#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 4.65 -2.79 4.33 1.74 -1.26 -4.98 116.66 118.35 1dwm n ARG 2 Ca 0.00 -4.73 -0.03 0.00 -0.77 0.00 0.00 57.85 52.32 1dwm n ARG 2 Cb 0.00 -2.40 -0.03 0.00 -1.02 0.00 0.00 32.46 29.02 1dwm n ARG 2 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1dwm n ARG 3 N -0.01 -3.28 -4.95 5.56 3.00 -1.26 -5.01 116.66 110.71 1dwm n ARG 3 Ca 0.40 2.60 -0.32 0.00 -0.00 0.00 0.00 57.85 60.53 1dwm n ARG 3 Cb 0.31 -3.74 -0.14 0.00 0.00 0.00 0.00 32.46 28.89 1dwm n ARG 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1dwm s PRO 5 N -0.49 2.23 0.35 0.00 0.04 -1.26 -4.94 135.00 130.93 1dwm s PRO 5 Ca 0.06 0.21 0.00 0.00 0.04 0.00 0.00 61.00 61.31 1dwm s PRO 5 Cb -0.12 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.45 1dwm s PRO 5 CO 0.02 -1.42 0.00 0.41 0.04 0.00 0.00 177.00 176.04 1dwm n GLY 6 N -3.22 -3.16 3.53 0.56 0.00 -1.26 -4.85 105.19 96.79 1dwm n GLY 6 Ca 0.08 -1.18 -0.40 0.00 0.00 0.00 0.00 46.02 44.52 1dwm n GLY 6 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1dwm n LYS 7 N -3.04 0.83 0.00 1.61 4.81 -1.26 -4.93 118.16 116.17 1dwm n LYS 7 Ca -0.04 0.31 0.05 0.00 -0.87 0.00 0.00 58.31 57.76 1dwm n LYS 7 Cb 0.36 -1.86 0.03 0.00 0.02 0.00 0.00 35.03 33.58 1dwm n LYS 7 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1dwm n ASN 8 N 0.37 1.66 -3.64 3.14 4.13 -1.26 -4.83 115.26 114.84 1dwm n ASN 8 Ca 0.11 -1.33 -0.09 0.00 1.68 0.00 0.00 54.58 54.96 1dwm n ASN 8 Cb 0.44 0.15 -0.07 0.00 -1.54 0.00 0.00 39.78 38.76 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 -1.03 -1.86 -0.67 5.41 0.00 -1.26 0.82 121.76 123.17 1dwm s ALA 9 Ca 0.11 2.33 0.05 0.00 0.00 0.00 0.00 51.96 54.46 1dwm s ALA 9 Cb 0.09 -1.37 0.23 0.00 0.00 0.00 0.00 23.12 22.07 1dwm s ALA 9 CO 0.17 -0.37 0.72 0.91 0.00 0.00 0.00 175.76 177.19 1dwm n TRP 10 N 3.93 3.57 -0.16 0.00 8.01 0.14 -4.90 117.44 128.03 1dwm n TRP 10 Ca -0.19 -4.16 0.08 0.00 -1.31 0.00 0.00 57.50 51.92 1dwm n TRP 10 Cb 0.58 -0.60 0.38 0.00 -2.01 0.00 0.00 31.31 29.67 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 4.46 0.66 0.00 -0.99 0.13 -1.91 0.10 132.00 134.45 1dwm h PRO 11 Ca 0.19 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1dwm h PRO 11 Cb 0.68 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 31.66 1dwm h PRO 11 CO 0.83 0.44 0.00 -0.85 -0.23 0.00 0.00 178.00 178.18 1dwm n GLU 12 N -4.48 0.01 0.17 0.86 0.00 -1.26 -1.29 120.64 114.66 1dwm n GLU 12 Ca 0.10 0.42 0.07 0.00 0.00 0.00 0.00 57.16 57.74 1dwm n GLU 12 Cb 0.25 -1.54 0.08 0.00 0.00 0.00 0.00 31.44 30.24 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 -9.01 -1.84 3.38 -1.35 -3.45 115.31 103.04 1dwm h LEU 13 Ca 0.00 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.38 1dwm h LEU 13 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1dwm h LEU 13 CO 0.00 0.29 1.43 0.52 0.09 0.00 0.00 178.44 180.76 1dwm n VAL 14 N -3.16 0.41 0.00 1.22 0.31 -0.41 -1.13 118.33 115.57 1dwm n VAL 14 Ca 0.03 -0.37 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 1dwm n VAL 14 Cb 0.65 -2.39 0.00 0.00 -0.91 0.00 0.00 33.84 31.19 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 5.60 1.00 1.86 2.92 0.00 0.08 -5.03 105.19 111.61 1dwm n GLY 15 Ca 0.29 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.51 0.90 -2.92 1.61 4.76 -0.28 -4.83 118.16 116.88 1dwm n LYS 16 Ca 0.00 -1.54 -0.39 0.00 -2.87 0.00 0.00 58.31 53.51 1dwm n LYS 16 Cb 0.00 -0.03 -0.06 0.00 -1.84 0.00 0.00 35.03 33.10 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 -2.67 7.44 0.54 4.39 1.04 -1.26 0.17 113.70 123.35 1dwm s SER 17 Ca 0.25 1.72 0.34 0.00 0.48 0.00 0.00 55.95 58.74 1dwm s SER 17 Cb -0.02 -2.53 1.51 0.00 0.10 0.00 0.00 66.02 65.09 1dwm s SER 17 CO 0.16 0.18 1.85 1.23 0.98 0.00 0.00 173.24 177.64 1dwm h GLY 18 N 4.20 0.00 0.57 7.32 0.00 -1.06 0.11 103.07 114.22 1dwm h GLY 18 Ca -0.47 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.82 1dwm h GLY 18 CO 0.66 0.00 -0.12 -0.57 0.00 0.00 0.00 176.54 176.51 1dwm h ASN 19 N 0.00 0.21 0.20 0.19 -0.73 -1.92 -1.45 115.58 112.07 1dwm h ASN 19 Ca 0.49 -0.58 -0.05 0.00 1.87 0.00 0.00 56.30 58.03 1dwm h ASN 19 Cb 1.97 -0.06 -0.01 0.00 0.27 0.00 0.00 38.32 40.49 1dwm h ASN 19 CO -0.01 0.74 -0.22 -0.03 -0.37 0.00 0.00 177.43 177.55 1dwm h MET 20 N -0.32 0.05 0.49 6.67 4.05 -1.29 -0.25 114.93 124.33 1dwm h MET 20 Ca 0.00 -0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.38 1dwm h MET 20 Cb 0.71 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.51 1dwm h MET 20 CO 0.03 0.27 -0.24 0.00 0.23 0.00 0.00 176.91 177.20 1dwm h ALA 21 N 1.73 -0.80 -0.83 0.39 0.00 -0.83 0.90 119.26 119.82 1dwm h ALA 21 Ca 0.01 -0.15 0.14 0.00 0.00 0.00 0.00 54.91 54.91 1dwm h ALA 21 Cb 0.42 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.41 1dwm h ALA 21 CO 0.03 -0.75 0.54 0.00 0.00 0.00 0.00 179.25 179.07 1dwm h ALA 22 N -1.40 1.94 -0.28 0.00 0.00 -1.21 -0.14 119.26 118.18 1dwm h ALA 22 Ca -0.07 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1dwm h ALA 22 Cb 0.51 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1dwm h ALA 22 CO 0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 179.25 179.18 1dwm h ALA 23 N 1.62 0.38 -0.95 0.00 0.00 -1.01 -1.44 119.26 117.85 1dwm h ALA 23 Ca 0.41 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1dwm h ALA 23 Cb 0.76 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 1dwm h ALA 23 CO -0.17 0.13 0.62 1.15 0.00 0.00 0.00 179.25 180.99 1dwm h THR 24 N 0.28 1.21 0.43 0.00 2.02 0.92 0.20 112.91 117.97 1dwm h THR 24 Ca 0.08 -0.43 -0.02 0.00 0.77 0.00 0.00 66.41 66.81 1dwm h THR 24 Cb 0.45 -0.15 0.00 0.00 -1.74 0.00 0.00 68.15 66.72 1dwm h THR 24 CO 0.02 0.23 -0.21 0.58 0.37 0.00 0.00 175.52 176.51 1dwm h VAL 25 N 1.25 0.48 0.00 3.16 2.07 -1.05 0.32 116.25 122.48 1dwm h VAL 25 Ca 0.36 -0.48 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 1dwm h VAL 25 Cb -0.08 0.67 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1dwm h VAL 25 CO -0.10 0.07 -0.10 -0.33 0.02 0.00 0.00 177.57 177.14 1dwm h GLU 26 N -0.90 0.00 0.00 1.57 5.08 -1.15 0.49 114.58 119.67 1dwm h GLU 26 Ca -0.06 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1dwm h GLU 26 Cb 0.56 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 1dwm h GLU 26 CO 0.10 0.10 -0.05 -0.09 -1.00 0.00 0.00 179.01 178.06 1dwm h ARG 27 N 0.00 0.00 -0.23 2.33 2.43 -0.51 -2.91 114.38 115.49 1dwm h ARG 27 Ca -0.00 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 1dwm h ARG 27 Cb 0.21 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1dwm h ARG 27 CO 0.01 0.26 -0.07 0.93 -1.51 0.00 0.00 179.97 179.59 1dwm h GLU 28 N -1.00 0.37 -2.86 0.20 5.08 -0.32 -3.31 114.58 112.74 1dwm h GLU 28 Ca -0.01 -0.08 -0.61 0.00 -1.00 0.00 0.00 59.36 57.66 1dwm h GLU 28 Cb 0.29 -0.05 -0.41 0.00 0.50 0.00 0.00 28.75 29.08 1dwm h GLU 28 CO -0.00 0.45 -0.69 -1.71 -1.00 0.00 0.00 179.01 176.06 1dwm n ASN 29 N -4.28 2.07 0.00 1.42 2.85 0.17 -4.59 115.26 112.91 1dwm n ASN 29 Ca 0.00 -2.99 0.03 0.00 -0.11 0.00 0.00 54.58 51.51 1dwm n ASN 29 Cb 0.26 -0.70 0.16 0.00 1.24 0.00 0.00 39.78 40.74 1dwm n ASN 29 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1dwm n ARG 30 N 2.16 0.16 -0.01 1.20 5.12 -1.10 -1.40 116.66 122.79 1dwm n ARG 30 Ca 0.23 0.04 0.12 0.00 -1.93 0.00 0.00 57.85 56.30 1dwm n ARG 30 Cb 0.39 -1.50 0.10 0.00 -1.16 0.00 0.00 32.46 30.29 1dwm n ARG 30 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1dwm n ASN 31 N -1.04 2.98 -4.40 0.55 2.85 -1.26 -4.97 115.26 109.97 1dwm n ASN 31 Ca 0.04 -1.98 -0.20 0.00 -0.11 0.00 0.00 54.58 52.33 1dwm n ASN 31 Cb 0.02 -0.01 -0.10 0.00 1.24 0.00 0.00 39.78 40.93 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 -1.95 1.15 -0.08 3.44 -7.23 -0.49 -4.63 120.40 110.61 1dwm s VAL 32 Ca 0.28 -2.03 0.00 0.00 -1.81 0.00 0.00 61.98 58.43 1dwm s VAL 32 Cb 0.20 -2.60 0.02 0.00 0.56 0.00 0.00 36.38 34.56 1dwm s VAL 32 CO 0.30 -0.14 -0.07 -2.28 -0.31 0.00 0.00 175.10 172.60 1dwm s HIS 33 N -3.34 1.15 -0.13 2.82 5.65 0.41 -4.54 115.29 117.31 1dwm s HIS 33 Ca 0.33 -0.46 -0.07 0.00 0.25 0.00 0.00 55.06 55.11 1dwm s HIS 33 Cb 0.07 -0.98 -0.04 0.00 -1.18 0.00 0.00 32.58 30.45 1dwm s HIS 33 CO 0.13 -0.35 0.13 0.00 -0.65 0.00 0.00 174.74 174.00 1dwm s ALA 34 N 1.32 3.81 -0.24 1.58 0.00 -1.26 -1.10 121.76 125.87 1dwm s ALA 34 Ca -0.03 -0.66 -0.05 0.00 0.00 0.00 0.00 51.96 51.22 1dwm s ALA 34 Cb -0.14 -1.98 -0.01 0.00 0.00 0.00 0.00 23.12 20.99 1dwm s ALA 34 CO -0.03 0.52 0.00 0.42 0.00 0.00 0.00 175.76 176.67 1dwm s ILE 35 N -0.73 3.67 -0.33 0.00 1.01 0.96 -4.88 121.20 120.91 1dwm s ILE 35 Ca 0.13 -0.45 -0.26 0.00 0.00 0.00 0.00 60.65 60.07 1dwm s ILE 35 Cb -0.12 -2.72 0.01 0.00 0.01 0.00 0.00 42.46 39.65 1dwm s ILE 35 CO 0.03 0.35 0.94 -0.69 0.00 0.00 0.00 174.94 175.57 1dwm s VAL 36 N 1.51 4.63 0.07 2.92 1.01 -1.26 -0.80 120.40 128.47 1dwm s VAL 36 Ca 0.05 1.41 0.02 0.00 0.00 0.00 0.00 61.98 63.47 1dwm s VAL 36 Cb -0.15 -4.30 -0.03 0.00 0.00 0.00 0.00 36.38 31.90 1dwm s VAL 36 CO -0.01 -0.42 -0.08 -1.48 0.00 0.00 0.00 175.10 173.12 1dwm s LEU 37 N 3.37 2.37 0.32 3.92 0.05 0.12 -4.95 118.68 123.88 1dwm s LEU 37 Ca 0.39 -0.75 -0.07 0.00 0.05 0.00 0.00 54.13 53.75 1dwm s LEU 37 Cb -0.13 -0.17 -0.06 0.00 -2.05 0.00 0.00 46.19 43.79 1dwm s LEU 37 CO 0.15 -0.30 0.62 -0.75 -0.55 0.00 0.00 176.35 175.53 1dwm s LYS 38 N -2.54 3.69 -0.36 1.48 2.20 -1.26 -0.15 119.74 122.80 1dwm s LYS 38 Ca 0.00 0.16 -0.42 0.00 -0.36 0.00 0.00 55.97 55.36 1dwm s LYS 38 Cb -0.04 -2.56 -0.16 0.00 -1.51 0.00 0.00 37.83 33.55 1dwm s LYS 38 CO -0.01 0.14 1.81 -1.91 -0.36 0.00 0.00 175.35 175.01 1dwm n GLU 39 N -1.02 0.78 0.00 4.03 2.13 0.07 -0.63 120.64 125.99 1dwm n GLU 39 Ca -0.00 0.27 0.00 0.00 0.66 0.00 0.00 57.16 58.09 1dwm n GLU 39 Cb 0.54 -1.95 0.00 0.00 0.27 0.00 0.00 31.44 30.30 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 4.76 0.68 0.00 8.31 0.00 -1.26 -5.05 105.19 112.64 1dwm n GLY 40 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.34 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 -0.95 -4.44 1.61 2.88 0.20 -4.93 113.62 107.99 1dwm n SER 41 Ca 0.00 -0.29 -0.44 0.00 -1.33 0.00 0.00 58.87 56.81 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 -2.76 3.22 -0.33 -1.46 0.00 -1.26 -4.98 121.76 114.19 1dwm s ALA 42 Ca 0.00 -1.88 0.02 0.00 0.00 0.00 0.00 51.96 50.10 1dwm s ALA 42 Cb 0.00 -3.71 0.10 0.00 0.00 0.00 0.00 23.12 19.51 1dwm s ALA 42 CO 0.00 -2.55 0.07 0.00 0.00 0.00 0.00 175.76 173.28 1dwm s MET 43 N 3.55 1.17 0.61 0.00 0.00 -1.26 -5.11 119.30 118.27 1dwm s MET 43 Ca 0.19 -1.56 -0.15 0.00 0.00 0.00 0.00 55.69 54.17 1dwm s MET 43 Cb -0.19 -2.71 -0.03 0.00 0.00 0.00 0.00 34.83 31.91 1dwm s MET 43 CO 0.10 -0.96 1.06 0.95 0.00 0.00 0.00 175.02 176.16 1dwm s THR 44 N 1.17 3.86 -0.15 3.16 -4.23 -1.26 -4.96 115.64 113.23 1dwm s THR 44 Ca 0.11 0.83 0.15 0.00 -1.18 0.00 0.00 61.69 61.59 1dwm s THR 44 Cb -0.18 -3.39 0.04 0.00 1.34 0.00 0.00 72.50 70.31 1dwm s THR 44 CO -0.15 -0.57 1.39 0.11 -0.54 0.00 0.00 174.62 174.85 1dwm h LYS 45 N 0.22 0.00 -6.20 3.99 6.56 -1.99 -3.47 116.57 115.68 1dwm h LYS 45 Ca -0.46 0.00 -0.64 0.00 -1.06 0.00 0.00 60.65 58.49 1dwm h LYS 45 Cb 1.22 0.00 0.12 0.00 -0.57 0.00 0.00 32.23 33.00 1dwm h LYS 45 CO 0.57 0.49 -0.34 -3.47 -2.06 0.00 0.00 179.45 174.64 1dwm n ASP 46 N -3.20 -0.53 -4.76 0.86 -0.08 -1.26 -4.91 116.55 102.68 1dwm n ASP 46 Ca 0.01 1.08 -0.38 0.00 -1.51 0.00 0.00 54.79 53.99 1dwm n ASP 46 Cb 0.75 -1.08 -0.06 0.00 2.34 0.00 0.00 41.12 43.07 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 -1.15 3.64 -0.24 -0.67 5.36 -1.26 -4.86 117.98 118.79 1dwm s PHE 47 Ca 0.62 1.10 -0.03 0.00 -0.96 0.00 0.00 56.93 57.65 1dwm s PHE 47 Cb -0.78 -2.57 0.13 0.00 -0.34 0.00 0.00 43.02 39.47 1dwm s PHE 47 CO 0.58 0.32 0.42 1.03 -1.46 0.00 0.00 175.22 176.11 1dwm s ARG 48 N -0.03 0.37 0.33 10.12 0.52 0.22 -5.02 118.95 125.47 1dwm s ARG 48 Ca 0.29 0.70 0.02 0.00 -0.52 0.00 0.00 55.73 56.22 1dwm s ARG 48 Cb -0.17 -0.18 0.60 0.00 0.52 0.00 0.00 34.95 35.72 1dwm s ARG 48 CO 0.15 -0.56 1.97 0.00 0.02 0.00 0.00 175.30 176.88 1dwm n ASP 50 N -4.45 0.00 -3.99 0.00 5.75 -1.26 -4.38 116.55 108.22 1dwm n ASP 50 Ca 0.10 -0.78 -0.31 0.00 -0.01 0.00 0.00 54.79 53.79 1dwm n ASP 50 Cb 0.12 -0.07 -0.15 0.00 -1.03 0.00 0.00 41.12 39.98 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 -2.14 1.83 -0.22 0.11 3.52 -0.24 -0.45 118.95 121.36 1dwm s ARG 51 Ca 0.43 -1.23 -0.04 0.00 -0.13 0.00 0.00 55.73 54.76 1dwm s ARG 51 Cb 0.21 -2.75 -0.01 0.00 -1.56 0.00 0.00 34.95 30.84 1dwm s ARG 51 CO 0.39 -0.63 -0.04 0.08 -0.81 0.00 0.00 175.30 174.28 1dwm s VAL 52 N 1.23 3.38 -0.09 7.11 1.01 -0.26 0.00 120.40 132.78 1dwm s VAL 52 Ca -0.05 -0.49 -0.30 0.00 0.00 0.00 0.00 61.98 61.14 1dwm s VAL 52 Cb -0.19 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.63 1dwm s VAL 52 CO -0.06 0.42 1.07 0.26 0.00 0.00 0.00 175.10 176.78 1dwm s TRP 53 N 1.48 3.41 -0.59 5.22 0.23 -1.25 -0.03 118.94 127.42 1dwm s TRP 53 Ca 0.06 1.48 0.03 0.00 -2.03 0.00 0.00 56.10 55.63 1dwm s TRP 53 Cb -0.14 -3.26 0.15 0.00 0.03 0.00 0.00 33.47 30.24 1dwm s TRP 53 CO -0.03 -0.56 0.35 0.08 0.96 0.00 0.00 176.95 177.75 1dwm s VAL 54 N 2.10 2.92 -0.09 4.03 1.01 0.02 -4.08 120.40 126.31 1dwm s VAL 54 Ca 0.50 -3.44 -0.30 0.00 0.00 0.00 0.00 61.98 58.75 1dwm s VAL 54 Cb -0.20 -2.97 -0.01 0.00 0.00 0.00 0.00 36.38 33.19 1dwm s VAL 54 CO 0.19 -0.86 1.00 -0.63 0.00 0.00 0.00 175.10 174.80 1dwm s ILE 55 N -0.49 4.80 0.29 2.22 1.01 -1.22 0.14 121.20 127.95 1dwm s ILE 55 Ca 0.19 2.04 0.07 0.00 0.00 0.00 0.00 60.65 62.95 1dwm s ILE 55 Cb -0.21 -4.31 -0.06 0.00 0.01 0.00 0.00 42.46 37.89 1dwm s ILE 55 CO -0.04 0.02 -0.07 0.68 0.00 0.00 0.00 174.94 175.54 1dwm s VAL 56 N 1.89 1.77 0.65 2.92 -7.23 0.79 -0.79 120.40 120.40 1dwm s VAL 56 Ca 0.49 -2.15 -0.08 0.00 -1.81 0.00 0.00 61.98 58.43 1dwm s VAL 56 Cb -0.19 -2.47 0.14 0.00 0.56 0.00 0.00 36.38 34.42 1dwm s VAL 56 CO 0.19 -0.29 0.88 -0.46 -0.31 0.00 0.00 175.10 175.11 1dwm n ASN 57 N -0.62 0.41 0.15 4.85 0.23 0.15 -0.75 115.26 119.69 1dwm n ASN 57 Ca -0.05 -1.53 0.19 0.00 -0.53 0.00 0.00 54.58 52.66 1dwm n ASN 57 Cb 0.63 -0.64 0.79 0.00 -2.08 0.00 0.00 39.78 38.48 1dwm n ASN 57 CO 0.00 0.00 0.00 -2.24 -0.93 0.00 0.00 177.26 174.09 1dwm h ASP 58 N -0.97 0.00 1.01 0.53 3.04 -1.98 0.13 116.42 118.18 1dwm h ASP 58 Ca -0.29 0.00 -0.07 0.00 -3.24 0.00 0.00 57.03 53.43 1dwm h ASP 58 Cb 0.87 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.15 1dwm h ASP 58 CO 0.24 0.00 -1.04 -0.74 -2.04 0.00 0.00 179.24 175.66 1dwm h HIS 59 N 0.00 0.00 0.00 4.15 2.76 -2.05 -3.48 115.15 116.53 1dwm h HIS 59 Ca 0.14 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.31 1dwm h HIS 59 Cb 0.81 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.77 1dwm h HIS 59 CO 0.00 0.27 0.00 0.41 -1.30 0.00 0.00 177.93 177.31 1dwm n GLY 60 N 1.26 1.56 3.80 5.26 0.00 0.45 -5.04 105.19 112.49 1dwm n GLY 60 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.28 1.61 1.01 -1.26 -0.43 120.40 124.31 1dwm s VAL 61 Ca 0.00 0.56 -0.29 0.00 0.00 0.00 0.00 61.98 62.26 1dwm s VAL 61 Cb 0.00 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 32.76 1dwm s VAL 61 CO 0.00 0.50 1.63 -0.69 0.00 0.00 0.00 175.10 176.54 1dwm s VAL 62 N -0.35 3.68 -0.16 2.92 1.01 0.13 0.34 120.40 127.97 1dwm s VAL 62 Ca 0.18 0.73 0.16 0.00 0.00 0.00 0.00 61.98 63.05 1dwm s VAL 62 Cb -0.14 -3.78 -0.24 0.00 0.00 0.00 0.00 36.38 32.22 1dwm s VAL 62 CO 0.07 -0.40 0.24 0.35 0.00 0.00 0.00 175.10 175.35 1dwm n THR 63 N 6.81 1.46 -3.94 3.92 -2.24 0.03 -0.74 114.28 119.57 1dwm n THR 63 Ca 0.20 -0.83 -0.32 0.00 -2.27 0.00 0.00 64.05 60.82 1dwm n THR 63 Cb 0.46 -0.66 -0.05 0.00 -2.10 0.00 0.00 70.33 67.98 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 -5.70 6.24 -0.46 3.42 0.15 -1.17 -4.85 113.70 111.33 1dwm s SER 64 Ca -0.09 0.27 -0.27 0.00 0.70 0.00 0.00 55.95 56.56 1dwm s SER 64 Cb 0.07 -1.91 -0.04 0.00 -1.71 0.00 0.00 66.02 62.42 1dwm s SER 64 CO 0.82 0.23 2.09 -0.69 1.20 0.00 0.00 173.24 176.89 1dwm s VAL 65 N -1.38 3.21 -0.32 4.45 1.01 -1.26 -4.55 120.40 121.56 1dwm s VAL 65 Ca 0.30 0.16 -0.28 0.00 0.00 0.00 0.00 61.98 62.16 1dwm s VAL 65 Cb -0.13 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 1dwm s VAL 65 CO 0.22 -0.37 2.00 -2.16 0.00 0.00 0.00 175.10 174.78 1dwm s PRO 66 N 7.09 3.12 0.03 2.72 0.04 -1.26 -4.81 135.00 141.93 1dwm s PRO 66 Ca 0.85 1.58 0.01 0.00 0.04 0.00 0.00 61.00 63.49 1dwm s PRO 66 Cb -0.19 -4.30 -0.02 0.00 0.04 0.00 0.00 34.50 30.03 1dwm s PRO 66 CO 0.27 -2.11 -0.05 -3.38 0.04 0.00 0.00 177.00 171.77 1dwm s HIS 67 N 7.94 0.44 -0.42 0.56 -3.43 -1.26 0.23 115.29 119.35 1dwm s HIS 67 Ca 0.88 -0.45 -0.42 0.00 -0.80 0.00 0.00 55.06 54.27 1dwm s HIS 67 Cb -0.25 -0.28 -0.17 0.00 -1.43 0.00 0.00 32.58 30.45 1dwm s HIS 67 CO 0.33 -0.12 2.00 -0.89 -2.00 0.00 0.00 174.74 174.06 1dwm n ILE 68 N 1.72 0.10 -1.53 -5.38 5.41 0.24 -3.87 119.36 116.05 1dwm n ILE 68 Ca -0.22 -0.08 0.00 0.00 1.00 0.00 0.00 62.75 63.45 1dwm n ILE 68 Cb 0.55 -0.93 0.00 0.00 -0.71 0.00 0.00 39.64 38.56 1dwm n ILE 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96