#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 -0.58 -1.19 5.41 0.00 -1.26 -4.71 120.51 118.17 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 0.06 0.00 0.00 0.00 0.00 19.45 19.51 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 -0.36 0.17 -3.74 0.00 -0.02 -1.26 -4.99 135.00 124.80 1nhn n PRO 5 Ca 0.00 0.08 -0.30 0.00 -2.02 0.00 0.00 63.50 61.27 1nhn n PRO 5 Cb 0.00 -1.57 -0.14 0.00 -0.02 0.00 0.00 33.50 31.77 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 -2.39 1.04 -0.40 -0.52 -2.85 -1.26 -5.00 119.74 108.35 1nhn s LYS 6 Ca 0.60 -1.57 -0.18 0.00 -1.00 0.00 0.00 55.97 53.82 1nhn s LYS 6 Cb -0.34 -2.24 0.03 0.00 -2.06 0.00 0.00 37.83 33.21 1nhn s LYS 6 CO 0.64 -1.07 0.44 0.54 0.10 0.00 0.00 175.35 176.00 1nhn n ARG 7 N 4.19 -1.23 -0.39 1.78 1.74 -1.26 -4.97 116.66 116.53 1nhn n ARG 7 Ca 0.04 0.81 -0.18 0.00 -0.77 0.00 0.00 57.85 57.74 1nhn n ARG 7 Cb 0.38 -1.42 0.16 0.00 -1.02 0.00 0.00 32.46 30.57 1nhn n ARG 7 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1nhn n PRO 8 N -0.78 -2.96 -0.96 5.56 -0.02 -1.26 -4.97 135.00 129.61 1nhn n PRO 8 Ca -0.12 -0.95 -0.33 0.00 -2.02 0.00 0.00 63.50 60.08 1nhn n PRO 8 Cb 0.47 -1.04 0.03 0.00 -0.02 0.00 0.00 33.50 32.95 1nhn n PRO 8 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1nhn n PRO 9 N -3.85 0.00 -0.66 0.52 -0.02 -1.26 -4.87 135.00 124.87 1nhn n PRO 9 Ca 0.09 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.60 1nhn n PRO 9 Cb 0.35 -0.90 0.06 0.00 -0.02 0.00 0.00 33.50 32.99 1nhn n PRO 9 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1nhn n SER 10 N 2.95 0.96 0.00 2.55 7.64 -1.26 -4.64 113.62 121.82 1nhn n SER 10 Ca 0.00 -2.47 0.00 0.00 1.01 0.00 0.00 58.87 57.41 1nhn n SER 10 Cb 0.49 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 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 -0.33 0.00 0.08 -0.43 0.00 -1.26 -4.48 120.51 114.09 1nhn n ALA 11 Ca 0.07 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.43 1nhn n ALA 11 Cb 0.79 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.28 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 0.37 -0.77 0.00 3.57 -1.94 -3.13 116.94 115.05 1nhn h PHE 12 Ca 0.00 -0.18 0.01 0.00 3.53 0.00 0.00 57.97 61.34 1nhn h PHE 12 Cb 0.00 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.65 1nhn h PHE 12 CO 0.00 0.93 0.51 0.35 -2.23 0.00 0.00 178.31 177.87 1nhn h PHE 13 N 0.18 0.96 0.88 0.41 3.04 -1.92 0.14 116.94 120.62 1nhn h PHE 13 Ca -0.03 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 61.90 1nhn h PHE 13 Cb 1.34 -0.32 0.01 0.00 2.56 0.00 0.00 35.95 39.53 1nhn h PHE 13 CO 0.03 0.60 -0.42 -0.07 -2.02 0.00 0.00 178.31 176.42 1nhn h LEU 14 N 1.03 -1.00 -0.81 0.59 -0.00 -1.91 -2.77 115.31 110.43 1nhn h LEU 14 Ca 0.29 0.03 0.19 0.00 -0.00 0.00 0.00 57.88 58.39 1nhn h LEU 14 Cb -0.09 0.26 -0.12 0.00 -0.00 0.00 0.00 40.66 40.71 1nhn h LEU 14 CO -0.07 -0.69 0.23 0.15 -0.00 0.00 0.00 178.44 178.07 1nhn h PHE 15 N -1.24 0.37 -0.79 1.13 3.57 -1.48 -0.33 116.94 118.17 1nhn h PHE 15 Ca -0.12 0.05 0.14 0.00 3.53 0.00 0.00 57.97 61.57 1nhn h PHE 15 Cb 0.91 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.56 1nhn h PHE 15 CO -0.01 -0.12 0.52 0.00 -2.23 0.00 0.00 178.31 176.48 1nhn h SER 17 N 0.50 0.08 -0.60 0.00 4.64 -0.83 0.10 113.55 117.45 1nhn h SER 17 Ca 0.39 -0.78 0.17 0.00 -0.47 0.00 0.00 61.79 61.10 1nhn h SER 17 Cb 0.78 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.82 1nhn h SER 17 CO -0.14 1.31 0.50 -0.33 -0.87 0.00 0.00 176.83 177.30 1nhn h GLU 18 N -0.86 0.00 0.00 4.77 4.39 -1.07 -2.92 114.58 118.89 1nhn h GLU 18 Ca -0.19 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.30 1nhn h GLU 18 Cb 1.27 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.88 1nhn h GLU 18 CO -0.07 0.00 -1.78 0.66 -1.16 0.00 0.00 179.01 176.66 1nhn n TYR 19 N -4.05 0.00 -0.19 4.33 4.02 -0.26 -4.70 117.16 116.31 1nhn n TYR 19 Ca 0.12 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.96 1nhn n TYR 19 Cb 0.73 -0.55 -0.05 0.00 -0.02 0.00 0.00 39.34 39.46 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 -2.58 -0.20 0.00 -0.72 1.74 0.02 -0.14 116.66 114.77 1nhn n ARG 20 Ca -0.21 0.71 0.15 0.00 -0.77 0.00 0.00 57.85 57.74 1nhn n ARG 20 Cb 0.83 -1.05 0.75 0.00 -1.02 0.00 0.00 32.46 31.98 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 -4.54 1.11 -0.10 5.56 -0.04 -1.26 -1.58 135.00 134.14 1nhn n PRO 21 Ca 0.01 -0.32 -0.23 0.00 -0.04 0.00 0.00 63.50 62.91 1nhn n PRO 21 Cb 0.12 -1.49 -0.11 0.00 -0.04 0.00 0.00 33.50 31.97 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 -0.67 0.58 -0.04 0.54 5.02 0.80 -1.91 118.16 122.48 1nhn n LYS 22 Ca 0.20 0.49 -0.13 0.00 -2.02 0.00 0.00 58.31 56.86 1nhn n LYS 22 Cb 0.22 -1.69 -0.08 0.00 -0.02 0.00 0.00 35.03 33.46 1nhn n LYS 22 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 1nhn h ILE 23 N -0.92 1.34 -0.76 -0.18 3.07 -1.48 -1.65 117.51 116.93 1nhn h ILE 23 Ca -0.43 -1.18 0.16 0.00 1.55 0.00 0.00 64.86 64.96 1nhn h ILE 23 Cb 1.42 1.87 -0.05 0.00 -0.27 0.00 0.00 36.82 39.79 1nhn h ILE 23 CO -0.23 0.34 0.51 0.50 -1.05 0.00 0.00 178.15 178.22 1nhn h LYS 24 N -0.12 0.38 -0.98 0.16 3.64 -1.45 1.07 116.57 119.27 1nhn h LYS 24 Ca 0.02 -0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.51 1nhn h LYS 24 Cb 0.57 -0.09 -0.09 0.00 -0.41 0.00 0.00 32.23 32.22 1nhn h LYS 24 CO 0.02 0.25 0.61 0.78 -2.27 0.00 0.00 179.45 178.84 1nhn h GLY 25 N 0.39 1.61 0.67 5.01 0.00 -0.60 0.16 103.07 110.31 1nhn h GLY 25 Ca 0.38 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1nhn h GLY 25 CO -0.12 0.12 -1.19 1.18 0.00 0.00 0.00 176.54 176.54 1nhn n GLU 26 N -4.66 0.49 -3.02 4.80 -0.58 0.69 -4.41 120.64 113.95 1nhn n GLU 26 Ca 0.19 0.01 -0.29 0.00 -0.42 0.00 0.00 57.16 56.65 1nhn n GLU 26 Cb 0.37 -1.68 -0.04 0.00 -0.57 0.00 0.00 31.44 29.53 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 -2.31 3.77 0.33 -0.32 8.25 0.34 -4.84 115.22 120.43 1nhn n HIS 27 Ca 0.00 -3.83 -0.01 0.00 -0.26 0.00 0.00 57.72 53.62 1nhn n HIS 27 Cb 0.51 -0.61 0.01 0.00 1.12 0.00 0.00 29.99 31.02 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 0.07 1.06 0.00 -0.41 -0.04 -0.44 -2.29 135.00 132.96 1nhn n PRO 28 Ca 0.32 -0.14 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 1nhn n PRO 28 Cb 0.38 -1.06 0.00 0.00 -0.04 0.00 0.00 33.50 32.78 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 0.81 0.84 3.92 0.55 0.00 -1.26 -5.10 105.19 104.95 1nhn n GLY 29 Ca 0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.30 0.00 -4.82 0.99 4.77 -0.97 -5.13 117.00 111.54 1nhn n LEU 30 Ca 0.00 -2.44 -0.31 0.00 -0.03 0.00 0.00 56.01 53.22 1nhn n LEU 30 Cb 0.00 -0.47 -0.05 0.00 -2.33 0.00 0.00 43.42 40.57 1nhn n LEU 30 CO 0.00 -0.77 -0.16 -0.94 -1.33 0.00 0.00 177.39 174.20 1nhn s SER 31 N -4.70 4.29 -0.19 -1.43 1.04 -1.26 -4.96 113.70 106.49 1nhn s SER 31 Ca 0.62 -1.56 0.09 0.00 0.48 0.00 0.00 55.95 55.58 1nhn s SER 31 Cb -0.05 0.58 0.55 0.00 0.10 0.00 0.00 66.02 67.20 1nhn s SER 31 CO 0.40 -0.97 1.41 0.00 0.98 0.00 0.00 173.24 175.06 1nhn n ILE 32 N -1.44 2.01 0.00 -1.02 3.06 -1.26 -1.62 119.36 119.09 1nhn n ILE 32 Ca -0.15 -1.02 0.00 0.00 -2.50 0.00 0.00 62.75 59.08 1nhn n ILE 32 Cb 0.66 -0.39 0.00 0.00 0.54 0.00 0.00 39.64 40.45 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 0.27 0.00 0.23 4.50 0.00 -1.26 -4.39 105.19 104.54 1nhn n GLY 33 Ca 0.23 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.92 1.91 0.22 1.61 2.03 -1.15 -2.48 116.55 116.76 1nhn n ASP 34 Ca 0.00 0.11 0.09 0.00 0.52 0.00 0.00 54.79 55.52 1nhn n ASP 34 Cb 0.43 -0.52 0.64 0.00 -0.72 0.00 0.00 41.12 40.95 1nhn n ASP 34 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 1nhn h VAL 35 N -0.47 0.97 -0.15 5.18 3.04 -1.62 0.49 116.25 123.70 1nhn h VAL 35 Ca -0.52 -0.00 -0.10 0.00 -1.01 0.00 0.00 66.70 65.07 1nhn h VAL 35 Cb 1.59 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 31.82 1nhn h VAL 35 CO -0.23 0.00 -0.28 0.00 -1.01 0.00 0.00 177.57 176.05 1nhn h ALA 36 N 1.96 0.23 -0.66 3.17 0.00 -1.73 -2.44 119.26 119.79 1nhn h ALA 36 Ca 0.04 -0.40 0.07 0.00 0.00 0.00 0.00 54.91 54.61 1nhn h ALA 36 Cb 0.13 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 1nhn h ALA 36 CO -0.00 0.24 0.35 0.87 0.00 0.00 0.00 179.25 180.71 1nhn h LYS 37 N 0.06 0.62 0.45 0.00 1.57 0.21 0.21 116.57 119.68 1nhn h LYS 37 Ca 0.01 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1nhn h LYS 37 Cb 0.87 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.02 1nhn h LYS 37 CO 0.06 0.41 -0.51 0.87 -0.57 0.00 0.00 179.45 179.71 1nhn h LYS 38 N 0.63 -0.94 -0.60 3.15 1.57 -0.86 -1.60 116.57 117.94 1nhn h LYS 38 Ca 0.30 0.06 0.12 0.00 -1.87 0.00 0.00 60.65 59.26 1nhn h LYS 38 Cb 0.23 0.21 -0.12 0.00 0.08 0.00 0.00 32.23 32.64 1nhn h LYS 38 CO -0.20 -0.63 -0.23 -0.07 -0.57 0.00 0.00 179.45 177.75 1nhn h LEU 39 N -0.97 -0.80 -0.56 2.94 3.38 -0.92 0.11 115.31 118.49 1nhn h LEU 39 Ca -0.05 0.20 0.22 0.00 0.09 0.00 0.00 57.88 58.34 1nhn h LEU 39 Cb 0.86 0.46 -0.10 0.00 0.09 0.00 0.00 40.66 41.97 1nhn h LEU 39 CO -0.10 -0.25 0.27 0.61 0.09 0.00 0.00 178.44 179.06 1nhn n GLY 40 N -1.44 -0.46 0.23 0.83 0.00 0.68 -1.22 105.19 103.82 1nhn n GLY 40 Ca 0.06 0.46 -0.26 0.00 0.00 0.00 0.00 46.02 46.28 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 -4.31 0.53 -0.37 1.61 1.02 -0.18 -4.60 120.64 114.34 1nhn n GLU 41 Ca 0.20 0.23 0.38 0.00 -0.02 0.00 0.00 57.16 57.95 1nhn n GLU 41 Cb 0.69 -1.38 0.76 0.00 -0.02 0.00 0.00 31.44 31.48 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 -0.84 0.00 -0.94 3.49 2.86 0.59 0.07 114.93 120.16 1nhn h MET 42 Ca -0.62 0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.04 1nhn h MET 42 Cb 1.56 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 33.17 1nhn h MET 42 CO -0.37 0.00 0.62 2.35 1.06 0.00 0.00 176.91 180.58 1nhn h TRP 43 N 0.00 1.16 0.00 -0.22 2.91 -1.59 0.17 115.95 118.38 1nhn h TRP 43 Ca 0.61 0.03 -0.06 0.00 1.13 0.00 0.00 58.89 60.60 1nhn h TRP 43 Cb 2.49 -0.39 -0.01 0.00 -0.51 0.00 0.00 29.16 30.74 1nhn h TRP 43 CO 0.00 0.69 -0.31 -0.91 -1.03 0.00 0.00 178.44 176.89 1nhn h ASN 44 N 1.22 0.00 -0.78 2.65 2.35 -1.25 -2.45 115.58 117.32 1nhn h ASN 44 Ca 0.37 0.00 -0.44 0.00 -0.55 0.00 0.00 56.30 55.68 1nhn h ASN 44 Cb -0.04 0.00 -0.24 0.00 0.05 0.00 0.00 38.32 38.09 1nhn h ASN 44 CO -0.10 0.31 0.56 0.59 -1.65 0.00 0.00 177.43 177.14 1nhn n ASN 45 N -3.76 4.53 -0.67 5.81 3.02 0.55 -4.91 115.26 119.83 1nhn n ASN 45 Ca -0.01 -3.32 0.00 0.00 -0.03 0.00 0.00 54.58 51.22 1nhn n ASN 45 Cb 0.40 -0.83 0.00 0.00 -0.61 0.00 0.00 39.78 38.74 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 -0.68 0.00 -1.31 3.41 5.66 -0.91 -4.97 114.28 115.48 1nhn n THR 46 Ca 0.47 0.00 0.02 0.00 -3.05 0.00 0.00 64.05 61.50 1nhn n THR 46 Cb 1.21 0.00 0.21 0.00 -1.55 0.00 0.00 70.33 70.20 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 3.61 -0.33 1.79 0.00 -1.26 -4.96 120.51 116.36 1nhn n ALA 47 Ca 0.00 -2.89 0.00 0.00 0.00 0.00 0.00 53.44 50.55 1nhn n ALA 47 Cb 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 18.82 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 -1.02 0.00 0.00 0.00 0.00 -1.26 -3.90 120.51 114.33 1nhn n ALA 48 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1nhn n ALA 48 Cb 0.90 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 20.26 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 2.00 2.13 -0.09 0.00 9.92 -1.26 -4.66 116.55 124.59 1nhn n ASP 49 Ca 0.00 0.00 0.12 0.00 -0.53 0.00 0.00 54.79 54.38 1nhn n ASP 49 Cb 0.00 0.42 0.27 0.00 -0.64 0.00 0.00 41.12 41.17 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 -0.66 0.72 0.09 -2.24 9.92 -1.25 -3.70 116.55 119.42 1nhn n ASP 50 Ca 0.00 -0.51 -0.23 0.00 -0.53 0.00 0.00 54.79 53.51 1nhn n ASP 50 Cb 0.01 0.25 -0.15 0.00 -0.64 0.00 0.00 41.12 40.59 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 0.43 0.42 -0.71 -1.24 1.57 -1.89 -3.37 116.57 111.78 1nhn h LYS 51 Ca 0.00 -0.71 0.09 0.00 -1.87 0.00 0.00 60.65 58.16 1nhn h LYS 51 Cb 0.51 0.26 -0.10 0.00 0.08 0.00 0.00 32.23 32.98 1nhn h LYS 51 CO 0.00 1.34 -0.34 1.04 -0.57 0.00 0.00 179.45 180.92 1nhn n GLN 52 N -3.72 -0.23 0.23 3.15 3.00 -1.24 -0.05 117.38 118.52 1nhn n GLN 52 Ca -0.22 1.08 -0.13 0.00 -0.01 0.00 0.00 57.00 57.73 1nhn n GLN 52 Cb 1.04 -1.60 -0.07 0.00 0.00 0.00 0.00 30.24 29.62 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 -0.71 -0.90 -1.09 0.13 -1.78 -1.02 132.00 126.63 1nhn h PRO 53 Ca 0.19 0.05 0.25 0.00 -0.87 0.00 0.00 66.00 65.61 1nhn h PRO 53 Cb 0.37 0.16 -0.14 0.00 0.13 0.00 0.00 31.00 31.51 1nhn h PRO 53 CO -0.69 -0.47 0.29 1.88 -0.23 0.00 0.00 178.00 178.78 1nhn h TYR 54 N -0.73 0.44 0.60 1.56 0.05 -1.28 -1.59 116.97 116.01 1nhn h TYR 54 Ca -0.05 0.05 -0.03 0.00 0.05 0.00 0.00 58.73 58.74 1nhn h TYR 54 Cb 0.61 -0.05 0.01 0.00 1.01 0.00 0.00 36.73 38.31 1nhn h TYR 54 CO -0.13 -0.20 -0.29 0.93 -1.05 0.00 0.00 178.16 177.42 1nhn h GLU 55 N 0.23 -0.78 -1.21 4.88 4.39 -0.27 0.11 114.58 121.93 1nhn h GLU 55 Ca 0.58 0.05 0.45 0.00 0.34 0.00 0.00 59.36 60.78 1nhn h GLU 55 Cb 1.19 0.18 -0.15 0.00 -0.10 0.00 0.00 28.75 29.87 1nhn h GLU 55 CO -0.65 -0.52 0.74 1.63 -1.16 0.00 0.00 179.01 179.05 1nhn n LYS 56 N -4.25 -0.04 0.00 2.33 4.76 -0.40 -0.08 118.16 120.47 1nhn n LYS 56 Ca -0.10 1.28 -0.01 0.00 -2.87 0.00 0.00 58.31 56.62 1nhn n LYS 56 Cb 0.32 -2.44 -0.00 0.00 -1.84 0.00 0.00 35.03 31.07 1nhn n LYS 56 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1nhn h LYS 57 N 0.00 -0.04 -0.85 1.97 3.64 -1.19 -2.92 116.57 117.18 1nhn h LYS 57 Ca 0.86 0.00 0.17 0.00 -1.27 0.00 0.00 60.65 60.41 1nhn h LYS 57 Cb 2.57 0.01 -0.16 0.00 -0.41 0.00 0.00 32.23 34.24 1nhn h LYS 57 CO -0.58 -0.02 -0.21 0.00 -2.27 0.00 0.00 179.45 176.37 1nhn h ALA 58 N -1.75 0.56 -0.06 5.00 0.00 0.26 -0.62 119.26 122.66 1nhn h ALA 58 Ca -0.00 0.33 0.02 0.00 0.00 0.00 0.00 54.91 55.26 1nhn h ALA 58 Cb 0.03 0.65 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1nhn h ALA 58 CO 0.01 -0.40 -0.08 0.00 0.00 0.00 0.00 179.25 178.77 1nhn h ALA 59 N 1.85 -0.04 -0.44 0.00 0.00 -0.65 -0.76 119.26 119.22 1nhn h ALA 59 Ca 0.41 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1nhn h ALA 59 Cb 0.62 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1nhn h ALA 59 CO -0.87 -0.56 0.28 -0.22 0.00 0.00 0.00 179.25 177.88 1nhn h LYS 60 N -0.12 0.58 0.01 0.00 3.64 -0.96 -1.50 116.57 118.22 1nhn h LYS 60 Ca 0.05 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1nhn h LYS 60 Cb 0.19 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1nhn h LYS 60 CO -0.13 0.40 -0.00 -0.07 -2.27 0.00 0.00 179.45 177.38 1nhn h LEU 61 N 0.59 -0.01 -0.93 5.20 3.38 -0.84 0.18 115.31 122.88 1nhn h LEU 61 Ca 0.16 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.97 1nhn h LEU 61 Cb -0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1nhn h LEU 61 CO -0.03 0.06 -0.26 0.07 0.09 0.00 0.00 178.44 178.37 1nhn h LYS 62 N -0.08 0.48 0.51 1.13 2.10 -1.12 -1.98 116.57 117.61 1nhn h LYS 62 Ca -0.00 -0.18 -0.03 0.00 -2.00 0.00 0.00 60.65 58.44 1nhn h LYS 62 Cb 0.08 -0.03 0.01 0.00 -0.90 0.00 0.00 32.23 31.38 1nhn h LYS 62 CO 0.00 0.70 -0.25 1.49 -2.00 0.00 0.00 179.45 179.40 1nhn h GLU 63 N 0.42 -0.67 -0.82 0.07 4.81 -1.14 -1.54 114.58 115.71 1nhn h GLU 63 Ca 0.06 0.05 0.19 0.00 -0.13 0.00 0.00 59.36 59.53 1nhn h GLU 63 Cb 0.68 0.15 -0.12 0.00 0.63 0.00 0.00 28.75 30.09 1nhn h GLU 63 CO 0.05 -0.44 0.27 1.57 -0.73 0.00 0.00 179.01 179.72 1nhn h LYS 64 N -0.80 0.30 0.00 1.92 5.09 -0.96 -1.99 116.57 120.13 1nhn h LYS 64 Ca -0.07 -0.02 0.00 0.00 0.09 0.00 0.00 60.65 60.65 1nhn h LYS 64 Cb 0.53 -0.07 -0.00 0.00 0.10 0.00 0.00 32.23 32.79 1nhn h LYS 64 CO 0.12 0.20 -0.02 -0.92 -2.09 0.00 0.00 179.45 176.74 1nhn h TYR 65 N 0.31 -0.05 -1.58 0.07 3.20 -1.25 0.11 116.97 117.79 1nhn h TYR 65 Ca 0.49 0.00 0.49 0.00 3.14 0.00 0.00 58.73 62.86 1nhn h TYR 65 Cb 0.90 0.02 -0.10 0.00 1.54 0.00 0.00 36.73 39.09 1nhn h TYR 65 CO -0.22 -0.02 1.09 0.39 -1.64 0.00 0.00 178.16 177.76 1nhn n GLU 66 N -2.52 -0.02 0.03 1.82 -0.58 -0.59 0.05 120.64 118.83 1nhn n GLU 66 Ca -0.00 1.08 -0.21 0.00 -0.42 0.00 0.00 57.16 57.61 1nhn n GLU 66 Cb 0.01 -2.31 -0.14 0.00 -0.57 0.00 0.00 31.44 28.43 1nhn n GLU 66 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1nhn h LYS 67 N 0.00 0.27 0.00 3.49 6.56 -1.01 -2.92 116.57 122.96 1nhn h LYS 67 Ca 0.85 -0.46 -0.04 0.00 -1.06 0.00 0.00 60.65 59.94 1nhn h LYS 67 Cb 3.11 0.17 -0.01 0.00 -0.57 0.00 0.00 32.23 34.93 1nhn h LYS 67 CO -0.21 1.22 -0.20 0.22 -2.06 0.00 0.00 179.45 178.41 1nhn h ASP 68 N -0.35 0.00 0.04 0.86 3.58 0.22 0.39 116.42 121.16 1nhn h ASP 68 Ca -0.22 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.06 1nhn h ASP 68 Cb 1.69 0.00 0.02 0.00 1.72 0.00 0.00 39.33 42.76 1nhn h ASP 68 CO 0.10 0.20 -0.70 -0.29 -2.88 0.00 0.00 179.24 175.67 1nhn h ILE 69 N 0.00 1.43 -0.65 2.25 -0.00 -0.71 -0.81 117.51 119.02 1nhn h ILE 69 Ca -0.00 -2.21 -0.06 0.00 -0.00 0.00 0.00 64.86 62.59 1nhn h ILE 69 Cb 0.40 2.72 -0.03 0.00 -0.00 0.00 0.00 36.82 39.91 1nhn h ILE 69 CO 0.03 0.64 0.16 0.00 -0.00 0.00 0.00 178.15 178.97 1nhn h ALA 70 N 0.27 1.05 0.00 0.18 0.00 -1.27 -0.19 119.26 119.30 1nhn h ALA 70 Ca -0.10 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1nhn h ALA 70 Cb 1.44 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1nhn h ALA 70 CO 0.14 0.63 0.00 0.00 0.00 0.00 0.00 179.25 180.01 1nhn h ALA 71 N 1.19 1.00 0.00 0.00 0.00 -0.10 1.51 119.26 122.85 1nhn h ALA 71 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1nhn h ALA 71 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1nhn h ALA 71 CO 0.00 0.00 -0.24 -0.92 0.00 0.00 0.00 179.25 178.09 1nhn h TYR 72 N 0.00 0.00 0.00 0.00 3.20 0.46 -3.46 116.97 117.17 1nhn h TYR 72 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1nhn h TYR 72 Cb 0.30 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.57 1nhn h TYR 72 CO 0.00 0.00 -0.27 -2.13 -1.64 0.00 0.00 178.16 174.12 1nhn n ARG 73 N -4.24 3.64 -1.99 1.82 0.63 -0.78 -4.86 116.66 110.89 1nhn n ARG 73 Ca -0.03 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.60 1nhn n ARG 73 Cb 0.12 -0.57 0.03 0.00 0.45 0.00 0.00 32.46 32.49 1nhn n ARG 73 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1nhn n ALA 74 N -0.47 5.54 -0.45 5.13 0.00 -0.59 -4.88 120.51 124.79 1nhn n ALA 74 Ca 0.00 -3.92 0.00 0.00 0.00 0.00 0.00 53.44 49.52 1nhn n ALA 74 Cb 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.51 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 -0.66 0.00 0.12 0.00 4.81 0.51 -4.62 118.16 118.31 1nhn n LYS 75 Ca 0.48 0.69 0.00 0.00 -0.87 0.00 0.00 58.31 58.61 1nhn n LYS 75 Cb 0.71 -1.28 0.00 0.00 0.02 0.00 0.00 35.03 34.48 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 -0.96 -0.24 0.00 3.14 0.00 -1.26 -4.85 105.19 101.02 1nhn n GLY 76 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -3.50 0.00 -0.54 1.61 4.81 -1.26 -4.93 118.16 114.35 1nhn n LYS 77 Ca 0.00 0.00 0.40 0.00 -0.87 0.00 0.00 58.31 57.84 1nhn n LYS 77 Cb 0.00 0.00 0.63 0.00 0.02 0.00 0.00 35.03 35.68 1nhn n LYS 77 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1nhn n PRO 78 N 0.00 -0.00 0.00 1.64 -0.02 -1.26 -3.64 135.00 131.71 1nhn n PRO 78 Ca 0.00 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 1nhn n PRO 78 Cb 0.00 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 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 -3.53 0.00 -3.37 2.55 -0.08 -1.26 0.12 116.55 110.97 1nhn n ASP 79 Ca 0.34 0.00 -0.31 0.00 -1.51 0.00 0.00 54.79 53.31 1nhn n ASP 79 Cb 1.53 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 44.95 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 -2.22 4.69 -0.59 -1.67 0.00 -1.24 -5.20 120.51 114.29 1nhn n ALA 80 Ca 0.00 -4.74 0.00 0.00 0.00 0.00 0.00 53.44 48.70 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