#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 3.86 0.64 1.61 0.01 -1.26 -4.97 113.70 113.59 2dn6 s SER 2 Ca 0.00 -1.46 0.18 0.00 1.31 0.00 0.00 55.95 55.98 2dn6 s SER 2 Cb 0.00 -0.94 0.86 0.00 0.21 0.00 0.00 66.02 66.16 2dn6 s SER 2 CO 0.00 -0.36 1.45 0.77 0.41 0.00 0.00 173.24 175.51 2dn6 h SER 3 N 8.05 0.00 -3.17 2.44 4.64 -2.10 -3.37 113.55 120.04 2dn6 h SER 3 Ca -0.14 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.61 2dn6 h SER 3 Cb 1.04 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.09 2dn6 h SER 3 CO 0.44 0.00 1.11 -0.83 -0.87 0.00 0.00 176.83 176.68 2dn6 s GLY 4 N -3.43 1.05 0.21 -0.77 0.00 -1.26 -4.90 107.32 98.22 2dn6 s GLY 4 Ca -0.02 -0.07 -0.20 0.00 0.00 0.00 0.00 44.72 44.43 2dn6 s GLY 4 CO 0.26 2.85 1.56 0.23 0.00 0.00 0.00 173.10 178.00 2dn6 h SER 5 N 11.05 -1.45 -2.20 1.64 0.87 -2.06 -3.41 113.55 118.00 2dn6 h SER 5 Ca -0.29 0.29 -0.34 0.00 -1.23 0.00 0.00 61.79 60.23 2dn6 h SER 5 Cb 1.12 0.74 0.18 0.00 -0.44 0.00 0.00 62.40 64.00 2dn6 h SER 5 CO 1.07 -0.29 -0.62 -1.20 -0.53 0.00 0.00 176.83 175.27 2dn6 n SER 6 N -5.45 -2.86 0.00 6.23 7.64 -1.26 -4.83 113.62 113.09 2dn6 n SER 6 Ca 0.08 -0.33 0.00 0.00 1.01 0.00 0.00 58.87 59.63 2dn6 n SER 6 Cb 0.38 -0.87 0.00 0.00 -1.01 0.00 0.00 64.21 62.71 2dn6 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dn6 n GLY 7 N 2.21 -0.53 2.40 0.23 0.00 -1.26 -5.05 105.19 103.19 2dn6 n GLY 7 Ca 0.04 0.25 -0.41 0.00 0.00 0.00 0.00 46.02 45.90 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 0.00 0.00 -0.04 1.61 3.14 -1.26 -4.55 118.33 117.23 2dn6 n VAL 8 Ca 0.00 0.00 -0.09 0.00 -2.96 0.00 0.00 64.34 61.29 2dn6 n VAL 8 Cb 0.00 -0.09 -0.08 0.00 -1.06 0.00 0.00 33.84 32.61 2dn6 n VAL 8 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2dn6 h LEU 9 N 2.37 -0.03 -8.75 6.55 3.38 -0.49 -3.48 115.31 114.86 2dn6 h LEU 9 Ca -0.33 -0.59 -0.45 0.00 0.09 0.00 0.00 57.88 56.59 2dn6 h LEU 9 Cb 0.95 0.01 -0.17 0.00 0.09 0.00 0.00 40.66 41.54 2dn6 h LEU 9 CO 0.50 0.74 -0.76 -0.75 0.09 0.00 0.00 178.44 178.26 2dn6 s LYS 10 N -2.27 1.18 -0.26 1.13 2.20 -1.18 -4.99 119.74 115.55 2dn6 s LYS 10 Ca -0.12 -1.39 -0.17 0.00 -0.36 0.00 0.00 55.97 53.93 2dn6 s LYS 10 Cb -0.01 -1.08 0.07 0.00 -1.51 0.00 0.00 37.83 35.30 2dn6 s LYS 10 CO 0.45 0.20 0.65 1.14 -0.36 0.00 0.00 175.35 177.44 2dn6 s GLN 11 N -3.01 0.69 0.23 4.03 -2.07 -1.26 -0.88 119.66 117.39 2dn6 s GLN 11 Ca 0.15 1.11 -0.20 0.00 -1.82 0.00 0.00 55.36 54.60 2dn6 s GLN 11 Cb -0.04 0.17 0.07 0.00 -1.09 0.00 0.00 33.01 32.13 2dn6 s GLN 11 CO 0.05 -0.14 0.99 0.20 -1.32 0.00 0.00 175.29 175.07 2dn6 s GLY 12 N 1.34 0.20 -0.44 2.60 0.00 -1.19 -5.01 107.32 104.82 2dn6 s GLY 12 Ca -0.08 -0.47 -0.12 0.00 0.00 0.00 0.00 44.72 44.06 2dn6 s GLY 12 CO -0.15 2.09 0.31 -0.19 0.00 0.00 0.00 173.10 175.15 2dn6 s TYR 13 N -2.10 3.30 0.39 1.90 2.02 -1.26 -2.03 117.35 119.56 2dn6 s TYR 13 Ca 0.21 -1.26 0.08 0.00 -0.37 0.00 0.00 57.07 55.73 2dn6 s TYR 13 Cb -0.03 -3.00 -0.06 0.00 -0.40 0.00 0.00 41.96 38.48 2dn6 s TYR 13 CO 0.07 -0.81 0.11 -1.64 -1.57 0.00 0.00 175.55 171.70 2dn6 s MET 14 N 1.52 2.16 -0.34 -0.62 -1.94 -1.05 -4.88 119.30 114.13 2dn6 s MET 14 Ca 0.03 -1.84 -0.08 0.00 -1.71 0.00 0.00 55.69 52.09 2dn6 s MET 14 Cb -0.23 -1.93 0.03 0.00 2.01 0.00 0.00 34.83 34.71 2dn6 s MET 14 CO 0.04 -0.03 0.14 -1.64 -0.01 0.00 0.00 175.02 173.52 2dn6 s MET 15 N -3.82 2.78 -0.18 2.03 1.00 -0.97 -0.62 119.30 119.51 2dn6 s MET 15 Ca 0.38 -1.09 -0.12 0.00 0.00 0.00 0.00 55.69 54.87 2dn6 s MET 15 Cb 0.03 -3.54 -0.05 0.00 0.00 0.00 0.00 34.83 31.28 2dn6 s MET 15 CO 0.21 -0.64 0.21 0.21 0.00 0.00 0.00 175.02 175.02 2dn6 s LYS 16 N 1.47 4.23 -0.49 2.03 2.20 -1.10 0.94 119.74 129.02 2dn6 s LYS 16 Ca 0.00 -0.06 -0.27 0.00 -0.36 0.00 0.00 55.97 55.28 2dn6 s LYS 16 Cb -0.19 -3.42 -0.02 0.00 -1.51 0.00 0.00 37.83 32.68 2dn6 s LYS 16 CO 0.04 0.26 1.88 0.21 -0.36 0.00 0.00 175.35 177.38 2dn6 s LYS 17 N 0.43 2.87 0.00 4.03 2.20 -0.71 -3.61 119.74 124.96 2dn6 s LYS 17 Ca 0.12 1.01 0.00 0.00 -0.36 0.00 0.00 55.97 56.75 2dn6 s LYS 17 Cb -0.12 -4.33 0.00 0.00 -1.51 0.00 0.00 37.83 31.87 2dn6 s LYS 17 CO 0.01 -2.42 0.04 0.41 -0.36 0.00 0.00 175.35 173.03 2dn6 n GLY 18 N 5.61 0.10 3.77 5.54 0.00 -1.25 -4.76 105.19 114.19 2dn6 n GLY 18 Ca 0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.85 2dn6 n GLY 18 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2dn6 s HIS 19 N -0.73 2.56 0.22 1.61 3.76 -1.26 -4.92 115.29 116.53 2dn6 s HIS 19 Ca 0.00 1.31 -0.07 0.00 -0.15 0.00 0.00 55.06 56.15 2dn6 s HIS 19 Cb 0.00 -3.85 0.19 0.00 1.11 0.00 0.00 32.58 30.03 2dn6 s HIS 19 CO 0.00 -2.69 1.78 0.00 -0.85 0.00 0.00 174.74 172.98 2dn6 h ARG 20 N 2.42 1.16 0.33 1.40 3.08 -1.98 -3.27 114.38 117.52 2dn6 h ARG 20 Ca -0.50 -0.22 -0.02 0.00 0.07 0.00 0.00 59.98 59.31 2dn6 h ARG 20 Cb 1.26 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 31.13 2dn6 h ARG 20 CO 0.61 0.95 -0.16 -0.09 -1.07 0.00 0.00 179.97 180.21 2dn6 h ARG 21 N 1.12 -0.43 -1.24 0.04 2.43 -2.00 -3.47 114.38 110.83 2dn6 h ARG 21 Ca 0.25 0.03 0.17 0.00 -0.81 0.00 0.00 59.98 59.62 2dn6 h ARG 21 Cb 0.24 0.10 -0.30 0.00 -0.42 0.00 0.00 29.97 29.58 2dn6 h ARG 21 CO -0.02 -0.29 0.58 -1.59 -1.51 0.00 0.00 179.97 177.14 2dn6 s LYS 22 N -3.75 0.19 -0.21 0.20 -2.85 -1.23 -5.17 119.74 106.92 2dn6 s LYS 22 Ca -0.07 0.34 -0.32 0.00 -1.00 0.00 0.00 55.97 54.92 2dn6 s LYS 22 Cb 0.01 0.05 0.15 0.00 -2.06 0.00 0.00 37.83 35.98 2dn6 s LYS 22 CO 0.20 -0.04 1.21 1.21 0.10 0.00 0.00 175.35 178.02 2dn6 s ASN 23 N 1.23 -0.15 -0.24 0.03 2.47 -1.26 -4.74 114.94 112.28 2dn6 s ASN 23 Ca -0.08 0.08 -0.08 0.00 0.42 0.00 0.00 52.86 53.20 2dn6 s ASN 23 Cb -0.03 0.14 0.11 0.00 -1.45 0.00 0.00 41.25 40.02 2dn6 s ASN 23 CO -0.12 -0.20 0.52 0.26 -3.72 0.00 0.00 177.10 173.84 2dn6 s TRP 24 N -1.79 -1.03 -0.02 0.43 0.52 -1.26 -3.89 118.94 111.89 2dn6 s TRP 24 Ca 0.07 1.88 0.04 0.00 0.02 0.00 0.00 56.10 58.10 2dn6 s TRP 24 Cb -0.01 0.52 -0.00 0.00 -1.15 0.00 0.00 33.47 32.83 2dn6 s TRP 24 CO -0.05 -0.56 -0.13 -0.08 0.02 0.00 0.00 176.95 176.16 2dn6 s THR 25 N 2.71 1.05 -0.68 2.01 -1.32 -1.24 -4.94 115.64 113.24 2dn6 s THR 25 Ca -0.04 -0.53 -0.27 0.00 -1.21 0.00 0.00 61.69 59.65 2dn6 s THR 25 Cb -0.12 -0.90 -0.00 0.00 -1.51 0.00 0.00 72.50 69.97 2dn6 s THR 25 CO -0.15 0.31 1.63 -0.70 -2.21 0.00 0.00 174.62 173.49 2dn6 s GLU 26 N -0.03 2.86 0.03 7.08 2.12 -1.26 -2.70 118.70 126.81 2dn6 s GLU 26 Ca -0.00 0.23 0.05 0.00 0.36 0.00 0.00 54.97 55.60 2dn6 s GLU 26 Cb -0.08 -4.34 -0.03 0.00 0.26 0.00 0.00 34.13 29.94 2dn6 s GLU 26 CO 0.01 -2.51 -0.11 0.50 -0.54 0.00 0.00 175.26 172.61 2dn6 s ARG 27 N 6.50 2.34 -0.02 4.30 6.06 0.20 -4.89 118.95 133.44 2dn6 s ARG 27 Ca 0.54 -0.85 -0.30 0.00 -2.50 0.00 0.00 55.73 52.62 2dn6 s ARG 27 Cb -0.10 -2.37 -0.03 0.00 0.06 0.00 0.00 34.95 32.50 2dn6 s ARG 27 CO 0.17 0.57 1.10 -0.46 -2.50 0.00 0.00 175.30 174.19 2dn6 s TRP 28 N -1.01 3.45 0.06 5.12 -0.11 -0.89 -2.53 118.94 123.03 2dn6 s TRP 28 Ca 0.17 1.44 0.06 0.00 1.22 0.00 0.00 56.10 58.99 2dn6 s TRP 28 Cb -0.11 -3.30 -0.04 0.00 -1.50 0.00 0.00 33.47 28.53 2dn6 s TRP 28 CO 0.08 -0.75 -0.11 -0.06 -4.62 0.00 0.00 176.95 171.49 2dn6 s PHE 29 N 1.53 2.74 -0.32 5.86 0.40 -0.86 -0.45 117.98 126.88 2dn6 s PHE 29 Ca 0.54 -0.15 -0.00 0.00 -0.60 0.00 0.00 56.93 56.72 2dn6 s PHE 29 Cb -0.24 -1.49 0.10 0.00 0.51 0.00 0.00 43.02 41.91 2dn6 s PHE 29 CO 0.25 0.37 0.10 0.08 0.70 0.00 0.00 175.22 176.72 2dn6 s VAL 30 N -1.09 1.00 -0.96 -0.44 1.01 0.30 -3.20 120.40 117.03 2dn6 s VAL 30 Ca 0.19 -1.51 -0.24 0.00 0.00 0.00 0.00 61.98 60.42 2dn6 s VAL 30 Cb -0.11 -1.76 0.01 0.00 0.00 0.00 0.00 36.38 34.52 2dn6 s VAL 30 CO 0.10 -0.68 1.65 -0.22 0.00 0.00 0.00 175.10 175.95 2dn6 s LEU 31 N 1.53 3.36 0.81 3.92 2.96 -0.06 -2.07 118.68 129.12 2dn6 s LEU 31 Ca 0.10 -1.08 -0.11 0.00 -0.22 0.00 0.00 54.13 52.82 2dn6 s LEU 31 Cb -0.18 -2.56 0.07 0.00 0.50 0.00 0.00 46.19 44.02 2dn6 s LEU 31 CO -0.23 -2.02 1.09 -0.54 -1.32 0.00 0.00 176.35 173.32 2dn6 s LYS 32 N 5.84 2.01 0.42 1.98 -0.14 0.88 0.24 119.74 130.98 2dn6 s LYS 32 Ca 0.56 0.86 0.21 0.00 -1.36 0.00 0.00 55.97 56.24 2dn6 s LYS 32 Cb -0.03 -1.89 0.92 0.00 -1.68 0.00 0.00 37.83 35.15 2dn6 s LYS 32 CO -0.05 -1.73 1.84 -1.00 -0.76 0.00 0.00 175.35 173.65 2dn6 h PRO 33 N -1.18 0.00 0.00 -1.68 0.13 -1.94 -3.25 132.00 124.09 2dn6 h PRO 33 Ca -0.46 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.58 2dn6 h PRO 33 Cb 1.26 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.20 2dn6 h PRO 33 CO 0.56 0.28 -0.72 0.09 -0.23 0.00 0.00 178.00 177.98 2dn6 n ASN 34 N -3.59 0.97 -4.00 1.44 4.13 -1.26 -4.96 115.26 108.00 2dn6 n ASN 34 Ca -0.01 -2.41 0.05 0.00 1.68 0.00 0.00 54.58 53.89 2dn6 n ASN 34 Cb 0.42 -0.32 0.01 0.00 -1.54 0.00 0.00 39.78 38.34 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 -0.79 0.00 -0.26 2.41 2.07 -1.23 -4.07 121.20 119.34 2dn6 s ILE 35 Ca 0.26 -0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.48 2dn6 s ILE 35 Cb 0.27 -2.90 0.13 0.00 0.13 0.00 0.00 42.46 40.10 2dn6 s ILE 35 CO -0.09 0.00 0.33 -0.63 -1.91 0.00 0.00 174.94 172.64 2dn6 s ILE 36 N -2.00 -0.50 0.26 2.00 1.01 -1.06 -0.08 121.20 120.83 2dn6 s ILE 36 Ca 0.31 -0.25 0.11 0.00 0.00 0.00 0.00 60.65 60.81 2dn6 s ILE 36 Cb 0.01 -0.88 -0.05 0.00 0.01 0.00 0.00 42.46 41.55 2dn6 s ILE 36 CO -0.03 -0.28 -0.11 -0.44 0.00 0.00 0.00 174.94 174.08 2dn6 s SER 37 N 2.45 4.05 -0.06 3.58 0.01 -0.88 -0.51 113.70 122.34 2dn6 s SER 37 Ca 0.10 -0.81 0.02 0.00 1.31 0.00 0.00 55.95 56.57 2dn6 s SER 37 Cb -0.14 -0.57 0.02 0.00 0.21 0.00 0.00 66.02 65.53 2dn6 s SER 37 CO -0.23 0.04 -0.08 -0.72 0.41 0.00 0.00 173.24 172.65 2dn6 s TYR 38 N -2.28 1.08 0.22 2.43 1.13 -1.20 0.11 117.35 118.84 2dn6 s TYR 38 Ca 0.29 -0.37 0.06 0.00 -1.41 0.00 0.00 57.07 55.65 2dn6 s TYR 38 Cb -0.06 -0.86 -0.04 0.00 -1.10 0.00 0.00 41.96 39.90 2dn6 s TYR 38 CO 0.17 -0.24 0.20 0.71 -2.51 0.00 0.00 175.55 173.88 2dn6 s TYR 39 N 0.83 3.18 0.21 -3.49 1.51 0.41 -1.87 117.35 118.13 2dn6 s TYR 39 Ca -0.12 -0.06 -0.10 0.00 -1.01 0.00 0.00 57.07 55.78 2dn6 s TYR 39 Cb -0.15 -1.47 0.27 0.00 -0.11 0.00 0.00 41.96 40.50 2dn6 s TYR 39 CO 0.02 0.51 1.76 0.28 -1.11 0.00 0.00 175.55 177.00 2dn6 h VAL 40 N 1.61 0.81 -1.81 0.71 2.07 -1.74 -2.36 116.25 115.55 2dn6 h VAL 40 Ca -0.49 -0.16 -0.62 0.00 0.82 0.00 0.00 66.70 66.26 2dn6 h VAL 40 Cb 1.22 0.32 -0.13 0.00 -1.52 0.00 0.00 31.29 31.18 2dn6 h VAL 40 CO 0.62 0.08 -0.50 -0.94 0.02 0.00 0.00 177.57 176.85 2dn6 s SER 41 N -5.42 3.33 -0.11 0.57 1.04 -1.26 -4.12 113.70 107.72 2dn6 s SER 41 Ca -0.13 -1.72 0.00 0.00 0.48 0.00 0.00 55.95 54.58 2dn6 s SER 41 Cb 0.17 0.62 0.12 0.00 0.10 0.00 0.00 66.02 67.02 2dn6 s SER 41 CO 0.75 -0.96 1.55 -1.84 0.98 0.00 0.00 173.24 173.72 2dn6 n GLU 42 N -1.07 1.29 -0.07 4.02 0.28 -1.26 -3.62 120.64 120.21 2dn6 n GLU 42 Ca -0.11 -0.64 -0.07 0.00 -0.16 0.00 0.00 57.16 56.18 2dn6 n GLU 42 Cb 0.65 -1.25 -0.10 0.00 1.43 0.00 0.00 31.44 32.18 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 0.54 1.96 -1.73 -1.84 8.00 -1.26 -5.03 116.55 117.19 2dn6 n ASP 43 Ca 0.12 -0.01 -0.09 0.00 0.71 0.00 0.00 54.79 55.53 2dn6 n ASP 43 Cb 0.65 0.68 0.03 0.00 -0.02 0.00 0.00 41.12 42.45 2dn6 n ASP 43 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2dn6 n LEU 44 N -2.54 -2.59 -0.07 0.64 4.77 -1.24 -4.97 117.00 111.01 2dn6 n LEU 44 Ca -0.22 -0.21 -0.11 0.00 -0.03 0.00 0.00 56.01 55.44 2dn6 n LEU 44 Cb 0.90 -1.47 -0.06 0.00 -2.33 0.00 0.00 43.42 40.45 2dn6 n LEU 44 CO 0.26 0.23 -0.98 0.29 -1.33 0.00 0.00 177.39 175.86 2dn6 n LYS 45 N -2.21 0.35 -3.84 3.23 4.76 -1.26 -4.89 118.16 114.29 2dn6 n LYS 45 Ca -0.02 0.09 -0.35 0.00 -2.87 0.00 0.00 58.31 55.17 2dn6 n LYS 45 Cb 0.53 -1.23 -0.12 0.00 -1.84 0.00 0.00 35.03 32.36 2dn6 n LYS 45 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2dn6 s ASP 46 N -5.59 5.09 0.53 4.39 1.01 -1.26 -5.10 116.67 115.74 2dn6 s ASP 46 Ca -0.20 -2.21 -0.17 0.00 0.71 0.00 0.00 52.55 50.67 2dn6 s ASP 46 Cb 0.06 -1.78 -0.07 0.00 1.01 0.00 0.00 42.92 42.14 2dn6 s ASP 46 CO 0.32 -0.47 1.01 -0.75 0.21 0.00 0.00 175.17 175.49 2dn6 s LYS 47 N 0.86 3.75 -0.15 8.23 2.20 -1.26 -2.31 119.74 131.06 2dn6 s LYS 47 Ca 0.10 1.13 -0.01 0.00 -0.36 0.00 0.00 55.97 56.83 2dn6 s LYS 47 Cb -0.22 -2.10 -0.09 0.00 -1.51 0.00 0.00 37.83 33.91 2dn6 s LYS 47 CO -0.05 -0.45 -0.15 1.63 -0.36 0.00 0.00 175.35 175.98 2dn6 n LYS 48 N -1.51 0.36 -3.79 4.03 4.76 -0.78 -4.90 118.16 116.34 2dn6 n LYS 48 Ca 0.08 0.10 -0.04 0.00 -2.87 0.00 0.00 58.31 55.58 2dn6 n LYS 48 Cb 0.53 -1.25 -0.01 0.00 -1.84 0.00 0.00 35.03 32.47 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 -5.40 -0.14 -0.01 0.72 0.00 -1.25 -5.05 107.32 96.18 2dn6 s GLY 49 Ca -0.20 -0.03 0.03 0.00 0.00 0.00 0.00 44.72 44.52 2dn6 s GLY 49 CO 0.33 0.34 -0.09 0.51 0.00 0.00 0.00 173.10 174.19 2dn6 s ASP 50 N -3.02 1.11 -0.57 1.64 -4.77 -1.26 -3.22 116.67 106.58 2dn6 s ASP 50 Ca 0.14 -0.17 -0.04 0.00 -3.30 0.00 0.00 52.55 49.18 2dn6 s ASP 50 Cb -0.02 -0.20 0.15 0.00 -1.09 0.00 0.00 42.92 41.75 2dn6 s ASP 50 CO 0.04 0.09 0.39 -0.63 0.70 0.00 0.00 175.17 175.76 2dn6 s ILE 51 N -0.03 3.75 -0.42 2.11 1.01 0.33 -4.98 121.20 122.98 2dn6 s ILE 51 Ca 0.01 -2.60 -0.35 0.00 0.00 0.00 0.00 60.65 57.71 2dn6 s ILE 51 Cb -0.06 -3.47 -0.12 0.00 0.01 0.00 0.00 42.46 38.82 2dn6 s ILE 51 CO -0.00 -0.83 2.25 0.18 0.00 0.00 0.00 174.94 176.54 2dn6 n LEU 52 N 3.92 1.91 -4.73 2.97 4.77 -1.26 -2.55 117.00 122.02 2dn6 n LEU 52 Ca 0.04 0.32 -0.41 0.00 -0.03 0.00 0.00 56.01 55.93 2dn6 n LEU 52 Cb 0.39 -1.24 -0.04 0.00 -2.33 0.00 0.00 43.42 40.20 2dn6 n LEU 52 CO 0.34 -0.81 0.73 -0.76 -1.33 0.00 0.00 177.39 175.56 2dn6 s LEU 53 N 7.83 4.50 -0.09 2.23 1.43 -1.26 -4.85 118.68 128.47 2dn6 s LEU 53 Ca 1.11 1.94 -0.30 0.00 -1.03 0.00 0.00 54.13 55.85 2dn6 s LEU 53 Cb -0.87 -3.60 0.12 0.00 0.03 0.00 0.00 46.19 41.88 2dn6 s LEU 53 CO 0.48 -0.14 0.99 -0.62 0.23 0.00 0.00 176.35 177.29 2dn6 s ASP 54 N -0.08 -0.31 0.17 2.29 2.15 -1.26 -4.81 116.67 114.82 2dn6 s ASP 54 Ca 0.48 0.11 -0.08 0.00 0.43 0.00 0.00 52.55 53.48 2dn6 s ASP 54 Cb -0.26 0.31 0.24 0.00 -0.30 0.00 0.00 42.92 42.90 2dn6 s ASP 54 CO 0.32 -0.46 1.04 -1.84 -0.17 0.00 0.00 175.17 174.06 2dn6 n GLU 55 N 0.05 -0.11 -0.13 4.34 0.28 -1.26 0.12 120.64 123.94 2dn6 n GLU 55 Ca -0.07 1.04 -0.06 0.00 -0.16 0.00 0.00 57.16 57.90 2dn6 n GLU 55 Cb 0.60 -1.55 -0.00 0.00 1.43 0.00 0.00 31.44 31.92 2dn6 n GLU 55 CO 0.00 0.00 0.00 -2.95 -0.16 0.00 0.00 177.13 174.02 2dn6 h ASN 56 N 0.00 -0.94 -2.97 -1.84 7.08 -1.96 -3.40 115.58 111.55 2dn6 h ASN 56 Ca 0.28 0.18 -0.52 0.00 -3.08 0.00 0.00 56.30 53.16 2dn6 h ASN 56 Cb 0.45 0.46 0.06 0.00 -2.08 0.00 0.00 38.32 37.21 2dn6 h ASN 56 CO -0.68 -0.29 0.91 0.00 -2.08 0.00 0.00 177.43 175.29 2dn6 s VAL 59 N -2.14 4.85 -0.03 0.00 0.11 -1.26 -0.07 120.40 121.85 2dn6 s VAL 59 Ca -0.08 -0.40 -0.02 0.00 -2.93 0.00 0.00 61.98 58.56 2dn6 s VAL 59 Cb -0.02 -3.24 0.02 0.00 -1.53 0.00 0.00 36.38 31.61 2dn6 s VAL 59 CO -0.00 0.32 0.08 -1.83 -3.33 0.00 0.00 175.10 170.33 2dn6 s GLU 60 N -1.85 0.05 0.39 1.54 1.03 0.09 -4.95 118.70 114.99 2dn6 s GLU 60 Ca 0.25 0.18 -0.26 0.00 0.03 0.00 0.00 54.97 55.16 2dn6 s GLU 60 Cb -0.12 -0.08 -0.09 0.00 -0.80 0.00 0.00 34.13 33.04 2dn6 s GLU 60 CO 0.16 -0.08 1.22 -1.12 -1.33 0.00 0.00 175.26 174.10 2dn6 s SER 61 N 0.54 6.53 0.21 0.83 0.01 -1.26 -1.54 113.70 119.02 2dn6 s SER 61 Ca -0.04 2.46 0.10 0.00 1.31 0.00 0.00 55.95 59.79 2dn6 s SER 61 Cb -0.06 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.50 2dn6 s SER 61 CO -0.02 -0.68 -0.16 -0.76 0.41 0.00 0.00 173.24 172.03 2dn6 s LEU 62 N -2.34 2.72 0.00 2.44 1.43 -0.61 -4.84 118.68 117.48 2dn6 s LEU 62 Ca 0.55 -0.78 -0.14 0.00 -1.03 0.00 0.00 54.13 52.73 2dn6 s LEU 62 Cb -0.34 -1.38 0.21 0.00 0.03 0.00 0.00 46.19 44.72 2dn6 s LEU 62 CO 0.43 0.09 0.75 -0.81 0.23 0.00 0.00 176.35 177.03 2dn6 n PRO 63 N -0.11 -2.49 -3.34 1.29 -0.04 -1.26 -4.02 135.00 125.03 2dn6 n PRO 63 Ca -0.10 -1.20 -0.40 0.00 -0.04 0.00 0.00 63.50 61.77 2dn6 n PRO 63 Cb 0.57 -1.12 -0.09 0.00 -0.04 0.00 0.00 33.50 32.82 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 -3.52 6.30 0.02 3.54 1.47 -1.26 -4.53 116.67 118.68 2dn6 s ASP 64 Ca 0.49 0.28 -0.00 0.00 1.18 0.00 0.00 52.55 54.50 2dn6 s ASP 64 Cb -0.05 -2.23 -0.02 0.00 -0.34 0.00 0.00 42.92 40.28 2dn6 s ASP 64 CO 0.37 -0.25 -0.03 -1.59 0.68 0.00 0.00 175.17 174.36 2dn6 s LYS 65 N 2.16 0.32 -1.25 2.11 0.00 -1.26 -4.86 119.74 116.95 2dn6 s LYS 65 Ca 0.17 -0.62 -0.06 0.00 0.00 0.00 0.00 55.97 55.46 2dn6 s LYS 65 Cb -0.16 0.11 0.01 0.00 0.00 0.00 0.00 37.83 37.79 2dn6 s LYS 65 CO 0.10 -0.05 1.08 -3.47 0.00 0.00 0.00 175.35 173.01 2dn6 n ASP 66 N 1.57 -5.06 -3.63 0.03 2.03 -1.26 -2.86 116.55 107.37 2dn6 n ASP 66 Ca -0.24 -0.54 -0.22 0.00 0.52 0.00 0.00 54.79 54.32 2dn6 n ASP 66 Cb 0.55 -4.85 0.04 0.00 -0.72 0.00 0.00 41.12 36.14 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 -1.72 -0.51 3.51 0.27 0.00 -1.26 -5.00 105.19 100.48 2dn6 n GLY 67 Ca -0.07 0.23 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 2dn6 n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dn6 s LYS 68 N -5.75 1.82 0.03 1.61 -0.14 -1.14 -5.17 119.74 111.01 2dn6 s LYS 68 Ca 0.13 -2.07 -0.14 0.00 -1.36 0.00 0.00 55.97 52.54 2dn6 s LYS 68 Cb -0.03 -0.90 0.02 0.00 -1.68 0.00 0.00 37.83 35.24 2dn6 s LYS 68 CO 0.81 -0.29 0.31 -1.59 -0.76 0.00 0.00 175.35 173.82 2dn6 s LYS 69 N -3.82 0.78 -1.23 1.68 0.00 -1.26 -4.37 119.74 111.53 2dn6 s LYS 69 Ca 0.29 -0.43 -0.08 0.00 0.00 0.00 0.00 55.97 55.75 2dn6 s LYS 69 Cb 0.06 0.34 -0.01 0.00 0.00 0.00 0.00 37.83 38.22 2dn6 s LYS 69 CO 0.14 -0.24 0.73 0.00 0.00 0.00 0.00 175.35 175.98 2dn6 s LEU 71 N -6.47 4.09 -0.18 0.00 1.43 -1.26 -2.79 118.68 113.51 2dn6 s LEU 71 Ca 0.22 0.91 -0.22 0.00 -1.03 0.00 0.00 54.13 54.01 2dn6 s LEU 71 Cb -0.06 -3.71 0.06 0.00 0.03 0.00 0.00 46.19 42.51 2dn6 s LEU 71 CO 0.83 -0.16 0.60 0.72 0.23 0.00 0.00 176.35 178.57 2dn6 s PHE 72 N -1.97 -0.62 0.11 0.29 -0.12 -1.09 -1.58 117.98 113.01 2dn6 s PHE 72 Ca 0.47 1.42 0.05 0.00 -0.05 0.00 0.00 56.93 58.82 2dn6 s PHE 72 Cb -0.11 0.25 -0.04 0.00 -0.63 0.00 0.00 43.02 42.50 2dn6 s PHE 72 CO 0.25 -0.38 -0.12 -1.17 -0.05 0.00 0.00 175.22 173.74 2dn6 s LEU 73 N -0.10 2.41 -0.13 -1.99 0.20 -0.59 -2.11 118.68 116.37 2dn6 s LEU 73 Ca -0.03 -0.82 -0.00 0.00 0.69 0.00 0.00 54.13 53.97 2dn6 s LEU 73 Cb -0.04 -0.43 -0.02 0.00 -0.43 0.00 0.00 46.19 45.27 2dn6 s LEU 73 CO 0.03 -0.20 -0.13 -0.69 -0.29 0.00 0.00 176.35 175.07 2dn6 s VAL 74 N -2.30 3.11 -0.20 1.68 1.01 0.65 -0.74 120.40 123.60 2dn6 s VAL 74 Ca 0.08 -0.65 -0.05 0.00 0.00 0.00 0.00 61.98 61.36 2dn6 s VAL 74 Cb -0.04 -2.30 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 2dn6 s VAL 74 CO 0.02 0.53 -0.00 -0.75 0.00 0.00 0.00 175.10 174.89 2dn6 s LYS 75 N 0.26 3.59 0.49 2.72 2.47 0.89 -2.03 119.74 128.14 2dn6 s LYS 75 Ca -0.09 -0.53 0.03 0.00 -1.56 0.00 0.00 55.97 53.82 2dn6 s LYS 75 Cb -0.15 -3.08 -0.02 0.00 -1.46 0.00 0.00 37.83 33.11 2dn6 s LYS 75 CO 0.05 -0.02 0.03 0.00 0.16 0.00 0.00 175.35 175.57 2dn6 n PHE 77 N -1.24 0.00 0.00 0.00 3.72 -1.26 -4.05 117.46 114.63 2dn6 n PHE 77 Ca -0.15 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.25 2dn6 n PHE 77 Cb 0.67 -0.16 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 -0.40 -0.05 0.00 0.00 176.76 176.31 2dn6 n ASP 78 N -1.84 4.37 -4.86 4.37 5.75 -1.26 -5.06 116.55 118.02 2dn6 n ASP 78 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 54.79 54.47 2dn6 n ASP 78 Cb 0.00 0.45 -0.03 0.00 -1.03 0.00 0.00 41.12 40.51 2dn6 n ASP 78 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2dn6 s LYS 79 N -1.87 3.84 0.02 0.11 1.02 -1.26 -5.09 119.74 116.51 2dn6 s LYS 79 Ca 0.00 0.75 -0.00 0.00 0.02 0.00 0.00 55.97 56.74 2dn6 s LYS 79 Cb 0.00 -2.22 -0.02 0.00 -0.52 0.00 0.00 37.83 35.07 2dn6 s LYS 79 CO 0.00 -0.22 -0.02 0.95 -0.92 0.00 0.00 175.35 175.14 2dn6 s THR 80 N -2.60 0.09 -0.05 2.17 -4.23 -1.26 -1.87 115.64 107.88 2dn6 s THR 80 Ca 0.56 -0.75 -0.00 0.00 -1.18 0.00 0.00 61.69 60.31 2dn6 s THR 80 Cb -0.10 -0.22 0.03 0.00 1.34 0.00 0.00 72.50 73.54 2dn6 s THR 80 CO 0.34 -0.41 -0.01 -0.36 -0.54 0.00 0.00 174.62 173.64 2dn6 s PHE 81 N -1.21 0.59 -0.20 3.99 0.40 -0.86 -5.03 117.98 115.66 2dn6 s PHE 81 Ca -0.13 -0.12 -0.05 0.00 -0.60 0.00 0.00 56.93 56.02 2dn6 s PHE 81 Cb -0.08 -0.67 -0.02 0.00 0.51 0.00 0.00 43.02 42.75 2dn6 s PHE 81 CO -0.01 -0.25 -0.00 -2.00 0.70 0.00 0.00 175.22 173.67 2dn6 s GLU 82 N 1.51 3.62 0.06 0.44 2.12 -1.26 -0.26 118.70 124.93 2dn6 s GLU 82 Ca -0.02 -0.52 0.05 0.00 0.36 0.00 0.00 54.97 54.84 2dn6 s GLU 82 Cb -0.13 -3.07 -0.03 0.00 0.26 0.00 0.00 34.13 31.16 2dn6 s GLU 82 CO -0.03 0.03 -0.14 0.42 -0.54 0.00 0.00 175.26 175.00 2dn6 s ILE 83 N 0.96 1.06 -0.09 -3.70 1.01 -0.90 -1.73 121.20 117.81 2dn6 s ILE 83 Ca 0.01 -1.17 0.04 0.00 0.00 0.00 0.00 60.65 59.53 2dn6 s ILE 83 Cb -0.14 -1.01 -0.01 0.00 0.01 0.00 0.00 42.46 41.31 2dn6 s ILE 83 CO 0.02 -0.15 -0.20 -0.55 0.00 0.00 0.00 174.94 174.06 2dn6 s SER 84 N -1.50 3.47 0.62 3.58 0.15 0.27 -2.65 113.70 117.64 2dn6 s SER 84 Ca -0.01 -0.43 0.02 0.00 0.70 0.00 0.00 55.95 56.24 2dn6 s SER 84 Cb -0.09 -1.18 0.08 0.00 -1.71 0.00 0.00 66.02 63.12 2dn6 s SER 84 CO 0.02 0.22 0.86 0.00 1.20 0.00 0.00 173.24 175.54 2dn6 s ALA 85 N 0.01 4.01 -0.20 5.45 0.00 -1.12 -2.30 121.76 127.61 2dn6 s ALA 85 Ca -0.07 -1.69 -0.16 0.00 0.00 0.00 0.00 51.96 50.04 2dn6 s ALA 85 Cb -0.15 -1.89 -0.08 0.00 0.00 0.00 0.00 23.12 21.00 2dn6 s ALA 85 CO 0.05 -1.05 -0.34 0.45 0.00 0.00 0.00 175.76 174.87 2dn6 n SER 86 N -2.51 1.90 -4.34 0.00 2.88 -1.26 -4.81 113.62 105.48 2dn6 n SER 86 Ca 0.13 0.32 -0.22 0.00 -1.33 0.00 0.00 58.87 57.77 2dn6 n SER 86 Cb 0.60 -0.74 -0.11 0.00 -0.75 0.00 0.00 64.21 63.21 2dn6 n SER 86 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 2dn6 s ASP 87 N -6.37 2.74 0.38 -3.46 1.47 -1.26 -4.88 116.67 105.29 2dn6 s ASP 87 Ca -0.31 -0.87 0.20 0.00 1.18 0.00 0.00 52.55 52.75 2dn6 s ASP 87 Cb 0.07 -0.16 1.20 0.00 -0.34 0.00 0.00 42.92 43.69 2dn6 s ASP 87 CO 0.43 -0.03 1.67 0.11 0.68 0.00 0.00 175.17 178.03 2dn6 h LYS 88 N 3.20 0.25 0.30 2.11 1.57 -1.96 -0.26 116.57 121.79 2dn6 h LYS 88 Ca -0.42 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.34 2dn6 h LYS 88 Cb 1.21 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 33.43 2dn6 h LYS 88 CO 0.51 0.17 -0.51 -0.22 -0.57 0.00 0.00 179.45 178.83 2dn6 h LYS 89 N 0.26 -0.83 0.47 3.15 1.63 -1.98 0.14 116.57 119.40 2dn6 h LYS 89 Ca 0.73 0.06 -0.02 0.00 -0.85 0.00 0.00 60.65 60.57 2dn6 h LYS 89 Cb 1.93 0.19 0.00 0.00 -0.60 0.00 0.00 32.23 33.75 2dn6 h LYS 89 CO -0.49 -0.56 -0.23 0.87 -3.45 0.00 0.00 179.45 175.60 2dn6 h LYS 90 N -0.86 -0.61 -0.32 1.90 1.57 -1.50 0.75 116.57 117.49 2dn6 h LYS 90 Ca -0.03 0.04 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 2dn6 h LYS 90 Cb 0.80 0.14 -0.07 0.00 0.08 0.00 0.00 32.23 33.19 2dn6 h LYS 90 CO -0.18 -0.41 -0.46 -0.22 -0.57 0.00 0.00 179.45 177.61 2dn6 h LYS 91 N -0.64 -0.32 0.42 3.15 3.11 -1.17 0.21 116.57 121.32 2dn6 h LYS 91 Ca -0.06 0.02 -0.02 0.00 -2.81 0.00 0.00 60.65 57.78 2dn6 h LYS 91 Cb 0.49 0.07 -0.00 0.00 -1.00 0.00 0.00 32.23 31.79 2dn6 h LYS 91 CO 0.10 -0.22 -0.27 0.37 -2.81 0.00 0.00 179.45 176.63 2dn6 h GLN 92 N -0.34 -0.62 -0.89 1.90 5.75 -0.70 -1.19 115.11 119.02 2dn6 h GLN 92 Ca 0.06 0.04 0.15 0.00 -0.15 0.00 0.00 58.65 58.75 2dn6 h GLN 92 Cb 0.49 0.14 -0.15 0.00 1.07 0.00 0.00 27.48 29.03 2dn6 h GLN 92 CO -0.48 -0.41 -0.30 0.39 -2.65 0.00 0.00 178.83 175.38 2dn6 n GLU 93 N -3.97 -0.16 0.31 1.69 -0.58 0.25 -0.12 120.64 118.06 2dn6 n GLU 93 Ca -0.08 1.39 -0.14 0.00 -0.42 0.00 0.00 57.16 57.90 2dn6 n GLU 93 Cb 0.27 -2.06 -0.07 0.00 -0.57 0.00 0.00 31.44 29.01 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 -0.96 -0.45 -0.32 4.06 -0.45 -0.54 115.95 117.29 2dn6 h TRP 94 Ca 0.36 -0.01 0.08 0.00 2.06 0.00 0.00 58.89 61.38 2dn6 h TRP 94 Cb 0.58 0.35 -0.10 0.00 -1.00 0.00 0.00 29.16 28.99 2dn6 h TRP 94 CO -0.75 -0.53 -0.40 0.82 -3.56 0.00 0.00 178.44 174.02 2dn6 h ILE 95 N -0.87 0.14 -0.99 1.49 2.04 0.22 0.28 117.51 119.81 2dn6 h ILE 95 Ca -0.08 0.00 0.17 0.00 1.00 0.00 0.00 64.86 65.95 2dn6 h ILE 95 Cb 0.70 0.14 -0.10 0.00 -0.74 0.00 0.00 36.82 36.82 2dn6 h ILE 95 CO 0.07 0.00 0.62 1.56 0.00 0.00 0.00 178.15 180.40 2dn6 h GLN 96 N -0.28 0.78 0.46 2.37 4.20 -0.47 0.28 115.11 122.45 2dn6 h GLN 96 Ca 0.16 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.80 2dn6 h GLN 96 Cb 0.57 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.18 2dn6 h GLN 96 CO -0.59 0.51 -0.22 0.00 -0.67 0.00 0.00 178.83 177.86 2dn6 h ALA 97 N 1.61 -0.62 0.10 3.87 0.00 0.94 -1.93 119.26 123.23 2dn6 h ALA 97 Ca 0.54 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 55.29 2dn6 h ALA 97 Cb 0.80 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2dn6 h ALA 97 CO -0.33 -0.64 -0.26 0.82 0.00 0.00 0.00 179.25 178.84 2dn6 h ILE 98 N -1.03 0.43 -0.08 0.00 2.04 -0.13 0.11 117.51 118.84 2dn6 h ILE 98 Ca -0.06 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.84 2dn6 h ILE 98 Cb 0.57 0.43 -0.06 0.00 -0.74 0.00 0.00 36.82 37.02 2dn6 h ILE 98 CO 0.10 0.00 -0.38 -0.74 0.00 0.00 0.00 178.15 177.14 2dn6 h HIS 99 N -0.46 -1.06 -0.37 1.37 2.76 -0.55 -1.59 115.15 115.25 2dn6 h HIS 99 Ca 0.03 0.04 0.06 0.00 -2.20 0.00 0.00 60.37 58.30 2dn6 h HIS 99 Cb 0.49 0.48 -0.05 0.00 1.55 0.00 0.00 27.41 29.88 2dn6 h HIS 99 CO -0.24 -0.45 0.06 0.77 -1.30 0.00 0.00 177.93 176.77 2dn6 h SER 100 N -0.48 -0.01 -0.98 3.26 0.02 -1.14 -1.36 113.55 112.86 2dn6 h SER 100 Ca 0.07 0.07 0.20 0.00 -0.84 0.00 0.00 61.79 61.29 2dn6 h SER 100 Cb 0.60 0.09 -0.11 0.00 0.14 0.00 0.00 62.40 63.12 2dn6 h SER 100 CO -0.35 0.03 0.57 0.74 -1.14 0.00 0.00 176.83 176.68 2dn6 h THR 101 N 0.18 0.65 0.01 -2.27 2.02 -0.13 -1.57 112.91 111.80 2dn6 h THR 101 Ca 0.18 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 67.13 2dn6 h THR 101 Cb 0.22 -0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.54 2dn6 h THR 101 CO -0.24 0.12 -0.00 0.40 0.37 0.00 0.00 175.52 176.16 2dn6 h ILE 102 N 0.68 1.37 -0.90 3.11 2.04 -0.34 -3.25 117.51 120.22 2dn6 h ILE 102 Ca 0.58 -1.16 0.19 0.00 1.00 0.00 0.00 64.86 65.48 2dn6 h ILE 102 Cb 0.97 2.15 -0.17 0.00 -0.74 0.00 0.00 36.82 39.04 2dn6 h ILE 102 CO -0.42 0.30 -0.17 -0.74 0.00 0.00 0.00 178.15 177.12 2dn6 h HIS 103 N -0.51 -0.38 -1.02 1.37 2.76 -0.29 0.90 115.15 117.97 2dn6 h HIS 103 Ca -0.00 0.08 0.25 0.00 -2.20 0.00 0.00 60.37 58.50 2dn6 h HIS 103 Cb 0.50 0.31 -0.10 0.00 1.55 0.00 0.00 27.41 29.67 2dn6 h HIS 103 CO 0.10 -0.38 0.65 -0.07 -1.30 0.00 0.00 177.93 176.92 2dn6 h LEU 104 N 0.01 0.53 -0.48 0.26 3.38 -1.49 0.40 115.31 117.91 2dn6 h LEU 104 Ca 0.45 0.09 -0.17 0.00 0.09 0.00 0.00 57.88 58.35 2dn6 h LEU 104 Cb 0.74 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2dn6 h LEU 104 CO -0.90 0.11 -0.70 -0.07 0.09 0.00 0.00 178.44 176.96 2dn6 h LEU 105 N 0.47 0.35 -1.12 1.67 3.38 0.72 -3.16 115.31 117.61 2dn6 h LEU 105 Ca 0.60 -0.22 0.05 0.00 0.09 0.00 0.00 57.88 58.40 2dn6 h LEU 105 Cb 1.38 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.97 2dn6 h LEU 105 CO -0.34 0.94 0.60 0.11 0.09 0.00 0.00 178.44 179.84 2dn6 h LYS 106 N 0.20 1.06 -0.67 1.13 1.57 0.48 -2.42 116.57 117.91 2dn6 h LYS 106 Ca -0.02 -0.06 0.14 0.00 -1.87 0.00 0.00 60.65 58.84 2dn6 h LYS 106 Cb 1.26 -0.24 -0.12 0.00 0.08 0.00 0.00 32.23 33.21 2dn6 h LYS 106 CO 0.11 0.70 -0.06 -0.07 -0.57 0.00 0.00 179.45 179.57 2dn6 h LEU 107 N 1.10 -0.42 0.00 2.94 -0.00 -1.43 -3.48 115.31 114.02 2dn6 h LEU 107 Ca 0.38 0.18 0.00 0.00 -0.00 0.00 0.00 57.88 58.45 2dn6 h LEU 107 Cb 0.12 0.34 0.00 0.00 -0.00 0.00 0.00 40.66 41.12 2dn6 h LEU 107 CO -0.13 -0.17 0.00 0.61 -0.00 0.00 0.00 178.44 178.74 2dn6 n GLY 108 N -1.41 -1.23 3.68 0.83 0.00 -0.91 -4.86 105.19 101.28 2dn6 n GLY 108 Ca 0.10 -1.60 -0.54 0.00 0.00 0.00 0.00 46.02 43.98 2dn6 n GLY 108 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dn6 n SER 109 N -1.77 2.54 -3.47 1.61 2.88 -1.26 -4.95 113.62 109.21 2dn6 n SER 109 Ca 0.00 1.06 -0.11 0.00 -1.33 0.00 0.00 58.87 58.49 2dn6 n SER 109 Cb 0.00 -1.22 -0.10 0.00 -0.75 0.00 0.00 64.21 62.14 2dn6 n SER 109 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dn6 s SER 110 N 2.96 0.33 0.00 -3.46 0.15 -1.26 -5.07 113.70 107.35 2dn6 s SER 110 Ca 0.93 0.35 0.00 0.00 0.70 0.00 0.00 55.95 57.93 2dn6 s SER 110 Cb -0.94 1.00 0.00 0.00 -1.71 0.00 0.00 66.02 64.37 2dn6 s SER 110 CO 0.57 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 175.34 2dn6 n GLY 111 N 5.36 -1.36 3.74 9.45 0.00 -1.26 -5.17 105.19 115.94 2dn6 n GLY 111 Ca -0.05 0.74 -0.30 0.00 0.00 0.00 0.00 46.02 46.41 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 0.00 1.64 -0.47 1.61 0.04 -1.26 -4.99 135.00 131.58 2dn6 s PRO 112 Ca 0.00 0.96 -0.22 0.00 0.04 0.00 0.00 61.00 61.78 2dn6 s PRO 112 Cb 0.00 -1.84 0.03 0.00 0.04 0.00 0.00 34.50 32.73 2dn6 s PRO 112 CO 0.00 -2.01 0.73 -1.12 0.04 0.00 0.00 177.00 174.64 2dn6 s SER 113 N -3.41 6.34 -0.30 6.66 0.01 -1.26 -4.97 113.70 116.77 2dn6 s SER 113 Ca 0.63 -0.36 -0.16 0.00 1.31 0.00 0.00 55.95 57.37 2dn6 s SER 113 Cb -0.18 -2.35 0.18 0.00 0.21 0.00 0.00 66.02 63.88 2dn6 s SER 113 CO 0.57 -0.90 1.08 -0.94 0.41 0.00 0.00 173.24 173.45 2dn6 s SER 114 N 2.27 -0.42 0.00 2.44 1.04 -1.26 -5.37 113.70 112.39 2dn6 s SER 114 Ca 0.25 0.51 0.00 0.00 0.48 0.00 0.00 55.95 57.18 2dn6 s SER 114 Cb -0.14 1.45 0.00 0.00 0.10 0.00 0.00 66.02 67.43 2dn6 s SER 114 CO 0.19 -0.08 0.00 0.61 0.98 0.00 0.00 173.24 174.94