#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 3.46 -0.11 1.61 0.15 -1.26 -5.12 113.70 112.43 2dbj s SER 2 Ca 0.00 -0.37 0.01 0.00 0.70 0.00 0.00 55.95 56.29 2dbj s SER 2 Cb 0.00 -0.72 0.02 0.00 -1.71 0.00 0.00 66.02 63.61 2dbj s SER 2 CO 0.00 0.30 -0.14 -0.44 1.20 0.00 0.00 173.24 174.16 2dbj s SER 3 N -0.48 2.40 0.00 5.45 0.01 -1.26 -5.08 113.70 114.74 2dbj s SER 3 Ca 0.06 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 56.90 2dbj s SER 3 Cb -0.11 -1.06 0.00 0.00 0.21 0.00 0.00 66.02 65.05 2dbj s SER 3 CO 0.01 -0.00 0.00 0.61 0.41 0.00 0.00 173.24 174.27 2dbj n GLY 4 N 4.29 4.52 3.86 3.44 0.00 -1.26 -5.13 105.19 114.92 2dbj n GLY 4 Ca -0.19 -1.36 -0.31 0.00 0.00 0.00 0.00 46.02 44.17 2dbj n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dbj s SER 5 N 0.00 6.42 -0.10 1.61 1.04 -1.26 -5.03 113.70 116.39 2dbj s SER 5 Ca 0.00 1.41 -0.09 0.00 0.48 0.00 0.00 55.95 57.75 2dbj s SER 5 Cb 0.00 -2.45 -0.05 0.00 0.10 0.00 0.00 66.02 63.62 2dbj s SER 5 CO 0.00 -0.68 -0.20 -1.20 0.98 0.00 0.00 173.24 172.13 2dbj n SER 6 N -2.09 1.42 0.00 7.02 7.64 -1.26 -5.14 113.62 121.21 2dbj n SER 6 Ca 0.05 0.23 0.00 0.00 1.01 0.00 0.00 58.87 60.16 2dbj n SER 6 Cb 0.54 -0.53 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 2dbj n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dbj n GLY 7 N 2.21 3.61 3.39 0.23 0.00 -1.26 -5.17 105.19 108.21 2dbj n GLY 7 Ca -0.16 -1.37 -0.22 0.00 0.00 0.00 0.00 46.02 44.27 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 -0.23 1.71 -0.16 1.61 0.52 -1.26 -5.15 118.94 115.98 2dbj s TRP 8 Ca 0.00 -1.42 -0.04 0.00 0.02 0.00 0.00 56.10 54.66 2dbj s TRP 8 Cb 0.00 -0.93 -0.03 0.00 -1.15 0.00 0.00 33.47 31.36 2dbj s TRP 8 CO 0.00 -0.54 -0.04 0.42 0.02 0.00 0.00 176.95 176.81 2dbj s ILE 9 N -3.41 3.84 0.77 2.03 1.01 -1.26 -5.10 121.20 119.09 2dbj s ILE 9 Ca 0.32 -0.37 -0.14 0.00 0.00 0.00 0.00 60.65 60.46 2dbj s ILE 9 Cb 0.03 -2.69 0.06 0.00 0.01 0.00 0.00 42.46 39.88 2dbj s ILE 9 CO 0.19 0.49 1.21 -0.76 0.00 0.00 0.00 174.94 176.07 2dbj s LEU 10 N 0.42 3.22 -0.67 2.97 1.43 -1.26 -4.93 118.68 119.86 2dbj s LEU 10 Ca -0.04 2.36 -0.22 0.00 -1.03 0.00 0.00 54.13 55.20 2dbj s LEU 10 Cb -0.14 -4.59 0.08 0.00 0.03 0.00 0.00 46.19 41.57 2dbj s LEU 10 CO 0.03 -2.48 0.95 0.00 0.23 0.00 0.00 176.35 175.08 2dbj s ALA 11 N -2.07 3.16 -0.15 4.21 0.00 -1.26 -4.99 121.76 120.65 2dbj s ALA 11 Ca 0.74 -1.94 -0.35 0.00 0.00 0.00 0.00 51.96 50.41 2dbj s ALA 11 Cb -0.29 -3.84 -0.12 0.00 0.00 0.00 0.00 23.12 18.87 2dbj s ALA 11 CO 0.48 -2.75 1.90 -1.13 0.00 0.00 0.00 175.76 174.26 2dbj n SER 12 N 7.50 3.16 -4.58 0.00 3.41 -1.26 -4.92 113.62 116.93 2dbj n SER 12 Ca -0.03 0.92 -0.41 0.00 -0.26 0.00 0.00 58.87 59.09 2dbj n SER 12 Cb 0.45 -1.33 -0.07 0.00 -0.26 0.00 0.00 64.21 63.01 2dbj n SER 12 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2dbj s THR 13 N 4.40 4.95 0.09 6.66 -4.23 -1.26 -5.06 115.64 121.19 2dbj s THR 13 Ca 0.95 0.68 0.08 0.00 -1.18 0.00 0.00 61.69 62.23 2dbj s THR 13 Cb -0.76 -4.00 -0.04 0.00 1.34 0.00 0.00 72.50 69.04 2dbj s THR 13 CO 0.54 -0.19 -0.18 -0.89 -0.54 0.00 0.00 174.62 173.35 2dbj s THR 14 N 2.58 2.80 -0.48 3.99 2.01 -1.26 -5.05 115.64 120.23 2dbj s THR 14 Ca 0.23 -1.40 -0.46 0.00 0.31 0.00 0.00 61.69 60.38 2dbj s THR 14 Cb -0.15 -2.24 -0.19 0.00 0.01 0.00 0.00 72.50 69.93 2dbj s THR 14 CO 0.13 0.19 1.73 1.21 -0.69 0.00 0.00 174.62 177.18 2dbj n GLU 15 N 1.08 0.13 0.00 4.92 0.00 -1.26 -4.77 120.64 120.74 2dbj n GLU 15 Ca -0.16 0.05 0.00 0.00 0.00 0.00 0.00 57.16 57.05 2dbj n GLU 15 Cb 0.52 -1.58 0.00 0.00 0.00 0.00 0.00 31.44 30.39 2dbj n GLU 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2dbj n GLY 16 N 4.75 -1.02 3.51 8.31 0.00 -1.26 -5.18 105.19 114.30 2dbj n GLY 16 Ca 0.35 0.67 -0.10 0.00 0.00 0.00 0.00 46.02 46.94 2dbj n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dbj s ALA 17 N 0.00 -1.82 -0.88 4.61 0.00 -1.26 -4.11 121.76 118.30 2dbj s ALA 17 Ca 0.00 1.12 -0.25 0.00 0.00 0.00 0.00 51.96 52.83 2dbj s ALA 17 Cb 0.00 0.18 -0.05 0.00 0.00 0.00 0.00 23.12 23.25 2dbj s ALA 17 CO 0.00 -0.58 1.94 -1.25 0.00 0.00 0.00 175.76 175.87 2dbj s PRO 18 N -2.57 2.56 0.00 0.00 0.04 -1.25 -4.78 135.00 129.00 2dbj s PRO 18 Ca 0.02 -0.22 -0.02 0.00 0.04 0.00 0.00 61.00 60.82 2dbj s PRO 18 Cb -0.01 -5.01 -0.08 0.00 0.04 0.00 0.00 34.50 29.44 2dbj s PRO 18 CO -0.05 -3.33 2.40 0.45 0.04 0.00 0.00 177.00 176.51 2dbj n SER 19 N 13.88 5.04 -3.52 6.66 2.88 -1.26 -3.98 113.62 133.33 2dbj n SER 19 Ca 0.39 -2.37 -0.18 0.00 -1.33 0.00 0.00 58.87 55.38 2dbj n SER 19 Cb 0.47 -1.16 -0.06 0.00 -0.75 0.00 0.00 64.21 62.71 2dbj n SER 19 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 2dbj s VAL 20 N 0.42 0.00 0.39 2.46 -7.23 -1.26 -5.00 120.40 110.19 2dbj s VAL 20 Ca 0.20 -0.01 0.08 0.00 -1.81 0.00 0.00 61.98 60.45 2dbj s VAL 20 Cb 0.10 -1.00 -0.04 0.00 0.56 0.00 0.00 36.38 36.00 2dbj s VAL 20 CO 0.00 -0.00 0.20 0.00 -0.31 0.00 0.00 175.10 174.99 2dbj s ALA 21 N -1.37 3.64 0.29 1.32 0.00 -1.26 -4.29 121.76 120.09 2dbj s ALA 21 Ca -0.10 -1.98 -0.29 0.00 0.00 0.00 0.00 51.96 49.59 2dbj s ALA 21 Cb -0.00 -0.61 -0.10 0.00 0.00 0.00 0.00 23.12 22.41 2dbj s ALA 21 CO 0.08 -0.11 1.24 -1.25 0.00 0.00 0.00 175.76 175.72 2dbj s PRO 22 N -3.93 4.45 0.51 0.00 0.04 -1.26 -4.68 135.00 130.14 2dbj s PRO 22 Ca 0.41 2.05 0.05 0.00 0.04 0.00 0.00 61.00 63.55 2dbj s PRO 22 Cb 0.01 -3.13 0.04 0.00 0.04 0.00 0.00 34.50 31.45 2dbj s PRO 22 CO 0.24 -0.07 0.71 -0.48 0.04 0.00 0.00 177.00 177.44 2dbj s LEU 23 N -1.41 3.39 -1.39 -3.56 2.34 -1.23 -4.42 118.68 112.40 2dbj s LEU 23 Ca 0.49 -0.27 -0.05 0.00 0.06 0.00 0.00 54.13 54.35 2dbj s LEU 23 Cb -0.37 -2.61 0.03 0.00 -0.56 0.00 0.00 46.19 42.68 2dbj s LEU 23 CO 0.47 -1.06 0.40 0.59 -1.06 0.00 0.00 176.35 175.69 2dbj n ASN 24 N -2.18 -4.84 -4.67 1.48 3.02 -1.26 -0.59 115.26 106.22 2dbj n ASN 24 Ca 0.09 -0.21 -0.42 0.00 -0.03 0.00 0.00 54.58 54.01 2dbj n ASN 24 Cb 0.60 -3.98 -0.03 0.00 -0.61 0.00 0.00 39.78 35.76 2dbj n ASN 24 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2dbj s VAL 25 N -2.98 3.49 0.13 2.41 1.01 -1.26 -4.35 120.40 118.86 2dbj s VAL 25 Ca 0.26 0.70 0.02 0.00 0.00 0.00 0.00 61.98 62.96 2dbj s VAL 25 Cb -0.13 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 2dbj s VAL 25 CO 0.32 -0.05 -0.06 0.42 0.00 0.00 0.00 175.10 175.74 2dbj s THR 26 N 3.62 0.81 -0.04 3.92 -4.23 -0.49 -5.03 115.64 114.19 2dbj s THR 26 Ca 0.73 -1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 59.24 2dbj s THR 26 Cb -0.34 -1.84 0.03 0.00 1.34 0.00 0.00 72.50 71.69 2dbj s THR 26 CO 0.30 -0.74 0.05 -0.69 -0.54 0.00 0.00 174.62 172.99 2dbj s VAL 27 N -3.56 -0.03 -0.16 2.29 1.01 -1.26 -2.90 120.40 115.79 2dbj s VAL 27 Ca 0.16 0.35 -0.00 0.00 0.00 0.00 0.00 61.98 62.48 2dbj s VAL 27 Cb 0.05 -0.19 -0.00 0.00 0.00 0.00 0.00 36.38 36.24 2dbj s VAL 27 CO -0.01 0.17 -0.14 -0.36 0.00 0.00 0.00 175.10 174.76 2dbj s PHE 28 N 1.92 2.81 -0.25 5.22 0.40 -0.50 -5.02 117.98 122.56 2dbj s PHE 28 Ca 0.02 -0.95 -0.08 0.00 -0.60 0.00 0.00 56.93 55.32 2dbj s PHE 28 Cb -0.12 -1.90 -0.03 0.00 0.51 0.00 0.00 43.02 41.48 2dbj s PHE 28 CO -0.03 -0.43 0.08 -1.17 0.70 0.00 0.00 175.22 174.37 2dbj s LEU 29 N 0.78 3.52 -0.08 -0.37 2.96 -1.26 0.49 118.68 124.72 2dbj s LEU 29 Ca -0.05 -0.17 -0.21 0.00 -0.22 0.00 0.00 54.13 53.47 2dbj s LEU 29 Cb -0.15 -1.94 -0.04 0.00 0.50 0.00 0.00 46.19 44.55 2dbj s LEU 29 CO 0.01 -0.02 0.61 0.21 -1.32 0.00 0.00 176.35 175.83 2dbj s ASN 30 N 1.56 6.88 0.03 3.68 2.47 -1.22 -4.96 114.94 123.38 2dbj s ASN 30 Ca 0.06 1.06 0.10 0.00 0.42 0.00 0.00 52.86 54.50 2dbj s ASN 30 Cb -0.15 -2.36 -0.22 0.00 -1.45 0.00 0.00 41.25 37.07 2dbj s ASN 30 CO 0.04 -0.05 0.92 -0.33 -3.72 0.00 0.00 177.10 173.96 2dbj h GLU 31 N 6.61 0.00 -0.05 0.43 4.39 -1.98 -3.32 114.58 120.66 2dbj h GLU 31 Ca -0.41 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.23 2dbj h GLU 31 Cb 1.19 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.83 2dbj h GLU 31 CO 0.75 0.69 -0.22 1.03 -1.16 0.00 0.00 179.01 180.10 2dbj h SER 32 N 0.00 0.08 -4.03 1.42 0.87 -1.97 -3.43 113.55 106.49 2dbj h SER 32 Ca -0.17 -0.02 -0.49 0.00 -1.23 0.00 0.00 61.79 59.88 2dbj h SER 32 Cb 1.90 -0.02 -0.20 0.00 -0.44 0.00 0.00 62.40 63.64 2dbj h SER 32 CO 0.10 0.31 -0.79 -0.55 -0.53 0.00 0.00 176.83 175.37 2dbj s SER 33 N -6.94 2.30 -0.14 6.23 0.15 -1.25 -5.03 113.70 109.01 2dbj s SER 33 Ca -0.04 -0.75 -0.05 0.00 0.70 0.00 0.00 55.95 55.81 2dbj s SER 33 Cb 0.15 -0.11 -0.13 0.00 -1.71 0.00 0.00 66.02 64.22 2dbj s SER 33 CO 0.72 -0.04 3.19 -0.90 1.20 0.00 0.00 173.24 177.40 2dbj n ASP 34 N 0.77 5.66 -4.35 5.45 5.68 -1.26 -4.58 116.55 123.91 2dbj n ASP 34 Ca -0.17 -2.71 -0.18 0.00 -0.50 0.00 0.00 54.79 51.23 2dbj n ASP 34 Cb 0.55 -1.33 -0.10 0.00 -1.14 0.00 0.00 41.12 39.10 2dbj n ASP 34 CO 0.00 0.00 0.00 0.20 -1.33 0.00 0.00 177.20 176.07 2dbj s ASN 35 N 1.45 1.58 -0.09 -1.12 0.01 -1.26 0.27 114.94 115.77 2dbj s ASN 35 Ca 0.58 -1.34 0.01 0.00 -0.71 0.00 0.00 52.86 51.40 2dbj s ASN 35 Cb 0.31 0.08 0.02 0.00 0.41 0.00 0.00 41.25 42.06 2dbj s ASN 35 CO -0.06 -0.66 -0.11 -0.69 -1.51 0.00 0.00 177.10 174.07 2dbj s VAL 36 N -3.59 1.18 0.25 1.60 1.01 0.81 -3.40 120.40 118.27 2dbj s VAL 36 Ca 0.35 -0.45 -0.13 0.00 0.00 0.00 0.00 61.98 61.75 2dbj s VAL 36 Cb 0.08 -1.11 -0.08 0.00 0.00 0.00 0.00 36.38 35.27 2dbj s VAL 36 CO 0.13 0.38 0.63 -1.81 0.00 0.00 0.00 175.10 174.42 2dbj s ASP 37 N 1.08 6.73 -0.01 3.32 1.01 0.18 -1.70 116.67 127.28 2dbj s ASP 37 Ca -0.06 1.10 0.00 0.00 0.71 0.00 0.00 52.55 54.30 2dbj s ASP 37 Cb -0.14 -2.30 0.01 0.00 1.01 0.00 0.00 42.92 41.49 2dbj s ASP 37 CO -0.02 -0.09 0.00 -0.63 0.21 0.00 0.00 175.17 174.65 2dbj s ILE 38 N -1.81 0.04 -0.05 0.77 1.09 0.40 -1.40 121.20 120.23 2dbj s ILE 38 Ca 0.48 0.02 -0.02 0.00 -1.10 0.00 0.00 60.65 60.03 2dbj s ILE 38 Cb -0.12 -0.07 0.04 0.00 -1.06 0.00 0.00 42.46 41.25 2dbj s ILE 38 CO 0.20 0.03 0.10 -0.60 -0.10 0.00 0.00 174.94 174.57 2dbj s ARG 39 N 0.23 0.03 0.29 2.79 3.00 -1.14 -1.21 118.95 122.94 2dbj s ARG 39 Ca -0.02 0.33 0.03 0.00 -1.00 0.00 0.00 55.73 55.07 2dbj s ARG 39 Cb -0.03 -0.23 -0.04 0.00 0.00 0.00 0.00 34.95 34.65 2dbj s ARG 39 CO -0.01 -0.19 0.16 1.67 0.00 0.00 0.00 175.30 176.94 2dbj s TRP 40 N 1.30 1.54 0.31 5.12 -2.14 -1.22 -1.40 118.94 122.46 2dbj s TRP 40 Ca -0.07 -1.40 0.09 0.00 2.66 0.00 0.00 56.10 57.38 2dbj s TRP 40 Cb -0.12 -0.79 -0.05 0.00 -3.10 0.00 0.00 33.47 29.41 2dbj s TRP 40 CO -0.05 -0.57 0.05 -1.64 -2.66 0.00 0.00 176.95 172.07 2dbj s MET 41 N -3.85 2.24 -0.02 3.25 -1.94 0.24 -4.89 119.30 114.34 2dbj s MET 41 Ca 0.37 -1.57 -0.26 0.00 -1.71 0.00 0.00 55.69 52.52 2dbj s MET 41 Cb 0.05 -2.09 -0.04 0.00 2.01 0.00 0.00 34.83 34.77 2dbj s MET 41 CO 0.18 0.21 0.80 0.21 -0.01 0.00 0.00 175.02 176.41 2dbj s LYS 42 N -3.74 4.49 0.82 2.03 2.20 -1.26 -3.53 119.74 120.75 2dbj s LYS 42 Ca 0.35 1.10 -0.11 0.00 -0.36 0.00 0.00 55.97 56.94 2dbj s LYS 42 Cb -0.03 -3.43 0.08 0.00 -1.51 0.00 0.00 37.83 32.94 2dbj s LYS 42 CO 0.21 0.08 1.09 -1.25 -0.36 0.00 0.00 175.35 175.12 2dbj s PRO 43 N 0.66 1.90 0.00 4.03 0.04 -1.26 -4.78 135.00 135.58 2dbj s PRO 43 Ca 0.42 1.05 0.08 0.00 0.04 0.00 0.00 61.00 62.59 2dbj s PRO 43 Cb -0.19 -1.86 0.45 0.00 0.04 0.00 0.00 34.50 32.93 2dbj s PRO 43 CO 0.22 -1.86 0.90 -0.35 0.04 0.00 0.00 177.00 175.96 2dbj n PRO 44 N -3.66 0.49 -1.50 0.56 -0.04 -1.26 -4.80 135.00 124.79 2dbj n PRO 44 Ca 0.08 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.27 2dbj n PRO 44 Cb 0.54 -1.24 -0.20 0.00 -0.04 0.00 0.00 33.50 32.56 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 -0.74 -0.00 0.00 0.52 -2.24 -1.26 -4.42 114.28 106.14 2dbj n THR 45 Ca 0.06 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2dbj n THR 45 Cb 0.03 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 2dbj n THR 45 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2dbj n LYS 46 N 6.57 0.00 0.00 -0.78 4.81 -1.26 -4.51 118.16 122.99 2dbj n LYS 46 Ca 0.66 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 58.10 2dbj n LYS 46 Cb 0.13 -0.52 0.00 0.00 0.02 0.00 0.00 35.03 34.66 2dbj n LYS 46 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2dbj n GLN 47 N -2.18 1.71 0.25 1.64 6.02 -1.26 -3.96 117.38 119.60 2dbj n GLN 47 Ca 0.00 0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.12 2dbj n GLN 47 Cb 0.20 -0.87 0.58 0.00 1.02 0.00 0.00 30.24 31.16 2dbj n GLN 47 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 2dbj h GLN 48 N 0.00 0.00 0.00 -1.09 4.15 -1.92 -3.38 115.11 112.87 2dbj h GLN 48 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2dbj h GLN 48 Cb 0.74 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.43 2dbj h GLN 48 CO 0.00 0.13 -0.32 -3.47 -1.93 0.00 0.00 178.83 173.24 2dbj n ASP 49 N -3.30 0.51 0.00 -0.69 2.03 -1.26 -4.67 116.55 109.16 2dbj n ASP 49 Ca 0.00 0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.44 2dbj n ASP 49 Cb 0.36 -0.11 0.00 0.00 -0.72 0.00 0.00 41.12 40.65 2dbj n ASP 49 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dbj n GLY 50 N 2.93 2.06 3.43 0.27 0.00 -1.25 -4.86 105.19 107.78 2dbj n GLY 50 Ca 0.00 -0.57 -0.11 0.00 0.00 0.00 0.00 46.02 45.34 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 0.00 0.57 0.13 1.61 -1.05 -1.26 -4.45 118.70 114.24 2dbj s GLU 51 Ca 0.00 0.89 -0.13 0.00 -0.15 0.00 0.00 54.97 55.59 2dbj s GLU 51 Cb 0.00 0.15 -0.07 0.00 -0.44 0.00 0.00 34.13 33.77 2dbj s GLU 51 CO 0.00 -0.12 0.50 -1.17 0.95 0.00 0.00 175.26 175.41 2dbj s LEU 52 N 1.04 4.34 -0.01 1.83 0.20 -1.26 -4.41 118.68 120.40 2dbj s LEU 52 Ca -0.06 0.97 0.07 0.00 0.69 0.00 0.00 54.13 55.80 2dbj s LEU 52 Cb -0.06 -3.18 -0.12 0.00 -0.43 0.00 0.00 46.19 42.40 2dbj s LEU 52 CO -0.10 0.12 0.16 1.33 -0.29 0.00 0.00 176.35 177.57 2dbj n VAL 53 N 0.80 0.04 -2.02 1.68 0.24 0.41 -4.91 118.33 114.56 2dbj n VAL 53 Ca -0.06 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 62.06 2dbj n VAL 53 Cb 0.52 0.24 0.00 0.00 -1.47 0.00 0.00 33.84 33.13 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 2.11 -0.64 3.29 7.63 0.00 -1.06 0.12 105.19 116.64 2dbj n GLY 54 Ca -0.02 -0.52 -0.14 0.00 0.00 0.00 0.00 46.02 45.34 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 -3.35 1.21 -0.27 1.61 1.51 -0.95 -0.19 117.35 116.93 2dbj s TYR 55 Ca 0.00 -1.37 -0.01 0.00 -1.01 0.00 0.00 57.07 54.68 2dbj s TYR 55 Cb 0.00 -0.47 0.08 0.00 -0.11 0.00 0.00 41.96 41.46 2dbj s TYR 55 CO 0.00 -0.78 0.06 1.03 -1.11 0.00 0.00 175.55 174.74 2dbj s ARG 56 N -3.86 0.84 -0.44 -0.62 0.52 0.14 -3.40 118.95 112.14 2dbj s ARG 56 Ca 0.37 -0.90 -0.18 0.00 -0.52 0.00 0.00 55.73 54.50 2dbj s ARG 56 Cb 0.04 -2.14 0.03 0.00 0.52 0.00 0.00 34.95 33.41 2dbj s ARG 56 CO 0.16 -0.84 0.48 0.42 0.02 0.00 0.00 175.30 175.55 2dbj s ILE 57 N 1.63 5.04 -0.37 1.52 1.01 -1.22 -1.70 121.20 127.12 2dbj s ILE 57 Ca 0.05 -0.36 -0.11 0.00 0.00 0.00 0.00 60.65 60.23 2dbj s ILE 57 Cb -0.17 -4.10 0.02 0.00 0.01 0.00 0.00 42.46 38.22 2dbj s ILE 57 CO -0.17 -0.50 0.21 -0.55 0.00 0.00 0.00 174.94 173.92 2dbj s SER 58 N 1.98 5.76 -0.32 3.58 0.15 0.21 -0.25 113.70 124.81 2dbj s SER 58 Ca 0.13 -0.92 -0.03 0.00 0.70 0.00 0.00 55.95 55.83 2dbj s SER 58 Cb -0.17 -2.04 0.05 0.00 -1.71 0.00 0.00 66.02 62.15 2dbj s SER 58 CO 0.14 -0.37 0.04 -1.38 1.20 0.00 0.00 173.24 172.87 2dbj s HIS 59 N 1.58 3.30 0.13 3.44 -3.43 -1.08 -2.57 115.29 116.65 2dbj s HIS 59 Ca 0.03 -1.85 0.01 0.00 -0.80 0.00 0.00 55.06 52.44 2dbj s HIS 59 Cb -0.19 -2.25 -0.04 0.00 -1.43 0.00 0.00 32.58 28.67 2dbj s HIS 59 CO 0.07 -0.81 0.28 0.54 -2.00 0.00 0.00 174.74 172.82 2dbj s VAL 60 N 1.27 5.32 -0.15 -5.38 0.11 -1.15 -1.61 120.40 118.80 2dbj s VAL 60 Ca -0.03 -0.53 0.00 0.00 -2.93 0.00 0.00 61.98 58.49 2dbj s VAL 60 Cb -0.20 -3.71 0.03 0.00 -1.53 0.00 0.00 36.38 30.97 2dbj s VAL 60 CO -0.01 -0.03 -0.10 0.26 -3.33 0.00 0.00 175.10 171.89 2dbj s TRP 61 N -1.69 1.97 -0.23 1.54 0.52 0.38 -2.47 118.94 118.96 2dbj s TRP 61 Ca 0.35 -1.15 0.02 0.00 0.02 0.00 0.00 56.10 55.35 2dbj s TRP 61 Cb -0.12 -1.47 0.04 0.00 -1.15 0.00 0.00 33.47 30.78 2dbj s TRP 61 CO 0.28 -0.64 -0.15 -0.65 0.02 0.00 0.00 176.95 175.82 2dbj s GLN 62 N 1.55 2.53 0.21 4.98 -0.21 -0.84 -0.26 119.66 127.62 2dbj s GLN 62 Ca 0.03 -1.14 0.07 0.00 0.02 0.00 0.00 55.36 54.35 2dbj s GLN 62 Cb -0.14 -2.76 -0.05 0.00 1.00 0.00 0.00 33.01 31.07 2dbj s GLN 62 CO -0.09 -0.43 -0.12 0.45 -2.12 0.00 0.00 175.29 172.98 2dbj s SER 63 N 1.18 2.51 -0.33 5.90 0.15 0.20 -1.15 113.70 122.16 2dbj s SER 63 Ca -0.03 -1.05 -0.28 0.00 0.70 0.00 0.00 55.95 55.29 2dbj s SER 63 Cb -0.17 -0.12 -0.04 0.00 -1.71 0.00 0.00 66.02 63.97 2dbj s SER 63 CO -0.08 -0.22 2.12 0.00 1.20 0.00 0.00 173.24 176.26 2dbj s ALA 64 N -3.02 2.52 0.00 5.45 0.00 -1.26 -1.54 121.76 123.90 2dbj s ALA 64 Ca 0.23 0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.60 2dbj s ALA 64 Cb 0.00 -4.13 0.00 0.00 0.00 0.00 0.00 23.12 19.00 2dbj s ALA 64 CO 0.07 -3.14 0.00 0.41 0.00 0.00 0.00 175.76 173.10 2dbj n GLY 65 N 5.72 3.25 2.90 0.00 0.00 -1.26 -4.99 105.19 110.80 2dbj n GLY 65 Ca 0.29 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.37 1.10 -0.27 -0.61 -1.09 -0.59 -5.10 121.20 112.28 2dbj s ILE 66 Ca 0.00 -0.56 0.01 0.00 -2.23 0.00 0.00 60.65 57.87 2dbj s ILE 66 Cb 0.00 -1.24 0.07 0.00 -1.58 0.00 0.00 42.46 39.71 2dbj s ILE 66 CO 0.00 0.18 -0.01 -0.94 -1.23 0.00 0.00 174.94 172.94 2dbj s SER 67 N 1.64 4.03 0.26 3.58 1.04 -1.26 0.58 113.70 123.59 2dbj s SER 67 Ca 0.02 -1.43 0.12 0.00 0.48 0.00 0.00 55.95 55.13 2dbj s SER 67 Cb -0.15 -1.20 -0.05 0.00 0.10 0.00 0.00 66.02 64.73 2dbj s SER 67 CO -0.08 -0.29 -0.18 -0.54 0.98 0.00 0.00 173.24 173.12 2dbj s LYS 68 N 1.35 1.73 -0.07 4.02 1.02 0.64 -5.00 119.74 123.43 2dbj s LYS 68 Ca 0.00 -1.69 0.00 0.00 0.02 0.00 0.00 55.97 54.30 2dbj s LYS 68 Cb -0.19 -1.83 0.02 0.00 -0.52 0.00 0.00 37.83 35.32 2dbj s LYS 68 CO -0.10 0.35 -0.05 -2.00 -0.92 0.00 0.00 175.35 172.63 2dbj s GLU 69 N -3.40 1.05 0.26 1.68 2.12 -1.26 -0.47 118.70 118.69 2dbj s GLU 69 Ca 0.29 -0.13 0.09 0.00 0.36 0.00 0.00 54.97 55.58 2dbj s GLU 69 Cb -0.06 -1.12 -0.04 0.00 0.26 0.00 0.00 34.13 33.17 2dbj s GLU 69 CO 0.15 -0.16 0.03 -0.51 -0.54 0.00 0.00 175.26 174.23 2dbj s LEU 70 N 1.32 3.31 -0.12 2.70 1.02 -0.63 -4.95 118.68 121.32 2dbj s LEU 70 Ca -0.04 -0.57 -0.04 0.00 0.02 0.00 0.00 54.13 53.49 2dbj s LEU 70 Cb -0.14 -1.83 0.06 0.00 0.02 0.00 0.00 46.19 44.30 2dbj s LEU 70 CO -0.03 -0.01 0.23 -0.22 0.02 0.00 0.00 176.35 176.35 2dbj s LEU 71 N -3.70 -0.21 0.29 1.79 1.98 -1.26 -2.65 118.68 114.91 2dbj s LEU 71 Ca 0.32 0.43 0.04 0.00 -2.89 0.00 0.00 54.13 52.02 2dbj s LEU 71 Cb -0.07 0.54 -0.03 0.00 0.66 0.00 0.00 46.19 47.29 2dbj s LEU 71 CO 0.21 -0.25 0.43 -0.70 -1.89 0.00 0.00 176.35 174.15 2dbj s GLU 72 N 2.37 3.42 -0.07 1.98 2.56 0.65 -4.98 118.70 124.63 2dbj s GLU 72 Ca 0.02 -0.65 -0.00 0.00 0.00 0.00 0.00 54.97 54.34 2dbj s GLU 72 Cb -0.12 -2.81 0.03 0.00 2.00 0.00 0.00 34.13 33.22 2dbj s GLU 72 CO -0.08 0.30 -0.02 -1.21 -0.56 0.00 0.00 175.26 173.68 2dbj s GLU 73 N -4.11 0.77 0.12 4.30 8.01 -1.26 -3.41 118.70 123.13 2dbj s GLU 73 Ca 0.37 -0.00 0.05 0.00 0.01 0.00 0.00 54.97 55.40 2dbj s GLU 73 Cb -0.09 -0.98 -0.04 0.00 -4.31 0.00 0.00 34.13 28.71 2dbj s GLU 73 CO 0.31 -0.22 -0.13 0.14 0.01 0.00 0.00 175.26 175.38 2dbj s VAL 74 N 1.57 1.27 0.15 2.63 -7.23 -1.22 -5.03 120.40 112.54 2dbj s VAL 74 Ca -0.01 -1.77 0.02 0.00 -1.81 0.00 0.00 61.98 58.42 2dbj s VAL 74 Cb -0.13 -1.56 0.03 0.00 0.56 0.00 0.00 36.38 35.28 2dbj s VAL 74 CO -0.04 -0.49 0.21 0.61 -0.31 0.00 0.00 175.10 175.08 2dbj n GLY 75 N 0.41 1.75 0.30 2.32 0.00 -1.26 -2.23 105.19 106.48 2dbj n GLY 75 Ca -0.15 -2.13 0.19 0.00 0.00 0.00 0.00 46.02 43.94 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 0.00 -2.24 1.61 3.07 0.59 -3.13 115.11 115.00 2dbj h GLN 76 Ca -0.07 0.00 -0.79 0.00 0.09 0.00 0.00 58.65 57.88 2dbj h GLN 76 Cb 0.31 0.00 -0.25 0.00 0.08 0.00 0.00 27.48 27.61 2dbj h GLN 76 CO 0.09 0.02 1.16 0.27 0.09 0.00 0.00 178.83 180.47 2dbj n ASN 77 N -3.19 7.44 -2.82 0.06 2.04 -1.26 -4.61 115.26 112.92 2dbj n ASN 77 Ca -0.01 -3.65 -0.11 0.00 -0.44 0.00 0.00 54.58 50.37 2dbj n ASN 77 Cb 0.19 -1.17 0.05 0.00 -2.53 0.00 0.00 39.78 36.32 2dbj n ASN 77 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2dbj n GLY 78 N 0.05 1.77 0.30 4.83 0.00 -1.18 -4.97 105.19 105.99 2dbj n GLY 78 Ca 0.49 -0.78 0.26 0.00 0.00 0.00 0.00 46.02 46.00 2dbj n GLY 78 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dbj n SER 79 N -0.00 0.24 -4.56 1.61 7.64 -1.26 -4.46 113.62 112.83 2dbj n SER 79 Ca 0.09 1.52 -0.26 0.00 1.01 0.00 0.00 58.87 61.23 2dbj n SER 79 Cb 0.76 -0.71 -0.11 0.00 -1.01 0.00 0.00 64.21 63.15 2dbj n SER 79 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dbj s ARG 80 N -5.47 1.87 0.11 1.43 1.70 -1.26 -3.37 118.95 113.96 2dbj s ARG 80 Ca -0.09 -2.07 -0.09 0.00 -0.47 0.00 0.00 55.73 53.01 2dbj s ARG 80 Cb 0.30 -1.35 -0.00 0.00 -0.57 0.00 0.00 34.95 33.33 2dbj s ARG 80 CO 0.71 -0.13 0.23 0.00 -1.08 0.00 0.00 175.30 175.03 2dbj s ALA 81 N -2.93 -0.22 0.00 7.88 0.00 -0.35 -4.98 121.76 121.17 2dbj s ALA 81 Ca 0.33 -0.64 -0.02 0.00 0.00 0.00 0.00 51.96 51.63 2dbj s ALA 81 Cb 0.09 0.59 -0.01 0.00 0.00 0.00 0.00 23.12 23.80 2dbj s ALA 81 CO 0.16 -0.55 0.02 0.50 0.00 0.00 0.00 175.76 175.89 2dbj s ARG 82 N -3.88 0.20 -0.02 0.00 3.52 -1.26 -0.45 118.95 117.06 2dbj s ARG 82 Ca 0.08 -0.26 0.02 0.00 -0.13 0.00 0.00 55.73 55.43 2dbj s ARG 82 Cb 0.04 0.08 0.00 0.00 -1.56 0.00 0.00 34.95 33.51 2dbj s ARG 82 CO -0.08 -0.04 -0.06 0.42 -0.81 0.00 0.00 175.30 174.73 2dbj s ILE 83 N -0.73 0.53 -0.65 4.11 1.01 -0.69 -4.94 121.20 119.84 2dbj s ILE 83 Ca -0.08 -0.24 -0.25 0.00 0.00 0.00 0.00 60.65 60.08 2dbj s ILE 83 Cb -0.05 -0.48 0.05 0.00 0.01 0.00 0.00 42.46 41.99 2dbj s ILE 83 CO -0.00 0.17 1.07 -0.44 0.00 0.00 0.00 174.94 175.74 2dbj s SER 84 N 0.15 6.24 -0.33 3.58 0.01 -1.26 -0.13 113.70 121.96 2dbj s SER 84 Ca -0.02 -0.57 -0.29 0.00 1.31 0.00 0.00 55.95 56.38 2dbj s SER 84 Cb -0.06 -2.48 -0.13 0.00 0.21 0.00 0.00 66.02 63.57 2dbj s SER 84 CO -0.00 -1.51 1.38 0.52 0.41 0.00 0.00 173.24 174.04 2dbj n VAL 85 N 6.20 0.00 0.05 3.43 0.31 0.14 -4.80 118.33 123.66 2dbj n VAL 85 Ca 0.01 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.13 2dbj n VAL 85 Cb 0.47 -0.33 -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 1.56 -1.32 0.00 0.00 176.83 177.07 2dbj h GLN 86 N 5.71 0.31 -5.38 5.55 1.08 -1.92 -3.47 115.11 117.00 2dbj h GLN 86 Ca -0.08 -0.52 -0.54 0.00 -1.45 0.00 0.00 58.65 56.05 2dbj h GLN 86 Cb 0.93 0.19 -0.30 0.00 -0.05 0.00 0.00 27.48 28.25 2dbj h GLN 86 CO 0.71 1.20 -0.83 0.08 -0.95 0.00 0.00 178.83 179.04 2dbj s VAL 87 N -2.58 1.34 0.18 -0.54 1.01 -1.26 -5.15 120.40 113.40 2dbj s VAL 87 Ca -0.16 -0.69 0.06 0.00 0.00 0.00 0.00 61.98 61.19 2dbj s VAL 87 Cb 0.06 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 2dbj s VAL 87 CO 0.83 0.39 0.10 -1.00 0.00 0.00 0.00 175.10 175.42 2dbj s HIS 88 N -0.13 3.06 -1.22 5.22 3.76 -1.26 -4.61 115.29 120.11 2dbj s HIS 88 Ca 0.01 -0.06 -0.03 0.00 -0.15 0.00 0.00 55.06 54.82 2dbj s HIS 88 Cb -0.09 -1.46 0.00 0.00 1.11 0.00 0.00 32.58 32.14 2dbj s HIS 88 CO 0.01 0.52 1.04 -1.71 -0.85 0.00 0.00 174.74 173.75 2dbj n ASN 89 N -0.38 -3.57 -4.07 1.40 2.85 0.19 -4.87 115.26 106.81 2dbj n ASN 89 Ca -0.09 -0.57 -0.10 0.00 -0.11 0.00 0.00 54.58 53.71 2dbj n ASN 89 Cb 0.55 -4.95 -0.09 0.00 1.24 0.00 0.00 39.78 36.53 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 -3.33 0.49 -0.40 5.20 0.00 -1.20 -4.77 121.76 117.74 2dbj s ALA 90 Ca 0.21 -1.23 -0.17 0.00 0.00 0.00 0.00 51.96 50.77 2dbj s ALA 90 Cb -0.09 0.94 0.02 0.00 0.00 0.00 0.00 23.12 23.98 2dbj s ALA 90 CO 0.71 -0.59 0.41 0.95 0.00 0.00 0.00 175.76 177.24 2dbj s THR 91 N -4.03 5.12 -0.00 0.00 -4.23 -0.30 -1.61 115.64 110.60 2dbj s THR 91 Ca 0.23 -0.32 -0.01 0.00 -1.18 0.00 0.00 61.69 60.41 2dbj s THR 91 Cb 0.05 -3.99 -0.04 0.00 1.34 0.00 0.00 72.50 69.87 2dbj s THR 91 CO 0.03 -0.35 0.11 0.00 -0.54 0.00 0.00 174.62 173.86 2dbj s THR 93 N -1.23 2.47 -0.07 0.00 2.01 -1.03 -1.21 115.64 116.58 2dbj s THR 93 Ca 0.24 -1.03 -0.15 0.00 0.31 0.00 0.00 61.69 61.06 2dbj s THR 93 Cb -0.12 -2.19 -0.05 0.00 0.01 0.00 0.00 72.50 70.15 2dbj s THR 93 CO 0.15 0.33 0.38 -0.69 -0.69 0.00 0.00 174.62 174.10 2dbj s VAL 94 N 1.29 5.16 -0.19 3.82 1.01 -1.11 -2.95 120.40 127.43 2dbj s VAL 94 Ca 0.01 0.76 -0.07 0.00 0.00 0.00 0.00 61.98 62.68 2dbj s VAL 94 Cb -0.15 -3.70 0.08 0.00 0.00 0.00 0.00 36.38 32.61 2dbj s VAL 94 CO -0.08 0.48 0.41 -0.13 0.00 0.00 0.00 175.10 175.78 2dbj s ARG 95 N -0.30 0.34 0.05 2.72 0.52 -1.06 -3.00 118.95 118.21 2dbj s ARG 95 Ca 0.22 0.97 0.06 0.00 -0.52 0.00 0.00 55.73 56.46 2dbj s ARG 95 Cb -0.15 0.23 -0.04 0.00 0.52 0.00 0.00 34.95 35.51 2dbj s ARG 95 CO 0.10 -0.23 -0.12 0.42 0.02 0.00 0.00 175.30 175.49 2dbj s ILE 96 N 2.30 3.21 0.03 1.52 1.01 -1.26 -0.62 121.20 127.40 2dbj s ILE 96 Ca -0.04 -1.12 -0.01 0.00 0.00 0.00 0.00 60.65 59.49 2dbj s ILE 96 Cb -0.11 -2.42 -0.03 0.00 0.01 0.00 0.00 42.46 39.91 2dbj s ILE 96 CO -0.13 0.27 -0.02 0.00 0.00 0.00 0.00 174.94 175.06 2dbj s ALA 97 N -1.05 0.25 0.01 9.38 0.00 -0.69 -1.73 121.76 127.93 2dbj s ALA 97 Ca 0.18 -0.80 -0.26 0.00 0.00 0.00 0.00 51.96 51.07 2dbj s ALA 97 Cb -0.11 0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.16 2dbj s ALA 97 CO 0.09 -0.24 0.80 0.00 0.00 0.00 0.00 175.76 176.41 2dbj s ALA 98 N -2.37 3.31 -0.02 0.00 0.00 -1.26 0.29 121.76 121.70 2dbj s ALA 98 Ca -0.07 0.31 0.01 0.00 0.00 0.00 0.00 51.96 52.20 2dbj s ALA 98 Cb -0.03 -3.07 -0.03 0.00 0.00 0.00 0.00 23.12 19.98 2dbj s ALA 98 CO -0.04 -0.05 -0.02 0.08 0.00 0.00 0.00 175.76 175.73 2dbj s VAL 99 N 0.42 4.02 0.38 0.00 1.01 0.73 -3.14 120.40 123.83 2dbj s VAL 99 Ca 0.41 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.84 2dbj s VAL 99 Cb -0.20 -2.76 -0.01 0.00 0.00 0.00 0.00 36.38 33.41 2dbj s VAL 99 CO 0.23 0.43 0.09 0.35 0.00 0.00 0.00 175.10 176.20 2dbj n THR 100 N 1.60 0.00 1.31 3.92 -2.24 -1.21 -0.44 114.28 117.22 2dbj n THR 100 Ca -0.16 -2.09 0.04 0.00 -2.27 0.00 0.00 64.05 59.57 2dbj n THR 100 Cb 0.53 0.66 0.11 0.00 -2.10 0.00 0.00 70.33 69.53 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 -0.89 1.50 0.00 -0.78 5.12 -1.26 -3.93 116.66 116.42 2dbj n ARG 101 Ca -0.09 -0.78 0.00 0.00 -1.93 0.00 0.00 57.85 55.05 2dbj n ARG 101 Cb 0.55 -1.18 0.00 0.00 -1.16 0.00 0.00 32.46 30.67 2dbj n ARG 101 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2dbj n GLY 102 N 0.85 0.00 0.00 -0.13 0.00 -1.26 -5.14 105.19 99.52 2dbj n GLY 102 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 2.95 0.95 3.89 -0.02 0.00 -1.25 -4.96 105.19 106.75 2dbj n GLY 103 Ca 0.00 -0.72 -0.29 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.00 4.82 0.05 1.61 0.11 -1.26 -3.36 120.40 120.36 2dbj s VAL 104 Ca 0.00 0.50 0.00 0.00 -2.93 0.00 0.00 61.98 59.55 2dbj s VAL 104 Cb 0.00 -3.85 0.00 0.00 -1.53 0.00 0.00 36.38 31.00 2dbj s VAL 104 CO 0.00 -0.93 0.01 0.61 -3.33 0.00 0.00 175.10 171.46 2dbj n GLY 105 N -2.35 3.94 3.77 6.54 0.00 -1.19 -4.54 105.19 111.36 2dbj n GLY 105 Ca 0.03 -2.22 -0.38 0.00 0.00 0.00 0.00 46.02 43.46 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 -2.17 3.88 0.76 1.61 0.04 -1.26 -4.77 135.00 133.09 2dbj s PRO 106 Ca 0.00 1.82 -0.12 0.00 0.04 0.00 0.00 61.00 62.75 2dbj s PRO 106 Cb -0.00 -2.53 0.05 0.00 0.04 0.00 0.00 34.50 32.06 2dbj s PRO 106 CO 0.00 -0.46 1.13 -0.06 0.04 0.00 0.00 177.00 177.66 2dbj s PHE 107 N -1.48 3.13 0.51 0.56 0.40 -1.26 -4.30 117.98 115.54 2dbj s PHE 107 Ca 0.61 0.88 -0.07 0.00 -0.60 0.00 0.00 56.93 57.75 2dbj s PHE 107 Cb -0.30 -3.28 0.11 0.00 0.51 0.00 0.00 43.02 40.06 2dbj s PHE 107 CO 0.37 -1.48 0.70 -1.13 0.70 0.00 0.00 175.22 174.38 2dbj n SER 108 N -3.16 0.27 -4.68 1.36 3.41 -0.70 -4.87 113.62 105.25 2dbj n SER 108 Ca 0.07 -1.39 -0.42 0.00 -0.26 0.00 0.00 58.87 56.88 2dbj n SER 108 Cb 0.59 -0.51 -0.03 0.00 -0.26 0.00 0.00 64.21 64.00 2dbj n SER 108 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 2dbj s ASP 109 N -3.62 6.43 0.38 4.04 -4.77 -1.26 -4.79 116.67 113.08 2dbj s ASP 109 Ca 0.41 2.73 -0.26 0.00 -3.30 0.00 0.00 52.55 52.14 2dbj s ASP 109 Cb -0.01 -2.55 -0.09 0.00 -1.09 0.00 0.00 42.92 39.18 2dbj s ASP 109 CO 0.28 -1.04 1.20 -2.16 0.70 0.00 0.00 175.17 174.15 2dbj s PRO 110 N 3.61 4.12 -0.17 2.11 0.04 -1.26 -4.90 135.00 138.54 2dbj s PRO 110 Ca 0.85 1.92 0.00 0.00 0.04 0.00 0.00 61.00 63.81 2dbj s PRO 110 Cb -0.45 -2.77 0.04 0.00 0.04 0.00 0.00 34.50 31.37 2dbj s PRO 110 CO 0.39 -0.29 -0.08 0.54 0.04 0.00 0.00 177.00 177.60 2dbj s VAL 111 N -1.35 1.34 -0.53 -0.36 0.11 -1.16 -4.99 120.40 113.47 2dbj s VAL 111 Ca 0.55 -0.74 -0.27 0.00 -2.93 0.00 0.00 61.98 58.59 2dbj s VAL 111 Cb -0.33 -1.44 0.03 0.00 -1.53 0.00 0.00 36.38 33.11 2dbj s VAL 111 CO 0.42 0.19 1.10 -0.75 -3.33 0.00 0.00 175.10 172.73 2dbj s LYS 112 N 1.54 3.54 -0.18 1.54 2.20 -1.26 -2.76 119.74 124.36 2dbj s LYS 112 Ca 0.01 0.23 -0.08 0.00 -0.36 0.00 0.00 55.97 55.78 2dbj s LYS 112 Cb -0.15 -3.98 -0.04 0.00 -1.51 0.00 0.00 37.83 32.15 2dbj s LYS 112 CO -0.08 -1.50 0.07 -1.50 -0.36 0.00 0.00 175.35 171.97 2dbj s ILE 113 N 4.49 4.89 -0.30 5.43 2.07 -0.35 -4.96 121.20 132.47 2dbj s ILE 113 Ca 0.41 -0.00 -0.26 0.00 -1.41 0.00 0.00 60.65 59.40 2dbj s ILE 113 Cb -0.09 -3.20 0.01 0.00 0.13 0.00 0.00 42.46 39.31 2dbj s ILE 113 CO 0.26 0.47 0.90 0.12 -1.91 0.00 0.00 174.94 174.78 2dbj s PHE 114 N 0.28 3.20 -0.44 3.50 2.19 -1.26 -2.23 117.98 123.22 2dbj s PHE 114 Ca 0.04 1.00 -0.26 0.00 0.33 0.00 0.00 56.93 58.05 2dbj s PHE 114 Cb -0.12 -3.36 0.02 0.00 -1.31 0.00 0.00 43.02 38.26 2dbj s PHE 114 CO -0.00 -0.61 0.94 0.42 1.83 0.00 0.00 175.22 177.80 2dbj s ILE 115 N 3.18 4.48 0.09 3.12 -1.09 -0.63 -4.99 121.20 125.36 2dbj s ILE 115 Ca 0.37 0.87 -0.31 0.00 -2.23 0.00 0.00 60.65 59.36 2dbj s ILE 115 Cb -0.14 -4.42 -0.07 0.00 -1.58 0.00 0.00 42.46 36.25 2dbj s ILE 115 CO 0.12 -0.78 1.38 -2.16 -1.23 0.00 0.00 174.94 172.27 2dbj s PRO 116 N 3.74 4.32 1.05 2.79 0.04 -1.26 -0.63 135.00 145.05 2dbj s PRO 116 Ca 0.38 2.03 -0.21 0.00 0.04 0.00 0.00 61.00 63.24 2dbj s PRO 116 Cb -0.10 -3.31 -0.04 0.00 0.04 0.00 0.00 34.50 31.09 2dbj s PRO 116 CO 0.25 -0.44 -0.60 0.00 0.04 0.00 0.00 177.00 176.25 2dbj n ALA 117 N 4.19 -4.73 -2.89 8.56 0.00 -1.26 -4.38 120.51 120.00 2dbj n ALA 117 Ca 0.12 -1.19 -0.44 0.00 0.00 0.00 0.00 53.44 51.93 2dbj n ALA 117 Cb 0.43 -1.25 -0.05 0.00 0.00 0.00 0.00 19.45 18.57 2dbj n ALA 117 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2dbj s HIS 118 N -2.14 2.99 -0.10 0.00 2.46 -1.26 -4.90 115.29 112.34 2dbj s HIS 118 Ca 0.47 -0.66 -0.03 0.00 0.47 0.00 0.00 55.06 55.31 2dbj s HIS 118 Cb -0.05 -3.79 0.04 0.00 -0.13 0.00 0.00 32.58 28.65 2dbj s HIS 118 CO 0.68 -1.19 0.07 -1.54 -2.47 0.00 0.00 174.74 170.29 2dbj s SER 119 N 3.11 1.68 0.00 9.88 1.04 -1.26 -5.13 113.70 123.02 2dbj s SER 119 Ca 0.15 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.36 2dbj s SER 119 Cb -0.20 -0.22 0.00 0.00 0.10 0.00 0.00 66.02 65.70 2dbj s SER 119 CO 0.10 -0.28 0.00 0.61 0.98 0.00 0.00 173.24 174.65 2dbj n GLY 120 N 5.27 -0.34 0.00 7.32 0.00 -1.26 -4.90 105.19 111.29 2dbj n GLY 120 Ca -0.05 -1.61 0.07 0.00 0.00 0.00 0.00 46.02 44.43 2dbj n GLY 120 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dbj n PRO 121 N 0.00 0.12 -5.13 1.61 -0.04 -1.26 -4.65 135.00 125.65 2dbj n PRO 121 Ca 0.00 0.19 -0.32 0.00 -0.04 0.00 0.00 63.50 63.33 2dbj n PRO 121 Cb 0.00 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 31.81 2dbj n PRO 121 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2dbj s SER 122 N -2.75 3.40 -0.22 3.54 0.01 -1.26 -5.12 113.70 111.30 2dbj s SER 122 Ca 0.11 -0.41 -0.11 0.00 1.31 0.00 0.00 55.95 56.85 2dbj s SER 122 Cb 0.10 -0.87 -0.05 0.00 0.21 0.00 0.00 66.02 65.41 2dbj s SER 122 CO 0.24 0.27 0.19 -0.44 0.41 0.00 0.00 173.24 173.90 2dbj s SER 123 N -0.29 6.20 0.00 2.44 0.01 -1.26 -4.99 113.70 115.80 2dbj s SER 123 Ca 0.01 0.21 0.00 0.00 1.31 0.00 0.00 55.95 57.48 2dbj s SER 123 Cb -0.13 -2.12 0.00 0.00 0.21 0.00 0.00 66.02 63.98 2dbj s SER 123 CO 0.03 0.08 0.42 0.61 0.41 0.00 0.00 173.24 174.79