#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 -3.61 0.00 5.66 -1.26 -4.98 114.28 110.09 1l3n n THR 2 Ca 0.00 -0.14 -0.11 0.00 -3.05 0.00 0.00 64.05 60.75 1l3n n THR 2 Cb 0.00 0.90 -0.04 0.00 -1.55 0.00 0.00 70.33 69.64 1l3n n THR 2 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 1l3n s LYS 3 N -2.62 1.16 0.21 1.09 -2.85 -1.26 -0.15 119.74 115.33 1l3n s LYS 3 Ca 0.05 -0.69 -0.10 0.00 -1.00 0.00 0.00 55.97 54.23 1l3n s LYS 3 Cb 0.12 0.50 -0.01 0.00 -2.06 0.00 0.00 37.83 36.38 1l3n s LYS 3 CO 0.68 -0.47 0.37 0.00 0.10 0.00 0.00 175.35 176.02 1l3n s ALA 4 N -3.80 0.04 0.33 0.59 0.00 0.07 -0.76 121.76 118.23 1l3n s ALA 4 Ca 0.04 -0.99 0.05 0.00 0.00 0.00 0.00 51.96 51.05 1l3n s ALA 4 Cb 0.01 1.06 -0.07 0.00 0.00 0.00 0.00 23.12 24.12 1l3n s ALA 4 CO -0.11 -0.75 0.03 0.14 0.00 0.00 0.00 175.76 175.08 1l3n s VAL 5 N -4.02 1.39 -0.20 0.00 -7.23 -0.03 -0.42 120.40 109.90 1l3n s VAL 5 Ca 0.23 -2.02 -0.04 0.00 -1.81 0.00 0.00 61.98 58.34 1l3n s VAL 5 Cb 0.02 -2.78 0.07 0.00 0.56 0.00 0.00 36.38 34.25 1l3n s VAL 5 CO 0.07 -0.05 0.09 0.00 -0.31 0.00 0.00 175.10 174.90 1l3n s ALA 6 N -3.16 0.63 -0.81 1.32 0.00 -0.44 -1.70 121.76 117.61 1l3n s ALA 6 Ca 0.35 -0.59 -0.21 0.00 0.00 0.00 0.00 51.96 51.51 1l3n s ALA 6 Cb 0.08 -1.16 0.09 0.00 0.00 0.00 0.00 23.12 22.14 1l3n s ALA 6 CO 0.15 -1.28 1.10 0.14 0.00 0.00 0.00 175.76 175.87 1l3n s VAL 7 N 2.05 4.40 -0.07 0.00 -7.23 -1.26 -1.09 120.40 117.19 1l3n s VAL 7 Ca 0.03 -0.82 -0.30 0.00 -1.81 0.00 0.00 61.98 59.08 1l3n s VAL 7 Cb -0.16 -4.78 -0.02 0.00 0.56 0.00 0.00 36.38 31.98 1l3n s VAL 7 CO -0.15 -1.55 1.05 -0.76 -0.31 0.00 0.00 175.10 173.38 1l3n s LEU 8 N 3.75 4.27 0.04 1.32 1.43 0.83 -3.95 118.68 126.38 1l3n s LEU 8 Ca 0.29 1.63 -0.10 0.00 -1.03 0.00 0.00 54.13 54.93 1l3n s LEU 8 Cb -0.10 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.57 1l3n s LEU 8 CO 0.01 -0.45 0.20 -0.54 0.23 0.00 0.00 176.35 175.79 1l3n s LYS 9 N 1.88 0.71 0.11 1.70 3.01 -0.05 -0.11 119.74 126.99 1l3n s LYS 9 Ca 0.51 -0.65 0.00 0.00 -1.01 0.00 0.00 55.97 54.82 1l3n s LYS 9 Cb -0.20 0.29 0.00 0.00 -1.01 0.00 0.00 37.83 36.91 1l3n s LYS 9 CO 0.21 -0.21 0.00 0.41 0.51 0.00 0.00 175.35 176.27 1l3n n GLY 10 N 0.63 -1.84 0.18 -3.33 0.00 -1.25 -0.68 105.19 98.89 1l3n n GLY 10 Ca -0.19 0.54 -0.15 0.00 0.00 0.00 0.00 46.02 46.23 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 0.62 0.00 1.61 3.58 -1.55 -3.49 116.42 117.19 1l3n h ASP 11 Ca 0.00 -0.56 0.00 0.00 0.42 0.00 0.00 57.03 56.89 1l3n h ASP 11 Cb 0.00 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 40.87 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 0.45 0.93 0.36 -0.78 0.00 -1.26 -4.95 105.19 99.93 1l3n n GLY 12 Ca -0.06 -0.08 0.06 0.00 0.00 0.00 0.00 46.02 45.94 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 0.85 -5.74 1.61 0.13 -1.92 -3.36 132.00 123.58 1l3n h PRO 13 Ca 0.00 -0.05 -0.38 0.00 -0.87 0.00 0.00 66.00 64.70 1l3n h PRO 13 Cb 0.00 -0.19 -0.06 0.00 0.13 0.00 0.00 31.00 30.88 1l3n h PRO 13 CO 0.00 0.57 1.04 0.14 -0.23 0.00 0.00 178.00 179.51 1l3n s VAL 14 N -5.79 3.60 -0.40 1.56 -7.23 -1.25 -3.84 120.40 107.04 1l3n s VAL 14 Ca -0.11 -0.66 -0.11 0.00 -1.81 0.00 0.00 61.98 59.29 1l3n s VAL 14 Cb 0.20 -4.39 0.04 0.00 0.56 0.00 0.00 36.38 32.79 1l3n s VAL 14 CO 0.79 -1.20 0.25 -1.10 -0.31 0.00 0.00 175.10 173.52 1l3n s GLN 15 N 6.35 2.79 -0.04 4.82 -0.21 0.36 -4.20 119.66 129.54 1l3n s GLN 15 Ca 0.64 -1.20 -0.10 0.00 0.02 0.00 0.00 55.36 54.73 1l3n s GLN 15 Cb -0.03 -3.80 -0.05 0.00 1.00 0.00 0.00 33.01 30.12 1l3n s GLN 15 CO 0.01 -0.80 0.29 0.20 -2.12 0.00 0.00 175.29 172.87 1l3n s GLY 16 N 1.80 2.32 -0.41 3.09 0.00 0.84 -1.39 107.32 113.57 1l3n s GLY 16 Ca 0.02 -0.44 0.03 0.00 0.00 0.00 0.00 44.72 44.34 1l3n s GLY 16 CO 0.06 -0.15 0.32 -0.42 0.00 0.00 0.00 173.10 172.90 1l3n s ILE 17 N -1.12 0.37 0.17 0.90 1.01 0.45 -0.12 121.20 122.86 1l3n s ILE 17 Ca 0.22 -2.53 -0.12 0.00 0.00 0.00 0.00 60.65 58.22 1l3n s ILE 17 Cb -0.14 -1.28 -0.07 0.00 0.01 0.00 0.00 42.46 40.98 1l3n s ILE 17 CO 0.11 -1.19 0.53 -0.63 0.00 0.00 0.00 174.94 173.76 1l3n s ILE 18 N 0.20 4.91 -0.17 2.92 1.09 -0.25 -1.68 121.20 128.21 1l3n s ILE 18 Ca 0.30 0.66 -0.00 0.00 -1.10 0.00 0.00 60.65 60.50 1l3n s ILE 18 Cb -0.01 -3.68 0.04 0.00 -1.06 0.00 0.00 42.46 37.75 1l3n s ILE 18 CO -0.16 0.13 -0.05 0.20 -0.10 0.00 0.00 174.94 174.96 1l3n s ASN 19 N -1.96 2.94 -0.34 3.58 0.02 0.67 -1.32 114.94 118.53 1l3n s ASN 19 Ca 0.41 -0.72 -0.18 0.00 -1.02 0.00 0.00 52.86 51.35 1l3n s ASN 19 Cb -0.13 -0.92 -0.01 0.00 0.02 0.00 0.00 41.25 40.20 1l3n s ASN 19 CO 0.20 -0.20 0.50 -0.36 0.02 0.00 0.00 177.10 177.26 1l3n s PHE 20 N 1.62 3.19 -0.05 2.20 0.40 0.44 -1.36 117.98 124.43 1l3n s PHE 20 Ca -0.00 0.23 0.06 0.00 -0.60 0.00 0.00 56.93 56.61 1l3n s PHE 20 Cb -0.16 -2.88 -0.02 0.00 0.51 0.00 0.00 43.02 40.47 1l3n s PHE 20 CO -0.08 -0.50 -0.21 -1.21 0.70 0.00 0.00 175.22 173.92 1l3n s GLU 21 N 2.36 2.45 -0.38 0.44 2.02 0.06 -0.75 118.70 124.89 1l3n s GLU 21 Ca 0.19 -0.84 0.01 0.00 0.02 0.00 0.00 54.97 54.34 1l3n s GLU 21 Cb -0.15 -2.22 0.13 0.00 0.10 0.00 0.00 34.13 31.99 1l3n s GLU 21 CO 0.13 0.50 0.20 -1.14 0.02 0.00 0.00 175.26 174.97 1l3n s GLN 22 N -0.44 0.89 0.33 1.61 0.74 0.79 -1.00 119.66 122.58 1l3n s GLN 22 Ca 0.05 -1.56 0.09 0.00 0.05 0.00 0.00 55.36 53.99 1l3n s GLN 22 Cb -0.12 -1.86 0.84 0.00 1.10 0.00 0.00 33.01 32.97 1l3n s GLN 22 CO 0.01 -1.15 1.79 1.57 -0.55 0.00 0.00 175.29 176.97 1l3n h LYS 23 N 7.10 0.65 0.00 1.67 2.10 -1.78 -3.43 116.57 122.89 1l3n h LYS 23 Ca -0.01 -0.04 -0.19 0.00 -2.00 0.00 0.00 60.65 58.41 1l3n h LYS 23 Cb 0.96 -0.15 -0.04 0.00 -0.90 0.00 0.00 32.23 32.10 1l3n h LYS 23 CO 0.40 0.43 -0.01 -1.91 -2.00 0.00 0.00 179.45 176.35 1l3n n GLU 24 N -4.70 0.80 0.24 0.07 0.00 -1.26 -4.96 120.64 110.83 1l3n n GLU 24 Ca 0.23 -2.49 0.15 0.00 0.00 0.00 0.00 57.16 55.05 1l3n n GLU 24 Cb 0.62 2.59 0.56 0.00 0.00 0.00 0.00 31.44 35.21 1l3n n GLU 24 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1l3n h SER 25 N 1.88 0.00 1.40 4.31 4.64 -1.98 -0.13 113.55 123.67 1l3n h SER 25 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1l3n h SER 25 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1l3n h SER 25 CO 0.37 0.00 -0.33 0.78 -0.87 0.00 0.00 176.83 176.78 1l3n h ASN 26 N 0.00 0.00 -3.99 4.97 2.35 -1.96 -3.45 115.58 113.50 1l3n h ASN 26 Ca 0.00 -0.05 -0.45 0.00 -0.55 0.00 0.00 56.30 55.25 1l3n h ASN 26 Cb 0.58 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.93 1l3n h ASN 26 CO 0.00 0.03 0.35 -0.83 -1.65 0.00 0.00 177.43 175.32 1l3n s GLY 27 N -3.93 2.55 1.03 2.83 0.00 -0.06 -5.08 107.32 104.67 1l3n s GLY 27 Ca 0.06 0.46 -0.13 0.00 0.00 0.00 0.00 44.72 45.12 1l3n s GLY 27 CO 0.68 0.81 1.10 2.56 0.00 0.00 0.00 173.10 178.25 1l3n s PRO 28 N -2.75 0.18 -0.56 2.90 0.04 -1.26 -4.74 135.00 128.81 1l3n s PRO 28 Ca 0.58 0.39 -0.23 0.00 0.04 0.00 0.00 61.00 61.78 1l3n s PRO 28 Cb -0.13 -1.72 0.05 0.00 0.04 0.00 0.00 34.50 32.74 1l3n s PRO 28 CO 0.18 -2.87 0.91 0.08 0.04 0.00 0.00 177.00 175.34 1l3n s VAL 29 N -3.00 4.42 -0.37 -0.36 1.01 0.42 -4.33 120.40 118.18 1l3n s VAL 29 Ca 0.66 0.11 -0.25 0.00 0.00 0.00 0.00 61.98 62.50 1l3n s VAL 29 Cb -0.17 -4.54 0.01 0.00 0.00 0.00 0.00 36.38 31.69 1l3n s VAL 29 CO 0.57 -1.13 0.89 -0.54 0.00 0.00 0.00 175.10 174.89 1l3n s LYS 30 N 3.84 3.80 -0.51 2.72 1.02 -0.17 -2.24 119.74 128.20 1l3n s LYS 30 Ca 0.28 0.48 -0.10 0.00 0.02 0.00 0.00 55.97 56.65 1l3n s LYS 30 Cb -0.14 -3.81 0.13 0.00 -0.52 0.00 0.00 37.83 33.49 1l3n s LYS 30 CO 0.17 -0.95 0.39 0.54 -0.92 0.00 0.00 175.35 174.58 1l3n s VAL 31 N 3.41 4.35 0.55 3.17 0.11 0.75 -0.76 120.40 131.98 1l3n s VAL 31 Ca 0.36 -1.88 0.03 0.00 -2.93 0.00 0.00 61.98 57.57 1l3n s VAL 31 Cb -0.12 -3.85 0.03 0.00 -1.53 0.00 0.00 36.38 30.92 1l3n s VAL 31 CO 0.19 -0.81 0.28 -1.66 -3.33 0.00 0.00 175.10 169.77 1l3n s TRP 32 N 1.22 1.56 -4.44 1.54 -2.14 -0.46 -0.63 118.94 115.59 1l3n s TRP 32 Ca 0.07 -0.93 0.00 0.00 2.66 0.00 0.00 56.10 57.90 1l3n s TRP 32 Cb -0.25 -1.79 0.00 0.00 -3.10 0.00 0.00 33.47 28.33 1l3n s TRP 32 CO -0.01 -0.31 0.00 0.41 -2.66 0.00 0.00 176.95 174.38 1l3n n GLY 33 N -1.65 0.79 3.37 3.67 0.00 0.25 -0.24 105.19 111.38 1l3n n GLY 33 Ca -0.09 -1.77 -0.13 0.00 0.00 0.00 0.00 46.02 44.03 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 -0.38 -0.08 1.61 1.04 -0.68 -0.36 113.70 110.85 1l3n s SER 34 Ca 0.00 0.07 0.03 0.00 0.48 0.00 0.00 55.95 56.54 1l3n s SER 34 Cb 0.00 0.48 -0.02 0.00 0.10 0.00 0.00 66.02 66.58 1l3n s SER 34 CO 0.00 -0.73 -0.17 0.27 0.98 0.00 0.00 173.24 173.60 1l3n s ILE 35 N -2.63 2.79 0.12 -1.02 -0.00 0.06 -0.41 121.20 120.12 1l3n s ILE 35 Ca -0.04 -0.80 0.10 0.00 -0.00 0.00 0.00 60.65 59.91 1l3n s ILE 35 Cb -0.00 -2.10 -0.04 0.00 -0.00 0.00 0.00 42.46 40.32 1l3n s ILE 35 CO -0.03 0.57 -0.25 -1.59 -0.00 0.00 0.00 174.94 173.63 1l3n s LYS 36 N -0.26 1.33 0.00 0.37 -2.85 -0.49 -0.28 119.74 117.56 1l3n s LYS 36 Ca 0.01 -1.30 0.00 0.00 -1.00 0.00 0.00 55.97 53.68 1l3n s LYS 36 Cb -0.13 -1.77 0.00 0.00 -2.06 0.00 0.00 37.83 33.87 1l3n s LYS 36 CO 0.03 0.42 0.00 0.41 0.10 0.00 0.00 175.35 176.31 1l3n n GLY 37 N 0.95 2.48 3.34 0.59 0.00 -1.19 -0.49 105.19 110.86 1l3n n GLY 37 Ca -0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.97 0.51 0.99 1.43 -1.19 -4.39 118.68 115.06 1l3n s LEU 38 Ca 0.00 0.74 0.08 0.00 -1.03 0.00 0.00 54.13 53.92 1l3n s LEU 38 Cb 0.00 -2.17 0.04 0.00 0.03 0.00 0.00 46.19 44.09 1l3n s LEU 38 CO 0.00 -5.29 0.58 0.28 0.23 0.00 0.00 176.35 172.16 1l3n s THR 39 N -2.39 2.26 1.12 5.49 -1.32 -1.26 -3.18 115.64 116.35 1l3n s THR 39 Ca 0.69 -1.19 -0.13 0.00 -1.21 0.00 0.00 61.69 59.86 1l3n s THR 39 Cb -0.11 -2.45 0.26 0.00 -1.51 0.00 0.00 72.50 68.69 1l3n s THR 39 CO 0.57 0.00 1.05 -0.70 -2.21 0.00 0.00 174.62 173.33 1l3n s GLU 40 N -4.42 -0.54 0.07 7.08 2.12 -1.25 -4.60 118.70 117.17 1l3n s GLU 40 Ca 0.51 0.69 0.00 0.00 0.36 0.00 0.00 54.97 56.54 1l3n s GLU 40 Cb -0.05 -1.61 0.00 0.00 0.26 0.00 0.00 34.13 32.73 1l3n s GLU 40 CO 0.31 -3.43 0.00 0.41 -0.54 0.00 0.00 175.26 172.01 1l3n n GLY 41 N 0.13 -2.64 3.78 -1.50 0.00 -0.75 -4.83 105.19 99.38 1l3n n GLY 41 Ca 0.03 -2.01 -0.36 0.00 0.00 0.00 0.00 46.02 43.69 1l3n n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l3n s LEU 42 N 0.00 3.86 -0.01 0.99 2.01 -1.26 -0.17 118.68 124.11 1l3n s LEU 42 Ca 0.00 2.17 -0.02 0.00 0.01 0.00 0.00 54.13 56.29 1l3n s LEU 42 Cb 0.00 -4.46 -0.00 0.00 0.01 0.00 0.00 46.19 41.74 1l3n s LEU 42 CO 0.00 -1.02 0.04 -1.00 1.01 0.00 0.00 176.35 175.38 1l3n s HIS 43 N -1.73 0.03 0.00 0.29 3.76 0.36 -3.26 115.29 114.73 1l3n s HIS 43 Ca 0.68 -0.04 0.00 0.00 -0.15 0.00 0.00 55.06 55.55 1l3n s HIS 43 Cb -0.24 -0.04 0.00 0.00 1.11 0.00 0.00 32.58 33.41 1l3n s HIS 43 CO 0.28 -0.10 0.00 0.41 -0.85 0.00 0.00 174.74 174.48 1l3n n GLY 44 N 2.53 0.00 2.82 -2.22 0.00 0.69 -1.79 105.19 107.23 1l3n n GLY 44 Ca -0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.67 0.23 1.61 5.36 -1.24 -2.57 117.98 120.70 1l3n s PHE 45 Ca 0.00 -0.08 -0.05 0.00 -0.96 0.00 0.00 56.93 55.84 1l3n s PHE 45 Cb 0.00 -0.33 -0.02 0.00 -0.34 0.00 0.00 43.02 42.33 1l3n s PHE 45 CO 0.00 -0.96 0.29 -1.01 -1.46 0.00 0.00 175.22 172.08 1l3n s HIS 46 N 2.28 0.88 -0.12 10.12 3.76 -1.19 -0.63 115.29 130.38 1l3n s HIS 46 Ca 0.11 -1.14 0.14 0.00 -0.15 0.00 0.00 55.06 54.01 1l3n s HIS 46 Cb -0.13 -0.26 -0.19 0.00 1.11 0.00 0.00 32.58 33.10 1l3n s HIS 46 CO -0.27 -0.81 0.11 0.28 -0.85 0.00 0.00 174.74 173.20 1l3n n VAL 47 N -0.34 0.82 -1.25 -0.90 0.31 0.25 -1.48 118.33 115.73 1l3n n VAL 47 Ca 0.01 -0.57 0.17 0.00 -0.01 0.00 0.00 64.34 63.93 1l3n n VAL 47 Cb 0.64 -0.47 -0.05 0.00 -0.91 0.00 0.00 33.84 33.06 1l3n n VAL 47 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1l3n n HIS 48 N -2.45 -3.18 -0.04 3.52 8.25 -1.25 -2.64 115.22 117.44 1l3n n HIS 48 Ca -0.20 1.62 -0.03 0.00 -0.26 0.00 0.00 57.72 58.85 1l3n n HIS 48 Cb 0.87 -2.89 -0.01 0.00 1.12 0.00 0.00 29.99 29.08 1l3n n HIS 48 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1l3n n GLU 49 N -3.91 0.24 -2.77 -0.41 2.13 -1.19 -4.70 120.64 110.03 1l3n n GLU 49 Ca -0.01 0.33 -0.34 0.00 0.66 0.00 0.00 57.16 57.80 1l3n n GLU 49 Cb 0.58 -1.18 -0.06 0.00 0.27 0.00 0.00 31.44 31.05 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 -1.72 3.33 -0.12 4.31 0.08 0.68 -4.74 117.98 119.80 1l3n s PHE 50 Ca -0.09 1.64 0.16 0.00 0.12 0.00 0.00 56.93 58.75 1l3n s PHE 50 Cb 0.01 -2.90 -0.08 0.00 -0.57 0.00 0.00 43.02 39.48 1l3n s PHE 50 CO 0.14 -0.17 1.01 0.78 -0.10 0.00 0.00 175.22 176.88 1l3n h GLY 51 N 2.10 0.00 -1.13 4.36 0.00 -1.78 -3.26 103.07 103.35 1l3n h GLY 51 Ca -0.49 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.38 1l3n h GLY 51 CO 0.61 0.00 0.09 0.51 0.00 0.00 0.00 176.54 177.76 1l3n s ASP 52 N -6.00 1.73 0.00 0.19 -4.77 -1.26 -4.64 116.67 101.92 1l3n s ASP 52 Ca -0.01 1.67 0.00 0.00 -3.30 0.00 0.00 52.55 50.91 1l3n s ASP 52 Cb 0.08 -2.34 0.00 0.00 -1.09 0.00 0.00 42.92 39.57 1l3n s ASP 52 CO 0.79 -3.76 0.50 -3.20 0.70 0.00 0.00 175.17 170.21 1l3n n ASN 53 N -4.64 -0.13 -0.24 2.11 2.85 -1.26 -1.98 115.26 111.97 1l3n n ASN 53 Ca 0.06 -1.01 0.18 0.00 -0.11 0.00 0.00 54.58 53.70 1l3n n ASN 53 Cb 0.54 0.04 0.49 0.00 1.24 0.00 0.00 39.78 42.09 1l3n n ASN 53 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 1l3n h THR 54 N 4.36 0.71 0.00 -0.44 2.02 -1.97 0.27 112.91 117.85 1l3n h THR 54 Ca -0.08 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1l3n h THR 54 Cb 0.94 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.57 1l3n h THR 54 CO -0.04 0.08 0.00 0.00 0.37 0.00 0.00 175.52 175.93 1l3n h ALA 55 N 1.61 1.00 -1.17 6.16 0.00 -1.97 -3.49 119.26 121.40 1l3n h ALA 55 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.37 1l3n h ALA 55 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1l3n h ALA 55 CO -0.18 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.48 1l3n n GLY 56 N 0.89 -1.14 4.00 0.00 0.00 0.94 -4.82 105.19 105.06 1l3n n GLY 56 Ca 0.03 -0.74 -0.35 0.00 0.00 0.00 0.00 46.02 44.96 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 -4.02 0.00 -0.34 0.00 -1.04 -1.26 -4.88 114.28 102.73 1l3n n THR 58 Ca -0.08 0.00 0.14 0.00 -2.04 0.00 0.00 64.05 62.06 1l3n n THR 58 Cb 0.41 -0.16 0.34 0.00 -1.82 0.00 0.00 70.33 69.11 1l3n n THR 58 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1l3n h SER 59 N 0.00 0.75 -0.56 8.00 0.02 -1.84 -0.43 113.55 119.49 1l3n h SER 59 Ca 0.00 0.09 0.21 0.00 -0.84 0.00 0.00 61.79 61.26 1l3n h SER 59 Cb 0.00 -0.04 -0.08 0.00 0.14 0.00 0.00 62.40 62.42 1l3n h SER 59 CO 0.00 0.26 0.33 0.00 -1.14 0.00 0.00 176.83 176.28 1l3n n ALA 60 N -2.35 0.56 0.00 3.77 0.00 -0.84 -4.65 120.51 117.00 1l3n n ALA 60 Ca 0.23 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.14 1l3n n ALA 60 Cb 0.59 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.54 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 -1.17 0.65 2.80 0.00 0.00 -0.17 -0.23 105.19 107.07 1l3n n GLY 61 Ca 0.19 -1.33 -0.33 0.00 0.00 0.00 0.00 46.02 44.56 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 2.07 1.97 -2.89 1.61 -0.04 -1.26 -4.38 135.00 132.07 1l3n n PRO 62 Ca 0.00 -1.73 -0.12 0.00 -0.04 0.00 0.00 63.50 61.62 1l3n n PRO 62 Cb 0.00 -2.71 0.03 0.00 -0.04 0.00 0.00 33.50 30.78 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 5.64 -1.29 0.66 0.54 8.25 -1.26 -4.74 115.22 123.03 1l3n n HIS 63 Ca 0.49 0.42 0.00 0.00 -0.26 0.00 0.00 57.72 58.36 1l3n n HIS 63 Cb 0.26 -2.95 0.00 0.00 1.12 0.00 0.00 29.99 28.42 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 -3.82 0.00 -1.36 4.41 3.72 -1.26 -4.84 117.46 114.30 1l3n n PHE 64 Ca -0.02 -0.22 -0.38 0.00 -0.05 0.00 0.00 57.45 56.78 1l3n n PHE 64 Cb 0.54 -0.15 0.03 0.00 -0.94 0.00 0.00 39.48 38.96 1l3n n PHE 64 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1l3n n ASN 65 N 0.50 -2.02 -0.02 4.37 6.94 -1.26 -4.75 115.26 119.03 1l3n n ASN 65 Ca 0.00 0.68 -0.09 0.00 -0.02 0.00 0.00 54.58 55.15 1l3n n ASN 65 Cb 0.27 -1.06 -0.03 0.00 -2.36 0.00 0.00 39.78 36.60 1l3n n ASN 65 CO 0.00 0.00 0.00 1.55 -1.03 0.00 0.00 177.26 177.78 1l3n h PRO 66 N 0.06 -0.24 -3.26 -0.53 0.13 -1.92 0.74 132.00 126.98 1l3n h PRO 66 Ca -0.44 0.02 -0.59 0.00 -0.87 0.00 0.00 66.00 64.12 1l3n h PRO 66 Cb 1.41 0.06 0.02 0.00 0.13 0.00 0.00 31.00 32.61 1l3n h PRO 66 CO 0.44 -0.16 3.38 1.28 -0.23 0.00 0.00 178.00 182.71 1l3n n LEU 67 N -5.35 7.33 -4.62 1.56 4.32 -1.26 -4.92 117.00 114.06 1l3n n LEU 67 Ca -0.02 -3.86 -0.43 0.00 -0.02 0.00 0.00 56.01 51.68 1l3n n LEU 67 Cb 0.27 -1.41 -0.03 0.00 -1.62 0.00 0.00 43.42 40.62 1l3n n LEU 67 CO 0.18 1.48 1.76 -0.55 -1.22 0.00 0.00 177.39 179.04 1l3n s SER 68 N 2.72 5.83 0.00 -1.43 0.15 0.25 -4.75 113.70 116.48 1l3n s SER 68 Ca 0.59 2.21 0.00 0.00 0.70 0.00 0.00 55.95 59.44 1l3n s SER 68 Cb 0.15 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.94 1l3n s SER 68 CO -0.05 -1.61 0.00 0.54 1.20 0.00 0.00 173.24 173.32 1l3n n ARG 69 N 8.29 0.00 -3.86 5.44 5.12 -1.26 -5.08 116.66 125.32 1l3n n ARG 69 Ca 0.26 0.00 -0.11 0.00 -1.93 0.00 0.00 57.85 56.07 1l3n n ARG 69 Cb 0.43 0.00 -0.09 0.00 -1.16 0.00 0.00 32.46 31.64 1l3n n ARG 69 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1l3n s LYS 70 N 0.00 0.54 -0.08 5.56 1.02 -0.45 -5.07 119.74 121.25 1l3n s LYS 70 Ca 0.00 -0.41 -0.29 0.00 0.02 0.00 0.00 55.97 55.28 1l3n s LYS 70 Cb 0.00 0.22 -0.06 0.00 -0.52 0.00 0.00 37.83 37.48 1l3n s LYS 70 CO 0.00 -0.13 1.81 -1.58 -0.92 0.00 0.00 175.35 174.52 1l3n s HIS 71 N -1.55 1.70 0.00 3.18 5.65 -0.99 -3.05 115.29 120.22 1l3n s HIS 71 Ca -0.13 0.10 0.00 0.00 0.25 0.00 0.00 55.06 55.28 1l3n s HIS 71 Cb -0.06 -4.03 0.00 0.00 -1.18 0.00 0.00 32.58 27.30 1l3n s HIS 71 CO 0.01 -4.22 0.00 0.41 -0.65 0.00 0.00 174.74 170.29 1l3n n GLY 72 N 4.54 4.80 0.00 1.59 0.00 -1.26 -2.47 105.19 112.39 1l3n n GLY 72 Ca 0.20 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.61 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 1.00 0.00 -0.02 0.00 -1.26 -4.68 105.19 100.23 1l3n n GLY 73 Ca 0.00 -0.63 0.01 0.00 0.00 0.00 0.00 46.02 45.39 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 0.01 0.05 1.61 -0.04 -1.25 -0.52 135.00 134.87 1l3n n PRO 74 Ca 0.00 0.33 -0.03 0.00 -0.04 0.00 0.00 63.50 63.76 1l3n n PRO 74 Cb 0.00 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 31.88 1l3n n PRO 74 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1l3n h LYS 75 N 0.00 0.00 -6.22 0.54 1.79 -1.92 -3.47 116.57 107.29 1l3n h LYS 75 Ca 0.00 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 57.89 1l3n h LYS 75 Cb 0.01 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 30.59 1l3n h LYS 75 CO 0.00 0.56 -0.58 0.34 -1.08 0.00 0.00 179.45 178.69 1l3n s ASP 76 N -6.24 5.38 0.18 0.86 -1.08 0.32 -5.01 116.67 111.09 1l3n s ASP 76 Ca -0.01 -0.18 0.17 0.00 -0.52 0.00 0.00 52.55 52.01 1l3n s ASP 76 Cb 0.09 -1.36 -0.02 0.00 -1.46 0.00 0.00 42.92 40.16 1l3n s ASP 76 CO 0.80 0.07 1.14 -0.33 0.52 0.00 0.00 175.17 177.38 1l3n h GLU 77 N 2.47 0.00 -0.63 4.34 5.08 -1.91 -3.37 114.58 120.56 1l3n h GLU 77 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1l3n h GLU 77 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1l3n h GLU 77 CO 0.62 0.34 0.00 -0.85 -1.00 0.00 0.00 179.01 178.13 1l3n n GLU 78 N -3.02 3.60 -1.33 2.33 0.28 -1.26 -4.99 120.64 116.25 1l3n n GLU 78 Ca -0.03 -2.84 -0.39 0.00 -0.16 0.00 0.00 57.16 53.74 1l3n n GLU 78 Cb 0.76 -1.84 0.02 0.00 1.43 0.00 0.00 31.44 31.80 1l3n n GLU 78 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86 1l3n n ARG 79 N 1.08 0.18 -0.82 3.44 1.85 -1.24 -1.34 116.66 119.80 1l3n n ARG 79 Ca 0.25 0.07 -0.09 0.00 -1.00 0.00 0.00 57.85 57.08 1l3n n ARG 79 Cb 0.85 -1.24 -0.13 0.00 -1.05 0.00 0.00 32.46 30.89 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 -1.52 0.00 -3.73 2.89 8.25 -1.17 -4.69 115.22 115.24 1l3n n HIS 80 Ca 0.09 -1.26 -0.22 0.00 -0.26 0.00 0.00 57.72 56.08 1l3n n HIS 80 Cb 0.47 -1.34 -0.07 0.00 1.12 0.00 0.00 29.99 30.17 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 2.45 -0.64 0.00 1.59 0.31 -1.26 -4.37 118.33 116.41 1l3n n VAL 81 Ca 0.33 -0.32 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 1l3n n VAL 81 Cb 0.76 -0.66 0.00 0.00 -0.91 0.00 0.00 33.84 33.03 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 -2.01 0.00 3.12 2.92 0.00 -1.26 -4.86 105.19 103.09 1l3n n GLY 82 Ca -0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 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 4.39 0.13 1.61 1.01 -1.26 -0.59 116.67 121.97 1l3n s ASP 83 Ca 0.00 -1.21 0.07 0.00 0.71 0.00 0.00 52.55 52.13 1l3n s ASP 83 Cb 0.00 -1.60 -0.17 0.00 1.01 0.00 0.00 42.92 42.16 1l3n s ASP 83 CO 0.00 -0.18 1.30 -0.07 0.21 0.00 0.00 175.17 176.44 1l3n h LEU 84 N 7.88 0.00 0.00 1.23 3.38 -1.20 -3.31 115.31 123.29 1l3n h LEU 84 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1l3n h LEU 84 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1l3n h LEU 84 CO 0.51 0.97 0.00 0.61 0.09 0.00 0.00 178.44 180.62 1l3n n GLY 85 N 1.28 2.28 3.44 0.83 0.00 -0.39 -4.33 105.19 108.30 1l3n n GLY 85 Ca -0.00 -0.74 -0.14 0.00 0.00 0.00 0.00 46.02 45.14 1l3n n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1l3n s ASN 86 N -4.00 -0.54 -0.03 1.61 0.01 -1.26 -3.70 114.94 107.02 1l3n s ASN 86 Ca 0.00 0.90 0.03 0.00 -0.71 0.00 0.00 52.86 53.07 1l3n s ASN 86 Cb 0.00 0.90 0.00 0.00 0.41 0.00 0.00 41.25 42.57 1l3n s ASN 86 CO 0.00 -0.32 -0.11 0.68 -1.51 0.00 0.00 177.10 175.85 1l3n s VAL 87 N -0.24 0.92 -0.51 1.60 -7.23 -0.74 -4.86 120.40 109.33 1l3n s VAL 87 Ca -0.04 -0.43 -0.29 0.00 -1.81 0.00 0.00 61.98 59.41 1l3n s VAL 87 Cb -0.03 -0.81 0.03 0.00 0.56 0.00 0.00 36.38 36.12 1l3n s VAL 87 CO 0.03 0.28 1.20 -0.89 -0.31 0.00 0.00 175.10 175.41 1l3n s THR 88 N 0.21 4.09 -0.08 5.32 2.01 -1.26 -0.49 115.64 125.44 1l3n s THR 88 Ca -0.04 1.06 -0.21 0.00 0.31 0.00 0.00 61.69 62.80 1l3n s THR 88 Cb -0.10 -4.60 -0.04 0.00 0.01 0.00 0.00 72.50 67.77 1l3n s THR 88 CO 0.01 -1.11 0.62 0.00 -0.69 0.00 0.00 174.62 173.45 1l3n s ALA 89 N 4.81 3.39 1.16 7.40 0.00 0.77 -3.94 121.76 135.35 1l3n s ALA 89 Ca 0.48 0.02 -0.13 0.00 0.00 0.00 0.00 51.96 52.33 1l3n s ALA 89 Cb -0.08 -2.84 0.28 0.00 0.00 0.00 0.00 23.12 20.48 1l3n s ALA 89 CO 0.30 -0.06 0.98 -3.47 0.00 0.00 0.00 175.76 173.51 1l3n n ASP 90 N 3.70 -1.66 -0.03 0.00 2.03 0.09 -1.81 116.55 118.88 1l3n n ASP 90 Ca -0.04 -0.13 0.22 0.00 0.52 0.00 0.00 54.79 55.36 1l3n n ASP 90 Cb 0.51 -1.26 0.70 0.00 -0.72 0.00 0.00 41.12 40.35 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 -2.64 0.00 0.00 -0.67 5.09 -1.90 0.16 116.57 116.61 1l3n h LYS 91 Ca -0.60 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.14 1l3n h LYS 91 Cb 1.33 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.66 1l3n h LYS 91 CO 0.48 0.00 0.00 -0.25 -2.09 0.00 0.00 179.45 177.59 1l3n n ASP 92 N -4.33 0.00 0.00 7.07 9.92 -1.26 -4.54 116.55 123.41 1l3n n ASP 92 Ca 0.11 -0.39 0.00 0.00 -0.53 0.00 0.00 54.79 53.98 1l3n n ASP 92 Cb 0.67 -0.18 0.00 0.00 -0.64 0.00 0.00 41.12 40.97 1l3n n ASP 92 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1l3n n GLY 93 N 0.92 0.78 3.55 0.44 0.00 0.56 -3.80 105.19 107.64 1l3n n GLY 93 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.97 3.72 -0.26 1.61 1.01 -1.25 -3.16 120.40 119.10 1l3n s VAL 94 Ca 0.00 0.14 -0.10 0.00 0.00 0.00 0.00 61.98 62.02 1l3n s VAL 94 Cb 0.00 -4.84 -0.05 0.00 0.00 0.00 0.00 36.38 31.50 1l3n s VAL 94 CO 0.00 -1.77 0.15 0.00 0.00 0.00 0.00 175.10 173.49 1l3n s ALA 95 N 6.00 3.48 -0.19 5.51 0.00 0.61 -0.73 121.76 136.44 1l3n s ALA 95 Ca 0.41 -1.02 -0.14 0.00 0.00 0.00 0.00 51.96 51.21 1l3n s ALA 95 Cb -0.07 -2.34 -0.04 0.00 0.00 0.00 0.00 23.12 20.67 1l3n s ALA 95 CO 0.10 -0.40 0.31 0.34 0.00 0.00 0.00 175.76 176.11 1l3n s ASP 96 N 1.46 6.38 -0.08 0.00 2.15 -1.25 -0.76 116.67 124.57 1l3n s ASP 96 Ca 0.07 0.44 -0.01 0.00 0.43 0.00 0.00 52.55 53.48 1l3n s ASP 96 Cb -0.15 -2.19 -0.03 0.00 -0.30 0.00 0.00 42.92 40.25 1l3n s ASP 96 CO 0.07 0.03 -0.04 -0.69 -0.17 0.00 0.00 175.17 174.37 1l3n s VAL 97 N 0.89 3.98 -0.47 1.11 1.01 0.51 -4.68 120.40 122.76 1l3n s VAL 97 Ca 0.16 -0.37 0.06 0.00 0.00 0.00 0.00 61.98 61.83 1l3n s VAL 97 Cb -0.14 -2.65 0.24 0.00 0.00 0.00 0.00 36.38 33.83 1l3n s VAL 97 CO 0.05 0.60 0.82 -1.54 0.00 0.00 0.00 175.10 175.03 1l3n n SER 98 N 2.25 -2.38 -4.86 3.32 3.41 -1.25 -0.58 113.62 113.52 1l3n n SER 98 Ca -0.18 -3.18 -0.21 0.00 -0.26 0.00 0.00 58.87 55.03 1l3n n SER 98 Cb 0.53 1.39 -0.03 0.00 -0.26 0.00 0.00 64.21 65.84 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 0.37 3.10 -0.23 -1.33 -1.09 0.20 -4.93 121.20 117.29 1l3n s ILE 99 Ca 0.32 -1.36 -0.09 0.00 -2.23 0.00 0.00 60.65 57.29 1l3n s ILE 99 Cb 0.21 -3.09 0.09 0.00 -1.58 0.00 0.00 42.46 38.10 1l3n s ILE 99 CO -0.22 -0.09 0.52 -0.70 -1.23 0.00 0.00 174.94 173.22 1l3n s GLU 100 N -4.06 0.46 0.11 2.79 2.12 -1.26 -0.18 118.70 118.68 1l3n s GLU 100 Ca 0.44 1.14 -0.19 0.00 0.36 0.00 0.00 54.97 56.72 1l3n s GLU 100 Cb -0.05 0.40 0.05 0.00 0.26 0.00 0.00 34.13 34.79 1l3n s GLU 100 CO 0.27 -0.21 0.48 0.34 -0.54 0.00 0.00 175.26 175.60 1l3n s ASP 101 N 2.34 -0.37 -0.02 -1.70 -1.08 -0.95 -5.01 116.67 109.89 1l3n s ASP 101 Ca -0.05 -0.09 0.15 0.00 -0.52 0.00 0.00 52.55 52.03 1l3n s ASP 101 Cb -0.10 0.50 -0.23 0.00 -1.46 0.00 0.00 42.92 41.63 1l3n s ASP 101 CO -0.16 -0.83 0.35 -1.54 0.52 0.00 0.00 175.17 173.51 1l3n n SER 102 N -0.04 1.50 0.07 -0.34 3.41 -1.26 -0.44 113.62 116.52 1l3n n SER 102 Ca -0.17 -0.04 -0.19 0.00 -0.26 0.00 0.00 58.87 58.21 1l3n n SER 102 Cb 0.63 1.66 -0.11 0.00 -0.26 0.00 0.00 64.21 66.13 1l3n n SER 102 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1l3n h VAL 103 N 0.00 1.32 0.00 -3.33 2.07 -1.98 -3.29 116.25 111.04 1l3n h VAL 103 Ca 0.00 -2.44 -0.33 0.00 0.82 0.00 0.00 66.70 64.75 1l3n h VAL 103 Cb 0.68 2.57 -0.02 0.00 -1.52 0.00 0.00 31.29 32.99 1l3n h VAL 103 CO 0.00 0.74 1.35 2.30 0.02 0.00 0.00 177.57 181.98 1l3n n ILE 104 N -3.78 2.91 -2.27 4.57 -0.00 -1.26 -4.85 119.36 114.68 1l3n n ILE 104 Ca -0.11 -1.60 -0.38 0.00 -0.00 0.00 0.00 62.75 60.66 1l3n n ILE 104 Cb 0.93 -2.13 -0.01 0.00 -0.00 0.00 0.00 39.64 38.43 1l3n n ILE 104 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.55 176.11 1l3n s SER 105 N 2.42 6.36 0.18 7.28 0.01 -1.24 -4.65 113.70 124.06 1l3n s SER 105 Ca 0.55 2.34 -0.19 0.00 1.31 0.00 0.00 55.95 59.96 1l3n s SER 105 Cb 0.21 -2.61 0.13 0.00 0.21 0.00 0.00 66.02 63.96 1l3n s SER 105 CO -0.02 -0.79 1.61 -0.07 0.41 0.00 0.00 173.24 174.38 1l3n h LEU 106 N 2.38 -0.92 -7.57 2.44 3.38 -1.92 0.08 115.31 113.17 1l3n h LEU 106 Ca -0.49 0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.60 1l3n h LEU 106 Cb 1.24 0.48 -0.14 0.00 0.09 0.00 0.00 40.66 42.32 1l3n h LEU 106 CO 0.61 -0.28 -0.22 -0.44 0.09 0.00 0.00 178.44 178.21 1l3n s SER 107 N -5.15 -0.09 0.00 -0.43 0.01 -1.26 -2.00 113.70 104.79 1l3n s SER 107 Ca -0.14 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.73 1l3n s SER 107 Cb 0.16 0.40 0.00 0.00 0.21 0.00 0.00 66.02 66.78 1l3n s SER 107 CO 0.70 -0.74 0.00 0.61 0.41 0.00 0.00 173.24 174.22 1l3n n GLY 108 N 0.07 -0.46 2.06 3.44 0.00 -1.26 -4.77 105.19 104.27 1l3n n GLY 108 Ca -0.16 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1l3n n GLY 108 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1l3n n ASP 109 N 0.00 -1.13 0.02 1.61 -0.08 -1.26 -4.93 116.55 110.78 1l3n n ASP 109 Ca 0.00 0.27 -0.14 0.00 -1.51 0.00 0.00 54.79 53.41 1l3n n ASP 109 Cb 0.00 1.33 -0.04 0.00 2.34 0.00 0.00 41.12 44.76 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 0.82 -5.87 -0.67 3.86 -1.89 -3.48 115.15 107.92 1l3n h HIS 110 Ca 0.00 -0.39 0.00 0.00 -1.16 0.00 0.00 60.37 58.83 1l3n h HIS 110 Cb 0.00 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 1l3n h HIS 110 CO 0.00 1.19 -0.94 0.45 0.86 0.00 0.00 177.93 179.49 1l3n n SER 111 N -3.86 -6.76 0.21 2.45 2.88 -1.24 -4.91 113.62 102.39 1l3n n SER 111 Ca -0.07 0.85 0.06 0.00 -1.33 0.00 0.00 58.87 58.38 1l3n n SER 111 Cb 0.76 -3.00 0.46 0.00 -0.75 0.00 0.00 64.21 61.68 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 3.61 0.95 -1.76 2.46 3.07 -0.59 -3.43 117.51 121.82 1l3n h ILE 112 Ca -0.04 -1.13 -0.68 0.00 1.55 0.00 0.00 64.86 64.57 1l3n h ILE 112 Cb 0.60 1.66 0.04 0.00 -0.27 0.00 0.00 36.82 38.85 1l3n h ILE 112 CO 0.03 0.29 0.69 -0.38 -1.05 0.00 0.00 178.15 177.73 1l3n n ILE 113 N -3.80 0.14 -0.96 0.16 2.08 -0.85 -0.55 119.36 115.58 1l3n n ILE 113 Ca -0.01 -0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.27 1l3n n ILE 113 Cb 0.39 -1.13 0.00 0.00 -0.75 0.00 0.00 39.64 38.15 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 3.29 0.46 3.75 7.39 0.00 -0.48 -4.99 105.19 114.61 1l3n n GLY 114 Ca 0.21 -0.50 -0.26 0.00 0.00 0.00 0.00 46.02 45.47 1l3n n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l3n n ARG 115 N -2.96 -0.86 -3.64 1.61 5.12 0.28 -3.06 116.66 113.15 1l3n n ARG 115 Ca 0.00 -2.21 -0.28 0.00 -1.93 0.00 0.00 57.85 53.42 1l3n n ARG 115 Cb 0.00 -1.09 -0.16 0.00 -1.16 0.00 0.00 32.46 30.05 1l3n n ARG 115 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1l3n s THR 116 N -3.53 0.28 0.42 0.55 2.01 -1.08 -0.71 115.64 113.58 1l3n s THR 116 Ca 0.70 -0.75 -0.24 0.00 0.31 0.00 0.00 61.69 61.72 1l3n s THR 116 Cb -0.02 -1.07 -0.08 0.00 0.01 0.00 0.00 72.50 71.33 1l3n s THR 116 CO 0.48 -0.51 1.10 -0.76 -0.69 0.00 0.00 174.62 174.24 1l3n s LEU 117 N 1.94 4.09 -0.05 4.42 1.02 0.55 -4.00 118.68 126.65 1l3n s LEU 117 Ca 0.05 2.16 0.03 0.00 0.02 0.00 0.00 54.13 56.39 1l3n s LEU 117 Cb -0.17 -4.20 0.01 0.00 0.02 0.00 0.00 46.19 41.85 1l3n s LEU 117 CO -0.22 -0.67 -0.12 -0.69 0.02 0.00 0.00 176.35 174.66 1l3n s VAL 118 N -1.61 1.11 -0.14 -1.59 1.01 -0.55 -0.67 120.40 117.96 1l3n s VAL 118 Ca 0.60 -0.49 -0.08 0.00 0.00 0.00 0.00 61.98 62.01 1l3n s VAL 118 Cb -0.25 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.09 1l3n s VAL 118 CO 0.31 0.34 0.15 0.54 0.00 0.00 0.00 175.10 176.44 1l3n s VAL 119 N 0.48 5.46 0.28 2.92 0.11 -0.44 -3.20 120.40 126.01 1l3n s VAL 119 Ca -0.11 0.23 0.10 0.00 -2.93 0.00 0.00 61.98 59.28 1l3n s VAL 119 Cb -0.14 -3.44 -0.05 0.00 -1.53 0.00 0.00 36.38 31.23 1l3n s VAL 119 CO 0.03 0.56 -0.04 -1.00 -3.33 0.00 0.00 175.10 171.32 1l3n s HIS 120 N -0.60 2.60 0.06 1.54 3.76 -1.06 -1.51 115.29 120.07 1l3n s HIS 120 Ca 0.13 -0.27 -0.37 0.00 -0.15 0.00 0.00 55.06 54.40 1l3n s HIS 120 Cb -0.12 -1.20 -0.20 0.00 1.11 0.00 0.00 32.58 32.17 1l3n s HIS 120 CO 0.03 0.62 1.53 1.49 -0.85 0.00 0.00 174.74 177.56 1l3n h GLU 121 N 1.95 -1.28 -6.87 1.40 4.81 -1.60 -3.27 114.58 109.72 1l3n h GLU 121 Ca -0.43 0.09 -0.46 0.00 -0.13 0.00 0.00 59.36 58.42 1l3n h GLU 121 Cb 1.25 0.29 0.04 0.00 0.63 0.00 0.00 28.75 30.96 1l3n h GLU 121 CO 0.61 -0.85 0.02 0.15 -0.73 0.00 0.00 179.01 178.21 1l3n s LYS 122 N -5.87 2.99 0.42 1.92 1.02 -0.01 -4.68 119.74 115.53 1l3n s LYS 122 Ca -0.19 -0.30 -0.23 0.00 0.02 0.00 0.00 55.97 55.27 1l3n s LYS 122 Cb 0.02 -2.44 -0.09 0.00 -0.52 0.00 0.00 37.83 34.80 1l3n s LYS 122 CO 0.58 -0.46 1.02 0.00 -0.92 0.00 0.00 175.35 175.57 1l3n s ALA 123 N -2.74 3.03 -0.07 5.17 0.00 -1.20 -0.22 121.76 125.72 1l3n s ALA 123 Ca 0.51 0.60 -0.08 0.00 0.00 0.00 0.00 51.96 52.99 1l3n s ALA 123 Cb -0.10 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.74 1l3n s ALA 123 CO 0.41 -0.14 0.21 -0.51 0.00 0.00 0.00 175.76 175.73 1l3n s ASP 124 N -1.80 6.48 0.51 0.00 1.01 -1.26 -4.49 116.67 117.11 1l3n s ASP 124 Ca 0.61 0.56 0.30 0.00 0.71 0.00 0.00 52.55 54.73 1l3n s ASP 124 Cb -0.18 -2.10 1.08 0.00 1.01 0.00 0.00 42.92 42.74 1l3n s ASP 124 CO 0.22 0.36 1.88 0.44 0.21 0.00 0.00 175.17 178.28 1l3n h ASP 125 N 4.68 0.00 -6.13 0.27 3.32 -1.09 -3.46 116.42 114.01 1l3n h ASP 125 Ca -0.53 0.00 -0.44 0.00 0.02 0.00 0.00 57.03 56.08 1l3n h ASP 125 Cb 1.22 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.80 1l3n h ASP 125 CO 0.61 0.05 -0.76 0.18 -1.72 0.00 0.00 179.24 177.60 1l3n n LEU 126 N -3.15 -2.92 0.00 1.55 4.77 -1.26 -2.45 117.00 113.53 1l3n n LEU 126 Ca 0.01 -0.73 0.00 0.00 -0.03 0.00 0.00 56.01 55.26 1l3n n LEU 126 Cb 0.38 -2.71 0.00 0.00 -2.33 0.00 0.00 43.42 38.75 1l3n n LEU 126 CO 0.30 0.49 0.00 0.61 -1.33 0.00 0.00 177.39 177.46 1l3n n GLY 127 N -1.71 2.13 0.00 -0.72 0.00 -1.03 -4.45 105.19 99.41 1l3n n GLY 127 Ca -0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.10 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 0.65 0.19 1.61 5.02 -1.03 -2.90 118.16 119.71 1l3n n LYS 128 Ca 0.00 0.02 0.14 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 4.22 0.00 -6.24 0.72 0.00 -1.88 -3.46 103.07 96.43 1l3n h GLY 129 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.87 1l3n h GLY 129 CO 0.00 0.00 -0.76 0.61 0.00 0.00 0.00 176.54 176.39 1l3n n GLY 130 N -0.47 -0.49 3.34 4.60 0.00 -1.14 -4.87 105.19 106.16 1l3n n GLY 130 Ca 0.00 0.20 -0.18 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.39 2.31 0.15 1.61 0.01 -1.26 -4.96 114.94 109.41 1l3n s ASN 131 Ca 0.61 -1.09 -0.18 0.00 -0.71 0.00 0.00 52.86 51.49 1l3n s ASN 131 Cb -0.30 -0.09 0.05 0.00 0.41 0.00 0.00 41.25 41.32 1l3n s ASN 131 CO 0.82 -0.30 1.68 -0.08 -1.51 0.00 0.00 177.10 177.71 1l3n h GLU 132 N 2.54 -0.01 -0.73 -0.60 4.22 -1.98 -0.40 114.58 117.61 1l3n h GLU 132 Ca -0.38 0.00 0.12 0.00 0.08 0.00 0.00 59.36 59.18 1l3n h GLU 132 Cb 1.22 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.39 1l3n h GLU 132 CO 0.64 -0.01 0.32 1.49 -2.18 0.00 0.00 179.01 179.27 1l3n h GLU 133 N -0.01 0.49 -0.94 1.92 4.57 -1.98 -1.48 114.58 117.15 1l3n h GLU 133 Ca 0.16 -0.03 0.06 0.00 -1.18 0.00 0.00 59.36 58.37 1l3n h GLU 133 Cb 0.25 -0.11 -0.06 0.00 -0.16 0.00 0.00 28.75 28.67 1l3n h GLU 133 CO -0.34 0.33 0.61 0.66 -1.18 0.00 0.00 179.01 179.09 1l3n h SER 134 N 0.51 0.96 -0.14 1.04 4.64 -1.41 0.16 113.55 119.31 1l3n h SER 134 Ca 0.38 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1l3n h SER 134 Cb 0.51 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1l3n h SER 134 CO -0.34 0.62 0.00 1.07 -0.87 0.00 0.00 176.83 177.31 1l3n n THR 135 N -4.49 0.19 0.00 2.95 5.66 -0.61 -1.93 114.28 116.04 1l3n n THR 135 Ca 0.14 -0.24 0.00 0.00 -3.05 0.00 0.00 64.05 60.90 1l3n n THR 135 Cb 0.19 0.13 0.00 0.00 -1.55 0.00 0.00 70.33 69.10 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 -0.01 0.00 0.01 1.09 4.76 0.43 -2.35 118.16 122.08 1l3n n LYS 136 Ca 0.13 0.00 0.11 0.00 -2.87 0.00 0.00 58.31 55.68 1l3n n LYS 136 Cb 0.21 0.00 0.02 0.00 -1.84 0.00 0.00 35.03 33.42 1l3n n LYS 136 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1l3n n THR 137 N -0.68 0.06 -2.09 -0.18 -2.24 -0.43 -4.64 114.28 104.08 1l3n n THR 137 Ca 0.00 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1l3n n THR 137 Cb 0.00 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 1l3n n THR 137 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l3n n GLY 138 N 1.44 0.58 3.81 3.38 0.00 -0.81 -3.97 105.19 109.62 1l3n n GLY 138 Ca 0.03 -0.80 -0.26 0.00 0.00 0.00 0.00 46.02 44.99 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 1.80 -3.15 0.00 1.61 3.02 -1.24 -0.56 115.26 116.73 1l3n n ASN 139 Ca 0.00 -0.79 0.08 0.00 -0.03 0.00 0.00 54.58 53.83 1l3n n ASN 139 Cb 0.49 -3.98 0.44 0.00 -0.61 0.00 0.00 39.78 36.11 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 -4.51 2.00 0.00 5.41 0.00 -1.25 -4.74 120.51 117.41 1l3n n ALA 140 Ca -0.12 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1l3n n ALA 140 Cb 0.60 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 0.01 2.07 3.82 0.00 0.00 -1.26 -0.83 105.19 109.00 1l3n n GLY 141 Ca 0.10 -0.47 -0.04 0.00 0.00 0.00 0.00 46.02 45.62 1l3n n GLY 141 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1l3n s SER 142 N 0.00 -0.07 -0.51 1.61 0.01 -1.26 -5.00 113.70 108.48 1l3n s SER 142 Ca 0.00 -0.61 -0.10 0.00 1.31 0.00 0.00 55.95 56.55 1l3n s SER 142 Cb 0.00 0.53 0.13 0.00 0.21 0.00 0.00 66.02 66.89 1l3n s SER 142 CO 0.00 -1.02 0.40 -0.13 0.41 0.00 0.00 173.24 172.90 1l3n s ARG 143 N -2.63 2.61 0.18 12.44 0.52 -1.26 -3.54 118.95 127.26 1l3n s ARG 143 Ca 0.17 -1.84 0.16 0.00 -0.52 0.00 0.00 55.73 53.70 1l3n s ARG 143 Cb -0.02 -3.99 -0.03 0.00 0.52 0.00 0.00 34.95 31.42 1l3n s ARG 143 CO 0.05 -1.22 1.15 -0.07 0.02 0.00 0.00 175.30 175.23 1l3n h LEU 144 N 8.40 0.00 -7.00 2.53 -0.00 -1.61 -3.46 115.31 114.16 1l3n h LEU 144 Ca -0.19 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.65 1l3n h LEU 144 Cb 1.07 0.00 -0.21 0.00 -0.00 0.00 0.00 40.66 41.52 1l3n h LEU 144 CO 0.87 0.52 0.12 0.00 -0.00 0.00 0.00 178.44 179.96 1l3n s ALA 145 N -2.96 -1.79 0.05 1.53 0.00 -1.12 -1.44 121.76 116.04 1l3n s ALA 145 Ca 0.01 2.06 0.09 0.00 0.00 0.00 0.00 51.96 54.11 1l3n s ALA 145 Cb 0.08 -1.20 -0.03 0.00 0.00 0.00 0.00 23.12 21.97 1l3n s ALA 145 CO 0.78 -0.34 -0.24 0.00 0.00 0.00 0.00 175.76 175.95 1l3n s GLY 147 N -1.33 -0.13 -0.11 0.00 0.00 0.15 -0.87 107.32 105.04 1l3n s GLY 147 Ca 0.13 0.76 -0.13 0.00 0.00 0.00 0.00 44.72 45.48 1l3n s GLY 147 CO 0.03 0.89 0.32 0.14 0.00 0.00 0.00 173.10 174.47 1l3n s VAL 148 N 0.75 5.25 -0.29 1.40 1.01 -1.26 -0.33 120.40 126.94 1l3n s VAL 148 Ca -0.05 0.61 -0.29 0.00 0.00 0.00 0.00 61.98 62.24 1l3n s VAL 148 Cb -0.07 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.68 1l3n s VAL 148 CO -0.04 0.46 1.26 -0.63 0.00 0.00 0.00 175.10 176.15 1l3n s ILE 149 N -0.12 4.22 -0.08 2.22 1.01 0.11 -4.48 121.20 124.07 1l3n s ILE 149 Ca 0.19 1.40 0.02 0.00 0.00 0.00 0.00 60.65 62.25 1l3n s ILE 149 Cb -0.14 -4.18 -0.02 0.00 0.01 0.00 0.00 42.46 38.12 1l3n s ILE 149 CO 0.07 -0.44 -0.11 -0.83 0.00 0.00 0.00 174.94 173.63 1l3n s GLY 150 N 2.50 1.59 0.30 6.18 0.00 -0.69 -1.38 107.32 115.82 1l3n s GLY 150 Ca 0.54 -0.92 -0.29 0.00 0.00 0.00 0.00 44.72 44.05 1l3n s GLY 150 CO 0.21 -0.56 1.29 1.39 0.00 0.00 0.00 173.10 175.43 1l3n n ILE 151 N 2.66 1.69 0.00 0.90 5.41 -1.26 -0.85 119.36 127.91 1l3n n ILE 151 Ca -0.18 -0.42 0.00 0.00 1.00 0.00 0.00 62.75 63.15 1l3n n ILE 151 Cb 0.52 -1.47 0.00 0.00 -0.71 0.00 0.00 39.64 37.98 1l3n n ILE 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1l3n n ALA 152 N 0.79 2.78 -0.65 -1.39 0.00 -0.10 -4.77 120.51 117.15 1l3n n ALA 152 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1l3n n ALA 152 Cb 0.34 0.41 0.00 0.00 0.00 0.00 0.00 19.45 20.20 1l3n n ALA 152 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44