#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ktk h ILE 19 N 0.00 1.25 -0.31 5.18 6.09 -2.06 -2.34 117.51 125.32 3ktk h ILE 19 Ca 0.00 -0.50 -0.18 0.00 -1.37 0.00 0.00 64.86 62.81 3ktk h ILE 19 Cb 0.00 -0.12 -0.00 0.00 0.47 0.00 0.00 36.82 37.17 3ktk h ILE 19 CO 0.00 0.25 -0.51 1.88 -3.07 0.00 0.00 178.15 176.70 3ktk h TYR 20 N 1.29 1.10 0.00 2.19 0.05 -1.99 -2.58 116.97 117.03 3ktk h TYR 20 Ca 0.34 -0.38 -0.00 0.00 0.05 0.00 0.00 58.73 58.75 3ktk h TYR 20 Cb -0.11 -0.21 -0.00 0.00 1.01 0.00 0.00 36.73 37.42 3ktk h TYR 20 CO -0.00 1.21 -0.01 1.03 -1.05 0.00 0.00 178.16 179.33 3ktk h SER 21 N 0.69 0.00 -0.26 3.88 0.87 -1.91 0.36 113.55 117.18 3ktk h SER 21 Ca 0.03 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.41 3ktk h SER 21 Cb 1.11 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.07 3ktk h SER 21 CO 0.12 0.01 -0.52 -0.09 -0.53 0.00 0.00 176.83 175.82 3ktk h ARG 22 N 0.00 0.85 -0.33 2.24 9.65 -1.07 -2.56 114.38 123.16 3ktk h ARG 22 Ca -0.00 -0.52 -0.09 0.00 -1.10 0.00 0.00 59.98 58.26 3ktk h ARG 22 Cb 0.02 0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.64 3ktk h ARG 22 CO 0.00 1.16 -0.19 -0.07 2.80 0.00 0.00 179.97 183.67 3ktk h LEU 23 N 0.66 0.60 -1.17 3.80 3.38 -0.64 -2.47 115.31 119.47 3ktk h LEU 23 Ca 0.02 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 3ktk h LEU 23 Cb 1.12 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 3ktk h LEU 23 CO 0.12 0.79 -0.06 0.25 0.09 0.00 0.00 178.44 179.63 3ktk h LEU 24 N 0.54 0.48 -2.42 1.67 5.85 -0.89 -0.66 115.31 119.88 3ktk h LEU 24 Ca 0.09 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 3ktk h LEU 24 Cb 0.62 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.53 3ktk h LEU 24 CO 0.04 0.59 -0.03 0.11 -0.34 0.00 0.00 178.44 178.82 3ktk h LYS 25 N 0.48 0.00 -0.48 1.25 6.56 -1.02 -0.97 116.57 122.39 3ktk h LYS 25 Ca 0.10 0.00 -0.19 0.00 -1.06 0.00 0.00 60.65 59.49 3ktk h LYS 25 Cb 0.40 0.00 -0.11 0.00 -0.57 0.00 0.00 32.23 31.95 3ktk h LYS 25 CO 0.02 0.03 0.10 -0.25 -2.06 0.00 0.00 179.45 177.29 3ktk n ASP 26 N -3.64 3.34 -3.53 0.86 8.00 -0.50 -4.96 116.55 116.12 3ktk n ASP 26 Ca -0.03 -3.49 -0.21 0.00 0.71 0.00 0.00 54.79 51.77 3ktk n ASP 26 Cb 0.12 -0.66 0.08 0.00 -0.02 0.00 0.00 41.12 40.64 3ktk n ASP 26 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3ktk n ARG 27 N -0.84 -7.42 -4.13 -1.24 1.74 -0.37 -4.90 116.66 99.51 3ktk n ARG 27 Ca 0.35 0.84 -0.30 0.00 -0.77 0.00 0.00 57.85 57.97 3ktk n ARG 27 Cb 1.15 -5.88 -0.16 0.00 -1.02 0.00 0.00 32.46 26.54 3ktk n ARG 27 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3ktk s ILE 28 N -3.34 1.66 -0.12 0.55 1.01 -0.37 -1.00 121.20 119.59 3ktk s ILE 28 Ca 0.34 -0.70 -0.03 0.00 0.00 0.00 0.00 60.65 60.26 3ktk s ILE 28 Cb -0.15 -1.54 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 3ktk s ILE 28 CO 0.73 0.47 -0.00 -0.63 0.00 0.00 0.00 174.94 175.51 3ktk s ILE 29 N 1.36 4.26 -0.30 2.92 1.01 0.67 -3.22 121.20 127.90 3ktk s ILE 29 Ca 0.03 -0.25 -0.08 0.00 0.00 0.00 0.00 60.65 60.35 3ktk s ILE 29 Cb -0.13 -2.83 -0.01 0.00 0.01 0.00 0.00 42.46 39.50 3ktk s ILE 29 CO -0.09 0.55 0.12 -0.04 0.00 0.00 0.00 174.94 175.48 3ktk s MET 30 N -0.32 3.31 -0.86 2.79 -1.94 -1.26 -0.31 119.30 120.71 3ktk s MET 30 Ca 0.06 -0.73 -0.07 0.00 -1.71 0.00 0.00 55.69 53.25 3ktk s MET 30 Cb -0.12 -3.47 0.22 0.00 2.01 0.00 0.00 34.83 33.46 3ktk s MET 30 CO 0.02 -0.39 0.76 -1.17 -0.01 0.00 0.00 175.02 174.23 3ktk s LEU 31 N 1.58 5.96 -0.33 -0.03 2.96 0.38 -4.89 118.68 124.31 3ktk s LEU 31 Ca 0.04 -3.22 0.08 0.00 -0.22 0.00 0.00 54.13 50.81 3ktk s LEU 31 Cb -0.17 -2.04 0.45 0.00 0.50 0.00 0.00 46.19 44.94 3ktk s LEU 31 CO 0.05 -0.35 1.16 0.61 -1.32 0.00 0.00 176.35 176.49 3ktk n GLY 32 N 3.11 5.92 3.63 7.98 0.00 -1.26 -1.57 105.19 123.00 3ktk n GLY 32 Ca 0.17 -2.57 -0.09 0.00 0.00 0.00 0.00 46.02 43.52 3ktk n GLY 32 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ktk s SER 33 N -3.58 -0.32 0.70 1.61 1.04 -1.23 -4.87 113.70 107.04 3ktk s SER 33 Ca 0.48 -0.44 -0.16 0.00 0.48 0.00 0.00 55.95 56.31 3ktk s SER 33 Cb 0.40 0.64 -0.01 0.00 0.10 0.00 0.00 66.02 67.15 3ktk s SER 33 CO -0.03 -1.15 0.92 0.00 0.98 0.00 0.00 173.24 173.96 3ktk n ALA 34 N -0.40 -0.29 -2.54 5.32 0.00 -1.26 -4.58 120.51 116.76 3ktk n ALA 34 Ca -0.09 -0.15 -0.42 0.00 0.00 0.00 0.00 53.44 52.78 3ktk n ALA 34 Cb 0.62 -2.09 -0.07 0.00 0.00 0.00 0.00 19.45 17.91 3ktk n ALA 34 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ktk s ILE 35 N -1.76 4.93 0.37 0.00 1.01 0.20 -4.88 121.20 121.07 3ktk s ILE 35 Ca 0.73 0.27 0.04 0.00 0.00 0.00 0.00 60.65 61.69 3ktk s ILE 35 Cb -0.36 -4.08 -0.05 0.00 0.01 0.00 0.00 42.46 37.98 3ktk s ILE 35 CO 0.50 -0.38 0.07 1.51 0.00 0.00 0.00 174.94 176.64 3ktk s ASP 36 N 1.85 2.77 0.36 3.58 -4.77 -1.26 -0.59 116.67 118.61 3ktk s ASP 36 Ca 0.21 -1.49 0.11 0.00 -3.30 0.00 0.00 52.55 48.08 3ktk s ASP 36 Cb -0.15 0.12 0.89 0.00 -1.09 0.00 0.00 42.92 42.69 3ktk s ASP 36 CO 0.16 -0.71 1.82 0.44 0.70 0.00 0.00 175.17 177.57 3ktk h ASP 37 N 1.92 0.62 0.42 2.11 3.45 -1.96 0.11 116.42 123.09 3ktk h ASP 37 Ca -0.40 0.07 -0.02 0.00 0.43 0.00 0.00 57.03 57.11 3ktk h ASP 37 Cb 1.26 -0.05 0.00 0.00 -0.56 0.00 0.00 39.33 39.99 3ktk h ASP 37 CO 0.67 0.24 -0.20 0.78 -1.57 0.00 0.00 179.24 179.16 3ktk h ASN 38 N 0.61 -0.48 -0.53 6.45 2.35 -1.99 0.16 115.58 122.15 3ktk h ASN 38 Ca 0.52 -0.06 0.06 0.00 -0.55 0.00 0.00 56.30 56.27 3ktk h ASN 38 Cb 1.01 0.12 -0.05 0.00 0.05 0.00 0.00 38.32 39.45 3ktk h ASN 38 CO -0.27 -0.22 0.24 0.58 -1.65 0.00 0.00 177.43 176.10 3ktk h VAL 39 N -0.73 0.89 -0.31 2.81 2.07 -1.72 -1.67 116.25 117.58 3ktk h VAL 39 Ca -0.06 -0.16 0.02 0.00 0.82 0.00 0.00 66.70 67.32 3ktk h VAL 39 Cb 0.52 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 3ktk h VAL 39 CO 0.10 0.08 0.17 0.00 0.02 0.00 0.00 177.57 177.93 3ktk h ALA 40 N 1.32 0.38 -0.45 1.67 0.00 -0.69 -0.94 119.26 120.55 3ktk h ALA 40 Ca 0.25 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 3ktk h ALA 40 Cb 0.21 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3ktk h ALA 40 CO -0.21 -0.21 0.08 -0.91 0.00 0.00 0.00 179.25 178.00 3ktk h ASN 41 N 0.34 0.64 0.01 0.00 2.35 -0.59 -0.75 115.58 117.58 3ktk h ASN 41 Ca 0.13 -0.11 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 3ktk h ASN 41 Cb 0.03 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.23 3ktk h ASN 41 CO -0.08 0.66 -0.00 -1.28 -1.65 0.00 0.00 177.43 175.07 3ktk h SER 42 N 0.66 -0.01 -0.55 5.81 0.87 -0.84 -0.83 113.55 118.66 3ktk h SER 42 Ca 0.15 -0.33 0.02 0.00 -1.23 0.00 0.00 61.79 60.40 3ktk h SER 42 Cb 0.29 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.22 3ktk h SER 42 CO 0.00 0.32 0.34 0.40 -0.53 0.00 0.00 176.83 177.37 3ktk h ILE 43 N -0.34 1.09 -0.39 2.23 1.08 -1.03 -0.85 117.51 119.29 3ktk h ILE 43 Ca -0.00 -0.24 0.00 0.00 -0.39 0.00 0.00 64.86 64.23 3ktk h ILE 43 Cb 0.34 0.34 -0.02 0.00 -3.07 0.00 0.00 36.82 34.40 3ktk h ILE 43 CO 0.00 0.13 0.24 0.58 -0.69 0.00 0.00 178.15 178.41 3ktk h VAL 44 N 0.69 1.12 -0.36 1.67 2.07 -1.08 -0.65 116.25 119.72 3ktk h VAL 44 Ca 0.22 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.49 3ktk h VAL 44 Cb -0.01 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 3ktk h VAL 44 CO -0.08 0.12 0.22 0.28 0.02 0.00 0.00 177.57 178.13 3ktk h SER 45 N 0.52 0.42 -0.88 0.57 0.02 -0.78 -1.01 113.55 112.41 3ktk h SER 45 Ca 0.14 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3ktk h SER 45 Cb -0.02 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.37 3ktk h SER 45 CO -0.03 0.33 0.56 1.56 -1.14 0.00 0.00 176.83 178.11 3ktk h GLN 46 N 0.47 1.17 -0.34 3.45 4.20 -0.89 0.14 115.11 123.32 3ktk h GLN 46 Ca 0.13 -0.09 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 3ktk h GLN 46 Cb -0.02 -0.26 -0.02 0.00 0.30 0.00 0.00 27.48 27.49 3ktk h GLN 46 CO -0.03 0.80 0.13 -0.07 -0.67 0.00 0.00 178.83 178.99 3ktk h LEU 47 N 1.20 0.48 -0.76 1.46 3.38 -0.74 0.38 115.31 120.71 3ktk h LEU 47 Ca 0.32 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 58.04 3ktk h LEU 47 Cb -0.10 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 3ktk h LEU 47 CO -0.06 0.52 0.06 -0.07 0.09 0.00 0.00 178.44 178.98 3ktk h LEU 48 N 0.41 0.97 0.74 1.67 3.38 -0.85 -1.35 115.31 120.27 3ktk h LEU 48 Ca 0.11 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 3ktk h LEU 48 Cb 0.20 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 40.70 3ktk h LEU 48 CO -0.01 0.99 -0.36 0.15 0.09 0.00 0.00 178.44 179.30 3ktk h PHE 49 N 0.94 -0.93 -0.66 1.13 3.57 -0.38 -0.66 116.94 119.96 3ktk h PHE 49 Ca 0.18 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.71 3ktk h PHE 49 Cb 0.46 0.31 -0.04 0.00 2.79 0.00 0.00 35.95 39.46 3ktk h PHE 49 CO 0.03 -0.56 0.43 -0.07 -2.23 0.00 0.00 178.31 175.91 3ktk h LEU 50 N -1.05 0.61 -0.96 0.59 3.38 -0.90 -0.24 115.31 116.75 3ktk h LEU 50 Ca -0.10 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.76 3ktk h LEU 50 Cb 0.78 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3ktk h LEU 50 CO 0.17 0.41 -0.45 0.00 0.09 0.00 0.00 178.44 178.65 3ktk h ALA 51 N 1.64 1.13 -0.24 1.53 0.00 -1.08 -2.38 119.26 119.86 3ktk h ALA 51 Ca 0.28 -0.43 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 3ktk h ALA 51 Cb 0.20 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3ktk h ALA 51 CO -0.08 0.60 -0.49 0.00 0.00 0.00 0.00 179.25 179.28 3ktk h ALA 52 N 1.41 0.38 -0.51 0.00 0.00 0.51 -2.66 119.26 118.39 3ktk h ALA 52 Ca 0.01 -0.49 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 3ktk h ALA 52 Cb 0.85 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 3ktk h ALA 52 CO 0.07 0.54 -0.00 0.93 0.00 0.00 0.00 179.25 180.79 3ktk h GLU 53 N 0.48 0.87 -1.00 0.00 5.08 -1.04 -3.41 114.58 115.54 3ktk h GLU 53 Ca 0.01 -0.25 0.02 0.00 -1.00 0.00 0.00 59.36 58.14 3ktk h GLU 53 Cb 1.09 -0.09 -0.21 0.00 0.50 0.00 0.00 28.75 30.04 3ktk h GLU 53 CO 0.11 0.87 -0.38 0.34 -1.00 0.00 0.00 179.01 178.94 3ktk s ASP 54 N -6.63 -1.62 0.00 1.42 -1.08 -0.91 -5.01 116.67 102.84 3ktk s ASP 54 Ca -0.10 0.14 0.09 0.00 -0.52 0.00 0.00 52.55 52.15 3ktk s ASP 54 Cb 0.14 2.03 0.53 0.00 -1.46 0.00 0.00 42.92 44.17 3ktk s ASP 54 CO 0.82 -0.29 1.02 -0.81 0.52 0.00 0.00 175.17 176.43 3ktk n PRO 55 N 5.37 0.58 -0.09 4.34 -0.04 -1.00 -3.61 135.00 140.54 3ktk n PRO 55 Ca 0.05 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.34 3ktk n PRO 55 Cb 0.54 -1.24 -0.06 0.00 -0.04 0.00 0.00 33.50 32.70 3ktk n PRO 55 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3ktk n GLU 56 N -0.74 0.44 -1.72 0.54 -0.58 -1.26 -3.18 120.64 114.13 3ktk n GLU 56 Ca 0.07 0.19 -0.42 0.00 -0.42 0.00 0.00 57.16 56.57 3ktk n GLU 56 Cb 0.03 -1.24 -0.03 0.00 -0.57 0.00 0.00 31.44 29.63 3ktk n GLU 56 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3ktk n LYS 57 N -4.05 2.74 -1.09 3.49 5.02 -1.24 -4.68 118.16 118.35 3ktk n LYS 57 Ca -0.32 0.99 -0.30 0.00 -2.02 0.00 0.00 58.31 56.66 3ktk n LYS 57 Cb 0.67 -2.82 0.14 0.00 -0.02 0.00 0.00 35.03 33.00 3ktk n LYS 57 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 3ktk s GLU 58 N 0.75 1.26 0.06 1.97 -1.05 -1.26 -4.68 118.70 115.75 3ktk s GLU 58 Ca 0.72 1.00 0.10 0.00 -0.15 0.00 0.00 54.97 56.64 3ktk s GLU 58 Cb -0.51 -1.80 -0.03 0.00 -0.44 0.00 0.00 34.13 31.36 3ktk s GLU 58 CO 0.36 -2.29 -0.26 0.42 0.95 0.00 0.00 175.26 174.44 3ktk s ILE 59 N -2.85 2.18 -0.18 1.83 1.01 -0.61 -4.94 121.20 117.65 3ktk s ILE 59 Ca 0.64 -1.46 -0.03 0.00 0.00 0.00 0.00 60.65 59.81 3ktk s ILE 59 Cb -0.19 -1.87 -0.01 0.00 0.01 0.00 0.00 42.46 40.40 3ktk s ILE 59 CO 0.58 0.32 -0.07 -0.44 0.00 0.00 0.00 174.94 175.32 3ktk s SER 60 N -1.40 4.32 -0.39 3.58 0.01 -0.17 -0.72 113.70 118.93 3ktk s SER 60 Ca 0.12 -0.31 -0.07 0.00 1.31 0.00 0.00 55.95 57.00 3ktk s SER 60 Cb -0.10 -1.71 0.07 0.00 0.21 0.00 0.00 66.02 64.49 3ktk s SER 60 CO 0.03 0.08 0.20 -0.22 0.41 0.00 0.00 173.24 173.74 3ktk s LEU 61 N 0.87 4.91 -0.08 2.44 2.96 0.63 -0.23 118.68 130.17 3ktk s LEU 61 Ca -0.02 -1.46 -0.27 0.00 -0.22 0.00 0.00 54.13 52.16 3ktk s LEU 61 Cb -0.15 -1.93 -0.02 0.00 0.50 0.00 0.00 46.19 44.59 3ktk s LEU 61 CO 0.01 -0.47 0.86 -0.31 -1.32 0.00 0.00 176.35 175.12 3ktk s TYR 62 N 1.38 3.55 -0.11 5.38 2.02 0.57 -2.06 117.35 128.08 3ktk s TYR 62 Ca 0.02 1.43 0.03 0.00 -0.37 0.00 0.00 57.07 58.18 3ktk s TYR 62 Cb -0.22 -3.01 -0.00 0.00 -0.40 0.00 0.00 41.96 38.33 3ktk s TYR 62 CO 0.01 -0.08 -0.21 0.42 -1.57 0.00 0.00 175.55 174.13 3ktk s ILE 63 N 1.41 2.32 -0.47 2.71 1.01 0.11 -0.47 121.20 127.82 3ktk s ILE 63 Ca 0.43 -0.92 0.06 0.00 0.00 0.00 0.00 60.65 60.22 3ktk s ILE 63 Cb -0.18 -1.92 0.21 0.00 0.01 0.00 0.00 42.46 40.58 3ktk s ILE 63 CO 0.19 0.55 0.70 -3.20 0.00 0.00 0.00 174.94 173.18 3ktk n ASN 64 N 3.57 -2.29 -4.02 3.58 5.15 -0.61 -0.29 115.26 120.35 3ktk n ASN 64 Ca -0.19 -2.94 -0.12 0.00 -0.60 0.00 0.00 54.58 50.72 3ktk n ASN 64 Cb 0.53 1.09 -0.12 0.00 -0.53 0.00 0.00 39.78 40.75 3ktk n ASN 64 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 3ktk s SER 65 N -0.47 0.66 0.00 1.20 0.15 -0.57 -3.56 113.70 111.10 3ktk s SER 65 Ca 0.32 -0.46 0.28 0.00 0.70 0.00 0.00 55.95 56.79 3ktk s SER 65 Cb 0.11 0.04 1.07 0.00 -1.71 0.00 0.00 66.02 65.53 3ktk s SER 65 CO -0.15 -0.18 1.76 -0.81 1.20 0.00 0.00 173.24 175.05 3ktk n PRO 66 N 1.74 0.92 0.00 5.44 -0.04 -1.26 -1.61 135.00 140.18 3ktk n PRO 66 Ca -0.21 -0.43 0.00 0.00 -0.04 0.00 0.00 63.50 62.82 3ktk n PRO 66 Cb 0.55 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 3ktk n PRO 66 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ktk n GLY 67 N 1.27 -0.81 0.00 0.55 0.00 -1.15 -4.20 105.19 100.85 3ktk n GLY 67 Ca 0.15 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.16 3ktk n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ktk n GLY 68 N 0.00 -0.56 3.75 -0.02 0.00 -1.26 0.60 105.19 107.71 3ktk n GLY 68 Ca 0.00 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 3ktk n GLY 68 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ktk s SER 69 N -4.00 6.43 0.06 1.61 0.15 0.24 -4.82 113.70 113.36 3ktk s SER 69 Ca 0.00 2.89 -0.20 0.00 0.70 0.00 0.00 55.95 59.34 3ktk s SER 69 Cb 0.00 -2.63 -0.12 0.00 -1.71 0.00 0.00 66.02 61.55 3ktk s SER 69 CO 0.00 -0.87 1.41 0.40 1.20 0.00 0.00 173.24 175.39 3ktk h ILE 70 N 3.41 1.31 0.00 6.45 2.04 -1.97 -1.74 117.51 127.01 3ktk h ILE 70 Ca -0.47 -1.14 -0.05 0.00 1.00 0.00 0.00 64.86 64.21 3ktk h ILE 70 Cb 1.22 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.97 3ktk h ILE 70 CO 0.78 0.34 -0.23 0.71 0.00 0.00 0.00 178.15 179.76 3ktk h THR 71 N 0.06 0.97 -0.21 -0.27 1.35 -1.99 -1.31 112.91 111.50 3ktk h THR 71 Ca 0.04 -0.84 -0.20 0.00 -0.55 0.00 0.00 66.41 64.86 3ktk h THR 71 Cb 0.57 1.48 0.01 0.00 -1.73 0.00 0.00 68.15 68.47 3ktk h THR 71 CO 0.03 0.22 -0.67 0.00 -0.25 0.00 0.00 175.52 174.85 3ktk h ALA 72 N 1.77 0.36 -0.46 6.62 0.00 -1.89 -2.40 119.26 123.27 3ktk h ALA 72 Ca -0.00 -0.56 -0.12 0.00 0.00 0.00 0.00 54.91 54.23 3ktk h ALA 72 Cb 0.46 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3ktk h ALA 72 CO 0.03 0.66 -0.18 0.78 0.00 0.00 0.00 179.25 180.54 3ktk h GLY 73 N 0.58 0.97 2.00 0.00 0.00 -0.87 -2.69 103.07 103.06 3ktk h GLY 73 Ca -0.02 -0.81 -0.07 0.00 0.00 0.00 0.00 47.33 46.42 3ktk h GLY 73 CO 0.14 0.74 -0.32 -0.33 0.00 0.00 0.00 176.54 176.78 3ktk h MET 74 N 0.78 0.00 -0.42 4.80 2.86 -1.25 0.23 114.93 121.93 3ktk h MET 74 Ca 0.11 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.70 3ktk h MET 74 Cb 0.72 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.37 3ktk h MET 74 CO 0.06 0.32 0.04 0.00 1.06 0.00 0.00 176.91 178.38 3ktk h ALA 75 N 1.68 0.56 -0.13 6.32 0.00 -1.11 0.26 119.26 126.84 3ktk h ALA 75 Ca -0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 3ktk h ALA 75 Cb 0.66 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 3ktk h ALA 75 CO 0.04 0.30 0.00 0.82 0.00 0.00 0.00 179.25 180.41 3ktk h ILE 76 N 0.55 1.25 0.02 0.00 2.04 -1.10 -2.50 117.51 117.78 3ktk h ILE 76 Ca 0.12 -0.82 0.02 0.00 1.00 0.00 0.00 64.86 65.19 3ktk h ILE 76 Cb 0.41 1.53 -0.03 0.00 -0.74 0.00 0.00 36.82 38.00 3ktk h ILE 76 CO 0.01 0.24 -0.17 0.22 0.00 0.00 0.00 178.15 178.45 3ktk h TYR 77 N -0.03 -0.45 -0.70 1.37 3.20 -0.37 -0.40 116.97 119.59 3ktk h TYR 77 Ca 0.04 0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.01 3ktk h TYR 77 Cb 0.36 0.20 -0.04 0.00 1.54 0.00 0.00 36.73 38.79 3ktk h TYR 77 CO 0.03 -0.25 0.46 -0.44 -1.64 0.00 0.00 178.16 176.32 3ktk h ASP 78 N -0.29 0.57 -0.07 -2.11 3.45 -0.48 -1.27 116.42 116.21 3ktk h ASP 78 Ca 0.05 0.01 -0.21 0.00 0.43 0.00 0.00 57.03 57.31 3ktk h ASP 78 Cb 0.35 -0.11 0.01 0.00 -0.56 0.00 0.00 39.33 39.02 3ktk h ASP 78 CO -0.15 0.35 -0.73 0.74 -1.57 0.00 0.00 179.24 177.88 3ktk h THR 79 N 0.64 1.30 -0.99 0.35 2.02 -0.93 -0.90 112.91 114.39 3ktk h THR 79 Ca 0.32 -1.97 0.07 0.00 0.77 0.00 0.00 66.41 65.59 3ktk h THR 79 Cb 0.40 1.95 -0.07 0.00 -1.74 0.00 0.00 68.15 68.70 3ktk h THR 79 CO -0.11 0.62 0.64 0.24 0.37 0.00 0.00 175.52 177.28 3ktk h MET 80 N 0.50 1.12 -0.12 6.66 2.86 0.02 -2.51 114.93 123.46 3ktk h MET 80 Ca -0.04 -0.07 -0.23 0.00 -2.06 0.00 0.00 59.70 57.31 3ktk h MET 80 Cb 1.34 -0.25 0.01 0.00 0.06 0.00 0.00 31.60 32.76 3ktk h MET 80 CO 0.15 0.74 -0.80 1.96 1.06 0.00 0.00 176.91 180.01 3ktk h GLN 81 N 1.15 0.76 -0.02 1.72 1.08 -1.18 -3.35 115.11 115.26 3ktk h GLN 81 Ca 0.43 -0.65 -0.00 0.00 -1.45 0.00 0.00 58.65 56.98 3ktk h GLN 81 Cb 0.19 0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 27.76 3ktk h GLN 81 CO -0.18 1.26 0.01 0.35 -0.95 0.00 0.00 178.83 179.32 3ktk h PHE 82 N 0.48 0.03 -4.16 2.96 3.57 -0.75 -3.44 116.94 115.62 3ktk h PHE 82 Ca -0.07 -0.00 -0.52 0.00 3.53 0.00 0.00 57.97 60.91 3ktk h PHE 82 Cb 1.44 -0.01 0.13 0.00 2.79 0.00 0.00 35.95 40.30 3ktk h PHE 82 CO 0.09 0.09 0.40 0.96 -2.23 0.00 0.00 178.31 177.63 3ktk s ILE 83 N -5.90 2.72 0.00 1.41 -4.36 -0.99 -4.97 121.20 109.10 3ktk s ILE 83 Ca -0.13 0.37 -0.22 0.00 -0.26 0.00 0.00 60.65 60.40 3ktk s ILE 83 Cb 0.06 -2.96 -0.18 0.00 1.25 0.00 0.00 42.46 40.62 3ktk s ILE 83 CO 0.67 -0.17 1.24 0.11 0.24 0.00 0.00 174.94 177.03 3ktk h LYS 84 N 0.14 0.25 -6.56 0.37 6.56 -1.86 -3.45 116.57 112.01 3ktk h LYS 84 Ca -0.48 -0.16 -0.59 0.00 -1.06 0.00 0.00 60.65 58.35 3ktk h LYS 84 Cb 1.28 0.02 0.12 0.00 -0.57 0.00 0.00 32.23 33.08 3ktk h LYS 84 CO 0.53 0.76 0.14 -2.30 -2.06 0.00 0.00 179.45 176.51 3ktk n PRO 85 N -4.58 1.37 -2.79 3.15 -0.02 -1.19 -4.91 135.00 126.02 3ktk n PRO 85 Ca -0.08 0.49 -0.41 0.00 -2.02 0.00 0.00 63.50 61.48 3ktk n PRO 85 Cb 0.39 -1.95 -0.04 0.00 -0.02 0.00 0.00 33.50 31.88 3ktk n PRO 85 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3ktk s LYS 86 N -1.79 4.59 -0.32 -0.52 1.02 -1.26 -4.84 119.74 116.61 3ktk s LYS 86 Ca 0.61 1.32 -0.11 0.00 0.02 0.00 0.00 55.97 57.81 3ktk s LYS 86 Cb -0.62 -3.42 -0.02 0.00 -0.52 0.00 0.00 37.83 33.26 3ktk s LYS 86 CO 0.59 0.10 0.20 0.08 -0.92 0.00 0.00 175.35 175.39 3ktk s VAL 87 N 0.49 5.00 0.08 3.17 1.01 -1.26 -1.57 120.40 127.31 3ktk s VAL 87 Ca 0.47 -0.24 -0.07 0.00 0.00 0.00 0.00 61.98 62.13 3ktk s VAL 87 Cb -0.21 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.58 3ktk s VAL 87 CO 0.27 0.06 0.36 -0.94 0.00 0.00 0.00 175.10 174.85 3ktk s SER 88 N 1.68 6.55 -0.04 3.32 1.04 0.10 -0.14 113.70 126.22 3ktk s SER 88 Ca 0.06 0.66 0.07 0.00 0.48 0.00 0.00 55.95 57.22 3ktk s SER 88 Cb -0.17 -2.13 -0.02 0.00 0.10 0.00 0.00 66.02 63.81 3ktk s SER 88 CO 0.09 0.16 -0.25 0.42 0.98 0.00 0.00 173.24 174.64 3ktk s THR 89 N -1.45 1.99 -0.17 2.02 -4.23 -0.89 -0.27 115.64 112.65 3ktk s THR 89 Ca 0.34 -1.06 0.01 0.00 -1.18 0.00 0.00 61.69 59.80 3ktk s THR 89 Cb -0.13 -1.67 0.03 0.00 1.34 0.00 0.00 72.50 72.07 3ktk s THR 89 CO 0.20 0.56 -0.14 -0.63 -0.54 0.00 0.00 174.62 174.07 3ktk s ILE 90 N -0.40 1.65 -0.33 2.99 1.09 -0.87 0.28 121.20 125.61 3ktk s ILE 90 Ca 0.04 -0.79 -0.23 0.00 -1.10 0.00 0.00 60.65 58.57 3ktk s ILE 90 Cb -0.11 -1.60 0.00 0.00 -1.06 0.00 0.00 42.46 39.70 3ktk s ILE 90 CO 0.01 0.37 0.79 0.00 -0.10 0.00 0.00 174.94 176.02 3ktk s ILE 92 N 3.05 1.95 0.00 0.00 2.07 0.60 -2.47 121.20 126.40 3ktk s ILE 92 Ca 0.32 -0.93 0.00 0.00 -1.41 0.00 0.00 60.65 58.64 3ktk s ILE 92 Cb -0.14 -1.80 0.00 0.00 0.13 0.00 0.00 42.46 40.65 3ktk s ILE 92 CO 0.15 0.47 0.00 0.61 -1.91 0.00 0.00 174.94 174.26 3ktk n GLY 93 N 4.64 1.46 2.93 1.50 0.00 -1.26 -4.06 105.19 110.39 3ktk n GLY 93 Ca -0.19 -0.42 -0.14 0.00 0.00 0.00 0.00 46.02 45.26 3ktk n GLY 93 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3ktk s MET 94 N 0.00 0.28 -0.38 1.61 -2.45 -1.26 -1.38 119.30 115.71 3ktk s MET 94 Ca 0.00 -0.12 0.01 0.00 -1.25 0.00 0.00 55.69 54.33 3ktk s MET 94 Cb 0.00 -0.27 0.12 0.00 1.25 0.00 0.00 34.83 35.94 3ktk s MET 94 CO 0.00 0.07 0.18 0.00 1.05 0.00 0.00 175.02 176.32 3ktk s ALA 95 N -0.07 1.88 0.20 4.11 0.00 0.27 -1.52 121.76 126.62 3ktk s ALA 95 Ca 0.01 -2.22 0.09 0.00 0.00 0.00 0.00 51.96 49.84 3ktk s ALA 95 Cb -0.01 -1.78 -0.04 0.00 0.00 0.00 0.00 23.12 21.28 3ktk s ALA 95 CO -0.00 -1.92 -0.08 0.00 0.00 0.00 0.00 175.76 173.76 3ktk s ALA 96 N 0.86 2.97 0.00 0.00 0.00 -0.63 -1.30 121.76 123.66 3ktk s ALA 96 Ca 0.15 -1.52 0.00 0.00 0.00 0.00 0.00 51.96 50.59 3ktk s ALA 96 Cb -0.22 -0.72 0.00 0.00 0.00 0.00 0.00 23.12 22.18 3ktk s ALA 96 CO -0.09 0.42 0.00 0.45 0.00 0.00 0.00 175.76 176.55 3ktk n SER 97 N -0.15 0.00 0.33 0.00 2.88 0.09 -0.99 113.62 115.78 3ktk n SER 97 Ca -0.10 0.00 0.22 0.00 -1.33 0.00 0.00 58.87 57.66 3ktk n SER 97 Cb 0.56 0.00 1.18 0.00 -0.75 0.00 0.00 64.21 65.21 3ktk n SER 97 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 3ktk h MET 98 N 0.00 0.00 -0.41 -1.46 1.85 -1.88 0.13 114.93 113.16 3ktk h MET 98 Ca 0.00 0.00 -0.15 0.00 -0.61 0.00 0.00 59.70 58.94 3ktk h MET 98 Cb 0.00 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.02 3ktk h MET 98 CO 0.00 0.00 -0.34 0.78 -0.40 0.00 0.00 176.91 176.95 3ktk h GLY 99 N 0.01 1.03 1.18 1.39 0.00 -1.34 -0.00 103.07 105.33 3ktk h GLY 99 Ca -0.00 -1.02 -0.11 0.00 0.00 0.00 0.00 47.33 46.20 3ktk h GLY 99 CO 0.00 0.92 -0.10 0.00 0.00 0.00 0.00 176.54 177.36 3ktk h ALA 100 N 0.79 0.84 -0.23 3.60 0.00 -0.74 -1.01 119.26 122.52 3ktk h ALA 100 Ca 0.07 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.66 3ktk h ALA 100 Cb 0.93 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 3ktk h ALA 100 CO 0.09 0.65 0.11 0.35 0.00 0.00 0.00 179.25 180.45 3ktk h PHE 101 N 0.86 0.20 -0.68 0.00 3.57 -0.94 -0.42 116.94 119.54 3ktk h PHE 101 Ca 0.14 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.61 3ktk h PHE 101 Cb 0.64 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.29 3ktk h PHE 101 CO 0.04 0.11 0.28 -0.07 -2.23 0.00 0.00 178.31 176.44 3ktk h LEU 102 N 0.24 0.90 -0.07 0.59 3.38 -0.74 -0.85 115.31 118.76 3ktk h LEU 102 Ca 0.09 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3ktk h LEU 102 Cb 0.03 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 3ktk h LEU 102 CO -0.07 0.80 0.05 0.25 0.09 0.00 0.00 178.44 179.56 3ktk h LEU 103 N 0.97 0.08 -2.38 1.67 5.85 -0.47 -0.86 115.31 120.17 3ktk h LEU 103 Ca 0.23 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 3ktk h LEU 103 Cb 0.17 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 3ktk h LEU 103 CO -0.02 0.06 -0.03 0.00 -0.34 0.00 0.00 178.44 178.10 3ktk h ALA 104 N 1.03 1.33 0.00 1.25 0.00 -0.55 -1.81 119.26 120.50 3ktk h ALA 104 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3ktk h ALA 104 Cb -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3ktk h ALA 104 CO -0.01 0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.29 3ktk n ALA 105 N -2.25 2.19 -0.73 0.00 0.00 -0.34 -4.87 120.51 114.50 3ktk n ALA 105 Ca -0.03 -0.09 -0.32 0.00 0.00 0.00 0.00 53.44 53.01 3ktk n ALA 105 Cb 0.13 -1.42 0.16 0.00 0.00 0.00 0.00 19.45 18.32 3ktk n ALA 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ktk n GLY 106 N 1.18 -0.71 3.67 0.00 0.00 -0.68 -4.83 105.19 103.82 3ktk n GLY 106 Ca 0.06 -0.71 -0.52 0.00 0.00 0.00 0.00 46.02 44.85 3ktk n GLY 106 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3ktk n GLU 107 N -3.64 1.54 -1.66 1.61 4.07 0.80 -4.81 120.64 118.55 3ktk n GLU 107 Ca 0.11 0.56 -0.53 0.00 -0.06 0.00 0.00 57.16 57.25 3ktk n GLU 107 Cb 0.52 -2.29 -0.06 0.00 -0.06 0.00 0.00 31.44 29.56 3ktk n GLU 107 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 3ktk n LYS 108 N 4.70 1.48 0.00 5.31 3.00 -1.26 -0.13 118.16 131.25 3ktk n LYS 108 Ca 0.22 0.54 0.00 0.00 -0.00 0.00 0.00 58.31 59.07 3ktk n LYS 108 Cb 0.21 -2.25 0.00 0.00 0.00 0.00 0.00 35.03 32.98 3ktk n LYS 108 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3ktk n GLY 109 N 3.63 2.32 2.14 3.14 0.00 -1.26 -4.91 105.19 110.24 3ktk n GLY 109 Ca 0.22 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.02 3ktk n GLY 109 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ktk n LYS 110 N -2.00 3.41 -3.90 1.61 5.02 0.81 -4.86 118.16 118.26 3ktk n LYS 110 Ca 0.00 -4.13 -0.35 0.00 -2.02 0.00 0.00 58.31 51.80 3ktk n LYS 110 Cb 0.00 -2.21 -0.14 0.00 -0.02 0.00 0.00 35.03 32.66 3ktk n LYS 110 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3ktk s ARG 111 N -3.61 2.67 0.41 1.97 0.52 -1.25 -2.09 118.95 117.57 3ktk s ARG 111 Ca 0.48 -1.10 0.07 0.00 -0.52 0.00 0.00 55.73 54.66 3ktk s ARG 111 Cb 0.40 -3.15 -0.05 0.00 0.52 0.00 0.00 34.95 32.67 3ktk s ARG 111 CO 0.01 -0.52 0.17 0.71 0.02 0.00 0.00 175.30 175.69 3ktk s TYR 112 N 1.32 2.60 -0.08 -0.53 1.51 0.14 0.24 117.35 122.55 3ktk s TYR 112 Ca -0.02 -0.59 -0.26 0.00 -1.01 0.00 0.00 57.07 55.19 3ktk s TYR 112 Cb -0.18 -1.94 0.06 0.00 -0.11 0.00 0.00 41.96 39.79 3ktk s TYR 112 CO -0.02 0.21 0.59 0.00 -1.11 0.00 0.00 175.55 175.22 3ktk s ALA 113 N -2.60 -1.51 0.46 3.71 0.00 -1.10 -0.83 121.76 119.88 3ktk s ALA 113 Ca 0.41 1.20 -0.11 0.00 0.00 0.00 0.00 51.96 53.46 3ktk s ALA 113 Cb 0.04 -0.20 -0.06 0.00 0.00 0.00 0.00 23.12 22.91 3ktk s ALA 113 CO 0.22 -0.33 0.84 -0.51 0.00 0.00 0.00 175.76 175.98 3ktk s LEU 114 N -0.90 3.69 0.27 0.00 1.43 -1.03 -1.36 118.68 120.78 3ktk s LEU 114 Ca -0.09 1.21 0.01 0.00 -1.03 0.00 0.00 54.13 54.23 3ktk s LEU 114 Cb -0.02 -4.14 0.65 0.00 0.03 0.00 0.00 46.19 42.71 3ktk s LEU 114 CO 0.07 -0.52 1.39 -2.65 0.23 0.00 0.00 176.35 174.87 3ktk n PRO 115 N -1.67 -0.07 -0.75 1.29 -0.02 -1.25 -0.71 135.00 131.82 3ktk n PRO 115 Ca 0.03 1.34 0.03 0.00 -2.02 0.00 0.00 63.50 62.88 3ktk n PRO 115 Cb 0.54 -2.11 0.30 0.00 -0.02 0.00 0.00 33.50 32.21 3ktk n PRO 115 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3ktk n ASN 116 N -5.31 4.42 -4.71 2.55 4.13 -1.26 -4.44 115.26 110.63 3ktk n ASN 116 Ca 0.20 -3.15 -0.31 0.00 1.68 0.00 0.00 54.58 53.01 3ktk n ASN 116 Cb 0.66 -0.64 0.13 0.00 -1.54 0.00 0.00 39.78 38.39 3ktk n ASN 116 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 3ktk s SER 117 N -1.50 3.59 -0.04 6.41 0.01 0.12 -4.84 113.70 117.44 3ktk s SER 117 Ca 0.49 1.89 0.02 0.00 1.31 0.00 0.00 55.95 59.67 3ktk s SER 117 Cb 0.39 -2.48 0.01 0.00 0.21 0.00 0.00 66.02 64.15 3ktk s SER 117 CO 0.11 -2.63 -0.10 -0.70 0.41 0.00 0.00 173.24 170.33 3ktk s GLU 118 N -4.79 1.20 -0.11 12.44 2.12 -0.48 -3.45 118.70 125.63 3ktk s GLU 118 Ca 0.64 -0.34 0.02 0.00 0.36 0.00 0.00 54.97 55.65 3ktk s GLU 118 Cb -0.20 -1.07 0.01 0.00 0.26 0.00 0.00 34.13 33.13 3ktk s GLU 118 CO 0.57 0.08 -0.15 0.08 -0.54 0.00 0.00 175.26 175.31 3ktk s VAL 119 N 0.37 1.47 -0.10 3.70 1.01 -0.16 -0.57 120.40 126.13 3ktk s VAL 119 Ca -0.07 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.30 3ktk s VAL 119 Cb -0.11 -1.35 0.02 0.00 0.00 0.00 0.00 36.38 34.93 3ktk s VAL 119 CO 0.01 0.44 -0.13 -0.32 0.00 0.00 0.00 175.10 175.10 3ktk s MET 120 N 1.00 1.97 0.02 2.72 0.00 -0.42 0.51 119.30 125.10 3ktk s MET 120 Ca -0.06 -0.47 0.06 0.00 0.00 0.00 0.00 55.69 55.22 3ktk s MET 120 Cb -0.15 -1.72 -0.03 0.00 0.00 0.00 0.00 34.83 32.93 3ktk s MET 120 CO -0.02 -0.08 -0.17 0.96 0.00 0.00 0.00 175.02 175.71 3ktk s ILE 121 N 1.03 2.82 0.23 10.11 -4.36 -0.92 -0.73 121.20 129.38 3ktk s ILE 121 Ca -0.06 -1.07 -0.09 0.00 -0.26 0.00 0.00 60.65 59.17 3ktk s ILE 121 Cb -0.15 -2.16 0.03 0.00 1.25 0.00 0.00 42.46 41.44 3ktk s ILE 121 CO -0.02 0.41 0.46 0.00 0.24 0.00 0.00 174.94 176.03 3ktk n HIS 122 N 1.77 -1.79 -2.99 1.37 1.44 -1.26 -1.89 115.22 111.87 3ktk n HIS 122 Ca -0.16 -1.08 -0.25 0.00 -2.01 0.00 0.00 57.72 54.22 3ktk n HIS 122 Cb 0.52 0.54 0.00 0.00 0.12 0.00 0.00 29.99 31.17 3ktk n HIS 122 CO 0.00 0.00 0.00 1.14 -2.81 0.00 0.00 176.34 174.67 3ktk s GLN 123 N -2.05 3.34 0.68 -1.40 -2.07 -0.45 -4.94 119.66 112.77 3ktk s GLN 123 Ca 0.09 -0.20 -0.17 0.00 -1.82 0.00 0.00 55.36 53.26 3ktk s GLN 123 Cb -0.03 -2.52 -0.00 0.00 -1.09 0.00 0.00 33.01 29.37 3ktk s GLN 123 CO 0.07 -0.13 1.13 -2.30 -1.32 0.00 0.00 175.29 172.73 3ktk n PRO 124 N -2.06 0.78 -4.79 9.60 -0.02 -1.26 -5.04 135.00 132.21 3ktk n PRO 124 Ca -0.01 0.32 -0.31 0.00 -2.02 0.00 0.00 63.50 61.49 3ktk n PRO 124 Cb 0.56 -2.36 -0.13 0.00 -0.02 0.00 0.00 33.50 31.55 3ktk n PRO 124 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3ktk s LEU 125 N -3.71 2.48 0.00 2.45 1.43 -1.26 -5.10 118.68 114.97 3ktk s LEU 125 Ca 0.78 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 53.43 3ktk s LEU 125 Cb -0.37 -1.45 0.00 0.00 0.03 0.00 0.00 46.19 44.40 3ktk s LEU 125 CO 0.45 0.27 0.00 0.61 0.23 0.00 0.00 176.35 177.91 3ktk n GLY 126 N 1.74 2.24 3.41 -3.19 0.00 -1.26 -5.06 105.19 103.07 3ktk n GLY 126 Ca -0.16 -0.81 -0.13 0.00 0.00 0.00 0.00 46.02 44.92 3ktk n GLY 126 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ktk s GLY 127 N -0.62 -0.51 -0.10 -0.02 0.00 -1.26 -5.17 107.32 99.65 3ktk s GLY 127 Ca 0.00 0.50 -0.07 0.00 0.00 0.00 0.00 44.72 45.15 3ktk s GLY 127 CO 0.00 0.19 0.25 0.00 0.00 0.00 0.00 173.10 173.53 3ktk s ALA 128 N -3.22 -0.59 0.04 3.20 0.00 -1.26 -4.97 121.76 114.96 3ktk s ALA 128 Ca -0.01 0.85 0.02 0.00 0.00 0.00 0.00 51.96 52.82 3ktk s ALA 128 Cb -0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 23.12 22.57 3ktk s ALA 128 CO -0.08 -0.16 -0.07 -1.14 0.00 0.00 0.00 175.76 174.32 3ktk s GLN 129 N 0.68 0.50 0.00 0.00 2.00 -1.26 -4.98 119.66 116.60 3ktk s GLN 129 Ca -0.05 -0.76 0.00 0.00 -2.00 0.00 0.00 55.36 52.56 3ktk s GLN 129 Cb -0.06 -0.20 0.00 0.00 0.80 0.00 0.00 33.01 33.55 3ktk s GLN 129 CO -0.04 0.03 0.00 0.41 -0.50 0.00 0.00 175.29 175.18 3ktk n GLY 130 N 1.42 0.12 3.75 2.59 0.00 -1.26 -4.60 105.19 107.21 3ktk n GLY 130 Ca -0.23 -1.86 -0.35 0.00 0.00 0.00 0.00 46.02 43.58 3ktk n GLY 130 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ktk s GLN 131 N 0.00 2.88 0.27 1.61 -0.21 -1.26 -4.77 119.66 118.18 3ktk s GLN 131 Ca 0.00 1.75 0.01 0.00 0.02 0.00 0.00 55.36 57.14 3ktk s GLN 131 Cb 0.00 -1.93 0.60 0.00 1.00 0.00 0.00 33.01 32.69 3ktk s GLN 131 CO 0.00 -1.26 1.73 0.00 -2.12 0.00 0.00 175.29 173.64 3ktk h ALA 132 N 0.67 1.31 -0.96 6.09 0.00 -1.99 0.15 119.26 124.53 3ktk h ALA 132 Ca -0.50 0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.56 3ktk h ALA 132 Cb 1.29 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 19.10 3ktk h ALA 132 CO 0.54 -0.22 0.63 1.15 0.00 0.00 0.00 179.25 181.36 3ktk h THR 133 N 0.50 1.19 -0.21 0.00 2.02 -1.99 0.23 112.91 114.64 3ktk h THR 133 Ca 0.50 -0.43 -0.19 0.00 0.77 0.00 0.00 66.41 67.06 3ktk h THR 133 Cb 0.82 -0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 3ktk h THR 133 CO -0.44 0.23 -0.61 -0.33 0.37 0.00 0.00 175.52 174.74 3ktk h GLU 134 N 1.24 0.73 -0.50 6.66 5.08 -1.14 -1.97 114.58 124.67 3ktk h GLU 134 Ca 0.37 -0.49 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 3ktk h GLU 134 Cb -0.05 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 3ktk h GLU 134 CO -0.11 1.12 0.10 0.82 -1.00 0.00 0.00 179.01 179.94 3ktk h ILE 135 N 0.54 1.22 -0.60 3.13 2.04 -0.59 -2.08 117.51 121.17 3ktk h ILE 135 Ca -0.00 -0.83 -0.09 0.00 1.00 0.00 0.00 64.86 64.94 3ktk h ILE 135 Cb 1.20 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 3ktk h ILE 135 CO 0.12 0.30 0.03 -0.08 0.00 0.00 0.00 178.15 178.53 3ktk h GLU 136 N 0.75 1.04 -0.18 2.37 4.81 -0.78 0.20 114.58 122.79 3ktk h GLU 136 Ca 0.16 -0.31 0.02 0.00 -0.13 0.00 0.00 59.36 59.10 3ktk h GLU 136 Cb 0.31 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 3ktk h GLU 136 CO 0.00 1.01 0.04 0.82 -0.73 0.00 0.00 179.01 180.15 3ktk h ILE 137 N 0.94 0.93 -0.58 2.32 1.08 -0.86 -1.15 117.51 120.19 3ktk h ILE 137 Ca 0.17 -0.04 -0.06 0.00 -0.39 0.00 0.00 64.86 64.55 3ktk h ILE 137 Cb 0.51 0.80 -0.02 0.00 -3.07 0.00 0.00 36.82 35.04 3ktk h ILE 137 CO 0.02 0.02 0.15 0.00 -0.69 0.00 0.00 178.15 177.65 3ktk h ALA 138 N 1.13 0.76 -0.13 1.87 0.00 -1.17 -2.59 119.26 119.13 3ktk h ALA 138 Ca 0.08 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.79 3ktk h ALA 138 Cb 0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3ktk h ALA 138 CO -0.10 0.46 0.01 0.00 0.00 0.00 0.00 179.25 179.62 3ktk h ALA 139 N 1.03 0.12 -0.77 0.00 0.00 -0.61 -1.52 119.26 117.51 3ktk h ALA 139 Ca 0.18 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 3ktk h ALA 139 Cb 0.34 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 3ktk h ALA 139 CO 0.00 -0.44 0.42 0.87 0.00 0.00 0.00 179.25 180.09 3ktk h LYS 140 N 0.06 1.07 0.53 0.00 1.57 -1.16 -1.06 116.57 117.58 3ktk h LYS 140 Ca 0.06 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 3ktk h LYS 140 Cb 0.07 -0.21 0.01 0.00 0.08 0.00 0.00 32.23 32.17 3ktk h LYS 140 CO -0.09 0.79 -0.26 -0.09 -0.57 0.00 0.00 179.45 179.23 3ktk h ARG 141 N 1.08 -0.69 -0.53 3.15 2.43 -1.07 0.03 114.38 118.77 3ktk h ARG 141 Ca 0.27 0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.45 3ktk h ARG 141 Cb 0.03 0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 3ktk h ARG 141 CO -0.04 -0.39 0.16 0.97 -1.51 0.00 0.00 179.97 179.15 3ktk h ILE 142 N -0.90 1.21 -0.43 1.20 2.10 -1.21 0.07 117.51 119.55 3ktk h ILE 142 Ca -0.07 -0.73 -0.10 0.00 1.08 0.00 0.00 64.86 65.03 3ktk h ILE 142 Cb 0.61 0.63 -0.02 0.00 -1.09 0.00 0.00 36.82 36.96 3ktk h ILE 142 CO 0.12 0.28 -0.15 -0.07 -1.08 0.00 0.00 178.15 177.25 3ktk h LEU 143 N 0.78 0.80 -0.76 2.19 3.38 -1.17 -0.19 115.31 120.34 3ktk h LEU 143 Ca 0.18 -0.26 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 3ktk h LEU 143 Cb 0.24 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3ktk h LEU 143 CO -0.01 0.96 0.07 -0.07 0.09 0.00 0.00 178.44 179.48 3ktk h LEU 144 N 0.72 0.97 -0.67 1.67 3.38 -0.17 -2.65 115.31 118.56 3ktk h LEU 144 Ca 0.11 -0.24 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 3ktk h LEU 144 Cb 0.65 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 3ktk h LEU 144 CO 0.05 0.99 -0.15 -0.07 0.09 0.00 0.00 178.44 179.34 3ktk h LEU 145 N 0.94 0.88 -1.09 1.67 3.38 -0.57 -1.81 115.31 118.71 3ktk h LEU 145 Ca 0.18 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.87 3ktk h LEU 145 Cb 0.46 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 3ktk h LEU 145 CO 0.02 1.03 0.62 -0.09 0.09 0.00 0.00 178.44 180.10 3ktk h ARG 146 N 0.78 1.23 -0.07 1.13 2.43 -0.83 -0.64 114.38 118.40 3ktk h ARG 146 Ca 0.12 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 3ktk h ARG 146 Cb 0.68 -0.28 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 3ktk h ARG 146 CO 0.05 0.81 -0.04 -0.44 -1.51 0.00 0.00 179.97 178.84 3ktk h ASP 147 N 1.26 0.17 -0.65 -3.80 5.19 -1.22 -0.49 116.42 116.89 3ktk h ASP 147 Ca 0.34 -0.43 0.05 0.00 -0.62 0.00 0.00 57.03 56.37 3ktk h ASP 147 Cb -0.15 -0.05 -0.05 0.00 0.18 0.00 0.00 39.33 39.26 3ktk h ASP 147 CO -0.07 0.56 0.36 0.50 -3.12 0.00 0.00 179.24 177.47 3ktk h LYS 148 N -0.23 0.66 -0.07 3.56 3.64 -1.06 0.16 116.57 123.23 3ktk h LYS 148 Ca 0.02 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 3ktk h LYS 148 Cb 0.50 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.17 3ktk h LYS 148 CO 0.01 0.44 -0.02 -0.07 -2.27 0.00 0.00 179.45 177.54 3ktk h LEU 149 N 0.68 0.14 -1.03 5.20 3.38 -1.10 -2.84 115.31 119.74 3ktk h LEU 149 Ca 0.28 -0.39 0.06 0.00 0.09 0.00 0.00 57.88 57.92 3ktk h LEU 149 Cb 0.15 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 40.80 3ktk h LEU 149 CO -0.17 0.50 0.64 0.78 0.09 0.00 0.00 178.44 180.28 3ktk h ASN 150 N -0.21 1.04 -0.33 -0.43 2.35 -0.75 -0.55 115.58 116.70 3ktk h ASN 150 Ca 0.02 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.76 3ktk h ASN 150 Cb 0.44 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 3ktk h ASN 150 CO 0.01 0.68 0.16 0.11 -1.65 0.00 0.00 177.43 176.74 3ktk h LYS 151 N 1.18 0.48 -0.53 0.81 1.57 -0.94 -0.23 116.57 118.92 3ktk h LYS 151 Ca 0.42 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 59.09 3ktk h LYS 151 Cb 0.12 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 3ktk h LYS 151 CO -0.15 0.44 0.18 0.28 -0.57 0.00 0.00 179.45 179.62 3ktk h VAL 152 N 0.41 1.23 -0.74 0.50 2.07 -1.17 -1.49 116.25 117.05 3ktk h VAL 152 Ca 0.12 -0.75 0.06 0.00 0.82 0.00 0.00 66.70 66.95 3ktk h VAL 152 Cb 0.11 0.73 -0.06 0.00 -1.52 0.00 0.00 31.29 30.55 3ktk h VAL 152 CO -0.02 0.28 0.44 -0.07 0.02 0.00 0.00 177.57 178.22 3ktk h LEU 153 N 0.72 0.68 -0.47 2.57 3.38 -0.85 0.61 115.31 121.94 3ktk h LEU 153 Ca 0.17 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.17 3ktk h LEU 153 Cb 0.25 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3ktk h LEU 153 CO -0.01 0.44 0.31 0.00 0.09 0.00 0.00 178.44 179.27 3ktk h ALA 154 N 1.36 0.60 -0.36 1.53 0.00 -0.51 0.92 119.26 122.81 3ktk h ALA 154 Ca 0.32 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 3ktk h ALA 154 Cb 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3ktk h ALA 154 CO -0.17 0.05 0.13 0.93 0.00 0.00 0.00 179.25 180.18 3ktk h GLU 155 N 0.64 0.54 0.00 0.00 5.08 -0.49 0.10 114.58 120.45 3ktk h GLU 155 Ca 0.17 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 3ktk h GLU 155 Cb -0.07 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 3ktk h GLU 155 CO -0.04 0.55 -0.40 0.00 -1.00 0.00 0.00 179.01 178.12 3ktk h ARG 156 N 0.43 0.00 0.03 2.33 2.47 -0.63 -3.31 114.38 115.70 3ktk h ARG 156 Ca 0.12 0.00 -0.37 0.00 -1.26 0.00 0.00 59.98 58.46 3ktk h ARG 156 Cb 0.22 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 28.49 3ktk h ARG 156 CO -0.01 0.40 -2.29 0.25 0.56 0.00 0.00 179.97 178.88 3ktk n THR 157 N -4.05 1.56 0.00 2.04 -2.24 0.30 -4.84 114.28 107.05 3ktk n THR 157 Ca -0.02 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.11 3ktk n THR 157 Cb 0.43 -1.34 0.00 0.00 -2.10 0.00 0.00 70.33 67.32 3ktk n THR 157 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ktk n GLY 158 N 2.08 0.66 3.77 3.38 0.00 0.35 -4.56 105.19 110.87 3ktk n GLY 158 Ca -0.39 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.26 3ktk n GLY 158 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ktk s GLN 159 N -0.69 4.00 0.61 1.61 -1.52 -1.21 -4.99 119.66 117.47 3ktk s GLN 159 Ca 0.00 1.73 -0.16 0.00 -1.95 0.00 0.00 55.36 54.98 3ktk s GLN 159 Cb 0.00 -2.56 -0.02 0.00 -0.22 0.00 0.00 33.01 30.20 3ktk s GLN 159 CO 0.00 -0.34 1.09 -1.25 -0.25 0.00 0.00 175.29 174.54 3ktk s PRO 160 N -2.47 3.10 0.22 2.91 0.04 -1.26 -4.52 135.00 133.02 3ktk s PRO 160 Ca 0.59 1.34 -0.09 0.00 0.04 0.00 0.00 61.00 62.88 3ktk s PRO 160 Cb -0.28 -1.99 0.32 0.00 0.04 0.00 0.00 34.50 32.59 3ktk s PRO 160 CO 0.34 -1.00 1.70 1.25 0.04 0.00 0.00 177.00 179.34 3ktk h LEU 161 N 0.38 0.02 -1.29 -3.56 5.85 -1.92 0.20 115.31 114.99 3ktk h LEU 161 Ca -0.47 0.12 0.15 0.00 0.84 0.00 0.00 57.88 58.51 3ktk h LEU 161 Cb 1.24 0.15 -0.07 0.00 0.37 0.00 0.00 40.66 42.35 3ktk h LEU 161 CO 0.56 0.01 0.58 -0.08 -0.34 0.00 0.00 178.44 179.17 3ktk h GLU 162 N 0.27 0.67 -0.21 1.25 4.57 -1.98 0.11 114.58 119.26 3ktk h GLU 162 Ca 0.33 -0.04 -0.08 0.00 -1.18 0.00 0.00 59.36 58.39 3ktk h GLU 162 Cb 0.50 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.94 3ktk h GLU 162 CO -0.42 0.44 -0.17 0.28 -1.18 0.00 0.00 179.01 177.96 3ktk h VAL 163 N 0.69 1.32 -0.43 0.32 2.07 -1.33 -2.42 116.25 116.47 3ktk h VAL 163 Ca 0.45 -1.31 -0.00 0.00 0.82 0.00 0.00 66.70 66.66 3ktk h VAL 163 Cb 0.73 1.72 -0.02 0.00 -1.52 0.00 0.00 31.29 32.20 3ktk h VAL 163 CO -0.21 0.40 0.26 0.40 0.02 0.00 0.00 177.57 178.44 3ktk h ILE 164 N 0.16 1.14 -0.58 4.57 1.08 -0.67 -0.21 117.51 123.01 3ktk h ILE 164 Ca 0.04 -0.34 0.07 0.00 -0.39 0.00 0.00 64.86 64.24 3ktk h ILE 164 Cb 0.70 0.58 -0.06 0.00 -3.07 0.00 0.00 36.82 34.98 3ktk h ILE 164 CO 0.04 0.15 0.28 -0.33 -0.69 0.00 0.00 178.15 177.60 3ktk h GLU 165 N 0.57 0.50 0.02 2.37 5.08 -0.81 -1.32 114.58 121.00 3ktk h GLU 165 Ca 0.15 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3ktk h GLU 165 Cb 0.01 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.15 3ktk h GLU 165 CO -0.03 0.33 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.21 3ktk h ARG 166 N 0.52 -0.03 0.00 2.33 2.43 -1.14 -3.10 114.38 115.39 3ktk h ARG 166 Ca 0.27 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 3ktk h ARG 166 Cb 0.23 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 3ktk h ARG 166 CO -0.21 0.37 0.00 -0.44 -1.51 0.00 0.00 179.97 178.18 3ktk h ASP 167 N -0.43 0.00 -0.35 -3.80 5.19 -0.83 -2.75 116.42 113.45 3ktk h ASP 167 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3ktk h ASP 167 Cb 0.41 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.92 3ktk h ASP 167 CO 0.00 0.00 0.00 0.35 -3.12 0.00 0.00 179.24 176.47 3ktk n THR 168 N -2.72 0.55 -0.31 0.35 -2.24 -0.52 -4.48 114.28 104.91 3ktk n THR 168 Ca 0.00 -0.78 0.04 0.00 -2.27 0.00 0.00 64.05 61.04 3ktk n THR 168 Cb 0.21 0.90 0.23 0.00 -2.10 0.00 0.00 70.33 69.57 3ktk n THR 168 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 3ktk h ASP 169 N 3.68 0.93 -4.31 3.42 -0.00 -1.41 -1.19 116.42 117.55 3ktk h ASP 169 Ca 0.00 0.01 -0.30 0.00 -0.00 0.00 0.00 57.03 56.73 3ktk h ASP 169 Cb 0.87 -0.19 -0.15 0.00 -0.00 0.00 0.00 39.33 39.86 3ktk h ASP 169 CO 0.00 0.60 -0.68 -0.13 -0.00 0.00 0.00 179.24 179.03 3ktk s ARG 170 N -5.92 1.10 -0.28 0.28 0.52 -1.26 -4.67 118.95 108.71 3ktk s ARG 170 Ca -0.12 -1.51 -0.39 0.00 -0.52 0.00 0.00 55.73 53.19 3ktk s ARG 170 Cb 0.20 -0.39 -0.15 0.00 0.52 0.00 0.00 34.95 35.13 3ktk s ARG 170 CO 0.80 -0.07 1.83 -0.25 0.02 0.00 0.00 175.30 177.63 3ktk n ASP 171 N -0.23 2.42 -4.07 0.23 9.92 -1.26 -4.69 116.55 118.86 3ktk n ASP 171 Ca -0.08 0.97 -0.34 0.00 -0.53 0.00 0.00 54.79 54.81 3ktk n ASP 171 Cb 0.62 -1.17 -0.12 0.00 -0.64 0.00 0.00 41.12 39.81 3ktk n ASP 171 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 3ktk s ASN 172 N 4.16 5.02 0.06 -2.24 3.04 -0.79 -5.01 114.94 119.18 3ktk s ASN 172 Ca 1.00 -2.29 -0.25 0.00 0.04 0.00 0.00 52.86 51.36 3ktk s ASN 172 Cb -1.02 -1.76 -0.06 0.00 -1.54 0.00 0.00 41.25 36.87 3ktk s ASN 172 CO 0.63 -0.44 0.78 -0.36 -3.04 0.00 0.00 177.10 174.66 3ktk s PHE 173 N 0.75 3.75 0.01 0.43 0.08 -1.26 -2.17 117.98 119.58 3ktk s PHE 173 Ca 0.11 1.50 0.04 0.00 0.12 0.00 0.00 56.93 58.70 3ktk s PHE 173 Cb -0.22 -2.83 -0.01 0.00 -0.57 0.00 0.00 43.02 39.39 3ktk s PHE 173 CO -0.05 0.29 -0.12 0.15 -0.10 0.00 0.00 175.22 175.39 3ktk s LYS 174 N -0.14 0.89 0.87 0.44 1.02 0.18 -4.98 119.74 118.01 3ktk s LYS 174 Ca 0.39 -0.55 -0.13 0.00 0.02 0.00 0.00 55.97 55.69 3ktk s LYS 174 Cb -0.21 -0.86 0.12 0.00 -0.52 0.00 0.00 37.83 36.36 3ktk s LYS 174 CO 0.24 0.23 1.22 -1.54 -0.92 0.00 0.00 175.35 174.57 3ktk s SER 175 N -0.66 3.98 0.28 2.83 1.04 -1.26 -0.99 113.70 118.92 3ktk s SER 175 Ca 0.02 0.65 -0.01 0.00 0.48 0.00 0.00 55.95 57.10 3ktk s SER 175 Cb -0.06 -1.02 0.41 0.00 0.10 0.00 0.00 66.02 65.46 3ktk s SER 175 CO 0.00 -2.22 1.81 0.00 0.98 0.00 0.00 173.24 173.81 3ktk h ALA 176 N -1.28 1.21 -0.43 5.32 0.00 -1.77 0.22 119.26 122.52 3ktk h ALA 176 Ca -0.46 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.21 3ktk h ALA 176 Cb 1.30 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 3ktk h ALA 176 CO 0.57 0.53 0.20 0.93 0.00 0.00 0.00 179.25 181.48 3ktk h GLU 177 N 0.73 0.62 -0.22 0.00 3.07 -1.92 -0.52 114.58 116.34 3ktk h GLU 177 Ca 0.16 -0.10 -0.11 0.00 -0.50 0.00 0.00 59.36 58.81 3ktk h GLU 177 Cb 0.35 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.13 3ktk h GLU 177 CO 0.01 0.55 -0.33 0.93 -1.40 0.00 0.00 179.01 178.77 3ktk h GLU 178 N 0.55 0.46 -0.55 2.33 5.08 -1.76 -1.84 114.58 118.86 3ktk h GLU 178 Ca 0.15 -0.20 -0.09 0.00 -1.00 0.00 0.00 59.36 58.21 3ktk h GLU 178 Cb 0.14 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 3ktk h GLU 178 CO -0.02 0.73 -0.03 0.00 -1.00 0.00 0.00 179.01 178.70 3ktk h ALA 179 N 1.26 0.91 -0.17 3.43 0.00 -0.24 -1.28 119.26 123.18 3ktk h ALA 179 Ca 0.05 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3ktk h ALA 179 Cb 0.77 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3ktk h ALA 179 CO 0.06 0.64 0.06 1.25 0.00 0.00 0.00 179.25 181.26 3ktk h LEU 180 N 0.88 0.25 -1.60 0.00 5.85 -0.79 -1.22 115.31 118.68 3ktk h LEU 180 Ca 0.16 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.65 3ktk h LEU 180 Cb 0.56 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 3ktk h LEU 180 CO 0.03 0.38 -0.04 -0.33 -0.34 0.00 0.00 178.44 178.13 3ktk h GLU 181 N 0.11 0.20 0.00 1.25 4.39 -1.15 -2.47 114.58 116.90 3ktk h GLU 181 Ca 0.06 -0.03 -0.07 0.00 0.34 0.00 0.00 59.36 59.66 3ktk h GLU 181 Cb 0.22 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 3ktk h GLU 181 CO -0.00 0.26 -0.31 -0.92 -1.16 0.00 0.00 179.01 176.88 3ktk h TYR 182 N 0.20 0.00 0.00 4.33 3.20 -0.94 -3.47 116.97 120.28 3ktk h TYR 182 Ca 0.05 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.92 3ktk h TYR 182 Cb 0.21 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.48 3ktk h TYR 182 CO 0.00 0.31 0.00 0.41 -1.64 0.00 0.00 178.16 177.24 3ktk n GLY 183 N 0.96 0.99 0.13 1.82 0.00 -0.78 -4.70 105.19 103.61 3ktk n GLY 183 Ca 0.02 -0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 3ktk n GLY 183 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3ktk h LEU 184 N 0.00 0.31 -9.01 0.99 3.38 -1.49 -3.38 115.31 106.13 3ktk h LEU 184 Ca 0.00 -0.27 -0.41 0.00 0.09 0.00 0.00 57.88 57.29 3ktk h LEU 184 Cb 0.00 -0.10 -0.14 0.00 0.09 0.00 0.00 40.66 40.51 3ktk h LEU 184 CO 0.00 1.09 -0.64 0.27 0.09 0.00 0.00 178.44 179.25 3ktk s ILE 185 N -3.13 1.11 -0.06 1.22 -4.36 -1.22 -4.12 121.20 110.65 3ktk s ILE 185 Ca -0.03 -2.03 0.11 0.00 -0.26 0.00 0.00 60.65 58.43 3ktk s ILE 185 Cb 0.09 -2.50 -0.16 0.00 1.25 0.00 0.00 42.46 41.14 3ktk s ILE 185 CO 0.84 -0.21 0.16 0.47 0.24 0.00 0.00 174.94 176.45 3ktk n ASP 186 N -0.51 2.25 -3.63 4.36 8.00 0.14 -4.53 116.55 122.63 3ktk n ASP 186 Ca -0.04 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.31 3ktk n ASP 186 Cb 0.65 1.21 -0.07 0.00 -0.02 0.00 0.00 41.12 42.88 3ktk n ASP 186 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3ktk s LYS 187 N -2.59 0.85 -0.24 -1.24 2.20 -1.01 -5.00 119.74 112.71 3ktk s LYS 187 Ca -0.05 0.28 -0.08 0.00 -0.36 0.00 0.00 55.97 55.76 3ktk s LYS 187 Cb 0.06 0.40 -0.03 0.00 -1.51 0.00 0.00 37.83 36.74 3ktk s LYS 187 CO 0.48 -0.22 0.08 0.42 -0.36 0.00 0.00 175.35 175.75 3ktk s ILE 188 N -0.83 4.51 0.10 5.43 1.01 -1.26 -2.70 121.20 127.46 3ktk s ILE 188 Ca -0.09 -0.11 -0.30 0.00 0.00 0.00 0.00 60.65 60.15 3ktk s ILE 188 Cb -0.03 -3.10 -0.06 0.00 0.01 0.00 0.00 42.46 39.28 3ktk s ILE 188 CO 0.06 0.35 1.20 -0.76 0.00 0.00 0.00 174.94 175.79 3ktk s LEU 189 N 1.36 4.40 0.00 2.97 1.43 -0.46 -4.94 118.68 123.43 3ktk s LEU 189 Ca 0.05 2.08 0.00 0.00 -1.03 0.00 0.00 54.13 55.23 3ktk s LEU 189 Cb -0.15 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.49 3ktk s LEU 189 CO 0.04 -0.44 0.00 0.35 0.23 0.00 0.00 176.35 176.53 3ktk n THR 190 N 3.52 0.00 -0.50 5.49 -2.24 -1.26 -3.76 114.28 115.53 3ktk n THR 190 Ca 0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 3ktk n THR 190 Cb 0.46 -0.42 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 3ktk n THR 190 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50