#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l3n h THR 2 N 0.00 0.26 -2.89 0.00 1.03 -1.82 -3.41 112.91 106.08 1l3n h THR 2 Ca 0.00 -1.37 -0.45 0.00 -0.01 0.00 0.00 66.41 64.59 1l3n h THR 2 Cb 0.00 2.13 -0.14 0.00 -1.07 0.00 0.00 68.15 69.06 1l3n h THR 2 CO 0.00 0.15 -0.71 -0.75 -0.01 0.00 0.00 175.52 174.20 1l3n s LYS 3 N -3.13 1.36 0.18 0.00 2.20 -1.24 -0.15 119.74 118.96 1l3n s LYS 3 Ca 0.06 -1.63 -0.15 0.00 -0.36 0.00 0.00 55.97 53.89 1l3n s LYS 3 Cb 0.06 -1.06 0.02 0.00 -1.51 0.00 0.00 37.83 35.34 1l3n s LYS 3 CO 0.69 0.12 0.44 0.00 -0.36 0.00 0.00 175.35 176.25 1l3n s ALA 4 N -3.04 -0.68 0.47 3.13 0.00 0.45 -2.47 121.76 119.61 1l3n s ALA 4 Ca 0.24 -0.38 0.02 0.00 0.00 0.00 0.00 51.96 51.84 1l3n s ALA 4 Cb 0.01 0.83 -0.01 0.00 0.00 0.00 0.00 23.12 23.95 1l3n s ALA 4 CO 0.08 -0.74 0.08 1.33 0.00 0.00 0.00 175.76 176.51 1l3n n VAL 5 N -0.29 0.00 -3.27 0.00 0.24 -0.48 -0.45 118.33 114.08 1l3n n VAL 5 Ca -0.10 -2.47 -0.04 0.00 -2.04 0.00 0.00 64.34 59.69 1l3n n VAL 5 Cb 0.63 0.71 -0.05 0.00 -1.47 0.00 0.00 33.84 33.66 1l3n n VAL 5 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1l3n s ALA 6 N -3.04 -1.56 -0.34 2.33 0.00 0.05 -3.67 121.76 115.54 1l3n s ALA 6 Ca 0.12 1.15 -0.19 0.00 0.00 0.00 0.00 51.96 53.04 1l3n s ALA 6 Cb 0.01 -1.93 -0.01 0.00 0.00 0.00 0.00 23.12 21.19 1l3n s ALA 6 CO 0.08 -1.37 0.54 0.14 0.00 0.00 0.00 175.76 175.15 1l3n s VAL 7 N 2.66 5.00 0.08 0.00 -7.23 -1.23 -0.89 120.40 118.79 1l3n s VAL 7 Ca 0.15 0.46 0.02 0.00 -1.81 0.00 0.00 61.98 60.80 1l3n s VAL 7 Cb -0.15 -3.97 -0.04 0.00 0.56 0.00 0.00 36.38 32.78 1l3n s VAL 7 CO -0.20 -0.20 0.12 -0.76 -0.31 0.00 0.00 175.10 173.76 1l3n s LEU 8 N 2.45 3.97 0.09 1.32 1.43 0.24 -3.79 118.68 124.38 1l3n s LEU 8 Ca 0.20 0.07 -0.26 0.00 -1.03 0.00 0.00 54.13 53.11 1l3n s LEU 8 Cb -0.15 -2.62 0.08 0.00 0.03 0.00 0.00 46.19 43.53 1l3n s LEU 8 CO 0.13 0.16 0.73 -0.75 0.23 0.00 0.00 176.35 176.85 1l3n s LYS 9 N -2.47 1.08 0.30 1.70 2.20 0.35 -0.63 119.74 122.27 1l3n s LYS 9 Ca 0.31 -0.39 0.00 0.00 -0.36 0.00 0.00 55.97 55.53 1l3n s LYS 9 Cb -0.12 0.50 0.00 0.00 -1.51 0.00 0.00 37.83 36.69 1l3n s LYS 9 CO 0.24 -0.47 0.00 0.41 -0.36 0.00 0.00 175.35 175.17 1l3n n GLY 10 N -0.30 -1.40 0.12 5.54 0.00 -1.24 -0.72 105.19 107.19 1l3n n GLY 10 Ca -0.13 0.27 -0.16 0.00 0.00 0.00 0.00 46.02 46.00 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 0.39 0.00 1.61 5.19 -1.77 -3.49 116.42 118.34 1l3n h ASP 11 Ca 0.00 -0.74 0.00 0.00 -0.62 0.00 0.00 57.03 55.67 1l3n h ASP 11 Cb 0.00 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.39 1l3n h ASP 11 CO 0.00 1.07 0.00 0.61 -3.12 0.00 0.00 179.24 177.80 1l3n n GLY 12 N 0.97 2.59 0.34 2.75 0.00 -1.26 -4.88 105.19 105.70 1l3n n GLY 12 Ca -0.10 -0.58 -0.01 0.00 0.00 0.00 0.00 46.02 45.34 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 1.06 -6.20 1.61 0.13 -1.92 -3.37 132.00 123.31 1l3n h PRO 13 Ca 0.00 -0.06 -0.54 0.00 -0.87 0.00 0.00 66.00 64.53 1l3n h PRO 13 Cb 0.00 -0.24 -0.04 0.00 0.13 0.00 0.00 31.00 30.85 1l3n h PRO 13 CO 0.00 0.70 1.27 0.08 -0.23 0.00 0.00 178.00 179.82 1l3n s VAL 14 N -6.09 3.51 -0.05 1.56 1.01 -1.26 -3.77 120.40 115.31 1l3n s VAL 14 Ca -0.13 0.44 0.02 0.00 0.00 0.00 0.00 61.98 62.32 1l3n s VAL 14 Cb 0.18 -3.91 0.01 0.00 0.00 0.00 0.00 36.38 32.65 1l3n s VAL 14 CO 0.80 -0.73 -0.11 0.00 0.00 0.00 0.00 175.10 175.05 1l3n s GLN 15 N 6.12 1.45 0.03 2.72 -2.07 0.08 -3.70 119.66 124.28 1l3n s GLN 15 Ca 0.70 -0.38 -0.02 0.00 -1.82 0.00 0.00 55.36 53.83 1l3n s GLN 15 Cb -0.16 -1.25 -0.04 0.00 -1.09 0.00 0.00 33.01 30.47 1l3n s GLN 15 CO 0.27 0.06 0.22 0.20 -1.32 0.00 0.00 175.29 174.72 1l3n s GLY 16 N 0.51 2.19 -0.45 2.60 0.00 0.20 -1.03 107.32 111.34 1l3n s GLY 16 Ca -0.10 -0.75 0.05 0.00 0.00 0.00 0.00 44.72 43.92 1l3n s GLY 16 CO 0.02 -0.66 0.53 -0.42 0.00 0.00 0.00 173.10 172.57 1l3n s ILE 17 N -1.41 -0.41 -0.00 0.90 1.01 -1.23 -0.59 121.20 119.47 1l3n s ILE 17 Ca 0.31 -1.58 -0.02 0.00 0.00 0.00 0.00 60.65 59.35 1l3n s ILE 17 Cb -0.13 -0.56 -0.04 0.00 0.01 0.00 0.00 42.46 41.74 1l3n s ILE 17 CO 0.22 -0.55 0.17 -0.63 0.00 0.00 0.00 174.94 174.15 1l3n s ILE 18 N 0.68 5.35 -0.17 2.92 -1.09 -0.07 -1.58 121.20 127.25 1l3n s ILE 18 Ca 0.29 -0.20 0.00 0.00 -2.23 0.00 0.00 60.65 58.51 1l3n s ILE 18 Cb -0.01 -3.50 0.03 0.00 -1.58 0.00 0.00 42.46 37.40 1l3n s ILE 18 CO -0.10 0.31 -0.10 0.20 -1.23 0.00 0.00 174.94 174.02 1l3n s ASN 19 N -1.96 2.90 -0.32 3.58 0.02 0.60 -0.77 114.94 118.99 1l3n s ASN 19 Ca 0.27 -0.64 -0.14 0.00 -1.02 0.00 0.00 52.86 51.34 1l3n s ASN 19 Cb -0.13 -1.10 -0.02 0.00 0.02 0.00 0.00 41.25 40.02 1l3n s ASN 19 CO 0.19 -0.12 0.29 -0.36 0.02 0.00 0.00 177.10 177.12 1l3n s PHE 20 N 1.51 3.22 -0.05 2.20 0.40 0.41 -1.21 117.98 124.46 1l3n s PHE 20 Ca 0.02 0.00 0.05 0.00 -0.60 0.00 0.00 56.93 56.40 1l3n s PHE 20 Cb -0.14 -2.54 -0.02 0.00 0.51 0.00 0.00 43.02 40.82 1l3n s PHE 20 CO -0.09 -0.33 -0.19 -2.00 0.70 0.00 0.00 175.22 173.31 1l3n s GLU 21 N 1.88 2.47 -0.71 0.44 2.12 -0.87 -0.41 118.70 123.63 1l3n s GLU 21 Ca 0.09 -0.79 -0.00 0.00 0.36 0.00 0.00 54.97 54.63 1l3n s GLU 21 Cb -0.17 -2.27 0.18 0.00 0.26 0.00 0.00 34.13 32.13 1l3n s GLU 21 CO 0.11 0.54 0.53 -1.14 -0.54 0.00 0.00 175.26 174.76 1l3n s GLN 22 N -0.53 2.69 0.29 4.30 0.74 0.79 -2.54 119.66 125.40 1l3n s GLN 22 Ca 0.07 -2.93 0.02 0.00 0.05 0.00 0.00 55.36 52.57 1l3n s GLN 22 Cb -0.11 -3.69 0.72 0.00 1.10 0.00 0.00 33.01 31.03 1l3n s GLN 22 CO 0.01 -1.21 1.66 1.57 -0.55 0.00 0.00 175.29 176.76 1l3n h LYS 23 N 6.33 0.24 -4.31 1.67 -0.00 -1.82 -3.40 116.57 115.28 1l3n h LYS 23 Ca 0.06 -0.01 -0.18 0.00 -0.00 0.00 0.00 60.65 60.51 1l3n h LYS 23 Cb 0.86 -0.05 -0.14 0.00 -0.00 0.00 0.00 32.23 32.90 1l3n h LYS 23 CO 0.75 0.16 -0.50 -2.00 -0.00 0.00 0.00 179.45 177.86 1l3n s GLU 24 N -5.92 1.20 0.50 0.07 -6.30 -1.26 -4.96 118.70 102.02 1l3n s GLU 24 Ca -0.12 -1.47 0.18 0.00 -2.50 0.00 0.00 54.97 51.06 1l3n s GLU 24 Cb 0.26 0.31 1.24 0.00 0.00 0.00 0.00 34.13 35.93 1l3n s GLU 24 CO 0.77 -0.41 2.10 1.03 0.02 0.00 0.00 175.26 178.77 1l3n h SER 25 N 2.60 0.00 1.66 -1.70 0.87 -1.91 -0.37 113.55 114.70 1l3n h SER 25 Ca -0.34 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.22 1l3n h SER 25 Cb 1.24 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.20 1l3n h SER 25 CO 0.51 0.08 -0.10 0.78 -0.53 0.00 0.00 176.83 177.57 1l3n h ASN 26 N 0.00 0.00 -3.29 6.23 2.35 -1.95 -3.46 115.58 115.46 1l3n h ASN 26 Ca -0.00 -0.01 -0.56 0.00 -0.55 0.00 0.00 56.30 55.17 1l3n h ASN 26 Cb 0.15 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.48 1l3n h ASN 26 CO 0.01 0.01 -0.04 -0.83 -1.65 0.00 0.00 177.43 174.92 1l3n s GLY 27 N -3.92 2.60 0.29 2.83 0.00 -0.15 -5.04 107.32 103.93 1l3n s GLY 27 Ca 0.08 -0.01 -0.30 0.00 0.00 0.00 0.00 44.72 44.49 1l3n s GLY 27 CO 0.65 0.36 1.47 2.56 0.00 0.00 0.00 173.10 178.14 1l3n s PRO 28 N -1.45 4.22 -0.10 2.90 0.04 -1.26 -4.63 135.00 134.71 1l3n s PRO 28 Ca 0.33 2.40 -0.30 0.00 0.04 0.00 0.00 61.00 63.48 1l3n s PRO 28 Cb -0.18 -3.06 -0.02 0.00 0.04 0.00 0.00 34.50 31.29 1l3n s PRO 28 CO 0.19 -0.46 1.10 0.14 0.04 0.00 0.00 177.00 178.01 1l3n s VAL 29 N -0.33 4.55 -0.32 -0.36 -7.23 0.52 -4.65 120.40 112.57 1l3n s VAL 29 Ca 0.58 1.84 -0.22 0.00 -1.81 0.00 0.00 61.98 62.37 1l3n s VAL 29 Cb -0.44 -4.19 -0.00 0.00 0.56 0.00 0.00 36.38 32.32 1l3n s VAL 29 CO 0.49 -0.03 0.73 -0.75 -0.31 0.00 0.00 175.10 175.23 1l3n s LYS 30 N 2.32 3.88 -0.50 4.82 2.20 -1.05 -1.37 119.74 130.03 1l3n s LYS 30 Ca 0.51 0.41 -0.17 0.00 -0.36 0.00 0.00 55.97 56.36 1l3n s LYS 30 Cb -0.20 -3.75 0.08 0.00 -1.51 0.00 0.00 37.83 32.44 1l3n s LYS 30 CO 0.18 -0.69 0.52 0.54 -0.36 0.00 0.00 175.35 175.54 1l3n s VAL 31 N 2.87 5.07 0.38 4.02 0.11 0.84 -2.04 120.40 131.64 1l3n s VAL 31 Ca 0.30 -0.91 0.08 0.00 -2.93 0.00 0.00 61.98 58.51 1l3n s VAL 31 Cb -0.14 -4.25 -0.05 0.00 -1.53 0.00 0.00 36.38 30.42 1l3n s VAL 31 CO 0.13 -0.74 0.16 -1.66 -3.33 0.00 0.00 175.10 169.66 1l3n s TRP 32 N 2.08 2.64 0.00 1.54 -2.14 -0.35 -0.89 118.94 121.82 1l3n s TRP 32 Ca 0.08 -0.49 0.00 0.00 2.66 0.00 0.00 56.10 58.35 1l3n s TRP 32 Cb -0.23 -1.81 0.00 0.00 -3.10 0.00 0.00 33.47 28.33 1l3n s TRP 32 CO 0.08 0.25 0.00 0.41 -2.66 0.00 0.00 176.95 175.03 1l3n n GLY 33 N -1.19 -0.34 2.68 3.67 0.00 0.26 -0.30 105.19 109.97 1l3n n GLY 33 Ca -0.02 -1.03 -0.21 0.00 0.00 0.00 0.00 46.02 44.77 1l3n n GLY 33 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1l3n s SER 34 N 0.00 2.25 0.49 1.61 0.15 -0.61 -0.75 113.70 116.84 1l3n s SER 34 Ca 0.00 -1.01 -0.17 0.00 0.70 0.00 0.00 55.95 55.47 1l3n s SER 34 Cb 0.00 0.22 -0.08 0.00 -1.71 0.00 0.00 66.02 64.45 1l3n s SER 34 CO 0.00 -0.40 0.96 0.27 1.20 0.00 0.00 173.24 175.27 1l3n s ILE 35 N 2.19 4.53 0.06 6.45 -4.36 -0.82 -3.82 121.20 125.42 1l3n s ILE 35 Ca 0.10 1.22 0.03 0.00 -0.26 0.00 0.00 60.65 61.73 1l3n s ILE 35 Cb -0.15 -3.70 -0.03 0.00 1.25 0.00 0.00 42.46 39.84 1l3n s ILE 35 CO -0.32 -0.60 -0.09 -1.59 0.24 0.00 0.00 174.94 172.58 1l3n s LYS 36 N -3.88 0.63 0.00 0.37 -2.85 -0.20 -1.13 119.74 112.69 1l3n s LYS 36 Ca 0.59 -0.87 0.00 0.00 -1.00 0.00 0.00 55.97 54.69 1l3n s LYS 36 Cb -0.10 -0.41 0.00 0.00 -2.06 0.00 0.00 37.83 35.26 1l3n s LYS 36 CO 0.28 0.07 0.00 0.41 0.10 0.00 0.00 175.35 176.21 1l3n n GLY 37 N 1.26 0.66 3.34 0.59 0.00 -0.41 -0.74 105.19 109.89 1l3n n GLY 37 Ca -0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.68 0.11 0.99 2.01 -0.52 -4.14 118.68 116.45 1l3n s LEU 38 Ca 0.00 1.03 0.05 0.00 0.01 0.00 0.00 54.13 55.22 1l3n s LEU 38 Cb 0.00 -2.57 -0.04 0.00 0.01 0.00 0.00 46.19 43.59 1l3n s LEU 38 CO 0.00 -5.13 0.05 0.28 1.01 0.00 0.00 176.35 172.56 1l3n s THR 39 N -2.30 4.23 0.40 5.49 -1.32 -1.26 -3.75 115.64 117.14 1l3n s THR 39 Ca 0.69 -0.98 -0.24 0.00 -1.21 0.00 0.00 61.69 59.95 1l3n s THR 39 Cb -0.17 -3.06 -0.12 0.00 -1.51 0.00 0.00 72.50 67.64 1l3n s THR 39 CO 0.60 0.06 0.80 1.21 -2.21 0.00 0.00 174.62 175.08 1l3n n GLU 40 N 0.29 0.96 0.00 7.08 2.13 -1.26 -4.64 120.64 125.21 1l3n n GLU 40 Ca -0.09 0.35 0.00 0.00 0.66 0.00 0.00 57.16 58.07 1l3n n GLU 40 Cb 0.53 -1.77 0.00 0.00 0.27 0.00 0.00 31.44 30.47 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 1.47 -1.72 3.80 8.31 0.00 -0.19 -4.86 105.19 111.99 1l3n n GLY 41 Ca 0.11 -2.04 -0.35 0.00 0.00 0.00 0.00 46.02 43.74 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 3.95 -0.11 0.99 2.01 -1.26 -0.73 118.68 123.53 1l3n s LEU 42 Ca 0.00 1.93 -0.08 0.00 0.01 0.00 0.00 54.13 55.99 1l3n s LEU 42 Cb 0.00 -4.44 0.04 0.00 0.01 0.00 0.00 46.19 41.80 1l3n s LEU 42 CO 0.00 -0.63 0.28 -1.00 1.01 0.00 0.00 176.35 176.01 1l3n s HIS 43 N -1.91 -0.35 -0.29 0.29 3.76 -0.88 -3.51 115.29 112.40 1l3n s HIS 43 Ca 0.64 0.83 -0.41 0.00 -0.15 0.00 0.00 55.06 55.97 1l3n s HIS 43 Cb -0.17 0.10 -0.18 0.00 1.11 0.00 0.00 32.58 33.44 1l3n s HIS 43 CO 0.21 -0.21 1.28 0.41 -0.85 0.00 0.00 174.74 175.59 1l3n n GLY 44 N 3.69 0.02 2.68 -2.22 0.00 0.16 -3.13 105.19 106.37 1l3n n GLY 44 Ca -0.20 0.84 -0.27 0.00 0.00 0.00 0.00 46.02 46.39 1l3n n GLY 44 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1l3n s PHE 45 N 1.75 0.72 0.32 1.61 0.40 0.30 -0.59 117.98 122.48 1l3n s PHE 45 Ca 0.91 -0.72 -0.14 0.00 -0.60 0.00 0.00 56.93 56.39 1l3n s PHE 45 Cb -1.29 -0.94 0.02 0.00 0.51 0.00 0.00 43.02 41.32 1l3n s PHE 45 CO 0.67 -0.61 0.63 -1.01 0.70 0.00 0.00 175.22 175.60 1l3n s HIS 46 N 1.96 0.29 -0.03 0.36 3.76 -1.12 -0.92 115.29 119.60 1l3n s HIS 46 Ca 0.01 -0.75 -0.02 0.00 -0.15 0.00 0.00 55.06 54.15 1l3n s HIS 46 Cb -0.17 0.46 -0.04 0.00 1.11 0.00 0.00 32.58 33.95 1l3n s HIS 46 CO -0.12 -1.26 0.12 0.14 -0.85 0.00 0.00 174.74 172.77 1l3n s VAL 47 N -3.27 5.07 0.09 -0.90 -7.23 0.79 -1.06 120.40 113.89 1l3n s VAL 47 Ca 0.19 -0.23 0.10 0.00 -1.81 0.00 0.00 61.98 60.23 1l3n s VAL 47 Cb -0.03 -3.31 -0.03 0.00 0.56 0.00 0.00 36.38 33.56 1l3n s VAL 47 CO 0.11 0.39 -0.25 -1.00 -0.31 0.00 0.00 175.10 174.05 1l3n s HIS 48 N -1.20 2.14 0.27 2.82 3.76 0.64 -4.70 115.29 119.02 1l3n s HIS 48 Ca 0.23 -0.39 -0.04 0.00 -0.15 0.00 0.00 55.06 54.71 1l3n s HIS 48 Cb -0.12 -1.20 0.36 0.00 1.11 0.00 0.00 32.58 32.72 1l3n s HIS 48 CO 0.14 0.23 1.93 1.49 -0.85 0.00 0.00 174.74 177.68 1l3n h GLU 49 N 4.25 1.21 -7.16 1.40 4.57 -1.36 -2.91 114.58 114.58 1l3n h GLU 49 Ca -0.48 -0.07 -0.48 0.00 -1.18 0.00 0.00 59.36 57.14 1l3n h GLU 49 Cb 1.16 -0.27 0.05 0.00 -0.16 0.00 0.00 28.75 29.53 1l3n h GLU 49 CO 0.41 0.80 0.38 -0.06 -1.18 0.00 0.00 179.01 179.36 1l3n s PHE 50 N -6.03 3.02 -0.83 0.92 0.08 -1.17 -4.70 117.98 109.27 1l3n s PHE 50 Ca -0.12 1.53 0.22 0.00 0.12 0.00 0.00 56.93 58.67 1l3n s PHE 50 Cb 0.18 -3.01 -0.16 0.00 -0.57 0.00 0.00 43.02 39.46 1l3n s PHE 50 CO 0.81 -0.99 0.90 0.41 -0.10 0.00 0.00 175.22 176.25 1l3n n GLY 51 N -0.79 -1.04 3.43 4.36 0.00 -1.25 -0.17 105.19 109.74 1l3n n GLY 51 Ca 0.09 -0.55 -0.49 0.00 0.00 0.00 0.00 46.02 45.07 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 -1.65 1.59 -0.45 1.61 2.03 -1.26 -4.63 116.55 113.79 1l3n n ASP 52 Ca 0.03 0.31 0.04 0.00 0.52 0.00 0.00 54.79 55.69 1l3n n ASP 52 Cb 0.37 -1.18 0.09 0.00 -0.72 0.00 0.00 41.12 39.69 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 10.26 2.38 -0.37 1.67 4.13 -1.26 -3.56 115.26 128.51 1l3n n ASN 53 Ca 0.47 -1.77 0.02 0.00 1.68 0.00 0.00 54.58 54.98 1l3n n ASN 53 Cb 0.18 -0.12 0.17 0.00 -1.54 0.00 0.00 39.78 38.47 1l3n n ASN 53 CO 0.00 0.00 0.00 0.74 0.28 0.00 0.00 177.26 178.28 1l3n h THR 54 N 1.64 1.12 0.00 3.41 2.02 -1.97 0.86 112.91 119.99 1l3n h THR 54 Ca 0.00 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 66.77 1l3n h THR 54 Cb 0.57 -0.20 0.00 0.00 -1.74 0.00 0.00 68.15 66.78 1l3n h THR 54 CO 0.00 0.22 0.00 0.00 0.37 0.00 0.00 175.52 176.11 1l3n h ALA 55 N 1.44 1.00 0.00 6.16 0.00 -1.96 -3.50 119.26 122.40 1l3n h ALA 55 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1l3n h ALA 55 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1l3n h ALA 55 CO -0.15 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.51 1l3n n GLY 56 N 1.09 1.02 2.51 0.00 0.00 0.29 -4.53 105.19 105.58 1l3n n GLY 56 Ca 0.05 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 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 -0.50 0.26 1.94 0.00 -1.04 -1.26 -4.69 114.28 108.98 1l3n n THR 58 Ca 0.23 0.09 0.09 0.00 -2.04 0.00 0.00 64.05 62.42 1l3n n THR 58 Cb 0.83 -1.01 0.50 0.00 -1.82 0.00 0.00 70.33 68.83 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 -3.07 0.13 0.05 8.00 2.88 -1.26 -3.78 113.62 116.57 1l3n n SER 59 Ca 0.00 -1.48 0.22 0.00 -1.33 0.00 0.00 58.87 56.27 1l3n n SER 59 Cb 0.14 -0.01 0.72 0.00 -0.75 0.00 0.00 64.21 64.31 1l3n n SER 59 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1l3n h ALA 60 N 3.58 2.23 0.00 -1.46 0.00 -1.84 -3.44 119.26 118.33 1l3n h ALA 60 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1l3n h ALA 60 Cb 0.04 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1l3n h ALA 60 CO 0.00 -0.79 0.00 0.41 0.00 0.00 0.00 179.25 178.87 1l3n n GLY 61 N -1.52 1.51 2.24 0.00 0.00 -1.25 -3.04 105.19 103.13 1l3n n GLY 61 Ca 0.09 -1.60 -0.33 0.00 0.00 0.00 0.00 46.02 44.18 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 1.58 3.33 0.00 1.61 -0.04 -1.26 -4.72 135.00 135.50 1l3n n PRO 62 Ca 0.00 -1.94 0.00 0.00 -0.04 0.00 0.00 63.50 61.52 1l3n n PRO 62 Cb 0.00 -2.62 0.00 0.00 -0.04 0.00 0.00 33.50 30.84 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 3.32 0.00 -3.10 0.54 8.25 -1.26 -4.74 115.22 118.23 1l3n n HIS 63 Ca 0.71 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.96 1l3n n HIS 63 Cb 0.39 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.46 1l3n n HIS 63 CO 0.00 0.00 0.00 1.97 0.64 0.00 0.00 176.34 178.95 1l3n n PHE 64 N 0.00 -1.03 -1.27 4.41 -1.74 -1.26 -1.35 117.46 115.22 1l3n n PHE 64 Ca 0.00 0.33 -0.38 0.00 -0.56 0.00 0.00 57.45 56.84 1l3n n PHE 64 Cb 0.00 -1.13 0.04 0.00 1.52 0.00 0.00 39.48 39.91 1l3n n PHE 64 CO 0.00 0.00 0.00 0.27 -0.56 0.00 0.00 176.76 176.47 1l3n n ASN 65 N -1.38 -2.63 -0.03 5.98 6.94 -1.26 -4.85 115.26 118.03 1l3n n ASN 65 Ca 0.06 0.60 -0.14 0.00 -0.02 0.00 0.00 54.58 55.08 1l3n n ASN 65 Cb 0.33 -1.02 -0.11 0.00 -2.36 0.00 0.00 39.78 36.63 1l3n n ASN 65 CO 0.00 0.00 0.00 1.55 -1.03 0.00 0.00 177.26 177.78 1l3n h PRO 66 N -0.17 0.08 -5.51 -0.53 0.13 -1.91 -3.36 132.00 120.72 1l3n h PRO 66 Ca -0.44 -0.07 -0.29 0.00 -0.87 0.00 0.00 66.00 64.34 1l3n h PRO 66 Cb 1.39 0.02 -0.04 0.00 0.13 0.00 0.00 31.00 32.50 1l3n h PRO 66 CO 0.41 0.77 0.87 -0.51 -0.23 0.00 0.00 178.00 179.31 1l3n s LEU 67 N -8.75 3.03 -0.74 1.56 1.43 -1.26 -4.85 118.68 109.11 1l3n s LEU 67 Ca -0.17 -1.27 -0.13 0.00 -1.03 0.00 0.00 54.13 51.53 1l3n s LEU 67 Cb 0.00 -2.58 -0.11 0.00 0.03 0.00 0.00 46.19 43.54 1l3n s LEU 67 CO 0.70 -3.13 1.92 -1.54 0.23 0.00 0.00 176.35 174.53 1l3n n SER 68 N 14.78 3.34 -4.07 2.29 3.41 -1.26 -4.84 113.62 127.27 1l3n n SER 68 Ca 0.43 -2.45 -0.23 0.00 -0.26 0.00 0.00 58.87 56.36 1l3n n SER 68 Cb 0.47 -1.03 0.14 0.00 -0.26 0.00 0.00 64.21 63.52 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 5.61 -0.47 -3.67 4.33 1.74 -1.26 -5.04 116.66 117.90 1l3n n ARG 69 Ca 0.43 -2.22 -0.36 0.00 -0.77 0.00 0.00 57.85 54.93 1l3n n ARG 69 Cb 0.25 -0.84 -0.08 0.00 -1.02 0.00 0.00 32.46 30.77 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 -5.13 2.95 0.00 5.56 -0.14 -1.18 -4.87 119.74 116.93 1l3n s LYS 70 Ca 0.63 -2.94 0.00 0.00 -1.36 0.00 0.00 55.97 52.30 1l3n s LYS 70 Cb -0.03 -3.86 0.00 0.00 -1.68 0.00 0.00 37.83 32.27 1l3n s LYS 70 CO 0.43 -1.23 0.00 1.58 -0.76 0.00 0.00 175.35 175.37 1l3n n HIS 71 N 2.86 0.00 -2.66 3.18 -0.00 -1.07 -4.69 115.22 112.84 1l3n n HIS 71 Ca 0.15 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.33 1l3n n HIS 71 Cb 0.38 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.25 1l3n n HIS 71 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1l3n n GLY 72 N 0.20 4.70 0.00 1.57 0.00 -0.35 -1.96 105.19 109.35 1l3n n GLY 72 Ca 0.00 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 43.97 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 5.00 4.53 0.00 -0.02 0.00 -1.26 -4.35 105.19 109.09 1l3n n GLY 73 Ca 0.00 -1.07 0.04 0.00 0.00 0.00 0.00 46.02 44.99 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 0.20 0.09 1.61 -0.04 -1.21 -0.60 135.00 135.05 1l3n n PRO 74 Ca 0.00 0.08 0.12 0.00 -0.04 0.00 0.00 63.50 63.65 1l3n n PRO 74 Cb 0.00 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.05 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 -5.11 0.54 1.57 -1.91 -3.48 116.57 108.18 1l3n h LYS 75 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 1l3n h LYS 75 Cb 0.03 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 32.20 1l3n h LYS 75 CO 0.00 0.00 -0.55 0.34 -0.57 0.00 0.00 179.45 178.67 1l3n s ASP 76 N -4.90 2.64 0.01 0.86 -1.08 0.23 -5.04 116.67 109.40 1l3n s ASP 76 Ca 0.03 -1.56 0.22 0.00 -0.52 0.00 0.00 52.55 50.73 1l3n s ASP 76 Cb 0.11 0.28 -0.15 0.00 -1.46 0.00 0.00 42.92 41.70 1l3n s ASP 76 CO 0.75 -0.80 0.82 1.21 0.52 0.00 0.00 175.17 177.66 1l3n n GLU 77 N -0.83 0.33 0.00 4.34 2.13 -1.26 -4.32 120.64 121.02 1l3n n GLU 77 Ca -0.05 -0.06 0.00 0.00 0.66 0.00 0.00 57.16 57.71 1l3n n GLU 77 Cb 0.66 -1.55 0.00 0.00 0.27 0.00 0.00 31.44 30.82 1l3n n GLU 77 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1l3n n GLU 78 N -1.94 0.98 -1.65 5.31 -0.58 -1.26 -4.82 120.64 116.69 1l3n n GLU 78 Ca 0.01 0.00 -0.50 0.00 -0.42 0.00 0.00 57.16 56.25 1l3n n GLU 78 Cb 0.45 -1.04 -0.05 0.00 -0.57 0.00 0.00 31.44 30.23 1l3n n GLU 78 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 1l3n n ARG 79 N -0.46 1.64 0.05 3.49 1.85 -1.26 -1.21 116.66 120.76 1l3n n ARG 79 Ca 0.00 0.60 -0.13 0.00 -1.00 0.00 0.00 57.85 57.32 1l3n n ARG 79 Cb 0.02 -2.32 -0.09 0.00 -1.05 0.00 0.00 32.46 29.03 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 5.96 -0.10 0.00 2.89 3.86 -1.88 -3.45 115.15 122.44 1l3n h HIS 80 Ca -0.47 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.74 1l3n h HIS 80 Cb 1.30 0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.80 1l3n h HIS 80 CO 0.66 0.19 0.00 1.55 0.86 0.00 0.00 177.93 181.20 1l3n n VAL 81 N -5.01 0.00 -2.66 2.45 3.14 -1.26 -4.63 118.33 110.36 1l3n n VAL 81 Ca -0.08 0.00 -0.04 0.00 -2.96 0.00 0.00 64.34 61.25 1l3n n VAL 81 Cb 0.18 0.00 0.07 0.00 -1.06 0.00 0.00 33.84 33.04 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 -0.35 -1.83 3.02 7.55 0.00 -1.26 -4.89 105.19 107.42 1l3n n GLY 82 Ca 0.00 1.07 -0.33 0.00 0.00 0.00 0.00 46.02 46.77 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 -0.08 4.76 0.29 1.61 1.11 -1.26 -0.15 116.67 122.95 1l3n s ASP 83 Ca 0.26 -2.87 0.13 0.00 0.18 0.00 0.00 52.55 50.24 1l3n s ASP 83 Cb 0.20 -1.74 0.41 0.00 1.07 0.00 0.00 42.92 42.86 1l3n s ASP 83 CO -0.08 -0.31 1.63 -0.07 1.18 0.00 0.00 175.17 177.52 1l3n h LEU 84 N 6.83 0.00 0.00 1.23 4.07 -1.48 -3.21 115.31 122.76 1l3n h LEU 84 Ca -0.05 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.91 1l3n h LEU 84 Cb 0.93 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.67 1l3n h LEU 84 CO 0.69 0.57 0.00 0.61 -1.08 0.00 0.00 178.44 179.23 1l3n n GLY 85 N 0.32 0.82 3.00 0.83 0.00 -0.10 -4.36 105.19 105.69 1l3n n GLY 85 Ca -0.01 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.26 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 0.18 0.02 1.61 0.01 -1.26 -0.54 114.94 110.96 1l3n s ASN 86 Ca 0.00 -0.41 0.05 0.00 -0.71 0.00 0.00 52.86 51.79 1l3n s ASN 86 Cb 0.00 0.12 -0.02 0.00 0.41 0.00 0.00 41.25 41.76 1l3n s ASN 86 CO 0.00 -0.30 -0.15 0.68 -1.51 0.00 0.00 177.10 175.83 1l3n s VAL 87 N -1.36 1.15 -0.25 1.60 -7.23 -1.18 -4.92 120.40 108.21 1l3n s VAL 87 Ca -0.15 -0.86 -0.15 0.00 -1.81 0.00 0.00 61.98 59.02 1l3n s VAL 87 Cb -0.09 -1.01 -0.04 0.00 0.56 0.00 0.00 36.38 35.81 1l3n s VAL 87 CO -0.00 0.14 0.37 -0.89 -0.31 0.00 0.00 175.10 174.41 1l3n s THR 88 N -0.64 5.19 0.02 5.32 2.01 -1.26 -2.07 115.64 124.20 1l3n s THR 88 Ca 0.04 0.59 -0.19 0.00 0.31 0.00 0.00 61.69 62.44 1l3n s THR 88 Cb -0.07 -3.70 -0.06 0.00 0.01 0.00 0.00 72.50 68.68 1l3n s THR 88 CO 0.01 0.19 0.54 0.00 -0.69 0.00 0.00 174.62 174.66 1l3n s ALA 89 N 1.84 3.57 1.14 7.40 0.00 0.09 -4.09 121.76 131.70 1l3n s ALA 89 Ca 0.16 -0.04 -0.16 0.00 0.00 0.00 0.00 51.96 51.93 1l3n s ALA 89 Cb -0.15 -2.62 0.26 0.00 0.00 0.00 0.00 23.12 20.60 1l3n s ALA 89 CO 0.09 0.30 1.07 0.34 0.00 0.00 0.00 175.76 177.56 1l3n s ASP 90 N -0.64 1.36 0.61 0.00 2.15 0.49 -1.03 116.67 119.62 1l3n s ASP 90 Ca 0.28 1.02 0.31 0.00 0.43 0.00 0.00 52.55 54.59 1l3n s ASP 90 Cb -0.18 -1.55 1.74 0.00 -0.30 0.00 0.00 42.92 42.63 1l3n s ASP 90 CO 0.17 -3.89 2.11 0.07 -0.17 0.00 0.00 175.17 173.45 1l3n h LYS 91 N -2.42 0.00 0.00 4.34 -0.00 -1.96 0.16 116.57 116.70 1l3n h LYS 91 Ca -0.52 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.13 1l3n h LYS 91 Cb 1.32 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.55 1l3n h LYS 91 CO 0.46 0.00 0.00 0.22 -0.00 0.00 0.00 179.45 180.13 1l3n h ASP 92 N 0.00 0.00 0.00 7.07 3.58 -1.91 -3.45 116.42 121.71 1l3n h ASP 92 Ca 0.07 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.52 1l3n h ASP 92 Cb 0.46 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.51 1l3n h ASP 92 CO -0.00 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.97 1l3n n GLY 93 N 0.99 0.74 3.65 -0.78 0.00 0.57 -4.29 105.19 106.08 1l3n n GLY 93 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.24 4.68 -0.22 1.61 1.01 -1.26 -1.28 120.40 122.70 1l3n s VAL 94 Ca 0.00 1.93 -0.03 0.00 0.00 0.00 0.00 61.98 63.88 1l3n s VAL 94 Cb 0.00 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 32.09 1l3n s VAL 94 CO 0.00 -0.20 -0.07 0.00 0.00 0.00 0.00 175.10 174.83 1l3n s ALA 95 N 3.21 2.71 -0.29 5.51 0.00 -0.28 -0.38 121.76 132.25 1l3n s ALA 95 Ca 0.43 -1.25 -0.29 0.00 0.00 0.00 0.00 51.96 50.85 1l3n s ALA 95 Cb -0.15 -1.62 0.01 0.00 0.00 0.00 0.00 23.12 21.36 1l3n s ALA 95 CO 0.07 -0.52 1.11 0.16 0.00 0.00 0.00 175.76 176.58 1l3n s ASP 96 N 1.41 6.94 -0.16 0.00 -4.77 -1.26 -1.95 116.67 116.89 1l3n s ASP 96 Ca 0.04 1.19 -0.05 0.00 -3.30 0.00 0.00 52.55 50.43 1l3n s ASP 96 Cb -0.15 -2.54 -0.04 0.00 -1.09 0.00 0.00 42.92 39.11 1l3n s ASP 96 CO -0.05 -0.85 0.02 -0.69 0.70 0.00 0.00 175.17 174.30 1l3n s VAL 97 N 3.62 4.43 -0.48 2.11 1.01 0.07 -4.73 120.40 126.42 1l3n s VAL 97 Ca 0.47 -0.17 0.06 0.00 0.00 0.00 0.00 61.98 62.34 1l3n s VAL 97 Cb -0.14 -2.96 0.23 0.00 0.00 0.00 0.00 36.38 33.51 1l3n s VAL 97 CO 0.14 0.49 0.82 -1.54 0.00 0.00 0.00 175.10 175.01 1l3n n SER 98 N 3.32 -2.67 -4.93 3.32 3.41 -1.25 -0.57 113.62 114.26 1l3n n SER 98 Ca -0.17 -3.17 -0.26 0.00 -0.26 0.00 0.00 58.87 55.00 1l3n n SER 98 Cb 0.53 1.55 -0.03 0.00 -0.26 0.00 0.00 64.21 65.99 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 0.54 5.24 -0.04 -1.33 1.09 -0.07 -4.96 121.20 121.67 1l3n s ILE 99 Ca 0.32 -0.73 0.00 0.00 -1.10 0.00 0.00 60.65 59.14 1l3n s ILE 99 Cb 0.18 -3.70 0.02 0.00 -1.06 0.00 0.00 42.46 37.91 1l3n s ILE 99 CO -0.21 -0.10 -0.02 -0.70 -0.10 0.00 0.00 174.94 173.82 1l3n s GLU 100 N -3.23 0.58 0.05 2.79 2.12 -1.26 -0.11 118.70 119.63 1l3n s GLU 100 Ca 0.34 0.00 0.02 0.00 0.36 0.00 0.00 54.97 55.69 1l3n s GLU 100 Cb -0.11 -0.71 -0.03 0.00 0.26 0.00 0.00 34.13 33.54 1l3n s GLU 100 CO 0.28 -0.14 -0.07 0.34 -0.54 0.00 0.00 175.26 175.14 1l3n s ASP 101 N 1.12 0.82 -0.45 -1.70 -1.08 -0.47 -4.98 116.67 109.94 1l3n s ASP 101 Ca -0.08 -0.67 0.05 0.00 -0.52 0.00 0.00 52.55 51.33 1l3n s ASP 101 Cb -0.14 0.07 0.42 0.00 -1.46 0.00 0.00 42.92 41.81 1l3n s ASP 101 CO -0.01 -0.30 1.18 -1.54 0.52 0.00 0.00 175.17 175.02 1l3n n SER 102 N 1.07 4.92 0.00 -0.34 3.41 -1.26 -0.35 113.62 121.06 1l3n n SER 102 Ca -0.20 -3.73 0.00 0.00 -0.26 0.00 0.00 58.87 54.68 1l3n n SER 102 Cb 0.56 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 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 -0.51 0.00 -1.67 -3.33 3.14 -1.26 -5.02 118.33 109.68 1l3n n VAL 103 Ca 0.41 0.00 -0.47 0.00 -2.96 0.00 0.00 64.34 61.31 1l3n n VAL 103 Cb 0.67 -0.11 -0.04 0.00 -1.06 0.00 0.00 33.84 33.30 1l3n n VAL 103 CO 0.00 0.00 0.00 -0.38 -6.46 0.00 0.00 176.83 169.99 1l3n n ILE 104 N -2.44 0.61 -3.65 1.55 -0.00 -1.26 -4.86 119.36 109.31 1l3n n ILE 104 Ca 0.00 -0.13 -0.29 0.00 -0.00 0.00 0.00 62.75 62.34 1l3n n ILE 104 Cb 0.00 -1.97 -0.12 0.00 -0.00 0.00 0.00 39.64 37.55 1l3n n ILE 104 CO 0.00 0.00 0.00 -0.94 -0.00 0.00 0.00 176.55 175.61 1l3n s SER 105 N 4.38 3.30 0.04 4.38 1.04 -1.22 -4.46 113.70 121.14 1l3n s SER 105 Ca 0.93 -2.92 0.01 0.00 0.48 0.00 0.00 55.95 54.45 1l3n s SER 105 Cb -0.64 -0.96 0.08 0.00 0.10 0.00 0.00 66.02 64.60 1l3n s SER 105 CO 0.50 -0.21 0.85 0.00 0.98 0.00 0.00 173.24 175.35 1l3n n LEU 106 N 3.13 0.04 -3.75 2.42 -0.00 -1.25 -2.29 117.00 115.29 1l3n n LEU 106 Ca 0.16 0.33 -0.12 0.00 -0.00 0.00 0.00 56.01 56.37 1l3n n LEU 106 Cb 0.38 -0.32 -0.11 0.00 -0.00 0.00 0.00 43.42 43.37 1l3n n LEU 106 CO 0.20 -0.34 -0.04 -0.55 -0.00 0.00 0.00 177.39 176.66 1l3n s SER 107 N -2.68 -0.33 0.00 1.45 0.15 -1.26 -4.48 113.70 106.55 1l3n s SER 107 Ca -0.00 0.62 0.00 0.00 0.70 0.00 0.00 55.95 57.27 1l3n s SER 107 Cb 0.00 0.59 0.00 0.00 -1.71 0.00 0.00 66.02 64.91 1l3n s SER 107 CO 0.01 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 174.94 1l3n n GLY 108 N 3.31 1.69 2.07 9.45 0.00 -1.25 -4.82 105.19 115.64 1l3n n GLY 108 Ca -0.16 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.26 -2.08 1.61 -0.08 -1.26 -4.94 116.55 108.55 1l3n n ASP 109 Ca 0.00 0.30 -0.15 0.00 -1.51 0.00 0.00 54.79 53.42 1l3n n ASP 109 Cb 0.00 1.45 -0.11 0.00 2.34 0.00 0.00 41.12 44.80 1l3n n ASP 109 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 1l3n n HIS 110 N -2.84 0.56 -1.54 -0.67 -0.00 -1.23 -4.76 115.22 104.74 1l3n n HIS 110 Ca 0.00 -1.60 -0.41 0.00 -0.00 0.00 0.00 57.72 55.71 1l3n n HIS 110 Cb 0.00 -1.38 -0.04 0.00 -0.00 0.00 0.00 29.99 28.58 1l3n n HIS 110 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1l3n n SER 111 N 1.78 3.14 -1.68 0.41 2.88 -0.97 -3.45 113.62 115.73 1l3n n SER 111 Ca 0.39 -2.74 0.00 0.00 -1.33 0.00 0.00 58.87 55.19 1l3n n SER 111 Cb 0.75 -1.39 0.00 0.00 -0.75 0.00 0.00 64.21 62.81 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 6.05 1.21 -0.05 2.46 -5.35 -1.26 -4.35 119.36 118.07 1l3n n ILE 112 Ca 0.50 -0.30 -0.12 0.00 -0.27 0.00 0.00 62.75 62.56 1l3n n ILE 112 Cb 0.41 -1.30 -0.06 0.00 -1.74 0.00 0.00 39.64 36.95 1l3n n ILE 112 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1l3n h ILE 113 N 1.37 1.26 0.00 7.28 1.08 -1.86 -3.30 117.51 123.34 1l3n h ILE 113 Ca 0.00 -0.88 -0.24 0.00 -0.39 0.00 0.00 64.86 63.35 1l3n h ILE 113 Cb 0.61 1.55 -0.05 0.00 -3.07 0.00 0.00 36.82 35.86 1l3n h ILE 113 CO 0.00 0.26 0.19 0.61 -0.69 0.00 0.00 178.15 178.52 1l3n n GLY 114 N -0.24 3.03 3.35 5.37 0.00 -1.26 -4.16 105.19 111.28 1l3n n GLY 114 Ca -0.05 -1.17 -0.30 0.00 0.00 0.00 0.00 46.02 44.50 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 1.28 1.68 -0.26 1.61 3.00 -1.25 -3.78 118.95 121.23 1l3n s ARG 115 Ca 0.63 -1.16 -0.20 0.00 0.00 0.00 0.00 55.73 55.00 1l3n s ARG 115 Cb 0.28 -1.93 -0.02 0.00 0.00 0.00 0.00 34.95 33.28 1l3n s ARG 115 CO -0.01 0.49 0.61 0.99 0.00 0.00 0.00 175.30 177.38 1l3n s THR 116 N -0.87 4.99 -0.06 0.02 2.01 0.76 -3.81 115.64 118.69 1l3n s THR 116 Ca 0.12 1.05 -0.04 0.00 0.31 0.00 0.00 61.69 63.13 1l3n s THR 116 Cb -0.10 -3.93 -0.04 0.00 0.01 0.00 0.00 72.50 68.45 1l3n s THR 116 CO 0.03 0.01 0.14 -0.76 -0.69 0.00 0.00 174.62 173.35 1l3n s LEU 117 N 2.49 4.24 -0.03 4.42 1.02 0.54 -0.26 118.68 131.10 1l3n s LEU 117 Ca 0.25 0.35 0.03 0.00 0.02 0.00 0.00 54.13 54.78 1l3n s LEU 117 Cb -0.15 -2.29 -0.00 0.00 0.02 0.00 0.00 46.19 43.77 1l3n s LEU 117 CO 0.09 0.33 -0.12 -0.69 0.02 0.00 0.00 176.35 175.98 1l3n s VAL 118 N -1.15 1.04 -0.26 -1.59 1.01 -0.22 -0.45 120.40 118.77 1l3n s VAL 118 Ca 0.21 -0.51 -0.08 0.00 0.00 0.00 0.00 61.98 61.60 1l3n s VAL 118 Cb -0.12 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 1l3n s VAL 118 CO 0.11 0.31 0.08 0.54 0.00 0.00 0.00 175.10 176.14 1l3n s VAL 119 N 0.07 4.34 0.28 2.92 0.11 0.17 -2.79 120.40 125.50 1l3n s VAL 119 Ca -0.02 -0.21 0.05 0.00 -2.93 0.00 0.00 61.98 58.86 1l3n s VAL 119 Cb -0.09 -3.06 -0.02 0.00 -1.53 0.00 0.00 36.38 31.68 1l3n s VAL 119 CO 0.01 0.30 0.42 -1.00 -3.33 0.00 0.00 175.10 171.49 1l3n s HIS 120 N 1.61 3.36 0.03 1.54 3.76 0.24 -1.41 115.29 124.43 1l3n s HIS 120 Ca 0.06 -0.02 -0.26 0.00 -0.15 0.00 0.00 55.06 54.69 1l3n s HIS 120 Cb -0.15 -1.73 -0.17 0.00 1.11 0.00 0.00 32.58 31.63 1l3n s HIS 120 CO 0.04 0.27 1.41 1.49 -0.85 0.00 0.00 174.74 177.10 1l3n h GLU 121 N 1.03 -0.31 -5.74 1.40 4.22 -0.67 -3.37 114.58 111.15 1l3n h GLU 121 Ca -0.50 0.02 -0.60 0.00 0.08 0.00 0.00 59.36 58.36 1l3n h GLU 121 Cb 1.24 0.07 -0.08 0.00 0.50 0.00 0.00 28.75 30.48 1l3n h GLU 121 CO 0.59 -0.04 -0.40 0.15 -2.18 0.00 0.00 179.01 177.13 1l3n s LYS 122 N -5.15 2.24 0.23 1.92 1.02 -0.10 -4.84 119.74 115.06 1l3n s LYS 122 Ca -0.15 -2.07 -0.30 0.00 0.02 0.00 0.00 55.97 53.47 1l3n s LYS 122 Cb 0.03 -1.94 -0.09 0.00 -0.52 0.00 0.00 37.83 35.31 1l3n s LYS 122 CO 0.60 -0.44 1.28 0.00 -0.92 0.00 0.00 175.35 175.87 1l3n s ALA 123 N -2.76 3.50 -0.44 5.17 0.00 -1.23 -0.67 121.76 125.33 1l3n s ALA 123 Ca 0.28 1.10 -0.29 0.00 0.00 0.00 0.00 51.96 53.06 1l3n s ALA 123 Cb -0.00 -3.46 0.02 0.00 0.00 0.00 0.00 23.12 19.68 1l3n s ALA 123 CO 0.17 -0.50 1.28 0.34 0.00 0.00 0.00 175.76 177.04 1l3n s ASP 124 N 0.05 6.49 -1.36 0.00 -1.08 -1.26 -3.08 116.67 116.42 1l3n s ASP 124 Ca 0.54 0.65 -0.09 0.00 -0.52 0.00 0.00 52.55 53.13 1l3n s ASP 124 Cb -0.36 -2.54 -0.11 0.00 -1.46 0.00 0.00 42.92 38.44 1l3n s ASP 124 CO 0.41 -1.34 3.05 -0.67 0.52 0.00 0.00 175.17 177.14 1l3n n ASP 125 N 8.33 8.21 0.00 -0.34 2.03 -1.26 -4.77 116.55 128.75 1l3n n ASP 125 Ca 0.14 -2.58 0.00 0.00 0.52 0.00 0.00 54.79 52.88 1l3n n ASP 125 Cb 0.48 -1.53 0.00 0.00 -0.72 0.00 0.00 41.12 39.35 1l3n n ASP 125 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1l3n n LEU 126 N 3.34 0.00 0.00 -2.67 4.77 -1.26 -0.42 117.00 120.77 1l3n n LEU 126 Ca 0.73 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.71 1l3n n LEU 126 Cb 0.34 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1l3n n LEU 126 CO 0.74 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.41 1l3n n GLY 127 N 0.00 1.95 0.79 -0.72 0.00 -0.83 -4.79 105.19 101.60 1l3n n GLY 127 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 1l3n n GLY 127 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1l3n n LYS 128 N -2.00 1.80 0.21 1.61 2.85 0.44 -4.51 118.16 118.56 1l3n n LYS 128 Ca 0.00 -3.10 0.14 0.00 -1.05 0.00 0.00 58.31 54.30 1l3n n LYS 128 Cb 0.00 -1.71 0.47 0.00 -0.65 0.00 0.00 35.03 33.14 1l3n n LYS 128 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 177.40 178.13 1l3n h GLY 129 N 0.95 0.00 -5.37 2.58 0.00 -1.73 -3.48 103.07 96.02 1l3n h GLY 129 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 47.09 1l3n h GLY 129 CO 0.19 0.00 -0.65 0.61 0.00 0.00 0.00 176.54 176.69 1l3n n GLY 130 N 0.50 -0.36 3.83 4.60 0.00 -1.26 -4.85 105.19 107.65 1l3n n GLY 130 Ca 0.03 0.12 -0.06 0.00 0.00 0.00 0.00 46.02 46.11 1l3n n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l3n s ASN 131 N -3.70 -0.07 0.24 1.61 2.20 -1.26 -5.01 114.94 108.96 1l3n s ASN 131 Ca 0.30 -0.76 -0.05 0.00 -0.94 0.00 0.00 52.86 51.41 1l3n s ASN 131 Cb -0.13 0.64 0.37 0.00 -2.00 0.00 0.00 41.25 40.13 1l3n s ASN 131 CO 0.66 -1.25 1.83 -0.08 -2.94 0.00 0.00 177.10 175.32 1l3n h GLU 132 N 2.00 0.84 0.00 3.55 4.81 -1.94 0.63 114.58 124.46 1l3n h GLU 132 Ca -0.27 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.90 1l3n h GLU 132 Cb 1.24 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 30.42 1l3n h GLU 132 CO 0.34 0.56 -0.05 1.49 -0.73 0.00 0.00 179.01 180.62 1l3n h GLU 133 N 0.87 0.00 -0.76 1.92 4.57 -1.97 -1.43 114.58 117.78 1l3n h GLU 133 Ca 0.39 0.00 0.18 0.00 -1.18 0.00 0.00 59.36 58.74 1l3n h GLU 133 Cb 0.28 0.00 -0.12 0.00 -0.16 0.00 0.00 28.75 28.75 1l3n h GLU 133 CO -0.22 0.05 0.14 1.03 -1.18 0.00 0.00 179.01 178.83 1l3n h SER 134 N 0.00 -0.08 -0.34 1.04 0.87 0.32 0.47 113.55 115.83 1l3n h SER 134 Ca -0.00 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 1l3n h SER 134 Cb 0.09 0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 1l3n h SER 134 CO 0.01 -0.09 0.00 1.07 -0.53 0.00 0.00 176.83 177.28 1l3n n THR 135 N -5.22 0.45 0.00 2.23 5.66 -0.54 -3.41 114.28 113.45 1l3n n THR 135 Ca 0.15 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.66 1l3n n THR 135 Cb 0.50 0.32 0.00 0.00 -1.55 0.00 0.00 70.33 69.60 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 0.61 0.00 -0.82 1.09 5.02 0.51 -4.03 118.16 120.53 1l3n n LYS 136 Ca 0.14 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.38 1l3n n LYS 136 Cb 0.34 0.00 0.20 0.00 -0.02 0.00 0.00 35.03 35.55 1l3n n LYS 136 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1l3n n THR 137 N -0.88 2.59 0.00 -0.18 -2.24 -0.33 -4.74 114.28 108.50 1l3n n THR 137 Ca 0.00 -2.68 0.00 0.00 -2.27 0.00 0.00 64.05 59.10 1l3n n THR 137 Cb 0.00 -0.33 0.00 0.00 -2.10 0.00 0.00 70.33 67.90 1l3n n THR 137 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l3n n GLY 138 N -1.10 0.94 1.34 3.38 0.00 0.13 -2.08 105.19 107.80 1l3n n GLY 138 Ca 0.34 0.47 -0.04 0.00 0.00 0.00 0.00 46.02 46.80 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 3.60 -0.83 0.09 1.61 2.85 -1.26 -1.44 115.26 119.89 1l3n n ASN 139 Ca 0.00 -1.58 0.11 0.00 -0.11 0.00 0.00 54.58 53.00 1l3n n ASN 139 Cb 0.00 0.31 0.45 0.00 1.24 0.00 0.00 39.78 41.77 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 -0.36 1.74 -0.52 5.20 0.00 -0.88 -4.61 120.51 121.07 1l3n n ALA 140 Ca -0.18 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1l3n n ALA 140 Cb 0.64 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.73 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 0.16 0.68 3.67 0.00 0.00 -1.26 -0.93 105.19 107.50 1l3n n GLY 141 Ca 0.03 -0.80 -0.44 0.00 0.00 0.00 0.00 46.02 44.81 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 -0.22 3.96 -3.91 1.61 7.64 -1.26 -4.70 113.62 116.74 1l3n n SER 142 Ca 0.00 0.93 -0.28 0.00 1.01 0.00 0.00 58.87 60.53 1l3n n SER 142 Cb 0.00 -1.49 -0.10 0.00 -1.01 0.00 0.00 64.21 61.61 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 7.15 0.03 -0.33 1.43 3.00 -1.26 -0.20 116.66 126.47 1l3n n ARG 143 Ca 0.21 -1.05 0.06 0.00 -0.01 0.00 0.00 57.85 57.06 1l3n n ARG 143 Cb 0.37 -2.70 0.14 0.00 0.00 0.00 0.00 32.46 30.28 1l3n n ARG 143 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 1l3n n LEU 144 N 11.55 -0.32 -3.56 0.55 7.94 -1.12 -4.75 117.00 127.30 1l3n n LEU 144 Ca 0.37 1.59 -0.12 0.00 -1.11 0.00 0.00 56.01 56.74 1l3n n LEU 144 Cb 0.42 -0.49 -0.04 0.00 0.53 0.00 0.00 43.42 43.84 1l3n n LEU 144 CO 0.87 -1.53 0.25 0.00 -1.11 0.00 0.00 177.39 175.88 1l3n s ALA 145 N -6.14 -1.22 0.21 1.96 0.00 -0.50 -4.21 121.76 111.86 1l3n s ALA 145 Ca -0.14 0.30 -0.23 0.00 0.00 0.00 0.00 51.96 51.90 1l3n s ALA 145 Cb 0.25 0.63 0.05 0.00 0.00 0.00 0.00 23.12 24.05 1l3n s ALA 145 CO 0.72 -0.62 0.89 0.00 0.00 0.00 0.00 175.76 176.75 1l3n n GLY 147 N -0.50 1.47 3.17 0.00 0.00 0.41 -0.49 105.19 109.24 1l3n n GLY 147 Ca -0.05 -0.68 -0.15 0.00 0.00 0.00 0.00 46.02 45.14 1l3n n GLY 147 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1l3n s VAL 148 N -2.37 0.93 0.00 1.61 1.01 -1.25 -0.34 120.40 120.00 1l3n s VAL 148 Ca 0.00 -1.59 0.00 0.00 0.00 0.00 0.00 61.98 60.39 1l3n s VAL 148 Cb 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 36.38 35.08 1l3n s VAL 148 CO 0.00 -0.52 0.13 -0.38 0.00 0.00 0.00 175.10 174.33 1l3n n ILE 149 N 0.66 0.00 0.00 2.22 5.41 -1.25 -3.50 119.36 122.90 1l3n n ILE 149 Ca -0.17 0.40 0.00 0.00 1.00 0.00 0.00 62.75 63.99 1l3n n ILE 149 Cb 0.57 -0.94 0.00 0.00 -0.71 0.00 0.00 39.64 38.56 1l3n n ILE 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1l3n n GLY 150 N 1.13 1.47 3.77 7.39 0.00 -1.24 -3.50 105.19 114.21 1l3n n GLY 150 Ca 0.00 -1.41 -0.38 0.00 0.00 0.00 0.00 46.02 44.23 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 -0.37 2.95 0.31 -0.61 1.01 -1.26 -1.38 121.20 121.86 1l3n s ILE 151 Ca 0.00 0.75 0.04 0.00 0.00 0.00 0.00 60.65 61.45 1l3n s ILE 151 Cb 0.00 -3.40 -0.03 0.00 0.01 0.00 0.00 42.46 39.04 1l3n s ILE 151 CO 0.00 0.03 0.21 0.00 0.00 0.00 0.00 174.94 175.17 1l3n s ALA 152 N -1.45 1.88 -0.36 9.38 0.00 -1.03 -4.76 121.76 125.41 1l3n s ALA 152 Ca 0.62 -1.84 0.03 0.00 0.00 0.00 0.00 51.96 50.77 1l3n s ALA 152 Cb -0.31 1.31 0.02 0.00 0.00 0.00 0.00 23.12 24.13 1l3n s ALA 152 CO 0.39 -0.58 0.59 0.94 0.00 0.00 0.00 175.76 177.10