#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 -1.57 -0.81 5.41 0.00 -1.26 -4.92 120.51 117.35 1nhn n ALA 4 Ca 0.00 0.45 -0.35 0.00 0.00 0.00 0.00 53.44 53.54 1nhn n ALA 4 Cb 0.00 -1.31 0.11 0.00 0.00 0.00 0.00 19.45 18.25 1nhn n ALA 4 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1nhn n PRO 5 N 2.11 -0.93 -0.67 0.00 -0.04 -1.26 -4.87 135.00 129.34 1nhn n PRO 5 Ca -0.06 -0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.13 1nhn n PRO 5 Cb 0.10 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.17 1nhn n PRO 5 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1nhn n LYS 6 N -0.06 0.00 -0.11 0.54 5.02 -1.26 -5.09 118.16 117.20 1nhn n LYS 6 Ca -0.01 0.22 -0.23 0.00 -2.02 0.00 0.00 58.31 56.27 1nhn n LYS 6 Cb 0.68 -0.67 -0.11 0.00 -0.02 0.00 0.00 35.03 34.90 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 -0.41 0.63 -2.19 1.97 5.12 -1.26 -5.02 116.66 115.50 1nhn n ARG 7 Ca 0.00 0.26 -0.27 0.00 -1.93 0.00 0.00 57.85 55.91 1nhn n ARG 7 Cb 0.19 -1.57 0.14 0.00 -1.16 0.00 0.00 32.46 30.07 1nhn n ARG 7 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1nhn s PRO 8 N -2.50 1.20 0.82 5.56 0.04 -1.26 -5.06 135.00 133.79 1nhn s PRO 8 Ca -0.34 -0.62 -0.22 0.00 0.04 0.00 0.00 61.00 59.86 1nhn s PRO 8 Cb 0.11 -2.05 -0.16 0.00 0.04 0.00 0.00 34.50 32.44 1nhn s PRO 8 CO 0.58 -1.93 -1.24 -0.35 0.04 0.00 0.00 177.00 174.09 1nhn n PRO 9 N -3.34 0.00 -0.47 0.56 -0.04 -1.26 -4.94 135.00 125.51 1nhn n PRO 9 Ca 0.14 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.67 1nhn n PRO 9 Cb 0.60 -0.84 0.13 0.00 -0.04 0.00 0.00 33.50 33.34 1nhn n PRO 9 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1nhn n SER 10 N 2.92 1.63 0.00 3.54 2.88 -1.26 -4.84 113.62 118.49 1nhn n SER 10 Ca -0.02 -3.06 0.00 0.00 -1.33 0.00 0.00 58.87 54.47 1nhn n SER 10 Cb 0.60 -0.41 0.00 0.00 -0.75 0.00 0.00 64.21 63.65 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 -0.89 0.00 1.15 -1.46 0.00 -1.26 -4.56 120.51 113.49 1nhn n ALA 11 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.68 1nhn n ALA 11 Cb 0.72 0.00 0.59 0.00 0.00 0.00 0.00 19.45 20.76 1nhn n ALA 11 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1nhn n PHE 12 N 0.00 0.00 -0.03 0.00 7.35 -1.26 -3.08 117.46 120.44 1nhn n PHE 12 Ca 0.00 0.00 -0.19 0.00 -0.76 0.00 0.00 57.45 56.50 1nhn n PHE 12 Cb 0.00 -0.20 -0.13 0.00 0.35 0.00 0.00 39.48 39.50 1nhn n PHE 12 CO 0.00 0.00 0.00 0.35 -0.76 0.00 0.00 176.76 176.35 1nhn h PHE 13 N 0.00 0.25 -0.49 -5.13 3.57 -1.94 -1.56 116.94 111.64 1nhn h PHE 13 Ca 0.00 -0.18 0.10 0.00 3.53 0.00 0.00 57.97 61.42 1nhn h PHE 13 Cb 0.14 -0.01 -0.09 0.00 2.79 0.00 0.00 35.95 38.78 1nhn h PHE 13 CO 0.00 1.30 -0.12 -0.07 -2.23 0.00 0.00 178.31 177.20 1nhn h LEU 14 N -0.67 -0.44 -0.58 0.59 -0.00 -1.90 0.27 115.31 112.57 1nhn h LEU 14 Ca -0.17 0.14 0.01 0.00 -0.00 0.00 0.00 57.88 57.86 1nhn h LEU 14 Cb 1.41 0.30 -0.03 0.00 -0.00 0.00 0.00 40.66 42.33 1nhn h LEU 14 CO 0.02 -0.16 0.38 0.15 -0.00 0.00 0.00 178.44 178.83 1nhn h PHE 15 N 0.01 0.72 0.00 1.13 3.57 -1.66 -1.31 116.94 119.40 1nhn h PHE 15 Ca 0.24 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.75 1nhn h PHE 15 Cb 0.36 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 38.86 1nhn h PHE 15 CO -0.41 0.45 0.00 0.00 -2.23 0.00 0.00 178.31 176.12 1nhn n SER 17 N -0.87 1.82 -0.31 0.00 2.88 -0.17 -3.74 113.62 113.23 1nhn n SER 17 Ca 0.11 0.30 0.11 0.00 -1.33 0.00 0.00 58.87 58.06 1nhn n SER 17 Cb 0.05 -0.69 0.28 0.00 -0.75 0.00 0.00 64.21 63.10 1nhn n SER 17 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1nhn h GLU 18 N -0.86 0.53 0.00 -1.46 4.57 -1.22 -3.35 114.58 112.79 1nhn h GLU 18 Ca -0.06 -0.03 -0.36 0.00 -1.18 0.00 0.00 59.36 57.73 1nhn h GLU 18 Cb 0.93 -0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 29.34 1nhn h GLU 18 CO -0.04 0.35 -2.26 0.66 -1.18 0.00 0.00 179.01 176.54 1nhn n TYR 19 N -4.93 0.00 -0.24 0.92 4.02 -0.84 -4.57 117.16 111.52 1nhn n TYR 19 Ca 0.21 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 58.05 1nhn n TYR 19 Cb 0.56 -0.82 -0.03 0.00 -0.02 0.00 0.00 39.34 39.03 1nhn n TYR 19 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 1nhn n ARG 20 N -3.67 -0.21 0.21 -0.72 0.63 -1.25 0.10 116.66 111.75 1nhn n ARG 20 Ca -0.42 0.89 0.15 0.00 -0.92 0.00 0.00 57.85 57.54 1nhn n ARG 20 Cb 0.85 -1.31 0.63 0.00 0.45 0.00 0.00 32.46 33.09 1nhn n ARG 20 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 1nhn h PRO 21 N 0.00 0.00 0.05 -0.14 0.13 -1.84 0.62 132.00 130.82 1nhn h PRO 21 Ca 0.13 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 65.04 1nhn h PRO 21 Cb 0.28 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.39 1nhn h PRO 21 CO -0.56 0.00 -1.17 -0.22 -0.23 0.00 0.00 178.00 175.82 1nhn h LYS 22 N 0.00 0.11 -0.45 0.86 3.11 -0.58 -2.34 116.57 117.27 1nhn h LYS 22 Ca 0.00 -0.18 -0.13 0.00 -2.81 0.00 0.00 60.65 57.53 1nhn h LYS 22 Cb 0.38 0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 31.67 1nhn h LYS 22 CO 0.00 1.09 -0.21 -0.84 -2.81 0.00 0.00 179.45 176.68 1nhn h ILE 23 N -0.68 1.27 0.00 2.00 3.07 -1.32 -1.78 117.51 120.07 1nhn h ILE 23 Ca -0.28 -1.37 -0.03 0.00 1.55 0.00 0.00 64.86 64.73 1nhn h ILE 23 Cb 1.47 1.18 -0.00 0.00 -0.27 0.00 0.00 36.82 39.20 1nhn h ILE 23 CO -0.06 0.47 -0.13 0.50 -1.05 0.00 0.00 178.15 177.88 1nhn h LYS 24 N 0.78 0.00 -0.10 0.16 3.64 -1.00 1.25 116.57 121.31 1nhn h LYS 24 Ca 0.10 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 1nhn h LYS 24 Cb 0.78 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.59 1nhn h LYS 24 CO 0.06 0.13 -0.13 0.78 -2.27 0.00 0.00 179.45 178.02 1nhn h GLY 25 N 0.43 0.17 0.37 5.01 0.00 -0.75 -1.07 103.07 107.24 1nhn h GLY 25 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1nhn h GLY 25 CO 0.02 0.09 -1.61 1.18 0.00 0.00 0.00 176.54 176.22 1nhn n GLU 26 N -4.30 0.63 -3.14 4.80 -0.58 0.08 -4.52 120.64 113.60 1nhn n GLU 26 Ca -0.01 -0.08 -0.26 0.00 -0.42 0.00 0.00 57.16 56.39 1nhn n GLU 26 Cb 0.25 -1.63 -0.06 0.00 -0.57 0.00 0.00 31.44 29.43 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 -2.40 3.59 -1.04 -0.32 8.25 0.41 -4.80 115.22 118.92 1nhn n HIS 27 Ca -0.02 -4.04 -0.18 0.00 -0.26 0.00 0.00 57.72 53.22 1nhn n HIS 27 Cb 0.56 -0.51 -0.01 0.00 1.12 0.00 0.00 29.99 31.15 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 0.25 1.93 0.00 -0.41 -0.04 -0.49 -3.71 135.00 132.52 1nhn n PRO 28 Ca 0.30 -1.64 0.00 0.00 -0.04 0.00 0.00 63.50 62.12 1nhn n PRO 28 Cb 0.41 -1.75 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 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 0.72 0.00 0.00 0.55 0.00 -1.26 -5.10 105.19 100.10 1nhn n GLY 29 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.36 1nhn n GLY 29 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1nhn n LEU 30 N -1.42 0.00 -4.83 0.99 -0.00 -1.24 -5.15 117.00 105.34 1nhn n LEU 30 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 56.01 55.71 1nhn n LEU 30 Cb 0.29 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.67 1nhn n LEU 30 CO 0.00 -0.29 -0.10 -0.55 -0.00 0.00 0.00 177.39 176.45 1nhn s SER 31 N -0.89 4.38 -0.16 1.45 0.15 -1.26 -4.99 113.70 112.38 1nhn s SER 31 Ca 0.00 -1.45 0.04 0.00 0.70 0.00 0.00 55.95 55.24 1nhn s SER 31 Cb 0.00 0.48 0.33 0.00 -1.71 0.00 0.00 66.02 65.11 1nhn s SER 31 CO 0.00 -0.98 1.26 0.00 1.20 0.00 0.00 173.24 174.72 1nhn n ILE 32 N -1.52 1.67 -0.01 6.45 3.06 -1.26 -1.64 119.36 126.11 1nhn n ILE 32 Ca -0.10 -0.76 -0.01 0.00 -2.50 0.00 0.00 62.75 59.38 1nhn n ILE 32 Cb 0.66 -0.61 -0.01 0.00 0.54 0.00 0.00 39.64 40.21 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 -0.02 -0.06 0.14 4.50 0.00 -1.26 -4.32 105.19 104.17 1nhn n GLY 33 Ca 0.21 -0.02 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.11 1.96 0.08 1.61 -0.08 -0.98 -2.50 116.55 114.53 1nhn n ASP 34 Ca -0.02 0.29 0.03 0.00 -1.51 0.00 0.00 54.79 53.57 1nhn n ASP 34 Cb 0.54 -0.78 0.40 0.00 2.34 0.00 0.00 41.12 43.62 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 -0.89 1.15 -0.39 5.18 3.04 -1.62 0.18 116.25 122.91 1nhn h VAL 35 Ca -0.69 -0.60 -0.13 0.00 -1.01 0.00 0.00 66.70 64.27 1nhn h VAL 35 Cb 1.65 1.00 -0.01 0.00 -2.01 0.00 0.00 31.29 31.92 1nhn h VAL 35 CO -0.39 0.20 -0.27 0.00 -1.01 0.00 0.00 177.57 176.10 1nhn h ALA 36 N 1.67 0.56 -0.28 3.17 0.00 -1.74 -1.19 119.26 121.45 1nhn h ALA 36 Ca 0.07 -0.40 -0.15 0.00 0.00 0.00 0.00 54.91 54.43 1nhn h ALA 36 Cb 0.25 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1nhn h ALA 36 CO 0.01 0.57 -0.43 0.87 0.00 0.00 0.00 179.25 180.26 1nhn h LYS 37 N 0.68 0.70 0.50 0.00 6.56 -0.85 0.29 116.57 124.45 1nhn h LYS 37 Ca 0.08 -0.38 -0.01 0.00 -1.06 0.00 0.00 60.65 59.27 1nhn h LYS 37 Cb 0.84 0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 32.51 1nhn h LYS 37 CO 0.07 1.00 -0.36 -0.22 -2.06 0.00 0.00 179.45 177.88 1nhn h LYS 38 N 0.57 -0.81 -0.25 3.15 3.64 -0.52 0.25 116.57 122.61 1nhn h LYS 38 Ca 0.04 0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1nhn h LYS 38 Cb 0.98 0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.97 1nhn h LYS 38 CO 0.09 -0.54 0.15 -0.07 -2.27 0.00 0.00 179.45 176.81 1nhn h LEU 39 N -0.84 0.24 -1.71 5.20 3.38 -1.19 0.35 115.31 120.74 1nhn h LEU 39 Ca -0.05 -0.00 0.52 0.00 0.09 0.00 0.00 57.88 58.44 1nhn h LEU 39 Cb 0.70 -0.05 -0.10 0.00 0.09 0.00 0.00 40.66 41.31 1nhn h LEU 39 CO 0.02 0.18 1.20 0.61 0.09 0.00 0.00 178.44 180.53 1nhn n GLY 40 N -1.16 -0.91 0.08 0.83 0.00 0.10 -1.30 105.19 102.83 1nhn n GLY 40 Ca -0.02 0.69 -0.08 0.00 0.00 0.00 0.00 46.02 46.61 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 -4.12 0.50 -0.32 1.61 -0.58 0.79 -4.52 120.64 113.99 1nhn n GLU 41 Ca 0.42 0.33 0.30 0.00 -0.42 0.00 0.00 57.16 57.79 1nhn n GLU 41 Cb 1.80 -1.53 0.55 0.00 -0.57 0.00 0.00 31.44 31.69 1nhn n GLU 41 CO 0.00 0.00 0.00 0.52 -0.48 0.00 0.00 177.13 177.17 1nhn h MET 42 N -1.00 0.05 -0.71 3.49 2.86 0.32 0.29 114.93 120.23 1nhn h MET 42 Ca -0.01 -0.00 0.15 0.00 -2.06 0.00 0.00 59.70 57.77 1nhn h MET 42 Cb 0.82 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.43 1nhn h MET 42 CO -0.01 0.03 0.48 2.35 1.06 0.00 0.00 176.91 180.83 1nhn h TRP 43 N 0.05 0.41 0.18 -0.22 2.91 -1.43 0.32 115.95 118.17 1nhn h TRP 43 Ca 0.82 0.01 -0.29 0.00 1.13 0.00 0.00 58.89 60.55 1nhn h TRP 43 Cb 2.10 -0.13 0.03 0.00 -0.51 0.00 0.00 29.16 30.65 1nhn h TRP 43 CO -0.04 0.16 -1.26 -0.91 -1.03 0.00 0.00 178.44 175.36 1nhn h ASN 44 N 0.35 0.80 -0.59 2.65 2.35 -1.18 -3.21 115.58 116.75 1nhn h ASN 44 Ca 0.35 -0.88 -0.37 0.00 -0.55 0.00 0.00 56.30 54.85 1nhn h ASN 44 Cb 0.85 -0.26 -0.17 0.00 0.05 0.00 0.00 38.32 38.79 1nhn h ASN 44 CO -0.10 1.61 0.48 0.59 -1.65 0.00 0.00 177.43 178.36 1nhn n ASN 45 N -3.83 5.70 -0.18 5.81 3.02 -0.06 -4.87 115.26 120.85 1nhn n ASN 45 Ca -0.15 -3.13 0.00 0.00 -0.03 0.00 0.00 54.58 51.27 1nhn n ASN 45 Cb 1.00 -0.93 0.00 0.00 -0.61 0.00 0.00 39.78 39.24 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 -0.10 0.00 -1.38 3.41 5.66 0.94 -4.88 114.28 117.93 1nhn n THR 46 Ca 0.36 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 61.37 1nhn n THR 46 Cb 0.78 0.00 0.20 0.00 -1.55 0.00 0.00 70.33 69.77 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 3.80 -0.72 1.79 0.00 -1.26 -4.96 120.51 116.15 1nhn n ALA 47 Ca 0.00 -3.01 0.00 0.00 0.00 0.00 0.00 53.44 50.43 1nhn n ALA 47 Cb 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 19.45 18.83 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 -1.07 -0.14 0.00 0.00 0.00 -1.26 -3.70 120.51 114.34 1nhn n ALA 48 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1nhn n ALA 48 Cb 0.91 -0.14 0.00 0.00 0.00 0.00 0.00 19.45 20.22 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 0.09 0.92 0.01 0.00 8.00 -1.26 -4.76 116.55 119.55 1nhn n ASP 49 Ca 0.00 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.63 1nhn n ASP 49 Cb 0.07 0.12 0.38 0.00 -0.02 0.00 0.00 41.12 41.67 1nhn n ASP 49 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1nhn n ASP 50 N -0.63 0.37 0.12 -2.24 9.92 -1.24 -3.68 116.55 119.16 1nhn n ASP 50 Ca 0.00 0.12 -0.24 0.00 -0.53 0.00 0.00 54.79 54.14 1nhn n ASP 50 Cb 0.07 -0.10 -0.16 0.00 -0.64 0.00 0.00 41.12 40.29 1nhn n ASP 50 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 1nhn h LYS 51 N 0.00 0.47 -0.67 -1.24 1.57 -1.89 -3.37 116.57 111.45 1nhn h LYS 51 Ca 0.00 -0.81 0.11 0.00 -1.87 0.00 0.00 60.65 58.08 1nhn h LYS 51 Cb 0.55 0.30 -0.11 0.00 0.08 0.00 0.00 32.23 33.05 1nhn h LYS 51 CO 0.00 1.39 -0.24 1.04 -0.57 0.00 0.00 179.45 181.06 1nhn n GLN 52 N -3.80 -0.14 0.35 3.15 3.00 -1.24 -0.08 117.38 118.62 1nhn n GLN 52 Ca -0.17 1.03 -0.16 0.00 -0.01 0.00 0.00 57.00 57.69 1nhn n GLN 52 Cb 1.04 -1.53 -0.08 0.00 0.00 0.00 0.00 30.24 29.67 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 -0.96 -0.81 -1.09 0.13 -1.79 -0.89 132.00 126.59 1nhn h PRO 53 Ca 0.25 0.07 0.19 0.00 -0.87 0.00 0.00 66.00 65.64 1nhn h PRO 53 Cb 0.41 0.22 -0.14 0.00 0.13 0.00 0.00 31.00 31.62 1nhn h PRO 53 CO -0.67 -0.64 0.05 1.88 -0.23 0.00 0.00 178.00 178.39 1nhn h TYR 54 N -0.99 0.03 0.40 1.56 0.05 -1.16 -1.04 116.97 115.82 1nhn h TYR 54 Ca -0.09 0.06 -0.02 0.00 0.05 0.00 0.00 58.73 58.73 1nhn h TYR 54 Cb 0.80 0.12 -0.00 0.00 1.01 0.00 0.00 36.73 38.66 1nhn h TYR 54 CO -0.08 -0.25 -0.26 0.93 -1.05 0.00 0.00 178.16 177.45 1nhn h GLU 55 N 0.12 -0.60 -1.61 4.88 4.39 -0.38 -0.67 114.58 120.70 1nhn h GLU 55 Ca 0.46 0.04 0.47 0.00 0.34 0.00 0.00 59.36 60.67 1nhn h GLU 55 Cb 0.85 0.14 -0.06 0.00 -0.10 0.00 0.00 28.75 29.57 1nhn h GLU 55 CO -0.69 -0.40 1.24 0.87 -1.16 0.00 0.00 179.01 178.87 1nhn h LYS 56 N -0.62 0.00 0.00 2.33 1.57 0.15 0.40 116.57 120.40 1nhn h LYS 56 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1nhn h LYS 56 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 1nhn h LYS 56 CO 0.05 0.00 -0.08 0.87 -0.57 0.00 0.00 179.45 179.72 1nhn h LYS 57 N 0.00 0.00 -0.67 3.15 6.56 -0.89 -2.78 116.57 121.94 1nhn h LYS 57 Ca 0.76 0.00 0.13 0.00 -1.06 0.00 0.00 60.65 60.49 1nhn h LYS 57 Cb 3.24 0.00 -0.10 0.00 -0.57 0.00 0.00 32.23 34.81 1nhn h LYS 57 CO -0.01 0.00 0.16 0.00 -2.06 0.00 0.00 179.45 177.54 1nhn h ALA 58 N -1.38 0.83 -0.12 3.86 0.00 -0.36 -1.08 119.26 121.01 1nhn h ALA 58 Ca 0.00 0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.10 1nhn h ALA 58 Cb 0.08 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 1nhn h ALA 58 CO 0.00 -0.31 -0.16 0.00 0.00 0.00 0.00 179.25 178.78 1nhn h ALA 59 N 1.54 -0.09 -0.16 0.00 0.00 -0.39 -0.22 119.26 119.94 1nhn h ALA 59 Ca 0.36 0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.37 1nhn h ALA 59 Cb 0.57 0.33 -0.07 0.00 0.00 0.00 0.00 17.79 18.62 1nhn h ALA 59 CO -0.45 -0.62 -0.34 -0.22 0.00 0.00 0.00 179.25 177.63 1nhn h LYS 60 N -0.21 -0.38 0.07 0.00 3.64 -0.92 0.61 116.57 119.38 1nhn h LYS 60 Ca 0.09 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.52 1nhn h LYS 60 Cb 0.34 0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 1nhn h LYS 60 CO -0.25 -0.25 -0.23 -0.07 -2.27 0.00 0.00 179.45 176.38 1nhn h LEU 61 N -0.40 -0.66 -1.58 5.20 3.38 -1.07 -1.99 115.31 118.19 1nhn h LEU 61 Ca 0.10 0.08 0.03 0.00 0.09 0.00 0.00 57.88 58.19 1nhn h LEU 61 Cb 0.56 0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 1nhn h LEU 61 CO -0.38 -0.31 0.32 0.11 0.09 0.00 0.00 178.44 178.27 1nhn h LYS 62 N -0.40 0.53 0.15 1.13 1.57 -0.53 -3.07 116.57 115.95 1nhn h LYS 62 Ca 0.04 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1nhn h LYS 62 Cb 0.45 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 1nhn h LYS 62 CO -0.16 0.35 -0.15 1.49 -0.57 0.00 0.00 179.45 180.41 1nhn h GLU 63 N 0.55 -0.29 -0.88 3.15 4.22 0.99 -0.02 114.58 122.30 1nhn h GLU 63 Ca 0.20 0.02 0.18 0.00 0.08 0.00 0.00 59.36 59.84 1nhn h GLU 63 Cb 0.11 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.36 1nhn h GLU 63 CO -0.05 -0.19 0.58 1.57 -2.18 0.00 0.00 179.01 178.73 1nhn h LYS 64 N -0.30 0.47 0.76 1.92 2.10 -1.49 -2.06 116.57 117.97 1nhn h LYS 64 Ca -0.02 -0.03 -0.04 0.00 -2.00 0.00 0.00 60.65 58.56 1nhn h LYS 64 Cb 0.26 -0.11 0.01 0.00 -0.90 0.00 0.00 32.23 31.49 1nhn h LYS 64 CO -0.01 0.31 -0.37 -0.92 -2.00 0.00 0.00 179.45 176.46 1nhn h TYR 65 N 0.49 -0.95 -1.59 0.07 3.20 -1.35 -2.49 116.97 114.34 1nhn h TYR 65 Ca 0.45 -0.02 0.49 0.00 3.14 0.00 0.00 58.73 62.79 1nhn h TYR 65 Cb 1.00 0.31 -0.10 0.00 1.54 0.00 0.00 36.73 39.49 1nhn h TYR 65 CO -0.00 -0.59 1.09 0.39 -1.64 0.00 0.00 178.16 177.41 1nhn n GLU 66 N -4.96 -0.02 0.17 1.82 1.02 -0.06 -0.15 120.64 118.47 1nhn n GLU 66 Ca -0.13 1.08 -0.11 0.00 -0.02 0.00 0.00 57.16 57.99 1nhn n GLU 66 Cb 0.40 -2.32 -0.06 0.00 -0.02 0.00 0.00 31.44 29.45 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 -0.47 -0.03 3.49 6.56 -1.30 0.14 116.57 124.96 1nhn h LYS 67 Ca 0.85 0.03 0.01 0.00 -1.06 0.00 0.00 60.65 60.48 1nhn h LYS 67 Cb 3.12 0.11 -0.00 0.00 -0.57 0.00 0.00 32.23 34.88 1nhn h LYS 67 CO -0.21 -0.18 0.03 0.22 -2.06 0.00 0.00 179.45 177.26 1nhn h ASP 68 N -1.01 0.00 -0.10 0.86 3.58 -0.23 0.13 116.42 119.66 1nhn h ASP 68 Ca -0.05 0.00 -0.20 0.00 0.42 0.00 0.00 57.03 57.20 1nhn h ASP 68 Cb 0.51 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.56 1nhn h ASP 68 CO 0.08 0.00 -0.70 0.40 -2.88 0.00 0.00 179.24 176.14 1nhn h ILE 69 N 0.00 1.30 -0.93 2.25 1.08 -0.58 -2.22 117.51 118.39 1nhn h ILE 69 Ca 0.01 -1.93 0.18 0.00 -0.39 0.00 0.00 64.86 62.74 1nhn h ILE 69 Cb 0.08 1.90 -0.08 0.00 -3.07 0.00 0.00 36.82 35.65 1nhn h ILE 69 CO -0.00 0.61 0.60 0.00 -0.69 0.00 0.00 178.15 178.67 1nhn h ALA 70 N 0.69 1.94 -0.59 1.87 0.00 0.21 0.39 119.26 123.77 1nhn h ALA 70 Ca -0.03 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1nhn h ALA 70 Cb 1.31 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 1nhn h ALA 70 CO 0.14 -0.24 0.17 0.00 0.00 0.00 0.00 179.25 179.32 1nhn h ALA 71 N 1.61 0.77 -0.99 0.00 0.00 -1.04 -1.28 119.26 118.34 1nhn h ALA 71 Ca 0.50 -0.21 0.19 0.00 0.00 0.00 0.00 54.91 55.39 1nhn h ALA 71 Cb 0.96 -0.23 -0.10 0.00 0.00 0.00 0.00 17.79 18.43 1nhn h ALA 71 CO -0.24 0.46 0.61 -0.92 0.00 0.00 0.00 179.25 179.16 1nhn h TYR 72 N 0.84 0.99 -0.19 0.00 3.20 -0.07 0.40 116.97 122.13 1nhn h TYR 72 Ca 0.19 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 62.01 1nhn h TYR 72 Cb 0.31 -0.30 -0.00 0.00 1.54 0.00 0.00 36.73 38.28 1nhn h TYR 72 CO 0.02 0.23 -0.19 0.00 -1.64 0.00 0.00 178.16 176.58 1nhn h ARG 73 N 0.72 0.47 -1.32 1.82 2.47 -0.96 -3.04 114.38 114.54 1nhn h ARG 73 Ca 0.56 -0.25 -0.00 0.00 -1.26 0.00 0.00 59.98 59.03 1nhn h ARG 73 Cb 0.93 0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 29.26 1nhn h ARG 73 CO -0.34 0.82 0.00 0.00 0.56 0.00 0.00 179.97 181.01 1nhn n ALA 74 N -2.44 3.00 -2.63 0.04 0.00 0.13 -4.81 120.51 113.79 1nhn n ALA 74 Ca -0.05 -0.02 -0.22 0.00 0.00 0.00 0.00 53.44 53.15 1nhn n ALA 74 Cb 0.40 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.79 1nhn n ALA 74 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1nhn s LYS 75 N -0.02 2.58 0.00 0.00 2.20 -0.47 -4.64 119.74 119.40 1nhn s LYS 75 Ca 0.00 -1.33 0.00 0.00 -0.36 0.00 0.00 55.97 54.29 1nhn s LYS 75 Cb 0.00 -2.34 0.00 0.00 -1.51 0.00 0.00 37.83 33.98 1nhn s LYS 75 CO 0.00 0.25 0.00 0.41 -0.36 0.00 0.00 175.35 175.65 1nhn n GLY 76 N -1.15 2.49 0.17 5.54 0.00 -1.26 -4.91 105.19 106.08 1nhn n GLY 76 Ca -0.05 -0.80 0.02 0.00 0.00 0.00 0.00 46.02 45.20 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 -0.06 0.19 1.61 4.76 -1.26 -0.40 118.16 123.01 1nhn n LYS 77 Ca 0.00 0.74 0.12 0.00 -2.87 0.00 0.00 58.31 56.31 1nhn n LYS 77 Cb 0.00 -1.11 0.68 0.00 -1.84 0.00 0.00 35.03 32.76 1nhn n LYS 77 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 1nhn h PRO 78 N 0.00 0.00 -4.29 1.97 0.11 -1.91 -3.47 132.00 124.42 1nhn h PRO 78 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 1nhn h PRO 78 Cb 0.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.45 1nhn h PRO 78 CO -0.49 0.00 -0.03 -3.47 -0.21 0.00 0.00 178.00 173.80 1nhn n ASP 79 N -4.41 -5.19 -4.01 -2.05 -0.08 0.47 -4.12 116.55 97.16 1nhn n ASP 79 Ca 0.01 0.00 -0.41 0.00 -1.51 0.00 0.00 54.79 52.88 1nhn n ASP 79 Cb 0.24 -3.37 0.01 0.00 2.34 0.00 0.00 41.12 40.34 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 -1.30 -2.68 -0.70 -1.67 0.00 -1.26 -5.15 120.51 107.76 1nhn n ALA 80 Ca 0.01 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.94 1nhn n ALA 80 Cb 0.47 -2.01 0.00 0.00 0.00 0.00 0.00 19.45 17.91 1nhn n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50