#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dwm n ARG 2 N 0.00 3.42 -3.10 4.33 1.85 -1.26 -4.79 116.66 117.11 1dwm n ARG 2 Ca 0.00 -3.94 -0.10 0.00 -1.00 0.00 0.00 57.85 52.81 1dwm n ARG 2 Cb 0.00 -2.31 -0.03 0.00 -1.05 0.00 0.00 32.46 29.07 1dwm n ARG 2 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 1dwm s ARG 3 N -4.05 0.90 0.03 2.89 0.52 -1.26 -5.14 118.95 112.84 1dwm s ARG 3 Ca 0.49 -1.06 0.05 0.00 -0.52 0.00 0.00 55.73 54.69 1dwm s ARG 3 Cb 0.38 -0.42 -0.02 0.00 0.52 0.00 0.00 34.95 35.41 1dwm s ARG 3 CO -0.32 -1.28 -0.14 0.00 0.02 0.00 0.00 175.30 173.57 1dwm n PRO 5 N 2.13 -1.96 -0.77 0.00 -0.04 -1.26 -4.95 135.00 128.15 1dwm n PRO 5 Ca -0.17 -1.61 0.10 0.00 -0.04 0.00 0.00 63.50 61.77 1dwm n PRO 5 Cb 0.55 -1.28 -0.04 0.00 -0.04 0.00 0.00 33.50 32.70 1dwm n PRO 5 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1dwm n GLY 6 N -3.02 -2.34 3.77 0.55 0.00 -1.26 -4.87 105.19 98.02 1dwm n GLY 6 Ca 0.13 -1.29 -0.35 0.00 0.00 0.00 0.00 46.02 44.51 1dwm n GLY 6 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1dwm s LYS 7 N -2.69 3.25 0.00 1.61 2.20 -1.26 -4.98 119.74 117.87 1dwm s LYS 7 Ca 0.00 1.69 0.10 0.00 -0.36 0.00 0.00 55.97 57.40 1dwm s LYS 7 Cb 0.00 -2.00 -0.07 0.00 -1.51 0.00 0.00 37.83 34.25 1dwm s LYS 7 CO 0.00 -0.95 0.48 0.09 -0.36 0.00 0.00 175.35 174.61 1dwm n ASN 8 N -1.36 0.69 -3.65 1.43 3.02 -1.26 -4.82 115.26 109.31 1dwm n ASN 8 Ca 0.12 -0.85 -0.04 0.00 -0.03 0.00 0.00 54.58 53.79 1dwm n ASN 8 Cb 0.50 0.83 -0.05 0.00 -0.61 0.00 0.00 39.78 40.45 1dwm n ASN 8 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dwm s ALA 9 N -1.74 -1.94 -0.89 5.41 0.00 -1.26 0.56 121.76 121.90 1dwm s ALA 9 Ca 0.05 2.34 -0.01 0.00 0.00 0.00 0.00 51.96 54.34 1dwm s ALA 9 Cb 0.08 -1.62 0.26 0.00 0.00 0.00 0.00 23.12 21.83 1dwm s ALA 9 CO 0.35 -0.71 1.00 0.91 0.00 0.00 0.00 175.76 177.31 1dwm n TRP 10 N 5.02 3.53 -0.26 0.00 8.01 0.10 -4.89 117.44 128.95 1dwm n TRP 10 Ca -0.15 -3.67 0.08 0.00 -1.31 0.00 0.00 57.50 52.45 1dwm n TRP 10 Cb 0.53 -1.04 0.32 0.00 -2.01 0.00 0.00 31.31 29.11 1dwm n TRP 10 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 1dwm h PRO 11 N 5.35 0.81 0.00 -0.99 0.13 -1.92 -0.12 132.00 135.26 1dwm h PRO 11 Ca 0.19 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1dwm h PRO 11 Cb 0.71 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 31.66 1dwm h PRO 11 CO 1.00 0.53 0.00 -0.85 -0.23 0.00 0.00 178.00 178.46 1dwm n GLU 12 N -4.52 0.06 0.14 0.86 0.00 -1.26 -1.35 120.64 114.57 1dwm n GLU 12 Ca 0.14 0.28 0.09 0.00 0.00 0.00 0.00 57.16 57.68 1dwm n GLU 12 Cb 0.31 -1.50 0.05 0.00 0.00 0.00 0.00 31.44 30.30 1dwm n GLU 12 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 1dwm h LEU 13 N 0.00 0.00 -8.97 -1.84 3.38 -1.41 -3.45 115.31 103.02 1dwm h LEU 13 Ca 0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 1dwm h LEU 13 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1dwm h LEU 13 CO 0.00 0.12 1.37 0.52 0.09 0.00 0.00 178.44 180.54 1dwm n VAL 14 N -2.91 0.40 0.00 1.22 0.31 -0.46 -0.50 118.33 116.39 1dwm n VAL 14 Ca 0.01 -0.31 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 1dwm n VAL 14 Cb 0.60 -2.18 0.00 0.00 -0.91 0.00 0.00 33.84 31.35 1dwm n VAL 14 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1dwm n GLY 15 N 5.58 1.01 3.95 2.92 0.00 0.16 -5.02 105.19 113.79 1dwm n GLY 15 Ca 0.30 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.08 1dwm n GLY 15 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1dwm s LYS 16 N -0.39 3.47 0.40 1.61 2.47 0.35 -4.67 119.74 122.97 1dwm s LYS 16 Ca 0.00 -0.55 -0.26 0.00 -1.56 0.00 0.00 55.97 53.60 1dwm s LYS 16 Cb 0.00 -2.84 -0.11 0.00 -1.46 0.00 0.00 37.83 33.42 1dwm s LYS 16 CO 0.00 0.38 1.29 -1.13 0.16 0.00 0.00 175.35 176.05 1dwm n SER 17 N -1.17 2.70 -0.04 1.43 3.41 -1.26 -0.09 113.62 118.59 1dwm n SER 17 Ca -0.07 1.14 0.23 0.00 -0.26 0.00 0.00 58.87 59.91 1dwm n SER 17 Cb 0.56 -1.50 0.71 0.00 -0.26 0.00 0.00 64.21 63.71 1dwm n SER 17 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1dwm h GLY 18 N 2.28 0.00 0.76 5.00 0.00 -1.12 0.90 103.07 110.88 1dwm h GLY 18 Ca -0.48 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.75 1dwm h GLY 18 CO 0.61 0.00 -0.33 -0.57 0.00 0.00 0.00 176.54 176.25 1dwm h ASN 19 N 0.00 0.47 -0.58 0.19 -1.24 -1.89 -1.25 115.58 111.28 1dwm h ASN 19 Ca 0.29 -0.60 -0.08 0.00 0.71 0.00 0.00 56.30 56.62 1dwm h ASN 19 Cb 1.22 -0.14 -0.02 0.00 0.73 0.00 0.00 38.32 40.11 1dwm h ASN 19 CO -0.00 0.99 0.06 -0.03 -1.29 0.00 0.00 177.43 177.16 1dwm h MET 20 N -0.03 1.02 0.80 6.67 4.05 -1.48 -0.28 114.93 125.68 1dwm h MET 20 Ca -0.01 -0.28 -0.04 0.00 -0.28 0.00 0.00 59.70 59.09 1dwm h MET 20 Cb 0.95 -0.11 0.01 0.00 -0.80 0.00 0.00 31.60 31.64 1dwm h MET 20 CO 0.07 0.96 -0.39 0.00 0.23 0.00 0.00 176.91 177.79 1dwm h ALA 21 N 1.11 -1.08 -0.97 0.39 0.00 -0.89 0.14 119.26 117.95 1dwm h ALA 21 Ca 0.18 -0.24 0.17 0.00 0.00 0.00 0.00 54.91 55.02 1dwm h ALA 21 Cb 0.47 0.42 -0.09 0.00 0.00 0.00 0.00 17.79 18.59 1dwm h ALA 21 CO 0.02 -1.07 0.61 0.00 0.00 0.00 0.00 179.25 178.81 1dwm h ALA 22 N -1.01 1.73 -0.30 0.00 0.00 -1.17 0.63 119.26 119.14 1dwm h ALA 22 Ca -0.11 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1dwm h ALA 22 Cb 0.84 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1dwm h ALA 22 CO 0.18 -0.04 0.12 0.00 0.00 0.00 0.00 179.25 179.51 1dwm h ALA 23 N 1.60 0.40 -0.78 0.00 0.00 -0.72 0.03 119.26 119.79 1dwm h ALA 23 Ca 0.52 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.31 1dwm h ALA 23 Cb 0.80 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 1dwm h ALA 23 CO -0.29 -0.00 0.51 1.15 0.00 0.00 0.00 179.25 180.62 1dwm h THR 24 N 0.34 1.20 0.12 0.00 2.02 0.14 0.32 112.91 117.04 1dwm h THR 24 Ca 0.10 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.91 1dwm h THR 24 Cb 0.19 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.65 1dwm h THR 24 CO -0.01 0.19 -0.06 0.58 0.37 0.00 0.00 175.52 176.60 1dwm h VAL 25 N 1.05 1.03 0.00 3.16 2.07 -0.80 0.35 116.25 123.11 1dwm h VAL 25 Ca 0.29 -0.59 -0.06 0.00 0.82 0.00 0.00 66.70 67.15 1dwm h VAL 25 Cb -0.12 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1dwm h VAL 25 CO -0.06 0.14 -0.28 -0.33 0.02 0.00 0.00 177.57 177.06 1dwm h GLU 26 N -0.44 0.00 0.00 1.57 4.39 -0.82 0.28 114.58 119.56 1dwm h GLU 26 Ca -0.02 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.63 1dwm h GLU 26 Cb 0.35 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 1dwm h GLU 26 CO 0.03 0.28 -0.30 0.00 -1.16 0.00 0.00 179.01 177.85 1dwm h ARG 27 N 0.00 0.00 -0.09 2.33 -0.00 -0.27 -2.97 114.38 113.39 1dwm h ARG 27 Ca -0.00 0.00 -0.08 0.00 -0.50 0.00 0.00 59.98 59.39 1dwm h ARG 27 Cb 0.55 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.50 1dwm h ARG 27 CO 0.04 0.77 -0.33 0.93 0.00 0.00 0.00 179.97 181.38 1dwm h GLU 28 N -1.00 0.16 -2.64 0.04 5.08 -0.32 -3.32 114.58 112.58 1dwm h GLU 28 Ca -0.08 -0.06 -0.60 0.00 -1.00 0.00 0.00 59.36 57.62 1dwm h GLU 28 Cb 0.87 -0.01 -0.41 0.00 0.50 0.00 0.00 28.75 29.70 1dwm h GLU 28 CO -0.05 0.48 -0.71 -1.71 -1.00 0.00 0.00 179.01 176.02 1dwm n ASN 29 N -4.11 2.19 0.00 1.42 2.85 0.97 -4.57 115.26 114.00 1dwm n ASN 29 Ca -0.01 -3.04 0.02 0.00 -0.11 0.00 0.00 54.58 51.44 1dwm n ASN 29 Cb 0.40 -0.69 0.14 0.00 1.24 0.00 0.00 39.78 40.88 1dwm n ASN 29 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 1dwm n ARG 30 N 1.85 0.18 0.02 1.20 0.63 -1.12 -1.43 116.66 117.99 1dwm n ARG 30 Ca 0.24 0.00 0.11 0.00 -0.92 0.00 0.00 57.85 57.28 1dwm n ARG 30 Cb 0.41 -1.41 -0.01 0.00 0.45 0.00 0.00 32.46 31.90 1dwm n ARG 30 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1dwm n ASN 31 N -0.91 0.62 -4.31 6.15 5.15 -1.26 -4.97 115.26 115.73 1dwm n ASN 31 Ca 0.04 -0.34 -0.16 0.00 -0.60 0.00 0.00 54.58 53.52 1dwm n ASN 31 Cb 0.02 0.91 -0.10 0.00 -0.53 0.00 0.00 39.78 40.08 1dwm n ASN 31 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1dwm s VAL 32 N -3.18 0.64 -0.01 3.44 -7.23 -0.52 -4.75 120.40 108.80 1dwm s VAL 32 Ca 0.04 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.25 1dwm s VAL 32 Cb 0.15 -2.50 -0.01 0.00 0.56 0.00 0.00 36.38 34.57 1dwm s VAL 32 CO 0.82 -0.13 -0.14 -1.38 -0.31 0.00 0.00 175.10 173.96 1dwm s HIS 33 N -3.69 1.24 -0.14 2.82 -3.43 -0.46 -4.42 115.29 107.21 1dwm s HIS 33 Ca 0.34 -0.24 -0.05 0.00 -0.80 0.00 0.00 55.06 54.31 1dwm s HIS 33 Cb 0.07 -0.79 -0.04 0.00 -1.43 0.00 0.00 32.58 30.39 1dwm s HIS 33 CO 0.11 -0.02 0.04 0.00 -2.00 0.00 0.00 174.74 172.87 1dwm s ALA 34 N -0.36 3.38 -0.31 -1.38 0.00 -1.26 -1.37 121.76 120.46 1dwm s ALA 34 Ca 0.05 -0.76 -0.11 0.00 0.00 0.00 0.00 51.96 51.14 1dwm s ALA 34 Cb -0.05 -1.73 -0.02 0.00 0.00 0.00 0.00 23.12 21.32 1dwm s ALA 34 CO -0.00 0.39 0.18 0.42 0.00 0.00 0.00 175.76 176.75 1dwm s ILE 35 N -0.26 4.95 -0.26 0.00 1.01 0.43 -4.86 121.20 122.21 1dwm s ILE 35 Ca 0.07 -0.22 -0.26 0.00 0.00 0.00 0.00 60.65 60.25 1dwm s ILE 35 Cb -0.12 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 38.87 1dwm s ILE 35 CO 0.02 0.10 0.89 -0.69 0.00 0.00 0.00 174.94 175.26 1dwm s VAL 36 N 1.68 4.76 0.05 2.92 1.01 -1.26 -0.95 120.40 128.60 1dwm s VAL 36 Ca 0.06 1.60 -0.05 0.00 0.00 0.00 0.00 61.98 63.58 1dwm s VAL 36 Cb -0.17 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 32.00 1dwm s VAL 36 CO 0.08 -0.18 0.09 -1.48 0.00 0.00 0.00 175.10 173.61 1dwm s LEU 37 N 3.04 1.86 0.42 3.92 0.05 0.71 -4.97 118.68 123.71 1dwm s LEU 37 Ca 0.37 -0.64 -0.02 0.00 0.05 0.00 0.00 54.13 53.89 1dwm s LEU 37 Cb -0.15 0.61 -0.03 0.00 -2.05 0.00 0.00 46.19 44.57 1dwm s LEU 37 CO 0.09 -0.56 0.68 -0.54 -0.55 0.00 0.00 176.35 175.47 1dwm s LYS 38 N -3.06 3.46 -0.25 1.48 1.02 -1.26 0.39 119.74 121.52 1dwm s LYS 38 Ca -0.01 -0.09 -0.36 0.00 0.02 0.00 0.00 55.97 55.53 1dwm s LYS 38 Cb 0.02 -2.51 -0.12 0.00 -0.52 0.00 0.00 37.83 34.69 1dwm s LYS 38 CO -0.07 -0.07 1.98 0.39 -0.92 0.00 0.00 175.35 176.66 1dwm n GLU 39 N -2.05 1.43 0.00 1.68 -0.58 -0.11 -1.03 120.64 119.98 1dwm n GLU 39 Ca -0.02 0.48 0.00 0.00 -0.42 0.00 0.00 57.16 57.20 1dwm n GLU 39 Cb 0.56 -2.43 0.00 0.00 -0.57 0.00 0.00 31.44 29.00 1dwm n GLU 39 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1dwm n GLY 40 N 5.26 1.08 3.41 0.62 0.00 -1.26 -5.07 105.19 109.24 1dwm n GLY 40 Ca 0.32 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.03 1dwm n GLY 40 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1dwm s SER 41 N -1.53 -0.39 -0.98 1.61 0.15 -0.20 -4.91 113.70 107.45 1dwm s SER 41 Ca 0.00 0.72 -0.17 0.00 0.70 0.00 0.00 55.95 57.19 1dwm s SER 41 Cb 0.00 -0.99 0.15 0.00 -1.71 0.00 0.00 66.02 63.47 1dwm s SER 41 CO 0.00 -4.94 1.16 0.00 1.20 0.00 0.00 173.24 170.67 1dwm s ALA 42 N -2.58 3.54 -0.38 5.45 0.00 -1.26 -4.97 121.76 121.57 1dwm s ALA 42 Ca 0.70 -2.92 -0.05 0.00 0.00 0.00 0.00 51.96 49.69 1dwm s ALA 42 Cb -0.11 -4.03 0.08 0.00 0.00 0.00 0.00 23.12 19.06 1dwm s ALA 42 CO 0.57 -2.89 0.16 0.00 0.00 0.00 0.00 175.76 173.59 1dwm s MET 43 N 2.29 2.34 0.66 0.00 0.00 -1.26 -5.09 119.30 118.23 1dwm s MET 43 Ca 0.34 -1.52 -0.16 0.00 0.00 0.00 0.00 55.69 54.35 1dwm s MET 43 Cb -0.05 -3.52 -0.00 0.00 0.00 0.00 0.00 34.83 31.26 1dwm s MET 43 CO -0.08 -0.88 1.15 0.95 0.00 0.00 0.00 175.02 176.16 1dwm s THR 44 N 1.27 2.94 -0.16 3.16 -4.23 -1.26 -4.94 115.64 112.42 1dwm s THR 44 Ca 0.02 0.47 0.15 0.00 -1.18 0.00 0.00 61.69 61.16 1dwm s THR 44 Cb -0.22 -3.03 0.07 0.00 1.34 0.00 0.00 72.50 70.66 1dwm s THR 44 CO -0.01 -0.24 1.45 0.11 -0.54 0.00 0.00 174.62 175.40 1dwm h LYS 45 N 0.17 0.00 -6.20 3.99 1.57 -1.98 -3.47 116.57 110.65 1dwm h LYS 45 Ca -0.48 0.00 -0.64 0.00 -1.87 0.00 0.00 60.65 57.66 1dwm h LYS 45 Cb 1.27 0.00 0.11 0.00 0.08 0.00 0.00 32.23 33.68 1dwm h LYS 45 CO 0.53 0.49 -0.24 -0.25 -0.57 0.00 0.00 179.45 179.41 1dwm n ASP 46 N -3.23 -0.14 -4.70 0.86 9.92 -1.26 -4.90 116.55 113.10 1dwm n ASP 46 Ca 0.02 1.15 -0.40 0.00 -0.53 0.00 0.00 54.79 55.03 1dwm n ASP 46 Cb 0.73 -1.10 -0.04 0.00 -0.64 0.00 0.00 41.12 40.07 1dwm n ASP 46 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1dwm s PHE 47 N -1.01 3.54 -0.18 1.24 5.36 -1.26 -4.83 117.98 120.83 1dwm s PHE 47 Ca 0.62 1.27 -0.04 0.00 -0.96 0.00 0.00 56.93 57.82 1dwm s PHE 47 Cb -0.83 -2.87 0.09 0.00 -0.34 0.00 0.00 43.02 39.06 1dwm s PHE 47 CO 0.58 -0.00 0.23 1.03 -1.46 0.00 0.00 175.22 175.60 1dwm s ARG 48 N 1.15 0.18 0.29 10.12 0.52 0.16 -5.01 118.95 126.36 1dwm s ARG 48 Ca 0.38 0.35 -0.02 0.00 -0.52 0.00 0.00 55.73 55.93 1dwm s ARG 48 Cb -0.18 -0.87 0.44 0.00 0.52 0.00 0.00 34.95 34.86 1dwm s ARG 48 CO 0.17 -0.56 1.94 0.00 0.02 0.00 0.00 175.30 176.88 1dwm n ASP 50 N -4.43 0.00 -3.85 0.00 5.75 -1.26 -4.55 116.55 108.21 1dwm n ASP 50 Ca 0.11 -0.89 -0.30 0.00 -0.01 0.00 0.00 54.79 53.70 1dwm n ASP 50 Cb 0.08 -0.01 -0.16 0.00 -1.03 0.00 0.00 41.12 40.01 1dwm n ASP 50 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 1dwm s ARG 51 N -2.02 1.16 -0.24 0.11 3.52 -0.34 -1.35 118.95 119.79 1dwm s ARG 51 Ca 0.44 -0.98 -0.07 0.00 -0.13 0.00 0.00 55.73 54.98 1dwm s ARG 51 Cb 0.20 -2.39 -0.03 0.00 -1.56 0.00 0.00 34.95 31.17 1dwm s ARG 51 CO 0.34 -0.74 0.07 0.08 -0.81 0.00 0.00 175.30 174.24 1dwm s VAL 52 N 1.50 4.35 0.08 7.11 1.01 -0.47 -0.46 120.40 133.52 1dwm s VAL 52 Ca 0.01 -0.16 -0.30 0.00 0.00 0.00 0.00 61.98 61.53 1dwm s VAL 52 Cb -0.18 -3.03 -0.05 0.00 0.00 0.00 0.00 36.38 33.12 1dwm s VAL 52 CO -0.12 0.35 1.03 0.26 0.00 0.00 0.00 175.10 176.61 1dwm s TRP 53 N 1.53 3.67 -0.53 5.22 0.23 -1.24 -0.43 118.94 127.39 1dwm s TRP 53 Ca 0.06 1.66 0.04 0.00 -2.03 0.00 0.00 56.10 55.83 1dwm s TRP 53 Cb -0.15 -3.17 0.14 0.00 0.03 0.00 0.00 33.47 30.32 1dwm s TRP 53 CO 0.04 -0.22 0.30 0.08 0.96 0.00 0.00 176.95 178.11 1dwm s VAL 54 N 0.43 2.24 -0.14 4.03 1.01 -0.13 -4.02 120.40 123.84 1dwm s VAL 54 Ca 0.51 -3.27 -0.29 0.00 0.00 0.00 0.00 61.98 58.92 1dwm s VAL 54 Cb -0.25 -2.54 -0.01 0.00 0.00 0.00 0.00 36.38 33.59 1dwm s VAL 54 CO 0.30 -0.88 1.02 -0.63 0.00 0.00 0.00 175.10 174.91 1dwm s ILE 55 N -0.33 4.75 0.29 2.22 1.09 -1.23 -0.21 121.20 127.79 1dwm s ILE 55 Ca 0.19 2.04 0.10 0.00 -1.10 0.00 0.00 60.65 61.88 1dwm s ILE 55 Cb -0.20 -4.31 -0.06 0.00 -1.06 0.00 0.00 42.46 36.83 1dwm s ILE 55 CO -0.04 -0.04 -0.14 0.68 -0.10 0.00 0.00 174.94 175.30 1dwm s VAL 56 N 2.30 2.22 0.05 2.92 -7.23 0.16 -0.90 120.40 119.92 1dwm s VAL 56 Ca 0.47 -2.28 -0.00 0.00 -1.81 0.00 0.00 61.98 58.36 1dwm s VAL 56 Cb -0.18 -2.41 0.01 0.00 0.56 0.00 0.00 36.38 34.36 1dwm s VAL 56 CO 0.15 -0.34 0.06 -0.46 -0.31 0.00 0.00 175.10 174.21 1dwm n ASN 57 N -0.65 0.08 0.25 4.85 0.23 0.15 -0.93 115.26 119.24 1dwm n ASN 57 Ca -0.05 -1.07 0.18 0.00 -0.53 0.00 0.00 54.58 53.10 1dwm n ASN 57 Cb 0.62 -0.04 0.85 0.00 -2.08 0.00 0.00 39.78 39.12 1dwm n ASN 57 CO 0.00 0.00 0.00 -0.78 -0.93 0.00 0.00 177.26 175.55 1dwm h ASP 58 N -0.04 0.00 -0.65 0.53 3.58 -1.98 0.13 116.42 117.98 1dwm h ASP 58 Ca -0.02 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.31 1dwm h ASP 58 Cb 0.08 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 41.06 1dwm h ASP 58 CO 0.02 0.00 0.15 1.41 -2.88 0.00 0.00 179.24 177.94 1dwm n HIS 59 N -3.32 2.24 -1.90 0.28 8.25 -1.26 -4.91 115.22 114.59 1dwm n HIS 59 Ca 0.01 -1.01 -0.20 0.00 -0.26 0.00 0.00 57.72 56.27 1dwm n HIS 59 Cb 0.39 -0.60 -0.05 0.00 1.12 0.00 0.00 29.99 30.84 1dwm n HIS 59 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1dwm n GLY 60 N 0.13 0.92 3.82 -1.41 0.00 0.44 -4.95 105.19 104.14 1dwm n GLY 60 Ca 0.35 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.99 1dwm n GLY 60 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dwm s VAL 61 N -2.79 5.09 -0.38 1.61 1.01 -1.26 -0.54 120.40 123.16 1dwm s VAL 61 Ca 0.00 0.79 -0.29 0.00 0.00 0.00 0.00 61.98 62.48 1dwm s VAL 61 Cb 0.00 -3.70 0.01 0.00 0.00 0.00 0.00 36.38 32.69 1dwm s VAL 61 CO 0.00 0.54 1.31 -0.69 0.00 0.00 0.00 175.10 176.27 1dwm s VAL 62 N -0.80 4.07 -0.12 2.92 1.01 0.87 0.34 120.40 128.69 1dwm s VAL 62 Ca 0.23 1.14 0.07 0.00 0.00 0.00 0.00 61.98 63.43 1dwm s VAL 62 Cb -0.16 -4.26 -0.24 0.00 0.00 0.00 0.00 36.38 31.73 1dwm s VAL 62 CO 0.12 -0.68 0.36 0.35 0.00 0.00 0.00 175.10 175.25 1dwm n THR 63 N 6.65 1.60 -3.90 3.92 -2.24 -0.08 0.40 114.28 120.64 1dwm n THR 63 Ca 0.15 -0.75 -0.30 0.00 -2.27 0.00 0.00 64.05 60.89 1dwm n THR 63 Cb 0.48 -1.15 -0.04 0.00 -2.10 0.00 0.00 70.33 67.52 1dwm n THR 63 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1dwm s SER 64 N -6.27 6.37 -0.46 3.42 0.15 -1.19 -4.81 113.70 110.90 1dwm s SER 64 Ca -0.14 0.27 -0.27 0.00 0.70 0.00 0.00 55.95 56.51 1dwm s SER 64 Cb 0.07 -1.96 -0.03 0.00 -1.71 0.00 0.00 66.02 62.40 1dwm s SER 64 CO 0.78 0.12 1.94 -0.69 1.20 0.00 0.00 173.24 176.59 1dwm s VAL 65 N -1.60 3.33 -0.50 4.45 1.01 -1.26 -4.60 120.40 121.23 1dwm s VAL 65 Ca 0.35 0.27 -0.26 0.00 0.00 0.00 0.00 61.98 62.35 1dwm s VAL 65 Cb -0.12 -3.63 -0.07 0.00 0.00 0.00 0.00 36.38 32.56 1dwm s VAL 65 CO 0.28 -0.52 2.40 -2.16 0.00 0.00 0.00 175.10 175.10 1dwm s PRO 66 N 6.63 2.09 0.08 2.72 0.04 -1.26 -4.80 135.00 140.50 1dwm s PRO 66 Ca 0.79 1.38 0.05 0.00 0.04 0.00 0.00 61.00 63.26 1dwm s PRO 66 Cb -0.18 -4.59 -0.03 0.00 0.04 0.00 0.00 34.50 29.74 1dwm s PRO 66 CO 0.27 -3.30 -0.15 -3.38 0.04 0.00 0.00 177.00 170.49 1dwm s HIS 67 N 12.24 1.28 -0.39 0.56 -3.43 -1.26 -0.72 115.29 123.57 1dwm s HIS 67 Ca 0.97 -0.46 -0.40 0.00 -0.80 0.00 0.00 55.06 54.37 1dwm s HIS 67 Cb -0.17 -0.71 -0.15 0.00 -1.43 0.00 0.00 32.58 30.12 1dwm s HIS 67 CO 0.26 0.07 2.04 -0.89 -2.00 0.00 0.00 174.74 174.22 1dwm n ILE 68 N 1.23 0.15 -1.92 -5.38 5.41 0.19 -3.65 119.36 115.39 1dwm n ILE 68 Ca -0.21 -0.12 0.00 0.00 1.00 0.00 0.00 62.75 63.42 1dwm n ILE 68 Cb 0.54 -1.14 0.00 0.00 -0.71 0.00 0.00 39.64 38.34 1dwm n ILE 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96