#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 6.53 -4.54 1.61 3.41 -1.26 -4.95 113.62 114.41 2dn6 n SER 2 Ca 0.00 -3.78 -0.41 0.00 -0.26 0.00 0.00 58.87 54.42 2dn6 n SER 2 Cb 0.00 -0.74 -0.03 0.00 -0.26 0.00 0.00 64.21 63.18 2dn6 n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dn6 s SER 3 N -2.45 6.34 0.11 4.04 0.01 -1.26 -4.96 113.70 115.53 2dn6 s SER 3 Ca 0.57 -1.02 0.09 0.00 1.31 0.00 0.00 55.95 56.90 2dn6 s SER 3 Cb 0.46 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 64.11 2dn6 s SER 3 CO -0.07 -1.62 -0.18 -0.83 0.41 0.00 0.00 173.24 170.95 2dn6 s GLY 4 N 4.27 1.68 0.21 3.44 0.00 -1.26 -5.03 107.32 110.62 2dn6 s GLY 4 Ca 0.39 -1.34 -0.10 0.00 0.00 0.00 0.00 44.72 43.67 2dn6 s GLY 4 CO 0.02 -1.32 1.73 1.76 0.00 0.00 0.00 173.10 175.29 2dn6 h SER 5 N 3.81 0.12 -1.28 1.64 0.02 -1.94 -3.44 113.55 112.49 2dn6 h SER 5 Ca -0.50 0.09 -0.45 0.00 -0.84 0.00 0.00 61.79 60.10 2dn6 h SER 5 Cb 1.17 0.10 0.12 0.00 0.14 0.00 0.00 62.40 63.93 2dn6 h SER 5 CO 0.46 0.07 -0.73 -1.54 -1.14 0.00 0.00 176.83 173.95 2dn6 n SER 6 N -5.06 -2.23 0.18 3.07 3.41 -1.26 -4.84 113.62 106.89 2dn6 n SER 6 Ca 0.09 0.56 -0.15 0.00 -0.26 0.00 0.00 58.87 59.11 2dn6 n SER 6 Cb 0.30 -0.64 -0.08 0.00 -0.26 0.00 0.00 64.21 63.53 2dn6 n SER 6 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2dn6 h GLY 7 N 0.18 -1.18 -4.16 5.00 0.00 -2.00 -3.43 103.07 97.48 2dn6 h GLY 7 Ca -0.28 0.59 -0.54 0.00 0.00 0.00 0.00 47.33 47.10 2dn6 h GLY 7 CO 0.33 -0.33 0.09 1.55 0.00 0.00 0.00 176.54 178.18 2dn6 n VAL 8 N -5.02 0.00 -0.10 4.60 3.14 -1.26 -4.55 118.33 115.14 2dn6 n VAL 8 Ca -0.09 0.00 -0.19 0.00 -2.96 0.00 0.00 64.34 61.10 2dn6 n VAL 8 Cb 0.37 -0.04 -0.10 0.00 -1.06 0.00 0.00 33.84 33.02 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 2.18 0.00 -8.91 6.55 3.38 -0.99 -3.46 115.31 114.07 2dn6 h LEU 9 Ca -0.34 -0.45 -0.60 0.00 0.09 0.00 0.00 57.88 56.58 2dn6 h LEU 9 Cb 0.97 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.53 2dn6 h LEU 9 CO 0.47 1.39 -0.81 -0.75 0.09 0.00 0.00 178.44 178.82 2dn6 s LYS 10 N -2.34 1.38 -0.26 1.13 2.20 -1.16 -4.92 119.74 115.75 2dn6 s LYS 10 Ca -0.27 -1.43 -0.17 0.00 -0.36 0.00 0.00 55.97 53.74 2dn6 s LYS 10 Cb 0.05 -1.62 0.07 0.00 -1.51 0.00 0.00 37.83 34.83 2dn6 s LYS 10 CO 0.54 0.35 0.66 1.14 -0.36 0.00 0.00 175.35 177.68 2dn6 s GLN 11 N -2.57 0.70 -0.01 4.03 -2.07 -1.26 -1.10 119.66 117.39 2dn6 s GLN 11 Ca 0.17 1.11 -0.30 0.00 -1.82 0.00 0.00 55.36 54.52 2dn6 s GLN 11 Cb -0.08 0.19 0.12 0.00 -1.09 0.00 0.00 33.01 32.15 2dn6 s GLN 11 CO 0.08 -0.14 1.28 0.20 -1.32 0.00 0.00 175.29 175.39 2dn6 s GLY 12 N 1.28 -0.38 -0.54 2.60 0.00 -1.17 -5.00 107.32 104.10 2dn6 s GLY 12 Ca -0.07 0.62 -0.25 0.00 0.00 0.00 0.00 44.72 45.02 2dn6 s GLY 12 CO -0.14 0.59 0.96 -0.19 0.00 0.00 0.00 173.10 174.31 2dn6 s TYR 13 N -2.41 2.80 0.13 1.90 2.02 -1.26 -2.16 117.35 118.37 2dn6 s TYR 13 Ca 0.15 0.08 0.08 0.00 -0.37 0.00 0.00 57.07 57.01 2dn6 s TYR 13 Cb 0.04 -4.09 -0.04 0.00 -0.40 0.00 0.00 41.96 37.47 2dn6 s TYR 13 CO -0.03 -1.33 -0.12 -1.64 -1.57 0.00 0.00 175.55 170.85 2dn6 s MET 14 N 3.99 1.99 -0.38 -0.62 -1.94 -0.24 -4.84 119.30 117.26 2dn6 s MET 14 Ca 0.32 -1.16 -0.15 0.00 -1.71 0.00 0.00 55.69 53.00 2dn6 s MET 14 Cb -0.12 -2.19 0.00 0.00 2.01 0.00 0.00 34.83 34.53 2dn6 s MET 14 CO 0.21 0.47 0.32 -1.64 -0.01 0.00 0.00 175.02 174.37 2dn6 s MET 15 N -2.40 3.24 -0.01 2.03 1.00 -1.08 -0.18 119.30 121.90 2dn6 s MET 15 Ca 0.21 -0.76 -0.08 0.00 0.00 0.00 0.00 55.69 55.06 2dn6 s MET 15 Cb -0.10 -3.90 -0.05 0.00 0.00 0.00 0.00 34.83 30.78 2dn6 s MET 15 CO 0.13 -0.65 0.28 0.21 0.00 0.00 0.00 175.02 174.99 2dn6 s LYS 16 N 1.84 3.63 -0.51 2.03 2.20 -1.09 0.13 119.74 127.97 2dn6 s LYS 16 Ca 0.08 0.03 -0.29 0.00 -0.36 0.00 0.00 55.97 55.43 2dn6 s LYS 16 Cb -0.18 -3.12 0.03 0.00 -1.51 0.00 0.00 37.83 33.05 2dn6 s LYS 16 CO 0.11 0.67 1.15 0.21 -0.36 0.00 0.00 175.35 177.13 2dn6 s LYS 17 N -1.51 3.64 0.17 4.03 2.20 -0.07 -3.73 119.74 124.46 2dn6 s LYS 17 Ca 0.25 0.42 0.00 0.00 -0.36 0.00 0.00 55.97 56.28 2dn6 s LYS 17 Cb -0.14 -3.95 0.00 0.00 -1.51 0.00 0.00 37.83 32.23 2dn6 s LYS 17 CO 0.13 -1.49 0.00 0.41 -0.36 0.00 0.00 175.35 174.05 2dn6 n GLY 18 N 4.94 -0.19 3.52 5.54 0.00 -1.26 -4.71 105.19 113.04 2dn6 n GLY 18 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 2dn6 n GLY 18 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dn6 n HIS 19 N -3.11 0.73 -4.46 1.61 8.25 -1.25 -1.85 115.22 115.15 2dn6 n HIS 19 Ca 0.00 0.16 -0.39 0.00 -0.26 0.00 0.00 57.72 57.23 2dn6 n HIS 19 Cb 0.01 -2.03 -0.08 0.00 1.12 0.00 0.00 29.99 29.01 2dn6 n HIS 19 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 2dn6 n ARG 20 N 7.95 -0.97 -3.70 -0.41 3.00 -1.26 -0.11 116.66 121.16 2dn6 n ARG 20 Ca 0.56 0.15 -0.30 0.00 -0.00 0.00 0.00 57.85 58.26 2dn6 n ARG 20 Cb 0.25 -4.43 -0.06 0.00 0.00 0.00 0.00 32.46 28.22 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 -4.23 -0.81 0.10 -0.14 3.00 -0.77 -4.60 116.66 109.21 2dn6 n ARG 21 Ca -0.01 0.10 0.00 0.00 -0.00 0.00 0.00 57.85 57.93 2dn6 n ARG 21 Cb 0.53 -3.29 0.00 0.00 0.00 0.00 0.00 32.46 29.70 2dn6 n ARG 21 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 2dn6 n LYS 22 N -3.12 0.00 -2.74 -0.14 4.81 0.85 -5.00 118.16 112.82 2dn6 n LYS 22 Ca 0.05 0.00 -0.27 0.00 -0.87 0.00 0.00 58.31 57.22 2dn6 n LYS 22 Cb 0.35 -0.17 -0.00 0.00 0.02 0.00 0.00 35.03 35.22 2dn6 n LYS 22 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 2dn6 s ASN 23 N -5.29 6.24 0.05 3.14 3.84 -0.90 -5.04 114.94 116.98 2dn6 s ASN 23 Ca 0.00 0.85 0.08 0.00 0.21 0.00 0.00 52.86 53.99 2dn6 s ASN 23 Cb 0.00 -2.19 -0.03 0.00 -0.55 0.00 0.00 41.25 38.48 2dn6 s ASN 23 CO 0.00 -0.56 -0.19 0.26 -2.79 0.00 0.00 177.10 173.82 2dn6 s TRP 24 N -2.69 2.52 -0.01 0.43 0.52 -1.26 -3.93 118.94 114.52 2dn6 s TRP 24 Ca 0.47 -0.28 0.02 0.00 0.02 0.00 0.00 56.10 56.33 2dn6 s TRP 24 Cb -0.10 -1.43 -0.00 0.00 -1.15 0.00 0.00 33.47 30.78 2dn6 s TRP 24 CO 0.44 0.26 -0.08 0.99 0.02 0.00 0.00 176.95 178.57 2dn6 s THR 25 N -0.94 0.67 0.09 2.01 2.01 -1.24 -5.01 115.64 113.22 2dn6 s THR 25 Ca 0.15 -0.35 -0.30 0.00 0.31 0.00 0.00 61.69 61.50 2dn6 s THR 25 Cb -0.10 -0.57 -0.06 0.00 0.01 0.00 0.00 72.50 71.77 2dn6 s THR 25 CO 0.05 0.20 1.18 -0.70 -0.69 0.00 0.00 174.62 174.66 2dn6 s GLU 26 N -0.09 4.46 -0.04 4.92 2.12 -1.26 -2.66 118.70 126.15 2dn6 s GLU 26 Ca 0.02 1.76 -0.08 0.00 0.36 0.00 0.00 54.97 57.03 2dn6 s GLU 26 Cb -0.05 -3.33 0.01 0.00 0.26 0.00 0.00 34.13 31.03 2dn6 s GLU 26 CO -0.00 -0.19 0.19 1.03 -0.54 0.00 0.00 175.26 175.75 2dn6 s ARG 27 N 0.74 0.38 0.26 4.30 1.81 0.75 -4.96 118.95 122.23 2dn6 s ARG 27 Ca 0.57 -0.02 -0.30 0.00 -1.72 0.00 0.00 55.73 54.26 2dn6 s ARG 27 Cb -0.30 0.17 -0.09 0.00 -0.45 0.00 0.00 34.95 34.28 2dn6 s ARG 27 CO 0.31 -0.08 1.10 -0.46 -0.68 0.00 0.00 175.30 175.49 2dn6 s TRP 28 N -0.61 3.58 -0.03 -0.53 -0.11 -0.53 -1.08 118.94 119.63 2dn6 s TRP 28 Ca -0.07 1.67 0.04 0.00 1.22 0.00 0.00 56.10 58.96 2dn6 s TRP 28 Cb -0.04 -3.29 -0.01 0.00 -1.50 0.00 0.00 33.47 28.64 2dn6 s TRP 28 CO 0.01 -0.58 -0.16 -0.06 -4.62 0.00 0.00 176.95 171.54 2dn6 s PHE 29 N -0.93 1.51 -0.44 5.86 0.40 -0.92 -1.01 117.98 122.45 2dn6 s PHE 29 Ca 0.46 -0.38 0.04 0.00 -0.60 0.00 0.00 56.93 56.45 2dn6 s PHE 29 Cb -0.31 -1.01 0.12 0.00 0.51 0.00 0.00 43.02 42.32 2dn6 s PHE 29 CO 0.40 -0.11 0.17 0.08 0.70 0.00 0.00 175.22 176.45 2dn6 s VAL 30 N -0.07 2.41 -0.73 -0.44 1.01 0.29 -3.05 120.40 119.82 2dn6 s VAL 30 Ca -0.01 -2.87 -0.26 0.00 0.00 0.00 0.00 61.98 58.85 2dn6 s VAL 30 Cb -0.09 -2.72 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 2dn6 s VAL 30 CO 0.01 -0.72 1.82 -0.22 0.00 0.00 0.00 175.10 176.00 2dn6 s LEU 31 N 0.25 3.25 0.67 3.92 2.96 -0.26 -2.10 118.68 127.38 2dn6 s LEU 31 Ca 0.14 -0.13 -0.11 0.00 -0.22 0.00 0.00 54.13 53.81 2dn6 s LEU 31 Cb -0.23 -2.54 -0.00 0.00 0.50 0.00 0.00 46.19 43.91 2dn6 s LEU 31 CO -0.04 -2.41 1.07 -0.54 -1.32 0.00 0.00 176.35 173.11 2dn6 s LYS 32 N 6.83 3.10 0.41 1.98 -0.14 0.63 -0.38 119.74 132.17 2dn6 s LYS 32 Ca 0.64 0.54 0.20 0.00 -1.36 0.00 0.00 55.97 55.99 2dn6 s LYS 32 Cb -0.10 -2.05 0.86 0.00 -1.68 0.00 0.00 37.83 34.86 2dn6 s LYS 32 CO 0.12 -0.87 1.82 -1.00 -0.76 0.00 0.00 175.35 174.66 2dn6 h PRO 33 N -0.53 0.00 0.00 -1.68 0.13 -1.94 -3.25 132.00 124.73 2dn6 h PRO 33 Ca -0.45 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.58 2dn6 h PRO 33 Cb 1.23 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.15 2dn6 h PRO 33 CO 0.63 0.31 -0.77 0.09 -0.23 0.00 0.00 178.00 178.04 2dn6 n ASN 34 N -3.65 1.03 0.00 1.44 4.13 -1.26 -4.88 115.26 112.07 2dn6 n ASN 34 Ca -0.01 -2.43 0.00 0.00 1.68 0.00 0.00 54.58 53.83 2dn6 n ASN 34 Cb 0.43 -0.33 0.00 0.00 -1.54 0.00 0.00 39.78 38.34 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 -0.02 0.00 -3.39 2.41 3.06 -1.23 -4.22 119.36 115.97 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 0.95 0.00 -0.09 0.00 0.54 0.00 0.00 39.64 41.03 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 -0.11 9.51 1.01 -1.06 -0.27 121.20 127.81 2dn6 s ILE 36 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.39 2dn6 s ILE 36 Cb 0.00 -0.87 -0.02 0.00 0.01 0.00 0.00 42.46 41.58 2dn6 s ILE 36 CO 0.00 -0.28 -0.10 -0.94 0.00 0.00 0.00 174.94 173.61 2dn6 s SER 37 N 2.44 4.29 -0.21 3.58 1.04 -0.89 -1.54 113.70 122.40 2dn6 s SER 37 Ca 0.10 -0.20 0.01 0.00 0.48 0.00 0.00 55.95 56.34 2dn6 s SER 37 Cb -0.14 -1.41 0.03 0.00 0.10 0.00 0.00 66.02 64.60 2dn6 s SER 37 CO -0.23 0.24 -0.15 -0.72 0.98 0.00 0.00 173.24 173.35 2dn6 s TYR 38 N -0.09 2.95 0.05 5.02 1.13 -1.24 0.11 117.35 125.28 2dn6 s TYR 38 Ca -0.01 -1.80 -0.17 0.00 -1.41 0.00 0.00 57.07 53.69 2dn6 s TYR 38 Cb -0.14 -1.94 -0.06 0.00 -1.10 0.00 0.00 41.96 38.72 2dn6 s TYR 38 CO 0.03 -0.81 0.50 0.71 -2.51 0.00 0.00 175.55 173.47 2dn6 s TYR 39 N 1.25 3.75 0.56 -3.49 1.51 -0.18 -0.96 117.35 119.79 2dn6 s TYR 39 Ca 0.01 1.12 0.35 0.00 -1.01 0.00 0.00 57.07 57.54 2dn6 s TYR 39 Cb -0.15 -2.39 1.47 0.00 -0.11 0.00 0.00 41.96 40.78 2dn6 s TYR 39 CO -0.10 0.59 1.75 -0.24 -1.11 0.00 0.00 175.55 176.45 2dn6 h VAL 40 N 3.50 0.32 -4.24 0.71 3.04 -1.45 -1.40 116.25 116.73 2dn6 h VAL 40 Ca -0.50 0.00 -0.31 0.00 -1.01 0.00 0.00 66.70 64.88 2dn6 h VAL 40 Cb 1.21 0.38 -0.15 0.00 -2.01 0.00 0.00 31.29 30.73 2dn6 h VAL 40 CO 0.63 0.00 -0.60 -0.44 -1.01 0.00 0.00 177.57 176.15 2dn6 s SER 41 N -4.88 0.76 -0.12 3.17 0.01 -1.26 -4.20 113.70 107.18 2dn6 s SER 41 Ca -0.05 -1.43 0.04 0.00 1.31 0.00 0.00 55.95 55.82 2dn6 s SER 41 Cb 0.20 0.32 0.28 0.00 0.21 0.00 0.00 66.02 67.03 2dn6 s SER 41 CO 0.71 -0.82 1.10 -1.84 0.41 0.00 0.00 173.24 172.80 2dn6 n GLU 42 N -0.39 2.06 -0.02 12.44 0.28 -1.26 -3.61 120.64 130.14 2dn6 n GLU 42 Ca 0.01 -1.14 0.07 0.00 -0.16 0.00 0.00 57.16 55.95 2dn6 n GLU 42 Cb 0.66 -1.65 -0.15 0.00 1.43 0.00 0.00 31.44 31.73 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 0.10 0.50 -2.01 -1.84 9.92 -1.26 -5.01 116.55 116.95 2dn6 n ASP 43 Ca 0.15 0.00 -0.11 0.00 -0.53 0.00 0.00 54.79 54.30 2dn6 n ASP 43 Cb 0.73 1.75 0.04 0.00 -0.64 0.00 0.00 41.12 42.99 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 -2.26 -2.74 -0.08 0.64 4.77 -1.24 -4.96 117.00 111.13 2dn6 n LEU 44 Ca -0.08 -0.27 -0.15 0.00 -0.03 0.00 0.00 56.01 55.48 2dn6 n LEU 44 Cb 0.61 -1.71 -0.06 0.00 -2.33 0.00 0.00 43.42 39.92 2dn6 n LEU 44 CO 0.41 0.28 -1.03 0.29 -1.33 0.00 0.00 177.39 176.01 2dn6 n LYS 45 N -2.61 0.34 -3.89 3.23 5.02 -1.26 -4.91 118.16 114.09 2dn6 n LYS 45 Ca -0.03 0.13 -0.33 0.00 -2.02 0.00 0.00 58.31 56.06 2dn6 n LYS 45 Cb 0.54 -1.12 -0.13 0.00 -0.02 0.00 0.00 35.03 34.30 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 -6.19 4.96 0.25 4.39 2.15 -1.26 -5.09 116.67 115.88 2dn6 s ASP 46 Ca -0.22 -2.25 -0.30 0.00 0.43 0.00 0.00 52.55 50.22 2dn6 s ASP 46 Cb 0.08 -1.73 -0.09 0.00 -0.30 0.00 0.00 42.92 40.88 2dn6 s ASP 46 CO 0.29 -0.43 1.13 -0.75 -0.17 0.00 0.00 175.17 175.24 2dn6 s LYS 47 N 0.80 4.59 0.03 4.34 2.20 -1.26 -1.29 119.74 129.15 2dn6 s LYS 47 Ca 0.11 1.82 -0.16 0.00 -0.36 0.00 0.00 55.97 57.38 2dn6 s LYS 47 Cb -0.21 -3.21 -0.35 0.00 -1.51 0.00 0.00 37.83 32.55 2dn6 s LYS 47 CO -0.05 0.12 1.01 0.87 -0.36 0.00 0.00 175.35 176.94 2dn6 h LYS 48 N 4.26 0.55 0.00 4.03 1.79 -1.37 -3.45 116.57 122.39 2dn6 h LYS 48 Ca -0.46 -0.92 0.00 0.00 -2.18 0.00 0.00 60.65 57.09 2dn6 h LYS 48 Cb 1.21 0.34 0.00 0.00 -1.58 0.00 0.00 32.23 32.20 2dn6 h LYS 48 CO 0.69 1.44 0.00 0.41 -1.08 0.00 0.00 179.45 180.91 2dn6 n GLY 49 N 1.68 -1.24 3.04 3.86 0.00 -1.24 -5.04 105.19 106.24 2dn6 n GLY 49 Ca -0.17 -0.86 -0.17 0.00 0.00 0.00 0.00 46.02 44.82 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 -4.00 0.99 -0.40 1.61 -4.77 -1.26 -3.72 116.67 105.12 2dn6 s ASP 50 Ca 0.00 -0.29 0.03 0.00 -3.30 0.00 0.00 52.55 48.99 2dn6 s ASP 50 Cb 0.00 -0.06 0.11 0.00 -1.09 0.00 0.00 42.92 41.88 2dn6 s ASP 50 CO 0.00 0.01 0.13 -0.63 0.70 0.00 0.00 175.17 175.38 2dn6 s ILE 51 N -0.58 2.20 -0.23 2.11 1.01 -0.59 -5.01 121.20 120.11 2dn6 s ILE 51 Ca -0.01 -2.57 -0.28 0.00 0.00 0.00 0.00 60.65 57.79 2dn6 s ILE 51 Cb -0.05 -2.59 -0.05 0.00 0.01 0.00 0.00 42.46 39.77 2dn6 s ILE 51 CO 0.00 -0.69 2.23 0.18 0.00 0.00 0.00 174.94 176.67 2dn6 n LEU 52 N 3.91 3.22 -4.77 2.97 4.77 -1.26 -2.56 117.00 123.29 2dn6 n LEU 52 Ca 0.04 0.18 -0.38 0.00 -0.03 0.00 0.00 56.01 55.82 2dn6 n LEU 52 Cb 0.39 -1.56 -0.06 0.00 -2.33 0.00 0.00 43.42 39.86 2dn6 n LEU 52 CO 0.25 -0.72 0.66 -0.76 -1.33 0.00 0.00 177.39 175.49 2dn6 s LEU 53 N 8.46 4.47 -0.16 2.23 1.43 -1.26 -4.88 118.68 128.97 2dn6 s LEU 53 Ca 1.01 1.90 -0.30 0.00 -1.03 0.00 0.00 54.13 55.71 2dn6 s LEU 53 Cb -0.33 -3.83 0.13 0.00 0.03 0.00 0.00 46.19 42.19 2dn6 s LEU 53 CO 0.35 0.02 1.06 -0.62 0.23 0.00 0.00 176.35 177.39 2dn6 s ASP 54 N -1.41 -0.29 0.22 2.29 2.15 -1.26 -4.87 116.67 113.50 2dn6 s ASP 54 Ca 0.46 0.25 0.08 0.00 0.43 0.00 0.00 52.55 53.76 2dn6 s ASP 54 Cb -0.22 0.26 0.68 0.00 -0.30 0.00 0.00 42.92 43.34 2dn6 s ASP 54 CO 0.28 -0.32 1.00 -1.84 -0.17 0.00 0.00 175.17 174.11 2dn6 n GLU 55 N 0.47 -0.04 0.29 4.34 0.28 -1.26 0.10 120.64 124.81 2dn6 n GLU 55 Ca -0.07 0.91 -0.17 0.00 -0.16 0.00 0.00 57.16 57.66 2dn6 n GLU 55 Cb 0.59 -1.54 -0.09 0.00 1.43 0.00 0.00 31.44 31.82 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 -3.87 -1.84 2.35 -1.96 -3.42 115.58 105.65 2dn6 h ASN 56 Ca 0.47 0.09 -0.55 0.00 -0.55 0.00 0.00 56.30 55.76 2dn6 h ASN 56 Cb 1.13 0.39 0.13 0.00 0.05 0.00 0.00 38.32 40.02 2dn6 h ASN 56 CO -0.54 -0.61 0.62 0.00 -1.65 0.00 0.00 177.43 175.25 2dn6 s VAL 59 N -3.36 3.35 0.22 0.00 0.11 -1.26 -0.21 120.40 119.25 2dn6 s VAL 59 Ca -0.00 -0.63 0.03 0.00 -2.93 0.00 0.00 61.98 58.44 2dn6 s VAL 59 Cb -0.00 -2.34 -0.05 0.00 -1.53 0.00 0.00 36.38 32.46 2dn6 s VAL 59 CO -0.09 0.58 0.02 -1.61 -3.33 0.00 0.00 175.10 170.67 2dn6 s GLU 60 N -0.80 1.29 -0.05 1.54 0.41 0.40 -4.94 118.70 116.55 2dn6 s GLU 60 Ca 0.12 -1.65 -0.10 0.00 -0.41 0.00 0.00 54.97 52.93 2dn6 s GLU 60 Cb -0.11 -0.44 -0.05 0.00 -1.78 0.00 0.00 34.13 31.76 2dn6 s GLU 60 CO 0.01 -0.15 0.27 -1.54 -0.49 0.00 0.00 175.26 173.36 2dn6 s SER 61 N -3.27 6.58 0.16 -0.19 1.04 -1.26 -1.23 113.70 115.53 2dn6 s SER 61 Ca 0.29 0.69 0.07 0.00 0.48 0.00 0.00 55.95 57.48 2dn6 s SER 61 Cb 0.06 -2.15 -0.04 0.00 0.10 0.00 0.00 66.02 64.00 2dn6 s SER 61 CO 0.08 0.35 -0.01 -0.76 0.98 0.00 0.00 173.24 173.88 2dn6 s LEU 62 N -1.16 3.29 0.00 2.42 1.43 0.75 -4.83 118.68 120.58 2dn6 s LEU 62 Ca 0.20 -0.37 -0.06 0.00 -1.03 0.00 0.00 54.13 52.87 2dn6 s LEU 62 Cb -0.14 -1.97 0.09 0.00 0.03 0.00 0.00 46.19 44.20 2dn6 s LEU 62 CO 0.10 0.11 0.34 -0.81 0.23 0.00 0.00 176.35 176.31 2dn6 n PRO 63 N 0.07 -1.69 -2.99 1.29 -0.04 -1.26 -3.70 135.00 126.68 2dn6 n PRO 63 Ca -0.10 -0.54 -0.41 0.00 -0.04 0.00 0.00 63.50 62.41 2dn6 n PRO 63 Cb 0.54 -0.51 -0.05 0.00 -0.04 0.00 0.00 33.50 33.45 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 -2.42 6.71 0.18 3.54 1.47 -1.26 -4.46 116.67 120.42 2dn6 s ASP 64 Ca 0.22 0.86 -0.09 0.00 1.18 0.00 0.00 52.55 54.72 2dn6 s ASP 64 Cb -0.02 -2.39 -0.01 0.00 -0.34 0.00 0.00 42.92 40.16 2dn6 s ASP 64 CO 0.17 -0.46 0.29 -1.59 0.68 0.00 0.00 175.17 174.26 2dn6 s LYS 65 N 2.71 1.20 -1.80 2.11 -2.85 -1.26 -4.85 119.74 115.00 2dn6 s LYS 65 Ca 0.31 -1.22 -0.19 0.00 -1.00 0.00 0.00 55.97 53.87 2dn6 s LYS 65 Cb -0.15 0.38 0.18 0.00 -2.06 0.00 0.00 37.83 36.18 2dn6 s LYS 65 CO 0.08 -0.44 0.54 -3.47 0.10 0.00 0.00 175.35 172.16 2dn6 n ASP 66 N -0.24 -1.65 -3.06 0.03 -0.08 -1.26 -0.12 116.55 110.18 2dn6 n ASP 66 Ca -0.06 -1.20 -0.14 0.00 -1.51 0.00 0.00 54.79 51.87 2dn6 n ASP 66 Cb 0.63 -1.85 0.07 0.00 2.34 0.00 0.00 41.12 42.32 2dn6 n ASP 66 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2dn6 n GLY 67 N -1.36 -0.31 3.74 0.27 0.00 -1.26 -5.04 105.19 101.23 2dn6 n GLY 67 Ca 0.04 0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 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 -5.05 2.14 0.00 1.61 -0.14 0.83 -5.07 119.74 114.06 2dn6 s LYS 68 Ca 0.04 -2.19 0.00 0.00 -1.36 0.00 0.00 55.97 52.46 2dn6 s LYS 68 Cb -0.01 -1.70 0.00 0.00 -1.68 0.00 0.00 37.83 34.45 2dn6 s LYS 68 CO 0.62 -0.27 0.00 0.36 -0.76 0.00 0.00 175.35 175.30 2dn6 n LYS 69 N -1.24 0.00 -3.70 1.68 0.00 -1.26 -4.35 118.16 109.29 2dn6 n LYS 69 Ca -0.10 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 57.91 2dn6 n LYS 69 Cb 0.66 -0.59 -0.14 0.00 -0.00 0.00 0.00 35.03 34.96 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 1.41 3.11 -0.27 0.00 1.43 -1.24 -2.59 118.68 120.54 2dn6 s LEU 71 Ca 0.12 -0.63 -0.15 0.00 -1.03 0.00 0.00 54.13 52.43 2dn6 s LEU 71 Cb -0.19 -1.68 0.08 0.00 0.03 0.00 0.00 46.19 44.43 2dn6 s LEU 71 CO -0.20 0.04 0.66 0.72 0.23 0.00 0.00 176.35 177.79 2dn6 s PHE 72 N -2.14 -1.02 0.07 0.29 -0.12 -1.11 -0.18 117.98 113.77 2dn6 s PHE 72 Ca 0.29 2.05 0.09 0.00 -0.05 0.00 0.00 56.93 59.31 2dn6 s PHE 72 Cb -0.07 0.60 -0.03 0.00 -0.63 0.00 0.00 43.02 42.89 2dn6 s PHE 72 CO 0.18 -0.51 -0.22 -1.17 -0.05 0.00 0.00 175.22 173.45 2dn6 s LEU 73 N 1.62 2.46 -0.15 -1.99 0.20 -0.36 -2.32 118.68 118.13 2dn6 s LEU 73 Ca -0.10 -0.55 -0.02 0.00 0.69 0.00 0.00 54.13 54.15 2dn6 s LEU 73 Cb -0.05 -1.41 -0.02 0.00 -0.43 0.00 0.00 46.19 44.28 2dn6 s LEU 73 CO -0.19 0.23 -0.09 -0.69 -0.29 0.00 0.00 176.35 175.32 2dn6 s VAL 74 N -0.96 3.35 -0.13 1.68 1.01 0.80 -0.46 120.40 125.69 2dn6 s VAL 74 Ca 0.14 -0.55 -0.06 0.00 0.00 0.00 0.00 61.98 61.52 2dn6 s VAL 74 Cb -0.10 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 2dn6 s VAL 74 CO 0.05 0.50 0.07 -0.54 0.00 0.00 0.00 175.10 175.18 2dn6 s LYS 75 N 0.52 3.52 0.45 2.72 3.01 0.70 -1.62 119.74 129.04 2dn6 s LYS 75 Ca -0.06 -0.29 0.03 0.00 -1.01 0.00 0.00 55.97 54.63 2dn6 s LYS 75 Cb -0.15 -3.08 -0.03 0.00 -1.01 0.00 0.00 37.83 33.55 2dn6 s LYS 75 CO 0.03 0.56 0.04 0.00 0.51 0.00 0.00 175.35 176.50 2dn6 n PHE 77 N -1.07 0.00 0.00 0.00 3.72 -1.26 -4.09 117.46 114.76 2dn6 n PHE 77 Ca -0.12 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.28 2dn6 n PHE 77 Cb 0.66 -0.26 0.00 0.00 -0.94 0.00 0.00 39.48 38.95 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 -2.26 4.73 -4.90 4.37 8.00 -1.26 -5.06 116.55 120.17 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 0.40 0.05 0.00 -0.02 0.00 0.00 41.12 41.55 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 -1.98 2.64 0.08 -1.24 -0.14 -1.26 -5.10 119.74 112.73 2dn6 s LYS 79 Ca 0.00 0.20 -0.03 0.00 -1.36 0.00 0.00 55.97 54.78 2dn6 s LYS 79 Cb 0.00 -2.09 -0.03 0.00 -1.68 0.00 0.00 37.83 34.03 2dn6 s LYS 79 CO 0.00 -1.07 0.05 0.95 -0.76 0.00 0.00 175.35 174.52 2dn6 s THR 80 N -3.29 0.17 -0.15 2.17 -4.23 -1.26 -1.86 115.64 107.19 2dn6 s THR 80 Ca 0.58 -1.66 -0.07 0.00 -1.18 0.00 0.00 61.69 59.36 2dn6 s THR 80 Cb -0.11 -1.58 0.06 0.00 1.34 0.00 0.00 72.50 72.21 2dn6 s THR 80 CO 0.49 -0.79 0.34 -0.36 -0.54 0.00 0.00 174.62 173.76 2dn6 s PHE 81 N -3.93 -0.52 -0.21 3.99 0.40 -0.64 -4.99 117.98 112.07 2dn6 s PHE 81 Ca 0.10 1.13 -0.03 0.00 -0.60 0.00 0.00 56.93 57.53 2dn6 s PHE 81 Cb 0.07 0.16 -0.00 0.00 0.51 0.00 0.00 43.02 43.75 2dn6 s PHE 81 CO -0.08 -0.34 -0.08 -2.00 0.70 0.00 0.00 175.22 173.43 2dn6 s GLU 82 N 1.75 3.31 0.18 0.44 2.12 -1.26 -0.14 118.70 125.09 2dn6 s GLU 82 Ca -0.06 -0.67 0.10 0.00 0.36 0.00 0.00 54.97 54.70 2dn6 s GLU 82 Cb -0.10 -2.90 -0.04 0.00 0.26 0.00 0.00 34.13 31.35 2dn6 s GLU 82 CO -0.11 -0.16 -0.20 0.42 -0.54 0.00 0.00 175.26 174.66 2dn6 s ILE 83 N 1.35 2.02 -0.05 -3.70 1.01 -0.98 -0.90 121.20 119.95 2dn6 s ILE 83 Ca 0.04 -1.96 0.05 0.00 0.00 0.00 0.00 60.65 58.78 2dn6 s ILE 83 Cb -0.14 -1.95 -0.01 0.00 0.01 0.00 0.00 42.46 40.38 2dn6 s ILE 83 CO -0.04 -0.24 -0.20 -0.55 0.00 0.00 0.00 174.94 173.91 2dn6 s SER 84 N -2.68 2.44 0.15 3.58 0.15 0.35 -2.77 113.70 114.93 2dn6 s SER 84 Ca 0.18 -0.40 0.03 0.00 0.70 0.00 0.00 55.95 56.45 2dn6 s SER 84 Cb -0.07 -0.68 -0.04 0.00 -1.71 0.00 0.00 66.02 63.53 2dn6 s SER 84 CO 0.08 0.18 0.25 0.00 1.20 0.00 0.00 173.24 174.95 2dn6 s ALA 85 N -0.02 3.88 -0.04 5.45 0.00 -1.07 -2.64 121.76 127.33 2dn6 s ALA 85 Ca -0.04 -1.06 -0.03 0.00 0.00 0.00 0.00 51.96 50.83 2dn6 s ALA 85 Cb -0.12 -1.69 -0.02 0.00 0.00 0.00 0.00 23.12 21.29 2dn6 s ALA 85 CO 0.03 0.55 0.21 1.03 0.00 0.00 0.00 175.76 177.58 2dn6 h SER 86 N 2.26 -0.09 -2.24 0.00 0.87 -1.92 -3.42 113.55 109.01 2dn6 h SER 86 Ca -0.48 0.00 -0.57 0.00 -1.23 0.00 0.00 61.79 59.51 2dn6 h SER 86 Cb 1.19 0.02 -0.11 0.00 -0.44 0.00 0.00 62.40 63.07 2dn6 h SER 86 CO 0.68 0.14 -0.68 -0.62 -0.53 0.00 0.00 176.83 175.82 2dn6 s ASP 87 N -4.06 4.30 0.39 6.23 -1.08 -1.26 -4.76 116.67 116.43 2dn6 s ASP 87 Ca -0.02 -0.73 0.18 0.00 -0.52 0.00 0.00 52.55 51.46 2dn6 s ASP 87 Cb 0.00 -0.71 1.09 0.00 -1.46 0.00 0.00 42.92 41.84 2dn6 s ASP 87 CO 0.05 0.01 1.76 0.07 0.52 0.00 0.00 175.17 177.59 2dn6 h LYS 88 N 2.02 0.39 0.24 4.34 2.10 -1.94 -1.88 116.57 121.84 2dn6 h LYS 88 Ca -0.43 -0.02 -0.00 0.00 -2.00 0.00 0.00 60.65 58.19 2dn6 h LYS 88 Cb 1.25 -0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 32.48 2dn6 h LYS 88 CO 0.60 0.26 -0.30 -0.22 -2.00 0.00 0.00 179.45 177.79 2dn6 h LYS 89 N 0.40 -0.53 -0.38 0.07 3.64 -1.99 -0.08 116.57 117.70 2dn6 h LYS 89 Ca 0.61 0.04 0.07 0.00 -1.27 0.00 0.00 60.65 60.10 2dn6 h LYS 89 Cb 1.51 0.12 -0.07 0.00 -0.41 0.00 0.00 32.23 33.38 2dn6 h LYS 89 CO -0.32 -0.35 -0.07 0.87 -2.27 0.00 0.00 179.45 177.31 2dn6 h LYS 90 N -0.55 0.02 -0.23 1.90 1.57 -1.78 0.44 116.57 117.95 2dn6 h LYS 90 Ca -0.03 -0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.80 2dn6 h LYS 90 Cb 0.49 -0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.72 2dn6 h LYS 90 CO -0.07 0.02 -0.43 -0.22 -0.57 0.00 0.00 179.45 178.18 2dn6 h LYS 91 N 0.02 -0.42 0.45 3.15 3.11 -1.18 0.30 116.57 122.00 2dn6 h LYS 91 Ca 0.18 0.03 -0.02 0.00 -2.81 0.00 0.00 60.65 58.03 2dn6 h LYS 91 Cb 0.28 0.10 0.00 0.00 -1.00 0.00 0.00 32.23 31.61 2dn6 h LYS 91 CO -0.37 -0.28 -0.22 0.37 -2.81 0.00 0.00 179.45 176.14 2dn6 h GLN 92 N -0.44 -0.58 -0.96 1.90 4.15 -0.55 0.49 115.11 119.11 2dn6 h GLN 92 Ca 0.09 0.04 0.23 0.00 0.77 0.00 0.00 58.65 59.79 2dn6 h GLN 92 Cb 0.61 0.13 -0.18 0.00 0.21 0.00 0.00 27.48 28.26 2dn6 h GLN 92 CO -0.46 -0.39 -0.07 0.93 -1.93 0.00 0.00 178.83 176.91 2dn6 h GLU 93 N -0.61 0.01 0.67 1.69 5.08 -0.82 0.34 114.58 120.94 2dn6 h GLU 93 Ca -0.06 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 2dn6 h GLU 93 Cb 0.46 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.72 2dn6 h GLU 93 CO 0.10 0.01 -0.32 -1.49 -1.00 0.00 0.00 179.01 176.31 2dn6 h TRP 94 N 0.01 -0.83 -0.32 4.33 4.06 -0.29 0.11 115.95 123.01 2dn6 h TRP 94 Ca 0.53 -0.02 0.06 0.00 2.06 0.00 0.00 58.89 61.53 2dn6 h TRP 94 Cb 1.00 0.27 -0.08 0.00 -1.00 0.00 0.00 29.16 29.35 2dn6 h TRP 94 CO -0.58 -0.52 -0.44 0.82 -3.56 0.00 0.00 178.44 174.16 2dn6 h ILE 95 N -1.01 0.11 -0.16 1.49 2.04 0.41 0.14 117.51 120.53 2dn6 h ILE 95 Ca -0.09 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.81 2dn6 h ILE 95 Cb 0.68 0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 36.83 2dn6 h ILE 95 CO 0.15 0.00 -0.10 1.56 0.00 0.00 0.00 178.15 179.76 2dn6 h GLN 96 N -0.38 -0.10 -0.48 2.37 4.20 -0.43 0.19 115.11 120.48 2dn6 h GLN 96 Ca 0.11 0.01 0.09 0.00 0.06 0.00 0.00 58.65 58.92 2dn6 h GLN 96 Cb 0.60 0.02 -0.08 0.00 0.30 0.00 0.00 27.48 28.32 2dn6 h GLN 96 CO -0.52 -0.06 0.00 0.00 -0.67 0.00 0.00 178.83 177.57 2dn6 h ALA 97 N 1.03 0.45 -0.07 3.87 0.00 0.08 -1.17 119.26 123.45 2dn6 h ALA 97 Ca 0.09 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 2dn6 h ALA 97 Cb 0.24 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2dn6 h ALA 97 CO -0.22 -0.39 0.01 0.82 0.00 0.00 0.00 179.25 179.48 2dn6 h ILE 98 N 0.12 1.21 -0.25 0.00 2.04 -0.26 -2.07 117.51 118.30 2dn6 h ILE 98 Ca 0.24 -0.65 0.05 0.00 1.00 0.00 0.00 64.86 65.50 2dn6 h ILE 98 Cb 0.36 1.51 -0.08 0.00 -0.74 0.00 0.00 36.82 37.87 2dn6 h ILE 98 CO -0.40 0.18 -0.46 -0.74 0.00 0.00 0.00 178.15 176.73 2dn6 h HIS 99 N -0.12 -1.36 -0.59 1.37 2.76 -0.08 -1.26 115.15 115.87 2dn6 h HIS 99 Ca 0.02 0.06 0.06 0.00 -2.20 0.00 0.00 60.37 58.31 2dn6 h HIS 99 Cb 0.27 0.63 -0.05 0.00 1.55 0.00 0.00 27.41 29.81 2dn6 h HIS 99 CO 0.01 -0.48 0.30 1.03 -1.30 0.00 0.00 177.93 177.49 2dn6 h SER 100 N -0.45 0.43 -0.97 3.26 0.87 -1.25 -1.66 113.55 113.78 2dn6 h SER 100 Ca 0.09 0.04 0.25 0.00 -1.23 0.00 0.00 61.79 60.94 2dn6 h SER 100 Cb 0.62 -0.04 -0.13 0.00 -0.44 0.00 0.00 62.40 62.41 2dn6 h SER 100 CO -0.48 0.28 0.53 0.74 -0.53 0.00 0.00 176.83 177.37 2dn6 h THR 101 N 0.57 0.47 -0.04 2.23 2.02 -0.51 -0.31 112.91 117.34 2dn6 h THR 101 Ca 0.27 -0.16 -0.11 0.00 0.77 0.00 0.00 66.41 67.18 2dn6 h THR 101 Cb 0.19 -0.05 0.01 0.00 -1.74 0.00 0.00 68.15 66.56 2dn6 h THR 101 CO -0.19 0.09 -0.40 0.40 0.37 0.00 0.00 175.52 175.79 2dn6 h ILE 102 N 0.48 1.44 -0.78 3.11 2.04 -0.70 -3.30 117.51 119.80 2dn6 h ILE 102 Ca 0.64 -1.88 0.17 0.00 1.00 0.00 0.00 64.86 64.79 2dn6 h ILE 102 Cb 1.26 2.48 -0.14 0.00 -0.74 0.00 0.00 36.82 39.68 2dn6 h ILE 102 CO -0.52 0.54 -0.13 -0.74 0.00 0.00 0.00 178.15 177.30 2dn6 h HIS 103 N -0.19 -0.29 -1.04 1.37 2.76 -0.33 0.62 115.15 118.05 2dn6 h HIS 103 Ca -0.04 0.07 0.27 0.00 -2.20 0.00 0.00 60.37 58.46 2dn6 h HIS 103 Cb 1.09 0.25 -0.09 0.00 1.55 0.00 0.00 27.41 30.21 2dn6 h HIS 103 CO 0.14 -0.31 0.67 -0.07 -1.30 0.00 0.00 177.93 177.06 2dn6 h LEU 104 N 0.03 0.42 -0.08 0.26 3.38 -1.48 0.18 115.31 118.02 2dn6 h LEU 104 Ca 0.40 0.08 -0.25 0.00 0.09 0.00 0.00 57.88 58.20 2dn6 h LEU 104 Cb 0.65 0.01 0.02 0.00 0.09 0.00 0.00 40.66 41.42 2dn6 h LEU 104 CO -0.77 0.09 -0.93 -0.07 0.09 0.00 0.00 178.44 176.85 2dn6 h LEU 105 N 0.38 0.90 -0.94 1.67 3.38 0.09 -3.24 115.31 117.55 2dn6 h LEU 105 Ca 0.59 -0.67 0.19 0.00 0.09 0.00 0.00 57.88 58.08 2dn6 h LEU 105 Cb 1.52 -0.27 -0.11 0.00 0.09 0.00 0.00 40.66 41.89 2dn6 h LEU 105 CO -0.28 1.47 0.51 0.11 0.09 0.00 0.00 178.44 180.34 2dn6 h LYS 106 N 0.44 0.62 -0.67 1.13 1.57 0.18 -0.99 116.57 118.85 2dn6 h LYS 106 Ca -0.10 -0.04 0.14 0.00 -1.87 0.00 0.00 60.65 58.79 2dn6 h LYS 106 Cb 1.57 -0.14 -0.12 0.00 0.08 0.00 0.00 32.23 33.62 2dn6 h LYS 106 CO 0.18 0.41 -0.10 -0.07 -0.57 0.00 0.00 179.45 179.30 2dn6 h LEU 107 N 0.64 -0.50 -9.89 2.94 -0.00 -1.50 -3.40 115.31 103.60 2dn6 h LEU 107 Ca 0.55 0.19 -0.48 0.00 -0.00 0.00 0.00 57.88 58.14 2dn6 h LEU 107 Cb 0.88 0.37 -0.01 0.00 -0.00 0.00 0.00 40.66 41.90 2dn6 h LEU 107 CO -0.41 -0.19 0.37 -0.83 -0.00 0.00 0.00 178.44 177.38 2dn6 s GLY 108 N -3.55 2.83 0.17 0.83 0.00 -0.38 -5.07 107.32 102.15 2dn6 s GLY 108 Ca -0.14 0.60 0.10 0.00 0.00 0.00 0.00 44.72 45.27 2dn6 s GLY 108 CO 0.74 1.06 -0.17 -1.35 0.00 0.00 0.00 173.10 173.38 2dn6 s SER 109 N -1.52 3.87 0.01 1.64 1.04 -1.26 -4.98 113.70 112.50 2dn6 s SER 109 Ca 0.51 -0.68 0.07 0.00 0.48 0.00 0.00 55.95 56.32 2dn6 s SER 109 Cb -0.21 -0.51 -0.02 0.00 0.10 0.00 0.00 66.02 65.38 2dn6 s SER 109 CO 0.26 0.12 -0.21 -0.55 0.98 0.00 0.00 173.24 173.85 2dn6 s SER 110 N -2.64 2.45 0.00 7.02 0.15 -1.26 -5.13 113.70 114.29 2dn6 s SER 110 Ca 0.22 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.43 2dn6 s SER 110 Cb -0.09 -0.24 0.00 0.00 -1.71 0.00 0.00 66.02 63.98 2dn6 s SER 110 CO 0.12 0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.38 2dn6 n GLY 111 N 2.25 1.13 3.66 9.45 0.00 -1.26 -5.17 105.19 115.25 2dn6 n GLY 111 Ca -0.16 0.22 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.50 0.14 0.31 1.61 0.04 -1.26 -5.08 135.00 130.25 2dn6 s PRO 112 Ca 0.00 0.42 0.09 0.00 0.04 0.00 0.00 61.00 61.55 2dn6 s PRO 112 Cb 0.00 -1.71 -0.06 0.00 0.04 0.00 0.00 34.50 32.77 2dn6 s PRO 112 CO 0.00 -2.91 -0.10 0.45 0.04 0.00 0.00 177.00 174.48 2dn6 s SER 113 N -3.51 3.39 0.48 6.66 0.15 -1.26 -5.16 113.70 114.45 2dn6 s SER 113 Ca 0.66 -1.16 0.07 0.00 0.70 0.00 0.00 55.95 56.21 2dn6 s SER 113 Cb -0.18 -0.28 0.01 0.00 -1.71 0.00 0.00 66.02 63.86 2dn6 s SER 113 CO 0.57 -0.21 0.38 -0.44 1.20 0.00 0.00 173.24 174.75 2dn6 s SER 114 N -3.53 4.76 0.00 5.45 0.01 -1.26 -5.38 113.70 113.75 2dn6 s SER 114 Ca 0.31 -1.03 0.00 0.00 1.31 0.00 0.00 55.95 56.54 2dn6 s SER 114 Cb 0.02 -0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.18 2dn6 s SER 114 CO 0.15 -0.87 0.00 0.61 0.41 0.00 0.00 173.24 173.53