#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dbj h SER 2 N 0.00 -0.44 -6.94 1.61 0.87 -2.14 -3.46 113.55 103.05 2dbj h SER 2 Ca 0.00 -0.12 -0.59 0.00 -1.23 0.00 0.00 61.79 59.86 2dbj h SER 2 Cb 0.00 0.11 -0.26 0.00 -0.44 0.00 0.00 62.40 61.81 2dbj h SER 2 CO 0.00 -0.11 -0.88 -1.54 -0.53 0.00 0.00 176.83 173.76 2dbj n SER 3 N -5.21 -1.93 -4.03 6.23 3.41 -1.26 -4.91 113.62 105.92 2dbj n SER 3 Ca -0.10 -1.13 -0.31 0.00 -0.26 0.00 0.00 58.87 57.06 2dbj n SER 3 Cb 0.28 -2.20 -0.15 0.00 -0.26 0.00 0.00 64.21 61.87 2dbj n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dbj s GLY 4 N -3.52 1.68 0.28 5.00 0.00 -1.26 -5.10 107.32 104.40 2dbj s GLY 4 Ca 0.61 -1.93 0.03 0.00 0.00 0.00 0.00 44.72 43.43 2dbj s GLY 4 CO 0.97 0.76 0.06 -0.56 0.00 0.00 0.00 173.10 174.33 2dbj s SER 5 N 1.09 1.73 0.13 1.64 0.01 -1.26 -5.16 113.70 111.89 2dbj s SER 5 Ca -0.03 -1.35 -0.01 0.00 1.31 0.00 0.00 55.95 55.87 2dbj s SER 5 Cb -0.20 0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.04 2dbj s SER 5 CO -0.06 -0.65 0.31 -0.55 0.41 0.00 0.00 173.24 172.70 2dbj s SER 6 N -3.37 6.39 -0.68 2.44 0.15 -1.26 -5.02 113.70 112.35 2dbj s SER 6 Ca 0.36 0.36 -0.01 0.00 0.70 0.00 0.00 55.95 57.36 2dbj s SER 6 Cb 0.08 -1.99 0.41 0.00 -1.71 0.00 0.00 66.02 62.81 2dbj s SER 6 CO 0.13 0.06 1.90 0.61 1.20 0.00 0.00 173.24 177.14 2dbj n GLY 7 N -0.17 5.81 3.58 9.45 0.00 -1.26 -4.98 105.19 117.63 2dbj n GLY 7 Ca -0.05 -2.43 -0.41 0.00 0.00 0.00 0.00 46.02 43.13 2dbj n GLY 7 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2dbj s TRP 8 N -3.88 1.24 0.36 1.61 -0.11 -1.26 -4.93 118.94 111.97 2dbj s TRP 8 Ca 0.58 0.85 -0.27 0.00 1.22 0.00 0.00 56.10 58.48 2dbj s TRP 8 Cb 0.47 -3.86 -0.09 0.00 -1.50 0.00 0.00 33.47 28.48 2dbj s TRP 8 CO -0.16 -3.43 1.25 0.42 -4.62 0.00 0.00 176.95 170.42 2dbj s ILE 9 N 9.27 2.87 0.76 5.86 1.01 -1.26 -4.98 121.20 134.74 2dbj s ILE 9 Ca 0.96 0.83 -0.14 0.00 0.00 0.00 0.00 60.65 62.29 2dbj s ILE 9 Cb -0.26 -3.51 0.06 0.00 0.01 0.00 0.00 42.46 38.76 2dbj s ILE 9 CO 0.32 0.16 1.20 -0.76 0.00 0.00 0.00 174.94 175.86 2dbj s LEU 10 N -2.04 3.23 -1.22 2.97 1.43 -1.26 -3.40 118.68 118.38 2dbj s LEU 10 Ca 0.52 2.35 -0.06 0.00 -1.03 0.00 0.00 54.13 55.90 2dbj s LEU 10 Cb -0.37 -4.59 0.01 0.00 0.03 0.00 0.00 46.19 41.27 2dbj s LEU 10 CO 0.48 -2.43 1.06 0.00 0.23 0.00 0.00 176.35 175.68 2dbj n ALA 11 N -3.00 -1.42 -4.00 4.21 0.00 -1.26 -5.00 120.51 110.04 2dbj n ALA 11 Ca 0.13 0.25 -0.31 0.00 0.00 0.00 0.00 53.44 53.51 2dbj n ALA 11 Cb 0.50 -4.33 -0.15 0.00 0.00 0.00 0.00 19.45 15.47 2dbj n ALA 11 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2dbj s SER 12 N -3.59 4.07 0.11 0.00 0.01 -1.22 -5.11 113.70 107.97 2dbj s SER 12 Ca 0.38 -1.25 -0.01 0.00 1.31 0.00 0.00 55.95 56.39 2dbj s SER 12 Cb -0.17 -1.35 -0.04 0.00 0.21 0.00 0.00 66.02 64.68 2dbj s SER 12 CO 0.68 -0.21 0.04 0.28 0.41 0.00 0.00 173.24 174.45 2dbj s THR 13 N 1.27 0.13 -0.25 1.44 -1.32 -1.26 -5.04 115.64 110.61 2dbj s THR 13 Ca -0.07 -1.88 -0.26 0.00 -1.21 0.00 0.00 61.69 58.27 2dbj s THR 13 Cb -0.19 -1.93 0.00 0.00 -1.51 0.00 0.00 72.50 68.87 2dbj s THR 13 CO -0.06 -0.57 0.91 0.28 -2.21 0.00 0.00 174.62 172.98 2dbj s THR 14 N -4.02 4.76 0.13 5.08 -1.32 -1.26 -5.02 115.64 114.00 2dbj s THR 14 Ca 0.21 1.71 -0.16 0.00 -1.21 0.00 0.00 61.69 62.24 2dbj s THR 14 Cb 0.08 -4.20 0.03 0.00 -1.51 0.00 0.00 72.50 66.89 2dbj s THR 14 CO -0.01 -0.15 0.41 -1.61 -2.21 0.00 0.00 174.62 171.06 2dbj s GLU 15 N 3.02 1.10 -0.66 7.08 0.41 -1.26 -5.12 118.70 123.28 2dbj s GLU 15 Ca 0.39 -0.74 -0.09 0.00 -0.41 0.00 0.00 54.97 54.12 2dbj s GLU 15 Cb -0.15 0.47 0.17 0.00 -1.78 0.00 0.00 34.13 32.84 2dbj s GLU 15 CO 0.08 -0.44 0.53 0.20 -0.49 0.00 0.00 175.26 175.15 2dbj s GLY 16 N -2.82 2.45 0.09 -1.39 0.00 -1.26 -5.05 107.32 99.34 2dbj s GLY 16 Ca 0.04 -3.10 0.08 0.00 0.00 0.00 0.00 44.72 41.74 2dbj s GLY 16 CO -0.11 1.16 -0.20 0.00 0.00 0.00 0.00 173.10 173.95 2dbj s ALA 17 N 0.38 1.76 -0.89 3.20 0.00 -1.26 -4.07 121.76 120.87 2dbj s ALA 17 Ca 0.14 -1.21 -0.25 0.00 0.00 0.00 0.00 51.96 50.65 2dbj s ALA 17 Cb -0.18 -0.25 -0.05 0.00 0.00 0.00 0.00 23.12 22.64 2dbj s ALA 17 CO -0.05 0.35 1.94 -1.25 0.00 0.00 0.00 175.76 176.76 2dbj s PRO 18 N -1.81 2.56 0.00 0.00 0.04 -1.26 -4.83 135.00 129.69 2dbj s PRO 18 Ca 0.06 -0.26 -0.02 0.00 0.04 0.00 0.00 61.00 60.82 2dbj s PRO 18 Cb -0.10 -5.04 -0.10 0.00 0.04 0.00 0.00 34.50 29.30 2dbj s PRO 18 CO 0.04 -3.35 2.52 0.43 0.04 0.00 0.00 177.00 176.67 2dbj n SER 19 N 13.93 4.99 -3.72 6.66 7.64 -1.26 -3.95 113.62 137.90 2dbj n SER 19 Ca 0.39 -2.36 -0.14 0.00 1.01 0.00 0.00 58.87 57.77 2dbj n SER 19 Cb 0.47 -1.17 -0.09 0.00 -1.01 0.00 0.00 64.21 62.41 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 0.53 0.03 0.37 0.44 -7.23 -1.26 -4.97 120.40 108.31 2dbj s VAL 20 Ca 0.26 -0.23 0.07 0.00 -1.81 0.00 0.00 61.98 60.27 2dbj s VAL 20 Cb 0.12 -0.64 -0.01 0.00 0.56 0.00 0.00 36.38 36.41 2dbj s VAL 20 CO 0.00 -0.13 0.43 0.00 -0.31 0.00 0.00 175.10 175.09 2dbj s ALA 21 N -0.69 4.16 0.53 1.32 0.00 -1.26 -4.46 121.76 121.37 2dbj s ALA 21 Ca -0.08 -1.66 -0.20 0.00 0.00 0.00 0.00 51.96 50.02 2dbj s ALA 21 Cb -0.04 -1.38 -0.06 0.00 0.00 0.00 0.00 23.12 21.64 2dbj s ALA 21 CO 0.03 -0.13 1.13 -1.25 0.00 0.00 0.00 175.76 175.55 2dbj s PRO 22 N -4.16 3.40 0.62 0.00 0.04 -1.26 -4.65 135.00 129.00 2dbj s PRO 22 Ca 0.47 1.63 0.04 0.00 0.04 0.00 0.00 61.00 63.18 2dbj s PRO 22 Cb -0.07 -2.05 0.12 0.00 0.04 0.00 0.00 34.50 32.53 2dbj s PRO 22 CO 0.30 -0.81 0.86 1.28 0.04 0.00 0.00 177.00 178.66 2dbj n LEU 23 N -1.20 0.00 -3.59 -3.56 4.77 -1.19 -4.50 117.00 107.73 2dbj n LEU 23 Ca 0.11 -2.13 -0.21 0.00 -0.03 0.00 0.00 56.01 53.76 2dbj n LEU 23 Cb 0.51 -0.52 -0.06 0.00 -2.33 0.00 0.00 43.42 41.02 2dbj n LEU 23 CO 0.43 -0.85 -0.26 0.59 -1.33 0.00 0.00 177.39 175.97 2dbj n ASN 24 N -2.69 0.25 -4.57 -1.43 3.02 -1.26 -0.76 115.26 107.81 2dbj n ASN 24 Ca 0.15 -0.79 -0.43 0.00 -0.03 0.00 0.00 54.58 53.48 2dbj n ASN 24 Cb 0.56 -0.99 -0.04 0.00 -0.61 0.00 0.00 39.78 38.70 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 -3.57 4.44 0.26 2.41 1.01 -1.26 -4.02 120.40 119.67 2dbj s VAL 25 Ca 0.11 0.86 0.05 0.00 0.00 0.00 0.00 61.98 62.99 2dbj s VAL 25 Cb -0.06 -4.46 -0.06 0.00 0.00 0.00 0.00 36.38 31.81 2dbj s VAL 25 CO 0.63 -0.84 -0.01 0.42 0.00 0.00 0.00 175.10 175.30 2dbj s THR 26 N 3.85 1.26 -0.10 3.92 -4.23 0.72 -5.00 115.64 116.06 2dbj s THR 26 Ca 0.39 -2.06 -0.05 0.00 -1.18 0.00 0.00 61.69 58.79 2dbj s THR 26 Cb -0.10 -2.44 0.05 0.00 1.34 0.00 0.00 72.50 71.35 2dbj s THR 26 CO 0.27 -0.27 0.22 -0.69 -0.54 0.00 0.00 174.62 173.61 2dbj s VAL 27 N -3.27 -0.08 0.13 2.29 1.01 -1.26 -1.58 120.40 117.64 2dbj s VAL 27 Ca 0.30 0.17 0.09 0.00 0.00 0.00 0.00 61.98 62.54 2dbj s VAL 27 Cb 0.05 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 36.04 2dbj s VAL 27 CO 0.11 0.07 -0.18 -0.36 0.00 0.00 0.00 175.10 174.74 2dbj s PHE 28 N 1.38 2.52 -0.13 5.22 0.40 0.00 -5.00 117.98 122.37 2dbj s PHE 28 Ca -0.08 -0.27 -0.01 0.00 -0.60 0.00 0.00 56.93 55.97 2dbj s PHE 28 Cb -0.11 -1.33 -0.02 0.00 0.51 0.00 0.00 43.02 42.08 2dbj s PHE 28 CO -0.08 0.40 -0.11 -1.17 0.70 0.00 0.00 175.22 174.96 2dbj s LEU 29 N -2.22 2.86 -0.33 -0.37 2.96 -1.26 -0.02 118.68 120.30 2dbj s LEU 29 Ca 0.18 -0.26 -0.17 0.00 -0.22 0.00 0.00 54.13 53.66 2dbj s LEU 29 Cb -0.10 -1.65 -0.01 0.00 0.50 0.00 0.00 46.19 44.93 2dbj s LEU 29 CO 0.10 0.18 0.48 0.20 -1.32 0.00 0.00 176.35 176.00 2dbj s ASN 30 N 0.24 6.31 0.00 3.68 -0.87 -0.94 -4.94 114.94 118.43 2dbj s ASN 30 Ca -0.07 0.06 -0.09 0.00 -1.57 0.00 0.00 52.86 51.18 2dbj s ASN 30 Cb -0.15 -2.26 -0.31 0.00 -0.02 0.00 0.00 41.25 38.52 2dbj s ASN 30 CO 0.05 -0.41 0.87 -0.33 -2.57 0.00 0.00 177.10 174.71 2dbj h GLU 31 N 8.37 0.37 0.00 -0.60 3.07 -1.97 -3.32 114.58 120.51 2dbj h GLU 31 Ca -0.29 -0.63 -0.08 0.00 -0.50 0.00 0.00 59.36 57.86 2dbj h GLU 31 Cb 1.13 0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 29.27 2dbj h GLU 31 CO 0.74 1.27 -0.37 0.77 -1.40 0.00 0.00 179.01 180.02 2dbj h SER 32 N 0.10 0.00 -4.28 1.42 0.02 -1.97 -3.42 113.55 105.42 2dbj h SER 32 Ca -0.27 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.17 2dbj h SER 32 Cb 2.08 0.00 -0.28 0.00 0.14 0.00 0.00 62.40 64.34 2dbj h SER 32 CO 0.20 0.37 -0.82 -0.44 -1.14 0.00 0.00 176.83 175.00 2dbj s SER 33 N -6.72 1.92 -1.18 3.07 0.01 -1.25 -4.72 113.70 104.84 2dbj s SER 33 Ca -0.02 -0.36 -0.18 0.00 1.31 0.00 0.00 55.95 56.70 2dbj s SER 33 Cb 0.13 -0.19 -0.03 0.00 0.21 0.00 0.00 66.02 66.14 2dbj s SER 33 CO 0.70 0.16 2.01 0.47 0.41 0.00 0.00 173.24 176.99 2dbj n ASP 34 N 2.40 3.53 -3.51 2.44 9.92 -1.26 -4.43 116.55 125.63 2dbj n ASP 34 Ca -0.16 -2.78 -0.14 0.00 -0.53 0.00 0.00 54.79 51.18 2dbj n ASP 34 Cb 0.54 -1.51 -0.05 0.00 -0.64 0.00 0.00 41.12 39.46 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 4.38 -0.55 -0.11 -2.24 2.20 -1.26 -2.97 114.94 114.40 2dbj s ASN 35 Ca 0.54 0.46 0.01 0.00 -0.94 0.00 0.00 52.86 52.93 2dbj s ASN 35 Cb 0.10 0.49 -0.02 0.00 -2.00 0.00 0.00 41.25 39.82 2dbj s ASN 35 CO 0.04 -0.62 -0.13 -0.69 -2.94 0.00 0.00 177.10 172.75 2dbj s VAL 36 N -1.81 3.05 0.10 3.54 1.01 -0.34 -2.20 120.40 123.74 2dbj s VAL 36 Ca -0.05 -0.68 -0.09 0.00 0.00 0.00 0.00 61.98 61.16 2dbj s VAL 36 Cb -0.00 -2.25 -0.06 0.00 0.00 0.00 0.00 36.38 34.07 2dbj s VAL 36 CO 0.02 0.54 0.40 -1.81 0.00 0.00 0.00 175.10 174.26 2dbj s ASP 37 N 0.04 6.61 -0.02 3.32 1.01 0.98 -1.19 116.67 127.42 2dbj s ASP 37 Ca -0.05 0.76 -0.00 0.00 0.71 0.00 0.00 52.55 53.97 2dbj s ASP 37 Cb -0.14 -2.16 0.03 0.00 1.01 0.00 0.00 42.92 41.65 2dbj s ASP 37 CO 0.04 0.14 0.04 -0.63 0.21 0.00 0.00 175.17 174.97 2dbj s ILE 38 N -1.47 -0.06 0.00 0.77 1.09 0.32 -0.82 121.20 121.04 2dbj s ILE 38 Ca 0.35 0.22 0.04 0.00 -1.10 0.00 0.00 60.65 60.16 2dbj s ILE 38 Cb -0.13 -0.09 -0.01 0.00 -1.06 0.00 0.00 42.46 41.17 2dbj s ILE 38 CO 0.19 0.09 -0.11 -0.60 -0.10 0.00 0.00 174.94 174.41 2dbj s ARG 39 N 1.08 0.88 0.20 2.79 6.06 -0.61 -1.41 118.95 127.94 2dbj s ARG 39 Ca -0.09 -0.48 0.01 0.00 -2.50 0.00 0.00 55.73 52.66 2dbj s ARG 39 Cb -0.13 -0.85 -0.00 0.00 0.06 0.00 0.00 34.95 34.03 2dbj s ARG 39 CO -0.03 0.23 0.24 -2.67 -2.50 0.00 0.00 175.30 170.57 2dbj n TRP 40 N 2.56 -0.85 -4.34 5.12 2.14 -1.24 -0.20 117.44 120.63 2dbj n TRP 40 Ca -0.15 -1.42 -0.18 0.00 2.07 0.00 0.00 57.50 57.83 2dbj n TRP 40 Cb 0.56 0.27 -0.10 0.00 -0.81 0.00 0.00 31.31 31.23 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 -2.55 1.35 0.14 -2.67 -1.94 0.06 -4.90 119.30 108.79 2dbj s MET 41 Ca 0.18 -1.67 -0.28 0.00 -1.71 0.00 0.00 55.69 52.21 2dbj s MET 41 Cb -0.00 -0.73 -0.07 0.00 2.01 0.00 0.00 34.83 36.04 2dbj s MET 41 CO 0.13 -0.05 0.87 0.21 -0.01 0.00 0.00 175.02 176.17 2dbj s LYS 42 N -3.82 4.66 0.59 2.03 2.36 -1.26 -3.19 119.74 121.11 2dbj s LYS 42 Ca 0.27 1.31 -0.17 0.00 -2.55 0.00 0.00 55.97 54.83 2dbj s LYS 42 Cb 0.05 -3.32 -0.03 0.00 -1.05 0.00 0.00 37.83 33.47 2dbj s LYS 42 CO 0.08 0.39 1.12 -1.25 1.55 0.00 0.00 175.35 177.24 2dbj s PRO 43 N -0.57 3.11 0.00 4.03 0.04 -1.26 -4.61 135.00 135.73 2dbj s PRO 43 Ca 0.41 1.51 0.08 0.00 0.04 0.00 0.00 61.00 63.05 2dbj s PRO 43 Cb -0.23 -1.98 0.49 0.00 0.04 0.00 0.00 34.50 32.82 2dbj s PRO 43 CO 0.28 -1.03 0.94 -0.35 0.04 0.00 0.00 177.00 176.89 2dbj n PRO 44 N -1.80 0.49 -1.37 0.56 -0.04 -1.26 -4.87 135.00 126.71 2dbj n PRO 44 Ca 0.11 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.16 2dbj n PRO 44 Cb 0.51 -1.27 0.01 0.00 -0.04 0.00 0.00 33.50 32.72 2dbj n PRO 44 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 2dbj n THR 45 N -0.77 1.17 -4.39 0.52 5.66 -1.26 -5.00 114.28 110.22 2dbj n THR 45 Ca 0.06 -0.50 -0.20 0.00 -3.05 0.00 0.00 64.05 60.36 2dbj n THR 45 Cb 0.03 -0.27 -0.06 0.00 -1.55 0.00 0.00 70.33 68.48 2dbj n THR 45 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2dbj n LYS 46 N 0.92 0.63 -0.14 1.09 4.76 -1.26 -4.99 118.16 119.16 2dbj n LYS 46 Ca 0.11 -2.80 0.27 0.00 -2.87 0.00 0.00 58.31 53.02 2dbj n LYS 46 Cb 0.41 1.57 0.59 0.00 -1.84 0.00 0.00 35.03 35.77 2dbj n LYS 46 CO 0.00 0.00 0.00 -0.56 -1.37 0.00 0.00 177.40 175.47 2dbj h GLN 47 N 0.00 0.00 -0.68 1.97 3.07 -1.95 0.23 115.11 117.74 2dbj h GLN 47 Ca -0.25 0.00 0.12 0.00 0.09 0.00 0.00 58.65 58.60 2dbj h GLN 47 Cb 0.99 0.00 -0.08 0.00 0.08 0.00 0.00 27.48 28.46 2dbj h GLN 47 CO 0.40 0.00 0.26 0.37 0.09 0.00 0.00 178.83 179.95 2dbj h GLN 48 N 0.00 0.42 0.10 0.06 5.75 -2.00 -2.92 115.11 116.52 2dbj h GLN 48 Ca 0.42 -0.03 -0.26 0.00 -0.15 0.00 0.00 58.65 58.64 2dbj h GLN 48 Cb 2.29 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 30.74 2dbj h GLN 48 CO -0.00 0.28 -1.32 0.22 -2.65 0.00 0.00 178.83 175.35 2dbj h ASP 49 N 0.43 0.32 0.00 -0.69 3.58 -0.94 -3.50 116.42 115.63 2dbj h ASP 49 Ca 0.36 -0.83 0.00 0.00 0.42 0.00 0.00 57.03 56.98 2dbj h ASP 49 Cb 0.49 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.44 2dbj h ASP 49 CO -0.35 1.57 0.00 0.61 -2.88 0.00 0.00 179.24 178.19 2dbj n GLY 50 N 1.71 0.53 2.90 -0.78 0.00 -1.00 -4.72 105.19 103.82 2dbj n GLY 50 Ca -0.25 -0.80 -0.16 0.00 0.00 0.00 0.00 46.02 44.81 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 0.40 -0.00 1.61 -1.05 -1.26 -4.29 118.70 114.10 2dbj s GLU 51 Ca 0.00 -0.07 -0.29 0.00 -0.15 0.00 0.00 54.97 54.45 2dbj s GLU 51 Cb 0.00 -0.45 -0.03 0.00 -0.44 0.00 0.00 34.13 33.20 2dbj s GLU 51 CO 0.00 -0.01 0.95 -1.17 0.95 0.00 0.00 175.26 175.98 2dbj s LEU 52 N 0.40 4.37 -0.00 1.83 0.20 -1.26 -3.27 118.68 120.94 2dbj s LEU 52 Ca -0.04 1.61 0.14 0.00 0.69 0.00 0.00 54.13 56.53 2dbj s LEU 52 Cb -0.07 -3.52 -0.16 0.00 -0.43 0.00 0.00 46.19 42.01 2dbj s LEU 52 CO -0.01 -0.24 0.52 1.33 -0.29 0.00 0.00 176.35 177.67 2dbj n VAL 53 N 3.84 0.00 -3.78 1.68 0.24 -0.22 -4.85 118.33 115.24 2dbj n VAL 53 Ca 0.05 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 2dbj n VAL 53 Cb 0.51 0.83 0.00 0.00 -1.47 0.00 0.00 33.84 33.71 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 1.40 -0.62 3.31 7.63 0.00 -1.15 0.53 105.19 116.28 2dbj n GLY 54 Ca 0.02 -1.02 -0.17 0.00 0.00 0.00 0.00 46.02 44.84 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 -3.00 1.54 -0.26 1.61 1.51 -0.96 -0.28 117.35 117.50 2dbj s TYR 55 Ca 0.00 -1.37 0.00 0.00 -1.01 0.00 0.00 57.07 54.69 2dbj s TYR 55 Cb 0.00 -0.81 0.08 0.00 -0.11 0.00 0.00 41.96 41.12 2dbj s TYR 55 CO 0.00 -0.54 0.02 1.03 -1.11 0.00 0.00 175.55 174.94 2dbj s ARG 56 N -3.87 1.18 -0.40 -0.62 0.52 0.33 -3.30 118.95 112.79 2dbj s ARG 56 Ca 0.37 -1.01 -0.18 0.00 -0.52 0.00 0.00 55.73 54.39 2dbj s ARG 56 Cb 0.05 -2.41 0.01 0.00 0.52 0.00 0.00 34.95 33.13 2dbj s ARG 56 CO 0.17 -0.75 0.48 0.42 0.02 0.00 0.00 175.30 175.64 2dbj s ILE 57 N 1.48 5.03 -0.34 1.52 1.01 -1.25 -1.58 121.20 127.09 2dbj s ILE 57 Ca 0.01 -0.10 -0.09 0.00 0.00 0.00 0.00 60.65 60.47 2dbj s ILE 57 Cb -0.18 -4.04 0.02 0.00 0.01 0.00 0.00 42.46 38.27 2dbj s ILE 57 CO -0.12 -0.39 0.14 -0.55 0.00 0.00 0.00 174.94 174.03 2dbj s SER 58 N 1.83 5.46 -0.27 3.58 0.15 0.56 -1.00 113.70 124.02 2dbj s SER 58 Ca 0.15 -0.88 0.02 0.00 0.70 0.00 0.00 55.95 55.94 2dbj s SER 58 Cb -0.16 -1.95 0.06 0.00 -1.71 0.00 0.00 66.02 62.26 2dbj s SER 58 CO 0.14 -0.29 -0.09 -1.38 1.20 0.00 0.00 173.24 172.82 2dbj s HIS 59 N 1.52 3.26 0.11 3.44 -3.43 -1.07 -2.44 115.29 116.68 2dbj s HIS 59 Ca 0.02 -2.21 0.03 0.00 -0.80 0.00 0.00 55.06 52.10 2dbj s HIS 59 Cb -0.18 -1.97 -0.04 0.00 -1.43 0.00 0.00 32.58 28.96 2dbj s HIS 59 CO 0.05 -0.86 0.13 0.08 -2.00 0.00 0.00 174.74 172.14 2dbj s VAL 60 N 1.14 4.67 -0.11 -5.38 1.01 -1.18 -1.82 120.40 118.72 2dbj s VAL 60 Ca -0.08 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.10 2dbj s VAL 60 Cb -0.20 -3.31 0.01 0.00 0.00 0.00 0.00 36.38 32.88 2dbj s VAL 60 CO -0.04 0.03 -0.21 0.26 0.00 0.00 0.00 175.10 175.14 2dbj s TRP 61 N -1.55 2.36 -0.18 5.22 0.52 0.72 -2.35 118.94 123.68 2dbj s TRP 61 Ca 0.31 -1.05 -0.01 0.00 0.02 0.00 0.00 56.10 55.37 2dbj s TRP 61 Cb -0.11 -1.61 0.05 0.00 -1.15 0.00 0.00 33.47 30.64 2dbj s TRP 61 CO 0.24 -0.46 -0.03 -0.65 0.02 0.00 0.00 176.95 176.06 2dbj s GLN 62 N 0.62 1.28 0.18 4.98 -0.21 -0.90 -0.61 119.66 125.00 2dbj s GLN 62 Ca -0.13 -0.54 0.07 0.00 0.02 0.00 0.00 55.36 54.78 2dbj s GLN 62 Cb -0.17 -2.06 -0.04 0.00 1.00 0.00 0.00 33.01 31.74 2dbj s GLN 62 CO 0.04 -0.49 -0.15 0.45 -2.12 0.00 0.00 175.29 173.02 2dbj s SER 63 N 1.66 2.46 -0.52 5.90 0.15 0.17 -1.80 113.70 121.72 2dbj s SER 63 Ca -0.00 -0.94 -0.26 0.00 0.70 0.00 0.00 55.95 55.44 2dbj s SER 63 Cb -0.16 -0.12 -0.06 0.00 -1.71 0.00 0.00 66.02 63.97 2dbj s SER 63 CO -0.07 -0.14 2.26 0.00 1.20 0.00 0.00 173.24 176.49 2dbj s ALA 64 N -2.61 1.80 0.00 5.45 0.00 -1.26 -1.23 121.76 123.91 2dbj s ALA 64 Ca 0.18 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.00 2dbj s ALA 64 Cb -0.03 -4.33 0.00 0.00 0.00 0.00 0.00 23.12 18.76 2dbj s ALA 64 CO 0.06 -4.28 0.00 0.41 0.00 0.00 0.00 175.76 171.95 2dbj n GLY 65 N 5.92 2.76 2.79 0.00 0.00 -1.26 -5.05 105.19 110.35 2dbj n GLY 65 Ca 0.32 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.13 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 -2.49 0.32 -0.27 -0.61 -1.09 -0.36 -5.11 121.20 111.59 2dbj s ILE 66 Ca 0.00 0.10 0.00 0.00 -2.23 0.00 0.00 60.65 58.52 2dbj s ILE 66 Cb 0.00 -0.45 0.08 0.00 -1.58 0.00 0.00 42.46 40.51 2dbj s ILE 66 CO 0.00 0.23 0.03 -0.94 -1.23 0.00 0.00 174.94 173.02 2dbj s SER 67 N 1.63 3.91 0.25 3.58 1.04 -1.26 0.44 113.70 123.29 2dbj s SER 67 Ca -0.01 -1.42 0.12 0.00 0.48 0.00 0.00 55.95 55.12 2dbj s SER 67 Cb -0.13 -1.05 -0.05 0.00 0.10 0.00 0.00 66.02 64.89 2dbj s SER 67 CO -0.03 -0.33 -0.21 -0.54 0.98 0.00 0.00 173.24 173.10 2dbj s LYS 68 N 1.47 1.62 -0.06 4.02 1.02 0.22 -5.01 119.74 123.01 2dbj s LYS 68 Ca 0.03 -1.68 -0.01 0.00 0.02 0.00 0.00 55.97 54.33 2dbj s LYS 68 Cb -0.18 -1.79 0.03 0.00 -0.52 0.00 0.00 37.83 35.36 2dbj s LYS 68 CO -0.13 0.36 -0.01 -1.83 -0.92 0.00 0.00 175.35 172.82 2dbj s GLU 69 N -3.19 0.64 0.16 1.68 -1.05 -1.26 -0.20 118.70 115.47 2dbj s GLU 69 Ca 0.26 0.06 0.06 0.00 -0.15 0.00 0.00 54.97 55.21 2dbj s GLU 69 Cb -0.06 -0.92 -0.04 0.00 -0.44 0.00 0.00 34.13 32.67 2dbj s GLU 69 CO 0.13 -0.25 0.02 -0.51 0.95 0.00 0.00 175.26 175.60 2dbj s LEU 70 N 1.70 3.41 -0.07 1.83 2.01 -0.76 -4.96 118.68 121.84 2dbj s LEU 70 Ca 0.01 -0.31 -0.01 0.00 0.01 0.00 0.00 54.13 53.83 2dbj s LEU 70 Cb -0.13 -2.08 0.03 0.00 0.01 0.00 0.00 46.19 44.02 2dbj s LEU 70 CO -0.04 0.10 -0.02 -0.22 1.01 0.00 0.00 176.35 177.19 2dbj s LEU 71 N -2.84 0.79 0.30 1.79 1.98 -1.26 -2.59 118.68 116.85 2dbj s LEU 71 Ca 0.28 -0.12 0.04 0.00 -2.89 0.00 0.00 54.13 51.43 2dbj s LEU 71 Cb -0.10 -0.50 -0.02 0.00 0.66 0.00 0.00 46.19 46.22 2dbj s LEU 71 CO 0.19 -0.16 0.45 -0.70 -1.89 0.00 0.00 176.35 174.24 2dbj s GLU 72 N 1.77 3.35 -0.08 1.98 2.12 -0.17 -5.00 118.70 122.68 2dbj s GLU 72 Ca 0.03 -0.69 -0.00 0.00 0.36 0.00 0.00 54.97 54.66 2dbj s GLU 72 Cb -0.13 -2.79 0.03 0.00 0.26 0.00 0.00 34.13 31.49 2dbj s GLU 72 CO -0.05 0.23 -0.04 -1.21 -0.54 0.00 0.00 175.26 173.65 2dbj s GLU 73 N -4.15 1.06 0.11 4.30 2.02 -1.26 -3.76 118.70 117.01 2dbj s GLU 73 Ca 0.39 -0.09 0.05 0.00 0.02 0.00 0.00 54.97 55.34 2dbj s GLU 73 Cb -0.09 -1.22 -0.04 0.00 0.10 0.00 0.00 34.13 32.88 2dbj s GLU 73 CO 0.32 -0.24 -0.13 0.14 0.02 0.00 0.00 175.26 175.37 2dbj s VAL 74 N 1.67 1.16 0.00 2.63 -7.23 -1.21 -5.02 120.40 112.40 2dbj s VAL 74 Ca 0.02 -1.62 0.00 0.00 -1.81 0.00 0.00 61.98 58.57 2dbj s VAL 74 Cb -0.13 -1.40 0.00 0.00 0.56 0.00 0.00 36.38 35.42 2dbj s VAL 74 CO -0.05 -0.43 0.00 0.61 -0.31 0.00 0.00 175.10 174.91 2dbj n GLY 75 N 0.66 3.18 0.29 2.32 0.00 -1.26 -2.27 105.19 108.11 2dbj n GLY 75 Ca -0.17 -2.10 0.02 0.00 0.00 0.00 0.00 46.02 43.77 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 0.53 -4.51 1.61 3.07 -0.22 -3.33 115.11 112.25 2dbj h GLN 76 Ca 0.00 -0.08 -0.72 0.00 0.09 0.00 0.00 58.65 57.94 2dbj h GLN 76 Cb 0.00 -0.10 -0.21 0.00 0.08 0.00 0.00 27.48 27.25 2dbj h GLN 76 CO 0.00 0.47 -0.11 -0.80 0.09 0.00 0.00 178.83 178.49 2dbj s ASN 77 N -6.71 6.18 0.00 0.06 -0.87 -1.26 -4.56 114.94 107.78 2dbj s ASN 77 Ca -0.08 -1.35 0.00 0.00 -1.57 0.00 0.00 52.86 49.86 2dbj s ASN 77 Cb 0.16 -2.24 0.00 0.00 -0.02 0.00 0.00 41.25 39.15 2dbj s ASN 77 CO 0.75 -0.87 0.00 0.61 -2.57 0.00 0.00 177.10 175.02 2dbj n GLY 78 N 5.22 0.00 0.30 0.66 0.00 -1.26 -5.02 105.19 105.10 2dbj n GLY 78 Ca -0.11 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.20 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 0.25 -4.58 1.61 7.64 -1.26 -3.90 113.62 113.38 2dbj n SER 79 Ca 0.00 1.29 -0.35 0.00 1.01 0.00 0.00 58.87 60.83 2dbj n SER 79 Cb 0.00 -0.63 -0.11 0.00 -1.01 0.00 0.00 64.21 62.46 2dbj n SER 79 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2dbj s ARG 80 N -5.16 3.87 0.01 1.43 3.52 -1.26 -3.68 118.95 117.69 2dbj s ARG 80 Ca -0.07 -0.39 0.07 0.00 -0.13 0.00 0.00 55.73 55.20 2dbj s ARG 80 Cb 0.27 -3.19 -0.02 0.00 -1.56 0.00 0.00 34.95 30.45 2dbj s ARG 80 CO 0.65 0.19 -0.20 0.00 -0.81 0.00 0.00 175.30 175.13 2dbj s ALA 81 N 0.59 1.66 -0.03 6.12 0.00 -0.50 -4.99 121.76 124.61 2dbj s ALA 81 Ca 0.02 -0.94 0.04 0.00 0.00 0.00 0.00 51.96 51.09 2dbj s ALA 81 Cb -0.13 -0.37 -0.01 0.00 0.00 0.00 0.00 23.12 22.61 2dbj s ALA 81 CO 0.01 0.39 -0.16 0.50 0.00 0.00 0.00 175.76 176.50 2dbj s ARG 82 N -0.81 1.55 0.36 0.00 3.52 -1.26 -0.52 118.95 121.79 2dbj s ARG 82 Ca 0.07 -0.57 0.09 0.00 -0.13 0.00 0.00 55.73 55.19 2dbj s ARG 82 Cb -0.08 -1.40 -0.06 0.00 -1.56 0.00 0.00 34.95 31.84 2dbj s ARG 82 CO 0.00 0.27 -0.02 0.42 -0.81 0.00 0.00 175.30 175.16 2dbj s ILE 83 N -0.09 2.31 -0.37 4.11 1.01 -0.33 -4.93 121.20 122.91 2dbj s ILE 83 Ca -0.00 -2.05 -0.08 0.00 0.00 0.00 0.00 60.65 58.51 2dbj s ILE 83 Cb -0.09 -2.79 0.05 0.00 0.01 0.00 0.00 42.46 39.64 2dbj s ILE 83 CO 0.01 -0.14 0.18 -0.44 0.00 0.00 0.00 174.94 174.54 2dbj s SER 84 N -3.68 5.50 -0.40 3.58 0.01 -1.26 -1.20 113.70 116.24 2dbj s SER 84 Ca 0.34 -1.26 -0.35 0.00 1.31 0.00 0.00 55.95 56.00 2dbj s SER 84 Cb 0.03 -1.93 -0.15 0.00 0.21 0.00 0.00 66.02 64.18 2dbj s SER 84 CO 0.18 -0.41 1.71 0.52 0.41 0.00 0.00 173.24 175.65 2dbj n VAL 85 N 4.87 0.00 0.06 3.43 0.31 -1.16 -4.79 118.33 121.05 2dbj n VAL 85 Ca -0.11 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.05 2dbj n VAL 85 Cb 0.44 -0.40 -0.14 0.00 -0.91 0.00 0.00 33.84 32.83 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 7.20 0.25 -4.60 5.55 1.08 -1.95 -3.47 115.11 119.17 2dbj h GLN 86 Ca -0.08 -0.43 -0.36 0.00 -1.45 0.00 0.00 58.65 56.33 2dbj h GLN 86 Cb 1.13 0.16 -0.27 0.00 -0.05 0.00 0.00 27.48 28.45 2dbj h GLN 86 CO 0.87 1.11 -0.77 0.08 -0.95 0.00 0.00 178.83 179.17 2dbj s VAL 87 N -2.61 0.61 0.06 -0.54 1.01 -1.26 -5.15 120.40 112.52 2dbj s VAL 87 Ca -0.10 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 61.45 2dbj s VAL 87 Cb 0.07 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 2dbj s VAL 87 CO 0.85 0.08 -0.02 -1.00 0.00 0.00 0.00 175.10 175.00 2dbj s HIS 88 N -0.38 2.97 -0.83 5.22 3.76 -1.26 -4.57 115.29 120.19 2dbj s HIS 88 Ca 0.01 -0.02 -0.05 0.00 -0.15 0.00 0.00 55.06 54.85 2dbj s HIS 88 Cb -0.04 -1.56 0.01 0.00 1.11 0.00 0.00 32.58 32.09 2dbj s HIS 88 CO -0.00 0.45 0.61 -1.71 -0.85 0.00 0.00 174.74 173.24 2dbj n ASN 89 N 0.90 -4.49 -3.91 1.40 2.85 0.09 -4.85 115.26 107.24 2dbj n ASN 89 Ca -0.12 -0.28 -0.20 0.00 -0.11 0.00 0.00 54.58 53.87 2dbj n ASN 89 Cb 0.52 -3.15 -0.09 0.00 1.24 0.00 0.00 39.78 38.30 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 -3.11 2.06 -0.36 5.20 0.00 -1.18 -4.82 121.76 119.53 2dbj s ALA 90 Ca 0.30 -1.74 -0.12 0.00 0.00 0.00 0.00 51.96 50.41 2dbj s ALA 90 Cb -0.13 1.15 0.01 0.00 0.00 0.00 0.00 23.12 24.15 2dbj s ALA 90 CO 0.37 -0.51 0.22 0.95 0.00 0.00 0.00 175.76 176.79 2dbj s THR 91 N -3.54 4.86 -0.15 0.00 -4.23 -0.74 -1.07 115.64 110.77 2dbj s THR 91 Ca 0.35 -0.60 -0.06 0.00 -1.18 0.00 0.00 61.69 60.20 2dbj s THR 91 Cb 0.04 -3.62 -0.04 0.00 1.34 0.00 0.00 72.50 70.22 2dbj s THR 91 CO 0.19 -0.14 0.05 0.00 -0.54 0.00 0.00 174.62 174.17 2dbj s THR 93 N -0.06 3.42 -0.01 0.00 2.01 -0.99 -1.29 115.64 118.72 2dbj s THR 93 Ca 0.06 -0.86 -0.15 0.00 0.31 0.00 0.00 61.69 61.04 2dbj s THR 93 Cb -0.12 -2.75 -0.06 0.00 0.01 0.00 0.00 72.50 69.58 2dbj s THR 93 CO 0.01 0.13 0.43 -0.69 -0.69 0.00 0.00 174.62 173.82 2dbj s VAL 94 N 1.41 5.02 -0.21 3.82 1.01 -1.17 -3.13 120.40 127.15 2dbj s VAL 94 Ca 0.01 0.88 -0.09 0.00 0.00 0.00 0.00 61.98 62.78 2dbj s VAL 94 Cb -0.17 -3.74 0.09 0.00 0.00 0.00 0.00 36.38 32.56 2dbj s VAL 94 CO -0.01 0.55 0.47 -0.13 0.00 0.00 0.00 175.10 175.98 2dbj s ARG 95 N -0.88 0.42 -0.02 2.72 0.52 -1.02 -3.21 118.95 117.47 2dbj s ARG 95 Ca 0.24 1.04 0.05 0.00 -0.52 0.00 0.00 55.73 56.54 2dbj s ARG 95 Cb -0.17 0.28 -0.03 0.00 0.52 0.00 0.00 34.95 35.55 2dbj s ARG 95 CO 0.13 -0.21 -0.15 0.42 0.02 0.00 0.00 175.30 175.52 2dbj s ILE 96 N 2.19 2.99 0.14 1.52 1.01 -1.26 -0.32 121.20 127.47 2dbj s ILE 96 Ca -0.05 -0.88 0.04 0.00 0.00 0.00 0.00 60.65 59.76 2dbj s ILE 96 Cb -0.10 -2.20 -0.04 0.00 0.01 0.00 0.00 42.46 40.12 2dbj s ILE 96 CO -0.14 0.50 -0.10 0.00 0.00 0.00 0.00 174.94 175.20 2dbj s ALA 97 N -0.80 1.44 -0.13 9.38 0.00 -0.61 -1.56 121.76 129.47 2dbj s ALA 97 Ca 0.13 -1.48 -0.18 0.00 0.00 0.00 0.00 51.96 50.43 2dbj s ALA 97 Cb -0.11 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 2dbj s ALA 97 CO 0.02 -0.09 0.47 0.00 0.00 0.00 0.00 175.76 176.16 2dbj s ALA 98 N -3.28 3.48 -0.10 0.00 0.00 -1.26 -0.51 121.76 120.09 2dbj s ALA 98 Ca 0.16 -0.22 -0.01 0.00 0.00 0.00 0.00 51.96 51.90 2dbj s ALA 98 Cb 0.02 -2.65 -0.03 0.00 0.00 0.00 0.00 23.12 20.47 2dbj s ALA 98 CO 0.00 -0.03 -0.06 0.08 0.00 0.00 0.00 175.76 175.76 2dbj s VAL 99 N 0.69 3.78 0.41 0.00 1.01 0.61 -2.48 120.40 124.42 2dbj s VAL 99 Ca 0.25 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.82 2dbj s VAL 99 Cb -0.15 -2.59 -0.01 0.00 0.00 0.00 0.00 36.38 33.64 2dbj s VAL 99 CO 0.10 0.56 0.08 0.35 0.00 0.00 0.00 175.10 176.19 2dbj n THR 100 N 2.72 0.00 1.71 3.92 -2.24 -1.11 -1.06 114.28 118.22 2dbj n THR 100 Ca -0.18 -2.19 0.00 0.00 -2.27 0.00 0.00 64.05 59.42 2dbj n THR 100 Cb 0.53 0.65 0.01 0.00 -2.10 0.00 0.00 70.33 69.41 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 -0.97 1.04 0.00 -0.78 1.74 -1.20 -3.76 116.66 112.73 2dbj n ARG 101 Ca -0.11 -0.05 0.00 0.00 -0.77 0.00 0.00 57.85 56.92 2dbj n ARG 101 Cb 0.57 -1.14 0.00 0.00 -1.02 0.00 0.00 32.46 30.88 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 0.40 0.00 3.88 -0.13 0.00 -1.26 -5.10 105.19 102.97 2dbj n GLY 102 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 2dbj n GLY 102 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dbj s GLY 103 N -4.59 -0.14 -0.18 -0.02 0.00 -1.25 -4.94 107.32 96.20 2dbj s GLY 103 Ca 0.00 0.10 -0.12 0.00 0.00 0.00 0.00 44.72 44.70 2dbj s GLY 103 CO 0.00 3.56 0.22 0.54 0.00 0.00 0.00 173.10 177.41 2dbj s VAL 104 N -2.18 5.36 0.76 1.40 0.11 -1.26 -2.74 120.40 121.84 2dbj s VAL 104 Ca 0.24 0.38 -0.06 0.00 -2.93 0.00 0.00 61.98 59.60 2dbj s VAL 104 Cb 0.00 -3.56 0.16 0.00 -1.53 0.00 0.00 36.38 31.46 2dbj s VAL 104 CO 0.00 0.41 1.04 0.61 -3.33 0.00 0.00 175.10 173.83 2dbj n GLY 105 N 3.47 -0.19 3.77 6.54 0.00 -1.03 -4.83 105.19 112.92 2dbj n GLY 105 Ca -0.14 -1.90 -0.37 0.00 0.00 0.00 0.00 46.02 43.61 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 -5.19 3.83 0.66 1.61 0.04 -1.26 -4.65 135.00 130.04 2dbj s PRO 106 Ca 0.64 1.80 -0.12 0.00 0.04 0.00 0.00 61.00 63.37 2dbj s PRO 106 Cb -0.03 -2.48 -0.01 0.00 0.04 0.00 0.00 34.50 32.02 2dbj s PRO 106 CO 0.44 -0.50 1.05 -0.06 0.04 0.00 0.00 177.00 177.96 2dbj s PHE 107 N -1.51 3.21 0.57 0.56 0.40 -1.26 -4.31 117.98 115.65 2dbj s PHE 107 Ca 0.62 1.41 -0.10 0.00 -0.60 0.00 0.00 56.93 58.26 2dbj s PHE 107 Cb -0.29 -2.86 0.14 0.00 0.51 0.00 0.00 43.02 40.51 2dbj s PHE 107 CO 0.36 -1.07 0.63 -1.13 0.70 0.00 0.00 175.22 174.71 2dbj n SER 108 N -2.84 -0.74 -4.66 1.36 3.41 -0.60 -4.89 113.62 104.66 2dbj n SER 108 Ca 0.07 -1.05 -0.42 0.00 -0.26 0.00 0.00 58.87 57.21 2dbj n SER 108 Cb 0.54 -0.53 -0.03 0.00 -0.26 0.00 0.00 64.21 63.93 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 -3.29 6.52 0.46 4.04 -4.77 -1.26 -4.79 116.67 113.58 2dbj s ASP 109 Ca 0.38 2.53 -0.23 0.00 -3.30 0.00 0.00 52.55 51.94 2dbj s ASP 109 Cb -0.02 -2.53 -0.07 0.00 -1.09 0.00 0.00 42.92 39.20 2dbj s ASP 109 CO 0.28 -1.01 1.16 -2.16 0.70 0.00 0.00 175.17 174.14 2dbj s PRO 110 N 4.31 3.75 -0.14 2.11 0.04 -1.26 -4.91 135.00 138.89 2dbj s PRO 110 Ca 0.83 1.77 -0.01 0.00 0.04 0.00 0.00 61.00 63.63 2dbj s PRO 110 Cb -0.40 -2.40 0.04 0.00 0.04 0.00 0.00 34.50 31.79 2dbj s PRO 110 CO 0.38 -0.56 -0.03 0.54 0.04 0.00 0.00 177.00 177.36 2dbj s VAL 111 N -1.55 0.88 -0.56 -0.36 0.11 -1.20 -5.00 120.40 112.72 2dbj s VAL 111 Ca 0.64 -0.42 -0.26 0.00 -2.93 0.00 0.00 61.98 59.01 2dbj s VAL 111 Cb -0.28 -1.07 0.04 0.00 -1.53 0.00 0.00 36.38 33.53 2dbj s VAL 111 CO 0.34 0.15 1.05 -0.75 -3.33 0.00 0.00 175.10 172.56 2dbj s LYS 112 N 1.74 3.42 -0.20 1.54 2.20 -1.26 -3.03 119.74 124.15 2dbj s LYS 112 Ca 0.02 -0.02 -0.08 0.00 -0.36 0.00 0.00 55.97 55.53 2dbj s LYS 112 Cb -0.14 -4.03 -0.04 0.00 -1.51 0.00 0.00 37.83 32.10 2dbj s LYS 112 CO -0.07 -1.56 0.09 -1.50 -0.36 0.00 0.00 175.35 171.95 2dbj s ILE 113 N 4.39 4.95 -0.30 5.43 2.07 -0.41 -4.95 121.20 132.38 2dbj s ILE 113 Ca 0.36 0.03 -0.29 0.00 -1.41 0.00 0.00 60.65 59.34 2dbj s ILE 113 Cb -0.10 -3.26 0.01 0.00 0.13 0.00 0.00 42.46 39.24 2dbj s ILE 113 CO 0.22 0.42 1.17 0.12 -1.91 0.00 0.00 174.94 174.96 2dbj s PHE 114 N 0.61 2.97 -0.41 3.50 2.19 -1.26 -2.27 117.98 123.31 2dbj s PHE 114 Ca 0.05 1.06 -0.27 0.00 0.33 0.00 0.00 56.93 58.11 2dbj s PHE 114 Cb -0.13 -3.77 0.02 0.00 -1.31 0.00 0.00 43.02 37.84 2dbj s PHE 114 CO 0.01 -1.16 0.98 0.42 1.83 0.00 0.00 175.22 177.30 2dbj s ILE 115 N 3.90 4.48 0.18 3.12 -1.09 -0.23 -4.99 121.20 126.56 2dbj s ILE 115 Ca 0.50 1.15 -0.30 0.00 -2.23 0.00 0.00 60.65 59.76 2dbj s ILE 115 Cb -0.14 -4.42 -0.08 0.00 -1.58 0.00 0.00 42.46 36.24 2dbj s ILE 115 CO 0.18 -0.69 1.31 -2.16 -1.23 0.00 0.00 174.94 172.36 2dbj s PRO 116 N 3.74 4.38 0.37 2.79 0.04 -1.26 -0.73 135.00 144.33 2dbj s PRO 116 Ca 0.40 2.04 0.13 0.00 0.04 0.00 0.00 61.00 63.61 2dbj s PRO 116 Cb -0.11 -3.21 0.93 0.00 0.04 0.00 0.00 34.50 32.16 2dbj s PRO 116 CO 0.23 -0.28 1.82 0.00 0.04 0.00 0.00 177.00 178.81 2dbj h ALA 117 N 5.67 1.98 -1.46 8.56 0.00 -1.94 -3.38 119.26 128.69 2dbj h ALA 117 Ca -0.44 0.04 -0.70 0.00 0.00 0.00 0.00 54.91 53.81 2dbj h ALA 117 Cb 1.21 -0.06 0.06 0.00 0.00 0.00 0.00 17.79 19.01 2dbj h ALA 117 CO 0.79 -0.30 0.24 1.58 0.00 0.00 0.00 179.25 181.56 2dbj n HIS 118 N -4.61 1.10 -3.95 0.00 -0.00 -1.26 -4.82 115.22 101.68 2dbj n HIS 118 Ca 0.21 0.79 -0.10 0.00 -0.00 0.00 0.00 57.72 58.62 2dbj n HIS 118 Cb 0.64 -2.23 -0.06 0.00 -0.00 0.00 0.00 29.99 28.34 2dbj n HIS 118 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 2dbj s SER 119 N 0.15 -0.02 0.76 0.26 1.04 -1.26 -5.05 113.70 109.59 2dbj s SER 119 Ca 0.83 -0.86 -0.15 0.00 0.48 0.00 0.00 55.95 56.24 2dbj s SER 119 Cb -1.02 0.48 0.03 0.00 0.10 0.00 0.00 66.02 65.61 2dbj s SER 119 CO 0.51 -0.97 0.96 0.61 0.98 0.00 0.00 173.24 175.34 2dbj n GLY 120 N -0.27 -0.50 3.77 7.32 0.00 -1.26 -4.95 105.19 109.29 2dbj n GLY 120 Ca -0.06 -0.41 -0.37 0.00 0.00 0.00 0.00 46.02 45.18 2dbj n GLY 120 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dbj s PRO 121 N -3.54 3.70 -0.11 1.61 0.04 -1.26 -5.05 135.00 130.39 2dbj s PRO 121 Ca 0.72 1.75 -0.04 0.00 0.04 0.00 0.00 61.00 63.47 2dbj s PRO 121 Cb -0.32 -2.35 0.05 0.00 0.04 0.00 0.00 34.50 31.92 2dbj s PRO 121 CO 0.52 -0.59 0.10 0.45 0.04 0.00 0.00 177.00 177.52 2dbj s SER 122 N -1.41 1.59 -1.35 6.66 0.15 -1.26 -4.86 113.70 113.21 2dbj s SER 122 Ca 0.65 -0.19 -0.07 0.00 0.70 0.00 0.00 55.95 57.03 2dbj s SER 122 Cb -0.28 -0.07 0.02 0.00 -1.71 0.00 0.00 66.02 63.98 2dbj s SER 122 CO 0.34 -0.30 1.08 -1.20 1.20 0.00 0.00 173.24 174.36 2dbj n SER 123 N 5.30 -4.81 -0.34 5.45 7.64 -1.26 -5.31 113.62 120.29 2dbj n SER 123 Ca -0.05 -0.62 0.15 0.00 1.01 0.00 0.00 58.87 59.35 2dbj n SER 123 Cb 0.50 -4.78 0.65 0.00 -1.01 0.00 0.00 64.21 59.56 2dbj n SER 123 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64