#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 0.85 -4.16 0.00 5.66 -1.26 -4.59 114.28 110.78 1l3n n THR 2 Ca 0.00 0.26 -0.14 0.00 -3.05 0.00 0.00 64.05 61.12 1l3n n THR 2 Cb 0.00 -1.18 -0.11 0.00 -1.55 0.00 0.00 70.33 67.49 1l3n n THR 2 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 1l3n s LYS 3 N -3.31 0.81 0.08 1.09 -2.85 -1.26 0.04 119.74 114.34 1l3n s LYS 3 Ca 0.04 -1.13 -0.11 0.00 -1.00 0.00 0.00 55.97 53.77 1l3n s LYS 3 Cb 0.09 -0.47 0.01 0.00 -2.06 0.00 0.00 37.83 35.40 1l3n s LYS 3 CO 0.37 0.07 0.26 0.00 0.10 0.00 0.00 175.35 176.15 1l3n s ALA 4 N -2.43 -0.49 0.15 0.59 0.00 0.34 -3.78 121.76 116.14 1l3n s ALA 4 Ca 0.04 -0.32 0.10 0.00 0.00 0.00 0.00 51.96 51.79 1l3n s ALA 4 Cb -0.03 0.47 -0.04 0.00 0.00 0.00 0.00 23.12 23.52 1l3n s ALA 4 CO -0.00 -0.50 -0.23 0.08 0.00 0.00 0.00 175.76 175.11 1l3n s VAL 5 N -3.40 2.09 -0.36 0.00 1.01 -1.21 -0.40 120.40 118.14 1l3n s VAL 5 Ca 0.01 -1.85 0.01 0.00 0.00 0.00 0.00 61.98 60.16 1l3n s VAL 5 Cb 0.02 -1.93 0.11 0.00 0.00 0.00 0.00 36.38 34.59 1l3n s VAL 5 CO -0.09 -0.10 0.13 0.00 0.00 0.00 0.00 175.10 175.04 1l3n s ALA 6 N -1.51 2.11 -0.49 5.51 0.00 0.58 -3.08 121.76 124.88 1l3n s ALA 6 Ca 0.15 -2.18 -0.29 0.00 0.00 0.00 0.00 51.96 49.64 1l3n s ALA 6 Cb -0.08 -1.80 0.03 0.00 0.00 0.00 0.00 23.12 21.27 1l3n s ALA 6 CO 0.07 -1.78 1.17 0.14 0.00 0.00 0.00 175.76 175.36 1l3n s VAL 7 N 1.06 4.14 0.06 0.00 -7.23 -1.26 -1.00 120.40 116.16 1l3n s VAL 7 Ca 0.12 1.14 -0.18 0.00 -1.81 0.00 0.00 61.98 61.25 1l3n s VAL 7 Cb -0.20 -4.60 -0.06 0.00 0.56 0.00 0.00 36.38 32.07 1l3n s VAL 7 CO -0.14 -1.06 0.54 -0.76 -0.31 0.00 0.00 175.10 173.37 1l3n s LEU 8 N 4.64 4.52 0.12 1.32 1.43 0.40 -4.06 118.68 127.05 1l3n s LEU 8 Ca 0.48 1.20 -0.24 0.00 -1.03 0.00 0.00 54.13 54.54 1l3n s LEU 8 Cb -0.08 -2.83 0.07 0.00 0.03 0.00 0.00 46.19 43.38 1l3n s LEU 8 CO 0.31 0.28 0.70 -0.75 0.23 0.00 0.00 176.35 177.12 1l3n s LYS 9 N -1.08 1.19 0.07 1.70 2.20 0.48 -0.56 119.74 123.74 1l3n s LYS 9 Ca 0.28 -0.47 0.00 0.00 -0.36 0.00 0.00 55.97 55.42 1l3n s LYS 9 Cb -0.19 0.53 0.00 0.00 -1.51 0.00 0.00 37.83 36.66 1l3n s LYS 9 CO 0.18 -0.52 0.00 0.41 -0.36 0.00 0.00 175.35 175.05 1l3n n GLY 10 N -0.35 -0.75 0.10 5.54 0.00 -1.25 -0.82 105.19 107.66 1l3n n GLY 10 Ca -0.13 0.19 -0.15 0.00 0.00 0.00 0.00 46.02 45.93 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 0.25 0.00 1.61 5.19 -1.79 -3.49 116.42 118.19 1l3n h ASP 11 Ca 0.00 -0.77 0.00 0.00 -0.62 0.00 0.00 57.03 55.64 1l3n h ASP 11 Cb 0.00 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.43 1l3n h ASP 11 CO 0.00 0.99 0.00 0.61 -3.12 0.00 0.00 179.24 177.72 1l3n n GLY 12 N 1.04 2.89 0.29 2.75 0.00 -1.26 -4.89 105.19 106.00 1l3n n GLY 12 Ca -0.10 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.32 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 0.59 -6.55 1.61 0.13 -1.93 -3.39 132.00 122.46 1l3n h PRO 13 Ca 0.00 -0.11 -0.57 0.00 -0.87 0.00 0.00 66.00 64.46 1l3n h PRO 13 Cb 0.00 -0.10 -0.05 0.00 0.13 0.00 0.00 31.00 30.98 1l3n h PRO 13 CO 0.00 0.56 1.05 0.08 -0.23 0.00 0.00 178.00 179.46 1l3n s VAL 14 N -5.13 3.94 -0.05 1.56 1.01 -1.26 -3.92 120.40 116.56 1l3n s VAL 14 Ca -0.08 0.96 0.01 0.00 0.00 0.00 0.00 61.98 62.87 1l3n s VAL 14 Cb 0.16 -4.25 0.02 0.00 0.00 0.00 0.00 36.38 32.31 1l3n s VAL 14 CO 0.77 -0.79 -0.06 0.00 0.00 0.00 0.00 175.10 175.02 1l3n s GLN 15 N 4.88 1.01 0.03 2.72 0.00 0.26 -3.89 119.66 124.67 1l3n s GLN 15 Ca 0.60 -0.17 0.01 0.00 -0.00 0.00 0.00 55.36 55.80 1l3n s GLN 15 Cb -0.13 -0.95 -0.04 0.00 0.00 0.00 0.00 33.01 31.89 1l3n s GLN 15 CO 0.32 -0.06 0.06 0.20 0.00 0.00 0.00 175.29 175.81 1l3n s GLY 16 N 0.86 1.98 -0.37 2.60 0.00 0.28 -0.98 107.32 111.69 1l3n s GLY 16 Ca -0.12 -0.95 0.12 0.00 0.00 0.00 0.00 44.72 43.77 1l3n s GLY 16 CO 0.01 -0.87 0.75 1.39 0.00 0.00 0.00 173.10 174.38 1l3n n ILE 17 N 0.94 -0.13 -2.70 0.90 5.41 -0.36 -0.45 119.36 122.97 1l3n n ILE 17 Ca -0.12 -4.42 -0.40 0.00 1.00 0.00 0.00 62.75 58.82 1l3n n ILE 17 Cb 0.52 -0.16 -0.06 0.00 -0.71 0.00 0.00 39.64 39.24 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 -2.34 3.97 -0.28 1.39 -1.09 -0.17 -4.19 121.20 118.49 1l3n s ILE 18 Ca 0.39 1.96 -0.00 0.00 -2.23 0.00 0.00 60.65 60.77 1l3n s ILE 18 Cb 0.35 -4.24 0.05 0.00 -1.58 0.00 0.00 42.46 37.04 1l3n s ILE 18 CO -0.08 0.45 -0.05 0.20 -1.23 0.00 0.00 174.94 174.24 1l3n s ASN 19 N -1.15 4.67 -0.43 3.58 0.01 0.81 -0.31 114.94 122.12 1l3n s ASN 19 Ca 0.42 -1.27 -0.19 0.00 -0.71 0.00 0.00 52.86 51.11 1l3n s ASN 19 Cb -0.27 -1.65 0.02 0.00 0.41 0.00 0.00 41.25 39.77 1l3n s ASN 19 CO 0.33 -0.22 0.54 -0.36 -1.51 0.00 0.00 177.10 175.88 1l3n s PHE 20 N 1.21 3.12 0.38 2.20 0.40 0.47 -1.24 117.98 124.51 1l3n s PHE 20 Ca -0.06 -0.25 -0.03 0.00 -0.60 0.00 0.00 56.93 55.99 1l3n s PHE 20 Cb -0.20 -3.13 -0.04 0.00 0.51 0.00 0.00 43.02 40.16 1l3n s PHE 20 CO -0.03 -0.80 0.63 -1.21 0.70 0.00 0.00 175.22 174.51 1l3n s GLU 21 N 2.46 3.54 -0.46 0.44 2.02 -0.93 -0.50 118.70 125.27 1l3n s GLU 21 Ca 0.17 -0.08 0.06 0.00 0.02 0.00 0.00 54.97 55.15 1l3n s GLU 21 Cb -0.16 -2.56 0.18 0.00 0.10 0.00 0.00 34.13 31.69 1l3n s GLU 21 CO 0.16 0.05 0.61 -1.14 0.02 0.00 0.00 175.26 174.96 1l3n s GLN 22 N -4.26 0.95 0.13 1.61 0.74 0.11 -3.43 119.66 115.50 1l3n s GLN 22 Ca 0.43 -1.04 -0.27 0.00 0.05 0.00 0.00 55.36 54.53 1l3n s GLN 22 Cb -0.10 -0.30 -0.05 0.00 1.10 0.00 0.00 33.01 33.66 1l3n s GLN 22 CO 0.37 -1.30 1.61 0.87 -0.55 0.00 0.00 175.29 176.29 1l3n h LYS 23 N 5.74 -0.46 -5.57 1.67 1.79 -1.86 -3.40 116.57 114.48 1l3n h LYS 23 Ca 0.09 0.03 -0.55 0.00 -2.18 0.00 0.00 60.65 58.04 1l3n h LYS 23 Cb 1.09 0.10 -0.14 0.00 -1.58 0.00 0.00 32.23 31.71 1l3n h LYS 23 CO 0.10 -0.31 -0.64 -2.00 -1.08 0.00 0.00 179.45 175.53 1l3n s GLU 24 N -5.98 1.73 0.25 3.15 -6.30 -1.26 -4.94 118.70 105.35 1l3n s GLU 24 Ca -0.16 -1.93 0.24 0.00 -2.50 0.00 0.00 54.97 50.63 1l3n s GLU 24 Cb 0.09 -1.33 0.95 0.00 0.00 0.00 0.00 34.13 33.85 1l3n s GLU 24 CO 0.65 -0.01 1.72 0.45 0.02 0.00 0.00 175.26 178.09 1l3n n SER 25 N -0.74 0.68 0.16 -1.70 2.88 -1.26 -0.76 113.62 112.87 1l3n n SER 25 Ca -0.05 0.65 0.13 0.00 -1.33 0.00 0.00 58.87 58.27 1l3n n SER 25 Cb 0.65 -0.80 0.31 0.00 -0.75 0.00 0.00 64.21 63.62 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 -3.78 -3.46 2.35 -1.96 -3.45 115.58 105.28 1l3n h ASN 26 Ca 0.00 0.00 -0.49 0.00 -0.55 0.00 0.00 56.30 55.26 1l3n h ASN 26 Cb 0.43 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.78 1l3n h ASN 26 CO 0.00 0.00 0.36 -0.83 -1.65 0.00 0.00 177.43 175.31 1l3n s GLY 27 N -3.85 3.05 0.71 2.83 0.00 0.06 -5.04 107.32 105.08 1l3n s GLY 27 Ca 0.09 0.61 -0.16 0.00 0.00 0.00 0.00 44.72 45.27 1l3n s GLY 27 CO 0.63 1.16 1.22 2.56 0.00 0.00 0.00 173.10 178.66 1l3n s PRO 28 N -1.39 2.21 -0.99 2.90 0.04 -1.26 -4.81 135.00 131.70 1l3n s PRO 28 Ca 0.43 1.81 -0.23 0.00 0.04 0.00 0.00 61.00 63.05 1l3n s PRO 28 Cb -0.25 -1.84 0.02 0.00 0.04 0.00 0.00 34.50 32.48 1l3n s PRO 28 CO 0.31 -1.79 1.61 0.08 0.04 0.00 0.00 177.00 177.24 1l3n s VAL 29 N -1.88 3.78 -0.37 -0.36 1.01 0.17 -4.65 120.40 118.10 1l3n s VAL 29 Ca 0.76 -0.66 -0.25 0.00 0.00 0.00 0.00 61.98 61.83 1l3n s VAL 29 Cb -0.31 -4.74 0.01 0.00 0.00 0.00 0.00 36.38 31.35 1l3n s VAL 29 CO 0.44 -1.63 0.87 -0.75 0.00 0.00 0.00 175.10 174.03 1l3n s LYS 30 N 5.60 3.79 -0.19 2.72 2.36 -1.22 -0.93 119.74 131.87 1l3n s LYS 30 Ca 0.54 0.45 -0.04 0.00 -2.55 0.00 0.00 55.97 54.37 1l3n s LYS 30 Cb -0.02 -3.81 -0.02 0.00 -1.05 0.00 0.00 37.83 32.93 1l3n s LYS 30 CO -0.07 -0.92 -0.04 0.14 1.55 0.00 0.00 175.35 176.01 1l3n s VAL 31 N 3.33 3.66 0.18 4.02 -7.23 0.71 -2.19 120.40 122.89 1l3n s VAL 31 Ca 0.35 -0.42 0.02 0.00 -1.81 0.00 0.00 61.98 60.12 1l3n s VAL 31 Cb -0.12 -2.63 -0.05 0.00 0.56 0.00 0.00 36.38 34.14 1l3n s VAL 31 CO 0.18 0.45 0.01 -1.66 -0.31 0.00 0.00 175.10 173.77 1l3n s TRP 32 N 0.91 1.26 -4.33 2.82 -2.14 -0.37 -0.50 118.94 116.59 1l3n s TRP 32 Ca -0.00 -1.02 0.00 0.00 2.66 0.00 0.00 56.10 57.74 1l3n s TRP 32 Cb -0.15 -0.72 0.00 0.00 -3.10 0.00 0.00 33.47 29.51 1l3n s TRP 32 CO 0.01 -0.20 0.00 0.41 -2.66 0.00 0.00 176.95 174.51 1l3n n GLY 33 N -0.27 -0.15 3.39 3.67 0.00 0.08 -0.14 105.19 111.78 1l3n n GLY 33 Ca -0.06 -0.97 -0.15 0.00 0.00 0.00 0.00 46.02 44.83 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 -4.00 -0.44 -0.29 1.61 0.15 -1.26 -0.65 113.70 108.82 1l3n s SER 34 Ca 0.00 0.38 -0.03 0.00 0.70 0.00 0.00 55.95 57.00 1l3n s SER 34 Cb 0.00 0.44 0.04 0.00 -1.71 0.00 0.00 66.02 64.79 1l3n s SER 34 CO 0.00 -0.56 0.01 0.27 1.20 0.00 0.00 173.24 174.15 1l3n s ILE 35 N -1.45 3.17 -0.08 6.45 -0.00 -0.13 -1.23 121.20 127.93 1l3n s ILE 35 Ca -0.11 -1.21 -0.12 0.00 -0.00 0.00 0.00 60.65 59.21 1l3n s ILE 35 Cb -0.02 -2.76 -0.05 0.00 -0.00 0.00 0.00 42.46 39.64 1l3n s ILE 35 CO 0.06 -0.04 0.30 -0.75 -0.00 0.00 0.00 174.94 174.52 1l3n s LYS 36 N 1.31 3.87 0.00 0.37 2.20 -0.16 -0.59 119.74 126.75 1l3n s LYS 36 Ca -0.03 0.18 0.00 0.00 -0.36 0.00 0.00 55.97 55.76 1l3n s LYS 36 Cb -0.19 -3.27 0.00 0.00 -1.51 0.00 0.00 37.83 32.86 1l3n s LYS 36 CO -0.01 0.59 0.00 0.41 -0.36 0.00 0.00 175.35 175.99 1l3n n GLY 37 N 2.28 0.69 3.75 5.54 0.00 0.70 -0.57 105.19 117.58 1l3n n GLY 37 Ca -0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 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 1.68 0.19 0.99 2.01 -0.10 -4.42 118.68 119.03 1l3n s LEU 38 Ca 0.00 0.67 0.04 0.00 0.01 0.00 0.00 54.13 54.85 1l3n s LEU 38 Cb 0.00 -2.69 -0.03 0.00 0.01 0.00 0.00 46.19 43.47 1l3n s LEU 38 CO 0.00 -3.22 0.30 0.28 1.01 0.00 0.00 176.35 174.72 1l3n s THR 39 N -3.32 5.22 0.66 5.49 -1.32 -1.26 -4.02 115.64 117.09 1l3n s THR 39 Ca 0.69 -0.84 -0.17 0.00 -1.21 0.00 0.00 61.69 60.16 1l3n s THR 39 Cb -0.10 -3.74 -0.03 0.00 -1.51 0.00 0.00 72.50 67.12 1l3n s THR 39 CO 0.54 -0.19 0.90 1.21 -2.21 0.00 0.00 174.62 174.88 1l3n n GLU 40 N -0.86 0.65 0.00 7.08 2.13 -1.26 -4.69 120.64 123.70 1l3n n GLU 40 Ca -0.08 0.27 0.00 0.00 0.66 0.00 0.00 57.16 58.01 1l3n n GLU 40 Cb 0.55 -2.14 0.00 0.00 0.27 0.00 0.00 31.44 30.12 1l3n n GLU 40 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1l3n n GLY 41 N 1.27 -3.50 3.76 8.31 0.00 0.02 -4.87 105.19 110.18 1l3n n GLY 41 Ca 0.13 -2.14 -0.35 0.00 0.00 0.00 0.00 46.02 43.66 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 3.63 0.03 0.99 1.02 -1.26 -0.24 118.68 122.85 1l3n s LEU 42 Ca 0.00 2.26 -0.16 0.00 0.02 0.00 0.00 54.13 56.25 1l3n s LEU 42 Cb 0.00 -4.58 0.03 0.00 0.02 0.00 0.00 46.19 41.65 1l3n s LEU 42 CO 0.00 -1.52 0.34 -1.00 0.02 0.00 0.00 176.35 174.19 1l3n s HIS 43 N -1.80 -0.18 -0.19 0.29 3.76 0.62 -3.22 115.29 114.59 1l3n s HIS 43 Ca 0.74 0.13 -0.39 0.00 -0.15 0.00 0.00 55.06 55.39 1l3n s HIS 43 Cb -0.27 0.14 -0.18 0.00 1.11 0.00 0.00 32.58 33.38 1l3n s HIS 43 CO 0.33 -0.50 1.17 0.41 -0.85 0.00 0.00 174.74 175.30 1l3n n GLY 44 N 0.70 -0.08 3.18 -2.22 0.00 0.58 -0.90 105.19 106.45 1l3n n GLY 44 Ca -0.19 0.79 -0.04 0.00 0.00 0.00 0.00 46.02 46.57 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 1.11 -1.11 0.24 1.61 5.36 -1.26 -1.06 117.98 122.88 1l3n s PHE 45 Ca 0.88 1.48 -0.10 0.00 -0.96 0.00 0.00 56.93 58.24 1l3n s PHE 45 Cb -1.24 0.36 -0.01 0.00 -0.34 0.00 0.00 43.02 41.79 1l3n s PHE 45 CO 0.61 -0.69 0.41 -1.01 -1.46 0.00 0.00 175.22 173.08 1l3n s HIS 46 N 2.70 0.56 -0.15 10.12 3.76 -0.68 -2.64 115.29 128.97 1l3n s HIS 46 Ca 0.08 -0.89 0.00 0.00 -0.15 0.00 0.00 55.06 54.11 1l3n s HIS 46 Cb -0.14 0.02 -0.01 0.00 1.11 0.00 0.00 32.58 33.57 1l3n s HIS 46 CO -0.17 -0.93 -0.14 0.14 -0.85 0.00 0.00 174.74 172.79 1l3n s VAL 47 N -3.99 2.84 0.18 -0.90 -7.23 0.09 -1.17 120.40 110.21 1l3n s VAL 47 Ca 0.26 -0.72 -0.23 0.00 -1.81 0.00 0.00 61.98 59.48 1l3n s VAL 47 Cb 0.01 -2.19 0.07 0.00 0.56 0.00 0.00 36.38 34.83 1l3n s VAL 47 CO 0.10 0.52 1.01 -1.38 -0.31 0.00 0.00 175.10 175.03 1l3n s HIS 48 N 0.63 -0.01 0.00 2.82 -3.43 -1.22 -3.99 115.29 110.10 1l3n s HIS 48 Ca -0.08 -0.36 0.00 0.00 -0.80 0.00 0.00 55.06 53.82 1l3n s HIS 48 Cb -0.16 0.68 0.00 0.00 -1.43 0.00 0.00 32.58 31.67 1l3n s HIS 48 CO 0.03 -0.90 0.00 -0.85 -2.00 0.00 0.00 174.74 171.02 1l3n n GLU 49 N -0.60 0.00 -0.10 -0.38 0.28 -1.26 -3.44 120.64 115.15 1l3n n GLU 49 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.95 1l3n n GLU 49 Cb 0.60 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.47 1l3n n GLU 49 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1l3n n PHE 50 N 0.00 -2.85 0.33 -1.84 3.72 0.63 -4.63 117.46 112.83 1l3n n PHE 50 Ca 0.00 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.44 1l3n n PHE 50 Cb 0.00 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.57 1l3n n PHE 50 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1l3n n GLY 51 N 5.00 -0.64 3.57 1.37 0.00 -1.24 -0.76 105.19 112.50 1l3n n GLY 51 Ca 0.00 -0.23 -0.35 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.70 5.92 0.00 1.61 -4.77 -1.26 -4.74 116.67 112.73 1l3n s ASP 52 Ca 0.09 -1.78 0.05 0.00 -3.30 0.00 0.00 52.55 47.61 1l3n s ASP 52 Cb 0.07 -2.58 0.30 0.00 -1.09 0.00 0.00 42.92 39.61 1l3n s ASP 52 CO 0.11 -2.11 1.17 0.59 0.70 0.00 0.00 175.17 175.62 1l3n n ASN 53 N 11.34 0.00 -0.31 2.11 5.03 -1.26 -1.33 115.26 130.83 1l3n n ASN 53 Ca 0.44 -1.80 0.08 0.00 0.87 0.00 0.00 54.58 54.18 1l3n n ASN 53 Cb 0.47 0.00 0.19 0.00 -1.02 0.00 0.00 39.78 39.42 1l3n n ASN 53 CO 0.00 0.00 0.00 0.74 -1.83 0.00 0.00 177.26 176.17 1l3n h THR 54 N 0.00 0.13 0.00 3.41 2.02 -1.98 0.30 112.91 116.80 1l3n h THR 54 Ca 0.00 -0.01 -0.14 0.00 0.77 0.00 0.00 66.41 67.03 1l3n h THR 54 Cb 0.00 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.49 1l3n h THR 54 CO 0.00 0.01 -0.68 0.00 0.37 0.00 0.00 175.52 175.22 1l3n h ALA 55 N 1.88 0.56 0.00 6.16 0.00 -1.99 -3.50 119.26 122.37 1l3n h ALA 55 Ca 0.49 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1l3n h ALA 55 Cb 0.89 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1l3n h ALA 55 CO -0.86 0.84 0.00 0.41 0.00 0.00 0.00 179.25 179.65 1l3n n GLY 56 N 1.27 0.70 1.17 0.00 0.00 0.11 -4.87 105.19 103.57 1l3n n GLY 56 Ca 0.01 -1.66 -0.00 0.00 0.00 0.00 0.00 46.02 44.37 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 0.79 0.71 -0.36 0.00 -1.04 -1.26 -4.83 114.28 108.29 1l3n n THR 58 Ca 0.01 0.23 0.01 0.00 -2.04 0.00 0.00 64.05 62.26 1l3n n THR 58 Cb 0.51 -1.29 0.15 0.00 -1.82 0.00 0.00 70.33 67.88 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 1.08 -0.50 8.00 0.87 -1.74 -1.56 113.55 119.70 1l3n h SER 59 Ca 0.00 -0.01 0.19 0.00 -1.23 0.00 0.00 61.79 60.74 1l3n h SER 59 Cb 0.17 -0.25 -0.09 0.00 -0.44 0.00 0.00 62.40 61.79 1l3n h SER 59 CO 0.00 0.74 0.20 0.00 -0.53 0.00 0.00 176.83 177.24 1l3n n ALA 60 N -2.38 0.45 0.00 6.23 0.00 -0.45 -4.88 120.51 119.49 1l3n n ALA 60 Ca 0.14 0.52 0.00 0.00 0.00 0.00 0.00 53.44 54.09 1l3n n ALA 60 Cb 0.10 -0.48 0.00 0.00 0.00 0.00 0.00 19.45 19.07 1l3n n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l3n n GLY 61 N -1.16 0.60 3.89 0.00 0.00 -0.59 -0.27 105.19 107.66 1l3n n GLY 61 Ca 0.17 -2.18 -0.26 0.00 0.00 0.00 0.00 46.02 43.74 1l3n n GLY 61 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1l3n s PRO 62 N -0.55 2.26 -1.15 1.61 0.04 -1.26 -4.89 135.00 131.06 1l3n s PRO 62 Ca 0.00 -2.02 -0.24 0.00 0.04 0.00 0.00 61.00 58.78 1l3n s PRO 62 Cb 0.00 -2.07 -0.13 0.00 0.04 0.00 0.00 34.50 32.33 1l3n s PRO 62 CO 0.00 -0.57 1.99 0.72 0.04 0.00 0.00 177.00 179.17 1l3n n HIS 63 N -1.71 2.18 -2.34 0.56 8.25 -1.26 -4.13 115.22 116.77 1l3n n HIS 63 Ca -0.02 -1.08 -0.36 0.00 -0.26 0.00 0.00 57.72 55.99 1l3n n HIS 63 Cb 0.64 -2.61 0.02 0.00 1.12 0.00 0.00 29.99 29.16 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 15.99 3.13 -1.60 4.41 3.72 -1.26 -4.91 117.46 136.93 1l3n n PHE 64 Ca 0.44 -2.72 -0.40 0.00 -0.05 0.00 0.00 57.45 54.71 1l3n n PHE 64 Cb 0.47 -0.92 0.02 0.00 -0.94 0.00 0.00 39.48 38.11 1l3n n PHE 64 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1l3n n ASN 65 N -0.36 0.99 -0.16 4.37 6.94 -1.26 -4.67 115.26 121.12 1l3n n ASN 65 Ca 0.47 0.97 -0.09 0.00 -0.02 0.00 0.00 54.58 55.90 1l3n n ASN 65 Cb 0.33 -1.35 -0.00 0.00 -2.36 0.00 0.00 39.78 36.40 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 1.23 0.74 -4.30 -0.53 0.13 -1.97 -3.13 132.00 124.18 1l3n h PRO 66 Ca -0.45 -0.19 -0.62 0.00 -0.87 0.00 0.00 66.00 63.86 1l3n h PRO 66 Cb 1.35 -0.09 0.04 0.00 0.13 0.00 0.00 31.00 32.43 1l3n h PRO 66 CO 0.55 0.75 2.41 1.28 -0.23 0.00 0.00 178.00 182.77 1l3n n LEU 67 N -4.48 4.43 -4.56 1.56 4.77 -1.26 -4.91 117.00 112.56 1l3n n LEU 67 Ca 0.00 -2.99 -0.40 0.00 -0.03 0.00 0.00 56.01 52.59 1l3n n LEU 67 Cb 0.23 -1.15 -0.04 0.00 -2.33 0.00 0.00 43.42 40.13 1l3n n LEU 67 CO 0.40 -0.11 1.95 -1.54 -1.33 0.00 0.00 177.39 176.76 1l3n n SER 68 N 6.93 2.63 -2.48 -1.43 3.41 -1.19 -4.76 113.62 116.74 1l3n n SER 68 Ca 0.49 -0.14 -0.13 0.00 -0.26 0.00 0.00 58.87 58.83 1l3n n SER 68 Cb 0.37 -1.53 -0.05 0.00 -0.26 0.00 0.00 64.21 62.74 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 8.84 0.31 -3.18 4.33 1.74 -1.26 -5.14 116.66 122.30 1l3n n ARG 69 Ca 0.35 -2.18 -0.39 0.00 -0.77 0.00 0.00 57.85 54.86 1l3n n ARG 69 Cb 0.47 1.84 -0.05 0.00 -1.02 0.00 0.00 32.46 33.70 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 -2.85 4.37 -0.42 5.56 1.02 -1.21 -4.85 119.74 121.38 1l3n s LYS 70 Ca 0.26 0.65 -0.41 0.00 0.02 0.00 0.00 55.97 56.49 1l3n s LYS 70 Cb 0.01 -3.45 -0.16 0.00 -0.52 0.00 0.00 37.83 33.71 1l3n s LYS 70 CO 0.18 0.09 2.06 1.58 -0.92 0.00 0.00 175.35 178.34 1l3n n HIS 71 N 3.83 1.48 -1.53 3.18 -0.00 0.09 -3.70 115.22 118.57 1l3n n HIS 71 Ca -0.04 0.60 0.00 0.00 -0.00 0.00 0.00 57.72 58.28 1l3n n HIS 71 Cb 0.51 -2.39 0.00 0.00 -0.00 0.00 0.00 29.99 28.11 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 6.45 5.26 0.00 1.57 0.00 -1.26 -2.94 105.19 114.27 1l3n n GLY 72 Ca 0.44 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.99 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 2.88 2.61 0.30 -0.02 0.00 -1.26 -4.64 105.19 105.06 1l3n n GLY 73 Ca 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.93 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 0.42 -0.01 1.61 -0.04 -1.25 -0.48 135.00 135.25 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 -1.13 -0.08 0.00 -0.04 0.00 0.00 33.50 32.25 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 -0.02 0.44 -4.34 0.54 5.02 -1.26 -5.06 118.16 113.48 1l3n n LYS 75 Ca 0.00 -0.09 -0.24 0.00 -2.02 0.00 0.00 58.31 55.96 1l3n n LYS 75 Cb 0.06 -1.25 -0.08 0.00 -0.02 0.00 0.00 35.03 33.74 1l3n n LYS 75 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1l3n s ASP 76 N -3.27 4.20 0.18 4.39 1.11 0.37 -5.04 116.67 118.62 1l3n s ASP 76 Ca -0.04 -0.89 0.21 0.00 0.18 0.00 0.00 52.55 52.01 1l3n s ASP 76 Cb 0.06 -0.59 -0.01 0.00 1.07 0.00 0.00 42.92 43.45 1l3n s ASP 76 CO 0.43 -0.13 1.03 1.05 1.18 0.00 0.00 175.17 178.74 1l3n h GLU 77 N 1.90 0.00 -0.00 8.23 4.11 -1.96 -3.37 114.58 123.49 1l3n h GLU 77 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.00 1l3n h GLU 77 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1l3n h GLU 77 CO 0.64 0.10 -0.11 -0.85 0.07 0.00 0.00 179.01 178.86 1l3n n GLU 78 N -2.79 0.45 -1.33 1.06 0.00 -1.26 -4.88 120.64 111.89 1l3n n GLU 78 Ca -0.02 -0.12 -0.53 0.00 0.00 0.00 0.00 57.16 56.49 1l3n n GLU 78 Cb 0.64 -1.50 -0.08 0.00 0.00 0.00 0.00 31.44 30.50 1l3n n GLU 78 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.13 180.02 1l3n n ARG 79 N -1.17 0.00 -0.14 3.44 1.85 -1.24 -3.29 116.66 116.10 1l3n n ARG 79 Ca 0.12 0.00 -0.04 0.00 -1.00 0.00 0.00 57.85 56.93 1l3n n ARG 79 Cb 0.29 -1.17 0.02 0.00 -1.05 0.00 0.00 32.46 30.54 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 4.24 -0.34 0.00 2.89 3.86 -1.84 -3.45 115.15 120.51 1l3n h HIS 80 Ca -0.32 0.04 0.00 0.00 -1.16 0.00 0.00 60.37 58.94 1l3n h HIS 80 Cb 1.08 0.22 0.00 0.00 1.06 0.00 0.00 27.41 29.77 1l3n h HIS 80 CO 0.54 -0.23 0.00 1.55 0.86 0.00 0.00 177.93 180.64 1l3n n VAL 81 N -5.36 0.00 -2.88 2.45 3.14 -1.26 -4.39 118.33 110.03 1l3n n VAL 81 Ca 0.03 0.00 -0.12 0.00 -2.96 0.00 0.00 64.34 61.29 1l3n n VAL 81 Cb 0.27 0.00 0.04 0.00 -1.06 0.00 0.00 33.84 33.09 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 -0.90 1.44 3.49 7.55 0.00 -1.26 -4.74 105.19 110.77 1l3n n GLY 82 Ca 0.00 -0.51 -0.43 0.00 0.00 0.00 0.00 46.02 45.08 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 -1.62 6.33 0.02 1.61 1.01 -1.26 -0.73 116.67 122.03 1l3n s ASP 83 Ca 0.29 -1.23 0.16 0.00 0.71 0.00 0.00 52.55 52.48 1l3n s ASP 83 Cb 0.29 -2.46 0.68 0.00 1.01 0.00 0.00 42.92 42.43 1l3n s ASP 83 CO -0.09 -1.43 1.51 0.18 0.21 0.00 0.00 175.17 175.55 1l3n n LEU 84 N 7.88 0.06 0.00 1.23 7.99 -1.08 -3.91 117.00 129.18 1l3n n LEU 84 Ca 0.10 0.51 0.00 0.00 -0.01 0.00 0.00 56.01 56.61 1l3n n LEU 84 Cb 0.48 -0.51 0.00 0.00 -0.11 0.00 0.00 43.42 43.28 1l3n n LEU 84 CO 0.62 -0.27 0.00 0.61 -1.51 0.00 0.00 177.39 176.85 1l3n n GLY 85 N 0.07 0.99 3.27 -0.72 0.00 -1.26 -4.59 105.19 102.94 1l3n n GLY 85 Ca 0.04 -0.74 -0.14 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.28 -0.13 1.61 -0.87 -1.26 -4.57 114.94 105.44 1l3n s ASN 86 Ca 0.00 0.32 0.02 0.00 -1.57 0.00 0.00 52.86 51.63 1l3n s ASN 86 Cb 0.00 0.46 -0.00 0.00 -0.02 0.00 0.00 41.25 41.69 1l3n s ASN 86 CO 0.00 -0.37 -0.19 0.68 -2.57 0.00 0.00 177.10 174.65 1l3n s VAL 87 N -0.88 2.40 -0.78 1.60 -7.23 -0.08 -4.87 120.40 110.57 1l3n s VAL 87 Ca -0.09 -0.88 -0.20 0.00 -1.81 0.00 0.00 61.98 58.99 1l3n s VAL 87 Cb -0.04 -1.97 0.11 0.00 0.56 0.00 0.00 36.38 35.04 1l3n s VAL 87 CO 0.04 0.54 0.99 -0.89 -0.31 0.00 0.00 175.10 175.47 1l3n s THR 88 N 0.54 4.63 0.08 5.32 2.01 -1.26 -0.27 115.64 126.68 1l3n s THR 88 Ca -0.12 -1.09 -0.31 0.00 0.31 0.00 0.00 61.69 60.48 1l3n s THR 88 Cb -0.17 -4.69 -0.07 0.00 0.01 0.00 0.00 72.50 67.58 1l3n s THR 88 CO 0.04 -1.41 1.39 0.00 -0.69 0.00 0.00 174.62 173.95 1l3n s ALA 89 N 3.09 3.58 1.11 7.40 0.00 0.67 -4.00 121.76 133.61 1l3n s ALA 89 Ca 0.25 1.04 -0.14 0.00 0.00 0.00 0.00 51.96 53.11 1l3n s ALA 89 Cb -0.12 -3.55 0.25 0.00 0.00 0.00 0.00 23.12 19.69 1l3n s ALA 89 CO -0.00 -0.70 1.07 0.34 0.00 0.00 0.00 175.76 176.46 1l3n s ASP 90 N 1.37 1.58 0.54 0.00 2.15 0.18 -0.80 116.67 121.70 1l3n s ASP 90 Ca 0.64 1.13 0.25 0.00 0.43 0.00 0.00 52.55 55.01 1l3n s ASP 90 Cb -0.35 -1.74 1.42 0.00 -0.30 0.00 0.00 42.92 41.95 1l3n s ASP 90 CO 0.29 -3.77 2.00 0.07 -0.17 0.00 0.00 175.17 173.60 1l3n h LYS 91 N -2.33 0.00 0.00 4.34 2.10 -1.96 0.14 116.57 118.87 1l3n h LYS 91 Ca -0.55 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.10 1l3n h LYS 91 Cb 1.33 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.66 1l3n h LYS 91 CO 0.50 0.00 0.00 -3.47 -2.00 0.00 0.00 179.45 174.48 1l3n n ASP 92 N -4.29 0.00 -0.22 7.07 2.03 -1.26 -4.80 116.55 115.09 1l3n n ASP 92 Ca 0.09 -0.93 -0.03 0.00 0.52 0.00 0.00 54.79 54.43 1l3n n ASP 92 Cb 0.57 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.96 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 0.82 0.61 3.38 0.27 0.00 0.50 -4.53 105.19 106.24 1l3n n GLY 93 Ca 0.21 -0.69 -0.45 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.06 5.07 -0.30 1.61 1.01 -1.25 -0.21 120.40 124.27 1l3n s VAL 94 Ca 0.00 -1.00 -0.14 0.00 0.00 0.00 0.00 61.98 60.84 1l3n s VAL 94 Cb 0.00 -4.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.07 1l3n s VAL 94 CO 0.00 -0.79 0.32 0.00 0.00 0.00 0.00 175.10 174.63 1l3n s ALA 95 N 2.06 3.53 0.28 5.51 0.00 0.24 -0.64 121.76 132.74 1l3n s ALA 95 Ca 0.08 -1.02 -0.28 0.00 0.00 0.00 0.00 51.96 50.73 1l3n s ALA 95 Cb -0.24 -2.69 -0.09 0.00 0.00 0.00 0.00 23.12 20.10 1l3n s ALA 95 CO 0.07 -0.77 0.96 0.16 0.00 0.00 0.00 175.76 176.18 1l3n s ASP 96 N 1.70 7.47 -0.12 0.00 -4.77 -1.26 -0.95 116.67 118.75 1l3n s ASP 96 Ca 0.12 1.93 -0.01 0.00 -3.30 0.00 0.00 52.55 51.29 1l3n s ASP 96 Cb -0.16 -2.60 -0.02 0.00 -1.09 0.00 0.00 42.92 39.05 1l3n s ASP 96 CO 0.11 0.03 -0.09 -0.69 0.70 0.00 0.00 175.17 175.23 1l3n s VAL 97 N -1.36 3.47 -0.45 2.11 1.01 0.18 -4.38 120.40 120.99 1l3n s VAL 97 Ca 0.45 -0.53 0.07 0.00 0.00 0.00 0.00 61.98 61.97 1l3n s VAL 97 Cb -0.23 -2.46 0.33 0.00 0.00 0.00 0.00 36.38 34.02 1l3n s VAL 97 CO 0.29 0.54 1.14 -1.54 0.00 0.00 0.00 175.10 175.53 1l3n n SER 98 N 3.11 -2.10 -4.90 3.32 3.41 -1.23 -0.74 113.62 114.49 1l3n n SER 98 Ca -0.18 -3.48 -0.28 0.00 -0.26 0.00 0.00 58.87 54.67 1l3n n SER 98 Cb 0.53 1.66 -0.04 0.00 -0.26 0.00 0.00 64.21 66.09 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 0.10 5.16 -0.16 -1.33 1.09 0.35 -4.92 121.20 121.49 1l3n s ILE 99 Ca 0.23 -0.64 -0.02 0.00 -1.10 0.00 0.00 60.65 59.12 1l3n s ILE 99 Cb 0.31 -3.59 -0.02 0.00 -1.06 0.00 0.00 42.46 38.11 1l3n s ILE 99 CO -0.06 0.01 -0.08 -1.61 -0.10 0.00 0.00 174.94 173.10 1l3n s GLU 100 N -2.88 3.48 0.04 2.79 2.02 -1.26 -0.21 118.70 122.68 1l3n s GLU 100 Ca 0.34 -0.62 0.05 0.00 0.02 0.00 0.00 54.97 54.76 1l3n s GLU 100 Cb -0.12 -2.80 -0.02 0.00 0.10 0.00 0.00 34.13 31.29 1l3n s GLU 100 CO 0.27 0.14 -0.14 0.34 0.02 0.00 0.00 175.26 175.89 1l3n s ASP 101 N 0.58 1.64 -0.46 -0.19 -1.08 -0.11 -4.96 116.67 112.10 1l3n s ASP 101 Ca -0.05 -0.45 0.09 0.00 -0.52 0.00 0.00 52.55 51.61 1l3n s ASP 101 Cb -0.15 -0.10 0.30 0.00 -1.46 0.00 0.00 42.92 41.51 1l3n s ASP 101 CO 0.03 0.03 0.71 -0.24 0.52 0.00 0.00 175.17 176.22 1l3n n SER 102 N 1.91 1.78 0.05 -0.34 2.88 -1.26 0.43 113.62 119.07 1l3n n SER 102 Ca -0.18 -3.11 0.00 0.00 -1.33 0.00 0.00 58.87 54.25 1l3n n SER 102 Cb 0.55 -0.62 0.00 0.00 -0.75 0.00 0.00 64.21 63.38 1l3n n SER 102 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 1l3n n VAL 103 N 0.62 0.00 -1.83 2.46 3.14 -1.26 -5.07 118.33 116.39 1l3n n VAL 103 Ca 0.26 0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.34 1l3n n VAL 103 Cb 0.53 -0.27 0.16 0.00 -1.06 0.00 0.00 33.84 33.19 1l3n n VAL 103 CO 0.00 0.00 0.00 0.27 -6.46 0.00 0.00 176.83 170.64 1l3n s ILE 104 N -2.00 1.97 0.03 1.55 -0.00 -1.26 -5.06 121.20 116.43 1l3n s ILE 104 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 60.65 60.45 1l3n s ILE 104 Cb 0.00 -2.94 0.04 0.00 -0.00 0.00 0.00 42.46 39.56 1l3n s ILE 104 CO 0.00 0.00 0.45 -0.44 -0.00 0.00 0.00 174.94 174.95 1l3n s SER 105 N -4.65 -0.34 0.26 4.36 0.01 -1.26 -4.64 113.70 107.44 1l3n s SER 105 Ca 0.69 0.11 0.23 0.00 1.31 0.00 0.00 55.95 58.29 1l3n s SER 105 Cb -0.07 0.43 0.99 0.00 0.21 0.00 0.00 66.02 67.58 1l3n s SER 105 CO 0.52 -0.64 1.69 0.18 0.41 0.00 0.00 173.24 175.40 1l3n n LEU 106 N 0.61 0.63 -3.70 2.44 4.77 -1.26 -3.44 117.00 117.05 1l3n n LEU 106 Ca -0.19 0.67 -0.11 0.00 -0.03 0.00 0.00 56.01 56.35 1l3n n LEU 106 Cb 0.59 -0.61 -0.06 0.00 -2.33 0.00 0.00 43.42 41.01 1l3n n LEU 106 CO 0.21 -0.61 0.09 -0.44 -1.33 0.00 0.00 177.39 175.31 1l3n s SER 107 N -4.17 -0.18 0.00 -1.43 0.01 -1.26 -4.57 113.70 102.09 1l3n s SER 107 Ca 0.03 -0.24 0.00 0.00 1.31 0.00 0.00 55.95 57.06 1l3n s SER 107 Cb 0.09 0.41 0.00 0.00 0.21 0.00 0.00 66.02 66.73 1l3n s SER 107 CO 0.36 -0.72 0.00 0.61 0.41 0.00 0.00 173.24 173.89 1l3n n GLY 108 N 0.21 0.79 1.94 3.44 0.00 -1.26 -4.77 105.19 105.54 1l3n n GLY 108 Ca -0.17 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.74 -0.01 1.61 -0.08 -1.26 -4.96 116.55 111.11 1l3n n ASP 109 Ca 0.00 0.16 -0.17 0.00 -1.51 0.00 0.00 54.79 53.27 1l3n n ASP 109 Cb 0.00 1.08 -0.07 0.00 2.34 0.00 0.00 41.12 44.48 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 1.02 -5.98 -0.67 3.86 -1.89 -3.47 115.15 108.02 1l3n h HIS 110 Ca 0.00 -0.47 -0.35 0.00 -1.16 0.00 0.00 60.37 58.39 1l3n h HIS 110 Cb 0.00 -0.15 0.01 0.00 1.06 0.00 0.00 27.41 28.33 1l3n h HIS 110 CO 0.00 1.29 -0.91 0.45 0.86 0.00 0.00 177.93 179.62 1l3n n SER 111 N -3.91 -3.97 -1.92 2.45 2.88 -1.22 -4.73 113.62 103.20 1l3n n SER 111 Ca -0.08 -0.46 -0.06 0.00 -1.33 0.00 0.00 58.87 56.94 1l3n n SER 111 Cb 0.76 -1.23 -0.09 0.00 -0.75 0.00 0.00 64.21 62.90 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 -1.18 2.17 0.00 2.46 -5.35 -1.25 -4.48 119.36 111.73 1l3n n ILE 112 Ca -0.17 -0.94 0.00 0.00 -0.27 0.00 0.00 62.75 61.37 1l3n n ILE 112 Cb 0.54 -1.74 0.00 0.00 -1.74 0.00 0.00 39.64 36.70 1l3n n ILE 112 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 1l3n n ILE 113 N 2.25 0.00 -0.83 7.28 2.08 -1.26 -4.57 119.36 124.31 1l3n n ILE 113 Ca 0.23 0.00 -0.11 0.00 0.56 0.00 0.00 62.75 63.43 1l3n n ILE 113 Cb 0.63 -0.40 -0.13 0.00 -0.75 0.00 0.00 39.64 38.99 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 2.85 2.69 4.01 7.39 0.00 -1.24 -2.18 105.19 118.71 1l3n n GLY 114 Ca 0.00 -1.00 -0.19 0.00 0.00 0.00 0.00 46.02 44.83 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 1.45 2.47 -0.46 1.61 1.81 -1.26 -3.71 118.95 120.85 1l3n s ARG 115 Ca 0.55 -1.55 -0.13 0.00 -1.72 0.00 0.00 55.73 52.88 1l3n s ARG 115 Cb 0.25 -2.63 0.08 0.00 -0.45 0.00 0.00 34.95 32.21 1l3n s ARG 115 CO -0.00 -0.64 0.36 0.99 -0.68 0.00 0.00 175.30 175.33 1l3n s THR 116 N -2.57 4.86 0.36 0.02 2.01 0.06 -3.80 115.64 116.59 1l3n s THR 116 Ca 0.57 -1.25 -0.25 0.00 0.31 0.00 0.00 61.69 61.07 1l3n s THR 116 Cb -0.07 -3.96 -0.09 0.00 0.01 0.00 0.00 72.50 68.39 1l3n s THR 116 CO 0.35 -0.59 1.04 -0.76 -0.69 0.00 0.00 174.62 173.97 1l3n s LEU 117 N 1.56 4.25 -0.01 4.42 2.01 0.55 -3.39 118.68 128.07 1l3n s LEU 117 Ca 0.04 2.04 0.02 0.00 0.01 0.00 0.00 54.13 56.23 1l3n s LEU 117 Cb -0.25 -4.06 -0.00 0.00 0.01 0.00 0.00 46.19 41.90 1l3n s LEU 117 CO 0.04 -0.35 -0.07 -0.69 1.01 0.00 0.00 176.35 176.30 1l3n s VAL 118 N -1.56 0.54 -0.15 -1.59 1.01 -0.31 -0.95 120.40 117.38 1l3n s VAL 118 Ca 0.54 -0.28 -0.04 0.00 0.00 0.00 0.00 61.98 62.20 1l3n s VAL 118 Cb -0.23 -0.47 -0.03 0.00 0.00 0.00 0.00 36.38 35.65 1l3n s VAL 118 CO 0.29 0.16 -0.01 0.54 0.00 0.00 0.00 175.10 176.08 1l3n s VAL 119 N -0.06 4.18 0.25 2.92 0.11 -0.42 -1.69 120.40 125.69 1l3n s VAL 119 Ca 0.01 -0.26 0.10 0.00 -2.93 0.00 0.00 61.98 58.90 1l3n s VAL 119 Cb -0.04 -2.83 -0.04 0.00 -1.53 0.00 0.00 36.38 31.93 1l3n s VAL 119 CO -0.00 0.51 -0.06 -1.00 -3.33 0.00 0.00 175.10 171.21 1l3n s HIS 120 N 0.14 2.60 0.17 1.54 3.76 -0.23 -2.46 115.29 120.81 1l3n s HIS 120 Ca 0.01 -0.25 -0.27 0.00 -0.15 0.00 0.00 55.06 54.40 1l3n s HIS 120 Cb -0.13 -1.17 0.02 0.00 1.11 0.00 0.00 32.58 32.41 1l3n s HIS 120 CO 0.02 0.62 1.56 1.49 -0.85 0.00 0.00 174.74 177.58 1l3n h GLU 121 N 2.17 -0.19 -5.82 1.40 4.81 -0.84 -3.20 114.58 112.92 1l3n h GLU 121 Ca -0.44 0.01 -0.60 0.00 -0.13 0.00 0.00 59.36 58.21 1l3n h GLU 121 Cb 1.24 0.04 -0.11 0.00 0.63 0.00 0.00 28.75 30.56 1l3n h GLU 121 CO 0.59 -0.12 -0.56 0.15 -0.73 0.00 0.00 179.01 178.34 1l3n s LYS 122 N -5.77 2.09 0.07 1.92 1.02 0.78 -4.83 119.74 115.02 1l3n s LYS 122 Ca -0.14 -1.94 -0.30 0.00 0.02 0.00 0.00 55.97 53.61 1l3n s LYS 122 Cb 0.13 -1.83 -0.05 0.00 -0.52 0.00 0.00 37.83 35.56 1l3n s LYS 122 CO 0.65 -0.05 1.04 0.00 -0.92 0.00 0.00 175.35 176.08 1l3n s ALA 123 N -2.63 3.27 0.12 5.17 0.00 -1.20 -0.31 121.76 126.17 1l3n s ALA 123 Ca 0.38 0.66 -0.30 0.00 0.00 0.00 0.00 51.96 52.69 1l3n s ALA 123 Cb 0.06 -3.35 -0.06 0.00 0.00 0.00 0.00 23.12 19.77 1l3n s ALA 123 CO 0.20 -0.21 1.05 -0.51 0.00 0.00 0.00 175.76 176.28 1l3n s ASP 124 N 0.56 7.34 0.09 0.00 1.11 -1.26 -4.45 116.67 120.05 1l3n s ASP 124 Ca 0.52 1.92 -0.09 0.00 0.18 0.00 0.00 52.55 55.07 1l3n s ASP 124 Cb -0.25 -2.59 -0.22 0.00 1.07 0.00 0.00 42.92 40.93 1l3n s ASP 124 CO 0.30 -0.20 1.18 -2.24 1.18 0.00 0.00 175.17 175.39 1l3n h ASP 125 N 5.70 0.66 -2.99 0.27 3.04 -0.79 -3.47 116.42 118.83 1l3n h ASP 125 Ca -0.43 -0.60 -0.06 0.00 -3.24 0.00 0.00 57.03 52.70 1l3n h ASP 125 Cb 1.21 -0.21 0.04 0.00 -1.04 0.00 0.00 39.33 39.33 1l3n h ASP 125 CO 0.74 1.42 -0.16 0.18 -2.04 0.00 0.00 179.24 179.38 1l3n n LEU 126 N -3.72 -2.52 0.00 0.15 4.77 -1.25 -4.45 117.00 109.98 1l3n n LEU 126 Ca -0.10 -0.13 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 1l3n n LEU 126 Cb 0.94 -1.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1l3n n LEU 126 CO 0.55 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 1l3n n GLY 127 N -1.18 3.09 0.00 -0.72 0.00 -1.15 -4.53 105.19 100.71 1l3n n GLY 127 Ca -0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.96 0.46 0.21 1.61 4.01 -1.26 -1.72 118.16 120.52 1l3n n LYS 128 Ca 0.00 0.04 0.11 0.00 -0.51 0.00 0.00 58.31 57.96 1l3n n LYS 128 Cb 0.00 -1.50 0.68 0.00 -0.51 0.00 0.00 35.03 33.70 1l3n n LYS 128 CO 0.00 0.00 0.00 0.78 -1.11 0.00 0.00 177.40 177.07 1l3n h GLY 129 N 3.95 0.00 -5.52 0.72 0.00 -1.90 -3.46 103.07 96.86 1l3n h GLY 129 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 46.96 1l3n h GLY 129 CO 0.00 0.00 -0.64 0.61 0.00 0.00 0.00 176.54 176.51 1l3n n GLY 130 N -1.54 -0.44 3.42 4.60 0.00 -0.70 -4.95 105.19 105.58 1l3n n GLY 130 Ca -0.00 0.19 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 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 -3.40 2.07 0.17 1.61 0.01 -1.26 -4.98 114.94 109.17 1l3n s ASN 131 Ca 0.50 -1.45 -0.28 0.00 -0.71 0.00 0.00 52.86 50.91 1l3n s ASN 131 Cb -0.22 0.14 -0.01 0.00 0.41 0.00 0.00 41.25 41.58 1l3n s ASN 131 CO 0.68 -0.73 1.54 -0.33 -1.51 0.00 0.00 177.10 176.76 1l3n h GLU 132 N 2.13 -0.01 -0.26 -0.60 3.07 -1.96 0.12 114.58 117.06 1l3n h GLU 132 Ca -0.38 0.00 0.06 0.00 -0.50 0.00 0.00 59.36 58.54 1l3n h GLU 132 Cb 1.25 0.00 -0.08 0.00 -0.84 0.00 0.00 28.75 29.09 1l3n h GLU 132 CO 0.63 -0.01 -0.31 1.49 -1.40 0.00 0.00 179.01 179.41 1l3n h GLU 133 N -0.01 -0.30 -0.66 2.33 4.57 -1.97 0.12 114.58 118.65 1l3n h GLU 133 Ca 0.20 0.02 0.08 0.00 -1.18 0.00 0.00 59.36 58.48 1l3n h GLU 133 Cb 0.45 0.07 -0.06 0.00 -0.16 0.00 0.00 28.75 29.05 1l3n h GLU 133 CO -0.94 -0.20 0.33 0.66 -1.18 0.00 0.00 179.01 177.68 1l3n h SER 134 N -0.31 0.44 0.71 1.04 4.64 -1.45 0.17 113.55 118.78 1l3n h SER 134 Ca 0.13 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1l3n h SER 134 Cb 0.53 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1l3n h SER 134 CO -0.44 0.26 0.00 1.07 -0.87 0.00 0.00 176.83 176.86 1l3n n THR 135 N -4.87 0.14 -0.00 2.95 5.66 0.27 -2.35 114.28 116.08 1l3n n THR 135 Ca 0.09 0.03 -0.01 0.00 -3.05 0.00 0.00 64.05 61.12 1l3n n THR 135 Cb 0.24 -0.58 -0.00 0.00 -1.55 0.00 0.00 70.33 68.43 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 -1.39 0.05 0.00 1.09 5.02 0.31 -0.73 118.16 122.50 1l3n n LYS 136 Ca 0.10 0.02 0.03 0.00 -2.02 0.00 0.00 58.31 56.44 1l3n n LYS 136 Cb 0.26 -0.38 -0.01 0.00 -0.02 0.00 0.00 35.03 34.87 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 -2.74 0.00 -2.30 -0.18 -2.24 0.41 -4.58 114.28 102.66 1l3n n THR 137 Ca -0.01 -0.41 -0.04 0.00 -2.27 0.00 0.00 64.05 61.32 1l3n n THR 137 Cb 0.04 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.32 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 0.90 0.39 2.48 3.38 0.00 -0.44 -3.67 105.19 108.23 1l3n n GLY 138 Ca 0.02 -0.66 -0.20 0.00 0.00 0.00 0.00 46.02 45.19 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 1.09 -5.52 0.00 1.61 3.02 -1.26 -0.09 115.26 114.13 1l3n n ASN 139 Ca -0.03 0.24 0.10 0.00 -0.03 0.00 0.00 54.58 54.86 1l3n n ASN 139 Cb 0.52 -4.65 0.45 0.00 -0.61 0.00 0.00 39.78 35.49 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 -0.27 1.95 -0.29 5.41 0.00 -1.24 -4.64 120.51 121.44 1l3n n ALA 140 Ca -0.22 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1l3n n ALA 140 Cb 0.66 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 0.54 -1.39 3.73 0.00 0.00 -1.26 -0.16 105.19 106.65 1l3n n GLY 141 Ca 0.06 -1.25 -0.42 0.00 0.00 0.00 0.00 46.02 44.40 1l3n n GLY 141 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1l3n n SER 142 N -0.43 3.48 -4.56 1.61 7.64 -1.26 -4.48 113.62 115.62 1l3n n SER 142 Ca 0.00 1.17 -0.19 0.00 1.01 0.00 0.00 58.87 60.86 1l3n n SER 142 Cb 0.00 -1.55 -0.06 0.00 -1.01 0.00 0.00 64.21 61.59 1l3n n SER 142 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1l3n s ARG 143 N -0.89 1.95 0.10 1.43 3.00 -1.26 -0.53 118.95 122.75 1l3n s ARG 143 Ca 0.62 0.09 -0.24 0.00 0.00 0.00 0.00 55.73 56.21 1l3n s ARG 143 Cb -0.53 -4.91 -0.11 0.00 0.00 0.00 0.00 34.95 29.40 1l3n s ARG 143 CO 0.53 -4.12 1.70 -0.07 0.00 0.00 0.00 175.30 173.34 1l3n h LEU 144 N 20.70 -0.26 -7.62 2.53 3.38 -1.81 -3.47 115.31 128.76 1l3n h LEU 144 Ca 0.04 0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 1l3n h LEU 144 Cb 1.00 0.10 -0.19 0.00 0.09 0.00 0.00 40.66 41.66 1l3n h LEU 144 CO 1.09 -0.14 -0.34 0.00 0.09 0.00 0.00 178.44 179.14 1l3n s ALA 145 N -6.16 -0.57 0.11 1.53 0.00 -1.10 -3.85 121.76 111.72 1l3n s ALA 145 Ca -0.14 0.03 0.05 0.00 0.00 0.00 0.00 51.96 51.90 1l3n s ALA 145 Cb 0.07 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.33 1l3n s ALA 145 CO 0.66 -0.30 -0.13 0.00 0.00 0.00 0.00 175.76 175.99 1l3n s GLY 147 N -2.35 0.23 -0.15 0.00 0.00 -0.12 -0.39 107.32 104.54 1l3n s GLY 147 Ca 0.06 -0.65 -0.00 0.00 0.00 0.00 0.00 44.72 44.13 1l3n s GLY 147 CO 0.02 -0.77 -0.13 0.14 0.00 0.00 0.00 173.10 172.36 1l3n s VAL 148 N -2.56 2.87 0.40 1.40 1.01 -1.26 -0.33 120.40 121.94 1l3n s VAL 148 Ca -0.05 -0.70 -0.23 0.00 0.00 0.00 0.00 61.98 60.99 1l3n s VAL 148 Cb -0.02 -2.22 -0.10 0.00 0.00 0.00 0.00 36.38 34.04 1l3n s VAL 148 CO -0.05 0.51 0.97 -0.63 0.00 0.00 0.00 175.10 175.91 1l3n s ILE 149 N 0.73 4.17 0.36 2.22 1.01 -0.92 -4.59 121.20 124.17 1l3n s ILE 149 Ca -0.06 1.52 -0.08 0.00 0.00 0.00 0.00 60.65 62.03 1l3n s ILE 149 Cb -0.15 -3.72 0.03 0.00 0.01 0.00 0.00 42.46 38.62 1l3n s ILE 149 CO 0.01 -0.12 0.62 -0.83 0.00 0.00 0.00 174.94 174.62 1l3n s GLY 150 N -1.89 0.98 0.03 6.18 0.00 -1.18 -3.60 107.32 107.84 1l3n s GLY 150 Ca 0.58 -1.17 -0.30 0.00 0.00 0.00 0.00 44.72 43.84 1l3n s GLY 150 CO 0.19 -0.69 1.72 -0.42 0.00 0.00 0.00 173.10 173.91 1l3n s ILE 151 N -2.74 3.16 0.10 0.90 1.01 -1.26 -3.31 121.20 119.06 1l3n s ILE 151 Ca 0.24 0.44 0.09 0.00 0.00 0.00 0.00 60.65 61.41 1l3n s ILE 151 Cb -0.03 -3.28 -0.04 0.00 0.01 0.00 0.00 42.46 39.12 1l3n s ILE 151 CO 0.16 -0.02 -0.20 0.00 0.00 0.00 0.00 174.94 174.89 1l3n s ALA 152 N 3.38 2.61 0.00 9.38 0.00 -1.25 -4.84 121.76 131.05 1l3n s ALA 152 Ca 0.77 -1.33 0.00 0.00 0.00 0.00 0.00 51.96 51.39 1l3n s ALA 152 Cb -0.39 -0.62 0.00 0.00 0.00 0.00 0.00 23.12 22.11 1l3n s ALA 152 CO 0.33 0.58 0.06 0.94 0.00 0.00 0.00 175.76 177.68