#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hma n ASP 3 N 0.00 0.00 -4.77 6.43 9.92 -1.26 -4.61 116.55 122.26 1hma n ASP 3 Ca 0.00 0.00 -0.38 0.00 -0.53 0.00 0.00 54.79 53.88 1hma n ASP 3 Cb 0.00 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.45 1hma n ASP 3 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1hma s LYS 4 N 0.00 4.16 0.86 -1.24 2.20 -1.26 -4.02 119.74 120.44 1hma s LYS 4 Ca 0.00 1.78 -0.12 0.00 -0.36 0.00 0.00 55.97 57.27 1hma s LYS 4 Cb 0.00 -2.73 0.11 0.00 -1.51 0.00 0.00 37.83 33.70 1hma s LYS 4 CO 0.00 -0.21 1.13 -1.25 -0.36 0.00 0.00 175.35 174.66 1hma s PRO 5 N -2.21 1.55 -1.12 4.03 0.04 -1.26 -4.90 135.00 131.13 1hma s PRO 5 Ca 0.55 0.37 -0.23 0.00 0.04 0.00 0.00 61.00 61.73 1hma s PRO 5 Cb -0.29 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 1hma s PRO 5 CO 0.37 -1.93 1.87 0.15 0.04 0.00 0.00 177.00 177.50 1hma s LYS 6 N -5.29 2.81 0.00 4.56 -0.14 -1.26 -4.85 119.74 115.57 1hma s LYS 6 Ca 0.63 -1.06 0.00 0.00 -1.36 0.00 0.00 55.97 54.18 1hma s LYS 6 Cb -0.14 -5.25 0.00 0.00 -1.68 0.00 0.00 37.83 30.76 1hma s LYS 6 CO 0.53 -3.45 0.00 0.54 -0.76 0.00 0.00 175.35 172.21 1hma n ARG 7 N 8.49 0.00 -2.75 1.68 1.74 -1.26 -4.82 116.66 119.74 1hma n ARG 7 Ca 0.43 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 57.14 1hma n ARG 7 Cb 0.47 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.85 1hma n ARG 7 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1hma s PRO 8 N 0.00 4.59 0.00 5.56 0.04 -1.26 -5.03 135.00 138.90 1hma s PRO 8 Ca 0.00 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.42 1hma s PRO 8 Cb 0.00 -2.86 0.00 0.00 0.04 0.00 0.00 34.50 31.68 1hma s PRO 8 CO 0.00 0.28 0.00 1.47 0.04 0.00 0.00 177.00 178.79 1hma n LEU 9 N 0.66 0.00 -4.72 -3.56 -0.00 -1.26 -5.13 117.00 102.98 1hma n LEU 9 Ca 0.02 0.00 -0.35 0.00 -0.00 0.00 0.00 56.01 55.67 1hma n LEU 9 Cb 0.49 0.00 0.09 0.00 -0.00 0.00 0.00 43.42 44.01 1hma n LEU 9 CO 0.45 0.00 0.84 -0.55 -0.00 0.00 0.00 177.39 178.13 1hma s SER 10 N -0.99 4.21 0.02 1.45 0.15 -1.26 -4.83 113.70 112.45 1hma s SER 10 Ca 0.00 2.47 -0.26 0.00 0.70 0.00 0.00 55.95 58.87 1hma s SER 10 Cb 0.00 -2.60 -0.17 0.00 -1.71 0.00 0.00 66.02 61.54 1hma s SER 10 CO 0.00 -2.26 1.38 0.00 1.20 0.00 0.00 173.24 173.56 1hma h ALA 11 N -0.09 -0.30 -1.34 5.45 0.00 -1.91 -2.31 119.26 118.76 1hma h ALA 11 Ca -0.49 -0.16 0.39 0.00 0.00 0.00 0.00 54.91 54.65 1hma h ALA 11 Cb 1.31 0.11 -0.07 0.00 0.00 0.00 0.00 17.79 19.15 1hma h ALA 11 CO 0.50 -0.53 0.94 -0.92 0.00 0.00 0.00 179.25 179.24 1hma h TYR 12 N -0.57 0.12 -0.15 0.00 3.20 -1.92 0.69 116.97 118.34 1hma h TYR 12 Ca -0.03 0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.74 1hma h TYR 12 Cb 0.42 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.66 1hma h TYR 12 CO 0.01 -0.01 -0.31 0.52 -1.64 0.00 0.00 178.16 176.73 1hma h MET 13 N 0.05 0.48 -0.18 1.82 0.00 -1.79 -2.21 114.93 113.10 1hma h MET 13 Ca 0.66 -0.31 0.05 0.00 0.00 0.00 0.00 59.70 60.11 1hma h MET 13 Cb 2.50 0.04 -0.06 0.00 0.00 0.00 0.00 31.60 34.08 1hma h MET 13 CO -0.08 0.92 -0.26 -0.07 0.00 0.00 0.00 176.91 177.43 1hma h LEU 14 N 0.10 -0.80 -1.88 1.22 3.38 0.73 0.52 115.31 118.57 1hma h LEU 14 Ca 0.00 0.13 0.06 0.00 0.09 0.00 0.00 57.88 58.17 1hma h LEU 14 Cb 0.90 0.36 -0.02 0.00 0.09 0.00 0.00 40.66 42.00 1hma h LEU 14 CO 0.07 -0.30 0.22 -0.25 0.09 0.00 0.00 178.44 178.27 1hma h TRP 15 N -0.30 0.15 0.91 1.13 7.01 -1.49 -0.39 115.95 122.97 1hma h TRP 15 Ca 0.11 0.00 -0.04 0.00 2.11 0.00 0.00 58.89 61.07 1hma h TRP 15 Cb 0.47 -0.05 0.01 0.00 -2.10 0.00 0.00 29.16 27.49 1hma h TRP 15 CO -0.38 0.08 -0.44 1.25 -2.79 0.00 0.00 178.44 176.17 1hma h LEU 16 N 0.15 -1.03 -1.74 0.65 7.12 0.63 -1.04 115.31 120.05 1hma h LEU 16 Ca 0.14 0.03 0.00 0.00 0.13 0.00 0.00 57.88 58.19 1hma h LEU 16 Cb 0.38 0.27 0.00 0.00 -0.53 0.00 0.00 40.66 40.77 1hma h LEU 16 CO -0.02 -0.69 0.00 -0.55 -0.13 0.00 0.00 178.44 177.05 1hma h ASN 17 N -1.32 0.00 1.40 1.25 7.08 -0.79 0.12 115.58 123.33 1hma h ASN 17 Ca -0.12 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.10 1hma h ASN 17 Cb 0.94 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.18 1hma h ASN 17 CO 0.20 0.00 -0.14 0.77 -2.08 0.00 0.00 177.43 176.18 1hma h SER 18 N 0.00 0.00 -0.02 6.14 4.64 -0.76 -3.23 113.55 120.31 1hma h SER 18 Ca 0.00 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1hma h SER 18 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1hma h SER 18 CO 0.00 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.98 1hma n ALA 19 N -1.84 2.42 0.26 5.18 0.00 -0.42 -4.59 120.51 121.51 1hma n ALA 19 Ca 0.05 -0.62 0.03 0.00 0.00 0.00 0.00 53.44 52.90 1hma n ALA 19 Cb 0.45 -0.12 0.15 0.00 0.00 0.00 0.00 19.45 19.93 1hma n ALA 19 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1hma n ARG 20 N 0.12 0.04 0.00 0.00 0.63 0.30 -1.57 116.66 116.19 1hma n ARG 20 Ca 0.02 0.31 0.00 0.00 -0.92 0.00 0.00 57.85 57.27 1hma n ARG 20 Cb 0.12 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.53 1hma n ARG 20 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1hma n GLU 21 N -1.40 0.00 0.19 -0.14 0.00 -1.26 -1.38 120.64 116.65 1hma n GLU 21 Ca 0.02 0.41 0.13 0.00 0.00 0.00 0.00 57.16 57.72 1hma n GLU 21 Cb 0.06 -0.93 0.68 0.00 0.00 0.00 0.00 31.44 31.25 1hma n GLU 21 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 1hma h SER 22 N 0.00 0.00 0.09 4.31 0.87 -1.90 -1.74 113.55 115.18 1hma h SER 22 Ca 0.00 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.40 1hma h SER 22 Cb 0.00 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 61.97 1hma h SER 22 CO 0.00 0.00 -0.73 0.40 -0.53 0.00 0.00 176.83 175.97 1hma h ILE 23 N 0.00 1.48 0.00 2.23 2.04 -1.38 -2.99 117.51 118.89 1hma h ILE 23 Ca 0.00 -2.45 0.00 0.00 1.00 0.00 0.00 64.86 63.41 1hma h ILE 23 Cb 0.05 3.13 0.00 0.00 -0.74 0.00 0.00 36.82 39.25 1hma h ILE 23 CO 0.00 0.67 0.00 0.07 0.00 0.00 0.00 178.15 178.89 1hma h LYS 24 N -0.55 0.00 0.00 2.37 2.10 -0.33 -2.26 116.57 117.89 1hma h LYS 24 Ca -0.14 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.51 1hma h LYS 24 Cb 1.48 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.81 1hma h LYS 24 CO 0.08 0.00 0.00 0.54 -2.00 0.00 0.00 179.45 178.07 1hma n ARG 25 N -2.67 0.00 -0.18 0.07 1.74 -0.95 -3.91 116.66 110.76 1hma n ARG 25 Ca -0.00 0.35 0.29 0.00 -0.77 0.00 0.00 57.85 57.72 1hma n ARG 25 Cb 0.18 -0.84 0.66 0.00 -1.02 0.00 0.00 32.46 31.45 1hma n ARG 25 CO 0.00 0.00 0.00 1.05 -1.52 0.00 0.00 177.63 177.16 1hma h GLU 26 N 0.00 0.00 -6.16 5.56 4.11 -1.59 -3.39 114.58 113.11 1hma h GLU 26 Ca 0.00 0.00 -0.57 0.00 0.07 0.00 0.00 59.36 58.86 1hma h GLU 26 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1hma h GLU 26 CO 0.00 0.00 -0.34 -0.80 0.07 0.00 0.00 179.01 177.94 1hma s ASN 27 N -4.58 6.45 -1.27 3.06 0.01 -0.85 -4.99 114.94 112.77 1hma s ASN 27 Ca -0.04 0.51 -0.17 0.00 -0.71 0.00 0.00 52.86 52.45 1hma s ASN 27 Cb 0.18 -2.06 -0.01 0.00 0.41 0.00 0.00 41.25 39.77 1hma s ASN 27 CO 0.62 0.04 2.10 -0.81 -1.51 0.00 0.00 177.10 177.53 1hma n PRO 28 N -0.11 2.52 -2.23 -0.60 -0.04 -1.26 -4.36 135.00 128.92 1hma n PRO 28 Ca -0.03 -2.48 -0.06 0.00 -0.04 0.00 0.00 63.50 60.89 1hma n PRO 28 Cb 0.52 -3.24 -0.01 0.00 -0.04 0.00 0.00 33.50 30.74 1hma n PRO 28 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1hma n GLY 29 N 4.40 -0.31 2.73 0.55 0.00 -1.25 -4.75 105.19 106.55 1hma n GLY 29 Ca 0.51 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.20 1hma n GLY 29 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1hma n ILE 30 N -2.63 0.00 -1.52 -0.61 3.06 -1.26 -4.86 119.36 111.54 1hma n ILE 30 Ca -0.07 -0.43 -0.32 0.00 -2.50 0.00 0.00 62.75 59.44 1hma n ILE 30 Cb 0.48 0.00 0.07 0.00 0.54 0.00 0.00 39.64 40.73 1hma n ILE 30 CO 0.00 0.00 0.00 -0.54 -2.50 0.00 0.00 176.55 173.51 1hma s LYS 31 N -1.08 2.59 0.48 9.51 1.02 -1.26 -4.81 119.74 126.19 1hma s LYS 31 Ca 0.45 1.22 0.16 0.00 0.02 0.00 0.00 55.97 57.82 1hma s LYS 31 Cb -0.36 -1.94 1.15 0.00 -0.52 0.00 0.00 37.83 36.17 1hma s LYS 31 CO 0.60 -1.39 2.07 -0.24 -0.92 0.00 0.00 175.35 175.47 1hma h VAL 32 N -0.58 1.04 -0.10 3.17 3.04 -1.98 0.24 116.25 121.07 1hma h VAL 32 Ca -0.45 -0.35 -0.02 0.00 -1.01 0.00 0.00 66.70 64.87 1hma h VAL 32 Cb 1.23 1.19 -0.00 0.00 -2.01 0.00 0.00 31.29 31.70 1hma h VAL 32 CO 0.53 0.10 -0.01 0.74 -1.01 0.00 0.00 177.57 177.92 1hma h THR 33 N 0.00 1.27 0.00 3.17 2.02 -2.01 -2.76 112.91 114.59 1hma h THR 33 Ca -0.00 -0.87 0.00 0.00 0.77 0.00 0.00 66.41 66.31 1hma h THR 33 Cb 0.18 1.65 0.00 0.00 -1.74 0.00 0.00 68.15 68.25 1hma h THR 33 CO 0.01 0.25 0.00 -0.33 0.37 0.00 0.00 175.52 175.82 1hma h GLU 34 N -0.12 0.00 -0.01 6.66 4.39 -1.83 -3.05 114.58 120.61 1hma h GLU 34 Ca 0.03 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.64 1hma h GLU 34 Cb 0.39 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 1hma h GLU 34 CO 0.01 0.00 -0.39 0.28 -1.16 0.00 0.00 179.01 177.75 1hma h VAL 35 N 0.00 1.28 0.00 3.13 2.07 -0.66 -2.59 116.25 119.48 1hma h VAL 35 Ca 0.00 -1.35 -0.12 0.00 0.82 0.00 0.00 66.70 66.05 1hma h VAL 35 Cb 0.65 1.71 -0.02 0.00 -1.52 0.00 0.00 31.29 32.12 1hma h VAL 35 CO 0.00 0.39 -0.71 0.00 0.02 0.00 0.00 177.57 177.27 1hma h ALA 36 N 1.59 0.65 0.19 1.67 0.00 -1.45 -1.96 119.26 119.95 1hma h ALA 36 Ca -0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 1hma h ALA 36 Cb 0.70 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1hma h ALA 36 CO 0.05 0.70 -0.11 -0.22 0.00 0.00 0.00 179.25 179.67 1hma h LYS 37 N 0.00 -0.27 0.00 0.00 1.63 -1.51 -2.10 116.57 114.32 1hma h LYS 37 Ca -0.04 0.02 -0.04 0.00 -0.85 0.00 0.00 60.65 59.74 1hma h LYS 37 Cb 1.43 0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 33.12 1hma h LYS 37 CO 0.06 -0.18 -0.54 -0.09 -3.45 0.00 0.00 179.45 175.25 1hma h ARG 38 N -0.28 0.00 0.00 1.90 9.65 -1.65 -3.25 114.38 120.74 1hma h ARG 38 Ca -0.02 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.83 1hma h ARG 38 Cb 0.23 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.81 1hma h ARG 38 CO 0.03 0.15 -0.12 0.78 2.80 0.00 0.00 179.97 183.61 1hma h GLY 39 N 3.85 0.00 2.00 2.80 0.00 -1.08 -2.20 103.07 108.44 1hma h GLY 39 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.25 1hma h GLY 39 CO 0.02 0.00 -0.29 -1.33 0.00 0.00 0.00 176.54 174.94 1hma h GLY 40 N 1.37 0.00 1.20 4.60 0.00 -1.42 -1.91 103.07 106.91 1hma h GLY 40 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 1hma h GLY 40 CO 0.02 0.00 -0.04 1.05 0.00 0.00 0.00 176.54 177.56 1hma h GLU 41 N 0.00 0.96 0.03 4.80 4.11 -1.56 -2.60 114.58 120.32 1hma h GLU 41 Ca -0.00 -0.31 -0.28 0.00 0.07 0.00 0.00 59.36 58.84 1hma h GLU 41 Cb 1.01 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 30.14 1hma h GLU 41 CO 0.04 0.97 -1.54 -0.07 0.07 0.00 0.00 179.01 178.47 1hma h LEU 42 N 0.87 0.10 0.39 3.06 3.38 -1.64 -3.22 115.31 118.26 1hma h LEU 42 Ca 0.15 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1hma h LEU 42 Cb 0.57 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1hma h LEU 42 CO 0.03 1.15 -0.27 -0.25 0.09 0.00 0.00 178.44 179.19 1hma h TRP 43 N 0.02 -0.72 0.00 1.13 2.91 -1.27 2.42 115.95 120.44 1hma h TRP 43 Ca -0.23 -0.00 -0.04 0.00 1.13 0.00 0.00 58.89 59.75 1hma h TRP 43 Cb 1.96 0.27 -0.01 0.00 -0.51 0.00 0.00 29.16 30.87 1hma h TRP 43 CO 0.02 -0.41 -0.20 0.00 -1.03 0.00 0.00 178.44 176.82 1hma h ARG 44 N -0.65 0.00 -0.44 2.65 3.08 -1.63 -2.46 114.38 114.94 1hma h ARG 44 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1hma h ARG 44 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.60 1hma h ARG 44 CO 0.02 0.20 0.00 0.00 -1.07 0.00 0.00 179.97 179.11 1hma n ALA 45 N -2.38 2.44 -1.00 0.04 0.00 -0.89 -4.85 120.51 113.87 1hma n ALA 45 Ca -0.02 -1.39 0.00 0.00 0.00 0.00 0.00 53.44 52.03 1hma n ALA 45 Cb 0.28 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 19.10 1hma n ALA 45 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1hma n MET 46 N 0.64 0.00 0.00 0.00 0.00 0.81 -4.97 117.12 113.60 1hma n MET 46 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.87 1hma n MET 46 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.80 1hma n MET 46 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1hma n LYS 47 N 0.00 0.00 -3.74 2.12 4.81 -1.26 -5.07 118.16 115.02 1hma n LYS 47 Ca 0.00 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.31 1hma n LYS 47 Cb 0.00 0.00 -0.09 0.00 0.02 0.00 0.00 35.03 34.96 1hma n LYS 47 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1hma s ASP 48 N 0.47 -0.30 0.17 3.14 1.11 -1.26 -5.03 116.67 114.98 1hma s ASP 48 Ca 0.00 0.41 0.26 0.00 0.18 0.00 0.00 52.55 53.40 1hma s ASP 48 Cb 0.00 0.52 0.76 0.00 1.07 0.00 0.00 42.92 45.27 1hma s ASP 48 CO 0.00 -0.32 1.70 0.29 1.18 0.00 0.00 175.17 178.02 1hma n LYS 49 N 1.94 0.24 0.27 8.23 4.01 -1.26 -3.18 118.16 128.41 1hma n LYS 49 Ca -0.18 0.17 0.17 0.00 -0.51 0.00 0.00 58.31 57.97 1hma n LYS 49 Cb 0.57 -1.75 0.72 0.00 -0.51 0.00 0.00 35.03 34.05 1hma n LYS 49 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 1hma h SER 50 N 0.00 0.00 0.04 4.39 0.87 -1.98 -1.11 113.55 115.76 1hma h SER 50 Ca 0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1hma h SER 50 Cb 0.72 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 1hma h SER 50 CO 0.00 0.00 -0.02 -0.08 -0.53 0.00 0.00 176.83 176.20 1hma h GLU 51 N 0.00 -0.05 0.20 2.24 4.81 -1.98 -2.86 114.58 116.94 1hma h GLU 51 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1hma h GLU 51 Cb 0.46 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1hma h GLU 51 CO 0.00 -0.03 -0.10 -1.49 -0.73 0.00 0.00 179.01 176.65 1hma h TRP 52 N -0.07 -0.27 -0.35 0.92 4.06 -1.77 -2.75 115.95 115.73 1hma h TRP 52 Ca -0.01 -0.01 0.03 0.00 2.06 0.00 0.00 58.89 60.97 1hma h TRP 52 Cb 0.04 0.09 -0.04 0.00 -1.00 0.00 0.00 29.16 28.25 1hma h TRP 52 CO 0.16 -0.17 -0.21 0.39 -3.56 0.00 0.00 178.44 175.05 1hma n GLU 53 N -5.22 -0.16 -0.30 0.49 -0.58 -0.42 0.24 120.64 114.70 1hma n GLU 53 Ca -0.09 0.81 0.01 0.00 -0.42 0.00 0.00 57.16 57.47 1hma n GLU 53 Cb 0.14 -1.19 0.14 0.00 -0.57 0.00 0.00 31.44 29.96 1hma n GLU 53 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1hma h ALA 54 N -0.10 1.17 -0.88 0.62 0.00 -1.44 -0.64 119.26 117.98 1hma h ALA 54 Ca 0.06 -0.00 0.16 0.00 0.00 0.00 0.00 54.91 55.12 1hma h ALA 54 Cb 0.14 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 17.65 1hma h ALA 54 CO -0.33 0.25 0.57 -0.22 0.00 0.00 0.00 179.25 179.52 1hma h LYS 55 N 0.94 0.58 -0.08 0.00 3.64 0.35 -1.20 116.57 120.80 1hma h LYS 55 Ca 0.37 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.71 1hma h LYS 55 Cb 0.19 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1hma h LYS 55 CO -0.18 0.39 0.03 0.00 -2.27 0.00 0.00 179.45 177.42 1hma h ALA 56 N 1.61 0.10 -0.16 5.00 0.00 0.92 -1.87 119.26 124.86 1hma h ALA 56 Ca 0.45 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.31 1hma h ALA 56 Cb 0.83 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 1hma h ALA 56 CO -0.20 -0.31 -0.09 0.00 0.00 0.00 0.00 179.25 178.65 1hma h ALA 57 N 0.88 0.04 -0.51 0.00 0.00 -1.15 -0.80 119.26 117.71 1hma h ALA 57 Ca 0.03 0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.10 1hma h ALA 57 Cb 0.16 0.22 -0.09 0.00 0.00 0.00 0.00 17.79 18.08 1hma h ALA 57 CO -0.00 -0.53 -0.00 -0.22 0.00 0.00 0.00 179.25 178.49 1hma h LYS 58 N -0.09 0.11 -0.44 0.00 1.63 -1.20 0.48 116.57 117.06 1hma h LYS 58 Ca 0.09 -0.01 0.04 0.00 -0.85 0.00 0.00 60.65 59.93 1hma h LYS 58 Cb 0.23 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.81 1hma h LYS 58 CO -0.22 0.07 0.30 0.00 -3.45 0.00 0.00 179.45 176.15 1hma h ALA 59 N 1.46 1.87 0.47 5.00 0.00 -0.49 -1.74 119.26 125.84 1hma h ALA 59 Ca 0.26 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1hma h ALA 59 Cb 0.40 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1hma h ALA 59 CO -0.44 0.07 -0.35 -0.22 0.00 0.00 0.00 179.25 178.31 1hma h LYS 60 N 0.44 -0.78 -0.04 0.00 3.64 0.13 0.96 116.57 120.91 1hma h LYS 60 Ca 0.18 0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.64 1hma h LYS 60 Cb 0.19 0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 1hma h LYS 60 CO -0.05 -0.52 -0.10 0.22 -2.27 0.00 0.00 179.45 176.73 1hma h ASP 61 N -0.81 -0.31 0.49 4.20 1.82 -0.76 0.91 116.42 121.95 1hma h ASP 61 Ca -0.05 0.05 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1hma h ASP 61 Cb 0.69 0.14 0.00 0.00 0.68 0.00 0.00 39.33 40.84 1hma h ASP 61 CO 0.01 -0.15 0.00 0.47 -1.61 0.00 0.00 179.24 177.96 1hma n ASP 62 N -5.24 0.09 0.01 2.28 8.00 -0.71 -2.58 116.55 118.40 1hma n ASP 62 Ca -0.05 0.52 -0.15 0.00 0.71 0.00 0.00 54.79 55.83 1hma n ASP 62 Cb 0.16 -0.54 -0.14 0.00 -0.02 0.00 0.00 41.12 40.58 1hma n ASP 62 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1hma h TYR 63 N 0.00 0.28 -0.11 1.24 5.03 0.33 -2.12 116.97 121.61 1hma h TYR 63 Ca 0.00 -0.20 -0.19 0.00 2.58 0.00 0.00 58.73 60.92 1hma h TYR 63 Cb 0.24 -0.01 0.01 0.00 1.55 0.00 0.00 36.73 38.52 1hma h TYR 63 CO 0.00 1.38 -0.68 0.22 -1.32 0.00 0.00 178.16 177.76 1hma h ASP 64 N 0.04 0.79 0.42 -2.11 3.58 -0.84 -1.52 116.42 116.78 1hma h ASP 64 Ca -0.33 -0.65 -0.24 0.00 0.42 0.00 0.00 57.03 56.23 1hma h ASP 64 Cb 2.02 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 42.84 1hma h ASP 64 CO 0.10 1.31 -1.05 -0.09 -2.88 0.00 0.00 179.24 176.63 1hma h ARG 65 N 0.31 0.38 0.00 0.28 2.43 -1.67 -3.26 114.38 112.84 1hma h ARG 65 Ca -0.05 -0.47 -0.03 0.00 -0.81 0.00 0.00 59.98 58.61 1hma h ARG 65 Cb 1.32 0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 31.02 1hma h ARG 65 CO 0.14 1.15 -0.16 0.00 -1.51 0.00 0.00 179.97 179.60 1hma h ALA 66 N 0.67 0.92 -0.07 2.80 0.00 -1.42 -3.16 119.26 119.00 1hma h ALA 66 Ca -0.10 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 1hma h ALA 66 Cb 1.72 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 1hma h ALA 66 CO 0.18 0.20 -0.31 -0.39 0.00 0.00 0.00 179.25 178.93 1hma h VAL 67 N 0.00 1.25 0.36 0.00 -1.51 -1.31 0.24 116.25 115.28 1hma h VAL 67 Ca -0.00 -1.18 -0.02 0.00 -1.23 0.00 0.00 66.70 64.27 1hma h VAL 67 Cb 0.98 1.54 0.00 0.00 -2.13 0.00 0.00 31.29 31.68 1hma h VAL 67 CO 0.02 0.35 -0.17 0.50 -1.23 0.00 0.00 177.57 177.04 1hma h LYS 68 N 0.12 -0.47 -0.41 5.19 3.64 -1.67 1.11 116.57 124.08 1hma h LYS 68 Ca 0.02 0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.47 1hma h LYS 68 Cb 0.61 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.51 1hma h LYS 68 CO 0.04 -0.15 0.27 0.93 -2.27 0.00 0.00 179.45 178.28 1hma h GLU 69 N -0.91 0.35 -0.06 1.90 4.39 -1.61 0.29 114.58 118.93 1hma h GLU 69 Ca -0.05 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.51 1hma h GLU 69 Cb 0.53 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.09 1hma h GLU 69 CO 0.08 0.23 -0.50 0.35 -1.16 0.00 0.00 179.01 178.02 1hma h PHE 70 N 0.36 0.18 0.00 4.33 3.57 -0.23 -2.09 116.94 123.07 1hma h PHE 70 Ca 0.17 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.61 1hma h PHE 70 Cb 0.23 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.94 1hma h PHE 70 CO -0.00 0.62 -0.47 0.39 -2.23 0.00 0.00 178.31 176.61 1hma n GLU 71 N -3.95 0.23 0.08 1.11 -0.58 0.38 -3.56 120.64 114.35 1hma n GLU 71 Ca -0.02 0.09 0.02 0.00 -0.42 0.00 0.00 57.16 56.84 1hma n GLU 71 Cb 0.53 -1.67 -0.04 0.00 -0.57 0.00 0.00 31.44 29.69 1hma n GLU 71 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1hma h ALA 72 N 2.60 0.65 -1.50 0.62 0.00 -0.17 -3.47 119.26 118.00 1hma h ALA 72 Ca 0.00 -0.61 -0.45 0.00 0.00 0.00 0.00 54.91 53.85 1hma h ALA 72 Cb 0.70 0.14 0.05 0.00 0.00 0.00 0.00 17.79 18.67 1hma h ALA 72 CO 0.00 0.70 -0.04 -0.80 0.00 0.00 0.00 179.25 179.10 1hma s ASN 73 N -5.93 5.08 0.00 0.00 0.01 -0.83 -5.08 114.94 108.19 1hma s ASN 73 Ca -0.00 -0.29 0.00 0.00 -0.71 0.00 0.00 52.86 51.86 1hma s ASN 73 Cb 0.08 -0.45 0.00 0.00 0.41 0.00 0.00 41.25 41.29 1hma s ASN 73 CO 0.79 -1.29 0.00 0.61 -1.51 0.00 0.00 177.10 175.69