#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dn6 s SER 2 N 0.00 2.98 -0.25 1.61 0.01 -1.26 -5.09 113.70 111.71 2dn6 s SER 2 Ca 0.00 0.54 -0.02 0.00 1.31 0.00 0.00 55.95 57.78 2dn6 s SER 2 Cb 0.00 -0.79 0.14 0.00 0.21 0.00 0.00 66.02 65.58 2dn6 s SER 2 CO 0.00 -2.84 0.39 -0.55 0.41 0.00 0.00 173.24 170.65 2dn6 s SER 3 N -4.50 0.22 0.00 2.44 0.15 -1.26 -5.14 113.70 105.61 2dn6 s SER 3 Ca 0.70 0.19 0.00 0.00 0.70 0.00 0.00 55.95 57.54 2dn6 s SER 3 Cb -0.08 1.14 0.00 0.00 -1.71 0.00 0.00 66.02 65.37 2dn6 s SER 3 CO 0.53 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 175.28 2dn6 n GLY 4 N 5.37 -2.13 2.96 9.45 0.00 -1.26 -5.08 105.19 114.50 2dn6 n GLY 4 Ca -0.03 -1.20 -0.31 0.00 0.00 0.00 0.00 46.02 44.48 2dn6 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dn6 s SER 5 N -0.90 4.62 -0.00 1.61 1.04 -1.26 -4.96 113.70 113.85 2dn6 s SER 5 Ca 0.00 -3.22 -0.16 0.00 0.48 0.00 0.00 55.95 53.05 2dn6 s SER 5 Cb 0.00 -1.68 -0.09 0.00 0.10 0.00 0.00 66.02 64.35 2dn6 s SER 5 CO 0.00 -0.21 0.84 -1.28 0.98 0.00 0.00 173.24 173.57 2dn6 h SER 6 N 6.28 -0.48 -1.37 7.02 0.87 -2.01 -3.50 113.55 120.38 2dn6 h SER 6 Ca -0.01 0.02 0.19 0.00 -1.23 0.00 0.00 61.79 60.76 2dn6 h SER 6 Cb 0.86 0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 62.91 2dn6 h SER 6 CO 0.71 -0.21 0.51 0.61 -0.53 0.00 0.00 176.83 177.92 2dn6 n GLY 7 N -0.16 0.44 2.44 5.77 0.00 -1.26 -5.09 105.19 107.33 2dn6 n GLY 7 Ca -0.07 -0.97 -0.41 0.00 0.00 0.00 0.00 46.02 44.57 2dn6 n GLY 7 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2dn6 n VAL 8 N -0.53 0.00 -0.09 1.61 3.14 -1.26 -4.48 118.33 116.72 2dn6 n VAL 8 Ca 0.02 0.00 -0.23 0.00 -2.96 0.00 0.00 64.34 61.17 2dn6 n VAL 8 Cb 0.34 -0.02 -0.12 0.00 -1.06 0.00 0.00 33.84 32.99 2dn6 n VAL 8 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 2dn6 n LEU 9 N 1.12 2.05 -4.37 6.55 4.77 0.33 -4.98 117.00 122.47 2dn6 n LEU 9 Ca 0.14 0.35 -0.23 0.00 -0.03 0.00 0.00 56.01 56.24 2dn6 n LEU 9 Cb 0.05 -0.96 -0.11 0.00 -2.33 0.00 0.00 43.42 40.06 2dn6 n LEU 9 CO 0.43 0.45 -0.49 -0.75 -1.33 0.00 0.00 177.39 175.70 2dn6 s LYS 10 N -2.43 1.36 -0.25 3.23 2.20 -1.20 -5.02 119.74 117.63 2dn6 s LYS 10 Ca -0.30 -1.47 -0.21 0.00 -0.36 0.00 0.00 55.97 53.63 2dn6 s LYS 10 Cb 0.08 -1.48 0.07 0.00 -1.51 0.00 0.00 37.83 34.99 2dn6 s LYS 10 CO 0.60 0.30 0.66 1.14 -0.36 0.00 0.00 175.35 177.70 2dn6 s GLN 11 N -2.85 0.75 -0.19 4.03 -2.07 -1.26 -1.93 119.66 116.14 2dn6 s GLN 11 Ca 0.18 0.99 -0.36 0.00 -1.82 0.00 0.00 55.36 54.36 2dn6 s GLN 11 Cb -0.06 0.31 0.15 0.00 -1.09 0.00 0.00 33.01 32.32 2dn6 s GLN 11 CO 0.08 -0.11 1.42 0.20 -1.32 0.00 0.00 175.29 175.57 2dn6 s GLY 12 N 0.70 -0.37 -0.66 2.60 0.00 -1.21 -5.03 107.32 103.35 2dn6 s GLY 12 Ca -0.03 1.41 -0.26 0.00 0.00 0.00 0.00 44.72 45.84 2dn6 s GLY 12 CO -0.04 0.39 1.16 -0.19 0.00 0.00 0.00 173.10 174.41 2dn6 s TYR 13 N -2.01 2.50 0.17 1.90 2.02 -1.26 -2.57 117.35 118.10 2dn6 s TYR 13 Ca 0.14 -0.03 0.07 0.00 -0.37 0.00 0.00 57.07 56.88 2dn6 s TYR 13 Cb 0.04 -4.47 -0.04 0.00 -0.40 0.00 0.00 41.96 37.09 2dn6 s TYR 13 CO -0.05 -1.79 0.01 -1.64 -1.57 0.00 0.00 175.55 170.52 2dn6 s MET 14 N 5.01 2.46 -0.33 -0.62 -1.94 -1.08 -4.88 119.30 117.92 2dn6 s MET 14 Ca 0.34 -1.07 -0.11 0.00 -1.71 0.00 0.00 55.69 53.14 2dn6 s MET 14 Cb -0.10 -2.39 -0.01 0.00 2.01 0.00 0.00 34.83 34.34 2dn6 s MET 14 CO 0.17 0.46 0.19 -1.64 -0.01 0.00 0.00 175.02 174.19 2dn6 s MET 15 N -2.93 3.36 -0.22 2.03 1.00 -1.11 -0.09 119.30 121.35 2dn6 s MET 15 Ca 0.28 -0.71 -0.11 0.00 0.00 0.00 0.00 55.69 55.15 2dn6 s MET 15 Cb -0.09 -3.67 -0.05 0.00 0.00 0.00 0.00 34.83 31.02 2dn6 s MET 15 CO 0.19 -0.44 0.17 0.21 0.00 0.00 0.00 175.02 175.14 2dn6 s LYS 16 N 1.65 4.13 -0.08 2.03 2.20 -1.11 0.70 119.74 129.26 2dn6 s LYS 16 Ca 0.05 -0.21 -0.30 0.00 -0.36 0.00 0.00 55.97 55.16 2dn6 s LYS 16 Cb -0.17 -3.49 -0.04 0.00 -1.51 0.00 0.00 37.83 32.62 2dn6 s LYS 16 CO 0.08 0.15 1.48 0.21 -0.36 0.00 0.00 175.35 176.91 2dn6 s LYS 17 N 0.78 4.22 0.92 4.03 2.20 0.15 -3.73 119.74 128.30 2dn6 s LYS 17 Ca 0.09 1.97 -0.12 0.00 -0.36 0.00 0.00 55.97 57.55 2dn6 s LYS 17 Cb -0.13 -3.84 0.14 0.00 -1.51 0.00 0.00 37.83 32.49 2dn6 s LYS 17 CO 0.02 -0.75 1.11 0.20 -0.36 0.00 0.00 175.35 175.56 2dn6 s GLY 18 N 2.62 1.59 0.14 5.54 0.00 0.31 -4.58 107.32 112.94 2dn6 s GLY 18 Ca 0.65 -0.32 -0.18 0.00 0.00 0.00 0.00 44.72 44.87 2dn6 s GLY 18 CO 0.24 0.22 1.70 0.45 0.00 0.00 0.00 173.10 175.71 2dn6 h HIS 19 N -1.57 -0.07 -2.05 1.90 -0.00 -1.94 -3.42 115.15 108.00 2dn6 h HIS 19 Ca -0.51 0.02 -0.57 0.00 -0.00 0.00 0.00 60.37 59.32 2dn6 h HIS 19 Cb 1.31 0.07 0.22 0.00 -0.00 0.00 0.00 27.41 29.01 2dn6 h HIS 19 CO 0.35 -0.08 -1.59 -2.13 -0.00 0.00 0.00 177.93 174.48 2dn6 n ARG 20 N -5.19 0.00 -0.28 2.45 3.00 -1.26 -4.70 116.66 110.68 2dn6 n ARG 20 Ca -0.01 0.00 0.05 0.00 -0.00 0.00 0.00 57.85 57.89 2dn6 n ARG 20 Cb 0.15 -1.03 0.11 0.00 0.00 0.00 0.00 32.46 31.69 2dn6 n ARG 20 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 2dn6 n ARG 21 N 2.05 -0.07 -3.69 -0.14 0.63 -1.26 -4.41 116.66 109.77 2dn6 n ARG 21 Ca 0.02 1.20 -0.11 0.00 -0.92 0.00 0.00 57.85 58.04 2dn6 n ARG 21 Cb 0.53 -1.80 -0.09 0.00 0.45 0.00 0.00 32.46 31.55 2dn6 n ARG 21 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 2dn6 s LYS 22 N -5.96 0.55 -0.30 -0.14 0.00 -1.26 -5.03 119.74 107.59 2dn6 s LYS 22 Ca -0.12 0.84 -0.14 0.00 0.00 0.00 0.00 55.97 56.55 2dn6 s LYS 22 Cb 0.21 0.15 0.18 0.00 0.00 0.00 0.00 37.83 38.37 2dn6 s LYS 22 CO 0.60 -0.12 1.10 1.21 0.00 0.00 0.00 175.35 178.14 2dn6 s ASN 23 N 0.92 -0.35 -0.19 0.03 2.47 -1.26 -4.94 114.94 111.62 2dn6 s ASN 23 Ca -0.05 0.21 -0.04 0.00 0.42 0.00 0.00 52.86 53.40 2dn6 s ASN 23 Cb -0.06 1.29 -0.02 0.00 -1.45 0.00 0.00 41.25 41.02 2dn6 s ASN 23 CO -0.08 -0.07 -0.03 0.26 -3.72 0.00 0.00 177.10 173.47 2dn6 s TRP 24 N 2.96 3.00 -0.02 0.43 0.52 -1.26 -0.53 118.94 124.04 2dn6 s TRP 24 Ca -0.02 -0.53 0.02 0.00 0.02 0.00 0.00 56.10 55.59 2dn6 s TRP 24 Cb -0.09 -2.04 0.00 0.00 -1.15 0.00 0.00 33.47 30.19 2dn6 s TRP 24 CO -0.11 -0.25 -0.07 -0.08 0.02 0.00 0.00 176.95 176.46 2dn6 s THR 25 N 0.89 0.59 -0.63 2.01 -1.32 -1.24 -4.97 115.64 110.97 2dn6 s THR 25 Ca -0.00 -0.27 -0.27 0.00 -1.21 0.00 0.00 61.69 59.94 2dn6 s THR 25 Cb -0.14 -0.53 -0.01 0.00 -1.51 0.00 0.00 72.50 70.30 2dn6 s THR 25 CO 0.01 0.19 1.72 -0.70 -2.21 0.00 0.00 174.62 173.64 2dn6 s GLU 26 N 0.15 2.79 -0.10 7.08 2.12 -1.26 -2.75 118.70 126.73 2dn6 s GLU 26 Ca -0.02 0.45 0.02 0.00 0.36 0.00 0.00 54.97 55.79 2dn6 s GLU 26 Cb -0.07 -4.33 -0.01 0.00 0.26 0.00 0.00 34.13 29.98 2dn6 s GLU 26 CO -0.00 -2.56 -0.18 0.50 -0.54 0.00 0.00 175.26 172.48 2dn6 s ARG 27 N 6.68 3.05 0.18 4.30 6.06 0.88 -4.90 118.95 135.20 2dn6 s ARG 27 Ca 0.60 -0.78 -0.31 0.00 -2.50 0.00 0.00 55.73 52.74 2dn6 s ARG 27 Cb -0.12 -2.43 -0.10 0.00 0.06 0.00 0.00 34.95 32.35 2dn6 s ARG 27 CO 0.20 0.28 1.59 -0.46 -2.50 0.00 0.00 175.30 174.41 2dn6 s TRP 28 N 0.13 3.02 -0.11 5.12 -0.11 -0.41 -2.64 118.94 123.94 2dn6 s TRP 28 Ca -0.09 0.60 0.03 0.00 1.22 0.00 0.00 56.10 57.86 2dn6 s TRP 28 Cb -0.15 -3.97 -0.00 0.00 -1.50 0.00 0.00 33.47 27.84 2dn6 s TRP 28 CO 0.06 -3.55 -0.21 -0.06 -4.62 0.00 0.00 176.95 168.56 2dn6 s PHE 29 N 1.04 2.64 -0.50 5.86 0.40 -1.06 -0.75 117.98 125.60 2dn6 s PHE 29 Ca 0.70 -0.94 -0.01 0.00 -0.60 0.00 0.00 56.93 56.08 2dn6 s PHE 29 Cb -0.45 -1.75 0.13 0.00 0.51 0.00 0.00 43.02 41.46 2dn6 s PHE 29 CO 0.33 -0.37 0.28 0.08 0.70 0.00 0.00 175.22 176.24 2dn6 s VAL 30 N 0.36 3.22 -0.62 -0.44 1.01 0.10 -3.30 120.40 120.73 2dn6 s VAL 30 Ca -0.16 -2.61 -0.27 0.00 0.00 0.00 0.00 61.98 58.94 2dn6 s VAL 30 Cb -0.17 -3.18 -0.01 0.00 0.00 0.00 0.00 36.38 33.01 2dn6 s VAL 30 CO 0.08 -0.77 1.76 -0.22 0.00 0.00 0.00 175.10 175.95 2dn6 s LEU 31 N 0.45 3.28 0.60 3.92 2.96 -0.81 -2.09 118.68 126.99 2dn6 s LEU 31 Ca 0.13 0.26 -0.08 0.00 -0.22 0.00 0.00 54.13 54.22 2dn6 s LEU 31 Cb -0.22 -2.60 -0.01 0.00 0.50 0.00 0.00 46.19 43.86 2dn6 s LEU 31 CO -0.04 -2.25 0.95 -0.54 -1.32 0.00 0.00 176.35 173.15 2dn6 s LYS 32 N 6.74 3.21 0.45 1.98 -0.14 0.11 -0.51 119.74 131.57 2dn6 s LYS 32 Ca 0.62 0.32 0.23 0.00 -1.36 0.00 0.00 55.97 55.78 2dn6 s LYS 32 Cb -0.12 -2.20 1.00 0.00 -1.68 0.00 0.00 37.83 34.83 2dn6 s LYS 32 CO 0.21 -0.63 1.87 -1.00 -0.76 0.00 0.00 175.35 175.04 2dn6 h PRO 33 N -0.22 0.00 0.00 -1.68 0.13 -1.94 -3.23 132.00 125.06 2dn6 h PRO 33 Ca -0.45 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.61 2dn6 h PRO 33 Cb 1.23 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.22 2dn6 h PRO 33 CO 0.62 0.24 -0.63 0.09 -0.23 0.00 0.00 178.00 178.09 2dn6 n ASN 34 N -3.51 0.95 -3.97 1.44 4.13 -1.26 -4.90 115.26 108.14 2dn6 n ASN 34 Ca -0.01 -2.43 0.05 0.00 1.68 0.00 0.00 54.58 53.87 2dn6 n ASN 34 Cb 0.40 -0.32 0.01 0.00 -1.54 0.00 0.00 39.78 38.33 2dn6 n ASN 34 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 2dn6 s ILE 35 N -0.88 0.00 -0.26 2.41 2.07 -1.22 -4.12 121.20 119.20 2dn6 s ILE 35 Ca 0.22 -0.01 -0.02 0.00 -1.41 0.00 0.00 60.65 59.44 2dn6 s ILE 35 Cb 0.24 -2.85 0.13 0.00 0.13 0.00 0.00 42.46 40.10 2dn6 s ILE 35 CO -0.07 0.00 0.31 -0.63 -1.91 0.00 0.00 174.94 172.64 2dn6 s ILE 36 N -2.00 -0.46 0.43 2.00 1.01 -1.00 0.07 121.20 121.25 2dn6 s ILE 36 Ca 0.30 -0.27 0.08 0.00 0.00 0.00 0.00 60.65 60.76 2dn6 s ILE 36 Cb 0.01 -0.87 -0.01 0.00 0.01 0.00 0.00 42.46 41.61 2dn6 s ILE 36 CO -0.03 -0.30 0.45 -0.55 0.00 0.00 0.00 174.94 174.51 2dn6 s SER 37 N 2.42 5.24 -0.21 3.58 0.15 -0.89 -0.99 113.70 123.00 2dn6 s SER 37 Ca 0.10 -0.65 -0.05 0.00 0.70 0.00 0.00 55.95 56.04 2dn6 s SER 37 Cb -0.15 -0.55 0.10 0.00 -1.71 0.00 0.00 66.02 63.71 2dn6 s SER 37 CO -0.23 -0.72 0.39 -0.72 1.20 0.00 0.00 173.24 173.16 2dn6 s TYR 38 N -2.45 -0.77 0.08 3.44 1.13 -1.22 0.01 117.35 117.58 2dn6 s TYR 38 Ca 0.50 1.22 0.01 0.00 -1.41 0.00 0.00 57.07 57.39 2dn6 s TYR 38 Cb -0.05 0.17 -0.04 0.00 -1.10 0.00 0.00 41.96 40.93 2dn6 s TYR 38 CO 0.30 -0.55 0.21 0.71 -2.51 0.00 0.00 175.55 173.70 2dn6 s TYR 39 N 2.57 3.46 0.27 -3.49 1.51 0.07 -2.39 117.35 119.35 2dn6 s TYR 39 Ca 0.04 0.20 -0.06 0.00 -1.01 0.00 0.00 57.07 56.23 2dn6 s TYR 39 Cb -0.13 -1.72 0.49 0.00 -0.11 0.00 0.00 41.96 40.49 2dn6 s TYR 39 CO -0.13 0.57 1.59 0.28 -1.11 0.00 0.00 175.55 176.74 2dn6 h VAL 40 N 2.05 0.12 -3.87 0.71 2.07 -1.81 -1.07 116.25 114.45 2dn6 h VAL 40 Ca -0.46 -0.01 -0.28 0.00 0.82 0.00 0.00 66.70 66.78 2dn6 h VAL 40 Cb 1.17 0.10 -0.06 0.00 -1.52 0.00 0.00 31.29 30.97 2dn6 h VAL 40 CO 0.73 0.00 -0.24 -1.54 0.02 0.00 0.00 177.57 176.55 2dn6 n SER 41 N -5.52 0.89 -1.41 0.57 3.41 -1.26 -3.60 113.62 106.71 2dn6 n SER 41 Ca 0.16 -2.10 -0.06 0.00 -0.26 0.00 0.00 58.87 56.61 2dn6 n SER 41 Cb 0.53 0.56 0.03 0.00 -0.26 0.00 0.00 64.21 65.08 2dn6 n SER 41 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2dn6 n GLU 42 N -0.45 1.29 -0.07 4.33 0.28 -1.26 -3.81 120.64 120.95 2dn6 n GLU 42 Ca -0.02 -0.64 -0.14 0.00 -0.16 0.00 0.00 57.16 56.20 2dn6 n GLU 42 Cb 0.31 -1.25 -0.14 0.00 1.43 0.00 0.00 31.44 31.79 2dn6 n GLU 42 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2dn6 n ASP 43 N 0.47 1.09 -2.10 -1.84 9.92 -1.26 -5.01 116.55 117.81 2dn6 n ASP 43 Ca 0.13 0.09 -0.12 0.00 -0.53 0.00 0.00 54.79 54.36 2dn6 n ASP 43 Cb 0.67 0.07 0.04 0.00 -0.64 0.00 0.00 41.12 41.26 2dn6 n ASP 43 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2dn6 n LEU 44 N -3.08 -2.77 -0.01 0.64 4.77 -1.25 -4.94 117.00 110.36 2dn6 n LEU 44 Ca -0.33 -0.28 -0.01 0.00 -0.03 0.00 0.00 56.01 55.36 2dn6 n LEU 44 Cb 1.07 -1.80 -0.01 0.00 -2.33 0.00 0.00 43.42 40.36 2dn6 n LEU 44 CO 0.39 0.31 -0.55 0.29 -1.33 0.00 0.00 177.39 176.50 2dn6 n LYS 45 N -2.76 0.04 -3.75 3.23 5.02 -1.26 -4.96 118.16 113.72 2dn6 n LYS 45 Ca -0.02 0.01 -0.37 0.00 -2.02 0.00 0.00 58.31 55.90 2dn6 n LYS 45 Cb 0.54 -1.01 -0.12 0.00 -0.02 0.00 0.00 35.03 34.42 2dn6 n LYS 45 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2dn6 s ASP 46 N -4.20 5.31 0.45 4.39 -1.08 -1.26 -5.09 116.67 115.18 2dn6 s ASP 46 Ca -0.02 -1.52 -0.17 0.00 -0.52 0.00 0.00 52.55 50.32 2dn6 s ASP 46 Cb 0.01 -1.86 -0.09 0.00 -1.46 0.00 0.00 42.92 39.52 2dn6 s ASP 46 CO 0.04 -0.44 0.91 -0.75 0.52 0.00 0.00 175.17 175.45 2dn6 s LYS 47 N 1.31 4.02 -0.07 4.34 2.20 -1.26 -2.95 119.74 127.32 2dn6 s LYS 47 Ca 0.02 0.89 0.03 0.00 -0.36 0.00 0.00 55.97 56.55 2dn6 s LYS 47 Cb -0.21 -2.23 -0.07 0.00 -1.51 0.00 0.00 37.83 33.81 2dn6 s LYS 47 CO -0.00 -0.10 -0.02 1.63 -0.36 0.00 0.00 175.35 176.49 2dn6 n LYS 48 N -1.09 1.64 -3.60 4.03 4.76 -1.01 -4.91 118.16 117.99 2dn6 n LYS 48 Ca 0.06 0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.52 2dn6 n LYS 48 Cb 0.54 -1.16 -0.01 0.00 -1.84 0.00 0.00 35.03 32.56 2dn6 n LYS 48 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2dn6 s GLY 49 N -4.26 -0.37 -0.09 0.72 0.00 -1.26 -5.05 107.32 97.01 2dn6 s GLY 49 Ca -0.07 1.20 0.01 0.00 0.00 0.00 0.00 44.72 45.85 2dn6 s GLY 49 CO 0.23 0.32 -0.10 0.51 0.00 0.00 0.00 173.10 174.06 2dn6 s ASP 50 N -2.62 2.01 -0.64 1.64 1.47 -1.26 -3.39 116.67 113.88 2dn6 s ASP 50 Ca 0.13 -0.31 -0.17 0.00 1.18 0.00 0.00 52.55 53.39 2dn6 s ASP 50 Cb 0.03 -0.84 0.14 0.00 -0.34 0.00 0.00 42.92 41.91 2dn6 s ASP 50 CO -0.04 -0.05 0.66 -0.63 0.68 0.00 0.00 175.17 175.78 2dn6 s ILE 51 N 1.25 5.16 -0.24 2.11 1.01 -0.16 -4.96 121.20 125.37 2dn6 s ILE 51 Ca -0.03 -1.58 -0.29 0.00 0.00 0.00 0.00 60.65 58.74 2dn6 s ILE 51 Cb -0.14 -4.44 -0.06 0.00 0.01 0.00 0.00 42.46 37.83 2dn6 s ILE 51 CO -0.03 -1.02 2.23 0.18 0.00 0.00 0.00 174.94 176.29 2dn6 n LEU 52 N 5.35 3.06 -4.73 2.97 4.77 -1.26 -2.36 117.00 124.80 2dn6 n LEU 52 Ca -0.04 0.22 -0.41 0.00 -0.03 0.00 0.00 56.01 55.75 2dn6 n LEU 52 Cb 0.43 -1.51 -0.04 0.00 -2.33 0.00 0.00 43.42 39.97 2dn6 n LEU 52 CO 0.50 -0.71 0.75 -0.76 -1.33 0.00 0.00 177.39 175.84 2dn6 s LEU 53 N 8.25 4.48 -0.09 2.23 1.43 -1.26 -4.93 118.68 128.80 2dn6 s LEU 53 Ca 1.02 1.97 -0.24 0.00 -1.03 0.00 0.00 54.13 55.86 2dn6 s LEU 53 Cb -0.42 -3.60 0.05 0.00 0.03 0.00 0.00 46.19 42.26 2dn6 s LEU 53 CO 0.37 -0.18 0.55 1.51 0.23 0.00 0.00 176.35 178.83 2dn6 s ASP 54 N 0.01 -0.52 0.27 2.29 -4.77 -1.26 -4.85 116.67 107.84 2dn6 s ASP 54 Ca 0.49 0.67 0.15 0.00 -3.30 0.00 0.00 52.55 50.56 2dn6 s ASP 54 Cb -0.27 0.65 0.98 0.00 -1.09 0.00 0.00 42.92 43.19 2dn6 s ASP 54 CO 0.33 -0.46 1.15 -1.84 0.70 0.00 0.00 175.17 175.05 2dn6 n GLU 55 N 1.51 -0.04 0.36 2.11 0.28 -1.26 0.71 120.64 124.31 2dn6 n GLU 55 Ca -0.18 1.00 -0.18 0.00 -0.16 0.00 0.00 57.16 57.63 2dn6 n GLU 55 Cb 0.56 -1.80 -0.09 0.00 1.43 0.00 0.00 31.44 31.54 2dn6 n GLU 55 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 2dn6 h ASN 56 N 0.00 -1.19 -3.52 -1.84 4.21 -1.95 -3.43 115.58 107.86 2dn6 h ASN 56 Ca 0.62 0.08 -0.56 0.00 1.21 0.00 0.00 56.30 57.65 2dn6 h ASN 56 Cb 1.64 0.36 0.18 0.00 -1.12 0.00 0.00 38.32 39.39 2dn6 h ASN 56 CO -0.55 -0.67 -0.13 0.00 -1.29 0.00 0.00 177.43 174.79 2dn6 s VAL 59 N -3.59 3.34 0.03 0.00 0.11 -1.26 0.06 120.40 119.09 2dn6 s VAL 59 Ca 0.05 -0.61 0.04 0.00 -2.93 0.00 0.00 61.98 58.53 2dn6 s VAL 59 Cb -0.02 -2.35 -0.02 0.00 -1.53 0.00 0.00 36.38 32.46 2dn6 s VAL 59 CO -0.06 0.58 -0.11 -1.83 -3.33 0.00 0.00 175.10 170.34 2dn6 s GLU 60 N -0.54 0.77 0.11 1.54 4.04 0.61 -4.95 118.70 120.28 2dn6 s GLU 60 Ca 0.08 -0.67 -0.27 0.00 0.04 0.00 0.00 54.97 54.15 2dn6 s GLU 60 Cb -0.12 -0.72 -0.07 0.00 0.02 0.00 0.00 34.13 33.25 2dn6 s GLU 60 CO 0.02 0.17 0.83 -1.12 -1.84 0.00 0.00 175.26 173.32 2dn6 s SER 61 N -1.08 7.36 0.14 0.83 0.01 -1.26 -0.57 113.70 119.13 2dn6 s SER 61 Ca -0.01 1.62 0.03 0.00 1.31 0.00 0.00 55.95 58.90 2dn6 s SER 61 Cb -0.07 -2.52 -0.04 0.00 0.21 0.00 0.00 66.02 63.60 2dn6 s SER 61 CO 0.01 0.06 0.22 -0.76 0.41 0.00 0.00 173.24 173.18 2dn6 s LEU 62 N -0.45 4.14 0.00 2.44 1.43 0.10 -4.87 118.68 121.48 2dn6 s LEU 62 Ca 0.40 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.58 2dn6 s LEU 62 Cb -0.22 -2.74 0.00 0.00 0.03 0.00 0.00 46.19 43.26 2dn6 s LEU 62 CO 0.26 0.08 0.00 -0.81 0.23 0.00 0.00 176.35 176.11 2dn6 n PRO 63 N -0.32 -0.98 -3.03 1.29 -0.04 -1.26 -3.88 135.00 126.78 2dn6 n PRO 63 Ca -0.07 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.96 2dn6 n PRO 63 Cb 0.54 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.94 2dn6 n PRO 63 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 2dn6 s ASP 64 N -1.51 6.37 0.30 3.54 1.47 -1.26 -4.46 116.67 121.12 2dn6 s ASP 64 Ca 0.00 -0.22 0.03 0.00 1.18 0.00 0.00 52.55 53.54 2dn6 s ASP 64 Cb 0.00 -2.35 -0.04 0.00 -0.34 0.00 0.00 42.92 40.19 2dn6 s ASP 64 CO 0.00 -0.85 0.16 -1.59 0.68 0.00 0.00 175.17 173.57 2dn6 s LYS 65 N 3.06 1.59 -1.20 2.11 -2.85 -1.26 -4.81 119.74 116.38 2dn6 s LYS 65 Ca 0.26 -1.90 -0.15 0.00 -1.00 0.00 0.00 55.97 53.18 2dn6 s LYS 65 Cb -0.13 -0.10 0.15 0.00 -2.06 0.00 0.00 37.83 35.69 2dn6 s LYS 65 CO 0.21 -0.44 0.38 -3.47 0.10 0.00 0.00 175.35 172.12 2dn6 n ASP 66 N -0.91 -1.36 -3.13 0.03 2.03 -1.26 0.39 116.55 112.34 2dn6 n ASP 66 Ca 0.01 -0.69 -0.14 0.00 0.52 0.00 0.00 54.79 54.49 2dn6 n ASP 66 Cb 0.65 -1.21 0.07 0.00 -0.72 0.00 0.00 41.12 39.91 2dn6 n ASP 66 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dn6 n GLY 67 N -0.83 -0.72 3.08 0.27 0.00 -1.26 -5.04 105.19 100.68 2dn6 n GLY 67 Ca 0.08 0.34 -0.27 0.00 0.00 0.00 0.00 46.02 46.17 2dn6 n GLY 67 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dn6 n LYS 68 N -3.35 0.95 0.00 1.61 4.76 0.16 -5.08 118.16 117.20 2dn6 n LYS 68 Ca -0.14 -3.09 0.00 0.00 -2.87 0.00 0.00 58.31 52.21 2dn6 n LYS 68 Cb 0.63 0.78 0.00 0.00 -1.84 0.00 0.00 35.03 34.59 2dn6 n LYS 68 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2dn6 n LYS 69 N -1.12 0.00 -3.69 1.97 4.01 -1.26 -4.54 118.16 113.52 2dn6 n LYS 69 Ca -0.16 0.00 -0.30 0.00 -0.51 0.00 0.00 58.31 57.34 2dn6 n LYS 69 Cb 0.54 -0.43 -0.14 0.00 -0.51 0.00 0.00 35.03 34.49 2dn6 n LYS 69 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2dn6 s LEU 71 N 1.26 3.11 -0.13 0.00 1.43 -1.25 -3.30 118.68 119.79 2dn6 s LEU 71 Ca 0.13 -0.29 -0.07 0.00 -1.03 0.00 0.00 54.13 52.86 2dn6 s LEU 71 Cb -0.20 -1.86 0.05 0.00 0.03 0.00 0.00 46.19 44.21 2dn6 s LEU 71 CO -0.16 0.21 0.30 0.72 0.23 0.00 0.00 176.35 177.65 2dn6 s PHE 72 N -1.15 -0.42 0.10 0.29 -0.12 -0.99 0.01 117.98 115.72 2dn6 s PHE 72 Ca 0.20 0.95 0.09 0.00 -0.05 0.00 0.00 56.93 58.12 2dn6 s PHE 72 Cb -0.11 0.12 -0.04 0.00 -0.63 0.00 0.00 43.02 42.37 2dn6 s PHE 72 CO 0.12 -0.26 -0.22 -1.17 -0.05 0.00 0.00 175.22 173.64 2dn6 s LEU 73 N 1.17 2.30 -0.19 -1.99 0.20 0.26 -1.94 118.68 118.50 2dn6 s LEU 73 Ca -0.08 -0.69 -0.07 0.00 0.69 0.00 0.00 54.13 53.98 2dn6 s LEU 73 Cb -0.09 -0.92 -0.04 0.00 -0.43 0.00 0.00 46.19 44.71 2dn6 s LEU 73 CO -0.09 0.07 0.05 -0.69 -0.29 0.00 0.00 176.35 175.40 2dn6 s VAL 74 N -1.15 4.56 -0.31 1.68 1.01 0.39 -0.29 120.40 126.29 2dn6 s VAL 74 Ca 0.07 -0.11 -0.10 0.00 0.00 0.00 0.00 61.98 61.84 2dn6 s VAL 74 Cb -0.10 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.21 2dn6 s VAL 74 CO 0.04 0.45 0.17 -0.75 0.00 0.00 0.00 175.10 175.01 2dn6 s LYS 75 N 0.55 3.39 0.51 2.72 2.47 0.11 -2.02 119.74 127.47 2dn6 s LYS 75 Ca 0.02 -0.69 0.05 0.00 -1.56 0.00 0.00 55.97 53.79 2dn6 s LYS 75 Cb -0.13 -3.61 0.01 0.00 -1.46 0.00 0.00 37.83 32.65 2dn6 s LYS 75 CO 0.01 -0.41 0.31 0.00 0.16 0.00 0.00 175.35 175.42 2dn6 n PHE 77 N -1.60 0.00 0.00 0.00 3.72 -1.26 -4.02 117.46 114.30 2dn6 n PHE 77 Ca -0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 2dn6 n PHE 77 Cb 0.65 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 39.05 2dn6 n PHE 77 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2dn6 n ASP 78 N -1.79 3.65 -4.83 4.37 9.92 -1.26 -5.06 116.55 121.55 2dn6 n ASP 78 Ca 0.00 0.00 -0.33 0.00 -0.53 0.00 0.00 54.79 53.93 2dn6 n ASP 78 Cb 0.00 0.45 -0.06 0.00 -0.64 0.00 0.00 41.12 40.86 2dn6 n ASP 78 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2dn6 s LYS 79 N -1.67 4.12 0.16 -1.24 1.02 -1.26 -5.09 119.74 115.79 2dn6 s LYS 79 Ca 0.00 0.87 0.07 0.00 0.02 0.00 0.00 55.97 56.92 2dn6 s LYS 79 Cb 0.00 -2.38 -0.04 0.00 -0.52 0.00 0.00 37.83 34.89 2dn6 s LYS 79 CO 0.00 0.11 -0.14 0.95 -0.92 0.00 0.00 175.35 175.35 2dn6 s THR 80 N -2.01 1.51 -0.19 2.17 -4.23 -1.26 -1.98 115.64 109.65 2dn6 s THR 80 Ca 0.56 -1.96 -0.05 0.00 -1.18 0.00 0.00 61.69 59.07 2dn6 s THR 80 Cb -0.10 -1.79 0.07 0.00 1.34 0.00 0.00 72.50 72.02 2dn6 s THR 80 CO 0.16 -0.51 0.14 -0.36 -0.54 0.00 0.00 174.62 173.52 2dn6 s PHE 81 N -2.58 0.01 -0.32 3.99 0.40 -0.86 -5.01 117.98 113.62 2dn6 s PHE 81 Ca 0.15 -0.13 -0.15 0.00 -0.60 0.00 0.00 56.93 56.21 2dn6 s PHE 81 Cb -0.03 -0.57 -0.02 0.00 0.51 0.00 0.00 43.02 42.91 2dn6 s PHE 81 CO 0.04 -0.56 0.37 -2.00 0.70 0.00 0.00 175.22 173.77 2dn6 s GLU 82 N 2.21 3.71 0.14 0.44 2.12 -1.26 -0.46 118.70 125.60 2dn6 s GLU 82 Ca 0.04 -0.26 0.09 0.00 0.36 0.00 0.00 54.97 55.19 2dn6 s GLU 82 Cb -0.16 -3.76 -0.04 0.00 0.26 0.00 0.00 34.13 30.44 2dn6 s GLU 82 CO -0.11 -0.45 -0.20 0.42 -0.54 0.00 0.00 175.26 174.38 2dn6 s ILE 83 N 2.05 1.86 -0.07 -3.70 1.01 -0.82 0.30 121.20 121.84 2dn6 s ILE 83 Ca 0.13 -1.77 0.04 0.00 0.00 0.00 0.00 60.65 59.05 2dn6 s ILE 83 Cb -0.16 -1.76 0.00 0.00 0.01 0.00 0.00 42.46 40.54 2dn6 s ILE 83 CO 0.11 -0.16 -0.18 -0.55 0.00 0.00 0.00 174.94 174.16 2dn6 s SER 84 N -2.32 2.38 0.68 3.58 0.15 0.22 -2.34 113.70 116.05 2dn6 s SER 84 Ca 0.12 -0.41 0.02 0.00 0.70 0.00 0.00 55.95 56.38 2dn6 s SER 84 Cb -0.08 -0.89 0.12 0.00 -1.71 0.00 0.00 66.02 63.45 2dn6 s SER 84 CO 0.06 0.13 0.94 0.00 1.20 0.00 0.00 173.24 175.57 2dn6 s ALA 85 N 0.27 3.96 -0.20 5.45 0.00 -1.21 -2.76 121.76 127.26 2dn6 s ALA 85 Ca -0.11 -1.83 -0.18 0.00 0.00 0.00 0.00 51.96 49.84 2dn6 s ALA 85 Cb -0.15 -1.86 -0.14 0.00 0.00 0.00 0.00 23.12 20.97 2dn6 s ALA 85 CO 0.04 -1.30 0.01 0.45 0.00 0.00 0.00 175.76 174.97 2dn6 n SER 86 N -2.68 1.87 -4.21 0.00 2.88 -1.26 -4.84 113.62 105.38 2dn6 n SER 86 Ca 0.15 0.45 -0.12 0.00 -1.33 0.00 0.00 58.87 58.02 2dn6 n SER 86 Cb 0.61 -0.91 -0.10 0.00 -0.75 0.00 0.00 64.21 63.05 2dn6 n SER 86 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2dn6 s ASP 87 N -6.68 0.57 0.32 -3.46 1.01 -1.26 -4.90 116.67 102.26 2dn6 s ASP 87 Ca -0.28 -1.30 0.09 0.00 0.71 0.00 0.00 52.55 51.77 2dn6 s ASP 87 Cb 0.06 0.27 0.91 0.00 1.01 0.00 0.00 42.92 45.17 2dn6 s ASP 87 CO 0.49 -0.74 1.66 0.11 0.21 0.00 0.00 175.17 176.90 2dn6 h LYS 88 N 2.66 0.27 0.17 8.23 1.57 -1.96 -0.50 116.57 127.02 2dn6 h LYS 88 Ca -0.36 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.41 2dn6 h LYS 88 Cb 1.23 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 33.43 2dn6 h LYS 88 CO 0.58 0.18 -0.53 -0.22 -0.57 0.00 0.00 179.45 178.89 2dn6 h LYS 89 N 0.28 -0.76 0.88 3.15 3.64 -1.98 0.34 116.57 122.12 2dn6 h LYS 89 Ca 0.65 0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 60.04 2dn6 h LYS 89 Cb 1.40 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 33.40 2dn6 h LYS 89 CO -0.63 -0.51 -0.49 0.87 -2.27 0.00 0.00 179.45 176.43 2dn6 h LYS 90 N -0.79 -1.21 -0.41 1.90 6.56 -1.55 0.12 116.57 121.17 2dn6 h LYS 90 Ca -0.01 0.08 0.05 0.00 -1.06 0.00 0.00 60.65 59.71 2dn6 h LYS 90 Cb 0.78 0.28 -0.08 0.00 -0.57 0.00 0.00 32.23 32.64 2dn6 h LYS 90 CO -0.26 -0.81 -0.51 -0.22 -2.06 0.00 0.00 179.45 175.59 2dn6 h LYS 91 N -1.26 -0.32 0.06 3.15 3.11 -1.13 0.27 116.57 120.45 2dn6 h LYS 91 Ca -0.12 0.02 -0.00 0.00 -2.81 0.00 0.00 60.65 57.74 2dn6 h LYS 91 Cb 0.99 0.07 -0.00 0.00 -1.00 0.00 0.00 32.23 32.29 2dn6 h LYS 91 CO 0.15 -0.21 -0.05 0.37 -2.81 0.00 0.00 179.45 176.90 2dn6 h GLN 92 N -0.33 -0.10 -0.88 1.90 5.75 -0.30 -0.84 115.11 120.31 2dn6 h GLN 92 Ca 0.07 0.01 0.12 0.00 -0.15 0.00 0.00 58.65 58.69 2dn6 h GLN 92 Cb 0.53 0.02 -0.13 0.00 1.07 0.00 0.00 27.48 28.97 2dn6 h GLN 92 CO -0.57 -0.07 -0.41 0.39 -2.65 0.00 0.00 178.83 175.53 2dn6 n GLU 93 N -2.53 -0.27 0.08 1.69 -0.58 0.40 -0.32 120.64 119.10 2dn6 n GLU 93 Ca -0.01 1.34 -0.09 0.00 -0.42 0.00 0.00 57.16 57.98 2dn6 n GLU 93 Cb 0.05 -1.99 -0.05 0.00 -0.57 0.00 0.00 31.44 28.87 2dn6 n GLU 93 CO 0.00 0.00 0.00 -1.49 -0.48 0.00 0.00 177.13 175.16 2dn6 h TRP 94 N 0.00 -0.80 -0.62 -0.32 4.06 -0.37 0.13 115.95 118.03 2dn6 h TRP 94 Ca 0.25 0.02 0.11 0.00 2.06 0.00 0.00 58.89 61.33 2dn6 h TRP 94 Cb 0.47 0.34 -0.12 0.00 -1.00 0.00 0.00 29.16 28.84 2dn6 h TRP 94 CO -0.82 -0.33 -0.30 0.82 -3.56 0.00 0.00 178.44 174.25 2dn6 h ILE 95 N -0.43 0.20 -0.91 1.49 2.04 0.37 0.27 117.51 120.53 2dn6 h ILE 95 Ca -0.01 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.96 2dn6 h ILE 95 Cb 0.42 0.20 -0.08 0.00 -0.74 0.00 0.00 36.82 36.62 2dn6 h ILE 95 CO -0.13 0.00 0.55 1.56 0.00 0.00 0.00 178.15 180.13 2dn6 h GLN 96 N -0.13 0.87 0.12 2.37 1.08 -0.37 0.24 115.11 119.29 2dn6 h GLN 96 Ca 0.26 -0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.40 2dn6 h GLN 96 Cb 0.54 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 27.78 2dn6 h GLN 96 CO -0.69 0.57 -0.06 0.00 -0.95 0.00 0.00 178.83 177.71 2dn6 h ALA 97 N 1.50 -0.16 0.53 3.87 0.00 0.22 -2.21 119.26 123.01 2dn6 h ALA 97 Ca 0.45 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 2dn6 h ALA 97 Cb 0.42 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2dn6 h ALA 97 CO -0.26 -0.44 -0.26 0.82 0.00 0.00 0.00 179.25 179.11 2dn6 h ILE 98 N -0.45 0.46 -0.39 0.00 2.04 -0.17 -0.01 117.51 118.99 2dn6 h ILE 98 Ca -0.02 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.92 2dn6 h ILE 98 Cb 0.37 0.46 -0.09 0.00 -0.74 0.00 0.00 36.82 36.82 2dn6 h ILE 98 CO 0.03 0.00 -0.36 -0.74 0.00 0.00 0.00 178.15 177.07 2dn6 h HIS 99 N -0.72 -1.03 -0.76 1.37 2.76 -0.60 -0.45 115.15 115.71 2dn6 h HIS 99 Ca -0.07 0.06 0.03 0.00 -2.20 0.00 0.00 60.37 58.19 2dn6 h HIS 99 Cb 0.56 0.51 -0.05 0.00 1.55 0.00 0.00 27.41 29.98 2dn6 h HIS 99 CO -0.04 -0.41 0.48 1.03 -1.30 0.00 0.00 177.93 177.69 2dn6 h SER 100 N -0.29 0.79 -1.00 3.26 0.87 -1.32 -1.92 113.55 113.95 2dn6 h SER 100 Ca 0.16 -0.00 0.17 0.00 -1.23 0.00 0.00 61.79 60.89 2dn6 h SER 100 Cb 0.56 -0.17 -0.10 0.00 -0.44 0.00 0.00 62.40 62.25 2dn6 h SER 100 CO -0.55 0.54 0.62 0.74 -0.53 0.00 0.00 176.83 177.65 2dn6 h THR 101 N 0.93 0.75 -0.16 2.23 2.02 0.63 -0.70 112.91 118.62 2dn6 h THR 101 Ca 0.31 -0.28 -0.21 0.00 0.77 0.00 0.00 66.41 66.99 2dn6 h THR 101 Cb 0.02 -0.13 0.01 0.00 -1.74 0.00 0.00 68.15 66.31 2dn6 h THR 101 CO -0.11 0.15 -0.73 0.40 0.37 0.00 0.00 175.52 175.59 2dn6 h ILE 102 N 0.82 1.29 -1.00 3.11 2.04 -0.60 -3.21 117.51 119.96 2dn6 h ILE 102 Ca 0.56 -1.93 0.11 0.00 1.00 0.00 0.00 64.86 64.60 2dn6 h ILE 102 Cb 0.81 1.98 -0.08 0.00 -0.74 0.00 0.00 36.82 38.79 2dn6 h ILE 102 CO -0.36 0.61 0.63 -0.74 0.00 0.00 0.00 178.15 178.30 2dn6 h HIS 103 N 0.50 1.14 -0.25 1.37 2.76 -0.47 0.32 115.15 120.52 2dn6 h HIS 103 Ca -0.05 0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.18 2dn6 h HIS 103 Cb 1.36 -0.36 -0.01 0.00 1.55 0.00 0.00 27.41 29.95 2dn6 h HIS 103 CO 0.09 0.48 0.17 -0.07 -1.30 0.00 0.00 177.93 177.29 2dn6 h LEU 104 N 1.01 0.18 -0.62 0.26 3.38 -1.33 -1.01 115.31 117.19 2dn6 h LEU 104 Ca 0.48 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.30 2dn6 h LEU 104 Cb 0.44 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2dn6 h LEU 104 CO -0.24 0.13 -0.62 -0.07 0.09 0.00 0.00 178.44 177.72 2dn6 h LEU 105 N 0.21 0.29 -0.43 1.67 3.38 -1.01 -3.20 115.31 116.22 2dn6 h LEU 105 Ca 0.10 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 2dn6 h LEU 105 Cb 0.15 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2dn6 h LEU 105 CO -0.02 0.84 0.27 0.11 0.09 0.00 0.00 178.44 179.72 2dn6 h LYS 106 N 0.18 0.58 -0.86 1.13 1.57 -0.92 -2.87 116.57 115.40 2dn6 h LYS 106 Ca -0.01 -0.05 0.17 0.00 -1.87 0.00 0.00 60.65 58.89 2dn6 h LYS 106 Cb 1.14 -0.12 -0.16 0.00 0.08 0.00 0.00 32.23 33.16 2dn6 h LYS 106 CO 0.10 0.42 -0.22 -0.07 -0.57 0.00 0.00 179.45 179.11 2dn6 h LEU 107 N 0.57 -0.82 0.00 2.94 -0.00 -1.51 -2.77 115.31 113.72 2dn6 h LEU 107 Ca 0.16 0.26 0.00 0.00 -0.00 0.00 0.00 57.88 58.29 2dn6 h LEU 107 Cb -0.02 0.54 0.00 0.00 -0.00 0.00 0.00 40.66 41.18 2dn6 h LEU 107 CO -0.03 -0.28 0.00 0.61 -0.00 0.00 0.00 178.44 178.74 2dn6 n GLY 108 N -1.55 -3.11 3.67 0.83 0.00 -1.08 -4.49 105.19 99.47 2dn6 n GLY 108 Ca 0.13 0.65 -0.35 0.00 0.00 0.00 0.00 46.02 46.44 2dn6 n GLY 108 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dn6 s SER 109 N -2.72 5.17 0.35 1.61 0.01 -1.04 -5.12 113.70 111.96 2dn6 s SER 109 Ca 0.00 0.13 0.07 0.00 1.31 0.00 0.00 55.95 57.45 2dn6 s SER 109 Cb 0.00 -1.44 -0.01 0.00 0.21 0.00 0.00 66.02 64.78 2dn6 s SER 109 CO 0.00 0.38 0.49 -0.44 0.41 0.00 0.00 173.24 174.07 2dn6 s SER 110 N -0.86 5.92 0.00 2.44 0.01 -1.26 -4.79 113.70 115.15 2dn6 s SER 110 Ca 0.13 -0.22 0.00 0.00 1.31 0.00 0.00 55.95 57.17 2dn6 s SER 110 Cb -0.11 -1.14 0.00 0.00 0.21 0.00 0.00 66.02 64.98 2dn6 s SER 110 CO 0.02 -0.49 0.00 0.61 0.41 0.00 0.00 173.24 173.79 2dn6 n GLY 111 N -1.68 -2.66 3.77 3.44 0.00 -1.26 -4.96 105.19 101.84 2dn6 n GLY 111 Ca 0.01 -1.26 -0.39 0.00 0.00 0.00 0.00 46.02 44.38 2dn6 n GLY 111 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dn6 s PRO 112 N -4.84 4.18 0.07 1.61 0.04 -1.26 -5.02 135.00 129.78 2dn6 s PRO 112 Ca 0.00 1.94 -0.17 0.00 0.04 0.00 0.00 61.00 62.81 2dn6 s PRO 112 Cb 0.00 -2.83 -0.06 0.00 0.04 0.00 0.00 34.50 31.65 2dn6 s PRO 112 CO 0.00 -0.24 0.52 -1.54 0.04 0.00 0.00 177.00 175.78 2dn6 s SER 113 N -0.94 6.94 -0.12 6.66 1.04 -1.26 -5.01 113.70 121.01 2dn6 s SER 113 Ca 0.54 1.14 -0.25 0.00 0.48 0.00 0.00 55.95 57.85 2dn6 s SER 113 Cb -0.33 -2.31 -0.27 0.00 0.10 0.00 0.00 66.02 63.21 2dn6 s SER 113 CO 0.43 0.24 0.72 0.77 0.98 0.00 0.00 173.24 176.38 2dn6 h SER 114 N 4.33 0.14 -0.03 7.02 4.64 -2.04 -3.53 113.55 124.08 2dn6 h SER 114 Ca -0.50 -0.92 0.00 0.00 -0.47 0.00 0.00 61.79 59.90 2dn6 h SER 114 Cb 1.21 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2dn6 h SER 114 CO 0.64 1.20 0.00 0.61 -0.87 0.00 0.00 176.83 178.40