00 72.50 68.92 2e1c s THR 155 CO -0.04 0.53 0.10 -0.04 -0.69 0.00 0.00 174.62 174.48 2e1c s MET 156 N -0.49 0.95 0.01 4.92 -1.94 0.59 -5.00 119.30 118.33 2e1c s MET 156 Ca 0.18 -1.36 -0.28 0.00 -1.71 0.00 0.00 55.69 52.51 2e1c s MET 156 Cb -0.14 -2.30 -0.04 0.00 2.01 0.00 0.00 34.83 34.36 2e1c s MET 156 CO 0.06 -0.99 0.91 0.42 -0.01 0.00 0.00 175.02 175.41 2e1c s ILE 157 N 1.32 4.84 -0.15 2.53 1.01 -1.26 -0.58 121.20 128.91 2e1c s ILE 157 Ca 0.11 1.92 -0.29 0.00 0.00 0.00 0.00 60.65 62.39 2e1c s ILE 157 Cb -0.18 -4.26 -0.02 0.00 0.01 0.00 0.00 42.46 38.01 2e1c s ILE 157 CO -0.19 0.21 1.24 -0.69 0.00 0.00 0.00 174.94 175.52 2e1c s VAL 158 N 0.74 4.29 -0.09 2.92 1.01 -0.56 -4.90 120.40 123.82 2e1c s VAL 158 Ca 0.48 1.57 0.09 0.00 0.00 0.00 0.00 61.98 64.12 2e1c s VAL 158 Cb -0.21 -4.01 -0.24 0.00 0.00 0.00 0.00 36.38 31.92 2e1c s VAL 158 CO 0.26 -0.11 0.49 0.18 0.00 0.00 0.00 175.10 175.92 2e1c n LEU 159 N 6.34 1.15 -3.68 3.92 4.77 -1.26 -4.74 117.00 123.50 2e1c n LEU 159 Ca 0.13 0.30 -0.14 0.00 -0.03 0.00 0.00 56.01 56.27 2e1c n LEU 159 Cb 0.45 -0.06 -0.08 0.00 -2.33 0.00 0.00 43.42 41.40 2e1c n LEU 159 CO 0.56 0.51 0.26 -0.75 -1.33 0.00 0.00 177.39 176.63 2e1c s LYS 160 N -2.57 0.68 -0.35 3.23 2.20 -1.26 -5.13 119.74 116.53 2e1c s LYS 160 Ca -0.10 0.75 -0.12 0.00 -0.36 0.00 0.00 55.97 56.14 2e1c s LYS 160 Cb 0.07 0.33 -0.00 0.00 -1.51 0.00 0.00 37.83 36.72 2e1c s LYS 160 CO 0.81 -0.09 0.22 0.99 -0.36 0.00 0.00 175.35 176.92 2e1c s THR 161 N 0.21 5.00 -0.16 3.43 2.01 -1.26 -4.94 115.64 119.94 2e1c s THR 161 Ca -0.01 -0.43 0.19 0.00 0.31 0.00 0.00 61.69 61.74 2e1c s THR 161 Cb -0.04 -3.63 -0.09 0.00 0.01 0.00 0.00 72.50 68.75 2e1c s THR 161 CO 0.01 -0.07 0.89 1.41 -0.69 0.00 0.00 174.62 176.17 2e1c n HIS 162 N 5.07 0.98 -3.63 4.92 -0.00 -1.26 -4.94 115.22 116.36 2e1c n HIS 162 Ca -0.13 0.31 -0.12 0.00 -0.00 0.00 0.00 57.72 57.79 2e1c n HIS 162 Cb 0.49 -1.05 -0.07 0.00 -0.00 0.00 0.00 29.99 29.36 2e1c n HIS 162 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.34 176.55 2e1c s LYS 163 N -3.06 0.69 -0.30 -0.41 2.20 -1.26 -5.14 119.74 112.46 2e1c s LYS 163 Ca -0.02 0.79 -0.02 0.00 -0.36 0.00 0.00 55.97 56.36 2e1c s LYS 163 Cb 0.09 0.34 0.19 0.00 -1.51 0.00 0.00 37.83 36.94 2e1c s LYS 163 CO 0.80 -0.09 0.66 -2.00 -0.36 0.00 0.00 175.35 174.36 2e1c s GLU 164 N 0.24 0.52 0.05 4.03 2.12 -1.26 -5.17 118.70 119.23 2e1c s GLU 164 Ca 0.01 0.86 -0.00 0.00 0.36 0.00 0.00 54.97 56.20 2e1c s GLU 164 Cb -0.05 0.47 -0.04 0.00 0.26 0.00 0.00 34.13 34.77 2e1c s GLU 164 CO -0.02 -0.63 -0.04 -0.08 -0.54 0.00 0.00 175.26 173.96 2e1c s THR 165 N 2.87 0.28 -0.70 -1.70 -1.32 -1.26 -5.03 115.64 108.78 2e1c s THR 165 Ca 0.17 -1.71 0.14 0.00 -1.21 0.00 0.00 61.69 59.08 2e1c s THR 165 Cb -0.14 -1.38 -0.14 0.00 -1.51 0.00 0.00 72.50 69.33 2e1c s THR 165 CO -0.21 -0.92 0.61 0.35 -2.21 0.00 0.00 174.62 172.24 2e1c n THR 166 N 0.28 0.00 -2.43 5.08 -2.24 -1.26 -4.98 114.28 108.73 2e1c n THR 166 Ca -0.15 -0.18 -0.42 0.00 -2.27 0.00 0.00 64.05 61.03 2e1c n THR 166 Cb 0.60 1.01 -0.03 0.00 -2.10 0.00 0.00 70.33 69.81 2e1c n THR 166 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2e1c s GLU 167 N -2.29 4.46 0.01 -0.78 2.02 -1.26 -5.03 118.70 115.84 2e1c s GLU 167 Ca 0.06 1.78 -0.06 0.00 0.02 0.00 0.00 54.97 56.77 2e1c s GLU 167 Cb 0.11 -3.32 -0.05 0.00 0.10 0.00 0.00 34.13 30.97 2e1c s GLU 167 CO 0.56 -0.19 0.26 -0.51 0.02 0.00 0.00 175.26 175.41 2e1c s LEU 168 N 0.66 4.36 0.35 1.80 1.43 -1.26 -5.07 118.68 120.96 2e1c s LEU 168 Ca 0.57 0.52 -0.28 0.00 -1.03 0.00 0.00 54.13 53.91 2e1c s LEU 168 Cb -0.30 -2.70 -0.09 0.00 0.03 0.00 0.00 46.19 43.12 2e1c s LEU 168 CO 0.31 0.24 1.21 -2.16 0.23 0.00 0.00 176.35 176.19 2e1c s PRO 169 N -1.85 4.29 0.00 1.29 0.04 -1.26 -5.05 135.00 132.46 2e1c s PRO 169 Ca 0.28 1.99 0.00 0.00 0.04 0.00 0.00 61.00 63.32 2e1c s PRO 169 Cb -0.13 -2.95 0.00 0.00 0.04 0.00 0.00 34.50 31.46 2e1c s PRO 169 CO 0.17 -0.16 0.16 -0.89 0.04 0.00 0.00 177.00 176.32