#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l3n n THR 2 N 0.00 0.00 -4.69 0.00 5.66 -1.26 -4.99 114.28 109.00 1l3n n THR 2 Ca 0.00 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.68 1l3n n THR 2 Cb 0.00 -0.04 -0.12 0.00 -1.55 0.00 0.00 70.33 68.62 1l3n n THR 2 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 1l3n s LYS 3 N -1.43 2.38 0.22 1.09 2.20 -1.26 -0.03 119.74 122.92 1l3n s LYS 3 Ca 0.00 -0.79 0.00 0.00 -0.36 0.00 0.00 55.97 54.82 1l3n s LYS 3 Cb 0.00 -2.36 -0.04 0.00 -1.51 0.00 0.00 37.83 33.92 1l3n s LYS 3 CO 0.00 0.59 0.15 0.00 -0.36 0.00 0.00 175.35 175.73 1l3n s ALA 4 N -0.87 1.28 0.15 3.13 0.00 0.12 -0.59 121.76 124.97 1l3n s ALA 4 Ca 0.14 -1.75 -0.01 0.00 0.00 0.00 0.00 51.96 50.34 1l3n s ALA 4 Cb -0.11 1.38 -0.04 0.00 0.00 0.00 0.00 23.12 24.36 1l3n s ALA 4 CO 0.04 -0.59 0.09 0.14 0.00 0.00 0.00 175.76 175.44 1l3n s VAL 5 N -4.06 0.07 -0.20 0.00 -7.23 0.95 -0.33 120.40 109.60 1l3n s VAL 5 Ca 0.39 -1.91 -0.04 0.00 -1.81 0.00 0.00 61.98 58.61 1l3n s VAL 5 Cb 0.07 -2.16 0.10 0.00 0.56 0.00 0.00 36.38 34.95 1l3n s VAL 5 CO 0.14 -0.33 0.29 0.00 -0.31 0.00 0.00 175.10 174.88 1l3n s ALA 6 N -4.07 -0.62 -0.35 1.32 0.00 -0.32 -0.80 121.76 116.92 1l3n s ALA 6 Ca 0.28 0.64 -0.15 0.00 0.00 0.00 0.00 51.96 52.73 1l3n s ALA 6 Cb 0.07 -1.37 -0.01 0.00 0.00 0.00 0.00 23.12 21.81 1l3n s ALA 6 CO 0.04 -1.10 0.35 0.14 0.00 0.00 0.00 175.76 175.20 1l3n s VAL 7 N 2.42 5.18 -0.12 0.00 -7.23 -1.26 -0.75 120.40 118.64 1l3n s VAL 7 Ca 0.07 -0.05 -0.05 0.00 -1.81 0.00 0.00 61.98 60.14 1l3n s VAL 7 Cb -0.15 -3.83 -0.04 0.00 0.56 0.00 0.00 36.38 32.92 1l3n s VAL 7 CO -0.13 -0.12 0.07 -0.76 -0.31 0.00 0.00 175.10 173.85 1l3n s LEU 8 N 1.98 3.94 0.16 1.32 2.01 0.38 -4.27 118.68 124.20 1l3n s LEU 8 Ca 0.11 0.25 -0.08 0.00 0.01 0.00 0.00 54.13 54.42 1l3n s LEU 8 Cb -0.17 -1.95 -0.01 0.00 0.01 0.00 0.00 46.19 44.07 1l3n s LEU 8 CO 0.12 0.33 0.25 -0.54 1.01 0.00 0.00 176.35 177.52 1l3n s LYS 9 N -0.59 1.13 0.23 1.70 1.02 -0.45 -0.15 119.74 122.63 1l3n s LYS 9 Ca 0.11 -1.22 0.00 0.00 0.02 0.00 0.00 55.97 54.88 1l3n s LYS 9 Cb -0.12 0.36 0.00 0.00 -0.52 0.00 0.00 37.83 37.55 1l3n s LYS 9 CO 0.02 -0.40 0.00 0.41 -0.92 0.00 0.00 175.35 174.46 1l3n n GLY 10 N -0.20 -1.49 0.14 -3.33 0.00 -1.26 -0.84 105.19 98.22 1l3n n GLY 10 Ca -0.07 0.43 -0.16 0.00 0.00 0.00 0.00 46.02 46.23 1l3n n GLY 10 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1l3n h ASP 11 N 0.00 0.48 0.00 1.61 5.19 -1.80 -3.49 116.42 118.41 1l3n h ASP 11 Ca 0.00 -0.70 0.00 0.00 -0.62 0.00 0.00 57.03 55.71 1l3n h ASP 11 Cb 0.00 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 39.37 1l3n h ASP 11 CO 0.00 1.10 0.00 0.61 -3.12 0.00 0.00 179.24 177.83 1l3n n GLY 12 N 0.86 2.52 0.35 2.75 0.00 -1.26 -4.89 105.19 105.51 1l3n n GLY 12 Ca -0.09 -0.51 0.03 0.00 0.00 0.00 0.00 46.02 45.44 1l3n n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1l3n h PRO 13 N 0.00 0.90 -6.13 1.61 0.13 -1.93 -3.38 132.00 123.20 1l3n h PRO 13 Ca 0.00 -0.05 -0.55 0.00 -0.87 0.00 0.00 66.00 64.53 1l3n h PRO 13 Cb 0.00 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 30.90 1l3n h PRO 13 CO 0.00 0.59 1.34 0.08 -0.23 0.00 0.00 178.00 179.78 1l3n s VAL 14 N -5.79 3.38 -0.28 1.56 1.01 -1.26 -3.92 120.40 115.10 1l3n s VAL 14 Ca -0.11 0.35 0.03 0.00 0.00 0.00 0.00 61.98 62.25 1l3n s VAL 14 Cb 0.18 -3.63 0.07 0.00 0.00 0.00 0.00 36.38 33.01 1l3n s VAL 14 CO 0.78 -0.48 -0.04 0.00 0.00 0.00 0.00 175.10 175.35 1l3n s GLN 15 N 6.26 1.83 0.13 2.72 -2.07 0.16 -4.00 119.66 124.69 1l3n s GLN 15 Ca 0.79 -1.40 -0.16 0.00 -1.82 0.00 0.00 55.36 52.77 1l3n s GLN 15 Cb -0.20 -2.87 -0.07 0.00 -1.09 0.00 0.00 33.01 28.78 1l3n s GLN 15 CO 0.30 -0.70 0.58 0.20 -1.32 0.00 0.00 175.29 174.35 1l3n s GLY 16 N 1.13 2.54 -0.43 2.60 0.00 0.78 -1.07 107.32 112.89 1l3n s GLY 16 Ca -0.02 -0.05 0.05 0.00 0.00 0.00 0.00 44.72 44.70 1l3n s GLY 16 CO -0.07 0.29 0.49 -0.42 0.00 0.00 0.00 173.10 173.38 1l3n s ILE 17 N -1.37 -0.39 0.05 0.90 1.01 -1.25 -0.47 121.20 119.68 1l3n s ILE 17 Ca 0.36 -1.36 -0.07 0.00 0.00 0.00 0.00 60.65 59.57 1l3n s ILE 17 Cb -0.17 -0.58 -0.05 0.00 0.01 0.00 0.00 42.46 41.67 1l3n s ILE 17 CO 0.19 -0.55 0.32 -0.51 0.00 0.00 0.00 174.94 174.40 1l3n s ILE 18 N 0.93 5.22 -0.14 2.92 1.10 0.07 -0.85 121.20 130.44 1l3n s ILE 18 Ca 0.25 0.24 -0.00 0.00 -0.51 0.00 0.00 60.65 60.63 1l3n s ILE 18 Cb -0.05 -3.60 0.03 0.00 0.15 0.00 0.00 42.46 38.99 1l3n s ILE 18 CO -0.08 0.30 -0.07 0.20 -2.11 0.00 0.00 174.94 173.18 1l3n s ASN 19 N -1.81 2.56 -0.21 4.50 0.02 0.02 -1.18 114.94 118.84 1l3n s ASN 19 Ca 0.31 -0.50 -0.15 0.00 -1.02 0.00 0.00 52.86 51.50 1l3n s ASN 19 Cb -0.13 -0.90 -0.04 0.00 0.02 0.00 0.00 41.25 40.19 1l3n s ASN 19 CO 0.18 -0.15 0.35 -0.36 0.02 0.00 0.00 177.10 177.14 1l3n s PHE 20 N 1.65 3.37 -0.13 2.20 0.08 0.55 -2.37 117.98 123.34 1l3n s PHE 20 Ca 0.03 0.54 -0.02 0.00 0.12 0.00 0.00 56.93 57.59 1l3n s PHE 20 Cb -0.14 -2.47 -0.03 0.00 -0.57 0.00 0.00 43.02 39.81 1l3n s PHE 20 CO -0.08 0.02 -0.05 -2.00 -0.10 0.00 0.00 175.22 173.01 1l3n s GLU 21 N 1.22 3.39 -0.52 0.44 -6.30 0.32 -0.70 118.70 116.55 1l3n s GLU 21 Ca 0.17 -0.53 0.04 0.00 -2.50 0.00 0.00 54.97 52.15 1l3n s GLU 21 Cb -0.14 -2.81 0.17 0.00 0.00 0.00 0.00 34.13 31.35 1l3n s GLU 21 CO 0.07 0.37 0.40 0.94 0.02 0.00 0.00 175.26 177.07 1l3n n GLN 22 N 3.12 0.81 -0.18 4.30 7.27 0.96 -1.05 117.38 132.62 1l3n n GLN 22 Ca -0.18 -3.66 -0.03 0.00 0.07 0.00 0.00 57.00 53.20 1l3n n GLN 22 Cb 0.53 -1.89 0.07 0.00 2.41 0.00 0.00 30.24 31.36 1l3n n GLN 22 CO 0.00 0.00 0.00 -0.22 0.07 0.00 0.00 177.06 176.91 1l3n h LYS 23 N 5.49 0.47 -5.87 3.69 3.64 -1.88 -3.41 116.57 118.70 1l3n h LYS 23 Ca 0.22 -0.03 -0.55 0.00 -1.27 0.00 0.00 60.65 59.03 1l3n h LYS 23 Cb 0.85 -0.11 -0.14 0.00 -0.41 0.00 0.00 32.23 32.42 1l3n h LYS 23 CO 0.50 0.31 -0.72 -2.00 -2.27 0.00 0.00 179.45 175.27 1l3n s GLU 24 N -6.12 1.59 0.52 1.90 -6.30 -1.26 -4.99 118.70 104.04 1l3n s GLU 24 Ca -0.13 -1.75 0.18 0.00 -2.50 0.00 0.00 54.97 50.77 1l3n s GLU 24 Cb 0.15 -1.48 1.28 0.00 0.00 0.00 0.00 34.13 34.08 1l3n s GLU 24 CO 0.74 0.21 2.10 1.03 0.02 0.00 0.00 175.26 179.36 1l3n h SER 25 N 2.30 0.03 0.44 -1.70 0.87 -1.95 -0.97 113.55 112.58 1l3n h SER 25 Ca -0.40 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.16 1l3n h SER 25 Cb 1.24 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.20 1l3n h SER 25 CO 0.64 0.02 -0.47 0.59 -0.53 0.00 0.00 176.83 177.08 1l3n n ASN 26 N -4.49 0.60 -4.76 6.23 3.02 -1.26 -4.89 115.26 109.72 1l3n n ASN 26 Ca 0.01 -0.38 -0.41 0.00 -0.03 0.00 0.00 54.58 53.78 1l3n n ASN 26 Cb 0.23 0.25 -0.04 0.00 -0.61 0.00 0.00 39.78 39.61 1l3n n ASN 26 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1l3n s GLY 27 N -2.91 2.95 0.30 7.41 0.00 -0.37 -4.99 107.32 109.71 1l3n s GLY 27 Ca 0.13 0.99 -0.30 0.00 0.00 0.00 0.00 44.72 45.55 1l3n s GLY 27 CO 0.67 1.68 1.60 -1.55 0.00 0.00 0.00 173.10 175.50 1l3n n PRO 28 N 1.42 2.73 -2.64 2.90 -0.04 -1.26 -4.83 135.00 133.27 1l3n n PRO 28 Ca 0.00 0.97 -0.42 0.00 -0.04 0.00 0.00 63.50 64.01 1l3n n PRO 28 Cb 0.44 -2.75 -0.03 0.00 -0.04 0.00 0.00 33.50 31.12 1l3n n PRO 28 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1l3n s VAL 29 N -0.08 4.68 -0.30 0.52 1.01 0.66 -4.83 120.40 122.06 1l3n s VAL 29 Ca 0.63 1.93 -0.11 0.00 0.00 0.00 0.00 61.98 64.43 1l3n s VAL 29 Cb -0.49 -4.24 -0.03 0.00 0.00 0.00 0.00 36.38 31.62 1l3n s VAL 29 CO 0.50 0.12 0.19 -0.54 0.00 0.00 0.00 175.10 175.37 1l3n s LYS 30 N 1.23 3.72 -0.60 2.72 -0.14 -0.21 -0.92 119.74 125.55 1l3n s LYS 30 Ca 0.53 -0.47 -0.12 0.00 -1.36 0.00 0.00 55.97 54.54 1l3n s LYS 30 Cb -0.22 -3.66 0.15 0.00 -1.68 0.00 0.00 37.83 32.42 1l3n s LYS 30 CO 0.26 -0.28 0.52 0.14 -0.76 0.00 0.00 175.35 175.23 1l3n s VAL 31 N 1.72 4.89 0.37 3.17 -7.23 0.12 -0.53 120.40 122.92 1l3n s VAL 31 Ca 0.06 -1.95 0.07 0.00 -1.81 0.00 0.00 61.98 58.36 1l3n s VAL 31 Cb -0.16 -4.13 -0.01 0.00 0.56 0.00 0.00 36.38 32.63 1l3n s VAL 31 CO 0.10 -0.88 0.41 -1.66 -0.31 0.00 0.00 175.10 172.76 1l3n s TRP 32 N 1.03 2.90 -0.99 2.82 -2.14 -1.00 -1.11 118.94 120.45 1l3n s TRP 32 Ca 0.09 -0.34 0.00 0.00 2.66 0.00 0.00 56.10 58.51 1l3n s TRP 32 Cb -0.23 -2.05 0.00 0.00 -3.10 0.00 0.00 33.47 28.09 1l3n s TRP 32 CO -0.02 -0.05 0.00 0.41 -2.66 0.00 0.00 176.95 174.63 1l3n n GLY 33 N -1.58 -1.41 3.00 3.67 0.00 0.14 -0.80 105.19 108.21 1l3n n GLY 33 Ca 0.02 -1.03 -0.07 0.00 0.00 0.00 0.00 46.02 44.94 1l3n n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1l3n s SER 34 N -0.90 -0.29 0.47 1.61 0.01 -0.03 -0.83 113.70 113.74 1l3n s SER 34 Ca 0.00 -1.00 -0.19 0.00 1.31 0.00 0.00 55.95 56.07 1l3n s SER 34 Cb 0.00 1.33 -0.09 0.00 0.21 0.00 0.00 66.02 67.47 1l3n s SER 34 CO 0.00 -0.23 0.98 0.27 0.41 0.00 0.00 173.24 174.67 1l3n s ILE 35 N 1.81 4.32 0.08 1.44 -4.36 -0.78 -3.80 121.20 119.91 1l3n s ILE 35 Ca 0.15 1.32 0.02 0.00 -0.26 0.00 0.00 60.65 61.88 1l3n s ILE 35 Cb -0.10 -3.60 -0.04 0.00 1.25 0.00 0.00 42.46 39.97 1l3n s ILE 35 CO -0.09 -0.44 -0.07 -1.59 0.24 0.00 0.00 174.94 172.99 1l3n s LYS 36 N -3.52 0.74 0.00 0.37 -2.85 -0.23 -0.89 119.74 113.36 1l3n s LYS 36 Ca 0.62 -1.14 0.00 0.00 -1.00 0.00 0.00 55.97 54.45 1l3n s LYS 36 Cb -0.11 -0.26 0.00 0.00 -2.06 0.00 0.00 37.83 35.40 1l3n s LYS 36 CO 0.21 0.01 0.00 0.41 0.10 0.00 0.00 175.35 176.08 1l3n n GLY 37 N 0.49 0.58 3.57 0.59 0.00 -1.19 -0.67 105.19 108.57 1l3n n GLY 37 Ca -0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 1l3n n GLY 37 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l3n s LEU 38 N 0.00 0.67 0.09 0.99 2.01 -1.13 -4.28 118.68 117.02 1l3n s LEU 38 Ca 0.00 0.77 0.03 0.00 0.01 0.00 0.00 54.13 54.94 1l3n s LEU 38 Cb 0.00 -2.55 -0.04 0.00 0.01 0.00 0.00 46.19 43.61 1l3n s LEU 38 CO 0.00 -4.09 0.09 0.28 1.01 0.00 0.00 176.35 173.63 1l3n s THR 39 N -2.91 4.56 0.47 5.49 -1.32 -1.26 -3.75 115.64 116.91 1l3n s THR 39 Ca 0.70 -0.78 -0.22 0.00 -1.21 0.00 0.00 61.69 60.18 1l3n s THR 39 Cb -0.12 -3.21 -0.10 0.00 -1.51 0.00 0.00 72.50 67.56 1l3n s THR 39 CO 0.57 0.11 0.81 1.21 -2.21 0.00 0.00 174.62 175.10 1l3n n GLU 40 N 0.39 0.94 0.00 7.08 2.13 -1.25 -4.62 120.64 125.31 1l3n n GLU 40 Ca -0.08 0.35 0.00 0.00 0.66 0.00 0.00 57.16 58.08 1l3n n GLU 40 Cb 0.52 -1.87 0.00 0.00 0.27 0.00 0.00 31.44 30.36 1l3n n GLU 40 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1l3n n GLY 41 N 1.45 -4.14 3.69 8.31 0.00 0.16 -4.85 105.19 109.81 1l3n n GLY 41 Ca 0.11 -2.12 -0.38 0.00 0.00 0.00 0.00 46.02 43.63 1l3n n GLY 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1l3n n LEU 42 N 0.00 4.94 -3.73 0.99 4.77 -1.26 -0.61 117.00 122.11 1l3n n LEU 42 Ca 0.00 0.86 -0.14 0.00 -0.03 0.00 0.00 56.01 56.71 1l3n n LEU 42 Cb 0.00 -1.49 -0.09 0.00 -2.33 0.00 0.00 43.42 39.51 1l3n n LEU 42 CO 0.00 -1.23 0.07 -1.00 -1.33 0.00 0.00 177.39 173.91 1l3n s HIS 43 N -1.40 -0.28 -0.15 -1.77 3.76 0.20 -3.90 115.29 111.75 1l3n s HIS 43 Ca 0.77 0.51 -0.28 0.00 -0.15 0.00 0.00 55.06 55.91 1l3n s HIS 43 Cb -0.41 0.14 -0.13 0.00 1.11 0.00 0.00 32.58 33.29 1l3n s HIS 43 CO 0.45 -0.37 0.87 0.41 -0.85 0.00 0.00 174.74 175.25 1l3n n GLY 44 N 1.57 -0.04 2.96 -2.22 0.00 0.49 -0.80 105.19 107.15 1l3n n GLY 44 Ca -0.20 0.58 -0.07 0.00 0.00 0.00 0.00 46.02 46.34 1l3n n GLY 44 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1l3n s PHE 45 N 0.92 -1.02 0.25 1.61 5.36 -1.26 -0.95 117.98 122.89 1l3n s PHE 45 Ca 0.64 0.87 -0.16 0.00 -0.96 0.00 0.00 56.93 57.32 1l3n s PHE 45 Cb -0.91 0.08 0.01 0.00 -0.34 0.00 0.00 43.02 41.86 1l3n s PHE 45 CO 0.45 -0.81 0.56 -1.01 -1.46 0.00 0.00 175.22 172.95 1l3n s HIS 46 N 2.60 0.13 0.40 10.12 3.76 -0.76 -2.15 115.29 129.40 1l3n s HIS 46 Ca 0.13 -0.53 -0.13 0.00 -0.15 0.00 0.00 55.06 54.38 1l3n s HIS 46 Cb -0.15 0.38 -0.08 0.00 1.11 0.00 0.00 32.58 33.85 1l3n s HIS 46 CO -0.20 -1.07 0.81 0.14 -0.85 0.00 0.00 174.74 173.56 1l3n s VAL 47 N -3.97 4.69 0.07 -0.90 -7.23 0.19 -0.57 120.40 112.68 1l3n s VAL 47 Ca 0.17 0.85 0.06 0.00 -1.81 0.00 0.00 61.98 61.26 1l3n s VAL 47 Cb -0.03 -3.69 -0.03 0.00 0.56 0.00 0.00 36.38 33.20 1l3n s VAL 47 CO 0.07 -0.45 -0.17 -1.00 -0.31 0.00 0.00 175.10 173.24 1l3n s HIS 48 N -2.30 1.48 0.12 2.82 3.76 0.95 -4.66 115.29 117.46 1l3n s HIS 48 Ca 0.54 -0.41 -0.22 0.00 -0.15 0.00 0.00 55.06 54.81 1l3n s HIS 48 Cb -0.10 -0.84 -0.05 0.00 1.11 0.00 0.00 32.58 32.70 1l3n s HIS 48 CO 0.27 0.11 1.18 -1.91 -0.85 0.00 0.00 174.74 173.54 1l3n n GLU 49 N 1.42 -0.32 -3.74 1.40 2.13 -0.98 -3.06 120.64 117.49 1l3n n GLU 49 Ca -0.19 1.16 -0.21 0.00 0.66 0.00 0.00 57.16 58.58 1l3n n GLU 49 Cb 0.54 -1.71 -0.01 0.00 0.27 0.00 0.00 31.44 30.52 1l3n n GLU 49 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 1l3n s PHE 50 N -5.17 3.39 -0.16 4.31 0.08 0.73 -4.75 117.98 116.41 1l3n s PHE 50 Ca -0.09 0.01 0.20 0.00 0.12 0.00 0.00 56.93 57.18 1l3n s PHE 50 Cb 0.08 -1.73 -0.12 0.00 -0.57 0.00 0.00 43.02 40.67 1l3n s PHE 50 CO 0.45 0.27 0.80 0.41 -0.10 0.00 0.00 175.22 177.05 1l3n n GLY 51 N -1.54 -1.26 3.50 4.36 0.00 -0.98 -0.44 105.19 108.84 1l3n n GLY 51 Ca -0.06 -0.24 -0.49 0.00 0.00 0.00 0.00 46.02 45.22 1l3n n GLY 51 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1l3n n ASP 52 N -2.70 0.19 -0.61 1.61 2.03 -1.26 -4.66 116.55 111.15 1l3n n ASP 52 Ca -0.07 1.15 0.00 0.00 0.52 0.00 0.00 54.79 56.40 1l3n n ASP 52 Cb 0.70 -1.09 0.00 0.00 -0.72 0.00 0.00 41.12 40.02 1l3n n ASP 52 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1l3n n ASN 53 N 1.78 0.09 -0.33 1.67 5.03 -1.26 -1.44 115.26 120.79 1l3n n ASN 53 Ca 0.16 -1.93 0.13 0.00 0.87 0.00 0.00 54.58 53.80 1l3n n ASN 53 Cb 0.24 -0.19 0.34 0.00 -1.02 0.00 0.00 39.78 39.15 1l3n n ASN 53 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.26 176.14 1l3n h THR 54 N 6.85 0.74 0.00 3.41 1.35 -1.95 0.25 112.91 123.57 1l3n h THR 54 Ca -0.03 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.58 1l3n h THR 54 Cb 1.42 -0.07 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 1l3n h THR 54 CO 0.01 0.14 0.00 0.00 -0.25 0.00 0.00 175.52 175.41 1l3n n ALA 55 N -2.37 2.06 0.00 6.62 0.00 -1.26 -4.93 120.51 120.62 1l3n n ALA 55 Ca 0.22 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1l3n n ALA 55 Cb 0.55 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1l3n n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l3n n GLY 56 N 0.87 2.62 2.64 0.00 0.00 0.89 -4.66 105.19 107.55 1l3n n GLY 56 Ca 0.05 -0.81 -0.09 0.00 0.00 0.00 0.00 46.02 45.17 1l3n n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l3n n THR 58 N -0.05 0.00 -0.11 0.00 -1.04 -1.26 -4.83 114.28 106.99 1l3n n THR 58 Ca 0.05 0.00 0.26 0.00 -2.04 0.00 0.00 64.05 62.33 1l3n n THR 58 Cb 0.76 -0.55 0.72 0.00 -1.82 0.00 0.00 70.33 69.45 1l3n n THR 58 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1l3n h SER 59 N 0.00 0.00 -0.64 8.00 0.02 -1.88 -0.01 113.55 119.03 1l3n h SER 59 Ca 0.00 0.00 0.24 0.00 -0.84 0.00 0.00 61.79 61.19 1l3n h SER 59 Cb 0.27 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 62.69 1l3n h SER 59 CO 0.00 0.00 0.23 0.00 -1.14 0.00 0.00 176.83 175.92 1l3n n ALA 60 N -2.64 0.55 0.00 3.77 0.00 -0.52 -4.58 120.51 117.08 1l3n n ALA 60 Ca 0.16 0.67 0.00 0.00 0.00 0.00 0.00 53.44 54.26 1l3n n ALA 60 Cb 0.86 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 19.71 1l3n n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l3n n GLY 61 N -1.22 0.19 0.00 0.00 0.00 -0.02 -0.19 105.19 103.94 1l3n n GLY 61 Ca 0.21 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.46 1l3n n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1l3n n PRO 62 N 0.34 0.48 -0.84 1.61 -0.04 -1.26 -4.42 135.00 130.87 1l3n n PRO 62 Ca 0.00 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.38 1l3n n PRO 62 Cb 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.35 1l3n n PRO 62 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1l3n n HIS 63 N -1.00 0.04 -1.45 0.54 8.25 -1.26 -2.33 115.22 118.01 1l3n n HIS 63 Ca 0.00 -1.34 -0.43 0.00 -0.26 0.00 0.00 57.72 55.69 1l3n n HIS 63 Cb 0.00 -1.22 -0.03 0.00 1.12 0.00 0.00 29.99 29.86 1l3n n HIS 63 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1l3n n PHE 64 N 2.12 2.72 -2.34 4.41 3.72 -1.26 -4.90 117.46 121.93 1l3n n PHE 64 Ca 0.28 -2.40 -0.35 0.00 -0.05 0.00 0.00 57.45 54.94 1l3n n PHE 64 Cb 0.77 -2.14 -0.01 0.00 -0.94 0.00 0.00 39.48 37.16 1l3n n PHE 64 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1l3n s ASN 65 N 4.10 5.99 0.15 4.37 4.22 -1.26 -4.65 114.94 127.85 1l3n s ASN 65 Ca 0.52 2.14 -0.17 0.00 -2.14 0.00 0.00 52.86 53.21 1l3n s ASN 65 Cb 0.14 -2.58 0.01 0.00 1.28 0.00 0.00 41.25 40.11 1l3n s ASN 65 CO 0.01 -1.04 1.78 1.55 -2.04 0.00 0.00 177.10 177.37 1l3n h PRO 66 N 1.49 0.36 -3.22 3.55 0.13 -2.00 -2.54 132.00 129.77 1l3n h PRO 66 Ca -0.50 -0.02 -0.59 0.00 -0.87 0.00 0.00 66.00 64.02 1l3n h PRO 66 Cb 1.25 -0.08 0.02 0.00 0.13 0.00 0.00 31.00 32.32 1l3n h PRO 66 CO 0.58 0.24 3.44 -0.11 -0.23 0.00 0.00 178.00 181.92 1l3n n LEU 67 N -4.92 7.49 -4.61 1.56 0.00 -1.26 -4.92 117.00 110.33 1l3n n LEU 67 Ca -0.00 -3.91 -0.43 0.00 0.00 0.00 0.00 56.01 51.67 1l3n n LEU 67 Cb 0.07 -1.43 -0.03 0.00 0.00 0.00 0.00 43.42 42.03 1l3n n LEU 67 CO 0.32 1.56 1.75 -0.55 0.00 0.00 0.00 177.39 180.46 1l3n s SER 68 N 2.64 5.74 0.00 1.96 0.15 -0.96 -4.87 113.70 118.37 1l3n s SER 68 Ca 0.60 2.00 0.00 0.00 0.70 0.00 0.00 55.95 59.25 1l3n s SER 68 Cb 0.15 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.95 1l3n s SER 68 CO -0.05 -1.72 0.00 0.54 1.20 0.00 0.00 173.24 173.21 1l3n n ARG 69 N 8.42 0.00 -3.60 5.44 1.74 -1.26 -5.11 116.66 122.29 1l3n n ARG 69 Ca 0.27 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 57.19 1l3n n ARG 69 Cb 0.44 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.81 1l3n n ARG 69 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 1l3n s LYS 70 N 0.87 0.90 -0.23 5.56 -2.85 -1.25 -5.11 119.74 117.63 1l3n s LYS 70 Ca 0.00 0.58 -0.40 0.00 -1.00 0.00 0.00 55.97 55.15 1l3n s LYS 70 Cb 0.00 0.43 -0.16 0.00 -2.06 0.00 0.00 37.83 36.04 1l3n s LYS 70 CO 0.00 -0.20 1.66 1.58 0.10 0.00 0.00 175.35 178.49 1l3n n HIS 71 N 1.84 1.93 -2.51 1.78 -0.00 0.21 -4.04 115.22 114.42 1l3n n HIS 71 Ca -0.17 0.60 0.00 0.00 -0.00 0.00 0.00 57.72 58.16 1l3n n HIS 71 Cb 0.56 -2.42 0.00 0.00 -0.00 0.00 0.00 29.99 28.13 1l3n n HIS 71 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1l3n n GLY 72 N 3.89 5.06 0.00 1.57 0.00 -1.26 -3.47 105.19 110.97 1l3n n GLY 72 Ca 0.25 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1l3n n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l3n n GLY 73 N 0.00 3.31 0.31 -0.02 0.00 -1.26 -4.45 105.19 103.07 1l3n n GLY 73 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.66 1l3n n GLY 73 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1l3n n PRO 74 N 0.00 0.49 -0.07 1.61 -0.04 -1.26 -0.26 135.00 135.47 1l3n n PRO 74 Ca 0.00 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.40 1l3n n PRO 74 Cb 0.00 -1.15 -0.12 0.00 -0.04 0.00 0.00 33.50 32.19 1l3n n PRO 74 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1l3n n LYS 75 N -0.03 1.52 -3.66 0.54 2.85 -1.26 -5.05 118.16 113.07 1l3n n LYS 75 Ca 0.00 -0.02 -0.22 0.00 -1.05 0.00 0.00 58.31 57.02 1l3n n LYS 75 Cb 0.08 -1.38 -0.03 0.00 -0.65 0.00 0.00 35.03 33.05 1l3n n LYS 75 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1l3n s ASP 76 N -4.73 4.90 0.05 -5.58 1.01 0.64 -5.03 116.67 107.93 1l3n s ASP 76 Ca -0.07 -0.89 0.16 0.00 0.71 0.00 0.00 52.55 52.45 1l3n s ASP 76 Cb 0.05 -0.31 -0.15 0.00 1.01 0.00 0.00 42.92 43.52 1l3n s ASP 76 CO 0.60 -0.77 0.83 -0.08 0.21 0.00 0.00 175.17 175.97 1l3n h GLU 77 N 0.97 0.00 0.00 8.23 4.81 -1.97 -3.40 114.58 123.22 1l3n h GLU 77 Ca -0.40 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 1l3n h GLU 77 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 1l3n h GLU 77 CO 0.58 0.36 0.00 -0.85 -0.73 0.00 0.00 179.01 178.37 1l3n n GLU 78 N -2.95 0.06 -1.12 1.92 0.00 -1.26 -4.91 120.64 112.38 1l3n n GLU 78 Ca -0.10 0.09 -0.44 0.00 0.00 0.00 0.00 57.16 56.70 1l3n n GLU 78 Cb 0.88 -1.58 -0.06 0.00 0.00 0.00 0.00 31.44 30.68 1l3n n GLU 78 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.13 180.02 1l3n n ARG 79 N -1.69 0.00 -0.86 3.44 -4.01 -1.26 -3.77 116.66 108.52 1l3n n ARG 79 Ca 0.06 0.00 -0.28 0.00 -1.04 0.00 0.00 57.85 56.59 1l3n n ARG 79 Cb 0.34 -1.10 0.22 0.00 -3.04 0.00 0.00 32.46 28.87 1l3n n ARG 79 CO 0.00 0.00 0.00 -1.01 -3.04 0.00 0.00 177.63 173.58 1l3n s HIS 80 N 0.18 1.71 -1.50 2.89 3.76 -1.26 -4.82 115.29 116.26 1l3n s HIS 80 Ca 0.68 1.06 0.00 0.00 -0.15 0.00 0.00 55.06 56.65 1l3n s HIS 80 Cb -0.95 -3.18 0.00 0.00 1.11 0.00 0.00 32.58 29.56 1l3n s HIS 80 CO 0.43 -3.43 0.13 1.55 -0.85 0.00 0.00 174.74 172.58 1l3n n VAL 81 N -4.58 0.00 -2.65 -0.90 3.14 -1.26 -2.39 118.33 109.69 1l3n n VAL 81 Ca 0.04 0.00 -0.03 0.00 -2.96 0.00 0.00 64.34 61.39 1l3n n VAL 81 Cb 0.56 -0.25 0.06 0.00 -1.06 0.00 0.00 33.84 33.15 1l3n n VAL 81 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1l3n n GLY 82 N 0.05 -1.49 3.38 7.55 0.00 -1.26 -4.89 105.19 108.52 1l3n n GLY 82 Ca 0.00 0.58 -0.45 0.00 0.00 0.00 0.00 46.02 46.15 1l3n n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1l3n s ASP 83 N -0.03 6.18 0.00 1.61 1.01 -1.00 -0.64 116.67 123.80 1l3n s ASP 83 Ca 0.12 -1.39 0.04 0.00 0.71 0.00 0.00 52.55 52.03 1l3n s ASP 83 Cb 0.18 -2.24 0.15 0.00 1.01 0.00 0.00 42.92 42.01 1l3n s ASP 83 CO -0.13 -0.88 1.11 0.18 0.21 0.00 0.00 175.17 175.66 1l3n n LEU 84 N 5.72 0.60 0.00 1.23 7.99 -0.91 -4.12 117.00 127.51 1l3n n LEU 84 Ca -0.11 -0.30 0.00 0.00 -0.01 0.00 0.00 56.01 55.59 1l3n n LEU 84 Cb 0.43 -0.07 0.00 0.00 -0.11 0.00 0.00 43.42 43.66 1l3n n LEU 84 CO 0.53 0.15 0.00 0.61 -1.51 0.00 0.00 177.39 177.17 1l3n n GLY 85 N 0.69 1.83 3.17 -0.72 0.00 -1.26 -4.74 105.19 104.17 1l3n n GLY 85 Ca 0.04 -0.26 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 1l3n n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1l3n s ASN 86 N -4.00 0.14 -0.17 1.61 0.01 -1.26 -4.33 114.94 106.94 1l3n s ASN 86 Ca 0.00 -0.59 -0.02 0.00 -0.71 0.00 0.00 52.86 51.54 1l3n s ASN 86 Cb 0.00 0.29 -0.01 0.00 0.41 0.00 0.00 41.25 41.94 1l3n s ASN 86 CO 0.00 -0.63 -0.08 0.68 -1.51 0.00 0.00 177.10 175.56 1l3n s VAL 87 N -3.27 3.31 -0.57 1.60 -7.23 0.02 -4.83 120.40 109.43 1l3n s VAL 87 Ca 0.00 -0.55 -0.19 0.00 -1.81 0.00 0.00 61.98 59.44 1l3n s VAL 87 Cb 0.02 -2.44 0.09 0.00 0.56 0.00 0.00 36.38 34.61 1l3n s VAL 87 CO -0.08 0.48 0.68 -0.89 -0.31 0.00 0.00 175.10 174.98 1l3n s THR 88 N 0.78 4.84 0.28 5.32 2.01 -1.26 -0.63 115.64 126.99 1l3n s THR 88 Ca -0.03 -0.87 -0.28 0.00 0.31 0.00 0.00 61.69 60.82 1l3n s THR 88 Cb -0.15 -4.43 -0.09 0.00 0.01 0.00 0.00 72.50 67.83 1l3n s THR 88 CO 0.01 -1.03 0.98 0.00 -0.69 0.00 0.00 174.62 173.89 1l3n s ALA 89 N 2.65 3.30 1.11 7.40 0.00 0.22 -4.18 121.76 132.26 1l3n s ALA 89 Ca 0.12 0.65 -0.16 0.00 0.00 0.00 0.00 51.96 52.57 1l3n s ALA 89 Cb -0.23 -3.23 0.24 0.00 0.00 0.00 0.00 23.12 19.91 1l3n s ALA 89 CO 0.08 0.11 1.10 0.34 0.00 0.00 0.00 175.76 177.38 1l3n s ASP 90 N -1.28 1.67 0.56 0.00 2.15 0.37 -0.66 116.67 119.47 1l3n s ASP 90 Ca 0.45 0.91 0.31 0.00 0.43 0.00 0.00 52.55 54.65 1l3n s ASP 90 Cb -0.25 -1.38 1.64 0.00 -0.30 0.00 0.00 42.92 42.64 1l3n s ASP 90 CO 0.31 -3.69 2.14 0.07 -0.17 0.00 0.00 175.17 173.83 1l3n h LYS 91 N -2.28 0.00 0.00 4.34 -0.00 -1.95 0.16 116.57 116.83 1l3n h LYS 91 Ca -0.50 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.15 1l3n h LYS 91 Cb 1.32 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.55 1l3n h LYS 91 CO 0.46 0.07 0.00 -3.47 -0.00 0.00 0.00 179.45 176.51 1l3n n ASP 92 N -3.57 0.00 0.00 7.07 2.03 -1.26 -4.76 116.55 116.06 1l3n n ASP 92 Ca -0.02 -0.70 0.00 0.00 0.52 0.00 0.00 54.79 54.59 1l3n n ASP 92 Cb 0.19 -0.07 0.00 0.00 -0.72 0.00 0.00 41.12 40.52 1l3n n ASP 92 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1l3n n GLY 93 N 0.88 0.86 3.58 0.27 0.00 0.55 -4.05 105.19 107.29 1l3n n GLY 93 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1l3n n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1l3n s VAL 94 N -3.40 3.86 -0.35 1.61 1.01 -1.25 -2.84 120.40 119.04 1l3n s VAL 94 Ca 0.00 0.76 -0.12 0.00 0.00 0.00 0.00 61.98 62.62 1l3n s VAL 94 Cb 0.00 -4.52 0.00 0.00 0.00 0.00 0.00 36.38 31.87 1l3n s VAL 94 CO 0.00 -1.20 0.21 0.00 0.00 0.00 0.00 175.10 174.11 1l3n s ALA 95 N 5.68 3.36 -0.27 5.51 0.00 -0.07 -0.48 121.76 135.49 1l3n s ALA 95 Ca 0.50 -1.52 -0.29 0.00 0.00 0.00 0.00 51.96 50.64 1l3n s ALA 95 Cb -0.10 -2.58 0.01 0.00 0.00 0.00 0.00 23.12 20.45 1l3n s ALA 95 CO 0.25 -1.13 1.09 0.16 0.00 0.00 0.00 175.76 176.14 1l3n s ASP 96 N 1.63 6.98 -0.12 0.00 -4.77 -1.26 -1.86 116.67 117.27 1l3n s ASP 96 Ca 0.04 1.24 -0.04 0.00 -3.30 0.00 0.00 52.55 50.49 1l3n s ASP 96 Cb -0.18 -2.54 -0.03 0.00 -1.09 0.00 0.00 42.92 39.07 1l3n s ASP 96 CO 0.08 -0.81 0.02 -0.69 0.70 0.00 0.00 175.17 174.48 1l3n s VAL 97 N 3.52 4.46 -0.46 2.11 1.01 -0.01 -4.71 120.40 126.33 1l3n s VAL 97 Ca 0.46 -0.17 0.06 0.00 0.00 0.00 0.00 61.98 62.33 1l3n s VAL 97 Cb -0.14 -2.93 0.30 0.00 0.00 0.00 0.00 36.38 33.61 1l3n s VAL 97 CO 0.12 0.55 1.04 -1.54 0.00 0.00 0.00 175.10 175.27 1l3n n SER 98 N 2.70 -2.27 -4.80 3.32 3.41 -1.24 -0.68 113.62 114.05 1l3n n SER 98 Ca -0.18 -3.57 -0.22 0.00 -0.26 0.00 0.00 58.87 54.64 1l3n n SER 98 Cb 0.53 1.74 -0.05 0.00 -0.26 0.00 0.00 64.21 66.18 1l3n n SER 98 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1l3n s ILE 99 N 0.20 3.96 0.03 -1.33 1.09 -0.27 -4.94 121.20 119.94 1l3n s ILE 99 Ca 0.25 -1.50 0.00 0.00 -1.10 0.00 0.00 60.65 58.31 1l3n s ILE 99 Cb 0.28 -3.23 -0.02 0.00 -1.06 0.00 0.00 42.46 38.42 1l3n s ILE 99 CO -0.10 -0.30 -0.03 -1.83 -0.10 0.00 0.00 174.94 172.58 1l3n s GLU 100 N -3.85 0.38 0.02 2.79 -1.05 -1.26 0.12 118.70 115.85 1l3n s GLU 100 Ca 0.35 -0.73 -0.10 0.00 -0.15 0.00 0.00 54.97 54.34 1l3n s GLU 100 Cb -0.07 0.09 0.01 0.00 -0.44 0.00 0.00 34.13 33.72 1l3n s GLU 100 CO 0.24 -0.05 0.21 0.34 0.95 0.00 0.00 175.26 176.95 1l3n s ASP 101 N -1.73 -0.03 -0.01 0.83 -1.08 -0.09 -4.98 116.67 109.59 1l3n s ASP 101 Ca -0.11 -0.21 0.15 0.00 -0.52 0.00 0.00 52.55 51.85 1l3n s ASP 101 Cb -0.07 0.27 -0.19 0.00 -1.46 0.00 0.00 42.92 41.47 1l3n s ASP 101 CO -0.02 -0.49 0.55 -1.54 0.52 0.00 0.00 175.17 174.19 1l3n n SER 102 N 1.01 0.94 -1.53 -0.34 3.41 -1.26 -0.25 113.62 115.61 1l3n n SER 102 Ca -0.21 -0.58 0.09 0.00 -0.26 0.00 0.00 58.87 57.91 1l3n n SER 102 Cb 0.57 1.23 0.35 0.00 -0.26 0.00 0.00 64.21 66.11 1l3n n SER 102 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1l3n n VAL 103 N -1.58 2.08 -4.94 -3.33 3.14 -1.26 -4.88 118.33 107.56 1l3n n VAL 103 Ca 0.01 -1.33 -0.31 0.00 -2.96 0.00 0.00 64.34 59.76 1l3n n VAL 103 Cb 0.29 0.00 -0.14 0.00 -1.06 0.00 0.00 33.84 32.93 1l3n n VAL 103 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 1l3n s ILE 104 N -2.15 2.44 0.01 1.55 1.09 -1.26 -4.85 121.20 118.03 1l3n s ILE 104 Ca 0.49 -1.16 -0.04 0.00 -1.10 0.00 0.00 60.65 58.85 1l3n s ILE 104 Cb 0.34 -1.95 -0.01 0.00 -1.06 0.00 0.00 42.46 39.79 1l3n s ILE 104 CO 0.20 0.45 0.06 -0.94 -0.10 0.00 0.00 174.94 174.61 1l3n s SER 105 N -1.06 0.13 0.21 3.58 1.04 -1.26 -4.54 113.70 111.79 1l3n s SER 105 Ca 0.12 -0.34 -0.09 0.00 0.48 0.00 0.00 55.95 56.12 1l3n s SER 105 Cb -0.10 0.15 0.15 0.00 0.10 0.00 0.00 66.02 66.32 1l3n s SER 105 CO 0.02 -0.33 1.80 -0.07 0.98 0.00 0.00 173.24 175.64 1l3n h LEU 106 N 4.48 0.99 -8.07 2.42 3.38 -1.95 0.26 115.31 116.82 1l3n h LEU 106 Ca -0.31 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.42 1l3n h LEU 106 Cb 1.20 -0.26 -0.13 0.00 0.09 0.00 0.00 40.66 41.57 1l3n h LEU 106 CO 0.41 0.85 -0.35 -0.94 0.09 0.00 0.00 178.44 178.49 1l3n s SER 107 N -6.18 0.07 0.00 -0.43 1.04 -1.26 -2.01 113.70 104.93 1l3n s SER 107 Ca -0.13 -0.87 0.00 0.00 0.48 0.00 0.00 55.95 55.44 1l3n s SER 107 Cb 0.15 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1l3n s SER 107 CO 0.82 -0.86 0.00 0.61 0.98 0.00 0.00 173.24 174.78 1l3n n GLY 108 N -0.19 1.38 0.48 7.32 0.00 -1.26 -4.44 105.19 108.48 1l3n n GLY 108 Ca -0.08 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.08 1l3n n GLY 108 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1l3n n ASP 109 N 0.00 1.70 -0.03 1.61 9.92 -1.26 -4.69 116.55 123.80 1l3n n ASP 109 Ca 0.00 0.00 -0.14 0.00 -0.53 0.00 0.00 54.79 54.12 1l3n n ASP 109 Cb 0.00 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.37 1l3n n ASP 109 CO 0.00 0.00 0.00 0.45 0.13 0.00 0.00 177.20 177.78 1l3n h HIS 110 N 0.00 0.16 -6.58 1.24 3.86 -1.86 -3.48 115.15 108.50 1l3n h HIS 110 Ca 0.00 -0.07 -0.51 0.00 -1.16 0.00 0.00 60.37 58.63 1l3n h HIS 110 Cb 0.67 -0.02 0.03 0.00 1.06 0.00 0.00 27.41 29.15 1l3n h HIS 110 CO 0.00 0.78 -0.97 0.45 0.86 0.00 0.00 177.93 179.05 1l3n n SER 111 N -4.64 -4.80 0.05 2.45 2.88 -0.98 -4.83 113.62 103.75 1l3n n SER 111 Ca -0.09 -1.14 0.05 0.00 -1.33 0.00 0.00 58.87 56.37 1l3n n SER 111 Cb 0.40 -2.51 0.25 0.00 -0.75 0.00 0.00 64.21 61.60 1l3n n SER 111 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1l3n n ILE 112 N -4.48 1.41 -1.54 2.46 -5.35 0.87 -4.74 119.36 107.98 1l3n n ILE 112 Ca -0.11 0.44 -0.44 0.00 -0.27 0.00 0.00 62.75 62.37 1l3n n ILE 112 Cb 0.58 -1.36 -0.01 0.00 -1.74 0.00 0.00 39.64 37.10 1l3n n ILE 112 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 1l3n n ILE 113 N -1.73 2.00 -1.18 7.28 2.08 -0.85 -3.05 119.36 123.91 1l3n n ILE 113 Ca 0.01 -0.50 -0.06 0.00 0.56 0.00 0.00 62.75 62.76 1l3n n ILE 113 Cb 0.08 -0.79 -0.03 0.00 -0.75 0.00 0.00 39.64 38.15 1l3n n ILE 113 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1l3n n GLY 114 N 1.41 0.84 3.91 7.39 0.00 -1.26 -5.03 105.19 112.45 1l3n n GLY 114 Ca 0.11 -0.44 -0.27 0.00 0.00 0.00 0.00 46.02 45.42 1l3n n GLY 114 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1l3n s ARG 115 N -2.19 2.78 -0.14 1.61 1.81 -1.17 -2.32 118.95 119.34 1l3n s ARG 115 Ca 0.00 0.06 -0.20 0.00 -1.72 0.00 0.00 55.73 53.88 1l3n s ARG 115 Cb 0.00 -2.20 -0.04 0.00 -0.45 0.00 0.00 34.95 32.27 1l3n s ARG 115 CO 0.00 -0.87 0.55 0.99 -0.68 0.00 0.00 175.30 175.28 1l3n s THR 116 N -3.12 5.12 0.04 0.02 2.01 0.41 -2.54 115.64 117.59 1l3n s THR 116 Ca 0.56 1.07 -0.21 0.00 0.31 0.00 0.00 61.69 63.42 1l3n s THR 116 Cb -0.11 -3.88 -0.06 0.00 0.01 0.00 0.00 72.50 68.46 1l3n s THR 116 CO 0.47 0.25 0.62 -0.76 -0.69 0.00 0.00 174.62 174.51 1l3n s LEU 117 N 1.04 4.47 -0.04 4.42 2.01 0.37 -0.03 118.68 130.91 1l3n s LEU 117 Ca 0.28 1.27 0.06 0.00 0.01 0.00 0.00 54.13 55.75 1l3n s LEU 117 Cb -0.16 -2.98 -0.01 0.00 0.01 0.00 0.00 46.19 43.05 1l3n s LEU 117 CO 0.12 0.15 -0.23 -0.69 1.01 0.00 0.00 176.35 176.70 1l3n s VAL 118 N -0.52 1.90 -0.14 -1.59 1.01 0.26 -1.17 120.40 120.15 1l3n s VAL 118 Ca 0.32 -0.99 -0.05 0.00 0.00 0.00 0.00 61.98 61.25 1l3n s VAL 118 Cb -0.19 -1.60 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 1l3n s VAL 118 CO 0.19 0.53 0.03 0.54 0.00 0.00 0.00 175.10 176.40 1l3n s VAL 119 N -0.24 4.56 0.24 2.92 0.11 -0.07 -1.83 120.40 126.10 1l3n s VAL 119 Ca -0.00 -0.13 0.10 0.00 -2.93 0.00 0.00 61.98 59.01 1l3n s VAL 119 Cb -0.12 -2.99 -0.04 0.00 -1.53 0.00 0.00 36.38 31.69 1l3n s VAL 119 CO 0.02 0.53 -0.05 -1.00 -3.33 0.00 0.00 175.10 171.27 1l3n s HIS 120 N -0.22 2.64 0.12 1.54 3.76 -0.13 -2.76 115.29 120.24 1l3n s HIS 120 Ca 0.07 -0.23 -0.20 0.00 -0.15 0.00 0.00 55.06 54.55 1l3n s HIS 120 Cb -0.12 -1.21 -0.06 0.00 1.11 0.00 0.00 32.58 32.30 1l3n s HIS 120 CO 0.02 0.60 1.75 1.49 -0.85 0.00 0.00 174.74 177.74 1l3n h GLU 121 N 2.26 0.14 -5.93 1.40 4.22 -0.89 -3.26 114.58 112.53 1l3n h GLU 121 Ca -0.45 -0.01 -0.57 0.00 0.08 0.00 0.00 59.36 58.42 1l3n h GLU 121 Cb 1.24 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.40 1l3n h GLU 121 CO 0.58 0.09 -0.37 0.15 -2.18 0.00 0.00 179.01 177.28 1l3n s LYS 122 N -6.18 2.30 0.42 1.92 1.02 0.62 -4.85 119.74 114.99 1l3n s LYS 122 Ca -0.13 -1.91 -0.15 0.00 0.02 0.00 0.00 55.97 53.80 1l3n s LYS 122 Cb 0.09 -2.09 -0.08 0.00 -0.52 0.00 0.00 37.83 35.22 1l3n s LYS 122 CO 0.68 -0.41 0.85 0.00 -0.92 0.00 0.00 175.35 175.55 1l3n s ALA 123 N -2.68 3.21 0.45 5.17 0.00 -1.25 -0.38 121.76 126.28 1l3n s ALA 123 Ca 0.37 0.06 -0.21 0.00 0.00 0.00 0.00 51.96 52.17 1l3n s ALA 123 Cb -0.01 -2.91 -0.09 0.00 0.00 0.00 0.00 23.12 20.11 1l3n s ALA 123 CO 0.22 0.03 1.01 -0.51 0.00 0.00 0.00 175.76 176.50 1l3n s ASP 124 N -2.77 6.63 0.19 0.00 1.11 -1.26 -3.70 116.67 116.87 1l3n s ASP 124 Ca 0.56 1.87 0.10 0.00 0.18 0.00 0.00 52.55 55.26 1l3n s ASP 124 Cb -0.10 -2.56 -0.04 0.00 1.07 0.00 0.00 42.92 41.29 1l3n s ASP 124 CO 0.25 -0.58 1.38 -0.78 1.18 0.00 0.00 175.17 176.62 1l3n h ASP 125 N 1.89 0.00 -6.35 0.27 1.82 -1.83 -3.46 116.42 108.75 1l3n h ASP 125 Ca -0.49 0.00 -0.47 0.00 -0.39 0.00 0.00 57.03 55.68 1l3n h ASP 125 Cb 1.21 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.19 1l3n h ASP 125 CO 0.60 0.79 -0.85 0.18 -1.61 0.00 0.00 179.24 178.35 1l3n n LEU 126 N -3.35 -2.53 0.00 2.28 4.77 -1.26 -2.39 117.00 114.52 1l3n n LEU 126 Ca 0.01 -0.92 0.00 0.00 -0.03 0.00 0.00 56.01 55.06 1l3n n LEU 126 Cb 0.83 -2.40 0.00 0.00 -2.33 0.00 0.00 43.42 39.53 1l3n n LEU 126 CO 0.44 0.42 0.00 0.61 -1.33 0.00 0.00 177.39 177.53 1l3n n GLY 127 N -1.78 1.78 0.07 -0.72 0.00 -1.23 -4.64 105.19 98.67 1l3n n GLY 127 Ca -0.25 0.00 0.16 0.00 0.00 0.00 0.00 46.02 45.92 1l3n n GLY 127 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1l3n n LYS 128 N -2.00 1.04 0.23 1.61 5.02 -1.00 -3.37 118.16 119.68 1l3n n LYS 128 Ca 0.00 -0.14 0.12 0.00 -2.02 0.00 0.00 58.31 56.27 1l3n n LYS 128 Cb 0.00 -1.50 0.46 0.00 -0.02 0.00 0.00 35.03 33.98 1l3n n LYS 128 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1l3n h GLY 129 N 4.98 0.00 -5.90 0.72 0.00 -1.89 -3.47 103.07 97.51 1l3n h GLY 129 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 47.33 46.89 1l3n h GLY 129 CO 0.00 0.00 -0.70 0.61 0.00 0.00 0.00 176.54 176.45 1l3n n GLY 130 N 0.29 -0.51 3.32 4.60 0.00 -1.22 -4.91 105.19 106.77 1l3n n GLY 130 Ca 0.01 0.19 -0.17 0.00 0.00 0.00 0.00 46.02 46.04 1l3n n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l3n s ASN 131 N -3.16 1.33 0.17 1.61 2.20 -1.26 -5.00 114.94 110.83 1l3n s ASN 131 Ca 0.58 -1.48 -0.15 0.00 -0.94 0.00 0.00 52.86 50.88 1l3n s ASN 131 Cb -0.28 0.29 0.13 0.00 -2.00 0.00 0.00 41.25 39.39 1l3n s ASN 131 CO 0.72 -0.82 1.72 -0.08 -2.94 0.00 0.00 177.10 175.70 1l3n h GLU 132 N 2.30 0.21 -0.99 3.55 4.81 -1.97 -0.38 114.58 122.11 1l3n h GLU 132 Ca -0.36 -0.01 0.05 0.00 -0.13 0.00 0.00 59.36 58.91 1l3n h GLU 132 Cb 1.25 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 30.52 1l3n h GLU 132 CO 0.56 0.14 0.65 0.93 -0.73 0.00 0.00 179.01 180.55 1l3n h GLU 133 N 0.21 1.19 -0.97 1.92 3.07 -1.97 -0.97 114.58 117.06 1l3n h GLU 133 Ca 0.21 -0.07 0.15 0.00 -0.50 0.00 0.00 59.36 59.15 1l3n h GLU 133 Cb 0.26 -0.27 -0.09 0.00 -0.84 0.00 0.00 28.75 27.81 1l3n h GLU 133 CO -0.27 0.79 0.61 0.66 -1.40 0.00 0.00 179.01 179.39 1l3n h SER 134 N 1.22 0.77 0.50 1.42 4.64 -0.59 0.16 113.55 121.66 1l3n h SER 134 Ca 0.40 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.78 1l3n h SER 134 Cb 0.06 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 1l3n h SER 134 CO -0.14 0.36 -0.28 1.07 -0.87 0.00 0.00 176.83 176.97 1l3n n THR 135 N -4.63 0.00 -0.06 2.95 5.66 -0.42 -2.90 114.28 114.87 1l3n n THR 135 Ca 0.20 -0.04 -0.07 0.00 -3.05 0.00 0.00 64.05 61.09 1l3n n THR 135 Cb 0.48 0.08 -0.02 0.00 -1.55 0.00 0.00 70.33 69.32 1l3n n THR 135 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1l3n n LYS 136 N -1.21 0.41 -0.30 1.09 5.02 0.08 -0.62 118.16 122.63 1l3n n LYS 136 Ca 0.09 0.16 0.02 0.00 -2.02 0.00 0.00 58.31 56.56 1l3n n LYS 136 Cb 0.33 -1.21 0.02 0.00 -0.02 0.00 0.00 35.03 34.15 1l3n n LYS 136 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1l3n n THR 137 N -4.15 0.37 0.00 -0.18 -2.24 0.33 -4.23 114.28 104.18 1l3n n THR 137 Ca -0.11 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.24 1l3n n THR 137 Cb 0.40 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 69.11 1l3n n THR 137 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l3n n GLY 138 N -0.27 1.71 2.36 3.38 0.00 -0.12 -2.80 105.19 109.45 1l3n n GLY 138 Ca 0.03 0.01 -0.02 0.00 0.00 0.00 0.00 46.02 46.04 1l3n n GLY 138 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1l3n n ASN 139 N 7.98 -1.09 0.06 1.61 3.02 -1.26 -2.21 115.26 123.37 1l3n n ASN 139 Ca 0.00 -1.90 0.09 0.00 -0.03 0.00 0.00 54.58 52.74 1l3n n ASN 139 Cb 0.00 0.51 0.37 0.00 -0.61 0.00 0.00 39.78 40.06 1l3n n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1l3n n ALA 140 N -1.13 1.61 -0.38 5.41 0.00 -1.12 -4.60 120.51 120.29 1l3n n ALA 140 Ca -0.13 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1l3n n ALA 140 Cb 0.78 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.94 1l3n n ALA 140 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l3n n GLY 141 N -0.12 -0.92 3.62 0.00 0.00 -1.26 -0.28 105.19 106.22 1l3n n GLY 141 Ca 0.03 -1.17 -0.47 0.00 0.00 0.00 0.00 46.02 44.40 1l3n n GLY 141 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1l3n n SER 142 N -0.95 1.96 -3.32 1.61 7.64 -1.26 -4.51 113.62 114.80 1l3n n SER 142 Ca 0.00 1.14 -0.27 0.00 1.01 0.00 0.00 58.87 60.75 1l3n n SER 142 Cb 0.00 -1.30 -0.04 0.00 -1.01 0.00 0.00 64.21 61.86 1l3n n SER 142 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1l3n n ARG 143 N 2.00 1.33 0.31 1.43 1.74 -1.26 -0.63 116.66 121.59 1l3n n ARG 143 Ca 0.14 -1.36 0.18 0.00 -0.77 0.00 0.00 57.85 56.04 1l3n n ARG 143 Cb 0.27 -2.52 1.03 0.00 -1.02 0.00 0.00 32.46 30.22 1l3n n ARG 143 CO 0.00 0.00 0.00 1.37 -1.52 0.00 0.00 177.63 177.48 1l3n h LEU 144 N 11.28 0.00 -7.14 0.55 -0.00 -1.86 -3.42 115.31 114.71 1l3n h LEU 144 Ca 0.36 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 58.17 1l3n h LEU 144 Cb 0.34 0.00 -0.20 0.00 -0.00 0.00 0.00 40.66 40.81 1l3n h LEU 144 CO 1.59 0.01 0.05 0.00 -0.00 0.00 0.00 178.44 180.09 1l3n s ALA 145 N -4.38 -1.50 0.20 0.17 0.00 -1.11 -3.41 121.76 111.73 1l3n s ALA 145 Ca -0.05 1.15 -0.23 0.00 0.00 0.00 0.00 51.96 52.83 1l3n s ALA 145 Cb 0.14 -0.13 0.05 0.00 0.00 0.00 0.00 23.12 23.17 1l3n s ALA 145 CO 0.49 -0.33 0.83 0.00 0.00 0.00 0.00 175.76 176.75 1l3n s GLY 147 N -2.90 -0.32 0.02 0.00 0.00 -0.32 -1.33 107.32 102.46 1l3n s GLY 147 Ca 0.11 0.42 0.03 0.00 0.00 0.00 0.00 44.72 45.28 1l3n s GLY 147 CO 0.03 0.07 -0.04 0.14 0.00 0.00 0.00 173.10 173.30 1l3n s VAL 148 N -2.86 3.83 0.24 1.40 1.01 -1.26 -0.48 120.40 122.27 1l3n s VAL 148 Ca 0.13 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 61.03 1l3n s VAL 148 Cb 0.02 -2.71 -0.09 0.00 0.00 0.00 0.00 36.38 33.60 1l3n s VAL 148 CO -0.01 0.33 1.11 -0.63 0.00 0.00 0.00 175.10 175.90 1l3n s ILE 149 N -1.08 3.61 0.07 2.22 1.01 -1.05 -4.47 121.20 121.51 1l3n s ILE 149 Ca 0.19 1.52 0.09 0.00 0.00 0.00 0.00 60.65 62.45 1l3n s ILE 149 Cb -0.11 -3.97 -0.03 0.00 0.01 0.00 0.00 42.46 38.36 1l3n s ILE 149 CO 0.10 0.32 -0.23 -0.83 0.00 0.00 0.00 174.94 174.30 1l3n s GLY 150 N -0.55 1.29 0.50 6.18 0.00 0.02 -4.29 107.32 110.48 1l3n s GLY 150 Ca 0.47 -1.22 -0.17 0.00 0.00 0.00 0.00 44.72 43.80 1l3n s GLY 150 CO 0.39 -1.16 0.97 -0.42 0.00 0.00 0.00 173.10 172.88 1l3n s ILE 151 N -0.92 4.53 0.00 0.90 1.01 -1.26 -0.04 121.20 125.43 1l3n s ILE 151 Ca 0.09 1.21 0.00 0.00 0.00 0.00 0.00 60.65 61.96 1l3n s ILE 151 Cb -0.10 -3.71 0.00 0.00 0.01 0.00 0.00 42.46 38.66 1l3n s ILE 151 CO 0.03 -0.65 0.00 0.00 0.00 0.00 0.00 174.94 174.32 1l3n n ALA 152 N -1.48 0.00 0.00 9.38 0.00 0.24 -4.76 120.51 123.88 1l3n n ALA 152 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1l3n n ALA 152 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1l3n n ALA 152 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44