#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 1.74 0.27 2.12 2.12 -1.26 0.10 118.70 123.79 1j9i s GLU 2 Ca 0.00 -2.35 0.03 0.00 0.36 0.00 0.00 54.97 53.01 1j9i s GLU 2 Cb 0.00 -3.09 -0.03 0.00 0.26 0.00 0.00 34.13 31.26 1j9i s GLU 2 CO 0.00 -1.09 0.43 0.14 -0.54 0.00 0.00 175.26 174.21 1j9i s VAL 3 N 0.07 5.20 0.59 3.70 -7.23 0.27 -4.76 120.40 118.24 1j9i s VAL 3 Ca 0.16 -0.71 0.02 0.00 -1.81 0.00 0.00 61.98 59.64 1j9i s VAL 3 Cb -0.24 -3.84 0.06 0.00 0.56 0.00 0.00 36.38 32.92 1j9i s VAL 3 CO -0.02 -0.39 0.83 0.20 -0.31 0.00 0.00 175.10 175.40 1j9i s ASN 4 N -3.88 5.02 0.33 4.85 0.01 -1.26 -0.71 114.94 119.29 1j9i s ASN 4 Ca 0.37 -0.19 0.11 0.00 -0.71 0.00 0.00 52.86 52.44 1j9i s ASN 4 Cb -0.10 -0.53 0.97 0.00 0.41 0.00 0.00 41.25 42.01 1j9i s ASN 4 CO 0.32 -1.34 1.68 0.07 -1.51 0.00 0.00 177.10 176.31 1j9i h LYS 5 N -0.06 0.35 0.28 -0.60 2.10 -1.92 2.47 116.57 119.19 1j9i h LYS 5 Ca -0.39 -0.02 -0.01 0.00 -2.00 0.00 0.00 60.65 58.22 1j9i h LYS 5 Cb 1.29 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 1j9i h LYS 5 CO 0.48 0.23 -0.13 -0.22 -2.00 0.00 0.00 179.45 177.80 1j9i h LYS 6 N 0.36 -0.36 -0.22 0.07 3.64 -1.96 0.70 116.57 118.79 1j9i h LYS 6 Ca 0.68 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 60.14 1j9i h LYS 6 Cb 1.47 0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 33.31 1j9i h LYS 6 CO -0.58 -0.24 -0.18 1.96 -2.27 0.00 0.00 179.45 178.13 1j9i h GLN 7 N -0.43 -0.18 -0.65 1.90 1.08 -1.63 0.38 115.11 115.59 1j9i h GLN 7 Ca -0.04 0.01 0.14 0.00 -1.45 0.00 0.00 58.65 57.31 1j9i h GLN 7 Cb 0.29 0.04 -0.11 0.00 -0.05 0.00 0.00 27.48 27.65 1j9i h GLN 7 CO 0.06 -0.12 0.03 1.25 -0.95 0.00 0.00 178.83 179.10 1j9i h LEU 8 N -0.18 -0.23 -1.58 1.46 6.46 0.42 2.28 115.31 123.95 1j9i h LEU 8 Ca 0.13 0.15 -0.04 0.00 -0.12 0.00 0.00 57.88 58.00 1j9i h LEU 8 Cb 0.38 0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 40.57 1j9i h LEU 8 CO -0.33 -0.11 -0.20 0.00 -0.62 0.00 0.00 178.44 177.18 1j9i h ALA 9 N 1.58 1.26 0.06 1.25 0.00 0.21 -2.02 119.26 121.60 1j9i h ALA 9 Ca 0.34 -0.19 -0.26 0.00 0.00 0.00 0.00 54.91 54.81 1j9i h ALA 9 Cb 0.56 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.33 1j9i h ALA 9 CO -0.53 0.26 -1.10 -0.44 0.00 0.00 0.00 179.25 177.43 1j9i h ASP 10 N 0.00 0.60 -0.73 0.00 5.19 0.66 1.46 116.42 123.59 1j9i h ASP 10 Ca -0.00 -0.54 0.16 0.00 -0.62 0.00 0.00 57.03 56.03 1j9i h ASP 10 Cb 0.50 -0.19 -0.11 0.00 0.18 0.00 0.00 39.33 39.71 1j9i h ASP 10 CO 0.03 1.36 0.16 0.40 -3.12 0.00 0.00 179.24 178.07 1j9i h ILE 11 N 0.20 0.50 -0.61 0.35 1.08 0.37 0.28 117.51 119.68 1j9i h ILE 11 Ca -0.12 -0.09 0.00 0.00 -0.39 0.00 0.00 64.86 64.26 1j9i h ILE 11 Cb 1.77 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 35.74 1j9i h ILE 11 CO 0.19 0.05 0.00 0.49 -0.69 0.00 0.00 178.15 178.19 1j9i n PHE 12 N -5.17 0.81 -1.77 1.37 3.01 -1.17 -4.89 117.46 109.64 1j9i n PHE 12 Ca 0.14 -0.42 -0.19 0.00 1.01 0.00 0.00 57.45 58.00 1j9i n PHE 12 Cb 0.46 -0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.87 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 1.58 1.19 0.00 1.37 0.00 0.97 -4.92 105.19 105.38 1j9i n GLY 13 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 0.30 0.00 -2.87 4.61 0.00 0.49 -4.93 120.51 118.11 1j9i n ALA 14 Ca -0.20 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.91 1j9i n ALA 14 Cb 0.63 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.94 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 3.98 0.55 0.00 0.01 -1.26 -4.58 113.70 111.40 1j9i s SER 15 Ca 0.00 -0.29 0.34 0.00 1.31 0.00 0.00 55.95 57.31 1j9i s SER 15 Cb 0.00 -1.34 1.50 0.00 0.21 0.00 0.00 66.02 66.40 1j9i s SER 15 CO 0.00 0.23 1.83 0.40 0.41 0.00 0.00 173.24 176.11 1j9i h ILE 16 N 5.05 0.44 -0.95 1.44 2.04 -1.88 2.51 117.51 126.14 1j9i h ILE 16 Ca -0.33 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.58 1j9i h ILE 16 Cb 1.19 0.46 -0.06 0.00 -0.74 0.00 0.00 36.82 37.68 1j9i h ILE 16 CO 0.53 0.00 0.61 0.03 0.00 0.00 0.00 178.15 179.33 1j9i h ARG 17 N 0.00 1.12 -0.56 2.37 2.47 -1.94 0.30 114.38 118.13 1j9i h ARG 17 Ca 0.48 -0.07 -0.09 0.00 -1.26 0.00 0.00 59.98 59.04 1j9i h ARG 17 Cb 1.99 -0.25 -0.02 0.00 -1.65 0.00 0.00 29.97 30.04 1j9i h ARG 17 CO -0.01 0.74 0.00 1.15 0.56 0.00 0.00 179.97 182.42 1j9i h THR 18 N 1.15 1.26 -0.48 2.04 2.02 0.39 -1.10 112.91 118.20 1j9i h THR 18 Ca 0.40 -1.12 0.05 0.00 0.77 0.00 0.00 66.41 66.51 1j9i h THR 18 Cb 0.09 0.87 -0.03 0.00 -1.74 0.00 0.00 68.15 67.34 1j9i h THR 18 CO -0.15 0.40 0.32 0.40 0.37 0.00 0.00 175.52 176.87 1j9i h ILE 19 N 0.88 0.99 0.00 3.11 1.08 0.44 0.73 117.51 124.74 1j9i h ILE 19 Ca 0.16 -0.15 -0.04 0.00 -0.39 0.00 0.00 64.86 64.44 1j9i h ILE 19 Cb 0.54 0.51 -0.01 0.00 -3.07 0.00 0.00 36.82 34.80 1j9i h ILE 19 CO 0.03 0.08 -0.21 1.56 -0.69 0.00 0.00 178.15 178.92 1j9i h GLN 20 N 0.44 0.00 0.00 2.37 1.08 0.68 -1.09 115.11 118.59 1j9i h GLN 20 Ca 0.21 0.00 -0.19 0.00 -1.45 0.00 0.00 58.65 57.22 1j9i h GLN 20 Cb 0.26 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.66 1j9i h GLN 20 CO -0.05 0.21 -0.99 -0.97 -0.95 0.00 0.00 178.83 176.07 1j9i h ASN 21 N 0.00 0.00 0.29 1.46 -0.00 0.11 -3.24 115.58 114.20 1j9i h ASN 21 Ca -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 56.30 56.28 1j9i h ASN 21 Cb 0.63 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.95 1j9i h ASN 21 CO 0.03 0.84 -0.14 -0.50 -0.00 0.00 0.00 177.43 177.65 1j9i h TRP 22 N 0.00 -0.36 -0.07 0.67 4.06 0.23 -0.54 115.95 119.94 1j9i h TRP 22 Ca -0.06 -0.01 0.02 0.00 2.06 0.00 0.00 58.89 60.91 1j9i h TRP 22 Cb 1.69 0.12 -0.00 0.00 -1.00 0.00 0.00 29.16 29.96 1j9i h TRP 22 CO 0.00 -0.01 0.52 -0.56 -3.56 0.00 0.00 178.44 174.83 1j9i h GLN 23 N -0.88 0.00 0.00 0.49 -0.00 -1.35 1.14 115.11 114.51 1j9i h GLN 23 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.61 1j9i h GLN 23 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.99 1j9i h GLN 23 CO 0.07 0.00 -1.34 0.39 -0.00 0.00 0.00 178.83 177.94 1j9i n GLU 24 N -2.89 0.23 -0.09 0.06 1.02 -1.05 -4.15 120.64 113.77 1j9i n GLU 24 Ca 0.00 -0.07 0.11 0.00 -0.02 0.00 0.00 57.16 57.18 1j9i n GLU 24 Cb 0.58 -1.51 0.34 0.00 -0.02 0.00 0.00 31.44 30.83 1j9i n GLU 24 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1j9i n GLN 25 N -1.76 1.93 -0.29 3.49 1.13 0.39 -4.88 117.38 117.38 1j9i n GLN 25 Ca 0.01 -1.39 0.00 0.00 -1.94 0.00 0.00 57.00 53.69 1j9i n GLN 25 Cb 0.41 -1.43 0.00 0.00 0.11 0.00 0.00 30.24 29.33 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 1.23 1.16 3.80 1.08 0.00 -0.98 -5.05 105.19 106.42 1j9i n GLY 26 Ca 0.17 -0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.76 3.86 -1.40 1.61 0.23 -0.93 -4.94 119.30 116.97 1j9i s MET 27 Ca 0.00 1.37 -0.08 0.00 -1.03 0.00 0.00 55.69 55.95 1j9i s MET 27 Cb 0.00 -2.15 0.07 0.00 -1.53 0.00 0.00 34.83 31.22 1j9i s MET 27 CO 0.00 -0.38 2.44 -0.35 -2.03 0.00 0.00 175.02 174.70 1j9i n PRO 28 N -0.85 4.12 0.00 3.16 -0.04 -1.26 -4.88 135.00 135.25 1j9i n PRO 28 Ca 0.09 -3.11 0.00 0.00 -0.04 0.00 0.00 63.50 60.43 1j9i n PRO 28 Cb 0.52 -2.76 0.00 0.00 -0.04 0.00 0.00 33.50 31.22 1j9i n PRO 28 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1j9i n VAL 29 N 2.63 0.00 -0.05 0.52 0.24 -1.26 -3.40 118.33 117.01 1j9i n VAL 29 Ca 0.62 0.00 -0.06 0.00 -2.04 0.00 0.00 64.34 62.87 1j9i n VAL 29 Cb 0.27 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.62 1j9i n VAL 29 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1j9i n LEU 30 N 0.00 1.39 -4.98 1.34 4.32 0.28 -4.26 117.00 115.09 1j9i n LEU 30 Ca 0.00 0.23 -0.21 0.00 -0.02 0.00 0.00 56.01 56.00 1j9i n LEU 30 Cb 0.00 -0.60 0.05 0.00 -1.62 0.00 0.00 43.42 41.25 1j9i n LEU 30 CO 0.00 -0.40 0.40 -0.13 -1.22 0.00 0.00 177.39 176.03 1j9i s ARG 31 N -2.35 2.41 -0.32 3.23 3.00 -1.26 -4.90 118.95 118.76 1j9i s ARG 31 Ca -0.18 -0.83 -0.02 0.00 0.00 0.00 0.00 55.73 54.71 1j9i s ARG 31 Cb 0.02 -2.46 0.15 0.00 0.00 0.00 0.00 34.95 32.66 1j9i s ARG 31 CO 0.26 -0.83 2.26 0.41 0.00 0.00 0.00 175.30 177.40 1j9i n GLY 32 N -2.43 4.02 2.42 -3.53 0.00 -1.26 -4.51 105.19 99.91 1j9i n GLY 32 Ca 0.09 -1.22 -0.11 0.00 0.00 0.00 0.00 46.02 44.79 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 0.63 2.30 1.32 -0.02 0.00 -1.26 -4.83 105.19 103.33 1j9i n GLY 33 Ca 0.33 -0.62 -0.09 0.00 0.00 0.00 0.00 46.02 45.65 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 3.17 0.13 2.05 -0.02 0.00 -1.26 -3.12 105.19 106.14 1j9i n GLY 34 Ca 0.27 -1.89 -0.14 0.00 0.00 0.00 0.00 46.02 44.26 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 -1.73 -1.31 -1.27 1.61 5.02 -1.26 -3.77 118.16 115.46 1j9i n LYS 35 Ca 0.06 0.81 0.00 0.00 -2.02 0.00 0.00 58.31 57.15 1j9i n LYS 35 Cb 0.20 -5.06 0.00 0.00 -0.02 0.00 0.00 35.03 30.15 1j9i n LYS 35 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1j9i n GLY 36 N -0.26 -2.50 0.00 0.72 0.00 -1.26 -5.12 105.19 96.77 1j9i n GLY 36 Ca -0.14 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1j9i n GLY 36 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1j9i n ASN 37 N 0.00 0.00 -1.73 1.61 2.85 -1.18 -5.01 115.26 111.80 1j9i n ASN 37 Ca 0.00 -0.01 -0.12 0.00 -0.11 0.00 0.00 54.58 54.34 1j9i n ASN 37 Cb 0.00 0.00 0.15 0.00 1.24 0.00 0.00 39.78 41.17 1j9i n ASN 37 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 1j9i n GLU 38 N 0.00 2.19 -1.70 1.20 0.00 -1.26 -4.94 120.64 116.13 1j9i n GLU 38 Ca 0.00 -2.00 -0.67 0.00 0.00 0.00 0.00 57.16 54.49 1j9i n GLU 38 Cb 0.00 -1.83 -0.10 0.00 0.00 0.00 0.00 31.44 29.51 1j9i n GLU 38 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.13 178.68 1j9i n VAL 39 N -0.38 0.01 -2.04 3.84 3.14 -1.25 -4.83 118.33 116.82 1j9i n VAL 39 Ca 0.35 -0.00 -0.05 0.00 -2.96 0.00 0.00 64.34 61.68 1j9i n VAL 39 Cb 1.19 -0.51 0.03 0.00 -1.06 0.00 0.00 33.84 33.49 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 4.35 0.00 -3.77 6.55 7.99 -1.26 -4.55 117.00 126.31 1j9i n LEU 40 Ca 0.33 -0.38 -0.13 0.00 -0.01 0.00 0.00 56.01 55.83 1j9i n LEU 40 Cb -0.05 -0.14 -0.11 0.00 -0.11 0.00 0.00 43.42 43.00 1j9i n LEU 40 CO 0.90 -0.62 -0.02 -0.31 -1.51 0.00 0.00 177.39 175.83 1j9i s TYR 41 N -0.68 -0.34 -0.93 -1.77 2.02 0.11 -0.55 117.35 115.21 1j9i s TYR 41 Ca 0.13 0.84 -0.24 0.00 -0.37 0.00 0.00 57.07 57.43 1j9i s TYR 41 Cb -0.01 0.12 0.04 0.00 -0.40 0.00 0.00 41.96 41.71 1j9i s TYR 41 CO 0.09 -0.17 1.41 0.34 -1.57 0.00 0.00 175.55 175.65 1j9i s ASP 42 N 0.18 6.36 0.49 2.29 2.15 -1.22 -0.57 116.67 126.35 1j9i s ASP 42 Ca -0.00 -1.11 0.39 0.00 0.43 0.00 0.00 52.55 52.26 1j9i s ASP 42 Cb -0.02 -2.57 1.32 0.00 -0.30 0.00 0.00 42.92 41.36 1j9i s ASP 42 CO 0.00 -1.64 1.29 -0.24 -0.17 0.00 0.00 175.17 174.41 1j9i n SER 43 N 9.15 0.00 -0.08 -0.34 2.88 0.11 0.26 113.62 125.61 1j9i n SER 43 Ca 0.24 0.81 -0.09 0.00 -1.33 0.00 0.00 58.87 58.49 1j9i n SER 43 Cb 0.50 -0.38 -0.04 0.00 -0.75 0.00 0.00 64.21 63.54 1j9i n SER 43 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1j9i h ALA 44 N 0.76 0.07 -0.09 -1.46 0.00 -1.88 -3.16 119.26 113.50 1j9i h ALA 44 Ca 0.72 -0.66 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1j9i h ALA 44 Cb 3.09 0.52 -0.00 0.00 0.00 0.00 0.00 17.79 21.39 1j9i h ALA 44 CO -0.01 0.51 0.13 0.00 0.00 0.00 0.00 179.25 179.88 1j9i h ALA 45 N -0.83 1.55 0.00 0.00 0.00 -1.04 0.97 119.26 119.90 1j9i h ALA 45 Ca -0.10 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1j9i h ALA 45 Cb 0.70 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1j9i h ALA 45 CO -0.06 -0.17 -0.08 0.28 0.00 0.00 0.00 179.25 179.22 1j9i h VAL 46 N 0.00 0.19 0.00 0.00 2.07 0.35 -2.96 116.25 115.91 1j9i h VAL 46 Ca 0.04 -0.76 -0.04 0.00 0.82 0.00 0.00 66.70 66.76 1j9i h VAL 46 Cb 0.30 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 1j9i h VAL 46 CO -0.00 0.08 -0.96 2.30 0.02 0.00 0.00 177.57 179.00 1j9i n ILE 47 N -3.20 1.48 -0.50 4.57 -5.35 0.32 -2.35 119.36 114.33 1j9i n ILE 47 Ca 0.01 0.12 0.43 0.00 -0.27 0.00 0.00 62.75 63.04 1j9i n ILE 47 Cb 0.37 -2.32 0.77 0.00 -1.74 0.00 0.00 39.64 36.72 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 0.02 0.00 6.28 3.11 -1.41 2.78 116.57 126.35 1j9i h LYS 48 Ca -0.06 -0.00 -0.24 0.00 -2.81 0.00 0.00 60.65 57.54 1j9i h LYS 48 Cb 0.90 -0.00 -0.04 0.00 -1.00 0.00 0.00 32.23 32.09 1j9i h LYS 48 CO -0.04 0.01 -1.44 2.35 -2.81 0.00 0.00 179.45 177.53 1j9i h TRP 49 N 0.02 0.00 0.00 1.91 7.01 -1.69 -3.17 115.95 120.03 1j9i h TRP 49 Ca 0.75 0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.72 1j9i h TRP 49 Cb 2.93 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 29.99 1j9i h TRP 49 CO -0.00 0.90 -0.62 -0.92 -2.79 0.00 0.00 178.44 175.01 1j9i h TYR 50 N 0.00 0.00 0.00 2.65 5.03 0.41 -3.22 116.97 121.84 1j9i h TYR 50 Ca -0.19 0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.07 1j9i h TYR 50 Cb 1.86 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 40.13 1j9i h TYR 50 CO 0.00 0.12 -0.26 0.00 -1.32 0.00 0.00 178.16 176.70 1j9i h ALA 51 N 1.88 0.84 -0.50 1.82 0.00 0.37 0.38 119.26 124.04 1j9i h ALA 51 Ca -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1j9i h ALA 51 Cb 1.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1j9i h ALA 51 CO 0.01 0.32 0.00 -0.85 0.00 0.00 0.00 179.25 178.74 1j9i n GLU 52 N -3.17 2.70 0.00 0.00 0.28 -1.20 -4.58 120.64 114.68 1j9i n GLU 52 Ca 0.03 -2.02 0.00 0.00 -0.16 0.00 0.00 57.16 55.01 1j9i n GLU 52 Cb 0.63 -1.60 0.00 0.00 1.43 0.00 0.00 31.44 31.90 1j9i n GLU 52 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86 1j9i n ARG 53 N 0.88 0.00 -0.18 3.44 1.85 -1.21 -4.95 116.66 116.50 1j9i n ARG 53 Ca 0.18 0.00 0.05 0.00 -1.00 0.00 0.00 57.85 57.08 1j9i n ARG 53 Cb 0.59 0.00 0.14 0.00 -1.05 0.00 0.00 32.46 32.15 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 -0.06 1.81 0.12 2.89 8.00 0.12 -3.99 116.55 125.45 1j9i n ASP 54 Ca 0.00 -2.03 0.09 0.00 0.71 0.00 0.00 54.79 53.56 1j9i n ASP 54 Cb 0.00 -0.24 0.46 0.00 -0.02 0.00 0.00 41.12 41.31 1j9i n ASP 54 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1j9i n ALA 55 N 0.42 1.15 0.04 2.24 0.00 -0.73 -1.25 120.51 122.37 1j9i n ALA 55 Ca 0.11 0.14 -0.13 0.00 0.00 0.00 0.00 53.44 53.55 1j9i n ALA 55 Cb 0.30 -1.27 -0.14 0.00 0.00 0.00 0.00 19.45 18.35 1j9i n ALA 55 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1j9i h GLU 56 N 0.00 0.15 -0.05 0.00 5.08 -1.88 -3.32 114.58 114.57 1j9i h GLU 56 Ca 0.00 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1j9i h GLU 56 Cb 0.06 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1j9i h GLU 56 CO 0.00 0.97 -0.03 0.82 -1.00 0.00 0.00 179.01 179.77 1j9i h ILE 57 N 0.04 0.00 -0.08 3.13 5.03 -1.47 2.33 117.51 126.49 1j9i h ILE 57 Ca -0.21 0.00 0.02 0.00 -0.12 0.00 0.00 64.86 64.55 1j9i h ILE 57 Cb 1.97 0.00 -0.00 0.00 -3.03 0.00 0.00 36.82 35.76 1j9i h ILE 57 CO 0.14 0.00 0.34 -0.33 -0.68 0.00 0.00 178.15 177.62 1j9i h GLU 58 N -0.00 0.00 0.00 2.37 4.39 -1.74 1.31 114.58 120.90 1j9i h GLU 58 Ca 0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1j9i h GLU 58 Cb 0.02 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.67 1j9i h GLU 58 CO -0.04 0.00 -0.16 -1.71 -1.16 0.00 0.00 179.01 175.93 1j9i n ASN 59 N -3.08 0.35 0.08 1.42 5.15 0.75 -3.06 115.26 116.86 1j9i n ASN 59 Ca -0.00 0.33 -0.04 0.00 -0.60 0.00 0.00 54.58 54.27 1j9i n ASN 59 Cb 0.41 -0.35 -0.07 0.00 -0.53 0.00 0.00 39.78 39.24 1j9i n ASN 59 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 1j9i h GLU 60 N 0.00 0.00 0.00 1.20 4.81 0.57 -2.84 114.58 118.32 1j9i h GLU 60 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1j9i h GLU 60 Cb 0.58 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.96 1j9i h GLU 60 CO 0.00 0.75 -0.85 1.63 -0.73 0.00 0.00 179.01 179.81 1j9i n LYS 61 N -3.26 0.19 -0.50 1.92 5.02 -1.22 -4.08 118.16 116.24 1j9i n LYS 61 Ca -0.01 0.01 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 1j9i n LYS 61 Cb 0.88 -1.57 0.19 0.00 -0.02 0.00 0.00 35.03 34.51 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 -1.83 2.90 -0.04 -0.35 4.77 -1.17 -4.22 117.00 117.06 1j9i n LEU 62 Ca 0.03 -3.66 -0.00 0.00 -0.03 0.00 0.00 56.01 52.35 1j9i n LEU 62 Cb 0.40 -0.52 -0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1j9i n LEU 62 CO 0.39 1.19 -0.03 -0.09 -1.33 0.00 0.00 177.39 177.52 1j9i h ARG 63 N 0.80 0.00 0.00 3.23 2.43 -1.65 -3.42 114.38 115.77 1j9i h ARG 63 Ca 0.03 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1j9i h ARG 63 Cb 1.12 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 1j9i h ARG 63 CO 0.07 0.00 -0.83 0.54 -1.51 0.00 0.00 179.97 178.24 1j9i n ARG 64 N -3.88 1.39 0.19 0.20 1.74 -1.26 -4.65 116.66 110.39 1j9i n ARG 64 Ca -0.01 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.19 1j9i n ARG 64 Cb 0.02 -0.91 0.64 0.00 -1.02 0.00 0.00 32.46 31.19 1j9i n ARG 64 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1j9i h GLU 65 N 0.00 0.00 -1.49 5.56 4.39 -1.88 -2.76 114.58 118.40 1j9i h GLU 65 Ca 0.00 0.00 0.45 0.00 0.34 0.00 0.00 59.36 60.15 1j9i h GLU 65 Cb 0.83 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.38 1j9i h GLU 65 CO 0.00 0.00 1.02 0.28 -1.16 0.00 0.00 179.01 179.15 1j9i h VAL 66 N 0.00 0.16 -0.32 3.13 2.07 -1.82 -3.46 116.25 116.01 1j9i h VAL 66 Ca 0.00 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1j9i h VAL 66 Cb 0.13 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.00 1j9i h VAL 66 CO 0.00 0.01 0.00 -1.84 0.02 0.00 0.00 177.57 175.76 1j9i n GLU 67 N -4.36 0.00 0.00 1.57 -0.00 -1.04 -5.13 120.64 111.67 1j9i n GLU 67 Ca 0.37 0.16 0.00 0.00 -0.00 0.00 0.00 57.16 57.69 1j9i n GLU 67 Cb 1.55 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 32.99 1j9i n GLU 67 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22