#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nhn n ALA 4 N 0.00 -0.25 -1.16 -2.53 0.00 -1.26 -4.74 120.51 110.57 1nhn n ALA 4 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 1nhn n ALA 4 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.50 1nhn n ALA 4 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1nhn n PRO 5 N -0.15 0.11 -3.61 0.00 -0.02 -1.26 -5.00 135.00 125.07 1nhn n PRO 5 Ca 0.00 0.06 -0.29 0.00 -2.02 0.00 0.00 63.50 61.25 1nhn n PRO 5 Cb 0.00 -1.46 -0.12 0.00 -0.02 0.00 0.00 33.50 31.90 1nhn n PRO 5 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1nhn s LYS 6 N -2.26 1.01 -0.39 -0.52 -2.85 -1.26 -5.02 119.74 108.45 1nhn s LYS 6 Ca 0.57 -1.78 -0.31 0.00 -1.00 0.00 0.00 55.97 53.45 1nhn s LYS 6 Cb -0.34 -1.92 0.05 0.00 -2.06 0.00 0.00 37.83 33.56 1nhn s LYS 6 CO 0.66 -1.19 0.56 0.54 0.10 0.00 0.00 175.35 176.02 1nhn n ARG 7 N 3.67 -1.81 -1.20 1.78 1.74 -1.26 -5.02 116.66 114.56 1nhn n ARG 7 Ca 0.11 1.46 -0.30 0.00 -0.77 0.00 0.00 57.85 58.34 1nhn n ARG 7 Cb 0.36 -2.41 0.25 0.00 -1.02 0.00 0.00 32.46 29.64 1nhn n ARG 7 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 1nhn s PRO 8 N -2.27 -1.29 0.65 5.56 0.02 -1.26 -5.02 135.00 131.39 1nhn s PRO 8 Ca 0.31 -0.25 -0.17 0.00 0.02 0.00 0.00 61.00 60.91 1nhn s PRO 8 Cb -0.04 -1.61 -0.13 0.00 0.02 0.00 0.00 34.50 32.75 1nhn s PRO 8 CO 0.75 -3.72 -0.12 -2.30 -0.33 0.00 0.00 177.00 171.28 1nhn n PRO 9 N -4.73 0.08 -0.67 5.54 -0.02 -1.26 -4.81 135.00 129.14 1nhn n PRO 9 Ca 0.15 0.04 0.04 0.00 -2.02 0.00 0.00 63.50 61.71 1nhn n PRO 9 Cb 0.60 -1.18 0.07 0.00 -0.02 0.00 0.00 33.50 32.97 1nhn n PRO 9 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1nhn n SER 10 N 2.14 1.04 0.00 2.55 2.88 -1.26 -4.29 113.62 116.68 1nhn n SER 10 Ca 0.06 -2.54 0.00 0.00 -1.33 0.00 0.00 58.87 55.06 1nhn n SER 10 Cb 0.49 -0.33 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 1nhn n SER 10 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nhn n ALA 11 N -0.37 0.00 0.08 -1.46 0.00 -1.26 -4.53 120.51 112.97 1nhn n ALA 11 Ca 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.46 1nhn n ALA 11 Cb 0.80 0.00 0.08 0.00 0.00 0.00 0.00 19.45 20.33 1nhn n ALA 11 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1nhn h PHE 12 N 0.00 0.33 -0.96 0.00 3.57 -1.94 -3.14 116.94 114.80 1nhn h PHE 12 Ca 0.00 -0.14 0.07 0.00 3.53 0.00 0.00 57.97 61.43 1nhn h PHE 12 Cb 0.00 -0.05 -0.07 0.00 2.79 0.00 0.00 35.95 38.62 1nhn h PHE 12 CO 0.00 0.85 0.62 0.35 -2.23 0.00 0.00 178.31 177.90 1nhn h PHE 13 N 0.17 1.14 0.65 0.41 3.04 -1.93 0.13 116.94 120.56 1nhn h PHE 13 Ca -0.02 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 61.93 1nhn h PHE 13 Cb 1.22 -0.37 -0.00 0.00 2.56 0.00 0.00 35.95 39.36 1nhn h PHE 13 CO 0.03 0.58 -0.36 -0.07 -2.02 0.00 0.00 178.31 176.46 1nhn h LEU 14 N 1.11 -0.90 -0.69 0.59 -0.00 -1.93 -2.57 115.31 110.93 1nhn h LEU 14 Ca 0.42 0.04 0.14 0.00 -0.00 0.00 0.00 57.88 58.48 1nhn h LEU 14 Cb 0.18 0.25 -0.10 0.00 -0.00 0.00 0.00 40.66 40.99 1nhn h LEU 14 CO -0.18 -0.59 0.16 0.15 -0.00 0.00 0.00 178.44 177.99 1nhn h PHE 15 N -0.95 0.25 -0.23 1.13 3.57 -1.52 -2.11 116.94 117.09 1nhn h PHE 15 Ca -0.08 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.51 1nhn h PHE 15 Cb 0.75 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 39.41 1nhn h PHE 15 CO -0.07 -0.06 -0.39 0.00 -2.23 0.00 0.00 178.31 175.57 1nhn h SER 17 N -0.40 -1.38 -0.05 0.00 0.87 -1.00 0.58 113.55 112.17 1nhn h SER 17 Ca 0.11 0.16 0.02 0.00 -1.23 0.00 0.00 61.79 60.84 1nhn h SER 17 Cb 0.59 0.53 -0.00 0.00 -0.44 0.00 0.00 62.40 63.07 1nhn h SER 17 CO -0.44 -0.42 0.23 -0.33 -0.53 0.00 0.00 176.83 175.34 1nhn h GLU 18 N -0.53 0.00 0.00 2.24 5.08 -1.23 -3.11 114.58 117.03 1nhn h GLU 18 Ca 0.01 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.15 1nhn h GLU 18 Cb 0.58 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.79 1nhn h GLU 18 CO -0.31 0.00 -1.85 0.66 -1.00 0.00 0.00 179.01 176.51 1nhn n TYR 19 N -3.13 0.00 -0.22 4.33 4.02 -0.88 -4.69 117.16 116.59 1nhn n TYR 19 Ca -0.01 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.82 1nhn n TYR 19 Cb 0.30 -0.59 -0.05 0.00 -0.02 0.00 0.00 39.34 38.98 1nhn n TYR 19 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1nhn n ARG 20 N -2.65 -0.23 0.00 -0.72 1.74 0.15 -0.18 116.66 114.78 1nhn n ARG 20 Ca -0.23 0.94 0.08 0.00 -0.77 0.00 0.00 57.85 57.88 1nhn n ARG 20 Cb 0.85 -1.39 0.39 0.00 -1.02 0.00 0.00 32.46 31.29 1nhn n ARG 20 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1nhn n PRO 21 N -4.32 0.19 -0.12 5.56 -0.04 -1.26 -0.70 135.00 134.32 1nhn n PRO 21 Ca 0.01 0.15 -0.24 0.00 -0.04 0.00 0.00 63.50 63.38 1nhn n PRO 21 Cb 0.13 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 31.99 1nhn n PRO 21 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1nhn n LYS 22 N -1.32 0.57 -0.10 0.54 4.76 0.75 -1.94 118.16 121.43 1nhn n LYS 22 Ca 0.07 0.47 -0.10 0.00 -2.87 0.00 0.00 58.31 55.88 1nhn n LYS 22 Cb 0.14 -1.66 -0.03 0.00 -1.84 0.00 0.00 35.03 31.64 1nhn n LYS 22 CO 0.00 0.00 0.00 -0.84 -1.37 0.00 0.00 177.40 175.19 1nhn h ILE 23 N -1.00 1.22 -0.70 -0.18 3.07 -1.25 -0.02 117.51 118.66 1nhn h ILE 23 Ca -0.45 -0.73 0.12 0.00 1.55 0.00 0.00 64.86 65.34 1nhn h ILE 23 Cb 1.38 1.12 -0.04 0.00 -0.27 0.00 0.00 36.82 39.01 1nhn h ILE 23 CO -0.28 0.24 0.46 0.50 -1.05 0.00 0.00 178.15 178.03 1nhn h LYS 24 N 0.33 0.45 -0.79 0.16 1.63 -1.07 0.88 116.57 118.15 1nhn h LYS 24 Ca 0.09 -0.03 0.14 0.00 -0.85 0.00 0.00 60.65 60.01 1nhn h LYS 24 Cb 0.30 -0.10 -0.06 0.00 -0.60 0.00 0.00 32.23 31.77 1nhn h LYS 24 CO 0.00 0.30 0.52 0.78 -3.45 0.00 0.00 179.45 177.60 1nhn h GLY 25 N 0.46 0.86 0.00 5.01 0.00 -0.31 -0.16 103.07 108.92 1nhn h GLY 25 Ca 0.33 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.44 1nhn h GLY 25 CO -0.10 0.08 -1.82 1.18 0.00 0.00 0.00 176.54 175.87 1nhn n GLU 26 N -4.50 0.59 -2.96 4.80 -0.58 0.23 -4.58 120.64 113.63 1nhn n GLU 26 Ca 0.15 -0.17 -0.30 0.00 -0.42 0.00 0.00 57.16 56.43 1nhn n GLU 26 Cb 0.49 -1.49 -0.03 0.00 -0.57 0.00 0.00 31.44 29.84 1nhn n GLU 26 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1nhn n HIS 27 N -2.13 3.77 -0.09 -0.32 8.25 0.28 -4.82 115.22 120.16 1nhn n HIS 27 Ca -0.03 -3.76 -0.04 0.00 -0.26 0.00 0.00 57.72 53.63 1nhn n HIS 27 Cb 0.52 -0.63 0.02 0.00 1.12 0.00 0.00 29.99 31.01 1nhn n HIS 27 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1nhn n PRO 28 N -0.03 1.20 0.00 -0.41 -0.04 -0.45 -2.71 135.00 132.56 1nhn n PRO 28 Ca 0.33 -0.43 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1nhn n PRO 28 Cb 0.37 -1.17 0.00 0.00 -0.04 0.00 0.00 33.50 32.66 1nhn n PRO 28 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nhn n GLY 29 N 0.82 0.00 3.95 0.55 0.00 -1.26 -5.10 105.19 104.14 1nhn n GLY 29 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1nhn n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nhn s LEU 30 N -0.87 2.78 0.47 0.99 1.43 -1.10 -5.10 118.68 117.28 1nhn s LEU 30 Ca 0.00 0.08 0.05 0.00 -1.03 0.00 0.00 54.13 53.23 1nhn s LEU 30 Cb 0.00 -2.13 -0.02 0.00 0.03 0.00 0.00 46.19 44.07 1nhn s LEU 30 CO 0.00 -2.66 0.16 -0.55 0.23 0.00 0.00 176.35 173.53 1nhn s SER 31 N -4.90 4.33 -0.13 2.29 0.15 -1.26 -4.97 113.70 109.21 1nhn s SER 31 Ca 0.74 -1.31 0.10 0.00 0.70 0.00 0.00 55.95 56.18 1nhn s SER 31 Cb -0.03 0.01 0.50 0.00 -1.71 0.00 0.00 66.02 64.79 1nhn s SER 31 CO 0.52 -0.75 1.30 0.00 1.20 0.00 0.00 173.24 175.51 1nhn n ILE 32 N -1.34 1.56 -0.01 6.45 3.06 -1.26 -1.41 119.36 126.42 1nhn n ILE 32 Ca -0.07 -0.84 -0.00 0.00 -2.50 0.00 0.00 62.75 59.34 1nhn n ILE 32 Cb 0.65 -0.25 -0.01 0.00 0.54 0.00 0.00 39.64 40.58 1nhn n ILE 32 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1nhn n GLY 33 N 0.54 -0.07 0.19 4.50 0.00 -1.26 -4.37 105.19 104.72 1nhn n GLY 33 Ca 0.17 -0.03 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 1nhn n GLY 33 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nhn n ASP 34 N -1.96 1.85 0.14 1.61 -0.08 -1.13 -2.43 116.55 114.54 1nhn n ASP 34 Ca -0.02 0.29 0.08 0.00 -1.51 0.00 0.00 54.79 53.63 1nhn n ASP 34 Cb 0.46 -0.74 0.58 0.00 2.34 0.00 0.00 41.12 43.75 1nhn n ASP 34 CO 0.00 0.00 0.00 1.62 0.12 0.00 0.00 177.20 178.94 1nhn h VAL 35 N -0.88 0.99 -0.10 5.18 3.04 -1.55 0.19 116.25 123.13 1nhn h VAL 35 Ca -0.66 -0.06 -0.17 0.00 -1.01 0.00 0.00 66.70 64.80 1nhn h VAL 35 Cb 1.59 0.80 0.01 0.00 -2.01 0.00 0.00 31.29 31.68 1nhn h VAL 35 CO -0.38 0.03 -0.61 0.00 -1.01 0.00 0.00 177.57 175.60 1nhn h ALA 36 N 1.88 0.21 -0.78 3.17 0.00 -1.74 -2.03 119.26 119.97 1nhn h ALA 36 Ca 0.09 -0.54 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 1nhn h ALA 36 Cb 0.12 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1nhn h ALA 36 CO -0.01 0.47 0.36 -0.22 0.00 0.00 0.00 179.25 179.84 1nhn h LYS 37 N 0.22 1.14 0.44 0.00 1.63 -0.42 0.13 116.57 119.71 1nhn h LYS 37 Ca -0.05 -0.18 -0.01 0.00 -0.85 0.00 0.00 60.65 59.56 1nhn h LYS 37 Cb 1.25 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 32.68 1nhn h LYS 37 CO 0.12 0.90 -0.29 -0.22 -3.45 0.00 0.00 179.45 176.51 1nhn h LYS 38 N 1.12 -0.68 -0.48 1.90 1.63 -0.74 -1.40 116.57 117.91 1nhn h LYS 38 Ca 0.27 0.05 0.10 0.00 -0.85 0.00 0.00 60.65 60.21 1nhn h LYS 38 Cb 0.15 0.15 -0.09 0.00 -0.60 0.00 0.00 32.23 31.84 1nhn h LYS 38 CO -0.03 -0.45 -0.13 -0.07 -3.45 0.00 0.00 179.45 175.32 1nhn h LEU 39 N -0.71 -0.47 -1.60 5.20 3.38 -1.00 0.14 115.31 120.25 1nhn h LEU 39 Ca -0.05 0.15 0.50 0.00 0.09 0.00 0.00 57.88 58.57 1nhn h LEU 39 Cb 0.59 0.31 -0.10 0.00 0.09 0.00 0.00 40.66 41.54 1nhn h LEU 39 CO 0.03 -0.17 1.10 0.61 0.09 0.00 0.00 178.44 180.11 1nhn n GLY 40 N -1.35 -0.87 0.17 0.83 0.00 0.42 -1.39 105.19 103.00 1nhn n GLY 40 Ca 0.04 0.69 -0.27 0.00 0.00 0.00 0.00 46.02 46.48 1nhn n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nhn n GLU 41 N -4.20 0.57 0.23 1.61 1.02 0.20 -4.54 120.64 115.53 1nhn n GLU 41 Ca 0.40 0.23 0.18 0.00 -0.02 0.00 0.00 57.16 57.95 1nhn n GLU 41 Cb 1.71 -1.45 0.86 0.00 -0.02 0.00 0.00 31.44 32.54 1nhn n GLU 41 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 1nhn h MET 42 N -0.80 0.00 -0.58 3.49 2.86 0.38 -2.32 114.93 117.95 1nhn h MET 42 Ca -0.66 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 56.90 1nhn h MET 42 Cb 1.63 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.27 1nhn h MET 42 CO -0.36 0.00 0.03 2.35 1.06 0.00 0.00 176.91 179.99 1nhn h TRP 43 N 0.00 1.09 0.00 -0.22 2.91 -1.47 -1.07 115.95 117.19 1nhn h TRP 43 Ca 0.07 -0.18 0.00 0.00 1.13 0.00 0.00 58.89 59.92 1nhn h TRP 43 Cb 0.48 -0.29 0.00 0.00 -0.51 0.00 0.00 29.16 28.85 1nhn h TRP 43 CO 0.00 0.96 0.00 0.27 -1.03 0.00 0.00 178.44 178.64 1nhn n ASN 44 N -4.25 0.00 -1.19 2.65 0.23 -0.88 -2.20 115.26 109.61 1nhn n ASN 44 Ca 0.03 -0.44 -0.04 0.00 -0.53 0.00 0.00 54.58 53.60 1nhn n ASN 44 Cb 0.32 -0.16 0.20 0.00 -2.08 0.00 0.00 39.78 38.07 1nhn n ASN 44 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1nhn n ASN 45 N -1.16 2.67 0.00 0.53 3.02 -0.43 -4.96 115.26 114.93 1nhn n ASN 45 Ca 0.16 -3.70 0.00 0.00 -0.03 0.00 0.00 54.58 51.02 1nhn n ASN 45 Cb 0.16 -0.64 0.00 0.00 -0.61 0.00 0.00 39.78 38.69 1nhn n ASN 45 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1nhn n THR 46 N -1.07 0.00 -1.14 3.41 5.66 -0.94 -4.97 114.28 115.24 1nhn n THR 46 Ca 0.33 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 61.38 1nhn n THR 46 Cb 1.06 0.00 0.23 0.00 -1.55 0.00 0.00 70.33 70.06 1nhn n THR 46 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nhn n ALA 47 N -3.00 3.29 -0.30 1.79 0.00 -1.26 -4.96 120.51 116.07 1nhn n ALA 47 Ca 0.00 -2.59 0.00 0.00 0.00 0.00 0.00 53.44 50.85 1nhn n ALA 47 Cb 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 19.45 18.77 1nhn n ALA 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nhn n ALA 48 N -0.80 0.00 0.00 0.00 0.00 -1.26 -3.83 120.51 114.62 1nhn n ALA 48 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1nhn n ALA 48 Cb 0.91 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 20.28 1nhn n ALA 48 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1nhn n ASP 49 N 1.88 1.98 -0.49 0.00 -0.08 -1.26 -4.70 116.55 113.87 1nhn n ASP 49 Ca 0.00 0.00 0.13 0.00 -1.51 0.00 0.00 54.79 53.41 1nhn n ASP 49 Cb 0.00 0.39 0.39 0.00 2.34 0.00 0.00 41.12 44.23 1nhn n ASP 49 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1nhn n ASP 50 N -0.62 1.64 0.00 1.67 9.92 -1.25 -3.78 116.55 124.14 1nhn n ASP 50 Ca 0.00 -1.42 -0.21 0.00 -0.53 0.00 0.00 54.79 52.63 1nhn n ASP 50 Cb 0.01 0.07 -0.14 0.00 -0.64 0.00 0.00 41.12 40.42 1nhn n ASP 50 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1nhn n LYS 51 N 0.13 0.75 -0.34 -1.24 5.02 -1.26 -4.15 118.16 117.07 1nhn n LYS 51 Ca 0.16 0.26 -0.00 0.00 -2.02 0.00 0.00 58.31 56.71 1nhn n LYS 51 Cb 0.40 -1.71 0.04 0.00 -0.02 0.00 0.00 35.03 33.74 1nhn n LYS 51 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1nhn n GLN 52 N -3.46 -0.19 0.23 1.97 3.00 -1.25 0.16 117.38 117.84 1nhn n GLN 52 Ca -0.31 1.35 -0.17 0.00 -0.01 0.00 0.00 57.00 57.87 1nhn n GLN 52 Cb 1.05 -2.01 -0.09 0.00 0.00 0.00 0.00 30.24 29.19 1nhn n GLN 52 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.06 176.06 1nhn h PRO 53 N 0.00 -0.85 -0.81 -1.09 0.13 -1.79 -1.23 132.00 126.37 1nhn h PRO 53 Ca 0.32 0.06 0.16 0.00 -0.87 0.00 0.00 66.00 65.67 1nhn h PRO 53 Cb 0.54 0.19 -0.15 0.00 0.13 0.00 0.00 31.00 31.71 1nhn h PRO 53 CO -0.88 -0.57 -0.19 1.88 -0.23 0.00 0.00 178.00 178.01 1nhn h TYR 54 N -0.88 -0.41 0.14 1.56 -1.99 -0.92 -1.82 116.97 112.65 1nhn h TYR 54 Ca -0.05 0.07 -0.00 0.00 2.00 0.00 0.00 58.73 60.75 1nhn h TYR 54 Cb 0.79 0.31 -0.00 0.00 2.00 0.00 0.00 36.73 39.82 1nhn h TYR 54 CO -0.29 -0.34 -0.13 0.93 -0.00 0.00 0.00 178.16 178.32 1nhn h GLU 55 N 0.00 -0.26 -1.74 4.88 4.39 -0.16 0.51 114.58 122.21 1nhn h GLU 55 Ca 0.39 0.02 0.50 0.00 0.34 0.00 0.00 59.36 60.61 1nhn h GLU 55 Cb 0.60 0.06 -0.07 0.00 -0.10 0.00 0.00 28.75 29.24 1nhn h GLU 55 CO -0.83 -0.17 1.38 1.63 -1.16 0.00 0.00 179.01 179.86 1nhn n LYS 56 N -3.07 0.00 -0.03 2.33 5.02 -0.48 0.13 118.16 122.08 1nhn n LYS 56 Ca -0.03 1.07 -0.01 0.00 -2.02 0.00 0.00 58.31 57.31 1nhn n LYS 56 Cb 0.12 -2.52 -0.00 0.00 -0.02 0.00 0.00 35.03 32.61 1nhn n LYS 56 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1nhn h LYS 57 N 0.00 0.00 -0.93 1.97 3.64 -1.11 -2.98 116.57 117.16 1nhn h LYS 57 Ca 0.83 0.00 0.26 0.00 -1.27 0.00 0.00 60.65 60.47 1nhn h LYS 57 Cb 3.57 0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 35.25 1nhn h LYS 57 CO -0.01 0.00 0.38 0.00 -2.27 0.00 0.00 179.45 177.55 1nhn h ALA 58 N -1.56 1.54 0.60 5.00 0.00 0.03 0.54 119.26 125.41 1nhn h ALA 58 Ca 0.00 0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1nhn h ALA 58 Cb 0.16 0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.18 1nhn h ALA 58 CO 0.00 -0.47 -0.29 0.00 0.00 0.00 0.00 179.25 178.49 1nhn h ALA 59 N 1.79 -0.81 -0.92 0.00 0.00 -0.49 -0.21 119.26 118.63 1nhn h ALA 59 Ca 0.61 -0.20 0.26 0.00 0.00 0.00 0.00 54.91 55.58 1nhn h ALA 59 Cb 1.28 0.31 -0.16 0.00 0.00 0.00 0.00 17.79 19.22 1nhn h ALA 59 CO -0.61 -0.90 0.13 -0.22 0.00 0.00 0.00 179.25 177.65 1nhn h LYS 60 N -0.92 0.09 0.02 0.00 3.64 -0.75 0.18 116.57 118.83 1nhn h LYS 60 Ca -0.08 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1nhn h LYS 60 Cb 0.66 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1nhn h LYS 60 CO 0.14 0.06 -0.01 -0.07 -2.27 0.00 0.00 179.45 177.29 1nhn h LEU 61 N 0.09 -0.02 0.00 5.20 3.38 -1.13 -2.94 115.31 119.89 1nhn h LEU 61 Ca 0.58 -0.71 -0.18 0.00 0.09 0.00 0.00 57.88 57.65 1nhn h LEU 61 Cb 1.19 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.92 1nhn h LEU 61 CO -0.79 0.73 -0.91 0.07 0.09 0.00 0.00 178.44 177.63 1nhn h LYS 62 N -0.79 0.00 0.61 1.13 2.10 -0.71 -2.73 116.57 116.19 1nhn h LYS 62 Ca -0.00 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.62 1nhn h LYS 62 Cb 0.73 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.07 1nhn h LYS 62 CO 0.00 0.82 -0.30 1.49 -2.00 0.00 0.00 179.45 179.47 1nhn h GLU 63 N 0.00 -0.80 -0.80 0.07 4.57 -0.81 -2.22 114.58 114.60 1nhn h GLU 63 Ca -0.02 0.05 0.12 0.00 -1.18 0.00 0.00 59.36 58.33 1nhn h GLU 63 Cb 1.67 0.18 -0.13 0.00 -0.16 0.00 0.00 28.75 30.31 1nhn h GLU 63 CO 0.11 -0.49 -0.40 -0.22 -1.18 0.00 0.00 179.01 176.83 1nhn h LYS 64 N -1.15 -0.09 0.00 1.92 1.63 -1.60 -2.44 116.57 114.85 1nhn h LYS 64 Ca -0.08 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.72 1nhn h LYS 64 Cb 0.67 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.32 1nhn h LYS 64 CO 0.14 -0.06 0.00 0.98 -3.45 0.00 0.00 179.45 177.06 1nhn n TYR 65 N -5.43 0.00 -0.45 1.91 9.36 -1.03 -0.53 117.16 120.98 1nhn n TYR 65 Ca 0.06 0.00 0.36 0.00 3.32 0.00 0.00 57.90 61.64 1nhn n TYR 65 Cb 0.37 -0.29 0.58 0.00 -0.63 0.00 0.00 39.34 39.37 1nhn n TYR 65 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 1nhn n GLU 66 N -2.01 -0.02 -0.08 2.98 1.02 -0.85 0.01 120.64 121.71 1nhn n GLU 66 Ca 0.00 0.93 -0.19 0.00 -0.02 0.00 0.00 57.16 57.88 1nhn n GLU 66 Cb 0.00 -1.96 -0.12 0.00 -0.02 0.00 0.00 31.44 29.34 1nhn n GLU 66 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1nhn h LYS 67 N 0.00 0.03 -0.03 3.49 6.56 -1.15 -3.05 116.57 122.43 1nhn h LYS 67 Ca 0.71 -0.06 0.01 0.00 -1.06 0.00 0.00 60.65 60.25 1nhn h LYS 67 Cb 2.55 0.02 -0.00 0.00 -0.57 0.00 0.00 32.23 34.23 1nhn h LYS 67 CO -0.22 1.03 0.02 0.22 -2.06 0.00 0.00 179.45 178.44 1nhn h ASP 68 N -0.91 0.00 0.00 0.86 3.58 0.19 0.56 116.42 120.71 1nhn h ASP 68 Ca -0.21 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.24 1nhn h ASP 68 Cb 1.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.30 1nhn h ASP 68 CO -0.09 0.00 -0.00 -0.29 -2.88 0.00 0.00 179.24 175.98 1nhn h ILE 69 N 0.00 1.72 -0.75 2.25 -0.00 -0.53 0.70 117.51 120.90 1nhn h ILE 69 Ca 0.01 -2.11 0.21 0.00 -0.00 0.00 0.00 64.86 62.98 1nhn h ILE 69 Cb 0.06 3.15 -0.03 0.00 -0.00 0.00 0.00 36.82 40.00 1nhn h ILE 69 CO -0.00 0.55 0.54 0.00 -0.00 0.00 0.00 178.15 179.23 1nhn h ALA 70 N 0.10 2.67 0.14 0.18 0.00 -1.14 0.97 119.26 122.20 1nhn h ALA 70 Ca -0.00 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.70 1nhn h ALA 70 Cb 0.90 0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.76 1nhn h ALA 70 CO 0.00 -0.89 -0.83 0.00 0.00 0.00 0.00 179.25 177.53 1nhn h ALA 71 N 1.63 -0.09 -0.81 0.00 0.00 -0.82 -2.67 119.26 116.50 1nhn h ALA 71 Ca 0.36 -0.70 0.15 0.00 0.00 0.00 0.00 54.91 54.72 1nhn h ALA 71 Cb 1.40 0.10 -0.10 0.00 0.00 0.00 0.00 17.79 19.19 1nhn h ALA 71 CO -0.01 0.39 0.37 -0.92 0.00 0.00 0.00 179.25 179.08 1nhn h TYR 72 N -0.35 0.65 -0.73 0.00 3.20 0.15 0.41 116.97 120.29 1nhn h TYR 72 Ca -0.14 0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.70 1nhn h TYR 72 Cb 1.65 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 39.73 1nhn h TYR 72 CO 0.19 0.11 0.20 0.00 -1.64 0.00 0.00 178.16 177.03 1nhn h ARG 73 N 0.53 1.16 0.00 1.82 2.47 -1.13 -1.42 114.38 117.80 1nhn h ARG 73 Ca 0.45 -0.27 0.00 0.00 -1.26 0.00 0.00 59.98 58.90 1nhn h ARG 73 Cb 0.67 -0.16 0.00 0.00 -1.65 0.00 0.00 29.97 28.83 1nhn h ARG 73 CO -0.39 1.00 0.00 0.00 0.56 0.00 0.00 179.97 181.14 1nhn n ALA 74 N -2.45 2.44 -2.41 0.04 0.00 0.12 -4.76 120.51 113.49 1nhn n ALA 74 Ca 0.06 -0.05 -0.22 0.00 0.00 0.00 0.00 53.44 53.23 1nhn n ALA 74 Cb 0.25 -1.12 -0.09 0.00 0.00 0.00 0.00 19.45 18.49 1nhn n ALA 74 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1nhn s LYS 75 N -2.00 1.76 0.00 0.00 -0.14 -0.14 -4.93 119.74 114.28 1nhn s LYS 75 Ca 0.11 -2.04 0.00 0.00 -1.36 0.00 0.00 55.97 52.69 1nhn s LYS 75 Cb 0.05 -0.28 0.00 0.00 -1.68 0.00 0.00 37.83 35.92 1nhn s LYS 75 CO 0.09 -0.48 0.00 0.41 -0.76 0.00 0.00 175.35 174.61 1nhn n GLY 76 N -0.73 3.30 0.37 -3.33 0.00 -0.74 -4.88 105.19 99.19 1nhn n GLY 76 Ca -0.01 -0.82 -0.12 0.00 0.00 0.00 0.00 46.02 45.07 1nhn n GLY 76 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nhn n LYS 77 N 0.00 0.30 -0.02 1.61 5.02 -1.26 -4.59 118.16 119.21 1nhn n LYS 77 Ca 0.00 0.10 -0.10 0.00 -2.02 0.00 0.00 58.31 56.30 1nhn n LYS 77 Cb 0.00 -1.10 -0.04 0.00 -0.02 0.00 0.00 35.03 33.88 1nhn n LYS 77 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1nhn h PRO 78 N -0.29 0.10 -2.93 1.97 0.11 -1.91 -3.43 132.00 125.61 1nhn h PRO 78 Ca -0.32 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.65 1nhn h PRO 78 Cb 1.36 -0.02 -0.23 0.00 0.11 0.00 0.00 31.00 32.22 1nhn h PRO 78 CO -0.14 0.06 -0.29 -0.51 -0.21 0.00 0.00 178.00 176.91 1nhn s ASP 79 N -5.26 -0.30 -0.58 -2.05 1.11 -1.26 -5.06 116.67 103.26 1nhn s ASP 79 Ca -0.13 0.47 0.06 0.00 0.18 0.00 0.00 52.55 53.13 1nhn s ASP 79 Cb 0.09 0.56 0.32 0.00 1.07 0.00 0.00 42.92 44.95 1nhn s ASP 79 CO 0.68 -0.25 0.88 0.00 1.18 0.00 0.00 175.17 177.66 1nhn n ALA 80 N 2.26 4.38 0.00 5.23 0.00 -1.26 -1.78 120.51 129.33 1nhn n ALA 80 Ca -0.16 -4.65 0.00 0.00 0.00 0.00 0.00 53.44 48.63 1nhn n ALA 80 Cb 0.57 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 19.24 1nhn n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50