#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i5l s PRO 3 N 0.00 3.44 0.70 0.54 0.04 -1.26 -5.06 135.00 133.40 1i5l s PRO 3 Ca 0.00 1.20 -0.11 0.00 0.04 0.00 0.00 61.00 62.13 1i5l s PRO 3 Cb 0.00 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.50 1i5l s PRO 3 CO 0.00 -0.71 1.09 1.03 0.04 0.00 0.00 177.00 178.45 1i5l s ARG 4 N -3.96 2.89 0.13 4.56 0.52 -1.26 -4.90 118.95 116.93 1i5l s ARG 4 Ca 0.64 0.53 -0.29 0.00 -0.52 0.00 0.00 55.73 56.09 1i5l s ARG 4 Cb -0.16 -2.02 -0.06 0.00 0.52 0.00 0.00 34.95 33.24 1i5l s ARG 4 CO 0.34 -1.03 1.59 -1.35 0.02 0.00 0.00 175.30 174.87 1i5l h PRO 5 N -0.65 -0.49 -0.94 3.54 0.11 -2.01 -1.81 132.00 129.75 1i5l h PRO 5 Ca -0.45 0.03 0.16 0.00 0.11 0.00 0.00 66.00 65.86 1i5l h PRO 5 Cb 1.25 0.11 -0.08 0.00 0.11 0.00 0.00 31.00 32.39 1i5l h PRO 5 CO 0.63 -0.33 0.60 -0.07 -0.21 0.00 0.00 178.00 178.62 1i5l h LEU 6 N -0.51 0.67 -1.60 2.35 3.38 -2.01 0.53 115.31 118.13 1i5l h LEU 6 Ca 0.07 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1i5l h LEU 6 Cb 0.63 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1i5l h LEU 6 CO -0.36 0.31 -0.16 0.44 0.09 0.00 0.00 178.44 178.76 1i5l h ASP 7 N 0.69 0.05 0.21 -0.43 3.32 -1.70 -2.37 116.42 116.19 1i5l h ASP 7 Ca 0.49 -0.01 -0.15 0.00 0.02 0.00 0.00 57.03 57.38 1i5l h ASP 7 Cb 0.83 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 1i5l h ASP 7 CO -0.25 0.22 -0.56 0.58 -1.72 0.00 0.00 179.24 177.51 1i5l h VAL 8 N 0.06 1.35 0.08 -1.35 2.07 -0.57 -2.09 116.25 115.79 1i5l h VAL 8 Ca 0.01 -1.86 -0.00 0.00 0.82 0.00 0.00 66.70 65.67 1i5l h VAL 8 Cb 0.32 1.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1i5l h VAL 8 CO 0.02 0.56 -0.04 -0.07 0.02 0.00 0.00 177.57 178.07 1i5l h LEU 9 N 0.28 -0.09 -1.42 2.57 3.38 -1.26 -2.74 115.31 116.03 1i5l h LEU 9 Ca 0.00 -0.25 0.14 0.00 0.09 0.00 0.00 57.88 57.86 1i5l h LEU 9 Cb 1.07 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.79 1i5l h LEU 9 CO 0.10 0.20 0.53 -1.13 0.09 0.00 0.00 178.44 178.23 1i5l h ASN 10 N -0.39 0.54 0.00 -0.43 -0.73 -1.37 0.39 115.58 113.59 1i5l h ASN 10 Ca -0.01 0.03 0.00 0.00 1.87 0.00 0.00 56.30 58.19 1i5l h ASN 10 Cb 0.33 -0.08 0.00 0.00 0.27 0.00 0.00 38.32 38.84 1i5l h ASN 10 CO 0.02 0.29 0.00 -1.14 -0.37 0.00 0.00 177.43 176.22 1i5l n ARG 11 N -4.52 0.58 -0.16 6.67 0.63 -0.80 -2.19 116.66 116.88 1i5l n ARG 11 Ca 0.15 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 57.12 1i5l n ARG 11 Cb 0.47 -1.31 0.06 0.00 0.45 0.00 0.00 32.46 32.12 1i5l n ARG 11 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1i5l n SER 12 N -0.81 1.36 -4.68 6.15 7.64 0.14 -5.05 113.62 118.36 1i5l n SER 12 Ca 0.09 -2.32 -0.31 0.00 1.01 0.00 0.00 58.87 57.34 1i5l n SER 12 Cb 0.04 -0.23 0.16 0.00 -1.01 0.00 0.00 64.21 63.17 1i5l n SER 12 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1i5l s LEU 13 N -1.38 2.81 0.00 -3.43 1.43 -0.93 -2.82 118.68 114.36 1i5l s LEU 13 Ca 0.13 2.11 0.00 0.00 -1.03 0.00 0.00 54.13 55.34 1i5l s LEU 13 Cb 0.11 -4.52 0.00 0.00 0.03 0.00 0.00 46.19 41.81 1i5l s LEU 13 CO 0.01 -2.97 0.00 0.29 0.23 0.00 0.00 176.35 173.91 1i5l n LYS 14 N -4.14 -1.94 -4.39 1.70 5.02 0.10 -4.90 118.16 109.61 1i5l n LYS 14 Ca 0.11 0.27 -0.25 0.00 -2.02 0.00 0.00 58.31 56.41 1i5l n LYS 14 Cb 0.52 -3.84 -0.09 0.00 -0.02 0.00 0.00 35.03 31.60 1i5l n LYS 14 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1i5l s SER 15 N -1.09 4.09 0.40 4.39 1.04 -1.13 -4.86 113.70 116.54 1i5l s SER 15 Ca 0.00 -1.11 -0.23 0.00 0.48 0.00 0.00 55.95 55.08 1i5l s SER 15 Cb 0.00 -0.47 -0.09 0.00 0.10 0.00 0.00 66.02 65.56 1i5l s SER 15 CO 0.00 -0.33 1.01 -2.16 0.98 0.00 0.00 173.24 172.74 1i5l s PRO 16 N -3.73 4.23 0.27 4.02 0.04 -1.26 -1.33 135.00 137.24 1i5l s PRO 16 Ca 0.36 1.38 -0.08 0.00 0.04 0.00 0.00 61.00 62.69 1i5l s PRO 16 Cb 0.03 -2.48 -0.01 0.00 0.04 0.00 0.00 34.50 32.08 1i5l s PRO 16 CO 0.19 -0.06 0.43 0.14 0.04 0.00 0.00 177.00 177.75 1i5l s VAL 17 N -1.78 0.00 0.01 -0.36 -7.23 0.22 -2.31 120.40 108.95 1i5l s VAL 17 Ca 0.58 -1.54 0.06 0.00 -1.81 0.00 0.00 61.98 59.27 1i5l s VAL 17 Cb -0.18 -2.39 -0.02 0.00 0.56 0.00 0.00 36.38 34.35 1i5l s VAL 17 CO 0.23 0.00 -0.19 -0.63 -0.31 0.00 0.00 175.10 174.20 1i5l s ILE 18 N -3.73 1.50 -0.12 -0.62 1.01 0.11 -1.39 121.20 117.95 1i5l s ILE 18 Ca 0.27 -0.96 -0.02 0.00 0.00 0.00 0.00 60.65 59.93 1i5l s ILE 18 Cb 0.00 -1.28 0.04 0.00 0.01 0.00 0.00 42.46 41.24 1i5l s ILE 18 CO 0.13 0.29 0.02 -0.69 0.00 0.00 0.00 174.94 174.69 1i5l s VAL 19 N -0.61 0.38 -0.08 2.92 1.01 -0.75 -1.19 120.40 122.08 1i5l s VAL 19 Ca 0.07 -0.15 -0.16 0.00 0.00 0.00 0.00 61.98 61.73 1i5l s VAL 19 Cb -0.08 -0.72 -0.05 0.00 0.00 0.00 0.00 36.38 35.54 1i5l s VAL 19 CO 0.00 0.04 0.42 -0.60 0.00 0.00 0.00 175.10 174.97 1i5l s ARG 20 N 1.95 4.19 0.34 2.72 3.52 -0.81 -1.92 118.95 128.93 1i5l s ARG 20 Ca 0.03 0.38 0.07 0.00 -0.13 0.00 0.00 55.73 56.08 1i5l s ARG 20 Cb -0.14 -3.36 -0.03 0.00 -1.56 0.00 0.00 34.95 29.86 1i5l s ARG 20 CO -0.07 0.35 0.31 -0.51 -0.81 0.00 0.00 175.30 174.57 1i5l s LEU 21 N 0.01 3.58 -0.51 -0.88 1.43 0.25 -0.95 118.68 121.62 1i5l s LEU 21 Ca 0.24 -0.52 -0.27 0.00 -1.03 0.00 0.00 54.13 52.55 1i5l s LEU 21 Cb -0.15 -2.21 -0.03 0.00 0.03 0.00 0.00 46.19 43.83 1i5l s LEU 21 CO 0.10 -0.39 1.96 -0.54 0.23 0.00 0.00 176.35 177.72 1i5l s LYS 22 N -4.01 2.70 0.00 1.70 1.02 -0.06 -1.83 119.74 119.26 1i5l s LYS 22 Ca 0.42 1.00 0.00 0.00 0.02 0.00 0.00 55.97 57.41 1i5l s LYS 22 Cb -0.06 -4.38 0.00 0.00 -0.52 0.00 0.00 37.83 32.87 1i5l s LYS 22 CO 0.27 -2.62 0.00 0.41 -0.92 0.00 0.00 175.35 172.49 1i5l n GLY 23 N 5.69 1.22 0.00 -3.33 0.00 -1.26 -4.84 105.19 102.67 1i5l n GLY 23 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1i5l n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i5l n GLY 24 N 0.00 1.68 3.77 -0.02 0.00 -0.76 -5.10 105.19 104.75 1i5l n GLY 24 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1i5l n GLY 24 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1i5l s ARG 25 N -0.10 3.88 0.06 1.61 0.52 -1.26 -4.76 118.95 118.90 1i5l s ARG 25 Ca 0.00 1.99 0.05 0.00 -0.52 0.00 0.00 55.73 57.24 1i5l s ARG 25 Cb 0.00 -2.62 -0.03 0.00 0.52 0.00 0.00 34.95 32.82 1i5l s ARG 25 CO 0.00 -0.51 -0.13 -1.21 0.02 0.00 0.00 175.30 173.47 1i5l s GLU 26 N -2.40 0.79 -0.03 3.54 2.02 -1.23 -0.59 118.70 120.81 1i5l s GLU 26 Ca 0.59 -0.87 0.06 0.00 0.02 0.00 0.00 54.97 54.77 1i5l s GLU 26 Cb -0.34 -0.77 -0.01 0.00 0.10 0.00 0.00 34.13 33.11 1i5l s GLU 26 CO 0.43 0.17 -0.21 -0.06 0.02 0.00 0.00 175.26 175.61 1i5l s PHE 27 N -1.18 2.01 -0.14 1.61 0.40 -0.81 0.94 117.98 120.80 1i5l s PHE 27 Ca -0.02 -0.49 -0.04 0.00 -0.60 0.00 0.00 56.93 55.78 1i5l s PHE 27 Cb -0.09 -1.31 -0.03 0.00 0.51 0.00 0.00 43.02 42.09 1i5l s PHE 27 CO 0.02 -0.11 0.02 0.50 0.70 0.00 0.00 175.22 176.34 1i5l s ARG 28 N -0.28 3.54 0.03 0.44 6.06 -0.50 -1.80 118.95 126.44 1i5l s ARG 28 Ca 0.02 -0.41 -0.23 0.00 -2.50 0.00 0.00 55.73 52.61 1i5l s ARG 28 Cb -0.10 -2.98 0.08 0.00 0.06 0.00 0.00 34.95 32.00 1i5l s ARG 28 CO 0.01 0.43 1.07 0.41 -2.50 0.00 0.00 175.30 174.72 1i5l n GLY 29 N 3.01 0.38 3.60 8.12 0.00 -0.48 -1.67 105.19 118.15 1i5l n GLY 29 Ca -0.18 -1.05 -0.36 0.00 0.00 0.00 0.00 46.02 44.43 1i5l n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i5l s THR 30 N -2.06 5.00 -0.80 2.61 2.01 -1.10 0.69 115.64 121.99 1i5l s THR 30 Ca 0.25 0.05 -0.25 0.00 0.31 0.00 0.00 61.69 62.05 1i5l s THR 30 Cb -0.01 -3.32 -0.00 0.00 0.01 0.00 0.00 72.50 69.17 1i5l s THR 30 CO 0.01 0.35 1.68 -0.22 -0.69 0.00 0.00 174.62 175.75 1i5l s LEU 31 N 1.15 3.27 -0.03 4.42 2.96 -0.44 -1.49 118.68 128.53 1i5l s LEU 31 Ca 0.06 -0.46 0.05 0.00 -0.22 0.00 0.00 54.13 53.57 1i5l s LEU 31 Cb -0.14 -2.55 -0.24 0.00 0.50 0.00 0.00 46.19 43.75 1i5l s LEU 31 CO 0.05 -2.19 0.73 -0.78 -1.32 0.00 0.00 176.35 172.83 1i5l h ASP 32 N 11.88 0.15 -5.02 3.68 3.58 -1.74 0.33 116.42 129.27 1i5l h ASP 32 Ca -0.08 -0.27 0.02 0.00 0.42 0.00 0.00 57.03 57.12 1i5l h ASP 32 Cb 1.06 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 42.05 1i5l h ASP 32 CO 1.27 1.24 0.27 -0.83 -2.88 0.00 0.00 179.24 178.31 1i5l s GLY 33 N -5.11 0.18 -0.22 -0.78 0.00 -1.21 -4.83 107.32 95.36 1i5l s GLY 33 Ca -0.08 -0.56 -0.34 0.00 0.00 0.00 0.00 44.72 43.75 1i5l s GLY 33 CO 0.82 -0.15 1.23 -2.52 0.00 0.00 0.00 173.10 172.48 1i5l s TYR 34 N -2.92 -0.12 0.44 1.90 -0.85 -1.26 -2.36 117.35 112.18 1i5l s TYR 34 Ca 0.14 0.13 0.03 0.00 -0.52 0.00 0.00 57.07 56.85 1i5l s TYR 34 Cb -0.05 0.50 -0.02 0.00 0.38 0.00 0.00 41.96 42.77 1i5l s TYR 34 CO 0.09 -0.17 0.10 0.16 -1.52 0.00 0.00 175.55 174.22 1i5l s ASP 35 N -1.79 3.16 0.45 -0.18 1.47 -1.13 -4.97 116.67 113.66 1i5l s ASP 35 Ca 0.08 -1.68 0.14 0.00 1.18 0.00 0.00 52.55 52.28 1i5l s ASP 35 Cb -0.01 0.52 1.06 0.00 -0.34 0.00 0.00 42.92 44.15 1i5l s ASP 35 CO -0.05 -0.92 2.00 -0.29 0.68 0.00 0.00 175.17 176.60 1i5l h ILE 36 N 1.67 0.91 0.00 2.11 6.09 -2.03 0.29 117.51 126.55 1i5l h ILE 36 Ca -0.37 -0.12 0.00 0.00 -1.37 0.00 0.00 64.86 62.99 1i5l h ILE 36 Cb 1.28 0.52 0.00 0.00 0.47 0.00 0.00 36.82 39.10 1i5l h ILE 36 CO 0.61 0.07 0.00 1.41 -3.07 0.00 0.00 178.15 177.16 1i5l n HIS 37 N -4.47 0.00 -1.60 2.19 8.25 -1.26 -4.88 115.22 113.45 1i5l n HIS 37 Ca 0.08 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.40 1i5l n HIS 37 Cb 0.34 -0.04 -0.05 0.00 1.12 0.00 0.00 29.99 31.36 1i5l n HIS 37 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 1i5l n MET 38 N -1.04 -0.98 -2.13 -0.41 1.56 0.10 -4.29 117.12 109.93 1i5l n MET 38 Ca 0.21 0.91 -0.39 0.00 -0.27 0.00 0.00 57.70 58.15 1i5l n MET 38 Cb 0.12 -5.03 -0.01 0.00 2.15 0.00 0.00 33.22 30.45 1i5l n MET 38 CO 0.00 0.00 0.00 -0.80 -0.73 0.00 0.00 175.97 174.44 1i5l s ASN 39 N -2.75 6.39 0.30 6.12 0.01 -1.26 -3.97 114.94 119.78 1i5l s ASN 39 Ca 0.00 2.56 0.09 0.00 -0.71 0.00 0.00 52.86 54.80 1i5l s ASN 39 Cb 0.00 -2.63 -0.06 0.00 0.41 0.00 0.00 41.25 38.97 1i5l s ASN 39 CO 0.00 -0.79 -0.12 -0.76 -1.51 0.00 0.00 177.10 173.93 1i5l s LEU 40 N -2.43 2.61 -0.02 0.60 1.43 0.03 -2.83 118.68 118.07 1i5l s LEU 40 Ca 0.57 -1.14 0.04 0.00 -1.03 0.00 0.00 54.13 52.57 1i5l s LEU 40 Cb -0.36 -0.89 -0.00 0.00 0.03 0.00 0.00 46.19 44.96 1i5l s LEU 40 CO 0.46 -0.18 -0.13 -0.69 0.23 0.00 0.00 176.35 176.05 1i5l s VAL 41 N -2.73 1.04 0.04 -1.59 1.01 -0.99 -0.09 120.40 117.09 1i5l s VAL 41 Ca 0.30 -0.53 0.04 0.00 0.00 0.00 0.00 61.98 61.79 1i5l s VAL 41 Cb 0.01 -0.89 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 1i5l s VAL 41 CO 0.14 0.30 -0.11 -0.76 0.00 0.00 0.00 175.10 174.67 1i5l s LEU 42 N -0.06 2.21 -0.01 3.92 1.43 -0.71 -2.03 118.68 123.43 1i5l s LEU 42 Ca 0.00 -0.49 0.07 0.00 -1.03 0.00 0.00 54.13 52.68 1i5l s LEU 42 Cb -0.08 -0.40 -0.02 0.00 0.03 0.00 0.00 46.19 45.72 1i5l s LEU 42 CO 0.00 -0.07 -0.24 -0.76 0.23 0.00 0.00 176.35 175.52 1i5l s LEU 43 N -1.34 2.22 -0.63 1.79 1.43 -0.55 -1.82 118.68 119.77 1i5l s LEU 43 Ca -0.03 -0.43 -0.13 0.00 -1.03 0.00 0.00 54.13 52.50 1i5l s LEU 43 Cb -0.09 -1.38 0.02 0.00 0.03 0.00 0.00 46.19 44.77 1i5l s LEU 43 CO 0.01 0.31 0.64 0.47 0.23 0.00 0.00 176.35 178.02 1i5l n ASP 44 N 2.29 -6.41 -4.45 2.29 9.92 0.33 -2.70 116.55 117.83 1i5l n ASP 44 Ca -0.16 -0.22 -0.28 0.00 -0.53 0.00 0.00 54.79 53.60 1i5l n ASP 44 Cb 0.51 -3.37 -0.12 0.00 -0.64 0.00 0.00 41.12 37.51 1i5l n ASP 44 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1i5l s ALA 45 N -2.53 2.59 0.05 2.24 0.00 -0.57 -4.44 121.76 119.10 1i5l s ALA 45 Ca 0.15 -1.55 0.09 0.00 0.00 0.00 0.00 51.96 50.65 1i5l s ALA 45 Cb -0.03 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 1i5l s ALA 45 CO 0.83 0.48 -0.25 -1.21 0.00 0.00 0.00 175.76 175.60 1i5l s GLU 46 N -2.52 1.66 -0.33 0.00 2.02 -0.67 -1.54 118.70 117.32 1i5l s GLU 46 Ca 0.20 -1.10 -0.20 0.00 0.02 0.00 0.00 54.97 53.89 1i5l s GLU 46 Cb -0.09 -1.85 -0.01 0.00 0.10 0.00 0.00 34.13 32.29 1i5l s GLU 46 CO 0.10 0.47 0.60 -2.00 0.02 0.00 0.00 175.26 174.45 1i5l s GLU 47 N -1.32 3.78 0.29 1.61 2.12 -1.19 -1.40 118.70 122.59 1i5l s GLU 47 Ca 0.11 0.12 0.06 0.00 0.36 0.00 0.00 54.97 55.62 1i5l s GLU 47 Cb -0.10 -3.77 -0.02 0.00 0.26 0.00 0.00 34.13 30.50 1i5l s GLU 47 CO 0.02 -0.63 0.37 0.42 -0.54 0.00 0.00 175.26 174.90 1i5l s ILE 48 N 2.58 4.44 -0.24 -3.70 1.01 0.27 -2.85 121.20 122.71 1i5l s ILE 48 Ca 0.23 -1.11 -0.03 0.00 0.00 0.00 0.00 60.65 59.75 1i5l s ILE 48 Cb -0.15 -3.52 0.12 0.00 0.01 0.00 0.00 42.46 38.91 1i5l s ILE 48 CO 0.13 -0.25 0.29 -1.58 0.00 0.00 0.00 174.94 173.53 1i5l s GLN 49 N -4.03 0.28 -1.25 2.79 0.74 -0.98 -3.51 119.66 113.69 1i5l s GLN 49 Ca 0.39 0.20 -0.07 0.00 0.05 0.00 0.00 55.36 55.93 1i5l s GLN 49 Cb -0.09 -0.84 -0.01 0.00 1.10 0.00 0.00 33.01 33.18 1i5l s GLN 49 CO 0.29 -0.76 0.69 0.09 -0.55 0.00 0.00 175.29 175.05 1i5l n ASN 50 N 5.33 -2.83 -3.40 6.67 4.13 -1.26 -3.05 115.26 120.84 1i5l n ASN 50 Ca -0.04 -0.91 -0.14 0.00 1.68 0.00 0.00 54.58 55.16 1i5l n ASN 50 Cb 0.49 -3.74 0.01 0.00 -1.54 0.00 0.00 39.78 35.01 1i5l n ASN 50 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1i5l n GLY 51 N -1.66 -1.21 3.48 7.41 0.00 -1.26 -5.01 105.19 106.95 1i5l n GLY 51 Ca -0.21 0.51 0.01 0.00 0.00 0.00 0.00 46.02 46.33 1i5l n GLY 51 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1i5l s GLU 52 N -4.25 0.20 0.82 1.61 2.12 -1.17 -5.18 118.70 112.85 1i5l s GLU 52 Ca 0.13 0.42 -0.13 0.00 0.36 0.00 0.00 54.97 55.75 1i5l s GLU 52 Cb -0.04 0.16 0.08 0.00 0.26 0.00 0.00 34.13 34.59 1i5l s GLU 52 CO 0.81 -0.05 1.16 0.28 -0.54 0.00 0.00 175.26 176.92 1i5l n VAL 53 N 4.09 1.84 0.00 3.70 0.31 -1.26 -2.31 118.33 124.70 1i5l n VAL 53 Ca -0.13 -0.20 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 1i5l n VAL 53 Cb 0.55 -1.16 0.00 0.00 -0.91 0.00 0.00 33.84 32.33 1i5l n VAL 53 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1i5l n VAL 54 N -3.34 0.00 -3.10 2.52 0.31 -1.13 -4.86 118.33 108.72 1i5l n VAL 54 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 1i5l n VAL 54 Cb 0.51 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.44 1i5l n VAL 54 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1i5l n ARG 55 N -0.64 1.56 -3.51 5.55 1.74 -1.23 -4.94 116.66 115.19 1i5l n ARG 55 Ca 0.00 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.92 1i5l n ARG 55 Cb 0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.39 1i5l n ARG 55 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1i5l s LYS 56 N -1.30 1.03 -0.19 5.56 1.02 -1.26 -3.19 119.74 121.40 1i5l s LYS 56 Ca 0.00 0.14 -0.16 0.00 0.02 0.00 0.00 55.97 55.98 1i5l s LYS 56 Cb 0.00 0.48 0.05 0.00 -0.52 0.00 0.00 37.83 37.85 1i5l s LYS 56 CO 0.00 -0.34 0.50 0.14 -0.92 0.00 0.00 175.35 174.72 1i5l s VAL 57 N -1.54 -0.00 0.39 3.17 -7.23 -0.59 -5.01 120.40 109.59 1i5l s VAL 57 Ca -0.08 0.02 0.13 0.00 -1.81 0.00 0.00 61.98 60.23 1i5l s VAL 57 Cb -0.00 -0.70 0.34 0.00 0.56 0.00 0.00 36.38 36.58 1i5l s VAL 57 CO 0.06 0.01 1.89 1.23 -0.31 0.00 0.00 175.10 177.98 1i5l h GLY 58 N 5.78 0.94 -3.14 2.32 0.00 -1.95 -1.52 103.07 105.50 1i5l h GLY 58 Ca -0.29 -0.24 0.04 0.00 0.00 0.00 0.00 47.33 46.84 1i5l h GLY 58 CO 0.21 0.07 0.33 -1.35 0.00 0.00 0.00 176.54 175.81 1i5l s SER 59 N -5.86 -0.48 0.00 0.19 1.04 -1.26 0.12 113.70 107.45 1i5l s SER 59 Ca -0.09 -0.01 -0.12 0.00 0.48 0.00 0.00 55.95 56.21 1i5l s SER 59 Cb 0.21 0.51 0.01 0.00 0.10 0.00 0.00 66.02 66.86 1i5l s SER 59 CO 0.78 -0.82 0.25 0.68 0.98 0.00 0.00 173.24 175.10 1i5l s VAL 60 N -3.48 0.07 -0.20 5.02 -7.23 -0.76 -4.99 120.40 108.84 1i5l s VAL 60 Ca 0.03 -0.59 0.01 0.00 -1.81 0.00 0.00 61.98 59.62 1i5l s VAL 60 Cb -0.01 -0.61 0.03 0.00 0.56 0.00 0.00 36.38 36.35 1i5l s VAL 60 CO -0.11 -0.33 -0.17 -0.69 -0.31 0.00 0.00 175.10 173.50 1i5l s VAL 61 N -1.54 2.03 -0.29 1.32 1.01 -1.26 -1.74 120.40 119.93 1i5l s VAL 61 Ca -0.13 -1.10 -0.08 0.00 0.00 0.00 0.00 61.98 60.68 1i5l s VAL 61 Cb -0.05 -1.93 -0.00 0.00 0.00 0.00 0.00 36.38 34.39 1i5l s VAL 61 CO 0.02 0.37 0.11 -0.63 0.00 0.00 0.00 175.10 174.97 1i5l s ILE 62 N 1.26 4.25 -0.04 2.22 1.01 0.87 -4.95 121.20 125.83 1i5l s ILE 62 Ca 0.01 -0.52 -0.32 0.00 0.00 0.00 0.00 60.65 59.82 1i5l s ILE 62 Cb -0.15 -3.16 -0.11 0.00 0.01 0.00 0.00 42.46 39.06 1i5l s ILE 62 CO -0.11 0.11 1.93 0.54 0.00 0.00 0.00 174.94 177.41 1i5l n ARG 63 N 4.92 2.49 -0.27 2.79 5.12 -1.26 -0.79 116.66 129.65 1i5l n ARG 63 Ca -0.14 0.91 0.26 0.00 -1.93 0.00 0.00 57.85 56.95 1i5l n ARG 63 Cb 0.49 -2.81 0.62 0.00 -1.16 0.00 0.00 32.46 29.60 1i5l n ARG 63 CO 0.00 0.00 0.00 0.78 -1.93 0.00 0.00 177.63 176.48 1i5l h GLY 64 N 9.84 0.55 1.52 -0.13 0.00 -1.75 0.34 103.07 113.45 1i5l h GLY 64 Ca -0.49 -0.10 0.02 0.00 0.00 0.00 0.00 47.33 46.76 1i5l h GLY 64 CO 0.95 -0.04 0.22 -1.80 0.00 0.00 0.00 176.54 175.86 1i5l h ASP 65 N 0.20 0.00 0.83 0.19 -0.00 -1.88 -1.97 116.42 113.79 1i5l h ASP 65 Ca 0.52 0.00 -0.05 0.00 -0.00 0.00 0.00 57.03 57.49 1i5l h ASP 65 Cb 1.66 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.98 1i5l h ASP 65 CO -0.13 0.00 -1.21 0.41 -0.00 0.00 0.00 179.24 178.31 1i5l n THR 66 N -3.20 0.75 -2.41 2.25 -1.04 0.12 -4.96 114.28 105.79 1i5l n THR 66 Ca -0.01 -0.59 -0.41 0.00 -2.04 0.00 0.00 64.05 61.01 1i5l n THR 66 Cb 0.30 -0.43 -0.04 0.00 -1.82 0.00 0.00 70.33 68.34 1i5l n THR 66 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1i5l s VAL 67 N -3.24 3.41 -0.19 12.58 1.01 -0.74 -0.88 120.40 132.35 1i5l s VAL 67 Ca -0.02 1.37 -0.11 0.00 0.00 0.00 0.00 61.98 63.22 1i5l s VAL 67 Cb 0.10 -3.87 -0.08 0.00 0.00 0.00 0.00 36.38 32.52 1i5l s VAL 67 CO 0.80 0.31 -0.27 0.52 0.00 0.00 0.00 175.10 176.46 1i5l n VAL 68 N 1.40 1.23 -3.68 2.92 0.31 -0.12 -4.82 118.33 115.58 1i5l n VAL 68 Ca 0.00 -0.18 -0.13 0.00 -0.01 0.00 0.00 64.34 64.03 1i5l n VAL 68 Cb 0.44 -1.88 -0.06 0.00 -0.91 0.00 0.00 33.84 31.43 1i5l n VAL 68 CO 0.00 0.00 0.00 0.72 -1.32 0.00 0.00 176.83 176.23 1i5l s PHE 69 N -2.46 -0.24 -0.10 3.52 -0.12 -1.16 -5.01 117.98 112.40 1i5l s PHE 69 Ca -0.28 0.18 0.01 0.00 -0.05 0.00 0.00 56.93 56.80 1i5l s PHE 69 Cb 0.09 0.20 0.02 0.00 -0.63 0.00 0.00 43.02 42.70 1i5l s PHE 69 CO 0.36 -0.56 -0.14 0.08 -0.05 0.00 0.00 175.22 174.91 1i5l s VAL 70 N -2.50 1.39 0.00 -2.49 1.01 -1.26 -1.93 120.40 114.63 1i5l s VAL 70 Ca -0.05 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.37 1i5l s VAL 70 Cb -0.01 -1.29 -0.01 0.00 0.00 0.00 0.00 36.38 35.08 1i5l s VAL 70 CO -0.03 0.42 -0.05 -0.55 0.00 0.00 0.00 175.10 174.90 1i5l s SER 71 N 1.05 0.56 0.14 3.32 0.15 -0.33 -4.97 113.70 113.61 1i5l s SER 71 Ca -0.06 -0.17 -0.31 0.00 0.70 0.00 0.00 55.95 56.11 1i5l s SER 71 Cb -0.15 -0.04 -0.10 0.00 -1.71 0.00 0.00 66.02 64.03 1i5l s SER 71 CO -0.02 -0.00 1.59 -2.16 1.20 0.00 0.00 173.24 173.85 1i5l s PRO 72 N -0.39 4.21 0.00 5.44 0.04 -1.26 0.07 135.00 143.11 1i5l s PRO 72 Ca -0.01 2.35 0.10 0.00 0.04 0.00 0.00 61.00 63.48 1i5l s PRO 72 Cb -0.03 -3.27 0.08 0.00 0.04 0.00 0.00 34.50 31.32 1i5l s PRO 72 CO -0.00 -0.64 0.81 0.00 0.04 0.00 0.00 177.00 177.21