#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jfq n ASN 2 N 0.00 6.07 -4.93 7.83 3.02 -1.26 -3.99 115.26 122.00 2jfq n ASN 2 Ca 0.00 -3.21 -0.28 0.00 -0.03 0.00 0.00 54.58 51.05 2jfq n ASN 2 Cb 0.00 -0.96 -0.03 0.00 -0.61 0.00 0.00 39.78 38.17 2jfq n ASN 2 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2jfq s LYS 3 N -2.32 3.50 0.79 3.52 1.02 -1.26 -5.03 119.74 119.95 2jfq s LYS 3 Ca 0.40 -0.39 -0.11 0.00 0.02 0.00 0.00 55.97 55.88 2jfq s LYS 3 Cb 0.32 -2.90 0.06 0.00 -0.52 0.00 0.00 37.83 34.78 2jfq s LYS 3 CO 0.01 0.47 1.09 -1.25 -0.92 0.00 0.00 175.35 174.75 2jfq s PRO 4 N -3.09 2.16 -0.22 -1.68 0.04 -1.26 -4.63 135.00 126.32 2jfq s PRO 4 Ca 0.37 0.85 -0.11 0.00 0.04 0.00 0.00 61.00 62.15 2jfq s PRO 4 Cb -0.11 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 32.47 2jfq s PRO 4 CO 0.28 -1.62 0.17 0.42 0.04 0.00 0.00 177.00 176.30 2jfq s ILE 5 N -3.04 5.36 0.07 0.56 1.01 0.12 -1.49 121.20 123.79 2jfq s ILE 5 Ca 0.61 0.24 -0.21 0.00 0.00 0.00 0.00 60.65 61.28 2jfq s ILE 5 Cb -0.15 -3.51 -0.06 0.00 0.01 0.00 0.00 42.46 38.74 2jfq s ILE 5 CO 0.55 0.37 0.64 -0.83 0.00 0.00 0.00 174.94 175.67 2jfq s GLY 6 N 0.80 2.72 -0.08 6.18 0.00 0.16 -1.27 107.32 115.84 2jfq s GLY 6 Ca 0.09 0.13 -0.01 0.00 0.00 0.00 0.00 44.72 44.93 2jfq s GLY 6 CO 0.03 0.69 -0.02 0.14 0.00 0.00 0.00 173.10 173.93 2jfq s VAL 7 N -0.75 0.55 0.11 1.40 1.01 0.43 0.05 120.40 123.20 2jfq s VAL 7 Ca 0.32 -0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.38 2jfq s VAL 7 Cb -0.20 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.48 2jfq s VAL 7 CO 0.20 0.28 -0.15 0.27 0.00 0.00 0.00 175.10 175.71 2jfq s ILE 8 N 1.80 3.03 0.20 2.22 -4.36 -0.61 -0.61 121.20 122.87 2jfq s ILE 8 Ca 0.03 -1.41 -0.18 0.00 -0.26 0.00 0.00 60.65 58.83 2jfq s ILE 8 Cb -0.13 -2.40 0.03 0.00 1.25 0.00 0.00 42.46 41.21 2jfq s ILE 8 CO -0.05 0.11 0.54 -0.62 0.24 0.00 0.00 174.94 175.16 2jfq s ASP 9 N -2.15 -0.27 0.52 4.36 2.15 -0.65 -1.28 116.67 119.34 2jfq s ASP 9 Ca 0.19 -0.49 0.30 0.00 0.43 0.00 0.00 52.55 52.98 2jfq s ASP 9 Cb -0.11 0.59 1.28 0.00 -0.30 0.00 0.00 42.92 44.39 2jfq s ASP 9 CO 0.11 -1.08 1.96 0.77 -0.17 0.00 0.00 175.17 176.76 2jfq h SER 10 N 2.17 0.00 0.00 -0.34 4.64 -1.89 -1.09 113.55 117.04 2jfq h SER 10 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 2jfq h SER 10 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2jfq h SER 10 CO 0.36 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 177.02 2jfq n GLY 11 N -0.08 -0.02 0.07 -0.77 0.00 -1.26 -2.77 105.19 100.36 2jfq n GLY 11 Ca -0.00 0.54 0.01 0.00 0.00 0.00 0.00 46.02 46.57 2jfq n GLY 11 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2jfq n VAL 12 N 0.00 0.79 -0.35 1.61 0.24 -1.26 -4.34 118.33 115.01 2jfq n VAL 12 Ca 0.00 -0.67 0.10 0.00 -2.04 0.00 0.00 64.34 61.73 2jfq n VAL 12 Cb 0.00 -0.34 0.28 0.00 -1.47 0.00 0.00 33.84 32.31 2jfq n VAL 12 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2jfq h GLY 13 N 3.94 1.69 1.70 7.63 0.00 -1.96 -0.90 103.07 115.17 2jfq h GLY 13 Ca -0.23 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.73 2jfq h GLY 13 CO 0.02 -0.00 0.12 -1.33 0.00 0.00 0.00 176.54 175.34 2jfq h GLY 14 N 0.80 0.00 2.00 4.60 0.00 -1.85 -1.63 103.07 107.00 2jfq h GLY 14 Ca 0.54 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.87 2jfq h GLY 14 CO -0.35 0.00 -0.01 1.41 0.00 0.00 0.00 176.54 177.59 2jfq h LEU 15 N 0.00 0.00 -1.01 3.11 3.38 -1.47 0.15 115.31 119.47 2jfq h LEU 15 Ca 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 2jfq h LEU 15 Cb 0.23 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2jfq h LEU 15 CO 0.00 0.01 -0.40 0.71 0.09 0.00 0.00 178.44 178.84 2jfq h THR 16 N 0.00 1.01 0.07 0.22 1.35 -1.51 -0.29 112.91 113.77 2jfq h THR 16 Ca -0.00 -1.54 -0.10 0.00 -0.55 0.00 0.00 66.41 64.22 2jfq h THR 16 Cb 0.09 1.90 0.01 0.00 -1.73 0.00 0.00 68.15 68.42 2jfq h THR 16 CO 0.00 0.40 -0.45 0.58 -0.25 0.00 0.00 175.52 175.79 2jfq h VAL 17 N 0.00 1.63 -0.86 6.82 2.07 -0.95 -3.11 116.25 121.85 2jfq h VAL 17 Ca -0.00 -2.42 0.08 0.00 0.82 0.00 0.00 66.70 65.17 2jfq h VAL 17 Cb 0.87 3.25 -0.07 0.00 -1.52 0.00 0.00 31.29 33.82 2jfq h VAL 17 CO 0.05 0.66 0.52 0.00 0.02 0.00 0.00 177.57 178.83 2jfq h ALA 18 N 0.06 1.21 -0.69 1.67 0.00 -1.19 -1.55 119.26 118.77 2jfq h ALA 18 Ca -0.08 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2jfq h ALA 18 Cb 1.35 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 2jfq h ALA 18 CO 0.09 0.21 0.36 -0.22 0.00 0.00 0.00 179.25 179.69 2jfq h LYS 19 N 0.91 0.96 -0.01 0.00 3.64 -1.13 -1.46 116.57 119.48 2jfq h LYS 19 Ca 0.39 -0.11 -0.17 0.00 -1.27 0.00 0.00 60.65 59.50 2jfq h LYS 19 Cb 0.26 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 2jfq h LYS 19 CO -0.21 0.71 -0.76 1.49 -2.27 0.00 0.00 179.45 178.41 2jfq h GLU 20 N 0.96 0.08 -0.38 1.90 4.57 -1.26 -2.43 114.58 118.03 2jfq h GLU 20 Ca 0.24 -0.08 -0.15 0.00 -1.18 0.00 0.00 59.36 58.19 2jfq h GLU 20 Cb 0.04 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 2jfq h GLU 20 CO -0.04 0.80 -0.36 0.82 -1.18 0.00 0.00 179.01 179.06 2jfq h ILE 21 N 0.05 1.27 -0.41 2.32 2.04 -0.82 -0.67 117.51 121.30 2jfq h ILE 21 Ca -0.02 -1.53 -0.09 0.00 1.00 0.00 0.00 64.86 64.22 2jfq h ILE 21 Cb 1.34 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 38.77 2jfq h ILE 21 CO 0.11 0.51 -0.12 0.24 0.00 0.00 0.00 178.15 178.89 2jfq h MET 22 N 0.74 0.74 -0.08 2.37 2.86 -1.22 0.47 114.93 120.81 2jfq h MET 22 Ca 0.07 -0.24 -0.10 0.00 -2.06 0.00 0.00 59.70 57.36 2jfq h MET 22 Cb 0.94 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.54 2jfq h MET 22 CO 0.09 0.83 -0.34 -0.09 1.06 0.00 0.00 176.91 178.46 2jfq h ARG 23 N 0.67 0.38 0.00 1.72 2.43 -1.30 -2.88 114.38 115.40 2jfq h ARG 23 Ca 0.11 -0.30 -0.10 0.00 -0.81 0.00 0.00 59.98 58.88 2jfq h ARG 23 Cb 0.58 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.18 2jfq h ARG 23 CO 0.04 0.93 -0.74 1.96 -1.51 0.00 0.00 179.97 180.65 2jfq h GLN 24 N -0.08 0.00 -2.10 0.20 4.20 -1.08 -3.38 115.11 112.86 2jfq h GLN 24 Ca -0.02 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.13 2jfq h GLN 24 Cb 0.98 0.00 -0.41 0.00 0.30 0.00 0.00 27.48 28.36 2jfq h GLN 24 CO 0.07 0.35 -0.90 1.28 -0.67 0.00 0.00 178.83 178.96 2jfq n LEU 25 N -3.07 2.07 0.27 1.46 4.77 0.16 -4.97 117.00 117.69 2jfq n LEU 25 Ca -0.01 -5.15 0.18 0.00 -0.03 0.00 0.00 56.01 51.00 2jfq n LEU 25 Cb 0.73 0.09 0.86 0.00 -2.33 0.00 0.00 43.42 42.76 2jfq n LEU 25 CO 0.40 2.17 1.15 1.55 -1.33 0.00 0.00 177.39 181.33 2jfq h PRO 26 N 3.65 0.00 0.00 3.23 0.13 -1.66 -1.94 132.00 135.41 2jfq h PRO 26 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2jfq h PRO 26 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 2jfq h PRO 26 CO 0.64 0.00 -0.33 -0.91 -0.23 0.00 0.00 178.00 177.17 2jfq h ASN 27 N 0.00 0.00 -4.01 1.44 2.35 -1.88 -3.44 115.58 110.05 2jfq h ASN 27 Ca 0.05 -0.05 -0.46 0.00 -0.55 0.00 0.00 56.30 55.30 2jfq h ASN 27 Cb 0.62 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.98 2jfq h ASN 27 CO -0.00 0.02 0.35 -1.61 -1.65 0.00 0.00 177.43 174.55 2jfq s GLU 28 N -3.20 4.27 -0.18 0.81 0.41 -0.73 -4.47 118.70 115.60 2jfq s GLU 28 Ca 0.06 1.24 -0.08 0.00 -0.41 0.00 0.00 54.97 55.79 2jfq s GLU 28 Cb 0.10 -2.37 -0.04 0.00 -1.78 0.00 0.00 34.13 30.04 2jfq s GLU 28 CO 0.68 -0.01 0.07 0.99 -0.49 0.00 0.00 175.26 176.50 2jfq s THR 29 N -1.95 4.86 -0.13 3.63 2.01 -1.26 -4.82 115.64 117.97 2jfq s THR 29 Ca 0.59 -0.01 -0.03 0.00 0.31 0.00 0.00 61.69 62.55 2jfq s THR 29 Cb -0.14 -3.19 -0.03 0.00 0.01 0.00 0.00 72.50 69.15 2jfq s THR 29 CO 0.18 0.46 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.93 2jfq s ILE 30 N 0.32 4.13 -0.29 1.82 1.09 -1.26 0.13 121.20 127.14 2jfq s ILE 30 Ca 0.04 -0.29 0.01 0.00 -1.10 0.00 0.00 60.65 59.31 2jfq s ILE 30 Cb -0.12 -2.79 0.06 0.00 -1.06 0.00 0.00 42.46 38.55 2jfq s ILE 30 CO -0.00 0.53 -0.04 -0.31 -0.10 0.00 0.00 174.94 175.02 2jfq s TYR 31 N -0.06 3.33 -0.15 3.97 1.51 -0.40 -1.21 117.35 124.35 2jfq s TYR 31 Ca 0.03 -2.22 -0.05 0.00 -1.01 0.00 0.00 57.07 53.82 2jfq s TYR 31 Cb -0.13 -2.16 -0.03 0.00 -0.11 0.00 0.00 41.96 39.53 2jfq s TYR 31 CO 0.02 -0.86 0.01 -0.47 -1.11 0.00 0.00 175.55 173.14 2jfq s TYR 32 N 1.14 3.14 -0.14 2.71 5.04 -0.26 -0.43 117.35 128.55 2jfq s TYR 32 Ca -0.05 -0.05 -0.00 0.00 -2.44 0.00 0.00 57.07 54.53 2jfq s TYR 32 Cb -0.20 -1.96 0.03 0.00 0.35 0.00 0.00 41.96 40.18 2jfq s TYR 32 CO -0.04 0.16 -0.10 -1.17 -1.34 0.00 0.00 175.55 173.06 2jfq s LEU 33 N 0.05 1.55 -0.20 6.97 0.20 0.22 -0.07 118.68 127.41 2jfq s LEU 33 Ca 0.02 -0.49 -0.04 0.00 0.69 0.00 0.00 54.13 54.31 2jfq s LEU 33 Cb -0.13 -1.01 -0.02 0.00 -0.43 0.00 0.00 46.19 44.60 2jfq s LEU 33 CO 0.02 -0.11 -0.03 -0.83 -0.29 0.00 0.00 176.35 175.11 2jfq s GLY 34 N 1.59 1.67 -0.67 7.98 0.00 -0.58 -1.64 107.32 115.67 2jfq s GLY 34 Ca 0.04 -1.02 -0.07 0.00 0.00 0.00 0.00 44.72 43.66 2jfq s GLY 34 CO -0.09 0.23 3.28 1.34 0.00 0.00 0.00 173.10 177.86 2jfq n ASP 35 N 4.29 6.71 0.01 1.64 2.03 -0.41 -2.53 116.55 128.29 2jfq n ASP 35 Ca -0.17 -2.59 0.18 0.00 0.52 0.00 0.00 54.79 52.72 2jfq n ASP 35 Cb 0.52 -1.45 0.66 0.00 -0.72 0.00 0.00 41.12 40.12 2jfq n ASP 35 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 2jfq h ILE 36 N 2.38 0.78 0.00 5.18 3.07 -1.78 0.01 117.51 127.16 2jfq h ILE 36 Ca 0.47 -0.02 0.00 0.00 1.55 0.00 0.00 64.86 66.86 2jfq h ILE 36 Cb 0.97 0.72 0.00 0.00 -0.27 0.00 0.00 36.82 38.24 2jfq h ILE 36 CO 0.88 0.01 0.00 0.61 -1.05 0.00 0.00 178.15 178.60 2jfq n GLY 37 N -1.62 -0.72 0.00 0.16 0.00 -0.81 -3.21 105.19 98.99 2jfq n GLY 37 Ca 0.09 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2jfq n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jfq n ARG 38 N -1.70 0.09 -1.51 1.61 1.74 -0.06 -5.04 116.66 111.78 2jfq n ARG 38 Ca 0.01 -0.31 -0.31 0.00 -0.77 0.00 0.00 57.85 56.47 2jfq n ARG 38 Cb 0.06 -0.57 0.06 0.00 -1.02 0.00 0.00 32.46 30.99 2jfq n ARG 38 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jfq s PRO 40 N -5.03 3.90 -0.10 0.00 0.04 -1.26 -5.03 135.00 127.52 2jfq s PRO 40 Ca 0.59 0.88 0.11 0.00 0.04 0.00 0.00 61.00 62.62 2jfq s PRO 40 Cb -0.15 -2.16 -0.24 0.00 0.04 0.00 0.00 34.50 32.00 2jfq s PRO 40 CO 0.55 -0.27 0.45 0.66 0.04 0.00 0.00 177.00 178.44 2jfq n TYR 41 N -1.64 0.75 -0.37 0.56 4.02 -1.26 -4.55 117.16 114.67 2jfq n TYR 41 Ca 0.06 0.25 0.03 0.00 -0.01 0.00 0.00 57.90 58.24 2jfq n TYR 41 Cb 0.54 -1.13 0.10 0.00 -0.02 0.00 0.00 39.34 38.83 2jfq n TYR 41 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2jfq n GLY 42 N 1.68 -1.82 0.07 2.72 0.00 -1.26 -1.16 105.19 105.43 2jfq n GLY 42 Ca -0.24 1.09 0.14 0.00 0.00 0.00 0.00 46.02 47.00 2jfq n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jfq n PRO 43 N -5.57 0.36 -1.71 1.61 -0.04 -1.26 -1.32 135.00 127.08 2jfq n PRO 43 Ca 0.14 -0.13 -0.31 0.00 -0.04 0.00 0.00 63.50 63.15 2jfq n PRO 43 Cb 0.46 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.46 2jfq n PRO 43 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2jfq s ARG 44 N -2.73 3.17 0.20 0.54 0.52 -0.30 -4.98 118.95 115.37 2jfq s ARG 44 Ca 0.21 0.92 -0.30 0.00 -0.52 0.00 0.00 55.73 56.04 2jfq s ARG 44 Cb 0.19 -2.02 -0.09 0.00 0.52 0.00 0.00 34.95 33.55 2jfq s ARG 44 CO 0.54 -0.92 1.38 -2.14 0.02 0.00 0.00 175.30 174.18 2jfq s PRO 45 N -4.97 4.33 0.30 3.54 0.02 -1.26 -4.81 135.00 132.15 2jfq s PRO 45 Ca 0.58 2.15 0.06 0.00 0.02 0.00 0.00 61.00 63.81 2jfq s PRO 45 Cb -0.13 -3.17 0.78 0.00 0.02 0.00 0.00 34.50 32.00 2jfq s PRO 45 CO 0.53 -0.35 1.72 0.78 -0.33 0.00 0.00 177.00 179.34 2jfq h GLY 46 N 5.53 1.69 1.72 0.52 0.00 -1.94 0.13 103.07 110.72 2jfq h GLY 46 Ca -0.45 -0.24 -0.03 0.00 0.00 0.00 0.00 47.33 46.61 2jfq h GLY 46 CO 0.79 -0.24 0.00 -2.09 0.00 0.00 0.00 176.54 175.01 2jfq h GLU 47 N 0.50 0.36 -0.03 4.80 4.57 -1.97 -0.61 114.58 122.19 2jfq h GLU 47 Ca 0.59 -0.06 -0.25 0.00 -1.18 0.00 0.00 59.36 58.46 2jfq h GLU 47 Cb 1.10 -0.06 0.02 0.00 -0.16 0.00 0.00 28.75 29.64 2jfq h GLU 47 CO -0.49 0.39 -0.97 0.37 -1.18 0.00 0.00 179.01 177.13 2jfq h GLN 48 N 0.35 0.68 -0.77 1.92 4.15 -1.15 -2.81 115.11 117.48 2jfq h GLN 48 Ca 0.08 -0.68 -0.06 0.00 0.77 0.00 0.00 58.65 58.76 2jfq h GLN 48 Cb 0.23 0.18 -0.03 0.00 0.21 0.00 0.00 27.48 28.07 2jfq h GLN 48 CO 0.00 1.28 0.26 0.28 -1.93 0.00 0.00 178.83 178.72 2jfq h VAL 49 N 0.40 1.26 -0.04 2.39 2.07 -0.82 -1.36 116.25 120.15 2jfq h VAL 49 Ca -0.10 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.53 2jfq h VAL 49 Cb 1.61 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.77 2jfq h VAL 49 CO 0.19 0.35 0.01 0.50 0.02 0.00 0.00 177.57 178.64 2jfq h LYS 50 N 1.14 0.02 -0.12 1.57 3.64 -1.12 0.12 116.57 121.82 2jfq h LYS 50 Ca 0.25 -0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.66 2jfq h LYS 50 Cb 0.28 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.06 2jfq h LYS 50 CO -0.01 0.02 -0.06 0.37 -2.27 0.00 0.00 179.45 177.49 2jfq h GLN 51 N 0.02 -0.05 -0.60 1.90 4.15 -1.24 -0.90 115.11 118.39 2jfq h GLN 51 Ca 0.02 0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.46 2jfq h GLN 51 Cb 0.01 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.68 2jfq h GLN 51 CO -0.02 -0.03 0.39 1.88 -1.93 0.00 0.00 178.83 179.11 2jfq h TYR 52 N -0.05 0.73 -0.60 3.99 0.99 -0.98 -1.41 116.97 119.63 2jfq h TYR 52 Ca 0.07 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.78 2jfq h TYR 52 Cb 0.16 -0.24 -0.03 0.00 1.00 0.00 0.00 36.73 37.62 2jfq h TYR 52 CO -0.19 0.44 0.21 1.15 -0.00 0.00 0.00 178.16 179.77 2jfq h THR 53 N 0.78 1.24 -0.78 -2.88 2.02 -0.45 -1.28 112.91 111.55 2jfq h THR 53 Ca 0.23 -0.77 -0.04 0.00 0.77 0.00 0.00 66.41 66.60 2jfq h THR 53 Cb -0.04 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 2jfq h THR 53 CO -0.07 0.30 0.32 0.58 0.37 0.00 0.00 175.52 177.02 2jfq h VAL 54 N 0.84 1.26 -0.13 3.16 2.07 -0.95 -1.15 116.25 121.36 2jfq h VAL 54 Ca 0.20 -0.79 0.00 0.00 0.82 0.00 0.00 66.70 66.93 2jfq h VAL 54 Cb 0.25 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 2jfq h VAL 54 CO -0.01 0.33 0.07 -0.33 0.02 0.00 0.00 177.57 177.65 2jfq h GLU 55 N 1.12 0.15 -0.02 1.57 5.08 -0.81 -1.04 114.58 120.63 2jfq h GLU 55 Ca 0.26 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.50 2jfq h GLU 55 Cb 0.20 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 2jfq h GLU 55 CO -0.02 0.10 -0.53 -0.84 -1.00 0.00 0.00 179.01 176.72 2jfq h ILE 56 N 0.16 1.38 -0.31 3.13 3.07 -1.09 -2.59 117.51 121.25 2jfq h ILE 56 Ca 0.05 -1.82 -0.03 0.00 1.55 0.00 0.00 64.86 64.61 2jfq h ILE 56 Cb -0.01 1.96 -0.01 0.00 -0.27 0.00 0.00 36.82 38.49 2jfq h ILE 56 CO -0.02 0.52 0.08 0.00 -1.05 0.00 0.00 178.15 177.68 2jfq h ALA 57 N 1.43 0.41 -0.41 0.16 0.00 -0.89 -1.71 119.26 118.24 2jfq h ALA 57 Ca -0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 2jfq h ALA 57 Cb 0.95 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 2jfq h ALA 57 CO 0.07 0.07 0.12 0.00 0.00 0.00 0.00 179.25 179.52 2jfq h ARG 58 N 0.34 0.59 -0.31 0.00 3.08 -1.08 -1.47 114.38 115.53 2jfq h ARG 58 Ca 0.10 -0.09 -0.05 0.00 0.07 0.00 0.00 59.98 60.01 2jfq h ARG 58 Cb 0.29 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 2jfq h ARG 58 CO 0.00 0.53 0.00 -0.22 -1.07 0.00 0.00 179.97 179.21 2jfq h LYS 59 N 0.59 0.55 -0.08 0.04 1.63 -1.20 -2.96 116.57 115.13 2jfq h LYS 59 Ca 0.14 -0.17 -0.10 0.00 -0.85 0.00 0.00 60.65 59.67 2jfq h LYS 59 Cb 0.18 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.75 2jfq h LYS 59 CO -0.01 0.68 -0.39 1.25 -3.45 0.00 0.00 179.45 177.54 2jfq h LEU 60 N 0.35 0.18 0.00 5.20 5.85 -1.01 -2.58 115.31 123.30 2jfq h LEU 60 Ca 0.09 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2jfq h LEU 60 Cb 0.43 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.41 2jfq h LEU 60 CO 0.02 0.56 0.00 0.23 -0.34 0.00 0.00 178.44 178.90 2jfq n MET 61 N -4.05 0.61 0.17 1.25 2.81 -0.58 -1.21 117.12 116.12 2jfq n MET 61 Ca -0.01 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 56.01 2jfq n MET 61 Cb 0.45 -1.34 0.46 0.00 -0.71 0.00 0.00 33.22 32.08 2jfq n MET 61 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 2jfq h GLU 62 N 0.00 0.00 -6.18 0.03 5.08 -1.47 -3.42 114.58 108.61 2jfq h GLU 62 Ca 0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.81 2jfq h GLU 62 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2jfq h GLU 62 CO 0.00 0.00 -0.35 -0.06 -1.00 0.00 0.00 179.01 177.60 2jfq s PHE 63 N -3.32 3.48 -1.49 4.33 0.40 -0.35 -5.00 117.98 116.04 2jfq s PHE 63 Ca 0.06 0.36 -0.12 0.00 -0.60 0.00 0.00 56.93 56.63 2jfq s PHE 63 Cb 0.09 -1.86 -0.04 0.00 0.51 0.00 0.00 43.02 41.72 2jfq s PHE 63 CO 0.53 0.41 2.58 -3.47 0.70 0.00 0.00 175.22 175.97 2jfq n ASP 64 N -0.45 6.30 -4.80 1.36 2.03 -1.26 -4.96 116.55 114.77 2jfq n ASP 64 Ca -0.04 -2.67 -0.35 0.00 0.52 0.00 0.00 54.79 52.25 2jfq n ASP 64 Cb 0.53 -1.56 -0.07 0.00 -0.72 0.00 0.00 41.12 39.31 2jfq n ASP 64 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2jfq s ILE 65 N 2.78 4.29 -0.96 5.18 -4.36 -1.26 -4.16 121.20 122.71 2jfq s ILE 65 Ca 0.58 1.62 0.22 0.00 -0.26 0.00 0.00 60.65 62.81 2jfq s ILE 65 Cb 0.16 -3.76 -0.18 0.00 1.25 0.00 0.00 42.46 39.92 2jfq s ILE 65 CO -0.06 -0.12 1.00 2.29 0.24 0.00 0.00 174.94 178.29 2jfq n LYS 66 N -0.15 0.03 -3.51 0.37 2.85 -0.56 -4.96 118.16 112.23 2jfq n LYS 66 Ca 0.05 -0.01 -0.17 0.00 -1.05 0.00 0.00 58.31 57.13 2jfq n LYS 66 Cb 0.52 -1.50 -0.06 0.00 -0.65 0.00 0.00 35.03 33.34 2jfq n LYS 66 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 177.40 178.76 2jfq s MET 67 N -3.02 1.06 -0.16 -1.58 0.00 -1.26 -4.19 119.30 110.15 2jfq s MET 67 Ca 0.08 0.20 0.02 0.00 0.00 0.00 0.00 55.69 55.98 2jfq s MET 67 Cb 0.16 0.50 0.01 0.00 0.00 0.00 0.00 34.83 35.51 2jfq s MET 67 CO 0.83 -0.34 -0.20 -1.17 0.00 0.00 0.00 175.02 174.14 2jfq s LEU 68 N -1.32 2.16 -0.20 4.11 2.96 0.13 -0.66 118.68 125.85 2jfq s LEU 68 Ca -0.10 -0.61 -0.04 0.00 -0.22 0.00 0.00 54.13 53.16 2jfq s LEU 68 Cb -0.00 -1.47 -0.02 0.00 0.50 0.00 0.00 46.19 45.19 2jfq s LEU 68 CO 0.08 0.04 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.44 2jfq s VAL 69 N 1.06 3.73 -0.67 1.68 1.01 0.11 -1.25 120.40 126.07 2jfq s VAL 69 Ca -0.01 -0.39 -0.18 0.00 0.00 0.00 0.00 61.98 61.40 2jfq s VAL 69 Cb -0.14 -2.68 0.12 0.00 0.00 0.00 0.00 36.38 33.68 2jfq s VAL 69 CO -0.07 0.43 0.77 -0.63 0.00 0.00 0.00 175.10 175.60 2jfq s ILE 70 N 1.10 4.91 0.28 2.22 1.01 0.26 -1.57 121.20 129.41 2jfq s ILE 70 Ca 0.02 -1.27 0.19 0.00 0.00 0.00 0.00 60.65 59.60 2jfq s ILE 70 Cb -0.14 -4.52 0.16 0.00 0.01 0.00 0.00 42.46 37.96 2jfq s ILE 70 CO 0.01 -1.16 1.85 0.00 0.00 0.00 0.00 174.94 175.63 2jfq h ALA 71 N 8.96 1.17 -2.22 9.38 0.00 -1.49 -2.99 119.26 132.07 2jfq h ALA 71 Ca -0.18 -0.28 -0.56 0.00 0.00 0.00 0.00 54.91 53.88 2jfq h ALA 71 Cb 1.07 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 2jfq h ALA 71 CO 1.06 0.38 0.71 0.00 0.00 0.00 0.00 179.25 181.40 2jfq h ASN 73 N 7.45 0.52 -0.26 0.00 4.21 -1.85 -0.06 115.58 125.58 2jfq h ASN 73 Ca -0.28 -0.22 -0.04 0.00 1.21 0.00 0.00 56.30 56.97 2jfq h ASN 73 Cb 1.12 -0.15 -0.01 0.00 -1.12 0.00 0.00 38.32 38.17 2jfq h ASN 73 CO 0.91 0.86 0.01 0.74 -1.29 0.00 0.00 177.43 178.65 2jfq h THR 74 N 0.41 1.25 -0.44 2.81 2.02 -1.92 -2.03 112.91 115.02 2jfq h THR 74 Ca 0.04 -0.88 -0.14 0.00 0.77 0.00 0.00 66.41 66.20 2jfq h THR 74 Cb 0.86 1.31 -0.01 0.00 -1.74 0.00 0.00 68.15 68.57 2jfq h THR 74 CO 0.07 0.28 -0.25 0.00 0.37 0.00 0.00 175.52 175.99 2jfq h ALA 75 N 0.83 0.63 -0.77 6.16 0.00 -1.92 -3.12 119.26 121.07 2jfq h ALA 75 Ca 0.08 -0.40 0.05 0.00 0.00 0.00 0.00 54.91 54.63 2jfq h ALA 75 Cb 0.40 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 2jfq h ALA 75 CO 0.01 0.64 0.47 1.15 0.00 0.00 0.00 179.25 181.52 2jfq h THR 76 N 0.79 1.05 -0.87 0.00 2.02 -0.92 0.09 112.91 115.07 2jfq h THR 76 Ca 0.09 -0.30 0.16 0.00 0.77 0.00 0.00 66.41 67.14 2jfq h THR 76 Cb 0.83 0.09 -0.07 0.00 -1.74 0.00 0.00 68.15 67.27 2jfq h THR 76 CO 0.07 0.16 0.57 0.00 0.37 0.00 0.00 175.52 176.69 2jfq h ALA 77 N 1.36 1.99 0.00 6.16 0.00 -1.30 -2.73 119.26 124.74 2jfq h ALA 77 Ca 0.33 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2jfq h ALA 77 Cb 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2jfq h ALA 77 CO -0.15 -0.24 -0.74 1.33 0.00 0.00 0.00 179.25 179.44 2jfq n VAL 78 N -4.54 0.00 0.08 0.00 0.24 -0.99 -4.81 118.33 108.32 2jfq n VAL 78 Ca 0.18 -0.27 0.01 0.00 -2.04 0.00 0.00 64.34 62.22 2jfq n VAL 78 Cb 0.55 0.73 -0.01 0.00 -1.47 0.00 0.00 33.84 33.64 2jfq n VAL 78 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jfq n ALA 79 N -1.41 2.25 -0.05 2.33 0.00 -0.02 -4.75 120.51 118.87 2jfq n ALA 79 Ca 0.00 -0.06 -0.09 0.00 0.00 0.00 0.00 53.44 53.29 2jfq n ALA 79 Cb 0.14 -0.09 -0.02 0.00 0.00 0.00 0.00 19.45 19.49 2jfq n ALA 79 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2jfq h LEU 80 N 0.00 0.06 -0.29 0.00 5.85 -1.64 -1.94 115.31 117.35 2jfq h LEU 80 Ca 0.00 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.79 2jfq h LEU 80 Cb 0.07 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 2jfq h LEU 80 CO 0.00 0.06 0.01 -0.08 -0.34 0.00 0.00 178.44 178.09 2jfq h GLU 81 N 0.15 0.09 -0.25 1.25 4.81 -1.86 0.31 114.58 119.09 2jfq h GLU 81 Ca 0.09 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2jfq h GLU 81 Cb 0.07 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 2jfq h GLU 81 CO -0.11 0.06 0.16 -0.92 -0.73 0.00 0.00 179.01 177.47 2jfq h TYR 82 N 0.09 0.32 -0.54 0.92 3.20 -1.81 -2.11 116.97 117.04 2jfq h TYR 82 Ca 0.14 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.90 2jfq h TYR 82 Cb 0.18 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.33 2jfq h TYR 82 CO -0.21 0.22 -0.12 -0.07 -1.64 0.00 0.00 178.16 176.34 2jfq h LEU 83 N 0.33 1.03 -1.06 2.82 3.38 -1.01 0.10 115.31 120.89 2jfq h LEU 83 Ca 0.09 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2jfq h LEU 83 Cb -0.02 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.41 2jfq h LEU 83 CO -0.02 1.14 0.56 1.56 0.09 0.00 0.00 178.44 181.78 2jfq h GLN 84 N 0.91 1.20 -0.14 1.13 4.20 -0.23 -0.88 115.11 121.30 2jfq h GLN 84 Ca 0.14 -0.09 -0.22 0.00 0.06 0.00 0.00 58.65 58.54 2jfq h GLN 84 Cb 0.69 -0.26 0.01 0.00 0.30 0.00 0.00 27.48 28.21 2jfq h GLN 84 CO 0.05 0.82 -0.77 0.87 -0.67 0.00 0.00 178.83 179.13 2jfq h LYS 85 N 1.22 0.71 0.06 1.46 1.57 -1.12 -3.37 116.57 117.11 2jfq h LYS 85 Ca 0.32 -0.58 -0.13 0.00 -1.87 0.00 0.00 60.65 58.40 2jfq h LYS 85 Cb -0.09 0.12 0.01 0.00 0.08 0.00 0.00 32.23 32.35 2jfq h LYS 85 CO -0.06 1.19 -0.53 1.15 -0.57 0.00 0.00 179.45 180.63 2jfq h THR 86 N 0.48 1.55 -4.26 -0.16 2.02 -0.81 -3.47 112.91 108.26 2jfq h THR 86 Ca -0.05 -2.31 -0.51 0.00 0.77 0.00 0.00 66.41 64.32 2jfq h THR 86 Cb 1.39 3.04 0.05 0.00 -1.74 0.00 0.00 68.15 70.89 2jfq h THR 86 CO 0.15 0.64 0.38 -0.76 0.37 0.00 0.00 175.52 176.31 2jfq s LEU 87 N -8.15 3.31 0.03 2.58 1.43 -0.35 -4.99 118.68 112.54 2jfq s LEU 87 Ca -0.15 1.38 0.22 0.00 -1.03 0.00 0.00 54.13 54.55 2jfq s LEU 87 Cb 0.01 -4.41 -0.20 0.00 0.03 0.00 0.00 46.19 41.62 2jfq s LEU 87 CO 0.79 -0.81 0.72 -1.54 0.23 0.00 0.00 176.35 175.74 2jfq n SER 88 N -2.60 0.37 -4.91 2.29 3.41 -1.26 -4.89 113.62 106.03 2jfq n SER 88 Ca 0.05 -0.10 -0.27 0.00 -0.26 0.00 0.00 58.87 58.29 2jfq n SER 88 Cb 0.54 1.40 0.00 0.00 -0.26 0.00 0.00 64.21 65.90 2jfq n SER 88 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2jfq s ILE 89 N -3.37 4.83 0.26 -1.33 -4.36 -1.26 -5.02 121.20 110.94 2jfq s ILE 89 Ca -0.03 0.18 -0.30 0.00 -0.26 0.00 0.00 60.65 60.24 2jfq s ILE 89 Cb 0.14 -3.84 -0.10 0.00 1.25 0.00 0.00 42.46 39.91 2jfq s ILE 89 CO 0.87 -0.82 1.34 -0.44 0.24 0.00 0.00 174.94 176.12 2jfq s SER 90 N -4.12 6.80 -0.09 4.36 0.01 -1.26 -4.87 113.70 114.53 2jfq s SER 90 Ca 0.48 2.57 0.02 0.00 1.31 0.00 0.00 55.95 60.32 2jfq s SER 90 Cb -0.10 -2.63 0.01 0.00 0.21 0.00 0.00 66.02 63.51 2jfq s SER 90 CO 0.45 -0.57 -0.14 -0.69 0.41 0.00 0.00 173.24 172.70 2jfq s VAL 91 N -0.36 1.33 0.02 3.43 1.01 -1.26 -0.70 120.40 123.87 2jfq s VAL 91 Ca 0.55 -0.56 0.04 0.00 0.00 0.00 0.00 61.98 62.01 2jfq s VAL 91 Cb -0.39 -1.21 -0.02 0.00 0.00 0.00 0.00 36.38 34.76 2jfq s VAL 91 CO 0.44 0.40 -0.13 -0.51 0.00 0.00 0.00 175.10 175.30 2jfq s ILE 92 N 0.85 1.05 0.47 2.22 2.07 -0.38 -4.88 121.20 122.61 2jfq s ILE 92 Ca -0.10 -0.83 0.06 0.00 -1.41 0.00 0.00 60.65 58.37 2jfq s ILE 92 Cb -0.15 -0.93 -0.01 0.00 0.13 0.00 0.00 42.46 41.49 2jfq s ILE 92 CO 0.01 0.10 0.23 -0.83 -1.91 0.00 0.00 174.94 172.54 2jfq s GLY 93 N -0.83 2.47 0.00 1.50 0.00 -1.26 -0.58 107.32 108.62 2jfq s GLY 93 Ca 0.03 -1.51 0.27 0.00 0.00 0.00 0.00 44.72 43.50 2jfq s GLY 93 CO 0.01 -1.97 1.62 3.33 0.00 0.00 0.00 173.10 176.09 2jfq n VAL 94 N -1.43 0.00 -0.07 1.40 0.24 -1.13 -4.41 118.33 112.93 2jfq n VAL 94 Ca -0.04 -0.23 -0.11 0.00 -2.04 0.00 0.00 64.34 61.92 2jfq n VAL 94 Cb 0.65 0.58 -0.08 0.00 -1.47 0.00 0.00 33.84 33.51 2jfq n VAL 94 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 2jfq h ILE 95 N 2.19 1.05 -0.93 1.34 2.04 -1.92 -3.34 117.51 117.95 2jfq h ILE 95 Ca 0.00 -1.86 0.04 0.00 1.00 0.00 0.00 64.86 64.04 2jfq h ILE 95 Cb 0.55 2.06 -0.06 0.00 -0.74 0.00 0.00 36.82 38.63 2jfq h ILE 95 CO 0.00 0.35 0.61 -0.33 0.00 0.00 0.00 178.15 178.78 2jfq h GLU 96 N -1.00 1.10 -0.42 2.37 5.08 -1.96 -0.37 114.58 119.38 2jfq h GLU 96 Ca -0.06 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 2jfq h GLU 96 Cb 0.75 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 2jfq h GLU 96 CO -0.03 0.73 0.14 -1.35 -1.00 0.00 0.00 179.01 177.50 2jfq h PRO 97 N 1.13 0.60 -0.05 2.33 0.11 -1.77 -0.18 132.00 134.16 2jfq h PRO 97 Ca 0.38 -0.09 -0.24 0.00 0.11 0.00 0.00 66.00 66.16 2jfq h PRO 97 Cb 0.07 -0.11 0.02 0.00 0.11 0.00 0.00 31.00 31.09 2jfq h PRO 97 CO -0.12 0.52 -0.92 0.78 -0.21 0.00 0.00 178.00 178.04 2jfq h GLY 98 N 0.77 0.79 1.01 -0.55 0.00 -1.47 -2.40 103.07 101.22 2jfq h GLY 98 Ca 0.14 -1.29 -0.00 0.00 0.00 0.00 0.00 47.33 46.18 2jfq h GLY 98 CO -0.01 1.15 0.44 0.00 0.00 0.00 0.00 176.54 178.12 2jfq h ALA 99 N 0.44 0.92 -0.64 3.60 0.00 -0.70 -0.84 119.26 122.05 2jfq h ALA 99 Ca -0.10 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 2jfq h ALA 99 Cb 1.57 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2jfq h ALA 99 CO 0.18 0.39 0.06 -0.09 0.00 0.00 0.00 179.25 179.80 2jfq h ARG 100 N 0.99 1.08 -0.12 0.00 2.43 -1.06 -2.07 114.38 115.62 2jfq h ARG 100 Ca 0.26 -0.31 -0.12 0.00 -0.81 0.00 0.00 59.98 59.01 2jfq h ARG 100 Cb -0.05 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 2jfq h ARG 100 CO -0.05 1.01 -0.45 1.15 -1.51 0.00 0.00 179.97 180.12 2jfq h THR 101 N 1.00 1.32 -0.66 0.20 2.02 -1.11 -2.33 112.91 113.36 2jfq h THR 101 Ca 0.19 -1.62 -0.08 0.00 0.77 0.00 0.00 66.41 65.67 2jfq h THR 101 Cb 0.48 1.72 -0.03 0.00 -1.74 0.00 0.00 68.15 68.59 2jfq h THR 101 CO 0.02 0.49 0.10 0.00 0.37 0.00 0.00 175.52 176.50 2jfq h ALA 102 N 1.29 0.87 -0.45 6.16 0.00 -0.79 -0.13 119.26 126.21 2jfq h ALA 102 Ca 0.02 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 2jfq h ALA 102 Cb 0.89 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2jfq h ALA 102 CO 0.07 0.64 0.08 0.82 0.00 0.00 0.00 179.25 180.86 2jfq h ILE 103 N 1.01 1.21 -0.15 0.00 2.04 -1.15 -0.47 117.51 120.00 2jfq h ILE 103 Ca 0.20 -0.78 -0.21 0.00 1.00 0.00 0.00 64.86 65.06 2jfq h ILE 103 Cb 0.45 0.79 0.01 0.00 -0.74 0.00 0.00 36.82 37.32 2jfq h ILE 103 CO 0.01 0.28 -0.75 -0.03 0.00 0.00 0.00 178.15 177.67 2jfq h MET 104 N 0.66 0.71 0.00 2.37 4.05 -0.95 -3.35 114.93 118.43 2jfq h MET 104 Ca 0.15 -0.57 -0.27 0.00 -0.28 0.00 0.00 59.70 58.73 2jfq h MET 104 Cb 0.30 0.11 -0.04 0.00 -0.80 0.00 0.00 31.60 31.17 2jfq h MET 104 CO 0.00 1.18 -1.50 1.79 0.23 0.00 0.00 176.91 178.62 2jfq h THR 105 N 0.49 1.10 -3.87 -0.77 1.35 -0.81 -3.47 112.91 106.94 2jfq h THR 105 Ca -0.04 -2.91 -0.53 0.00 -0.55 0.00 0.00 66.41 62.38 2jfq h THR 105 Cb 1.36 2.55 0.08 0.00 -1.73 0.00 0.00 68.15 70.41 2jfq h THR 105 CO 0.15 0.64 0.70 0.28 -0.25 0.00 0.00 175.52 177.04 2jfq s THR 106 N -2.63 2.46 -0.05 6.82 -1.32 -0.20 -4.92 115.64 115.80 2jfq s THR 106 Ca -0.03 0.46 0.07 0.00 -1.21 0.00 0.00 61.69 60.97 2jfq s THR 106 Cb 0.09 -3.29 -0.10 0.00 -1.51 0.00 0.00 72.50 67.69 2jfq s THR 106 CO 0.82 0.11 0.08 0.54 -2.21 0.00 0.00 174.62 173.96 2jfq n ARG 107 N 0.78 1.86 -0.24 7.08 5.12 -1.26 -4.60 116.66 125.40 2jfq n ARG 107 Ca 0.01 -0.03 0.10 0.00 -1.93 0.00 0.00 57.85 56.00 2jfq n ARG 107 Cb 0.41 -1.18 0.23 0.00 -1.16 0.00 0.00 32.46 30.76 2jfq n ARG 107 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 2jfq n ASN 108 N -2.07 3.45 -3.14 0.55 0.23 -1.26 -4.97 115.26 108.05 2jfq n ASN 108 Ca -0.08 -1.96 -0.23 0.00 -0.53 0.00 0.00 54.58 51.78 2jfq n ASN 108 Cb 0.52 -0.32 0.04 0.00 -2.08 0.00 0.00 39.78 37.95 2jfq n ASN 108 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2jfq n GLN 109 N 1.30 -5.46 -3.79 -3.83 1.13 -1.26 -4.93 117.38 100.53 2jfq n GLN 109 Ca 0.19 0.89 -0.27 0.00 -1.94 0.00 0.00 57.00 55.87 2jfq n GLN 109 Cb 0.55 -5.79 -0.17 0.00 0.11 0.00 0.00 30.24 24.95 2jfq n GLN 109 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 2jfq s ASN 110 N -2.82 2.76 -0.05 1.08 3.84 -1.26 -0.04 114.94 118.45 2jfq s ASN 110 Ca 0.36 -0.70 0.06 0.00 0.21 0.00 0.00 52.86 52.79 2jfq s ASN 110 Cb -0.16 -0.69 -0.02 0.00 -0.55 0.00 0.00 41.25 39.83 2jfq s ASN 110 CO 0.45 -0.26 -0.24 -0.69 -2.79 0.00 0.00 177.10 173.57 2jfq s VAL 111 N 1.79 2.21 -0.16 -5.21 1.01 0.06 -2.52 120.40 117.59 2jfq s VAL 111 Ca -0.00 -1.02 -0.05 0.00 0.00 0.00 0.00 61.98 60.91 2jfq s VAL 111 Cb -0.16 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 2jfq s VAL 111 CO -0.07 0.57 -0.00 -0.22 0.00 0.00 0.00 175.10 175.38 2jfq s LEU 112 N -0.36 3.46 -0.17 3.92 2.96 0.18 -1.68 118.68 126.98 2jfq s LEU 112 Ca 0.03 -0.04 -0.01 0.00 -0.22 0.00 0.00 54.13 53.89 2jfq s LEU 112 Cb -0.12 -1.85 -0.00 0.00 0.50 0.00 0.00 46.19 44.72 2jfq s LEU 112 CO 0.02 0.18 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.41 2jfq s VAL 113 N 0.30 2.78 -0.10 1.68 1.01 0.14 -0.20 120.40 126.01 2jfq s VAL 113 Ca -0.01 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 2jfq s VAL 113 Cb -0.13 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 2jfq s VAL 113 CO 0.02 0.50 -0.04 -0.76 0.00 0.00 0.00 175.10 174.81 2jfq s LEU 114 N 1.04 3.29 0.00 3.92 1.43 -0.70 -0.16 118.68 127.51 2jfq s LEU 114 Ca -0.01 -0.02 -0.02 0.00 -1.03 0.00 0.00 54.13 53.06 2jfq s LEU 114 Cb -0.15 -1.75 0.01 0.00 0.03 0.00 0.00 46.19 44.33 2jfq s LEU 114 CO -0.03 0.30 0.08 0.61 0.23 0.00 0.00 176.35 177.54 2jfq n GLY 115 N 2.63 0.86 3.85 -3.19 0.00 -1.05 -0.45 105.19 107.84 2jfq n GLY 115 Ca -0.18 -0.88 -0.29 0.00 0.00 0.00 0.00 46.02 44.67 2jfq n GLY 115 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jfq s THR 116 N -2.30 2.54 0.24 2.61 -4.23 -1.26 -0.78 115.64 112.47 2jfq s THR 116 Ca 0.02 0.18 -0.05 0.00 -1.18 0.00 0.00 61.69 60.65 2jfq s THR 116 Cb -0.00 -3.06 0.21 0.00 1.34 0.00 0.00 72.50 70.99 2jfq s THR 116 CO 0.00 -0.23 1.83 -0.08 -0.54 0.00 0.00 174.62 175.60 2jfq h GLU 117 N -1.09 0.85 -0.43 3.99 4.81 -1.95 -0.74 114.58 120.02 2jfq h GLU 117 Ca -0.47 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 58.68 2jfq h GLU 117 Cb 1.30 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.47 2jfq h GLU 117 CO 0.63 0.56 0.16 0.78 -0.73 0.00 0.00 179.01 180.41 2jfq h GLY 118 N 0.87 0.70 0.86 1.92 0.00 -1.52 0.58 103.07 106.48 2jfq h GLY 118 Ca 0.38 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2jfq h GLY 118 CO -0.21 0.37 -0.06 -0.84 0.00 0.00 0.00 176.54 175.80 2jfq h THR 119 N 0.55 0.94 -0.58 4.70 2.02 -1.69 -2.15 112.91 116.70 2jfq h THR 119 Ca 0.14 -0.31 0.01 0.00 0.77 0.00 0.00 66.41 67.02 2jfq h THR 119 Cb 0.21 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.73 2jfq h THR 119 CO -0.01 0.07 0.38 0.40 0.37 0.00 0.00 175.52 176.74 2jfq h ILE 120 N -0.32 1.14 -0.33 3.11 1.08 -1.13 -2.70 117.51 118.37 2jfq h ILE 120 Ca -0.02 -0.27 -0.01 0.00 -0.39 0.00 0.00 64.86 64.18 2jfq h ILE 120 Cb 0.26 0.30 -0.02 0.00 -3.07 0.00 0.00 36.82 34.29 2jfq h ILE 120 CO 0.03 0.14 0.18 0.50 -0.69 0.00 0.00 178.15 178.31 2jfq h LYS 121 N 0.78 0.45 0.00 2.37 3.64 -0.79 -2.16 116.57 120.86 2jfq h LYS 121 Ca 0.21 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.52 2jfq h LYS 121 Cb -0.08 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.64 2jfq h LYS 121 CO -0.05 0.34 -0.19 0.66 -2.27 0.00 0.00 179.45 177.94 2jfq h SER 122 N 0.46 0.00 -2.80 4.20 4.64 -1.05 -3.47 113.55 115.53 2jfq h SER 122 Ca 0.12 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 61.03 2jfq h SER 122 Cb 0.02 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.07 2jfq h SER 122 CO -0.02 0.19 -0.50 -0.62 -0.87 0.00 0.00 176.83 175.01 2jfq n GLU 123 N -3.28 -1.69 -0.35 4.77 1.02 -0.81 -4.87 120.64 115.43 2jfq n GLU 123 Ca 0.01 1.01 -0.03 0.00 -0.02 0.00 0.00 57.16 58.13 2jfq n GLU 123 Cb 0.46 -5.63 0.10 0.00 -0.02 0.00 0.00 31.44 26.34 2jfq n GLU 123 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jfq h ALA 124 N 0.87 1.20 0.06 0.62 0.00 -1.85 -1.27 119.26 118.88 2jfq h ALA 124 Ca -0.47 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.34 2jfq h ALA 124 Cb 1.35 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2jfq h ALA 124 CO 0.57 0.63 -0.03 1.88 0.00 0.00 0.00 179.25 182.31 2jfq h TYR 125 N 1.29 -0.07 -0.67 0.00 -1.99 -1.89 -1.15 116.97 112.49 2jfq h TYR 125 Ca 0.34 -0.00 0.04 0.00 2.00 0.00 0.00 58.73 61.11 2jfq h TYR 125 Cb -0.09 0.02 -0.05 0.00 2.00 0.00 0.00 36.73 38.62 2jfq h TYR 125 CO 0.00 0.20 0.40 -0.09 -0.00 0.00 0.00 178.16 178.66 2jfq h ARG 126 N -0.33 0.73 0.24 4.88 2.43 -1.91 -1.04 114.38 119.38 2jfq h ARG 126 Ca -0.01 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 2jfq h ARG 126 Cb 0.30 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2jfq h ARG 126 CO 0.01 0.48 -0.15 1.15 -1.51 0.00 0.00 179.97 179.95 2jfq h THR 127 N 0.75 0.68 0.00 0.20 2.02 -1.11 -0.73 112.91 114.72 2jfq h THR 127 Ca 0.29 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.41 2jfq h THR 127 Cb 0.11 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 2jfq h THR 127 CO -0.14 0.00 -0.28 0.45 0.37 0.00 0.00 175.52 175.92 2jfq h HIS 128 N -0.38 0.00 -0.01 3.16 3.86 -0.99 -2.07 115.15 118.72 2jfq h HIS 128 Ca -0.02 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.05 2jfq h HIS 128 Cb 0.32 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.80 2jfq h HIS 128 CO -0.09 0.28 -0.54 0.82 0.86 0.00 0.00 177.93 179.26 2jfq h ILE 129 N 0.00 1.44 0.00 2.45 2.04 -1.03 -3.24 117.51 119.18 2jfq h ILE 129 Ca -0.00 -2.04 -0.04 0.00 1.00 0.00 0.00 64.86 63.78 2jfq h ILE 129 Cb 0.52 2.59 -0.01 0.00 -0.74 0.00 0.00 36.82 39.18 2jfq h ILE 129 CO 0.04 0.59 -0.19 0.11 0.00 0.00 0.00 178.15 178.70 2jfq h LYS 130 N -0.15 0.00 -0.38 2.37 1.79 -1.02 0.19 116.57 119.37 2jfq h LYS 130 Ca -0.06 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.32 2jfq h LYS 130 Cb 1.25 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.88 2jfq h LYS 130 CO 0.11 0.19 -0.10 0.00 -1.08 0.00 0.00 179.45 178.56 2jfq h ARG 131 N 0.00 0.66 0.01 3.15 3.08 -1.40 -3.07 114.38 116.81 2jfq h ARG 131 Ca -0.00 -0.20 -0.33 0.00 0.07 0.00 0.00 59.98 59.52 2jfq h ARG 131 Cb 0.36 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.30 2jfq h ARG 131 CO 0.02 0.75 -1.80 -0.89 -1.07 0.00 0.00 179.97 176.99 2jfq n ILE 132 N -4.18 1.55 -3.63 2.04 5.41 -0.94 -4.82 119.36 114.78 2jfq n ILE 132 Ca 0.01 -0.21 -0.29 0.00 1.00 0.00 0.00 62.75 63.26 2jfq n ILE 132 Cb 0.34 -1.94 -0.13 0.00 -0.71 0.00 0.00 39.64 37.20 2jfq n ILE 132 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 2jfq s ASN 133 N -7.08 3.49 0.00 4.38 3.04 0.64 -4.98 114.94 114.43 2jfq s ASN 133 Ca -0.32 -2.29 0.11 0.00 0.04 0.00 0.00 52.86 50.39 2jfq s ASN 133 Cb 0.09 -0.79 0.49 0.00 -1.54 0.00 0.00 41.25 39.50 2jfq s ASN 133 CO 0.57 -0.31 1.29 -0.81 -3.04 0.00 0.00 177.10 174.80 2jfq n PRO 134 N 3.95 0.07 0.11 0.43 -0.04 -1.16 -2.52 135.00 135.85 2jfq n PRO 134 Ca 0.08 0.26 -0.03 0.00 -0.04 0.00 0.00 63.50 63.76 2jfq n PRO 134 Cb 0.37 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.39 2jfq n PRO 134 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2jfq h HIS 135 N 0.00 0.00 -2.85 0.54 3.86 -1.91 -3.45 115.15 111.34 2jfq h HIS 135 Ca 0.00 0.00 -0.54 0.00 -1.16 0.00 0.00 60.37 58.67 2jfq h HIS 135 Cb 0.14 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.61 2jfq h HIS 135 CO 0.00 0.75 0.88 0.08 0.86 0.00 0.00 177.93 180.51 2jfq s VAL 136 N -3.24 3.65 0.10 2.45 1.01 -1.05 -4.94 120.40 118.38 2jfq s VAL 136 Ca -0.00 1.01 -0.26 0.00 0.00 0.00 0.00 61.98 62.72 2jfq s VAL 136 Cb 0.11 -3.65 -0.06 0.00 0.00 0.00 0.00 36.38 32.78 2jfq s VAL 136 CO 0.78 -0.02 0.81 -0.70 0.00 0.00 0.00 175.10 175.98 2jfq s GLU 137 N 2.67 4.57 -0.06 2.72 2.12 0.94 -4.83 118.70 126.85 2jfq s GLU 137 Ca 0.65 1.18 0.02 0.00 0.36 0.00 0.00 54.97 57.18 2jfq s GLU 137 Cb -0.32 -3.33 0.02 0.00 0.26 0.00 0.00 34.13 30.75 2jfq s GLU 137 CO 0.27 0.36 -0.09 0.08 -0.54 0.00 0.00 175.26 175.34 2jfq s VAL 138 N -0.41 0.88 -0.05 3.70 1.01 -1.26 -0.76 120.40 123.52 2jfq s VAL 138 Ca 0.39 -0.33 0.04 0.00 0.00 0.00 0.00 61.98 62.08 2jfq s VAL 138 Cb -0.22 -0.84 0.00 0.00 0.00 0.00 0.00 36.38 35.32 2jfq s VAL 138 CO 0.26 0.30 -0.17 -1.00 0.00 0.00 0.00 175.10 174.49 2jfq s HIS 139 N 0.78 1.78 -0.03 5.22 3.76 -0.67 -4.98 115.29 121.14 2jfq s HIS 139 Ca -0.13 -0.57 0.04 0.00 -0.15 0.00 0.00 55.06 54.25 2jfq s HIS 139 Cb -0.15 -1.21 -0.03 0.00 1.11 0.00 0.00 32.58 32.30 2jfq s HIS 139 CO 0.02 -0.22 -0.16 0.20 -0.85 0.00 0.00 174.74 173.73 2jfq s GLY 140 N 0.20 1.52 -0.08 -2.22 0.00 -1.26 0.28 107.32 105.76 2jfq s GLY 140 Ca -0.08 -1.02 0.00 0.00 0.00 0.00 0.00 44.72 43.62 2jfq s GLY 140 CO 0.03 -0.82 -0.05 0.14 0.00 0.00 0.00 173.10 172.40 2jfq s VAL 141 N -0.75 0.74 0.22 1.40 1.01 0.77 -4.94 120.40 118.85 2jfq s VAL 141 Ca 0.12 -0.17 -0.30 0.00 0.00 0.00 0.00 61.98 61.64 2jfq s VAL 141 Cb -0.11 -0.78 -0.08 0.00 0.00 0.00 0.00 36.38 35.41 2jfq s VAL 141 CO 0.01 0.30 1.01 0.00 0.00 0.00 0.00 175.10 176.42 2jfq s ALA 142 N 1.39 3.35 -0.51 5.51 0.00 -1.26 -2.52 121.76 127.71 2jfq s ALA 142 Ca -0.03 0.72 0.07 0.00 0.00 0.00 0.00 51.96 52.73 2jfq s ALA 142 Cb -0.13 -3.28 0.33 0.00 0.00 0.00 0.00 23.12 20.04 2jfq s ALA 142 CO -0.03 0.00 0.86 0.00 0.00 0.00 0.00 175.76 176.58 2jfq h PRO 144 N 3.10 0.17 0.00 0.00 0.13 -1.95 -1.11 132.00 132.34 2jfq h PRO 144 Ca 0.12 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2jfq h PRO 144 Cb 0.67 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.76 2jfq h PRO 144 CO 0.71 0.12 0.00 0.41 -0.23 0.00 0.00 178.00 179.01 2jfq n GLY 145 N -1.34 -1.26 0.25 1.56 0.00 -1.26 -3.72 105.19 99.43 2jfq n GLY 145 Ca 0.35 0.03 -0.11 0.00 0.00 0.00 0.00 46.02 46.28 2jfq n GLY 145 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2jfq h PHE 146 N 0.00 0.97 0.40 1.61 0.05 -1.59 -3.03 116.94 115.35 2jfq h PHE 146 Ca 0.00 -0.22 -0.02 0.00 3.82 0.00 0.00 57.97 61.56 2jfq h PHE 146 Cb 0.38 -0.24 0.00 0.00 2.00 0.00 0.00 35.95 38.10 2jfq h PHE 146 CO 0.00 0.98 -0.20 0.28 -0.18 0.00 0.00 178.31 179.18 2jfq h VAL 147 N 0.69 0.58 -0.78 -0.55 2.07 -1.76 -2.13 116.25 114.37 2jfq h VAL 147 Ca 0.11 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.71 2jfq h VAL 147 Cb 0.67 0.58 -0.07 0.00 -1.52 0.00 0.00 31.29 30.95 2jfq h VAL 147 CO 0.05 0.00 0.44 -0.65 0.02 0.00 0.00 177.57 177.43 2jfq h PRO 148 N -0.55 0.74 -0.60 1.57 0.11 -1.76 0.98 132.00 132.48 2jfq h PRO 148 Ca -0.05 -0.04 0.07 0.00 0.11 0.00 0.00 66.00 66.08 2jfq h PRO 148 Cb 0.43 -0.17 -0.06 0.00 0.11 0.00 0.00 31.00 31.32 2jfq h PRO 148 CO 0.08 0.49 0.28 1.25 -0.21 0.00 0.00 178.00 179.89 2jfq h LEU 149 N 0.76 0.37 -0.05 2.35 5.85 -1.39 0.70 115.31 123.90 2jfq h LEU 149 Ca 0.37 0.05 -0.12 0.00 0.84 0.00 0.00 57.88 59.02 2jfq h LEU 149 Cb 0.30 -0.01 0.01 0.00 0.37 0.00 0.00 40.66 41.33 2jfq h LEU 149 CO -0.23 0.24 -0.44 0.58 -0.34 0.00 0.00 178.44 178.25 2jfq h VAL 150 N 0.52 1.43 -0.87 1.05 2.07 -0.67 -1.18 116.25 118.59 2jfq h VAL 150 Ca 0.28 -1.89 -0.02 0.00 0.82 0.00 0.00 66.70 65.90 2jfq h VAL 150 Cb 0.25 2.44 -0.04 0.00 -1.52 0.00 0.00 31.29 32.42 2jfq h VAL 150 CO -0.23 0.55 0.47 -0.33 0.02 0.00 0.00 177.57 178.06 2jfq h GLU 151 N -0.12 1.21 -0.55 1.57 4.39 -0.65 -2.02 114.58 118.42 2jfq h GLU 151 Ca -0.04 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.52 2jfq h GLU 151 Cb 1.12 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 29.53 2jfq h GLU 151 CO 0.09 0.89 0.00 1.04 -1.16 0.00 0.00 179.01 179.87 2jfq n GLN 152 N -4.33 1.63 -3.62 2.33 6.02 0.22 -4.92 117.38 114.71 2jfq n GLN 152 Ca 0.09 -0.64 -0.29 0.00 -0.01 0.00 0.00 57.00 56.15 2jfq n GLN 152 Cb 0.10 -1.41 0.04 0.00 1.02 0.00 0.00 30.24 30.00 2jfq n GLN 152 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 2jfq n MET 153 N 0.06 -1.32 -0.08 -1.09 2.81 -0.76 -4.92 117.12 111.82 2jfq n MET 153 Ca 0.06 0.54 0.01 0.00 -1.81 0.00 0.00 57.70 56.50 2jfq n MET 153 Cb 0.30 -4.29 0.02 0.00 -0.71 0.00 0.00 33.22 28.55 2jfq n MET 153 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2jfq n ARG 154 N -3.98 1.21 -0.01 0.03 5.12 -0.45 -4.74 116.66 113.84 2jfq n ARG 154 Ca -0.09 -1.19 0.11 0.00 -1.93 0.00 0.00 57.85 54.74 2jfq n ARG 154 Cb 0.59 -0.80 0.59 0.00 -1.16 0.00 0.00 32.46 31.68 2jfq n ARG 154 CO 0.00 0.00 0.00 2.48 -1.93 0.00 0.00 177.63 178.18 2jfq n TYR 155 N -0.36 0.02 0.07 -1.55 0.18 -1.23 -3.95 117.16 110.34 2jfq n TYR 155 Ca 0.02 -0.01 -0.02 0.00 1.88 0.00 0.00 57.90 59.77 2jfq n TYR 155 Cb 0.46 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.36 2jfq n TYR 155 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 2jfq h SER 156 N 0.29 0.00 -3.80 9.48 0.87 -1.92 -3.45 113.55 115.02 2jfq h SER 156 Ca 0.00 0.00 -0.64 0.00 -1.23 0.00 0.00 61.79 59.92 2jfq h SER 156 Cb 0.06 0.00 -0.17 0.00 -0.44 0.00 0.00 62.40 61.85 2jfq h SER 156 CO 0.00 0.70 -0.53 1.51 -0.53 0.00 0.00 176.83 177.98 2jfq s ASP 157 N -6.31 5.90 0.57 6.23 3.84 -1.25 -4.95 116.67 120.69 2jfq s ASP 157 Ca 0.01 -0.02 0.29 0.00 -0.00 0.00 0.00 52.55 52.83 2jfq s ASP 157 Cb 0.08 -2.09 1.46 0.00 -1.38 0.00 0.00 42.92 41.00 2jfq s ASP 157 CO 0.79 -0.03 1.88 -0.65 -0.00 0.00 0.00 175.17 177.16 2jfq h PRO 158 N 8.19 0.00 0.67 2.11 0.11 -1.93 -2.80 132.00 138.35 2jfq h PRO 158 Ca -0.36 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.72 2jfq h PRO 158 Cb 1.18 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.30 2jfq h PRO 158 CO 0.57 0.00 -0.32 1.15 -0.21 0.00 0.00 178.00 179.19 2jfq h THR 159 N 0.00 0.28 0.07 -1.15 2.02 -1.98 -2.65 112.91 109.51 2jfq h THR 159 Ca 0.29 -0.15 -0.10 0.00 0.77 0.00 0.00 66.41 67.22 2jfq h THR 159 Cb 1.38 0.33 0.01 0.00 -1.74 0.00 0.00 68.15 68.13 2jfq h THR 159 CO -0.00 0.02 -0.45 0.40 0.37 0.00 0.00 175.52 175.86 2jfq h ILE 160 N -1.01 1.62 -0.95 3.11 2.04 -1.88 -2.86 117.51 117.59 2jfq h ILE 160 Ca -0.09 -2.40 0.04 0.00 1.00 0.00 0.00 64.86 63.41 2jfq h ILE 160 Cb 0.72 3.22 -0.06 0.00 -0.74 0.00 0.00 36.82 39.96 2jfq h ILE 160 CO 0.15 0.66 0.62 0.71 0.00 0.00 0.00 178.15 180.29 2jfq h THR 161 N -0.61 1.15 -0.70 -0.27 1.35 -1.61 -2.08 112.91 110.15 2jfq h THR 161 Ca -0.08 -0.40 -0.05 0.00 -0.55 0.00 0.00 66.41 65.33 2jfq h THR 161 Cb 1.33 -0.13 -0.03 0.00 -1.73 0.00 0.00 68.15 67.59 2jfq h THR 161 CO 0.08 0.22 0.23 0.77 -0.25 0.00 0.00 175.52 176.57 2jfq h SER 162 N 1.18 0.99 0.28 5.36 4.64 -1.29 0.20 113.55 124.91 2jfq h SER 162 Ca 0.38 -0.17 -0.01 0.00 -0.47 0.00 0.00 61.79 61.52 2jfq h SER 162 Cb 0.03 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 61.87 2jfq h SER 162 CO -0.12 0.91 -0.14 0.40 -0.87 0.00 0.00 176.83 177.01 2jfq h ILE 163 N 1.03 0.75 -0.70 0.95 2.04 -1.28 0.12 117.51 120.42 2jfq h ILE 163 Ca 0.23 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.84 2jfq h ILE 163 Cb 0.27 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 2jfq h ILE 163 CO -0.01 0.05 0.30 0.58 0.00 0.00 0.00 178.15 179.06 2jfq h VAL 164 N -0.49 1.24 -0.13 1.67 2.07 -1.23 -2.13 116.25 117.25 2jfq h VAL 164 Ca -0.04 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 2jfq h VAL 164 Cb 0.37 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 2jfq h VAL 164 CO 0.06 0.30 0.03 0.40 0.02 0.00 0.00 177.57 178.38 2jfq h ILE 165 N 0.99 1.19 -0.36 4.57 2.04 -0.86 -2.87 117.51 122.20 2jfq h ILE 165 Ca 0.23 -0.61 0.02 0.00 1.00 0.00 0.00 64.86 65.51 2jfq h ILE 165 Cb 0.18 1.36 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 2jfq h ILE 165 CO -0.02 0.18 0.20 -0.74 0.00 0.00 0.00 178.15 177.77 2jfq h HIS 166 N 0.00 0.38 0.00 1.37 2.76 -0.65 0.42 115.15 119.43 2jfq h HIS 166 Ca 0.04 0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.22 2jfq h HIS 166 Cb 0.25 -0.12 -0.00 0.00 1.55 0.00 0.00 27.41 29.09 2jfq h HIS 166 CO 0.01 0.22 -0.02 1.96 -1.30 0.00 0.00 177.93 178.79 2jfq h GLN 167 N 0.41 0.00 0.06 5.26 1.08 -1.37 0.25 115.11 120.81 2jfq h GLN 167 Ca 0.15 0.00 -0.34 0.00 -1.45 0.00 0.00 58.65 57.00 2jfq h GLN 167 Cb 0.02 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.42 2jfq h GLN 167 CO -0.08 0.02 -1.92 2.41 -0.95 0.00 0.00 178.83 178.30 2jfq n THR 168 N -3.66 1.65 -0.27 -0.54 -1.04 -0.63 -4.56 114.28 105.22 2jfq n THR 168 Ca -0.03 -0.44 0.09 0.00 -2.04 0.00 0.00 64.05 61.63 2jfq n THR 168 Cb 0.11 -1.79 0.25 0.00 -1.82 0.00 0.00 70.33 67.08 2jfq n THR 168 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2jfq n LEU 169 N -3.79 3.51 -0.24 -4.42 4.77 0.14 -4.65 117.00 112.31 2jfq n LEU 169 Ca -0.36 -1.98 0.04 0.00 -0.03 0.00 0.00 56.01 53.68 2jfq n LEU 169 Cb 0.92 -0.37 0.16 0.00 -2.33 0.00 0.00 43.42 41.80 2jfq n LEU 169 CO 0.30 0.87 0.96 0.07 -1.33 0.00 0.00 177.39 178.25 2jfq h LYS 170 N 3.35 0.31 0.00 3.23 2.10 -0.68 0.19 116.57 125.07 2jfq h LYS 170 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 2jfq h LYS 170 Cb 0.88 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.14 2jfq h LYS 170 CO 0.00 0.21 0.00 0.54 -2.00 0.00 0.00 179.45 178.20 2jfq n ARG 171 N -5.10 0.13 -0.00 0.07 3.00 -1.26 -2.60 116.66 110.90 2jfq n ARG 171 Ca 0.13 0.52 0.01 0.00 -0.01 0.00 0.00 57.85 58.50 2jfq n ARG 171 Cb 0.41 -1.85 0.01 0.00 0.00 0.00 0.00 32.46 31.03 2jfq n ARG 171 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.63 178.54 2jfq n TRP 172 N -2.12 0.01 -0.15 -1.55 7.02 0.50 -4.73 117.44 116.41 2jfq n TRP 172 Ca 0.00 -0.07 0.28 0.00 -1.02 0.00 0.00 57.50 56.69 2jfq n TRP 172 Cb 0.11 -0.01 0.72 0.00 -2.42 0.00 0.00 31.31 29.71 2jfq n TRP 172 CO 0.00 0.00 0.00 -0.09 -2.02 0.00 0.00 177.69 175.58 2jfq h ARG 173 N 0.21 0.00 -0.17 -0.99 2.43 -0.82 -1.64 114.38 113.40 2jfq h ARG 173 Ca 0.00 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.01 2jfq h ARG 173 Cb 0.12 0.00 -0.20 0.00 -0.42 0.00 0.00 29.97 29.47 2jfq h ARG 173 CO 0.00 0.00 -0.72 0.09 -1.51 0.00 0.00 179.97 177.83 2jfq n ASN 174 N -4.01 2.15 -4.70 -3.80 3.02 -1.26 -4.76 115.26 101.90 2jfq n ASN 174 Ca 0.18 -3.32 -0.30 0.00 -0.03 0.00 0.00 54.58 51.11 2jfq n ASN 174 Cb 1.01 -0.44 0.15 0.00 -0.61 0.00 0.00 39.78 39.88 2jfq n ASN 174 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2jfq s SER 175 N -3.08 3.28 0.49 6.41 1.04 -0.62 -4.94 113.70 116.27 2jfq s SER 175 Ca 0.39 1.57 0.28 0.00 0.48 0.00 0.00 55.95 58.66 2jfq s SER 175 Cb 0.38 -2.23 1.20 0.00 0.10 0.00 0.00 66.02 65.46 2jfq s SER 175 CO -0.07 -2.77 1.94 -0.33 0.98 0.00 0.00 173.24 172.99 2jfq h GLU 176 N -1.64 0.00 -6.40 4.02 4.39 -1.98 -3.45 114.58 109.52 2jfq h GLU 176 Ca -0.50 0.00 -0.62 0.00 0.34 0.00 0.00 59.36 58.59 2jfq h GLU 176 Cb 1.28 0.00 0.05 0.00 -0.10 0.00 0.00 28.75 29.98 2jfq h GLU 176 CO 0.53 0.15 0.78 0.43 -1.16 0.00 0.00 179.01 179.74 2jfq n SER 177 N -3.38 2.81 -0.91 1.42 7.64 -1.26 -4.88 113.62 115.06 2jfq n SER 177 Ca -0.00 1.07 0.12 0.00 1.01 0.00 0.00 58.87 61.07 2jfq n SER 177 Cb 0.34 -1.35 0.12 0.00 -1.01 0.00 0.00 64.21 62.31 2jfq n SER 177 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2jfq n ASP 178 N 3.87 2.86 -3.90 6.43 5.75 -1.05 -4.80 116.55 125.71 2jfq n ASP 178 Ca 0.19 -1.94 -0.15 0.00 -0.01 0.00 0.00 54.79 52.88 2jfq n ASP 178 Cb 0.26 0.03 -0.15 0.00 -1.03 0.00 0.00 41.12 40.23 2jfq n ASP 178 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2jfq s THR 179 N -2.03 0.23 -0.07 2.12 2.01 -1.23 -0.61 115.64 116.06 2jfq s THR 179 Ca 0.28 -0.08 0.02 0.00 0.31 0.00 0.00 61.69 62.22 2jfq s THR 179 Cb 0.20 -0.22 0.01 0.00 0.01 0.00 0.00 72.50 72.50 2jfq s THR 179 CO 0.32 0.09 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.53 2jfq s VAL 180 N 0.17 1.11 -0.23 3.82 1.01 0.72 -0.65 120.40 126.34 2jfq s VAL 180 Ca -0.01 -0.46 -0.10 0.00 0.00 0.00 0.00 61.98 61.41 2jfq s VAL 180 Cb -0.04 -1.02 -0.05 0.00 0.00 0.00 0.00 36.38 35.27 2jfq s VAL 180 CO -0.00 0.35 0.14 -0.63 0.00 0.00 0.00 175.10 174.95 2jfq s ILE 181 N 0.70 5.19 -1.21 2.22 1.01 0.72 -0.59 121.20 129.24 2jfq s ILE 181 Ca -0.14 0.12 -0.17 0.00 0.00 0.00 0.00 60.65 60.46 2jfq s ILE 181 Cb -0.16 -3.41 0.12 0.00 0.01 0.00 0.00 42.46 39.02 2jfq s ILE 181 CO 0.03 0.37 1.54 -0.76 0.00 0.00 0.00 174.94 176.12 2jfq s LEU 182 N 0.96 4.43 -0.03 2.97 1.43 0.38 -1.71 118.68 127.11 2jfq s LEU 182 Ca 0.07 -2.58 -0.06 0.00 -1.03 0.00 0.00 54.13 50.53 2jfq s LEU 182 Cb -0.13 -2.49 -0.24 0.00 0.03 0.00 0.00 46.19 43.35 2jfq s LEU 182 CO 0.03 -1.00 3.54 0.61 0.23 0.00 0.00 176.35 179.76 2jfq n GLY 183 N 4.96 3.07 3.57 -3.19 0.00 0.40 -3.71 105.19 110.29 2jfq n GLY 183 Ca 0.41 -1.22 -0.15 0.00 0.00 0.00 0.00 46.02 45.06 2jfq n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jfq h THR 185 N 3.87 0.92 0.00 0.00 1.35 -1.86 -2.94 112.91 114.26 2jfq h THR 185 Ca -0.28 -0.10 -0.17 0.00 -0.55 0.00 0.00 66.41 65.31 2jfq h THR 185 Cb 1.16 0.62 -0.03 0.00 -1.73 0.00 0.00 68.15 68.17 2jfq h THR 185 CO 0.14 0.05 -0.91 0.45 -0.25 0.00 0.00 175.52 174.99 2jfq h HIS 186 N 0.28 0.00 -0.14 4.73 3.86 -1.96 -3.37 115.15 118.55 2jfq h HIS 186 Ca 0.20 0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.45 2jfq h HIS 186 Cb 0.42 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.88 2jfq h HIS 186 CO -0.00 0.75 0.19 1.88 0.86 0.00 0.00 177.93 181.61 2jfq h TYR 187 N 0.00 0.00 -0.23 2.45 -1.99 -1.86 -2.15 116.97 113.19 2jfq h TYR 187 Ca -0.05 0.00 0.03 0.00 2.00 0.00 0.00 58.73 60.71 2jfq h TYR 187 Cb 1.62 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 40.34 2jfq h TYR 187 CO 0.00 0.00 0.16 -1.35 -0.00 0.00 0.00 178.16 176.97 2jfq h PRO 188 N 0.00 0.16 0.00 4.88 0.11 -1.76 0.20 132.00 135.59 2jfq h PRO 188 Ca 0.06 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.16 2jfq h PRO 188 Cb 0.44 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.52 2jfq h PRO 188 CO -0.00 0.11 0.00 -0.07 -0.21 0.00 0.00 178.00 177.83 2jfq h LEU 189 N 0.17 0.00 -2.68 2.35 -0.00 -1.70 -1.29 115.31 112.16 2jfq h LEU 189 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.98 2jfq h LEU 189 Cb 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.85 2jfq h LEU 189 CO -0.02 0.00 0.00 0.18 -0.00 0.00 0.00 178.44 178.60 2jfq n LEU 190 N -2.45 3.16 -0.24 1.67 4.77 0.67 -4.79 117.00 119.79 2jfq n LEU 190 Ca -0.00 -1.87 -0.07 0.00 -0.03 0.00 0.00 56.01 54.04 2jfq n LEU 190 Cb 0.14 -0.28 -0.06 0.00 -2.33 0.00 0.00 43.42 40.89 2jfq n LEU 190 CO 0.17 0.77 0.49 0.22 -1.33 0.00 0.00 177.39 177.71 2jfq h TYR 191 N 2.84 -1.16 -0.15 -1.77 3.20 -0.89 -1.26 116.97 117.79 2jfq h TYR 191 Ca 0.00 0.08 0.04 0.00 3.14 0.00 0.00 58.73 61.98 2jfq h TYR 191 Cb 0.80 0.58 -0.04 0.00 1.54 0.00 0.00 36.73 39.61 2jfq h TYR 191 CO 0.28 -0.24 -0.09 -0.22 -1.64 0.00 0.00 178.16 176.25 2jfq h LYS 192 N -0.03 -0.09 -0.96 1.82 3.64 -1.86 0.25 116.57 119.35 2jfq h LYS 192 Ca 0.09 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.54 2jfq h LYS 192 Cb 0.26 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.04 2jfq h LYS 192 CO -0.56 -0.06 0.61 -1.35 -2.27 0.00 0.00 179.45 175.83 2jfq h PRO 193 N -0.09 1.09 -0.24 1.90 0.11 -1.82 0.29 132.00 133.24 2jfq h PRO 193 Ca 0.09 -0.07 -0.19 0.00 0.11 0.00 0.00 66.00 65.95 2jfq h PRO 193 Cb 0.22 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.08 2jfq h PRO 193 CO -0.20 0.72 -0.59 0.82 -0.21 0.00 0.00 178.00 178.54 2jfq h ILE 194 N 1.12 1.29 0.06 4.15 2.04 -0.93 -0.92 117.51 124.32 2jfq h ILE 194 Ca 0.41 -1.79 -0.00 0.00 1.00 0.00 0.00 64.86 64.48 2jfq h ILE 194 Cb 0.16 1.72 0.00 0.00 -0.74 0.00 0.00 36.82 37.96 2jfq h ILE 194 CO -0.17 0.58 -0.03 0.22 0.00 0.00 0.00 178.15 178.75 2jfq h TYR 195 N 0.59 -0.07 -0.25 1.37 3.20 -0.39 -2.79 116.97 118.62 2jfq h TYR 195 Ca 0.00 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.80 2jfq h TYR 195 Cb 1.18 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 39.46 2jfq h TYR 195 CO 0.07 0.04 -0.15 -0.44 -1.64 0.00 0.00 178.16 176.04 2jfq h ASP 196 N -0.17 0.41 -0.88 -2.11 3.32 -0.97 -2.08 116.42 113.94 2jfq h ASP 196 Ca -0.01 -0.11 0.08 0.00 0.02 0.00 0.00 57.03 57.01 2jfq h ASP 196 Cb 0.15 -0.11 -0.07 0.00 0.22 0.00 0.00 39.33 39.52 2jfq h ASP 196 CO 0.01 0.59 0.54 0.22 -1.72 0.00 0.00 179.24 178.88 2jfq h TYR 197 N 0.39 0.99 -0.15 4.55 3.20 -0.90 0.27 116.97 125.32 2jfq h TYR 197 Ca 0.07 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.97 2jfq h TYR 197 Cb 0.49 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.45 2jfq h TYR 197 CO 0.01 0.46 0.00 1.19 -1.64 0.00 0.00 178.16 178.19 2jfq n PHE 198 N -4.64 0.32 -1.22 -3.82 3.01 -1.09 -4.86 117.46 105.16 2jfq n PHE 198 Ca 0.14 -0.13 -0.07 0.00 1.01 0.00 0.00 57.45 58.39 2jfq n PHE 198 Cb 0.23 -0.08 -0.03 0.00 -0.01 0.00 0.00 39.48 39.59 2jfq n PHE 198 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jfq n GLY 199 N 0.52 0.90 2.44 1.37 0.00 0.08 -2.56 105.19 107.95 2jfq n GLY 199 Ca 0.06 -0.31 -0.07 0.00 0.00 0.00 0.00 46.02 45.70 2jfq n GLY 199 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jfq n GLY 200 N -1.28 0.81 0.76 -0.02 0.00 -0.80 -4.86 105.19 99.80 2jfq n GLY 200 Ca -0.07 -0.27 0.11 0.00 0.00 0.00 0.00 46.02 45.79 2jfq n GLY 200 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2jfq n LYS 201 N -1.80 2.00 -4.81 1.61 2.85 -1.06 -4.86 118.16 112.09 2jfq n LYS 201 Ca -0.07 -1.50 -0.25 0.00 -1.05 0.00 0.00 58.31 55.44 2jfq n LYS 201 Cb 0.34 -1.44 -0.15 0.00 -0.65 0.00 0.00 35.03 33.12 2jfq n LYS 201 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2jfq s LYS 202 N -1.74 1.42 -0.04 -1.58 1.02 -1.26 -4.78 119.74 112.78 2jfq s LYS 202 Ca 0.34 -0.60 -0.28 0.00 0.02 0.00 0.00 55.97 55.45 2jfq s LYS 202 Cb 0.19 -1.35 -0.03 0.00 -0.52 0.00 0.00 37.83 36.12 2jfq s LYS 202 CO 0.29 0.35 0.90 0.99 -0.92 0.00 0.00 175.35 176.95 2jfq s THR 203 N -0.34 4.91 -0.22 2.17 2.01 0.22 -4.88 115.64 119.50 2jfq s THR 203 Ca 0.05 1.87 -0.09 0.00 0.31 0.00 0.00 61.69 63.83 2jfq s THR 203 Cb -0.07 -4.23 -0.04 0.00 0.01 0.00 0.00 72.50 68.17 2jfq s THR 203 CO -0.00 0.17 0.10 -0.69 -0.69 0.00 0.00 174.62 173.51 2jfq s VAL 204 N 1.09 4.87 -0.19 3.82 1.01 -1.26 -0.20 120.40 129.53 2jfq s VAL 204 Ca 0.47 0.01 -0.05 0.00 0.00 0.00 0.00 61.98 62.40 2jfq s VAL 204 Cb -0.20 -3.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.91 2jfq s VAL 204 CO 0.24 0.38 0.01 -0.63 0.00 0.00 0.00 175.10 175.09 2jfq s ILE 205 N 1.02 4.08 -0.08 2.22 1.01 0.24 -4.98 121.20 124.72 2jfq s ILE 205 Ca 0.05 -0.27 -0.14 0.00 0.00 0.00 0.00 60.65 60.29 2jfq s ILE 205 Cb -0.14 -2.84 -0.05 0.00 0.01 0.00 0.00 42.46 39.44 2jfq s ILE 205 CO 0.04 0.44 0.36 -0.44 0.00 0.00 0.00 174.94 175.33 2jfq s SER 206 N 0.82 6.63 0.11 3.58 0.01 -1.26 -0.47 113.70 123.12 2jfq s SER 206 Ca 0.01 0.74 -0.16 0.00 1.31 0.00 0.00 55.95 57.85 2jfq s SER 206 Cb -0.14 -2.22 -0.04 0.00 0.21 0.00 0.00 66.02 63.83 2jfq s SER 206 CO 0.02 0.21 1.57 0.28 0.41 0.00 0.00 173.24 175.73 2jfq h SER 207 N 5.69 0.57 -0.32 2.44 0.02 -1.88 -2.87 113.55 117.20 2jfq h SER 207 Ca -0.47 -0.29 0.02 0.00 -0.84 0.00 0.00 61.79 60.21 2jfq h SER 207 Cb 1.20 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.56 2jfq h SER 207 CO 0.68 0.72 0.18 1.23 -1.14 0.00 0.00 176.83 178.49 2jfq h GLY 208 N 0.41 0.43 0.86 -3.77 0.00 -1.90 -0.29 103.07 98.81 2jfq h GLY 208 Ca 0.10 -0.13 0.01 0.00 0.00 0.00 0.00 47.33 47.31 2jfq h GLY 208 CO 0.01 0.11 -0.05 -2.00 0.00 0.00 0.00 176.54 174.61 2jfq h LEU 209 N 0.36 -0.16 -0.59 3.11 5.85 -1.84 -2.32 115.31 119.73 2jfq h LEU 209 Ca 0.13 0.02 -0.14 0.00 0.84 0.00 0.00 57.88 58.73 2jfq h LEU 209 Cb 0.02 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2jfq h LEU 209 CO -0.07 -0.08 -0.39 -0.33 -0.34 0.00 0.00 178.44 177.23 2jfq h GLU 210 N -0.10 0.69 -0.46 1.25 4.39 -1.40 -2.98 114.58 115.97 2jfq h GLU 210 Ca 0.02 -0.35 -0.11 0.00 0.34 0.00 0.00 59.36 59.26 2jfq h GLU 210 Cb 0.13 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 2jfq h GLU 210 CO -0.05 0.96 -0.14 1.15 -1.16 0.00 0.00 179.01 179.77 2jfq h THR 211 N 0.57 1.26 -0.69 1.13 2.02 -1.01 -0.93 112.91 115.27 2jfq h THR 211 Ca 0.05 -1.25 -0.05 0.00 0.77 0.00 0.00 66.41 65.93 2jfq h THR 211 Cb 0.92 1.06 -0.03 0.00 -1.74 0.00 0.00 68.15 68.37 2jfq h THR 211 CO 0.08 0.43 0.22 0.00 0.37 0.00 0.00 175.52 176.63 2jfq h ALA 212 N 1.07 0.90 -0.66 6.16 0.00 -1.40 0.31 119.26 125.64 2jfq h ALA 212 Ca 0.12 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2jfq h ALA 212 Cb 0.66 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2jfq h ALA 212 CO 0.05 0.57 0.26 -0.09 0.00 0.00 0.00 179.25 180.03 2jfq h ARG 213 N 1.00 0.98 0.00 0.00 2.43 -1.34 -0.57 114.38 116.89 2jfq h ARG 213 Ca 0.22 -0.18 -0.11 0.00 -0.81 0.00 0.00 59.98 59.10 2jfq h ARG 213 Cb 0.29 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.66 2jfq h ARG 213 CO -0.01 0.83 -0.52 1.49 -1.51 0.00 0.00 179.97 180.25 2jfq h GLU 214 N 0.93 0.00 -0.50 0.20 4.81 -0.61 -1.30 114.58 118.11 2jfq h GLU 214 Ca 0.22 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.36 2jfq h GLU 214 Cb 0.21 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 2jfq h GLU 214 CO -0.02 0.52 -0.03 0.28 -0.73 0.00 0.00 179.01 179.04 2jfq h VAL 215 N 0.00 1.27 -0.58 0.32 2.07 0.20 0.60 116.25 120.13 2jfq h VAL 215 Ca -0.01 -1.12 0.01 0.00 0.82 0.00 0.00 66.70 66.40 2jfq h VAL 215 Cb 0.94 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 2jfq h VAL 215 CO 0.07 0.39 0.39 -1.28 0.02 0.00 0.00 177.57 177.16 2jfq h SER 216 N 0.76 0.67 -0.68 0.57 0.87 -0.77 0.43 113.55 115.40 2jfq h SER 216 Ca 0.14 -0.02 -0.05 0.00 -1.23 0.00 0.00 61.79 60.63 2jfq h SER 216 Cb 0.56 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.32 2jfq h SER 216 CO 0.03 0.49 0.25 0.00 -0.53 0.00 0.00 176.83 177.07 2jfq h ALA 217 N 1.21 1.13 -0.72 6.23 0.00 -0.91 -2.05 119.26 124.15 2jfq h ALA 217 Ca 0.21 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 2jfq h ALA 217 Cb -0.09 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.39 2jfq h ALA 217 CO -0.05 0.61 0.18 1.25 0.00 0.00 0.00 179.25 181.24 2jfq h LEU 218 N 1.02 1.09 -1.11 0.00 5.85 0.04 -0.15 115.31 122.04 2jfq h LEU 218 Ca 0.23 -0.23 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 2jfq h LEU 218 Cb 0.23 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 2jfq h LEU 218 CO -0.02 1.04 0.12 -0.07 -0.34 0.00 0.00 178.44 179.17 2jfq h LEU 219 N 1.09 0.69 0.05 2.25 3.38 -0.59 -1.80 115.31 120.39 2jfq h LEU 219 Ca 0.23 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2jfq h LEU 219 Cb 0.37 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2jfq h LEU 219 CO 0.00 0.69 -0.03 0.74 0.09 0.00 0.00 178.44 179.94 2jfq h THR 220 N 0.72 1.20 -0.88 0.22 2.02 -0.86 0.18 112.91 115.52 2jfq h THR 220 Ca 0.16 -0.86 0.15 0.00 0.77 0.00 0.00 66.41 66.63 2jfq h THR 220 Cb 0.27 1.76 -0.07 0.00 -1.74 0.00 0.00 68.15 68.38 2jfq h THR 220 CO -0.00 0.22 0.57 -0.26 0.37 0.00 0.00 175.52 176.41 2jfq h PHE 221 N -0.45 0.77 -0.44 3.16 0.05 -0.83 -1.64 116.94 117.56 2jfq h PHE 221 Ca -0.01 0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.81 2jfq h PHE 221 Cb 0.41 -0.24 0.00 0.00 2.00 0.00 0.00 35.95 38.11 2jfq h PHE 221 CO 0.05 0.27 0.00 -1.13 -0.18 0.00 0.00 178.31 177.33 2jfq n SER 222 N -4.56 3.36 -3.81 2.17 3.41 -0.69 -4.98 113.62 108.52 2jfq n SER 222 Ca 0.18 -1.95 -0.25 0.00 -0.26 0.00 0.00 58.87 56.59 2jfq n SER 222 Cb 0.50 -0.29 0.02 0.00 -0.26 0.00 0.00 64.21 64.19 2jfq n SER 222 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2jfq n ASN 223 N 1.27 -2.14 -0.26 4.04 3.02 -0.03 -4.91 115.26 116.24 2jfq n ASN 223 Ca 0.18 -0.84 0.09 0.00 -0.03 0.00 0.00 54.58 53.98 2jfq n ASN 223 Cb 0.55 -3.85 0.16 0.00 -0.61 0.00 0.00 39.78 36.03 2jfq n ASN 223 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2jfq n GLU 224 N -4.41 1.48 -2.04 3.52 1.02 0.44 -4.55 120.64 116.09 2jfq n GLU 224 Ca -0.20 -2.75 -0.41 0.00 -0.02 0.00 0.00 57.16 53.78 2jfq n GLU 224 Cb 0.63 -1.56 -0.02 0.00 -0.02 0.00 0.00 31.44 30.47 2jfq n GLU 224 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2jfq s HIS 225 N -2.95 3.05 0.85 -0.32 3.76 -1.25 -2.59 115.29 115.84 2jfq s HIS 225 Ca 0.34 1.08 -0.11 0.00 -0.15 0.00 0.00 55.06 56.22 2jfq s HIS 225 Cb 0.30 -3.78 0.10 0.00 1.11 0.00 0.00 32.58 30.31 2jfq s HIS 225 CO 0.02 -2.51 1.10 0.00 -0.85 0.00 0.00 174.74 172.49 2jfq s ALA 226 N -0.08 1.80 0.85 -1.40 0.00 -1.26 -3.87 121.76 117.80 2jfq s ALA 226 Ca 0.58 0.17 -0.12 0.00 0.00 0.00 0.00 51.96 52.59 2jfq s ALA 226 Cb -0.41 -3.26 0.10 0.00 0.00 0.00 0.00 23.12 19.55 2jfq s ALA 226 CO 0.43 -2.18 1.14 -1.12 0.00 0.00 0.00 175.76 174.03 2jfq s SER 227 N -3.29 4.11 0.08 0.00 0.01 -1.26 -4.92 113.70 108.42 2jfq s SER 227 Ca 0.63 0.99 -0.35 0.00 1.31 0.00 0.00 55.95 58.53 2jfq s SER 227 Cb -0.18 -1.59 -0.14 0.00 0.21 0.00 0.00 66.02 64.31 2jfq s SER 227 CO 0.57 -2.18 1.56 0.00 0.41 0.00 0.00 173.24 173.61 2jfq n TYR 228 N -3.52 2.05 -3.59 2.43 9.36 -1.26 -4.87 117.16 117.76 2jfq n TYR 228 Ca 0.07 0.35 -0.28 0.00 3.32 0.00 0.00 57.90 61.36 2jfq n TYR 228 Cb 0.59 -2.50 -0.16 0.00 -0.63 0.00 0.00 39.34 36.65 2jfq n TYR 228 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 2jfq s THR 229 N 1.41 0.06 0.12 2.97 2.01 -1.26 -5.03 115.64 115.92 2jfq s THR 229 Ca 0.84 -0.69 -0.19 0.00 0.31 0.00 0.00 61.69 61.96 2jfq s THR 229 Cb -0.78 -0.97 -0.06 0.00 0.01 0.00 0.00 72.50 70.70 2jfq s THR 229 CO 0.44 -0.60 1.77 -0.08 -0.69 0.00 0.00 174.62 175.46 2jfq h GLU 230 N 8.37 0.24 -2.84 4.92 4.81 -1.92 -3.37 114.58 124.79 2jfq h GLU 230 Ca -0.18 -0.01 -0.61 0.00 -0.13 0.00 0.00 59.36 58.43 2jfq h GLU 230 Cb 1.05 -0.06 -0.40 0.00 0.63 0.00 0.00 28.75 29.97 2jfq h GLU 230 CO 0.41 0.16 -0.75 -1.01 -0.73 0.00 0.00 179.01 177.09 2jfq s HIS 231 N -6.18 2.30 0.28 0.92 3.76 -1.26 -5.06 115.29 110.05 2jfq s HIS 231 Ca -0.13 -2.73 -0.30 0.00 -0.15 0.00 0.00 55.06 51.74 2jfq s HIS 231 Cb 0.09 -1.90 -0.12 0.00 1.11 0.00 0.00 32.58 31.76 2jfq s HIS 231 CO 0.69 -0.71 1.53 -2.30 -0.85 0.00 0.00 174.74 173.11 2jfq n PRO 232 N 2.76 2.48 -2.66 8.40 -0.02 -1.26 -4.89 135.00 139.82 2jfq n PRO 232 Ca 0.19 0.88 -0.43 0.00 -2.02 0.00 0.00 63.50 62.12 2jfq n PRO 232 Cb 0.39 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.24 2jfq n PRO 232 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2jfq n ASP 233 N 2.17 5.12 -4.74 2.55 10.43 -1.26 -4.98 116.55 125.85 2jfq n ASP 233 Ca 0.10 -3.02 -0.35 0.00 2.57 0.00 0.00 54.79 54.09 2jfq n ASP 233 Cb 0.35 -1.54 0.07 0.00 1.84 0.00 0.00 41.12 41.84 2jfq n ASP 233 CO 0.00 0.00 0.00 -1.00 -1.07 0.00 0.00 177.20 175.13 2jfq s HIS 234 N 1.26 2.21 0.01 1.24 3.76 -1.26 -4.81 115.29 117.69 2jfq s HIS 234 Ca 0.42 1.57 0.02 0.00 -0.15 0.00 0.00 55.06 56.92 2jfq s HIS 234 Cb 0.03 -3.44 -0.01 0.00 1.11 0.00 0.00 32.58 30.27 2jfq s HIS 234 CO 0.00 -2.40 -0.06 1.03 -0.85 0.00 0.00 174.74 172.46 2jfq s ARG 235 N -3.79 0.47 -0.03 1.40 0.52 -0.35 -4.99 118.95 112.18 2jfq s ARG 235 Ca 0.74 -0.34 0.05 0.00 -0.52 0.00 0.00 55.73 55.66 2jfq s ARG 235 Cb -0.28 -0.40 -0.01 0.00 0.52 0.00 0.00 34.95 34.77 2jfq s ARG 235 CO 0.42 0.10 -0.19 -0.06 0.02 0.00 0.00 175.30 175.59 2jfq s PHE 236 N -0.45 1.83 0.11 -0.53 0.40 -1.26 -1.10 117.98 116.98 2jfq s PHE 236 Ca -0.01 -0.47 0.06 0.00 -0.60 0.00 0.00 56.93 55.92 2jfq s PHE 236 Cb -0.04 -1.21 -0.04 0.00 0.51 0.00 0.00 43.02 42.24 2jfq s PHE 236 CO -0.00 -0.12 -0.14 -0.06 0.70 0.00 0.00 175.22 175.59 2jfq s PHE 237 N -0.17 1.40 -0.18 0.36 0.40 0.90 -0.58 117.98 120.11 2jfq s PHE 237 Ca 0.00 -0.53 -0.18 0.00 -0.60 0.00 0.00 56.93 55.62 2jfq s PHE 237 Cb -0.10 -0.74 0.05 0.00 0.51 0.00 0.00 43.02 42.73 2jfq s PHE 237 CO 0.01 0.14 0.50 0.00 0.70 0.00 0.00 175.22 176.57 2jfq s ALA 238 N -1.97 -1.24 -0.79 5.36 0.00 -0.63 -1.53 121.76 120.96 2jfq s ALA 238 Ca 0.07 1.36 -0.05 0.00 0.00 0.00 0.00 51.96 53.34 2jfq s ALA 238 Cb -0.06 -0.76 0.02 0.00 0.00 0.00 0.00 23.12 22.32 2jfq s ALA 238 CO 0.03 -0.24 2.80 0.25 0.00 0.00 0.00 175.76 178.59 2jfq n THR 239 N 2.67 4.02 -3.40 0.00 -2.24 -1.05 -0.57 114.28 113.72 2jfq n THR 239 Ca -0.14 -3.17 0.00 0.00 -2.27 0.00 0.00 64.05 58.47 2jfq n THR 239 Cb 0.56 -1.92 0.00 0.00 -2.10 0.00 0.00 70.33 66.88 2jfq n THR 239 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jfq n GLY 240 N 1.68 -1.43 3.67 3.38 0.00 -1.26 -1.93 105.19 109.30 2jfq n GLY 240 Ca 0.56 -1.11 -0.49 0.00 0.00 0.00 0.00 46.02 44.97 2jfq n GLY 240 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jfq n ASP 241 N 2.11 3.05 -0.28 1.61 -0.08 -1.26 -4.79 116.55 116.91 2jfq n ASP 241 Ca 0.00 1.03 0.10 0.00 -1.51 0.00 0.00 54.79 54.41 2jfq n ASP 241 Cb 0.00 -1.35 0.45 0.00 2.34 0.00 0.00 41.12 42.56 2jfq n ASP 241 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 2jfq n THR 242 N 4.26 0.11 0.34 5.18 -2.24 -1.26 -4.44 114.28 116.23 2jfq n THR 242 Ca 0.21 -0.18 -0.18 0.00 -2.27 0.00 0.00 64.05 61.63 2jfq n THR 242 Cb 0.27 0.05 -0.09 0.00 -2.10 0.00 0.00 70.33 68.45 2jfq n THR 242 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2jfq h THR 243 N 1.12 0.08 0.14 4.28 2.02 -1.98 -1.25 112.91 117.31 2jfq h THR 243 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2jfq h THR 243 Cb 0.25 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.73 2jfq h THR 243 CO 0.00 0.00 -0.07 -0.74 0.37 0.00 0.00 175.52 175.08 2jfq h HIS 244 N -1.03 -0.18 -0.49 3.16 6.17 -2.00 -2.35 115.15 118.42 2jfq h HIS 244 Ca -0.07 -0.00 -0.03 0.00 0.71 0.00 0.00 60.37 60.98 2jfq h HIS 244 Cb 0.87 0.06 -0.02 0.00 2.52 0.00 0.00 27.41 30.83 2jfq h HIS 244 CO -0.18 -0.11 0.20 0.97 0.71 0.00 0.00 177.93 179.52 2jfq h ILE 245 N -0.19 1.18 -0.54 6.26 2.10 -1.83 -0.80 117.51 123.69 2jfq h ILE 245 Ca -0.02 -0.56 -0.04 0.00 1.08 0.00 0.00 64.86 65.32 2jfq h ILE 245 Cb 0.15 0.59 -0.02 0.00 -1.09 0.00 0.00 36.82 36.45 2jfq h ILE 245 CO 0.03 0.22 0.19 0.74 -1.08 0.00 0.00 178.15 178.24 2jfq h THR 246 N 0.70 1.23 -0.31 2.19 2.02 -1.06 -0.87 112.91 116.80 2jfq h THR 246 Ca 0.17 -0.75 -0.11 0.00 0.77 0.00 0.00 66.41 66.49 2jfq h THR 246 Cb 0.13 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 2jfq h THR 246 CO -0.02 0.28 -0.25 0.78 0.37 0.00 0.00 175.52 176.69 2jfq h ASN 247 N 0.75 0.62 -0.46 4.18 2.35 -0.93 -2.29 115.58 119.79 2jfq h ASN 247 Ca 0.18 -0.22 -0.07 0.00 -0.55 0.00 0.00 56.30 55.64 2jfq h ASN 247 Cb 0.25 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 2jfq h ASN 247 CO -0.01 0.86 0.02 0.40 -1.65 0.00 0.00 177.43 177.05 2jfq h ILE 248 N 0.54 1.26 -0.94 2.81 1.08 -0.85 -0.11 117.51 121.31 2jfq h ILE 248 Ca 0.08 -1.01 0.05 0.00 -0.39 0.00 0.00 64.86 63.58 2jfq h ILE 248 Cb 0.71 1.00 -0.06 0.00 -3.07 0.00 0.00 36.82 35.40 2jfq h ILE 248 CO 0.05 0.35 0.61 0.40 -0.69 0.00 0.00 178.15 178.87 2jfq h ILE 249 N 0.66 1.13 -0.25 -0.67 2.04 -0.94 0.43 117.51 119.91 2jfq h ILE 249 Ca 0.13 -0.39 -0.06 0.00 1.00 0.00 0.00 64.86 65.54 2jfq h ILE 249 Cb 0.47 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.42 2jfq h ILE 249 CO 0.02 0.21 -0.07 0.11 0.00 0.00 0.00 178.15 178.42 2jfq h LYS 250 N 1.15 0.49 -0.12 2.37 1.57 -1.08 -0.21 116.57 120.73 2jfq h LYS 250 Ca 0.39 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.97 2jfq h LYS 250 Cb 0.06 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 2jfq h LYS 250 CO -0.14 0.71 0.04 1.49 -0.57 0.00 0.00 179.45 180.98 2jfq h GLU 251 N 0.23 0.19 0.13 3.15 4.57 -0.34 -1.22 114.58 121.29 2jfq h GLU 251 Ca 0.06 -0.04 -0.33 0.00 -1.18 0.00 0.00 59.36 57.87 2jfq h GLU 251 Cb 0.54 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.10 2jfq h GLU 251 CO 0.03 0.32 -1.72 -1.49 -1.18 0.00 0.00 179.01 174.97 2jfq h TRP 252 N 0.01 0.51 -0.01 0.92 6.55 -0.22 -3.38 115.95 120.33 2jfq h TRP 252 Ca 0.04 -0.37 0.00 0.00 0.95 0.00 0.00 58.89 59.50 2jfq h TRP 252 Cb 0.21 -0.02 0.00 0.00 -0.86 0.00 0.00 29.16 28.49 2jfq h TRP 252 CO -0.00 1.67 -0.65 1.28 -1.05 0.00 0.00 178.44 179.69 2jfq n LEU 253 N -3.70 1.52 -3.63 -4.49 4.77 -0.14 -4.98 117.00 106.36 2jfq n LEU 253 Ca -0.28 -0.60 -0.20 0.00 -0.03 0.00 0.00 56.01 54.90 2jfq n LEU 253 Cb 0.99 -0.02 0.05 0.00 -2.33 0.00 0.00 43.42 42.11 2jfq n LEU 253 CO 0.43 0.31 -0.00 -3.20 -1.33 0.00 0.00 177.39 173.60 2jfq n ASN 254 N -0.66 -1.68 -3.95 -1.43 5.15 -0.46 -4.98 115.26 107.26 2jfq n ASN 254 Ca 0.07 -0.75 -0.17 0.00 -0.60 0.00 0.00 54.58 53.13 2jfq n ASN 254 Cb 0.41 -4.38 -0.15 0.00 -0.53 0.00 0.00 39.78 35.13 2jfq n ASN 254 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2jfq s LEU 255 N -6.63 1.85 -0.42 1.20 1.43 -1.19 -4.99 118.68 109.93 2jfq s LEU 255 Ca 0.04 -0.11 -0.12 0.00 -1.03 0.00 0.00 54.13 52.92 2jfq s LEU 255 Cb -0.02 -0.33 0.06 0.00 0.03 0.00 0.00 46.19 45.93 2jfq s LEU 255 CO 0.79 0.04 0.28 -0.44 0.23 0.00 0.00 176.35 177.25 2jfq s SER 256 N 0.10 5.85 0.35 2.29 0.01 -1.26 -3.08 113.70 117.96 2jfq s SER 256 Ca -0.01 -1.24 0.04 0.00 1.31 0.00 0.00 55.95 56.05 2jfq s SER 256 Cb -0.05 -2.07 -0.06 0.00 0.21 0.00 0.00 66.02 64.05 2jfq s SER 256 CO -0.00 -0.51 0.05 0.68 0.41 0.00 0.00 173.24 173.86 2jfq s VAL 257 N 1.55 1.36 -0.53 3.43 -7.23 -1.26 -5.10 120.40 112.61 2jfq s VAL 257 Ca 0.03 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.09 2jfq s VAL 257 Cb -0.22 -2.81 0.13 0.00 0.56 0.00 0.00 36.38 34.04 2jfq s VAL 257 CO 0.05 0.00 0.42 0.20 -0.31 0.00 0.00 175.10 175.47 2jfq s ASN 258 N -3.55 5.88 -0.12 4.85 0.01 -1.26 -5.02 114.94 115.73 2jfq s ASN 258 Ca 0.35 -2.02 -0.30 0.00 -0.71 0.00 0.00 52.86 50.19 2jfq s ASN 258 Cb 0.09 -2.06 -0.02 0.00 0.41 0.00 0.00 41.25 39.66 2jfq s ASN 258 CO 0.16 -0.70 1.17 -0.69 -1.51 0.00 0.00 177.10 175.53 2jfq s VAL 259 N 1.22 4.39 -0.20 1.60 1.01 -1.26 -4.61 120.40 122.55 2jfq s VAL 259 Ca 0.07 1.69 -0.24 0.00 0.00 0.00 0.00 61.98 63.50 2jfq s VAL 259 Cb -0.25 -4.09 -0.01 0.00 0.00 0.00 0.00 36.38 32.02 2jfq s VAL 259 CO -0.01 -0.07 0.79 -1.61 0.00 0.00 0.00 175.10 174.21 2jfq s GLU 260 N 2.72 4.24 0.02 2.72 2.02 0.25 -4.92 118.70 125.75 2jfq s GLU 260 Ca 0.53 0.92 -0.30 0.00 0.02 0.00 0.00 54.97 56.13 2jfq s GLU 260 Cb -0.22 -3.60 -0.04 0.00 0.10 0.00 0.00 34.13 30.38 2jfq s GLU 260 CO 0.17 -0.37 1.06 0.50 0.02 0.00 0.00 175.26 176.63 2jfq s ARG 261 N 2.33 4.51 0.28 1.61 3.52 -1.26 -1.60 118.95 128.34 2jfq s ARG 261 Ca 0.35 1.54 0.05 0.00 -0.13 0.00 0.00 55.73 57.54 2jfq s ARG 261 Cb -0.16 -3.42 -0.02 0.00 -1.56 0.00 0.00 34.95 29.79 2jfq s ARG 261 CO 0.10 -0.13 0.17 0.44 -0.81 0.00 0.00 175.30 175.07 2jfq n ILE 262 N 3.93 0.00 -3.90 4.11 -5.35 0.27 -4.90 119.36 113.52 2jfq n ILE 262 Ca 0.07 -1.83 -0.11 0.00 -0.27 0.00 0.00 62.75 60.62 2jfq n ILE 262 Cb 0.49 0.80 -0.12 0.00 -1.74 0.00 0.00 39.64 39.07 2jfq n ILE 262 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 2jfq s SER 263 N -2.83 0.05 -0.66 7.28 0.01 -1.26 -4.18 113.70 112.11 2jfq s SER 263 Ca 0.24 -0.13 -0.02 0.00 1.31 0.00 0.00 55.95 57.34 2jfq s SER 263 Cb 0.01 0.12 0.40 0.00 0.21 0.00 0.00 66.02 66.77 2jfq s SER 263 CO 0.17 -0.16 2.05 1.33 0.41 0.00 0.00 173.24 177.04 2jfq n VAL 264 N 2.35 3.55 0.00 3.43 0.24 -1.26 -4.89 118.33 121.75 2jfq n VAL 264 Ca -0.18 -3.04 0.00 0.00 -2.04 0.00 0.00 64.34 59.09 2jfq n VAL 264 Cb 0.58 -1.20 0.00 0.00 -1.47 0.00 0.00 33.84 31.75 2jfq n VAL 264 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2jfq n ASN 265 N -0.71 0.00 0.00 -1.34 4.05 -1.26 -5.04 115.26 110.97 2jfq n ASN 265 Ca 0.58 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.61 2jfq n ASN 265 Cb 0.58 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.59 2jfq n ASN 265 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 177.26 173.54