#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 -4.40 0.00 5.66 -1.26 -4.84 114.28 109.44 1l3n n THR 2 Ca 0.00 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.79 1l3n n THR 2 Cb 0.00 -0.02 -0.16 0.00 -1.55 0.00 0.00 70.33 68.61 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 -1.42 1.08 0.21 1.09 2.36 -1.26 0.16 119.74 121.96 1l3n s LYS 3 Ca 0.00 -0.30 -0.06 0.00 -2.55 0.00 0.00 55.97 53.05 1l3n s LYS 3 Cb 0.00 -0.99 -0.02 0.00 -1.05 0.00 0.00 37.83 35.77 1l3n s LYS 3 CO 0.00 0.08 0.28 0.00 1.55 0.00 0.00 175.35 177.26 1l3n s ALA 4 N 0.36 0.51 0.35 3.13 0.00 -0.10 -0.56 121.76 125.45 1l3n s ALA 4 Ca -0.06 -1.30 0.03 0.00 0.00 0.00 0.00 51.96 50.63 1l3n s ALA 4 Cb -0.11 1.21 -0.05 0.00 0.00 0.00 0.00 23.12 24.17 1l3n s ALA 4 CO 0.01 -0.70 0.08 0.14 0.00 0.00 0.00 175.76 175.30 1l3n s VAL 5 N -4.09 0.92 -0.22 0.00 -7.23 -0.21 -0.52 120.40 109.05 1l3n s VAL 5 Ca 0.30 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.44 1l3n s VAL 5 Cb 0.04 -2.62 0.10 0.00 0.56 0.00 0.00 36.38 34.45 1l3n s VAL 5 CO 0.10 0.00 0.22 0.00 -0.31 0.00 0.00 175.10 175.10 1l3n s ALA 6 N -3.32 -0.18 -0.96 1.32 0.00 -0.94 -2.28 121.76 115.39 1l3n s ALA 6 Ca 0.32 0.01 -0.20 0.00 0.00 0.00 0.00 51.96 52.09 1l3n s ALA 6 Cb 0.07 -1.39 0.11 0.00 0.00 0.00 0.00 23.12 21.91 1l3n s ALA 6 CO 0.15 -1.33 1.22 0.14 0.00 0.00 0.00 175.76 175.94 1l3n s VAL 7 N 2.30 4.53 -0.32 0.00 -7.23 -1.26 -2.32 120.40 116.09 1l3n s VAL 7 Ca 0.07 -1.40 -0.29 0.00 -1.81 0.00 0.00 61.98 58.55 1l3n s VAL 7 Cb -0.15 -4.86 0.02 0.00 0.56 0.00 0.00 36.38 31.94 1l3n s VAL 7 CO -0.18 -1.63 1.06 -0.76 -0.31 0.00 0.00 175.10 173.28 1l3n s LEU 8 N 3.25 3.94 0.06 1.32 1.43 0.88 -4.25 118.68 125.31 1l3n s LEU 8 Ca 0.37 1.00 -0.03 0.00 -1.03 0.00 0.00 54.13 54.43 1l3n s LEU 8 Cb -0.03 -3.51 -0.03 0.00 0.03 0.00 0.00 46.19 42.65 1l3n s LEU 8 CO -0.09 -0.87 0.04 -0.54 0.23 0.00 0.00 176.35 175.12 1l3n s LYS 9 N 3.63 0.67 0.19 1.70 1.02 -0.17 -0.23 119.74 126.55 1l3n s LYS 9 Ca 0.44 -1.09 0.00 0.00 0.02 0.00 0.00 55.97 55.34 1l3n s LYS 9 Cb -0.12 0.25 0.00 0.00 -0.52 0.00 0.00 37.83 37.44 1l3n s LYS 9 CO 0.16 -0.16 0.00 0.41 -0.92 0.00 0.00 175.35 174.84 1l3n n GLY 10 N 0.15 -1.82 0.21 -3.33 0.00 -1.21 -0.99 105.19 98.21 1l3n n GLY 10 Ca -0.15 0.47 -0.16 0.00 0.00 0.00 0.00 46.02 46.18 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 0.82 0.00 1.61 5.19 -1.33 -3.48 116.42 119.22 1l3n h ASP 11 Ca 0.00 -0.58 0.00 0.00 -0.62 0.00 0.00 57.03 55.83 1l3n h ASP 11 Cb 0.00 -0.24 0.00 0.00 0.18 0.00 0.00 39.33 39.27 1l3n h ASP 11 CO 0.00 1.25 0.00 0.61 -3.12 0.00 0.00 179.24 177.98 1l3n n GLY 12 N 0.51 2.65 0.36 2.75 0.00 -1.26 -4.90 105.19 105.30 1l3n n GLY 12 Ca -0.06 -0.47 0.03 0.00 0.00 0.00 0.00 46.02 45.53 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 0.95 -5.92 1.61 0.13 -1.93 -3.37 132.00 123.47 1l3n h PRO 13 Ca 0.00 -0.06 -0.53 0.00 -0.87 0.00 0.00 66.00 64.54 1l3n h PRO 13 Cb 0.00 -0.22 -0.01 0.00 0.13 0.00 0.00 31.00 30.91 1l3n h PRO 13 CO 0.00 0.63 1.48 0.08 -0.23 0.00 0.00 178.00 179.96 1l3n s VAL 14 N -5.85 3.14 -0.16 1.56 1.01 -1.26 -3.94 120.40 114.90 1l3n s VAL 14 Ca -0.11 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.00 1l3n s VAL 14 Cb 0.19 -3.25 0.03 0.00 0.00 0.00 0.00 36.38 33.35 1l3n s VAL 14 CO 0.79 -0.20 -0.14 -1.10 0.00 0.00 0.00 175.10 174.45 1l3n s GLN 15 N 6.93 2.32 -0.16 2.72 -0.21 0.09 -3.99 119.66 127.36 1l3n s GLN 15 Ca 0.91 -0.64 -0.04 0.00 0.02 0.00 0.00 55.36 55.61 1l3n s GLN 15 Cb -0.23 -2.21 -0.03 0.00 1.00 0.00 0.00 33.01 31.54 1l3n s GLN 15 CO 0.30 -0.27 -0.02 0.20 -2.12 0.00 0.00 175.29 173.38 1l3n s GLY 16 N 1.45 1.76 -0.55 3.09 0.00 0.68 -0.58 107.32 113.17 1l3n s GLY 16 Ca 0.04 -0.80 0.06 0.00 0.00 0.00 0.00 44.72 44.02 1l3n s GLY 16 CO -0.10 -0.07 0.61 1.39 0.00 0.00 0.00 173.10 174.92 1l3n n ILE 17 N 3.45 0.97 -2.92 0.90 5.41 -0.34 -0.08 119.36 126.75 1l3n n ILE 17 Ca -0.17 -4.63 -0.35 0.00 1.00 0.00 0.00 62.75 58.60 1l3n n ILE 17 Cb 0.52 -2.03 -0.06 0.00 -0.71 0.00 0.00 39.64 37.36 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 -1.72 4.42 -0.26 1.39 1.09 -0.98 -3.38 121.20 121.76 1l3n s ILE 18 Ca 0.36 1.46 -0.00 0.00 -1.10 0.00 0.00 60.65 61.36 1l3n s ILE 18 Cb 0.12 -3.78 0.08 0.00 -1.06 0.00 0.00 42.46 37.82 1l3n s ILE 18 CO -0.08 -0.05 0.02 0.20 -0.10 0.00 0.00 174.94 174.93 1l3n s ASN 19 N -1.92 3.77 -0.15 3.58 0.02 0.30 -2.23 114.94 118.31 1l3n s ASN 19 Ca 0.53 -1.32 -0.23 0.00 -1.02 0.00 0.00 52.86 50.82 1l3n s ASN 19 Cb -0.14 -0.99 -0.02 0.00 0.02 0.00 0.00 41.25 40.12 1l3n s ASN 19 CO 0.19 -0.32 0.74 -0.36 0.02 0.00 0.00 177.10 177.37 1l3n s PHE 20 N 1.52 3.44 0.06 2.20 0.08 0.32 -2.88 117.98 122.72 1l3n s PHE 20 Ca 0.01 1.15 0.09 0.00 0.12 0.00 0.00 56.93 58.31 1l3n s PHE 20 Cb -0.18 -2.90 -0.03 0.00 -0.57 0.00 0.00 43.02 39.34 1l3n s PHE 20 CO -0.12 -0.14 -0.26 -2.00 -0.10 0.00 0.00 175.22 172.59 1l3n s GLU 21 N 1.75 1.72 -0.28 0.44 2.12 -1.00 -0.92 118.70 122.53 1l3n s GLU 21 Ca 0.35 -1.14 0.01 0.00 0.36 0.00 0.00 54.97 54.55 1l3n s GLU 21 Cb -0.17 -1.95 0.08 0.00 0.26 0.00 0.00 34.13 32.36 1l3n s GLU 21 CO 0.13 0.50 0.01 -1.14 -0.54 0.00 0.00 175.26 174.22 1l3n s GLN 22 N -1.37 1.36 0.08 4.30 2.00 0.12 -2.31 119.66 123.84 1l3n s GLN 22 Ca 0.12 -1.22 -0.32 0.00 -2.00 0.00 0.00 55.36 51.94 1l3n s GLN 22 Cb -0.10 -2.59 -0.15 0.00 0.80 0.00 0.00 33.01 30.97 1l3n s GLN 22 CO 0.03 -0.78 1.49 0.87 -0.50 0.00 0.00 175.29 176.40 1l3n h LYS 23 N 7.91 -0.85 -4.89 1.67 1.79 -1.86 -3.44 116.57 116.89 1l3n h LYS 23 Ca -0.13 0.06 -0.33 0.00 -2.18 0.00 0.00 60.65 58.06 1l3n h LYS 23 Cb 1.05 0.19 -0.14 0.00 -1.58 0.00 0.00 32.23 31.75 1l3n h LYS 23 CO 0.45 -0.57 -0.64 -2.00 -1.08 0.00 0.00 179.45 175.62 1l3n s GLU 24 N -5.51 1.30 0.28 3.15 -6.30 -1.26 -5.01 118.70 105.35 1l3n s GLU 24 Ca -0.16 -1.68 0.24 0.00 -2.50 0.00 0.00 54.97 50.88 1l3n s GLU 24 Cb 0.04 -0.32 1.02 0.00 0.00 0.00 0.00 34.13 34.86 1l3n s GLU 24 CO 0.53 -0.21 1.72 0.45 0.02 0.00 0.00 175.26 177.77 1l3n n SER 25 N -0.39 0.70 0.18 -1.70 2.88 -1.26 -0.71 113.62 113.32 1l3n n SER 25 Ca -0.03 0.68 0.12 0.00 -1.33 0.00 0.00 58.87 58.32 1l3n n SER 25 Cb 0.65 -0.83 0.26 0.00 -0.75 0.00 0.00 64.21 63.54 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 -4.11 -3.46 2.35 -1.99 -3.47 115.58 104.90 1l3n h ASN 26 Ca 0.00 0.00 -0.47 0.00 -0.55 0.00 0.00 56.30 55.28 1l3n h ASN 26 Cb 0.35 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.74 1l3n h ASN 26 CO 0.00 0.00 0.37 -0.83 -1.65 0.00 0.00 177.43 175.32 1l3n s GLY 27 N -3.97 2.34 0.43 2.83 0.00 0.11 -5.04 107.32 104.01 1l3n s GLY 27 Ca 0.08 0.46 -0.23 0.00 0.00 0.00 0.00 44.72 45.03 1l3n s GLY 27 CO 0.64 0.76 1.09 2.56 0.00 0.00 0.00 173.10 178.15 1l3n s PRO 28 N -3.53 3.97 -0.20 2.90 0.04 -1.26 -4.89 135.00 132.03 1l3n s PRO 28 Ca 0.64 1.59 -0.29 0.00 0.04 0.00 0.00 61.00 62.98 1l3n s PRO 28 Cb -0.14 -2.43 -0.01 0.00 0.04 0.00 0.00 34.50 31.96 1l3n s PRO 28 CO 0.24 -0.33 1.21 0.08 0.04 0.00 0.00 177.00 178.24 1l3n s VAL 29 N -1.66 4.37 -0.43 -0.36 1.01 0.76 -4.79 120.40 119.31 1l3n s VAL 29 Ca 0.61 1.65 -0.21 0.00 0.00 0.00 0.00 61.98 64.02 1l3n s VAL 29 Cb -0.24 -4.11 0.02 0.00 0.00 0.00 0.00 36.38 32.06 1l3n s VAL 29 CO 0.29 -0.20 0.67 -0.54 0.00 0.00 0.00 175.10 175.33 1l3n s LYS 30 N 3.50 3.35 -0.48 2.72 1.02 -0.98 -1.20 119.74 127.67 1l3n s LYS 30 Ca 0.52 -0.26 -0.19 0.00 0.02 0.00 0.00 55.97 56.05 1l3n s LYS 30 Cb -0.19 -3.93 0.05 0.00 -0.52 0.00 0.00 37.83 33.24 1l3n s LYS 30 CO 0.13 -1.00 0.61 0.14 -0.92 0.00 0.00 175.35 174.31 1l3n s VAL 31 N 2.91 4.89 0.32 3.17 -7.23 0.12 -2.37 120.40 122.20 1l3n s VAL 31 Ca 0.24 -0.38 0.03 0.00 -1.81 0.00 0.00 61.98 60.07 1l3n s VAL 31 Cb -0.14 -4.25 -0.06 0.00 0.56 0.00 0.00 36.38 32.49 1l3n s VAL 31 CO 0.19 -0.73 0.06 -1.66 -0.31 0.00 0.00 175.10 172.66 1l3n s TRP 32 N 2.60 1.92 -5.00 2.82 -2.14 -1.14 -0.84 118.94 117.16 1l3n s TRP 32 Ca 0.16 -0.98 0.00 0.00 2.66 0.00 0.00 56.10 57.94 1l3n s TRP 32 Cb -0.18 -1.24 0.00 0.00 -3.10 0.00 0.00 33.47 28.95 1l3n s TRP 32 CO 0.13 -0.03 0.00 0.41 -2.66 0.00 0.00 176.95 174.80 1l3n n GLY 33 N -0.66 0.09 3.38 3.67 0.00 0.30 -0.53 105.19 111.44 1l3n n GLY 33 Ca -0.02 -1.24 -0.13 0.00 0.00 0.00 0.00 46.02 44.63 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 -0.41 0.50 1.61 0.15 -1.22 -0.65 113.70 109.68 1l3n s SER 34 Ca 0.00 0.07 0.07 0.00 0.70 0.00 0.00 55.95 56.79 1l3n s SER 34 Cb 0.00 0.49 0.02 0.00 -1.71 0.00 0.00 66.02 64.83 1l3n s SER 34 CO 0.00 -0.76 0.43 0.27 1.20 0.00 0.00 173.24 174.38 1l3n s ILE 35 N -2.76 2.04 -0.01 6.45 -4.36 -0.35 -1.20 121.20 121.00 1l3n s ILE 35 Ca -0.04 -1.40 -0.19 0.00 -0.26 0.00 0.00 60.65 58.77 1l3n s ILE 35 Cb -0.00 -2.44 0.04 0.00 1.25 0.00 0.00 42.46 41.31 1l3n s ILE 35 CO -0.04 0.00 0.41 -1.59 0.24 0.00 0.00 174.94 173.95 1l3n s LYS 36 N -4.26 0.79 0.00 0.37 -2.85 0.25 -3.48 119.74 110.55 1l3n s LYS 36 Ca 0.42 -0.12 0.00 0.00 -1.00 0.00 0.00 55.97 55.27 1l3n s LYS 36 Cb -0.03 0.36 0.00 0.00 -2.06 0.00 0.00 37.83 36.10 1l3n s LYS 36 CO 0.25 -0.23 0.00 0.41 0.10 0.00 0.00 175.35 175.88 1l3n n GLY 37 N 1.08 1.93 3.56 0.59 0.00 -1.21 -0.73 105.19 110.42 1l3n n GLY 37 Ca -0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 1l3n n GLY 37 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1l3n n LEU 38 N 0.00 0.00 -5.01 0.99 4.32 -1.23 -4.20 117.00 111.88 1l3n n LEU 38 Ca 0.00 -1.24 -0.21 0.00 -0.02 0.00 0.00 56.01 54.55 1l3n n LEU 38 Cb 0.00 -1.00 0.07 0.00 -1.62 0.00 0.00 43.42 40.87 1l3n n LEU 38 CO 0.00 -1.93 0.39 0.28 -1.22 0.00 0.00 177.39 174.91 1l3n s THR 39 N -3.24 2.36 1.17 -5.08 -1.32 -1.26 -2.99 115.64 105.28 1l3n s THR 39 Ca 0.71 -0.80 -0.14 0.00 -1.21 0.00 0.00 61.69 60.26 1l3n s THR 39 Cb -0.05 -2.56 0.26 0.00 -1.51 0.00 0.00 72.50 68.64 1l3n s THR 39 CO 0.53 0.00 0.85 1.21 -2.21 0.00 0.00 174.62 175.01 1l3n n GLU 40 N -2.41 -2.32 0.00 7.08 2.13 -1.25 -4.53 120.64 119.33 1l3n n GLU 40 Ca 0.13 -0.65 0.00 0.00 0.66 0.00 0.00 57.16 57.30 1l3n n GLU 40 Cb 0.61 -2.09 0.00 0.00 0.27 0.00 0.00 31.44 30.22 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 1.17 -1.97 3.77 8.31 0.00 -0.45 -4.78 105.19 111.25 1l3n n GLY 41 Ca 0.03 -1.45 -0.37 0.00 0.00 0.00 0.00 46.02 44.23 1l3n n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l3n s LEU 42 N 0.00 4.06 0.02 0.99 2.01 -1.26 -0.43 118.68 124.07 1l3n s LEU 42 Ca 0.00 2.24 -0.15 0.00 0.01 0.00 0.00 54.13 56.23 1l3n s LEU 42 Cb 0.00 -4.21 0.02 0.00 0.01 0.00 0.00 46.19 42.01 1l3n s LEU 42 CO 0.00 -0.79 0.32 -1.00 1.01 0.00 0.00 176.35 175.89 1l3n s HIS 43 N -1.57 -0.15 -0.37 0.29 3.76 0.77 -3.57 115.29 114.45 1l3n s HIS 43 Ca 0.62 0.13 -0.40 0.00 -0.15 0.00 0.00 55.06 55.25 1l3n s HIS 43 Cb -0.27 0.11 -0.17 0.00 1.11 0.00 0.00 32.58 33.35 1l3n s HIS 43 CO 0.33 -0.46 1.32 0.41 -0.85 0.00 0.00 174.74 175.49 1l3n n GLY 44 N 0.88 0.11 3.03 -2.22 0.00 0.12 -1.43 105.19 105.67 1l3n n GLY 44 Ca -0.20 0.84 -0.03 0.00 0.00 0.00 0.00 46.02 46.64 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 2.22 -1.29 0.24 1.61 2.19 -1.25 -1.21 117.98 120.50 1l3n s PHE 45 Ca 0.89 1.05 -0.09 0.00 0.33 0.00 0.00 56.93 59.11 1l3n s PHE 45 Cb -1.27 0.21 -0.01 0.00 -1.31 0.00 0.00 43.02 40.63 1l3n s PHE 45 CO 0.68 -0.89 0.38 -1.01 1.83 0.00 0.00 175.22 176.21 1l3n s HIS 46 N 2.69 0.65 -0.12 10.12 0.09 -0.24 -3.60 115.29 124.88 1l3n s HIS 46 Ca 0.14 -0.96 -0.00 0.00 -0.00 0.00 0.00 55.06 54.24 1l3n s HIS 46 Cb -0.14 -0.05 -0.02 0.00 -0.00 0.00 0.00 32.58 32.37 1l3n s HIS 46 CO -0.22 -0.90 -0.10 0.08 -0.00 0.00 0.00 174.74 173.60 1l3n s VAL 47 N -3.99 3.35 0.17 -0.90 1.01 -0.55 -0.68 120.40 118.82 1l3n s VAL 47 Ca 0.28 -0.57 -0.23 0.00 0.00 0.00 0.00 61.98 61.46 1l3n s VAL 47 Cb 0.02 -2.41 0.08 0.00 0.00 0.00 0.00 36.38 34.07 1l3n s VAL 47 CO 0.11 0.53 1.04 -1.38 0.00 0.00 0.00 175.10 175.40 1l3n s HIS 48 N 0.06 0.04 0.00 5.22 -3.43 -1.24 -3.99 115.29 111.96 1l3n s HIS 48 Ca -0.03 -0.42 0.00 0.00 -0.80 0.00 0.00 55.06 53.81 1l3n s HIS 48 Cb -0.14 0.69 0.00 0.00 -1.43 0.00 0.00 32.58 31.70 1l3n s HIS 48 CO 0.04 -0.88 0.00 -0.85 -2.00 0.00 0.00 174.74 171.04 1l3n n GLU 49 N -0.67 0.00 -2.51 -0.38 0.28 -1.25 -3.95 120.64 112.15 1l3n n GLU 49 Ca -0.03 0.00 -0.28 0.00 -0.16 0.00 0.00 57.16 56.68 1l3n n GLU 49 Cb 0.60 0.00 -0.00 0.00 1.43 0.00 0.00 31.44 33.46 1l3n n GLU 49 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 1l3n s PHE 50 N 0.00 3.57 -0.15 -1.84 0.08 0.06 -4.53 117.98 115.16 1l3n s PHE 50 Ca 0.00 0.93 0.30 0.00 0.12 0.00 0.00 56.93 58.28 1l3n s PHE 50 Cb 0.00 -2.40 1.11 0.00 -0.57 0.00 0.00 43.02 41.17 1l3n s PHE 50 CO 0.00 -0.34 1.86 0.78 -0.10 0.00 0.00 175.22 177.42 1l3n h GLY 51 N 0.23 0.00 -4.36 4.36 0.00 -1.83 -3.31 103.07 98.17 1l3n h GLY 51 Ca -0.46 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.27 1l3n h GLY 51 CO 0.62 0.00 0.14 1.34 0.00 0.00 0.00 176.54 178.64 1l3n n ASP 52 N -2.84 1.34 0.00 0.19 2.03 -1.26 -4.82 116.55 111.19 1l3n n ASP 52 Ca 0.02 1.16 0.00 0.00 0.52 0.00 0.00 54.79 56.48 1l3n n ASP 52 Cb 0.32 -1.31 0.00 0.00 -0.72 0.00 0.00 41.12 39.42 1l3n n ASP 52 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1l3n n ASN 53 N 1.11 0.00 -0.34 1.67 4.05 -1.26 -2.86 115.26 117.62 1l3n n ASN 53 Ca 0.09 -1.00 -0.04 0.00 0.45 0.00 0.00 54.58 54.08 1l3n n ASN 53 Cb 0.33 0.00 0.01 0.00 1.23 0.00 0.00 39.78 41.35 1l3n n ASN 53 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 177.26 174.92 1l3n h THR 54 N 2.77 0.03 0.00 -0.44 1.35 -1.95 0.12 112.91 114.80 1l3n h THR 54 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1l3n h THR 54 Cb 0.94 0.03 0.00 0.00 -1.73 0.00 0.00 68.15 67.40 1l3n h THR 54 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 1l3n h ALA 55 N 1.11 1.00 -0.04 6.62 0.00 -1.96 -3.48 119.26 122.51 1l3n h ALA 55 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1l3n h ALA 55 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1l3n h ALA 55 CO -0.90 0.00 0.00 0.41 0.00 0.00 0.00 179.25 178.76 1l3n n GLY 56 N 0.84 0.71 2.37 0.00 0.00 0.43 -4.83 105.19 104.71 1l3n n GLY 56 Ca 0.04 -0.65 -0.11 0.00 0.00 0.00 0.00 46.02 45.29 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 -3.86 0.38 -0.28 0.00 -1.04 -1.26 -4.86 114.28 103.36 1l3n n THR 58 Ca -0.05 0.13 0.06 0.00 -2.04 0.00 0.00 64.05 62.15 1l3n n THR 58 Cb 0.56 -0.94 0.21 0.00 -1.82 0.00 0.00 70.33 68.34 1l3n n THR 58 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1l3n h SER 59 N 0.00 0.45 -0.16 8.00 0.02 -1.87 -2.26 113.55 117.74 1l3n h SER 59 Ca 0.00 0.10 0.02 0.00 -0.84 0.00 0.00 61.79 61.07 1l3n h SER 59 Cb 0.10 0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 1l3n h SER 59 CO 0.00 0.19 -0.07 0.00 -1.14 0.00 0.00 176.83 175.81 1l3n n ALA 60 N -2.45 -0.04 0.00 3.77 0.00 -1.14 -4.91 120.51 115.75 1l3n n ALA 60 Ca 0.16 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1l3n n ALA 60 Cb 0.42 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.81 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 -1.07 0.83 0.00 0.00 0.00 -0.85 -0.76 105.19 103.34 1l3n n GLY 61 Ca 0.01 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.32 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 0.00 3.56 -0.76 1.61 -0.04 -1.26 -4.91 135.00 133.20 1l3n n PRO 62 Ca 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.39 1l3n n PRO 62 Cb 0.00 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.36 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 0.00 0.00 -1.19 0.54 8.25 -1.26 -3.92 115.22 117.65 1l3n n HIS 63 Ca 0.00 -1.20 -0.35 0.00 -0.26 0.00 0.00 57.72 55.91 1l3n n HIS 63 Cb 0.00 -1.16 -0.03 0.00 1.12 0.00 0.00 29.99 29.92 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 2.24 2.21 -1.66 4.41 3.72 -1.26 -4.73 117.46 122.38 1l3n n PHE 64 Ca 0.26 -2.77 -0.32 0.00 -0.05 0.00 0.00 57.45 54.58 1l3n n PHE 64 Cb 0.71 -2.27 0.05 0.00 -0.94 0.00 0.00 39.48 37.03 1l3n n PHE 64 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1l3n s ASN 65 N 2.63 5.15 0.22 4.37 0.01 -1.26 -4.54 114.94 121.52 1l3n s ASN 65 Ca 0.60 1.84 -0.07 0.00 -0.71 0.00 0.00 52.86 54.52 1l3n s ASN 65 Cb 0.16 -2.53 0.30 0.00 0.41 0.00 0.00 41.25 39.58 1l3n s ASN 65 CO -0.05 -1.60 1.81 1.55 -1.51 0.00 0.00 177.10 177.30 1l3n h PRO 66 N -0.31 0.71 -1.95 -0.60 0.13 -1.99 -1.42 132.00 126.56 1l3n h PRO 66 Ca -0.45 -0.04 -0.27 0.00 -0.87 0.00 0.00 66.00 64.36 1l3n h PRO 66 Cb 1.23 -0.16 -0.10 0.00 0.13 0.00 0.00 31.00 32.10 1l3n h PRO 66 CO 0.55 0.47 -0.01 1.28 -0.23 0.00 0.00 178.00 180.05 1l3n n LEU 67 N -4.77 5.76 -4.56 1.56 4.77 -1.26 -4.86 117.00 113.64 1l3n n LEU 67 Ca 0.10 -3.35 -0.18 0.00 -0.03 0.00 0.00 56.01 52.56 1l3n n LEU 67 Cb 0.21 -1.28 -0.06 0.00 -2.33 0.00 0.00 43.42 39.95 1l3n n LEU 67 CO 0.28 1.56 1.33 -0.94 -1.33 0.00 0.00 177.39 178.29 1l3n s SER 68 N 1.31 4.09 0.00 -1.43 1.04 -0.54 -4.25 113.70 113.92 1l3n s SER 68 Ca 0.51 0.11 -0.01 0.00 0.48 0.00 0.00 55.95 57.04 1l3n s SER 68 Cb 0.29 -2.54 -0.00 0.00 0.10 0.00 0.00 66.02 63.86 1l3n s SER 68 CO -0.07 -3.63 -0.01 -1.14 0.98 0.00 0.00 173.24 169.37 1l3n n ARG 69 N 8.85 0.02 -3.65 4.02 0.63 -1.26 -5.05 116.66 120.22 1l3n n ARG 69 Ca 0.45 0.01 -0.10 0.00 -0.92 0.00 0.00 57.85 57.28 1l3n n ARG 69 Cb 0.45 -0.23 -0.04 0.00 0.45 0.00 0.00 32.46 33.09 1l3n n ARG 69 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 1l3n s LYS 70 N -1.12 1.17 0.06 -0.14 -0.14 -0.84 -5.08 119.74 113.65 1l3n s LYS 70 Ca -0.01 -0.74 -0.31 0.00 -1.36 0.00 0.00 55.97 53.56 1l3n s LYS 70 Cb 0.00 0.49 -0.06 0.00 -1.68 0.00 0.00 37.83 36.58 1l3n s LYS 70 CO 0.01 -0.47 1.27 -1.58 -0.76 0.00 0.00 175.35 173.82 1l3n s HIS 71 N -3.82 3.30 0.00 3.18 5.65 -0.72 -2.41 115.29 120.47 1l3n s HIS 71 Ca 0.05 1.14 0.00 0.00 0.25 0.00 0.00 55.06 56.50 1l3n s HIS 71 Cb 0.01 -3.52 0.00 0.00 -1.18 0.00 0.00 32.58 27.89 1l3n s HIS 71 CO -0.09 -1.72 0.00 0.41 -0.65 0.00 0.00 174.74 172.69 1l3n n GLY 72 N 3.35 4.69 0.00 1.59 0.00 -1.26 -3.32 105.19 110.25 1l3n n GLY 72 Ca 0.10 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1l3n n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l3n n GLY 73 N 0.00 -0.61 0.42 -0.02 0.00 -1.26 -4.62 105.19 99.09 1l3n n GLY 73 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.48 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 0.47 -0.01 1.61 -0.04 -1.26 -0.76 135.00 135.00 1l3n n PRO 74 Ca 0.00 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.53 1l3n n PRO 74 Cb 0.00 -1.19 -0.13 0.00 -0.04 0.00 0.00 33.50 32.14 1l3n n PRO 74 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1l3n n LYS 75 N 0.14 0.60 -4.55 0.54 4.76 -1.26 -5.03 118.16 113.35 1l3n n LYS 75 Ca 0.00 -0.14 -0.26 0.00 -2.87 0.00 0.00 58.31 55.05 1l3n n LYS 75 Cb 0.10 -1.39 -0.11 0.00 -1.84 0.00 0.00 35.03 31.79 1l3n n LYS 75 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1l3n s ASP 76 N -4.00 3.62 0.00 4.39 1.11 0.06 -5.04 116.67 116.81 1l3n s ASP 76 Ca -0.06 -1.25 -0.18 0.00 0.18 0.00 0.00 52.55 51.23 1l3n s ASP 76 Cb 0.10 -0.33 -0.32 0.00 1.07 0.00 0.00 42.92 43.43 1l3n s ASP 76 CO 0.68 -0.30 0.98 -0.08 1.18 0.00 0.00 175.17 177.63 1l3n h GLU 77 N 1.98 0.45 -1.09 8.23 4.81 -1.96 -3.40 114.58 123.60 1l3n h GLU 77 Ca -0.42 -0.72 -0.48 0.00 -0.13 0.00 0.00 59.36 57.61 1l3n h GLU 77 Cb 1.25 0.26 -0.24 0.00 0.63 0.00 0.00 28.75 30.64 1l3n h GLU 77 CO 0.73 1.33 0.62 -0.85 -0.73 0.00 0.00 179.01 180.11 1l3n n GLU 78 N -3.93 2.19 -1.30 1.92 0.00 -1.26 -4.98 120.64 113.27 1l3n n GLU 78 Ca -0.15 -2.55 -0.35 0.00 0.00 0.00 0.00 57.16 54.11 1l3n n GLU 78 Cb 0.94 -2.00 0.10 0.00 0.00 0.00 0.00 31.44 30.48 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 -0.65 0.45 -1.53 3.44 1.85 -1.26 -1.99 116.66 116.97 1l3n n ARG 79 Ca 0.50 0.21 -0.31 0.00 -1.00 0.00 0.00 57.85 57.25 1l3n n ARG 79 Cb 1.05 -2.28 0.06 0.00 -1.05 0.00 0.00 32.46 30.24 1l3n n ARG 79 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 1l3n s HIS 80 N -1.88 2.90 0.35 2.89 3.76 -1.01 -4.70 115.29 117.60 1l3n s HIS 80 Ca 0.73 1.48 0.20 0.00 -0.15 0.00 0.00 55.06 57.32 1l3n s HIS 80 Cb -0.33 -2.96 1.27 0.00 1.11 0.00 0.00 32.58 31.67 1l3n s HIS 80 CO 0.50 -1.43 1.49 1.55 -0.85 0.00 0.00 174.74 176.01 1l3n n VAL 81 N -3.11 -0.40 -2.58 -0.90 3.14 -1.26 -1.02 118.33 112.20 1l3n n VAL 81 Ca 0.08 1.92 -0.10 0.00 -2.96 0.00 0.00 64.34 63.29 1l3n n VAL 81 Cb 0.53 -3.12 0.03 0.00 -1.06 0.00 0.00 33.84 30.23 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 -1.25 3.17 3.56 7.55 0.00 -1.26 -4.66 105.19 112.31 1l3n n GLY 82 Ca 0.36 -1.63 -0.41 0.00 0.00 0.00 0.00 46.02 44.34 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 -3.60 6.52 0.21 1.61 1.01 -0.19 -1.48 116.67 120.75 1l3n s ASP 83 Ca 0.34 -1.50 -0.05 0.00 0.71 0.00 0.00 52.55 52.05 1l3n s ASP 83 Cb 0.38 -2.57 0.17 0.00 1.01 0.00 0.00 42.92 41.90 1l3n s ASP 83 CO -0.02 -1.49 1.62 -0.07 0.21 0.00 0.00 175.17 175.41 1l3n h LEU 84 N 12.79 0.80 0.00 1.23 3.38 -1.89 -3.40 115.31 128.23 1l3n h LEU 84 Ca 0.21 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1l3n h LEU 84 Cb 1.00 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1l3n h LEU 84 CO 1.43 1.01 0.00 0.61 0.09 0.00 0.00 178.44 181.58 1l3n n GLY 85 N -0.20 1.96 2.81 0.83 0.00 -1.24 -4.42 105.19 104.93 1l3n n GLY 85 Ca -0.00 -0.73 -0.14 0.00 0.00 0.00 0.00 46.02 45.14 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 0.03 -0.06 1.61 0.02 -1.26 -4.11 114.94 107.17 1l3n s ASN 86 Ca 0.00 0.09 0.04 0.00 -1.02 0.00 0.00 52.86 51.97 1l3n s ASN 86 Cb 0.00 -0.01 -0.02 0.00 0.02 0.00 0.00 41.25 41.24 1l3n s ASN 86 CO 0.00 -0.12 -0.16 0.68 0.02 0.00 0.00 177.10 177.52 1l3n s VAL 87 N 0.99 2.87 -0.01 1.60 -7.23 -0.51 -4.85 120.40 113.25 1l3n s VAL 87 Ca -0.08 -0.78 -0.25 0.00 -1.81 0.00 0.00 61.98 59.06 1l3n s VAL 87 Cb -0.11 -2.12 -0.04 0.00 0.56 0.00 0.00 36.38 34.66 1l3n s VAL 87 CO -0.03 0.58 0.75 0.28 -0.31 0.00 0.00 175.10 176.37 1l3n s THR 88 N -0.50 4.90 -0.09 5.32 -1.32 -1.26 -0.16 115.64 122.54 1l3n s THR 88 Ca 0.06 1.58 -0.01 0.00 -1.21 0.00 0.00 61.69 62.12 1l3n s THR 88 Cb -0.12 -4.10 -0.03 0.00 -1.51 0.00 0.00 72.50 66.75 1l3n s THR 88 CO 0.01 0.29 -0.04 0.00 -2.21 0.00 0.00 174.62 172.67 1l3n s ALA 89 N 0.46 3.09 1.24 11.08 0.00 0.43 -4.16 121.76 133.89 1l3n s ALA 89 Ca 0.39 -0.85 -0.15 0.00 0.00 0.00 0.00 51.96 51.35 1l3n s ALA 89 Cb -0.19 -1.36 0.30 0.00 0.00 0.00 0.00 23.12 21.86 1l3n s ALA 89 CO 0.21 0.52 0.86 -3.47 0.00 0.00 0.00 175.76 173.89 1l3n n ASP 90 N 2.39 -2.35 -0.38 0.00 -0.08 0.10 -1.34 116.55 114.89 1l3n n ASP 90 Ca -0.18 -0.32 0.31 0.00 -1.51 0.00 0.00 54.79 53.09 1l3n n ASP 90 Cb 0.53 -1.17 0.61 0.00 2.34 0.00 0.00 41.12 43.44 1l3n n ASP 90 CO 0.00 0.00 0.00 0.07 0.12 0.00 0.00 177.20 177.39 1l3n h LYS 91 N -2.85 0.20 -0.00 -0.67 2.10 -1.91 0.19 116.57 113.63 1l3n h LYS 91 Ca -0.59 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.05 1l3n h LYS 91 Cb 1.33 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.62 1l3n h LYS 91 CO 0.44 0.13 -0.04 -0.25 -2.00 0.00 0.00 179.45 177.73 1l3n n ASP 92 N -4.55 0.30 0.00 7.07 8.00 -1.26 -4.29 116.55 121.82 1l3n n ASP 92 Ca 0.31 -0.69 0.00 0.00 0.71 0.00 0.00 54.79 55.12 1l3n n ASP 92 Cb 1.19 -0.09 0.00 0.00 -0.02 0.00 0.00 41.12 42.20 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 1.18 0.65 3.46 0.44 0.00 0.66 -3.41 105.19 108.17 1l3n n GLY 93 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.23 4.34 -0.25 1.61 1.01 -1.25 -3.35 120.40 120.27 1l3n s VAL 94 Ca 0.00 -0.47 -0.14 0.00 0.00 0.00 0.00 61.98 61.37 1l3n s VAL 94 Cb 0.00 -4.71 -0.04 0.00 0.00 0.00 0.00 36.38 31.63 1l3n s VAL 94 CO 0.00 -1.49 0.33 0.00 0.00 0.00 0.00 175.10 173.94 1l3n s ALA 95 N 4.00 3.56 -0.37 5.51 0.00 -1.23 -0.72 121.76 132.52 1l3n s ALA 95 Ca 0.24 -0.80 -0.25 0.00 0.00 0.00 0.00 51.96 51.14 1l3n s ALA 95 Cb -0.15 -2.62 0.01 0.00 0.00 0.00 0.00 23.12 20.37 1l3n s ALA 95 CO 0.08 -0.52 0.91 0.16 0.00 0.00 0.00 175.76 176.39 1l3n s ASP 96 N 1.47 6.67 -0.18 0.00 -4.77 -1.26 -1.21 116.67 117.38 1l3n s ASP 96 Ca 0.14 0.56 -0.08 0.00 -3.30 0.00 0.00 52.55 49.87 1l3n s ASP 96 Cb -0.15 -2.46 -0.04 0.00 -1.09 0.00 0.00 42.92 39.18 1l3n s ASP 96 CO 0.09 -0.84 0.09 -0.69 0.70 0.00 0.00 175.17 174.53 1l3n s VAL 97 N 3.42 5.08 -0.41 2.11 1.01 0.17 -4.89 120.40 126.89 1l3n s VAL 97 Ca 0.37 0.07 0.07 0.00 0.00 0.00 0.00 61.98 62.49 1l3n s VAL 97 Cb -0.12 -3.29 0.18 0.00 0.00 0.00 0.00 36.38 33.15 1l3n s VAL 97 CO 0.18 0.47 0.60 -0.94 0.00 0.00 0.00 175.10 175.42 1l3n s SER 98 N 0.17 -1.09 0.22 3.32 1.04 -1.25 -0.54 113.70 115.58 1l3n s SER 98 Ca 0.06 -1.02 0.05 0.00 0.48 0.00 0.00 55.95 55.52 1l3n s SER 98 Cb -0.12 1.72 -0.05 0.00 0.10 0.00 0.00 66.02 67.67 1l3n s SER 98 CO -0.00 -0.17 -0.06 -0.63 0.98 0.00 0.00 173.24 173.36 1l3n s ILE 99 N 1.67 1.32 0.04 -1.02 1.09 -0.02 -4.98 121.20 119.30 1l3n s ILE 99 Ca 0.18 -2.09 0.02 0.00 -1.10 0.00 0.00 60.65 57.66 1l3n s ILE 99 Cb -0.05 -2.23 -0.02 0.00 -1.06 0.00 0.00 42.46 39.09 1l3n s ILE 99 CO -0.06 -0.44 -0.07 -1.83 -0.10 0.00 0.00 174.94 172.44 1l3n s GLU 100 N -3.77 0.50 0.05 2.79 -1.05 -1.26 0.12 118.70 116.07 1l3n s GLU 100 Ca 0.26 -0.76 -0.10 0.00 -0.15 0.00 0.00 54.97 54.22 1l3n s GLU 100 Cb 0.04 -0.22 0.00 0.00 -0.44 0.00 0.00 34.13 33.51 1l3n s GLU 100 CO 0.08 0.03 0.20 0.34 0.95 0.00 0.00 175.26 176.86 1l3n s ASP 101 N -1.62 0.03 -0.49 0.83 -1.08 -0.35 -4.98 116.67 109.03 1l3n s ASP 101 Ca -0.10 -0.40 0.03 0.00 -0.52 0.00 0.00 52.55 51.57 1l3n s ASP 101 Cb -0.09 0.30 0.43 0.00 -1.46 0.00 0.00 42.92 42.10 1l3n s ASP 101 CO -0.00 -0.59 1.45 -1.54 0.52 0.00 0.00 175.17 175.01 1l3n n SER 102 N 0.56 5.77 0.00 -0.34 3.41 -1.26 -0.17 113.62 121.60 1l3n n SER 102 Ca -0.18 -3.76 0.00 0.00 -0.26 0.00 0.00 58.87 54.67 1l3n n SER 102 Cb 0.59 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 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 -0.65 0.00 -1.51 -3.33 3.14 -1.26 -5.03 118.33 109.69 1l3n n VAL 103 Ca 0.47 0.00 -0.48 0.00 -2.96 0.00 0.00 64.34 61.38 1l3n n VAL 103 Cb 0.71 -0.27 -0.05 0.00 -1.06 0.00 0.00 33.84 33.16 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 -2.12 0.26 -4.03 1.55 2.08 -1.26 -4.93 119.36 110.91 1l3n n ILE 104 Ca 0.00 -0.34 -0.31 0.00 0.56 0.00 0.00 62.75 62.66 1l3n n ILE 104 Cb 0.00 -2.03 -0.15 0.00 -0.75 0.00 0.00 39.64 36.71 1l3n n ILE 104 CO 0.00 0.00 0.00 -0.44 0.56 0.00 0.00 176.55 176.67 1l3n s SER 105 N 7.64 4.54 0.54 4.38 0.01 -1.26 -4.38 113.70 125.16 1l3n s SER 105 Ca 1.06 -1.73 0.22 0.00 1.31 0.00 0.00 55.95 56.80 1l3n s SER 105 Cb -0.64 -1.54 1.42 0.00 0.21 0.00 0.00 66.02 65.48 1l3n s SER 105 CO 0.43 -0.29 2.12 -0.07 0.41 0.00 0.00 173.24 175.84 1l3n h LEU 106 N 7.72 0.00 -7.66 2.44 3.38 -1.93 0.92 115.31 120.18 1l3n h LEU 106 Ca -0.12 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 1l3n h LEU 106 Cb 1.03 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.65 1l3n h LEU 106 CO 0.48 0.00 -0.22 -0.44 0.09 0.00 0.00 178.44 178.35 1l3n s SER 107 N -6.56 -0.06 0.00 -0.43 0.01 -1.26 -3.99 113.70 101.42 1l3n s SER 107 Ca -0.05 -0.53 0.00 0.00 1.31 0.00 0.00 55.95 56.69 1l3n s SER 107 Cb 0.17 0.42 0.00 0.00 0.21 0.00 0.00 66.02 66.82 1l3n s SER 107 CO 0.65 -0.82 0.00 0.61 0.41 0.00 0.00 173.24 174.10 1l3n n GLY 108 N -0.16 0.59 5.00 3.44 0.00 -1.26 -4.63 105.19 108.17 1l3n n GLY 108 Ca -0.14 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.13 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 0.00 0.21 1.61 -0.08 -1.26 -4.20 116.55 112.83 1l3n n ASP 109 Ca 0.00 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.38 1l3n n ASP 109 Cb 0.00 0.00 0.29 0.00 2.34 0.00 0.00 41.12 43.75 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 0.00 -3.84 -0.67 -0.00 -1.88 -3.47 115.15 105.29 1l3n h HIS 110 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 60.37 60.24 1l3n h HIS 110 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 27.41 27.42 1l3n h HIS 110 CO 0.00 0.17 -0.39 0.45 -0.00 0.00 0.00 177.93 178.16 1l3n n SER 111 N -3.19 -1.72 0.00 2.45 2.88 -1.23 -4.78 113.62 108.03 1l3n n SER 111 Ca 0.02 -0.10 0.06 0.00 -1.33 0.00 0.00 58.87 57.52 1l3n n SER 111 Cb 0.52 -0.51 0.29 0.00 -0.75 0.00 0.00 64.21 63.75 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 -0.25 0.78 -1.62 2.46 -6.64 0.32 -4.68 119.36 109.71 1l3n n ILE 112 Ca -0.04 0.19 -0.48 0.00 -1.77 0.00 0.00 62.75 60.65 1l3n n ILE 112 Cb 0.22 -1.00 -0.04 0.00 -1.44 0.00 0.00 39.64 37.38 1l3n n ILE 112 CO 0.00 0.00 0.00 -0.38 -1.77 0.00 0.00 176.55 174.40 1l3n n ILE 113 N -1.32 0.57 -0.33 7.28 2.08 -1.26 -2.36 119.36 124.03 1l3n n ILE 113 Ca 0.05 -0.14 0.00 0.00 0.56 0.00 0.00 62.75 63.22 1l3n n ILE 113 Cb 0.10 -1.15 0.00 0.00 -0.75 0.00 0.00 39.64 37.84 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 2.41 0.83 3.93 7.39 0.00 -1.21 -5.04 105.19 113.49 1l3n n GLY 114 Ca 0.15 -0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.67 0.92 -0.24 1.61 1.81 -0.99 -3.35 118.95 118.04 1l3n s ARG 115 Ca 0.00 -0.30 -0.07 0.00 -1.72 0.00 0.00 55.73 53.64 1l3n s ARG 115 Cb 0.00 -1.87 -0.03 0.00 -0.45 0.00 0.00 34.95 32.60 1l3n s ARG 115 CO 0.00 -2.24 0.05 0.99 -0.68 0.00 0.00 175.30 173.42 1l3n s THR 116 N -3.83 4.26 0.35 0.02 2.01 -1.25 -1.09 115.64 116.11 1l3n s THR 116 Ca 0.71 -0.19 -0.26 0.00 0.31 0.00 0.00 61.69 62.26 1l3n s THR 116 Cb -0.05 -2.97 -0.09 0.00 0.01 0.00 0.00 72.50 69.39 1l3n s THR 116 CO 0.52 0.36 1.02 -0.76 -0.69 0.00 0.00 174.62 175.07 1l3n s LEU 117 N 1.42 4.28 -0.08 4.42 2.01 0.51 -3.66 118.68 127.59 1l3n s LEU 117 Ca 0.05 2.00 0.00 0.00 0.01 0.00 0.00 54.13 56.19 1l3n s LEU 117 Cb -0.15 -4.03 0.02 0.00 0.01 0.00 0.00 46.19 42.05 1l3n s LEU 117 CO 0.03 -0.27 -0.06 -0.69 1.01 0.00 0.00 176.35 176.37 1l3n s VAL 118 N -1.56 0.78 -0.11 -1.59 1.01 0.15 -1.57 120.40 117.51 1l3n s VAL 118 Ca 0.53 -0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.28 1l3n s VAL 118 Cb -0.22 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 1l3n s VAL 118 CO 0.28 0.31 0.05 -0.69 0.00 0.00 0.00 175.10 175.05 1l3n s VAL 119 N 1.42 4.72 0.20 2.92 1.01 0.18 -1.08 120.40 129.76 1l3n s VAL 119 Ca -0.02 -0.09 0.09 0.00 0.00 0.00 0.00 61.98 61.96 1l3n s VAL 119 Cb -0.13 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 1l3n s VAL 119 CO -0.04 0.58 -0.17 -1.00 0.00 0.00 0.00 175.10 174.47 1l3n s HIS 120 N -0.66 1.85 0.17 5.22 3.76 -0.35 -2.78 115.29 122.51 1l3n s HIS 120 Ca 0.11 -0.49 -0.24 0.00 -0.15 0.00 0.00 55.06 54.29 1l3n s HIS 120 Cb -0.12 -0.88 0.05 0.00 1.11 0.00 0.00 32.58 32.75 1l3n s HIS 120 CO 0.02 0.39 1.57 1.49 -0.85 0.00 0.00 174.74 177.37 1l3n h GLU 121 N 2.86 -0.22 -5.27 1.40 4.81 -0.85 -3.16 114.58 114.15 1l3n h GLU 121 Ca -0.40 0.01 -0.61 0.00 -0.13 0.00 0.00 59.36 58.23 1l3n h GLU 121 Cb 1.22 0.05 -0.13 0.00 0.63 0.00 0.00 28.75 30.52 1l3n h GLU 121 CO 0.56 -0.15 -0.55 0.15 -0.73 0.00 0.00 179.01 178.30 1l3n s LYS 122 N -5.88 2.00 0.21 1.92 1.02 0.75 -4.80 119.74 114.95 1l3n s LYS 122 Ca -0.14 -2.21 -0.21 0.00 0.02 0.00 0.00 55.97 53.43 1l3n s LYS 122 Cb 0.14 -1.24 -0.08 0.00 -0.52 0.00 0.00 37.83 36.13 1l3n s LYS 122 CO 0.67 -0.29 0.74 0.00 -0.92 0.00 0.00 175.35 175.54 1l3n s ALA 123 N -2.98 3.42 0.54 5.17 0.00 -1.23 0.14 121.76 126.81 1l3n s ALA 123 Ca 0.21 0.21 -0.18 0.00 0.00 0.00 0.00 51.96 52.20 1l3n s ALA 123 Cb 0.05 -2.85 -0.06 0.00 0.00 0.00 0.00 23.12 20.25 1l3n s ALA 123 CO 0.11 0.32 1.06 -0.51 0.00 0.00 0.00 175.76 176.74 1l3n s ASP 124 N -1.52 6.01 -0.01 0.00 1.11 -1.26 -4.03 116.67 116.98 1l3n s ASP 124 Ca 0.41 1.94 0.03 0.00 0.18 0.00 0.00 52.55 55.11 1l3n s ASP 124 Cb -0.18 -2.55 0.12 0.00 1.07 0.00 0.00 42.92 41.37 1l3n s ASP 124 CO 0.22 -1.01 0.96 0.47 1.18 0.00 0.00 175.17 176.99 1l3n n ASP 125 N -1.41 1.05 -4.14 0.27 8.00 -1.26 -4.83 116.55 114.22 1l3n n ASP 125 Ca 0.10 -2.05 -0.31 0.00 0.71 0.00 0.00 54.79 53.23 1l3n n ASP 125 Cb 0.52 -0.24 -0.04 0.00 -0.02 0.00 0.00 41.12 41.34 1l3n n ASP 125 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1l3n n LEU 126 N -0.06 -1.73 0.00 0.64 4.77 -1.26 -0.85 117.00 118.51 1l3n n LEU 126 Ca 0.04 -1.08 0.00 0.00 -0.03 0.00 0.00 56.01 54.94 1l3n n LEU 126 Cb 0.21 -2.01 0.00 0.00 -2.33 0.00 0.00 43.42 39.29 1l3n n LEU 126 CO 0.04 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1l3n n GLY 127 N -1.89 2.81 2.34 -0.72 0.00 -1.21 -4.34 105.19 102.18 1l3n n GLY 127 Ca -0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.99 3.22 0.10 1.61 5.02 -0.03 -4.50 118.16 122.59 1l3n n LYS 128 Ca 0.00 -3.95 0.12 0.00 -2.02 0.00 0.00 58.31 52.47 1l3n n LYS 128 Cb 0.00 -2.27 0.20 0.00 -0.02 0.00 0.00 35.03 32.93 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 2.36 0.00 -5.43 0.72 0.00 -1.80 -3.47 103.07 95.45 1l3n h GLY 129 Ca 0.44 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.45 1l3n h GLY 129 CO 1.08 0.00 -0.70 0.61 0.00 0.00 0.00 176.54 177.53 1l3n n GLY 130 N 1.27 -0.34 3.81 4.60 0.00 -1.26 -4.82 105.19 108.45 1l3n n GLY 130 Ca 0.03 0.09 -0.04 0.00 0.00 0.00 0.00 46.02 46.10 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 -4.07 -0.10 0.23 1.61 2.20 -1.26 -5.00 114.94 108.55 1l3n s ASN 131 Ca 0.12 -0.60 -0.07 0.00 -0.94 0.00 0.00 52.86 51.37 1l3n s ASN 131 Cb -0.05 0.56 0.31 0.00 -2.00 0.00 0.00 41.25 40.06 1l3n s ASN 131 CO 0.68 -1.07 1.83 -0.08 -2.94 0.00 0.00 177.10 175.53 1l3n h GLU 132 N 2.00 0.84 0.00 3.55 4.81 -1.95 -0.74 114.58 123.09 1l3n h GLU 132 Ca -0.26 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 1l3n h GLU 132 Cb 1.23 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1l3n h GLU 132 CO 0.30 0.55 0.00 1.49 -0.73 0.00 0.00 179.01 180.63 1l3n h GLU 133 N 0.86 0.00 -0.92 1.92 4.57 -1.97 -2.24 114.58 116.80 1l3n h GLU 133 Ca 0.35 0.00 0.27 0.00 -1.18 0.00 0.00 59.36 58.80 1l3n h GLU 133 Cb 0.19 0.00 -0.15 0.00 -0.16 0.00 0.00 28.75 28.63 1l3n h GLU 133 CO -0.18 0.00 0.30 1.03 -1.18 0.00 0.00 179.01 178.98 1l3n h SER 134 N 0.00 0.08 -0.32 1.04 0.87 -0.39 0.32 113.55 115.15 1l3n h SER 134 Ca 0.00 0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.77 1l3n h SER 134 Cb 0.47 0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.69 1l3n h SER 134 CO 0.00 -0.19 0.00 1.07 -0.53 0.00 0.00 176.83 177.18 1l3n n THR 135 N -5.22 0.41 0.00 2.23 5.66 -0.84 -3.24 114.28 113.28 1l3n n THR 135 Ca 0.25 -0.55 0.00 0.00 -3.05 0.00 0.00 64.05 60.70 1l3n n THR 135 Cb 0.79 0.56 0.00 0.00 -1.55 0.00 0.00 70.33 70.13 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 0.85 0.00 -0.12 1.09 5.02 0.40 -1.76 118.16 123.64 1l3n n LYS 136 Ca 0.17 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.51 1l3n n LYS 136 Cb 0.44 -0.03 0.11 0.00 -0.02 0.00 0.00 35.03 35.53 1l3n n LYS 136 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1l3n n THR 137 N -1.96 0.78 0.00 -0.18 -2.24 -0.03 -4.47 114.28 106.19 1l3n n THR 137 Ca 0.00 -0.89 0.00 0.00 -2.27 0.00 0.00 64.05 60.89 1l3n n THR 137 Cb 0.00 0.65 0.00 0.00 -2.10 0.00 0.00 70.33 68.88 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 0.42 2.03 1.98 3.38 0.00 0.83 -2.94 105.19 110.91 1l3n n GLY 138 Ca 0.09 0.03 -0.01 0.00 0.00 0.00 0.00 46.02 46.14 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 5.69 -0.67 0.01 1.61 2.85 -1.26 -1.88 115.26 121.61 1l3n n ASN 139 Ca 0.00 -1.53 0.04 0.00 -0.11 0.00 0.00 54.58 52.98 1l3n n ASN 139 Cb 0.00 0.31 0.19 0.00 1.24 0.00 0.00 39.78 41.53 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 -0.69 1.36 -0.37 5.20 0.00 -1.15 -4.52 120.51 120.35 1l3n n ALA 140 Ca -0.09 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1l3n n ALA 140 Cb 0.67 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.97 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 -0.69 -1.46 3.77 0.00 0.00 -1.26 -0.17 105.19 105.37 1l3n n GLY 141 Ca 0.02 -1.24 -0.41 0.00 0.00 0.00 0.00 46.02 44.38 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 -0.59 3.80 -3.56 1.61 7.64 -1.26 -4.46 113.62 116.80 1l3n n SER 142 Ca 0.00 1.21 -0.42 0.00 1.01 0.00 0.00 58.87 60.67 1l3n n SER 142 Cb 0.00 -1.61 -0.07 0.00 -1.01 0.00 0.00 64.21 61.52 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 0.79 1.19 0.00 1.43 1.74 -1.26 -0.65 116.66 119.91 1l3n n ARG 143 Ca 0.03 -1.62 0.05 0.00 -0.77 0.00 0.00 57.85 55.53 1l3n n ARG 143 Cb 0.38 -2.79 0.21 0.00 -1.02 0.00 0.00 32.46 29.25 1l3n n ARG 143 CO 0.00 0.00 0.00 1.47 -1.52 0.00 0.00 177.63 177.58 1l3n n LEU 144 N 7.58 0.00 -3.63 0.55 -0.00 -1.19 -4.58 117.00 115.73 1l3n n LEU 144 Ca 0.48 0.46 -0.15 0.00 -0.00 0.00 0.00 56.01 56.80 1l3n n LEU 144 Cb 0.39 -0.46 -0.07 0.00 -0.00 0.00 0.00 43.42 43.27 1l3n n LEU 144 CO 1.05 -0.31 0.32 0.00 -0.00 0.00 0.00 177.39 178.45 1l3n s ALA 145 N -2.92 -1.54 0.16 1.47 0.00 -1.12 -0.98 121.76 116.84 1l3n s ALA 145 Ca 0.06 1.53 -0.05 0.00 0.00 0.00 0.00 51.96 53.49 1l3n s ALA 145 Cb 0.06 -0.67 -0.02 0.00 0.00 0.00 0.00 23.12 22.49 1l3n s ALA 145 CO 0.17 -0.31 0.20 0.00 0.00 0.00 0.00 175.76 175.82 1l3n s GLY 147 N -3.03 -0.55 -0.11 0.00 0.00 -0.61 -1.00 107.32 102.03 1l3n s GLY 147 Ca 0.23 1.33 -0.06 0.00 0.00 0.00 0.00 44.72 46.22 1l3n s GLY 147 CO 0.03 0.89 0.10 0.14 0.00 0.00 0.00 173.10 174.27 1l3n s VAL 148 N -1.41 5.20 -0.03 1.40 1.01 -1.26 -0.36 120.40 124.95 1l3n s VAL 148 Ca -0.09 0.09 -0.30 0.00 0.00 0.00 0.00 61.98 61.68 1l3n s VAL 148 Cb -0.00 -3.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 1l3n s VAL 148 CO 0.07 0.61 1.12 -0.63 0.00 0.00 0.00 175.10 176.27 1l3n s ILE 149 N -0.95 4.42 -0.01 2.22 1.01 -0.25 -4.49 121.20 123.14 1l3n s ILE 149 Ca 0.14 1.73 0.06 0.00 0.00 0.00 0.00 60.65 62.58 1l3n s ILE 149 Cb -0.12 -4.11 -0.02 0.00 0.01 0.00 0.00 42.46 38.23 1l3n s ILE 149 CO 0.03 0.06 -0.19 -0.83 0.00 0.00 0.00 174.94 174.01 1l3n s GLY 150 N 1.22 0.96 0.34 6.18 0.00 -0.97 -3.34 107.32 111.71 1l3n s GLY 150 Ca 0.54 -0.85 -0.28 0.00 0.00 0.00 0.00 44.72 44.13 1l3n s GLY 150 CO 0.24 -0.73 1.26 -0.42 0.00 0.00 0.00 173.10 173.45 1l3n s ILE 151 N -0.50 2.87 0.00 0.90 1.01 -1.26 -1.05 121.20 123.17 1l3n s ILE 151 Ca 0.07 0.84 0.00 0.00 0.00 0.00 0.00 60.65 61.57 1l3n s ILE 151 Cb -0.08 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 38.87 1l3n s ILE 151 CO -0.00 0.17 0.00 0.00 0.00 0.00 0.00 174.94 175.11 1l3n n ALA 152 N 0.65 2.63 -0.64 9.38 0.00 0.28 -4.85 120.51 127.97 1l3n n ALA 152 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1l3n n ALA 152 Cb 0.43 0.32 0.00 0.00 0.00 0.00 0.00 19.45 20.20 1l3n n ALA 152 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44