#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l6v s LYS 6 N 0.00 1.30 0.31 -0.67 -2.85 -1.26 -3.30 119.74 113.26 1l6v s LYS 6 Ca 0.00 -1.62 0.04 0.00 -1.00 0.00 0.00 55.97 53.39 1l6v s LYS 6 Cb 0.00 -0.81 -0.06 0.00 -2.06 0.00 0.00 37.83 34.90 1l6v s LYS 6 CO 0.00 0.03 0.05 0.96 0.10 0.00 0.00 175.35 176.49 1l6v s ILE 7 N -3.24 1.13 0.38 3.79 -4.36 0.47 -4.83 121.20 114.55 1l6v s ILE 7 Ca 0.24 -2.01 0.08 0.00 -0.26 0.00 0.00 60.65 58.70 1l6v s ILE 7 Cb 0.03 -2.71 -0.05 0.00 1.25 0.00 0.00 42.46 40.98 1l6v s ILE 7 CO 0.07 -0.05 0.16 -0.89 0.24 0.00 0.00 174.94 174.47 1l6v s THR 8 N -3.34 2.56 0.00 8.37 2.01 -1.26 0.22 115.64 124.19 1l6v s THR 8 Ca 0.36 -1.71 -0.29 0.00 0.31 0.00 0.00 61.69 60.36 1l6v s THR 8 Cb 0.08 -2.97 0.08 0.00 0.01 0.00 0.00 72.50 69.70 1l6v s THR 8 CO 0.14 -0.07 0.69 -0.69 -0.69 0.00 0.00 174.62 174.00 1l6v s VAL 9 N -2.54 0.00 -0.18 3.82 1.01 -0.27 0.21 120.40 122.44 1l6v s VAL 9 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.38 1l6v s VAL 9 Cb 0.01 -1.00 0.04 0.00 0.00 0.00 0.00 36.38 35.43 1l6v s VAL 9 CO 0.23 0.00 -0.08 -1.00 0.00 0.00 0.00 175.10 174.25 1l6v s HIS 10 N -1.96 2.09 -0.21 5.22 3.76 0.43 -1.19 115.29 123.42 1l6v s HIS 10 Ca -0.06 -1.36 -0.09 0.00 -0.15 0.00 0.00 55.06 53.40 1l6v s HIS 10 Cb -0.00 -1.49 -0.04 0.00 1.11 0.00 0.00 32.58 32.15 1l6v s HIS 10 CO 0.02 -0.69 0.10 -0.06 -0.85 0.00 0.00 174.74 173.27 1l6v s PHE 11 N 1.51 3.26 -0.16 1.40 0.40 -1.26 0.16 117.98 123.29 1l6v s PHE 11 Ca -0.00 0.08 -0.15 0.00 -0.60 0.00 0.00 56.93 56.26 1l6v s PHE 11 Cb -0.16 -2.17 -0.04 0.00 0.51 0.00 0.00 43.02 41.16 1l6v s PHE 11 CO -0.08 0.07 0.34 0.42 0.70 0.00 0.00 175.22 176.67 1l6v s ILE 12 N 0.75 5.27 0.00 0.64 1.01 0.80 -0.32 121.20 129.36 1l6v s ILE 12 Ca 0.05 0.63 0.00 0.00 0.00 0.00 0.00 60.65 61.33 1l6v s ILE 12 Cb -0.13 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.66 1l6v s ILE 12 CO 0.02 0.35 0.00 -3.20 0.00 0.00 0.00 174.94 172.11 1l6v n ASN 13 N 3.78 0.00 -2.04 3.58 5.15 -1.26 -4.00 115.26 120.47 1l6v n ASN 13 Ca -0.11 -0.91 -0.16 0.00 -0.60 0.00 0.00 54.58 52.81 1l6v n ASN 13 Cb 0.52 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.72 1l6v n ASN 13 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1l6v n ARG 14 N -0.91 1.90 0.00 1.20 3.00 -1.26 -3.52 116.66 117.07 1l6v n ARG 14 Ca 0.00 -1.42 0.00 0.00 -0.01 0.00 0.00 57.85 56.42 1l6v n ARG 14 Cb 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 32.46 30.70 1l6v n ARG 14 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1l6v n ASP 15 N 1.20 0.00 0.00 0.55 2.03 -1.26 -5.02 116.55 114.05 1l6v n ASP 15 Ca 0.34 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.65 1l6v n ASP 15 Cb 0.63 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.03 1l6v n ASP 15 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1l6v n GLY 16 N -1.22 1.68 2.94 0.27 0.00 -1.23 -5.05 105.19 102.58 1l6v n GLY 16 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1l6v n GLY 16 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1l6v n GLU 17 N 0.00 3.43 -1.37 1.61 -0.58 -1.26 -4.84 120.64 117.62 1l6v n GLU 17 Ca 0.00 -3.38 -0.54 0.00 -0.42 0.00 0.00 57.16 52.82 1l6v n GLU 17 Cb 0.00 -3.03 -0.08 0.00 -0.57 0.00 0.00 31.44 27.75 1l6v n GLU 17 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1l6v n THR 18 N 3.94 0.00 -0.01 2.62 -1.04 -1.26 -4.36 114.28 114.18 1l6v n THR 18 Ca 0.42 0.00 -0.19 0.00 -2.04 0.00 0.00 64.05 62.24 1l6v n THR 18 Cb 0.38 -0.41 -0.14 0.00 -1.82 0.00 0.00 70.33 68.35 1l6v n THR 18 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1l6v h LEU 19 N 4.46 0.27 -0.67 -4.42 -0.00 -1.04 -3.48 115.31 110.44 1l6v h LEU 19 Ca -0.32 -0.90 0.00 0.00 -0.00 0.00 0.00 57.88 56.66 1l6v h LEU 19 Cb 1.12 -0.09 0.00 0.00 -0.00 0.00 0.00 40.66 41.69 1l6v h LEU 19 CO 0.81 1.35 -0.73 0.41 -0.00 0.00 0.00 178.44 180.27 1l6v n THR 20 N -4.24 -2.80 -3.58 0.22 -1.04 -1.26 -4.90 114.28 96.68 1l6v n THR 20 Ca -0.17 1.32 -0.08 0.00 -2.04 0.00 0.00 64.05 63.08 1l6v n THR 20 Cb 0.73 -2.05 -0.04 0.00 -1.82 0.00 0.00 70.33 67.15 1l6v n THR 20 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1l6v s THR 21 N -4.56 0.00 0.18 12.58 -1.32 -0.33 -4.85 115.64 117.34 1l6v s THR 21 Ca 0.00 0.00 -0.10 0.00 -1.21 0.00 0.00 61.69 60.38 1l6v s THR 21 Cb 0.00 -1.00 -0.07 0.00 -1.51 0.00 0.00 72.50 69.92 1l6v s THR 21 CO 0.00 0.00 0.51 -1.59 -2.21 0.00 0.00 174.62 171.33 1l6v s LYS 22 N -1.56 3.80 0.27 7.08 -2.85 -1.26 -1.12 119.74 124.11 1l6v s LYS 22 Ca 0.03 0.25 0.02 0.00 -1.00 0.00 0.00 55.97 55.26 1l6v s LYS 22 Cb -0.01 -2.77 -0.05 0.00 -2.06 0.00 0.00 37.83 32.95 1l6v s LYS 22 CO -0.02 0.39 0.09 0.20 0.10 0.00 0.00 175.35 176.11 1l6v s GLY 23 N -2.19 1.81 -0.08 0.59 0.00 0.59 -4.73 107.32 103.31 1l6v s GLY 23 Ca 0.43 -1.89 0.04 0.00 0.00 0.00 0.00 44.72 43.30 1l6v s GLY 23 CO 0.21 -1.63 -0.20 0.54 0.00 0.00 0.00 173.10 172.02 1l6v s LYS 24 N -4.00 2.84 -0.22 2.90 1.02 -1.26 0.18 119.74 121.19 1l6v s LYS 24 Ca 0.37 -0.80 -0.28 0.00 0.02 0.00 0.00 55.97 55.28 1l6v s LYS 24 Cb 0.08 -2.35 -0.05 0.00 -0.52 0.00 0.00 37.83 34.99 1l6v s LYS 24 CO 0.14 0.35 2.19 -1.50 -0.92 0.00 0.00 175.35 175.61 1l6v s ILE 25 N -0.06 3.04 0.00 2.17 2.07 -1.21 -0.69 121.20 126.53 1l6v s ILE 25 Ca -0.05 0.04 0.00 0.00 -1.41 0.00 0.00 60.65 59.23 1l6v s ILE 25 Cb -0.14 -3.05 0.00 0.00 0.13 0.00 0.00 42.46 39.39 1l6v s ILE 25 CO 0.04 -0.03 0.00 0.61 -1.91 0.00 0.00 174.94 173.65 1l6v n GLY 26 N 5.73 1.29 3.14 1.50 0.00 -1.20 -4.92 105.19 110.73 1l6v n GLY 26 Ca 0.29 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.01 1l6v n GLY 26 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1l6v n ASP 27 N 0.00 -2.64 -3.61 1.61 5.75 0.14 -4.61 116.55 113.19 1l6v n ASP 27 Ca 0.00 -0.15 0.00 0.00 -0.01 0.00 0.00 54.79 54.63 1l6v n ASP 27 Cb 0.00 -0.79 -0.01 0.00 -1.03 0.00 0.00 41.12 39.29 1l6v n ASP 27 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1l6v s SER 28 N -1.65 -0.00 -1.26 -1.12 1.04 -1.26 -3.76 113.70 105.69 1l6v s SER 28 Ca 0.46 -0.00 -0.05 0.00 0.48 0.00 0.00 55.95 56.83 1l6v s SER 28 Cb -0.05 0.00 0.01 0.00 0.10 0.00 0.00 66.02 66.08 1l6v s SER 28 CO 0.57 -0.00 1.08 0.18 0.98 0.00 0.00 173.24 176.05 1l6v n LEU 29 N -0.19 -3.62 -3.55 2.42 7.99 -1.26 -3.34 117.00 115.44 1l6v n LEU 29 Ca -0.00 -0.56 -0.33 0.00 -0.01 0.00 0.00 56.01 55.11 1l6v n LEU 29 Cb 0.59 -3.01 0.02 0.00 -0.11 0.00 0.00 43.42 40.92 1l6v n LEU 29 CO 0.09 0.53 -0.26 0.18 -1.51 0.00 0.00 177.39 176.42 1l6v n LEU 30 N -4.54 -2.14 -0.09 2.23 4.32 -1.26 -4.92 117.00 110.60 1l6v n LEU 30 Ca -0.11 -0.45 -0.08 0.00 -0.02 0.00 0.00 56.01 55.34 1l6v n LEU 30 Cb 0.60 -1.54 -0.03 0.00 -1.62 0.00 0.00 43.42 40.84 1l6v n LEU 30 CO 0.62 0.15 -0.63 -0.67 -1.22 0.00 0.00 177.39 175.64 1l6v n ASP 31 N -1.01 1.92 -0.02 -1.43 -0.08 -1.21 -4.36 116.55 110.36 1l6v n ASP 31 Ca -0.17 0.37 -0.00 0.00 -1.51 0.00 0.00 54.79 53.48 1l6v n ASP 31 Cb 0.67 -0.76 -0.00 0.00 2.34 0.00 0.00 41.12 43.37 1l6v n ASP 31 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1l6v n VAL 32 N -4.48 -0.03 0.00 5.18 0.31 -1.26 0.30 118.33 118.35 1l6v n VAL 32 Ca -0.13 0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 1l6v n VAL 32 Cb 0.48 -0.21 0.00 0.00 -0.91 0.00 0.00 33.84 33.21 1l6v n VAL 32 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 1l6v n VAL 33 N -2.97 0.00 -0.26 2.52 3.14 -1.26 -0.80 118.33 118.70 1l6v n VAL 33 Ca 0.00 1.39 0.04 0.00 -2.96 0.00 0.00 64.34 62.81 1l6v n VAL 33 Cb 0.01 -1.96 0.17 0.00 -1.06 0.00 0.00 33.84 31.00 1l6v n VAL 33 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 1l6v h VAL 34 N 0.00 0.76 -0.50 1.55 2.07 0.84 1.60 116.25 122.57 1l6v h VAL 34 Ca 0.00 -0.19 0.16 0.00 0.82 0.00 0.00 66.70 67.49 1l6v h VAL 34 Cb 0.00 0.16 -0.09 0.00 -1.52 0.00 0.00 31.29 29.84 1l6v h VAL 34 CO 0.00 0.10 0.10 1.67 0.02 0.00 0.00 177.57 179.46 1l6v n GLN 35 N -4.91 -0.04 -0.00 1.57 0.00 0.89 0.11 117.38 115.00 1l6v n GLN 35 Ca 0.13 0.73 0.02 0.00 -0.00 0.00 0.00 57.00 57.88 1l6v n GLN 35 Cb 0.35 -1.21 -0.02 0.00 0.00 0.00 0.00 30.24 29.36 1l6v n GLN 35 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1l6v n ASN 36 N -4.42 2.80 -0.03 1.69 5.15 -0.58 -5.00 115.26 114.86 1l6v n ASN 36 Ca 0.14 -0.20 0.00 0.00 -0.60 0.00 0.00 54.58 53.92 1l6v n ASN 36 Cb 0.47 1.10 0.00 0.00 -0.53 0.00 0.00 39.78 40.83 1l6v n ASN 36 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1l6v n ASN 37 N -1.43 -0.96 -4.09 1.20 5.15 0.53 -5.02 115.26 110.64 1l6v n ASN 37 Ca -0.00 0.00 -0.33 0.00 -0.60 0.00 0.00 54.58 53.65 1l6v n ASN 37 Cb 0.08 -0.45 0.11 0.00 -0.53 0.00 0.00 39.78 38.99 1l6v n ASN 37 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1l6v n LEU 38 N -0.03 -2.53 0.12 1.20 0.00 -0.30 -4.91 117.00 110.54 1l6v n LEU 38 Ca 0.00 -0.10 -0.09 0.00 0.00 0.00 0.00 56.01 55.82 1l6v n LEU 38 Cb 0.45 -0.73 -0.06 0.00 0.00 0.00 0.00 43.42 43.08 1l6v n LEU 38 CO 0.00 -2.81 0.30 -0.78 0.00 0.00 0.00 177.39 174.11 1l6v h ASP 39 N -1.69 -0.32 0.00 1.96 1.82 -1.95 -3.46 116.42 112.78 1l6v h ASP 39 Ca -0.43 -0.16 0.00 0.00 -0.39 0.00 0.00 57.03 56.04 1l6v h ASP 39 Cb 1.28 0.08 0.00 0.00 0.68 0.00 0.00 39.33 41.37 1l6v h ASP 39 CO 0.28 0.17 0.00 -0.38 -1.61 0.00 0.00 179.24 177.70 1l6v n ILE 40 N -5.03 0.00 0.00 2.25 2.08 -1.26 -4.77 119.36 112.63 1l6v n ILE 40 Ca -0.07 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.24 1l6v n ILE 40 Cb 0.23 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.12 1l6v n ILE 40 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 1l6v n ASP 41 N 8.65 0.00 -2.58 4.38 -0.08 -1.26 -5.01 116.55 120.65 1l6v n ASP 41 Ca 0.00 0.00 -0.14 0.00 -1.51 0.00 0.00 54.79 53.14 1l6v n ASP 41 Cb 0.00 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.39 1l6v n ASP 41 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1l6v n GLY 42 N -0.09 2.64 0.00 0.27 0.00 -1.26 -4.79 105.19 101.96 1l6v n GLY 42 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1l6v n GLY 42 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1l6v n PHE 43 N 3.25 -1.53 -2.92 1.61 3.72 -1.26 -4.83 117.46 115.50 1l6v n PHE 43 Ca 0.35 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.64 1l6v n PHE 43 Cb 0.40 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 39.00 1l6v n PHE 43 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1l6v n GLY 44 N 5.00 -0.01 0.00 1.37 0.00 -1.26 -4.96 105.19 105.33 1l6v n GLY 44 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1l6v n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l6v n ALA 45 N -3.14 0.00 0.00 4.61 0.00 -1.26 -3.49 120.51 117.23 1l6v n ALA 45 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1l6v n ALA 45 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 1l6v n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l6v h GLU 47 N 0.00 0.00 0.00 0.00 5.08 -1.95 -3.45 114.58 114.26 1l6v h GLU 47 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1l6v h GLU 47 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1l6v h GLU 47 CO 0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 1l6v n GLY 48 N -1.71 -0.84 0.57 -3.84 0.00 -1.25 -4.04 105.19 94.09 1l6v n GLY 48 Ca 0.23 0.00 0.43 0.00 0.00 0.00 0.00 46.02 46.69 1l6v n GLY 48 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1l6v n THR 49 N 0.00 -0.01 -0.29 2.61 -1.04 -1.26 -3.89 114.28 110.40 1l6v n THR 49 Ca 0.00 1.22 0.00 0.00 -2.04 0.00 0.00 64.05 63.23 1l6v n THR 49 Cb 0.00 -2.03 0.00 0.00 -1.82 0.00 0.00 70.33 66.48 1l6v n THR 49 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1l6v n LEU 50 N -3.58 -1.54 -0.20 -4.42 0.00 -1.26 -4.95 117.00 101.05 1l6v n LEU 50 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.37 1l6v n LEU 50 Cb 1.63 -0.40 0.00 0.00 0.00 0.00 0.00 43.42 44.66 1l6v n LEU 50 CO 0.36 0.00 0.00 0.00 0.00 0.00 0.00 177.39 177.75 1l6v n ALA 51 N 0.59 0.00 0.01 1.96 0.00 -1.26 -4.98 120.51 116.83 1l6v n ALA 51 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1l6v n ALA 51 Cb 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 19.45 19.15 1l6v n ALA 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l6v n SER 53 N -2.63 1.57 0.00 0.00 3.41 -1.26 -4.98 113.62 109.73 1l6v n SER 53 Ca 0.00 -0.94 0.00 0.00 -0.26 0.00 0.00 58.87 57.67 1l6v n SER 53 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1l6v n SER 53 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1l6v n THR 54 N -0.20 0.00 -1.93 6.66 -2.24 -1.26 -4.94 114.28 110.36 1l6v n THR 54 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1l6v n THR 54 Cb 0.00 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 1l6v n THR 54 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1l6v s HIS 56 N -2.77 2.86 0.05 0.00 2.46 -1.26 0.21 115.29 116.84 1l6v s HIS 56 Ca 0.00 -1.57 -0.03 0.00 0.47 0.00 0.00 55.06 53.93 1l6v s HIS 56 Cb 0.00 -1.96 -0.02 0.00 -0.13 0.00 0.00 32.58 30.46 1l6v s HIS 56 CO 0.00 -0.77 0.04 -0.51 -2.47 0.00 0.00 174.74 171.03 1l6v s LEU 57 N 1.31 2.12 0.54 8.88 1.02 -0.57 -4.53 118.68 127.45 1l6v s LEU 57 Ca 0.04 -0.78 -0.19 0.00 0.02 0.00 0.00 54.13 53.22 1l6v s LEU 57 Cb -0.14 0.43 -0.06 0.00 0.02 0.00 0.00 46.19 46.44 1l6v s LEU 57 CO -0.10 -0.57 1.10 -0.51 0.02 0.00 0.00 176.35 176.28 1l6v s ILE 58 N -3.36 3.38 -0.01 -0.59 -1.16 0.60 -0.87 121.20 119.19 1l6v s ILE 58 Ca 0.02 0.83 -0.00 0.00 -0.51 0.00 0.00 60.65 60.99 1l6v s ILE 58 Cb 0.04 -3.33 0.01 0.00 0.61 0.00 0.00 42.46 39.79 1l6v s ILE 58 CO -0.08 -0.21 0.02 -0.36 -2.81 0.00 0.00 174.94 171.50 1l6v s PHE 59 N -1.90 -0.01 -0.25 3.50 0.40 -1.26 -3.46 117.98 115.00 1l6v s PHE 59 Ca 0.70 0.06 -0.43 0.00 -0.60 0.00 0.00 56.93 56.67 1l6v s PHE 59 Cb -0.21 -0.05 -0.19 0.00 0.51 0.00 0.00 43.02 43.08 1l6v s PHE 59 CO 0.26 -0.03 1.44 0.39 0.70 0.00 0.00 175.22 177.99 1l6v n GLU 60 N 3.35 0.32 -0.11 0.44 1.02 -1.26 -3.68 120.64 120.73 1l6v n GLU 60 Ca -0.16 0.12 0.15 0.00 -0.02 0.00 0.00 57.16 57.25 1l6v n GLU 60 Cb 0.58 -1.66 0.54 0.00 -0.02 0.00 0.00 31.44 30.87 1l6v n GLU 60 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1l6v h GLN 61 N 4.76 0.32 -0.86 3.49 4.15 -1.95 0.73 115.11 125.74 1l6v h GLN 61 Ca -0.47 -0.02 -0.06 0.00 0.77 0.00 0.00 58.65 58.87 1l6v h GLN 61 Cb 1.37 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 28.96 1l6v h GLN 61 CO 0.86 0.21 0.08 1.58 -1.93 0.00 0.00 178.83 179.63 1l6v n HIS 62 N -4.45 1.05 0.02 3.99 -0.00 -1.26 -2.38 115.22 112.18 1l6v n HIS 62 Ca 0.12 -0.53 0.00 0.00 0.46 0.00 0.00 57.72 57.77 1l6v n HIS 62 Cb 0.50 -0.36 0.00 0.00 -0.12 0.00 0.00 29.99 30.01 1l6v n HIS 62 CO 0.00 0.00 0.00 -0.89 0.46 0.00 0.00 176.34 175.91 1l6v n ILE 63 N 0.14 0.16 -0.08 3.57 2.08 0.24 -4.82 119.36 120.65 1l6v n ILE 63 Ca 0.16 0.05 -0.08 0.00 0.56 0.00 0.00 62.75 63.45 1l6v n ILE 63 Cb 0.77 -1.12 -0.03 0.00 -0.75 0.00 0.00 39.64 38.50 1l6v n ILE 63 CO 0.00 0.00 0.00 0.33 0.56 0.00 0.00 176.55 177.44 1l6v n PHE 64 N -2.95 0.91 -0.14 1.39 -0.00 -0.17 -4.10 117.46 112.40 1l6v n PHE 64 Ca 0.00 0.40 0.25 0.00 -0.00 0.00 0.00 57.45 58.10 1l6v n PHE 64 Cb 0.24 -0.82 0.44 0.00 -0.00 0.00 0.00 39.48 39.34 1l6v n PHE 64 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.76 177.81 1l6v h GLU 65 N -1.00 0.00 -2.04 -4.13 -0.00 -1.65 0.10 114.58 105.86 1l6v h GLU 65 Ca -0.06 0.00 -0.05 0.00 -0.00 0.00 0.00 59.36 59.25 1l6v h GLU 65 Cb 0.66 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.39 1l6v h GLU 65 CO -0.04 0.00 -0.07 1.63 -0.00 0.00 0.00 179.01 180.53 1l6v n LYS 66 N -3.23 1.10 -3.73 1.06 5.02 -1.24 -4.72 118.16 112.42 1l6v n LYS 66 Ca 0.20 -0.25 -0.11 0.00 -2.02 0.00 0.00 58.31 56.14 1l6v n LYS 66 Cb 1.41 -1.32 -0.06 0.00 -0.02 0.00 0.00 35.03 35.03 1l6v n LYS 66 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1l6v s LEU 67 N 0.00 0.82 -0.76 -0.35 1.02 0.35 -5.02 118.68 114.74 1l6v s LEU 67 Ca 0.16 -0.33 0.03 0.00 0.02 0.00 0.00 54.13 54.02 1l6v s LEU 67 Cb 0.08 1.46 0.22 0.00 0.02 0.00 0.00 46.19 47.97 1l6v s LEU 67 CO 0.00 -0.72 0.73 -1.84 0.02 0.00 0.00 176.35 174.54 1l6v n GLU 68 N 0.16 2.49 -3.64 1.70 0.28 -1.26 -5.00 120.64 115.37 1l6v n GLU 68 Ca -0.17 -4.56 -0.06 0.00 -0.16 0.00 0.00 57.16 52.21 1l6v n GLU 68 Cb 0.62 -2.33 -0.07 0.00 1.43 0.00 0.00 31.44 31.09 1l6v n GLU 68 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1l6v s ALA 69 N -1.91 -1.95 0.04 -1.84 0.00 -1.26 -5.17 121.76 109.67 1l6v s ALA 69 Ca 0.31 2.38 -0.15 0.00 0.00 0.00 0.00 51.96 54.50 1l6v s ALA 69 Cb 0.02 -1.47 0.05 0.00 0.00 0.00 0.00 23.12 21.72 1l6v s ALA 69 CO -0.08 -0.37 0.68 1.51 0.00 0.00 0.00 175.76 177.49 1l6v n ILE 70 N 4.15 0.00 -4.17 0.00 3.06 -1.26 -5.07 119.36 116.07 1l6v n ILE 70 Ca -0.20 -0.19 -0.08 0.00 -2.50 0.00 0.00 62.75 59.79 1l6v n ILE 70 Cb 0.59 0.38 -0.02 0.00 0.54 0.00 0.00 39.64 41.13 1l6v n ILE 70 CO 0.00 0.00 0.00 0.41 -2.50 0.00 0.00 176.55 174.46 1l6v n THR 71 N -0.48 0.00 0.00 9.51 -1.04 -1.26 -4.92 114.28 116.09 1l6v n THR 71 Ca 0.01 -0.58 0.00 0.00 -2.04 0.00 0.00 64.05 61.44 1l6v n THR 71 Cb 0.33 0.13 0.00 0.00 -1.82 0.00 0.00 70.33 68.98 1l6v n THR 71 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1l6v n ASP 72 N -1.24 0.00 -2.69 8.00 -0.08 -1.26 -1.99 116.55 117.28 1l6v n ASP 72 Ca -0.04 0.00 -0.07 0.00 -1.51 0.00 0.00 54.79 53.17 1l6v n ASP 72 Cb 0.15 0.00 0.08 0.00 2.34 0.00 0.00 41.12 43.69 1l6v n ASP 72 CO 0.00 0.00 0.00 -1.84 0.12 0.00 0.00 177.20 175.48 1l6v n GLU 73 N -1.83 1.24 -0.83 -0.67 0.00 -1.26 -4.92 120.64 112.37 1l6v n GLU 73 Ca 0.00 -2.47 0.00 0.00 0.00 0.00 0.00 57.16 54.69 1l6v n GLU 73 Cb 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 31.44 30.84 1l6v n GLU 73 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 1l6v n GLU 74 N -0.48 0.00 0.00 3.44 0.28 -0.84 -4.81 120.64 118.23 1l6v n GLU 74 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.01 1l6v n GLU 74 Cb 0.84 -1.40 0.00 0.00 1.43 0.00 0.00 31.44 32.31 1l6v n GLU 74 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1l6v n ASN 75 N 0.80 0.00 -2.65 -1.84 2.85 -1.26 -3.27 115.26 109.89 1l6v n ASN 75 Ca 0.00 0.00 -0.10 0.00 -0.11 0.00 0.00 54.58 54.37 1l6v n ASN 75 Cb 0.20 0.00 -0.02 0.00 1.24 0.00 0.00 39.78 41.21 1l6v n ASN 75 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1l6v n ASP 76 N 0.00 -1.01 -0.37 1.20 -0.08 -1.26 0.26 116.55 115.30 1l6v n ASP 76 Ca 0.00 0.01 0.00 0.00 -1.51 0.00 0.00 54.79 53.29 1l6v n ASP 76 Cb 0.00 -0.96 0.00 0.00 2.34 0.00 0.00 41.12 42.50 1l6v n ASP 76 CO 0.00 0.00 0.00 0.80 0.12 0.00 0.00 177.20 178.12 1l6v n MET 77 N -2.43 0.00 0.02 -0.67 0.00 -1.26 -4.89 117.12 107.89 1l6v n MET 77 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.73 1l6v n MET 77 Cb 0.40 -1.48 0.00 0.00 0.00 0.00 0.00 33.22 32.14 1l6v n MET 77 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1l6v n LEU 78 N -0.37 0.12 -1.68 -0.89 7.99 0.73 -4.75 117.00 118.16 1l6v n LEU 78 Ca 0.00 0.06 0.00 0.00 -0.01 0.00 0.00 56.01 56.06 1l6v n LEU 78 Cb 0.30 -0.01 0.00 0.00 -0.11 0.00 0.00 43.42 43.60 1l6v n LEU 78 CO 0.00 -0.31 -0.46 0.47 -1.51 0.00 0.00 177.39 175.58 1l6v n ASP 79 N -2.94 -8.88 -2.89 -1.43 8.00 -1.20 -4.27 116.55 102.93 1l6v n ASP 79 Ca 0.00 1.27 -0.12 0.00 0.71 0.00 0.00 54.79 56.65 1l6v n ASP 79 Cb 0.25 -4.82 -0.03 0.00 -0.02 0.00 0.00 41.12 36.50 1l6v n ASP 79 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1l6v n LEU 80 N -0.29 2.85 -4.69 0.64 -0.00 -1.26 -4.84 117.00 109.41 1l6v n LEU 80 Ca 0.00 -2.02 -0.42 0.00 -0.00 0.00 0.00 56.01 53.56 1l6v n LEU 80 Cb 0.00 -0.79 -0.03 0.00 -0.00 0.00 0.00 43.42 42.61 1l6v n LEU 80 CO 0.00 0.06 0.84 0.00 -0.00 0.00 0.00 177.39 178.29 1l6v s ALA 81 N 3.50 3.40 -0.79 1.47 0.00 -1.26 -4.86 121.76 123.22 1l6v s ALA 81 Ca 0.25 0.53 -0.29 0.00 0.00 0.00 0.00 51.96 52.45 1l6v s ALA 81 Cb 0.08 -3.45 -0.19 0.00 0.00 0.00 0.00 23.12 19.56 1l6v s ALA 81 CO -0.02 -0.59 2.26 0.66 0.00 0.00 0.00 175.76 178.08 1l6v n TYR 82 N 4.81 0.59 0.00 0.00 4.02 -1.26 -2.83 117.16 122.49 1l6v n TYR 82 Ca 0.09 0.40 0.00 0.00 -0.01 0.00 0.00 57.90 58.38 1l6v n TYR 82 Cb 0.48 -2.06 0.00 0.00 -0.02 0.00 0.00 39.34 37.74 1l6v n TYR 82 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1l6v n GLY 83 N 5.85 1.46 3.26 2.72 0.00 -1.26 -4.45 105.19 112.77 1l6v n GLY 83 Ca 0.56 -0.10 -0.60 0.00 0.00 0.00 0.00 46.02 45.87 1l6v n GLY 83 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1l6v n LEU 84 N 0.00 0.82 0.00 0.99 4.32 -1.13 -4.81 117.00 117.19 1l6v n LEU 84 Ca 0.00 0.76 0.00 0.00 -0.02 0.00 0.00 56.01 56.75 1l6v n LEU 84 Cb 0.00 -0.87 0.00 0.00 -1.62 0.00 0.00 43.42 40.93 1l6v n LEU 84 CO 0.00 -0.76 0.00 0.41 -1.22 0.00 0.00 177.39 175.82 1l6v n THR 85 N 5.86 0.00 -0.68 -5.08 -1.04 -1.26 -4.84 114.28 107.24 1l6v n THR 85 Ca 0.49 0.00 0.51 0.00 -2.04 0.00 0.00 64.05 63.01 1l6v n THR 85 Cb -0.04 0.00 0.78 0.00 -1.82 0.00 0.00 70.33 69.25 1l6v n THR 85 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1l6v n ASP 86 N 0.00 0.01 0.00 8.00 8.00 -1.26 -4.52 116.55 126.77 1l6v n ASP 86 Ca 0.00 0.96 0.00 0.00 0.71 0.00 0.00 54.79 56.46 1l6v n ASP 86 Cb 0.00 -0.48 0.00 0.00 -0.02 0.00 0.00 41.12 40.62 1l6v n ASP 86 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1l6v n ARG 87 N -3.85 0.00 -1.56 -1.24 3.00 -1.24 -3.86 116.66 107.91 1l6v n ARG 87 Ca 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.27 1l6v n ARG 87 Cb 1.92 0.00 0.00 0.00 0.00 0.00 0.00 32.46 34.38 1l6v n ARG 87 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1l6v n SER 88 N 0.00 -7.38 0.00 6.15 2.88 -1.25 -4.85 113.62 109.17 1l6v n SER 88 Ca 0.00 1.36 0.00 0.00 -1.33 0.00 0.00 58.87 58.90 1l6v n SER 88 Cb 0.00 -4.62 0.00 0.00 -0.75 0.00 0.00 64.21 58.84 1l6v n SER 88 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1l6v n ARG 89 N -1.75 0.00 -3.75 -1.46 3.00 -0.05 -4.78 116.66 107.87 1l6v n ARG 89 Ca 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.50 1l6v n ARG 89 Cb 0.21 0.00 -0.05 0.00 0.00 0.00 0.00 32.46 32.62 1l6v n ARG 89 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 1l6v s LEU 90 N 0.00 4.37 -0.70 6.15 2.96 -1.26 -1.52 118.68 128.69 1l6v s LEU 90 Ca 0.00 0.58 0.03 0.00 -0.22 0.00 0.00 54.13 54.52 1l6v s LEU 90 Cb 0.00 -2.64 0.34 0.00 0.50 0.00 0.00 46.19 44.39 1l6v s LEU 90 CO 0.00 0.26 1.26 0.61 -1.32 0.00 0.00 176.35 177.16 1l6v n GLY 91 N 1.19 5.80 3.19 7.98 0.00 0.57 -4.88 105.19 119.03 1l6v n GLY 91 Ca -0.12 -2.72 -0.09 0.00 0.00 0.00 0.00 46.02 43.10 1l6v n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l6v n GLN 93 N -0.04 -2.20 -3.70 0.00 10.64 -1.25 -4.79 117.38 116.04 1l6v n GLN 93 Ca -0.12 0.03 -0.29 0.00 -1.83 0.00 0.00 57.00 54.79 1l6v n GLN 93 Cb 0.62 -3.81 -0.12 0.00 -0.86 0.00 0.00 30.24 26.07 1l6v n GLN 93 CO 0.00 0.00 0.00 0.96 -1.83 0.00 0.00 177.06 176.19 1l6v s ILE 94 N -1.97 1.52 0.99 -0.39 -4.36 -1.26 -5.11 121.20 110.62 1l6v s ILE 94 Ca 0.17 -2.89 -0.15 0.00 -0.26 0.00 0.00 60.65 57.53 1l6v s ILE 94 Cb -0.10 -2.04 0.02 0.00 1.25 0.00 0.00 42.46 41.59 1l6v s ILE 94 CO 0.21 -0.97 0.13 0.00 0.24 0.00 0.00 174.94 174.56 1l6v s LEU 96 N 0.13 1.77 0.32 0.00 1.43 -1.25 -4.80 118.68 116.28 1l6v s LEU 96 Ca 0.54 1.37 -0.17 0.00 -1.03 0.00 0.00 54.13 54.85 1l6v s LEU 96 Cb -0.18 -3.61 0.03 0.00 0.03 0.00 0.00 46.19 42.46 1l6v s LEU 96 CO 0.69 -3.11 0.70 -0.89 0.23 0.00 0.00 176.35 173.97 1l6v s THR 97 N -2.87 0.00 0.04 5.49 2.01 -1.26 -3.26 115.64 115.79 1l6v s THR 97 Ca 0.65 -1.09 0.30 0.00 0.31 0.00 0.00 61.69 61.86 1l6v s THR 97 Cb -0.19 -2.42 0.36 0.00 0.01 0.00 0.00 72.50 70.25 1l6v s THR 97 CO 0.58 0.00 1.91 0.50 -0.69 0.00 0.00 174.62 176.92 1l6v h LYS 98 N 2.04 0.00 -0.16 4.92 3.11 -1.97 -2.82 116.57 121.69 1l6v h LYS 98 Ca -0.26 0.00 -0.06 0.00 -2.81 0.00 0.00 60.65 57.53 1l6v h LYS 98 Cb 1.25 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.48 1l6v h LYS 98 CO 0.33 0.05 -0.12 0.00 -2.81 0.00 0.00 179.45 176.89 1l6v h ALA 99 N 1.95 0.23 0.00 5.00 0.00 -1.95 -2.61 119.26 121.88 1l6v h ALA 99 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1l6v h ALA 99 Cb 0.62 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1l6v h ALA 99 CO 0.01 0.08 0.00 -1.33 0.00 0.00 0.00 179.25 178.01 1l6v n MET 100 N -4.57 0.94 -1.55 0.00 2.81 -1.11 -4.73 117.12 108.90 1l6v n MET 100 Ca -0.06 0.00 -0.26 0.00 -1.81 0.00 0.00 57.70 55.57 1l6v n MET 100 Cb 0.34 -1.31 -0.05 0.00 -0.71 0.00 0.00 33.22 31.50 1l6v n MET 100 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1l6v n ASP 101 N -0.81 2.03 -1.54 7.83 -0.08 -0.99 -1.14 116.55 121.86 1l6v n ASP 101 Ca 0.14 -0.91 -0.04 0.00 -1.51 0.00 0.00 54.79 52.47 1l6v n ASP 101 Cb 0.06 -1.60 0.02 0.00 2.34 0.00 0.00 41.12 41.95 1l6v n ASP 101 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1l6v n ASN 102 N 16.94 -2.02 -4.89 1.67 5.15 0.55 -4.79 115.26 127.86 1l6v n ASN 102 Ca 0.42 -0.14 -0.34 0.00 -0.60 0.00 0.00 54.58 53.92 1l6v n ASN 102 Cb 0.49 -1.53 -0.05 0.00 -0.53 0.00 0.00 39.78 38.15 1l6v n ASN 102 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1l6v s MET 103 N -4.32 3.51 -0.65 1.20 0.23 -0.29 -4.80 119.30 114.19 1l6v s MET 103 Ca 0.00 -0.19 -0.17 0.00 -1.03 0.00 0.00 55.69 54.29 1l6v s MET 103 Cb -0.00 -3.08 0.13 0.00 -1.53 0.00 0.00 34.83 30.35 1l6v s MET 103 CO 0.16 0.66 0.71 0.99 -2.03 0.00 0.00 175.02 175.51 1l6v s THR 104 N -1.31 5.04 -0.07 3.16 2.01 -1.26 0.16 115.64 123.37 1l6v s THR 104 Ca 0.27 -1.42 -0.14 0.00 0.31 0.00 0.00 61.69 60.71 1l6v s THR 104 Cb -0.13 -4.48 -0.05 0.00 0.01 0.00 0.00 72.50 67.85 1l6v s THR 104 CO 0.17 -1.09 0.36 0.68 -0.69 0.00 0.00 174.62 174.05 1l6v s VAL 105 N 2.01 5.18 0.02 3.82 -7.23 0.43 -4.54 120.40 120.08 1l6v s VAL 105 Ca 0.13 0.72 0.02 0.00 -1.81 0.00 0.00 61.98 61.03 1l6v s VAL 105 Cb -0.21 -3.68 -0.01 0.00 0.56 0.00 0.00 36.38 33.04 1l6v s VAL 105 CO 0.01 0.49 -0.06 -0.60 -0.31 0.00 0.00 175.10 174.64 1l6v s ARG 106 N -0.39 0.44 -0.12 4.82 3.00 -1.22 -0.14 118.95 125.34 1l6v s ARG 106 Ca 0.21 -0.45 0.02 0.00 -1.00 0.00 0.00 55.73 54.51 1l6v s ARG 106 Cb -0.15 -0.31 -0.01 0.00 0.00 0.00 0.00 34.95 34.48 1l6v s ARG 106 CO 0.09 0.07 -0.18 0.54 0.00 0.00 0.00 175.30 175.82 1l6v s VAL 107 N -0.74 2.60 0.00 7.11 0.11 -1.26 0.22 120.40 128.44 1l6v s VAL 107 Ca -0.04 -0.83 0.00 0.00 -2.93 0.00 0.00 61.98 58.18 1l6v s VAL 107 Cb -0.06 -2.05 0.00 0.00 -1.53 0.00 0.00 36.38 32.74 1l6v s VAL 107 CO 0.00 0.54 0.02 -0.81 -3.33 0.00 0.00 175.10 171.52 1l6v n PRO 108 N 3.51 0.00 -3.55 1.54 -0.04 -1.26 -4.83 135.00 130.37 1l6v n PRO 108 Ca -0.18 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.12 1l6v n PRO 108 Cb 0.53 -0.19 -0.06 0.00 -0.04 0.00 0.00 33.50 33.74 1l6v n PRO 108 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1l6v s ASP 109 N -1.25 -0.63 0.00 3.54 1.47 -1.26 -5.00 116.67 113.53 1l6v s ASP 109 Ca 0.00 0.83 0.00 0.00 1.18 0.00 0.00 52.55 54.56 1l6v s ASP 109 Cb 0.00 0.70 0.00 0.00 -0.34 0.00 0.00 42.92 43.28 1l6v s ASP 109 CO 0.00 -0.49 0.00 0.00 0.68 0.00 0.00 175.17 175.36