#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h2s h ALA 24 N 0.00 1.78 -0.08 4.61 0.00 -2.05 -1.82 119.26 121.70 1h2s h ALA 24 Ca 0.00 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 1h2s h ALA 24 Cb 0.00 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.78 1h2s h ALA 24 CO 0.00 0.12 -0.45 -0.39 0.00 0.00 0.00 179.25 178.53 1h2s h VAL 25 N 0.00 1.39 -0.89 0.00 -1.51 -2.05 -0.26 116.25 112.93 1h2s h VAL 25 Ca -0.00 -1.82 0.01 0.00 -1.23 0.00 0.00 66.70 63.65 1h2s h VAL 25 Cb 0.18 2.29 -0.04 0.00 -2.13 0.00 0.00 31.29 31.58 1h2s h VAL 25 CO 0.01 0.54 0.58 -0.26 -1.23 0.00 0.00 177.57 177.21 1h2s h PHE 26 N -0.00 1.13 -0.39 5.19 -1.00 -1.93 0.18 116.94 120.12 1h2s h PHE 26 Ca -0.03 0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.74 1h2s h PHE 26 Cb 1.11 -0.38 -0.02 0.00 3.61 0.00 0.00 35.95 40.27 1h2s h PHE 26 CO 0.12 0.72 0.14 0.82 -1.61 0.00 0.00 178.31 178.50 1h2s h ILE 27 N 1.21 1.21 0.50 -0.55 2.04 -1.31 0.78 117.51 121.38 1h2s h ILE 27 Ca 0.33 -0.66 -0.02 0.00 1.00 0.00 0.00 64.86 65.51 1h2s h ILE 27 Cb -0.12 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1h2s h ILE 27 CO -0.07 0.23 -0.27 0.15 0.00 0.00 0.00 178.15 178.19 1h2s h PHE 28 N 0.48 -0.72 -0.36 1.37 3.57 -0.24 0.27 116.94 121.32 1h2s h PHE 28 Ca 0.13 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.53 1h2s h PHE 28 Cb 0.23 0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.20 1h2s h PHE 28 CO 0.01 -0.43 -0.15 -0.39 -2.23 0.00 0.00 178.31 175.12 1h2s h VAL 29 N -0.72 1.25 -0.35 1.41 -1.51 -1.00 -1.05 116.25 114.28 1h2s h VAL 29 Ca -0.06 -1.16 -0.08 0.00 -1.23 0.00 0.00 66.70 64.17 1h2s h VAL 29 Cb 0.57 1.14 -0.01 0.00 -2.13 0.00 0.00 31.29 30.86 1h2s h VAL 29 CO 0.08 0.39 -0.08 1.23 -1.23 0.00 0.00 177.57 177.96 1h2s h GLY 30 N 0.97 0.73 0.91 5.19 0.00 -0.68 -0.33 103.07 109.87 1h2s h GLY 30 Ca 0.10 -0.60 -0.02 0.00 0.00 0.00 0.00 47.33 46.81 1h2s h GLY 30 CO 0.04 0.55 0.11 0.00 0.00 0.00 0.00 176.54 177.24 1h2s h ALA 31 N 0.82 0.36 -0.56 3.60 0.00 -0.28 -1.78 119.26 121.41 1h2s h ALA 31 Ca 0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1h2s h ALA 31 Cb 0.59 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1h2s h ALA 31 CO 0.03 -0.04 0.28 -0.07 0.00 0.00 0.00 179.25 179.45 1h2s h LEU 32 N 0.30 0.73 -0.82 0.00 3.38 -1.14 -0.05 115.31 117.71 1h2s h LEU 32 Ca 0.09 -0.12 0.04 0.00 0.09 0.00 0.00 57.88 57.98 1h2s h LEU 32 Cb 0.18 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 1h2s h LEU 32 CO -0.01 0.64 0.52 0.74 0.09 0.00 0.00 178.44 180.42 1h2s h THR 33 N 0.76 1.11 -0.59 0.22 2.02 -0.89 0.25 112.91 115.79 1h2s h THR 33 Ca 0.19 -0.34 -0.07 0.00 0.77 0.00 0.00 66.41 66.96 1h2s h THR 33 Cb 0.10 0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.51 1h2s h THR 33 CO -0.03 0.18 0.07 0.58 0.37 0.00 0.00 175.52 176.70 1h2s h VAL 34 N 1.00 1.25 -0.42 3.16 2.07 -0.85 0.35 116.25 122.81 1h2s h VAL 34 Ca 0.33 -1.00 -0.03 0.00 0.82 0.00 0.00 66.70 66.82 1h2s h VAL 34 Cb 0.04 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1h2s h VAL 34 CO -0.12 0.37 0.16 0.25 0.02 0.00 0.00 177.57 178.24 1h2s h LEU 35 N 0.90 0.59 -0.66 2.57 5.85 0.29 -0.56 115.31 124.30 1h2s h LEU 35 Ca 0.18 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1h2s h LEU 35 Cb 0.43 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 1h2s h LEU 35 CO 0.01 0.61 0.25 0.15 -0.34 0.00 0.00 178.44 179.12 1h2s h PHE 36 N 0.54 1.02 -0.77 1.25 3.57 -0.23 -1.87 116.94 120.44 1h2s h PHE 36 Ca 0.14 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.56 1h2s h PHE 36 Cb 0.21 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.61 1h2s h PHE 36 CO 0.00 0.80 0.48 0.78 -2.23 0.00 0.00 178.31 178.15 1h2s h GLY 37 N 0.93 1.11 0.99 2.40 0.00 -0.62 0.11 103.07 107.98 1h2s h GLY 37 Ca 0.22 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 1h2s h GLY 37 CO -0.02 0.43 0.30 0.00 0.00 0.00 0.00 176.54 177.26 1h2s h ALA 38 N 1.26 0.70 -0.29 3.60 0.00 -0.71 0.58 119.26 124.41 1h2s h ALA 38 Ca 0.28 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1h2s h ALA 38 Cb -0.07 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1h2s h ALA 38 CO -0.06 0.22 0.10 0.82 0.00 0.00 0.00 179.25 180.33 1h2s h ILE 39 N 0.73 1.19 -0.31 0.00 2.04 -0.91 0.31 117.51 120.57 1h2s h ILE 39 Ca 0.19 -0.62 0.00 0.00 1.00 0.00 0.00 64.86 65.44 1h2s h ILE 39 Cb 0.04 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 1h2s h ILE 39 CO -0.03 0.21 0.20 0.00 0.00 0.00 0.00 178.15 178.52 1h2s h ALA 40 N 0.93 0.39 -0.78 1.87 0.00 -0.40 -2.11 119.26 119.17 1h2s h ALA 40 Ca 0.09 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.04 1h2s h ALA 40 Cb 0.23 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 1h2s h ALA 40 CO -0.00 -0.13 0.45 -0.92 0.00 0.00 0.00 179.25 178.65 1h2s h TYR 41 N 0.40 0.83 -0.81 0.00 3.20 0.40 -1.63 116.97 119.36 1h2s h TYR 41 Ca 0.11 0.03 0.08 0.00 3.14 0.00 0.00 58.73 62.08 1h2s h TYR 41 Cb -0.02 -0.26 -0.07 0.00 1.54 0.00 0.00 36.73 37.92 1h2s h TYR 41 CO -0.05 0.38 0.48 0.78 -1.64 0.00 0.00 178.16 178.11 1h2s h GLY 42 N 0.80 1.24 1.14 1.82 0.00 -0.30 0.16 103.07 107.93 1h2s h GLY 42 Ca 0.35 -0.33 -0.11 0.00 0.00 0.00 0.00 47.33 47.24 1h2s h GLY 42 CO -0.20 0.18 -0.09 0.83 0.00 0.00 0.00 176.54 177.26 1h2s h GLU 43 N 0.84 1.01 -0.39 4.80 5.08 -0.77 -1.61 114.58 123.53 1h2s h GLU 43 Ca 0.37 -0.36 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 1h2s h GLU 43 Cb 0.26 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1h2s h GLU 43 CO -0.21 1.04 0.08 0.28 -1.00 0.00 0.00 179.01 179.20 1h2s h VAL 44 N 0.90 1.23 -0.41 3.13 2.07 -0.65 -1.80 116.25 120.72 1h2s h VAL 44 Ca 0.14 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 1h2s h VAL 44 Cb 0.65 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 1h2s h VAL 44 CO 0.04 0.28 0.21 0.74 0.02 0.00 0.00 177.57 178.87 1h2s h THR 45 N 0.49 1.16 -0.83 2.57 2.02 -0.88 -0.78 112.91 116.66 1h2s h THR 45 Ca 0.12 -0.44 0.00 0.00 0.77 0.00 0.00 66.41 66.86 1h2s h THR 45 Cb 0.34 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 1h2s h THR 45 CO 0.00 0.17 0.54 0.00 0.37 0.00 0.00 175.52 176.60 1h2s h ALA 46 N 1.06 1.06 -0.53 6.16 0.00 -1.24 -1.66 119.26 124.12 1h2s h ALA 46 Ca 0.14 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1h2s h ALA 46 Cb 0.09 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1h2s h ALA 46 CO -0.02 0.48 0.07 0.00 0.00 0.00 0.00 179.25 179.78 1h2s h ALA 47 N 1.29 0.70 -0.91 0.00 0.00 -1.01 -2.91 119.26 116.43 1h2s h ALA 47 Ca 0.30 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1h2s h ALA 47 Cb -0.10 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.44 1h2s h ALA 47 CO -0.06 0.45 0.60 0.00 0.00 0.00 0.00 179.25 180.24 1h2s h ALA 48 N 0.98 1.36 -0.58 0.00 0.00 -0.69 -1.74 119.26 118.58 1h2s h ALA 48 Ca 0.16 -0.06 0.15 0.00 0.00 0.00 0.00 54.91 55.16 1h2s h ALA 48 Cb 0.43 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1h2s h ALA 48 CO 0.01 0.59 0.41 0.00 0.00 0.00 0.00 179.25 180.26 1h2s h ALA 49 N 1.44 2.40 -0.36 0.00 0.00 -1.11 -0.40 119.26 121.23 1h2s h ALA 49 Ca 0.34 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.09 1h2s h ALA 49 Cb -0.12 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1h2s h ALA 49 CO -0.08 -0.56 -0.33 1.79 0.00 0.00 0.00 179.25 180.07 1h2s h THR 50 N 0.11 1.28 0.00 0.00 1.35 -1.34 -3.47 112.91 110.83 1h2s h THR 50 Ca 0.28 -1.49 0.00 0.00 -0.55 0.00 0.00 66.41 64.65 1h2s h THR 50 Cb 0.96 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 68.73 1h2s h THR 50 CO -0.03 0.49 0.00 0.61 -0.25 0.00 0.00 175.52 176.34 1h2s n GLY 51 N -0.02 0.54 3.49 5.82 0.00 -0.16 -5.05 105.19 109.81 1h2s n GLY 51 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 1h2s n GLY 51 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1h2s s ASP 52 N -2.87 6.28 0.39 1.61 2.15 -1.26 -4.93 116.67 118.04 1h2s s ASP 52 Ca 0.00 -0.54 0.11 0.00 0.43 0.00 0.00 52.55 52.55 1h2s s ASP 52 Cb 0.00 -2.30 0.90 0.00 -0.30 0.00 0.00 42.92 41.22 1h2s s ASP 52 CO 0.00 -0.80 1.94 0.00 -0.17 0.00 0.00 175.17 176.13 1h2s h ALA 53 N 8.91 1.90 -0.62 3.66 0.00 -1.96 -1.09 119.26 130.06 1h2s h ALA 53 Ca -0.26 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 1h2s h ALA 53 Cb 1.10 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 1h2s h ALA 53 CO 0.91 -0.07 0.02 0.00 0.00 0.00 0.00 179.25 180.11 1h2s h ALA 54 N 1.64 0.84 -0.68 0.00 0.00 -1.98 -0.96 119.26 118.12 1h2s h ALA 54 Ca 0.34 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1h2s h ALA 54 Cb 0.56 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1h2s h ALA 54 CO -0.12 0.67 0.17 0.00 0.00 0.00 0.00 179.25 179.97 1h2s h ALA 55 N 1.00 0.89 -0.44 0.00 0.00 -1.58 -1.94 119.26 117.19 1h2s h ALA 55 Ca 0.18 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1h2s h ALA 55 Cb 0.54 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1h2s h ALA 55 CO 0.03 0.61 -0.01 0.28 0.00 0.00 0.00 179.25 180.15 1h2s h VAL 56 N 1.01 1.26 -0.98 0.00 2.07 -1.20 -2.24 116.25 116.17 1h2s h VAL 56 Ca 0.21 -1.06 0.02 0.00 0.82 0.00 0.00 66.70 66.70 1h2s h VAL 56 Cb 0.36 1.07 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 1h2s h VAL 56 CO 0.00 0.36 0.65 -0.61 0.02 0.00 0.00 177.57 177.99 1h2s h GLN 57 N 0.62 1.25 -0.39 1.57 4.15 -0.91 0.68 115.11 122.08 1h2s h GLN 57 Ca 0.12 -0.08 -0.04 0.00 0.77 0.00 0.00 58.65 59.43 1h2s h GLN 57 Cb 0.51 -0.28 -0.02 0.00 0.21 0.00 0.00 27.48 27.90 1h2s h GLN 57 CO 0.02 0.83 0.10 0.93 -1.93 0.00 0.00 178.83 178.78 1h2s h GLU 58 N 1.29 0.62 -0.39 1.69 5.08 -1.19 0.13 114.58 121.80 1h2s h GLU 58 Ca 0.38 -0.15 -0.07 0.00 -1.00 0.00 0.00 59.36 58.52 1h2s h GLU 58 Cb -0.08 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 1h2s h GLU 58 CO -0.10 0.65 -0.03 0.00 -1.00 0.00 0.00 179.01 178.53 1h2s h ALA 59 N 0.94 1.22 -0.17 3.43 0.00 -0.98 -2.15 119.26 121.56 1h2s h ALA 59 Ca 0.12 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1h2s h ALA 59 Cb 0.31 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1h2s h ALA 59 CO 0.00 0.51 -0.31 0.00 0.00 0.00 0.00 179.25 179.46 1h2s h ALA 60 N 1.37 0.27 -0.78 0.00 0.00 -0.53 -1.82 119.26 117.77 1h2s h ALA 60 Ca 0.12 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 1h2s h ALA 60 Cb 0.42 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1h2s h ALA 60 CO 0.02 0.30 0.39 0.28 0.00 0.00 0.00 179.25 180.24 1h2s h VAL 61 N 0.16 1.24 -0.64 0.00 2.07 -0.93 -1.05 116.25 117.11 1h2s h VAL 61 Ca 0.01 -0.65 -0.04 0.00 0.82 0.00 0.00 66.70 66.84 1h2s h VAL 61 Cb 0.89 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1h2s h VAL 61 CO 0.07 0.28 0.23 -1.28 0.02 0.00 0.00 177.57 176.90 1h2s h SER 62 N 1.11 0.90 -0.42 0.57 0.87 -1.32 -1.42 113.55 113.83 1h2s h SER 62 Ca 0.27 -0.18 -0.04 0.00 -1.23 0.00 0.00 61.79 60.60 1h2s h SER 62 Cb 0.08 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 61.79 1h2s h SER 62 CO -0.04 0.84 0.09 0.00 -0.53 0.00 0.00 176.83 177.19 1h2s h ALA 63 N 1.09 0.55 -0.03 6.23 0.00 -0.74 0.17 119.26 126.53 1h2s h ALA 63 Ca 0.21 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1h2s h ALA 63 Cb 0.24 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1h2s h ALA 63 CO -0.01 0.24 0.01 0.82 0.00 0.00 0.00 179.25 180.31 1h2s h ILE 64 N 0.54 1.16 -0.65 0.00 2.04 -1.04 -0.45 117.51 119.11 1h2s h ILE 64 Ca 0.13 -0.48 -0.07 0.00 1.00 0.00 0.00 64.86 65.44 1h2s h ILE 64 Cb 0.33 1.43 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 1h2s h ILE 64 CO 0.00 0.13 0.14 -0.07 0.00 0.00 0.00 178.15 178.35 1h2s h LEU 65 N -0.14 0.99 -0.72 1.44 3.38 -1.24 -1.80 115.31 117.22 1h2s h LEU 65 Ca 0.01 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 1h2s h LEU 65 Cb 0.20 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1h2s h LEU 65 CO -0.00 0.96 0.28 1.23 0.09 0.00 0.00 178.44 181.00 1h2s h GLY 66 N 1.05 1.16 1.33 0.83 0.00 -0.46 -1.01 103.07 105.96 1h2s h GLY 66 Ca 0.20 -0.64 -0.10 0.00 0.00 0.00 0.00 47.33 46.80 1h2s h GLY 66 CO 0.00 0.60 -0.14 1.41 0.00 0.00 0.00 176.54 178.41 1h2s h LEU 67 N 1.03 0.79 -0.52 3.11 3.38 -0.76 0.73 115.31 123.06 1h2s h LEU 67 Ca 0.24 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1h2s h LEU 67 Cb 0.22 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1h2s h LEU 67 CO -0.02 0.94 0.17 0.40 0.09 0.00 0.00 178.44 180.02 1h2s h ILE 68 N 0.71 1.23 -0.48 1.22 2.04 -1.02 -1.42 117.51 119.79 1h2s h ILE 68 Ca 0.11 -0.77 -0.06 0.00 1.00 0.00 0.00 64.86 65.14 1h2s h ILE 68 Cb 0.63 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 1h2s h ILE 68 CO 0.04 0.29 0.07 0.40 0.00 0.00 0.00 178.15 178.95 1h2s h ILE 69 N 0.72 1.25 -0.89 -0.67 2.04 -0.92 -2.10 117.51 116.94 1h2s h ILE 69 Ca 0.17 -0.94 0.09 0.00 1.00 0.00 0.00 64.86 65.18 1h2s h ILE 69 Cb 0.27 0.93 -0.07 0.00 -0.74 0.00 0.00 36.82 37.20 1h2s h ILE 69 CO -0.01 0.33 0.54 0.25 0.00 0.00 0.00 178.15 179.26 1h2s h LEU 70 N 0.67 0.80 -0.83 1.44 5.85 -0.63 0.80 115.31 123.41 1h2s h LEU 70 Ca 0.14 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.91 1h2s h LEU 70 Cb 0.41 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 1h2s h LEU 70 CO 0.01 0.47 0.55 0.25 -0.34 0.00 0.00 178.44 179.37 1h2s h LEU 71 N 0.91 0.96 -0.54 2.25 5.85 -0.87 -0.68 115.31 123.19 1h2s h LEU 71 Ca 0.42 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.11 1h2s h LEU 71 Cb 0.33 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 1h2s h LEU 71 CO -0.23 0.70 0.34 1.23 -0.34 0.00 0.00 178.44 180.14 1h2s h GLY 72 N 1.13 0.78 0.91 3.75 0.00 -0.25 -0.45 103.07 108.94 1h2s h GLY 72 Ca 0.30 -0.31 -0.00 0.00 0.00 0.00 0.00 47.33 47.32 1h2s h GLY 72 CO -0.06 0.30 0.07 -2.22 0.00 0.00 0.00 176.54 174.63 1h2s h ILE 73 N 0.73 1.12 -0.51 2.60 2.04 -0.52 -0.15 117.51 122.81 1h2s h ILE 73 Ca 0.20 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 1h2s h ILE 73 Cb -0.04 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 1h2s h ILE 73 CO -0.04 0.11 0.32 0.78 0.00 0.00 0.00 178.15 179.31 1h2s h ASN 74 N 0.12 0.61 -0.50 1.72 2.35 -0.98 0.32 115.58 119.23 1h2s h ASN 74 Ca 0.05 -0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1h2s h ASN 74 Cb 0.11 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 1h2s h ASN 74 CO -0.01 0.48 0.22 -0.07 -1.65 0.00 0.00 177.43 176.40 1h2s h LEU 75 N 0.69 0.67 -0.67 1.61 4.07 -0.96 -1.49 115.31 119.23 1h2s h LEU 75 Ca 0.19 -0.15 -0.02 0.00 0.08 0.00 0.00 57.88 57.97 1h2s h LEU 75 Cb -0.02 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 41.51 1h2s h LEU 75 CO -0.04 0.63 0.32 1.23 -1.08 0.00 0.00 178.44 179.51 1h2s h GLY 76 N 0.66 1.03 0.97 0.83 0.00 -0.66 -1.59 103.07 104.32 1h2s h GLY 76 Ca 0.17 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 1h2s h GLY 76 CO -0.02 0.49 0.09 -2.00 0.00 0.00 0.00 176.54 175.10 1h2s h LEU 77 N 0.93 0.17 -0.29 3.11 5.85 -0.72 -0.91 115.31 123.45 1h2s h LEU 77 Ca 0.23 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.92 1h2s h LEU 77 Cb 0.12 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1h2s h LEU 77 CO -0.03 0.17 0.15 0.58 -0.34 0.00 0.00 178.44 178.97 1h2s h VAL 78 N 0.16 0.99 -0.25 1.05 2.07 -1.10 -1.36 116.25 117.82 1h2s h VAL 78 Ca 0.05 -0.11 -0.05 0.00 0.82 0.00 0.00 66.70 67.41 1h2s h VAL 78 Cb 0.02 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1h2s h VAL 78 CO -0.01 0.06 -0.07 0.00 0.02 0.00 0.00 177.57 177.56 1h2s h ALA 79 N 1.15 1.42 0.00 1.67 0.00 -1.13 0.56 119.26 122.92 1h2s h ALA 79 Ca 0.12 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 1h2s h ALA 79 Cb 0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1h2s h ALA 79 CO -0.08 0.40 -0.52 0.00 0.00 0.00 0.00 179.25 179.05 1h2s h ALA 80 N 1.56 0.78 0.00 0.00 0.00 -0.72 -3.35 119.26 117.52 1h2s h ALA 80 Ca 0.08 -0.48 -0.38 0.00 0.00 0.00 0.00 54.91 54.13 1h2s h ALA 80 Cb 0.37 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 1h2s h ALA 80 CO 0.02 0.65 -2.42 0.25 0.00 0.00 0.00 179.25 177.76 1h2s n THR 81 N -3.40 1.42 1.24 0.00 -2.24 -0.55 -5.09 114.28 105.65 1h2s n THR 81 Ca 0.01 -0.52 0.13 0.00 -2.27 0.00 0.00 64.05 61.39 1h2s n THR 81 Cb 0.66 -1.43 0.30 0.00 -2.10 0.00 0.00 70.33 67.76 1h2s n THR 81 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68