#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dwm s ARG 2 N 0.00 0.94 -0.48 4.33 1.70 -1.26 -5.06 118.95 119.11 1dwm s ARG 2 Ca 0.00 -0.68 0.06 0.00 -0.47 0.00 0.00 55.73 54.65 1dwm s ARG 2 Cb 0.00 0.02 0.20 0.00 -0.57 0.00 0.00 34.95 34.60 1dwm s ARG 2 CO 0.00 -1.24 0.66 -2.13 -1.08 0.00 0.00 175.30 171.51 1dwm n ARG 3 N 3.61 0.52 -4.00 3.89 0.63 -1.26 -5.14 116.66 114.92 1dwm n ARG 3 Ca 0.15 -2.32 -0.13 0.00 -0.92 0.00 0.00 57.85 54.63 1dwm n ARG 3 Cb 0.57 -1.49 -0.13 0.00 0.45 0.00 0.00 32.46 31.85 1dwm n ARG 3 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1dwm s PRO 5 N -0.53 2.39 0.00 0.00 0.04 -1.26 -4.88 135.00 130.76 1dwm s PRO 5 Ca -0.04 1.25 0.00 0.00 0.04 0.00 0.00 61.00 62.25 1dwm s PRO 5 Cb -0.04 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.59 1dwm s PRO 5 CO -0.00 -1.55 0.00 0.41 0.04 0.00 0.00 177.00 175.90 1dwm n GLY 6 N -0.95 -1.58 3.77 0.56 0.00 -1.26 -4.78 105.19 100.95 1dwm n GLY 6 Ca 0.10 -1.54 -0.33 0.00 0.00 0.00 0.00 46.02 44.25 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 -1.61 2.86 0.00 1.61 2.20 -1.26 -4.98 119.74 118.56 1dwm s LYS 7 Ca 0.00 1.42 0.09 0.00 -0.36 0.00 0.00 55.97 57.13 1dwm s LYS 7 Cb 0.00 -1.96 -0.03 0.00 -1.51 0.00 0.00 37.83 34.33 1dwm s LYS 7 CO 0.00 -1.21 0.54 -1.71 -0.36 0.00 0.00 175.35 172.62 1dwm n ASN 8 N -2.28 0.94 -3.64 1.43 2.85 -1.26 -4.85 115.26 108.44 1dwm n ASN 8 Ca 0.11 -0.97 -0.05 0.00 -0.11 0.00 0.00 54.58 53.56 1dwm n ASN 8 Cb 0.52 0.64 -0.06 0.00 1.24 0.00 0.00 39.78 42.12 1dwm n ASN 8 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1dwm s ALA 9 N -1.49 -1.93 -0.83 5.20 0.00 -1.26 0.55 121.76 122.00 1dwm s ALA 9 Ca 0.06 2.40 0.01 0.00 0.00 0.00 0.00 51.96 54.43 1dwm s ALA 9 Cb 0.07 -1.54 0.25 0.00 0.00 0.00 0.00 23.12 21.90 1dwm s ALA 9 CO 0.28 -0.56 0.92 0.91 0.00 0.00 0.00 175.76 177.32 1dwm n TRP 10 N 4.69 3.44 -0.03 0.00 8.01 -0.42 -4.88 117.44 128.25 1dwm n TRP 10 Ca -0.17 -3.77 0.09 0.00 -1.31 0.00 0.00 57.50 52.34 1dwm n TRP 10 Cb 0.56 -0.89 0.49 0.00 -2.01 0.00 0.00 31.31 29.45 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 5.06 0.41 0.00 -0.99 0.13 -1.91 0.12 132.00 134.82 1dwm h PRO 11 Ca 0.19 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1dwm h PRO 11 Cb 0.69 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.73 1dwm h PRO 11 CO 0.96 0.27 0.00 -0.85 -0.23 0.00 0.00 178.00 178.15 1dwm n GLU 12 N -4.47 0.10 0.16 0.86 0.00 -1.26 -1.08 120.64 114.94 1dwm n GLU 12 Ca 0.07 0.51 0.06 0.00 0.00 0.00 0.00 57.16 57.80 1dwm n GLU 12 Cb 0.26 -1.78 0.07 0.00 0.00 0.00 0.00 31.44 29.99 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 -9.09 -1.84 3.38 -1.36 -3.45 115.31 102.94 1dwm h LEU 13 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 1dwm h LEU 13 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1dwm h LEU 13 CO 0.00 0.30 1.40 -0.69 0.09 0.00 0.00 178.44 179.54 1dwm s VAL 14 N -3.07 3.04 0.00 1.22 1.01 -0.24 -1.28 120.40 121.07 1dwm s VAL 14 Ca 0.04 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.07 1dwm s VAL 14 Cb 0.07 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.40 1dwm s VAL 14 CO 0.73 -0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.41 1dwm n GLY 15 N 5.37 1.13 3.95 4.51 0.00 0.11 -5.03 105.19 115.21 1dwm n GLY 15 Ca 0.26 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.05 1dwm n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dwm s LYS 16 N -0.24 2.32 0.45 1.61 -2.85 -0.41 -4.81 119.74 115.82 1dwm s LYS 16 Ca 0.00 -1.81 -0.24 0.00 -1.00 0.00 0.00 55.97 52.92 1dwm s LYS 16 Cb 0.00 -2.33 -0.07 0.00 -2.06 0.00 0.00 37.83 33.36 1dwm s LYS 16 CO 0.00 -0.64 1.26 -1.54 0.10 0.00 0.00 175.35 174.53 1dwm s SER 17 N -4.39 6.08 0.54 0.03 1.04 -1.26 -0.10 113.70 115.63 1dwm s SER 17 Ca 0.46 2.53 0.21 0.00 0.48 0.00 0.00 55.95 59.63 1dwm s SER 17 Cb -0.04 -2.62 1.45 0.00 0.10 0.00 0.00 66.02 64.91 1dwm s SER 17 CO 0.28 -1.00 2.18 1.23 0.98 0.00 0.00 173.24 176.91 1dwm h GLY 18 N 2.22 0.00 0.37 7.32 0.00 -1.52 -0.02 103.07 111.44 1dwm h GLY 18 Ca -0.50 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.83 1dwm h GLY 18 CO 0.61 0.00 -0.06 -0.57 0.00 0.00 0.00 176.54 176.51 1dwm h ASN 19 N 0.00 -0.15 -0.02 0.19 -0.73 -1.91 -1.49 115.58 111.48 1dwm h ASN 19 Ca -0.00 -0.41 -0.02 0.00 1.87 0.00 0.00 56.30 57.75 1dwm h ASN 19 Cb 0.03 0.04 -0.01 0.00 0.27 0.00 0.00 38.32 38.65 1dwm h ASN 19 CO 0.00 0.42 -0.02 0.24 -0.37 0.00 0.00 177.43 177.70 1dwm h MET 20 N -0.81 0.12 0.60 6.67 2.86 -1.89 -0.64 114.93 121.83 1dwm h MET 20 Ca -0.02 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1dwm h MET 20 Cb 0.55 -0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.19 1dwm h MET 20 CO 0.03 0.15 -0.29 0.00 1.06 0.00 0.00 176.91 177.86 1dwm h ALA 21 N 1.87 -0.92 -0.98 6.32 0.00 -0.98 -0.20 119.26 124.36 1dwm h ALA 21 Ca 0.03 -0.18 0.20 0.00 0.00 0.00 0.00 54.91 54.97 1dwm h ALA 21 Cb 0.12 0.31 -0.09 0.00 0.00 0.00 0.00 17.79 18.13 1dwm h ALA 21 CO 0.00 -0.87 0.62 0.00 0.00 0.00 0.00 179.25 179.01 1dwm h ALA 22 N -1.39 1.89 -0.43 0.00 0.00 -1.08 0.21 119.26 118.46 1dwm h ALA 22 Ca -0.08 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1dwm h ALA 22 Cb 0.62 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1dwm h ALA 22 CO 0.13 -0.24 0.22 0.00 0.00 0.00 0.00 179.25 179.36 1dwm h ALA 23 N 1.63 0.55 -0.65 0.00 0.00 -1.01 0.07 119.26 119.85 1dwm h ALA 23 Ca 0.55 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.40 1dwm h ALA 23 Cb 1.05 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 1dwm h ALA 23 CO -0.32 0.09 0.40 1.15 0.00 0.00 0.00 179.25 180.57 1dwm h THR 24 N 0.55 1.07 0.75 0.00 2.02 0.13 0.39 112.91 117.82 1dwm h THR 24 Ca 0.15 -0.27 -0.04 0.00 0.77 0.00 0.00 66.41 67.03 1dwm h THR 24 Cb 0.08 0.23 0.01 0.00 -1.74 0.00 0.00 68.15 66.73 1dwm h THR 24 CO -0.02 0.14 -0.36 0.58 0.37 0.00 0.00 175.52 176.23 1dwm h VAL 25 N 0.78 0.00 -0.04 3.16 2.07 -0.88 0.29 116.25 121.63 1dwm h VAL 25 Ca 0.26 -0.20 0.01 0.00 0.82 0.00 0.00 66.70 67.59 1dwm h VAL 25 Cb 0.03 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.80 1dwm h VAL 25 CO -0.11 0.00 0.06 -0.33 0.02 0.00 0.00 177.57 177.21 1dwm h GLU 26 N -1.21 0.00 0.00 1.57 5.08 -0.91 0.53 114.58 119.65 1dwm h GLU 26 Ca -0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1dwm h GLU 26 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1dwm h GLU 26 CO 0.17 0.00 -0.06 -0.09 -1.00 0.00 0.00 179.01 178.03 1dwm h ARG 27 N 0.00 0.00 -0.15 2.33 9.65 -0.02 -2.98 114.38 123.21 1dwm h ARG 27 Ca 0.02 0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 58.86 1dwm h ARG 27 Cb 0.13 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.70 1dwm h ARG 27 CO -0.00 0.00 -0.07 0.93 2.80 0.00 0.00 179.97 183.63 1dwm h GLU 28 N -0.90 0.22 -2.84 0.20 5.08 -0.29 -3.31 114.58 112.74 1dwm h GLU 28 Ca 0.00 -0.04 -0.61 0.00 -1.00 0.00 0.00 59.36 57.71 1dwm h GLU 28 Cb 0.06 -0.04 -0.40 0.00 0.50 0.00 0.00 28.75 28.87 1dwm h GLU 28 CO 0.00 0.30 -0.72 1.21 -1.00 0.00 0.00 179.01 178.80 1dwm s ASN 29 N -6.90 3.59 0.00 1.42 3.84 0.18 -4.59 114.94 112.49 1dwm s ASN 29 Ca -0.06 -3.50 0.04 0.00 0.21 0.00 0.00 52.86 49.55 1dwm s ASN 29 Cb 0.16 -1.19 0.18 0.00 -0.55 0.00 0.00 41.25 39.85 1dwm s ASN 29 CO 0.72 -0.13 1.05 0.54 -2.79 0.00 0.00 177.10 176.49 1dwm n ARG 30 N 2.38 0.03 0.00 0.43 1.74 -1.13 -1.39 116.66 118.72 1dwm n ARG 30 Ca 0.22 0.35 0.14 0.00 -0.77 0.00 0.00 57.85 57.79 1dwm n ARG 30 Cb 0.39 -1.50 0.48 0.00 -1.02 0.00 0.00 32.46 30.81 1dwm n ARG 30 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1dwm n ASN 31 N -1.40 1.15 -4.41 0.55 2.85 -1.26 -4.91 115.26 107.82 1dwm n ASN 31 Ca 0.01 -1.13 -0.20 0.00 -0.11 0.00 0.00 54.58 53.16 1dwm n ASN 31 Cb 0.04 0.05 -0.10 0.00 1.24 0.00 0.00 39.78 41.01 1dwm n ASN 31 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 1dwm s VAL 32 N -2.27 1.10 -0.03 3.44 -7.23 -0.49 -4.61 120.40 110.32 1dwm s VAL 32 Ca 0.31 -2.01 0.02 0.00 -1.81 0.00 0.00 61.98 58.49 1dwm s VAL 32 Cb 0.20 -2.67 0.01 0.00 0.56 0.00 0.00 36.38 34.48 1dwm s VAL 32 CO 0.43 -0.08 -0.07 -1.38 -0.31 0.00 0.00 175.10 173.70 1dwm s HIS 33 N -3.37 0.79 -0.21 2.82 -3.43 -0.01 -4.48 115.29 107.39 1dwm s HIS 33 Ca 0.35 -0.19 -0.06 0.00 -0.80 0.00 0.00 55.06 54.36 1dwm s HIS 33 Cb 0.08 -0.59 -0.02 0.00 -1.43 0.00 0.00 32.58 30.61 1dwm s HIS 33 CO 0.14 -0.10 0.01 0.00 -2.00 0.00 0.00 174.74 172.79 1dwm s ALA 34 N 0.31 3.05 -0.34 -1.38 0.00 -1.26 -0.10 121.76 122.05 1dwm s ALA 34 Ca -0.04 -1.03 -0.14 0.00 0.00 0.00 0.00 51.96 50.75 1dwm s ALA 34 Cb -0.09 -1.84 -0.02 0.00 0.00 0.00 0.00 23.12 21.18 1dwm s ALA 34 CO 0.00 -0.24 0.33 0.42 0.00 0.00 0.00 175.76 176.27 1dwm s ILE 35 N 1.15 5.20 -0.40 0.00 1.09 0.14 -4.86 121.20 123.53 1dwm s ILE 35 Ca 0.03 0.02 -0.29 0.00 -1.10 0.00 0.00 60.65 59.31 1dwm s ILE 35 Cb -0.14 -3.78 0.02 0.00 -1.06 0.00 0.00 42.46 37.50 1dwm s ILE 35 CO 0.02 -0.05 1.12 -0.69 -0.10 0.00 0.00 174.94 175.24 1dwm s VAL 36 N 1.94 4.33 0.05 2.92 1.01 -1.26 -1.00 120.40 128.39 1dwm s VAL 36 Ca 0.10 1.45 0.03 0.00 0.00 0.00 0.00 61.98 63.56 1dwm s VAL 36 Cb -0.17 -4.50 -0.03 0.00 0.00 0.00 0.00 36.38 31.69 1dwm s VAL 36 CO 0.11 -0.75 -0.10 -1.48 0.00 0.00 0.00 175.10 172.88 1dwm s LEU 37 N 4.13 2.27 0.37 3.92 0.05 0.11 -4.96 118.68 124.56 1dwm s LEU 37 Ca 0.47 -0.58 -0.05 0.00 0.05 0.00 0.00 54.13 54.03 1dwm s LEU 37 Cb -0.10 -0.26 -0.05 0.00 -2.05 0.00 0.00 46.19 43.74 1dwm s LEU 37 CO 0.24 -0.17 0.66 -1.59 -0.55 0.00 0.00 176.35 174.94 1dwm s LYS 38 N -1.66 3.62 -0.21 1.48 -2.85 -1.26 0.07 119.74 118.93 1dwm s LYS 38 Ca -0.07 0.10 -0.41 0.00 -1.00 0.00 0.00 55.97 54.59 1dwm s LYS 38 Cb -0.10 -2.53 -0.18 0.00 -2.06 0.00 0.00 37.83 32.97 1dwm s LYS 38 CO 0.01 0.05 1.51 -1.91 0.10 0.00 0.00 175.35 175.11 1dwm n GLU 39 N -1.46 0.68 0.00 1.78 2.13 0.42 -0.78 120.64 123.40 1dwm n GLU 39 Ca -0.01 0.25 0.00 0.00 0.66 0.00 0.00 57.16 58.06 1dwm n GLU 39 Cb 0.55 -1.85 0.00 0.00 0.27 0.00 0.00 31.44 30.41 1dwm n GLU 39 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1dwm n GLY 40 N 3.34 0.36 3.26 8.31 0.00 -1.26 -5.05 105.19 114.15 1dwm n GLY 40 Ca 0.25 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.50 -4.49 1.61 2.88 0.04 -4.93 113.62 106.23 1dwm n SER 41 Ca 0.00 -1.07 -0.43 0.00 -1.33 0.00 0.00 58.87 56.05 1dwm n SER 41 Cb 0.00 -0.95 -0.04 0.00 -0.75 0.00 0.00 64.21 62.47 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 -2.82 3.06 -0.32 -1.46 0.00 -1.26 -4.96 121.76 114.00 1dwm s ALA 42 Ca 0.67 -1.58 0.00 0.00 0.00 0.00 0.00 51.96 51.05 1dwm s ALA 42 Cb -0.08 -3.90 0.10 0.00 0.00 0.00 0.00 23.12 19.24 1dwm s ALA 42 CO 0.52 -2.76 0.09 0.00 0.00 0.00 0.00 175.76 173.61 1dwm s MET 43 N 4.35 0.85 0.57 0.00 0.00 -1.26 -5.11 119.30 118.70 1dwm s MET 43 Ca 0.27 -1.22 -0.21 0.00 0.00 0.00 0.00 55.69 54.53 1dwm s MET 43 Cb -0.14 -2.21 -0.04 0.00 0.00 0.00 0.00 34.83 32.44 1dwm s MET 43 CO 0.14 -0.98 1.31 0.25 0.00 0.00 0.00 175.02 175.74 1dwm n THR 44 N 4.74 4.08 0.14 3.16 -2.24 -1.26 -4.91 114.28 117.98 1dwm n THR 44 Ca -0.01 -0.50 0.02 0.00 -2.27 0.00 0.00 64.05 61.30 1dwm n THR 44 Cb 0.42 -1.58 0.03 0.00 -2.10 0.00 0.00 70.33 67.09 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 1.16 0.00 -6.30 -0.78 1.79 -1.99 -3.47 116.57 106.98 1dwm h LYS 45 Ca -0.51 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.43 1dwm h LYS 45 Cb 1.32 0.00 0.23 0.00 -1.58 0.00 0.00 32.23 32.20 1dwm h LYS 45 CO 0.56 0.50 -1.43 -0.25 -1.08 0.00 0.00 179.45 177.75 1dwm n ASP 46 N -3.23 -4.37 -4.64 0.86 9.92 -1.26 -4.95 116.55 108.88 1dwm n ASP 46 Ca 0.02 0.21 -0.35 0.00 -0.53 0.00 0.00 54.79 54.15 1dwm n ASP 46 Cb 0.73 -0.91 -0.10 0.00 -0.64 0.00 0.00 41.12 40.21 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 -2.15 3.25 -0.21 1.24 5.36 -1.26 -4.83 117.98 119.38 1dwm s PHE 47 Ca 0.46 0.09 -0.04 0.00 -0.96 0.00 0.00 56.93 56.48 1dwm s PHE 47 Cb -0.17 -2.05 0.10 0.00 -0.34 0.00 0.00 43.02 40.56 1dwm s PHE 47 CO 0.76 0.20 0.22 1.03 -1.46 0.00 0.00 175.22 175.97 1dwm s ARG 48 N 0.21 0.20 0.43 10.12 0.52 0.22 -5.02 118.95 125.63 1dwm s ARG 48 Ca 0.04 0.18 0.09 0.00 -0.52 0.00 0.00 55.73 55.51 1dwm s ARG 48 Cb -0.12 -1.18 0.93 0.00 0.52 0.00 0.00 34.95 35.10 1dwm s ARG 48 CO 0.01 -0.68 2.08 0.00 0.02 0.00 0.00 175.30 176.72 1dwm n ASP 50 N -4.49 0.00 -4.31 0.00 5.75 -1.26 -4.68 116.55 107.57 1dwm n ASP 50 Ca 0.02 -0.54 -0.29 0.00 -0.01 0.00 0.00 54.79 53.97 1dwm n ASP 50 Cb 0.06 -0.15 -0.15 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 -2.30 1.81 -0.12 0.11 3.52 -0.21 -0.83 118.95 120.93 1dwm s ARG 51 Ca 0.37 -1.00 -0.03 0.00 -0.13 0.00 0.00 55.73 54.94 1dwm s ARG 51 Cb 0.21 -1.89 0.05 0.00 -1.56 0.00 0.00 34.95 31.75 1dwm s ARG 51 CO 0.41 0.50 0.06 0.08 -0.81 0.00 0.00 175.30 175.54 1dwm s VAL 52 N -0.72 0.05 0.05 7.11 1.01 0.85 -0.46 120.40 128.30 1dwm s VAL 52 Ca 0.10 -0.00 -0.30 0.00 0.00 0.00 0.00 61.98 61.78 1dwm s VAL 52 Cb -0.10 -0.50 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 1dwm s VAL 52 CO 0.01 -0.06 1.02 0.26 0.00 0.00 0.00 175.10 176.33 1dwm s TRP 53 N 2.09 3.65 -0.55 5.22 0.23 -1.25 -0.68 118.94 127.65 1dwm s TRP 53 Ca 0.03 1.65 0.03 0.00 -2.03 0.00 0.00 56.10 55.78 1dwm s TRP 53 Cb -0.14 -3.17 0.14 0.00 0.03 0.00 0.00 33.47 30.33 1dwm s TRP 53 CO -0.07 -0.21 0.31 0.08 0.96 0.00 0.00 176.95 178.02 1dwm s VAL 54 N 0.68 2.75 -0.18 4.03 1.01 -0.17 -4.11 120.40 124.41 1dwm s VAL 54 Ca 0.52 -3.41 -0.29 0.00 0.00 0.00 0.00 61.98 58.80 1dwm s VAL 54 Cb -0.24 -2.88 0.00 0.00 0.00 0.00 0.00 36.38 33.27 1dwm s VAL 54 CO 0.29 -0.83 1.03 -0.63 0.00 0.00 0.00 175.10 174.96 1dwm s ILE 55 N -0.42 4.71 0.32 2.22 1.01 -1.21 0.05 121.20 127.88 1dwm s ILE 55 Ca 0.18 2.02 0.09 0.00 0.00 0.00 0.00 60.65 62.94 1dwm s ILE 55 Cb -0.23 -4.30 -0.06 0.00 0.01 0.00 0.00 42.46 37.88 1dwm s ILE 55 CO -0.02 -0.11 -0.10 0.68 0.00 0.00 0.00 174.94 175.40 1dwm s VAL 56 N 2.74 2.13 0.39 2.92 -7.23 0.11 -1.00 120.40 120.46 1dwm s VAL 56 Ca 0.46 -2.21 -0.03 0.00 -1.81 0.00 0.00 61.98 58.39 1dwm s VAL 56 Cb -0.17 -2.57 0.08 0.00 0.56 0.00 0.00 36.38 34.29 1dwm s VAL 56 CO 0.11 -0.24 0.53 -0.46 -0.31 0.00 0.00 175.10 174.73 1dwm n ASN 57 N -0.73 0.43 0.28 4.85 0.23 0.49 -0.44 115.26 120.36 1dwm n ASN 57 Ca -0.05 -1.43 0.18 0.00 -0.53 0.00 0.00 54.58 52.75 1dwm n ASN 57 Cb 0.63 -0.37 0.95 0.00 -2.08 0.00 0.00 39.78 38.91 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 -0.48 0.00 1.36 0.53 3.32 -1.98 0.47 116.42 119.65 1dwm h ASP 58 Ca -0.17 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.86 1dwm h ASP 58 Cb 0.58 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.12 1dwm h ASP 58 CO 0.16 0.00 -0.64 0.45 -1.72 0.00 0.00 179.24 177.49 1dwm h HIS 59 N 0.00 0.00 0.00 4.55 3.86 -2.05 -3.47 115.15 118.03 1dwm h HIS 59 Ca 0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1dwm h HIS 59 Cb 0.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.72 1dwm h HIS 59 CO 0.00 0.04 0.00 0.41 0.86 0.00 0.00 177.93 179.24 1dwm n GLY 60 N 1.16 1.29 3.89 2.45 0.00 0.16 -5.04 105.19 109.10 1dwm n GLY 60 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 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 5.38 -0.35 1.61 1.01 -1.26 -1.34 120.40 123.45 1dwm s VAL 61 Ca 0.00 0.04 -0.29 0.00 0.00 0.00 0.00 61.98 61.73 1dwm s VAL 61 Cb 0.00 -3.54 0.01 0.00 0.00 0.00 0.00 36.38 32.85 1dwm s VAL 61 CO 0.00 0.38 1.34 -0.69 0.00 0.00 0.00 175.10 176.13 1dwm s VAL 62 N -1.28 4.04 -0.11 2.92 1.01 0.86 -0.38 120.40 127.45 1dwm s VAL 62 Ca 0.26 1.13 0.12 0.00 0.00 0.00 0.00 61.98 63.49 1dwm s VAL 62 Cb -0.13 -4.19 -0.24 0.00 0.00 0.00 0.00 36.38 31.83 1dwm s VAL 62 CO 0.16 -0.61 0.39 0.35 0.00 0.00 0.00 175.10 175.39 1dwm n THR 63 N 6.58 1.55 -4.02 3.92 -2.24 -0.17 -0.71 114.28 119.18 1dwm n THR 63 Ca 0.15 -0.79 -0.27 0.00 -2.27 0.00 0.00 64.05 60.87 1dwm n THR 63 Cb 0.47 -0.93 -0.05 0.00 -2.10 0.00 0.00 70.33 67.73 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 -6.00 5.84 -0.53 3.42 0.15 -1.19 -4.84 113.70 110.55 1dwm s SER 64 Ca -0.10 0.01 -0.27 0.00 0.70 0.00 0.00 55.95 56.29 1dwm s SER 64 Cb 0.07 -1.63 -0.04 0.00 -1.71 0.00 0.00 66.02 62.72 1dwm s SER 64 CO 0.81 0.08 2.05 -0.69 1.20 0.00 0.00 173.24 176.69 1dwm s VAL 65 N -1.69 3.24 -0.76 4.45 1.01 -1.26 -4.64 120.40 120.76 1dwm s VAL 65 Ca 0.32 0.16 -0.25 0.00 0.00 0.00 0.00 61.98 62.21 1dwm s VAL 65 Cb -0.11 -3.57 -0.15 0.00 0.00 0.00 0.00 36.38 32.55 1dwm s VAL 65 CO 0.25 -0.53 2.40 -0.81 0.00 0.00 0.00 175.10 176.41 1dwm n PRO 66 N 9.04 0.59 -4.37 2.72 -0.04 -1.26 -4.76 135.00 136.93 1dwm n PRO 66 Ca 0.26 -0.60 -0.25 0.00 -0.04 0.00 0.00 63.50 62.88 1dwm n PRO 66 Cb 0.52 -3.37 -0.12 0.00 -0.04 0.00 0.00 33.50 30.50 1dwm n PRO 66 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1dwm s HIS 67 N 12.97 2.04 -0.32 0.54 -3.43 -1.26 -1.31 115.29 124.52 1dwm s HIS 67 Ca 0.98 -0.41 -0.38 0.00 -0.80 0.00 0.00 55.06 54.45 1dwm s HIS 67 Cb -0.23 -1.03 -0.14 0.00 -1.43 0.00 0.00 32.58 29.75 1dwm s HIS 67 CO 0.17 0.38 1.97 -0.89 -2.00 0.00 0.00 174.74 174.37 1dwm n ILE 68 N 0.43 0.24 -1.98 -5.38 5.41 0.19 -3.74 119.36 114.53 1dwm n ILE 68 Ca -0.14 -0.13 0.00 0.00 1.00 0.00 0.00 62.75 63.48 1dwm n ILE 68 Cb 0.56 -1.33 0.00 0.00 -0.71 0.00 0.00 39.64 38.15 1dwm n ILE 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96