#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 0.34 -4.84 4.04 -0.08 -1.26 -5.14 116.55 109.61 1hma n ASP 3 Ca 0.00 0.00 -0.35 0.00 -1.51 0.00 0.00 54.79 52.93 1hma n ASP 3 Cb 0.00 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.40 1hma n ASP 3 CO 0.00 0.00 0.00 -0.75 0.12 0.00 0.00 177.20 176.57 1hma s LYS 4 N 2.75 4.02 0.77 -0.67 2.20 -1.26 -4.87 119.74 122.68 1hma s LYS 4 Ca 0.00 0.56 -0.12 0.00 -0.36 0.00 0.00 55.97 56.05 1hma s LYS 4 Cb 0.00 -2.88 0.05 0.00 -1.51 0.00 0.00 37.83 33.49 1hma s LYS 4 CO 0.00 0.44 1.10 -1.25 -0.36 0.00 0.00 175.35 175.28 1hma s PRO 5 N -2.06 2.30 -0.13 4.03 0.04 -1.26 -4.98 135.00 132.94 1hma s PRO 5 Ca 0.40 0.55 -0.29 0.00 0.04 0.00 0.00 61.00 61.69 1hma s PRO 5 Cb -0.15 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.41 1hma s PRO 5 CO 0.20 -1.45 1.51 0.15 0.04 0.00 0.00 177.00 177.44 1hma s LYS 6 N -5.24 4.11 0.62 4.56 -0.14 -1.26 -4.98 119.74 117.41 1hma s LYS 6 Ca 0.60 1.88 -0.16 0.00 -1.36 0.00 0.00 55.97 56.93 1hma s LYS 6 Cb -0.13 -3.92 -0.02 0.00 -1.68 0.00 0.00 37.83 32.08 1hma s LYS 6 CO 0.53 -0.90 1.10 1.03 -0.76 0.00 0.00 175.35 176.35 1hma s ARG 7 N 4.00 3.01 0.36 1.68 1.81 -1.26 -4.74 118.95 123.80 1hma s ARG 7 Ca 0.66 1.40 -0.26 0.00 -1.72 0.00 0.00 55.73 55.82 1hma s ARG 7 Cb -0.27 -1.98 -0.09 0.00 -0.45 0.00 0.00 34.95 32.16 1hma s ARG 7 CO 0.24 -1.09 1.10 -1.25 -0.68 0.00 0.00 175.30 173.63 1hma s PRO 8 N -3.92 4.28 0.41 3.54 0.04 -1.26 -5.03 135.00 133.06 1hma s PRO 8 Ca 0.68 1.69 0.04 0.00 0.04 0.00 0.00 61.00 63.45 1hma s PRO 8 Cb -0.20 -2.78 -0.02 0.00 0.04 0.00 0.00 34.50 31.53 1hma s PRO 8 CO 0.37 -0.08 0.16 -0.48 0.04 0.00 0.00 177.00 177.02 1hma s LEU 9 N -2.22 1.95 0.48 -3.56 2.34 -1.26 -5.10 118.68 111.31 1hma s LEU 9 Ca 0.53 -1.72 -0.11 0.00 0.06 0.00 0.00 54.13 52.89 1hma s LEU 9 Cb -0.28 0.03 -0.06 0.00 -0.56 0.00 0.00 46.19 45.33 1hma s LEU 9 CO 0.35 -0.99 0.87 -0.55 -1.06 0.00 0.00 176.35 174.97 1hma s SER 10 N -3.58 6.45 0.09 1.48 0.15 -1.26 -4.85 113.70 112.17 1hma s SER 10 Ca 0.25 1.25 -0.19 0.00 0.70 0.00 0.00 55.95 57.96 1hma s SER 10 Cb 0.02 -2.38 -0.08 0.00 -1.71 0.00 0.00 66.02 61.87 1hma s SER 10 CO 0.17 -0.56 1.59 0.00 1.20 0.00 0.00 173.24 175.63 1hma h ALA 11 N 0.70 0.30 -0.32 5.45 0.00 -1.90 -1.55 119.26 121.93 1hma h ALA 11 Ca -0.46 -0.15 0.09 0.00 0.00 0.00 0.00 54.91 54.39 1hma h ALA 11 Cb 1.19 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1hma h ALA 11 CO 0.62 -0.06 0.49 -0.92 0.00 0.00 0.00 179.25 179.39 1hma h TYR 12 N 0.19 0.00 0.09 0.00 3.20 -1.94 0.25 116.97 118.77 1hma h TYR 12 Ca 0.07 0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.76 1hma h TYR 12 Cb 0.27 0.00 0.02 0.00 1.54 0.00 0.00 36.73 38.56 1hma h TYR 12 CO 0.01 0.00 -0.77 0.52 -1.64 0.00 0.00 178.16 176.28 1hma h MET 13 N 0.00 0.35 -0.18 1.82 0.00 -1.67 -2.29 114.93 112.97 1hma h MET 13 Ca 0.15 -0.51 0.05 0.00 0.00 0.00 0.00 59.70 59.40 1hma h MET 13 Cb 1.13 0.17 -0.06 0.00 0.00 0.00 0.00 31.60 32.85 1hma h MET 13 CO -0.00 1.20 -0.25 -0.07 0.00 0.00 0.00 176.91 177.80 1hma h LEU 14 N -0.24 -0.77 -1.03 1.22 3.38 -0.20 0.10 115.31 117.77 1hma h LEU 14 Ca -0.12 0.13 0.03 0.00 0.09 0.00 0.00 57.88 58.00 1hma h LEU 14 Cb 1.55 0.35 -0.05 0.00 0.09 0.00 0.00 40.66 42.59 1hma h LEU 14 CO 0.15 -0.29 0.65 -0.25 0.09 0.00 0.00 178.44 178.79 1hma h TRP 15 N -0.29 1.23 -0.84 1.13 7.01 -1.57 -0.56 115.95 122.06 1hma h TRP 15 Ca 0.11 0.03 0.15 0.00 2.11 0.00 0.00 58.89 61.30 1hma h TRP 15 Cb 0.46 -0.41 -0.06 0.00 -2.10 0.00 0.00 29.16 27.05 1hma h TRP 15 CO -0.37 0.73 0.55 1.25 -2.79 0.00 0.00 178.44 177.82 1hma h LEU 16 N 1.29 0.52 0.00 0.65 7.12 -0.25 0.20 115.31 124.84 1hma h LEU 16 Ca 0.38 0.03 -0.13 0.00 0.13 0.00 0.00 57.88 58.29 1hma h LEU 16 Cb -0.06 -0.07 -0.02 0.00 -0.53 0.00 0.00 40.66 39.98 1hma h LEU 16 CO -0.11 0.26 -0.80 0.78 -0.13 0.00 0.00 178.44 178.45 1hma h ASN 17 N 0.55 0.00 0.41 1.25 2.35 0.38 -2.71 115.58 117.81 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 0.82 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.19 1hma h ASN 17 CO -0.17 0.58 -0.26 -1.54 -1.65 0.00 0.00 177.43 174.40 1hma n SER 18 N -3.16 0.63 -0.01 5.81 3.41 0.18 -3.85 113.62 116.63 1hma n SER 18 Ca -0.01 -0.50 0.04 0.00 -0.26 0.00 0.00 58.87 58.14 1hma n SER 18 Cb 0.79 0.05 -0.10 0.00 -0.26 0.00 0.00 64.21 64.69 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 -1.04 2.33 0.22 7.33 0.00 0.46 -4.46 120.51 125.35 1hma n ALA 19 Ca 0.11 -0.38 0.15 0.00 0.00 0.00 0.00 53.44 53.32 1hma n ALA 19 Cb 0.32 -0.35 0.80 0.00 0.00 0.00 0.00 19.45 20.22 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 0.02 0.00 3.08 -1.59 0.82 114.38 116.71 1hma h ARG 20 Ca -0.05 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 1hma h ARG 20 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.82 1hma h ARG 20 CO 0.00 0.00 -0.01 0.93 -1.07 0.00 0.00 179.97 179.82 1hma h GLU 21 N 0.00 -0.02 0.00 0.04 5.08 -1.78 -2.02 114.58 115.88 1hma h GLU 21 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1hma h GLU 21 Cb 0.33 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1hma h GLU 21 CO -0.00 0.46 0.00 -1.13 -1.00 0.00 0.00 179.01 177.34 1hma n SER 22 N -4.72 0.00 -0.09 1.42 3.41 -1.01 -2.28 113.62 110.35 1hma n SER 22 Ca -0.05 -0.20 -0.23 0.00 -0.26 0.00 0.00 58.87 58.13 1hma n SER 22 Cb 0.24 -0.19 -0.12 0.00 -0.26 0.00 0.00 64.21 63.89 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 -1.19 1.58 0.41 -1.33 5.41 0.28 -3.38 119.36 121.14 1hma n ILE 23 Ca 0.11 -0.23 0.13 0.00 1.00 0.00 0.00 62.75 63.76 1hma n ILE 23 Cb 0.12 -1.93 0.50 0.00 -0.71 0.00 0.00 39.64 37.62 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 -0.74 0.00 0.01 0.38 1.79 -1.23 -2.24 116.57 114.54 1hma h LYS 24 Ca -0.43 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 57.77 1hma h LYS 24 Cb 1.53 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 32.14 1hma h LYS 24 CO -0.18 0.00 -1.50 0.07 -1.08 0.00 0.00 179.45 176.76 1hma h ARG 25 N 0.00 0.03 -0.20 3.15 -0.00 -1.60 -3.30 114.38 112.45 1hma h ARG 25 Ca 0.00 -0.05 0.00 0.00 -0.00 0.00 0.00 59.98 59.93 1hma h ARG 25 Cb 0.49 0.02 0.00 0.00 -0.00 0.00 0.00 29.97 30.47 1hma h ARG 25 CO 0.00 0.71 0.00 -0.85 -0.00 0.00 0.00 179.97 179.83 1hma n GLU 26 N -3.18 2.11 -4.40 0.08 0.28 -1.12 -4.89 120.64 109.52 1hma n GLU 26 Ca -0.12 -1.65 -0.28 0.00 -0.16 0.00 0.00 57.16 54.94 1hma n GLU 26 Cb 1.02 -1.46 -0.12 0.00 1.43 0.00 0.00 31.44 32.30 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 -1.67 3.40 -1.24 -1.84 0.01 -0.86 -5.04 114.94 107.70 1hma s ASN 27 Ca 0.34 -0.78 -0.18 0.00 -0.71 0.00 0.00 52.86 51.54 1hma s ASN 27 Cb 0.20 -0.26 -0.01 0.00 0.41 0.00 0.00 41.25 41.59 1hma s ASN 27 CO 0.30 0.16 2.03 -0.81 -1.51 0.00 0.00 177.10 177.27 1hma n PRO 28 N 0.66 2.49 -2.63 -0.60 -0.04 -1.26 -4.34 135.00 129.28 1hma n PRO 28 Ca -0.16 -2.54 -0.08 0.00 -0.04 0.00 0.00 63.50 60.68 1hma n PRO 28 Cb 0.54 -3.28 -0.01 0.00 -0.04 0.00 0.00 33.50 30.71 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 4.61 -0.49 2.66 0.55 0.00 -1.26 -4.73 105.19 106.52 1hma n GLY 29 Ca 0.50 0.01 -0.32 0.00 0.00 0.00 0.00 46.02 46.21 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 -2.96 0.15 -1.27 -0.61 3.06 -1.26 -4.82 119.36 111.66 1hma n ILE 30 Ca -0.04 -0.41 -0.34 0.00 -2.50 0.00 0.00 62.75 59.46 1hma n ILE 30 Cb 0.54 0.00 0.11 0.00 0.54 0.00 0.00 39.64 40.83 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 -0.81 1.85 0.44 9.51 -0.14 -1.26 -4.78 119.74 124.54 1hma s LYS 31 Ca 0.47 1.83 0.22 0.00 -1.36 0.00 0.00 55.97 57.13 1hma s LYS 31 Cb -0.44 -1.79 1.00 0.00 -1.68 0.00 0.00 37.83 34.92 1hma s LYS 31 CO 0.53 -2.07 1.88 -0.24 -0.76 0.00 0.00 175.35 174.69 1hma h VAL 32 N -0.56 0.75 0.00 3.17 3.04 -1.99 -0.81 116.25 119.85 1hma h VAL 32 Ca -0.47 -1.05 -0.10 0.00 -1.01 0.00 0.00 66.70 64.06 1hma h VAL 32 Cb 1.31 1.65 -0.01 0.00 -2.01 0.00 0.00 31.29 32.23 1hma h VAL 32 CO 0.48 0.25 -0.48 0.71 -1.01 0.00 0.00 177.57 177.52 1hma h THR 33 N 0.00 1.08 0.00 3.17 1.35 -2.01 -2.93 112.91 113.58 1hma h THR 33 Ca -0.00 -1.81 0.00 0.00 -0.55 0.00 0.00 66.41 64.04 1hma h THR 33 Cb 0.63 2.06 0.00 0.00 -1.73 0.00 0.00 68.15 69.11 1hma h THR 33 CO 0.03 0.47 -0.96 -0.62 -0.25 0.00 0.00 175.52 174.19 1hma n GLU 34 N -3.59 0.21 0.09 4.72 1.02 -0.87 -3.70 120.64 118.52 1hma n GLU 34 Ca -0.00 -0.01 -0.05 0.00 -0.02 0.00 0.00 57.16 57.08 1hma n GLU 34 Cb 0.57 -1.56 0.02 0.00 -0.02 0.00 0.00 31.44 30.44 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 1.57 0.00 2.62 2.07 -0.98 -3.07 116.25 118.46 1hma h VAL 35 Ca 0.00 -2.75 -0.25 0.00 0.82 0.00 0.00 66.70 64.52 1hma h VAL 35 Cb 0.67 2.50 -0.04 0.00 -1.52 0.00 0.00 31.29 32.89 1hma h VAL 35 CO 0.00 0.79 -1.39 0.00 0.02 0.00 0.00 177.57 176.99 1hma h ALA 36 N 1.14 0.59 -0.49 1.67 0.00 -1.69 -3.26 119.26 117.22 1hma h ALA 36 Ca -0.02 -1.21 -0.04 0.00 0.00 0.00 0.00 54.91 53.64 1hma h ALA 36 Cb 1.45 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.43 1hma h ALA 36 CO 0.11 1.43 0.15 -0.22 0.00 0.00 0.00 179.25 180.72 1hma h LYS 37 N 0.00 0.76 0.00 0.00 3.64 -1.63 -1.80 116.57 117.54 1hma h LYS 37 Ca -0.16 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1hma h LYS 37 Cb 1.90 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.61 1hma h LYS 37 CO 0.10 0.72 0.00 0.00 -2.27 0.00 0.00 179.45 178.01 1hma h ARG 38 N 0.66 0.00 -0.35 1.90 2.47 -1.66 -2.90 114.38 114.50 1hma h ARG 38 Ca 0.16 0.00 -0.16 0.00 -1.26 0.00 0.00 59.98 58.71 1hma h ARG 38 Cb 0.28 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.60 1hma h ARG 38 CO -0.00 0.00 -0.43 0.78 0.56 0.00 0.00 179.97 180.88 1hma h GLY 39 N 2.20 0.97 1.61 0.04 0.00 -1.37 -2.58 103.07 103.94 1hma h GLY 39 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 47.33 46.31 1hma h GLY 39 CO 0.00 0.92 0.00 0.61 0.00 0.00 0.00 176.54 178.07 1hma n GLY 40 N 0.17 -1.06 0.06 4.60 0.00 -1.10 -2.57 105.19 105.30 1hma n GLY 40 Ca -0.03 -0.11 -0.04 0.00 0.00 0.00 0.00 46.02 45.84 1hma n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1hma n GLU 41 N -1.30 0.36 0.26 1.61 1.02 -1.00 -4.03 120.64 117.56 1hma n GLU 41 Ca 0.10 0.38 0.08 0.00 -0.02 0.00 0.00 57.16 57.70 1hma n GLU 41 Cb 0.19 -1.39 0.65 0.00 -0.02 0.00 0.00 31.44 30.86 1hma n GLU 41 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1hma h LEU 42 N -0.76 0.00 0.56 -4.62 3.38 -1.60 -1.82 115.31 110.45 1hma h LEU 42 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1hma h LEU 42 Cb 0.49 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 1hma h LEU 42 CO 0.00 0.01 -0.37 -0.25 0.09 0.00 0.00 178.44 177.92 1hma h TRP 43 N 0.00 -1.00 0.00 1.13 2.91 -1.69 1.20 115.95 118.49 1hma h TRP 43 Ca -0.00 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.01 1hma h TRP 43 Cb 0.02 0.36 0.00 0.00 -0.51 0.00 0.00 29.16 29.03 1hma h TRP 43 CO 0.00 -0.54 0.00 0.54 -1.03 0.00 0.00 178.44 177.41 1hma n ARG 44 N -4.71 0.87 0.00 2.65 1.74 -1.13 -3.03 116.66 113.04 1hma n ARG 44 Ca -0.11 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.97 1hma n ARG 44 Cb 0.37 -1.26 0.00 0.00 -1.02 0.00 0.00 32.46 30.55 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 -0.76 1.73 -1.17 7.54 0.00 -0.70 -4.99 120.51 122.15 1hma n ALA 45 Ca 0.11 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1hma n ALA 45 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.50 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 -0.15 0.00 0.00 0.00 0.00 0.40 -4.94 117.12 112.43 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 0.18 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.40 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 -4.14 3.17 4.76 -1.26 -5.09 118.16 115.59 1hma n LYS 47 Ca 0.00 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.34 1hma n LYS 47 Cb 0.00 0.00 -0.10 0.00 -1.84 0.00 0.00 35.03 33.09 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 -0.74 0.97 -0.19 4.39 1.01 -1.26 -5.03 116.67 115.81 1hma s ASP 48 Ca 0.00 -0.97 0.16 0.00 0.71 0.00 0.00 52.55 52.45 1hma s ASP 48 Cb 0.00 0.11 0.79 0.00 1.01 0.00 0.00 42.92 44.84 1hma s ASP 48 CO 0.00 -0.48 1.71 0.29 0.21 0.00 0.00 175.17 176.90 1hma n LYS 49 N 0.10 4.49 0.13 8.23 5.02 -1.26 -4.20 118.16 130.67 1hma n LYS 49 Ca -0.13 -3.08 0.10 0.00 -2.02 0.00 0.00 58.31 53.18 1hma n LYS 49 Cb 0.60 -2.14 0.04 0.00 -0.02 0.00 0.00 35.03 33.51 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 4.04 0.00 0.06 4.39 0.02 -1.98 -3.02 113.55 117.06 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 1.80 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.34 1hma h SER 50 CO 0.40 0.06 -0.03 -0.08 -1.14 0.00 0.00 176.83 176.04 1hma h GLU 51 N 0.00 -0.08 -0.32 3.45 4.57 -2.02 -2.86 114.58 117.33 1hma h GLU 51 Ca -0.01 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.19 1hma h GLU 51 Cb 1.06 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.64 1hma h GLU 51 CO 0.01 -0.05 0.16 -1.49 -1.18 0.00 0.00 179.01 176.45 1hma h TRP 52 N -0.09 0.30 -0.42 0.92 4.06 -1.87 -2.71 115.95 116.13 1hma h TRP 52 Ca -0.01 0.01 0.04 0.00 2.06 0.00 0.00 58.89 60.99 1hma h TRP 52 Cb 0.06 -0.09 -0.05 0.00 -1.00 0.00 0.00 29.16 28.08 1hma h TRP 52 CO 0.18 0.16 -0.25 0.39 -3.56 0.00 0.00 178.44 175.36 1hma n GLU 53 N -4.95 -0.19 -0.18 0.49 -0.58 -1.14 0.17 120.64 114.27 1hma n GLU 53 Ca -0.00 1.10 0.09 0.00 -0.42 0.00 0.00 57.16 57.93 1hma n GLU 53 Cb 0.07 -1.64 0.40 0.00 -0.57 0.00 0.00 31.44 29.70 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 -0.25 1.82 -0.79 0.62 0.00 -1.41 -1.29 119.26 117.95 1hma h ALA 54 Ca 0.07 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.02 1hma h ALA 54 Cb 0.17 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1hma h ALA 54 CO -0.40 0.03 0.49 -0.22 0.00 0.00 0.00 179.25 179.15 1hma h LYS 55 N 0.65 0.90 -0.14 0.00 3.11 0.21 -0.96 116.57 120.34 1hma h LYS 55 Ca 0.34 -0.05 -0.02 0.00 -2.81 0.00 0.00 60.65 58.10 1hma h LYS 55 Cb 0.46 -0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 31.48 1hma h LYS 55 CO -0.12 0.59 -0.02 0.00 -2.81 0.00 0.00 179.45 177.09 1hma h ALA 56 N 1.36 1.71 -0.53 5.00 0.00 0.45 -2.33 119.26 124.91 1hma h ALA 56 Ca 0.34 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 55.23 1hma h ALA 56 Cb 0.11 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.76 1hma h ALA 56 CO -0.15 0.22 0.14 0.00 0.00 0.00 0.00 179.25 179.47 1hma h ALA 57 N 1.79 0.64 -0.20 0.00 0.00 -1.06 -1.92 119.26 118.50 1hma h ALA 57 Ca 0.05 0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.09 1hma h ALA 57 Cb 0.18 0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 1hma h ALA 57 CO 0.01 -0.27 -0.52 -0.22 0.00 0.00 0.00 179.25 178.25 1hma h LYS 58 N 0.29 -0.50 -0.74 0.00 3.11 -1.42 0.59 116.57 117.90 1hma h LYS 58 Ca 0.27 0.03 0.18 0.00 -2.81 0.00 0.00 60.65 58.33 1hma h LYS 58 Cb 0.35 0.11 -0.04 0.00 -1.00 0.00 0.00 32.23 31.65 1hma h LYS 58 CO -0.32 -0.33 0.51 0.00 -2.81 0.00 0.00 179.45 176.50 1hma h ALA 59 N -0.13 2.40 -0.27 5.00 0.00 -1.52 -0.42 119.26 124.33 1hma h ALA 59 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1hma h ALA 59 Cb 0.65 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1hma h ALA 59 CO -0.47 -0.62 0.17 -0.22 0.00 0.00 0.00 179.25 178.11 1hma h LYS 60 N 0.20 0.36 -0.20 0.00 3.64 0.88 0.82 116.57 122.27 1hma h LYS 60 Ca 0.36 -0.03 -0.19 0.00 -1.27 0.00 0.00 60.65 59.52 1hma h LYS 60 Cb 1.13 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 32.88 1hma h LYS 60 CO -0.07 0.27 -0.62 0.22 -2.27 0.00 0.00 179.45 176.98 1hma h ASP 61 N 0.35 0.90 0.86 4.20 3.58 0.03 -0.92 116.42 125.42 1hma h ASP 61 Ca 0.10 -0.59 0.00 0.00 0.42 0.00 0.00 57.03 56.96 1hma h ASP 61 Cb -0.01 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 40.78 1hma h ASP 61 CO -0.02 1.32 0.00 0.47 -2.88 0.00 0.00 179.24 178.14 1hma n ASP 62 N -4.04 0.00 -0.11 2.28 9.92 -0.61 -2.46 116.55 121.53 1hma n ASP 62 Ca -0.06 0.36 -0.23 0.00 -0.53 0.00 0.00 54.79 54.33 1hma n ASP 62 Cb 0.66 -0.45 -0.12 0.00 -0.64 0.00 0.00 41.12 40.57 1hma n ASP 62 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1hma n TYR 63 N -1.45 0.35 0.03 1.24 9.36 0.28 -2.92 117.16 124.05 1hma n TYR 63 Ca 0.08 0.10 -0.10 0.00 3.32 0.00 0.00 57.90 61.30 1hma n TYR 63 Cb 0.30 -1.04 0.03 0.00 -0.63 0.00 0.00 39.34 38.01 1hma n TYR 63 CO 0.00 0.00 0.00 0.22 0.22 0.00 0.00 176.86 177.30 1hma h ASP 64 N -0.41 0.57 0.20 2.98 3.58 -1.26 -1.06 116.42 121.01 1hma h ASP 64 Ca -0.56 -0.34 -0.26 0.00 0.42 0.00 0.00 57.03 56.28 1hma h ASP 64 Cb 1.77 -0.17 0.02 0.00 1.72 0.00 0.00 39.33 42.67 1hma h ASP 64 CO -0.18 1.07 -1.09 -0.09 -2.88 0.00 0.00 179.24 176.08 1hma h ARG 65 N 0.36 0.55 0.12 0.28 2.43 -1.69 -3.20 114.38 113.24 1hma h ARG 65 Ca -0.02 -0.66 -0.23 0.00 -0.81 0.00 0.00 59.98 58.26 1hma h ARG 65 Cb 1.22 0.20 0.02 0.00 -0.42 0.00 0.00 29.97 30.99 1hma h ARG 65 CO 0.12 1.27 -0.97 0.00 -1.51 0.00 0.00 179.97 178.88 1hma h ALA 66 N 0.49 -0.04 -0.58 2.80 0.00 -1.54 -3.29 119.26 117.10 1hma h ALA 66 Ca -0.13 -0.71 0.09 0.00 0.00 0.00 0.00 54.91 54.16 1hma h ALA 66 Cb 1.75 0.10 -0.07 0.00 0.00 0.00 0.00 17.79 19.57 1hma h ALA 66 CO 0.20 0.50 0.21 -0.39 0.00 0.00 0.00 179.25 179.76 1hma h VAL 67 N -0.06 0.78 -0.99 0.00 -1.51 -1.32 0.18 116.25 113.34 1hma h VAL 67 Ca -0.15 -0.13 0.34 0.00 -1.23 0.00 0.00 66.70 65.52 1hma h VAL 67 Cb 1.71 0.36 -0.16 0.00 -2.13 0.00 0.00 31.29 31.07 1hma h VAL 67 CO 0.18 0.07 0.49 0.11 -1.23 0.00 0.00 177.57 177.20 1hma h LYS 68 N 0.38 0.19 0.15 5.19 1.57 -1.62 1.21 116.57 123.65 1hma h LYS 68 Ca 0.29 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 59.05 1hma h LYS 68 Cb 0.35 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.62 1hma h LYS 68 CO -0.30 0.13 -0.07 1.05 -0.57 0.00 0.00 179.45 179.69 1hma h GLU 69 N 0.20 -0.20 -0.39 3.15 4.11 -0.79 0.54 114.58 121.20 1hma h GLU 69 Ca 0.74 0.01 0.11 0.00 0.07 0.00 0.00 59.36 60.30 1hma h GLU 69 Cb 1.76 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 31.04 1hma h GLU 69 CO -0.68 0.13 0.39 0.35 0.07 0.00 0.00 179.01 179.28 1hma h PHE 70 N -0.55 0.00 0.00 2.06 3.57 0.21 0.13 116.94 122.35 1hma h PHE 70 Ca -0.02 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.48 1hma h PHE 70 Cb 0.42 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.16 1hma h PHE 70 CO 0.03 0.00 -1.60 0.39 -2.23 0.00 0.00 178.31 174.90 1hma n GLU 71 N -3.81 0.56 -1.04 1.11 1.02 0.28 -4.34 120.64 114.43 1hma n GLU 71 Ca 0.07 -0.09 -0.15 0.00 -0.02 0.00 0.00 57.16 56.97 1hma n GLU 71 Cb 0.57 -1.60 -0.09 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 -2.14 5.88 0.19 0.62 0.00 0.44 -4.08 120.51 121.41 1hma n ALA 72 Ca -0.02 -1.84 0.00 0.00 0.00 0.00 0.00 53.44 51.58 1hma n ALA 72 Cb 0.53 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 18.03 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 1.67 -1.94 0.00 0.00 2.85 -1.26 -4.98 115.26 111.60 1hma n ASN 73 Ca 0.36 0.69 0.00 0.00 -0.11 0.00 0.00 54.58 55.52 1hma n ASN 73 Cb 0.72 1.94 0.00 0.00 1.24 0.00 0.00 39.78 43.67 1hma n ASN 73 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76