#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 -0.59 -0.14 1.61 0.15 -1.26 -5.16 113.70 108.31 2dn6 s SER 2 Ca 0.00 0.52 -0.05 0.00 0.70 0.00 0.00 55.95 57.12 2dn6 s SER 2 Cb 0.00 0.51 -0.03 0.00 -1.71 0.00 0.00 66.02 64.79 2dn6 s SER 2 CO 0.00 -0.64 0.02 -0.94 1.20 0.00 0.00 173.24 172.88 2dn6 s SER 3 N -1.52 5.34 0.00 5.45 1.04 -1.26 -4.84 113.70 117.91 2dn6 s SER 3 Ca -0.07 0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.43 2dn6 s SER 3 Cb -0.00 -1.77 0.00 0.00 0.10 0.00 0.00 66.02 64.35 2dn6 s SER 3 CO 0.04 0.25 0.00 0.61 0.98 0.00 0.00 173.24 175.12 2dn6 n GLY 4 N 2.99 -0.10 3.88 7.32 0.00 -1.26 -5.15 105.19 112.87 2dn6 n GLY 4 Ca -0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.67 6.44 0.03 1.61 1.04 -1.26 -4.98 113.70 114.91 2dn6 s SER 5 Ca 0.00 1.17 -0.37 0.00 0.48 0.00 0.00 55.95 57.22 2dn6 s SER 5 Cb 0.00 -2.34 -0.16 0.00 0.10 0.00 0.00 66.02 63.61 2dn6 s SER 5 CO 0.00 -0.52 1.41 -0.24 0.98 0.00 0.00 173.24 174.88 2dn6 n SER 6 N -1.72 1.82 0.00 7.02 2.88 -1.26 -4.88 113.62 117.48 2dn6 n SER 6 Ca 0.03 1.11 0.00 0.00 -1.33 0.00 0.00 58.87 58.68 2dn6 n SER 6 Cb 0.54 -1.19 0.00 0.00 -0.75 0.00 0.00 64.21 62.81 2dn6 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dn6 n GLY 7 N 2.81 3.06 2.43 0.46 0.00 -1.26 -5.10 105.19 107.59 2dn6 n GLY 7 Ca 0.20 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.05 1.61 3.14 -1.26 -4.60 118.33 117.17 2dn6 n VAL 8 Ca 0.00 0.00 -0.20 0.00 -2.96 0.00 0.00 64.34 61.18 2dn6 n VAL 8 Cb 0.00 -0.08 -0.13 0.00 -1.06 0.00 0.00 33.84 32.57 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 2.36 0.17 -8.66 6.55 3.38 -0.72 -3.48 115.31 114.91 2dn6 h LEU 9 Ca -0.34 -0.75 -0.46 0.00 0.09 0.00 0.00 57.88 56.43 2dn6 h LEU 9 Cb 0.97 -0.06 -0.19 0.00 0.09 0.00 0.00 40.66 41.47 2dn6 h LEU 9 CO 0.49 1.48 -0.77 -0.75 0.09 0.00 0.00 178.44 178.98 2dn6 s LYS 10 N -2.39 1.09 -0.25 1.13 2.20 -1.23 -5.02 119.74 115.26 2dn6 s LYS 10 Ca -0.23 -1.26 -0.15 0.00 -0.36 0.00 0.00 55.97 53.97 2dn6 s LYS 10 Cb 0.04 -1.06 0.07 0.00 -1.51 0.00 0.00 37.83 35.37 2dn6 s LYS 10 CO 0.69 0.21 0.63 1.14 -0.36 0.00 0.00 175.35 177.66 2dn6 s GLN 11 N -2.57 0.64 -0.10 4.03 -2.07 -1.26 -1.60 119.66 116.74 2dn6 s GLN 11 Ca 0.10 1.12 -0.33 0.00 -1.82 0.00 0.00 55.36 54.43 2dn6 s GLN 11 Cb -0.06 0.11 0.13 0.00 -1.09 0.00 0.00 33.01 32.11 2dn6 s GLN 11 CO 0.04 -0.15 1.31 0.20 -1.32 0.00 0.00 175.29 175.37 2dn6 s GLY 12 N 1.55 -0.38 -0.33 2.60 0.00 -1.22 -5.03 107.32 104.51 2dn6 s GLY 12 Ca -0.10 1.08 -0.28 0.00 0.00 0.00 0.00 44.72 45.42 2dn6 s GLY 12 CO -0.18 0.28 1.03 -0.19 0.00 0.00 0.00 173.10 174.04 2dn6 s TYR 13 N -2.30 3.13 0.10 1.90 2.02 -1.26 -2.74 117.35 118.20 2dn6 s TYR 13 Ca 0.13 1.09 0.07 0.00 -0.37 0.00 0.00 57.07 57.99 2dn6 s TYR 13 Cb 0.04 -3.68 -0.03 0.00 -0.40 0.00 0.00 41.96 37.88 2dn6 s TYR 13 CO -0.04 -0.78 -0.18 -1.64 -1.57 0.00 0.00 175.55 171.34 2dn6 s MET 14 N 3.61 1.02 -0.40 -0.62 -1.94 -0.94 -4.92 119.30 115.11 2dn6 s MET 14 Ca 0.43 -1.12 -0.20 0.00 -1.71 0.00 0.00 55.69 53.10 2dn6 s MET 14 Cb -0.12 -1.15 0.01 0.00 2.01 0.00 0.00 34.83 35.59 2dn6 s MET 14 CO 0.16 0.26 0.61 -1.64 -0.01 0.00 0.00 175.02 174.40 2dn6 s MET 15 N -1.99 3.42 -0.15 2.03 1.00 -1.23 -0.21 119.30 122.18 2dn6 s MET 15 Ca 0.04 -0.26 -0.07 0.00 0.00 0.00 0.00 55.69 55.41 2dn6 s MET 15 Cb -0.09 -3.89 -0.04 0.00 0.00 0.00 0.00 34.83 30.80 2dn6 s MET 15 CO 0.04 -0.88 0.09 0.21 0.00 0.00 0.00 175.02 174.48 2dn6 s LYS 16 N 2.69 3.66 -0.68 2.03 2.36 -1.06 0.17 119.74 128.91 2dn6 s LYS 16 Ca 0.22 -0.26 -0.20 0.00 -2.55 0.00 0.00 55.97 53.18 2dn6 s LYS 16 Cb -0.15 -3.17 0.10 0.00 -1.05 0.00 0.00 37.83 33.56 2dn6 s LYS 16 CO 0.17 0.53 0.88 0.21 1.55 0.00 0.00 175.35 178.69 2dn6 s LYS 17 N -0.34 3.18 0.43 4.03 2.20 0.94 -3.66 119.74 126.51 2dn6 s LYS 17 Ca 0.10 -1.23 -0.26 0.00 -0.36 0.00 0.00 55.97 54.22 2dn6 s LYS 17 Cb -0.12 -4.36 -0.09 0.00 -1.51 0.00 0.00 37.83 31.75 2dn6 s LYS 17 CO 0.01 -1.69 1.45 0.20 -0.36 0.00 0.00 175.35 174.97 2dn6 s GLY 18 N 3.61 2.93 0.12 5.54 0.00 -1.26 -4.42 107.32 113.84 2dn6 s GLY 18 Ca 0.19 1.51 -0.23 0.00 0.00 0.00 0.00 44.72 46.19 2dn6 s GLY 18 CO 0.05 2.14 1.35 1.57 0.00 0.00 0.00 173.10 178.21 2dn6 n HIS 19 N -0.01 -0.33 -3.25 1.90 -0.00 -1.26 -4.45 115.22 107.82 2dn6 n HIS 19 Ca 0.04 0.93 -0.24 0.00 0.46 0.00 0.00 57.72 58.90 2dn6 n HIS 19 Cb 0.41 -0.55 -0.01 0.00 -0.12 0.00 0.00 29.99 29.72 2dn6 n HIS 19 CO 0.00 0.00 0.00 0.50 0.46 0.00 0.00 176.34 177.30 2dn6 s ARG 20 N -4.93 3.47 -0.74 1.57 6.06 -1.26 -4.54 118.95 118.58 2dn6 s ARG 20 Ca -0.09 -0.26 -0.01 0.00 -2.50 0.00 0.00 55.73 52.86 2dn6 s ARG 20 Cb 0.08 -2.61 -0.02 0.00 0.06 0.00 0.00 34.95 32.46 2dn6 s ARG 20 CO 0.46 0.07 0.63 -2.13 -2.50 0.00 0.00 175.30 171.83 2dn6 n ARG 21 N -1.87 -3.28 -0.96 5.12 3.00 -1.26 -4.75 116.66 112.66 2dn6 n ARG 21 Ca -0.04 0.56 -0.37 0.00 -0.00 0.00 0.00 57.85 58.00 2dn6 n ARG 21 Cb 0.56 -4.56 -0.09 0.00 0.00 0.00 0.00 32.46 28.37 2dn6 n ARG 21 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2dn6 n LYS 22 N -2.89 0.00 -3.83 -0.14 4.01 -1.26 -4.79 118.16 109.26 2dn6 n LYS 22 Ca -0.14 0.00 -0.01 0.00 -0.51 0.00 0.00 58.31 57.65 2dn6 n LYS 22 Cb 0.60 -1.06 0.01 0.00 -0.51 0.00 0.00 35.03 34.06 2dn6 n LYS 22 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 2dn6 s ASN 23 N 5.12 -0.04 -0.09 4.39 2.47 -1.26 -5.09 114.94 120.44 2dn6 s ASN 23 Ca 0.90 -0.41 0.03 0.00 0.42 0.00 0.00 52.86 53.80 2dn6 s ASN 23 Cb -0.99 0.35 0.00 0.00 -1.45 0.00 0.00 41.25 39.16 2dn6 s ASN 23 CO 0.42 -0.68 -0.20 0.26 -3.72 0.00 0.00 177.10 173.18 2dn6 s TRP 24 N -2.37 2.24 -0.03 0.43 0.52 -1.26 -4.17 118.94 114.30 2dn6 s TRP 24 Ca 0.21 -0.91 0.02 0.00 0.02 0.00 0.00 56.10 55.43 2dn6 s TRP 24 Cb -0.00 -1.52 0.01 0.00 -1.15 0.00 0.00 33.47 30.80 2dn6 s TRP 24 CO 0.02 -0.38 -0.06 0.95 0.02 0.00 0.00 176.95 177.49 2dn6 s THR 25 N 0.46 0.58 -0.72 2.01 -4.23 -1.24 -4.97 115.64 107.53 2dn6 s THR 25 Ca -0.17 -0.20 -0.26 0.00 -1.18 0.00 0.00 61.69 59.88 2dn6 s THR 25 Cb -0.17 -0.57 -0.03 0.00 1.34 0.00 0.00 72.50 73.07 2dn6 s THR 25 CO 0.07 0.22 1.90 -0.70 -0.54 0.00 0.00 174.62 175.57 2dn6 s GLU 26 N 0.58 2.59 -0.07 3.99 2.12 -1.26 -2.55 118.70 124.10 2dn6 s GLU 26 Ca -0.08 0.28 0.02 0.00 0.36 0.00 0.00 54.97 55.55 2dn6 s GLU 26 Cb -0.11 -4.65 -0.02 0.00 0.26 0.00 0.00 34.13 29.60 2dn6 s GLU 26 CO 0.00 -2.99 -0.13 0.50 -0.54 0.00 0.00 175.26 172.10 2dn6 s ARG 27 N 7.06 2.73 0.32 4.30 6.06 0.71 -4.85 118.95 135.28 2dn6 s ARG 27 Ca 0.69 -0.68 -0.29 0.00 -2.50 0.00 0.00 55.73 52.95 2dn6 s ARG 27 Cb -0.10 -2.46 -0.10 0.00 0.06 0.00 0.00 34.95 32.35 2dn6 s ARG 27 CO 0.13 0.53 1.28 -0.46 -2.50 0.00 0.00 175.30 174.27 2dn6 s TRP 28 N -0.48 3.13 -0.09 5.12 -0.11 -0.37 -2.22 118.94 123.92 2dn6 s TRP 28 Ca 0.06 1.45 0.01 0.00 1.22 0.00 0.00 56.10 58.85 2dn6 s TRP 28 Cb -0.12 -3.62 0.02 0.00 -1.50 0.00 0.00 33.47 28.25 2dn6 s TRP 28 CO 0.02 -1.66 -0.10 -0.06 -4.62 0.00 0.00 176.95 170.52 2dn6 s PHE 29 N -1.12 1.48 -0.54 5.86 0.08 -1.11 -1.20 117.98 121.43 2dn6 s PHE 29 Ca 0.48 -0.65 -0.06 0.00 0.12 0.00 0.00 56.93 56.82 2dn6 s PHE 29 Cb -0.39 -1.15 0.14 0.00 -0.57 0.00 0.00 43.02 41.05 2dn6 s PHE 29 CO 0.51 -0.39 0.39 0.08 -0.10 0.00 0.00 175.22 175.70 2dn6 s VAL 30 N 1.16 4.02 -0.12 -0.44 1.01 0.15 -3.37 120.40 122.80 2dn6 s VAL 30 Ca -0.05 -2.27 -0.29 0.00 0.00 0.00 0.00 61.98 59.36 2dn6 s VAL 30 Cb -0.14 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 2dn6 s VAL 30 CO -0.02 -0.82 1.51 -0.22 0.00 0.00 0.00 175.10 175.55 2dn6 s LEU 31 N 0.76 4.20 0.29 3.92 2.96 -0.63 -1.79 118.68 128.39 2dn6 s LEU 31 Ca 0.11 1.93 0.07 0.00 -0.22 0.00 0.00 54.13 56.02 2dn6 s LEU 31 Cb -0.22 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 42.91 2dn6 s LEU 31 CO -0.03 -0.93 0.33 -0.54 -1.32 0.00 0.00 176.35 173.86 2dn6 s LYS 32 N 3.97 3.04 0.42 1.98 -0.14 0.95 0.04 119.74 130.00 2dn6 s LYS 32 Ca 0.67 -1.04 0.21 0.00 -1.36 0.00 0.00 55.97 54.45 2dn6 s LYS 32 Cb -0.28 -2.69 0.91 0.00 -1.68 0.00 0.00 37.83 34.10 2dn6 s LYS 32 CO 0.24 0.23 1.84 -1.00 -0.76 0.00 0.00 175.35 175.91 2dn6 h PRO 33 N 1.19 0.00 0.00 -1.68 0.13 -1.93 -3.24 132.00 126.47 2dn6 h PRO 33 Ca -0.48 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.58 2dn6 h PRO 33 Cb 1.25 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.22 2dn6 h PRO 33 CO 0.58 0.28 -0.64 0.09 -0.23 0.00 0.00 178.00 178.08 2dn6 n ASN 34 N -3.59 0.99 -3.97 1.44 3.02 -1.26 -4.76 115.26 107.13 2dn6 n ASN 34 Ca -0.01 -2.47 0.05 0.00 -0.03 0.00 0.00 54.58 52.12 2dn6 n ASN 34 Cb 0.42 -0.33 0.01 0.00 -0.61 0.00 0.00 39.78 39.27 2dn6 n ASN 34 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2dn6 s ILE 35 N -0.93 0.00 -0.26 2.41 2.07 -1.22 -4.25 121.20 119.02 2dn6 s ILE 35 Ca 0.24 -0.02 -0.02 0.00 -1.41 0.00 0.00 60.65 59.44 2dn6 s ILE 35 Cb 0.25 -2.88 0.13 0.00 0.13 0.00 0.00 42.46 40.09 2dn6 s ILE 35 CO -0.07 0.00 0.31 -0.63 -1.91 0.00 0.00 174.94 172.63 2dn6 s ILE 36 N -2.01 -0.46 0.38 2.00 1.01 -1.10 -0.03 121.20 121.00 2dn6 s ILE 36 Ca 0.31 -0.27 0.07 0.00 0.00 0.00 0.00 60.65 60.76 2dn6 s ILE 36 Cb 0.01 -0.87 -0.00 0.00 0.01 0.00 0.00 42.46 41.61 2dn6 s ILE 36 CO -0.03 -0.30 0.48 -0.55 0.00 0.00 0.00 174.94 174.54 2dn6 s SER 37 N 2.42 5.65 -0.20 3.58 0.15 -0.74 -0.79 113.70 123.77 2dn6 s SER 37 Ca 0.10 -0.39 -0.05 0.00 0.70 0.00 0.00 55.95 56.31 2dn6 s SER 37 Cb -0.15 -0.88 0.10 0.00 -1.71 0.00 0.00 66.02 63.38 2dn6 s SER 37 CO -0.23 -0.59 0.36 -0.72 1.20 0.00 0.00 173.24 173.26 2dn6 s TYR 38 N -2.30 -0.70 0.39 3.44 1.13 -1.26 0.31 117.35 118.36 2dn6 s TYR 38 Ca 0.49 1.12 0.08 0.00 -1.41 0.00 0.00 57.07 57.34 2dn6 s TYR 38 Cb -0.08 0.11 -0.00 0.00 -1.10 0.00 0.00 41.96 40.88 2dn6 s TYR 38 CO 0.31 -0.54 0.49 0.71 -2.51 0.00 0.00 175.55 174.01 2dn6 s TYR 39 N 2.54 2.87 0.08 -3.49 1.51 -0.34 -2.93 117.35 117.58 2dn6 s TYR 39 Ca 0.04 -0.37 -0.31 0.00 -1.01 0.00 0.00 57.07 55.43 2dn6 s TYR 39 Cb -0.13 -2.21 -0.16 0.00 -0.11 0.00 0.00 41.96 39.36 2dn6 s TYR 39 CO -0.13 -0.22 1.63 0.28 -1.11 0.00 0.00 175.55 176.00 2dn6 h VAL 40 N 0.82 0.39 -4.40 0.71 2.07 -1.79 -0.98 116.25 113.06 2dn6 h VAL 40 Ca -0.42 0.00 -0.34 0.00 0.82 0.00 0.00 66.70 66.76 2dn6 h VAL 40 Cb 1.27 0.39 -0.07 0.00 -1.52 0.00 0.00 31.29 31.36 2dn6 h VAL 40 CO 0.50 0.00 -0.26 -1.54 0.02 0.00 0.00 177.57 176.29 2dn6 n SER 41 N -5.43 2.25 -1.33 0.57 3.41 -1.26 -3.12 113.62 108.71 2dn6 n SER 41 Ca -0.11 -2.20 -0.06 0.00 -0.26 0.00 0.00 58.87 56.24 2dn6 n SER 41 Cb 0.33 0.31 0.04 0.00 -0.26 0.00 0.00 64.21 64.62 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 -0.63 1.30 -0.06 4.33 0.28 -1.26 -3.59 120.64 121.02 2dn6 n GLU 42 Ca -0.09 -0.71 -0.04 0.00 -0.16 0.00 0.00 57.16 56.16 2dn6 n GLU 42 Cb 0.34 -1.28 -0.12 0.00 1.43 0.00 0.00 31.44 31.81 2dn6 n GLU 42 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2dn6 n ASP 43 N 0.19 1.28 -2.59 -1.84 -0.08 -1.26 -5.02 116.55 107.23 2dn6 n ASP 43 Ca 0.14 0.00 -0.16 0.00 -1.51 0.00 0.00 54.79 53.26 2dn6 n ASP 43 Cb 0.75 1.09 0.05 0.00 2.34 0.00 0.00 41.12 45.36 2dn6 n ASP 43 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2dn6 n LEU 44 N -2.44 -2.94 -0.12 -2.67 4.77 -1.24 -4.94 117.00 107.42 2dn6 n LEU 44 Ca -0.19 -0.36 -0.17 0.00 -0.03 0.00 0.00 56.01 55.25 2dn6 n LEU 44 Cb 0.85 -2.22 -0.12 0.00 -2.33 0.00 0.00 43.42 39.61 2dn6 n LEU 44 CO 0.33 0.44 -1.31 0.29 -1.33 0.00 0.00 177.39 175.81 2dn6 n LYS 45 N -3.55 0.63 -4.01 3.23 5.02 -1.26 -4.89 118.16 113.32 2dn6 n LYS 45 Ca 0.01 0.14 -0.33 0.00 -2.02 0.00 0.00 58.31 56.10 2dn6 n LYS 45 Cb 0.54 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.91 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 -6.39 4.29 0.22 4.39 2.15 -1.26 -5.11 116.67 114.96 2dn6 s ASP 46 Ca -0.33 -1.10 -0.18 0.00 0.43 0.00 0.00 52.55 51.36 2dn6 s ASP 46 Cb 0.09 -1.60 -0.08 0.00 -0.30 0.00 0.00 42.92 41.02 2dn6 s ASP 46 CO 0.58 -0.16 0.70 -0.75 -0.17 0.00 0.00 175.17 175.37 2dn6 s LYS 47 N 1.23 4.19 -0.23 4.34 2.20 -1.26 -2.82 119.74 127.39 2dn6 s LYS 47 Ca -0.03 0.79 -0.02 0.00 -0.36 0.00 0.00 55.97 56.35 2dn6 s LYS 47 Cb -0.18 -2.86 -0.13 0.00 -1.51 0.00 0.00 37.83 33.15 2dn6 s LYS 47 CO -0.05 0.39 -0.23 1.63 -0.36 0.00 0.00 175.35 176.73 2dn6 n LYS 48 N 0.66 0.54 0.00 4.03 4.76 -1.15 -4.96 118.16 122.04 2dn6 n LYS 48 Ca -0.02 0.15 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 2dn6 n LYS 48 Cb 0.51 -1.42 0.00 0.00 -1.84 0.00 0.00 35.03 32.28 2dn6 n LYS 48 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dn6 n GLY 49 N 2.19 1.63 3.54 0.72 0.00 -1.26 -5.08 105.19 106.94 2dn6 n GLY 49 Ca -0.41 -0.44 -0.17 0.00 0.00 0.00 0.00 46.02 45.00 2dn6 n GLY 49 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2dn6 s ASP 50 N 2.00 -0.67 -0.50 1.61 1.47 -1.26 -4.17 116.67 115.14 2dn6 s ASP 50 Ca 0.00 0.92 0.01 0.00 1.18 0.00 0.00 52.55 54.67 2dn6 s ASP 50 Cb 0.00 0.81 0.13 0.00 -0.34 0.00 0.00 42.92 43.52 2dn6 s ASP 50 CO 0.00 -0.50 0.26 -0.63 0.68 0.00 0.00 175.17 174.99 2dn6 s ILE 51 N -0.72 2.93 -0.23 2.11 1.01 0.03 -5.00 121.20 121.33 2dn6 s ILE 51 Ca -0.08 -2.88 -0.33 0.00 0.00 0.00 0.00 60.65 57.36 2dn6 s ILE 51 Cb -0.02 -3.01 -0.10 0.00 0.01 0.00 0.00 42.46 39.35 2dn6 s ILE 51 CO 0.07 -0.77 2.09 0.18 0.00 0.00 0.00 174.94 176.52 2dn6 n LEU 52 N 3.61 2.83 -4.77 2.97 4.77 -1.26 -2.70 117.00 122.45 2dn6 n LEU 52 Ca 0.05 0.55 -0.39 0.00 -0.03 0.00 0.00 56.01 56.19 2dn6 n LEU 52 Cb 0.37 -1.37 -0.06 0.00 -2.33 0.00 0.00 43.42 40.03 2dn6 n LEU 52 CO 0.32 -0.50 0.58 -0.76 -1.33 0.00 0.00 177.39 175.69 2dn6 s LEU 53 N 6.50 4.52 -0.07 2.23 1.43 -1.26 -4.92 118.68 127.10 2dn6 s LEU 53 Ca 1.02 1.78 -0.31 0.00 -1.03 0.00 0.00 54.13 55.60 2dn6 s LEU 53 Cb -0.68 -3.64 0.08 0.00 0.03 0.00 0.00 46.19 41.99 2dn6 s LEU 53 CO 0.47 0.10 0.75 -1.81 0.23 0.00 0.00 176.35 176.08 2dn6 s ASP 54 N -1.34 -0.60 0.22 2.29 1.01 -1.26 -4.88 116.67 112.11 2dn6 s ASP 54 Ca 0.42 0.64 0.08 0.00 0.71 0.00 0.00 52.55 54.40 2dn6 s ASP 54 Cb -0.22 0.49 0.71 0.00 1.01 0.00 0.00 42.92 44.91 2dn6 s ASP 54 CO 0.27 -0.56 1.03 -1.84 0.21 0.00 0.00 175.17 174.28 2dn6 n GLU 55 N 0.85 -0.04 0.28 8.23 0.28 -1.26 0.14 120.64 129.11 2dn6 n GLU 55 Ca -0.17 0.93 -0.16 0.00 -0.16 0.00 0.00 57.16 57.60 2dn6 n GLU 55 Cb 0.57 -1.59 -0.08 0.00 1.43 0.00 0.00 31.44 31.77 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 -0.71 -2.80 -1.84 2.35 -1.95 -3.43 115.58 107.20 2dn6 h ASN 56 Ca 0.48 0.04 -0.59 0.00 -0.55 0.00 0.00 56.30 55.68 2dn6 h ASN 56 Cb 1.18 0.20 0.12 0.00 0.05 0.00 0.00 38.32 39.87 2dn6 h ASN 56 CO -0.55 -0.46 0.22 0.00 -1.65 0.00 0.00 177.43 174.99 2dn6 s VAL 59 N -3.94 1.69 0.25 0.00 0.11 -1.26 -0.48 120.40 116.76 2dn6 s VAL 59 Ca 0.14 -0.94 0.09 0.00 -2.93 0.00 0.00 61.98 58.34 2dn6 s VAL 59 Cb -0.03 -1.41 -0.05 0.00 -1.53 0.00 0.00 36.38 33.36 2dn6 s VAL 59 CO 0.05 0.46 -0.13 -1.83 -3.33 0.00 0.00 175.10 170.32 2dn6 s GLU 60 N -0.55 1.48 -0.49 1.54 -1.05 -0.32 -5.00 118.70 114.31 2dn6 s GLU 60 Ca 0.08 -1.69 -0.15 0.00 -0.15 0.00 0.00 54.97 53.06 2dn6 s GLU 60 Cb -0.08 -1.31 0.09 0.00 -0.44 0.00 0.00 34.13 32.39 2dn6 s GLU 60 CO -0.01 0.18 0.41 -1.54 0.95 0.00 0.00 175.26 175.26 2dn6 s SER 61 N -3.40 6.10 0.42 0.83 1.04 -1.26 -2.55 113.70 114.87 2dn6 s SER 61 Ca 0.26 -1.50 -0.23 0.00 0.48 0.00 0.00 55.95 54.97 2dn6 s SER 61 Cb -0.01 -2.17 -0.09 0.00 0.10 0.00 0.00 66.02 63.85 2dn6 s SER 61 CO 0.10 -0.70 1.02 -0.76 0.98 0.00 0.00 173.24 173.88 2dn6 s LEU 62 N 1.60 4.06 0.00 2.42 1.43 -0.91 -4.95 118.68 122.32 2dn6 s LEU 62 Ca 0.04 1.93 0.00 0.00 -1.03 0.00 0.00 54.13 55.06 2dn6 s LEU 62 Cb -0.26 -4.32 0.00 0.00 0.03 0.00 0.00 46.19 41.64 2dn6 s LEU 62 CO 0.05 -0.49 0.00 -0.81 0.23 0.00 0.00 176.35 175.33 2dn6 n PRO 63 N -0.31 0.18 -3.01 1.29 -0.04 -1.26 -3.69 135.00 128.17 2dn6 n PRO 63 Ca 0.06 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.11 2dn6 n PRO 63 Cb 0.51 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.92 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 6.76 0.09 3.54 -4.77 -1.26 -4.36 116.67 115.16 2dn6 s ASP 64 Ca 0.00 0.94 -0.08 0.00 -3.30 0.00 0.00 52.55 50.10 2dn6 s ASP 64 Cb 0.00 -2.39 -0.00 0.00 -1.09 0.00 0.00 42.92 39.43 2dn6 s ASP 64 CO 0.00 -0.38 0.19 -1.59 0.70 0.00 0.00 175.17 174.08 2dn6 s LYS 65 N 2.32 0.85 -1.68 2.11 -2.85 -1.26 -4.85 119.74 114.39 2dn6 s LYS 65 Ca 0.32 -0.98 -0.15 0.00 -1.00 0.00 0.00 55.97 54.15 2dn6 s LYS 65 Cb -0.16 0.34 0.14 0.00 -2.06 0.00 0.00 37.83 36.09 2dn6 s LYS 65 CO 0.10 -0.27 0.63 -0.25 0.10 0.00 0.00 175.35 175.66 2dn6 n ASP 66 N -0.06 -2.23 -2.40 0.03 9.92 -1.26 0.59 116.55 121.14 2dn6 n ASP 66 Ca -0.14 -1.08 -0.17 0.00 -0.53 0.00 0.00 54.79 52.87 2dn6 n ASP 66 Cb 0.62 -2.50 0.03 0.00 -0.64 0.00 0.00 41.12 38.64 2dn6 n ASP 66 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2dn6 n GLY 67 N -1.53 -0.24 3.95 0.44 0.00 -1.26 -5.02 105.19 101.53 2dn6 n GLY 67 Ca -0.01 -0.07 -0.20 0.00 0.00 0.00 0.00 46.02 45.74 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 -5.46 2.54 0.00 1.61 -0.14 0.20 -5.05 119.74 113.43 2dn6 s LYS 68 Ca 0.25 -1.53 0.00 0.00 -1.36 0.00 0.00 55.97 53.33 2dn6 s LYS 68 Cb -0.11 -2.51 0.00 0.00 -1.68 0.00 0.00 37.83 33.53 2dn6 s LYS 68 CO 0.31 -0.40 0.00 1.63 -0.76 0.00 0.00 175.35 176.13 2dn6 n LYS 69 N -1.80 0.24 -3.71 1.68 4.01 -1.26 -4.14 118.16 113.18 2dn6 n LYS 69 Ca 0.07 0.00 -0.30 0.00 -0.51 0.00 0.00 58.31 57.57 2dn6 n LYS 69 Cb 0.61 -0.68 -0.14 0.00 -0.51 0.00 0.00 35.03 34.31 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 1.21 3.11 -0.29 0.00 1.43 -1.24 -0.52 118.68 122.37 2dn6 s LEU 71 Ca 0.13 -0.86 -0.16 0.00 -1.03 0.00 0.00 54.13 52.21 2dn6 s LEU 71 Cb -0.20 -1.54 0.14 0.00 0.03 0.00 0.00 46.19 44.62 2dn6 s LEU 71 CO -0.16 -0.21 0.95 0.72 0.23 0.00 0.00 176.35 177.88 2dn6 s PHE 72 N -2.45 -0.61 0.17 0.29 -0.12 -0.76 -2.15 117.98 112.34 2dn6 s PHE 72 Ca 0.35 1.23 0.11 0.00 -0.05 0.00 0.00 56.93 58.58 2dn6 s PHE 72 Cb -0.02 0.37 -0.04 0.00 -0.63 0.00 0.00 43.02 42.70 2dn6 s PHE 72 CO 0.20 -0.30 -0.25 -1.17 -0.05 0.00 0.00 175.22 173.65 2dn6 s LEU 73 N 1.32 2.40 -0.15 -1.99 0.20 -1.06 -1.52 118.68 117.89 2dn6 s LEU 73 Ca -0.09 -0.82 -0.02 0.00 0.69 0.00 0.00 54.13 53.89 2dn6 s LEU 73 Cb -0.04 -1.19 -0.02 0.00 -0.43 0.00 0.00 46.19 44.51 2dn6 s LEU 73 CO -0.15 0.14 -0.08 -0.69 -0.29 0.00 0.00 176.35 175.28 2dn6 s VAL 74 N -1.47 3.40 -0.30 1.68 1.01 0.78 -1.18 120.40 124.32 2dn6 s VAL 74 Ca 0.19 -0.53 -0.08 0.00 0.00 0.00 0.00 61.98 61.55 2dn6 s VAL 74 Cb -0.09 -2.47 -0.00 0.00 0.00 0.00 0.00 36.38 33.82 2dn6 s VAL 74 CO 0.09 0.50 0.12 -0.75 0.00 0.00 0.00 175.10 175.06 2dn6 s LYS 75 N 0.50 3.24 0.52 2.72 2.47 0.36 -2.13 119.74 127.43 2dn6 s LYS 75 Ca -0.06 -0.77 0.06 0.00 -1.56 0.00 0.00 55.97 53.64 2dn6 s LYS 75 Cb -0.15 -3.48 0.02 0.00 -1.46 0.00 0.00 37.83 32.76 2dn6 s LYS 75 CO 0.03 -0.42 0.39 0.00 0.16 0.00 0.00 175.35 175.51 2dn6 n PHE 77 N -1.70 0.00 0.00 0.00 3.01 -1.26 -4.02 117.46 113.49 2dn6 n PHE 77 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 2dn6 n PHE 77 Cb 0.64 -0.22 0.00 0.00 -0.01 0.00 0.00 39.48 39.89 2dn6 n PHE 77 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2dn6 n ASP 78 N -2.21 3.83 -4.89 4.37 8.00 -1.26 -5.07 116.55 119.32 2dn6 n ASP 78 Ca 0.00 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.21 2dn6 n ASP 78 Cb 0.00 0.47 0.02 0.00 -0.02 0.00 0.00 41.12 41.59 2dn6 n ASP 78 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2dn6 s LYS 79 N -1.71 3.24 0.05 -1.24 -0.14 -1.26 -5.10 119.74 113.59 2dn6 s LYS 79 Ca 0.00 0.43 -0.03 0.00 -1.36 0.00 0.00 55.97 55.01 2dn6 s LYS 79 Cb 0.00 -2.15 -0.03 0.00 -1.68 0.00 0.00 37.83 33.97 2dn6 s LYS 79 CO 0.00 -0.67 0.02 0.95 -0.76 0.00 0.00 175.35 174.89 2dn6 s THR 80 N -3.12 0.19 -0.22 2.17 -4.23 -1.26 -1.90 115.64 107.26 2dn6 s THR 80 Ca 0.54 -1.54 -0.04 0.00 -1.18 0.00 0.00 61.69 59.47 2dn6 s THR 80 Cb -0.11 -1.29 0.11 0.00 1.34 0.00 0.00 72.50 72.55 2dn6 s THR 80 CO 0.50 -0.85 0.37 -0.36 -0.54 0.00 0.00 174.62 173.74 2dn6 s PHE 81 N -3.51 -0.74 -0.21 3.99 0.40 -0.90 -5.00 117.98 112.00 2dn6 s PHE 81 Ca 0.03 1.01 -0.09 0.00 -0.60 0.00 0.00 56.93 57.28 2dn6 s PHE 81 Cb 0.05 0.07 -0.04 0.00 0.51 0.00 0.00 43.02 43.61 2dn6 s PHE 81 CO -0.09 -0.60 0.11 -2.00 0.70 0.00 0.00 175.22 173.34 2dn6 s GLU 82 N 2.54 3.99 0.07 0.44 2.12 -1.26 -0.16 118.70 126.44 2dn6 s GLU 82 Ca 0.07 -0.32 0.04 0.00 0.36 0.00 0.00 54.97 55.12 2dn6 s GLU 82 Cb -0.14 -3.37 -0.03 0.00 0.26 0.00 0.00 34.13 30.85 2dn6 s GLU 82 CO -0.14 0.14 -0.12 0.42 -0.54 0.00 0.00 175.26 175.02 2dn6 s ILE 83 N 0.79 0.95 0.12 -3.70 1.01 -0.58 -0.04 121.20 119.74 2dn6 s ILE 83 Ca 0.05 -1.31 0.08 0.00 0.00 0.00 0.00 60.65 59.48 2dn6 s ILE 83 Cb -0.13 -1.01 -0.04 0.00 0.01 0.00 0.00 42.46 41.29 2dn6 s ILE 83 CO 0.02 -0.32 -0.15 -0.55 0.00 0.00 0.00 174.94 173.94 2dn6 s SER 84 N -1.82 4.05 0.24 3.58 0.15 0.13 -1.84 113.70 118.19 2dn6 s SER 84 Ca -0.03 -0.51 0.10 0.00 0.70 0.00 0.00 55.95 56.21 2dn6 s SER 84 Cb -0.09 -0.64 -0.04 0.00 -1.71 0.00 0.00 66.02 63.54 2dn6 s SER 84 CO 0.02 0.17 -0.09 0.00 1.20 0.00 0.00 173.24 174.54 2dn6 s ALA 85 N -1.19 2.96 -0.10 5.45 0.00 0.32 -3.47 121.76 125.73 2dn6 s ALA 85 Ca 0.19 -1.66 -0.04 0.00 0.00 0.00 0.00 51.96 50.45 2dn6 s ALA 85 Cb -0.11 -0.60 -0.01 0.00 0.00 0.00 0.00 23.12 22.39 2dn6 s ALA 85 CO 0.11 0.33 -0.08 1.03 0.00 0.00 0.00 175.76 177.15 2dn6 h SER 86 N 2.35 0.00 -3.81 0.00 0.87 -1.94 -3.39 113.55 107.63 2dn6 h SER 86 Ca -0.44 0.00 -0.68 0.00 -1.23 0.00 0.00 61.79 59.44 2dn6 h SER 86 Cb 1.24 0.00 -0.20 0.00 -0.44 0.00 0.00 62.40 63.00 2dn6 h SER 86 CO 0.58 0.52 -0.76 -1.81 -0.53 0.00 0.00 176.83 174.82 2dn6 s ASP 87 N -5.17 4.15 0.35 6.23 1.01 -1.26 -4.74 116.67 117.23 2dn6 s ASP 87 Ca -0.07 -0.32 0.15 0.00 0.71 0.00 0.00 52.55 53.02 2dn6 s ASP 87 Cb 0.01 -0.80 1.16 0.00 1.01 0.00 0.00 42.92 44.30 2dn6 s ASP 87 CO 0.10 0.26 1.60 0.07 0.21 0.00 0.00 175.17 177.41 2dn6 h LYS 88 N 4.46 0.07 -0.18 8.23 2.10 -1.95 0.21 116.57 129.51 2dn6 h LYS 88 Ca -0.48 -0.00 0.05 0.00 -2.00 0.00 0.00 60.65 58.22 2dn6 h LYS 88 Cb 1.16 -0.02 -0.07 0.00 -0.90 0.00 0.00 32.23 32.41 2dn6 h LYS 88 CO 0.50 0.05 -0.38 -0.22 -2.00 0.00 0.00 179.45 177.40 2dn6 h LYS 89 N 0.07 -0.41 -0.06 0.07 1.63 -1.99 0.18 116.57 116.07 2dn6 h LYS 89 Ca 0.77 0.03 0.02 0.00 -0.85 0.00 0.00 60.65 60.61 2dn6 h LYS 89 Cb 1.90 0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 33.61 2dn6 h LYS 89 CO -0.76 -0.27 -0.05 0.87 -3.45 0.00 0.00 179.45 175.79 2dn6 h LYS 90 N -0.43 -0.06 0.09 1.90 1.57 -1.01 0.77 116.57 119.41 2dn6 h LYS 90 Ca 0.10 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2dn6 h LYS 90 Cb 0.59 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 2dn6 h LYS 90 CO -0.41 -0.04 -0.15 -0.22 -0.57 0.00 0.00 179.45 178.06 2dn6 h LYS 91 N -0.06 -0.25 -0.40 3.15 3.11 -0.89 0.22 116.57 121.44 2dn6 h LYS 91 Ca 0.04 0.02 0.08 0.00 -2.81 0.00 0.00 60.65 57.98 2dn6 h LYS 91 Cb 0.11 0.06 -0.09 0.00 -1.00 0.00 0.00 32.23 31.31 2dn6 h LYS 91 CO -0.09 -0.17 -0.23 0.37 -2.81 0.00 0.00 179.45 176.52 2dn6 h GLN 92 N -0.26 -0.15 0.08 1.90 5.75 -0.66 -0.77 115.11 120.99 2dn6 h GLN 92 Ca -0.01 0.01 0.01 0.00 -0.15 0.00 0.00 58.65 58.51 2dn6 h GLN 92 Cb 0.24 0.03 -0.05 0.00 1.07 0.00 0.00 27.48 28.78 2dn6 h GLN 92 CO -0.05 -0.10 -0.50 0.93 -2.65 0.00 0.00 178.83 176.45 2dn6 h GLU 93 N -0.16 -0.66 -0.12 1.69 5.08 -0.67 0.22 114.58 119.96 2dn6 h GLU 93 Ca 0.19 0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.63 2dn6 h GLU 93 Cb 0.46 0.15 -0.06 0.00 0.50 0.00 0.00 28.75 29.80 2dn6 h GLU 93 CO -0.49 -0.44 -0.51 -1.49 -1.00 0.00 0.00 179.01 175.07 2dn6 h TRP 94 N -0.69 -1.53 -0.59 4.33 4.06 -0.10 0.16 115.95 121.59 2dn6 h TRP 94 Ca -0.00 0.06 0.12 0.00 2.06 0.00 0.00 58.89 61.13 2dn6 h TRP 94 Cb 0.71 0.68 -0.10 0.00 -1.00 0.00 0.00 29.16 29.45 2dn6 h TRP 94 CO -0.47 -0.52 -0.03 0.82 -3.56 0.00 0.00 178.44 174.69 2dn6 h ILE 95 N -0.55 0.49 -0.70 1.49 2.04 -0.92 0.23 117.51 119.58 2dn6 h ILE 95 Ca 0.03 -0.03 0.05 0.00 1.00 0.00 0.00 64.86 65.90 2dn6 h ILE 95 Cb 0.64 0.39 -0.05 0.00 -0.74 0.00 0.00 36.82 37.07 2dn6 h ILE 95 CO -0.41 0.02 0.42 1.56 0.00 0.00 0.00 178.15 179.74 2dn6 h GLN 96 N 0.09 0.77 0.07 2.37 1.08 0.37 0.18 115.11 120.03 2dn6 h GLN 96 Ca 0.30 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.45 2dn6 h GLN 96 Cb 0.49 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.74 2dn6 h GLN 96 CO -0.53 0.51 -0.03 0.00 -0.95 0.00 0.00 178.83 177.83 2dn6 h ALA 97 N 1.33 -0.09 0.57 3.87 0.00 0.11 -2.58 119.26 122.47 2dn6 h ALA 97 Ca 0.30 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2dn6 h ALA 97 Cb 0.11 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2dn6 h ALA 97 CO -0.15 -0.41 -0.33 0.82 0.00 0.00 0.00 179.25 179.19 2dn6 h ILE 98 N -0.38 0.33 -0.71 0.00 2.04 -0.37 -1.32 117.51 117.10 2dn6 h ILE 98 Ca -0.01 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.99 2dn6 h ILE 98 Cb 0.33 0.33 -0.13 0.00 -0.74 0.00 0.00 36.82 36.61 2dn6 h ILE 98 CO 0.02 0.00 -0.23 -0.74 0.00 0.00 0.00 178.15 177.19 2dn6 h HIS 99 N -0.84 -0.57 -0.34 1.37 2.76 -0.72 0.64 115.15 117.45 2dn6 h HIS 99 Ca -0.07 0.07 0.02 0.00 -2.20 0.00 0.00 60.37 58.18 2dn6 h HIS 99 Cb 0.67 0.36 -0.02 0.00 1.55 0.00 0.00 27.41 29.97 2dn6 h HIS 99 CO -0.08 -0.34 0.20 0.77 -1.30 0.00 0.00 177.93 177.18 2dn6 h SER 100 N -0.04 0.32 -0.82 3.26 0.02 -1.28 -2.07 113.55 112.93 2dn6 h SER 100 Ca 0.32 0.00 0.19 0.00 -0.84 0.00 0.00 61.79 61.47 2dn6 h SER 100 Cb 0.55 -0.06 -0.12 0.00 0.14 0.00 0.00 62.40 62.91 2dn6 h SER 100 CO -0.75 0.23 0.27 0.74 -1.14 0.00 0.00 176.83 176.18 2dn6 h THR 101 N 0.40 0.48 -0.35 -2.27 2.02 0.30 0.12 112.91 113.61 2dn6 h THR 101 Ca 0.14 -0.11 -0.13 0.00 0.77 0.00 0.00 66.41 67.07 2dn6 h THR 101 Cb 0.01 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 66.54 2dn6 h THR 101 CO -0.07 0.06 -0.32 0.40 0.37 0.00 0.00 175.52 175.96 2dn6 h ILE 102 N 0.32 1.28 -0.75 3.11 2.04 -0.93 -3.12 117.51 119.46 2dn6 h ILE 102 Ca 0.48 -1.47 0.16 0.00 1.00 0.00 0.00 64.86 65.04 2dn6 h ILE 102 Cb 0.87 1.35 -0.11 0.00 -0.74 0.00 0.00 36.82 38.19 2dn6 h ILE 102 CO -0.53 0.48 0.20 -0.74 0.00 0.00 0.00 178.15 177.57 2dn6 h HIS 103 N 0.66 0.32 -0.21 1.37 2.76 -0.07 0.38 115.15 120.36 2dn6 h HIS 103 Ca 0.07 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.28 2dn6 h HIS 103 Cb 0.86 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.78 2dn6 h HIS 103 CO 0.05 -0.07 0.13 -0.07 -1.30 0.00 0.00 177.93 176.67 2dn6 h LEU 104 N 0.29 0.24 -0.51 0.26 3.38 -1.42 -1.49 115.31 116.06 2dn6 h LEU 104 Ca 0.43 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 58.22 2dn6 h LEU 104 Cb 0.73 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 2dn6 h LEU 104 CO -0.50 0.18 -0.68 -0.07 0.09 0.00 0.00 178.44 177.46 2dn6 h LEU 105 N 0.29 0.36 -0.39 1.67 3.38 -0.35 -3.22 115.31 117.05 2dn6 h LEU 105 Ca 0.08 -0.23 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 2dn6 h LEU 105 Cb -0.02 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2dn6 h LEU 105 CO -0.02 0.93 0.05 0.11 0.09 0.00 0.00 178.44 179.61 2dn6 h LYS 106 N 0.22 0.66 -0.72 1.13 1.57 -0.23 -3.11 116.57 116.08 2dn6 h LYS 106 Ca -0.02 -0.18 0.13 0.00 -1.87 0.00 0.00 60.65 58.71 2dn6 h LYS 106 Cb 1.22 -0.07 -0.14 0.00 0.08 0.00 0.00 32.23 33.33 2dn6 h LYS 106 CO 0.11 0.72 -0.27 -0.07 -0.57 0.00 0.00 179.45 179.37 2dn6 h LEU 107 N 0.50 -0.96 0.00 2.94 -0.00 -1.46 -3.34 115.31 113.00 2dn6 h LEU 107 Ca 0.12 0.24 0.00 0.00 -0.00 0.00 0.00 57.88 58.24 2dn6 h LEU 107 Cb 0.39 0.54 0.00 0.00 -0.00 0.00 0.00 40.66 41.59 2dn6 h LEU 107 CO 0.01 -0.28 0.00 0.61 -0.00 0.00 0.00 178.44 178.78 2dn6 n GLY 108 N -1.47 -0.13 2.44 0.83 0.00 -1.18 -4.72 105.19 100.96 2dn6 n GLY 108 Ca 0.08 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.65 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 0.00 0.59 -4.62 1.61 2.88 -1.20 -4.73 113.62 108.15 2dn6 n SER 109 Ca 0.00 0.54 -0.46 0.00 -1.33 0.00 0.00 58.87 57.62 2dn6 n SER 109 Cb 0.00 -0.67 -0.03 0.00 -0.75 0.00 0.00 64.21 62.77 2dn6 n SER 109 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dn6 n SER 110 N 5.31 1.96 -3.40 -3.46 3.41 -1.26 -4.76 113.62 111.43 2dn6 n SER 110 Ca 0.39 1.15 -0.27 0.00 -0.26 0.00 0.00 58.87 59.88 2dn6 n SER 110 Cb -0.03 -1.33 -0.08 0.00 -0.26 0.00 0.00 64.21 62.52 2dn6 n SER 110 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dn6 n GLY 111 N 1.87 4.78 3.39 5.00 0.00 -1.26 -5.09 105.19 113.88 2dn6 n GLY 111 Ca 0.12 -2.73 -0.29 0.00 0.00 0.00 0.00 46.02 43.12 2dn6 n GLY 111 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dn6 n PRO 112 N 0.83 -3.08 -1.59 1.61 -0.04 -1.26 -4.91 135.00 126.56 2dn6 n PRO 112 Ca 0.30 -1.69 -0.48 0.00 -0.04 0.00 0.00 63.50 61.58 2dn6 n PRO 112 Cb 0.41 -1.58 -0.04 0.00 -0.04 0.00 0.00 33.50 32.25 2dn6 n PRO 112 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dn6 n SER 113 N -4.81 1.49 -2.17 3.54 7.64 -1.26 -4.90 113.62 113.16 2dn6 n SER 113 Ca 0.15 1.14 -0.26 0.00 1.01 0.00 0.00 58.87 60.90 2dn6 n SER 113 Cb 0.57 -1.24 0.02 0.00 -1.01 0.00 0.00 64.21 62.56 2dn6 n SER 113 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2dn6 n SER 114 N 2.05 5.32 0.00 6.43 3.41 -1.26 -5.30 113.62 124.27 2dn6 n SER 114 Ca 0.15 -3.75 0.00 0.00 -0.26 0.00 0.00 58.87 55.01 2dn6 n SER 114 Cb 0.25 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 2dn6 n SER 114 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49