#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1okk s LEU 5 N 0.00 2.88 0.76 1.69 1.43 -1.26 -4.29 118.68 119.89 1okk s LEU 5 Ca 0.00 1.30 -0.14 0.00 -1.03 0.00 0.00 54.13 54.26 1okk s LEU 5 Cb 0.00 -4.09 0.05 0.00 0.03 0.00 0.00 46.19 42.19 1okk s LEU 5 CO 0.00 -1.50 1.21 -0.94 0.23 0.00 0.00 176.35 175.35 1okk s SER 6 N -4.10 3.97 0.18 2.29 1.04 -0.71 -4.77 113.70 111.60 1okk s SER 6 Ca 0.59 2.38 -0.13 0.00 0.48 0.00 0.00 55.95 59.27 1okk s SER 6 Cb -0.13 -2.59 0.14 0.00 0.10 0.00 0.00 66.02 63.55 1okk s SER 6 CO 0.53 -2.42 1.77 0.00 0.98 0.00 0.00 173.24 174.11 1okk h ALA 7 N -0.49 0.62 -0.77 5.32 0.00 -1.92 -0.26 119.26 121.76 1okk h ALA 7 Ca -0.47 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.42 1okk h ALA 7 Cb 1.30 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 1okk h ALA 7 CO 0.48 -0.14 0.27 -0.09 0.00 0.00 0.00 179.25 179.77 1okk h ARG 8 N 0.44 1.17 -0.32 0.00 2.43 -1.98 -0.85 114.38 115.28 1okk h ARG 8 Ca 0.22 -0.24 -0.14 0.00 -0.81 0.00 0.00 59.98 59.02 1okk h ARG 8 Cb 0.17 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1okk h ARG 8 CO -0.18 0.98 -0.35 -0.07 -1.51 0.00 0.00 179.97 178.84 1okk h LEU 9 N 1.13 0.85 -0.71 3.80 3.38 -1.79 -1.39 115.31 120.59 1okk h LEU 9 Ca 0.25 -0.48 0.11 0.00 0.09 0.00 0.00 57.88 57.85 1okk h LEU 9 Cb 0.27 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.70 1okk h LEU 9 CO -0.01 1.16 0.31 1.56 0.09 0.00 0.00 178.44 181.55 1okk h GLN 10 N 0.57 0.49 -0.21 1.13 4.20 -0.72 0.70 115.11 121.28 1okk h GLN 10 Ca 0.05 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.65 1okk h GLN 10 Cb 0.93 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.59 1okk h GLN 10 CO 0.08 0.33 -0.19 1.49 -0.67 0.00 0.00 178.83 179.87 1okk h GLU 11 N 0.51 0.49 -0.29 1.46 4.57 -1.10 0.97 114.58 121.19 1okk h GLU 11 Ca 0.36 -0.25 -0.01 0.00 -1.18 0.00 0.00 59.36 58.28 1okk h GLU 11 Cb 0.46 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.04 1okk h GLU 11 CO -0.32 0.83 0.15 0.00 -1.18 0.00 0.00 179.01 178.49 1okk h ALA 12 N 0.65 0.37 0.04 2.92 0.00 -0.74 -2.01 119.26 120.49 1okk h ALA 12 Ca 0.03 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1okk h ALA 12 Cb 0.73 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1okk h ALA 12 CO 0.05 -0.09 -0.02 0.82 0.00 0.00 0.00 179.25 180.00 1okk h ILE 13 N 0.34 1.34 -0.91 0.00 1.08 -0.96 -3.36 117.51 115.05 1okk h ILE 13 Ca 0.10 -1.59 0.15 0.00 -0.39 0.00 0.00 64.86 63.13 1okk h ILE 13 Cb 0.08 2.35 -0.07 0.00 -3.07 0.00 0.00 36.82 36.10 1okk h ILE 13 CO -0.02 0.38 0.58 1.23 -0.69 0.00 0.00 178.15 179.64 1okk h GLY 14 N -0.80 1.24 2.00 5.37 0.00 -0.81 -1.63 103.07 108.44 1okk h GLY 14 Ca -0.01 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.02 1okk h GLY 14 CO 0.01 0.07 0.00 -0.96 0.00 0.00 0.00 176.54 175.66 1okk n ARG 15 N -4.58 0.13 0.09 4.80 1.85 -0.76 -1.81 116.66 116.39 1okk n ARG 15 Ca 0.18 0.34 0.01 0.00 -1.00 0.00 0.00 57.85 57.39 1okk n ARG 15 Cb 0.49 -1.74 -0.03 0.00 -1.05 0.00 0.00 32.46 30.13 1okk n ARG 15 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 1okk h LEU 16 N 0.00 0.00 -9.62 2.89 3.38 -1.46 -3.46 115.31 107.03 1okk h LEU 16 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 1okk h LEU 16 Cb 0.36 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.16 1okk h LEU 16 CO 0.00 0.55 1.02 -0.13 0.09 0.00 0.00 178.44 179.97 1okk s ARG 17 N -2.94 4.14 -0.38 1.13 0.52 -0.75 -2.41 118.95 118.27 1okk s ARG 17 Ca 0.01 2.58 0.00 0.00 -0.52 0.00 0.00 55.73 57.80 1okk s ARG 17 Cb 0.08 -3.19 0.00 0.00 0.52 0.00 0.00 34.95 32.36 1okk s ARG 17 CO 0.78 -0.76 0.00 0.41 0.02 0.00 0.00 175.30 175.75 1okk n GLY 18 N 4.01 0.63 0.75 -3.53 0.00 -1.26 -4.89 105.19 100.89 1okk n GLY 18 Ca 0.16 -0.35 0.08 0.00 0.00 0.00 0.00 46.02 45.91 1okk n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1okk n ARG 19 N -2.19 1.85 0.00 1.61 5.12 -1.01 -5.09 116.66 116.96 1okk n ARG 19 Ca -0.04 -1.79 0.00 0.00 -1.93 0.00 0.00 57.85 54.10 1okk n ARG 19 Cb 0.21 -1.34 0.00 0.00 -1.16 0.00 0.00 32.46 30.17 1okk n ARG 19 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1okk n GLY 20 N 0.92 -2.45 3.77 -0.13 0.00 -1.26 -4.93 105.19 101.11 1okk n GLY 20 Ca 0.12 -1.77 -0.38 0.00 0.00 0.00 0.00 46.02 43.98 1okk n GLY 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1okk s ARG 21 N -0.39 3.93 0.40 1.61 0.52 -1.26 -4.82 118.95 118.94 1okk s ARG 21 Ca 0.00 1.96 0.02 0.00 -0.52 0.00 0.00 55.73 57.19 1okk s ARG 21 Cb 0.00 -2.65 -0.01 0.00 0.52 0.00 0.00 34.95 32.81 1okk s ARG 21 CO 0.00 -0.46 0.58 0.96 0.02 0.00 0.00 175.30 176.41 1okk s ILE 22 N -1.37 4.21 0.41 1.52 -4.36 -1.26 -5.12 121.20 115.23 1okk s ILE 22 Ca 0.59 -0.66 0.08 0.00 -0.26 0.00 0.00 60.65 60.39 1okk s ILE 22 Cb -0.33 -3.52 -0.00 0.00 1.25 0.00 0.00 42.46 39.85 1okk s ILE 22 CO 0.42 -0.31 0.50 0.42 0.24 0.00 0.00 174.94 176.22 1okk s THR 23 N -2.39 3.05 0.47 8.37 -4.23 -1.26 -4.74 115.64 114.90 1okk s THR 23 Ca 0.46 -1.10 0.17 0.00 -1.18 0.00 0.00 61.69 60.04 1okk s THR 23 Cb -0.10 -3.05 0.22 0.00 1.34 0.00 0.00 72.50 70.92 1okk s THR 23 CO 0.35 -0.02 2.05 -0.08 -0.54 0.00 0.00 174.62 176.38 1okk h GLU 24 N 0.78 0.00 -0.77 3.99 4.22 -1.99 -1.92 114.58 118.89 1okk h GLU 24 Ca -0.41 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.01 1okk h GLU 24 Cb 1.27 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.49 1okk h GLU 24 CO 0.49 0.13 0.40 1.49 -2.18 0.00 0.00 179.01 179.34 1okk h GLU 25 N 0.00 1.09 -0.78 1.92 4.81 -1.99 0.20 114.58 119.82 1okk h GLU 25 Ca -0.00 -0.14 -0.05 0.00 -0.13 0.00 0.00 59.36 59.04 1okk h GLU 25 Cb 0.24 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 1okk h GLU 25 CO 0.02 0.82 0.30 -0.44 -0.73 0.00 0.00 179.01 178.98 1okk h ASP 26 N 1.07 1.09 -0.46 1.04 3.32 -1.76 -1.67 116.42 119.05 1okk h ASP 26 Ca 0.27 -0.18 -0.05 0.00 0.02 0.00 0.00 57.03 57.09 1okk h ASP 26 Cb 0.07 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 1okk h ASP 26 CO -0.04 0.98 0.11 0.25 -1.72 0.00 0.00 179.24 178.82 1okk h LEU 27 N 1.14 0.70 -0.38 1.55 5.85 -0.92 -1.74 115.31 121.50 1okk h LEU 27 Ca 0.26 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1okk h LEU 27 Cb 0.24 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1okk h LEU 27 CO -0.02 0.75 0.22 0.50 -0.34 0.00 0.00 178.44 179.55 1okk h LYS 28 N 0.61 0.53 -0.68 1.25 3.64 -0.79 -0.38 116.57 120.75 1okk h LYS 28 Ca 0.14 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.39 1okk h LYS 28 Cb 0.33 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 1okk h LYS 28 CO 0.00 0.42 0.14 0.00 -2.27 0.00 0.00 179.45 177.75 1okk h ALA 29 N 1.08 0.97 -0.20 5.00 0.00 -1.23 -1.41 119.26 123.47 1okk h ALA 29 Ca 0.14 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1okk h ALA 29 Cb 0.04 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1okk h ALA 29 CO -0.02 0.66 -0.00 1.15 0.00 0.00 0.00 179.25 181.03 1okk h THR 30 N 1.03 1.26 -0.41 0.00 2.02 -1.07 -2.87 112.91 112.87 1okk h THR 30 Ca 0.21 -0.88 -0.03 0.00 0.77 0.00 0.00 66.41 66.48 1okk h THR 30 Cb 0.39 1.44 -0.02 0.00 -1.74 0.00 0.00 68.15 68.23 1okk h THR 30 CO 0.01 0.27 0.11 -0.07 0.37 0.00 0.00 175.52 176.21 1okk h LEU 31 N 0.11 0.55 -0.70 2.58 3.38 -0.91 -0.85 115.31 119.47 1okk h LEU 31 Ca 0.06 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 57.98 1okk h LEU 31 Cb 0.40 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 1okk h LEU 31 CO 0.01 0.54 0.44 -0.09 0.09 0.00 0.00 178.44 179.43 1okk h ARG 32 N 0.59 0.84 -0.20 1.13 2.43 -1.17 0.42 114.38 118.43 1okk h ARG 32 Ca 0.14 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 59.12 1okk h ARG 32 Cb 0.20 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 1okk h ARG 32 CO -0.01 0.56 -0.44 0.93 -1.51 0.00 0.00 179.97 179.50 1okk h GLU 33 N 0.87 0.49 -0.47 0.20 4.39 -1.12 -1.44 114.58 117.51 1okk h GLU 33 Ca 0.27 -0.26 -0.03 0.00 0.34 0.00 0.00 59.36 59.68 1okk h GLU 33 Cb -0.01 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 1okk h GLU 33 CO -0.10 0.84 0.17 0.82 -1.16 0.00 0.00 179.01 179.58 1okk h ILE 34 N 0.40 1.22 -0.34 3.13 2.04 -0.86 0.16 117.51 123.26 1okk h ILE 34 Ca 0.03 -0.70 0.04 0.00 1.00 0.00 0.00 64.86 65.23 1okk h ILE 34 Cb 0.94 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 37.77 1okk h ILE 34 CO 0.08 0.26 0.11 -0.09 0.00 0.00 0.00 178.15 178.51 1okk h ARG 35 N 0.62 0.24 -0.69 2.37 2.43 -0.71 -0.94 114.38 117.71 1okk h ARG 35 Ca 0.15 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.24 1okk h ARG 35 Cb 0.24 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.70 1okk h ARG 35 CO -0.01 0.16 0.16 0.00 -1.51 0.00 0.00 179.97 178.78 1okk h ARG 36 N 0.25 1.10 -0.75 0.20 3.08 -1.06 -2.11 114.38 115.09 1okk h ARG 36 Ca 0.15 -0.26 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 1okk h ARG 36 Cb 0.13 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.00 1okk h ARG 36 CO -0.16 0.97 0.43 0.00 -1.07 0.00 0.00 179.97 180.14 1okk h ALA 37 N 1.12 0.96 -0.77 0.04 0.00 -0.66 -1.07 119.26 118.89 1okk h ALA 37 Ca 0.22 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1okk h ALA 37 Cb 0.37 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1okk h ALA 37 CO 0.00 0.46 0.32 -0.07 0.00 0.00 0.00 179.25 179.96 1okk h LEU 38 N 1.03 1.03 -0.54 0.00 3.38 -0.87 -1.51 115.31 117.84 1okk h LEU 38 Ca 0.27 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 1okk h LEU 38 Cb 0.01 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 1okk h LEU 38 CO -0.05 0.91 -0.04 0.24 0.09 0.00 0.00 178.44 179.59 1okk h MET 39 N 1.11 0.98 -1.00 1.13 2.86 -0.92 -1.03 114.93 118.06 1okk h MET 39 Ca 0.26 -0.33 0.21 0.00 -2.06 0.00 0.00 59.70 57.78 1okk h MET 39 Cb 0.18 -0.08 -0.11 0.00 0.06 0.00 0.00 31.60 31.65 1okk h MET 39 CO -0.02 1.00 0.59 -0.44 1.06 0.00 0.00 176.91 179.10 1okk h ASP 40 N 0.85 0.72 -0.20 1.22 3.32 -0.82 -0.91 116.42 120.61 1okk h ASP 40 Ca 0.15 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.31 1okk h ASP 40 Cb 0.59 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.13 1okk h ASP 40 CO 0.04 0.20 0.00 0.00 -1.72 0.00 0.00 179.24 177.76 1okk n ALA 41 N -2.33 2.67 -1.17 3.45 0.00 -0.60 -4.89 120.51 117.63 1okk n ALA 41 Ca 0.24 -0.47 -0.06 0.00 0.00 0.00 0.00 53.44 53.16 1okk n ALA 41 Cb 0.64 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 19.05 1okk n ALA 41 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1okk n ASP 42 N 0.17 -4.04 -4.73 0.00 8.00 -0.35 -1.40 116.55 114.20 1okk n ASP 42 Ca 0.08 0.14 -0.42 0.00 0.71 0.00 0.00 54.79 55.31 1okk n ASP 42 Cb 0.34 -2.06 -0.03 0.00 -0.02 0.00 0.00 41.12 39.36 1okk n ASP 42 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1okk s VAL 43 N -2.10 3.27 0.44 2.53 1.01 -0.46 -3.05 120.40 122.04 1okk s VAL 43 Ca 0.00 0.97 -0.26 0.00 0.00 0.00 0.00 61.98 62.69 1okk s VAL 43 Cb 0.00 -3.62 -0.09 0.00 0.00 0.00 0.00 36.38 32.67 1okk s VAL 43 CO 0.00 0.11 1.45 -3.20 0.00 0.00 0.00 175.10 173.46 1okk n ASN 44 N 3.34 3.42 -0.21 3.32 2.85 -1.26 -4.22 115.26 122.50 1okk n ASN 44 Ca 0.09 1.13 0.04 0.00 -0.11 0.00 0.00 54.58 55.73 1okk n ASN 44 Cb 0.43 -1.61 0.29 0.00 1.24 0.00 0.00 39.78 40.13 1okk n ASN 44 CO 0.00 0.00 0.00 0.17 -2.11 0.00 0.00 177.26 175.32 1okk h LEU 45 N 2.39 0.78 -0.35 1.20 -0.00 -1.93 0.69 115.31 118.08 1okk h LEU 45 Ca -0.51 -0.01 -0.16 0.00 -0.00 0.00 0.00 57.88 57.20 1okk h LEU 45 Cb 1.26 -0.18 -0.00 0.00 -0.00 0.00 0.00 40.66 41.74 1okk h LEU 45 CO 0.61 0.53 -0.41 -0.33 -0.00 0.00 0.00 178.44 178.85 1okk h GLU 46 N 0.90 0.89 -0.44 0.17 5.08 -1.99 -2.09 114.58 117.10 1okk h GLU 46 Ca 0.30 -0.49 -0.12 0.00 -1.00 0.00 0.00 59.36 58.05 1okk h GLU 46 Cb 0.08 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1okk h GLU 46 CO -0.09 1.14 -0.21 0.28 -1.00 0.00 0.00 179.01 179.13 1okk h VAL 47 N 0.69 1.27 -0.68 3.13 2.07 -1.75 -1.60 116.25 119.39 1okk h VAL 47 Ca 0.05 -1.35 -0.06 0.00 0.82 0.00 0.00 66.70 66.16 1okk h VAL 47 Cb 1.00 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 31.89 1okk h VAL 47 CO 0.10 0.46 0.19 0.00 0.02 0.00 0.00 177.57 178.34 1okk h ALA 48 N 0.98 1.05 -0.03 1.67 0.00 -0.85 -0.23 119.26 121.85 1okk h ALA 48 Ca 0.11 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1okk h ALA 48 Cb 0.76 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1okk h ALA 48 CO 0.06 0.63 0.01 -0.09 0.00 0.00 0.00 179.25 179.86 1okk h ARG 49 N 1.01 0.05 -0.88 0.00 2.43 -1.14 -1.76 114.38 114.10 1okk h ARG 49 Ca 0.22 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.45 1okk h ARG 49 Cb 0.32 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.80 1okk h ARG 49 CO -0.00 0.27 0.54 -0.44 -1.51 0.00 0.00 179.97 178.82 1okk h ASP 50 N -0.18 0.83 -0.06 -3.80 3.32 -1.12 -1.51 116.42 113.90 1okk h ASP 50 Ca 0.01 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.08 1okk h ASP 50 Cb 0.24 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 1okk h ASP 50 CO 0.00 0.51 0.03 0.15 -1.72 0.00 0.00 179.24 178.21 1okk h PHE 51 N 0.95 0.08 0.00 4.55 3.57 -0.85 -1.65 116.94 123.60 1okk h PHE 51 Ca 0.40 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.80 1okk h PHE 51 Cb 0.24 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 1okk h PHE 51 CO -0.03 0.12 -0.43 -0.39 -2.23 0.00 0.00 178.31 175.34 1okk h VAL 52 N 0.02 1.01 -0.50 1.41 -1.51 -1.05 -0.91 116.25 114.72 1okk h VAL 52 Ca 0.02 -1.66 -0.02 0.00 -1.23 0.00 0.00 66.70 63.81 1okk h VAL 52 Cb 0.06 1.98 -0.02 0.00 -2.13 0.00 0.00 31.29 31.18 1okk h VAL 52 CO -0.00 0.42 0.23 -0.33 -1.23 0.00 0.00 177.57 176.66 1okk h GLU 53 N 0.00 0.74 -0.19 5.19 5.08 -1.08 0.49 114.58 124.81 1okk h GLU 53 Ca -0.00 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1okk h GLU 53 Cb 0.94 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 1okk h GLU 53 CO 0.06 0.63 0.12 -0.09 -1.00 0.00 0.00 179.01 178.72 1okk h ARG 54 N 0.67 0.25 -0.77 2.33 2.43 -0.83 -2.44 114.38 116.03 1okk h ARG 54 Ca 0.17 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.37 1okk h ARG 54 Cb 0.15 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.59 1okk h ARG 54 CO -0.02 0.19 0.46 0.28 -1.51 0.00 0.00 179.97 179.38 1okk h VAL 55 N 0.23 1.04 -0.26 0.20 2.07 -0.99 -1.34 116.25 117.20 1okk h VAL 55 Ca 0.07 -0.30 0.03 0.00 0.82 0.00 0.00 66.70 67.32 1okk h VAL 55 Cb 0.01 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 29.84 1okk h VAL 55 CO -0.01 0.16 0.06 -0.09 0.02 0.00 0.00 177.57 177.71 1okk h ARG 56 N 0.86 0.16 -0.26 1.57 2.43 -0.57 0.11 114.38 118.68 1okk h ARG 56 Ca 0.33 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.37 1okk h ARG 56 Cb 0.13 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1okk h ARG 56 CO -0.16 0.11 -0.35 0.93 -1.51 0.00 0.00 179.97 178.98 1okk h GLU 57 N 0.17 0.58 -0.38 0.20 4.39 -1.04 -1.05 114.58 117.45 1okk h GLU 57 Ca 0.12 -0.27 -0.06 0.00 0.34 0.00 0.00 59.36 59.49 1okk h GLU 57 Cb 0.11 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 1okk h GLU 57 CO -0.15 0.85 0.01 0.93 -1.16 0.00 0.00 179.01 179.50 1okk h GLU 58 N 0.49 0.66 -0.42 2.33 5.08 -0.76 -1.37 114.58 120.60 1okk h GLU 58 Ca 0.05 -0.20 -0.06 0.00 -1.00 0.00 0.00 59.36 58.15 1okk h GLU 58 Cb 0.84 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 1okk h GLU 58 CO 0.07 0.75 0.04 0.00 -1.00 0.00 0.00 179.01 178.88 1okk h ALA 59 N 0.88 0.56 -0.50 3.43 0.00 -0.63 -0.62 119.26 122.39 1okk h ALA 59 Ca 0.11 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.80 1okk h ALA 59 Cb 0.44 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1okk h ALA 59 CO 0.02 0.30 0.31 -0.07 0.00 0.00 0.00 179.25 179.81 1okk h LEU 60 N 0.56 0.52 -1.74 0.00 3.38 -1.15 -1.53 115.31 115.36 1okk h LEU 60 Ca 0.12 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 1okk h LEU 60 Cb 0.41 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1okk h LEU 60 CO 0.01 0.37 -0.17 1.23 0.09 0.00 0.00 178.44 179.97 1okk h GLY 61 N 0.63 0.00 0.04 0.83 0.00 -0.99 -0.16 103.07 103.42 1okk h GLY 61 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1okk h GLY 61 CO -0.07 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.75 1okk n LYS 62 N -3.91 1.14 -3.43 4.80 5.02 -0.26 -4.92 118.16 116.60 1okk n LYS 62 Ca -0.02 -0.22 -0.19 0.00 -2.02 0.00 0.00 58.31 55.86 1okk n LYS 62 Cb 0.26 -1.18 0.08 0.00 -0.02 0.00 0.00 35.03 34.17 1okk n LYS 62 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1okk n GLN 63 N -0.45 -6.83 -0.05 1.97 1.13 -0.07 -4.90 117.38 108.17 1okk n GLN 63 Ca 0.08 0.77 0.08 0.00 -1.94 0.00 0.00 57.00 56.00 1okk n GLN 63 Cb 0.08 -5.61 0.46 0.00 0.11 0.00 0.00 30.24 25.28 1okk n GLN 63 CO 0.00 0.00 0.00 -0.24 -1.44 0.00 0.00 177.06 175.38 1okk h VAL 64 N -2.18 0.99 0.00 5.09 3.04 -1.44 -1.27 116.25 120.47 1okk h VAL 64 Ca -0.53 -0.17 0.00 0.00 -1.01 0.00 0.00 66.70 64.99 1okk h VAL 64 Cb 1.33 0.46 0.00 0.00 -2.01 0.00 0.00 31.29 31.07 1okk h VAL 64 CO 0.49 0.09 0.00 0.18 -1.01 0.00 0.00 177.57 177.32 1okk n LEU 65 N -4.47 0.22 -0.29 3.16 4.77 -1.26 -2.21 117.00 116.92 1okk n LEU 65 Ca 0.07 0.56 0.06 0.00 -0.03 0.00 0.00 56.01 56.67 1okk n LEU 65 Cb 0.23 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 1okk n LEU 65 CO 0.34 -0.41 0.25 -0.62 -1.33 0.00 0.00 177.39 175.63 1okk n GLU 66 N -1.76 1.83 -2.21 3.23 -0.58 -0.51 -4.51 120.64 116.14 1okk n GLU 66 Ca 0.02 -0.72 -0.40 0.00 -0.42 0.00 0.00 57.16 55.64 1okk n GLU 66 Cb 0.16 -1.14 -0.02 0.00 -0.57 0.00 0.00 31.44 29.86 1okk n GLU 66 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1okk s SER 67 N -1.44 6.78 0.00 1.62 0.15 -0.94 -4.92 113.70 114.95 1okk s SER 67 Ca 0.10 2.54 0.27 0.00 0.70 0.00 0.00 55.95 59.57 1okk s SER 67 Cb 0.09 -2.64 0.97 0.00 -1.71 0.00 0.00 66.02 62.73 1okk s SER 67 CO 0.28 -0.51 1.72 0.18 1.20 0.00 0.00 173.24 176.10 1okk n LEU 68 N 0.69 0.36 -2.92 3.45 4.77 -1.26 -4.17 117.00 117.91 1okk n LEU 68 Ca 0.01 0.15 -0.21 0.00 -0.03 0.00 0.00 56.01 55.93 1okk n LEU 68 Cb 0.43 -0.30 -0.02 0.00 -2.33 0.00 0.00 43.42 41.20 1okk n LEU 68 CO 0.56 0.08 -0.03 0.35 -1.33 0.00 0.00 177.39 177.02 1okk n THR 69 N -1.29 1.46 0.05 -5.08 -2.24 -1.26 -4.87 114.28 101.05 1okk n THR 69 Ca 0.09 -4.73 0.06 0.00 -2.27 0.00 0.00 64.05 57.20 1okk n THR 69 Cb 0.32 -0.64 0.49 0.00 -2.10 0.00 0.00 70.33 68.40 1okk n THR 69 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1okk h PRO 70 N 2.93 0.38 -0.55 -0.78 0.13 -1.86 -1.60 132.00 130.66 1okk h PRO 70 Ca 0.11 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1okk h PRO 70 Cb 0.84 -0.09 -0.03 0.00 0.13 0.00 0.00 31.00 31.86 1okk h PRO 70 CO 0.66 0.25 0.34 0.00 -0.23 0.00 0.00 178.00 179.02 1okk h ALA 71 N 1.80 0.69 -0.18 -0.56 0.00 -1.86 -0.35 119.26 118.80 1okk h ALA 71 Ca 0.13 -0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.79 1okk h ALA 71 Cb 0.04 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1okk h ALA 71 CO -0.03 0.16 -0.65 0.93 0.00 0.00 0.00 179.25 179.67 1okk h GLU 72 N 0.74 0.67 -0.50 0.00 3.07 -1.71 -2.10 114.58 114.74 1okk h GLU 72 Ca 0.20 -0.48 -0.05 0.00 -0.50 0.00 0.00 59.36 58.53 1okk h GLU 72 Cb -0.04 0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 27.93 1okk h GLU 72 CO -0.04 1.10 0.14 0.28 -1.40 0.00 0.00 179.01 179.09 1okk h VAL 73 N 0.49 1.24 -0.22 3.13 2.07 -1.09 -0.71 116.25 121.16 1okk h VAL 73 Ca -0.01 -0.82 -0.03 0.00 0.82 0.00 0.00 66.70 66.66 1okk h VAL 73 Cb 1.24 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 1okk h VAL 73 CO 0.13 0.30 0.03 0.40 0.02 0.00 0.00 177.57 178.45 1okk h ILE 74 N 0.69 1.23 -0.34 4.57 2.04 -1.03 -0.83 117.51 123.83 1okk h ILE 74 Ca 0.16 -0.76 0.01 0.00 1.00 0.00 0.00 64.86 65.27 1okk h ILE 74 Cb 0.31 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 1okk h ILE 74 CO -0.00 0.24 0.21 0.25 0.00 0.00 0.00 178.15 178.85 1okk h LEU 75 N 0.16 0.36 -0.91 1.44 5.85 -1.30 -0.60 115.31 120.31 1okk h LEU 75 Ca 0.07 -0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.72 1okk h LEU 75 Cb 0.32 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1okk h LEU 75 CO 0.00 0.26 0.06 0.00 -0.34 0.00 0.00 178.44 178.42 1okk h ALA 76 N 1.14 1.10 -0.43 1.25 0.00 -1.07 -1.41 119.26 119.85 1okk h ALA 76 Ca 0.13 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1okk h ALA 76 Cb -0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1okk h ALA 76 CO -0.04 0.58 0.13 1.15 0.00 0.00 0.00 179.25 181.07 1okk h THR 77 N 0.81 1.22 -0.08 0.00 2.02 -0.61 -1.21 112.91 115.06 1okk h THR 77 Ca 0.16 -0.73 -0.00 0.00 0.77 0.00 0.00 66.41 66.61 1okk h THR 77 Cb 0.40 0.89 -0.00 0.00 -1.74 0.00 0.00 68.15 67.70 1okk h THR 77 CO 0.01 0.26 0.04 0.58 0.37 0.00 0.00 175.52 176.78 1okk h VAL 78 N 0.55 1.11 -0.31 3.16 2.07 -0.88 -0.77 116.25 121.18 1okk h VAL 78 Ca 0.14 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 1okk h VAL 78 Cb 0.27 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1okk h VAL 78 CO -0.00 0.10 0.15 0.22 0.02 0.00 0.00 177.57 178.05 1okk h TYR 79 N 0.00 0.45 -0.44 1.57 3.20 -1.19 0.22 116.97 120.78 1okk h TYR 79 Ca 0.03 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 1okk h TYR 79 Cb 0.12 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 1okk h TYR 79 CO -0.03 0.40 0.15 0.93 -1.64 0.00 0.00 178.16 177.97 1okk h GLU 80 N 0.37 0.69 -0.72 1.82 5.08 -1.20 -0.95 114.58 119.67 1okk h GLU 80 Ca 0.11 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.27 1okk h GLU 80 Cb 0.12 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1okk h GLU 80 CO -0.01 0.66 0.23 0.00 -1.00 0.00 0.00 179.01 178.89 1okk h ALA 81 N 1.00 1.05 -0.28 3.43 0.00 -0.96 -1.05 119.26 122.44 1okk h ALA 81 Ca 0.14 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 1okk h ALA 81 Cb 0.25 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1okk h ALA 81 CO -0.01 0.64 -0.30 1.25 0.00 0.00 0.00 179.25 180.84 1okk h LEU 82 N 1.06 0.75 -0.18 0.00 5.85 -0.78 0.27 115.31 122.29 1okk h LEU 82 Ca 0.23 -0.48 0.03 0.00 0.84 0.00 0.00 57.88 58.51 1okk h LEU 82 Cb 0.28 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 1okk h LEU 82 CO -0.01 1.08 -0.03 0.50 -0.34 0.00 0.00 178.44 179.63 1okk h LYS 83 N 0.44 0.01 -0.61 1.25 3.64 -1.05 -0.93 116.57 119.33 1okk h LYS 83 Ca 0.04 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 1okk h LYS 83 Cb 0.87 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.66 1okk h LYS 83 CO 0.07 0.01 0.22 1.49 -2.27 0.00 0.00 179.45 178.97 1okk h GLU 84 N 0.01 0.94 0.00 1.90 4.57 -1.11 -0.24 114.58 120.65 1okk h GLU 84 Ca 0.08 -0.19 -0.04 0.00 -1.18 0.00 0.00 59.36 58.04 1okk h GLU 84 Cb 0.12 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.57 1okk h GLU 84 CO -0.17 0.82 -0.17 0.00 -1.18 0.00 0.00 179.01 178.30 1okk h ALA 85 N 1.08 1.30 -0.01 2.92 0.00 -0.56 -1.20 119.26 122.79 1okk h ALA 85 Ca 0.20 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1okk h ALA 85 Cb 0.25 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1okk h ALA 85 CO -0.01 0.22 -0.07 1.28 0.00 0.00 0.00 179.25 180.66 1okk n LEU 86 N -3.73 0.78 0.00 0.00 4.77 -0.39 -4.75 117.00 113.68 1okk n LEU 86 Ca -0.02 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 1okk n LEU 86 Cb 0.28 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1okk n LEU 86 CO 0.32 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1okk n GLY 87 N 1.20 1.16 4.68 -0.72 0.00 -0.46 -4.67 105.19 106.39 1okk n GLY 87 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1okk n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1okk n GLY 88 N 0.00 2.23 3.34 -0.02 0.00 -0.13 -4.81 105.19 105.80 1okk n GLY 88 Ca 0.00 -0.06 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 1okk n GLY 88 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1okk s GLU 89 N 0.00 1.37 0.43 1.61 0.41 -1.26 -4.38 118.70 116.87 1okk s GLU 89 Ca 0.00 -1.70 -0.26 0.00 -0.41 0.00 0.00 54.97 52.60 1okk s GLU 89 Cb 0.00 -0.64 -0.09 0.00 -1.78 0.00 0.00 34.13 31.62 1okk s GLU 89 CO 0.00 -0.10 1.42 0.00 -0.49 0.00 0.00 175.26 176.08 1okk n ALA 90 N -0.44 1.98 -3.44 5.21 0.00 -1.26 -4.76 120.51 117.80 1okk n ALA 90 Ca -0.05 0.27 -0.12 0.00 0.00 0.00 0.00 53.44 53.54 1okk n ALA 90 Cb 0.64 -2.38 -0.10 0.00 0.00 0.00 0.00 19.45 17.61 1okk n ALA 90 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1okk s ARG 91 N -2.33 0.43 0.32 0.00 3.52 -1.26 -5.10 118.95 114.52 1okk s ARG 91 Ca 0.59 0.63 0.08 0.00 -0.13 0.00 0.00 55.73 56.91 1okk s ARG 91 Cb -0.47 0.13 -0.04 0.00 -1.56 0.00 0.00 34.95 33.01 1okk s ARG 91 CO 0.59 -0.09 0.11 -0.51 -0.81 0.00 0.00 175.30 174.59 1okk s LEU 92 N 0.65 3.28 0.49 -0.88 1.43 -1.26 -4.47 118.68 117.91 1okk s LEU 92 Ca -0.04 -0.71 -0.24 0.00 -1.03 0.00 0.00 54.13 52.11 1okk s LEU 92 Cb -0.05 -1.77 -0.07 0.00 0.03 0.00 0.00 46.19 44.34 1okk s LEU 92 CO -0.04 -0.21 1.41 -2.84 0.23 0.00 0.00 176.35 174.89 1okk s PRO 93 N -3.80 3.49 -0.10 1.29 0.02 -1.26 -4.95 135.00 129.68 1okk s PRO 93 Ca 0.36 2.37 -0.30 0.00 0.02 0.00 0.00 61.00 63.45 1okk s PRO 93 Cb -0.04 -2.52 -0.03 0.00 0.02 0.00 0.00 34.50 31.94 1okk s PRO 93 CO 0.22 -0.96 1.26 0.08 -0.33 0.00 0.00 177.00 177.28 1okk s VAL 94 N -1.23 4.20 0.22 3.83 1.01 -1.26 -5.01 120.40 122.15 1okk s VAL 94 Ca 0.65 1.49 -0.26 0.00 0.00 0.00 0.00 61.98 63.86 1okk s VAL 94 Cb -0.43 -3.96 -0.09 0.00 0.00 0.00 0.00 36.38 31.91 1okk s VAL 94 CO 0.54 -0.07 0.84 -0.76 0.00 0.00 0.00 175.10 175.65 1okk s LEU 95 N 2.92 4.54 0.00 3.92 1.43 -1.26 -5.08 118.68 125.16 1okk s LEU 95 Ca 0.57 1.73 0.01 0.00 -1.03 0.00 0.00 54.13 55.41 1okk s LEU 95 Cb -0.24 -3.52 0.01 0.00 0.03 0.00 0.00 46.19 42.47 1okk s LEU 95 CO 0.19 0.14 0.08 0.29 0.23 0.00 0.00 176.35 177.27 1okk n LYS 96 N 1.31 0.87 -0.22 1.70 5.02 -1.26 -5.03 118.16 120.55 1okk n LYS 96 Ca -0.03 -3.26 -0.01 0.00 -2.02 0.00 0.00 58.31 52.98 1okk n LYS 96 Cb 0.49 0.77 0.20 0.00 -0.02 0.00 0.00 35.03 36.47 1okk n LYS 96 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1okk h ASP 97 N 0.98 0.89 -3.31 4.39 3.32 -1.98 -3.40 116.42 117.31 1okk h ASP 97 Ca -0.36 -0.07 -0.50 0.00 0.02 0.00 0.00 57.03 56.12 1okk h ASP 97 Cb 1.14 -0.23 -0.35 0.00 0.22 0.00 0.00 39.33 40.11 1okk h ASP 97 CO 0.60 0.71 -0.80 -0.60 -1.72 0.00 0.00 179.24 177.43 1okk s ARG 98 N -5.68 1.44 -0.06 3.56 3.52 -1.26 -4.77 118.95 115.69 1okk s ARG 98 Ca -0.11 -0.27 0.04 0.00 -0.13 0.00 0.00 55.73 55.25 1okk s ARG 98 Cb 0.17 -1.39 0.00 0.00 -1.56 0.00 0.00 34.95 32.18 1okk s ARG 98 CO 0.80 -0.14 -0.17 -0.80 -0.81 0.00 0.00 175.30 174.18 1okk s ASN 99 N 1.24 2.21 -0.11 -2.12 -0.87 -0.69 -5.02 114.94 109.58 1okk s ASN 99 Ca -0.04 -0.37 -0.02 0.00 -1.57 0.00 0.00 52.86 50.85 1okk s ASN 99 Cb -0.14 -0.84 0.04 0.00 -0.02 0.00 0.00 41.25 40.29 1okk s ASN 99 CO -0.03 0.11 0.01 -0.22 -2.57 0.00 0.00 177.10 174.41 1okk s LEU 100 N 0.31 0.78 -0.00 0.60 0.20 -1.26 -0.31 118.68 119.00 1okk s LEU 100 Ca -0.10 -0.33 0.08 0.00 0.69 0.00 0.00 54.13 54.47 1okk s LEU 100 Cb -0.14 -0.50 -0.02 0.00 -0.43 0.00 0.00 46.19 45.10 1okk s LEU 100 CO 0.04 -0.23 -0.25 0.26 -0.29 0.00 0.00 176.35 175.88 1okk s TRP 101 N 1.93 2.36 -0.01 5.38 0.51 0.29 -0.95 118.94 128.45 1okk s TRP 101 Ca 0.03 -0.41 -0.08 0.00 -2.12 0.00 0.00 56.10 53.52 1okk s TRP 101 Cb -0.14 -1.48 -0.05 0.00 -0.81 0.00 0.00 33.47 30.99 1okk s TRP 101 CO -0.06 0.03 0.28 -0.06 -0.51 0.00 0.00 176.95 176.63 1okk s PHE 102 N -0.68 3.61 -0.26 -1.98 0.40 -0.59 -0.50 117.98 117.98 1okk s PHE 102 Ca 0.11 0.65 -0.08 0.00 -0.60 0.00 0.00 56.93 57.01 1okk s PHE 102 Cb -0.10 -2.04 -0.02 0.00 0.51 0.00 0.00 43.02 41.36 1okk s PHE 102 CO 0.00 0.63 0.08 -0.51 0.70 0.00 0.00 175.22 176.13 1okk s LEU 103 N -1.53 3.56 0.22 -0.37 1.43 -0.13 -0.83 118.68 121.03 1okk s LEU 103 Ca 0.25 -0.29 0.03 0.00 -1.03 0.00 0.00 54.13 53.09 1okk s LEU 103 Cb -0.14 -1.93 -0.05 0.00 0.03 0.00 0.00 46.19 44.10 1okk s LEU 103 CO 0.14 -0.07 -0.01 0.68 0.23 0.00 0.00 176.35 177.32 1okk s VAL 104 N 1.61 0.97 -5.00 -1.59 -7.23 -0.43 -2.60 120.40 106.13 1okk s VAL 104 Ca 0.06 -2.03 0.00 0.00 -1.81 0.00 0.00 61.98 58.20 1okk s VAL 104 Cb -0.16 -2.28 0.00 0.00 0.56 0.00 0.00 36.38 34.50 1okk s VAL 104 CO 0.04 -0.37 0.00 0.61 -0.31 0.00 0.00 175.10 175.07 1okk n GLY 105 N -0.38 0.01 3.77 2.32 0.00 -1.26 -0.78 105.19 108.87 1okk n GLY 105 Ca -0.05 -1.74 -0.32 0.00 0.00 0.00 0.00 46.02 43.90 1okk n GLY 105 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1okk s LEU 106 N 0.00 3.26 -0.23 0.99 1.43 -1.25 -1.93 118.68 120.94 1okk s LEU 106 Ca 0.00 1.92 -0.38 0.00 -1.03 0.00 0.00 54.13 54.64 1okk s LEU 106 Cb 0.00 -4.54 -0.14 0.00 0.03 0.00 0.00 46.19 41.54 1okk s LEU 106 CO 0.00 -1.75 1.80 0.00 0.23 0.00 0.00 176.35 176.63 1okk n GLN 107 N -2.80 1.43 -0.18 1.70 3.00 -1.26 -2.50 117.38 116.76 1okk n GLN 107 Ca 0.10 0.52 0.00 0.00 -0.01 0.00 0.00 57.00 57.61 1okk n GLN 107 Cb 0.52 -2.26 0.00 0.00 0.00 0.00 0.00 30.24 28.50 1okk n GLN 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1okk n GLY 108 N 4.36 0.67 0.30 1.08 0.00 -1.26 -4.96 105.19 105.37 1okk n GLY 108 Ca 0.26 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.47 1okk n GLY 108 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1okk h SER 109 N 0.00 0.00 0.00 1.61 4.64 -1.80 -3.46 113.55 114.54 1okk h SER 109 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1okk h SER 109 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1okk h SER 109 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1okk n GLY 110 N -0.33 1.84 0.14 -0.77 0.00 -1.26 -4.17 105.19 100.64 1okk n GLY 110 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1okk n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1okk h LYS 111 N 0.01 0.40 -0.29 1.61 1.57 -1.91 -0.91 116.57 117.05 1okk h LYS 111 Ca 0.00 -0.14 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 1okk h LYS 111 Cb 0.00 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1okk h LYS 111 CO 0.00 0.62 -0.03 1.15 -0.57 0.00 0.00 179.45 180.62 1okk h THR 112 N 0.14 1.27 -0.63 -0.16 2.02 -1.96 0.43 112.91 114.02 1okk h THR 112 Ca 0.06 -1.01 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 1okk h THR 112 Cb 0.46 1.35 -0.03 0.00 -1.74 0.00 0.00 68.15 68.20 1okk h THR 112 CO 0.02 0.32 0.38 0.74 0.37 0.00 0.00 175.52 177.35 1okk h THR 113 N 0.30 1.18 -0.35 3.16 2.02 -1.96 -2.73 112.91 114.53 1okk h THR 113 Ca 0.08 -0.41 -0.09 0.00 0.77 0.00 0.00 66.41 66.76 1okk h THR 113 Cb 0.49 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 1okk h THR 113 CO 0.02 0.19 -0.15 0.74 0.37 0.00 0.00 175.52 176.69 1okk h THR 114 N 0.85 1.25 -0.67 3.16 2.02 -0.80 -0.80 112.91 117.92 1okk h THR 114 Ca 0.23 -1.16 0.01 0.00 0.77 0.00 0.00 66.41 66.26 1okk h THR 114 Cb -0.02 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.51 1okk h THR 114 CO -0.04 0.38 0.44 0.00 0.37 0.00 0.00 175.52 176.67 1okk h ALA 115 N 1.27 0.85 -0.32 6.16 0.00 -0.68 -0.10 119.26 126.45 1okk h ALA 115 Ca 0.10 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 1okk h ALA 115 Cb 0.59 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1okk h ALA 115 CO 0.04 0.27 -0.45 0.00 0.00 0.00 0.00 179.25 179.11 1okk h ALA 116 N 1.25 0.61 -0.53 0.00 0.00 -1.17 -1.83 119.26 117.59 1okk h ALA 116 Ca 0.25 -0.47 0.02 0.00 0.00 0.00 0.00 54.91 54.70 1okk h ALA 116 Cb -0.09 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1okk h ALA 116 CO -0.06 0.68 0.33 0.87 0.00 0.00 0.00 179.25 181.07 1okk h LYS 117 N 0.66 0.64 -0.63 0.00 1.57 -0.90 -1.32 116.57 116.58 1okk h LYS 117 Ca 0.04 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1okk h LYS 117 Cb 1.02 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.16 1okk h LYS 117 CO 0.10 0.42 0.19 -0.07 -0.57 0.00 0.00 179.45 179.52 1okk h LEU 118 N 0.66 0.90 -0.32 2.94 3.38 -0.90 -0.50 115.31 121.47 1okk h LEU 118 Ca 0.21 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1okk h LEU 118 Cb -0.01 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1okk h LEU 118 CO -0.08 0.85 0.16 0.00 0.09 0.00 0.00 178.44 179.46 1okk h ALA 119 N 1.27 0.42 -0.43 1.53 0.00 -0.86 -1.46 119.26 119.72 1okk h ALA 119 Ca 0.21 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1okk h ALA 119 Cb 0.28 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1okk h ALA 119 CO -0.01 -0.03 0.07 1.25 0.00 0.00 0.00 179.25 180.53 1okk h LEU 120 N 0.39 0.69 -0.05 0.00 5.85 -1.04 -0.28 115.31 120.87 1okk h LEU 120 Ca 0.11 -0.26 0.01 0.00 0.84 0.00 0.00 57.88 58.58 1okk h LEU 120 Cb 0.10 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 1okk h LEU 120 CO -0.02 0.78 0.00 0.22 -0.34 0.00 0.00 178.44 179.08 1okk h TYR 121 N 0.58 -0.00 0.00 1.25 3.20 -0.94 -2.62 116.97 118.43 1okk h TYR 121 Ca 0.13 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.88 1okk h TYR 121 Cb 0.38 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.65 1okk h TYR 121 CO 0.03 -0.00 -0.58 1.88 -1.64 0.00 0.00 178.16 177.84 1okk h TYR 122 N 0.02 0.00 -1.00 -3.82 0.05 -1.23 -2.97 116.97 108.01 1okk h TYR 122 Ca 0.02 0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.85 1okk h TYR 122 Cb 0.03 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 37.70 1okk h TYR 122 CO -0.10 0.58 0.65 -0.22 -1.05 0.00 0.00 178.16 178.02 1okk h LYS 123 N 0.00 1.19 0.00 4.88 3.64 -0.95 -0.86 116.57 124.47 1okk h LYS 123 Ca -0.01 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1okk h LYS 123 Cb 1.41 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1okk h LYS 123 CO 0.08 0.79 0.00 0.41 -2.27 0.00 0.00 179.45 178.45 1okk n GLY 124 N -1.37 -1.11 1.49 5.01 0.00 -1.00 -2.76 105.19 105.45 1okk n GLY 124 Ca 0.14 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 1okk n GLY 124 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1okk n LYS 125 N -1.47 2.49 -0.90 1.61 5.02 -0.71 -4.97 118.16 119.24 1okk n LYS 125 Ca 0.05 -3.56 0.00 0.00 -2.02 0.00 0.00 58.31 52.78 1okk n LYS 125 Cb 0.21 -1.99 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 1okk n LYS 125 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1okk n GLY 126 N -0.96 0.88 3.90 0.72 0.00 -1.11 -5.01 105.19 103.60 1okk n GLY 126 Ca 0.38 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.12 1okk n GLY 126 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1okk s ARG 127 N -0.10 3.12 -0.55 1.61 1.81 -0.41 -5.01 118.95 119.41 1okk s ARG 127 Ca 0.00 0.20 0.03 0.00 -1.72 0.00 0.00 55.73 54.24 1okk s ARG 127 Cb 0.00 -2.23 0.14 0.00 -0.45 0.00 0.00 34.95 32.40 1okk s ARG 127 CO 0.00 -0.63 0.30 1.03 -0.68 0.00 0.00 175.30 175.32 1okk s ARG 128 N -5.02 2.09 0.66 3.54 0.52 -1.26 -4.18 118.95 115.31 1okk s ARG 128 Ca 0.53 -2.69 -0.12 0.00 -0.52 0.00 0.00 55.73 52.94 1okk s ARG 128 Cb -0.11 -3.38 -0.01 0.00 0.52 0.00 0.00 34.95 31.98 1okk s ARG 128 CO 0.47 -1.13 1.05 -2.14 0.02 0.00 0.00 175.30 173.57 1okk s PRO 129 N -0.38 3.12 -0.08 3.54 0.02 -1.26 -1.29 135.00 138.68 1okk s PRO 129 Ca 0.18 0.96 0.00 0.00 0.02 0.00 0.00 61.00 62.16 1okk s PRO 129 Cb -0.24 -2.01 0.02 0.00 0.02 0.00 0.00 34.50 32.29 1okk s PRO 129 CO -0.02 -0.95 -0.06 -1.17 -0.33 0.00 0.00 177.00 174.47 1okk s LEU 130 N -5.29 1.17 0.11 -5.54 2.96 0.34 -4.43 118.68 107.99 1okk s LEU 130 Ca 0.58 -0.20 -0.19 0.00 -0.22 0.00 0.00 54.13 54.10 1okk s LEU 130 Cb -0.14 -0.64 -0.07 0.00 0.50 0.00 0.00 46.19 45.85 1okk s LEU 130 CO 0.51 -0.09 0.60 -0.76 -1.32 0.00 0.00 176.35 175.30 1okk s LEU 131 N 1.36 4.49 -0.19 -0.68 1.43 -0.24 -0.84 118.68 124.01 1okk s LEU 131 Ca -0.03 1.29 0.01 0.00 -1.03 0.00 0.00 54.13 54.37 1okk s LEU 131 Cb -0.14 -3.06 0.04 0.00 0.03 0.00 0.00 46.19 43.06 1okk s LEU 131 CO -0.03 0.22 -0.09 -0.69 0.23 0.00 0.00 176.35 175.98 1okk s VAL 132 N -1.21 1.53 -0.93 -1.59 1.01 0.11 -0.87 120.40 118.45 1okk s VAL 132 Ca 0.32 -0.91 -0.18 0.00 0.00 0.00 0.00 61.98 61.21 1okk s VAL 132 Cb -0.19 -1.62 0.14 0.00 0.00 0.00 0.00 36.38 34.72 1okk s VAL 132 CO 0.20 0.17 1.10 0.00 0.00 0.00 0.00 175.10 176.57 1okk s ALA 133 N 1.45 3.49 -2.47 5.51 0.00 -0.42 -1.01 121.76 128.31 1okk s ALA 133 Ca -0.01 -2.87 0.23 0.00 0.00 0.00 0.00 51.96 49.31 1okk s ALA 133 Cb -0.16 -3.99 0.47 0.00 0.00 0.00 0.00 23.12 19.44 1okk s ALA 133 CO -0.08 -2.88 1.42 0.00 0.00 0.00 0.00 175.76 174.22 1okk n ALA 134 N 6.17 2.44 -2.68 0.00 0.00 -0.73 -1.78 120.51 123.93 1okk n ALA 134 Ca 0.23 -0.91 -0.43 0.00 0.00 0.00 0.00 53.44 52.33 1okk n ALA 134 Cb 0.49 -0.91 -0.04 0.00 0.00 0.00 0.00 19.45 18.99 1okk n ALA 134 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1okk s ASP 135 N -1.52 6.31 0.00 0.00 -1.08 -1.21 -4.58 116.67 114.60 1okk s ASP 135 Ca 0.37 -0.44 0.17 0.00 -0.52 0.00 0.00 52.55 52.13 1okk s ASP 135 Cb 0.22 -2.44 0.37 0.00 -1.46 0.00 0.00 42.92 39.61 1okk s ASP 135 CO 0.31 -1.28 1.29 0.35 0.52 0.00 0.00 175.17 176.36 1okk n THR 136 N 6.17 0.68 -0.11 1.71 -2.24 -1.26 -4.27 114.28 114.96 1okk n THR 136 Ca 0.01 -0.84 -0.14 0.00 -2.27 0.00 0.00 64.05 60.81 1okk n THR 136 Cb 0.47 0.78 -0.10 0.00 -2.10 0.00 0.00 70.33 69.38 1okk n THR 136 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1okk n GLN 137 N 1.06 0.63 -2.53 -0.78 10.64 -1.26 -4.95 117.38 120.20 1okk n GLN 137 Ca 0.16 0.11 -0.42 0.00 -1.83 0.00 0.00 57.00 55.01 1okk n GLN 137 Cb 0.50 -1.43 -0.03 0.00 -0.86 0.00 0.00 30.24 28.42 1okk n GLN 137 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.06 175.73 1okk s ARG 138 N -2.43 4.45 0.23 2.61 3.52 -1.26 -4.97 118.95 121.11 1okk s ARG 138 Ca -0.27 1.63 -0.32 0.00 -0.13 0.00 0.00 55.73 56.65 1okk s ARG 138 Cb 0.07 -3.43 -0.12 0.00 -1.56 0.00 0.00 34.95 29.91 1okk s ARG 138 CO 0.53 -0.24 1.64 -2.30 -0.81 0.00 0.00 175.30 174.12 1okk n PRO 139 N 4.22 2.63 -1.60 5.12 -0.02 -1.26 -1.94 135.00 142.15 1okk n PRO 139 Ca 0.08 0.94 -0.15 0.00 -2.02 0.00 0.00 63.50 62.35 1okk n PRO 139 Cb 0.48 -2.75 -0.05 0.00 -0.02 0.00 0.00 33.50 31.16 1okk n PRO 139 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1okk n ALA 140 N 3.17 -0.27 -0.09 3.55 0.00 -1.26 -4.92 120.51 120.69 1okk n ALA 140 Ca 0.13 0.22 -0.12 0.00 0.00 0.00 0.00 53.44 53.68 1okk n ALA 140 Cb 0.34 -1.66 -0.05 0.00 0.00 0.00 0.00 19.45 18.09 1okk n ALA 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1okk h ALA 141 N 0.14 0.36 -0.29 0.00 0.00 -1.68 -1.03 119.26 116.76 1okk h ALA 141 Ca -0.32 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.11 1okk h ALA 141 Cb 1.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1okk h ALA 141 CO 0.45 0.24 -0.45 0.00 0.00 0.00 0.00 179.25 179.49 1okk h ARG 142 N 0.27 0.74 -0.71 0.00 3.08 -1.83 -2.60 114.38 113.33 1okk h ARG 142 Ca 0.06 -0.41 -0.02 0.00 0.07 0.00 0.00 59.98 59.68 1okk h ARG 142 Cb 0.65 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.69 1okk h ARG 142 CO 0.04 1.03 0.37 1.49 -1.07 0.00 0.00 179.97 181.84 1okk h GLU 143 N 0.59 0.99 -0.38 0.04 4.81 -1.96 -0.47 114.58 118.21 1okk h GLU 143 Ca 0.04 -0.12 0.06 0.00 -0.13 0.00 0.00 59.36 59.20 1okk h GLU 143 Cb 1.01 -0.19 -0.05 0.00 0.63 0.00 0.00 28.75 30.15 1okk h GLU 143 CO 0.10 0.75 0.07 0.37 -0.73 0.00 0.00 179.01 179.57 1okk h GLN 144 N 0.98 0.19 -0.08 1.92 4.15 -0.93 -0.11 115.11 121.22 1okk h GLN 144 Ca 0.25 -0.01 -0.21 0.00 0.77 0.00 0.00 58.65 59.44 1okk h GLN 144 Cb 0.06 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.71 1okk h GLN 144 CO -0.04 0.12 -0.81 1.25 -1.93 0.00 0.00 178.83 177.43 1okk h LEU 145 N 0.19 0.68 -0.50 -2.39 5.85 -1.27 -2.07 115.31 115.81 1okk h LEU 145 Ca 0.18 -0.47 0.08 0.00 0.84 0.00 0.00 57.88 58.51 1okk h LEU 145 Cb 0.21 -0.20 -0.07 0.00 0.37 0.00 0.00 40.66 40.97 1okk h LEU 145 CO -0.24 1.25 0.12 -0.09 -0.34 0.00 0.00 178.44 179.13 1okk h ARG 146 N 0.37 0.26 -0.50 1.25 2.43 -0.83 0.37 114.38 117.72 1okk h ARG 146 Ca -0.05 -0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.00 1okk h ARG 146 Cb 1.42 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.89 1okk h ARG 146 CO 0.15 0.17 -0.09 -0.07 -1.51 0.00 0.00 179.97 178.62 1okk h LEU 147 N 0.26 0.91 -0.68 3.80 3.38 -0.81 -1.69 115.31 120.48 1okk h LEU 147 Ca 0.25 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 1okk h LEU 147 Cb 0.32 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1okk h LEU 147 CO -0.31 1.02 0.07 -0.07 0.09 0.00 0.00 178.44 179.24 1okk h LEU 148 N 0.83 1.05 -0.62 1.67 3.38 -1.01 -2.12 115.31 118.49 1okk h LEU 148 Ca 0.14 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1okk h LEU 148 Cb 0.62 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 1okk h LEU 148 CO 0.04 1.06 0.36 1.23 0.09 0.00 0.00 178.44 181.22 1okk h GLY 149 N 1.03 0.91 0.94 0.83 0.00 -0.52 -0.96 103.07 105.29 1okk h GLY 149 Ca 0.19 -0.39 0.01 0.00 0.00 0.00 0.00 47.33 47.15 1okk h GLY 149 CO 0.02 0.38 0.31 -2.09 0.00 0.00 0.00 176.54 175.15 1okk h GLU 150 N 0.84 0.60 -0.99 4.80 4.81 -1.16 0.53 114.58 124.01 1okk h GLU 150 Ca 0.22 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.42 1okk h GLU 150 Cb 0.00 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.20 1okk h GLU 150 CO -0.04 0.40 0.65 -0.22 -0.73 0.00 0.00 179.01 179.07 1okk h LYS 151 N 0.62 1.30 -0.01 1.92 3.64 -0.81 -2.92 116.57 120.31 1okk h LYS 151 Ca 0.19 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1okk h LYS 151 Cb -0.03 -0.29 0.00 0.00 -0.41 0.00 0.00 32.23 31.50 1okk h LYS 151 CO -0.07 0.86 -0.28 1.33 -2.27 0.00 0.00 179.45 179.03 1okk n VAL 152 N -4.40 0.00 -2.92 2.00 0.24 -0.42 -4.97 118.33 107.87 1okk n VAL 152 Ca 0.12 -0.21 -0.09 0.00 -2.04 0.00 0.00 64.34 62.11 1okk n VAL 152 Cb 0.01 0.76 0.03 0.00 -1.47 0.00 0.00 33.84 33.18 1okk n VAL 152 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1okk n GLY 153 N 1.35 0.34 2.99 7.63 0.00 0.04 -4.85 105.19 112.68 1okk n GLY 153 Ca 0.12 -0.30 -0.22 0.00 0.00 0.00 0.00 46.02 45.63 1okk n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1okk s VAL 154 N -3.13 0.86 0.70 1.61 1.01 -0.39 -5.04 120.40 116.03 1okk s VAL 154 Ca 0.22 -0.36 -0.15 0.00 0.00 0.00 0.00 61.98 61.69 1okk s VAL 154 Cb -0.10 -0.79 0.02 0.00 0.00 0.00 0.00 36.38 35.51 1okk s VAL 154 CO 0.29 0.28 1.17 -2.16 0.00 0.00 0.00 175.10 174.69 1okk s PRO 155 N 0.48 2.39 -0.15 2.72 0.04 -1.26 -4.28 135.00 134.94 1okk s PRO 155 Ca -0.08 1.63 -0.01 0.00 0.04 0.00 0.00 61.00 62.57 1okk s PRO 155 Cb -0.12 -1.88 0.04 0.00 0.04 0.00 0.00 34.50 32.58 1okk s PRO 155 CO 0.01 -1.61 -0.02 0.08 0.04 0.00 0.00 177.00 175.50 1okk s VAL 156 N -2.10 0.78 -0.17 -0.36 1.01 -1.26 -1.08 120.40 117.22 1okk s VAL 156 Ca 0.72 -0.43 -0.20 0.00 0.00 0.00 0.00 61.98 62.06 1okk s VAL 156 Cb -0.26 -1.04 -0.03 0.00 0.00 0.00 0.00 36.38 35.05 1okk s VAL 156 CO 0.43 0.07 0.59 -0.22 0.00 0.00 0.00 175.10 175.98 1okk s LEU 157 N 1.77 4.18 -0.20 3.92 0.20 -0.05 -4.97 118.68 123.53 1okk s LEU 157 Ca 0.01 0.83 -0.08 0.00 0.69 0.00 0.00 54.13 55.58 1okk s LEU 157 Cb -0.15 -2.84 -0.04 0.00 -0.43 0.00 0.00 46.19 42.72 1okk s LEU 157 CO -0.07 -0.20 0.09 -1.61 -0.29 0.00 0.00 176.35 174.27 1okk s GLU 158 N 1.56 4.00 0.35 1.98 2.02 -1.26 -1.30 118.70 126.05 1okk s GLU 158 Ca 0.28 -0.32 -0.27 0.00 0.02 0.00 0.00 54.97 54.68 1okk s GLU 158 Cb -0.16 -3.32 -0.09 0.00 0.10 0.00 0.00 34.13 30.66 1okk s GLU 158 CO 0.11 0.19 1.11 0.08 0.02 0.00 0.00 175.26 176.77 1okk s VAL 159 N 0.62 3.44 0.29 2.63 1.01 -0.73 -4.96 120.40 122.70 1okk s VAL 159 Ca 0.05 1.28 -0.10 0.00 0.00 0.00 0.00 61.98 63.21 1okk s VAL 159 Cb -0.13 -3.75 -0.07 0.00 0.00 0.00 0.00 36.38 32.43 1okk s VAL 159 CO 0.01 0.18 0.63 -0.04 0.00 0.00 0.00 175.10 175.88 1okk s MET 160 N -1.99 3.81 0.18 2.72 1.00 -1.26 -4.92 119.30 118.84 1okk s MET 160 Ca 0.52 0.34 -0.33 0.00 0.00 0.00 0.00 55.69 56.21 1okk s MET 160 Cb -0.29 -2.56 -0.14 0.00 0.00 0.00 0.00 34.83 31.84 1okk s MET 160 CO 0.37 0.20 1.41 -0.25 0.00 0.00 0.00 175.02 176.75 1okk n ASP 161 N -0.53 2.44 0.00 3.03 8.00 -1.26 -1.92 116.55 126.31 1okk n ASP 161 Ca 0.01 1.12 0.00 0.00 0.71 0.00 0.00 54.79 56.63 1okk n ASP 161 Cb 0.53 -1.35 0.00 0.00 -0.02 0.00 0.00 41.12 40.28 1okk n ASP 161 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1okk n GLY 162 N 2.60 1.34 3.76 0.44 0.00 -1.26 -4.99 105.19 107.07 1okk n GLY 162 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1okk n GLY 162 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1okk s GLU 163 N -0.10 4.29 0.60 1.61 2.12 -0.81 -4.98 118.70 121.43 1okk s GLU 163 Ca 0.00 2.29 -0.15 0.00 0.36 0.00 0.00 54.97 57.47 1okk s GLU 163 Cb 0.00 -3.08 -0.04 0.00 0.26 0.00 0.00 34.13 31.27 1okk s GLU 163 CO 0.00 -0.34 1.04 -1.54 -0.54 0.00 0.00 175.26 173.89 1okk s SER 164 N -0.03 5.91 0.39 -1.70 1.04 -1.26 -4.90 113.70 113.15 1okk s SER 164 Ca 0.54 1.71 0.07 0.00 0.48 0.00 0.00 55.95 58.76 1okk s SER 164 Cb -0.41 -2.52 0.83 0.00 0.10 0.00 0.00 66.02 64.02 1okk s SER 164 CO 0.49 -1.08 2.00 -0.65 0.98 0.00 0.00 173.24 174.98 1okk h PRO 165 N 0.28 0.61 -0.20 4.02 0.11 -1.96 -1.86 132.00 133.00 1okk h PRO 165 Ca -0.46 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.52 1okk h PRO 165 Cb 1.21 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1okk h PRO 165 CO 0.58 0.40 -0.28 0.93 -0.21 0.00 0.00 178.00 179.43 1okk h GLU 166 N 0.63 0.39 -0.14 1.05 3.07 -1.97 -1.12 114.58 116.49 1okk h GLU 166 Ca 0.24 -0.15 -0.21 0.00 -0.50 0.00 0.00 59.36 58.74 1okk h GLU 166 Cb 0.17 -0.02 0.01 0.00 -0.84 0.00 0.00 28.75 28.06 1okk h GLU 166 CO -0.07 0.64 -0.74 1.03 -1.40 0.00 0.00 179.01 178.47 1okk h SER 167 N 0.34 0.81 -0.41 1.42 0.87 -1.79 -2.05 113.55 112.74 1okk h SER 167 Ca 0.05 -0.52 0.03 0.00 -1.23 0.00 0.00 61.79 60.11 1okk h SER 167 Cb 0.67 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.36 1okk h SER 167 CO 0.05 1.30 0.22 0.40 -0.53 0.00 0.00 176.83 178.28 1okk h ILE 168 N 0.48 1.00 -0.06 2.23 2.04 -1.12 -1.68 117.51 120.40 1okk h ILE 168 Ca -0.04 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 1okk h ILE 168 Cb 1.36 0.51 -0.00 0.00 -0.74 0.00 0.00 36.82 37.95 1okk h ILE 168 CO 0.15 0.08 0.04 -0.09 0.00 0.00 0.00 178.15 178.32 1okk h ARG 169 N 0.45 0.08 -0.26 2.37 2.43 -1.09 -0.16 114.38 118.20 1okk h ARG 169 Ca 0.17 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.40 1okk h ARG 169 Cb 0.05 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 29.51 1okk h ARG 169 CO -0.10 0.09 -0.29 -0.09 -1.51 0.00 0.00 179.97 178.07 1okk h ARG 170 N 0.05 -0.28 -0.27 0.20 2.43 -1.23 0.21 114.38 115.49 1okk h ARG 170 Ca 0.02 0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 59.06 1okk h ARG 170 Cb 0.03 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1okk h ARG 170 CO -0.00 -0.19 -0.43 0.00 -1.51 0.00 0.00 179.97 177.84 1okk h ARG 171 N -0.29 0.67 -0.25 0.20 3.08 -1.07 -1.45 114.38 115.27 1okk h ARG 171 Ca 0.14 -0.36 -0.05 0.00 0.07 0.00 0.00 59.98 59.78 1okk h ARG 171 Cb 0.51 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 1okk h ARG 171 CO -0.42 0.97 -0.02 0.28 -1.07 0.00 0.00 179.97 179.70 1okk h VAL 172 N 0.54 1.27 -0.84 2.04 2.07 -0.81 -1.84 116.25 118.68 1okk h VAL 172 Ca 0.04 -0.96 -0.02 0.00 0.82 0.00 0.00 66.70 66.58 1okk h VAL 172 Cb 0.96 1.40 -0.04 0.00 -1.52 0.00 0.00 31.29 32.10 1okk h VAL 172 CO 0.09 0.30 0.45 -0.33 0.02 0.00 0.00 177.57 178.10 1okk h GLU 173 N 0.22 1.17 -0.16 1.57 5.08 -0.40 -0.87 114.58 121.18 1okk h GLU 173 Ca 0.07 -0.14 -0.09 0.00 -1.00 0.00 0.00 59.36 58.20 1okk h GLU 173 Cb 0.45 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 1okk h GLU 173 CO 0.02 0.87 -0.25 1.49 -1.00 0.00 0.00 179.01 180.13 1okk h GLU 174 N 1.18 0.46 -0.65 2.33 4.57 -1.15 -1.25 114.58 120.06 1okk h GLU 174 Ca 0.29 -0.27 -0.06 0.00 -1.18 0.00 0.00 59.36 58.14 1okk h GLU 174 Cb 0.04 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.63 1okk h GLU 174 CO -0.05 0.87 0.18 -0.22 -1.18 0.00 0.00 179.01 178.61 1okk h LYS 175 N 0.08 1.03 -0.54 1.92 3.64 -1.24 -1.51 116.57 119.96 1okk h LYS 175 Ca 0.01 -0.24 -0.08 0.00 -1.27 0.00 0.00 60.65 59.07 1okk h LYS 175 Cb 0.83 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 1okk h LYS 175 CO 0.06 0.92 -0.01 0.00 -2.27 0.00 0.00 179.45 178.15 1okk h ALA 176 N 1.07 0.98 -0.05 5.00 0.00 -1.11 -1.81 119.26 123.34 1okk h ALA 176 Ca 0.21 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1okk h ALA 176 Cb 0.34 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1okk h ALA 176 CO -0.00 0.62 -0.03 -0.09 0.00 0.00 0.00 179.25 179.75 1okk h ARG 177 N 0.85 0.10 -0.65 0.00 2.43 -1.04 0.29 114.38 116.36 1okk h ARG 177 Ca 0.16 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1okk h ARG 177 Cb 0.51 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.02 1okk h ARG 177 CO 0.03 0.50 0.42 -0.07 -1.51 0.00 0.00 179.97 179.34 1okk h LEU 178 N -0.30 0.76 -2.36 3.80 3.38 -1.21 -3.00 115.31 116.38 1okk h LEU 178 Ca 0.01 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1okk h LEU 178 Cb 0.47 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1okk h LEU 178 CO 0.01 0.57 0.00 -0.62 0.09 0.00 0.00 178.44 178.48 1okk n GLU 179 N -4.61 2.47 -3.76 1.13 1.02 -0.69 -4.97 120.64 111.23 1okk n GLU 179 Ca 0.05 -2.27 -0.23 0.00 -0.02 0.00 0.00 57.16 54.69 1okk n GLU 179 Cb 0.03 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 29.97 1okk n GLU 179 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1okk n ALA 180 N 1.44 -1.97 -2.71 0.62 0.00 -0.14 -4.96 120.51 112.79 1okk n ALA 180 Ca 0.19 -0.16 -0.40 0.00 0.00 0.00 0.00 53.44 53.07 1okk n ALA 180 Cb 0.59 -2.00 -0.05 0.00 0.00 0.00 0.00 19.45 17.99 1okk n ALA 180 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1okk s ARG 181 N -6.12 4.39 0.00 0.00 1.81 -0.09 -4.78 118.95 114.16 1okk s ARG 181 Ca 0.04 0.82 0.02 0.00 -1.72 0.00 0.00 55.73 54.89 1okk s ARG 181 Cb -0.02 -3.47 0.03 0.00 -0.45 0.00 0.00 34.95 31.04 1okk s ARG 181 CO 0.83 0.00 0.77 -0.40 -0.68 0.00 0.00 175.30 175.82 1okk n ASP 182 N 4.05 1.60 -3.67 0.23 5.68 -0.41 -4.76 116.55 119.26 1okk n ASP 182 Ca -0.01 -1.48 -0.27 0.00 -0.50 0.00 0.00 54.79 52.53 1okk n ASP 182 Cb 0.51 -0.02 -0.17 0.00 -1.14 0.00 0.00 41.12 40.31 1okk n ASP 182 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 1okk s LEU 183 N -0.53 0.84 -0.23 -2.12 2.96 -1.18 -1.71 118.68 116.72 1okk s LEU 183 Ca 0.03 -0.80 -0.06 0.00 -0.22 0.00 0.00 54.13 53.08 1okk s LEU 183 Cb 0.02 -0.45 -0.02 0.00 0.50 0.00 0.00 46.19 46.24 1okk s LEU 183 CO 0.03 -0.34 0.03 -0.63 -1.32 0.00 0.00 176.35 174.12 1okk s ILE 184 N 1.98 4.06 -0.28 6.68 1.01 0.58 -0.50 121.20 134.72 1okk s ILE 184 Ca 0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 60.65 60.39 1okk s ILE 184 Cb -0.17 -2.87 0.05 0.00 0.01 0.00 0.00 42.46 39.48 1okk s ILE 184 CO -0.11 0.38 -0.04 -0.76 0.00 0.00 0.00 174.94 174.42 1okk s LEU 185 N 1.37 3.63 -0.39 2.97 1.43 -0.02 -0.55 118.68 127.13 1okk s LEU 185 Ca 0.05 -1.20 -0.12 0.00 -1.03 0.00 0.00 54.13 51.82 1okk s LEU 185 Cb -0.15 -1.67 0.03 0.00 0.03 0.00 0.00 46.19 44.43 1okk s LEU 185 CO 0.02 -0.21 0.24 -0.69 0.23 0.00 0.00 176.35 175.94 1okk s VAL 186 N 1.24 4.83 -0.26 -1.59 1.01 0.35 -0.71 120.40 125.26 1okk s VAL 186 Ca -0.05 -0.80 -0.22 0.00 0.00 0.00 0.00 61.98 60.91 1okk s VAL 186 Cb -0.19 -3.70 -0.01 0.00 0.00 0.00 0.00 36.38 32.48 1okk s VAL 186 CO -0.03 -0.27 0.72 -0.62 0.00 0.00 0.00 175.10 174.90 1okk s ASP 187 N 1.61 6.66 0.23 3.32 2.15 -0.18 -0.95 116.67 129.51 1okk s ASP 187 Ca 0.03 0.77 0.08 0.00 0.43 0.00 0.00 52.55 53.86 1okk s ASP 187 Cb -0.19 -2.38 -0.04 0.00 -0.30 0.00 0.00 42.92 40.01 1okk s ASP 187 CO 0.08 -0.47 0.10 0.42 -0.17 0.00 0.00 175.17 175.13 1okk s THR 188 N 2.70 4.03 0.59 1.71 -4.23 -1.07 -1.76 115.64 117.60 1okk s THR 188 Ca 0.30 -1.53 -0.19 0.00 -1.18 0.00 0.00 61.69 59.09 1okk s THR 188 Cb -0.15 -3.13 -0.04 0.00 1.34 0.00 0.00 72.50 70.52 1okk s THR 188 CO 0.09 -0.29 1.20 0.00 -0.54 0.00 0.00 174.62 175.08 1okk s ALA 189 N -2.08 2.54 0.36 3.99 0.00 -1.26 -4.80 121.76 120.51 1okk s ALA 189 Ca 0.31 0.98 -0.28 0.00 0.00 0.00 0.00 51.96 52.97 1okk s ALA 189 Cb -0.08 -3.44 -0.10 0.00 0.00 0.00 0.00 23.12 19.50 1okk s ALA 189 CO 0.22 -1.15 1.35 0.20 0.00 0.00 0.00 175.76 176.38 1okk s GLY 190 N -1.64 2.97 -0.01 0.00 0.00 -1.26 -4.70 107.32 102.68 1okk s GLY 190 Ca 0.77 1.33 -0.15 0.00 0.00 0.00 0.00 44.72 46.67 1okk s GLY 190 CO 0.33 1.98 0.31 1.09 0.00 0.00 0.00 173.10 176.81 1okk s ARG 191 N -1.96 0.68 0.41 2.90 1.70 -0.81 -4.59 118.95 117.28 1okk s ARG 191 Ca 0.51 -0.22 -0.24 0.00 -0.47 0.00 0.00 55.73 55.31 1okk s ARG 191 Cb -0.41 0.30 -0.09 0.00 -0.57 0.00 0.00 34.95 34.19 1okk s ARG 191 CO 0.55 -0.19 1.09 -0.51 -1.08 0.00 0.00 175.30 175.16 1okk s LEU 192 N -1.40 4.14 0.43 -1.89 1.43 -1.26 -3.93 118.68 116.19 1okk s LEU 192 Ca -0.13 2.14 0.30 0.00 -1.03 0.00 0.00 54.13 55.42 1okk s LEU 192 Cb -0.05 -4.15 1.36 0.00 0.03 0.00 0.00 46.19 43.38 1okk s LEU 192 CO 0.04 -0.59 1.90 0.06 0.23 0.00 0.00 176.35 177.98 1okk h GLN 193 N 2.48 0.00 -0.37 1.70 -0.00 -1.95 -2.48 115.11 114.49 1okk h GLN 193 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.17 1okk h GLN 193 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.70 1okk h GLN 193 CO 0.62 0.00 0.00 0.44 -0.00 0.00 0.00 178.83 179.89 1okk n ILE 194 N -2.66 0.52 -2.76 1.86 -5.35 -1.26 -4.81 119.36 104.89 1okk n ILE 194 Ca 0.00 -0.76 -0.43 0.00 -0.27 0.00 0.00 62.75 61.30 1okk n ILE 194 Cb 0.20 0.95 -0.03 0.00 -1.74 0.00 0.00 39.64 39.03 1okk n ILE 194 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1okk s ASP 195 N -1.38 6.47 0.16 7.28 -1.08 -0.93 -4.91 116.67 122.27 1okk s ASP 195 Ca 0.36 -1.54 -0.15 0.00 -0.52 0.00 0.00 52.55 50.70 1okk s ASP 195 Cb 0.21 -2.47 0.04 0.00 -1.46 0.00 0.00 42.92 39.23 1okk s ASP 195 CO 0.29 -1.34 1.78 -0.33 0.52 0.00 0.00 175.17 176.09 1okk h GLU 196 N 9.37 0.65 -0.67 4.34 4.39 -1.87 -0.06 114.58 130.74 1okk h GLU 196 Ca 0.06 -0.07 0.03 0.00 0.34 0.00 0.00 59.36 59.72 1okk h GLU 196 Cb 1.03 -0.13 -0.04 0.00 -0.10 0.00 0.00 28.75 29.50 1okk h GLU 196 CO 1.24 0.49 0.42 -1.35 -1.16 0.00 0.00 179.01 178.65 1okk h PRO 197 N 0.63 0.79 -0.01 2.33 0.11 -1.99 -0.09 132.00 133.77 1okk h PRO 197 Ca 0.17 -0.05 -0.17 0.00 0.11 0.00 0.00 66.00 66.06 1okk h PRO 197 Cb 0.02 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 30.93 1okk h PRO 197 CO -0.03 0.52 -0.77 -0.07 -0.21 0.00 0.00 178.00 177.44 1okk h LEU 198 N 0.81 0.16 -0.54 2.35 3.38 -1.84 -0.37 115.31 119.27 1okk h LEU 198 Ca 0.27 -0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.98 1okk h LEU 198 Cb 0.03 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1okk h LEU 198 CO -0.11 0.86 -0.42 0.24 0.09 0.00 0.00 178.44 179.10 1okk h MET 199 N 0.08 0.72 -0.53 1.13 2.86 -0.90 -1.96 114.93 116.33 1okk h MET 199 Ca -0.02 -0.38 -0.04 0.00 -2.06 0.00 0.00 59.70 57.20 1okk h MET 199 Cb 1.35 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 33.00 1okk h MET 199 CO 0.11 1.00 0.17 0.78 1.06 0.00 0.00 176.91 180.04 1okk h GLY 200 N 0.94 0.88 0.71 8.32 0.00 -0.77 -1.48 103.07 111.67 1okk h GLY 200 Ca 0.04 -0.52 0.05 0.00 0.00 0.00 0.00 47.33 46.91 1okk h GLY 200 CO 0.09 0.48 0.28 0.83 0.00 0.00 0.00 176.54 178.22 1okk h GLU 201 N 0.73 0.51 -0.60 4.80 5.08 -0.86 -0.76 114.58 123.48 1okk h GLU 201 Ca 0.17 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.44 1okk h GLU 201 Cb 0.26 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 1okk h GLU 201 CO -0.01 0.34 0.14 1.25 -1.00 0.00 0.00 179.01 179.73 1okk h LEU 202 N 0.53 0.92 -0.83 1.33 5.85 -1.17 -1.39 115.31 120.54 1okk h LEU 202 Ca 0.24 -0.24 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 1okk h LEU 202 Cb 0.15 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 1okk h LEU 202 CO -0.17 0.92 0.24 0.00 -0.34 0.00 0.00 178.44 179.09 1okk h ALA 203 N 1.03 1.06 -0.56 1.25 0.00 -0.93 -1.86 119.26 119.25 1okk h ALA 203 Ca 0.19 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1okk h ALA 203 Cb 0.36 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1okk h ALA 203 CO 0.00 0.64 0.00 -0.09 0.00 0.00 0.00 179.25 179.81 1okk h ARG 204 N 1.07 0.99 -0.96 0.00 9.65 -0.85 -1.59 114.38 122.69 1okk h ARG 204 Ca 0.24 -0.31 0.01 0.00 -1.10 0.00 0.00 59.98 58.81 1okk h ARG 204 Cb 0.28 -0.09 -0.05 0.00 -1.39 0.00 0.00 29.97 28.72 1okk h ARG 204 CO -0.01 0.99 0.63 1.25 2.80 0.00 0.00 179.97 185.62 1okk h LEU 205 N 0.87 1.11 -0.44 3.80 5.85 -1.07 -1.30 115.31 124.13 1okk h LEU 205 Ca 0.16 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 1okk h LEU 205 Cb 0.54 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1okk h LEU 205 CO 0.03 0.81 0.14 0.50 -0.34 0.00 0.00 178.44 179.58 1okk h LYS 206 N 1.30 0.69 -0.74 1.25 3.64 -1.08 0.17 116.57 121.80 1okk h LYS 206 Ca 0.35 -0.15 0.05 0.00 -1.27 0.00 0.00 60.65 59.63 1okk h LYS 206 Cb -0.14 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 31.53 1okk h LYS 206 CO -0.07 0.66 0.45 1.49 -2.27 0.00 0.00 179.45 179.71 1okk h GLU 207 N 0.57 0.82 0.09 1.90 4.81 -0.83 0.49 114.58 122.43 1okk h GLU 207 Ca 0.14 -0.05 -0.16 0.00 -0.13 0.00 0.00 59.36 59.16 1okk h GLU 207 Cb 0.26 -0.18 0.02 0.00 0.63 0.00 0.00 28.75 29.48 1okk h GLU 207 CO -0.00 0.54 -0.69 0.28 -0.73 0.00 0.00 179.01 178.40 1okk h VAL 208 N 0.84 1.50 0.00 0.32 2.07 -1.06 -3.35 116.25 116.57 1okk h VAL 208 Ca 0.31 -2.36 -0.10 0.00 0.82 0.00 0.00 66.70 65.37 1okk h VAL 208 Cb 0.11 3.01 -0.01 0.00 -1.52 0.00 0.00 31.29 32.88 1okk h VAL 208 CO -0.15 0.67 -0.60 -0.07 0.02 0.00 0.00 177.57 177.44 1okk h LEU 209 N -0.32 0.00 -1.85 2.57 3.38 -0.95 -3.49 115.31 114.65 1okk h LEU 209 Ca -0.11 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.53 1okk h LEU 209 Cb 1.49 0.00 0.16 0.00 0.09 0.00 0.00 40.66 42.40 1okk h LEU 209 CO 0.13 0.44 -0.80 0.61 0.09 0.00 0.00 178.44 178.92 1okk n GLY 210 N 1.23 -0.52 3.77 0.83 0.00 0.16 -4.95 105.19 105.72 1okk n GLY 210 Ca 0.01 0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1okk n GLY 210 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1okk s PRO 211 N -5.26 3.84 0.06 1.61 0.04 -1.26 -4.90 135.00 129.13 1okk s PRO 211 Ca 0.10 2.45 0.25 0.00 0.04 0.00 0.00 61.00 63.84 1okk s PRO 211 Cb -0.01 -2.76 0.55 0.00 0.04 0.00 0.00 34.50 32.31 1okk s PRO 211 CO 0.74 -0.71 1.46 -0.40 0.04 0.00 0.00 177.00 178.14 1okk n ASP 212 N 0.03 0.53 -3.98 6.66 5.75 -0.12 -4.82 116.55 120.60 1okk n ASP 212 Ca 0.04 0.04 -0.15 0.00 -0.01 0.00 0.00 54.79 54.71 1okk n ASP 212 Cb 0.41 0.06 -0.14 0.00 -1.03 0.00 0.00 41.12 40.42 1okk n ASP 212 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1okk s GLU 213 N -3.07 0.46 -0.25 0.11 0.41 -1.21 -5.00 118.70 110.15 1okk s GLU 213 Ca 0.09 -0.32 0.01 0.00 -0.41 0.00 0.00 54.97 54.35 1okk s GLU 213 Cb 0.16 -0.40 0.07 0.00 -1.78 0.00 0.00 34.13 32.18 1okk s GLU 213 CO 0.68 0.10 -0.04 0.08 -0.49 0.00 0.00 175.26 175.60 1okk s VAL 214 N -0.40 1.63 -0.35 2.63 1.01 -1.26 -1.54 120.40 122.12 1okk s VAL 214 Ca -0.01 -1.40 -0.13 0.00 0.00 0.00 0.00 61.98 60.44 1okk s VAL 214 Cb -0.04 -1.93 -0.01 0.00 0.00 0.00 0.00 36.38 34.39 1okk s VAL 214 CO -0.00 -0.19 0.25 -0.76 0.00 0.00 0.00 175.10 174.41 1okk s LEU 215 N 1.33 4.59 -0.38 3.92 1.43 -0.01 -1.04 118.68 128.52 1okk s LEU 215 Ca -0.03 -0.47 -0.29 0.00 -1.03 0.00 0.00 54.13 52.31 1okk s LEU 215 Cb -0.19 -2.15 0.02 0.00 0.03 0.00 0.00 46.19 43.90 1okk s LEU 215 CO -0.08 -0.27 1.19 -0.22 0.23 0.00 0.00 176.35 177.21 1okk s LEU 216 N 1.73 3.79 -0.40 1.79 2.96 -0.26 -1.31 118.68 126.98 1okk s LEU 216 Ca 0.06 0.88 -0.21 0.00 -0.22 0.00 0.00 54.13 54.64 1okk s LEU 216 Cb -0.18 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 42.98 1okk s LEU 216 CO 0.11 -1.11 0.66 -0.69 -1.32 0.00 0.00 176.35 174.00 1okk s VAL 217 N 4.28 4.83 -0.18 1.68 1.01 0.04 -1.56 120.40 130.51 1okk s VAL 217 Ca 0.51 0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.90 1okk s VAL 217 Cb -0.12 -4.16 0.01 0.00 0.00 0.00 0.00 36.38 32.11 1okk s VAL 217 CO 0.24 -0.47 -0.16 -0.22 0.00 0.00 0.00 175.10 174.49 1okk s LEU 218 N 2.83 2.34 0.17 3.92 2.96 0.25 -4.50 118.68 126.65 1okk s LEU 218 Ca 0.25 -0.56 -0.31 0.00 -0.22 0.00 0.00 54.13 53.29 1okk s LEU 218 Cb -0.14 -1.54 -0.10 0.00 0.50 0.00 0.00 46.19 44.91 1okk s LEU 218 CO 0.17 0.03 1.52 -0.62 -1.32 0.00 0.00 176.35 176.13 1okk s ASP 219 N 1.15 6.63 0.60 3.68 -1.08 -1.26 -1.27 116.67 125.12 1okk s ASP 219 Ca 0.01 2.58 0.30 0.00 -0.52 0.00 0.00 52.55 54.93 1okk s ASP 219 Cb -0.14 -2.60 1.79 0.00 -1.46 0.00 0.00 42.92 40.51 1okk s ASP 219 CO -0.07 -0.78 2.18 0.00 0.52 0.00 0.00 175.17 177.02 1okk h ALA 220 N 6.49 1.61 -0.00 3.66 0.00 -1.51 -1.57 119.26 127.94 1okk h ALA 220 Ca -0.43 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1okk h ALA 220 Cb 1.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1okk h ALA 220 CO 0.88 -0.15 -0.04 0.00 0.00 0.00 0.00 179.25 179.94 1okk n MET 221 N -3.74 0.77 -1.69 0.00 0.00 -1.26 -3.73 117.12 107.47 1okk n MET 221 Ca -0.01 -0.16 -0.44 0.00 0.00 0.00 0.00 57.70 57.09 1okk n MET 221 Cb 0.21 -1.50 -0.02 0.00 0.00 0.00 0.00 33.22 31.91 1okk n MET 221 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 1okk n THR 222 N -0.97 1.03 -0.40 3.17 -1.04 -0.59 -5.00 114.28 110.48 1okk n THR 222 Ca 0.17 -0.26 0.00 0.00 -2.04 0.00 0.00 64.05 61.92 1okk n THR 222 Cb 0.23 -1.60 0.00 0.00 -1.82 0.00 0.00 70.33 67.14 1okk n THR 222 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1okk n GLY 223 N 2.07 1.42 0.33 3.41 0.00 -1.26 -4.21 105.19 106.95 1okk n GLY 223 Ca 0.10 -1.67 0.13 0.00 0.00 0.00 0.00 46.02 44.59 1okk n GLY 223 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1okk h GLN 224 N 0.00 0.13 0.00 1.61 1.08 -1.92 -1.90 115.11 114.11 1okk h GLN 224 Ca 0.00 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1okk h GLN 224 Cb 0.00 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.40 1okk h GLN 224 CO 0.00 0.08 0.00 0.39 -0.95 0.00 0.00 178.83 178.35 1okk n GLU 225 N -4.46 0.00 -0.29 1.46 -0.58 -1.26 -3.21 120.64 112.30 1okk n GLU 225 Ca 0.05 0.33 0.17 0.00 -0.42 0.00 0.00 57.16 57.29 1okk n GLU 225 Cb 0.35 -1.50 0.43 0.00 -0.57 0.00 0.00 31.44 30.15 1okk n GLU 225 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1okk h ALA 226 N 2.35 2.00 0.53 0.62 0.00 -1.67 -0.63 119.26 122.45 1okk h ALA 226 Ca 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1okk h ALA 226 Cb 0.18 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.92 1okk h ALA 226 CO 0.00 -0.32 -0.25 1.25 0.00 0.00 0.00 179.25 179.93 1okk h LEU 227 N 0.56 -0.60 -1.12 0.00 5.85 -1.81 -0.84 115.31 117.34 1okk h LEU 227 Ca 0.52 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 59.17 1okk h LEU 227 Cb 1.07 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.24 1okk h LEU 227 CO -0.26 -0.39 -0.00 -1.28 -0.34 0.00 0.00 178.44 176.18 1okk h SER 228 N -0.77 0.58 -0.11 1.25 0.87 -1.67 -1.36 113.55 112.35 1okk h SER 228 Ca -0.07 -0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.35 1okk h SER 228 Cb 0.57 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 62.37 1okk h SER 228 CO 0.12 0.65 -0.01 0.58 -0.53 0.00 0.00 176.83 177.65 1okk h VAL 229 N 0.58 1.26 -0.39 2.23 2.07 -1.02 -1.31 116.25 119.68 1okk h VAL 229 Ca 0.12 -0.84 -0.10 0.00 0.82 0.00 0.00 66.70 66.70 1okk h VAL 229 Cb 0.37 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 1okk h VAL 229 CO 0.01 0.24 -0.13 0.00 0.02 0.00 0.00 177.57 177.71 1okk h ALA 230 N 0.73 0.54 -0.40 1.67 0.00 -1.03 -1.87 119.26 118.89 1okk h ALA 230 Ca 0.03 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.64 1okk h ALA 230 Cb 0.38 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1okk h ALA 230 CO 0.01 0.45 0.19 -0.09 0.00 0.00 0.00 179.25 179.80 1okk h ARG 231 N 0.59 0.37 -0.45 0.00 2.43 -1.21 -0.25 114.38 115.86 1okk h ARG 231 Ca 0.09 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.17 1okk h ARG 231 Cb 0.67 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.12 1okk h ARG 231 CO 0.05 0.25 0.01 0.00 -1.51 0.00 0.00 179.97 178.76 1okk h ALA 232 N 1.22 0.61 -0.57 2.80 0.00 -1.13 0.11 119.26 122.30 1okk h ALA 232 Ca 0.18 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1okk h ALA 232 Cb 0.10 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1okk h ALA 232 CO -0.14 0.40 0.16 0.74 0.00 0.00 0.00 179.25 180.41 1okk h PHE 233 N 0.64 0.89 -0.24 0.00 0.04 -1.22 -0.13 116.94 116.93 1okk h PHE 233 Ca 0.13 -0.08 -0.09 0.00 2.80 0.00 0.00 57.97 60.73 1okk h PHE 233 Cb 0.49 -0.26 -0.00 0.00 2.20 0.00 0.00 35.95 38.37 1okk h PHE 233 CO 0.04 0.73 -0.20 0.22 -0.60 0.00 0.00 178.31 178.50 1okk h ASP 234 N 0.84 0.59 -0.11 2.17 3.58 -0.64 -0.91 116.42 121.93 1okk h ASP 234 Ca 0.19 -0.46 -0.22 0.00 0.42 0.00 0.00 57.03 56.96 1okk h ASP 234 Cb 0.27 -0.16 0.01 0.00 1.72 0.00 0.00 39.33 41.16 1okk h ASP 234 CO -0.01 0.92 -0.76 -0.33 -2.88 0.00 0.00 179.24 176.19 1okk h GLU 235 N 0.26 0.76 0.00 0.28 5.08 -0.63 -1.48 114.58 118.85 1okk h GLU 235 Ca 0.04 -0.61 -0.14 0.00 -1.00 0.00 0.00 59.36 57.65 1okk h GLU 235 Cb 0.75 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 1okk h GLU 235 CO 0.05 1.22 -1.18 0.87 -1.00 0.00 0.00 179.01 178.97 1okk h LYS 236 N 0.52 0.00 0.00 2.33 1.57 -1.10 -3.42 116.57 116.47 1okk h LYS 236 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1okk h LYS 236 Cb 1.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.69 1okk h LYS 236 CO 0.15 0.32 -0.58 0.28 -0.57 0.00 0.00 179.45 179.06 1okk n VAL 237 N -2.95 0.15 0.00 0.50 0.31 -0.71 -4.67 118.33 110.96 1okk n VAL 237 Ca -0.06 0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1okk n VAL 237 Cb 0.80 -1.21 0.00 0.00 -0.91 0.00 0.00 33.84 32.52 1okk n VAL 237 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1okk n GLY 238 N 2.61 1.44 3.82 2.92 0.00 -0.43 -4.98 105.19 110.57 1okk n GLY 238 Ca 0.00 -0.87 -0.36 0.00 0.00 0.00 0.00 46.02 44.79 1okk n GLY 238 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1okk s VAL 239 N 0.00 5.44 -0.36 1.61 1.01 -1.26 -4.63 120.40 122.21 1okk s VAL 239 Ca 0.00 0.25 0.16 0.00 0.00 0.00 0.00 61.98 62.39 1okk s VAL 239 Cb 0.00 -3.45 -0.21 0.00 0.00 0.00 0.00 36.38 32.72 1okk s VAL 239 CO 0.00 0.54 0.50 0.35 0.00 0.00 0.00 175.10 176.49 1okk n THR 240 N 2.61 0.00 -3.79 3.92 -2.24 -0.21 -4.93 114.28 109.64 1okk n THR 240 Ca -0.18 -0.26 0.04 0.00 -2.27 0.00 0.00 64.05 61.38 1okk n THR 240 Cb 0.54 0.54 0.00 0.00 -2.10 0.00 0.00 70.33 69.31 1okk n THR 240 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1okk s GLY 241 N -3.20 -0.33 0.13 3.38 0.00 -1.19 -4.26 107.32 101.85 1okk s GLY 241 Ca -0.00 0.51 0.07 0.00 0.00 0.00 0.00 44.72 45.29 1okk s GLY 241 CO 0.66 3.27 -0.16 1.08 0.00 0.00 0.00 173.10 177.95 1okk s LEU 242 N -3.45 2.41 -0.08 0.66 1.02 0.06 -1.10 118.68 118.20 1okk s LEU 242 Ca 0.23 -0.81 0.03 0.00 0.02 0.00 0.00 54.13 53.59 1okk s LEU 242 Cb 0.03 -0.65 0.01 0.00 0.02 0.00 0.00 46.19 45.61 1okk s LEU 242 CO -0.04 -0.10 -0.17 -0.69 0.02 0.00 0.00 176.35 175.37 1okk s VAL 243 N -2.04 1.50 -0.32 -1.59 1.01 -0.60 -0.94 120.40 117.41 1okk s VAL 243 Ca 0.10 -0.69 -0.09 0.00 0.00 0.00 0.00 61.98 61.30 1okk s VAL 243 Cb -0.05 -1.33 0.00 0.00 0.00 0.00 0.00 36.38 35.00 1okk s VAL 243 CO 0.04 0.44 0.15 -0.22 0.00 0.00 0.00 175.10 175.51 1okk s LEU 244 N 0.55 4.20 0.34 3.92 2.96 -0.71 -0.58 118.68 129.36 1okk s LEU 244 Ca -0.16 -0.65 0.07 0.00 -0.22 0.00 0.00 54.13 53.17 1okk s LEU 244 Cb -0.17 -1.99 -0.02 0.00 0.50 0.00 0.00 46.19 44.52 1okk s LEU 244 CO 0.06 -0.23 0.37 0.42 -1.32 0.00 0.00 176.35 175.64 1okk s THR 245 N 1.58 3.74 -1.50 3.68 -4.23 -0.39 -0.62 115.64 117.90 1okk s THR 245 Ca 0.04 -1.21 -0.03 0.00 -1.18 0.00 0.00 61.69 59.31 1okk s THR 245 Cb -0.18 -3.27 0.00 0.00 1.34 0.00 0.00 72.50 70.39 1okk s THR 245 CO 0.06 -0.16 0.40 0.29 -0.54 0.00 0.00 174.62 174.66 1okk n LYS 246 N -1.49 -3.64 0.00 3.99 5.02 -1.08 -1.34 118.16 119.62 1okk n LYS 246 Ca -0.01 0.87 0.11 0.00 -2.02 0.00 0.00 58.31 57.26 1okk n LYS 246 Cb 0.59 -5.53 0.56 0.00 -0.02 0.00 0.00 35.03 30.63 1okk n LYS 246 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1okk n LEU 247 N -3.44 0.00 0.00 -0.35 4.77 -0.30 -1.96 117.00 115.72 1okk n LEU 247 Ca -0.14 0.28 0.12 0.00 -0.03 0.00 0.00 56.01 56.23 1okk n LEU 247 Cb 0.63 -0.28 0.58 0.00 -2.33 0.00 0.00 43.42 42.03 1okk n LEU 247 CO 0.38 -0.07 0.89 -0.90 -1.33 0.00 0.00 177.39 176.36 1okk n ASP 248 N -1.28 0.00 -2.31 -1.43 5.75 -1.26 -4.74 116.55 111.28 1okk n ASP 248 Ca 0.11 0.03 0.00 0.00 -0.01 0.00 0.00 54.79 54.92 1okk n ASP 248 Cb 0.17 -0.32 0.00 0.00 -1.03 0.00 0.00 41.12 39.95 1okk n ASP 248 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1okk n GLY 249 N 0.76 -1.04 0.20 6.12 0.00 -0.83 -5.04 105.19 105.37 1okk n GLY 249 Ca 0.10 -1.65 0.03 0.00 0.00 0.00 0.00 46.02 44.50 1okk n GLY 249 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1okk n ASP 250 N -2.08 2.35 -4.74 1.61 5.75 -1.26 -5.01 116.55 113.16 1okk n ASP 250 Ca 0.00 -2.16 -0.42 0.00 -0.01 0.00 0.00 54.79 52.20 1okk n ASP 250 Cb 0.00 -0.13 -0.01 0.00 -1.03 0.00 0.00 41.12 39.95 1okk n ASP 250 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1okk n ALA 251 N -0.35 2.39 -0.01 2.12 0.00 -1.26 -4.89 120.51 118.50 1okk n ALA 251 Ca 0.05 0.37 -0.02 0.00 0.00 0.00 0.00 53.44 53.84 1okk n ALA 251 Cb 0.36 -2.44 0.24 0.00 0.00 0.00 0.00 19.45 17.61 1okk n ALA 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1okk h ARG 252 N 4.37 0.54 0.00 0.00 2.47 -1.83 -3.47 114.38 116.46 1okk h ARG 252 Ca -0.47 -0.16 0.00 0.00 -1.26 0.00 0.00 59.98 58.09 1okk h ARG 252 Cb 1.23 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 29.50 1okk h ARG 252 CO 0.76 0.65 0.00 0.41 0.56 0.00 0.00 179.97 182.35 1okk n GLY 253 N -0.63 0.83 0.38 0.04 0.00 -1.24 -4.08 105.19 100.49 1okk n GLY 253 Ca 0.01 -0.35 0.20 0.00 0.00 0.00 0.00 46.02 45.88 1okk n GLY 253 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1okk h GLY 254 N 0.00 0.00 0.56 -0.02 0.00 -1.46 -1.04 103.07 101.11 1okk h GLY 254 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 47.33 47.52 1okk h GLY 254 CO 0.00 0.00 0.52 0.00 0.00 0.00 0.00 176.54 177.06 1okk h ALA 255 N 1.64 2.47 -0.95 3.60 0.00 -1.71 -0.98 119.26 123.34 1okk h ALA 255 Ca 0.22 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.14 1okk h ALA 255 Cb 1.00 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 1okk h ALA 255 CO -0.00 -0.69 0.62 0.00 0.00 0.00 0.00 179.25 179.18 1okk h ALA 256 N 1.64 1.37 -0.32 0.00 0.00 -1.53 -0.24 119.26 120.18 1okk h ALA 256 Ca 0.37 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.13 1okk h ALA 256 Cb 1.21 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1okk h ALA 256 CO -0.06 0.55 -0.17 1.25 0.00 0.00 0.00 179.25 180.82 1okk h LEU 257 N 1.22 0.70 -0.44 0.00 5.85 -1.36 -1.54 115.31 119.74 1okk h LEU 257 Ca 0.37 -0.41 0.06 0.00 0.84 0.00 0.00 57.88 58.74 1okk h LEU 257 Cb -0.03 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 1okk h LEU 257 CO -0.10 0.96 0.12 0.28 -0.34 0.00 0.00 178.44 179.35 1okk h SER 258 N 0.44 0.08 -0.36 1.25 0.02 -1.16 0.12 113.55 113.92 1okk h SER 258 Ca 0.07 0.06 -0.14 0.00 -0.84 0.00 0.00 61.79 60.94 1okk h SER 258 Cb 0.70 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.30 1okk h SER 258 CO 0.05 0.08 -0.30 0.00 -1.14 0.00 0.00 176.83 175.51 1okk h ALA 259 N 1.31 0.69 -0.06 3.77 0.00 -0.96 -2.77 119.26 121.25 1okk h ALA 259 Ca 0.21 -0.42 -0.22 0.00 0.00 0.00 0.00 54.91 54.48 1okk h ALA 259 Cb 0.24 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1okk h ALA 259 CO -0.25 0.67 -0.86 -0.09 0.00 0.00 0.00 179.25 178.72 1okk h ARG 260 N 0.75 0.53 -0.40 0.00 2.43 -1.07 -2.32 114.38 114.30 1okk h ARG 260 Ca 0.08 -0.50 0.05 0.00 -0.81 0.00 0.00 59.98 58.80 1okk h ARG 260 Cb 0.87 0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 30.50 1okk h ARG 260 CO 0.08 1.13 0.12 1.25 -1.51 0.00 0.00 179.97 181.04 1okk h HIS 261 N 0.33 0.22 0.00 2.20 2.76 -0.92 0.29 115.15 120.03 1okk h HIS 261 Ca -0.07 0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 58.03 1okk h HIS 261 Cb 1.48 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 30.39 1okk h HIS 261 CO 0.07 0.07 -0.74 -0.24 -1.30 0.00 0.00 177.93 175.79 1okk h VAL 262 N 0.27 0.54 0.00 5.26 3.04 -1.48 -3.35 116.25 120.53 1okk h VAL 262 Ca 0.18 -1.84 -0.19 0.00 -1.01 0.00 0.00 66.70 63.85 1okk h VAL 262 Cb 0.18 2.14 -0.04 0.00 -2.01 0.00 0.00 31.29 31.57 1okk h VAL 262 CO -0.20 0.31 -2.15 0.35 -1.01 0.00 0.00 177.57 174.86 1okk n THR 263 N -3.05 0.72 -1.28 3.17 -2.24 -0.88 -4.92 114.28 105.81 1okk n THR 263 Ca -0.01 -0.66 -0.10 0.00 -2.27 0.00 0.00 64.05 61.01 1okk n THR 263 Cb 0.71 -0.26 -0.04 0.00 -2.10 0.00 0.00 70.33 68.65 1okk n THR 263 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1okk n GLY 264 N 1.59 1.06 3.87 3.38 0.00 0.10 -5.00 105.19 110.19 1okk n GLY 264 Ca -0.19 -0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.29 1okk n GLY 264 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1okk s LYS 265 N -2.61 3.21 0.45 1.61 -0.14 -1.26 -5.07 119.74 115.93 1okk s LYS 265 Ca 0.00 -0.62 -0.23 0.00 -1.36 0.00 0.00 55.97 53.76 1okk s LYS 265 Cb 0.00 -2.87 -0.08 0.00 -1.68 0.00 0.00 37.83 33.20 1okk s LYS 265 CO 0.00 0.55 1.14 -1.25 -0.76 0.00 0.00 175.35 175.03 1okk s PRO 266 N -2.78 3.84 -0.52 -1.68 0.04 -1.26 -4.72 135.00 127.92 1okk s PRO 266 Ca 0.33 1.72 -0.21 0.00 0.04 0.00 0.00 61.00 62.88 1okk s PRO 266 Cb -0.12 -2.43 0.05 0.00 0.04 0.00 0.00 34.50 32.05 1okk s PRO 266 CO 0.26 -0.47 0.72 0.42 0.04 0.00 0.00 177.00 177.97 1okk s ILE 267 N -1.57 4.73 -0.01 0.56 1.01 -1.26 -0.76 121.20 123.89 1okk s ILE 267 Ca 0.62 -0.27 -0.21 0.00 0.00 0.00 0.00 60.65 60.79 1okk s ILE 267 Cb -0.27 -4.37 -0.24 0.00 0.01 0.00 0.00 42.46 37.58 1okk s ILE 267 CO 0.33 -0.90 1.06 1.88 0.00 0.00 0.00 174.94 177.31 1okk h TYR 268 N 9.09 0.54 -3.93 3.97 0.05 -1.26 -3.41 116.97 122.02 1okk h TYR 268 Ca -0.27 -0.30 -0.23 0.00 0.05 0.00 0.00 58.73 57.97 1okk h TYR 268 Cb 1.09 -0.06 -0.18 0.00 1.01 0.00 0.00 36.73 38.59 1okk h TYR 268 CO 0.80 1.13 -0.71 -0.06 -1.05 0.00 0.00 178.16 178.27 1okk s PHE 269 N -3.09 0.73 -0.08 4.88 0.08 -1.23 -1.60 117.98 117.66 1okk s PHE 269 Ca -0.14 -0.74 0.04 0.00 0.12 0.00 0.00 56.93 56.22 1okk s PHE 269 Cb 0.03 -0.44 -0.01 0.00 -0.57 0.00 0.00 43.02 42.03 1okk s PHE 269 CO 0.81 -0.15 -0.22 0.00 -0.10 0.00 0.00 175.22 175.56 1okk s ALA 270 N -2.61 2.28 -0.18 5.36 0.00 0.15 -1.73 121.76 125.02 1okk s ALA 270 Ca 0.01 -0.99 -0.19 0.00 0.00 0.00 0.00 51.96 50.78 1okk s ALA 270 Cb -0.02 -0.83 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 1okk s ALA 270 CO -0.03 0.36 0.56 0.20 0.00 0.00 0.00 175.76 176.85 1okk s GLY 271 N 0.05 2.13 0.00 0.00 0.00 0.20 -2.02 107.32 107.69 1okk s GLY 271 Ca -0.09 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.33 1okk s GLY 271 CO 0.06 1.13 0.67 3.33 0.00 0.00 0.00 173.10 178.29 1okk n VAL 272 N 4.46 0.44 -3.49 1.40 0.24 -0.50 -1.15 118.33 119.73 1okk n VAL 272 Ca -0.04 -0.52 -0.09 0.00 -2.04 0.00 0.00 64.34 61.65 1okk n VAL 272 Cb 0.50 0.88 -0.02 0.00 -1.47 0.00 0.00 33.84 33.74 1okk n VAL 272 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1okk s SER 273 N -0.44 -0.40 0.37 -1.34 0.15 -1.23 -4.40 113.70 106.41 1okk s SER 273 Ca 0.00 0.02 0.07 0.00 0.70 0.00 0.00 55.95 56.74 1okk s SER 273 Cb 0.00 0.41 0.72 0.00 -1.71 0.00 0.00 66.02 65.45 1okk s SER 273 CO 0.00 -0.66 1.91 1.05 1.20 0.00 0.00 173.24 176.74 1okk h GLU 274 N 2.03 0.36 -7.06 5.44 -0.00 -1.97 -3.42 114.58 109.95 1okk h GLU 274 Ca -0.24 -0.08 -0.53 0.00 -0.00 0.00 0.00 59.36 58.52 1okk h GLU 274 Cb 1.25 -0.05 0.10 0.00 -0.00 0.00 0.00 28.75 30.05 1okk h GLU 274 CO 0.32 0.44 0.50 0.15 -0.00 0.00 0.00 179.01 180.42 1okk s LYS 275 N -4.87 3.22 0.63 1.06 1.02 -1.26 -4.89 119.74 114.66 1okk s LYS 275 Ca -0.06 1.88 0.37 0.00 0.02 0.00 0.00 55.97 58.18 1okk s LYS 275 Cb 0.16 -2.12 2.13 0.00 -0.52 0.00 0.00 37.83 37.48 1okk s LYS 275 CO 0.74 -1.02 2.30 -1.35 -0.92 0.00 0.00 175.35 175.11 1okk h PRO 276 N 1.31 0.00 0.00 -1.68 0.11 -1.92 0.26 132.00 130.08 1okk h PRO 276 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1okk h PRO 276 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1okk h PRO 276 CO 0.57 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.75 1okk n GLU 277 N -3.43 0.07 -1.34 1.05 4.71 -1.26 -4.32 120.64 116.12 1okk n GLU 277 Ca -0.03 0.04 -0.29 0.00 -0.01 0.00 0.00 57.16 56.87 1okk n GLU 277 Cb 0.09 -1.50 -0.08 0.00 -1.01 0.00 0.00 31.44 28.95 1okk n GLU 277 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1okk n GLY 278 N 1.21 4.01 2.89 0.62 0.00 0.91 -4.81 105.19 110.02 1okk n GLY 278 Ca 0.08 -1.54 -0.16 0.00 0.00 0.00 0.00 46.02 44.40 1okk n GLY 278 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1okk s LEU 279 N -0.55 1.68 0.15 0.99 2.96 -1.26 -1.41 118.68 121.24 1okk s LEU 279 Ca 0.65 -0.05 -0.08 0.00 -0.22 0.00 0.00 54.13 54.43 1okk s LEU 279 Cb 0.25 -0.21 -0.01 0.00 0.50 0.00 0.00 46.19 46.72 1okk s LEU 279 CO -0.07 -0.01 0.24 -1.83 -1.32 0.00 0.00 176.35 173.36 1okk s GLU 280 N 0.35 1.08 0.46 1.98 -1.05 -0.86 -5.01 118.70 115.66 1okk s GLU 280 Ca -0.03 -1.19 -0.24 0.00 -0.15 0.00 0.00 54.97 53.36 1okk s GLU 280 Cb -0.06 0.35 -0.09 0.00 -0.44 0.00 0.00 34.13 33.89 1okk s GLU 280 CO -0.01 -0.38 1.10 -2.30 0.95 0.00 0.00 175.26 174.62 1okk n PRO 281 N -0.18 1.47 -2.38 -4.83 -0.02 -1.26 -0.68 135.00 127.13 1okk n PRO 281 Ca -0.08 0.53 -0.41 0.00 -2.02 0.00 0.00 63.50 61.52 1okk n PRO 281 Cb 0.63 -2.19 -0.03 0.00 -0.02 0.00 0.00 33.50 31.88 1okk n PRO 281 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1okk s PHE 282 N -1.29 3.42 -0.37 6.00 5.36 -0.63 -4.46 117.98 126.01 1okk s PHE 282 Ca 0.65 1.37 0.01 0.00 -0.96 0.00 0.00 56.93 58.00 1okk s PHE 282 Cb -0.51 -3.44 0.11 0.00 -0.34 0.00 0.00 43.02 38.83 1okk s PHE 282 CO 0.55 -1.28 0.12 0.71 -1.46 0.00 0.00 175.22 173.86 1okk s TYR 283 N 0.28 3.68 0.31 10.12 2.02 -1.26 -4.12 117.35 128.38 1okk s TYR 283 Ca 0.55 -2.79 0.08 0.00 -0.37 0.00 0.00 57.07 54.54 1okk s TYR 283 Cb -0.32 -3.04 0.88 0.00 -0.40 0.00 0.00 41.96 39.08 1okk s TYR 283 CO 0.34 -0.95 1.67 -1.35 -1.57 0.00 0.00 175.55 173.69 1okk h PRO 284 N 7.74 0.33 -0.61 -1.71 0.11 -1.84 -0.49 132.00 135.52 1okk h PRO 284 Ca -0.07 -0.02 0.07 0.00 0.11 0.00 0.00 66.00 66.09 1okk h PRO 284 Cb 1.03 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.00 1okk h PRO 284 CO 0.59 0.22 0.30 1.49 -0.21 0.00 0.00 178.00 180.39 1okk h GLU 285 N 0.34 0.53 -0.27 1.05 4.81 -1.85 -0.58 114.58 118.61 1okk h GLU 285 Ca 0.64 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.78 1okk h GLU 285 Cb 1.34 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 1okk h GLU 285 CO -0.59 0.35 -0.04 -0.09 -0.73 0.00 0.00 179.01 177.91 1okk h ARG 286 N 0.55 0.50 -0.10 1.92 2.43 -1.51 -2.59 114.38 115.58 1okk h ARG 286 Ca 0.29 -0.18 -0.09 0.00 -0.81 0.00 0.00 59.98 59.18 1okk h ARG 286 Cb 0.25 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1okk h ARG 286 CO -0.22 0.70 -0.36 1.25 -1.51 0.00 0.00 179.97 179.83 1okk h LEU 287 N 0.27 0.22 -0.63 3.80 5.85 -1.29 -1.76 115.31 121.77 1okk h LEU 287 Ca 0.07 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.72 1okk h LEU 287 Cb 0.50 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 1okk h LEU 287 CO 0.02 0.57 0.41 0.00 -0.34 0.00 0.00 178.44 179.11 1okk h ALA 288 N 1.45 0.80 -0.72 1.25 0.00 -1.02 0.08 119.26 121.10 1okk h ALA 288 Ca 0.02 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1okk h ALA 288 Cb 0.73 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1okk h ALA 288 CO 0.06 0.22 0.19 0.78 0.00 0.00 0.00 179.25 180.50 1okk h GLY 289 N 0.84 1.23 0.96 0.00 0.00 -1.09 -2.36 103.07 102.66 1okk h GLY 289 Ca 0.23 -0.76 -0.07 0.00 0.00 0.00 0.00 47.33 46.74 1okk h GLY 289 CO -0.05 0.71 -0.00 -0.09 0.00 0.00 0.00 176.54 177.10 1okk h ARG 290 N 1.09 0.73 -0.86 4.80 2.43 -1.03 -1.29 114.38 120.25 1okk h ARG 290 Ca 0.23 -0.23 0.01 0.00 -0.81 0.00 0.00 59.98 59.17 1okk h ARG 290 Cb 0.35 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.80 1okk h ARG 290 CO -0.00 0.81 0.56 0.82 -1.51 0.00 0.00 179.97 180.65 1okk h ILE 291 N 0.56 1.22 -0.00 1.20 2.04 -0.86 -2.80 117.51 118.87 1okk h ILE 291 Ca 0.12 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.55 1okk h ILE 291 Cb 0.49 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 1okk h ILE 291 CO 0.02 0.22 -0.32 0.18 0.00 0.00 0.00 178.15 178.25 1okk n LEU 292 N -4.40 0.68 -0.93 1.44 4.77 -0.90 -4.85 117.00 112.81 1okk n LEU 292 Ca 0.10 -0.08 0.12 0.00 -0.03 0.00 0.00 56.01 56.12 1okk n LEU 292 Cb 0.03 -0.20 0.12 0.00 -2.33 0.00 0.00 43.42 41.04 1okk n LEU 292 CO 0.37 0.14 0.64 0.61 -1.33 0.00 0.00 177.39 177.82