#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dbj s SER 2 N 0.00 6.70 -0.29 1.61 0.15 -1.26 -4.96 113.70 115.64 2dbj s SER 2 Ca 0.00 1.81 -0.15 0.00 0.70 0.00 0.00 55.95 58.31 2dbj s SER 2 Cb 0.00 -2.54 0.15 0.00 -1.71 0.00 0.00 66.02 61.92 2dbj s SER 2 CO 0.00 -0.96 0.92 -0.55 1.20 0.00 0.00 173.24 173.85 2dbj s SER 3 N 3.02 -0.65 0.51 5.45 0.15 -1.26 -5.16 113.70 115.77 2dbj s SER 3 Ca 0.65 0.94 -0.21 0.00 0.70 0.00 0.00 55.95 58.03 2dbj s SER 3 Cb -0.26 1.56 -0.06 0.00 -1.71 0.00 0.00 66.02 65.55 2dbj s SER 3 CO 0.24 -0.14 1.18 -0.83 1.20 0.00 0.00 173.24 174.89 2dbj s GLY 4 N 2.05 2.74 0.32 9.45 0.00 -1.26 -5.05 107.32 115.58 2dbj s GLY 4 Ca -0.06 0.95 0.03 0.00 0.00 0.00 0.00 44.72 45.64 2dbj s GLY 4 CO -0.17 1.38 0.11 -1.35 0.00 0.00 0.00 173.10 173.07 2dbj s SER 5 N -1.46 1.92 0.75 1.64 1.04 -1.26 -5.14 113.70 111.18 2dbj s SER 5 Ca 0.69 -1.50 -0.13 0.00 0.48 0.00 0.00 55.95 55.49 2dbj s SER 5 Cb -0.29 0.25 0.05 0.00 0.10 0.00 0.00 66.02 66.13 2dbj s SER 5 CO 0.34 -0.79 1.14 -0.94 0.98 0.00 0.00 173.24 173.96 2dbj s SER 6 N -3.44 4.35 0.00 7.02 1.04 -1.26 -5.04 113.70 116.38 2dbj s SER 6 Ca 0.34 2.09 0.00 0.00 0.48 0.00 0.00 55.95 58.86 2dbj s SER 6 Cb 0.06 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.62 2dbj s SER 6 CO 0.15 -2.15 0.00 0.61 0.98 0.00 0.00 173.24 172.84 2dbj n GLY 7 N -0.29 -0.38 3.86 7.32 0.00 -1.26 -5.17 105.19 109.27 2dbj n GLY 7 Ca 0.11 0.81 -0.29 0.00 0.00 0.00 0.00 46.02 46.65 2dbj n GLY 7 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dbj s TRP 8 N 0.00 2.45 -0.00 1.61 0.52 -1.26 -5.07 118.94 117.18 2dbj s TRP 8 Ca 0.00 0.68 0.01 0.00 0.02 0.00 0.00 56.10 56.81 2dbj s TRP 8 Cb 0.00 -3.60 -0.04 0.00 -1.15 0.00 0.00 33.47 28.68 2dbj s TRP 8 CO 0.00 -2.21 0.01 0.42 0.02 0.00 0.00 176.95 175.19 2dbj s ILE 9 N -3.54 4.23 0.22 2.03 -1.09 -1.26 -5.12 121.20 116.67 2dbj s ILE 9 Ca 0.65 -0.57 -0.04 0.00 -2.23 0.00 0.00 60.65 58.46 2dbj s ILE 9 Cb -0.10 -2.89 -0.03 0.00 -1.58 0.00 0.00 42.46 37.85 2dbj s ILE 9 CO 0.51 0.37 0.23 -1.48 -1.23 0.00 0.00 174.94 173.34 2dbj s LEU 10 N -1.57 0.97 0.01 2.97 2.34 -1.26 -5.18 118.68 116.96 2dbj s LEU 10 Ca 0.20 -1.30 -0.28 0.00 0.06 0.00 0.00 54.13 52.81 2dbj s LEU 10 Cb -0.12 0.74 0.10 0.00 -0.56 0.00 0.00 46.19 46.36 2dbj s LEU 10 CO 0.11 -0.93 0.90 0.00 -1.06 0.00 0.00 176.35 175.36 2dbj s ALA 11 N -4.08 -1.81 -0.82 1.48 0.00 -1.26 -5.10 121.76 110.18 2dbj s ALA 11 Ca 0.35 0.92 -0.19 0.00 0.00 0.00 0.00 51.96 53.03 2dbj s ALA 11 Cb 0.05 0.44 0.12 0.00 0.00 0.00 0.00 23.12 23.73 2dbj s ALA 11 CO 0.12 -0.73 1.02 -1.12 0.00 0.00 0.00 175.76 175.05 2dbj s SER 12 N -2.53 6.47 0.32 0.00 0.01 -1.26 -5.03 113.70 111.69 2dbj s SER 12 Ca 0.06 -1.74 -0.10 0.00 1.31 0.00 0.00 55.95 55.48 2dbj s SER 12 Cb -0.01 -2.38 -0.07 0.00 0.21 0.00 0.00 66.02 63.77 2dbj s SER 12 CO -0.08 -1.14 0.67 0.42 0.41 0.00 0.00 173.24 173.52 2dbj s THR 13 N 2.92 4.85 -0.02 1.44 -4.23 -1.26 -5.09 115.64 114.24 2dbj s THR 13 Ca 0.27 0.53 0.05 0.00 -1.18 0.00 0.00 61.69 61.37 2dbj s THR 13 Cb -0.10 -3.68 -0.01 0.00 1.34 0.00 0.00 72.50 70.04 2dbj s THR 13 CO -0.03 -0.31 -0.18 -0.89 -0.54 0.00 0.00 174.62 172.67 2dbj s THR 14 N -2.11 1.45 0.12 3.99 2.01 -1.26 -5.13 115.64 114.71 2dbj s THR 14 Ca 0.49 -0.78 -0.25 0.00 0.31 0.00 0.00 61.69 61.47 2dbj s THR 14 Cb -0.11 -1.21 0.08 0.00 0.01 0.00 0.00 72.50 71.28 2dbj s THR 14 CO 0.26 0.41 1.09 -1.83 -0.69 0.00 0.00 174.62 173.86 2dbj s GLU 15 N -0.37 1.02 -0.36 4.92 -1.05 -1.26 -5.13 118.70 116.47 2dbj s GLU 15 Ca 0.06 -0.62 -0.03 0.00 -0.15 0.00 0.00 54.97 54.23 2dbj s GLU 15 Cb -0.08 0.31 0.07 0.00 -0.44 0.00 0.00 34.13 34.00 2dbj s GLU 15 CO -0.00 -0.47 0.11 0.20 0.95 0.00 0.00 175.26 176.05 2dbj s GLY 16 N -3.24 1.88 0.20 -3.83 0.00 -1.26 -5.09 107.32 95.97 2dbj s GLY 16 Ca 0.19 -2.10 0.10 0.00 0.00 0.00 0.00 44.72 42.90 2dbj s GLY 16 CO 0.02 0.86 -0.15 0.00 0.00 0.00 0.00 173.10 173.84 2dbj s ALA 17 N 1.24 2.81 -0.93 3.20 0.00 -1.26 -4.49 121.76 122.33 2dbj s ALA 17 Ca 0.01 -1.57 -0.24 0.00 0.00 0.00 0.00 51.96 50.16 2dbj s ALA 17 Cb -0.21 -0.57 -0.05 0.00 0.00 0.00 0.00 23.12 22.29 2dbj s ALA 17 CO -0.02 0.43 1.95 -1.25 0.00 0.00 0.00 175.76 176.87 2dbj s PRO 18 N -2.87 2.55 0.00 0.00 0.04 -1.26 -4.82 135.00 128.63 2dbj s PRO 18 Ca 0.24 -0.37 -0.02 0.00 0.04 0.00 0.00 61.00 60.90 2dbj s PRO 18 Cb -0.08 -5.08 -0.10 0.00 0.04 0.00 0.00 34.50 29.28 2dbj s PRO 18 CO 0.14 -3.43 2.55 0.43 0.04 0.00 0.00 177.00 176.72 2dbj n SER 19 N 14.01 5.15 -3.64 6.66 7.64 -1.26 -3.93 113.62 138.26 2dbj n SER 19 Ca 0.41 -2.40 -0.15 0.00 1.01 0.00 0.00 58.87 57.73 2dbj n SER 19 Cb 0.47 -1.20 -0.08 0.00 -1.01 0.00 0.00 64.21 62.39 2dbj n SER 19 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2dbj s VAL 20 N 0.44 0.01 0.40 0.44 -7.23 -1.26 -4.96 120.40 108.23 2dbj s VAL 20 Ca 0.25 -0.09 0.08 0.00 -1.81 0.00 0.00 61.98 60.41 2dbj s VAL 20 Cb 0.12 -0.85 -0.01 0.00 0.56 0.00 0.00 36.38 36.20 2dbj s VAL 20 CO 0.00 -0.05 0.41 0.00 -0.31 0.00 0.00 175.10 175.15 2dbj s ALA 21 N -0.50 4.13 0.65 1.32 0.00 -1.26 -4.20 121.76 121.89 2dbj s ALA 21 Ca -0.06 -1.77 -0.15 0.00 0.00 0.00 0.00 51.96 49.97 2dbj s ALA 21 Cb -0.03 -1.22 -0.00 0.00 0.00 0.00 0.00 23.12 21.87 2dbj s ALA 21 CO 0.05 -0.18 1.11 -1.25 0.00 0.00 0.00 175.76 175.49 2dbj s PRO 22 N -4.15 2.84 0.34 0.00 0.04 -1.26 -4.67 135.00 128.14 2dbj s PRO 22 Ca 0.48 1.41 0.05 0.00 0.04 0.00 0.00 61.00 62.98 2dbj s PRO 22 Cb -0.06 -1.95 0.05 0.00 0.04 0.00 0.00 34.50 32.58 2dbj s PRO 22 CO 0.29 -1.22 0.43 1.28 0.04 0.00 0.00 177.00 177.82 2dbj n LEU 23 N -2.33 0.00 -3.31 -3.56 4.32 -1.18 -4.56 117.00 106.38 2dbj n LEU 23 Ca 0.10 -1.52 -0.21 0.00 -0.02 0.00 0.00 56.01 54.36 2dbj n LEU 23 Cb 0.52 -0.21 -0.02 0.00 -1.62 0.00 0.00 43.42 42.09 2dbj n LEU 23 CO 0.47 -0.59 -0.06 0.59 -1.22 0.00 0.00 177.39 176.58 2dbj n ASN 24 N -2.48 -2.92 -4.60 -1.43 5.03 -1.26 -0.78 115.26 106.83 2dbj n ASN 24 Ca 0.08 -0.31 -0.43 0.00 0.87 0.00 0.00 54.58 54.80 2dbj n ASN 24 Cb 0.36 -2.47 -0.03 0.00 -1.02 0.00 0.00 39.78 36.62 2dbj n ASN 24 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2dbj s VAL 25 N -2.78 3.49 0.06 2.41 1.01 -1.26 -4.06 120.40 119.27 2dbj s VAL 25 Ca 0.36 0.49 0.01 0.00 0.00 0.00 0.00 61.98 62.84 2dbj s VAL 25 Cb -0.20 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 2dbj s VAL 25 CO 0.44 -0.46 -0.06 0.42 0.00 0.00 0.00 175.10 175.44 2dbj s THR 26 N 6.97 0.49 -0.05 3.92 -4.23 -0.92 -5.05 115.64 116.77 2dbj s THR 26 Ca 0.78 -1.49 -0.02 0.00 -1.18 0.00 0.00 61.69 59.78 2dbj s THR 26 Cb -0.21 -1.11 0.04 0.00 1.34 0.00 0.00 72.50 72.56 2dbj s THR 26 CO 0.33 -0.68 0.10 -0.69 -0.54 0.00 0.00 174.62 173.14 2dbj s VAL 27 N -2.62 -0.08 0.14 2.29 1.01 -1.26 -2.67 120.40 117.20 2dbj s VAL 27 Ca -0.00 0.23 0.09 0.00 0.00 0.00 0.00 61.98 62.30 2dbj s VAL 27 Cb -0.01 -0.18 -0.04 0.00 0.00 0.00 0.00 36.38 36.14 2dbj s VAL 27 CO -0.03 0.10 -0.15 -0.36 0.00 0.00 0.00 175.10 174.65 2dbj s PHE 28 N 1.35 2.58 -0.09 5.22 0.40 -0.09 -4.96 117.98 122.38 2dbj s PHE 28 Ca -0.07 -0.24 0.01 0.00 -0.60 0.00 0.00 56.93 56.03 2dbj s PHE 28 Cb -0.12 -1.33 -0.02 0.00 0.51 0.00 0.00 43.02 42.05 2dbj s PHE 28 CO -0.05 0.43 -0.11 -1.17 0.70 0.00 0.00 175.22 175.02 2dbj s LEU 29 N -2.35 2.86 -0.34 -0.37 2.96 -1.26 -0.39 118.68 119.78 2dbj s LEU 29 Ca 0.20 -0.21 -0.12 0.00 -0.22 0.00 0.00 54.13 53.79 2dbj s LEU 29 Cb -0.10 -1.62 -0.01 0.00 0.50 0.00 0.00 46.19 44.96 2dbj s LEU 29 CO 0.12 0.27 0.21 0.20 -1.32 0.00 0.00 176.35 175.83 2dbj s ASN 30 N -0.24 5.87 0.11 3.68 -0.87 -0.79 -4.96 114.94 117.73 2dbj s ASN 30 Ca 0.02 -0.54 -0.10 0.00 -1.57 0.00 0.00 52.86 50.67 2dbj s ASN 30 Cb -0.13 -2.09 -0.15 0.00 -0.02 0.00 0.00 41.25 38.87 2dbj s ASN 30 CO 0.03 -0.25 1.28 -0.33 -2.57 0.00 0.00 177.10 175.26 2dbj h GLU 31 N 8.45 0.64 -0.22 -0.60 5.08 -1.99 -3.23 114.58 122.72 2dbj h GLU 31 Ca -0.31 -0.62 -0.11 0.00 -1.00 0.00 0.00 59.36 57.32 2dbj h GLU 31 Cb 1.15 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.54 2dbj h GLU 31 CO 0.64 1.22 -0.35 1.03 -1.00 0.00 0.00 179.01 180.55 2dbj h SER 32 N 0.40 0.48 -3.74 1.42 0.87 -1.99 -3.43 113.55 107.56 2dbj h SER 32 Ca -0.08 -0.19 -0.45 0.00 -1.23 0.00 0.00 61.79 59.83 2dbj h SER 32 Cb 1.54 -0.13 -0.31 0.00 -0.44 0.00 0.00 62.40 63.05 2dbj h SER 32 CO 0.17 0.80 -0.79 -0.44 -0.53 0.00 0.00 176.83 176.04 2dbj s SER 33 N -6.84 1.32 -1.05 6.23 0.01 -1.22 -5.06 113.70 107.09 2dbj s SER 33 Ca -0.07 -0.21 -0.23 0.00 1.31 0.00 0.00 55.95 56.76 2dbj s SER 33 Cb 0.13 -0.41 -0.12 0.00 0.21 0.00 0.00 66.02 65.82 2dbj s SER 33 CO 0.80 0.06 1.93 0.47 0.41 0.00 0.00 173.24 176.91 2dbj n ASP 34 N 3.41 2.77 -3.75 2.44 9.92 -1.26 -4.15 116.55 125.93 2dbj n ASP 34 Ca -0.19 -2.67 -0.13 0.00 -0.53 0.00 0.00 54.79 51.26 2dbj n ASP 34 Cb 0.53 -1.57 -0.10 0.00 -0.64 0.00 0.00 41.12 39.35 2dbj n ASP 34 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2dbj s ASN 35 N 6.33 -0.31 -0.34 -2.24 2.20 -1.26 -2.91 114.94 116.42 2dbj s ASN 35 Ca 0.67 0.46 -0.04 0.00 -0.94 0.00 0.00 52.86 53.01 2dbj s ASN 35 Cb 0.03 0.56 0.06 0.00 -2.00 0.00 0.00 41.25 39.89 2dbj s ASN 35 CO 0.14 -0.27 0.08 -0.69 -2.94 0.00 0.00 177.10 173.42 2dbj s VAL 36 N -0.47 3.37 0.28 3.54 1.01 -0.59 -1.89 120.40 125.64 2dbj s VAL 36 Ca -0.06 -1.40 -0.29 0.00 0.00 0.00 0.00 61.98 60.23 2dbj s VAL 36 Cb -0.04 -2.99 -0.10 0.00 0.00 0.00 0.00 36.38 33.26 2dbj s VAL 36 CO 0.02 -0.24 1.27 -0.62 0.00 0.00 0.00 175.10 175.53 2dbj s ASP 37 N 1.44 6.91 -0.04 3.32 2.15 0.48 -3.38 116.67 127.55 2dbj s ASP 37 Ca -0.02 2.52 0.01 0.00 0.43 0.00 0.00 52.55 55.49 2dbj s ASP 37 Cb -0.20 -2.63 0.03 0.00 -0.30 0.00 0.00 42.92 39.81 2dbj s ASP 37 CO -0.00 -0.45 -0.01 -0.63 -0.17 0.00 0.00 175.17 173.91 2dbj s ILE 38 N -0.77 0.30 -0.00 4.11 1.01 -0.81 -0.91 121.20 124.13 2dbj s ILE 38 Ca 0.50 0.02 -0.00 0.00 0.00 0.00 0.00 60.65 61.17 2dbj s ILE 38 Cb -0.37 -0.37 0.01 0.00 0.01 0.00 0.00 42.46 41.73 2dbj s ILE 38 CO 0.46 0.17 0.01 -0.60 0.00 0.00 0.00 174.94 174.98 2dbj s ARG 39 N 1.01 -0.01 0.20 2.79 3.00 -1.09 -2.91 118.95 121.95 2dbj s ARG 39 Ca -0.10 0.04 0.03 0.00 -1.00 0.00 0.00 55.73 54.70 2dbj s ARG 39 Cb -0.14 -0.05 -0.01 0.00 0.00 0.00 0.00 34.95 34.76 2dbj s ARG 39 CO -0.01 -0.03 0.21 -2.67 0.00 0.00 0.00 175.30 172.79 2dbj n TRP 40 N 3.29 -0.66 -4.36 5.12 2.14 -1.26 -2.17 117.44 119.54 2dbj n TRP 40 Ca -0.15 -1.58 -0.18 0.00 2.07 0.00 0.00 57.50 57.65 2dbj n TRP 40 Cb 0.58 0.22 -0.10 0.00 -0.81 0.00 0.00 31.31 31.20 2dbj n TRP 40 CO 0.00 0.00 0.00 -1.64 2.07 0.00 0.00 177.69 178.12 2dbj s MET 41 N -2.70 1.39 0.08 -2.67 -1.94 0.04 -4.93 119.30 108.58 2dbj s MET 41 Ca 0.22 -1.69 -0.30 0.00 -1.71 0.00 0.00 55.69 52.20 2dbj s MET 41 Cb 0.01 -0.82 -0.05 0.00 2.01 0.00 0.00 34.83 35.97 2dbj s MET 41 CO 0.15 -0.03 0.99 0.15 -0.01 0.00 0.00 175.02 176.27 2dbj s LYS 42 N -3.80 4.64 0.95 2.03 3.01 -1.26 -3.08 119.74 122.22 2dbj s LYS 42 Ca 0.28 1.47 -0.12 0.00 -1.01 0.00 0.00 55.97 56.59 2dbj s LYS 42 Cb 0.05 -3.39 0.16 0.00 -1.01 0.00 0.00 37.83 33.63 2dbj s LYS 42 CO 0.09 0.11 1.09 -1.25 0.51 0.00 0.00 175.35 175.90 2dbj s PRO 43 N 0.33 0.86 0.00 -1.68 0.04 -1.26 -4.75 135.00 128.53 2dbj s PRO 43 Ca 0.49 0.67 0.09 0.00 0.04 0.00 0.00 61.00 62.29 2dbj s PRO 43 Cb -0.23 -1.77 0.52 0.00 0.04 0.00 0.00 34.50 33.05 2dbj s PRO 43 CO 0.30 -2.48 0.96 -0.35 0.04 0.00 0.00 177.00 175.47 2dbj n PRO 44 N -4.02 0.49 -1.09 0.56 -0.04 -1.26 -4.89 135.00 124.75 2dbj n PRO 44 Ca 0.06 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.13 2dbj n PRO 44 Cb 0.56 -1.28 -0.04 0.00 -0.04 0.00 0.00 33.50 32.71 2dbj n PRO 44 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2dbj n THR 45 N -0.78 0.99 -4.24 0.52 -2.24 -1.26 -4.94 114.28 102.33 2dbj n THR 45 Ca 0.07 -0.25 -0.29 0.00 -2.27 0.00 0.00 64.05 61.31 2dbj n THR 45 Cb 0.03 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.16 2dbj n THR 45 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2dbj s LYS 46 N -0.49 2.10 0.38 -0.78 2.47 -1.26 -5.01 119.74 117.15 2dbj s LYS 46 Ca 0.56 -1.07 0.18 0.00 -1.56 0.00 0.00 55.97 54.08 2dbj s LYS 46 Cb -0.80 -2.28 1.13 0.00 -1.46 0.00 0.00 37.83 34.43 2dbj s LYS 46 CO 0.43 0.50 1.70 -0.56 0.16 0.00 0.00 175.35 177.57 2dbj h GLN 47 N 3.50 0.33 -0.40 4.03 3.07 -1.93 0.89 115.11 124.60 2dbj h GLN 47 Ca -0.49 -0.02 0.01 0.00 0.09 0.00 0.00 58.65 58.25 2dbj h GLN 47 Cb 1.17 -0.07 -0.02 0.00 0.08 0.00 0.00 27.48 28.64 2dbj h GLN 47 CO 0.52 0.22 0.26 -0.56 0.09 0.00 0.00 178.83 179.36 2dbj h GLN 48 N 0.34 0.47 0.00 0.06 3.07 -2.01 -1.22 115.11 115.82 2dbj h GLN 48 Ca 0.69 -0.03 -0.02 0.00 0.09 0.00 0.00 58.65 59.39 2dbj h GLN 48 Cb 1.74 -0.11 -0.00 0.00 0.08 0.00 0.00 27.48 29.19 2dbj h GLN 48 CO -0.44 0.31 -0.73 -0.44 0.09 0.00 0.00 178.83 177.62 2dbj h ASP 49 N 0.49 0.00 -4.69 0.06 3.32 0.34 -3.50 116.42 112.43 2dbj h ASP 49 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 2dbj h ASP 49 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 2dbj h ASP 49 CO -0.03 0.07 0.00 0.61 -1.72 0.00 0.00 179.24 178.16 2dbj n GLY 50 N 1.18 3.70 3.68 2.75 0.00 -0.31 -4.72 105.19 111.46 2dbj n GLY 50 Ca 0.00 -1.71 -0.38 0.00 0.00 0.00 0.00 46.02 43.93 2dbj n GLY 50 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2dbj s GLU 51 N -3.47 4.20 0.15 1.61 -1.05 -1.26 -4.40 118.70 114.47 2dbj s GLU 51 Ca 0.00 0.27 -0.34 0.00 -0.15 0.00 0.00 54.97 54.75 2dbj s GLU 51 Cb 0.00 -3.52 -0.14 0.00 -0.44 0.00 0.00 34.13 30.03 2dbj s GLU 51 CO 0.00 -0.02 1.61 -0.11 0.95 0.00 0.00 175.26 177.69 2dbj n LEU 52 N 4.37 3.17 -0.24 1.83 0.00 -1.26 -3.69 117.00 121.18 2dbj n LEU 52 Ca -0.08 1.07 0.04 0.00 0.00 0.00 0.00 56.01 57.04 2dbj n LEU 52 Cb 0.51 -1.43 0.02 0.00 0.00 0.00 0.00 43.42 42.51 2dbj n LEU 52 CO 0.41 -0.24 0.28 1.33 0.00 0.00 0.00 177.39 179.16 2dbj n VAL 53 N 3.58 0.00 -2.74 1.96 0.24 0.31 -4.88 118.33 116.79 2dbj n VAL 53 Ca 0.17 -0.46 0.00 0.00 -2.04 0.00 0.00 64.34 62.01 2dbj n VAL 53 Cb 0.29 1.12 0.00 0.00 -1.47 0.00 0.00 33.84 33.79 2dbj n VAL 53 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dbj n GLY 54 N 0.61 -1.88 3.49 7.63 0.00 -1.04 -1.76 105.19 112.24 2dbj n GLY 54 Ca 0.04 -1.26 -0.24 0.00 0.00 0.00 0.00 46.02 44.56 2dbj n GLY 54 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dbj s TYR 55 N -2.69 1.84 -0.23 1.61 1.51 -0.08 0.17 117.35 119.49 2dbj s TYR 55 Ca 0.00 -1.15 -0.03 0.00 -1.01 0.00 0.00 57.07 54.88 2dbj s TYR 55 Cb 0.00 -1.21 0.08 0.00 -0.11 0.00 0.00 41.96 40.72 2dbj s TYR 55 CO 0.00 -0.17 0.08 1.03 -1.11 0.00 0.00 175.55 175.38 2dbj s ARG 56 N -3.80 0.39 0.02 -0.62 1.81 0.94 -3.55 118.95 114.13 2dbj s ARG 56 Ca 0.28 -0.45 -0.16 0.00 -1.72 0.00 0.00 55.73 53.69 2dbj s ARG 56 Cb 0.05 -1.79 -0.06 0.00 -0.45 0.00 0.00 34.95 32.70 2dbj s ARG 56 CO 0.14 -0.79 0.45 0.42 -0.68 0.00 0.00 175.30 174.84 2dbj s ILE 57 N 1.96 4.96 -0.33 1.52 1.01 -1.24 -0.98 121.20 128.09 2dbj s ILE 57 Ca 0.04 0.93 0.00 0.00 0.00 0.00 0.00 60.65 61.63 2dbj s ILE 57 Cb -0.17 -3.76 0.10 0.00 0.01 0.00 0.00 42.46 38.65 2dbj s ILE 57 CO -0.18 0.57 0.10 -0.94 0.00 0.00 0.00 174.94 174.49 2dbj s SER 58 N -1.07 4.16 -0.22 3.58 1.04 0.90 -2.63 113.70 119.47 2dbj s SER 58 Ca 0.25 -1.84 -0.05 0.00 0.48 0.00 0.00 55.95 54.79 2dbj s SER 58 Cb -0.17 -1.05 -0.02 0.00 0.10 0.00 0.00 66.02 64.88 2dbj s SER 58 CO 0.15 -0.40 -0.01 -1.38 0.98 0.00 0.00 173.24 172.58 2dbj s HIS 59 N 1.35 3.00 0.11 5.02 -3.43 -1.24 -2.67 115.29 117.43 2dbj s HIS 59 Ca 0.11 -0.73 0.10 0.00 -0.80 0.00 0.00 55.06 53.75 2dbj s HIS 59 Cb -0.18 -2.14 -0.04 0.00 -1.43 0.00 0.00 32.58 28.80 2dbj s HIS 59 CO -0.19 -0.45 -0.26 0.08 -2.00 0.00 0.00 174.74 171.91 2dbj s VAL 60 N 1.44 2.19 -0.15 -5.38 1.01 -1.11 -3.03 120.40 115.38 2dbj s VAL 60 Ca 0.05 -1.67 0.01 0.00 0.00 0.00 0.00 61.98 60.37 2dbj s VAL 60 Cb -0.15 -1.93 0.00 0.00 0.00 0.00 0.00 36.38 34.31 2dbj s VAL 60 CO -0.01 0.13 -0.18 0.26 0.00 0.00 0.00 175.10 175.30 2dbj s TRP 61 N -1.02 2.72 -0.25 5.22 0.52 -1.11 -1.75 118.94 123.27 2dbj s TRP 61 Ca 0.13 -1.17 0.01 0.00 0.02 0.00 0.00 56.10 55.09 2dbj s TRP 61 Cb -0.10 -1.85 0.07 0.00 -1.15 0.00 0.00 33.47 30.44 2dbj s TRP 61 CO 0.05 -0.53 -0.02 -0.65 0.02 0.00 0.00 176.95 175.83 2dbj s GLN 62 N 0.79 1.42 0.28 4.98 -0.21 -0.15 -1.58 119.66 125.19 2dbj s GLN 62 Ca -0.07 -1.06 0.10 0.00 0.02 0.00 0.00 55.36 54.36 2dbj s GLN 62 Cb -0.16 -2.54 -0.05 0.00 1.00 0.00 0.00 33.01 31.26 2dbj s GLN 62 CO -0.00 -0.69 -0.08 0.45 -2.12 0.00 0.00 175.29 172.84 2dbj s SER 63 N 1.40 4.08 -0.53 5.90 0.15 0.18 -1.96 113.70 122.92 2dbj s SER 63 Ca -0.02 -0.86 -0.26 0.00 0.70 0.00 0.00 55.95 55.50 2dbj s SER 63 Cb -0.19 -0.57 -0.04 0.00 -1.71 0.00 0.00 66.02 63.52 2dbj s SER 63 CO -0.09 -0.02 2.09 0.00 1.20 0.00 0.00 173.24 176.42 2dbj s ALA 64 N -2.43 2.02 0.00 5.45 0.00 -1.26 -1.60 121.76 123.93 2dbj s ALA 64 Ca 0.31 -0.27 0.00 0.00 0.00 0.00 0.00 51.96 52.01 2dbj s ALA 64 Cb -0.05 -4.29 0.00 0.00 0.00 0.00 0.00 23.12 18.78 2dbj s ALA 64 CO 0.18 -4.00 0.00 0.41 0.00 0.00 0.00 175.76 172.35 2dbj n GLY 65 N 5.80 2.27 2.75 0.00 0.00 -1.26 -5.03 105.19 109.72 2dbj n GLY 65 Ca 0.27 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.06 2dbj n GLY 65 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dbj s ILE 66 N -2.60 0.36 -0.18 -0.61 -1.09 -0.63 -5.12 121.20 111.34 2dbj s ILE 66 Ca 0.00 0.01 -0.01 0.00 -2.23 0.00 0.00 60.65 58.42 2dbj s ILE 66 Cb 0.00 -0.60 0.05 0.00 -1.58 0.00 0.00 42.46 40.33 2dbj s ILE 66 CO 0.00 0.15 -0.03 -0.94 -1.23 0.00 0.00 174.94 172.89 2dbj s SER 67 N 1.97 2.92 0.36 3.58 1.04 -1.26 0.48 113.70 122.78 2dbj s SER 67 Ca 0.04 -0.73 0.09 0.00 0.48 0.00 0.00 55.95 55.82 2dbj s SER 67 Cb -0.13 -0.86 -0.07 0.00 0.10 0.00 0.00 66.02 65.06 2dbj s SER 67 CO -0.06 -0.22 -0.06 -0.54 0.98 0.00 0.00 173.24 173.35 2dbj s LYS 68 N 1.66 1.87 -0.01 4.02 1.02 -0.61 -5.02 119.74 122.66 2dbj s LYS 68 Ca -0.00 -1.99 0.02 0.00 0.02 0.00 0.00 55.97 54.02 2dbj s LYS 68 Cb -0.16 -1.69 -0.00 0.00 -0.52 0.00 0.00 37.83 35.46 2dbj s LYS 68 CO -0.07 0.08 -0.07 -2.00 -0.92 0.00 0.00 175.35 172.37 2dbj s GLU 69 N -3.64 0.65 0.07 1.68 2.12 -1.26 -2.76 118.70 115.56 2dbj s GLU 69 Ca 0.33 -0.25 0.01 0.00 0.36 0.00 0.00 54.97 55.42 2dbj s GLU 69 Cb 0.05 -0.63 -0.04 0.00 0.26 0.00 0.00 34.13 33.76 2dbj s GLU 69 CO 0.17 0.13 -0.05 -0.51 -0.54 0.00 0.00 175.26 174.46 2dbj s LEU 70 N -0.04 2.47 -0.07 2.70 1.43 -1.17 -5.00 118.68 119.00 2dbj s LEU 70 Ca 0.01 -0.94 -0.03 0.00 -1.03 0.00 0.00 54.13 52.14 2dbj s LEU 70 Cb -0.04 0.03 0.04 0.00 0.03 0.00 0.00 46.19 46.25 2dbj s LEU 70 CO -0.00 -0.49 0.14 -0.22 0.23 0.00 0.00 176.35 176.00 2dbj s LEU 71 N -2.81 0.32 0.28 1.79 1.98 -1.26 -3.65 118.68 115.33 2dbj s LEU 71 Ca 0.07 0.28 0.06 0.00 -2.89 0.00 0.00 54.13 51.65 2dbj s LEU 71 Cb 0.04 0.24 -0.02 0.00 0.66 0.00 0.00 46.19 47.11 2dbj s LEU 71 CO -0.06 -0.20 0.35 -0.70 -1.89 0.00 0.00 176.35 173.85 2dbj s GLU 72 N 1.78 3.15 -0.04 1.98 2.56 -1.08 -5.02 118.70 122.04 2dbj s GLU 72 Ca -0.02 -0.96 0.03 0.00 0.00 0.00 0.00 54.97 54.01 2dbj s GLU 72 Cb -0.12 -2.75 0.01 0.00 2.00 0.00 0.00 34.13 33.26 2dbj s GLU 72 CO -0.05 0.27 -0.11 -1.21 -0.56 0.00 0.00 175.26 173.60 2dbj s GLU 73 N -4.01 1.31 -0.00 4.30 2.02 -1.26 -3.67 118.70 117.38 2dbj s GLU 73 Ca 0.38 -0.38 -0.00 0.00 0.02 0.00 0.00 54.97 54.99 2dbj s GLU 73 Cb -0.08 -1.16 0.00 0.00 0.10 0.00 0.00 34.13 32.99 2dbj s GLU 73 CO 0.29 0.10 0.01 0.14 0.02 0.00 0.00 175.26 175.81 2dbj s VAL 74 N 0.35 -0.01 0.64 2.63 -7.23 -1.23 -5.00 120.40 110.54 2dbj s VAL 74 Ca -0.07 0.03 -0.04 0.00 -1.81 0.00 0.00 61.98 60.10 2dbj s VAL 74 Cb -0.12 -0.02 0.13 0.00 0.56 0.00 0.00 36.38 36.93 2dbj s VAL 74 CO 0.02 0.01 0.87 0.61 -0.31 0.00 0.00 175.10 176.30 2dbj n GLY 75 N 3.24 0.12 0.28 2.32 0.00 -1.26 -0.90 105.19 108.99 2dbj n GLY 75 Ca -0.14 -1.93 -0.04 0.00 0.00 0.00 0.00 46.02 43.91 2dbj n GLY 75 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2dbj h GLN 76 N 0.00 0.71 -3.07 1.61 -0.00 -1.63 -3.26 115.11 109.47 2dbj h GLN 76 Ca -0.29 -0.19 -0.74 0.00 -0.00 0.00 0.00 58.65 57.42 2dbj h GLN 76 Cb 0.97 -0.08 -0.13 0.00 -0.00 0.00 0.00 27.48 28.24 2dbj h GLN 76 CO 0.27 0.75 2.32 0.09 -0.00 0.00 0.00 178.83 182.26 2dbj n ASN 77 N -4.21 6.63 0.02 0.06 5.03 -1.26 -4.22 115.26 117.31 2dbj n ASN 77 Ca 0.02 -3.10 0.00 0.00 0.87 0.00 0.00 54.58 52.37 2dbj n ASN 77 Cb 0.31 -1.43 0.00 0.00 -1.02 0.00 0.00 39.78 37.64 2dbj n ASN 77 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2dbj n GLY 78 N 2.35 -0.14 1.97 7.41 0.00 -1.23 -4.99 105.19 110.55 2dbj n GLY 78 Ca 0.52 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.56 2dbj n GLY 78 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dbj n SER 79 N -2.63 -0.69 -3.64 1.61 2.88 -1.26 -4.76 113.62 105.13 2dbj n SER 79 Ca 0.00 0.35 -0.07 0.00 -1.33 0.00 0.00 58.87 57.82 2dbj n SER 79 Cb 0.00 -0.79 -0.07 0.00 -0.75 0.00 0.00 64.21 62.60 2dbj n SER 79 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 2dbj s ARG 80 N -3.85 0.46 -0.03 -1.46 3.52 -1.26 -4.60 118.95 111.73 2dbj s ARG 80 Ca 0.00 0.61 -0.06 0.00 -0.13 0.00 0.00 55.73 56.14 2dbj s ARG 80 Cb 0.00 0.19 0.01 0.00 -1.56 0.00 0.00 34.95 33.59 2dbj s ARG 80 CO 0.00 -0.07 0.15 0.00 -0.81 0.00 0.00 175.30 174.57 2dbj s ALA 81 N 0.54 -0.36 -0.02 6.12 0.00 -1.15 -5.03 121.76 121.87 2dbj s ALA 81 Ca -0.00 0.18 0.01 0.00 0.00 0.00 0.00 51.96 52.15 2dbj s ALA 81 Cb -0.05 -0.10 0.01 0.00 0.00 0.00 0.00 23.12 22.99 2dbj s ALA 81 CO -0.09 -0.13 -0.02 0.50 0.00 0.00 0.00 175.76 176.02 2dbj s ARG 82 N -0.57 0.29 -0.04 0.00 3.52 -1.26 -1.92 118.95 118.98 2dbj s ARG 82 Ca -0.07 -0.02 0.07 0.00 -0.13 0.00 0.00 55.73 55.59 2dbj s ARG 82 Cb -0.04 -0.38 -0.01 0.00 -1.56 0.00 0.00 34.95 32.96 2dbj s ARG 82 CO 0.01 -0.04 -0.24 0.42 -0.81 0.00 0.00 175.30 174.64 2dbj s ILE 83 N 0.51 1.93 -0.41 4.11 1.01 -1.22 -4.91 121.20 122.22 2dbj s ILE 83 Ca -0.05 -1.02 -0.24 0.00 0.00 0.00 0.00 60.65 59.34 2dbj s ILE 83 Cb -0.08 -1.62 0.02 0.00 0.01 0.00 0.00 42.46 40.79 2dbj s ILE 83 CO -0.01 0.54 0.84 -0.44 0.00 0.00 0.00 174.94 175.88 2dbj s SER 84 N -0.36 6.53 -0.35 3.58 0.01 -1.26 -1.55 113.70 120.31 2dbj s SER 84 Ca 0.03 0.25 -0.32 0.00 1.31 0.00 0.00 55.95 57.22 2dbj s SER 84 Cb -0.11 -2.42 -0.14 0.00 0.21 0.00 0.00 66.02 63.56 2dbj s SER 84 CO 0.01 -0.87 1.33 0.52 0.41 0.00 0.00 173.24 174.65 2dbj n VAL 85 N 6.05 0.00 -0.04 3.43 0.31 -1.14 -4.80 118.33 122.13 2dbj n VAL 85 Ca 0.04 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.32 2dbj n VAL 85 Cb 0.48 -0.35 -0.14 0.00 -0.91 0.00 0.00 33.84 32.93 2dbj n VAL 85 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dbj n GLN 86 N 4.17 0.65 -3.87 5.55 1.13 -1.26 -4.93 117.38 118.83 2dbj n GLN 86 Ca 0.31 0.13 -0.13 0.00 -1.94 0.00 0.00 57.00 55.36 2dbj n GLN 86 Cb -0.03 -1.67 -0.15 0.00 0.11 0.00 0.00 30.24 28.50 2dbj n GLN 86 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2dbj s VAL 87 N -2.70 0.02 0.06 5.09 1.01 -1.26 -5.16 120.40 117.46 2dbj s VAL 87 Ca -0.07 0.05 0.02 0.00 0.00 0.00 0.00 61.98 61.98 2dbj s VAL 87 Cb 0.08 -0.07 -0.04 0.00 0.00 0.00 0.00 36.38 36.35 2dbj s VAL 87 CO 0.83 0.04 0.11 -1.00 0.00 0.00 0.00 175.10 175.09 2dbj s HIS 88 N 0.36 3.29 -1.04 5.22 3.76 -1.26 -4.56 115.29 121.07 2dbj s HIS 88 Ca -0.03 0.14 -0.00 0.00 -0.15 0.00 0.00 55.06 55.02 2dbj s HIS 88 Cb -0.05 -1.67 -0.00 0.00 1.11 0.00 0.00 32.58 31.97 2dbj s HIS 88 CO -0.01 0.55 0.86 -1.71 -0.85 0.00 0.00 174.74 173.58 2dbj n ASN 89 N 0.51 -2.05 -3.97 1.40 2.85 -0.35 -4.86 115.26 108.79 2dbj n ASN 89 Ca -0.08 -0.54 -0.10 0.00 -0.11 0.00 0.00 54.58 53.76 2dbj n ASN 89 Cb 0.52 -4.50 -0.07 0.00 1.24 0.00 0.00 39.78 36.96 2dbj n ASN 89 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2dbj s ALA 90 N -3.31 0.04 -0.27 5.20 0.00 -1.21 -4.79 121.76 117.42 2dbj s ALA 90 Ca 0.00 -0.92 -0.14 0.00 0.00 0.00 0.00 51.96 50.90 2dbj s ALA 90 Cb -0.00 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.95 2dbj s ALA 90 CO 0.63 -0.64 0.33 0.95 0.00 0.00 0.00 175.76 177.03 2dbj s THR 91 N -3.97 5.20 0.04 0.00 -4.23 -0.83 -1.77 115.64 110.08 2dbj s THR 91 Ca 0.18 0.49 0.05 0.00 -1.18 0.00 0.00 61.69 61.22 2dbj s THR 91 Cb 0.03 -3.66 -0.04 0.00 1.34 0.00 0.00 72.50 70.18 2dbj s THR 91 CO 0.00 0.18 -0.08 0.00 -0.54 0.00 0.00 174.62 174.18 2dbj s THR 93 N -1.06 2.26 0.00 0.00 2.01 -0.72 -1.03 115.64 117.10 2dbj s THR 93 Ca 0.18 -1.23 -0.10 0.00 0.31 0.00 0.00 61.69 60.86 2dbj s THR 93 Cb -0.11 -2.14 -0.05 0.00 0.01 0.00 0.00 72.50 70.21 2dbj s THR 93 CO 0.09 0.26 0.33 -0.69 -0.69 0.00 0.00 174.62 173.92 2dbj s VAL 94 N 1.22 5.19 -0.13 3.82 1.01 -0.85 -2.73 120.40 127.92 2dbj s VAL 94 Ca -0.01 0.48 -0.23 0.00 0.00 0.00 0.00 61.98 62.22 2dbj s VAL 94 Cb -0.16 -3.61 0.06 0.00 0.00 0.00 0.00 36.38 32.66 2dbj s VAL 94 CO -0.08 0.46 0.57 -0.13 0.00 0.00 0.00 175.10 175.92 2dbj s ARG 95 N -1.45 0.80 0.03 2.72 0.52 -1.09 -2.63 118.95 117.84 2dbj s ARG 95 Ca 0.26 0.48 0.03 0.00 -0.52 0.00 0.00 55.73 55.98 2dbj s ARG 95 Cb -0.14 0.38 -0.02 0.00 0.52 0.00 0.00 34.95 35.69 2dbj s ARG 95 CO 0.14 -0.17 -0.11 0.42 0.02 0.00 0.00 175.30 175.60 2dbj s ILE 96 N -0.42 0.81 0.04 1.52 1.01 -1.26 -0.07 121.20 122.84 2dbj s ILE 96 Ca -0.06 -0.82 0.03 0.00 0.00 0.00 0.00 60.65 59.80 2dbj s ILE 96 Cb -0.03 -0.76 -0.02 0.00 0.01 0.00 0.00 42.46 41.66 2dbj s ILE 96 CO 0.04 -0.05 -0.08 0.00 0.00 0.00 0.00 174.94 174.85 2dbj s ALA 97 N -0.78 0.65 0.05 9.38 0.00 -0.15 -0.29 121.76 130.61 2dbj s ALA 97 Ca -0.01 -0.72 -0.28 0.00 0.00 0.00 0.00 51.96 50.95 2dbj s ALA 97 Cb -0.07 -0.00 -0.05 0.00 0.00 0.00 0.00 23.12 23.00 2dbj s ALA 97 CO 0.01 0.03 0.88 0.00 0.00 0.00 0.00 175.76 176.67 2dbj s ALA 98 N -1.18 3.28 -0.11 0.00 0.00 -1.26 -0.04 121.76 122.45 2dbj s ALA 98 Ca -0.07 0.43 0.01 0.00 0.00 0.00 0.00 51.96 52.33 2dbj s ALA 98 Cb -0.09 -3.17 -0.02 0.00 0.00 0.00 0.00 23.12 19.85 2dbj s ALA 98 CO 0.01 -0.04 -0.14 0.08 0.00 0.00 0.00 175.76 175.66 2dbj s VAL 99 N 0.23 2.94 0.27 0.00 1.01 0.13 -2.64 120.40 122.34 2dbj s VAL 99 Ca 0.44 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.71 2dbj s VAL 99 Cb -0.21 -2.21 0.00 0.00 0.00 0.00 0.00 36.38 33.96 2dbj s VAL 99 CO 0.26 0.54 0.02 0.35 0.00 0.00 0.00 175.10 176.27 2dbj n THR 100 N 3.33 0.00 0.97 3.92 -2.24 -1.16 -0.53 114.28 118.57 2dbj n THR 100 Ca -0.18 -1.24 0.01 0.00 -2.27 0.00 0.00 64.05 60.37 2dbj n THR 100 Cb 0.53 0.20 0.05 0.00 -2.10 0.00 0.00 70.33 69.01 2dbj n THR 100 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2dbj n ARG 101 N -0.71 1.41 0.01 -0.78 1.74 -1.24 -3.90 116.66 113.18 2dbj n ARG 101 Ca -0.10 -0.36 0.00 0.00 -0.77 0.00 0.00 57.85 56.62 2dbj n ARG 101 Cb 0.33 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.29 2dbj n ARG 101 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dbj n GLY 102 N 0.19 -0.01 3.80 -0.13 0.00 -1.26 -5.09 105.19 102.69 2dbj n GLY 102 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 2dbj n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dbj n GLY 103 N 2.75 0.56 3.71 -0.02 0.00 -1.25 -5.00 105.19 105.93 2dbj n GLY 103 Ca 0.00 -1.13 -0.37 0.00 0.00 0.00 0.00 46.02 44.52 2dbj n GLY 103 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dbj s VAL 104 N -2.06 5.29 0.74 1.61 0.11 -1.26 -2.97 120.40 121.85 2dbj s VAL 104 Ca 0.23 0.55 -0.04 0.00 -2.93 0.00 0.00 61.98 59.79 2dbj s VAL 104 Cb -0.03 -3.64 0.15 0.00 -1.53 0.00 0.00 36.38 31.34 2dbj s VAL 104 CO 0.05 0.35 1.01 0.61 -3.33 0.00 0.00 175.10 173.79 2dbj n GLY 105 N 3.62 0.17 3.77 6.54 0.00 -1.08 -4.83 105.19 113.38 2dbj n GLY 105 Ca -0.11 -1.95 -0.36 0.00 0.00 0.00 0.00 46.02 43.59 2dbj n GLY 105 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dbj s PRO 106 N -5.13 3.56 0.65 1.61 0.04 -1.25 -4.67 135.00 129.81 2dbj s PRO 106 Ca 0.64 1.70 -0.09 0.00 0.04 0.00 0.00 61.00 63.29 2dbj s PRO 106 Cb -0.03 -2.21 0.01 0.00 0.04 0.00 0.00 34.50 32.30 2dbj s PRO 106 CO 0.43 -0.70 1.01 -0.06 0.04 0.00 0.00 177.00 177.73 2dbj s PHE 107 N -1.65 3.33 0.69 0.56 0.40 -1.26 -4.22 117.98 115.83 2dbj s PHE 107 Ca 0.68 0.92 -0.12 0.00 -0.60 0.00 0.00 56.93 57.81 2dbj s PHE 107 Cb -0.26 -2.89 0.17 0.00 0.51 0.00 0.00 43.02 40.54 2dbj s PHE 107 CO 0.31 -0.98 0.71 -1.13 0.70 0.00 0.00 175.22 174.83 2dbj n SER 108 N -2.81 -1.08 -4.77 1.36 3.41 0.60 -4.88 113.62 105.46 2dbj n SER 108 Ca 0.06 -1.04 -0.41 0.00 -0.26 0.00 0.00 58.87 57.22 2dbj n SER 108 Cb 0.57 -0.61 -0.01 0.00 -0.26 0.00 0.00 64.21 63.90 2dbj n SER 108 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2dbj s ASP 109 N -3.52 6.47 0.09 4.04 2.15 -1.26 -4.73 116.67 119.91 2dbj s ASP 109 Ca 0.44 2.92 -0.31 0.00 0.43 0.00 0.00 52.55 56.03 2dbj s ASP 109 Cb -0.03 -2.65 -0.07 0.00 -0.30 0.00 0.00 42.92 39.86 2dbj s ASP 109 CO 0.33 -0.79 1.37 -2.16 -0.17 0.00 0.00 175.17 173.75 2dbj s PRO 110 N -1.56 4.33 -0.27 4.34 0.04 -1.26 -4.79 135.00 135.82 2dbj s PRO 110 Ca 0.55 2.03 -0.04 0.00 0.04 0.00 0.00 61.00 63.58 2dbj s PRO 110 Cb -0.45 -3.31 0.02 0.00 0.04 0.00 0.00 34.50 30.81 2dbj s PRO 110 CO 0.56 -0.44 0.00 0.54 0.04 0.00 0.00 177.00 177.70 2dbj s VAL 111 N 1.30 3.30 -0.48 -0.36 0.11 -1.08 -4.96 120.40 118.23 2dbj s VAL 111 Ca 0.64 -0.96 -0.22 0.00 -2.93 0.00 0.00 61.98 58.51 2dbj s VAL 111 Cb -0.35 -2.72 0.03 0.00 -1.53 0.00 0.00 36.38 31.81 2dbj s VAL 111 CO 0.30 0.11 0.77 -0.75 -3.33 0.00 0.00 175.10 172.19 2dbj s LYS 112 N 1.38 3.32 -0.12 1.54 2.20 -1.26 -2.01 119.74 124.78 2dbj s LYS 112 Ca 0.00 -0.32 -0.03 0.00 -0.36 0.00 0.00 55.97 55.26 2dbj s LYS 112 Cb -0.17 -3.99 -0.03 0.00 -1.51 0.00 0.00 37.83 32.12 2dbj s LYS 112 CO -0.01 -1.21 0.00 -1.50 -0.36 0.00 0.00 175.35 172.28 2dbj s ILE 113 N 3.26 4.31 -0.29 5.43 2.07 -0.20 -4.95 121.20 130.83 2dbj s ILE 113 Ca 0.26 -0.23 -0.23 0.00 -1.41 0.00 0.00 60.65 59.04 2dbj s ILE 113 Cb -0.14 -2.86 -0.00 0.00 0.13 0.00 0.00 42.46 39.59 2dbj s ILE 113 CO 0.19 0.55 0.76 0.12 -1.91 0.00 0.00 174.94 174.66 2dbj s PHE 114 N -0.32 3.23 -0.38 3.50 2.19 -1.26 -2.16 117.98 122.77 2dbj s PHE 114 Ca 0.07 0.85 -0.24 0.00 0.33 0.00 0.00 56.93 57.93 2dbj s PHE 114 Cb -0.12 -3.13 0.01 0.00 -1.31 0.00 0.00 43.02 38.47 2dbj s PHE 114 CO 0.02 -0.51 0.84 0.42 1.83 0.00 0.00 175.22 177.83 2dbj s ILE 115 N 2.86 4.65 0.07 3.12 -1.09 -0.73 -5.00 121.20 125.08 2dbj s ILE 115 Ca 0.31 0.92 -0.31 0.00 -2.23 0.00 0.00 60.65 59.35 2dbj s ILE 115 Cb -0.15 -4.28 -0.07 0.00 -1.58 0.00 0.00 42.46 36.38 2dbj s ILE 115 CO 0.11 -0.54 1.39 -2.16 -1.23 0.00 0.00 174.94 172.51 2dbj s PRO 116 N 3.31 4.31 0.04 2.79 0.04 -1.26 -1.22 135.00 143.01 2dbj s PRO 116 Ca 0.34 2.03 -0.12 0.00 0.04 0.00 0.00 61.00 63.29 2dbj s PRO 116 Cb -0.12 -3.38 -0.05 0.00 0.04 0.00 0.00 34.50 30.99 2dbj s PRO 116 CO 0.19 -0.48 1.19 0.00 0.04 0.00 0.00 177.00 177.94 2dbj h ALA 117 N 7.20 -0.69 -4.75 8.56 0.00 -1.94 -3.39 119.26 124.25 2dbj h ALA 117 Ca -0.41 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 2dbj h ALA 117 Cb 1.20 0.63 -0.03 0.00 0.00 0.00 0.00 17.79 19.59 2dbj h ALA 117 CO 0.87 -0.74 -0.06 -2.39 0.00 0.00 0.00 179.25 176.93 2dbj n HIS 118 N -3.51 -1.73 -3.52 0.00 1.44 -1.26 -4.77 115.22 101.88 2dbj n HIS 118 Ca -0.03 0.05 -0.39 0.00 -2.01 0.00 0.00 57.72 55.34 2dbj n HIS 118 Cb 0.14 -0.95 -0.10 0.00 0.12 0.00 0.00 29.99 29.19 2dbj n HIS 118 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 2dbj s SER 119 N -1.88 6.09 -0.25 4.39 0.15 -1.26 -5.05 113.70 115.88 2dbj s SER 119 Ca 0.06 -0.06 -0.23 0.00 0.70 0.00 0.00 55.95 56.41 2dbj s SER 119 Cb -0.03 -2.15 0.06 0.00 -1.71 0.00 0.00 66.02 62.19 2dbj s SER 119 CO 0.07 -0.14 0.67 -0.83 1.20 0.00 0.00 173.24 174.21 2dbj s GLY 120 N 1.73 -0.50 0.85 9.45 0.00 -1.26 -5.17 107.32 112.41 2dbj s GLY 120 Ca 0.09 1.88 -0.11 0.00 0.00 0.00 0.00 44.72 46.58 2dbj s GLY 120 CO 0.11 1.62 1.09 2.56 0.00 0.00 0.00 173.10 178.48 2dbj s PRO 121 N 0.35 1.65 0.35 2.90 0.04 -1.26 -5.08 135.00 133.95 2dbj s PRO 121 Ca -0.00 0.96 0.03 0.00 0.04 0.00 0.00 61.00 62.04 2dbj s PRO 121 Cb -0.05 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.61 2dbj s PRO 121 CO 0.01 -2.01 0.11 -1.54 0.04 0.00 0.00 177.00 173.62 2dbj s SER 122 N -3.41 2.28 0.03 6.66 1.04 -1.26 -5.17 113.70 113.88 2dbj s SER 122 Ca 0.63 -1.54 0.06 0.00 0.48 0.00 0.00 55.95 55.57 2dbj s SER 122 Cb -0.18 0.29 -0.02 0.00 0.10 0.00 0.00 66.02 66.21 2dbj s SER 122 CO 0.57 -0.82 -0.17 -0.94 0.98 0.00 0.00 173.24 172.86 2dbj s SER 123 N -3.50 2.00 0.00 7.02 1.04 -1.26 -5.38 113.70 113.62 2dbj s SER 123 Ca 0.31 -0.45 0.21 0.00 0.48 0.00 0.00 55.95 56.50 2dbj s SER 123 Cb 0.05 -0.16 0.17 0.00 0.10 0.00 0.00 66.02 66.18 2dbj s SER 123 CO 0.15 0.11 1.16 0.61 0.98 0.00 0.00 173.24 176.25