#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 1.52 -3.98 0.00 5.66 -1.26 -4.78 114.28 111.44 1l3n n THR 2 Ca 0.00 -0.75 -0.16 0.00 -3.05 0.00 0.00 64.05 60.09 1l3n n THR 2 Cb 0.00 -0.99 -0.16 0.00 -1.55 0.00 0.00 70.33 67.63 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 -2.53 0.31 0.20 1.09 2.36 -1.26 -0.42 119.74 119.49 1l3n s LYS 3 Ca -0.17 0.00 0.05 0.00 -2.55 0.00 0.00 55.97 53.30 1l3n s LYS 3 Cb 0.07 -0.42 -0.05 0.00 -1.05 0.00 0.00 37.83 36.38 1l3n s LYS 3 CO 0.76 -0.06 -0.07 0.00 1.55 0.00 0.00 175.35 177.53 1l3n s ALA 4 N 0.64 1.76 0.17 3.13 0.00 -0.18 -1.24 121.76 126.04 1l3n s ALA 4 Ca -0.06 -1.65 0.09 0.00 0.00 0.00 0.00 51.96 50.33 1l3n s ALA 4 Cb -0.10 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.16 1l3n s ALA 4 CO -0.01 -0.11 -0.19 0.08 0.00 0.00 0.00 175.76 175.52 1l3n s VAL 5 N -3.26 1.89 -0.17 0.00 1.01 0.30 -0.72 120.40 119.46 1l3n s VAL 5 Ca 0.23 -1.92 -0.04 0.00 0.00 0.00 0.00 61.98 60.25 1l3n s VAL 5 Cb 0.03 -1.87 0.08 0.00 0.00 0.00 0.00 36.38 34.61 1l3n s VAL 5 CO 0.05 -0.28 0.18 0.00 0.00 0.00 0.00 175.10 175.05 1l3n s ALA 6 N -1.96 -0.07 -0.36 5.51 0.00 0.01 -0.57 121.76 124.33 1l3n s ALA 6 Ca 0.16 0.16 -0.13 0.00 0.00 0.00 0.00 51.96 52.16 1l3n s ALA 6 Cb -0.06 -1.15 -0.00 0.00 0.00 0.00 0.00 23.12 21.91 1l3n s ALA 6 CO 0.07 -1.08 0.24 0.14 0.00 0.00 0.00 175.76 175.13 1l3n s VAL 7 N 2.27 5.08 0.05 0.00 -7.23 -1.26 -0.89 120.40 118.42 1l3n s VAL 7 Ca 0.05 -0.44 -0.19 0.00 -1.81 0.00 0.00 61.98 59.60 1l3n s VAL 7 Cb -0.15 -3.69 -0.06 0.00 0.56 0.00 0.00 36.38 33.04 1l3n s VAL 7 CO -0.10 -0.10 0.54 -0.76 -0.31 0.00 0.00 175.10 174.37 1l3n s LEU 8 N 1.67 4.50 0.11 1.32 1.02 0.30 -4.02 118.68 123.59 1l3n s LEU 8 Ca 0.05 1.19 -0.14 0.00 0.02 0.00 0.00 54.13 55.25 1l3n s LEU 8 Cb -0.18 -2.84 0.03 0.00 0.02 0.00 0.00 46.19 43.22 1l3n s LEU 8 CO 0.09 0.26 0.34 -0.54 0.02 0.00 0.00 176.35 176.53 1l3n s LYS 9 N -0.97 1.01 0.07 1.70 1.02 -0.20 -0.13 119.74 122.24 1l3n s LYS 9 Ca 0.28 -0.77 0.00 0.00 0.02 0.00 0.00 55.97 55.50 1l3n s LYS 9 Cb -0.19 0.43 0.00 0.00 -0.52 0.00 0.00 37.83 37.56 1l3n s LYS 9 CO 0.18 -0.38 0.00 0.41 -0.92 0.00 0.00 175.35 174.64 1l3n n GLY 10 N -0.17 -1.07 0.16 -3.33 0.00 -1.24 -0.98 105.19 98.56 1l3n n GLY 10 Ca -0.16 0.38 -0.14 0.00 0.00 0.00 0.00 46.02 46.10 1l3n n GLY 10 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1l3n h ASP 11 N 0.00 0.54 0.00 1.61 3.58 -0.98 -3.48 116.42 117.69 1l3n h ASP 11 Ca 0.00 -0.55 0.00 0.00 0.42 0.00 0.00 57.03 56.90 1l3n h ASP 11 Cb 0.00 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 40.89 1l3n h ASP 11 CO 0.00 1.00 0.00 0.61 -2.88 0.00 0.00 179.24 177.97 1l3n n GLY 12 N 0.42 1.91 0.32 -0.78 0.00 -1.26 -4.88 105.19 100.92 1l3n n GLY 12 Ca -0.06 -0.34 0.09 0.00 0.00 0.00 0.00 46.02 45.70 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 0.38 -5.67 1.61 0.13 -1.92 -3.36 132.00 123.17 1l3n h PRO 13 Ca 0.00 -0.02 -0.30 0.00 -0.87 0.00 0.00 66.00 64.81 1l3n h PRO 13 Cb 0.00 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 31.02 1l3n h PRO 13 CO 0.00 0.25 0.87 0.08 -0.23 0.00 0.00 178.00 178.97 1l3n s VAL 14 N -5.37 3.23 -0.16 1.56 1.01 -1.25 -3.95 120.40 115.47 1l3n s VAL 14 Ca -0.07 -0.07 -0.01 0.00 0.00 0.00 0.00 61.98 61.82 1l3n s VAL 14 Cb 0.18 -3.56 -0.01 0.00 0.00 0.00 0.00 36.38 32.99 1l3n s VAL 14 CO 0.73 -0.53 -0.12 0.00 0.00 0.00 0.00 175.10 175.18 1l3n s GLN 15 N 7.72 3.35 0.06 2.72 -2.07 0.23 -3.96 119.66 127.71 1l3n s GLN 15 Ca 0.80 -0.68 0.09 0.00 -1.82 0.00 0.00 55.36 53.75 1l3n s GLN 15 Cb -0.12 -2.72 -0.03 0.00 -1.09 0.00 0.00 33.01 29.06 1l3n s GLN 15 CO 0.11 0.07 -0.25 0.20 -1.32 0.00 0.00 175.29 174.11 1l3n s GLY 16 N 0.71 1.36 -0.41 2.60 0.00 0.81 -0.81 107.32 111.57 1l3n s GLY 16 Ca -0.05 -1.24 0.04 0.00 0.00 0.00 0.00 44.72 43.46 1l3n s GLY 16 CO 0.02 -1.15 0.41 -0.42 0.00 0.00 0.00 173.10 171.96 1l3n s ILE 17 N -0.84 -0.15 0.01 0.90 1.01 0.34 -0.53 121.20 121.94 1l3n s ILE 17 Ca 0.11 -1.71 -0.10 0.00 0.00 0.00 0.00 60.65 58.94 1l3n s ILE 17 Cb -0.10 -0.81 -0.05 0.00 0.01 0.00 0.00 42.46 41.51 1l3n s ILE 17 CO 0.02 -0.77 0.34 -0.63 0.00 0.00 0.00 174.94 173.90 1l3n s ILE 18 N 0.74 5.18 -0.10 2.92 -1.09 -0.07 -1.73 121.20 127.06 1l3n s ILE 18 Ca 0.26 0.47 0.02 0.00 -2.23 0.00 0.00 60.65 59.18 1l3n s ILE 18 Cb -0.06 -3.61 0.01 0.00 -1.58 0.00 0.00 42.46 37.22 1l3n s ILE 18 CO -0.09 0.44 -0.17 0.20 -1.23 0.00 0.00 174.94 174.08 1l3n s ASN 19 N -1.44 2.50 -0.33 3.58 0.02 0.58 -0.81 114.94 119.04 1l3n s ASN 19 Ca 0.26 -0.45 -0.09 0.00 -1.02 0.00 0.00 52.86 51.57 1l3n s ASN 19 Cb -0.14 -1.14 0.02 0.00 0.02 0.00 0.00 41.25 40.00 1l3n s ASN 19 CO 0.14 0.06 0.14 -0.36 0.02 0.00 0.00 177.10 177.10 1l3n s PHE 20 N 0.73 3.20 -0.19 2.20 0.40 0.11 -2.00 117.98 122.43 1l3n s PHE 20 Ca -0.12 -0.94 -0.07 0.00 -0.60 0.00 0.00 56.93 55.20 1l3n s PHE 20 Cb -0.16 -2.34 -0.04 0.00 0.51 0.00 0.00 43.02 41.00 1l3n s PHE 20 CO 0.02 -0.59 0.05 -1.21 0.70 0.00 0.00 175.22 174.19 1l3n s GLU 21 N 1.53 3.84 -0.63 0.44 2.02 -1.24 -1.01 118.70 123.65 1l3n s GLU 21 Ca 0.02 -0.41 -0.00 0.00 0.02 0.00 0.00 54.97 54.60 1l3n s GLU 21 Cb -0.18 -3.19 0.16 0.00 0.10 0.00 0.00 34.13 31.02 1l3n s GLU 21 CO 0.05 0.15 0.42 -1.14 0.02 0.00 0.00 175.26 174.76 1l3n s GLN 22 N 0.69 2.46 0.19 1.61 0.74 0.44 -3.77 119.66 122.01 1l3n s GLN 22 Ca 0.02 -2.69 -0.12 0.00 0.05 0.00 0.00 55.36 52.62 1l3n s GLN 22 Cb -0.13 -3.62 0.11 0.00 1.10 0.00 0.00 33.01 30.47 1l3n s GLN 22 CO 0.02 -1.17 1.85 1.57 -0.55 0.00 0.00 175.29 177.01 1l3n h LYS 23 N 6.67 0.78 -4.93 1.67 2.10 -1.86 -3.41 116.57 117.59 1l3n h LYS 23 Ca -0.01 -0.05 -0.30 0.00 -2.00 0.00 0.00 60.65 58.29 1l3n h LYS 23 Cb 0.91 -0.18 -0.15 0.00 -0.90 0.00 0.00 32.23 31.92 1l3n h LYS 23 CO 0.72 0.52 -0.69 -1.21 -2.00 0.00 0.00 179.45 176.78 1l3n s GLU 24 N -6.14 1.06 0.54 0.07 2.02 -1.26 -4.99 118.70 109.99 1l3n s GLU 24 Ca -0.13 -1.47 0.35 0.00 0.02 0.00 0.00 54.97 53.74 1l3n s GLU 24 Cb 0.14 -0.46 1.65 0.00 0.10 0.00 0.00 34.13 35.56 1l3n s GLU 24 CO 0.76 -0.01 2.05 0.66 0.02 0.00 0.00 175.26 178.74 1l3n h SER 25 N 2.76 0.00 1.76 -0.19 4.64 -1.98 -0.37 113.55 120.18 1l3n h SER 25 Ca -0.36 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.92 1l3n h SER 25 Cb 1.19 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1l3n h SER 25 CO 0.64 0.00 -0.15 0.78 -0.87 0.00 0.00 176.83 177.23 1l3n h ASN 26 N 0.00 0.00 -3.31 4.97 4.21 -1.96 -3.45 115.58 116.04 1l3n h ASN 26 Ca 0.00 0.00 -0.55 0.00 1.21 0.00 0.00 56.30 56.96 1l3n h ASN 26 Cb 0.29 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.47 1l3n h ASN 26 CO 0.00 0.15 0.49 -0.83 -1.29 0.00 0.00 177.43 175.95 1l3n s GLY 27 N -4.28 2.57 0.19 2.83 0.00 -0.15 -5.01 107.32 103.47 1l3n s GLY 27 Ca 0.06 0.48 -0.31 0.00 0.00 0.00 0.00 44.72 44.94 1l3n s GLY 27 CO 0.68 1.85 1.53 2.56 0.00 0.00 0.00 173.10 179.72 1l3n s PRO 28 N 1.57 4.23 -0.67 2.90 0.04 -1.26 -4.77 135.00 137.04 1l3n s PRO 28 Ca 0.51 2.34 -0.27 0.00 0.04 0.00 0.00 61.00 63.62 1l3n s PRO 28 Cb -0.20 -3.14 0.02 0.00 0.04 0.00 0.00 34.50 31.22 1l3n s PRO 28 CO 0.23 -0.56 1.34 0.08 0.04 0.00 0.00 177.00 178.13 1l3n s VAL 29 N 0.82 3.75 -0.43 -0.36 1.01 -1.09 -4.76 120.40 119.35 1l3n s VAL 29 Ca 0.67 0.52 -0.28 0.00 0.00 0.00 0.00 61.98 62.90 1l3n s VAL 29 Cb -0.43 -4.72 -0.01 0.00 0.00 0.00 0.00 36.38 31.22 1l3n s VAL 29 CO 0.35 -1.57 1.75 -0.75 0.00 0.00 0.00 175.10 174.88 1l3n s LYS 30 N 5.68 3.16 -0.43 2.72 2.20 -1.25 -3.79 119.74 128.03 1l3n s LYS 30 Ca 0.42 1.09 -0.27 0.00 -0.36 0.00 0.00 55.97 56.86 1l3n s LYS 30 Cb -0.09 -4.23 0.02 0.00 -1.51 0.00 0.00 37.83 32.03 1l3n s LYS 30 CO 0.19 -2.08 1.00 0.14 -0.36 0.00 0.00 175.35 174.24 1l3n s VAL 31 N 7.33 4.42 0.36 4.02 -7.23 0.12 -3.66 120.40 125.75 1l3n s VAL 31 Ca 0.73 1.10 0.07 0.00 -1.81 0.00 0.00 61.98 62.06 1l3n s VAL 31 Cb -0.18 -4.46 -0.07 0.00 0.56 0.00 0.00 36.38 32.23 1l3n s VAL 31 CO 0.29 -0.78 -0.02 -1.66 -0.31 0.00 0.00 175.10 172.63 1l3n s TRP 32 N 3.89 2.30 -5.00 2.82 -2.14 -0.85 -0.93 118.94 119.04 1l3n s TRP 32 Ca 0.41 -0.69 0.00 0.00 2.66 0.00 0.00 56.10 58.49 1l3n s TRP 32 Cb -0.10 -1.49 0.00 0.00 -3.10 0.00 0.00 33.47 28.78 1l3n s TRP 32 CO 0.25 0.37 0.00 0.41 -2.66 0.00 0.00 176.95 175.32 1l3n n GLY 33 N -0.82 0.26 3.38 3.67 0.00 0.36 -0.31 105.19 111.74 1l3n n GLY 33 Ca -0.05 -1.33 -0.13 0.00 0.00 0.00 0.00 46.02 44.51 1l3n n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1l3n s SER 34 N -4.00 -0.42 -0.12 1.61 1.04 -0.70 -0.60 113.70 110.51 1l3n s SER 34 Ca 0.00 0.11 0.02 0.00 0.48 0.00 0.00 55.95 56.56 1l3n s SER 34 Cb 0.00 0.49 -0.00 0.00 0.10 0.00 0.00 66.02 66.61 1l3n s SER 34 CO 0.00 -0.74 -0.19 0.27 0.98 0.00 0.00 173.24 173.55 1l3n s ILE 35 N -2.65 2.43 0.07 -1.02 -0.00 -0.26 -0.50 121.20 119.27 1l3n s ILE 35 Ca -0.04 -0.88 0.05 0.00 -0.00 0.00 0.00 60.65 59.78 1l3n s ILE 35 Cb -0.00 -1.98 -0.04 0.00 -0.00 0.00 0.00 42.46 40.44 1l3n s ILE 35 CO -0.03 0.54 -0.04 -0.75 -0.00 0.00 0.00 174.94 174.66 1l3n s LYS 36 N 0.43 2.47 0.00 0.37 2.20 0.00 -0.31 119.74 124.90 1l3n s LYS 36 Ca -0.14 -0.84 0.00 0.00 -0.36 0.00 0.00 55.97 54.63 1l3n s LYS 36 Cb -0.17 -2.49 0.00 0.00 -1.51 0.00 0.00 37.83 33.66 1l3n s LYS 36 CO 0.06 0.55 0.00 0.41 -0.36 0.00 0.00 175.35 176.01 1l3n n GLY 37 N 0.87 0.95 3.69 5.54 0.00 -1.12 -0.60 105.19 114.53 1l3n n GLY 37 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 1l3n n GLY 37 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l3n s LEU 38 N 0.00 1.25 0.34 0.99 1.43 -1.15 -4.30 118.68 117.24 1l3n s LEU 38 Ca 0.00 0.42 0.07 0.00 -1.03 0.00 0.00 54.13 53.60 1l3n s LEU 38 Cb 0.00 -2.18 -0.02 0.00 0.03 0.00 0.00 46.19 44.02 1l3n s LEU 38 CO 0.00 -3.84 0.34 0.28 0.23 0.00 0.00 176.35 173.36 1l3n s THR 39 N -3.31 3.61 0.81 5.49 -1.32 -1.26 -3.38 115.64 116.29 1l3n s THR 39 Ca 0.73 -1.29 -0.14 0.00 -1.21 0.00 0.00 61.69 59.78 1l3n s THR 39 Cb -0.06 -3.23 0.03 0.00 -1.51 0.00 0.00 72.50 67.74 1l3n s THR 39 CO 0.55 -0.16 0.80 1.21 -2.21 0.00 0.00 174.62 174.81 1l3n n GLU 40 N -1.44 0.11 0.00 7.08 2.13 -1.25 -4.58 120.64 122.69 1l3n n GLU 40 Ca -0.01 0.10 0.00 0.00 0.66 0.00 0.00 57.16 57.90 1l3n n GLU 40 Cb 0.59 -2.11 0.00 0.00 0.27 0.00 0.00 31.44 30.20 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 1.12 -1.13 3.44 8.31 0.00 0.22 -4.75 105.19 112.40 1l3n n GLY 41 Ca 0.11 -1.61 -0.50 0.00 0.00 0.00 0.00 46.02 44.02 1l3n n GLY 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1l3n n LEU 42 N -1.19 -0.74 -3.98 0.99 4.77 -1.26 -1.24 117.00 114.36 1l3n n LEU 42 Ca 0.00 1.14 -0.09 0.00 -0.03 0.00 0.00 56.01 57.03 1l3n n LEU 42 Cb 0.00 -0.97 -0.11 0.00 -2.33 0.00 0.00 43.42 40.01 1l3n n LEU 42 CO 0.00 -2.63 -0.35 -1.00 -1.33 0.00 0.00 177.39 172.08 1l3n s HIS 43 N -0.78 0.27 -0.26 -1.77 3.76 0.95 -3.72 115.29 113.73 1l3n s HIS 43 Ca 0.69 -0.55 -0.36 0.00 -0.15 0.00 0.00 55.06 54.70 1l3n s HIS 43 Cb -0.98 -0.20 -0.16 0.00 1.11 0.00 0.00 32.58 32.35 1l3n s HIS 43 CO 0.56 -0.21 1.13 0.41 -0.85 0.00 0.00 174.74 175.79 1l3n n GLY 44 N 1.49 0.02 2.87 -2.22 0.00 0.89 -0.97 105.19 107.28 1l3n n GLY 44 Ca -0.23 0.74 -0.11 0.00 0.00 0.00 0.00 46.02 46.41 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 1.57 -0.71 0.33 1.61 5.36 -1.26 -1.16 117.98 123.72 1l3n s PHE 45 Ca 0.80 0.58 -0.11 0.00 -0.96 0.00 0.00 56.93 57.23 1l3n s PHE 45 Cb -1.13 -0.11 0.02 0.00 -0.34 0.00 0.00 43.02 41.46 1l3n s PHE 45 CO 0.59 -0.74 0.61 -1.01 -1.46 0.00 0.00 175.22 173.20 1l3n s HIS 46 N 2.49 0.44 0.31 10.12 3.76 -1.04 -2.75 115.29 128.62 1l3n s HIS 46 Ca 0.11 -0.87 -0.03 0.00 -0.15 0.00 0.00 55.06 54.12 1l3n s HIS 46 Cb -0.15 0.37 -0.04 0.00 1.11 0.00 0.00 32.58 33.87 1l3n s HIS 46 CO -0.18 -1.25 0.55 0.54 -0.85 0.00 0.00 174.74 173.55 1l3n s VAL 47 N -3.16 5.06 -0.04 -0.90 0.11 -0.14 -1.01 120.40 120.32 1l3n s VAL 47 Ca 0.21 -0.13 0.02 0.00 -2.93 0.00 0.00 61.98 59.15 1l3n s VAL 47 Cb -0.03 -3.78 0.02 0.00 -1.53 0.00 0.00 36.38 31.06 1l3n s VAL 47 CO 0.13 -0.42 -0.07 -1.00 -3.33 0.00 0.00 175.10 170.42 1l3n s HIS 48 N -2.18 0.91 0.09 1.54 3.76 0.13 -4.56 115.29 114.99 1l3n s HIS 48 Ca 0.42 -0.27 -0.27 0.00 -0.15 0.00 0.00 55.06 54.80 1l3n s HIS 48 Cb -0.10 -0.74 -0.13 0.00 1.11 0.00 0.00 32.58 32.72 1l3n s HIS 48 CO 0.33 -0.19 1.68 1.49 -0.85 0.00 0.00 174.74 177.19 1l3n h GLU 49 N 7.00 -0.37 -6.64 1.40 4.57 -1.71 -2.51 114.58 116.31 1l3n h GLU 49 Ca -0.36 0.03 -0.51 0.00 -1.18 0.00 0.00 59.36 57.33 1l3n h GLU 49 Cb 1.16 0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 29.83 1l3n h GLU 49 CO 0.48 -0.25 0.44 -0.06 -1.18 0.00 0.00 179.01 178.44 1l3n s PHE 50 N -6.12 3.68 0.30 0.92 0.08 0.48 -4.47 117.98 112.86 1l3n s PHE 50 Ca -0.15 1.68 0.08 0.00 0.12 0.00 0.00 56.93 58.66 1l3n s PHE 50 Cb 0.06 -3.19 0.49 0.00 -0.57 0.00 0.00 43.02 39.81 1l3n s PHE 50 CO 0.65 -0.30 1.71 0.78 -0.10 0.00 0.00 175.22 177.96 1l3n h GLY 51 N 5.12 0.19 -5.16 4.36 0.00 -1.76 -3.34 103.07 102.49 1l3n h GLY 51 Ca -0.44 -0.18 -0.67 0.00 0.00 0.00 0.00 47.33 46.04 1l3n h GLY 51 CO 0.72 0.17 0.21 1.34 0.00 0.00 0.00 176.54 178.97 1l3n n ASP 52 N -4.01 0.31 0.00 0.19 -0.08 -1.26 -4.68 116.55 107.01 1l3n n ASP 52 Ca -0.02 0.96 0.00 0.00 -1.51 0.00 0.00 54.79 54.22 1l3n n ASP 52 Cb 0.48 -0.74 0.00 0.00 2.34 0.00 0.00 41.12 43.20 1l3n n ASP 52 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1l3n n ASN 53 N 1.87 0.95 -0.21 1.67 5.03 -1.26 -0.73 115.26 122.58 1l3n n ASN 53 Ca 0.19 -1.47 0.13 0.00 0.87 0.00 0.00 54.58 54.30 1l3n n ASN 53 Cb 0.03 0.00 0.43 0.00 -1.02 0.00 0.00 39.78 39.22 1l3n n ASN 53 CO 0.00 0.00 0.00 0.74 -1.83 0.00 0.00 177.26 176.17 1l3n h THR 54 N 1.57 0.84 0.00 3.41 2.02 -1.98 0.32 112.91 119.08 1l3n h THR 54 Ca 0.00 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1l3n h THR 54 Cb 0.76 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 1l3n h THR 54 CO 0.00 0.10 0.00 0.00 0.37 0.00 0.00 175.52 175.99 1l3n h ALA 55 N 1.62 1.00 0.00 6.16 0.00 -1.97 -3.47 119.26 122.60 1l3n h ALA 55 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1l3n h ALA 55 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.51 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 0.89 0.77 3.34 0.00 0.00 0.11 -4.74 105.19 105.56 1l3n n GLY 56 Ca 0.04 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.41 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 -1.98 1.53 -0.35 0.00 -1.04 -1.26 -4.44 114.28 106.73 1l3n n THR 58 Ca 0.00 -0.53 0.05 0.00 -2.04 0.00 0.00 64.05 61.53 1l3n n THR 58 Cb 0.32 -1.55 0.23 0.00 -1.82 0.00 0.00 70.33 67.50 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 -0.20 0.95 -0.61 8.00 0.02 -1.85 -3.21 113.55 116.65 1l3n h SER 59 Ca -0.58 0.03 0.18 0.00 -0.84 0.00 0.00 61.79 60.57 1l3n h SER 59 Cb 1.85 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 64.19 1l3n h SER 59 CO -0.14 0.56 0.72 0.00 -1.14 0.00 0.00 176.83 176.83 1l3n n ALA 60 N -2.37 0.59 -0.08 3.77 0.00 0.09 -4.82 120.51 117.69 1l3n n ALA 60 Ca 0.17 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1l3n n ALA 60 Cb 0.28 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.38 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 -1.33 0.39 3.29 0.00 0.00 -1.21 -0.39 105.19 105.94 1l3n n GLY 61 Ca 0.14 -1.15 -0.38 0.00 0.00 0.00 0.00 46.02 44.62 1l3n n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1l3n n PRO 62 N 2.37 1.37 -3.41 1.61 -0.04 -1.26 -4.06 135.00 131.58 1l3n n PRO 62 Ca 0.00 -1.96 -0.18 0.00 -0.04 0.00 0.00 63.50 61.32 1l3n n PRO 62 Cb 0.00 -3.15 0.08 0.00 -0.04 0.00 0.00 33.50 30.39 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 9.98 -2.28 -0.67 0.54 8.25 -1.26 -4.46 115.22 125.32 1l3n n HIS 63 Ca 0.48 0.91 -0.07 0.00 -0.26 0.00 0.00 57.72 58.78 1l3n n HIS 63 Cb 0.43 -4.89 -0.11 0.00 1.12 0.00 0.00 29.99 26.54 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 -4.25 0.00 -1.93 4.41 3.72 -1.26 -4.88 117.46 113.27 1l3n n PHE 64 Ca -0.18 -1.02 -0.37 0.00 -0.05 0.00 0.00 57.45 55.83 1l3n n PHE 64 Cb 0.63 -1.15 0.04 0.00 -0.94 0.00 0.00 39.48 38.06 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 2.25 5.08 0.09 4.37 4.22 -1.26 -4.70 114.94 124.99 1l3n s ASN 65 Ca 0.41 2.49 -0.36 0.00 -2.14 0.00 0.00 52.86 53.27 1l3n s ASN 65 Cb 0.20 -2.61 -0.17 0.00 1.28 0.00 0.00 41.25 39.95 1l3n s ASN 65 CO 0.00 -1.67 1.56 1.55 -2.04 0.00 0.00 177.10 176.50 1l3n h PRO 66 N 0.91 -0.94 -3.85 3.55 0.13 -1.96 -1.62 132.00 128.22 1l3n h PRO 66 Ca -0.51 0.06 -0.63 0.00 -0.87 0.00 0.00 66.00 64.05 1l3n h PRO 66 Cb 1.31 0.21 0.01 0.00 0.13 0.00 0.00 31.00 32.66 1l3n h PRO 66 CO 0.55 -0.62 2.97 1.47 -0.23 0.00 0.00 178.00 182.13 1l3n n LEU 67 N -5.54 6.17 -4.56 1.56 -0.00 -1.26 -4.90 117.00 108.46 1l3n n LEU 67 Ca -0.11 -3.64 -0.38 0.00 -0.00 0.00 0.00 56.01 51.87 1l3n n LEU 67 Cb 0.46 -1.40 -0.04 0.00 -0.00 0.00 0.00 43.42 42.44 1l3n n LEU 67 CO 0.24 0.81 1.99 -0.24 -0.00 0.00 0.00 177.39 180.20 1l3n n SER 68 N 5.69 2.46 0.00 1.45 2.88 -0.61 -4.74 113.62 120.75 1l3n n SER 68 Ca 0.55 -0.31 0.00 0.00 -1.33 0.00 0.00 58.87 57.78 1l3n n SER 68 Cb 0.32 -1.55 0.00 0.00 -0.75 0.00 0.00 64.21 62.23 1l3n n SER 68 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1l3n n ARG 69 N 8.92 0.00 -3.88 -1.46 1.74 -1.26 -5.09 116.66 115.64 1l3n n ARG 69 Ca 0.37 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 57.33 1l3n n ARG 69 Cb 0.50 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 31.83 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 0.00 0.33 -0.03 5.56 -0.14 -0.15 -5.05 119.74 120.26 1l3n s LYS 70 Ca 0.00 -0.25 -0.33 0.00 -1.36 0.00 0.00 55.97 54.02 1l3n s LYS 70 Cb 0.00 0.14 -0.12 0.00 -1.68 0.00 0.00 37.83 36.17 1l3n s LYS 70 CO 0.00 -0.07 1.86 1.58 -0.76 0.00 0.00 175.35 177.96 1l3n n HIS 71 N 2.00 2.36 -1.21 3.18 -0.00 -0.91 -2.90 115.22 117.74 1l3n n HIS 71 Ca -0.20 -0.03 0.00 0.00 -0.00 0.00 0.00 57.72 57.49 1l3n n HIS 71 Cb 0.57 -2.67 0.00 0.00 -0.00 0.00 0.00 29.99 27.88 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 4.30 3.82 0.00 1.57 0.00 -1.26 -2.91 105.19 110.71 1l3n n GLY 72 Ca 0.21 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 1.53 0.37 -0.02 0.00 -1.26 -4.52 105.19 101.28 1l3n n GLY 73 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 0.50 -0.01 1.61 -0.04 -1.26 -0.63 135.00 135.17 1l3n n PRO 74 Ca 0.00 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.57 1l3n n PRO 74 Cb 0.00 -1.19 -0.17 0.00 -0.04 0.00 0.00 33.50 32.11 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 0.05 0.61 -4.15 0.54 4.76 -1.26 -5.04 118.16 113.67 1l3n n LYS 75 Ca 0.00 -0.18 -0.22 0.00 -2.87 0.00 0.00 58.31 55.03 1l3n n LYS 75 Cb 0.09 -1.51 -0.06 0.00 -1.84 0.00 0.00 35.03 31.70 1l3n n LYS 75 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1l3n n ASP 76 N -2.20 1.07 -0.08 4.39 8.00 0.20 -5.06 116.55 122.87 1l3n n ASP 76 Ca -0.03 -2.96 0.02 0.00 0.71 0.00 0.00 54.79 52.53 1l3n n ASP 76 Cb 0.55 0.97 -0.00 0.00 -0.02 0.00 0.00 41.12 42.62 1l3n n ASP 76 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1l3n n GLU 77 N -0.81 2.92 0.00 -1.24 4.07 -1.26 -4.62 120.64 119.69 1l3n n GLU 77 Ca -0.04 -0.35 0.12 0.00 -0.06 0.00 0.00 57.16 56.83 1l3n n GLU 77 Cb 0.55 -0.87 0.11 0.00 -0.06 0.00 0.00 31.44 31.18 1l3n n GLU 77 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22 1l3n n GLU 78 N -0.48 1.57 -0.66 5.31 0.00 -1.26 -4.96 120.64 120.16 1l3n n GLU 78 Ca 0.02 -1.24 -0.26 0.00 0.00 0.00 0.00 57.16 55.67 1l3n n GLU 78 Cb 0.08 -1.47 -0.04 0.00 0.00 0.00 0.00 31.44 30.01 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 0.37 0.00 -1.51 3.44 1.85 -1.14 -0.98 116.66 118.69 1l3n n ARG 79 Ca 0.12 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.61 1l3n n ARG 79 Cb 0.49 -0.66 0.09 0.00 -1.05 0.00 0.00 32.46 31.33 1l3n n ARG 79 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1l3n n HIS 80 N 0.68 1.61 -1.56 2.89 8.25 -1.15 -4.79 115.22 121.15 1l3n n HIS 80 Ca 0.09 0.41 -0.13 0.00 -0.26 0.00 0.00 57.72 57.83 1l3n n HIS 80 Cb 0.03 -2.20 -0.08 0.00 1.12 0.00 0.00 29.99 28.87 1l3n n HIS 80 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1l3n n VAL 81 N -2.37 0.00 0.00 1.59 0.31 -1.26 -1.21 118.33 115.39 1l3n n VAL 81 Ca 0.15 -0.48 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 1l3n n VAL 81 Cb 0.49 -1.95 0.00 0.00 -0.91 0.00 0.00 33.84 31.47 1l3n n VAL 81 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1l3n n GLY 82 N 6.76 1.95 3.49 2.92 0.00 -1.26 -4.82 105.19 114.22 1l3n n GLY 82 Ca 0.47 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.00 6.20 -0.01 1.61 1.01 -0.35 -0.96 116.67 122.16 1l3n s ASP 83 Ca 0.00 -0.75 0.01 0.00 0.71 0.00 0.00 52.55 52.52 1l3n s ASP 83 Cb 0.00 -2.45 0.06 0.00 1.01 0.00 0.00 42.92 41.54 1l3n s ASP 83 CO 0.00 -1.49 0.76 0.18 0.21 0.00 0.00 175.17 174.82 1l3n n LEU 84 N 8.04 1.02 0.00 1.23 7.99 -1.11 -4.64 117.00 129.53 1l3n n LEU 84 Ca -0.01 -0.51 0.00 0.00 -0.01 0.00 0.00 56.01 55.47 1l3n n LEU 84 Cb 0.47 -0.35 0.00 0.00 -0.11 0.00 0.00 43.42 43.43 1l3n n LEU 84 CO 0.66 0.21 0.00 0.61 -1.51 0.00 0.00 177.39 177.36 1l3n n GLY 85 N 0.24 1.67 3.45 -0.72 0.00 -1.26 -4.66 105.19 103.91 1l3n n GLY 85 Ca 0.02 -0.14 -0.15 0.00 0.00 0.00 0.00 46.02 45.76 1l3n n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l3n s ASN 86 N -4.00 -0.54 -0.05 1.61 2.20 -1.26 -4.10 114.94 108.79 1l3n s ASN 86 Ca 0.00 0.84 0.06 0.00 -0.94 0.00 0.00 52.86 52.82 1l3n s ASN 86 Cb 0.00 0.84 -0.01 0.00 -2.00 0.00 0.00 41.25 40.08 1l3n s ASN 86 CO 0.00 -0.36 -0.24 0.68 -2.94 0.00 0.00 177.10 174.24 1l3n s VAL 87 N -0.41 1.97 0.01 3.54 -7.23 -0.15 -4.80 120.40 113.34 1l3n s VAL 87 Ca -0.06 -1.03 -0.27 0.00 -1.81 0.00 0.00 61.98 58.81 1l3n s VAL 87 Cb -0.03 -1.67 -0.04 0.00 0.56 0.00 0.00 36.38 35.20 1l3n s VAL 87 CO 0.04 0.55 0.86 -0.89 -0.31 0.00 0.00 175.10 175.35 1l3n s THR 88 N -0.20 4.82 -0.08 5.32 2.01 -1.26 -0.04 115.64 126.21 1l3n s THR 88 Ca -0.02 1.81 -0.06 0.00 0.31 0.00 0.00 61.69 63.74 1l3n s THR 88 Cb -0.13 -4.20 -0.04 0.00 0.01 0.00 0.00 72.50 68.14 1l3n s THR 88 CO 0.03 0.26 0.17 0.00 -0.69 0.00 0.00 174.62 174.38 1l3n s ALA 89 N 0.54 3.90 1.12 7.40 0.00 -0.37 -4.13 121.76 130.22 1l3n s ALA 89 Ca 0.44 -0.67 -0.12 0.00 0.00 0.00 0.00 51.96 51.61 1l3n s ALA 89 Cb -0.20 -1.95 0.26 0.00 0.00 0.00 0.00 23.12 21.22 1l3n s ALA 89 CO 0.25 0.66 1.05 0.34 0.00 0.00 0.00 175.76 178.06 1l3n s ASP 90 N -1.36 1.32 0.58 0.00 2.15 0.31 -0.61 116.67 119.06 1l3n s ASP 90 Ca 0.20 1.66 0.28 0.00 0.43 0.00 0.00 52.55 55.11 1l3n s ASP 90 Cb -0.12 -2.36 1.51 0.00 -0.30 0.00 0.00 42.92 41.65 1l3n s ASP 90 CO 0.10 -4.01 1.98 0.07 -0.17 0.00 0.00 175.17 173.13 1l3n h LYS 91 N -2.49 0.00 0.00 4.34 2.10 -1.93 0.18 116.57 118.77 1l3n h LYS 91 Ca -0.58 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 57.90 1l3n h LYS 91 Cb 1.32 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.63 1l3n h LYS 91 CO 0.48 0.00 -0.79 0.22 -2.00 0.00 0.00 179.45 177.36 1l3n h ASP 92 N 0.00 0.00 0.00 7.07 1.82 -1.91 -3.43 116.42 119.98 1l3n h ASP 92 Ca 0.19 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.83 1l3n h ASP 92 Cb 0.95 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.96 1l3n h ASP 92 CO -0.00 0.79 0.00 0.61 -1.61 0.00 0.00 179.24 179.03 1l3n n GLY 93 N 0.76 1.04 3.55 -0.78 0.00 0.62 -4.24 105.19 106.14 1l3n n GLY 93 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.00 3.69 -0.31 1.61 1.01 -1.25 -2.80 120.40 120.35 1l3n s VAL 94 Ca 0.00 0.28 -0.13 0.00 0.00 0.00 0.00 61.98 62.13 1l3n s VAL 94 Cb 0.00 -4.80 -0.03 0.00 0.00 0.00 0.00 36.38 31.55 1l3n s VAL 94 CO 0.00 -1.74 0.27 0.00 0.00 0.00 0.00 175.10 173.63 1l3n s ALA 95 N 6.15 3.52 -0.26 5.51 0.00 0.57 -0.53 121.76 136.73 1l3n s ALA 95 Ca 0.40 -1.18 -0.21 0.00 0.00 0.00 0.00 51.96 50.98 1l3n s ALA 95 Cb -0.08 -2.65 -0.02 0.00 0.00 0.00 0.00 23.12 20.38 1l3n s ALA 95 CO 0.14 -0.81 0.66 0.16 0.00 0.00 0.00 175.76 175.90 1l3n s ASP 96 N 1.73 6.61 -0.13 0.00 -4.77 -1.26 -1.11 116.67 117.73 1l3n s ASP 96 Ca 0.09 0.73 -0.05 0.00 -3.30 0.00 0.00 52.55 50.02 1l3n s ASP 96 Cb -0.17 -2.35 -0.04 0.00 -1.09 0.00 0.00 42.92 39.28 1l3n s ASP 96 CO 0.11 -0.40 0.04 -0.69 0.70 0.00 0.00 175.17 174.92 1l3n s VAL 97 N 2.56 4.58 -0.49 2.11 1.01 0.23 -4.88 120.40 125.53 1l3n s VAL 97 Ca 0.27 -0.13 0.06 0.00 0.00 0.00 0.00 61.98 62.19 1l3n s VAL 97 Cb -0.15 -3.00 0.24 0.00 0.00 0.00 0.00 36.38 33.47 1l3n s VAL 97 CO 0.09 0.54 0.89 -1.54 0.00 0.00 0.00 175.10 175.08 1l3n n SER 98 N 2.80 -2.85 -4.25 3.32 3.41 -1.25 -0.49 113.62 114.32 1l3n n SER 98 Ca -0.18 -3.31 -0.27 0.00 -0.26 0.00 0.00 58.87 54.85 1l3n n SER 98 Cb 0.53 1.81 -0.15 0.00 -0.26 0.00 0.00 64.21 66.14 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 0.66 1.70 0.11 -1.33 1.09 -0.11 -4.93 121.20 118.40 1l3n s ILE 99 Ca 0.32 -1.11 0.09 0.00 -1.10 0.00 0.00 60.65 58.84 1l3n s ILE 99 Cb 0.23 -1.46 -0.04 0.00 -1.06 0.00 0.00 42.46 40.13 1l3n s ILE 99 CO -0.24 0.31 -0.18 -1.83 -0.10 0.00 0.00 174.94 172.89 1l3n s GLU 100 N -0.95 1.79 0.03 2.79 1.03 -1.26 0.12 118.70 122.24 1l3n s GLU 100 Ca 0.08 -1.17 -0.14 0.00 0.03 0.00 0.00 54.97 53.76 1l3n s GLU 100 Cb -0.09 -2.11 0.02 0.00 -0.80 0.00 0.00 34.13 31.15 1l3n s GLU 100 CO 0.01 0.48 0.31 0.34 -1.33 0.00 0.00 175.26 175.07 1l3n s ASP 101 N -2.12 -0.15 -0.96 0.83 2.15 -1.25 -4.97 116.67 110.20 1l3n s ASP 101 Ca 0.18 -0.10 -0.03 0.00 0.43 0.00 0.00 52.55 53.02 1l3n s ASP 101 Cb -0.11 0.34 0.22 0.00 -0.30 0.00 0.00 42.92 43.08 1l3n s ASP 101 CO 0.10 -0.56 2.21 -1.54 -0.17 0.00 0.00 175.17 175.20 1l3n n SER 102 N 0.79 7.43 0.05 -0.34 3.41 -1.26 -2.68 113.62 121.02 1l3n n SER 102 Ca -0.19 -3.47 0.00 0.00 -0.26 0.00 0.00 58.87 54.94 1l3n n SER 102 Cb 0.58 -1.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.32 1l3n n SER 102 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1l3n n VAL 103 N 0.52 0.00 -1.67 -3.33 0.31 -1.26 -5.06 118.33 107.83 1l3n n VAL 103 Ca 0.53 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 64.43 1l3n n VAL 103 Cb 0.31 -0.40 -0.01 0.00 -0.91 0.00 0.00 33.84 32.83 1l3n n VAL 103 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1l3n n ILE 104 N -2.82 1.82 -3.68 2.52 2.08 -1.26 -5.00 119.36 113.02 1l3n n ILE 104 Ca 0.00 -0.45 -0.11 0.00 0.56 0.00 0.00 62.75 62.74 1l3n n ILE 104 Cb 0.00 -1.45 -0.09 0.00 -0.75 0.00 0.00 39.64 37.35 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 -0.25 -0.64 0.12 4.38 0.01 -1.26 -4.30 113.70 111.77 1l3n s SER 105 Ca 0.58 1.13 -0.23 0.00 1.31 0.00 0.00 55.95 58.74 1l3n s SER 105 Cb -0.61 1.07 -0.06 0.00 0.21 0.00 0.00 66.02 66.64 1l3n s SER 105 CO 0.60 -0.20 1.67 -0.07 0.41 0.00 0.00 173.24 175.65 1l3n h LEU 106 N 6.19 -0.43 0.00 2.44 3.38 -1.94 0.40 115.31 125.35 1l3n h LEU 106 Ca -0.31 0.07 -0.44 0.00 0.09 0.00 0.00 57.88 57.29 1l3n h LEU 106 Cb 1.19 0.19 -0.12 0.00 0.09 0.00 0.00 40.66 42.01 1l3n h LEU 106 CO 0.20 -0.20 -0.43 -0.24 0.09 0.00 0.00 178.44 177.86 1l3n n SER 107 N -5.28 -0.72 0.00 -0.43 2.88 -1.26 -2.73 113.62 106.09 1l3n n SER 107 Ca -0.04 -3.07 0.00 0.00 -1.33 0.00 0.00 58.87 54.42 1l3n n SER 107 Cb 0.20 1.65 0.00 0.00 -0.75 0.00 0.00 64.21 65.31 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 -0.60 1.33 1.41 0.46 0.00 -1.26 -4.52 105.19 102.00 1l3n n GLY 108 Ca 0.07 -0.65 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 1.22 0.00 0.00 0.00 173.32 174.54 1l3n n ASP 109 N 0.00 0.05 0.05 1.61 9.92 -1.26 -4.80 116.55 122.11 1l3n n ASP 109 Ca 0.00 0.00 -0.20 0.00 -0.53 0.00 0.00 54.79 54.06 1l3n n ASP 109 Cb 0.00 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.37 1l3n n ASP 109 CO 0.00 0.00 0.00 0.45 0.13 0.00 0.00 177.20 177.78 1l3n h HIS 110 N 0.00 0.94 -6.03 1.24 3.86 -1.89 -3.49 115.15 109.78 1l3n h HIS 110 Ca 0.00 -0.53 -0.01 0.00 -1.16 0.00 0.00 60.37 58.67 1l3n h HIS 110 Cb 0.55 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.93 1l3n h HIS 110 CO 0.00 1.37 -0.94 0.45 0.86 0.00 0.00 177.93 179.67 1l3n n SER 111 N -3.93 -6.12 0.14 2.45 2.88 -1.23 -4.89 113.62 102.92 1l3n n SER 111 Ca -0.12 0.36 0.13 0.00 -1.33 0.00 0.00 58.87 57.91 1l3n n SER 111 Cb 0.86 -1.47 0.47 0.00 -0.75 0.00 0.00 64.21 63.32 1l3n n SER 111 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 1l3n h ILE 112 N 3.40 0.00 -1.73 2.46 -0.00 -0.81 -3.45 117.51 117.38 1l3n h ILE 112 Ca -0.01 -0.36 -0.69 0.00 -0.00 0.00 0.00 64.86 63.80 1l3n h ILE 112 Cb 0.94 1.21 0.03 0.00 -0.00 0.00 0.00 36.82 39.00 1l3n h ILE 112 CO 0.00 0.00 0.86 -0.38 -0.00 0.00 0.00 178.15 178.63 1l3n n ILE 113 N -2.35 0.29 -0.08 0.16 2.08 -1.10 -1.31 119.36 117.06 1l3n n ILE 113 Ca 0.03 -0.05 0.00 0.00 0.56 0.00 0.00 62.75 63.29 1l3n n ILE 113 Cb 0.31 -1.32 0.00 0.00 -0.75 0.00 0.00 39.64 37.88 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 3.88 0.77 3.78 7.39 0.00 -1.25 -5.06 105.19 114.71 1l3n n GLY 114 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.92 -0.42 0.00 1.61 3.00 -0.42 -3.01 118.95 118.80 1l3n s ARG 115 Ca 0.00 -0.36 0.04 0.00 0.00 0.00 0.00 55.73 55.41 1l3n s ARG 115 Cb 0.00 -1.72 -0.01 0.00 0.00 0.00 0.00 34.95 33.22 1l3n s ARG 115 CO 0.00 -3.13 -0.14 0.99 0.00 0.00 0.00 175.30 173.03 1l3n s THR 116 N -3.55 1.08 0.21 0.02 2.01 -0.95 -0.90 115.64 113.57 1l3n s THR 116 Ca 0.74 -0.69 0.07 0.00 0.31 0.00 0.00 61.69 62.12 1l3n s THR 116 Cb -0.05 -0.92 -0.04 0.00 0.01 0.00 0.00 72.50 71.50 1l3n s THR 116 CO 0.55 0.22 0.11 -0.76 -0.69 0.00 0.00 174.62 174.04 1l3n s LEU 117 N -0.54 3.61 -0.00 4.42 1.02 0.64 0.22 118.68 128.04 1l3n s LEU 117 Ca 0.04 -0.31 -0.00 0.00 0.02 0.00 0.00 54.13 53.88 1l3n s LEU 117 Cb -0.06 -2.19 0.01 0.00 0.02 0.00 0.00 46.19 43.97 1l3n s LEU 117 CO -0.00 0.03 0.01 -0.69 0.02 0.00 0.00 176.35 175.71 1l3n s VAL 118 N -1.97 -0.01 -0.15 -1.59 1.01 -0.18 -0.90 120.40 116.61 1l3n s VAL 118 Ca 0.31 0.05 -0.06 0.00 0.00 0.00 0.00 61.98 62.27 1l3n s VAL 118 Cb -0.09 -0.03 -0.04 0.00 0.00 0.00 0.00 36.38 36.23 1l3n s VAL 118 CO 0.22 0.02 0.07 0.68 0.00 0.00 0.00 175.10 176.10 1l3n s VAL 119 N 0.23 4.90 0.25 2.92 -7.23 0.05 -2.48 120.40 119.04 1l3n s VAL 119 Ca -0.02 -0.01 0.09 0.00 -1.81 0.00 0.00 61.98 60.23 1l3n s VAL 119 Cb -0.03 -3.16 -0.04 0.00 0.56 0.00 0.00 36.38 33.71 1l3n s VAL 119 CO -0.01 0.53 0.05 -1.00 -0.31 0.00 0.00 175.10 174.36 1l3n s HIS 120 N -0.24 2.83 0.12 2.82 3.76 -0.31 -1.72 115.29 122.54 1l3n s HIS 120 Ca 0.08 -0.18 -0.21 0.00 -0.15 0.00 0.00 55.06 54.61 1l3n s HIS 120 Cb -0.12 -1.27 -0.05 0.00 1.11 0.00 0.00 32.58 32.25 1l3n s HIS 120 CO 0.01 0.58 1.71 1.49 -0.85 0.00 0.00 174.74 177.68 1l3n h GLU 121 N 1.90 -0.01 -5.87 1.40 4.22 -0.72 -3.25 114.58 112.25 1l3n h GLU 121 Ca -0.46 0.00 -0.57 0.00 0.08 0.00 0.00 59.36 58.41 1l3n h GLU 121 Cb 1.24 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.41 1l3n h GLU 121 CO 0.60 -0.00 -0.45 0.15 -2.18 0.00 0.00 179.01 177.12 1l3n s LYS 122 N -6.20 2.26 0.47 1.92 1.02 0.68 -4.82 119.74 115.08 1l3n s LYS 122 Ca -0.13 -1.89 -0.20 0.00 0.02 0.00 0.00 55.97 53.77 1l3n s LYS 122 Cb 0.09 -2.00 -0.09 0.00 -0.52 0.00 0.00 37.83 35.31 1l3n s LYS 122 CO 0.68 -0.23 0.99 0.00 -0.92 0.00 0.00 175.35 175.87 1l3n s ALA 123 N -2.64 2.98 0.38 5.17 0.00 -1.24 -0.07 121.76 126.33 1l3n s ALA 123 Ca 0.38 0.41 -0.24 0.00 0.00 0.00 0.00 51.96 52.51 1l3n s ALA 123 Cb 0.02 -3.18 -0.10 0.00 0.00 0.00 0.00 23.12 19.86 1l3n s ALA 123 CO 0.21 -0.13 0.96 -0.51 0.00 0.00 0.00 175.76 176.29 1l3n s ASP 124 N -2.35 7.10 0.00 0.00 1.11 -1.26 -4.08 116.67 117.19 1l3n s ASP 124 Ca 0.63 1.79 0.23 0.00 0.18 0.00 0.00 52.55 55.38 1l3n s ASP 124 Cb -0.12 -2.56 1.01 0.00 1.07 0.00 0.00 42.92 42.32 1l3n s ASP 124 CO 0.20 -0.24 1.69 0.47 1.18 0.00 0.00 175.17 178.47 1l3n n ASP 125 N -0.04 1.07 -3.92 0.27 8.00 -1.26 -4.95 116.55 115.72 1l3n n ASP 125 Ca 0.05 -1.53 -0.27 0.00 0.71 0.00 0.00 54.79 53.75 1l3n n ASP 125 Cb 0.52 -0.05 -0.01 0.00 -0.02 0.00 0.00 41.12 41.56 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 -0.10 -2.23 0.00 0.64 4.77 -1.26 -0.90 117.00 117.92 1l3n n LEU 126 Ca 0.17 -1.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.12 1l3n n LEU 126 Cb 0.25 -2.22 0.00 0.00 -2.33 0.00 0.00 43.42 39.12 1l3n n LEU 126 CO 0.14 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 1l3n n GLY 127 N -1.96 0.43 1.61 -0.72 0.00 -1.15 -4.46 105.19 98.94 1l3n n GLY 127 Ca -0.27 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.00 2.59 0.13 1.61 5.02 -0.08 -4.57 118.16 120.86 1l3n n LYS 128 Ca 0.00 -3.58 0.05 0.00 -2.02 0.00 0.00 58.31 52.76 1l3n n LYS 128 Cb 0.00 -2.04 0.03 0.00 -0.02 0.00 0.00 35.03 33.00 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 1.58 0.00 -5.02 0.72 0.00 -1.78 -3.47 103.07 95.09 1l3n h GLY 129 Ca 0.32 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.36 1l3n h GLY 129 CO 0.67 0.00 -0.62 0.61 0.00 0.00 0.00 176.54 177.20 1l3n n GLY 130 N 1.22 -0.24 3.69 4.60 0.00 -1.26 -4.86 105.19 108.35 1l3n n GLY 130 Ca 0.00 0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 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 -3.96 -0.29 0.20 1.61 0.01 -1.26 -4.98 114.94 106.27 1l3n s ASN 131 Ca 0.09 -0.53 -0.11 0.00 -0.71 0.00 0.00 52.86 51.60 1l3n s ASN 131 Cb -0.04 0.66 0.18 0.00 0.41 0.00 0.00 41.25 42.47 1l3n s ASN 131 CO 0.60 -1.21 1.81 -0.08 -1.51 0.00 0.00 177.10 176.72 1l3n h GLU 132 N 2.07 0.64 -0.75 -0.60 4.22 -1.94 -0.16 114.58 118.06 1l3n h GLU 132 Ca -0.24 -0.04 0.20 0.00 0.08 0.00 0.00 59.36 59.36 1l3n h GLU 132 Cb 1.26 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 30.33 1l3n h GLU 132 CO 0.30 0.42 0.52 1.49 -2.18 0.00 0.00 179.01 179.56 1l3n h GLU 133 N 0.66 0.10 -0.76 1.92 4.57 -1.97 -1.40 114.58 117.69 1l3n h GLU 133 Ca 0.26 -0.01 0.17 0.00 -1.18 0.00 0.00 59.36 58.61 1l3n h GLU 133 Cb 0.12 -0.02 -0.13 0.00 -0.16 0.00 0.00 28.75 28.56 1l3n h GLU 133 CO -0.15 0.07 0.05 1.03 -1.18 0.00 0.00 179.01 178.83 1l3n h SER 134 N 0.10 -0.27 -0.01 1.04 0.87 -0.32 0.34 113.55 115.31 1l3n h SER 134 Ca 0.36 0.19 0.00 0.00 -1.23 0.00 0.00 61.79 61.11 1l3n h SER 134 Cb 1.28 0.32 0.00 0.00 -0.44 0.00 0.00 62.40 63.56 1l3n h SER 134 CO -0.04 -0.16 0.00 1.07 -0.53 0.00 0.00 176.83 177.17 1l3n n THR 135 N -5.31 0.01 0.00 2.23 5.66 -0.53 -3.41 114.28 112.94 1l3n n THR 135 Ca 0.14 -0.10 0.00 0.00 -3.05 0.00 0.00 64.05 61.05 1l3n n THR 135 Cb 0.49 -0.12 0.00 0.00 -1.55 0.00 0.00 70.33 69.15 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 -0.54 0.00 -0.70 1.09 5.02 0.55 -2.14 118.16 121.43 1l3n n LYS 136 Ca 0.21 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 1l3n n LYS 136 Cb 0.20 0.00 0.24 0.00 -0.02 0.00 0.00 35.03 35.45 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 -0.70 2.54 0.00 -0.18 -2.24 -0.56 -4.55 114.28 108.59 1l3n n THR 137 Ca 0.00 -2.14 0.00 0.00 -2.27 0.00 0.00 64.05 59.64 1l3n n THR 137 Cb 0.00 -0.31 0.00 0.00 -2.10 0.00 0.00 70.33 67.92 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 -0.69 1.25 1.17 3.38 0.00 0.89 -2.00 105.19 109.19 1l3n n GLY 138 Ca 0.31 0.36 -0.02 0.00 0.00 0.00 0.00 46.02 46.67 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 4.08 -0.40 0.00 1.61 2.85 -1.26 -1.92 115.26 120.21 1l3n n ASN 139 Ca 0.00 -0.98 0.07 0.00 -0.11 0.00 0.00 54.58 53.56 1l3n n ASN 139 Cb 0.00 0.16 0.31 0.00 1.24 0.00 0.00 39.78 41.49 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 -0.22 1.67 -0.16 5.20 0.00 -0.85 -4.81 120.51 121.35 1l3n n ALA 140 Ca -0.08 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1l3n n ALA 140 Cb 0.49 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.71 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 -0.00 -1.40 3.67 0.00 0.00 -1.26 -0.23 105.19 105.97 1l3n n GLY 141 Ca 0.04 -1.28 -0.54 0.00 0.00 0.00 0.00 46.02 44.24 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 -0.18 2.39 -3.98 1.61 7.64 -1.26 -4.42 113.62 115.43 1l3n n SER 142 Ca 0.00 1.07 -0.34 0.00 1.01 0.00 0.00 58.87 60.61 1l3n n SER 142 Cb 0.00 -1.21 -0.10 0.00 -1.01 0.00 0.00 64.21 61.89 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 4.59 0.56 -0.32 1.43 1.74 -1.26 -0.36 116.66 123.04 1l3n n ARG 143 Ca 0.23 -1.58 0.21 0.00 -0.77 0.00 0.00 57.85 55.94 1l3n n ARG 143 Cb 0.18 -3.16 0.48 0.00 -1.02 0.00 0.00 32.46 28.95 1l3n n ARG 143 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1l3n h LEU 144 N 18.39 0.49 -7.28 0.55 3.38 -1.65 -3.42 115.31 125.78 1l3n h LEU 144 Ca 0.22 0.08 -0.10 0.00 0.09 0.00 0.00 57.88 58.17 1l3n h LEU 144 Cb 0.81 -0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.34 1l3n h LEU 144 CO 1.63 0.12 -0.13 0.00 0.09 0.00 0.00 178.44 180.15 1l3n s ALA 145 N -5.54 -1.16 0.08 1.53 0.00 -1.02 -0.39 121.76 115.26 1l3n s ALA 145 Ca -0.09 1.05 0.04 0.00 0.00 0.00 0.00 51.96 52.96 1l3n s ALA 145 Cb 0.25 -0.41 -0.03 0.00 0.00 0.00 0.00 23.12 22.92 1l3n s ALA 145 CO 0.80 -0.26 -0.12 0.00 0.00 0.00 0.00 175.76 176.18 1l3n s GLY 147 N -2.00 -0.02 -0.02 0.00 0.00 -0.08 -1.03 107.32 104.17 1l3n s GLY 147 Ca -0.00 0.12 -0.08 0.00 0.00 0.00 0.00 44.72 44.76 1l3n s GLY 147 CO 0.01 0.08 0.27 0.14 0.00 0.00 0.00 173.10 173.60 1l3n s VAL 148 N -0.25 5.29 0.17 1.40 1.01 -1.26 -0.26 120.40 126.49 1l3n s VAL 148 Ca -0.03 0.32 -0.30 0.00 0.00 0.00 0.00 61.98 61.97 1l3n s VAL 148 Cb -0.02 -3.56 -0.07 0.00 0.00 0.00 0.00 36.38 32.73 1l3n s VAL 148 CO 0.00 0.46 0.98 -0.63 0.00 0.00 0.00 175.10 175.91 1l3n s ILE 149 N -1.20 4.25 0.02 2.22 1.01 -0.07 -4.18 121.20 123.24 1l3n s ILE 149 Ca 0.24 2.01 0.02 0.00 0.00 0.00 0.00 60.65 62.91 1l3n s ILE 149 Cb -0.14 -4.28 -0.01 0.00 0.01 0.00 0.00 42.46 38.04 1l3n s ILE 149 CO 0.13 0.37 -0.06 -0.83 0.00 0.00 0.00 174.94 174.56 1l3n s GLY 150 N -0.43 0.34 0.32 6.18 0.00 0.26 -3.78 107.32 110.21 1l3n s GLY 150 Ca 0.45 -0.48 -0.29 0.00 0.00 0.00 0.00 44.72 44.40 1l3n s GLY 150 CO 0.31 -0.50 1.29 -0.42 0.00 0.00 0.00 173.10 173.78 1l3n s ILE 151 N -0.81 2.82 0.00 0.90 1.01 -1.26 -0.53 121.20 123.33 1l3n s ILE 151 Ca -0.05 0.82 0.00 0.00 0.00 0.00 0.00 60.65 61.41 1l3n s ILE 151 Cb -0.06 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 38.89 1l3n s ILE 151 CO -0.00 0.19 0.00 0.00 0.00 0.00 0.00 174.94 175.13 1l3n n ALA 152 N 0.98 1.42 0.75 9.38 0.00 -0.37 -4.74 120.51 127.93 1l3n n ALA 152 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 1l3n n ALA 152 Cb 0.42 0.10 0.35 0.00 0.00 0.00 0.00 19.45 20.32 1l3n n ALA 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50