#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hma s ASP 3 N 0.00 6.09 0.43 -3.46 1.01 -1.26 -5.09 116.67 114.39 1hma s ASP 3 Ca 0.00 0.31 -0.07 0.00 0.71 0.00 0.00 52.55 53.50 1hma s ASP 3 Cb 0.00 -1.99 -0.05 0.00 1.01 0.00 0.00 42.92 41.89 1hma s ASP 3 CO 0.00 0.31 0.76 -0.75 0.21 0.00 0.00 175.17 175.70 1hma s LYS 4 N -0.43 3.64 0.80 8.23 2.20 -1.26 -4.90 119.74 128.01 1hma s LYS 4 Ca 0.11 0.28 -0.12 0.00 -0.36 0.00 0.00 55.97 55.88 1hma s LYS 4 Cb -0.12 -2.41 0.07 0.00 -1.51 0.00 0.00 37.83 33.86 1hma s LYS 4 CO 0.02 -0.10 1.11 -1.25 -0.36 0.00 0.00 175.35 174.76 1hma s PRO 5 N -4.30 2.08 -1.19 4.03 0.04 -1.26 -4.91 135.00 129.49 1hma s PRO 5 Ca 0.48 0.52 -0.21 0.00 0.04 0.00 0.00 61.00 61.83 1hma s PRO 5 Cb -0.10 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 1hma s PRO 5 CO 0.38 -1.60 1.85 -1.59 0.04 0.00 0.00 177.00 176.09 1hma s LYS 6 N -5.24 3.01 -0.27 4.56 0.00 -1.26 -4.90 119.74 115.64 1hma s LYS 6 Ca 0.61 -1.34 -0.26 0.00 0.00 0.00 0.00 55.97 54.97 1hma s LYS 6 Cb -0.14 -5.32 -0.11 0.00 0.00 0.00 0.00 37.83 32.26 1hma s LYS 6 CO 0.53 -3.32 0.89 0.54 0.00 0.00 0.00 175.35 173.99 1hma n ARG 7 N 8.40 0.00 -2.64 1.78 1.74 -1.26 -4.85 116.66 119.83 1hma n ARG 7 Ca 0.45 0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 57.13 1hma n ARG 7 Cb 0.47 -0.84 -0.05 0.00 -1.02 0.00 0.00 32.46 31.02 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 1.63 4.74 0.28 5.56 0.04 -1.26 -5.05 135.00 140.94 1hma s PRO 8 Ca 0.59 1.61 -0.13 0.00 0.04 0.00 0.00 61.00 63.10 1hma s PRO 8 Cb -0.84 -3.26 0.01 0.00 0.04 0.00 0.00 34.50 30.45 1hma s PRO 8 CO 0.46 0.34 0.56 -0.48 0.04 0.00 0.00 177.00 177.91 1hma s LEU 9 N -1.02 0.28 0.87 -3.56 0.05 -1.26 -5.15 118.68 108.89 1hma s LEU 9 Ca 0.44 -0.97 -0.13 0.00 0.05 0.00 0.00 54.13 53.51 1hma s LEU 9 Cb -0.28 2.02 0.04 0.00 -2.05 0.00 0.00 46.19 45.92 1hma s LEU 9 CO 0.35 -1.26 0.66 -0.24 -0.55 0.00 0.00 176.35 175.30 1hma n SER 10 N -0.65 -1.07 -0.23 1.48 2.88 -1.26 -4.78 113.62 109.99 1hma n SER 10 Ca -0.02 0.44 -0.06 0.00 -1.33 0.00 0.00 58.87 57.89 1hma n SER 10 Cb 0.61 -1.29 0.04 0.00 -0.75 0.00 0.00 64.21 62.82 1hma n SER 10 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1hma h ALA 11 N -1.23 0.81 -0.34 -1.46 0.00 -1.93 0.04 119.26 115.16 1hma h ALA 11 Ca -0.44 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 54.46 1hma h ALA 11 Cb 1.30 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1hma h ALA 11 CO 0.39 0.33 0.39 -0.92 0.00 0.00 0.00 179.25 179.43 1hma h TYR 12 N 0.86 0.00 -0.01 0.00 3.20 -1.94 0.15 116.97 119.22 1hma h TYR 12 Ca 0.22 0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.92 1hma h TYR 12 Cb 0.04 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.32 1hma h TYR 12 CO -0.01 0.00 -0.67 0.52 -1.64 0.00 0.00 178.16 176.36 1hma h MET 13 N 0.00 0.48 0.12 1.82 2.86 -1.31 -2.24 114.93 116.66 1hma h MET 13 Ca 0.16 -0.50 0.02 0.00 -2.06 0.00 0.00 59.70 57.32 1hma h MET 13 Cb 0.94 0.14 -0.04 0.00 0.06 0.00 0.00 31.60 32.69 1hma h MET 13 CO -0.00 1.14 -0.35 -0.07 1.06 0.00 0.00 176.91 178.69 1hma h LEU 14 N 0.02 -1.00 -1.50 1.22 3.38 -0.46 0.53 115.31 117.49 1hma h LEU 14 Ca -0.08 0.11 0.09 0.00 0.09 0.00 0.00 57.88 58.09 1hma h LEU 14 Cb 1.36 0.38 -0.04 0.00 0.09 0.00 0.00 40.66 42.45 1hma h LEU 14 CO 0.13 -0.43 0.45 -0.25 0.09 0.00 0.00 178.44 178.43 1hma h TRP 15 N -0.57 0.61 -0.96 1.13 7.01 -1.56 -0.95 115.95 120.65 1hma h TRP 15 Ca 0.03 0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.12 1hma h TRP 15 Cb 0.60 -0.20 -0.07 0.00 -2.10 0.00 0.00 29.16 27.40 1hma h TRP 15 CO -0.31 0.30 0.61 1.25 -2.79 0.00 0.00 178.44 177.50 1hma h LEU 16 N 0.58 0.96 -1.53 0.65 7.12 -0.28 -0.04 115.31 122.76 1hma h LEU 16 Ca 0.31 0.02 -0.02 0.00 0.13 0.00 0.00 57.88 58.32 1hma h LEU 16 Cb 0.44 -0.18 -0.00 0.00 -0.53 0.00 0.00 40.66 40.39 1hma h LEU 16 CO -0.10 0.60 -0.08 0.78 -0.13 0.00 0.00 178.44 179.50 1hma h ASN 17 N 1.09 0.00 0.35 1.25 2.35 -0.33 -1.44 115.58 118.84 1hma h ASN 17 Ca 0.42 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.17 1hma h ASN 17 Cb 0.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1hma h ASN 17 CO -0.19 0.08 -0.39 -1.54 -1.65 0.00 0.00 177.43 173.75 1hma n SER 18 N -3.25 0.80 -0.15 5.81 3.41 -0.09 -3.87 113.62 116.29 1hma n SER 18 Ca -0.00 -0.61 0.03 0.00 -0.26 0.00 0.00 58.87 58.02 1hma n SER 18 Cb 0.32 0.22 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 1hma n SER 18 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hma n ALA 19 N -1.05 2.57 0.36 7.33 0.00 -0.83 -4.53 120.51 124.37 1hma n ALA 19 Ca 0.09 -0.39 0.11 0.00 0.00 0.00 0.00 53.44 53.24 1hma n ALA 19 Cb 0.34 -0.20 0.47 0.00 0.00 0.00 0.00 19.45 20.07 1hma n ALA 19 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1hma n ARG 20 N -0.23 0.16 -0.02 0.00 -4.01 -0.59 -1.00 116.66 110.96 1hma n ARG 20 Ca 0.03 0.44 -0.00 0.00 -1.04 0.00 0.00 57.85 57.27 1hma n ARG 20 Cb 0.12 -1.83 -0.00 0.00 -3.04 0.00 0.00 32.46 27.71 1hma n ARG 20 CO 0.00 0.00 0.00 1.49 -3.04 0.00 0.00 177.63 176.08 1hma h GLU 21 N 0.00 0.00 0.00 2.89 4.57 -1.82 -1.61 114.58 118.62 1hma h GLU 21 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1hma h GLU 21 Cb 0.29 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 1hma h GLU 21 CO 0.00 0.00 0.00 -1.13 -1.18 0.00 0.00 179.01 176.70 1hma n SER 22 N -3.18 0.40 -0.08 1.04 3.41 -1.22 -1.24 113.62 112.75 1hma n SER 22 Ca -0.00 0.65 -0.18 0.00 -0.26 0.00 0.00 58.87 59.08 1hma n SER 22 Cb 0.01 -0.72 -0.12 0.00 -0.26 0.00 0.00 64.21 63.12 1hma n SER 22 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1hma h ILE 23 N 0.00 1.38 0.00 -1.33 2.04 -1.15 -3.06 117.51 115.39 1hma h ILE 23 Ca 0.00 -2.28 0.00 0.00 1.00 0.00 0.00 64.86 63.58 1hma h ILE 23 Cb 0.12 2.85 0.00 0.00 -0.74 0.00 0.00 36.82 39.05 1hma h ILE 23 CO 0.00 0.48 0.00 0.11 0.00 0.00 0.00 178.15 178.74 1hma h LYS 24 N -0.98 0.00 0.01 2.37 1.57 -0.84 -1.45 116.57 117.25 1hma h LYS 24 Ca -0.17 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.37 1hma h LYS 24 Cb 1.16 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.44 1hma h LYS 24 CO -0.09 0.00 -1.31 0.00 -0.57 0.00 0.00 179.45 177.47 1hma h ARG 25 N 0.00 0.01 -0.01 3.15 3.08 -1.29 -3.31 114.38 116.02 1hma h ARG 25 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1hma h ARG 25 Cb 0.60 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1hma h ARG 25 CO 0.00 0.80 -0.62 -0.85 -1.07 0.00 0.00 179.97 178.23 1hma n GLU 26 N -3.23 0.51 -4.05 0.04 0.28 -1.15 -4.92 120.64 108.12 1hma n GLU 26 Ca -0.08 -0.38 -0.29 0.00 -0.16 0.00 0.00 57.16 56.25 1hma n GLU 26 Cb 0.99 -1.49 -0.06 0.00 1.43 0.00 0.00 31.44 32.31 1hma n GLU 26 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 1hma s ASN 27 N -2.76 5.57 -1.30 -1.84 0.01 -0.56 -5.01 114.94 109.06 1hma s ASN 27 Ca 0.15 -0.04 -0.16 0.00 -0.71 0.00 0.00 52.86 52.09 1hma s ASN 27 Cb 0.17 -1.49 0.00 0.00 0.41 0.00 0.00 41.25 40.34 1hma s ASN 27 CO 0.69 0.13 2.10 -0.81 -1.51 0.00 0.00 177.10 177.70 1hma n PRO 28 N 0.11 2.59 -2.18 -0.60 -0.04 -1.26 -4.37 135.00 129.24 1hma n PRO 28 Ca -0.08 -2.53 -0.06 0.00 -0.04 0.00 0.00 63.50 60.79 1hma n PRO 28 Cb 0.53 -3.26 -0.01 0.00 -0.04 0.00 0.00 33.50 30.72 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 4.39 -0.25 2.73 0.55 0.00 -1.26 -4.77 105.19 106.57 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 -2.60 0.00 -2.08 -0.61 3.06 -1.26 -4.90 119.36 110.97 1hma n ILE 30 Ca -0.07 -0.45 -0.31 0.00 -2.50 0.00 0.00 62.75 59.42 1hma n ILE 30 Cb 0.48 0.00 -0.00 0.00 0.54 0.00 0.00 39.64 40.65 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 -1.65 3.69 0.27 9.51 -0.14 -1.26 -4.87 119.74 125.29 1hma s LYS 31 Ca 0.38 0.76 0.22 0.00 -1.36 0.00 0.00 55.97 55.98 1hma s LYS 31 Cb -0.21 -2.12 1.02 0.00 -1.68 0.00 0.00 37.83 34.84 1hma s LYS 31 CO 0.72 -0.46 1.68 1.55 -0.76 0.00 0.00 175.35 178.08 1hma n VAL 32 N -2.38 0.91 0.04 3.17 3.14 -1.26 -0.89 118.33 121.06 1hma n VAL 32 Ca 0.06 0.39 -0.17 0.00 -2.96 0.00 0.00 64.34 61.66 1hma n VAL 32 Cb 0.54 -1.34 -0.07 0.00 -1.06 0.00 0.00 33.84 31.91 1hma n VAL 32 CO 0.00 0.00 0.00 0.71 -6.46 0.00 0.00 176.83 171.08 1hma h THR 33 N 0.00 1.33 0.00 1.55 1.35 -2.01 -3.24 112.91 111.89 1hma h THR 33 Ca 0.00 -2.27 0.00 0.00 -0.55 0.00 0.00 66.41 63.59 1hma h THR 33 Cb 0.25 2.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 1hma h THR 33 CO 0.00 0.69 -0.97 -0.62 -0.25 0.00 0.00 175.52 174.38 1hma n GLU 34 N -3.83 0.20 0.23 4.72 1.02 -0.89 -4.00 120.64 118.09 1hma n GLU 34 Ca -0.08 -0.01 0.08 0.00 -0.02 0.00 0.00 57.16 57.12 1hma n GLU 34 Cb 0.83 -1.56 0.54 0.00 -0.02 0.00 0.00 31.44 31.24 1hma n GLU 34 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1hma h VAL 35 N 0.00 0.90 0.06 2.62 2.07 -1.03 -2.48 116.25 118.39 1hma h VAL 35 Ca 0.00 -0.83 -0.25 0.00 0.82 0.00 0.00 66.70 66.44 1hma h VAL 35 Cb 0.66 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.89 1hma h VAL 35 CO 0.00 0.22 -1.21 0.00 0.02 0.00 0.00 177.57 176.59 1hma h ALA 36 N 1.78 0.29 -0.48 1.67 0.00 -1.69 -2.64 119.26 118.18 1hma h ALA 36 Ca -0.00 -0.98 -0.04 0.00 0.00 0.00 0.00 54.91 53.89 1hma h ALA 36 Cb 0.47 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1hma h ALA 36 CO 0.03 1.17 0.14 -0.22 0.00 0.00 0.00 179.25 180.37 1hma h LYS 37 N 0.03 0.76 0.00 0.00 3.11 -1.62 -0.70 116.57 118.15 1hma h LYS 37 Ca -0.11 -0.17 -0.04 0.00 -2.81 0.00 0.00 60.65 57.52 1hma h LYS 37 Cb 1.89 -0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 33.01 1hma h LYS 37 CO 0.15 0.73 -0.21 -0.09 -2.81 0.00 0.00 179.45 177.23 1hma h ARG 38 N 0.65 0.00 0.00 1.90 9.65 -1.57 -2.93 114.38 122.09 1hma h ARG 38 Ca 0.15 0.00 -0.07 0.00 -1.10 0.00 0.00 59.98 58.97 1hma h ARG 38 Cb 0.30 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.87 1hma h ARG 38 CO -0.00 0.21 -0.32 0.78 2.80 0.00 0.00 179.97 183.43 1hma h GLY 39 N 2.75 0.00 2.00 2.80 0.00 -1.03 -3.16 103.07 106.43 1hma h GLY 39 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 1hma h GLY 39 CO 0.03 0.00 -0.32 -1.33 0.00 0.00 0.00 176.54 174.92 1hma h GLY 40 N 3.63 0.00 1.36 4.60 0.00 -0.95 -1.81 103.07 109.90 1hma h GLY 40 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.25 1hma h GLY 40 CO 0.04 0.00 -0.00 1.05 0.00 0.00 0.00 176.54 177.63 1hma h GLU 41 N 0.00 0.79 0.06 4.80 4.11 -1.58 -2.76 114.58 120.00 1hma h GLU 41 Ca -0.00 -0.21 -0.32 0.00 0.07 0.00 0.00 59.36 58.90 1hma h GLU 41 Cb 1.01 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.14 1hma h GLU 41 CO 0.04 0.79 -1.76 -0.07 0.07 0.00 0.00 179.01 178.08 1hma h LEU 42 N 0.73 0.20 0.33 3.06 3.38 -1.68 -3.10 115.31 118.22 1hma h LEU 42 Ca 0.14 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1hma h LEU 42 Cb 0.45 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1hma h LEU 42 CO 0.02 1.36 -0.39 -0.25 0.09 0.00 0.00 178.44 179.27 1hma h TRP 43 N 0.03 -1.06 -0.02 1.13 2.91 -1.26 0.85 115.95 118.54 1hma h TRP 43 Ca -0.32 0.01 0.00 0.00 1.13 0.00 0.00 58.89 59.71 1hma h TRP 43 Cb 2.02 0.42 0.00 0.00 -0.51 0.00 0.00 29.16 31.09 1hma h TRP 43 CO 0.04 -0.53 0.00 0.54 -1.03 0.00 0.00 178.44 177.46 1hma n ARG 44 N -5.48 1.21 0.00 2.65 5.12 -1.05 -3.44 116.66 115.67 1hma n ARG 44 Ca -0.09 -0.31 0.00 0.00 -1.93 0.00 0.00 57.85 55.52 1hma n ARG 44 Cb 0.38 -1.45 0.00 0.00 -1.16 0.00 0.00 32.46 30.24 1hma n ARG 44 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1hma n ALA 45 N -0.59 2.23 -1.08 7.54 0.00 -0.63 -4.96 120.51 123.02 1hma n ALA 45 Ca 0.20 -0.74 0.00 0.00 0.00 0.00 0.00 53.44 52.90 1hma n ALA 45 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.62 1hma n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hma n MET 46 N -0.25 0.00 0.00 0.00 0.00 0.29 -4.94 117.12 112.22 1hma n MET 46 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 1hma n MET 46 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.35 1hma n MET 46 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1hma n LYS 47 N 0.00 0.00 -4.45 3.17 4.76 -1.26 -5.10 118.16 115.29 1hma n LYS 47 Ca 0.00 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.22 1hma n LYS 47 Cb 0.00 0.00 -0.09 0.00 -1.84 0.00 0.00 35.03 33.10 1hma n LYS 47 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1hma s ASP 48 N 0.31 2.30 -0.00 4.39 1.01 -1.26 -5.06 116.67 118.35 1hma s ASP 48 Ca 0.00 -1.55 0.01 0.00 0.71 0.00 0.00 52.55 51.72 1hma s ASP 48 Cb 0.00 0.31 -0.02 0.00 1.01 0.00 0.00 42.92 44.22 1hma s ASP 48 CO 0.00 -0.83 0.05 2.29 0.21 0.00 0.00 175.17 176.89 1hma n LYS 49 N -0.75 4.93 0.20 8.23 2.85 -1.26 -4.56 118.16 127.81 1hma n LYS 49 Ca -0.03 -0.00 0.13 0.00 -1.05 0.00 0.00 58.31 57.36 1hma n LYS 49 Cb 0.65 -0.68 0.72 0.00 -0.65 0.00 0.00 35.03 35.08 1hma n LYS 49 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 177.40 178.12 1hma h SER 50 N 0.00 0.00 0.13 -5.58 0.02 -1.99 -1.94 113.55 104.19 1hma h SER 50 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1hma h SER 50 Cb 0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.58 1hma h SER 50 CO 0.00 0.00 -0.06 -0.33 -1.14 0.00 0.00 176.83 175.30 1hma h GLU 51 N 0.00 -0.16 -0.58 3.45 5.08 -2.01 -2.83 114.58 117.51 1hma h GLU 51 Ca 0.00 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1hma h GLU 51 Cb 0.04 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 1hma h GLU 51 CO 0.00 -0.11 0.36 -1.49 -1.00 0.00 0.00 179.01 176.77 1hma h TRP 52 N -0.21 0.67 -0.93 4.33 4.06 -1.84 -2.76 115.95 119.27 1hma h TRP 52 Ca -0.02 0.02 0.08 0.00 2.06 0.00 0.00 58.89 61.04 1hma h TRP 52 Cb 0.13 -0.22 -0.11 0.00 -1.00 0.00 0.00 29.16 27.96 1hma h TRP 52 CO 0.14 0.39 -0.55 0.39 -3.56 0.00 0.00 178.44 175.25 1hma n GLU 53 N -4.74 -0.41 -0.20 0.49 1.02 -0.75 0.16 120.64 116.21 1hma n GLU 53 Ca 0.05 1.43 0.03 0.00 -0.02 0.00 0.00 57.16 58.65 1hma n GLU 53 Cb 0.07 -2.10 0.29 0.00 -0.02 0.00 0.00 31.44 29.68 1hma n GLU 53 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1hma h ALA 54 N 0.44 1.55 -0.83 0.62 0.00 -1.29 -1.49 119.26 118.26 1hma h ALA 54 Ca 0.15 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.07 1hma h ALA 54 Cb 0.38 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 1hma h ALA 54 CO -0.88 0.38 0.55 0.87 0.00 0.00 0.00 179.25 180.17 1hma h LYS 55 N 0.91 0.96 -0.29 0.00 1.57 0.18 -2.13 116.57 117.77 1hma h LYS 55 Ca 0.29 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1hma h LYS 55 Cb 0.03 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1hma h LYS 55 CO -0.08 0.64 0.18 0.00 -0.57 0.00 0.00 179.45 179.62 1hma h ALA 56 N 1.53 0.37 -0.60 3.86 0.00 0.23 -2.31 119.26 122.34 1hma h ALA 56 Ca 0.34 -0.04 0.12 0.00 0.00 0.00 0.00 54.91 55.33 1hma h ALA 56 Cb 0.10 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 17.67 1hma h ALA 56 CO -0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 179.25 178.98 1hma h ALA 57 N 1.08 0.56 -0.07 0.00 0.00 -1.33 -1.37 119.26 118.12 1hma h ALA 57 Ca 0.11 0.19 0.02 0.00 0.00 0.00 0.00 54.91 55.23 1hma h ALA 57 Cb -0.00 0.34 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 1hma h ALA 57 CO -0.02 -0.40 -0.49 0.87 0.00 0.00 0.00 179.25 179.21 1hma h LYS 58 N 0.09 -0.54 -0.98 0.00 1.79 -1.24 0.43 116.57 116.12 1hma h LYS 58 Ca 0.31 0.04 0.27 0.00 -2.18 0.00 0.00 60.65 59.09 1hma h LYS 58 Cb 0.49 0.12 -0.05 0.00 -1.58 0.00 0.00 32.23 31.22 1hma h LYS 58 CO -0.53 -0.36 0.69 0.00 -1.08 0.00 0.00 179.45 178.16 1hma h ALA 59 N -0.46 2.72 0.68 3.86 0.00 -1.12 -0.28 119.26 124.66 1hma h ALA 59 Ca 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1hma h ALA 59 Cb 0.63 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1hma h ALA 59 CO -0.37 -1.02 -0.41 -0.22 0.00 0.00 0.00 179.25 177.23 1hma h LYS 60 N 0.12 -0.99 -0.23 0.00 3.11 0.86 0.99 116.57 120.42 1hma h LYS 60 Ca 0.49 0.07 0.02 0.00 -2.81 0.00 0.00 60.65 58.42 1hma h LYS 60 Cb 1.72 0.23 -0.02 0.00 -1.00 0.00 0.00 32.23 33.15 1hma h LYS 60 CO -0.08 -0.66 0.10 -0.44 -2.81 0.00 0.00 179.45 175.56 1hma h ASP 61 N -1.03 0.13 0.52 4.20 5.19 -0.37 0.26 116.42 125.32 1hma h ASP 61 Ca -0.09 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.34 1hma h ASP 61 Cb 0.83 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.34 1hma h ASP 61 CO 0.09 0.11 0.00 -0.67 -3.12 0.00 0.00 179.24 175.65 1hma n ASP 62 N -5.01 0.00 -0.04 6.45 2.03 -0.63 -2.48 116.55 116.87 1hma n ASP 62 Ca -0.02 0.45 -0.14 0.00 0.52 0.00 0.00 54.79 55.60 1hma n ASP 62 Cb 0.07 -0.48 -0.14 0.00 -0.72 0.00 0.00 41.12 39.85 1hma n ASP 62 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1hma n TYR 63 N -1.48 0.82 0.08 -0.67 4.19 0.34 -2.02 117.16 118.43 1hma n TYR 63 Ca 0.04 0.23 -0.16 0.00 3.31 0.00 0.00 57.90 61.33 1hma n TYR 63 Cb 0.18 -1.13 -0.09 0.00 0.49 0.00 0.00 39.34 38.79 1hma n TYR 63 CO 0.00 0.00 0.00 0.22 0.91 0.00 0.00 176.86 177.99 1hma h ASP 64 N 0.03 0.56 0.39 2.98 3.58 -0.97 -2.11 116.42 120.87 1hma h ASP 64 Ca -0.41 -0.51 -0.32 0.00 0.42 0.00 0.00 57.03 56.22 1hma h ASP 64 Cb 2.04 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 42.92 1hma h ASP 64 CO 0.05 1.34 -1.56 0.03 -2.88 0.00 0.00 179.24 176.22 1hma h ARG 65 N 0.19 0.31 0.00 0.28 3.08 -1.66 -3.30 114.38 113.28 1hma h ARG 65 Ca -0.12 -0.53 -0.11 0.00 0.07 0.00 0.00 59.98 59.29 1hma h ARG 65 Cb 1.76 0.20 -0.02 0.00 0.08 0.00 0.00 29.97 31.99 1hma h ARG 65 CO 0.19 1.19 -0.53 0.00 -1.07 0.00 0.00 179.97 179.75 1hma h ALA 66 N 0.39 0.77 -0.09 0.04 0.00 -1.50 -3.04 119.26 115.84 1hma h ALA 66 Ca -0.26 -0.48 -0.11 0.00 0.00 0.00 0.00 54.91 54.05 1hma h ALA 66 Cb 2.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.74 1hma h ALA 66 CO 0.18 0.67 -0.46 -0.39 0.00 0.00 0.00 179.25 179.25 1hma h VAL 67 N 0.00 1.33 0.55 0.00 -1.51 -1.50 0.20 116.25 115.33 1hma h VAL 67 Ca -0.01 -1.63 -0.03 0.00 -1.23 0.00 0.00 66.70 63.81 1hma h VAL 67 Cb 1.23 1.78 0.01 0.00 -2.13 0.00 0.00 31.29 32.17 1hma h VAL 67 CO 0.07 0.48 -0.27 0.50 -1.23 0.00 0.00 177.57 177.13 1hma h LYS 68 N 0.17 -0.72 -0.24 5.19 3.64 -1.60 1.31 116.57 124.32 1hma h LYS 68 Ca 0.01 0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1hma h LYS 68 Cb 0.88 0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.85 1hma h LYS 68 CO 0.07 -0.41 0.12 0.93 -2.27 0.00 0.00 179.45 177.89 1hma h GLU 69 N -1.00 0.32 0.00 1.90 5.08 -1.52 0.16 114.58 119.52 1hma h GLU 69 Ca -0.08 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.17 1hma h GLU 69 Cb 0.64 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 1hma h GLU 69 CO 0.12 0.24 -0.43 0.35 -1.00 0.00 0.00 179.01 178.30 1hma h PHE 70 N 0.33 0.00 0.00 4.33 3.57 -0.22 -2.38 116.94 122.56 1hma h PHE 70 Ca 0.09 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 1hma h PHE 70 Cb 0.02 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.76 1hma h PHE 70 CO 0.00 0.43 -0.65 0.93 -2.23 0.00 0.00 178.31 176.79 1hma h GLU 71 N 0.00 0.00 0.15 1.11 4.39 0.44 -3.35 114.58 117.32 1hma h GLU 71 Ca -0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1hma h GLU 71 Cb 0.83 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.48 1hma h GLU 71 CO 0.06 0.02 -0.07 0.00 -1.16 0.00 0.00 179.01 177.86 1hma h ALA 72 N 1.97 -0.20 -2.64 3.43 0.00 -0.46 -3.44 119.26 117.92 1hma h ALA 72 Ca -0.01 -0.23 -0.51 0.00 0.00 0.00 0.00 54.91 54.16 1hma h ALA 72 Cb 1.03 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1hma h ALA 72 CO 0.00 -0.29 0.36 -0.80 0.00 0.00 0.00 179.25 178.53 1hma s ASN 73 N -5.50 7.54 0.00 0.00 0.01 -0.97 -5.11 114.94 110.91 1hma s ASN 73 Ca -0.13 1.87 0.00 0.00 -0.71 0.00 0.00 52.86 53.89 1hma s ASN 73 Cb 0.00 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 39.07 1hma s ASN 73 CO 0.49 0.01 0.00 0.61 -1.51 0.00 0.00 177.10 176.70