#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l3n n THR 2 N 0.00 1.49 -3.79 0.00 5.66 -1.26 -4.64 114.28 111.73 1l3n n THR 2 Ca 0.00 -0.77 -0.12 0.00 -3.05 0.00 0.00 64.05 60.10 1l3n n THR 2 Cb 0.00 -0.87 -0.09 0.00 -1.55 0.00 0.00 70.33 67.83 1l3n n THR 2 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 1l3n s LYS 3 N -2.52 0.66 0.04 1.09 2.20 -1.24 -0.39 119.74 119.58 1l3n s LYS 3 Ca -0.15 -0.36 -0.03 0.00 -0.36 0.00 0.00 55.97 55.07 1l3n s LYS 3 Cb 0.07 0.29 -0.02 0.00 -1.51 0.00 0.00 37.83 36.66 1l3n s LYS 3 CO 0.78 -0.19 0.04 0.00 -0.36 0.00 0.00 175.35 175.63 1l3n s ALA 4 N -1.75 0.11 0.11 3.13 0.00 0.20 -1.32 121.76 122.24 1l3n s ALA 4 Ca -0.11 -0.73 0.07 0.00 0.00 0.00 0.00 51.96 51.19 1l3n s ALA 4 Cb -0.04 0.24 -0.04 0.00 0.00 0.00 0.00 23.12 23.29 1l3n s ALA 4 CO 0.01 -0.31 -0.18 0.54 0.00 0.00 0.00 175.76 175.82 1l3n s VAL 5 N -2.77 1.55 -0.10 0.00 0.11 0.24 -0.68 120.40 118.76 1l3n s VAL 5 Ca -0.04 -1.57 -0.03 0.00 -2.93 0.00 0.00 61.98 57.41 1l3n s VAL 5 Cb -0.00 -1.49 0.04 0.00 -1.53 0.00 0.00 36.38 33.39 1l3n s VAL 5 CO -0.06 -0.18 0.05 0.00 -3.33 0.00 0.00 175.10 171.59 1l3n s ALA 6 N -1.45 0.45 -0.63 1.54 0.00 -1.19 -0.25 121.76 120.23 1l3n s ALA 6 Ca 0.06 -0.09 -0.27 0.00 0.00 0.00 0.00 51.96 51.66 1l3n s ALA 6 Cb -0.09 -0.81 0.03 0.00 0.00 0.00 0.00 23.12 22.26 1l3n s ALA 6 CO 0.04 -0.74 1.18 0.54 0.00 0.00 0.00 175.76 176.78 1l3n s VAL 7 N 2.09 3.98 -0.32 0.00 0.11 -1.26 -2.77 120.40 122.24 1l3n s VAL 7 Ca 0.04 0.59 -0.25 0.00 -2.93 0.00 0.00 61.98 59.42 1l3n s VAL 7 Cb -0.14 -4.76 0.01 0.00 -1.53 0.00 0.00 36.38 29.96 1l3n s VAL 7 CO -0.06 -1.49 0.87 -0.76 -3.33 0.00 0.00 175.10 170.34 1l3n s LEU 8 N 5.03 4.05 0.06 2.54 1.02 0.59 -3.85 118.68 128.12 1l3n s LEU 8 Ca 0.37 0.73 0.01 0.00 0.02 0.00 0.00 54.13 55.26 1l3n s LEU 8 Cb -0.09 -3.21 -0.03 0.00 0.02 0.00 0.00 46.19 42.88 1l3n s LEU 8 CO 0.20 -0.72 -0.05 -0.54 0.02 0.00 0.00 176.35 175.27 1l3n s LYS 9 N 3.19 0.61 0.16 1.70 1.02 -0.38 -0.23 119.74 125.81 1l3n s LYS 9 Ca 0.36 -1.04 0.00 0.00 0.02 0.00 0.00 55.97 55.31 1l3n s LYS 9 Cb -0.13 -0.05 0.00 0.00 -0.52 0.00 0.00 37.83 37.13 1l3n s LYS 9 CO 0.14 -0.04 0.00 0.41 -0.92 0.00 0.00 175.35 174.95 1l3n n GLY 10 N 0.63 -1.84 0.16 -3.33 0.00 -1.25 -0.95 105.19 98.61 1l3n n GLY 10 Ca -0.17 0.46 -0.16 0.00 0.00 0.00 0.00 46.02 46.15 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 0.58 0.00 1.61 5.19 -1.81 -3.49 116.42 118.50 1l3n h ASP 11 Ca 0.00 -0.66 0.00 0.00 -0.62 0.00 0.00 57.03 55.75 1l3n h ASP 11 Cb 0.00 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 39.34 1l3n h ASP 11 CO 0.00 1.15 0.00 0.61 -3.12 0.00 0.00 179.24 177.88 1l3n n GLY 12 N 0.76 2.35 0.36 2.75 0.00 -1.26 -4.90 105.19 105.26 1l3n n GLY 12 Ca -0.08 -0.46 0.03 0.00 0.00 0.00 0.00 46.02 45.51 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 0.96 -5.70 1.61 0.13 -1.92 -3.37 132.00 123.72 1l3n h PRO 13 Ca 0.00 -0.06 -0.37 0.00 -0.87 0.00 0.00 66.00 64.70 1l3n h PRO 13 Cb 0.00 -0.22 -0.01 0.00 0.13 0.00 0.00 31.00 30.90 1l3n h PRO 13 CO 0.00 0.64 1.14 0.08 -0.23 0.00 0.00 178.00 179.62 1l3n s VAL 14 N -5.86 3.18 -0.15 1.56 1.01 -1.25 -3.93 120.40 114.95 1l3n s VAL 14 Ca -0.11 0.01 0.02 0.00 0.00 0.00 0.00 61.98 61.90 1l3n s VAL 14 Cb 0.19 -3.45 0.01 0.00 0.00 0.00 0.00 36.38 33.14 1l3n s VAL 14 CO 0.79 -0.43 -0.21 -1.10 0.00 0.00 0.00 175.10 174.15 1l3n s GLN 15 N 7.82 2.96 -0.07 2.72 -0.21 -0.12 -3.89 119.66 128.88 1l3n s GLN 15 Ca 0.83 -0.83 0.04 0.00 0.02 0.00 0.00 55.36 55.43 1l3n s GLN 15 Cb -0.13 -2.45 -0.02 0.00 1.00 0.00 0.00 33.01 31.41 1l3n s GLN 15 CO 0.17 -0.09 -0.18 0.20 -2.12 0.00 0.00 175.29 173.27 1l3n s GLY 16 N 1.01 1.45 -0.61 3.09 0.00 0.68 -0.91 107.32 112.03 1l3n s GLY 16 Ca -0.02 -0.99 0.06 0.00 0.00 0.00 0.00 44.72 43.76 1l3n s GLY 16 CO -0.06 -0.63 0.60 1.39 0.00 0.00 0.00 173.10 174.40 1l3n n ILE 17 N 2.75 1.40 -1.96 0.90 5.41 0.12 -0.30 119.36 127.69 1l3n n ILE 17 Ca -0.17 -4.79 -0.37 0.00 1.00 0.00 0.00 62.75 58.42 1l3n n ILE 17 Cb 0.52 -2.07 0.04 0.00 -0.71 0.00 0.00 39.64 37.42 1l3n n ILE 17 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 176.55 176.04 1l3n s ILE 18 N -1.76 2.48 -0.31 1.39 1.10 -1.11 -2.69 121.20 120.30 1l3n s ILE 18 Ca 0.34 0.32 -0.03 0.00 -0.51 0.00 0.00 60.65 60.77 1l3n s ILE 18 Cb 0.08 -3.14 0.11 0.00 0.15 0.00 0.00 42.46 39.66 1l3n s ILE 18 CO -0.09 -0.05 0.14 0.20 -2.11 0.00 0.00 174.94 173.04 1l3n s ASN 19 N -1.41 3.48 -0.28 4.50 0.01 0.97 -3.15 114.94 119.06 1l3n s ASN 19 Ca 0.75 -1.52 -0.20 0.00 -0.71 0.00 0.00 52.86 51.18 1l3n s ASN 19 Cb -0.33 -0.42 -0.01 0.00 0.41 0.00 0.00 41.25 40.89 1l3n s ASN 19 CO 0.37 -0.41 0.64 -0.36 -1.51 0.00 0.00 177.10 175.83 1l3n s PHE 20 N 1.82 3.25 -0.17 2.20 0.08 0.14 -1.41 117.98 123.89 1l3n s PHE 20 Ca 0.11 0.73 -0.06 0.00 0.12 0.00 0.00 56.93 57.82 1l3n s PHE 20 Cb -0.18 -2.91 -0.04 0.00 -0.57 0.00 0.00 43.02 39.32 1l3n s PHE 20 CO -0.28 -0.39 0.04 -2.00 -0.10 0.00 0.00 175.22 172.49 1l3n s GLU 21 N 2.56 3.85 -0.46 0.44 2.12 -1.02 -0.63 118.70 125.56 1l3n s GLU 21 Ca 0.26 -0.37 0.03 0.00 0.36 0.00 0.00 54.97 55.25 1l3n s GLU 21 Cb -0.15 -3.13 0.12 0.00 0.26 0.00 0.00 34.13 31.23 1l3n s GLU 21 CO 0.10 0.31 0.21 -1.14 -0.54 0.00 0.00 175.26 174.20 1l3n s GLN 22 N 0.24 1.65 0.10 4.30 0.74 0.48 -3.09 119.66 124.07 1l3n s GLN 22 Ca 0.03 -2.25 -0.31 0.00 0.05 0.00 0.00 55.36 52.87 1l3n s GLN 22 Cb -0.13 -2.98 -0.13 0.00 1.10 0.00 0.00 33.01 30.88 1l3n s GLN 22 CO 0.01 -1.09 1.50 0.87 -0.55 0.00 0.00 175.29 176.04 1l3n h LYS 23 N 6.84 -0.60 -4.82 1.67 1.79 -1.86 -3.42 116.57 116.18 1l3n h LYS 23 Ca -0.06 0.04 -0.41 0.00 -2.18 0.00 0.00 60.65 58.04 1l3n h LYS 23 Cb 0.93 0.14 -0.14 0.00 -1.58 0.00 0.00 32.23 31.58 1l3n h LYS 23 CO 0.60 -0.40 -0.53 -2.00 -1.08 0.00 0.00 179.45 176.04 1l3n s GLU 24 N -5.49 1.60 0.19 3.15 -6.30 -1.26 -4.99 118.70 105.59 1l3n s GLU 24 Ca -0.15 -1.91 0.24 0.00 -2.50 0.00 0.00 54.97 50.66 1l3n s GLU 24 Cb 0.06 0.31 0.91 0.00 0.00 0.00 0.00 34.13 35.41 1l3n s GLU 24 CO 0.55 -0.58 1.73 0.45 0.02 0.00 0.00 175.26 177.44 1l3n n SER 25 N -1.19 0.59 0.04 -1.70 2.88 -1.26 -1.56 113.62 111.41 1l3n n SER 25 Ca 0.06 0.60 0.12 0.00 -1.33 0.00 0.00 58.87 58.32 1l3n n SER 25 Cb 0.63 -0.74 0.23 0.00 -0.75 0.00 0.00 64.21 63.58 1l3n n SER 25 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1l3n n ASN 26 N -2.10 0.59 -4.64 -3.46 3.02 -1.26 -4.82 115.26 102.59 1l3n n ASN 26 Ca 0.04 0.03 -0.42 0.00 -0.03 0.00 0.00 54.58 54.20 1l3n n ASN 26 Cb 0.31 0.13 -0.04 0.00 -0.61 0.00 0.00 39.78 39.57 1l3n n ASN 26 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1l3n s GLY 27 N -3.39 1.73 0.16 7.41 0.00 -0.60 -5.02 107.32 107.61 1l3n s GLY 27 Ca 0.08 -0.11 -0.31 0.00 0.00 0.00 0.00 44.72 44.38 1l3n s GLY 27 CO 0.70 1.88 1.75 2.56 0.00 0.00 0.00 173.10 180.00 1l3n s PRO 28 N 2.95 4.14 0.22 2.90 0.04 -1.26 -4.71 135.00 139.28 1l3n s PRO 28 Ca 0.36 2.57 -0.30 0.00 0.04 0.00 0.00 61.00 63.68 1l3n s PRO 28 Cb -0.15 -3.33 -0.08 0.00 0.04 0.00 0.00 34.50 30.98 1l3n s PRO 28 CO 0.08 -0.78 1.04 0.14 0.04 0.00 0.00 177.00 177.52 1l3n s VAL 29 N 1.91 3.89 -0.50 -0.36 -7.23 0.59 -4.75 120.40 113.96 1l3n s VAL 29 Ca 0.77 1.77 -0.19 0.00 -1.81 0.00 0.00 61.98 62.52 1l3n s VAL 29 Cb -0.47 -4.13 0.05 0.00 0.56 0.00 0.00 36.38 32.39 1l3n s VAL 29 CO 0.34 0.37 0.63 -0.54 -0.31 0.00 0.00 175.10 175.59 1l3n s LYS 30 N -0.86 3.15 -0.86 4.82 3.01 -1.18 -0.77 119.74 127.05 1l3n s LYS 30 Ca 0.45 -0.80 -0.21 0.00 -1.01 0.00 0.00 55.97 54.40 1l3n s LYS 30 Cb -0.28 -4.07 0.09 0.00 -1.01 0.00 0.00 37.83 32.56 1l3n s LYS 30 CO 0.35 -1.19 1.14 0.14 0.51 0.00 0.00 175.35 176.31 1l3n s VAL 31 N 2.67 4.43 0.55 3.17 -7.23 0.12 -2.44 120.40 121.67 1l3n s VAL 31 Ca 0.16 -1.00 0.06 0.00 -1.81 0.00 0.00 61.98 59.39 1l3n s VAL 31 Cb -0.18 -4.81 0.04 0.00 0.56 0.00 0.00 36.38 31.99 1l3n s VAL 31 CO 0.13 -1.58 0.43 -1.66 -0.31 0.00 0.00 175.10 172.11 1l3n s TRP 32 N 3.62 1.58 -5.00 2.82 -2.14 -0.50 -1.06 118.94 118.26 1l3n s TRP 32 Ca 0.32 -0.84 0.00 0.00 2.66 0.00 0.00 56.10 58.24 1l3n s TRP 32 Cb -0.08 -1.93 0.00 0.00 -3.10 0.00 0.00 33.47 28.37 1l3n s TRP 32 CO -0.03 -0.53 0.00 0.41 -2.66 0.00 0.00 176.95 174.14 1l3n n GLY 33 N -1.81 -0.08 3.28 3.67 0.00 0.54 -0.02 105.19 110.77 1l3n n GLY 33 Ca -0.01 -1.47 -0.09 0.00 0.00 0.00 0.00 46.02 44.45 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 -0.33 -0.14 1.61 1.04 -1.10 -0.65 113.70 110.14 1l3n s SER 34 Ca 0.00 0.98 -0.07 0.00 0.48 0.00 0.00 55.95 57.34 1l3n s SER 34 Cb 0.00 1.22 -0.04 0.00 0.10 0.00 0.00 66.02 67.30 1l3n s SER 34 CO 0.00 -0.22 0.12 0.27 0.98 0.00 0.00 173.24 174.39 1l3n s ILE 35 N 2.33 5.33 0.16 -1.02 -0.00 -0.60 -0.70 121.20 126.69 1l3n s ILE 35 Ca -0.04 0.15 0.05 0.00 -0.00 0.00 0.00 60.65 60.81 1l3n s ILE 35 Cb -0.11 -3.35 -0.05 0.00 -0.00 0.00 0.00 42.46 38.95 1l3n s ILE 35 CO -0.13 0.56 -0.11 -1.59 -0.00 0.00 0.00 174.94 173.67 1l3n s LYS 36 N -0.54 1.14 0.00 0.37 -2.85 -0.09 -0.28 119.74 117.49 1l3n s LYS 36 Ca 0.12 -1.49 0.00 0.00 -1.00 0.00 0.00 55.97 53.60 1l3n s LYS 36 Cb -0.12 -0.77 0.00 0.00 -2.06 0.00 0.00 37.83 34.89 1l3n s LYS 36 CO 0.02 0.11 0.00 0.41 0.10 0.00 0.00 175.35 175.99 1l3n n GLY 37 N -0.25 1.02 3.33 0.59 0.00 -0.83 -0.94 105.19 108.11 1l3n n GLY 37 Ca -0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 1l3n n GLY 37 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1l3n n LEU 38 N 0.00 0.00 -4.74 0.99 4.77 -1.25 -4.15 117.00 112.62 1l3n n LEU 38 Ca 0.00 -1.08 -0.23 0.00 -0.03 0.00 0.00 56.01 54.67 1l3n n LEU 38 Cb 0.00 -0.97 -0.06 0.00 -2.33 0.00 0.00 43.42 40.06 1l3n n LEU 38 CO 0.00 -2.24 -0.18 0.28 -1.33 0.00 0.00 177.39 173.92 1l3n s THR 39 N -2.78 2.83 0.52 -5.08 -1.32 -1.26 -2.71 115.64 105.84 1l3n s THR 39 Ca 0.68 -1.68 -0.19 0.00 -1.21 0.00 0.00 61.69 59.29 1l3n s THR 39 Cb -0.07 -2.97 -0.11 0.00 -1.51 0.00 0.00 72.50 67.83 1l3n s THR 39 CO 0.53 -0.13 0.40 1.21 -2.21 0.00 0.00 174.62 174.42 1l3n n GLU 40 N -1.19 0.43 0.00 7.08 4.07 -1.24 -4.68 120.64 125.11 1l3n n GLU 40 Ca -0.02 0.16 0.00 0.00 -0.06 0.00 0.00 57.16 57.24 1l3n n GLU 40 Cb 0.62 -1.52 0.00 0.00 -0.06 0.00 0.00 31.44 30.48 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 1.92 -3.27 3.64 8.31 0.00 0.40 -4.82 105.19 111.36 1l3n n GLY 41 Ca 0.11 -1.84 -0.45 0.00 0.00 0.00 0.00 46.02 43.84 1l3n n GLY 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1l3n n LEU 42 N 0.00 2.52 -3.99 0.99 4.77 -1.25 -0.78 117.00 119.25 1l3n n LEU 42 Ca 0.00 1.17 -0.16 0.00 -0.03 0.00 0.00 56.01 56.99 1l3n n LEU 42 Cb 0.00 -1.36 -0.14 0.00 -2.33 0.00 0.00 43.42 39.59 1l3n n LEU 42 CO 0.00 -0.93 -0.41 -1.00 -1.33 0.00 0.00 177.39 173.72 1l3n s HIS 43 N -0.70 0.58 -0.11 -1.77 3.76 0.20 -2.95 115.29 114.30 1l3n s HIS 43 Ca 0.62 -0.16 -0.12 0.00 -0.15 0.00 0.00 55.06 55.24 1l3n s HIS 43 Cb -0.68 -0.37 -0.05 0.00 1.11 0.00 0.00 32.58 32.59 1l3n s HIS 43 CO 0.57 -0.02 0.41 0.41 -0.85 0.00 0.00 174.74 175.26 1l3n n GLY 44 N 2.70 0.03 2.73 -2.22 0.00 0.60 -0.91 105.19 108.12 1l3n n GLY 44 Ca -0.14 0.26 -0.19 0.00 0.00 0.00 0.00 46.02 45.95 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 0.68 -0.22 0.30 1.61 5.36 0.60 -1.07 117.98 125.24 1l3n s PHE 45 Ca 0.28 0.12 -0.05 0.00 -0.96 0.00 0.00 56.93 56.32 1l3n s PHE 45 Cb -0.40 -0.41 -0.00 0.00 -0.34 0.00 0.00 43.02 41.86 1l3n s PHE 45 CO 0.21 -0.61 0.43 -1.01 -1.46 0.00 0.00 175.22 172.79 1l3n s HIS 46 N 2.30 0.88 -0.35 10.12 3.76 -1.21 -0.54 115.29 130.26 1l3n s HIS 46 Ca 0.06 -1.15 0.01 0.00 -0.15 0.00 0.00 55.06 53.84 1l3n s HIS 46 Cb -0.16 -0.07 0.11 0.00 1.11 0.00 0.00 32.58 33.57 1l3n s HIS 46 CO -0.13 -1.03 0.11 0.54 -0.85 0.00 0.00 174.74 173.37 1l3n s VAL 47 N -3.46 1.52 0.47 -0.90 0.11 -0.08 -2.34 120.40 115.71 1l3n s VAL 47 Ca 0.29 -1.97 -0.22 0.00 -2.93 0.00 0.00 61.98 57.16 1l3n s VAL 47 Cb 0.00 -2.12 -0.08 0.00 -1.53 0.00 0.00 36.38 32.65 1l3n s VAL 47 CO 0.16 -0.68 1.09 -1.00 -3.33 0.00 0.00 175.10 171.34 1l3n s HIS 48 N 1.12 2.98 0.05 1.54 3.76 0.74 -4.83 115.29 120.65 1l3n s HIS 48 Ca 0.12 1.58 -0.30 0.00 -0.15 0.00 0.00 55.06 56.31 1l3n s HIS 48 Cb -0.19 -3.20 -0.18 0.00 1.11 0.00 0.00 32.58 30.12 1l3n s HIS 48 CO -0.15 -1.08 1.51 1.49 -0.85 0.00 0.00 174.74 175.66 1l3n h GLU 49 N 1.87 -0.68 -6.62 1.40 4.57 -1.49 -3.01 114.58 110.62 1l3n h GLU 49 Ca -0.49 0.05 -0.51 0.00 -1.18 0.00 0.00 59.36 57.22 1l3n h GLU 49 Cb 1.23 0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.95 1l3n h GLU 49 CO 0.60 -0.41 0.01 -0.06 -1.18 0.00 0.00 179.01 177.97 1l3n s PHE 50 N -5.65 3.40 -0.30 0.92 0.08 -0.03 -4.62 117.98 111.78 1l3n s PHE 50 Ca -0.16 1.05 0.08 0.00 0.12 0.00 0.00 56.93 58.02 1l3n s PHE 50 Cb 0.03 -2.41 0.48 0.00 -0.57 0.00 0.00 43.02 40.55 1l3n s PHE 50 CO 0.59 0.14 1.40 0.41 -0.10 0.00 0.00 175.22 177.66 1l3n n GLY 51 N -0.39 5.36 2.76 4.36 0.00 -1.26 -4.18 105.19 111.85 1l3n n GLY 51 Ca 0.02 -1.64 -0.42 0.00 0.00 0.00 0.00 46.02 43.98 1l3n n GLY 51 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1l3n n ASP 52 N -1.02 3.86 0.00 1.61 5.75 -1.26 -4.74 116.55 120.75 1l3n n ASP 52 Ca 0.35 -2.84 0.05 0.00 -0.01 0.00 0.00 54.79 52.34 1l3n n ASP 52 Cb 0.93 -1.65 0.30 0.00 -1.03 0.00 0.00 41.12 39.66 1l3n n ASP 52 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1l3n n ASN 53 N 6.18 0.00 -0.23 -1.12 2.85 -1.26 -4.09 115.26 117.59 1l3n n ASN 53 Ca 0.52 -1.08 0.03 0.00 -0.11 0.00 0.00 54.58 53.94 1l3n n ASN 53 Cb 0.39 0.00 0.08 0.00 1.24 0.00 0.00 39.78 41.49 1l3n n ASN 53 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 1l3n n THR 54 N -0.73 -0.28 0.21 -0.44 -1.04 -1.26 -0.31 114.28 110.44 1l3n n THR 54 Ca 0.08 1.47 0.11 0.00 -2.04 0.00 0.00 64.05 63.67 1l3n n THR 54 Cb 0.03 -2.02 0.16 0.00 -1.82 0.00 0.00 70.33 66.68 1l3n n THR 54 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1l3n h ALA 55 N 1.21 0.97 0.00 2.41 0.00 -2.01 -3.47 119.26 118.37 1l3n h ALA 55 Ca 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1l3n h ALA 55 Cb 0.45 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1l3n h ALA 55 CO -0.65 0.05 0.00 0.41 0.00 0.00 0.00 179.25 179.06 1l3n n GLY 56 N 1.11 0.79 2.03 0.00 0.00 0.58 -4.76 105.19 104.93 1l3n n GLY 56 Ca 0.04 -0.72 -0.10 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.27 1.51 0.24 0.00 -1.04 -1.26 -4.44 114.28 107.02 1l3n n THR 58 Ca -0.11 -0.09 0.10 0.00 -2.04 0.00 0.00 64.05 61.92 1l3n n THR 58 Cb 0.43 -2.07 0.61 0.00 -1.82 0.00 0.00 70.33 67.47 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 -1.00 0.00 -0.61 8.00 0.02 -1.85 -3.19 113.55 114.92 1l3n h SER 59 Ca -0.38 0.00 0.23 0.00 -0.84 0.00 0.00 61.79 60.80 1l3n h SER 59 Cb 1.26 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.72 1l3n h SER 59 CO -0.23 0.18 0.36 0.00 -1.14 0.00 0.00 176.83 176.01 1l3n n ALA 60 N -2.29 0.62 0.00 3.77 0.00 -1.26 -4.81 120.51 116.53 1l3n n ALA 60 Ca -0.01 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.93 1l3n n ALA 60 Cb 0.31 -0.54 0.00 0.00 0.00 0.00 0.00 19.45 19.22 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 -1.20 3.19 2.26 0.00 0.00 -1.21 -0.85 105.19 107.39 1l3n n GLY 61 Ca 0.20 -1.81 -0.30 0.00 0.00 0.00 0.00 46.02 44.12 1l3n n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1l3n n PRO 62 N -0.59 3.06 0.00 1.61 -0.04 -1.26 -4.76 135.00 133.02 1l3n n PRO 62 Ca 0.00 -1.79 0.00 0.00 -0.04 0.00 0.00 63.50 61.67 1l3n n PRO 62 Cb 0.00 -2.54 0.00 0.00 -0.04 0.00 0.00 33.50 30.92 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 3.35 0.00 -3.00 0.54 8.25 -1.26 -4.63 115.22 118.47 1l3n n HIS 63 Ca 0.65 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 58.02 1l3n n HIS 63 Cb 0.39 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.47 1l3n n HIS 63 CO 0.00 0.00 0.00 1.97 0.64 0.00 0.00 176.34 178.95 1l3n n PHE 64 N 0.00 -0.38 -1.01 4.41 -1.74 -1.26 -2.06 117.46 115.42 1l3n n PHE 64 Ca 0.00 0.19 -0.34 0.00 -0.56 0.00 0.00 57.45 56.73 1l3n n PHE 64 Cb 0.00 -0.82 0.10 0.00 1.52 0.00 0.00 39.48 40.27 1l3n n PHE 64 CO 0.00 0.00 0.00 0.27 -0.56 0.00 0.00 176.76 176.47 1l3n n ASN 65 N -0.63 -1.76 -0.25 5.98 6.94 -1.26 -4.83 115.26 119.46 1l3n n ASN 65 Ca -0.09 0.44 -0.07 0.00 -0.02 0.00 0.00 54.58 54.84 1l3n n ASN 65 Cb 0.21 -1.20 0.04 0.00 -2.36 0.00 0.00 39.78 36.46 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 -1.02 1.07 -3.11 -0.53 0.13 -1.92 -1.84 132.00 124.78 1l3n h PRO 66 Ca -0.44 -0.24 -0.56 0.00 -0.87 0.00 0.00 66.00 63.89 1l3n h PRO 66 Cb 1.31 -0.15 0.02 0.00 0.13 0.00 0.00 31.00 32.31 1l3n h PRO 66 CO 0.38 0.93 3.31 1.28 -0.23 0.00 0.00 178.00 183.67 1l3n n LEU 67 N -4.31 7.37 -4.58 1.56 4.32 -1.26 -4.91 117.00 115.19 1l3n n LEU 67 Ca 0.05 -3.83 -0.41 0.00 -0.02 0.00 0.00 56.01 51.80 1l3n n LEU 67 Cb 0.23 -1.40 -0.03 0.00 -1.62 0.00 0.00 43.42 40.60 1l3n n LEU 67 CO 0.41 1.58 1.87 -0.94 -1.22 0.00 0.00 177.39 179.09 1l3n s SER 68 N 2.57 5.18 0.00 -1.43 1.04 -0.69 -4.73 113.70 115.64 1l3n s SER 68 Ca 0.59 1.57 0.00 0.00 0.48 0.00 0.00 55.95 58.59 1l3n s SER 68 Cb 0.16 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.77 1l3n s SER 68 CO -0.05 -2.23 0.00 0.54 0.98 0.00 0.00 173.24 172.48 1l3n n ARG 69 N 8.83 0.00 -4.04 4.02 1.74 -1.26 -5.09 116.66 120.86 1l3n n ARG 69 Ca 0.31 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.30 1l3n n ARG 69 Cb 0.48 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 31.81 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 0.47 -0.11 5.56 -0.14 -0.14 -5.06 119.74 120.32 1l3n s LYS 70 Ca 0.00 -0.87 -0.29 0.00 -1.36 0.00 0.00 55.97 53.45 1l3n s LYS 70 Cb 0.00 0.05 -0.04 0.00 -1.68 0.00 0.00 37.83 36.16 1l3n s LYS 70 CO 0.00 -0.05 1.49 -1.58 -0.76 0.00 0.00 175.35 174.45 1l3n s HIS 71 N -2.33 2.33 0.00 3.18 5.65 -0.91 -2.37 115.29 120.84 1l3n s HIS 71 Ca -0.06 0.53 0.00 0.00 0.25 0.00 0.00 55.06 55.78 1l3n s HIS 71 Cb -0.04 -3.75 0.00 0.00 -1.18 0.00 0.00 32.58 27.61 1l3n s HIS 71 CO -0.04 -2.95 0.00 0.41 -0.65 0.00 0.00 174.74 171.51 1l3n n GLY 72 N 3.94 4.90 0.00 1.59 0.00 -1.26 -3.56 105.19 110.80 1l3n n GLY 72 Ca 0.16 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 1.67 0.00 -0.02 0.00 -1.26 -4.71 105.19 100.87 1l3n n GLY 73 Ca 0.00 -0.24 0.01 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 0.36 -0.04 1.61 -0.04 -1.25 -0.71 135.00 134.92 1l3n n PRO 74 Ca 0.00 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.50 1l3n n PRO 74 Cb 0.00 -1.11 0.06 0.00 -0.04 0.00 0.00 33.50 32.41 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 -0.61 1.06 -4.37 0.54 5.02 -1.26 -4.98 118.16 113.56 1l3n n LYS 75 Ca 0.02 -1.29 -0.27 0.00 -2.02 0.00 0.00 58.31 54.76 1l3n n LYS 75 Cb 0.01 -1.17 -0.13 0.00 -0.02 0.00 0.00 35.03 33.72 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 -0.78 2.94 0.23 4.39 -1.08 0.11 -5.01 116.67 117.47 1l3n s ASP 76 Ca 0.12 -0.71 0.16 0.00 -0.52 0.00 0.00 52.55 51.60 1l3n s ASP 76 Cb 0.07 -0.19 0.02 0.00 -1.46 0.00 0.00 42.92 41.37 1l3n s ASP 76 CO 0.10 0.13 1.27 -0.08 0.52 0.00 0.00 175.17 177.12 1l3n h GLU 77 N 4.03 0.00 -0.28 4.34 4.81 -1.94 -3.37 114.58 122.17 1l3n h GLU 77 Ca -0.48 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 58.64 1l3n h GLU 77 Cb 1.17 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.49 1l3n h GLU 77 CO 0.40 0.40 -0.07 -0.85 -0.73 0.00 0.00 179.01 178.16 1l3n n GLU 78 N -3.11 2.08 -0.86 1.92 0.28 -1.26 -5.01 120.64 114.68 1l3n n GLU 78 Ca -0.01 -3.05 -0.34 0.00 -0.16 0.00 0.00 57.16 53.60 1l3n n GLU 78 Cb 0.74 -1.79 0.09 0.00 1.43 0.00 0.00 31.44 31.92 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 -0.98 -0.31 -0.79 3.44 1.85 -1.24 -0.97 116.66 117.65 1l3n n ARG 79 Ca 0.28 -0.07 -0.08 0.00 -1.00 0.00 0.00 57.85 56.98 1l3n n ARG 79 Cb 0.95 -1.51 -0.11 0.00 -1.05 0.00 0.00 32.46 30.74 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 -3.32 0.00 -2.82 2.89 8.25 -1.00 -4.65 115.22 114.57 1l3n n HIS 80 Ca 0.03 -1.25 -0.17 0.00 -0.26 0.00 0.00 57.72 56.07 1l3n n HIS 80 Cb 0.57 -1.19 -0.03 0.00 1.12 0.00 0.00 29.99 30.45 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 2.22 0.00 0.00 1.59 3.14 -1.26 -4.28 118.33 119.73 1l3n n VAL 81 Ca 0.28 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.66 1l3n n VAL 81 Cb 0.74 -0.20 0.00 0.00 -1.06 0.00 0.00 33.84 33.32 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 -0.65 0.00 3.18 7.55 0.00 -1.26 -4.77 105.19 109.23 1l3n n GLY 82 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 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 5.02 0.11 1.61 1.01 -1.26 -0.91 116.67 122.26 1l3n s ASP 83 Ca 0.00 -1.39 0.09 0.00 0.71 0.00 0.00 52.55 51.95 1l3n s ASP 83 Cb 0.00 -1.76 -0.19 0.00 1.01 0.00 0.00 42.92 41.99 1l3n s ASP 83 CO 0.00 -0.32 1.22 -0.07 0.21 0.00 0.00 175.17 176.21 1l3n h LEU 84 N 8.04 0.00 0.00 1.23 -0.00 -1.41 -3.33 115.31 119.83 1l3n h LEU 84 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.68 1l3n h LEU 84 Cb 1.06 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.72 1l3n h LEU 84 CO 0.57 0.95 0.00 0.61 -0.00 0.00 0.00 178.44 180.57 1l3n n GLY 85 N 1.36 0.96 2.77 0.83 0.00 0.30 -4.34 105.19 107.08 1l3n n GLY 85 Ca -0.02 -0.76 -0.24 0.00 0.00 0.00 0.00 46.02 45.00 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 1.89 -0.12 1.61 2.20 -1.26 -0.29 114.94 114.97 1l3n s ASN 86 Ca 0.00 -0.25 -0.01 0.00 -0.94 0.00 0.00 52.86 51.66 1l3n s ASN 86 Cb 0.00 -0.50 -0.02 0.00 -2.00 0.00 0.00 41.25 38.73 1l3n s ASN 86 CO 0.00 -0.21 -0.09 0.68 -2.94 0.00 0.00 177.10 174.54 1l3n s VAL 87 N 1.93 3.47 -0.52 3.54 -7.23 -0.09 -4.75 120.40 116.76 1l3n s VAL 87 Ca 0.04 -0.52 -0.28 0.00 -1.81 0.00 0.00 61.98 59.40 1l3n s VAL 87 Cb -0.13 -2.47 0.02 0.00 0.56 0.00 0.00 36.38 34.36 1l3n s VAL 87 CO -0.06 0.53 1.25 -0.89 -0.31 0.00 0.00 175.10 175.62 1l3n s THR 88 N 0.09 4.01 0.02 5.32 2.01 -1.26 -0.63 115.64 125.21 1l3n s THR 88 Ca -0.03 0.97 -0.19 0.00 0.31 0.00 0.00 61.69 62.74 1l3n s THR 88 Cb -0.14 -4.55 -0.06 0.00 0.01 0.00 0.00 72.50 67.76 1l3n s THR 88 CO 0.04 -1.11 0.56 0.00 -0.69 0.00 0.00 174.62 173.42 1l3n s ALA 89 N 5.08 3.55 1.29 7.40 0.00 0.03 -4.14 121.76 134.98 1l3n s ALA 89 Ca 0.49 0.00 -0.18 0.00 0.00 0.00 0.00 51.96 52.28 1l3n s ALA 89 Cb -0.09 -2.67 0.33 0.00 0.00 0.00 0.00 23.12 20.69 1l3n s ALA 89 CO 0.29 0.28 0.98 -0.51 0.00 0.00 0.00 175.76 176.80 1l3n s ASP 90 N -0.61 -0.03 0.48 0.00 1.01 0.11 -0.46 116.67 117.17 1l3n s ASP 90 Ca 0.29 1.11 0.24 0.00 0.71 0.00 0.00 52.55 54.91 1l3n s ASP 90 Cb -0.18 -1.66 1.28 0.00 1.01 0.00 0.00 42.92 43.36 1l3n s ASP 90 CO 0.17 -4.77 1.88 0.07 0.21 0.00 0.00 175.17 172.74 1l3n h LYS 91 N -3.01 0.19 0.00 8.23 2.10 -1.91 0.30 116.57 122.47 1l3n h LYS 91 Ca -0.52 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.12 1l3n h LYS 91 Cb 1.34 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.62 1l3n h LYS 91 CO 0.39 0.13 0.00 -3.47 -2.00 0.00 0.00 179.45 174.50 1l3n n ASP 92 N -4.40 0.08 0.00 7.07 2.03 -1.26 -4.63 116.55 115.44 1l3n n ASP 92 Ca 0.18 0.51 0.00 0.00 0.52 0.00 0.00 54.79 56.00 1l3n n ASP 92 Cb 0.81 -0.53 0.00 0.00 -0.72 0.00 0.00 41.12 40.68 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 1.36 0.73 3.55 0.27 0.00 0.11 -1.96 105.19 109.25 1l3n n GLY 93 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.45 3.63 -0.37 1.61 1.01 -1.24 -3.67 120.40 118.92 1l3n s VAL 94 Ca 0.00 -0.08 -0.15 0.00 0.00 0.00 0.00 61.98 61.75 1l3n s VAL 94 Cb 0.00 -4.54 0.00 0.00 0.00 0.00 0.00 36.38 31.84 1l3n s VAL 94 CO 0.00 -1.47 0.34 0.00 0.00 0.00 0.00 175.10 173.97 1l3n s ALA 95 N 7.20 3.48 -0.35 5.51 0.00 0.61 -0.71 121.76 137.50 1l3n s ALA 95 Ca 0.52 -1.41 -0.28 0.00 0.00 0.00 0.00 51.96 50.80 1l3n s ALA 95 Cb -0.07 -2.85 0.02 0.00 0.00 0.00 0.00 23.12 20.22 1l3n s ALA 95 CO 0.07 -1.23 1.01 0.16 0.00 0.00 0.00 175.76 175.77 1l3n s ASP 96 N 1.74 6.80 -0.17 0.00 -4.77 -1.26 -1.56 116.67 117.45 1l3n s ASP 96 Ca 0.09 0.81 -0.08 0.00 -3.30 0.00 0.00 52.55 50.07 1l3n s ASP 96 Cb -0.17 -2.51 -0.04 0.00 -1.09 0.00 0.00 42.92 39.10 1l3n s ASP 96 CO 0.12 -0.89 0.11 -0.69 0.70 0.00 0.00 175.17 174.51 1l3n s VAL 97 N 3.63 5.24 -0.50 2.11 1.01 0.18 -4.83 120.40 127.24 1l3n s VAL 97 Ca 0.42 0.12 0.07 0.00 0.00 0.00 0.00 61.98 62.59 1l3n s VAL 97 Cb -0.12 -3.35 0.19 0.00 0.00 0.00 0.00 36.38 33.11 1l3n s VAL 97 CO 0.18 0.50 0.69 -0.94 0.00 0.00 0.00 175.10 175.53 1l3n s SER 98 N -0.09 -1.24 -0.01 3.32 1.04 -1.25 -0.34 113.70 115.13 1l3n s SER 98 Ca 0.09 -1.75 0.04 0.00 0.48 0.00 0.00 55.95 54.80 1l3n s SER 98 Cb -0.12 1.73 -0.03 0.00 0.10 0.00 0.00 66.02 67.71 1l3n s SER 98 CO 0.00 -0.07 -0.10 -0.63 0.98 0.00 0.00 173.24 173.43 1l3n s ILE 99 N 0.90 3.41 -0.22 -1.02 1.09 -0.23 -4.95 121.20 120.18 1l3n s ILE 99 Ca 0.29 -0.79 -0.11 0.00 -1.10 0.00 0.00 60.65 58.94 1l3n s ILE 99 Cb -0.00 -2.44 -0.05 0.00 -1.06 0.00 0.00 42.46 38.91 1l3n s ILE 99 CO -0.06 0.44 0.16 -1.61 -0.10 0.00 0.00 174.94 173.77 1l3n s GLU 100 N -1.23 4.13 0.10 2.79 2.02 -1.26 0.14 118.70 125.39 1l3n s GLU 100 Ca 0.15 -0.22 0.03 0.00 0.02 0.00 0.00 54.97 54.95 1l3n s GLU 100 Cb -0.11 -3.48 -0.04 0.00 0.10 0.00 0.00 34.13 30.60 1l3n s GLU 100 CO 0.05 0.17 -0.09 0.34 0.02 0.00 0.00 175.26 175.75 1l3n s ASP 101 N 0.73 1.37 -0.39 -0.19 -1.08 0.05 -4.98 116.67 112.19 1l3n s ASP 101 Ca 0.08 -0.84 0.10 0.00 -0.52 0.00 0.00 52.55 51.37 1l3n s ASP 101 Cb -0.12 0.03 0.44 0.00 -1.46 0.00 0.00 42.92 41.80 1l3n s ASP 101 CO 0.02 -0.30 1.05 -0.24 0.52 0.00 0.00 175.17 176.21 1l3n n SER 102 N 0.46 3.39 0.00 -0.34 2.88 -1.26 -0.30 113.62 118.45 1l3n n SER 102 Ca -0.15 -3.30 0.00 0.00 -1.33 0.00 0.00 58.87 54.09 1l3n n SER 102 Cb 0.58 -0.48 0.00 0.00 -0.75 0.00 0.00 64.21 63.56 1l3n n SER 102 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 1l3n n VAL 103 N -0.32 0.00 -1.64 2.46 3.14 -1.26 -5.05 118.33 115.66 1l3n n VAL 103 Ca 0.27 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.22 1l3n n VAL 103 Cb 0.73 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.48 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 -1.44 0.62 -3.86 1.55 2.08 -1.26 -4.97 119.36 112.08 1l3n n ILE 104 Ca 0.00 -0.25 -0.26 0.00 0.56 0.00 0.00 62.75 62.80 1l3n n ILE 104 Cb 0.00 -2.41 -0.17 0.00 -0.75 0.00 0.00 39.64 36.31 1l3n n ILE 104 CO 0.00 0.00 0.00 -0.44 0.56 0.00 0.00 176.55 176.67 1l3n s SER 105 N 5.83 2.09 0.33 4.38 0.01 -1.26 -4.53 113.70 120.55 1l3n s SER 105 Ca 0.93 -0.29 0.06 0.00 1.31 0.00 0.00 55.95 57.97 1l3n s SER 105 Cb -0.40 -0.73 0.72 0.00 0.21 0.00 0.00 66.02 65.83 1l3n s SER 105 CO 0.40 -0.15 1.85 -0.07 0.41 0.00 0.00 173.24 175.67 1l3n h LEU 106 N 8.22 0.76 -7.40 2.44 3.38 -1.92 0.12 115.31 120.91 1l3n h LEU 106 Ca -0.26 0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.66 1l3n h LEU 106 Cb 1.13 -0.10 -0.19 0.00 0.09 0.00 0.00 40.66 41.59 1l3n h LEU 106 CO 0.36 0.38 -0.15 -0.44 0.09 0.00 0.00 178.44 178.68 1l3n s SER 107 N -5.71 -0.28 0.00 -0.43 0.01 -1.26 -3.62 113.70 102.41 1l3n s SER 107 Ca -0.11 0.12 0.00 0.00 1.31 0.00 0.00 55.95 57.28 1l3n s SER 107 Cb 0.22 0.38 0.00 0.00 0.21 0.00 0.00 66.02 66.84 1l3n s SER 107 CO 0.80 -0.55 0.00 0.61 0.41 0.00 0.00 173.24 174.50 1l3n n GLY 108 N 0.92 0.34 1.12 3.44 0.00 -1.26 -4.70 105.19 105.05 1l3n n GLY 108 Ca -0.20 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.72 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 0.11 0.04 1.61 -0.08 -1.26 -4.82 116.55 112.15 1l3n n ASP 109 Ca 0.00 0.02 -0.11 0.00 -1.51 0.00 0.00 54.79 53.19 1l3n n ASP 109 Cb 0.00 -0.03 0.01 0.00 2.34 0.00 0.00 41.12 43.44 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 0.62 -6.76 -0.67 -0.00 -1.89 -3.47 115.15 102.98 1l3n h HIS 110 Ca 0.00 -0.28 -0.55 0.00 -0.00 0.00 0.00 60.37 59.55 1l3n h HIS 110 Cb 0.79 -0.09 0.01 0.00 -0.00 0.00 0.00 27.41 28.11 1l3n h HIS 110 CO 0.00 1.05 -1.00 0.45 -0.00 0.00 0.00 177.93 178.43 1l3n n SER 111 N -3.85 -4.52 0.00 2.45 2.88 -1.02 -4.82 113.62 104.75 1l3n n SER 111 Ca -0.05 -1.19 0.06 0.00 -1.33 0.00 0.00 58.87 56.36 1l3n n SER 111 Cb 0.72 -2.03 0.28 0.00 -0.75 0.00 0.00 64.21 62.43 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 -4.54 1.03 -1.56 2.46 -6.64 0.39 -4.73 119.36 105.77 1l3n n ILE 112 Ca -0.13 0.26 -0.50 0.00 -1.77 0.00 0.00 62.75 60.60 1l3n n ILE 112 Cb 0.58 -1.04 -0.05 0.00 -1.44 0.00 0.00 39.64 37.70 1l3n n ILE 112 CO 0.00 0.00 0.00 -0.38 -1.77 0.00 0.00 176.55 174.40 1l3n n ILE 113 N -1.46 0.67 -0.18 7.28 2.08 -1.24 -1.02 119.36 125.49 1l3n n ILE 113 Ca 0.04 -0.17 0.00 0.00 0.56 0.00 0.00 62.75 63.18 1l3n n ILE 113 Cb 0.14 -0.71 0.00 0.00 -0.75 0.00 0.00 39.64 38.32 1l3n n ILE 113 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1l3n n GLY 114 N 2.07 1.87 3.81 7.39 0.00 0.13 -4.98 105.19 115.47 1l3n n GLY 114 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.26 0.41 -0.06 1.61 0.52 -0.19 -4.00 118.95 116.98 1l3n s ARG 115 Ca 0.00 -0.11 0.03 0.00 -0.52 0.00 0.00 55.73 55.13 1l3n s ARG 115 Cb 0.00 -1.79 0.01 0.00 0.52 0.00 0.00 34.95 33.68 1l3n s ARG 115 CO 0.00 -2.61 -0.14 0.99 0.02 0.00 0.00 175.30 173.56 1l3n s THR 116 N -3.50 1.24 0.30 0.02 2.01 -1.14 -0.88 115.64 113.69 1l3n s THR 116 Ca 0.70 -0.57 -0.17 0.00 0.31 0.00 0.00 61.69 61.96 1l3n s THR 116 Cb -0.09 -1.10 -0.09 0.00 0.01 0.00 0.00 72.50 71.23 1l3n s THR 116 CO 0.53 0.37 0.75 -0.76 -0.69 0.00 0.00 174.62 174.83 1l3n s LEU 117 N 0.41 4.14 -0.05 4.42 2.01 0.38 -0.19 118.68 129.79 1l3n s LEU 117 Ca -0.10 1.36 0.01 0.00 0.01 0.00 0.00 54.13 55.41 1l3n s LEU 117 Cb -0.14 -3.97 0.02 0.00 0.01 0.00 0.00 46.19 42.11 1l3n s LEU 117 CO 0.03 -0.14 -0.05 -0.69 1.01 0.00 0.00 176.35 176.50 1l3n s VAL 118 N -1.86 0.64 -0.22 -1.59 1.01 -0.99 -1.54 120.40 115.86 1l3n s VAL 118 Ca 0.51 -0.17 -0.15 0.00 0.00 0.00 0.00 61.98 62.18 1l3n s VAL 118 Cb -0.12 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 1l3n s VAL 118 CO 0.18 0.26 0.35 0.54 0.00 0.00 0.00 175.10 176.43 1l3n s VAL 119 N 1.00 5.22 0.26 2.92 0.11 -0.17 -3.32 120.40 126.42 1l3n s VAL 119 Ca -0.10 0.59 0.04 0.00 -2.93 0.00 0.00 61.98 59.58 1l3n s VAL 119 Cb -0.14 -3.68 -0.03 0.00 -1.53 0.00 0.00 36.38 30.99 1l3n s VAL 119 CO -0.00 0.24 0.39 -1.00 -3.33 0.00 0.00 175.10 171.41 1l3n s HIS 120 N 1.45 3.46 0.18 1.54 3.76 -0.23 -2.30 115.29 123.15 1l3n s HIS 120 Ca 0.16 0.06 -0.27 0.00 -0.15 0.00 0.00 55.06 54.86 1l3n s HIS 120 Cb -0.15 -1.64 0.02 0.00 1.11 0.00 0.00 32.58 31.92 1l3n s HIS 120 CO 0.08 0.38 1.54 1.49 -0.85 0.00 0.00 174.74 177.38 1l3n h GLU 121 N 1.14 -0.03 -5.54 1.40 4.81 -0.82 -3.28 114.58 112.27 1l3n h GLU 121 Ca -0.51 0.00 -0.61 0.00 -0.13 0.00 0.00 59.36 58.11 1l3n h GLU 121 Cb 1.23 0.01 -0.13 0.00 0.63 0.00 0.00 28.75 30.48 1l3n h GLU 121 CO 0.61 -0.02 -0.59 0.15 -0.73 0.00 0.00 179.01 178.44 1l3n s LYS 122 N -5.64 1.93 0.31 1.92 1.02 0.70 -4.85 119.74 115.13 1l3n s LYS 122 Ca -0.13 -2.11 -0.29 0.00 0.02 0.00 0.00 55.97 53.46 1l3n s LYS 122 Cb 0.14 -1.49 -0.11 0.00 -0.52 0.00 0.00 37.83 35.85 1l3n s LYS 122 CO 0.65 -0.11 1.54 0.00 -0.92 0.00 0.00 175.35 176.50 1l3n s ALA 123 N -2.83 3.68 0.44 5.17 0.00 -1.15 -0.29 121.76 126.77 1l3n s ALA 123 Ca 0.32 1.53 -0.22 0.00 0.00 0.00 0.00 51.96 53.60 1l3n s ALA 123 Cb 0.09 -3.62 -0.09 0.00 0.00 0.00 0.00 23.12 19.49 1l3n s ALA 123 CO 0.16 -0.97 1.01 0.34 0.00 0.00 0.00 175.76 176.30 1l3n s ASP 124 N 0.26 6.69 -0.02 0.00 -1.08 -1.26 -4.17 116.67 117.09 1l3n s ASP 124 Ca 0.59 1.87 -0.17 0.00 -0.52 0.00 0.00 52.55 54.33 1l3n s ASP 124 Cb -0.46 -2.56 -0.33 0.00 -1.46 0.00 0.00 42.92 38.11 1l3n s ASP 124 CO 0.52 -0.53 0.85 -0.78 0.52 0.00 0.00 175.17 175.75 1l3n h ASP 125 N 2.00 0.66 -5.49 -0.34 1.82 -1.86 -3.46 116.42 109.74 1l3n h ASP 125 Ca -0.49 -0.92 -0.35 0.00 -0.39 0.00 0.00 57.03 54.88 1l3n h ASP 125 Cb 1.20 -0.21 0.14 0.00 0.68 0.00 0.00 39.33 41.14 1l3n h ASP 125 CO 0.61 1.64 -0.67 0.18 -1.61 0.00 0.00 179.24 179.39 1l3n n LEU 126 N -3.82 -3.55 -0.69 2.28 4.77 -1.26 -3.54 117.00 111.19 1l3n n LEU 126 Ca -0.19 -0.53 -0.09 0.00 -0.03 0.00 0.00 56.01 55.17 1l3n n LEU 126 Cb 1.01 -2.91 -0.04 0.00 -2.33 0.00 0.00 43.42 39.15 1l3n n LEU 126 CO 0.54 0.52 -0.09 0.61 -1.33 0.00 0.00 177.39 177.64 1l3n n GLY 127 N -1.61 1.07 0.13 -0.72 0.00 -1.13 -4.65 105.19 98.28 1l3n n GLY 127 Ca -0.10 -0.58 0.08 0.00 0.00 0.00 0.00 46.02 45.42 1l3n n GLY 127 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1l3n h LYS 128 N 0.02 0.00 -0.36 1.61 1.57 -1.84 -3.35 116.57 114.23 1l3n h LYS 128 Ca -0.18 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.70 1l3n h LYS 128 Cb 0.61 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 1l3n h LYS 128 CO 0.27 0.12 0.26 0.78 -0.57 0.00 0.00 179.45 180.31 1l3n h GLY 129 N 3.88 0.00 -2.95 3.86 0.00 -1.89 -3.46 103.07 102.51 1l3n h GLY 129 Ca -0.04 -0.00 -0.41 0.00 0.00 0.00 0.00 47.33 46.89 1l3n h GLY 129 CO 0.02 0.00 -0.52 0.61 0.00 0.00 0.00 176.54 176.64 1l3n n GLY 130 N -1.61 -0.47 3.60 4.60 0.00 -1.26 -4.95 105.19 105.10 1l3n n GLY 130 Ca 0.06 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.11 3.95 0.16 1.61 2.20 -1.26 -4.99 114.94 114.51 1l3n s ASN 131 Ca 0.01 -1.17 -0.23 0.00 -0.94 0.00 0.00 52.86 50.52 1l3n s ASN 131 Cb -0.00 -0.42 0.05 0.00 -2.00 0.00 0.00 41.25 38.87 1l3n s ASN 131 CO 0.01 -0.30 1.60 -0.08 -2.94 0.00 0.00 177.10 175.39 1l3n h GLU 132 N 1.85 -0.26 -0.58 3.55 4.57 -1.97 0.06 114.58 121.80 1l3n h GLU 132 Ca -0.43 0.02 0.11 0.00 -1.18 0.00 0.00 59.36 57.88 1l3n h GLU 132 Cb 1.25 0.06 -0.09 0.00 -0.16 0.00 0.00 28.75 29.81 1l3n h GLU 132 CO 0.72 -0.17 0.09 0.93 -1.18 0.00 0.00 179.01 179.40 1l3n h GLU 133 N -0.27 0.21 -0.94 1.92 3.07 -1.97 -0.69 114.58 115.91 1l3n h GLU 133 Ca 0.16 -0.01 0.17 0.00 -0.50 0.00 0.00 59.36 59.18 1l3n h GLU 133 Cb 0.54 -0.05 -0.08 0.00 -0.84 0.00 0.00 28.75 28.32 1l3n h GLU 133 CO -0.51 0.14 0.60 0.66 -1.40 0.00 0.00 179.01 178.49 1l3n h SER 134 N 0.21 0.65 -0.04 1.42 4.64 -0.48 0.28 113.55 120.23 1l3n h SER 134 Ca 0.30 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 1l3n h SER 134 Cb 0.45 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1l3n h SER 134 CO -0.42 0.28 0.00 1.07 -0.87 0.00 0.00 176.83 176.90 1l3n n THR 135 N -4.61 0.03 -0.04 2.95 5.66 -0.33 -2.37 114.28 115.57 1l3n n THR 135 Ca 0.20 -0.28 -0.09 0.00 -3.05 0.00 0.00 64.05 60.83 1l3n n THR 135 Cb 0.56 0.55 -0.03 0.00 -1.55 0.00 0.00 70.33 69.85 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 0.28 0.23 0.00 1.09 5.02 0.68 -2.13 118.16 123.33 1l3n n LYS 136 Ca 0.18 0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.57 1l3n n LYS 136 Cb 0.37 -0.89 0.00 0.00 -0.02 0.00 0.00 35.03 34.49 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 -3.63 0.29 0.00 -0.18 -2.24 0.45 -4.22 114.28 104.75 1l3n n THR 137 Ca -0.16 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 1l3n n THR 137 Cb 0.51 1.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.81 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 -0.14 2.06 2.04 3.38 0.00 -0.13 -4.01 105.19 108.38 1l3n n GLY 138 Ca 0.00 -0.49 -0.01 0.00 0.00 0.00 0.00 46.02 45.51 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 8.45 -0.80 0.00 1.61 3.02 -1.26 -2.14 115.26 124.13 1l3n n ASN 139 Ca 0.00 -1.63 0.11 0.00 -0.03 0.00 0.00 54.58 53.02 1l3n n ASN 139 Cb 0.00 0.37 0.64 0.00 -0.61 0.00 0.00 39.78 40.18 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 -0.80 2.31 -0.09 5.41 0.00 -1.26 -4.70 120.51 121.38 1l3n n ALA 140 Ca -0.11 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1l3n n ALA 140 Cb 0.69 -1.35 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 0.36 -1.53 3.71 0.00 0.00 -1.26 -0.21 105.19 106.25 1l3n n GLY 141 Ca 0.16 -1.31 -0.42 0.00 0.00 0.00 0.00 46.02 44.45 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 0.05 2.85 -3.85 1.61 7.64 -1.26 -4.53 113.62 116.14 1l3n n SER 142 Ca 0.00 1.20 -0.38 0.00 1.01 0.00 0.00 58.87 60.70 1l3n n SER 142 Cb 0.00 -1.50 -0.09 0.00 -1.01 0.00 0.00 64.21 61.61 1l3n n SER 142 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1l3n n ARG 143 N 0.46 0.81 -0.30 1.43 3.00 -1.26 -0.50 116.66 120.31 1l3n n ARG 143 Ca 0.05 -1.63 0.12 0.00 -0.01 0.00 0.00 57.85 56.38 1l3n n ARG 143 Cb 0.37 -3.03 0.26 0.00 0.00 0.00 0.00 32.46 30.06 1l3n n ARG 143 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 1l3n h LEU 144 N 17.02 -0.16 -7.14 0.55 5.85 -1.79 -3.43 115.31 126.22 1l3n h LEU 144 Ca 0.28 0.21 -0.07 0.00 0.84 0.00 0.00 57.88 59.14 1l3n h LEU 144 Cb 0.76 0.33 -0.20 0.00 0.37 0.00 0.00 40.66 41.91 1l3n h LEU 144 CO 1.76 -0.20 0.03 0.00 -0.34 0.00 0.00 178.44 179.68 1l3n s ALA 145 N -5.98 -1.49 0.03 1.25 0.00 -0.97 -3.79 121.76 110.81 1l3n s ALA 145 Ca -0.12 1.30 -0.00 0.00 0.00 0.00 0.00 51.96 53.14 1l3n s ALA 145 Cb 0.26 -0.39 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 1l3n s ALA 145 CO 0.77 -0.32 -0.03 0.00 0.00 0.00 0.00 175.76 176.18 1l3n s GLY 147 N -1.86 -0.21 -0.13 0.00 0.00 -0.59 -1.25 107.32 103.29 1l3n s GLY 147 Ca -0.09 0.64 -0.06 0.00 0.00 0.00 0.00 44.72 45.21 1l3n s GLY 147 CO -0.03 0.47 0.10 0.14 0.00 0.00 0.00 173.10 173.77 1l3n s VAL 148 N -0.63 5.13 -0.49 1.40 1.01 -1.26 -0.47 120.40 125.09 1l3n s VAL 148 Ca -0.07 0.07 -0.28 0.00 0.00 0.00 0.00 61.98 61.69 1l3n s VAL 148 Cb -0.04 -3.24 0.01 0.00 0.00 0.00 0.00 36.38 33.12 1l3n s VAL 148 CO 0.03 0.58 1.39 -0.63 0.00 0.00 0.00 175.10 176.47 1l3n s ILE 149 N -0.72 3.88 0.33 2.22 1.01 -0.06 -4.34 121.20 123.51 1l3n s ILE 149 Ca 0.13 0.83 0.09 0.00 0.00 0.00 0.00 60.65 61.69 1l3n s ILE 149 Cb -0.12 -4.35 -0.04 0.00 0.01 0.00 0.00 42.46 37.96 1l3n s ILE 149 CO 0.03 -0.97 0.10 -0.83 0.00 0.00 0.00 174.94 173.26 1l3n s GLY 150 N 4.05 1.95 0.44 6.18 0.00 0.66 -0.70 107.32 119.89 1l3n s GLY 150 Ca 0.56 -1.84 -0.25 0.00 0.00 0.00 0.00 44.72 43.19 1l3n s GLY 150 CO 0.29 -1.79 1.32 -0.42 0.00 0.00 0.00 173.10 172.50 1l3n s ILE 151 N -2.44 2.48 0.12 0.90 1.01 -1.26 -0.59 121.20 121.42 1l3n s ILE 151 Ca 0.36 0.41 0.01 0.00 0.00 0.00 0.00 60.65 61.43 1l3n s ILE 151 Cb -0.02 -3.23 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 1l3n s ILE 151 CO 0.22 0.04 -0.02 0.00 0.00 0.00 0.00 174.94 175.18 1l3n s ALA 152 N -1.29 1.02 0.00 9.38 0.00 -0.43 -4.50 121.76 125.94 1l3n s ALA 152 Ca 0.61 -1.43 0.00 0.00 0.00 0.00 0.00 51.96 51.14 1l3n s ALA 152 Cb -0.38 0.41 0.00 0.00 0.00 0.00 0.00 23.12 23.15 1l3n s ALA 152 CO 0.49 -0.32 0.19 1.04 0.00 0.00 0.00 175.76 177.15