#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 -3.41 0.00 1.03 -1.81 -3.15 112.91 105.57 1l3n h THR 2 Ca 0.00 -0.65 -0.36 0.00 -0.01 0.00 0.00 66.41 65.40 1l3n h THR 2 Cb 0.00 1.32 -0.14 0.00 -1.07 0.00 0.00 68.15 68.26 1l3n h THR 2 CO 0.00 0.00 -0.67 -0.75 -0.01 0.00 0.00 175.52 174.09 1l3n s LYS 3 N -3.20 1.26 0.30 0.00 2.20 -1.18 -0.33 119.74 118.79 1l3n s LYS 3 Ca 0.06 -1.62 -0.18 0.00 -0.36 0.00 0.00 55.97 53.87 1l3n s LYS 3 Cb 0.11 -0.55 0.02 0.00 -1.51 0.00 0.00 37.83 35.90 1l3n s LYS 3 CO 0.71 -0.08 0.68 0.00 -0.36 0.00 0.00 175.35 176.30 1l3n s ALA 4 N -3.45 -0.87 0.33 3.13 0.00 0.31 -2.60 121.76 118.60 1l3n s ALA 4 Ca 0.26 -0.54 0.03 0.00 0.00 0.00 0.00 51.96 51.71 1l3n s ALA 4 Cb 0.05 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 24.00 1l3n s ALA 4 CO 0.07 -0.99 0.13 0.14 0.00 0.00 0.00 175.76 175.11 1l3n s VAL 5 N -3.60 0.56 -0.18 0.00 -7.23 0.46 -0.43 120.40 109.97 1l3n s VAL 5 Ca 0.15 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.28 1l3n s VAL 5 Cb -0.05 -2.54 0.09 0.00 0.56 0.00 0.00 36.38 34.45 1l3n s VAL 5 CO 0.09 0.00 0.25 0.00 -0.31 0.00 0.00 175.10 175.13 1l3n s ALA 6 N -3.49 -0.47 -0.26 1.32 0.00 0.38 -2.90 121.76 116.34 1l3n s ALA 6 Ca 0.33 0.55 -0.18 0.00 0.00 0.00 0.00 51.96 52.67 1l3n s ALA 6 Cb 0.05 -1.27 -0.03 0.00 0.00 0.00 0.00 23.12 21.88 1l3n s ALA 6 CO 0.16 -1.03 0.50 0.14 0.00 0.00 0.00 175.76 175.53 1l3n s VAL 7 N 2.38 5.08 -0.19 0.00 -7.23 -1.26 -1.09 120.40 118.10 1l3n s VAL 7 Ca 0.06 0.86 -0.09 0.00 -1.81 0.00 0.00 61.98 60.99 1l3n s VAL 7 Cb -0.14 -3.82 -0.05 0.00 0.56 0.00 0.00 36.38 32.93 1l3n s VAL 7 CO -0.11 0.10 0.13 -0.76 -0.31 0.00 0.00 175.10 174.14 1l3n s LEU 8 N 2.24 4.23 0.05 1.32 2.01 0.21 -4.08 118.68 124.65 1l3n s LEU 8 Ca 0.21 0.27 -0.03 0.00 0.01 0.00 0.00 54.13 54.58 1l3n s LEU 8 Cb -0.16 -2.08 -0.03 0.00 0.01 0.00 0.00 46.19 43.93 1l3n s LEU 8 CO 0.09 0.22 0.03 -0.54 1.01 0.00 0.00 176.35 177.16 1l3n s LYS 9 N 0.12 0.63 0.12 1.70 1.02 -0.50 -0.29 119.74 122.54 1l3n s LYS 9 Ca 0.09 -1.07 0.00 0.00 0.02 0.00 0.00 55.97 55.01 1l3n s LYS 9 Cb -0.11 0.23 0.00 0.00 -0.52 0.00 0.00 37.83 37.43 1l3n s LYS 9 CO -0.01 -0.14 0.00 0.41 -0.92 0.00 0.00 175.35 174.69 1l3n n GLY 10 N 0.25 -1.77 0.21 -3.33 0.00 -1.23 -0.80 105.19 98.53 1l3n n GLY 10 Ca -0.15 0.56 -0.16 0.00 0.00 0.00 0.00 46.02 46.26 1l3n n GLY 10 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1l3n h ASP 11 N 0.00 0.83 0.00 1.61 3.58 -0.95 -3.49 116.42 118.01 1l3n h ASP 11 Ca 0.00 -0.60 0.00 0.00 0.42 0.00 0.00 57.03 56.85 1l3n h ASP 11 Cb 0.00 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 40.81 1l3n h ASP 11 CO 0.00 1.29 0.00 0.61 -2.88 0.00 0.00 179.24 178.26 1l3n n GLY 12 N 0.59 1.66 0.37 -0.78 0.00 -1.26 -4.94 105.19 100.83 1l3n n GLY 12 Ca -0.07 -0.23 0.02 0.00 0.00 0.00 0.00 46.02 45.74 1l3n n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1l3n h PRO 13 N 0.00 1.13 -6.26 1.61 0.13 -1.94 -3.40 132.00 123.28 1l3n h PRO 13 Ca 0.00 -0.07 -0.55 0.00 -0.87 0.00 0.00 66.00 64.51 1l3n h PRO 13 Cb 0.00 -0.26 -0.01 0.00 0.13 0.00 0.00 31.00 30.86 1l3n h PRO 13 CO 0.00 0.75 1.11 0.54 -0.23 0.00 0.00 178.00 180.17 1l3n s VAL 14 N -6.01 3.58 -0.29 1.56 0.11 -1.15 -4.21 120.40 113.99 1l3n s VAL 14 Ca -0.12 0.70 0.02 0.00 -2.93 0.00 0.00 61.98 59.64 1l3n s VAL 14 Cb 0.20 -3.48 0.08 0.00 -1.53 0.00 0.00 36.38 31.65 1l3n s VAL 14 CO 0.81 -0.10 0.01 0.00 -3.33 0.00 0.00 175.10 172.50 1l3n s GLN 15 N 4.21 1.41 0.17 1.54 -2.07 0.20 -4.16 119.66 120.96 1l3n s GLN 15 Ca 0.74 -1.36 -0.21 0.00 -1.82 0.00 0.00 55.36 52.71 1l3n s GLN 15 Cb -0.32 -2.70 -0.08 0.00 -1.09 0.00 0.00 33.01 28.83 1l3n s GLN 15 CO 0.30 -0.81 0.70 0.20 -1.32 0.00 0.00 175.29 174.35 1l3n s GLY 16 N 1.24 2.71 -0.34 2.60 0.00 0.60 -1.92 107.32 112.22 1l3n s GLY 16 Ca 0.04 0.18 -0.01 0.00 0.00 0.00 0.00 44.72 44.93 1l3n s GLY 16 CO -0.11 0.59 0.21 -0.42 0.00 0.00 0.00 173.10 173.36 1l3n s ILE 17 N -1.32 0.04 -0.11 0.90 1.01 -1.25 -0.62 121.20 119.84 1l3n s ILE 17 Ca 0.38 -1.41 -0.06 0.00 0.00 0.00 0.00 60.65 59.56 1l3n s ILE 17 Cb -0.19 -1.05 -0.04 0.00 0.01 0.00 0.00 42.46 41.19 1l3n s ILE 17 CO 0.22 -0.89 0.10 -0.63 0.00 0.00 0.00 174.94 173.74 1l3n s ILE 18 N 1.36 5.14 -0.23 2.92 -1.09 -0.25 -1.21 121.20 127.84 1l3n s ILE 18 Ca 0.16 0.07 -0.04 0.00 -2.23 0.00 0.00 60.65 58.61 1l3n s ILE 18 Cb -0.21 -3.23 -0.00 0.00 -1.58 0.00 0.00 42.46 37.45 1l3n s ILE 18 CO -0.09 0.61 -0.04 0.20 -1.23 0.00 0.00 174.94 174.39 1l3n s ASN 19 N -0.90 4.33 -0.34 3.58 0.01 0.62 -0.47 114.94 121.76 1l3n s ASN 19 Ca 0.14 -0.50 -0.13 0.00 -0.71 0.00 0.00 52.86 51.66 1l3n s ASN 19 Cb -0.12 -1.73 -0.02 0.00 0.41 0.00 0.00 41.25 39.79 1l3n s ASN 19 CO 0.03 -0.05 0.25 -0.36 -1.51 0.00 0.00 177.10 175.46 1l3n s PHE 20 N 1.45 3.23 -0.14 2.20 0.40 0.43 -1.58 117.98 123.98 1l3n s PHE 20 Ca 0.05 -0.20 0.01 0.00 -0.60 0.00 0.00 56.93 56.19 1l3n s PHE 20 Cb -0.15 -2.48 -0.00 0.00 0.51 0.00 0.00 43.02 40.90 1l3n s PHE 20 CO -0.03 -0.36 -0.17 -2.00 0.70 0.00 0.00 175.22 173.36 1l3n s GLU 21 N 1.73 3.21 -1.07 0.44 2.12 -0.48 -0.53 118.70 124.13 1l3n s GLU 21 Ca 0.06 -0.77 -0.22 0.00 0.36 0.00 0.00 54.97 54.40 1l3n s GLU 21 Cb -0.17 -2.55 0.05 0.00 0.26 0.00 0.00 34.13 31.72 1l3n s GLU 21 CO 0.11 0.09 1.51 -1.14 -0.54 0.00 0.00 175.26 175.29 1l3n s GLN 22 N 0.62 3.64 0.32 4.30 0.74 0.56 -1.16 119.66 128.68 1l3n s GLN 22 Ca -0.09 -1.27 0.10 0.00 0.05 0.00 0.00 55.36 54.15 1l3n s GLN 22 Cb -0.16 -5.39 0.92 0.00 1.10 0.00 0.00 33.01 29.48 1l3n s GLN 22 CO 0.03 -2.24 1.70 1.57 -0.55 0.00 0.00 175.29 175.80 1l3n h LYS 23 N 9.42 0.45 -5.17 1.67 5.09 -1.83 -3.35 116.57 122.85 1l3n h LYS 23 Ca 0.24 -0.03 -0.37 0.00 0.09 0.00 0.00 60.65 60.58 1l3n h LYS 23 Cb 0.98 -0.10 -0.14 0.00 0.10 0.00 0.00 32.23 33.07 1l3n h LYS 23 CO 1.43 0.30 -0.69 -2.00 -2.09 0.00 0.00 179.45 176.40 1l3n s GLU 24 N -5.76 1.23 0.44 0.07 -6.30 -1.26 -4.95 118.70 102.16 1l3n s GLU 24 Ca -0.11 -1.57 0.16 0.00 -2.50 0.00 0.00 54.97 50.95 1l3n s GLU 24 Cb 0.28 -0.72 1.08 0.00 0.00 0.00 0.00 34.13 34.77 1l3n s GLU 24 CO 0.79 0.02 1.97 1.03 0.02 0.00 0.00 175.26 179.09 1l3n h SER 25 N 2.61 0.33 -0.02 -1.70 0.87 -1.98 -0.74 113.55 112.92 1l3n h SER 25 Ca -0.38 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 1l3n h SER 25 Cb 1.21 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1l3n h SER 25 CO 0.64 0.19 -0.21 0.59 -0.53 0.00 0.00 176.83 177.51 1l3n n ASN 26 N -4.46 2.49 -4.96 6.23 3.02 -1.26 -4.98 115.26 111.33 1l3n n ASN 26 Ca 0.11 -1.75 -0.22 0.00 -0.03 0.00 0.00 54.58 52.69 1l3n n ASN 26 Cb 0.43 0.21 0.01 0.00 -0.61 0.00 0.00 39.78 39.82 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 -2.22 1.58 0.62 7.41 0.00 -0.29 -5.07 107.32 109.35 1l3n s GLY 27 Ca 0.24 -1.18 -0.19 0.00 0.00 0.00 0.00 44.72 43.59 1l3n s GLY 27 CO 0.42 -1.03 1.27 2.56 0.00 0.00 0.00 173.10 176.32 1l3n s PRO 28 N -4.44 2.76 -0.20 2.90 0.04 -1.26 -4.65 135.00 130.14 1l3n s PRO 28 Ca 0.47 2.01 -0.24 0.00 0.04 0.00 0.00 61.00 63.29 1l3n s PRO 28 Cb -0.10 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.50 1l3n s PRO 28 CO 0.36 -1.42 0.76 0.08 0.04 0.00 0.00 177.00 176.82 1l3n s VAL 29 N -1.44 4.92 -0.37 -0.36 1.01 0.41 -3.71 120.40 120.85 1l3n s VAL 29 Ca 0.80 1.47 -0.21 0.00 0.00 0.00 0.00 61.98 64.04 1l3n s VAL 29 Cb -0.36 -4.07 0.01 0.00 0.00 0.00 0.00 36.38 31.96 1l3n s VAL 29 CO 0.38 0.03 0.67 -0.75 0.00 0.00 0.00 175.10 175.43 1l3n s LYS 30 N 2.24 3.64 -1.04 2.72 2.20 -0.31 -1.47 119.74 127.73 1l3n s LYS 30 Ca 0.34 0.05 -0.02 0.00 -0.36 0.00 0.00 55.97 55.98 1l3n s LYS 30 Cb -0.16 -3.83 0.29 0.00 -1.51 0.00 0.00 37.83 32.62 1l3n s LYS 30 CO 0.11 -0.80 1.96 1.33 -0.36 0.00 0.00 175.35 177.59 1l3n n VAL 31 N 5.67 5.64 -1.87 4.02 0.24 0.45 -1.38 118.33 131.09 1l3n n VAL 31 Ca -0.00 -5.47 -0.31 0.00 -2.04 0.00 0.00 64.34 56.51 1l3n n VAL 31 Cb 0.48 -1.59 0.02 0.00 -1.47 0.00 0.00 33.84 31.28 1l3n n VAL 31 CO 0.00 0.00 0.00 -1.66 -2.14 0.00 0.00 176.83 173.03 1l3n s TRP 32 N -3.78 3.31 0.00 6.34 -2.14 -0.61 -4.26 118.94 117.80 1l3n s TRP 32 Ca 0.43 1.40 0.00 0.00 2.66 0.00 0.00 56.10 60.59 1l3n s TRP 32 Cb 0.22 -2.83 0.00 0.00 -3.10 0.00 0.00 33.47 27.76 1l3n s TRP 32 CO -0.16 -0.90 0.00 0.41 -2.66 0.00 0.00 176.95 173.63 1l3n n GLY 33 N -2.02 -1.05 2.85 3.67 0.00 0.50 -0.28 105.19 108.87 1l3n n GLY 33 Ca 0.07 -1.04 -0.12 0.00 0.00 0.00 0.00 46.02 44.93 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 0.00 0.76 0.55 1.61 0.01 -0.35 -1.01 113.70 115.28 1l3n s SER 34 Ca 0.00 -0.86 -0.16 0.00 1.31 0.00 0.00 55.95 56.24 1l3n s SER 34 Cb 0.00 0.87 -0.06 0.00 0.21 0.00 0.00 66.02 67.04 1l3n s SER 34 CO 0.00 -0.32 1.02 0.27 0.41 0.00 0.00 173.24 174.62 1l3n s ILE 35 N 2.12 4.24 0.02 1.44 -4.36 -0.44 -3.81 121.20 120.42 1l3n s ILE 35 Ca 0.12 1.06 0.01 0.00 -0.26 0.00 0.00 60.65 61.58 1l3n s ILE 35 Cb -0.13 -3.59 -0.02 0.00 1.25 0.00 0.00 42.46 39.98 1l3n s ILE 35 CO -0.21 -0.63 -0.04 -1.59 0.24 0.00 0.00 174.94 172.71 1l3n s LYS 36 N -4.11 0.30 0.00 0.37 -2.85 -0.81 -0.88 119.74 111.76 1l3n s LYS 36 Ca 0.61 -0.47 0.00 0.00 -1.00 0.00 0.00 55.97 55.10 1l3n s LYS 36 Cb -0.12 -0.04 0.00 0.00 -2.06 0.00 0.00 37.83 35.60 1l3n s LYS 36 CO 0.34 -0.00 0.00 0.41 0.10 0.00 0.00 175.35 176.20 1l3n n GLY 37 N 2.01 0.61 3.67 0.59 0.00 -1.10 -0.63 105.19 110.34 1l3n n GLY 37 Ca -0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 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 1.13 0.77 0.99 1.02 -1.21 -2.95 118.68 118.42 1l3n s LEU 38 Ca 0.00 0.47 -0.05 0.00 0.02 0.00 0.00 54.13 54.58 1l3n s LEU 38 Cb 0.00 -2.23 0.13 0.00 0.02 0.00 0.00 46.19 44.11 1l3n s LEU 38 CO 0.00 -3.89 1.06 0.28 0.02 0.00 0.00 176.35 173.82 1l3n s THR 39 N -3.24 2.15 1.12 5.49 -1.32 -1.26 -3.35 115.64 115.23 1l3n s THR 39 Ca 0.73 -0.42 -0.13 0.00 -1.21 0.00 0.00 61.69 60.66 1l3n s THR 39 Cb -0.07 -2.73 0.26 0.00 -1.51 0.00 0.00 72.50 68.45 1l3n s THR 39 CO 0.55 0.00 1.05 -0.70 -2.21 0.00 0.00 174.62 173.31 1l3n s GLU 40 N -5.31 -0.57 0.24 7.08 2.12 -1.26 -4.52 118.70 116.48 1l3n s GLU 40 Ca 0.67 0.71 0.00 0.00 0.36 0.00 0.00 54.97 56.71 1l3n s GLU 40 Cb -0.06 -1.60 0.00 0.00 0.26 0.00 0.00 34.13 32.73 1l3n s GLU 40 CO 0.46 -3.45 0.00 0.41 -0.54 0.00 0.00 175.26 172.14 1l3n n GLY 41 N 0.19 -2.60 3.74 -1.50 0.00 -0.19 -4.82 105.19 100.00 1l3n n GLY 41 Ca 0.03 -1.68 -0.36 0.00 0.00 0.00 0.00 46.02 44.01 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 3.55 0.03 0.99 2.01 -1.26 -0.48 118.68 123.52 1l3n s LEU 42 Ca 0.00 2.49 -0.04 0.00 0.01 0.00 0.00 54.13 56.59 1l3n s LEU 42 Cb 0.00 -4.61 -0.01 0.00 0.01 0.00 0.00 46.19 41.58 1l3n s LEU 42 CO 0.00 -1.92 0.06 -1.00 1.01 0.00 0.00 176.35 174.50 1l3n s HIS 43 N -1.58 0.22 -0.24 0.29 3.76 0.84 -3.77 115.29 114.81 1l3n s HIS 43 Ca 0.79 -0.50 -0.42 0.00 -0.15 0.00 0.00 55.06 54.77 1l3n s HIS 43 Cb -0.33 -0.16 -0.20 0.00 1.11 0.00 0.00 32.58 33.00 1l3n s HIS 43 CO 0.39 -0.31 1.30 0.41 -0.85 0.00 0.00 174.74 175.68 1l3n n GLY 44 N 1.01 -0.04 2.86 -2.22 0.00 0.12 -1.35 105.19 105.56 1l3n n GLY 44 Ca -0.20 0.86 -0.12 0.00 0.00 0.00 0.00 46.02 46.56 1l3n n GLY 44 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1l3n s PHE 45 N 1.46 -0.71 0.38 1.61 2.19 -1.26 -1.69 117.98 119.96 1l3n s PHE 45 Ca 0.96 0.43 -0.07 0.00 0.33 0.00 0.00 56.93 58.58 1l3n s PHE 45 Cb -1.35 -0.17 0.03 0.00 -1.31 0.00 0.00 43.02 40.21 1l3n s PHE 45 CO 0.68 -0.80 0.62 0.72 1.83 0.00 0.00 175.22 178.27 1l3n n HIS 46 N 5.34 -1.84 -4.00 10.12 -0.00 -0.77 -1.51 115.22 122.57 1l3n n HIS 46 Ca -0.03 -2.23 -0.29 0.00 -0.00 0.00 0.00 57.72 55.18 1l3n n HIS 46 Cb 0.49 0.72 -0.05 0.00 -0.00 0.00 0.00 29.99 31.15 1l3n n HIS 46 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.34 176.48 1l3n s VAL 47 N -2.54 4.93 -0.04 1.59 -7.23 -1.25 -0.72 120.40 115.14 1l3n s VAL 47 Ca 0.25 -0.68 0.02 0.00 -1.81 0.00 0.00 61.98 59.76 1l3n s VAL 47 Cb -0.03 -3.43 0.01 0.00 0.56 0.00 0.00 36.38 33.49 1l3n s VAL 47 CO 0.18 0.06 -0.10 -1.00 -0.31 0.00 0.00 175.10 173.93 1l3n s HIS 48 N -1.54 1.15 0.05 2.82 3.76 0.11 -4.44 115.29 117.20 1l3n s HIS 48 Ca 0.32 -0.34 -0.29 0.00 -0.15 0.00 0.00 55.06 54.60 1l3n s HIS 48 Cb -0.12 -0.84 -0.18 0.00 1.11 0.00 0.00 32.58 32.56 1l3n s HIS 48 CO 0.25 -0.17 1.48 1.49 -0.85 0.00 0.00 174.74 176.95 1l3n h GLU 49 N 6.63 -0.67 -6.92 1.40 4.57 -1.58 -2.16 114.58 115.85 1l3n h GLU 49 Ca -0.33 0.05 -0.48 0.00 -1.18 0.00 0.00 59.36 57.42 1l3n h GLU 49 Cb 1.17 0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 29.91 1l3n h GLU 49 CO 0.48 -0.40 0.38 -0.06 -1.18 0.00 0.00 179.01 178.23 1l3n s PHE 50 N -5.56 3.50 -0.28 0.92 0.08 0.80 -4.53 117.98 112.91 1l3n s PHE 50 Ca -0.16 1.71 0.13 0.00 0.12 0.00 0.00 56.93 58.73 1l3n s PHE 50 Cb 0.03 -3.03 0.79 0.00 -0.57 0.00 0.00 43.02 40.24 1l3n s PHE 50 CO 0.58 -0.20 1.73 0.41 -0.10 0.00 0.00 175.22 177.65 1l3n n GLY 51 N 0.46 3.07 2.80 4.36 0.00 -1.24 -3.57 105.19 111.08 1l3n n GLY 51 Ca 0.03 -0.91 -0.42 0.00 0.00 0.00 0.00 46.02 44.72 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 0.47 4.03 0.10 1.61 5.75 -1.26 -4.68 116.55 122.57 1l3n n ASP 52 Ca 0.30 -2.86 0.10 0.00 -0.01 0.00 0.00 54.79 52.32 1l3n n ASP 52 Cb 1.22 -1.65 0.45 0.00 -1.03 0.00 0.00 41.12 40.10 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 6.11 0.50 -0.15 -1.12 2.85 -1.26 -3.65 115.26 118.53 1l3n n ASN 53 Ca 0.51 0.63 0.00 0.00 -0.11 0.00 0.00 54.58 55.61 1l3n n ASN 53 Cb 0.39 -0.73 0.03 0.00 1.24 0.00 0.00 39.78 40.71 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 -2.06 -0.19 0.57 -0.44 -1.04 -1.26 -0.01 114.28 109.85 1l3n n THR 54 Ca 0.02 0.90 0.13 0.00 -2.04 0.00 0.00 64.05 63.06 1l3n n THR 54 Cb 0.20 -1.20 0.43 0.00 -1.82 0.00 0.00 70.33 67.94 1l3n n THR 54 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1l3n n ALA 55 N -3.81 2.13 0.00 2.41 0.00 -1.26 -4.84 120.51 115.14 1l3n n ALA 55 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1l3n n ALA 55 Cb 0.16 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.16 1l3n n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l3n n GLY 56 N 0.99 0.69 3.99 0.00 0.00 0.99 -4.84 105.19 107.01 1l3n n GLY 56 Ca 0.05 -0.24 -0.27 0.00 0.00 0.00 0.00 46.02 45.55 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 -4.43 1.19 -0.34 0.00 -2.24 -1.26 -4.64 114.28 102.55 1l3n n THR 58 Ca -0.30 0.20 0.31 0.00 -2.27 0.00 0.00 64.05 61.99 1l3n n THR 58 Cb 0.68 -1.85 0.65 0.00 -2.10 0.00 0.00 70.33 67.71 1l3n n THR 58 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1l3n h SER 59 N -0.41 0.20 -0.42 3.42 0.02 -1.89 -1.77 113.55 112.70 1l3n h SER 59 Ca -0.06 0.05 0.17 0.00 -0.84 0.00 0.00 61.79 61.11 1l3n h SER 59 Cb 0.59 0.02 -0.07 0.00 0.14 0.00 0.00 62.40 63.08 1l3n h SER 59 CO -0.04 0.02 0.23 0.00 -1.14 0.00 0.00 176.83 175.90 1l3n n ALA 60 N -2.63 0.43 0.00 3.77 0.00 -1.24 -4.80 120.51 116.04 1l3n n ALA 60 Ca 0.27 0.41 0.00 0.00 0.00 0.00 0.00 53.44 54.12 1l3n n ALA 60 Cb 1.14 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 20.17 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 2.48 0.09 0.00 0.00 -0.67 -0.14 105.19 105.84 1l3n n GLY 61 Ca 0.15 -1.92 -0.01 0.00 0.00 0.00 0.00 46.02 44.25 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 1.29 -0.98 -1.12 1.61 -0.04 -1.26 -4.50 135.00 130.00 1l3n n PRO 62 Ca 0.00 -0.05 -0.26 0.00 -0.04 0.00 0.00 63.50 63.15 1l3n n PRO 62 Cb 0.00 -0.04 -0.08 0.00 -0.04 0.00 0.00 33.50 33.34 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 -2.52 1.35 -1.17 0.54 8.25 -1.23 -3.46 115.22 116.99 1l3n n HIS 63 Ca 0.00 -2.33 -0.35 0.00 -0.26 0.00 0.00 57.72 54.78 1l3n n HIS 63 Cb 0.02 -2.04 -0.03 0.00 1.12 0.00 0.00 29.99 29.06 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 3.20 2.17 -1.16 4.41 3.72 -1.26 -4.90 117.46 123.65 1l3n n PHE 64 Ca 0.61 -2.39 -0.34 0.00 -0.05 0.00 0.00 57.45 55.27 1l3n n PHE 64 Cb 0.48 -2.05 0.11 0.00 -0.94 0.00 0.00 39.48 37.08 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 5.24 0.42 -0.15 4.37 6.94 -1.26 -4.72 115.26 126.10 1l3n n ASN 65 Ca 0.55 0.58 -0.07 0.00 -0.02 0.00 0.00 54.58 55.63 1l3n n ASN 65 Cb 0.27 -1.43 0.02 0.00 -2.36 0.00 0.00 39.78 36.28 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 -0.75 0.53 -3.70 -0.53 0.13 -1.93 -3.02 132.00 122.73 1l3n h PRO 66 Ca -0.46 -0.03 -0.61 0.00 -0.87 0.00 0.00 66.00 64.03 1l3n h PRO 66 Cb 1.31 -0.12 0.01 0.00 0.13 0.00 0.00 31.00 32.33 1l3n h PRO 66 CO 0.45 0.35 3.03 1.28 -0.23 0.00 0.00 178.00 182.88 1l3n n LEU 67 N -4.82 6.33 -4.46 1.56 4.32 -1.26 -4.93 117.00 113.74 1l3n n LEU 67 Ca 0.02 -3.64 -0.61 0.00 -0.02 0.00 0.00 56.01 51.77 1l3n n LEU 67 Cb 0.06 -1.38 -0.10 0.00 -1.62 0.00 0.00 43.42 40.38 1l3n n LEU 67 CO 0.33 0.94 1.54 -1.54 -1.22 0.00 0.00 177.39 177.44 1l3n n SER 68 N 5.26 1.20 -2.60 -1.43 3.41 -1.14 -4.87 113.62 113.43 1l3n n SER 68 Ca 0.57 0.83 -0.13 0.00 -0.26 0.00 0.00 58.87 59.88 1l3n n SER 68 Cb 0.29 -0.96 -0.04 0.00 -0.26 0.00 0.00 64.21 63.24 1l3n n SER 68 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1l3n n ARG 69 N 6.40 0.48 -2.12 4.33 1.74 -1.26 -5.12 116.66 121.11 1l3n n ARG 69 Ca 0.44 -2.30 -0.33 0.00 -0.77 0.00 0.00 57.85 54.89 1l3n n ARG 69 Cb 0.00 2.10 0.00 0.00 -1.02 0.00 0.00 32.46 33.55 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 -2.75 3.43 -0.47 5.56 -0.14 -1.11 -4.87 119.74 119.39 1l3n s LYS 70 Ca 0.25 1.18 -0.28 0.00 -1.36 0.00 0.00 55.97 55.77 1l3n s LYS 70 Cb -0.00 -2.05 -0.01 0.00 -1.68 0.00 0.00 37.83 34.09 1l3n s LYS 70 CO 0.18 -0.72 1.77 -1.58 -0.76 0.00 0.00 175.35 174.24 1l3n s HIS 71 N -2.44 1.83 0.00 3.18 5.65 0.28 -3.42 115.29 120.37 1l3n s HIS 71 Ca 0.63 0.70 0.00 0.00 0.25 0.00 0.00 55.06 56.64 1l3n s HIS 71 Cb -0.15 -4.14 0.00 0.00 -1.18 0.00 0.00 32.58 27.10 1l3n s HIS 71 CO 0.35 -2.52 0.00 0.41 -0.65 0.00 0.00 174.74 172.33 1l3n n GLY 72 N 5.50 4.65 0.00 1.59 0.00 -1.25 -2.01 105.19 113.66 1l3n n GLY 72 Ca 0.21 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.59 1l3n n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l3n n GLY 73 N 5.00 0.85 0.20 -0.02 0.00 -1.26 -4.64 105.19 105.32 1l3n n GLY 73 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 0.37 0.00 1.61 -0.04 -1.26 -0.82 135.00 134.86 1l3n n PRO 74 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1l3n n PRO 74 Cb 0.00 -1.07 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 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 -0.18 0.24 -4.32 0.54 5.02 -1.26 -5.03 118.16 113.17 1l3n n LYS 75 Ca 0.00 -0.78 -0.18 0.00 -2.02 0.00 0.00 58.31 55.33 1l3n n LYS 75 Cb 0.04 -0.97 -0.10 0.00 -0.02 0.00 0.00 35.03 33.97 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 -0.30 2.45 0.11 4.39 -1.08 0.00 -5.02 116.67 117.23 1l3n s ASP 76 Ca 0.00 -0.99 0.01 0.00 -0.52 0.00 0.00 52.55 51.06 1l3n s ASP 76 Cb 0.00 -0.12 -0.21 0.00 -1.46 0.00 0.00 42.92 41.13 1l3n s ASP 76 CO 0.00 -0.17 1.24 1.05 0.52 0.00 0.00 175.17 177.80 1l3n h GLU 77 N 2.73 0.14 -0.99 4.34 -0.00 -1.96 -3.38 114.58 115.46 1l3n h GLU 77 Ca -0.38 -0.23 -0.06 0.00 -0.00 0.00 0.00 59.36 58.68 1l3n h GLU 77 Cb 1.21 0.08 -0.04 0.00 -0.00 0.00 0.00 28.75 30.01 1l3n h GLU 77 CO 0.60 1.09 0.08 0.39 -0.00 0.00 0.00 179.01 181.17 1l3n n GLU 78 N -3.47 1.24 -0.86 1.06 1.02 -1.26 -4.91 120.64 113.45 1l3n n GLU 78 Ca -0.04 -0.44 -0.30 0.00 -0.02 0.00 0.00 57.16 56.36 1l3n n GLU 78 Cb 0.96 -1.24 0.17 0.00 -0.02 0.00 0.00 31.44 31.31 1l3n n GLU 78 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1l3n s ARG 79 N -0.60 0.67 -0.02 3.49 1.04 -1.26 -2.73 118.95 119.55 1l3n s ARG 79 Ca 0.08 1.10 -0.01 0.00 -1.04 0.00 0.00 55.73 55.86 1l3n s ARG 79 Cb 0.07 -1.72 -0.00 0.00 -2.04 0.00 0.00 34.95 31.25 1l3n s ARG 79 CO 0.02 -2.72 0.08 0.45 -0.04 0.00 0.00 175.30 173.09 1l3n h HIS 80 N -1.91 -0.02 0.00 5.89 3.86 -1.86 -3.44 115.15 117.66 1l3n h HIS 80 Ca -0.50 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.71 1l3n h HIS 80 Cb 1.29 0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.76 1l3n h HIS 80 CO 0.42 -0.01 0.00 1.33 0.86 0.00 0.00 177.93 180.53 1l3n n VAL 81 N -2.69 0.00 -1.05 2.45 0.24 -1.26 -4.86 118.33 111.16 1l3n n VAL 81 Ca -0.00 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 62.07 1l3n n VAL 81 Cb 0.01 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.28 1l3n n VAL 81 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1l3n n GLY 82 N 0.00 3.40 3.56 7.63 0.00 -1.26 -4.80 105.19 113.72 1l3n n GLY 82 Ca 0.00 -1.23 -0.40 0.00 0.00 0.00 0.00 46.02 44.38 1l3n n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1l3n s ASP 83 N 2.23 6.36 0.50 1.61 1.01 -1.26 -3.85 116.67 123.27 1l3n s ASP 83 Ca 0.63 -1.18 0.29 0.00 0.71 0.00 0.00 52.55 53.00 1l3n s ASP 83 Cb 0.23 -2.57 1.10 0.00 1.01 0.00 0.00 42.92 42.70 1l3n s ASP 83 CO -0.03 -1.64 1.89 -0.07 0.21 0.00 0.00 175.17 175.53 1l3n h LEU 84 N 13.10 0.00 0.00 1.23 3.38 -1.58 -3.34 115.31 128.10 1l3n h LEU 84 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1l3n h LEU 84 Cb 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1l3n h LEU 84 CO 1.39 0.10 0.00 0.61 0.09 0.00 0.00 178.44 180.62 1l3n n GLY 85 N 0.16 2.23 2.56 0.83 0.00 -1.17 -4.63 105.19 105.18 1l3n n GLY 85 Ca 0.01 -0.10 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.35 3.17 -0.16 1.61 0.02 -1.26 -3.66 114.94 113.32 1l3n s ASN 86 Ca 0.00 -1.08 -0.04 0.00 -1.02 0.00 0.00 52.86 50.72 1l3n s ASN 86 Cb 0.00 -0.32 -0.03 0.00 0.02 0.00 0.00 41.25 40.92 1l3n s ASN 86 CO 0.00 -0.41 -0.04 0.68 0.02 0.00 0.00 177.10 177.35 1l3n s VAL 87 N 2.11 3.88 -0.47 1.60 -7.23 -0.46 -4.79 120.40 115.05 1l3n s VAL 87 Ca 0.07 -0.36 -0.29 0.00 -1.81 0.00 0.00 61.98 59.59 1l3n s VAL 87 Cb -0.16 -2.70 0.03 0.00 0.56 0.00 0.00 36.38 34.10 1l3n s VAL 87 CO -0.28 0.49 1.18 -0.89 -0.31 0.00 0.00 175.10 175.29 1l3n s THR 88 N 0.41 4.16 -0.12 5.32 2.01 -1.26 -0.11 115.64 126.05 1l3n s THR 88 Ca -0.04 1.19 -0.15 0.00 0.31 0.00 0.00 61.69 63.00 1l3n s THR 88 Cb -0.14 -4.54 -0.05 0.00 0.01 0.00 0.00 72.50 67.78 1l3n s THR 88 CO 0.03 -0.97 0.35 0.00 -0.69 0.00 0.00 174.62 173.34 1l3n s ALA 89 N 4.59 3.60 1.08 7.40 0.00 0.37 -3.99 121.76 134.82 1l3n s ALA 89 Ca 0.50 -0.36 -0.16 0.00 0.00 0.00 0.00 51.96 51.94 1l3n s ALA 89 Cb -0.08 -2.43 0.12 0.00 0.00 0.00 0.00 23.12 20.73 1l3n s ALA 89 CO 0.32 0.18 0.27 -0.25 0.00 0.00 0.00 175.76 176.28 1l3n n ASP 90 N 3.16 -2.13 -0.33 0.00 8.00 0.52 -1.03 116.55 124.75 1l3n n ASP 90 Ca -0.12 -0.00 0.21 0.00 0.71 0.00 0.00 54.79 55.59 1l3n n ASP 90 Cb 0.52 -1.07 0.42 0.00 -0.02 0.00 0.00 41.12 40.96 1l3n n ASP 90 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1l3n h LYS 91 N -2.03 0.07 -0.01 -1.24 3.64 -1.91 0.18 116.57 115.27 1l3n h LYS 91 Ca -0.52 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 1l3n h LYS 91 Cb 1.34 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 1l3n h LYS 91 CO 0.39 0.05 0.00 -0.25 -2.27 0.00 0.00 179.45 177.37 1l3n n ASP 92 N -5.32 0.27 0.00 4.20 9.92 -1.26 -4.12 116.55 120.24 1l3n n ASP 92 Ca 0.29 -1.13 0.00 0.00 -0.53 0.00 0.00 54.79 53.42 1l3n n ASP 92 Cb 0.96 -0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.44 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 1.01 0.79 3.58 0.44 0.00 0.61 -3.74 105.19 107.89 1l3n n GLY 93 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.99 3.98 -0.22 1.61 1.01 -1.25 -2.71 120.40 119.83 1l3n s VAL 94 Ca 0.00 0.89 -0.02 0.00 0.00 0.00 0.00 61.98 62.85 1l3n s VAL 94 Cb 0.00 -4.63 0.01 0.00 0.00 0.00 0.00 36.38 31.76 1l3n s VAL 94 CO 0.00 -1.25 -0.09 0.00 0.00 0.00 0.00 175.10 173.76 1l3n s ALA 95 N 5.16 2.64 -0.07 5.51 0.00 -0.06 -0.35 121.76 134.59 1l3n s ALA 95 Ca 0.46 -1.28 -0.30 0.00 0.00 0.00 0.00 51.96 50.85 1l3n s ALA 95 Cb -0.08 -1.56 -0.02 0.00 0.00 0.00 0.00 23.12 21.46 1l3n s ALA 95 CO 0.26 -0.54 1.01 0.16 0.00 0.00 0.00 175.76 176.66 1l3n s ASP 96 N 1.38 7.27 -0.07 0.00 -4.77 -1.26 -1.32 116.67 117.89 1l3n s ASP 96 Ca 0.04 1.58 0.05 0.00 -3.30 0.00 0.00 52.55 50.92 1l3n s ASP 96 Cb -0.15 -2.56 -0.01 0.00 -1.09 0.00 0.00 42.92 39.11 1l3n s ASP 96 CO -0.06 -0.40 -0.23 -0.69 0.70 0.00 0.00 175.17 174.48 1l3n s VAL 97 N 1.74 2.23 -0.44 2.11 1.01 -0.18 -4.71 120.40 122.16 1l3n s VAL 97 Ca 0.50 -0.99 0.07 0.00 0.00 0.00 0.00 61.98 61.56 1l3n s VAL 97 Cb -0.19 -1.83 0.33 0.00 0.00 0.00 0.00 36.38 34.68 1l3n s VAL 97 CO 0.21 0.57 1.06 -1.54 0.00 0.00 0.00 175.10 175.39 1l3n n SER 98 N 3.08 -1.80 -4.78 3.32 3.41 -1.26 -0.37 113.62 115.22 1l3n n SER 98 Ca -0.18 -3.57 -0.27 0.00 -0.26 0.00 0.00 58.87 54.59 1l3n n SER 98 Cb 0.52 1.49 -0.06 0.00 -0.26 0.00 0.00 64.21 65.90 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 -0.19 4.43 -0.07 -1.33 1.09 -1.26 -4.94 121.20 118.92 1l3n s ILE 99 Ca 0.25 -1.02 0.04 0.00 -1.10 0.00 0.00 60.65 58.81 1l3n s ILE 99 Cb 0.30 -3.22 0.00 0.00 -1.06 0.00 0.00 42.46 38.49 1l3n s ILE 99 CO -0.06 -0.04 -0.19 -1.83 -0.10 0.00 0.00 174.94 172.72 1l3n s GLU 100 N -2.88 2.33 0.10 2.79 -1.05 -1.26 -0.41 118.70 118.31 1l3n s GLU 100 Ca 0.30 -0.69 0.10 0.00 -0.15 0.00 0.00 54.97 54.53 1l3n s GLU 100 Cb -0.11 -1.86 -0.04 0.00 -0.44 0.00 0.00 34.13 31.69 1l3n s GLU 100 CO 0.22 0.17 -0.26 0.34 0.95 0.00 0.00 175.26 176.68 1l3n s ASP 101 N 0.32 3.18 0.00 0.83 -1.08 -0.54 -4.91 116.67 114.46 1l3n s ASP 101 Ca -0.13 -0.68 0.17 0.00 -0.52 0.00 0.00 52.55 51.39 1l3n s ASP 101 Cb -0.16 -0.24 0.39 0.00 -1.46 0.00 0.00 42.92 41.46 1l3n s ASP 101 CO 0.05 0.20 1.31 -1.54 0.52 0.00 0.00 175.17 175.71 1l3n n SER 102 N 1.24 3.18 0.00 -0.34 3.41 -1.26 -0.45 113.62 119.41 1l3n n SER 102 Ca -0.18 -1.93 0.00 0.00 -0.26 0.00 0.00 58.87 56.51 1l3n n SER 102 Cb 0.53 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 1l3n n SER 102 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1l3n n VAL 103 N 1.07 0.81 -4.12 -3.33 3.14 -1.26 -4.97 118.33 109.66 1l3n n VAL 103 Ca 0.16 -0.83 -0.30 0.00 -2.96 0.00 0.00 64.34 60.41 1l3n n VAL 103 Cb 0.50 0.61 -0.08 0.00 -1.06 0.00 0.00 33.84 33.81 1l3n n VAL 103 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 1l3n s ILE 104 N -0.81 4.07 0.02 1.55 1.09 -1.26 -4.96 121.20 120.90 1l3n s ILE 104 Ca 0.00 -0.97 -0.09 0.00 -1.10 0.00 0.00 60.65 58.49 1l3n s ILE 104 Cb 0.00 -2.94 0.00 0.00 -1.06 0.00 0.00 42.46 38.46 1l3n s ILE 104 CO 0.00 0.12 0.19 -0.44 -0.10 0.00 0.00 174.94 174.70 1l3n s SER 105 N -2.32 0.01 0.00 3.58 0.01 -1.03 -4.56 113.70 109.39 1l3n s SER 105 Ca 0.26 -0.27 0.20 0.00 1.31 0.00 0.00 55.95 57.45 1l3n s SER 105 Cb -0.12 0.26 0.16 0.00 0.21 0.00 0.00 66.02 66.54 1l3n s SER 105 CO 0.19 -0.48 1.13 0.18 0.41 0.00 0.00 173.24 174.67 1l3n n LEU 106 N 1.00 2.66 0.00 2.44 4.77 -1.26 -2.11 117.00 124.50 1l3n n LEU 106 Ca -0.20 -1.02 -0.02 0.00 -0.03 0.00 0.00 56.01 54.74 1l3n n LEU 106 Cb 0.57 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 41.66 1l3n n LEU 106 CO 0.22 0.46 0.14 -0.24 -1.33 0.00 0.00 177.39 176.65 1l3n n SER 107 N 1.11 -0.52 0.00 -1.43 2.88 -1.19 -0.01 113.62 114.46 1l3n n SER 107 Ca 0.12 -1.34 0.00 0.00 -1.33 0.00 0.00 58.87 56.31 1l3n n SER 107 Cb 0.49 0.87 0.00 0.00 -0.75 0.00 0.00 64.21 64.82 1l3n n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1l3n n GLY 108 N -0.14 1.96 1.73 0.46 0.00 -1.26 -4.11 105.19 103.83 1l3n n GLY 108 Ca -0.02 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 2.82 -0.06 -1.61 1.61 -0.08 -1.26 -4.93 116.55 113.04 1l3n n ASP 109 Ca 0.00 0.01 -0.03 0.00 -1.51 0.00 0.00 54.79 53.27 1l3n n ASP 109 Cb 0.00 0.48 -0.03 0.00 2.34 0.00 0.00 41.12 43.91 1l3n n ASP 109 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 1l3n n HIS 110 N -2.45 0.05 -2.63 -0.67 8.25 -1.26 -4.79 115.22 111.73 1l3n n HIS 110 Ca 0.00 -1.13 -0.42 0.00 -0.26 0.00 0.00 57.72 55.91 1l3n n HIS 110 Cb 0.00 -0.73 -0.01 0.00 1.12 0.00 0.00 29.99 30.37 1l3n n HIS 110 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1l3n s SER 111 N 1.94 6.74 0.65 0.41 0.15 -1.25 -2.46 113.70 119.88 1l3n s SER 111 Ca 0.14 -2.15 0.33 0.00 0.70 0.00 0.00 55.95 54.97 1l3n s SER 111 Cb 0.07 -2.55 1.83 0.00 -1.71 0.00 0.00 66.02 63.66 1l3n s SER 111 CO -0.00 -1.24 2.07 0.16 1.20 0.00 0.00 173.24 175.43 1l3n h ILE 112 N 5.90 0.13 0.00 6.45 3.07 -1.73 -3.34 117.51 127.99 1l3n h ILE 112 Ca 0.34 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.75 1l3n h ILE 112 Cb 0.92 0.78 0.00 0.00 -0.27 0.00 0.00 36.82 38.26 1l3n h ILE 112 CO 1.41 0.00 0.00 -0.38 -1.05 0.00 0.00 178.15 178.13 1l3n n ILE 113 N -3.19 0.00 1.26 0.16 -0.00 -1.26 -0.37 119.36 115.96 1l3n n ILE 113 Ca -0.01 0.00 0.08 0.00 -0.00 0.00 0.00 62.75 62.82 1l3n n ILE 113 Cb 0.31 0.00 0.30 0.00 -0.00 0.00 0.00 39.64 40.25 1l3n n ILE 113 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1l3n n GLY 114 N -0.70 0.15 3.85 7.39 0.00 -1.25 -3.85 105.19 110.77 1l3n n GLY 114 Ca 0.00 -0.34 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.75 0.55 -0.15 1.61 3.00 0.50 -3.64 118.95 119.07 1l3n s ARG 115 Ca 0.26 -0.18 -0.01 0.00 0.00 0.00 0.00 55.73 55.80 1l3n s ARG 115 Cb 0.14 -1.81 -0.01 0.00 0.00 0.00 0.00 34.95 33.26 1l3n s ARG 115 CO 0.20 -2.51 -0.12 0.99 0.00 0.00 0.00 175.30 173.86 1l3n s THR 116 N -3.60 3.07 0.12 0.02 2.01 -0.81 -4.17 115.64 112.27 1l3n s THR 116 Ca 0.70 -0.64 0.03 0.00 0.31 0.00 0.00 61.69 62.09 1l3n s THR 116 Cb -0.07 -2.31 -0.04 0.00 0.01 0.00 0.00 72.50 70.09 1l3n s THR 116 CO 0.53 0.51 0.18 -0.76 -0.69 0.00 0.00 174.62 174.39 1l3n s LEU 117 N 0.60 4.07 -0.03 4.42 1.43 0.36 0.06 118.68 129.59 1l3n s LEU 117 Ca -0.07 0.07 -0.02 0.00 -1.03 0.00 0.00 54.13 53.08 1l3n s LEU 117 Cb -0.15 -2.68 0.02 0.00 0.03 0.00 0.00 46.19 43.40 1l3n s LEU 117 CO 0.03 0.11 0.06 -0.69 0.23 0.00 0.00 176.35 176.09 1l3n s VAL 118 N -1.61 -0.02 -0.10 -1.59 1.01 0.10 -1.14 120.40 117.05 1l3n s VAL 118 Ca 0.32 0.08 -0.04 0.00 0.00 0.00 0.00 61.98 62.34 1l3n s VAL 118 Cb -0.11 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 1l3n s VAL 118 CO 0.25 0.03 0.05 0.68 0.00 0.00 0.00 175.10 176.12 1l3n s VAL 119 N 0.44 4.72 0.32 2.92 -7.23 0.38 -1.85 120.40 120.11 1l3n s VAL 119 Ca -0.03 -0.09 0.10 0.00 -1.81 0.00 0.00 61.98 60.15 1l3n s VAL 119 Cb -0.05 -3.02 -0.05 0.00 0.56 0.00 0.00 36.38 33.82 1l3n s VAL 119 CO -0.02 0.60 -0.05 -1.00 -0.31 0.00 0.00 175.10 174.32 1l3n s HIS 120 N -0.86 2.49 0.11 2.82 3.76 -0.68 -2.06 115.29 120.87 1l3n s HIS 120 Ca 0.13 -0.40 -0.28 0.00 -0.15 0.00 0.00 55.06 54.37 1l3n s HIS 120 Cb -0.12 -1.33 -0.10 0.00 1.11 0.00 0.00 32.58 32.15 1l3n s HIS 120 CO 0.03 0.57 1.64 1.49 -0.85 0.00 0.00 174.74 177.61 1l3n h GLU 121 N 1.95 -0.49 -5.93 1.40 4.22 -1.28 -3.27 114.58 111.18 1l3n h GLU 121 Ca -0.42 0.03 -0.56 0.00 0.08 0.00 0.00 59.36 58.49 1l3n h GLU 121 Cb 1.25 0.11 -0.06 0.00 0.50 0.00 0.00 28.75 30.55 1l3n h GLU 121 CO 0.65 -0.33 -0.40 0.15 -2.18 0.00 0.00 179.01 176.90 1l3n s LYS 122 N -6.06 2.30 -0.09 1.92 1.02 0.43 -4.76 119.74 114.51 1l3n s LYS 122 Ca -0.16 -1.87 -0.12 0.00 0.02 0.00 0.00 55.97 53.84 1l3n s LYS 122 Cb 0.07 -2.08 -0.05 0.00 -0.52 0.00 0.00 37.83 35.25 1l3n s LYS 122 CO 0.65 -0.32 0.29 0.00 -0.92 0.00 0.00 175.35 175.05 1l3n s ALA 123 N -2.65 3.72 0.68 5.17 0.00 -1.25 0.15 121.76 127.59 1l3n s ALA 123 Ca 0.38 -0.42 -0.11 0.00 0.00 0.00 0.00 51.96 51.81 1l3n s ALA 123 Cb 0.00 -2.27 -0.00 0.00 0.00 0.00 0.00 23.12 20.85 1l3n s ALA 123 CO 0.22 0.40 1.06 0.16 0.00 0.00 0.00 175.76 177.60 1l3n s ASP 124 N -0.57 5.58 0.28 0.00 -4.77 -1.24 -4.44 116.67 111.51 1l3n s ASP 124 Ca 0.19 1.45 0.25 0.00 -3.30 0.00 0.00 52.55 51.14 1l3n s ASP 124 Cb -0.14 -2.36 0.93 0.00 -1.09 0.00 0.00 42.92 40.26 1l3n s ASP 124 CO 0.08 -1.29 1.76 0.44 0.70 0.00 0.00 175.17 176.85 1l3n h ASP 125 N -0.62 0.00 -5.87 2.11 3.32 -1.85 -3.46 116.42 110.05 1l3n h ASP 125 Ca -0.44 0.00 -0.39 0.00 0.02 0.00 0.00 57.03 56.22 1l3n h ASP 125 Cb 1.22 0.00 0.12 0.00 0.22 0.00 0.00 39.33 40.88 1l3n h ASP 125 CO 0.60 0.00 -0.74 0.18 -1.72 0.00 0.00 179.24 177.56 1l3n n LEU 126 N -2.38 -3.47 0.00 1.55 4.77 -1.26 -3.06 117.00 113.14 1l3n n LEU 126 Ca 0.03 -0.64 0.00 0.00 -0.03 0.00 0.00 56.01 55.38 1l3n n LEU 126 Cb 0.32 -2.96 0.00 0.00 -2.33 0.00 0.00 43.42 38.45 1l3n n LEU 126 CO 0.25 0.50 0.00 0.61 -1.33 0.00 0.00 177.39 177.42 1l3n n GLY 127 N -1.61 1.99 0.00 -0.72 0.00 -0.85 -4.49 105.19 99.51 1l3n n GLY 127 Ca -0.13 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.01 1l3n n GLY 127 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1l3n n LYS 128 N -2.00 0.43 0.25 1.61 5.02 -1.17 -1.68 118.16 120.61 1l3n n LYS 128 Ca 0.00 0.05 0.12 0.00 -2.02 0.00 0.00 58.31 56.46 1l3n n LYS 128 Cb 0.00 -1.50 0.60 0.00 -0.02 0.00 0.00 35.03 34.11 1l3n n LYS 128 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1l3n h GLY 129 N 3.87 0.00 -0.86 0.72 0.00 -1.88 -3.47 103.07 101.45 1l3n h GLY 129 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 46.96 1l3n h GLY 129 CO 0.00 0.00 -0.33 0.61 0.00 0.00 0.00 176.54 176.82 1l3n n GLY 130 N -0.21 1.72 3.78 4.60 0.00 -0.68 -4.91 105.19 109.49 1l3n n GLY 130 Ca -0.01 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.68 4.26 0.08 1.61 4.22 -1.26 -4.96 114.94 116.20 1l3n s ASN 131 Ca 0.00 -1.47 -0.16 0.00 -2.14 0.00 0.00 52.86 49.09 1l3n s ASN 131 Cb 0.00 0.29 -0.04 0.00 1.28 0.00 0.00 41.25 42.79 1l3n s ASN 131 CO 0.00 -0.84 0.90 1.21 -2.04 0.00 0.00 177.10 176.33 1l3n n GLU 132 N -1.35 -0.23 -0.14 3.55 0.00 -1.26 -0.65 120.64 120.56 1l3n n GLU 132 Ca -0.12 0.89 -0.09 0.00 0.00 0.00 0.00 57.16 57.84 1l3n n GLU 132 Cb 0.66 -1.31 -0.01 0.00 0.00 0.00 0.00 31.44 30.79 1l3n n GLU 132 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1l3n h GLU 133 N 0.00 0.64 -0.90 5.31 5.08 -1.97 -3.07 114.58 119.67 1l3n h GLU 133 Ca 0.08 -0.13 0.20 0.00 -1.00 0.00 0.00 59.36 58.51 1l3n h GLU 133 Cb 0.21 -0.09 -0.12 0.00 0.50 0.00 0.00 28.75 29.25 1l3n h GLU 133 CO -0.48 0.63 0.44 0.77 -1.00 0.00 0.00 179.01 179.37 1l3n h SER 134 N 0.53 0.45 0.21 1.42 0.02 -0.40 0.12 113.55 115.89 1l3n h SER 134 Ca 0.14 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1l3n h SER 134 Cb 0.25 0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1l3n h SER 134 CO -0.01 0.08 -0.12 1.07 -1.14 0.00 0.00 176.83 176.71 1l3n n THR 135 N -4.97 0.00 -0.04 -2.27 5.66 -0.61 -2.18 114.28 109.87 1l3n n THR 135 Ca 0.22 -0.12 -0.08 0.00 -3.05 0.00 0.00 64.05 61.02 1l3n n THR 135 Cb 0.61 0.16 -0.03 0.00 -1.55 0.00 0.00 70.33 69.52 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 -0.61 0.16 0.00 1.09 5.02 0.17 -0.56 118.16 123.44 1l3n n LYS 136 Ca 0.16 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 1l3n n LYS 136 Cb 0.30 -0.83 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 -3.25 0.02 0.00 -0.18 -2.24 0.13 -3.50 114.28 105.26 1l3n n THR 137 Ca -0.15 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1l3n n THR 137 Cb 0.61 1.63 0.00 0.00 -2.10 0.00 0.00 70.33 70.47 1l3n n THR 137 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l3n n GLY 138 N -0.01 1.55 2.39 3.38 0.00 -0.19 -3.91 105.19 108.39 1l3n n GLY 138 Ca 0.00 -0.43 -0.03 0.00 0.00 0.00 0.00 46.02 45.57 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 5.74 -1.14 0.15 1.61 3.02 -1.26 -2.21 115.26 121.16 1l3n n ASN 139 Ca 0.00 -1.88 0.12 0.00 -0.03 0.00 0.00 54.58 52.80 1l3n n ASN 139 Cb 0.00 0.63 0.52 0.00 -0.61 0.00 0.00 39.78 40.32 1l3n n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1l3n h ALA 140 N 0.97 1.00 -0.50 5.41 0.00 -1.78 -3.41 119.26 120.96 1l3n h ALA 140 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1l3n h ALA 140 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1l3n h ALA 140 CO -0.12 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.54 1l3n n GLY 141 N -0.07 -0.83 3.74 0.00 0.00 -1.26 -0.43 105.19 106.34 1l3n n GLY 141 Ca 0.02 -1.16 -0.37 0.00 0.00 0.00 0.00 46.02 44.51 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 -4.00 4.92 -1.00 1.61 0.01 -1.26 -4.63 113.70 109.35 1l3n s SER 142 Ca 0.00 2.55 -0.22 0.00 1.31 0.00 0.00 55.95 59.60 1l3n s SER 142 Cb 0.00 -2.61 -0.11 0.00 0.21 0.00 0.00 66.02 63.51 1l3n s SER 142 CO 0.00 -1.79 1.93 0.54 0.41 0.00 0.00 173.24 174.33 1l3n n ARG 143 N -1.66 1.70 0.28 12.44 1.74 -1.26 -1.46 116.66 128.44 1l3n n ARG 143 Ca 0.14 -2.21 0.12 0.00 -0.77 0.00 0.00 57.85 55.13 1l3n n ARG 143 Cb 0.48 -3.29 0.77 0.00 -1.02 0.00 0.00 32.46 29.41 1l3n n ARG 143 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1l3n h LEU 144 N 15.13 0.00 -7.25 0.55 3.38 -1.75 -3.44 115.31 121.94 1l3n h LEU 144 Ca 0.35 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.25 1l3n h LEU 144 Cb 0.79 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.36 1l3n h LEU 144 CO 1.64 0.02 -0.01 0.00 0.09 0.00 0.00 178.44 180.18 1l3n s ALA 145 N -4.77 -1.26 0.06 1.53 0.00 -0.87 -0.30 121.76 116.15 1l3n s ALA 145 Ca -0.05 0.63 -0.21 0.00 0.00 0.00 0.00 51.96 52.33 1l3n s ALA 145 Cb 0.16 0.26 0.05 0.00 0.00 0.00 0.00 23.12 23.58 1l3n s ALA 145 CO 0.61 -0.43 0.49 0.00 0.00 0.00 0.00 175.76 176.42 1l3n s GLY 147 N -2.12 -0.11 -0.59 0.00 0.00 -0.29 -1.41 107.32 102.79 1l3n s GLY 147 Ca -0.04 -0.21 0.06 0.00 0.00 0.00 0.00 44.72 44.53 1l3n s GLY 147 CO -0.04 -0.34 0.78 -0.62 0.00 0.00 0.00 173.10 172.88 1l3n n VAL 148 N -0.28 2.19 0.00 1.40 0.31 -1.26 -0.48 118.33 120.21 1l3n n VAL 148 Ca -0.12 -5.19 0.00 0.00 -0.01 0.00 0.00 64.34 59.01 1l3n n VAL 148 Cb 0.63 -1.82 0.00 0.00 -0.91 0.00 0.00 33.84 31.74 1l3n n VAL 148 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1l3n n ILE 149 N 0.57 0.00 0.00 2.52 2.08 -1.25 -4.90 119.36 118.38 1l3n n ILE 149 Ca 0.29 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.60 1l3n n ILE 149 Cb 0.43 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.32 1l3n n ILE 149 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1l3n n GLY 150 N 0.00 2.50 3.65 7.39 0.00 -1.14 -4.02 105.19 113.56 1l3n n GLY 150 Ca 0.00 -0.56 -0.44 0.00 0.00 0.00 0.00 46.02 45.02 1l3n n GLY 150 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1l3n n ILE 151 N 0.00 1.52 -4.12 -0.61 5.41 -1.26 -0.40 119.36 119.89 1l3n n ILE 151 Ca 0.00 -0.38 -0.09 0.00 1.00 0.00 0.00 62.75 63.28 1l3n n ILE 151 Cb 0.00 -1.33 -0.10 0.00 -0.71 0.00 0.00 39.64 37.50 1l3n n ILE 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1l3n s ALA 152 N -0.63 0.73 0.00 -1.39 0.00 -1.07 -4.79 121.76 114.61 1l3n s ALA 152 Ca 0.62 -1.21 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1l3n s ALA 152 Cb -0.66 0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.65 1l3n s ALA 152 CO 0.56 -0.26 0.13 0.94 0.00 0.00 0.00 175.76 177.13