#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 -4.70 -3.46 2.03 -1.26 -4.67 116.55 104.49 1hma n ASP 3 Ca 0.00 -0.16 -0.42 0.00 0.52 0.00 0.00 54.79 54.73 1hma n ASP 3 Cb 0.00 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.37 1hma n ASP 3 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1hma s LYS 4 N 1.65 4.14 0.78 -0.67 2.20 -1.26 -4.72 119.74 121.86 1hma s LYS 4 Ca 0.00 2.57 -0.11 0.00 -0.36 0.00 0.00 55.97 58.07 1hma s LYS 4 Cb 0.00 -3.51 0.06 0.00 -1.51 0.00 0.00 37.83 32.87 1hma s LYS 4 CO 0.00 -0.82 1.10 -1.25 -0.36 0.00 0.00 175.35 174.02 1hma s PRO 5 N 2.48 2.20 -0.87 4.03 0.04 -1.26 -4.91 135.00 136.71 1hma s PRO 5 Ca 0.79 0.62 -0.25 0.00 0.04 0.00 0.00 61.00 62.20 1hma s PRO 5 Cb -0.46 -1.93 -0.06 0.00 0.04 0.00 0.00 34.50 32.09 1hma s PRO 5 CO 0.35 -1.53 2.02 0.15 0.04 0.00 0.00 177.00 178.03 1hma s LYS 6 N -5.19 2.40 0.59 4.56 1.02 -1.26 -4.92 119.74 116.94 1hma s LYS 6 Ca 0.60 -0.13 -0.18 0.00 0.02 0.00 0.00 55.97 56.28 1hma s LYS 6 Cb -0.14 -5.00 -0.07 0.00 -0.52 0.00 0.00 37.83 32.11 1hma s LYS 6 CO 0.54 -3.53 0.75 0.54 -0.92 0.00 0.00 175.35 172.73 1hma n ARG 7 N 8.86 0.70 -2.44 1.68 1.74 -1.26 -4.83 116.66 121.10 1hma n ARG 7 Ca 0.41 0.27 -0.39 0.00 -0.77 0.00 0.00 57.85 57.37 1hma n ARG 7 Cb 0.47 -1.94 -0.04 0.00 -1.02 0.00 0.00 32.46 29.92 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 -2.45 4.48 0.01 5.56 0.04 -1.26 -5.02 135.00 136.36 1hma s PRO 8 Ca 0.73 1.78 0.00 0.00 0.04 0.00 0.00 61.00 63.55 1hma s PRO 8 Cb -0.43 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.10 1hma s PRO 8 CO 0.50 0.07 0.02 1.47 0.04 0.00 0.00 177.00 179.10 1hma n LEU 9 N 0.83 0.00 -4.83 -3.56 -0.00 -1.26 -5.11 117.00 103.06 1hma n LEU 9 Ca 0.01 -0.11 -0.32 0.00 -0.00 0.00 0.00 56.01 55.59 1hma n LEU 9 Cb 0.46 0.09 0.01 0.00 -0.00 0.00 0.00 43.42 43.97 1hma n LEU 9 CO 0.52 -0.02 0.71 -0.44 -0.00 0.00 0.00 177.39 178.16 1hma s SER 10 N -1.08 6.04 0.02 1.45 0.01 -1.26 -4.89 113.70 113.98 1hma s SER 10 Ca 0.01 1.62 -0.25 0.00 1.31 0.00 0.00 55.95 58.65 1hma s SER 10 Cb -0.00 -2.51 -0.18 0.00 0.21 0.00 0.00 66.02 63.54 1hma s SER 10 CO 0.01 -0.99 1.43 0.00 0.41 0.00 0.00 173.24 174.09 1hma h ALA 11 N 0.19 -0.03 -0.17 1.44 0.00 -1.91 -2.11 119.26 116.68 1hma h ALA 11 Ca -0.46 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.35 1hma h ALA 11 Cb 1.20 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1hma h ALA 11 CO 0.59 -0.36 0.43 -0.92 0.00 0.00 0.00 179.25 178.99 1hma h TYR 12 N -0.34 0.00 0.06 0.00 3.20 -1.95 0.88 116.97 118.81 1hma h TYR 12 Ca -0.00 0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.77 1hma h TYR 12 Cb 0.32 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.60 1hma h TYR 12 CO 0.03 0.00 -0.41 0.52 -1.64 0.00 0.00 178.16 176.66 1hma h MET 13 N 0.00 0.18 -0.53 1.82 2.86 -1.77 -2.43 114.93 115.05 1hma h MET 13 Ca 0.08 -0.27 0.11 0.00 -2.06 0.00 0.00 59.70 57.56 1hma h MET 13 Cb 0.95 0.09 -0.10 0.00 0.06 0.00 0.00 31.60 32.60 1hma h MET 13 CO -0.00 1.09 -0.15 -0.07 1.06 0.00 0.00 176.91 178.84 1hma h LEU 14 N -0.60 -0.55 -0.99 1.22 3.38 -0.50 0.45 115.31 117.70 1hma h LEU 14 Ca -0.07 0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1hma h LEU 14 Cb 1.28 0.35 -0.04 0.00 0.09 0.00 0.00 40.66 42.34 1hma h LEU 14 CO 0.08 -0.19 0.42 -0.25 0.09 0.00 0.00 178.44 178.58 1hma h TRP 15 N -0.02 1.12 -0.92 1.13 7.01 -1.59 -1.53 115.95 121.15 1hma h TRP 15 Ca 0.25 -0.03 0.15 0.00 2.11 0.00 0.00 58.89 61.37 1hma h TRP 15 Cb 0.41 -0.35 -0.08 0.00 -2.10 0.00 0.00 29.16 27.04 1hma h TRP 15 CO -0.46 0.79 0.59 1.25 -2.79 0.00 0.00 178.44 177.81 1hma h LEU 16 N 1.13 0.68 -0.25 0.65 7.12 0.35 0.00 115.31 124.99 1hma h LEU 16 Ca 0.28 0.05 -0.21 0.00 0.13 0.00 0.00 57.88 58.13 1hma h LEU 16 Cb 0.06 -0.09 0.00 0.00 -0.53 0.00 0.00 40.66 40.11 1hma h LEU 16 CO -0.04 0.33 -0.84 0.78 -0.13 0.00 0.00 178.44 178.54 1hma h ASN 17 N 0.71 0.62 0.59 1.25 2.35 -0.18 0.26 115.58 121.19 1hma h ASN 17 Ca 0.47 -0.45 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1hma h ASN 17 Cb 0.75 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.93 1hma h ASN 17 CO -0.23 1.22 0.00 -1.54 -1.65 0.00 0.00 177.43 175.23 1hma n SER 18 N -3.83 0.00 0.00 5.81 3.41 -0.17 -2.98 113.62 115.86 1hma n SER 18 Ca -0.06 0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.82 1hma n SER 18 Cb 0.77 -0.41 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 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 -1.41 1.79 -0.21 7.33 0.00 -0.27 -4.71 120.51 123.03 1hma n ALA 19 Ca 0.07 -0.44 -0.01 0.00 0.00 0.00 0.00 53.44 53.06 1hma n ALA 19 Cb 0.21 0.00 0.20 0.00 0.00 0.00 0.00 19.45 19.86 1hma n ALA 19 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1hma h ARG 20 N 0.00 0.98 0.04 0.00 2.43 -0.37 0.87 114.38 118.34 1hma h ARG 20 Ca 0.00 -0.11 -0.13 0.00 -0.81 0.00 0.00 59.98 58.93 1hma h ARG 20 Cb 0.22 -0.19 0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1hma h ARG 20 CO 0.00 0.73 -0.52 0.93 -1.51 0.00 0.00 179.97 179.60 1hma h GLU 21 N 0.99 0.28 0.00 0.20 5.08 -1.85 -2.51 114.58 116.77 1hma h GLU 21 Ca 0.25 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1hma h GLU 21 Cb 0.05 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1hma h GLU 21 CO -0.04 1.09 0.00 0.43 -1.00 0.00 0.00 179.01 179.49 1hma n SER 22 N -4.30 0.00 -0.06 1.42 7.64 -1.10 -2.11 113.62 115.10 1hma n SER 22 Ca -0.11 0.08 -0.22 0.00 1.01 0.00 0.00 58.87 59.63 1hma n SER 22 Cb 0.66 -0.32 -0.12 0.00 -1.01 0.00 0.00 64.21 63.41 1hma n SER 22 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1hma h ILE 23 N 0.00 0.83 0.00 0.44 2.04 0.86 -3.27 117.51 118.41 1hma h ILE 23 Ca 0.00 -2.24 -0.10 0.00 1.00 0.00 0.00 64.86 63.52 1hma h ILE 23 Cb 0.23 2.33 -0.01 0.00 -0.74 0.00 0.00 36.82 38.62 1hma h ILE 23 CO 0.00 0.51 -0.49 0.11 0.00 0.00 0.00 178.15 178.28 1hma h LYS 24 N -0.64 0.00 0.18 2.37 1.57 -1.38 -1.47 116.57 117.20 1hma h LYS 24 Ca -0.37 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.40 1hma h LYS 24 Cb 1.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.87 1hma h LYS 24 CO -0.11 0.49 -0.09 0.00 -0.57 0.00 0.00 179.45 179.18 1hma h ARG 25 N 0.00 -0.23 -0.11 3.15 3.08 -1.58 -3.10 114.38 115.59 1hma h ARG 25 Ca -0.00 0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.09 1hma h ARG 25 Cb 0.93 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 31.03 1hma h ARG 25 CO 0.06 -0.15 0.11 0.93 -1.07 0.00 0.00 179.97 179.85 1hma h GLU 26 N -0.32 0.00 -6.53 0.04 5.08 -1.65 -3.42 114.58 107.79 1hma h GLU 26 Ca -0.02 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.81 1hma h GLU 26 Cb 0.18 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1hma h GLU 26 CO 0.04 0.00 -0.08 -0.80 -1.00 0.00 0.00 179.01 177.17 1hma s ASN 27 N -6.26 6.54 -1.31 1.42 0.01 -0.55 -4.97 114.94 109.81 1hma s ASN 27 Ca -0.05 0.87 -0.16 0.00 -0.71 0.00 0.00 52.86 52.81 1hma s ASN 27 Cb 0.16 -2.21 0.00 0.00 0.41 0.00 0.00 41.25 39.61 1hma s ASN 27 CO 0.60 -0.18 2.12 -0.81 -1.51 0.00 0.00 177.10 177.32 1hma n PRO 28 N -0.67 2.59 -2.34 -0.60 -0.04 -1.26 -4.37 135.00 128.31 1hma n PRO 28 Ca -0.00 -2.51 -0.06 0.00 -0.04 0.00 0.00 63.50 60.88 1hma n PRO 28 Cb 0.53 -3.25 -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 4.34 -0.39 2.68 0.55 0.00 -1.25 -4.74 105.19 106.37 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 -2.80 0.27 -1.29 -0.61 3.06 -1.26 -4.87 119.36 111.86 1hma n ILE 30 Ca -0.07 -0.41 -0.30 0.00 -2.50 0.00 0.00 62.75 59.46 1hma n ILE 30 Cb 0.52 0.00 0.11 0.00 0.54 0.00 0.00 39.64 40.82 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 -0.82 1.75 0.49 9.51 3.01 -1.26 -4.81 119.74 127.60 1hma s LYS 31 Ca 0.48 0.90 0.26 0.00 -1.01 0.00 0.00 55.97 56.60 1hma s LYS 31 Cb -0.47 -1.86 1.23 0.00 -1.01 0.00 0.00 37.83 35.72 1hma s LYS 31 CO 0.53 -1.93 1.97 -0.24 0.51 0.00 0.00 175.35 176.19 1hma h VAL 32 N -1.32 0.56 0.01 3.17 3.04 -1.99 -0.64 116.25 119.06 1hma h VAL 32 Ca -0.47 -0.79 -0.22 0.00 -1.01 0.00 0.00 66.70 64.21 1hma h VAL 32 Cb 1.26 1.53 -0.00 0.00 -2.01 0.00 0.00 31.29 32.07 1hma h VAL 32 CO 0.54 0.16 -0.93 0.71 -1.01 0.00 0.00 177.57 177.05 1hma h THR 33 N 0.00 1.43 -0.00 3.17 1.35 -2.01 -3.13 112.91 113.72 1hma h THR 33 Ca -0.00 -2.52 0.00 0.00 -0.55 0.00 0.00 66.41 63.34 1hma h THR 33 Cb 0.51 2.45 0.00 0.00 -1.73 0.00 0.00 68.15 69.38 1hma h THR 33 CO 0.02 0.75 -0.37 -0.62 -0.25 0.00 0.00 175.52 175.05 1hma n GLU 34 N -3.71 0.41 0.11 4.72 1.02 -0.99 -3.82 120.64 118.38 1hma n GLU 34 Ca -0.06 -0.23 -0.04 0.00 -0.02 0.00 0.00 57.16 56.81 1hma n GLU 34 Cb 0.83 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.83 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 0.57 1.53 0.14 2.62 2.07 -1.06 -3.06 116.25 119.05 1hma h VAL 35 Ca 0.00 -2.53 -0.28 0.00 0.82 0.00 0.00 66.70 64.70 1hma h VAL 35 Cb 0.50 2.37 0.01 0.00 -1.52 0.00 0.00 31.29 32.64 1hma h VAL 35 CO 0.00 0.72 -1.30 0.00 0.02 0.00 0.00 177.57 177.02 1hma h ALA 36 N 1.24 0.08 -0.92 1.67 0.00 -1.66 -1.13 119.26 118.53 1hma h ALA 36 Ca -0.01 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.00 1hma h ALA 36 Cb 1.32 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.12 1hma h ALA 36 CO 0.10 0.96 0.58 -0.22 0.00 0.00 0.00 179.25 180.67 1hma h LYS 37 N 0.08 1.23 0.12 0.00 3.64 -1.68 -1.80 116.57 118.16 1hma h LYS 37 Ca -0.16 -0.09 -0.29 0.00 -1.27 0.00 0.00 60.65 58.84 1hma h LYS 37 Cb 2.00 -0.27 -0.00 0.00 -0.41 0.00 0.00 32.23 33.55 1hma h LYS 37 CO 0.21 0.84 -1.40 -0.09 -2.27 0.00 0.00 179.45 176.73 1hma h ARG 38 N 1.26 0.25 0.00 1.90 9.65 -1.60 -3.25 114.38 122.59 1hma h ARG 38 Ca 0.33 -0.43 -0.00 0.00 -1.10 0.00 0.00 59.98 58.78 1hma h ARG 38 Cb -0.10 0.16 -0.00 0.00 -1.39 0.00 0.00 29.97 28.64 1hma h ARG 38 CO -0.07 1.15 -0.01 0.78 2.80 0.00 0.00 179.97 184.62 1hma h GLY 39 N 1.69 0.00 2.00 2.80 0.00 -0.86 -0.69 103.07 108.01 1hma h GLY 39 Ca -0.19 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.05 1hma h GLY 39 CO 0.18 0.00 -0.39 -1.33 0.00 0.00 0.00 176.54 175.00 1hma h GLY 40 N 0.24 0.00 0.29 4.60 0.00 -1.36 -2.17 103.07 104.67 1hma h GLY 40 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1hma h GLY 40 CO 0.00 0.00 -0.02 1.05 0.00 0.00 0.00 176.54 177.57 1hma h GLU 41 N 0.00 0.02 -0.44 4.80 4.11 -1.24 -3.03 114.58 118.79 1hma h GLU 41 Ca -0.00 -0.02 -0.11 0.00 0.07 0.00 0.00 59.36 59.30 1hma h GLU 41 Cb 1.16 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 1hma h GLU 41 CO 0.05 0.75 -0.16 -0.07 0.07 0.00 0.00 179.01 179.65 1hma h LEU 42 N -0.70 0.85 -0.42 3.06 3.38 -1.62 0.13 115.31 119.99 1hma h LEU 42 Ca -0.00 -0.28 0.08 0.00 0.09 0.00 0.00 57.88 57.77 1hma h LEU 42 Cb 0.75 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 41.20 1hma h LEU 42 CO 0.00 1.00 -0.05 -0.25 0.09 0.00 0.00 178.44 179.24 1hma h TRP 43 N 0.75 -0.12 -0.01 1.13 2.91 -1.45 0.40 115.95 119.56 1hma h TRP 43 Ca 0.11 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.17 1hma h TRP 43 Cb 0.67 0.11 0.00 0.00 -0.51 0.00 0.00 29.16 29.44 1hma h TRP 43 CO 0.04 -0.13 -0.10 -2.13 -1.03 0.00 0.00 178.44 175.09 1hma n ARG 44 N -5.25 1.43 0.00 2.65 0.63 -1.14 -3.77 116.66 111.21 1hma n ARG 44 Ca 0.03 -0.89 0.08 0.00 -0.92 0.00 0.00 57.85 56.15 1hma n ARG 44 Cb 0.22 -1.48 0.01 0.00 0.45 0.00 0.00 32.46 31.66 1hma n ARG 44 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1hma n ALA 45 N -0.01 3.08 -1.18 5.13 0.00 0.43 -4.88 120.51 123.08 1hma n ALA 45 Ca 0.16 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1hma n ALA 45 Cb 0.38 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.27 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 -0.00 0.00 0.00 0.00 0.00 0.12 -4.98 117.12 112.27 1hma n MET 46 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.77 1hma n MET 46 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.56 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 -1.27 3.17 5.02 -1.26 -5.11 118.16 118.71 1hma n LYS 47 Ca 0.00 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1hma n LYS 47 Cb 0.00 -0.05 0.00 0.00 -0.02 0.00 0.00 35.03 34.96 1hma n LYS 47 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1hma n ASP 48 N -1.52 -0.03 -0.02 4.39 8.00 -1.26 -5.06 116.55 121.05 1hma n ASP 48 Ca 0.00 -1.03 0.02 0.00 0.71 0.00 0.00 54.79 54.49 1hma n ASP 48 Cb 0.00 0.05 -0.08 0.00 -0.02 0.00 0.00 41.12 41.07 1hma n ASP 48 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1hma n LYS 49 N -0.01 1.08 -0.17 -1.24 4.01 -1.26 -4.47 118.16 116.10 1hma n LYS 49 Ca -0.00 -0.06 0.29 0.00 -0.51 0.00 0.00 58.31 58.03 1hma n LYS 49 Cb 0.01 -1.26 0.65 0.00 -0.51 0.00 0.00 35.03 33.92 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 0.37 4.39 0.87 -1.97 0.92 113.55 118.13 1hma h SER 50 Ca -0.10 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.44 1hma h SER 50 Cb 0.92 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.89 1hma h SER 50 CO 0.01 0.00 -0.18 -0.33 -0.53 0.00 0.00 176.83 175.80 1hma h GLU 51 N 0.00 -0.48 0.52 2.24 5.08 -2.00 -2.67 114.58 117.27 1hma h GLU 51 Ca 0.44 0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.81 1hma h GLU 51 Cb 2.20 0.11 0.01 0.00 0.50 0.00 0.00 28.75 31.56 1hma h GLU 51 CO -0.00 -0.32 -0.25 -1.49 -1.00 0.00 0.00 179.01 175.95 1hma h TRP 52 N -0.54 -0.65 -0.47 4.33 4.06 -1.50 -2.55 115.95 118.63 1hma h TRP 52 Ca -0.05 -0.02 0.04 0.00 2.06 0.00 0.00 58.89 60.93 1hma h TRP 52 Cb 0.38 0.21 -0.06 0.00 -1.00 0.00 0.00 29.16 28.70 1hma h TRP 52 CO 0.12 -0.37 -0.28 0.39 -3.56 0.00 0.00 178.44 174.75 1hma n GLU 53 N -5.25 -0.21 -0.31 0.49 1.02 0.19 0.22 120.64 116.79 1hma n GLU 53 Ca -0.09 0.92 0.01 0.00 -0.02 0.00 0.00 57.16 57.98 1hma n GLU 53 Cb 0.30 -1.36 0.14 0.00 -0.02 0.00 0.00 31.44 30.49 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 0.02 1.18 -0.89 0.62 0.00 -1.57 -0.74 119.26 117.88 1hma h ALA 54 Ca 0.07 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.13 1hma h ALA 54 Cb 0.19 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 17.68 1hma h ALA 54 CO -0.44 0.28 0.58 -0.22 0.00 0.00 0.00 179.25 179.45 1hma h LYS 55 N 0.98 0.65 -0.66 0.00 3.64 0.32 -0.29 116.57 121.20 1hma h LYS 55 Ca 0.38 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.72 1hma h LYS 55 Cb 0.17 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 1hma h LYS 55 CO -0.17 0.43 0.44 0.00 -2.27 0.00 0.00 179.45 177.87 1hma h ALA 56 N 1.60 0.84 -0.26 5.00 0.00 0.80 -2.31 119.26 124.93 1hma h ALA 56 Ca 0.45 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.38 1hma h ALA 56 Cb 0.77 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 1hma h ALA 56 CO -0.21 0.26 -0.16 0.00 0.00 0.00 0.00 179.25 179.13 1hma h ALA 57 N 1.24 0.02 -0.22 0.00 0.00 -1.00 -1.07 119.26 118.23 1hma h ALA 57 Ca 0.24 0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.30 1hma h ALA 57 Cb -0.10 0.37 -0.07 0.00 0.00 0.00 0.00 17.79 18.00 1hma h ALA 57 CO -0.06 -0.57 -0.45 -0.22 0.00 0.00 0.00 179.25 177.95 1hma h LYS 58 N -0.15 -0.44 -0.95 0.00 3.64 -1.27 0.56 116.57 117.96 1hma h LYS 58 Ca 0.14 0.03 0.22 0.00 -1.27 0.00 0.00 60.65 59.77 1hma h LYS 58 Cb 0.36 0.10 -0.08 0.00 -0.41 0.00 0.00 32.23 32.21 1hma h LYS 58 CO -0.35 -0.29 0.62 0.00 -2.27 0.00 0.00 179.45 177.16 1hma h ALA 59 N 0.12 2.19 0.37 5.00 0.00 -1.11 -0.82 119.26 125.00 1hma h ALA 59 Ca 0.09 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1hma h ALA 59 Cb 0.62 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1hma h ALA 59 CO -0.47 -0.50 -0.49 -0.22 0.00 0.00 0.00 179.25 177.57 1hma h LYS 60 N 0.43 -0.87 -0.06 0.00 3.64 0.14 1.28 116.57 121.13 1hma h LYS 60 Ca 0.51 0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.96 1hma h LYS 60 Cb 1.24 0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 33.24 1hma h LYS 60 CO -0.21 -0.58 -0.04 0.22 -2.27 0.00 0.00 179.45 176.57 1hma h ASP 61 N -0.90 -0.13 0.36 4.20 3.58 -0.49 0.56 116.42 123.60 1hma h ASP 61 Ca -0.04 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.44 1hma h ASP 61 Cb 0.82 0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.94 1hma h ASP 61 CO -0.13 -0.06 0.00 0.47 -2.88 0.00 0.00 179.24 176.64 1hma n ASP 62 N -5.16 0.00 -0.09 2.28 8.00 -0.71 -2.84 116.55 118.02 1hma n ASP 62 Ca -0.05 0.04 -0.21 0.00 0.71 0.00 0.00 54.79 55.28 1hma n ASP 62 Cb 0.09 -0.29 -0.12 0.00 -0.02 0.00 0.00 41.12 40.77 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 -1.29 0.42 0.02 1.24 9.36 0.44 -2.96 117.16 124.39 1hma n TYR 63 Ca 0.09 0.11 -0.08 0.00 3.32 0.00 0.00 57.90 61.33 1hma n TYR 63 Cb 0.15 -1.05 0.09 0.00 -0.63 0.00 0.00 39.34 37.89 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 -0.23 0.54 0.26 2.98 3.58 -0.96 -0.85 116.42 121.75 1hma h ASP 64 Ca -0.54 -0.28 -0.30 0.00 0.42 0.00 0.00 57.03 56.33 1hma h ASP 64 Cb 1.84 -0.16 0.03 0.00 1.72 0.00 0.00 39.33 42.76 1hma h ASP 64 CO -0.11 0.96 -1.30 -0.09 -2.88 0.00 0.00 179.24 175.83 1hma h ARG 65 N 0.39 0.53 0.12 0.28 2.43 -1.72 -3.34 114.38 113.07 1hma h ARG 65 Ca 0.01 -0.78 -0.20 0.00 -0.81 0.00 0.00 59.98 58.21 1hma h ARG 65 Cb 1.04 0.27 0.02 0.00 -0.42 0.00 0.00 29.97 30.88 1hma h ARG 65 CO 0.09 1.36 -0.85 0.00 -1.51 0.00 0.00 179.97 179.06 1hma h ALA 66 N 0.33 -0.06 -1.01 2.80 0.00 -1.53 -3.28 119.26 116.51 1hma h ALA 66 Ca -0.19 -0.69 0.30 0.00 0.00 0.00 0.00 54.91 54.33 1hma h ALA 66 Cb 1.98 0.09 -0.14 0.00 0.00 0.00 0.00 17.79 19.72 1hma h ALA 66 CO 0.24 0.41 0.59 -0.39 0.00 0.00 0.00 179.25 180.10 1hma h VAL 67 N -0.24 0.39 -0.41 0.00 -1.51 -1.30 0.60 116.25 113.77 1hma h VAL 67 Ca -0.14 -0.14 0.09 0.00 -1.23 0.00 0.00 66.70 65.27 1hma h VAL 67 Cb 1.63 -0.07 -0.09 0.00 -2.13 0.00 0.00 31.29 30.64 1hma h VAL 67 CO 0.16 0.08 -0.19 0.50 -1.23 0.00 0.00 177.57 176.88 1hma h LYS 68 N 0.41 -0.11 -0.95 5.19 3.64 -1.67 1.10 116.57 124.19 1hma h LYS 68 Ca 0.70 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 60.14 1hma h LYS 68 Cb 1.53 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 33.31 1hma h LYS 68 CO -0.55 -0.07 0.61 0.93 -2.27 0.00 0.00 179.45 178.10 1hma h GLU 69 N -0.11 1.11 0.00 1.90 5.08 0.02 0.35 114.58 122.93 1hma h GLU 69 Ca 0.20 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.46 1hma h GLU 69 Cb 0.42 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1hma h GLU 69 CO -0.48 0.73 -0.18 0.35 -1.00 0.00 0.00 179.01 178.43 1hma h PHE 70 N 1.14 0.00 0.00 4.33 3.57 0.95 -2.23 116.94 124.69 1hma h PHE 70 Ca 0.40 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.90 1hma h PHE 70 Cb 0.09 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.83 1hma h PHE 70 CO -0.01 0.18 -0.95 0.39 -2.23 0.00 0.00 178.31 175.69 1hma n GLU 71 N -3.79 0.07 -0.53 1.11 1.02 0.34 -4.17 120.64 114.68 1hma n GLU 71 Ca -0.02 -0.01 -0.10 0.00 -0.02 0.00 0.00 57.16 57.01 1hma n GLU 71 Cb 0.28 -1.51 0.06 0.00 -0.02 0.00 0.00 31.44 30.26 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 -1.58 3.89 -1.06 0.62 0.00 0.10 -3.98 120.51 118.51 1hma n ALA 72 Ca 0.04 -1.17 0.08 0.00 0.00 0.00 0.00 53.44 52.38 1hma n ALA 72 Cb 0.36 -1.20 0.23 0.00 0.00 0.00 0.00 19.45 18.84 1hma n ALA 72 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1hma n ASN 73 N -0.05 3.37 0.00 0.00 6.94 -1.26 -5.02 115.26 119.24 1hma n ASN 73 Ca 0.24 -3.11 0.00 0.00 -0.02 0.00 0.00 54.58 51.68 1hma n ASN 73 Cb 0.90 -0.53 0.00 0.00 -2.36 0.00 0.00 39.78 37.80 1hma n ASN 73 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84