#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 -4.11 0.00 5.66 -1.25 -4.79 114.28 109.80 1l3n n THR 2 Ca 0.00 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.75 1l3n n THR 2 Cb 0.00 -0.12 -0.06 0.00 -1.55 0.00 0.00 70.33 68.60 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 -1.93 2.84 0.19 1.09 2.20 -0.89 0.20 119.74 123.44 1l3n s LYS 3 Ca 0.00 -0.94 -0.17 0.00 -0.36 0.00 0.00 55.97 54.51 1l3n s LYS 3 Cb 0.00 -2.59 0.02 0.00 -1.51 0.00 0.00 37.83 33.75 1l3n s LYS 3 CO 0.00 0.46 0.50 0.00 -0.36 0.00 0.00 175.35 175.95 1l3n s ALA 4 N -1.82 -0.83 0.16 3.13 0.00 0.56 -0.53 121.76 122.43 1l3n s ALA 4 Ca 0.31 -0.30 0.01 0.00 0.00 0.00 0.00 51.96 51.98 1l3n s ALA 4 Cb -0.10 0.85 -0.04 0.00 0.00 0.00 0.00 23.12 23.84 1l3n s ALA 4 CO 0.23 -0.79 0.01 0.14 0.00 0.00 0.00 175.76 175.35 1l3n s VAL 5 N -3.89 0.53 -0.27 0.00 -7.23 -0.07 -0.49 120.40 108.99 1l3n s VAL 5 Ca 0.10 -1.96 -0.04 0.00 -1.81 0.00 0.00 61.98 58.28 1l3n s VAL 5 Cb -0.01 -2.08 0.10 0.00 0.56 0.00 0.00 36.38 34.96 1l3n s VAL 5 CO -0.02 -0.50 0.15 0.00 -0.31 0.00 0.00 175.10 174.43 1l3n s ALA 6 N -3.75 0.38 -1.01 1.32 0.00 0.14 -1.74 121.76 117.10 1l3n s ALA 6 Ca 0.23 -0.80 -0.20 0.00 0.00 0.00 0.00 51.96 51.20 1l3n s ALA 6 Cb 0.06 -1.40 0.11 0.00 0.00 0.00 0.00 23.12 21.89 1l3n s ALA 6 CO 0.03 -1.57 1.31 0.14 0.00 0.00 0.00 175.76 175.66 1l3n s VAL 7 N 2.16 4.46 -0.10 0.00 -7.23 -1.26 -1.13 120.40 117.30 1l3n s VAL 7 Ca 0.08 -1.45 -0.28 0.00 -1.81 0.00 0.00 61.98 58.52 1l3n s VAL 7 Cb -0.16 -4.91 -0.02 0.00 0.56 0.00 0.00 36.38 31.85 1l3n s VAL 7 CO -0.31 -1.69 0.93 -0.76 -0.31 0.00 0.00 175.10 172.95 1l3n s LEU 8 N 3.41 4.26 0.06 1.32 1.02 0.14 -4.45 118.68 124.43 1l3n s LEU 8 Ca 0.39 1.44 -0.02 0.00 0.02 0.00 0.00 54.13 55.97 1l3n s LEU 8 Cb -0.02 -3.44 -0.04 0.00 0.02 0.00 0.00 46.19 42.71 1l3n s LEU 8 CO -0.07 -0.37 0.00 -0.54 0.02 0.00 0.00 176.35 175.39 1l3n s LYS 9 N 1.72 0.66 0.18 1.70 1.02 -0.52 -0.30 119.74 124.21 1l3n s LYS 9 Ca 0.46 -1.21 0.00 0.00 0.02 0.00 0.00 55.97 55.24 1l3n s LYS 9 Cb -0.18 0.23 0.00 0.00 -0.52 0.00 0.00 37.83 37.35 1l3n s LYS 9 CO 0.19 -0.14 0.00 0.41 -0.92 0.00 0.00 175.35 174.89 1l3n n GLY 10 N 0.08 -1.63 0.17 -3.33 0.00 -1.22 -1.00 105.19 98.25 1l3n n GLY 10 Ca -0.13 0.53 -0.15 0.00 0.00 0.00 0.00 46.02 46.26 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 0.59 0.00 1.61 3.58 -0.90 -3.49 116.42 117.81 1l3n h ASP 11 Ca 0.00 -0.58 0.00 0.00 0.42 0.00 0.00 57.03 56.87 1l3n h ASP 11 Cb 0.00 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 40.88 1l3n h ASP 11 CO 0.00 1.07 0.00 0.61 -2.88 0.00 0.00 179.24 178.04 1l3n n GLY 12 N 0.50 1.70 0.32 -0.78 0.00 -1.26 -4.89 105.19 100.78 1l3n n GLY 12 Ca -0.07 -0.28 0.09 0.00 0.00 0.00 0.00 46.02 45.76 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 0.32 -5.72 1.61 0.13 -1.93 -3.37 132.00 123.04 1l3n h PRO 13 Ca 0.00 -0.02 -0.32 0.00 -0.87 0.00 0.00 66.00 64.79 1l3n h PRO 13 Cb 0.00 -0.07 -0.03 0.00 0.13 0.00 0.00 31.00 31.03 1l3n h PRO 13 CO 0.00 0.21 0.88 0.08 -0.23 0.00 0.00 178.00 178.93 1l3n s VAL 14 N -5.32 3.31 -0.30 1.56 1.01 -1.26 -3.84 120.40 115.56 1l3n s VAL 14 Ca -0.07 -0.12 0.01 0.00 0.00 0.00 0.00 61.98 61.81 1l3n s VAL 14 Cb 0.18 -3.73 0.07 0.00 0.00 0.00 0.00 36.38 32.91 1l3n s VAL 14 CO 0.72 -0.69 -0.02 -1.10 0.00 0.00 0.00 175.10 174.02 1l3n s GLN 15 N 7.46 2.11 0.02 2.72 -0.21 0.47 -3.95 119.66 128.28 1l3n s GLN 15 Ca 0.76 -1.48 -0.12 0.00 0.02 0.00 0.00 55.36 54.54 1l3n s GLN 15 Cb -0.10 -3.10 -0.05 0.00 1.00 0.00 0.00 33.01 30.75 1l3n s GLN 15 CO 0.09 -0.71 0.37 0.20 -2.12 0.00 0.00 175.29 173.12 1l3n s GLY 16 N 1.16 2.38 -0.38 3.09 0.00 0.58 -1.10 107.32 113.06 1l3n s GLY 16 Ca -0.02 -0.35 0.12 0.00 0.00 0.00 0.00 44.72 44.47 1l3n s GLY 16 CO -0.05 -0.06 0.83 1.39 0.00 0.00 0.00 173.10 175.22 1l3n n ILE 17 N 1.46 -0.01 -2.73 0.90 5.41 -1.22 0.27 119.36 123.43 1l3n n ILE 17 Ca -0.12 -3.84 -0.41 0.00 1.00 0.00 0.00 62.75 59.38 1l3n n ILE 17 Cb 0.53 0.16 -0.05 0.00 -0.71 0.00 0.00 39.64 39.56 1l3n n ILE 17 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1l3n s ILE 18 N -2.00 4.26 -0.23 1.39 -1.09 -0.29 -4.24 121.20 119.00 1l3n s ILE 18 Ca 0.35 2.05 -0.02 0.00 -2.23 0.00 0.00 60.65 60.81 1l3n s ILE 18 Cb 0.35 -4.31 0.02 0.00 -1.58 0.00 0.00 42.46 36.94 1l3n s ILE 18 CO -0.06 0.40 -0.08 0.20 -1.23 0.00 0.00 174.94 174.17 1l3n s ASN 19 N -0.57 4.11 -0.24 3.58 0.01 0.25 -0.68 114.94 121.39 1l3n s ASN 19 Ca 0.44 -0.73 -0.09 0.00 -0.71 0.00 0.00 52.86 51.77 1l3n s ASN 19 Cb -0.25 -1.65 -0.04 0.00 0.41 0.00 0.00 41.25 39.72 1l3n s ASN 19 CO 0.31 -0.08 0.12 -0.36 -1.51 0.00 0.00 177.10 175.58 1l3n s PHE 20 N 1.35 3.20 0.04 2.20 0.08 0.36 -2.40 117.98 122.82 1l3n s PHE 20 Ca 0.02 -0.05 0.08 0.00 0.12 0.00 0.00 56.93 57.11 1l3n s PHE 20 Cb -0.15 -2.25 -0.03 0.00 -0.57 0.00 0.00 43.02 40.01 1l3n s PHE 20 CO -0.06 -0.12 -0.23 -2.00 -0.10 0.00 0.00 175.22 172.71 1l3n s GLU 21 N 1.31 1.92 -0.31 0.44 2.12 -1.23 -0.32 118.70 122.62 1l3n s GLU 21 Ca 0.06 -1.05 0.02 0.00 0.36 0.00 0.00 54.97 54.35 1l3n s GLU 21 Cb -0.15 -2.07 0.09 0.00 0.26 0.00 0.00 34.13 32.27 1l3n s GLU 21 CO 0.05 0.52 0.05 -0.65 -0.54 0.00 0.00 175.26 174.69 1l3n s GLN 22 N -1.31 1.24 0.14 4.30 -1.52 0.13 -3.96 119.66 118.68 1l3n s GLN 22 Ca 0.13 -1.42 -0.27 0.00 -1.95 0.00 0.00 55.36 51.85 1l3n s GLN 22 Cb -0.10 -2.65 -0.02 0.00 -0.22 0.00 0.00 33.01 30.01 1l3n s GLN 22 CO 0.03 -0.89 1.59 0.87 -0.25 0.00 0.00 175.29 176.65 1l3n h LYS 23 N 7.85 -0.40 -4.93 2.91 1.79 -1.91 -3.43 116.57 118.45 1l3n h LYS 23 Ca -0.10 0.03 -0.49 0.00 -2.18 0.00 0.00 60.65 57.90 1l3n h LYS 23 Cb 1.03 0.09 -0.13 0.00 -1.58 0.00 0.00 32.23 31.64 1l3n h LYS 23 CO 0.48 -0.26 -0.50 -2.00 -1.08 0.00 0.00 179.45 176.09 1l3n s GLU 24 N -5.93 1.80 0.46 3.15 -6.30 -1.26 -5.01 118.70 105.62 1l3n s GLU 24 Ca -0.15 -2.06 0.30 0.00 -2.50 0.00 0.00 54.97 50.56 1l3n s GLU 24 Cb 0.11 0.00 1.10 0.00 0.00 0.00 0.00 34.13 35.34 1l3n s GLU 24 CO 0.65 -0.58 1.87 1.03 0.02 0.00 0.00 175.26 178.25 1l3n h SER 25 N 2.03 0.00 1.91 -1.70 0.87 -1.89 -1.94 113.55 112.83 1l3n h SER 25 Ca -0.29 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 1l3n h SER 25 Cb 1.25 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 1l3n h SER 25 CO 0.44 0.00 0.00 0.78 -0.53 0.00 0.00 176.83 177.52 1l3n h ASN 26 N 0.00 0.00 -3.96 6.23 2.35 -1.96 -3.46 115.58 114.78 1l3n h ASN 26 Ca 0.00 0.00 -0.53 0.00 -0.55 0.00 0.00 56.30 55.22 1l3n h ASN 26 Cb 0.58 0.00 0.09 0.00 0.05 0.00 0.00 38.32 39.03 1l3n h ASN 26 CO 0.00 0.00 0.60 -0.83 -1.65 0.00 0.00 177.43 175.55 1l3n s GLY 27 N -4.13 2.90 0.48 2.83 0.00 -0.73 -5.01 107.32 103.65 1l3n s GLY 27 Ca 0.07 1.21 -0.21 0.00 0.00 0.00 0.00 44.72 45.79 1l3n s GLY 27 CO 0.66 1.78 1.07 2.56 0.00 0.00 0.00 173.10 179.16 1l3n s PRO 28 N -2.36 3.77 -0.73 2.90 0.04 -1.26 -4.91 135.00 132.44 1l3n s PRO 28 Ca 0.59 1.47 -0.27 0.00 0.04 0.00 0.00 61.00 62.83 1l3n s PRO 28 Cb -0.37 -2.18 0.03 0.00 0.04 0.00 0.00 34.50 32.02 1l3n s PRO 28 CO 0.47 -0.48 1.30 0.08 0.04 0.00 0.00 177.00 178.41 1l3n s VAL 29 N -1.85 3.72 -0.52 -0.36 1.01 0.12 -4.84 120.40 117.69 1l3n s VAL 29 Ca 0.67 0.43 -0.27 0.00 0.00 0.00 0.00 61.98 62.80 1l3n s VAL 29 Cb -0.20 -4.87 0.03 0.00 0.00 0.00 0.00 36.38 31.34 1l3n s VAL 29 CO 0.24 -1.79 1.09 -0.75 0.00 0.00 0.00 175.10 173.88 1l3n s LYS 30 N 5.75 3.55 -0.57 2.72 2.20 -1.25 -0.97 119.74 131.16 1l3n s LYS 30 Ca 0.37 0.25 -0.22 0.00 -0.36 0.00 0.00 55.97 56.01 1l3n s LYS 30 Cb -0.08 -3.97 0.06 0.00 -1.51 0.00 0.00 37.83 32.33 1l3n s LYS 30 CO 0.16 -1.48 0.83 0.14 -0.36 0.00 0.00 175.35 174.64 1l3n s VAL 31 N 4.43 4.56 0.17 4.02 -7.23 0.97 -3.56 120.40 123.76 1l3n s VAL 31 Ca 0.42 -0.27 0.08 0.00 -1.81 0.00 0.00 61.98 60.39 1l3n s VAL 31 Cb -0.09 -4.50 -0.04 0.00 0.56 0.00 0.00 36.38 32.31 1l3n s VAL 31 CO 0.27 -1.12 -0.06 -1.66 -0.31 0.00 0.00 175.10 172.22 1l3n s TRP 32 N 3.45 2.73 0.00 2.82 -2.14 -1.01 -1.02 118.94 123.78 1l3n s TRP 32 Ca 0.21 -0.18 0.00 0.00 2.66 0.00 0.00 56.10 58.80 1l3n s TRP 32 Cb -0.17 -1.34 0.00 0.00 -3.10 0.00 0.00 33.47 28.86 1l3n s TRP 32 CO 0.13 0.50 0.00 0.41 -2.66 0.00 0.00 176.95 175.33 1l3n n GLY 33 N 0.06 -0.88 2.76 3.67 0.00 0.26 -0.59 105.19 110.48 1l3n n GLY 33 Ca -0.11 -1.17 -0.29 0.00 0.00 0.00 0.00 46.02 44.46 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 0.00 3.72 0.26 1.61 1.04 -1.26 -0.41 113.70 118.66 1l3n s SER 34 Ca 0.00 -1.37 -0.29 0.00 0.48 0.00 0.00 55.95 54.77 1l3n s SER 34 Cb 0.00 -0.84 -0.09 0.00 0.10 0.00 0.00 66.02 65.18 1l3n s SER 34 CO 0.00 -0.36 0.95 0.27 0.98 0.00 0.00 173.24 175.07 1l3n s ILE 35 N 1.64 4.08 0.12 -1.02 -4.36 -0.52 -4.10 121.20 117.04 1l3n s ILE 35 Ca 0.05 2.01 0.10 0.00 -0.26 0.00 0.00 60.65 62.55 1l3n s ILE 35 Cb -0.17 -4.25 -0.04 0.00 1.25 0.00 0.00 42.46 39.25 1l3n s ILE 35 CO -0.18 0.41 -0.23 -0.75 0.24 0.00 0.00 174.94 174.44 1l3n s LYS 36 N -1.39 1.59 0.00 0.37 2.20 -0.25 -0.54 119.74 121.71 1l3n s LYS 36 Ca 0.43 -1.27 0.00 0.00 -0.36 0.00 0.00 55.97 54.78 1l3n s LYS 36 Cb -0.25 -2.00 0.00 0.00 -1.51 0.00 0.00 37.83 34.07 1l3n s LYS 36 CO 0.30 0.47 0.00 0.41 -0.36 0.00 0.00 175.35 176.17 1l3n n GLY 37 N 0.88 0.59 3.33 5.54 0.00 -0.68 -0.39 105.19 114.46 1l3n n GLY 37 Ca -0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.79 0.44 0.99 2.01 -1.01 -4.25 118.68 116.08 1l3n s LEU 38 Ca 0.00 1.01 0.07 0.00 0.01 0.00 0.00 54.13 55.22 1l3n s LEU 38 Cb 0.00 -2.52 -0.02 0.00 0.01 0.00 0.00 46.19 43.65 1l3n s LEU 38 CO 0.00 -5.20 0.29 0.28 1.01 0.00 0.00 176.35 172.74 1l3n s THR 39 N -2.28 2.30 0.82 5.49 -1.32 -1.26 -3.56 115.64 115.83 1l3n s THR 39 Ca 0.69 -1.53 -0.15 0.00 -1.21 0.00 0.00 61.69 59.48 1l3n s THR 39 Cb -0.16 -2.84 -0.04 0.00 -1.51 0.00 0.00 72.50 67.95 1l3n s THR 39 CO 0.60 0.00 0.23 1.21 -2.21 0.00 0.00 174.62 174.45 1l3n n GLU 40 N -1.45 0.05 0.00 7.08 4.07 -1.25 -4.62 120.64 124.53 1l3n n GLU 40 Ca 0.00 0.05 0.00 0.00 -0.06 0.00 0.00 57.16 57.16 1l3n n GLU 40 Cb 0.63 -1.64 0.00 0.00 -0.06 0.00 0.00 31.44 30.37 1l3n n GLU 40 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1l3n n GLY 41 N 1.96 -2.02 3.77 8.31 0.00 0.26 -4.81 105.19 112.66 1l3n n GLY 41 Ca 0.07 -1.56 -0.40 0.00 0.00 0.00 0.00 46.02 44.14 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 4.35 0.02 0.99 1.02 -1.26 -0.43 118.68 123.37 1l3n s LEU 42 Ca 0.00 2.46 -0.04 0.00 0.02 0.00 0.00 54.13 56.57 1l3n s LEU 42 Cb 0.00 -3.81 -0.01 0.00 0.02 0.00 0.00 46.19 42.39 1l3n s LEU 42 CO 0.00 -0.52 0.06 -1.00 0.02 0.00 0.00 176.35 174.90 1l3n s HIS 43 N -1.26 0.19 -0.20 0.29 3.76 0.44 -2.61 115.29 115.90 1l3n s HIS 43 Ca 0.52 -0.43 -0.24 0.00 -0.15 0.00 0.00 55.06 54.75 1l3n s HIS 43 Cb -0.34 -0.14 -0.11 0.00 1.11 0.00 0.00 32.58 33.09 1l3n s HIS 43 CO 0.44 -0.28 0.79 0.41 -0.85 0.00 0.00 174.74 175.25 1l3n n GLY 44 N 1.22 0.04 3.04 -2.22 0.00 0.94 -1.28 105.19 106.94 1l3n n GLY 44 Ca -0.22 0.51 -0.02 0.00 0.00 0.00 0.00 46.02 46.29 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 1.22 -1.31 0.27 1.61 2.19 -1.25 -1.41 117.98 119.29 1l3n s PHE 45 Ca 0.54 1.16 -0.19 0.00 0.33 0.00 0.00 56.93 58.77 1l3n s PHE 45 Cb -0.77 0.26 0.01 0.00 -1.31 0.00 0.00 43.02 41.21 1l3n s PHE 45 CO 0.41 -0.87 0.64 -1.01 1.83 0.00 0.00 175.22 176.22 1l3n s HIS 46 N 2.71 -0.03 0.50 10.12 0.09 -0.98 -1.73 115.29 125.97 1l3n s HIS 46 Ca 0.15 -0.39 -0.10 0.00 -0.00 0.00 0.00 55.06 54.72 1l3n s HIS 46 Cb -0.14 0.55 -0.05 0.00 -0.00 0.00 0.00 32.58 32.94 1l3n s HIS 46 CO -0.21 -1.16 0.87 0.14 -0.00 0.00 0.00 174.74 174.38 1l3n s VAL 47 N -3.95 4.77 -0.03 -0.90 -7.23 -0.35 -0.60 120.40 112.11 1l3n s VAL 47 Ca 0.14 0.63 -0.03 0.00 -1.81 0.00 0.00 61.98 60.91 1l3n s VAL 47 Cb -0.04 -3.81 0.01 0.00 0.56 0.00 0.00 36.38 33.09 1l3n s VAL 47 CO 0.07 -0.81 0.08 -1.00 -0.31 0.00 0.00 175.10 173.12 1l3n s HIS 48 N -2.74 -0.08 0.07 2.82 3.76 0.15 -4.59 115.29 114.68 1l3n s HIS 48 Ca 0.52 0.20 -0.37 0.00 -0.15 0.00 0.00 55.06 55.26 1l3n s HIS 48 Cb -0.10 0.03 -0.20 0.00 1.11 0.00 0.00 32.58 33.42 1l3n s HIS 48 CO 0.42 -0.04 1.57 1.49 -0.85 0.00 0.00 174.74 177.32 1l3n h GLU 49 N 6.00 -1.19 -6.22 1.40 4.81 -1.63 -2.88 114.58 114.87 1l3n h GLU 49 Ca -0.25 0.08 -0.56 0.00 -0.13 0.00 0.00 59.36 58.50 1l3n h GLU 49 Cb 1.20 0.27 -0.04 0.00 0.63 0.00 0.00 28.75 30.82 1l3n h GLU 49 CO 0.46 -0.79 0.75 -0.06 -0.73 0.00 0.00 179.01 178.63 1l3n s PHE 50 N -5.96 3.18 -1.08 0.92 0.40 0.12 -4.50 117.98 111.07 1l3n s PHE 50 Ca -0.19 1.27 0.15 0.00 -0.60 0.00 0.00 56.93 57.55 1l3n s PHE 50 Cb 0.03 -3.38 0.65 0.00 0.51 0.00 0.00 43.02 40.83 1l3n s PHE 50 CO 0.60 -1.09 1.46 0.41 0.70 0.00 0.00 175.22 177.31 1l3n n GLY 51 N 3.38 -0.96 3.55 4.36 0.00 -1.25 -4.25 105.19 110.00 1l3n n GLY 51 Ca 0.11 -0.05 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.46 2.22 -1.02 1.61 2.03 -1.26 -4.74 116.55 113.92 1l3n n ASP 52 Ca 0.04 -0.50 0.08 0.00 0.52 0.00 0.00 54.79 54.93 1l3n n ASP 52 Cb 0.16 -1.56 0.25 0.00 -0.72 0.00 0.00 41.12 39.25 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 15.79 3.79 -0.20 1.67 4.13 -1.26 -1.46 115.26 137.73 1l3n n ASN 53 Ca 0.39 -2.44 0.13 0.00 1.68 0.00 0.00 54.58 54.34 1l3n n ASN 53 Cb 0.52 -0.43 0.44 0.00 -1.54 0.00 0.00 39.78 38.77 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 2.63 0.84 0.00 3.41 2.02 -1.99 0.25 112.91 120.08 1l3n h THR 54 Ca 0.00 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 66.99 1l3n h THR 54 Cb 1.17 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1l3n h THR 54 CO 0.14 0.10 0.00 0.00 0.37 0.00 0.00 175.52 176.13 1l3n h ALA 55 N 1.63 1.00 0.00 6.16 0.00 -1.99 -3.49 119.26 122.57 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 0.74 1.47 2.60 0.00 0.00 0.88 -4.89 105.19 106.00 1l3n n GLY 56 Ca 0.03 -0.46 -0.11 0.00 0.00 0.00 0.00 46.02 45.47 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 0.60 0.00 0.34 0.00 -1.04 -1.26 -4.84 114.28 108.07 1l3n n THR 58 Ca 0.11 0.00 0.20 0.00 -2.04 0.00 0.00 64.05 62.32 1l3n n THR 58 Cb 0.67 0.00 1.07 0.00 -1.82 0.00 0.00 70.33 70.25 1l3n n THR 58 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 1l3n h SER 59 N 0.00 0.00 -1.46 8.00 0.87 -1.92 -1.71 113.55 117.33 1l3n h SER 59 Ca 0.00 0.00 0.42 0.00 -1.23 0.00 0.00 61.79 60.98 1l3n h SER 59 Cb 0.00 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 61.90 1l3n h SER 59 CO 0.00 0.00 1.31 0.00 -0.53 0.00 0.00 176.83 177.61 1l3n n ALA 60 N -2.01 1.40 0.00 6.23 0.00 -0.53 -4.73 120.51 120.87 1l3n n ALA 60 Ca -0.03 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1l3n n ALA 60 Cb 0.19 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 18.80 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 -1.81 0.87 0.00 0.00 0.00 -0.64 -0.70 105.19 102.91 1l3n n GLY 61 Ca 0.33 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.40 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 1.32 0.46 -1.46 1.61 -0.04 -1.26 -4.77 135.00 130.87 1l3n n PRO 62 Ca 0.00 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.09 1l3n n PRO 62 Cb 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.42 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 -1.23 2.25 -1.63 0.54 8.25 -1.20 -3.52 115.22 118.69 1l3n n HIS 63 Ca 0.00 -2.87 -0.38 0.00 -0.26 0.00 0.00 57.72 54.20 1l3n n HIS 63 Cb 0.00 -2.23 -0.05 0.00 1.12 0.00 0.00 29.99 28.83 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 2.96 2.56 -2.24 4.41 3.72 -1.26 -4.92 117.46 122.69 1l3n n PHE 64 Ca 0.71 -1.89 -0.33 0.00 -0.05 0.00 0.00 57.45 55.89 1l3n n PHE 64 Cb 0.30 -2.17 -0.01 0.00 -0.94 0.00 0.00 39.48 36.66 1l3n n PHE 64 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1l3n s ASN 65 N 5.24 6.04 0.14 4.37 4.22 -1.26 -4.61 114.94 129.08 1l3n s ASN 65 Ca 0.60 1.83 -0.14 0.00 -2.14 0.00 0.00 52.86 53.01 1l3n s ASN 65 Cb 0.09 -2.54 0.00 0.00 1.28 0.00 0.00 41.25 40.08 1l3n s ASN 65 CO 0.10 -0.99 1.62 1.55 -2.04 0.00 0.00 177.10 177.34 1l3n h PRO 66 N 0.85 0.73 -2.29 3.55 0.13 -1.92 -3.18 132.00 129.87 1l3n h PRO 66 Ca -0.48 -0.19 -0.21 0.00 -0.87 0.00 0.00 66.00 64.25 1l3n h PRO 66 Cb 1.22 -0.09 -0.05 0.00 0.13 0.00 0.00 31.00 32.21 1l3n h PRO 66 CO 0.58 0.75 0.20 1.28 -0.23 0.00 0.00 178.00 180.58 1l3n n LEU 67 N -4.48 4.70 -4.53 1.56 4.77 -1.26 -4.93 117.00 112.84 1l3n n LEU 67 Ca 0.00 -2.85 -0.50 0.00 -0.03 0.00 0.00 56.01 52.63 1l3n n LEU 67 Cb 0.24 -1.20 -0.06 0.00 -2.33 0.00 0.00 43.42 40.07 1l3n n LEU 67 CO 0.40 1.35 1.72 -1.54 -1.33 0.00 0.00 177.39 177.98 1l3n n SER 68 N 2.73 2.51 0.00 -1.43 3.41 -1.20 -4.73 113.62 114.91 1l3n n SER 68 Ca 0.39 0.53 0.00 0.00 -0.26 0.00 0.00 58.87 59.54 1l3n n SER 68 Cb 0.69 -1.31 0.00 0.00 -0.26 0.00 0.00 64.21 63.34 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 7.78 0.00 -3.92 4.33 1.74 -1.26 -5.14 116.66 120.18 1l3n n ARG 69 Ca 0.36 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.35 1l3n n ARG 69 Cb 0.26 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.61 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 0.72 -0.13 5.56 -0.14 -0.47 -5.07 119.74 120.21 1l3n s LYS 70 Ca 0.00 -0.93 -0.29 0.00 -1.36 0.00 0.00 55.97 53.39 1l3n s LYS 70 Cb 0.00 0.28 -0.03 0.00 -1.68 0.00 0.00 37.83 36.41 1l3n s LYS 70 CO 0.00 -0.20 1.36 -1.58 -0.76 0.00 0.00 175.35 174.17 1l3n s HIS 71 N -3.43 2.66 0.00 3.18 5.65 -1.08 -2.49 115.29 119.78 1l3n s HIS 71 Ca 0.02 0.82 0.00 0.00 0.25 0.00 0.00 55.06 56.15 1l3n s HIS 71 Cb 0.03 -3.60 0.00 0.00 -1.18 0.00 0.00 32.58 27.83 1l3n s HIS 71 CO -0.08 -2.22 0.00 0.41 -0.65 0.00 0.00 174.74 172.19 1l3n n GLY 72 N 3.72 4.69 0.00 1.59 0.00 -1.26 -2.86 105.19 111.08 1l3n n GLY 72 Ca 0.15 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 1.19 0.00 -0.02 0.00 -1.26 -4.69 105.19 100.40 1l3n n GLY 73 Ca 0.00 -0.24 0.02 0.00 0.00 0.00 0.00 46.02 45.80 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 0.25 0.05 1.61 -0.04 -1.25 -0.62 135.00 135.00 1l3n n PRO 74 Ca 0.00 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.52 1l3n n PRO 74 Cb 0.00 -1.31 -0.07 0.00 -0.04 0.00 0.00 33.50 32.08 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 -0.81 0.62 -4.34 0.54 4.76 -1.26 -4.98 118.16 112.69 1l3n n LYS 75 Ca 0.04 0.09 -0.28 0.00 -2.87 0.00 0.00 58.31 55.29 1l3n n LYS 75 Cb 0.02 -1.75 -0.11 0.00 -1.84 0.00 0.00 35.03 31.35 1l3n n LYS 75 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1l3n s ASP 76 N -5.36 3.81 0.10 4.39 2.15 0.21 -5.01 116.67 116.96 1l3n s ASP 76 Ca -0.03 -0.68 -0.01 0.00 0.43 0.00 0.00 52.55 52.26 1l3n s ASP 76 Cb 0.10 -0.48 -0.21 0.00 -0.30 0.00 0.00 42.92 42.02 1l3n s ASP 76 CO 0.82 0.14 1.22 -0.08 -0.17 0.00 0.00 175.17 177.10 1l3n h GLU 77 N 3.31 0.20 -0.34 4.34 4.81 -1.94 -3.35 114.58 121.62 1l3n h GLU 77 Ca -0.48 -0.31 0.00 0.00 -0.13 0.00 0.00 59.36 58.44 1l3n h GLU 77 Cb 1.19 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.68 1l3n h GLU 77 CO 0.49 1.12 0.00 0.39 -0.73 0.00 0.00 179.01 180.28 1l3n n GLU 78 N -3.52 1.91 -1.49 1.92 1.02 -1.26 -4.95 120.64 114.27 1l3n n GLU 78 Ca -0.06 -1.40 -0.44 0.00 -0.02 0.00 0.00 57.16 55.24 1l3n n GLU 78 Cb 0.96 -1.35 -0.01 0.00 -0.02 0.00 0.00 31.44 31.02 1l3n n GLU 78 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1l3n n ARG 79 N 0.63 0.74 0.50 3.49 -4.01 -1.25 -1.37 116.66 115.38 1l3n n ARG 79 Ca 0.15 0.26 -0.20 0.00 -1.04 0.00 0.00 57.85 57.02 1l3n n ARG 79 Cb 0.35 -1.51 -0.10 0.00 -3.04 0.00 0.00 32.46 28.16 1l3n n ARG 79 CO 0.00 0.00 0.00 0.45 -3.04 0.00 0.00 177.63 175.04 1l3n h HIS 80 N 1.31 -1.20 0.00 2.89 3.86 -1.80 -3.45 115.15 116.75 1l3n h HIS 80 Ca -0.37 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 58.81 1l3n h HIS 80 Cb 1.39 0.40 0.00 0.00 1.06 0.00 0.00 27.41 30.26 1l3n h HIS 80 CO 0.42 -0.74 0.00 1.55 0.86 0.00 0.00 177.93 180.02 1l3n n VAL 81 N -5.64 0.00 -1.20 2.45 3.14 -1.26 -4.68 118.33 111.14 1l3n n VAL 81 Ca -0.16 0.00 -0.33 0.00 -2.96 0.00 0.00 64.34 60.89 1l3n n VAL 81 Cb 0.50 0.00 -0.05 0.00 -1.06 0.00 0.00 33.84 33.23 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 0.00 3.94 3.44 7.55 0.00 -1.26 -4.76 105.19 114.09 1l3n n GLY 82 Ca 0.00 -1.39 -0.44 0.00 0.00 0.00 0.00 46.02 44.19 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 2.26 6.62 0.25 1.61 1.01 -1.26 -1.22 116.67 125.93 1l3n s ASP 83 Ca 0.66 -2.06 0.04 0.00 0.71 0.00 0.00 52.55 51.91 1l3n s ASP 83 Cb 0.19 -2.38 0.29 0.00 1.01 0.00 0.00 42.92 42.04 1l3n s ASP 83 CO -0.05 -1.03 1.60 -0.07 0.21 0.00 0.00 175.17 175.83 1l3n h LEU 84 N 10.18 0.33 0.00 1.23 3.38 -1.63 -3.33 115.31 125.46 1l3n h LEU 84 Ca 0.13 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1l3n h LEU 84 Cb 1.03 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1l3n h LEU 84 CO 1.07 0.79 0.00 0.61 0.09 0.00 0.00 178.44 181.01 1l3n n GLY 85 N 0.11 1.94 2.76 0.83 0.00 -0.99 -4.42 105.19 105.42 1l3n n GLY 85 Ca -0.02 -0.59 -0.24 0.00 0.00 0.00 0.00 46.02 45.17 1l3n n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1l3n s ASN 86 N -2.61 1.77 -0.24 1.61 0.02 -1.26 -3.95 114.94 110.28 1l3n s ASN 86 Ca 0.00 -0.19 -0.08 0.00 -1.02 0.00 0.00 52.86 51.57 1l3n s ASN 86 Cb 0.00 -0.46 -0.04 0.00 0.02 0.00 0.00 41.25 40.77 1l3n s ASN 86 CO 0.00 -0.21 0.10 0.68 0.02 0.00 0.00 177.10 177.69 1l3n s VAL 87 N 1.96 4.68 -0.67 1.60 -7.23 -0.40 -4.82 120.40 115.52 1l3n s VAL 87 Ca 0.04 -0.05 -0.26 0.00 -1.81 0.00 0.00 61.98 59.90 1l3n s VAL 87 Cb -0.13 -3.18 0.04 0.00 0.56 0.00 0.00 36.38 33.67 1l3n s VAL 87 CO -0.06 0.35 1.15 -0.89 -0.31 0.00 0.00 175.10 175.34 1l3n s THR 88 N 1.35 3.99 -0.08 5.32 2.01 -1.26 -0.42 115.64 126.55 1l3n s THR 88 Ca 0.06 0.30 -0.21 0.00 0.31 0.00 0.00 61.69 62.14 1l3n s THR 88 Cb -0.15 -4.79 -0.04 0.00 0.01 0.00 0.00 72.50 67.54 1l3n s THR 88 CO 0.05 -1.59 0.61 0.00 -0.69 0.00 0.00 174.62 173.00 1l3n s ALA 89 N 5.00 3.39 1.17 7.40 0.00 0.43 -4.08 121.76 135.07 1l3n s ALA 89 Ca 0.33 0.01 -0.13 0.00 0.00 0.00 0.00 51.96 52.16 1l3n s ALA 89 Cb -0.11 -2.83 0.27 0.00 0.00 0.00 0.00 23.12 20.45 1l3n s ALA 89 CO 0.16 -0.05 0.89 -0.25 0.00 0.00 0.00 175.76 176.51 1l3n n ASP 90 N 3.69 -1.82 -0.23 0.00 8.00 0.39 -0.58 116.55 126.00 1l3n n ASP 90 Ca -0.04 -0.16 0.25 0.00 0.71 0.00 0.00 54.79 55.56 1l3n n ASP 90 Cb 0.51 -1.22 0.63 0.00 -0.02 0.00 0.00 41.12 41.02 1l3n n ASP 90 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 1l3n h LYS 91 N -2.62 0.17 0.00 -1.24 2.10 -1.90 0.20 116.57 113.29 1l3n h LYS 91 Ca -0.61 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.03 1l3n h LYS 91 Cb 1.34 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.63 1l3n h LYS 91 CO 0.48 0.11 0.00 -0.25 -2.00 0.00 0.00 179.45 177.79 1l3n n ASP 92 N -4.39 0.00 0.00 7.07 8.00 -1.26 -4.58 116.55 121.39 1l3n n ASP 92 Ca 0.20 -0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.52 1l3n n ASP 92 Cb 0.90 -0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.74 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 1.04 0.68 3.59 0.44 0.00 0.71 -4.25 105.19 107.40 1l3n n GLY 93 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.53 4.06 -0.24 1.61 1.01 -1.25 -1.68 120.40 121.37 1l3n s VAL 94 Ca 0.00 0.99 -0.05 0.00 0.00 0.00 0.00 61.98 62.92 1l3n s VAL 94 Cb 0.00 -4.69 -0.01 0.00 0.00 0.00 0.00 36.38 31.68 1l3n s VAL 94 CO 0.00 -1.25 0.01 0.00 0.00 0.00 0.00 175.10 173.86 1l3n s ALA 95 N 4.84 2.94 -0.15 5.51 0.00 0.30 -0.46 121.76 134.73 1l3n s ALA 95 Ca 0.45 -1.24 -0.28 0.00 0.00 0.00 0.00 51.96 50.89 1l3n s ALA 95 Cb -0.07 -1.88 -0.01 0.00 0.00 0.00 0.00 23.12 21.16 1l3n s ALA 95 CO 0.27 -0.57 0.94 0.34 0.00 0.00 0.00 175.76 176.74 1l3n s ASP 96 N 1.50 7.11 -0.13 0.00 2.15 -1.26 -1.44 116.67 124.60 1l3n s ASP 96 Ca 0.05 1.37 -0.01 0.00 0.43 0.00 0.00 52.55 54.39 1l3n s ASP 96 Cb -0.15 -2.51 -0.02 0.00 -0.30 0.00 0.00 42.92 39.93 1l3n s ASP 96 CO -0.01 -0.46 -0.10 -0.69 -0.17 0.00 0.00 175.17 173.74 1l3n s VAL 97 N 2.24 3.34 -0.46 1.11 1.01 0.45 -4.67 120.40 123.41 1l3n s VAL 97 Ca 0.44 -0.56 0.07 0.00 0.00 0.00 0.00 61.98 61.93 1l3n s VAL 97 Cb -0.17 -2.42 0.28 0.00 0.00 0.00 0.00 36.38 34.07 1l3n s VAL 97 CO 0.14 0.52 0.92 -1.54 0.00 0.00 0.00 175.10 175.14 1l3n n SER 98 N 3.46 -2.04 -4.94 3.32 3.41 -1.24 -0.57 113.62 115.03 1l3n n SER 98 Ca -0.18 -3.37 -0.25 0.00 -0.26 0.00 0.00 58.87 54.81 1l3n n SER 98 Cb 0.53 1.40 -0.02 0.00 -0.26 0.00 0.00 64.21 65.85 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 0.06 5.18 -0.06 -1.33 1.09 -0.19 -4.93 121.20 121.02 1l3n s ILE 99 Ca 0.29 -0.49 -0.01 0.00 -1.10 0.00 0.00 60.65 59.34 1l3n s ILE 99 Cb 0.26 -3.79 0.03 0.00 -1.06 0.00 0.00 42.46 37.90 1l3n s ILE 99 CO -0.14 -0.30 0.00 -0.70 -0.10 0.00 0.00 174.94 173.69 1l3n s GLU 100 N -3.70 0.54 -0.16 2.79 2.12 -1.26 -0.02 118.70 119.00 1l3n s GLU 100 Ca 0.38 0.11 0.00 0.00 0.36 0.00 0.00 54.97 55.82 1l3n s GLU 100 Cb -0.10 -0.87 0.03 0.00 0.26 0.00 0.00 34.13 33.45 1l3n s GLU 100 CO 0.31 -0.27 -0.11 -0.51 -0.54 0.00 0.00 175.26 174.14 1l3n s ASP 101 N 1.80 2.85 -0.84 -1.70 1.01 -0.14 -4.96 116.67 114.68 1l3n s ASP 101 Ca 0.02 -0.61 -0.05 0.00 0.71 0.00 0.00 52.55 52.62 1l3n s ASP 101 Cb -0.13 -1.12 0.05 0.00 1.01 0.00 0.00 42.92 42.74 1l3n s ASP 101 CO -0.04 -0.11 2.69 -1.54 0.21 0.00 0.00 175.17 176.38 1l3n n SER 102 N 4.78 7.15 0.08 0.27 3.41 -1.26 -0.70 113.62 127.35 1l3n n SER 102 Ca -0.15 -3.09 0.00 0.00 -0.26 0.00 0.00 58.87 55.37 1l3n n SER 102 Cb 0.49 -1.32 0.00 0.00 -0.26 0.00 0.00 64.21 63.12 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 1.48 0.00 -1.70 -3.33 3.14 -1.26 -5.03 118.33 111.64 1l3n n VAL 103 Ca 0.56 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 61.55 1l3n n VAL 103 Cb 0.44 -0.10 0.05 0.00 -1.06 0.00 0.00 33.84 33.17 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 -2.85 3.93 -4.01 1.55 -0.00 -1.26 -4.79 119.36 111.93 1l3n n ILE 104 Ca 0.00 -0.50 -0.15 0.00 -0.00 0.00 0.00 62.75 62.10 1l3n n ILE 104 Cb 0.00 -1.48 -0.15 0.00 -0.00 0.00 0.00 39.64 38.01 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 -1.06 0.41 0.11 4.38 1.04 -1.26 -4.41 113.70 112.91 1l3n s SER 105 Ca 0.74 -0.05 -0.04 0.00 0.48 0.00 0.00 55.95 57.08 1l3n s SER 105 Cb -0.42 -0.12 -0.17 0.00 0.10 0.00 0.00 66.02 65.41 1l3n s SER 105 CO 0.47 -0.01 1.24 -0.07 0.98 0.00 0.00 173.24 175.85 1l3n h LEU 106 N 6.51 0.45 -7.23 2.42 3.38 -1.95 -0.03 115.31 118.86 1l3n h LEU 106 Ca -0.33 -0.42 -0.12 0.00 0.09 0.00 0.00 57.88 57.11 1l3n h LEU 106 Cb 1.17 -0.14 -0.26 0.00 0.09 0.00 0.00 40.66 41.52 1l3n h LEU 106 CO 0.49 1.26 -0.30 -0.44 0.09 0.00 0.00 178.44 179.55 1l3n s SER 107 N -7.10 -0.51 0.00 -0.43 0.01 -1.26 -4.44 113.70 99.98 1l3n s SER 107 Ca -0.05 0.88 0.00 0.00 1.31 0.00 0.00 55.95 58.09 1l3n s SER 107 Cb 0.08 0.77 0.00 0.00 0.21 0.00 0.00 66.02 67.08 1l3n s SER 107 CO 0.87 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.94 1l3n n GLY 108 N 4.18 -1.82 2.04 3.44 0.00 -1.26 -4.87 105.19 106.90 1l3n n GLY 108 Ca -0.23 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.38 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 -0.75 0.06 1.61 -0.08 -1.26 -4.92 116.55 111.21 1l3n n ASP 109 Ca 0.00 0.29 -0.15 0.00 -1.51 0.00 0.00 54.79 53.42 1l3n n ASP 109 Cb 0.00 0.86 -0.06 0.00 2.34 0.00 0.00 41.12 44.26 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 0.74 -6.53 -0.67 3.86 -1.87 -3.48 115.15 107.21 1l3n h HIS 110 Ca 0.00 -0.40 -0.49 0.00 -1.16 0.00 0.00 60.37 58.32 1l3n h HIS 110 Cb 0.00 -0.08 0.04 0.00 1.06 0.00 0.00 27.41 28.42 1l3n h HIS 110 CO 0.00 1.22 -0.96 0.45 0.86 0.00 0.00 177.93 179.51 1l3n n SER 111 N -3.78 -4.91 -1.11 2.45 2.88 -0.67 -4.75 113.62 103.73 1l3n n SER 111 Ca -0.08 -1.10 0.00 0.00 -1.33 0.00 0.00 58.87 56.36 1l3n n SER 111 Cb 0.85 -2.62 0.00 0.00 -0.75 0.00 0.00 64.21 61.69 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 -4.34 0.86 -2.76 2.46 -5.35 -0.11 -4.82 119.36 105.29 1l3n n ILE 112 Ca -0.11 -0.06 -0.42 0.00 -0.27 0.00 0.00 62.75 61.88 1l3n n ILE 112 Cb 0.58 -0.95 -0.03 0.00 -1.74 0.00 0.00 39.64 37.50 1l3n n ILE 112 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1l3n s ILE 113 N 0.32 4.80 0.00 7.28 -1.09 -1.26 -3.05 121.20 128.21 1l3n s ILE 113 Ca 0.00 1.88 0.00 0.00 -2.23 0.00 0.00 60.65 60.30 1l3n s ILE 113 Cb 0.00 -4.24 0.00 0.00 -1.58 0.00 0.00 42.46 36.64 1l3n s ILE 113 CO 0.00 -0.02 0.00 0.61 -1.23 0.00 0.00 174.94 174.30 1l3n n GLY 114 N 3.28 0.74 3.92 6.18 0.00 -1.00 -5.02 105.19 113.30 1l3n n GLY 114 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 1l3n n GLY 114 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1l3n s ARG 115 N -0.66 1.96 -0.01 1.61 3.00 -1.17 -3.95 118.95 119.74 1l3n s ARG 115 Ca 0.00 -0.20 0.08 0.00 0.00 0.00 0.00 55.73 55.61 1l3n s ARG 115 Cb 0.00 -2.08 -0.02 0.00 0.00 0.00 0.00 34.95 32.85 1l3n s ARG 115 CO 0.00 -1.46 -0.24 0.99 0.00 0.00 0.00 175.30 174.58 1l3n s THR 116 N -3.40 2.22 0.33 0.02 2.01 -1.09 -0.68 115.64 115.05 1l3n s THR 116 Ca 0.62 -1.10 0.09 0.00 0.31 0.00 0.00 61.69 61.61 1l3n s THR 116 Cb -0.10 -1.80 -0.05 0.00 0.01 0.00 0.00 72.50 70.57 1l3n s THR 116 CO 0.47 0.55 0.07 -0.76 -0.69 0.00 0.00 174.62 174.26 1l3n s LEU 117 N -0.73 3.15 -0.02 4.42 1.02 -0.03 0.31 118.68 126.80 1l3n s LEU 117 Ca 0.11 -0.83 -0.01 0.00 0.02 0.00 0.00 54.13 53.42 1l3n s LEU 117 Cb -0.10 -1.59 0.02 0.00 0.02 0.00 0.00 46.19 44.54 1l3n s LEU 117 CO -0.00 -0.23 0.04 -0.69 0.02 0.00 0.00 176.35 175.48 1l3n s VAL 118 N -2.44 -0.03 -0.14 -1.59 1.01 0.23 -1.57 120.40 115.87 1l3n s VAL 118 Ca 0.36 0.12 -0.12 0.00 0.00 0.00 0.00 61.98 62.34 1l3n s VAL 118 Cb -0.02 -0.08 -0.05 0.00 0.00 0.00 0.00 36.38 36.23 1l3n s VAL 118 CO 0.21 0.05 0.26 0.68 0.00 0.00 0.00 175.10 176.30 1l3n s VAL 119 N 0.64 5.32 0.24 2.92 -7.23 0.32 -2.33 120.40 120.28 1l3n s VAL 119 Ca -0.05 0.48 0.10 0.00 -1.81 0.00 0.00 61.98 60.69 1l3n s VAL 119 Cb -0.07 -3.58 -0.04 0.00 0.56 0.00 0.00 36.38 33.24 1l3n s VAL 119 CO -0.02 0.46 -0.05 -1.00 -0.31 0.00 0.00 175.10 174.18 1l3n s HIS 120 N 0.00 2.64 0.17 2.82 3.76 -0.50 -2.03 115.29 122.16 1l3n s HIS 120 Ca 0.16 -0.23 -0.14 0.00 -0.15 0.00 0.00 55.06 54.70 1l3n s HIS 120 Cb -0.13 -1.20 0.12 0.00 1.11 0.00 0.00 32.58 32.48 1l3n s HIS 120 CO 0.04 0.60 1.75 1.49 -0.85 0.00 0.00 174.74 177.77 1l3n h GLU 121 N 2.23 0.30 -6.12 1.40 4.22 -0.71 -3.21 114.58 112.69 1l3n h GLU 121 Ca -0.45 -0.02 -0.55 0.00 0.08 0.00 0.00 59.36 58.42 1l3n h GLU 121 Cb 1.24 -0.07 -0.09 0.00 0.50 0.00 0.00 28.75 30.33 1l3n h GLU 121 CO 0.59 0.20 -0.58 0.15 -2.18 0.00 0.00 179.01 177.18 1l3n s LYS 122 N -6.14 2.32 0.70 1.92 1.02 0.76 -4.82 119.74 115.50 1l3n s LYS 122 Ca -0.13 -1.52 -0.16 0.00 0.02 0.00 0.00 55.97 54.18 1l3n s LYS 122 Cb 0.14 -2.15 0.02 0.00 -0.52 0.00 0.00 37.83 35.32 1l3n s LYS 122 CO 0.72 0.20 1.23 0.00 -0.92 0.00 0.00 175.35 176.58 1l3n s ALA 123 N -2.40 2.19 0.47 5.17 0.00 -1.07 -0.04 121.76 126.08 1l3n s ALA 123 Ca 0.35 0.99 -0.19 0.00 0.00 0.00 0.00 51.96 53.11 1l3n s ALA 123 Cb -0.03 -3.50 -0.09 0.00 0.00 0.00 0.00 23.12 19.49 1l3n s ALA 123 CO 0.21 -1.79 0.98 -0.51 0.00 0.00 0.00 175.76 174.65 1l3n s ASP 124 N -1.82 6.71 0.16 0.00 1.11 -1.26 -4.26 116.67 117.31 1l3n s ASP 124 Ca 0.77 1.70 0.08 0.00 0.18 0.00 0.00 52.55 55.28 1l3n s ASP 124 Cb -0.32 -2.53 -0.10 0.00 1.07 0.00 0.00 42.92 41.04 1l3n s ASP 124 CO 0.43 -0.52 1.35 -0.78 1.18 0.00 0.00 175.17 176.83 1l3n h ASP 125 N 1.52 0.00 -4.46 0.27 1.82 -1.86 -3.48 116.42 110.24 1l3n h ASP 125 Ca -0.48 0.00 -0.40 0.00 -0.39 0.00 0.00 57.03 55.75 1l3n h ASP 125 Cb 1.19 0.00 0.04 0.00 0.68 0.00 0.00 39.33 41.24 1l3n h ASP 125 CO 0.61 0.90 -0.59 0.18 -1.61 0.00 0.00 179.24 178.72 1l3n n LEU 126 N -3.41 -2.48 0.00 2.28 4.77 -1.26 -2.66 117.00 114.25 1l3n n LEU 126 Ca -0.00 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.71 1l3n n LEU 126 Cb 0.87 -2.87 0.00 0.00 -2.33 0.00 0.00 43.42 39.09 1l3n n LEU 126 CO 0.46 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 1l3n n GLY 127 N -1.44 2.98 0.00 -0.72 0.00 -1.13 -4.39 105.19 100.48 1l3n n GLY 127 Ca -0.11 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.01 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 0.30 0.25 1.61 5.02 -1.09 -1.37 118.16 120.89 1l3n n LYS 128 Ca 0.00 0.08 0.08 0.00 -2.02 0.00 0.00 58.31 56.45 1l3n n LYS 128 Cb 0.00 -1.50 0.64 0.00 -0.02 0.00 0.00 35.03 34.15 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 3.69 0.00 -6.35 0.72 0.00 -1.91 -3.46 103.07 95.76 1l3n h GLY 129 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.85 1l3n h GLY 129 CO 0.00 0.00 -0.80 0.61 0.00 0.00 0.00 176.54 176.35 1l3n n GLY 130 N -1.28 -0.41 3.42 4.60 0.00 -0.47 -4.96 105.19 106.10 1l3n n GLY 130 Ca -0.03 0.16 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.67 2.33 0.20 1.61 2.20 -1.26 -4.98 114.94 111.37 1l3n s ASN 131 Ca 0.45 -1.31 -0.15 0.00 -0.94 0.00 0.00 52.86 50.91 1l3n s ASN 131 Cb -0.23 -0.08 0.19 0.00 -2.00 0.00 0.00 41.25 39.13 1l3n s ASN 131 CO 0.85 -0.54 1.63 -0.08 -2.94 0.00 0.00 177.10 176.02 1l3n h GLU 132 N 2.22 -0.01 0.13 3.55 4.22 -1.97 0.27 114.58 122.99 1l3n h GLU 132 Ca -0.40 0.00 0.02 0.00 0.08 0.00 0.00 59.36 59.06 1l3n h GLU 132 Cb 1.24 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 1l3n h GLU 132 CO 0.68 -0.01 -0.24 0.93 -2.18 0.00 0.00 179.01 178.19 1l3n h GLU 133 N -0.01 -0.43 -0.76 1.92 3.07 -1.97 -3.09 114.58 113.30 1l3n h GLU 133 Ca 0.27 0.03 0.16 0.00 -0.50 0.00 0.00 59.36 59.32 1l3n h GLU 133 Cb 0.43 0.10 -0.11 0.00 -0.84 0.00 0.00 28.75 28.33 1l3n h GLU 133 CO -0.59 -0.29 0.24 0.66 -1.40 0.00 0.00 179.01 177.63 1l3n h SER 134 N -0.45 0.13 0.15 1.42 4.64 -0.40 0.18 113.55 119.22 1l3n h SER 134 Ca 0.03 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1l3n h SER 134 Cb 0.47 0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 1l3n h SER 134 CO -0.13 0.01 -0.01 1.07 -0.87 0.00 0.00 176.83 176.90 1l3n n THR 135 N -5.10 0.00 -0.05 2.95 5.66 -0.68 -1.00 114.28 116.06 1l3n n THR 135 Ca 0.15 -0.02 -0.11 0.00 -3.05 0.00 0.00 64.05 61.02 1l3n n THR 135 Cb 0.47 -0.39 -0.04 0.00 -1.55 0.00 0.00 70.33 68.83 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 -0.97 0.22 -0.34 1.09 5.02 0.44 -2.63 118.16 120.99 1l3n n LYS 136 Ca 0.21 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.59 1l3n n LYS 136 Cb 0.17 -0.86 0.00 0.00 -0.02 0.00 0.00 35.03 34.32 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 -3.47 0.07 0.00 -0.18 -2.24 -0.12 -3.25 114.28 105.10 1l3n n THR 137 Ca -0.20 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 1l3n n THR 137 Cb 0.63 0.61 0.00 0.00 -2.10 0.00 0.00 70.33 69.47 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 -0.05 2.48 2.45 3.38 0.00 -0.17 -3.47 105.19 109.81 1l3n n GLY 138 Ca 0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 46.02 45.83 1l3n n GLY 138 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1l3n n ASN 139 N 9.60 -1.21 0.00 1.61 3.02 -1.26 -2.07 115.26 124.95 1l3n n ASN 139 Ca 0.00 -2.00 0.11 0.00 -0.03 0.00 0.00 54.58 52.67 1l3n n ASN 139 Cb 0.00 0.58 0.59 0.00 -0.61 0.00 0.00 39.78 40.34 1l3n n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1l3n n ALA 140 N -1.23 2.20 -0.16 5.41 0.00 -1.23 -4.76 120.51 120.73 1l3n n ALA 140 Ca -0.14 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1l3n n ALA 140 Cb 0.81 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.89 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 0.58 -1.45 3.65 0.00 0.00 -1.26 -0.17 105.19 106.54 1l3n n GLY 141 Ca 0.12 -1.29 -0.47 0.00 0.00 0.00 0.00 46.02 44.39 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 -0.13 2.72 -3.91 1.61 7.64 -1.26 -4.42 113.62 115.87 1l3n n SER 142 Ca 0.00 1.11 -0.36 0.00 1.01 0.00 0.00 58.87 60.62 1l3n n SER 142 Cb 0.00 -1.38 -0.09 0.00 -1.01 0.00 0.00 64.21 61.73 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 2.87 0.76 -0.28 1.43 1.74 -1.26 -0.39 116.66 121.52 1l3n n ARG 143 Ca 0.16 -1.64 0.20 0.00 -0.77 0.00 0.00 57.85 55.80 1l3n n ARG 143 Cb 0.28 -3.09 0.50 0.00 -1.02 0.00 0.00 32.46 29.12 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 17.47 0.44 -7.40 0.55 3.38 -1.73 -3.43 115.31 124.60 1l3n h LEU 144 Ca 0.26 0.06 -0.09 0.00 0.09 0.00 0.00 57.88 58.20 1l3n h LEU 144 Cb 0.78 -0.02 -0.18 0.00 0.09 0.00 0.00 40.66 41.33 1l3n h LEU 144 CO 1.70 0.15 -0.14 0.00 0.09 0.00 0.00 178.44 180.24 1l3n s ALA 145 N -5.47 -0.98 0.06 1.53 0.00 -1.02 -0.28 121.76 115.59 1l3n s ALA 145 Ca -0.09 0.37 -0.13 0.00 0.00 0.00 0.00 51.96 52.11 1l3n s ALA 145 Cb 0.24 0.24 0.02 0.00 0.00 0.00 0.00 23.12 23.62 1l3n s ALA 145 CO 0.79 -0.39 0.30 0.00 0.00 0.00 0.00 175.76 176.46 1l3n s GLY 147 N -2.31 -0.36 -0.11 0.00 0.00 -0.61 -1.43 107.32 102.51 1l3n s GLY 147 Ca -0.02 0.52 -0.05 0.00 0.00 0.00 0.00 44.72 45.17 1l3n s GLY 147 CO -0.06 0.24 0.08 0.14 0.00 0.00 0.00 173.10 173.50 1l3n s VAL 148 N -2.26 5.01 -0.41 1.40 1.01 -1.26 -0.85 120.40 123.04 1l3n s VAL 148 Ca -0.06 0.02 -0.29 0.00 0.00 0.00 0.00 61.98 61.65 1l3n s VAL 148 Cb -0.01 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.22 1l3n s VAL 148 CO -0.01 0.61 1.41 -0.63 0.00 0.00 0.00 175.10 176.49 1l3n s ILE 149 N -0.95 3.91 -0.06 2.22 1.01 0.15 -4.60 121.20 122.86 1l3n s ILE 149 Ca 0.14 0.93 -0.02 0.00 0.00 0.00 0.00 60.65 61.70 1l3n s ILE 149 Cb -0.12 -4.19 -0.04 0.00 0.01 0.00 0.00 42.46 38.12 1l3n s ILE 149 CO 0.03 -0.74 0.06 -0.83 0.00 0.00 0.00 174.94 173.46 1l3n s GLY 150 N 3.92 1.97 0.51 6.18 0.00 -0.71 -2.37 107.32 116.81 1l3n s GLY 150 Ca 0.61 -0.80 -0.22 0.00 0.00 0.00 0.00 44.72 44.31 1l3n s GLY 150 CO 0.32 -0.59 1.27 -0.42 0.00 0.00 0.00 173.10 173.68 1l3n s ILE 151 N -1.02 2.55 0.17 0.90 1.01 -1.26 -0.89 121.20 122.65 1l3n s ILE 151 Ca 0.17 0.41 -0.09 0.00 0.00 0.00 0.00 60.65 61.14 1l3n s ILE 151 Cb -0.12 -3.21 -0.01 0.00 0.01 0.00 0.00 42.46 39.14 1l3n s ILE 151 CO 0.07 -0.01 0.29 0.00 0.00 0.00 0.00 174.94 175.29 1l3n s ALA 152 N -1.41 0.02 0.00 9.38 0.00 0.31 -4.78 121.76 125.28 1l3n s ALA 152 Ca 0.68 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.73 1l3n s ALA 152 Cb -0.35 0.88 0.00 0.00 0.00 0.00 0.00 23.12 23.65 1l3n s ALA 152 CO 0.42 -0.65 0.22 0.94 0.00 0.00 0.00 175.76 176.68