#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j9i s GLU 2 N 0.00 3.17 0.41 3.17 -6.30 -1.26 0.26 118.70 118.15 1j9i s GLU 2 Ca 0.00 -2.60 0.04 0.00 -2.50 0.00 0.00 54.97 49.91 1j9i s GLU 2 Cb 0.00 -4.10 0.00 0.00 0.00 0.00 0.00 34.13 30.03 1j9i s GLU 2 CO 0.00 -1.24 0.59 0.14 0.02 0.00 0.00 175.26 174.77 1j9i s VAL 3 N -0.14 3.76 0.53 3.70 -7.23 -0.69 -4.75 120.40 115.57 1j9i s VAL 3 Ca 0.19 -0.78 0.00 0.00 -1.81 0.00 0.00 61.98 59.59 1j9i s VAL 3 Cb -0.14 -3.34 0.10 0.00 0.56 0.00 0.00 36.38 33.56 1j9i s VAL 3 CO -0.07 -0.18 0.72 0.59 -0.31 0.00 0.00 175.10 175.85 1j9i n ASN 4 N -1.91 1.01 -0.24 4.85 3.02 -1.26 0.23 115.26 120.97 1j9i n ASN 4 Ca 0.02 -1.85 0.01 0.00 -0.03 0.00 0.00 54.58 52.74 1j9i n ASN 4 Cb 0.58 -0.46 0.13 0.00 -0.61 0.00 0.00 39.78 39.42 1j9i n ASN 4 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 1j9i h LYS 5 N 0.00 0.60 0.27 3.52 2.10 -1.93 1.70 116.57 122.83 1j9i h LYS 5 Ca -0.24 -0.04 -0.01 0.00 -2.00 0.00 0.00 60.65 58.36 1j9i h LYS 5 Cb 0.89 -0.13 0.00 0.00 -0.90 0.00 0.00 32.23 32.09 1j9i h LYS 5 CO 0.26 0.40 -0.13 0.87 -2.00 0.00 0.00 179.45 178.85 1j9i h LYS 6 N 0.62 -0.35 -0.83 0.07 1.57 -1.95 1.10 116.57 116.80 1j9i h LYS 6 Ca 0.34 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 59.14 1j9i h LYS 6 Cb 0.34 0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.69 1j9i h LYS 6 CO -0.26 -0.06 0.48 1.96 -0.57 0.00 0.00 179.45 181.00 1j9i h GLN 7 N -0.63 1.14 0.34 3.15 1.08 -1.82 0.95 115.11 119.32 1j9i h GLN 7 Ca -0.04 -0.12 -0.02 0.00 -1.45 0.00 0.00 58.65 57.03 1j9i h GLN 7 Cb 0.45 -0.23 0.00 0.00 -0.05 0.00 0.00 27.48 27.65 1j9i h GLN 7 CO 0.06 0.82 -0.16 1.25 -0.95 0.00 0.00 178.83 179.85 1j9i h LEU 8 N 1.15 -0.39 -1.94 1.46 5.85 0.28 2.19 115.31 123.91 1j9i h LEU 8 Ca 0.29 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 1j9i h LEU 8 Cb -0.01 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.12 1j9i h LEU 8 CO -0.05 -0.12 -0.11 0.00 -0.34 0.00 0.00 178.44 177.82 1j9i h ALA 9 N -0.07 1.54 0.00 1.25 0.00 0.15 -0.73 119.26 121.41 1j9i h ALA 9 Ca -0.05 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 1j9i h ALA 9 Cb 0.46 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1j9i h ALA 9 CO 0.08 0.14 -0.00 -0.44 0.00 0.00 0.00 179.25 179.02 1j9i h ASP 10 N 0.00 -0.00 -0.03 0.00 5.19 0.16 0.68 116.42 122.42 1j9i h ASP 10 Ca -0.00 -0.82 0.01 0.00 -0.62 0.00 0.00 57.03 55.60 1j9i h ASP 10 Cb 0.24 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.74 1j9i h ASP 10 CO 0.01 0.82 0.05 -0.29 -3.12 0.00 0.00 179.24 176.71 1j9i h ILE 11 N -0.82 0.37 -0.02 0.35 2.10 0.40 0.19 117.51 120.07 1j9i h ILE 11 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1j9i h ILE 11 Cb 0.82 0.96 0.00 0.00 -1.09 0.00 0.00 36.82 37.51 1j9i h ILE 11 CO 0.00 0.00 -0.05 0.49 -1.08 0.00 0.00 178.15 177.52 1j9i n PHE 12 N -3.62 0.00 -1.35 2.19 3.01 -0.32 -4.93 117.46 112.45 1j9i n PHE 12 Ca -0.02 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.31 1j9i n PHE 12 Cb 0.13 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.54 1j9i n PHE 12 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1j9i n GLY 13 N 1.12 1.25 0.00 1.37 0.00 0.65 -4.92 105.19 104.66 1j9i n GLY 13 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1j9i n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9i n ALA 14 N 1.10 0.00 -3.11 4.61 0.00 0.21 -4.96 120.51 118.36 1j9i n ALA 14 Ca -0.13 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.98 1j9i n ALA 14 Cb 0.58 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.88 1j9i n ALA 14 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1j9i s SER 15 N -1.00 3.80 0.60 0.00 0.01 -1.26 -4.66 113.70 111.19 1j9i s SER 15 Ca 0.00 -0.38 0.29 0.00 1.31 0.00 0.00 55.95 57.17 1j9i s SER 15 Cb 0.00 -1.56 1.48 0.00 0.21 0.00 0.00 66.02 66.15 1j9i s SER 15 CO 0.00 0.16 1.89 0.40 0.41 0.00 0.00 173.24 176.10 1j9i h ILE 16 N 5.47 0.31 -0.39 1.44 2.04 -1.88 2.37 117.51 126.87 1j9i h ILE 16 Ca -0.24 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.53 1j9i h ILE 16 Cb 1.22 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 1j9i h ILE 16 CO 0.54 0.00 -0.14 0.03 0.00 0.00 0.00 178.15 178.57 1j9i h ARG 17 N 0.00 0.70 -0.41 2.37 2.47 -1.95 -0.01 114.38 117.56 1j9i h ARG 17 Ca 0.18 -0.24 -0.12 0.00 -1.26 0.00 0.00 59.98 58.55 1j9i h ARG 17 Cb 1.11 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 29.36 1j9i h ARG 17 CO -0.00 0.82 -0.21 1.15 0.56 0.00 0.00 179.97 182.28 1j9i h THR 18 N 0.64 1.27 -0.42 2.04 2.02 0.35 -1.53 112.91 117.27 1j9i h THR 18 Ca 0.10 -1.33 -0.01 0.00 0.77 0.00 0.00 66.41 65.94 1j9i h THR 18 Cb 0.61 1.19 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 1j9i h THR 18 CO 0.04 0.45 0.21 0.40 0.37 0.00 0.00 175.52 176.99 1j9i h ILE 19 N 0.70 1.14 0.00 3.11 1.08 -0.04 0.31 117.51 123.81 1j9i h ILE 19 Ca 0.10 -0.38 -0.05 0.00 -0.39 0.00 0.00 64.86 64.14 1j9i h ILE 19 Cb 0.73 0.59 -0.01 0.00 -3.07 0.00 0.00 36.82 35.06 1j9i h ILE 19 CO 0.06 0.16 -0.22 1.56 -0.69 0.00 0.00 178.15 179.01 1j9i h GLN 20 N 0.59 0.00 0.00 2.37 4.20 -0.08 -1.07 115.11 121.12 1j9i h GLN 20 Ca 0.15 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.62 1j9i h GLN 20 Cb 0.05 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.79 1j9i h GLN 20 CO -0.02 0.22 -1.26 -0.91 -0.67 0.00 0.00 178.83 176.20 1j9i h ASN 21 N 0.00 0.00 -0.22 1.46 2.35 0.16 -3.31 115.58 116.02 1j9i h ASN 21 Ca -0.00 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 1j9i h ASN 21 Cb 0.67 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.03 1j9i h ASN 21 CO 0.03 1.00 -0.10 -0.50 -1.65 0.00 0.00 177.43 176.20 1j9i h TRP 22 N 0.00 0.53 -0.33 1.19 4.06 0.05 -2.19 115.95 119.26 1j9i h TRP 22 Ca -0.11 -0.13 0.10 0.00 2.06 0.00 0.00 58.89 60.81 1j9i h TRP 22 Cb 1.86 -0.12 -0.01 0.00 -1.00 0.00 0.00 29.16 29.88 1j9i h TRP 22 CO 0.00 0.73 0.57 0.37 -3.56 0.00 0.00 178.44 176.55 1j9i h GLN 23 N 0.17 0.00 -0.66 0.49 4.15 -1.30 2.06 115.11 120.02 1j9i h GLN 23 Ca 0.05 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1j9i h GLN 23 Cb 0.59 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.28 1j9i h GLN 23 CO 0.03 0.00 0.00 -0.85 -1.93 0.00 0.00 178.83 176.08 1j9i n GLU 24 N -3.28 3.03 -0.28 1.69 0.28 -0.84 -4.22 120.64 117.02 1j9i n GLU 24 Ca 0.06 -2.66 0.07 0.00 -0.16 0.00 0.00 57.16 54.47 1j9i n GLU 24 Cb 0.71 -1.63 0.19 0.00 1.43 0.00 0.00 31.44 32.14 1j9i n GLU 24 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1j9i n GLN 25 N 1.33 2.85 -2.33 3.44 1.13 0.70 -4.95 117.38 119.55 1j9i n GLN 25 Ca 0.23 -2.39 0.00 0.00 -1.94 0.00 0.00 57.00 52.90 1j9i n GLN 25 Cb 0.68 -1.52 0.00 0.00 0.11 0.00 0.00 30.24 29.51 1j9i n GLN 25 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1j9i n GLY 26 N -0.06 0.85 3.87 1.08 0.00 -1.22 -5.04 105.19 104.67 1j9i n GLY 26 Ca 0.15 -0.70 -0.32 0.00 0.00 0.00 0.00 46.02 45.16 1j9i n GLY 26 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1j9i s MET 27 N -4.67 3.84 -1.38 1.61 0.00 -1.23 -4.99 119.30 112.48 1j9i s MET 27 Ca 0.00 0.39 -0.15 0.00 0.00 0.00 0.00 55.69 55.93 1j9i s MET 27 Cb 0.00 -2.56 0.07 0.00 0.00 0.00 0.00 34.83 32.34 1j9i s MET 27 CO 0.00 0.23 2.01 -0.35 0.00 0.00 0.00 175.02 176.91 1j9i n PRO 28 N -0.39 3.05 -2.21 3.16 -0.04 -1.26 -4.95 135.00 132.37 1j9i n PRO 28 Ca 0.01 -2.95 -0.35 0.00 -0.04 0.00 0.00 63.50 60.18 1j9i n PRO 28 Cb 0.53 -3.31 0.00 0.00 -0.04 0.00 0.00 33.50 30.68 1j9i n PRO 28 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1j9i s VAL 29 N 3.20 3.28 0.01 0.52 -7.23 -1.26 -3.47 120.40 115.45 1j9i s VAL 29 Ca 0.48 0.76 -0.06 0.00 -1.81 0.00 0.00 61.98 61.35 1j9i s VAL 29 Cb 0.10 -3.29 -0.03 0.00 0.56 0.00 0.00 36.38 33.73 1j9i s VAL 29 CO -0.03 -0.21 1.09 -0.07 -0.31 0.00 0.00 175.10 175.57 1j9i h LEU 30 N 1.03 -0.23-10.53 1.32 -0.00 -0.44 -3.44 115.31 103.03 1j9i h LEU 30 Ca -0.49 0.02 -0.45 0.00 -0.00 0.00 0.00 57.88 56.96 1j9i h LEU 30 Cb 1.25 0.08 0.03 0.00 -0.00 0.00 0.00 40.66 42.02 1j9i h LEU 30 CO 0.57 -0.11 -0.18 -0.13 -0.00 0.00 0.00 178.44 178.59 1j9i s ARG 31 N -3.46 2.59 -0.35 1.13 3.00 -1.26 -4.89 118.95 115.71 1j9i s ARG 31 Ca -0.03 -1.37 -0.03 0.00 0.00 0.00 0.00 55.73 54.29 1j9i s ARG 31 Cb 0.01 -2.70 0.07 0.00 0.00 0.00 0.00 34.95 32.33 1j9i s ARG 31 CO 0.10 -0.54 2.63 0.41 0.00 0.00 0.00 175.30 177.89 1j9i n GLY 32 N -2.05 4.08 2.67 -3.53 0.00 -1.26 -4.34 105.19 100.76 1j9i n GLY 32 Ca 0.11 -1.53 -0.08 0.00 0.00 0.00 0.00 46.02 44.52 1j9i n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j9i n GLY 33 N 0.92 2.09 2.32 -0.02 0.00 -1.26 -4.85 105.19 104.39 1j9i n GLY 33 Ca 0.41 -0.38 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 1j9i n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j9i n GLY 34 N 3.56 -1.78 2.37 -0.02 0.00 -1.26 -1.90 105.19 106.17 1j9i n GLY 34 Ca 0.18 -1.62 -0.17 0.00 0.00 0.00 0.00 46.02 44.40 1j9i n GLY 34 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j9i n LYS 35 N -3.01 -1.68 -2.78 1.61 4.01 -1.26 -1.62 118.16 113.43 1j9i n LYS 35 Ca 0.10 0.92 -0.09 0.00 -0.51 0.00 0.00 58.31 58.72 1j9i n LYS 35 Cb 0.36 -5.41 0.05 0.00 -0.51 0.00 0.00 35.03 29.52 1j9i n LYS 35 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1j9i n GLY 36 N -0.66 0.03 0.00 0.72 0.00 -1.25 -5.05 105.19 98.99 1j9i n GLY 36 Ca -0.19 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1j9i n GLY 36 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1j9i n ASN 37 N -2.00 0.17 -1.38 1.61 5.03 -0.64 -4.95 115.26 113.10 1j9i n ASN 37 Ca -0.14 0.00 -0.05 0.00 0.87 0.00 0.00 54.58 55.26 1j9i n ASN 37 Cb 0.58 0.00 0.03 0.00 -1.02 0.00 0.00 39.78 39.37 1j9i n ASN 37 CO 0.00 0.00 0.00 -1.84 -1.83 0.00 0.00 177.26 173.59 1j9i n GLU 38 N 0.00 1.26 -1.51 3.52 0.28 -1.26 -4.87 120.64 118.06 1j9i n GLU 38 Ca 0.00 -0.56 -0.55 0.00 -0.16 0.00 0.00 57.16 55.89 1j9i n GLU 38 Cb 0.00 -1.22 -0.08 0.00 1.43 0.00 0.00 31.44 31.57 1j9i n GLU 38 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 177.13 178.52 1j9i n VAL 39 N 0.51 0.20 -2.41 3.84 3.14 -1.24 -4.70 118.33 117.68 1j9i n VAL 39 Ca 0.11 -0.14 -0.09 0.00 -2.96 0.00 0.00 64.34 61.26 1j9i n VAL 39 Cb 0.65 -1.29 0.04 0.00 -1.06 0.00 0.00 33.84 32.18 1j9i n VAL 39 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1j9i n LEU 40 N 7.84 0.00 -3.65 6.55 4.77 -1.26 -4.54 117.00 126.70 1j9i n LEU 40 Ca 0.38 -0.81 -0.16 0.00 -0.03 0.00 0.00 56.01 55.39 1j9i n LEU 40 Cb 0.15 -0.24 -0.15 0.00 -2.33 0.00 0.00 43.42 40.85 1j9i n LEU 40 CO 0.80 -0.68 -0.20 -0.31 -1.33 0.00 0.00 177.39 175.67 1j9i s TYR 41 N -1.01 -0.27 -0.72 -1.77 2.02 0.14 0.29 117.35 116.02 1j9i s TYR 41 Ca 0.25 0.70 -0.26 0.00 -0.37 0.00 0.00 57.07 57.40 1j9i s TYR 41 Cb -0.01 -0.19 -0.10 0.00 -0.40 0.00 0.00 41.96 41.26 1j9i s TYR 41 CO 0.17 -0.33 2.29 0.34 -1.57 0.00 0.00 175.55 176.44 1j9i s ASP 42 N 2.34 4.34 0.57 2.29 -1.08 -1.23 -1.71 116.67 122.20 1j9i s ASP 42 Ca 0.03 0.20 0.31 0.00 -0.52 0.00 0.00 52.55 52.57 1j9i s ASP 42 Cb -0.12 -2.54 1.06 0.00 -1.46 0.00 0.00 42.92 39.86 1j9i s ASP 42 CO -0.07 -3.33 1.30 -0.24 0.52 0.00 0.00 175.17 173.35 1j9i n SER 43 N 16.74 0.00 -0.03 -0.34 2.88 0.73 0.21 113.62 133.81 1j9i n SER 43 Ca 0.41 0.78 -0.22 0.00 -1.33 0.00 0.00 58.87 58.52 1j9i n SER 43 Cb 0.47 -0.30 -0.13 0.00 -0.75 0.00 0.00 64.21 63.50 1j9i n SER 43 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1j9i n ALA 44 N -2.37 0.85 0.21 -1.46 0.00 -1.25 -3.09 120.51 113.40 1j9i n ALA 44 Ca 0.27 -0.56 0.08 0.00 0.00 0.00 0.00 53.44 53.24 1j9i n ALA 44 Cb 1.59 -0.64 0.45 0.00 0.00 0.00 0.00 19.45 20.84 1j9i n ALA 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j9i h ALA 45 N -0.11 1.09 0.00 0.00 0.00 -0.08 -1.71 119.26 118.45 1j9i h ALA 45 Ca -0.40 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1j9i h ALA 45 Cb 1.81 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.56 1j9i h ALA 45 CO -0.01 0.35 0.00 0.28 0.00 0.00 0.00 179.25 179.88 1j9i h VAL 46 N 0.00 0.00 0.00 0.00 2.07 0.23 -3.15 116.25 115.40 1j9i h VAL 46 Ca -0.00 -0.65 -0.05 0.00 0.82 0.00 0.00 66.70 66.81 1j9i h VAL 46 Cb 0.73 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 1j9i h VAL 46 CO 0.04 0.00 -0.97 2.30 0.02 0.00 0.00 177.57 178.96 1j9i n ILE 47 N -2.97 1.47 -0.44 4.57 -5.35 -0.69 -2.02 119.36 113.94 1j9i n ILE 47 Ca 0.02 0.11 0.41 0.00 -0.27 0.00 0.00 62.75 63.02 1j9i n ILE 47 Cb 0.38 -2.31 0.75 0.00 -1.74 0.00 0.00 39.64 36.73 1j9i n ILE 47 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1j9i h LYS 48 N -1.00 0.00 0.00 6.28 3.11 -1.58 2.79 116.57 126.17 1j9i h LYS 48 Ca -0.08 0.00 -0.25 0.00 -2.81 0.00 0.00 60.65 57.51 1j9i h LYS 48 Cb 0.89 0.00 -0.04 0.00 -1.00 0.00 0.00 32.23 32.08 1j9i h LYS 48 CO -0.05 0.00 -1.49 2.35 -2.81 0.00 0.00 179.45 177.45 1j9i h TRP 49 N 0.00 0.00 0.00 1.91 7.01 -1.70 -3.18 115.95 119.99 1j9i h TRP 49 Ca 0.68 0.00 -0.15 0.00 2.11 0.00 0.00 58.89 61.52 1j9i h TRP 49 Cb 2.83 0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 29.86 1j9i h TRP 49 CO 0.00 0.91 -1.07 -0.92 -2.79 0.00 0.00 178.44 174.56 1j9i h TYR 50 N 0.00 0.00 0.00 2.65 3.20 0.43 -3.30 116.97 119.95 1j9i h TYR 50 Ca -0.21 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.59 1j9i h TYR 50 Cb 1.87 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 40.13 1j9i h TYR 50 CO 0.00 0.60 -0.34 0.00 -1.64 0.00 0.00 178.16 176.78 1j9i h ALA 51 N 1.40 0.81 -0.40 1.82 0.00 0.37 0.47 119.26 123.73 1j9i h ALA 51 Ca -0.10 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.46 1j9i h ALA 51 Cb 1.55 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.26 1j9i h ALA 51 CO 0.06 0.43 0.04 0.39 0.00 0.00 0.00 179.25 180.17 1j9i n GLU 52 N -3.24 3.35 0.00 0.00 1.02 -1.20 -4.54 120.64 116.03 1j9i n GLU 52 Ca 0.02 -2.03 0.00 0.00 -0.02 0.00 0.00 57.16 55.13 1j9i n GLU 52 Cb 0.63 -1.97 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 1j9i n GLU 52 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1j9i n ARG 53 N 0.30 0.00 -0.19 3.49 1.85 -1.20 -4.96 116.66 115.95 1j9i n ARG 53 Ca 0.20 0.00 0.02 0.00 -1.00 0.00 0.00 57.85 57.07 1j9i n ARG 53 Cb 0.91 0.00 0.09 0.00 -1.05 0.00 0.00 32.46 32.41 1j9i n ARG 53 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1j9i n ASP 54 N 0.00 1.90 0.00 2.89 9.92 0.15 -4.09 116.55 127.32 1j9i n ASP 54 Ca 0.00 -2.18 0.06 0.00 -0.53 0.00 0.00 54.79 52.14 1j9i n ASP 54 Cb 0.00 -0.47 0.32 0.00 -0.64 0.00 0.00 41.12 40.33 1j9i n ASP 54 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1j9i n ALA 55 N 0.12 1.73 -0.11 2.24 0.00 -0.67 -2.98 120.51 120.84 1j9i n ALA 55 Ca 0.06 -0.06 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 1j9i n ALA 55 Cb 0.41 -1.21 -0.12 0.00 0.00 0.00 0.00 19.45 18.54 1j9i n ALA 55 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1j9i n GLU 56 N -1.32 0.63 -0.34 0.00 -0.58 -1.26 -4.50 120.64 113.28 1j9i n GLU 56 Ca 0.06 0.28 -0.09 0.00 -0.42 0.00 0.00 57.16 56.99 1j9i n GLU 56 Cb 0.11 -1.58 -0.08 0.00 -0.57 0.00 0.00 31.44 29.32 1j9i n GLU 56 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1j9i n ILE 57 N -3.84 -0.55 0.27 -3.67 -0.00 -1.16 0.29 119.36 110.70 1j9i n ILE 57 Ca -0.45 2.02 0.13 0.00 -0.00 0.00 0.00 62.75 64.46 1j9i n ILE 57 Cb 0.91 -2.50 0.61 0.00 -0.00 0.00 0.00 39.64 38.66 1j9i n ILE 57 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.55 176.47 1j9i h GLU 58 N 0.00 0.00 0.00 0.38 4.57 -1.80 0.23 114.58 117.96 1j9i h GLU 58 Ca 0.13 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 1j9i h GLU 58 Cb 0.33 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.92 1j9i h GLU 58 CO -0.76 0.00 0.00 -1.71 -1.18 0.00 0.00 179.01 175.36 1j9i n ASN 59 N -2.94 1.19 -0.13 1.04 5.15 0.84 -4.65 115.26 115.75 1j9i n ASN 59 Ca 0.01 -1.51 0.13 0.00 -0.60 0.00 0.00 54.58 52.61 1j9i n ASN 59 Cb 0.61 0.00 0.34 0.00 -0.53 0.00 0.00 39.78 40.20 1j9i n ASN 59 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1j9i n GLU 60 N -0.25 0.47 0.00 1.20 2.13 0.79 -3.62 120.64 121.36 1j9i n GLU 60 Ca 0.00 -0.27 0.08 0.00 0.66 0.00 0.00 57.16 57.64 1j9i n GLU 60 Cb 0.27 -1.49 0.06 0.00 0.27 0.00 0.00 31.44 30.55 1j9i n GLU 60 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1j9i n LYS 61 N -1.04 1.35 -0.00 5.31 5.02 -1.21 -4.39 118.16 123.20 1j9i n LYS 61 Ca 0.09 -1.43 0.06 0.00 -2.02 0.00 0.00 58.31 55.01 1j9i n LYS 61 Cb 0.34 -1.31 -0.09 0.00 -0.02 0.00 0.00 35.03 33.94 1j9i n LYS 61 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1j9i n LEU 62 N 0.84 0.07 0.00 -0.35 4.77 -1.24 -3.51 117.00 117.59 1j9i n LEU 62 Ca 0.09 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1j9i n LEU 62 Cb 0.41 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 1j9i n LEU 62 CO 0.11 0.02 0.00 -1.14 -1.33 0.00 0.00 177.39 175.05 1j9i n ARG 63 N -1.83 0.00 -0.11 3.23 0.63 -1.24 -4.63 116.66 112.72 1j9i n ARG 63 Ca -0.02 0.00 -0.14 0.00 -0.92 0.00 0.00 57.85 56.78 1j9i n ARG 63 Cb 0.30 -0.30 -0.13 0.00 0.45 0.00 0.00 32.46 32.77 1j9i n ARG 63 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1j9i n ARG 64 N 0.00 0.72 -0.99 -0.14 0.63 -1.26 -4.50 116.66 111.11 1j9i n ARG 64 Ca 0.00 0.07 -0.18 0.00 -0.92 0.00 0.00 57.85 56.82 1j9i n ARG 64 Cb 0.00 -1.50 -0.12 0.00 0.45 0.00 0.00 32.46 31.29 1j9i n ARG 64 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1j9i n GLU 65 N -2.98 2.26 -0.03 -0.14 1.02 -1.26 -4.45 120.64 115.05 1j9i n GLU 65 Ca -0.38 -1.22 -0.00 0.00 -0.02 0.00 0.00 57.16 55.53 1j9i n GLU 65 Cb 1.05 -2.17 -0.00 0.00 -0.02 0.00 0.00 31.44 30.30 1j9i n GLU 65 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1j9i h VAL 66 N 2.35 0.00 0.00 2.62 2.07 -1.79 -3.40 116.25 118.11 1j9i h VAL 66 Ca 0.34 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 67.20 1j9i h VAL 66 Cb 1.09 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1j9i h VAL 66 CO 0.65 0.00 -0.66 1.21 0.02 0.00 0.00 177.57 178.79 1j9i n GLU 67 N -3.85 2.17 0.00 1.57 2.13 -1.26 -4.99 120.64 116.41 1j9i n GLU 67 Ca -0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1j9i n GLU 67 Cb 0.01 -0.83 0.00 0.00 0.27 0.00 0.00 31.44 30.89 1j9i n GLU 67 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87