#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 -3.96 0.00 5.66 -1.26 -4.87 114.28 109.85 1l3n n THR 2 Ca 0.00 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.85 1l3n n THR 2 Cb 0.00 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 68.63 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 -0.78 0.25 0.22 1.09 2.20 -1.26 -0.29 119.74 121.16 1l3n s LYS 3 Ca 0.00 0.00 -0.13 0.00 -0.36 0.00 0.00 55.97 55.49 1l3n s LYS 3 Cb 0.00 -0.34 0.00 0.00 -1.51 0.00 0.00 37.83 35.98 1l3n s LYS 3 CO 0.00 -0.05 0.44 0.00 -0.36 0.00 0.00 175.35 175.38 1l3n s ALA 4 N 0.53 -0.31 0.26 3.13 0.00 -0.18 -0.66 121.76 124.53 1l3n s ALA 4 Ca -0.05 -0.76 0.06 0.00 0.00 0.00 0.00 51.96 51.21 1l3n s ALA 4 Cb -0.08 0.98 -0.05 0.00 0.00 0.00 0.00 23.12 23.97 1l3n s ALA 4 CO -0.01 -0.80 -0.06 0.14 0.00 0.00 0.00 175.76 175.03 1l3n s VAL 5 N -3.98 1.54 -0.17 0.00 -7.23 0.38 -0.30 120.40 110.64 1l3n s VAL 5 Ca 0.19 -2.12 -0.02 0.00 -1.81 0.00 0.00 61.98 58.22 1l3n s VAL 5 Cb 0.00 -2.36 0.05 0.00 0.56 0.00 0.00 36.38 34.63 1l3n s VAL 5 CO 0.05 -0.35 0.02 0.00 -0.31 0.00 0.00 175.10 174.50 1l3n s ALA 6 N -3.08 1.05 -0.53 1.32 0.00 0.30 -1.01 121.76 119.80 1l3n s ALA 6 Ca 0.28 -0.64 -0.18 0.00 0.00 0.00 0.00 51.96 51.42 1l3n s ALA 6 Cb 0.03 -1.11 0.08 0.00 0.00 0.00 0.00 23.12 22.13 1l3n s ALA 6 CO 0.10 -1.01 0.60 0.14 0.00 0.00 0.00 175.76 175.59 1l3n s VAL 7 N 1.83 4.95 -0.50 0.00 -7.23 -1.26 -1.22 120.40 116.97 1l3n s VAL 7 Ca 0.00 -0.85 -0.23 0.00 -1.81 0.00 0.00 61.98 59.09 1l3n s VAL 7 Cb -0.16 -4.34 0.04 0.00 0.56 0.00 0.00 36.38 32.48 1l3n s VAL 7 CO -0.07 -0.88 0.85 -0.76 -0.31 0.00 0.00 175.10 173.93 1l3n s LEU 8 N 2.39 4.23 0.12 1.32 1.43 0.82 -3.93 118.68 125.06 1l3n s LEU 8 Ca 0.11 -0.26 0.03 0.00 -1.03 0.00 0.00 54.13 52.98 1l3n s LEU 8 Cb -0.23 -2.88 -0.04 0.00 0.03 0.00 0.00 46.19 43.07 1l3n s LEU 8 CO 0.08 -1.06 -0.09 -0.54 0.23 0.00 0.00 176.35 174.98 1l3n s LYS 9 N 3.55 0.93 0.04 1.70 1.02 -0.12 -0.11 119.74 126.76 1l3n s LYS 9 Ca 0.29 -1.33 0.00 0.00 0.02 0.00 0.00 55.97 54.95 1l3n s LYS 9 Cb -0.13 -0.47 0.00 0.00 -0.52 0.00 0.00 37.83 36.71 1l3n s LYS 9 CO 0.21 0.05 0.00 0.41 -0.92 0.00 0.00 175.35 175.10 1l3n n GLY 10 N 0.06 -1.89 0.23 -3.33 0.00 -1.24 -0.88 105.19 98.15 1l3n n GLY 10 Ca -0.12 0.50 -0.15 0.00 0.00 0.00 0.00 46.02 46.25 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 0.93 0.00 1.61 3.32 -1.52 -3.49 116.42 117.27 1l3n h ASP 11 Ca 0.00 -0.55 0.00 0.00 0.02 0.00 0.00 57.03 56.50 1l3n h ASP 11 Cb 0.00 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.28 1l3n h ASP 11 CO 0.00 1.35 0.00 0.61 -1.72 0.00 0.00 179.24 179.48 1l3n n GLY 12 N 0.52 2.95 0.37 2.75 0.00 -1.26 -4.95 105.19 105.57 1l3n n GLY 12 Ca -0.06 -0.46 -0.02 0.00 0.00 0.00 0.00 46.02 45.48 1l3n n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1l3n h PRO 13 N 0.00 1.26 -6.29 1.61 0.13 -1.93 -3.38 132.00 123.40 1l3n h PRO 13 Ca 0.00 -0.10 -0.56 0.00 -0.87 0.00 0.00 66.00 64.46 1l3n h PRO 13 Cb 0.00 -0.27 -0.03 0.00 0.13 0.00 0.00 31.00 30.83 1l3n h PRO 13 CO 0.00 0.87 1.09 0.54 -0.23 0.00 0.00 178.00 180.27 1l3n s VAL 14 N -5.97 3.78 -0.29 1.56 0.11 -1.23 -4.06 120.40 114.30 1l3n s VAL 14 Ca -0.13 0.88 0.01 0.00 -2.93 0.00 0.00 61.98 59.81 1l3n s VAL 14 Cb 0.18 -3.77 0.08 0.00 -1.53 0.00 0.00 36.38 31.34 1l3n s VAL 14 CO 0.82 -0.31 0.03 0.00 -3.33 0.00 0.00 175.10 172.31 1l3n s GLN 15 N 4.53 1.22 0.20 1.54 -2.07 0.26 -4.19 119.66 121.15 1l3n s GLN 15 Ca 0.69 -1.22 -0.16 0.00 -1.82 0.00 0.00 55.36 52.85 1l3n s GLN 15 Cb -0.24 -2.52 -0.08 0.00 -1.09 0.00 0.00 33.01 29.09 1l3n s GLN 15 CO 0.28 -0.82 0.63 0.20 -1.32 0.00 0.00 175.29 174.25 1l3n s GLY 16 N 1.37 2.48 -0.43 2.60 0.00 0.85 -1.72 107.32 112.47 1l3n s GLY 16 Ca 0.04 -0.03 0.06 0.00 0.00 0.00 0.00 44.72 44.79 1l3n s GLY 16 CO -0.13 0.25 0.52 1.39 0.00 0.00 0.00 173.10 175.13 1l3n n ILE 17 N 0.57 -0.73 -3.08 0.90 5.41 -1.25 -0.13 119.36 121.05 1l3n n ILE 17 Ca -0.03 -3.12 -0.40 0.00 1.00 0.00 0.00 62.75 60.21 1l3n n ILE 17 Cb 0.52 -1.06 -0.05 0.00 -0.71 0.00 0.00 39.64 38.33 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 -0.24 5.05 -0.38 1.39 -1.09 -0.36 -3.54 121.20 122.03 1l3n s ILE 18 Ca 0.33 1.36 -0.14 0.00 -2.23 0.00 0.00 60.65 59.97 1l3n s ILE 18 Cb 0.11 -4.01 0.01 0.00 -1.58 0.00 0.00 42.46 36.99 1l3n s ILE 18 CO -0.15 0.23 0.29 0.20 -1.23 0.00 0.00 174.94 174.28 1l3n s ASN 19 N 0.84 6.10 -0.38 3.58 0.01 0.73 -0.54 114.94 125.29 1l3n s ASN 19 Ca 0.35 -0.68 -0.23 0.00 -0.71 0.00 0.00 52.86 51.59 1l3n s ASN 19 Cb -0.17 -2.16 0.01 0.00 0.41 0.00 0.00 41.25 39.34 1l3n s ASN 19 CO 0.16 -0.38 0.77 -0.36 -1.51 0.00 0.00 177.10 175.77 1l3n s PHE 20 N 1.75 3.09 -0.24 2.20 0.40 0.59 -1.55 117.98 124.22 1l3n s PHE 20 Ca 0.06 0.44 0.02 0.00 -0.60 0.00 0.00 56.93 56.85 1l3n s PHE 20 Cb -0.18 -3.43 0.05 0.00 0.51 0.00 0.00 43.02 39.97 1l3n s PHE 20 CO 0.11 -0.78 -0.11 -2.00 0.70 0.00 0.00 175.22 173.14 1l3n s GLU 21 N 3.10 2.20 -0.79 0.44 2.12 -0.03 -1.01 118.70 124.73 1l3n s GLU 21 Ca 0.30 -1.20 -0.15 0.00 0.36 0.00 0.00 54.97 54.29 1l3n s GLU 21 Cb -0.13 -2.77 0.20 0.00 0.26 0.00 0.00 34.13 31.69 1l3n s GLU 21 CO 0.18 -0.53 0.74 -1.14 -0.54 0.00 0.00 175.26 173.98 1l3n s GLN 22 N 1.19 3.52 0.36 4.30 0.74 0.60 -0.74 119.66 129.63 1l3n s GLN 22 Ca -0.06 -2.32 0.08 0.00 0.05 0.00 0.00 55.36 53.10 1l3n s GLN 22 Cb -0.19 -4.43 0.79 0.00 1.10 0.00 0.00 33.01 30.29 1l3n s GLN 22 CO -0.06 -1.32 1.91 1.57 -0.55 0.00 0.00 175.29 176.84 1l3n h LYS 23 N 7.99 0.69 -4.72 1.67 2.10 -1.78 -3.42 116.57 119.09 1l3n h LYS 23 Ca 0.05 -0.04 -0.31 0.00 -2.00 0.00 0.00 60.65 58.35 1l3n h LYS 23 Cb 1.05 -0.16 -0.15 0.00 -0.90 0.00 0.00 32.23 32.08 1l3n h LYS 23 CO 0.81 0.46 -0.60 -2.00 -2.00 0.00 0.00 179.45 176.11 1l3n s GLU 24 N -5.67 1.34 0.53 0.07 -6.30 -1.26 -4.99 118.70 102.42 1l3n s GLU 24 Ca -0.10 -1.73 0.28 0.00 -2.50 0.00 0.00 54.97 50.92 1l3n s GLU 24 Cb 0.21 0.09 1.46 0.00 0.00 0.00 0.00 34.13 35.89 1l3n s GLU 24 CO 0.78 -0.39 2.08 0.66 0.02 0.00 0.00 175.26 178.41 1l3n h SER 25 N 2.47 0.00 1.78 -1.70 4.64 -1.93 -0.15 113.55 118.67 1l3n h SER 25 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 1l3n h SER 25 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1l3n h SER 25 CO 0.54 0.11 -0.15 0.78 -0.87 0.00 0.00 176.83 177.24 1l3n h ASN 26 N 0.00 0.00 -4.03 4.97 2.35 -1.95 -3.47 115.58 113.45 1l3n h ASN 26 Ca -0.00 -0.01 -0.48 0.00 -0.55 0.00 0.00 56.30 55.26 1l3n h ASN 26 Cb 0.33 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.71 1l3n h ASN 26 CO 0.01 0.00 0.29 -0.83 -1.65 0.00 0.00 177.43 175.26 1l3n s GLY 27 N -4.15 2.03 0.49 2.83 0.00 -0.07 -5.05 107.32 103.41 1l3n s GLY 27 Ca 0.06 0.06 -0.22 0.00 0.00 0.00 0.00 44.72 44.62 1l3n s GLY 27 CO 0.68 0.31 1.21 2.56 0.00 0.00 0.00 173.10 177.86 1l3n s PRO 28 N -3.98 3.54 -0.48 2.90 0.04 -1.26 -4.78 135.00 130.98 1l3n s PRO 28 Ca 0.56 1.88 -0.29 0.00 0.04 0.00 0.00 61.00 63.19 1l3n s PRO 28 Cb -0.10 -2.32 0.03 0.00 0.04 0.00 0.00 34.50 32.15 1l3n s PRO 28 CO 0.31 -0.76 1.13 0.54 0.04 0.00 0.00 177.00 178.26 1l3n s VAL 29 N -1.50 4.22 -0.33 -0.36 0.11 -0.42 -4.37 120.40 117.75 1l3n s VAL 29 Ca 0.67 1.20 -0.25 0.00 -2.93 0.00 0.00 61.98 60.66 1l3n s VAL 29 Cb -0.31 -4.60 0.01 0.00 -1.53 0.00 0.00 36.38 29.95 1l3n s VAL 29 CO 0.37 -1.01 0.90 -0.75 -3.33 0.00 0.00 175.10 171.29 1l3n s LYS 30 N 4.42 3.93 -1.01 1.54 2.20 0.08 -0.89 119.74 130.01 1l3n s LYS 30 Ca 0.47 0.68 -0.02 0.00 -0.36 0.00 0.00 55.97 56.75 1l3n s LYS 30 Cb -0.07 -3.76 0.29 0.00 -1.51 0.00 0.00 37.83 32.78 1l3n s LYS 30 CO 0.32 -0.83 1.97 1.33 -0.36 0.00 0.00 175.35 177.77 1l3n n VAL 31 N 5.77 5.48 -2.67 4.02 0.24 0.07 -0.85 118.33 130.39 1l3n n VAL 31 Ca 0.07 -5.39 -0.37 0.00 -2.04 0.00 0.00 64.34 56.61 1l3n n VAL 31 Cb 0.48 -1.56 -0.05 0.00 -1.47 0.00 0.00 33.84 31.23 1l3n n VAL 31 CO 0.00 0.00 0.00 -1.66 -2.14 0.00 0.00 176.83 173.03 1l3n s TRP 32 N -3.81 3.51 -0.02 6.34 -2.14 -0.59 -4.36 118.94 117.86 1l3n s TRP 32 Ca 0.44 1.72 -0.30 0.00 2.66 0.00 0.00 56.10 60.62 1l3n s TRP 32 Cb 0.24 -3.02 0.12 0.00 -3.10 0.00 0.00 33.47 27.70 1l3n s TRP 32 CO -0.18 -0.17 1.29 0.20 -2.66 0.00 0.00 176.95 175.43 1l3n s GLY 33 N -1.56 -0.35 -0.24 3.67 0.00 0.46 -0.19 107.32 109.10 1l3n s GLY 33 Ca 0.53 0.56 -0.00 0.00 0.00 0.00 0.00 44.72 45.81 1l3n s GLY 33 CO 0.26 1.25 -0.00 -0.45 0.00 0.00 0.00 173.10 174.15 1l3n s SER 34 N -3.15 3.69 0.25 1.64 0.15 -1.23 -0.59 113.70 114.46 1l3n s SER 34 Ca 0.17 -1.21 -0.26 0.00 0.70 0.00 0.00 55.95 55.35 1l3n s SER 34 Cb 0.04 -1.01 -0.09 0.00 -1.71 0.00 0.00 66.02 63.25 1l3n s SER 34 CO -0.03 -0.29 0.87 0.27 1.20 0.00 0.00 173.24 175.26 1l3n s ILE 35 N 1.52 4.26 -0.03 6.45 -4.36 -0.25 -3.99 121.20 124.79 1l3n s ILE 35 Ca -0.01 1.79 0.04 0.00 -0.26 0.00 0.00 60.65 62.21 1l3n s ILE 35 Cb -0.18 -4.11 -0.01 0.00 1.25 0.00 0.00 42.46 39.42 1l3n s ILE 35 CO -0.10 0.34 -0.16 -1.59 0.24 0.00 0.00 174.94 173.67 1l3n s LYS 36 N -1.59 1.53 0.00 0.37 -2.85 -0.70 -0.59 119.74 115.91 1l3n s LYS 36 Ca 0.43 -0.57 0.00 0.00 -1.00 0.00 0.00 55.97 54.83 1l3n s LYS 36 Cb -0.21 -1.39 0.00 0.00 -2.06 0.00 0.00 37.83 34.17 1l3n s LYS 36 CO 0.26 0.27 0.00 0.41 0.10 0.00 0.00 175.35 176.39 1l3n n GLY 37 N 2.99 0.81 3.43 0.59 0.00 -0.76 -0.57 105.19 111.68 1l3n n GLY 37 Ca -0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.56 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 0.01 0.32 0.99 2.01 -1.00 -3.51 118.68 117.51 1l3n s LEU 38 Ca 0.00 1.14 0.07 0.00 0.01 0.00 0.00 54.13 55.35 1l3n s LEU 38 Cb 0.00 -2.84 -0.02 0.00 0.01 0.00 0.00 46.19 43.34 1l3n s LEU 38 CO 0.00 -4.65 0.35 0.28 1.01 0.00 0.00 176.35 173.34 1l3n s THR 39 N -2.46 3.89 1.00 5.49 -1.32 -1.26 -3.72 115.64 117.26 1l3n s THR 39 Ca 0.69 -1.22 -0.13 0.00 -1.21 0.00 0.00 61.69 59.81 1l3n s THR 39 Cb -0.19 -3.32 0.10 0.00 -1.51 0.00 0.00 72.50 67.58 1l3n s THR 39 CO 0.61 -0.19 0.53 1.21 -2.21 0.00 0.00 174.62 174.57 1l3n n GLU 40 N -1.46 -0.82 0.00 7.08 0.00 -1.26 -4.59 120.64 119.59 1l3n n GLU 40 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 57.16 56.94 1l3n n GLU 40 Cb 0.59 -1.96 0.00 0.00 0.00 0.00 0.00 31.44 30.07 1l3n n GLU 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1l3n n GLY 41 N 1.31 -3.39 3.77 8.31 0.00 -0.73 -4.76 105.19 109.69 1l3n n GLY 41 Ca 0.06 -1.85 -0.40 0.00 0.00 0.00 0.00 46.02 43.84 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 4.26 -0.03 0.99 1.43 -1.26 -0.85 118.68 123.22 1l3n s LEU 42 Ca 0.00 2.63 0.00 0.00 -1.03 0.00 0.00 54.13 55.73 1l3n s LEU 42 Cb 0.00 -3.86 0.03 0.00 0.03 0.00 0.00 46.19 42.39 1l3n s LEU 42 CO 0.00 -0.76 0.01 -1.00 0.23 0.00 0.00 176.35 174.83 1l3n s HIS 43 N -1.25 0.29 0.00 0.29 3.76 0.53 -2.70 115.29 116.21 1l3n s HIS 43 Ca 0.55 0.02 0.00 0.00 -0.15 0.00 0.00 55.06 55.48 1l3n s HIS 43 Cb -0.38 -0.41 0.00 0.00 1.11 0.00 0.00 32.58 32.90 1l3n s HIS 43 CO 0.49 -0.14 0.00 0.41 -0.85 0.00 0.00 174.74 174.65 1l3n n GLY 44 N 4.25 0.00 2.60 -2.22 0.00 0.18 -0.78 105.19 109.22 1l3n n GLY 44 Ca -0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.48 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 0.00 0.71 0.26 1.61 5.36 0.47 -0.86 117.98 125.53 1l3n s PHE 45 Ca 0.00 -1.11 -0.18 0.00 -0.96 0.00 0.00 56.93 54.68 1l3n s PHE 45 Cb 0.00 -1.13 0.01 0.00 -0.34 0.00 0.00 43.02 41.56 1l3n s PHE 45 CO 0.00 -0.84 0.62 -1.01 -1.46 0.00 0.00 175.22 172.53 1l3n s HIS 46 N 1.96 0.02 -0.04 10.12 0.09 -1.14 -0.94 115.29 125.37 1l3n s HIS 46 Ca 0.09 -0.44 -0.10 0.00 -0.00 0.00 0.00 55.06 54.61 1l3n s HIS 46 Cb -0.16 0.50 -0.05 0.00 -0.00 0.00 0.00 32.58 32.87 1l3n s HIS 46 CO -0.33 -1.14 0.27 0.08 -0.00 0.00 0.00 174.74 173.62 1l3n s VAL 47 N -3.96 5.27 0.39 -0.90 1.01 0.12 -1.49 120.40 120.84 1l3n s VAL 47 Ca 0.15 0.44 0.08 0.00 0.00 0.00 0.00 61.98 62.65 1l3n s VAL 47 Cb -0.04 -3.56 -0.06 0.00 0.00 0.00 0.00 36.38 32.72 1l3n s VAL 47 CO 0.08 0.54 0.08 -1.00 0.00 0.00 0.00 175.10 174.80 1l3n s HIS 48 N -1.12 2.56 0.00 5.22 3.76 -0.07 -4.66 115.29 120.98 1l3n s HIS 48 Ca 0.21 -0.57 0.00 0.00 -0.15 0.00 0.00 55.06 54.55 1l3n s HIS 48 Cb -0.14 -1.78 0.00 0.00 1.11 0.00 0.00 32.58 31.77 1l3n s HIS 48 CO 0.10 0.34 0.56 -1.91 -0.85 0.00 0.00 174.74 172.98 1l3n n GLU 49 N -1.08 0.00 -2.88 1.40 2.13 -1.21 -4.38 120.64 114.62 1l3n n GLU 49 Ca -0.03 0.37 -0.40 0.00 0.66 0.00 0.00 57.16 57.76 1l3n n GLU 49 Cb 0.65 -1.19 -0.05 0.00 0.27 0.00 0.00 31.44 31.11 1l3n n GLU 49 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 1l3n s PHE 50 N -1.86 3.85 0.35 4.31 0.08 0.65 -4.60 117.98 120.75 1l3n s PHE 50 Ca 0.00 1.68 0.09 0.00 0.12 0.00 0.00 56.93 58.82 1l3n s PHE 50 Cb 0.00 -2.89 0.65 0.00 -0.57 0.00 0.00 43.02 40.21 1l3n s PHE 50 CO 0.00 0.35 1.81 0.78 -0.10 0.00 0.00 175.22 178.07 1l3n h GLY 51 N 5.02 0.18 -3.00 4.36 0.00 -1.81 -3.34 103.07 104.48 1l3n h GLY 51 Ca -0.45 -0.14 -0.56 0.00 0.00 0.00 0.00 47.33 46.18 1l3n h GLY 51 CO 0.69 0.13 -1.05 2.09 0.00 0.00 0.00 176.54 178.41 1l3n n ASP 52 N -4.13 -3.37 -0.27 0.19 5.68 -1.26 -4.62 116.55 108.76 1l3n n ASP 52 Ca -0.01 0.46 0.00 0.00 -0.50 0.00 0.00 54.79 54.73 1l3n n ASP 52 Cb 0.38 -0.99 0.00 0.00 -1.14 0.00 0.00 41.12 39.38 1l3n n ASP 52 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1l3n n ASN 53 N 1.44 0.00 -0.28 -1.12 5.03 -1.26 -3.14 115.26 115.93 1l3n n ASN 53 Ca 0.06 -1.26 0.04 0.00 0.87 0.00 0.00 54.58 54.28 1l3n n ASN 53 Cb 0.51 -0.05 0.18 0.00 -1.02 0.00 0.00 39.78 39.40 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 4.60 0.81 0.00 3.41 2.02 -1.98 0.18 112.91 121.96 1l3n h THR 54 Ca 0.00 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.96 1l3n h THR 54 Cb 1.11 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 1l3n h THR 54 CO 0.00 0.12 0.00 0.00 0.37 0.00 0.00 175.52 176.01 1l3n h ALA 55 N 1.49 1.00 0.00 6.16 0.00 -2.00 -3.47 119.26 122.44 1l3n h ALA 55 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1l3n h ALA 55 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1l3n h ALA 55 CO -0.30 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.36 1l3n n GLY 56 N 1.13 0.51 2.62 0.00 0.00 0.63 -4.80 105.19 105.28 1l3n n GLY 56 Ca 0.04 -0.81 -0.17 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.38 1.47 -0.29 0.00 -2.24 -1.26 -4.36 114.28 105.22 1l3n n THR 58 Ca -0.17 0.10 0.24 0.00 -2.27 0.00 0.00 64.05 61.95 1l3n n THR 58 Cb 0.62 -2.28 0.57 0.00 -2.10 0.00 0.00 70.33 67.14 1l3n n THR 58 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1l3n h SER 59 N -1.00 0.33 -0.57 3.42 0.02 -1.86 -0.33 113.55 113.55 1l3n h SER 59 Ca -0.12 0.05 0.23 0.00 -0.84 0.00 0.00 61.79 61.11 1l3n h SER 59 Cb 0.87 -0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.32 1l3n h SER 59 CO -0.07 0.09 0.32 0.00 -1.14 0.00 0.00 176.83 176.02 1l3n n ALA 60 N -2.55 0.58 0.00 3.77 0.00 -1.19 -4.71 120.51 116.41 1l3n n ALA 60 Ca 0.23 0.52 0.00 0.00 0.00 0.00 0.00 53.44 54.19 1l3n n ALA 60 Cb 0.89 -0.54 0.00 0.00 0.00 0.00 0.00 19.45 19.79 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 -1.16 1.90 0.00 0.00 0.00 -0.14 -0.25 105.19 105.54 1l3n n GLY 61 Ca 0.20 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.45 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 1.77 0.08 -1.41 1.61 -0.04 -1.26 -4.54 135.00 131.20 1l3n n PRO 62 Ca 0.00 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.06 1l3n n PRO 62 Cb 0.00 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.44 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 -1.42 2.71 -1.32 0.54 8.25 -1.26 -3.32 115.22 119.40 1l3n n HIS 63 Ca 0.00 -3.05 -0.39 0.00 -0.26 0.00 0.00 57.72 54.02 1l3n n HIS 63 Cb 0.00 -2.50 -0.03 0.00 1.12 0.00 0.00 29.99 28.58 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 4.29 2.47 -2.06 4.41 3.72 -1.26 -4.91 117.46 124.11 1l3n n PHE 64 Ca 0.71 -2.42 -0.33 0.00 -0.05 0.00 0.00 57.45 55.36 1l3n n PHE 64 Cb 0.27 -2.11 0.01 0.00 -0.94 0.00 0.00 39.48 36.72 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 3.76 5.68 0.13 4.37 2.20 -1.26 -4.63 114.94 125.18 1l3n s ASN 65 Ca 0.53 1.92 -0.12 0.00 -0.94 0.00 0.00 52.86 54.25 1l3n s ASN 65 Cb 0.14 -2.55 -0.08 0.00 -2.00 0.00 0.00 41.25 36.77 1l3n s ASN 65 CO -0.00 -1.24 1.42 1.55 -2.94 0.00 0.00 177.10 175.89 1l3n h PRO 66 N 0.57 0.89 -2.09 3.55 0.13 -1.93 -3.30 132.00 129.82 1l3n h PRO 66 Ca -0.48 -0.54 -0.16 0.00 -0.87 0.00 0.00 66.00 63.96 1l3n h PRO 66 Cb 1.23 0.05 -0.06 0.00 0.13 0.00 0.00 31.00 32.36 1l3n h PRO 66 CO 0.57 1.18 -0.28 1.28 -0.23 0.00 0.00 178.00 180.51 1l3n n LEU 67 N -4.04 4.75 -4.55 1.56 4.77 -1.26 -4.92 117.00 113.31 1l3n n LEU 67 Ca -0.04 -2.86 -0.42 0.00 -0.03 0.00 0.00 56.01 52.65 1l3n n LEU 67 Cb 0.60 -1.26 -0.04 0.00 -2.33 0.00 0.00 43.42 40.38 1l3n n LEU 67 CO 0.50 1.44 1.92 -1.54 -1.33 0.00 0.00 177.39 178.38 1l3n n SER 68 N 2.47 2.60 0.00 -1.43 3.41 -1.25 -4.69 113.62 114.73 1l3n n SER 68 Ca 0.36 0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.99 1l3n n SER 68 Cb 0.80 -1.48 0.00 0.00 -0.26 0.00 0.00 64.21 63.28 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 8.71 0.00 -4.02 4.33 1.74 -1.26 -5.14 116.66 121.03 1l3n n ARG 69 Ca 0.36 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.36 1l3n n ARG 69 Cb 0.41 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.75 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 0.50 -0.10 5.56 -0.14 0.13 -5.06 119.74 120.63 1l3n s LYS 70 Ca 0.00 -0.91 -0.29 0.00 -1.36 0.00 0.00 55.97 53.40 1l3n s LYS 70 Cb 0.00 0.18 -0.04 0.00 -1.68 0.00 0.00 37.83 36.28 1l3n s LYS 70 CO 0.00 -0.10 1.57 -1.58 -0.76 0.00 0.00 175.35 174.48 1l3n s HIS 71 N -2.78 2.17 0.00 3.18 5.65 -1.19 -2.81 115.29 119.52 1l3n s HIS 71 Ca -0.04 0.41 0.00 0.00 0.25 0.00 0.00 55.06 55.68 1l3n s HIS 71 Cb -0.00 -3.84 0.00 0.00 -1.18 0.00 0.00 32.58 27.56 1l3n s HIS 71 CO -0.06 -3.28 0.00 0.41 -0.65 0.00 0.00 174.74 171.16 1l3n n GLY 72 N 4.09 5.40 0.00 1.59 0.00 -1.26 -2.84 105.19 112.17 1l3n n GLY 72 Ca 0.17 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.23 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 1.02 1.12 0.24 -0.02 0.00 -1.26 -4.49 105.19 101.80 1l3n n GLY 73 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 0.39 0.00 1.61 -0.04 -1.25 -1.08 135.00 134.63 1l3n n PRO 74 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1l3n n PRO 74 Cb 0.00 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 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 -0.12 4.34 -4.16 0.54 5.02 -1.26 -5.05 118.16 117.47 1l3n n LYS 75 Ca 0.00 -0.15 -0.23 0.00 -2.02 0.00 0.00 58.31 55.92 1l3n n LYS 75 Cb 0.05 -0.63 -0.06 0.00 -0.02 0.00 0.00 35.03 34.36 1l3n n LYS 75 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1l3n s ASP 76 N -0.66 4.80 -0.00 4.39 -1.08 -0.24 -5.02 116.67 118.86 1l3n s ASP 76 Ca 0.00 -0.63 0.22 0.00 -0.52 0.00 0.00 52.55 51.62 1l3n s ASP 76 Cb 0.00 -0.89 -0.24 0.00 -1.46 0.00 0.00 42.92 40.33 1l3n s ASP 76 CO 0.00 -0.15 0.71 -1.84 0.52 0.00 0.00 175.17 174.41 1l3n n GLU 77 N -1.07 0.40 -0.19 4.34 0.00 -1.26 -4.42 120.64 118.43 1l3n n GLU 77 Ca -0.05 -0.10 0.09 0.00 0.00 0.00 0.00 57.16 57.10 1l3n n GLU 77 Cb 0.60 -1.54 0.19 0.00 0.00 0.00 0.00 31.44 30.69 1l3n n GLU 77 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1l3n n GLU 78 N -2.00 2.38 -0.97 3.44 1.02 -1.26 -5.02 120.64 118.22 1l3n n GLU 78 Ca -0.01 -2.11 -0.30 0.00 -0.02 0.00 0.00 57.16 54.72 1l3n n GLU 78 Cb 0.48 -1.40 0.01 0.00 -0.02 0.00 0.00 31.44 30.51 1l3n n GLU 78 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1l3n n ARG 79 N 1.07 0.00 0.00 3.49 1.85 -1.23 -0.69 116.66 121.14 1l3n n ARG 79 Ca 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.01 1l3n n ARG 79 Cb 0.50 -0.78 0.00 0.00 -1.05 0.00 0.00 32.46 31.13 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 -1.14 0.00 -2.11 2.89 8.25 -1.12 -4.68 115.22 117.31 1l3n n HIS 80 Ca 0.06 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.51 1l3n n HIS 80 Cb 0.36 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.46 1l3n n HIS 80 CO 0.00 0.00 0.00 1.55 0.64 0.00 0.00 176.34 178.53 1l3n n VAL 81 N 0.00 0.00 0.00 1.59 3.14 -1.26 -4.75 118.33 117.05 1l3n n VAL 81 Ca 0.00 -0.21 0.00 0.00 -2.96 0.00 0.00 64.34 61.17 1l3n n VAL 81 Cb 0.00 0.46 0.00 0.00 -1.06 0.00 0.00 33.84 33.24 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 0.11 -0.21 3.34 7.55 0.00 -1.26 -4.84 105.19 109.87 1l3n n GLY 82 Ca -0.07 0.06 -0.45 0.00 0.00 0.00 0.00 46.02 45.56 1l3n n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1l3n s ASP 83 N 0.00 6.20 -0.37 1.61 1.01 -1.26 -0.71 116.67 123.15 1l3n s ASP 83 Ca 0.00 -1.65 0.02 0.00 0.71 0.00 0.00 52.55 51.63 1l3n s ASP 83 Cb 0.00 -2.25 0.44 0.00 1.01 0.00 0.00 42.92 42.11 1l3n s ASP 83 CO 0.00 -0.97 1.78 0.18 0.21 0.00 0.00 175.17 176.36 1l3n n LEU 84 N 5.73 6.12 0.00 1.23 4.77 -0.11 -3.86 117.00 130.88 1l3n n LEU 84 Ca -0.11 -3.25 0.00 0.00 -0.03 0.00 0.00 56.01 52.62 1l3n n LEU 84 Cb 0.41 -0.83 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 1l3n n LEU 84 CO 0.56 1.03 0.00 0.61 -1.33 0.00 0.00 177.39 178.26 1l3n n GLY 85 N -0.56 1.28 3.18 -0.72 0.00 -1.19 -4.44 105.19 102.73 1l3n n GLY 85 Ca 0.44 0.63 -0.09 0.00 0.00 0.00 0.00 46.02 47.01 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 -0.15 -0.01 1.61 2.20 -1.26 -0.40 114.94 112.94 1l3n s ASN 86 Ca 0.00 0.81 -0.15 0.00 -0.94 0.00 0.00 52.86 52.58 1l3n s ASN 86 Cb 0.00 1.29 -0.06 0.00 -2.00 0.00 0.00 41.25 40.49 1l3n s ASN 86 CO 0.00 -0.25 0.43 0.68 -2.94 0.00 0.00 177.10 175.02 1l3n s VAL 87 N 2.60 5.03 -0.27 3.54 -7.23 0.04 -4.37 120.40 119.73 1l3n s VAL 87 Ca 0.02 0.88 -0.25 0.00 -1.81 0.00 0.00 61.98 60.81 1l3n s VAL 87 Cb -0.13 -3.74 0.00 0.00 0.56 0.00 0.00 36.38 33.08 1l3n s VAL 87 CO -0.13 0.55 0.87 0.28 -0.31 0.00 0.00 175.10 176.35 1l3n s THR 88 N -0.86 4.76 -0.10 5.32 -1.32 -1.26 -0.35 115.64 121.83 1l3n s THR 88 Ca 0.24 1.51 -0.13 0.00 -1.21 0.00 0.00 61.69 62.10 1l3n s THR 88 Cb -0.17 -4.19 -0.05 0.00 -1.51 0.00 0.00 72.50 66.59 1l3n s THR 88 CO 0.13 -0.20 0.32 0.00 -2.21 0.00 0.00 174.62 172.66 1l3n s ALA 89 N 3.03 3.66 1.13 11.08 0.00 -0.03 -4.12 121.76 136.51 1l3n s ALA 89 Ca 0.36 -0.39 -0.14 0.00 0.00 0.00 0.00 51.96 51.80 1l3n s ALA 89 Cb -0.14 -2.34 0.22 0.00 0.00 0.00 0.00 23.12 20.86 1l3n s ALA 89 CO 0.10 0.29 0.79 -3.47 0.00 0.00 0.00 175.76 173.47 1l3n n ASP 90 N 2.78 -1.65 0.29 0.00 2.03 0.37 -1.78 116.55 118.61 1l3n n ASP 90 Ca -0.13 -0.06 0.18 0.00 0.52 0.00 0.00 54.79 55.29 1l3n n ASP 90 Cb 0.52 -1.22 0.98 0.00 -0.72 0.00 0.00 41.12 40.68 1l3n n ASP 90 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 1l3n h LYS 91 N -2.42 0.00 0.00 -0.67 -0.00 -1.93 0.12 116.57 111.67 1l3n h LYS 91 Ca -0.57 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.08 1l3n h LYS 91 Cb 1.33 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.56 1l3n h LYS 91 CO 0.45 0.00 0.00 -3.47 -0.00 0.00 0.00 179.45 176.43 1l3n n ASP 92 N -3.59 0.52 0.00 7.07 2.03 -1.26 -4.66 116.55 116.65 1l3n n ASP 92 Ca -0.02 0.56 0.00 0.00 0.52 0.00 0.00 54.79 55.85 1l3n n ASP 92 Cb 0.14 -0.69 0.00 0.00 -0.72 0.00 0.00 41.12 39.84 1l3n n ASP 92 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1l3n n GLY 93 N 1.16 0.75 3.58 0.27 0.00 0.41 -4.34 105.19 107.02 1l3n n GLY 93 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.35 4.19 -0.21 1.61 1.01 -1.25 -1.83 120.40 121.58 1l3n s VAL 94 Ca 0.00 0.93 -0.03 0.00 0.00 0.00 0.00 61.98 62.88 1l3n s VAL 94 Cb 0.00 -4.62 -0.01 0.00 0.00 0.00 0.00 36.38 31.75 1l3n s VAL 94 CO 0.00 -1.12 -0.07 0.00 0.00 0.00 0.00 175.10 173.91 1l3n s ALA 95 N 4.48 2.75 -0.00 5.51 0.00 0.24 -0.47 121.76 134.27 1l3n s ALA 95 Ca 0.42 -1.14 -0.27 0.00 0.00 0.00 0.00 51.96 50.98 1l3n s ALA 95 Cb -0.08 -1.60 -0.04 0.00 0.00 0.00 0.00 23.12 21.40 1l3n s ALA 95 CO 0.27 -0.35 0.84 0.34 0.00 0.00 0.00 175.76 176.87 1l3n s ASP 96 N 1.33 7.23 -0.10 0.00 -1.08 -1.26 -1.09 116.67 121.70 1l3n s ASP 96 Ca 0.04 1.48 0.04 0.00 -0.52 0.00 0.00 52.55 53.59 1l3n s ASP 96 Cb -0.14 -2.50 -0.00 0.00 -1.46 0.00 0.00 42.92 38.81 1l3n s ASP 96 CO -0.04 -0.14 -0.23 -0.69 0.52 0.00 0.00 175.17 174.60 1l3n s VAL 97 N 0.62 2.19 -0.43 1.11 1.01 0.25 -4.73 120.40 120.42 1l3n s VAL 97 Ca 0.44 -0.98 0.08 0.00 0.00 0.00 0.00 61.98 61.52 1l3n s VAL 97 Cb -0.20 -1.84 0.34 0.00 0.00 0.00 0.00 36.38 34.68 1l3n s VAL 97 CO 0.24 0.56 1.09 -1.54 0.00 0.00 0.00 175.10 175.45 1l3n n SER 98 N 3.43 -1.57 -4.40 3.32 3.41 -1.26 -0.40 113.62 116.16 1l3n n SER 98 Ca -0.19 -3.33 -0.32 0.00 -0.26 0.00 0.00 58.87 54.77 1l3n n SER 98 Cb 0.53 1.24 -0.14 0.00 -0.26 0.00 0.00 64.21 65.57 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 -0.35 2.65 -0.55 -1.33 1.01 -1.26 -4.94 121.20 116.42 1l3n s ILE 99 Ca 0.25 -0.87 -0.21 0.00 0.00 0.00 0.00 60.65 59.82 1l3n s ILE 99 Cb 0.33 -2.00 0.06 0.00 0.01 0.00 0.00 42.46 40.86 1l3n s ILE 99 CO -0.06 0.58 0.77 -1.83 0.00 0.00 0.00 174.94 174.40 1l3n s GLU 100 N -0.56 3.17 -0.32 2.79 1.03 -1.26 -0.75 118.70 122.80 1l3n s GLU 100 Ca 0.08 -0.77 -0.28 0.00 0.03 0.00 0.00 54.97 54.03 1l3n s GLU 100 Cb -0.11 -4.13 0.01 0.00 -0.80 0.00 0.00 34.13 29.11 1l3n s GLU 100 CO 0.01 -1.41 1.02 0.34 -1.33 0.00 0.00 175.26 173.88 1l3n s ASP 101 N 2.99 6.88 -0.56 0.83 -1.08 -0.07 -4.91 116.67 120.74 1l3n s ASP 101 Ca 0.20 0.96 0.02 0.00 -0.52 0.00 0.00 52.55 53.21 1l3n s ASP 101 Cb -0.18 -2.52 0.41 0.00 -1.46 0.00 0.00 42.92 39.18 1l3n s ASP 101 CO 0.13 -0.83 1.53 -1.54 0.52 0.00 0.00 175.17 174.97 1l3n n SER 102 N 6.74 6.01 0.00 -0.34 3.41 -1.26 -1.30 113.62 126.89 1l3n n SER 102 Ca 0.10 -3.77 0.00 0.00 -0.26 0.00 0.00 58.87 54.94 1l3n n SER 102 Cb 0.47 -0.69 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 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 -0.61 0.00 -3.57 -3.33 3.14 -1.26 -5.08 118.33 107.62 1l3n n VAL 103 Ca 0.48 0.00 -0.23 0.00 -2.96 0.00 0.00 64.34 61.63 1l3n n VAL 103 Cb 0.60 -0.16 0.01 0.00 -1.06 0.00 0.00 33.84 33.24 1l3n n VAL 103 CO 0.00 0.00 0.00 0.27 -6.46 0.00 0.00 176.83 170.64 1l3n s ILE 104 N -1.27 1.97 0.03 1.55 -0.00 -1.26 -5.15 121.20 117.06 1l3n s ILE 104 Ca 0.00 -1.31 -0.09 0.00 -0.00 0.00 0.00 60.65 59.25 1l3n s ILE 104 Cb 0.00 -2.28 0.00 0.00 -0.00 0.00 0.00 42.46 40.18 1l3n s ILE 104 CO 0.00 0.00 0.18 -0.55 -0.00 0.00 0.00 174.94 174.57 1l3n s SER 105 N -4.38 0.03 0.42 4.36 0.15 -1.26 -4.56 113.70 108.47 1l3n s SER 105 Ca 0.45 -0.33 0.29 0.00 0.70 0.00 0.00 55.95 57.06 1l3n s SER 105 Cb -0.04 0.27 1.22 0.00 -1.71 0.00 0.00 66.02 65.76 1l3n s SER 105 CO 0.28 -0.51 1.87 -0.07 1.20 0.00 0.00 173.24 176.00 1l3n h LEU 106 N 3.64 0.00 -7.44 3.45 3.38 -1.94 -3.11 115.31 113.28 1l3n h LEU 106 Ca -0.32 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.55 1l3n h LEU 106 Cb 1.19 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.74 1l3n h LEU 106 CO 0.47 0.00 -0.20 -0.55 0.09 0.00 0.00 178.44 178.24 1l3n s SER 107 N -5.01 -0.25 0.00 -0.43 0.15 -1.26 -4.07 113.70 102.82 1l3n s SER 107 Ca 0.02 0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.82 1l3n s SER 107 Cb 0.09 0.35 0.00 0.00 -1.71 0.00 0.00 66.02 64.75 1l3n s SER 107 CO 0.47 -0.49 0.00 0.61 1.20 0.00 0.00 173.24 175.03 1l3n n GLY 108 N 1.14 0.63 5.00 9.45 0.00 -1.26 -4.76 105.19 115.39 1l3n n GLY 108 Ca -0.21 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.09 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 0.00 1.61 -0.08 -1.26 -4.42 116.55 112.40 1l3n n ASP 109 Ca 0.00 0.00 0.14 0.00 -1.51 0.00 0.00 54.79 53.42 1l3n n ASP 109 Cb 0.00 0.00 0.79 0.00 2.34 0.00 0.00 41.12 44.25 1l3n n ASP 109 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 1l3n n HIS 110 N 0.00 0.00 0.00 -0.67 -0.00 -1.26 -4.91 115.22 108.38 1l3n n HIS 110 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1l3n n HIS 110 Cb 0.00 -0.12 0.00 0.00 -0.00 0.00 0.00 29.99 29.87 1l3n n HIS 110 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1l3n n SER 111 N -1.12 0.00 0.00 0.41 2.88 -1.26 -4.77 113.62 109.76 1l3n n SER 111 Ca 0.18 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.82 1l3n n SER 111 Cb 0.15 0.00 0.53 0.00 -0.75 0.00 0.00 64.21 64.14 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 0.00 0.26 -1.64 2.46 -5.35 -1.18 -4.74 119.36 109.17 1l3n n ILE 112 Ca 0.00 0.06 -0.48 0.00 -0.27 0.00 0.00 62.75 62.06 1l3n n ILE 112 Cb 0.00 -0.74 -0.05 0.00 -1.74 0.00 0.00 39.64 37.11 1l3n n ILE 112 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 1l3n n ILE 113 N -1.18 0.06 -1.00 7.28 2.08 -1.26 -0.64 119.36 124.70 1l3n n ILE 113 Ca 0.11 -0.01 0.00 0.00 0.56 0.00 0.00 62.75 63.41 1l3n n ILE 113 Cb 0.12 -1.25 0.00 0.00 -0.75 0.00 0.00 39.64 37.76 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 3.00 0.53 3.87 7.39 0.00 -0.30 -4.98 105.19 114.71 1l3n n GLY 114 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.10 0.60 -0.03 1.61 1.81 0.18 -3.35 118.95 119.67 1l3n s ARG 115 Ca 0.00 -0.25 0.04 0.00 -1.72 0.00 0.00 55.73 53.80 1l3n s ARG 115 Cb 0.00 -1.83 -0.00 0.00 -0.45 0.00 0.00 34.95 32.67 1l3n s ARG 115 CO 0.00 -2.46 -0.15 0.99 -0.68 0.00 0.00 175.30 173.00 1l3n s THR 116 N -3.70 1.23 0.22 0.02 2.01 -1.25 -0.97 115.64 113.20 1l3n s THR 116 Ca 0.71 -0.62 0.07 0.00 0.31 0.00 0.00 61.69 62.16 1l3n s THR 116 Cb -0.06 -1.05 -0.04 0.00 0.01 0.00 0.00 72.50 71.36 1l3n s THR 116 CO 0.53 0.36 0.12 -0.76 -0.69 0.00 0.00 174.62 174.18 1l3n s LEU 117 N -0.05 3.65 -0.02 4.42 1.02 -0.04 -0.89 118.68 126.77 1l3n s LEU 117 Ca -0.01 -0.30 0.03 0.00 0.02 0.00 0.00 54.13 53.87 1l3n s LEU 117 Cb -0.09 -2.21 0.00 0.00 0.02 0.00 0.00 46.19 43.91 1l3n s LEU 117 CO 0.01 0.01 -0.09 -0.69 0.02 0.00 0.00 176.35 175.61 1l3n s VAL 118 N -2.02 0.78 -0.23 -1.59 1.01 -0.56 -1.30 120.40 116.49 1l3n s VAL 118 Ca 0.31 -0.37 -0.09 0.00 0.00 0.00 0.00 61.98 61.83 1l3n s VAL 118 Cb -0.08 -0.69 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 1l3n s VAL 118 CO 0.23 0.24 0.12 0.54 0.00 0.00 0.00 175.10 176.22 1l3n s VAL 119 N 0.09 4.98 0.32 2.92 0.11 -0.25 -2.90 120.40 125.68 1l3n s VAL 119 Ca -0.01 0.05 0.07 0.00 -2.93 0.00 0.00 61.98 59.16 1l3n s VAL 119 Cb -0.07 -3.31 -0.03 0.00 -1.53 0.00 0.00 36.38 31.44 1l3n s VAL 119 CO 0.00 0.37 0.27 -1.00 -3.33 0.00 0.00 175.10 171.42 1l3n s HIS 120 N 1.01 2.92 0.13 1.54 3.76 -0.04 -2.87 115.29 121.74 1l3n s HIS 120 Ca 0.06 -0.28 -0.20 0.00 -0.15 0.00 0.00 55.06 54.49 1l3n s HIS 120 Cb -0.14 -1.74 -0.03 0.00 1.11 0.00 0.00 32.58 31.79 1l3n s HIS 120 CO 0.04 0.24 1.71 1.49 -0.85 0.00 0.00 174.74 177.36 1l3n h GLU 121 N 1.29 0.02 -5.60 1.40 4.22 -1.02 -3.32 114.58 111.58 1l3n h GLU 121 Ca -0.45 -0.00 -0.63 0.00 0.08 0.00 0.00 59.36 58.36 1l3n h GLU 121 Cb 1.25 -0.01 -0.11 0.00 0.50 0.00 0.00 28.75 30.38 1l3n h GLU 121 CO 0.59 0.01 -0.53 0.15 -2.18 0.00 0.00 179.01 177.05 1l3n s LYS 122 N -6.20 2.11 0.36 1.92 1.02 0.87 -4.87 119.74 114.94 1l3n s LYS 122 Ca -0.13 -2.13 -0.26 0.00 0.02 0.00 0.00 55.97 53.46 1l3n s LYS 122 Cb 0.10 -1.71 -0.09 0.00 -0.52 0.00 0.00 37.83 35.61 1l3n s LYS 122 CO 0.68 -0.20 1.10 0.00 -0.92 0.00 0.00 175.35 176.02 1l3n s ALA 123 N -2.74 3.22 0.62 5.17 0.00 -1.10 -0.64 121.76 126.29 1l3n s ALA 123 Ca 0.28 0.85 -0.14 0.00 0.00 0.00 0.00 51.96 52.94 1l3n s ALA 123 Cb 0.05 -3.32 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 1l3n s ALA 123 CO 0.15 -0.28 1.05 -0.51 0.00 0.00 0.00 175.76 176.17 1l3n s ASP 124 N -1.19 5.76 0.00 0.00 1.11 -1.26 -4.05 116.67 117.03 1l3n s ASP 124 Ca 0.53 1.73 0.09 0.00 0.18 0.00 0.00 52.55 55.07 1l3n s ASP 124 Cb -0.28 -2.52 0.31 0.00 1.07 0.00 0.00 42.92 41.51 1l3n s ASP 124 CO 0.36 -1.18 1.24 0.47 1.18 0.00 0.00 175.17 177.23 1l3n n ASP 125 N -2.32 1.04 -4.21 0.27 8.00 -0.95 -4.91 116.55 113.47 1l3n n ASP 125 Ca 0.08 -1.92 -0.35 0.00 0.71 0.00 0.00 54.79 53.31 1l3n n ASP 125 Cb 0.53 -0.12 -0.06 0.00 -0.02 0.00 0.00 41.12 41.45 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 0.04 -0.69 0.00 0.64 4.77 -1.26 -0.96 117.00 119.54 1l3n n LEU 126 Ca 0.08 -1.25 0.00 0.00 -0.03 0.00 0.00 56.01 54.82 1l3n n LEU 126 Cb 0.18 -1.53 0.00 0.00 -2.33 0.00 0.00 43.42 39.73 1l3n n LEU 126 CO 0.06 0.55 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 1l3n n GLY 127 N -2.41 3.15 0.72 -0.72 0.00 -1.13 -4.60 105.19 100.20 1l3n n GLY 127 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.75 0.95 0.04 1.61 5.02 -0.13 -2.94 118.16 121.96 1l3n n LYS 128 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.12 1l3n n LYS 128 Cb 0.00 -1.28 -0.07 0.00 -0.02 0.00 0.00 35.03 33.66 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 4.40 0.68 -4.16 0.72 0.00 -1.79 -3.49 103.07 99.43 1l3n h GLY 129 Ca 0.00 -1.15 -0.21 0.00 0.00 0.00 0.00 47.33 45.97 1l3n h GLY 129 CO 0.00 1.02 -0.46 0.61 0.00 0.00 0.00 176.54 177.71 1l3n n GLY 130 N 0.97 -0.03 3.42 4.60 0.00 -1.15 -4.97 105.19 108.02 1l3n n GLY 130 Ca -0.09 -0.12 -0.10 0.00 0.00 0.00 0.00 46.02 45.71 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 -3.69 -0.13 0.27 1.61 4.22 -1.26 -4.99 114.94 110.96 1l3n s ASN 131 Ca 0.08 -0.61 -0.04 0.00 -2.14 0.00 0.00 52.86 50.15 1l3n s ASN 131 Cb -0.03 0.50 0.54 0.00 1.28 0.00 0.00 41.25 43.54 1l3n s ASN 131 CO 0.44 -0.96 1.62 -0.33 -2.04 0.00 0.00 177.10 175.84 1l3n h GLU 132 N 2.37 0.09 -0.15 3.55 3.07 -1.98 0.36 114.58 121.88 1l3n h GLU 132 Ca -0.31 -0.01 -0.14 0.00 -0.50 0.00 0.00 59.36 58.41 1l3n h GLU 132 Cb 1.25 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 29.13 1l3n h GLU 132 CO 0.43 0.06 -0.52 1.49 -1.40 0.00 0.00 179.01 179.07 1l3n h GLU 133 N 0.09 0.41 -0.75 2.33 4.57 -1.97 -2.52 114.58 116.75 1l3n h GLU 133 Ca 0.47 -0.25 0.14 0.00 -1.18 0.00 0.00 59.36 58.55 1l3n h GLU 133 Cb 0.88 0.02 -0.09 0.00 -0.16 0.00 0.00 28.75 29.39 1l3n h GLU 133 CO -0.73 0.83 0.29 0.66 -1.18 0.00 0.00 179.01 178.88 1l3n h SER 134 N 0.33 0.27 -0.11 1.04 4.64 -0.55 0.14 113.55 119.30 1l3n h SER 134 Ca 0.01 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1l3n h SER 134 Cb 1.02 0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1l3n h SER 134 CO 0.09 0.10 0.00 1.07 -0.87 0.00 0.00 176.83 177.22 1l3n n THR 135 N -5.01 0.15 0.00 2.95 5.66 -0.82 -2.31 114.28 114.91 1l3n n THR 135 Ca 0.14 -0.18 0.00 0.00 -3.05 0.00 0.00 64.05 60.96 1l3n n THR 135 Cb 0.41 0.05 0.00 0.00 -1.55 0.00 0.00 70.33 69.25 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 -0.17 0.00 -0.27 1.09 5.02 0.01 -3.14 118.16 120.70 1l3n n LYS 136 Ca 0.11 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.46 1l3n n LYS 136 Cb 0.16 -0.01 0.19 0.00 -0.02 0.00 0.00 35.03 35.35 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 -1.67 1.47 0.00 -0.18 -2.24 0.26 -4.26 114.28 107.65 1l3n n THR 137 Ca 0.00 -1.32 0.00 0.00 -2.27 0.00 0.00 64.05 60.46 1l3n n THR 137 Cb 0.00 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 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 0.11 3.06 0.93 3.38 0.00 0.10 -2.45 105.19 110.31 1l3n n GLY 138 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 0.09 -0.65 0.00 1.61 3.02 -1.26 -2.24 115.26 115.84 1l3n n ASN 139 Ca 0.00 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.57 1l3n n ASN 139 Cb 0.00 -0.23 0.14 0.00 -0.61 0.00 0.00 39.78 39.08 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 -0.92 1.58 -0.10 5.41 0.00 -1.03 -4.63 120.51 120.82 1l3n n ALA 140 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1l3n n ALA 140 Cb 0.19 -1.08 -0.00 0.00 0.00 0.00 0.00 19.45 18.55 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 -0.76 -2.04 3.76 0.00 0.00 -1.26 -0.09 105.19 104.80 1l3n n GLY 141 Ca 0.03 -1.41 -0.39 0.00 0.00 0.00 0.00 46.02 44.25 1l3n n GLY 141 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1l3n s SER 142 N -3.72 5.54 -0.29 1.61 0.15 -1.26 -4.45 113.70 111.27 1l3n s SER 142 Ca 0.00 2.82 -0.10 0.00 0.70 0.00 0.00 55.95 59.36 1l3n s SER 142 Cb 0.00 -2.64 -0.11 0.00 -1.71 0.00 0.00 66.02 61.56 1l3n s SER 142 CO 0.00 -1.40 1.48 0.54 1.20 0.00 0.00 173.24 175.06 1l3n n ARG 143 N -0.67 0.64 0.15 5.44 1.74 -1.26 -0.97 116.66 121.72 1l3n n ARG 143 Ca 0.08 -0.97 0.12 0.00 -0.77 0.00 0.00 57.85 56.30 1l3n n ARG 143 Cb 0.44 -2.31 0.55 0.00 -1.02 0.00 0.00 32.46 30.12 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 5.96 0.63 -3.58 0.55 -0.00 -1.23 -4.56 117.00 114.76 1l3n n LEU 144 Ca 0.26 0.73 -0.16 0.00 -0.00 0.00 0.00 56.01 56.83 1l3n n LEU 144 Cb 0.16 -0.72 -0.07 0.00 -0.00 0.00 0.00 43.42 42.79 1l3n n LEU 144 CO 0.76 -0.79 0.39 0.00 -0.00 0.00 0.00 177.39 177.75 1l3n s ALA 145 N -3.46 -1.67 0.07 1.47 0.00 -1.14 -1.39 121.76 115.65 1l3n s ALA 145 Ca 0.00 1.47 -0.20 0.00 0.00 0.00 0.00 51.96 53.24 1l3n s ALA 145 Cb 0.08 -0.41 0.04 0.00 0.00 0.00 0.00 23.12 22.83 1l3n s ALA 145 CO 0.29 -0.34 0.47 0.00 0.00 0.00 0.00 175.76 176.17 1l3n s GLY 147 N -2.25 -0.40 -0.09 0.00 0.00 -0.42 -0.94 107.32 103.22 1l3n s GLY 147 Ca -0.03 1.18 -0.04 0.00 0.00 0.00 0.00 44.72 45.84 1l3n s GLY 147 CO -0.05 0.92 0.07 0.14 0.00 0.00 0.00 173.10 174.18 1l3n s VAL 148 N -0.54 4.84 -0.23 1.40 1.01 -1.26 -0.86 120.40 124.76 1l3n s VAL 148 Ca -0.07 -0.10 -0.29 0.00 0.00 0.00 0.00 61.98 61.53 1l3n s VAL 148 Cb -0.03 -3.09 0.01 0.00 0.00 0.00 0.00 36.38 33.27 1l3n s VAL 148 CO 0.04 0.57 1.02 -0.63 0.00 0.00 0.00 175.10 176.10 1l3n s ILE 149 N -0.99 4.70 0.13 2.22 1.01 -0.14 -4.30 121.20 123.82 1l3n s ILE 149 Ca 0.15 1.98 0.06 0.00 0.00 0.00 0.00 60.65 62.85 1l3n s ILE 149 Cb -0.12 -4.29 -0.04 0.00 0.01 0.00 0.00 42.46 38.03 1l3n s ILE 149 CO 0.05 -0.16 -0.15 -0.83 0.00 0.00 0.00 174.94 173.84 1l3n s GLY 150 N 1.21 1.13 0.50 6.18 0.00 -0.18 -1.15 107.32 115.01 1l3n s GLY 150 Ca 0.43 -1.31 -0.22 0.00 0.00 0.00 0.00 44.72 43.61 1l3n s GLY 150 CO 0.06 -1.37 1.27 -0.42 0.00 0.00 0.00 173.10 172.65 1l3n s ILE 151 N -2.05 2.54 0.00 0.90 -1.09 -1.26 -0.47 121.20 119.77 1l3n s ILE 151 Ca 0.10 0.41 0.00 0.00 -2.23 0.00 0.00 60.65 58.92 1l3n s ILE 151 Cb -0.05 -3.21 0.00 0.00 -1.58 0.00 0.00 42.46 37.62 1l3n s ILE 151 CO 0.04 -0.00 0.00 0.00 -1.23 0.00 0.00 174.94 173.74 1l3n n ALA 152 N -0.74 0.44 0.00 9.38 0.00 0.17 -4.65 120.51 125.10 1l3n n ALA 152 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1l3n n ALA 152 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1l3n n ALA 152 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44