#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 -1.14 -2.02 6.43 8.00 -1.26 -4.80 116.55 121.76 1hma n ASP 3 Ca 0.00 0.23 -0.24 0.00 0.71 0.00 0.00 54.79 55.49 1hma n ASP 3 Cb 0.00 -0.32 0.03 0.00 -0.02 0.00 0.00 41.12 40.81 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 -2.03 3.49 -1.48 -1.24 0.00 -1.26 -5.05 118.16 110.59 1hma n LYS 4 Ca -0.01 -4.07 -0.29 0.00 0.00 0.00 0.00 58.31 53.94 1hma n LYS 4 Cb 0.08 -2.27 0.14 0.00 0.00 0.00 0.00 35.03 32.99 1hma n LYS 4 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1hma s PRO 5 N -3.61 1.01 -0.86 1.64 0.04 -1.26 -4.84 135.00 127.12 1hma s PRO 5 Ca 0.52 0.32 -0.25 0.00 0.04 0.00 0.00 61.00 61.63 1hma s PRO 5 Cb 0.42 -1.82 -0.17 0.00 0.04 0.00 0.00 34.50 32.96 1hma s PRO 5 CO 0.03 -2.29 2.31 1.17 0.04 0.00 0.00 177.00 178.26 1hma n LYS 6 N -3.84 0.41 -1.02 4.56 4.81 -1.26 -4.79 118.16 117.04 1hma n LYS 6 Ca 0.06 -0.98 -0.45 0.00 -0.87 0.00 0.00 58.31 56.07 1hma n LYS 6 Cb 0.59 -3.55 -0.08 0.00 0.02 0.00 0.00 35.03 32.01 1hma n LYS 6 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 1hma n ARG 7 N 8.38 0.00 -2.83 1.64 1.85 -1.26 -4.76 116.66 119.68 1hma n ARG 7 Ca 0.46 0.00 -0.40 0.00 -1.00 0.00 0.00 57.85 56.91 1hma n ARG 7 Cb 0.42 -1.08 -0.06 0.00 -1.05 0.00 0.00 32.46 30.69 1hma n ARG 7 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1hma s PRO 8 N 3.62 4.75 0.20 2.89 0.04 -1.26 -5.07 135.00 140.17 1hma s PRO 8 Ca 0.83 1.37 -0.10 0.00 0.04 0.00 0.00 61.00 63.14 1hma s PRO 8 Cb -1.08 -3.28 -0.01 0.00 0.04 0.00 0.00 34.50 30.17 1hma s PRO 8 CO 0.51 0.52 0.35 -0.48 0.04 0.00 0.00 177.00 177.94 1hma s LEU 9 N -1.08 0.70 0.79 -3.56 0.05 -1.26 -5.14 118.68 109.18 1hma s LEU 9 Ca 0.40 -0.92 -0.13 0.00 0.05 0.00 0.00 54.13 53.53 1hma s LEU 9 Cb -0.25 1.36 0.08 0.00 -2.05 0.00 0.00 46.19 45.33 1hma s LEU 9 CO 0.30 -0.98 1.19 -0.44 -0.55 0.00 0.00 176.35 175.86 1hma s SER 10 N -3.00 3.76 0.11 1.48 0.01 -1.26 -4.80 113.70 110.01 1hma s SER 10 Ca 0.21 2.29 -0.25 0.00 1.31 0.00 0.00 55.95 59.51 1hma s SER 10 Cb 0.02 -2.58 -0.08 0.00 0.21 0.00 0.00 66.02 63.59 1hma s SER 10 CO 0.04 -2.55 1.66 0.00 0.41 0.00 0.00 173.24 172.81 1hma h ALA 11 N -0.86 -0.27 -0.80 1.44 0.00 -1.90 0.79 119.26 117.65 1hma h ALA 11 Ca -0.46 -0.01 0.23 0.00 0.00 0.00 0.00 54.91 54.67 1hma h ALA 11 Cb 1.29 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 19.35 1hma h ALA 11 CO 0.47 -0.70 0.75 -0.92 0.00 0.00 0.00 179.25 178.85 1hma h TYR 12 N -0.33 0.00 -0.04 0.00 3.20 -1.93 0.31 116.97 118.17 1hma h TYR 12 Ca 0.04 0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.78 1hma h TYR 12 Cb 0.37 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.65 1hma h TYR 12 CO -0.21 0.00 -0.48 0.52 -1.64 0.00 0.00 178.16 176.36 1hma h MET 13 N 0.00 0.40 -0.96 1.82 0.00 -1.19 -2.52 114.93 112.48 1hma h MET 13 Ca 0.38 -0.37 0.14 0.00 0.00 0.00 0.00 59.70 59.85 1hma h MET 13 Cb 1.88 0.09 -0.09 0.00 0.00 0.00 0.00 31.60 33.48 1hma h MET 13 CO -0.00 1.03 0.57 -0.07 0.00 0.00 0.00 176.91 178.44 1hma h LEU 14 N -0.10 0.79 -0.64 1.22 3.38 0.01 0.16 115.31 120.13 1hma h LEU 14 Ca -0.05 0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 1hma h LEU 14 Cb 1.16 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.82 1hma h LEU 14 CO 0.10 0.37 -0.19 -0.25 0.09 0.00 0.00 178.44 178.56 1hma h TRP 15 N 0.84 0.99 -0.86 1.13 7.01 -1.49 -1.45 115.95 122.12 1hma h TRP 15 Ca 0.51 -0.22 0.02 0.00 2.11 0.00 0.00 58.89 61.31 1hma h TRP 15 Cb 0.63 -0.24 -0.05 0.00 -2.10 0.00 0.00 29.16 27.40 1hma h TRP 15 CO -0.03 0.98 0.56 -0.07 -2.79 0.00 0.00 178.44 177.10 1hma h LEU 16 N 0.77 0.96 -0.36 0.65 3.38 -0.28 0.68 115.31 121.11 1hma h LEU 16 Ca 0.11 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 1hma h LEU 16 Cb 0.72 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1hma h LEU 16 CO 0.06 0.68 -0.36 -0.55 0.09 0.00 0.00 178.44 178.35 1hma h ASN 17 N 1.12 0.00 0.26 -0.43 7.08 -1.08 -2.58 115.58 119.95 1hma h ASN 17 Ca 0.33 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.55 1hma h ASN 17 Cb -0.07 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.17 1hma h ASN 17 CO -0.09 0.36 -0.30 -1.54 -2.08 0.00 0.00 177.43 173.78 1hma n SER 18 N -3.27 0.99 -0.57 6.14 3.41 -0.56 -3.63 113.62 116.13 1hma n SER 18 Ca 0.02 -0.84 0.06 0.00 -0.26 0.00 0.00 58.87 57.85 1hma n SER 18 Cb 0.61 0.16 0.08 0.00 -0.26 0.00 0.00 64.21 64.81 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 -0.73 2.42 0.08 7.33 0.00 0.23 -4.52 120.51 125.31 1hma n ALA 19 Ca 0.11 -0.73 0.17 0.00 0.00 0.00 0.00 53.44 52.99 1hma n ALA 19 Cb 0.35 -0.45 0.68 0.00 0.00 0.00 0.00 19.45 20.03 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 2.49 0.00 0.01 0.00 3.08 -1.53 0.73 114.38 119.16 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 0.59 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.64 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 -0.02 0.00 0.04 4.81 -1.86 -2.01 114.58 115.55 1hma h GLU 21 Ca 0.17 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 1hma h GLU 21 Cb 0.70 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.09 1hma h GLU 21 CO -0.00 0.70 0.00 -1.13 -0.73 0.00 0.00 179.01 177.85 1hma n SER 22 N -4.68 0.00 -0.10 1.04 3.41 -0.92 -1.88 113.62 110.49 1hma n SER 22 Ca -0.08 -0.02 -0.24 0.00 -0.26 0.00 0.00 58.87 58.27 1hma n SER 22 Cb 0.35 -0.25 -0.11 0.00 -0.26 0.00 0.00 64.21 63.93 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 -1.25 1.57 0.28 -1.33 5.41 0.25 -3.28 119.36 121.01 1hma n ILE 23 Ca 0.08 -0.30 0.17 0.00 1.00 0.00 0.00 62.75 63.70 1hma n ILE 23 Cb 0.12 -1.88 0.62 0.00 -0.71 0.00 0.00 39.64 37.80 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 -0.72 0.00 0.00 0.38 1.79 -1.22 -2.65 116.57 114.15 1hma h LYS 24 Ca -0.50 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.97 1hma h LYS 24 Cb 1.59 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.24 1hma h LYS 24 CO -0.22 0.00 0.00 0.54 -1.08 0.00 0.00 179.45 178.69 1hma n ARG 25 N -3.05 0.00 -0.35 3.15 1.74 -0.78 -4.20 116.66 113.16 1hma n ARG 25 Ca 0.01 0.06 0.36 0.00 -0.77 0.00 0.00 57.85 57.51 1hma n ARG 25 Cb 0.33 -0.39 0.64 0.00 -1.02 0.00 0.00 32.46 32.01 1hma n ARG 25 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1hma h GLU 26 N 0.00 0.00 -6.38 5.56 4.39 -1.71 -3.38 114.58 113.06 1hma h GLU 26 Ca 0.00 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 59.15 1hma h GLU 26 Cb 0.00 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.61 1hma h GLU 26 CO 0.00 0.00 -0.07 -0.80 -1.16 0.00 0.00 179.01 176.98 1hma s ASN 27 N -4.01 6.79 -1.30 1.42 -0.87 -1.00 -4.98 114.94 110.99 1hma s ASN 27 Ca -0.04 1.07 -0.17 0.00 -1.57 0.00 0.00 52.86 52.15 1hma s ASN 27 Cb 0.19 -2.28 0.01 0.00 -0.02 0.00 0.00 41.25 39.15 1hma s ASN 27 CO 0.66 0.05 2.06 -0.81 -2.57 0.00 0.00 177.10 176.48 1hma n PRO 28 N 0.55 2.66 -2.36 -0.60 -0.04 -1.26 -4.38 135.00 129.57 1hma n PRO 28 Ca -0.04 -2.63 -0.05 0.00 -0.04 0.00 0.00 63.50 60.74 1hma n PRO 28 Cb 0.52 -3.31 -0.00 0.00 -0.04 0.00 0.00 33.50 30.67 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 4.55 -0.42 2.69 0.55 0.00 -1.26 -4.75 105.19 106.55 1hma n GLY 29 Ca 0.51 0.00 -0.32 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 -2.73 0.00 -1.64 -0.61 3.06 -1.26 -4.91 119.36 111.27 1hma n ILE 30 Ca -0.06 -0.42 -0.30 0.00 -2.50 0.00 0.00 62.75 59.48 1hma n ILE 30 Cb 0.51 0.00 0.18 0.00 0.54 0.00 0.00 39.64 40.87 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 -0.99 0.43 0.44 9.51 3.01 -1.26 -4.85 119.74 126.03 1hma s LYS 31 Ca 0.45 -0.13 0.24 0.00 -1.01 0.00 0.00 55.97 55.53 1hma s LYS 31 Cb -0.37 -1.80 0.53 0.00 -1.01 0.00 0.00 37.83 35.18 1hma s LYS 31 CO 0.58 -2.60 1.67 -0.24 0.51 0.00 0.00 175.35 175.27 1hma h VAL 32 N -1.78 0.14 -0.00 3.17 3.04 -2.00 -2.25 116.25 116.56 1hma h VAL 32 Ca -0.46 -1.06 0.00 0.00 -1.01 0.00 0.00 66.70 64.17 1hma h VAL 32 Cb 1.28 1.95 0.00 0.00 -2.01 0.00 0.00 31.29 32.51 1hma h VAL 32 CO 0.45 0.07 -0.01 0.35 -1.01 0.00 0.00 177.57 177.42 1hma n THR 33 N -3.13 0.00 -0.31 3.17 -2.24 -1.26 -3.54 114.28 106.97 1hma n THR 33 Ca 0.03 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1hma n THR 33 Cb 0.51 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.49 1hma n THR 33 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1hma n GLU 34 N -0.75 1.01 0.11 -0.78 1.02 -1.12 -4.72 120.64 115.41 1hma n GLU 34 Ca 0.22 -0.16 -0.05 0.00 -0.02 0.00 0.00 57.16 57.15 1hma n GLU 34 Cb 0.19 -0.56 -0.02 0.00 -0.02 0.00 0.00 31.44 31.02 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 0.31 0.00 -0.66 2.62 2.07 -1.45 -2.07 116.25 117.07 1hma h VAL 35 Ca 0.00 -0.26 0.15 0.00 0.82 0.00 0.00 66.70 67.41 1hma h VAL 35 Cb 0.15 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 29.89 1hma h VAL 35 CO 0.00 0.00 0.45 0.00 0.02 0.00 0.00 177.57 178.04 1hma h ALA 36 N -1.59 2.30 -0.34 1.67 0.00 -1.88 0.11 119.26 119.53 1hma h ALA 36 Ca -0.03 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1hma h ALA 36 Cb 0.25 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1hma h ALA 36 CO 0.05 -0.48 -0.26 -0.22 0.00 0.00 0.00 179.25 178.34 1hma h LYS 37 N 0.23 0.70 0.00 0.00 3.64 -1.84 -2.71 116.57 116.59 1hma h LYS 37 Ca 0.32 -0.29 -0.06 0.00 -1.27 0.00 0.00 60.65 59.34 1hma h LYS 37 Cb 0.93 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.72 1hma h LYS 37 CO -0.06 0.89 -0.28 0.00 -2.27 0.00 0.00 179.45 177.73 1hma h ARG 38 N 0.61 0.00 0.00 1.90 -0.00 -0.10 -3.06 114.38 113.72 1hma h ARG 38 Ca 0.08 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.56 1hma h ARG 38 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.73 1hma h ARG 38 CO 0.06 0.28 0.00 0.78 0.00 0.00 0.00 179.97 181.09 1hma h GLY 39 N 3.33 0.00 1.81 0.04 0.00 -0.80 -2.33 103.07 105.13 1hma h GLY 39 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1hma h GLY 39 CO 0.04 0.00 -0.10 0.61 0.00 0.00 0.00 176.54 177.09 1hma n GLY 40 N 0.18 -1.48 0.13 4.60 0.00 -1.16 -2.24 105.19 105.23 1hma n GLY 40 Ca 0.02 -0.14 -0.20 0.00 0.00 0.00 0.00 46.02 45.70 1hma n GLY 40 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1hma h GLU 41 N 0.00 0.32 0.00 1.61 4.11 -1.56 -3.30 114.58 115.77 1hma h GLU 41 Ca 0.00 -0.54 -0.24 0.00 0.07 0.00 0.00 59.36 58.65 1hma h GLU 41 Cb 0.54 0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.95 1hma h GLU 41 CO 0.00 1.21 -1.26 -0.07 0.07 0.00 0.00 179.01 178.96 1hma h LEU 42 N 0.09 0.00 0.96 3.06 3.38 -1.61 -2.82 115.31 118.36 1hma h LEU 42 Ca -0.33 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.59 1hma h LEU 42 Cb 2.06 -0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.82 1hma h LEU 42 CO 0.16 1.00 -0.48 -0.25 0.09 0.00 0.00 178.44 178.96 1hma h TRP 43 N 0.00 -1.25 0.00 1.13 2.91 -1.60 1.20 115.95 118.34 1hma h TRP 43 Ca -0.11 -0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.88 1hma h TRP 43 Cb 1.86 0.42 0.00 0.00 -0.51 0.00 0.00 29.16 30.93 1hma h TRP 43 CO 0.00 -0.76 0.00 -2.13 -1.03 0.00 0.00 178.44 174.52 1hma n ARG 44 N -5.66 0.27 -0.04 2.65 3.00 -1.24 -3.10 116.66 112.54 1hma n ARG 44 Ca -0.16 0.05 0.04 0.00 -0.00 0.00 0.00 57.85 57.77 1hma n ARG 44 Cb 0.52 -1.50 0.05 0.00 0.00 0.00 0.00 32.46 31.54 1hma n ARG 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1hma n ALA 45 N -1.35 2.37 -1.00 5.13 0.00 -0.96 -4.92 120.51 119.78 1hma n ALA 45 Ca 0.11 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.82 1hma n ALA 45 Cb 0.23 -0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.43 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 0.32 0.00 0.00 0.00 0.00 0.41 -4.94 117.12 112.91 1hma n MET 46 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.75 1hma n MET 46 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.46 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 -2.27 3.17 4.76 -1.26 -5.09 118.16 117.48 1hma n LYS 47 Ca 0.00 0.00 -0.04 0.00 -2.87 0.00 0.00 58.31 55.40 1hma n LYS 47 Cb 0.00 -0.14 -0.01 0.00 -1.84 0.00 0.00 35.03 33.04 1hma n LYS 47 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1hma n ASP 48 N -1.84 -0.43 0.00 4.39 9.92 -1.26 -5.06 116.55 122.27 1hma n ASP 48 Ca 0.00 -1.56 0.00 0.00 -0.53 0.00 0.00 54.79 52.70 1hma n ASP 48 Cb 0.00 0.79 0.00 0.00 -0.64 0.00 0.00 41.12 41.27 1hma n ASP 48 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1hma n LYS 49 N -0.17 4.78 0.28 -1.24 4.01 -1.26 -4.61 118.16 119.95 1hma n LYS 49 Ca 0.00 -0.08 0.19 0.00 -0.51 0.00 0.00 58.31 57.90 1hma n LYS 49 Cb 0.18 -0.53 0.87 0.00 -0.51 0.00 0.00 35.03 35.03 1hma n LYS 49 CO 0.00 0.00 0.00 0.77 -1.11 0.00 0.00 177.40 177.06 1hma h SER 50 N 0.00 0.00 0.00 4.39 0.02 -1.97 -0.55 113.55 115.43 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 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.55 1hma h SER 50 CO 0.00 0.00 0.00 1.21 -1.14 0.00 0.00 176.83 176.90 1hma n GLU 51 N -2.98 0.00 0.11 3.45 4.07 -1.26 -2.60 120.64 121.43 1hma n GLU 51 Ca -0.01 0.47 -0.13 0.00 -0.06 0.00 0.00 57.16 57.43 1hma n GLU 51 Cb 0.20 -1.35 -0.08 0.00 -0.06 0.00 0.00 31.44 30.15 1hma n GLU 51 CO 0.00 0.00 0.00 -1.49 -0.06 0.00 0.00 177.13 175.58 1hma h TRP 52 N 0.00 -0.22 -0.73 4.31 4.06 -1.88 -2.78 115.95 118.72 1hma h TRP 52 Ca 0.00 -0.01 0.10 0.00 2.06 0.00 0.00 58.89 61.04 1hma h TRP 52 Cb 0.00 0.07 -0.11 0.00 -1.00 0.00 0.00 29.16 28.12 1hma h TRP 52 CO 0.17 -0.05 -0.33 0.39 -3.56 0.00 0.00 178.44 175.06 1hma n GLU 53 N -5.14 -0.22 -0.24 0.49 1.02 -0.22 0.24 120.64 116.57 1hma n GLU 53 Ca -0.09 1.11 -0.06 0.00 -0.02 0.00 0.00 57.16 58.10 1hma n GLU 53 Cb 0.15 -1.65 0.05 0.00 -0.02 0.00 0.00 31.44 29.97 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 0.80 0.87 -1.00 0.62 0.00 -1.41 -2.24 119.26 116.91 1hma h ALA 54 Ca 0.21 -0.14 0.14 0.00 0.00 0.00 0.00 54.91 55.12 1hma h ALA 54 Cb 0.39 -0.27 -0.09 0.00 0.00 0.00 0.00 17.79 17.83 1hma h ALA 54 CO -0.71 0.43 0.63 0.87 0.00 0.00 0.00 179.25 180.46 1hma h LYS 55 N 0.94 0.90 -0.87 0.00 1.57 0.35 0.15 116.57 119.61 1hma h LYS 55 Ca 0.23 -0.05 0.11 0.00 -1.87 0.00 0.00 60.65 59.07 1hma h LYS 55 Cb 0.11 -0.20 -0.06 0.00 0.08 0.00 0.00 32.23 32.15 1hma h LYS 55 CO -0.03 0.60 0.56 0.00 -0.57 0.00 0.00 179.45 180.01 1hma h ALA 56 N 1.57 1.74 -0.47 3.86 0.00 -0.12 0.62 119.26 126.45 1hma h ALA 56 Ca 0.51 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.43 1hma h ALA 56 Cb 0.60 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1hma h ALA 56 CO -0.29 0.06 0.31 0.00 0.00 0.00 0.00 179.25 179.34 1hma h ALA 57 N 1.58 0.60 -0.55 0.00 0.00 -0.69 -2.34 119.26 117.86 1hma h ALA 57 Ca 0.42 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.37 1hma h ALA 57 Cb 0.54 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 1hma h ALA 57 CO -0.18 0.04 0.23 -0.22 0.00 0.00 0.00 179.25 179.12 1hma h LYS 58 N 0.63 0.42 0.00 0.00 1.63 -0.70 0.22 116.57 118.77 1hma h LYS 58 Ca 0.17 -0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.95 1hma h LYS 58 Cb -0.07 -0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 31.47 1hma h LYS 58 CO -0.04 0.28 -0.02 0.00 -3.45 0.00 0.00 179.45 176.22 1hma h ALA 59 N 1.35 1.78 0.79 5.00 0.00 -0.96 -0.49 119.26 126.72 1hma h ALA 59 Ca 0.26 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 1hma h ALA 59 Cb 0.26 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.06 1hma h ALA 59 CO -0.24 0.02 -0.38 -0.22 0.00 0.00 0.00 179.25 178.43 1hma h LYS 60 N 0.00 -1.02 0.00 0.00 3.64 -0.08 0.48 116.57 119.58 1hma h LYS 60 Ca -0.00 0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1hma h LYS 60 Cb 0.03 0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1hma h LYS 60 CO 0.00 -0.68 -0.11 -0.44 -2.27 0.00 0.00 179.45 175.95 1hma h ASP 61 N -1.28 0.00 0.85 4.20 5.19 -1.12 -0.17 116.42 124.09 1hma h ASP 61 Ca -0.11 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.30 1hma h ASP 61 Cb 0.81 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.32 1hma h ASP 61 CO 0.18 0.11 -0.45 -0.67 -3.12 0.00 0.00 179.24 175.28 1hma n ASP 62 N -3.80 0.58 0.02 6.45 2.03 -0.22 -2.75 116.55 118.86 1hma n ASP 62 Ca -0.02 0.12 -0.22 0.00 0.52 0.00 0.00 54.79 55.18 1hma n ASP 62 Cb 0.21 0.01 -0.14 0.00 -0.72 0.00 0.00 41.12 40.47 1hma n ASP 62 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 1hma h TYR 63 N 0.00 0.50 -0.04 -0.67 5.03 0.17 -0.09 116.97 121.87 1hma h TYR 63 Ca 0.00 -0.37 -0.16 0.00 2.58 0.00 0.00 58.73 60.78 1hma h TYR 63 Cb 0.65 -0.02 -0.01 0.00 1.55 0.00 0.00 36.73 38.90 1hma h TYR 63 CO 0.00 1.64 -0.70 0.22 -1.32 0.00 0.00 178.16 178.00 1hma h ASP 64 N -0.15 0.26 0.24 -2.11 1.82 -1.43 -2.62 116.42 112.43 1hma h ASP 64 Ca -0.35 -0.17 -0.34 0.00 -0.39 0.00 0.00 57.03 55.78 1hma h ASP 64 Cb 1.89 -0.08 0.01 0.00 0.68 0.00 0.00 39.33 41.83 1hma h ASP 64 CO 0.08 0.87 -1.72 -0.09 -1.61 0.00 0.00 179.24 176.77 1hma h ARG 65 N 0.15 0.36 0.00 0.28 1.12 -1.65 -3.33 114.38 111.32 1hma h ARG 65 Ca -0.02 -0.62 -0.03 0.00 -1.11 0.00 0.00 59.98 58.19 1hma h ARG 65 Cb 1.24 0.23 -0.00 0.00 -0.01 0.00 0.00 29.97 31.43 1hma h ARG 65 CO 0.11 1.27 -0.17 0.00 -3.11 0.00 0.00 179.97 178.07 1hma h ALA 66 N 0.19 1.18 -0.04 2.80 0.00 -1.05 -1.81 119.26 120.55 1hma h ALA 66 Ca -0.33 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.33 1hma h ALA 66 Cb 2.09 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.84 1hma h ALA 66 CO 0.17 0.21 -0.44 -0.39 0.00 0.00 0.00 179.25 178.80 1hma h VAL 67 N 0.00 1.32 0.52 0.00 -1.51 -1.57 0.19 116.25 115.20 1hma h VAL 67 Ca -0.00 -1.56 -0.03 0.00 -1.23 0.00 0.00 66.70 63.88 1hma h VAL 67 Cb 0.49 1.79 0.01 0.00 -2.13 0.00 0.00 31.29 31.45 1hma h VAL 67 CO 0.02 0.45 -0.25 0.50 -1.23 0.00 0.00 177.57 177.06 1hma h LYS 68 N 0.07 -0.67 -0.36 5.19 3.64 -1.44 1.22 116.57 124.22 1hma h LYS 68 Ca 0.00 0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.47 1hma h LYS 68 Cb 0.82 0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.77 1hma h LYS 68 CO 0.06 -0.38 0.24 0.93 -2.27 0.00 0.00 179.45 178.04 1hma h GLU 69 N -1.07 0.33 -0.01 1.90 4.39 -1.50 0.24 114.58 118.87 1hma h GLU 69 Ca -0.07 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.49 1hma h GLU 69 Cb 0.61 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.16 1hma h GLU 69 CO 0.12 0.22 -0.55 0.35 -1.16 0.00 0.00 179.01 177.99 1hma h PHE 70 N 0.34 0.02 0.00 4.33 3.57 -0.36 -2.63 116.94 122.21 1hma h PHE 70 Ca 0.15 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1hma h PHE 70 Cb 0.18 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.92 1hma h PHE 70 CO -0.00 0.56 -0.51 0.93 -2.23 0.00 0.00 178.31 177.06 1hma h GLU 71 N 0.01 0.00 -0.97 1.11 4.39 0.46 -3.28 114.58 116.31 1hma h GLU 71 Ca -0.00 0.00 -0.41 0.00 0.34 0.00 0.00 59.36 59.28 1hma h GLU 71 Cb 0.97 0.00 -0.24 0.00 -0.10 0.00 0.00 28.75 29.38 1hma h GLU 71 CO 0.07 0.00 0.52 0.00 -1.16 0.00 0.00 179.01 178.44 1hma n ALA 72 N -1.84 5.05 -0.02 3.43 0.00 0.23 -4.20 120.51 123.16 1hma n ALA 72 Ca 0.04 -2.42 0.09 0.00 0.00 0.00 0.00 53.44 51.15 1hma n ALA 72 Cb 0.44 -1.36 -0.17 0.00 0.00 0.00 0.00 19.45 18.36 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 -0.80 0.03 -0.66 0.00 6.94 -1.23 -5.00 115.26 114.54 1hma n ASN 73 Ca 0.49 0.00 0.13 0.00 -0.02 0.00 0.00 54.58 55.18 1hma n ASN 73 Cb 1.48 1.91 0.36 0.00 -2.36 0.00 0.00 39.78 41.17 1hma n ASN 73 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84