#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dj0 n SER 2 N 0.00 1.08 -4.29 1.61 2.88 -1.26 -5.08 113.62 108.56 2dj0 n SER 2 Ca 0.00 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.16 2dj0 n SER 2 Cb 0.00 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 63.49 2dj0 n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dj0 n SER 3 N -2.55 -3.06 -3.19 -3.46 2.88 -1.26 -3.72 113.62 99.27 2dj0 n SER 3 Ca 0.00 0.59 -0.14 0.00 -1.33 0.00 0.00 58.87 57.99 2dj0 n SER 3 Cb 0.33 -0.97 0.01 0.00 -0.75 0.00 0.00 64.21 62.83 2dj0 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dj0 n GLY 4 N 2.35 0.07 3.47 0.46 0.00 -1.26 -4.87 105.19 105.41 2dj0 n GLY 4 Ca 0.08 0.40 -0.43 0.00 0.00 0.00 0.00 46.02 46.07 2dj0 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dj0 s SER 5 N -1.11 6.19 -0.09 1.61 0.01 -1.24 -5.05 113.70 114.02 2dj0 s SER 5 Ca 0.13 -0.74 0.02 0.00 1.31 0.00 0.00 55.95 56.68 2dj0 s SER 5 Cb -0.01 -2.23 0.01 0.00 0.21 0.00 0.00 66.02 64.00 2dj0 s SER 5 CO 0.30 -0.61 -0.16 -0.44 0.41 0.00 0.00 173.24 172.75 2dj0 s SER 6 N 1.93 2.29 -0.21 2.44 0.01 -1.26 -4.92 113.70 113.98 2dj0 s SER 6 Ca 0.12 -0.40 -0.19 0.00 1.31 0.00 0.00 55.95 56.79 2dj0 s SER 6 Cb -0.18 -1.04 0.03 0.00 0.21 0.00 0.00 66.02 65.04 2dj0 s SER 6 CO 0.13 0.05 0.32 0.61 0.41 0.00 0.00 173.24 174.76 2dj0 n GLY 7 N 3.89 0.10 3.06 3.44 0.00 -1.26 -4.95 105.19 109.46 2dj0 n GLY 7 Ca -0.21 0.56 -0.29 0.00 0.00 0.00 0.00 46.02 46.08 2dj0 n GLY 7 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dj0 s TYR 8 N -0.93 2.03 -0.05 1.61 1.13 -1.26 -5.10 117.35 114.78 2dj0 s TYR 8 Ca 0.19 -0.99 0.04 0.00 -1.41 0.00 0.00 57.07 54.90 2dj0 s TYR 8 Cb -0.02 -1.47 -0.02 0.00 -1.10 0.00 0.00 41.96 39.35 2dj0 s TYR 8 CO 0.42 -0.51 -0.16 0.42 -2.51 0.00 0.00 175.55 173.20 2dj0 s ILE 9 N 1.05 2.86 -0.68 -3.49 1.01 -1.26 -4.82 121.20 115.87 2dj0 s ILE 9 Ca -0.05 -0.79 -0.27 0.00 0.00 0.00 0.00 60.65 59.54 2dj0 s ILE 9 Cb -0.15 -2.11 0.03 0.00 0.01 0.00 0.00 42.46 40.25 2dj0 s ILE 9 CO -0.03 0.58 1.21 -0.75 0.00 0.00 0.00 174.94 175.95 2dj0 s LYS 10 N -0.57 3.27 0.98 2.79 2.47 -0.86 -4.93 119.74 122.89 2dj0 s LYS 10 Ca 0.08 -0.18 -0.12 0.00 -1.56 0.00 0.00 55.97 54.20 2dj0 s LYS 10 Cb -0.11 -4.14 0.18 0.00 -1.46 0.00 0.00 37.83 32.30 2dj0 s LYS 10 CO 0.01 -1.97 1.08 0.71 0.16 0.00 0.00 175.35 175.35 2dj0 s TYR 11 N 5.29 2.03 -0.00 4.03 2.02 -1.26 -3.35 117.35 126.11 2dj0 s TYR 11 Ca 0.36 1.19 -0.17 0.00 -0.37 0.00 0.00 57.07 58.08 2dj0 s TYR 11 Cb -0.09 -3.19 0.03 0.00 -0.40 0.00 0.00 41.96 38.31 2dj0 s TYR 11 CO 0.17 -2.85 0.36 -0.06 -1.57 0.00 0.00 175.55 171.61 2dj0 s PHE 12 N -2.85 -0.23 0.61 2.71 0.08 -1.25 -4.87 117.98 112.19 2dj0 s PHE 12 Ca 0.65 0.31 0.05 0.00 0.12 0.00 0.00 56.93 58.05 2dj0 s PHE 12 Cb -0.20 0.14 0.11 0.00 -0.57 0.00 0.00 43.02 42.51 2dj0 s PHE 12 CO 0.59 -0.45 0.85 0.09 -0.10 0.00 0.00 175.22 176.19 2dj0 n ASN 13 N 1.05 1.66 0.23 1.36 3.02 -1.26 -4.78 115.26 116.54 2dj0 n ASN 13 Ca -0.21 -2.28 0.11 0.00 -0.03 0.00 0.00 54.58 52.18 2dj0 n ASN 13 Cb 0.57 -0.50 0.46 0.00 -0.61 0.00 0.00 39.78 39.70 2dj0 n ASN 13 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 2dj0 h ASP 14 N -0.21 0.00 0.00 6.41 3.04 -2.00 -2.80 116.42 120.85 2dj0 h ASP 14 Ca -0.28 0.00 -0.04 0.00 -3.24 0.00 0.00 57.03 53.47 2dj0 h ASP 14 Cb 1.17 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.45 2dj0 h ASP 14 CO 0.35 0.17 -1.00 1.17 -2.04 0.00 0.00 179.24 177.90 2dj0 n LYS 15 N -3.29 0.45 -0.30 4.15 3.00 -1.26 -4.59 118.16 116.32 2dj0 n LYS 15 Ca 0.01 0.18 0.14 0.00 -0.00 0.00 0.00 58.31 58.64 2dj0 n LYS 15 Cb 0.43 -1.29 0.32 0.00 0.00 0.00 0.00 35.03 34.49 2dj0 n LYS 15 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.40 179.19 2dj0 h THR 16 N -0.85 0.39 -1.22 3.15 1.35 -1.97 0.25 112.91 114.01 2dj0 h THR 16 Ca -0.06 -0.11 0.35 0.00 -0.55 0.00 0.00 66.41 66.05 2dj0 h THR 16 Cb 0.92 0.05 -0.05 0.00 -1.73 0.00 0.00 68.15 67.34 2dj0 h THR 16 CO -0.04 0.06 1.25 -0.29 -0.25 0.00 0.00 175.52 176.25 2dj0 h ILE 17 N 0.31 0.01 0.00 6.82 2.10 -1.74 0.15 117.51 125.16 2dj0 h ILE 17 Ca 0.58 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.52 2dj0 h ILE 17 Cb 1.15 0.02 0.00 0.00 -1.09 0.00 0.00 36.82 36.90 2dj0 h ILE 17 CO -0.59 0.00 -0.04 -0.78 -1.08 0.00 0.00 178.15 175.66 2dj0 h ASP 18 N 0.00 0.00 -0.98 2.19 1.82 -0.78 -3.12 116.42 115.54 2dj0 h ASP 18 Ca 0.58 0.00 0.35 0.00 -0.39 0.00 0.00 57.03 57.56 2dj0 h ASP 18 Cb 3.07 0.00 -0.18 0.00 0.68 0.00 0.00 39.33 42.90 2dj0 h ASP 18 CO -0.01 0.08 0.29 -1.84 -1.61 0.00 0.00 179.24 176.15 2dj0 n GLU 19 N -2.46 -0.07 0.21 0.28 0.28 -0.59 0.10 120.64 118.39 2dj0 n GLU 19 Ca -0.01 1.41 -0.08 0.00 -0.16 0.00 0.00 57.16 58.32 2dj0 n GLU 19 Cb 0.02 -2.39 -0.04 0.00 1.43 0.00 0.00 31.44 30.46 2dj0 n GLU 19 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 2dj0 h GLU 20 N 0.00 -0.52 -0.05 3.44 4.57 -1.20 -1.51 114.58 119.31 2dj0 h GLU 20 Ca 0.72 0.04 0.01 0.00 -1.18 0.00 0.00 59.36 58.95 2dj0 h GLU 20 Cb 1.75 0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 30.45 2dj0 h GLU 20 CO -0.84 -0.35 0.40 -0.07 -1.18 0.00 0.00 179.01 176.97 2dj0 h LEU 21 N -0.69 0.00 0.07 1.64 3.38 -1.06 0.25 115.31 118.90 2dj0 h LEU 21 Ca -0.06 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2dj0 h LEU 21 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 2dj0 h LEU 21 CO 0.09 0.00 -0.03 -0.33 0.09 0.00 0.00 178.44 178.26 2dj0 h GLU 22 N 0.00 -0.09 -0.83 1.13 4.39 -0.15 -1.01 114.58 118.02 2dj0 h GLU 22 Ca 0.02 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 2dj0 h GLU 22 Cb 0.81 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.45 2dj0 h GLU 22 CO -0.00 -0.06 0.49 0.07 -1.16 0.00 0.00 179.01 178.34 2dj0 h ARG 23 N -0.62 1.14 -0.81 2.33 0.11 -0.69 -1.95 114.38 113.89 2dj0 h ARG 23 Ca -0.01 -0.11 -0.24 0.00 0.10 0.00 0.00 59.98 59.72 2dj0 h ARG 23 Cb 0.07 -0.23 -0.14 0.00 1.11 0.00 0.00 29.97 30.78 2dj0 h ARG 23 CO 0.02 0.82 0.30 -0.25 0.10 0.00 0.00 179.97 180.95 2dj0 n ASP 24 N -4.42 4.47 -0.14 0.08 8.00 0.82 -4.54 116.55 120.81 2dj0 n ASP 24 Ca 0.08 -3.14 -0.04 0.00 0.71 0.00 0.00 54.79 52.40 2dj0 n ASP 24 Cb 0.07 -0.74 0.05 0.00 -0.02 0.00 0.00 41.12 40.48 2dj0 n ASP 24 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 2dj0 h LYS 25 N 2.23 0.29 -0.31 -1.24 2.10 -0.35 -0.07 116.57 119.22 2dj0 h LYS 25 Ca 0.29 -0.02 0.09 0.00 -2.00 0.00 0.00 60.65 59.01 2dj0 h LYS 25 Cb 2.27 -0.07 -0.01 0.00 -0.90 0.00 0.00 32.23 33.52 2dj0 h LYS 25 CO 0.72 0.19 0.71 0.07 -2.00 0.00 0.00 179.45 179.15 2dj0 h ARG 26 N 0.30 0.00 -6.00 0.07 -0.00 -1.82 -3.06 114.38 103.88 2dj0 h ARG 26 Ca 0.22 0.00 -0.61 0.00 -0.00 0.00 0.00 59.98 59.59 2dj0 h ARG 26 Cb 0.23 0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 30.15 2dj0 h ARG 26 CO -0.24 0.00 -0.20 0.08 -0.00 0.00 0.00 179.97 179.61 2dj0 s VAL 27 N -4.26 5.03 -0.83 0.08 1.01 -0.04 -4.80 120.40 116.59 2dj0 s VAL 27 Ca -0.03 0.84 -0.26 0.00 0.00 0.00 0.00 61.98 62.54 2dj0 s VAL 27 Cb 0.09 -3.71 0.03 0.00 0.00 0.00 0.00 36.38 32.79 2dj0 s VAL 27 CO 0.31 0.57 1.41 -0.89 0.00 0.00 0.00 175.10 176.49 2dj0 s THR 28 N -1.02 3.74 -0.14 3.92 2.01 -1.26 -4.70 115.64 118.20 2dj0 s THR 28 Ca 0.24 -0.01 -0.15 0.00 0.31 0.00 0.00 61.69 62.08 2dj0 s THR 28 Cb -0.17 -4.85 -0.05 0.00 0.01 0.00 0.00 72.50 67.45 2dj0 s THR 28 CO 0.13 -1.78 0.35 0.26 -0.69 0.00 0.00 174.62 172.89 2dj0 s TRP 29 N 5.93 3.49 -0.31 4.92 0.52 -1.04 -4.12 118.94 128.32 2dj0 s TRP 29 Ca 0.42 0.69 0.00 0.00 0.02 0.00 0.00 56.10 57.24 2dj0 s TRP 29 Cb -0.06 -2.39 0.07 0.00 -1.15 0.00 0.00 33.47 29.94 2dj0 s TRP 29 CO 0.07 0.25 0.01 -1.50 0.02 0.00 0.00 176.95 175.79 2dj0 s ILE 30 N 0.41 2.68 -0.01 2.03 2.07 -1.22 -1.88 121.20 125.29 2dj0 s ILE 30 Ca 0.19 -1.74 -0.05 0.00 -1.41 0.00 0.00 60.65 57.64 2dj0 s ILE 30 Cb -0.14 -2.68 -0.04 0.00 0.13 0.00 0.00 42.46 39.73 2dj0 s ILE 30 CO 0.06 -0.27 0.23 -0.69 -1.91 0.00 0.00 174.94 172.36 2dj0 s VAL 31 N 1.13 5.36 -0.34 4.00 1.01 -1.17 -0.74 120.40 129.65 2dj0 s VAL 31 Ca -0.01 0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.05 2dj0 s VAL 31 Cb -0.20 -3.54 0.09 0.00 0.00 0.00 0.00 36.38 32.72 2dj0 s VAL 31 CO -0.04 0.38 0.05 -0.70 0.00 0.00 0.00 175.10 174.79 2dj0 s GLU 32 N -1.75 1.90 0.07 2.72 2.12 -0.77 -2.66 118.70 120.33 2dj0 s GLU 32 Ca 0.26 -1.67 -0.30 0.00 0.36 0.00 0.00 54.97 53.62 2dj0 s GLU 32 Cb -0.13 -3.25 -0.05 0.00 0.26 0.00 0.00 34.13 30.96 2dj0 s GLU 32 CO 0.16 -0.86 1.06 -0.06 -0.54 0.00 0.00 175.26 175.02 2dj0 s PHE 33 N 1.06 3.62 0.28 5.30 0.40 0.90 -2.99 117.98 126.55 2dj0 s PHE 33 Ca 0.04 1.59 -0.02 0.00 -0.60 0.00 0.00 56.93 57.94 2dj0 s PHE 33 Cb -0.20 -3.22 -0.02 0.00 0.51 0.00 0.00 43.02 40.09 2dj0 s PHE 33 CO -0.05 -0.42 0.35 -0.59 0.70 0.00 0.00 175.22 175.20 2dj0 s PHE 34 N 0.63 1.08 0.10 0.36 -0.71 -0.99 -0.05 117.98 118.41 2dj0 s PHE 34 Ca 0.52 -1.28 0.07 0.00 -1.04 0.00 0.00 56.93 55.20 2dj0 s PHE 34 Cb -0.25 -0.27 -0.03 0.00 -1.21 0.00 0.00 43.02 41.25 2dj0 s PHE 34 CO 0.30 -0.93 -0.17 0.00 -1.34 0.00 0.00 175.22 173.08 2dj0 s ALA 35 N -3.60 1.52 0.26 1.99 0.00 -1.26 -0.03 121.76 120.64 2dj0 s ALA 35 Ca 0.33 -1.19 0.03 0.00 0.00 0.00 0.00 51.96 51.13 2dj0 s ALA 35 Cb 0.02 -0.14 0.35 0.00 0.00 0.00 0.00 23.12 23.34 2dj0 s ALA 35 CO 0.17 0.22 1.65 -0.97 0.00 0.00 0.00 175.76 176.83 2dj0 h ASN 36 N 3.94 0.39 -0.34 0.00 -1.24 -1.96 -2.62 115.58 113.75 2dj0 h ASN 36 Ca -0.42 -0.17 0.00 0.00 0.71 0.00 0.00 56.30 56.42 2dj0 h ASN 36 Cb 1.19 -0.11 0.00 0.00 0.73 0.00 0.00 38.32 40.13 2dj0 h ASN 36 CO 0.44 0.77 0.00 -2.67 -1.29 0.00 0.00 177.43 174.67 2dj0 n TRP 37 N -4.02 1.15 -3.57 0.67 4.27 -1.26 -4.72 117.44 109.96 2dj0 n TRP 37 Ca -0.02 -0.41 -0.40 0.00 -3.89 0.00 0.00 57.50 52.78 2dj0 n TRP 37 Cb 0.50 -0.31 -0.07 0.00 -1.36 0.00 0.00 31.31 30.07 2dj0 n TRP 37 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 2dj0 s SER 38 N -0.51 5.78 0.19 -0.67 0.15 -0.99 -4.93 113.70 112.73 2dj0 s SER 38 Ca 0.31 -2.60 -0.12 0.00 0.70 0.00 0.00 55.95 54.25 2dj0 s SER 38 Cb 0.23 -1.99 0.14 0.00 -1.71 0.00 0.00 66.02 62.69 2dj0 s SER 38 CO 0.10 -0.50 1.84 0.78 1.20 0.00 0.00 173.24 176.66 2dj0 h ASN 39 N 7.56 0.65 -1.26 5.45 2.35 -1.86 -2.22 115.58 126.25 2dj0 h ASN 39 Ca -0.02 -0.00 0.44 0.00 -0.55 0.00 0.00 56.30 56.16 2dj0 h ASN 39 Cb 1.00 -0.14 -0.14 0.00 0.05 0.00 0.00 38.32 39.09 2dj0 h ASN 39 CO 0.76 0.46 0.78 0.44 -1.65 0.00 0.00 177.43 178.21 2dj0 h ASP 40 N 0.78 0.26 -0.79 5.81 3.32 -1.92 1.01 116.42 124.89 2dj0 h ASP 40 Ca 0.24 0.17 0.06 0.00 0.02 0.00 0.00 57.03 57.53 2dj0 h ASP 40 Cb -0.01 0.17 -0.06 0.00 0.22 0.00 0.00 39.33 39.65 2dj0 h ASP 40 CO -0.09 -0.26 0.47 0.00 -1.72 0.00 0.00 179.24 177.64 2dj0 h GLN 42 N 0.85 0.06 -0.08 0.00 3.07 0.94 0.35 115.11 120.30 2dj0 h GLN 42 Ca 0.35 -0.00 -0.02 0.00 0.09 0.00 0.00 58.65 59.07 2dj0 h GLN 42 Cb 0.20 -0.01 -0.00 0.00 0.08 0.00 0.00 27.48 27.74 2dj0 h GLN 42 CO -0.18 0.04 -0.02 0.77 0.09 0.00 0.00 178.83 179.53 2dj0 h SER 43 N 0.06 0.16 -0.41 0.06 0.02 -1.29 -2.95 113.55 109.20 2dj0 h SER 43 Ca 0.64 -0.36 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 2dj0 h SER 43 Cb 2.38 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 64.88 2dj0 h SER 43 CO -0.08 0.49 0.00 0.33 -1.14 0.00 0.00 176.83 176.43 2dj0 n PHE 44 N -4.80 0.96 0.32 3.45 7.35 0.77 -4.37 117.46 121.14 2dj0 n PHE 44 Ca -0.07 -0.38 -0.14 0.00 -0.76 0.00 0.00 57.45 56.10 2dj0 n PHE 44 Cb 0.23 -0.18 -0.07 0.00 0.35 0.00 0.00 39.48 39.81 2dj0 n PHE 44 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2dj0 h ALA 45 N 3.54 -0.85 -0.20 3.13 0.00 -0.30 -2.80 119.26 121.78 2dj0 h ALA 45 Ca 0.00 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.63 2dj0 h ALA 45 Cb 1.02 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 2dj0 h ALA 45 CO 0.15 -0.82 -0.20 -1.00 0.00 0.00 0.00 179.25 177.39 2dj0 h PRO 46 N -1.16 0.49 -0.60 0.00 0.13 -1.76 -3.19 132.00 125.91 2dj0 h PRO 46 Ca -0.09 -0.26 0.12 0.00 -0.87 0.00 0.00 66.00 64.91 2dj0 h PRO 46 Cb 0.68 0.01 -0.10 0.00 0.13 0.00 0.00 31.00 31.72 2dj0 h PRO 46 CO 0.14 0.84 -0.03 0.82 -0.23 0.00 0.00 178.00 179.54 2dj0 h ILE 47 N 0.17 0.49 -0.70 -3.56 2.04 -1.78 -0.10 117.51 114.06 2dj0 h ILE 47 Ca 0.03 -0.03 0.06 0.00 1.00 0.00 0.00 64.86 65.92 2dj0 h ILE 47 Cb 0.74 0.39 -0.06 0.00 -0.74 0.00 0.00 36.82 37.16 2dj0 h ILE 47 CO 0.05 0.02 0.40 0.22 0.00 0.00 0.00 178.15 178.83 2dj0 h TYR 48 N 0.09 0.73 -0.59 1.37 3.20 -1.52 -0.91 116.97 119.33 2dj0 h TYR 48 Ca 0.31 0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.26 2dj0 h TYR 48 Cb 0.49 -0.22 -0.05 0.00 1.54 0.00 0.00 36.73 38.48 2dj0 h TYR 48 CO -0.38 0.34 0.31 0.00 -1.64 0.00 0.00 178.16 176.79 2dj0 h ALA 49 N 1.36 0.77 0.27 1.82 0.00 -1.03 0.02 119.26 122.48 2dj0 h ALA 49 Ca 0.32 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2dj0 h ALA 49 Cb 0.20 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2dj0 h ALA 49 CO -0.19 -0.04 -0.13 0.22 0.00 0.00 0.00 179.25 179.12 2dj0 h ASP 50 N 0.58 -0.31 -0.38 0.00 3.58 -0.66 -2.52 116.42 116.71 2dj0 h ASP 50 Ca 0.27 -0.15 0.08 0.00 0.42 0.00 0.00 57.03 57.64 2dj0 h ASP 50 Cb 0.18 0.08 -0.07 0.00 1.72 0.00 0.00 39.33 41.24 2dj0 h ASP 50 CO -0.18 -0.02 -0.10 -0.07 -2.88 0.00 0.00 179.24 175.99 2dj0 h LEU 51 N -0.61 -0.37 0.08 2.28 3.38 -0.97 -1.87 115.31 117.23 2dj0 h LEU 51 Ca -0.04 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2dj0 h LEU 51 Cb 0.44 0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2dj0 h LEU 51 CO 0.06 -0.13 -0.17 0.77 0.09 0.00 0.00 178.44 179.06 2dj0 h SER 52 N -0.01 -0.49 -0.95 -0.43 4.64 -0.98 -0.06 113.55 115.26 2dj0 h SER 52 Ca 0.18 0.05 0.18 0.00 -0.47 0.00 0.00 61.79 61.73 2dj0 h SER 52 Cb 0.29 0.18 -0.17 0.00 -0.31 0.00 0.00 62.40 62.38 2dj0 h SER 52 CO -0.40 -0.19 -0.28 -0.07 -0.87 0.00 0.00 176.83 175.02 2dj0 h LEU 53 N -0.27 -1.04 -0.44 5.97 3.38 -1.28 1.69 115.31 123.31 2dj0 h LEU 53 Ca -0.01 0.29 0.06 0.00 0.09 0.00 0.00 57.88 58.31 2dj0 h LEU 53 Cb 0.26 0.63 -0.05 0.00 0.09 0.00 0.00 40.66 41.59 2dj0 h LEU 53 CO -0.07 -0.31 0.15 0.50 0.09 0.00 0.00 178.44 178.81 2dj0 h LYS 54 N -0.01 0.31 -0.65 1.13 3.64 -0.98 -0.73 116.57 119.28 2dj0 h LYS 54 Ca 0.42 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.78 2dj0 h LYS 54 Cb 0.67 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2dj0 h LYS 54 CO -0.97 0.21 0.00 0.66 -2.27 0.00 0.00 179.45 177.07 2dj0 n TYR 55 N -5.01 1.25 -2.89 1.91 4.01 0.16 -4.37 117.16 112.22 2dj0 n TYR 55 Ca 0.04 -0.46 -0.25 0.00 -0.16 0.00 0.00 57.90 57.06 2dj0 n TYR 55 Cb 0.17 -0.28 -0.03 0.00 -0.31 0.00 0.00 39.34 38.89 2dj0 n TYR 55 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2dj0 n ASN 56 N 0.62 3.97 0.00 7.72 5.15 0.53 -4.08 115.26 129.17 2dj0 n ASN 56 Ca 0.19 -3.58 0.00 0.00 -0.60 0.00 0.00 54.58 50.59 2dj0 n ASN 56 Cb 0.78 -0.55 0.00 0.00 -0.53 0.00 0.00 39.78 39.48 2dj0 n ASN 56 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2dj0 n THR 58 N -1.81 0.00 0.00 0.00 -2.24 -1.26 -5.01 114.28 103.96 2dj0 n THR 58 Ca 0.00 0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.99 2dj0 n THR 58 Cb 0.14 -0.85 0.00 0.00 -2.10 0.00 0.00 70.33 67.53 2dj0 n THR 58 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dj0 n GLY 59 N 2.21 -0.03 3.69 3.38 0.00 -1.26 -5.08 105.19 108.11 2dj0 n GLY 59 Ca 0.00 -0.00 -0.58 0.00 0.00 0.00 0.00 46.02 45.44 2dj0 n GLY 59 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2dj0 n LEU 60 N -2.02 2.08 -4.75 0.99 7.94 -1.26 -4.95 117.00 115.02 2dj0 n LEU 60 Ca 0.00 1.10 -0.24 0.00 -1.11 0.00 0.00 56.01 55.75 2dj0 n LEU 60 Cb 0.00 -1.11 -0.06 0.00 0.53 0.00 0.00 43.42 42.78 2dj0 n LEU 60 CO 0.00 -0.61 -0.24 0.20 -1.11 0.00 0.00 177.39 175.63 2dj0 s ASN 61 N 2.95 5.21 -0.13 1.96 -0.87 -1.26 -3.84 114.94 118.95 2dj0 s ASN 61 Ca 0.97 -0.31 0.01 0.00 -1.57 0.00 0.00 52.86 51.97 2dj0 s ASN 61 Cb -1.11 -1.24 0.02 0.00 -0.02 0.00 0.00 41.25 38.89 2dj0 s ASN 61 CO 0.65 0.03 -0.16 -0.36 -2.57 0.00 0.00 177.10 174.69 2dj0 s PHE 62 N -1.96 2.16 0.40 2.20 0.40 -1.26 -3.37 117.98 116.55 2dj0 s PHE 62 Ca 0.31 -1.12 0.08 0.00 -0.60 0.00 0.00 56.93 55.60 2dj0 s PHE 62 Cb -0.09 -1.56 -0.04 0.00 0.51 0.00 0.00 43.02 41.85 2dj0 s PHE 62 CO 0.22 -0.58 0.23 0.20 0.70 0.00 0.00 175.22 175.99 2dj0 s GLY 63 N 1.17 2.18 -0.28 4.36 0.00 0.08 -2.03 107.32 112.80 2dj0 s GLY 63 Ca -0.02 -1.97 -0.16 0.00 0.00 0.00 0.00 44.72 42.57 2dj0 s GLY 63 CO -0.06 -1.81 0.69 1.25 0.00 0.00 0.00 173.10 173.17 2dj0 s LYS 64 N -3.96 0.71 0.01 2.90 2.20 -1.21 -1.84 119.74 118.54 2dj0 s LYS 64 Ca 0.42 1.21 0.01 0.00 -0.36 0.00 0.00 55.97 57.25 2dj0 s LYS 64 Cb 0.00 0.15 -0.01 0.00 -1.51 0.00 0.00 37.83 36.46 2dj0 s LYS 64 CO 0.24 -0.15 -0.03 0.54 -0.36 0.00 0.00 175.35 175.60 2dj0 s VAL 65 N 1.59 0.19 -0.26 4.02 0.11 -1.16 -3.77 120.40 121.12 2dj0 s VAL 65 Ca -0.10 -0.35 -0.20 0.00 -2.93 0.00 0.00 61.98 58.41 2dj0 s VAL 65 Cb -0.05 -0.21 -0.02 0.00 -1.53 0.00 0.00 36.38 34.57 2dj0 s VAL 65 CO -0.19 -0.10 0.60 1.51 -3.33 0.00 0.00 175.10 173.59 2dj0 s ASP 66 N -0.48 6.53 -0.15 3.54 1.47 -1.26 -2.34 116.67 123.99 2dj0 s ASP 66 Ca -0.04 0.62 0.09 0.00 1.18 0.00 0.00 52.55 54.40 2dj0 s ASP 66 Cb -0.03 -2.32 -0.23 0.00 -0.34 0.00 0.00 42.92 39.99 2dj0 s ASP 66 CO -0.00 -0.37 0.25 1.33 0.68 0.00 0.00 175.17 177.06 2dj0 n VAL 67 N 5.22 1.55 -0.39 2.11 0.24 0.96 -3.46 118.33 124.56 2dj0 n VAL 67 Ca -0.01 -0.75 0.31 0.00 -2.04 0.00 0.00 64.34 61.85 2dj0 n VAL 67 Cb 0.49 -1.05 0.58 0.00 -1.47 0.00 0.00 33.84 32.39 2dj0 n VAL 67 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2dj0 h GLY 68 N 2.95 1.54 0.15 7.63 0.00 -1.89 -1.73 103.07 111.73 2dj0 h GLY 68 Ca -0.45 -0.16 -0.37 0.00 0.00 0.00 0.00 47.33 46.35 2dj0 h GLY 68 CO 0.03 -0.41 -2.11 -2.13 0.00 0.00 0.00 176.54 171.92 2dj0 n ARG 69 N -4.81 0.64 -2.39 4.80 0.63 -1.26 -4.82 116.66 109.46 2dj0 n ARG 69 Ca 0.34 0.30 -0.41 0.00 -0.92 0.00 0.00 57.85 57.16 2dj0 n ARG 69 Cb 1.23 -1.61 -0.03 0.00 0.45 0.00 0.00 32.46 32.50 2dj0 n ARG 69 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2dj0 s TYR 70 N -2.49 2.24 0.11 -0.14 1.51 -0.65 -4.86 117.35 113.06 2dj0 s TYR 70 Ca -0.32 0.43 -0.13 0.00 -1.01 0.00 0.00 57.07 56.05 2dj0 s TYR 70 Cb 0.09 -4.40 -0.12 0.00 -0.11 0.00 0.00 41.96 37.42 2dj0 s TYR 70 CO 0.61 -2.01 1.36 0.00 -1.11 0.00 0.00 175.55 174.40 2dj0 h THR 71 N 6.37 1.28 -0.11 -0.71 1.03 -1.88 -2.05 112.91 116.85 2dj0 h THR 71 Ca -0.27 -1.79 0.04 0.00 -0.01 0.00 0.00 66.41 64.38 2dj0 h THR 71 Cb 1.09 1.79 -0.06 0.00 -1.07 0.00 0.00 68.15 69.90 2dj0 h THR 71 CO 1.19 0.58 -0.31 0.44 -0.01 0.00 0.00 175.52 177.40 2dj0 h ASP 72 N 0.57 -0.97 0.65 0.00 3.32 -1.92 -1.37 116.42 116.69 2dj0 h ASP 72 Ca -0.01 0.14 -0.03 0.00 0.02 0.00 0.00 57.03 57.15 2dj0 h ASP 72 Cb 1.21 0.41 0.01 0.00 0.22 0.00 0.00 39.33 41.18 2dj0 h ASP 72 CO 0.13 -0.36 -0.31 0.58 -1.72 0.00 0.00 179.24 177.56 2dj0 h VAL 73 N -0.40 0.06 -0.83 -1.35 2.07 -1.91 0.42 116.25 114.31 2dj0 h VAL 73 Ca 0.09 -0.35 0.24 0.00 0.82 0.00 0.00 66.70 67.50 2dj0 h VAL 73 Cb 0.54 0.09 -0.15 0.00 -1.52 0.00 0.00 31.29 30.24 2dj0 h VAL 73 CO -0.33 0.01 0.05 -1.54 0.02 0.00 0.00 177.57 175.78 2dj0 n SER 74 N -5.36 -0.06 0.07 0.57 3.41 -0.77 0.36 113.62 111.84 2dj0 n SER 74 Ca -0.11 1.41 -0.22 0.00 -0.26 0.00 0.00 58.87 59.68 2dj0 n SER 74 Cb 0.35 -0.53 -0.15 0.00 -0.26 0.00 0.00 64.21 63.63 2dj0 n SER 74 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2dj0 h THR 75 N 0.00 1.22 -0.61 6.66 2.02 -1.23 0.90 112.91 121.87 2dj0 h THR 75 Ca 0.52 -2.54 0.11 0.00 0.77 0.00 0.00 66.41 65.27 2dj0 h THR 75 Cb 1.11 2.96 -0.12 0.00 -1.74 0.00 0.00 68.15 70.36 2dj0 h THR 75 CO -0.77 0.76 -0.28 -0.09 0.37 0.00 0.00 175.52 175.52 2dj0 h ARG 76 N -0.13 -0.11 -0.95 6.66 2.43 0.46 0.68 114.38 123.41 2dj0 h ARG 76 Ca -0.25 0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 58.80 2dj0 h ARG 76 Cb 1.90 0.02 -0.08 0.00 -0.42 0.00 0.00 29.97 31.40 2dj0 h ARG 76 CO 0.17 -0.07 0.16 0.66 -1.51 0.00 0.00 179.97 179.38 2dj0 n TYR 77 N -5.44 0.98 -4.17 2.20 4.02 -0.13 -4.84 117.16 109.76 2dj0 n TYR 77 Ca 0.06 -0.75 -0.36 0.00 -0.01 0.00 0.00 57.90 56.84 2dj0 n TYR 77 Cb 0.35 -0.42 -0.04 0.00 -0.02 0.00 0.00 39.34 39.21 2dj0 n TYR 77 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2dj0 n LYS 78 N 0.01 -2.30 -3.41 -0.72 4.01 0.24 -4.88 118.16 111.11 2dj0 n LYS 78 Ca 0.18 0.28 -0.44 0.00 -0.51 0.00 0.00 58.31 57.81 2dj0 n LYS 78 Cb 0.81 -4.95 -0.08 0.00 -0.51 0.00 0.00 35.03 30.31 2dj0 n LYS 78 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2dj0 s VAL 79 N -3.17 5.19 0.23 -0.18 1.01 0.31 -4.99 120.40 118.80 2dj0 s VAL 79 Ca 0.71 -1.04 -0.31 0.00 0.00 0.00 0.00 61.98 61.34 2dj0 s VAL 79 Cb -0.40 -4.08 -0.10 0.00 0.00 0.00 0.00 36.38 31.80 2dj0 s VAL 79 CO 0.87 -0.55 1.53 -0.44 0.00 0.00 0.00 175.10 176.51 2dj0 s SER 80 N 2.50 6.56 -0.34 3.32 0.01 -1.26 -4.18 113.70 120.31 2dj0 s SER 80 Ca 0.04 2.72 0.06 0.00 1.31 0.00 0.00 55.95 60.09 2dj0 s SER 80 Cb -0.24 -2.61 0.46 0.00 0.21 0.00 0.00 66.02 63.84 2dj0 s SER 80 CO 0.07 -0.80 1.35 0.35 0.41 0.00 0.00 173.24 174.62 2dj0 n THR 81 N 2.91 2.66 -3.63 1.44 -2.24 -1.26 -4.66 114.28 109.50 2dj0 n THR 81 Ca 0.10 -3.74 -0.30 0.00 -2.27 0.00 0.00 64.05 57.84 2dj0 n THR 81 Cb 0.39 -0.93 -0.04 0.00 -2.10 0.00 0.00 70.33 67.65 2dj0 n THR 81 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2dj0 s SER 82 N -3.17 6.45 0.00 3.42 1.04 -1.26 -4.97 113.70 115.22 2dj0 s SER 82 Ca 0.51 0.55 0.11 0.00 0.48 0.00 0.00 55.95 57.60 2dj0 s SER 82 Cb 0.42 -2.07 0.64 0.00 0.10 0.00 0.00 66.02 65.10 2dj0 s SER 82 CO 0.01 -0.01 1.07 -0.81 0.98 0.00 0.00 173.24 174.49 2dj0 n PRO 83 N -0.28 0.49 -2.67 4.02 -0.04 -1.26 -3.14 135.00 132.11 2dj0 n PRO 83 Ca -0.03 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.22 2dj0 n PRO 83 Cb 0.53 -1.34 -0.00 0.00 -0.04 0.00 0.00 33.50 32.65 2dj0 n PRO 83 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2dj0 n LEU 84 N -0.84 3.37 -3.57 1.53 4.77 -1.26 -5.05 117.00 115.95 2dj0 n LEU 84 Ca 0.08 -4.85 -0.17 0.00 -0.03 0.00 0.00 56.01 51.05 2dj0 n LEU 84 Cb 0.04 -0.11 -0.07 0.00 -2.33 0.00 0.00 43.42 40.95 2dj0 n LEU 84 CO 0.06 2.07 0.38 0.28 -1.33 0.00 0.00 177.39 178.85 2dj0 s THR 85 N -4.38 0.01 -0.85 -5.08 -1.32 -1.19 -5.06 115.64 97.77 2dj0 s THR 85 Ca 0.41 -0.05 -0.01 0.00 -1.21 0.00 0.00 61.69 60.83 2dj0 s THR 85 Cb 0.39 -0.95 0.35 0.00 -1.51 0.00 0.00 72.50 70.79 2dj0 s THR 85 CO -0.11 -0.03 1.94 0.29 -2.21 0.00 0.00 174.62 174.51 2dj0 n LYS 86 N 1.27 3.16 -0.64 7.08 4.76 -1.26 -4.55 118.16 127.97 2dj0 n LYS 86 Ca -0.18 -3.74 0.01 0.00 -2.87 0.00 0.00 58.31 51.52 2dj0 n LYS 86 Cb 0.57 -2.30 0.21 0.00 -1.84 0.00 0.00 35.03 31.67 2dj0 n LYS 86 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2dj0 n GLN 87 N -0.47 1.95 -3.67 1.97 6.02 -1.26 -4.56 117.38 117.36 2dj0 n GLN 87 Ca 0.52 -3.08 -0.08 0.00 -0.01 0.00 0.00 57.00 54.35 2dj0 n GLN 87 Cb 0.26 -1.77 -0.09 0.00 1.02 0.00 0.00 30.24 29.66 2dj0 n GLN 87 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2dj0 s LEU 88 N -3.14 -0.58 0.00 1.08 1.43 -1.26 -4.24 118.68 111.97 2dj0 s LEU 88 Ca 0.42 1.10 -0.08 0.00 -1.03 0.00 0.00 54.13 54.53 2dj0 s LEU 88 Cb 0.38 1.59 0.13 0.00 0.03 0.00 0.00 46.19 48.32 2dj0 s LEU 88 CO 0.01 -0.22 0.45 -0.81 0.23 0.00 0.00 176.35 176.01 2dj0 n PRO 89 N 4.94 -1.90 -3.67 1.29 -0.04 -1.26 -4.84 135.00 129.51 2dj0 n PRO 89 Ca -0.15 -0.72 -0.09 0.00 -0.04 0.00 0.00 63.50 62.50 2dj0 n PRO 89 Cb 0.52 -0.67 -0.10 0.00 -0.04 0.00 0.00 33.50 33.21 2dj0 n PRO 89 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2dj0 s THR 90 N -1.81 -0.39 -0.12 0.52 2.01 0.93 -4.67 115.64 112.11 2dj0 s THR 90 Ca 0.29 0.14 -0.03 0.00 0.31 0.00 0.00 61.69 62.40 2dj0 s THR 90 Cb -0.03 -0.65 -0.03 0.00 0.01 0.00 0.00 72.50 71.80 2dj0 s THR 90 CO 0.22 0.06 0.01 -0.76 -0.69 0.00 0.00 174.62 173.46 2dj0 s LEU 91 N 2.12 3.57 -0.02 4.42 1.43 0.15 -0.07 118.68 130.28 2dj0 s LEU 91 Ca -0.05 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.14 2dj0 s LEU 91 Cb -0.10 -1.84 0.02 0.00 0.03 0.00 0.00 46.19 44.29 2dj0 s LEU 91 CO -0.13 0.29 -0.01 -0.63 0.23 0.00 0.00 176.35 176.11 2dj0 s ILE 92 N -0.37 0.14 -0.24 -0.59 1.01 -1.09 -0.14 121.20 119.92 2dj0 s ILE 92 Ca 0.07 0.03 -0.10 0.00 0.00 0.00 0.00 60.65 60.65 2dj0 s ILE 92 Cb -0.12 -0.19 -0.05 0.00 0.01 0.00 0.00 42.46 42.11 2dj0 s ILE 92 CO 0.02 0.10 0.14 -0.22 0.00 0.00 0.00 174.94 174.97 2dj0 s LEU 93 N 0.57 3.96 -0.26 2.97 2.96 -0.04 -3.05 118.68 125.79 2dj0 s LEU 93 Ca -0.05 0.05 -0.05 0.00 -0.22 0.00 0.00 54.13 53.85 2dj0 s LEU 93 Cb -0.08 -2.06 0.00 0.00 0.50 0.00 0.00 46.19 44.55 2dj0 s LEU 93 CO -0.01 0.06 0.03 -0.36 -1.32 0.00 0.00 176.35 174.75 2dj0 s PHE 94 N 1.10 3.08 -0.27 5.38 0.40 -0.79 -0.66 117.98 126.22 2dj0 s PHE 94 Ca 0.06 -0.96 -0.02 0.00 -0.60 0.00 0.00 56.93 55.41 2dj0 s PHE 94 Cb -0.14 -2.19 0.09 0.00 0.51 0.00 0.00 43.02 41.29 2dj0 s PHE 94 CO 0.04 -0.56 0.08 -0.65 0.70 0.00 0.00 175.22 174.84 2dj0 s GLN 95 N 1.49 0.59 0.00 0.44 -0.21 -1.06 -2.51 119.66 118.40 2dj0 s GLN 95 Ca 0.04 -0.75 0.00 0.00 0.02 0.00 0.00 55.36 54.67 2dj0 s GLN 95 Cb -0.16 -1.86 0.00 0.00 1.00 0.00 0.00 33.01 31.98 2dj0 s GLN 95 CO 0.00 -0.88 0.00 0.41 -2.12 0.00 0.00 175.29 172.71 2dj0 n GLY 96 N 5.00 1.87 2.49 3.09 0.00 -1.15 -4.38 105.19 112.10 2dj0 n GLY 96 Ca -0.05 -0.05 -0.14 0.00 0.00 0.00 0.00 46.02 45.78 2dj0 n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dj0 n GLY 97 N -1.04 -0.06 3.79 -0.02 0.00 -1.26 -4.96 105.19 101.64 2dj0 n GLY 97 Ca 0.00 -0.24 -0.09 0.00 0.00 0.00 0.00 46.02 45.69 2dj0 n GLY 97 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dj0 s LYS 98 N -5.19 2.27 -0.25 1.61 0.00 -1.26 -5.01 119.74 111.91 2dj0 s LYS 98 Ca 0.17 -1.51 -0.17 0.00 0.00 0.00 0.00 55.97 54.47 2dj0 s LYS 98 Cb -0.07 0.62 -0.03 0.00 0.00 0.00 0.00 37.83 38.34 2dj0 s LYS 98 CO 0.21 -1.06 0.45 -2.00 0.00 0.00 0.00 175.35 172.95 2dj0 s GLU 99 N -2.17 4.07 -0.14 1.78 -6.30 -1.26 -2.56 118.70 112.12 2dj0 s GLU 99 Ca 0.17 0.21 0.06 0.00 -2.50 0.00 0.00 54.97 52.91 2dj0 s GLU 99 Cb -0.05 -3.63 -0.23 0.00 0.00 0.00 0.00 34.13 30.22 2dj0 s GLU 99 CO 0.12 -0.27 0.27 0.00 0.02 0.00 0.00 175.26 175.40 2dj0 n ALA 100 N 5.28 1.31 -3.56 6.30 0.00 0.16 -4.94 120.51 125.06 2dj0 n ALA 100 Ca -0.06 -0.91 -0.06 0.00 0.00 0.00 0.00 53.44 52.41 2dj0 n ALA 100 Cb 0.50 -0.50 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2dj0 n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dj0 s MET 101 N -2.55 0.69 0.02 0.00 0.23 -1.21 -5.01 119.30 111.48 2dj0 s MET 101 Ca -0.17 -0.28 -0.12 0.00 -1.03 0.00 0.00 55.69 54.08 2dj0 s MET 101 Cb 0.07 0.30 0.02 0.00 -1.53 0.00 0.00 34.83 33.69 2dj0 s MET 101 CO 0.76 -0.31 0.26 -0.98 -2.03 0.00 0.00 175.02 172.73 2dj0 s ARG 102 N -2.90 0.71 -0.09 3.16 1.70 -1.26 -0.86 118.95 119.41 2dj0 s ARG 102 Ca 0.07 -0.43 -0.07 0.00 -0.47 0.00 0.00 55.73 54.84 2dj0 s ARG 102 Cb -0.01 0.30 0.03 0.00 -0.57 0.00 0.00 34.95 34.70 2dj0 s ARG 102 CO -0.06 -0.21 0.22 1.03 -1.08 0.00 0.00 175.30 175.20 2dj0 s ARG 103 N -2.06 0.24 0.98 3.89 1.81 0.80 -4.00 118.95 120.61 2dj0 s ARG 103 Ca -0.09 0.34 -0.12 0.00 -1.72 0.00 0.00 55.73 54.14 2dj0 s ARG 103 Cb -0.03 0.07 0.18 0.00 -0.45 0.00 0.00 34.95 34.72 2dj0 s ARG 103 CO -0.01 -0.06 1.09 -1.25 -0.68 0.00 0.00 175.30 174.40 2dj0 s PRO 104 N 0.34 0.60 0.33 3.54 0.04 -1.26 -0.68 135.00 137.91 2dj0 s PRO 104 Ca -0.02 0.59 0.02 0.00 0.04 0.00 0.00 61.00 61.63 2dj0 s PRO 104 Cb -0.03 -1.75 -0.03 0.00 0.04 0.00 0.00 34.50 32.73 2dj0 s PRO 104 CO -0.01 -2.63 0.52 -1.14 0.04 0.00 0.00 177.00 173.77 2dj0 s GLN 105 N -4.96 3.40 0.52 4.56 0.74 -1.26 -4.92 119.66 117.74 2dj0 s GLN 105 Ca 0.65 -0.50 -0.06 0.00 0.05 0.00 0.00 55.36 55.50 2dj0 s GLN 105 Cb -0.18 -2.71 -0.03 0.00 1.10 0.00 0.00 33.01 31.19 2dj0 s GLN 105 CO 0.57 0.15 0.83 0.42 -0.55 0.00 0.00 175.29 176.72 2dj0 s ILE 106 N -2.26 4.63 0.00 -2.34 -1.09 -1.26 -2.08 121.20 116.80 2dj0 s ILE 106 Ca 0.40 0.22 0.00 0.00 -2.23 0.00 0.00 60.65 59.04 2dj0 s ILE 106 Cb -0.09 -3.78 0.00 0.00 -1.58 0.00 0.00 42.46 37.00 2dj0 s ILE 106 CO 0.34 -0.80 0.00 -0.67 -1.23 0.00 0.00 174.94 172.59 2dj0 n ASP 107 N -2.37 0.00 0.00 3.58 2.03 -0.12 -4.85 116.55 114.82 2dj0 n ASP 107 Ca 0.02 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.33 2dj0 n ASP 107 Cb 0.56 -0.17 0.00 0.00 -0.72 0.00 0.00 41.12 40.78 2dj0 n ASP 107 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2dj0 n LYS 108 N -2.40 0.00 -2.80 -0.67 3.00 -1.26 -4.96 118.16 109.06 2dj0 n LYS 108 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.88 2dj0 n LYS 108 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 2dj0 n LYS 108 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2dj0 n LYS 109 N -2.41 3.67 -2.20 1.64 4.76 -1.26 -4.67 118.16 117.68 2dj0 n LYS 109 Ca 0.00 -3.94 0.00 0.00 -2.87 0.00 0.00 58.31 51.50 2dj0 n LYS 109 Cb 0.00 -2.84 0.00 0.00 -1.84 0.00 0.00 35.03 30.35 2dj0 n LYS 109 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dj0 n GLY 110 N 2.97 -0.41 3.74 0.72 0.00 -1.26 -4.85 105.19 106.10 2dj0 n GLY 110 Ca 0.34 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.98 2dj0 n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dj0 s ARG 111 N -4.35 4.28 -0.27 1.61 1.81 -1.26 -4.93 118.95 115.85 2dj0 s ARG 111 Ca 0.00 0.50 -0.18 0.00 -1.72 0.00 0.00 55.73 54.34 2dj0 s ARG 111 Cb 0.00 -3.39 -0.03 0.00 -0.45 0.00 0.00 34.95 31.08 2dj0 s ARG 111 CO 0.00 0.26 0.50 0.00 -0.68 0.00 0.00 175.30 175.38 2dj0 s ALA 112 N 0.27 3.58 0.05 2.13 0.00 -1.26 -0.95 121.76 125.58 2dj0 s ALA 112 Ca 0.27 -0.66 -0.30 0.00 0.00 0.00 0.00 51.96 51.27 2dj0 s ALA 112 Cb -0.16 -2.87 -0.09 0.00 0.00 0.00 0.00 23.12 20.00 2dj0 s ALA 112 CO 0.12 -0.76 1.82 0.08 0.00 0.00 0.00 175.76 177.01 2dj0 s VAL 113 N 2.29 2.98 -0.46 0.00 1.01 -0.89 -4.79 120.40 120.55 2dj0 s VAL 113 Ca 0.20 0.23 -0.35 0.00 0.00 0.00 0.00 61.98 62.07 2dj0 s VAL 113 Cb -0.16 -3.15 -0.13 0.00 0.00 0.00 0.00 36.38 32.94 2dj0 s VAL 113 CO 0.09 -0.01 2.26 -1.20 0.00 0.00 0.00 175.10 176.25 2dj0 n SER 114 N 6.56 1.76 -4.50 3.32 7.64 -1.26 -4.70 113.62 122.43 2dj0 n SER 114 Ca 0.18 0.33 -0.25 0.00 1.01 0.00 0.00 58.87 60.14 2dj0 n SER 114 Cb 0.40 -1.21 -0.10 0.00 -1.01 0.00 0.00 64.21 62.30 2dj0 n SER 114 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 2dj0 s TRP 115 N 7.82 2.41 0.16 1.43 -0.00 -1.26 -5.12 118.94 124.38 2dj0 s TRP 115 Ca 1.13 -0.30 -0.26 0.00 -0.00 0.00 0.00 56.10 56.67 2dj0 s TRP 115 Cb -0.92 -1.10 -0.08 0.00 -0.00 0.00 0.00 33.47 31.38 2dj0 s TRP 115 CO 0.49 0.63 0.79 0.99 -0.00 0.00 0.00 176.95 179.85 2dj0 s THR 116 N -2.20 4.37 -0.87 5.86 2.01 -1.26 -5.02 115.64 118.53 2dj0 s THR 116 Ca 0.28 1.73 -0.05 0.00 0.31 0.00 0.00 61.69 63.96 2dj0 s THR 116 Cb -0.06 -4.15 0.22 0.00 0.01 0.00 0.00 72.50 68.51 2dj0 s THR 116 CO 0.15 0.51 0.77 -0.36 -0.69 0.00 0.00 174.62 175.00 2dj0 s PHE 117 N -1.06 3.84 0.15 4.92 0.08 -1.26 -4.80 117.98 119.87 2dj0 s PHE 117 Ca 0.36 -2.76 0.03 0.00 0.12 0.00 0.00 56.93 54.69 2dj0 s PHE 117 Cb -0.23 -3.43 -0.05 0.00 -0.57 0.00 0.00 43.02 38.75 2dj0 s PHE 117 CO 0.26 -0.83 -0.06 -1.54 -0.10 0.00 0.00 175.22 172.95 2dj0 s SER 118 N 0.62 1.53 0.04 1.36 1.04 -1.26 -4.91 113.70 112.12 2dj0 s SER 118 Ca 0.25 -1.07 -0.28 0.00 0.48 0.00 0.00 55.95 55.32 2dj0 s SER 118 Cb -0.11 0.04 -0.17 0.00 0.10 0.00 0.00 66.02 65.88 2dj0 s SER 118 CO -0.09 -0.44 1.38 -0.08 0.98 0.00 0.00 173.24 174.99 2dj0 h GLU 119 N 2.76 -0.65 -0.44 4.02 4.81 -1.96 0.89 114.58 124.02 2dj0 h GLU 119 Ca -0.37 0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.00 2dj0 h GLU 119 Cb 1.19 0.15 -0.08 0.00 0.63 0.00 0.00 28.75 30.64 2dj0 h GLU 119 CO 0.64 -0.35 -0.10 1.05 -0.73 0.00 0.00 179.01 179.52 2dj0 h GLU 120 N -0.87 0.01 0.55 1.92 4.11 -2.00 -0.97 114.58 117.34 2dj0 h GLU 120 Ca -0.07 -0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.33 2dj0 h GLU 120 Cb 0.59 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.84 2dj0 h GLU 120 CO 0.11 0.01 -0.26 -0.97 0.07 0.00 0.00 179.01 177.97 2dj0 h ASN 121 N 0.01 -0.62 -0.79 3.06 -0.73 -1.93 -2.34 115.58 112.23 2dj0 h ASN 121 Ca 0.21 -0.02 0.17 0.00 1.87 0.00 0.00 56.30 58.54 2dj0 h ASN 121 Cb 0.32 0.16 -0.15 0.00 0.27 0.00 0.00 38.32 38.93 2dj0 h ASN 121 CO -0.44 -0.38 -0.09 0.58 -0.37 0.00 0.00 177.43 176.73 2dj0 h VAL 122 N -0.83 0.25 0.39 2.57 2.07 -0.43 0.32 116.25 120.58 2dj0 h VAL 122 Ca -0.08 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 2dj0 h VAL 122 Cb 0.60 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2dj0 h VAL 122 CO 0.12 0.01 -0.28 0.40 0.02 0.00 0.00 177.57 177.84 2dj0 h ILE 123 N 0.04 0.42 -0.89 4.57 2.04 -1.07 0.20 117.51 122.82 2dj0 h ILE 123 Ca 0.41 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.35 2dj0 h ILE 123 Cb 0.70 0.42 -0.06 0.00 -0.74 0.00 0.00 36.82 37.14 2dj0 h ILE 123 CO -0.76 0.00 0.58 -0.09 0.00 0.00 0.00 178.15 177.88 2dj0 h ARG 124 N -0.66 0.92 0.45 2.37 2.43 -0.60 1.65 114.38 120.95 2dj0 h ARG 124 Ca -0.04 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 2dj0 h ARG 124 Cb 0.56 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 2dj0 h ARG 124 CO 0.01 0.61 -0.22 0.93 -1.51 0.00 0.00 179.97 179.79 2dj0 h GLU 125 N 0.95 -0.58 -0.74 0.20 4.39 0.00 -3.11 114.58 115.68 2dj0 h GLU 125 Ca 0.40 0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.14 2dj0 h GLU 125 Cb 0.30 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 2dj0 h GLU 125 CO -0.16 -0.28 0.00 1.19 -1.16 0.00 0.00 179.01 178.61 2dj0 n PHE 126 N -5.22 1.02 -3.13 4.33 3.01 0.67 -4.88 117.46 113.25 2dj0 n PHE 126 Ca -0.10 -0.36 -0.21 0.00 1.01 0.00 0.00 57.45 57.79 2dj0 n PHE 126 Cb 0.30 -0.28 -0.04 0.00 -0.01 0.00 0.00 39.48 39.45 2dj0 n PHE 126 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2dj0 n ASN 127 N 0.35 -1.11 -0.29 4.37 4.13 0.55 -4.70 115.26 118.55 2dj0 n ASN 127 Ca 0.14 -0.52 0.12 0.00 1.68 0.00 0.00 54.58 56.01 2dj0 n ASN 127 Cb 0.70 -1.00 0.29 0.00 -1.54 0.00 0.00 39.78 38.22 2dj0 n ASN 127 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 2dj0 h LEU 128 N -0.43 0.15 -0.88 3.41 3.38 -1.42 0.37 115.31 119.89 2dj0 h LEU 128 Ca -0.30 0.17 0.14 0.00 0.09 0.00 0.00 57.88 57.98 2dj0 h LEU 128 Cb 0.90 0.20 -0.09 0.00 0.09 0.00 0.00 40.66 41.75 2dj0 h LEU 128 CO 0.45 -0.07 0.49 -1.13 0.09 0.00 0.00 178.44 178.26 2dj0 h ASN 129 N 0.30 0.64 0.02 -0.43 -0.73 -1.84 -2.42 115.58 111.11 2dj0 h ASN 129 Ca 0.54 0.08 -0.00 0.00 1.87 0.00 0.00 56.30 58.79 2dj0 h ASN 129 Cb 1.05 -0.03 0.00 0.00 0.27 0.00 0.00 38.32 39.60 2dj0 h ASN 129 CO -0.58 0.30 -0.01 -0.33 -0.37 0.00 0.00 177.43 176.44 2dj0 h GLU 130 N 0.72 -0.02 -0.57 6.67 4.39 -0.78 -2.70 114.58 122.29 2dj0 h GLU 130 Ca 0.47 0.00 0.05 0.00 0.34 0.00 0.00 59.36 60.22 2dj0 h GLU 130 Cb 0.60 0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 29.19 2dj0 h GLU 130 CO -0.33 0.47 -0.34 1.28 -1.16 0.00 0.00 179.01 178.94 2dj0 n LEU 131 N -4.72 -0.61 -0.15 1.33 4.77 0.68 0.25 117.00 118.55 2dj0 n LEU 131 Ca -0.05 1.19 -0.10 0.00 -0.03 0.00 0.00 56.01 57.02 2dj0 n LEU 131 Cb 0.24 -0.22 -0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2dj0 n LEU 131 CO 0.18 -0.92 0.83 -1.28 -1.33 0.00 0.00 177.39 174.87 2dj0 h SER 132 N 0.00 0.73 0.00 -1.43 0.87 -1.61 -3.49 113.55 108.61 2dj0 h SER 132 Ca 0.09 -0.28 0.00 0.00 -1.23 0.00 0.00 61.79 60.37 2dj0 h SER 132 Cb 0.23 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 2dj0 h SER 132 CO -0.54 0.82 0.00 0.61 -0.53 0.00 0.00 176.83 177.19 2dj0 n GLY 133 N -0.46 2.60 0.00 5.77 0.00 0.14 -4.82 105.19 108.42 2dj0 n GLY 133 Ca 0.00 -1.44 0.06 0.00 0.00 0.00 0.00 46.02 44.64 2dj0 n GLY 133 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dj0 n PRO 134 N 1.63 0.48 -2.76 1.61 -0.04 -1.24 -4.81 135.00 129.87 2dj0 n PRO 134 Ca 0.00 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.40 2dj0 n PRO 134 Cb 0.00 -1.36 0.02 0.00 -0.04 0.00 0.00 33.50 32.12 2dj0 n PRO 134 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dj0 n SER 135 N -0.86 -3.09 -4.22 3.54 2.88 -1.26 -5.03 113.62 105.57 2dj0 n SER 135 Ca 0.08 -0.15 -0.36 0.00 -1.33 0.00 0.00 58.87 57.11 2dj0 n SER 135 Cb 0.04 -1.77 -0.14 0.00 -0.75 0.00 0.00 64.21 61.59 2dj0 n SER 135 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dj0 s SER 136 N -3.12 4.82 0.00 -3.46 0.01 -1.26 -5.33 113.70 105.35 2dj0 s SER 136 Ca 0.15 -1.04 0.00 0.00 1.31 0.00 0.00 55.95 56.36 2dj0 s SER 136 Cb -0.06 -1.75 0.00 0.00 0.21 0.00 0.00 66.02 64.42 2dj0 s SER 136 CO 0.20 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.24