#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dn6 n SER 2 N 0.00 -1.02 -0.01 1.61 2.88 -1.26 -4.71 113.62 111.11 2dn6 n SER 2 Ca 0.00 -1.06 -0.02 0.00 -1.33 0.00 0.00 58.87 56.46 2dn6 n SER 2 Cb 0.00 -1.35 -0.01 0.00 -0.75 0.00 0.00 64.21 62.10 2dn6 n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dn6 n SER 3 N -2.05 1.61 0.00 -3.46 7.64 -1.26 -5.15 113.62 110.95 2dn6 n SER 3 Ca 0.02 0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.91 2dn6 n SER 3 Cb 0.43 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 2dn6 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dn6 n GLY 4 N 3.10 2.47 3.82 0.23 0.00 -1.26 -5.07 105.19 108.48 2dn6 n GLY 4 Ca -0.03 -1.43 -0.34 0.00 0.00 0.00 0.00 46.02 44.22 2dn6 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dn6 s SER 5 N 0.00 7.01 0.12 1.61 0.15 -1.26 -4.98 113.70 116.35 2dn6 s SER 5 Ca 0.00 1.63 -0.23 0.00 0.70 0.00 0.00 55.95 58.04 2dn6 s SER 5 Cb 0.00 -2.51 -0.05 0.00 -1.71 0.00 0.00 66.02 61.75 2dn6 s SER 5 CO 0.00 -0.23 1.67 -1.28 1.20 0.00 0.00 173.24 174.60 2dn6 h SER 6 N 2.40 -0.46 0.00 5.45 0.87 -1.99 -3.43 113.55 116.39 2dn6 h SER 6 Ca -0.48 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 2dn6 h SER 6 Cb 1.18 0.20 0.00 0.00 -0.44 0.00 0.00 62.40 63.35 2dn6 h SER 6 CO 0.63 -0.21 0.00 0.61 -0.53 0.00 0.00 176.83 177.33 2dn6 n GLY 7 N -1.29 0.29 2.46 5.77 0.00 -1.26 -4.96 105.19 106.20 2dn6 n GLY 7 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 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 -4.67 118.33 117.10 2dn6 n VAL 8 Ca 0.00 0.00 -0.16 0.00 -2.96 0.00 0.00 64.34 61.22 2dn6 n VAL 8 Cb 0.00 -0.11 -0.13 0.00 -1.06 0.00 0.00 33.84 32.54 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 2.49 0.08 -8.65 6.55 3.38 -0.58 -3.38 115.31 115.20 2dn6 h LEU 9 Ca -0.34 -0.94 -0.47 0.00 0.09 0.00 0.00 57.88 56.23 2dn6 h LEU 9 Cb 0.97 -0.03 -0.19 0.00 0.09 0.00 0.00 40.66 41.50 2dn6 h LEU 9 CO 0.52 1.13 -0.78 -0.75 0.09 0.00 0.00 178.44 178.65 2dn6 s LYS 10 N -2.27 1.08 -0.26 1.13 2.20 -1.18 -4.76 119.74 115.68 2dn6 s LYS 10 Ca -0.19 -1.24 -0.18 0.00 -0.36 0.00 0.00 55.97 54.00 2dn6 s LYS 10 Cb -0.01 -1.10 0.07 0.00 -1.51 0.00 0.00 37.83 35.29 2dn6 s LYS 10 CO 0.70 0.23 0.65 1.14 -0.36 0.00 0.00 175.35 177.71 2dn6 s GLN 11 N -2.46 0.70 -0.29 4.03 -2.07 -1.26 -1.13 119.66 117.17 2dn6 s GLN 11 Ca 0.09 1.08 -0.39 0.00 -1.82 0.00 0.00 55.36 54.33 2dn6 s GLN 11 Cb -0.07 0.20 0.16 0.00 -1.09 0.00 0.00 33.01 32.21 2dn6 s GLN 11 CO 0.04 -0.13 1.39 0.20 -1.32 0.00 0.00 175.29 175.47 2dn6 s GLY 12 N 1.20 -0.19 -0.09 2.60 0.00 -1.19 -5.01 107.32 104.63 2dn6 s GLY 12 Ca -0.07 1.93 -0.30 0.00 0.00 0.00 0.00 44.72 46.29 2dn6 s GLY 12 CO -0.12 0.64 1.45 -0.19 0.00 0.00 0.00 173.10 174.88 2dn6 s TYR 13 N -2.02 2.49 0.06 1.90 2.02 -1.26 -2.78 117.35 117.76 2dn6 s TYR 13 Ca 0.12 0.64 0.06 0.00 -0.37 0.00 0.00 57.07 57.52 2dn6 s TYR 13 Cb -0.01 -3.70 -0.03 0.00 -0.40 0.00 0.00 41.96 37.82 2dn6 s TYR 13 CO -0.02 -2.72 -0.17 -1.64 -1.57 0.00 0.00 175.55 169.42 2dn6 s MET 14 N 3.53 1.07 -0.42 -0.62 -1.94 0.22 -4.89 119.30 116.26 2dn6 s MET 14 Ca 0.64 -0.94 -0.20 0.00 -1.71 0.00 0.00 55.69 53.48 2dn6 s MET 14 Cb -0.28 -1.17 0.02 0.00 2.01 0.00 0.00 34.83 35.41 2dn6 s MET 14 CO 0.23 0.28 0.61 -1.64 -0.01 0.00 0.00 175.02 174.49 2dn6 s MET 15 N -1.45 3.35 -0.16 2.03 -1.94 -1.07 0.25 119.30 120.31 2dn6 s MET 15 Ca 0.04 -0.33 -0.07 0.00 -1.71 0.00 0.00 55.69 53.61 2dn6 s MET 15 Cb -0.09 -3.92 -0.04 0.00 2.01 0.00 0.00 34.83 32.79 2dn6 s MET 15 CO 0.02 -0.92 0.09 0.21 -0.01 0.00 0.00 175.02 174.41 2dn6 s LYS 16 N 2.70 3.78 -0.24 2.03 2.20 -0.97 0.52 119.74 129.75 2dn6 s LYS 16 Ca 0.21 -0.28 -0.29 0.00 -0.36 0.00 0.00 55.97 55.26 2dn6 s LYS 16 Cb -0.15 -3.20 -0.02 0.00 -1.51 0.00 0.00 37.83 32.96 2dn6 s LYS 16 CO 0.17 0.45 1.49 0.21 -0.36 0.00 0.00 175.35 177.31 2dn6 s LYS 17 N -0.11 3.87 0.04 4.03 2.20 -0.88 -3.24 119.74 125.65 2dn6 s LYS 17 Ca 0.08 1.54 -0.38 0.00 -0.36 0.00 0.00 55.97 56.85 2dn6 s LYS 17 Cb -0.12 -3.97 -0.19 0.00 -1.51 0.00 0.00 37.83 32.04 2dn6 s LYS 17 CO 0.01 -1.19 1.01 0.41 -0.36 0.00 0.00 175.35 175.23 2dn6 n GLY 18 N 4.47 -0.43 0.33 5.54 0.00 -1.21 -4.79 105.19 109.10 2dn6 n GLY 18 Ca 0.17 0.69 0.03 0.00 0.00 0.00 0.00 46.02 46.91 2dn6 n GLY 18 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2dn6 h HIS 19 N 2.82 -0.54 0.00 1.61 3.86 -1.98 -3.13 115.15 117.80 2dn6 h HIS 19 Ca -0.47 0.08 -0.36 0.00 -1.16 0.00 0.00 60.37 58.46 2dn6 h HIS 19 Cb 1.42 0.37 -0.06 0.00 1.06 0.00 0.00 27.41 30.21 2dn6 h HIS 19 CO 0.55 -0.38 -2.27 -2.13 0.86 0.00 0.00 177.93 174.56 2dn6 n ARG 20 N -5.56 0.53 -1.55 2.45 0.00 -1.26 -5.01 116.66 106.26 2dn6 n ARG 20 Ca 0.13 0.16 -0.29 0.00 -0.00 0.00 0.00 57.85 57.85 2dn6 n ARG 20 Cb 0.44 -1.39 0.12 0.00 0.00 0.00 0.00 32.46 31.63 2dn6 n ARG 20 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2dn6 s ARG 21 N -2.43 1.44 -0.14 -0.14 1.81 -1.18 -5.04 118.95 113.27 2dn6 s ARG 21 Ca -0.31 0.39 -0.11 0.00 -1.72 0.00 0.00 55.73 53.98 2dn6 s ARG 21 Cb 0.10 -1.86 -0.06 0.00 -0.45 0.00 0.00 34.95 32.67 2dn6 s ARG 21 CO 0.47 -2.01 -0.25 1.63 -0.68 0.00 0.00 175.30 174.46 2dn6 n LYS 22 N -3.66 0.39 -0.89 3.54 4.01 -1.26 -3.29 118.16 117.00 2dn6 n LYS 22 Ca 0.07 0.16 -0.43 0.00 -0.51 0.00 0.00 58.31 57.60 2dn6 n LYS 22 Cb 0.58 -1.16 -0.09 0.00 -0.51 0.00 0.00 35.03 33.85 2dn6 n LYS 22 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2dn6 n ASN 23 N -4.04 0.53 -4.69 4.39 3.02 -1.26 -4.21 115.26 109.00 2dn6 n ASN 23 Ca -0.22 0.48 -0.35 0.00 -0.03 0.00 0.00 54.58 54.46 2dn6 n ASN 23 Cb 0.53 -0.64 0.10 0.00 -0.61 0.00 0.00 39.78 39.16 2dn6 n ASN 23 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 2dn6 n TRP 24 N 5.33 1.41 -3.77 3.10 7.02 -1.26 -4.43 117.44 124.84 2dn6 n TRP 24 Ca 0.39 0.41 -0.14 0.00 -1.02 0.00 0.00 57.50 57.14 2dn6 n TRP 24 Cb -0.03 -2.16 -0.15 0.00 -2.42 0.00 0.00 31.31 26.55 2dn6 n TRP 24 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2dn6 s THR 25 N -1.77 -0.04 0.16 -0.99 -4.23 -1.20 -4.98 115.64 102.58 2dn6 s THR 25 Ca 0.77 0.16 -0.31 0.00 -1.18 0.00 0.00 61.69 61.12 2dn6 s THR 25 Cb -0.34 -0.18 -0.10 0.00 1.34 0.00 0.00 72.50 73.22 2dn6 s THR 25 CO 0.46 0.06 1.56 -0.70 -0.54 0.00 0.00 174.62 175.47 2dn6 s GLU 26 N 0.95 4.22 -0.07 3.99 2.12 -1.26 -2.30 118.70 126.34 2dn6 s GLU 26 Ca -0.07 2.34 -0.08 0.00 0.36 0.00 0.00 54.97 57.52 2dn6 s GLU 26 Cb -0.10 -3.18 0.02 0.00 0.26 0.00 0.00 34.13 31.13 2dn6 s GLU 26 CO -0.04 -0.60 0.20 1.03 -0.54 0.00 0.00 175.26 175.31 2dn6 s ARG 27 N 1.21 0.28 0.21 4.30 1.81 0.14 -4.94 118.95 121.97 2dn6 s ARG 27 Ca 0.70 0.20 -0.30 0.00 -1.72 0.00 0.00 55.73 54.61 2dn6 s ARG 27 Cb -0.43 0.13 -0.08 0.00 -0.45 0.00 0.00 34.95 34.12 2dn6 s ARG 27 CO 0.31 -0.04 1.10 -0.46 -0.68 0.00 0.00 175.30 175.53 2dn6 s TRP 28 N -0.09 3.60 0.03 -0.53 -0.11 -0.75 -0.61 118.94 120.48 2dn6 s TRP 28 Ca -0.02 1.64 0.07 0.00 1.22 0.00 0.00 56.10 59.01 2dn6 s TRP 28 Cb -0.02 -3.27 -0.02 0.00 -1.50 0.00 0.00 33.47 28.65 2dn6 s TRP 28 CO 0.01 -0.57 -0.21 -0.06 -4.62 0.00 0.00 176.95 171.50 2dn6 s PHE 29 N -0.55 1.85 -0.34 5.86 0.40 -1.12 -0.68 117.98 123.39 2dn6 s PHE 29 Ca 0.48 -0.37 0.02 0.00 -0.60 0.00 0.00 56.93 56.45 2dn6 s PHE 29 Cb -0.30 -1.12 0.10 0.00 0.51 0.00 0.00 43.02 42.21 2dn6 s PHE 29 CO 0.37 0.07 0.09 0.08 0.70 0.00 0.00 175.22 176.53 2dn6 s VAL 30 N -0.74 1.66 -0.58 -0.44 1.01 0.34 -3.19 120.40 118.44 2dn6 s VAL 30 Ca 0.08 -2.03 -0.27 0.00 0.00 0.00 0.00 61.98 59.75 2dn6 s VAL 30 Cb -0.09 -2.22 0.01 0.00 0.00 0.00 0.00 36.38 34.08 2dn6 s VAL 30 CO 0.01 -0.66 1.52 -0.22 0.00 0.00 0.00 175.10 175.75 2dn6 s LEU 31 N 1.09 3.35 0.55 3.92 2.96 -0.28 -1.88 118.68 128.38 2dn6 s LEU 31 Ca 0.11 0.26 -0.06 0.00 -0.22 0.00 0.00 54.13 54.22 2dn6 s LEU 31 Cb -0.19 -2.89 -0.01 0.00 0.50 0.00 0.00 46.19 43.60 2dn6 s LEU 31 CO -0.14 -1.88 0.86 -0.54 -1.32 0.00 0.00 176.35 173.33 2dn6 s LYS 32 N 5.90 3.17 0.42 1.98 -0.14 0.77 0.17 119.74 132.00 2dn6 s LYS 32 Ca 0.55 0.08 0.21 0.00 -1.36 0.00 0.00 55.97 55.45 2dn6 s LYS 32 Cb -0.12 -2.31 0.90 0.00 -1.68 0.00 0.00 37.83 34.63 2dn6 s LYS 32 CO 0.23 -0.51 1.84 -1.00 -0.76 0.00 0.00 175.35 175.15 2dn6 h PRO 33 N -0.03 0.00 0.00 -1.68 0.13 -1.95 -3.25 132.00 125.23 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 1.24 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.17 2dn6 h PRO 33 CO 0.61 0.29 -0.73 0.09 -0.23 0.00 0.00 178.00 178.03 2dn6 n ASN 34 N -3.62 0.99 0.00 1.44 4.13 -1.26 -4.88 115.26 112.06 2dn6 n ASN 34 Ca -0.01 -2.41 0.00 0.00 1.68 0.00 0.00 54.58 53.84 2dn6 n ASN 34 Cb 0.42 -0.33 0.00 0.00 -1.54 0.00 0.00 39.78 38.33 2dn6 n ASN 34 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2dn6 n ILE 35 N -0.05 0.00 -3.39 2.41 3.06 -1.23 -4.21 119.36 115.95 2dn6 n ILE 35 Ca 0.08 0.00 -0.14 0.00 -2.50 0.00 0.00 62.75 60.19 2dn6 n ILE 35 Cb 0.92 0.00 -0.09 0.00 0.54 0.00 0.00 39.64 41.01 2dn6 n ILE 35 CO 0.00 0.00 0.00 -0.63 -2.50 0.00 0.00 176.55 173.42 2dn6 s ILE 36 N -2.00 -0.48 -0.02 9.51 1.01 -1.11 -0.16 121.20 127.95 2dn6 s ILE 36 Ca 0.00 -0.26 0.05 0.00 0.00 0.00 0.00 60.65 60.45 2dn6 s ILE 36 Cb 0.00 -0.87 -0.03 0.00 0.01 0.00 0.00 42.46 41.57 2dn6 s ILE 36 CO 0.00 -0.28 -0.18 -0.44 0.00 0.00 0.00 174.94 174.04 2dn6 s SER 37 N 2.44 3.78 -0.08 3.58 0.01 -0.79 -0.93 113.70 121.71 2dn6 s SER 37 Ca 0.10 -0.32 0.03 0.00 1.31 0.00 0.00 55.95 57.08 2dn6 s SER 37 Cb -0.14 -0.68 0.00 0.00 0.21 0.00 0.00 66.02 65.41 2dn6 s SER 37 CO -0.23 0.31 -0.20 -0.72 0.41 0.00 0.00 173.24 172.81 2dn6 s TYR 38 N -0.77 2.14 -0.03 2.43 1.13 -1.13 0.12 117.35 121.24 2dn6 s TYR 38 Ca 0.12 -0.84 -0.03 0.00 -1.41 0.00 0.00 57.07 54.91 2dn6 s TYR 38 Cb -0.10 -1.46 -0.04 0.00 -1.10 0.00 0.00 41.96 39.26 2dn6 s TYR 38 CO 0.02 -0.36 0.15 0.71 -2.51 0.00 0.00 175.55 173.57 2dn6 s TYR 39 N 0.44 3.51 0.60 -3.49 1.51 0.14 0.24 117.35 120.30 2dn6 s TYR 39 Ca -0.17 0.37 0.29 0.00 -1.01 0.00 0.00 57.07 56.55 2dn6 s TYR 39 Cb -0.17 -1.84 1.50 0.00 -0.11 0.00 0.00 41.96 41.35 2dn6 s TYR 39 CO 0.07 0.65 1.91 -0.24 -1.11 0.00 0.00 175.55 176.83 2dn6 h VAL 40 N 3.15 0.34 -3.95 0.71 3.04 -1.62 -2.00 116.25 115.90 2dn6 h VAL 40 Ca -0.50 0.00 -0.34 0.00 -1.01 0.00 0.00 66.70 64.85 2dn6 h VAL 40 Cb 1.20 0.64 -0.14 0.00 -2.01 0.00 0.00 31.29 30.97 2dn6 h VAL 40 CO 0.65 0.00 -0.61 -0.94 -1.01 0.00 0.00 177.57 175.67 2dn6 s SER 41 N -5.18 1.03 -0.12 3.17 1.04 -1.26 -4.36 113.70 108.02 2dn6 s SER 41 Ca -0.04 -1.41 0.02 0.00 0.48 0.00 0.00 55.95 55.00 2dn6 s SER 41 Cb 0.15 0.23 0.20 0.00 0.10 0.00 0.00 66.02 66.70 2dn6 s SER 41 CO 0.52 -0.77 1.19 -1.84 0.98 0.00 0.00 173.24 173.32 2dn6 n GLU 42 N -0.44 1.50 -0.05 4.02 0.28 -1.26 -3.57 120.64 121.12 2dn6 n GLU 42 Ca 0.01 -0.88 -0.02 0.00 -0.16 0.00 0.00 57.16 56.10 2dn6 n GLU 42 Cb 0.66 -1.41 -0.11 0.00 1.43 0.00 0.00 31.44 32.01 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 0.05 1.61 -1.27 -1.84 -0.08 -1.26 -5.02 116.55 108.74 2dn6 n ASP 43 Ca 0.16 0.00 -0.07 0.00 -1.51 0.00 0.00 54.79 53.37 2dn6 n ASP 43 Cb 0.78 1.10 0.02 0.00 2.34 0.00 0.00 41.12 45.37 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 -2.35 -2.19 -0.08 -2.67 4.77 -1.23 -4.96 117.00 108.28 2dn6 n LEU 44 Ca -0.16 -0.13 -0.13 0.00 -0.03 0.00 0.00 56.01 55.56 2dn6 n LEU 44 Cb 0.77 -1.25 -0.07 0.00 -2.33 0.00 0.00 43.42 40.55 2dn6 n LEU 44 CO 0.30 0.14 -1.03 0.29 -1.33 0.00 0.00 177.39 175.76 2dn6 n LYS 45 N -1.79 0.38 -3.69 3.23 5.02 -1.26 -4.82 118.16 115.24 2dn6 n LYS 45 Ca -0.01 0.11 -0.35 0.00 -2.02 0.00 0.00 58.31 56.04 2dn6 n LYS 45 Cb 0.53 -1.26 -0.08 0.00 -0.02 0.00 0.00 35.03 34.20 2dn6 n LYS 45 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2dn6 s ASP 46 N -5.80 5.74 0.27 4.39 1.11 -1.26 -5.07 116.67 116.05 2dn6 s ASP 46 Ca -0.22 -3.66 -0.31 0.00 0.18 0.00 0.00 52.55 48.55 2dn6 s ASP 46 Cb 0.06 -1.86 -0.12 0.00 1.07 0.00 0.00 42.92 42.08 2dn6 s ASP 46 CO 0.35 -0.19 1.64 -0.75 1.18 0.00 0.00 175.17 177.40 2dn6 s LYS 47 N -1.24 4.11 0.01 8.23 2.20 -1.26 -1.84 119.74 129.95 2dn6 s LYS 47 Ca 0.26 2.61 -0.14 0.00 -0.36 0.00 0.00 55.97 58.33 2dn6 s LYS 47 Cb -0.08 -3.03 -0.34 0.00 -1.51 0.00 0.00 37.83 32.86 2dn6 s LYS 47 CO -0.12 -0.68 0.92 0.87 -0.36 0.00 0.00 175.35 175.98 2dn6 h LYS 48 N 5.37 0.50 0.00 4.03 1.79 -0.53 -3.45 116.57 124.28 2dn6 h LYS 48 Ca -0.46 -0.86 0.00 0.00 -2.18 0.00 0.00 60.65 57.15 2dn6 h LYS 48 Cb 1.21 0.32 0.00 0.00 -1.58 0.00 0.00 32.23 32.18 2dn6 h LYS 48 CO 0.84 1.41 0.00 0.41 -1.08 0.00 0.00 179.45 181.03 2dn6 n GLY 49 N 1.75 -1.28 3.17 3.86 0.00 -1.19 -5.02 105.19 106.48 2dn6 n GLY 49 Ca -0.19 -1.02 -0.16 0.00 0.00 0.00 0.00 46.02 44.65 2dn6 n GLY 49 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dn6 s ASP 50 N -0.43 1.53 -0.36 1.61 1.11 -1.26 -2.83 116.67 116.04 2dn6 s ASP 50 Ca 0.00 -0.73 0.01 0.00 0.18 0.00 0.00 52.55 52.02 2dn6 s ASP 50 Cb 0.00 -0.02 0.11 0.00 1.07 0.00 0.00 42.92 44.08 2dn6 s ASP 50 CO 0.00 -0.19 0.13 -0.63 1.18 0.00 0.00 175.17 175.67 2dn6 s ILE 51 N -1.95 1.44 -0.40 0.77 1.01 -0.11 -4.98 121.20 116.99 2dn6 s ILE 51 Ca 0.02 -2.04 -0.29 0.00 0.00 0.00 0.00 60.65 58.34 2dn6 s ILE 51 Cb -0.06 -2.06 -0.08 0.00 0.01 0.00 0.00 42.46 40.27 2dn6 s ILE 51 CO 0.01 -0.72 2.32 0.18 0.00 0.00 0.00 174.94 176.73 2dn6 n LEU 52 N 4.26 2.45 -4.76 2.97 4.77 -1.26 -2.76 117.00 122.66 2dn6 n LEU 52 Ca 0.03 -0.01 -0.41 0.00 -0.03 0.00 0.00 56.01 55.59 2dn6 n LEU 52 Cb 0.39 -1.45 -0.03 0.00 -2.33 0.00 0.00 43.42 40.00 2dn6 n LEU 52 CO 0.19 -1.02 0.92 -0.76 -1.33 0.00 0.00 177.39 175.39 2dn6 s LEU 53 N 9.55 4.46 -0.19 2.23 1.43 -1.26 -4.93 118.68 129.97 2dn6 s LEU 53 Ca 1.05 2.55 -0.27 0.00 -1.03 0.00 0.00 54.13 56.42 2dn6 s LEU 53 Cb -0.47 -3.64 0.08 0.00 0.03 0.00 0.00 46.19 42.19 2dn6 s LEU 53 CO 0.36 -0.42 0.76 -1.81 0.23 0.00 0.00 176.35 175.48 2dn6 s ASP 54 N -0.55 -0.66 0.30 2.29 1.01 -1.26 -4.91 116.67 112.89 2dn6 s ASP 54 Ca 0.48 1.07 0.19 0.00 0.71 0.00 0.00 52.55 55.01 2dn6 s ASP 54 Cb -0.37 1.02 1.04 0.00 1.01 0.00 0.00 42.92 45.62 2dn6 s ASP 54 CO 0.48 -0.36 1.15 -1.84 0.21 0.00 0.00 175.17 174.81 2dn6 n GLU 55 N 1.92 -0.04 0.24 8.23 0.00 -1.26 0.14 120.64 129.87 2dn6 n GLU 55 Ca -0.15 0.97 -0.15 0.00 0.00 0.00 0.00 57.16 57.82 2dn6 n GLU 55 Cb 0.56 -1.81 -0.08 0.00 0.00 0.00 0.00 31.44 30.11 2dn6 n GLU 55 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.13 176.22 2dn6 h ASN 56 N 0.00 -0.50 -4.03 -1.84 4.21 -1.95 -3.43 115.58 108.03 2dn6 h ASN 56 Ca 0.63 0.02 -0.55 0.00 1.21 0.00 0.00 56.30 57.62 2dn6 h ASN 56 Cb 1.86 0.14 0.13 0.00 -1.12 0.00 0.00 38.32 39.32 2dn6 h ASN 56 CO -0.46 -0.35 0.62 0.00 -1.29 0.00 0.00 177.43 175.96 2dn6 s VAL 59 N -3.77 4.07 0.29 0.00 0.11 -1.26 0.04 120.40 119.88 2dn6 s VAL 59 Ca 0.02 -0.85 0.03 0.00 -2.93 0.00 0.00 61.98 58.25 2dn6 s VAL 59 Cb -0.01 -2.90 -0.04 0.00 -1.53 0.00 0.00 36.38 31.90 2dn6 s VAL 59 CO -0.11 0.21 0.18 -1.61 -3.33 0.00 0.00 175.10 170.44 2dn6 s GLU 60 N -2.05 1.54 -0.15 1.54 2.02 0.11 -4.96 118.70 116.76 2dn6 s GLU 60 Ca 0.24 -1.87 -0.02 0.00 0.02 0.00 0.00 54.97 53.34 2dn6 s GLU 60 Cb -0.12 0.10 -0.02 0.00 0.10 0.00 0.00 34.13 34.20 2dn6 s GLU 60 CO 0.16 -0.49 -0.09 0.45 0.02 0.00 0.00 175.26 175.30 2dn6 s SER 61 N -3.32 4.24 0.03 -0.19 0.15 -1.26 -2.05 113.70 111.30 2dn6 s SER 61 Ca 0.38 -0.29 -0.01 0.00 0.70 0.00 0.00 55.95 56.73 2dn6 s SER 61 Cb 0.05 -1.67 -0.04 0.00 -1.71 0.00 0.00 66.02 62.64 2dn6 s SER 61 CO 0.19 0.13 0.17 -0.76 1.20 0.00 0.00 173.24 174.18 2dn6 s LEU 62 N 0.55 4.26 0.00 3.45 1.43 -1.15 -4.91 118.68 122.32 2dn6 s LEU 62 Ca -0.06 0.26 0.00 0.00 -1.03 0.00 0.00 54.13 53.30 2dn6 s LEU 62 Cb -0.15 -2.70 0.00 0.00 0.03 0.00 0.00 46.19 43.36 2dn6 s LEU 62 CO 0.03 0.22 0.00 -0.81 0.23 0.00 0.00 176.35 176.02 2dn6 n PRO 63 N 0.66 -0.08 -2.35 1.29 -0.04 -1.26 -4.03 135.00 129.18 2dn6 n PRO 63 Ca -0.08 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.96 2dn6 n PRO 63 Cb 0.52 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.95 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 6.10 -0.01 3.54 1.47 -1.26 -4.66 116.67 120.35 2dn6 s ASP 64 Ca 0.00 0.41 0.04 0.00 1.18 0.00 0.00 52.55 54.18 2dn6 s ASP 64 Cb 0.00 -2.54 -0.03 0.00 -0.34 0.00 0.00 42.92 40.01 2dn6 s ASP 64 CO 0.00 -1.70 -0.10 -0.75 0.68 0.00 0.00 175.17 173.30 2dn6 s LYS 65 N 5.51 2.48 -0.78 2.11 2.20 -1.26 -4.60 119.74 125.39 2dn6 s LYS 65 Ca 0.56 -0.75 -0.10 0.00 -0.36 0.00 0.00 55.97 55.32 2dn6 s LYS 65 Cb -0.12 -2.43 0.10 0.00 -1.51 0.00 0.00 37.83 33.87 2dn6 s LYS 65 CO 0.26 0.60 0.25 -0.25 -0.36 0.00 0.00 175.35 175.85 2dn6 n ASP 66 N 1.75 -1.34 -1.98 1.43 9.92 -1.26 -1.79 116.55 123.28 2dn6 n ASP 66 Ca -0.16 -0.23 -0.00 0.00 -0.53 0.00 0.00 54.79 53.87 2dn6 n ASP 66 Cb 0.52 -1.25 0.00 0.00 -0.64 0.00 0.00 41.12 39.76 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 -0.73 -0.63 3.62 0.44 0.00 -1.26 -5.09 105.19 101.53 2dn6 n GLY 67 Ca 0.05 0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.81 2.04 0.00 1.61 -0.14 -0.74 -5.08 119.74 114.61 2dn6 s LYS 68 Ca 0.01 -2.27 0.00 0.00 -1.36 0.00 0.00 55.97 52.35 2dn6 s LYS 68 Cb -0.00 -1.01 0.00 0.00 -1.68 0.00 0.00 37.83 35.14 2dn6 s LYS 68 CO 0.23 -0.42 0.00 0.36 -0.76 0.00 0.00 175.35 174.76 2dn6 n LYS 69 N -1.05 0.00 -3.73 1.68 0.00 -1.26 -4.65 118.16 109.14 2dn6 n LYS 69 Ca -0.11 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 57.90 2dn6 n LYS 69 Cb 0.66 -0.65 -0.14 0.00 -0.00 0.00 0.00 35.03 34.90 2dn6 n LYS 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2dn6 s LEU 71 N 1.12 3.05 -0.29 0.00 1.43 -1.26 -1.19 118.68 121.54 2dn6 s LEU 71 Ca 0.13 -0.84 -0.18 0.00 -1.03 0.00 0.00 54.13 52.21 2dn6 s LEU 71 Cb -0.20 -1.51 0.16 0.00 0.03 0.00 0.00 46.19 44.67 2dn6 s LEU 71 CO -0.14 -0.13 1.06 0.72 0.23 0.00 0.00 176.35 178.09 2dn6 s PHE 72 N -2.43 -0.44 0.17 0.29 -0.12 -0.89 -2.92 117.98 111.63 2dn6 s PHE 72 Ca 0.33 0.92 0.09 0.00 -0.05 0.00 0.00 56.93 58.22 2dn6 s PHE 72 Cb -0.03 0.31 -0.04 0.00 -0.63 0.00 0.00 43.02 42.62 2dn6 s PHE 72 CO 0.19 -0.22 -0.19 -1.17 -0.05 0.00 0.00 175.22 173.79 2dn6 s LEU 73 N 1.04 2.45 -0.13 -1.99 0.20 -0.87 -1.82 118.68 117.56 2dn6 s LEU 73 Ca -0.06 -0.87 0.01 0.00 0.69 0.00 0.00 54.13 53.90 2dn6 s LEU 73 Cb -0.04 -0.88 -0.00 0.00 -0.43 0.00 0.00 46.19 44.83 2dn6 s LEU 73 CO -0.13 -0.01 -0.18 -0.69 -0.29 0.00 0.00 176.35 175.05 2dn6 s VAL 74 N -2.03 2.56 -0.13 1.68 1.01 0.69 0.10 120.40 124.28 2dn6 s VAL 74 Ca 0.17 -0.83 -0.10 0.00 0.00 0.00 0.00 61.98 61.22 2dn6 s VAL 74 Cb -0.06 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.23 2dn6 s VAL 74 CO 0.07 0.53 0.21 -0.54 0.00 0.00 0.00 175.10 175.38 2dn6 s LYS 75 N 0.50 3.86 0.38 2.72 3.01 0.11 -1.81 119.74 128.51 2dn6 s LYS 75 Ca -0.12 -0.03 0.04 0.00 -1.01 0.00 0.00 55.97 54.85 2dn6 s LYS 75 Cb -0.16 -3.30 -0.03 0.00 -1.01 0.00 0.00 37.83 33.33 2dn6 s LYS 75 CO 0.05 0.54 0.13 0.00 0.51 0.00 0.00 175.35 176.57 2dn6 n PHE 77 N -0.84 0.00 0.00 0.00 3.72 -1.26 -4.03 117.46 115.05 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 39.07 2dn6 n PHE 77 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2dn6 n ASP 78 N -1.62 3.91 -4.88 4.37 2.03 -1.26 -5.06 116.55 114.04 2dn6 n ASP 78 Ca 0.00 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 55.01 2dn6 n ASP 78 Cb 0.00 0.64 -0.03 0.00 -0.72 0.00 0.00 41.12 41.00 2dn6 n ASP 78 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 2dn6 s LYS 79 N -1.65 3.77 -0.01 -0.67 -2.85 -1.26 -5.10 119.74 111.98 2dn6 s LYS 79 Ca 0.00 0.40 0.02 0.00 -1.00 0.00 0.00 55.97 55.39 2dn6 s LYS 79 Cb 0.00 -2.44 -0.01 0.00 -2.06 0.00 0.00 37.83 33.32 2dn6 s LYS 79 CO 0.00 0.03 -0.08 0.95 0.10 0.00 0.00 175.35 176.35 2dn6 s THR 80 N -2.29 0.60 -0.18 3.79 -4.23 -1.26 -2.02 115.64 110.05 2dn6 s THR 80 Ca 0.50 -0.32 0.01 0.00 -1.18 0.00 0.00 61.69 60.70 2dn6 s THR 80 Cb -0.10 -0.51 0.03 0.00 1.34 0.00 0.00 72.50 73.26 2dn6 s THR 80 CO 0.30 0.17 -0.14 -0.36 -0.54 0.00 0.00 174.62 174.05 2dn6 s PHE 81 N -0.17 2.51 -0.22 3.99 0.40 -0.75 -5.02 117.98 118.72 2dn6 s PHE 81 Ca 0.03 -1.56 -0.08 0.00 -0.60 0.00 0.00 56.93 54.72 2dn6 s PHE 81 Cb -0.03 -1.72 -0.04 0.00 0.51 0.00 0.00 43.02 41.74 2dn6 s PHE 81 CO -0.00 -0.75 0.09 -2.00 0.70 0.00 0.00 175.22 173.25 2dn6 s GLU 82 N 1.37 3.86 0.09 0.44 2.12 -1.26 -0.22 118.70 125.11 2dn6 s GLU 82 Ca 0.01 -0.39 0.04 0.00 0.36 0.00 0.00 54.97 55.00 2dn6 s GLU 82 Cb -0.15 -3.33 -0.03 0.00 0.26 0.00 0.00 34.13 30.88 2dn6 s GLU 82 CO -0.10 0.04 -0.11 0.42 -0.54 0.00 0.00 175.26 174.98 2dn6 s ILE 83 N 1.03 0.96 -0.06 -3.70 1.01 -0.75 -2.07 121.20 117.62 2dn6 s ILE 83 Ca 0.05 -1.59 0.03 0.00 0.00 0.00 0.00 60.65 59.13 2dn6 s ILE 83 Cb -0.14 -1.31 0.01 0.00 0.01 0.00 0.00 42.46 41.03 2dn6 s ILE 83 CO 0.03 -0.51 -0.13 -0.55 0.00 0.00 0.00 174.94 173.78 2dn6 s SER 84 N -2.35 1.82 0.39 3.58 0.15 0.18 -2.09 113.70 115.38 2dn6 s SER 84 Ca 0.04 -0.30 0.02 0.00 0.70 0.00 0.00 55.95 56.41 2dn6 s SER 84 Cb -0.04 -0.72 -0.02 0.00 -1.71 0.00 0.00 66.02 63.54 2dn6 s SER 84 CO 0.00 0.07 0.58 0.00 1.20 0.00 0.00 173.24 175.10 2dn6 s ALA 85 N 0.44 3.82 -0.20 5.45 0.00 -0.33 -2.61 121.76 128.33 2dn6 s ALA 85 Ca -0.10 -1.08 -0.15 0.00 0.00 0.00 0.00 51.96 50.62 2dn6 s ALA 85 Cb -0.14 -2.03 -0.10 0.00 0.00 0.00 0.00 23.12 20.85 2dn6 s ALA 85 CO 0.03 -0.17 -0.15 0.45 0.00 0.00 0.00 175.76 175.92 2dn6 n SER 86 N -1.87 1.88 -4.71 0.00 2.88 -1.26 -4.43 113.62 106.10 2dn6 n SER 86 Ca -0.02 0.45 -0.28 0.00 -1.33 0.00 0.00 58.87 57.69 2dn6 n SER 86 Cb 0.57 -0.86 -0.07 0.00 -0.75 0.00 0.00 64.21 63.10 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 -6.45 5.09 0.22 -3.46 1.11 -1.26 -4.78 116.67 107.13 2dn6 s ASP 87 Ca -0.27 -0.23 -0.08 0.00 0.18 0.00 0.00 52.55 52.15 2dn6 s ASP 87 Cb 0.06 -1.21 0.31 0.00 1.07 0.00 0.00 42.92 43.15 2dn6 s ASP 87 CO 0.42 0.12 1.77 0.11 1.18 0.00 0.00 175.17 178.77 2dn6 h LYS 88 N 2.93 0.52 -0.48 8.23 1.57 -1.97 -1.40 116.57 125.98 2dn6 h LYS 88 Ca -0.47 -0.03 0.09 0.00 -1.87 0.00 0.00 60.65 58.37 2dn6 h LYS 88 Cb 1.19 -0.12 -0.09 0.00 0.08 0.00 0.00 32.23 33.29 2dn6 h LYS 88 CO 0.60 0.34 -0.07 -0.22 -0.57 0.00 0.00 179.45 179.53 2dn6 h LYS 89 N 0.53 0.04 0.43 3.15 3.64 -1.99 -1.20 116.57 121.17 2dn6 h LYS 89 Ca 0.33 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.69 2dn6 h LYS 89 Cb 0.36 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2dn6 h LYS 89 CO -0.27 0.03 -0.21 0.87 -2.27 0.00 0.00 179.45 177.60 2dn6 h LYS 90 N 0.04 -0.55 -0.32 1.90 1.57 -1.78 -0.18 116.57 117.25 2dn6 h LYS 90 Ca 0.23 0.04 0.03 0.00 -1.87 0.00 0.00 60.65 59.09 2dn6 h LYS 90 Cb 0.36 0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.74 2dn6 h LYS 90 CO -0.46 -0.29 -0.31 -0.22 -0.57 0.00 0.00 179.45 177.60 2dn6 h LYS 91 N -0.73 -0.15 0.33 3.15 3.11 -0.85 0.34 116.57 121.78 2dn6 h LYS 91 Ca -0.06 0.01 -0.01 0.00 -2.81 0.00 0.00 60.65 57.78 2dn6 h LYS 91 Cb 0.52 0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 31.78 2dn6 h LYS 91 CO 0.10 -0.10 -0.22 0.37 -2.81 0.00 0.00 179.45 176.79 2dn6 h GLN 92 N -0.15 -0.50 -0.86 1.90 4.15 -1.28 -1.21 115.11 117.15 2dn6 h GLN 92 Ca 0.05 0.03 0.27 0.00 0.77 0.00 0.00 58.65 59.77 2dn6 h GLN 92 Cb 0.29 0.11 -0.16 0.00 0.21 0.00 0.00 27.48 27.94 2dn6 h GLN 92 CO -0.38 -0.33 0.12 0.39 -1.93 0.00 0.00 178.83 176.70 2dn6 n GLU 93 N -3.64 -0.06 0.40 1.69 -0.58 -0.08 -0.22 120.64 118.14 2dn6 n GLU 93 Ca -0.06 1.27 -0.17 0.00 -0.42 0.00 0.00 57.16 57.78 2dn6 n GLU 93 Cb 0.22 -2.08 -0.08 0.00 -0.57 0.00 0.00 31.44 28.93 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 -0.95 -0.68 -0.32 4.06 -0.04 0.81 115.95 118.83 2dn6 h TRP 94 Ca 0.57 -0.02 0.13 0.00 2.06 0.00 0.00 58.89 61.63 2dn6 h TRP 94 Cb 1.28 0.32 -0.10 0.00 -1.00 0.00 0.00 29.16 29.66 2dn6 h TRP 94 CO -0.34 -0.58 0.18 0.82 -3.56 0.00 0.00 178.44 174.96 2dn6 h ILE 95 N -1.22 0.60 -0.03 1.49 2.04 0.65 0.78 117.51 121.82 2dn6 h ILE 95 Ca -0.11 -0.10 -0.00 0.00 1.00 0.00 0.00 64.86 65.65 2dn6 h ILE 95 Cb 0.80 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 2dn6 h ILE 95 CO 0.17 0.05 0.01 1.56 0.00 0.00 0.00 178.15 179.95 2dn6 h GLN 96 N 0.30 0.04 -0.73 2.37 4.20 -0.57 0.13 115.11 120.84 2dn6 h GLN 96 Ca 0.37 -0.01 0.08 0.00 0.06 0.00 0.00 58.65 59.15 2dn6 h GLN 96 Cb 0.58 -0.01 -0.07 0.00 0.30 0.00 0.00 27.48 28.29 2dn6 h GLN 96 CO -0.44 0.20 0.39 0.00 -0.67 0.00 0.00 178.83 178.31 2dn6 h ALA 97 N 0.84 1.01 0.11 3.87 0.00 0.07 -2.12 119.26 123.04 2dn6 h ALA 97 Ca 0.01 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2dn6 h ALA 97 Cb 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2dn6 h ALA 97 CO -0.00 0.03 -0.05 0.82 0.00 0.00 0.00 179.25 180.05 2dn6 h ILE 98 N 0.69 1.10 -0.60 0.00 2.04 -0.73 -2.50 117.51 117.50 2dn6 h ILE 98 Ca 0.35 -0.97 0.06 0.00 1.00 0.00 0.00 64.86 65.30 2dn6 h ILE 98 Cb 0.31 1.70 -0.10 0.00 -0.74 0.00 0.00 36.82 37.99 2dn6 h ILE 98 CO -0.23 0.23 -0.56 -0.74 0.00 0.00 0.00 178.15 176.84 2dn6 h HIS 99 N -0.61 -1.75 -0.52 1.37 2.76 -0.47 -0.04 115.15 115.89 2dn6 h HIS 99 Ca -0.01 0.10 0.06 0.00 -2.20 0.00 0.00 60.37 58.31 2dn6 h HIS 99 Cb 0.48 0.84 -0.05 0.00 1.55 0.00 0.00 27.41 30.24 2dn6 h HIS 99 CO 0.07 -0.45 0.23 0.77 -1.30 0.00 0.00 177.93 177.25 2dn6 h SER 100 N -0.27 0.29 -0.90 3.26 0.02 -1.48 -1.81 113.55 112.67 2dn6 h SER 100 Ca 0.11 0.04 0.24 0.00 -0.84 0.00 0.00 61.79 61.34 2dn6 h SER 100 Cb 0.54 -0.00 -0.13 0.00 0.14 0.00 0.00 62.40 62.94 2dn6 h SER 100 CO -0.71 0.20 0.36 0.74 -1.14 0.00 0.00 176.83 176.28 2dn6 h THR 101 N 0.44 0.39 -0.27 -2.27 2.02 -0.56 0.17 112.91 112.84 2dn6 h THR 101 Ca 0.24 -0.11 -0.18 0.00 0.77 0.00 0.00 66.41 67.13 2dn6 h THR 101 Cb 0.21 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.66 2dn6 h THR 101 CO -0.20 0.06 -0.55 0.40 0.37 0.00 0.00 175.52 175.59 2dn6 h ILE 102 N 0.32 1.28 -0.88 3.11 2.04 -0.51 -3.19 117.51 119.68 2dn6 h ILE 102 Ca 0.58 -1.74 0.21 0.00 1.00 0.00 0.00 64.86 64.91 2dn6 h ILE 102 Cb 1.17 1.69 -0.12 0.00 -0.74 0.00 0.00 36.82 38.82 2dn6 h ILE 102 CO -0.59 0.56 0.39 -0.74 0.00 0.00 0.00 178.15 177.78 2dn6 h HIS 103 N 0.61 0.65 -0.74 1.37 2.76 -0.08 0.38 115.15 120.10 2dn6 h HIS 103 Ca 0.01 0.04 0.11 0.00 -2.20 0.00 0.00 60.37 58.32 2dn6 h HIS 103 Cb 1.16 -0.15 -0.05 0.00 1.55 0.00 0.00 27.41 29.93 2dn6 h HIS 103 CO 0.08 -0.02 0.49 -0.07 -1.30 0.00 0.00 177.93 177.11 2dn6 h LEU 104 N 0.42 0.54 -0.44 0.26 3.38 -1.42 -0.85 115.31 117.20 2dn6 h LEU 104 Ca 0.54 0.02 -0.17 0.00 0.09 0.00 0.00 57.88 58.36 2dn6 h LEU 104 Cb 0.99 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.64 2dn6 h LEU 104 CO -0.51 0.31 -0.56 -0.07 0.09 0.00 0.00 178.44 177.71 2dn6 h LEU 105 N 0.59 0.72 -0.74 1.67 3.38 -0.37 -3.17 115.31 117.40 2dn6 h LEU 105 Ca 0.35 -0.39 0.10 0.00 0.09 0.00 0.00 57.88 58.03 2dn6 h LEU 105 Cb 0.56 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 41.02 2dn6 h LEU 105 CO -0.12 1.13 0.36 0.11 0.09 0.00 0.00 178.44 180.01 2dn6 h LYS 106 N 0.50 0.58 -0.61 1.13 1.57 -0.63 -2.17 116.57 116.93 2dn6 h LYS 106 Ca 0.01 -0.03 0.12 0.00 -1.87 0.00 0.00 60.65 58.87 2dn6 h LYS 106 Cb 1.13 -0.13 -0.12 0.00 0.08 0.00 0.00 32.23 33.19 2dn6 h LYS 106 CO 0.11 0.38 -0.26 -0.07 -0.57 0.00 0.00 179.45 179.05 2dn6 h LEU 107 N 0.60 -0.90 -8.48 2.94 -0.00 -1.48 -3.34 115.31 104.64 2dn6 h LEU 107 Ca 0.37 0.21 -0.71 0.00 -0.00 0.00 0.00 57.88 57.75 2dn6 h LEU 107 Cb 0.42 0.50 -0.22 0.00 -0.00 0.00 0.00 40.66 41.36 2dn6 h LEU 107 CO -0.29 -0.27 -0.47 -0.83 -0.00 0.00 0.00 178.44 176.58 2dn6 s GLY 108 N -3.33 1.97 -0.28 0.83 0.00 -0.82 -5.03 107.32 100.67 2dn6 s GLY 108 Ca -0.14 -1.67 -0.18 0.00 0.00 0.00 0.00 44.72 42.73 2dn6 s GLY 108 CO 0.71 0.87 0.70 -0.56 0.00 0.00 0.00 173.10 174.82 2dn6 s SER 109 N 1.64 -0.90 -0.10 1.64 0.01 -1.26 -4.88 113.70 109.86 2dn6 s SER 109 Ca 0.04 1.50 0.03 0.00 1.31 0.00 0.00 55.95 58.83 2dn6 s SER 109 Cb -0.19 1.41 0.00 0.00 0.21 0.00 0.00 66.02 67.45 2dn6 s SER 109 CO 0.09 -0.24 -0.21 -0.55 0.41 0.00 0.00 173.24 172.73 2dn6 s SER 110 N 1.32 2.80 0.00 2.44 0.15 -1.26 -5.05 113.70 114.11 2dn6 s SER 110 Ca -0.08 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.07 2dn6 s SER 110 Cb -0.05 -1.28 0.00 0.00 -1.71 0.00 0.00 66.02 62.98 2dn6 s SER 110 CO -0.15 0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.02 2dn6 n GLY 111 N 3.65 0.37 3.72 9.45 0.00 -1.26 -5.06 105.19 116.06 2dn6 n GLY 111 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 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 4.35 -0.25 1.61 0.04 -1.26 -4.91 135.00 134.58 2dn6 s PRO 112 Ca 0.00 2.04 -0.40 0.00 0.04 0.00 0.00 61.00 62.67 2dn6 s PRO 112 Cb 0.00 -3.24 -0.16 0.00 0.04 0.00 0.00 34.50 31.14 2dn6 s PRO 112 CO 0.00 -0.36 1.68 0.43 0.04 0.00 0.00 177.00 178.78 2dn6 n SER 113 N 3.54 2.16 -0.32 6.66 7.64 -1.26 -4.81 113.62 127.23 2dn6 n SER 113 Ca 0.10 1.09 0.14 0.00 1.01 0.00 0.00 58.87 61.20 2dn6 n SER 113 Cb 0.43 -1.12 0.32 0.00 -1.01 0.00 0.00 64.21 62.83 2dn6 n SER 113 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2dn6 h SER 114 N 6.66 0.52 0.00 6.43 0.87 -2.02 -3.56 113.55 122.44 2dn6 h SER 114 Ca -0.46 0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.23 2dn6 h SER 114 Cb 1.33 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.35 2dn6 h SER 114 CO 0.94 0.09 0.00 0.61 -0.53 0.00 0.00 176.83 177.94