#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nhm n ALA 4 N 0.00 -0.17 -0.63 5.41 0.00 -1.26 -4.81 120.51 119.06 1nhm n ALA 4 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 1nhm n ALA 4 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 1nhm n ALA 4 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1nhm n PRO 5 N -0.02 0.00 -3.74 0.00 -0.02 -1.26 -4.99 135.00 124.97 1nhm n PRO 5 Ca 0.00 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.19 1nhm n PRO 5 Cb 0.00 -0.62 -0.12 0.00 -0.02 0.00 0.00 33.50 32.74 1nhm n PRO 5 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1nhm s LYS 6 N -1.19 1.65 0.00 -0.52 -2.85 -1.26 -5.04 119.74 110.53 1nhm s LYS 6 Ca 0.25 -2.50 0.00 0.00 -1.00 0.00 0.00 55.97 52.72 1nhm s LYS 6 Cb -0.12 -2.61 0.00 0.00 -2.06 0.00 0.00 37.83 33.04 1nhm s LYS 6 CO 0.50 -1.23 0.00 0.54 0.10 0.00 0.00 175.35 175.26 1nhm n ARG 7 N 2.89 0.00 -0.48 1.78 3.00 -1.26 -4.90 116.66 117.69 1nhm n ARG 7 Ca 0.15 0.00 -0.24 0.00 -0.01 0.00 0.00 57.85 57.75 1nhm n ARG 7 Cb 0.37 0.00 0.19 0.00 0.00 0.00 0.00 32.46 33.02 1nhm n ARG 7 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 1nhm n PRO 8 N 0.03 -2.77 -0.99 5.56 -0.02 -1.26 -4.90 135.00 130.64 1nhm n PRO 8 Ca 0.00 -0.81 -0.31 0.00 -2.02 0.00 0.00 63.50 60.35 1nhm n PRO 8 Cb 0.00 -1.66 0.01 0.00 -0.02 0.00 0.00 33.50 31.83 1nhm n PRO 8 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1nhm n PRO 9 N -2.94 0.00 -0.10 0.52 -0.02 -1.26 -4.62 135.00 126.57 1nhm n PRO 9 Ca 0.06 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.60 1nhm n PRO 9 Cb 0.47 -0.80 0.08 0.00 -0.02 0.00 0.00 33.50 33.23 1nhm n PRO 9 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1nhm n SER 10 N 2.04 1.83 0.00 2.55 7.64 -1.26 -4.38 113.62 122.03 1nhm n SER 10 Ca 0.06 -2.54 0.00 0.00 1.01 0.00 0.00 58.87 57.40 1nhm n SER 10 Cb 0.38 -0.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 1nhm n SER 10 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nhm n ALA 11 N -0.92 0.00 -0.18 -0.43 0.00 -1.26 -4.70 120.51 113.01 1nhm n ALA 11 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.52 1nhm n ALA 11 Cb 0.53 0.00 0.09 0.00 0.00 0.00 0.00 19.45 20.07 1nhm n ALA 11 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1nhm h PHE 12 N 0.00 0.14 -0.80 0.00 3.57 -1.96 -2.40 116.94 115.50 1nhm h PHE 12 Ca 0.00 0.03 0.22 0.00 3.53 0.00 0.00 57.97 61.76 1nhm h PHE 12 Cb 0.00 0.02 -0.15 0.00 2.79 0.00 0.00 35.95 38.61 1nhm h PHE 12 CO 0.00 -0.04 0.03 0.34 -2.23 0.00 0.00 178.31 176.41 1nhm n PHE 13 N -5.15 0.52 0.40 0.41 -0.00 -1.26 -0.70 117.46 111.68 1nhm n PHE 13 Ca 0.07 0.97 -0.16 0.00 -0.00 0.00 0.00 57.45 58.33 1nhm n PHE 13 Cb 0.29 -1.11 -0.07 0.00 -0.00 0.00 0.00 39.48 38.59 1nhm n PHE 13 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 1nhm h LEU 14 N 0.00 -0.86 -0.86 -2.13 -0.00 -1.79 -2.82 115.31 106.84 1nhm h LEU 14 Ca 0.49 0.03 0.22 0.00 -0.00 0.00 0.00 57.88 58.62 1nhm h LEU 14 Cb 1.02 0.22 -0.14 0.00 -0.00 0.00 0.00 40.66 41.77 1nhm h LEU 14 CO -0.75 -0.56 0.24 0.15 -0.00 0.00 0.00 178.44 177.52 1nhm h PHE 15 N -1.13 0.36 0.12 1.13 3.57 -1.26 -0.63 116.94 119.10 1nhm h PHE 15 Ca -0.10 0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.46 1nhm h PHE 15 Cb 0.78 -0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.45 1nhm h PHE 15 CO 0.03 -0.18 -0.51 0.00 -2.23 0.00 0.00 178.31 175.42 1nhm h SER 17 N -0.74 -1.32 -0.89 0.00 0.02 -0.88 0.98 113.55 110.71 1nhm h SER 17 Ca 0.00 0.18 0.24 0.00 -0.84 0.00 0.00 61.79 61.37 1nhm h SER 17 Cb 0.75 0.54 -0.14 0.00 0.14 0.00 0.00 62.40 63.69 1nhm h SER 17 CO -0.28 -0.42 0.29 -0.33 -1.14 0.00 0.00 176.83 174.95 1nhm h GLU 18 N -0.48 0.24 0.02 3.45 5.08 -1.12 -3.18 114.58 118.60 1nhm h GLU 18 Ca 0.08 -0.01 -0.37 0.00 -1.00 0.00 0.00 59.36 58.06 1nhm h GLU 18 Cb 0.62 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.76 1nhm h GLU 18 CO -0.40 0.16 -2.26 0.66 -1.00 0.00 0.00 179.01 176.17 1nhm n TYR 19 N -5.18 0.38 -0.11 4.33 4.01 -0.87 -4.62 117.16 115.09 1nhm n TYR 19 Ca 0.22 0.10 -0.03 0.00 -0.16 0.00 0.00 57.90 58.03 1nhm n TYR 19 Cb 0.71 -1.06 -0.03 0.00 -0.31 0.00 0.00 39.34 38.66 1nhm n TYR 19 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 1nhm n ARG 20 N -3.13 -0.12 0.26 -0.72 0.63 0.31 -0.06 116.66 113.83 1nhm n ARG 20 Ca -0.36 0.84 0.18 0.00 -0.92 0.00 0.00 57.85 57.58 1nhm n ARG 20 Cb 1.06 -1.24 0.92 0.00 0.45 0.00 0.00 32.46 33.64 1nhm n ARG 20 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 1nhm h PRO 21 N 0.00 0.00 0.00 -0.14 0.13 -1.84 -0.25 132.00 129.90 1nhm h PRO 21 Ca 0.04 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.13 1nhm h PRO 21 Cb 0.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.23 1nhm h PRO 21 CO -0.25 0.00 -0.33 0.87 -0.23 0.00 0.00 178.00 178.06 1nhm h LYS 22 N 0.00 0.00 -0.26 0.86 1.79 -0.73 -2.05 116.57 116.18 1nhm h LYS 22 Ca 0.00 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 1nhm h LYS 22 Cb 0.07 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.71 1nhm h LYS 22 CO 0.00 0.49 0.13 -0.84 -1.08 0.00 0.00 179.45 178.15 1nhm h ILE 23 N -1.00 1.14 -0.45 1.86 3.07 -1.08 -0.76 117.51 120.29 1nhm h ILE 23 Ca -0.06 -0.40 0.09 0.00 1.55 0.00 0.00 64.86 66.04 1nhm h ILE 23 Cb 0.64 0.92 -0.02 0.00 -0.27 0.00 0.00 36.82 38.09 1nhm h ILE 23 CO -0.04 0.14 0.31 0.50 -1.05 0.00 0.00 178.15 178.01 1nhm h LYS 24 N 0.30 0.21 -0.74 0.16 3.64 -1.19 0.80 116.57 119.75 1nhm h LYS 24 Ca 0.09 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.51 1nhm h LYS 24 Cb 0.11 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 1nhm h LYS 24 CO -0.01 0.14 0.48 0.78 -2.27 0.00 0.00 179.45 178.57 1nhm h GLY 25 N 0.22 1.00 0.61 5.01 0.00 -0.37 -0.94 103.07 108.59 1nhm h GLY 25 Ca 0.21 -0.33 -0.11 0.00 0.00 0.00 0.00 47.33 47.10 1nhm h GLY 25 CO -0.04 0.26 -1.59 1.18 0.00 0.00 0.00 176.54 176.35 1nhm n GLU 26 N -4.47 0.64 -2.96 4.80 -0.58 0.22 -4.50 120.64 113.78 1nhm n GLU 26 Ca 0.10 0.06 -0.31 0.00 -0.42 0.00 0.00 57.16 56.59 1nhm n GLU 26 Cb 0.19 -1.70 -0.03 0.00 -0.57 0.00 0.00 31.44 29.33 1nhm n GLU 26 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1nhm n HIS 27 N -2.66 3.55 0.03 -0.32 8.25 0.25 -4.86 115.22 119.47 1nhm n HIS 27 Ca -0.09 -3.59 0.00 0.00 -0.26 0.00 0.00 57.72 53.79 1nhm n HIS 27 Cb 0.74 -0.72 0.00 0.00 1.12 0.00 0.00 29.99 31.12 1nhm n HIS 27 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1nhm n PRO 28 N 0.11 0.97 0.00 -0.41 -0.04 -0.48 -2.39 135.00 132.76 1nhm n PRO 28 Ca 0.34 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.80 1nhm n PRO 28 Cb 0.36 -1.02 0.00 0.00 -0.04 0.00 0.00 33.50 32.80 1nhm n PRO 28 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nhm n GLY 29 N 1.16 0.92 3.95 0.55 0.00 -1.26 -5.07 105.19 105.44 1nhm n GLY 29 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1nhm n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nhm s LEU 30 N -1.10 2.99 0.47 0.99 1.43 -1.00 -5.11 118.68 117.34 1nhm s LEU 30 Ca 0.00 -0.99 0.03 0.00 -1.03 0.00 0.00 54.13 52.14 1nhm s LEU 30 Cb 0.00 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.65 1nhm s LEU 30 CO 0.00 -1.12 0.03 -0.44 0.23 0.00 0.00 176.35 175.05 1nhm s SER 31 N -4.41 3.76 -0.05 2.29 0.01 -1.26 -4.93 113.70 109.11 1nhm s SER 31 Ca 0.48 -1.61 0.02 0.00 1.31 0.00 0.00 55.95 56.15 1nhm s SER 31 Cb -0.04 0.38 0.14 0.00 0.21 0.00 0.00 66.02 66.71 1nhm s SER 31 CO 0.29 -0.81 0.82 0.00 0.41 0.00 0.00 173.24 173.96 1nhm n ILE 32 N -1.13 0.70 -0.01 1.44 3.06 -1.26 -1.06 119.36 121.10 1nhm n ILE 32 Ca -0.14 -0.27 -0.00 0.00 -2.50 0.00 0.00 62.75 59.83 1nhm n ILE 32 Cb 0.67 -0.56 -0.01 0.00 0.54 0.00 0.00 39.64 40.28 1nhm n ILE 32 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1nhm n GLY 33 N 0.13 -0.07 0.33 4.50 0.00 -1.26 -4.37 105.19 104.46 1nhm n GLY 33 Ca 0.06 -0.03 -0.16 0.00 0.00 0.00 0.00 46.02 45.89 1nhm n GLY 33 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nhm n ASP 34 N -1.93 1.74 0.25 1.61 -0.08 -0.91 -2.37 116.55 114.85 1nhm n ASP 34 Ca -0.02 0.11 0.08 0.00 -1.51 0.00 0.00 54.79 53.46 1nhm n ASP 34 Cb 0.43 -0.43 0.63 0.00 2.34 0.00 0.00 41.12 44.08 1nhm n ASP 34 CO 0.00 0.00 0.00 1.62 0.12 0.00 0.00 177.20 178.94 1nhm h VAL 35 N -0.42 0.94 0.09 5.18 3.04 -1.41 0.85 116.25 124.53 1nhm h VAL 35 Ca -0.42 -0.35 -0.21 0.00 -1.01 0.00 0.00 66.70 64.71 1nhm h VAL 35 Cb 1.45 1.19 0.02 0.00 -2.01 0.00 0.00 31.29 31.95 1nhm h VAL 35 CO -0.20 0.09 -0.88 0.00 -1.01 0.00 0.00 177.57 175.57 1nhm h ALA 36 N 1.90 -0.02 -0.58 3.17 0.00 -1.75 -3.07 119.26 118.91 1nhm h ALA 36 Ca -0.00 -0.68 0.12 0.00 0.00 0.00 0.00 54.91 54.35 1nhm h ALA 36 Cb 0.19 0.08 -0.10 0.00 0.00 0.00 0.00 17.79 17.96 1nhm h ALA 36 CO 0.01 0.46 -0.04 -0.22 0.00 0.00 0.00 179.25 179.46 1nhm h LYS 37 N -0.09 0.08 -0.03 0.00 3.64 -0.52 0.35 116.57 119.99 1nhm h LYS 37 Ca -0.14 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.27 1nhm h LYS 37 Cb 1.63 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 33.38 1nhm h LYS 37 CO 0.17 0.05 -0.33 -0.22 -2.27 0.00 0.00 179.45 176.85 1nhm h LYS 38 N 0.08 -0.44 -0.35 1.90 3.64 -1.18 -1.31 116.57 118.91 1nhm h LYS 38 Ca 0.30 0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.78 1nhm h LYS 38 Cb 0.47 0.10 -0.08 0.00 -0.41 0.00 0.00 32.23 32.30 1nhm h LYS 38 CO -0.53 -0.30 -0.27 -0.07 -2.27 0.00 0.00 179.45 176.02 1nhm h LEU 39 N -0.46 -0.89 -1.06 5.20 3.38 -1.00 0.65 115.31 121.13 1nhm h LEU 39 Ca 0.07 0.17 0.39 0.00 0.09 0.00 0.00 57.88 58.60 1nhm h LEU 39 Cb 0.56 0.43 -0.14 0.00 0.09 0.00 0.00 40.66 41.61 1nhm h LEU 39 CO -0.29 -0.29 0.64 0.61 0.09 0.00 0.00 178.44 179.20 1nhm n GLY 40 N -1.40 -0.70 0.07 0.83 0.00 -0.05 -1.08 105.19 102.86 1nhm n GLY 40 Ca 0.01 0.68 -0.04 0.00 0.00 0.00 0.00 46.02 46.66 1nhm n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nhm n GLU 41 N -4.65 0.42 -0.31 1.61 1.02 -0.20 -4.41 120.64 114.13 1nhm n GLU 41 Ca 0.34 0.52 0.29 0.00 -0.02 0.00 0.00 57.16 58.29 1nhm n GLU 41 Cb 1.26 -1.64 0.54 0.00 -0.02 0.00 0.00 31.44 31.59 1nhm n GLU 41 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1nhm n MET 42 N -4.47 -0.06 -0.13 3.49 2.81 0.05 -0.46 117.12 118.35 1nhm n MET 42 Ca -0.07 1.34 0.15 0.00 -1.81 0.00 0.00 57.70 57.32 1nhm n MET 42 Cb 0.24 -2.39 0.53 0.00 -0.71 0.00 0.00 33.22 30.89 1nhm n MET 42 CO 0.00 0.00 0.00 2.35 1.51 0.00 0.00 175.97 179.83 1nhm h TRP 43 N 0.00 0.42 0.00 2.03 2.91 -1.31 0.30 115.95 120.29 1nhm h TRP 43 Ca 0.80 0.01 -0.23 0.00 1.13 0.00 0.00 58.89 60.60 1nhm h TRP 43 Cb 2.09 -0.13 -0.04 0.00 -0.51 0.00 0.00 29.16 30.57 1nhm h TRP 43 CO -0.05 0.17 -1.27 -0.91 -1.03 0.00 0.00 178.44 175.35 1nhm h ASN 44 N 0.36 0.00 -0.61 2.65 2.35 -0.99 -3.24 115.58 116.10 1nhm h ASN 44 Ca 0.34 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.84 1nhm h ASN 44 Cb 0.82 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 39.05 1nhm h ASN 44 CO -0.10 0.94 0.32 0.59 -1.65 0.00 0.00 177.43 177.53 1nhm n ASN 45 N -3.19 3.80 -0.35 5.81 3.02 0.78 -4.87 115.26 120.25 1nhm n ASN 45 Ca -0.07 -2.98 0.00 0.00 -0.03 0.00 0.00 54.58 51.50 1nhm n ASN 45 Cb 0.96 -0.71 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 1nhm n ASN 45 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1nhm n THR 46 N -0.31 0.00 -1.01 3.41 5.66 0.34 -4.93 114.28 117.43 1nhm n THR 46 Ca 0.35 0.00 0.08 0.00 -3.05 0.00 0.00 64.05 61.43 1nhm n THR 46 Cb 1.20 -0.01 0.26 0.00 -1.55 0.00 0.00 70.33 70.23 1nhm n THR 46 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nhm n ALA 47 N -3.00 3.05 -1.19 1.79 0.00 -1.26 -4.95 120.51 114.94 1nhm n ALA 47 Ca 0.00 -2.34 0.00 0.00 0.00 0.00 0.00 53.44 51.10 1nhm n ALA 47 Cb 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 18.73 1nhm n ALA 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nhm n ALA 48 N -0.53 -0.32 0.00 0.00 0.00 -1.26 -4.00 120.51 114.40 1nhm n ALA 48 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1nhm n ALA 48 Cb 0.90 -0.23 0.00 0.00 0.00 0.00 0.00 19.45 20.12 1nhm n ALA 48 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1nhm n ASP 49 N -0.19 2.73 -0.03 0.00 -0.08 -1.26 -4.60 116.55 113.13 1nhm n ASP 49 Ca 0.00 0.00 0.12 0.00 -1.51 0.00 0.00 54.79 53.40 1nhm n ASP 49 Cb 0.16 0.14 0.33 0.00 2.34 0.00 0.00 41.12 44.09 1nhm n ASP 49 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1nhm n ASP 50 N -1.79 0.48 -0.00 1.67 8.00 -1.26 -3.73 116.55 119.92 1nhm n ASP 50 Ca 0.00 -0.22 -0.21 0.00 0.71 0.00 0.00 54.79 55.07 1nhm n ASP 50 Cb 0.31 0.11 -0.14 0.00 -0.02 0.00 0.00 41.12 41.39 1nhm n ASP 50 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1nhm h LYS 51 N 0.14 0.21 -0.37 -1.24 1.57 -1.88 -3.39 116.57 111.62 1nhm h LYS 51 Ca 0.00 -0.36 0.05 0.00 -1.87 0.00 0.00 60.65 58.47 1nhm h LYS 51 Cb 0.49 0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.88 1nhm h LYS 51 CO 0.00 1.17 -0.17 1.04 -0.57 0.00 0.00 179.45 180.92 1nhm n GLN 52 N -4.03 -0.12 0.20 3.15 1.13 -1.24 -0.06 117.38 116.41 1nhm n GLN 52 Ca -0.24 0.56 -0.17 0.00 -1.94 0.00 0.00 57.00 55.22 1nhm n GLN 52 Cb 0.85 -0.82 -0.09 0.00 0.11 0.00 0.00 30.24 30.28 1nhm n GLN 52 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1nhm h PRO 53 N 0.00 -0.80 -0.60 -1.09 0.13 -1.79 -1.30 132.00 126.55 1nhm h PRO 53 Ca 0.10 0.05 0.12 0.00 -0.87 0.00 0.00 66.00 65.40 1nhm h PRO 53 Cb 0.19 0.18 -0.09 0.00 0.13 0.00 0.00 31.00 31.41 1nhm h PRO 53 CO -0.35 -0.54 0.10 1.88 -0.23 0.00 0.00 178.00 178.86 1nhm h TYR 54 N -0.84 0.16 0.60 1.56 0.05 -0.70 -2.30 116.97 115.50 1nhm h TYR 54 Ca -0.02 0.04 -0.02 0.00 0.05 0.00 0.00 58.73 58.77 1nhm h TYR 54 Cb 0.78 0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.52 1nhm h TYR 54 CO -0.32 -0.06 -0.51 0.93 -1.05 0.00 0.00 178.16 177.16 1nhm h GLU 55 N 0.23 -1.05 -0.99 4.88 5.08 -0.76 0.76 114.58 122.74 1nhm h GLU 55 Ca 0.32 0.07 0.32 0.00 -1.00 0.00 0.00 59.36 59.07 1nhm h GLU 55 Cb 0.48 0.24 -0.15 0.00 0.50 0.00 0.00 28.75 29.81 1nhm h GLU 55 CO -0.42 -0.70 0.52 0.87 -1.00 0.00 0.00 179.01 178.28 1nhm h LYS 56 N -1.08 0.26 0.37 2.33 1.57 -0.71 0.15 116.57 119.46 1nhm h LYS 56 Ca -0.08 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 1nhm h LYS 56 Cb 0.92 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.17 1nhm h LYS 56 CO -0.01 0.17 -0.18 0.87 -0.57 0.00 0.00 179.45 179.73 1nhm h LYS 57 N 0.26 -0.49 -0.99 3.15 1.57 -0.95 -2.13 116.57 117.01 1nhm h LYS 57 Ca 0.73 0.03 0.28 0.00 -1.87 0.00 0.00 60.65 59.82 1nhm h LYS 57 Cb 1.68 0.11 -0.18 0.00 0.08 0.00 0.00 32.23 33.91 1nhm h LYS 57 CO -0.64 -0.32 0.08 0.00 -0.57 0.00 0.00 179.45 177.99 1nhm h ALA 58 N -1.57 1.25 0.51 3.86 0.00 0.44 -0.34 119.26 123.41 1nhm h ALA 58 Ca -0.05 0.33 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1nhm h ALA 58 Cb 0.39 0.57 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1nhm h ALA 58 CO 0.08 -0.60 -0.27 0.00 0.00 0.00 0.00 179.25 178.47 1nhm h ALA 59 N 1.98 -1.17 -0.94 0.00 0.00 -0.75 0.08 119.26 118.46 1nhm h ALA 59 Ca 0.62 -0.15 0.17 0.00 0.00 0.00 0.00 54.91 55.55 1nhm h ALA 59 Cb 1.31 0.32 -0.17 0.00 0.00 0.00 0.00 17.79 19.25 1nhm h ALA 59 CO -0.90 -1.12 -0.30 -0.22 0.00 0.00 0.00 179.25 176.71 1nhm h LYS 60 N -0.71 -0.01 0.74 0.00 3.64 -0.41 0.11 116.57 119.92 1nhm h LYS 60 Ca -0.07 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.28 1nhm h LYS 60 Cb 0.55 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.38 1nhm h LYS 60 CO 0.10 -0.01 -0.41 -0.07 -2.27 0.00 0.00 179.45 176.80 1nhm h LEU 61 N -0.01 -1.00 -1.57 5.20 3.38 -1.04 -2.09 115.31 118.18 1nhm h LEU 61 Ca 0.40 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.47 1nhm h LEU 61 Cb 0.65 0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.64 1nhm h LEU 61 CO -0.96 -0.65 0.36 0.07 0.09 0.00 0.00 178.44 177.35 1nhm h LYS 62 N -1.05 0.53 0.42 1.13 2.10 -0.40 -2.10 116.57 117.20 1nhm h LYS 62 Ca -0.10 -0.03 -0.01 0.00 -2.00 0.00 0.00 60.65 58.51 1nhm h LYS 62 Cb 0.83 -0.12 -0.02 0.00 -0.90 0.00 0.00 32.23 32.01 1nhm h LYS 62 CO 0.13 0.35 -0.45 1.49 -2.00 0.00 0.00 179.45 178.97 1nhm h GLU 63 N 0.54 -0.86 -0.76 0.07 4.81 -0.64 -0.07 114.58 117.66 1nhm h GLU 63 Ca 0.23 0.06 0.12 0.00 -0.13 0.00 0.00 59.36 59.64 1nhm h GLU 63 Cb 0.23 0.20 -0.13 0.00 0.63 0.00 0.00 28.75 29.68 1nhm h GLU 63 CO -0.06 -0.57 -0.37 -0.22 -0.73 0.00 0.00 179.01 177.05 1nhm h LYS 64 N -0.89 -0.10 -0.02 1.92 3.64 -0.71 -1.62 116.57 118.80 1nhm h LYS 64 Ca -0.04 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1nhm h LYS 64 Cb 0.79 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.63 1nhm h LYS 64 CO -0.08 -0.06 -0.10 -0.92 -2.27 0.00 0.00 179.45 176.02 1nhm h TYR 65 N -0.10 -0.29 -1.44 1.91 3.20 -1.01 -1.37 116.97 117.86 1nhm h TYR 65 Ca 0.27 0.01 0.42 0.00 3.14 0.00 0.00 58.73 62.57 1nhm h TYR 65 Cb 0.57 0.13 -0.06 0.00 1.54 0.00 0.00 36.73 38.91 1nhm h TYR 65 CO -0.75 -0.10 1.29 0.39 -1.64 0.00 0.00 178.16 177.35 1nhm n GLU 66 N -3.07 0.01 -0.04 1.82 1.02 -0.10 0.04 120.64 120.32 1nhm n GLU 66 Ca -0.01 1.02 -0.22 0.00 -0.02 0.00 0.00 57.16 57.94 1nhm n GLU 66 Cb 0.07 -2.46 -0.13 0.00 -0.02 0.00 0.00 31.44 28.90 1nhm n GLU 66 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1nhm h LYS 67 N 0.00 0.16 0.00 3.49 6.56 -0.93 -2.75 116.57 123.09 1nhm h LYS 67 Ca 0.69 -0.27 -0.00 0.00 -1.06 0.00 0.00 60.65 60.00 1nhm h LYS 67 Cb 3.26 0.10 -0.00 0.00 -0.57 0.00 0.00 32.23 35.02 1nhm h LYS 67 CO -0.01 1.13 -0.01 0.22 -2.06 0.00 0.00 179.45 178.72 1nhm h ASP 68 N -0.44 0.00 0.13 0.86 3.58 0.14 0.14 116.42 120.83 1nhm h ASP 68 Ca -0.36 0.00 -0.22 0.00 0.42 0.00 0.00 57.03 56.87 1nhm h ASP 68 Cb 1.68 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.74 1nhm h ASP 68 CO -0.03 0.01 -1.04 -0.29 -2.88 0.00 0.00 179.24 175.01 1nhm h ILE 69 N 0.00 1.34 0.00 2.25 -0.00 -0.53 -1.89 117.51 118.68 1nhm h ILE 69 Ca -0.00 -2.49 -0.03 0.00 -0.00 0.00 0.00 64.86 62.34 1nhm h ILE 69 Cb 0.73 3.02 -0.00 0.00 -0.00 0.00 0.00 36.82 40.56 1nhm h ILE 69 CO 0.00 0.71 -0.17 0.00 -0.00 0.00 0.00 178.15 178.69 1nhm h ALA 70 N 0.03 1.34 0.00 0.18 0.00 -1.28 0.42 119.26 119.94 1nhm h ALA 70 Ca -0.20 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1nhm h ALA 70 Cb 1.69 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.45 1nhm h ALA 70 CO 0.12 0.21 -0.25 0.00 0.00 0.00 0.00 179.25 179.33 1nhm h ALA 71 N 1.83 0.87 -0.01 0.00 0.00 -0.66 -1.87 119.26 119.43 1nhm h ALA 71 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1nhm h ALA 71 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1nhm h ALA 71 CO 0.02 0.00 -0.53 0.98 0.00 0.00 0.00 179.25 179.72 1nhm n TYR 72 N -2.80 0.00 -0.12 0.00 9.36 -0.47 -4.17 117.16 118.97 1nhm n TYR 72 Ca 0.03 0.00 -0.16 0.00 3.32 0.00 0.00 57.90 61.09 1nhm n TYR 72 Cb 0.51 0.00 -0.13 0.00 -0.63 0.00 0.00 39.34 39.09 1nhm n TYR 72 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 1nhm n ARG 73 N -0.79 0.66 -1.26 2.98 0.63 0.13 -4.33 116.66 114.69 1nhm n ARG 73 Ca 0.05 0.13 -0.31 0.00 -0.92 0.00 0.00 57.85 56.79 1nhm n ARG 73 Cb 0.28 -1.53 0.09 0.00 0.45 0.00 0.00 32.46 31.75 1nhm n ARG 73 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1nhm n ALA 74 N -3.14 6.05 -2.54 5.13 0.00 -0.70 -4.93 120.51 120.39 1nhm n ALA 74 Ca -0.42 -3.17 -0.25 0.00 0.00 0.00 0.00 53.44 49.60 1nhm n ALA 74 Cb 1.03 -1.67 -0.09 0.00 0.00 0.00 0.00 19.45 18.71 1nhm n ALA 74 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1nhm s LYS 75 N -3.51 1.95 -0.60 0.00 2.20 -1.26 -4.68 119.74 113.85 1nhm s LYS 75 Ca 0.60 -1.78 -0.02 0.00 -0.36 0.00 0.00 55.97 54.41 1nhm s LYS 75 Cb 0.47 -1.86 0.00 0.00 -1.51 0.00 0.00 37.83 34.94 1nhm s LYS 75 CO 0.01 0.19 0.24 0.41 -0.36 0.00 0.00 175.35 175.84 1nhm n GLY 76 N -0.85 0.22 0.09 5.54 0.00 -1.26 -4.93 105.19 104.00 1nhm n GLY 76 Ca -0.05 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1nhm n GLY 76 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nhm n LYS 77 N -2.00 0.00 -0.23 1.61 5.02 -1.26 -4.68 118.16 116.62 1nhm n LYS 77 Ca -0.04 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.27 1nhm n LYS 77 Cb 0.55 -0.95 0.13 0.00 -0.02 0.00 0.00 35.03 34.73 1nhm n LYS 77 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1nhm h PRO 78 N 0.00 0.12 -2.18 1.97 0.11 -1.91 -3.47 132.00 126.64 1nhm h PRO 78 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1nhm h PRO 78 Cb 0.98 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1nhm h PRO 78 CO 0.00 0.08 0.00 -3.47 -0.21 0.00 0.00 178.00 174.40 1nhm n ASP 79 N -5.29 -1.46 0.00 -2.05 2.03 -1.26 -5.01 116.55 103.51 1nhm n ASP 79 Ca 0.11 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.42 1nhm n ASP 79 Cb 0.40 -0.42 0.00 0.00 -0.72 0.00 0.00 41.12 40.38 1nhm n ASP 79 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1nhm n ALA 80 N -1.04 0.00 0.10 -1.67 0.00 -1.26 -5.19 120.51 111.45 1nhm n ALA 80 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1nhm n ALA 80 Cb 0.36 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.82 1nhm n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50