#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l3n h THR 2 N 0.00 0.00 -2.75 0.00 1.03 -1.88 -3.43 112.91 105.88 1l3n h THR 2 Ca 0.00 -0.61 -0.11 0.00 -0.01 0.00 0.00 66.41 65.68 1l3n h THR 2 Cb 0.00 1.17 -0.22 0.00 -1.07 0.00 0.00 68.15 68.03 1l3n h THR 2 CO 0.00 0.00 -0.20 -1.59 -0.01 0.00 0.00 175.52 173.72 1l3n s LYS 3 N -3.21 0.62 0.13 0.00 -2.85 -1.26 -0.19 119.74 112.97 1l3n s LYS 3 Ca 0.05 0.28 0.03 0.00 -1.00 0.00 0.00 55.97 55.33 1l3n s LYS 3 Cb 0.12 0.29 -0.04 0.00 -2.06 0.00 0.00 37.83 36.14 1l3n s LYS 3 CO 0.74 -0.13 -0.07 0.00 0.10 0.00 0.00 175.35 175.99 1l3n s ALA 4 N -0.47 1.20 0.14 0.59 0.00 -0.07 -0.97 121.76 122.17 1l3n s ALA 4 Ca -0.06 -1.43 0.10 0.00 0.00 0.00 0.00 51.96 50.57 1l3n s ALA 4 Cb -0.03 0.17 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 1l3n s ALA 4 CO 0.03 -0.20 -0.24 0.08 0.00 0.00 0.00 175.76 175.43 1l3n s VAL 5 N -3.53 2.11 -0.30 0.00 1.01 0.50 -0.38 120.40 119.82 1l3n s VAL 5 Ca 0.15 -1.76 -0.01 0.00 0.00 0.00 0.00 61.98 60.36 1l3n s VAL 5 Cb 0.04 -1.90 0.10 0.00 0.00 0.00 0.00 36.38 34.62 1l3n s VAL 5 CO -0.02 -0.01 0.10 0.00 0.00 0.00 0.00 175.10 175.17 1l3n s ALA 6 N -1.24 1.46 -0.49 5.51 0.00 0.51 -0.71 121.76 126.79 1l3n s ALA 6 Ca 0.13 -1.58 -0.26 0.00 0.00 0.00 0.00 51.96 50.25 1l3n s ALA 6 Cb -0.09 -1.58 0.03 0.00 0.00 0.00 0.00 23.12 21.47 1l3n s ALA 6 CO 0.06 -1.64 0.99 0.14 0.00 0.00 0.00 175.76 175.31 1l3n s VAL 7 N 1.66 4.38 0.06 0.00 -7.23 -1.26 -1.31 120.40 116.69 1l3n s VAL 7 Ca 0.09 0.77 -0.07 0.00 -1.81 0.00 0.00 61.98 60.96 1l3n s VAL 7 Cb -0.17 -4.50 -0.05 0.00 0.56 0.00 0.00 36.38 32.21 1l3n s VAL 7 CO -0.25 -0.95 0.33 -0.76 -0.31 0.00 0.00 175.10 173.16 1l3n s LEU 8 N 4.00 4.34 0.20 1.32 1.43 0.69 -4.26 118.68 126.41 1l3n s LEU 8 Ca 0.39 0.63 -0.20 0.00 -1.03 0.00 0.00 54.13 53.91 1l3n s LEU 8 Cb -0.10 -2.90 0.04 0.00 0.03 0.00 0.00 46.19 43.26 1l3n s LEU 8 CO 0.26 0.19 0.59 -0.54 0.23 0.00 0.00 176.35 177.08 1l3n s LYS 9 N -2.00 1.44 0.13 1.70 1.02 0.01 -0.54 119.74 121.50 1l3n s LYS 9 Ca 0.32 -0.78 0.00 0.00 0.02 0.00 0.00 55.97 55.53 1l3n s LYS 9 Cb -0.13 0.56 0.00 0.00 -0.52 0.00 0.00 37.83 37.74 1l3n s LYS 9 CO 0.19 -0.63 0.00 0.41 -0.92 0.00 0.00 175.35 174.40 1l3n n GLY 10 N -0.38 -1.83 0.17 -3.33 0.00 -1.25 -0.66 105.19 97.90 1l3n n GLY 10 Ca -0.11 0.44 -0.19 0.00 0.00 0.00 0.00 46.02 46.16 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 0.73 0.00 1.61 3.32 -1.82 -3.49 116.42 116.76 1l3n h ASP 11 Ca 0.00 -0.75 0.00 0.00 0.02 0.00 0.00 57.03 56.30 1l3n h ASP 11 Cb 0.00 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.33 1l3n h ASP 11 CO 0.00 1.39 0.00 0.61 -1.72 0.00 0.00 179.24 179.52 1l3n n GLY 12 N 1.09 2.40 0.32 2.75 0.00 -1.26 -4.93 105.19 105.56 1l3n n GLY 12 Ca -0.11 -0.45 0.01 0.00 0.00 0.00 0.00 46.02 45.46 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 -6.29 1.61 0.13 -1.92 -3.37 132.00 123.11 1l3n h PRO 13 Ca 0.00 -0.06 -0.57 0.00 -0.87 0.00 0.00 66.00 64.51 1l3n h PRO 13 Cb 0.00 -0.22 -0.03 0.00 0.13 0.00 0.00 31.00 30.88 1l3n h PRO 13 CO 0.00 0.63 1.24 0.54 -0.23 0.00 0.00 178.00 180.19 1l3n s VAL 14 N -6.07 3.55 -0.20 1.56 0.11 -1.24 -3.98 120.40 114.14 1l3n s VAL 14 Ca -0.13 0.54 0.01 0.00 -2.93 0.00 0.00 61.98 59.48 1l3n s VAL 14 Cb 0.18 -3.79 0.03 0.00 -1.53 0.00 0.00 36.38 31.28 1l3n s VAL 14 CO 0.79 -0.53 -0.17 -1.10 -3.33 0.00 0.00 175.10 170.76 1l3n s GLN 15 N 5.66 2.73 0.01 1.54 -0.21 0.42 -3.94 119.66 125.86 1l3n s GLN 15 Ca 0.75 -0.93 -0.11 0.00 0.02 0.00 0.00 55.36 55.09 1l3n s GLN 15 Cb -0.20 -2.61 -0.05 0.00 1.00 0.00 0.00 33.01 31.15 1l3n s GLN 15 CO 0.32 -0.30 0.34 0.20 -2.12 0.00 0.00 175.29 173.73 1l3n s GLY 16 N 1.26 2.35 -0.41 3.09 0.00 0.29 -0.86 107.32 113.05 1l3n s GLY 16 Ca 0.02 -0.39 0.08 0.00 0.00 0.00 0.00 44.72 44.43 1l3n s GLY 16 CO -0.11 -0.12 0.68 1.39 0.00 0.00 0.00 173.10 174.95 1l3n n ILE 17 N 1.46 -0.40 -3.32 0.90 5.41 -1.24 -0.22 119.36 121.94 1l3n n ILE 17 Ca -0.13 -3.44 -0.38 0.00 1.00 0.00 0.00 62.75 59.80 1l3n n ILE 17 Cb 0.53 -0.66 -0.06 0.00 -0.71 0.00 0.00 39.64 38.74 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 -0.95 4.99 -0.17 1.39 -1.09 -0.43 -3.83 121.20 121.11 1l3n s ILE 18 Ca 0.34 1.05 -0.08 0.00 -2.23 0.00 0.00 60.65 59.74 1l3n s ILE 18 Cb 0.23 -3.84 -0.04 0.00 -1.58 0.00 0.00 42.46 37.23 1l3n s ILE 18 CO -0.13 0.45 0.10 0.20 -1.23 0.00 0.00 174.94 174.33 1l3n s ASN 19 N -0.31 5.96 -0.63 3.58 0.01 0.67 -0.37 114.94 123.85 1l3n s ASN 19 Ca 0.27 0.21 0.01 0.00 -0.71 0.00 0.00 52.86 52.65 1l3n s ASN 19 Cb -0.17 -2.00 0.16 0.00 0.41 0.00 0.00 41.25 39.65 1l3n s ASN 19 CO 0.14 0.24 0.43 -0.36 -1.51 0.00 0.00 177.10 176.03 1l3n s PHE 20 N 0.01 3.40 0.47 2.20 0.40 0.49 -1.01 117.98 123.95 1l3n s PHE 20 Ca 0.08 -3.03 -0.12 0.00 -0.60 0.00 0.00 56.93 53.27 1l3n s PHE 20 Cb -0.12 -2.99 -0.06 0.00 0.51 0.00 0.00 43.02 40.36 1l3n s PHE 20 CO 0.00 -0.74 0.86 -1.21 0.70 0.00 0.00 175.22 174.83 1l3n s GLU 21 N -0.53 3.78 -0.30 0.44 8.01 -1.23 -0.89 118.70 127.97 1l3n s GLU 21 Ca 0.20 0.60 -0.01 0.00 0.01 0.00 0.00 54.97 55.77 1l3n s GLU 21 Cb -0.18 -2.29 0.13 0.00 -4.31 0.00 0.00 34.13 27.48 1l3n s GLU 21 CO -0.05 -0.18 0.26 -1.14 0.01 0.00 0.00 175.26 174.16 1l3n s GLN 22 N -4.15 0.31 0.05 1.61 0.74 0.73 -3.90 119.66 115.05 1l3n s GLN 22 Ca 0.53 -0.31 -0.31 0.00 0.05 0.00 0.00 55.36 55.32 1l3n s GLN 22 Cb -0.10 -0.80 -0.18 0.00 1.10 0.00 0.00 33.01 33.03 1l3n s GLN 22 CO 0.35 -1.04 1.45 1.57 -0.55 0.00 0.00 175.29 177.07 1l3n h LYS 23 N 8.20 -0.87 -5.29 1.67 2.10 -1.86 -3.40 116.57 117.11 1l3n h LYS 23 Ca -0.13 0.06 -0.41 0.00 -2.00 0.00 0.00 60.65 58.17 1l3n h LYS 23 Cb 1.05 0.20 -0.14 0.00 -0.90 0.00 0.00 32.23 32.44 1l3n h LYS 23 CO 0.35 -0.55 -0.69 -1.21 -2.00 0.00 0.00 179.45 175.35 1l3n s GLU 24 N -5.54 1.33 0.00 0.07 2.02 -1.26 -4.99 118.70 110.32 1l3n s GLU 24 Ca -0.17 -1.64 0.26 0.00 0.02 0.00 0.00 54.97 53.44 1l3n s GLU 24 Cb 0.03 -0.86 1.34 0.00 0.10 0.00 0.00 34.13 34.74 1l3n s GLU 24 CO 0.56 0.03 1.87 0.45 0.02 0.00 0.00 175.26 178.20 1l3n n SER 25 N -0.40 0.00 0.18 -0.19 2.88 -1.26 -0.74 113.62 114.09 1l3n n SER 25 Ca -0.07 -0.22 0.08 0.00 -1.33 0.00 0.00 58.87 57.33 1l3n n SER 25 Cb 0.62 -0.23 0.10 0.00 -0.75 0.00 0.00 64.21 63.96 1l3n n SER 25 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 1l3n h ASN 26 N 0.00 0.00 -4.02 -3.46 4.21 -1.99 -3.46 115.58 106.86 1l3n h ASN 26 Ca 0.00 0.00 -0.45 0.00 1.21 0.00 0.00 56.30 57.06 1l3n h ASN 26 Cb 0.19 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.37 1l3n h ASN 26 CO 0.00 0.19 0.34 -0.83 -1.29 0.00 0.00 177.43 175.84 1l3n s GLY 27 N -4.32 2.49 0.38 2.83 0.00 0.08 -5.04 107.32 103.74 1l3n s GLY 27 Ca 0.05 0.44 -0.27 0.00 0.00 0.00 0.00 44.72 44.94 1l3n s GLY 27 CO 0.71 0.76 1.35 2.56 0.00 0.00 0.00 173.10 178.48 1l3n s PRO 28 N -2.93 4.12 -1.19 2.90 0.04 -1.26 -4.80 135.00 131.87 1l3n s PRO 28 Ca 0.60 2.28 -0.20 0.00 0.04 0.00 0.00 61.00 63.72 1l3n s PRO 28 Cb -0.12 -2.91 0.04 0.00 0.04 0.00 0.00 34.50 31.56 1l3n s PRO 28 CO 0.16 -0.41 1.70 0.08 0.04 0.00 0.00 177.00 178.56 1l3n s VAL 29 N -1.18 3.97 -0.22 -0.36 1.01 -1.26 -4.76 120.40 117.59 1l3n s VAL 29 Ca 0.53 -1.43 -0.28 0.00 0.00 0.00 0.00 61.98 60.80 1l3n s VAL 29 Cb -0.41 -5.03 -0.04 0.00 0.00 0.00 0.00 36.38 30.90 1l3n s VAL 29 CO 0.54 -1.83 2.01 -0.75 0.00 0.00 0.00 175.10 175.07 1l3n s LYS 30 N 4.82 3.36 -0.24 2.72 2.20 -1.25 -4.26 119.74 127.10 1l3n s LYS 30 Ca 0.54 1.89 -0.19 0.00 -0.36 0.00 0.00 55.97 57.85 1l3n s LYS 30 Cb 0.02 -4.27 -0.03 0.00 -1.51 0.00 0.00 37.83 32.04 1l3n s LYS 30 CO 0.03 -1.83 0.54 0.14 -0.36 0.00 0.00 175.35 173.87 1l3n s VAL 31 N 7.19 5.07 0.07 4.02 -7.23 0.75 -3.57 120.40 126.70 1l3n s VAL 31 Ca 0.91 0.95 0.04 0.00 -1.81 0.00 0.00 61.98 62.07 1l3n s VAL 31 Cb -0.30 -3.85 -0.03 0.00 0.56 0.00 0.00 36.38 32.76 1l3n s VAL 31 CO 0.35 0.11 -0.11 -1.66 -0.31 0.00 0.00 175.10 173.48 1l3n s TRP 32 N 2.07 0.99 -1.23 2.82 -2.14 -0.18 -0.96 118.94 120.32 1l3n s TRP 32 Ca 0.23 -0.51 0.00 0.00 2.66 0.00 0.00 56.10 58.48 1l3n s TRP 32 Cb -0.16 -0.56 0.00 0.00 -3.10 0.00 0.00 33.47 29.65 1l3n s TRP 32 CO 0.09 -0.00 0.00 0.41 -2.66 0.00 0.00 176.95 174.79 1l3n n GLY 33 N 1.20 -1.47 2.83 3.67 0.00 0.16 -0.24 105.19 111.34 1l3n n GLY 33 Ca -0.21 -1.04 -0.30 0.00 0.00 0.00 0.00 46.02 44.48 1l3n n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1l3n s SER 34 N -1.12 4.00 0.47 1.61 0.01 -1.25 -0.47 113.70 116.95 1l3n s SER 34 Ca 0.00 -1.54 -0.20 0.00 1.31 0.00 0.00 55.95 55.52 1l3n s SER 34 Cb 0.00 -1.04 -0.09 0.00 0.21 0.00 0.00 66.02 65.10 1l3n s SER 34 CO 0.00 -0.36 1.00 0.27 0.41 0.00 0.00 173.24 174.57 1l3n s ILE 35 N 1.47 4.04 0.00 1.44 -4.36 -0.56 -4.16 121.20 119.07 1l3n s ILE 35 Ca 0.05 1.25 0.01 0.00 -0.26 0.00 0.00 60.65 61.71 1l3n s ILE 35 Cb -0.18 -3.51 -0.01 0.00 1.25 0.00 0.00 42.46 40.01 1l3n s ILE 35 CO -0.16 -0.30 -0.05 -1.59 0.24 0.00 0.00 174.94 173.08 1l3n s LYS 36 N -3.28 0.38 0.00 0.37 -2.85 -0.04 -0.71 119.74 113.61 1l3n s LYS 36 Ca 0.65 -0.26 0.00 0.00 -1.00 0.00 0.00 55.97 55.35 1l3n s LYS 36 Cb -0.13 -0.32 0.00 0.00 -2.06 0.00 0.00 37.83 35.31 1l3n s LYS 36 CO 0.18 0.08 0.00 0.41 0.10 0.00 0.00 175.35 176.13 1l3n n GLY 37 N 2.70 0.79 3.47 0.59 0.00 -0.62 -0.44 105.19 111.68 1l3n n GLY 37 Ca -0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 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 0.07 0.39 0.99 2.01 -0.90 -3.58 118.68 117.66 1l3n s LEU 38 Ca 0.00 0.91 0.06 0.00 0.01 0.00 0.00 54.13 55.11 1l3n s LEU 38 Cb 0.00 -2.59 0.00 0.00 0.01 0.00 0.00 46.19 43.61 1l3n s LEU 38 CO 0.00 -4.55 0.54 0.28 1.01 0.00 0.00 176.35 173.63 1l3n s THR 39 N -2.63 3.61 1.17 5.49 -1.32 -1.26 -3.75 115.64 116.95 1l3n s THR 39 Ca 0.69 -0.93 -0.14 0.00 -1.21 0.00 0.00 61.69 60.10 1l3n s THR 39 Cb -0.14 -3.25 0.25 0.00 -1.51 0.00 0.00 72.50 67.85 1l3n s THR 39 CO 0.58 -0.11 0.79 1.21 -2.21 0.00 0.00 174.62 174.89 1l3n n GLU 40 N -1.80 -2.29 0.00 7.08 0.00 -1.26 -4.61 120.64 117.75 1l3n n GLU 40 Ca 0.03 -0.64 0.00 0.00 0.00 0.00 0.00 57.16 56.55 1l3n n GLU 40 Cb 0.58 -2.07 0.00 0.00 0.00 0.00 0.00 31.44 29.96 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 1.24 -3.01 3.78 8.31 0.00 -0.89 -4.74 105.19 109.87 1l3n n GLY 41 Ca 0.02 -1.78 -0.34 0.00 0.00 0.00 0.00 46.02 43.92 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 3.53 -0.08 0.99 1.02 -1.26 -0.81 118.68 122.06 1l3n s LEU 42 Ca 0.00 2.02 -0.12 0.00 0.02 0.00 0.00 54.13 56.05 1l3n s LEU 42 Cb 0.00 -4.56 0.03 0.00 0.02 0.00 0.00 46.19 41.68 1l3n s LEU 42 CO 0.00 -1.41 0.31 -1.00 0.02 0.00 0.00 176.35 174.27 1l3n s HIS 43 N -2.18 -0.28 -0.06 0.29 3.76 0.13 -3.13 115.29 113.82 1l3n s HIS 43 Ca 0.68 0.64 -0.25 0.00 -0.15 0.00 0.00 55.06 55.98 1l3n s HIS 43 Cb -0.21 0.11 -0.12 0.00 1.11 0.00 0.00 32.58 33.47 1l3n s HIS 43 CO 0.36 -0.24 0.71 0.41 -0.85 0.00 0.00 174.74 175.13 1l3n n GLY 44 N 2.35 -0.11 3.02 -2.22 0.00 0.46 -2.74 105.19 105.94 1l3n n GLY 44 Ca -0.16 0.49 -0.03 0.00 0.00 0.00 0.00 46.02 46.32 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 0.38 -1.31 0.31 1.61 2.19 -1.26 -1.20 117.98 118.70 1l3n s PHE 45 Ca 0.57 0.85 -0.10 0.00 0.33 0.00 0.00 56.93 58.58 1l3n s PHE 45 Cb -0.79 0.12 0.01 0.00 -1.31 0.00 0.00 43.02 41.05 1l3n s PHE 45 CO 0.38 -0.95 0.54 -1.01 1.83 0.00 0.00 175.22 176.00 1l3n s HIS 46 N 2.67 0.57 0.26 10.12 3.76 -1.03 -1.44 115.29 130.20 1l3n s HIS 46 Ca 0.12 -0.94 -0.29 0.00 -0.15 0.00 0.00 55.06 53.80 1l3n s HIS 46 Cb -0.13 0.21 -0.09 0.00 1.11 0.00 0.00 32.58 33.68 1l3n s HIS 46 CO -0.25 -1.15 0.96 0.54 -0.85 0.00 0.00 174.74 173.99 1l3n s VAL 47 N -3.37 4.01 -0.32 -0.90 0.11 -1.00 -2.26 120.40 116.66 1l3n s VAL 47 Ca 0.24 1.96 0.01 0.00 -2.93 0.00 0.00 61.98 61.26 1l3n s VAL 47 Cb -0.01 -4.22 0.10 0.00 -1.53 0.00 0.00 36.38 30.72 1l3n s VAL 47 CO 0.14 0.42 0.07 -1.00 -3.33 0.00 0.00 175.10 171.39 1l3n s HIS 48 N -1.26 2.69 0.00 1.54 3.76 -0.25 -4.71 115.29 117.06 1l3n s HIS 48 Ca 0.43 -2.32 0.00 0.00 -0.15 0.00 0.00 55.06 53.02 1l3n s HIS 48 Cb -0.26 -2.27 0.00 0.00 1.11 0.00 0.00 32.58 31.17 1l3n s HIS 48 CO 0.32 -0.91 0.00 -0.85 -0.85 0.00 0.00 174.74 172.45 1l3n n GLU 49 N 4.57 0.00 -2.04 1.40 0.28 -1.26 -3.26 120.64 120.33 1l3n n GLU 49 Ca 0.00 0.00 -0.30 0.00 -0.16 0.00 0.00 57.16 56.71 1l3n n GLU 49 Cb 0.42 0.00 0.02 0.00 1.43 0.00 0.00 31.44 33.32 1l3n n GLU 49 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 1l3n s PHE 50 N 0.00 3.46 -0.39 -1.84 0.08 0.18 -4.46 117.98 115.01 1l3n s PHE 50 Ca 0.00 1.06 0.23 0.00 0.12 0.00 0.00 56.93 58.34 1l3n s PHE 50 Cb 0.00 -2.80 0.21 0.00 -0.57 0.00 0.00 43.02 39.86 1l3n s PHE 50 CO 0.00 -0.83 1.31 0.78 -0.10 0.00 0.00 175.22 176.38 1l3n h GLY 51 N -0.35 0.00 -1.21 4.36 0.00 -1.53 -1.88 103.07 102.47 1l3n h GLY 51 Ca -0.45 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.39 1l3n h GLY 51 CO 0.62 0.00 0.22 0.51 0.00 0.00 0.00 176.54 177.90 1l3n s ASP 52 N -5.40 3.14 0.00 0.19 -4.77 -1.26 -4.66 116.67 103.91 1l3n s ASP 52 Ca 0.04 1.81 0.00 0.00 -3.30 0.00 0.00 52.55 51.09 1l3n s ASP 52 Cb 0.09 -2.41 0.00 0.00 -1.09 0.00 0.00 42.92 39.51 1l3n s ASP 52 CO 0.73 -2.90 0.36 -3.20 0.70 0.00 0.00 175.17 170.87 1l3n n ASN 53 N -4.08 0.00 -0.31 2.11 2.85 -1.26 -1.62 115.26 112.95 1l3n n ASN 53 Ca 0.08 -0.92 0.15 0.00 -0.11 0.00 0.00 54.58 53.78 1l3n n ASN 53 Cb 0.53 0.00 0.39 0.00 1.24 0.00 0.00 39.78 41.95 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 4.22 0.71 0.00 -0.44 2.02 -1.96 0.27 112.91 117.73 1l3n h THR 54 Ca 0.00 -0.22 -0.04 0.00 0.77 0.00 0.00 66.41 66.92 1l3n h THR 54 Cb 0.92 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 1l3n h THR 54 CO 0.00 0.12 -0.19 0.00 0.37 0.00 0.00 175.52 175.82 1l3n h ALA 55 N 1.62 0.89 0.00 6.16 0.00 -1.98 -3.49 119.26 122.46 1l3n h ALA 55 Ca 0.53 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1l3n h ALA 55 Cb 0.98 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1l3n h ALA 55 CO -0.29 0.23 0.00 0.41 0.00 0.00 0.00 179.25 179.61 1l3n n GLY 56 N 1.06 0.80 2.55 0.00 0.00 0.94 -4.88 105.19 105.65 1l3n n GLY 56 Ca 0.03 -0.82 -0.14 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 -3.50 0.36 -0.26 0.00 -1.04 -1.26 -4.90 114.28 103.69 1l3n n THR 58 Ca -0.14 0.12 0.07 0.00 -2.04 0.00 0.00 64.05 62.06 1l3n n THR 58 Cb 0.61 -0.84 0.20 0.00 -1.82 0.00 0.00 70.33 68.48 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 -0.11 -0.19 8.00 0.02 -1.82 -1.52 113.55 117.93 1l3n h SER 59 Ca 0.00 0.17 0.04 0.00 -0.84 0.00 0.00 61.79 61.16 1l3n h SER 59 Cb 0.02 0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.78 1l3n h SER 59 CO 0.00 -0.11 -0.04 0.00 -1.14 0.00 0.00 176.83 175.54 1l3n n ALA 60 N -2.76 0.05 0.00 3.77 0.00 -0.64 -4.87 120.51 116.05 1l3n n ALA 60 Ca 0.15 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1l3n n ALA 60 Cb 0.51 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.83 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 -1.12 2.60 0.00 0.00 0.00 -0.57 -0.65 105.19 105.45 1l3n n GLY 61 Ca 0.03 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.07 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 -1.46 2.47 -2.12 1.61 -0.04 -1.26 -4.81 135.00 129.40 1l3n n PRO 62 Ca 0.00 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.10 1l3n n PRO 62 Cb 0.00 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 33.49 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 0.00 3.12 -1.28 0.54 8.25 -1.26 -4.07 115.22 120.52 1l3n n HIS 63 Ca 0.00 -2.59 -0.37 0.00 -0.26 0.00 0.00 57.72 54.50 1l3n n HIS 63 Cb 0.00 -0.85 -0.03 0.00 1.12 0.00 0.00 29.99 30.24 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 -0.51 2.40 -1.21 4.41 3.72 -1.26 -4.93 117.46 120.09 1l3n n PHE 64 Ca 0.49 -2.91 -0.33 0.00 -0.05 0.00 0.00 57.45 54.64 1l3n n PHE 64 Cb 0.36 -2.38 0.11 0.00 -0.94 0.00 0.00 39.48 36.63 1l3n n PHE 64 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1l3n s ASN 65 N 2.50 3.83 0.04 4.37 2.20 -1.26 -4.75 114.94 121.87 1l3n s ASN 65 Ca 0.63 2.30 -0.31 0.00 -0.94 0.00 0.00 52.86 54.55 1l3n s ASN 65 Cb 0.16 -2.58 -0.17 0.00 -2.00 0.00 0.00 41.25 36.66 1l3n s ASN 65 CO -0.06 -2.51 1.37 1.55 -2.94 0.00 0.00 177.10 174.51 1l3n h PRO 66 N -0.78 -0.92 -2.96 3.55 0.13 -1.91 -3.28 132.00 125.83 1l3n h PRO 66 Ca -0.46 0.06 -0.55 0.00 -0.87 0.00 0.00 66.00 64.18 1l3n h PRO 66 Cb 1.29 0.21 0.01 0.00 0.13 0.00 0.00 31.00 32.64 1l3n h PRO 66 CO 0.47 -0.58 3.06 1.28 -0.23 0.00 0.00 178.00 182.00 1l3n n LEU 67 N -5.45 7.50 -4.59 1.56 4.32 -1.26 -4.92 117.00 114.16 1l3n n LEU 67 Ca -0.13 -3.89 -0.44 0.00 -0.02 0.00 0.00 56.01 51.53 1l3n n LEU 67 Cb 0.39 -1.43 -0.03 0.00 -1.62 0.00 0.00 43.42 40.73 1l3n n LEU 67 CO 0.34 1.72 1.83 -0.24 -1.22 0.00 0.00 177.39 179.82 1l3n n SER 68 N 3.56 3.21 0.00 -1.43 2.88 -1.24 -4.73 113.62 115.87 1l3n n SER 68 Ca 0.67 0.27 0.00 0.00 -1.33 0.00 0.00 58.87 58.47 1l3n n SER 68 Cb 0.29 -1.53 0.00 0.00 -0.75 0.00 0.00 64.21 62.22 1l3n n SER 68 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1l3n n ARG 69 N 8.62 0.00 -3.92 -1.46 1.74 -1.26 -5.12 116.66 115.26 1l3n n ARG 69 Ca 0.30 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.29 1l3n n ARG 69 Cb 0.42 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.78 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 0.01 0.66 -0.00 5.56 1.02 -0.28 -5.05 119.74 121.65 1l3n s LYS 70 Ca 0.00 -0.82 -0.30 0.00 0.02 0.00 0.00 55.97 54.87 1l3n s LYS 70 Cb 0.00 0.26 -0.07 0.00 -0.52 0.00 0.00 37.83 37.49 1l3n s LYS 70 CO 0.00 -0.17 1.82 -1.58 -0.92 0.00 0.00 175.35 174.50 1l3n s HIS 71 N -2.98 1.62 0.00 3.18 5.65 -0.57 -2.34 115.29 119.86 1l3n s HIS 71 Ca -0.02 -0.15 0.00 0.00 0.25 0.00 0.00 55.06 55.14 1l3n s HIS 71 Cb 0.01 -4.09 0.00 0.00 -1.18 0.00 0.00 32.58 27.32 1l3n s HIS 71 CO -0.06 -4.78 0.00 0.41 -0.65 0.00 0.00 174.74 169.66 1l3n n GLY 72 N 4.34 4.51 0.00 1.59 0.00 -1.26 -2.46 105.19 111.91 1l3n n GLY 72 Ca 0.19 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 45.12 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 4.00 0.11 -0.02 0.00 -1.26 -4.60 105.19 103.41 1l3n n GLY 73 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.99 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 0.56 -0.01 1.61 -0.04 -1.26 -0.87 135.00 134.98 1l3n n PRO 74 Ca 0.00 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.47 1l3n n PRO 74 Cb 0.00 -1.06 -0.12 0.00 -0.04 0.00 0.00 33.50 32.28 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 -0.35 0.65 -4.28 0.54 4.76 -1.26 -5.01 118.16 113.21 1l3n n LYS 75 Ca 0.00 0.02 -0.26 0.00 -2.87 0.00 0.00 58.31 55.20 1l3n n LYS 75 Cb 0.03 -1.64 -0.08 0.00 -1.84 0.00 0.00 35.03 31.50 1l3n n LYS 75 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1l3n s ASP 76 N -5.29 4.29 -0.00 4.39 1.01 -0.05 -5.04 116.67 115.98 1l3n s ASP 76 Ca -0.06 -1.21 0.00 0.00 0.71 0.00 0.00 52.55 51.99 1l3n s ASP 76 Cb 0.10 -0.32 0.00 0.00 1.01 0.00 0.00 42.92 43.71 1l3n s ASP 76 CO 0.84 -0.59 0.97 1.21 0.21 0.00 0.00 175.17 177.82 1l3n n GLU 77 N -1.21 2.81 -0.13 8.23 4.07 -1.26 -4.50 120.64 128.64 1l3n n GLU 77 Ca -0.04 -1.46 0.07 0.00 -0.06 0.00 0.00 57.16 55.67 1l3n n GLU 77 Cb 0.65 -0.98 0.13 0.00 -0.06 0.00 0.00 31.44 31.19 1l3n n GLU 77 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22 1l3n n GLU 78 N -0.48 2.13 -1.44 5.31 0.28 -1.26 -5.05 120.64 120.13 1l3n n GLU 78 Ca 0.00 -1.84 -0.40 0.00 -0.16 0.00 0.00 57.16 54.77 1l3n n GLU 78 Cb 0.27 -1.29 0.02 0.00 1.43 0.00 0.00 31.44 31.87 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 0.70 0.51 0.30 3.44 1.85 -1.24 -1.13 116.66 121.09 1l3n n ARG 79 Ca 0.11 0.19 -0.12 0.00 -1.00 0.00 0.00 57.85 57.04 1l3n n ARG 79 Cb 0.41 -1.57 -0.06 0.00 -1.05 0.00 0.00 32.46 30.19 1l3n n ARG 79 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1l3n h HIS 80 N 0.46 -0.72 0.00 2.89 3.86 -1.72 -3.43 115.15 116.49 1l3n h HIS 80 Ca -0.43 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 58.76 1l3n h HIS 80 Cb 1.40 0.24 0.00 0.00 1.06 0.00 0.00 27.41 30.11 1l3n h HIS 80 CO 0.32 -0.45 0.00 1.55 0.86 0.00 0.00 177.93 180.22 1l3n n VAL 81 N -4.15 0.00 -2.64 2.45 3.14 -1.26 -4.34 118.33 111.52 1l3n n VAL 81 Ca -0.10 0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.18 1l3n n VAL 81 Cb 0.31 0.00 0.03 0.00 -1.06 0.00 0.00 33.84 33.11 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 -1.30 2.36 3.55 7.55 0.00 -1.26 -4.88 105.19 111.21 1l3n n GLY 82 Ca 0.00 -1.51 -0.43 0.00 0.00 0.00 0.00 46.02 44.08 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 -3.31 6.44 0.23 1.61 1.01 -1.26 -2.39 116.67 119.00 1l3n s ASP 83 Ca 0.31 -0.04 0.25 0.00 0.71 0.00 0.00 52.55 53.77 1l3n s ASP 83 Cb 0.43 -2.43 0.90 0.00 1.01 0.00 0.00 42.92 42.83 1l3n s ASP 83 CO -0.01 -1.05 1.74 0.18 0.21 0.00 0.00 175.17 176.24 1l3n n LEU 84 N 7.11 0.72 0.00 1.23 4.77 -0.52 -4.18 117.00 126.13 1l3n n LEU 84 Ca 0.04 0.62 0.00 0.00 -0.03 0.00 0.00 56.01 56.64 1l3n n LEU 84 Cb 0.48 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1l3n n LEU 84 CO 0.63 -0.37 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 1l3n n GLY 85 N 0.64 1.19 3.31 -0.72 0.00 -1.26 -4.58 105.19 103.77 1l3n n GLY 85 Ca 0.04 -0.78 -0.08 0.00 0.00 0.00 0.00 46.02 45.20 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 -0.37 0.02 1.61 -0.87 -1.26 -4.48 114.94 105.60 1l3n s ASN 86 Ca 0.00 1.05 -0.00 0.00 -1.57 0.00 0.00 52.86 52.34 1l3n s ASN 86 Cb 0.00 1.41 -0.04 0.00 -0.02 0.00 0.00 41.25 42.60 1l3n s ASN 86 CO 0.00 -0.23 0.13 0.68 -2.57 0.00 0.00 177.10 175.11 1l3n s VAL 87 N 2.56 5.01 -0.07 1.60 -7.23 -1.11 -4.87 120.40 116.30 1l3n s VAL 87 Ca -0.03 -0.40 0.05 0.00 -1.81 0.00 0.00 61.98 59.80 1l3n s VAL 87 Cb -0.12 -3.36 -0.01 0.00 0.56 0.00 0.00 36.38 33.46 1l3n s VAL 87 CO -0.13 0.26 -0.24 0.28 -0.31 0.00 0.00 175.10 174.96 1l3n s THR 88 N -1.32 2.01 -0.16 5.32 -1.32 -1.26 0.23 115.64 119.13 1l3n s THR 88 Ca 0.27 -1.02 -0.07 0.00 -1.21 0.00 0.00 61.69 59.66 1l3n s THR 88 Cb -0.12 -1.72 -0.04 0.00 -1.51 0.00 0.00 72.50 69.11 1l3n s THR 88 CO 0.19 0.55 0.08 0.00 -2.21 0.00 0.00 174.62 173.24 1l3n s ALA 89 N 0.06 3.53 1.27 11.08 0.00 0.01 -3.93 121.76 133.77 1l3n s ALA 89 Ca -0.10 -0.72 -0.16 0.00 0.00 0.00 0.00 51.96 50.97 1l3n s ALA 89 Cb -0.15 -1.93 0.31 0.00 0.00 0.00 0.00 23.12 21.35 1l3n s ALA 89 CO 0.06 0.30 0.87 -0.25 0.00 0.00 0.00 175.76 176.74 1l3n n ASP 90 N 3.11 -2.59 0.30 0.00 8.00 0.67 -2.10 116.55 123.94 1l3n n ASP 90 Ca -0.17 -0.39 0.20 0.00 0.71 0.00 0.00 54.79 55.14 1l3n n ASP 90 Cb 0.53 -1.14 1.01 0.00 -0.02 0.00 0.00 41.12 41.50 1l3n n ASP 90 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1l3n h LYS 91 N -2.96 0.00 0.00 -1.24 1.57 -1.95 0.16 116.57 112.16 1l3n h LYS 91 Ca -0.56 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.21 1l3n h LYS 91 Cb 1.33 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.64 1l3n h LYS 91 CO 0.42 0.00 -0.03 0.22 -0.57 0.00 0.00 179.45 179.49 1l3n h ASP 92 N 0.00 0.00 0.00 0.86 3.58 -1.91 -3.46 116.42 115.50 1l3n h ASP 92 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1l3n h ASP 92 Cb 0.15 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.20 1l3n h ASP 92 CO 0.00 0.03 0.00 0.61 -2.88 0.00 0.00 179.24 177.00 1l3n n GLY 93 N 0.87 0.79 3.63 -0.78 0.00 0.57 -4.19 105.19 106.07 1l3n n GLY 93 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.17 4.38 -0.17 1.61 1.01 -1.26 -1.59 120.40 122.21 1l3n s VAL 94 Ca 0.00 1.54 -0.01 0.00 0.00 0.00 0.00 61.98 63.51 1l3n s VAL 94 Cb 0.00 -4.43 -0.00 0.00 0.00 0.00 0.00 36.38 31.95 1l3n s VAL 94 CO 0.00 -0.61 -0.13 0.00 0.00 0.00 0.00 175.10 174.36 1l3n s ALA 95 N 3.97 2.57 -0.01 5.51 0.00 0.11 -0.24 121.76 133.67 1l3n s ALA 95 Ca 0.48 -1.08 -0.30 0.00 0.00 0.00 0.00 51.96 51.06 1l3n s ALA 95 Cb -0.12 -1.34 -0.03 0.00 0.00 0.00 0.00 23.12 21.63 1l3n s ALA 95 CO 0.21 -0.14 1.03 0.34 0.00 0.00 0.00 175.76 177.20 1l3n s ASP 96 N 0.98 7.29 -0.14 0.00 -1.08 -1.25 -1.50 116.67 120.96 1l3n s ASP 96 Ca -0.02 1.70 -0.02 0.00 -0.52 0.00 0.00 52.55 53.70 1l3n s ASP 96 Cb -0.15 -2.57 -0.02 0.00 -1.46 0.00 0.00 42.92 38.72 1l3n s ASP 96 CO -0.02 -0.34 -0.09 -0.69 0.52 0.00 0.00 175.17 174.55 1l3n s VAL 97 N 1.24 3.37 -0.43 1.11 1.01 0.38 -4.51 120.40 122.57 1l3n s VAL 97 Ca 0.53 -0.54 0.08 0.00 0.00 0.00 0.00 61.98 62.04 1l3n s VAL 97 Cb -0.22 -2.44 0.34 0.00 0.00 0.00 0.00 36.38 34.06 1l3n s VAL 97 CO 0.26 0.51 1.14 -1.54 0.00 0.00 0.00 175.10 175.48 1l3n n SER 98 N 3.54 -1.87 -4.77 3.32 3.41 -1.23 -0.66 113.62 115.35 1l3n n SER 98 Ca -0.18 -3.32 -0.31 0.00 -0.26 0.00 0.00 58.87 54.80 1l3n n SER 98 Cb 0.53 1.44 -0.07 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 -0.07 4.56 -0.10 -1.33 1.09 -0.13 -4.92 121.20 120.31 1l3n s ILE 99 Ca 0.24 -0.68 0.01 0.00 -1.10 0.00 0.00 60.65 59.12 1l3n s ILE 99 Cb 0.33 -3.16 0.02 0.00 -1.06 0.00 0.00 42.46 38.59 1l3n s ILE 99 CO -0.06 0.19 -0.09 -1.83 -0.10 0.00 0.00 174.94 173.05 1l3n s GLU 100 N -2.19 1.59 -0.25 2.79 -1.05 -1.26 -0.18 118.70 118.14 1l3n s GLU 100 Ca 0.27 -0.31 0.00 0.00 -0.15 0.00 0.00 54.97 54.78 1l3n s GLU 100 Cb -0.12 -1.52 0.07 0.00 -0.44 0.00 0.00 34.13 32.12 1l3n s GLU 100 CO 0.20 -0.16 -0.00 0.16 0.95 0.00 0.00 175.26 176.40 1l3n s ASP 101 N 1.33 3.83 -1.29 0.83 -4.77 -1.26 -4.99 116.67 110.34 1l3n s ASP 101 Ca -0.02 -1.31 -0.07 0.00 -3.30 0.00 0.00 52.55 47.85 1l3n s ASP 101 Cb -0.14 -1.08 -0.00 0.00 -1.09 0.00 0.00 42.92 40.61 1l3n s ASP 101 CO -0.04 -0.29 2.75 -1.54 0.70 0.00 0.00 175.17 176.75 1l3n n SER 102 N 4.72 8.04 0.00 2.11 3.41 -1.26 -3.48 113.62 127.16 1l3n n SER 102 Ca -0.08 -2.86 0.00 0.00 -0.26 0.00 0.00 58.87 55.67 1l3n n SER 102 Cb 0.44 -1.44 0.00 0.00 -0.26 0.00 0.00 64.21 62.95 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 2.50 0.00 -1.91 -3.33 3.14 -1.26 -5.05 118.33 112.42 1l3n n VAL 103 Ca 0.67 0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.76 1l3n n VAL 103 Cb 0.31 -0.40 0.15 0.00 -1.06 0.00 0.00 33.84 32.84 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 -1.89 2.00 -0.08 1.55 -0.00 -1.23 -5.00 121.20 116.55 1l3n s ILE 104 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 60.65 60.35 1l3n s ILE 104 Cb 0.00 -3.00 0.11 0.00 -0.00 0.00 0.00 42.46 39.58 1l3n s ILE 104 CO 0.00 0.00 0.94 -0.44 -0.00 0.00 0.00 174.94 175.44 1l3n s SER 105 N -4.75 -0.37 0.57 4.36 0.01 -1.26 -4.53 113.70 107.73 1l3n s SER 105 Ca 0.69 0.22 0.30 0.00 1.31 0.00 0.00 55.95 58.47 1l3n s SER 105 Cb -0.07 0.35 1.71 0.00 0.21 0.00 0.00 66.02 68.21 1l3n s SER 105 CO 0.51 -0.48 2.18 -0.07 0.41 0.00 0.00 173.24 175.80 1l3n h LEU 106 N 2.30 0.00 -7.83 2.44 3.38 -1.94 -3.02 115.31 110.65 1l3n h LEU 106 Ca -0.20 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.68 1l3n h LEU 106 Cb 1.20 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.81 1l3n h LEU 106 CO 0.31 0.05 -0.32 -0.44 0.09 0.00 0.00 178.44 178.13 1l3n s SER 107 N -6.07 0.06 0.00 -0.43 0.01 -1.26 -4.22 113.70 101.79 1l3n s SER 107 Ca -0.04 -0.67 0.00 0.00 1.31 0.00 0.00 55.95 56.55 1l3n s SER 107 Cb 0.14 0.38 0.00 0.00 0.21 0.00 0.00 66.02 66.75 1l3n s SER 107 CO 0.55 -0.78 0.00 0.61 0.41 0.00 0.00 173.24 174.03 1l3n n GLY 108 N -0.12 -0.20 2.06 3.44 0.00 -1.26 -4.68 105.19 104.43 1l3n n GLY 108 Ca -0.13 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.04 0.03 1.61 -0.08 -1.26 -4.92 116.55 110.89 1l3n n ASP 109 Ca 0.00 0.29 -0.17 0.00 -1.51 0.00 0.00 54.79 53.40 1l3n n ASP 109 Cb 0.00 1.19 -0.07 0.00 2.34 0.00 0.00 41.12 44.58 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 0.92 -6.54 -0.67 3.86 -1.90 -3.47 115.15 107.35 1l3n h HIS 110 Ca 0.00 -0.46 -0.51 0.00 -1.16 0.00 0.00 60.37 58.24 1l3n h HIS 110 Cb 0.00 -0.12 -0.00 0.00 1.06 0.00 0.00 27.41 28.35 1l3n h HIS 110 CO 0.00 1.29 -0.94 0.45 0.86 0.00 0.00 177.93 179.59 1l3n n SER 111 N -3.85 -3.05 0.00 2.45 2.88 -1.21 -4.76 113.62 106.08 1l3n n SER 111 Ca -0.08 -1.10 0.02 0.00 -1.33 0.00 0.00 58.87 56.37 1l3n n SER 111 Cb 0.82 -2.75 0.10 0.00 -0.75 0.00 0.00 64.21 61.62 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 -4.48 0.00 -1.72 2.46 -0.00 -1.14 -4.71 119.36 109.77 1l3n n ILE 112 Ca -0.18 0.00 -0.41 0.00 -0.00 0.00 0.00 62.75 62.16 1l3n n ILE 112 Cb 0.62 -0.48 0.01 0.00 -0.00 0.00 0.00 39.64 39.79 1l3n n ILE 112 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 1l3n n ILE 113 N -0.65 2.47 -1.17 7.28 2.08 -1.26 -3.08 119.36 125.04 1l3n n ILE 113 Ca 0.03 -0.50 -0.06 0.00 0.56 0.00 0.00 62.75 62.78 1l3n n ILE 113 Cb 0.01 -1.65 -0.03 0.00 -0.75 0.00 0.00 39.64 37.22 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 0.73 0.83 3.92 7.39 0.00 -1.25 -5.02 105.19 111.79 1l3n n GLY 114 Ca 0.06 -0.71 -0.30 0.00 0.00 0.00 0.00 46.02 45.07 1l3n n GLY 114 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1l3n s ARG 115 N -2.39 0.96 -0.13 1.61 1.70 -1.18 -1.66 118.95 117.87 1l3n s ARG 115 Ca 0.00 -0.27 -0.01 0.00 -0.47 0.00 0.00 55.73 54.98 1l3n s ARG 115 Cb 0.00 -1.87 -0.02 0.00 -0.57 0.00 0.00 34.95 32.49 1l3n s ARG 115 CO 0.00 -2.22 -0.09 0.99 -1.08 0.00 0.00 175.30 172.90 1l3n s THR 116 N -3.79 3.47 -0.10 4.99 2.01 -0.71 -2.93 115.64 118.58 1l3n s THR 116 Ca 0.71 -0.52 -0.12 0.00 0.31 0.00 0.00 61.69 62.06 1l3n s THR 116 Cb -0.06 -2.47 -0.05 0.00 0.01 0.00 0.00 72.50 69.93 1l3n s THR 116 CO 0.52 0.53 0.29 -0.76 -0.69 0.00 0.00 174.62 174.50 1l3n s LEU 117 N 0.13 4.36 -0.08 4.42 1.02 -0.04 -1.09 118.68 127.40 1l3n s LEU 117 Ca -0.04 0.64 0.04 0.00 0.02 0.00 0.00 54.13 54.79 1l3n s LEU 117 Cb -0.14 -2.36 -0.01 0.00 0.02 0.00 0.00 46.19 43.70 1l3n s LEU 117 CO 0.04 0.25 -0.22 -0.69 0.02 0.00 0.00 176.35 175.75 1l3n s VAL 118 N -0.41 2.25 -0.20 -1.59 1.01 -0.96 -0.96 120.40 119.54 1l3n s VAL 118 Ca 0.18 -0.97 -0.07 0.00 0.00 0.00 0.00 61.98 61.11 1l3n s VAL 118 Cb -0.14 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.35 1l3n s VAL 118 CO 0.07 0.56 0.07 0.54 0.00 0.00 0.00 175.10 176.34 1l3n s VAL 119 N 0.05 4.71 0.23 2.92 0.11 0.33 -2.47 120.40 126.28 1l3n s VAL 119 Ca -0.09 -0.06 0.06 0.00 -2.93 0.00 0.00 61.98 58.96 1l3n s VAL 119 Cb -0.15 -3.14 -0.03 0.00 -1.53 0.00 0.00 36.38 31.52 1l3n s VAL 119 CO 0.06 0.43 0.25 -1.00 -3.33 0.00 0.00 175.10 171.50 1l3n s HIS 120 N 0.68 3.24 0.13 1.54 3.76 -0.34 -1.92 115.29 122.38 1l3n s HIS 120 Ca 0.04 -0.06 -0.30 0.00 -0.15 0.00 0.00 55.06 54.59 1l3n s HIS 120 Cb -0.13 -1.48 -0.09 0.00 1.11 0.00 0.00 32.58 31.99 1l3n s HIS 120 CO 0.02 0.50 1.51 1.49 -0.85 0.00 0.00 174.74 177.40 1l3n h GLU 121 N 1.53 -0.23 -5.61 1.40 4.81 -0.84 -3.29 114.58 112.36 1l3n h GLU 121 Ca -0.49 0.02 -0.62 0.00 -0.13 0.00 0.00 59.36 58.13 1l3n h GLU 121 Cb 1.23 0.05 -0.10 0.00 0.63 0.00 0.00 28.75 30.56 1l3n h GLU 121 CO 0.62 -0.15 -0.47 0.15 -0.73 0.00 0.00 179.01 178.43 1l3n s LYS 122 N -5.40 2.19 0.44 1.92 1.02 0.75 -4.86 119.74 115.80 1l3n s LYS 122 Ca -0.12 -2.14 -0.21 0.00 0.02 0.00 0.00 55.97 53.52 1l3n s LYS 122 Cb 0.09 -1.80 -0.10 0.00 -0.52 0.00 0.00 37.83 35.50 1l3n s LYS 122 CO 0.57 -0.33 0.98 0.00 -0.92 0.00 0.00 175.35 175.65 1l3n s ALA 123 N -2.76 3.01 0.32 5.17 0.00 -1.18 -0.40 121.76 125.91 1l3n s ALA 123 Ca 0.25 0.47 -0.26 0.00 0.00 0.00 0.00 51.96 52.42 1l3n s ALA 123 Cb 0.02 -3.18 -0.10 0.00 0.00 0.00 0.00 23.12 19.86 1l3n s ALA 123 CO 0.14 0.01 0.96 -0.51 0.00 0.00 0.00 175.76 176.36 1l3n s ASP 124 N -2.08 7.30 0.11 0.00 1.11 -1.26 -3.78 116.67 118.07 1l3n s ASP 124 Ca 0.63 1.88 -0.04 0.00 0.18 0.00 0.00 52.55 55.19 1l3n s ASP 124 Cb -0.12 -2.58 -0.15 0.00 1.07 0.00 0.00 42.92 41.14 1l3n s ASP 124 CO 0.16 -0.09 1.25 0.44 1.18 0.00 0.00 175.17 178.11 1l3n h ASP 125 N 3.20 0.50 -4.43 0.27 3.32 -0.98 -3.48 116.42 114.81 1l3n h ASP 125 Ca -0.47 -0.44 -0.23 0.00 0.02 0.00 0.00 57.03 55.91 1l3n h ASP 125 Cb 1.19 -0.16 0.11 0.00 0.22 0.00 0.00 39.33 40.70 1l3n h ASP 125 CO 0.65 1.27 -0.51 0.18 -1.72 0.00 0.00 179.24 179.11 1l3n n LEU 126 N -3.68 -3.32 0.00 1.55 4.77 -1.26 -3.55 117.00 111.51 1l3n n LEU 126 Ca -0.07 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.50 1l3n n LEU 126 Cb 0.90 -2.26 0.00 0.00 -2.33 0.00 0.00 43.42 39.72 1l3n n LEU 126 CO 0.52 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 1l3n n GLY 127 N -1.14 2.62 0.00 -0.72 0.00 -1.03 -4.35 105.19 100.57 1l3n n GLY 127 Ca -0.17 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.00 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 0.78 0.23 1.61 5.02 -1.23 -1.07 118.16 121.50 1l3n n LYS 128 Ca 0.00 0.01 0.08 0.00 -2.02 0.00 0.00 58.31 56.38 1l3n n LYS 128 Cb 0.00 -1.50 0.54 0.00 -0.02 0.00 0.00 35.03 34.05 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 4.71 0.00 -5.90 0.72 0.00 -1.89 -3.47 103.07 97.24 1l3n h GLY 129 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 46.90 1l3n h GLY 129 CO 0.00 0.00 -0.70 0.61 0.00 0.00 0.00 176.54 176.45 1l3n n GLY 130 N -0.47 -0.52 3.46 4.60 0.00 -0.23 -4.92 105.19 107.11 1l3n n GLY 130 Ca -0.01 0.21 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 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 -3.21 3.31 0.25 1.61 0.01 -1.26 -4.97 114.94 110.68 1l3n s ASN 131 Ca 0.59 -1.09 -0.04 0.00 -0.71 0.00 0.00 52.86 51.61 1l3n s ASN 131 Cb -0.28 -0.26 0.50 0.00 0.41 0.00 0.00 41.25 41.62 1l3n s ASN 131 CO 0.73 -0.11 1.68 -0.08 -1.51 0.00 0.00 177.10 177.81 1l3n h GLU 132 N 2.27 0.26 -0.02 -0.60 4.22 -1.99 0.70 114.58 119.43 1l3n h GLU 132 Ca -0.40 -0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.02 1l3n h GLU 132 Cb 1.25 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.44 1l3n h GLU 132 CO 0.64 0.17 0.00 1.49 -2.18 0.00 0.00 179.01 179.13 1l3n h GLU 133 N 0.27 0.03 -0.70 1.92 4.57 -1.98 -3.04 114.58 115.65 1l3n h GLU 133 Ca 0.44 -0.01 0.11 0.00 -1.18 0.00 0.00 59.36 58.72 1l3n h GLU 133 Cb 0.77 -0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 29.27 1l3n h GLU 133 CO -0.53 0.26 0.29 1.03 -1.18 0.00 0.00 179.01 178.88 1l3n h SER 134 N -0.20 0.30 0.45 1.04 0.87 -1.28 0.24 113.55 114.97 1l3n h SER 134 Ca 0.01 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 1l3n h SER 134 Cb 0.24 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.26 1l3n h SER 134 CO 0.00 0.15 0.00 1.07 -0.53 0.00 0.00 176.83 177.52 1l3n n THR 135 N -4.97 0.30 0.00 2.23 5.66 -0.17 -1.43 114.28 115.91 1l3n n THR 135 Ca 0.12 0.08 0.00 0.00 -3.05 0.00 0.00 64.05 61.19 1l3n n THR 135 Cb 0.34 -0.70 0.00 0.00 -1.55 0.00 0.00 70.33 68.41 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 -1.30 0.00 -0.62 1.09 5.02 0.60 -1.51 118.16 121.44 1l3n n LYS 136 Ca 0.10 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.41 1l3n n LYS 136 Cb 0.19 0.00 0.21 0.00 -0.02 0.00 0.00 35.03 35.41 1l3n n LYS 136 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1l3n n THR 137 N -0.99 2.40 -2.21 -0.18 -2.24 0.12 -4.67 114.28 106.51 1l3n n THR 137 Ca 0.00 -2.46 -0.21 0.00 -2.27 0.00 0.00 64.05 59.12 1l3n n THR 137 Cb 0.00 -0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 67.91 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 -0.97 0.08 2.31 3.38 0.00 -0.51 -0.78 105.19 108.70 1l3n n GLY 138 Ca 0.28 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.86 -3.38 0.00 1.61 3.02 -1.26 -0.32 115.26 113.07 1l3n n ASN 139 Ca -0.24 0.24 0.06 0.00 -0.03 0.00 0.00 54.58 54.61 1l3n n ASN 139 Cb 0.69 -2.96 0.31 0.00 -0.61 0.00 0.00 39.78 37.20 1l3n n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1l3n n ALA 140 N -1.73 1.78 -0.13 5.41 0.00 0.04 -4.72 120.51 121.15 1l3n n ALA 140 Ca -0.12 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1l3n n ALA 140 Cb 0.54 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.81 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 -0.30 -1.45 3.71 0.00 0.00 -1.26 -0.18 105.19 105.71 1l3n n GLY 141 Ca 0.07 -1.29 -0.41 0.00 0.00 0.00 0.00 46.02 44.38 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 -0.09 2.67 -3.36 1.61 7.64 -1.26 -4.56 113.62 116.28 1l3n n SER 142 Ca 0.00 1.12 -0.30 0.00 1.01 0.00 0.00 58.87 60.70 1l3n n SER 142 Cb 0.00 -1.51 -0.04 0.00 -1.01 0.00 0.00 64.21 61.65 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 0.09 1.47 -0.43 1.43 1.74 -1.26 -0.48 116.66 119.22 1l3n n ARG 143 Ca 0.06 -1.48 0.35 0.00 -0.77 0.00 0.00 57.85 56.02 1l3n n ARG 143 Cb 0.39 -2.59 0.64 0.00 -1.02 0.00 0.00 32.46 29.88 1l3n n ARG 143 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1l3n h LEU 144 N 11.43 0.25 -7.00 0.55 5.85 -1.83 -3.42 115.31 121.14 1l3n h LEU 144 Ca 0.39 0.10 0.02 0.00 0.84 0.00 0.00 57.88 59.24 1l3n h LEU 144 Cb 0.39 0.08 -0.14 0.00 0.37 0.00 0.00 40.66 41.36 1l3n h LEU 144 CO 1.65 -0.10 0.31 0.00 -0.34 0.00 0.00 178.44 179.96 1l3n s ALA 145 N -5.28 -1.69 0.22 1.25 0.00 -0.81 -3.46 121.76 111.99 1l3n s ALA 145 Ca -0.07 0.74 -0.23 0.00 0.00 0.00 0.00 51.96 52.40 1l3n s ALA 145 Cb 0.28 0.64 0.04 0.00 0.00 0.00 0.00 23.12 24.08 1l3n s ALA 145 CO 0.82 -0.70 0.78 0.00 0.00 0.00 0.00 175.76 176.65 1l3n s GLY 147 N -2.88 -0.33 -0.09 0.00 0.00 -0.13 -0.81 107.32 103.07 1l3n s GLY 147 Ca 0.10 0.45 -0.02 0.00 0.00 0.00 0.00 44.72 45.25 1l3n s GLY 147 CO 0.02 0.07 -0.01 0.14 0.00 0.00 0.00 173.10 173.33 1l3n s VAL 148 N -2.82 4.24 0.16 1.40 1.01 -1.26 -0.86 120.40 122.27 1l3n s VAL 148 Ca 0.13 -0.27 -0.30 0.00 0.00 0.00 0.00 61.98 61.55 1l3n s VAL 148 Cb 0.02 -2.79 -0.07 0.00 0.00 0.00 0.00 36.38 33.54 1l3n s VAL 148 CO -0.01 0.59 0.95 -0.63 0.00 0.00 0.00 175.10 176.00 1l3n s ILE 149 N -0.73 4.35 0.05 2.22 1.01 -1.15 -4.31 121.20 122.64 1l3n s ILE 149 Ca 0.11 2.07 0.06 0.00 0.00 0.00 0.00 60.65 62.89 1l3n s ILE 149 Cb -0.12 -4.32 -0.02 0.00 0.01 0.00 0.00 42.46 38.01 1l3n s ILE 149 CO 0.02 0.38 -0.16 -0.83 0.00 0.00 0.00 174.94 174.36 1l3n s GLY 150 N -0.43 0.89 0.35 6.18 0.00 0.11 -3.74 107.32 110.67 1l3n s GLY 150 Ca 0.45 -0.93 -0.27 0.00 0.00 0.00 0.00 44.72 43.96 1l3n s GLY 150 CO 0.30 -0.92 1.16 -0.26 0.00 0.00 0.00 173.10 173.39 1l3n s ILE 151 N -0.97 3.23 -0.00 0.90 -4.36 -1.26 -0.37 121.20 118.37 1l3n s ILE 151 Ca 0.02 1.13 0.01 0.00 -0.26 0.00 0.00 60.65 61.54 1l3n s ILE 151 Cb -0.09 -3.68 -0.01 0.00 1.25 0.00 0.00 42.46 39.94 1l3n s ILE 151 CO 0.02 0.19 0.01 0.00 0.24 0.00 0.00 174.94 175.40 1l3n n ALA 152 N 0.58 2.02 0.00 2.27 0.00 -0.15 -4.77 120.51 120.47 1l3n n ALA 152 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1l3n n ALA 152 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.88 1l3n n ALA 152 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44