#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 0.00 -2.06 -2.53 0.00 -1.26 -5.13 120.51 109.53 1nhn n ALA 4 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 1nhn n ALA 4 Cb 0.00 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.58 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 0.00 -0.51 -3.66 0.00 -0.04 -1.26 -5.09 135.00 124.44 1nhn n PRO 5 Ca 0.00 -1.77 -0.29 0.00 -0.04 0.00 0.00 63.50 61.40 1nhn n PRO 5 Cb 0.00 -0.79 -0.15 0.00 -0.04 0.00 0.00 33.50 32.52 1nhn n PRO 5 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1nhn s LYS 6 N -4.84 0.51 -0.01 0.54 -2.85 -1.26 -5.08 119.74 106.75 1nhn s LYS 6 Ca 0.53 -0.83 -0.00 0.00 -1.00 0.00 0.00 55.97 54.67 1nhn s LYS 6 Cb -0.02 -1.69 -0.00 0.00 -2.06 0.00 0.00 37.83 34.06 1nhn s LYS 6 CO 0.37 -0.98 0.02 0.54 0.10 0.00 0.00 175.35 175.40 1nhn n ARG 7 N 5.01 0.00 -0.52 1.78 1.74 -1.26 -4.88 116.66 118.53 1nhn n ARG 7 Ca -0.04 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.74 1nhn n ARG 7 Cb 0.42 -0.01 0.28 0.00 -1.02 0.00 0.00 32.46 32.13 1nhn n ARG 7 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1nhn s PRO 8 N 0.07 -2.48 0.81 5.56 0.04 -1.26 -5.02 135.00 132.72 1nhn s PRO 8 Ca 0.01 0.15 -0.11 0.00 0.04 0.00 0.00 61.00 61.10 1nhn s PRO 8 Cb -0.01 -1.43 0.03 0.00 0.04 0.00 0.00 34.50 33.13 1nhn s PRO 8 CO 0.00 -4.58 -0.17 -0.35 0.04 0.00 0.00 177.00 171.94 1nhn n PRO 9 N -5.42 -0.91 -0.48 0.56 -0.04 -1.26 -4.99 135.00 122.45 1nhn n PRO 9 Ca 0.12 -0.27 0.06 0.00 -0.04 0.00 0.00 63.50 63.37 1nhn n PRO 9 Cb 0.59 -1.21 0.13 0.00 -0.04 0.00 0.00 33.50 32.97 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 1.29 1.63 0.00 3.54 7.64 -1.26 -4.90 113.62 121.56 1nhn n SER 10 Ca 0.02 -3.08 0.00 0.00 1.01 0.00 0.00 58.87 56.82 1nhn n SER 10 Cb 0.30 -0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 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 -0.89 0.00 0.25 -0.43 0.00 -1.26 -4.52 120.51 113.66 1nhn n ALA 11 Ca 0.13 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.70 1nhn n ALA 11 Cb 0.73 0.00 0.61 0.00 0.00 0.00 0.00 19.45 20.79 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 -0.21 0.00 3.57 -1.93 -2.86 116.94 115.51 1nhn h PHE 12 Ca 0.00 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.38 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 0.15 -0.34 0.35 -2.23 0.00 0.00 178.31 176.24 1nhn h PHE 13 N 0.00 0.74 0.10 0.41 3.04 -1.94 -1.09 116.94 118.21 1nhn h PHE 13 Ca -0.00 -0.26 0.02 0.00 3.98 0.00 0.00 57.97 61.71 1nhn h PHE 13 Cb 0.54 -0.14 -0.03 0.00 2.56 0.00 0.00 35.95 38.88 1nhn h PHE 13 CO 0.00 1.00 -0.20 -0.07 -2.02 0.00 0.00 178.31 177.01 1nhn h LEU 14 N 0.28 -0.57 -0.78 0.59 -0.00 -1.88 -1.30 115.31 111.65 1nhn h LEU 14 Ca 0.02 0.07 0.18 0.00 -0.00 0.00 0.00 57.88 58.14 1nhn h LEU 14 Cb 0.93 0.22 -0.12 0.00 -0.00 0.00 0.00 40.66 41.69 1nhn h LEU 14 CO 0.08 -0.28 0.17 0.15 -0.00 0.00 0.00 178.44 178.55 1nhn h PHE 15 N -0.38 0.25 0.00 1.13 3.57 -1.50 0.12 116.94 120.12 1nhn h PHE 15 Ca 0.03 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.58 1nhn h PHE 15 Cb 0.40 0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.15 1nhn h PHE 15 CO -0.20 -0.14 0.00 0.00 -2.23 0.00 0.00 178.31 175.74 1nhn n SER 17 N -2.93 1.44 0.14 0.00 3.41 0.33 -1.67 113.62 114.35 1nhn n SER 17 Ca -0.01 0.08 0.13 0.00 -0.26 0.00 0.00 58.87 58.81 1nhn n SER 17 Cb 0.16 -0.20 0.42 0.00 -0.26 0.00 0.00 64.21 64.33 1nhn n SER 17 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1nhn h GLU 18 N 0.02 0.00 0.00 4.33 5.08 -1.18 -3.37 114.58 119.47 1nhn h GLU 18 Ca -0.48 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 57.72 1nhn h GLU 18 Cb 2.03 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 31.25 1nhn h GLU 18 CO 0.01 0.00 -1.56 0.66 -1.00 0.00 0.00 179.01 177.12 1nhn n TYR 19 N -2.45 0.00 -0.37 4.33 4.02 -0.55 -4.64 117.16 117.50 1nhn n TYR 19 Ca 0.04 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.88 1nhn n TYR 19 Cb 0.37 -0.37 -0.01 0.00 -0.02 0.00 0.00 39.34 39.32 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 -3.15 -0.29 0.16 -0.72 0.63 -0.67 0.01 116.66 112.62 1nhn n ARG 20 Ca -0.19 1.44 0.12 0.00 -0.92 0.00 0.00 57.85 58.30 1nhn n ARG 20 Cb 0.66 -2.13 0.57 0.00 0.45 0.00 0.00 32.46 32.01 1nhn n ARG 20 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1nhn n PRO 21 N -5.31 0.17 -0.07 -0.14 -0.04 -1.26 -0.58 135.00 127.77 1nhn n PRO 21 Ca 0.07 0.56 -0.09 0.00 -0.04 0.00 0.00 63.50 64.00 1nhn n PRO 21 Cb 0.33 -1.95 -0.06 0.00 -0.04 0.00 0.00 33.50 31.79 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 -0.50 0.54 3.64 -0.68 -2.60 116.57 116.97 1nhn h LYS 22 Ca 0.00 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1nhn h LYS 22 Cb 0.14 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.94 1nhn h LYS 22 CO 0.00 0.43 0.33 -0.84 -2.27 0.00 0.00 179.45 177.10 1nhn h ILE 23 N -1.00 1.12 -0.94 2.00 3.07 -1.36 0.18 117.51 120.57 1nhn h ILE 23 Ca -0.08 -0.23 0.17 0.00 1.55 0.00 0.00 64.86 66.27 1nhn h ILE 23 Cb 0.66 0.39 -0.08 0.00 -0.27 0.00 0.00 36.82 37.52 1nhn h ILE 23 CO -0.05 0.12 0.60 0.50 -1.05 0.00 0.00 178.15 178.27 1nhn h LYS 24 N 0.67 0.64 -0.98 0.16 3.64 -0.97 0.63 116.57 120.37 1nhn h LYS 24 Ca 0.19 -0.04 0.27 0.00 -1.27 0.00 0.00 60.65 59.80 1nhn h LYS 24 Cb -0.07 -0.15 -0.14 0.00 -0.41 0.00 0.00 32.23 31.47 1nhn h LYS 24 CO -0.05 0.43 0.53 0.78 -2.27 0.00 0.00 179.45 178.87 1nhn h GLY 25 N 0.66 1.88 0.91 5.01 0.00 -0.22 0.13 103.07 111.45 1nhn h GLY 25 Ca 0.50 -0.24 -0.31 0.00 0.00 0.00 0.00 47.33 47.28 1nhn h GLY 25 CO -0.26 -0.36 -1.76 0.83 0.00 0.00 0.00 176.54 174.99 1nhn h GLU 26 N 0.42 0.07 -2.31 4.80 4.39 -0.07 -3.41 114.58 118.47 1nhn h GLU 26 Ca 0.66 -0.13 -0.64 0.00 0.34 0.00 0.00 59.36 59.60 1nhn h GLU 26 Cb 1.37 0.05 -0.39 0.00 -0.10 0.00 0.00 28.75 29.68 1nhn h GLU 26 CO -0.55 0.70 -0.33 -2.39 -1.16 0.00 0.00 179.01 175.27 1nhn n HIS 27 N -3.17 3.55 0.16 4.33 1.44 0.17 -4.88 115.22 116.82 1nhn n HIS 27 Ca -0.20 -3.82 0.00 0.00 -2.01 0.00 0.00 57.72 51.69 1nhn n HIS 27 Cb 1.05 -0.67 0.00 0.00 0.12 0.00 0.00 29.99 30.49 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 0.52 0.76 0.00 -1.40 -0.04 -0.31 -2.50 135.00 132.03 1nhn n PRO 28 Ca 0.31 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.77 1nhn n PRO 28 Cb 0.38 -1.12 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 1.15 0.89 3.37 0.55 0.00 -1.26 -5.11 105.19 104.77 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 1.04 0.00 0.00 0.00 173.32 174.36 1nhn n LEU 30 N -0.11 0.00 0.00 0.99 4.77 -1.04 -5.11 117.00 116.49 1nhn n LEU 30 Ca 0.00 -1.50 0.00 0.00 -0.03 0.00 0.00 56.01 54.48 1nhn n LEU 30 Cb 0.06 -0.76 0.00 0.00 -2.33 0.00 0.00 43.42 40.39 1nhn n LEU 30 CO 0.00 -1.17 0.00 -1.20 -1.33 0.00 0.00 177.39 173.69 1nhn n SER 31 N -3.42 0.20 -0.02 -1.43 7.64 -1.26 -5.01 113.62 110.33 1nhn n SER 31 Ca 0.14 0.00 0.02 0.00 1.01 0.00 0.00 58.87 60.05 1nhn n SER 31 Cb 0.51 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.74 1nhn n SER 31 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nhn n ILE 32 N 0.00 1.20 0.00 0.44 3.06 -1.26 -4.12 119.36 118.68 1nhn n ILE 32 Ca 0.00 -1.28 0.00 0.00 -2.50 0.00 0.00 62.75 58.97 1nhn n ILE 32 Cb 0.00 0.33 0.00 0.00 0.54 0.00 0.00 39.64 40.51 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 -0.71 0.55 0.12 4.50 0.00 -1.26 -4.21 105.19 104.18 1nhn n GLY 33 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.08 1.94 -0.07 1.61 -0.08 -1.26 -2.73 116.55 114.88 1nhn n ASP 34 Ca 0.00 0.36 0.13 0.00 -1.51 0.00 0.00 54.79 53.77 1nhn n ASP 34 Cb 0.00 -0.83 0.52 0.00 2.34 0.00 0.00 41.12 43.15 1nhn n ASP 34 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1nhn h VAL 35 N -1.00 0.88 -0.30 5.18 2.07 -1.85 0.34 116.25 121.56 1nhn h VAL 35 Ca -0.52 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 66.84 1nhn h VAL 35 Cb 1.44 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 1nhn h VAL 35 CO -0.31 0.07 0.05 0.00 0.02 0.00 0.00 177.57 177.39 1nhn h ALA 36 N 1.70 0.40 -0.90 1.67 0.00 -1.73 0.66 119.26 121.07 1nhn h ALA 36 Ca 0.28 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 55.11 1nhn h ALA 36 Cb 0.59 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.18 1nhn h ALA 36 CO -0.07 0.09 0.53 0.87 0.00 0.00 0.00 179.25 180.67 1nhn h LYS 37 N 0.32 0.81 0.08 0.00 1.57 -0.13 0.42 116.57 119.64 1nhn h LYS 37 Ca 0.09 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1nhn h LYS 37 Cb 0.34 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1nhn h LYS 37 CO 0.01 0.54 -0.04 0.87 -0.57 0.00 0.00 179.45 180.26 1nhn h LYS 38 N 0.84 -0.10 -1.01 3.15 6.56 -1.08 0.67 116.57 125.60 1nhn h LYS 38 Ca 0.45 0.01 0.14 0.00 -1.06 0.00 0.00 60.65 60.18 1nhn h LYS 38 Cb 0.47 0.02 -0.09 0.00 -0.57 0.00 0.00 32.23 32.06 1nhn h LYS 38 CO -0.28 0.46 0.63 -0.07 -2.06 0.00 0.00 179.45 178.14 1nhn h LEU 39 N -0.83 0.90 -1.54 2.94 3.38 -0.69 0.87 115.31 120.34 1nhn h LEU 39 Ca -0.01 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1nhn h LEU 39 Cb 0.61 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1nhn h LEU 39 CO 0.02 0.45 0.27 1.23 0.09 0.00 0.00 178.44 180.49 1nhn h GLY 40 N 0.95 0.61 -2.12 0.83 0.00 -0.10 0.29 103.07 103.53 1nhn h GLY 40 Ca 0.52 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.61 1nhn h GLY 40 CO -0.29 0.23 0.00 1.18 0.00 0.00 0.00 176.54 177.66 1nhn n GLU 41 N -4.45 2.41 0.00 4.80 1.02 0.17 -4.12 120.64 120.47 1nhn n GLU 41 Ca 0.03 -2.13 0.00 0.00 -0.02 0.00 0.00 57.16 55.04 1nhn n GLU 41 Cb 0.07 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.99 1nhn n GLU 41 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1nhn n MET 42 N 1.34 1.83 -0.09 3.49 2.81 0.25 -4.72 117.12 122.04 1nhn n MET 42 Ca 0.19 -1.14 -0.11 0.00 -1.81 0.00 0.00 57.70 54.83 1nhn n MET 42 Cb 0.57 -0.89 -0.04 0.00 -0.71 0.00 0.00 33.22 32.15 1nhn n MET 42 CO 0.00 0.00 0.00 1.87 1.51 0.00 0.00 175.97 179.35 1nhn n TRP 43 N -0.33 0.00 0.24 2.03 -0.00 -0.04 -3.51 117.44 115.84 1nhn n TRP 43 Ca 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 57.50 57.65 1nhn n TRP 43 Cb 0.26 -0.53 0.82 0.00 -0.00 0.00 0.00 31.31 31.86 1nhn n TRP 43 CO 0.00 0.00 0.00 -2.95 -0.00 0.00 0.00 177.69 174.74 1nhn h ASN 44 N -0.91 0.00 -1.30 5.87 7.08 -1.83 0.34 115.58 124.83 1nhn h ASN 44 Ca -0.10 0.00 -0.66 0.00 -3.08 0.00 0.00 56.30 52.46 1nhn h ASN 44 Cb 1.02 0.00 -0.34 0.00 -2.08 0.00 0.00 38.32 36.91 1nhn h ASN 44 CO -0.06 0.00 0.24 -0.46 -2.08 0.00 0.00 177.43 175.06 1nhn n ASN 45 N -4.02 6.46 0.00 6.14 0.23 -1.26 -4.98 115.26 117.84 1nhn n ASN 45 Ca -0.01 -3.78 0.00 0.00 -0.53 0.00 0.00 54.58 50.26 1nhn n ASN 45 Cb 0.19 -0.76 0.00 0.00 -2.08 0.00 0.00 39.78 37.13 1nhn n ASN 45 CO 0.00 0.00 0.00 1.07 -0.93 0.00 0.00 177.26 177.40 1nhn n THR 46 N -0.69 0.00 -3.43 5.53 5.66 0.11 -4.75 114.28 116.72 1nhn n THR 46 Ca 0.52 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 61.08 1nhn n THR 46 Cb 0.62 -0.43 -0.09 0.00 -1.55 0.00 0.00 70.33 68.88 1nhn n THR 46 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nhn s ALA 47 N -2.05 3.50 0.44 1.79 0.00 -1.26 -4.93 121.76 119.25 1nhn s ALA 47 Ca 0.00 -1.83 0.28 0.00 0.00 0.00 0.00 51.96 50.41 1nhn s ALA 47 Cb 0.00 -2.96 1.34 0.00 0.00 0.00 0.00 23.12 21.50 1nhn s ALA 47 CO 0.00 -1.56 1.70 0.00 0.00 0.00 0.00 175.76 175.90 1nhn h ALA 48 N 8.68 2.66 0.00 0.00 0.00 -1.94 0.44 119.26 129.10 1nhn h ALA 48 Ca -0.27 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1nhn h ALA 48 Cb 1.12 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 1nhn h ALA 48 CO 0.78 -1.17 -0.03 -0.44 0.00 0.00 0.00 179.25 178.39 1nhn h ASP 49 N 0.18 0.00 0.85 0.00 3.32 -2.01 0.43 116.42 119.19 1nhn h ASP 49 Ca 0.71 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.76 1nhn h ASP 49 Cb 2.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.76 1nhn h ASP 49 CO -0.30 0.03 -0.74 -0.78 -1.72 0.00 0.00 179.24 175.73 1nhn h ASP 50 N 0.00 0.00 0.12 6.45 1.82 -0.53 -3.30 116.42 120.97 1nhn h ASP 50 Ca -0.00 -0.19 -0.23 0.00 -0.39 0.00 0.00 57.03 56.22 1nhn h ASP 50 Cb 0.22 0.00 0.01 0.00 0.68 0.00 0.00 39.33 40.24 1nhn h ASP 50 CO 0.00 0.10 -1.12 0.11 -1.61 0.00 0.00 179.24 176.72 1nhn h LYS 51 N 0.00 0.25 -0.68 0.28 1.57 -0.77 -3.35 116.57 113.87 1nhn h LYS 51 Ca 0.00 -0.42 0.11 0.00 -1.87 0.00 0.00 60.65 58.47 1nhn h LYS 51 Cb 0.79 0.16 -0.11 0.00 0.08 0.00 0.00 32.23 33.15 1nhn h LYS 51 CO 0.00 1.20 -0.25 1.04 -0.57 0.00 0.00 179.45 180.87 1nhn n GLN 52 N -4.05 -0.15 0.42 3.15 1.13 -0.77 -0.26 117.38 116.87 1nhn n GLN 52 Ca -0.20 1.04 -0.18 0.00 -1.94 0.00 0.00 57.00 55.72 1nhn n GLN 52 Cb 0.85 -1.55 -0.09 0.00 0.11 0.00 0.00 30.24 29.56 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 -1.08 -0.88 -1.09 0.13 -1.75 -1.31 132.00 126.03 1nhn h PRO 53 Ca 0.24 0.07 0.23 0.00 -0.87 0.00 0.00 66.00 65.68 1nhn h PRO 53 Cb 0.41 0.24 -0.15 0.00 0.13 0.00 0.00 31.00 31.64 1nhn h PRO 53 CO -0.68 -0.72 0.09 1.88 -0.23 0.00 0.00 178.00 178.35 1nhn h TYR 54 N -1.12 0.08 0.36 1.56 0.05 -1.12 -0.41 116.97 116.38 1nhn h TYR 54 Ca -0.11 0.06 -0.02 0.00 0.05 0.00 0.00 58.73 58.71 1nhn h TYR 54 Cb 0.87 0.11 0.00 0.00 1.01 0.00 0.00 36.73 38.72 1nhn h TYR 54 CO -0.01 -0.30 -0.21 0.93 -1.05 0.00 0.00 178.16 177.52 1nhn h GLU 55 N 0.10 -0.51 -1.66 4.88 4.39 -0.57 0.51 114.58 121.73 1nhn h GLU 55 Ca 0.52 0.03 0.49 0.00 0.34 0.00 0.00 59.36 60.75 1nhn h GLU 55 Cb 1.03 0.12 -0.08 0.00 -0.10 0.00 0.00 28.75 29.71 1nhn h GLU 55 CO -0.75 -0.34 1.18 0.87 -1.16 0.00 0.00 179.01 178.81 1nhn h LYS 56 N -0.53 0.02 0.00 2.33 1.79 0.09 0.18 116.57 120.45 1nhn h LYS 56 Ca -0.05 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 1nhn h LYS 56 Cb 0.42 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.06 1nhn h LYS 56 CO 0.06 0.01 -0.04 0.87 -1.08 0.00 0.00 179.45 179.27 1nhn h LYS 57 N 0.02 0.00 -0.87 3.15 1.57 -0.72 -2.00 116.57 117.72 1nhn h LYS 57 Ca 0.83 0.00 0.21 0.00 -1.87 0.00 0.00 60.65 59.81 1nhn h LYS 57 Cb 3.18 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 35.37 1nhn h LYS 57 CO -0.09 0.00 0.35 0.00 -0.57 0.00 0.00 179.45 179.14 1nhn h ALA 58 N -1.18 1.34 -0.08 3.86 0.00 0.05 0.16 119.26 123.41 1nhn h ALA 58 Ca 0.00 0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1nhn h ALA 58 Cb 0.04 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1nhn h ALA 58 CO 0.00 -0.33 0.05 0.00 0.00 0.00 0.00 179.25 178.97 1nhn h ALA 59 N 1.69 0.10 -0.04 0.00 0.00 -0.82 -1.10 119.26 119.08 1nhn h ALA 59 Ca 0.53 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.44 1nhn h ALA 59 Cb 0.98 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1nhn h ALA 59 CO -0.52 -0.39 -0.12 -0.22 0.00 0.00 0.00 179.25 178.00 1nhn h LYS 60 N 0.07 -0.18 -0.33 0.00 3.64 0.04 0.16 116.57 119.96 1nhn h LYS 60 Ca 0.03 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.45 1nhn h LYS 60 Cb 0.03 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 1nhn h LYS 60 CO -0.01 -0.12 0.16 -0.07 -2.27 0.00 0.00 179.45 177.14 1nhn h LEU 61 N -0.19 0.23 -0.80 5.20 3.38 -0.95 -1.76 115.31 120.42 1nhn h LEU 61 Ca 0.06 0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.92 1nhn h LEU 61 Cb 0.27 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1nhn h LEU 61 CO -0.15 0.17 -0.55 0.07 0.09 0.00 0.00 178.44 178.07 1nhn h LYS 62 N 0.33 0.13 0.62 1.13 2.10 -1.04 -2.46 116.57 117.38 1nhn h LYS 62 Ca 0.14 -0.08 -0.03 0.00 -2.00 0.00 0.00 60.65 58.68 1nhn h LYS 62 Cb 0.06 0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 31.40 1nhn h LYS 62 CO -0.11 0.65 -0.37 1.49 -2.00 0.00 0.00 179.45 179.11 1nhn h GLU 63 N 0.10 -0.89 -0.76 0.07 4.81 -0.22 0.26 114.58 117.94 1nhn h GLU 63 Ca -0.00 0.06 0.11 0.00 -0.13 0.00 0.00 59.36 59.40 1nhn h GLU 63 Cb 1.01 0.20 -0.13 0.00 0.63 0.00 0.00 28.75 30.46 1nhn h GLU 63 CO 0.08 -0.59 -0.42 0.87 -0.73 0.00 0.00 179.01 178.22 1nhn h LYS 64 N -0.92 -0.11 -0.21 1.92 1.57 -1.29 -0.82 116.57 116.71 1nhn h LYS 64 Ca -0.08 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1nhn h LYS 64 Cb 0.74 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 33.03 1nhn h LYS 64 CO 0.09 -0.07 -0.24 -0.92 -0.57 0.00 0.00 179.45 177.73 1nhn h TYR 65 N -0.12 -0.75 -0.83 -1.35 5.03 -1.12 0.81 116.97 118.64 1nhn h TYR 65 Ca 0.24 0.04 0.24 0.00 2.58 0.00 0.00 58.73 61.83 1nhn h TYR 65 Cb 0.56 0.35 -0.03 0.00 1.55 0.00 0.00 36.73 39.16 1nhn h TYR 65 CO -0.78 -0.21 1.04 0.93 -1.32 0.00 0.00 178.16 177.82 1nhn h GLU 66 N -0.15 0.00 0.01 1.82 5.08 0.54 0.56 114.58 122.44 1nhn h GLU 66 Ca 0.04 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.27 1nhn h GLU 66 Cb 0.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1nhn h GLU 66 CO -0.28 0.00 -0.68 0.87 -1.00 0.00 0.00 179.01 177.92 1nhn h LYS 67 N 0.00 0.03 -0.01 2.33 6.56 -0.64 -1.12 116.57 123.72 1nhn h LYS 67 Ca 0.40 -0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.94 1nhn h LYS 67 Cb 2.47 0.02 -0.00 0.00 -0.57 0.00 0.00 32.23 34.14 1nhn h LYS 67 CO -0.00 1.02 0.01 -0.44 -2.06 0.00 0.00 179.45 177.98 1nhn h ASP 68 N -0.93 0.00 0.01 0.86 3.32 0.69 0.95 116.42 121.32 1nhn h ASP 68 Ca -0.18 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.81 1nhn h ASP 68 Cb 1.21 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 1nhn h ASP 68 CO -0.08 0.00 -0.30 -0.29 -1.72 0.00 0.00 179.24 176.84 1nhn h ILE 69 N 0.00 1.60 -0.88 0.35 -0.00 -0.17 -2.67 117.51 115.74 1nhn h ILE 69 Ca 0.01 -2.32 0.24 0.00 -0.00 0.00 0.00 64.86 62.78 1nhn h ILE 69 Cb 0.02 3.15 -0.04 0.00 -0.00 0.00 0.00 36.82 39.95 1nhn h ILE 69 CO -0.00 0.56 0.62 0.00 -0.00 0.00 0.00 178.15 179.33 1nhn h ALA 70 N -0.09 2.66 -0.05 0.18 0.00 -0.48 0.91 119.26 122.38 1nhn h ALA 70 Ca -0.08 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1nhn h ALA 70 Cb 1.10 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1nhn h ALA 70 CO -0.03 -0.92 -0.29 0.00 0.00 0.00 0.00 179.25 178.00 1nhn h ALA 71 N 1.58 0.11 -0.47 0.00 0.00 -0.84 -2.61 119.26 117.03 1nhn h ALA 71 Ca 0.43 -0.44 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1nhn h ALA 71 Cb 1.54 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.31 1nhn h ALA 71 CO -0.06 0.15 -0.08 1.88 0.00 0.00 0.00 179.25 181.14 1nhn h TYR 72 N -0.23 0.98 0.00 0.00 -1.99 -0.63 -2.89 116.97 112.21 1nhn h TYR 72 Ca -0.02 -0.20 -0.09 0.00 2.00 0.00 0.00 58.73 60.42 1nhn h TYR 72 Cb 0.95 -0.24 -0.01 0.00 2.00 0.00 0.00 36.73 39.42 1nhn h TYR 72 CO 0.14 0.96 -0.42 0.00 -0.00 0.00 0.00 178.16 178.83 1nhn h ARG 73 N 0.73 0.00 -1.96 4.88 3.08 -1.04 -3.09 114.38 116.99 1nhn h ARG 73 Ca 0.12 0.00 -0.44 0.00 0.07 0.00 0.00 59.98 59.73 1nhn h ARG 73 Cb 0.62 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 30.51 1nhn h ARG 73 CO 0.04 0.42 0.30 0.00 -1.07 0.00 0.00 179.97 179.66 1nhn n ALA 74 N -2.32 6.32 -2.04 0.04 0.00 -0.98 -4.64 120.51 116.88 1nhn n ALA 74 Ca -0.00 -2.77 0.00 0.00 0.00 0.00 0.00 53.44 50.67 1nhn n ALA 74 Cb 0.53 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.88 1nhn n ALA 74 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1nhn n LYS 75 N 1.02 0.00 0.00 0.00 4.81 -1.17 -4.92 118.16 117.90 1nhn n LYS 75 Ca 0.46 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.90 1nhn n LYS 75 Cb 0.60 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.65 1nhn n LYS 75 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1nhn n GLY 76 N 5.00 2.16 3.30 3.14 0.00 -1.26 -4.98 105.19 112.56 1nhn n GLY 76 Ca 0.00 -0.37 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 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 -1.56 -0.13 1.61 5.02 -1.26 -4.92 118.16 116.93 1nhn n LYS 77 Ca 0.00 -0.43 -0.05 0.00 -2.02 0.00 0.00 58.31 55.80 1nhn n LYS 77 Cb 0.00 -1.75 0.03 0.00 -0.02 0.00 0.00 35.03 33.29 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 -2.08 0.33 0.00 1.97 0.11 -1.94 -3.47 132.00 126.93 1nhn h PRO 78 Ca -0.53 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1nhn h PRO 78 Cb 1.35 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1nhn h PRO 78 CO 0.39 0.22 0.00 -3.47 -0.21 0.00 0.00 178.00 174.92 1nhn n ASP 79 N -4.99 0.00 -2.79 -2.05 2.03 -1.26 -5.04 116.55 102.45 1nhn n ASP 79 Ca 0.03 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.24 1nhn n ASP 79 Cb 0.14 0.00 0.06 0.00 -0.72 0.00 0.00 41.12 40.60 1nhn n ASP 79 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1nhn n ALA 80 N -0.42 -0.76 -0.82 -1.67 0.00 -1.26 -5.26 120.51 110.32 1nhn n ALA 80 Ca 0.00 -1.64 0.00 0.00 0.00 0.00 0.00 53.44 51.80 1nhn n ALA 80 Cb 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1nhn n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50