#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 1.81 0.36 2.12 2.12 -1.26 0.57 118.70 124.42 1j9i s GLU 2 Ca 0.00 -2.18 0.03 0.00 0.36 0.00 0.00 54.97 53.18 1j9i s GLU 2 Cb 0.00 -3.34 -0.02 0.00 0.26 0.00 0.00 34.13 31.03 1j9i s GLU 2 CO 0.00 -1.03 0.53 0.14 -0.54 0.00 0.00 175.26 174.36 1j9i s VAL 3 N 0.44 4.55 0.29 3.70 -7.23 -0.43 -4.76 120.40 116.96 1j9i s VAL 3 Ca 0.13 -0.69 -0.00 0.00 -1.81 0.00 0.00 61.98 59.60 1j9i s VAL 3 Cb -0.22 -3.64 0.06 0.00 0.56 0.00 0.00 36.38 33.14 1j9i s VAL 3 CO -0.04 -0.35 0.40 0.59 -0.31 0.00 0.00 175.10 175.38 1j9i n ASN 4 N -1.78 0.51 -0.20 4.85 3.02 -1.26 -0.11 115.26 120.29 1j9i n ASN 4 Ca -0.03 -1.44 0.09 0.00 -0.03 0.00 0.00 54.58 53.18 1j9i n ASN 4 Cb 0.57 -0.26 0.38 0.00 -0.61 0.00 0.00 39.78 39.87 1j9i n ASN 4 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1j9i h LYS 5 N 0.00 0.67 0.16 3.52 1.63 -1.93 0.62 116.57 121.24 1j9i h LYS 5 Ca -0.13 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.62 1j9i h LYS 5 Cb 0.48 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 31.96 1j9i h LYS 5 CO 0.14 0.44 -0.08 0.87 -3.45 0.00 0.00 179.45 177.37 1j9i h LYS 6 N 0.69 -0.21 -0.99 1.90 1.79 -1.98 -2.05 116.57 115.72 1j9i h LYS 6 Ca 0.35 0.01 0.17 0.00 -2.18 0.00 0.00 60.65 59.00 1j9i h LYS 6 Cb 0.45 0.05 -0.09 0.00 -1.58 0.00 0.00 32.23 31.06 1j9i h LYS 6 CO -0.13 -0.14 0.62 1.96 -1.08 0.00 0.00 179.45 180.68 1j9i h GLN 7 N -1.04 0.78 0.20 3.15 1.08 -1.88 0.85 115.11 118.25 1j9i h GLN 7 Ca -0.02 -0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.12 1j9i h GLN 7 Cb 0.17 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1j9i h GLN 7 CO 0.04 0.51 -0.09 1.25 -0.95 0.00 0.00 178.83 179.59 1j9i h LEU 8 N 0.80 -0.22 -1.69 1.46 5.85 0.17 2.14 115.31 123.82 1j9i h LEU 8 Ca 0.53 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 59.07 1j9i h LEU 8 Cb 0.79 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.87 1j9i h LEU 8 CO -0.31 0.02 -0.18 0.00 -0.34 0.00 0.00 178.44 177.62 1j9i h ALA 9 N 0.30 1.51 0.02 1.25 0.00 -0.52 -1.73 119.26 120.09 1j9i h ALA 9 Ca -0.03 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1j9i h ALA 9 Cb 0.35 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1j9i h ALA 9 CO 0.04 0.23 -0.01 -0.44 0.00 0.00 0.00 179.25 179.08 1j9i h ASP 10 N 0.00 -0.02 -0.24 0.00 3.32 0.13 1.03 116.42 120.64 1j9i h ASP 10 Ca -0.00 -0.72 0.07 0.00 0.02 0.00 0.00 57.03 56.40 1j9i h ASP 10 Cb 0.37 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1j9i h ASP 10 CO 0.02 0.80 0.24 -0.29 -1.72 0.00 0.00 179.24 178.30 1j9i h ILE 11 N -0.94 0.52 -0.10 0.35 2.10 0.37 0.41 117.51 120.22 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 0.74 0.81 0.00 0.00 -1.09 0.00 0.00 36.82 37.28 1j9i h ILE 11 CO 0.00 0.00 0.00 0.49 -1.08 0.00 0.00 178.15 177.56 1j9i n PHE 12 N -3.89 0.10 -1.03 2.19 3.01 -0.66 -4.92 117.46 112.25 1j9i n PHE 12 Ca 0.03 -0.06 -0.01 0.00 1.01 0.00 0.00 57.45 58.42 1j9i n PHE 12 Cb 0.38 -0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.84 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 1.21 0.19 1.61 1.37 0.00 0.14 -4.95 105.19 104.77 1j9i n GLY 13 Ca 0.13 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 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 1.02 -0.60 -2.81 4.61 0.00 0.34 -4.93 120.51 118.14 1j9i n ALA 14 Ca -0.01 -0.73 -0.34 0.00 0.00 0.00 0.00 53.44 52.36 1j9i n ALA 14 Cb 0.42 -0.03 -0.11 0.00 0.00 0.00 0.00 19.45 19.73 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 -3.01 4.87 0.49 0.00 0.01 -1.26 -4.43 113.70 110.37 1j9i s SER 15 Ca 0.31 -0.04 0.28 0.00 1.31 0.00 0.00 55.95 57.81 1j9i s SER 15 Cb -0.01 -1.58 1.36 0.00 0.21 0.00 0.00 66.02 66.01 1j9i s SER 15 CO 0.22 0.26 1.84 0.40 0.41 0.00 0.00 173.24 176.36 1j9i h ILE 16 N 4.73 0.52 -0.02 1.44 2.04 -1.88 2.20 117.51 126.54 1j9i h ILE 16 Ca -0.39 -0.05 0.01 0.00 1.00 0.00 0.00 64.86 65.42 1j9i h ILE 16 Cb 1.19 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1j9i h ILE 16 CO 0.59 0.03 0.02 0.08 0.00 0.00 0.00 178.15 178.86 1j9i h ARG 17 N 0.14 0.00 -0.10 2.37 -0.00 -1.95 0.43 114.38 115.27 1j9i h ARG 17 Ca 0.51 0.00 -0.23 0.00 -0.00 0.00 0.00 59.98 60.26 1j9i h ARG 17 Cb 1.74 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 31.72 1j9i h ARG 17 CO -0.09 0.00 -0.84 1.15 -0.00 0.00 0.00 179.97 180.19 1j9i h THR 18 N 0.00 1.30 -0.30 0.08 2.02 0.32 -2.47 112.91 113.87 1j9i h THR 18 Ca 0.01 -2.09 -0.02 0.00 0.77 0.00 0.00 66.41 65.07 1j9i h THR 18 Cb 0.04 2.12 -0.02 0.00 -1.74 0.00 0.00 68.15 68.55 1j9i h THR 18 CO -0.00 0.65 0.09 0.40 0.37 0.00 0.00 175.52 177.03 1j9i h ILE 19 N 0.44 1.13 0.00 3.11 1.08 0.37 0.80 117.51 124.44 1j9i h ILE 19 Ca -0.07 -0.45 -0.02 0.00 -0.39 0.00 0.00 64.86 63.93 1j9i h ILE 19 Cb 1.46 0.82 -0.00 0.00 -3.07 0.00 0.00 36.82 36.03 1j9i h ILE 19 CO 0.16 0.17 -0.09 1.56 -0.69 0.00 0.00 178.15 179.26 1j9i h GLN 20 N 0.42 0.00 0.00 2.37 1.08 -0.05 -1.02 115.11 117.91 1j9i h GLN 20 Ca 0.10 0.00 -0.24 0.00 -1.45 0.00 0.00 58.65 57.06 1j9i h GLN 20 Cb 0.14 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.53 1j9i h GLN 20 CO -0.01 0.09 -1.60 -1.71 -0.95 0.00 0.00 178.83 174.65 1j9i n ASN 21 N -3.28 0.86 0.05 1.46 5.15 0.15 -4.04 115.26 115.61 1j9i n ASN 21 Ca -0.00 0.40 -0.13 0.00 -0.60 0.00 0.00 54.58 54.25 1j9i n ASN 21 Cb 0.31 0.03 -0.09 0.00 -0.53 0.00 0.00 39.78 39.50 1j9i n ASN 21 CO 0.00 0.00 0.00 -0.50 1.40 0.00 0.00 177.26 178.16 1j9i h TRP 22 N 0.00 -0.15 -0.58 1.20 4.06 0.11 -2.14 115.95 118.46 1j9i h TRP 22 Ca -0.24 -0.00 0.17 0.00 2.06 0.00 0.00 58.89 60.87 1j9i h TRP 22 Cb 1.85 0.05 -0.02 0.00 -1.00 0.00 0.00 29.16 30.04 1j9i h TRP 22 CO 0.00 0.24 0.73 0.37 -3.56 0.00 0.00 178.44 176.22 1j9i h GLN 23 N -0.57 0.00 -0.60 0.49 4.15 -1.38 2.19 115.11 119.40 1j9i h GLN 23 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1j9i h GLN 23 Cb 0.45 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.14 1j9i h GLN 23 CO 0.03 0.00 0.00 0.39 -1.93 0.00 0.00 178.83 177.32 1j9i n GLU 24 N -3.43 2.75 -0.17 1.69 -0.58 -0.97 -4.20 120.64 115.73 1j9i n GLU 24 Ca 0.12 -2.46 0.10 0.00 -0.42 0.00 0.00 57.16 54.50 1j9i n GLU 24 Cb 0.93 -1.48 0.19 0.00 -0.57 0.00 0.00 31.44 30.51 1j9i n GLU 24 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1j9i n GLN 25 N 1.30 2.30 -1.40 3.49 1.13 0.74 -4.94 117.38 120.01 1j9i n GLN 25 Ca 0.20 -2.10 0.00 0.00 -1.94 0.00 0.00 57.00 53.16 1j9i n GLN 25 Cb 0.56 -1.42 0.00 0.00 0.11 0.00 0.00 30.24 29.49 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 1.17 0.93 3.92 1.08 0.00 -1.20 -5.06 105.19 106.04 1j9i n GLY 26 Ca 0.16 -0.38 -0.27 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.76 3.55 -0.89 1.61 0.23 -1.24 -5.02 119.30 114.79 1j9i s MET 27 Ca 0.00 -0.21 -0.22 0.00 -1.03 0.00 0.00 55.69 54.23 1j9i s MET 27 Cb 0.00 -2.72 0.08 0.00 -1.53 0.00 0.00 34.83 30.66 1j9i s MET 27 CO 0.00 0.27 1.22 -1.25 -2.03 0.00 0.00 175.02 173.23 1j9i s PRO 28 N -3.66 3.45 -0.03 3.16 0.04 -1.26 -4.95 135.00 131.76 1j9i s PRO 28 Ca 0.41 -1.19 -0.16 0.00 0.04 0.00 0.00 61.00 60.10 1j9i s PRO 28 Cb -0.10 -4.85 -0.05 0.00 0.04 0.00 0.00 34.50 29.53 1j9i s PRO 28 CO 0.31 -1.97 0.43 0.54 0.04 0.00 0.00 177.00 176.35 1j9i s VAL 29 N 4.09 5.06 0.00 -0.36 0.11 -1.26 -3.43 120.40 124.60 1j9i s VAL 29 Ca 0.35 0.88 0.00 0.00 -2.93 0.00 0.00 61.98 60.28 1j9i s VAL 29 Cb -0.06 -3.74 0.00 0.00 -1.53 0.00 0.00 36.38 31.05 1j9i s VAL 29 CO -0.03 0.51 0.82 0.18 -3.33 0.00 0.00 175.10 173.25 1j9i n LEU 30 N 2.32 0.00 -4.93 2.54 7.99 0.02 -4.66 117.00 120.27 1j9i n LEU 30 Ca -0.12 0.82 -0.25 0.00 -0.01 0.00 0.00 56.01 56.45 1j9i n LEU 30 Cb 0.52 -0.32 0.05 0.00 -0.11 0.00 0.00 43.42 43.56 1j9i n LEU 30 CO 0.39 -0.32 0.55 -0.13 -1.51 0.00 0.00 177.39 176.37 1j9i s ARG 31 N -2.27 2.46 0.28 3.23 0.52 -1.26 -4.82 118.95 117.09 1j9i s ARG 31 Ca 0.00 -0.27 0.14 0.00 -0.52 0.00 0.00 55.73 55.07 1j9i s ARG 31 Cb 0.00 -2.25 0.29 0.00 0.52 0.00 0.00 34.95 33.51 1j9i s ARG 31 CO 0.00 -1.00 1.55 0.78 0.02 0.00 0.00 175.30 176.66 1j9i h GLY 32 N -0.37 0.00 -4.37 -3.53 0.00 -1.90 -3.35 103.07 89.55 1j9i h GLY 32 Ca -0.44 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.84 1j9i h GLY 32 CO 0.59 0.00 -0.07 0.61 0.00 0.00 0.00 176.54 177.67 1j9i n GLY 33 N 0.68 -0.39 3.17 4.60 0.00 -1.26 -4.66 105.19 107.33 1j9i n GLY 33 Ca 0.00 0.01 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.45 -3.42 2.41 -0.02 0.00 -1.26 -1.13 105.19 101.32 1j9i n GLY 34 Ca 0.01 -0.72 -0.18 0.00 0.00 0.00 0.00 46.02 45.12 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 0.67 -1.63 -3.40 1.61 4.76 -1.26 -2.83 118.16 116.08 1j9i n LYS 35 Ca 0.01 0.99 -0.17 0.00 -2.87 0.00 0.00 58.31 56.27 1j9i n LYS 35 Cb 0.57 -5.48 0.01 0.00 -1.84 0.00 0.00 35.03 28.29 1j9i n LYS 35 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1j9i n GLY 36 N -0.66 -1.08 0.00 0.72 0.00 -0.33 -4.97 105.19 98.87 1j9i n GLY 36 Ca -0.20 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.54 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 -1.73 0.00 -0.48 1.61 4.05 -0.29 -4.95 115.26 113.46 1j9i n ASN 37 Ca -0.13 0.00 0.07 0.00 0.45 0.00 0.00 54.58 54.97 1j9i n ASN 37 Cb 0.60 0.00 0.19 0.00 1.23 0.00 0.00 39.78 41.80 1j9i n ASN 37 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 177.26 172.37 1j9i n GLU 38 N 0.00 1.76 -1.47 1.20 0.28 -1.26 -5.01 120.64 116.14 1j9i n GLU 38 Ca 0.00 -2.85 -0.60 0.00 -0.16 0.00 0.00 57.16 53.55 1j9i n GLU 38 Cb 0.00 -1.64 -0.10 0.00 1.43 0.00 0.00 31.44 31.13 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 -1.14 0.08 -2.00 3.84 0.31 -1.26 -4.65 118.33 113.51 1j9i n VAL 39 Ca 0.20 -0.05 -0.06 0.00 -0.01 0.00 0.00 64.34 64.42 1j9i n VAL 39 Cb 0.75 -0.81 0.03 0.00 -0.91 0.00 0.00 33.84 32.90 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 6.80 0.00 -3.72 7.52 7.99 -1.26 -4.45 117.00 129.88 1j9i n LEU 40 Ca 0.43 -0.43 -0.14 0.00 -0.01 0.00 0.00 56.01 55.85 1j9i n LEU 40 Cb 0.03 -0.17 -0.14 0.00 -0.11 0.00 0.00 43.42 43.02 1j9i n LEU 40 CO 0.85 -0.64 -0.21 -0.31 -1.51 0.00 0.00 177.39 175.57 1j9i s TYR 41 N -0.85 -0.21 -0.88 -1.77 2.02 0.84 -0.80 117.35 115.70 1j9i s TYR 41 Ca 0.16 0.59 -0.25 0.00 -0.37 0.00 0.00 57.07 57.20 1j9i s TYR 41 Cb -0.01 -0.10 -0.11 0.00 -0.40 0.00 0.00 41.96 41.34 1j9i s TYR 41 CO 0.11 -0.22 2.19 -0.51 -1.57 0.00 0.00 175.55 175.55 1j9i s ASP 42 N 1.55 4.38 0.29 2.29 1.11 -1.22 -1.31 116.67 123.75 1j9i s ASP 42 Ca -0.06 -0.41 0.22 0.00 0.18 0.00 0.00 52.55 52.49 1j9i s ASP 42 Cb -0.12 -2.56 0.99 0.00 1.07 0.00 0.00 42.92 42.31 1j9i s ASP 42 CO -0.06 -3.49 1.03 -0.24 1.18 0.00 0.00 175.17 173.58 1j9i n SER 43 N 16.79 0.14 -0.09 0.27 2.88 0.19 0.27 113.62 134.07 1j9i n SER 43 Ca 0.44 0.91 -0.23 0.00 -1.33 0.00 0.00 58.87 58.66 1j9i n SER 43 Cb 0.45 -0.45 -0.12 0.00 -0.75 0.00 0.00 64.21 63.34 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 -2.55 0.92 0.27 -1.46 0.00 -1.26 -3.36 120.51 113.07 1j9i n ALA 44 Ca 0.27 -0.66 0.12 0.00 0.00 0.00 0.00 53.44 53.17 1j9i n ALA 44 Cb 1.05 -0.43 0.74 0.00 0.00 0.00 0.00 19.45 20.81 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 -0.45 1.38 0.00 0.00 0.00 -0.87 0.51 119.26 119.83 1j9i h ALA 45 Ca -0.45 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.29 1j9i h ALA 45 Cb 1.55 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.31 1j9i h ALA 45 CO -0.19 0.13 -0.39 0.28 0.00 0.00 0.00 179.25 179.08 1j9i h VAL 46 N 0.00 0.94 0.00 0.00 2.07 0.36 -3.07 116.25 116.55 1j9i h VAL 46 Ca -0.00 -1.53 -0.15 0.00 0.82 0.00 0.00 66.70 65.84 1j9i h VAL 46 Cb 0.26 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 1j9i h VAL 46 CO 0.01 0.38 -0.91 0.16 0.02 0.00 0.00 177.57 177.23 1j9i h ILE 47 N 0.00 0.76 -1.27 4.57 3.07 -0.93 -1.23 117.51 122.48 1j9i h ILE 47 Ca -0.00 -1.89 0.37 0.00 1.55 0.00 0.00 64.86 64.89 1j9i h ILE 47 Cb 0.89 1.76 -0.09 0.00 -0.27 0.00 0.00 36.82 39.10 1j9i h ILE 47 CO 0.05 0.26 0.86 0.50 -1.05 0.00 0.00 178.15 178.77 1j9i h LYS 48 N -1.00 0.14 0.00 0.16 3.64 -1.48 2.21 116.57 120.24 1j9i h LYS 48 Ca -0.22 -0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 58.97 1j9i h LYS 48 Cb 1.04 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.80 1j9i h LYS 48 CO -0.13 0.09 -1.20 2.35 -2.27 0.00 0.00 179.45 178.28 1j9i h TRP 49 N 0.14 0.00 0.16 1.91 7.01 -1.65 -3.05 115.95 120.47 1j9i h TRP 49 Ca 0.69 0.00 -0.23 0.00 2.11 0.00 0.00 58.89 61.46 1j9i h TRP 49 Cb 2.31 0.00 0.03 0.00 -2.10 0.00 0.00 29.16 29.39 1j9i h TRP 49 CO -0.00 0.68 -1.00 -0.92 -2.79 0.00 0.00 178.44 174.41 1j9i h TYR 50 N 0.00 0.70 0.00 2.65 5.03 0.41 -3.00 116.97 122.75 1j9i h TYR 50 Ca -0.13 -0.49 0.00 0.00 2.58 0.00 0.00 58.73 60.69 1j9i h TYR 50 Cb 1.63 -0.03 0.00 0.00 1.55 0.00 0.00 36.73 39.88 1j9i h TYR 50 CO 0.00 1.37 0.00 0.00 -1.32 0.00 0.00 178.16 178.21 1j9i h ALA 51 N 0.13 1.00 -0.01 1.82 0.00 0.22 2.36 119.26 124.78 1j9i h ALA 51 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1j9i h ALA 51 Cb 1.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.56 1j9i h ALA 51 CO 0.19 0.00 -0.09 -1.91 0.00 0.00 0.00 179.25 177.44 1j9i n GLU 52 N -2.98 1.20 0.00 0.00 4.07 -1.14 -4.67 120.64 117.12 1j9i n GLU 52 Ca -0.01 -0.62 0.00 0.00 -0.06 0.00 0.00 57.16 56.47 1j9i n GLU 52 Cb 0.16 -1.49 0.00 0.00 -0.06 0.00 0.00 31.44 30.05 1j9i n GLU 52 CO 0.00 0.00 0.00 2.89 -0.06 0.00 0.00 177.13 179.96 1j9i n ARG 53 N -0.36 0.00 -0.32 5.31 1.85 -0.20 -4.93 116.66 118.01 1j9i n ARG 53 Ca 0.17 0.00 0.18 0.00 -1.00 0.00 0.00 57.85 57.20 1j9i n ARG 53 Cb 0.32 0.00 0.38 0.00 -1.05 0.00 0.00 32.46 32.11 1j9i n ARG 53 CO 0.00 0.00 0.00 0.38 -0.01 0.00 0.00 177.63 178.00 1j9i h ASP 54 N 0.00 0.31 -0.59 2.89 3.04 0.37 1.06 116.42 123.51 1j9i h ASP 54 Ca 0.00 0.19 0.17 0.00 -3.24 0.00 0.00 57.03 54.15 1j9i h ASP 54 Cb 0.00 0.18 -0.02 0.00 -1.04 0.00 0.00 39.33 38.45 1j9i h ASP 54 CO 0.00 -0.12 1.05 0.00 -2.04 0.00 0.00 179.24 178.13 1j9i h ALA 55 N 1.81 2.51 0.00 4.15 0.00 -1.81 3.21 119.26 129.12 1j9i h ALA 55 Ca 0.64 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.51 1j9i h ALA 55 Cb 1.37 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 1j9i h ALA 55 CO -0.61 -1.35 -0.13 0.93 0.00 0.00 0.00 179.25 178.09 1j9i h GLU 56 N 0.00 0.00 -0.90 0.00 5.08 0.86 -3.18 114.58 116.43 1j9i h GLU 56 Ca 0.28 0.00 0.19 0.00 -1.00 0.00 0.00 59.36 58.83 1j9i h GLU 56 Cb 2.38 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 31.45 1j9i h GLU 56 CO -0.00 0.13 -0.19 1.51 -1.00 0.00 0.00 179.01 179.45 1j9i n ILE 57 N -3.36 -0.38 0.12 3.13 3.06 1.07 0.32 119.36 123.32 1j9i n ILE 57 Ca -0.00 2.06 0.00 0.00 -2.50 0.00 0.00 62.75 62.31 1j9i n ILE 57 Cb 0.33 -2.87 0.30 0.00 0.54 0.00 0.00 39.64 37.94 1j9i n ILE 57 CO 0.00 0.00 0.00 1.05 -2.50 0.00 0.00 176.55 175.10 1j9i h GLU 58 N 0.00 0.18 0.00 9.51 4.11 -1.75 -2.11 114.58 124.53 1j9i h GLU 58 Ca 0.45 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 59.81 1j9i h GLU 58 Cb 0.72 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.96 1j9i h GLU 58 CO -0.92 0.50 -0.57 -0.97 0.07 0.00 0.00 179.01 177.12 1j9i h ASN 59 N 0.16 0.00 0.24 3.06 -1.24 0.49 -3.31 115.58 114.98 1j9i h ASN 59 Ca 0.02 -0.17 -0.06 0.00 0.71 0.00 0.00 56.30 56.80 1j9i h ASN 59 Cb 0.66 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.70 1j9i h ASN 59 CO 0.05 0.09 -0.25 -0.08 -1.29 0.00 0.00 177.43 175.94 1j9i h GLU 60 N 0.00 0.04 -0.27 6.67 4.81 0.54 -1.56 114.58 124.81 1j9i h GLU 60 Ca 0.00 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.30 1j9i h GLU 60 Cb 0.77 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1j9i h GLU 60 CO 0.00 0.29 0.48 1.57 -0.73 0.00 0.00 179.01 180.62 1j9i h LYS 61 N 0.03 0.00 0.07 1.92 2.10 -1.64 0.45 116.57 119.50 1j9i h LYS 61 Ca 0.00 0.00 -0.36 0.00 -2.00 0.00 0.00 60.65 58.29 1j9i h LYS 61 Cb 0.47 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.77 1j9i h LYS 61 CO 0.03 0.00 -2.04 1.28 -2.00 0.00 0.00 179.45 176.72 1j9i n LEU 62 N -3.30 2.58 -1.92 7.07 4.77 -0.60 -5.08 117.00 120.52 1j9i n LEU 62 Ca 0.04 0.17 -0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1j9i n LEU 62 Cb 0.61 -1.04 -0.00 0.00 -2.33 0.00 0.00 43.42 40.66 1j9i n LEU 62 CO 0.20 0.79 -0.34 0.54 -1.33 0.00 0.00 177.39 177.25 1j9i n ARG 63 N -3.60 -3.40 0.00 3.23 3.00 0.14 -5.04 116.66 111.00 1j9i n ARG 63 Ca -0.36 2.64 0.00 0.00 -0.01 0.00 0.00 57.85 60.12 1j9i n ARG 63 Cb 0.98 -3.33 0.00 0.00 0.00 0.00 0.00 32.46 30.10 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 1.20 0.00 -2.20 5.56 3.00 -1.26 -4.85 116.66 118.11 1j9i n ARG 64 Ca -0.03 0.00 -0.38 0.00 -0.00 0.00 0.00 57.85 57.44 1j9i n ARG 64 Cb 0.05 -0.42 0.03 0.00 0.00 0.00 0.00 32.46 32.11 1j9i n ARG 64 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1j9i n GLU 65 N -2.66 3.42 0.26 -0.14 1.02 -1.26 -4.76 120.64 116.52 1j9i n GLU 65 Ca 0.00 -3.96 -0.16 0.00 -0.02 0.00 0.00 57.16 53.02 1j9i n GLU 65 Cb 0.31 -2.31 -0.08 0.00 -0.02 0.00 0.00 31.44 29.34 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 2.18 0.54 -0.71 2.62 2.07 -2.00 -1.93 116.25 119.01 1j9i h VAL 66 Ca 0.50 -0.11 0.21 0.00 0.82 0.00 0.00 66.70 68.12 1j9i h VAL 66 Cb 0.24 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 1j9i h VAL 66 CO 1.27 0.02 0.85 -0.08 0.02 0.00 0.00 177.57 179.65 1j9i h GLU 67 N -0.69 0.00 0.00 1.57 4.57 -2.02 -3.55 114.58 114.46 1j9i h GLU 67 Ca -0.06 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1j9i h GLU 67 Cb 0.51 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.10 1j9i h GLU 67 CO 0.11 0.00 0.00 -1.91 -1.18 0.00 0.00 179.01 176.03