#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 -4.16 0.00 5.66 -1.26 -4.90 114.28 109.61 1l3n n THR 2 Ca 0.00 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.85 1l3n n THR 2 Cb 0.00 -0.18 -0.11 0.00 -1.55 0.00 0.00 70.33 68.49 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 -1.84 0.81 0.02 1.09 2.20 -1.23 -0.37 119.74 120.42 1l3n s LYS 3 Ca 0.00 -1.07 -0.02 0.00 -0.36 0.00 0.00 55.97 54.52 1l3n s LYS 3 Cb 0.00 -0.57 -0.02 0.00 -1.51 0.00 0.00 37.83 35.74 1l3n s LYS 3 CO 0.00 0.10 0.01 0.00 -0.36 0.00 0.00 175.35 175.10 1l3n s ALA 4 N -2.08 0.05 0.26 3.13 0.00 -0.00 -1.49 121.76 121.63 1l3n s ALA 4 Ca 0.02 -0.55 0.06 0.00 0.00 0.00 0.00 51.96 51.49 1l3n s ALA 4 Cb -0.05 0.16 -0.03 0.00 0.00 0.00 0.00 23.12 23.20 1l3n s ALA 4 CO 0.01 -0.20 0.34 0.54 0.00 0.00 0.00 175.76 176.45 1l3n s VAL 5 N -1.74 4.83 -0.30 0.00 0.11 -0.11 -0.51 120.40 122.69 1l3n s VAL 5 Ca -0.13 -1.09 0.00 0.00 -2.93 0.00 0.00 61.98 57.83 1l3n s VAL 5 Cb -0.07 -3.67 0.14 0.00 -1.53 0.00 0.00 36.38 31.25 1l3n s VAL 5 CO -0.01 -0.30 0.31 0.00 -3.33 0.00 0.00 175.10 171.76 1l3n s ALA 6 N -2.06 -0.48 -0.66 1.54 0.00 0.53 -1.35 121.76 119.28 1l3n s ALA 6 Ca 0.36 -0.38 -0.19 0.00 0.00 0.00 0.00 51.96 51.75 1l3n s ALA 6 Cb -0.09 -1.84 0.11 0.00 0.00 0.00 0.00 23.12 21.31 1l3n s ALA 6 CO 0.28 -1.76 0.81 0.14 0.00 0.00 0.00 175.76 175.23 1l3n s VAL 7 N 2.27 4.78 0.15 0.00 -7.23 -1.26 -1.07 120.40 118.03 1l3n s VAL 7 Ca 0.10 -1.07 -0.30 0.00 -1.81 0.00 0.00 61.98 58.91 1l3n s VAL 7 Cb -0.14 -4.56 -0.07 0.00 0.56 0.00 0.00 36.38 32.17 1l3n s VAL 7 CO -0.30 -1.23 0.97 -0.76 -0.31 0.00 0.00 175.10 173.47 1l3n s LEU 8 N 2.75 4.54 0.05 1.32 1.02 0.11 -4.32 118.68 124.15 1l3n s LEU 8 Ca 0.16 1.86 -0.07 0.00 0.02 0.00 0.00 54.13 56.11 1l3n s LEU 8 Cb -0.19 -3.60 -0.01 0.00 0.02 0.00 0.00 46.19 42.41 1l3n s LEU 8 CO 0.04 -0.02 0.13 -0.54 0.02 0.00 0.00 176.35 175.98 1l3n s LYS 9 N -0.37 0.66 0.04 1.70 1.02 0.03 -0.57 119.74 122.25 1l3n s LYS 9 Ca 0.45 -0.80 0.00 0.00 0.02 0.00 0.00 55.97 55.65 1l3n s LYS 9 Cb -0.25 0.26 0.00 0.00 -0.52 0.00 0.00 37.83 37.33 1l3n s LYS 9 CO 0.31 -0.18 0.00 0.41 -0.92 0.00 0.00 175.35 174.97 1l3n n GLY 10 N 0.55 -1.85 0.19 -3.33 0.00 -1.25 -0.93 105.19 98.58 1l3n n GLY 10 Ca -0.18 0.46 -0.18 0.00 0.00 0.00 0.00 46.02 46.13 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 0.80 0.00 1.61 3.32 -1.80 -3.49 116.42 116.86 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 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.31 1l3n h ASP 11 CO 0.00 1.35 0.00 0.61 -1.72 0.00 0.00 179.24 179.48 1l3n n GLY 12 N 0.83 2.22 0.31 2.75 0.00 -1.26 -4.91 105.19 105.13 1l3n n GLY 12 Ca -0.09 -0.38 0.03 0.00 0.00 0.00 0.00 46.02 45.59 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 0.80 -5.25 1.61 0.13 -1.93 -3.34 132.00 124.02 1l3n h PRO 13 Ca 0.00 -0.05 -0.02 0.00 -0.87 0.00 0.00 66.00 65.06 1l3n h PRO 13 Cb 0.00 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 30.94 1l3n h PRO 13 CO 0.00 0.53 0.13 0.28 -0.23 0.00 0.00 178.00 178.71 1l3n n VAL 14 N -4.72 0.00 -3.87 1.56 0.31 -1.01 -3.90 118.33 106.70 1l3n n VAL 14 Ca 0.14 -0.37 -0.36 0.00 -0.01 0.00 0.00 64.34 63.75 1l3n n VAL 14 Cb 0.28 -1.85 -0.14 0.00 -0.91 0.00 0.00 33.84 31.23 1l3n n VAL 14 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1l3n s GLN 15 N 8.66 3.14 -0.03 5.55 -2.07 -1.26 -3.77 119.66 129.88 1l3n s GLN 15 Ca 0.90 -0.79 0.00 0.00 -1.82 0.00 0.00 55.36 53.65 1l3n s GLN 15 Cb -0.15 -3.13 -0.03 0.00 -1.09 0.00 0.00 33.01 28.61 1l3n s GLN 15 CO 0.13 -0.33 -0.01 0.20 -1.32 0.00 0.00 175.29 173.96 1l3n s GLY 16 N 1.45 1.85 -0.39 2.60 0.00 0.27 -1.32 107.32 111.78 1l3n s GLY 16 Ca 0.03 -0.90 0.11 0.00 0.00 0.00 0.00 44.72 43.96 1l3n s GLY 16 CO -0.01 -0.73 0.73 1.39 0.00 0.00 0.00 173.10 174.47 1l3n n ILE 17 N 1.69 -0.00 -2.62 0.90 5.41 -0.06 0.10 119.36 124.77 1l3n n ILE 17 Ca -0.16 -4.61 -0.41 0.00 1.00 0.00 0.00 62.75 58.57 1l3n n ILE 17 Cb 0.53 -0.47 -0.04 0.00 -0.71 0.00 0.00 39.64 38.96 1l3n n ILE 17 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1l3n s ILE 18 N -2.46 4.31 -0.29 1.39 -1.09 -0.24 -3.83 121.20 118.99 1l3n s ILE 18 Ca 0.40 1.85 0.03 0.00 -2.23 0.00 0.00 60.65 60.70 1l3n s ILE 18 Cb 0.33 -4.18 0.08 0.00 -1.58 0.00 0.00 42.46 37.11 1l3n s ILE 18 CO -0.09 0.25 -0.01 0.20 -1.23 0.00 0.00 174.94 174.06 1l3n s ASN 19 N 0.28 4.40 0.02 3.58 0.01 0.64 -0.35 114.94 123.53 1l3n s ASN 19 Ca 0.50 -1.67 -0.20 0.00 -0.71 0.00 0.00 52.86 50.78 1l3n s ASN 19 Cb -0.26 -1.43 -0.06 0.00 0.41 0.00 0.00 41.25 39.92 1l3n s ASN 19 CO 0.31 -0.30 0.58 -0.36 -1.51 0.00 0.00 177.10 175.82 1l3n s PHE 20 N 1.14 3.72 0.09 2.20 0.40 0.34 -2.48 117.98 123.39 1l3n s PHE 20 Ca 0.01 1.21 0.09 0.00 -0.60 0.00 0.00 56.93 57.65 1l3n s PHE 20 Cb -0.19 -2.57 -0.04 0.00 0.51 0.00 0.00 43.02 40.73 1l3n s PHE 20 CO -0.08 0.42 -0.21 -2.00 0.70 0.00 0.00 175.22 174.05 1l3n s GLU 21 N -0.46 1.76 -0.27 0.44 2.12 -1.20 -0.82 118.70 120.27 1l3n s GLU 21 Ca 0.30 -1.17 0.02 0.00 0.36 0.00 0.00 54.97 54.49 1l3n s GLU 21 Cb -0.18 -2.07 0.07 0.00 0.26 0.00 0.00 34.13 32.21 1l3n s GLU 21 CO 0.18 0.49 -0.04 -1.14 -0.54 0.00 0.00 175.26 174.20 1l3n s GLN 22 N -1.87 1.79 0.01 4.30 0.74 0.50 -4.10 119.66 121.04 1l3n s GLN 22 Ca 0.16 -1.34 -0.27 0.00 0.05 0.00 0.00 55.36 53.96 1l3n s GLN 22 Cb -0.10 -2.82 -0.15 0.00 1.10 0.00 0.00 33.01 31.04 1l3n s GLN 22 CO 0.07 -0.69 1.13 0.87 -0.55 0.00 0.00 175.29 176.13 1l3n h LYS 23 N 7.81 -0.86 -5.26 1.67 1.79 -1.85 -3.44 116.57 116.44 1l3n h LYS 23 Ca -0.15 0.06 -0.46 0.00 -2.18 0.00 0.00 60.65 57.92 1l3n h LYS 23 Cb 1.04 0.19 -0.14 0.00 -1.58 0.00 0.00 32.23 31.75 1l3n h LYS 23 CO 0.46 -0.55 -0.63 -1.21 -1.08 0.00 0.00 179.45 176.44 1l3n s GLU 24 N -4.71 1.57 0.49 3.15 8.01 -1.26 -4.98 118.70 120.96 1l3n s GLU 24 Ca -0.14 -1.84 0.24 0.00 0.01 0.00 0.00 54.97 53.24 1l3n s GLU 24 Cb 0.02 -0.87 1.25 0.00 -4.31 0.00 0.00 34.13 30.21 1l3n s GLU 24 CO 0.44 -0.12 2.00 0.66 0.01 0.00 0.00 175.26 178.25 1l3n h SER 25 N 2.22 0.00 0.03 -0.19 4.64 -1.89 -2.48 113.55 115.89 1l3n h SER 25 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1l3n h SER 25 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1l3n h SER 25 CO 0.68 0.17 -0.59 0.59 -0.87 0.00 0.00 176.83 176.81 1l3n n ASN 26 N -3.72 1.62 -4.81 4.97 3.02 -1.26 -4.91 115.26 110.17 1l3n n ASN 26 Ca -0.02 -1.28 -0.36 0.00 -0.03 0.00 0.00 54.58 52.89 1l3n n ASN 26 Cb 0.29 0.57 -0.06 0.00 -0.61 0.00 0.00 39.78 39.97 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 -2.63 2.64 0.34 7.41 0.00 -0.94 -5.04 107.32 109.11 1l3n s GLY 27 Ca 0.16 0.23 -0.29 0.00 0.00 0.00 0.00 44.72 44.83 1l3n s GLY 27 CO 0.65 0.60 1.40 2.56 0.00 0.00 0.00 173.10 178.31 1l3n s PRO 28 N -2.00 4.24 0.05 2.90 0.04 -1.26 -4.73 135.00 134.24 1l3n s PRO 28 Ca 0.44 2.38 -0.13 0.00 0.04 0.00 0.00 61.00 63.73 1l3n s PRO 28 Cb -0.17 -3.03 -0.06 0.00 0.04 0.00 0.00 34.50 31.28 1l3n s PRO 28 CO 0.21 -0.36 0.43 0.14 0.04 0.00 0.00 177.00 177.46 1l3n s VAL 29 N -1.00 5.02 -0.21 -0.36 -7.23 -0.08 -4.75 120.40 111.79 1l3n s VAL 29 Ca 0.52 0.71 -0.06 0.00 -1.81 0.00 0.00 61.98 61.34 1l3n s VAL 29 Cb -0.43 -3.69 -0.02 0.00 0.56 0.00 0.00 36.38 32.79 1l3n s VAL 29 CO 0.56 0.43 0.02 -0.75 -0.31 0.00 0.00 175.10 175.05 1l3n s LYS 30 N -1.50 3.62 -0.41 4.82 2.20 -1.26 -1.26 119.74 125.95 1l3n s LYS 30 Ca 0.29 -0.51 -0.07 0.00 -0.36 0.00 0.00 55.97 55.32 1l3n s LYS 30 Cb -0.16 -3.14 0.09 0.00 -1.51 0.00 0.00 37.83 33.11 1l3n s LYS 30 CO 0.16 -0.05 0.24 0.14 -0.36 0.00 0.00 175.35 175.48 1l3n s VAL 31 N 1.18 3.89 0.44 4.02 -7.23 0.67 -3.24 120.40 120.12 1l3n s VAL 31 Ca 0.03 -1.61 0.06 0.00 -1.81 0.00 0.00 61.98 58.65 1l3n s VAL 31 Cb -0.14 -3.46 -0.04 0.00 0.56 0.00 0.00 36.38 33.30 1l3n s VAL 31 CO 0.02 -0.55 0.18 -1.66 -0.31 0.00 0.00 175.10 172.77 1l3n s TRP 32 N 1.33 2.42 -5.00 2.82 -2.14 -1.03 -2.71 118.94 114.62 1l3n s TRP 32 Ca 0.04 -0.66 0.00 0.00 2.66 0.00 0.00 56.10 58.14 1l3n s TRP 32 Cb -0.23 -1.91 0.00 0.00 -3.10 0.00 0.00 33.47 28.23 1l3n s TRP 32 CO -0.00 0.13 0.00 0.41 -2.66 0.00 0.00 176.95 174.83 1l3n n GLY 33 N -1.28 0.07 3.34 3.67 0.00 0.40 -0.26 105.19 111.13 1l3n n GLY 33 Ca -0.03 -1.26 -0.15 0.00 0.00 0.00 0.00 46.02 44.58 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 -4.00 -0.37 -0.30 1.61 0.01 -1.25 -0.63 113.70 108.78 1l3n s SER 34 Ca 0.00 0.31 -0.05 0.00 1.31 0.00 0.00 55.95 57.52 1l3n s SER 34 Cb 0.00 0.40 0.03 0.00 0.21 0.00 0.00 66.02 66.66 1l3n s SER 34 CO 0.00 -0.52 0.04 0.27 0.41 0.00 0.00 173.24 173.45 1l3n s ILE 35 N -1.34 3.52 -0.50 1.44 -0.00 0.34 -0.88 121.20 123.79 1l3n s ILE 35 Ca -0.12 -1.01 0.04 0.00 -0.00 0.00 0.00 60.65 59.56 1l3n s ILE 35 Cb -0.03 -2.90 0.13 0.00 -0.00 0.00 0.00 42.46 39.66 1l3n s ILE 35 CO 0.06 -0.00 0.25 -1.59 -0.00 0.00 0.00 174.94 173.66 1l3n s LYS 36 N 1.39 1.84 0.00 0.37 -2.85 -0.43 -0.42 119.74 119.64 1l3n s LYS 36 Ca -0.01 -2.49 0.00 0.00 -1.00 0.00 0.00 55.97 52.47 1l3n s LYS 36 Cb -0.18 -3.14 0.00 0.00 -2.06 0.00 0.00 37.83 32.45 1l3n s LYS 36 CO 0.01 -1.11 0.00 0.41 0.10 0.00 0.00 175.35 174.75 1l3n n GLY 37 N 3.22 0.00 3.59 0.59 0.00 0.36 -4.01 105.19 108.94 1l3n n GLY 37 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 1l3n n GLY 37 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1l3n s LEU 38 N 0.00 2.25 0.87 0.99 -0.00 -1.11 -2.40 118.68 119.28 1l3n s LEU 38 Ca 0.00 -1.57 -0.12 0.00 -0.00 0.00 0.00 54.13 52.44 1l3n s LEU 38 Cb 0.00 -0.47 0.11 0.00 -0.00 0.00 0.00 46.19 45.83 1l3n s LEU 38 CO 0.00 -0.78 1.13 0.28 -0.00 0.00 0.00 176.35 176.98 1l3n s THR 39 N -3.05 2.31 1.28 5.48 -1.32 -1.26 -4.01 115.64 115.07 1l3n s THR 39 Ca 0.22 0.10 -0.17 0.00 -1.21 0.00 0.00 61.69 60.63 1l3n s THR 39 Cb 0.05 -2.88 0.33 0.00 -1.51 0.00 0.00 72.50 68.48 1l3n s THR 39 CO 0.12 -0.13 0.98 -0.70 -2.21 0.00 0.00 174.62 172.68 1l3n s GLU 40 N -5.28 -1.86 0.00 7.08 2.12 -1.26 -4.71 118.70 114.79 1l3n s GLU 40 Ca 0.63 0.55 0.00 0.00 0.36 0.00 0.00 54.97 56.50 1l3n s GLU 40 Cb -0.14 -1.47 0.00 0.00 0.26 0.00 0.00 34.13 32.78 1l3n s GLU 40 CO 0.53 -4.27 0.00 0.41 -0.54 0.00 0.00 175.26 171.39 1l3n n GLY 41 N 1.11 -0.76 3.77 -1.50 0.00 -0.05 -4.74 105.19 103.02 1l3n n GLY 41 Ca 0.06 -1.72 -0.39 0.00 0.00 0.00 0.00 46.02 43.98 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 -1.44 4.15 0.01 0.99 1.02 -1.26 -0.46 118.68 121.69 1l3n s LEU 42 Ca 0.00 2.60 -0.01 0.00 0.02 0.00 0.00 54.13 56.75 1l3n s LEU 42 Cb 0.00 -3.99 -0.01 0.00 0.02 0.00 0.00 46.19 42.21 1l3n s LEU 42 CO 0.00 -0.92 -0.01 -1.00 0.02 0.00 0.00 176.35 174.45 1l3n s HIS 43 N -1.31 0.15 -0.17 0.29 3.76 0.42 -2.99 115.29 115.45 1l3n s HIS 43 Ca 0.59 -0.31 -0.21 0.00 -0.15 0.00 0.00 55.06 54.98 1l3n s HIS 43 Cb -0.37 -0.11 -0.09 0.00 1.11 0.00 0.00 32.58 33.12 1l3n s HIS 43 CO 0.46 -0.13 0.67 0.41 -0.85 0.00 0.00 174.74 175.31 1l3n n GLY 44 N 2.11 0.03 2.88 -2.22 0.00 0.47 -1.27 105.19 107.19 1l3n n GLY 44 Ca -0.20 0.44 -0.11 0.00 0.00 0.00 0.00 46.02 46.15 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 1.01 -0.80 0.32 1.61 5.36 -1.25 -1.43 117.98 122.80 1l3n s PHE 45 Ca 0.47 0.53 -0.10 0.00 -0.96 0.00 0.00 56.93 56.87 1l3n s PHE 45 Cb -0.66 -0.11 0.01 0.00 -0.34 0.00 0.00 43.02 41.91 1l3n s PHE 45 CO 0.35 -0.81 0.55 -1.01 -1.46 0.00 0.00 175.22 172.84 1l3n s HIS 46 N 2.51 0.56 0.29 10.12 3.76 -1.13 -1.25 115.29 130.14 1l3n s HIS 46 Ca 0.11 -0.94 -0.06 0.00 -0.15 0.00 0.00 55.06 54.01 1l3n s HIS 46 Cb -0.14 0.24 -0.06 0.00 1.11 0.00 0.00 32.58 33.73 1l3n s HIS 46 CO -0.22 -1.18 0.57 0.14 -0.85 0.00 0.00 174.74 173.20 1l3n s VAL 47 N -3.27 4.99 -0.11 -0.90 -7.23 -1.20 -1.55 120.40 111.13 1l3n s VAL 47 Ca 0.24 0.18 0.01 0.00 -1.81 0.00 0.00 61.98 60.60 1l3n s VAL 47 Cb -0.02 -3.71 0.02 0.00 0.56 0.00 0.00 36.38 33.23 1l3n s VAL 47 CO 0.14 -0.30 -0.12 -1.00 -0.31 0.00 0.00 175.10 173.51 1l3n s HIS 48 N -2.07 1.74 0.36 2.82 3.76 0.82 -4.52 115.29 118.20 1l3n s HIS 48 Ca 0.45 -0.84 0.04 0.00 -0.15 0.00 0.00 55.06 54.56 1l3n s HIS 48 Cb -0.11 -1.32 0.69 0.00 1.11 0.00 0.00 32.58 32.95 1l3n s HIS 48 CO 0.29 -0.49 1.98 1.49 -0.85 0.00 0.00 174.74 177.15 1l3n h GLU 49 N 7.73 0.64 -6.16 1.40 4.57 -1.73 -3.08 114.58 117.96 1l3n h GLU 49 Ca -0.32 -0.07 -0.57 0.00 -1.18 0.00 0.00 59.36 57.22 1l3n h GLU 49 Cb 1.15 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 29.57 1l3n h GLU 49 CO 0.46 0.49 0.90 -0.06 -1.18 0.00 0.00 179.01 179.63 1l3n s PHE 50 N -5.40 2.89 0.00 0.92 0.08 0.19 -4.75 117.98 111.91 1l3n s PHE 50 Ca -0.09 1.05 0.00 0.00 0.12 0.00 0.00 56.93 58.01 1l3n s PHE 50 Cb 0.17 -3.51 0.00 0.00 -0.57 0.00 0.00 43.02 39.11 1l3n s PHE 50 CO 0.75 -1.55 1.20 0.41 -0.10 0.00 0.00 175.22 175.93 1l3n n GLY 51 N 3.64 1.76 3.88 4.36 0.00 -1.24 -4.08 105.19 113.51 1l3n n GLY 51 Ca 0.14 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 1l3n n GLY 51 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1l3n s ASP 52 N 1.71 4.94 0.00 1.61 1.47 -1.26 -4.73 116.67 120.41 1l3n s ASP 52 Ca 0.00 -0.85 0.00 0.00 1.18 0.00 0.00 52.55 52.88 1l3n s ASP 52 Cb 0.00 -0.39 0.00 0.00 -0.34 0.00 0.00 42.92 42.19 1l3n s ASP 52 CO 0.00 -0.74 0.74 -3.20 0.68 0.00 0.00 175.17 172.65 1l3n n ASN 53 N -1.58 -0.53 -0.24 2.11 2.85 -1.26 -4.20 115.26 112.39 1l3n n ASN 53 Ca 0.03 -1.48 0.10 0.00 -0.11 0.00 0.00 54.58 53.12 1l3n n ASN 53 Cb 0.62 0.16 0.36 0.00 1.24 0.00 0.00 39.78 42.16 1l3n n ASN 53 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 1l3n h THR 54 N 4.72 0.91 0.00 -0.44 2.02 -1.97 0.24 112.91 118.40 1l3n h THR 54 Ca -0.30 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 66.62 1l3n h THR 54 Cb 1.18 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 1l3n h THR 54 CO -0.15 0.13 0.00 0.00 0.37 0.00 0.00 175.52 175.87 1l3n h ALA 55 N 1.59 1.00 -1.94 6.16 0.00 -1.98 -3.49 119.26 120.60 1l3n h ALA 55 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1l3n h ALA 55 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1l3n h ALA 55 CO -0.17 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.49 1l3n n GLY 56 N 0.83 -1.84 4.07 0.00 0.00 0.85 -4.81 105.19 104.29 1l3n n GLY 56 Ca 0.03 -0.52 -0.36 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 -4.68 0.00 0.26 0.00 -1.04 -1.26 -4.83 114.28 102.73 1l3n n THR 58 Ca -0.21 0.00 0.09 0.00 -2.04 0.00 0.00 64.05 61.89 1l3n n THR 58 Cb 0.63 -0.10 0.67 0.00 -1.82 0.00 0.00 70.33 69.71 1l3n n THR 58 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 1l3n h SER 59 N 0.00 0.00 -1.76 8.00 0.87 -1.90 -3.03 113.55 115.73 1l3n h SER 59 Ca 0.00 0.00 0.51 0.00 -1.23 0.00 0.00 61.79 61.07 1l3n h SER 59 Cb 0.00 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 61.89 1l3n h SER 59 CO 0.00 0.04 1.37 0.00 -0.53 0.00 0.00 176.83 177.70 1l3n h ALA 60 N 1.96 3.67 0.00 6.23 0.00 -1.78 -3.45 119.26 125.89 1l3n h ALA 60 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1l3n h ALA 60 Cb 0.07 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1l3n h ALA 60 CO 0.00 -2.27 0.00 0.41 0.00 0.00 0.00 179.25 177.40 1l3n n GLY 61 N -1.88 2.04 2.46 0.00 0.00 -1.15 -0.63 105.19 106.04 1l3n n GLY 61 Ca 0.39 -1.46 -0.37 0.00 0.00 0.00 0.00 46.02 44.58 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 2.37 3.25 -2.21 1.61 -0.04 -1.26 -4.32 135.00 134.41 1l3n n PRO 62 Ca 0.00 -2.16 -0.19 0.00 -0.04 0.00 0.00 63.50 61.11 1l3n n PRO 62 Cb 0.00 -2.85 -0.02 0.00 -0.04 0.00 0.00 33.50 30.59 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 4.28 -0.73 -0.33 0.54 8.25 -1.26 -4.66 115.22 121.31 1l3n n HIS 63 Ca 0.68 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 58.24 1l3n n HIS 63 Cb 0.25 -3.64 0.30 0.00 1.12 0.00 0.00 29.99 28.03 1l3n n HIS 63 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1l3n h PHE 64 N 0.00 1.02 -0.55 4.41 -5.15 -1.92 -3.46 116.94 111.29 1l3n h PHE 64 Ca -0.44 0.03 0.00 0.00 -0.20 0.00 0.00 57.97 57.36 1l3n h PHE 64 Cb 1.32 -0.32 0.00 0.00 0.22 0.00 0.00 35.95 37.17 1l3n h PHE 64 CO 0.52 0.36 0.00 0.27 -2.00 0.00 0.00 178.31 177.46 1l3n n ASN 65 N -4.63 0.00 0.13 -0.68 6.94 -1.26 -3.60 115.26 112.16 1l3n n ASN 65 Ca 0.19 0.00 -0.05 0.00 -0.02 0.00 0.00 54.58 54.70 1l3n n ASN 65 Cb 0.44 -0.91 -0.02 0.00 -2.36 0.00 0.00 39.78 36.92 1l3n n ASN 65 CO 0.00 0.00 0.00 1.55 -1.03 0.00 0.00 177.26 177.78 1l3n h PRO 66 N -0.55 -0.33 -4.88 -0.53 0.13 -1.93 -3.22 132.00 120.69 1l3n h PRO 66 Ca 0.00 0.02 -0.62 0.00 -0.87 0.00 0.00 66.00 64.53 1l3n h PRO 66 Cb 0.71 0.07 -0.03 0.00 0.13 0.00 0.00 31.00 31.89 1l3n h PRO 66 CO 0.00 -0.22 2.33 1.47 -0.23 0.00 0.00 178.00 181.35 1l3n n LEU 67 N -3.35 5.03 -4.51 1.56 -0.00 -1.26 -4.93 117.00 109.53 1l3n n LEU 67 Ca -0.04 -3.62 -0.55 0.00 -0.00 0.00 0.00 56.01 51.80 1l3n n LEU 67 Cb 0.13 -1.57 -0.08 0.00 -0.00 0.00 0.00 43.42 41.90 1l3n n LEU 67 CO 0.10 -0.01 1.61 -1.54 -0.00 0.00 0.00 177.39 177.55 1l3n n SER 68 N 8.52 1.98 -0.95 1.45 3.41 -1.22 -4.83 113.62 121.99 1l3n n SER 68 Ca 0.49 0.71 0.00 0.00 -0.26 0.00 0.00 58.87 59.81 1l3n n SER 68 Cb 0.43 -1.15 0.00 0.00 -0.26 0.00 0.00 64.21 63.22 1l3n n SER 68 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1l3n n ARG 69 N 7.03 0.89 -2.95 4.33 1.74 -1.26 -5.10 116.66 121.33 1l3n n ARG 69 Ca 0.38 0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 57.06 1l3n n ARG 69 Cb 0.14 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.53 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 -1.12 4.56 -0.31 5.56 1.02 -1.24 -4.79 119.74 123.42 1l3n s LYS 70 Ca 0.00 1.16 -0.41 0.00 0.02 0.00 0.00 55.97 56.74 1l3n s LYS 70 Cb 0.00 -3.31 -0.16 0.00 -0.52 0.00 0.00 37.83 33.84 1l3n s LYS 70 CO 0.00 0.43 1.75 1.58 -0.92 0.00 0.00 175.35 178.19 1l3n n HIS 71 N 2.13 2.01 -0.70 3.18 -0.00 -0.51 -3.57 115.22 117.76 1l3n n HIS 71 Ca -0.04 0.59 0.00 0.00 -0.00 0.00 0.00 57.72 58.28 1l3n n HIS 71 Cb 0.49 -2.44 0.00 0.00 -0.00 0.00 0.00 29.99 28.04 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 4.29 5.35 0.00 1.57 0.00 -1.26 -2.72 105.19 112.42 1l3n n GLY 72 Ca 0.28 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.40 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 1.98 0.23 -0.02 0.00 -1.26 -4.73 105.19 101.39 1l3n n GLY 73 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 0.46 -0.00 1.61 -0.04 -1.25 -0.63 135.00 135.15 1l3n n PRO 74 Ca 0.00 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.51 1l3n n PRO 74 Cb 0.00 -1.11 -0.06 0.00 -0.04 0.00 0.00 33.50 32.29 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 -0.14 3.28 -4.25 0.54 5.02 -1.26 -5.02 118.16 116.33 1l3n n LYS 75 Ca 0.00 -0.01 -0.24 0.00 -2.02 0.00 0.00 58.31 56.04 1l3n n LYS 75 Cb 0.05 -1.02 -0.07 0.00 -0.02 0.00 0.00 35.03 33.98 1l3n n LYS 75 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1l3n s ASP 76 N -2.09 4.74 0.07 4.39 -1.08 0.20 -5.03 116.67 117.87 1l3n s ASP 76 Ca 0.03 -0.52 -0.09 0.00 -0.52 0.00 0.00 52.55 51.46 1l3n s ASP 76 Cb 0.08 -0.97 -0.29 0.00 -1.46 0.00 0.00 42.92 40.28 1l3n s ASP 76 CO 0.43 0.02 1.11 -0.08 0.52 0.00 0.00 175.17 177.18 1l3n h GLU 77 N 2.05 0.39 0.00 4.34 4.81 -1.96 -3.41 114.58 120.80 1l3n h GLU 77 Ca -0.46 -0.63 -0.39 0.00 -0.13 0.00 0.00 59.36 57.75 1l3n h GLU 77 Cb 1.24 0.23 -0.06 0.00 0.63 0.00 0.00 28.75 30.78 1l3n h GLU 77 CO 0.60 1.29 -2.16 -0.85 -0.73 0.00 0.00 179.01 177.16 1l3n n GLU 78 N -3.63 0.59 0.00 1.92 0.28 -1.26 -4.97 120.64 113.57 1l3n n GLU 78 Ca -0.11 0.36 0.00 0.00 -0.16 0.00 0.00 57.16 57.24 1l3n n GLU 78 Cb 1.03 -1.57 0.00 0.00 1.43 0.00 0.00 31.44 32.32 1l3n n GLU 78 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86 1l3n n ARG 79 N -4.28 0.00 -1.98 3.44 1.85 -1.23 -1.70 116.66 112.76 1l3n n ARG 79 Ca -0.48 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.07 1l3n n ARG 79 Cb 0.83 0.00 0.03 0.00 -1.05 0.00 0.00 32.46 32.27 1l3n n ARG 79 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1l3n n HIS 80 N 12.04 3.08 -4.01 2.89 8.25 -1.26 -3.67 115.22 132.54 1l3n n HIS 80 Ca 0.00 -2.66 -0.34 0.00 -0.26 0.00 0.00 57.72 54.45 1l3n n HIS 80 Cb 0.00 -0.66 -0.06 0.00 1.12 0.00 0.00 29.99 30.39 1l3n n HIS 80 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1l3n n VAL 81 N -0.66 0.00 0.00 1.59 0.31 -0.69 -4.67 118.33 114.22 1l3n n VAL 81 Ca 0.48 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.81 1l3n n VAL 81 Cb 0.69 -0.40 0.00 0.00 -0.91 0.00 0.00 33.84 33.22 1l3n n VAL 81 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1l3n n GLY 82 N -0.94 -1.75 2.69 2.92 0.00 -1.26 -4.85 105.19 101.99 1l3n n GLY 82 Ca 0.10 0.71 -0.26 0.00 0.00 0.00 0.00 46.02 46.56 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 0.00 2.52 0.45 1.61 1.01 -1.26 -3.22 116.67 117.79 1l3n s ASP 83 Ca 0.00 -0.65 0.25 0.00 0.71 0.00 0.00 52.55 52.86 1l3n s ASP 83 Cb 0.00 -0.43 0.91 0.00 1.01 0.00 0.00 42.92 44.41 1l3n s ASP 83 CO 0.00 -0.31 1.82 -0.07 0.21 0.00 0.00 175.17 176.82 1l3n h LEU 84 N 8.33 0.00 0.00 1.23 3.38 -1.52 -3.34 115.31 123.39 1l3n h LEU 84 Ca -0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.81 1l3n h LEU 84 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1l3n h LEU 84 CO 0.31 0.19 0.00 0.61 0.09 0.00 0.00 178.44 179.64 1l3n n GLY 85 N 0.24 1.36 3.09 0.83 0.00 -1.06 -4.45 105.19 105.20 1l3n n GLY 85 Ca 0.00 -0.74 -0.12 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.12 -0.19 1.61 0.01 -1.26 -3.77 114.94 107.21 1l3n s ASN 86 Ca 0.00 0.63 -0.04 0.00 -0.71 0.00 0.00 52.86 52.74 1l3n s ASN 86 Cb 0.00 0.61 -0.02 0.00 0.41 0.00 0.00 41.25 42.25 1l3n s ASN 86 CO 0.00 -0.20 -0.03 0.68 -1.51 0.00 0.00 177.10 176.05 1l3n s VAL 87 N 1.71 3.74 -0.44 1.60 -7.23 -0.39 -4.81 120.40 114.58 1l3n s VAL 87 Ca -0.06 -0.39 -0.29 0.00 -1.81 0.00 0.00 61.98 59.43 1l3n s VAL 87 Cb -0.11 -2.68 0.03 0.00 0.56 0.00 0.00 36.38 34.18 1l3n s VAL 87 CO -0.09 0.44 1.15 -0.89 -0.31 0.00 0.00 175.10 175.40 1l3n s THR 88 N 0.96 4.24 -0.07 5.32 2.01 -1.26 -0.43 115.64 126.40 1l3n s THR 88 Ca 0.01 1.30 -0.23 0.00 0.31 0.00 0.00 61.69 63.07 1l3n s THR 88 Cb -0.14 -4.53 -0.04 0.00 0.01 0.00 0.00 72.50 67.80 1l3n s THR 88 CO 0.01 -0.88 0.70 0.00 -0.69 0.00 0.00 174.62 173.76 1l3n s ALA 89 N 4.38 3.34 1.09 7.40 0.00 0.39 -4.02 121.76 134.35 1l3n s ALA 89 Ca 0.49 0.13 -0.12 0.00 0.00 0.00 0.00 51.96 52.45 1l3n s ALA 89 Cb -0.09 -2.96 0.24 0.00 0.00 0.00 0.00 23.12 20.31 1l3n s ALA 89 CO 0.29 -0.12 1.06 0.34 0.00 0.00 0.00 175.76 177.33 1l3n s ASP 90 N 0.81 1.56 0.58 0.00 2.15 0.17 -0.87 116.67 121.07 1l3n s ASP 90 Ca 0.37 1.69 0.28 0.00 0.43 0.00 0.00 52.55 55.33 1l3n s ASP 90 Cb -0.18 -2.37 1.63 0.00 -0.30 0.00 0.00 42.92 41.70 1l3n s ASP 90 CO 0.18 -3.87 2.09 0.07 -0.17 0.00 0.00 175.17 173.47 1l3n h LYS 91 N -2.40 0.00 0.00 4.34 -0.00 -1.96 0.13 116.57 116.69 1l3n h LYS 91 Ca -0.56 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.09 1l3n h LYS 91 Cb 1.31 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.54 1l3n h LYS 91 CO 0.48 0.00 0.00 -3.47 -0.00 0.00 0.00 179.45 176.46 1l3n n ASP 92 N -3.86 0.10 0.00 7.07 2.03 -1.26 -4.76 116.55 115.87 1l3n n ASP 92 Ca 0.02 0.52 0.00 0.00 0.52 0.00 0.00 54.79 55.85 1l3n n ASP 92 Cb 0.34 -0.54 0.00 0.00 -0.72 0.00 0.00 41.12 40.20 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 0.85 0.71 3.27 0.27 0.00 0.45 -4.77 105.19 105.98 1l3n n GLY 93 Ca 0.05 -0.67 -0.40 0.00 0.00 0.00 0.00 46.02 45.00 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 -2.00 4.18 -0.25 1.61 1.01 -1.25 -0.49 120.40 123.21 1l3n s VAL 94 Ca 0.00 -1.35 -0.09 0.00 0.00 0.00 0.00 61.98 60.53 1l3n s VAL 94 Cb 0.00 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 1l3n s VAL 94 CO 0.00 -0.46 0.13 0.00 0.00 0.00 0.00 175.10 174.76 1l3n s ALA 95 N 1.42 3.38 -0.09 5.51 0.00 0.44 -0.66 121.76 131.77 1l3n s ALA 95 Ca 0.03 -1.05 -0.17 0.00 0.00 0.00 0.00 51.96 50.76 1l3n s ALA 95 Cb -0.22 -2.25 -0.05 0.00 0.00 0.00 0.00 23.12 20.60 1l3n s ALA 95 CO 0.02 -0.42 0.45 0.16 0.00 0.00 0.00 175.76 175.98 1l3n s ASP 96 N 1.50 6.71 -0.11 0.00 -4.77 -1.26 -0.50 116.67 118.25 1l3n s ASP 96 Ca 0.06 0.85 0.00 0.00 -3.30 0.00 0.00 52.55 50.16 1l3n s ASP 96 Cb -0.15 -2.28 -0.02 0.00 -1.09 0.00 0.00 42.92 39.38 1l3n s ASP 96 CO 0.06 0.09 -0.12 -0.69 0.70 0.00 0.00 175.17 175.22 1l3n s VAL 97 N 0.16 3.23 -0.44 2.11 1.01 0.20 -4.68 120.40 121.99 1l3n s VAL 97 Ca 0.25 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 61.68 1l3n s VAL 97 Cb -0.16 -2.34 0.34 0.00 0.00 0.00 0.00 36.38 34.22 1l3n s VAL 97 CO 0.11 0.54 1.14 -1.54 0.00 0.00 0.00 175.10 175.35 1l3n n SER 98 N 3.13 -1.99 -4.82 3.32 3.41 -1.26 -0.45 113.62 114.96 1l3n n SER 98 Ca -0.18 -3.40 -0.26 0.00 -0.26 0.00 0.00 58.87 54.78 1l3n n SER 98 Cb 0.53 1.55 -0.05 0.00 -0.26 0.00 0.00 64.21 65.97 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 0.02 4.62 0.21 -1.33 1.09 -1.10 -4.90 121.20 119.80 1l3n s ILE 99 Ca 0.23 -1.03 0.10 0.00 -1.10 0.00 0.00 60.65 58.85 1l3n s ILE 99 Cb 0.32 -3.37 -0.04 0.00 -1.06 0.00 0.00 42.46 38.31 1l3n s ILE 99 CO -0.06 -0.12 -0.20 -1.83 -0.10 0.00 0.00 174.94 172.63 1l3n s GLU 100 N -3.16 1.46 0.16 2.79 1.03 -1.26 -0.24 118.70 119.48 1l3n s GLU 100 Ca 0.32 -1.55 -0.10 0.00 0.03 0.00 0.00 54.97 53.66 1l3n s GLU 100 Cb -0.10 -1.60 -0.00 0.00 -0.80 0.00 0.00 34.13 31.63 1l3n s GLU 100 CO 0.24 0.32 0.31 0.16 -1.33 0.00 0.00 175.26 174.97 1l3n s ASP 101 N -2.92 -0.01 -0.37 0.83 1.47 -0.38 -4.99 116.67 110.29 1l3n s ASP 101 Ca 0.21 -0.76 0.06 0.00 1.18 0.00 0.00 52.55 53.25 1l3n s ASP 101 Cb -0.06 0.45 0.44 0.00 -0.34 0.00 0.00 42.92 43.41 1l3n s ASP 101 CO 0.10 -0.89 1.21 -1.54 0.68 0.00 0.00 175.17 174.73 1l3n n SER 102 N -0.21 5.01 0.00 2.11 3.41 -1.26 -0.90 113.62 121.77 1l3n n SER 102 Ca -0.09 -3.74 0.00 0.00 -0.26 0.00 0.00 58.87 54.78 1l3n n SER 102 Cb 0.63 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 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 -0.63 0.00 -1.82 -3.33 3.14 -1.26 -5.01 118.33 109.43 1l3n n VAL 103 Ca 0.43 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 61.43 1l3n n VAL 103 Cb 0.82 -0.13 0.04 0.00 -1.06 0.00 0.00 33.84 33.52 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 -1.35 2.16 -0.16 1.55 1.09 -1.26 -4.95 121.20 118.28 1l3n s ILE 104 Ca 0.00 0.11 -0.12 0.00 -1.10 0.00 0.00 60.65 59.54 1l3n s ILE 104 Cb 0.00 -3.06 0.05 0.00 -1.06 0.00 0.00 42.46 38.39 1l3n s ILE 104 CO 0.00 -0.01 0.41 -0.44 -0.10 0.00 0.00 174.94 174.81 1l3n s SER 105 N -1.10 -0.47 0.17 3.58 0.01 -1.26 -4.64 113.70 109.99 1l3n s SER 105 Ca 0.74 0.87 -0.07 0.00 1.31 0.00 0.00 55.95 58.79 1l3n s SER 105 Cb -0.39 0.82 0.06 0.00 0.21 0.00 0.00 66.02 66.72 1l3n s SER 105 CO 0.44 -0.17 1.51 -0.07 0.41 0.00 0.00 173.24 175.37 1l3n h LEU 106 N 6.23 0.82 -7.62 2.44 -0.00 -1.95 -2.71 115.31 112.53 1l3n h LEU 106 Ca -0.31 -0.39 -0.34 0.00 -0.00 0.00 0.00 57.88 56.84 1l3n h LEU 106 Cb 1.18 -0.23 -0.34 0.00 -0.00 0.00 0.00 40.66 41.27 1l3n h LEU 106 CO 0.27 1.14 -0.75 -0.44 -0.00 0.00 0.00 178.44 178.66 1l3n s SER 107 N -6.87 0.41 0.00 -0.43 0.01 -1.26 -4.40 113.70 101.16 1l3n s SER 107 Ca -0.09 -0.03 0.00 0.00 1.31 0.00 0.00 55.95 57.14 1l3n s SER 107 Cb 0.11 -0.22 0.00 0.00 0.21 0.00 0.00 66.02 66.13 1l3n s SER 107 CO 0.86 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 175.03 1l3n n GLY 108 N 4.09 -1.71 1.72 3.44 0.00 -1.26 -4.82 105.19 106.65 1l3n n GLY 108 Ca -0.27 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.35 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 -0.01 1.61 -0.08 -1.26 -4.97 116.55 111.33 1l3n n ASP 109 Ca 0.00 0.12 -0.17 0.00 -1.51 0.00 0.00 54.79 53.23 1l3n n ASP 109 Cb 0.00 0.85 -0.09 0.00 2.34 0.00 0.00 41.12 44.22 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 0.91 -6.62 -0.67 3.86 -1.92 -3.48 115.15 107.23 1l3n h HIS 110 Ca 0.00 -0.43 -0.43 0.00 -1.16 0.00 0.00 60.37 58.35 1l3n h HIS 110 Cb 0.00 -0.13 0.01 0.00 1.06 0.00 0.00 27.41 28.35 1l3n h HIS 110 CO 0.00 1.24 -1.11 0.45 0.86 0.00 0.00 177.93 179.37 1l3n n SER 111 N -4.05 -5.23 0.00 2.45 2.88 -1.03 -4.83 113.62 103.81 1l3n n SER 111 Ca -0.09 -0.60 0.06 0.00 -1.33 0.00 0.00 58.87 56.92 1l3n n SER 111 Cb 0.72 -1.80 0.34 0.00 -0.75 0.00 0.00 64.21 62.72 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 -1.57 0.43 -0.22 2.46 -0.00 -1.19 -3.87 119.36 115.40 1l3n n ILE 112 Ca -0.21 0.11 0.13 0.00 -0.00 0.00 0.00 62.75 62.78 1l3n n ILE 112 Cb 0.68 -0.90 0.26 0.00 -0.00 0.00 0.00 39.64 39.68 1l3n n ILE 112 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 1l3n n ILE 113 N -1.18 -0.27 -1.64 7.28 2.08 -1.26 -0.43 119.36 123.93 1l3n n ILE 113 Ca 0.07 1.39 -0.27 0.00 0.56 0.00 0.00 62.75 64.51 1l3n n ILE 113 Cb 0.08 -2.11 0.07 0.00 -0.75 0.00 0.00 39.64 36.93 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 -1.27 5.98 3.99 7.39 0.00 -1.25 -2.88 105.19 117.15 1l3n n GLY 114 Ca 0.19 -2.33 -0.21 0.00 0.00 0.00 0.00 46.02 43.66 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 -3.66 2.38 -0.09 1.61 3.00 0.42 -3.61 118.95 119.00 1l3n s ARG 115 Ca 0.57 -1.66 0.04 0.00 0.00 0.00 0.00 55.73 54.67 1l3n s ARG 115 Cb 0.46 -2.52 -0.00 0.00 0.00 0.00 0.00 34.95 32.88 1l3n s ARG 115 CO 0.02 -0.67 -0.23 0.99 0.00 0.00 0.00 175.30 175.41 1l3n s THR 116 N -2.63 2.21 0.04 0.02 2.01 -1.16 -0.80 115.64 115.33 1l3n s THR 116 Ca 0.54 -0.98 0.01 0.00 0.31 0.00 0.00 61.69 61.57 1l3n s THR 116 Cb -0.05 -1.85 -0.04 0.00 0.01 0.00 0.00 72.50 70.57 1l3n s THR 116 CO 0.33 0.56 0.11 -0.76 -0.69 0.00 0.00 174.62 174.17 1l3n s LEU 117 N 0.22 3.96 -0.02 4.42 1.43 0.59 -0.13 118.68 129.15 1l3n s LEU 117 Ca -0.14 0.11 0.01 0.00 -1.03 0.00 0.00 54.13 53.07 1l3n s LEU 117 Cb -0.17 -2.51 0.01 0.00 0.03 0.00 0.00 46.19 43.56 1l3n s LEU 117 CO 0.07 0.21 -0.03 -0.69 0.23 0.00 0.00 176.35 176.14 1l3n s VAL 118 N -1.34 0.35 -0.12 -1.59 1.01 -0.60 -1.09 120.40 117.02 1l3n s VAL 118 Ca 0.28 -0.09 -0.11 0.00 0.00 0.00 0.00 61.98 62.06 1l3n s VAL 118 Cb -0.12 -0.36 -0.05 0.00 0.00 0.00 0.00 36.38 35.85 1l3n s VAL 118 CO 0.20 0.15 0.24 0.54 0.00 0.00 0.00 175.10 176.23 1l3n s VAL 119 N 0.48 5.33 0.19 2.92 0.11 -0.74 -2.86 120.40 125.84 1l3n s VAL 119 Ca -0.05 0.45 0.08 0.00 -2.93 0.00 0.00 61.98 59.53 1l3n s VAL 119 Cb -0.09 -3.55 -0.04 0.00 -1.53 0.00 0.00 36.38 31.17 1l3n s VAL 119 CO -0.01 0.52 -0.03 -1.00 -3.33 0.00 0.00 175.10 171.25 1l3n s HIS 120 N -0.40 2.76 0.11 1.54 3.76 -0.51 -2.20 115.29 120.34 1l3n s HIS 120 Ca 0.16 -0.18 -0.22 0.00 -0.15 0.00 0.00 55.06 54.67 1l3n s HIS 120 Cb -0.13 -1.32 -0.06 0.00 1.11 0.00 0.00 32.58 32.18 1l3n s HIS 120 CO 0.05 0.54 1.38 1.49 -0.85 0.00 0.00 174.74 177.35 1l3n h GLU 121 N 2.60 -0.10 -6.16 1.40 4.81 -0.82 -3.19 114.58 113.11 1l3n h GLU 121 Ca -0.46 0.01 -0.51 0.00 -0.13 0.00 0.00 59.36 58.26 1l3n h GLU 121 Cb 1.21 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.59 1l3n h GLU 121 CO 0.57 -0.07 -0.34 0.15 -0.73 0.00 0.00 179.01 178.59 1l3n s LYS 122 N -4.81 2.46 0.51 1.92 1.02 0.81 -4.84 119.74 116.82 1l3n s LYS 122 Ca -0.09 -1.64 -0.19 0.00 0.02 0.00 0.00 55.97 54.06 1l3n s LYS 122 Cb 0.07 -2.34 -0.07 0.00 -0.52 0.00 0.00 37.83 34.96 1l3n s LYS 122 CO 0.44 -0.33 1.05 0.00 -0.92 0.00 0.00 175.35 175.58 1l3n s ALA 123 N -2.55 2.83 0.44 5.17 0.00 -1.16 -0.40 121.76 126.10 1l3n s ALA 123 Ca 0.46 0.58 -0.21 0.00 0.00 0.00 0.00 51.96 52.80 1l3n s ALA 123 Cb -0.03 -3.26 -0.11 0.00 0.00 0.00 0.00 23.12 19.73 1l3n s ALA 123 CO 0.27 -0.45 0.96 -0.51 0.00 0.00 0.00 175.76 176.04 1l3n s ASP 124 N -2.13 6.86 0.24 0.00 1.11 -1.26 -4.13 116.67 117.37 1l3n s ASP 124 Ca 0.67 1.71 0.10 0.00 0.18 0.00 0.00 52.55 55.21 1l3n s ASP 124 Cb -0.17 -2.54 0.24 0.00 1.07 0.00 0.00 42.92 41.52 1l3n s ASP 124 CO 0.24 -0.42 1.54 0.44 1.18 0.00 0.00 175.17 178.15 1l3n h ASP 125 N 1.82 0.00 -6.12 0.27 3.32 -1.03 -3.48 116.42 111.21 1l3n h ASP 125 Ca -0.49 0.00 -0.43 0.00 0.02 0.00 0.00 57.03 56.13 1l3n h ASP 125 Cb 1.18 0.00 0.04 0.00 0.22 0.00 0.00 39.33 40.77 1l3n h ASP 125 CO 0.61 0.69 -0.77 0.18 -1.72 0.00 0.00 179.24 178.22 1l3n n LEU 126 N -3.66 -2.98 0.00 1.55 4.77 -1.26 -2.26 117.00 113.16 1l3n n LEU 126 Ca -0.01 -0.75 0.00 0.00 -0.03 0.00 0.00 56.01 55.23 1l3n n LEU 126 Cb 0.69 -2.71 0.00 0.00 -2.33 0.00 0.00 43.42 39.07 1l3n n LEU 126 CO 0.43 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.57 1l3n n GLY 127 N -1.66 2.06 0.00 -0.72 0.00 -1.10 -4.53 105.19 99.24 1l3n n GLY 127 Ca -0.11 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.05 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 0.56 -0.27 1.61 5.02 -0.96 -3.13 118.16 118.99 1l3n n LYS 128 Ca 0.00 0.02 -0.02 0.00 -2.02 0.00 0.00 58.31 56.29 1l3n n LYS 128 Cb 0.00 -1.50 0.16 0.00 -0.02 0.00 0.00 35.03 33.67 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 4.58 1.18 -2.63 0.72 0.00 -1.88 -3.47 103.07 101.57 1l3n h GLY 129 Ca 0.00 -0.51 -0.26 0.00 0.00 0.00 0.00 47.33 46.56 1l3n h GLY 129 CO 0.00 0.49 -0.37 0.61 0.00 0.00 0.00 176.54 177.27 1l3n n GLY 130 N -1.22 -0.11 3.56 4.60 0.00 -1.18 -4.98 105.19 105.86 1l3n n GLY 130 Ca 0.08 -0.25 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.68 3.95 0.19 1.61 0.01 -1.26 -4.98 114.94 111.78 1l3n s ASN 131 Ca 0.13 -0.97 -0.14 0.00 -0.71 0.00 0.00 52.86 51.17 1l3n s ASN 131 Cb -0.06 -0.48 0.18 0.00 0.41 0.00 0.00 41.25 41.31 1l3n s ASN 131 CO 0.16 -0.07 1.68 -0.08 -1.51 0.00 0.00 177.10 177.27 1l3n h GLU 132 N 2.04 0.09 -1.00 -0.60 4.81 -1.98 -0.07 114.58 117.86 1l3n h GLU 132 Ca -0.42 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 58.84 1l3n h GLU 132 Cb 1.25 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.56 1l3n h GLU 132 CO 0.63 0.06 0.66 1.49 -0.73 0.00 0.00 179.01 181.12 1l3n h GLU 133 N 0.09 1.25 -1.00 1.92 4.57 -1.98 -1.69 114.58 117.75 1l3n h GLU 133 Ca 0.25 -0.08 0.10 0.00 -1.18 0.00 0.00 59.36 58.45 1l3n h GLU 133 Cb 0.38 -0.28 -0.08 0.00 -0.16 0.00 0.00 28.75 28.61 1l3n h GLU 133 CO -0.44 0.83 0.63 0.66 -1.18 0.00 0.00 179.01 179.51 1l3n h SER 134 N 1.29 0.96 -0.09 1.04 4.64 -1.36 0.88 113.55 120.91 1l3n h SER 134 Ca 0.39 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 1l3n h SER 134 Cb -0.04 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 61.88 1l3n h SER 134 CO -0.11 0.56 0.00 1.07 -0.87 0.00 0.00 176.83 177.48 1l3n n THR 135 N -4.58 0.11 0.00 2.95 5.66 -0.67 -2.72 114.28 115.04 1l3n n THR 135 Ca 0.17 -0.17 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1l3n n THR 135 Cb 0.28 0.04 0.00 0.00 -1.55 0.00 0.00 70.33 69.10 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 -0.23 0.00 -0.94 1.09 5.02 0.19 -1.43 118.16 121.86 1l3n n LYS 136 Ca 0.14 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.34 1l3n n LYS 136 Cb 0.19 0.00 0.18 0.00 -0.02 0.00 0.00 35.03 35.38 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 -0.54 2.67 -2.19 -0.18 -2.24 -0.54 -4.61 114.28 106.66 1l3n n THR 137 Ca 0.00 -2.77 -0.18 0.00 -2.27 0.00 0.00 64.05 58.84 1l3n n THR 137 Cb 0.00 -0.41 -0.03 0.00 -2.10 0.00 0.00 70.33 67.80 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 -1.10 0.04 2.43 3.38 0.00 -0.72 -0.90 105.19 108.32 1l3n n GLY 138 Ca 0.38 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.33 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 -1.71 -2.66 0.00 1.61 3.02 -1.25 -0.37 115.26 113.91 1l3n n ASN 139 Ca -0.20 0.32 0.07 0.00 -0.03 0.00 0.00 54.58 54.74 1l3n n ASN 139 Cb 0.64 -2.33 0.37 0.00 -0.61 0.00 0.00 39.78 37.85 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 -2.26 1.86 -0.12 5.41 0.00 -0.08 -4.84 120.51 120.49 1l3n n ALA 140 Ca -0.08 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1l3n n ALA 140 Cb 0.55 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.77 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 -0.08 -1.36 3.67 0.00 0.00 -1.26 -0.13 105.19 106.02 1l3n n GLY 141 Ca 0.08 -1.28 -0.46 0.00 0.00 0.00 0.00 46.02 44.35 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 -0.18 3.11 -3.88 1.61 7.64 -1.26 -4.48 113.62 116.19 1l3n n SER 142 Ca 0.00 1.07 -0.38 0.00 1.01 0.00 0.00 58.87 60.57 1l3n n SER 142 Cb 0.00 -1.41 -0.08 0.00 -1.01 0.00 0.00 64.21 61.71 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 3.92 0.97 -0.32 1.43 1.74 -1.26 -0.51 116.66 122.62 1l3n n ARG 143 Ca 0.18 -1.73 0.21 0.00 -0.77 0.00 0.00 57.85 55.75 1l3n n ARG 143 Cb 0.29 -3.07 0.49 0.00 -1.02 0.00 0.00 32.46 29.14 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 16.64 0.48 -7.12 0.55 3.38 -1.77 -3.43 115.31 124.05 1l3n h LEU 144 Ca 0.29 0.09 -0.06 0.00 0.09 0.00 0.00 57.88 58.29 1l3n h LEU 144 Cb 0.76 0.01 -0.18 0.00 0.09 0.00 0.00 40.66 41.34 1l3n h LEU 144 CO 1.74 0.11 0.09 0.00 0.09 0.00 0.00 178.44 180.47 1l3n s ALA 145 N -5.53 -1.52 0.04 1.53 0.00 -1.18 -3.00 121.76 112.10 1l3n s ALA 145 Ca -0.09 0.94 0.04 0.00 0.00 0.00 0.00 51.96 52.85 1l3n s ALA 145 Cb 0.25 0.19 -0.02 0.00 0.00 0.00 0.00 23.12 23.54 1l3n s ALA 145 CO 0.80 -0.43 -0.13 0.00 0.00 0.00 0.00 175.76 176.00 1l3n s GLY 147 N -1.10 0.32 -0.14 0.00 0.00 -0.25 -0.79 107.32 105.35 1l3n s GLY 147 Ca 0.01 -0.32 -0.08 0.00 0.00 0.00 0.00 44.72 44.32 1l3n s GLY 147 CO 0.01 -0.29 0.15 0.14 0.00 0.00 0.00 173.10 173.11 1l3n s VAL 148 N -0.30 5.46 0.71 1.40 1.01 -1.26 -0.30 120.40 127.13 1l3n s VAL 148 Ca 0.01 0.22 -0.12 0.00 0.00 0.00 0.00 61.98 62.09 1l3n s VAL 148 Cb -0.03 -3.43 0.02 0.00 0.00 0.00 0.00 36.38 32.94 1l3n s VAL 148 CO -0.00 0.56 1.08 -0.63 0.00 0.00 0.00 175.10 176.10 1l3n s ILE 149 N -0.56 3.62 0.02 2.22 1.01 0.02 -4.30 121.20 123.22 1l3n s ILE 149 Ca 0.13 0.57 -0.29 0.00 0.00 0.00 0.00 60.65 61.06 1l3n s ILE 149 Cb -0.12 -3.16 0.11 0.00 0.01 0.00 0.00 42.46 39.30 1l3n s ILE 149 CO 0.02 -0.64 1.17 -0.83 0.00 0.00 0.00 174.94 174.66 1l3n s GLY 150 N -3.39 -0.36 0.38 6.18 0.00 -0.46 -4.58 107.32 105.10 1l3n s GLY 150 Ca 0.61 0.63 -0.26 0.00 0.00 0.00 0.00 44.72 45.70 1l3n s GLY 150 CO 0.52 0.13 1.09 1.39 0.00 0.00 0.00 173.10 176.23 1l3n n ILE 151 N -0.44 2.30 -3.89 0.90 5.41 -1.26 -0.93 119.36 121.45 1l3n n ILE 151 Ca -0.07 -0.50 -0.09 0.00 1.00 0.00 0.00 62.75 63.08 1l3n n ILE 151 Cb 0.62 -1.24 -0.06 0.00 -0.71 0.00 0.00 39.64 38.24 1l3n n ILE 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1l3n s ALA 152 N -1.20 -0.23 0.00 -1.39 0.00 -0.56 -4.38 121.76 114.01 1l3n s ALA 152 Ca 0.61 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.88 1l3n s ALA 152 Cb -0.58 0.77 0.00 0.00 0.00 0.00 0.00 23.12 23.31 1l3n s ALA 152 CO 0.58 -0.63 0.14 1.04 0.00 0.00 0.00 175.76 176.89