#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2l0a s GLY 2 N 0.00 0.28 0.35 -5.12 0.00 -1.26 -5.03 107.32 96.54 2l0a s GLY 2 Ca 0.00 -0.15 0.26 0.00 0.00 0.00 0.00 44.72 44.84 2l0a s GLY 2 CO 0.00 0.00 1.76 1.12 0.00 0.00 0.00 173.10 175.99 2l0a h HIS 3 N 6.35 0.00 -0.34 1.90 -0.00 -2.13 -3.39 115.15 117.53 2l0a h HIS 3 Ca -0.31 0.00 -0.30 0.00 -0.00 0.00 0.00 60.37 59.76 2l0a h HIS 3 Cb 1.18 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 28.57 2l0a h HIS 3 CO 0.43 0.00 0.96 -2.39 -0.00 0.00 0.00 177.93 176.94 2l0a n HIS 4 N -2.63 2.23 -2.38 6.12 -0.00 -1.26 -4.92 115.22 112.37 2l0a n HIS 4 Ca 0.03 -1.20 -0.43 0.00 -0.00 0.00 0.00 57.72 56.12 2l0a n HIS 4 Cb 0.38 -2.50 -0.02 0.00 -0.00 0.00 0.00 29.99 27.85 2l0a n HIS 4 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2l0a s HIS 5 N 11.79 2.80 -0.39 -1.40 0.00 -1.26 -5.01 115.29 121.82 2l0a s HIS 5 Ca 0.70 0.95 -0.10 0.00 -3.00 0.00 0.00 55.06 53.61 2l0a s HIS 5 Cb 0.00 -3.54 0.05 0.00 -4.00 0.00 0.00 32.58 25.09 2l0a s HIS 5 CO 0.15 -1.89 0.22 -1.58 -1.00 0.00 0.00 174.74 170.65 2l0a s HIS 6 N 3.40 3.28 0.17 0.38 5.04 -1.26 -5.07 115.29 121.24 2l0a s HIS 6 Ca 0.57 -1.25 -0.33 0.00 -1.54 0.00 0.00 55.06 52.50 2l0a s HIS 6 Cb -0.23 -2.65 -0.14 0.00 0.04 0.00 0.00 32.58 29.60 2l0a s HIS 6 CO 0.17 -0.75 1.50 -2.39 -2.34 0.00 0.00 174.74 170.94 2l0a n HIS 7 N 4.95 2.16 -2.67 3.88 -0.00 -1.26 -4.91 115.22 117.36 2l0a n HIS 7 Ca -0.11 0.35 -0.42 0.00 -0.00 0.00 0.00 57.72 57.54 2l0a n HIS 7 Cb 0.44 -2.50 -0.03 0.00 -0.00 0.00 0.00 29.99 27.91 2l0a n HIS 7 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2l0a s HIS 8 N 0.60 3.53 -0.24 -1.40 0.09 -1.26 -4.99 115.29 111.62 2l0a s HIS 8 Ca 0.76 1.59 -0.29 0.00 -0.00 0.00 0.00 55.06 57.13 2l0a s HIS 8 Cb -0.70 -3.19 -0.02 0.00 -0.00 0.00 0.00 32.58 28.66 2l0a s HIS 8 CO 0.42 -0.26 1.62 -1.54 -0.00 0.00 0.00 174.74 174.97 2l0a s SER 9 N 1.10 6.34 -0.30 1.40 1.04 -1.26 -4.89 113.70 117.13 2l0a s SER 9 Ca 0.50 1.55 0.12 0.00 0.48 0.00 0.00 55.95 58.60 2l0a s SER 9 Cb -0.20 -2.53 0.47 0.00 0.10 0.00 0.00 66.02 63.86 2l0a s SER 9 CO 0.21 -1.30 1.15 1.41 0.98 0.00 0.00 173.24 175.68 2l0a n HIS 10 N 8.62 2.30 -3.85 5.02 -0.00 -1.26 -4.89 115.22 121.16 2l0a n HIS 10 Ca 0.19 -2.30 -0.36 0.00 -0.00 0.00 0.00 57.72 55.25 2l0a n HIS 10 Cb 0.45 -0.29 -0.13 0.00 -0.00 0.00 0.00 29.99 30.02 2l0a n HIS 10 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 2l0a s MET 11 N -3.63 3.18 0.00 -0.41 -1.94 -1.26 -4.84 119.30 110.39 2l0a s MET 11 Ca 0.43 -0.78 0.00 0.00 -1.71 0.00 0.00 55.69 53.63 2l0a s MET 11 Cb 0.38 -3.18 0.00 0.00 2.01 0.00 0.00 34.83 34.05 2l0a s MET 11 CO -0.00 -0.34 0.00 0.09 -0.01 0.00 0.00 175.02 174.76 2l0a n ASN 12 N 4.81 0.00 0.22 3.03 3.02 -1.26 -4.28 115.26 120.80 2l0a n ASN 12 Ca -0.16 0.00 0.16 0.00 -0.03 0.00 0.00 54.58 54.55 2l0a n ASN 12 Cb 0.49 0.00 0.69 0.00 -0.61 0.00 0.00 39.78 40.35 2l0a n ASN 12 CO 0.00 0.00 0.00 0.45 -2.62 0.00 0.00 177.26 175.09 2l0a h HIS 13 N 0.00 0.00 0.00 3.10 3.86 -1.91 0.31 115.15 120.51 2l0a h HIS 13 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2l0a h HIS 13 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2l0a h HIS 13 CO 0.00 0.00 0.00 0.00 0.86 0.00 0.00 177.93 178.79 2l0a n GLN 14 N -3.13 0.07 -0.08 2.45 10.64 -1.26 -2.26 117.38 123.80 2l0a n GLN 14 Ca 0.03 0.42 -0.06 0.00 -1.83 0.00 0.00 57.00 55.56 2l0a n GLN 14 Cb 0.59 -1.67 -0.00 0.00 -0.86 0.00 0.00 30.24 28.30 2l0a n GLN 14 CO 0.00 0.00 0.00 1.25 -1.83 0.00 0.00 177.06 176.48 2l0a h HIS 15 N 0.00 -0.27 -0.25 2.61 2.76 -1.30 -3.43 115.15 115.26 2l0a h HIS 15 Ca 0.00 0.03 0.22 0.00 -2.20 0.00 0.00 60.37 58.43 2l0a h HIS 15 Cb 0.17 0.17 -0.19 0.00 1.55 0.00 0.00 27.41 29.11 2l0a h HIS 15 CO 0.00 -0.18 0.02 -2.00 -1.30 0.00 0.00 177.93 174.47 2l0a s GLU 16 N -6.19 0.14 -0.40 5.26 2.12 -0.96 -5.13 118.70 113.54 2l0a s GLU 16 Ca -0.14 0.16 -0.27 0.00 0.36 0.00 0.00 54.97 55.09 2l0a s GLU 16 Cb 0.13 0.08 0.02 0.00 0.26 0.00 0.00 34.13 34.62 2l0a s GLU 16 CO 0.70 -0.25 0.98 0.00 -0.54 0.00 0.00 175.26 176.15 2l0a s ALA 17 N 2.96 3.35 0.97 6.30 0.00 -1.22 -5.02 121.76 129.11 2l0a s ALA 17 Ca 0.22 -0.46 -0.12 0.00 0.00 0.00 0.00 51.96 51.60 2l0a s ALA 17 Cb -0.03 -3.63 0.17 0.00 0.00 0.00 0.00 23.12 19.63 2l0a s ALA 17 CO -0.20 -1.77 1.09 -0.98 0.00 0.00 0.00 175.76 173.89 2l0a s ARG 18 N 3.70 0.61 0.03 0.00 1.70 -1.26 -4.60 118.95 119.13 2l0a s ARG 18 Ca 0.40 0.75 0.08 0.00 -0.47 0.00 0.00 55.73 56.49 2l0a s ARG 18 Cb -0.11 -1.74 -0.02 0.00 -0.57 0.00 0.00 34.95 32.51 2l0a s ARG 18 CO 0.22 -2.66 -0.23 0.15 -1.08 0.00 0.00 175.30 171.70 2l0a s LYS 19 N -4.86 1.59 0.19 3.89 1.02 -1.26 -1.11 119.74 119.19 2l0a s LYS 19 Ca 0.65 -0.96 0.09 0.00 0.02 0.00 0.00 55.97 55.77 2l0a s LYS 19 Cb -0.19 -1.68 -0.04 0.00 -0.52 0.00 0.00 37.83 35.39 2l0a s LYS 19 CO 0.58 0.44 -0.18 0.14 -0.92 0.00 0.00 175.35 175.42 2l0a s VAL 20 N -0.74 1.89 -0.15 3.17 -7.23 -0.00 -4.73 120.40 112.61 2l0a s VAL 20 Ca 0.09 -2.05 -0.08 0.00 -1.81 0.00 0.00 61.98 58.13 2l0a s VAL 20 Cb -0.09 -1.96 -0.04 0.00 0.56 0.00 0.00 36.38 34.85 2l0a s VAL 20 CO 0.01 -0.39 0.12 -0.60 -0.31 0.00 0.00 175.10 173.93 2l0a s ARG 21 N -3.09 3.73 -0.18 4.82 3.52 -0.62 0.04 118.95 127.17 2l0a s ARG 21 Ca 0.19 -0.20 -0.29 0.00 -0.13 0.00 0.00 55.73 55.30 2l0a s ARG 21 Cb -0.04 -3.25 -0.00 0.00 -1.56 0.00 0.00 34.95 30.10 2l0a s ARG 21 CO 0.08 0.56 1.05 0.00 -0.81 0.00 0.00 175.30 176.18 2l0a s ALA 22 N -0.39 3.58 -0.11 6.12 0.00 0.06 -0.96 121.76 130.07 2l0a s ALA 22 Ca 0.11 0.29 0.21 0.00 0.00 0.00 0.00 51.96 52.57 2l0a s ALA 22 Cb -0.12 -3.52 -0.24 0.00 0.00 0.00 0.00 23.12 19.25 2l0a s ALA 22 CO 0.01 -0.90 0.55 0.44 0.00 0.00 0.00 175.76 175.87 2l0a n ILE 23 N 5.04 0.49 -4.73 0.00 -5.35 -1.02 -0.42 119.36 113.36 2l0a n ILE 23 Ca 0.11 -0.59 -0.24 0.00 -0.27 0.00 0.00 62.75 61.75 2l0a n ILE 23 Cb 0.47 -0.23 -0.16 0.00 -1.74 0.00 0.00 39.64 37.98 2l0a n ILE 23 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 2l0a s TYR 24 N -3.25 1.50 0.27 4.28 2.02 -1.01 -4.86 117.35 116.30 2l0a s TYR 24 Ca -0.06 -0.38 -0.29 0.00 -0.37 0.00 0.00 57.07 55.96 2l0a s TYR 24 Cb 0.11 -1.01 -0.09 0.00 -0.40 0.00 0.00 41.96 40.57 2l0a s TYR 24 CO 0.86 -0.11 1.02 0.16 -1.57 0.00 0.00 175.55 175.91 2l0a s ASP 25 N -0.05 7.41 -0.03 2.29 -4.77 -1.26 -4.34 116.67 115.92 2l0a s ASP 25 Ca -0.01 2.10 -0.08 0.00 -3.30 0.00 0.00 52.55 51.27 2l0a s ASP 25 Cb -0.10 -2.62 0.01 0.00 -1.09 0.00 0.00 42.92 39.13 2l0a s ASP 25 CO 0.01 -0.02 0.18 0.12 0.70 0.00 0.00 175.17 176.15 2l0a s PHE 26 N -1.21 -0.08 -0.17 2.11 5.36 -0.36 -4.90 117.98 118.73 2l0a s PHE 26 Ca 0.44 0.17 0.01 0.00 -0.96 0.00 0.00 56.93 56.59 2l0a s PHE 26 Cb -0.28 0.02 0.01 0.00 -0.34 0.00 0.00 43.02 42.42 2l0a s PHE 26 CO 0.36 -0.22 -0.17 -1.21 -1.46 0.00 0.00 175.22 172.52 2l0a s GLU 27 N -0.76 3.12 -0.33 10.12 2.02 -1.26 -1.75 118.70 129.85 2l0a s GLU 27 Ca -0.09 -0.78 -0.34 0.00 0.02 0.00 0.00 54.97 53.78 2l0a s GLU 27 Cb -0.05 -2.61 -0.10 0.00 0.10 0.00 0.00 34.13 31.47 2l0a s GLU 27 CO 0.01 -0.09 2.20 0.00 0.02 0.00 0.00 175.26 177.40 2l0a n ALA 28 N 4.33 1.19 0.16 5.21 0.00 -1.26 -4.83 120.51 125.32 2l0a n ALA 28 Ca -0.20 -0.10 0.04 0.00 0.00 0.00 0.00 53.44 53.18 2l0a n ALA 28 Cb 0.51 -2.61 0.19 0.00 0.00 0.00 0.00 19.45 17.54 2l0a n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2l0a h ALA 29 N 12.89 0.83 -2.65 0.00 0.00 -1.93 -3.46 119.26 124.94 2l0a h ALA 29 Ca -0.29 -0.42 -0.58 0.00 0.00 0.00 0.00 54.91 53.61 2l0a h ALA 29 Cb 1.31 -0.07 -0.16 0.00 0.00 0.00 0.00 17.79 18.86 2l0a h ALA 29 CO 1.01 0.58 -0.78 -1.21 0.00 0.00 0.00 179.25 178.86 2l0a s GLU 30 N -3.31 1.50 0.60 0.00 2.02 -1.26 -5.03 118.70 113.22 2l0a s GLU 30 Ca 0.02 -1.60 0.34 0.00 0.02 0.00 0.00 54.97 53.75 2l0a s GLU 30 Cb 0.10 -1.61 1.92 0.00 0.10 0.00 0.00 34.13 34.63 2l0a s GLU 30 CO 0.72 0.32 2.24 -0.44 0.02 0.00 0.00 175.26 178.12 2l0a h ASP 31 N 2.79 0.00 1.61 -0.19 5.19 -2.03 -1.98 116.42 121.82 2l0a h ASP 31 Ca -0.42 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 55.94 2l0a h ASP 31 Cb 1.23 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.73 2l0a h ASP 31 CO 0.55 0.03 -0.24 -1.13 -3.12 0.00 0.00 179.24 175.32 2l0a h ASN 32 N 0.00 0.00 -3.21 6.45 -1.24 -1.95 -3.47 115.58 112.15 2l0a h ASN 32 Ca -0.00 0.00 -0.47 0.00 0.71 0.00 0.00 56.30 56.54 2l0a h ASN 32 Cb 0.10 0.00 0.04 0.00 0.73 0.00 0.00 38.32 39.18 2l0a h ASN 32 CO 0.00 0.24 0.02 -0.70 -1.29 0.00 0.00 177.43 175.71 2l0a s GLU 33 N -3.17 3.18 -0.08 6.67 2.56 -0.74 -1.33 118.70 125.79 2l0a s GLU 33 Ca 0.05 -0.17 -0.01 0.00 0.00 0.00 0.00 54.97 54.84 2l0a s GLU 33 Cb 0.07 -2.44 -0.03 0.00 2.00 0.00 0.00 34.13 33.72 2l0a s GLU 33 CO 0.69 -0.33 -0.03 -1.17 -0.56 0.00 0.00 175.26 173.86 2l0a s LEU 34 N -4.70 3.41 -0.25 2.70 0.20 -0.48 -4.59 118.68 114.97 2l0a s LEU 34 Ca 0.49 0.07 -0.10 0.00 0.69 0.00 0.00 54.13 55.28 2l0a s LEU 34 Cb -0.10 -1.77 -0.04 0.00 -0.43 0.00 0.00 46.19 43.85 2l0a s LEU 34 CO 0.41 0.36 0.14 -0.89 -0.29 0.00 0.00 176.35 176.09 2l0a s THR 35 N -0.80 5.04 0.02 3.68 2.01 -1.26 -4.11 115.64 120.22 2l0a s THR 35 Ca 0.12 0.07 -0.28 0.00 0.31 0.00 0.00 61.69 61.92 2l0a s THR 35 Cb -0.11 -3.36 0.09 0.00 0.01 0.00 0.00 72.50 69.13 2l0a s THR 35 CO 0.02 0.33 0.81 0.72 -0.69 0.00 0.00 174.62 175.80 2l0a s PHE 36 N 1.33 -0.43 0.64 4.92 -0.12 -0.72 -4.81 117.98 118.81 2l0a s PHE 36 Ca 0.06 0.37 -0.02 0.00 -0.05 0.00 0.00 56.93 57.29 2l0a s PHE 36 Cb -0.15 0.52 0.07 0.00 -0.63 0.00 0.00 43.02 42.83 2l0a s PHE 36 CO 0.06 -0.61 0.90 0.15 -0.05 0.00 0.00 175.22 175.68 2l0a s LYS 37 N -2.89 2.20 0.13 1.99 3.01 -1.26 -1.22 119.74 121.69 2l0a s LYS 37 Ca 0.02 -0.70 -0.30 0.00 -1.01 0.00 0.00 55.97 53.97 2l0a s LYS 37 Cb -0.01 -2.35 -0.07 0.00 -1.01 0.00 0.00 37.83 34.39 2l0a s LYS 37 CO -0.07 -1.07 1.25 0.00 0.51 0.00 0.00 175.35 175.97 2l0a s ALA 38 N -3.01 3.46 0.00 5.17 0.00 -1.26 -3.02 121.76 123.09 2l0a s ALA 38 Ca 0.61 0.96 0.00 0.00 0.00 0.00 0.00 51.96 53.53 2l0a s ALA 38 Cb -0.09 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.57 2l0a s ALA 38 CO 0.42 -0.46 0.00 0.41 0.00 0.00 0.00 175.76 176.13 2l0a n GLY 39 N 2.85 2.68 3.75 0.00 0.00 0.44 -4.95 105.19 109.96 2l0a n GLY 39 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2l0a n GLY 39 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2l0a n GLU 40 N -0.93 2.46 -3.32 1.61 -0.58 -1.17 -4.64 120.64 114.07 2l0a n GLU 40 Ca 0.00 0.86 -0.46 0.00 -0.42 0.00 0.00 57.16 57.14 2l0a n GLU 40 Cb 0.00 -2.54 -0.05 0.00 -0.57 0.00 0.00 31.44 28.29 2l0a n GLU 40 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2l0a s ILE 41 N -1.09 5.25 -0.21 -3.67 -1.09 -1.26 -0.76 121.20 118.37 2l0a s ILE 41 Ca 0.54 -1.70 -0.27 0.00 -2.23 0.00 0.00 60.65 56.99 2l0a s ILE 41 Cb -0.51 -4.34 -0.00 0.00 -1.58 0.00 0.00 42.46 36.03 2l0a s ILE 41 CO 0.63 -0.90 0.94 -0.63 -1.23 0.00 0.00 174.94 173.76 2l0a s ILE 42 N 1.32 4.77 -0.50 2.92 1.09 0.11 -4.82 121.20 126.09 2l0a s ILE 42 Ca 0.06 1.84 -0.26 0.00 -1.10 0.00 0.00 60.65 61.19 2l0a s ILE 42 Cb -0.26 -4.23 0.03 0.00 -1.06 0.00 0.00 42.46 36.94 2l0a s ILE 42 CO 0.01 -0.09 1.00 -0.89 -0.10 0.00 0.00 174.94 174.86 2l0a s THR 43 N 2.77 4.36 -0.68 2.92 2.01 -0.49 -0.82 115.64 125.70 2l0a s THR 43 Ca 0.41 0.76 -0.27 0.00 0.31 0.00 0.00 61.69 62.90 2l0a s THR 43 Cb -0.16 -4.52 0.02 0.00 0.01 0.00 0.00 72.50 67.85 2l0a s THR 43 CO 0.09 -0.98 1.38 0.54 -0.69 0.00 0.00 174.62 174.96 2l0a s VAL 44 N 4.06 3.70 0.20 3.82 0.11 -0.27 -0.19 120.40 131.82 2l0a s VAL 44 Ca 0.38 0.46 0.09 0.00 -2.93 0.00 0.00 61.98 59.99 2l0a s VAL 44 Cb -0.10 -4.68 -0.10 0.00 -1.53 0.00 0.00 36.38 29.97 2l0a s VAL 44 CO 0.26 -1.56 1.46 -0.07 -3.33 0.00 0.00 175.10 171.87 2l0a h LEU 45 N 13.47 0.00 -7.43 2.54 3.38 -0.68 -3.38 115.31 123.22 2l0a h LEU 45 Ca -0.27 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.55 2l0a h LEU 45 Cb 1.07 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 41.58 2l0a h LEU 45 CO 1.25 0.78 -0.36 -0.62 0.09 0.00 0.00 178.44 179.58 2l0a s ASP 46 N -6.78 -0.30 -0.48 -0.43 2.15 -1.18 -4.78 116.67 104.87 2l0a s ASP 46 Ca -0.00 0.57 0.05 0.00 0.43 0.00 0.00 52.55 53.59 2l0a s ASP 46 Cb 0.11 0.60 0.18 0.00 -0.30 0.00 0.00 42.92 43.51 2l0a s ASP 46 CO 0.79 -0.13 0.40 -0.90 -0.17 0.00 0.00 175.17 175.16 2l0a n ASP 47 N 2.80 0.45 -0.05 -0.34 5.75 -1.26 -0.78 116.55 123.12 2l0a n ASP 47 Ca -0.13 -2.61 -0.19 0.00 -0.01 0.00 0.00 54.79 51.84 2l0a n ASP 47 Cb 0.58 -0.61 -0.13 0.00 -1.03 0.00 0.00 41.12 39.93 2l0a n ASP 47 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2l0a h SER 48 N 5.43 0.14 -4.05 -1.12 0.02 -2.00 -3.47 113.55 108.50 2l0a h SER 48 Ca 0.23 -0.80 -0.69 0.00 -0.84 0.00 0.00 61.79 59.69 2l0a h SER 48 Cb 0.87 -0.05 -0.24 0.00 0.14 0.00 0.00 62.40 63.12 2l0a h SER 48 CO 0.47 1.36 -0.78 -1.81 -1.14 0.00 0.00 176.83 174.93 2l0a s ASP 49 N -6.71 3.95 0.65 3.07 1.11 -1.24 -5.01 116.67 112.49 2l0a s ASP 49 Ca -0.22 -0.22 0.39 0.00 0.18 0.00 0.00 52.55 52.68 2l0a s ASP 49 Cb 0.02 -0.83 2.12 0.00 1.07 0.00 0.00 42.92 45.30 2l0a s ASP 49 CO 0.69 0.34 2.19 1.55 1.18 0.00 0.00 175.17 181.12 2l0a h PRO 50 N 5.40 0.00 0.01 8.23 0.13 -2.02 -1.08 132.00 142.67 2l0a h PRO 50 Ca -0.45 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.32 2l0a h PRO 50 Cb 1.15 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.22 2l0a h PRO 50 CO 0.50 0.00 -2.23 0.09 -0.23 0.00 0.00 178.00 176.13 2l0a n ASN 51 N -2.97 0.63 -4.24 1.44 4.13 -1.26 -4.82 115.26 108.17 2l0a n ASN 51 Ca -0.03 0.08 -0.43 0.00 1.68 0.00 0.00 54.58 55.89 2l0a n ASN 51 Cb 0.17 0.43 -0.06 0.00 -1.54 0.00 0.00 39.78 38.79 2l0a n ASN 51 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 2l0a s TRP 52 N -2.52 3.57 -0.05 3.10 0.52 -0.41 -3.87 118.94 119.28 2l0a s TRP 52 Ca -0.13 -2.16 -0.04 0.00 0.02 0.00 0.00 56.10 53.79 2l0a s TRP 52 Cb 0.07 -3.58 -0.04 0.00 -1.15 0.00 0.00 33.47 28.77 2l0a s TRP 52 CO 0.79 -0.95 0.14 -1.58 0.02 0.00 0.00 176.95 175.38 2l0a s TRP 53 N 0.36 3.52 -0.34 -1.98 0.52 -1.26 -3.59 118.94 116.16 2l0a s TRP 53 Ca 0.15 0.39 -0.13 0.00 0.02 0.00 0.00 56.10 56.54 2l0a s TRP 53 Cb -0.17 -1.86 -0.01 0.00 -1.15 0.00 0.00 33.47 30.28 2l0a s TRP 53 CO -0.05 0.66 0.24 0.21 0.02 0.00 0.00 176.95 178.03 2l0a s LYS 54 N -1.52 3.46 0.08 4.98 2.20 0.03 -3.16 119.74 125.81 2l0a s LYS 54 Ca 0.21 -0.67 0.07 0.00 -0.36 0.00 0.00 55.97 55.23 2l0a s LYS 54 Cb -0.12 -3.80 -0.04 0.00 -1.51 0.00 0.00 37.83 32.36 2l0a s LYS 54 CO 0.12 -0.46 -0.15 0.20 -0.36 0.00 0.00 175.35 174.70 2l0a s GLY 55 N 1.71 1.68 -0.16 5.54 0.00 -0.48 0.07 107.32 115.69 2l0a s GLY 55 Ca 0.06 -1.25 -0.02 0.00 0.00 0.00 0.00 44.72 43.52 2l0a s GLY 55 CO 0.10 -1.19 -0.10 1.85 0.00 0.00 0.00 173.10 173.77 2l0a s GLU 56 N -1.85 3.43 0.35 2.90 -6.30 0.73 -2.38 118.70 115.57 2l0a s GLU 56 Ca 0.17 -0.64 0.04 0.00 -2.50 0.00 0.00 54.97 52.04 2l0a s GLU 56 Cb -0.11 -2.77 -0.04 0.00 0.00 0.00 0.00 34.13 31.22 2l0a s GLU 56 CO 0.09 0.12 0.13 0.95 0.02 0.00 0.00 175.26 176.57 2l0a s THR 57 N 0.62 0.59 -2.00 -1.70 -4.23 -0.56 -1.40 115.64 106.96 2l0a s THR 57 Ca -0.06 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 58.61 2l0a s THR 57 Cb -0.15 -2.50 0.43 0.00 1.34 0.00 0.00 72.50 71.63 2l0a s THR 57 CO 0.03 0.00 1.36 1.41 -0.54 0.00 0.00 174.62 176.87 2l0a n HIS 58 N -0.73 0.00 -0.07 3.99 8.25 -1.26 -3.09 115.22 122.31 2l0a n HIS 58 Ca -0.02 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.29 2l0a n HIS 58 Cb 0.65 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.71 2l0a n HIS 58 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 2l0a n GLN 59 N -0.88 0.29 -0.93 -0.41 7.27 -1.26 -5.15 117.38 116.32 2l0a n GLN 59 Ca 0.11 0.13 0.00 0.00 0.07 0.00 0.00 57.00 57.31 2l0a n GLN 59 Cb 0.05 -1.01 0.00 0.00 2.41 0.00 0.00 30.24 31.70 2l0a n GLN 59 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2l0a n GLY 60 N 2.17 0.88 3.28 1.69 0.00 -1.18 -5.15 105.19 106.89 2l0a n GLY 60 Ca -0.27 -0.73 -0.32 0.00 0.00 0.00 0.00 46.02 44.70 2l0a n GLY 60 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2l0a s ILE 61 N -2.17 2.23 0.14 -0.61 1.01 -1.26 -1.50 121.20 119.04 2l0a s ILE 61 Ca 0.00 -0.99 -0.13 0.00 0.00 0.00 0.00 60.65 59.53 2l0a s ILE 61 Cb 0.00 -1.84 0.05 0.00 0.01 0.00 0.00 42.46 40.68 2l0a s ILE 61 CO 0.00 0.56 0.65 0.61 0.00 0.00 0.00 174.94 176.76 2l0a n GLY 62 N 3.10 0.92 3.87 6.18 0.00 -1.00 -4.95 105.19 113.31 2l0a n GLY 62 Ca -0.18 -1.09 -0.23 0.00 0.00 0.00 0.00 46.02 44.52 2l0a n GLY 62 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2l0a s LEU 63 N 0.00 3.98 -0.41 0.99 1.43 -0.44 -1.38 118.68 122.86 2l0a s LEU 63 Ca 0.14 -0.11 0.09 0.00 -1.03 0.00 0.00 54.13 53.22 2l0a s LEU 63 Cb -0.02 -2.54 0.30 0.00 0.03 0.00 0.00 46.19 43.96 2l0a s LEU 63 CO 0.04 -0.01 0.75 2.22 0.23 0.00 0.00 176.35 179.58 2l0a n PHE 64 N -1.00 -1.06 0.27 0.29 -1.74 -1.19 -1.38 117.46 111.65 2l0a n PHE 64 Ca -0.08 -3.13 0.18 0.00 -0.56 0.00 0.00 57.45 53.86 2l0a n PHE 64 Cb 0.57 0.25 0.96 0.00 1.52 0.00 0.00 39.48 42.78 2l0a n PHE 64 CO 0.00 0.00 0.00 -1.00 -0.56 0.00 0.00 176.76 175.20 2l0a h PRO 65 N 3.48 0.00 0.00 3.97 0.13 -1.86 -0.19 132.00 137.53 2l0a h PRO 65 Ca 0.02 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.14 2l0a h PRO 65 Cb 0.97 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.10 2l0a h PRO 65 CO 0.40 0.00 -0.05 0.77 -0.23 0.00 0.00 178.00 178.88 2l0a h SER 66 N 0.00 0.00 -5.63 1.44 0.02 -1.93 -3.46 113.55 103.99 2l0a h SER 66 Ca 0.00 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.85 2l0a h SER 66 Cb 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.56 2l0a h SER 66 CO 0.00 0.05 -0.59 -3.20 -1.14 0.00 0.00 176.83 171.95 2l0a n ASN 67 N -4.46 -7.28 -1.06 3.07 2.85 -0.08 -4.95 115.26 103.34 2l0a n ASN 67 Ca -0.03 0.22 0.02 0.00 -0.11 0.00 0.00 54.58 54.68 2l0a n ASN 67 Cb 0.14 -4.45 0.23 0.00 1.24 0.00 0.00 39.78 36.94 2l0a n ASN 67 CO 0.00 0.00 0.00 2.22 -2.11 0.00 0.00 177.26 177.37 2l0a n PHE 68 N -0.65 1.10 -4.48 1.20 1.16 -1.26 -5.00 117.46 109.53 2l0a n PHE 68 Ca 0.03 -1.22 -0.21 0.00 -1.87 0.00 0.00 57.45 54.19 2l0a n PHE 68 Cb 0.52 -0.42 -0.04 0.00 -1.61 0.00 0.00 39.48 37.93 2l0a n PHE 68 CO 0.00 0.00 0.00 1.33 -1.87 0.00 0.00 176.76 176.22 2l0a n VAL 69 N -0.80 0.00 -3.60 1.97 0.24 -1.26 -2.40 118.33 112.47 2l0a n VAL 69 Ca 0.28 -1.54 -0.09 0.00 -2.04 0.00 0.00 64.34 60.95 2l0a n VAL 69 Cb 0.99 0.32 -0.02 0.00 -1.47 0.00 0.00 33.84 33.66 2l0a n VAL 69 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2l0a s THR 70 N -2.19 0.00 -0.55 3.34 -1.32 -0.14 -4.81 115.64 109.97 2l0a s THR 70 Ca 0.01 -0.38 -0.28 0.00 -1.21 0.00 0.00 61.69 59.83 2l0a s THR 70 Cb 0.00 -1.42 0.01 0.00 -1.51 0.00 0.00 72.50 69.59 2l0a s THR 70 CO 0.00 0.00 1.40 0.00 -2.21 0.00 0.00 174.62 173.81 2l0a s ALA 71 N -3.65 2.84 -2.38 11.08 0.00 -1.26 -1.59 121.76 126.80 2l0a s ALA 71 Ca 0.06 -0.63 0.29 0.00 0.00 0.00 0.00 51.96 51.68 2l0a s ALA 71 Cb -0.03 -4.08 1.25 0.00 0.00 0.00 0.00 23.12 20.26 2l0a s ALA 71 CO -0.05 -2.86 1.86 -3.47 0.00 0.00 0.00 175.76 171.24