#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 -1.00 -1.00 5.20 0.00 -1.26 -4.96 120.51 117.49 1nhn n ALA 4 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1nhn n ALA 4 Cb 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 19.45 19.21 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 -1.41 0.07 -3.44 0.00 -0.02 -1.26 -4.95 135.00 123.99 1nhn n PRO 5 Ca 0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.07 1nhn n PRO 5 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.46 1nhn n PRO 5 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1nhn n LYS 6 N -0.96 3.23 -0.13 -0.52 5.02 -1.26 -5.01 118.16 118.53 1nhn n LYS 6 Ca 0.00 -4.47 -0.02 0.00 -2.02 0.00 0.00 58.31 51.80 1nhn n LYS 6 Cb 0.00 -2.49 -0.02 0.00 -0.02 0.00 0.00 35.03 32.50 1nhn n LYS 6 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1nhn n ARG 7 N 2.46 0.00 -1.44 1.97 1.74 -1.26 -4.88 116.66 115.25 1nhn n ARG 7 Ca 0.23 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 57.02 1nhn n ARG 7 Cb 0.38 -0.09 0.16 0.00 -1.02 0.00 0.00 32.46 31.90 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 0.59 0.59 1.33 5.56 0.02 -1.26 -5.04 135.00 136.78 1nhn s PRO 8 Ca 0.10 0.21 -0.21 0.00 0.02 0.00 0.00 61.00 61.12 1nhn s PRO 8 Cb -0.06 -1.78 0.32 0.00 0.02 0.00 0.00 34.50 32.99 1nhn s PRO 8 CO 0.04 -2.55 0.73 -0.35 -0.33 0.00 0.00 177.00 174.54 1nhn n PRO 9 N -4.00 -4.03 -0.41 5.54 -0.04 -1.26 -4.84 135.00 125.96 1nhn n PRO 9 Ca 0.08 -1.19 0.04 0.00 -0.04 0.00 0.00 63.50 62.39 1nhn n PRO 9 Cb 0.59 -1.79 0.06 0.00 -0.04 0.00 0.00 33.50 32.32 1nhn n PRO 9 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1nhn n SER 10 N -4.40 0.99 0.00 3.54 7.64 -1.26 -4.73 113.62 115.39 1nhn n SER 10 Ca 0.11 -2.48 0.00 0.00 1.01 0.00 0.00 58.87 57.51 1nhn n SER 10 Cb 0.52 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 1nhn n SER 10 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nhn n ALA 11 N -0.54 0.00 0.22 -0.43 0.00 -1.26 -4.54 120.51 113.97 1nhn n ALA 11 Ca 0.07 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.61 1nhn n ALA 11 Cb 0.71 0.00 0.46 0.00 0.00 0.00 0.00 19.45 20.62 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 0.00 -0.23 0.00 3.57 -1.94 -3.05 116.94 115.29 1nhn h PHE 12 Ca 0.00 0.00 -0.19 0.00 3.53 0.00 0.00 57.97 61.31 1nhn h PHE 12 Cb 0.00 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1nhn h PHE 12 CO 0.00 0.23 -0.60 0.35 -2.23 0.00 0.00 178.31 176.06 1nhn h PHE 13 N 0.00 1.05 0.22 0.41 3.04 -1.93 -1.07 116.94 118.66 1nhn h PHE 13 Ca -0.00 -0.41 0.01 0.00 3.98 0.00 0.00 57.97 61.55 1nhn h PHE 13 Cb 0.74 -0.19 -0.02 0.00 2.56 0.00 0.00 35.95 39.04 1nhn h PHE 13 CO 0.00 1.23 -0.25 -0.07 -2.02 0.00 0.00 178.31 177.20 1nhn h LEU 14 N 0.58 -0.68 -0.79 0.59 -0.00 -1.90 -0.58 115.31 112.52 1nhn h LEU 14 Ca -0.01 0.07 0.18 0.00 -0.00 0.00 0.00 57.88 58.12 1nhn h LEU 14 Cb 1.21 0.24 -0.12 0.00 -0.00 0.00 0.00 40.66 41.99 1nhn h LEU 14 CO 0.13 -0.36 0.21 0.15 -0.00 0.00 0.00 178.44 178.57 1nhn h PHE 15 N -0.52 0.33 0.41 1.13 3.57 -1.52 -1.39 116.94 118.95 1nhn h PHE 15 Ca 0.00 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 1nhn h PHE 15 Cb 0.49 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.21 1nhn h PHE 15 CO -0.18 -0.11 -0.20 0.00 -2.23 0.00 0.00 178.31 175.59 1nhn n SER 17 N -5.30 -0.70 0.18 0.00 2.88 -0.31 -0.13 113.62 110.23 1nhn n SER 17 Ca -0.11 1.50 0.02 0.00 -1.33 0.00 0.00 58.87 58.96 1nhn n SER 17 Cb 0.25 -0.28 0.37 0.00 -0.75 0.00 0.00 64.21 63.80 1nhn n SER 17 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1nhn h GLU 18 N 0.00 0.05 0.00 -1.46 5.08 -1.51 -3.36 114.58 113.38 1nhn h GLU 18 Ca 0.23 -0.02 -0.39 0.00 -1.00 0.00 0.00 59.36 58.18 1nhn h GLU 18 Cb 0.44 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.62 1nhn h GLU 18 CO -0.83 0.36 -2.46 0.66 -1.00 0.00 0.00 179.01 175.74 1nhn n TYR 19 N -4.15 0.03 -0.34 4.33 4.02 -0.04 -4.50 117.16 116.52 1nhn n TYR 19 Ca -0.02 0.01 -0.06 0.00 -0.01 0.00 0.00 57.90 57.82 1nhn n TYR 19 Cb 0.37 -1.00 -0.02 0.00 -0.02 0.00 0.00 39.34 38.67 1nhn n TYR 19 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 1nhn h ARG 20 N 0.00 -0.06 0.00 -0.72 2.43 -0.67 0.46 114.38 115.82 1nhn h ARG 20 Ca -0.58 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.60 1nhn h ARG 20 Cb 1.91 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.48 1nhn h ARG 20 CO -0.08 -0.04 0.00 -0.35 -1.51 0.00 0.00 179.97 177.99 1nhn n PRO 21 N -5.39 0.05 -0.08 0.20 -0.04 -1.26 -0.30 135.00 128.18 1nhn n PRO 21 Ca 0.06 0.46 -0.11 0.00 -0.04 0.00 0.00 63.50 63.86 1nhn n PRO 21 Cb 0.35 -1.64 -0.06 0.00 -0.04 0.00 0.00 33.50 32.11 1nhn n PRO 21 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1nhn h LYS 22 N 0.00 0.00 -0.40 0.54 1.63 -0.35 -2.64 116.57 115.36 1nhn h LYS 22 Ca 0.00 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.79 1nhn h LYS 22 Cb 0.11 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.72 1nhn h LYS 22 CO 0.00 0.44 0.21 -0.84 -3.45 0.00 0.00 179.45 175.81 1nhn h ILE 23 N -1.00 1.16 -1.01 2.00 3.07 -1.20 0.14 117.51 120.67 1nhn h ILE 23 Ca -0.14 -0.42 0.18 0.00 1.55 0.00 0.00 64.86 66.04 1nhn h ILE 23 Cb 0.81 0.71 -0.11 0.00 -0.27 0.00 0.00 36.82 37.96 1nhn h ILE 23 CO -0.08 0.17 0.61 0.50 -1.05 0.00 0.00 178.15 178.30 1nhn h LYS 24 N 0.51 0.76 -0.93 0.16 3.64 -0.81 0.38 116.57 120.28 1nhn h LYS 24 Ca 0.14 -0.05 0.26 0.00 -1.27 0.00 0.00 60.65 59.73 1nhn h LYS 24 Cb 0.07 -0.17 -0.17 0.00 -0.41 0.00 0.00 32.23 31.56 1nhn h LYS 24 CO -0.02 0.51 0.10 0.78 -2.27 0.00 0.00 179.45 178.55 1nhn h GLY 25 N 0.79 1.28 0.44 5.01 0.00 -0.32 -0.38 103.07 109.89 1nhn h GLY 25 Ca 0.57 0.09 -0.18 0.00 0.00 0.00 0.00 47.33 47.82 1nhn h GLY 25 CO -0.37 -0.47 -1.83 -1.84 0.00 0.00 0.00 176.54 172.02 1nhn n GLU 26 N -5.40 0.65 -3.23 4.80 0.28 0.51 -4.61 120.64 113.64 1nhn n GLU 26 Ca 0.22 0.04 -0.35 0.00 -0.16 0.00 0.00 57.16 56.92 1nhn n GLU 26 Cb 0.74 -1.65 -0.04 0.00 1.43 0.00 0.00 31.44 31.92 1nhn n GLU 26 CO 0.00 0.00 0.00 -2.39 -0.16 0.00 0.00 177.13 174.58 1nhn n HIS 27 N -2.68 3.02 -0.12 -1.84 1.44 0.10 -4.86 115.22 110.29 1nhn n HIS 27 Ca -0.15 -3.43 0.00 0.00 -2.01 0.00 0.00 57.72 52.13 1nhn n HIS 27 Cb 0.85 -0.89 0.00 0.00 0.12 0.00 0.00 29.99 30.07 1nhn n HIS 27 CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 1nhn n PRO 28 N 1.09 0.80 0.00 -1.40 -0.04 -0.93 -2.85 135.00 131.67 1nhn n PRO 28 Ca 0.28 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.74 1nhn n PRO 28 Cb 0.37 -1.10 0.00 0.00 -0.04 0.00 0.00 33.50 32.73 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 1.37 0.80 4.00 0.55 0.00 -1.26 -5.11 105.19 105.54 1nhn n GLY 29 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.56 3.03 0.40 0.99 1.43 -1.13 -5.12 118.68 117.71 1nhn s LEU 30 Ca 0.00 -0.39 0.05 0.00 -1.03 0.00 0.00 54.13 52.76 1nhn s LEU 30 Cb 0.00 -2.03 -0.06 0.00 0.03 0.00 0.00 46.19 44.13 1nhn s LEU 30 CO 0.00 -1.72 0.03 -0.55 0.23 0.00 0.00 176.35 174.35 1nhn s SER 31 N -4.69 3.39 -0.02 2.29 0.15 -1.26 -5.00 113.70 108.56 1nhn s SER 31 Ca 0.65 -1.45 0.01 0.00 0.70 0.00 0.00 55.95 55.85 1nhn s SER 31 Cb -0.06 -0.06 0.06 0.00 -1.71 0.00 0.00 66.02 64.25 1nhn s SER 31 CO 0.43 -0.61 0.67 0.00 1.20 0.00 0.00 173.24 174.93 1nhn n ILE 32 N -0.94 0.36 -0.02 6.45 3.06 -1.26 -1.70 119.36 125.32 1nhn n ILE 32 Ca -0.07 -0.10 -0.01 0.00 -2.50 0.00 0.00 62.75 60.06 1nhn n ILE 32 Cb 0.67 -0.57 -0.03 0.00 0.54 0.00 0.00 39.64 40.25 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 0.10 -0.19 0.18 4.50 0.00 -1.26 -4.27 105.19 104.24 1nhn n GLY 33 Ca 0.02 -0.07 -0.27 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.09 1.88 -0.01 1.61 2.03 -0.86 -2.87 116.55 116.24 1nhn n ASP 34 Ca -0.06 0.27 0.11 0.00 0.52 0.00 0.00 54.79 55.63 1nhn n ASP 34 Cb 0.57 -0.74 0.52 0.00 -0.72 0.00 0.00 41.12 40.76 1nhn n ASP 34 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 1nhn h VAL 35 N -0.84 0.94 -0.11 5.18 2.07 -1.63 0.29 116.25 122.14 1nhn h VAL 35 Ca -0.66 -0.12 -0.03 0.00 0.82 0.00 0.00 66.70 66.71 1nhn h VAL 35 Cb 1.62 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 31.95 1nhn h VAL 35 CO -0.37 0.06 -0.04 0.00 0.02 0.00 0.00 177.57 177.24 1nhn h ALA 36 N 1.75 0.15 -0.00 1.67 0.00 -1.73 0.71 119.26 121.81 1nhn h ALA 36 Ca 0.21 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1nhn h ALA 36 Cb 0.39 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1nhn h ALA 36 CO -0.05 -0.09 -0.17 0.87 0.00 0.00 0.00 179.25 179.80 1nhn h LYS 37 N -0.12 0.01 0.15 0.00 1.57 -0.43 0.37 116.57 118.12 1nhn h LYS 37 Ca 0.03 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1nhn h LYS 37 Cb 0.47 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1nhn h LYS 37 CO 0.01 0.18 -0.07 -0.22 -0.57 0.00 0.00 179.45 178.78 1nhn h LYS 38 N 0.01 -0.20 -0.39 3.15 3.64 -0.48 -2.76 116.57 119.53 1nhn h LYS 38 Ca -0.00 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.46 1nhn h LYS 38 Cb 0.31 0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.12 1nhn h LYS 38 CO 0.02 0.10 0.01 -0.07 -2.27 0.00 0.00 179.45 177.24 1nhn h LEU 39 N -0.99 -0.14 -0.88 5.20 3.38 -0.79 -0.07 115.31 121.02 1nhn h LEU 39 Ca -0.02 0.09 0.30 0.00 0.09 0.00 0.00 57.88 58.33 1nhn h LEU 39 Cb 0.39 0.15 -0.16 0.00 0.09 0.00 0.00 40.66 41.13 1nhn h LEU 39 CO 0.03 -0.03 0.21 0.61 0.09 0.00 0.00 178.44 179.35 1nhn n GLY 40 N -1.27 -0.96 0.06 0.83 0.00 0.13 -0.73 105.19 103.25 1nhn n GLY 40 Ca 0.02 0.80 -0.05 0.00 0.00 0.00 0.00 46.02 46.80 1nhn n GLY 40 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1nhn h GLU 41 N 0.00 0.00 -1.00 1.61 5.08 -0.77 -3.37 114.58 116.14 1nhn h GLU 41 Ca 0.62 0.00 0.27 0.00 -1.00 0.00 0.00 59.36 59.26 1nhn h GLU 41 Cb 1.48 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.67 1nhn h GLU 41 CO -0.76 0.29 0.69 0.52 -1.00 0.00 0.00 179.01 178.75 1nhn h MET 42 N -1.00 0.14 -0.81 2.33 2.86 0.48 -2.03 114.93 116.90 1nhn h MET 42 Ca -0.01 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.58 1nhn h MET 42 Cb 0.33 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 31.92 1nhn h MET 42 CO -0.01 0.09 0.36 2.35 1.06 0.00 0.00 176.91 180.76 1nhn h TRP 43 N 0.14 1.20 0.00 -0.22 2.91 -1.08 -0.64 115.95 118.26 1nhn h TRP 43 Ca 0.50 -0.07 0.00 0.00 1.13 0.00 0.00 58.89 60.45 1nhn h TRP 43 Cb 1.72 -0.37 0.00 0.00 -0.51 0.00 0.00 29.16 30.01 1nhn h TRP 43 CO -0.00 0.89 0.00 0.27 -1.03 0.00 0.00 178.44 178.57 1nhn n ASN 44 N -4.29 0.49 -1.91 2.65 0.23 -0.77 -2.41 115.26 109.25 1nhn n ASN 44 Ca 0.08 0.57 -0.21 0.00 -0.53 0.00 0.00 54.58 54.49 1nhn n ASN 44 Cb 0.16 -0.70 0.14 0.00 -2.08 0.00 0.00 39.78 37.31 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 -1.99 4.46 -0.13 0.53 3.02 -0.29 -4.95 115.26 115.91 1nhn n ASN 45 Ca 0.05 -3.73 0.00 0.00 -0.03 0.00 0.00 54.58 50.87 1nhn n ASN 45 Cb 0.32 -0.76 0.00 0.00 -0.61 0.00 0.00 39.78 38.73 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 -1.04 0.00 -1.22 3.41 5.66 -0.95 -4.95 114.28 115.18 1nhn n THR 46 Ca 0.51 0.00 0.06 0.00 -3.05 0.00 0.00 64.05 61.57 1nhn n THR 46 Cb 1.15 0.00 0.20 0.00 -1.55 0.00 0.00 70.33 70.13 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 3.11 -0.47 1.79 0.00 -1.26 -4.97 120.51 115.72 1nhn n ALA 47 Ca 0.00 -2.77 0.00 0.00 0.00 0.00 0.00 53.44 50.67 1nhn n ALA 47 Cb 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 18.92 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 -1.08 0.00 0.00 0.00 0.00 -1.26 -3.92 120.51 114.25 1nhn n ALA 48 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1nhn n ALA 48 Cb 0.79 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 20.13 1nhn n ALA 48 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1nhn n ASP 49 N 1.53 0.90 -0.97 0.00 9.92 -1.26 -4.70 116.55 121.97 1nhn n ASP 49 Ca 0.00 -0.07 0.12 0.00 -0.53 0.00 0.00 54.79 54.31 1nhn n ASP 49 Cb 0.00 0.32 0.11 0.00 -0.64 0.00 0.00 41.12 40.91 1nhn n ASP 49 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1nhn n ASP 50 N -0.41 3.04 -0.03 -2.24 9.92 -1.25 -4.12 116.55 121.45 1nhn n ASP 50 Ca 0.00 -1.99 -0.18 0.00 -0.53 0.00 0.00 54.79 52.09 1nhn n ASP 50 Cb 0.00 -0.02 -0.14 0.00 -0.64 0.00 0.00 41.12 40.32 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 1.36 0.72 -0.26 -1.24 5.02 -1.26 -4.33 118.16 118.16 1nhn n LYS 51 Ca 0.14 0.23 0.02 0.00 -2.02 0.00 0.00 58.31 56.69 1nhn n LYS 51 Cb 0.60 -1.68 0.07 0.00 -0.02 0.00 0.00 35.03 34.00 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 -3.33 -0.10 0.15 1.97 1.13 -1.26 -0.09 117.38 115.85 1nhn n GLN 52 Ca -0.32 1.10 -0.09 0.00 -1.94 0.00 0.00 57.00 55.74 1nhn n GLN 52 Cb 1.04 -1.64 -0.05 0.00 0.11 0.00 0.00 30.24 29.71 1nhn n GLN 52 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1nhn h PRO 53 N 0.00 -0.50 -0.90 -1.09 0.13 -1.83 -1.68 132.00 126.12 1nhn h PRO 53 Ca 0.31 0.03 0.25 0.00 -0.87 0.00 0.00 66.00 65.72 1nhn h PRO 53 Cb 0.48 0.11 -0.14 0.00 0.13 0.00 0.00 31.00 31.58 1nhn h PRO 53 CO -0.72 -0.34 0.29 1.88 -0.23 0.00 0.00 178.00 178.89 1nhn h TYR 54 N -0.52 0.45 0.48 1.56 0.05 -0.86 -1.43 116.97 116.69 1nhn h TYR 54 Ca -0.03 0.05 -0.02 0.00 0.05 0.00 0.00 58.73 58.77 1nhn h TYR 54 Cb 0.46 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 38.14 1nhn h TYR 54 CO -0.17 -0.20 -0.25 0.93 -1.05 0.00 0.00 178.16 177.41 1nhn h GLU 55 N 0.23 -0.65 -1.27 4.88 4.39 -0.37 0.12 114.58 121.92 1nhn h GLU 55 Ca 0.59 0.04 0.44 0.00 0.34 0.00 0.00 59.36 60.77 1nhn h GLU 55 Cb 1.21 0.15 -0.14 0.00 -0.10 0.00 0.00 28.75 29.87 1nhn h GLU 55 CO -0.65 -0.43 0.79 0.87 -1.16 0.00 0.00 179.01 178.43 1nhn h LYS 56 N -0.67 0.05 0.10 2.33 1.79 -0.30 0.25 116.57 120.11 1nhn h LYS 56 Ca -0.07 -0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.40 1nhn h LYS 56 Cb 0.53 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.17 1nhn h LYS 56 CO 0.09 0.03 -0.05 -0.22 -1.08 0.00 0.00 179.45 178.22 1nhn h LYS 57 N 0.05 -0.13 -0.76 3.15 3.11 -0.98 -2.50 116.57 118.50 1nhn h LYS 57 Ca 0.85 0.01 0.17 0.00 -2.81 0.00 0.00 60.65 58.87 1nhn h LYS 57 Cb 2.57 0.03 -0.13 0.00 -1.00 0.00 0.00 32.23 33.70 1nhn h LYS 57 CO -0.52 -0.09 0.06 0.00 -2.81 0.00 0.00 179.45 176.09 1nhn h ALA 58 N -1.78 0.86 0.39 5.00 0.00 0.24 -1.37 119.26 122.60 1nhn h ALA 58 Ca -0.01 0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1nhn h ALA 58 Cb 0.11 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1nhn h ALA 58 CO 0.02 -0.41 -0.29 0.00 0.00 0.00 0.00 179.25 178.57 1nhn h ALA 59 N 1.69 -0.67 -0.67 0.00 0.00 -0.67 0.12 119.26 119.05 1nhn h ALA 59 Ca 0.42 -0.12 0.13 0.00 0.00 0.00 0.00 54.91 55.35 1nhn h ALA 59 Cb 0.76 0.38 -0.13 0.00 0.00 0.00 0.00 17.79 18.80 1nhn h ALA 59 CO -0.63 -0.90 -0.21 -0.22 0.00 0.00 0.00 179.25 177.30 1nhn h LYS 60 N -0.67 -0.03 0.09 0.00 3.64 -0.79 0.80 116.57 119.62 1nhn h LYS 60 Ca -0.04 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1nhn h LYS 60 Cb 0.57 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1nhn h LYS 60 CO 0.01 -0.02 -0.05 -0.07 -2.27 0.00 0.00 179.45 177.05 1nhn h LEU 61 N -0.04 -0.11 -0.76 5.20 3.38 -1.21 -3.07 115.31 118.70 1nhn h LEU 61 Ca 0.31 -0.42 0.08 0.00 0.09 0.00 0.00 57.88 57.95 1nhn h LEU 61 Cb 0.52 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.23 1nhn h LEU 61 CO -0.71 0.39 0.42 0.11 0.09 0.00 0.00 178.44 178.74 1nhn h LYS 62 N -0.65 0.70 -0.11 1.13 1.57 -0.41 -2.20 116.57 116.59 1nhn h LYS 62 Ca -0.01 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1nhn h LYS 62 Cb 0.52 -0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.62 1nhn h LYS 62 CO 0.02 0.46 -0.42 1.49 -0.57 0.00 0.00 179.45 180.43 1nhn h GLU 63 N 0.72 -0.43 -0.98 3.15 4.22 -0.92 0.16 114.58 120.51 1nhn h GLU 63 Ca 0.36 0.03 0.20 0.00 0.08 0.00 0.00 59.36 60.03 1nhn h GLU 63 Cb 0.31 0.10 -0.19 0.00 0.50 0.00 0.00 28.75 29.48 1nhn h GLU 63 CO -0.24 -0.29 -0.22 0.36 -2.18 0.00 0.00 179.01 176.45 1nhn n LYS 64 N -4.76 -0.09 0.20 1.92 2.85 -0.85 -1.42 118.16 116.01 1nhn n LYS 64 Ca -0.05 1.52 -0.08 0.00 -1.05 0.00 0.00 58.31 58.65 1nhn n LYS 64 Cb 0.29 -2.28 -0.04 0.00 -0.65 0.00 0.00 35.03 32.35 1nhn n LYS 64 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 177.40 176.43 1nhn h TYR 65 N 0.00 -0.47 -1.61 5.58 5.03 -0.98 -1.13 116.97 123.38 1nhn h TYR 65 Ca 0.48 -0.01 0.47 0.00 2.58 0.00 0.00 58.73 62.25 1nhn h TYR 65 Cb 0.76 0.16 -0.08 0.00 1.55 0.00 0.00 36.73 39.12 1nhn h TYR 65 CO -0.73 -0.29 1.14 0.93 -1.32 0.00 0.00 178.16 177.89 1nhn h GLU 66 N -0.63 0.02 0.06 1.82 5.08 0.05 0.45 114.58 121.44 1nhn h GLU 66 Ca -0.05 -0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.15 1nhn h GLU 66 Cb 0.39 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 1nhn h GLU 66 CO 0.09 0.01 -0.80 0.87 -1.00 0.00 0.00 179.01 178.18 1nhn h LYS 67 N 0.02 0.14 0.00 2.33 6.56 -1.21 -2.94 116.57 121.46 1nhn h LYS 67 Ca 0.79 -0.23 -0.01 0.00 -1.06 0.00 0.00 60.65 60.14 1nhn h LYS 67 Cb 3.07 0.09 -0.00 0.00 -0.57 0.00 0.00 32.23 34.82 1nhn h LYS 67 CO -0.07 1.11 -0.05 0.22 -2.06 0.00 0.00 179.45 178.59 1nhn h ASP 68 N -0.67 0.00 -0.19 0.86 3.58 0.10 0.29 116.42 120.40 1nhn h ASP 68 Ca -0.18 0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.13 1nhn h ASP 68 Cb 1.41 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.46 1nhn h ASP 68 CO 0.01 0.05 -0.43 -0.29 -2.88 0.00 0.00 179.24 175.71 1nhn h ILE 69 N 0.00 1.33 -0.66 2.25 -0.00 -0.52 0.19 117.51 120.10 1nhn h ILE 69 Ca -0.00 -1.67 -0.08 0.00 -0.00 0.00 0.00 64.86 63.11 1nhn h ILE 69 Cb 0.13 1.91 -0.03 0.00 -0.00 0.00 0.00 36.82 38.83 1nhn h ILE 69 CO 0.01 0.52 0.08 0.00 -0.00 0.00 0.00 178.15 178.76 1nhn h ALA 70 N 0.58 0.89 0.00 0.18 0.00 -1.13 -1.17 119.26 118.61 1nhn h ALA 70 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1nhn h ALA 70 Cb 1.04 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1nhn h ALA 70 CO 0.09 0.67 0.00 0.00 0.00 0.00 0.00 179.25 180.02 1nhn n ALA 71 N -2.47 2.43 -0.07 0.00 0.00 0.92 0.22 120.51 121.54 1nhn n ALA 71 Ca 0.04 -0.15 -0.05 0.00 0.00 0.00 0.00 53.44 53.27 1nhn n ALA 71 Cb 0.31 -1.41 -0.03 0.00 0.00 0.00 0.00 19.45 18.32 1nhn n ALA 71 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1nhn h TYR 72 N 0.00 0.00 0.00 0.00 -1.99 0.65 -3.46 116.97 112.17 1nhn h TYR 72 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1nhn h TYR 72 Cb 0.03 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.76 1nhn h TYR 72 CO 0.00 0.23 -0.16 0.54 -0.00 0.00 0.00 178.16 178.77 1nhn n ARG 73 N -4.66 1.53 -1.93 4.88 1.74 -1.11 -4.89 116.66 112.22 1nhn n ARG 73 Ca -0.07 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.66 1nhn n ARG 73 Cb 0.22 -0.58 0.04 0.00 -1.02 0.00 0.00 32.46 31.12 1nhn n ARG 73 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1nhn n ALA 74 N -0.65 6.03 -0.13 7.54 0.00 -0.06 -4.86 120.51 128.38 1nhn n ALA 74 Ca 0.00 -4.00 0.08 0.00 0.00 0.00 0.00 53.44 49.52 1nhn n ALA 74 Cb 0.07 -1.48 0.15 0.00 0.00 0.00 0.00 19.45 18.19 1nhn n ALA 74 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1nhn n LYS 75 N -0.62 -0.03 0.00 0.00 2.85 0.61 -4.60 118.16 116.36 1nhn n LYS 75 Ca 0.52 0.54 0.00 0.00 -1.05 0.00 0.00 58.31 58.32 1nhn n LYS 75 Cb 0.48 -0.90 0.00 0.00 -0.65 0.00 0.00 35.03 33.97 1nhn n LYS 75 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1nhn n GLY 76 N -1.15 0.20 0.66 2.58 0.00 -1.26 -4.70 105.19 101.52 1nhn n GLY 76 Ca 0.11 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1nhn n GLY 76 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1nhn n LYS 77 N 0.00 0.00 0.04 1.61 3.00 -1.26 -4.77 118.16 116.78 1nhn n LYS 77 Ca 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 58.31 58.44 1nhn n LYS 77 Cb 0.00 0.00 0.50 0.00 0.00 0.00 0.00 35.03 35.53 1nhn n LYS 77 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 1nhn n PRO 78 N -0.09 0.09 -1.79 1.64 -0.02 -1.26 -3.77 135.00 129.80 1nhn n PRO 78 Ca 0.00 0.13 -0.34 0.00 -2.02 0.00 0.00 63.50 61.28 1nhn n PRO 78 Cb 0.00 -1.62 -0.02 0.00 -0.02 0.00 0.00 33.50 31.84 1nhn n PRO 78 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1nhn n ASP 79 N -1.78 7.12 -2.28 2.55 -0.08 -1.26 -4.21 116.55 116.60 1nhn n ASP 79 Ca 0.06 -3.34 0.01 0.00 -1.51 0.00 0.00 54.79 50.00 1nhn n ASP 79 Cb 0.33 -1.23 0.04 0.00 2.34 0.00 0.00 41.12 42.60 1nhn n ASP 79 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1nhn n ALA 80 N 0.77 2.62 -0.95 -1.67 0.00 -1.25 -5.27 120.51 114.76 1nhn n ALA 80 Ca 0.53 -2.31 0.00 0.00 0.00 0.00 0.00 53.44 51.66 1nhn n ALA 80 Cb 0.40 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 19.05 1nhn n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50