#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i2z s ILE 4 N 0.00 1.76 0.07 0.58 -4.36 0.18 -4.94 121.20 114.49 3i2z s ILE 4 Ca 0.00 -2.21 0.06 0.00 -0.26 0.00 0.00 60.65 58.25 3i2z s ILE 4 Cb 0.00 -2.14 -0.04 0.00 1.25 0.00 0.00 42.46 41.53 3i2z s ILE 4 CO 0.00 -0.52 -0.11 -0.54 0.24 0.00 0.00 174.94 174.01 3i2z s LYS 5 N -3.65 2.19 0.00 0.37 1.02 -1.26 -1.06 119.74 117.34 3i2z s LYS 5 Ca 0.24 -0.96 0.00 0.00 0.02 0.00 0.00 55.97 55.28 3i2z s LYS 5 Cb -0.00 -2.32 0.00 0.00 -0.52 0.00 0.00 37.83 34.99 3i2z s LYS 5 CO 0.08 0.53 0.00 0.41 -0.92 0.00 0.00 175.35 175.46 3i2z n GLY 6 N 1.06 1.70 3.02 -3.33 0.00 -0.48 -0.59 105.19 106.57 3i2z n GLY 6 Ca -0.14 -0.97 -0.20 0.00 0.00 0.00 0.00 46.02 44.71 3i2z n GLY 6 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i2z s ASN 7 N -0.97 1.23 -0.00 1.61 -0.87 -0.37 -1.14 114.94 114.42 3i2z s ASN 7 Ca 0.00 -0.19 -0.30 0.00 -1.57 0.00 0.00 52.86 50.80 3i2z s ASN 7 Cb 0.00 -0.24 -0.07 0.00 -0.02 0.00 0.00 41.25 40.92 3i2z s ASN 7 CO 0.00 0.10 1.83 -0.69 -2.57 0.00 0.00 177.10 175.77 3i2z s VAL 8 N -0.02 3.26 -0.06 1.60 1.01 0.37 -0.49 120.40 126.08 3i2z s VAL 8 Ca 0.00 0.32 -0.24 0.00 0.00 0.00 0.00 61.98 62.07 3i2z s VAL 8 Cb -0.06 -3.21 -0.26 0.00 0.00 0.00 0.00 36.38 32.84 3i2z s VAL 8 CO 0.00 -0.03 0.95 0.50 0.00 0.00 0.00 175.10 176.53 3i2z h LYS 9 N 10.12 0.22 -1.93 2.72 3.64 -1.28 0.29 116.57 130.36 3i2z h LYS 9 Ca -0.45 -0.30 -0.03 0.00 -1.27 0.00 0.00 60.65 58.60 3i2z h LYS 9 Cb 1.21 0.10 -0.21 0.00 -0.41 0.00 0.00 32.23 32.92 3i2z h LYS 9 CO 0.95 1.07 0.21 -0.46 -2.27 0.00 0.00 179.45 178.95 3i2z s TRP 10 N -2.76 -0.69 -0.15 1.91 -0.00 -1.18 -4.61 118.94 111.45 3i2z s TRP 10 Ca -0.15 1.54 -0.12 0.00 -0.00 0.00 0.00 56.10 57.38 3i2z s TRP 10 Cb 0.01 0.33 0.04 0.00 -0.00 0.00 0.00 33.47 33.85 3i2z s TRP 10 CO 0.78 -0.42 0.39 0.12 -0.00 0.00 0.00 176.95 177.81 3i2z s PHE 11 N -0.15 -0.48 -0.31 5.86 5.36 -1.26 -1.10 117.98 125.90 3i2z s PHE 11 Ca -0.03 1.10 -0.05 0.00 -0.96 0.00 0.00 56.93 57.00 3i2z s PHE 11 Cb -0.03 0.18 0.03 0.00 -0.34 0.00 0.00 43.02 42.86 3i2z s PHE 11 CO 0.03 -0.25 0.05 1.21 -1.46 0.00 0.00 175.22 174.80 3i2z s ASN 12 N 0.65 5.04 0.16 6.13 3.84 -0.35 -4.95 114.94 125.46 3i2z s ASN 12 Ca -0.04 -1.05 -0.16 0.00 0.21 0.00 0.00 52.86 51.83 3i2z s ASN 12 Cb -0.05 -1.80 0.09 0.00 -0.55 0.00 0.00 41.25 38.93 3i2z s ASN 12 CO -0.04 -0.26 1.74 -0.33 -2.79 0.00 0.00 177.10 175.42 3i2z h GLU 13 N 8.14 0.24 -0.10 0.43 5.08 -1.93 -2.21 114.58 124.23 3i2z h GLU 13 Ca -0.26 -0.01 -0.21 0.00 -1.00 0.00 0.00 59.36 57.88 3i2z h GLU 13 Cb 1.09 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.29 3i2z h GLU 13 CO 0.58 0.16 -0.78 1.03 -1.00 0.00 0.00 179.01 179.00 3i2z h SER 14 N 0.24 0.70 1.64 1.42 0.87 -1.96 -3.01 113.55 113.44 3i2z h SER 14 Ca 0.18 -0.47 -0.06 0.00 -1.23 0.00 0.00 61.79 60.21 3i2z h SER 14 Cb 0.19 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 3i2z h SER 14 CO -0.21 1.24 -0.37 0.11 -0.53 0.00 0.00 176.83 177.07 3i2z h LYS 15 N 0.39 0.00 0.00 2.24 1.57 -2.01 -3.48 116.57 115.29 3i2z h LYS 15 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 3i2z h LYS 15 Cb 1.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.70 3i2z h LYS 15 CO 0.15 0.25 0.00 0.41 -0.57 0.00 0.00 179.45 179.69 3i2z n GLY 16 N 1.18 0.89 3.34 3.86 0.00 -0.84 -4.98 105.19 108.64 3i2z n GLY 16 Ca 0.02 -0.57 -0.10 0.00 0.00 0.00 0.00 46.02 45.38 3i2z n GLY 16 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3i2z s PHE 17 N -2.00 0.12 0.00 1.61 -0.71 -1.16 -0.40 117.98 115.45 3i2z s PHE 17 Ca 0.00 -0.49 0.00 0.00 -1.04 0.00 0.00 56.93 55.40 3i2z s PHE 17 Cb 0.00 0.09 0.00 0.00 -1.21 0.00 0.00 43.02 41.90 3i2z s PHE 17 CO 0.00 -0.71 0.00 0.41 -1.34 0.00 0.00 175.22 173.58 3i2z n GLY 18 N -0.20 2.34 3.05 1.99 0.00 0.02 -1.21 105.19 111.18 3i2z n GLY 18 Ca -0.11 -0.68 -0.14 0.00 0.00 0.00 0.00 46.02 45.08 3i2z n GLY 18 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3i2z s PHE 19 N -2.56 0.66 -0.08 1.61 0.40 -0.26 -0.68 117.98 117.08 3i2z s PHE 19 Ca 0.00 -0.40 0.05 0.00 -0.60 0.00 0.00 56.93 55.98 3i2z s PHE 19 Cb 0.00 -0.40 -0.01 0.00 0.51 0.00 0.00 43.02 43.12 3i2z s PHE 19 CO 0.00 -0.06 -0.23 0.42 0.70 0.00 0.00 175.22 176.05 3i2z s ILE 20 N -1.08 2.18 -0.38 0.64 1.01 0.17 -0.75 121.20 122.98 3i2z s ILE 20 Ca -0.07 -1.01 -0.20 0.00 0.00 0.00 0.00 60.65 59.38 3i2z s ILE 20 Cb -0.08 -1.81 0.01 0.00 0.01 0.00 0.00 42.46 40.58 3i2z s ILE 20 CO 0.00 0.56 0.59 -0.89 0.00 0.00 0.00 174.94 175.20 3i2z s THR 21 N 0.02 4.92 0.50 2.92 2.01 0.36 -0.89 115.64 125.49 3i2z s THR 21 Ca -0.09 0.29 -0.22 0.00 0.31 0.00 0.00 61.69 61.98 3i2z s THR 21 Cb -0.15 -4.08 -0.06 0.00 0.01 0.00 0.00 72.50 68.22 3i2z s THR 21 CO 0.05 -0.38 1.26 -2.84 -0.69 0.00 0.00 174.62 172.03 3i2z s PRO 22 N 2.60 3.44 0.53 4.92 0.02 -1.26 -1.24 135.00 144.02 3i2z s PRO 22 Ca 0.21 2.01 0.21 0.00 0.02 0.00 0.00 61.00 63.45 3i2z s PRO 22 Cb -0.15 -2.33 1.36 0.00 0.02 0.00 0.00 34.50 33.40 3i2z s PRO 22 CO 0.16 -0.88 2.08 0.93 -0.33 0.00 0.00 177.00 178.96 3i2z h GLU 23 N 1.74 0.00 0.00 5.54 5.08 -1.19 -2.08 114.58 123.67 3i2z h GLU 23 Ca -0.50 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 3i2z h GLU 23 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3i2z h GLU 23 CO 0.59 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.20 3i2z n ASP 24 N -4.41 0.00 0.00 1.42 5.75 -1.26 -4.86 116.55 113.19 3i2z n ASP 24 Ca 0.03 -0.82 0.00 0.00 -0.01 0.00 0.00 54.79 53.99 3i2z n ASP 24 Cb 0.33 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.39 3i2z n ASP 24 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3i2z n GLY 25 N 0.79 0.74 3.76 6.12 0.00 -0.78 -5.05 105.19 110.77 3i2z n GLY 25 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 3i2z n GLY 25 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3i2z s SER 26 N -2.48 1.73 0.60 1.61 1.04 -1.26 -4.97 113.70 109.97 3i2z s SER 26 Ca 0.00 0.33 -0.18 0.00 0.48 0.00 0.00 55.95 56.58 3i2z s SER 26 Cb 0.00 -0.38 -0.03 0.00 0.10 0.00 0.00 66.02 65.71 3i2z s SER 26 CO 0.00 -3.60 1.16 -0.54 0.98 0.00 0.00 173.24 171.24 3i2z s LYS 27 N -5.74 2.98 0.45 4.02 1.02 -1.26 -4.38 119.74 116.84 3i2z s LYS 27 Ca 0.74 1.65 -0.25 0.00 0.02 0.00 0.00 55.97 58.14 3i2z s LYS 27 Cb -0.05 -1.95 -0.08 0.00 -0.52 0.00 0.00 37.83 35.23 3i2z s LYS 27 CO 0.55 -1.15 1.33 -0.51 -0.92 0.00 0.00 175.35 174.64 3i2z s ASP 28 N -1.91 6.02 -0.03 2.83 1.01 -1.26 -4.57 116.67 118.75 3i2z s ASP 28 Ca 0.73 2.70 0.06 0.00 0.71 0.00 0.00 52.55 56.75 3i2z s ASP 28 Cb -0.26 -2.64 -0.02 0.00 1.01 0.00 0.00 42.92 41.01 3i2z s ASP 28 CO 0.34 -1.05 -0.21 0.68 0.21 0.00 0.00 175.17 175.14 3i2z s VAL 29 N -1.28 2.51 0.49 -1.27 -7.23 -0.06 -4.92 120.40 108.63 3i2z s VAL 29 Ca 0.61 -0.93 -0.23 0.00 -1.81 0.00 0.00 61.98 59.62 3i2z s VAL 29 Cb -0.39 -1.93 -0.06 0.00 0.56 0.00 0.00 36.38 34.56 3i2z s VAL 29 CO 0.49 0.58 1.28 0.12 -0.31 0.00 0.00 175.10 177.27 3i2z s PHE 30 N -0.66 2.57 -0.03 2.82 2.19 -1.15 -0.66 117.98 123.07 3i2z s PHE 30 Ca 0.10 1.43 0.00 0.00 0.33 0.00 0.00 56.93 58.80 3i2z s PHE 30 Cb -0.10 -3.63 0.03 0.00 -1.31 0.00 0.00 43.02 38.00 3i2z s PHE 30 CO -0.00 -2.29 0.02 0.54 1.83 0.00 0.00 175.22 175.32 3i2z s VAL 31 N -1.39 0.04 0.14 3.12 0.11 0.15 -0.42 120.40 122.15 3i2z s VAL 31 Ca 0.67 0.17 -0.06 0.00 -2.93 0.00 0.00 61.98 59.82 3i2z s VAL 31 Cb -0.36 -0.16 -0.06 0.00 -1.53 0.00 0.00 36.38 34.27 3i2z s VAL 31 CO 0.43 0.12 0.41 -2.28 -3.33 0.00 0.00 175.10 170.45 3i2z s HIS 32 N 1.11 3.49 0.58 1.54 2.46 -1.26 -0.80 115.29 122.40 3i2z s HIS 32 Ca -0.09 0.65 0.27 0.00 0.47 0.00 0.00 55.06 56.37 3i2z s HIS 32 Cb -0.13 -2.07 1.68 0.00 -0.13 0.00 0.00 32.58 31.93 3i2z s HIS 32 CO -0.02 0.43 2.19 0.27 -2.47 0.00 0.00 174.74 175.13 3i2z h PHE 33 N 2.96 0.00 0.00 3.88 -0.00 -1.05 -0.15 116.94 122.58 3i2z h PHE 33 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.50 3i2z h PHE 33 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.12 3i2z h PHE 33 CO 0.62 0.00 0.00 0.66 -0.00 0.00 0.00 178.31 179.59 3i2z h SER 34 N 0.00 0.00 1.67 -0.68 4.64 -1.93 -1.42 113.55 115.84 3i2z h SER 34 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3i2z h SER 34 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3i2z h SER 34 CO -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 3i2z h ALA 35 N 2.25 1.00 -1.97 5.18 0.00 -1.33 -3.46 119.26 120.93 3i2z h ALA 35 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.34 3i2z h ALA 35 Cb 0.40 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 3i2z h ALA 35 CO 0.00 0.00 0.91 0.42 0.00 0.00 0.00 179.25 180.58 3i2z s ILE 36 N -3.20 4.33 -0.56 0.00 1.01 -0.54 -1.41 121.20 120.83 3i2z s ILE 36 Ca 0.08 1.53 -0.24 0.00 0.00 0.00 0.00 60.65 62.01 3i2z s ILE 36 Cb 0.08 -4.27 0.04 0.00 0.01 0.00 0.00 42.46 38.33 3i2z s ILE 36 CO 0.62 -0.45 0.95 -1.10 0.00 0.00 0.00 174.94 174.96 3i2z s GLN 37 N 3.86 3.32 -0.10 2.79 -1.52 -0.60 -4.95 119.66 122.46 3i2z s GLN 37 Ca 0.51 -0.28 -0.30 0.00 -1.95 0.00 0.00 55.36 53.34 3i2z s GLN 37 Cb -0.15 -4.06 0.09 0.00 -0.22 0.00 0.00 33.01 28.67 3i2z s GLN 37 CO 0.19 -1.51 0.79 0.95 -0.25 0.00 0.00 175.29 175.45 3i2z s THR 38 N 3.98 0.00 -1.05 -0.19 -4.23 -1.26 -4.79 115.64 108.10 3i2z s THR 38 Ca 0.30 0.00 -0.03 0.00 -1.18 0.00 0.00 61.69 60.79 3i2z s THR 38 Cb -0.13 -1.00 -0.03 0.00 1.34 0.00 0.00 72.50 72.68 3i2z s THR 38 CO 0.19 0.00 0.89 0.59 -0.54 0.00 0.00 174.62 175.75 3i2z n ASN 39 N 1.01 -3.97 0.00 3.99 4.13 -1.26 -4.93 115.26 114.23 3i2z n ASN 39 Ca -0.16 -0.61 0.00 0.00 1.68 0.00 0.00 54.58 55.49 3i2z n ASN 39 Cb 0.57 -4.83 0.00 0.00 -1.54 0.00 0.00 39.78 33.98 3i2z n ASN 39 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3i2z n GLY 40 N -1.18 0.84 3.71 7.41 0.00 -1.26 -4.96 105.19 109.76 3i2z n GLY 40 Ca -0.18 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 43.74 3i2z n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3i2z s PHE 41 N 0.00 3.05 -1.34 1.61 0.08 -1.26 -4.89 117.98 115.23 3i2z s PHE 41 Ca 0.00 0.67 -0.12 0.00 0.12 0.00 0.00 56.93 57.61 3i2z s PHE 41 Cb 0.00 -3.87 0.12 0.00 -0.57 0.00 0.00 43.02 38.70 3i2z s PHE 41 CO 0.00 -3.22 1.95 1.63 -0.10 0.00 0.00 175.22 175.48 3i2z n LYS 42 N 4.12 3.33 -4.16 0.44 4.76 -1.26 -4.89 118.16 120.50 3i2z n LYS 42 Ca 0.13 -3.24 -0.11 0.00 -2.87 0.00 0.00 58.31 52.23 3i2z n LYS 42 Cb 0.40 -3.08 -0.10 0.00 -1.84 0.00 0.00 35.03 30.41 3i2z n LYS 42 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 3i2z s THR 43 N 1.58 0.05 0.01 -0.18 -1.32 -1.26 -4.84 115.64 109.69 3i2z s THR 43 Ca 0.43 -1.93 0.00 0.00 -1.21 0.00 0.00 61.69 58.99 3i2z s THR 43 Cb 0.10 -2.25 -0.01 0.00 -1.51 0.00 0.00 72.50 68.83 3i2z s THR 43 CO -0.02 -0.24 -0.03 -0.76 -2.21 0.00 0.00 174.62 171.37 3i2z s LEU 44 N -3.10 2.12 0.03 9.08 1.43 -1.26 -5.09 118.68 121.89 3i2z s LEU 44 Ca 0.31 -0.26 -0.12 0.00 -1.03 0.00 0.00 54.13 53.03 3i2z s LEU 44 Cb 0.07 -0.01 -0.06 0.00 0.03 0.00 0.00 46.19 46.22 3i2z s LEU 44 CO 0.07 -0.13 0.38 0.00 0.23 0.00 0.00 176.35 176.90 3i2z s ALA 45 N -0.71 3.73 0.05 4.21 0.00 -1.26 -4.70 121.76 123.07 3i2z s ALA 45 Ca -0.07 -0.33 -0.35 0.00 0.00 0.00 0.00 51.96 51.21 3i2z s ALA 45 Cb -0.05 -2.29 -0.14 0.00 0.00 0.00 0.00 23.12 20.64 3i2z s ALA 45 CO -0.00 0.54 1.63 -0.85 0.00 0.00 0.00 175.76 177.07 3i2z n GLU 46 N 1.37 1.90 0.00 0.00 0.28 -1.26 -1.91 120.64 121.01 3i2z n GLU 46 Ca -0.11 0.69 0.00 0.00 -0.16 0.00 0.00 57.16 57.57 3i2z n GLU 46 Cb 0.52 -2.45 0.00 0.00 1.43 0.00 0.00 31.44 30.95 3i2z n GLU 46 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3i2z n GLY 47 N 3.58 2.29 3.72 -1.84 0.00 0.10 -4.99 105.19 108.06 3i2z n GLY 47 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3i2z n GLY 47 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3i2z s GLN 48 N -0.92 4.15 0.08 1.61 0.74 -0.80 -4.51 119.66 120.01 3i2z s GLN 48 Ca 0.00 2.53 -0.30 0.00 0.05 0.00 0.00 55.36 57.63 3i2z s GLN 48 Cb 0.00 -3.09 -0.06 0.00 1.10 0.00 0.00 33.01 30.96 3i2z s GLN 48 CO 0.00 -0.69 1.18 0.50 -0.55 0.00 0.00 175.29 175.73 3i2z s ARG 49 N 0.92 4.46 0.11 1.67 3.52 -1.26 -0.48 118.95 127.89 3i2z s ARG 49 Ca 0.72 1.75 0.00 0.00 -0.13 0.00 0.00 55.73 58.07 3i2z s ARG 49 Cb -0.48 -3.34 -0.04 0.00 -1.56 0.00 0.00 34.95 29.54 3i2z s ARG 49 CO 0.34 -0.19 -0.02 0.14 -0.81 0.00 0.00 175.30 174.76 3i2z s VAL 50 N 0.81 0.44 0.04 7.11 -7.23 -0.29 -1.79 120.40 119.49 3i2z s VAL 50 Ca 0.57 -1.90 0.09 0.00 -1.81 0.00 0.00 61.98 58.92 3i2z s VAL 50 Cb -0.29 -1.79 -0.03 0.00 0.56 0.00 0.00 36.38 34.83 3i2z s VAL 50 CO 0.30 -0.75 -0.25 -0.70 -0.31 0.00 0.00 175.10 173.39 3i2z s GLU 51 N -3.92 1.71 0.27 4.82 2.12 0.04 -1.38 118.70 122.35 3i2z s GLU 51 Ca 0.15 -1.06 -0.21 0.00 0.36 0.00 0.00 54.97 54.21 3i2z s GLU 51 Cb 0.07 -1.86 0.02 0.00 0.26 0.00 0.00 34.13 32.62 3i2z s GLU 51 CO -0.03 0.48 0.74 -0.59 -0.54 0.00 0.00 175.26 175.32 3i2z s PHE 52 N -0.79 -0.19 0.12 5.30 -0.71 -0.23 -0.61 117.98 120.86 3i2z s PHE 52 Ca 0.11 -0.25 0.08 0.00 -1.04 0.00 0.00 56.93 55.83 3i2z s PHE 52 Cb -0.10 0.70 -0.04 0.00 -1.21 0.00 0.00 43.02 42.37 3i2z s PHE 52 CO 0.02 -1.20 -0.14 -1.21 -1.34 0.00 0.00 175.22 171.35 3i2z s GLU 53 N -3.86 1.94 -0.12 1.99 2.02 0.07 0.13 118.70 120.87 3i2z s GLU 53 Ca 0.11 -1.13 -0.20 0.00 0.02 0.00 0.00 54.97 53.77 3i2z s GLU 53 Cb -0.05 -2.19 -0.04 0.00 0.10 0.00 0.00 34.13 31.94 3i2z s GLU 53 CO 0.06 0.49 0.54 0.42 0.02 0.00 0.00 175.26 176.79 3i2z s ILE 54 N -1.23 5.14 0.19 -1.63 1.01 -1.26 0.02 121.20 123.43 3i2z s ILE 54 Ca 0.20 1.08 0.11 0.00 0.00 0.00 0.00 60.65 62.05 3i2z s ILE 54 Cb -0.11 -3.88 -0.04 0.00 0.01 0.00 0.00 42.46 38.44 3i2z s ILE 54 CO 0.12 0.28 -0.24 0.42 0.00 0.00 0.00 174.94 175.52 3i2z s THR 55 N 0.87 2.38 -0.67 2.92 -4.23 0.62 -4.92 115.64 112.60 3i2z s THR 55 Ca 0.29 -1.99 -0.24 0.00 -1.18 0.00 0.00 61.69 58.56 3i2z s THR 55 Cb -0.16 -2.13 0.06 0.00 1.34 0.00 0.00 72.50 71.60 3i2z s THR 55 CO 0.12 -0.10 1.05 0.20 -0.54 0.00 0.00 174.62 175.35 3i2z s ASN 56 N -2.62 6.19 0.00 3.99 0.01 -1.26 -0.29 114.94 120.96 3i2z s ASN 56 Ca 0.20 -0.77 0.00 0.00 -0.71 0.00 0.00 52.86 51.58 3i2z s ASN 56 Cb -0.08 -2.46 0.00 0.00 0.41 0.00 0.00 41.25 39.12 3i2z s ASN 56 CO 0.10 -1.53 0.00 0.61 -1.51 0.00 0.00 177.10 174.77 3i2z n GLY 57 N 5.32 3.46 0.33 0.66 0.00 -0.40 -4.96 105.19 109.60 3i2z n GLY 57 Ca -0.01 -2.17 0.15 0.00 0.00 0.00 0.00 46.02 43.99 3i2z n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i2z h ALA 58 N 0.75 2.26 -0.57 4.61 0.00 -2.00 -1.60 119.26 122.70 3i2z h ALA 58 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3i2z h ALA 58 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3i2z h ALA 58 CO 0.00 -0.37 0.00 1.63 0.00 0.00 0.00 179.25 180.51 3i2z n LYS 59 N -4.42 4.23 0.00 0.00 5.02 -1.26 -5.05 118.16 116.68 3i2z n LYS 59 Ca 0.04 -3.01 0.00 0.00 -2.02 0.00 0.00 58.31 53.32 3i2z n LYS 59 Cb 0.38 -2.06 0.00 0.00 -0.02 0.00 0.00 35.03 33.33 3i2z n LYS 59 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3i2z n GLY 60 N 0.73 -1.51 3.68 0.72 0.00 -0.61 -4.88 105.19 103.31 3i2z n GLY 60 Ca 0.26 -1.62 -0.47 0.00 0.00 0.00 0.00 46.02 44.19 3i2z n GLY 60 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3i2z n PRO 61 N 0.00 2.23 -4.22 1.61 -0.02 -1.26 -1.27 135.00 132.08 3i2z n PRO 61 Ca 0.00 0.81 -0.12 0.00 -2.02 0.00 0.00 63.50 62.17 3i2z n PRO 61 Cb 0.00 -2.63 -0.10 0.00 -0.02 0.00 0.00 33.50 30.75 3i2z n PRO 61 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3i2z s SER 62 N 2.63 1.06 -0.12 2.55 0.01 0.60 -2.95 113.70 117.49 3i2z s SER 62 Ca 0.86 -1.16 -0.13 0.00 1.31 0.00 0.00 55.95 56.83 3i2z s SER 62 Cb -0.66 0.14 -0.05 0.00 0.21 0.00 0.00 66.02 65.66 3i2z s SER 62 CO 0.44 -0.58 0.31 0.00 0.41 0.00 0.00 173.24 173.82 3i2z s ALA 63 N -3.71 3.65 0.19 1.44 0.00 0.44 -0.28 121.76 123.48 3i2z s ALA 63 Ca 0.22 -0.41 0.10 0.00 0.00 0.00 0.00 51.96 51.87 3i2z s ALA 63 Cb 0.06 -2.34 -0.04 0.00 0.00 0.00 0.00 23.12 20.80 3i2z s ALA 63 CO 0.02 0.25 -0.21 0.00 0.00 0.00 0.00 175.76 175.82 3i2z s ALA 64 N -0.09 2.34 -1.23 0.00 0.00 0.10 -4.60 121.76 118.28 3i2z s ALA 64 Ca 0.18 -1.60 -0.09 0.00 0.00 0.00 0.00 51.96 50.46 3i2z s ALA 64 Cb -0.14 -0.27 -0.01 0.00 0.00 0.00 0.00 23.12 22.70 3i2z s ALA 64 CO 0.06 0.34 0.71 -1.71 0.00 0.00 0.00 175.76 175.17 3i2z n ASN 65 N 0.22 -3.22 -4.65 0.00 5.15 -1.24 -0.75 115.26 110.77 3i2z n ASN 65 Ca -0.12 -0.92 -0.42 0.00 -0.60 0.00 0.00 54.58 52.52 3i2z n ASN 65 Cb 0.57 -3.75 -0.03 0.00 -0.53 0.00 0.00 39.78 36.03 3i2z n ASN 65 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3i2z s VAL 66 N -3.61 4.77 0.08 3.44 1.01 -0.50 -4.40 120.40 121.19 3i2z s VAL 66 Ca 0.24 1.80 0.09 0.00 0.00 0.00 0.00 61.98 64.10 3i2z s VAL 66 Cb -0.07 -4.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 3i2z s VAL 66 CO 0.84 -0.11 -0.25 0.42 0.00 0.00 0.00 175.10 176.00 3i2z s THR 67 N 2.93 2.01 0.36 3.92 -4.23 0.22 -1.56 115.64 119.28 3i2z s THR 67 Ca 0.40 -1.51 -0.27 0.00 -1.18 0.00 0.00 61.69 59.13 3i2z s THR 67 Cb -0.15 -1.76 -0.09 0.00 1.34 0.00 0.00 72.50 71.83 3i2z s THR 67 CO 0.07 0.17 1.20 0.00 -0.54 0.00 0.00 174.62 175.52 3i2z s ALA 68 N -0.95 3.31 -2.44 3.99 0.00 -1.26 -0.78 121.76 123.62 3i2z s ALA 68 Ca 0.11 1.05 0.20 0.00 0.00 0.00 0.00 51.96 53.31 3i2z s ALA 68 Cb -0.10 -3.40 0.15 0.00 0.00 0.00 0.00 23.12 19.77 3i2z s ALA 68 CO 0.04 -0.50 1.12 1.28 0.00 0.00 0.00 175.76 177.70