#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 -5.24 0.00 5.66 -1.26 -4.69 114.28 108.75 1l3n n THR 2 Ca 0.00 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.70 1l3n n THR 2 Cb 0.00 -0.75 -0.16 0.00 -1.55 0.00 0.00 70.33 67.87 1l3n n THR 2 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1l3n s LYS 3 N -1.94 2.05 0.16 1.09 1.02 -1.26 -0.52 119.74 120.35 1l3n s LYS 3 Ca 0.00 -0.88 -0.11 0.00 0.02 0.00 0.00 55.97 54.99 1l3n s LYS 3 Cb 0.00 -1.96 0.00 0.00 -0.52 0.00 0.00 37.83 35.36 1l3n s LYS 3 CO 0.00 0.52 0.34 0.00 -0.92 0.00 0.00 175.35 175.29 1l3n s ALA 4 N -0.54 -0.32 0.49 5.17 0.00 -0.92 -0.69 121.76 124.96 1l3n s ALA 4 Ca 0.08 -0.64 0.02 0.00 0.00 0.00 0.00 51.96 51.42 1l3n s ALA 4 Cb -0.10 0.80 -0.01 0.00 0.00 0.00 0.00 23.12 23.81 1l3n s ALA 4 CO -0.01 -0.67 0.05 0.14 0.00 0.00 0.00 175.76 175.28 1l3n s VAL 5 N -3.92 0.85 -0.13 0.00 -7.23 -0.84 -0.54 120.40 108.58 1l3n s VAL 5 Ca 0.13 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.25 1l3n s VAL 5 Cb 0.02 -2.13 0.07 0.00 0.56 0.00 0.00 36.38 34.90 1l3n s VAL 5 CO -0.03 0.00 0.23 0.00 -0.31 0.00 0.00 175.10 175.00 1l3n s ALA 6 N -3.00 -0.43 -0.95 1.32 0.00 -0.38 -3.59 121.76 114.73 1l3n s ALA 6 Ca 0.09 0.74 -0.14 0.00 0.00 0.00 0.00 51.96 52.65 1l3n s ALA 6 Cb 0.01 -1.03 0.21 0.00 0.00 0.00 0.00 23.12 22.31 1l3n s ALA 6 CO 0.06 -0.72 0.97 0.14 0.00 0.00 0.00 175.76 176.21 1l3n s VAL 7 N 2.38 5.50 0.25 0.00 -7.23 -1.26 -1.92 120.40 118.12 1l3n s VAL 7 Ca 0.03 -2.56 -0.30 0.00 -1.81 0.00 0.00 61.98 57.34 1l3n s VAL 7 Cb -0.13 -4.60 -0.09 0.00 0.56 0.00 0.00 36.38 32.13 1l3n s VAL 7 CO -0.09 -1.20 0.96 -0.76 -0.31 0.00 0.00 175.10 173.70 1l3n s LEU 8 N 0.39 4.63 0.17 1.32 1.02 0.13 -4.33 118.68 122.00 1l3n s LEU 8 Ca 0.26 1.98 -0.14 0.00 0.02 0.00 0.00 54.13 56.24 1l3n s LEU 8 Cb -0.08 -3.63 0.02 0.00 0.02 0.00 0.00 46.19 42.52 1l3n s LEU 8 CO -0.08 0.12 0.41 -0.54 0.02 0.00 0.00 176.35 176.28 1l3n s LYS 9 N -1.24 1.22 0.15 1.70 1.02 -0.43 -0.52 119.74 121.64 1l3n s LYS 9 Ca 0.42 -0.93 0.00 0.00 0.02 0.00 0.00 55.97 55.48 1l3n s LYS 9 Cb -0.26 0.46 0.00 0.00 -0.52 0.00 0.00 37.83 37.50 1l3n s LYS 9 CO 0.33 -0.49 0.00 0.41 -0.92 0.00 0.00 175.35 174.68 1l3n n GLY 10 N -0.26 -1.83 0.18 -3.33 0.00 -1.24 -0.81 105.19 97.89 1l3n n GLY 10 Ca -0.11 0.50 -0.17 0.00 0.00 0.00 0.00 46.02 46.24 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 0.75 0.00 1.61 3.32 -1.71 -3.49 116.42 116.90 1l3n h ASP 11 Ca 0.00 -0.67 0.00 0.00 0.02 0.00 0.00 57.03 56.38 1l3n h ASP 11 Cb 0.00 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.33 1l3n h ASP 11 CO 0.00 1.30 0.00 0.61 -1.72 0.00 0.00 179.24 179.43 1l3n n GLY 12 N 0.81 2.31 0.34 2.75 0.00 -1.26 -4.94 105.19 105.19 1l3n n GLY 12 Ca -0.09 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 1.04 -6.26 1.61 0.13 -1.93 -3.37 132.00 123.22 1l3n h PRO 13 Ca 0.00 -0.06 -0.57 0.00 -0.87 0.00 0.00 66.00 64.49 1l3n h PRO 13 Cb 0.00 -0.23 -0.03 0.00 0.13 0.00 0.00 31.00 30.87 1l3n h PRO 13 CO 0.00 0.69 1.28 0.54 -0.23 0.00 0.00 178.00 180.28 1l3n s VAL 14 N -6.07 3.47 -0.16 1.56 0.11 -1.23 -4.04 120.40 114.03 1l3n s VAL 14 Ca -0.13 0.47 0.02 0.00 -2.93 0.00 0.00 61.98 59.41 1l3n s VAL 14 Cb 0.18 -3.65 0.02 0.00 -1.53 0.00 0.00 36.38 31.40 1l3n s VAL 14 CO 0.80 -0.43 -0.20 -1.10 -3.33 0.00 0.00 175.10 170.84 1l3n s GLN 15 N 5.71 2.93 -0.13 1.54 -0.21 0.27 -3.98 119.66 125.80 1l3n s GLN 15 Ca 0.79 -0.81 -0.02 0.00 0.02 0.00 0.00 55.36 55.33 1l3n s GLN 15 Cb -0.22 -2.46 -0.03 0.00 1.00 0.00 0.00 33.01 31.30 1l3n s GLN 15 CO 0.33 -0.12 -0.04 0.20 -2.12 0.00 0.00 175.29 173.54 1l3n s GLY 16 N 1.08 1.74 -0.39 3.09 0.00 0.32 -1.09 107.32 112.07 1l3n s GLY 16 Ca -0.01 -0.83 0.02 0.00 0.00 0.00 0.00 44.72 43.90 1l3n s GLY 16 CO -0.08 -0.27 0.27 -0.42 0.00 0.00 0.00 173.10 172.60 1l3n s ILE 17 N -0.08 0.43 0.02 0.90 1.01 -1.25 0.22 121.20 122.45 1l3n s ILE 17 Ca 0.02 -2.19 -0.10 0.00 0.00 0.00 0.00 60.65 58.38 1l3n s ILE 17 Cb -0.13 -1.31 -0.05 0.00 0.01 0.00 0.00 42.46 40.97 1l3n s ILE 17 CO 0.02 -1.06 0.34 -0.63 0.00 0.00 0.00 174.94 173.61 1l3n s ILE 18 N 0.58 5.18 -0.19 2.92 -1.09 -0.81 -2.91 121.20 124.88 1l3n s ILE 18 Ca 0.23 0.43 -0.01 0.00 -2.23 0.00 0.00 60.65 59.07 1l3n s ILE 18 Cb -0.14 -3.61 0.00 0.00 -1.58 0.00 0.00 42.46 37.13 1l3n s ILE 18 CO -0.07 0.41 -0.12 0.20 -1.23 0.00 0.00 174.94 174.13 1l3n s ASN 19 N -1.52 3.78 -0.57 3.58 0.01 0.60 -1.25 114.94 119.56 1l3n s ASN 19 Ca 0.27 -0.49 -0.13 0.00 -0.71 0.00 0.00 52.86 51.80 1l3n s ASN 19 Cb -0.14 -1.61 0.14 0.00 0.41 0.00 0.00 41.25 40.05 1l3n s ASN 19 CO 0.15 0.02 0.50 -0.36 -1.51 0.00 0.00 177.10 175.90 1l3n s PHE 20 N 1.22 3.38 -0.18 2.20 0.40 0.30 -1.42 117.98 123.88 1l3n s PHE 20 Ca 0.02 -1.61 0.00 0.00 -0.60 0.00 0.00 56.93 54.75 1l3n s PHE 20 Cb -0.14 -3.70 0.01 0.00 0.51 0.00 0.00 43.02 39.70 1l3n s PHE 20 CO -0.05 -1.00 -0.16 -1.21 0.70 0.00 0.00 175.22 173.49 1l3n s GLU 21 N 1.25 3.10 -0.51 0.44 2.02 -0.21 -2.16 118.70 122.64 1l3n s GLU 21 Ca 0.07 -0.78 -0.19 0.00 0.02 0.00 0.00 54.97 54.08 1l3n s GLU 21 Cb -0.26 -2.65 0.06 0.00 0.10 0.00 0.00 34.13 31.38 1l3n s GLU 21 CO -0.00 -0.15 0.63 -0.65 0.02 0.00 0.00 175.26 175.11 1l3n s GLN 22 N 1.21 3.13 0.27 1.61 -0.21 0.33 -0.77 119.66 125.22 1l3n s GLN 22 Ca 0.02 -0.88 -0.01 0.00 0.02 0.00 0.00 55.36 54.52 1l3n s GLN 22 Cb -0.14 -4.10 0.56 0.00 1.00 0.00 0.00 33.01 30.33 1l3n s GLN 22 CO -0.08 -1.23 1.75 1.57 -2.12 0.00 0.00 175.29 175.18 1l3n h LYS 23 N 9.00 0.55 -4.63 2.91 5.09 -1.86 -3.40 116.57 124.23 1l3n h LYS 23 Ca -0.27 -0.03 -0.23 0.00 0.09 0.00 0.00 60.65 60.21 1l3n h LYS 23 Cb 1.09 -0.12 -0.16 0.00 0.10 0.00 0.00 32.23 33.14 1l3n h LYS 23 CO 0.97 0.37 -0.70 -1.21 -2.09 0.00 0.00 179.45 176.78 1l3n s GLU 24 N -5.96 0.78 0.00 0.07 2.02 -1.26 -4.98 118.70 109.37 1l3n s GLU 24 Ca -0.12 -1.25 0.27 0.00 0.02 0.00 0.00 54.97 53.89 1l3n s GLU 24 Cb 0.22 -0.20 1.43 0.00 0.10 0.00 0.00 34.13 35.68 1l3n s GLU 24 CO 0.78 -0.01 1.92 0.45 0.02 0.00 0.00 175.26 178.42 1l3n n SER 25 N 0.18 0.00 0.10 -0.19 2.88 -1.26 -0.64 113.62 114.69 1l3n n SER 25 Ca -0.14 -0.34 0.03 0.00 -1.33 0.00 0.00 58.87 57.09 1l3n n SER 25 Cb 0.60 -0.19 -0.01 0.00 -0.75 0.00 0.00 64.21 63.85 1l3n n SER 25 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 1l3n h ASN 26 N 0.00 0.00 -4.26 -3.46 4.21 -1.95 -3.47 115.58 106.66 1l3n h ASN 26 Ca 0.00 0.00 -0.49 0.00 1.21 0.00 0.00 56.30 57.02 1l3n h ASN 26 Cb 0.17 0.00 0.05 0.00 -1.12 0.00 0.00 38.32 37.42 1l3n h ASN 26 CO 0.00 0.46 0.39 -0.83 -1.29 0.00 0.00 177.43 176.15 1l3n s GLY 27 N -4.57 1.91 0.68 2.83 0.00 0.19 -5.05 107.32 103.30 1l3n s GLY 27 Ca 0.01 0.15 -0.16 0.00 0.00 0.00 0.00 44.72 44.72 1l3n s GLY 27 CO 0.77 0.44 1.19 2.56 0.00 0.00 0.00 173.10 178.07 1l3n s PRO 28 N -4.51 2.49 -0.19 2.90 0.04 -1.26 -4.73 135.00 129.73 1l3n s PRO 28 Ca 0.59 1.71 -0.29 0.00 0.04 0.00 0.00 61.00 63.05 1l3n s PRO 28 Cb -0.12 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.54 1l3n s PRO 28 CO 0.42 -1.56 1.07 0.54 0.04 0.00 0.00 177.00 177.52 1l3n s VAL 29 N -1.94 4.62 -0.38 -0.36 0.11 0.09 -4.38 120.40 118.17 1l3n s VAL 29 Ca 0.74 1.95 -0.22 0.00 -2.93 0.00 0.00 61.98 61.51 1l3n s VAL 29 Cb -0.28 -4.25 0.01 0.00 -1.53 0.00 0.00 36.38 30.33 1l3n s VAL 29 CO 0.41 -0.14 0.73 -0.75 -3.33 0.00 0.00 175.10 172.03 1l3n s LYS 30 N 3.00 3.66 -0.73 1.54 2.20 0.05 -0.79 119.74 128.67 1l3n s LYS 30 Ca 0.47 0.15 -0.19 0.00 -0.36 0.00 0.00 55.97 56.03 1l3n s LYS 30 Cb -0.17 -3.83 0.12 0.00 -1.51 0.00 0.00 37.83 32.44 1l3n s LYS 30 CO 0.10 -0.86 0.89 0.14 -0.36 0.00 0.00 175.35 175.27 1l3n s VAL 31 N 2.99 4.77 0.28 4.02 -7.23 0.11 -1.04 120.40 124.30 1l3n s VAL 31 Ca 0.29 -1.19 0.07 0.00 -1.81 0.00 0.00 61.98 59.34 1l3n s VAL 31 Cb -0.13 -4.62 -0.03 0.00 0.56 0.00 0.00 36.38 32.15 1l3n s VAL 31 CO 0.17 -1.30 0.20 -1.66 -0.31 0.00 0.00 175.10 172.20 1l3n s TRP 32 N 2.72 2.99 0.00 2.82 -2.14 -0.51 -0.99 118.94 123.82 1l3n s TRP 32 Ca 0.21 -0.19 0.00 0.00 2.66 0.00 0.00 56.10 58.77 1l3n s TRP 32 Cb -0.15 -1.51 0.00 0.00 -3.10 0.00 0.00 33.47 28.70 1l3n s TRP 32 CO 0.01 0.42 0.00 0.41 -2.66 0.00 0.00 176.95 175.13 1l3n n GLY 33 N -1.21 0.38 2.52 3.67 0.00 0.20 -0.30 105.19 110.46 1l3n n GLY 33 Ca -0.06 -0.83 -0.29 0.00 0.00 0.00 0.00 46.02 44.84 1l3n n GLY 33 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1l3n s SER 34 N 0.00 3.33 0.79 1.61 0.15 -1.15 -0.80 113.70 117.64 1l3n s SER 34 Ca 0.00 -1.70 -0.12 0.00 0.70 0.00 0.00 55.95 54.84 1l3n s SER 34 Cb 0.00 -0.41 0.07 0.00 -1.71 0.00 0.00 66.02 63.97 1l3n s SER 34 CO 0.00 -0.38 1.12 0.27 1.20 0.00 0.00 173.24 175.44 1l3n s ILE 35 N 1.63 2.85 -0.05 6.45 -4.36 -1.10 -4.12 121.20 122.49 1l3n s ILE 35 Ca 0.13 0.28 -0.13 0.00 -0.26 0.00 0.00 60.65 60.66 1l3n s ILE 35 Cb -0.19 -3.13 0.03 0.00 1.25 0.00 0.00 42.46 40.42 1l3n s ILE 35 CO -0.20 -0.36 0.31 -0.75 0.24 0.00 0.00 174.94 174.18 1l3n s LYS 36 N -5.29 0.57 0.00 0.37 2.20 -0.25 -3.33 119.74 114.00 1l3n s LYS 36 Ca 0.61 0.03 0.00 0.00 -0.36 0.00 0.00 55.97 56.24 1l3n s LYS 36 Cb -0.13 0.26 0.00 0.00 -1.51 0.00 0.00 37.83 36.45 1l3n s LYS 36 CO 0.53 -0.13 0.00 0.41 -0.36 0.00 0.00 175.35 175.79 1l3n n GLY 37 N 1.84 0.93 3.71 5.54 0.00 -1.03 -0.57 105.19 115.61 1l3n n GLY 37 Ca -0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 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 1.37 0.65 0.99 1.02 -1.17 -3.55 118.68 117.99 1l3n s LEU 38 Ca 0.00 0.50 -0.02 0.00 0.02 0.00 0.00 54.13 54.63 1l3n s LEU 38 Cb 0.00 -2.34 0.07 0.00 0.02 0.00 0.00 46.19 43.94 1l3n s LEU 38 CO 0.00 -3.66 0.91 0.28 0.02 0.00 0.00 176.35 173.90 1l3n s THR 39 N -3.31 2.40 1.17 5.49 -1.32 -1.26 -3.48 115.64 115.33 1l3n s THR 39 Ca 0.72 -0.52 -0.13 0.00 -1.21 0.00 0.00 61.69 60.55 1l3n s THR 39 Cb -0.08 -2.88 0.29 0.00 -1.51 0.00 0.00 72.50 68.32 1l3n s THR 39 CO 0.55 0.00 1.03 -0.70 -2.21 0.00 0.00 174.62 173.29 1l3n s GLU 40 N -5.03 -0.95 0.04 7.08 -6.30 -1.26 -4.68 118.70 107.61 1l3n s GLU 40 Ca 0.61 0.77 0.00 0.00 -2.50 0.00 0.00 54.97 53.85 1l3n s GLU 40 Cb -0.09 -1.55 0.00 0.00 0.00 0.00 0.00 34.13 32.49 1l3n s GLU 40 CO 0.42 -3.73 0.00 0.41 0.02 0.00 0.00 175.26 172.38 1l3n n GLY 41 N 0.66 -3.35 3.77 -1.50 0.00 -0.46 -4.78 105.19 99.53 1l3n n GLY 41 Ca 0.03 -1.87 -0.38 0.00 0.00 0.00 0.00 46.02 43.79 1l3n n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l3n s LEU 42 N 0.00 4.19 -0.04 0.99 1.02 -1.26 -0.56 118.68 123.03 1l3n s LEU 42 Ca 0.00 2.41 -0.03 0.00 0.02 0.00 0.00 54.13 56.53 1l3n s LEU 42 Cb 0.00 -4.00 0.01 0.00 0.02 0.00 0.00 46.19 42.22 1l3n s LEU 42 CO 0.00 -0.72 0.10 -1.00 0.02 0.00 0.00 176.35 174.74 1l3n s HIS 43 N -1.38 -0.10 -0.17 0.29 3.76 0.75 -3.06 115.29 115.38 1l3n s HIS 43 Ca 0.57 0.26 -0.16 0.00 -0.15 0.00 0.00 55.06 55.58 1l3n s HIS 43 Cb -0.32 0.03 -0.07 0.00 1.11 0.00 0.00 32.58 33.33 1l3n s HIS 43 CO 0.41 -0.05 0.58 0.41 -0.85 0.00 0.00 174.74 175.24 1l3n n GLY 44 N 3.09 0.04 2.67 -2.22 0.00 0.28 -1.61 105.19 107.44 1l3n n GLY 44 Ca -0.13 0.35 -0.22 0.00 0.00 0.00 0.00 46.02 46.02 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 1.24 -0.06 0.26 1.61 2.19 0.51 -1.26 117.98 122.47 1l3n s PHE 45 Ca 0.37 -0.22 -0.08 0.00 0.33 0.00 0.00 56.93 57.33 1l3n s PHE 45 Cb -0.51 -0.58 -0.01 0.00 -1.31 0.00 0.00 43.02 40.61 1l3n s PHE 45 CO 0.27 -0.68 0.41 -1.01 1.83 0.00 0.00 175.22 176.03 1l3n s HIS 46 N 2.23 0.70 -0.20 10.12 0.09 -1.00 -0.73 115.29 126.50 1l3n s HIS 46 Ca 0.06 -1.00 -0.11 0.00 -0.00 0.00 0.00 55.06 54.02 1l3n s HIS 46 Cb -0.16 -0.03 -0.20 0.00 -0.00 0.00 0.00 32.58 32.19 1l3n s HIS 46 CO -0.20 -0.96 0.10 0.28 -0.00 0.00 0.00 174.74 173.96 1l3n n VAL 47 N -0.40 1.62 -1.38 -0.90 0.31 0.09 -0.79 118.33 116.87 1l3n n VAL 47 Ca -0.00 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 63.92 1l3n n VAL 47 Cb 0.63 -1.79 0.00 0.00 -0.91 0.00 0.00 33.84 31.76 1l3n n VAL 47 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1l3n n HIS 48 N -3.85 -3.81 -0.04 3.52 8.25 -1.26 -2.63 115.22 115.40 1l3n n HIS 48 Ca -0.38 2.04 -0.12 0.00 -0.26 0.00 0.00 57.72 59.00 1l3n n HIS 48 Cb 0.90 -3.21 -0.07 0.00 1.12 0.00 0.00 29.99 28.74 1l3n n HIS 48 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 1l3n h GLU 49 N 0.88 0.24 -6.47 -0.41 4.57 -1.82 -3.37 114.58 108.20 1l3n h GLU 49 Ca 0.00 -0.09 -0.53 0.00 -1.18 0.00 0.00 59.36 57.56 1l3n h GLU 49 Cb 0.36 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.94 1l3n h GLU 49 CO 0.00 0.52 0.54 -0.06 -1.18 0.00 0.00 179.01 178.83 1l3n s PHE 50 N -4.82 3.46 -0.06 0.92 0.40 -1.26 -4.72 117.98 111.90 1l3n s PHE 50 Ca -0.14 1.35 0.13 0.00 -0.60 0.00 0.00 56.93 57.67 1l3n s PHE 50 Cb 0.05 -3.38 -0.19 0.00 0.51 0.00 0.00 43.02 40.01 1l3n s PHE 50 CO 0.72 -1.13 0.81 0.78 0.70 0.00 0.00 175.22 177.10 1l3n h GLY 51 N 6.81 0.00 -0.98 4.36 0.00 -1.85 -2.45 103.07 108.96 1l3n h GLY 51 Ca -0.41 0.00 -0.40 0.00 0.00 0.00 0.00 47.33 46.52 1l3n h GLY 51 CO 0.80 0.00 -0.06 0.51 0.00 0.00 0.00 176.54 177.80 1l3n s ASP 52 N -6.07 -0.35 0.20 0.19 1.47 -1.26 -4.38 116.67 106.48 1l3n s ASP 52 Ca -0.03 0.97 0.00 0.00 1.18 0.00 0.00 52.55 54.67 1l3n s ASP 52 Cb 0.08 -1.42 0.00 0.00 -0.34 0.00 0.00 42.92 41.24 1l3n s ASP 52 CO 0.82 -4.94 0.00 0.59 0.68 0.00 0.00 175.17 172.31 1l3n n ASN 53 N -5.36 -0.87 0.00 2.11 5.03 -1.26 -4.49 115.26 110.42 1l3n n ASN 53 Ca 0.10 0.36 0.00 0.00 0.87 0.00 0.00 54.58 55.92 1l3n n ASN 53 Cb 0.59 0.97 0.00 0.00 -1.02 0.00 0.00 39.78 40.31 1l3n n ASN 53 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1l3n n THR 54 N -3.06 0.00 -0.04 3.41 -2.24 -1.26 -1.15 114.28 109.94 1l3n n THR 54 Ca 0.00 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.69 1l3n n THR 54 Cb 0.00 0.00 0.07 0.00 -2.10 0.00 0.00 70.33 68.30 1l3n n THR 54 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1l3n h ALA 55 N 0.00 0.76 0.00 6.98 0.00 -2.00 -3.50 119.26 121.50 1l3n h ALA 55 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1l3n h ALA 55 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1l3n h ALA 55 CO 0.00 0.66 0.00 0.41 0.00 0.00 0.00 179.25 180.32 1l3n n GLY 56 N 0.04 0.20 1.50 0.00 0.00 -0.30 -4.83 105.19 101.79 1l3n n GLY 56 Ca -0.02 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.19 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 1.46 0.67 0.18 0.00 -1.04 -1.26 -4.61 114.28 109.68 1l3n n THR 58 Ca 0.00 -0.18 0.05 0.00 -2.04 0.00 0.00 64.05 61.88 1l3n n THR 58 Cb 0.47 -1.61 0.21 0.00 -1.82 0.00 0.00 70.33 67.58 1l3n n THR 58 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1l3n n SER 59 N -3.50 3.19 -3.31 8.00 7.64 -1.22 -4.50 113.62 119.93 1l3n n SER 59 Ca -0.24 -2.36 -0.32 0.00 1.01 0.00 0.00 58.87 56.96 1l3n n SER 59 Cb 0.67 -0.50 -0.02 0.00 -1.01 0.00 0.00 64.21 63.35 1l3n n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1l3n n ALA 60 N 0.46 5.93 0.00 -0.43 0.00 -1.26 -4.76 120.51 120.45 1l3n n ALA 60 Ca 0.15 -2.89 0.00 0.00 0.00 0.00 0.00 53.44 50.70 1l3n n ALA 60 Cb 0.65 -3.25 0.00 0.00 0.00 0.00 0.00 19.45 16.85 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 3.76 0.00 3.20 0.00 0.00 -1.26 -4.62 105.19 106.27 1l3n n GLY 61 Ca 0.60 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.23 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 0.02 1.95 -2.65 1.61 -0.04 -1.26 -3.93 135.00 130.69 1l3n n PRO 62 Ca 0.00 -2.28 -0.09 0.00 -0.04 0.00 0.00 63.50 61.08 1l3n n PRO 62 Cb 0.00 -3.24 0.02 0.00 -0.04 0.00 0.00 33.50 30.24 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 8.99 -0.89 -0.89 0.54 8.25 -1.26 -4.52 115.22 125.43 1l3n n HIS 63 Ca 0.49 0.26 -0.27 0.00 -0.26 0.00 0.00 57.72 57.94 1l3n n HIS 63 Cb 0.42 -2.49 -0.02 0.00 1.12 0.00 0.00 29.99 29.02 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 -3.71 1.65 -1.87 4.41 3.72 -1.25 -4.91 117.46 115.49 1l3n n PHE 64 Ca -0.04 -2.27 -0.32 0.00 -0.05 0.00 0.00 57.45 54.77 1l3n n PHE 64 Cb 0.54 -1.89 0.02 0.00 -0.94 0.00 0.00 39.48 37.21 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 3.08 5.68 0.01 4.37 4.22 -1.26 -4.64 114.94 126.40 1l3n s ASN 65 Ca 0.48 1.71 -0.13 0.00 -2.14 0.00 0.00 52.86 52.78 1l3n s ASN 65 Cb 0.12 -2.51 -0.07 0.00 1.28 0.00 0.00 41.25 40.07 1l3n s ASN 65 CO -0.04 -1.24 0.92 1.55 -2.04 0.00 0.00 177.10 176.25 1l3n h PRO 66 N -0.02 -0.45 -3.98 3.55 0.13 -1.92 -3.20 132.00 126.12 1l3n h PRO 66 Ca -0.46 0.03 -0.61 0.00 -0.87 0.00 0.00 66.00 64.10 1l3n h PRO 66 Cb 1.21 0.10 0.02 0.00 0.13 0.00 0.00 31.00 32.46 1l3n h PRO 66 CO 0.57 -0.30 2.74 1.47 -0.23 0.00 0.00 178.00 182.25 1l3n n LEU 67 N -3.59 5.44 -4.62 1.56 -0.00 -1.26 -4.92 117.00 109.60 1l3n n LEU 67 Ca -0.06 -3.35 -0.43 0.00 -0.00 0.00 0.00 56.01 52.18 1l3n n LEU 67 Cb 0.18 -1.29 -0.03 0.00 -0.00 0.00 0.00 43.42 42.28 1l3n n LEU 67 CO 0.14 0.46 1.65 -0.55 -0.00 0.00 0.00 177.39 179.09 1l3n s SER 68 N 3.92 5.96 0.00 1.45 0.15 -1.21 -4.80 113.70 119.18 1l3n s SER 68 Ca 0.52 1.98 0.00 0.00 0.70 0.00 0.00 55.95 59.15 1l3n s SER 68 Cb 0.14 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.93 1l3n s SER 68 CO 0.02 -1.54 0.00 0.54 1.20 0.00 0.00 173.24 173.45 1l3n n ARG 69 N 8.16 0.00 -3.90 5.44 1.74 -1.26 -5.12 116.66 121.73 1l3n n ARG 69 Ca 0.24 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.24 1l3n n ARG 69 Cb 0.44 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.80 1l3n n ARG 69 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1l3n s LYS 70 N 0.00 0.81 0.14 5.56 -0.14 -0.69 -5.07 119.74 120.36 1l3n s LYS 70 Ca 0.00 -1.01 -0.31 0.00 -1.36 0.00 0.00 55.97 53.29 1l3n s LYS 70 Cb 0.00 0.32 -0.10 0.00 -1.68 0.00 0.00 37.83 36.37 1l3n s LYS 70 CO 0.00 -0.24 1.71 -1.58 -0.76 0.00 0.00 175.35 174.48 1l3n s HIS 71 N -3.87 2.57 0.00 3.18 5.65 -1.24 -2.20 115.29 119.38 1l3n s HIS 71 Ca 0.06 0.28 0.00 0.00 0.25 0.00 0.00 55.06 55.64 1l3n s HIS 71 Cb 0.05 -4.07 0.00 0.00 -1.18 0.00 0.00 32.58 27.39 1l3n s HIS 71 CO -0.11 -4.21 0.00 0.41 -0.65 0.00 0.00 174.74 170.19 1l3n n GLY 72 N 4.02 5.11 0.00 1.59 0.00 -1.26 -3.00 105.19 111.65 1l3n n GLY 72 Ca 0.16 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.60 0.03 -0.02 0.00 -1.23 -4.73 105.19 98.64 1l3n n GLY 73 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 0.30 -0.00 1.61 -0.04 -1.25 -1.10 135.00 134.52 1l3n n PRO 74 Ca 0.00 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.52 1l3n n PRO 74 Cb 0.00 -1.01 -0.08 0.00 -0.04 0.00 0.00 33.50 32.37 1l3n n PRO 74 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1l3n n LYS 75 N -0.45 1.48 -3.78 0.54 4.76 -1.26 -5.01 118.16 114.45 1l3n n LYS 75 Ca 0.00 -0.07 -0.14 0.00 -2.87 0.00 0.00 58.31 55.23 1l3n n LYS 75 Cb 0.00 -1.20 -0.15 0.00 -1.84 0.00 0.00 35.03 31.85 1l3n n LYS 75 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1l3n s ASP 76 N -2.89 -0.01 0.45 4.39 1.11 -0.25 -5.03 116.67 114.44 1l3n s ASP 76 Ca -0.01 0.13 0.25 0.00 0.18 0.00 0.00 52.55 53.10 1l3n s ASP 76 Cb 0.08 0.04 0.84 0.00 1.07 0.00 0.00 42.92 44.95 1l3n s ASP 76 CO 0.51 -0.11 1.79 -0.08 1.18 0.00 0.00 175.17 178.45 1l3n h GLU 77 N 7.02 0.00 0.00 8.23 4.81 -1.95 -2.67 114.58 130.03 1l3n h GLU 77 Ca -0.41 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 1l3n h GLU 77 Cb 1.14 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1l3n h GLU 77 CO 0.46 0.17 0.00 -0.85 -0.73 0.00 0.00 179.01 178.07 1l3n n GLU 78 N -3.26 0.98 -1.40 1.92 0.00 -1.26 -4.91 120.64 112.71 1l3n n GLU 78 Ca 0.01 0.00 -0.45 0.00 0.00 0.00 0.00 57.16 56.72 1l3n n GLU 78 Cb 0.45 -1.41 -0.01 0.00 0.00 0.00 0.00 31.44 30.47 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 -0.91 0.24 0.40 3.44 0.00 -1.01 -1.70 116.66 117.13 1l3n n ARG 79 Ca 0.19 0.09 -0.16 0.00 -0.00 0.00 0.00 57.85 57.97 1l3n n ARG 79 Cb 0.09 -1.18 -0.08 0.00 -0.00 0.00 0.00 32.46 31.29 1l3n n ARG 79 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1l3n h HIS 80 N 0.87 -0.99 0.00 2.89 3.86 -1.76 -3.44 115.15 116.57 1l3n h HIS 80 Ca -0.34 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 58.85 1l3n h HIS 80 Cb 1.42 0.33 0.00 0.00 1.06 0.00 0.00 27.41 30.23 1l3n h HIS 80 CO 0.38 -0.60 0.00 1.55 0.86 0.00 0.00 177.93 180.12 1l3n n VAL 81 N -4.84 0.00 -2.98 2.45 3.14 -1.26 -4.80 118.33 110.04 1l3n n VAL 81 Ca -0.13 0.00 -0.26 0.00 -2.96 0.00 0.00 64.34 60.99 1l3n n VAL 81 Cb 0.41 0.00 -0.04 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 -1.40 5.39 3.42 7.55 0.00 -1.26 -4.90 105.19 113.99 1l3n n GLY 82 Ca 0.00 -2.68 -0.45 0.00 0.00 0.00 0.00 46.02 42.90 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 -3.35 6.62 0.29 1.61 1.01 -1.26 -0.73 116.67 120.86 1l3n s ASP 83 Ca 0.48 -2.13 0.08 0.00 0.71 0.00 0.00 52.55 51.69 1l3n s ASP 83 Cb 0.28 -2.35 0.44 0.00 1.01 0.00 0.00 42.92 42.31 1l3n s ASP 83 CO -0.13 -0.96 1.67 -0.07 0.21 0.00 0.00 175.17 175.90 1l3n h LEU 84 N 9.76 0.15 0.00 1.23 3.38 -1.72 -3.32 115.31 124.80 1l3n h LEU 84 Ca 0.10 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1l3n h LEU 84 Cb 1.03 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.74 1l3n h LEU 84 CO 1.02 0.62 0.00 0.61 0.09 0.00 0.00 178.44 180.78 1l3n n GLY 85 N -0.05 1.01 3.06 0.83 0.00 0.09 -4.43 105.19 105.71 1l3n n GLY 85 Ca -0.02 -0.83 -0.29 0.00 0.00 0.00 0.00 46.02 44.88 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 2.57 -0.08 1.61 0.01 -1.26 -0.37 114.94 113.42 1l3n s ASN 86 Ca 0.00 -0.46 0.01 0.00 -0.71 0.00 0.00 52.86 51.70 1l3n s ASN 86 Cb 0.00 -1.15 -0.03 0.00 0.41 0.00 0.00 41.25 40.48 1l3n s ASN 86 CO 0.00 0.01 -0.08 0.68 -1.51 0.00 0.00 177.10 176.20 1l3n s VAL 87 N 1.07 3.58 -0.26 1.60 -7.23 -0.63 -4.84 120.40 113.70 1l3n s VAL 87 Ca -0.04 -0.51 -0.18 0.00 -1.81 0.00 0.00 61.98 59.44 1l3n s VAL 87 Cb -0.15 -2.47 -0.03 0.00 0.56 0.00 0.00 36.38 34.29 1l3n s VAL 87 CO -0.04 0.58 0.52 -0.89 -0.31 0.00 0.00 175.10 174.96 1l3n s THR 88 N -0.53 5.07 -0.17 5.32 2.01 -1.26 -0.17 115.64 125.90 1l3n s THR 88 Ca 0.08 0.89 -0.09 0.00 0.31 0.00 0.00 61.69 62.88 1l3n s THR 88 Cb -0.12 -3.83 -0.05 0.00 0.01 0.00 0.00 72.50 68.51 1l3n s THR 88 CO 0.02 0.09 0.15 0.00 -0.69 0.00 0.00 174.62 174.19 1l3n s ALA 89 N 2.29 3.74 1.23 7.40 0.00 0.28 -4.06 121.76 132.64 1l3n s ALA 89 Ca 0.21 -0.65 -0.15 0.00 0.00 0.00 0.00 51.96 51.38 1l3n s ALA 89 Cb -0.16 -2.13 0.30 0.00 0.00 0.00 0.00 23.12 21.14 1l3n s ALA 89 CO 0.09 0.30 0.92 -3.47 0.00 0.00 0.00 175.76 173.60 1l3n n ASP 90 N 3.03 -2.21 -0.35 0.00 2.03 0.22 -1.35 116.55 117.93 1l3n n ASP 90 Ca -0.17 -0.29 0.28 0.00 0.52 0.00 0.00 54.79 55.14 1l3n n ASP 90 Cb 0.53 -1.20 0.59 0.00 -0.72 0.00 0.00 41.12 40.32 1l3n n ASP 90 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 1l3n h LYS 91 N -2.83 0.24 0.00 -0.67 2.10 -1.92 0.14 116.57 113.63 1l3n h LYS 91 Ca -0.61 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.03 1l3n h LYS 91 Cb 1.34 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 1l3n h LYS 91 CO 0.47 0.16 0.00 -0.25 -2.00 0.00 0.00 179.45 177.82 1l3n n ASP 92 N -4.54 0.00 0.00 7.07 9.92 -1.26 -4.59 116.55 123.15 1l3n n ASP 92 Ca 0.28 -0.87 0.00 0.00 -0.53 0.00 0.00 54.79 53.67 1l3n n ASP 92 Cb 1.08 -0.04 0.00 0.00 -0.64 0.00 0.00 41.12 41.52 1l3n n ASP 92 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1l3n n GLY 93 N 0.98 0.56 3.52 0.44 0.00 0.50 -3.80 105.19 107.39 1l3n n GLY 93 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.26 4.53 -0.29 1.61 1.01 -1.25 -2.45 120.40 121.30 1l3n s VAL 94 Ca 0.00 0.21 -0.09 0.00 0.00 0.00 0.00 61.98 62.10 1l3n s VAL 94 Cb 0.00 -4.45 -0.02 0.00 0.00 0.00 0.00 36.38 31.91 1l3n s VAL 94 CO 0.00 -0.96 0.14 0.00 0.00 0.00 0.00 175.10 174.28 1l3n s ALA 95 N 3.58 3.30 -0.36 5.51 0.00 -1.21 -0.61 121.76 131.97 1l3n s ALA 95 Ca 0.28 -1.25 -0.29 0.00 0.00 0.00 0.00 51.96 50.70 1l3n s ALA 95 Cb -0.13 -2.32 0.02 0.00 0.00 0.00 0.00 23.12 20.69 1l3n s ALA 95 CO 0.19 -0.70 1.13 0.16 0.00 0.00 0.00 175.76 176.54 1l3n s ASP 96 N 1.65 6.80 -0.14 0.00 -4.77 -1.26 -2.72 116.67 116.23 1l3n s ASP 96 Ca 0.06 0.91 -0.04 0.00 -3.30 0.00 0.00 52.55 50.18 1l3n s ASP 96 Cb -0.16 -2.54 -0.03 0.00 -1.09 0.00 0.00 42.92 39.09 1l3n s ASP 96 CO 0.06 -1.02 -0.00 -0.69 0.70 0.00 0.00 175.17 174.22 1l3n s VAL 97 N 4.02 4.22 -0.44 2.11 1.01 0.02 -4.80 120.40 126.54 1l3n s VAL 97 Ca 0.48 -0.25 0.07 0.00 0.00 0.00 0.00 61.98 62.28 1l3n s VAL 97 Cb -0.11 -2.83 0.33 0.00 0.00 0.00 0.00 36.38 33.76 1l3n s VAL 97 CO 0.21 0.53 1.07 -1.54 0.00 0.00 0.00 175.10 175.37 1l3n n SER 98 N 3.05 -1.78 -4.94 3.32 3.41 -1.25 -0.63 113.62 114.81 1l3n n SER 98 Ca -0.18 -3.51 -0.25 0.00 -0.26 0.00 0.00 58.87 54.68 1l3n n SER 98 Cb 0.53 1.45 -0.02 0.00 -0.26 0.00 0.00 64.21 65.90 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 5.18 0.01 -1.33 1.01 -0.17 -4.91 121.20 120.79 1l3n s ILE 99 Ca 0.25 -0.49 0.03 0.00 0.00 0.00 0.00 60.65 60.44 1l3n s ILE 99 Cb 0.31 -3.80 -0.01 0.00 0.01 0.00 0.00 42.46 38.97 1l3n s ILE 99 CO -0.06 -0.33 -0.10 -1.83 0.00 0.00 0.00 174.94 172.63 1l3n s GLU 100 N -3.77 0.72 -0.11 2.79 -1.05 -1.26 0.10 118.70 116.12 1l3n s GLU 100 Ca 0.38 -0.49 0.01 0.00 -0.15 0.00 0.00 54.97 54.73 1l3n s GLU 100 Cb -0.10 -0.67 0.02 0.00 -0.44 0.00 0.00 34.13 32.93 1l3n s GLU 100 CO 0.31 0.17 -0.12 -0.51 0.95 0.00 0.00 175.26 176.06 1l3n s ASP 101 N -0.65 2.26 0.00 0.83 1.01 0.03 -4.97 116.67 115.18 1l3n s ASP 101 Ca 0.01 -0.37 0.25 0.00 0.71 0.00 0.00 52.55 53.15 1l3n s ASP 101 Cb -0.05 -0.98 0.57 0.00 1.01 0.00 0.00 42.92 43.47 1l3n s ASP 101 CO 0.00 -0.03 1.45 -1.54 0.21 0.00 0.00 175.17 175.27 1l3n n SER 102 N 4.40 0.61 -0.07 0.27 3.41 -1.26 -0.73 113.62 120.25 1l3n n SER 102 Ca -0.18 -0.39 -0.19 0.00 -0.26 0.00 0.00 58.87 57.86 1l3n n SER 102 Cb 0.51 0.22 -0.13 0.00 -0.26 0.00 0.00 64.21 64.55 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 -1.31 1.60 -3.70 -3.33 3.14 -1.26 -4.95 118.33 108.52 1l3n n VAL 103 Ca 0.07 -0.62 -0.26 0.00 -2.96 0.00 0.00 64.34 60.56 1l3n n VAL 103 Cb 0.34 -1.49 -0.03 0.00 -1.06 0.00 0.00 33.84 31.60 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 -2.54 5.20 0.08 1.55 1.09 -1.26 -4.99 121.20 120.33 1l3n s ILE 104 Ca -0.28 -0.46 -0.23 0.00 -1.10 0.00 0.00 60.65 58.58 1l3n s ILE 104 Cb 0.08 -3.76 0.06 0.00 -1.06 0.00 0.00 42.46 37.77 1l3n s ILE 104 CO 0.68 -0.24 0.55 -0.44 -0.10 0.00 0.00 174.94 175.40 1l3n s SER 105 N -3.37 -0.48 0.42 3.58 0.01 -1.26 -4.35 113.70 108.24 1l3n s SER 105 Ca 0.38 0.13 0.23 0.00 1.31 0.00 0.00 55.95 58.00 1l3n s SER 105 Cb -0.11 0.53 0.70 0.00 0.21 0.00 0.00 66.02 67.35 1l3n s SER 105 CO 0.30 -0.80 1.73 -0.07 0.41 0.00 0.00 173.24 174.81 1l3n h LEU 106 N 2.52 0.00 -7.38 2.44 4.07 -1.92 -2.80 115.31 112.24 1l3n h LEU 106 Ca -0.32 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 57.52 1l3n h LEU 106 Cb 1.24 0.00 -0.23 0.00 1.08 0.00 0.00 40.66 42.75 1l3n h LEU 106 CO 0.41 0.22 -0.26 -0.44 -1.08 0.00 0.00 178.44 177.28 1l3n s SER 107 N -6.19 -0.35 0.00 -0.43 0.01 -1.26 -4.41 113.70 101.07 1l3n s SER 107 Ca 0.02 0.60 0.00 0.00 1.31 0.00 0.00 55.95 57.88 1l3n s SER 107 Cb 0.09 0.66 0.00 0.00 0.21 0.00 0.00 66.02 66.97 1l3n s SER 107 CO 0.65 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.70 1l3n n GLY 108 N 2.45 0.11 1.69 3.44 0.00 -1.26 -4.81 105.19 106.81 1l3n n GLY 108 Ca -0.15 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1l3n n GLY 108 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1l3n n ASP 109 N 0.00 -0.51 0.13 1.61 -0.08 -1.26 -4.95 116.55 111.49 1l3n n ASP 109 Ca 0.00 0.12 -0.00 0.00 -1.51 0.00 0.00 54.79 53.40 1l3n n ASP 109 Cb 0.00 0.84 0.12 0.00 2.34 0.00 0.00 41.12 44.42 1l3n n ASP 109 CO 0.00 0.00 0.00 0.45 0.12 0.00 0.00 177.20 177.77 1l3n h HIS 110 N 0.00 0.00 -2.52 -0.67 3.86 -1.90 -3.47 115.15 110.44 1l3n h HIS 110 Ca 0.00 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.16 1l3n h HIS 110 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1l3n h HIS 110 CO 0.00 0.63 -0.17 0.45 0.86 0.00 0.00 177.93 179.70 1l3n n SER 111 N -3.54 -0.80 -1.56 2.45 2.88 -1.21 -4.72 113.62 107.11 1l3n n SER 111 Ca -0.00 -0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 1l3n n SER 111 Cb 0.68 -0.23 0.00 0.00 -0.75 0.00 0.00 64.21 63.91 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 0.07 1.53 -0.06 2.46 -5.35 -1.06 -4.23 119.36 112.72 1l3n n ILE 112 Ca -0.01 -0.37 -0.18 0.00 -0.27 0.00 0.00 62.75 61.92 1l3n n ILE 112 Cb 0.09 -1.36 -0.13 0.00 -1.74 0.00 0.00 39.64 36.51 1l3n n ILE 112 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1l3n h ILE 113 N 1.13 1.44 -1.57 7.28 1.08 -1.84 -3.37 117.51 121.65 1l3n h ILE 113 Ca 0.00 -2.33 -0.72 0.00 -0.39 0.00 0.00 64.86 61.42 1l3n h ILE 113 Cb 0.80 2.98 -0.29 0.00 -3.07 0.00 0.00 36.82 37.23 1l3n h ILE 113 CO 0.00 0.55 0.84 0.61 -0.69 0.00 0.00 178.15 179.46 1l3n n GLY 114 N 1.59 5.71 3.71 5.37 0.00 -1.26 -3.13 105.19 117.17 1l3n n GLY 114 Ca -0.18 -2.44 -0.23 0.00 0.00 0.00 0.00 46.02 43.17 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 -3.94 2.44 -0.41 1.61 1.81 -1.26 -3.49 118.95 115.71 1l3n s ARG 115 Ca 0.56 -1.40 -0.06 0.00 -1.72 0.00 0.00 55.73 53.11 1l3n s ARG 115 Cb 0.46 -2.24 0.10 0.00 -0.45 0.00 0.00 34.95 32.82 1l3n s ARG 115 CO -0.24 0.27 0.22 0.99 -0.68 0.00 0.00 175.30 175.86 1l3n s THR 116 N -2.33 3.70 0.16 0.02 2.01 -0.92 -3.03 115.64 115.25 1l3n s THR 116 Ca 0.34 -1.74 -0.30 0.00 0.31 0.00 0.00 61.69 60.31 1l3n s THR 116 Cb -0.05 -3.39 -0.07 0.00 0.01 0.00 0.00 72.50 68.99 1l3n s THR 116 CO 0.22 -0.59 1.10 -0.76 -0.69 0.00 0.00 174.62 173.90 1l3n s LEU 117 N 1.28 4.47 -0.07 4.42 2.01 0.86 -4.14 118.68 127.51 1l3n s LEU 117 Ca 0.05 2.05 0.04 0.00 0.01 0.00 0.00 54.13 56.27 1l3n s LEU 117 Cb -0.23 -3.60 0.00 0.00 0.01 0.00 0.00 46.19 42.37 1l3n s LEU 117 CO -0.01 -0.24 -0.19 -0.69 1.01 0.00 0.00 176.35 176.23 1l3n s VAL 118 N -0.06 1.63 -0.24 -1.59 1.01 0.03 -1.13 120.40 120.04 1l3n s VAL 118 Ca 0.50 -0.79 -0.12 0.00 0.00 0.00 0.00 61.98 61.57 1l3n s VAL 118 Cb -0.29 -1.42 -0.05 0.00 0.00 0.00 0.00 36.38 34.63 1l3n s VAL 118 CO 0.34 0.46 0.25 -0.69 0.00 0.00 0.00 175.10 175.46 1l3n s VAL 119 N 0.32 5.29 0.22 2.92 1.01 0.60 -2.38 120.40 128.38 1l3n s VAL 119 Ca -0.13 0.34 0.08 0.00 0.00 0.00 0.00 61.98 62.28 1l3n s VAL 119 Cb -0.15 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 1l3n s VAL 119 CO 0.05 0.28 0.05 -1.00 0.00 0.00 0.00 175.10 174.49 1l3n s HIS 120 N 1.39 2.88 0.07 5.22 3.76 -0.39 -1.69 115.29 126.55 1l3n s HIS 120 Ca 0.11 -0.15 -0.15 0.00 -0.15 0.00 0.00 55.06 54.72 1l3n s HIS 120 Cb -0.15 -1.34 -0.04 0.00 1.11 0.00 0.00 32.58 32.17 1l3n s HIS 120 CO 0.07 0.55 1.26 1.49 -0.85 0.00 0.00 174.74 177.27 1l3n h GLU 121 N 2.15 -0.04 -5.83 1.40 4.81 -0.77 -3.23 114.58 113.06 1l3n h GLU 121 Ca -0.47 0.00 -0.59 0.00 -0.13 0.00 0.00 59.36 58.18 1l3n h GLU 121 Cb 1.23 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 30.55 1l3n h GLU 121 CO 0.60 -0.03 -0.40 0.15 -0.73 0.00 0.00 179.01 178.60 1l3n s LYS 122 N -4.23 2.26 0.42 1.92 1.02 0.88 -4.82 119.74 117.19 1l3n s LYS 122 Ca -0.06 -1.99 -0.22 0.00 0.02 0.00 0.00 55.97 53.72 1l3n s LYS 122 Cb 0.05 -2.00 -0.09 0.00 -0.52 0.00 0.00 37.83 35.27 1l3n s LYS 122 CO 0.30 -0.40 1.01 0.00 -0.92 0.00 0.00 175.35 175.34 1l3n s ALA 123 N -2.71 3.02 0.30 5.17 0.00 -1.17 -0.55 121.76 125.81 1l3n s ALA 123 Ca 0.33 0.59 -0.27 0.00 0.00 0.00 0.00 51.96 52.61 1l3n s ALA 123 Cb -0.00 -3.23 -0.09 0.00 0.00 0.00 0.00 23.12 19.79 1l3n s ALA 123 CO 0.19 -0.13 0.97 -0.51 0.00 0.00 0.00 175.76 176.28 1l3n s ASP 124 N -1.83 7.36 0.16 0.00 1.11 -1.26 -3.88 116.67 118.33 1l3n s ASP 124 Ca 0.61 1.94 0.26 0.00 0.18 0.00 0.00 52.55 55.54 1l3n s ASP 124 Cb -0.17 -2.59 0.91 0.00 1.07 0.00 0.00 42.92 42.14 1l3n s ASP 124 CO 0.22 -0.06 1.79 -0.90 1.18 0.00 0.00 175.17 177.40 1l3n n ASP 125 N 0.84 0.60 -3.32 0.27 5.68 -1.26 -4.93 116.55 114.42 1l3n n ASP 125 Ca 0.01 0.57 -0.20 0.00 -0.50 0.00 0.00 54.79 54.66 1l3n n ASP 125 Cb 0.48 -0.72 0.08 0.00 -1.14 0.00 0.00 41.12 39.82 1l3n n ASP 125 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1l3n n LEU 126 N -2.07 -3.46 0.00 -2.12 4.77 -1.26 -3.02 117.00 109.84 1l3n n LEU 126 Ca 0.05 -0.52 0.00 0.00 -0.03 0.00 0.00 56.01 55.52 1l3n n LEU 126 Cb 0.38 -2.86 0.00 0.00 -2.33 0.00 0.00 43.42 38.61 1l3n n LEU 126 CO 0.28 0.53 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 1l3n n GLY 127 N -1.68 0.27 1.83 -0.72 0.00 -1.16 -4.12 105.19 99.61 1l3n n GLY 127 Ca -0.07 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.89 2.64 0.04 1.61 5.02 -1.17 -4.51 118.16 119.91 1l3n n LYS 128 Ca 0.00 -3.51 -0.09 0.00 -2.02 0.00 0.00 58.31 52.68 1l3n n LYS 128 Cb 0.00 -2.12 -0.13 0.00 -0.02 0.00 0.00 35.03 32.76 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 1.63 0.06 -5.37 0.72 0.00 -1.85 -3.48 103.07 94.78 1l3n h GLY 129 Ca 0.41 -0.15 -0.31 0.00 0.00 0.00 0.00 47.33 47.27 1l3n h GLY 129 CO 0.89 0.13 -0.69 0.61 0.00 0.00 0.00 176.54 177.47 1l3n n GLY 130 N 1.48 -0.32 3.42 4.60 0.00 -1.26 -4.92 105.19 108.19 1l3n n GLY 130 Ca -0.09 0.07 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 1l3n n GLY 130 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1l3n s ASN 131 N -4.10 -0.06 0.14 1.61 0.01 -1.26 -5.00 114.94 106.29 1l3n s ASN 131 Ca 0.09 -0.77 -0.18 0.00 -0.71 0.00 0.00 52.86 51.29 1l3n s ASN 131 Cb -0.04 0.49 0.00 0.00 0.41 0.00 0.00 41.25 42.12 1l3n s ASN 131 CO 0.67 -0.97 1.77 -0.08 -1.51 0.00 0.00 177.10 176.98 1l3n h GLU 132 N 2.41 0.29 -0.64 -0.60 4.22 -1.95 -1.49 114.58 116.83 1l3n h GLU 132 Ca -0.30 -0.02 0.17 0.00 0.08 0.00 0.00 59.36 59.29 1l3n h GLU 132 Cb 1.24 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.40 1l3n h GLU 132 CO 0.44 0.19 0.45 1.49 -2.18 0.00 0.00 179.01 179.40 1l3n h GLU 133 N 0.30 0.09 -0.73 1.92 4.57 -1.97 -2.20 114.58 116.55 1l3n h GLU 133 Ca 0.12 -0.01 0.16 0.00 -1.18 0.00 0.00 59.36 58.46 1l3n h GLU 133 Cb 0.05 -0.02 -0.12 0.00 -0.16 0.00 0.00 28.75 28.50 1l3n h GLU 133 CO -0.09 0.06 0.03 1.03 -1.18 0.00 0.00 179.01 178.85 1l3n h SER 134 N 0.09 -0.29 -0.31 1.04 0.87 -0.37 0.24 113.55 114.83 1l3n h SER 134 Ca 0.31 0.18 0.00 0.00 -1.23 0.00 0.00 61.79 61.05 1l3n h SER 134 Cb 1.09 0.31 0.00 0.00 -0.44 0.00 0.00 62.40 63.36 1l3n h SER 134 CO -0.03 -0.15 0.00 1.07 -0.53 0.00 0.00 176.83 177.19 1l3n n THR 135 N -5.31 0.43 0.00 2.23 5.66 -0.83 -3.27 114.28 113.19 1l3n n THR 135 Ca 0.13 -0.42 0.00 0.00 -3.05 0.00 0.00 64.05 60.71 1l3n n THR 135 Cb 0.46 0.19 0.00 0.00 -1.55 0.00 0.00 70.33 69.43 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 0.40 0.00 -1.00 1.09 5.02 0.55 -3.60 118.16 120.61 1l3n n LYS 136 Ca 0.10 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.32 1l3n n LYS 136 Cb 0.27 0.00 0.28 0.00 -0.02 0.00 0.00 35.03 35.56 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 0.00 2.91 0.00 -0.18 -2.24 -0.88 -4.64 114.28 109.26 1l3n n THR 137 Ca 0.00 -1.77 0.00 0.00 -2.27 0.00 0.00 64.05 60.01 1l3n n THR 137 Cb 0.00 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 67.87 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 -0.36 1.32 1.90 3.38 0.00 0.36 -0.85 105.19 110.94 1l3n n GLY 138 Ca 0.42 0.29 -0.04 0.00 0.00 0.00 0.00 46.02 46.69 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 5.03 -1.14 0.00 1.61 3.02 -1.26 -1.70 115.26 120.82 1l3n n ASN 139 Ca 0.00 -1.96 0.07 0.00 -0.03 0.00 0.00 54.58 52.66 1l3n n ASN 139 Cb 0.00 0.47 0.30 0.00 -0.61 0.00 0.00 39.78 39.94 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 -0.83 1.64 -0.35 5.41 0.00 -0.03 -4.62 120.51 121.73 1l3n n ALA 140 Ca -0.20 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1l3n n ALA 140 Cb 0.76 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 -0.07 -1.47 3.76 0.00 0.00 -1.26 -0.08 105.19 106.06 1l3n n GLY 141 Ca 0.03 -1.25 -0.41 0.00 0.00 0.00 0.00 46.02 44.39 1l3n n GLY 141 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1l3n n SER 142 N -0.54 3.65 -4.06 1.61 3.41 -1.26 -4.47 113.62 111.95 1l3n n SER 142 Ca 0.00 1.21 -0.34 0.00 -0.26 0.00 0.00 58.87 59.48 1l3n n SER 142 Cb 0.00 -1.60 -0.08 0.00 -0.26 0.00 0.00 64.21 62.27 1l3n n SER 142 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1l3n n ARG 143 N 0.68 1.05 -0.34 4.33 1.74 -1.26 -0.48 116.66 122.37 1l3n n ARG 143 Ca 0.03 -1.88 0.22 0.00 -0.77 0.00 0.00 57.85 55.45 1l3n n ARG 143 Cb 0.38 -3.27 0.46 0.00 -1.02 0.00 0.00 32.46 29.01 1l3n n ARG 143 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1l3n h LEU 144 N 17.22 0.55 -7.42 0.55 3.38 -1.77 -3.43 115.31 124.39 1l3n h LEU 144 Ca 0.26 0.13 -0.07 0.00 0.09 0.00 0.00 57.88 58.30 1l3n h LEU 144 Cb 0.81 0.06 -0.15 0.00 0.09 0.00 0.00 40.66 41.47 1l3n h LEU 144 CO 1.59 0.02 -0.12 0.00 0.09 0.00 0.00 178.44 180.03 1l3n s ALA 145 N -5.63 -0.91 0.24 1.53 0.00 -0.68 -2.18 121.76 114.12 1l3n s ALA 145 Ca -0.10 0.09 -0.21 0.00 0.00 0.00 0.00 51.96 51.75 1l3n s ALA 145 Cb 0.28 0.49 0.03 0.00 0.00 0.00 0.00 23.12 23.92 1l3n s ALA 145 CO 0.80 -0.53 0.66 0.00 0.00 0.00 0.00 175.76 176.68 1l3n s GLY 147 N -2.89 -0.34 0.03 0.00 0.00 -0.28 -1.31 107.32 102.53 1l3n s GLY 147 Ca 0.09 0.24 0.01 0.00 0.00 0.00 0.00 44.72 45.06 1l3n s GLY 147 CO 0.02 0.07 0.06 0.14 0.00 0.00 0.00 173.10 173.39 1l3n s VAL 148 N -3.60 4.53 0.00 1.40 1.01 -1.26 -0.10 120.40 122.38 1l3n s VAL 148 Ca 0.07 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.47 1l3n s VAL 148 Cb -0.03 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.25 1l3n s VAL 148 CO -0.02 0.27 0.09 -0.38 0.00 0.00 0.00 175.10 175.06 1l3n n ILE 149 N 0.96 0.00 0.00 2.22 5.41 -1.17 -3.98 119.36 122.81 1l3n n ILE 149 Ca -0.12 0.38 0.00 0.00 1.00 0.00 0.00 62.75 64.01 1l3n n ILE 149 Cb 0.52 -0.96 0.00 0.00 -0.71 0.00 0.00 39.64 38.49 1l3n n ILE 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1l3n n GLY 150 N 1.10 0.29 3.77 7.39 0.00 -1.19 -4.02 105.19 112.53 1l3n n GLY 150 Ca 0.00 -1.35 -0.39 0.00 0.00 0.00 0.00 46.02 44.27 1l3n n GLY 150 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1l3n s ILE 151 N -0.87 3.12 0.00 -0.61 1.01 -1.26 -1.99 121.20 120.60 1l3n s ILE 151 Ca 0.00 1.03 0.00 0.00 0.00 0.00 0.00 60.65 61.68 1l3n s ILE 151 Cb 0.00 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.86 1l3n s ILE 151 CO 0.00 0.17 0.00 0.00 0.00 0.00 0.00 174.94 175.11 1l3n n ALA 152 N 0.50 2.52 -0.79 9.38 0.00 -0.21 -4.85 120.51 127.07 1l3n n ALA 152 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1l3n n ALA 152 Cb 0.45 0.46 0.00 0.00 0.00 0.00 0.00 19.45 20.35 1l3n n ALA 152 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44