#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jfn s ARG 21 N 0.00 1.18 0.27 -0.52 3.00 -0.57 -4.77 118.95 117.54 2jfn s ARG 21 Ca 0.00 -1.52 -0.30 0.00 0.00 0.00 0.00 55.73 53.91 2jfn s ARG 21 Cb 0.00 -0.79 -0.13 0.00 0.00 0.00 0.00 34.95 34.04 2jfn s ARG 21 CO 0.00 0.09 1.42 -0.35 0.00 0.00 0.00 175.30 176.46 2jfn n PRO 22 N -0.28 2.20 -2.98 3.54 -0.04 -1.26 -1.22 135.00 134.96 2jfn n PRO 22 Ca -0.09 0.78 -0.41 0.00 -0.04 0.00 0.00 63.50 63.74 2jfn n PRO 22 Cb 0.61 -2.45 -0.05 0.00 -0.04 0.00 0.00 33.50 31.57 2jfn n PRO 22 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2jfn s THR 23 N -0.29 4.91 -0.12 0.52 2.01 -0.08 -1.60 115.64 120.99 2jfn s THR 23 Ca 0.64 1.42 0.03 0.00 0.31 0.00 0.00 61.69 64.09 2jfn s THR 23 Cb -0.60 -4.05 0.01 0.00 0.01 0.00 0.00 72.50 67.87 2jfn s THR 23 CO 0.52 -0.00 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.54 2jfn s VAL 24 N 2.50 2.00 -0.16 3.82 1.01 -0.26 -0.57 120.40 128.74 2jfn s VAL 24 Ca 0.32 -0.96 -0.11 0.00 0.00 0.00 0.00 61.98 61.24 2jfn s VAL 24 Cb -0.16 -1.75 -0.05 0.00 0.00 0.00 0.00 36.38 34.42 2jfn s VAL 24 CO 0.09 0.54 0.20 -0.22 0.00 0.00 0.00 175.10 175.71 2jfn s LEU 25 N 0.61 4.28 -0.19 3.92 2.96 -0.37 -1.12 118.68 128.78 2jfn s LEU 25 Ca -0.12 0.42 0.01 0.00 -0.22 0.00 0.00 54.13 54.21 2jfn s LEU 25 Cb -0.17 -2.20 0.03 0.00 0.50 0.00 0.00 46.19 44.35 2jfn s LEU 25 CO 0.03 0.23 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.42 2jfn s VAL 26 N -0.06 2.00 0.05 1.68 1.01 -0.19 0.00 120.40 124.88 2jfn s VAL 26 Ca 0.13 -1.00 0.07 0.00 0.00 0.00 0.00 61.98 61.19 2jfn s VAL 26 Cb -0.12 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 2jfn s VAL 26 CO 0.02 0.44 -0.19 0.12 0.00 0.00 0.00 175.10 175.49 2jfn s PHE 27 N 1.29 2.54 0.22 5.22 5.36 0.19 -1.80 117.98 131.01 2jfn s PHE 27 Ca 0.03 -0.27 -0.21 0.00 -0.96 0.00 0.00 56.93 55.52 2jfn s PHE 27 Cb -0.14 -1.45 0.04 0.00 -0.34 0.00 0.00 43.02 41.13 2jfn s PHE 27 CO -0.11 0.25 0.64 0.34 -1.46 0.00 0.00 175.22 174.88 2jfn s ASP 28 N -1.48 -0.36 0.31 6.13 3.68 -0.97 -0.74 116.67 123.24 2jfn s ASP 28 Ca 0.15 -0.39 0.15 0.00 2.13 0.00 0.00 52.55 54.59 2jfn s ASP 28 Cb -0.10 0.66 0.46 0.00 -1.45 0.00 0.00 42.92 42.48 2jfn s ASP 28 CO 0.05 -1.16 1.64 0.77 0.13 0.00 0.00 175.17 176.60 2jfn h SER 29 N 2.04 0.00 0.00 -0.34 4.64 -1.88 -2.58 113.55 115.43 2jfn h SER 29 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 2jfn h SER 29 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2jfn h SER 29 CO 0.31 0.51 0.00 0.61 -0.87 0.00 0.00 176.83 177.39 2jfn n GLY 30 N 0.39 4.36 0.07 -0.77 0.00 -1.26 -2.84 105.19 105.14 2jfn n GLY 30 Ca -0.00 -0.47 0.12 0.00 0.00 0.00 0.00 46.02 45.67 2jfn n GLY 30 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2jfn n VAL 31 N 0.00 0.39 -0.22 1.61 0.24 -1.26 -4.19 118.33 114.90 2jfn n VAL 31 Ca 0.00 -0.27 0.16 0.00 -2.04 0.00 0.00 64.34 62.19 2jfn n VAL 31 Cb 0.00 -0.19 0.49 0.00 -1.47 0.00 0.00 33.84 32.67 2jfn n VAL 31 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2jfn h GLY 32 N 4.52 0.87 1.07 7.63 0.00 -1.90 -0.27 103.07 114.99 2jfn h GLY 32 Ca 0.00 -0.20 0.13 0.00 0.00 0.00 0.00 47.33 47.25 2jfn h GLY 32 CO 0.00 0.04 0.34 -1.33 0.00 0.00 0.00 176.54 175.59 2jfn h GLY 33 N 0.46 0.00 2.00 4.60 0.00 -1.73 -1.12 103.07 107.28 2jfn h GLY 33 Ca 0.43 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.74 2jfn h GLY 33 CO -0.16 0.00 -0.10 1.41 0.00 0.00 0.00 176.54 177.69 2jfn h LEU 34 N 0.00 0.00 -0.66 3.11 3.38 -1.33 -0.66 115.31 119.14 2jfn h LEU 34 Ca 0.21 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.05 2jfn h LEU 34 Cb 0.89 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 2jfn h LEU 34 CO -0.00 0.10 -0.39 0.77 0.09 0.00 0.00 178.44 179.01 2jfn h SER 35 N 0.00 0.63 -0.07 -0.43 4.64 -1.36 -0.14 113.55 116.81 2jfn h SER 35 Ca -0.00 -0.28 -0.17 0.00 -0.47 0.00 0.00 61.79 60.88 2jfn h SER 35 Cb 0.20 -0.18 0.01 0.00 -0.31 0.00 0.00 62.40 62.12 2jfn h SER 35 CO 0.01 0.95 -0.60 0.58 -0.87 0.00 0.00 176.83 176.90 2jfn h VAL 36 N 0.50 1.36 -0.78 0.95 2.07 -1.50 -3.12 116.25 115.73 2jfn h VAL 36 Ca 0.05 -1.94 0.02 0.00 0.82 0.00 0.00 66.70 65.64 2jfn h VAL 36 Cb 0.89 2.29 -0.04 0.00 -1.52 0.00 0.00 31.29 32.91 2jfn h VAL 36 CO 0.08 0.58 0.51 0.22 0.02 0.00 0.00 177.57 178.98 2jfn h TYR 37 N 0.13 0.97 -0.84 1.57 5.03 -1.06 -1.55 116.97 121.21 2jfn h TYR 37 Ca -0.05 0.02 0.10 0.00 2.58 0.00 0.00 58.73 61.38 2jfn h TYR 37 Cb 1.26 -0.32 -0.08 0.00 1.55 0.00 0.00 36.73 39.14 2jfn h TYR 37 CO 0.12 0.59 0.48 0.22 -1.32 0.00 0.00 178.16 178.25 2jfn h ASP 38 N 1.03 0.69 -0.32 -2.11 3.58 -1.00 0.17 116.42 118.46 2jfn h ASP 38 Ca 0.29 0.05 -0.12 0.00 0.42 0.00 0.00 57.03 57.67 2jfn h ASP 38 Cb -0.08 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 40.88 2jfn h ASP 38 CO -0.08 0.39 -0.28 -0.33 -2.88 0.00 0.00 179.24 176.05 2jfn h GLU 39 N 0.80 0.76 -0.22 0.28 4.39 -1.38 -2.39 114.58 116.82 2jfn h GLU 39 Ca 0.41 -0.39 -0.01 0.00 0.34 0.00 0.00 59.36 59.71 2jfn h GLU 39 Cb 0.39 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 2jfn h GLU 39 CO -0.26 1.01 0.10 0.82 -1.16 0.00 0.00 179.01 179.53 2jfn h ILE 40 N 0.52 1.14 0.00 3.13 2.04 -0.31 -2.75 117.51 121.29 2jfn h ILE 40 Ca 0.06 -0.41 -0.05 0.00 1.00 0.00 0.00 64.86 65.45 2jfn h ILE 40 Cb 0.85 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.94 2jfn h ILE 40 CO 0.07 0.14 -0.26 0.08 0.00 0.00 0.00 178.15 178.18 2jfn h ARG 41 N 0.22 0.00 -0.12 2.37 0.11 -0.73 0.39 114.38 116.63 2jfn h ARG 41 Ca 0.08 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 60.07 2jfn h ARG 41 Cb 0.13 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.19 2jfn h ARG 41 CO -0.01 0.26 -0.30 1.25 0.10 0.00 0.00 179.97 181.27 2jfn h HIS 42 N 0.00 0.25 0.10 4.08 2.76 -1.16 -0.79 115.15 120.39 2jfn h HIS 42 Ca -0.00 -0.05 -0.33 0.00 -2.20 0.00 0.00 60.37 57.78 2jfn h HIS 42 Cb 0.53 -0.06 -0.02 0.00 1.55 0.00 0.00 27.41 29.41 2jfn h HIS 42 CO 0.00 0.50 -1.80 1.25 -1.30 0.00 0.00 177.93 176.58 2jfn h LEU 43 N 0.20 0.34 -6.45 0.26 5.85 -1.05 -3.41 115.31 111.04 2jfn h LEU 43 Ca 0.03 -0.65 -0.59 0.00 0.84 0.00 0.00 57.88 57.50 2jfn h LEU 43 Cb 0.63 -0.11 -0.40 0.00 0.37 0.00 0.00 40.66 41.15 2jfn h LEU 43 CO 0.05 1.57 -0.81 0.18 -0.34 0.00 0.00 178.44 179.09 2jfn n LEU 44 N -3.39 1.52 0.23 2.25 4.77 0.13 -4.99 117.00 117.51 2jfn n LEU 44 Ca -0.24 -4.90 0.16 0.00 -0.03 0.00 0.00 56.01 51.00 2jfn n LEU 44 Cb 1.05 -0.05 0.72 0.00 -2.33 0.00 0.00 43.42 42.81 2jfn n LEU 44 CO 0.46 1.92 0.97 1.55 -1.33 0.00 0.00 177.39 180.96 2jfn h PRO 45 N 4.92 0.00 -0.33 3.23 0.13 -1.37 -3.31 132.00 135.28 2jfn h PRO 45 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2jfn h PRO 45 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 2jfn h PRO 45 CO 0.58 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.10 2jfn n ASP 46 N -2.75 3.28 -4.67 1.44 8.00 -1.26 -5.00 116.55 115.58 2jfn n ASP 46 Ca 0.00 -1.95 -0.30 0.00 0.71 0.00 0.00 54.79 53.25 2jfn n ASP 46 Cb 0.21 -0.21 0.16 0.00 -0.02 0.00 0.00 41.12 41.27 2jfn n ASP 46 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2jfn s LEU 47 N -1.45 2.09 -0.63 0.64 1.43 -1.25 -4.77 118.68 114.75 2jfn s LEU 47 Ca 0.35 1.58 -0.19 0.00 -1.03 0.00 0.00 54.13 54.84 2jfn s LEU 47 Cb 0.21 -3.91 0.11 0.00 0.03 0.00 0.00 46.19 42.63 2jfn s LEU 47 CO 0.29 -2.97 0.75 -2.28 0.23 0.00 0.00 176.35 172.37 2jfn s HIS 48 N -2.82 3.00 0.08 0.29 5.65 -0.63 -4.91 115.29 115.96 2jfn s HIS 48 Ca 0.65 -0.99 -0.17 0.00 0.25 0.00 0.00 55.06 54.80 2jfn s HIS 48 Cb -0.20 -4.05 -0.06 0.00 -1.18 0.00 0.00 32.58 27.09 2jfn s HIS 48 CO 0.58 -1.33 0.52 0.71 -0.65 0.00 0.00 174.74 174.57 2jfn s TYR 49 N 2.72 3.73 -0.12 3.88 1.51 -1.26 -1.10 117.35 126.70 2jfn s TYR 49 Ca 0.14 1.14 0.01 0.00 -1.01 0.00 0.00 57.07 57.34 2jfn s TYR 49 Cb -0.22 -2.40 0.02 0.00 -0.11 0.00 0.00 41.96 39.25 2jfn s TYR 49 CO 0.05 0.56 -0.13 0.42 -1.11 0.00 0.00 175.55 175.33 2jfn s ILE 50 N -1.21 1.42 -0.17 2.71 1.01 -0.28 -1.83 121.20 122.86 2jfn s ILE 50 Ca 0.30 -0.57 -0.04 0.00 0.00 0.00 0.00 60.65 60.35 2jfn s ILE 50 Cb -0.17 -1.33 -0.02 0.00 0.01 0.00 0.00 42.46 40.94 2jfn s ILE 50 CO 0.18 0.43 -0.04 -0.47 0.00 0.00 0.00 174.94 175.04 2jfn s TYR 51 N 1.26 3.00 -0.06 3.97 6.14 -0.29 -1.02 117.35 130.34 2jfn s TYR 51 Ca -0.01 -0.44 0.03 0.00 0.64 0.00 0.00 57.07 57.28 2jfn s TYR 51 Cb -0.14 -2.00 0.01 0.00 0.42 0.00 0.00 41.96 40.25 2jfn s TYR 51 CO -0.06 -0.16 -0.14 0.00 0.64 0.00 0.00 175.55 175.83 2jfn s ALA 52 N 0.65 1.35 -0.02 3.97 0.00 -0.74 0.81 121.76 127.77 2jfn s ALA 52 Ca -0.02 -0.49 0.03 0.00 0.00 0.00 0.00 51.96 51.48 2jfn s ALA 52 Cb -0.14 -0.56 -0.00 0.00 0.00 0.00 0.00 23.12 22.41 2jfn s ALA 52 CO 0.02 0.15 -0.12 -0.59 0.00 0.00 0.00 175.76 175.23 2jfn s PHE 53 N 0.53 1.14 -1.27 0.00 -0.12 -0.63 -2.30 117.98 115.32 2jfn s PHE 53 Ca -0.13 -0.27 -0.12 0.00 -0.05 0.00 0.00 56.93 56.36 2jfn s PHE 53 Cb -0.15 -0.78 0.15 0.00 -0.63 0.00 0.00 43.02 41.61 2jfn s PHE 53 CO 0.04 -0.08 1.73 -3.47 -0.05 0.00 0.00 175.22 173.38 2jfn n ASP 54 N 3.09 5.01 0.12 1.98 -0.08 -0.97 -3.36 116.55 122.34 2jfn n ASP 54 Ca -0.17 -3.01 0.11 0.00 -1.51 0.00 0.00 54.79 50.21 2jfn n ASP 54 Cb 0.55 -1.56 0.48 0.00 2.34 0.00 0.00 41.12 42.92 2jfn n ASP 54 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 2jfn n ASN 55 N 5.22 0.58 0.07 1.67 6.94 -1.25 -1.50 115.26 127.00 2jfn n ASN 55 Ca 0.41 0.66 -0.21 0.00 -0.02 0.00 0.00 54.58 55.42 2jfn n ASN 55 Cb 0.40 -0.78 -0.12 0.00 -2.36 0.00 0.00 39.78 36.93 2jfn n ASN 55 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 2jfn h VAL 56 N 0.00 1.29 -0.02 3.53 2.07 -1.90 -3.36 116.25 117.88 2jfn h VAL 56 Ca 0.00 -2.41 0.00 0.00 0.82 0.00 0.00 66.70 65.11 2jfn h VAL 56 Cb 0.31 2.58 0.00 0.00 -1.52 0.00 0.00 31.29 32.65 2jfn h VAL 56 CO 0.00 0.73 -0.01 0.00 0.02 0.00 0.00 177.57 178.32 2jfn n ALA 57 N -2.66 2.49 -1.78 1.67 0.00 -1.11 -4.98 120.51 114.15 2jfn n ALA 57 Ca -0.12 -0.60 -0.41 0.00 0.00 0.00 0.00 53.44 52.31 2jfn n ALA 57 Cb 0.94 -0.45 -0.01 0.00 0.00 0.00 0.00 19.45 19.93 2jfn n ALA 57 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2jfn s PHE 58 N -1.13 2.77 0.17 0.00 5.36 -0.56 -4.08 117.98 120.51 2jfn s PHE 58 Ca 0.15 1.25 -0.16 0.00 -0.96 0.00 0.00 56.93 57.21 2jfn s PHE 58 Cb 0.11 -3.89 -0.07 0.00 -0.34 0.00 0.00 43.02 38.83 2jfn s PHE 58 CO 0.17 -2.58 0.61 -1.25 -1.46 0.00 0.00 175.22 170.72 2jfn s PRO 59 N -1.91 4.08 0.25 10.12 0.04 -1.26 -5.01 135.00 141.31 2jfn s PRO 59 Ca 0.52 0.64 0.13 0.00 0.04 0.00 0.00 61.00 62.32 2jfn s PRO 59 Cb -0.44 -2.93 0.08 0.00 0.04 0.00 0.00 34.50 31.26 2jfn s PRO 59 CO 0.59 0.46 1.44 1.88 0.04 0.00 0.00 177.00 181.41 2jfn h TYR 60 N 3.55 0.00 -1.07 0.56 -1.99 -1.96 -3.35 116.97 112.71 2jfn h TYR 60 Ca -0.48 0.00 0.30 0.00 2.00 0.00 0.00 58.73 60.55 2jfn h TYR 60 Cb 1.19 0.00 -0.12 0.00 2.00 0.00 0.00 36.73 39.81 2jfn h TYR 60 CO 0.65 0.63 0.67 0.78 -0.00 0.00 0.00 178.16 180.89 2jfn h GLY 61 N 3.09 1.54 1.22 3.88 0.00 -1.93 -1.65 103.07 109.22 2jfn h GLY 61 Ca -0.01 -0.22 -0.30 0.00 0.00 0.00 0.00 47.33 46.81 2jfn h GLY 61 CO 0.08 -0.28 -1.54 1.05 0.00 0.00 0.00 176.54 175.85 2jfn h GLU 62 N 0.36 0.22 -6.75 4.80 4.11 -1.98 -3.37 114.58 111.96 2jfn h GLU 62 Ca 0.67 -0.37 -0.56 0.00 0.07 0.00 0.00 59.36 59.18 2jfn h GLU 62 Cb 1.68 0.14 0.18 0.00 0.50 0.00 0.00 28.75 31.25 2jfn h GLU 62 CO -0.42 1.06 -0.20 1.63 0.07 0.00 0.00 179.01 181.15 2jfn n LYS 63 N -3.41 0.42 -2.33 1.06 4.76 -0.62 -4.97 118.16 113.06 2jfn n LYS 63 Ca -0.16 0.19 -0.38 0.00 -2.87 0.00 0.00 58.31 55.08 2jfn n LYS 63 Cb 1.04 -1.97 -0.02 0.00 -1.84 0.00 0.00 35.03 32.24 2jfn n LYS 63 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2jfn s SER 64 N -1.49 6.55 0.32 4.39 0.01 -1.26 -4.92 113.70 117.30 2jfn s SER 64 Ca 0.69 2.30 0.01 0.00 1.31 0.00 0.00 55.95 60.27 2jfn s SER 64 Cb -0.36 -2.61 0.55 0.00 0.21 0.00 0.00 66.02 63.81 2jfn s SER 64 CO 0.54 -0.65 1.92 -0.33 0.41 0.00 0.00 173.24 175.13 2jfn h GLU 65 N 2.61 0.78 -0.88 12.44 5.08 -1.95 -1.93 114.58 130.74 2jfn h GLU 65 Ca -0.49 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 57.76 2jfn h GLU 65 Cb 1.23 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 30.30 2jfn h GLU 65 CO 0.62 0.62 0.50 0.00 -1.00 0.00 0.00 179.01 179.76 2jfn h ALA 66 N 1.49 1.23 0.04 3.43 0.00 -2.00 -1.87 119.26 121.59 2jfn h ALA 66 Ca 0.19 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2jfn h ALA 66 Cb 0.12 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.56 2jfn h ALA 66 CO -0.02 0.64 -0.02 0.35 0.00 0.00 0.00 179.25 180.20 2jfn h PHE 67 N 1.22 -0.05 -0.45 0.00 3.57 -1.82 -3.07 116.94 116.34 2jfn h PHE 67 Ca 0.31 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.90 2jfn h PHE 67 Cb -0.01 0.02 -0.08 0.00 2.79 0.00 0.00 35.95 38.66 2jfn h PHE 67 CO 0.01 0.31 -0.08 0.82 -2.23 0.00 0.00 178.31 177.13 2jfn h ILE 68 N -0.42 0.57 -0.07 1.41 2.04 -1.08 0.85 117.51 120.81 2jfn h ILE 68 Ca -0.01 -0.01 0.02 0.00 1.00 0.00 0.00 64.86 65.86 2jfn h ILE 68 Cb 0.38 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 2jfn h ILE 68 CO 0.01 0.00 -0.04 0.58 0.00 0.00 0.00 178.15 178.70 2jfn h VAL 69 N 0.03 0.87 -0.74 1.67 2.07 -1.41 -0.53 116.25 118.21 2jfn h VAL 69 Ca 0.22 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.72 2jfn h VAL 69 Cb 0.33 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 2jfn h VAL 69 CO -0.44 0.00 0.40 -0.33 0.02 0.00 0.00 177.57 177.22 2jfn h GLU 70 N -0.04 1.03 -0.05 1.57 4.39 -1.34 -1.97 114.58 118.17 2jfn h GLU 70 Ca 0.04 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 2jfn h GLU 70 Cb 0.10 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 28.55 2jfn h GLU 70 CO -0.09 0.77 0.02 -0.09 -1.16 0.00 0.00 179.01 178.45 2jfn h ARG 71 N 1.02 0.08 -0.56 2.33 9.65 -0.56 -1.00 114.38 125.33 2jfn h ARG 71 Ca 0.26 -0.02 -0.07 0.00 -1.10 0.00 0.00 59.98 59.05 2jfn h ARG 71 Cb 0.04 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.59 2jfn h ARG 71 CO -0.04 0.26 0.05 0.28 2.80 0.00 0.00 179.97 183.32 2jfn h VAL 72 N -0.11 1.25 -0.72 0.20 2.07 -1.03 -0.36 116.25 117.54 2jfn h VAL 72 Ca 0.02 -1.01 -0.06 0.00 0.82 0.00 0.00 66.70 66.47 2jfn h VAL 72 Cb 0.21 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 2jfn h VAL 72 CO -0.00 0.37 0.24 0.58 0.02 0.00 0.00 177.57 178.77 2jfn h VAL 73 N 0.87 1.26 -0.57 2.57 2.07 -1.29 -1.42 116.25 119.74 2jfn h VAL 73 Ca 0.17 -0.88 -0.10 0.00 0.82 0.00 0.00 66.70 66.71 2jfn h VAL 73 Cb 0.44 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 2jfn h VAL 73 CO 0.02 0.35 -0.03 0.00 0.02 0.00 0.00 177.57 177.93 2jfn h ALA 74 N 1.12 0.77 -0.42 1.67 0.00 -0.64 -1.39 119.26 120.37 2jfn h ALA 74 Ca 0.24 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2jfn h ALA 74 Cb 0.29 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2jfn h ALA 74 CO -0.01 0.63 0.02 0.82 0.00 0.00 0.00 179.25 180.71 2jfn h ILE 75 N 0.91 1.26 -0.17 0.00 2.04 -0.83 -1.40 117.51 119.31 2jfn h ILE 75 Ca 0.16 -0.98 -0.08 0.00 1.00 0.00 0.00 64.86 64.96 2jfn h ILE 75 Cb 0.58 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 2jfn h ILE 75 CO 0.03 0.34 -0.23 0.58 0.00 0.00 0.00 178.15 178.87 2jfn h VAL 76 N 0.57 1.24 -0.50 1.67 2.07 -1.19 -0.87 116.25 119.24 2jfn h VAL 76 Ca 0.12 -1.10 -0.04 0.00 0.82 0.00 0.00 66.70 66.50 2jfn h VAL 76 Cb 0.45 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 2jfn h VAL 76 CO 0.02 0.34 0.18 0.74 0.02 0.00 0.00 177.57 178.86 2jfn h THR 77 N 0.28 1.22 -0.54 2.57 2.02 -0.98 -0.80 112.91 116.69 2jfn h THR 77 Ca 0.05 -0.72 -0.09 0.00 0.77 0.00 0.00 66.41 66.42 2jfn h THR 77 Cb 0.56 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 2jfn h THR 77 CO 0.04 0.27 0.00 0.00 0.37 0.00 0.00 175.52 176.20 2jfn h ALA 78 N 1.03 0.72 -0.40 6.16 0.00 -0.74 -2.59 119.26 123.44 2jfn h ALA 78 Ca 0.16 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2jfn h ALA 78 Cb 0.24 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2jfn h ALA 78 CO -0.01 0.54 0.19 0.28 0.00 0.00 0.00 179.25 180.25 2jfn h VAL 79 N 0.82 1.17 -0.18 0.00 2.07 -0.98 -2.27 116.25 116.88 2jfn h VAL 79 Ca 0.15 -0.50 0.05 0.00 0.82 0.00 0.00 66.70 67.22 2jfn h VAL 79 Cb 0.53 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 2jfn h VAL 79 CO 0.03 0.19 0.19 -0.61 0.02 0.00 0.00 177.57 177.38 2jfn h GLN 80 N 0.50 0.00 -0.03 1.57 4.15 -0.94 0.46 115.11 120.83 2jfn h GLN 80 Ca 0.14 0.00 -0.19 0.00 0.77 0.00 0.00 58.65 59.36 2jfn h GLN 80 Cb 0.12 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.81 2jfn h GLN 80 CO -0.02 0.00 -0.82 0.93 -1.93 0.00 0.00 178.83 177.00 2jfn h GLU 81 N 0.00 0.29 0.09 1.69 4.39 -1.02 -3.25 114.58 116.76 2jfn h GLU 81 Ca 0.09 -0.27 -0.28 0.00 0.34 0.00 0.00 59.36 59.23 2jfn h GLU 81 Cb 0.46 0.07 0.03 0.00 -0.10 0.00 0.00 28.75 29.21 2jfn h GLU 81 CO -0.00 0.96 -1.16 0.00 -1.16 0.00 0.00 179.01 177.65 2jfn h ARG 82 N 0.18 0.62 -2.86 2.33 2.47 -0.83 -3.46 114.38 112.83 2jfn h ARG 82 Ca -0.04 -0.79 -0.17 0.00 -1.26 0.00 0.00 59.98 57.72 2jfn h ARG 82 Cb 1.41 0.26 -0.29 0.00 -1.65 0.00 0.00 29.97 29.70 2jfn h ARG 82 CO 0.13 1.36 -0.42 0.71 0.56 0.00 0.00 179.97 182.31 2jfn s TYR 83 N -3.04 -0.45 0.43 3.04 1.51 -0.22 -5.13 117.35 113.50 2jfn s TYR 83 Ca -0.10 1.00 -0.26 0.00 -1.01 0.00 0.00 57.07 56.70 2jfn s TYR 83 Cb 0.05 0.13 -0.09 0.00 -0.11 0.00 0.00 41.96 41.94 2jfn s TYR 83 CO 0.92 -0.29 1.42 -2.14 -1.11 0.00 0.00 175.55 174.36 2jfn s PRO 84 N 1.42 3.83 -0.08 -1.71 0.02 -1.25 -4.05 135.00 133.18 2jfn s PRO 84 Ca -0.09 2.42 -0.02 0.00 0.02 0.00 0.00 61.00 63.33 2jfn s PRO 84 Cb -0.10 -2.75 -0.03 0.00 0.02 0.00 0.00 34.50 31.64 2jfn s PRO 84 CO -0.10 -0.70 0.00 -0.51 -0.33 0.00 0.00 177.00 175.36 2jfn s LEU 85 N -2.53 3.59 -0.00 -5.54 1.43 -1.26 -4.70 118.68 109.67 2jfn s LEU 85 Ca 0.58 0.14 0.11 0.00 -1.03 0.00 0.00 54.13 53.94 2jfn s LEU 85 Cb -0.44 -1.84 -0.23 0.00 0.03 0.00 0.00 46.19 43.72 2jfn s LEU 85 CO 0.57 0.37 0.82 0.00 0.23 0.00 0.00 176.35 178.35 2jfn h ALA 86 N 5.11 0.67 -1.62 4.21 0.00 -0.98 -3.44 119.26 123.20 2jfn h ALA 86 Ca -0.51 -1.32 0.08 0.00 0.00 0.00 0.00 54.91 53.16 2jfn h ALA 86 Cb 1.19 0.32 -0.22 0.00 0.00 0.00 0.00 17.79 19.08 2jfn h ALA 86 CO 0.54 1.50 0.53 -1.17 0.00 0.00 0.00 179.25 180.66 2jfn s LEU 87 N -6.25 -0.38 -0.01 0.00 0.20 -1.16 -4.09 118.68 106.99 2jfn s LEU 87 Ca -0.03 0.39 0.04 0.00 0.69 0.00 0.00 54.13 55.22 2jfn s LEU 87 Cb 0.08 1.90 -0.01 0.00 -0.43 0.00 0.00 46.19 47.73 2jfn s LEU 87 CO 0.82 -0.37 -0.13 0.00 -0.29 0.00 0.00 176.35 176.39 2jfn s ALA 88 N -1.24 1.06 -0.17 5.97 0.00 -0.93 -1.23 121.76 125.22 2jfn s ALA 88 Ca -0.02 -0.54 0.00 0.00 0.00 0.00 0.00 51.96 51.40 2jfn s ALA 88 Cb -0.00 -0.27 0.00 0.00 0.00 0.00 0.00 23.12 22.85 2jfn s ALA 88 CO 0.01 0.26 -0.15 0.08 0.00 0.00 0.00 175.76 175.96 2jfn s VAL 89 N -0.28 2.55 -1.15 0.00 1.01 0.10 -0.35 120.40 122.29 2jfn s VAL 89 Ca 0.05 -0.79 -0.14 0.00 0.00 0.00 0.00 61.98 61.10 2jfn s VAL 89 Cb -0.05 -2.09 0.18 0.00 0.00 0.00 0.00 36.38 34.42 2jfn s VAL 89 CO -0.00 0.51 1.33 -0.69 0.00 0.00 0.00 175.10 176.25 2jfn s VAL 90 N 1.05 5.14 -1.36 2.92 1.01 0.25 -0.64 120.40 128.78 2jfn s VAL 90 Ca -0.01 -2.60 -0.09 0.00 0.00 0.00 0.00 61.98 59.28 2jfn s VAL 90 Cb -0.15 -4.84 -0.08 0.00 0.00 0.00 0.00 36.38 31.32 2jfn s VAL 90 CO -0.04 -1.53 2.96 0.00 0.00 0.00 0.00 175.10 176.49 2jfn n ALA 91 N 5.31 7.30 -3.46 5.51 0.00 0.08 -3.89 120.51 131.36 2jfn n ALA 91 Ca 0.33 -3.40 -0.06 0.00 0.00 0.00 0.00 53.44 50.31 2jfn n ALA 91 Cb 0.43 -3.13 -0.07 0.00 0.00 0.00 0.00 19.45 16.68 2jfn n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jfn h ASN 93 N 8.14 0.86 0.28 0.00 4.21 -1.84 0.72 115.58 127.95 2jfn h ASN 93 Ca -0.18 -0.16 0.00 0.00 1.21 0.00 0.00 56.30 57.16 2jfn h ASN 93 Cb 1.13 -0.22 0.00 0.00 -1.12 0.00 0.00 38.32 38.11 2jfn h ASN 93 CO 0.20 0.79 0.00 0.35 -1.29 0.00 0.00 177.43 177.48 2jfn n THR 94 N -4.45 0.89 -0.02 2.81 -2.24 -1.26 -3.41 114.28 106.60 2jfn n THR 94 Ca 0.04 0.22 -0.02 0.00 -2.27 0.00 0.00 64.05 62.02 2jfn n THR 94 Cb 0.16 -1.03 -0.02 0.00 -2.10 0.00 0.00 70.33 67.34 2jfn n THR 94 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jfn n ALA 95 N -1.36 1.93 -0.65 6.98 0.00 -0.96 -4.85 120.51 121.59 2jfn n ALA 95 Ca 0.05 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2jfn n ALA 95 Cb 0.11 0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.91 2jfn n ALA 95 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2jfn n SER 96 N -2.46 0.00 0.00 0.00 7.64 0.21 -1.28 113.62 117.72 2jfn n SER 96 Ca -0.06 0.67 0.00 0.00 1.01 0.00 0.00 58.87 60.49 2jfn n SER 96 Cb 0.57 -0.17 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 2jfn n SER 96 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2jfn n THR 97 N -1.55 0.00 0.28 0.44 -2.24 -1.26 -1.21 114.28 108.74 2jfn n THR 97 Ca 0.00 1.07 0.16 0.00 -2.27 0.00 0.00 64.05 63.00 2jfn n THR 97 Cb 0.00 -1.44 0.92 0.00 -2.10 0.00 0.00 70.33 67.70 2jfn n THR 97 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 2jfn h VAL 98 N 0.00 0.49 0.00 2.28 -1.51 -1.88 -3.18 116.25 112.45 2jfn h VAL 98 Ca 0.00 0.00 -0.06 0.00 -1.23 0.00 0.00 66.70 65.41 2jfn h VAL 98 Cb 0.00 0.97 -0.01 0.00 -2.13 0.00 0.00 31.29 30.12 2jfn h VAL 98 CO 0.00 0.00 -1.65 -1.20 -1.23 0.00 0.00 177.57 173.49 2jfn n SER 99 N -3.80 0.39 -0.04 4.19 7.64 -0.35 -4.62 113.62 117.02 2jfn n SER 99 Ca -0.02 0.16 -0.08 0.00 1.01 0.00 0.00 58.87 59.93 2jfn n SER 99 Cb 0.12 1.15 -0.02 0.00 -1.01 0.00 0.00 64.21 64.46 2jfn n SER 99 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2jfn h LEU 100 N 0.00 -0.33 -0.36 -3.43 3.38 -1.19 -1.54 115.31 111.84 2jfn h LEU 100 Ca -0.08 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.03 2jfn h LEU 100 Cb 1.21 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 42.10 2jfn h LEU 100 CO 0.01 -0.13 0.06 -0.65 0.09 0.00 0.00 178.44 177.82 2jfn h PRO 101 N -0.06 0.17 -0.84 1.13 0.11 -1.82 0.59 132.00 131.28 2jfn h PRO 101 Ca 0.12 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.18 2jfn h PRO 101 Cb 0.24 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.27 2jfn h PRO 101 CO -0.26 0.11 0.38 0.00 -0.21 0.00 0.00 178.00 178.02 2jfn h ALA 102 N 1.28 1.08 -0.37 -0.75 0.00 -1.80 -1.75 119.26 116.96 2jfn h ALA 102 Ca 0.17 -0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 2jfn h ALA 102 Cb 0.21 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2jfn h ALA 102 CO -0.24 0.67 -0.42 -0.07 0.00 0.00 0.00 179.25 179.19 2jfn h LEU 103 N 1.20 1.00 -1.21 0.00 3.38 -0.88 -2.22 115.31 116.58 2jfn h LEU 103 Ca 0.29 -0.47 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 2jfn h LEU 103 Cb 0.15 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2jfn h LEU 103 CO -0.03 1.28 -0.17 0.03 0.09 0.00 0.00 178.44 179.63 2jfn h ARG 104 N 0.75 0.00 0.19 1.13 3.08 -0.70 -1.56 114.38 117.27 2jfn h ARG 104 Ca 0.05 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.85 2jfn h ARG 104 Cb 1.02 0.00 0.03 0.00 0.08 0.00 0.00 29.97 31.10 2jfn h ARG 104 CO 0.10 0.17 -1.11 1.49 -1.07 0.00 0.00 179.97 179.55 2jfn h GLU 105 N 0.00 0.42 -0.00 0.04 4.57 -1.20 -3.37 114.58 115.04 2jfn h GLU 105 Ca -0.00 -0.70 -0.23 0.00 -1.18 0.00 0.00 59.36 57.25 2jfn h GLU 105 Cb 0.68 0.26 0.00 0.00 -0.16 0.00 0.00 28.75 29.53 2jfn h GLU 105 CO 0.02 1.33 -0.95 -0.22 -1.18 0.00 0.00 179.01 178.02 2jfn h LYS 106 N -0.12 0.44 -6.16 1.92 3.64 -1.27 -3.46 116.57 111.55 2jfn h LYS 106 Ca -0.19 -0.48 -0.56 0.00 -1.27 0.00 0.00 60.65 58.15 2jfn h LYS 106 Cb 1.87 0.13 -0.06 0.00 -0.41 0.00 0.00 32.23 33.77 2jfn h LYS 106 CO 0.21 1.13 -0.54 -0.06 -2.27 0.00 0.00 179.45 177.92 2jfn s PHE 107 N -3.28 3.23 -0.45 1.91 0.40 -0.60 -5.03 117.98 114.17 2jfn s PHE 107 Ca -0.06 0.01 0.04 0.00 -0.60 0.00 0.00 56.93 56.31 2jfn s PHE 107 Cb 0.09 -1.54 0.47 0.00 0.51 0.00 0.00 43.02 42.54 2jfn s PHE 107 CO 0.87 0.52 1.58 -0.25 0.70 0.00 0.00 175.22 178.65 2jfn n ASP 108 N -0.44 5.65 -4.05 1.36 8.00 -1.26 -4.77 116.55 121.03 2jfn n ASP 108 Ca -0.08 -3.77 -0.13 0.00 0.71 0.00 0.00 54.79 51.53 2jfn n ASP 108 Cb 0.55 -0.65 -0.11 0.00 -0.02 0.00 0.00 41.12 40.88 2jfn n ASP 108 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2jfn s PHE 109 N -3.63 0.61 0.48 1.24 -0.12 -1.26 -4.74 117.98 110.56 2jfn s PHE 109 Ca 0.56 -0.50 -0.24 0.00 -0.05 0.00 0.00 56.93 56.70 2jfn s PHE 109 Cb 0.45 -0.37 -0.07 0.00 -0.63 0.00 0.00 43.02 42.40 2jfn s PHE 109 CO 0.02 -0.10 1.36 -1.25 -0.05 0.00 0.00 175.22 175.19 2jfn s PRO 110 N -1.54 3.51 -0.10 1.99 0.04 -1.26 -4.87 135.00 132.77 2jfn s PRO 110 Ca -0.11 2.24 0.03 0.00 0.04 0.00 0.00 61.00 63.21 2jfn s PRO 110 Cb -0.10 -2.49 0.01 0.00 0.04 0.00 0.00 34.50 31.96 2jfn s PRO 110 CO 0.00 -0.89 -0.21 0.08 0.04 0.00 0.00 177.00 176.01 2jfn s VAL 111 N -1.28 1.89 -0.14 -0.36 1.01 -1.26 -2.19 120.40 118.07 2jfn s VAL 111 Ca 0.65 -0.91 -0.06 0.00 0.00 0.00 0.00 61.98 61.66 2jfn s VAL 111 Cb -0.40 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 2jfn s VAL 111 CO 0.50 0.52 0.09 -0.69 0.00 0.00 0.00 175.10 175.51 2jfn s VAL 112 N 0.54 5.03 0.50 2.92 1.01 0.53 -4.99 120.40 125.94 2jfn s VAL 112 Ca -0.15 0.04 0.04 0.00 0.00 0.00 0.00 61.98 61.91 2jfn s VAL 112 Cb -0.17 -3.21 -0.00 0.00 0.00 0.00 0.00 36.38 33.00 2jfn s VAL 112 CO 0.05 0.55 0.21 -0.83 0.00 0.00 0.00 175.10 175.09 2jfn s GLY 113 N -0.46 2.59 -0.02 4.51 0.00 -1.26 -0.58 107.32 112.09 2jfn s GLY 113 Ca 0.11 -1.16 0.01 0.00 0.00 0.00 0.00 44.72 43.68 2jfn s GLY 113 CO 0.02 -2.02 -0.04 -1.34 0.00 0.00 0.00 173.10 169.72 2jfn s VAL 114 N -2.77 0.39 0.05 1.40 -7.23 -1.25 -4.90 120.40 106.09 2jfn s VAL 114 Ca 0.26 -0.11 0.04 0.00 -1.81 0.00 0.00 61.98 60.36 2jfn s VAL 114 Cb 0.01 -0.40 -0.02 0.00 0.56 0.00 0.00 36.38 36.52 2jfn s VAL 114 CO 0.15 0.16 -0.11 0.68 -0.31 0.00 0.00 175.10 175.67 2jfn s VAL 115 N 0.52 0.82 0.23 1.32 -7.23 -1.26 -4.53 120.40 110.27 2jfn s VAL 115 Ca -0.06 -1.09 -0.31 0.00 -1.81 0.00 0.00 61.98 58.71 2jfn s VAL 115 Cb -0.09 -0.82 -0.14 0.00 0.56 0.00 0.00 36.38 35.89 2jfn s VAL 115 CO -0.00 -0.24 1.21 -2.65 -0.31 0.00 0.00 175.10 173.11 2jfn n PRO 116 N 1.56 1.54 -0.60 4.82 -0.02 -1.26 -4.79 135.00 136.25 2jfn n PRO 116 Ca -0.21 0.55 -0.07 0.00 -2.02 0.00 0.00 63.50 61.75 2jfn n PRO 116 Cb 0.55 -2.07 -0.10 0.00 -0.02 0.00 0.00 33.50 31.86 2jfn n PRO 116 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jfn n ALA 117 N 1.25 4.27 -0.22 3.55 0.00 -1.26 -4.50 120.51 123.60 2jfn n ALA 117 Ca 0.12 -1.04 -0.08 0.00 0.00 0.00 0.00 53.44 52.44 2jfn n ALA 117 Cb 0.29 -2.20 0.03 0.00 0.00 0.00 0.00 19.45 17.57 2jfn n ALA 117 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2jfn h ILE 118 N 2.27 1.25 0.21 0.00 2.04 -1.96 -2.84 117.51 118.48 2jfn h ILE 118 Ca 0.11 -0.87 0.01 0.00 1.00 0.00 0.00 64.86 65.11 2jfn h ILE 118 Cb 0.93 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 37.61 2jfn h ILE 118 CO 0.30 0.33 -0.41 0.50 0.00 0.00 0.00 178.15 178.87 2jfn h LYS 119 N 0.89 -0.68 -0.12 2.37 3.64 -1.82 -0.70 116.57 120.15 2jfn h LYS 119 Ca 0.20 0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.54 2jfn h LYS 119 Cb 0.32 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 2jfn h LYS 119 CO -0.00 -0.45 -0.29 -1.00 -2.27 0.00 0.00 179.45 175.43 2jfn h PRO 120 N -0.71 0.22 -0.55 1.90 0.13 -1.93 -2.79 132.00 128.27 2jfn h PRO 120 Ca 0.00 -0.08 -0.02 0.00 -0.87 0.00 0.00 66.00 65.03 2jfn h PRO 120 Cb 0.69 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 31.78 2jfn h PRO 120 CO -0.18 0.50 0.25 0.00 -0.23 0.00 0.00 178.00 178.34 2jfn h ALA 121 N 1.50 1.39 0.00 -0.56 0.00 -1.21 -1.83 119.26 118.56 2jfn h ALA 121 Ca 0.03 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 2jfn h ALA 121 Cb 0.63 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2jfn h ALA 121 CO 0.05 0.47 -0.27 0.00 0.00 0.00 0.00 179.25 179.50 2jfn h ALA 122 N 1.49 1.55 -0.00 0.00 0.00 -0.85 -1.64 119.26 119.80 2jfn h ALA 122 Ca 0.19 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2jfn h ALA 122 Cb 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2jfn h ALA 122 CO -0.02 0.34 -0.31 0.54 0.00 0.00 0.00 179.25 179.79 2jfn n ARG 123 N -4.21 0.16 -0.08 0.00 1.74 -0.74 -4.14 116.66 109.40 2jfn n ARG 123 Ca -0.02 -0.08 -0.07 0.00 -0.77 0.00 0.00 57.85 56.91 2jfn n ARG 123 Cb 0.32 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 30.12 2jfn n ARG 123 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2jfn n LEU 124 N -1.35 0.00 -4.73 0.55 4.77 -0.81 -5.00 117.00 110.43 2jfn n LEU 124 Ca 0.08 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.65 2jfn n LEU 124 Cb 0.33 0.40 0.02 0.00 -2.33 0.00 0.00 43.42 41.84 2jfn n LEU 124 CO 0.31 0.40 0.97 1.07 -1.33 0.00 0.00 177.39 178.81 2jfn n THR 125 N -2.60 2.85 -0.07 -5.08 5.66 -0.68 -4.93 114.28 109.42 2jfn n THR 125 Ca -0.26 -0.50 -0.08 0.00 -3.05 0.00 0.00 64.05 60.16 2jfn n THR 125 Cb 1.02 -1.70 -0.10 0.00 -1.55 0.00 0.00 70.33 68.00 2jfn n THR 125 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2jfn n ALA 126 N -0.34 1.65 1.17 1.79 0.00 -1.26 -4.50 120.51 119.01 2jfn n ALA 126 Ca 0.07 -0.88 0.13 0.00 0.00 0.00 0.00 53.44 52.75 2jfn n ALA 126 Cb 0.41 -0.01 0.24 0.00 0.00 0.00 0.00 19.45 20.08 2jfn n ALA 126 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2jfn n ASN 127 N -2.61 2.31 0.00 0.00 6.94 -1.26 -4.95 115.26 115.69 2jfn n ASN 127 Ca -0.24 -1.72 0.00 0.00 -0.02 0.00 0.00 54.58 52.60 2jfn n ASN 127 Cb 0.92 0.06 0.00 0.00 -2.36 0.00 0.00 39.78 38.41 2jfn n ASN 127 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2jfn n GLY 128 N 1.30 0.56 3.32 4.83 0.00 -1.26 -4.99 105.19 108.95 2jfn n GLY 128 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 2jfn n GLY 128 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jfn s ILE 129 N -2.43 4.31 -0.16 -0.61 -1.09 -1.26 -1.41 121.20 118.54 2jfn s ILE 129 Ca 0.00 -1.09 -0.02 0.00 -2.23 0.00 0.00 60.65 57.31 2jfn s ILE 129 Cb 0.00 -3.49 -0.02 0.00 -1.58 0.00 0.00 42.46 37.37 2jfn s ILE 129 CO 0.00 -0.31 -0.08 -0.69 -1.23 0.00 0.00 174.94 172.63 2jfn s VAL 130 N 1.48 3.38 0.08 2.92 1.01 -0.57 -2.15 120.40 126.55 2jfn s VAL 130 Ca 0.01 -0.53 -0.02 0.00 0.00 0.00 0.00 61.98 61.44 2jfn s VAL 130 Cb -0.20 -2.47 -0.05 0.00 0.00 0.00 0.00 36.38 33.66 2jfn s VAL 130 CO 0.04 0.49 0.27 -0.83 0.00 0.00 0.00 175.10 175.08 2jfn s GLY 131 N 0.67 2.21 -0.20 4.51 0.00 0.29 -0.62 107.32 114.17 2jfn s GLY 131 Ca -0.04 -0.71 0.00 0.00 0.00 0.00 0.00 44.72 43.97 2jfn s GLY 131 CO 0.02 -0.65 -0.07 -2.27 0.00 0.00 0.00 173.10 170.14 2jfn s LEU 132 N -2.45 2.15 -0.26 0.66 2.96 0.41 0.00 118.68 122.15 2jfn s LEU 132 Ca 0.36 -0.92 -0.10 0.00 -0.22 0.00 0.00 54.13 53.26 2jfn s LEU 132 Cb -0.13 -1.11 -0.04 0.00 0.50 0.00 0.00 46.19 45.41 2jfn s LEU 132 CO 0.25 -0.19 0.14 -0.76 -1.32 0.00 0.00 176.35 174.47 2jfn s LEU 133 N 1.48 3.83 0.31 -0.68 1.43 -0.21 -0.76 118.68 124.08 2jfn s LEU 133 Ca -0.02 -0.06 -0.02 0.00 -1.03 0.00 0.00 54.13 53.00 2jfn s LEU 133 Cb -0.17 -2.05 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 2jfn s LEU 133 CO -0.07 -0.02 0.41 0.00 0.23 0.00 0.00 176.35 176.89 2jfn s ALA 134 N 1.58 0.87 0.69 4.21 0.00 -0.77 0.16 121.76 128.51 2jfn s ALA 134 Ca 0.07 -1.55 -0.11 0.00 0.00 0.00 0.00 51.96 50.36 2jfn s ALA 134 Cb -0.15 1.22 0.01 0.00 0.00 0.00 0.00 23.12 24.20 2jfn s ALA 134 CO 0.08 -0.76 1.08 -0.08 0.00 0.00 0.00 175.76 176.08 2jfn s THR 135 N -3.35 3.75 0.26 0.00 -1.32 -1.26 0.31 115.64 114.02 2jfn s THR 135 Ca 0.32 0.57 -0.02 0.00 -1.21 0.00 0.00 61.69 61.35 2jfn s THR 135 Cb 0.01 -3.54 0.25 0.00 -1.51 0.00 0.00 72.50 67.71 2jfn s THR 135 CO 0.19 -0.74 1.70 -0.09 -2.21 0.00 0.00 174.62 173.47 2jfn h ARG 136 N -0.61 0.34 0.00 7.08 9.65 -1.78 -1.79 114.38 127.27 2jfn h ARG 136 Ca -0.45 -0.02 -0.10 0.00 -1.10 0.00 0.00 59.98 58.31 2jfn h ARG 136 Cb 1.24 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 29.73 2jfn h ARG 136 CO 0.63 0.22 -0.49 0.78 2.80 0.00 0.00 179.97 183.91 2jfn h GLY 137 N 0.35 0.00 2.00 2.80 0.00 -1.93 -3.22 103.07 103.07 2jfn h GLY 137 Ca 0.46 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.68 2jfn h GLY 137 CO -0.50 0.00 -0.52 -0.84 0.00 0.00 0.00 176.54 174.68 2jfn h THR 138 N 0.00 1.27 -0.00 4.70 2.02 -1.64 -3.01 112.91 116.24 2jfn h THR 138 Ca -0.00 -1.86 0.00 0.00 0.77 0.00 0.00 66.41 65.32 2jfn h THR 138 Cb 0.88 2.03 0.00 0.00 -1.74 0.00 0.00 68.15 69.32 2jfn h THR 138 CO 0.06 0.51 -0.00 1.33 0.37 0.00 0.00 175.52 177.79 2jfn n VAL 139 N -3.76 0.00 0.46 3.16 0.24 -1.16 -3.24 118.33 114.03 2jfn n VAL 139 Ca -0.01 -0.08 0.05 0.00 -2.04 0.00 0.00 64.34 62.26 2jfn n VAL 139 Cb 0.56 -0.17 0.02 0.00 -1.47 0.00 0.00 33.84 32.79 2jfn n VAL 139 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2jfn n LYS 140 N -0.63 1.20 -2.81 7.34 4.81 -1.14 -4.92 118.16 122.01 2jfn n LYS 140 Ca 0.22 -0.92 -0.38 0.00 -0.87 0.00 0.00 58.31 56.36 2jfn n LYS 140 Cb 0.19 -1.16 -0.06 0.00 0.02 0.00 0.00 35.03 34.02 2jfn n LYS 140 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 2jfn s ARG 141 N -1.12 4.68 0.23 1.64 1.81 -1.20 -4.97 118.95 120.03 2jfn s ARG 141 Ca 0.11 1.35 -0.03 0.00 -1.72 0.00 0.00 55.73 55.44 2jfn s ARG 141 Cb 0.09 -3.06 0.25 0.00 -0.45 0.00 0.00 34.95 31.78 2jfn s ARG 141 CO 0.19 0.42 1.68 0.66 -0.68 0.00 0.00 175.30 177.58 2jfn h SER 142 N 3.74 0.76 -0.92 0.23 4.64 -1.95 -2.46 113.55 117.59 2jfn h SER 142 Ca -0.46 -0.24 0.15 0.00 -0.47 0.00 0.00 61.79 60.77 2jfn h SER 142 Cb 1.20 -0.21 -0.08 0.00 -0.31 0.00 0.00 62.40 63.00 2jfn h SER 142 CO 0.66 0.91 0.59 0.22 -0.87 0.00 0.00 176.83 178.35 2jfn h TYR 143 N 0.69 0.88 0.32 4.77 5.03 -1.95 -1.23 116.97 125.48 2jfn h TYR 143 Ca 0.11 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.43 2jfn h TYR 143 Cb 0.62 -0.28 0.00 0.00 1.55 0.00 0.00 36.73 38.63 2jfn h TYR 143 CO 0.03 0.31 -0.15 1.15 -1.32 0.00 0.00 178.16 178.18 2jfn h THR 144 N 0.73 0.00 -1.21 1.81 2.02 -1.72 -2.73 112.91 111.82 2jfn h THR 144 Ca 0.47 -0.32 0.39 0.00 0.77 0.00 0.00 66.41 67.72 2jfn h THR 144 Cb 0.72 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 67.00 2jfn h THR 144 CO -0.23 0.00 0.76 0.45 0.37 0.00 0.00 175.52 176.87 2jfn h HIS 145 N -0.74 0.63 0.08 3.16 3.86 -1.24 0.13 115.15 121.02 2jfn h HIS 145 Ca -0.04 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 2jfn h HIS 145 Cb 0.32 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 28.64 2jfn h HIS 145 CO 0.04 -0.19 -0.04 0.93 0.86 0.00 0.00 177.93 179.54 2jfn h GLU 146 N 0.16 -0.10 -0.83 2.45 5.08 -1.27 -3.07 114.58 116.99 2jfn h GLU 146 Ca 0.78 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 59.25 2jfn h GLU 146 Cb 2.26 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 31.48 2jfn h GLU 146 CO -0.46 0.30 0.54 1.25 -1.00 0.00 0.00 179.01 179.64 2jfn h LEU 147 N -0.54 0.68 -1.83 1.33 5.85 -0.46 0.29 115.31 120.62 2jfn h LEU 147 Ca -0.01 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 2jfn h LEU 147 Cb 0.45 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.36 2jfn h LEU 147 CO 0.02 0.39 -0.07 0.40 -0.34 0.00 0.00 178.44 178.84 2jfn h ILE 148 N 0.74 1.06 0.00 4.05 2.04 -1.23 -2.40 117.51 121.77 2jfn h ILE 148 Ca 0.39 -0.27 -0.25 0.00 1.00 0.00 0.00 64.86 65.73 2jfn h ILE 148 Cb 0.49 1.12 -0.04 0.00 -0.74 0.00 0.00 36.82 37.65 2jfn h ILE 148 CO -0.16 0.08 -1.65 0.00 0.00 0.00 0.00 178.15 176.42 2jfn n ALA 149 N -2.52 1.67 -0.04 1.87 0.00 -0.07 -3.09 120.51 118.33 2jfn n ALA 149 Ca -0.03 -0.72 -0.14 0.00 0.00 0.00 0.00 53.44 52.56 2jfn n ALA 149 Cb 0.15 -0.85 -0.09 0.00 0.00 0.00 0.00 19.45 18.67 2jfn n ALA 149 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2jfn h ARG 150 N 0.00 0.28 -0.17 0.00 2.43 -0.70 -3.35 114.38 112.87 2jfn h ARG 150 Ca -0.25 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 2jfn h ARG 150 Cb 1.86 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 31.43 2jfn h ARG 150 CO 0.06 0.78 0.00 1.19 -1.51 0.00 0.00 179.97 180.49 2jfn n PHE 151 N -4.56 0.22 -2.68 2.20 3.01 -0.94 -4.68 117.46 110.04 2jfn n PHE 151 Ca -0.07 -0.47 -0.08 0.00 1.01 0.00 0.00 57.45 57.84 2jfn n PHE 151 Cb 0.40 -0.04 0.03 0.00 -0.01 0.00 0.00 39.48 39.87 2jfn n PHE 151 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2jfn n ALA 152 N 0.04 3.32 0.19 4.37 0.00 -1.18 -4.63 120.51 122.61 2jfn n ALA 152 Ca 0.06 -3.11 0.08 0.00 0.00 0.00 0.00 53.44 50.47 2jfn n ALA 152 Cb 0.33 -0.85 0.17 0.00 0.00 0.00 0.00 19.45 19.10 2jfn n ALA 152 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2jfn h ASN 153 N 2.77 0.00 -0.26 0.00 -0.00 -1.73 -3.24 115.58 113.12 2jfn h ASN 153 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.24 2jfn h ASN 153 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.54 2jfn h ASN 153 CO 0.42 0.23 0.00 -1.84 -0.00 0.00 0.00 177.43 176.24 2jfn n GLU 154 N -3.18 2.05 -4.07 6.67 -0.00 -1.26 -4.93 120.64 115.91 2jfn n GLU 154 Ca 0.03 -1.58 -0.08 0.00 -0.00 0.00 0.00 57.16 55.53 2jfn n GLU 154 Cb 0.59 -1.44 -0.10 0.00 -0.00 0.00 0.00 31.44 30.50 2jfn n GLU 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2jfn s GLN 156 N -3.94 4.13 -0.22 0.00 -2.07 -0.50 -4.95 119.66 112.09 2jfn s GLN 156 Ca 0.11 0.15 -0.09 0.00 -1.82 0.00 0.00 55.36 53.71 2jfn s GLN 156 Cb 0.07 -3.37 -0.04 0.00 -1.09 0.00 0.00 33.01 28.58 2jfn s GLN 156 CO -0.07 0.36 0.11 0.42 -1.32 0.00 0.00 175.29 174.79 2jfn s ILE 157 N 0.07 4.99 -0.41 3.63 -1.09 -1.26 -1.51 121.20 125.62 2jfn s ILE 157 Ca 0.18 0.05 -0.11 0.00 -2.23 0.00 0.00 60.65 58.54 2jfn s ILE 157 Cb -0.14 -3.30 0.05 0.00 -1.58 0.00 0.00 42.46 37.50 2jfn s ILE 157 CO 0.06 0.38 0.25 -1.61 -1.23 0.00 0.00 174.94 172.80 2jfn s GLU 158 N 0.92 2.75 0.12 2.79 0.41 0.20 -4.99 118.70 120.91 2jfn s GLU 158 Ca 0.06 -1.27 -0.15 0.00 -0.41 0.00 0.00 54.97 53.19 2jfn s GLU 158 Cb -0.13 -3.81 -0.07 0.00 -1.78 0.00 0.00 34.13 28.34 2jfn s GLU 158 CO 0.03 -0.85 0.54 -1.64 -0.49 0.00 0.00 175.26 172.85 2jfn s MET 159 N 1.51 4.00 -0.24 1.61 -1.94 -1.26 -0.45 119.30 122.54 2jfn s MET 159 Ca 0.03 0.52 -0.02 0.00 -1.71 0.00 0.00 55.69 54.50 2jfn s MET 159 Cb -0.21 -3.01 0.12 0.00 2.01 0.00 0.00 34.83 33.73 2jfn s MET 159 CO 0.05 0.53 0.29 -1.17 -0.01 0.00 0.00 175.02 174.71 2jfn s LEU 160 N -1.74 -0.32 -0.19 -0.03 0.20 0.06 -4.92 118.68 111.75 2jfn s LEU 160 Ca 0.35 -0.23 -0.11 0.00 0.69 0.00 0.00 54.13 54.82 2jfn s LEU 160 Cb -0.16 0.66 -0.05 0.00 -0.43 0.00 0.00 46.19 46.21 2jfn s LEU 160 CO 0.19 -0.34 0.19 -0.83 -0.29 0.00 0.00 176.35 175.27 2jfn s GLY 161 N 2.41 2.10 -0.19 7.98 0.00 -1.25 -1.84 107.32 116.52 2jfn s GLY 161 Ca 0.09 -0.61 -0.05 0.00 0.00 0.00 0.00 44.72 44.16 2jfn s GLY 161 CO -0.19 0.25 0.13 -0.45 0.00 0.00 0.00 173.10 172.84 2jfn s SER 162 N 0.42 2.10 0.29 1.64 0.15 0.15 -4.46 113.70 113.99 2jfn s SER 162 Ca 0.11 -0.52 0.13 0.00 0.70 0.00 0.00 55.95 56.37 2jfn s SER 162 Cb -0.12 -0.06 0.39 0.00 -1.71 0.00 0.00 66.02 64.52 2jfn s SER 162 CO 0.00 -0.35 1.61 0.00 1.20 0.00 0.00 173.24 175.70 2jfn h ALA 163 N 8.39 0.90 -0.49 5.45 0.00 -1.89 -3.06 119.26 128.55 2jfn h ALA 163 Ca -0.16 -0.52 -0.06 0.00 0.00 0.00 0.00 54.91 54.18 2jfn h ALA 163 Cb 1.14 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 2jfn h ALA 163 CO 0.29 0.71 0.07 1.49 0.00 0.00 0.00 179.25 181.81 2jfn h GLU 164 N 0.00 0.78 -0.28 0.00 4.81 -1.97 -2.23 114.58 115.68 2jfn h GLU 164 Ca -0.01 -0.18 -0.06 0.00 -0.13 0.00 0.00 59.36 58.98 2jfn h GLU 164 Cb 1.12 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.37 2jfn h GLU 164 CO 0.07 0.74 -0.10 1.98 -0.73 0.00 0.00 179.01 180.97 2jfn h MET 165 N 0.74 0.46 -0.60 1.92 4.05 -1.94 -0.61 114.93 118.95 2jfn h MET 165 Ca 0.16 -0.12 -0.01 0.00 -0.28 0.00 0.00 59.70 59.45 2jfn h MET 165 Cb 0.35 -0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 31.07 2jfn h MET 165 CO 0.01 0.57 0.34 0.28 0.23 0.00 0.00 176.91 178.34 2jfn h VAL 166 N 0.44 1.19 -0.40 -5.77 2.07 -1.45 -1.50 116.25 110.83 2jfn h VAL 166 Ca 0.08 -0.45 -0.06 0.00 0.82 0.00 0.00 66.70 67.09 2jfn h VAL 166 Cb 0.44 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 2jfn h VAL 166 CO 0.02 0.20 -0.02 -0.33 0.02 0.00 0.00 177.57 177.47 2jfn h GLU 167 N 0.82 0.65 -0.77 1.57 4.39 -1.04 -0.82 114.58 119.37 2jfn h GLU 167 Ca 0.21 -0.16 -0.05 0.00 0.34 0.00 0.00 59.36 59.71 2jfn h GLU 167 Cb 0.02 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 2jfn h GLU 167 CO -0.04 0.68 0.30 -0.07 -1.16 0.00 0.00 179.01 178.73 2jfn h LEU 168 N 0.61 1.07 -0.32 1.33 3.38 -0.53 0.19 115.31 121.04 2jfn h LEU 168 Ca 0.12 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 2jfn h LEU 168 Cb 0.41 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2jfn h LEU 168 CO 0.02 0.96 0.01 0.00 0.09 0.00 0.00 178.44 179.51 2jfn h ALA 169 N 1.16 0.43 0.02 1.53 0.00 -0.74 -0.41 119.26 121.25 2jfn h ALA 169 Ca 0.26 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2jfn h ALA 169 Cb 0.22 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2jfn h ALA 169 CO -0.02 0.18 -0.09 0.93 0.00 0.00 0.00 179.25 180.25 2jfn h GLU 170 N 0.37 -0.16 -0.43 0.00 4.39 -0.76 -2.41 114.58 115.58 2jfn h GLU 170 Ca 0.09 0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.88 2jfn h GLU 170 Cb 0.43 0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 29.05 2jfn h GLU 170 CO 0.01 -0.11 0.01 0.00 -1.16 0.00 0.00 179.01 177.77 2jfn h ALA 171 N 0.80 0.41 -0.23 3.43 0.00 -0.46 -1.88 119.26 121.31 2jfn h ALA 171 Ca 0.03 0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.12 2jfn h ALA 171 Cb 0.20 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 2jfn h ALA 171 CO -0.08 -0.38 -0.17 -0.22 0.00 0.00 0.00 179.25 178.40 2jfn h LYS 172 N 0.12 -0.16 0.00 0.00 3.64 -0.69 0.04 116.57 119.52 2jfn h LYS 172 Ca 0.21 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 2jfn h LYS 172 Cb 0.30 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2jfn h LYS 172 CO -0.34 -0.11 0.00 1.28 -2.27 0.00 0.00 179.45 178.01 2jfn n LEU 173 N -5.33 0.00 -0.48 5.20 4.77 -0.94 -1.82 117.00 118.40 2jfn n LEU 173 Ca -0.01 0.35 0.12 0.00 -0.03 0.00 0.00 56.01 56.44 2jfn n LEU 173 Cb 0.25 -0.35 0.24 0.00 -2.33 0.00 0.00 43.42 41.23 2jfn n LEU 173 CO 0.17 -0.11 0.58 1.41 -1.33 0.00 0.00 177.39 178.12 2jfn n HIS 174 N -1.35 0.00 0.00 -1.77 8.25 -0.13 -4.76 115.22 115.46 2jfn n HIS 174 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2jfn n HIS 174 Cb 0.18 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.25 2jfn n HIS 174 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jfn n GLY 175 N 1.34 0.74 3.87 -1.41 0.00 -0.75 -4.92 105.19 104.05 2jfn n GLY 175 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2jfn n GLY 175 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jfn s GLU 176 N -0.51 3.82 0.18 1.61 8.01 -0.44 -4.99 118.70 126.37 2jfn s GLU 176 Ca 0.00 0.31 -0.24 0.00 0.01 0.00 0.00 54.97 55.05 2jfn s GLU 176 Cb 0.00 -2.64 -0.08 0.00 -4.31 0.00 0.00 34.13 27.10 2jfn s GLU 176 CO 0.00 0.31 0.76 -0.51 0.01 0.00 0.00 175.26 175.83 2jfn s ASP 177 N -2.33 7.31 -0.08 -0.19 1.01 -1.26 -3.55 116.67 117.57 2jfn s ASP 177 Ca 0.48 1.59 -0.30 0.00 0.71 0.00 0.00 52.55 55.03 2jfn s ASP 177 Cb -0.11 -2.48 -0.02 0.00 1.01 0.00 0.00 42.92 41.32 2jfn s ASP 177 CO 0.21 0.17 1.03 -0.69 0.21 0.00 0.00 175.17 176.10 2jfn s VAL 178 N -1.23 4.72 -0.35 -1.27 1.01 -1.26 -4.92 120.40 117.10 2jfn s VAL 178 Ca 0.37 1.98 -0.29 0.00 0.00 0.00 0.00 61.98 64.05 2jfn s VAL 178 Cb -0.22 -4.27 0.01 0.00 0.00 0.00 0.00 36.38 31.90 2jfn s VAL 178 CO 0.25 0.03 1.25 -0.55 0.00 0.00 0.00 175.10 176.08 2jfn s SER 179 N 1.12 6.67 0.42 3.32 0.15 -1.26 -4.89 113.70 119.23 2jfn s SER 179 Ca 0.50 1.00 0.13 0.00 0.70 0.00 0.00 55.95 58.28 2jfn s SER 179 Cb -0.20 -2.54 0.90 0.00 -1.71 0.00 0.00 66.02 62.47 2jfn s SER 179 CO 0.20 -1.12 1.94 -0.07 1.20 0.00 0.00 173.24 175.39 2jfn h LEU 180 N 10.97 0.04 -0.99 3.45 3.38 -1.98 -2.13 115.31 128.05 2jfn h LEU 180 Ca -0.25 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.64 2jfn h LEU 180 Cb 1.09 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 2jfn h LEU 180 CO 1.06 0.26 -0.04 0.44 0.09 0.00 0.00 178.44 180.25 2jfn h ASP 181 N 0.04 0.66 -0.59 -0.43 3.32 -1.99 -0.17 116.42 117.27 2jfn h ASP 181 Ca 0.01 -0.16 -0.07 0.00 0.02 0.00 0.00 57.03 56.83 2jfn h ASP 181 Cb 0.40 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 2jfn h ASP 181 CO 0.03 0.75 0.09 0.00 -1.72 0.00 0.00 179.24 178.39 2jfn h ALA 182 N 1.32 0.78 -0.34 3.45 0.00 -1.80 -1.88 119.26 120.79 2jfn h ALA 182 Ca 0.12 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2jfn h ALA 182 Cb 0.45 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2jfn h ALA 182 CO 0.02 0.53 0.11 -0.07 0.00 0.00 0.00 179.25 179.84 2jfn h LEU 183 N 0.88 0.50 -1.21 0.00 3.38 -1.13 -1.61 115.31 116.11 2jfn h LEU 183 Ca 0.18 -0.21 0.03 0.00 0.09 0.00 0.00 57.88 57.97 2jfn h LEU 183 Cb 0.42 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 2jfn h LEU 183 CO 0.01 0.57 0.55 0.11 0.09 0.00 0.00 178.44 179.77 2jfn h LYS 184 N 0.40 1.00 -0.14 1.13 1.57 -0.89 0.74 116.57 120.39 2jfn h LYS 184 Ca 0.11 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 2jfn h LYS 184 Cb 0.25 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 2jfn h LYS 184 CO -0.00 0.66 0.02 -0.09 -0.57 0.00 0.00 179.45 179.47 2jfn h ARG 185 N 1.03 0.24 -0.91 3.15 9.65 -1.08 0.20 114.38 126.66 2jfn h ARG 185 Ca 0.33 -0.07 0.01 0.00 -1.10 0.00 0.00 59.98 59.16 2jfn h ARG 185 Cb 0.02 -0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 28.53 2jfn h ARG 185 CO -0.09 0.44 0.60 0.82 2.80 0.00 0.00 179.97 184.53 2jfn h ILE 186 N 0.00 1.21 -0.19 1.20 2.04 -0.64 -2.17 117.51 118.95 2jfn h ILE 186 Ca 0.04 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.49 2jfn h ILE 186 Cb 0.32 -0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 2jfn h ILE 186 CO 0.00 0.22 0.00 0.18 0.00 0.00 0.00 178.15 178.55 2jfn n LEU 187 N -4.47 1.65 -0.25 1.44 4.77 0.19 -4.44 117.00 115.90 2jfn n LEU 187 Ca 0.10 -0.71 0.04 0.00 -0.03 0.00 0.00 56.01 55.41 2jfn n LEU 187 Cb 0.03 -0.12 0.14 0.00 -2.33 0.00 0.00 43.42 41.14 2jfn n LEU 187 CO 0.36 0.36 0.82 -0.09 -1.33 0.00 0.00 177.39 177.51 2jfn h ARG 188 N 2.12 0.10 -0.79 3.23 2.43 0.08 -0.10 114.38 121.45 2jfn h ARG 188 Ca 0.00 -0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.34 2jfn h ARG 188 Cb 0.47 -0.02 -0.12 0.00 -0.42 0.00 0.00 29.97 29.88 2jfn h ARG 188 CO 0.00 0.07 0.21 -1.35 -1.51 0.00 0.00 179.97 177.39 2jfn h PRO 189 N 0.11 0.27 -0.09 0.20 0.11 -1.81 -0.77 132.00 130.01 2jfn h PRO 189 Ca 0.39 -0.02 -0.22 0.00 0.11 0.00 0.00 66.00 66.26 2jfn h PRO 189 Cb 0.68 -0.06 0.01 0.00 0.11 0.00 0.00 31.00 31.73 2jfn h PRO 189 CO -0.64 0.18 -0.84 -1.49 -0.21 0.00 0.00 178.00 175.00 2jfn h TRP 190 N 0.28 0.91 0.00 0.65 4.06 -1.40 -3.10 115.95 117.35 2jfn h TRP 190 Ca 0.46 -0.43 0.00 0.00 2.06 0.00 0.00 58.89 60.98 2jfn h TRP 190 Cb 0.82 -0.13 0.00 0.00 -1.00 0.00 0.00 29.16 28.85 2jfn h TRP 190 CO -0.25 1.25 0.00 -0.07 -3.56 0.00 0.00 178.44 175.80 2jfn h LEU 191 N 0.43 0.00 -2.13 -4.49 3.38 -0.05 -2.14 115.31 110.30 2jfn h LEU 191 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2jfn h LEU 191 Cb 1.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.21 2jfn h LEU 191 CO 0.16 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.23 2jfn n ARG 192 N -2.33 2.39 -2.96 1.13 1.74 -0.42 -4.95 116.66 111.25 2jfn n ARG 192 Ca 0.01 -2.10 -0.37 0.00 -0.77 0.00 0.00 57.85 54.62 2jfn n ARG 192 Cb 0.19 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.07 2jfn n ARG 192 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2jfn s MET 193 N -1.52 4.46 0.08 5.56 -1.94 -0.81 -4.97 119.30 120.16 2jfn s MET 193 Ca 0.38 1.11 -0.22 0.00 -1.71 0.00 0.00 55.69 55.25 2jfn s MET 193 Cb 0.22 -2.97 -0.14 0.00 2.01 0.00 0.00 34.83 33.95 2jfn s MET 193 CO 0.31 0.41 1.66 -0.22 -0.01 0.00 0.00 175.02 177.16 2jfn h LYS 194 N 3.61 0.09 -3.23 2.03 3.64 -1.92 -3.36 116.57 117.43 2jfn h LYS 194 Ca -0.47 -0.01 -0.62 0.00 -1.27 0.00 0.00 60.65 58.28 2jfn h LYS 194 Cb 1.20 -0.02 -0.40 0.00 -0.41 0.00 0.00 32.23 32.60 2jfn h LYS 194 CO 0.65 0.16 -0.71 -2.00 -2.27 0.00 0.00 179.45 175.28 2jfn s GLU 195 N -5.78 1.41 0.94 1.90 2.12 -1.26 -5.12 118.70 112.91 2jfn s GLU 195 Ca -0.14 -2.07 -0.12 0.00 0.36 0.00 0.00 54.97 53.01 2jfn s GLU 195 Cb 0.06 -2.59 0.15 0.00 0.26 0.00 0.00 34.13 32.01 2jfn s GLU 195 CO 0.68 -1.12 1.09 -1.25 -0.54 0.00 0.00 175.26 174.12 2jfn s PRO 196 N 0.34 0.93 0.38 4.30 0.04 -1.26 -4.95 135.00 134.78 2jfn s PRO 196 Ca 0.16 0.70 -0.28 0.00 0.04 0.00 0.00 61.00 61.63 2jfn s PRO 196 Cb -0.24 -1.78 -0.11 0.00 0.04 0.00 0.00 34.50 32.41 2jfn s PRO 196 CO -0.02 -2.44 1.45 -2.30 0.04 0.00 0.00 177.00 173.72 2jfn n PRO 197 N -4.00 2.54 0.00 0.56 -0.02 -1.26 -4.88 135.00 127.94 2jfn n PRO 197 Ca 0.06 0.89 0.12 0.00 -2.02 0.00 0.00 63.50 62.55 2jfn n PRO 197 Cb 0.56 -2.60 0.17 0.00 -0.02 0.00 0.00 33.50 31.61 2jfn n PRO 197 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2jfn n ASP 198 N 0.45 1.21 -3.81 2.55 5.75 -0.92 -4.81 116.55 116.99 2jfn n ASP 198 Ca 0.02 -0.97 -0.21 0.00 -0.01 0.00 0.00 54.79 53.63 2jfn n ASP 198 Cb 0.39 0.39 -0.17 0.00 -1.03 0.00 0.00 41.12 40.69 2jfn n ASP 198 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2jfn s THR 199 N -2.66 0.35 -0.16 2.12 2.01 -1.24 -1.04 115.64 115.02 2jfn s THR 199 Ca 0.18 0.06 0.02 0.00 0.31 0.00 0.00 61.69 62.26 2jfn s THR 199 Cb 0.18 -0.46 0.02 0.00 0.01 0.00 0.00 72.50 72.24 2jfn s THR 199 CO 0.62 0.22 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.87 2jfn s VAL 200 N 1.47 2.07 -0.14 3.82 1.01 0.55 -0.55 120.40 128.63 2jfn s VAL 200 Ca -0.03 -0.95 -0.22 0.00 0.00 0.00 0.00 61.98 60.78 2jfn s VAL 200 Cb -0.13 -1.85 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 2jfn s VAL 200 CO -0.03 0.54 0.67 -0.69 0.00 0.00 0.00 175.10 175.60 2jfn s VAL 201 N 1.10 5.02 -0.68 2.92 1.01 0.10 -0.83 120.40 129.05 2jfn s VAL 201 Ca 0.00 1.33 -0.20 0.00 0.00 0.00 0.00 61.98 63.11 2jfn s VAL 201 Cb -0.14 -4.00 0.10 0.00 0.00 0.00 0.00 36.38 32.34 2jfn s VAL 201 CO -0.09 0.16 0.88 -0.76 0.00 0.00 0.00 175.10 175.30 2jfn s LEU 202 N 1.46 4.95 -0.26 3.92 1.43 0.38 -1.04 118.68 129.52 2jfn s LEU 202 Ca 0.33 -1.38 0.05 0.00 -1.03 0.00 0.00 54.13 52.11 2jfn s LEU 202 Cb -0.16 -2.36 0.51 0.00 0.03 0.00 0.00 46.19 44.20 2jfn s LEU 202 CO 0.13 -1.23 1.55 0.61 0.23 0.00 0.00 176.35 177.64 2jfn n GLY 203 N 5.29 3.33 2.81 -3.19 0.00 0.12 -4.64 105.19 108.92 2jfn n GLY 203 Ca -0.01 -0.72 -0.16 0.00 0.00 0.00 0.00 46.02 45.12 2jfn n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jfn n THR 205 N 4.78 1.36 0.09 0.00 -2.24 -1.26 -1.33 114.28 115.67 2jfn n THR 205 Ca -0.15 0.52 -0.08 0.00 -2.27 0.00 0.00 64.05 62.07 2jfn n THR 205 Cb 0.50 -1.48 -0.01 0.00 -2.10 0.00 0.00 70.33 67.24 2jfn n THR 205 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2jfn h HIS 206 N 0.00 0.21 -0.85 4.78 3.86 -1.92 -3.37 115.15 117.86 2jfn h HIS 206 Ca 0.00 -0.12 -0.03 0.00 -1.16 0.00 0.00 60.37 59.06 2jfn h HIS 206 Cb 0.08 -0.02 -0.04 0.00 1.06 0.00 0.00 27.41 28.49 2jfn h HIS 206 CO 0.00 0.95 0.41 0.74 0.86 0.00 0.00 177.93 180.89 2jfn h PHE 207 N 0.07 1.22 -0.20 2.45 0.05 -1.57 -2.58 116.94 116.39 2jfn h PHE 207 Ca -0.04 -0.06 0.06 0.00 3.82 0.00 0.00 57.97 61.75 2jfn h PHE 207 Cb 1.52 -0.38 -0.01 0.00 2.00 0.00 0.00 35.95 39.08 2jfn h PHE 207 CO 0.02 0.88 0.22 -1.35 -0.18 0.00 0.00 178.31 177.90 2jfn h PRO 208 N 1.21 0.00 0.00 1.51 0.11 -1.72 0.37 132.00 133.48 2jfn h PRO 208 Ca 0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.40 2jfn h PRO 208 Cb 0.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.22 2jfn h PRO 208 CO -0.04 0.00 0.00 -0.07 -0.21 0.00 0.00 178.00 177.68 2jfn h LEU 209 N 0.00 0.00 -3.09 2.35 3.38 -1.70 -1.64 115.31 114.62 2jfn h LEU 209 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2jfn h LEU 209 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2jfn h LEU 209 CO -0.00 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.71 2jfn n LEU 210 N -2.87 4.02 -0.21 1.67 4.77 0.13 -4.74 117.00 119.78 2jfn n LEU 210 Ca -0.01 -2.45 -0.03 0.00 -0.03 0.00 0.00 56.01 53.50 2jfn n LEU 210 Cb 0.18 -0.47 0.04 0.00 -2.33 0.00 0.00 43.42 40.83 2jfn n LEU 210 CO 0.21 0.76 0.68 -0.61 -1.33 0.00 0.00 177.39 177.10 2jfn h GLN 211 N 2.96 -0.09 -0.08 3.23 4.15 -1.26 0.16 115.11 124.19 2jfn h GLN 211 Ca 0.00 0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.46 2jfn h GLN 211 Cb 1.24 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.91 2jfn h GLN 211 CO 0.16 -0.06 -0.11 1.49 -1.93 0.00 0.00 178.83 178.38 2jfn h GLU 212 N -0.09 -0.15 -0.65 1.69 4.81 -1.85 -0.50 114.58 117.84 2jfn h GLU 212 Ca 0.27 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.52 2jfn h GLU 212 Cb 0.52 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.90 2jfn h GLU 212 CO -0.68 -0.10 0.43 0.93 -0.73 0.00 0.00 179.01 178.87 2jfn h GLU 213 N -0.15 0.85 -0.85 1.92 3.07 -1.70 -2.51 114.58 115.20 2jfn h GLU 213 Ca 0.07 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.87 2jfn h GLU 213 Cb 0.25 -0.19 -0.04 0.00 -0.84 0.00 0.00 28.75 27.93 2jfn h GLU 213 CO -0.17 0.56 0.50 -0.07 -1.40 0.00 0.00 179.01 178.44 2jfn h LEU 214 N 0.88 1.03 -1.63 1.33 3.38 -0.26 -2.10 115.31 117.94 2jfn h LEU 214 Ca 0.24 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 2jfn h LEU 214 Cb -0.10 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.39 2jfn h LEU 214 CO -0.05 0.80 -0.03 -0.07 0.09 0.00 0.00 178.44 179.19 2jfn h LEU 215 N 1.17 0.00 0.00 1.67 3.38 -0.75 0.12 115.31 120.90 2jfn h LEU 215 Ca 0.30 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.09 2jfn h LEU 215 Cb -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2jfn h LEU 215 CO -0.06 0.03 -0.95 1.56 0.09 0.00 0.00 178.44 179.11 2jfn h GLN 216 N 0.00 0.00 0.08 1.13 4.20 -0.97 -3.37 115.11 116.18 2jfn h GLN 216 Ca -0.00 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.34 2jfn h GLN 216 Cb 0.46 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.21 2jfn h GLN 216 CO 0.00 0.76 -2.15 0.28 -0.67 0.00 0.00 178.83 177.05 2jfn n VAL 217 N -3.26 1.68 -2.20 -0.54 0.31 -0.96 -4.97 118.33 108.39 2jfn n VAL 217 Ca -0.02 -0.64 -0.36 0.00 -0.01 0.00 0.00 64.34 63.32 2jfn n VAL 217 Cb 0.88 -1.58 0.01 0.00 -0.91 0.00 0.00 33.84 32.24 2jfn n VAL 217 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2jfn s LEU 218 N -6.81 3.79 0.38 7.52 1.43 0.37 -4.96 118.68 120.40 2jfn s LEU 218 Ca -0.25 2.26 -0.27 0.00 -1.03 0.00 0.00 54.13 54.84 2jfn s LEU 218 Cb 0.07 -4.51 -0.11 0.00 0.03 0.00 0.00 46.19 41.67 2jfn s LEU 218 CO 0.72 -1.24 1.25 -0.81 0.23 0.00 0.00 176.35 176.50 2jfn n PRO 219 N -1.19 1.95 -1.45 1.29 -0.04 -1.26 -4.88 135.00 129.42 2jfn n PRO 219 Ca 0.11 0.69 -0.42 0.00 -0.04 0.00 0.00 63.50 63.84 2jfn n PRO 219 Cb 0.50 -2.31 0.00 0.00 -0.04 0.00 0.00 33.50 31.65 2jfn n PRO 219 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2jfn n GLU 220 N 0.29 0.57 -0.74 0.54 1.02 -1.26 -2.33 120.64 118.73 2jfn n GLU 220 Ca 0.06 0.21 0.00 0.00 -0.02 0.00 0.00 57.16 57.41 2jfn n GLU 220 Cb 0.38 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 2jfn n GLU 220 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jfn n GLY 221 N 1.78 1.25 3.71 0.62 0.00 -1.26 -5.01 105.19 106.27 2jfn n GLY 221 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2jfn n GLY 221 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jfn s THR 222 N -3.64 3.97 -0.23 2.61 2.01 -0.98 -4.87 115.64 114.50 2jfn s THR 222 Ca 0.00 1.39 -0.10 0.00 0.31 0.00 0.00 61.69 63.29 2jfn s THR 222 Cb 0.00 -3.89 -0.05 0.00 0.01 0.00 0.00 72.50 68.57 2jfn s THR 222 CO 0.00 0.08 0.14 -0.60 -0.69 0.00 0.00 174.62 173.55 2jfn s ARG 223 N 1.35 4.05 -0.01 4.92 3.52 -0.21 -4.96 118.95 127.62 2jfn s ARG 223 Ca 0.59 -0.28 -0.19 0.00 -0.13 0.00 0.00 55.73 55.72 2jfn s ARG 223 Cb -0.30 -3.47 -0.05 0.00 -1.56 0.00 0.00 34.95 29.57 2jfn s ARG 223 CO 0.28 0.11 0.53 -0.51 -0.81 0.00 0.00 175.30 174.90 2jfn s LEU 224 N 0.91 4.42 -0.06 -0.88 1.43 -1.26 -0.33 118.68 122.91 2jfn s LEU 224 Ca 0.07 1.07 0.02 0.00 -1.03 0.00 0.00 54.13 54.27 2jfn s LEU 224 Cb -0.13 -2.81 0.01 0.00 0.03 0.00 0.00 46.19 43.29 2jfn s LEU 224 CO 0.03 0.16 -0.12 -0.69 0.23 0.00 0.00 176.35 175.96 2jfn s VAL 225 N -0.37 1.07 0.28 -1.59 1.01 -0.01 -4.93 120.40 115.86 2jfn s VAL 225 Ca 0.28 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.86 2jfn s VAL 225 Cb -0.18 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.21 2jfn s VAL 225 CO 0.15 0.34 0.20 -0.90 0.00 0.00 0.00 175.10 174.89 2jfn n ASP 226 N 3.69 -0.22 -0.40 3.32 5.68 -1.26 -0.47 116.55 126.90 2jfn n ASP 226 Ca -0.22 -2.75 0.12 0.00 -0.50 0.00 0.00 54.79 51.44 2jfn n ASP 226 Cb 0.52 1.24 0.16 0.00 -1.14 0.00 0.00 41.12 41.90 2jfn n ASP 226 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2jfn n SER 227 N -1.89 1.61 -0.12 -1.12 7.64 -1.26 -4.74 113.62 113.75 2jfn n SER 227 Ca 0.04 -1.26 -0.07 0.00 1.01 0.00 0.00 58.87 58.59 2jfn n SER 227 Cb 0.49 0.33 -0.05 0.00 -1.01 0.00 0.00 64.21 63.96 2jfn n SER 227 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2jfn h GLY 228 N 4.88 -1.54 1.27 0.23 0.00 -1.93 0.03 103.07 106.01 2jfn h GLY 228 Ca 0.00 0.84 -0.01 0.00 0.00 0.00 0.00 47.33 48.16 2jfn h GLY 228 CO 0.00 -0.43 0.42 0.00 0.00 0.00 0.00 176.54 176.53 2jfn h ALA 229 N -0.49 1.40 -0.17 3.60 0.00 -1.92 -1.51 119.26 120.17 2jfn h ALA 229 Ca 0.05 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 2jfn h ALA 229 Cb 0.29 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2jfn h ALA 229 CO -0.38 0.51 -0.31 0.00 0.00 0.00 0.00 179.25 179.08 2jfn h ALA 230 N 1.48 1.17 -0.38 0.00 0.00 -1.78 -1.35 119.26 118.40 2jfn h ALA 230 Ca 0.25 -0.36 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 2jfn h ALA 230 Cb -0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2jfn h ALA 230 CO -0.05 0.54 -0.29 0.82 0.00 0.00 0.00 179.25 180.27 2jfn h ILE 231 N 0.28 1.28 0.03 0.00 1.08 -0.41 -0.86 117.51 118.91 2jfn h ILE 231 Ca 0.04 -1.46 0.01 0.00 -0.39 0.00 0.00 64.86 63.06 2jfn h ILE 231 Cb 0.70 1.37 -0.01 0.00 -3.07 0.00 0.00 36.82 35.80 2jfn h ILE 231 CO 0.05 0.49 -0.06 0.00 -0.69 0.00 0.00 178.15 177.94 2jfn h ALA 232 N 0.78 -0.09 -0.78 1.87 0.00 -0.95 0.14 119.26 120.23 2jfn h ALA 232 Ca 0.07 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.00 2jfn h ALA 232 Cb 0.87 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 2jfn h ALA 232 CO 0.08 -0.56 0.51 0.00 0.00 0.00 0.00 179.25 179.27 2jfn h ARG 233 N -0.12 0.99 -0.45 0.00 3.08 -1.14 -0.22 114.38 116.52 2jfn h ARG 233 Ca 0.02 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 2jfn h ARG 233 Cb 0.14 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 2jfn h ARG 233 CO -0.05 0.66 0.05 -0.09 -1.07 0.00 0.00 179.97 179.47 2jfn h ARG 234 N 1.02 0.71 -0.25 0.04 9.65 -0.73 -1.22 114.38 123.60 2jfn h ARG 234 Ca 0.30 -0.16 -0.04 0.00 -1.10 0.00 0.00 59.98 58.98 2jfn h ARG 234 Cb -0.06 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.41 2jfn h ARG 234 CO -0.09 0.70 0.01 1.15 2.80 0.00 0.00 179.97 184.54 2jfn h THR 235 N 0.68 1.25 -0.65 0.20 2.02 0.13 -1.31 112.91 115.24 2jfn h THR 235 Ca 0.14 -0.88 -0.03 0.00 0.77 0.00 0.00 66.41 66.42 2jfn h THR 235 Cb 0.35 1.33 -0.03 0.00 -1.74 0.00 0.00 68.15 68.07 2jfn h THR 235 CO 0.01 0.28 0.30 0.00 0.37 0.00 0.00 175.52 176.47 2jfn h ALA 236 N 0.82 1.30 -0.43 6.16 0.00 -0.82 -0.39 119.26 125.90 2jfn h ALA 236 Ca 0.07 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 2jfn h ALA 236 Cb 0.40 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2jfn h ALA 236 CO 0.01 0.53 -0.14 2.35 0.00 0.00 0.00 179.25 182.01 2jfn h TRP 237 N 0.92 0.97 -0.21 0.00 7.01 -1.00 -2.83 115.95 120.81 2jfn h TRP 237 Ca 0.22 -0.22 -0.13 0.00 2.11 0.00 0.00 58.89 60.88 2jfn h TRP 237 Cb 0.12 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 26.94 2jfn h TRP 237 CO 0.01 0.98 -0.41 -0.07 -2.79 0.00 0.00 178.44 176.16 2jfn h LEU 238 N 0.68 0.53 -1.61 0.65 3.38 -0.87 -0.05 115.31 118.01 2jfn h LEU 238 Ca 0.11 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2jfn h LEU 238 Cb 0.68 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2jfn h LEU 238 CO 0.05 0.88 0.00 -0.07 0.09 0.00 0.00 178.44 179.39 2jfn h LEU 239 N 0.41 0.00 0.05 1.67 3.38 -1.01 0.13 115.31 119.94 2jfn h LEU 239 Ca 0.04 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.64 2jfn h LEU 239 Cb 0.89 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.60 2jfn h LEU 239 CO 0.08 0.00 -2.16 -0.62 0.09 0.00 0.00 178.44 175.82 2jfn n GLU 240 N -2.88 0.70 0.00 1.13 -0.58 -0.83 -4.48 120.64 113.69 2jfn n GLU 240 Ca 0.00 0.20 0.04 0.00 -0.42 0.00 0.00 57.16 56.98 2jfn n GLU 240 Cb 0.23 -1.64 0.02 0.00 -0.57 0.00 0.00 31.44 29.49 2jfn n GLU 240 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2jfn n HIS 241 N -3.25 0.00 0.00 -0.32 8.25 -0.09 -4.88 115.22 114.93 2jfn n HIS 241 Ca -0.34 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.12 2jfn n HIS 241 Cb 1.04 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.15 2jfn n HIS 241 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2jfn n GLU 242 N 0.24 0.77 -1.98 -0.41 1.02 0.11 -5.03 120.64 115.35 2jfn n GLU 242 Ca 0.04 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.77 2jfn n GLU 242 Cb 0.19 -0.36 -0.02 0.00 -0.02 0.00 0.00 31.44 31.23 2jfn n GLU 242 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jfn s ALA 243 N -0.82 3.67 0.75 0.62 0.00 0.22 -4.69 121.76 121.51 2jfn s ALA 243 Ca 0.00 1.34 -0.11 0.00 0.00 0.00 0.00 51.96 53.20 2jfn s ALA 243 Cb 0.00 -3.58 0.04 0.00 0.00 0.00 0.00 23.12 19.58 2jfn s ALA 243 CO 0.00 -0.76 1.08 -1.25 0.00 0.00 0.00 175.76 174.83 2jfn s PRO 244 N 0.09 2.48 -0.89 0.00 0.04 -1.26 -4.88 135.00 130.58 2jfn s PRO 244 Ca 0.63 0.92 -0.18 0.00 0.04 0.00 0.00 61.00 62.41 2jfn s PRO 244 Cb -0.42 -1.94 -0.12 0.00 0.04 0.00 0.00 34.50 32.06 2jfn s PRO 244 CO 0.40 -1.41 2.01 -3.47 0.04 0.00 0.00 177.00 174.56 2jfn n ASP 245 N -3.34 3.21 -4.23 6.66 4.64 -1.26 -4.63 116.55 117.59 2jfn n ASP 245 Ca 0.08 -2.63 -0.39 0.00 -1.38 0.00 0.00 54.79 50.47 2jfn n ASP 245 Cb 0.54 -1.18 -0.11 0.00 -1.04 0.00 0.00 41.12 39.33 2jfn n ASP 245 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2jfn s ALA 246 N 4.46 3.18 0.15 -1.67 0.00 -1.26 -5.07 121.76 121.55 2jfn s ALA 246 Ca 0.53 -2.12 0.01 0.00 0.00 0.00 0.00 51.96 50.38 2jfn s ALA 246 Cb 0.14 -2.48 -0.04 0.00 0.00 0.00 0.00 23.12 20.73 2jfn s ALA 246 CO 0.06 -1.59 -0.00 -1.59 0.00 0.00 0.00 175.76 172.64 2jfn s LYS 247 N 1.35 1.01 0.05 0.00 -2.85 -1.26 -0.90 119.74 117.14 2jfn s LYS 247 Ca 0.02 -1.47 -0.15 0.00 -1.00 0.00 0.00 55.97 53.37 2jfn s LYS 247 Cb -0.22 -0.16 0.02 0.00 -2.06 0.00 0.00 37.83 35.41 2jfn s LYS 247 CO 0.01 -0.13 0.33 0.45 0.10 0.00 0.00 175.35 176.11 2jfn s SER 248 N -3.12 -0.16 0.00 0.03 0.15 -0.36 -4.82 113.70 105.41 2jfn s SER 248 Ca 0.21 -0.17 0.21 0.00 0.70 0.00 0.00 55.95 56.91 2jfn s SER 248 Cb 0.06 0.38 -0.04 0.00 -1.71 0.00 0.00 66.02 64.71 2jfn s SER 248 CO 0.02 -0.65 1.02 0.00 1.20 0.00 0.00 173.24 174.83 2jfn n ALA 249 N 0.48 3.68 -1.12 5.45 0.00 -1.26 -1.51 120.51 126.23 2jfn n ALA 249 Ca -0.18 -0.62 -0.33 0.00 0.00 0.00 0.00 53.44 52.31 2jfn n ALA 249 Cb 0.60 -0.75 0.12 0.00 0.00 0.00 0.00 19.45 19.42 2jfn n ALA 249 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2jfn s ASP 250 N -2.46 3.80 0.80 0.00 1.01 -1.26 -4.91 116.67 113.64 2jfn s ASP 250 Ca 0.16 2.24 -0.11 0.00 0.71 0.00 0.00 52.55 55.55 2jfn s ASP 250 Cb 0.17 -2.57 0.07 0.00 1.01 0.00 0.00 42.92 41.59 2jfn s ASP 250 CO 0.59 -2.52 1.09 0.00 0.21 0.00 0.00 175.17 174.54 2jfn s ALA 251 N -2.30 2.21 0.49 5.23 0.00 -1.26 -4.90 121.76 121.23 2jfn s ALA 251 Ca 0.70 -0.11 -0.24 0.00 0.00 0.00 0.00 51.96 52.31 2jfn s ALA 251 Cb -0.26 -3.14 -0.07 0.00 0.00 0.00 0.00 23.12 19.65 2jfn s ALA 251 CO 0.51 -1.75 1.41 -0.80 0.00 0.00 0.00 175.76 175.13 2jfn s ASN 252 N -3.79 5.61 0.02 0.00 0.01 -1.26 -4.88 114.94 110.66 2jfn s ASN 252 Ca 0.61 2.88 0.01 0.00 -0.71 0.00 0.00 52.86 55.65 2jfn s ASN 252 Cb -0.15 -2.65 -0.02 0.00 0.41 0.00 0.00 41.25 38.84 2jfn s ASN 252 CO 0.55 -1.35 -0.05 -0.51 -1.51 0.00 0.00 177.10 174.23 2jfn s ILE 253 N -1.23 0.28 -0.07 0.60 2.07 -0.76 -3.67 121.20 118.42 2jfn s ILE 253 Ca 0.65 -0.85 0.02 0.00 -1.41 0.00 0.00 60.65 59.06 2jfn s ILE 253 Cb -0.43 -0.38 -0.03 0.00 0.13 0.00 0.00 42.46 41.76 2jfn s ILE 253 CO 0.54 -0.37 -0.11 0.00 -1.91 0.00 0.00 174.94 173.08 2jfn s ALA 254 N -1.22 2.79 -0.08 1.50 0.00 -0.16 -1.14 121.76 123.44 2jfn s ALA 254 Ca -0.11 -0.93 0.04 0.00 0.00 0.00 0.00 51.96 50.96 2jfn s ALA 254 Cb -0.09 -1.12 -0.01 0.00 0.00 0.00 0.00 23.12 21.90 2jfn s ALA 254 CO -0.00 0.50 -0.21 -0.06 0.00 0.00 0.00 175.76 175.99 2jfn s PHE 255 N -0.56 2.58 0.34 0.00 2.99 0.24 -0.85 117.98 122.73 2jfn s PHE 255 Ca 0.08 -0.72 0.09 0.00 0.00 0.00 0.00 56.93 56.37 2jfn s PHE 255 Cb -0.12 -1.68 -0.05 0.00 0.00 0.00 0.00 43.02 41.17 2jfn s PHE 255 CO 0.02 -0.22 0.06 0.00 -0.00 0.00 0.00 175.22 175.08 2jfn n MET 257 N -1.03 0.09 -3.67 0.00 0.00 -1.21 -0.67 117.12 110.62 2jfn n MET 257 Ca -0.04 0.00 -0.09 0.00 0.00 0.00 0.00 57.70 57.58 2jfn n MET 257 Cb 0.62 -1.54 -0.09 0.00 0.00 0.00 0.00 33.22 32.21 2jfn n MET 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2jfn s ALA 258 N -3.06 -1.37 -1.28 3.04 0.00 -1.26 -4.68 121.76 113.15 2jfn s ALA 258 Ca 0.08 1.87 -0.18 0.00 0.00 0.00 0.00 51.96 53.73 2jfn s ALA 258 Cb 0.16 -1.14 0.07 0.00 0.00 0.00 0.00 23.12 22.21 2jfn s ALA 258 CO 0.76 -0.34 1.71 1.41 0.00 0.00 0.00 175.76 179.30 2jfn s MET 259 N 1.56 3.96 0.40 0.00 1.75 -1.26 -4.75 119.30 120.96 2jfn s MET 259 Ca -0.09 -1.95 0.08 0.00 -1.25 0.00 0.00 55.69 52.47 2jfn s MET 259 Cb -0.07 -5.51 -0.01 0.00 2.84 0.00 0.00 34.83 32.08 2jfn s MET 259 CO -0.16 -2.24 0.45 0.95 -0.65 0.00 0.00 175.02 173.37 2jfn s THR 260 N 4.21 3.04 0.27 10.11 -4.23 -1.26 -4.96 115.64 122.82 2jfn s THR 260 Ca 0.53 -1.18 -0.04 0.00 -1.18 0.00 0.00 61.69 59.82 2jfn s THR 260 Cb 0.03 -3.07 0.22 0.00 1.34 0.00 0.00 72.50 71.02 2jfn s THR 260 CO 0.06 -0.04 1.89 -0.65 -0.54 0.00 0.00 174.62 175.35 2jfn h PRO 261 N 0.90 1.10 -0.27 3.99 0.11 -1.99 -0.83 132.00 135.01 2jfn h PRO 261 Ca -0.42 -0.12 0.01 0.00 0.11 0.00 0.00 66.00 65.58 2jfn h PRO 261 Cb 1.27 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 2jfn h PRO 261 CO 0.52 0.81 0.14 0.78 -0.21 0.00 0.00 178.00 180.04 2jfn h GLY 262 N 1.13 0.36 1.00 -0.55 0.00 -1.95 -0.06 103.07 103.00 2jfn h GLY 262 Ca 0.28 -0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.46 2jfn h GLY 262 CO -0.04 0.09 0.16 0.00 0.00 0.00 0.00 176.54 176.75 2jfn h ALA 263 N 1.13 0.74 -0.39 3.60 0.00 -1.78 -2.82 119.26 119.74 2jfn h ALA 263 Ca 0.11 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2jfn h ALA 263 Cb 0.02 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2jfn h ALA 263 CO -0.07 0.41 0.12 0.93 0.00 0.00 0.00 179.25 180.64 2jfn h GLU 264 N 0.79 0.56 0.00 0.00 5.08 -0.80 -1.99 114.58 118.22 2jfn h GLU 264 Ca 0.18 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2jfn h GLU 264 Cb 0.30 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.45 2jfn h GLU 264 CO -0.00 0.50 0.00 1.04 -1.00 0.00 0.00 179.01 179.55 2jfn n GLN 265 N -4.35 0.10 0.00 2.33 6.02 -0.07 -1.41 117.38 120.00 2jfn n GLN 265 Ca 0.02 0.47 0.13 0.00 -0.01 0.00 0.00 57.00 57.61 2jfn n GLN 265 Cb 0.17 -1.74 0.35 0.00 1.02 0.00 0.00 30.24 30.04 2jfn n GLN 265 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2jfn n LEU 266 N -1.94 0.36 -0.20 1.08 4.77 -0.75 -4.45 117.00 115.88 2jfn n LEU 266 Ca 0.01 0.14 -0.05 0.00 -0.03 0.00 0.00 56.01 56.08 2jfn n LEU 266 Cb 0.11 -0.32 0.01 0.00 -2.33 0.00 0.00 43.42 40.88 2jfn n LEU 266 CO 0.11 0.09 0.64 0.25 -1.33 0.00 0.00 177.39 177.14 2jfn h LEU 267 N 0.00 -1.13 -0.86 2.23 5.85 -1.36 0.15 115.31 120.19 2jfn h LEU 267 Ca 0.00 0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.98 2jfn h LEU 267 Cb 0.50 0.56 -0.05 0.00 0.37 0.00 0.00 40.66 42.04 2jfn h LEU 267 CO 0.00 -0.30 0.55 1.55 -0.34 0.00 0.00 178.44 179.90 2jfn h PRO 268 N -0.16 1.03 -0.24 5.25 0.13 -1.83 0.36 132.00 136.54 2jfn h PRO 268 Ca 0.23 -0.06 -0.08 0.00 -0.87 0.00 0.00 66.00 65.22 2jfn h PRO 268 Cb 0.55 -0.23 -0.00 0.00 0.13 0.00 0.00 31.00 31.44 2jfn h PRO 268 CO -0.67 0.68 -0.18 0.28 -0.23 0.00 0.00 178.00 177.88 2jfn h VAL 269 N 1.06 1.31 -0.99 1.56 2.07 -1.64 -1.33 116.25 118.30 2jfn h VAL 269 Ca 0.35 -1.30 0.07 0.00 0.82 0.00 0.00 66.70 66.63 2jfn h VAL 269 Cb 0.03 1.64 -0.07 0.00 -1.52 0.00 0.00 31.29 31.37 2jfn h VAL 269 CO -0.13 0.40 0.63 -0.07 0.02 0.00 0.00 177.57 178.43 2jfn h LEU 270 N 0.25 1.01 -0.57 2.57 3.38 -0.38 -0.51 115.31 121.06 2jfn h LEU 270 Ca 0.05 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 2jfn h LEU 270 Cb 0.71 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 2jfn h LEU 270 CO 0.05 0.64 -0.03 1.56 0.09 0.00 0.00 178.44 180.75 2jfn h GLN 271 N 1.15 1.03 -0.01 1.13 4.20 -0.72 -0.77 115.11 121.11 2jfn h GLN 271 Ca 0.43 -0.34 -0.03 0.00 0.06 0.00 0.00 58.65 58.77 2jfn h GLN 271 Cb 0.18 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.87 2jfn h GLN 271 CO -0.18 1.03 -0.12 0.00 -0.67 0.00 0.00 178.83 178.89 2jfn h ARG 272 N 0.91 0.02 0.00 1.46 3.08 -0.28 -1.48 114.38 118.10 2jfn h ARG 272 Ca 0.16 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 2jfn h ARG 272 Cb 0.58 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2jfn h ARG 272 CO 0.03 0.14 0.00 0.66 -1.07 0.00 0.00 179.97 179.74 2jfn n TYR 273 N -4.38 0.14 0.00 3.04 4.02 -0.29 -4.91 117.16 114.78 2jfn n TYR 273 Ca -0.02 0.04 0.00 0.00 -0.01 0.00 0.00 57.90 57.91 2jfn n TYR 273 Cb 0.20 -0.57 0.00 0.00 -0.02 0.00 0.00 39.34 38.95 2jfn n TYR 273 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2jfn n GLY 274 N 1.39 1.23 3.26 2.72 0.00 -0.56 -5.05 105.19 108.18 2jfn n GLY 274 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 2jfn n GLY 274 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jfn s PHE 275 N -2.00 3.33 0.24 1.61 0.40 -0.36 -4.55 117.98 116.65 2jfn s PHE 275 Ca 0.00 -1.57 -0.01 0.00 -0.60 0.00 0.00 56.93 54.75 2jfn s PHE 275 Cb 0.00 -2.70 0.28 0.00 0.51 0.00 0.00 43.02 41.11 2jfn s PHE 275 CO 0.00 -0.81 1.66 1.05 0.70 0.00 0.00 175.22 177.82 2jfn h GLU 276 N 8.30 0.62 -6.48 0.44 4.11 -1.84 -3.06 114.58 116.67 2jfn h GLU 276 Ca -0.22 -0.25 -0.61 0.00 0.07 0.00 0.00 59.36 58.34 2jfn h GLU 276 Cb 1.08 -0.03 -0.22 0.00 0.50 0.00 0.00 28.75 30.09 2jfn h GLU 276 CO 0.69 0.82 -0.84 0.99 0.07 0.00 0.00 179.01 180.74 2jfn s THR 277 N -4.50 1.95 -0.15 -1.06 2.01 -1.26 -4.91 115.64 107.72 2jfn s THR 277 Ca -0.08 -1.64 0.00 0.00 0.31 0.00 0.00 61.69 60.28 2jfn s THR 277 Cb 0.13 -1.75 0.02 0.00 0.01 0.00 0.00 72.50 70.91 2jfn s THR 277 CO 0.81 -0.00 -0.14 -0.22 -0.69 0.00 0.00 174.62 174.38 2jfn s LEU 278 N -1.99 1.67 0.19 4.42 2.96 -1.26 -0.99 118.68 123.68 2jfn s LEU 278 Ca 0.10 -0.48 0.07 0.00 -0.22 0.00 0.00 54.13 53.60 2jfn s LEU 278 Cb -0.10 -1.17 -0.05 0.00 0.50 0.00 0.00 46.19 45.38 2jfn s LEU 278 CO 0.05 -0.06 -0.14 -1.61 -1.32 0.00 0.00 176.35 173.28 2jfn s GLU 279 N 1.48 1.27 0.02 1.98 2.02 -0.03 -4.99 118.70 120.45 2jfn s GLU 279 Ca 0.05 -1.55 -0.23 0.00 0.02 0.00 0.00 54.97 53.26 2jfn s GLU 279 Cb -0.13 -1.03 -0.05 0.00 0.10 0.00 0.00 34.13 33.02 2jfn s GLU 279 CO -0.10 0.17 0.69 0.21 0.02 0.00 0.00 175.26 176.24 2jfn s LYS 280 N -3.61 4.42 -0.18 1.61 2.20 -1.26 -0.96 119.74 121.96 2jfn s LYS 280 Ca 0.21 0.92 -0.07 0.00 -0.36 0.00 0.00 55.97 56.66 2jfn s LYS 280 Cb -0.00 -3.35 -0.04 0.00 -1.51 0.00 0.00 37.83 32.92 2jfn s LYS 280 CO 0.06 0.32 0.06 -1.17 -0.36 0.00 0.00 175.35 174.26 2jfn s LEU 281 N -0.12 3.80 -0.29 5.43 2.96 0.16 -4.89 118.68 125.73 2jfn s LEU 281 Ca 0.35 0.08 -0.27 0.00 -0.22 0.00 0.00 54.13 54.07 2jfn s LEU 281 Cb -0.19 -1.96 0.01 0.00 0.50 0.00 0.00 46.19 44.55 2jfn s LEU 281 CO 0.20 0.18 0.97 0.00 -1.32 0.00 0.00 176.35 176.38 2jfn s ALA 282 N 0.34 3.56 0.02 5.97 0.00 -1.26 -4.67 121.76 125.72 2jfn s ALA 282 Ca 0.03 -0.11 0.05 0.00 0.00 0.00 0.00 51.96 51.92 2jfn s ALA 282 Cb -0.12 -3.51 -0.03 0.00 0.00 0.00 0.00 23.12 19.45 2jfn s ALA 282 CO 0.00 -1.26 -0.09 0.08 0.00 0.00 0.00 175.76 174.49 2jfn s VAL 283 N 3.29 3.43 -0.64 0.00 1.01 -1.26 -4.79 120.40 121.44 2jfn s VAL 283 Ca 0.41 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.49 2jfn s VAL 283 Cb -0.14 -2.50 0.38 0.00 0.00 0.00 0.00 36.38 34.13 2jfn s VAL 283 CO 0.12 0.35 1.47 0.18 0.00 0.00 0.00 175.10 177.22 2jfn n LEU 284 N 1.45 5.88 0.00 3.92 4.77 -1.26 -5.10 117.00 126.65 2jfn n LEU 284 Ca -0.15 -5.14 0.00 0.00 -0.03 0.00 0.00 56.01 50.69 2jfn n LEU 284 Cb 0.52 -0.73 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 2jfn n LEU 284 CO 0.30 2.07 0.00 0.61 -1.33 0.00 0.00 177.39 179.04