#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ofn n THR 2 N 0.00 0.56 -0.01 2.03 -1.04 -1.26 -4.88 114.28 109.68 2ofn n THR 2 Ca 0.00 -0.30 -0.01 0.00 -2.04 0.00 0.00 64.05 61.71 2ofn n THR 2 Cb 0.00 -2.43 -0.00 0.00 -1.82 0.00 0.00 70.33 66.07 2ofn n THR 2 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 2ofn h THR 3 N 6.38 0.00 -5.89 12.58 1.35 -2.12 -3.50 112.91 121.70 2ofn h THR 3 Ca -0.45 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.21 2ofn h THR 3 Cb 1.24 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 67.65 2ofn h THR 3 CO 0.95 0.00 -0.91 -0.62 -0.25 0.00 0.00 175.52 174.69 2ofn n GLU 4 N -2.66 -1.64 -1.44 4.72 4.71 -1.26 -4.87 120.64 118.19 2ofn n GLU 4 Ca -0.01 1.61 -0.37 0.00 -0.01 0.00 0.00 57.16 58.38 2ofn n GLU 4 Cb 0.04 -2.51 0.06 0.00 -1.01 0.00 0.00 31.44 28.01 2ofn n GLU 4 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 2ofn n GLN 5 N 1.32 0.55 -2.62 3.49 3.00 -1.26 -4.85 117.38 117.01 2ofn n GLN 5 Ca -0.03 0.23 -0.41 0.00 -0.01 0.00 0.00 57.00 56.77 2ofn n GLN 5 Cb 0.31 -1.92 -0.03 0.00 0.00 0.00 0.00 30.24 28.60 2ofn n GLN 5 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 2ofn s GLU 6 N -2.59 3.55 0.02 -1.09 2.02 -1.26 -4.98 118.70 114.37 2ofn s GLU 6 Ca 0.71 -1.15 -0.07 0.00 0.02 0.00 0.00 54.97 54.48 2ofn s GLU 6 Cb -0.40 -5.18 -0.05 0.00 0.10 0.00 0.00 34.13 28.61 2ofn s GLU 6 CO 0.53 -2.13 0.29 -0.59 0.02 0.00 0.00 175.26 173.38 2ofn s PHE 7 N 4.66 3.57 -0.07 1.61 -0.12 -1.26 -5.10 117.98 121.28 2ofn s PHE 7 Ca 0.43 0.60 -0.04 0.00 -0.05 0.00 0.00 56.93 57.87 2ofn s PHE 7 Cb -0.02 -2.01 -0.04 0.00 -0.63 0.00 0.00 43.02 40.32 2ofn s PHE 7 CO -0.08 0.59 0.12 -2.00 -0.05 0.00 0.00 175.22 173.80 2ofn s GLU 8 N -1.82 3.30 0.35 1.99 2.12 -1.26 -5.02 118.70 118.35 2ofn s GLU 8 Ca 0.29 -0.29 -0.19 0.00 0.36 0.00 0.00 54.97 55.14 2ofn s GLU 8 Cb -0.13 -3.04 -0.10 0.00 0.26 0.00 0.00 34.13 31.12 2ofn s GLU 8 CO 0.17 0.72 0.84 0.15 -0.54 0.00 0.00 175.26 176.60 2ofn s LYS 9 N -1.36 4.19 -0.46 4.30 3.01 -1.26 -4.07 119.74 124.08 2ofn s LYS 9 Ca 0.19 0.94 -0.14 0.00 -1.01 0.00 0.00 55.97 55.96 2ofn s LYS 9 Cb -0.12 -2.44 0.08 0.00 -1.01 0.00 0.00 37.83 34.34 2ofn s LYS 9 CO 0.09 0.13 0.37 0.08 0.51 0.00 0.00 175.35 176.53 2ofn s VAL 10 N -1.96 4.95 -0.43 3.17 1.01 0.57 -4.98 120.40 122.73 2ofn s VAL 10 Ca 0.55 -1.20 -0.21 0.00 0.00 0.00 0.00 61.98 61.12 2ofn s VAL 10 Cb -0.12 -4.00 0.02 0.00 0.00 0.00 0.00 36.38 32.29 2ofn s VAL 10 CO 0.17 -0.59 0.66 -1.61 0.00 0.00 0.00 175.10 173.73 2ofn s GLU 11 N 1.58 3.33 -0.64 2.72 2.02 -1.26 -2.31 118.70 124.14 2ofn s GLU 11 Ca 0.04 -0.30 -0.01 0.00 0.02 0.00 0.00 54.97 54.72 2ofn s GLU 11 Cb -0.24 -3.94 -0.01 0.00 0.10 0.00 0.00 34.13 30.03 2ofn s GLU 11 CO 0.05 -1.01 0.59 1.28 0.02 0.00 0.00 175.26 176.19 2ofn n LEU 12 N 6.31 -5.54 -4.78 1.80 4.77 -1.19 -4.97 117.00 113.40 2ofn n LEU 12 Ca -0.01 -0.17 -0.29 0.00 -0.03 0.00 0.00 56.01 55.50 2ofn n LEU 12 Cb 0.48 -2.77 0.12 0.00 -2.33 0.00 0.00 43.42 38.92 2ofn n LEU 12 CO 0.54 -0.65 0.71 0.28 -1.33 0.00 0.00 177.39 176.93 2ofn s THR 13 N -3.07 2.46 -1.92 -5.08 -1.32 -1.22 -4.64 115.64 100.85 2ofn s THR 13 Ca 0.09 0.15 0.17 0.00 -1.21 0.00 0.00 61.69 60.88 2ofn s THR 13 Cb -0.01 -2.87 0.44 0.00 -1.51 0.00 0.00 72.50 68.55 2ofn s THR 13 CO 0.58 -0.19 1.41 0.00 -2.21 0.00 0.00 174.62 174.21 2ofn n ALA 14 N -3.66 2.08 1.85 11.08 0.00 -1.26 -1.01 120.51 129.59 2ofn n ALA 14 Ca 0.07 -0.10 0.15 0.00 0.00 0.00 0.00 53.44 53.56 2ofn n ALA 14 Cb 0.58 -1.27 0.89 0.00 0.00 0.00 0.00 19.45 19.65 2ofn n ALA 14 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2ofn n ASP 15 N -1.04 0.00 0.00 0.00 2.03 -1.26 -4.76 116.55 111.52 2ofn n ASP 15 Ca 0.12 -0.87 0.00 0.00 0.52 0.00 0.00 54.79 54.56 2ofn n ASP 15 Cb 0.07 -0.03 0.00 0.00 -0.72 0.00 0.00 41.12 40.44 2ofn n ASP 15 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ofn n GLY 16 N 0.94 1.68 1.83 0.27 0.00 -0.98 -4.80 105.19 104.12 2ofn n GLY 16 Ca 0.22 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.24 2ofn n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ofn n GLY 17 N 0.00 -0.58 2.94 -0.02 0.00 -0.18 -4.98 105.19 102.37 2ofn n GLY 17 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2ofn n GLY 17 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ofn s VAL 18 N -2.61 0.13 -0.40 1.61 1.01 -1.26 -4.81 120.40 114.08 2ofn s VAL 18 Ca 0.01 -0.50 -0.22 0.00 0.00 0.00 0.00 61.98 61.27 2ofn s VAL 18 Cb -0.00 -0.20 0.01 0.00 0.00 0.00 0.00 36.38 36.19 2ofn s VAL 18 CO 0.16 -0.24 0.70 -0.63 0.00 0.00 0.00 175.10 175.10 2ofn s ILE 19 N -0.75 4.79 0.02 2.22 -1.09 -1.26 -3.20 121.20 121.93 2ofn s ILE 19 Ca -0.07 0.52 0.01 0.00 -2.23 0.00 0.00 60.65 58.88 2ofn s ILE 19 Cb -0.05 -4.19 -0.01 0.00 -1.58 0.00 0.00 42.46 36.63 2ofn s ILE 19 CO -0.00 -0.49 -0.06 -1.59 -1.23 0.00 0.00 174.94 171.57 2ofn s LYS 20 N 2.95 0.41 -0.21 2.79 -2.85 -0.98 -1.25 119.74 120.60 2ofn s LYS 20 Ca 0.27 -0.49 -0.06 0.00 -1.00 0.00 0.00 55.97 54.69 2ofn s LYS 20 Cb -0.14 -0.24 -0.03 0.00 -2.06 0.00 0.00 37.83 35.37 2ofn s LYS 20 CO 0.18 0.05 0.02 0.99 0.10 0.00 0.00 175.35 176.68 2ofn s THR 21 N -0.87 4.04 -0.02 3.79 2.01 0.11 -0.32 115.64 124.38 2ofn s THR 21 Ca -0.06 -0.28 -0.26 0.00 0.31 0.00 0.00 61.69 61.40 2ofn s THR 21 Cb -0.07 -2.84 -0.04 0.00 0.01 0.00 0.00 72.50 69.56 2ofn s THR 21 CO -0.00 0.41 0.81 -0.51 -0.69 0.00 0.00 174.62 174.64 2ofn s ILE 22 N 1.13 4.92 -0.17 1.82 1.10 -1.26 -1.08 121.20 127.66 2ofn s ILE 22 Ca 0.03 1.69 -0.17 0.00 -0.51 0.00 0.00 60.65 61.69 2ofn s ILE 22 Cb -0.14 -4.15 -0.06 0.00 0.15 0.00 0.00 42.46 38.26 2ofn s ILE 22 CO 0.02 0.25 -0.33 0.18 -2.11 0.00 0.00 174.94 172.94 2ofn n LEU 23 N 3.61 1.85 -4.10 8.50 7.99 -1.22 -4.69 117.00 128.94 2ofn n LEU 23 Ca 0.01 0.31 -0.31 0.00 -0.01 0.00 0.00 56.01 56.01 2ofn n LEU 23 Cb 0.51 -0.73 -0.16 0.00 -0.11 0.00 0.00 43.42 42.93 2ofn n LEU 23 CO 0.49 -0.28 -0.52 -0.75 -1.51 0.00 0.00 177.39 174.82 2ofn s LYS 24 N -2.82 2.66 0.34 3.23 2.20 -1.24 -5.05 119.74 119.06 2ofn s LYS 24 Ca -0.28 -0.71 -0.21 0.00 -0.36 0.00 0.00 55.97 54.41 2ofn s LYS 24 Cb 0.04 -2.26 -0.10 0.00 -1.51 0.00 0.00 37.83 34.00 2ofn s LYS 24 CO 0.41 -0.12 0.86 0.15 -0.36 0.00 0.00 175.35 176.29 2ofn s LYS 25 N 1.13 4.28 0.37 4.03 1.02 -1.26 -3.71 119.74 125.59 2ofn s LYS 25 Ca -0.01 1.03 -0.26 0.00 0.02 0.00 0.00 55.97 56.76 2ofn s LYS 25 Cb -0.14 -2.53 -0.09 0.00 -0.52 0.00 0.00 37.83 34.55 2ofn s LYS 25 CO -0.07 0.17 1.09 0.20 -0.92 0.00 0.00 175.35 175.82 2ofn s GLY 26 N -1.95 2.85 0.00 -3.33 0.00 -1.26 -4.92 107.32 98.71 2ofn s GLY 26 Ca 0.54 0.81 0.00 0.00 0.00 0.00 0.00 44.72 46.06 2ofn s GLY 26 CO 0.18 1.30 0.00 1.34 0.00 0.00 0.00 173.10 175.92 2ofn n ASP 27 N 0.26 0.00 -4.55 1.64 2.03 -1.26 -5.00 116.55 109.68 2ofn n ASP 27 Ca 0.03 0.07 -0.26 0.00 0.52 0.00 0.00 54.79 55.16 2ofn n ASP 27 Cb 0.48 -0.09 -0.10 0.00 -0.72 0.00 0.00 41.12 40.68 2ofn n ASP 27 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 2ofn s GLU 28 N -0.19 1.84 0.00 -0.67 1.03 -1.26 -5.08 118.70 114.38 2ofn s GLU 28 Ca 0.00 -1.91 0.00 0.00 0.03 0.00 0.00 54.97 53.09 2ofn s GLU 28 Cb 0.00 -1.73 0.00 0.00 -0.80 0.00 0.00 34.13 31.60 2ofn s GLU 28 CO 0.00 0.15 0.00 0.41 -1.33 0.00 0.00 175.26 174.49 2ofn n GLY 29 N -0.81 -1.51 0.11 -3.83 0.00 -1.26 -5.01 105.19 92.89 2ofn n GLY 29 Ca -0.05 0.58 -0.05 0.00 0.00 0.00 0.00 46.02 46.50 2ofn n GLY 29 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2ofn h GLU 30 N 0.00 0.06 0.16 1.61 4.57 -2.02 -3.34 114.58 115.62 2ofn h GLU 30 Ca 0.00 -0.07 -0.35 0.00 -1.18 0.00 0.00 59.36 57.77 2ofn h GLU 30 Cb 0.00 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 2ofn h GLU 30 CO 0.00 0.82 -1.77 1.05 -1.18 0.00 0.00 179.01 177.93 2ofn h GLU 31 N 0.04 0.34 -4.24 1.92 9.09 -2.05 -3.40 114.58 116.27 2ofn h GLU 31 Ca -0.02 -0.58 -0.76 0.00 0.05 0.00 0.00 59.36 58.05 2ofn h GLU 31 Cb 1.38 0.21 -0.22 0.00 -1.65 0.00 0.00 28.75 28.48 2ofn h GLU 31 CO 0.11 1.24 1.04 0.09 0.05 0.00 0.00 179.01 181.54 2ofn n ASN 32 N -3.53 5.36 -3.93 3.06 5.03 -1.25 -4.94 115.26 115.05 2ofn n ASN 32 Ca -0.25 -3.01 -0.24 0.00 0.87 0.00 0.00 54.58 51.95 2ofn n ASN 32 Cb 1.07 -1.49 -0.17 0.00 -1.02 0.00 0.00 39.78 38.17 2ofn n ASN 32 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2ofn s ILE 33 N 0.39 0.87 0.29 2.41 -1.09 -1.26 -4.26 121.20 118.55 2ofn s ILE 33 Ca 0.38 -0.27 -0.29 0.00 -2.23 0.00 0.00 60.65 58.25 2ofn s ILE 33 Cb -0.05 -0.87 -0.10 0.00 -1.58 0.00 0.00 42.46 39.86 2ofn s ILE 33 CO -0.03 0.32 1.12 -2.16 -1.23 0.00 0.00 174.94 172.96 2ofn s PRO 34 N 1.20 4.58 0.07 2.79 0.04 -1.26 -4.91 135.00 137.50 2ofn s PRO 34 Ca -0.05 1.83 0.06 0.00 0.04 0.00 0.00 61.00 62.88 2ofn s PRO 34 Cb -0.14 -3.13 -0.03 0.00 0.04 0.00 0.00 34.50 31.24 2ofn s PRO 34 CO -0.02 0.14 -0.18 0.15 0.04 0.00 0.00 177.00 177.14 2ofn s LYS 35 N -1.55 1.07 0.53 4.56 -0.14 -1.26 -4.48 119.74 118.47 2ofn s LYS 35 Ca 0.46 -0.96 -0.20 0.00 -1.36 0.00 0.00 55.97 53.90 2ofn s LYS 35 Cb -0.32 -1.19 -0.06 0.00 -1.68 0.00 0.00 37.83 34.58 2ofn s LYS 35 CO 0.41 0.29 1.15 -1.59 -0.76 0.00 0.00 175.35 174.85 2ofn s LYS 36 N -1.50 3.42 0.00 1.68 0.00 -1.26 -2.79 119.74 119.28 2ofn s LYS 36 Ca 0.04 1.67 0.00 0.00 0.00 0.00 0.00 55.97 57.68 2ofn s LYS 36 Cb -0.09 -2.09 0.00 0.00 0.00 0.00 0.00 37.83 35.64 2ofn s LYS 36 CO 0.02 -0.81 0.00 0.41 0.00 0.00 0.00 175.35 174.98 2ofn n GLY 37 N 0.26 2.78 3.95 0.59 0.00 -1.18 -4.93 105.19 106.66 2ofn n GLY 37 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 2ofn n GLY 37 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ofn s ASN 38 N -1.54 3.99 -0.26 1.61 0.01 -1.12 -4.79 114.94 112.84 2ofn s ASN 38 Ca 0.00 0.09 -0.13 0.00 -0.71 0.00 0.00 52.86 52.10 2ofn s ASN 38 Cb 0.00 -0.40 -0.04 0.00 0.41 0.00 0.00 41.25 41.21 2ofn s ASN 38 CO 0.00 -2.13 0.29 -0.70 -1.51 0.00 0.00 177.10 173.05 2ofn s GLU 39 N -5.46 4.03 0.15 -0.60 -6.30 -1.24 -4.00 118.70 105.28 2ofn s GLU 39 Ca 0.68 -0.09 -0.02 0.00 -2.50 0.00 0.00 54.97 53.03 2ofn s GLU 39 Cb -0.06 -3.62 -0.04 0.00 0.00 0.00 0.00 34.13 30.41 2ofn s GLU 39 CO 0.48 -0.16 0.11 0.14 0.02 0.00 0.00 175.26 175.84 2ofn s VAL 40 N 1.71 0.07 -0.12 3.70 -7.23 -1.26 -1.50 120.40 115.76 2ofn s VAL 40 Ca 0.12 -1.87 -0.02 0.00 -1.81 0.00 0.00 61.98 58.40 2ofn s VAL 40 Cb -0.15 -2.15 0.04 0.00 0.56 0.00 0.00 36.38 34.68 2ofn s VAL 40 CO 0.09 -0.32 -0.00 -0.89 -0.31 0.00 0.00 175.10 173.67 2ofn s THR 41 N -4.07 0.56 0.02 5.32 2.01 0.07 -4.48 115.64 115.07 2ofn s THR 41 Ca 0.27 -0.17 0.02 0.00 0.31 0.00 0.00 61.69 62.12 2ofn s THR 41 Cb 0.07 -0.79 -0.02 0.00 0.01 0.00 0.00 72.50 71.77 2ofn s THR 41 CO 0.04 0.14 -0.08 0.68 -0.69 0.00 0.00 174.62 174.71 2ofn s VAL 42 N 1.88 0.60 -0.11 3.82 -7.23 -1.25 -2.55 120.40 115.56 2ofn s VAL 42 Ca 0.03 -0.73 -0.06 0.00 -1.81 0.00 0.00 61.98 59.41 2ofn s VAL 42 Cb -0.14 -0.58 -0.04 0.00 0.56 0.00 0.00 36.38 36.18 2ofn s VAL 42 CO -0.07 -0.11 0.13 -1.38 -0.31 0.00 0.00 175.10 173.36 2ofn s HIS 43 N -0.79 3.54 -0.04 2.82 -3.43 -1.24 -3.18 115.29 112.97 2ofn s HIS 43 Ca -0.03 0.48 0.04 0.00 -0.80 0.00 0.00 55.06 54.75 2ofn s HIS 43 Cb -0.06 -1.91 -0.00 0.00 -1.43 0.00 0.00 32.58 29.17 2ofn s HIS 43 CO 0.00 0.70 -0.17 1.52 -2.00 0.00 0.00 174.74 174.79 2ofn s TYR 44 N -1.04 1.74 -0.10 0.38 1.13 -1.09 -3.79 117.35 114.58 2ofn s TYR 44 Ca 0.16 -0.49 -0.30 0.00 -1.41 0.00 0.00 57.07 55.02 2ofn s TYR 44 Cb -0.12 -1.17 0.12 0.00 -1.10 0.00 0.00 41.96 39.69 2ofn s TYR 44 CO 0.05 -0.16 0.98 0.54 -2.51 0.00 0.00 175.55 174.44 2ofn s VAL 45 N 0.01 0.00 0.00 -3.49 0.11 -1.25 -4.34 120.40 111.44 2ofn s VAL 45 Ca -0.03 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.02 2ofn s VAL 45 Cb -0.11 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.74 2ofn s VAL 45 CO 0.02 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.40 2ofn n GLY 46 N 0.25 -0.56 3.44 6.54 0.00 -1.25 0.47 105.19 114.08 2ofn n GLY 46 Ca -0.08 0.31 -0.11 0.00 0.00 0.00 0.00 46.02 46.13 2ofn n GLY 46 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ofn s LYS 47 N -0.00 1.48 -0.62 1.61 -2.85 -0.87 -2.64 119.74 115.85 2ofn s LYS 47 Ca 0.00 -1.46 -0.17 0.00 -1.00 0.00 0.00 55.97 53.33 2ofn s LYS 47 Cb 0.00 0.40 0.13 0.00 -2.06 0.00 0.00 37.83 36.29 2ofn s LYS 47 CO 0.00 -0.58 0.67 -1.17 0.10 0.00 0.00 175.35 174.37 2ofn s LEU 48 N -3.10 5.78 0.52 2.77 2.96 0.10 -1.59 118.68 126.12 2ofn s LEU 48 Ca 0.30 -1.72 0.30 0.00 -0.22 0.00 0.00 54.13 52.78 2ofn s LEU 48 Cb 0.02 -2.27 1.32 0.00 0.50 0.00 0.00 46.19 45.76 2ofn s LEU 48 CO 0.12 -0.97 1.98 -0.08 -1.32 0.00 0.00 176.35 176.08 2ofn h GLU 49 N 8.92 0.00 -0.22 1.98 4.57 -1.74 0.67 114.58 128.75 2ofn h GLU 49 Ca -0.23 0.00 0.06 0.00 -1.18 0.00 0.00 59.36 58.02 2ofn h GLU 49 Cb 1.08 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.66 2ofn h GLU 49 CO 1.04 0.10 0.26 1.03 -1.18 0.00 0.00 179.01 180.26 2ofn h SER 50 N 0.00 0.00 0.00 1.04 0.87 -1.50 -3.13 113.55 110.84 2ofn h SER 50 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2ofn h SER 50 Cb 0.51 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 2ofn h SER 50 CO 0.01 0.00 -0.33 1.07 -0.53 0.00 0.00 176.83 177.06 2ofn n THR 51 N -3.75 0.00 -0.94 2.23 5.66 -1.01 -4.97 114.28 111.49 2ofn n THR 51 Ca 0.03 -0.01 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 2ofn n THR 51 Cb 0.39 0.23 0.00 0.00 -1.55 0.00 0.00 70.33 69.40 2ofn n THR 51 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2ofn n GLY 52 N 0.84 1.16 3.35 1.09 0.00 0.23 -5.09 105.19 106.76 2ofn n GLY 52 Ca 0.00 -0.33 -0.32 0.00 0.00 0.00 0.00 46.02 45.37 2ofn n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ofn s LYS 53 N -2.18 2.77 0.56 1.61 3.01 -0.83 -4.95 119.74 119.73 2ofn s LYS 53 Ca 0.00 -0.79 -0.15 0.00 -1.01 0.00 0.00 55.97 54.02 2ofn s LYS 53 Cb 0.00 -2.34 -0.06 0.00 -1.01 0.00 0.00 37.83 34.42 2ofn s LYS 53 CO 0.00 0.39 1.01 0.54 0.51 0.00 0.00 175.35 177.80 2ofn s VAL 54 N -0.16 4.50 0.09 3.17 0.11 -1.26 0.01 120.40 126.86 2ofn s VAL 54 Ca -0.02 1.06 -0.30 0.00 -2.93 0.00 0.00 61.98 59.79 2ofn s VAL 54 Cb -0.14 -3.72 -0.06 0.00 -1.53 0.00 0.00 36.38 30.93 2ofn s VAL 54 CO 0.04 -0.82 1.18 -0.36 -3.33 0.00 0.00 175.10 171.81 2ofn s PHE 55 N -2.80 3.46 -0.38 1.54 0.40 -1.08 -4.85 117.98 114.27 2ofn s PHE 55 Ca 0.58 1.35 0.01 0.00 -0.60 0.00 0.00 56.93 58.27 2ofn s PHE 55 Cb -0.11 -3.40 0.14 0.00 0.51 0.00 0.00 43.02 40.16 2ofn s PHE 55 CO 0.40 -1.18 0.23 0.34 0.70 0.00 0.00 175.22 175.71 2ofn s ASP 56 N 0.84 3.05 0.07 1.36 2.15 -1.26 -4.96 116.67 117.92 2ofn s ASP 56 Ca 0.57 -2.38 0.08 0.00 0.43 0.00 0.00 52.55 51.24 2ofn s ASP 56 Cb -0.30 -0.58 -0.03 0.00 -0.30 0.00 0.00 42.92 41.71 2ofn s ASP 56 CO 0.31 -0.29 -0.21 -0.44 -0.17 0.00 0.00 175.17 174.37 2ofn s SER 57 N 0.78 2.47 0.66 -0.34 0.01 -1.26 -5.01 113.70 111.02 2ofn s SER 57 Ca 0.19 -0.59 0.42 0.00 1.31 0.00 0.00 55.95 57.28 2ofn s SER 57 Cb -0.21 -0.17 2.31 0.00 0.21 0.00 0.00 66.02 68.16 2ofn s SER 57 CO -0.01 0.11 2.32 0.28 0.41 0.00 0.00 173.24 176.35 2ofn h SER 58 N 4.54 0.00 0.00 2.44 0.02 -1.99 -2.73 113.55 115.83 2ofn h SER 58 Ca -0.44 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.25 2ofn h SER 58 Cb 1.17 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.67 2ofn h SER 58 CO 0.42 0.00 -1.49 0.49 -1.14 0.00 0.00 176.83 175.11 2ofn n PHE 59 N -3.12 0.77 0.10 3.45 3.72 -1.26 -4.20 117.46 116.92 2ofn n PHE 59 Ca -0.03 0.33 -0.02 0.00 -0.05 0.00 0.00 57.45 57.69 2ofn n PHE 59 Cb 0.11 -1.05 0.24 0.00 -0.94 0.00 0.00 39.48 37.84 2ofn n PHE 59 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 2ofn h ASP 60 N -1.00 0.25 -0.03 4.37 2.03 -1.70 0.20 116.42 120.55 2ofn h ASP 60 Ca -0.40 -0.10 0.00 0.00 -0.73 0.00 0.00 57.03 55.80 2ofn h ASP 60 Cb 1.32 -0.07 0.00 0.00 -0.83 0.00 0.00 39.33 39.75 2ofn h ASP 60 CO -0.24 0.61 0.00 -2.11 -1.03 0.00 0.00 179.24 176.47 2ofn n ARG 61 N -4.05 1.24 -0.07 4.15 1.85 -1.04 -3.70 116.66 115.03 2ofn n ARG 61 Ca -0.01 -0.35 -0.15 0.00 -1.00 0.00 0.00 57.85 56.33 2ofn n ARG 61 Cb 0.45 -1.42 -0.06 0.00 -1.05 0.00 0.00 32.46 30.39 2ofn n ARG 61 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 2ofn n ASN 62 N -0.51 1.31 -3.68 2.89 5.15 -0.40 -5.05 115.26 114.97 2ofn n ASN 62 Ca 0.19 0.15 -0.10 0.00 -0.60 0.00 0.00 54.58 54.22 2ofn n ASN 62 Cb 0.18 -0.41 -0.10 0.00 -0.53 0.00 0.00 39.78 38.91 2ofn n ASN 62 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2ofn s VAL 63 N -2.28 -0.26 0.63 3.44 0.11 0.58 -5.11 120.40 117.50 2ofn s VAL 63 Ca -0.21 0.12 -0.10 0.00 -2.93 0.00 0.00 61.98 58.86 2ofn s VAL 63 Cb 0.08 -0.65 -0.02 0.00 -1.53 0.00 0.00 36.38 34.26 2ofn s VAL 63 CO 0.27 0.05 1.01 -2.16 -3.33 0.00 0.00 175.10 170.94 2ofn s PRO 64 N 1.88 3.27 0.16 1.54 0.04 -1.26 -4.23 135.00 136.40 2ofn s PRO 64 Ca -0.07 0.51 0.04 0.00 0.04 0.00 0.00 61.00 61.52 2ofn s PRO 64 Cb -0.10 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 32.29 2ofn s PRO 64 CO -0.13 -0.70 0.18 0.12 0.04 0.00 0.00 177.00 176.51 2ofn s PHE 65 N -3.17 3.24 -0.03 0.56 5.36 -1.26 -4.98 117.98 117.70 2ofn s PHE 65 Ca 0.55 0.02 0.04 0.00 -0.96 0.00 0.00 56.93 56.58 2ofn s PHE 65 Cb -0.11 -1.56 -0.00 0.00 -0.34 0.00 0.00 43.02 41.01 2ofn s PHE 65 CO 0.51 0.52 -0.14 -1.59 -1.46 0.00 0.00 175.22 173.06 2ofn s LYS 66 N -3.13 1.46 0.23 10.12 0.00 -1.26 -2.67 119.74 124.50 2ofn s LYS 66 Ca 0.32 -0.51 0.01 0.00 0.00 0.00 0.00 55.97 55.79 2ofn s LYS 66 Cb -0.10 -1.31 0.01 0.00 0.00 0.00 0.00 37.83 36.43 2ofn s LYS 66 CO 0.25 0.22 0.10 1.97 0.00 0.00 0.00 175.35 177.88 2ofn n PHE 67 N 3.12 -0.37 -4.29 1.78 1.16 -1.19 -4.94 117.46 112.73 2ofn n PHE 67 Ca -0.18 -1.05 -0.21 0.00 -1.87 0.00 0.00 57.45 54.14 2ofn n PHE 67 Cb 0.54 -0.17 -0.12 0.00 -1.61 0.00 0.00 39.48 38.12 2ofn n PHE 67 CO 0.00 0.00 0.00 -1.01 -1.87 0.00 0.00 176.76 173.88 2ofn s HIS 68 N -1.46 1.67 0.66 2.97 3.76 -1.26 -3.84 115.29 117.78 2ofn s HIS 68 Ca 0.07 -0.47 -0.17 0.00 -0.15 0.00 0.00 55.06 54.34 2ofn s HIS 68 Cb -0.01 -0.87 -0.05 0.00 1.11 0.00 0.00 32.58 32.76 2ofn s HIS 68 CO 0.05 0.23 0.61 -0.11 -0.85 0.00 0.00 174.74 174.67 2ofn n LEU 69 N 0.67 1.38 -0.50 0.89 -0.00 -1.26 -4.52 117.00 113.66 2ofn n LEU 69 Ca -0.16 0.67 -0.04 0.00 -0.00 0.00 0.00 56.01 56.48 2ofn n LEU 69 Cb 0.56 -1.24 -0.02 0.00 -0.00 0.00 0.00 43.42 42.72 2ofn n LEU 69 CO 0.26 -2.86 0.24 1.21 -0.00 0.00 0.00 177.39 176.24 2ofn n GLU 70 N -0.61 0.00 0.00 1.96 0.00 -1.26 -4.41 120.64 116.32 2ofn n GLU 70 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.27 2ofn n GLU 70 Cb 0.49 -0.16 0.00 0.00 0.00 0.00 0.00 31.44 31.77 2ofn n GLU 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2ofn n GLN 71 N 0.90 1.14 0.00 5.31 0.00 -1.26 -3.09 117.38 120.38 2ofn n GLN 71 Ca 0.07 -0.86 0.00 0.00 0.00 0.00 0.00 57.00 56.21 2ofn n GLN 71 Cb 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 30.24 29.49 2ofn n GLN 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2ofn n GLY 72 N -0.21 0.58 0.11 2.61 0.00 -1.26 -4.95 105.19 102.07 2ofn n GLY 72 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2ofn n GLY 72 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ofn h GLU 73 N 2.74 0.14 -5.56 1.61 4.39 -1.92 -3.45 114.58 112.54 2ofn h GLU 73 Ca 0.00 -0.24 -0.62 0.00 0.34 0.00 0.00 59.36 58.85 2ofn h GLU 73 Cb 0.00 0.09 -0.09 0.00 -0.10 0.00 0.00 28.75 28.65 2ofn h GLU 73 CO 0.00 1.11 -0.38 0.14 -1.16 0.00 0.00 179.01 178.72 2ofn s VAL 74 N -2.39 5.34 -0.00 3.13 -7.23 -1.26 -5.03 120.40 112.95 2ofn s VAL 74 Ca -0.21 0.43 -0.00 0.00 -1.81 0.00 0.00 61.98 60.38 2ofn s VAL 74 Cb 0.03 -3.55 -0.00 0.00 0.56 0.00 0.00 36.38 33.42 2ofn s VAL 74 CO 0.71 0.49 -0.00 2.30 -0.31 0.00 0.00 175.10 178.29 2ofn n ILE 75 N 2.90 0.02 0.00 -0.62 -0.00 -1.26 -4.56 119.36 115.84 2ofn n ILE 75 Ca -0.15 0.49 0.00 0.00 -0.00 0.00 0.00 62.75 63.09 2ofn n ILE 75 Cb 0.53 -1.51 0.00 0.00 -0.00 0.00 0.00 39.64 38.65 2ofn n ILE 75 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 2ofn n LYS 76 N -2.45 0.00 -0.01 6.28 4.76 -1.24 -4.67 118.16 120.82 2ofn n LYS 76 Ca -0.00 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.35 2ofn n LYS 76 Cb 0.01 -0.21 -0.03 0.00 -1.84 0.00 0.00 35.03 32.96 2ofn n LYS 76 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 2ofn h GLY 77 N 0.00 -0.20 1.92 0.72 0.00 -1.68 -1.27 103.07 102.56 2ofn h GLY 77 Ca 0.00 0.28 -0.19 0.00 0.00 0.00 0.00 47.33 47.42 2ofn h GLY 77 CO 0.00 -0.19 -0.86 1.49 0.00 0.00 0.00 176.54 176.97 2ofn h TRP 78 N -0.27 0.11 -0.18 5.60 6.55 -1.92 -3.36 115.95 122.47 2ofn h TRP 78 Ca 0.11 -0.06 0.02 0.00 0.95 0.00 0.00 58.89 59.91 2ofn h TRP 78 Cb 0.44 -0.01 -0.02 0.00 -0.86 0.00 0.00 29.16 28.70 2ofn h TRP 78 CO -0.34 0.90 0.03 0.22 -1.05 0.00 0.00 178.44 178.20 2ofn h ASP 79 N 0.04 0.00 -0.16 -3.49 3.58 -1.55 0.74 116.42 115.58 2ofn h ASP 79 Ca -0.02 0.03 0.01 0.00 0.42 0.00 0.00 57.03 57.47 2ofn h ASP 79 Cb 1.51 0.04 -0.01 0.00 1.72 0.00 0.00 39.33 42.59 2ofn h ASP 79 CO 0.12 0.03 0.11 0.40 -2.88 0.00 0.00 179.24 177.02 2ofn h ILE 80 N 0.11 1.02 0.12 2.25 5.03 -1.43 -1.00 117.51 123.60 2ofn h ILE 80 Ca 0.08 -0.06 -0.01 0.00 -0.12 0.00 0.00 64.86 64.75 2ofn h ILE 80 Cb 0.08 0.83 0.00 0.00 -3.03 0.00 0.00 36.82 34.69 2ofn h ILE 80 CO -0.11 0.03 -0.06 0.00 -0.68 0.00 0.00 178.15 177.33 2ofn h VAL 82 N -1.02 1.14 -0.27 0.00 -1.51 -0.64 0.09 116.25 114.05 2ofn h VAL 82 Ca -0.02 -0.49 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 2ofn h VAL 82 Cb 0.29 0.81 0.00 0.00 -2.13 0.00 0.00 31.29 30.27 2ofn h VAL 82 CO 0.03 0.18 0.00 -0.24 -1.23 0.00 0.00 177.57 176.30 2ofn n SER 83 N -4.38 2.16 -1.41 4.19 2.88 -0.40 -3.94 113.62 112.73 2ofn n SER 83 Ca 0.01 -1.83 0.04 0.00 -1.33 0.00 0.00 58.87 55.77 2ofn n SER 83 Cb 0.16 -0.17 0.04 0.00 -0.75 0.00 0.00 64.21 63.49 2ofn n SER 83 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2ofn n SER 84 N 0.65 1.09 -2.63 -3.46 2.88 -0.07 -4.68 113.62 107.40 2ofn n SER 84 Ca 0.16 -2.22 -0.05 0.00 -1.33 0.00 0.00 58.87 55.43 2ofn n SER 84 Cb 0.39 -0.33 0.01 0.00 -0.75 0.00 0.00 64.21 63.53 2ofn n SER 84 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 2ofn n MET 85 N 0.31 1.18 -4.23 -1.46 2.81 -0.66 -4.93 117.12 110.14 2ofn n MET 85 Ca 0.08 -0.73 -0.14 0.00 -1.81 0.00 0.00 57.70 55.10 2ofn n MET 85 Cb 1.10 0.04 -0.10 0.00 -0.71 0.00 0.00 33.22 33.54 2ofn n MET 85 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2ofn s ARG 86 N -2.52 1.29 0.61 0.03 0.52 -1.26 -4.25 118.95 113.37 2ofn s ARG 86 Ca 0.09 -1.69 0.39 0.00 -0.52 0.00 0.00 55.73 54.00 2ofn s ARG 86 Cb -0.01 0.15 1.96 0.00 0.52 0.00 0.00 34.95 37.57 2ofn s ARG 86 CO 0.06 -0.39 2.21 -0.22 0.02 0.00 0.00 175.30 176.97 2ofn h LYS 87 N 2.53 0.00 0.00 3.54 3.64 -1.81 -2.25 116.57 122.22 2ofn h LYS 87 Ca -0.36 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 2ofn h LYS 87 Cb 1.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 2ofn h LYS 87 CO 0.54 0.01 -0.12 0.09 -2.27 0.00 0.00 179.45 177.70 2ofn n ASN 88 N -3.15 1.44 -4.67 4.20 3.02 -1.26 -4.79 115.26 110.05 2ofn n ASN 88 Ca -0.02 -2.34 -0.27 0.00 -0.03 0.00 0.00 54.58 51.92 2ofn n ASN 88 Cb 0.17 -0.23 -0.08 0.00 -0.61 0.00 0.00 39.78 39.03 2ofn n ASN 88 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2ofn s GLU 89 N -1.45 2.44 -0.28 3.52 -6.30 -0.85 -4.77 118.70 111.01 2ofn s GLU 89 Ca 0.14 -1.05 -0.11 0.00 -2.50 0.00 0.00 54.97 51.44 2ofn s GLU 89 Cb 0.12 -2.40 0.11 0.00 0.00 0.00 0.00 34.13 31.96 2ofn s GLU 89 CO 0.01 0.47 0.63 0.21 0.02 0.00 0.00 175.26 176.60 2ofn s LYS 90 N -2.82 0.58 0.09 4.30 2.20 -1.24 -4.32 119.74 118.52 2ofn s LYS 90 Ca 0.27 1.32 0.01 0.00 -0.36 0.00 0.00 55.97 57.22 2ofn s LYS 90 Cb -0.10 0.57 -0.04 0.00 -1.51 0.00 0.00 37.83 36.76 2ofn s LYS 90 CO 0.18 -0.19 -0.06 0.00 -0.36 0.00 0.00 175.35 174.93 2ofn s LEU 92 N -2.88 3.62 0.10 0.00 1.43 -0.24 -3.95 118.68 116.76 2ofn s LEU 92 Ca 0.09 -0.03 0.04 0.00 -1.03 0.00 0.00 54.13 53.19 2ofn s LEU 92 Cb 0.04 -1.92 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 2ofn s LEU 92 CO -0.05 0.11 0.09 -0.69 0.23 0.00 0.00 176.35 176.04 2ofn s VAL 93 N 0.72 4.49 -0.34 -1.59 1.01 -1.25 0.05 120.40 123.48 2ofn s VAL 93 Ca 0.03 -0.85 -0.09 0.00 0.00 0.00 0.00 61.98 61.07 2ofn s VAL 93 Cb -0.13 -3.19 0.02 0.00 0.00 0.00 0.00 36.38 33.07 2ofn s VAL 93 CO 0.02 0.07 0.15 -0.60 0.00 0.00 0.00 175.10 174.74 2ofn s ARG 94 N -2.54 2.93 -0.53 2.72 6.06 -0.38 -3.73 118.95 123.48 2ofn s ARG 94 Ca 0.29 -0.99 -0.22 0.00 -2.50 0.00 0.00 55.73 52.32 2ofn s ARG 94 Cb -0.12 -3.56 0.05 0.00 0.06 0.00 0.00 34.95 31.38 2ofn s ARG 94 CO 0.22 -0.58 0.78 0.42 -2.50 0.00 0.00 175.30 173.64 2ofn s ILE 95 N 1.52 4.63 0.69 4.11 1.09 -0.61 -4.55 121.20 128.08 2ofn s ILE 95 Ca 0.02 -0.10 -0.09 0.00 -1.10 0.00 0.00 60.65 59.37 2ofn s ILE 95 Cb -0.18 -4.41 0.03 0.00 -1.06 0.00 0.00 42.46 36.83 2ofn s ILE 95 CO 0.05 -0.95 1.05 -0.70 -0.10 0.00 0.00 174.94 174.28 2ofn s GLU 96 N 3.28 2.65 0.25 2.79 2.12 -1.26 -3.04 118.70 125.50 2ofn s GLU 96 Ca 0.23 0.20 -0.03 0.00 0.36 0.00 0.00 54.97 55.73 2ofn s GLU 96 Cb -0.16 -2.09 0.47 0.00 0.26 0.00 0.00 34.13 32.61 2ofn s GLU 96 CO 0.16 -1.06 1.77 0.66 -0.54 0.00 0.00 175.26 176.25 2ofn h SER 97 N -0.59 0.52 0.67 -1.70 4.64 -1.87 0.31 113.55 115.53 2ofn h SER 97 Ca -0.45 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 2ofn h SER 97 Cb 1.27 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2ofn h SER 97 CO 0.63 0.24 0.00 1.15 -0.87 0.00 0.00 176.83 177.98 2ofn n MET 98 N -4.86 0.18 0.00 4.77 0.00 -1.26 -2.13 117.12 113.82 2ofn n MET 98 Ca 0.15 0.06 0.14 0.00 0.00 0.00 0.00 57.70 58.05 2ofn n MET 98 Cb 0.38 -1.50 0.52 0.00 0.00 0.00 0.00 33.22 32.63 2ofn n MET 98 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 2ofn n TYR 99 N -1.40 0.00 -3.23 3.17 4.01 0.09 -4.91 117.16 114.90 2ofn n TYR 99 Ca 0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.83 2ofn n TYR 99 Cb 0.25 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.24 2ofn n TYR 99 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2ofn n GLY 100 N 1.21 3.90 3.49 2.72 0.00 -0.91 -1.69 105.19 113.91 2ofn n GLY 100 Ca 0.17 -1.34 -0.44 0.00 0.00 0.00 0.00 46.02 44.41 2ofn n GLY 100 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ofn s TYR 101 N -3.03 3.35 -0.07 1.61 2.02 -1.26 -4.69 117.35 115.28 2ofn s TYR 101 Ca 0.00 -2.01 0.14 0.00 -0.37 0.00 0.00 57.07 54.83 2ofn s TYR 101 Cb 0.00 -4.40 -0.22 0.00 -0.40 0.00 0.00 41.96 36.94 2ofn s TYR 101 CO 0.00 -1.48 0.60 0.41 -1.57 0.00 0.00 175.55 173.51 2ofn n GLY 102 N 4.41 -1.02 0.21 0.71 0.00 -1.22 -1.21 105.19 107.07 2ofn n GLY 102 Ca 0.39 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 46.21 2ofn n GLY 102 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2ofn h ASP 103 N 0.00 -0.37 -0.43 1.61 5.19 -1.86 -3.30 116.42 117.26 2ofn h ASP 103 Ca -0.30 -0.15 -0.14 0.00 -0.62 0.00 0.00 57.03 55.81 2ofn h ASP 103 Cb 1.99 0.10 -0.01 0.00 0.18 0.00 0.00 39.33 41.59 2ofn h ASP 103 CO 0.07 0.08 -0.28 -0.08 -3.12 0.00 0.00 179.24 175.91 2ofn h GLU 104 N -0.97 0.95 -0.23 3.56 4.81 -1.96 -3.49 114.58 117.25 2ofn h GLU 104 Ca -0.05 -0.45 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2ofn h GLU 104 Cb 0.50 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.87 2ofn h GLU 104 CO 0.07 1.11 0.00 0.41 -0.73 0.00 0.00 179.01 179.87 2ofn n GLY 105 N 0.01 0.36 3.60 1.92 0.00 -1.10 -5.06 105.19 104.92 2ofn n GLY 105 Ca -0.01 -0.63 -0.40 0.00 0.00 0.00 0.00 46.02 44.98 2ofn n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ofn s GLY 107 N 1.62 1.34 -0.00 0.00 0.00 -1.26 -4.71 107.32 104.31 2ofn s GLY 107 Ca 0.19 -1.13 -0.02 0.00 0.00 0.00 0.00 44.72 43.76 2ofn s GLY 107 CO 0.10 0.20 -0.03 1.18 0.00 0.00 0.00 173.10 174.55 2ofn n GLU 108 N 4.44 0.05 0.00 2.90 1.02 -1.26 -5.04 120.64 122.74 2ofn n GLU 108 Ca -0.20 0.02 0.00 0.00 -0.02 0.00 0.00 57.16 56.96 2ofn n GLU 108 Cb 0.51 -0.37 0.00 0.00 -0.02 0.00 0.00 31.44 31.55 2ofn n GLU 108 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2ofn n SER 109 N -2.83 0.00 -3.26 1.62 7.64 -1.26 -5.01 113.62 110.52 2ofn n SER 109 Ca -0.01 0.00 -0.21 0.00 1.01 0.00 0.00 58.87 59.65 2ofn n SER 109 Cb 0.05 -0.15 -0.08 0.00 -1.01 0.00 0.00 64.21 63.02 2ofn n SER 109 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2ofn s ILE 110 N -0.53 -0.03 0.00 0.44 -0.00 -1.26 -5.12 121.20 114.70 2ofn s ILE 110 Ca 0.00 -2.06 0.00 0.00 -0.00 0.00 0.00 60.65 58.59 2ofn s ILE 110 Cb 0.00 -0.92 0.00 0.00 -0.00 0.00 0.00 42.46 41.54 2ofn s ILE 110 CO 0.00 -0.89 0.00 -0.81 -0.00 0.00 0.00 174.94 173.24 2ofn n PRO 111 N 3.10 3.92 -0.28 0.37 -0.04 -1.26 -4.93 135.00 135.88 2ofn n PRO 111 Ca 0.24 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 2ofn n PRO 111 Cb 0.49 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.95 2ofn n PRO 111 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ofn n GLY 112 N 5.00 0.56 2.37 0.55 0.00 -1.26 -4.50 105.19 107.91 2ofn n GLY 112 Ca 0.00 -0.61 -0.18 0.00 0.00 0.00 0.00 46.02 45.23 2ofn n GLY 112 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ofn n ASN 113 N -0.15 -4.82 -4.56 1.61 4.13 -1.26 -4.95 115.26 105.26 2ofn n ASN 113 Ca 0.00 0.30 -0.29 0.00 1.68 0.00 0.00 54.58 56.28 2ofn n ASN 113 Cb 0.06 -4.22 -0.10 0.00 -1.54 0.00 0.00 39.78 33.98 2ofn n ASN 113 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2ofn s SER 114 N -2.33 4.26 -0.16 6.41 0.01 -1.26 -4.80 113.70 115.83 2ofn s SER 114 Ca 0.00 -0.48 -0.11 0.00 1.31 0.00 0.00 55.95 56.66 2ofn s SER 114 Cb 0.00 -0.75 -0.05 0.00 0.21 0.00 0.00 66.02 65.44 2ofn s SER 114 CO 0.00 0.15 0.21 0.54 0.41 0.00 0.00 173.24 174.55 2ofn s VAL 115 N -1.38 5.36 0.29 3.43 0.11 -1.26 -4.52 120.40 122.43 2ofn s VAL 115 Ca 0.22 0.37 0.07 0.00 -2.93 0.00 0.00 61.98 59.71 2ofn s VAL 115 Cb -0.10 -3.53 -0.06 0.00 -1.53 0.00 0.00 36.38 31.16 2ofn s VAL 115 CO 0.14 0.47 -0.05 -0.76 -3.33 0.00 0.00 175.10 171.56 2ofn s LEU 116 N 0.04 2.50 -0.12 2.54 1.02 -1.17 -1.19 118.68 122.30 2ofn s LEU 116 Ca 0.14 -1.21 0.02 0.00 0.02 0.00 0.00 54.13 53.09 2ofn s LEU 116 Cb -0.12 -0.67 0.02 0.00 0.02 0.00 0.00 46.19 45.43 2ofn s LEU 116 CO 0.02 -0.35 -0.15 -0.76 0.02 0.00 0.00 176.35 175.13 2ofn s LEU 117 N -3.47 1.74 0.03 1.79 1.02 -0.62 -1.58 118.68 117.58 2ofn s LEU 117 Ca 0.30 -0.45 0.09 0.00 0.02 0.00 0.00 54.13 54.10 2ofn s LEU 117 Cb 0.04 -1.12 -0.03 0.00 0.02 0.00 0.00 46.19 45.10 2ofn s LEU 117 CO 0.13 0.01 -0.26 -0.36 0.02 0.00 0.00 176.35 175.89 2ofn s PHE 118 N 1.04 2.34 0.30 0.29 0.08 -1.24 -2.05 117.98 118.73 2ofn s PHE 118 Ca -0.05 -0.41 -0.29 0.00 0.12 0.00 0.00 56.93 56.30 2ofn s PHE 118 Cb -0.15 -1.43 -0.11 0.00 -0.57 0.00 0.00 43.02 40.77 2ofn s PHE 118 CO -0.03 0.09 1.50 -1.21 -0.10 0.00 0.00 175.22 175.47 2ofn s GLU 119 N -1.09 4.19 -0.15 0.44 2.02 0.18 -3.96 118.70 120.32 2ofn s GLU 119 Ca 0.11 2.46 -0.00 0.00 0.02 0.00 0.00 54.97 57.56 2ofn s GLU 119 Cb -0.10 -3.04 0.04 0.00 0.10 0.00 0.00 34.13 31.12 2ofn s GLU 119 CO 0.01 -0.51 -0.07 0.42 0.02 0.00 0.00 175.26 175.13 2ofn s ILE 120 N -0.33 1.21 -0.17 -1.63 1.01 -1.25 -3.74 121.20 116.29 2ofn s ILE 120 Ca 0.59 -0.59 -0.03 0.00 0.00 0.00 0.00 60.65 60.62 2ofn s ILE 120 Cb -0.45 -1.30 0.06 0.00 0.01 0.00 0.00 42.46 40.78 2ofn s ILE 120 CO 0.50 0.23 0.04 -0.70 0.00 0.00 0.00 174.94 175.00 2ofn s GLU 121 N 1.61 0.60 -0.72 2.79 2.12 -1.25 -4.06 118.70 119.79 2ofn s GLU 121 Ca 0.02 -0.32 -0.26 0.00 0.36 0.00 0.00 54.97 54.77 2ofn s GLU 121 Cb -0.14 -1.93 0.04 0.00 0.26 0.00 0.00 34.13 32.36 2ofn s GLU 121 CO -0.08 -0.60 1.22 -1.17 -0.54 0.00 0.00 175.26 174.09 2ofn s LEU 122 N 1.90 3.39 0.00 2.70 2.96 -1.26 -3.71 118.68 124.65 2ofn s LEU 122 Ca 0.00 -0.54 0.16 0.00 -0.22 0.00 0.00 54.13 53.53 2ofn s LEU 122 Cb -0.16 -2.54 -0.16 0.00 0.50 0.00 0.00 46.19 43.83 2ofn s LEU 122 CO -0.08 -1.76 0.71 0.00 -1.32 0.00 0.00 176.35 173.90 2ofn n LEU 123 N 9.06 0.86 -3.69 -0.68 -0.00 -1.06 -4.58 117.00 116.91 2ofn n LEU 123 Ca 0.02 -0.53 -0.13 0.00 -0.00 0.00 0.00 56.01 55.37 2ofn n LEU 123 Cb 0.48 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.82 2ofn n LEU 123 CO 0.70 0.20 0.23 -0.44 -0.00 0.00 0.00 177.39 178.08 2ofn s SER 124 N -2.46 -0.58 -0.12 1.45 0.01 -1.16 -4.97 113.70 105.86 2ofn s SER 124 Ca 0.07 1.11 -0.30 0.00 1.31 0.00 0.00 55.95 58.14 2ofn s SER 124 Cb 0.12 1.12 0.11 0.00 0.21 0.00 0.00 66.02 67.58 2ofn s SER 124 CO 0.64 -0.19 0.88 0.72 0.41 0.00 0.00 173.24 175.70 2ofn s PHE 125 N 0.35 -0.47 -0.11 2.43 -0.71 -1.26 -0.75 117.98 117.46 2ofn s PHE 125 Ca -0.00 0.79 -0.05 0.00 -1.04 0.00 0.00 56.93 56.63 2ofn s PHE 125 Cb -0.04 0.44 0.05 0.00 -1.21 0.00 0.00 43.02 42.26 2ofn s PHE 125 CO -0.00 -0.44 0.24 -0.98 -1.34 0.00 0.00 175.22 172.70 2ofn s ARG 126 N -1.20 0.18 -0.18 1.99 1.70 -0.57 -4.99 118.95 115.88 2ofn s ARG 126 Ca -0.05 0.57 -0.25 0.00 -0.47 0.00 0.00 55.73 55.53 2ofn s ARG 126 Cb -0.00 -0.11 -0.01 0.00 -0.57 0.00 0.00 34.95 34.25 2ofn s ARG 126 CO 0.04 -0.20 0.84 -1.21 -1.08 0.00 0.00 175.30 173.70 2ofn s GLU 127 N 1.56 4.28 0.00 3.89 0.41 -1.26 -3.67 118.70 123.91 2ofn s GLU 127 Ca -0.06 1.02 0.00 0.00 -0.41 0.00 0.00 54.97 55.52 2ofn s GLU 127 Cb -0.11 -3.59 0.00 0.00 -1.78 0.00 0.00 34.13 28.65 2ofn s GLU 127 CO -0.08 -0.37 0.00 -0.11 -0.49 0.00 0.00 175.26 174.21 2ofn n LEU 128 N 5.40 0.00 0.00 1.80 7.94 -1.26 -5.09 117.00 125.79 2ofn n LEU 128 Ca 0.05 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.95 2ofn n LEU 128 Cb 0.48 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.43 2ofn n LEU 128 CO 0.48 0.00 0.00 -0.62 -1.11 0.00 0.00 177.39 176.14 2ofn n GLU 129 N 0.00 -3.17 -0.10 1.96 1.02 -1.26 -5.07 120.64 114.02 2ofn n GLU 129 Ca 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.97 2ofn n GLU 129 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.35 2ofn n GLU 129 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2ofn n HIS 130 N 0.10 0.45 0.00 -0.32 8.25 -1.26 -4.86 115.22 117.59 2ofn n HIS 130 Ca 0.00 0.20 0.00 0.00 -0.26 0.00 0.00 57.72 57.66 2ofn n HIS 130 Cb 0.00 -0.85 0.00 0.00 1.12 0.00 0.00 29.99 30.26 2ofn n HIS 130 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2ofn n HIS 131 N -4.43 0.00 -3.32 4.41 -0.00 -1.26 -5.08 115.22 105.54 2ofn n HIS 131 Ca -0.28 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.14 2ofn n HIS 131 Cb 0.61 0.00 0.03 0.00 -0.00 0.00 0.00 29.99 30.62 2ofn n HIS 131 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2ofn n HIS 132 N -0.05 -2.91 -2.94 -1.40 -0.00 -1.26 -5.01 115.22 101.65 2ofn n HIS 132 Ca 0.00 1.20 0.04 0.00 -0.00 0.00 0.00 57.72 58.96 2ofn n HIS 132 Cb 0.00 -2.50 0.00 0.00 -0.00 0.00 0.00 29.99 27.49 2ofn n HIS 132 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2ofn s HIS 133 N -1.86 -0.29 0.38 1.57 2.46 -1.26 -5.06 115.29 111.23 2ofn s HIS 133 Ca 0.33 0.11 0.10 0.00 0.47 0.00 0.00 55.06 56.06 2ofn s HIS 133 Cb -0.05 0.05 0.77 0.00 -0.13 0.00 0.00 32.58 33.23 2ofn s HIS 133 CO 0.85 -0.18 1.91 1.25 -2.47 0.00 0.00 174.74 176.09 2ofn h HIS 134 N 6.22 0.24 0.00 3.88 2.76 -2.07 -3.55 115.15 122.63 2ofn h HIS 134 Ca -0.07 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.07 2ofn h HIS 134 Cb 1.21 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 30.10 2ofn h HIS 134 CO -0.15 0.37 0.00 1.58 -1.30 0.00 0.00 177.93 178.43