#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 -4.45 4.04 8.00 -1.26 -2.52 116.55 120.35 1hma n ASP 3 Ca 0.00 0.00 -0.48 0.00 0.71 0.00 0.00 54.79 55.02 1hma n ASP 3 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 1hma n ASP 3 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1hma n LYS 4 N 0.00 0.33 -1.72 -1.24 4.81 -1.26 -4.37 118.16 114.71 1hma n LYS 4 Ca 0.00 0.12 -0.30 0.00 -0.87 0.00 0.00 58.31 57.26 1hma n LYS 4 Cb 0.00 -1.25 0.08 0.00 0.02 0.00 0.00 35.03 33.87 1hma n LYS 4 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1hma s PRO 5 N -1.01 2.33 -0.98 1.64 0.04 -1.26 -4.96 135.00 130.79 1hma s PRO 5 Ca 0.65 0.50 -0.23 0.00 0.04 0.00 0.00 61.00 61.96 1hma s PRO 5 Cb -0.90 -1.96 0.05 0.00 0.04 0.00 0.00 34.50 31.73 1hma s PRO 5 CO 0.57 -1.42 1.41 0.21 0.04 0.00 0.00 177.00 177.81 1hma s LYS 6 N -5.28 3.54 -0.10 4.56 2.47 -1.26 -4.90 119.74 118.77 1hma s LYS 6 Ca 0.60 -1.05 -0.09 0.00 -1.56 0.00 0.00 55.97 53.87 1hma s LYS 6 Cb -0.13 -5.20 -0.04 0.00 -1.46 0.00 0.00 37.83 31.00 1hma s LYS 6 CO 0.53 -2.18 0.36 0.54 0.16 0.00 0.00 175.35 174.76 1hma n ARG 7 N 8.83 0.00 -2.74 4.03 5.12 -1.26 -4.84 116.66 125.80 1hma n ARG 7 Ca 0.29 0.00 -0.38 0.00 -1.93 0.00 0.00 57.85 55.83 1hma n ARG 7 Cb 0.51 -0.29 -0.06 0.00 -1.16 0.00 0.00 32.46 31.46 1hma n ARG 7 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1hma s PRO 8 N 0.88 4.59 0.16 5.56 0.04 -1.26 -5.06 135.00 139.91 1hma s PRO 8 Ca 0.22 1.39 -0.11 0.00 0.04 0.00 0.00 61.00 62.54 1hma s PRO 8 Cb -0.29 -2.86 0.00 0.00 0.04 0.00 0.00 34.50 31.39 1hma s PRO 8 CO 0.14 0.27 0.33 -0.48 0.04 0.00 0.00 177.00 177.30 1hma s LEU 9 N -1.95 0.81 0.62 -3.56 0.05 -1.26 -5.13 118.68 108.26 1hma s LEU 9 Ca 0.49 -0.76 -0.15 0.00 0.05 0.00 0.00 54.13 53.76 1hma s LEU 9 Cb -0.21 1.39 -0.02 0.00 -2.05 0.00 0.00 46.19 45.30 1hma s LEU 9 CO 0.26 -0.91 1.08 -0.44 -0.55 0.00 0.00 176.35 175.79 1hma s SER 10 N -2.94 5.49 0.20 1.48 0.01 -1.26 -4.83 113.70 111.86 1hma s SER 10 Ca 0.14 1.88 -0.12 0.00 1.31 0.00 0.00 55.95 59.16 1hma s SER 10 Cb 0.03 -2.54 0.24 0.00 0.21 0.00 0.00 66.02 63.96 1hma s SER 10 CO -0.02 -1.37 1.68 0.00 0.41 0.00 0.00 173.24 173.95 1hma h ALA 11 N 0.23 0.56 -0.97 1.44 0.00 -1.89 0.14 119.26 118.77 1hma h ALA 11 Ca -0.47 0.16 0.23 0.00 0.00 0.00 0.00 54.91 54.83 1hma h ALA 11 Cb 1.23 0.26 -0.08 0.00 0.00 0.00 0.00 17.79 19.20 1hma h ALA 11 CO 0.56 -0.37 0.63 -0.92 0.00 0.00 0.00 179.25 179.15 1hma h TYR 12 N 0.14 0.61 -0.22 0.00 3.20 -1.93 -0.02 116.97 118.75 1hma h TYR 12 Ca 0.29 0.02 -0.18 0.00 3.14 0.00 0.00 58.73 61.99 1hma h TYR 12 Cb 0.44 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.53 1hma h TYR 12 CO -0.32 0.12 -0.58 0.52 -1.64 0.00 0.00 178.16 176.26 1hma h MET 13 N 0.42 0.78 0.14 1.82 2.86 -1.08 -2.39 114.93 117.48 1hma h MET 13 Ca 0.53 -0.55 0.02 0.00 -2.06 0.00 0.00 59.70 57.64 1hma h MET 13 Cb 1.30 0.09 -0.04 0.00 0.06 0.00 0.00 31.60 33.00 1hma h MET 13 CO -0.23 1.17 -0.37 -0.07 1.06 0.00 0.00 176.91 178.47 1hma h LEU 14 N 0.51 -1.06 -1.45 1.22 3.38 -0.60 0.10 115.31 117.41 1hma h LEU 14 Ca -0.01 0.12 0.13 0.00 0.09 0.00 0.00 57.88 58.21 1hma h LEU 14 Cb 1.20 0.40 -0.05 0.00 0.09 0.00 0.00 40.66 42.30 1hma h LEU 14 CO 0.13 -0.45 0.52 -0.25 0.09 0.00 0.00 178.44 178.47 1hma h TRP 15 N -0.61 0.64 -0.16 1.13 7.01 -1.55 -1.35 115.95 121.06 1hma h TRP 15 Ca 0.02 0.02 0.02 0.00 2.11 0.00 0.00 58.89 61.06 1hma h TRP 15 Cb 0.63 -0.20 -0.02 0.00 -2.10 0.00 0.00 29.16 27.46 1hma h TRP 15 CO -0.32 0.26 0.02 1.25 -2.79 0.00 0.00 178.44 176.87 1hma h LEU 16 N 0.57 -0.01 0.00 0.65 7.12 -0.30 -1.01 115.31 122.32 1hma h LEU 16 Ca 0.38 0.03 0.00 0.00 0.13 0.00 0.00 57.88 58.42 1hma h LEU 16 Cb 0.68 0.04 0.00 0.00 -0.53 0.00 0.00 40.66 40.85 1hma h LEU 16 CO -0.14 0.02 0.00 -0.46 -0.13 0.00 0.00 178.44 177.73 1hma n ASN 17 N -5.10 0.00 -1.34 1.25 0.23 -0.54 -2.55 115.26 107.21 1hma n ASN 17 Ca -0.03 -0.01 0.10 0.00 -0.53 0.00 0.00 54.58 54.10 1hma n ASN 17 Cb 0.08 -0.31 0.31 0.00 -2.08 0.00 0.00 39.78 37.78 1hma n ASN 17 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1hma n SER 18 N -1.31 4.15 0.00 0.53 3.41 -0.43 -4.22 113.62 115.74 1hma n SER 18 Ca 0.12 -2.22 0.00 0.00 -0.26 0.00 0.00 58.87 56.51 1hma n SER 18 Cb 0.22 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 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 1.21 0.69 0.27 7.33 0.00 -0.91 -4.82 120.51 124.28 1hma n ALA 19 Ca 0.23 -0.32 0.11 0.00 0.00 0.00 0.00 53.44 53.46 1hma n ALA 19 Cb 0.72 0.00 0.76 0.00 0.00 0.00 0.00 19.45 20.92 1hma n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hma h ARG 20 N 0.00 0.00 0.03 0.00 3.08 -1.71 0.58 114.38 116.36 1hma h ARG 20 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1hma h ARG 20 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.79 1hma h ARG 20 CO 0.00 0.00 -0.01 1.49 -1.07 0.00 0.00 179.97 180.38 1hma h GLU 21 N 0.00 -0.04 0.00 0.04 4.81 -1.89 -1.77 114.58 115.73 1hma h GLU 21 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1hma h GLU 21 Cb 0.00 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.39 1hma h GLU 21 CO -0.00 0.49 0.00 -1.13 -0.73 0.00 0.00 179.01 177.64 1hma n SER 22 N -4.73 0.00 -0.09 1.04 3.41 -1.09 -1.61 113.62 110.55 1hma n SER 22 Ca -0.06 0.20 -0.22 0.00 -0.26 0.00 0.00 58.87 58.53 1hma n SER 22 Cb 0.26 -0.35 -0.12 0.00 -0.26 0.00 0.00 64.21 63.74 1hma n SER 22 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1hma n ILE 23 N -1.35 1.57 0.27 -1.33 5.41 0.20 -3.41 119.36 120.71 1hma n ILE 23 Ca 0.06 -0.13 0.16 0.00 1.00 0.00 0.00 62.75 63.84 1hma n ILE 23 Cb 0.14 -1.99 0.59 0.00 -0.71 0.00 0.00 39.64 37.67 1hma n ILE 23 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 1hma h LYS 24 N -0.86 0.00 0.05 0.38 1.57 -1.14 -2.55 116.57 114.01 1hma h LYS 24 Ca -0.38 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.16 1hma h LYS 24 Cb 1.42 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.72 1hma h LYS 24 CO -0.19 0.02 -1.07 0.07 -0.57 0.00 0.00 179.45 177.71 1hma h ARG 25 N 0.00 0.14 -0.58 3.15 0.11 -1.45 -3.22 114.38 112.53 1hma h ARG 25 Ca -0.00 -0.22 0.00 0.00 0.10 0.00 0.00 59.98 59.86 1hma h ARG 25 Cb 0.60 0.08 0.00 0.00 1.11 0.00 0.00 29.97 31.76 1hma h ARG 25 CO 0.00 1.08 0.00 0.39 0.10 0.00 0.00 179.97 181.54 1hma n GLU 26 N -3.47 4.75 -4.33 0.08 1.02 -1.10 -4.93 120.64 112.66 1hma n GLU 26 Ca -0.04 -3.14 -0.23 0.00 -0.02 0.00 0.00 57.16 53.73 1hma n GLU 26 Cb 0.95 -2.22 -0.13 0.00 -0.02 0.00 0.00 31.44 30.02 1hma n GLU 26 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1hma s ASN 27 N -0.83 2.39 -1.32 1.62 0.01 -0.98 -5.04 114.94 110.78 1hma s ASN 27 Ca 0.54 -0.64 -0.16 0.00 -0.71 0.00 0.00 52.86 51.90 1hma s ASN 27 Cb 0.41 -0.14 -0.00 0.00 0.41 0.00 0.00 41.25 41.93 1hma s ASN 27 CO 0.17 0.06 2.18 -0.81 -1.51 0.00 0.00 177.10 177.18 1hma n PRO 28 N 1.27 2.59 -2.03 -0.60 -0.04 -1.26 -4.37 135.00 130.55 1hma n PRO 28 Ca -0.19 -2.43 -0.07 0.00 -0.04 0.00 0.00 63.50 60.76 1hma n PRO 28 Cb 0.54 -3.20 -0.01 0.00 -0.04 0.00 0.00 33.50 30.78 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 4.18 -0.08 3.10 0.55 0.00 -1.26 -4.76 105.19 106.92 1hma n GLY 29 Ca 0.52 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.50 0.38 -0.78 -0.61 3.06 -1.26 -4.85 119.36 112.80 1hma n ILE 30 Ca -0.08 -0.47 -0.31 0.00 -2.50 0.00 0.00 62.75 59.39 1hma n ILE 30 Cb 0.46 0.00 0.16 0.00 0.54 0.00 0.00 39.64 40.80 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 -0.94 1.01 0.38 9.51 1.02 -1.26 -4.81 119.74 124.64 1hma s LYS 31 Ca 0.55 1.40 0.15 0.00 0.02 0.00 0.00 55.97 58.10 1hma s LYS 31 Cb -0.55 -1.74 0.76 0.00 -0.52 0.00 0.00 37.83 35.77 1hma s LYS 31 CO 0.60 -2.59 1.81 -0.24 -0.92 0.00 0.00 175.35 174.02 1hma h VAL 32 N -1.83 1.12 0.23 3.17 3.04 -2.00 -1.80 116.25 118.18 1hma h VAL 32 Ca -0.45 -1.34 -0.33 0.00 -1.01 0.00 0.00 66.70 63.56 1hma h VAL 32 Cb 1.27 1.75 0.03 0.00 -2.01 0.00 0.00 31.29 32.33 1hma h VAL 32 CO 0.44 0.37 -1.50 0.74 -1.01 0.00 0.00 177.57 176.60 1hma h THR 33 N 0.00 1.25 0.00 3.17 2.02 -2.01 -3.19 112.91 114.14 1hma h THR 33 Ca -0.00 -2.72 0.00 0.00 0.77 0.00 0.00 66.41 64.46 1hma h THR 33 Cb 0.72 2.99 0.00 0.00 -1.74 0.00 0.00 68.15 70.12 1hma h THR 33 CO 0.05 0.83 0.00 -0.62 0.37 0.00 0.00 175.52 176.15 1hma n GLU 34 N -3.67 0.26 0.09 6.66 1.02 -1.13 -2.87 120.64 120.99 1hma n GLU 34 Ca -0.17 0.08 -0.13 0.00 -0.02 0.00 0.00 57.16 56.92 1hma n GLU 34 Cb 1.09 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.88 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 1.56 0.00 2.62 2.07 -1.31 -2.87 116.25 118.32 1hma h VAL 35 Ca 0.00 -3.18 -0.09 0.00 0.82 0.00 0.00 66.70 64.25 1hma h VAL 35 Cb 0.24 2.91 -0.01 0.00 -1.52 0.00 0.00 31.29 32.91 1hma h VAL 35 CO 0.00 0.92 -0.43 0.00 0.02 0.00 0.00 177.57 178.08 1hma h ALA 36 N 0.72 0.81 0.00 1.67 0.00 -1.63 -1.38 119.26 119.45 1hma h ALA 36 Ca -0.10 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.36 1hma h ALA 36 Cb 1.91 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.63 1hma h ALA 36 CO 0.18 0.54 -0.23 -0.22 0.00 0.00 0.00 179.25 179.52 1hma h LYS 37 N 0.00 0.15 -0.25 0.00 1.63 -1.61 -3.17 116.57 113.32 1hma h LYS 37 Ca -0.00 -0.16 -0.18 0.00 -0.85 0.00 0.00 60.65 59.45 1hma h LYS 37 Cb 1.15 0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.83 1hma h LYS 37 CO 0.06 0.92 -0.58 -0.09 -3.45 0.00 0.00 179.45 176.31 1hma h ARG 38 N -0.56 0.79 -0.27 1.90 1.12 -1.56 -2.94 114.38 112.86 1hma h ARG 38 Ca -0.03 -0.52 0.08 0.00 -1.11 0.00 0.00 59.98 58.40 1hma h ARG 38 Cb 1.01 0.07 -0.01 0.00 -0.01 0.00 0.00 29.97 31.02 1hma h ARG 38 CO 0.04 1.15 0.23 0.78 -3.11 0.00 0.00 179.97 179.07 1hma h GLY 39 N 0.77 0.00 1.46 2.80 0.00 -1.35 -0.10 103.07 106.65 1hma h GLY 39 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.19 1hma h GLY 39 CO 0.12 0.00 -0.47 -1.33 0.00 0.00 0.00 176.54 174.87 1hma h GLY 40 N 0.00 0.64 0.85 4.60 0.00 -1.48 -2.73 103.07 104.95 1hma h GLY 40 Ca 0.13 -0.68 0.12 0.00 0.00 0.00 0.00 47.33 46.90 1hma h GLY 40 CO -0.00 0.61 0.46 1.05 0.00 0.00 0.00 176.54 178.66 1hma h GLU 41 N 0.47 0.00 0.00 4.80 -0.00 -1.07 0.21 114.58 118.99 1hma h GLU 41 Ca 0.03 0.00 -0.27 0.00 -0.00 0.00 0.00 59.36 59.12 1hma h GLU 41 Cb 0.99 0.00 -0.05 0.00 -0.00 0.00 0.00 28.75 29.69 1hma h GLU 41 CO 0.09 0.00 -1.75 1.28 -0.00 0.00 0.00 179.01 178.63 1hma n LEU 42 N -3.71 0.72 0.15 3.06 4.77 -1.05 -3.78 117.00 117.17 1hma n LEU 42 Ca 0.08 0.34 -0.14 0.00 -0.03 0.00 0.00 56.01 56.25 1hma n LEU 42 Cb 0.63 0.19 -0.08 0.00 -2.33 0.00 0.00 43.42 41.84 1hma n LEU 42 CO 0.27 0.34 0.78 -0.25 -1.33 0.00 0.00 177.39 177.20 1hma h TRP 43 N 0.00 -0.29 0.00 -1.77 2.91 -0.38 0.13 115.95 116.55 1hma h TRP 43 Ca -0.29 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 59.72 1hma h TRP 43 Cb 1.93 0.10 0.00 0.00 -0.51 0.00 0.00 29.16 30.67 1hma h TRP 43 CO 0.00 -0.15 0.00 0.54 -1.03 0.00 0.00 178.44 177.80 1hma n ARG 44 N -5.21 0.96 0.00 2.65 1.74 -1.01 -3.15 116.66 112.64 1hma n ARG 44 Ca -0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 1hma n ARG 44 Cb 0.16 -1.09 0.00 0.00 -1.02 0.00 0.00 32.46 30.51 1hma n ARG 44 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1hma n ALA 45 N -0.59 1.51 -1.00 7.54 0.00 -0.61 -5.02 120.51 122.34 1hma n ALA 45 Ca 0.04 -0.70 0.00 0.00 0.00 0.00 0.00 53.44 52.78 1hma n ALA 45 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 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 -0.23 0.00 0.00 0.00 0.00 0.36 -4.99 117.12 112.26 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 0.33 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.55 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 -4.13 3.17 5.02 -1.26 -5.11 118.16 115.85 1hma n LYS 47 Ca 0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.18 1hma n LYS 47 Cb 0.00 -0.25 -0.08 0.00 -0.02 0.00 0.00 35.03 34.68 1hma n LYS 47 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1hma s ASP 48 N -3.98 0.07 -0.00 4.39 1.11 -1.26 -5.05 116.67 111.95 1hma s ASP 48 Ca 0.00 -1.23 0.08 0.00 0.18 0.00 0.00 52.55 51.58 1hma s ASP 48 Cb 0.00 0.46 -0.09 0.00 1.07 0.00 0.00 42.92 44.35 1hma s ASP 48 CO 0.00 -0.95 0.31 0.29 1.18 0.00 0.00 175.17 176.00 1hma n LYS 49 N -0.31 3.76 0.28 8.23 5.02 -1.26 -4.46 118.16 129.42 1hma n LYS 49 Ca 0.01 -0.01 0.18 0.00 -2.02 0.00 0.00 58.31 56.46 1hma n LYS 49 Cb 0.64 -0.92 0.95 0.00 -0.02 0.00 0.00 35.03 35.69 1hma n LYS 49 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1hma h SER 50 N 0.00 0.00 0.03 4.39 0.02 -1.98 -1.14 113.55 114.87 1hma h SER 50 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1hma h SER 50 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 1hma h SER 50 CO 0.00 0.00 -0.01 -0.33 -1.14 0.00 0.00 176.83 175.35 1hma h GLU 51 N 0.00 -0.04 0.65 3.45 5.08 -2.01 -2.81 114.58 118.90 1hma h GLU 51 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1hma h GLU 51 Cb 0.12 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1hma h GLU 51 CO 0.00 -0.02 -0.34 -1.49 -1.00 0.00 0.00 179.01 176.16 1hma h TRP 52 N -0.05 -0.87 -0.33 4.33 4.06 -1.83 -2.82 115.95 118.45 1hma h TRP 52 Ca -0.00 -0.02 0.03 0.00 2.06 0.00 0.00 58.89 60.96 1hma h TRP 52 Cb 0.03 0.30 -0.04 0.00 -1.00 0.00 0.00 29.16 28.45 1hma h TRP 52 CO 0.15 -0.53 -0.19 0.39 -3.56 0.00 0.00 178.44 174.70 1hma n GLU 53 N -5.49 -0.14 -0.22 0.49 1.02 -0.45 0.21 120.64 116.05 1hma n GLU 53 Ca -0.13 0.73 0.01 0.00 -0.02 0.00 0.00 57.16 57.74 1hma n GLU 53 Cb 0.37 -1.08 0.12 0.00 -0.02 0.00 0.00 31.44 30.84 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 -0.07 0.89 -0.96 0.62 0.00 -1.45 -1.05 119.26 117.24 1hma h ALA 54 Ca 0.05 0.07 0.10 0.00 0.00 0.00 0.00 54.91 55.13 1hma h ALA 54 Cb 0.13 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.84 1hma h ALA 54 CO -0.31 -0.11 0.60 -0.22 0.00 0.00 0.00 179.25 179.21 1hma h LYS 55 N 0.51 0.96 -0.44 0.00 1.63 0.27 -1.83 116.57 117.68 1hma h LYS 55 Ca 0.33 -0.06 -0.05 0.00 -0.85 0.00 0.00 60.65 60.02 1hma h LYS 55 Cb 0.37 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 31.76 1hma h LYS 55 CO -0.28 0.63 0.08 0.00 -3.45 0.00 0.00 179.45 176.44 1hma h ALA 56 N 1.50 0.58 -0.86 5.00 0.00 0.46 -2.74 119.26 123.19 1hma h ALA 56 Ca 0.46 -0.21 0.22 0.00 0.00 0.00 0.00 54.91 55.37 1hma h ALA 56 Cb 0.38 -0.17 -0.15 0.00 0.00 0.00 0.00 17.79 17.86 1hma h ALA 56 CO -0.24 0.29 0.13 0.00 0.00 0.00 0.00 179.25 179.43 1hma h ALA 57 N 0.95 1.10 -0.07 0.00 0.00 -0.84 -0.75 119.26 119.65 1hma h ALA 57 Ca 0.13 0.25 0.02 0.00 0.00 0.00 0.00 54.91 55.31 1hma h ALA 57 Cb 0.36 0.40 -0.04 0.00 0.00 0.00 0.00 17.79 18.50 1hma h ALA 57 CO 0.01 -0.47 -0.37 0.87 0.00 0.00 0.00 179.25 179.29 1hma h LYS 58 N 0.14 -0.40 -1.20 0.00 1.57 -1.39 0.42 116.57 115.71 1hma h LYS 58 Ca 0.52 0.03 0.34 0.00 -1.87 0.00 0.00 60.65 59.66 1hma h LYS 58 Cb 1.01 0.09 -0.07 0.00 0.08 0.00 0.00 32.23 33.34 1hma h LYS 58 CO -0.70 -0.26 0.83 0.00 -0.57 0.00 0.00 179.45 178.74 1hma h ALA 59 N -0.70 2.86 0.38 3.86 0.00 -1.23 0.27 119.26 124.71 1hma h ALA 59 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1hma h ALA 59 Cb 0.47 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1hma h ALA 59 CO -0.28 -1.26 -0.24 -0.22 0.00 0.00 0.00 179.25 177.25 1hma h LYS 60 N 0.13 -0.58 0.13 0.00 3.64 0.41 0.84 116.57 121.14 1hma h LYS 60 Ca 0.62 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 60.04 1hma h LYS 60 Cb 2.15 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 34.09 1hma h LYS 60 CO -0.13 -0.39 -0.14 0.22 -2.27 0.00 0.00 179.45 176.74 1hma h ASP 61 N -0.61 -0.37 0.48 4.20 1.82 0.41 0.32 116.42 122.68 1hma h ASP 61 Ca -0.04 0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1hma h ASP 61 Cb 0.50 0.13 0.00 0.00 0.68 0.00 0.00 39.33 40.64 1hma h ASP 61 CO 0.04 -0.21 0.00 0.47 -1.61 0.00 0.00 179.24 177.93 1hma n ASP 62 N -5.26 0.00 -0.02 2.28 8.00 -0.73 -2.51 116.55 118.31 1hma n ASP 62 Ca -0.07 0.47 -0.13 0.00 0.71 0.00 0.00 54.79 55.77 1hma n ASP 62 Cb 0.18 -0.49 -0.14 0.00 -0.02 0.00 0.00 41.12 40.65 1hma n ASP 62 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1hma n TYR 63 N -1.49 0.96 0.10 1.24 4.19 0.29 -2.10 117.16 120.35 1hma n TYR 63 Ca 0.04 0.29 -0.19 0.00 3.31 0.00 0.00 57.90 61.34 1hma n TYR 63 Cb 0.16 -1.16 -0.12 0.00 0.49 0.00 0.00 39.34 38.72 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 0.02 0.68 0.54 2.98 3.58 -0.78 -2.31 116.42 121.14 1hma h ASP 64 Ca -0.36 -0.64 -0.29 0.00 0.42 0.00 0.00 57.03 56.15 1hma h ASP 64 Cb 2.04 -0.22 0.01 0.00 1.72 0.00 0.00 39.33 42.88 1hma h ASP 64 CO 0.07 1.47 -1.31 -0.09 -2.88 0.00 0.00 179.24 176.49 1hma h ARG 65 N 0.20 0.33 0.00 0.28 2.43 -1.66 -3.29 114.38 112.68 1hma h ARG 65 Ca -0.16 -0.57 -0.12 0.00 -0.81 0.00 0.00 59.98 58.32 1hma h ARG 65 Cb 1.88 0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 31.62 1hma h ARG 65 CO 0.22 1.27 -0.58 0.00 -1.51 0.00 0.00 179.97 179.36 1hma h ALA 66 N 0.48 0.85 -0.36 2.80 0.00 -1.50 -3.09 119.26 118.44 1hma h ALA 66 Ca -0.17 -0.53 -0.11 0.00 0.00 0.00 0.00 54.91 54.10 1hma h ALA 66 Cb 2.02 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.70 1hma h ALA 66 CO 0.22 0.73 -0.22 -0.39 0.00 0.00 0.00 179.25 179.59 1hma h VAL 67 N 0.00 1.27 0.59 0.00 -1.51 -1.49 0.19 116.25 115.29 1hma h VAL 67 Ca -0.01 -1.31 -0.03 0.00 -1.23 0.00 0.00 66.70 64.12 1hma h VAL 67 Cb 1.16 1.23 0.01 0.00 -2.13 0.00 0.00 31.29 31.56 1hma h VAL 67 CO 0.08 0.43 -0.28 0.50 -1.23 0.00 0.00 177.57 177.07 1hma h LYS 68 N 0.63 -0.76 -0.11 5.19 1.63 -1.61 1.41 116.57 122.95 1hma h LYS 68 Ca 0.09 0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.94 1hma h LYS 68 Cb 0.71 0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 32.51 1hma h LYS 68 CO 0.05 -0.46 0.07 0.93 -3.45 0.00 0.00 179.45 176.59 1hma h GLU 69 N -0.94 0.14 0.00 1.90 4.39 -1.52 0.98 114.58 119.53 1hma h GLU 69 Ca -0.08 -0.01 -0.11 0.00 0.34 0.00 0.00 59.36 59.50 1hma h GLU 69 Cb 0.65 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.26 1hma h GLU 69 CO 0.13 0.10 -0.54 0.35 -1.16 0.00 0.00 179.01 177.89 1hma h PHE 70 N 0.15 0.00 0.00 4.33 3.57 -0.02 -2.80 116.94 122.16 1hma h PHE 70 Ca 0.04 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1hma h PHE 70 Cb -0.01 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.73 1hma h PHE 70 CO 0.00 0.54 -0.52 0.39 -2.23 0.00 0.00 178.31 176.49 1hma n GLU 71 N -3.66 0.16 -1.20 1.11 1.02 0.48 -4.15 120.64 114.40 1hma n GLU 71 Ca -0.01 0.05 -0.18 0.00 -0.02 0.00 0.00 57.16 57.00 1hma n GLU 71 Cb 0.59 -1.61 -0.11 0.00 -0.02 0.00 0.00 31.44 30.30 1hma n GLU 71 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1hma n ALA 72 N -1.68 6.31 -2.68 0.62 0.00 -0.36 -4.16 120.51 118.56 1hma n ALA 72 Ca 0.04 -2.31 0.00 0.00 0.00 0.00 0.00 53.44 51.18 1hma n ALA 72 Cb 0.39 -2.18 0.04 0.00 0.00 0.00 0.00 19.45 17.71 1hma n ALA 72 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1hma n ASN 73 N 1.69 1.52 0.00 0.00 2.85 -1.26 -5.03 115.26 115.04 1hma n ASN 73 Ca 0.44 -2.11 0.00 0.00 -0.11 0.00 0.00 54.58 52.79 1hma n ASN 73 Cb 0.74 -0.42 0.00 0.00 1.24 0.00 0.00 39.78 41.34 1hma n ASN 73 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76