#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 1.98 0.35 2.12 2.12 -1.26 0.17 118.70 124.18 1j9i s GLU 2 Ca 0.00 -2.38 0.04 0.00 0.36 0.00 0.00 54.97 52.98 1j9i s GLU 2 Cb 0.00 -3.39 -0.01 0.00 0.26 0.00 0.00 34.13 30.98 1j9i s GLU 2 CO 0.00 -1.08 0.52 0.14 -0.54 0.00 0.00 175.26 174.30 1j9i s VAL 3 N 0.12 4.42 0.38 3.70 -7.23 -0.66 -4.75 120.40 116.39 1j9i s VAL 3 Ca 0.15 -0.77 -0.02 0.00 -1.81 0.00 0.00 61.98 59.54 1j9i s VAL 3 Cb -0.23 -3.58 0.08 0.00 0.56 0.00 0.00 36.38 33.21 1j9i s VAL 3 CO -0.03 -0.30 0.52 -0.46 -0.31 0.00 0.00 175.10 174.52 1j9i n ASN 4 N -1.75 0.54 -0.27 4.85 0.23 -1.26 -0.50 115.26 117.09 1j9i n ASN 4 Ca -0.02 -1.49 0.08 0.00 -0.53 0.00 0.00 54.58 52.62 1j9i n ASN 4 Cb 0.57 -0.35 0.32 0.00 -2.08 0.00 0.00 39.78 38.24 1j9i n ASN 4 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 1j9i h LYS 5 N 0.00 0.80 0.28 -3.83 1.63 -1.93 0.39 116.57 113.91 1j9i h LYS 5 Ca -0.17 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.57 1j9i h LYS 5 Cb 0.59 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 32.04 1j9i h LYS 5 CO 0.17 0.53 -0.13 0.87 -3.45 0.00 0.00 179.45 177.44 1j9i h LYS 6 N 0.83 -0.36 -0.91 1.90 1.57 -1.96 -1.61 116.57 116.04 1j9i h LYS 6 Ca 0.41 0.02 0.19 0.00 -1.87 0.00 0.00 60.65 59.41 1j9i h LYS 6 Cb 0.47 0.08 -0.11 0.00 0.08 0.00 0.00 32.23 32.75 1j9i h LYS 6 CO -0.18 -0.23 0.47 1.96 -0.57 0.00 0.00 179.45 180.90 1j9i h GLN 7 N -1.10 0.54 0.58 3.15 1.08 -1.89 1.33 115.11 118.80 1j9i h GLN 7 Ca -0.04 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.10 1j9i h GLN 7 Cb 0.29 -0.12 0.01 0.00 -0.05 0.00 0.00 27.48 27.61 1j9i h GLN 7 CO 0.06 0.36 -0.28 1.25 -0.95 0.00 0.00 178.83 179.27 1j9i h LEU 8 N 0.56 -0.65 -1.68 1.46 6.46 -0.27 2.51 115.31 123.70 1j9i h LEU 8 Ca 0.54 -0.00 -0.03 0.00 -0.12 0.00 0.00 57.88 58.27 1j9i h LEU 8 Cb 0.91 0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 41.01 1j9i h LEU 8 CO -0.44 -0.42 -0.11 0.00 -0.62 0.00 0.00 178.44 176.85 1j9i h ALA 9 N -0.44 1.74 0.04 1.25 0.00 -0.20 0.03 119.26 121.69 1j9i h ALA 9 Ca -0.08 -0.13 -0.28 0.00 0.00 0.00 0.00 54.91 54.43 1j9i h ALA 9 Cb 0.62 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.39 1j9i h ALA 9 CO 0.13 0.20 -1.11 -0.44 0.00 0.00 0.00 179.25 178.02 1j9i h ASP 10 N 0.06 0.88 -0.14 0.00 5.19 0.23 0.42 116.42 123.06 1j9i h ASP 10 Ca 0.01 -0.74 -0.14 0.00 -0.62 0.00 0.00 57.03 55.54 1j9i h ASP 10 Cb 0.24 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.47 1j9i h ASP 10 CO 0.02 1.54 -0.40 -0.29 -3.12 0.00 0.00 179.24 176.99 1j9i h ILE 11 N 0.34 1.29 -0.01 0.35 2.10 0.49 -2.49 117.51 119.59 1j9i h ILE 11 Ca -0.15 -1.57 0.00 0.00 1.08 0.00 0.00 64.86 64.22 1j9i h ILE 11 Cb 1.77 1.50 0.00 0.00 -1.09 0.00 0.00 36.82 39.01 1j9i h ILE 11 CO 0.22 0.50 -0.01 0.49 -1.08 0.00 0.00 178.15 178.27 1j9i n PHE 12 N -4.04 0.00 -1.06 2.19 3.01 -0.06 -4.88 117.46 112.63 1j9i n PHE 12 Ca -0.02 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.42 1j9i n PHE 12 Cb 0.53 -0.01 -0.01 0.00 -0.01 0.00 0.00 39.48 39.98 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 1.16 0.34 0.00 1.37 0.00 -0.26 -4.96 105.19 102.84 1j9i n GLY 13 Ca 0.19 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 1.04 0.00 -2.97 4.61 0.00 0.13 -4.95 120.51 118.37 1j9i n ALA 14 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.09 1j9i n ALA 14 Cb 0.39 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.69 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 3.81 0.59 0.00 0.01 -1.26 -4.59 113.70 111.26 1j9i s SER 15 Ca 0.00 -0.35 0.29 0.00 1.31 0.00 0.00 55.95 57.19 1j9i s SER 15 Cb 0.00 -1.40 1.48 0.00 0.21 0.00 0.00 66.02 66.31 1j9i s SER 15 CO 0.00 0.20 1.90 0.40 0.41 0.00 0.00 173.24 176.15 1j9i h ILE 16 N 5.25 0.35 -0.22 1.44 2.04 -1.87 2.48 117.51 126.99 1j9i h ILE 16 Ca -0.28 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.46 1j9i h ILE 16 Cb 1.20 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 1j9i h ILE 16 CO 0.53 0.00 -0.36 0.03 0.00 0.00 0.00 178.15 178.34 1j9i h ARG 17 N 0.00 0.49 -0.17 2.37 2.47 -1.94 -1.14 114.38 116.47 1j9i h ARG 17 Ca 0.20 -0.23 -0.15 0.00 -1.26 0.00 0.00 59.98 58.55 1j9i h ARG 17 Cb 1.15 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.45 1j9i h ARG 17 CO -0.00 0.78 -0.51 1.15 0.56 0.00 0.00 179.97 181.95 1j9i h THR 18 N 0.41 1.33 -0.28 2.04 2.02 0.38 -2.11 112.91 116.69 1j9i h THR 18 Ca 0.04 -1.75 -0.02 0.00 0.77 0.00 0.00 66.41 65.44 1j9i h THR 18 Cb 0.83 1.76 -0.01 0.00 -1.74 0.00 0.00 68.15 68.98 1j9i h THR 18 CO 0.07 0.54 0.06 0.40 0.37 0.00 0.00 175.52 176.96 1j9i h ILE 19 N 0.36 1.14 0.00 3.11 1.08 -0.00 0.41 117.51 123.61 1j9i h ILE 19 Ca 0.01 -0.48 -0.05 0.00 -0.39 0.00 0.00 64.86 63.96 1j9i h ILE 19 Cb 1.03 0.86 -0.01 0.00 -3.07 0.00 0.00 36.82 35.63 1j9i h ILE 19 CO 0.09 0.17 -0.23 1.56 -0.69 0.00 0.00 178.15 179.05 1j9i h GLN 20 N 0.39 0.00 0.00 2.37 1.08 -0.58 -0.07 115.11 118.29 1j9i h GLN 20 Ca 0.09 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.21 1j9i h GLN 20 Cb 0.16 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.58 1j9i h GLN 20 CO -0.00 0.23 -0.70 -0.97 -0.95 0.00 0.00 178.83 176.44 1j9i h ASN 21 N 0.00 0.00 0.02 1.46 -0.73 0.08 -3.27 115.58 113.15 1j9i h ASN 21 Ca -0.00 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.17 1j9i h ASN 21 Cb 0.63 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.22 1j9i h ASN 21 CO 0.03 0.37 -0.01 -0.50 -0.37 0.00 0.00 177.43 176.95 1j9i h TRP 22 N 0.00 -0.02 -0.35 0.67 4.06 0.59 -2.74 115.95 118.16 1j9i h TRP 22 Ca -0.04 -0.00 0.10 0.00 2.06 0.00 0.00 58.89 61.01 1j9i h TRP 22 Cb 1.32 0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 29.47 1j9i h TRP 22 CO 0.00 0.71 0.49 0.37 -3.56 0.00 0.00 178.44 176.45 1j9i h GLN 23 N -0.82 0.00 -0.40 0.49 4.15 -1.16 0.59 115.11 117.96 1j9i h GLN 23 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1j9i h GLN 23 Cb 0.74 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.43 1j9i h GLN 23 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 178.83 177.29 1j9i n GLU 24 N -3.45 3.31 0.00 1.69 -0.58 -1.18 -4.33 120.64 116.09 1j9i n GLU 24 Ca 0.06 -2.70 0.02 0.00 -0.42 0.00 0.00 57.16 54.12 1j9i n GLU 24 Cb 0.64 -1.76 0.02 0.00 -0.57 0.00 0.00 31.44 29.77 1j9i n GLU 24 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 1j9i n GLN 25 N 0.22 -0.40 0.00 3.49 -0.06 0.21 -4.97 117.38 115.87 1j9i n GLN 25 Ca 0.21 -0.72 0.00 0.00 -2.00 0.00 0.00 57.00 54.49 1j9i n GLN 25 Cb 0.81 -1.07 0.00 0.00 -4.06 0.00 0.00 30.24 25.92 1j9i n GLN 25 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1j9i n GLY 26 N 0.22 1.45 3.86 1.69 0.00 -1.17 -5.07 105.19 106.18 1j9i n GLY 26 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.37 3.89 -0.98 1.61 0.23 -1.14 -5.00 119.30 117.54 1j9i s MET 27 Ca 0.00 0.50 -0.20 0.00 -1.03 0.00 0.00 55.69 54.95 1j9i s MET 27 Cb 0.00 -2.49 0.10 0.00 -1.53 0.00 0.00 34.83 30.91 1j9i s MET 27 CO 0.00 0.16 1.28 -1.25 -2.03 0.00 0.00 175.02 173.18 1j9i s PRO 28 N -3.15 3.61 -0.06 3.16 0.04 -1.26 -4.90 135.00 132.44 1j9i s PRO 28 Ca 0.51 -1.50 -0.19 0.00 0.04 0.00 0.00 61.00 59.86 1j9i s PRO 28 Cb -0.10 -5.12 -0.05 0.00 0.04 0.00 0.00 34.50 29.27 1j9i s PRO 28 CO 0.22 -1.97 0.54 0.54 0.04 0.00 0.00 177.00 176.37 1j9i s VAL 29 N 3.67 5.06 0.00 -0.36 0.11 -1.26 -3.36 120.40 124.26 1j9i s VAL 29 Ca 0.39 1.11 0.00 0.00 -2.93 0.00 0.00 61.98 60.54 1j9i s VAL 29 Cb -0.03 -3.88 0.00 0.00 -1.53 0.00 0.00 36.38 30.95 1j9i s VAL 29 CO -0.09 0.37 0.53 0.18 -3.33 0.00 0.00 175.10 172.75 1j9i n LEU 30 N 3.22 0.00 -4.80 2.54 7.99 0.04 -4.67 117.00 121.32 1j9i n LEU 30 Ca -0.07 0.53 -0.31 0.00 -0.01 0.00 0.00 56.01 56.15 1j9i n LEU 30 Cb 0.51 -0.03 0.07 0.00 -0.11 0.00 0.00 43.42 43.87 1j9i n LEU 30 CO 0.43 -0.03 0.71 -0.13 -1.51 0.00 0.00 177.39 176.87 1j9i s ARG 31 N -1.10 2.51 -0.79 3.23 3.00 -1.26 -4.78 118.95 119.77 1j9i s ARG 31 Ca 0.00 0.87 -0.04 0.00 0.00 0.00 0.00 55.73 56.56 1j9i s ARG 31 Cb 0.00 -1.95 0.15 0.00 0.00 0.00 0.00 34.95 33.15 1j9i s ARG 31 CO 0.00 -1.38 2.45 0.41 0.00 0.00 0.00 175.30 176.79 1j9i n GLY 32 N -1.91 4.95 0.58 -3.53 0.00 -1.26 -3.85 105.19 100.16 1j9i n GLY 32 Ca 0.07 -2.10 0.41 0.00 0.00 0.00 0.00 46.02 44.40 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 0.73 -0.81 2.29 -0.02 0.00 -1.26 -4.62 105.19 101.50 1j9i n GLY 33 Ca 0.53 0.53 -0.16 0.00 0.00 0.00 0.00 46.02 46.92 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 -1.75 0.69 3.14 -0.02 0.00 -1.26 -2.44 105.19 103.55 1j9i n GLY 34 Ca 0.34 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.29 1j9i n GLY 34 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1j9i n LYS 35 N -2.38 -1.61 0.00 1.61 4.81 -1.26 -4.82 118.16 114.51 1j9i n LYS 35 Ca -0.17 1.53 0.00 0.00 -0.87 0.00 0.00 58.31 58.80 1j9i n LYS 35 Cb 0.57 -5.10 0.00 0.00 0.02 0.00 0.00 35.03 30.52 1j9i n LYS 35 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1j9i n GLY 36 N -1.36 0.00 0.23 3.14 0.00 -1.02 -5.08 105.19 101.10 1j9i n GLY 36 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 0.00 0.00 -1.72 1.61 4.13 -1.13 -5.06 115.26 113.09 1j9i n ASN 37 Ca 0.00 0.00 -0.01 0.00 1.68 0.00 0.00 54.58 56.25 1j9i n ASN 37 Cb 0.00 0.05 0.03 0.00 -1.54 0.00 0.00 39.78 38.32 1j9i n ASN 37 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 1j9i n GLU 38 N -1.18 0.30 -1.62 3.52 0.00 -1.26 -5.02 120.64 115.38 1j9i n GLU 38 Ca 0.00 -0.27 -0.61 0.00 0.00 0.00 0.00 57.16 56.28 1j9i n GLU 38 Cb 0.00 0.12 -0.09 0.00 0.00 0.00 0.00 31.44 31.47 1j9i n GLU 38 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1j9i n VAL 39 N -0.34 0.14 -2.55 3.84 0.31 -1.26 -4.58 118.33 113.89 1j9i n VAL 39 Ca -0.04 -0.05 -0.01 0.00 -0.01 0.00 0.00 64.34 64.24 1j9i n VAL 39 Cb 0.58 -0.89 0.00 0.00 -0.91 0.00 0.00 33.84 32.62 1j9i n VAL 39 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1j9i n LEU 40 N 5.69 0.00 -3.62 7.52 7.99 -1.25 -4.62 117.00 128.70 1j9i n LEU 40 Ca 0.34 -0.06 -0.17 0.00 -0.01 0.00 0.00 56.01 56.11 1j9i n LEU 40 Cb 0.04 -0.02 -0.15 0.00 -0.11 0.00 0.00 43.42 43.19 1j9i n LEU 40 CO 0.85 -0.51 -0.23 -0.31 -1.51 0.00 0.00 177.39 175.68 1j9i s TYR 41 N 0.45 -0.20 -0.82 -1.77 2.02 0.34 -0.78 117.35 116.59 1j9i s TYR 41 Ca 0.02 0.50 -0.26 0.00 -0.37 0.00 0.00 57.07 56.96 1j9i s TYR 41 Cb -0.00 -0.29 -0.15 0.00 -0.40 0.00 0.00 41.96 41.12 1j9i s TYR 41 CO 0.01 -0.37 2.39 0.34 -1.57 0.00 0.00 175.55 176.35 1j9i s ASP 42 N 2.30 3.79 0.34 2.29 -1.08 -1.21 -1.65 116.67 121.46 1j9i s ASP 42 Ca 0.04 -0.05 0.27 0.00 -0.52 0.00 0.00 52.55 52.29 1j9i s ASP 42 Cb -0.13 -2.56 1.14 0.00 -1.46 0.00 0.00 42.92 39.91 1j9i s ASP 42 CO -0.08 -4.02 1.14 -0.24 0.52 0.00 0.00 175.17 172.49 1j9i n SER 43 N 18.95 0.11 -0.09 -0.34 2.88 0.45 0.28 113.62 135.85 1j9i n SER 43 Ca 0.46 0.94 -0.16 0.00 -1.33 0.00 0.00 58.87 58.77 1j9i n SER 43 Cb 0.43 -0.46 -0.08 0.00 -0.75 0.00 0.00 64.21 63.35 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 -2.58 0.69 0.30 -1.46 0.00 -1.25 -3.28 120.51 112.93 1j9i n ALA 44 Ca 0.30 -0.49 0.15 0.00 0.00 0.00 0.00 53.44 53.40 1j9i n ALA 44 Cb 1.23 -0.35 0.92 0.00 0.00 0.00 0.00 19.45 21.25 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 -0.68 1.51 0.00 0.00 0.00 -1.15 0.22 119.26 119.17 1j9i h ALA 45 Ca -0.25 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 1j9i h ALA 45 Cb 1.06 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1j9i h ALA 45 CO -0.15 0.01 -0.37 0.28 0.00 0.00 0.00 179.25 179.02 1j9i h VAL 46 N 0.00 1.00 0.00 0.00 2.07 0.38 -3.14 116.25 116.56 1j9i h VAL 46 Ca -0.00 -1.40 -0.20 0.00 0.82 0.00 0.00 66.70 65.92 1j9i h VAL 46 Cb 0.01 1.82 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 1j9i h VAL 46 CO 0.00 0.36 -1.15 2.30 0.02 0.00 0.00 177.57 179.10 1j9i n ILE 47 N -3.71 1.51 -0.45 4.57 -5.35 0.73 -1.85 119.36 114.81 1j9i n ILE 47 Ca -0.01 0.01 0.37 0.00 -0.27 0.00 0.00 62.75 62.85 1j9i n ILE 47 Cb 0.46 -2.10 0.68 0.00 -1.74 0.00 0.00 39.64 36.94 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 0.10 0.00 6.28 3.64 -1.52 3.08 116.57 127.16 1j9i h LYS 48 Ca -0.29 -0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 58.90 1j9i h LYS 48 Cb 1.17 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.94 1j9i h LYS 48 CO -0.18 0.07 -1.18 2.35 -2.27 0.00 0.00 179.45 178.24 1j9i h TRP 49 N 0.11 0.00 0.00 1.91 7.01 -1.67 -3.19 115.95 120.11 1j9i h TRP 49 Ca 0.75 0.00 -0.10 0.00 2.11 0.00 0.00 58.89 61.65 1j9i h TRP 49 Cb 2.54 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 29.58 1j9i h TRP 49 CO -0.00 0.69 -1.09 -0.92 -2.79 0.00 0.00 178.44 174.32 1j9i h TYR 50 N 0.00 0.00 0.00 2.65 5.03 0.45 -3.31 116.97 121.78 1j9i h TYR 50 Ca -0.12 0.00 -0.09 0.00 2.58 0.00 0.00 58.73 61.10 1j9i h TYR 50 Cb 1.63 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 39.90 1j9i h TYR 50 CO 0.00 0.36 -0.42 0.00 -1.32 0.00 0.00 178.16 176.78 1j9i h ALA 51 N 1.64 0.76 -0.58 1.82 0.00 0.44 0.48 119.26 123.82 1j9i h ALA 51 Ca -0.08 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1j9i h ALA 51 Cb 1.35 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1j9i h ALA 51 CO 0.03 0.53 0.00 0.39 0.00 0.00 0.00 179.25 180.20 1j9i n GLU 52 N -3.25 3.27 0.00 0.00 -0.58 -1.21 -4.62 120.64 114.25 1j9i n GLU 52 Ca 0.02 -2.47 0.00 0.00 -0.42 0.00 0.00 57.16 54.29 1j9i n GLU 52 Cb 0.67 -1.78 0.00 0.00 -0.57 0.00 0.00 31.44 29.76 1j9i n GLU 52 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 1j9i n ARG 53 N 1.02 0.00 -0.20 3.49 -4.01 -1.19 -4.94 116.66 110.82 1j9i n ARG 53 Ca 0.22 0.00 0.05 0.00 -1.04 0.00 0.00 57.85 57.08 1j9i n ARG 53 Cb 0.76 0.00 0.15 0.00 -3.04 0.00 0.00 32.46 30.33 1j9i n ARG 53 CO 0.00 0.00 0.00 -0.25 -3.04 0.00 0.00 177.63 174.34 1j9i n ASP 54 N -0.09 1.95 0.18 2.89 9.92 0.17 -3.68 116.55 127.89 1j9i n ASP 54 Ca 0.00 -2.08 0.13 0.00 -0.53 0.00 0.00 54.79 52.32 1j9i n ASP 54 Cb 0.00 -0.28 0.41 0.00 -0.64 0.00 0.00 41.12 40.61 1j9i n ASP 54 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1j9i h ALA 55 N 3.45 1.00 0.00 2.24 0.00 -1.75 -2.59 119.26 121.61 1j9i h ALA 55 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1j9i h ALA 55 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1j9i h ALA 55 CO 0.04 0.00 -0.24 1.49 0.00 0.00 0.00 179.25 180.54 1j9i h GLU 56 N 0.00 0.00 -0.10 0.00 4.81 -1.90 -3.24 114.58 114.15 1j9i h GLU 56 Ca 0.00 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 1j9i h GLU 56 Cb 0.69 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.07 1j9i h GLU 56 CO 0.00 0.00 0.47 0.82 -0.73 0.00 0.00 179.01 179.57 1j9i h ILE 57 N 0.00 0.06 -0.09 2.32 5.03 -1.70 0.28 117.51 123.40 1j9i h ILE 57 Ca 0.00 0.00 0.03 0.00 -0.12 0.00 0.00 64.86 64.77 1j9i h ILE 57 Cb 0.98 0.55 -0.00 0.00 -3.03 0.00 0.00 36.82 35.32 1j9i h ILE 57 CO 0.00 0.00 0.70 -0.08 -0.68 0.00 0.00 178.15 178.09 1j9i h GLU 58 N 0.00 0.00 0.00 2.37 4.81 -1.76 2.65 114.58 122.65 1j9i h GLU 58 Ca 0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1j9i h GLU 58 Cb 0.99 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.37 1j9i h GLU 58 CO -0.00 0.00 -0.51 -1.71 -0.73 0.00 0.00 179.01 176.06 1j9i n ASN 59 N -2.78 0.66 -0.31 1.04 2.85 0.09 -3.89 115.26 112.91 1j9i n ASN 59 Ca 0.01 0.15 0.35 0.00 -0.11 0.00 0.00 54.58 54.98 1j9i n ASN 59 Cb 0.75 0.02 0.71 0.00 1.24 0.00 0.00 39.78 42.50 1j9i n ASN 59 CO 0.00 0.00 0.00 1.05 -2.11 0.00 0.00 177.26 176.20 1j9i h GLU 60 N 0.00 0.00 0.00 1.20 -0.00 0.45 1.54 114.58 117.77 1j9i h GLU 60 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 59.35 1j9i h GLU 60 Cb 0.70 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.45 1j9i h GLU 60 CO 0.00 0.00 -0.03 0.87 -0.00 0.00 0.00 179.01 179.85 1j9i h LYS 61 N 0.00 0.00 -0.14 1.06 1.57 -1.73 -1.34 116.57 115.99 1j9i h LYS 61 Ca 0.57 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.35 1j9i h LYS 61 Cb 2.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.82 1j9i h LYS 61 CO -0.01 0.03 0.00 1.28 -0.57 0.00 0.00 179.45 180.19 1j9i n LEU 62 N -4.39 2.64 0.00 2.94 4.77 0.52 -4.64 117.00 118.85 1j9i n LEU 62 Ca -0.03 -1.24 0.00 0.00 -0.03 0.00 0.00 56.01 54.71 1j9i n LEU 62 Cb 0.12 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1j9i n LEU 62 CO 0.33 0.53 0.00 -1.14 -1.33 0.00 0.00 177.39 175.78 1j9i n ARG 63 N 0.97 0.00 0.00 3.23 0.63 -0.50 -5.01 116.66 115.97 1j9i n ARG 63 Ca 0.12 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.05 1j9i n ARG 63 Cb 0.44 -0.05 0.00 0.00 0.45 0.00 0.00 32.46 33.31 1j9i n ARG 63 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 1j9i n ARG 64 N 0.00 0.00 0.24 -0.14 1.85 -1.26 -4.90 116.66 112.45 1j9i n ARG 64 Ca 0.00 0.00 0.16 0.00 -1.00 0.00 0.00 57.85 57.01 1j9i n ARG 64 Cb 0.00 0.00 0.69 0.00 -1.05 0.00 0.00 32.46 32.10 1j9i n ARG 64 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 1j9i h GLU 65 N 0.00 0.00 0.20 2.89 5.08 -1.91 -2.70 114.58 118.15 1j9i h GLU 65 Ca 0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.03 1j9i h GLU 65 Cb 0.00 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.27 1j9i h GLU 65 CO 0.00 0.00 -1.57 -0.24 -1.00 0.00 0.00 179.01 176.20 1j9i h VAL 66 N 0.00 1.10 0.00 3.13 3.04 -1.89 -3.27 116.25 118.36 1j9i h VAL 66 Ca 0.00 -2.57 0.00 0.00 -1.01 0.00 0.00 66.70 63.12 1j9i h VAL 66 Cb 0.41 2.89 0.00 0.00 -2.01 0.00 0.00 31.29 32.58 1j9i h VAL 66 CO 0.00 0.82 0.00 -0.08 -1.01 0.00 0.00 177.57 177.30 1j9i h GLU 67 N 0.05 0.00 0.00 4.17 4.81 -1.75 -3.52 114.58 118.35 1j9i h GLU 67 Ca -0.30 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1j9i h GLU 67 Cb 2.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.45 1j9i h GLU 67 CO 0.20 0.00 0.00 0.39 -0.73 0.00 0.00 179.01 178.87