#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 0.64 -3.46 1.43 1.74 -1.26 -5.05 116.66 110.71 1dwm n ARG 2 Ca 0.00 -2.19 -0.28 0.00 -0.77 0.00 0.00 57.85 54.61 1dwm n ARG 2 Cb 0.00 -1.45 -0.11 0.00 -1.02 0.00 0.00 32.46 29.89 1dwm n ARG 2 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1dwm s ARG 3 N 0.39 0.98 0.20 5.56 3.00 -1.26 -5.12 118.95 122.70 1dwm s ARG 3 Ca 0.32 -2.05 -0.20 0.00 0.00 0.00 0.00 55.73 53.79 1dwm s ARG 3 Cb 0.14 -1.59 -0.08 0.00 0.00 0.00 0.00 34.95 33.42 1dwm s ARG 3 CO -0.17 -1.34 0.72 0.00 0.00 0.00 0.00 175.30 174.51 1dwm n PRO 5 N 0.89 -3.53 -1.42 0.00 -0.02 -1.26 -4.90 135.00 124.76 1dwm n PRO 5 Ca -0.03 -1.08 0.18 0.00 -2.02 0.00 0.00 63.50 60.55 1dwm n PRO 5 Cb 0.51 -1.26 -0.07 0.00 -0.02 0.00 0.00 33.50 32.66 1dwm n PRO 5 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dwm n GLY 6 N -3.55 -2.61 3.75 -1.23 0.00 -1.26 -4.81 105.19 95.48 1dwm n GLY 6 Ca 0.10 -1.02 -0.35 0.00 0.00 0.00 0.00 46.02 44.74 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 -3.42 2.87 -0.01 1.61 2.20 -1.26 -4.97 119.74 116.77 1dwm s LYS 7 Ca 0.00 1.76 0.10 0.00 -0.36 0.00 0.00 55.97 57.47 1dwm s LYS 7 Cb 0.00 -1.92 -0.13 0.00 -1.51 0.00 0.00 37.83 34.27 1dwm s LYS 7 CO 0.00 -1.27 0.32 0.09 -0.36 0.00 0.00 175.35 174.13 1dwm n ASN 8 N -1.80 1.56 -3.72 1.43 3.02 -1.26 -4.87 115.26 109.63 1dwm n ASN 8 Ca 0.13 -0.37 -0.12 0.00 -0.03 0.00 0.00 54.58 54.20 1dwm n ASN 8 Cb 0.50 1.23 -0.12 0.00 -0.61 0.00 0.00 39.78 40.78 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 -2.30 -0.80 -0.70 5.41 0.00 -1.26 0.67 121.76 122.78 1dwm s ALA 9 Ca 0.00 1.23 0.04 0.00 0.00 0.00 0.00 51.96 53.23 1dwm s ALA 9 Cb 0.07 -0.76 0.28 0.00 0.00 0.00 0.00 23.12 22.71 1dwm s ALA 9 CO 0.41 -0.22 0.93 0.91 0.00 0.00 0.00 175.76 177.79 1dwm n TRP 10 N 4.13 3.54 -0.13 0.00 8.01 0.15 -4.88 117.44 128.25 1dwm n TRP 10 Ca -0.23 -3.86 0.12 0.00 -1.31 0.00 0.00 57.50 52.22 1dwm n TRP 10 Cb 0.54 -0.66 0.47 0.00 -2.01 0.00 0.00 31.31 29.66 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 4.06 0.46 0.00 -0.99 0.13 -1.90 0.98 132.00 134.74 1dwm h PRO 11 Ca 0.20 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1dwm h PRO 11 Cb 0.60 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.63 1dwm h PRO 11 CO 0.91 0.31 0.00 -0.85 -0.23 0.00 0.00 178.00 178.14 1dwm n GLU 12 N -4.48 0.01 0.15 0.86 0.00 -1.26 -1.25 120.64 114.68 1dwm n GLU 12 Ca 0.12 0.42 0.06 0.00 0.00 0.00 0.00 57.16 57.75 1dwm n GLU 12 Cb 0.40 -1.54 0.06 0.00 0.00 0.00 0.00 31.44 30.36 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 -9.20 -1.84 3.38 -1.19 -3.46 115.31 103.00 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 0.10 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.86 1dwm h LEU 13 CO 0.00 0.32 1.16 0.52 0.09 0.00 0.00 178.44 180.53 1dwm n VAL 14 N -3.11 0.55 0.00 1.22 0.31 -0.38 -0.78 118.33 116.13 1dwm n VAL 14 Ca 0.01 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 1dwm n VAL 14 Cb 0.67 -1.93 0.00 0.00 -0.91 0.00 0.00 33.84 31.67 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 4.68 0.45 2.17 2.92 0.00 0.35 -5.01 105.19 110.75 1dwm n GLY 15 Ca 0.24 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.15 1dwm n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dwm n LYS 16 N -1.44 0.53 -2.97 1.61 4.76 0.04 -4.74 118.16 115.94 1dwm n LYS 16 Ca 0.00 -1.64 -0.38 0.00 -2.87 0.00 0.00 58.31 53.42 1dwm n LYS 16 Cb 0.00 -0.24 -0.06 0.00 -1.84 0.00 0.00 35.03 32.89 1dwm n LYS 16 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1dwm s SER 17 N -3.12 7.27 0.48 4.39 1.04 -1.26 0.15 113.70 122.66 1dwm s SER 17 Ca 0.35 1.62 0.23 0.00 0.48 0.00 0.00 55.95 58.63 1dwm s SER 17 Cb -0.02 -2.49 1.28 0.00 0.10 0.00 0.00 66.02 64.88 1dwm s SER 17 CO 0.23 0.09 1.91 1.23 0.98 0.00 0.00 173.24 177.67 1dwm h GLY 18 N 3.76 0.37 0.72 7.32 0.00 -1.18 0.15 103.07 114.20 1dwm h GLY 18 Ca -0.47 -0.08 -0.03 0.00 0.00 0.00 0.00 47.33 46.75 1dwm h GLY 18 CO 0.66 0.01 -0.04 -0.57 0.00 0.00 0.00 176.54 176.59 1dwm h ASN 19 N 0.19 0.23 -0.21 0.19 -0.73 -1.92 -0.62 115.58 112.70 1dwm h ASN 19 Ca 0.39 -0.39 -0.05 0.00 1.87 0.00 0.00 56.30 58.12 1dwm h ASN 19 Cb 1.26 -0.06 -0.02 0.00 0.27 0.00 0.00 38.32 39.77 1dwm h ASN 19 CO -0.07 0.57 -0.02 -0.03 -0.37 0.00 0.00 177.43 177.50 1dwm h MET 20 N -0.11 0.51 0.76 6.67 4.05 -1.48 -0.69 114.93 124.64 1dwm h MET 20 Ca 0.03 -0.11 -0.04 0.00 -0.28 0.00 0.00 59.70 59.30 1dwm h MET 20 Cb 0.47 -0.07 0.01 0.00 -0.80 0.00 0.00 31.60 31.21 1dwm h MET 20 CO 0.01 0.55 -0.37 0.00 0.23 0.00 0.00 176.91 177.34 1dwm h ALA 21 N 1.50 -1.11 -1.00 0.39 0.00 -0.60 0.12 119.26 118.57 1dwm h ALA 21 Ca 0.10 -0.22 0.13 0.00 0.00 0.00 0.00 54.91 54.92 1dwm h ALA 21 Cb 0.34 0.40 -0.09 0.00 0.00 0.00 0.00 17.79 18.44 1dwm h ALA 21 CO 0.01 -1.03 0.62 0.00 0.00 0.00 0.00 179.25 178.85 1dwm h ALA 22 N -1.38 1.53 -0.48 0.00 0.00 -1.03 -0.35 119.26 117.56 1dwm h ALA 22 Ca -0.10 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1dwm h ALA 22 Cb 0.78 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1dwm h ALA 22 CO 0.17 0.17 0.24 0.00 0.00 0.00 0.00 179.25 179.83 1dwm h ALA 23 N 1.56 0.61 -0.71 0.00 0.00 -1.03 -0.93 119.26 118.76 1dwm h ALA 23 Ca 0.51 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.31 1dwm h ALA 23 Cb 0.57 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1dwm h ALA 23 CO -0.29 0.16 0.40 1.15 0.00 0.00 0.00 179.25 180.66 1dwm h THR 24 N 0.63 1.21 -0.08 0.00 2.02 0.62 0.26 112.91 117.57 1dwm h THR 24 Ca 0.17 -0.52 -0.00 0.00 0.77 0.00 0.00 66.41 66.82 1dwm h THR 24 Cb 0.09 0.27 -0.00 0.00 -1.74 0.00 0.00 68.15 66.77 1dwm h THR 24 CO -0.02 0.23 0.03 0.58 0.37 0.00 0.00 175.52 176.71 1dwm h VAL 25 N 0.97 1.14 -0.06 3.16 2.07 -0.86 0.31 116.25 122.97 1dwm h VAL 25 Ca 0.25 -0.42 -0.10 0.00 0.82 0.00 0.00 66.70 67.25 1dwm h VAL 25 Cb 0.02 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1dwm h VAL 25 CO -0.04 0.12 -0.42 -0.33 0.02 0.00 0.00 177.57 176.91 1dwm h GLU 26 N -0.03 0.14 0.01 1.57 4.39 -0.98 0.36 114.58 120.03 1dwm h GLU 26 Ca 0.03 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.66 1dwm h GLU 26 Cb 0.16 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1dwm h GLU 26 CO -0.00 0.54 -0.00 0.00 -1.16 0.00 0.00 179.01 178.39 1dwm h ARG 27 N 0.12 -0.01 -0.23 2.33 3.08 -0.30 -2.88 114.38 116.49 1dwm h ARG 27 Ca 0.01 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.89 1dwm h ARG 27 Cb 0.80 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.85 1dwm h ARG 27 CO 0.06 0.80 -0.54 0.93 -1.07 0.00 0.00 179.97 180.15 1dwm h GLU 28 N -0.89 0.67 -2.93 0.04 5.08 -0.43 -3.36 114.58 112.77 1dwm h GLU 28 Ca -0.00 -0.42 -0.62 0.00 -1.00 0.00 0.00 59.36 57.31 1dwm h GLU 28 Cb 0.82 0.05 -0.42 0.00 0.50 0.00 0.00 28.75 29.70 1dwm h GLU 28 CO 0.00 1.04 -0.54 -1.71 -1.00 0.00 0.00 179.01 176.80 1dwm n ASN 29 N -3.98 3.25 0.00 1.42 2.85 0.13 -4.53 115.26 114.40 1dwm n ASN 29 Ca -0.03 -3.26 0.04 0.00 -0.11 0.00 0.00 54.58 51.22 1dwm n ASN 29 Cb 0.61 -0.76 0.24 0.00 1.24 0.00 0.00 39.78 41.11 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 1.76 0.25 0.00 1.20 3.00 -1.09 -1.48 116.66 120.31 1dwm n ARG 30 Ca 0.22 0.00 0.11 0.00 -0.00 0.00 0.00 57.85 58.18 1dwm n ARG 30 Cb 0.36 -1.50 0.08 0.00 0.00 0.00 0.00 32.46 31.40 1dwm n ARG 30 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1dwm n ASN 31 N -1.00 0.77 -4.20 6.15 5.15 -1.26 -4.96 115.26 115.91 1dwm n ASN 31 Ca 0.06 -0.64 -0.12 0.00 -0.60 0.00 0.00 54.58 53.29 1dwm n ASN 31 Cb 0.03 0.60 -0.10 0.00 -0.53 0.00 0.00 39.78 39.78 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 -2.98 0.15 0.03 3.44 -7.23 -0.55 -4.79 120.40 108.47 1dwm s VAL 32 Ca 0.10 -1.97 0.05 0.00 -1.81 0.00 0.00 61.98 58.36 1dwm s VAL 32 Cb 0.17 -2.33 -0.02 0.00 0.56 0.00 0.00 36.38 34.76 1dwm s VAL 32 CO 0.77 -0.19 -0.16 -1.38 -0.31 0.00 0.00 175.10 173.83 1dwm s HIS 33 N -4.04 1.41 -0.14 2.82 -3.43 -0.56 -4.41 115.29 106.94 1dwm s HIS 33 Ca 0.33 -0.33 -0.03 0.00 -0.80 0.00 0.00 55.06 54.22 1dwm s HIS 33 Cb 0.07 -0.85 -0.03 0.00 -1.43 0.00 0.00 32.58 30.34 1dwm s HIS 33 CO 0.08 0.04 -0.05 0.00 -2.00 0.00 0.00 174.74 172.81 1dwm s ALA 34 N -0.72 2.95 -0.21 -1.38 0.00 -1.26 -0.97 121.76 120.18 1dwm s ALA 34 Ca 0.04 -0.83 -0.08 0.00 0.00 0.00 0.00 51.96 51.09 1dwm s ALA 34 Cb -0.08 -1.48 -0.04 0.00 0.00 0.00 0.00 23.12 21.53 1dwm s ALA 34 CO 0.01 0.26 0.09 0.42 0.00 0.00 0.00 175.76 176.54 1dwm s ILE 35 N 0.21 4.86 -0.22 0.00 1.01 0.31 -4.78 121.20 122.59 1dwm s ILE 35 Ca -0.03 -0.00 -0.26 0.00 0.00 0.00 0.00 60.65 60.36 1dwm s ILE 35 Cb -0.14 -3.22 -0.01 0.00 0.01 0.00 0.00 42.46 39.10 1dwm s ILE 35 CO 0.03 0.41 0.87 -0.69 0.00 0.00 0.00 174.94 175.56 1dwm s VAL 36 N 0.73 4.82 0.05 2.92 1.01 -1.26 -0.38 120.40 128.30 1dwm s VAL 36 Ca 0.05 1.67 -0.09 0.00 0.00 0.00 0.00 61.98 63.61 1dwm s VAL 36 Cb -0.13 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 32.09 1dwm s VAL 36 CO 0.02 -0.06 0.19 -1.48 0.00 0.00 0.00 175.10 173.77 1dwm s LEU 37 N 2.68 1.38 0.47 3.92 0.05 0.66 -4.94 118.68 122.91 1dwm s LEU 37 Ca 0.38 -0.42 -0.03 0.00 0.05 0.00 0.00 54.13 54.11 1dwm s LEU 37 Cb -0.16 0.97 -0.02 0.00 -2.05 0.00 0.00 46.19 44.93 1dwm s LEU 37 CO 0.09 -0.59 0.73 -0.54 -0.55 0.00 0.00 176.35 175.49 1dwm s LYS 38 N -2.79 3.27 -0.00 1.48 1.02 -1.26 -0.11 119.74 121.34 1dwm s LYS 38 Ca -0.03 -0.14 -0.36 0.00 0.02 0.00 0.00 55.97 55.47 1dwm s LYS 38 Cb -0.00 -2.46 -0.14 0.00 -0.52 0.00 0.00 37.83 34.71 1dwm s LYS 38 CO -0.05 -0.26 1.66 0.39 -0.92 0.00 0.00 175.35 176.17 1dwm n GLU 39 N -2.19 1.81 -0.11 1.68 -0.58 -0.01 -0.98 120.64 120.26 1dwm n GLU 39 Ca 0.01 0.66 0.00 0.00 -0.42 0.00 0.00 57.16 57.40 1dwm n GLU 39 Cb 0.57 -2.41 0.00 0.00 -0.57 0.00 0.00 31.44 29.02 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 3.69 0.55 3.71 0.62 0.00 -1.26 -5.04 105.19 107.46 1dwm n GLY 40 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 1dwm n GLY 40 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1dwm n SER 41 N 0.00 3.37 -4.58 1.61 2.88 -0.16 -4.80 113.62 111.95 1dwm n SER 41 Ca 0.00 1.14 -0.18 0.00 -1.33 0.00 0.00 58.87 58.50 1dwm n SER 41 Cb 0.00 -1.52 -0.10 0.00 -0.75 0.00 0.00 64.21 61.84 1dwm n SER 41 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1dwm s ALA 42 N 0.04 0.76 -0.08 -1.46 0.00 -1.26 -4.86 121.76 114.90 1dwm s ALA 42 Ca 0.67 -1.57 0.03 0.00 0.00 0.00 0.00 51.96 51.09 1dwm s ALA 42 Cb -0.57 -4.69 0.01 0.00 0.00 0.00 0.00 23.12 17.87 1dwm s ALA 42 CO 0.48 -6.51 -0.18 -1.64 0.00 0.00 0.00 175.76 167.92 1dwm s MET 43 N 8.07 2.30 0.72 0.00 1.00 -1.26 -5.12 119.30 125.01 1dwm s MET 43 Ca 0.79 -0.63 -0.16 0.00 0.00 0.00 0.00 55.69 55.70 1dwm s MET 43 Cb -0.05 -1.81 0.01 0.00 0.00 0.00 0.00 34.83 32.98 1dwm s MET 43 CO 0.16 0.10 0.99 0.25 0.00 0.00 0.00 175.02 176.53 1dwm n THR 44 N 3.66 2.95 0.09 2.05 -2.24 -1.26 -4.92 114.28 114.59 1dwm n THR 44 Ca -0.21 -0.38 0.05 0.00 -2.27 0.00 0.00 64.05 61.24 1dwm n THR 44 Cb 0.52 -1.13 -0.02 0.00 -2.10 0.00 0.00 70.33 67.60 1dwm n THR 44 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1dwm h LYS 45 N -0.20 0.00 -5.32 -0.78 6.56 -2.00 -3.48 116.57 111.35 1dwm h LYS 45 Ca -0.48 0.00 -0.52 0.00 -1.06 0.00 0.00 60.65 58.59 1dwm h LYS 45 Cb 1.33 0.00 0.17 0.00 -0.57 0.00 0.00 32.23 33.17 1dwm h LYS 45 CO 0.47 0.21 -1.19 -3.47 -2.06 0.00 0.00 179.45 173.41 1dwm n ASP 46 N -2.89 -3.80 -4.76 0.86 -0.08 -1.26 -4.91 116.55 99.71 1dwm n ASP 46 Ca -0.04 0.47 -0.38 0.00 -1.51 0.00 0.00 54.79 53.34 1dwm n ASP 46 Cb 0.71 -0.73 -0.06 0.00 2.34 0.00 0.00 41.12 43.37 1dwm n ASP 46 CO 0.00 0.00 0.00 0.12 0.12 0.00 0.00 177.20 177.44 1dwm s PHE 47 N -1.77 3.57 -0.23 -0.67 2.19 -1.26 -4.84 117.98 114.97 1dwm s PHE 47 Ca 0.47 0.85 -0.03 0.00 0.33 0.00 0.00 56.93 58.54 1dwm s PHE 47 Cb -0.37 -2.42 0.12 0.00 -1.31 0.00 0.00 43.02 39.04 1dwm s PHE 47 CO 0.63 0.33 0.33 1.03 1.83 0.00 0.00 175.22 179.36 1dwm s ARG 48 N 0.07 0.29 0.36 10.12 0.52 0.19 -5.02 118.95 125.49 1dwm s ARG 48 Ca 0.23 0.46 0.04 0.00 -0.52 0.00 0.00 55.73 55.94 1dwm s ARG 48 Cb -0.15 -0.66 0.69 0.00 0.52 0.00 0.00 34.95 35.36 1dwm s ARG 48 CO 0.10 -0.62 2.01 0.00 0.02 0.00 0.00 175.30 176.81 1dwm n ASP 50 N -4.45 0.00 -4.00 0.00 5.75 -1.26 -4.70 116.55 107.88 1dwm n ASP 50 Ca 0.06 -1.01 -0.24 0.00 -0.01 0.00 0.00 54.79 53.60 1dwm n ASP 50 Cb 0.07 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 39.99 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 -2.00 1.56 -0.15 0.11 3.52 -0.25 -1.50 118.95 120.24 1dwm s ARG 51 Ca 0.41 -0.36 0.00 0.00 -0.13 0.00 0.00 55.73 55.64 1dwm s ARG 51 Cb 0.19 -1.32 0.03 0.00 -1.56 0.00 0.00 34.95 32.29 1dwm s ARG 51 CO 0.31 0.01 -0.10 0.08 -0.81 0.00 0.00 175.30 174.80 1dwm s VAL 52 N 0.70 1.34 0.08 7.11 1.01 -0.14 -0.39 120.40 130.12 1dwm s VAL 52 Ca -0.14 -0.60 -0.30 0.00 0.00 0.00 0.00 61.98 60.93 1dwm s VAL 52 Cb -0.16 -1.36 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 1dwm s VAL 52 CO 0.03 0.31 1.01 0.26 0.00 0.00 0.00 175.10 176.72 1dwm s TRP 53 N 1.56 3.69 -0.75 5.22 0.23 -1.24 -0.53 118.94 127.13 1dwm s TRP 53 Ca 0.03 1.69 0.01 0.00 -2.03 0.00 0.00 56.10 55.79 1dwm s TRP 53 Cb -0.14 -3.15 0.18 0.00 0.03 0.00 0.00 33.47 30.40 1dwm s TRP 53 CO -0.09 -0.14 0.58 0.08 0.96 0.00 0.00 176.95 178.33 1dwm s VAL 54 N 0.39 3.60 -0.18 4.03 1.01 0.49 -4.28 120.40 125.46 1dwm s VAL 54 Ca 0.50 -3.78 -0.29 0.00 0.00 0.00 0.00 61.98 58.40 1dwm s VAL 54 Cb -0.24 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 32.83 1dwm s VAL 54 CO 0.30 -0.99 1.03 -0.63 0.00 0.00 0.00 175.10 174.81 1dwm s ILE 55 N -1.05 4.70 0.28 2.22 1.01 -1.21 -0.24 121.20 126.91 1dwm s ILE 55 Ca 0.24 2.02 0.06 0.00 0.00 0.00 0.00 60.65 62.97 1dwm s ILE 55 Cb -0.11 -4.30 -0.06 0.00 0.01 0.00 0.00 42.46 38.00 1dwm s ILE 55 CO -0.11 -0.11 -0.05 0.68 0.00 0.00 0.00 174.94 175.35 1dwm s VAL 56 N 2.77 1.59 0.51 2.92 -7.23 0.84 -0.83 120.40 120.98 1dwm s VAL 56 Ca 0.46 -2.11 -0.06 0.00 -1.81 0.00 0.00 61.98 58.46 1dwm s VAL 56 Cb -0.16 -2.49 0.11 0.00 0.56 0.00 0.00 36.38 34.40 1dwm s VAL 56 CO 0.11 -0.27 0.69 -0.46 -0.31 0.00 0.00 175.10 174.86 1dwm n ASN 57 N -0.59 0.30 0.30 4.85 0.23 0.81 -0.83 115.26 120.33 1dwm n ASN 57 Ca -0.05 -1.40 0.20 0.00 -0.53 0.00 0.00 54.58 52.80 1dwm n ASN 57 Cb 0.64 -0.51 1.07 0.00 -2.08 0.00 0.00 39.78 38.90 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 -0.77 0.00 1.04 0.53 1.82 -1.98 0.26 116.42 117.32 1dwm h ASP 58 Ca -0.23 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.41 1dwm h ASP 58 Cb 0.68 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.69 1dwm h ASP 58 CO 0.18 0.00 -0.95 -0.74 -1.61 0.00 0.00 179.24 176.12 1dwm h HIS 59 N 0.00 0.00 0.00 0.28 2.76 -2.04 -3.48 115.15 112.67 1dwm h HIS 59 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1dwm h HIS 59 Cb 0.04 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.00 1dwm h HIS 59 CO 0.00 0.00 0.00 0.41 -1.30 0.00 0.00 177.93 177.04 1dwm n GLY 60 N 1.18 1.12 3.76 5.26 0.00 0.08 -5.03 105.19 111.56 1dwm n GLY 60 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.00 5.27 -0.31 1.61 1.01 -1.26 -0.60 120.40 124.11 1dwm s VAL 61 Ca 0.00 0.60 -0.29 0.00 0.00 0.00 0.00 61.98 62.29 1dwm s VAL 61 Cb 0.00 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.73 1dwm s VAL 61 CO 0.00 0.44 1.70 -0.69 0.00 0.00 0.00 175.10 176.56 1dwm s VAL 62 N 0.04 3.58 -0.06 2.92 1.01 0.12 -0.13 120.40 127.88 1dwm s VAL 62 Ca 0.18 0.61 0.13 0.00 0.00 0.00 0.00 61.98 62.90 1dwm s VAL 62 Cb -0.14 -3.73 -0.22 0.00 0.00 0.00 0.00 36.38 32.29 1dwm s VAL 62 CO 0.06 -0.43 0.64 0.35 0.00 0.00 0.00 175.10 175.72 1dwm n THR 63 N 7.15 1.55 -4.07 3.92 -2.24 -0.01 -0.50 114.28 120.09 1dwm n THR 63 Ca 0.21 -0.79 -0.31 0.00 -2.27 0.00 0.00 64.05 60.89 1dwm n THR 63 Cb 0.46 -0.97 -0.07 0.00 -2.10 0.00 0.00 70.33 67.66 1dwm n THR 63 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1dwm s SER 64 N -6.01 5.61 -0.36 3.42 0.01 -1.19 -4.88 113.70 110.29 1dwm s SER 64 Ca -0.05 0.06 -0.27 0.00 1.31 0.00 0.00 55.95 56.99 1dwm s SER 64 Cb 0.08 -1.55 -0.04 0.00 0.21 0.00 0.00 66.02 64.72 1dwm s SER 64 CO 0.82 0.21 2.09 -0.69 0.41 0.00 0.00 173.24 176.08 1dwm s VAL 65 N -1.32 3.19 -0.61 3.43 1.01 -1.26 -4.64 120.40 120.19 1dwm s VAL 65 Ca 0.27 0.17 -0.26 0.00 0.00 0.00 0.00 61.98 62.16 1dwm s VAL 65 Cb -0.12 -3.32 -0.11 0.00 0.00 0.00 0.00 36.38 32.83 1dwm s VAL 65 CO 0.19 -0.24 2.45 -2.65 0.00 0.00 0.00 175.10 174.85 1dwm n PRO 66 N 8.78 0.81 -4.46 2.72 -0.02 -1.25 -4.75 135.00 136.82 1dwm n PRO 66 Ca 0.28 -0.13 -0.22 0.00 -2.02 0.00 0.00 63.50 61.41 1dwm n PRO 66 Cb 0.49 -3.18 -0.10 0.00 -0.02 0.00 0.00 33.50 30.68 1dwm n PRO 66 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1dwm s HIS 67 N 11.94 2.04 -0.35 6.00 -3.43 -1.26 0.30 115.29 130.53 1dwm s HIS 67 Ca 1.03 -0.74 -0.28 0.00 -0.80 0.00 0.00 55.06 54.28 1dwm s HIS 67 Cb -0.32 -1.24 -0.04 0.00 -1.43 0.00 0.00 32.58 29.55 1dwm s HIS 67 CO 0.27 0.26 2.04 0.42 -2.00 0.00 0.00 174.74 175.73 1dwm s ILE 68 N -3.01 3.23 0.00 -5.38 1.01 0.21 -3.61 121.20 113.65 1dwm s ILE 68 Ca 0.32 0.22 0.00 0.00 0.00 0.00 0.00 60.65 61.19 1dwm s ILE 68 Cb 0.05 -3.37 0.00 0.00 0.01 0.00 0.00 42.46 39.15 1dwm s ILE 68 CO 0.14 -0.27 0.00 0.41 0.00 0.00 0.00 174.94 175.21