#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ydz n HIS 2 N 0.00 3.48 -3.03 3.52 -0.00 -1.26 -4.93 115.22 113.00 1ydz n HIS 2 Ca 0.00 -3.32 -0.40 0.00 -0.00 0.00 0.00 57.72 54.00 1ydz n HIS 2 Cb 0.00 -0.77 -0.05 0.00 -0.00 0.00 0.00 29.99 29.17 1ydz n HIS 2 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1ydz s LEU 3 N -3.84 4.32 0.35 0.27 1.02 -1.26 -5.03 118.68 114.50 1ydz s LEU 3 Ca 0.45 1.21 -0.28 0.00 0.02 0.00 0.00 54.13 55.54 1ydz s LEU 3 Cb 0.26 -3.10 -0.09 0.00 0.02 0.00 0.00 46.19 43.27 1ydz s LEU 3 CO -0.15 -0.12 1.23 -0.89 0.02 0.00 0.00 176.35 176.44 1ydz s THR 4 N 0.79 2.97 0.28 5.49 2.01 -1.26 -4.75 115.64 121.17 1ydz s THR 4 Ca 0.38 0.92 -0.03 0.00 0.31 0.00 0.00 61.69 63.27 1ydz s THR 4 Cb -0.18 -3.56 0.35 0.00 0.01 0.00 0.00 72.50 69.12 1ydz s THR 4 CO 0.19 0.18 1.60 -0.65 -0.69 0.00 0.00 174.62 175.24 1ydz h PRO 5 N 3.17 0.06 -0.40 4.92 0.11 -1.98 2.16 132.00 140.04 1ydz h PRO 5 Ca -0.49 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.59 1ydz h PRO 5 Cb 1.23 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 1ydz h PRO 5 CO 0.65 0.04 0.11 0.93 -0.21 0.00 0.00 178.00 179.52 1ydz h GLU 6 N 0.06 0.63 -0.05 1.05 3.07 -2.01 -2.72 114.58 114.61 1ydz h GLU 6 Ca 0.51 -0.14 -0.11 0.00 -0.50 0.00 0.00 59.36 59.11 1ydz h GLU 6 Cb 0.97 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.78 1ydz h GLU 6 CO -0.81 0.64 -0.48 0.93 -1.40 0.00 0.00 179.01 177.89 1ydz h GLU 7 N 0.50 0.13 0.00 2.33 5.08 0.86 -2.93 114.58 120.55 1ydz h GLU 7 Ca 0.13 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 1ydz h GLU 7 Cb 0.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 1ydz h GLU 7 CO -0.00 0.59 -0.33 0.87 -1.00 0.00 0.00 179.01 179.14 1ydz h LYS 8 N 0.11 0.00 0.15 2.33 1.57 0.33 -2.70 116.57 118.35 1ydz h LYS 8 Ca 0.00 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.47 1ydz h LYS 8 Cb 0.89 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.21 1ydz h LYS 8 CO 0.07 0.33 -1.50 1.03 -0.57 0.00 0.00 179.45 178.80 1ydz h SER 9 N 0.00 0.50 -0.13 0.86 0.87 -1.34 -2.51 113.55 111.79 1ydz h SER 9 Ca -0.00 -0.64 0.01 0.00 -1.23 0.00 0.00 61.79 59.92 1ydz h SER 9 Cb 0.73 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.52 1ydz h SER 9 CO 0.04 1.52 0.06 0.00 -0.53 0.00 0.00 176.83 177.93 1ydz h ALA 10 N 0.40 0.15 0.43 6.23 0.00 -1.46 0.63 119.26 125.65 1ydz h ALA 10 Ca -0.24 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1ydz h ALA 10 Cb 2.05 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.80 1ydz h ALA 10 CO 0.19 -0.38 -0.39 0.28 0.00 0.00 0.00 179.25 178.95 1ydz h VAL 11 N 0.14 0.20 -0.44 0.00 2.07 -1.59 -2.41 116.25 114.21 1ydz h VAL 11 Ca 0.05 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.67 1ydz h VAL 11 Cb 0.02 0.20 -0.09 0.00 -1.52 0.00 0.00 31.29 29.90 1ydz h VAL 11 CO -0.04 0.00 -0.23 0.74 0.02 0.00 0.00 177.57 178.05 1ydz h THR 12 N -0.83 0.34 -0.01 2.57 2.02 -1.14 -2.60 112.91 113.25 1ydz h THR 12 Ca -0.04 0.00 -0.18 0.00 0.77 0.00 0.00 66.41 66.96 1ydz h THR 12 Cb 0.73 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 1ydz h THR 12 CO -0.04 0.00 -0.79 0.00 0.37 0.00 0.00 175.52 175.06 1ydz h ALA 13 N 1.10 0.64 -0.11 6.16 0.00 0.36 -2.81 119.26 124.60 1ydz h ALA 13 Ca 0.21 -0.68 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1ydz h ALA 13 Cb 0.47 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ydz h ALA 13 CO -0.53 0.88 -0.01 1.25 0.00 0.00 0.00 179.25 180.83 1ydz h LEU 14 N 0.10 0.19 -1.12 0.00 7.12 -1.34 -2.80 115.31 117.46 1ydz h LEU 14 Ca -0.03 -0.34 0.16 0.00 0.13 0.00 0.00 57.88 57.79 1ydz h LEU 14 Cb 1.38 -0.05 -0.09 0.00 -0.53 0.00 0.00 40.66 41.37 1ydz h LEU 14 CO 0.12 0.49 0.61 -0.25 -0.13 0.00 0.00 178.44 179.28 1ydz h TRP 15 N -0.11 0.99 -0.91 1.25 2.91 -1.51 0.25 115.95 118.82 1ydz h TRP 15 Ca 0.03 0.03 0.21 0.00 1.13 0.00 0.00 58.89 60.28 1ydz h TRP 15 Cb 0.40 -0.31 -0.07 0.00 -0.51 0.00 0.00 29.16 28.68 1ydz h TRP 15 CO 0.04 0.32 0.60 0.78 -1.03 0.00 0.00 178.44 179.15 1ydz h GLY 16 N 0.80 0.89 -0.89 2.65 0.00 -1.22 0.55 103.07 105.83 1ydz h GLY 16 Ca 0.51 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1ydz h GLY 16 CO -0.28 -0.01 0.00 0.28 0.00 0.00 0.00 176.54 176.53 1ydz n LYS 17 N -4.52 1.75 -2.63 4.80 5.02 0.86 -4.93 118.16 118.51 1ydz n LYS 17 Ca 0.19 -1.13 -0.42 0.00 -2.02 0.00 0.00 58.31 54.94 1ydz n LYS 17 Cb 0.70 -1.38 -0.03 0.00 -0.02 0.00 0.00 35.03 34.30 1ydz n LYS 17 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ydz s VAL 18 N -1.75 4.48 -1.03 -0.18 1.01 0.19 -4.96 120.40 118.16 1ydz s VAL 18 Ca 0.31 1.88 -0.17 0.00 0.00 0.00 0.00 61.98 64.00 1ydz s VAL 18 Cb 0.17 -4.20 0.14 0.00 0.00 0.00 0.00 36.38 32.49 1ydz s VAL 18 CO 0.25 0.20 1.25 0.21 0.00 0.00 0.00 175.10 177.01 1ydz s ASN 19 N 0.64 6.79 0.24 3.32 3.84 -1.26 -4.87 114.94 123.62 1ydz s ASN 19 Ca 0.52 -2.38 -0.13 0.00 0.21 0.00 0.00 52.86 51.08 1ydz s ASN 19 Cb -0.24 -2.40 0.30 0.00 -0.55 0.00 0.00 41.25 38.36 1ydz s ASN 19 CO 0.30 -0.96 1.59 0.58 -2.79 0.00 0.00 177.10 175.81 1ydz h VAL 20 N 5.43 0.16 0.11 -5.21 2.07 -1.94 0.44 116.25 117.30 1ydz h VAL 20 Ca 0.22 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.75 1ydz h VAL 20 Cb 0.97 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 1ydz h VAL 20 CO 1.16 0.00 -0.44 0.44 0.02 0.00 0.00 177.57 178.75 1ydz h ASP 21 N -0.03 -1.32 0.62 0.57 5.19 -1.94 -0.40 116.42 119.12 1ydz h ASP 21 Ca 0.36 0.14 -0.03 0.00 -0.62 0.00 0.00 57.03 56.88 1ydz h ASP 21 Cb 0.59 0.48 -0.00 0.00 0.18 0.00 0.00 39.33 40.59 1ydz h ASP 21 CO -0.84 -0.47 -0.34 -0.33 -3.12 0.00 0.00 179.24 174.14 1ydz h GLU 22 N -0.63 -0.86 -0.19 3.56 5.08 -1.57 -2.82 114.58 117.14 1ydz h GLU 22 Ca -0.01 0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.44 1ydz h GLU 22 Cb 0.63 0.20 -0.03 0.00 0.50 0.00 0.00 28.75 30.05 1ydz h GLU 22 CO -0.23 -0.58 0.01 0.28 -1.00 0.00 0.00 179.01 177.49 1ydz h VAL 23 N -0.90 0.88 -0.66 3.13 2.07 -0.24 -3.03 116.25 117.50 1ydz h VAL 23 Ca -0.08 -0.02 0.08 0.00 0.82 0.00 0.00 66.70 67.49 1ydz h VAL 23 Cb 0.71 0.80 -0.10 0.00 -1.52 0.00 0.00 31.29 31.18 1ydz h VAL 23 CO 0.11 0.01 -0.53 1.23 0.02 0.00 0.00 177.57 178.40 1ydz h GLY 24 N 0.07 -0.78 1.75 2.17 0.00 -1.05 -2.32 103.07 102.90 1ydz h GLY 24 Ca 0.09 0.70 -0.05 0.00 0.00 0.00 0.00 47.33 48.07 1ydz h GLY 24 CO -0.14 -0.08 -0.09 -1.33 0.00 0.00 0.00 176.54 174.89 1ydz h GLY 25 N -0.22 0.34 1.57 4.60 0.00 -1.49 -3.06 103.07 104.81 1ydz h GLY 25 Ca 0.14 -0.20 -0.27 0.00 0.00 0.00 0.00 47.33 46.99 1ydz h GLY 25 CO -0.74 0.19 -1.29 -2.09 0.00 0.00 0.00 176.54 172.61 1ydz h GLU 26 N 0.30 0.23 -0.20 4.80 4.81 -1.36 -1.66 114.58 121.50 1ydz h GLU 26 Ca 0.06 -0.39 -0.08 0.00 -0.13 0.00 0.00 59.36 58.82 1ydz h GLU 26 Cb 0.36 0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.88 1ydz h GLU 26 CO 0.02 1.16 -0.20 0.00 -0.73 0.00 0.00 179.01 179.25 1ydz h ALA 27 N 0.62 0.29 -0.08 2.92 0.00 -1.43 0.56 119.26 122.14 1ydz h ALA 27 Ca -0.15 -0.36 -0.18 0.00 0.00 0.00 0.00 54.91 54.23 1ydz h ALA 27 Cb 1.96 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.68 1ydz h ALA 27 CO 0.18 0.23 -0.72 1.25 0.00 0.00 0.00 179.25 180.19 1ydz h LEU 28 N 0.16 0.47 0.29 0.00 5.85 -1.64 -0.41 115.31 120.03 1ydz h LEU 28 Ca 0.03 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 1ydz h LEU 28 Cb 0.75 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.64 1ydz h LEU 28 CO 0.05 1.05 -0.14 1.23 -0.34 0.00 0.00 178.44 180.29 1ydz h GLY 29 N 1.29 -0.41 2.00 3.75 0.00 -1.18 -2.26 103.07 106.26 1ydz h GLY 29 Ca -0.03 0.15 -0.03 0.00 0.00 0.00 0.00 47.33 47.42 1ydz h GLY 29 CO 0.12 -0.15 -0.15 3.21 0.00 0.00 0.00 176.54 179.57 1ydz h ARG 30 N -0.42 0.00 0.91 4.80 3.08 0.17 -2.19 114.38 120.73 1ydz h ARG 30 Ca -0.04 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 1ydz h ARG 30 Cb 0.32 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.38 1ydz h ARG 30 CO 0.07 0.15 -0.46 1.25 -1.07 0.00 0.00 179.97 179.91 1ydz h LEU 31 N 0.00 -1.10 -1.42 3.04 5.85 -0.49 0.27 115.31 121.46 1ydz h LEU 31 Ca -0.00 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.80 1ydz h LEU 31 Cb 0.35 0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.63 1ydz h LEU 31 CO 0.02 -0.76 0.43 -0.07 -0.34 0.00 0.00 178.44 177.71 1ydz h LEU 32 N -1.25 0.65 0.04 2.25 3.38 -1.43 -0.26 115.31 118.68 1ydz h LEU 32 Ca -0.13 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 1ydz h LEU 32 Cb 0.97 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1ydz h LEU 32 CO 0.19 0.45 -0.02 0.58 0.09 0.00 0.00 178.44 179.73 1ydz h VAL 33 N 0.76 1.36 -0.09 1.22 2.07 -1.23 -3.08 116.25 117.26 1ydz h VAL 33 Ca 0.26 -1.65 -0.15 0.00 0.82 0.00 0.00 66.70 65.98 1ydz h VAL 33 Cb 0.09 2.40 -0.01 0.00 -1.52 0.00 0.00 31.29 32.25 1ydz h VAL 33 CO -0.07 0.40 -0.60 0.58 0.02 0.00 0.00 177.57 177.90 1ydz h VAL 34 N -0.82 1.37 -2.37 2.57 2.07 -0.39 -3.37 116.25 115.32 1ydz h VAL 34 Ca -0.01 -1.95 -0.60 0.00 0.82 0.00 0.00 66.70 64.97 1ydz h VAL 34 Cb 0.69 1.97 -0.41 0.00 -1.52 0.00 0.00 31.29 32.01 1ydz h VAL 34 CO 0.01 0.58 -0.73 -1.22 0.02 0.00 0.00 177.57 176.23 1ydz n TYR 35 N -3.89 2.30 -0.27 1.57 4.01 -0.12 -5.01 117.16 115.75 1ydz n TYR 35 Ca -0.03 -3.99 0.18 0.00 -0.16 0.00 0.00 57.90 53.91 1ydz n TYR 35 Cb 0.62 -0.45 0.35 0.00 -0.31 0.00 0.00 39.34 39.54 1ydz n TYR 35 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1ydz n PRO 36 N 1.41 -0.06 0.24 -0.72 -0.04 -1.16 -1.07 135.00 133.60 1ydz n PRO 36 Ca 0.26 1.16 0.18 0.00 -0.04 0.00 0.00 63.50 65.05 1ydz n PRO 36 Cb 0.43 -1.94 0.88 0.00 -0.04 0.00 0.00 33.50 32.82 1ydz n PRO 36 CO 0.00 0.00 0.00 0.11 -0.04 0.00 0.00 175.50 175.57 1ydz h TRP 37 N 0.00 0.00 0.00 0.54 0.09 -1.93 -0.84 115.95 113.81 1ydz h TRP 37 Ca 0.58 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.56 1ydz h TRP 37 Cb 1.38 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.62 1ydz h TRP 37 CO -0.22 0.00 0.00 1.79 0.09 0.00 0.00 178.44 180.10 1ydz h THR 38 N 0.00 0.00 -0.00 0.12 1.35 -1.43 -2.25 112.91 110.70 1ydz h THR 38 Ca 0.06 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 1ydz h THR 38 Cb 0.50 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 1ydz h THR 38 CO -0.00 0.00 -0.07 0.00 -0.25 0.00 0.00 175.52 175.20 1ydz n GLN 39 N -2.30 0.23 0.14 4.72 6.02 -0.32 -3.65 117.38 122.22 1ydz n GLN 39 Ca 0.01 -0.03 0.11 0.00 -0.01 0.00 0.00 57.00 57.07 1ydz n GLN 39 Cb 0.19 -1.50 0.52 0.00 1.02 0.00 0.00 30.24 30.47 1ydz n GLN 39 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 1ydz n ARG 40 N -1.36 0.14 -0.01 -1.09 1.85 -0.85 -1.86 116.66 113.50 1ydz n ARG 40 Ca 0.10 0.56 0.11 0.00 -1.00 0.00 0.00 57.85 57.62 1ydz n ARG 40 Cb 0.30 -1.90 -0.15 0.00 -1.05 0.00 0.00 32.46 29.66 1ydz n ARG 40 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1ydz n PHE 41 N -2.20 0.00 -2.48 2.89 3.01 -1.24 -4.57 117.46 112.87 1ydz n PHE 41 Ca -0.00 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.21 1ydz n PHE 41 Cb 0.09 -0.30 0.00 0.00 -0.01 0.00 0.00 39.48 39.26 1ydz n PHE 41 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1ydz n PHE 42 N -1.96 3.15 -0.30 1.38 3.01 -0.77 -4.82 117.46 117.14 1ydz n PHE 42 Ca -0.01 -3.05 -0.05 0.00 1.01 0.00 0.00 57.45 55.36 1ydz n PHE 42 Cb 0.47 -0.12 0.07 0.00 -0.01 0.00 0.00 39.48 39.89 1ydz n PHE 42 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1ydz h GLU 43 N 2.61 1.14 0.00 -1.08 4.39 -1.80 -2.93 114.58 116.91 1ydz h GLU 43 Ca 0.26 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.82 1ydz h GLU 43 Cb 0.97 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.40 1ydz h GLU 43 CO 0.81 0.84 0.00 0.66 -1.16 0.00 0.00 179.01 180.16 1ydz h SER 44 N 1.13 0.00 0.84 1.42 4.64 -1.92 -3.16 113.55 116.50 1ydz h SER 44 Ca 0.29 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.44 1ydz h SER 44 Cb 0.03 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.10 1ydz h SER 44 CO -0.05 0.00 -0.77 -0.26 -0.87 0.00 0.00 176.83 174.88 1ydz h PHE 45 N 0.00 0.00 0.00 4.77 0.05 -1.91 -3.50 116.94 116.36 1ydz h PHE 45 Ca 0.00 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 1ydz h PHE 45 Cb 0.05 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.00 1ydz h PHE 45 CO 0.00 0.77 0.00 0.41 -0.18 0.00 0.00 178.31 179.31 1ydz n GLY 46 N 0.78 0.31 3.57 -1.45 0.00 -1.20 -4.81 105.19 102.39 1ydz n GLY 46 Ca -0.00 -1.51 -0.41 0.00 0.00 0.00 0.00 46.02 44.10 1ydz n GLY 46 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ydz s ASP 47 N -4.00 6.06 -0.04 1.61 3.68 -1.26 -4.74 116.67 117.98 1ydz s ASP 47 Ca 0.00 0.06 0.06 0.00 2.13 0.00 0.00 52.55 54.80 1ydz s ASP 47 Cb 0.00 -2.55 0.10 0.00 -1.45 0.00 0.00 42.92 39.03 1ydz s ASP 47 CO 0.00 -1.81 1.06 0.18 0.13 0.00 0.00 175.17 174.73 1ydz n LEU 48 N 9.83 2.17 -0.09 -1.34 4.77 -1.26 -4.03 117.00 127.04 1ydz n LEU 48 Ca 0.10 -2.33 0.19 0.00 -0.03 0.00 0.00 56.01 53.94 1ydz n LEU 48 Cb 0.49 -0.14 0.61 0.00 -2.33 0.00 0.00 43.42 42.05 1ydz n LEU 48 CO 0.71 0.57 1.20 0.28 -1.33 0.00 0.00 177.39 178.83 1ydz h SER 49 N 0.10 0.18 -5.09 -1.43 0.02 -1.88 -3.43 113.55 102.03 1ydz h SER 49 Ca 0.00 0.01 -0.15 0.00 -0.84 0.00 0.00 61.79 60.81 1ydz h SER 49 Cb 0.67 -0.03 -0.18 0.00 0.14 0.00 0.00 62.40 63.01 1ydz h SER 49 CO 0.00 0.09 -0.69 0.42 -1.14 0.00 0.00 176.83 175.52 1ydz s THR 50 N -5.19 0.21 0.15 -2.27 -4.23 -1.26 -5.01 115.64 98.02 1ydz s THR 50 Ca -0.06 -1.42 -0.30 0.00 -1.18 0.00 0.00 61.69 58.73 1ydz s THR 50 Cb 0.20 -0.98 -0.05 0.00 1.34 0.00 0.00 72.50 73.02 1ydz s THR 50 CO 0.75 -0.77 1.56 -0.65 -0.54 0.00 0.00 174.62 174.97 1ydz h PRO 51 N 3.80 -0.32 -0.44 3.99 0.11 -1.98 1.75 132.00 138.91 1ydz h PRO 51 Ca -0.33 0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.77 1ydz h PRO 51 Cb 1.17 0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 1ydz h PRO 51 CO 0.55 -0.21 0.13 -0.44 -0.21 0.00 0.00 178.00 177.82 1ydz h ASP 52 N -0.33 0.58 0.30 -2.05 3.32 -1.97 0.84 116.42 117.11 1ydz h ASP 52 Ca 0.12 -0.08 -0.10 0.00 0.02 0.00 0.00 57.03 56.99 1ydz h ASP 52 Cb 0.58 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 1ydz h ASP 52 CO -0.62 0.56 -0.43 0.00 -1.72 0.00 0.00 179.24 177.03 1ydz h ALA 53 N 1.52 1.14 0.00 3.45 0.00 -0.96 0.96 119.26 125.39 1ydz h ALA 53 Ca 0.15 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1ydz h ALA 53 Cb 0.19 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1ydz h ALA 53 CO -0.01 0.58 -0.06 0.28 0.00 0.00 0.00 179.25 180.04 1ydz h VAL 54 N 0.14 0.00 -0.76 0.00 2.07 0.36 -2.66 116.25 115.41 1ydz h VAL 54 Ca 0.01 -0.94 0.22 0.00 0.82 0.00 0.00 66.70 66.81 1ydz h VAL 54 Cb 0.82 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1ydz h VAL 54 CO 0.06 0.00 0.55 0.24 0.02 0.00 0.00 177.57 178.44 1ydz h MET 55 N -0.94 0.00 0.15 1.57 2.07 0.59 0.55 114.93 118.92 1ydz h MET 55 Ca 0.00 -0.00 -0.29 0.00 -2.07 0.00 0.00 59.70 57.34 1ydz h MET 55 Cb 0.06 -0.00 0.03 0.00 -1.87 0.00 0.00 31.60 29.82 1ydz h MET 55 CO 0.00 0.00 -1.22 0.78 1.07 0.00 0.00 176.91 177.55 1ydz h GLY 56 N 0.00 0.63 -6.19 8.32 0.00 -0.92 -3.46 103.07 101.45 1ydz h GLY 56 Ca 0.36 -1.40 -0.75 0.00 0.00 0.00 0.00 47.33 45.54 1ydz h GLY 56 CO -0.01 1.23 0.66 -2.01 0.00 0.00 0.00 176.54 176.41 1ydz n ASN 57 N -3.85 1.73 0.18 0.19 2.85 0.18 -4.80 115.26 111.74 1ydz n ASN 57 Ca -0.14 1.12 0.07 0.00 -0.11 0.00 0.00 54.58 55.51 1ydz n ASN 57 Cb 0.98 -1.08 0.09 0.00 1.24 0.00 0.00 39.78 41.01 1ydz n ASN 57 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1ydz h PRO 58 N 5.70 0.00 -0.02 1.20 0.13 -1.88 -2.03 132.00 135.09 1ydz h PRO 58 Ca -0.47 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.53 1ydz h PRO 58 Cb 1.34 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.46 1ydz h PRO 58 CO 0.88 0.26 -0.59 0.87 -0.23 0.00 0.00 178.00 179.20 1ydz h LYS 59 N 0.00 0.06 0.15 0.86 1.57 -1.87 -0.73 116.57 116.61 1ydz h LYS 59 Ca -0.00 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1ydz h LYS 59 Cb 1.20 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1ydz h LYS 59 CO 0.03 0.63 -0.07 0.28 -0.57 0.00 0.00 179.45 179.76 1ydz h VAL 60 N 0.05 0.97 -0.71 0.50 2.07 -1.85 -2.21 116.25 115.06 1ydz h VAL 60 Ca -0.01 -1.09 0.06 0.00 0.82 0.00 0.00 66.70 66.49 1ydz h VAL 60 Cb 1.05 1.58 -0.06 0.00 -1.52 0.00 0.00 31.29 32.34 1ydz h VAL 60 CO 0.08 0.23 0.41 0.11 0.02 0.00 0.00 177.57 178.42 1ydz h LYS 61 N -0.77 0.73 -0.56 1.57 6.56 -1.34 -1.84 116.57 120.92 1ydz h LYS 61 Ca -0.02 -0.04 -0.01 0.00 -1.06 0.00 0.00 60.65 59.52 1ydz h LYS 61 Cb 0.53 -0.17 -0.03 0.00 -0.57 0.00 0.00 32.23 32.00 1ydz h LYS 61 CO 0.03 0.48 0.32 0.00 -2.06 0.00 0.00 179.45 178.23 1ydz h ALA 62 N 1.36 0.71 0.00 3.86 0.00 -1.16 -2.20 119.26 121.83 1ydz h ALA 62 Ca 0.32 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 1ydz h ALA 62 Cb 0.19 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1ydz h ALA 62 CO -0.18 0.21 -0.29 1.25 0.00 0.00 0.00 179.25 180.23 1ydz h HIS 63 N 0.75 0.00 -0.30 0.00 -0.00 -1.08 -2.98 115.15 111.54 1ydz h HIS 63 Ca 0.20 0.00 -0.18 0.00 -0.00 0.00 0.00 60.37 60.39 1ydz h HIS 63 Cb 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.42 1ydz h HIS 63 CO -0.02 0.29 -0.52 0.78 -0.00 0.00 0.00 177.93 178.47 1ydz h GLY 64 N 1.27 0.96 2.00 5.26 0.00 -0.73 -2.52 103.07 109.30 1ydz h GLY 64 Ca -0.00 -1.10 -0.13 0.00 0.00 0.00 0.00 47.33 46.10 1ydz h GLY 64 CO 0.04 0.99 -0.60 1.70 0.00 0.00 0.00 176.54 178.67 1ydz h LYS 65 N 0.66 0.00 -0.47 4.80 3.11 -1.39 -1.64 116.57 121.64 1ydz h LYS 65 Ca 0.02 0.00 -0.06 0.00 -2.81 0.00 0.00 60.65 57.79 1ydz h LYS 65 Cb 1.13 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 32.34 1ydz h LYS 65 CO 0.12 0.60 0.04 -0.22 -2.81 0.00 0.00 179.45 177.17 1ydz h LYS 66 N 0.00 0.80 0.00 1.90 3.64 -1.40 -0.63 116.57 120.89 1ydz h LYS 66 Ca -0.01 -0.23 -0.00 0.00 -1.27 0.00 0.00 60.65 59.14 1ydz h LYS 66 Cb 1.16 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1ydz h LYS 66 CO 0.08 0.83 -0.00 0.28 -2.27 0.00 0.00 179.45 178.37 1ydz h VAL 67 N 0.66 1.49 -0.88 2.00 2.07 -1.38 -3.05 116.25 117.16 1ydz h VAL 67 Ca 0.14 -1.47 0.09 0.00 0.82 0.00 0.00 66.70 66.28 1ydz h VAL 67 Cb 0.45 2.49 -0.06 0.00 -1.52 0.00 0.00 31.29 32.64 1ydz h VAL 67 CO 0.02 0.38 0.57 -0.07 0.02 0.00 0.00 177.57 178.49 1ydz h LEU 68 N -0.63 0.81 -0.04 2.57 -0.00 -1.31 -1.59 115.31 115.12 1ydz h LEU 68 Ca -0.00 0.02 0.04 0.00 -0.00 0.00 0.00 57.88 57.93 1ydz h LEU 68 Cb 0.62 -0.15 -0.05 0.00 -0.00 0.00 0.00 40.66 41.08 1ydz h LEU 68 CO 0.00 0.49 -0.23 1.23 -0.00 0.00 0.00 178.44 179.93 1ydz h GLY 69 N 0.91 -0.31 0.85 0.83 0.00 -1.07 0.67 103.07 104.95 1ydz h GLY 69 Ca 0.40 0.28 0.06 0.00 0.00 0.00 0.00 47.33 48.07 1ydz h GLY 69 CO -0.17 -0.20 0.62 0.00 0.00 0.00 0.00 176.54 176.80 1ydz h ALA 70 N 0.55 1.44 0.34 3.60 0.00 -1.34 0.43 119.26 124.28 1ydz h ALA 70 Ca 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1ydz h ALA 70 Cb 0.45 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1ydz h ALA 70 CO -0.24 0.44 -0.16 0.35 0.00 0.00 0.00 179.25 179.63 1ydz h PHE 71 N 1.13 -0.42 -0.62 0.00 3.57 -0.56 -0.09 116.94 119.96 1ydz h PHE 71 Ca 0.40 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 62.01 1ydz h PHE 71 Cb 0.12 0.14 -0.10 0.00 2.79 0.00 0.00 35.95 38.90 1ydz h PHE 71 CO -0.00 -0.14 0.05 1.03 -2.23 0.00 0.00 178.31 177.03 1ydz h SER 72 N -0.67 -0.17 -0.59 0.41 0.87 0.96 0.20 113.55 114.56 1ydz h SER 72 Ca -0.05 0.14 -0.07 0.00 -1.23 0.00 0.00 61.79 60.58 1ydz h SER 72 Cb 0.47 0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 62.63 1ydz h SER 72 CO 0.08 -0.07 0.09 0.44 -0.53 0.00 0.00 176.83 176.83 1ydz h ASP 73 N 0.17 0.97 1.03 6.23 5.19 -0.03 -2.84 116.42 127.14 1ydz h ASP 73 Ca 0.33 -0.23 -0.01 0.00 -0.62 0.00 0.00 57.03 56.50 1ydz h ASP 73 Cb 0.52 -0.26 -0.00 0.00 0.18 0.00 0.00 39.33 39.77 1ydz h ASP 73 CO -0.49 0.97 -0.03 1.23 -3.12 0.00 0.00 179.24 177.80 1ydz h GLY 74 N 1.03 0.00 2.00 2.75 0.00 0.13 -2.54 103.07 106.44 1ydz h GLY 74 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1ydz h GLY 74 CO 0.01 0.00 0.00 1.41 0.00 0.00 0.00 176.54 177.96 1ydz h LEU 75 N 0.00 0.00 -0.87 3.11 3.38 -0.90 -2.78 115.31 117.25 1ydz h LEU 75 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ydz h LEU 75 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1ydz h LEU 75 CO 0.00 0.00 -0.20 0.00 0.09 0.00 0.00 178.44 178.34 1ydz n ALA 76 N -1.83 2.96 -2.64 1.53 0.00 -0.95 -4.08 120.51 115.50 1ydz n ALA 76 Ca 0.02 -0.49 -0.11 0.00 0.00 0.00 0.00 53.44 52.87 1ydz n ALA 76 Cb 0.28 -1.05 0.03 0.00 0.00 0.00 0.00 19.45 18.71 1ydz n ALA 76 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1ydz n HIS 77 N -0.09 1.55 0.53 0.00 8.25 -1.05 -4.91 115.22 119.50 1ydz n HIS 77 Ca 0.14 -2.70 0.06 0.00 -0.26 0.00 0.00 57.72 54.96 1ydz n HIS 77 Cb 0.40 -0.31 0.29 0.00 1.12 0.00 0.00 29.99 31.49 1ydz n HIS 77 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1ydz n LEU 78 N -0.24 0.00 0.00 2.41 4.32 -1.21 0.34 117.00 122.62 1ydz n LEU 78 Ca 0.14 0.32 0.10 0.00 -0.02 0.00 0.00 56.01 56.55 1ydz n LEU 78 Cb 0.80 -0.32 -0.07 0.00 -1.62 0.00 0.00 43.42 42.21 1ydz n LEU 78 CO 0.25 -0.19 -0.08 0.47 -1.22 0.00 0.00 177.39 176.61 1ydz n ASP 79 N -1.32 0.79 -2.94 -1.43 10.43 -1.26 -1.17 116.55 119.65 1ydz n ASP 79 Ca 0.05 -0.72 -0.14 0.00 2.57 0.00 0.00 54.79 56.55 1ydz n ASP 79 Cb 0.10 1.02 0.02 0.00 1.84 0.00 0.00 41.12 44.11 1ydz n ASP 79 CO 0.00 0.00 0.00 -3.20 -1.07 0.00 0.00 177.20 172.93 1ydz n ASN 80 N -1.64 -1.15 -0.12 -2.24 5.15 0.15 -4.90 115.26 110.51 1ydz n ASN 80 Ca 0.03 -3.28 -0.07 0.00 -0.60 0.00 0.00 54.58 50.66 1ydz n ASN 80 Cb 0.37 0.79 0.09 0.00 -0.53 0.00 0.00 39.78 40.50 1ydz n ASN 80 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1ydz h LEU 81 N 3.34 0.85 -0.36 1.20 3.38 -1.59 -2.47 115.31 119.67 1ydz h LEU 81 Ca -0.03 -0.26 0.07 0.00 0.09 0.00 0.00 57.88 57.75 1ydz h LEU 81 Cb 1.02 -0.23 -0.09 0.00 0.09 0.00 0.00 40.66 41.45 1ydz h LEU 81 CO 0.33 0.98 -0.39 0.50 0.09 0.00 0.00 178.44 179.95 1ydz h LYS 82 N 0.77 -0.31 0.00 1.13 1.63 -1.87 -0.09 116.57 117.83 1ydz h LYS 82 Ca 0.13 0.02 -0.13 0.00 -0.85 0.00 0.00 60.65 59.82 1ydz h LYS 82 Cb 0.62 0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.30 1ydz h LYS 82 CO 0.04 -0.21 -0.62 0.78 -3.45 0.00 0.00 179.45 175.99 1ydz h GLY 83 N -0.33 0.00 1.18 5.01 0.00 -1.93 -2.39 103.07 104.62 1ydz h GLY 83 Ca 0.14 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.31 1ydz h GLY 83 CO -0.53 0.00 -0.40 -0.84 0.00 0.00 0.00 176.54 174.77 1ydz h THR 84 N 0.00 1.27 -0.02 4.70 2.02 -1.03 -3.33 112.91 116.52 1ydz h THR 84 Ca -0.01 -1.57 0.00 0.00 0.77 0.00 0.00 66.41 65.60 1ydz h THR 84 Cb 1.32 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 69.14 1ydz h THR 84 CO 0.08 0.52 -0.46 0.49 0.37 0.00 0.00 175.52 176.53 1ydz n PHE 85 N -4.05 0.00 -0.09 3.16 3.01 -0.08 -4.66 117.46 114.74 1ydz n PHE 85 Ca -0.02 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.38 1ydz n PHE 85 Cb 0.55 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.02 1ydz n PHE 85 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ydz h ALA 86 N 3.92 0.14 -0.78 4.37 0.00 -1.54 0.47 119.26 125.84 1ydz h ALA 86 Ca 0.00 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1ydz h ALA 86 Cb 0.77 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1ydz h ALA 86 CO 0.00 -0.52 0.32 1.15 0.00 0.00 0.00 179.25 180.20 1ydz h THR 87 N -0.08 1.26 0.00 0.00 2.02 -1.84 -1.78 112.91 112.49 1ydz h THR 87 Ca 0.17 -0.80 -0.12 0.00 0.77 0.00 0.00 66.41 66.43 1ydz h THR 87 Cb 0.34 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 67.06 1ydz h THR 87 CO -0.39 0.33 -0.58 0.25 0.37 0.00 0.00 175.52 175.49 1ydz h LEU 88 N 1.12 0.00 -0.46 2.58 5.85 -1.72 -2.84 115.31 119.85 1ydz h LEU 88 Ca 0.26 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.93 1ydz h LEU 88 Cb 0.20 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 1ydz h LEU 88 CO -0.02 0.58 0.08 -1.28 -0.34 0.00 0.00 178.44 177.46 1ydz h SER 89 N 0.00 0.73 0.57 1.25 0.87 0.62 -1.80 113.55 115.78 1ydz h SER 89 Ca -0.01 -0.26 -0.14 0.00 -1.23 0.00 0.00 61.79 60.15 1ydz h SER 89 Cb 1.13 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.88 1ydz h SER 89 CO 0.08 0.80 -0.65 -0.33 -0.53 0.00 0.00 176.83 176.20 1ydz h GLU 90 N 0.63 0.07 0.06 2.24 5.08 -1.35 -3.11 114.58 118.21 1ydz h GLU 90 Ca 0.14 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1ydz h GLU 90 Cb 0.38 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1ydz h GLU 90 CO 0.01 0.69 -0.03 1.25 -1.00 0.00 0.00 179.01 179.93 1ydz h LEU 91 N 0.05 -0.07 -2.04 1.33 5.85 -1.22 0.47 115.31 119.69 1ydz h LEU 91 Ca -0.01 -0.38 -0.02 0.00 0.84 0.00 0.00 57.88 58.31 1ydz h LEU 91 Cb 1.15 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.20 1ydz h LEU 91 CO 0.09 0.36 -0.09 0.45 -0.34 0.00 0.00 178.44 178.91 1ydz h HIS 92 N -0.51 0.00 0.00 1.25 3.86 -1.39 0.20 115.15 118.55 1ydz h HIS 92 Ca -0.01 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 1ydz h HIS 92 Cb 0.45 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.92 1ydz h HIS 92 CO 0.07 0.09 -0.63 0.00 0.86 0.00 0.00 177.93 178.32 1ydz h ASP 94 N -1.00 0.72 0.00 0.00 3.32 -0.10 -3.19 116.42 116.17 1ydz h ASP 94 Ca -0.02 -0.17 -0.11 0.00 0.02 0.00 0.00 57.03 56.75 1ydz h ASP 94 Cb 0.62 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1ydz h ASP 94 CO -0.01 0.79 -1.28 0.29 -1.72 0.00 0.00 179.24 177.31 1ydz n LYS 95 N -4.22 0.49 0.08 3.56 4.01 0.57 -4.77 118.16 117.89 1ydz n LYS 95 Ca 0.02 0.20 -0.07 0.00 -0.51 0.00 0.00 58.31 57.95 1ydz n LYS 95 Cb 0.30 -1.35 0.05 0.00 -0.51 0.00 0.00 35.03 33.52 1ydz n LYS 95 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1ydz h LEU 96 N -0.90 0.27 -1.55 -0.35 3.38 -1.28 -3.49 115.31 111.40 1ydz h LEU 96 Ca -0.16 -0.19 -0.37 0.00 0.09 0.00 0.00 57.88 57.24 1ydz h LEU 96 Cb 1.07 -0.08 0.12 0.00 0.09 0.00 0.00 40.66 41.85 1ydz h LEU 96 CO -0.10 0.92 -0.78 1.41 0.09 0.00 0.00 178.44 179.99 1ydz n HIS 97 N -3.76 -2.20 -3.50 1.13 8.25 0.16 -4.97 115.22 110.32 1ydz n HIS 97 Ca -0.03 0.92 -0.37 0.00 -0.26 0.00 0.00 57.72 57.98 1ydz n HIS 97 Cb 0.71 -4.81 -0.08 0.00 1.12 0.00 0.00 29.99 26.94 1ydz n HIS 97 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1ydz s VAL 98 N -3.44 5.27 0.25 1.59 1.01 -0.05 -5.02 120.40 120.01 1ydz s VAL 98 Ca 0.12 0.52 -0.30 0.00 0.00 0.00 0.00 61.98 62.32 1ydz s VAL 98 Cb -0.05 -3.64 -0.10 0.00 0.00 0.00 0.00 36.38 32.58 1ydz s VAL 98 CO 0.76 0.31 1.50 -0.62 0.00 0.00 0.00 175.10 177.05 1ydz s ASP 99 N 0.92 6.56 0.52 3.32 3.68 -1.26 -4.67 116.67 125.74 1ydz s ASP 99 Ca 0.15 2.75 0.21 0.00 2.13 0.00 0.00 52.55 57.79 1ydz s ASP 99 Cb -0.14 -2.62 1.16 0.00 -1.45 0.00 0.00 42.92 39.87 1ydz s ASP 99 CO 0.06 -0.78 1.61 1.55 0.13 0.00 0.00 175.17 177.74 1ydz h PRO 100 N 5.21 0.00 -0.58 4.34 0.13 -1.96 -2.59 132.00 136.55 1ydz h PRO 100 Ca -0.46 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.68 1ydz h PRO 100 Cb 1.22 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.32 1ydz h PRO 100 CO 0.80 0.00 0.38 1.49 -0.23 0.00 0.00 178.00 180.44 1ydz h GLU 101 N 0.00 0.76 -0.15 0.86 4.57 -1.97 -2.37 114.58 116.27 1ydz h GLU 101 Ca 0.00 -0.05 0.04 0.00 -1.18 0.00 0.00 59.36 58.18 1ydz h GLU 101 Cb 0.71 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.12 1ydz h GLU 101 CO 0.00 0.50 0.18 -0.91 -1.18 0.00 0.00 179.01 177.60 1ydz h ASN 102 N 0.78 0.00 -0.18 1.04 4.21 -1.85 -0.05 115.58 119.54 1ydz h ASN 102 Ca 0.21 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.72 1ydz h ASN 102 Cb -0.09 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.10 1ydz h ASN 102 CO -0.05 0.00 0.10 -0.26 -1.29 0.00 0.00 177.43 175.94 1ydz h PHE 103 N 0.00 0.24 -0.07 1.19 0.04 -1.61 -1.50 116.94 115.23 1ydz h PHE 103 Ca 0.07 -0.00 0.03 0.00 2.80 0.00 0.00 57.97 60.87 1ydz h PHE 103 Cb 0.44 -0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.48 1ydz h PHE 103 CO 0.00 0.21 -0.08 0.00 -0.60 0.00 0.00 178.31 177.84 1ydz h ARG 104 N 0.20 -0.11 -0.27 1.51 3.08 -1.06 -1.01 114.38 116.72 1ydz h ARG 104 Ca 0.06 0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.19 1ydz h ARG 104 Cb 0.05 0.02 -0.08 0.00 0.08 0.00 0.00 29.97 30.04 1ydz h ARG 104 CO -0.01 -0.07 -0.27 -0.07 -1.07 0.00 0.00 179.97 178.47 1ydz h LEU 105 N -0.11 -0.88 -0.44 3.04 3.38 -1.27 -1.23 115.31 117.80 1ydz h LEU 105 Ca 0.06 0.16 0.08 0.00 0.09 0.00 0.00 57.88 58.26 1ydz h LEU 105 Cb 0.19 0.41 -0.07 0.00 0.09 0.00 0.00 40.66 41.29 1ydz h LEU 105 CO -0.14 -0.30 0.03 0.25 0.09 0.00 0.00 178.44 178.37 1ydz h LEU 106 N -0.27 -0.13 -0.87 1.67 5.85 -0.85 -0.48 115.31 120.24 1ydz h LEU 106 Ca 0.14 0.09 0.10 0.00 0.84 0.00 0.00 57.88 59.06 1ydz h LEU 106 Cb 0.49 0.16 -0.12 0.00 0.37 0.00 0.00 40.66 41.56 1ydz h LEU 106 CO -0.43 -0.03 -0.53 1.23 -0.34 0.00 0.00 178.44 178.35 1ydz h GLY 107 N 0.14 -0.62 0.41 3.75 0.00 0.05 1.00 103.07 107.79 1ydz h GLY 107 Ca 0.22 0.70 0.05 0.00 0.00 0.00 0.00 47.33 48.30 1ydz h GLY 107 CO -0.34 -0.05 -0.17 3.43 0.00 0.00 0.00 176.54 179.42 1ydz h ASN 108 N -0.08 -0.52 -0.56 0.19 4.21 -1.21 -1.37 115.58 116.24 1ydz h ASN 108 Ca 0.19 0.10 0.00 0.00 1.21 0.00 0.00 56.30 57.80 1ydz h ASN 108 Cb 0.49 0.25 -0.03 0.00 -1.12 0.00 0.00 38.32 37.91 1ydz h ASN 108 CO -0.88 -0.21 0.37 0.58 -1.29 0.00 0.00 177.43 176.00 1ydz h VAL 109 N -0.20 1.15 -0.97 2.81 2.07 0.69 0.46 116.25 122.25 1ydz h VAL 109 Ca 0.10 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.37 1ydz h VAL 109 Cb 0.35 0.33 -0.05 0.00 -1.52 0.00 0.00 31.29 30.40 1ydz h VAL 109 CO -0.27 0.14 0.64 0.25 0.02 0.00 0.00 177.57 178.36 1ydz h LEU 110 N 0.76 1.09 -0.53 2.57 5.85 0.17 -0.58 115.31 124.64 1ydz h LEU 110 Ca 0.20 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.94 1ydz h LEU 110 Cb -0.08 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.65 1ydz h LEU 110 CO -0.04 0.77 0.30 0.58 -0.34 0.00 0.00 178.44 179.71 1ydz h VAL 111 N 1.27 1.02 -0.73 1.05 2.07 -0.22 0.15 116.25 120.87 1ydz h VAL 111 Ca 0.37 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.66 1ydz h VAL 111 Cb -0.08 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 30.04 1ydz h VAL 111 CO -0.10 0.11 0.34 0.00 0.02 0.00 0.00 177.57 177.95 1ydz h VAL 113 N 1.02 1.30 -0.30 0.00 2.07 -0.33 -0.52 116.25 119.49 1ydz h VAL 113 Ca 0.25 -0.96 0.01 0.00 0.82 0.00 0.00 66.70 66.82 1ydz h VAL 113 Cb 0.13 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 1ydz h VAL 113 CO -0.03 0.27 0.18 -0.07 0.02 0.00 0.00 177.57 177.94 1ydz h LEU 114 N -0.17 0.30 -1.16 2.57 3.38 -0.49 0.30 115.31 120.05 1ydz h LEU 114 Ca 0.02 -0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.14 1ydz h LEU 114 Cb 0.44 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 41.04 1ydz h LEU 114 CO 0.01 0.22 0.60 0.00 0.09 0.00 0.00 178.44 179.36 1ydz h ALA 115 N 1.13 1.73 -0.48 1.53 0.00 -0.05 -0.44 119.26 122.69 1ydz h ALA 115 Ca 0.12 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1ydz h ALA 115 Cb -0.01 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1ydz h ALA 115 CO -0.05 -0.01 0.05 1.25 0.00 0.00 0.00 179.25 180.49 1ydz h HIS 116 N 0.78 0.87 0.00 0.00 6.17 0.02 -2.91 115.15 120.09 1ydz h HIS 116 Ca 0.50 -0.13 -0.04 0.00 0.71 0.00 0.00 60.37 61.40 1ydz h HIS 116 Cb 0.73 -0.23 0.00 0.00 2.52 0.00 0.00 27.41 30.43 1ydz h HIS 116 CO -0.00 0.82 -0.18 1.25 0.71 0.00 0.00 177.93 180.53 1ydz h HIS 117 N 0.67 0.17 -0.01 5.26 6.17 0.54 -3.38 115.15 124.57 1ydz h HIS 117 Ca 0.14 -0.10 0.00 0.00 0.71 0.00 0.00 60.37 61.13 1ydz h HIS 117 Cb 0.44 -0.02 0.00 0.00 2.52 0.00 0.00 27.41 30.35 1ydz h HIS 117 CO 0.03 0.91 -0.33 1.19 0.71 0.00 0.00 177.93 180.44 1ydz n PHE 118 N -4.56 0.00 0.00 5.26 3.01 -0.35 -5.03 117.46 115.79 1ydz n PHE 118 Ca -0.10 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.36 1ydz n PHE 118 Cb 0.48 -0.07 0.00 0.00 -0.01 0.00 0.00 39.48 39.88 1ydz n PHE 118 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ydz n GLY 119 N 1.37 2.66 0.36 1.37 0.00 -1.10 -1.47 105.19 108.39 1ydz n GLY 119 Ca 0.11 0.21 0.02 0.00 0.00 0.00 0.00 46.02 46.36 1ydz n GLY 119 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ydz h LYS 120 N 0.00 -0.01 -1.00 1.61 1.57 -1.96 0.85 116.57 117.63 1ydz h LYS 120 Ca 0.00 0.00 0.27 0.00 -1.87 0.00 0.00 60.65 59.06 1ydz h LYS 120 Cb 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.26 1ydz h LYS 120 CO 0.00 -0.01 0.70 0.93 -0.57 0.00 0.00 179.45 180.50 1ydz h GLU 121 N -0.01 0.13 -3.73 3.15 5.08 -1.67 -3.21 114.58 114.32 1ydz h GLU 121 Ca 0.39 -0.01 -0.68 0.00 -1.00 0.00 0.00 59.36 58.06 1ydz h GLU 121 Cb 0.64 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 1ydz h GLU 121 CO -0.96 0.09 3.26 0.34 -1.00 0.00 0.00 179.01 180.74 1ydz n PHE 122 N -4.35 2.99 -2.13 4.33 7.35 0.29 -4.94 117.46 121.00 1ydz n PHE 122 Ca 0.22 -2.87 -0.33 0.00 -0.76 0.00 0.00 57.45 53.71 1ydz n PHE 122 Cb 0.98 -2.43 0.00 0.00 0.35 0.00 0.00 39.48 38.38 1ydz n PHE 122 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1ydz s THR 123 N 3.06 3.82 0.23 -2.13 -4.23 -1.21 -4.73 115.64 110.45 1ydz s THR 123 Ca 0.54 0.90 -0.14 0.00 -1.18 0.00 0.00 61.69 61.81 1ydz s THR 123 Cb 0.15 -3.40 0.28 0.00 1.34 0.00 0.00 72.50 70.87 1ydz s THR 123 CO -0.06 -0.47 1.58 -0.65 -0.54 0.00 0.00 174.62 174.48 1ydz h PRO 124 N 0.61 -0.04 -0.31 3.99 0.11 -1.93 1.14 132.00 135.57 1ydz h PRO 124 Ca -0.47 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 1ydz h PRO 124 Cb 1.22 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 1ydz h PRO 124 CO 0.58 -0.02 -0.02 -1.35 -0.21 0.00 0.00 178.00 176.97 1ydz h PRO 125 N -0.04 0.49 0.00 1.05 0.11 -1.97 0.51 132.00 132.15 1ydz h PRO 125 Ca 0.35 -0.11 -0.06 0.00 0.11 0.00 0.00 66.00 66.30 1ydz h PRO 125 Cb 0.60 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 1ydz h PRO 125 CO -0.86 0.53 -0.28 0.28 -0.21 0.00 0.00 178.00 177.46 1ydz h VAL 126 N 0.47 0.51 0.09 3.15 2.07 0.04 0.58 116.25 123.16 1ydz h VAL 126 Ca 0.10 -1.60 -0.28 0.00 0.82 0.00 0.00 66.70 65.74 1ydz h VAL 126 Cb 0.34 2.16 0.03 0.00 -1.52 0.00 0.00 31.29 32.29 1ydz h VAL 126 CO 0.01 0.28 -1.14 -0.61 0.02 0.00 0.00 177.57 176.13 1ydz h GLN 127 N 0.00 0.61 -0.99 1.57 4.15 0.16 -2.46 115.11 118.16 1ydz h GLN 127 Ca -0.00 -0.78 0.09 0.00 0.77 0.00 0.00 58.65 58.73 1ydz h GLN 127 Cb 1.14 0.25 -0.08 0.00 0.21 0.00 0.00 27.48 29.00 1ydz h GLN 127 CO 0.04 1.35 0.62 0.00 -1.93 0.00 0.00 178.83 178.91 1ydz h ALA 128 N 0.30 1.43 0.54 3.38 0.00 0.33 0.67 119.26 125.90 1ydz h ALA 128 Ca -0.17 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1ydz h ALA 128 Cb 1.82 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 19.37 1ydz h ALA 128 CO 0.22 0.31 -0.26 0.00 0.00 0.00 0.00 179.25 179.52 1ydz h ALA 129 N 1.49 -0.72 -0.98 0.00 0.00 -0.78 -3.21 119.26 115.07 1ydz h ALA 129 Ca 0.46 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.28 1ydz h ALA 129 Cb 0.33 0.28 -0.08 0.00 0.00 0.00 0.00 17.79 18.33 1ydz h ALA 129 CO -0.22 -0.70 0.62 1.88 0.00 0.00 0.00 179.25 180.82 1ydz h TYR 130 N -1.14 1.13 -0.89 0.00 0.05 -1.30 -0.86 116.97 113.96 1ydz h TYR 130 Ca -0.07 0.03 0.20 0.00 0.05 0.00 0.00 58.73 58.94 1ydz h TYR 130 Cb 0.59 -0.36 -0.11 0.00 1.01 0.00 0.00 36.73 37.86 1ydz h TYR 130 CO 0.01 0.51 0.43 1.96 -1.05 0.00 0.00 178.16 180.01 1ydz h GLN 131 N 1.04 0.47 0.00 4.88 1.08 -0.92 0.11 115.11 121.78 1ydz h GLN 131 Ca 0.46 -0.03 -0.06 0.00 -1.45 0.00 0.00 58.65 57.57 1ydz h GLN 131 Cb 0.33 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.65 1ydz h GLN 131 CO -0.22 0.31 -0.27 0.87 -0.95 0.00 0.00 178.83 178.57 1ydz h LYS 132 N 0.49 0.00 0.00 1.46 1.57 -1.16 -1.80 116.57 117.13 1ydz h LYS 132 Ca 0.54 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.31 1ydz h LYS 132 Cb 0.95 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.26 1ydz h LYS 132 CO -0.47 0.27 -0.09 0.28 -0.57 0.00 0.00 179.45 178.87 1ydz h VAL 133 N 0.00 0.37 -1.19 0.50 2.07 -0.78 -1.87 116.25 115.35 1ydz h VAL 133 Ca -0.00 -1.29 0.34 0.00 0.82 0.00 0.00 66.70 66.56 1ydz h VAL 133 Cb 0.48 0.71 -0.08 0.00 -1.52 0.00 0.00 31.29 30.88 1ydz h VAL 133 CO 0.04 0.13 0.80 -0.37 0.02 0.00 0.00 177.57 178.18 1ydz h VAL 134 N -1.00 0.38 0.97 2.57 -1.51 -0.93 0.50 116.25 117.23 1ydz h VAL 134 Ca -0.01 -0.06 -0.05 0.00 -1.23 0.00 0.00 66.70 65.35 1ydz h VAL 134 Cb 0.28 0.18 0.01 0.00 -2.13 0.00 0.00 31.29 29.63 1ydz h VAL 134 CO -0.01 0.03 -0.46 0.00 -1.23 0.00 0.00 177.57 175.90 1ydz h ALA 135 N 1.51 -1.30 -0.36 5.19 0.00 -1.36 -1.75 119.26 121.19 1ydz h ALA 135 Ca 0.64 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1ydz h ALA 135 Cb 2.08 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 20.35 1ydz h ALA 135 CO -0.21 -1.21 0.24 0.78 0.00 0.00 0.00 179.25 178.85 1ydz h GLY 136 N -1.35 0.51 0.71 0.00 0.00 0.57 -2.33 103.07 101.19 1ydz h GLY 136 Ca -0.13 -0.19 0.03 0.00 0.00 0.00 0.00 47.33 47.04 1ydz h GLY 136 CO 0.22 0.19 0.01 -2.08 0.00 0.00 0.00 176.54 174.88 1ydz h VAL 137 N 0.49 0.87 -0.53 4.60 2.07 -0.28 0.85 116.25 124.32 1ydz h VAL 137 Ca 0.13 -0.03 0.06 0.00 0.82 0.00 0.00 66.70 67.68 1ydz h VAL 137 Cb -0.05 0.78 -0.05 0.00 -1.52 0.00 0.00 31.29 30.44 1ydz h VAL 137 CO -0.03 0.02 0.23 0.00 0.02 0.00 0.00 177.57 177.81 1ydz h ALA 138 N 1.17 0.67 -0.42 1.67 0.00 -1.20 -2.08 119.26 119.06 1ydz h ALA 138 Ca 0.10 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 1ydz h ALA 138 Cb 0.11 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1ydz h ALA 138 CO -0.15 -0.14 -0.04 -0.91 0.00 0.00 0.00 179.25 178.00 1ydz h ASN 139 N 0.44 0.77 -0.00 0.00 2.35 -1.06 -2.77 115.58 115.31 1ydz h ASN 139 Ca 0.24 -0.33 -0.08 0.00 -0.55 0.00 0.00 56.30 55.58 1ydz h ASN 139 Cb 0.21 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 1ydz h ASN 139 CO -0.21 0.92 -0.23 0.00 -1.65 0.00 0.00 177.43 176.26 1ydz h ALA 140 N 0.88 1.22 0.00 -0.83 0.00 -0.57 -2.31 119.26 117.64 1ydz h ALA 140 Ca 0.11 -0.31 -0.11 0.00 0.00 0.00 0.00 54.91 54.61 1ydz h ALA 140 Cb 0.55 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1ydz h ALA 140 CO 0.03 0.51 -0.51 -0.07 0.00 0.00 0.00 179.25 179.21 1ydz h LEU 141 N 0.35 0.00 0.00 0.00 3.38 -1.29 -3.20 115.31 114.54 1ydz h LEU 141 Ca 0.06 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 1ydz h LEU 141 Cb 0.60 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1ydz h LEU 141 CO 0.04 0.51 -0.69 0.00 0.09 0.00 0.00 178.44 178.39 1ydz h ALA 142 N 1.49 0.64 -0.91 1.53 0.00 -1.17 -3.40 119.26 117.44 1ydz h ALA 142 Ca -0.01 -0.55 0.13 0.00 0.00 0.00 0.00 54.91 54.49 1ydz h ALA 142 Cb 1.05 -0.03 -0.14 0.00 0.00 0.00 0.00 17.79 18.67 1ydz h ALA 142 CO 0.07 0.72 -0.38 1.58 0.00 0.00 0.00 179.25 181.24 1ydz n HIS 143 N -3.18 -0.02 0.51 0.00 -0.00 -0.91 -1.82 115.22 109.80 1ydz n HIS 143 Ca -0.00 1.12 0.04 0.00 -0.00 0.00 0.00 57.72 58.88 1ydz n HIS 143 Cb 0.77 -0.81 0.16 0.00 -0.00 0.00 0.00 29.99 30.11 1ydz n HIS 143 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 1ydz n LYS 144 N -5.31 2.30 -2.66 1.57 4.76 -1.26 -4.93 118.16 112.62 1ydz n LYS 144 Ca 0.08 -1.28 -0.37 0.00 -2.87 0.00 0.00 58.31 53.87 1ydz n LYS 144 Cb 0.35 -1.59 -0.05 0.00 -1.84 0.00 0.00 35.03 31.90 1ydz n LYS 144 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1ydz s TYR 145 N -1.68 3.51 0.00 2.13 2.02 -0.76 -4.67 117.35 117.90 1ydz s TYR 145 Ca 0.23 1.72 0.00 0.00 -0.37 0.00 0.00 57.07 58.65 1ydz s TYR 145 Cb 0.15 -3.04 0.00 0.00 -0.40 0.00 0.00 41.96 38.68 1ydz s TYR 145 CO 0.10 -0.19 0.00 -2.39 -1.57 0.00 0.00 175.55 171.50