#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1scf h VAL 12 N 0.00 1.08 0.00 3.53 3.04 -2.06 -3.08 116.25 118.77 1scf h VAL 12 Ca 0.00 -1.94 -0.10 0.00 -1.01 0.00 0.00 66.70 63.66 1scf h VAL 12 Cb 0.00 2.14 -0.01 0.00 -2.01 0.00 0.00 31.29 31.40 1scf h VAL 12 CO 0.00 0.50 -0.46 0.11 -1.01 0.00 0.00 177.57 176.70 1scf h LYS 13 N 0.00 0.00 0.00 4.17 6.56 -2.06 -3.22 116.57 122.03 1scf h LYS 13 Ca -0.01 0.00 -0.24 0.00 -1.06 0.00 0.00 60.65 59.34 1scf h LYS 13 Cb 1.10 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.77 1scf h LYS 13 CO 0.07 0.46 -0.98 -0.44 -2.06 0.00 0.00 179.45 176.50 1scf h ASP 14 N 0.00 0.66 -0.84 0.86 5.19 -1.98 -2.78 116.42 117.53 1scf h ASP 14 Ca -0.00 -0.53 -0.02 0.00 -0.62 0.00 0.00 57.03 55.86 1scf h ASP 14 Cb 0.98 -0.20 -0.04 0.00 0.18 0.00 0.00 39.33 40.24 1scf h ASP 14 CO 0.06 1.33 0.45 0.58 -3.12 0.00 0.00 179.24 178.54 1scf h VAL 15 N 0.28 1.25 -0.39 -1.35 2.07 -1.62 -1.35 116.25 115.14 1scf h VAL 15 Ca -0.10 -0.63 0.05 0.00 0.82 0.00 0.00 66.70 66.84 1scf h VAL 15 Cb 1.63 0.13 -0.05 0.00 -1.52 0.00 0.00 31.29 31.48 1scf h VAL 15 CO 0.18 0.28 0.11 0.74 0.02 0.00 0.00 177.57 178.90 1scf h THR 16 N 1.18 0.85 -0.29 2.57 2.02 -1.58 0.24 112.91 117.91 1scf h THR 16 Ca 0.29 -0.09 -0.11 0.00 0.77 0.00 0.00 66.41 67.27 1scf h THR 16 Cb 0.04 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 1scf h THR 16 CO -0.05 0.05 -0.29 0.50 0.37 0.00 0.00 175.52 176.10 1scf h LYS 17 N 0.26 0.59 -0.10 6.66 3.64 -1.42 -0.81 116.57 125.38 1scf h LYS 17 Ca 0.18 -0.25 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1scf h LYS 17 Cb 0.18 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1scf h LYS 17 CO -0.21 0.81 0.02 1.25 -2.27 0.00 0.00 179.45 179.06 1scf h LEU 18 N 0.51 0.15 -0.93 5.20 5.85 -0.90 -1.68 115.31 123.50 1scf h LEU 18 Ca 0.06 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.57 1scf h LEU 18 Cb 0.76 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.70 1scf h LEU 18 CO 0.06 0.33 0.61 0.58 -0.34 0.00 0.00 178.44 179.69 1scf h VAL 19 N -0.05 1.24 0.00 1.05 2.07 -0.43 -1.83 116.25 118.30 1scf h VAL 19 Ca 0.03 -0.44 -0.03 0.00 0.82 0.00 0.00 66.70 67.08 1scf h VAL 19 Cb 0.24 -0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 29.88 1scf h VAL 19 CO 0.00 0.23 -0.12 0.00 0.02 0.00 0.00 177.57 177.70 1scf h ALA 20 N 1.34 1.12 -0.51 1.67 0.00 -1.02 -2.35 119.26 119.51 1scf h ALA 20 Ca 0.34 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1scf h ALA 20 Cb -0.14 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1scf h ALA 20 CO -0.07 0.15 0.00 0.09 0.00 0.00 0.00 179.25 179.42 1scf n ASN 21 N -3.40 3.79 -4.88 0.00 3.02 -0.64 -4.94 115.26 108.20 1scf n ASN 21 Ca -0.01 -2.25 -0.36 0.00 -0.03 0.00 0.00 54.58 51.93 1scf n ASN 21 Cb 0.30 -0.42 -0.06 0.00 -0.61 0.00 0.00 39.78 38.99 1scf n ASN 21 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1scf s LEU 22 N -1.46 4.39 0.22 3.41 1.43 -0.76 -5.03 118.68 120.88 1scf s LEU 22 Ca 0.39 0.48 -0.32 0.00 -1.03 0.00 0.00 54.13 53.65 1scf s LEU 22 Cb 0.24 -2.24 -0.13 0.00 0.03 0.00 0.00 46.19 44.09 1scf s LEU 22 CO 0.21 0.37 1.60 -2.65 0.23 0.00 0.00 176.35 176.11 1scf n PRO 23 N 1.71 2.45 0.30 1.29 -0.02 -1.26 -4.89 135.00 134.58 1scf n PRO 23 Ca -0.17 0.88 0.18 0.00 -2.02 0.00 0.00 63.50 62.36 1scf n PRO 23 Cb 0.54 -2.66 0.98 0.00 -0.02 0.00 0.00 33.50 32.35 1scf n PRO 23 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1scf h LYS 24 N 5.66 0.00 -0.47 -0.52 1.57 -1.97 -2.24 116.57 118.60 1scf h LYS 24 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1scf h LYS 24 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1scf h LYS 24 CO 0.87 0.00 0.00 -0.40 -0.57 0.00 0.00 179.45 179.35 1scf n ASP 25 N -3.60 4.54 -1.76 0.86 5.75 -1.26 -4.68 116.55 116.40 1scf n ASP 25 Ca -0.02 -2.70 0.00 0.00 -0.01 0.00 0.00 54.79 52.05 1scf n ASP 25 Cb 0.13 -0.56 0.00 0.00 -1.03 0.00 0.00 41.12 39.66 1scf n ASP 25 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1scf n TYR 26 N 0.41 -2.65 -3.60 2.11 9.36 -0.84 -5.10 117.16 116.84 1scf n TYR 26 Ca 0.23 0.00 -0.01 0.00 3.32 0.00 0.00 57.90 61.44 1scf n TYR 26 Cb 0.92 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 39.59 1scf n TYR 26 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1scf s ILE 28 N 0.84 -0.78 0.26 2.97 1.01 0.83 -3.98 121.20 122.35 1scf s ILE 28 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 60.65 60.35 1scf s ILE 28 Cb 0.00 -1.00 -0.09 0.00 0.01 0.00 0.00 42.46 41.38 1scf s ILE 28 CO 0.00 0.00 1.04 -0.89 0.00 0.00 0.00 174.94 175.09 1scf s THR 29 N 2.65 3.70 -0.23 2.92 2.01 -1.26 -0.86 115.64 124.58 1scf s THR 29 Ca -0.06 1.71 -0.12 0.00 0.31 0.00 0.00 61.69 63.53 1scf s THR 29 Cb -0.10 -4.09 0.08 0.00 0.01 0.00 0.00 72.50 68.40 1scf s THR 29 CO -0.19 0.41 0.55 -0.22 -0.69 0.00 0.00 174.62 174.48 1scf s LEU 30 N -1.32 -0.59 -1.26 4.42 2.96 0.10 -4.78 118.68 118.21 1scf s LEU 30 Ca 0.43 1.22 -0.19 0.00 -0.22 0.00 0.00 54.13 55.37 1scf s LEU 30 Cb -0.30 1.87 0.03 0.00 0.50 0.00 0.00 46.19 48.29 1scf s LEU 30 CO 0.38 -0.22 1.77 -0.54 -1.32 0.00 0.00 176.35 176.42 1scf s LYS 31 N 1.72 3.63 0.23 1.98 1.02 -1.26 -0.29 119.74 126.76 1scf s LYS 31 Ca -0.09 -1.77 -0.31 0.00 0.02 0.00 0.00 55.97 53.82 1scf s LYS 31 Cb -0.08 -5.46 -0.11 0.00 -0.52 0.00 0.00 37.83 31.66 1scf s LYS 31 CO -0.16 -2.66 1.59 -0.47 -0.92 0.00 0.00 175.35 172.73 1scf s TYR 32 N 5.84 2.93 -0.37 3.18 5.04 -1.24 -4.75 117.35 127.98 1scf s TYR 32 Ca 0.57 0.67 -0.25 0.00 -2.44 0.00 0.00 57.07 55.62 1scf s TYR 32 Cb 0.03 -4.00 0.01 0.00 0.35 0.00 0.00 41.96 38.35 1scf s TYR 32 CO 0.08 -3.56 0.88 0.08 -1.34 0.00 0.00 175.55 171.69 1scf s VAL 33 N 0.62 4.63 0.20 3.14 1.01 -1.26 -4.51 120.40 124.22 1scf s VAL 33 Ca 0.67 1.08 -0.33 0.00 0.00 0.00 0.00 61.98 63.41 1scf s VAL 33 Cb -0.46 -4.30 -0.13 0.00 0.00 0.00 0.00 36.38 31.49 1scf s VAL 33 CO 0.38 -0.51 1.58 -2.65 0.00 0.00 0.00 175.10 173.90 1scf n PRO 34 N 6.67 2.32 0.00 2.72 -0.02 -1.26 -4.85 135.00 140.59 1scf n PRO 34 Ca 0.06 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 1scf n PRO 34 Cb 0.48 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 1scf n PRO 34 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1scf n GLY 35 N 3.22 0.74 1.23 -1.23 0.00 -1.26 -4.98 105.19 102.91 1scf n GLY 35 Ca 0.15 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1scf n GLY 35 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1scf n ASP 37 N 0.00 0.00 -0.06 1.61 5.68 -1.26 -0.67 116.55 121.85 1scf n ASP 37 Ca 0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1scf n ASP 37 Cb 0.00 0.00 -0.16 0.00 -1.14 0.00 0.00 41.12 39.82 1scf n ASP 37 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 1scf n VAL 38 N 0.00 0.74 -3.62 2.12 0.24 -1.26 -5.03 118.33 111.53 1scf n VAL 38 Ca 0.00 -0.69 -0.28 0.00 -2.04 0.00 0.00 64.34 61.33 1scf n VAL 38 Cb 0.00 -0.25 -0.03 0.00 -1.47 0.00 0.00 33.84 32.09 1scf n VAL 38 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1scf s LEU 39 N -5.04 4.19 0.53 1.34 1.43 0.15 -5.07 118.68 116.20 1scf s LEU 39 Ca -0.09 0.47 -0.22 0.00 -1.03 0.00 0.00 54.13 53.27 1scf s LEU 39 Cb 0.10 -3.25 -0.05 0.00 0.03 0.00 0.00 46.19 43.01 1scf s LEU 39 CO 0.87 -0.07 1.29 -2.84 0.23 0.00 0.00 176.35 175.82 1scf s PRO 40 N -3.35 3.30 0.59 1.29 0.02 -1.26 -4.87 135.00 130.72 1scf s PRO 40 Ca 0.40 2.07 0.29 0.00 0.02 0.00 0.00 61.00 63.78 1scf s PRO 40 Cb -0.11 -2.27 1.54 0.00 0.02 0.00 0.00 34.50 33.68 1scf s PRO 40 CO 0.29 -1.01 1.96 0.66 -0.33 0.00 0.00 177.00 178.57 1scf h SER 41 N 1.58 0.00 0.33 2.53 4.64 -1.95 0.45 113.55 121.13 1scf h SER 41 Ca -0.50 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.78 1scf h SER 41 Cb 1.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.37 1scf h SER 41 CO 0.58 0.00 -0.17 1.12 -0.87 0.00 0.00 176.83 177.49 1scf h HIS 42 N 0.00 0.00 0.00 4.77 2.07 -1.94 -0.19 115.15 119.86 1scf h HIS 42 Ca 0.16 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.67 1scf h HIS 42 Cb 0.93 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.91 1scf h HIS 42 CO 0.00 0.17 -0.02 0.00 -3.07 0.00 0.00 177.93 175.02 1scf n TRP 44 N -3.13 0.00 -0.27 0.00 4.27 -0.86 -4.83 117.44 112.63 1scf n TRP 44 Ca -0.00 0.00 0.12 0.00 -3.89 0.00 0.00 57.50 53.73 1scf n TRP 44 Cb 0.26 0.00 0.38 0.00 -1.36 0.00 0.00 31.31 30.60 1scf n TRP 44 CO 0.00 0.00 0.00 0.97 -2.29 0.00 0.00 177.69 176.37 1scf h ILE 45 N 0.00 0.83 0.18 -1.67 6.09 -1.27 -2.69 117.51 118.98 1scf h ILE 45 Ca 0.00 -0.23 -0.01 0.00 -1.37 0.00 0.00 64.86 63.25 1scf h ILE 45 Cb 0.00 0.09 0.00 0.00 0.47 0.00 0.00 36.82 37.38 1scf h ILE 45 CO 0.00 0.12 -0.09 -1.28 -3.07 0.00 0.00 178.15 173.84 1scf h SER 46 N 0.68 -0.21 0.00 2.19 0.87 -1.83 0.65 113.55 115.91 1scf h SER 46 Ca 0.44 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.01 1scf h SER 46 Cb 0.72 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.74 1scf h SER 46 CO -0.20 -0.14 0.00 1.21 -0.53 0.00 0.00 176.83 177.16 1scf n GLU 47 N -5.19 0.54 0.00 2.24 4.07 -1.02 -3.05 120.64 118.23 1scf n GLU 47 Ca -0.09 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.01 1scf n GLU 47 Cb 0.12 -1.23 0.00 0.00 -0.06 0.00 0.00 31.44 30.27 1scf n GLU 47 CO 0.00 0.00 0.00 1.33 -0.06 0.00 0.00 177.13 178.40 1scf n VAL 49 N 1.63 0.00 -0.11 6.31 0.24 0.22 -1.86 118.33 124.76 1scf n VAL 49 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.20 1scf n VAL 49 Cb 0.27 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.62 1scf n VAL 49 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 1scf h VAL 50 N 0.00 1.20 -0.53 3.34 2.07 -1.80 -0.15 116.25 120.38 1scf h VAL 50 Ca 0.00 -0.65 -0.06 0.00 0.82 0.00 0.00 66.70 66.81 1scf h VAL 50 Cb 0.00 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 1scf h VAL 50 CO 0.00 0.22 0.08 1.56 0.02 0.00 0.00 177.57 179.45 1scf h GLN 51 N 0.40 0.88 -0.51 1.57 1.08 -1.67 -1.51 115.11 115.36 1scf h GLN 51 Ca 0.11 -0.24 -0.08 0.00 -1.45 0.00 0.00 58.65 56.99 1scf h GLN 51 Cb 0.23 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.54 1scf h GLN 51 CO -0.00 0.87 -0.02 -0.07 -0.95 0.00 0.00 178.83 178.65 1scf h LEU 52 N 0.77 0.84 -0.32 1.46 3.38 -1.79 -1.74 115.31 117.92 1scf h LEU 52 Ca 0.16 -0.22 0.03 0.00 0.09 0.00 0.00 57.88 57.94 1scf h LEU 52 Cb 0.42 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1scf h LEU 52 CO 0.01 0.92 0.13 -1.28 0.09 0.00 0.00 178.44 178.31 1scf h SER 53 N 0.80 0.17 -0.44 -0.43 0.87 -0.76 0.10 113.55 113.86 1scf h SER 53 Ca 0.15 0.03 -0.04 0.00 -1.23 0.00 0.00 61.79 60.69 1scf h SER 53 Cb 0.51 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.45 1scf h SER 53 CO 0.03 0.13 0.11 0.44 -0.53 0.00 0.00 176.83 177.01 1scf h ASP 54 N 0.28 0.67 -0.48 6.23 3.32 -1.01 0.77 116.42 126.20 1scf h ASP 54 Ca 0.14 -0.23 -0.09 0.00 0.02 0.00 0.00 57.03 56.86 1scf h ASP 54 Cb 0.09 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 1scf h ASP 54 CO -0.12 0.72 -0.05 0.28 -1.72 0.00 0.00 179.24 178.36 1scf h SER 55 N 0.58 0.91 0.41 6.45 0.02 -1.18 -1.41 113.55 119.33 1scf h SER 55 Ca 0.14 -0.26 -0.17 0.00 -0.84 0.00 0.00 61.79 60.66 1scf h SER 55 Cb 0.32 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1scf h SER 55 CO 0.00 1.00 -0.71 -0.07 -1.14 0.00 0.00 176.83 175.91 1scf h LEU 56 N 0.85 0.31 -0.39 5.07 3.38 -0.74 0.07 115.31 123.85 1scf h LEU 56 Ca 0.15 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1scf h LEU 56 Cb 0.56 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1scf h LEU 56 CO 0.03 0.92 0.01 0.74 0.09 0.00 0.00 178.44 180.23 1scf h THR 57 N 0.17 1.26 -0.64 0.22 2.02 -0.76 0.19 112.91 115.37 1scf h THR 57 Ca -0.02 -0.98 -0.05 0.00 0.77 0.00 0.00 66.41 66.13 1scf h THR 57 Cb 1.27 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 68.77 1scf h THR 57 CO 0.11 0.33 0.19 0.44 0.37 0.00 0.00 175.52 176.97 1scf h ASP 58 N 0.51 0.94 -0.80 4.18 3.32 -1.12 -2.84 116.42 120.62 1scf h ASP 58 Ca 0.11 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.95 1scf h ASP 58 Cb 0.45 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 1scf h ASP 58 CO 0.02 0.91 0.50 0.25 -1.72 0.00 0.00 179.24 179.20 1scf h LEU 59 N 0.93 0.94 -2.03 1.55 5.85 -0.62 -2.46 115.31 119.47 1scf h LEU 59 Ca 0.21 -0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.93 1scf h LEU 59 Cb 0.31 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1scf h LEU 59 CO -0.01 0.70 0.11 0.25 -0.34 0.00 0.00 178.44 179.16 1scf h LEU 60 N 1.09 0.00 0.00 2.25 5.85 -0.71 -0.57 115.31 123.21 1scf h LEU 60 Ca 0.29 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.01 1scf h LEU 60 Cb -0.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.95 1scf h LEU 60 CO -0.06 0.00 0.00 -0.90 -0.34 0.00 0.00 178.44 177.14 1scf n ASP 61 N -4.43 0.00 0.12 1.25 5.68 -0.93 -2.19 116.55 116.06 1scf n ASP 61 Ca 0.01 0.47 0.13 0.00 -0.50 0.00 0.00 54.79 54.89 1scf n ASP 61 Cb 0.24 -0.49 0.29 0.00 -1.14 0.00 0.00 41.12 40.02 1scf n ASP 61 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 1scf h LYS 62 N 0.00 0.00 -6.23 0.11 1.79 -1.18 -3.46 116.57 107.60 1scf h LYS 62 Ca 0.00 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 57.88 1scf h LYS 62 Cb 0.28 0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 30.81 1scf h LYS 62 CO 0.00 0.00 -0.70 -0.06 -1.08 0.00 0.00 179.45 177.61 1scf s PHE 63 N -3.15 2.52 0.22 -1.35 0.08 -0.93 -5.14 117.98 110.22 1scf s PHE 63 Ca 0.08 -0.27 0.11 0.00 0.12 0.00 0.00 56.93 56.97 1scf s PHE 63 Cb 0.11 -1.12 -0.04 0.00 -0.57 0.00 0.00 43.02 41.40 1scf s PHE 63 CO 0.65 0.65 -0.16 -1.12 -0.10 0.00 0.00 175.22 175.13 1scf s SER 64 N -3.53 3.82 0.32 1.36 0.01 -1.26 -4.98 113.70 109.44 1scf s SER 64 Ca 0.30 -0.79 -0.24 0.00 1.31 0.00 0.00 55.95 56.53 1scf s SER 64 Cb -0.06 -0.46 -0.10 0.00 0.21 0.00 0.00 66.02 65.61 1scf s SER 64 CO 0.17 0.09 0.90 0.21 0.41 0.00 0.00 173.24 175.02 1scf s ASN 65 N -3.00 7.22 -0.14 2.44 3.04 -1.26 -4.67 114.94 118.57 1scf s ASN 65 Ca 0.25 1.73 0.01 0.00 0.04 0.00 0.00 52.86 54.89 1scf s ASN 65 Cb -0.07 -2.54 0.02 0.00 -1.54 0.00 0.00 41.25 37.11 1scf s ASN 65 CO 0.14 -0.10 -0.15 -0.63 -3.04 0.00 0.00 177.10 173.32 1scf s ILE 66 N -1.69 1.59 -0.63 -5.21 1.01 -1.26 -5.06 121.20 109.95 1scf s ILE 66 Ca 0.51 -0.65 -0.06 0.00 0.00 0.00 0.00 60.65 60.45 1scf s ILE 66 Cb -0.17 -1.49 -0.07 0.00 0.01 0.00 0.00 42.46 40.75 1scf s ILE 66 CO 0.22 0.46 3.03 -1.54 0.00 0.00 0.00 174.94 177.11 1scf n SER 67 N 4.69 6.68 0.00 3.58 3.41 -1.26 -4.55 113.62 126.17 1scf n SER 67 Ca -0.17 -2.85 0.00 0.00 -0.26 0.00 0.00 58.87 55.59 1scf n SER 67 Cb 0.50 -1.37 0.00 0.00 -0.26 0.00 0.00 64.21 63.08 1scf n SER 67 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1scf n GLU 68 N 1.99 0.00 0.00 4.33 2.13 -1.26 -5.14 120.64 122.69 1scf n GLU 68 Ca 0.54 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.36 1scf n GLU 68 Cb 0.58 -0.02 0.00 0.00 0.27 0.00 0.00 31.44 32.26 1scf n GLU 68 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1scf n GLY 69 N 3.58 5.02 3.72 8.31 0.00 -1.26 -5.10 105.19 119.46 1scf n GLY 69 Ca 0.00 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.65 1scf n GLY 69 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1scf s LEU 70 N 0.00 4.37 0.32 0.99 2.01 -1.26 -4.98 118.68 120.13 1scf s LEU 70 Ca 0.00 2.63 0.09 0.00 0.01 0.00 0.00 54.13 56.87 1scf s LEU 70 Cb 0.00 -3.59 -0.05 0.00 0.01 0.00 0.00 46.19 42.56 1scf s LEU 70 CO 0.00 -0.84 -0.01 -0.94 1.01 0.00 0.00 176.35 175.57 1scf s SER 71 N 1.25 4.24 0.36 2.29 1.04 -1.26 -5.01 113.70 116.60 1scf s SER 71 Ca 0.71 -0.89 0.07 0.00 0.48 0.00 0.00 55.95 56.32 1scf s SER 71 Cb -0.44 -0.60 0.78 0.00 0.10 0.00 0.00 66.02 65.86 1scf s SER 71 CO 0.31 -0.15 1.93 0.78 0.98 0.00 0.00 173.24 177.09 1scf h ASN 72 N 1.86 0.65 0.61 7.02 2.35 -1.95 0.25 115.58 126.36 1scf h ASN 72 Ca -0.43 0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.31 1scf h ASN 72 Cb 1.25 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.49 1scf h ASN 72 CO 0.64 0.39 -0.41 0.22 -1.65 0.00 0.00 177.43 176.63 1scf h TYR 73 N 0.72 -1.09 -0.81 1.19 5.03 -1.94 0.93 116.97 121.01 1scf h TYR 73 Ca 0.36 -0.01 0.12 0.00 2.58 0.00 0.00 58.73 61.77 1scf h TYR 73 Cb 0.42 0.40 -0.06 0.00 1.55 0.00 0.00 36.73 39.04 1scf h TYR 73 CO -0.00 -0.59 0.53 0.77 -1.32 0.00 0.00 178.16 177.54 1scf h SER 74 N -0.96 0.61 -0.03 -2.11 0.02 -1.79 -0.95 113.55 108.35 1scf h SER 74 Ca -0.08 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.87 1scf h SER 74 Cb 0.78 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.22 1scf h SER 74 CO 0.06 0.34 -0.08 0.40 -1.14 0.00 0.00 176.83 176.41 1scf h ILE 75 N 0.66 1.47 -0.28 3.27 2.04 -0.67 -2.40 117.51 121.61 1scf h ILE 75 Ca 0.39 -1.51 -0.01 0.00 1.00 0.00 0.00 64.86 64.73 1scf h ILE 75 Cb 0.58 2.41 -0.01 0.00 -0.74 0.00 0.00 36.82 39.06 1scf h ILE 75 CO -0.15 0.41 0.13 0.40 0.00 0.00 0.00 178.15 178.93 1scf h ILE 76 N -0.47 1.16 -0.36 -0.67 2.04 -0.61 -1.60 117.51 116.99 1scf h ILE 76 Ca -0.00 -0.47 0.08 0.00 1.00 0.00 0.00 64.86 65.47 1scf h ILE 76 Cb 0.70 0.96 -0.08 0.00 -0.74 0.00 0.00 36.82 37.66 1scf h ILE 76 CO 0.02 0.16 -0.20 -0.78 0.00 0.00 0.00 178.15 177.35 1scf h ASP 77 N 0.31 -0.67 -0.68 1.72 3.58 -1.21 0.22 116.42 119.68 1scf h ASP 77 Ca 0.09 0.15 0.13 0.00 0.42 0.00 0.00 57.03 57.82 1scf h ASP 77 Cb 0.14 0.35 -0.04 0.00 1.72 0.00 0.00 39.33 41.50 1scf h ASP 77 CO -0.01 -0.23 0.46 0.50 -2.88 0.00 0.00 179.24 177.07 1scf h LYS 78 N -0.14 0.40 -0.12 0.28 3.64 -1.08 -1.06 116.57 118.49 1scf h LYS 78 Ca 0.18 -0.02 -0.20 0.00 -1.27 0.00 0.00 60.65 59.34 1scf h LYS 78 Cb 0.42 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1scf h LYS 78 CO -0.45 0.26 -0.74 -0.07 -2.27 0.00 0.00 179.45 176.18 1scf h LEU 79 N 0.41 0.69 -0.21 5.20 3.38 0.28 -2.37 115.31 122.68 1scf h LEU 79 Ca 0.33 -0.45 0.03 0.00 0.09 0.00 0.00 57.88 57.87 1scf h LEU 79 Cb 0.71 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1scf h LEU 79 CO -0.10 1.21 0.05 0.58 0.09 0.00 0.00 178.44 180.27 1scf h VAL 80 N 0.40 0.91 -0.61 1.22 2.07 -0.27 -1.89 116.25 118.08 1scf h VAL 80 Ca -0.04 -0.05 -0.08 0.00 0.82 0.00 0.00 66.70 67.36 1scf h VAL 80 Cb 1.34 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 1scf h VAL 80 CO 0.14 0.02 0.06 0.78 0.02 0.00 0.00 177.57 178.60 1scf h ASN 81 N 0.13 0.97 -0.35 0.57 2.35 -1.09 -0.72 115.58 117.44 1scf h ASN 81 Ca 0.10 -0.24 -0.03 0.00 -0.55 0.00 0.00 56.30 55.58 1scf h ASN 81 Cb 0.09 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.18 1scf h ASN 81 CO -0.12 0.99 0.11 0.40 -1.65 0.00 0.00 177.43 177.16 1scf h ILE 82 N 0.94 1.21 0.00 2.81 2.04 -1.24 -2.26 117.51 121.01 1scf h ILE 82 Ca 0.18 -0.67 -0.10 0.00 1.00 0.00 0.00 64.86 65.28 1scf h ILE 82 Cb 0.46 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 1scf h ILE 82 CO 0.02 0.23 -0.50 1.62 0.00 0.00 0.00 178.15 179.52 1scf h VAL 83 N 0.41 0.80 0.00 1.67 3.04 -1.10 -2.10 116.25 118.96 1scf h VAL 83 Ca 0.11 -2.14 -0.07 0.00 -1.01 0.00 0.00 66.70 63.59 1scf h VAL 83 Cb 0.25 2.39 -0.01 0.00 -2.01 0.00 0.00 31.29 31.90 1scf h VAL 83 CO -0.00 0.46 -0.36 0.44 -1.01 0.00 0.00 177.57 177.09 1scf h ASP 84 N 0.00 0.00 0.27 3.17 3.32 -1.10 0.20 116.42 122.28 1scf h ASP 84 Ca -0.01 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.89 1scf h ASP 84 Cb 1.37 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.91 1scf h ASP 84 CO 0.06 0.36 -0.59 0.44 -1.72 0.00 0.00 179.24 177.78 1scf h ASP 85 N 0.00 0.36 0.44 6.45 3.32 -0.97 -2.91 116.42 123.12 1scf h ASP 85 Ca -0.00 -0.21 -0.14 0.00 0.02 0.00 0.00 57.03 56.70 1scf h ASP 85 Cb 0.83 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.26 1scf h ASP 85 CO 0.05 0.87 -0.59 -0.07 -1.72 0.00 0.00 179.24 177.78 1scf h LEU 86 N 0.24 0.17 0.49 1.55 3.38 -1.00 -1.95 115.31 118.19 1scf h LEU 86 Ca -0.00 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 1scf h LEU 86 Cb 1.11 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1scf h LEU 86 CO 0.10 0.72 -0.24 0.58 0.09 0.00 0.00 178.44 179.69 1scf h VAL 87 N 0.11 0.52 -0.35 1.22 2.07 -0.98 -1.33 116.25 117.51 1scf h VAL 87 Ca -0.00 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 67.52 1scf h VAL 87 Cb 1.07 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 1scf h VAL 87 CO 0.09 0.01 0.13 -0.33 0.02 0.00 0.00 177.57 177.48 1scf h GLU 88 N -0.68 0.28 -0.58 1.57 5.08 -1.46 -1.38 114.58 117.41 1scf h GLU 88 Ca -0.07 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1scf h GLU 88 Cb 0.51 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 1scf h GLU 88 CO 0.11 0.18 0.33 0.00 -1.00 0.00 0.00 179.01 178.63 1scf h VAL 90 N 0.80 0.00 0.00 0.00 2.07 -0.21 -2.88 116.25 116.03 1scf h VAL 90 Ca 0.21 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 66.95 1scf h VAL 90 Cb 0.00 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 1scf h VAL 90 CO -0.04 0.00 -0.37 0.29 0.02 0.00 0.00 177.57 177.47 1scf n LYS 91 N -2.85 0.17 0.02 1.57 5.02 -0.67 -4.19 118.16 117.23 1scf n LYS 91 Ca 0.04 0.08 -0.03 0.00 -2.02 0.00 0.00 58.31 56.38 1scf n LYS 91 Cb 0.46 -1.64 -0.01 0.00 -0.02 0.00 0.00 35.03 33.82 1scf n LYS 91 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1scf h GLU 92 N 0.00 -0.15 -5.06 1.97 4.39 -1.39 -3.45 114.58 110.89 1scf h GLU 92 Ca 0.00 0.01 -0.44 0.00 0.34 0.00 0.00 59.36 59.27 1scf h GLU 92 Cb 0.65 0.03 -0.09 0.00 -0.10 0.00 0.00 28.75 29.24 1scf h GLU 92 CO 0.00 -0.09 1.77 0.09 -1.16 0.00 0.00 179.01 179.62 1scf n ASN 93 N -4.88 -0.03 -0.03 1.42 5.03 -1.10 -4.79 115.26 110.87 1scf n ASN 93 Ca -0.02 -0.15 0.14 0.00 0.87 0.00 0.00 54.58 55.42 1scf n ASN 93 Cb 0.07 -0.88 0.66 0.00 -1.02 0.00 0.00 39.78 38.60 1scf n ASN 93 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 1scf n SER 94 N 9.72 0.17 -4.51 6.41 3.41 -1.26 -4.78 113.62 122.78 1scf n SER 94 Ca 0.64 -0.15 -0.45 0.00 -0.26 0.00 0.00 58.87 58.65 1scf n SER 94 Cb 0.12 -0.23 -0.06 0.00 -0.26 0.00 0.00 64.21 63.78 1scf n SER 94 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1scf n SER 95 N -1.25 2.27 -0.31 4.04 2.88 -1.26 -4.77 113.62 115.22 1scf n SER 95 Ca 0.12 0.15 0.15 0.00 -1.33 0.00 0.00 58.87 57.97 1scf n SER 95 Cb 0.28 -1.37 0.31 0.00 -0.75 0.00 0.00 64.21 62.68 1scf n SER 95 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 1scf h LYS 96 N 14.45 0.11 -0.03 -1.46 -0.00 -2.01 -3.16 116.57 124.47 1scf h LYS 96 Ca -0.28 -0.01 0.04 0.00 -0.00 0.00 0.00 60.65 60.40 1scf h LYS 96 Cb 1.29 -0.02 -0.05 0.00 -0.00 0.00 0.00 32.23 33.45 1scf h LYS 96 CO 1.07 0.07 -0.28 0.38 -0.00 0.00 0.00 179.45 180.69 1scf h ASP 97 N 0.11 -0.83 -0.48 7.07 3.04 -1.96 -3.41 116.42 119.95 1scf h ASP 97 Ca 0.59 0.12 -0.62 0.00 -3.24 0.00 0.00 57.03 53.88 1scf h ASP 97 Cb 1.25 0.34 -0.04 0.00 -1.04 0.00 0.00 39.33 39.83 1scf h ASP 97 CO -0.76 -0.34 1.53 -0.11 -2.04 0.00 0.00 179.24 177.52 1scf n LEU 98 N -5.39 1.15 -4.67 0.15 0.00 -1.20 -4.76 117.00 102.28 1scf n LEU 98 Ca -0.04 0.30 -0.44 0.00 0.00 0.00 0.00 56.01 55.83 1scf n LEU 98 Cb 0.30 -1.08 -0.03 0.00 0.00 0.00 0.00 43.42 42.60 1scf n LEU 98 CO 0.20 -0.84 1.56 1.17 0.00 0.00 0.00 177.39 179.48 1scf n LYS 99 N 8.20 2.68 0.00 1.96 4.81 -1.10 -4.87 118.16 129.84 1scf n LYS 99 Ca 0.53 0.98 0.00 0.00 -0.87 0.00 0.00 58.31 58.95 1scf n LYS 99 Cb 0.12 -2.90 0.00 0.00 0.02 0.00 0.00 35.03 32.27 1scf n LYS 99 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1scf n LYS 100 N 7.03 6.14 -3.28 1.64 5.02 -1.26 -4.54 118.16 128.90 1scf n LYS 100 Ca 0.20 0.00 -0.45 0.00 -2.02 0.00 0.00 58.31 56.04 1scf n LYS 100 Cb 0.37 -0.46 -0.05 0.00 -0.02 0.00 0.00 35.03 34.87 1scf n LYS 100 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1scf s SER 101 N -0.91 6.18 0.08 4.39 0.15 -1.26 -4.89 113.70 117.44 1scf s SER 101 Ca 0.00 -1.61 0.08 0.00 0.70 0.00 0.00 55.95 55.12 1scf s SER 101 Cb 0.00 -2.23 -0.03 0.00 -1.71 0.00 0.00 66.02 62.05 1scf s SER 101 CO 0.00 -0.87 -0.20 -0.36 1.20 0.00 0.00 173.24 173.00 1scf s PHE 102 N 1.86 1.73 0.32 3.44 0.40 -1.26 -5.11 117.98 119.36 1scf s PHE 102 Ca 0.05 -0.40 -0.28 0.00 -0.60 0.00 0.00 56.93 55.70 1scf s PHE 102 Cb -0.27 -0.98 -0.09 0.00 0.51 0.00 0.00 43.02 42.18 1scf s PHE 102 CO 0.05 0.16 1.15 -1.59 0.70 0.00 0.00 175.22 175.69 1scf s LYS 103 N -1.65 4.44 -0.15 0.44 0.00 -1.26 -4.93 119.74 116.63 1scf s LYS 103 Ca 0.06 1.88 -0.29 0.00 0.00 0.00 0.00 55.97 57.62 1scf s LYS 103 Cb -0.10 -3.03 -0.05 0.00 0.00 0.00 0.00 37.83 34.65 1scf s LYS 103 CO 0.03 0.01 1.94 -1.12 0.00 0.00 0.00 175.35 176.21 1scf s SER 104 N -0.88 6.05 0.90 0.03 0.01 -1.26 -4.90 113.70 113.64 1scf s SER 104 Ca 0.49 2.00 -0.11 0.00 1.31 0.00 0.00 55.95 59.64 1scf s SER 104 Cb -0.33 -2.52 0.13 0.00 0.21 0.00 0.00 66.02 63.51 1scf s SER 104 CO 0.42 -1.47 1.11 -2.84 0.41 0.00 0.00 173.24 170.88 1scf s PRO 105 N 5.25 1.19 0.15 12.44 0.02 -1.26 -4.95 135.00 147.84 1scf s PRO 105 Ca 0.87 1.29 -0.30 0.00 0.02 0.00 0.00 61.00 62.88 1scf s PRO 105 Cb -0.33 -1.77 -0.07 0.00 0.02 0.00 0.00 34.50 32.36 1scf s PRO 105 CO 0.35 -2.43 1.09 -2.00 -0.33 0.00 0.00 177.00 173.69 1scf s GLU 106 N -4.73 4.58 0.19 5.54 2.12 -1.26 -4.82 118.70 120.32 1scf s GLU 106 Ca 0.65 1.68 -0.32 0.00 0.36 0.00 0.00 54.97 57.35 1scf s GLU 106 Cb -0.21 -3.31 -0.11 0.00 0.26 0.00 0.00 34.13 30.77 1scf s GLU 106 CO 0.58 0.03 1.62 -2.14 -0.54 0.00 0.00 175.26 174.82 1scf s PRO 107 N -0.06 4.18 0.04 4.30 0.02 -1.26 -3.60 135.00 138.62 1scf s PRO 107 Ca 0.51 2.46 0.07 0.00 0.02 0.00 0.00 61.00 64.06 1scf s PRO 107 Cb -0.28 -3.11 -0.02 0.00 0.02 0.00 0.00 34.50 31.10 1scf s PRO 107 CO 0.33 -0.66 -0.21 1.03 -0.33 0.00 0.00 177.00 177.17 1scf s ARG 108 N 1.00 1.43 -0.07 5.54 0.52 0.60 -4.90 118.95 123.07 1scf s ARG 108 Ca 0.71 -0.93 -0.15 0.00 -0.52 0.00 0.00 55.73 54.85 1scf s ARG 108 Cb -0.46 -1.53 -0.05 0.00 0.52 0.00 0.00 34.95 33.43 1scf s ARG 108 CO 0.33 0.39 0.37 -0.51 0.02 0.00 0.00 175.30 175.90 1scf s LEU 109 N -1.11 4.37 0.03 2.53 1.43 -1.26 0.03 118.68 124.70 1scf s LEU 109 Ca 0.08 0.78 0.04 0.00 -1.03 0.00 0.00 54.13 54.00 1scf s LEU 109 Cb -0.09 -2.51 -0.02 0.00 0.03 0.00 0.00 46.19 43.60 1scf s LEU 109 CO 0.01 0.21 -0.12 -0.36 0.23 0.00 0.00 176.35 176.32 1scf s PHE 110 N -0.34 1.07 0.81 0.29 0.08 -0.04 -4.95 117.98 114.91 1scf s PHE 110 Ca 0.22 -0.35 -0.11 0.00 0.12 0.00 0.00 56.93 56.81 1scf s PHE 110 Cb -0.15 -0.64 0.08 0.00 -0.57 0.00 0.00 43.02 41.74 1scf s PHE 110 CO 0.10 0.01 1.09 0.95 -0.10 0.00 0.00 175.22 177.27 1scf s THR 111 N -0.85 3.11 0.33 0.64 -4.23 -1.26 -0.12 115.64 113.26 1scf s THR 111 Ca -0.00 0.36 0.05 0.00 -1.18 0.00 0.00 61.69 60.92 1scf s THR 111 Cb -0.08 -2.82 0.30 0.00 1.34 0.00 0.00 72.50 71.24 1scf s THR 111 CO 0.01 -0.47 1.87 -0.65 -0.54 0.00 0.00 174.62 174.84 1scf h PRO 112 N -1.27 0.81 -0.40 3.99 0.11 -1.84 -2.01 132.00 131.40 1scf h PRO 112 Ca -0.45 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 1scf h PRO 112 Cb 1.24 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1scf h PRO 112 CO 0.52 0.54 0.21 1.49 -0.21 0.00 0.00 178.00 180.54 1scf h GLU 113 N 0.83 0.56 -0.45 1.05 4.81 -1.92 -1.93 114.58 117.53 1scf h GLU 113 Ca 0.44 -0.07 -0.06 0.00 -0.13 0.00 0.00 59.36 59.54 1scf h GLU 113 Cb 0.53 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 1scf h GLU 113 CO -0.20 0.46 0.06 0.93 -0.73 0.00 0.00 179.01 179.53 1scf h GLU 114 N 0.51 0.75 -0.13 1.92 5.08 -1.75 -2.41 114.58 118.54 1scf h GLU 114 Ca 0.14 -0.21 0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1scf h GLU 114 Cb 0.07 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 1scf h GLU 114 CO -0.02 0.78 -0.03 0.35 -1.00 0.00 0.00 179.01 179.09 1scf h PHE 115 N 0.61 -0.07 0.00 4.33 3.57 -1.38 -1.98 116.94 122.02 1scf h PHE 115 Ca 0.13 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.65 1scf h PHE 115 Cb 0.40 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.20 1scf h PHE 115 CO 0.03 -0.06 0.00 0.74 -2.23 0.00 0.00 178.31 176.79 1scf h PHE 116 N 0.00 0.00 -0.08 0.41 0.04 -1.38 0.76 116.94 116.69 1scf h PHE 116 Ca 0.06 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.67 1scf h PHE 116 Cb 0.10 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.24 1scf h PHE 116 CO -0.17 0.00 -0.68 -0.09 -0.60 0.00 0.00 178.31 176.77 1scf h ARG 117 N 0.00 0.34 -0.02 1.51 9.65 -1.17 -1.38 114.38 123.30 1scf h ARG 117 Ca 0.00 -0.26 -0.02 0.00 -1.10 0.00 0.00 59.98 58.60 1scf h ARG 117 Cb 0.67 0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.30 1scf h ARG 117 CO 0.00 0.89 -0.04 0.82 2.80 0.00 0.00 179.97 184.44 1scf h ILE 118 N 0.24 1.44 -0.79 1.20 2.04 -0.75 -2.06 117.51 118.82 1scf h ILE 118 Ca -0.02 -1.36 0.15 0.00 1.00 0.00 0.00 64.86 64.63 1scf h ILE 118 Cb 1.23 2.29 -0.10 0.00 -0.74 0.00 0.00 36.82 39.51 1scf h ILE 118 CO 0.11 0.36 0.33 0.15 0.00 0.00 0.00 178.15 179.11 1scf h PHE 119 N -0.46 0.57 -0.34 1.37 3.57 -0.89 -1.55 116.94 119.20 1scf h PHE 119 Ca 0.00 0.04 -0.11 0.00 3.53 0.00 0.00 57.97 61.42 1scf h PHE 119 Cb 0.61 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 1scf h PHE 119 CO 0.12 0.07 -0.23 -0.91 -2.23 0.00 0.00 178.31 175.13 1scf h ASN 120 N 0.47 0.79 -0.71 0.41 2.35 -1.26 -2.10 115.58 115.52 1scf h ASN 120 Ca 0.44 -0.43 0.01 0.00 -0.55 0.00 0.00 56.30 55.77 1scf h ASN 120 Cb 0.68 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.80 1scf h ASN 120 CO -0.41 1.05 0.47 -0.09 -1.65 0.00 0.00 177.43 176.80 1scf h ARG 121 N 0.53 0.92 -0.13 0.81 9.65 -0.67 -2.11 114.38 123.37 1scf h ARG 121 Ca 0.07 -0.06 -0.09 0.00 -1.10 0.00 0.00 59.98 58.80 1scf h ARG 121 Cb 0.79 -0.21 0.00 0.00 -1.39 0.00 0.00 29.97 29.16 1scf h ARG 121 CO 0.06 0.61 -0.26 0.77 2.80 0.00 0.00 179.97 183.95 1scf h SER 122 N 0.95 0.45 -0.96 -3.80 0.02 -1.26 0.13 113.55 109.07 1scf h SER 122 Ca 0.27 -0.56 0.03 0.00 -0.84 0.00 0.00 61.79 60.69 1scf h SER 122 Cb -0.08 -0.13 -0.05 0.00 0.14 0.00 0.00 62.40 62.28 1scf h SER 122 CO -0.06 0.93 0.63 0.40 -1.14 0.00 0.00 176.83 177.58 1scf h ILE 123 N -0.02 1.18 0.00 3.27 1.08 -1.28 -2.35 117.51 119.39 1scf h ILE 123 Ca 0.00 -0.42 0.00 0.00 -0.39 0.00 0.00 64.86 64.05 1scf h ILE 123 Cb 0.85 -0.15 0.00 0.00 -3.07 0.00 0.00 36.82 34.45 1scf h ILE 123 CO 0.06 0.22 0.00 0.44 -0.69 0.00 0.00 178.15 178.18 1scf h ASP 124 N 1.23 0.00 0.22 1.72 3.32 -1.19 -3.20 116.42 118.52 1scf h ASP 124 Ca 0.38 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.41 1scf h ASP 124 Cb -0.02 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 1scf h ASP 124 CO -0.11 0.00 -0.08 0.00 -1.72 0.00 0.00 179.24 177.33 1scf h ALA 125 N 2.02 1.38 -0.15 3.45 0.00 -0.17 -2.41 119.26 123.38 1scf h ALA 125 Ca 0.00 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1scf h ALA 125 Cb 0.87 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 1scf h ALA 125 CO 0.00 0.09 -0.20 0.74 0.00 0.00 0.00 179.25 179.88 1scf h PHE 126 N 0.00 0.50 -0.93 0.00 -1.00 -1.63 -3.37 116.94 110.52 1scf h PHE 126 Ca -0.00 -0.16 0.16 0.00 2.81 0.00 0.00 57.97 60.77 1scf h PHE 126 Cb 0.21 -0.10 -0.08 0.00 3.61 0.00 0.00 35.95 39.59 1scf h PHE 126 CO 0.00 0.82 0.59 0.87 -1.61 0.00 0.00 178.31 178.99 1scf h LYS 127 N 0.03 0.68 -2.13 1.51 1.57 -1.61 -2.71 116.57 113.91 1scf h LYS 127 Ca 0.02 -0.04 -0.78 0.00 -1.87 0.00 0.00 60.65 57.98 1scf h LYS 127 Cb 0.76 -0.15 -0.28 0.00 0.08 0.00 0.00 32.23 32.64 1scf h LYS 127 CO 0.05 0.45 0.92 -0.25 -0.57 0.00 0.00 179.45 180.04 1scf n ASP 128 N -4.59 7.21 -4.86 0.86 10.43 -1.23 -5.17 116.55 119.20 1scf n ASP 128 Ca 0.19 -3.75 -0.37 0.00 2.57 0.00 0.00 54.79 53.43 1scf n ASP 128 Cb 0.51 -1.08 -0.06 0.00 1.84 0.00 0.00 41.12 42.33 1scf n ASP 128 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1scf s PHE 129 N -4.18 3.59 0.18 1.24 0.08 -1.03 -5.01 117.98 112.85 1scf s PHE 129 Ca 0.45 0.55 -0.10 0.00 0.12 0.00 0.00 56.93 57.95 1scf s PHE 129 Cb 0.30 -1.99 0.08 0.00 -0.57 0.00 0.00 43.02 40.84 1scf s PHE 129 CO -0.24 0.69 1.68 0.38 -0.10 0.00 0.00 175.22 177.62 1scf h ASP 137 N 5.13 1.02 0.00 1.36 3.04 -2.01 -3.53 116.42 121.43 1scf h ASP 137 Ca -0.53 -0.26 0.00 0.00 -3.24 0.00 0.00 57.03 53.00 1scf h ASP 137 Cb 1.22 -0.27 0.00 0.00 -1.04 0.00 0.00 39.33 39.24 1scf h ASP 137 CO 0.60 1.02 0.00 0.00 -2.04 0.00 0.00 179.24 178.82