#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 2.14 0.29 2.12 2.12 -1.26 0.23 118.70 124.33 1j9i s GLU 2 Ca 0.00 -2.46 0.05 0.00 0.36 0.00 0.00 54.97 52.92 1j9i s GLU 2 Cb 0.00 -3.47 -0.02 0.00 0.26 0.00 0.00 34.13 30.89 1j9i s GLU 2 CO 0.00 -1.11 0.43 0.14 -0.54 0.00 0.00 175.26 174.17 1j9i s VAL 3 N 0.01 4.82 0.59 3.70 -7.23 -0.24 -4.74 120.40 117.31 1j9i s VAL 3 Ca 0.16 -0.92 -0.03 0.00 -1.81 0.00 0.00 61.98 59.38 1j9i s VAL 3 Cb -0.23 -3.70 0.03 0.00 0.56 0.00 0.00 36.38 33.04 1j9i s VAL 3 CO -0.02 -0.30 0.86 0.20 -0.31 0.00 0.00 175.10 175.53 1j9i s ASN 4 N -4.06 5.27 0.32 4.85 0.01 -1.26 -0.09 114.94 119.97 1j9i s ASN 4 Ca 0.39 0.30 0.08 0.00 -0.71 0.00 0.00 52.86 52.91 1j9i s ASN 4 Cb -0.09 -1.18 0.91 0.00 0.41 0.00 0.00 41.25 41.30 1j9i s ASN 4 CO 0.31 -1.21 1.61 0.07 -1.51 0.00 0.00 177.10 176.37 1j9i h LYS 5 N -0.13 0.11 0.19 -0.60 2.10 -1.87 1.88 116.57 118.26 1j9i h LYS 5 Ca -0.44 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.19 1j9i h LYS 5 Cb 1.29 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 1j9i h LYS 5 CO 0.57 0.08 -0.09 -0.22 -2.00 0.00 0.00 179.45 177.78 1j9i h LYS 6 N 0.12 -0.25 -0.87 0.07 3.64 -1.95 0.66 116.57 117.99 1j9i h LYS 6 Ca 0.65 0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 60.03 1j9i h LYS 6 Cb 1.47 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 33.30 1j9i h LYS 6 CO -0.75 0.08 0.46 1.96 -2.27 0.00 0.00 179.45 178.92 1j9i h GLN 7 N -0.60 1.22 0.25 1.90 1.08 -1.14 0.55 115.11 118.36 1j9i h GLN 7 Ca -0.03 -0.15 -0.01 0.00 -1.45 0.00 0.00 58.65 57.01 1j9i h GLN 7 Cb 0.44 -0.23 0.00 0.00 -0.05 0.00 0.00 27.48 27.64 1j9i h GLN 7 CO 0.04 0.91 -0.12 1.25 -0.95 0.00 0.00 178.83 179.96 1j9i h LEU 8 N 1.22 -0.28 -1.58 1.46 6.46 0.30 1.90 115.31 124.78 1j9i h LEU 8 Ca 0.30 -0.09 -0.04 0.00 -0.12 0.00 0.00 57.88 57.94 1j9i h LEU 8 Cb 0.05 0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.05 1j9i h LEU 8 CO -0.05 -0.09 -0.12 0.00 -0.62 0.00 0.00 178.44 177.57 1j9i h ALA 9 N 0.25 1.66 0.01 1.25 0.00 0.61 -1.68 119.26 121.36 1j9i h ALA 9 Ca -0.03 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 1j9i h ALA 9 Cb 0.35 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.09 1j9i h ALA 9 CO 0.06 0.26 -0.26 -0.44 0.00 0.00 0.00 179.25 178.86 1j9i h ASP 10 N 0.11 0.22 -0.17 0.00 5.19 0.67 1.14 116.42 123.59 1j9i h ASP 10 Ca 0.02 -0.80 0.05 0.00 -0.62 0.00 0.00 57.03 55.69 1j9i h ASP 10 Cb 0.29 -0.07 -0.01 0.00 0.18 0.00 0.00 39.33 39.73 1j9i h ASP 10 CO 0.02 0.99 0.17 -0.29 -3.12 0.00 0.00 179.24 177.01 1j9i h ILE 11 N -0.52 0.53 -0.02 0.35 2.10 0.33 0.32 117.51 120.60 1j9i h ILE 11 Ca -0.03 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.91 1j9i h ILE 11 Cb 1.04 0.86 0.00 0.00 -1.09 0.00 0.00 36.82 37.63 1j9i h ILE 11 CO 0.05 0.00 -0.14 0.49 -1.08 0.00 0.00 178.15 177.47 1j9i n PHE 12 N -3.90 0.00 -1.24 2.19 3.01 -0.66 -4.93 117.46 111.93 1j9i n PHE 12 Ca 0.01 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.39 1j9i n PHE 12 Cb 0.30 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.73 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 1.14 0.85 0.00 1.37 0.00 0.11 -4.95 105.19 103.72 1j9i n GLY 13 Ca 0.10 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 1.15 0.00 -3.01 4.61 0.00 0.36 -4.93 120.51 118.69 1j9i n ALA 14 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.03 1j9i n ALA 14 Cb 0.50 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.82 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 4.27 0.60 0.00 0.01 -1.26 -4.58 113.70 111.75 1j9i s SER 15 Ca 0.00 -0.25 0.28 0.00 1.31 0.00 0.00 55.95 57.29 1j9i s SER 15 Cb 0.00 -1.63 1.41 0.00 0.21 0.00 0.00 66.02 66.01 1j9i s SER 15 CO 0.00 0.18 1.82 0.40 0.41 0.00 0.00 173.24 176.05 1j9i h ILE 16 N 5.26 0.27 -0.68 1.44 2.04 -1.88 2.35 117.51 126.32 1j9i h ILE 16 Ca -0.28 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.50 1j9i h ILE 16 Cb 1.20 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.80 1j9i h ILE 16 CO 0.58 0.00 0.12 0.03 0.00 0.00 0.00 178.15 178.88 1j9i h ARG 17 N 0.00 1.11 -0.25 2.37 2.47 -1.95 0.61 114.38 118.74 1j9i h ARG 17 Ca 0.21 -0.29 -0.05 0.00 -1.26 0.00 0.00 59.98 58.60 1j9i h ARG 17 Cb 1.32 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 29.49 1j9i h ARG 17 CO -0.00 1.00 -0.08 1.15 0.56 0.00 0.00 179.97 182.60 1j9i h THR 18 N 1.04 1.19 -0.07 2.04 2.02 0.35 0.36 112.91 119.85 1j9i h THR 18 Ca 0.21 -0.82 -0.11 0.00 0.77 0.00 0.00 66.41 66.46 1j9i h THR 18 Cb 0.42 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.91 1j9i h THR 18 CO 0.01 0.27 -0.48 0.40 0.37 0.00 0.00 175.52 176.08 1j9i h ILE 19 N 0.37 1.34 0.00 3.11 1.08 0.39 0.74 117.51 124.55 1j9i h ILE 19 Ca 0.08 -1.68 -0.09 0.00 -0.39 0.00 0.00 64.86 62.78 1j9i h ILE 19 Cb 0.37 1.83 -0.01 0.00 -3.07 0.00 0.00 36.82 35.94 1j9i h ILE 19 CO 0.02 0.49 -0.41 1.56 -0.69 0.00 0.00 178.15 179.12 1j9i h GLN 20 N 0.13 0.00 0.00 2.37 1.08 0.27 -0.99 115.11 117.98 1j9i h GLN 20 Ca 0.01 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.10 1j9i h GLN 20 Cb 0.90 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.31 1j9i h GLN 20 CO 0.07 0.41 -1.05 -0.97 -0.95 0.00 0.00 178.83 176.34 1j9i h ASN 21 N 0.00 0.00 0.00 1.46 -1.24 0.58 -3.33 115.58 113.05 1j9i h ASN 21 Ca -0.00 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.01 1j9i h ASN 21 Cb 0.96 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.01 1j9i h ASN 21 CO 0.05 0.40 -0.00 -0.50 -1.29 0.00 0.00 177.43 176.09 1j9i h TRP 22 N 0.00 -0.00 -1.11 0.67 4.06 0.87 -2.42 115.95 118.02 1j9i h TRP 22 Ca -0.08 -0.00 0.32 0.00 2.06 0.00 0.00 58.89 61.19 1j9i h TRP 22 Cb 1.38 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 29.49 1j9i h TRP 22 CO 0.00 0.65 0.87 0.37 -3.56 0.00 0.00 178.44 176.77 1j9i h GLN 23 N -0.65 0.00 -0.02 0.49 -0.00 -1.32 1.92 115.11 115.52 1j9i h GLN 23 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1j9i h GLN 23 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.13 1j9i h GLN 23 CO 0.00 0.00 -0.07 -0.85 0.00 0.00 0.00 178.83 177.91 1j9i n GLU 24 N -3.99 1.87 -0.00 1.69 0.28 -1.11 -3.98 120.64 115.39 1j9i n GLU 24 Ca 0.24 -1.39 0.12 0.00 -0.16 0.00 0.00 57.16 55.97 1j9i n GLU 24 Cb 1.23 -1.47 0.16 0.00 1.43 0.00 0.00 31.44 32.79 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 0.64 2.25 -0.36 3.44 1.13 0.65 -4.92 117.38 120.21 1j9i n GLN 25 Ca 0.15 -1.81 0.00 0.00 -1.94 0.00 0.00 57.00 53.40 1j9i n GLN 25 Cb 0.48 -1.46 0.00 0.00 0.11 0.00 0.00 30.24 29.37 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 1.33 1.39 3.78 1.08 0.00 -1.11 -5.07 105.19 106.59 1j9i n GLY 26 Ca 0.15 -0.13 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 1j9i n GLY 26 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1j9i s MET 27 N -1.16 4.58 -1.19 1.61 1.75 -1.17 -4.94 119.30 118.78 1j9i s MET 27 Ca 0.00 1.20 -0.21 0.00 -1.25 0.00 0.00 55.69 55.43 1j9i s MET 27 Cb 0.00 -3.17 -0.03 0.00 2.84 0.00 0.00 34.83 34.47 1j9i s MET 27 CO 0.00 0.51 1.86 -1.25 -0.65 0.00 0.00 175.02 175.49 1j9i s PRO 28 N -1.36 2.97 0.28 4.11 0.04 -1.26 -4.87 135.00 134.92 1j9i s PRO 28 Ca 0.39 -1.34 -0.22 0.00 0.04 0.00 0.00 61.00 59.87 1j9i s PRO 28 Cb -0.22 -5.32 -0.09 0.00 0.04 0.00 0.00 34.50 28.91 1j9i s PRO 28 CO 0.26 -3.38 0.84 0.54 0.04 0.00 0.00 177.00 175.30 1j9i s VAL 29 N 8.77 4.41 0.00 -0.36 0.11 -1.26 -3.38 120.40 128.68 1j9i s VAL 29 Ca 0.63 1.51 0.00 0.00 -2.93 0.00 0.00 61.98 61.20 1j9i s VAL 29 Cb 0.00 -3.89 0.00 0.00 -1.53 0.00 0.00 36.38 30.96 1j9i s VAL 29 CO 0.10 0.12 0.91 0.18 -3.33 0.00 0.00 175.10 173.08 1j9i n LEU 30 N 0.50 0.00 0.00 2.54 7.99 -0.55 -4.69 117.00 122.79 1j9i n LEU 30 Ca 0.00 0.91 0.00 0.00 -0.01 0.00 0.00 56.01 56.91 1j9i n LEU 30 Cb 0.51 -0.41 0.00 0.00 -0.11 0.00 0.00 43.42 43.41 1j9i n LEU 30 CO 0.43 -0.41 0.00 0.54 -1.51 0.00 0.00 177.39 176.44 1j9i n ARG 31 N -2.03 0.22 -0.05 3.23 3.00 -1.26 -4.83 116.66 114.95 1j9i n ARG 31 Ca 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 57.85 57.85 1j9i n ARG 31 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 32.46 32.30 1j9i n ARG 31 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1j9i n GLY 32 N 5.00 -1.02 2.42 -0.13 0.00 -1.26 -4.43 105.19 105.76 1j9i n GLY 32 Ca 0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 46.02 45.60 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 1.49 -0.47 0.93 -0.02 0.00 -1.26 -4.68 105.19 101.18 1j9i n GLY 33 Ca -0.18 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.48 2.76 2.26 -0.02 0.00 -1.26 -4.41 105.19 104.04 1j9i n GLY 34 Ca 0.00 -0.57 -0.23 0.00 0.00 0.00 0.00 46.02 45.22 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 0.83 1.14 -1.25 1.61 4.01 -1.26 -4.87 118.16 118.38 1j9i n LYS 35 Ca 0.17 -3.53 -0.08 0.00 -0.51 0.00 0.00 58.31 54.35 1j9i n LYS 35 Cb 0.54 -1.52 -0.04 0.00 -0.51 0.00 0.00 35.03 33.50 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 0.97 0.91 0.00 0.72 0.00 -1.26 -4.96 105.19 101.56 1j9i n GLY 36 Ca 0.24 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.69 0.00 0.00 1.61 4.13 -1.26 -5.05 115.26 114.00 1j9i n ASN 37 Ca -0.08 -0.05 0.00 0.00 1.68 0.00 0.00 54.58 56.13 1j9i n ASN 37 Cb 0.46 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.70 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 -0.05 2.22 -1.97 3.52 0.28 -1.26 -4.85 120.64 118.54 1j9i n GLU 38 Ca 0.00 -0.17 0.00 0.00 -0.16 0.00 0.00 57.16 56.83 1j9i n GLU 38 Cb 0.00 -0.60 0.00 0.00 1.43 0.00 0.00 31.44 32.27 1j9i n GLU 38 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1j9i n VAL 39 N -0.37 -8.07 -2.48 3.84 0.31 -1.26 -4.79 118.33 105.52 1j9i n VAL 39 Ca 0.00 2.80 -0.00 0.00 -0.01 0.00 0.00 64.34 67.12 1j9i n VAL 39 Cb 0.03 -3.96 0.00 0.00 -0.91 0.00 0.00 33.84 29.01 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 1.04 0.00 -3.64 7.52 7.99 -1.26 -4.42 117.00 124.23 1j9i n LEU 40 Ca 0.00 -0.02 -0.14 0.00 -0.01 0.00 0.00 56.01 55.84 1j9i n LEU 40 Cb 0.00 -0.01 -0.13 0.00 -0.11 0.00 0.00 43.42 43.17 1j9i n LEU 40 CO 0.00 -0.50 -0.15 -0.31 -1.51 0.00 0.00 177.39 174.92 1j9i s TYR 41 N 0.44 -0.40 -1.00 -1.77 2.02 0.87 -1.48 117.35 116.03 1j9i s TYR 41 Ca 0.01 0.87 -0.25 0.00 -0.37 0.00 0.00 57.07 57.33 1j9i s TYR 41 Cb -0.00 -0.08 -0.14 0.00 -0.40 0.00 0.00 41.96 41.34 1j9i s TYR 41 CO 0.00 -0.38 2.11 0.34 -1.57 0.00 0.00 175.55 176.06 1j9i s ASP 42 N 2.41 4.23 0.33 2.29 -1.08 -1.22 -1.08 116.67 122.55 1j9i s ASP 42 Ca 0.02 -0.83 0.27 0.00 -0.52 0.00 0.00 52.55 51.49 1j9i s ASP 42 Cb -0.12 -2.58 1.07 0.00 -1.46 0.00 0.00 42.92 39.82 1j9i s ASP 42 CO -0.09 -3.78 1.03 -0.24 0.52 0.00 0.00 175.17 172.61 1j9i n SER 43 N 17.15 0.07 -0.07 -0.34 2.88 0.62 0.24 113.62 134.17 1j9i n SER 43 Ca 0.43 0.78 -0.22 0.00 -1.33 0.00 0.00 58.87 58.54 1j9i n SER 43 Cb 0.46 -0.39 -0.12 0.00 -0.75 0.00 0.00 64.21 63.41 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 0.86 0.24 -1.46 0.00 -1.25 -3.33 120.51 112.99 1j9i n ALA 44 Ca 0.28 -0.57 0.10 0.00 0.00 0.00 0.00 53.44 53.25 1j9i n ALA 44 Cb 1.19 -0.55 0.59 0.00 0.00 0.00 0.00 19.45 20.68 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 -0.33 1.21 -0.14 0.00 0.00 -0.18 -1.49 119.26 118.35 1j9i h ALA 45 Ca -0.40 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.24 1j9i h ALA 45 Cb 1.58 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 1j9i h ALA 45 CO -0.12 0.24 -0.34 0.28 0.00 0.00 0.00 179.25 179.31 1j9i h VAL 46 N 0.00 1.28 0.00 0.00 2.07 0.30 -2.76 116.25 117.14 1j9i h VAL 46 Ca -0.00 -1.35 -0.06 0.00 0.82 0.00 0.00 66.70 66.11 1j9i h VAL 46 Cb 0.51 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 1j9i h VAL 46 CO 0.02 0.41 -0.34 0.16 0.02 0.00 0.00 177.57 177.84 1j9i h ILE 47 N 0.24 1.28 -1.46 4.57 3.07 -1.30 0.56 117.51 124.47 1j9i h ILE 47 Ca 0.03 -2.08 0.44 0.00 1.55 0.00 0.00 64.86 64.80 1j9i h ILE 47 Cb 0.72 2.54 -0.09 0.00 -0.27 0.00 0.00 36.82 39.71 1j9i h ILE 47 CO 0.05 0.43 1.01 0.50 -1.05 0.00 0.00 178.15 179.09 1j9i h LYS 48 N -1.00 0.07 0.00 0.16 3.64 -1.41 2.86 116.57 120.89 1j9i h LYS 48 Ca -0.09 -0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.08 1j9i h LYS 48 Cb 0.94 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.71 1j9i h LYS 48 CO -0.05 0.04 -1.49 2.35 -2.27 0.00 0.00 179.45 178.03 1j9i h TRP 49 N 0.07 0.00 0.00 1.91 7.01 -1.52 -3.20 115.95 120.21 1j9i h TRP 49 Ca 0.78 0.00 -0.22 0.00 2.11 0.00 0.00 58.89 61.56 1j9i h TRP 49 Cb 2.76 0.00 -0.04 0.00 -2.10 0.00 0.00 29.16 29.79 1j9i h TRP 49 CO -0.00 0.70 -1.44 -0.92 -2.79 0.00 0.00 178.44 173.99 1j9i h TYR 50 N 0.00 0.00 0.00 2.65 5.03 0.52 -3.32 116.97 121.85 1j9i h TYR 50 Ca -0.20 0.00 -0.10 0.00 2.58 0.00 0.00 58.73 61.01 1j9i h TYR 50 Cb 1.71 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 39.98 1j9i h TYR 50 CO 0.00 0.79 -0.49 0.00 -1.32 0.00 0.00 178.16 177.14 1j9i h ALA 51 N 1.21 0.76 -0.16 1.82 0.00 0.40 0.91 119.26 124.20 1j9i h ALA 51 Ca -0.19 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1j9i h ALA 51 Cb 1.77 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.48 1j9i h ALA 51 CO 0.07 0.61 0.00 0.39 0.00 0.00 0.00 179.25 180.32 1j9i n GLU 52 N -3.33 1.46 0.00 0.00 1.02 -1.21 -4.49 120.64 114.09 1j9i n GLU 52 Ca 0.01 -0.70 0.00 0.00 -0.02 0.00 0.00 57.16 56.45 1j9i n GLU 52 Cb 0.67 -1.24 0.00 0.00 -0.02 0.00 0.00 31.44 30.85 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 0.01 0.00 -0.27 3.49 1.85 -1.17 -4.94 116.66 115.62 1j9i n ARG 53 Ca 0.10 0.00 0.04 0.00 -1.00 0.00 0.00 57.85 56.99 1j9i n ARG 53 Cb 0.19 0.00 0.16 0.00 -1.05 0.00 0.00 32.46 31.76 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 -0.12 2.33 0.01 2.89 9.92 0.30 -4.06 116.55 127.82 1j9i n ASP 54 Ca 0.00 -2.19 0.04 0.00 -0.53 0.00 0.00 54.79 52.11 1j9i n ASP 54 Cb 0.00 -0.39 0.18 0.00 -0.64 0.00 0.00 41.12 40.28 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 0.35 1.35 -0.03 2.24 0.00 -0.56 -1.70 120.51 122.16 1j9i n ALA 55 Ca 0.11 -0.02 -0.09 0.00 0.00 0.00 0.00 53.44 53.44 1j9i n ALA 55 Cb 0.45 -1.14 -0.14 0.00 0.00 0.00 0.00 19.45 18.62 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 -1.54 0.64 -0.29 0.00 1.02 -1.26 -4.18 120.64 115.04 1j9i n GLU 56 Ca 0.02 0.27 0.10 0.00 -0.02 0.00 0.00 57.16 57.53 1j9i n GLU 56 Cb 0.09 -1.77 0.24 0.00 -0.02 0.00 0.00 31.44 29.98 1j9i n GLU 56 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1j9i h ILE 57 N 0.00 0.28 -0.37 -3.67 5.03 -1.63 1.30 117.51 118.45 1j9i h ILE 57 Ca -0.31 -0.05 0.11 0.00 -0.12 0.00 0.00 64.86 64.49 1j9i h ILE 57 Cb 2.03 0.13 -0.01 0.00 -3.03 0.00 0.00 36.82 35.94 1j9i h ILE 57 CO 0.08 0.02 0.79 -0.33 -0.68 0.00 0.00 178.15 178.03 1j9i h GLU 58 N 0.13 0.00 0.00 2.37 4.39 -1.73 1.96 114.58 121.71 1j9i h GLU 58 Ca 0.50 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.20 1j9i h GLU 58 Cb 0.97 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.62 1j9i h GLU 58 CO -0.70 0.00 0.00 -1.71 -1.16 0.00 0.00 179.01 175.44 1j9i n ASN 59 N -3.05 0.52 -0.35 1.42 2.85 0.45 -3.03 115.26 114.07 1j9i n ASN 59 Ca 0.08 0.63 0.16 0.00 -0.11 0.00 0.00 54.58 55.33 1j9i n ASN 59 Cb 0.92 -0.74 0.36 0.00 1.24 0.00 0.00 39.78 41.56 1j9i n ASN 59 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 1j9i h GLU 60 N 0.00 0.63 0.00 1.20 4.39 0.30 0.69 114.58 121.79 1j9i h GLU 60 Ca 0.00 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1j9i h GLU 60 Cb 0.33 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1j9i h GLU 60 CO 0.00 0.42 -0.60 1.63 -1.16 0.00 0.00 179.01 179.30 1j9i n LYS 61 N -4.84 0.12 -0.76 2.33 5.02 -1.17 -3.85 118.16 115.00 1j9i n LYS 61 Ca 0.26 0.02 -0.09 0.00 -2.02 0.00 0.00 58.31 56.48 1j9i n LYS 61 Cb 0.68 -1.56 0.18 0.00 -0.02 0.00 0.00 35.03 34.31 1j9i n LYS 61 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1j9i n LEU 62 N -1.72 5.11 -0.05 -0.35 7.94 0.24 -4.03 117.00 124.13 1j9i n LEU 62 Ca 0.04 -2.67 0.06 0.00 -1.11 0.00 0.00 56.01 52.33 1j9i n LEU 62 Cb 0.38 -0.70 0.08 0.00 0.53 0.00 0.00 43.42 43.71 1j9i n LEU 62 CO 0.36 0.75 0.53 -1.14 -1.11 0.00 0.00 177.39 176.78 1j9i n ARG 63 N -0.25 1.94 0.00 1.96 3.00 -1.02 -4.82 116.66 117.47 1j9i n ARG 63 Ca 0.33 -2.08 0.00 0.00 -0.00 0.00 0.00 57.85 56.11 1j9i n ARG 63 Cb 1.17 -1.26 0.00 0.00 0.00 0.00 0.00 32.46 32.36 1j9i n ARG 63 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 1j9i n ARG 64 N -1.01 0.00 -2.55 -0.14 0.63 -1.26 -4.86 116.66 107.48 1j9i n ARG 64 Ca 0.09 0.00 -0.18 0.00 -0.92 0.00 0.00 57.85 56.83 1j9i n ARG 64 Cb 0.48 0.00 0.02 0.00 0.45 0.00 0.00 32.46 33.40 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 0.00 2.43 0.00 -0.14 1.02 -1.26 -4.81 120.64 117.88 1j9i n GLU 65 Ca 0.00 -3.94 0.15 0.00 -0.02 0.00 0.00 57.16 53.35 1j9i n GLU 65 Cb 0.00 -1.81 0.69 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 n VAL 66 N -0.32 0.00 0.03 2.62 0.31 -1.26 -4.75 118.33 114.95 1j9i n VAL 66 Ca 0.26 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.56 1j9i n VAL 66 Cb 0.75 -0.33 0.00 0.00 -0.91 0.00 0.00 33.84 33.35 1j9i n VAL 66 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1j9i n GLU 67 N -1.16 0.00 0.00 5.55 2.13 -1.26 -5.18 120.64 120.72 1j9i n GLU 67 Ca 0.14 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.96 1j9i n GLU 67 Cb 0.26 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.97 1j9i n GLU 67 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87