#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 -4.44 0.00 5.66 -1.26 -4.81 114.28 109.43 1l3n n THR 2 Ca 0.00 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.78 1l3n n THR 2 Cb 0.00 0.00 -0.16 0.00 -1.55 0.00 0.00 70.33 68.62 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 0.00 1.26 0.23 1.09 1.02 -1.26 -0.62 119.74 121.45 1l3n s LYS 3 Ca 0.00 -0.32 0.01 0.00 0.02 0.00 0.00 55.97 55.68 1l3n s LYS 3 Cb 0.00 -1.11 -0.05 0.00 -0.52 0.00 0.00 37.83 36.15 1l3n s LYS 3 CO 0.00 0.05 0.08 0.00 -0.92 0.00 0.00 175.35 174.56 1l3n s ALA 4 N 0.51 1.54 0.45 5.17 0.00 -0.09 -0.91 121.76 128.43 1l3n s ALA 4 Ca -0.09 -1.78 0.03 0.00 0.00 0.00 0.00 51.96 50.12 1l3n s ALA 4 Cb -0.13 1.00 -0.02 0.00 0.00 0.00 0.00 23.12 23.97 1l3n s ALA 4 CO 0.02 -0.45 0.11 0.14 0.00 0.00 0.00 175.76 175.57 1l3n s VAL 5 N -3.81 0.66 -0.29 0.00 -7.23 0.04 -0.52 120.40 109.26 1l3n s VAL 5 Ca 0.35 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.47 1l3n s VAL 5 Cb 0.07 -2.24 0.15 0.00 0.56 0.00 0.00 36.38 34.93 1l3n s VAL 5 CO 0.11 0.00 0.59 0.00 -0.31 0.00 0.00 175.10 175.49 1l3n s ALA 6 N -3.11 -2.01 -0.66 1.32 0.00 -1.11 -3.70 121.76 112.49 1l3n s ALA 6 Ca 0.17 1.96 -0.16 0.00 0.00 0.00 0.00 51.96 53.93 1l3n s ALA 6 Cb 0.01 -1.92 0.16 0.00 0.00 0.00 0.00 23.12 21.37 1l3n s ALA 6 CO 0.11 -1.12 0.65 0.14 0.00 0.00 0.00 175.76 175.54 1l3n s VAL 7 N 2.84 5.26 0.21 0.00 -7.23 -1.25 -1.34 120.40 118.89 1l3n s VAL 7 Ca 0.08 -1.74 -0.22 0.00 -1.81 0.00 0.00 61.98 58.28 1l3n s VAL 7 Cb -0.14 -4.43 -0.08 0.00 0.56 0.00 0.00 36.38 32.29 1l3n s VAL 7 CO -0.19 -0.99 0.76 -0.76 -0.31 0.00 0.00 175.10 173.61 1l3n s LEU 8 N 1.35 4.44 0.19 1.32 1.02 0.98 -4.39 118.68 123.60 1l3n s LEU 8 Ca 0.11 1.55 -0.15 0.00 0.02 0.00 0.00 54.13 55.65 1l3n s LEU 8 Cb -0.21 -3.50 0.02 0.00 0.02 0.00 0.00 46.19 42.51 1l3n s LEU 8 CO -0.01 0.10 0.45 -0.54 0.02 0.00 0.00 176.35 176.37 1l3n s LYS 9 N -1.65 1.32 0.21 1.70 1.02 -0.22 -0.39 119.74 121.73 1l3n s LYS 9 Ca 0.41 -0.97 0.00 0.00 0.02 0.00 0.00 55.97 55.43 1l3n s LYS 9 Cb -0.19 0.48 0.00 0.00 -0.52 0.00 0.00 37.83 37.59 1l3n s LYS 9 CO 0.23 -0.54 0.00 0.41 -0.92 0.00 0.00 175.35 174.53 1l3n n GLY 10 N -0.31 -1.56 0.18 -3.33 0.00 -1.24 -0.71 105.19 98.22 1l3n n GLY 10 Ca -0.09 0.49 -0.16 0.00 0.00 0.00 0.00 46.02 46.26 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 0.68 0.00 1.61 5.19 -1.78 -3.48 116.42 118.64 1l3n h ASP 11 Ca 0.00 -0.63 0.00 0.00 -0.62 0.00 0.00 57.03 55.78 1l3n h ASP 11 Cb 0.00 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.31 1l3n h ASP 11 CO 0.00 1.20 0.00 0.61 -3.12 0.00 0.00 179.24 177.93 1l3n n GLY 12 N 0.67 2.45 0.37 2.75 0.00 -1.26 -4.87 105.19 105.31 1l3n n GLY 12 Ca -0.08 -0.45 0.01 0.00 0.00 0.00 0.00 46.02 45.50 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 1.21 -6.13 1.61 0.13 -1.93 -3.40 132.00 123.50 1l3n h PRO 13 Ca 0.00 -0.07 -0.58 0.00 -0.87 0.00 0.00 66.00 64.48 1l3n h PRO 13 Cb 0.00 -0.27 -0.01 0.00 0.13 0.00 0.00 31.00 30.84 1l3n h PRO 13 CO 0.00 0.80 1.38 0.08 -0.23 0.00 0.00 178.00 180.03 1l3n s VAL 14 N -6.07 3.23 -0.06 1.56 1.01 -1.26 -4.10 120.40 114.71 1l3n s VAL 14 Ca -0.13 0.24 0.03 0.00 0.00 0.00 0.00 61.98 62.12 1l3n s VAL 14 Cb 0.19 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 33.28 1l3n s VAL 14 CO 0.82 -0.18 -0.16 0.00 0.00 0.00 0.00 175.10 175.57 1l3n s GLN 15 N 5.92 1.97 -0.10 2.72 -2.07 -0.05 -3.72 119.66 124.32 1l3n s GLN 15 Ca 0.90 -0.57 0.01 0.00 -1.82 0.00 0.00 55.36 53.89 1l3n s GLN 15 Cb -0.29 -1.61 -0.02 0.00 -1.09 0.00 0.00 33.01 30.00 1l3n s GLN 15 CO 0.34 0.14 -0.14 0.20 -1.32 0.00 0.00 175.29 174.51 1l3n s GLY 16 N 0.37 1.53 -0.32 2.60 0.00 0.48 -0.84 107.32 111.14 1l3n s GLY 16 Ca -0.11 -0.93 -0.02 0.00 0.00 0.00 0.00 44.72 43.66 1l3n s GLY 16 CO 0.04 -0.43 0.14 -0.42 0.00 0.00 0.00 173.10 172.43 1l3n s ILE 17 N -0.09 0.43 0.11 0.90 1.01 -1.25 -0.02 121.20 122.29 1l3n s ILE 17 Ca -0.02 -1.27 0.02 0.00 0.00 0.00 0.00 60.65 59.38 1l3n s ILE 17 Cb -0.14 -1.33 -0.04 0.00 0.01 0.00 0.00 42.46 40.96 1l3n s ILE 17 CO 0.04 -0.76 0.18 -0.63 0.00 0.00 0.00 174.94 173.77 1l3n s ILE 18 N 1.64 4.98 -0.19 2.92 -1.09 -0.45 -1.17 121.20 127.84 1l3n s ILE 18 Ca 0.11 -0.70 0.00 0.00 -2.23 0.00 0.00 60.65 57.84 1l3n s ILE 18 Cb -0.18 -3.48 0.05 0.00 -1.58 0.00 0.00 42.46 37.27 1l3n s ILE 18 CO -0.24 0.03 -0.07 0.20 -1.23 0.00 0.00 174.94 173.62 1l3n s ASN 19 N -2.78 3.26 -0.57 3.58 0.02 0.69 -2.74 114.94 116.39 1l3n s ASN 19 Ca 0.33 -0.85 -0.18 0.00 -1.02 0.00 0.00 52.86 51.13 1l3n s ASN 19 Cb -0.12 -1.09 0.11 0.00 0.02 0.00 0.00 41.25 40.18 1l3n s ASN 19 CO 0.26 -0.18 0.62 -0.36 0.02 0.00 0.00 177.10 177.46 1l3n s PHE 20 N 1.49 3.10 -0.24 2.20 0.40 0.33 -1.52 117.98 123.74 1l3n s PHE 20 Ca -0.01 -1.10 -0.05 0.00 -0.60 0.00 0.00 56.93 55.17 1l3n s PHE 20 Cb -0.16 -3.93 -0.01 0.00 0.51 0.00 0.00 43.02 39.43 1l3n s PHE 20 CO -0.08 -1.18 -0.01 -1.21 0.70 0.00 0.00 175.22 173.45 1l3n s GLU 21 N 2.23 3.33 -0.56 0.44 2.02 -0.39 -0.92 118.70 124.86 1l3n s GLU 21 Ca 0.08 -0.67 -0.21 0.00 0.02 0.00 0.00 54.97 54.19 1l3n s GLU 21 Cb -0.27 -3.12 0.06 0.00 0.10 0.00 0.00 34.13 30.91 1l3n s GLU 21 CO 0.05 -0.25 0.80 -1.14 0.02 0.00 0.00 175.26 174.73 1l3n s GLN 22 N 1.49 3.17 0.14 1.61 2.00 0.21 -0.81 119.66 127.47 1l3n s GLN 22 Ca 0.05 -0.76 -0.29 0.00 -2.00 0.00 0.00 55.36 52.36 1l3n s GLN 22 Cb -0.15 -4.14 -0.05 0.00 0.80 0.00 0.00 33.01 29.48 1l3n s GLN 22 CO -0.01 -1.47 1.57 0.87 -0.50 0.00 0.00 175.29 175.75 1l3n h LYS 23 N 9.24 -0.41 -4.88 1.67 1.79 -1.82 -3.45 116.57 118.71 1l3n h LYS 23 Ca -0.28 0.03 -0.46 0.00 -2.18 0.00 0.00 60.65 57.76 1l3n h LYS 23 Cb 1.08 0.09 -0.13 0.00 -1.58 0.00 0.00 32.23 31.70 1l3n h LYS 23 CO 1.07 -0.28 -0.49 -2.00 -1.08 0.00 0.00 179.45 176.67 1l3n s GLU 24 N -5.83 1.74 0.46 3.15 -6.30 -1.26 -4.96 118.70 105.70 1l3n s GLU 24 Ca -0.15 -2.00 0.21 0.00 -2.50 0.00 0.00 54.97 50.52 1l3n s GLU 24 Cb 0.10 0.33 1.10 0.00 0.00 0.00 0.00 34.13 35.65 1l3n s GLU 24 CO 0.64 -0.64 1.95 1.03 0.02 0.00 0.00 175.26 178.26 1l3n h SER 25 N 2.15 0.00 1.55 -1.70 0.87 -1.99 -0.77 113.55 113.67 1l3n h SER 25 Ca -0.25 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.26 1l3n h SER 25 Cb 1.23 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.19 1l3n h SER 25 CO 0.37 0.22 -0.24 0.78 -0.53 0.00 0.00 176.83 177.43 1l3n h ASN 26 N 0.00 0.00 -3.68 6.23 2.35 -1.98 -3.46 115.58 115.04 1l3n h ASN 26 Ca -0.00 0.00 -0.50 0.00 -0.55 0.00 0.00 56.30 55.25 1l3n h ASN 26 Cb 0.49 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.83 1l3n h ASN 26 CO 0.03 0.24 0.19 -0.83 -1.65 0.00 0.00 177.43 175.40 1l3n s GLY 27 N -4.32 2.66 0.71 2.83 0.00 -0.30 -5.05 107.32 103.85 1l3n s GLY 27 Ca 0.04 0.28 -0.15 0.00 0.00 0.00 0.00 44.72 44.89 1l3n s GLY 27 CO 0.69 0.66 1.20 2.56 0.00 0.00 0.00 173.10 178.20 1l3n s PRO 28 N -2.06 2.28 -0.26 2.90 0.04 -1.26 -4.62 135.00 132.02 1l3n s PRO 28 Ca 0.46 1.72 -0.29 0.00 0.04 0.00 0.00 61.00 62.93 1l3n s PRO 28 Cb -0.17 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1l3n s PRO 28 CO 0.22 -1.72 1.20 0.54 0.04 0.00 0.00 177.00 177.28 1l3n s VAL 29 N -2.00 4.33 -0.49 -0.36 0.11 0.97 -4.10 120.40 118.86 1l3n s VAL 29 Ca 0.74 1.55 -0.25 0.00 -2.93 0.00 0.00 61.98 61.09 1l3n s VAL 29 Cb -0.28 -4.20 0.03 0.00 -1.53 0.00 0.00 36.38 30.40 1l3n s VAL 29 CO 0.44 -0.35 0.94 -0.75 -3.33 0.00 0.00 175.10 172.05 1l3n s LYS 30 N 3.75 3.48 -0.83 1.54 2.20 0.01 -1.65 119.74 128.25 1l3n s LYS 30 Ca 0.52 0.06 -0.20 0.00 -0.36 0.00 0.00 55.97 55.99 1l3n s LYS 30 Cb -0.17 -3.96 0.10 0.00 -1.51 0.00 0.00 37.83 32.29 1l3n s LYS 30 CO 0.17 -1.31 1.08 0.54 -0.36 0.00 0.00 175.35 175.47 1l3n s VAL 31 N 3.87 4.52 0.35 4.02 0.11 0.11 -1.26 120.40 132.13 1l3n s VAL 31 Ca 0.36 -1.06 0.07 0.00 -2.93 0.00 0.00 61.98 58.42 1l3n s VAL 31 Cb -0.10 -4.76 -0.03 0.00 -1.53 0.00 0.00 36.38 29.96 1l3n s VAL 31 CO 0.25 -1.51 0.31 -1.66 -3.33 0.00 0.00 175.10 169.15 1l3n s TRP 32 N 3.35 2.87 0.00 1.54 -2.14 -0.57 -0.97 118.94 123.02 1l3n s TRP 32 Ca 0.29 -0.33 0.00 0.00 2.66 0.00 0.00 56.10 58.72 1l3n s TRP 32 Cb -0.09 -1.85 0.00 0.00 -3.10 0.00 0.00 33.47 28.43 1l3n s TRP 32 CO -0.02 0.14 0.00 0.41 -2.66 0.00 0.00 176.95 174.82 1l3n n GLY 33 N -1.40 0.62 2.50 3.67 0.00 0.37 -0.22 105.19 110.74 1l3n n GLY 33 Ca -0.01 -0.73 -0.29 0.00 0.00 0.00 0.00 46.02 44.99 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 0.00 3.17 0.91 1.61 0.01 -0.31 -0.58 113.70 118.50 1l3n s SER 34 Ca 0.00 -1.76 -0.14 0.00 1.31 0.00 0.00 55.95 55.36 1l3n s SER 34 Cb 0.00 -0.34 0.14 0.00 0.21 0.00 0.00 66.02 66.03 1l3n s SER 34 CO 0.00 -0.37 1.20 0.27 0.41 0.00 0.00 173.24 174.75 1l3n s ILE 35 N 1.55 1.97 -0.01 1.44 -4.36 -1.00 -3.80 121.20 116.98 1l3n s ILE 35 Ca 0.14 0.00 -0.23 0.00 -0.26 0.00 0.00 60.65 60.30 1l3n s ILE 35 Cb -0.20 -2.89 0.05 0.00 1.25 0.00 0.00 42.46 40.67 1l3n s ILE 35 CO -0.16 0.00 0.51 -1.59 0.24 0.00 0.00 174.94 173.94 1l3n s LYS 36 N -5.56 0.93 0.00 0.37 -2.85 -0.02 -3.46 119.74 109.15 1l3n s LYS 36 Ca 0.66 -0.04 0.00 0.00 -1.00 0.00 0.00 55.97 55.60 1l3n s LYS 36 Cb -0.10 0.43 0.00 0.00 -2.06 0.00 0.00 37.83 36.10 1l3n s LYS 36 CO 0.52 -0.30 0.00 0.41 0.10 0.00 0.00 175.35 176.08 1l3n n GLY 37 N 0.87 2.46 3.65 0.59 0.00 -1.21 -0.87 105.19 110.68 1l3n n GLY 37 Ca -0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 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 1.00 0.41 0.99 1.02 -1.20 -4.25 118.68 116.65 1l3n s LEU 38 Ca 0.00 0.46 0.02 0.00 0.02 0.00 0.00 54.13 54.64 1l3n s LEU 38 Cb 0.00 -2.18 -0.00 0.00 0.02 0.00 0.00 46.19 44.02 1l3n s LEU 38 CO 0.00 -4.00 0.61 0.28 0.02 0.00 0.00 176.35 173.25 1l3n s THR 39 N -3.20 3.98 1.26 5.49 -1.32 -1.26 -3.11 115.64 117.48 1l3n s THR 39 Ca 0.73 -0.67 -0.15 0.00 -1.21 0.00 0.00 61.69 60.38 1l3n s THR 39 Cb -0.07 -3.44 0.32 0.00 -1.51 0.00 0.00 72.50 67.80 1l3n s THR 39 CO 0.55 -0.26 0.99 -0.70 -2.21 0.00 0.00 174.62 172.99 1l3n s GLU 40 N -4.43 -1.69 0.43 7.08 2.12 -1.25 -4.72 118.70 116.23 1l3n s GLU 40 Ca 0.47 0.69 0.00 0.00 0.36 0.00 0.00 54.97 56.49 1l3n s GLU 40 Cb -0.10 -1.47 0.00 0.00 0.26 0.00 0.00 34.13 32.82 1l3n s GLU 40 CO 0.36 -4.20 0.00 0.41 -0.54 0.00 0.00 175.26 171.29 1l3n n GLY 41 N 1.22 -2.30 3.77 -1.50 0.00 -0.15 -4.76 105.19 101.47 1l3n n GLY 41 Ca 0.04 -1.70 -0.39 0.00 0.00 0.00 0.00 46.02 43.97 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 4.30 -0.01 0.99 2.01 -1.26 -0.38 118.68 124.33 1l3n s LEU 42 Ca 0.00 2.40 -0.06 0.00 0.01 0.00 0.00 54.13 56.48 1l3n s LEU 42 Cb 0.00 -3.88 0.00 0.00 0.01 0.00 0.00 46.19 42.32 1l3n s LEU 42 CO 0.00 -0.56 0.12 -1.00 1.01 0.00 0.00 176.35 175.93 1l3n s HIS 43 N -1.32 0.01 -0.05 0.29 3.76 0.77 -2.93 115.29 115.81 1l3n s HIS 43 Ca 0.53 -0.04 -0.25 0.00 -0.15 0.00 0.00 55.06 55.16 1l3n s HIS 43 Cb -0.33 -0.04 -0.12 0.00 1.11 0.00 0.00 32.58 33.21 1l3n s HIS 43 CO 0.42 -0.23 0.70 0.41 -0.85 0.00 0.00 174.74 175.19 1l3n n GLY 44 N 1.85 -0.12 2.97 -2.22 0.00 0.67 -1.28 105.19 107.07 1l3n n GLY 44 Ca -0.20 0.49 -0.06 0.00 0.00 0.00 0.00 46.02 46.25 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 0.33 -1.10 0.29 1.61 5.36 -1.26 -1.34 117.98 121.87 1l3n s PHE 45 Ca 0.56 0.87 -0.08 0.00 -0.96 0.00 0.00 56.93 57.32 1l3n s PHE 45 Cb -0.79 0.09 0.00 0.00 -0.34 0.00 0.00 43.02 41.98 1l3n s PHE 45 CO 0.37 -0.85 0.48 -1.01 -1.46 0.00 0.00 175.22 172.75 1l3n s HIS 46 N 2.62 0.66 0.03 10.12 3.76 -0.45 -2.52 115.29 129.52 1l3n s HIS 46 Ca 0.13 -0.99 -0.08 0.00 -0.15 0.00 0.00 55.06 53.97 1l3n s HIS 46 Cb -0.14 0.09 -0.05 0.00 1.11 0.00 0.00 32.58 33.59 1l3n s HIS 46 CO -0.22 -1.08 0.32 0.08 -0.85 0.00 0.00 174.74 172.99 1l3n s VAL 47 N -3.50 5.22 -0.02 -0.90 1.01 0.33 -0.77 120.40 121.77 1l3n s VAL 47 Ca 0.26 0.30 0.04 0.00 0.00 0.00 0.00 61.98 62.58 1l3n s VAL 47 Cb -0.00 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.77 1l3n s VAL 47 CO 0.14 0.35 -0.15 -1.00 0.00 0.00 0.00 175.10 174.43 1l3n s HIS 48 N -1.32 1.40 0.08 5.22 3.76 0.61 -4.61 115.29 120.41 1l3n s HIS 48 Ca 0.29 -0.29 -0.25 0.00 -0.15 0.00 0.00 55.06 54.66 1l3n s HIS 48 Cb -0.14 -0.91 -0.10 0.00 1.11 0.00 0.00 32.58 32.54 1l3n s HIS 48 CO 0.17 -0.05 1.40 1.49 -0.85 0.00 0.00 174.74 176.90 1l3n h GLU 49 N 5.88 -0.51 -6.41 1.40 4.81 -1.66 -3.03 114.58 115.07 1l3n h GLU 49 Ca -0.35 0.03 -0.54 0.00 -0.13 0.00 0.00 59.36 58.38 1l3n h GLU 49 Cb 1.16 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.63 1l3n h GLU 49 CO 0.48 -0.34 0.36 -0.06 -0.73 0.00 0.00 179.01 178.73 1l3n s PHE 50 N -4.99 3.67 -0.59 0.92 0.08 0.86 -4.57 117.98 113.35 1l3n s PHE 50 Ca -0.12 1.69 0.22 0.00 0.12 0.00 0.00 56.93 58.84 1l3n s PHE 50 Cb 0.04 -3.11 0.91 0.00 -0.57 0.00 0.00 43.02 40.30 1l3n s PHE 50 CO 0.44 0.00 1.67 0.41 -0.10 0.00 0.00 175.22 177.65 1l3n n GLY 51 N 2.87 -1.25 3.46 4.36 0.00 -1.21 -3.68 105.19 109.75 1l3n n GLY 51 Ca 0.06 0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.10 -0.68 -0.28 1.61 2.03 -1.26 -4.65 116.55 111.22 1l3n n ASP 52 Ca 0.03 0.95 0.00 0.00 0.52 0.00 0.00 54.79 56.28 1l3n n ASP 52 Cb 0.23 -1.12 0.00 0.00 -0.72 0.00 0.00 41.12 39.51 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 1.30 0.00 -0.05 1.67 3.02 -1.26 -3.84 115.26 116.11 1l3n n ASN 53 Ca 0.12 -1.17 0.06 0.00 -0.03 0.00 0.00 54.58 53.56 1l3n n ASN 53 Cb 0.38 -0.03 0.43 0.00 -0.61 0.00 0.00 39.78 39.95 1l3n n ASN 53 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1l3n h THR 54 N 4.47 1.04 0.00 3.41 2.02 -2.00 0.28 112.91 122.13 1l3n h THR 54 Ca 0.00 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 1l3n h THR 54 Cb 1.07 0.44 -0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1l3n h THR 54 CO 0.00 0.10 -0.09 0.00 0.37 0.00 0.00 175.52 175.90 1l3n h ALA 55 N 1.71 0.94 -1.17 6.16 0.00 -2.01 -3.49 119.26 121.41 1l3n h ALA 55 Ca 0.20 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1l3n h ALA 55 Cb 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1l3n h ALA 55 CO -0.05 0.11 0.00 0.41 0.00 0.00 0.00 179.25 179.72 1l3n n GLY 56 N 1.09 -1.06 2.84 0.00 0.00 0.99 -4.82 105.19 104.22 1l3n n GLY 56 Ca 0.04 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.71 0.40 0.24 0.00 -1.04 -1.26 -4.78 114.28 107.13 1l3n n THR 58 Ca 0.00 0.13 0.17 0.00 -2.04 0.00 0.00 64.05 62.31 1l3n n THR 58 Cb 0.00 -0.83 0.87 0.00 -1.82 0.00 0.00 70.33 68.55 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 -1.79 8.00 0.02 -1.89 -0.69 113.55 117.20 1l3n h SER 59 Ca 0.00 0.00 0.52 0.00 -0.84 0.00 0.00 61.79 61.47 1l3n h SER 59 Cb 0.00 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 62.46 1l3n h SER 59 CO 0.00 0.00 1.28 0.00 -1.14 0.00 0.00 176.83 176.97 1l3n h ALA 60 N 1.79 3.67 0.00 3.77 0.00 -1.77 -3.43 119.26 123.29 1l3n h ALA 60 Ca 0.06 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1l3n h ALA 60 Cb 0.39 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1l3n h ALA 60 CO -0.00 -2.19 0.00 0.41 0.00 0.00 0.00 179.25 177.47 1l3n n GLY 61 N -1.87 2.09 2.88 0.00 0.00 -0.27 -0.10 105.19 107.92 1l3n n GLY 61 Ca 0.40 -1.28 -0.37 0.00 0.00 0.00 0.00 46.02 44.77 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 2.26 1.96 -3.22 1.61 -0.04 -1.26 -4.21 135.00 132.10 1l3n n PRO 62 Ca 0.00 -1.87 -0.16 0.00 -0.04 0.00 0.00 63.50 61.43 1l3n n PRO 62 Cb 0.00 -2.85 0.07 0.00 -0.04 0.00 0.00 33.50 30.68 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 6.24 -1.94 -1.16 0.54 8.25 -1.26 -4.68 115.22 121.20 1l3n n HIS 63 Ca 0.50 0.77 -0.43 0.00 -0.26 0.00 0.00 57.72 58.30 1l3n n HIS 63 Cb 0.32 -4.36 -0.05 0.00 1.12 0.00 0.00 29.99 27.02 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 -3.86 1.91 -1.99 4.41 3.72 -1.26 -4.91 117.46 115.48 1l3n n PHE 64 Ca -0.14 -1.85 -0.34 0.00 -0.05 0.00 0.00 57.45 55.07 1l3n n PHE 64 Cb 0.60 -1.73 0.03 0.00 -0.94 0.00 0.00 39.48 37.44 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 4.91 5.32 0.05 4.37 4.22 -1.26 -4.64 114.94 127.91 1l3n s ASN 65 Ca 0.57 2.16 -0.34 0.00 -2.14 0.00 0.00 52.86 53.10 1l3n s ASN 65 Cb 0.14 -2.57 -0.19 0.00 1.28 0.00 0.00 41.25 39.91 1l3n s ASN 65 CO 0.11 -1.49 1.50 1.55 -2.04 0.00 0.00 177.10 176.73 1l3n h PRO 66 N 0.63 -1.08 -4.54 3.55 0.13 -1.92 -3.21 132.00 125.57 1l3n h PRO 66 Ca -0.49 0.07 -0.65 0.00 -0.87 0.00 0.00 66.00 64.06 1l3n h PRO 66 Cb 1.26 0.24 -0.02 0.00 0.13 0.00 0.00 31.00 32.62 1l3n h PRO 66 CO 0.55 -0.71 2.56 1.47 -0.23 0.00 0.00 178.00 181.64 1l3n n LEU 67 N -5.55 5.38 -4.39 1.56 -0.00 -1.26 -4.94 117.00 107.80 1l3n n LEU 67 Ca -0.15 -3.63 -0.62 0.00 -0.00 0.00 0.00 56.01 51.62 1l3n n LEU 67 Cb 0.45 -1.50 -0.11 0.00 -0.00 0.00 0.00 43.42 42.25 1l3n n LEU 67 CO 0.38 0.25 1.58 -1.20 -0.00 0.00 0.00 177.39 178.40 1l3n n SER 68 N 7.58 0.92 0.00 1.45 7.64 -1.22 -4.83 113.62 125.17 1l3n n SER 68 Ca 0.50 0.81 0.00 0.00 1.01 0.00 0.00 58.87 61.19 1l3n n SER 68 Cb 0.41 -0.91 0.00 0.00 -1.01 0.00 0.00 64.21 62.70 1l3n n SER 68 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1l3n n ARG 69 N 6.61 0.00 -3.77 1.43 3.00 -1.26 -5.15 116.66 117.52 1l3n n ARG 69 Ca 0.48 0.00 -0.11 0.00 -0.01 0.00 0.00 57.85 58.21 1l3n n ARG 69 Cb -0.04 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.35 1l3n n ARG 69 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1l3n s LYS 70 N 0.63 0.82 -0.10 5.56 1.02 -0.50 -5.06 119.74 122.11 1l3n s LYS 70 Ca 0.00 -0.59 -0.29 0.00 0.02 0.00 0.00 55.97 55.11 1l3n s LYS 70 Cb 0.00 0.35 -0.07 0.00 -0.52 0.00 0.00 37.83 37.59 1l3n s LYS 70 CO 0.00 -0.26 2.06 -1.58 -0.92 0.00 0.00 175.35 174.65 1l3n s HIS 71 N -2.80 1.28 0.00 3.18 5.65 -0.90 -2.75 115.29 118.95 1l3n s HIS 71 Ca -0.03 0.05 0.00 0.00 0.25 0.00 0.00 55.06 55.33 1l3n s HIS 71 Cb 0.00 -4.09 0.00 0.00 -1.18 0.00 0.00 32.58 27.31 1l3n s HIS 71 CO -0.05 -4.74 0.00 0.41 -0.65 0.00 0.00 174.74 169.71 1l3n n GLY 72 N 5.10 5.52 0.00 1.59 0.00 -1.26 -2.40 105.19 113.73 1l3n n GLY 72 Ca 0.24 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.41 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 0.08 1.57 0.00 -0.02 0.00 -1.26 -4.72 105.19 100.84 1l3n n GLY 73 Ca 0.00 -0.72 0.01 0.00 0.00 0.00 0.00 46.02 45.32 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 0.04 0.03 1.61 -0.04 -1.25 -0.70 135.00 134.68 1l3n n PRO 74 Ca 0.00 0.22 -0.02 0.00 -0.04 0.00 0.00 63.50 63.66 1l3n n PRO 74 Cb 0.00 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 31.87 1l3n n PRO 74 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1l3n h LYS 75 N 0.00 0.00 -6.15 0.54 1.79 -1.93 -3.47 116.57 107.35 1l3n h LYS 75 Ca 0.00 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 57.95 1l3n h LYS 75 Cb 0.02 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.63 1l3n h LYS 75 CO 0.00 0.36 -0.49 0.34 -1.08 0.00 0.00 179.45 178.58 1l3n s ASP 76 N -5.91 5.96 0.11 0.86 -1.08 0.12 -5.00 116.67 111.73 1l3n s ASP 76 Ca -0.03 -0.02 0.07 0.00 -0.52 0.00 0.00 52.55 52.05 1l3n s ASP 76 Cb 0.08 -1.68 -0.21 0.00 -1.46 0.00 0.00 42.92 39.65 1l3n s ASP 76 CO 0.81 0.00 1.24 -0.08 0.52 0.00 0.00 175.17 177.66 1l3n h GLU 77 N 1.79 0.01 -0.28 4.34 4.81 -1.91 -3.37 114.58 119.96 1l3n h GLU 77 Ca -0.49 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 1l3n h GLU 77 Cb 1.22 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1l3n h GLU 77 CO 0.63 0.98 0.00 0.39 -0.73 0.00 0.00 179.01 180.29 1l3n n GLU 78 N -3.34 1.88 -1.44 1.92 1.02 -1.26 -4.97 120.64 114.45 1l3n n GLU 78 Ca -0.01 -1.34 -0.47 0.00 -0.02 0.00 0.00 57.16 55.31 1l3n n GLU 78 Cb 0.95 -1.37 -0.02 0.00 -0.02 0.00 0.00 31.44 30.97 1l3n n GLU 78 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1l3n n ARG 79 N 0.57 0.31 0.26 3.49 1.85 -1.24 -1.41 116.66 120.50 1l3n n ARG 79 Ca 0.15 0.11 -0.10 0.00 -1.00 0.00 0.00 57.85 57.01 1l3n n ARG 79 Cb 0.36 -1.20 -0.05 0.00 -1.05 0.00 0.00 32.46 30.52 1l3n n ARG 79 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1l3n h HIS 80 N 1.19 -0.62 0.00 2.89 3.86 -1.82 -3.45 115.15 117.21 1l3n h HIS 80 Ca -0.31 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.88 1l3n h HIS 80 Cb 1.42 0.20 0.00 0.00 1.06 0.00 0.00 27.41 30.09 1l3n h HIS 80 CO 0.43 -0.38 0.00 1.55 0.86 0.00 0.00 177.93 180.38 1l3n n VAL 81 N -3.80 0.00 -1.87 2.45 3.14 -1.26 -4.84 118.33 112.15 1l3n n VAL 81 Ca -0.08 0.00 -0.40 0.00 -2.96 0.00 0.00 64.34 60.90 1l3n n VAL 81 Cb 0.26 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 33.03 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 -0.26 5.04 3.37 7.55 0.00 -1.26 -4.79 105.19 114.84 1l3n n GLY 82 Ca 0.00 -1.95 -0.46 0.00 0.00 0.00 0.00 46.02 43.61 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 0.70 6.64 0.32 1.61 1.01 -1.26 -0.51 116.67 125.18 1l3n s ASP 83 Ca 0.57 -2.32 0.07 0.00 0.71 0.00 0.00 52.55 51.58 1l3n s ASP 83 Cb 0.19 -2.28 0.56 0.00 1.01 0.00 0.00 42.92 42.40 1l3n s ASP 83 CO -0.09 -0.80 1.78 -0.07 0.21 0.00 0.00 175.17 176.21 1l3n h LEU 84 N 8.88 0.30 0.00 1.23 -0.00 -1.80 -3.34 115.31 120.59 1l3n h LEU 84 Ca 0.06 -0.09 0.00 0.00 -0.00 0.00 0.00 57.88 57.85 1l3n h LEU 84 Cb 1.04 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 41.62 1l3n h LEU 84 CO 0.91 0.57 0.00 0.61 -0.00 0.00 0.00 178.44 180.53 1l3n n GLY 85 N -0.48 2.13 3.26 0.83 0.00 -1.23 -4.39 105.19 105.32 1l3n n GLY 85 Ca -0.01 -0.70 -0.12 0.00 0.00 0.00 0.00 46.02 45.19 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 -0.44 -0.14 1.61 0.01 -1.26 -4.23 114.94 106.49 1l3n s ASN 86 Ca 0.00 0.80 -0.04 0.00 -0.71 0.00 0.00 52.86 52.91 1l3n s ASN 86 Cb 0.00 0.76 -0.03 0.00 0.41 0.00 0.00 41.25 42.39 1l3n s ASN 86 CO 0.00 -0.16 0.00 0.68 -1.51 0.00 0.00 177.10 176.11 1l3n s VAL 87 N 0.70 4.27 -0.04 1.60 -7.23 -0.40 -4.86 120.40 114.44 1l3n s VAL 87 Ca -0.04 -0.23 -0.22 0.00 -1.81 0.00 0.00 61.98 59.67 1l3n s VAL 87 Cb -0.05 -2.86 -0.04 0.00 0.56 0.00 0.00 36.38 33.98 1l3n s VAL 87 CO -0.05 0.52 0.65 0.28 -0.31 0.00 0.00 175.10 176.20 1l3n s THR 88 N -0.03 4.99 -0.12 5.32 -1.32 -1.26 -0.16 115.64 123.06 1l3n s THR 88 Ca 0.03 1.36 -0.03 0.00 -1.21 0.00 0.00 61.69 61.84 1l3n s THR 88 Cb -0.13 -3.99 -0.03 0.00 -1.51 0.00 0.00 72.50 66.84 1l3n s THR 88 CO 0.02 0.32 -0.00 0.00 -2.21 0.00 0.00 174.62 172.74 1l3n s ALA 89 N 0.43 3.22 1.26 11.08 0.00 0.49 -3.91 121.76 134.34 1l3n s ALA 89 Ca 0.35 -0.80 -0.16 0.00 0.00 0.00 0.00 51.96 51.35 1l3n s ALA 89 Cb -0.18 -1.56 0.32 0.00 0.00 0.00 0.00 23.12 21.70 1l3n s ALA 89 CO 0.17 0.43 0.94 -0.25 0.00 0.00 0.00 175.76 177.06 1l3n n ASP 90 N 2.71 -2.45 -0.35 0.00 8.00 0.34 -0.98 116.55 123.83 1l3n n ASP 90 Ca -0.18 -0.36 0.27 0.00 0.71 0.00 0.00 54.79 55.23 1l3n n ASP 90 Cb 0.53 -1.18 0.56 0.00 -0.02 0.00 0.00 41.12 41.01 1l3n n ASP 90 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 1l3n h LYS 91 N -2.95 0.29 0.00 -1.24 2.10 -1.93 0.15 116.57 112.99 1l3n h LYS 91 Ca -0.58 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.05 1l3n h LYS 91 Cb 1.34 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 1l3n h LYS 91 CO 0.44 0.19 0.00 -0.25 -2.00 0.00 0.00 179.45 177.83 1l3n n ASP 92 N -4.61 0.00 0.00 7.07 8.00 -1.26 -4.54 116.55 121.21 1l3n n ASP 92 Ca 0.28 -0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.68 1l3n n ASP 92 Cb 1.02 -0.30 0.00 0.00 -0.02 0.00 0.00 41.12 41.83 1l3n n ASP 92 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1l3n n GLY 93 N 1.26 0.79 3.59 0.44 0.00 0.54 -3.63 105.19 108.17 1l3n n GLY 93 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 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 -3.01 4.08 -0.25 1.61 1.01 -1.26 -3.28 120.40 119.31 1l3n s VAL 94 Ca 0.00 1.03 -0.08 0.00 0.00 0.00 0.00 61.98 62.93 1l3n s VAL 94 Cb 0.00 -4.65 -0.03 0.00 0.00 0.00 0.00 36.38 31.70 1l3n s VAL 94 CO 0.00 -1.18 0.08 0.00 0.00 0.00 0.00 175.10 174.00 1l3n s ALA 95 N 4.82 3.21 -0.36 5.51 0.00 -1.22 -0.50 121.76 133.22 1l3n s ALA 95 Ca 0.46 -1.09 -0.29 0.00 0.00 0.00 0.00 51.96 51.04 1l3n s ALA 95 Cb -0.08 -2.10 0.02 0.00 0.00 0.00 0.00 23.12 20.96 1l3n s ALA 95 CO 0.28 -0.43 1.10 0.16 0.00 0.00 0.00 175.76 176.87 1l3n s ASP 96 N 1.51 6.85 -0.16 0.00 -4.77 -1.25 -2.38 116.67 116.46 1l3n s ASP 96 Ca 0.06 0.91 -0.08 0.00 -3.30 0.00 0.00 52.55 50.15 1l3n s ASP 96 Cb -0.15 -2.54 -0.04 0.00 -1.09 0.00 0.00 42.92 39.09 1l3n s ASP 96 CO 0.04 -0.98 0.11 -0.69 0.70 0.00 0.00 175.17 174.35 1l3n s VAL 97 N 3.89 5.20 -0.44 2.11 1.01 0.25 -4.74 120.40 127.68 1l3n s VAL 97 Ca 0.47 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.62 1l3n s VAL 97 Cb -0.11 -3.32 0.33 0.00 0.00 0.00 0.00 36.38 33.28 1l3n s VAL 97 CO 0.20 0.51 1.11 -1.20 0.00 0.00 0.00 175.10 175.72 1l3n n SER 98 N 2.95 -1.99 -4.83 3.32 7.64 -1.24 -0.48 113.62 118.99 1l3n n SER 98 Ca -0.18 -3.51 -0.27 0.00 1.01 0.00 0.00 58.87 55.92 1l3n n SER 98 Cb 0.53 1.60 -0.05 0.00 -1.01 0.00 0.00 64.21 65.28 1l3n n SER 98 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1l3n s ILE 99 N -0.01 4.72 -0.04 0.44 1.09 -0.14 -4.90 121.20 122.35 1l3n s ILE 99 Ca 0.24 -0.90 0.06 0.00 -1.10 0.00 0.00 60.65 58.95 1l3n s ILE 99 Cb 0.31 -3.38 -0.01 0.00 -1.06 0.00 0.00 42.46 38.32 1l3n s ILE 99 CO -0.06 -0.04 -0.21 -1.83 -0.10 0.00 0.00 174.94 172.70 1l3n s GLU 100 N -2.95 2.08 0.03 2.79 1.03 -1.26 0.10 118.70 120.52 1l3n s GLU 100 Ca 0.32 -0.76 -0.06 0.00 0.03 0.00 0.00 54.97 54.50 1l3n s GLU 100 Cb -0.11 -1.82 -0.01 0.00 -0.80 0.00 0.00 34.13 31.39 1l3n s GLU 100 CO 0.24 0.34 0.10 0.34 -1.33 0.00 0.00 175.26 174.96 1l3n s ASP 101 N -0.15 0.14 -0.08 0.83 -1.08 -0.66 -4.97 116.67 110.69 1l3n s ASP 101 Ca -0.01 -0.45 0.12 0.00 -0.52 0.00 0.00 52.55 51.69 1l3n s ASP 101 Cb -0.12 0.21 -0.17 0.00 -1.46 0.00 0.00 42.92 41.39 1l3n s ASP 101 CO 0.02 -0.46 0.13 -1.54 0.52 0.00 0.00 175.17 173.84 1l3n n SER 102 N 1.00 1.99 0.02 -0.34 3.41 -1.26 -0.02 113.62 118.41 1l3n n SER 102 Ca -0.20 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.23 1l3n n SER 102 Cb 0.57 1.08 -0.13 0.00 -0.26 0.00 0.00 64.21 65.48 1l3n n SER 102 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1l3n h VAL 103 N 0.00 1.50 -3.46 -3.33 3.04 -1.98 -3.41 116.25 108.61 1l3n h VAL 103 Ca -0.21 -2.28 -0.52 0.00 -1.01 0.00 0.00 66.70 62.67 1l3n h VAL 103 Cb 1.35 2.93 0.01 0.00 -2.01 0.00 0.00 31.29 33.57 1l3n h VAL 103 CO 0.01 0.65 0.54 -0.63 -1.01 0.00 0.00 177.57 177.12 1l3n s ILE 104 N -2.80 3.72 -0.01 3.17 1.09 -1.26 -4.92 121.20 120.20 1l3n s ILE 104 Ca -0.14 1.42 -0.28 0.00 -1.10 0.00 0.00 60.65 60.55 1l3n s ILE 104 Cb 0.02 -3.91 0.10 0.00 -1.06 0.00 0.00 42.46 37.61 1l3n s ILE 104 CO 0.81 0.21 0.86 -0.44 -0.10 0.00 0.00 174.94 176.28 1l3n s SER 105 N 0.21 -0.40 0.08 3.58 0.01 -1.26 -4.40 113.70 111.52 1l3n s SER 105 Ca 0.53 0.07 -0.24 0.00 1.31 0.00 0.00 55.95 57.62 1l3n s SER 105 Cb -0.31 0.41 -0.16 0.00 0.21 0.00 0.00 66.02 66.17 1l3n s SER 105 CO 0.35 -0.63 1.70 -0.07 0.41 0.00 0.00 173.24 175.00 1l3n h LEU 106 N 2.10 -0.09 0.00 2.44 3.38 -1.95 -2.68 115.31 118.52 1l3n h LEU 106 Ca -0.23 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1l3n h LEU 106 Cb 1.24 0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1l3n h LEU 106 CO 0.32 -0.03 0.00 -0.24 0.09 0.00 0.00 178.44 178.58 1l3n n SER 107 N -5.12 1.99 -0.17 -0.43 2.88 -1.26 -2.92 113.62 108.60 1l3n n SER 107 Ca -0.08 -0.56 0.00 0.00 -1.33 0.00 0.00 58.87 56.90 1l3n n SER 107 Cb 0.08 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.54 1l3n n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1l3n n GLY 108 N 4.97 0.85 5.00 0.46 0.00 -1.26 -3.89 105.19 111.32 1l3n n GLY 108 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.15 0.00 0.00 1.61 -0.08 -1.26 -4.20 116.55 112.47 1l3n n ASP 109 Ca 0.00 0.00 -0.18 0.00 -1.51 0.00 0.00 54.79 53.10 1l3n n ASP 109 Cb 0.06 0.00 -0.08 0.00 2.34 0.00 0.00 41.12 43.43 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 1.07 -6.43 -0.67 -0.00 -1.92 -3.48 115.15 103.72 1l3n h HIS 110 Ca 0.00 -0.51 -0.20 0.00 -0.00 0.00 0.00 60.37 59.66 1l3n h HIS 110 Cb 0.00 -0.15 0.01 0.00 -0.00 0.00 0.00 27.41 27.27 1l3n h HIS 110 CO 0.00 1.35 -1.10 0.45 -0.00 0.00 0.00 177.93 178.62 1l3n n SER 111 N -3.91 -5.97 0.30 2.45 2.88 -1.25 -4.82 113.62 103.31 1l3n n SER 111 Ca -0.09 0.12 0.19 0.00 -1.33 0.00 0.00 58.87 57.76 1l3n n SER 111 Cb 0.80 -1.57 1.02 0.00 -0.75 0.00 0.00 64.21 63.71 1l3n n SER 111 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 1l3n h ILE 112 N 2.83 0.25 -1.65 2.46 3.07 -1.34 -3.43 117.51 119.69 1l3n h ILE 112 Ca -0.28 0.00 -0.68 0.00 1.55 0.00 0.00 64.86 65.44 1l3n h ILE 112 Cb 1.20 0.93 0.06 0.00 -0.27 0.00 0.00 36.82 38.74 1l3n h ILE 112 CO 0.11 0.00 0.36 -0.38 -1.05 0.00 0.00 178.15 177.19 1l3n n ILE 113 N -3.44 0.22 -0.62 0.16 2.08 -1.23 -1.75 119.36 114.79 1l3n n ILE 113 Ca -0.02 -0.06 0.00 0.00 0.56 0.00 0.00 62.75 63.23 1l3n n ILE 113 Cb 0.15 -0.73 0.00 0.00 -0.75 0.00 0.00 39.64 38.32 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 2.30 0.79 3.89 7.39 0.00 -1.26 -5.06 105.19 113.24 1l3n n GLY 114 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.38 2.68 -0.19 1.61 1.81 -0.72 -3.32 118.95 120.45 1l3n s ARG 115 Ca 0.00 0.29 -0.09 0.00 -1.72 0.00 0.00 55.73 54.20 1l3n s ARG 115 Cb 0.00 -2.06 -0.05 0.00 -0.45 0.00 0.00 34.95 32.39 1l3n s ARG 115 CO 0.00 -1.08 0.12 0.99 -0.68 0.00 0.00 175.30 174.64 1l3n s THR 116 N -3.33 5.30 0.08 0.02 2.01 -1.15 -3.18 115.64 115.40 1l3n s THR 116 Ca 0.58 0.15 0.05 0.00 0.31 0.00 0.00 61.69 62.78 1l3n s THR 116 Cb -0.11 -3.41 -0.04 0.00 0.01 0.00 0.00 72.50 68.95 1l3n s THR 116 CO 0.50 0.45 0.00 -0.76 -0.69 0.00 0.00 174.62 174.12 1l3n s LEU 117 N 0.29 3.47 -0.01 4.42 1.02 0.11 -0.29 118.68 127.70 1l3n s LEU 117 Ca 0.07 -0.16 0.01 0.00 0.02 0.00 0.00 54.13 54.08 1l3n s LEU 117 Cb -0.11 -2.19 0.00 0.00 0.02 0.00 0.00 46.19 43.91 1l3n s LEU 117 CO -0.01 0.18 -0.04 -0.69 0.02 0.00 0.00 176.35 175.81 1l3n s VAL 118 N -1.30 0.40 -0.09 -1.59 1.01 0.05 -0.82 120.40 118.06 1l3n s VAL 118 Ca 0.25 -0.17 -0.01 0.00 0.00 0.00 0.00 61.98 62.05 1l3n s VAL 118 Cb -0.12 -0.37 -0.03 0.00 0.00 0.00 0.00 36.38 35.86 1l3n s VAL 118 CO 0.18 0.14 -0.02 0.54 0.00 0.00 0.00 175.10 175.93 1l3n s VAL 119 N 0.18 4.09 0.29 2.92 0.11 -0.37 -1.34 120.40 126.28 1l3n s VAL 119 Ca -0.02 -0.33 0.10 0.00 -2.93 0.00 0.00 61.98 58.81 1l3n s VAL 119 Cb -0.05 -2.71 -0.05 0.00 -1.53 0.00 0.00 36.38 32.03 1l3n s VAL 119 CO -0.00 0.59 -0.07 -1.00 -3.33 0.00 0.00 175.10 171.29 1l3n s HIS 120 N -0.70 2.52 0.19 1.54 3.76 -0.45 -3.12 115.29 119.02 1l3n s HIS 120 Ca 0.11 -0.31 -0.22 0.00 -0.15 0.00 0.00 55.06 54.49 1l3n s HIS 120 Cb -0.12 -1.19 0.12 0.00 1.11 0.00 0.00 32.58 32.50 1l3n s HIS 120 CO 0.02 0.62 1.57 1.49 -0.85 0.00 0.00 174.74 177.59 1l3n h GLU 121 N 2.00 -0.12 -5.28 1.40 4.81 -0.88 -3.26 114.58 113.26 1l3n h GLU 121 Ca -0.42 0.01 -0.59 0.00 -0.13 0.00 0.00 59.36 58.22 1l3n h GLU 121 Cb 1.25 0.03 -0.13 0.00 0.63 0.00 0.00 28.75 30.53 1l3n h GLU 121 CO 0.62 -0.08 -0.56 0.15 -0.73 0.00 0.00 179.01 178.41 1l3n s LYS 122 N -5.89 1.95 0.49 1.92 1.02 0.62 -4.87 119.74 114.99 1l3n s LYS 122 Ca -0.14 -2.17 -0.21 0.00 0.02 0.00 0.00 55.97 53.47 1l3n s LYS 122 Cb 0.16 -1.19 -0.07 0.00 -0.52 0.00 0.00 37.83 36.21 1l3n s LYS 122 CO 0.68 -0.28 1.09 0.00 -0.92 0.00 0.00 175.35 175.93 1l3n s ALA 123 N -3.01 2.85 0.39 5.17 0.00 -1.15 -0.24 121.76 125.78 1l3n s ALA 123 Ca 0.24 0.75 -0.23 0.00 0.00 0.00 0.00 51.96 52.72 1l3n s ALA 123 Cb 0.05 -3.32 -0.10 0.00 0.00 0.00 0.00 23.12 19.76 1l3n s ALA 123 CO 0.12 -0.52 0.98 -0.51 0.00 0.00 0.00 175.76 175.83 1l3n s ASP 124 N -1.75 6.98 0.21 0.00 1.11 -1.26 -3.90 116.67 118.07 1l3n s ASP 124 Ca 0.67 1.83 0.09 0.00 0.18 0.00 0.00 52.55 55.32 1l3n s ASP 124 Cb -0.22 -2.56 0.12 0.00 1.07 0.00 0.00 42.92 41.33 1l3n s ASP 124 CO 0.26 -0.33 1.47 0.44 1.18 0.00 0.00 175.17 178.19 1l3n h ASP 125 N 2.42 0.02 -5.78 0.27 3.32 -0.89 -3.48 116.42 112.30 1l3n h ASP 125 Ca -0.48 -0.02 -0.35 0.00 0.02 0.00 0.00 57.03 56.20 1l3n h ASP 125 Cb 1.19 -0.01 0.14 0.00 0.22 0.00 0.00 39.33 40.87 1l3n h ASP 125 CO 0.62 0.79 -0.82 0.18 -1.72 0.00 0.00 179.24 178.29 1l3n n LEU 126 N -3.63 -4.00 0.00 1.55 4.77 -1.26 -2.96 117.00 111.47 1l3n n LEU 126 Ca -0.01 -0.73 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 1l3n n LEU 126 Cb 0.75 -2.95 0.00 0.00 -2.33 0.00 0.00 43.42 38.88 1l3n n LEU 126 CO 0.44 0.34 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 1l3n n GLY 127 N -1.32 3.00 0.00 -0.72 0.00 -1.01 -4.61 105.19 100.52 1l3n n GLY 127 Ca -0.24 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.06 0.76 0.17 1.61 5.02 -1.16 -2.57 118.16 120.93 1l3n n LYS 128 Ca 0.00 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 1l3n n LYS 128 Cb 0.00 -1.17 0.47 0.00 -0.02 0.00 0.00 35.03 34.31 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 4.27 0.00 -6.41 0.72 0.00 -1.88 -3.48 103.07 96.29 1l3n h GLY 129 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.84 1l3n h GLY 129 CO 0.00 0.00 -0.81 0.61 0.00 0.00 0.00 176.54 176.34 1l3n n GLY 130 N 0.48 -0.39 3.31 4.60 0.00 -1.06 -4.87 105.19 107.25 1l3n n GLY 130 Ca 0.03 0.16 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.70 1.89 0.15 1.61 0.01 -1.26 -4.96 114.94 108.68 1l3n s ASN 131 Ca 0.44 -1.14 -0.18 0.00 -0.71 0.00 0.00 52.86 51.27 1l3n s ASN 131 Cb -0.23 -0.01 0.06 0.00 0.41 0.00 0.00 41.25 41.48 1l3n s ASN 131 CO 0.86 -0.43 1.69 -0.08 -1.51 0.00 0.00 177.10 177.64 1l3n h GLU 132 N 2.57 0.04 -0.65 -0.60 4.81 -1.98 -0.34 114.58 118.44 1l3n h GLU 132 Ca -0.38 -0.00 0.05 0.00 -0.13 0.00 0.00 59.36 58.91 1l3n h GLU 132 Cb 1.21 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.53 1l3n h GLU 132 CO 0.64 0.03 0.36 1.49 -0.73 0.00 0.00 179.01 180.80 1l3n h GLU 133 N 0.04 0.65 -0.70 1.92 4.57 -1.97 -1.72 114.58 117.37 1l3n h GLU 133 Ca 0.16 -0.04 0.07 0.00 -1.18 0.00 0.00 59.36 58.37 1l3n h GLU 133 Cb 0.23 -0.15 -0.06 0.00 -0.16 0.00 0.00 28.75 28.62 1l3n h GLU 133 CO -0.30 0.43 0.39 0.66 -1.18 0.00 0.00 179.01 179.01 1l3n h SER 134 N 0.67 0.57 -0.02 1.04 4.64 -1.45 0.33 113.55 119.33 1l3n h SER 134 Ca 0.29 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1l3n h SER 134 Cb 0.17 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1l3n h SER 134 CO -0.17 0.36 0.00 1.07 -0.87 0.00 0.00 176.83 177.21 1l3n n THR 135 N -4.78 0.02 0.00 2.95 5.66 -0.30 -2.29 114.28 115.54 1l3n n THR 135 Ca 0.10 -0.07 0.00 0.00 -3.05 0.00 0.00 64.05 61.03 1l3n n THR 135 Cb 0.20 -0.21 0.00 0.00 -1.55 0.00 0.00 70.33 68.77 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 -0.63 0.00 -0.48 1.09 5.02 0.11 -2.11 118.16 121.15 1l3n n LYS 136 Ca 0.19 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.55 1l3n n LYS 136 Cb 0.14 -0.09 0.18 0.00 -0.02 0.00 0.00 35.03 35.25 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 -1.75 2.01 -2.19 -0.18 -2.24 0.94 -4.61 114.28 106.27 1l3n n THR 137 Ca 0.00 -2.85 -0.19 0.00 -2.27 0.00 0.00 64.05 58.74 1l3n n THR 137 Cb 0.00 -0.19 -0.02 0.00 -2.10 0.00 0.00 70.33 68.02 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 -1.14 0.04 2.47 3.38 0.00 -0.27 -1.37 105.19 108.31 1l3n n GLY 138 Ca 0.17 -0.10 -0.08 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.47 -2.90 0.00 1.61 3.02 -1.24 -0.18 115.26 114.10 1l3n n ASN 139 Ca -0.22 0.29 0.05 0.00 -0.03 0.00 0.00 54.58 54.68 1l3n n ASN 139 Cb 0.66 -2.52 0.28 0.00 -0.61 0.00 0.00 39.78 37.59 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 -2.33 1.69 0.00 5.41 0.00 -0.47 -4.76 120.51 120.05 1l3n n ALA 140 Ca -0.09 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1l3n n ALA 140 Cb 0.57 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.85 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 -0.36 -1.08 3.73 0.00 0.00 -1.26 -0.27 105.19 105.95 1l3n n GLY 141 Ca 0.05 -1.29 -0.42 0.00 0.00 0.00 0.00 46.02 44.36 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 0.36 3.97 -3.48 1.61 7.64 -1.26 -4.63 113.62 117.83 1l3n n SER 142 Ca 0.00 1.09 -0.38 0.00 1.01 0.00 0.00 58.87 60.60 1l3n n SER 142 Cb 0.00 -1.59 -0.07 0.00 -1.01 0.00 0.00 64.21 61.55 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 3.28 0.98 0.27 1.43 3.00 -1.26 -0.76 116.66 123.60 1l3n n ARG 143 Ca 0.13 -1.42 0.11 0.00 -0.01 0.00 0.00 57.85 56.66 1l3n n ARG 143 Cb 0.36 -2.66 0.76 0.00 0.00 0.00 0.00 32.46 30.92 1l3n n ARG 143 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.63 179.00 1l3n h LEU 144 N 14.15 0.00 -7.29 0.55 8.10 -1.88 -3.43 115.31 125.51 1l3n h LEU 144 Ca 0.34 0.00 -0.10 0.00 0.11 0.00 0.00 57.88 58.24 1l3n h LEU 144 Cb 0.56 0.00 -0.21 0.00 -0.44 0.00 0.00 40.66 40.57 1l3n h LEU 144 CO 1.85 0.03 -0.13 0.00 -4.11 0.00 0.00 178.44 176.08 1l3n s ALA 145 N -4.76 -1.16 0.15 0.17 0.00 -1.18 -3.37 121.76 111.60 1l3n s ALA 145 Ca -0.05 0.96 -0.24 0.00 0.00 0.00 0.00 51.96 52.64 1l3n s ALA 145 Cb 0.16 -0.30 0.06 0.00 0.00 0.00 0.00 23.12 23.04 1l3n s ALA 145 CO 0.61 -0.27 0.74 0.00 0.00 0.00 0.00 175.76 176.84 1l3n s GLY 147 N -2.76 0.38 0.09 0.00 0.00 -0.00 -1.06 107.32 103.98 1l3n s GLY 147 Ca 0.06 -0.75 0.09 0.00 0.00 0.00 0.00 44.72 44.12 1l3n s GLY 147 CO -0.05 -0.02 -0.23 0.14 0.00 0.00 0.00 173.10 172.93 1l3n s VAL 148 N -2.16 1.91 0.00 1.40 1.01 -1.26 -0.71 120.40 120.60 1l3n s VAL 148 Ca 0.17 -1.51 0.00 0.00 0.00 0.00 0.00 61.98 60.64 1l3n s VAL 148 Cb -0.05 -1.69 0.00 0.00 0.00 0.00 0.00 36.38 34.64 1l3n s VAL 148 CO 0.11 0.10 0.08 -0.38 0.00 0.00 0.00 175.10 175.01 1l3n n ILE 149 N 1.30 0.00 0.00 2.22 5.41 -1.19 -3.84 119.36 123.26 1l3n n ILE 149 Ca -0.18 0.44 0.00 0.00 1.00 0.00 0.00 62.75 64.00 1l3n n ILE 149 Cb 0.53 -1.15 0.00 0.00 -0.71 0.00 0.00 39.64 38.31 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 0.76 0.05 3.80 7.39 0.00 -1.24 -3.56 105.19 112.39 1l3n n GLY 150 Ca 0.00 -1.33 -0.34 0.00 0.00 0.00 0.00 46.02 44.35 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 -0.90 3.97 -0.11 -0.61 1.01 -1.26 -0.78 121.20 122.51 1l3n s ILE 151 Ca 0.00 1.20 -0.03 0.00 0.00 0.00 0.00 60.65 61.82 1l3n s ILE 151 Cb 0.00 -3.49 -0.06 0.00 0.01 0.00 0.00 42.46 38.92 1l3n s ILE 151 CO 0.00 -0.29 -0.12 0.00 0.00 0.00 0.00 174.94 174.53 1l3n n ALA 152 N -0.97 2.06 0.34 9.38 0.00 -0.09 -4.73 120.51 126.51 1l3n n ALA 152 Ca 0.09 -0.44 0.04 0.00 0.00 0.00 0.00 53.44 53.13 1l3n n ALA 152 Cb 0.53 0.32 0.03 0.00 0.00 0.00 0.00 19.45 20.33 1l3n n ALA 152 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44