#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i5l s ARG 4 N 0.00 3.47 0.03 -0.52 0.52 -1.26 -4.96 118.95 116.23 1i5l s ARG 4 Ca 0.00 -0.55 -0.06 0.00 -0.52 0.00 0.00 55.73 54.60 1i5l s ARG 4 Cb 0.00 -2.82 -0.01 0.00 0.52 0.00 0.00 34.95 32.63 1i5l s ARG 4 CO 0.00 0.35 0.99 -2.30 0.02 0.00 0.00 175.30 174.37 1i5l n PRO 5 N -1.30 -0.09 -0.16 3.54 -0.02 -1.26 -0.06 135.00 135.65 1i5l n PRO 5 Ca -0.07 0.99 0.23 0.00 -2.02 0.00 0.00 63.50 62.63 1i5l n PRO 5 Cb 0.56 -1.47 0.64 0.00 -0.02 0.00 0.00 33.50 33.21 1i5l n PRO 5 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1i5l h LEU 6 N 0.00 0.14 -0.87 2.45 3.38 -2.00 0.25 115.31 118.66 1i5l h LEU 6 Ca 0.03 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1i5l h LEU 6 Cb 0.08 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1i5l h LEU 6 CO -0.19 0.06 0.00 0.44 0.09 0.00 0.00 178.44 178.84 1i5l h ASP 7 N 0.14 0.00 0.72 -0.43 3.32 -0.87 -2.53 116.42 116.78 1i5l h ASP 7 Ca 0.40 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 57.23 1i5l h ASP 7 Cb 1.35 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.86 1i5l h ASP 7 CO -0.06 0.00 -1.40 0.58 -1.72 0.00 0.00 179.24 176.64 1i5l h VAL 8 N 0.00 0.77 -0.08 -1.35 2.07 0.16 -3.09 116.25 114.73 1i5l h VAL 8 Ca 0.00 -2.41 -0.02 0.00 0.82 0.00 0.00 66.70 65.09 1i5l h VAL 8 Cb 0.58 2.29 -0.00 0.00 -1.52 0.00 0.00 31.29 32.64 1i5l h VAL 8 CO 0.00 0.44 -0.02 -0.07 0.02 0.00 0.00 177.57 177.94 1i5l h LEU 9 N 0.00 0.15 -1.49 2.57 3.38 -1.30 -2.82 115.31 115.80 1i5l h LEU 9 Ca -0.18 -0.36 0.14 0.00 0.09 0.00 0.00 57.88 57.57 1i5l h LEU 9 Cb 1.74 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 42.40 1i5l h LEU 9 CO 0.07 0.48 0.52 -1.13 0.09 0.00 0.00 178.44 178.47 1i5l h ASN 10 N -0.18 0.47 0.04 -0.43 -0.73 -1.56 0.56 115.58 113.76 1i5l h ASN 10 Ca 0.02 0.03 0.00 0.00 1.87 0.00 0.00 56.30 58.22 1i5l h ASN 10 Cb 0.41 -0.07 0.00 0.00 0.27 0.00 0.00 38.32 38.93 1i5l h ASN 10 CO 0.01 0.25 0.00 -1.14 -0.37 0.00 0.00 177.43 176.17 1i5l n ARG 11 N -4.50 0.70 -0.04 6.67 0.63 -1.07 -2.83 116.66 116.21 1i5l n ARG 11 Ca 0.15 0.01 0.06 0.00 -0.92 0.00 0.00 57.85 57.15 1i5l n ARG 11 Cb 0.50 -1.50 0.08 0.00 0.45 0.00 0.00 32.46 31.99 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 -1.03 2.20 -4.76 6.15 7.64 0.19 -5.03 113.62 118.98 1i5l n SER 12 Ca 0.17 -2.65 -0.37 0.00 1.01 0.00 0.00 58.87 57.03 1i5l n SER 12 Cb 0.09 -0.26 0.01 0.00 -1.01 0.00 0.00 64.21 63.04 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 -2.11 3.90 -0.57 -3.43 1.43 -1.13 -2.73 118.68 114.04 1i5l s LEU 13 Ca 0.19 2.39 0.00 0.00 -1.03 0.00 0.00 54.13 55.68 1i5l s LEU 13 Cb 0.17 -4.34 0.00 0.00 0.03 0.00 0.00 46.19 42.04 1i5l s LEU 13 CO 0.02 -1.18 0.00 0.29 0.23 0.00 0.00 176.35 175.71 1i5l n LYS 14 N -0.85 -1.54 -4.59 1.70 5.02 0.63 -4.97 118.16 113.56 1i5l n LYS 14 Ca 0.09 0.63 -0.28 0.00 -2.02 0.00 0.00 58.31 56.74 1i5l n LYS 14 Cb 0.48 -4.89 -0.11 0.00 -0.02 0.00 0.00 35.03 30.49 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 -2.25 3.91 0.26 4.39 1.04 -1.10 -4.89 113.70 115.06 1i5l s SER 15 Ca 0.00 -1.35 -0.21 0.00 0.48 0.00 0.00 55.95 54.86 1i5l s SER 15 Cb 0.00 -0.40 -0.09 0.00 0.10 0.00 0.00 66.02 65.63 1i5l s SER 15 CO 0.00 -0.45 0.80 -2.16 0.98 0.00 0.00 173.24 172.41 1i5l s PRO 16 N -3.72 4.34 0.21 4.02 0.04 -1.26 -1.06 135.00 137.58 1i5l s PRO 16 Ca 0.35 1.01 -0.07 0.00 0.04 0.00 0.00 61.00 62.33 1i5l s PRO 16 Cb 0.10 -2.82 -0.02 0.00 0.04 0.00 0.00 34.50 31.80 1i5l s PRO 16 CO 0.18 0.34 0.30 0.14 0.04 0.00 0.00 177.00 178.00 1i5l s VAL 17 N -1.59 0.02 -0.03 -0.36 -7.23 0.11 -2.51 120.40 108.81 1i5l s VAL 17 Ca 0.46 -1.64 0.06 0.00 -1.81 0.00 0.00 61.98 59.05 1i5l s VAL 17 Cb -0.17 -2.24 -0.01 0.00 0.56 0.00 0.00 36.38 34.52 1i5l s VAL 17 CO 0.21 -0.07 -0.22 -0.63 -0.31 0.00 0.00 175.10 174.08 1i5l s ILE 18 N -4.06 1.79 -0.07 -0.62 1.01 0.11 -2.30 121.20 117.06 1i5l s ILE 18 Ca 0.28 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 60.01 1i5l s ILE 18 Cb 0.03 -1.50 0.01 0.00 0.01 0.00 0.00 42.46 41.01 1i5l s ILE 18 CO 0.08 0.51 -0.15 -0.69 0.00 0.00 0.00 174.94 174.69 1i5l s VAL 19 N -0.35 1.35 -0.01 2.92 1.01 -0.84 -0.51 120.40 123.98 1i5l s VAL 19 Ca 0.04 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.43 1i5l s VAL 19 Cb -0.10 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 35.04 1i5l s VAL 19 CO 0.01 0.40 -0.06 -0.60 0.00 0.00 0.00 175.10 174.85 1i5l s ARG 20 N 0.50 2.60 0.36 2.72 3.52 -0.58 -1.07 118.95 127.01 1i5l s ARG 20 Ca -0.14 -0.68 0.09 0.00 -0.13 0.00 0.00 55.73 54.87 1i5l s ARG 20 Cb -0.15 -2.53 -0.06 0.00 -1.56 0.00 0.00 34.95 30.64 1i5l s ARG 20 CO 0.04 0.61 -0.02 -0.51 -0.81 0.00 0.00 175.30 174.62 1i5l s LEU 21 N -1.33 2.87 -0.97 -0.88 1.43 -0.16 -1.80 118.68 117.84 1i5l s LEU 21 Ca 0.16 -1.15 -0.24 0.00 -1.03 0.00 0.00 54.13 51.88 1i5l s LEU 21 Cb -0.11 -1.14 -0.06 0.00 0.03 0.00 0.00 46.19 44.91 1i5l s LEU 21 CO 0.07 -0.28 1.96 -0.54 0.23 0.00 0.00 176.35 177.78 1i5l s LYS 22 N -3.68 2.51 0.00 1.70 1.02 -0.34 -1.89 119.74 119.05 1i5l s LYS 22 Ca 0.34 -0.50 0.00 0.00 0.02 0.00 0.00 55.97 55.84 1i5l s LYS 22 Cb 0.03 -5.10 0.00 0.00 -0.52 0.00 0.00 37.83 32.24 1i5l s LYS 22 CO 0.18 -3.58 0.00 0.41 -0.92 0.00 0.00 175.35 171.45 1i5l n GLY 23 N 6.58 -0.07 1.14 -3.33 0.00 -1.26 -4.90 105.19 103.35 1i5l n GLY 23 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.44 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 1.14 3.75 -0.02 0.00 -0.79 -5.04 105.19 104.22 1i5l n GLY 24 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.62 4.64 0.05 1.61 1.81 -1.26 -4.82 118.95 120.36 1i5l s ARG 25 Ca 0.00 1.74 0.06 0.00 -1.72 0.00 0.00 55.73 55.81 1i5l s ARG 25 Cb 0.00 -3.24 -0.02 0.00 -0.45 0.00 0.00 34.95 31.24 1i5l s ARG 25 CO 0.00 0.18 -0.17 -1.21 -0.68 0.00 0.00 175.30 173.43 1i5l s GLU 26 N -0.96 1.07 0.31 3.54 2.02 -1.23 -0.99 118.70 122.46 1i5l s GLU 26 Ca 0.46 -0.87 0.09 0.00 0.02 0.00 0.00 54.97 54.68 1i5l s GLU 26 Cb -0.30 -1.14 -0.05 0.00 0.10 0.00 0.00 34.13 32.74 1i5l s GLU 26 CO 0.37 0.28 -0.00 -0.06 0.02 0.00 0.00 175.26 175.88 1i5l s PHE 27 N -0.90 2.59 -0.02 1.61 0.40 -0.23 0.26 117.98 121.70 1i5l s PHE 27 Ca 0.03 -0.34 -0.02 0.00 -0.60 0.00 0.00 56.93 56.01 1i5l s PHE 27 Cb -0.09 -1.34 0.00 0.00 0.51 0.00 0.00 43.02 42.10 1i5l s PHE 27 CO 0.02 0.54 0.04 0.50 0.70 0.00 0.00 175.22 177.02 1i5l s ARG 28 N -3.70 0.06 0.00 0.44 3.52 -0.52 -1.98 118.95 116.77 1i5l s ARG 28 Ca 0.33 0.04 0.00 0.00 -0.13 0.00 0.00 55.73 55.97 1i5l s ARG 28 Cb -0.03 0.03 0.00 0.00 -1.56 0.00 0.00 34.95 33.39 1i5l s ARG 28 CO 0.19 -0.01 0.00 0.41 -0.81 0.00 0.00 175.30 175.09 1i5l n GLY 29 N 3.00 -0.80 3.67 8.12 0.00 -0.97 -0.91 105.19 117.29 1i5l n GLY 29 Ca -0.13 -1.25 -0.41 0.00 0.00 0.00 0.00 46.02 44.23 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 -2.00 4.93 -0.19 2.61 2.01 -1.00 -0.71 115.64 121.29 1i5l s THR 30 Ca 0.00 1.47 -0.29 0.00 0.31 0.00 0.00 61.69 63.18 1i5l s THR 30 Cb 0.00 -4.07 -0.03 0.00 0.01 0.00 0.00 72.50 68.41 1i5l s THR 30 CO 0.00 0.06 1.60 -0.22 -0.69 0.00 0.00 174.62 175.37 1i5l s LEU 31 N 2.05 3.97 -0.19 4.42 2.96 -0.22 -1.67 118.68 130.01 1i5l s LEU 31 Ca 0.35 1.71 0.09 0.00 -0.22 0.00 0.00 54.13 56.05 1i5l s LEU 31 Cb -0.16 -3.53 -0.17 0.00 0.50 0.00 0.00 46.19 42.82 1i5l s LEU 31 CO 0.12 -1.18 -0.06 -0.67 -1.32 0.00 0.00 176.35 173.24 1i5l n ASP 32 N 8.15 1.58 -2.98 3.68 2.03 0.47 -0.27 116.55 129.20 1i5l n ASP 32 Ca 0.18 -0.05 -0.12 0.00 0.52 0.00 0.00 54.79 55.32 1i5l n ASP 32 Cb 0.45 0.32 -0.00 0.00 -0.72 0.00 0.00 41.12 41.17 1i5l n ASP 32 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1i5l s GLY 33 N -5.53 0.95 0.00 0.27 0.00 -1.14 -4.79 107.32 97.09 1i5l s GLY 33 Ca -0.18 -1.15 -0.30 0.00 0.00 0.00 0.00 44.72 43.10 1i5l s GLY 33 CO 0.59 -0.65 1.23 -2.52 0.00 0.00 0.00 173.10 171.76 1i5l s TYR 34 N -2.52 -0.06 0.05 1.90 -0.85 -1.26 -3.05 117.35 111.56 1i5l s TYR 34 Ca 0.23 -0.07 -0.01 0.00 -0.52 0.00 0.00 57.07 56.70 1i5l s TYR 34 Cb -0.03 0.56 0.00 0.00 0.38 0.00 0.00 41.96 42.87 1i5l s TYR 34 CO 0.16 -0.35 0.07 -0.40 -1.52 0.00 0.00 175.55 173.51 1i5l n ASP 35 N -0.47 -0.21 -0.16 -0.18 5.75 -1.15 -4.94 116.55 115.18 1i5l n ASP 35 Ca -0.08 -1.24 -0.02 0.00 -0.01 0.00 0.00 54.79 53.44 1i5l n ASP 35 Cb 0.62 0.38 0.06 0.00 -1.03 0.00 0.00 41.12 41.16 1i5l n ASP 35 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 1i5l h ILE 36 N 1.13 0.62 0.00 2.12 6.09 -2.04 -0.90 117.51 124.54 1i5l h ILE 36 Ca -0.04 -0.05 0.00 0.00 -1.37 0.00 0.00 64.86 63.40 1i5l h ILE 36 Cb 0.16 0.47 0.00 0.00 0.47 0.00 0.00 36.82 37.92 1i5l h ILE 36 CO 0.05 0.03 0.00 1.41 -3.07 0.00 0.00 178.15 176.57 1i5l n HIS 37 N -5.21 0.00 -2.22 2.19 8.25 -1.26 -4.87 115.22 112.10 1i5l n HIS 37 Ca 0.06 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.45 1i5l n HIS 37 Cb 0.27 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.38 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 -0.98 -0.81 -2.51 -0.41 1.56 -0.34 -4.36 117.12 109.26 1i5l n MET 38 Ca 0.21 0.33 -0.41 0.00 -0.27 0.00 0.00 57.70 57.56 1i5l n MET 38 Cb 0.09 -4.14 -0.04 0.00 2.15 0.00 0.00 33.22 31.28 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 -2.74 7.30 0.30 6.12 0.01 -1.26 -3.88 114.94 120.79 1i5l s ASN 39 Ca 0.02 2.17 0.09 0.00 -0.71 0.00 0.00 52.86 54.44 1i5l s ASN 39 Cb -0.01 -2.62 -0.05 0.00 0.41 0.00 0.00 41.25 38.99 1i5l s ASN 39 CO 0.03 -0.14 0.02 -0.76 -1.51 0.00 0.00 177.10 174.74 1i5l s LEU 40 N -1.01 3.13 -0.07 0.60 1.43 -0.51 -2.95 118.68 119.30 1i5l s LEU 40 Ca 0.46 -0.78 -0.01 0.00 -1.03 0.00 0.00 54.13 52.77 1i5l s LEU 40 Cb -0.30 -1.60 0.03 0.00 0.03 0.00 0.00 46.19 44.34 1i5l s LEU 40 CO 0.38 -0.12 0.00 -0.69 0.23 0.00 0.00 176.35 176.15 1i5l s VAL 41 N -2.40 0.36 0.12 -1.59 1.01 -1.17 -0.82 120.40 115.91 1i5l s VAL 41 Ca 0.34 0.13 0.10 0.00 0.00 0.00 0.00 61.98 62.55 1i5l s VAL 41 Cb -0.04 -0.52 -0.04 0.00 0.00 0.00 0.00 36.38 35.78 1i5l s VAL 41 CO 0.20 0.26 -0.26 -0.76 0.00 0.00 0.00 175.10 174.54 1i5l s LEU 42 N 1.96 2.31 0.11 3.92 1.43 -0.59 -0.40 118.68 127.43 1i5l s LEU 42 Ca 0.05 -0.73 0.09 0.00 -1.03 0.00 0.00 54.13 52.51 1i5l s LEU 42 Cb -0.12 -1.18 -0.04 0.00 0.03 0.00 0.00 46.19 44.88 1i5l s LEU 42 CO -0.05 0.17 -0.21 -0.76 0.23 0.00 0.00 176.35 175.73 1i5l s LEU 43 N -1.98 2.56 -1.15 1.79 1.43 -0.67 -1.66 118.68 119.00 1i5l s LEU 43 Ca 0.13 -0.60 -0.28 0.00 -1.03 0.00 0.00 54.13 52.34 1i5l s LEU 43 Cb -0.10 -1.44 0.03 0.00 0.03 0.00 0.00 46.19 44.71 1i5l s LEU 43 CO 0.05 0.19 0.70 0.47 0.23 0.00 0.00 176.35 178.00 1i5l n ASP 44 N 0.94 -4.55 -4.77 2.29 9.92 0.19 -2.37 116.55 118.20 1i5l n ASP 44 Ca -0.16 -1.19 -0.26 0.00 -0.53 0.00 0.00 54.79 52.64 1i5l n ASP 44 Cb 0.53 -2.12 -0.06 0.00 -0.64 0.00 0.00 41.12 38.83 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 -3.45 3.49 0.06 2.24 0.00 -0.89 -4.51 121.76 118.70 1i5l s ALA 45 Ca 0.44 -1.24 0.09 0.00 0.00 0.00 0.00 51.96 51.24 1i5l s ALA 45 Cb -0.22 -1.29 -0.03 0.00 0.00 0.00 0.00 23.12 21.58 1i5l s ALA 45 CO 0.94 0.50 -0.25 -1.21 0.00 0.00 0.00 175.76 175.74 1i5l s GLU 46 N -3.06 1.62 -0.24 0.00 2.02 -0.09 -1.96 118.70 116.98 1i5l s GLU 46 Ca 0.30 -1.10 -0.19 0.00 0.02 0.00 0.00 54.97 54.00 1i5l s GLU 46 Cb -0.10 -1.82 -0.03 0.00 0.10 0.00 0.00 34.13 32.28 1i5l s GLU 46 CO 0.22 0.46 0.56 -2.00 0.02 0.00 0.00 175.26 174.53 1i5l s GLU 47 N -1.36 4.12 -0.02 1.61 2.12 -1.26 -1.44 118.70 122.47 1i5l s GLU 47 Ca 0.11 0.44 0.05 0.00 0.36 0.00 0.00 54.97 55.93 1i5l s GLU 47 Cb -0.10 -3.63 -0.03 0.00 0.26 0.00 0.00 34.13 30.64 1i5l s GLU 47 CO 0.03 -0.32 -0.16 0.42 -0.54 0.00 0.00 175.26 174.68 1i5l s ILE 48 N 2.20 2.89 -0.23 -3.70 1.01 0.14 -0.96 121.20 122.55 1i5l s ILE 48 Ca 0.24 -0.90 -0.01 0.00 0.00 0.00 0.00 60.65 59.98 1i5l s ILE 48 Cb -0.16 -2.15 0.07 0.00 0.01 0.00 0.00 42.46 40.23 1i5l s ILE 48 CO 0.09 0.51 0.00 -1.58 0.00 0.00 0.00 174.94 173.96 1i5l s GLN 49 N -0.96 1.14 -0.43 2.79 2.00 -0.04 -3.52 119.66 120.64 1i5l s GLN 49 Ca 0.13 -0.82 -0.01 0.00 -2.00 0.00 0.00 55.36 52.66 1i5l s GLN 49 Cb -0.11 -2.35 0.00 0.00 0.80 0.00 0.00 33.01 31.35 1i5l s GLN 49 CO 0.02 -0.68 0.30 0.09 -0.50 0.00 0.00 175.29 174.53 1i5l n ASN 50 N 4.82 -2.37 0.00 6.67 5.03 -1.26 -0.07 115.26 128.08 1i5l n ASN 50 Ca -0.09 -0.51 0.00 0.00 0.87 0.00 0.00 54.58 54.85 1i5l n ASN 50 Cb 0.45 -0.80 0.00 0.00 -1.02 0.00 0.00 39.78 38.41 1i5l n ASN 50 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1i5l n GLY 51 N -1.11 2.50 3.80 7.41 0.00 -1.26 -4.99 105.19 111.54 1i5l n GLY 51 Ca -0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 1i5l n GLY 51 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1i5l s GLU 52 N 0.00 3.08 0.46 1.61 0.41 0.90 -5.10 118.70 120.06 1i5l s GLU 52 Ca 0.00 -0.52 -0.19 0.00 -0.41 0.00 0.00 54.97 53.84 1i5l s GLU 52 Cb 0.00 -2.86 -0.10 0.00 -1.78 0.00 0.00 34.13 29.39 1i5l s GLU 52 CO 0.00 0.62 0.97 0.08 -0.49 0.00 0.00 175.26 176.44 1i5l s VAL 53 N -1.28 4.40 0.00 2.63 1.01 -1.26 -0.86 120.40 125.04 1i5l s VAL 53 Ca 0.26 1.38 0.00 0.00 0.00 0.00 0.00 61.98 63.62 1i5l s VAL 53 Cb -0.12 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.63 1i5l s VAL 53 CO 0.18 -0.44 0.00 0.52 0.00 0.00 0.00 175.10 175.36 1i5l n VAL 54 N -0.98 0.00 -1.38 2.92 0.31 -0.14 -4.85 118.33 114.22 1i5l n VAL 54 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 1i5l n VAL 54 Cb 0.54 -0.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.97 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 -2.50 0.00 -3.53 5.55 1.74 -1.23 -4.98 116.66 111.70 1i5l n ARG 55 Ca 0.00 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 57.01 1i5l n ARG 55 Cb 0.50 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.92 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 2.16 0.68 -0.30 5.56 1.02 -1.26 -4.26 119.74 123.34 1i5l s LYS 56 Ca 0.00 -0.23 -0.15 0.00 0.02 0.00 0.00 55.97 55.61 1i5l s LYS 56 Cb 0.00 0.31 0.16 0.00 -0.52 0.00 0.00 37.83 37.78 1i5l s LYS 56 CO 0.00 -0.29 0.96 0.14 -0.92 0.00 0.00 175.35 175.24 1i5l s VAL 57 N -2.86 -0.38 0.47 3.17 -7.23 -0.83 -4.97 120.40 107.77 1i5l s VAL 57 Ca 0.06 0.00 0.32 0.00 -1.81 0.00 0.00 61.98 60.55 1i5l s VAL 57 Cb -0.01 -1.00 0.52 0.00 0.56 0.00 0.00 36.38 36.45 1i5l s VAL 57 CO -0.08 0.00 1.68 1.23 -0.31 0.00 0.00 175.10 177.62 1i5l h GLY 58 N 7.10 0.86 -4.33 2.32 0.00 -1.95 -2.37 103.07 104.70 1i5l h GLY 58 Ca -0.20 -0.09 0.18 0.00 0.00 0.00 0.00 47.33 47.23 1i5l h GLY 58 CO 0.12 -0.22 0.75 -1.35 0.00 0.00 0.00 176.54 175.84 1i5l s SER 59 N -4.66 -0.20 0.03 0.19 1.04 -1.26 0.55 113.70 109.39 1i5l s SER 59 Ca -0.07 0.14 -0.03 0.00 0.48 0.00 0.00 55.95 56.48 1i5l s SER 59 Cb 0.27 0.17 -0.02 0.00 0.10 0.00 0.00 66.02 66.55 1i5l s SER 59 CO 0.83 -0.23 0.02 0.68 0.98 0.00 0.00 173.24 175.52 1i5l s VAL 60 N -1.59 0.13 -0.27 5.02 -7.23 -0.66 -4.99 120.40 110.81 1i5l s VAL 60 Ca 0.05 -1.06 0.02 0.00 -1.81 0.00 0.00 61.98 59.18 1i5l s VAL 60 Cb -0.01 -0.63 0.06 0.00 0.56 0.00 0.00 36.38 36.36 1i5l s VAL 60 CO -0.04 -0.58 -0.09 -0.69 -0.31 0.00 0.00 175.10 173.39 1i5l s VAL 61 N -2.10 2.32 -0.20 1.32 1.01 -1.26 -1.53 120.40 119.96 1i5l s VAL 61 Ca -0.10 -1.58 -0.11 0.00 0.00 0.00 0.00 61.98 60.19 1i5l s VAL 61 Cb -0.05 -2.36 -0.05 0.00 0.00 0.00 0.00 36.38 33.93 1i5l s VAL 61 CO -0.03 -0.03 0.19 -0.63 0.00 0.00 0.00 175.10 174.60 1i5l s ILE 62 N 1.13 5.36 0.07 2.22 1.01 -0.00 -4.96 121.20 126.03 1i5l s ILE 62 Ca -0.08 0.29 -0.31 0.00 0.00 0.00 0.00 60.65 60.56 1i5l s ILE 62 Cb -0.20 -3.53 -0.07 0.00 0.01 0.00 0.00 42.46 38.68 1i5l s ILE 62 CO -0.04 0.39 1.39 -0.13 0.00 0.00 0.00 174.94 176.56 1i5l s ARG 63 N 0.61 4.31 0.24 2.79 1.81 -1.26 -1.42 118.95 126.02 1i5l s ARG 63 Ca 0.10 2.03 -0.06 0.00 -1.72 0.00 0.00 55.73 56.08 1i5l s ARG 63 Cb -0.12 -3.39 0.28 0.00 -0.45 0.00 0.00 34.95 31.27 1i5l s ARG 63 CO 0.01 -0.49 1.88 0.78 -0.68 0.00 0.00 175.30 176.81 1i5l h GLY 64 N 7.44 1.29 0.26 -3.53 0.00 -1.76 -1.51 103.07 105.25 1i5l h GLY 64 Ca -0.41 -0.44 0.12 0.00 0.00 0.00 0.00 47.33 46.61 1i5l h GLY 64 CO 0.88 0.37 0.75 -1.80 0.00 0.00 0.00 176.54 176.74 1i5l h ASP 65 N 1.11 0.00 1.17 0.19 -0.00 -1.88 0.24 116.42 117.24 1i5l h ASP 65 Ca 0.35 0.00 -0.04 0.00 -0.00 0.00 0.00 57.03 57.34 1i5l h ASP 65 Cb 0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 39.33 1i5l h ASP 65 CO -0.12 0.00 -0.86 0.74 -0.00 0.00 0.00 179.24 179.00 1i5l h THR 66 N 0.00 0.17 -3.98 2.25 2.02 -1.66 -3.48 112.91 108.23 1i5l h THR 66 Ca 0.20 -1.30 -0.48 0.00 0.77 0.00 0.00 66.41 65.60 1i5l h THR 66 Cb 1.71 1.78 0.02 0.00 -1.74 0.00 0.00 68.15 69.91 1i5l h THR 66 CO -0.00 0.10 0.41 -0.69 0.37 0.00 0.00 175.52 175.71 1i5l s VAL 67 N -3.21 3.71 -0.11 3.16 1.01 0.83 -1.20 120.40 124.59 1i5l s VAL 67 Ca 0.01 1.27 -0.04 0.00 0.00 0.00 0.00 61.98 63.22 1i5l s VAL 67 Cb 0.08 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.77 1i5l s VAL 67 CO 0.77 -0.03 -0.13 0.52 0.00 0.00 0.00 175.10 176.23 1i5l n VAL 68 N -0.20 0.60 -3.61 2.92 0.31 -0.75 -4.80 118.33 112.80 1i5l n VAL 68 Ca 0.06 -0.17 -0.09 0.00 -0.01 0.00 0.00 64.34 64.13 1i5l n VAL 68 Cb 0.50 -1.52 -0.02 0.00 -0.91 0.00 0.00 33.84 31.89 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 -2.20 -0.38 -0.05 3.52 -0.12 -1.20 -5.01 117.98 112.55 1i5l s PHE 69 Ca -0.15 0.07 -0.01 0.00 -0.05 0.00 0.00 56.93 56.79 1i5l s PHE 69 Cb 0.06 0.62 0.03 0.00 -0.63 0.00 0.00 43.02 43.09 1i5l s PHE 69 CO 0.20 -0.98 0.01 0.08 -0.05 0.00 0.00 175.22 174.48 1i5l s VAL 70 N -3.75 0.23 -0.04 -2.49 1.01 -1.26 -1.53 120.40 112.57 1i5l s VAL 70 Ca 0.06 0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.23 1i5l s VAL 70 Cb -0.03 -0.38 -0.00 0.00 0.00 0.00 0.00 36.38 35.97 1i5l s VAL 70 CO -0.04 0.21 -0.16 -0.55 0.00 0.00 0.00 175.10 174.55 1i5l s SER 71 N 1.63 1.99 0.32 3.32 0.15 0.34 -4.93 113.70 116.52 1i5l s SER 71 Ca -0.01 -0.32 -0.29 0.00 0.70 0.00 0.00 55.95 56.03 1i5l s SER 71 Cb -0.13 -0.56 -0.10 0.00 -1.71 0.00 0.00 66.02 63.51 1i5l s SER 71 CO -0.03 0.13 1.40 -2.16 1.20 0.00 0.00 173.24 173.78 1i5l s PRO 72 N 0.09 4.26 -0.22 5.44 0.04 -1.26 0.04 135.00 143.39 1i5l s PRO 72 Ca -0.04 2.35 -0.00 0.00 0.04 0.00 0.00 61.00 63.35 1i5l s PRO 72 Cb -0.11 -3.05 0.06 0.00 0.04 0.00 0.00 34.50 31.43 1i5l s PRO 72 CO 0.02 -0.35 -0.04 0.00 0.04 0.00 0.00 177.00 176.66 1i5l s ALA 73 N -0.82 1.73 -2.41 8.56 0.00 -1.04 -4.79 121.76 122.98 1i5l s ALA 73 Ca 0.53 -1.15 0.29 0.00 0.00 0.00 0.00 51.96 51.62 1i5l s ALA 73 Cb -0.42 -1.33 1.20 0.00 0.00 0.00 0.00 23.12 22.56 1i5l s ALA 73 CO 0.53 -1.11 1.83 -0.35 0.00 0.00 0.00 175.76 176.66