#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 -2.19 -3.07 1.43 1.74 -1.26 -5.05 116.66 108.27 1dwm n ARG 2 Ca 0.00 1.86 0.03 0.00 -0.77 0.00 0.00 57.85 58.96 1dwm n ARG 2 Cb 0.00 -4.03 -0.00 0.00 -1.02 0.00 0.00 32.46 27.41 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 -2.32 0.46 0.16 5.56 1.81 -1.26 -5.17 118.95 118.19 1dwm s ARG 3 Ca 0.25 0.05 0.09 0.00 -1.72 0.00 0.00 55.73 54.40 1dwm s ARG 3 Cb -0.05 0.10 -0.04 0.00 -0.45 0.00 0.00 34.95 34.52 1dwm s ARG 3 CO 0.75 -0.72 -0.12 0.00 -0.68 0.00 0.00 175.30 174.52 1dwm n PRO 5 N 0.26 -0.41 -0.98 0.00 -0.02 -1.26 -4.81 135.00 127.77 1dwm n PRO 5 Ca -0.12 -0.06 0.13 0.00 -2.02 0.00 0.00 63.50 61.43 1dwm n PRO 5 Cb 0.55 -2.19 -0.04 0.00 -0.02 0.00 0.00 33.50 31.80 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 0.73 -2.23 3.77 -1.23 0.00 -1.26 -4.83 105.19 100.13 1dwm n GLY 6 Ca 0.10 -1.24 -0.38 0.00 0.00 0.00 0.00 46.02 44.50 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 -2.58 3.72 0.00 1.61 2.20 -1.26 -4.96 119.74 118.47 1dwm s LYS 7 Ca 0.00 1.91 0.16 0.00 -0.36 0.00 0.00 55.97 57.68 1dwm s LYS 7 Cb 0.00 -2.46 -0.04 0.00 -1.51 0.00 0.00 37.83 33.82 1dwm s LYS 7 CO 0.00 -0.62 0.82 0.09 -0.36 0.00 0.00 175.35 175.28 1dwm n ASN 8 N -0.42 1.45 -3.64 1.43 4.13 -1.26 -4.80 115.26 112.14 1dwm n ASN 8 Ca 0.07 -1.22 -0.06 0.00 1.68 0.00 0.00 54.58 55.04 1dwm n ASN 8 Cb 0.47 0.58 -0.07 0.00 -1.54 0.00 0.00 39.78 39.22 1dwm n ASN 8 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1dwm s ALA 9 N -2.03 -1.89 -0.80 5.41 0.00 -1.26 0.75 121.76 121.94 1dwm s ALA 9 Ca 0.12 2.40 0.02 0.00 0.00 0.00 0.00 51.96 54.50 1dwm s ALA 9 Cb 0.13 -1.48 0.27 0.00 0.00 0.00 0.00 23.12 22.04 1dwm s ALA 9 CO 0.46 -0.47 1.03 0.91 0.00 0.00 0.00 175.76 177.68 1dwm n TRP 10 N 4.51 3.14 -0.26 0.00 8.01 -0.39 -4.88 117.44 127.58 1dwm n TRP 10 Ca -0.19 -3.57 0.09 0.00 -1.31 0.00 0.00 57.50 52.53 1dwm n TRP 10 Cb 0.57 -0.81 0.34 0.00 -2.01 0.00 0.00 31.31 29.40 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 4.62 0.75 0.00 -0.99 0.13 -1.94 0.28 132.00 134.85 1dwm h PRO 11 Ca 0.20 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1dwm h PRO 11 Cb 0.64 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.60 1dwm h PRO 11 CO 1.02 0.50 0.00 -0.85 -0.23 0.00 0.00 178.00 178.44 1dwm n GLU 12 N -4.53 0.10 0.15 0.86 0.00 -1.26 -1.53 120.64 114.43 1dwm n GLU 12 Ca 0.15 0.22 0.12 0.00 0.00 0.00 0.00 57.16 57.66 1dwm n GLU 12 Cb 0.36 -1.50 0.13 0.00 0.00 0.00 0.00 31.44 30.44 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 -9.06 -1.84 3.38 -1.33 -3.46 115.31 103.00 1dwm h LEU 13 Ca 0.00 -0.02 -0.59 0.00 0.09 0.00 0.00 57.88 57.36 1dwm h LEU 13 Cb 0.08 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.83 1dwm h LEU 13 CO 0.00 0.01 1.39 0.52 0.09 0.00 0.00 178.44 180.45 1dwm n VAL 14 N -2.76 0.46 0.00 1.22 0.31 -0.58 -0.95 118.33 116.02 1dwm n VAL 14 Ca 0.03 -0.33 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 1dwm n VAL 14 Cb 0.52 -2.36 0.00 0.00 -0.91 0.00 0.00 33.84 31.09 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 5.41 1.43 3.94 2.92 0.00 -0.13 -5.04 105.19 113.72 1dwm n GLY 15 Ca 0.28 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.05 1dwm n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dwm s LYS 16 N -0.24 3.39 0.51 1.61 -0.14 -0.13 -4.76 119.74 119.98 1dwm s LYS 16 Ca 0.00 -0.67 -0.22 0.00 -1.36 0.00 0.00 55.97 53.72 1dwm s LYS 16 Cb 0.00 -2.92 -0.07 0.00 -1.68 0.00 0.00 37.83 33.16 1dwm s LYS 16 CO 0.00 0.49 1.19 -1.13 -0.76 0.00 0.00 175.35 175.14 1dwm n SER 17 N -0.77 1.97 -0.12 2.83 3.41 -1.26 0.34 113.62 120.02 1dwm n SER 17 Ca -0.08 0.98 0.19 0.00 -0.26 0.00 0.00 58.87 59.70 1dwm n SER 17 Cb 0.55 -1.48 0.60 0.00 -0.26 0.00 0.00 64.21 63.62 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 1.39 0.40 0.72 5.00 0.00 -1.01 -0.63 103.07 108.93 1dwm h GLY 18 Ca -0.49 -0.10 -0.04 0.00 0.00 0.00 0.00 47.33 46.71 1dwm h GLY 18 CO 0.56 0.02 -0.08 3.43 0.00 0.00 0.00 176.54 180.48 1dwm h ASN 19 N 0.22 0.29 -0.50 0.19 4.21 -1.89 -0.78 115.58 117.33 1dwm h ASN 19 Ca 0.35 -0.44 -0.02 0.00 1.21 0.00 0.00 56.30 57.40 1dwm h ASN 19 Cb 1.05 -0.08 -0.02 0.00 -1.12 0.00 0.00 38.32 38.15 1dwm h ASN 19 CO -0.07 0.67 0.23 -0.03 -1.29 0.00 0.00 177.43 176.94 1dwm h MET 20 N -0.08 0.72 0.27 0.81 4.05 -1.59 -0.98 114.93 118.13 1dwm h MET 20 Ca 0.03 -0.11 -0.01 0.00 -0.28 0.00 0.00 59.70 59.32 1dwm h MET 20 Cb 0.56 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.24 1dwm h MET 20 CO 0.02 0.61 -0.13 0.00 0.23 0.00 0.00 176.91 177.65 1dwm h ALA 21 N 1.07 -0.36 -0.68 0.39 0.00 -1.16 0.14 119.26 118.67 1dwm h ALA 21 Ca 0.17 -0.08 0.12 0.00 0.00 0.00 0.00 54.91 55.12 1dwm h ALA 21 Cb 0.13 0.14 -0.09 0.00 0.00 0.00 0.00 17.79 17.97 1dwm h ALA 21 CO -0.02 -0.69 0.25 0.00 0.00 0.00 0.00 179.25 178.78 1dwm h ALA 22 N 0.37 0.91 -0.68 0.00 0.00 -0.99 0.12 119.26 118.98 1dwm h ALA 22 Ca -0.04 0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1dwm h ALA 22 Cb 0.28 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1dwm h ALA 22 CO 0.06 -0.21 0.16 0.00 0.00 0.00 0.00 179.25 179.26 1dwm h ALA 23 N 1.49 0.99 -0.59 0.00 0.00 -0.85 -0.88 119.26 119.42 1dwm h ALA 23 Ca 0.36 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1dwm h ALA 23 Cb 0.51 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1dwm h ALA 23 CO -0.37 0.65 0.31 1.15 0.00 0.00 0.00 179.25 181.00 1dwm h THR 24 N 1.03 1.20 -0.09 0.00 2.02 0.13 0.36 112.91 117.56 1dwm h THR 24 Ca 0.21 -0.51 -0.02 0.00 0.77 0.00 0.00 66.41 66.87 1dwm h THR 24 Cb 0.37 0.46 -0.00 0.00 -1.74 0.00 0.00 68.15 67.24 1dwm h THR 24 CO 0.00 0.21 -0.01 0.58 0.37 0.00 0.00 175.52 176.68 1dwm h VAL 25 N 0.79 1.27 -0.06 3.16 2.07 -0.60 0.41 116.25 123.30 1dwm h VAL 25 Ca 0.21 -0.88 -0.08 0.00 0.82 0.00 0.00 66.70 66.77 1dwm h VAL 25 Cb 0.06 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 1dwm h VAL 25 CO -0.03 0.25 -0.33 -0.33 0.02 0.00 0.00 177.57 177.14 1dwm h GLU 26 N -0.14 0.11 0.00 1.57 4.39 -1.04 0.25 114.58 119.72 1dwm h GLU 26 Ca 0.02 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 1dwm h GLU 26 Cb 0.39 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.03 1dwm h GLU 26 CO 0.01 0.44 -0.16 -0.09 -1.16 0.00 0.00 179.01 178.04 1dwm h ARG 27 N 0.10 0.00 -0.22 2.33 2.43 -0.19 -3.04 114.38 115.79 1dwm h ARG 27 Ca 0.01 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.12 1dwm h ARG 27 Cb 0.64 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 1dwm h ARG 27 CO 0.05 0.66 -0.14 0.93 -1.51 0.00 0.00 179.97 179.96 1dwm h GLU 28 N -1.00 0.36 -2.83 0.20 5.08 -0.22 -3.34 114.58 112.83 1dwm h GLU 28 Ca -0.04 -0.10 -0.61 0.00 -1.00 0.00 0.00 59.36 57.62 1dwm h GLU 28 Cb 0.72 -0.04 -0.40 0.00 0.50 0.00 0.00 28.75 29.53 1dwm h GLU 28 CO -0.02 0.51 -0.73 1.21 -1.00 0.00 0.00 179.01 178.97 1dwm s ASN 29 N -6.82 3.51 0.00 1.42 3.84 0.87 -4.58 114.94 113.17 1dwm s ASN 29 Ca -0.06 -3.44 0.05 0.00 0.21 0.00 0.00 52.86 49.61 1dwm s ASN 29 Cb 0.15 -1.15 0.22 0.00 -0.55 0.00 0.00 41.25 39.92 1dwm s ASN 29 CO 0.76 -0.13 1.09 -2.11 -2.79 0.00 0.00 177.10 173.92 1dwm n ARG 30 N 2.45 0.03 0.00 0.43 1.85 -1.15 -1.32 116.66 118.96 1dwm n ARG 30 Ca 0.22 0.35 0.14 0.00 -1.00 0.00 0.00 57.85 57.56 1dwm n ARG 30 Cb 0.39 -1.50 0.61 0.00 -1.05 0.00 0.00 32.46 30.91 1dwm n ARG 30 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1dwm n ASN 31 N -1.42 0.98 -3.92 2.89 5.15 -1.26 -4.91 115.26 112.77 1dwm n ASN 31 Ca 0.02 -1.18 -0.14 0.00 -0.60 0.00 0.00 54.58 52.67 1dwm n ASN 31 Cb 0.05 0.00 -0.09 0.00 -0.53 0.00 0.00 39.78 39.21 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 -2.13 0.00 -0.02 3.44 -7.23 -0.43 -4.65 120.40 109.38 1dwm s VAL 32 Ca 0.37 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.56 1dwm s VAL 32 Cb 0.21 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.65 1dwm s VAL 32 CO 0.39 0.00 -0.07 -1.38 -0.31 0.00 0.00 175.10 173.73 1dwm s HIS 33 N -3.92 0.72 -0.22 2.82 -3.43 -0.26 -4.55 115.29 106.44 1dwm s HIS 33 Ca 0.40 -0.16 -0.09 0.00 -0.80 0.00 0.00 55.06 54.41 1dwm s HIS 33 Cb 0.05 -0.53 -0.04 0.00 -1.43 0.00 0.00 32.58 30.64 1dwm s HIS 33 CO 0.17 -0.07 0.11 0.00 -2.00 0.00 0.00 174.74 172.95 1dwm s ALA 34 N 0.18 3.45 -0.40 -1.38 0.00 -1.26 -0.77 121.76 121.58 1dwm s ALA 34 Ca -0.02 -0.89 -0.16 0.00 0.00 0.00 0.00 51.96 50.89 1dwm s ALA 34 Cb -0.07 -2.13 0.01 0.00 0.00 0.00 0.00 23.12 20.93 1dwm s ALA 34 CO 0.00 -0.12 0.36 0.42 0.00 0.00 0.00 175.76 176.42 1dwm s ILE 35 N 0.93 5.18 -0.10 0.00 1.01 0.51 -4.88 121.20 123.85 1dwm s ILE 35 Ca 0.06 -0.39 -0.30 0.00 0.00 0.00 0.00 60.65 60.02 1dwm s ILE 35 Cb -0.13 -3.94 -0.01 0.00 0.01 0.00 0.00 42.46 38.38 1dwm s ILE 35 CO 0.03 -0.30 1.02 0.54 0.00 0.00 0.00 174.94 176.24 1dwm s VAL 36 N 1.92 4.74 -0.06 2.92 0.11 -1.26 -1.19 120.40 127.58 1dwm s VAL 36 Ca 0.09 2.01 -0.26 0.00 -2.93 0.00 0.00 61.98 60.89 1dwm s VAL 36 Cb -0.18 -4.29 0.06 0.00 -1.53 0.00 0.00 36.38 30.44 1dwm s VAL 36 CO 0.12 -0.00 0.58 -1.48 -3.33 0.00 0.00 175.10 170.98 1dwm s LEU 37 N 2.05 -0.23 0.40 2.54 0.05 0.02 -4.96 118.68 118.55 1dwm s LEU 37 Ca 0.49 0.61 -0.05 0.00 0.05 0.00 0.00 54.13 55.24 1dwm s LEU 37 Cb -0.19 2.16 -0.04 0.00 -2.05 0.00 0.00 46.19 46.07 1dwm s LEU 37 CO 0.18 -0.52 0.68 -1.59 -0.55 0.00 0.00 176.35 174.55 1dwm s LYS 38 N -1.05 3.58 -0.21 1.48 -2.85 -1.26 -0.83 119.74 118.60 1dwm s LYS 38 Ca -0.10 0.08 -0.41 0.00 -1.00 0.00 0.00 55.97 54.54 1dwm s LYS 38 Cb -0.02 -2.50 -0.17 0.00 -2.06 0.00 0.00 37.83 33.08 1dwm s LYS 38 CO 0.07 -0.01 1.53 0.39 0.10 0.00 0.00 175.35 177.43 1dwm n GLU 39 N -1.74 0.74 0.00 1.78 1.02 -0.12 -1.18 120.64 121.13 1dwm n GLU 39 Ca -0.01 0.27 0.00 0.00 -0.02 0.00 0.00 57.16 57.40 1dwm n GLU 39 Cb 0.55 -1.88 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 1dwm n GLU 39 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1dwm n GLY 40 N 3.41 1.14 0.00 0.62 0.00 -1.26 -5.04 105.19 104.06 1dwm n GLY 40 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 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 -0.77 -4.43 1.61 2.88 -0.33 -4.92 113.62 107.66 1dwm n SER 41 Ca 0.00 -0.27 -0.44 0.00 -1.33 0.00 0.00 58.87 56.83 1dwm n SER 41 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 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 -2.83 3.21 -0.38 -1.46 0.00 -1.26 -4.97 121.76 114.07 1dwm s ALA 42 Ca 0.00 -1.97 0.02 0.00 0.00 0.00 0.00 51.96 50.01 1dwm s ALA 42 Cb 0.00 -3.75 0.11 0.00 0.00 0.00 0.00 23.12 19.48 1dwm s ALA 42 CO 0.00 -2.63 0.13 0.00 0.00 0.00 0.00 175.76 173.26 1dwm s MET 43 N 3.60 1.30 0.59 0.00 0.00 -1.26 -5.11 119.30 118.43 1dwm s MET 43 Ca 0.18 -1.79 -0.19 0.00 0.00 0.00 0.00 55.69 53.90 1dwm s MET 43 Cb -0.19 -2.72 -0.04 0.00 0.00 0.00 0.00 34.83 31.89 1dwm s MET 43 CO 0.09 -1.02 1.20 0.95 0.00 0.00 0.00 175.02 176.24 1dwm s THR 44 N 0.82 2.66 -0.15 3.16 -4.23 -1.26 -4.94 115.64 111.70 1dwm s THR 44 Ca 0.13 0.41 0.16 0.00 -1.18 0.00 0.00 61.69 61.20 1dwm s THR 44 Cb -0.21 -3.15 0.00 0.00 1.34 0.00 0.00 72.50 70.48 1dwm s THR 44 CO -0.10 -0.09 1.25 0.11 -0.54 0.00 0.00 174.62 175.25 1dwm h LYS 45 N 0.87 0.00 -6.40 3.99 1.57 -1.99 -3.47 116.57 111.14 1dwm h LYS 45 Ca -0.50 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 57.66 1dwm h LYS 45 Cb 1.30 0.00 0.12 0.00 0.08 0.00 0.00 32.23 33.72 1dwm h LYS 45 CO 0.55 0.42 -0.04 -0.25 -0.57 0.00 0.00 179.45 179.57 1dwm n ASP 46 N -3.11 0.63 -4.73 0.86 9.92 -1.26 -4.92 116.55 113.95 1dwm n ASP 46 Ca -0.01 1.12 -0.40 0.00 -0.53 0.00 0.00 54.79 54.97 1dwm n ASP 46 Cb 0.76 -1.22 -0.05 0.00 -0.64 0.00 0.00 41.12 39.97 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 -1.13 3.67 -0.23 1.24 5.36 -1.26 -4.83 117.98 120.80 1dwm s PHE 47 Ca 0.60 1.42 -0.03 0.00 -0.96 0.00 0.00 56.93 57.96 1dwm s PHE 47 Cb -0.71 -2.85 0.11 0.00 -0.34 0.00 0.00 43.02 39.23 1dwm s PHE 47 CO 0.59 0.17 0.30 1.03 -1.46 0.00 0.00 175.22 175.84 1dwm s ARG 48 N 0.40 0.27 0.41 10.12 0.52 0.20 -5.01 118.95 125.86 1dwm s ARG 48 Ca 0.40 0.33 0.07 0.00 -0.52 0.00 0.00 55.73 56.02 1dwm s ARG 48 Cb -0.20 -0.85 0.86 0.00 0.52 0.00 0.00 34.95 35.29 1dwm s ARG 48 CO 0.22 -0.67 2.05 0.00 0.02 0.00 0.00 175.30 176.91 1dwm n ASP 50 N -4.47 0.00 -4.18 0.00 5.75 -1.26 -4.70 116.55 107.68 1dwm n ASP 50 Ca 0.04 -0.47 -0.28 0.00 -0.01 0.00 0.00 54.79 54.06 1dwm n ASP 50 Cb 0.09 -0.17 -0.16 0.00 -1.03 0.00 0.00 41.12 39.85 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 -2.33 2.09 -0.13 0.11 3.52 -0.28 -1.11 118.95 120.82 1dwm s ARG 51 Ca 0.35 -0.72 -0.01 0.00 -0.13 0.00 0.00 55.73 55.22 1dwm s ARG 51 Cb 0.20 -1.79 0.04 0.00 -1.56 0.00 0.00 34.95 31.83 1dwm s ARG 51 CO 0.40 0.29 -0.04 0.08 -0.81 0.00 0.00 175.30 175.23 1dwm s VAL 52 N -0.02 0.87 0.05 7.11 1.01 0.05 -0.66 120.40 128.80 1dwm s VAL 52 Ca -0.04 -0.35 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 1dwm s VAL 52 Cb -0.13 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 1dwm s VAL 52 CO 0.03 0.20 1.02 0.26 0.00 0.00 0.00 175.10 176.61 1dwm s TRP 53 N 1.75 3.65 -0.59 5.22 0.23 -1.26 -0.36 118.94 127.58 1dwm s TRP 53 Ca 0.03 1.64 0.00 0.00 -2.03 0.00 0.00 56.10 55.75 1dwm s TRP 53 Cb -0.14 -3.17 0.15 0.00 0.03 0.00 0.00 33.47 30.34 1dwm s TRP 53 CO -0.07 -0.23 0.38 0.08 0.96 0.00 0.00 176.95 178.06 1dwm s VAL 54 N 0.72 3.21 -0.20 4.03 1.01 -0.33 -4.15 120.40 124.70 1dwm s VAL 54 Ca 0.52 -3.21 -0.29 0.00 0.00 0.00 0.00 61.98 59.00 1dwm s VAL 54 Cb -0.24 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.01 1dwm s VAL 54 CO 0.29 -0.86 1.05 -0.63 0.00 0.00 0.00 175.10 174.95 1dwm s ILE 55 N -0.27 4.68 0.30 2.22 -1.09 -1.23 -0.80 121.20 125.00 1dwm s ILE 55 Ca 0.18 2.01 0.09 0.00 -2.23 0.00 0.00 60.65 60.69 1dwm s ILE 55 Cb -0.22 -4.29 -0.06 0.00 -1.58 0.00 0.00 42.46 36.31 1dwm s ILE 55 CO -0.02 -0.13 -0.10 0.68 -1.23 0.00 0.00 174.94 174.13 1dwm s VAL 56 N 2.93 2.05 0.67 2.92 -7.23 -0.01 -0.77 120.40 120.96 1dwm s VAL 56 Ca 0.46 -2.21 -0.08 0.00 -1.81 0.00 0.00 61.98 58.33 1dwm s VAL 56 Cb -0.16 -2.49 0.15 0.00 0.56 0.00 0.00 36.38 34.44 1dwm s VAL 56 CO 0.09 -0.29 0.92 -0.46 -0.31 0.00 0.00 175.10 175.05 1dwm n ASN 57 N -0.67 0.39 0.28 4.85 0.23 0.18 -0.95 115.26 119.56 1dwm n ASN 57 Ca -0.05 -1.52 0.18 0.00 -0.53 0.00 0.00 54.58 52.65 1dwm n ASN 57 Cb 0.63 -0.67 0.91 0.00 -2.08 0.00 0.00 39.78 38.56 1dwm n ASN 57 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1dwm h ASP 58 N -1.03 0.00 0.84 0.53 3.32 -1.96 0.92 116.42 119.04 1dwm h ASP 58 Ca -0.30 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.70 1dwm h ASP 58 Cb 0.90 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.44 1dwm h ASP 58 CO 0.24 0.00 -1.20 1.41 -1.72 0.00 0.00 179.24 177.97 1dwm n HIS 59 N -3.26 0.92 0.00 4.55 8.25 -1.26 -4.97 115.22 119.45 1dwm n HIS 59 Ca -0.00 0.28 0.00 0.00 -0.26 0.00 0.00 57.72 57.74 1dwm n HIS 59 Cb 0.31 -0.98 0.00 0.00 1.12 0.00 0.00 29.99 30.45 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 1.26 1.47 3.76 -1.41 0.00 0.32 -5.05 105.19 105.53 1dwm n GLY 60 Ca -0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 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 5.24 -0.16 1.61 1.01 -1.26 -0.38 120.40 124.45 1dwm s VAL 61 Ca 0.00 0.12 -0.29 0.00 0.00 0.00 0.00 61.98 61.81 1dwm s VAL 61 Cb 0.00 -3.33 -0.05 0.00 0.00 0.00 0.00 36.38 33.00 1dwm s VAL 61 CO 0.00 0.52 1.84 -0.69 0.00 0.00 0.00 175.10 176.77 1dwm s VAL 62 N -0.22 3.38 -0.17 2.92 1.01 0.15 0.50 120.40 127.97 1dwm s VAL 62 Ca 0.10 0.43 0.11 0.00 0.00 0.00 0.00 61.98 62.62 1dwm s VAL 62 Cb -0.12 -3.39 -0.23 0.00 0.00 0.00 0.00 36.38 32.64 1dwm s VAL 62 CO 0.01 -0.16 0.16 0.35 0.00 0.00 0.00 175.10 175.46 1dwm n THR 63 N 6.55 1.50 -4.09 3.92 -2.24 0.05 -0.95 114.28 119.02 1dwm n THR 63 Ca 0.22 -0.76 -0.23 0.00 -2.27 0.00 0.00 64.05 61.00 1dwm n THR 63 Cb 0.44 -0.92 -0.04 0.00 -2.10 0.00 0.00 70.33 67.71 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 -5.99 5.63 -0.12 3.42 0.01 -1.20 -4.80 113.70 110.64 1dwm s SER 64 Ca -0.15 -0.18 -0.29 0.00 1.31 0.00 0.00 55.95 56.64 1dwm s SER 64 Cb 0.07 -1.48 -0.05 0.00 0.21 0.00 0.00 66.02 64.78 1dwm s SER 64 CO 0.77 -0.01 1.77 -0.69 0.41 0.00 0.00 173.24 175.49 1dwm s VAL 65 N -2.01 3.45 -0.91 3.43 1.01 -1.26 -4.59 120.40 119.52 1dwm s VAL 65 Ca 0.33 0.53 -0.24 0.00 0.00 0.00 0.00 61.98 62.59 1dwm s VAL 65 Cb -0.09 -3.41 0.04 0.00 0.00 0.00 0.00 36.38 32.92 1dwm s VAL 65 CO 0.25 -0.13 1.43 -2.16 0.00 0.00 0.00 175.10 174.49 1dwm s PRO 66 N 4.62 3.39 0.11 2.72 0.05 -1.26 -4.91 135.00 139.73 1dwm s PRO 66 Ca 0.79 -0.75 0.08 0.00 0.05 0.00 0.00 61.00 61.16 1dwm s PRO 66 Cb -0.32 -4.94 -0.04 0.00 0.05 0.00 0.00 34.50 29.26 1dwm s PRO 66 CO 0.32 -2.26 -0.19 -3.38 0.05 0.00 0.00 177.00 171.54 1dwm s HIS 67 N 5.56 1.72 -0.49 0.56 -3.43 -1.26 -1.26 115.29 116.70 1dwm s HIS 67 Ca 0.44 -0.44 -0.43 0.00 -0.80 0.00 0.00 55.06 53.82 1dwm s HIS 67 Cb -0.03 -0.92 -0.18 0.00 -1.43 0.00 0.00 32.58 30.01 1dwm s HIS 67 CO -0.01 0.22 2.13 -0.89 -2.00 0.00 0.00 174.74 174.19 1dwm n ILE 68 N 0.90 0.01 -1.79 -5.38 5.41 0.23 -3.99 119.36 114.75 1dwm n ILE 68 Ca -0.18 -0.02 0.00 0.00 1.00 0.00 0.00 62.75 63.55 1dwm n ILE 68 Cb 0.55 -0.58 0.00 0.00 -0.71 0.00 0.00 39.64 38.90 1dwm n ILE 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96