#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 1.93 -1.97 5.41 0.00 -1.26 -5.01 120.51 119.61 1nhn n ALA 4 Ca 0.00 -0.16 -0.26 0.00 0.00 0.00 0.00 53.44 53.02 1nhn n ALA 4 Cb 0.00 0.34 0.13 0.00 0.00 0.00 0.00 19.45 19.92 1nhn n ALA 4 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1nhn s PRO 5 N -2.07 1.36 0.00 0.00 0.02 -1.26 -5.15 135.00 127.90 1nhn s PRO 5 Ca -0.04 -0.89 0.00 0.00 0.02 0.00 0.00 61.00 60.09 1nhn s PRO 5 Cb 0.01 -2.18 0.00 0.00 0.02 0.00 0.00 34.50 32.35 1nhn s PRO 5 CO 0.09 -1.75 0.00 0.36 -0.33 0.00 0.00 177.00 175.38 1nhn n LYS 6 N -3.13 1.82 -3.64 5.54 0.00 -1.26 -5.12 118.16 112.38 1nhn n LYS 6 Ca 0.15 0.00 -0.39 0.00 -0.00 0.00 0.00 58.31 58.07 1nhn n LYS 6 Cb 0.60 0.00 -0.09 0.00 -0.00 0.00 0.00 35.03 35.54 1nhn n LYS 6 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 1nhn s ARG 7 N 3.55 2.48 0.72 -1.58 0.52 -1.26 -4.97 118.95 118.41 1nhn s ARG 7 Ca 0.00 -2.06 -0.12 0.00 -0.52 0.00 0.00 55.73 53.02 1nhn s ARG 7 Cb 0.00 -3.83 0.18 0.00 0.52 0.00 0.00 34.95 31.82 1nhn s ARG 7 CO 0.00 -1.17 0.62 -2.30 0.02 0.00 0.00 175.30 172.47 1nhn n PRO 8 N 4.33 -2.37 -1.13 3.54 -0.02 -1.26 -4.98 135.00 133.11 1nhn n PRO 8 Ca 0.00 -1.00 -0.37 0.00 -2.02 0.00 0.00 63.50 60.11 1nhn n PRO 8 Cb 0.41 -0.96 0.02 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 -3.50 0.00 -0.73 0.52 -0.02 -1.26 -4.92 135.00 125.09 1nhn n PRO 9 Ca 0.09 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.61 1nhn n PRO 9 Cb 0.34 -0.98 0.07 0.00 -0.02 0.00 0.00 33.50 32.91 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 2.87 1.09 0.00 2.55 7.64 -1.26 -4.56 113.62 121.95 1nhn n SER 10 Ca 0.04 -2.58 0.00 0.00 1.01 0.00 0.00 58.87 57.34 1nhn n SER 10 Cb 0.50 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 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 -0.35 0.00 0.17 -0.43 0.00 -1.26 -4.48 120.51 114.16 1nhn n ALA 11 Ca 0.09 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.59 1nhn n ALA 11 Cb 0.82 0.00 0.09 0.00 0.00 0.00 0.00 19.45 20.36 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 -1.93 -3.18 116.94 115.17 1nhn h PHE 12 Ca 0.00 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.36 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 0.30 -0.39 0.35 -2.23 0.00 0.00 178.31 176.34 1nhn h PHE 13 N 0.00 0.84 0.37 0.41 3.04 -1.92 0.10 116.94 119.79 1nhn h PHE 13 Ca -0.00 -0.29 -0.01 0.00 3.98 0.00 0.00 57.97 61.65 1nhn h PHE 13 Cb 1.23 -0.16 -0.03 0.00 2.56 0.00 0.00 35.95 39.55 1nhn h PHE 13 CO 0.00 1.06 -0.48 -0.07 -2.02 0.00 0.00 178.31 176.80 1nhn h LEU 14 N 0.38 -1.34 -0.80 0.59 -0.00 -1.93 -1.61 115.31 110.60 1nhn h LEU 14 Ca 0.02 0.12 0.19 0.00 -0.00 0.00 0.00 57.88 58.20 1nhn h LEU 14 Cb 0.99 0.46 -0.12 0.00 -0.00 0.00 0.00 40.66 41.99 1nhn h LEU 14 CO 0.09 -0.59 0.22 0.15 -0.00 0.00 0.00 178.44 178.30 1nhn h PHE 15 N -0.87 0.34 0.44 1.13 3.57 -1.54 -2.31 116.94 117.68 1nhn h PHE 15 Ca -0.05 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1nhn h PHE 15 Cb 0.78 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.47 1nhn h PHE 15 CO -0.30 -0.11 -0.49 0.00 -2.23 0.00 0.00 178.31 175.18 1nhn h SER 17 N -0.94 -1.32 -0.86 0.00 0.02 -0.75 0.16 113.55 109.87 1nhn h SER 17 Ca -0.05 0.20 0.22 0.00 -0.84 0.00 0.00 61.79 61.32 1nhn h SER 17 Cb 0.83 0.58 -0.14 0.00 0.14 0.00 0.00 62.40 63.82 1nhn h SER 17 CO -0.09 -0.15 0.20 -0.33 -1.14 0.00 0.00 176.83 175.32 1nhn h GLU 18 N -0.01 0.19 0.00 3.45 5.08 -1.47 -2.89 114.58 118.93 1nhn h GLU 18 Ca 0.09 -0.01 -0.30 0.00 -1.00 0.00 0.00 59.36 58.14 1nhn h GLU 18 Cb 0.26 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.41 1nhn h GLU 18 CO -0.56 0.13 -1.84 0.66 -1.00 0.00 0.00 179.01 176.39 1nhn n TYR 19 N -5.24 0.79 -0.31 4.33 4.02 -0.81 -4.52 117.16 115.41 1nhn n TYR 19 Ca 0.20 0.29 -0.07 0.00 -0.01 0.00 0.00 57.90 58.31 1nhn n TYR 19 Cb 0.64 -1.14 -0.05 0.00 -0.02 0.00 0.00 39.34 38.77 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 -2.98 -0.30 0.00 -0.72 0.63 0.50 0.28 116.66 114.07 1nhn n ARG 20 Ca -0.20 1.15 0.11 0.00 -0.92 0.00 0.00 57.85 57.99 1nhn n ARG 20 Cb 1.07 -1.70 0.51 0.00 0.45 0.00 0.00 32.46 32.78 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 -4.99 0.08 -0.09 -0.14 -0.04 -1.26 -0.66 135.00 127.90 1nhn n PRO 21 Ca 0.03 0.10 -0.18 0.00 -0.04 0.00 0.00 63.50 63.41 1nhn n PRO 21 Cb 0.22 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.07 1nhn n PRO 21 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1nhn h LYS 22 N 0.00 0.00 -0.08 0.54 1.79 -0.41 -1.92 116.57 116.49 1nhn h LYS 22 Ca 0.00 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 1nhn h LYS 22 Cb 0.34 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.99 1nhn h LYS 22 CO 0.00 0.92 -0.10 -0.84 -1.08 0.00 0.00 179.45 178.34 1nhn h ILE 23 N -1.00 1.38 -0.30 1.86 3.07 -1.13 -2.10 117.51 119.29 1nhn h ILE 23 Ca -0.21 -1.31 0.09 0.00 1.55 0.00 0.00 64.86 64.98 1nhn h ILE 23 Cb 1.13 2.06 -0.01 0.00 -0.27 0.00 0.00 36.82 39.73 1nhn h ILE 23 CO -0.13 0.37 0.22 0.50 -1.05 0.00 0.00 178.15 178.05 1nhn h LYS 24 N -0.23 0.00 -1.01 0.16 3.64 -1.05 0.88 116.57 118.96 1nhn h LYS 24 Ca 0.01 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.49 1nhn h LYS 24 Cb 0.64 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.38 1nhn h LYS 24 CO 0.02 0.00 0.64 0.78 -2.27 0.00 0.00 179.45 178.63 1nhn h GLY 25 N 0.00 1.60 0.82 5.01 0.00 -0.64 0.82 103.07 110.68 1nhn h GLY 25 Ca 0.14 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 1nhn h GLY 25 CO -0.00 0.24 -1.21 1.18 0.00 0.00 0.00 176.54 176.74 1nhn n GLU 26 N -4.57 0.62 -2.90 4.80 -0.58 0.49 -4.40 120.64 114.09 1nhn n GLU 26 Ca 0.17 0.07 -0.30 0.00 -0.42 0.00 0.00 57.16 56.69 1nhn n GLU 26 Cb 0.28 -1.77 -0.03 0.00 -0.57 0.00 0.00 31.44 29.35 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 -2.62 3.83 0.16 -0.32 8.25 0.28 -4.84 115.22 119.95 1nhn n HIS 27 Ca -0.02 -3.75 -0.04 0.00 -0.26 0.00 0.00 57.72 53.66 1nhn n HIS 27 Cb 0.58 -0.62 0.02 0.00 1.12 0.00 0.00 29.99 31.09 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 -0.18 1.19 0.00 -0.41 -0.04 0.09 -2.61 135.00 133.03 1nhn n PRO 28 Ca 0.34 -0.41 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 1nhn n PRO 28 Cb 0.37 -1.16 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 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 0.65 0.00 2.66 0.55 0.00 -1.26 -5.11 105.19 102.68 1nhn n GLY 29 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.36 0.00 0.00 0.99 4.77 -1.07 -5.10 117.00 116.23 1nhn n LEU 30 Ca 0.00 -0.95 -0.18 0.00 -0.03 0.00 0.00 56.01 54.85 1nhn n LEU 30 Cb 0.02 -0.73 0.01 0.00 -2.33 0.00 0.00 43.42 40.39 1nhn n LEU 30 CO 0.00 -1.48 0.07 -1.20 -1.33 0.00 0.00 177.39 173.44 1nhn n SER 31 N -3.95 2.14 -0.76 -1.43 7.64 -1.26 -4.96 113.62 111.03 1nhn n SER 31 Ca 0.11 -2.28 0.13 0.00 1.01 0.00 0.00 58.87 57.84 1nhn n SER 31 Cb 0.42 -0.05 0.28 0.00 -1.01 0.00 0.00 64.21 63.84 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 -1.44 0.00 0.15 0.44 3.06 -1.26 -2.24 119.36 118.08 1nhn n ILE 32 Ca -0.00 -0.40 0.05 0.00 -2.50 0.00 0.00 62.75 59.90 1nhn n ILE 32 Cb 0.43 1.08 -0.07 0.00 0.54 0.00 0.00 39.64 41.62 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 1.28 -0.30 0.26 4.50 0.00 -1.26 -4.08 105.19 105.59 1nhn n GLY 33 Ca 0.16 -0.26 -0.23 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.66 1.70 0.12 1.61 -0.08 -1.23 -2.27 116.55 114.74 1nhn n ASP 34 Ca -0.01 0.29 0.17 0.00 -1.51 0.00 0.00 54.79 53.74 1nhn n ASP 34 Cb 0.23 -0.70 0.74 0.00 2.34 0.00 0.00 41.12 43.73 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 -0.86 0.65 0.19 5.18 3.04 -1.72 0.62 116.25 123.35 1nhn h VAL 35 Ca -0.52 0.00 -0.31 0.00 -1.01 0.00 0.00 66.70 64.87 1nhn h VAL 35 Cb 1.43 0.80 0.02 0.00 -2.01 0.00 0.00 31.29 31.53 1nhn h VAL 35 CO -0.31 0.00 -1.39 0.00 -1.01 0.00 0.00 177.57 174.86 1nhn h ALA 36 N 1.76 -0.01 -0.62 3.17 0.00 -1.73 -2.86 119.26 118.96 1nhn h ALA 36 Ca 0.15 -0.90 -0.03 0.00 0.00 0.00 0.00 54.91 54.13 1nhn h ALA 36 Cb 0.69 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 1nhn h ALA 36 CO -0.00 0.86 0.26 1.57 0.00 0.00 0.00 179.25 181.93 1nhn h LYS 37 N 0.11 0.92 0.32 0.00 2.10 0.59 0.18 116.57 120.78 1nhn h LYS 37 Ca -0.21 -0.16 0.00 0.00 -2.00 0.00 0.00 60.65 58.29 1nhn h LYS 37 Cb 2.07 -0.15 -0.02 0.00 -0.90 0.00 0.00 32.23 33.23 1nhn h LYS 37 CO 0.24 0.77 -0.34 0.87 -2.00 0.00 0.00 179.45 178.98 1nhn h LYS 38 N 0.86 -0.67 -0.30 0.07 6.56 -0.99 -1.36 116.57 120.75 1nhn h LYS 38 Ca 0.21 0.05 0.07 0.00 -1.06 0.00 0.00 60.65 59.91 1nhn h LYS 38 Cb 0.18 0.15 -0.07 0.00 -0.57 0.00 0.00 32.23 31.93 1nhn h LYS 38 CO -0.02 -0.45 -0.14 -0.07 -2.06 0.00 0.00 179.45 176.71 1nhn h LEU 39 N -0.70 -0.47 -1.69 2.94 3.38 -1.26 0.10 115.31 117.61 1nhn h LEU 39 Ca -0.02 0.11 0.52 0.00 0.09 0.00 0.00 57.88 58.59 1nhn h LEU 39 Cb 0.64 0.26 -0.10 0.00 0.09 0.00 0.00 40.66 41.55 1nhn h LEU 39 CO -0.08 -0.17 1.17 0.61 0.09 0.00 0.00 178.44 180.06 1nhn n GLY 40 N -1.31 -0.90 0.12 0.83 0.00 0.61 -1.15 105.19 103.39 1nhn n GLY 40 Ca 0.00 0.70 -0.23 0.00 0.00 0.00 0.00 46.02 46.49 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 -4.17 0.56 -0.16 1.61 -0.58 -0.20 -4.55 120.64 113.16 1nhn n GLU 41 Ca 0.42 0.35 0.20 0.00 -0.42 0.00 0.00 57.16 57.71 1nhn n GLU 41 Cb 1.78 -1.56 0.59 0.00 -0.57 0.00 0.00 31.44 31.68 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 0.23 -0.83 3.49 2.86 0.68 -2.02 114.93 118.34 1nhn h MET 42 Ca -0.45 -0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.21 1nhn h MET 42 Cb 1.36 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.91 1nhn h MET 42 CO -0.27 0.15 0.53 2.35 1.06 0.00 0.00 176.91 180.73 1nhn h TRP 43 N 0.24 1.00 -0.23 -0.22 2.91 -1.49 0.94 115.95 119.09 1nhn h TRP 43 Ca 0.39 0.03 -0.06 0.00 1.13 0.00 0.00 58.89 60.38 1nhn h TRP 43 Cb 1.16 -0.33 -0.01 0.00 -0.51 0.00 0.00 29.16 29.47 1nhn h TRP 43 CO -0.00 0.57 -0.11 -0.91 -1.03 0.00 0.00 178.44 176.97 1nhn h ASN 44 N 1.04 0.35 -0.59 2.65 2.35 -1.62 -1.93 115.58 117.83 1nhn h ASN 44 Ca 0.33 -0.08 -0.34 0.00 -0.55 0.00 0.00 56.30 55.67 1nhn h ASN 44 Cb 0.01 -0.09 -0.18 0.00 0.05 0.00 0.00 38.32 38.11 1nhn h ASN 44 CO -0.11 0.49 0.43 0.59 -1.65 0.00 0.00 177.43 177.18 1nhn n ASN 45 N -4.25 4.47 0.00 5.81 3.02 0.25 -4.88 115.26 119.68 1nhn n ASN 45 Ca 0.00 -3.03 0.00 0.00 -0.03 0.00 0.00 54.58 51.52 1nhn n ASN 45 Cb 0.28 -0.81 0.00 0.00 -0.61 0.00 0.00 39.78 38.65 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 -0.30 0.00 -3.72 3.41 5.66 -0.73 -4.94 114.28 113.66 1nhn n THR 46 Ca 0.36 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.99 1nhn n THR 46 Cb 1.01 -0.40 -0.12 0.00 -1.55 0.00 0.00 70.33 69.27 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 -2.40 3.19 -2.00 1.79 0.00 -1.26 -4.95 121.76 116.13 1nhn s ALA 47 Ca 0.00 -1.28 0.04 0.00 0.00 0.00 0.00 51.96 50.73 1nhn s ALA 47 Cb 0.00 -2.20 0.25 0.00 0.00 0.00 0.00 23.12 21.17 1nhn s ALA 47 CO 0.00 -0.71 0.70 0.00 0.00 0.00 0.00 175.76 175.75 1nhn n ALA 48 N 4.94 1.67 0.45 0.00 0.00 -1.26 0.00 120.51 126.30 1nhn n ALA 48 Ca -0.15 -0.03 0.05 0.00 0.00 0.00 0.00 53.44 53.31 1nhn n ALA 48 Cb 0.50 -1.07 -0.04 0.00 0.00 0.00 0.00 19.45 18.84 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 -0.96 0.59 -0.50 0.00 -0.08 -1.26 -4.31 116.55 110.03 1nhn n ASP 49 Ca 0.03 -0.79 0.11 0.00 -1.51 0.00 0.00 54.79 52.63 1nhn n ASP 49 Cb 0.01 0.90 -0.00 0.00 2.34 0.00 0.00 41.12 44.37 1nhn n ASP 49 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1nhn n ASP 50 N -1.05 2.02 0.09 1.67 2.03 0.10 -4.02 116.55 117.39 1nhn n ASP 50 Ca 0.02 -1.51 -0.18 0.00 0.52 0.00 0.00 54.79 53.64 1nhn n ASP 50 Cb 0.16 0.47 -0.14 0.00 -0.72 0.00 0.00 41.12 40.88 1nhn n ASP 50 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1nhn h LYS 51 N 2.44 0.31 -0.80 -0.67 1.57 -1.69 -3.36 116.57 114.36 1nhn h LYS 51 Ca 0.00 -0.53 0.13 0.00 -1.87 0.00 0.00 60.65 58.38 1nhn h LYS 51 Cb 0.74 0.20 -0.14 0.00 0.08 0.00 0.00 32.23 33.12 1nhn h LYS 51 CO 0.00 1.21 -0.28 1.04 -0.57 0.00 0.00 179.45 180.85 1nhn n GLN 52 N -3.52 -0.15 0.19 3.15 3.00 -1.26 -0.27 117.38 118.51 1nhn n GLN 52 Ca -0.15 1.24 -0.11 0.00 -0.01 0.00 0.00 57.00 57.96 1nhn n GLN 52 Cb 1.05 -1.84 -0.06 0.00 0.00 0.00 0.00 30.24 29.39 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 -0.60 -0.82 -1.09 0.13 -1.85 -0.42 132.00 127.35 1nhn h PRO 53 Ca 0.31 0.04 0.20 0.00 -0.87 0.00 0.00 66.00 65.68 1nhn h PRO 53 Cb 0.51 0.14 -0.13 0.00 0.13 0.00 0.00 31.00 31.65 1nhn h PRO 53 CO -0.80 -0.40 0.20 1.88 -0.23 0.00 0.00 178.00 178.64 1nhn h TYR 54 N -0.63 0.29 0.50 1.56 0.05 -1.41 -1.16 116.97 116.18 1nhn h TYR 54 Ca -0.04 0.05 -0.02 0.00 0.05 0.00 0.00 58.73 58.77 1nhn h TYR 54 Cb 0.54 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.28 1nhn h TYR 54 CO -0.17 -0.17 -0.34 0.93 -1.05 0.00 0.00 178.16 177.36 1nhn h GLU 55 N 0.23 -0.77 -0.98 4.88 4.39 -0.45 0.58 114.58 122.46 1nhn h GLU 55 Ca 0.49 0.05 0.32 0.00 0.34 0.00 0.00 59.36 60.57 1nhn h GLU 55 Cb 0.93 0.18 -0.16 0.00 -0.10 0.00 0.00 28.75 29.60 1nhn h GLU 55 CO -0.61 -0.51 0.46 0.87 -1.16 0.00 0.00 179.01 178.06 1nhn h LYS 56 N -0.80 0.21 0.08 2.33 1.79 0.08 0.18 116.57 120.44 1nhn h LYS 56 Ca -0.07 -0.01 -0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1nhn h LYS 56 Cb 0.65 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.25 1nhn h LYS 56 CO 0.05 0.14 -0.04 0.87 -1.08 0.00 0.00 179.45 179.39 1nhn h LYS 57 N 0.22 -0.10 -0.87 3.15 6.56 -0.68 -1.39 116.57 123.46 1nhn h LYS 57 Ca 0.71 0.01 0.22 0.00 -1.06 0.00 0.00 60.65 60.53 1nhn h LYS 57 Cb 1.64 0.02 -0.15 0.00 -0.57 0.00 0.00 32.23 33.17 1nhn h LYS 57 CO -0.67 -0.07 0.03 0.00 -2.06 0.00 0.00 179.45 176.68 1nhn h ALA 58 N -1.92 0.98 0.71 3.86 0.00 -0.28 -0.88 119.26 121.74 1nhn h ALA 58 Ca -0.01 0.28 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 1nhn h ALA 58 Cb 0.08 0.49 0.01 0.00 0.00 0.00 0.00 17.79 18.37 1nhn h ALA 58 CO 0.02 -0.48 -0.34 0.00 0.00 0.00 0.00 179.25 178.45 1nhn h ALA 59 N 1.83 -0.95 -0.53 0.00 0.00 -0.74 -1.23 119.26 117.64 1nhn h ALA 59 Ca 0.50 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 55.29 1nhn h ALA 59 Cb 0.96 0.37 -0.11 0.00 0.00 0.00 0.00 17.79 19.01 1nhn h ALA 59 CO -0.78 -1.02 -0.35 -0.22 0.00 0.00 0.00 179.25 176.88 1nhn h LYS 60 N -0.98 -0.19 0.31 0.00 3.11 -0.02 0.70 116.57 119.49 1nhn h LYS 60 Ca -0.10 0.01 -0.02 0.00 -2.81 0.00 0.00 60.65 57.74 1nhn h LYS 60 Cb 0.74 0.04 0.00 0.00 -1.00 0.00 0.00 32.23 32.02 1nhn h LYS 60 CO 0.16 -0.13 -0.15 -0.07 -2.81 0.00 0.00 179.45 176.45 1nhn h LEU 61 N -0.20 -0.35 -0.63 5.20 3.38 -1.23 -1.83 115.31 119.65 1nhn h LEU 61 Ca 0.21 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 58.02 1nhn h LEU 61 Cb 0.55 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1nhn h LEU 61 CO -0.64 -0.23 -0.62 0.07 0.09 0.00 0.00 178.44 177.11 1nhn h LYS 62 N -0.45 0.22 0.82 1.13 2.10 -1.02 -2.46 116.57 116.93 1nhn h LYS 62 Ca -0.04 -0.16 -0.04 0.00 -2.00 0.00 0.00 60.65 58.41 1nhn h LYS 62 Cb 0.34 0.03 0.01 0.00 -0.90 0.00 0.00 32.23 31.70 1nhn h LYS 62 CO 0.07 0.78 -0.40 1.49 -2.00 0.00 0.00 179.45 179.38 1nhn h GLU 63 N 0.16 -1.08 -0.27 0.07 4.81 -0.85 -0.68 114.58 116.74 1nhn h GLU 63 Ca -0.01 0.07 0.06 0.00 -0.13 0.00 0.00 59.36 59.35 1nhn h GLU 63 Cb 1.14 0.24 -0.06 0.00 0.63 0.00 0.00 28.75 30.70 1nhn h GLU 63 CO 0.10 -0.72 -0.12 -0.22 -0.73 0.00 0.00 179.01 177.32 1nhn h LYS 64 N -1.12 -0.07 -0.29 1.92 3.64 -1.35 -2.52 116.57 116.78 1nhn h LYS 64 Ca -0.11 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.30 1nhn h LYS 64 Cb 0.86 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.65 1nhn h LYS 64 CO 0.18 -0.05 -0.28 -0.92 -2.27 0.00 0.00 179.45 176.11 1nhn h TYR 65 N -0.07 -0.88 -1.76 1.91 3.20 -1.15 0.18 116.97 118.39 1nhn h TYR 65 Ca 0.14 0.05 0.53 0.00 3.14 0.00 0.00 58.73 62.59 1nhn h TYR 65 Cb 0.29 0.42 -0.09 0.00 1.54 0.00 0.00 36.73 38.89 1nhn h TYR 65 CO -0.31 -0.23 1.23 0.93 -1.64 0.00 0.00 178.16 178.15 1nhn h GLU 66 N -0.14 0.01 0.05 1.82 5.08 -0.69 0.37 114.58 121.09 1nhn h GLU 66 Ca 0.05 -0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.23 1nhn h GLU 66 Cb 0.27 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1nhn h GLU 66 CO -0.35 0.01 -0.94 0.87 -1.00 0.00 0.00 179.01 177.60 1nhn h LYS 67 N 0.01 0.11 -0.05 2.33 6.56 -0.63 -2.92 116.57 121.98 1nhn h LYS 67 Ca 0.90 -0.19 0.01 0.00 -1.06 0.00 0.00 60.65 60.31 1nhn h LYS 67 Cb 3.40 0.07 -0.00 0.00 -0.57 0.00 0.00 32.23 35.13 1nhn h LYS 67 CO -0.14 1.09 0.04 0.22 -2.06 0.00 0.00 179.45 178.60 1nhn h ASP 68 N -0.70 0.00 -0.01 0.86 3.58 0.18 0.97 116.42 121.29 1nhn h ASP 68 Ca -0.22 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.20 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 -0.03 0.00 -0.09 -0.29 -2.88 0.00 0.00 179.24 175.95 1nhn h ILE 69 N 0.00 1.52 -0.59 2.25 -0.00 -0.50 -0.03 117.51 120.16 1nhn h ILE 69 Ca 0.02 -1.67 0.16 0.00 -0.00 0.00 0.00 64.86 63.37 1nhn h ILE 69 Cb 0.11 2.60 -0.03 0.00 -0.00 0.00 0.00 36.82 39.50 1nhn h ILE 69 CO -0.00 0.45 0.42 0.00 -0.00 0.00 0.00 178.15 179.01 1nhn h ALA 70 N 0.33 2.48 0.00 0.18 0.00 -0.83 0.15 119.26 121.56 1nhn h ALA 70 Ca -0.01 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1nhn h ALA 70 Cb 0.78 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1nhn h ALA 70 CO 0.02 -0.65 -0.64 0.00 0.00 0.00 0.00 179.25 177.98 1nhn h ALA 71 N 1.71 0.72 0.15 0.00 0.00 -0.61 -2.77 119.26 118.46 1nhn h ALA 71 Ca 0.28 -0.30 -0.30 0.00 0.00 0.00 0.00 54.91 54.58 1nhn h ALA 71 Cb 1.04 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1nhn h ALA 71 CO -0.02 0.37 -1.53 -0.92 0.00 0.00 0.00 179.25 177.16 1nhn h TYR 72 N 0.00 0.57 -0.30 0.00 3.20 0.11 -3.36 116.97 117.20 1nhn h TYR 72 Ca -0.03 -0.42 -0.06 0.00 3.14 0.00 0.00 58.73 61.36 1nhn h TYR 72 Cb 1.23 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 39.47 1nhn h TYR 72 CO 0.00 1.60 -0.04 -0.09 -1.64 0.00 0.00 178.16 177.98 1nhn h ARG 73 N -0.13 0.57 -0.43 1.82 2.43 -1.02 -3.28 114.38 114.34 1nhn h ARG 73 Ca -0.31 -0.20 0.17 0.00 -0.81 0.00 0.00 59.98 58.82 1nhn h ARG 73 Cb 1.90 -0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 31.35 1nhn h ARG 73 CO 0.12 0.74 0.25 0.00 -1.51 0.00 0.00 179.97 179.56 1nhn n ALA 74 N -2.39 0.44 -1.63 2.80 0.00 -1.04 -4.45 120.51 114.23 1nhn n ALA 74 Ca -0.03 0.37 -0.31 0.00 0.00 0.00 0.00 53.44 53.48 1nhn n ALA 74 Cb 0.30 -0.40 0.05 0.00 0.00 0.00 0.00 19.45 19.40 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 -4.47 2.91 0.00 0.00 2.20 -1.24 -4.14 119.74 115.00 1nhn s LYS 75 Ca -0.03 0.86 0.00 0.00 -0.36 0.00 0.00 55.97 56.43 1nhn s LYS 75 Cb 0.13 -1.99 0.00 0.00 -1.51 0.00 0.00 37.83 34.45 1nhn s LYS 75 CO 0.30 -1.09 0.00 0.41 -0.36 0.00 0.00 175.35 174.61 1nhn n GLY 76 N -2.16 1.95 0.43 5.54 0.00 -1.26 -4.92 105.19 104.75 1nhn n GLY 76 Ca 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.12 0.29 -0.21 1.61 5.02 -1.26 -4.48 118.16 118.02 1nhn n LYS 77 Ca 0.00 0.12 -0.00 0.00 -2.02 0.00 0.00 58.31 56.41 1nhn n LYS 77 Cb 0.00 -0.99 0.11 0.00 -0.02 0.00 0.00 35.03 34.13 1nhn n LYS 77 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1nhn h PRO 78 N -0.55 0.44 -1.89 1.97 0.13 -1.92 -3.33 132.00 126.85 1nhn h PRO 78 Ca 0.00 -0.03 -0.40 0.00 -0.87 0.00 0.00 66.00 64.70 1nhn h PRO 78 Cb 0.55 -0.10 -0.30 0.00 0.13 0.00 0.00 31.00 31.28 1nhn h PRO 78 CO 0.00 0.29 -0.74 0.34 -0.23 0.00 0.00 178.00 177.66 1nhn s ASP 79 N -5.42 0.71 -0.21 1.44 -1.08 -1.26 -4.97 116.67 105.88 1nhn s ASP 79 Ca -0.13 -2.12 0.12 0.00 -0.52 0.00 0.00 52.55 49.90 1nhn s ASP 79 Cb 0.17 0.51 0.42 0.00 -1.46 0.00 0.00 42.92 42.55 1nhn s ASP 79 CO 0.75 -0.19 1.23 0.00 0.52 0.00 0.00 175.17 177.48 1nhn n ALA 80 N 3.50 3.60 -0.79 3.66 0.00 -1.25 -4.80 120.51 124.42 1nhn n ALA 80 Ca 0.19 -3.24 0.00 0.00 0.00 0.00 0.00 53.44 50.39 1nhn n ALA 80 Cb 0.48 -0.38 0.00 0.00 0.00 0.00 0.00 19.45 19.55 1nhn n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50