#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i5l n ARG 4 N 0.00 2.55 -0.06 -0.52 5.12 -1.26 -4.59 116.66 117.90 1i5l n ARG 4 Ca 0.00 0.01 -0.08 0.00 -1.93 0.00 0.00 57.85 55.85 1i5l n ARG 4 Cb 0.00 -1.11 -0.02 0.00 -1.16 0.00 0.00 32.46 30.17 1i5l n ARG 4 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 1i5l h PRO 5 N 0.00 0.03 -0.24 5.56 0.11 -2.06 -0.48 132.00 134.92 1i5l h PRO 5 Ca -0.12 -0.00 0.07 0.00 0.11 0.00 0.00 66.00 66.06 1i5l h PRO 5 Cb 1.24 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1i5l h PRO 5 CO 0.00 0.02 0.20 -0.07 -0.21 0.00 0.00 178.00 177.94 1i5l h LEU 6 N 0.03 0.00 -0.33 2.35 3.38 -2.01 -0.60 115.31 118.13 1i5l h LEU 6 Ca 0.11 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.98 1i5l h LEU 6 Cb 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1i5l h LEU 6 CO -0.22 0.00 -0.22 0.44 0.09 0.00 0.00 178.44 178.53 1i5l h ASP 7 N 0.00 0.77 -0.69 -0.43 5.19 -1.36 -2.84 116.42 117.06 1i5l h ASP 7 Ca 0.11 -0.43 0.01 0.00 -0.62 0.00 0.00 57.03 56.10 1i5l h ASP 7 Cb 0.52 -0.21 -0.03 0.00 0.18 0.00 0.00 39.33 39.78 1i5l h ASP 7 CO -0.00 1.03 0.46 0.58 -3.12 0.00 0.00 179.24 178.19 1i5l h VAL 8 N 0.51 1.18 -0.44 -1.35 2.07 -0.45 -0.94 116.25 116.82 1i5l h VAL 8 Ca 0.07 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1i5l h VAL 8 Cb 0.77 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1i5l h VAL 8 CO 0.06 0.17 0.22 -0.07 0.02 0.00 0.00 177.57 177.97 1i5l h LEU 9 N 0.93 0.57 -0.83 2.57 3.38 -1.40 -2.79 115.31 117.75 1i5l h LEU 9 Ca 0.25 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1i5l h LEU 9 Cb -0.11 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.46 1i5l h LEU 9 CO -0.05 0.53 0.43 -1.13 0.09 0.00 0.00 178.44 178.31 1i5l h ASN 10 N 0.57 1.06 0.02 -0.43 -0.73 -1.06 -0.86 115.58 114.15 1i5l h ASN 10 Ca 0.15 -0.11 0.00 0.00 1.87 0.00 0.00 56.30 58.21 1i5l h ASN 10 Cb 0.11 -0.27 0.00 0.00 0.27 0.00 0.00 38.32 38.43 1i5l h ASN 10 CO -0.02 0.87 0.00 0.54 -0.37 0.00 0.00 177.43 178.45 1i5l n ARG 11 N -4.37 0.26 -0.00 6.67 1.74 -0.45 -1.66 116.66 118.86 1i5l n ARG 11 Ca 0.08 0.03 0.01 0.00 -0.77 0.00 0.00 57.85 57.20 1i5l n ARG 11 Cb 0.11 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.06 1i5l n ARG 11 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1i5l n SER 12 N -1.04 1.17 -4.67 0.55 7.64 -0.34 -4.96 113.62 111.96 1i5l n SER 12 Ca 0.06 -1.09 -0.48 0.00 1.01 0.00 0.00 58.87 58.38 1i5l n SER 12 Cb 0.04 -0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.19 1i5l n SER 12 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1i5l n LEU 13 N 0.10 3.16 0.00 -3.43 4.77 -0.66 -0.64 117.00 120.31 1i5l n LEU 13 Ca 0.01 1.03 0.00 0.00 -0.03 0.00 0.00 56.01 57.03 1i5l n LEU 13 Cb 0.05 -1.38 0.00 0.00 -2.33 0.00 0.00 43.42 39.76 1i5l n LEU 13 CO 0.01 -0.22 0.00 0.29 -1.33 0.00 0.00 177.39 176.14 1i5l n LYS 14 N 4.89 0.00 -3.60 3.23 5.02 0.14 -5.01 118.16 122.82 1i5l n LYS 14 Ca 0.20 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.23 1i5l n LYS 14 Cb 0.28 -1.00 -0.02 0.00 -0.02 0.00 0.00 35.03 34.27 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 -3.25 6.36 0.53 4.39 1.04 0.19 -4.79 113.70 118.17 1i5l s SER 15 Ca 0.00 0.41 -0.20 0.00 0.48 0.00 0.00 55.95 56.65 1i5l s SER 15 Cb 0.00 -2.01 -0.06 0.00 0.10 0.00 0.00 66.02 64.04 1i5l s SER 15 CO 0.00 -0.13 1.11 -2.16 0.98 0.00 0.00 173.24 173.04 1i5l s PRO 16 N -3.69 3.45 0.20 4.02 0.04 -1.26 -2.43 135.00 135.33 1i5l s PRO 16 Ca 0.39 1.55 -0.11 0.00 0.04 0.00 0.00 61.00 62.87 1i5l s PRO 16 Cb -0.10 -2.02 -0.00 0.00 0.04 0.00 0.00 34.50 32.41 1i5l s PRO 16 CO 0.31 -0.76 0.38 0.14 0.04 0.00 0.00 177.00 177.10 1i5l s VAL 17 N -1.83 0.03 -0.12 -0.36 -7.23 -0.42 -2.31 120.40 108.16 1i5l s VAL 17 Ca 0.71 -1.35 0.02 0.00 -1.81 0.00 0.00 61.98 59.55 1i5l s VAL 17 Cb -0.22 -1.98 0.01 0.00 0.56 0.00 0.00 36.38 34.76 1i5l s VAL 17 CO 0.26 -0.15 -0.17 -0.63 -0.31 0.00 0.00 175.10 174.10 1i5l s ILE 18 N -3.98 1.62 0.04 -0.62 1.01 -0.37 -2.35 121.20 116.55 1i5l s ILE 18 Ca 0.19 -0.71 0.06 0.00 0.00 0.00 0.00 60.65 60.19 1i5l s ILE 18 Cb 0.02 -1.47 -0.03 0.00 0.01 0.00 0.00 42.46 40.98 1i5l s ILE 18 CO 0.04 0.47 -0.16 -0.69 0.00 0.00 0.00 174.94 174.59 1i5l s VAL 19 N 0.99 2.97 -0.06 2.92 1.01 -0.06 -1.65 120.40 126.52 1i5l s VAL 19 Ca -0.06 -1.13 0.04 0.00 0.00 0.00 0.00 61.98 60.83 1i5l s VAL 19 Cb -0.15 -2.27 -0.00 0.00 0.00 0.00 0.00 36.38 33.96 1i5l s VAL 19 CO -0.02 0.33 -0.19 -0.60 0.00 0.00 0.00 175.10 174.61 1i5l s ARG 20 N -1.50 2.17 0.07 2.72 3.52 -0.65 -0.35 118.95 124.94 1i5l s ARG 20 Ca 0.15 -0.69 0.03 0.00 -0.13 0.00 0.00 55.73 55.10 1i5l s ARG 20 Cb -0.11 -1.80 -0.04 0.00 -1.56 0.00 0.00 34.95 31.45 1i5l s ARG 20 CO 0.06 0.22 0.04 -0.51 -0.81 0.00 0.00 175.30 174.31 1i5l s LEU 21 N 0.16 3.67 0.11 -0.88 1.43 -0.65 -0.64 118.68 121.89 1i5l s LEU 21 Ca -0.09 -0.05 -0.35 0.00 -1.03 0.00 0.00 54.13 52.61 1i5l s LEU 21 Cb -0.14 -2.33 -0.17 0.00 0.03 0.00 0.00 46.19 43.59 1i5l s LEU 21 CO 0.04 0.19 1.19 0.29 0.23 0.00 0.00 176.35 178.29 1i5l n LYS 22 N 0.64 0.91 0.00 1.70 5.02 0.18 -2.50 118.16 124.11 1i5l n LYS 22 Ca -0.10 0.32 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 1i5l n LYS 22 Cb 0.52 -1.86 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 1i5l n LYS 22 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1i5l n GLY 23 N 2.13 2.90 0.00 0.72 0.00 -1.26 -4.73 105.19 104.95 1i5l n GLY 23 Ca 0.17 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 0.88 3.75 -0.02 0.00 -1.04 -5.15 105.19 103.61 1i5l n GLY 24 Ca 0.00 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1i5l n GLY 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i5l n ARG 25 N 0.00 2.60 -4.65 1.61 1.74 -1.26 -4.82 116.66 111.88 1i5l n ARG 25 Ca 0.00 0.92 -0.26 0.00 -0.77 0.00 0.00 57.85 57.74 1i5l n ARG 25 Cb 0.00 -2.65 -0.14 0.00 -1.02 0.00 0.00 32.46 28.65 1i5l n ARG 25 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1i5l s GLU 26 N -1.41 1.41 0.06 5.56 2.02 -1.21 -1.63 118.70 123.49 1i5l s GLU 26 Ca 0.58 -0.96 0.08 0.00 0.02 0.00 0.00 54.97 54.69 1i5l s GLU 26 Cb -0.50 -1.53 -0.03 0.00 0.10 0.00 0.00 34.13 32.17 1i5l s GLU 26 CO 0.57 0.39 -0.22 -0.06 0.02 0.00 0.00 175.26 175.97 1i5l s PHE 27 N -0.81 1.89 -0.11 1.61 0.40 0.53 0.19 117.98 121.69 1i5l s PHE 27 Ca 0.08 -0.39 -0.02 0.00 -0.60 0.00 0.00 56.93 56.00 1i5l s PHE 27 Cb -0.09 -1.11 0.04 0.00 0.51 0.00 0.00 43.02 42.37 1i5l s PHE 27 CO 0.02 0.13 0.01 1.03 0.70 0.00 0.00 175.22 177.10 1i5l s ARG 28 N -1.35 0.70 0.01 0.44 0.52 -0.88 -0.88 118.95 117.52 1i5l s ARG 28 Ca 0.08 -0.09 -0.19 0.00 -0.52 0.00 0.00 55.73 55.01 1i5l s ARG 28 Cb -0.09 -1.38 0.06 0.00 0.52 0.00 0.00 34.95 34.06 1i5l s ARG 28 CO 0.02 -0.41 0.88 0.41 0.02 0.00 0.00 175.30 176.22 1i5l n GLY 29 N 5.10 0.43 3.68 -3.53 0.00 -0.99 -1.82 105.19 108.06 1i5l n GLY 29 Ca -0.08 -1.00 -0.43 0.00 0.00 0.00 0.00 46.02 44.51 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 -2.08 4.62 -0.05 2.61 2.01 -0.52 -1.30 115.64 120.92 1i5l s THR 30 Ca 0.20 1.91 -0.30 0.00 0.31 0.00 0.00 61.69 63.81 1i5l s THR 30 Cb -0.01 -4.23 -0.05 0.00 0.01 0.00 0.00 72.50 68.22 1i5l s THR 30 CO 0.00 -0.03 1.50 -0.22 -0.69 0.00 0.00 174.62 175.18 1i5l s LEU 31 N 2.29 4.30 -0.24 4.42 2.96 -1.02 -0.78 118.68 130.61 1i5l s LEU 31 Ca 0.50 2.11 -0.15 0.00 -0.22 0.00 0.00 54.13 56.36 1i5l s LEU 31 Cb -0.20 -3.55 -0.11 0.00 0.50 0.00 0.00 46.19 42.84 1i5l s LEU 31 CO 0.17 -0.82 -0.31 -0.67 -1.32 0.00 0.00 176.35 173.40 1i5l n ASP 32 N 6.35 1.94 -0.87 3.68 2.03 0.11 -0.68 116.55 129.11 1i5l n ASP 32 Ca 0.15 0.35 0.00 0.00 0.52 0.00 0.00 54.79 55.82 1i5l n ASP 32 Cb 0.43 -0.81 0.00 0.00 -0.72 0.00 0.00 41.12 40.02 1i5l n ASP 32 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1i5l n GLY 33 N 1.33 3.41 0.00 0.27 0.00 -1.20 -4.71 105.19 104.30 1i5l n GLY 33 Ca -0.41 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.23 1i5l n GLY 33 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1i5l n TYR 34 N 0.00 0.00 -3.54 1.61 0.18 -1.26 -2.91 117.16 111.24 1i5l n TYR 34 Ca 0.00 0.00 -0.17 0.00 1.88 0.00 0.00 57.90 59.61 1i5l n TYR 34 Cb 0.00 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 38.90 1i5l n TYR 34 CO 0.00 0.00 0.00 0.16 -2.08 0.00 0.00 176.86 174.94 1i5l s ASP 35 N 0.00 -0.64 0.00 9.48 1.47 -1.16 -4.97 116.67 120.85 1i5l s ASP 35 Ca 0.00 0.76 0.00 0.00 1.18 0.00 0.00 52.55 54.49 1i5l s ASP 35 Cb 0.00 0.61 0.00 0.00 -0.34 0.00 0.00 42.92 43.19 1i5l s ASP 35 CO 0.00 -0.54 0.00 -0.38 0.68 0.00 0.00 175.17 174.93 1i5l n ILE 36 N 1.08 0.00 0.21 2.11 -0.00 -1.26 0.28 119.36 121.78 1i5l n ILE 36 Ca -0.18 0.00 0.05 0.00 -0.00 0.00 0.00 62.75 62.63 1i5l n ILE 36 Cb 0.57 0.00 0.51 0.00 -0.00 0.00 0.00 39.64 40.72 1i5l n ILE 36 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.55 177.00 1i5l h HIS 37 N 0.00 0.05 0.00 1.39 3.86 -2.01 -3.46 115.15 114.98 1i5l h HIS 37 Ca 0.00 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1i5l h HIS 37 Cb 0.00 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.45 1i5l h HIS 37 CO 0.00 0.18 0.00 -0.12 0.86 0.00 0.00 177.93 178.85 1i5l n MET 38 N -4.36 0.00 -2.38 2.45 1.56 0.81 -4.59 117.12 110.61 1i5l n MET 38 Ca -0.02 0.03 -0.36 0.00 -0.27 0.00 0.00 57.70 57.08 1i5l n MET 38 Cb 0.21 -0.40 -0.02 0.00 2.15 0.00 0.00 33.22 35.16 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 -2.11 6.18 0.26 6.12 0.01 -1.24 -3.51 114.94 120.65 1i5l s ASN 39 Ca 0.00 2.13 0.06 0.00 -0.71 0.00 0.00 52.86 54.34 1i5l s ASN 39 Cb 0.00 -2.58 -0.06 0.00 0.41 0.00 0.00 41.25 39.02 1i5l s ASN 39 CO 0.00 -0.90 -0.06 -0.76 -1.51 0.00 0.00 177.10 173.87 1i5l s LEU 40 N -3.31 2.45 -0.13 0.60 1.43 -0.65 -3.00 118.68 116.07 1i5l s LEU 40 Ca 0.66 -1.18 -0.00 0.00 -1.03 0.00 0.00 54.13 52.58 1i5l s LEU 40 Cb -0.23 -0.59 0.03 0.00 0.03 0.00 0.00 46.19 45.44 1i5l s LEU 40 CO 0.27 -0.35 -0.07 -0.69 0.23 0.00 0.00 176.35 175.75 1i5l s VAL 41 N -3.07 1.07 0.01 -1.59 1.01 -1.15 -1.57 120.40 115.12 1i5l s VAL 41 Ca 0.28 -0.42 0.05 0.00 0.00 0.00 0.00 61.98 61.89 1i5l s VAL 41 Cb 0.04 -1.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.24 1i5l s VAL 41 CO 0.11 0.28 -0.12 -0.76 0.00 0.00 0.00 175.10 174.61 1i5l s LEU 42 N 1.68 2.92 0.10 3.92 1.43 -0.22 0.09 118.68 128.60 1i5l s LEU 42 Ca 0.03 -0.25 0.07 0.00 -1.03 0.00 0.00 54.13 52.95 1i5l s LEU 42 Cb -0.14 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 1i5l s LEU 42 CO -0.08 0.28 -0.09 -0.76 0.23 0.00 0.00 176.35 175.93 1i5l s LEU 43 N -1.35 3.10 -0.60 1.79 1.43 0.04 -1.68 118.68 121.41 1i5l s LEU 43 Ca 0.16 -0.36 -0.14 0.00 -1.03 0.00 0.00 54.13 52.76 1i5l s LEU 43 Cb -0.11 -1.88 0.02 0.00 0.03 0.00 0.00 46.19 44.25 1i5l s LEU 43 CO 0.06 0.18 0.56 0.47 0.23 0.00 0.00 176.35 177.85 1i5l n ASP 44 N 0.69 -4.51 -4.66 2.29 9.92 -0.60 -1.44 116.55 118.24 1i5l n ASP 44 Ca -0.13 -0.59 -0.25 0.00 -0.53 0.00 0.00 54.79 53.29 1i5l n ASP 44 Cb 0.52 -1.42 -0.08 0.00 -0.64 0.00 0.00 41.12 39.50 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 -2.24 3.31 -0.00 2.24 0.00 -0.87 -4.16 121.76 120.04 1i5l s ALA 45 Ca 0.14 -2.03 0.01 0.00 0.00 0.00 0.00 51.96 50.08 1i5l s ALA 45 Cb -0.01 -0.34 -0.00 0.00 0.00 0.00 0.00 23.12 22.76 1i5l s ALA 45 CO 0.79 -0.01 -0.03 -1.21 0.00 0.00 0.00 175.76 175.30 1i5l s GLU 46 N -3.77 0.24 0.18 0.00 2.02 -0.75 -1.70 118.70 114.92 1i5l s GLU 46 Ca 0.36 -0.14 -0.26 0.00 0.02 0.00 0.00 54.97 54.95 1i5l s GLU 46 Cb 0.02 -0.22 -0.08 0.00 0.10 0.00 0.00 34.13 33.95 1i5l s GLU 46 CO 0.20 0.06 0.81 -2.00 0.02 0.00 0.00 175.26 174.35 1i5l s GLU 47 N -0.15 4.63 0.09 1.61 2.12 -1.22 -2.07 118.70 123.71 1i5l s GLU 47 Ca 0.00 1.23 0.02 0.00 0.36 0.00 0.00 54.97 56.58 1i5l s GLU 47 Cb -0.02 -3.27 -0.04 0.00 0.26 0.00 0.00 34.13 31.07 1i5l s GLU 47 CO -0.00 0.55 -0.07 0.42 -0.54 0.00 0.00 175.26 175.62 1i5l s ILE 48 N -1.12 0.71 -0.11 -3.70 1.01 0.13 -2.76 121.20 115.36 1i5l s ILE 48 Ca 0.37 -1.77 -0.19 0.00 0.00 0.00 0.00 60.65 59.06 1i5l s ILE 48 Cb -0.24 -1.48 0.04 0.00 0.01 0.00 0.00 42.46 40.80 1i5l s ILE 48 CO 0.27 -0.76 0.46 -1.10 0.00 0.00 0.00 174.94 173.82 1i5l s GLN 49 N -3.35 0.69 -1.01 2.79 -0.21 -1.25 -3.34 119.66 113.98 1i5l s GLN 49 Ca 0.08 0.33 0.00 0.00 0.02 0.00 0.00 55.36 55.79 1i5l s GLN 49 Cb 0.02 0.32 0.00 0.00 1.00 0.00 0.00 33.01 34.35 1i5l s GLN 49 CO -0.03 -0.15 0.00 0.09 -2.12 0.00 0.00 175.29 173.08 1i5l n ASN 50 N 1.99 -3.72 0.00 5.90 4.13 -1.26 -2.82 115.26 119.49 1i5l n ASN 50 Ca -0.17 0.22 0.00 0.00 1.68 0.00 0.00 54.58 56.31 1i5l n ASN 50 Cb 0.56 -3.18 0.00 0.00 -1.54 0.00 0.00 39.78 35.62 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 -0.76 2.98 3.24 7.41 0.00 -1.26 -5.05 105.19 111.75 1i5l n GLY 51 Ca -0.14 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.03 1.25 0.00 1.61 2.02 -1.13 -5.11 118.70 117.31 1i5l s GLU 52 Ca 0.00 -1.60 -0.00 0.00 0.02 0.00 0.00 54.97 53.39 1i5l s GLU 52 Cb 0.00 0.29 -0.00 0.00 0.10 0.00 0.00 34.13 34.52 1i5l s GLU 52 CO 0.00 -0.42 0.00 0.28 0.02 0.00 0.00 175.26 175.14 1i5l n VAL 53 N -0.29 0.01 -0.21 2.63 0.31 -1.26 -3.92 118.33 115.60 1i5l n VAL 53 Ca 0.02 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 1i5l n VAL 53 Cb 0.65 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.58 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 -0.01 0.00 0.00 2.52 0.31 -1.11 -4.83 118.33 115.20 1i5l n VAL 54 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1i5l n VAL 54 Cb 0.00 0.10 0.00 0.00 -0.91 0.00 0.00 33.84 33.04 1i5l n VAL 54 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1i5l n ARG 55 N 0.00 -2.62 -3.82 5.55 0.63 -1.25 -4.93 116.66 110.23 1i5l n ARG 55 Ca 0.00 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 56.83 1i5l n ARG 55 Cb 0.00 0.00 -0.08 0.00 0.45 0.00 0.00 32.46 32.83 1i5l n ARG 55 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 1i5l s LYS 56 N -2.00 0.77 -0.26 -0.14 1.02 -1.26 -3.41 119.74 114.46 1i5l s LYS 56 Ca 0.00 -0.68 -0.11 0.00 0.02 0.00 0.00 55.97 55.20 1i5l s LYS 56 Cb 0.00 0.32 0.10 0.00 -0.52 0.00 0.00 37.83 37.73 1i5l s LYS 56 CO 0.00 -0.24 0.59 0.14 -0.92 0.00 0.00 175.35 174.92 1i5l s VAL 57 N -2.90 -0.57 0.59 3.17 -7.23 -0.69 -5.00 120.40 107.78 1i5l s VAL 57 Ca -0.02 0.04 0.30 0.00 -1.81 0.00 0.00 61.98 60.49 1i5l s VAL 57 Cb 0.00 -0.89 0.43 0.00 0.56 0.00 0.00 36.38 36.48 1i5l s VAL 57 CO -0.06 0.02 1.59 1.23 -0.31 0.00 0.00 175.10 177.57 1i5l h GLY 58 N 7.68 0.00 0.00 2.32 0.00 -1.95 -2.31 103.07 108.81 1i5l h GLY 58 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1i5l h GLY 58 CO 0.14 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.54 1i5l n SER 59 N -3.54 0.00 -3.81 0.19 3.41 -1.26 -1.55 113.62 107.07 1i5l n SER 59 Ca 0.19 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.68 1i5l n SER 59 Cb 1.22 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 65.07 1i5l n SER 59 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1i5l s VAL 60 N -2.00 0.05 -0.31 -3.33 -7.23 -0.68 -4.98 120.40 101.93 1i5l s VAL 60 Ca 0.00 -0.45 -0.01 0.00 -1.81 0.00 0.00 61.98 59.71 1i5l s VAL 60 Cb 0.00 -0.49 0.06 0.00 0.56 0.00 0.00 36.38 36.51 1i5l s VAL 60 CO 0.00 -0.25 0.01 -0.69 -0.31 0.00 0.00 175.10 173.86 1i5l s VAL 61 N -1.04 2.87 0.04 1.32 1.01 -1.26 -1.05 120.40 122.29 1i5l s VAL 61 Ca -0.11 -1.56 -0.14 0.00 0.00 0.00 0.00 61.98 60.17 1i5l s VAL 61 Cb -0.05 -2.72 -0.06 0.00 0.00 0.00 0.00 36.38 33.55 1i5l s VAL 61 CO 0.02 -0.20 0.45 -0.63 0.00 0.00 0.00 175.10 174.74 1i5l s ILE 62 N 1.20 4.98 -0.24 2.22 1.01 -0.61 -4.93 121.20 124.83 1i5l s ILE 62 Ca -0.03 0.81 -0.27 0.00 0.00 0.00 0.00 60.65 61.17 1i5l s ILE 62 Cb -0.20 -3.73 0.00 0.00 0.01 0.00 0.00 42.46 38.55 1i5l s ILE 62 CO -0.02 0.48 0.93 -0.13 0.00 0.00 0.00 174.94 176.19 1i5l s ARG 63 N -1.36 4.21 0.55 2.79 1.81 -1.26 -1.63 118.95 124.06 1i5l s ARG 63 Ca 0.28 1.13 0.44 0.00 -1.72 0.00 0.00 55.73 55.85 1i5l s ARG 63 Cb -0.16 -3.64 1.65 0.00 -0.45 0.00 0.00 34.95 32.34 1i5l s ARG 63 CO 0.16 -0.57 1.69 0.78 -0.68 0.00 0.00 175.30 176.67 1i5l h GLY 64 N 9.31 0.03 2.00 -3.53 0.00 -1.81 0.71 103.07 109.78 1i5l h GLY 64 Ca -0.21 -0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 1i5l h GLY 64 CO 0.92 -0.01 -0.03 -1.80 0.00 0.00 0.00 176.54 175.63 1i5l h ASP 65 N 0.00 0.00 0.74 0.19 -0.00 -1.87 -2.26 116.42 113.23 1i5l h ASP 65 Ca 0.76 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.79 1i5l h ASP 65 Cb 3.04 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 42.37 1i5l h ASP 65 CO -0.02 0.03 -0.77 0.41 -0.00 0.00 0.00 179.24 178.89 1i5l n THR 66 N -3.50 0.31 -2.65 2.25 -1.04 0.25 -4.92 114.28 104.98 1i5l n THR 66 Ca -0.02 -0.28 -0.39 0.00 -2.04 0.00 0.00 64.05 61.31 1i5l n THR 66 Cb 0.13 -0.04 -0.05 0.00 -1.82 0.00 0.00 70.33 68.54 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 -3.19 3.87 -0.12 12.58 1.01 -0.85 0.48 120.40 134.18 1i5l s VAL 67 Ca 0.05 1.78 -0.08 0.00 0.00 0.00 0.00 61.98 63.72 1i5l s VAL 67 Cb 0.13 -4.09 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 1i5l s VAL 67 CO 0.75 0.34 -0.19 0.52 0.00 0.00 0.00 175.10 176.52 1i5l n VAL 68 N 1.07 1.03 -3.56 2.92 0.31 0.19 -4.70 118.33 115.60 1i5l n VAL 68 Ca -0.00 -0.04 -0.14 0.00 -0.01 0.00 0.00 64.34 64.15 1i5l n VAL 68 Cb 0.47 -1.81 -0.05 0.00 -0.91 0.00 0.00 33.84 31.54 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 -2.36 -0.44 -0.02 3.52 -0.12 -1.17 -5.01 117.98 112.37 1i5l s PHE 69 Ca -0.19 0.48 0.04 0.00 -0.05 0.00 0.00 56.93 57.21 1i5l s PHE 69 Cb 0.06 0.37 -0.01 0.00 -0.63 0.00 0.00 43.02 42.81 1i5l s PHE 69 CO 0.26 -0.67 -0.15 0.08 -0.05 0.00 0.00 175.22 174.69 1i5l s VAL 70 N -2.57 1.22 -0.09 -2.49 1.01 -1.26 -1.64 120.40 114.58 1i5l s VAL 70 Ca -0.05 -0.64 -0.05 0.00 0.00 0.00 0.00 61.98 61.24 1i5l s VAL 70 Cb -0.01 -1.03 0.04 0.00 0.00 0.00 0.00 36.38 35.38 1i5l s VAL 70 CO -0.03 0.35 0.22 -0.94 0.00 0.00 0.00 175.10 174.71 1i5l s SER 71 N -0.22 -0.23 0.22 3.32 1.04 -0.66 -4.99 113.70 112.18 1i5l s SER 71 Ca 0.03 0.47 -0.32 0.00 0.48 0.00 0.00 55.95 56.61 1i5l s SER 71 Cb -0.07 0.38 -0.12 0.00 0.10 0.00 0.00 66.02 66.31 1i5l s SER 71 CO 0.00 -0.15 1.69 -2.65 0.98 0.00 0.00 173.24 173.12 1i5l n PRO 72 N 3.97 2.73 -3.31 4.02 -0.02 -1.26 -1.23 135.00 139.90 1i5l n PRO 72 Ca -0.23 0.98 -0.07 0.00 -2.02 0.00 0.00 63.50 62.16 1i5l n PRO 72 Cb 0.54 -2.81 -0.06 0.00 -0.02 0.00 0.00 33.50 31.14 1i5l n PRO 72 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1i5l s ALA 73 N 0.95 -1.30 0.23 3.55 0.00 -0.98 -4.88 121.76 119.33 1i5l s ALA 73 Ca 0.73 0.77 0.09 0.00 0.00 0.00 0.00 51.96 53.55 1i5l s ALA 73 Cb -0.51 -1.90 0.20 0.00 0.00 0.00 0.00 23.12 20.90 1i5l s ALA 73 CO 0.35 -1.46 1.52 -1.35 0.00 0.00 0.00 175.76 174.82 1i5l h PRO 74 N 8.15 0.03 0.00 0.00 0.11 -1.95 -3.38 132.00 134.97 1i5l h PRO 74 Ca -0.15 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.93 1i5l h PRO 74 Cb 1.14 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1i5l h PRO 74 CO 0.26 0.74 0.00 0.41 -0.21 0.00 0.00 178.00 179.20