#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 1.36 -4.04 0.00 1.03 -1.89 -3.43 112.91 105.94 1l3n h THR 2 Ca 0.00 -2.39 -0.59 0.00 -0.01 0.00 0.00 66.41 63.42 1l3n h THR 2 Cb 0.00 2.42 -0.31 0.00 -1.07 0.00 0.00 68.15 69.19 1l3n h THR 2 CO 0.00 0.72 -0.85 -0.54 -0.01 0.00 0.00 175.52 174.84 1l3n s LYS 3 N -3.27 1.89 0.16 0.00 1.02 -1.26 -0.03 119.74 118.25 1l3n s LYS 3 Ca -0.07 -0.69 -0.07 0.00 0.02 0.00 0.00 55.97 55.16 1l3n s LYS 3 Cb 0.08 -1.67 -0.02 0.00 -0.52 0.00 0.00 37.83 35.70 1l3n s LYS 3 CO 0.89 0.31 0.22 0.00 -0.92 0.00 0.00 175.35 175.85 1l3n s ALA 4 N -0.12 0.27 0.37 5.17 0.00 -0.45 -0.61 121.76 126.39 1l3n s ALA 4 Ca -0.01 -1.07 0.03 0.00 0.00 0.00 0.00 51.96 50.91 1l3n s ALA 4 Cb -0.11 0.88 -0.01 0.00 0.00 0.00 0.00 23.12 23.88 1l3n s ALA 4 CO 0.02 -0.61 0.10 1.33 0.00 0.00 0.00 175.76 176.60 1l3n n VAL 5 N -0.19 0.00 -3.38 0.00 0.24 -0.41 -0.38 118.33 114.21 1l3n n VAL 5 Ca -0.06 -2.07 -0.09 0.00 -2.04 0.00 0.00 64.34 60.08 1l3n n VAL 5 Cb 0.63 0.67 -0.08 0.00 -1.47 0.00 0.00 33.84 33.59 1l3n n VAL 5 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1l3n s ALA 6 N -2.92 -1.10 -0.51 2.33 0.00 0.12 -3.60 121.76 116.07 1l3n s ALA 6 Ca 0.14 0.97 -0.18 0.00 0.00 0.00 0.00 51.96 52.89 1l3n s ALA 6 Cb 0.01 -1.64 0.07 0.00 0.00 0.00 0.00 23.12 21.56 1l3n s ALA 6 CO 0.10 -1.21 0.58 0.14 0.00 0.00 0.00 175.76 175.37 1l3n s VAL 7 N 2.55 4.96 -0.08 0.00 -7.23 -1.25 -0.95 120.40 118.40 1l3n s VAL 7 Ca 0.11 -0.72 -0.14 0.00 -1.81 0.00 0.00 61.98 59.42 1l3n s VAL 7 Cb -0.15 -4.29 -0.05 0.00 0.56 0.00 0.00 36.38 32.45 1l3n s VAL 7 CO -0.15 -0.80 0.34 -0.76 -0.31 0.00 0.00 175.10 173.42 1l3n s LEU 8 N 2.37 4.36 0.23 1.32 1.02 0.76 -4.17 118.68 124.57 1l3n s LEU 8 Ca 0.12 0.72 -0.10 0.00 0.02 0.00 0.00 54.13 54.89 1l3n s LEU 8 Cb -0.21 -2.45 -0.01 0.00 0.02 0.00 0.00 46.19 43.53 1l3n s LEU 8 CO 0.10 0.23 0.39 -0.54 0.02 0.00 0.00 176.35 176.55 1l3n s LYS 9 N -0.36 1.44 0.00 1.70 1.02 -0.10 -0.45 119.74 122.99 1l3n s LYS 9 Ca 0.20 -1.31 0.00 0.00 0.02 0.00 0.00 55.97 54.88 1l3n s LYS 9 Cb -0.15 0.42 0.00 0.00 -0.52 0.00 0.00 37.83 37.59 1l3n s LYS 9 CO 0.08 -0.57 0.00 0.41 -0.92 0.00 0.00 175.35 174.35 1l3n n GLY 10 N -0.34 -2.05 0.20 -3.33 0.00 -1.25 -0.66 105.19 97.74 1l3n n GLY 10 Ca -0.02 0.62 -0.18 0.00 0.00 0.00 0.00 46.02 46.45 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 0.83 0.00 1.61 3.32 -1.80 -3.49 116.42 116.89 1l3n h ASP 11 Ca 0.00 -0.66 0.00 0.00 0.02 0.00 0.00 57.03 56.39 1l3n h ASP 11 Cb 0.00 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.30 1l3n h ASP 11 CO 0.00 1.36 0.00 0.61 -1.72 0.00 0.00 179.24 179.49 1l3n n GLY 12 N 0.80 2.51 1.39 2.75 0.00 -1.26 -4.95 105.19 106.43 1l3n n GLY 12 Ca -0.09 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1l3n n GLY 12 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1l3n n PRO 13 N 0.00 0.96 -3.40 1.61 -0.04 -1.26 -4.09 135.00 128.77 1l3n n PRO 13 Ca 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.33 1l3n n PRO 13 Cb 0.00 -1.02 -0.10 0.00 -0.04 0.00 0.00 33.50 32.34 1l3n n PRO 13 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1l3n s VAL 14 N 0.08 -0.49 -0.09 0.52 1.01 -1.26 -3.70 120.40 116.47 1l3n s VAL 14 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 61.83 1l3n s VAL 14 Cb 0.00 -0.80 0.02 0.00 0.00 0.00 0.00 36.38 35.60 1l3n s VAL 14 CO 0.00 -0.21 -0.07 0.00 0.00 0.00 0.00 175.10 174.82 1l3n s GLN 15 N 2.45 1.40 -0.08 2.72 0.00 0.41 -4.20 119.66 122.35 1l3n s GLN 15 Ca 0.10 -0.23 -0.01 0.00 -0.00 0.00 0.00 55.36 55.22 1l3n s GLN 15 Cb -0.15 -1.42 -0.03 0.00 0.00 0.00 0.00 33.01 31.41 1l3n s GLN 15 CO -0.18 -0.20 -0.01 0.20 0.00 0.00 0.00 175.29 175.11 1l3n s GLY 16 N 1.46 1.83 -0.36 2.60 0.00 0.40 -0.55 107.32 112.70 1l3n s GLY 16 Ca -0.00 -0.83 0.01 0.00 0.00 0.00 0.00 44.72 43.89 1l3n s GLY 16 CO -0.05 -0.60 0.23 -0.42 0.00 0.00 0.00 173.10 172.26 1l3n s ILE 17 N -0.88 0.16 -0.00 0.90 1.01 -1.21 -0.17 121.20 121.00 1l3n s ILE 17 Ca 0.13 -1.82 -0.02 0.00 0.00 0.00 0.00 60.65 58.94 1l3n s ILE 17 Cb -0.11 -1.13 -0.04 0.00 0.01 0.00 0.00 42.46 41.19 1l3n s ILE 17 CO 0.02 -1.02 0.18 -0.63 0.00 0.00 0.00 174.94 173.49 1l3n s ILE 18 N 0.95 5.39 -0.14 2.92 1.09 -0.12 -1.28 121.20 130.01 1l3n s ILE 18 Ca 0.20 -0.20 0.01 0.00 -1.10 0.00 0.00 60.65 59.56 1l3n s ILE 18 Cb -0.20 -3.53 0.02 0.00 -1.06 0.00 0.00 42.46 37.69 1l3n s ILE 18 CO -0.02 0.31 -0.15 0.20 -0.10 0.00 0.00 174.94 175.18 1l3n s ASN 19 N -1.99 2.70 -0.44 3.58 0.01 0.41 -0.71 114.94 118.51 1l3n s ASN 19 Ca 0.28 -0.50 -0.16 0.00 -0.71 0.00 0.00 52.86 51.78 1l3n s ASN 19 Cb -0.13 -1.20 0.04 0.00 0.41 0.00 0.00 41.25 40.37 1l3n s ASN 19 CO 0.19 -0.03 0.37 -0.36 -1.51 0.00 0.00 177.10 175.76 1l3n s PHE 20 N 1.34 3.22 -0.10 2.20 0.08 0.49 -1.73 117.98 123.48 1l3n s PHE 20 Ca 0.02 -0.69 -0.03 0.00 0.12 0.00 0.00 56.93 56.35 1l3n s PHE 20 Cb -0.13 -2.89 -0.04 0.00 -0.57 0.00 0.00 43.02 39.39 1l3n s PHE 20 CO -0.09 -0.70 0.04 -2.00 -0.10 0.00 0.00 175.22 172.37 1l3n s GLU 21 N 1.77 3.17 -0.32 0.44 2.12 -0.07 -1.35 118.70 124.47 1l3n s GLU 21 Ca 0.06 -0.34 0.00 0.00 0.36 0.00 0.00 54.97 55.05 1l3n s GLU 21 Cb -0.21 -2.92 0.07 0.00 0.26 0.00 0.00 34.13 31.34 1l3n s GLU 21 CO 0.09 0.68 0.02 -1.14 -0.54 0.00 0.00 175.26 174.37 1l3n s GLN 22 N -0.80 2.11 -0.47 4.30 0.74 0.96 -0.29 119.66 126.19 1l3n s GLN 22 Ca 0.13 -1.51 0.06 0.00 0.05 0.00 0.00 55.36 54.08 1l3n s GLN 22 Cb -0.12 -3.18 0.19 0.00 1.10 0.00 0.00 33.01 31.00 1l3n s GLN 22 CO 0.03 -0.75 0.59 1.17 -0.55 0.00 0.00 175.29 175.77 1l3n n LYS 23 N 4.49 0.43 -3.68 1.67 4.81 -1.26 -4.67 118.16 119.95 1l3n n LYS 23 Ca -0.08 -2.47 -0.09 0.00 -0.87 0.00 0.00 58.31 54.80 1l3n n LYS 23 Cb 0.42 -1.53 -0.03 0.00 0.02 0.00 0.00 35.03 33.91 1l3n n LYS 23 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 1l3n s GLU 24 N 0.50 1.49 0.44 1.64 -6.30 -1.26 -4.95 118.70 110.26 1l3n s GLU 24 Ca 0.31 -0.79 0.29 0.00 -2.50 0.00 0.00 54.97 52.29 1l3n s GLU 24 Cb 0.03 0.57 1.08 0.00 0.00 0.00 0.00 34.13 35.82 1l3n s GLU 24 CO -0.12 -0.66 1.85 1.03 0.02 0.00 0.00 175.26 177.39 1l3n h SER 25 N 2.07 0.00 1.04 -1.70 0.87 -2.00 -0.93 113.55 112.90 1l3n h SER 25 Ca -0.27 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 1l3n h SER 25 Cb 1.27 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 1l3n h SER 25 CO 0.33 0.00 0.00 0.59 -0.53 0.00 0.00 176.83 177.22 1l3n n ASN 26 N -2.82 0.07 -4.09 6.23 3.02 -1.26 -4.95 115.26 111.46 1l3n n ASN 26 Ca 0.02 0.51 -0.31 0.00 -0.03 0.00 0.00 54.58 54.77 1l3n n ASN 26 Cb 0.33 -0.53 -0.02 0.00 -0.61 0.00 0.00 39.78 38.95 1l3n n ASN 26 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1l3n n GLY 27 N 1.48 -0.34 3.76 7.41 0.00 -0.36 -4.93 105.19 112.21 1l3n n GLY 27 Ca 0.07 0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 1l3n n GLY 27 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1l3n s PRO 28 N -6.76 4.55 -0.70 1.61 0.04 -1.26 -4.72 135.00 127.77 1l3n s PRO 28 Ca 0.39 1.80 -0.24 0.00 0.04 0.00 0.00 61.00 62.99 1l3n s PRO 28 Cb -0.21 -3.10 0.06 0.00 0.04 0.00 0.00 34.50 31.29 1l3n s PRO 28 CO 0.91 0.14 1.06 0.08 0.04 0.00 0.00 177.00 179.22 1l3n s VAL 29 N -1.22 4.17 -0.50 -0.36 1.01 -0.10 -4.16 120.40 119.24 1l3n s VAL 29 Ca 0.46 -0.20 -0.29 0.00 0.00 0.00 0.00 61.98 61.96 1l3n s VAL 29 Cb -0.31 -4.76 0.03 0.00 0.00 0.00 0.00 36.38 31.34 1l3n s VAL 29 CO 0.40 -1.58 1.19 -0.54 0.00 0.00 0.00 175.10 174.58 1l3n s LYS 30 N 4.49 3.65 -0.59 2.72 1.02 0.60 -0.64 119.74 130.98 1l3n s LYS 30 Ca 0.26 0.54 -0.13 0.00 0.02 0.00 0.00 55.97 56.66 1l3n s LYS 30 Cb -0.14 -3.95 0.15 0.00 -0.52 0.00 0.00 37.83 33.37 1l3n s LYS 30 CO 0.10 -1.49 0.52 0.54 -0.92 0.00 0.00 175.35 174.11 1l3n s VAL 31 N 4.74 4.97 0.43 3.17 0.11 0.89 -0.89 120.40 133.81 1l3n s VAL 31 Ca 0.49 -1.88 0.07 0.00 -2.93 0.00 0.00 61.98 57.73 1l3n s VAL 31 Cb -0.08 -4.18 -0.05 0.00 -1.53 0.00 0.00 36.38 30.54 1l3n s VAL 31 CO 0.31 -0.88 0.12 -1.66 -3.33 0.00 0.00 175.10 169.65 1l3n s TRP 32 N 1.12 2.45 -4.19 1.54 -2.14 -0.70 -1.09 118.94 115.93 1l3n s TRP 32 Ca 0.08 -0.66 0.00 0.00 2.66 0.00 0.00 56.10 58.17 1l3n s TRP 32 Cb -0.24 -1.87 0.00 0.00 -3.10 0.00 0.00 33.47 28.26 1l3n s TRP 32 CO -0.01 0.23 0.00 0.41 -2.66 0.00 0.00 176.95 174.92 1l3n n GLY 33 N -1.19 -0.97 3.00 3.67 0.00 0.33 -0.44 105.19 109.59 1l3n n GLY 33 Ca -0.04 -1.10 -0.04 0.00 0.00 0.00 0.00 46.02 44.84 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 -4.00 -0.37 0.96 1.61 0.01 -0.40 -0.96 113.70 110.55 1l3n s SER 34 Ca 0.00 0.34 -0.16 0.00 1.31 0.00 0.00 55.95 57.44 1l3n s SER 34 Cb 0.00 1.50 0.20 0.00 0.21 0.00 0.00 66.02 67.93 1l3n s SER 34 CO 0.00 -0.30 1.32 0.27 0.41 0.00 0.00 173.24 174.94 1l3n s ILE 35 N 2.66 1.99 0.03 1.44 -4.36 -1.04 -3.35 121.20 118.59 1l3n s ILE 35 Ca 0.15 0.00 -0.19 0.00 -0.26 0.00 0.00 60.65 60.35 1l3n s ILE 35 Cb -0.14 -2.99 0.04 0.00 1.25 0.00 0.00 42.46 40.61 1l3n s ILE 35 CO -0.20 0.00 0.43 -0.75 0.24 0.00 0.00 174.94 174.66 1l3n s LYS 36 N -5.87 0.91 0.00 0.37 2.47 0.29 -3.83 119.74 114.07 1l3n s LYS 36 Ca 0.74 -0.29 0.00 0.00 -1.56 0.00 0.00 55.97 54.85 1l3n s LYS 36 Cb -0.04 0.41 0.00 0.00 -1.46 0.00 0.00 37.83 36.74 1l3n s LYS 36 CO 0.53 -0.31 0.00 0.41 0.16 0.00 0.00 175.35 176.14 1l3n n GLY 37 N 0.61 2.78 3.42 5.54 0.00 -1.09 -0.45 105.19 116.01 1l3n n GLY 37 Ca -0.19 -1.02 -0.30 0.00 0.00 0.00 0.00 46.02 44.51 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 -0.27 0.28 0.99 1.02 -1.24 -4.54 118.68 114.92 1l3n s LEU 38 Ca 0.00 0.88 0.07 0.00 0.02 0.00 0.00 54.13 55.09 1l3n s LEU 38 Cb 0.00 -2.47 -0.03 0.00 0.02 0.00 0.00 46.19 43.71 1l3n s LEU 38 CO 0.00 -4.80 0.30 0.28 0.02 0.00 0.00 176.35 172.15 1l3n s THR 39 N -2.53 4.36 0.72 5.49 -1.32 -1.26 -2.43 115.64 118.66 1l3n s THR 39 Ca 0.69 -1.23 -0.16 0.00 -1.21 0.00 0.00 61.69 59.78 1l3n s THR 39 Cb -0.14 -3.46 -0.03 0.00 -1.51 0.00 0.00 72.50 67.36 1l3n s THR 39 CO 0.58 -0.27 0.63 1.21 -2.21 0.00 0.00 174.62 174.56 1l3n n GLU 40 N -1.36 0.35 0.00 7.08 2.13 -1.25 -4.75 120.64 122.85 1l3n n GLU 40 Ca -0.05 0.16 0.00 0.00 0.66 0.00 0.00 57.16 57.93 1l3n n GLU 40 Cb 0.58 -1.91 0.00 0.00 0.27 0.00 0.00 31.44 30.38 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 -1.72 3.80 8.31 0.00 -0.86 -4.88 105.19 111.35 1l3n n GLY 41 Ca 0.11 -2.15 -0.34 0.00 0.00 0.00 0.00 46.02 43.64 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 3.75 0.01 0.99 2.01 -1.26 -0.56 118.68 123.62 1l3n s LEU 42 Ca 0.00 1.91 -0.15 0.00 0.01 0.00 0.00 54.13 55.89 1l3n s LEU 42 Cb 0.00 -4.55 0.02 0.00 0.01 0.00 0.00 46.19 41.67 1l3n s LEU 42 CO 0.00 -0.89 0.32 -1.00 1.01 0.00 0.00 176.35 175.79 1l3n s HIS 43 N -2.10 -0.17 -0.07 0.29 3.76 0.13 -3.85 115.29 113.28 1l3n s HIS 43 Ca 0.66 0.19 -0.39 0.00 -0.15 0.00 0.00 55.06 55.37 1l3n s HIS 43 Cb -0.16 0.11 -0.18 0.00 1.11 0.00 0.00 32.58 33.46 1l3n s HIS 43 CO 0.25 -0.44 1.36 0.41 -0.85 0.00 0.00 174.74 175.46 1l3n n GLY 44 N 0.99 0.28 3.05 -2.22 0.00 0.14 -1.02 105.19 106.42 1l3n n GLY 44 Ca -0.20 0.79 -0.04 0.00 0.00 0.00 0.00 46.02 46.57 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 1.15 -1.12 0.23 1.61 2.19 -1.26 -0.91 117.98 119.87 1l3n s PHE 45 Ca 0.91 1.26 -0.17 0.00 0.33 0.00 0.00 56.93 59.26 1l3n s PHE 45 Cb -1.13 0.27 0.02 0.00 -1.31 0.00 0.00 43.02 40.86 1l3n s PHE 45 CO 0.57 -0.75 0.55 -1.01 1.83 0.00 0.00 175.22 176.41 1l3n s HIS 46 N 2.67 0.02 0.29 10.12 0.09 -0.89 -2.70 115.29 124.91 1l3n s HIS 46 Ca 0.14 -0.40 -0.15 0.00 -0.00 0.00 0.00 55.06 54.65 1l3n s HIS 46 Cb -0.15 0.40 -0.09 0.00 -0.00 0.00 0.00 32.58 32.75 1l3n s HIS 46 CO -0.17 -1.02 0.71 0.14 -0.00 0.00 0.00 174.74 174.39 1l3n s VAL 47 N -3.93 4.70 0.33 -0.90 -7.23 -0.59 -0.78 120.40 111.99 1l3n s VAL 47 Ca 0.14 0.93 0.10 0.00 -1.81 0.00 0.00 61.98 61.33 1l3n s VAL 47 Cb -0.02 -3.65 -0.06 0.00 0.56 0.00 0.00 36.38 33.22 1l3n s VAL 47 CO 0.03 -0.11 -0.05 -1.00 -0.31 0.00 0.00 175.10 173.67 1l3n s HIS 48 N -1.89 2.48 0.13 2.82 3.76 0.32 -4.82 115.29 118.09 1l3n s HIS 48 Ca 0.51 -0.43 -0.25 0.00 -0.15 0.00 0.00 55.06 54.74 1l3n s HIS 48 Cb -0.11 -1.38 -0.03 0.00 1.11 0.00 0.00 32.58 32.17 1l3n s HIS 48 CO 0.18 0.55 1.62 1.05 -0.85 0.00 0.00 174.74 177.30 1l3n h GLU 49 N 1.93 -0.37 0.00 1.40 4.11 -1.59 -3.38 114.58 116.69 1l3n h GLU 49 Ca -0.42 0.02 -0.47 0.00 0.07 0.00 0.00 59.36 58.56 1l3n h GLU 49 Cb 1.25 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.57 1l3n h GLU 49 CO 0.67 -0.24 -0.18 1.19 0.07 0.00 0.00 179.01 180.52 1l3n n PHE 50 N -5.39 -1.26 -1.32 2.06 3.72 0.61 -4.81 117.46 111.07 1l3n n PHE 50 Ca -0.04 -1.97 0.00 0.00 -0.05 0.00 0.00 57.45 55.40 1l3n n PHE 50 Cb 0.31 -0.42 0.00 0.00 -0.94 0.00 0.00 39.48 38.43 1l3n n PHE 50 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1l3n n GLY 51 N -0.90 -1.66 3.76 1.37 0.00 -0.86 -0.82 105.19 106.08 1l3n n GLY 51 Ca 0.04 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 1l3n n GLY 51 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1l3n s ASP 52 N -0.38 4.96 0.00 1.61 -4.77 -1.26 -4.53 116.67 112.30 1l3n s ASP 52 Ca 0.00 2.18 0.04 0.00 -3.30 0.00 0.00 52.55 51.47 1l3n s ASP 52 Cb 0.00 -2.57 0.06 0.00 -1.09 0.00 0.00 42.92 39.32 1l3n s ASP 52 CO 0.00 -1.74 0.85 0.59 0.70 0.00 0.00 175.17 175.58 1l3n n ASN 53 N -2.21 0.02 -0.34 2.11 5.03 -1.26 -1.31 115.26 117.31 1l3n n ASN 53 Ca 0.12 -1.66 0.19 0.00 0.87 0.00 0.00 54.58 54.10 1l3n n ASN 53 Cb 0.51 -0.09 0.43 0.00 -1.02 0.00 0.00 39.78 39.61 1l3n n ASN 53 CO 0.00 0.00 0.00 0.74 -1.83 0.00 0.00 177.26 176.17 1l3n h THR 54 N 6.09 0.56 0.00 3.41 2.02 -1.96 0.16 112.91 123.18 1l3n h THR 54 Ca -0.10 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.90 1l3n h THR 54 Cb 1.33 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 1l3n h THR 54 CO -0.02 0.10 0.00 0.00 0.37 0.00 0.00 175.52 175.97 1l3n h ALA 55 N 1.67 1.00 0.00 6.16 0.00 -1.98 -3.48 119.26 122.63 1l3n h ALA 55 Ca 0.61 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.52 1l3n h ALA 55 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1l3n h ALA 55 CO -0.38 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.28 1l3n n GLY 56 N 0.80 2.43 2.75 0.00 0.00 0.55 -4.87 105.19 106.85 1l3n n GLY 56 Ca 0.03 -0.69 -0.08 0.00 0.00 0.00 0.00 46.02 45.28 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 1.66 0.00 -0.34 0.00 -1.04 -1.26 -4.82 114.28 108.48 1l3n n THR 58 Ca 0.09 0.00 0.19 0.00 -2.04 0.00 0.00 64.05 62.29 1l3n n THR 58 Cb 0.63 0.00 0.43 0.00 -1.82 0.00 0.00 70.33 69.57 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 0.60 -0.36 8.00 0.02 -1.90 -0.93 113.55 118.99 1l3n h SER 59 Ca 0.00 0.11 0.14 0.00 -0.84 0.00 0.00 61.79 61.20 1l3n h SER 59 Cb 0.00 0.02 -0.06 0.00 0.14 0.00 0.00 62.40 62.50 1l3n h SER 59 CO 0.00 0.11 0.15 0.00 -1.14 0.00 0.00 176.83 175.95 1l3n n ALA 60 N -2.37 0.32 0.00 3.77 0.00 -0.42 -4.79 120.51 117.02 1l3n n ALA 60 Ca 0.26 0.37 0.00 0.00 0.00 0.00 0.00 53.44 54.07 1l3n n ALA 60 Cb 0.79 -0.34 0.00 0.00 0.00 0.00 0.00 19.45 19.89 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 -1.11 1.81 0.00 0.00 0.00 -0.35 -0.29 105.19 105.24 1l3n n GLY 61 Ca 0.12 -1.89 0.00 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 1.77 3.05 -1.64 1.61 -0.04 -1.26 -4.50 135.00 133.98 1l3n n PRO 62 Ca 0.00 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.12 1l3n n PRO 62 Cb 0.00 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 33.52 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 -1.50 0.54 8.25 -1.26 -2.56 115.22 121.81 1l3n n HIS 63 Ca 0.00 -2.76 -0.41 0.00 -0.26 0.00 0.00 57.72 54.29 1l3n n HIS 63 Cb 0.00 -1.15 -0.04 0.00 1.12 0.00 0.00 29.99 29.92 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 -0.77 2.56 -1.34 4.41 3.72 -1.26 -4.86 117.46 119.92 1l3n n PHE 64 Ca 0.57 -2.11 -0.34 0.00 -0.05 0.00 0.00 57.45 55.52 1l3n n PHE 64 Cb 0.61 -2.09 0.10 0.00 -0.94 0.00 0.00 39.48 37.16 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 4.71 4.06 0.05 4.37 4.22 -1.26 -4.75 114.94 126.35 1l3n s ASN 65 Ca 0.56 2.31 -0.22 0.00 -2.14 0.00 0.00 52.86 53.37 1l3n s ASN 65 Cb 0.12 -2.58 -0.14 0.00 1.28 0.00 0.00 41.25 39.93 1l3n s ASN 65 CO 0.07 -2.35 1.46 1.55 -2.04 0.00 0.00 177.10 175.79 1l3n h PRO 66 N -0.51 0.22 -4.14 3.55 0.13 -1.92 -3.30 132.00 126.02 1l3n h PRO 66 Ca -0.47 -0.07 -0.64 0.00 -0.87 0.00 0.00 66.00 63.95 1l3n h PRO 66 Cb 1.29 -0.02 0.02 0.00 0.13 0.00 0.00 31.00 32.42 1l3n h PRO 66 CO 0.49 0.48 2.66 1.47 -0.23 0.00 0.00 178.00 182.87 1l3n n LEU 67 N -4.77 5.23 -4.43 1.56 -0.00 -1.26 -4.90 117.00 108.42 1l3n n LEU 67 Ca -0.06 -3.33 -0.46 0.00 -0.00 0.00 0.00 56.01 52.16 1l3n n LEU 67 Cb 0.22 -1.29 -0.14 0.00 -0.00 0.00 0.00 43.42 42.21 1l3n n LEU 67 CO 0.36 0.30 2.08 -0.24 -0.00 0.00 0.00 177.39 179.89 1l3n n SER 68 N 6.50 0.51 -4.19 1.45 2.88 -1.25 -4.92 113.62 114.60 1l3n n SER 68 Ca 0.51 0.30 -0.24 0.00 -1.33 0.00 0.00 58.87 58.11 1l3n n SER 68 Cb 0.36 -0.94 -0.09 0.00 -0.75 0.00 0.00 64.21 62.79 1l3n n SER 68 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1l3n s ARG 69 N 8.12 1.81 -0.89 -1.46 0.52 -1.26 -5.11 118.95 120.68 1l3n s ARG 69 Ca 1.30 -2.07 -0.06 0.00 -0.52 0.00 0.00 55.73 54.38 1l3n s ARG 69 Cb -1.28 -0.61 0.22 0.00 0.52 0.00 0.00 34.95 33.80 1l3n s ARG 69 CO 0.53 -0.40 0.80 0.15 0.02 0.00 0.00 175.30 176.40 1l3n s LYS 70 N -3.78 3.44 0.00 3.54 -0.14 -1.15 -4.84 119.74 116.82 1l3n s LYS 70 Ca 0.28 -2.97 0.00 0.00 -1.36 0.00 0.00 55.97 51.93 1l3n s LYS 70 Cb 0.04 -4.16 0.00 0.00 -1.68 0.00 0.00 37.83 32.03 1l3n s LYS 70 CO 0.15 -1.25 0.00 1.58 -0.76 0.00 0.00 175.35 175.07 1l3n n HIS 71 N 2.96 0.00 -3.46 3.18 -0.00 -1.06 -4.64 115.22 112.20 1l3n n HIS 71 Ca 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.90 1l3n n HIS 71 Cb 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.39 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 0.29 6.09 0.00 1.57 0.00 -0.24 -1.16 105.19 111.73 1l3n n GLY 72 Ca 0.00 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.94 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 4.68 -0.68 0.00 -0.02 0.00 -1.18 -4.38 105.19 103.62 1l3n n GLY 73 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 0.21 -0.10 1.61 -0.04 -1.26 -0.91 135.00 134.51 1l3n n PRO 74 Ca 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 1l3n n PRO 74 Cb 0.00 -1.02 -0.15 0.00 -0.04 0.00 0.00 33.50 32.29 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 -0.52 0.78 -3.99 0.54 4.76 -1.26 -5.06 118.16 113.40 1l3n n LYS 75 Ca 0.00 0.01 -0.09 0.00 -2.87 0.00 0.00 58.31 55.37 1l3n n LYS 75 Cb 0.00 -1.50 -0.10 0.00 -1.84 0.00 0.00 35.03 31.59 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 -5.55 0.29 0.47 4.39 -1.08 -0.08 -5.03 116.67 110.09 1l3n s ASP 76 Ca -0.13 -0.66 0.27 0.00 -0.52 0.00 0.00 52.55 51.50 1l3n s ASP 76 Cb 0.06 0.18 0.74 0.00 -1.46 0.00 0.00 42.92 42.44 1l3n s ASP 76 CO 0.77 -0.47 1.75 -0.08 0.52 0.00 0.00 175.17 177.66 1l3n h GLU 77 N 3.81 0.00 -1.09 4.34 4.81 -1.97 -3.11 114.58 121.38 1l3n h GLU 77 Ca -0.33 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.89 1l3n h GLU 77 Cb 1.18 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 1l3n h GLU 77 CO 0.52 0.04 0.01 0.39 -0.73 0.00 0.00 179.01 179.25 1l3n n GLU 78 N -3.12 1.02 -1.73 1.92 -0.58 -1.26 -4.89 120.64 112.00 1l3n n GLU 78 Ca 0.02 -0.06 -0.42 0.00 -0.42 0.00 0.00 57.16 56.29 1l3n n GLU 78 Cb 0.45 -1.02 -0.01 0.00 -0.57 0.00 0.00 31.44 30.29 1l3n n GLU 78 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 1l3n n ARG 79 N 0.56 2.38 0.09 3.49 0.00 -1.23 -1.08 116.66 120.88 1l3n n ARG 79 Ca 0.01 0.84 -0.05 0.00 -0.00 0.00 0.00 57.85 58.65 1l3n n ARG 79 Cb 0.52 -2.51 -0.02 0.00 -0.00 0.00 0.00 32.46 30.45 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 3.17 -0.30 0.00 2.89 3.86 -1.88 -3.44 115.15 119.44 1l3n h HIS 80 Ca -0.48 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.73 1l3n h HIS 80 Cb 1.26 0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.83 1l3n h HIS 80 CO 0.53 -0.19 0.00 1.33 0.86 0.00 0.00 177.93 180.46 1l3n n VAL 81 N -4.71 0.00 -1.38 2.45 0.24 -1.26 -4.86 118.33 108.81 1l3n n VAL 81 Ca -0.04 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.83 1l3n n VAL 81 Cb 0.13 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.46 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 3.33 3.37 7.63 0.00 -1.26 -4.82 105.19 113.43 1l3n n GLY 82 Ca 0.00 -1.40 -0.46 0.00 0.00 0.00 0.00 46.02 44.16 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 4.26 6.54 0.42 1.61 1.01 -1.26 -1.54 116.67 127.71 1l3n s ASP 83 Ca 0.53 -2.14 0.14 0.00 0.71 0.00 0.00 52.55 51.79 1l3n s ASP 83 Cb 0.14 -2.28 0.92 0.00 1.01 0.00 0.00 42.92 42.71 1l3n s ASP 83 CO 0.03 -0.86 1.93 -0.07 0.21 0.00 0.00 175.17 176.42 1l3n h LEU 84 N 9.10 0.00 0.00 1.23 3.38 -1.83 -3.39 115.31 123.79 1l3n h LEU 84 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1l3n h LEU 84 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1l3n h LEU 84 CO 0.95 0.25 0.00 0.61 0.09 0.00 0.00 178.44 180.34 1l3n n GLY 85 N -0.78 2.11 2.71 0.83 0.00 -1.25 -4.44 105.19 104.37 1l3n n GLY 85 Ca -0.02 -0.64 -0.20 0.00 0.00 0.00 0.00 46.02 45.16 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 -3.92 1.74 -0.17 1.61 0.02 -1.26 -3.94 114.94 109.02 1l3n s ASN 86 Ca 0.00 -0.43 -0.06 0.00 -1.02 0.00 0.00 52.86 51.35 1l3n s ASN 86 Cb 0.00 0.24 -0.04 0.00 0.02 0.00 0.00 41.25 41.47 1l3n s ASN 86 CO 0.00 -0.35 0.03 0.68 0.02 0.00 0.00 177.10 177.48 1l3n s VAL 87 N 2.28 4.47 -0.21 1.60 -7.23 -0.19 -4.78 120.40 116.34 1l3n s VAL 87 Ca 0.07 -0.15 -0.20 0.00 -1.81 0.00 0.00 61.98 59.89 1l3n s VAL 87 Cb -0.16 -2.99 -0.03 0.00 0.56 0.00 0.00 36.38 33.77 1l3n s VAL 87 CO -0.16 0.48 0.58 -0.89 -0.31 0.00 0.00 175.10 174.80 1l3n s THR 88 N 0.26 5.05 -0.11 5.32 2.01 -1.26 0.18 115.64 127.09 1l3n s THR 88 Ca 0.01 1.06 -0.04 0.00 0.31 0.00 0.00 61.69 63.04 1l3n s THR 88 Cb -0.13 -3.89 -0.04 0.00 0.01 0.00 0.00 72.50 68.45 1l3n s THR 88 CO 0.01 0.12 0.03 0.00 -0.69 0.00 0.00 174.62 174.10 1l3n s ALA 89 N 1.91 3.39 1.21 7.40 0.00 0.28 -3.98 121.76 131.97 1l3n s ALA 89 Ca 0.26 -0.77 -0.15 0.00 0.00 0.00 0.00 51.96 51.30 1l3n s ALA 89 Cb -0.16 -1.63 0.30 0.00 0.00 0.00 0.00 23.12 21.63 1l3n s ALA 89 CO 0.10 0.51 1.01 0.34 0.00 0.00 0.00 175.76 177.72 1l3n s ASP 90 N -0.65 0.60 0.54 0.00 2.15 -0.09 -2.03 116.67 117.20 1l3n s ASP 90 Ca 0.11 1.32 0.25 0.00 0.43 0.00 0.00 52.55 54.66 1l3n s ASP 90 Cb -0.12 -2.03 1.43 0.00 -0.30 0.00 0.00 42.92 41.90 1l3n s ASP 90 CO 0.02 -4.40 2.03 0.07 -0.17 0.00 0.00 175.17 172.72 1l3n h LYS 91 N -2.76 0.00 0.00 4.34 -0.00 -1.91 0.18 116.57 116.42 1l3n h LYS 91 Ca -0.59 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.06 1l3n h LYS 91 Cb 1.34 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.57 1l3n h LYS 91 CO 0.47 0.00 0.00 -3.47 -0.00 0.00 0.00 179.45 176.45 1l3n n ASP 92 N -4.26 0.00 0.00 7.07 2.03 -1.26 -4.59 116.55 115.54 1l3n n ASP 92 Ca 0.06 -0.36 0.00 0.00 0.52 0.00 0.00 54.79 55.02 1l3n n ASP 92 Cb 0.49 -0.20 0.00 0.00 -0.72 0.00 0.00 41.12 40.69 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 0.99 0.84 3.56 0.27 0.00 0.64 -2.66 105.19 108.83 1l3n n GLY 93 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.08 3.74 -0.31 1.61 1.01 -1.25 -3.75 120.40 118.36 1l3n s VAL 94 Ca 0.00 0.48 -0.15 0.00 0.00 0.00 0.00 61.98 62.31 1l3n s VAL 94 Cb 0.00 -4.77 -0.02 0.00 0.00 0.00 0.00 36.38 31.59 1l3n s VAL 94 CO 0.00 -1.65 0.37 0.00 0.00 0.00 0.00 175.10 173.82 1l3n s ALA 95 N 5.94 3.52 -0.56 5.51 0.00 -1.25 -0.91 121.76 134.01 1l3n s ALA 95 Ca 0.40 -1.05 -0.28 0.00 0.00 0.00 0.00 51.96 51.04 1l3n s ALA 95 Cb -0.09 -2.78 0.03 0.00 0.00 0.00 0.00 23.12 20.28 1l3n s ALA 95 CO 0.18 -0.91 1.17 0.16 0.00 0.00 0.00 175.76 176.36 1l3n s ASP 96 N 1.71 6.47 -0.11 0.00 -4.77 -1.26 -2.49 116.67 116.23 1l3n s ASP 96 Ca 0.13 0.15 -0.13 0.00 -3.30 0.00 0.00 52.55 49.40 1l3n s ASP 96 Cb -0.16 -2.55 -0.05 0.00 -1.09 0.00 0.00 42.92 39.07 1l3n s ASP 96 CO 0.11 -1.43 0.29 -0.69 0.70 0.00 0.00 175.17 174.15 1l3n s VAL 97 N 4.81 5.28 -0.51 2.11 1.01 -0.14 -4.85 120.40 128.12 1l3n s VAL 97 Ca 0.43 0.55 0.07 0.00 0.00 0.00 0.00 61.98 63.02 1l3n s VAL 97 Cb -0.08 -3.60 0.19 0.00 0.00 0.00 0.00 36.38 32.89 1l3n s VAL 97 CO 0.26 0.48 0.71 -1.54 0.00 0.00 0.00 175.10 175.01 1l3n n SER 98 N 2.83 -3.15 -4.49 3.32 3.41 -1.25 -0.51 113.62 113.77 1l3n n SER 98 Ca -0.14 -2.91 -0.24 0.00 -0.26 0.00 0.00 58.87 55.32 1l3n n SER 98 Cb 0.53 1.56 -0.10 0.00 -0.26 0.00 0.00 64.21 65.93 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 0.77 2.01 0.01 -1.33 1.09 -0.25 -4.96 121.20 118.56 1l3n s ILE 99 Ca 0.30 -2.19 0.01 0.00 -1.10 0.00 0.00 60.65 57.68 1l3n s ILE 99 Cb 0.02 -2.55 -0.01 0.00 -1.06 0.00 0.00 42.46 38.87 1l3n s ILE 99 CO -0.08 -0.25 -0.04 -1.83 -0.10 0.00 0.00 174.94 172.64 1l3n s GLU 100 N -3.65 0.31 -0.40 2.79 -1.05 -1.26 -0.08 118.70 115.35 1l3n s GLU 100 Ca 0.31 -0.38 -0.06 0.00 -0.15 0.00 0.00 54.97 54.68 1l3n s GLU 100 Cb 0.03 -0.14 0.08 0.00 -0.44 0.00 0.00 34.13 33.66 1l3n s GLU 100 CO 0.14 0.03 0.21 -0.51 0.95 0.00 0.00 175.26 176.08 1l3n s ASP 101 N -0.79 5.43 -0.59 0.83 1.01 0.18 -4.95 116.67 117.80 1l3n s ASP 101 Ca -0.06 -1.62 -0.05 0.00 0.71 0.00 0.00 52.55 51.52 1l3n s ASP 101 Cb -0.05 -1.90 -0.04 0.00 1.01 0.00 0.00 42.92 41.93 1l3n s ASP 101 CO -0.00 -0.50 2.99 -1.54 0.21 0.00 0.00 175.17 176.32 1l3n n SER 102 N 4.79 6.62 0.00 0.27 3.41 -1.26 -0.93 113.62 126.51 1l3n n SER 102 Ca -0.08 -2.91 0.00 0.00 -0.26 0.00 0.00 58.87 55.62 1l3n n SER 102 Cb 0.42 -1.35 0.00 0.00 -0.26 0.00 0.00 64.21 63.03 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 1.79 0.00 -1.53 -3.33 3.14 -1.26 -4.99 118.33 112.15 1l3n n VAL 103 Ca 0.53 0.00 -0.33 0.00 -2.96 0.00 0.00 64.34 61.58 1l3n n VAL 103 Cb 0.58 -0.05 0.07 0.00 -1.06 0.00 0.00 33.84 33.38 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 -1.95 2.84 -0.18 1.55 -1.09 -1.24 -5.05 121.20 116.09 1l3n s ILE 104 Ca 0.00 0.38 -0.15 0.00 -2.23 0.00 0.00 60.65 58.65 1l3n s ILE 104 Cb 0.00 -2.88 0.05 0.00 -1.58 0.00 0.00 42.46 38.05 1l3n s ILE 104 CO 0.00 -0.25 0.47 -0.44 -1.23 0.00 0.00 174.94 173.49 1l3n s SER 105 N -2.46 -0.52 -0.34 3.58 0.01 -1.26 -3.97 113.70 108.73 1l3n s SER 105 Ca 0.69 0.97 -0.05 0.00 1.31 0.00 0.00 55.95 58.87 1l3n s SER 105 Cb -0.23 0.94 -0.15 0.00 0.21 0.00 0.00 66.02 66.80 1l3n s SER 105 CO 0.45 -0.17 2.54 0.18 0.41 0.00 0.00 173.24 176.64 1l3n n LEU 106 N 3.21 4.29 0.00 2.44 4.77 -1.26 -4.38 117.00 126.07 1l3n n LEU 106 Ca -0.16 -2.61 0.00 0.00 -0.03 0.00 0.00 56.01 53.21 1l3n n LEU 106 Cb 0.57 -1.04 0.00 0.00 -2.33 0.00 0.00 43.42 40.61 1l3n n LEU 106 CO 0.10 1.00 0.00 -1.20 -1.33 0.00 0.00 177.39 175.95 1l3n n SER 107 N 3.08 0.00 -0.04 -1.43 7.64 -1.26 -1.67 113.62 119.94 1l3n n SER 107 Ca 0.37 -0.52 -0.01 0.00 1.01 0.00 0.00 58.87 59.72 1l3n n SER 107 Cb 0.48 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.57 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 -0.69 0.22 0.23 0.00 -1.26 -3.27 105.19 105.42 1l3n n GLY 108 Ca 0.00 -0.29 -0.11 0.00 0.00 0.00 0.00 46.02 45.62 1l3n n GLY 108 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1l3n h ASP 109 N 0.00 -0.40 0.20 1.61 5.19 -1.97 -3.33 116.42 117.72 1l3n h ASP 109 Ca -0.21 -0.14 -0.35 0.00 -0.62 0.00 0.00 57.03 55.71 1l3n h ASP 109 Cb 1.35 0.10 -0.00 0.00 0.18 0.00 0.00 39.33 40.96 1l3n h ASP 109 CO 0.01 0.04 -1.81 0.45 -3.12 0.00 0.00 179.24 174.81 1l3n h HIS 110 N -0.98 0.60 -4.74 4.55 3.86 -1.87 -3.49 115.15 113.08 1l3n h HIS 110 Ca -0.05 -0.44 -0.24 0.00 -1.16 0.00 0.00 60.37 58.48 1l3n h HIS 110 Cb 0.51 -0.02 0.01 0.00 1.06 0.00 0.00 27.41 28.97 1l3n h HIS 110 CO 0.03 1.67 -0.72 0.45 0.86 0.00 0.00 177.93 180.22 1l3n n SER 111 N -3.53 -3.21 -2.73 2.45 2.88 -1.20 -4.79 113.62 103.48 1l3n n SER 111 Ca -0.26 -0.11 -0.23 0.00 -1.33 0.00 0.00 58.87 56.94 1l3n n SER 111 Cb 1.06 -0.94 -0.08 0.00 -0.75 0.00 0.00 64.21 63.51 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 -0.15 3.13 -0.02 2.46 -0.00 -1.26 -3.48 119.36 120.04 1l3n n ILE 112 Ca -0.06 -1.76 -0.03 0.00 -0.00 0.00 0.00 62.75 60.90 1l3n n ILE 112 Cb 0.41 -2.21 -0.01 0.00 -0.00 0.00 0.00 39.64 37.83 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 3.26 0.17 1.02 7.28 2.08 -1.26 -4.73 119.36 127.18 1l3n n ILE 113 Ca 0.53 -0.05 0.05 0.00 0.56 0.00 0.00 62.75 63.84 1l3n n ILE 113 Cb 0.45 -1.46 0.13 0.00 -0.75 0.00 0.00 39.64 38.02 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 2.85 0.45 3.92 7.39 0.00 -1.23 -3.67 105.19 114.90 1l3n n GLY 114 Ca -0.06 -0.33 -0.26 0.00 0.00 0.00 0.00 46.02 45.37 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 -1.60 3.26 -0.10 1.61 1.81 -1.26 -2.02 118.95 120.65 1l3n s ARG 115 Ca 0.20 -0.00 -0.04 0.00 -1.72 0.00 0.00 55.73 54.17 1l3n s ARG 115 Cb 0.11 -2.39 -0.04 0.00 -0.45 0.00 0.00 34.95 32.18 1l3n s ARG 115 CO 0.13 -0.36 0.06 0.99 -0.68 0.00 0.00 175.30 175.45 1l3n s THR 116 N -2.77 4.84 0.02 0.02 2.01 0.00 -3.18 115.64 116.59 1l3n s THR 116 Ca 0.49 -0.06 -0.16 0.00 0.31 0.00 0.00 61.69 62.28 1l3n s THR 116 Cb -0.10 -3.08 -0.06 0.00 0.01 0.00 0.00 72.50 69.27 1l3n s THR 116 CO 0.43 0.60 0.45 -0.76 -0.69 0.00 0.00 174.62 174.65 1l3n s LEU 117 N -0.99 4.49 -0.04 4.42 2.01 0.41 -0.52 118.68 128.45 1l3n s LEU 117 Ca 0.14 1.04 0.04 0.00 0.01 0.00 0.00 54.13 55.36 1l3n s LEU 117 Cb -0.12 -2.68 -0.00 0.00 0.01 0.00 0.00 46.19 43.40 1l3n s LEU 117 CO 0.04 0.31 -0.17 -0.69 1.01 0.00 0.00 176.35 176.84 1l3n s VAL 118 N -1.10 1.44 -0.18 -1.59 1.01 0.04 -0.90 120.40 119.12 1l3n s VAL 118 Ca 0.25 -0.72 -0.06 0.00 0.00 0.00 0.00 61.98 61.45 1l3n s VAL 118 Cb -0.17 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 1l3n s VAL 118 CO 0.15 0.41 0.03 0.54 0.00 0.00 0.00 175.10 176.23 1l3n s VAL 119 N 0.02 4.50 0.23 2.92 0.11 -0.39 -2.09 120.40 125.70 1l3n s VAL 119 Ca -0.03 -0.14 0.09 0.00 -2.93 0.00 0.00 61.98 58.97 1l3n s VAL 119 Cb -0.11 -3.02 -0.04 0.00 -1.53 0.00 0.00 36.38 31.68 1l3n s VAL 119 CO 0.02 0.47 -0.03 -1.00 -3.33 0.00 0.00 175.10 171.22 1l3n s HIS 120 N 0.40 2.69 0.10 1.54 3.76 -0.09 -2.47 115.29 121.22 1l3n s HIS 120 Ca 0.01 -0.21 -0.20 0.00 -0.15 0.00 0.00 55.06 54.50 1l3n s HIS 120 Cb -0.13 -1.24 -0.05 0.00 1.11 0.00 0.00 32.58 32.28 1l3n s HIS 120 CO 0.01 0.58 1.32 -1.91 -0.85 0.00 0.00 174.74 173.89 1l3n n GLU 121 N -0.53 -0.29 -4.58 1.40 2.13 0.29 -3.33 120.64 115.74 1l3n n GLU 121 Ca -0.08 1.30 -0.29 0.00 0.66 0.00 0.00 57.16 58.75 1l3n n GLU 121 Cb 0.57 -1.92 -0.09 0.00 0.27 0.00 0.00 31.44 30.27 1l3n n GLU 121 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1l3n s LYS 122 N -4.68 2.08 0.18 5.31 1.02 0.26 -4.77 119.74 119.14 1l3n s LYS 122 Ca -0.08 -2.18 -0.09 0.00 0.02 0.00 0.00 55.97 53.65 1l3n s LYS 122 Cb 0.07 -1.66 -0.07 0.00 -0.52 0.00 0.00 37.83 35.65 1l3n s LYS 122 CO 0.41 -0.19 0.49 0.00 -0.92 0.00 0.00 175.35 175.13 1l3n s ALA 123 N -2.76 3.65 0.72 5.17 0.00 -1.25 0.29 121.76 127.57 1l3n s ALA 123 Ca 0.26 -0.34 -0.11 0.00 0.00 0.00 0.00 51.96 51.76 1l3n s ALA 123 Cb 0.06 -2.34 0.02 0.00 0.00 0.00 0.00 23.12 20.86 1l3n s ALA 123 CO 0.13 0.55 1.07 -0.51 0.00 0.00 0.00 175.76 177.01 1l3n s ASP 124 N -2.23 5.15 0.27 0.00 1.11 -1.25 -4.23 116.67 115.49 1l3n s ASP 124 Ca 0.43 1.57 0.12 0.00 0.18 0.00 0.00 52.55 54.85 1l3n s ASP 124 Cb -0.12 -2.40 0.31 0.00 1.07 0.00 0.00 42.92 41.78 1l3n s ASP 124 CO 0.21 -1.59 1.57 0.44 1.18 0.00 0.00 175.17 176.99 1l3n h ASP 125 N -0.82 0.00 -5.15 0.27 3.32 -1.82 -3.44 116.42 108.78 1l3n h ASP 125 Ca -0.44 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.37 1l3n h ASP 125 Cb 1.22 0.00 0.17 0.00 0.22 0.00 0.00 39.33 40.94 1l3n h ASP 125 CO 0.57 0.61 -0.73 0.18 -1.72 0.00 0.00 179.24 178.16 1l3n n LEU 126 N -3.60 -4.76 0.00 1.55 7.99 -1.26 -3.89 117.00 113.04 1l3n n LEU 126 Ca -0.00 -0.59 0.00 0.00 -0.01 0.00 0.00 56.01 55.40 1l3n n LEU 126 Cb 0.66 -2.85 0.00 0.00 -0.11 0.00 0.00 43.42 41.12 1l3n n LEU 126 CO 0.41 0.16 0.00 0.61 -1.51 0.00 0.00 177.39 177.07 1l3n n GLY 127 N -1.22 1.19 2.04 -0.72 0.00 -0.31 -4.73 105.19 101.44 1l3n n GLY 127 Ca -0.12 -0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 1l3n n GLY 127 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1l3n n LYS 128 N 0.00 1.65 -0.09 1.61 2.85 -1.25 -3.59 118.16 119.34 1l3n n LYS 128 Ca 0.00 -0.80 -0.10 0.00 -1.05 0.00 0.00 58.31 56.36 1l3n n LYS 128 Cb 0.00 -1.87 -0.13 0.00 -0.65 0.00 0.00 35.03 32.38 1l3n n LYS 128 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1l3n n GLY 129 N 2.50 -0.72 3.49 2.58 0.00 -1.26 -4.97 105.19 106.82 1l3n n GLY 129 Ca 0.34 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 1l3n n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l3n n GLY 130 N 2.06 -0.46 3.27 -0.02 0.00 -1.24 -4.95 105.19 103.85 1l3n n GLY 130 Ca -0.32 0.19 -0.15 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.59 1.57 0.12 1.61 0.01 -1.26 -4.98 114.94 108.43 1l3n s ASN 131 Ca 0.41 -1.14 -0.24 0.00 -0.71 0.00 0.00 52.86 51.19 1l3n s ASN 131 Cb -0.18 0.05 -0.05 0.00 0.41 0.00 0.00 41.25 41.47 1l3n s ASN 131 CO 0.71 -0.48 1.67 -0.08 -1.51 0.00 0.00 177.10 177.41 1l3n h GLU 132 N 2.66 -0.24 -0.76 -0.60 4.22 -1.95 -0.98 114.58 116.92 1l3n h GLU 132 Ca -0.37 0.02 0.17 0.00 0.08 0.00 0.00 59.36 59.25 1l3n h GLU 132 Cb 1.20 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 30.46 1l3n h GLU 132 CO 0.64 -0.16 0.52 1.49 -2.18 0.00 0.00 179.01 179.31 1l3n h GLU 133 N -0.25 0.32 -0.90 1.92 4.57 -1.97 -0.67 114.58 117.61 1l3n h GLU 133 Ca 0.06 -0.02 0.15 0.00 -1.18 0.00 0.00 59.36 58.38 1l3n h GLU 133 Cb 0.33 -0.07 -0.10 0.00 -0.16 0.00 0.00 28.75 28.76 1l3n h GLU 133 CO -0.18 0.21 0.49 0.66 -1.18 0.00 0.00 179.01 179.01 1l3n h SER 134 N 0.33 0.61 0.26 1.04 4.64 -0.48 0.29 113.55 120.24 1l3n h SER 134 Ca 0.38 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 1l3n h SER 134 Cb 0.99 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 1l3n h SER 134 CO -0.11 0.25 -0.09 1.07 -0.87 0.00 0.00 176.83 177.09 1l3n n THR 135 N -4.83 0.00 -0.01 2.95 5.66 -0.27 -2.95 114.28 114.84 1l3n n THR 135 Ca 0.19 -0.08 -0.03 0.00 -3.05 0.00 0.00 64.05 61.07 1l3n n THR 135 Cb 0.46 -0.04 -0.01 0.00 -1.55 0.00 0.00 70.33 69.18 1l3n n THR 135 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1l3n n LYS 136 N -0.79 0.20 -0.76 1.09 4.81 0.66 -3.13 118.16 120.23 1l3n n LYS 136 Ca 0.16 0.08 0.03 0.00 -0.87 0.00 0.00 58.31 57.71 1l3n n LYS 136 Cb 0.27 -0.82 0.04 0.00 0.02 0.00 0.00 35.03 34.53 1l3n n LYS 136 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1l3n n THR 137 N -3.78 0.38 0.00 3.15 -2.24 0.67 -4.09 114.28 108.36 1l3n n THR 137 Ca -0.05 -0.80 0.00 0.00 -2.27 0.00 0.00 64.05 60.93 1l3n n THR 137 Cb 0.19 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 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 -0.09 1.22 2.47 3.38 0.00 0.50 -2.13 105.19 110.54 1l3n n GLY 138 Ca 0.05 0.28 -0.03 0.00 0.00 0.00 0.00 46.02 46.32 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 6.91 -1.29 0.31 1.61 3.02 -1.26 -1.93 115.26 122.63 1l3n n ASN 139 Ca 0.00 -2.00 0.21 0.00 -0.03 0.00 0.00 54.58 52.75 1l3n n ASN 139 Cb 0.00 0.69 1.06 0.00 -0.61 0.00 0.00 39.78 40.92 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 1.09 1.00 -0.05 5.41 0.00 -1.60 -3.42 119.26 121.68 1l3n h ALA 140 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1l3n h ALA 140 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1l3n h ALA 140 CO -0.13 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.53 1l3n n GLY 141 N -0.80 -0.14 3.70 0.00 0.00 -1.26 -0.58 105.19 106.11 1l3n n GLY 141 Ca -0.02 -1.05 -0.42 0.00 0.00 0.00 0.00 46.02 44.53 1l3n n GLY 141 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1l3n s SER 142 N -4.00 6.78 -0.99 1.61 0.15 -1.26 -4.74 113.70 111.24 1l3n s SER 142 Ca 0.00 2.28 -0.26 0.00 0.70 0.00 0.00 55.95 58.68 1l3n s SER 142 Cb 0.00 -2.57 -0.20 0.00 -1.71 0.00 0.00 66.02 61.54 1l3n s SER 142 CO 0.00 -0.74 1.99 0.54 1.20 0.00 0.00 173.24 176.23 1l3n n ARG 143 N 4.93 0.70 -0.35 5.44 3.00 -1.26 -0.55 116.66 128.57 1l3n n ARG 143 Ca 0.13 -1.91 0.11 0.00 -0.01 0.00 0.00 57.85 56.17 1l3n n ARG 143 Cb 0.42 -3.66 0.29 0.00 0.00 0.00 0.00 32.46 29.50 1l3n n ARG 143 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 1l3n h LEU 144 N 19.93 0.82 -7.47 0.55 3.38 -1.85 -3.43 115.31 127.23 1l3n h LEU 144 Ca 0.13 0.08 -0.13 0.00 0.09 0.00 0.00 57.88 58.05 1l3n h LEU 144 Cb 0.93 -0.07 -0.22 0.00 0.09 0.00 0.00 40.66 41.38 1l3n h LEU 144 CO 1.25 0.35 -0.31 0.00 0.09 0.00 0.00 178.44 179.82 1l3n s ALA 145 N -5.90 -0.77 0.08 1.53 0.00 -1.03 -2.80 121.76 112.87 1l3n s ALA 145 Ca -0.12 0.56 0.08 0.00 0.00 0.00 0.00 51.96 52.49 1l3n s ALA 145 Cb 0.24 -0.19 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 1l3n s ALA 145 CO 0.80 -0.21 -0.22 0.00 0.00 0.00 0.00 175.76 176.13 1l3n s GLY 147 N -1.64 -0.06 0.26 0.00 0.00 -0.08 -0.92 107.32 104.88 1l3n s GLY 147 Ca 0.08 0.25 -0.10 0.00 0.00 0.00 0.00 44.72 44.95 1l3n s GLY 147 CO 0.04 0.18 0.59 0.14 0.00 0.00 0.00 173.10 174.05 1l3n s VAL 148 N -0.22 4.89 0.00 1.40 1.01 -1.26 -0.45 120.40 125.77 1l3n s VAL 148 Ca -0.03 0.53 0.00 0.00 0.00 0.00 0.00 61.98 62.48 1l3n s VAL 148 Cb -0.02 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.73 1l3n s VAL 148 CO 0.00 -0.13 0.04 -0.38 0.00 0.00 0.00 175.10 174.63 1l3n n ILE 149 N -0.29 0.00 0.00 2.22 5.41 -1.19 -3.92 119.36 121.58 1l3n n ILE 149 Ca 0.01 0.23 0.00 0.00 1.00 0.00 0.00 62.75 63.99 1l3n n ILE 149 Cb 0.53 -0.63 0.00 0.00 -0.71 0.00 0.00 39.64 38.83 1l3n n ILE 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1l3n n GLY 150 N 1.73 1.80 3.75 7.39 0.00 -1.24 -3.91 105.19 114.71 1l3n n GLY 150 Ca 0.00 -1.44 -0.37 0.00 0.00 0.00 0.00 46.02 44.21 1l3n n GLY 150 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1l3n s ILE 151 N -0.28 2.38 -0.01 -0.61 1.01 -1.26 -1.29 121.20 121.14 1l3n s ILE 151 Ca 0.00 0.27 0.01 0.00 0.00 0.00 0.00 60.65 60.93 1l3n s ILE 151 Cb 0.00 -3.13 -0.01 0.00 0.01 0.00 0.00 42.46 39.33 1l3n s ILE 151 CO 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 174.94 174.92 1l3n n ALA 152 N -1.19 1.97 0.21 9.38 0.00 0.22 -4.76 120.51 126.34 1l3n n ALA 152 Ca 0.11 -0.08 0.02 0.00 0.00 0.00 0.00 53.44 53.50 1l3n n ALA 152 Cb 0.47 0.29 0.02 0.00 0.00 0.00 0.00 19.45 20.23 1l3n n ALA 152 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44