#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l3n n THR 2 N 0.00 0.28 -4.31 0.00 5.66 -1.26 -4.61 114.28 110.03 1l3n n THR 2 Ca 0.00 -0.05 -0.34 0.00 -3.05 0.00 0.00 64.05 60.61 1l3n n THR 2 Cb 0.00 -1.57 -0.14 0.00 -1.55 0.00 0.00 70.33 67.08 1l3n n THR 2 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1l3n s LYS 3 N -2.08 3.46 0.12 1.09 3.01 -1.26 -0.68 119.74 123.38 1l3n s LYS 3 Ca -0.06 -0.62 -0.01 0.00 -1.01 0.00 0.00 55.97 54.27 1l3n s LYS 3 Cb 0.02 -2.87 -0.04 0.00 -1.01 0.00 0.00 37.83 33.94 1l3n s LYS 3 CO 0.08 0.05 0.04 0.00 0.51 0.00 0.00 175.35 176.02 1l3n s ALA 4 N 0.83 0.81 0.13 5.17 0.00 -0.32 -0.68 121.76 127.69 1l3n s ALA 4 Ca -0.02 -1.42 -0.00 0.00 0.00 0.00 0.00 51.96 50.51 1l3n s ALA 4 Cb -0.15 0.73 -0.04 0.00 0.00 0.00 0.00 23.12 23.67 1l3n s ALA 4 CO 0.01 -0.46 0.03 0.14 0.00 0.00 0.00 175.76 175.49 1l3n s VAL 5 N -4.01 0.22 -0.08 0.00 -7.23 0.42 -0.13 120.40 109.60 1l3n s VAL 5 Ca 0.21 -1.91 -0.02 0.00 -1.81 0.00 0.00 61.98 58.45 1l3n s VAL 5 Cb 0.08 -1.99 0.03 0.00 0.56 0.00 0.00 36.38 35.06 1l3n s VAL 5 CO -0.01 -0.54 0.02 0.00 -0.31 0.00 0.00 175.10 174.27 1l3n s ALA 6 N -3.96 0.61 -0.43 1.32 0.00 0.08 -0.61 121.76 118.77 1l3n s ALA 6 Ca 0.22 -0.11 -0.20 0.00 0.00 0.00 0.00 51.96 51.87 1l3n s ALA 6 Cb 0.07 -0.77 0.02 0.00 0.00 0.00 0.00 23.12 22.45 1l3n s ALA 6 CO 0.01 -0.56 0.62 0.14 0.00 0.00 0.00 175.76 175.97 1l3n s VAL 7 N 2.02 4.86 0.06 0.00 -7.23 -1.26 -1.14 120.40 117.70 1l3n s VAL 7 Ca 0.04 0.08 -0.09 0.00 -1.81 0.00 0.00 61.98 60.20 1l3n s VAL 7 Cb -0.13 -4.18 -0.05 0.00 0.56 0.00 0.00 36.38 32.58 1l3n s VAL 7 CO -0.05 -0.57 0.37 -0.76 -0.31 0.00 0.00 175.10 173.78 1l3n s LEU 8 N 2.74 4.36 0.16 1.32 1.02 0.70 -4.20 118.68 124.77 1l3n s LEU 8 Ca 0.21 0.74 -0.19 0.00 0.02 0.00 0.00 54.13 54.91 1l3n s LEU 8 Cb -0.14 -2.89 0.04 0.00 0.02 0.00 0.00 46.19 43.22 1l3n s LEU 8 CO 0.18 0.20 0.51 -0.54 0.02 0.00 0.00 176.35 176.72 1l3n s LYS 9 N -1.85 1.24 0.00 1.70 1.02 -0.00 -0.33 119.74 121.51 1l3n s LYS 9 Ca 0.31 -0.68 0.00 0.00 0.02 0.00 0.00 55.97 55.63 1l3n s LYS 9 Cb -0.14 0.53 0.00 0.00 -0.52 0.00 0.00 37.83 37.70 1l3n s LYS 9 CO 0.17 -0.52 0.00 0.41 -0.92 0.00 0.00 175.35 174.49 1l3n n GLY 10 N -0.31 -0.61 0.16 -3.33 0.00 -1.26 -0.89 105.19 98.95 1l3n n GLY 10 Ca -0.14 0.09 -0.15 0.00 0.00 0.00 0.00 46.02 45.82 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 0.53 0.00 1.61 3.58 -1.56 -3.48 116.42 117.10 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 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 40.90 1l3n h ASP 11 CO 0.00 1.04 0.00 0.61 -2.88 0.00 0.00 179.24 178.01 1l3n n GLY 12 N 0.56 1.63 0.34 -0.78 0.00 -1.26 -4.88 105.19 100.80 1l3n n GLY 12 Ca -0.07 -0.27 0.06 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 0.67 -6.05 1.61 0.13 -1.94 -3.39 132.00 123.02 1l3n h PRO 13 Ca 0.00 -0.04 -0.56 0.00 -0.87 0.00 0.00 66.00 64.53 1l3n h PRO 13 Cb 0.00 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 30.97 1l3n h PRO 13 CO 0.00 0.44 1.40 0.08 -0.23 0.00 0.00 178.00 179.69 1l3n s VAL 14 N -5.61 3.25 -0.30 1.56 1.01 -1.26 -3.90 120.40 115.16 1l3n s VAL 14 Ca -0.09 0.23 0.03 0.00 0.00 0.00 0.00 61.98 62.15 1l3n s VAL 14 Cb 0.19 -3.39 0.08 0.00 0.00 0.00 0.00 36.38 33.26 1l3n s VAL 14 CO 0.76 -0.29 -0.02 0.00 0.00 0.00 0.00 175.10 175.55 1l3n s GLN 15 N 6.41 1.73 0.04 2.72 -2.07 0.36 -3.98 119.66 124.87 1l3n s GLN 15 Ca 0.87 -1.53 -0.21 0.00 -1.82 0.00 0.00 55.36 52.68 1l3n s GLN 15 Cb -0.24 -2.94 -0.06 0.00 -1.09 0.00 0.00 33.01 28.68 1l3n s GLN 15 CO 0.31 -0.77 0.61 0.20 -1.32 0.00 0.00 175.29 174.33 1l3n s GLY 16 N 1.08 2.67 -0.37 2.60 0.00 0.55 -0.92 107.32 112.93 1l3n s GLY 16 Ca 0.02 0.07 0.01 0.00 0.00 0.00 0.00 44.72 44.82 1l3n s GLY 16 CO -0.08 0.68 0.24 -0.42 0.00 0.00 0.00 173.10 173.52 1l3n s ILE 17 N -0.58 0.29 -0.09 0.90 1.01 -1.23 -0.22 121.20 121.28 1l3n s ILE 17 Ca 0.31 -1.97 -0.06 0.00 0.00 0.00 0.00 60.65 58.93 1l3n s ILE 17 Cb -0.19 -1.22 -0.04 0.00 0.01 0.00 0.00 42.46 41.02 1l3n s ILE 17 CO 0.19 -1.03 0.16 -0.63 0.00 0.00 0.00 174.94 173.63 1l3n s ILE 18 N 0.80 5.47 -0.20 2.92 -1.09 -0.29 -1.18 121.20 127.63 1l3n s ILE 18 Ca 0.21 0.13 0.00 0.00 -2.23 0.00 0.00 60.65 58.77 1l3n s ILE 18 Cb -0.18 -3.45 0.05 0.00 -1.58 0.00 0.00 42.46 37.30 1l3n s ILE 18 CO -0.03 0.54 -0.07 0.20 -1.23 0.00 0.00 174.94 174.34 1l3n s ASN 19 N -1.27 3.35 -0.35 3.58 0.01 0.48 -0.74 114.94 119.99 1l3n s ASN 19 Ca 0.19 -0.90 -0.18 0.00 -0.71 0.00 0.00 52.86 51.25 1l3n s ASN 19 Cb -0.12 -1.11 -0.00 0.00 0.41 0.00 0.00 41.25 40.42 1l3n s ASN 19 CO 0.08 -0.18 0.52 -0.36 -1.51 0.00 0.00 177.10 175.65 1l3n s PHE 20 N 1.47 3.18 -0.11 2.20 0.40 0.81 -1.81 117.98 124.13 1l3n s PHE 20 Ca -0.02 0.20 0.02 0.00 -0.60 0.00 0.00 56.93 56.53 1l3n s PHE 20 Cb -0.17 -2.93 -0.01 0.00 0.51 0.00 0.00 43.02 40.43 1l3n s PHE 20 CO -0.07 -0.54 -0.19 -1.21 0.70 0.00 0.00 175.22 173.90 1l3n s GLU 21 N 2.41 3.19 -0.35 0.44 2.02 -0.06 -1.17 118.70 125.17 1l3n s GLU 21 Ca 0.19 -0.80 -0.10 0.00 0.02 0.00 0.00 54.97 54.28 1l3n s GLU 21 Cb -0.15 -2.44 0.02 0.00 0.10 0.00 0.00 34.13 31.66 1l3n s GLU 21 CO 0.13 0.20 0.17 -1.14 0.02 0.00 0.00 175.26 174.64 1l3n s GLN 22 N 0.34 2.95 0.27 1.61 0.74 0.14 -0.58 119.66 125.13 1l3n s GLN 22 Ca -0.16 -0.98 -0.01 0.00 0.05 0.00 0.00 55.36 54.26 1l3n s GLN 22 Cb -0.17 -3.64 0.36 0.00 1.10 0.00 0.00 33.01 30.66 1l3n s GLN 22 CO 0.08 -0.61 1.77 1.57 -0.55 0.00 0.00 175.29 177.55 1l3n h LYS 23 N 8.38 0.77 0.00 1.67 2.10 -1.82 -3.44 116.57 124.23 1l3n h LYS 23 Ca -0.27 -0.20 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 1l3n h LYS 23 Cb 1.11 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 32.35 1l3n h LYS 23 CO 0.64 0.77 0.00 -1.91 -2.00 0.00 0.00 179.45 176.96 1l3n n GLU 24 N -4.22 0.35 0.16 0.07 0.00 -1.26 -4.97 120.64 110.76 1l3n n GLU 24 Ca 0.02 0.00 0.04 0.00 0.00 0.00 0.00 57.16 57.23 1l3n n GLU 24 Cb 0.29 0.00 0.10 0.00 0.00 0.00 0.00 31.44 31.84 1l3n n GLU 24 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 1l3n h SER 25 N 0.00 0.00 0.73 4.31 0.87 -1.94 -3.27 113.55 114.25 1l3n h SER 25 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1l3n h SER 25 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1l3n h SER 25 CO 0.00 0.42 -1.06 0.59 -0.53 0.00 0.00 176.83 176.25 1l3n n ASN 26 N -3.25 0.68 -4.77 6.23 3.02 -1.26 -4.91 115.26 111.00 1l3n n ASN 26 Ca 0.02 0.13 -0.38 0.00 -0.03 0.00 0.00 54.58 54.32 1l3n n ASN 26 Cb 0.67 0.65 -0.01 0.00 -0.61 0.00 0.00 39.78 40.48 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 -4.10 2.84 0.79 7.41 0.00 -1.24 -5.02 107.32 108.01 1l3n s GLY 27 Ca 0.01 1.00 -0.13 0.00 0.00 0.00 0.00 44.72 45.60 1l3n s GLY 27 CO 0.79 1.51 1.16 2.56 0.00 0.00 0.00 173.10 179.12 1l3n s PRO 28 N -2.46 1.88 -0.67 2.90 0.04 -1.26 -4.64 135.00 130.79 1l3n s PRO 28 Ca 0.60 1.57 -0.27 0.00 0.04 0.00 0.00 61.00 62.94 1l3n s PRO 28 Cb -0.31 -1.82 0.03 0.00 0.04 0.00 0.00 34.50 32.43 1l3n s PRO 28 CO 0.39 -1.99 1.30 0.08 0.04 0.00 0.00 177.00 176.82 1l3n s VAL 29 N -2.36 3.79 -0.59 -0.36 1.01 0.48 -4.38 120.40 118.00 1l3n s VAL 29 Ca 0.69 0.57 -0.28 0.00 0.00 0.00 0.00 61.98 62.96 1l3n s VAL 29 Cb -0.25 -4.76 0.03 0.00 0.00 0.00 0.00 36.38 31.40 1l3n s VAL 29 CO 0.50 -1.58 1.26 -0.54 0.00 0.00 0.00 175.10 174.74 1l3n s LYS 30 N 5.57 3.43 -0.60 2.72 1.02 0.25 -1.54 119.74 130.60 1l3n s LYS 30 Ca 0.41 0.27 -0.15 0.00 0.02 0.00 0.00 55.97 56.52 1l3n s LYS 30 Cb -0.08 -4.06 0.15 0.00 -0.52 0.00 0.00 37.83 33.32 1l3n s LYS 30 CO 0.19 -1.79 0.54 0.54 -0.92 0.00 0.00 175.35 173.92 1l3n s VAL 31 N 5.31 5.21 0.50 3.17 0.11 0.12 -0.88 120.40 133.94 1l3n s VAL 31 Ca 0.45 -1.74 0.08 0.00 -2.93 0.00 0.00 61.98 57.84 1l3n s VAL 31 Cb -0.08 -4.32 0.04 0.00 -1.53 0.00 0.00 36.38 30.48 1l3n s VAL 31 CO 0.24 -0.90 0.58 -1.66 -3.33 0.00 0.00 175.10 170.04 1l3n s TRP 32 N 1.27 2.07 0.00 1.54 -2.14 -0.75 -1.10 118.94 119.84 1l3n s TRP 32 Ca 0.06 -0.62 0.00 0.00 2.66 0.00 0.00 56.10 58.21 1l3n s TRP 32 Cb -0.26 -2.19 0.00 0.00 -3.10 0.00 0.00 33.47 27.92 1l3n s TRP 32 CO 0.00 -0.63 0.00 0.41 -2.66 0.00 0.00 176.95 174.07 1l3n n GLY 33 N -1.91 0.64 2.59 3.67 0.00 0.45 -0.39 105.19 110.24 1l3n n GLY 33 Ca 0.08 -0.93 -0.29 0.00 0.00 0.00 0.00 46.02 44.88 1l3n n GLY 33 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1l3n s SER 34 N 0.00 3.53 0.23 1.61 0.15 -0.33 -0.50 113.70 118.40 1l3n s SER 34 Ca 0.00 -1.75 -0.28 0.00 0.70 0.00 0.00 55.95 54.62 1l3n s SER 34 Cb 0.00 -0.57 -0.09 0.00 -1.71 0.00 0.00 66.02 63.66 1l3n s SER 34 CO 0.00 -0.38 0.89 0.27 1.20 0.00 0.00 173.24 175.22 1l3n s ILE 35 N 1.53 4.18 0.23 6.45 -4.36 -0.89 -3.56 121.20 124.78 1l3n s ILE 35 Ca 0.12 1.94 0.09 0.00 -0.26 0.00 0.00 60.65 62.54 1l3n s ILE 35 Cb -0.19 -4.23 -0.04 0.00 1.25 0.00 0.00 42.46 39.24 1l3n s ILE 35 CO -0.20 0.46 -0.02 -0.75 0.24 0.00 0.00 174.94 174.67 1l3n s LYS 36 N -1.29 2.28 0.00 0.37 2.20 -0.09 -0.89 119.74 122.31 1l3n s LYS 36 Ca 0.41 -1.33 0.00 0.00 -0.36 0.00 0.00 55.97 54.68 1l3n s LYS 36 Cb -0.24 -2.20 0.00 0.00 -1.51 0.00 0.00 37.83 33.88 1l3n s LYS 36 CO 0.29 0.39 0.00 0.41 -0.36 0.00 0.00 175.35 176.09 1l3n n GLY 37 N -0.60 0.14 3.62 5.54 0.00 -1.00 -0.49 105.19 112.41 1l3n n GLY 37 Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.66 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 1.27 0.13 0.99 2.01 -1.03 -4.21 118.68 117.84 1l3n s LEU 38 Ca 0.00 1.23 0.03 0.00 0.01 0.00 0.00 54.13 55.41 1l3n s LEU 38 Cb 0.00 -3.31 -0.04 0.00 0.01 0.00 0.00 46.19 42.86 1l3n s LEU 38 CO 0.00 -3.52 0.17 0.28 1.01 0.00 0.00 176.35 174.29 1l3n s THR 39 N -2.83 4.80 0.39 5.49 -1.32 -1.26 -3.84 115.64 117.07 1l3n s THR 39 Ca 0.66 -0.84 -0.24 0.00 -1.21 0.00 0.00 61.69 60.06 1l3n s THR 39 Cb -0.20 -3.41 -0.12 0.00 -1.51 0.00 0.00 72.50 67.25 1l3n s THR 39 CO 0.60 -0.03 0.77 1.21 -2.21 0.00 0.00 174.62 174.96 1l3n n GLU 40 N -0.15 0.90 0.00 7.08 2.13 -1.26 -4.61 120.64 124.73 1l3n n GLU 40 Ca -0.08 0.32 0.00 0.00 0.66 0.00 0.00 57.16 58.07 1l3n n GLU 40 Cb 0.53 -1.70 0.00 0.00 0.27 0.00 0.00 31.44 30.54 1l3n n GLU 40 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1l3n n GLY 41 N 1.52 -2.52 3.77 8.31 0.00 0.08 -4.86 105.19 111.48 1l3n n GLY 41 Ca 0.11 -2.09 -0.38 0.00 0.00 0.00 0.00 46.02 43.67 1l3n n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l3n s LEU 42 N 0.00 4.07 -0.07 0.99 2.01 -1.26 -0.75 118.68 123.67 1l3n s LEU 42 Ca 0.00 2.42 -0.08 0.00 0.01 0.00 0.00 54.13 56.48 1l3n s LEU 42 Cb 0.00 -4.14 0.02 0.00 0.01 0.00 0.00 46.19 42.08 1l3n s LEU 42 CO 0.00 -0.92 0.22 -1.00 1.01 0.00 0.00 176.35 175.66 1l3n s HIS 43 N -1.44 -0.22 -0.08 0.29 3.76 -0.18 -3.07 115.29 114.35 1l3n s HIS 43 Ca 0.62 0.53 -0.10 0.00 -0.15 0.00 0.00 55.06 55.96 1l3n s HIS 43 Cb -0.32 0.07 -0.05 0.00 1.11 0.00 0.00 32.58 33.40 1l3n s HIS 43 CO 0.39 -0.15 0.33 0.41 -0.85 0.00 0.00 174.74 174.88 1l3n n GLY 44 N 2.76 0.01 2.70 -2.22 0.00 0.18 -2.10 105.19 106.52 1l3n n GLY 44 Ca -0.14 0.22 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 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 0.45 -0.20 0.25 1.61 2.19 0.66 -0.84 117.98 122.11 1l3n s PHE 45 Ca 0.23 -0.17 -0.13 0.00 0.33 0.00 0.00 56.93 57.20 1l3n s PHE 45 Cb -0.33 -0.52 -0.00 0.00 -1.31 0.00 0.00 43.02 40.85 1l3n s PHE 45 CO 0.17 -0.76 0.50 -1.01 1.83 0.00 0.00 175.22 175.95 1l3n s HIS 46 N 2.28 0.35 0.26 10.12 0.09 -0.96 -0.09 115.29 127.33 1l3n s HIS 46 Ca 0.08 -0.72 -0.13 0.00 -0.00 0.00 0.00 55.06 54.29 1l3n s HIS 46 Cb -0.15 0.22 -0.08 0.00 -0.00 0.00 0.00 32.58 32.57 1l3n s HIS 46 CO -0.24 -1.02 0.63 0.14 -0.00 0.00 0.00 174.74 174.25 1l3n s VAL 47 N -3.95 4.81 -0.11 -0.90 -7.23 0.40 -0.72 120.40 112.69 1l3n s VAL 47 Ca 0.22 0.74 0.03 0.00 -1.81 0.00 0.00 61.98 61.16 1l3n s VAL 47 Cb -0.01 -3.64 0.00 0.00 0.56 0.00 0.00 36.38 33.29 1l3n s VAL 47 CO 0.09 -0.06 -0.22 -1.00 -0.31 0.00 0.00 175.10 173.60 1l3n s HIS 48 N -1.82 2.53 0.10 2.82 3.76 0.14 -4.68 115.29 118.13 1l3n s HIS 48 Ca 0.49 -1.13 -0.24 0.00 -0.15 0.00 0.00 55.06 54.03 1l3n s HIS 48 Cb -0.12 -1.71 -0.12 0.00 1.11 0.00 0.00 32.58 31.75 1l3n s HIS 48 CO 0.19 -0.48 1.71 1.49 -0.85 0.00 0.00 174.74 176.80 1l3n h GLU 49 N 6.96 -0.17 -6.68 1.40 4.81 -1.74 -2.73 114.58 116.43 1l3n h GLU 49 Ca -0.25 0.01 -0.50 0.00 -0.13 0.00 0.00 59.36 58.49 1l3n h GLU 49 Cb 1.22 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.62 1l3n h GLU 49 CO 0.50 -0.11 0.37 -0.06 -0.73 0.00 0.00 179.01 178.98 1l3n s PHE 50 N -6.16 3.89 -0.22 0.92 0.40 0.04 -4.60 117.98 112.25 1l3n s PHE 50 Ca -0.14 1.85 0.13 0.00 -0.60 0.00 0.00 56.93 58.17 1l3n s PHE 50 Cb 0.07 -3.03 0.45 0.00 0.51 0.00 0.00 43.02 41.02 1l3n s PHE 50 CO 0.66 0.28 1.34 0.41 0.70 0.00 0.00 175.22 178.61 1l3n n GLY 51 N 1.78 4.76 3.06 4.36 0.00 -1.26 -4.23 105.19 113.66 1l3n n GLY 51 Ca -0.00 -1.18 -0.41 0.00 0.00 0.00 0.00 46.02 44.42 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 -1.05 3.50 0.00 1.61 5.68 -1.26 -4.71 116.55 120.31 1l3n n ASP 52 Ca 0.24 -2.78 0.05 0.00 -0.50 0.00 0.00 54.79 51.80 1l3n n ASP 52 Cb 0.86 -1.50 0.28 0.00 -1.14 0.00 0.00 41.12 39.62 1l3n n ASP 52 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1l3n n ASN 53 N 7.73 0.00 -0.32 -1.12 2.85 -1.26 -4.04 115.26 119.09 1l3n n ASN 53 Ca 0.50 -1.28 0.20 0.00 -0.11 0.00 0.00 54.58 53.89 1l3n n ASN 53 Cb 0.41 0.00 0.38 0.00 1.24 0.00 0.00 39.78 41.81 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 -0.69 -0.40 0.23 -0.44 -1.04 -1.26 0.01 114.28 110.69 1l3n n THR 54 Ca 0.07 2.06 0.12 0.00 -2.04 0.00 0.00 64.05 64.26 1l3n n THR 54 Cb 0.03 -3.11 0.20 0.00 -1.82 0.00 0.00 70.33 65.63 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 1.92 1.00 -1.23 2.41 0.00 -2.00 -3.49 119.26 117.87 1l3n h ALA 55 Ca 0.66 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.57 1l3n h ALA 55 Cb 1.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1l3n h ALA 55 CO -0.85 0.00 0.00 0.41 0.00 0.00 0.00 179.25 178.81 1l3n n GLY 56 N 1.03 -0.89 2.40 0.00 0.00 0.10 -4.68 105.19 103.16 1l3n n GLY 56 Ca 0.04 -0.51 -0.13 0.00 0.00 0.00 0.00 46.02 45.42 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 -3.30 0.71 0.47 0.00 -1.04 -1.26 -4.73 114.28 105.13 1l3n n THR 58 Ca -0.15 0.16 0.13 0.00 -2.04 0.00 0.00 64.05 62.15 1l3n n THR 58 Cb 0.60 -1.61 0.40 0.00 -1.82 0.00 0.00 70.33 67.90 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 -0.12 0.00 0.00 8.00 0.02 -1.85 -3.36 113.55 116.23 1l3n h SER 59 Ca -0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1l3n h SER 59 Cb 0.62 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.16 1l3n h SER 59 CO -0.03 0.00 0.22 0.00 -1.14 0.00 0.00 176.83 175.89 1l3n n ALA 60 N -1.87 0.67 -0.10 3.77 0.00 -1.26 -4.83 120.51 116.89 1l3n n ALA 60 Ca 0.04 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1l3n n ALA 60 Cb 0.40 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 19.07 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 -1.30 -0.89 2.64 0.00 0.00 -1.26 -0.78 105.19 103.60 1l3n n GLY 61 Ca -0.01 -1.11 -0.35 0.00 0.00 0.00 0.00 46.02 44.56 1l3n n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1l3n n PRO 62 N 1.39 2.61 -2.81 1.61 -0.04 -1.26 -4.33 135.00 132.18 1l3n n PRO 62 Ca 0.00 -1.99 -0.10 0.00 -0.04 0.00 0.00 63.50 61.37 1l3n n PRO 62 Cb 0.00 -2.82 0.05 0.00 -0.04 0.00 0.00 33.50 30.69 1l3n n PRO 62 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1l3n n HIS 63 N 5.04 -1.49 -0.41 0.54 8.25 -1.26 -4.59 115.22 121.31 1l3n n HIS 63 Ca 0.57 0.59 -0.03 0.00 -0.26 0.00 0.00 57.72 58.59 1l3n n HIS 63 Cb 0.27 -3.82 -0.04 0.00 1.12 0.00 0.00 29.99 27.51 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 -2.86 0.00 -1.67 4.41 3.72 -1.26 -4.94 117.46 114.86 1l3n n PHE 64 Ca -0.13 -0.70 -0.39 0.00 -0.05 0.00 0.00 57.45 56.18 1l3n n PHE 64 Cb 0.60 -0.67 0.04 0.00 -0.94 0.00 0.00 39.48 38.51 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 2.08 1.60 -0.17 4.37 6.94 -1.26 -4.92 115.26 123.91 1l3n n ASN 65 Ca 0.10 0.91 -0.09 0.00 -0.02 0.00 0.00 54.58 55.47 1l3n n ASN 65 Cb 0.39 -1.46 0.01 0.00 -2.36 0.00 0.00 39.78 36.36 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 1.01 0.79 -2.63 -0.53 0.13 -1.92 -3.04 132.00 125.82 1l3n h PRO 66 Ca -0.49 -0.20 -0.34 0.00 -0.87 0.00 0.00 66.00 64.10 1l3n h PRO 66 Cb 1.34 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 1l3n h PRO 66 CO 0.54 0.79 1.43 1.28 -0.23 0.00 0.00 178.00 181.81 1l3n n LEU 67 N -4.45 5.74 -3.29 1.56 4.77 -1.26 -4.93 117.00 115.14 1l3n n LEU 67 Ca 0.01 -3.23 -0.46 0.00 -0.03 0.00 0.00 56.01 52.30 1l3n n LEU 67 Cb 0.24 -1.28 -0.09 0.00 -2.33 0.00 0.00 43.42 39.96 1l3n n LEU 67 CO 0.40 1.42 1.35 -1.54 -1.33 0.00 0.00 177.39 177.69 1l3n n SER 68 N 3.15 0.57 -2.42 -1.43 3.41 -1.15 -4.89 113.62 110.86 1l3n n SER 68 Ca 0.50 0.52 -0.10 0.00 -0.26 0.00 0.00 58.87 59.52 1l3n n SER 68 Cb 0.50 -0.70 -0.03 0.00 -0.26 0.00 0.00 64.21 63.73 1l3n n SER 68 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1l3n n ARG 69 N 5.82 0.71 -2.20 4.33 3.00 -1.26 -5.12 116.66 121.94 1l3n n ARG 69 Ca 0.43 -1.45 -0.30 0.00 -0.00 0.00 0.00 57.85 56.53 1l3n n ARG 69 Cb -0.03 0.83 -0.00 0.00 0.00 0.00 0.00 32.46 33.26 1l3n n ARG 69 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1l3n s LYS 70 N -2.65 3.64 0.08 -0.14 -0.14 -1.21 -4.85 119.74 114.47 1l3n s LYS 70 Ca 0.10 0.61 -0.31 0.00 -1.36 0.00 0.00 55.97 55.00 1l3n s LYS 70 Cb 0.00 -2.19 -0.11 0.00 -1.68 0.00 0.00 37.83 33.86 1l3n s LYS 70 CO 0.07 -0.40 1.87 1.58 -0.76 0.00 0.00 175.35 177.71 1l3n n HIS 71 N -2.39 2.55 -0.80 3.18 -0.00 -0.44 -2.99 115.22 114.33 1l3n n HIS 71 Ca 0.04 -0.18 0.00 0.00 -0.00 0.00 0.00 57.72 57.59 1l3n n HIS 71 Cb 0.54 -2.74 0.00 0.00 -0.00 0.00 0.00 29.99 27.80 1l3n n HIS 71 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1l3n n GLY 72 N 4.30 5.40 0.00 1.57 0.00 -1.23 -2.66 105.19 112.56 1l3n n GLY 72 Ca 0.19 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.90 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 2.27 0.76 0.00 -0.02 0.00 -1.26 -4.65 105.19 102.29 1l3n n GLY 73 Ca 0.00 -0.68 0.02 0.00 0.00 0.00 0.00 46.02 45.36 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 0.20 -0.01 1.61 -0.04 -1.25 -0.48 135.00 135.03 1l3n n PRO 74 Ca 0.00 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.57 1l3n n PRO 74 Cb 0.00 -1.32 -0.15 0.00 -0.04 0.00 0.00 33.50 31.99 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 -0.82 0.43 -4.24 0.54 4.76 -1.26 -5.00 118.16 112.57 1l3n n LYS 75 Ca 0.03 -0.12 -0.24 0.00 -2.87 0.00 0.00 58.31 55.11 1l3n n LYS 75 Cb 0.01 -1.51 -0.08 0.00 -1.84 0.00 0.00 35.03 31.62 1l3n n LYS 75 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1l3n s ASP 76 N -3.91 4.35 0.08 4.39 -1.08 0.37 -5.01 116.67 115.86 1l3n s ASP 76 Ca -0.02 -0.96 -0.11 0.00 -0.52 0.00 0.00 52.55 50.94 1l3n s ASP 76 Cb 0.15 -0.57 -0.24 0.00 -1.46 0.00 0.00 42.92 40.79 1l3n s ASP 76 CO 0.89 -0.31 1.17 -0.08 0.52 0.00 0.00 175.17 177.35 1l3n h GLU 77 N 1.67 0.57 -1.91 4.34 4.81 -1.95 -3.41 114.58 118.70 1l3n h GLU 77 Ca -0.43 -0.71 -0.74 0.00 -0.13 0.00 0.00 59.36 57.35 1l3n h GLU 77 Cb 1.25 0.22 -0.30 0.00 0.63 0.00 0.00 28.75 30.56 1l3n h GLU 77 CO 0.67 1.30 0.75 -0.85 -0.73 0.00 0.00 179.01 180.15 1l3n n GLU 78 N -3.77 2.87 -0.80 1.92 0.28 -1.26 -4.97 120.64 114.90 1l3n n GLU 78 Ca -0.11 -3.69 -0.32 0.00 -0.16 0.00 0.00 57.16 52.87 1l3n n GLU 78 Cb 0.94 -2.27 0.14 0.00 1.43 0.00 0.00 31.44 31.68 1l3n n GLU 78 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1l3n n ARG 79 N -0.53 -0.28 0.14 3.44 3.00 -1.26 -3.35 116.66 117.82 1l3n n ARG 79 Ca 0.51 -0.03 -0.06 0.00 -0.01 0.00 0.00 57.85 58.27 1l3n n ARG 79 Cb 0.31 -2.09 -0.03 0.00 0.00 0.00 0.00 32.46 30.65 1l3n n ARG 79 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1l3n h HIS 80 N -1.57 -0.35 0.00 -1.55 3.86 -1.84 -3.44 115.15 110.27 1l3n h HIS 80 Ca -0.44 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.77 1l3n h HIS 80 Cb 1.28 0.12 0.00 0.00 1.06 0.00 0.00 27.41 29.87 1l3n h HIS 80 CO 0.43 -0.22 0.00 1.55 0.86 0.00 0.00 177.93 180.55 1l3n n VAL 81 N -3.40 0.00 -2.56 2.45 3.14 -1.26 -4.78 118.33 111.92 1l3n n VAL 81 Ca -0.05 0.00 -0.34 0.00 -2.96 0.00 0.00 64.34 60.99 1l3n n VAL 81 Cb 0.15 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.93 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 -1.50 5.84 3.47 7.55 0.00 -1.26 -4.79 105.19 114.51 1l3n n GLY 82 Ca 0.00 -2.66 -0.43 0.00 0.00 0.00 0.00 46.02 42.93 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 -2.31 6.55 0.26 1.61 1.01 -1.26 -0.45 116.67 122.08 1l3n s ASP 83 Ca 0.46 -1.83 0.06 0.00 0.71 0.00 0.00 52.55 51.95 1l3n s ASP 83 Cb 0.30 -2.43 0.34 0.00 1.01 0.00 0.00 42.92 42.14 1l3n s ASP 83 CO -0.20 -1.17 1.62 -0.07 0.21 0.00 0.00 175.17 175.55 1l3n h LEU 84 N 10.87 0.24 0.00 1.23 -0.00 -1.75 -3.34 115.31 122.55 1l3n h LEU 84 Ca 0.11 -0.12 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1l3n h LEU 84 Cb 1.03 -0.07 0.00 0.00 -0.00 0.00 0.00 40.66 41.62 1l3n h LEU 84 CO 1.16 0.73 0.00 0.61 -0.00 0.00 0.00 178.44 180.94 1l3n n GLY 85 N 0.10 1.11 3.11 0.83 0.00 0.86 -4.37 105.19 106.84 1l3n n GLY 85 Ca -0.02 -0.74 -0.12 0.00 0.00 0.00 0.00 46.02 45.15 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 -0.05 -0.02 1.61 0.01 -1.26 -0.24 114.94 110.98 1l3n s ASN 86 Ca 0.00 -0.03 0.06 0.00 -0.71 0.00 0.00 52.86 52.18 1l3n s ASN 86 Cb 0.00 0.26 -0.01 0.00 0.41 0.00 0.00 41.25 41.91 1l3n s ASN 86 CO 0.00 -0.30 -0.20 0.68 -1.51 0.00 0.00 177.10 175.77 1l3n s VAL 87 N -0.99 1.62 -0.37 1.60 -7.23 -0.89 -4.89 120.40 109.24 1l3n s VAL 87 Ca -0.11 -0.87 -0.21 0.00 -1.81 0.00 0.00 61.98 58.98 1l3n s VAL 87 Cb -0.06 -1.35 0.01 0.00 0.56 0.00 0.00 36.38 35.54 1l3n s VAL 87 CO 0.01 0.46 0.68 -0.89 -0.31 0.00 0.00 175.10 175.05 1l3n s THR 88 N -0.39 4.83 0.09 5.32 2.01 -1.26 -1.01 115.64 125.23 1l3n s THR 88 Ca 0.06 0.60 -0.23 0.00 0.31 0.00 0.00 61.69 62.43 1l3n s THR 88 Cb -0.09 -4.13 -0.07 0.00 0.01 0.00 0.00 72.50 68.22 1l3n s THR 88 CO -0.00 -0.39 0.69 0.00 -0.69 0.00 0.00 174.62 174.22 1l3n s ALA 89 N 2.84 3.48 1.11 7.40 0.00 0.07 -4.06 121.76 132.61 1l3n s ALA 89 Ca 0.26 0.20 -0.13 0.00 0.00 0.00 0.00 51.96 52.29 1l3n s ALA 89 Cb -0.14 -2.84 0.25 0.00 0.00 0.00 0.00 23.12 20.39 1l3n s ALA 89 CO 0.16 0.25 1.06 0.34 0.00 0.00 0.00 175.76 177.57 1l3n s ASP 90 N -0.75 1.55 0.43 0.00 2.15 0.29 -0.75 116.67 119.60 1l3n s ASP 90 Ca 0.34 1.26 0.21 0.00 0.43 0.00 0.00 52.55 54.78 1l3n s ASP 90 Cb -0.21 -1.95 1.17 0.00 -0.30 0.00 0.00 42.92 41.62 1l3n s ASP 90 CO 0.22 -3.81 1.83 0.07 -0.17 0.00 0.00 175.17 173.31 1l3n h LYS 91 N -2.36 0.32 -0.02 4.34 2.10 -1.94 0.97 116.57 119.97 1l3n h LYS 91 Ca -0.58 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.05 1l3n h LYS 91 Cb 1.34 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 1l3n h LYS 91 CO 0.53 0.21 0.00 -3.47 -2.00 0.00 0.00 179.45 174.72 1l3n n ASP 92 N -4.50 0.18 0.00 7.07 2.03 -1.26 -4.73 116.55 115.34 1l3n n ASP 92 Ca 0.21 -1.56 0.00 0.00 0.52 0.00 0.00 54.79 53.97 1l3n n ASP 92 Cb 0.82 -0.01 0.00 0.00 -0.72 0.00 0.00 41.12 41.21 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 0.77 0.66 3.60 0.27 0.00 0.33 -4.45 105.19 106.37 1l3n n GLY 93 Ca 0.12 0.00 -0.43 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 -2.79 4.14 -0.30 1.61 1.01 -1.25 -2.36 120.40 120.46 1l3n s VAL 94 Ca 0.00 1.13 -0.09 0.00 0.00 0.00 0.00 61.98 63.03 1l3n s VAL 94 Cb 0.00 -4.61 -0.00 0.00 0.00 0.00 0.00 36.38 31.77 1l3n s VAL 94 CO 0.00 -1.07 0.12 0.00 0.00 0.00 0.00 175.10 174.15 1l3n s ALA 95 N 4.64 3.20 -1.11 5.51 0.00 -0.07 -0.55 121.76 133.39 1l3n s ALA 95 Ca 0.48 -1.38 -0.20 0.00 0.00 0.00 0.00 51.96 50.86 1l3n s ALA 95 Cb -0.07 -2.28 0.08 0.00 0.00 0.00 0.00 23.12 20.84 1l3n s ALA 95 CO 0.31 -0.86 1.50 0.16 0.00 0.00 0.00 175.76 176.86 1l3n s ASP 96 N 1.58 6.66 0.09 0.00 -4.77 -1.26 -2.10 116.67 116.88 1l3n s ASP 96 Ca 0.04 -1.95 -0.30 0.00 -3.30 0.00 0.00 52.55 47.04 1l3n s ASP 96 Cb -0.17 -2.54 -0.06 0.00 -1.09 0.00 0.00 42.92 39.07 1l3n s ASP 96 CO 0.05 -1.29 1.12 -0.69 0.70 0.00 0.00 175.17 175.06 1l3n s VAL 97 N 4.19 4.13 -0.46 2.11 1.01 0.35 -4.90 120.40 126.84 1l3n s VAL 97 Ca 0.46 1.62 0.06 0.00 0.00 0.00 0.00 61.98 64.13 1l3n s VAL 97 Cb 0.00 -4.04 0.29 0.00 0.00 0.00 0.00 36.38 32.63 1l3n s VAL 97 CO -0.04 0.18 1.00 -1.54 0.00 0.00 0.00 175.10 174.70 1l3n n SER 98 N 3.40 -2.31 -4.67 3.32 3.41 -1.25 -0.41 113.62 115.11 1l3n n SER 98 Ca 0.06 -3.49 -0.24 0.00 -0.26 0.00 0.00 58.87 54.94 1l3n n SER 98 Cb 0.47 1.68 -0.07 0.00 -0.26 0.00 0.00 64.21 66.04 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 0.24 3.66 -0.01 -1.33 1.09 -0.25 -4.94 121.20 119.65 1l3n s ILE 99 Ca 0.27 -1.72 0.02 0.00 -1.10 0.00 0.00 60.65 58.12 1l3n s ILE 99 Cb 0.27 -2.93 0.00 0.00 -1.06 0.00 0.00 42.46 38.74 1l3n s ILE 99 CO -0.13 -0.30 -0.06 -1.83 -0.10 0.00 0.00 174.94 172.52 1l3n s GLU 100 N -3.51 0.55 0.02 2.79 -1.05 -1.26 0.13 118.70 116.38 1l3n s GLU 100 Ca 0.30 -0.19 0.01 0.00 -0.15 0.00 0.00 54.97 54.95 1l3n s GLU 100 Cb -0.07 -0.55 -0.02 0.00 -0.44 0.00 0.00 34.13 33.05 1l3n s GLU 100 CO 0.20 0.08 -0.04 0.34 0.95 0.00 0.00 175.26 176.79 1l3n s ASP 101 N 0.09 0.43 0.00 0.83 -1.08 -0.59 -4.96 116.67 111.39 1l3n s ASP 101 Ca -0.01 -0.40 0.11 0.00 -0.52 0.00 0.00 52.55 51.74 1l3n s ASP 101 Cb -0.05 0.05 0.05 0.00 -1.46 0.00 0.00 42.92 41.50 1l3n s ASP 101 CO -0.00 -0.19 0.77 -1.54 0.52 0.00 0.00 175.17 174.73 1l3n n SER 102 N 1.92 1.64 -0.09 -0.34 3.41 -1.26 -0.39 113.62 118.52 1l3n n SER 102 Ca -0.21 -1.32 -0.18 0.00 -0.26 0.00 0.00 58.87 56.91 1l3n n SER 102 Cb 0.56 0.21 -0.13 0.00 -0.26 0.00 0.00 64.21 64.60 1l3n n SER 102 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1l3n n VAL 103 N 0.24 1.56 -2.02 -3.33 3.14 -1.26 -4.86 118.33 111.81 1l3n n VAL 103 Ca 0.06 -0.63 -0.41 0.00 -2.96 0.00 0.00 64.34 60.40 1l3n n VAL 103 Cb 0.26 -1.40 -0.02 0.00 -1.06 0.00 0.00 33.84 31.62 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 -2.53 2.60 -0.21 1.55 1.09 -1.26 -5.01 121.20 117.43 1l3n s ILE 104 Ca -0.29 0.54 -0.14 0.00 -1.10 0.00 0.00 60.65 59.67 1l3n s ILE 104 Cb 0.08 -3.35 0.06 0.00 -1.06 0.00 0.00 42.46 38.20 1l3n s ILE 104 CO 0.67 0.10 0.52 -0.44 -0.10 0.00 0.00 174.94 175.70 1l3n s SER 105 N 0.08 -0.66 -1.51 3.58 0.01 -1.26 -4.36 113.70 109.58 1l3n s SER 105 Ca 0.56 1.12 -0.10 0.00 1.31 0.00 0.00 55.95 58.84 1l3n s SER 105 Cb -0.42 1.03 -0.07 0.00 0.21 0.00 0.00 66.02 66.77 1l3n s SER 105 CO 0.48 -0.21 2.78 0.18 0.41 0.00 0.00 173.24 176.89 1l3n n LEU 106 N 3.93 8.06 0.00 2.44 7.99 -1.26 -3.86 117.00 134.29 1l3n n LEU 106 Ca -0.20 -4.14 0.00 0.00 -0.01 0.00 0.00 56.01 51.66 1l3n n LEU 106 Cb 0.57 -1.50 0.00 0.00 -0.11 0.00 0.00 43.42 42.37 1l3n n LEU 106 CO 0.05 1.77 0.00 -1.20 -1.51 0.00 0.00 177.39 176.51 1l3n n SER 107 N 3.93 0.00 0.00 -1.43 7.64 -1.26 0.11 113.62 122.62 1l3n n SER 107 Ca 0.72 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.60 1l3n n SER 107 Cb 0.23 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 1l3n n SER 107 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1l3n n GLY 108 N 5.00 -0.16 0.40 0.23 0.00 -1.26 -2.96 105.19 106.43 1l3n n GLY 108 Ca 0.00 0.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.87 1l3n n GLY 108 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1l3n h ASP 109 N 0.00 -0.84 0.06 1.61 1.82 -1.98 -3.32 116.42 113.77 1l3n h ASP 109 Ca 0.00 0.01 -0.25 0.00 -0.39 0.00 0.00 57.03 56.40 1l3n h ASP 109 Cb 0.00 0.22 0.02 0.00 0.68 0.00 0.00 39.33 40.24 1l3n h ASP 109 CO 0.00 -0.48 -0.99 0.45 -1.61 0.00 0.00 179.24 176.61 1l3n h HIS 110 N -1.21 0.96 -6.48 0.28 3.86 -1.91 -3.48 115.15 107.17 1l3n h HIS 110 Ca -0.10 -0.51 -0.41 0.00 -1.16 0.00 0.00 60.37 58.19 1l3n h HIS 110 Cb 0.77 -0.11 0.01 0.00 1.06 0.00 0.00 27.41 29.14 1l3n h HIS 110 CO 0.00 1.34 -1.13 0.45 0.86 0.00 0.00 177.93 179.45 1l3n n SER 111 N -3.84 -4.95 0.27 2.45 2.88 -1.25 -4.85 113.62 104.33 1l3n n SER 111 Ca -0.10 -0.44 0.12 0.00 -1.33 0.00 0.00 58.87 57.12 1l3n n SER 111 Cb 0.86 -1.51 0.76 0.00 -0.75 0.00 0.00 64.21 63.57 1l3n n SER 111 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 1l3n h ILE 112 N 1.19 0.73 -0.93 2.46 -0.00 -1.93 -3.45 117.51 115.57 1l3n h ILE 112 Ca -0.58 -0.18 -0.71 0.00 -0.00 0.00 0.00 64.86 63.39 1l3n h ILE 112 Cb 1.35 1.11 0.06 0.00 -0.00 0.00 0.00 36.82 39.34 1l3n h ILE 112 CO 0.27 0.05 -0.09 -0.38 -0.00 0.00 0.00 178.15 178.00 1l3n n ILE 113 N -4.04 0.48 -0.87 0.16 2.08 -1.26 -2.06 119.36 113.86 1l3n n ILE 113 Ca -0.03 -0.12 0.00 0.00 0.56 0.00 0.00 62.75 63.16 1l3n n ILE 113 Cb 0.13 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.02 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 1.52 0.64 3.84 7.39 0.00 -1.14 -5.00 105.19 112.44 1l3n n GLY 114 Ca 0.18 0.00 -0.31 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 -0.13 3.37 -0.34 1.61 0.52 -0.87 -4.43 118.95 118.68 1l3n s ARG 115 Ca 0.00 0.90 -0.16 0.00 -0.52 0.00 0.00 55.73 55.95 1l3n s ARG 115 Cb 0.00 -2.05 -0.01 0.00 0.52 0.00 0.00 34.95 33.41 1l3n s ARG 115 CO 0.00 -0.75 0.42 0.99 0.02 0.00 0.00 175.30 175.98 1l3n s THR 116 N -2.98 5.12 0.13 0.02 2.01 -1.03 -0.83 115.64 118.07 1l3n s THR 116 Ca 0.57 0.19 -0.26 0.00 0.31 0.00 0.00 61.69 62.51 1l3n s THR 116 Cb -0.12 -3.86 -0.07 0.00 0.01 0.00 0.00 72.50 68.45 1l3n s THR 116 CO 0.50 -0.12 0.79 -0.76 -0.69 0.00 0.00 174.62 174.33 1l3n s LEU 117 N 2.15 4.55 -0.03 4.42 2.01 -1.20 0.24 118.68 130.82 1l3n s LEU 117 Ca 0.14 1.61 0.05 0.00 0.01 0.00 0.00 54.13 55.94 1l3n s LEU 117 Cb -0.16 -3.30 -0.01 0.00 0.01 0.00 0.00 46.19 42.73 1l3n s LEU 117 CO 0.12 0.14 -0.18 -0.69 1.01 0.00 0.00 176.35 176.75 1l3n s VAL 118 N -0.80 1.50 -0.17 -1.59 1.01 0.10 -0.81 120.40 119.65 1l3n s VAL 118 Ca 0.37 -0.78 -0.08 0.00 0.00 0.00 0.00 61.98 61.50 1l3n s VAL 118 Cb -0.22 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.84 1l3n s VAL 118 CO 0.26 0.43 0.09 0.54 0.00 0.00 0.00 175.10 176.42 1l3n s VAL 119 N -0.16 5.09 0.16 2.92 0.11 -0.29 -2.27 120.40 125.96 1l3n s VAL 119 Ca 0.00 0.07 0.05 0.00 -2.93 0.00 0.00 61.98 59.18 1l3n s VAL 119 Cb -0.10 -3.27 -0.04 0.00 -1.53 0.00 0.00 36.38 31.44 1l3n s VAL 119 CO 0.01 0.50 0.10 -1.00 -3.33 0.00 0.00 175.10 171.38 1l3n s HIS 120 N -0.04 3.08 0.12 1.54 3.76 -0.02 -2.82 115.29 120.92 1l3n s HIS 120 Ca 0.08 -0.04 -0.26 0.00 -0.15 0.00 0.00 55.06 54.69 1l3n s HIS 120 Cb -0.12 -1.49 -0.07 0.00 1.11 0.00 0.00 32.58 32.02 1l3n s HIS 120 CO 0.00 0.52 1.44 1.49 -0.85 0.00 0.00 174.74 177.34 1l3n h GLU 121 N 2.52 -0.09 -6.06 1.40 4.81 -0.85 -3.28 114.58 113.03 1l3n h GLU 121 Ca -0.47 0.01 -0.53 0.00 -0.13 0.00 0.00 59.36 58.24 1l3n h GLU 121 Cb 1.20 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.54 1l3n h GLU 121 CO 0.62 -0.06 -0.44 0.15 -0.73 0.00 0.00 179.01 178.55 1l3n s LYS 122 N -5.05 2.41 0.28 1.92 1.02 0.78 -4.86 119.74 116.23 1l3n s LYS 122 Ca -0.10 -1.64 -0.29 0.00 0.02 0.00 0.00 55.97 53.95 1l3n s LYS 122 Cb 0.08 -2.21 -0.10 0.00 -0.52 0.00 0.00 37.83 35.08 1l3n s LYS 122 CO 0.50 -0.12 1.39 0.00 -0.92 0.00 0.00 175.35 176.20 1l3n s ALA 123 N -2.51 3.58 0.51 5.17 0.00 -1.17 -0.65 121.76 126.69 1l3n s ALA 123 Ca 0.44 1.31 -0.08 0.00 0.00 0.00 0.00 51.96 53.63 1l3n s ALA 123 Cb -0.01 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 1l3n s ALA 123 CO 0.25 -0.72 0.87 0.16 0.00 0.00 0.00 175.76 176.32 1l3n s ASP 124 N 0.06 6.31 -0.15 0.00 1.47 -1.26 -4.04 116.67 119.06 1l3n s ASP 124 Ca 0.55 1.14 0.16 0.00 1.18 0.00 0.00 52.55 55.58 1l3n s ASP 124 Cb -0.41 -2.34 0.66 0.00 -0.34 0.00 0.00 42.92 40.49 1l3n s ASP 124 CO 0.47 -0.64 1.58 0.47 0.68 0.00 0.00 175.17 177.73 1l3n n ASP 125 N -2.23 4.66 -4.37 2.11 8.00 0.35 -4.94 116.55 120.13 1l3n n ASP 125 Ca 0.03 -2.68 -0.39 0.00 0.71 0.00 0.00 54.79 52.45 1l3n n ASP 125 Cb 0.55 -0.57 -0.05 0.00 -0.02 0.00 0.00 41.12 41.03 1l3n n ASP 125 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1l3n n LEU 126 N 0.52 -1.30 0.00 0.64 4.77 -1.26 -0.57 117.00 119.79 1l3n n LEU 126 Ca 0.24 -1.13 0.00 0.00 -0.03 0.00 0.00 56.01 55.09 1l3n n LEU 126 Cb 0.94 -1.86 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 1l3n n LEU 126 CO 0.23 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1l3n n GLY 127 N -1.31 0.37 0.85 -0.72 0.00 -1.09 -4.14 105.19 99.15 1l3n n GLY 127 Ca 0.07 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.10 1l3n n GLY 127 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1l3n n LYS 128 N -1.84 1.79 0.02 1.61 5.02 0.26 -4.51 118.16 120.51 1l3n n LYS 128 Ca 0.00 -3.34 -0.11 0.00 -2.02 0.00 0.00 58.31 52.84 1l3n n LYS 128 Cb 0.00 -1.72 0.02 0.00 -0.02 0.00 0.00 35.03 33.31 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 1.08 0.60 -3.03 0.72 0.00 -1.85 -3.48 103.07 97.11 1l3n h GLY 129 Ca 0.09 -0.79 -0.14 0.00 0.00 0.00 0.00 47.33 46.48 1l3n h GLY 129 CO 0.16 0.71 -0.27 0.61 0.00 0.00 0.00 176.54 177.75 1l3n n GLY 130 N 0.48 0.30 3.36 4.60 0.00 -1.26 -4.96 105.19 107.70 1l3n n GLY 130 Ca -0.05 -0.30 -0.10 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.27 0.06 0.26 1.61 0.01 -1.26 -5.00 114.94 107.35 1l3n s ASN 131 Ca 0.14 -1.13 -0.01 0.00 -0.71 0.00 0.00 52.86 51.14 1l3n s ASN 131 Cb -0.06 0.46 0.51 0.00 0.41 0.00 0.00 41.25 42.57 1l3n s ASN 131 CO 0.28 -0.95 1.77 -0.08 -1.51 0.00 0.00 177.10 176.61 1l3n h GLU 132 N 2.50 0.62 -0.14 -0.60 4.22 -2.02 -0.49 114.58 118.67 1l3n h GLU 132 Ca -0.32 -0.04 -0.04 0.00 0.08 0.00 0.00 59.36 59.05 1l3n h GLU 132 Cb 1.24 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1l3n h GLU 132 CO 0.46 0.41 -0.09 1.49 -2.18 0.00 0.00 179.01 179.11 1l3n h GLU 133 N 0.64 0.22 -0.83 1.92 4.57 -2.00 -2.74 114.58 116.36 1l3n h GLU 133 Ca 0.45 -0.04 0.19 0.00 -1.18 0.00 0.00 59.36 58.78 1l3n h GLU 133 Cb 0.62 -0.03 -0.15 0.00 -0.16 0.00 0.00 28.75 29.02 1l3n h GLU 133 CO -0.35 0.32 -0.08 1.03 -1.18 0.00 0.00 179.01 178.76 1l3n h SER 134 N 0.21 -0.55 0.36 1.04 0.87 -1.39 0.37 113.55 114.47 1l3n h SER 134 Ca 0.05 0.23 0.00 0.00 -1.23 0.00 0.00 61.79 60.84 1l3n h SER 134 Cb 0.30 0.44 0.00 0.00 -0.44 0.00 0.00 62.40 62.70 1l3n h SER 134 CO 0.02 -0.25 -0.01 1.07 -0.53 0.00 0.00 176.83 177.13 1l3n n THR 135 N -5.45 0.00 0.00 2.23 5.66 -1.03 -2.68 114.28 113.00 1l3n n THR 135 Ca 0.15 -0.01 0.00 0.00 -3.05 0.00 0.00 64.05 61.14 1l3n n THR 135 Cb 0.51 -0.46 0.00 0.00 -1.55 0.00 0.00 70.33 68.82 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 -1.16 0.00 -0.05 1.09 5.02 -0.01 -1.32 118.16 121.73 1l3n n LYS 136 Ca 0.18 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.55 1l3n n LYS 136 Cb 0.20 -0.01 0.10 0.00 -0.02 0.00 0.00 35.03 35.30 1l3n n LYS 136 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1l3n n THR 137 N -1.29 0.19 -1.32 -0.18 -2.24 -0.69 -4.52 114.28 104.23 1l3n n THR 137 Ca 0.00 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 61.19 1l3n n THR 137 Cb 0.00 1.19 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 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 0.69 2.53 3.38 0.00 -0.42 -3.73 105.19 108.61 1l3n n GLY 138 Ca 0.11 -0.72 -0.20 0.00 0.00 0.00 0.00 46.02 45.21 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 1.53 -5.44 0.02 1.61 4.13 -1.24 -0.50 115.26 115.37 1l3n n ASN 139 Ca 0.00 0.41 0.06 0.00 1.68 0.00 0.00 54.58 56.72 1l3n n ASN 139 Cb 0.28 -4.76 0.25 0.00 -1.54 0.00 0.00 39.78 34.01 1l3n n ASN 139 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1l3n n ALA 140 N 0.68 1.45 -0.17 5.41 0.00 -1.24 -4.75 120.51 121.88 1l3n n ALA 140 Ca -0.21 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1l3n n ALA 140 Cb 0.67 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.94 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 -0.48 -1.24 3.76 0.00 0.00 -1.26 -0.15 105.19 105.81 1l3n n GLY 141 Ca 0.02 -1.25 -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 -0.36 3.54 -3.46 1.61 7.64 -1.26 -4.54 113.62 116.79 1l3n n SER 142 Ca 0.00 1.22 -0.38 0.00 1.01 0.00 0.00 58.87 60.73 1l3n n SER 142 Cb 0.00 -1.59 -0.08 0.00 -1.01 0.00 0.00 64.21 61.53 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 0.48 0.62 0.22 1.43 3.00 -1.26 -0.52 116.66 120.63 1l3n n ARG 143 Ca 0.02 -1.24 0.15 0.00 -0.01 0.00 0.00 57.85 56.77 1l3n n ARG 143 Cb 0.38 -2.57 0.74 0.00 0.00 0.00 0.00 32.46 31.01 1l3n n ARG 143 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.63 179.00 1l3n h LEU 144 N 15.07 0.00 -7.16 0.55 -0.00 -1.84 -3.42 115.31 118.51 1l3n h LEU 144 Ca 0.30 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 58.10 1l3n h LEU 144 Cb 0.57 0.00 -0.19 0.00 -0.00 0.00 0.00 40.66 41.05 1l3n h LEU 144 CO 1.86 0.00 0.05 0.00 -0.00 0.00 0.00 178.44 180.35 1l3n s ALA 145 N -3.67 -1.46 0.19 0.17 0.00 -1.13 -1.61 121.76 114.26 1l3n s ALA 145 Ca -0.01 0.95 -0.15 0.00 0.00 0.00 0.00 51.96 52.75 1l3n s ALA 145 Cb 0.09 0.09 0.02 0.00 0.00 0.00 0.00 23.12 23.32 1l3n s ALA 145 CO 0.36 -0.37 0.47 0.00 0.00 0.00 0.00 175.76 176.22 1l3n n GLY 147 N -0.32 3.95 2.85 0.00 0.00 0.01 -0.82 105.19 110.85 1l3n n GLY 147 Ca -0.09 -1.52 -0.17 0.00 0.00 0.00 0.00 46.02 44.24 1l3n n GLY 147 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1l3n s VAL 148 N -1.98 0.27 0.33 1.61 1.01 -1.26 -3.24 120.40 117.13 1l3n s VAL 148 Ca 0.00 0.01 -0.29 0.00 0.00 0.00 0.00 61.98 61.71 1l3n s VAL 148 Cb 0.00 -0.34 -0.10 0.00 0.00 0.00 0.00 36.38 35.94 1l3n s VAL 148 CO 0.00 0.16 1.32 -0.63 0.00 0.00 0.00 175.10 175.95 1l3n s ILE 149 N 0.89 2.68 0.03 2.22 1.01 -0.01 -4.45 121.20 123.57 1l3n s ILE 149 Ca -0.10 0.68 0.03 0.00 0.00 0.00 0.00 60.65 61.26 1l3n s ILE 149 Cb -0.13 -3.43 -0.02 0.00 0.01 0.00 0.00 42.46 38.89 1l3n s ILE 149 CO -0.01 0.16 -0.10 -0.83 0.00 0.00 0.00 174.94 174.16 1l3n s GLY 150 N -0.42 0.58 0.61 6.18 0.00 0.22 -2.90 107.32 111.60 1l3n s GLY 150 Ca 0.50 -0.70 -0.17 0.00 0.00 0.00 0.00 44.72 44.34 1l3n s GLY 150 CO 0.53 -0.71 1.13 -0.42 0.00 0.00 0.00 173.10 173.64 1l3n s ILE 151 N -0.95 3.09 0.00 0.90 1.01 -1.26 -0.44 121.20 123.55 1l3n s ILE 151 Ca -0.03 0.60 0.00 0.00 0.00 0.00 0.00 60.65 61.22 1l3n s ILE 151 Cb -0.08 -3.17 0.00 0.00 0.01 0.00 0.00 42.46 39.23 1l3n s ILE 151 CO 0.01 -0.22 0.00 0.00 0.00 0.00 0.00 174.94 174.72 1l3n n ALA 152 N -1.86 1.76 0.00 9.38 0.00 0.14 -4.71 120.51 125.22 1l3n n ALA 152 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1l3n n ALA 152 Cb 0.51 0.15 0.00 0.00 0.00 0.00 0.00 19.45 20.12 1l3n n ALA 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50