#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 -4.17 0.00 5.66 -1.26 -4.60 114.28 109.91 1l3n n THR 2 Ca 0.00 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.64 1l3n n THR 2 Cb 0.00 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 68.70 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 -1.59 3.25 0.14 1.09 2.20 -1.26 -0.56 119.74 123.02 1l3n s LYS 3 Ca 0.00 -0.31 -0.10 0.00 -0.36 0.00 0.00 55.97 55.20 1l3n s LYS 3 Cb 0.00 -2.97 -0.00 0.00 -1.51 0.00 0.00 37.83 33.35 1l3n s LYS 3 CO 0.00 0.68 0.28 0.00 -0.36 0.00 0.00 175.35 175.95 1l3n s ALA 4 N -0.78 -0.17 0.17 3.13 0.00 0.21 -2.12 121.76 122.19 1l3n s ALA 4 Ca 0.13 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.37 1l3n s ALA 4 Cb -0.12 0.74 -0.04 0.00 0.00 0.00 0.00 23.12 23.70 1l3n s ALA 4 CO 0.03 -0.62 0.05 0.14 0.00 0.00 0.00 175.76 175.36 1l3n s VAL 5 N -3.92 0.34 -0.22 0.00 -7.23 -1.12 -0.33 120.40 107.92 1l3n s VAL 5 Ca 0.12 -1.95 -0.04 0.00 -1.81 0.00 0.00 61.98 58.30 1l3n s VAL 5 Cb 0.03 -2.19 0.08 0.00 0.56 0.00 0.00 36.38 34.87 1l3n s VAL 5 CO -0.04 -0.36 0.15 0.00 -0.31 0.00 0.00 175.10 174.54 1l3n s ALA 6 N -3.90 0.22 -0.70 1.32 0.00 -0.05 -2.83 121.76 115.82 1l3n s ALA 6 Ca 0.27 -0.34 -0.27 0.00 0.00 0.00 0.00 51.96 51.62 1l3n s ALA 6 Cb 0.07 -1.25 0.03 0.00 0.00 0.00 0.00 23.12 21.97 1l3n s ALA 6 CO 0.05 -1.33 1.23 0.14 0.00 0.00 0.00 175.76 175.84 1l3n s VAL 7 N 2.20 3.84 0.22 0.00 -7.23 -1.26 -1.23 120.40 116.93 1l3n s VAL 7 Ca 0.05 0.40 -0.30 0.00 -1.81 0.00 0.00 61.98 60.33 1l3n s VAL 7 Cb -0.16 -4.86 -0.08 0.00 0.56 0.00 0.00 36.38 31.84 1l3n s VAL 7 CO -0.18 -1.73 0.98 -0.76 -0.31 0.00 0.00 175.10 173.10 1l3n s LEU 8 N 5.42 4.60 0.17 1.32 1.43 0.14 -4.37 118.68 127.39 1l3n s LEU 8 Ca 0.35 1.98 -0.23 0.00 -1.03 0.00 0.00 54.13 55.20 1l3n s LEU 8 Cb -0.09 -3.61 0.06 0.00 0.03 0.00 0.00 46.19 42.59 1l3n s LEU 8 CO 0.16 0.05 0.61 -0.75 0.23 0.00 0.00 176.35 176.65 1l3n s LYS 9 N -0.95 1.33 0.24 1.70 2.20 -0.21 -1.21 119.74 122.85 1l3n s LYS 9 Ca 0.43 -0.52 0.00 0.00 -0.36 0.00 0.00 55.97 55.52 1l3n s LYS 9 Cb -0.27 0.59 0.00 0.00 -1.51 0.00 0.00 37.83 36.64 1l3n s LYS 9 CO 0.33 -0.58 0.00 0.41 -0.36 0.00 0.00 175.35 175.15 1l3n n GLY 10 N -0.39 -1.67 0.13 5.54 0.00 -1.26 -1.05 105.19 106.51 1l3n n GLY 10 Ca -0.16 0.49 -0.16 0.00 0.00 0.00 0.00 46.02 46.19 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 0.46 0.00 1.61 3.32 -1.84 -3.49 116.42 116.47 1l3n h ASP 11 Ca 0.00 -0.71 0.00 0.00 0.02 0.00 0.00 57.03 56.34 1l3n h ASP 11 Cb 0.00 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.41 1l3n h ASP 11 CO 0.00 1.10 0.00 0.61 -1.72 0.00 0.00 179.24 179.23 1l3n n GLY 12 N 0.90 2.19 0.37 2.75 0.00 -1.26 -4.94 105.19 105.20 1l3n n GLY 12 Ca -0.09 -0.40 0.06 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 0.96 -4.23 1.61 0.13 -1.92 -3.28 132.00 125.27 1l3n h PRO 13 Ca 0.00 -0.06 -0.30 0.00 -0.87 0.00 0.00 66.00 64.77 1l3n h PRO 13 Cb 0.00 -0.22 0.05 0.00 0.13 0.00 0.00 31.00 30.96 1l3n h PRO 13 CO 0.00 0.64 1.54 0.28 -0.23 0.00 0.00 178.00 180.23 1l3n n VAL 14 N -4.56 0.65 -1.58 1.56 0.31 -1.07 -3.92 118.33 109.72 1l3n n VAL 14 Ca 0.17 -0.45 -0.32 0.00 -0.01 0.00 0.00 64.34 63.73 1l3n n VAL 14 Cb 0.31 -1.84 0.01 0.00 -0.91 0.00 0.00 33.84 31.40 1l3n n VAL 14 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1l3n n GLN 15 N 5.91 2.52 -1.63 5.55 10.64 -1.24 -3.71 117.38 135.41 1l3n n GLN 15 Ca 0.26 -2.86 -0.37 0.00 -1.83 0.00 0.00 57.00 52.21 1l3n n GLN 15 Cb 0.18 -2.16 0.07 0.00 -0.86 0.00 0.00 30.24 27.48 1l3n n GLN 15 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1l3n n GLY 16 N 0.03 0.27 2.54 2.61 0.00 -0.35 -4.68 105.19 105.61 1l3n n GLY 16 Ca 0.51 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 46.04 1l3n n GLY 16 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1l3n s ILE 17 N -1.50 0.56 -0.09 -0.61 1.01 0.07 0.24 121.20 120.88 1l3n s ILE 17 Ca 0.80 -2.02 -0.12 0.00 0.00 0.00 0.00 60.65 59.31 1l3n s ILE 17 Cb -0.38 -1.40 -0.05 0.00 0.01 0.00 0.00 42.46 40.64 1l3n s ILE 17 CO 0.43 -0.97 0.29 -0.63 0.00 0.00 0.00 174.94 174.06 1l3n s ILE 18 N 0.80 5.26 -0.24 2.92 -1.09 -0.36 -1.00 121.20 127.49 1l3n s ILE 18 Ca 0.18 0.56 0.02 0.00 -2.23 0.00 0.00 60.65 59.18 1l3n s ILE 18 Cb -0.22 -3.59 0.05 0.00 -1.58 0.00 0.00 42.46 37.12 1l3n s ILE 18 CO -0.00 0.53 -0.09 0.20 -1.23 0.00 0.00 174.94 174.34 1l3n s ASN 19 N -0.56 3.98 -0.28 3.58 0.02 0.33 -0.87 114.94 121.13 1l3n s ASN 19 Ca 0.19 -1.19 -0.18 0.00 -1.02 0.00 0.00 52.86 50.66 1l3n s ASN 19 Cb -0.14 -1.36 -0.02 0.00 0.02 0.00 0.00 41.25 39.75 1l3n s ASN 19 CO 0.07 -0.19 0.51 -0.36 0.02 0.00 0.00 177.10 177.16 1l3n s PHE 20 N 1.27 3.24 -0.17 2.20 0.40 0.55 -2.01 117.98 123.46 1l3n s PHE 20 Ca -0.06 0.51 0.01 0.00 -0.60 0.00 0.00 56.93 56.79 1l3n s PHE 20 Cb -0.19 -2.77 0.03 0.00 0.51 0.00 0.00 43.02 40.61 1l3n s PHE 20 CO -0.06 -0.35 -0.13 -1.21 0.70 0.00 0.00 175.22 174.17 1l3n s GLU 21 N 2.33 2.25 -0.50 0.44 2.02 0.10 -0.62 118.70 124.73 1l3n s GLU 21 Ca 0.20 -0.70 -0.15 0.00 0.02 0.00 0.00 54.97 54.35 1l3n s GLU 21 Cb -0.16 -2.27 0.10 0.00 0.10 0.00 0.00 34.13 31.91 1l3n s GLU 21 CO 0.10 -0.31 0.42 -1.14 0.02 0.00 0.00 175.26 174.36 1l3n s GLN 22 N 1.43 2.91 0.12 1.61 0.74 0.27 -0.78 119.66 125.97 1l3n s GLN 22 Ca 0.02 -1.54 -0.25 0.00 0.05 0.00 0.00 55.36 53.64 1l3n s GLN 22 Cb -0.14 -4.16 -0.05 0.00 1.10 0.00 0.00 33.01 29.77 1l3n s GLN 22 CO -0.10 -1.16 1.64 0.87 -0.55 0.00 0.00 175.29 175.99 1l3n h LYS 23 N 8.76 -0.34 -4.96 1.67 1.79 -1.82 -3.43 116.57 118.23 1l3n h LYS 23 Ca -0.28 0.02 -0.51 0.00 -2.18 0.00 0.00 60.65 57.70 1l3n h LYS 23 Cb 1.10 0.08 -0.13 0.00 -1.58 0.00 0.00 32.23 31.70 1l3n h LYS 23 CO 0.93 -0.23 -0.51 -2.00 -1.08 0.00 0.00 179.45 176.57 1l3n s GLU 24 N -6.08 1.84 0.55 3.15 -6.30 -1.26 -4.98 118.70 105.61 1l3n s GLU 24 Ca -0.15 -2.10 0.33 0.00 -2.50 0.00 0.00 54.97 50.55 1l3n s GLU 24 Cb 0.09 -0.17 1.36 0.00 0.00 0.00 0.00 34.13 35.41 1l3n s GLU 24 CO 0.66 -0.56 1.98 1.03 0.02 0.00 0.00 175.26 178.40 1l3n h SER 25 N 1.96 0.00 1.77 -1.70 0.87 -1.96 -0.63 113.55 113.86 1l3n h SER 25 Ca -0.31 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.21 1l3n h SER 25 Cb 1.26 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.21 1l3n h SER 25 CO 0.48 0.02 -0.18 0.78 -0.53 0.00 0.00 176.83 177.39 1l3n h ASN 26 N 0.00 0.00 -4.05 6.23 2.35 -1.97 -3.46 115.58 114.68 1l3n h ASN 26 Ca -0.00 0.00 -0.45 0.00 -0.55 0.00 0.00 56.30 55.30 1l3n h ASN 26 Cb 0.52 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 1l3n h ASN 26 CO 0.00 0.18 0.35 -0.83 -1.65 0.00 0.00 177.43 175.49 1l3n s GLY 27 N -4.30 2.45 0.81 2.83 0.00 -0.24 -5.05 107.32 103.82 1l3n s GLY 27 Ca 0.06 0.47 -0.11 0.00 0.00 0.00 0.00 44.72 45.14 1l3n s GLY 27 CO 0.69 0.77 1.11 2.56 0.00 0.00 0.00 173.10 178.24 1l3n s PRO 28 N -3.13 1.88 -0.82 2.90 0.04 -1.26 -4.72 135.00 129.89 1l3n s PRO 28 Ca 0.63 1.30 -0.26 0.00 0.04 0.00 0.00 61.00 62.71 1l3n s PRO 28 Cb -0.12 -1.84 0.03 0.00 0.04 0.00 0.00 34.50 32.60 1l3n s PRO 28 CO 0.16 -1.94 1.43 0.08 0.04 0.00 0.00 177.00 176.77 1l3n s VAL 29 N -2.80 3.73 -0.62 -0.36 1.01 0.62 -4.34 120.40 117.62 1l3n s VAL 29 Ca 0.63 -0.02 -0.27 0.00 0.00 0.00 0.00 61.98 62.33 1l3n s VAL 29 Cb -0.19 -4.80 -0.01 0.00 0.00 0.00 0.00 36.38 31.38 1l3n s VAL 29 CO 0.56 -1.73 1.73 -0.54 0.00 0.00 0.00 175.10 175.12 1l3n s LYS 30 N 5.72 2.79 -0.61 2.72 1.02 0.04 -0.72 119.74 130.70 1l3n s LYS 30 Ca 0.44 0.47 -0.16 0.00 0.02 0.00 0.00 55.97 56.74 1l3n s LYS 30 Cb -0.06 -4.33 0.15 0.00 -0.52 0.00 0.00 37.83 33.07 1l3n s LYS 30 CO 0.07 -2.56 0.58 0.54 -0.92 0.00 0.00 175.35 173.06 1l3n s VAL 31 N 8.23 5.27 0.40 3.17 0.11 0.11 -0.72 120.40 136.97 1l3n s VAL 31 Ca 0.61 -1.68 0.08 0.00 -2.93 0.00 0.00 61.98 58.05 1l3n s VAL 31 Cb -0.12 -4.38 -0.03 0.00 -1.53 0.00 0.00 36.38 30.32 1l3n s VAL 31 CO 0.20 -0.93 0.30 -1.66 -3.33 0.00 0.00 175.10 169.69 1l3n s TRP 32 N 1.37 2.71 -4.61 1.54 -2.14 -0.85 -1.04 118.94 115.91 1l3n s TRP 32 Ca 0.07 -0.48 0.00 0.00 2.66 0.00 0.00 56.10 58.35 1l3n s TRP 32 Cb -0.25 -2.04 0.00 0.00 -3.10 0.00 0.00 33.47 28.08 1l3n s TRP 32 CO 0.00 0.02 0.00 0.41 -2.66 0.00 0.00 176.95 174.72 1l3n n GLY 33 N -1.43 -1.24 3.07 3.67 0.00 0.83 -0.52 105.19 109.57 1l3n n GLY 33 Ca 0.01 -1.18 -0.12 0.00 0.00 0.00 0.00 46.02 44.73 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 0.08 -0.68 1.61 0.01 -0.17 -0.76 113.70 109.80 1l3n s SER 34 Ca 0.00 0.65 -0.15 0.00 1.31 0.00 0.00 55.95 57.76 1l3n s SER 34 Cb 0.00 0.72 0.17 0.00 0.21 0.00 0.00 66.02 67.12 1l3n s SER 34 CO 0.00 -0.22 0.64 0.27 0.41 0.00 0.00 173.24 174.34 1l3n s ILE 35 N 2.13 5.36 -0.45 1.44 -4.36 0.37 -0.75 121.20 124.94 1l3n s ILE 35 Ca -0.02 -1.91 -0.10 0.00 -0.26 0.00 0.00 60.65 58.36 1l3n s ILE 35 Cb -0.11 -4.41 0.10 0.00 1.25 0.00 0.00 42.46 39.28 1l3n s ILE 35 CO -0.09 -0.97 0.32 -1.59 0.24 0.00 0.00 174.94 172.85 1l3n s LYS 36 N 1.04 2.59 0.00 0.37 -2.85 -1.26 -0.41 119.74 119.22 1l3n s LYS 36 Ca 0.11 -1.60 0.00 0.00 -1.00 0.00 0.00 55.97 53.47 1l3n s LYS 36 Cb -0.20 -3.89 0.00 0.00 -2.06 0.00 0.00 37.83 31.67 1l3n s LYS 36 CO -0.02 -1.09 0.00 0.41 0.10 0.00 0.00 175.35 174.75 1l3n n GLY 37 N 4.95 0.00 3.57 0.59 0.00 0.38 -3.71 105.19 110.98 1l3n n GLY 37 Ca -0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 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 2.18 0.70 0.99 -0.00 -1.13 -2.59 118.68 118.83 1l3n s LEU 38 Ca 0.00 -1.59 -0.11 0.00 -0.00 0.00 0.00 54.13 52.43 1l3n s LEU 38 Cb 0.00 -0.39 0.01 0.00 -0.00 0.00 0.00 46.19 45.81 1l3n s LEU 38 CO 0.00 -0.81 1.06 0.28 -0.00 0.00 0.00 176.35 176.88 1l3n s THR 39 N -3.10 4.01 0.92 5.48 -1.32 -1.26 -3.92 115.64 116.46 1l3n s THR 39 Ca 0.22 0.65 -0.15 0.00 -1.21 0.00 0.00 61.69 61.20 1l3n s THR 39 Cb 0.04 -3.42 0.24 0.00 -1.51 0.00 0.00 72.50 67.85 1l3n s THR 39 CO 0.12 -0.85 0.60 -1.84 -2.21 0.00 0.00 174.62 170.43 1l3n n GLU 40 N -3.12 -3.57 0.00 7.08 0.28 -1.26 -4.78 120.64 115.28 1l3n n GLU 40 Ca 0.07 -0.99 0.00 0.00 -0.16 0.00 0.00 57.16 56.08 1l3n n GLU 40 Cb 0.54 -1.20 0.00 0.00 1.43 0.00 0.00 31.44 32.21 1l3n n GLU 40 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1l3n n GLY 41 N -3.43 -2.84 3.78 -1.84 0.00 0.19 -4.75 105.19 96.29 1l3n n GLY 41 Ca 0.09 -1.75 -0.35 0.00 0.00 0.00 0.00 46.02 44.02 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 3.74 -0.00 0.99 2.01 -1.26 -0.26 118.68 123.90 1l3n s LEU 42 Ca 0.00 2.14 -0.07 0.00 0.01 0.00 0.00 54.13 56.21 1l3n s LEU 42 Cb 0.00 -4.58 0.00 0.00 0.01 0.00 0.00 46.19 41.62 1l3n s LEU 42 CO 0.00 -1.20 0.13 -1.00 1.01 0.00 0.00 176.35 175.30 1l3n s HIS 43 N -1.82 0.03 -0.21 0.29 3.76 0.18 -2.55 115.29 114.97 1l3n s HIS 43 Ca 0.72 -0.10 -0.23 0.00 -0.15 0.00 0.00 55.06 55.30 1l3n s HIS 43 Cb -0.23 -0.04 -0.10 0.00 1.11 0.00 0.00 32.58 33.32 1l3n s HIS 43 CO 0.27 -0.27 0.76 0.41 -0.85 0.00 0.00 174.74 175.06 1l3n n GLY 44 N 1.59 0.05 2.86 -2.22 0.00 0.11 -1.26 105.19 106.33 1l3n n GLY 44 Ca -0.22 0.49 -0.12 0.00 0.00 0.00 0.00 46.02 46.17 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 1.25 -0.68 0.22 1.61 2.19 -1.26 -2.04 117.98 119.26 1l3n s PHE 45 Ca 0.52 0.51 -0.10 0.00 0.33 0.00 0.00 56.93 58.19 1l3n s PHE 45 Cb -0.74 -0.14 -0.01 0.00 -1.31 0.00 0.00 43.02 40.82 1l3n s PHE 45 CO 0.39 -0.75 0.39 -1.01 1.83 0.00 0.00 175.22 176.07 1l3n s HIS 46 N 2.48 0.47 0.02 10.12 0.09 -1.08 -1.99 115.29 125.41 1l3n s HIS 46 Ca 0.11 -0.81 -0.10 0.00 -0.00 0.00 0.00 55.06 54.26 1l3n s HIS 46 Cb -0.15 0.03 -0.05 0.00 -0.00 0.00 0.00 32.58 32.41 1l3n s HIS 46 CO -0.19 -0.88 0.34 0.08 -0.00 0.00 0.00 174.74 174.10 1l3n s VAL 47 N -4.02 5.17 0.13 -0.90 1.01 0.59 -1.17 120.40 121.20 1l3n s VAL 47 Ca 0.23 0.45 0.08 0.00 0.00 0.00 0.00 61.98 62.74 1l3n s VAL 47 Cb 0.01 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 1l3n s VAL 47 CO 0.07 0.41 -0.19 -1.00 0.00 0.00 0.00 175.10 174.38 1l3n s HIS 48 N -1.27 1.75 0.05 5.22 3.76 0.10 -4.70 115.29 120.21 1l3n s HIS 48 Ca 0.28 -0.45 -0.29 0.00 -0.15 0.00 0.00 55.06 54.45 1l3n s HIS 48 Cb -0.14 -0.93 -0.18 0.00 1.11 0.00 0.00 32.58 32.45 1l3n s HIS 48 CO 0.15 0.24 1.49 1.49 -0.85 0.00 0.00 174.74 177.26 1l3n h GLU 49 N 3.74 -0.68 -6.41 1.40 4.57 -1.80 -3.06 114.58 112.34 1l3n h GLU 49 Ca -0.44 0.05 -0.55 0.00 -1.18 0.00 0.00 59.36 57.24 1l3n h GLU 49 Cb 1.19 0.15 -0.06 0.00 -0.16 0.00 0.00 28.75 29.87 1l3n h GLU 49 CO 0.45 -0.40 1.10 -0.06 -1.18 0.00 0.00 179.01 178.91 1l3n s PHE 50 N -5.57 2.29 0.26 0.92 0.40 -1.26 -4.64 117.98 110.38 1l3n s PHE 50 Ca -0.16 0.45 -0.01 0.00 -0.60 0.00 0.00 56.93 56.61 1l3n s PHE 50 Cb 0.03 -4.40 0.35 0.00 0.51 0.00 0.00 43.02 39.51 1l3n s PHE 50 CO 0.59 -1.97 1.75 0.78 0.70 0.00 0.00 175.22 177.07 1l3n h GLY 51 N 13.07 0.78 -1.74 4.36 0.00 -1.79 -3.39 103.07 114.38 1l3n h GLY 51 Ca -0.27 -0.54 -0.52 0.00 0.00 0.00 0.00 47.33 46.00 1l3n h GLY 51 CO 1.18 0.50 -0.44 2.09 0.00 0.00 0.00 176.54 179.88 1l3n n ASP 52 N -4.20 -1.62 -0.64 0.19 5.68 -1.26 -4.61 116.55 110.09 1l3n n ASP 52 Ca 0.02 0.30 -0.01 0.00 -0.50 0.00 0.00 54.79 54.60 1l3n n ASP 52 Cb 0.32 -1.24 -0.01 0.00 -1.14 0.00 0.00 41.12 39.04 1l3n n ASP 52 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1l3n n ASN 53 N -2.04 -0.15 -0.33 -1.12 2.85 -1.26 -4.61 115.26 108.60 1l3n n ASN 53 Ca 0.07 -1.38 0.22 0.00 -0.11 0.00 0.00 54.58 53.38 1l3n n ASN 53 Cb 0.54 0.02 0.49 0.00 1.24 0.00 0.00 39.78 42.06 1l3n n ASN 53 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 1l3n h THR 54 N 5.37 0.53 0.00 -0.44 1.35 -1.98 0.24 112.91 117.98 1l3n h THR 54 Ca -0.12 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1l3n h THR 54 Cb 1.18 0.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.66 1l3n h THR 54 CO -0.05 0.08 0.00 0.00 -0.25 0.00 0.00 175.52 175.30 1l3n h ALA 55 N 1.64 1.00 -3.16 6.62 0.00 -1.95 -3.49 119.26 119.91 1l3n h ALA 55 Ca 0.60 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.51 1l3n h ALA 55 Cb 1.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.25 1l3n h ALA 55 CO -0.32 0.00 -0.05 0.41 0.00 0.00 0.00 179.25 179.29 1l3n n GLY 56 N 0.89 -1.65 3.43 0.00 0.00 0.86 -4.43 105.19 104.29 1l3n n GLY 56 Ca 0.04 -0.09 -0.23 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.79 0.16 -1.10 0.00 -1.04 -1.26 -4.65 114.28 102.59 1l3n n THR 58 Ca 0.00 0.05 -0.03 0.00 -2.04 0.00 0.00 64.05 62.03 1l3n n THR 58 Cb 0.52 -1.04 0.28 0.00 -1.82 0.00 0.00 70.33 68.27 1l3n n THR 58 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1l3n n SER 59 N -2.94 4.29 -1.87 8.00 2.88 -1.26 -4.72 113.62 118.00 1l3n n SER 59 Ca 0.00 -3.28 -0.07 0.00 -1.33 0.00 0.00 58.87 54.19 1l3n n SER 59 Cb 0.20 -0.69 -0.10 0.00 -0.75 0.00 0.00 64.21 62.86 1l3n n SER 59 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1l3n n ALA 60 N -0.40 5.18 -2.67 -1.46 0.00 -1.26 -4.84 120.51 115.06 1l3n n ALA 60 Ca 0.37 -1.09 -0.05 0.00 0.00 0.00 0.00 53.44 52.67 1l3n n ALA 60 Cb 1.25 -1.89 -0.04 0.00 0.00 0.00 0.00 19.45 18.78 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 2.19 -4.35 3.32 0.00 0.00 -1.26 -4.30 105.19 100.79 1l3n n GLY 61 Ca 0.26 1.43 -0.37 0.00 0.00 0.00 0.00 46.02 47.33 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 1.89 1.30 -3.49 1.61 -0.04 -1.26 -4.06 135.00 130.95 1l3n n PRO 62 Ca -0.33 -1.95 -0.20 0.00 -0.04 0.00 0.00 63.50 60.97 1l3n n PRO 62 Cb 0.52 -3.19 0.08 0.00 -0.04 0.00 0.00 33.50 30.87 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 10.53 -2.52 -1.00 0.54 8.25 -1.26 -4.84 115.22 124.92 1l3n n HIS 63 Ca 0.47 0.95 -0.41 0.00 -0.26 0.00 0.00 57.72 58.48 1l3n n HIS 63 Cb 0.43 -4.95 -0.06 0.00 1.12 0.00 0.00 29.99 26.53 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 -4.55 1.53 -2.73 4.41 3.72 -1.26 -4.91 117.46 113.67 1l3n n PHE 64 Ca -0.11 -1.62 -0.31 0.00 -0.05 0.00 0.00 57.45 55.36 1l3n n PHE 64 Cb 0.60 -1.55 -0.03 0.00 -0.94 0.00 0.00 39.48 37.56 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 5.12 6.53 0.10 4.37 2.20 -1.26 -4.66 114.94 127.34 1l3n s ASN 65 Ca 0.56 1.23 -0.16 0.00 -0.94 0.00 0.00 52.86 53.54 1l3n s ASN 65 Cb 0.14 -2.36 -0.06 0.00 -2.00 0.00 0.00 41.25 36.97 1l3n s ASN 65 CO 0.13 -0.46 1.51 1.55 -2.94 0.00 0.00 177.10 176.89 1l3n h PRO 66 N 1.12 0.61 -2.50 3.55 0.13 -1.91 -3.29 132.00 129.71 1l3n h PRO 66 Ca -0.47 -0.23 -0.31 0.00 -0.87 0.00 0.00 66.00 64.12 1l3n h PRO 66 Cb 1.19 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.25 1l3n h PRO 66 CO 0.63 0.78 1.06 1.28 -0.23 0.00 0.00 178.00 181.52 1l3n n LEU 67 N -4.47 5.57 -4.52 1.56 4.77 -1.26 -4.93 117.00 113.72 1l3n n LEU 67 Ca -0.03 -3.18 -0.56 0.00 -0.03 0.00 0.00 56.01 52.21 1l3n n LEU 67 Cb 0.32 -1.28 -0.08 0.00 -2.33 0.00 0.00 43.42 40.04 1l3n n LEU 67 CO 0.41 1.46 1.58 -0.24 -1.33 0.00 0.00 177.39 179.27 1l3n n SER 68 N 3.00 1.94 -3.20 -1.43 2.88 -1.24 -4.88 113.62 110.68 1l3n n SER 68 Ca 0.48 0.75 -0.13 0.00 -1.33 0.00 0.00 58.87 58.64 1l3n n SER 68 Cb 0.58 -1.13 -0.02 0.00 -0.75 0.00 0.00 64.21 62.88 1l3n n SER 68 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1l3n s ARG 69 N 5.04 1.98 0.28 -1.46 0.52 -1.26 -5.14 118.95 118.91 1l3n s ARG 69 Ca 1.07 -1.63 -0.29 0.00 -0.52 0.00 0.00 55.73 54.36 1l3n s ARG 69 Cb -1.09 0.50 -0.09 0.00 0.52 0.00 0.00 34.95 34.79 1l3n s ARG 69 CO 0.60 -0.86 0.98 0.15 0.02 0.00 0.00 175.30 176.19 1l3n s LYS 70 N -2.91 4.71 -0.38 3.54 -0.14 -1.25 -4.82 119.74 118.50 1l3n s LYS 70 Ca 0.26 1.50 -0.42 0.00 -1.36 0.00 0.00 55.97 55.95 1l3n s LYS 70 Cb -0.02 -3.10 -0.17 0.00 -1.68 0.00 0.00 37.83 32.87 1l3n s LYS 70 CO 0.17 0.37 1.79 1.58 -0.76 0.00 0.00 175.35 178.49 1l3n n HIS 71 N 1.11 1.83 -0.33 3.18 -0.00 -0.22 -3.53 115.22 117.26 1l3n n HIS 71 Ca -0.00 0.72 0.00 0.00 -0.00 0.00 0.00 57.72 58.44 1l3n n HIS 71 Cb 0.48 -2.38 0.00 0.00 -0.00 0.00 0.00 29.99 28.09 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 4.71 5.58 2.10 1.57 0.00 -1.26 -2.07 105.19 115.83 1l3n n GLY 72 Ca 0.32 -1.05 -0.04 0.00 0.00 0.00 0.00 46.02 45.25 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 0.86 1.29 0.00 -0.02 0.00 -1.26 -4.67 105.19 101.40 1l3n n GLY 73 Ca 0.00 -1.12 0.01 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.33 0.33 0.00 1.61 -0.04 -1.25 -0.60 135.00 134.72 1l3n n PRO 74 Ca -0.04 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.48 1l3n n PRO 74 Cb 0.33 -1.12 -0.12 0.00 -0.04 0.00 0.00 33.50 32.55 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 -0.62 0.65 -2.69 0.54 4.76 -1.26 -5.05 118.16 114.50 1l3n n LYS 75 Ca 0.02 -0.04 -0.08 0.00 -2.87 0.00 0.00 58.31 55.34 1l3n n LYS 75 Cb 0.01 -1.62 -0.02 0.00 -1.84 0.00 0.00 35.03 31.56 1l3n n LYS 75 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1l3n n ASP 76 N -2.51 1.54 -0.09 4.39 5.75 0.23 -5.07 116.55 120.79 1l3n n ASP 76 Ca -0.09 -1.60 0.03 0.00 -0.01 0.00 0.00 54.79 53.12 1l3n n ASP 76 Cb 0.70 0.21 -0.01 0.00 -1.03 0.00 0.00 41.12 40.99 1l3n n ASP 76 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1l3n n GLU 77 N -0.29 3.21 -0.00 0.11 1.02 -1.26 -4.56 120.64 118.86 1l3n n GLU 77 Ca -0.03 -0.32 0.10 0.00 -0.02 0.00 0.00 57.16 56.89 1l3n n GLU 77 Cb 0.17 -0.88 -0.14 0.00 -0.02 0.00 0.00 31.44 30.57 1l3n n GLU 77 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1l3n n GLU 78 N -0.57 0.42 -0.45 3.49 1.02 -1.26 -4.98 120.64 118.31 1l3n n GLU 78 Ca 0.02 -0.08 -0.19 0.00 -0.02 0.00 0.00 57.16 56.88 1l3n n GLU 78 Cb 0.11 -1.48 -0.03 0.00 -0.02 0.00 0.00 31.44 30.01 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 -1.81 0.00 0.01 3.49 -4.01 -1.23 -3.79 116.66 109.33 1l3n n ARG 79 Ca 0.01 0.00 -0.10 0.00 -1.04 0.00 0.00 57.85 56.72 1l3n n ARG 79 Cb 0.42 -0.46 -0.03 0.00 -3.04 0.00 0.00 32.46 29.35 1l3n n ARG 79 CO 0.00 0.00 0.00 0.45 -3.04 0.00 0.00 177.63 175.04 1l3n h HIS 80 N 2.17 -0.57 0.00 2.89 3.86 -1.86 -3.46 115.15 118.18 1l3n h HIS 80 Ca -0.08 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 1l3n h HIS 80 Cb 0.43 0.27 0.00 0.00 1.06 0.00 0.00 27.41 29.17 1l3n h HIS 80 CO 0.25 -0.30 0.00 1.55 0.86 0.00 0.00 177.93 180.29 1l3n n VAL 81 N -5.35 0.00 -1.06 2.45 3.14 -1.26 -4.60 118.33 111.64 1l3n n VAL 81 Ca -0.03 0.00 -0.31 0.00 -2.96 0.00 0.00 64.34 61.04 1l3n n VAL 81 Cb 0.26 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.01 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 0.00 3.73 3.50 7.55 0.00 -1.26 -4.81 105.19 113.90 1l3n n GLY 82 Ca 0.00 -1.22 -0.43 0.00 0.00 0.00 0.00 46.02 44.37 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 2.64 6.31 0.40 1.61 1.01 -1.26 -0.30 116.67 127.07 1l3n s ASP 83 Ca 0.58 -0.46 0.23 0.00 0.71 0.00 0.00 52.55 53.61 1l3n s ASP 83 Cb 0.16 -2.34 0.29 0.00 1.01 0.00 0.00 42.92 42.04 1l3n s ASP 83 CO -0.05 -0.90 1.52 -0.07 0.21 0.00 0.00 175.17 175.89 1l3n h LEU 84 N 9.96 0.00 0.00 1.23 -0.00 -1.71 -3.34 115.31 121.45 1l3n h LEU 84 Ca -0.26 -0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.62 1l3n h LEU 84 Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.75 1l3n h LEU 84 CO 0.95 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 180.00 1l3n n GLY 85 N 1.12 1.60 3.34 0.83 0.00 -1.25 -4.49 105.19 106.33 1l3n n GLY 85 Ca 0.03 -0.77 -0.11 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 -0.32 -0.10 1.61 0.01 -1.26 -4.36 114.94 106.52 1l3n s ASN 86 Ca 0.00 -0.21 0.02 0.00 -0.71 0.00 0.00 52.86 51.96 1l3n s ASN 86 Cb 0.00 0.50 0.01 0.00 0.41 0.00 0.00 41.25 42.17 1l3n s ASN 86 CO 0.00 -0.86 -0.14 0.68 -1.51 0.00 0.00 177.10 175.26 1l3n s VAL 87 N -3.67 1.40 -0.13 1.60 -7.23 -0.39 -4.89 120.40 107.10 1l3n s VAL 87 Ca 0.02 -0.60 -0.29 0.00 -1.81 0.00 0.00 61.98 59.29 1l3n s VAL 87 Cb 0.01 -1.28 -0.01 0.00 0.56 0.00 0.00 36.38 35.66 1l3n s VAL 87 CO -0.11 0.42 1.01 -0.89 -0.31 0.00 0.00 175.10 175.22 1l3n s THR 88 N 0.90 4.77 -0.19 5.32 2.01 -1.26 -0.64 115.64 126.55 1l3n s THR 88 Ca -0.09 2.03 -0.08 0.00 0.31 0.00 0.00 61.69 63.86 1l3n s THR 88 Cb -0.15 -4.31 -0.04 0.00 0.01 0.00 0.00 72.50 68.01 1l3n s THR 88 CO 0.00 -0.03 0.08 0.00 -0.69 0.00 0.00 174.62 173.99 1l3n s ALA 89 N 2.21 3.47 1.17 7.40 0.00 0.64 -3.72 121.76 132.94 1l3n s ALA 89 Ca 0.47 -0.75 -0.15 0.00 0.00 0.00 0.00 51.96 51.54 1l3n s ALA 89 Cb -0.18 -1.99 0.27 0.00 0.00 0.00 0.00 23.12 21.22 1l3n s ALA 89 CO 0.16 0.15 1.04 0.34 0.00 0.00 0.00 175.76 177.45 1l3n s ASP 90 N 0.42 1.08 0.44 0.00 -1.08 -0.02 -0.64 116.67 116.86 1l3n s ASP 90 Ca 0.04 1.18 0.24 0.00 -0.52 0.00 0.00 52.55 53.49 1l3n s ASP 90 Cb -0.12 -1.81 1.24 0.00 -1.46 0.00 0.00 42.92 40.76 1l3n s ASP 90 CO -0.00 -4.09 1.78 0.07 0.52 0.00 0.00 175.17 173.45 1l3n h LYS 91 N -2.55 0.26 0.00 4.34 2.10 -1.96 0.95 116.57 119.71 1l3n h LYS 91 Ca -0.56 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.08 1l3n h LYS 91 Cb 1.33 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 1l3n h LYS 91 CO 0.48 0.17 0.00 -0.25 -2.00 0.00 0.00 179.45 177.85 1l3n n ASP 92 N -4.51 0.00 -0.16 7.07 8.00 -1.26 -4.67 116.55 121.02 1l3n n ASP 92 Ca 0.26 -0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.73 1l3n n ASP 92 Cb 0.99 -0.33 -0.01 0.00 -0.02 0.00 0.00 41.12 41.76 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 1.19 0.50 3.38 0.44 0.00 0.33 -4.75 105.19 106.28 1l3n n GLY 93 Ca 0.12 -0.97 -0.43 0.00 0.00 0.00 0.00 46.02 44.74 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 -2.08 4.97 -0.27 1.61 1.01 -1.26 -0.47 120.40 123.93 1l3n s VAL 94 Ca 0.00 -1.02 -0.10 0.00 0.00 0.00 0.00 61.98 60.86 1l3n s VAL 94 Cb 0.00 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 1l3n s VAL 94 CO 0.00 -0.47 0.15 0.00 0.00 0.00 0.00 175.10 174.78 1l3n s ALA 95 N 1.60 3.42 -0.01 5.51 0.00 0.45 -0.84 121.76 131.89 1l3n s ALA 95 Ca 0.04 -1.09 -0.21 0.00 0.00 0.00 0.00 51.96 50.70 1l3n s ALA 95 Cb -0.22 -2.34 -0.05 0.00 0.00 0.00 0.00 23.12 20.50 1l3n s ALA 95 CO 0.06 -0.50 0.60 0.34 0.00 0.00 0.00 175.76 176.26 1l3n s ASP 96 N 1.66 6.97 -0.14 0.00 -1.08 -1.24 -0.48 116.67 122.37 1l3n s ASP 96 Ca 0.07 1.16 -0.03 0.00 -0.52 0.00 0.00 52.55 53.23 1l3n s ASP 96 Cb -0.16 -2.37 -0.03 0.00 -1.46 0.00 0.00 42.92 38.91 1l3n s ASP 96 CO 0.08 0.09 -0.05 -0.69 0.52 0.00 0.00 175.17 175.13 1l3n s VAL 97 N -0.14 3.80 -0.46 1.11 1.01 0.06 -4.61 120.40 121.17 1l3n s VAL 97 Ca 0.31 -0.40 0.07 0.00 0.00 0.00 0.00 61.98 61.96 1l3n s VAL 97 Cb -0.18 -2.64 0.26 0.00 0.00 0.00 0.00 36.38 33.82 1l3n s VAL 97 CO 0.17 0.52 0.83 -1.20 0.00 0.00 0.00 175.10 175.42 1l3n n SER 98 N 3.29 -2.02 -4.55 3.32 7.64 -1.25 -0.12 113.62 119.92 1l3n n SER 98 Ca -0.18 -3.21 -0.24 0.00 1.01 0.00 0.00 58.87 56.26 1l3n n SER 98 Cb 0.53 1.21 -0.09 0.00 -1.01 0.00 0.00 64.21 64.84 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 0.11 2.81 -0.08 0.44 1.09 -0.21 -4.95 121.20 120.41 1l3n s ILE 99 Ca 0.32 -2.18 0.00 0.00 -1.10 0.00 0.00 60.65 57.69 1l3n s ILE 99 Cb 0.23 -2.56 0.02 0.00 -1.06 0.00 0.00 42.46 39.09 1l3n s ILE 99 CO -0.19 -0.36 -0.06 -1.83 -0.10 0.00 0.00 174.94 172.40 1l3n s GLU 100 N -3.59 1.17 -0.19 2.79 -1.05 -1.26 0.05 118.70 116.61 1l3n s GLU 100 Ca 0.31 -0.16 -0.07 0.00 -0.15 0.00 0.00 54.97 54.90 1l3n s GLU 100 Cb -0.05 -1.23 -0.04 0.00 -0.44 0.00 0.00 34.13 32.38 1l3n s GLU 100 CO 0.17 -0.18 0.06 0.34 0.95 0.00 0.00 175.26 176.60 1l3n s ASP 101 N 1.41 5.49 -0.39 0.83 -1.08 0.10 -4.88 116.67 118.15 1l3n s ASP 101 Ca -0.02 0.01 0.05 0.00 -0.52 0.00 0.00 52.55 52.07 1l3n s ASP 101 Cb -0.13 -1.95 0.46 0.00 -1.46 0.00 0.00 42.92 39.84 1l3n s ASP 101 CO -0.04 0.13 1.47 -1.54 0.52 0.00 0.00 175.17 175.71 1l3n n SER 102 N 3.81 5.24 0.00 -0.34 3.41 -1.26 -0.28 113.62 124.20 1l3n n SER 102 Ca -0.16 -3.77 0.00 0.00 -0.26 0.00 0.00 58.87 54.67 1l3n n SER 102 Cb 0.52 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 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 -0.84 0.00 -2.49 -3.33 3.14 -1.26 -5.07 118.33 108.47 1l3n n VAL 103 Ca 0.47 0.00 -0.24 0.00 -2.96 0.00 0.00 64.34 61.61 1l3n n VAL 103 Cb 0.89 -0.27 0.10 0.00 -1.06 0.00 0.00 33.84 33.50 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 -1.52 2.22 0.07 1.55 -5.25 -1.26 -5.02 121.20 111.99 1l3n s ILE 104 Ca 0.00 -0.51 -0.08 0.00 -0.99 0.00 0.00 60.65 59.06 1l3n s ILE 104 Cb 0.00 -2.71 -0.00 0.00 2.95 0.00 0.00 42.46 42.70 1l3n s ILE 104 CO 0.00 0.00 0.17 -0.94 -1.79 0.00 0.00 174.94 172.38 1l3n s SER 105 N -4.68 0.13 0.05 4.36 1.04 -1.26 -4.67 113.70 108.67 1l3n s SER 105 Ca 0.65 -0.61 0.16 0.00 0.48 0.00 0.00 55.95 56.63 1l3n s SER 105 Cb -0.07 0.32 -0.15 0.00 0.10 0.00 0.00 66.02 66.22 1l3n s SER 105 CO 0.44 -0.68 0.81 -0.07 0.98 0.00 0.00 173.24 174.73 1l3n h LEU 106 N 2.95 0.00 -5.03 2.42 4.07 -1.93 0.91 115.31 118.70 1l3n h LEU 106 Ca -0.34 0.00 -0.23 0.00 0.08 0.00 0.00 57.88 57.40 1l3n h LEU 106 Cb 1.19 0.00 -0.20 0.00 1.08 0.00 0.00 40.66 42.73 1l3n h LEU 106 CO 0.55 0.66 -0.50 -0.24 -1.08 0.00 0.00 178.44 177.83 1l3n n SER 107 N -2.93 -1.09 -2.93 -0.43 2.88 -1.26 -4.40 113.62 103.46 1l3n n SER 107 Ca -0.11 -2.40 -0.14 0.00 -1.33 0.00 0.00 58.87 54.89 1l3n n SER 107 Cb 0.88 0.61 -0.00 0.00 -0.75 0.00 0.00 64.21 64.95 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 -0.79 1.14 5.00 0.46 0.00 -1.26 -4.88 105.19 104.85 1l3n n GLY 108 Ca -0.05 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.44 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 1.61 0.00 0.05 1.61 -0.08 -1.26 -4.40 116.55 114.08 1l3n n ASP 109 Ca 0.14 0.00 -0.14 0.00 -1.51 0.00 0.00 54.79 53.28 1l3n n ASP 109 Cb 0.59 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 44.00 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 0.71 -6.30 -0.67 -0.00 -1.94 -3.47 115.15 103.47 1l3n h HIS 110 Ca 0.00 -0.37 -0.40 0.00 -0.00 0.00 0.00 60.37 59.60 1l3n h HIS 110 Cb 0.00 -0.09 0.01 0.00 -0.00 0.00 0.00 27.41 27.33 1l3n h HIS 110 CO 0.00 1.18 -1.05 0.45 -0.00 0.00 0.00 177.93 178.51 1l3n n SER 111 N -3.79 -4.58 0.00 2.45 2.88 -0.87 -4.80 113.62 104.90 1l3n n SER 111 Ca -0.07 -0.48 0.01 0.00 -1.33 0.00 0.00 58.87 57.00 1l3n n SER 111 Cb 0.81 -1.41 0.06 0.00 -0.75 0.00 0.00 64.21 62.92 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 1.69 -1.57 2.46 -5.35 0.26 -4.71 119.36 110.96 1l3n n ILE 112 Ca -0.18 0.42 -0.55 0.00 -0.27 0.00 0.00 62.75 62.18 1l3n n ILE 112 Cb 0.62 -1.37 -0.07 0.00 -1.74 0.00 0.00 39.64 37.08 1l3n n ILE 112 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 1l3n n ILE 113 N -1.47 0.01 -0.50 7.28 2.08 -1.26 -1.18 119.36 124.32 1l3n n ILE 113 Ca 0.01 -0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.32 1l3n n ILE 113 Cb 0.03 -0.55 0.00 0.00 -0.75 0.00 0.00 39.64 38.37 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 2.27 1.36 3.87 7.39 0.00 -0.05 -5.00 105.19 115.03 1l3n n GLY 114 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.24 0.71 -0.05 1.61 1.81 -0.32 -3.87 118.95 118.60 1l3n s ARG 115 Ca 0.00 -0.20 0.05 0.00 -1.72 0.00 0.00 55.73 53.86 1l3n s ARG 115 Cb 0.00 -1.83 -0.01 0.00 -0.45 0.00 0.00 34.95 32.66 1l3n s ARG 115 CO 0.00 -2.40 -0.21 0.99 -0.68 0.00 0.00 175.30 173.01 1l3n s THR 116 N -3.66 1.70 0.20 0.02 2.01 -1.16 -0.80 115.64 113.96 1l3n s THR 116 Ca 0.70 -0.87 -0.13 0.00 0.31 0.00 0.00 61.69 61.70 1l3n s THR 116 Cb -0.07 -1.45 -0.07 0.00 0.01 0.00 0.00 72.50 70.92 1l3n s THR 116 CO 0.53 0.48 0.59 -0.76 -0.69 0.00 0.00 174.62 174.76 1l3n s LEU 117 N -0.04 4.25 -0.05 4.42 2.01 0.69 0.01 118.68 129.96 1l3n s LEU 117 Ca -0.04 1.08 0.03 0.00 0.01 0.00 0.00 54.13 55.20 1l3n s LEU 117 Cb -0.13 -3.53 0.01 0.00 0.01 0.00 0.00 46.19 42.55 1l3n s LEU 117 CO 0.03 0.00 -0.12 -0.69 1.01 0.00 0.00 176.35 176.58 1l3n s VAL 118 N -1.65 1.08 -0.16 -1.59 1.01 -0.32 -1.10 120.40 117.67 1l3n s VAL 118 Ca 0.43 -0.47 -0.07 0.00 0.00 0.00 0.00 61.98 61.87 1l3n s VAL 118 Cb -0.13 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 1l3n s VAL 118 CO 0.20 0.34 0.08 0.54 0.00 0.00 0.00 175.10 176.25 1l3n s VAL 119 N 0.48 4.94 0.23 2.92 0.11 0.08 -2.62 120.40 126.54 1l3n s VAL 119 Ca -0.10 0.01 0.08 0.00 -2.93 0.00 0.00 61.98 59.04 1l3n s VAL 119 Cb -0.14 -3.20 -0.04 0.00 -1.53 0.00 0.00 36.38 31.48 1l3n s VAL 119 CO 0.03 0.51 0.01 -1.00 -3.33 0.00 0.00 175.10 171.32 1l3n s HIS 120 N -0.06 2.79 0.22 1.54 3.76 -0.87 -1.87 115.29 120.80 1l3n s HIS 120 Ca 0.07 -0.18 -0.16 0.00 -0.15 0.00 0.00 55.06 54.64 1l3n s HIS 120 Cb -0.12 -1.29 0.24 0.00 1.11 0.00 0.00 32.58 32.52 1l3n s HIS 120 CO 0.01 0.57 1.58 1.49 -0.85 0.00 0.00 174.74 177.53 1l3n h GLU 121 N 2.21 -0.06 -5.96 1.40 4.81 -0.62 -3.26 114.58 113.10 1l3n h GLU 121 Ca -0.46 0.00 -0.60 0.00 -0.13 0.00 0.00 59.36 58.17 1l3n h GLU 121 Cb 1.23 0.01 -0.12 0.00 0.63 0.00 0.00 28.75 30.50 1l3n h GLU 121 CO 0.59 -0.04 -0.65 0.15 -0.73 0.00 0.00 179.01 178.34 1l3n s LYS 122 N -6.08 1.94 0.56 1.92 1.02 0.75 -4.87 119.74 114.98 1l3n s LYS 122 Ca -0.14 -1.87 -0.21 0.00 0.02 0.00 0.00 55.97 53.77 1l3n s LYS 122 Cb 0.20 -1.80 -0.05 0.00 -0.52 0.00 0.00 37.83 35.66 1l3n s LYS 122 CO 0.72 0.12 1.26 0.00 -0.92 0.00 0.00 175.35 176.54 1l3n n ALA 123 N -0.88 1.21 -2.63 5.17 0.00 -1.06 0.06 120.51 122.38 1l3n n ALA 123 Ca -0.05 0.10 -0.42 0.00 0.00 0.00 0.00 53.44 53.07 1l3n n ALA 123 Cb 0.63 -2.30 -0.03 0.00 0.00 0.00 0.00 19.45 17.76 1l3n n ALA 123 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1l3n s ASP 124 N -1.02 7.36 0.32 0.00 1.01 -1.26 -4.19 116.67 118.89 1l3n s ASP 124 Ca 0.73 1.71 0.26 0.00 0.71 0.00 0.00 52.55 55.96 1l3n s ASP 124 Cb -0.42 -2.57 0.81 0.00 1.01 0.00 0.00 42.92 41.75 1l3n s ASP 124 CO 0.48 -0.26 1.75 0.44 0.21 0.00 0.00 175.17 177.80 1l3n h ASP 125 N 6.65 0.00 -5.97 0.27 3.32 -1.20 -3.48 116.42 116.01 1l3n h ASP 125 Ca -0.41 0.00 -0.40 0.00 0.02 0.00 0.00 57.03 56.24 1l3n h ASP 125 Cb 1.22 0.00 0.08 0.00 0.22 0.00 0.00 39.33 40.85 1l3n h ASP 125 CO 0.75 0.00 -0.81 0.18 -1.72 0.00 0.00 179.24 177.64 1l3n n LEU 126 N -2.56 -3.35 0.00 1.55 4.77 -1.26 -2.97 117.00 113.17 1l3n n LEU 126 Ca 0.04 -0.76 0.00 0.00 -0.03 0.00 0.00 56.01 55.25 1l3n n LEU 126 Cb 0.39 -2.79 0.00 0.00 -2.33 0.00 0.00 43.42 38.69 1l3n n LEU 126 CO 0.28 0.40 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 1l3n n GLY 127 N -1.46 2.91 0.00 -0.72 0.00 -0.88 -4.55 105.19 100.49 1l3n n GLY 127 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.10 0.85 0.29 1.61 5.02 -1.16 -3.02 118.16 121.65 1l3n n LYS 128 Ca 0.00 0.00 0.18 0.00 -2.02 0.00 0.00 58.31 56.47 1l3n n LYS 128 Cb 0.00 -1.00 0.75 0.00 -0.02 0.00 0.00 35.03 34.76 1l3n n LYS 128 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1l3n h GLY 129 N 5.11 0.00 -6.23 0.72 0.00 -1.88 -3.47 103.07 97.33 1l3n h GLY 129 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.87 1l3n h GLY 129 CO 0.00 0.00 -0.77 0.61 0.00 0.00 0.00 176.54 176.38 1l3n n GLY 130 N -0.09 -0.45 3.24 4.60 0.00 -1.17 -4.87 105.19 106.46 1l3n n GLY 130 Ca 0.00 0.18 -0.15 0.00 0.00 0.00 0.00 46.02 46.06 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 -3.57 1.78 0.19 1.61 0.01 -1.26 -4.95 114.94 108.75 1l3n s ASN 131 Ca 0.50 -0.98 -0.14 0.00 -0.71 0.00 0.00 52.86 51.54 1l3n s ASN 131 Cb -0.25 -0.01 0.20 0.00 0.41 0.00 0.00 41.25 41.60 1l3n s ASN 131 CO 0.82 -0.31 1.67 -0.08 -1.51 0.00 0.00 177.10 177.69 1l3n h GLU 132 N 2.92 0.07 -0.29 -0.60 4.22 -1.99 0.96 114.58 119.87 1l3n h GLU 132 Ca -0.37 -0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.03 1l3n h GLU 132 Cb 1.19 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.41 1l3n h GLU 132 CO 0.61 0.05 0.01 1.49 -2.18 0.00 0.00 179.01 178.99 1l3n h GLU 133 N 0.07 0.44 -0.69 1.92 4.57 -1.97 -0.79 114.58 118.13 1l3n h GLU 133 Ca 0.26 -0.08 0.02 0.00 -1.18 0.00 0.00 59.36 58.38 1l3n h GLU 133 Cb 0.40 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.88 1l3n h GLU 133 CO -0.47 0.46 0.45 0.66 -1.18 0.00 0.00 179.01 178.93 1l3n h SER 134 N 0.43 0.76 1.76 1.04 4.64 -1.16 0.24 113.55 121.26 1l3n h SER 134 Ca 0.10 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.38 1l3n h SER 134 Cb 0.27 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1l3n h SER 134 CO 0.01 0.54 -0.25 0.00 -0.87 0.00 0.00 176.83 176.26 1l3n h THR 135 N 0.90 0.17 0.01 2.95 1.03 -0.57 -1.61 112.91 115.79 1l3n h THR 135 Ca 0.26 -1.24 -0.22 0.00 -0.01 0.00 0.00 66.41 65.20 1l3n h THR 135 Cb -0.06 2.02 -0.03 0.00 -1.07 0.00 0.00 68.15 69.01 1l3n h THR 135 CO -0.08 0.09 -1.22 0.11 -0.01 0.00 0.00 175.52 174.42 1l3n h LYS 136 N 0.00 0.02 0.00 0.00 1.79 -1.02 -0.56 116.57 116.80 1l3n h LYS 136 Ca -0.01 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 1l3n h LYS 136 Cb 1.08 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.75 1l3n h LYS 136 CO 0.01 1.02 -0.45 0.25 -1.08 0.00 0.00 179.45 179.20 1l3n n THR 137 N -4.38 0.00 0.00 -0.16 -2.24 0.39 -4.39 114.28 103.49 1l3n n THR 137 Ca -0.30 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 1l3n n THR 137 Cb 0.69 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 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 1.24 1.75 2.49 3.38 0.00 0.55 -4.49 105.19 110.10 1l3n n GLY 138 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1l3n n GLY 138 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1l3n n ASN 139 N 0.00 -5.23 0.00 1.61 2.85 -0.71 -0.62 115.26 113.16 1l3n n ASN 139 Ca 0.00 0.41 0.09 0.00 -0.11 0.00 0.00 54.58 54.97 1l3n n ASN 139 Cb 0.00 -4.60 0.48 0.00 1.24 0.00 0.00 39.78 36.90 1l3n n ASN 139 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1l3n n ALA 140 N 0.70 2.02 -0.16 5.20 0.00 -1.26 -4.83 120.51 122.18 1l3n n ALA 140 Ca -0.20 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1l3n n ALA 140 Cb 0.65 -1.31 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 0.30 -1.56 3.63 0.00 0.00 -1.26 -0.18 105.19 106.13 1l3n n GLY 141 Ca 0.09 -1.30 -0.49 0.00 0.00 0.00 0.00 46.02 44.32 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 -0.00 2.44 -3.83 1.61 7.64 -1.26 -4.49 113.62 115.72 1l3n n SER 142 Ca 0.00 1.10 -0.36 0.00 1.01 0.00 0.00 58.87 60.61 1l3n n SER 142 Cb 0.00 -1.31 -0.11 0.00 -1.01 0.00 0.00 64.21 61.78 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 3.12 0.28 -0.34 1.43 3.00 -1.26 -0.36 116.66 122.52 1l3n n ARG 143 Ca 0.18 -1.35 0.27 0.00 -0.01 0.00 0.00 57.85 56.94 1l3n n ARG 143 Cb 0.24 -2.97 0.57 0.00 0.00 0.00 0.00 32.46 30.31 1l3n n ARG 143 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 1l3n h LEU 144 N 18.65 0.34 -7.00 0.55 5.85 -1.76 -3.42 115.31 128.52 1l3n h LEU 144 Ca 0.21 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.99 1l3n h LEU 144 Cb 0.78 0.03 -0.14 0.00 0.37 0.00 0.00 40.66 41.69 1l3n h LEU 144 CO 1.74 0.03 0.24 0.00 -0.34 0.00 0.00 178.44 180.11 1l3n s ALA 145 N -5.36 -1.68 0.13 1.25 0.00 -0.78 -2.76 121.76 112.55 1l3n s ALA 145 Ca -0.08 0.79 -0.07 0.00 0.00 0.00 0.00 51.96 52.60 1l3n s ALA 145 Cb 0.26 0.57 -0.02 0.00 0.00 0.00 0.00 23.12 23.93 1l3n s ALA 145 CO 0.80 -0.64 0.19 0.00 0.00 0.00 0.00 175.76 176.11 1l3n s GLY 147 N -2.95 -0.46 -0.16 0.00 0.00 -0.26 -1.05 107.32 102.44 1l3n s GLY 147 Ca 0.14 1.24 -0.05 0.00 0.00 0.00 0.00 44.72 46.04 1l3n s GLY 147 CO -0.04 0.94 0.02 0.14 0.00 0.00 0.00 173.10 174.16 1l3n s VAL 148 N -0.81 4.44 -0.25 1.40 1.01 -1.26 -0.23 120.40 124.70 1l3n s VAL 148 Ca -0.09 -0.17 -0.29 0.00 0.00 0.00 0.00 61.98 61.44 1l3n s VAL 148 Cb -0.02 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.40 1l3n s VAL 148 CO 0.06 0.50 1.20 -0.63 0.00 0.00 0.00 175.10 176.24 1l3n s ILE 149 N 0.12 4.34 0.25 2.22 1.01 0.02 -4.64 121.20 124.53 1l3n s ILE 149 Ca 0.03 1.57 0.10 0.00 0.00 0.00 0.00 60.65 62.35 1l3n s ILE 149 Cb -0.13 -4.18 -0.04 0.00 0.01 0.00 0.00 42.46 38.11 1l3n s ILE 149 CO 0.01 -0.33 -0.08 -0.83 0.00 0.00 0.00 174.94 173.72 1l3n s GLY 150 N 2.06 1.73 0.41 6.18 0.00 -1.13 -0.87 107.32 115.71 1l3n s GLY 150 Ca 0.52 -1.69 -0.26 0.00 0.00 0.00 0.00 44.72 43.29 1l3n s GLY 150 CO 0.16 -1.75 1.33 -0.42 0.00 0.00 0.00 173.10 172.42 1l3n s ILE 151 N -2.25 2.51 0.13 0.90 1.01 -1.26 -2.79 121.20 119.45 1l3n s ILE 151 Ca 0.30 0.46 -0.01 0.00 0.00 0.00 0.00 60.65 61.40 1l3n s ILE 151 Cb -0.06 -3.27 -0.04 0.00 0.01 0.00 0.00 42.46 39.09 1l3n s ILE 151 CO 0.17 0.07 0.05 0.00 0.00 0.00 0.00 174.94 175.23 1l3n s ALA 152 N -1.25 0.87 0.00 9.38 0.00 -0.90 -4.84 121.76 125.02 1l3n s ALA 152 Ca 0.57 -1.47 0.00 0.00 0.00 0.00 0.00 51.96 51.06 1l3n s ALA 152 Cb -0.39 0.83 0.00 0.00 0.00 0.00 0.00 23.12 23.56 1l3n s ALA 152 CO 0.51 -0.48 0.16 0.94 0.00 0.00 0.00 175.76 176.89