#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9h s SER 2 N 0.00 5.73 -0.21 1.61 0.01 -1.26 -5.13 113.70 114.45 2d9h s SER 2 Ca 0.00 -0.33 -0.11 0.00 1.31 0.00 0.00 55.95 56.81 2d9h s SER 2 Cb 0.00 -0.83 0.07 0.00 0.21 0.00 0.00 66.02 65.47 2d9h s SER 2 CO 0.00 -0.69 0.51 -0.44 0.41 0.00 0.00 173.24 173.03 2d9h s SER 3 N -4.31 -0.66 0.00 2.44 0.01 -1.26 -5.04 113.70 104.88 2d9h s SER 3 Ca 0.52 1.12 0.00 0.00 1.31 0.00 0.00 55.95 58.91 2d9h s SER 3 Cb -0.10 1.04 0.00 0.00 0.21 0.00 0.00 66.02 67.17 2d9h s SER 3 CO 0.33 -0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.38 2d9h n GLY 4 N 4.36 0.00 3.44 3.44 0.00 -1.26 -5.16 105.19 110.01 2d9h n GLY 4 Ca -0.21 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.68 2d9h n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d9h s SER 5 N 0.00 -0.60 -0.25 1.61 1.04 -1.26 -5.16 113.70 109.09 2d9h s SER 5 Ca 0.00 1.11 -0.11 0.00 0.48 0.00 0.00 55.95 57.43 2d9h s SER 5 Cb 0.00 1.09 0.09 0.00 0.10 0.00 0.00 66.02 67.30 2d9h s SER 5 CO 0.00 -0.20 0.57 -0.94 0.98 0.00 0.00 173.24 173.65 2d9h s SER 6 N 0.61 -0.78 -0.09 7.02 1.04 -1.26 -5.16 113.70 115.08 2d9h s SER 6 Ca -0.03 1.30 -0.03 0.00 0.48 0.00 0.00 55.95 57.68 2d9h s SER 6 Cb -0.05 1.46 -0.03 0.00 0.10 0.00 0.00 66.02 67.50 2d9h s SER 6 CO -0.04 -0.22 0.02 -0.83 0.98 0.00 0.00 173.24 173.15 2d9h s GLY 7 N 2.06 1.90 0.56 7.32 0.00 -1.26 -4.84 107.32 113.06 2d9h s GLY 7 Ca -0.07 -0.78 -0.15 0.00 0.00 0.00 0.00 44.72 43.71 2d9h s GLY 7 CO -0.17 -0.54 1.01 1.08 0.00 0.00 0.00 173.10 174.48 2d9h s LEU 8 N -0.91 3.50 -0.16 0.66 1.43 -1.11 -4.92 118.68 117.17 2d9h s LEU 8 Ca 0.14 1.61 -0.00 0.00 -1.03 0.00 0.00 54.13 54.85 2d9h s LEU 8 Cb -0.11 -4.51 0.04 0.00 0.03 0.00 0.00 46.19 41.64 2d9h s LEU 8 CO 0.03 -0.83 -0.07 -1.58 0.23 0.00 0.00 176.35 174.13 2d9h s GLN 9 N -4.29 1.57 -0.10 1.70 2.00 -1.26 -2.57 119.66 116.71 2d9h s GLN 9 Ca 0.59 -0.52 -0.29 0.00 -2.00 0.00 0.00 55.36 53.14 2d9h s GLN 9 Cb -0.12 -2.00 -0.06 0.00 0.80 0.00 0.00 33.01 31.63 2d9h s GLN 9 CO 0.37 -0.39 1.93 0.00 -0.50 0.00 0.00 175.29 176.70 2d9h n GLU 11 N 7.87 1.17 -0.11 0.00 0.28 -1.26 -1.39 120.64 127.20 2d9h n GLU 11 Ca 0.22 -0.26 -0.20 0.00 -0.16 0.00 0.00 57.16 56.76 2d9h n GLU 11 Cb 0.43 -1.14 -0.08 0.00 1.43 0.00 0.00 31.44 32.09 2d9h n GLU 11 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 2d9h n ILE 12 N -0.36 1.51 -0.03 3.84 2.08 -1.26 -4.83 119.36 120.31 2d9h n ILE 12 Ca 0.06 -0.09 -0.04 0.00 0.56 0.00 0.00 62.75 63.24 2d9h n ILE 12 Cb 0.08 -2.09 -0.03 0.00 -0.75 0.00 0.00 39.64 36.85 2d9h n ILE 12 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2d9h n GLY 14 N 3.13 1.72 3.77 0.00 0.00 -0.49 -5.07 105.19 108.25 2d9h n GLY 14 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 2d9h n GLY 14 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2d9h s PHE 15 N -1.88 1.09 -0.04 1.61 5.36 -1.25 -4.69 117.98 118.18 2d9h s PHE 15 Ca 0.00 0.41 -0.03 0.00 -0.96 0.00 0.00 56.93 56.34 2d9h s PHE 15 Cb 0.00 -3.80 0.01 0.00 -0.34 0.00 0.00 43.02 38.89 2d9h s PHE 15 CO 0.00 -3.22 0.10 0.95 -1.46 0.00 0.00 175.22 171.59 2d9h s THR 16 N -3.47 -0.01 -0.22 0.12 -4.23 -1.26 -0.45 115.64 106.12 2d9h s THR 16 Ca 0.72 0.02 -0.09 0.00 -1.18 0.00 0.00 61.69 61.17 2d9h s THR 16 Cb -0.07 -0.16 0.09 0.00 1.34 0.00 0.00 72.50 73.71 2d9h s THR 16 CO 0.54 0.01 0.48 0.00 -0.54 0.00 0.00 174.62 175.11 2d9h h ARG 18 N 7.87 0.41 -6.74 0.00 3.08 -1.88 -2.95 114.38 114.18 2d9h h ARG 18 Ca -0.21 -0.05 -0.51 0.00 0.07 0.00 0.00 59.98 59.28 2d9h h ARG 18 Cb 1.13 -0.08 0.02 0.00 0.08 0.00 0.00 29.97 31.12 2d9h h ARG 18 CO 0.15 0.37 0.52 -0.65 -1.07 0.00 0.00 179.97 179.29 2d9h s GLN 19 N -5.81 4.55 -0.03 0.04 -1.52 -1.26 -4.62 119.66 111.00 2d9h s GLN 19 Ca -0.13 1.86 -0.19 0.00 -1.95 0.00 0.00 55.36 54.94 2d9h s GLN 19 Cb 0.09 -3.21 -0.12 0.00 -0.22 0.00 0.00 33.01 29.55 2d9h s GLN 19 CO 0.72 0.04 0.82 -0.22 -0.25 0.00 0.00 175.29 176.40 2d9h h LYS 20 N 4.51 -0.46 -0.94 2.91 1.63 -2.01 -3.10 116.57 119.11 2d9h h LYS 20 Ca -0.46 0.03 0.28 0.00 -0.85 0.00 0.00 60.65 59.65 2d9h h LYS 20 Cb 1.21 0.11 -0.15 0.00 -0.60 0.00 0.00 32.23 32.80 2d9h h LYS 20 CO 0.71 -0.18 0.39 0.00 -3.45 0.00 0.00 179.45 176.92 2d9h h ALA 21 N -0.80 1.60 -0.20 5.00 0.00 -1.97 0.18 119.26 123.07 2d9h h ALA 21 Ca -0.05 0.21 0.03 0.00 0.00 0.00 0.00 54.91 55.10 2d9h h ALA 21 Cb 0.49 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 2d9h h ALA 21 CO 0.08 -0.52 0.04 0.77 0.00 0.00 0.00 179.25 179.62 2d9h h SER 22 N 0.26 0.01 0.28 0.00 0.02 -1.97 -1.47 113.55 110.69 2d9h h SER 22 Ca 0.64 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.62 2d9h h SER 22 Cb 1.39 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.95 2d9h h SER 22 CO -0.64 0.04 -0.26 0.25 -1.14 0.00 0.00 176.83 175.08 2d9h h LEU 23 N 0.12 -0.68 -0.89 5.07 5.85 -0.59 -0.88 115.31 123.32 2d9h h LEU 23 Ca 0.09 0.06 0.17 0.00 0.84 0.00 0.00 57.88 59.04 2d9h h LEU 23 Cb 0.08 0.23 -0.10 0.00 0.37 0.00 0.00 40.66 41.24 2d9h h LEU 23 CO -0.12 -0.38 0.46 0.78 -0.34 0.00 0.00 178.44 178.85 2d9h h ASN 24 N -0.56 0.54 0.53 1.25 2.35 -1.19 0.61 115.58 119.11 2d9h h ASN 24 Ca -0.01 0.11 -0.06 0.00 -0.55 0.00 0.00 56.30 55.78 2d9h h ASN 24 Cb 0.51 0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.89 2d9h h ASN 24 CO -0.04 0.18 -0.29 -0.25 -1.65 0.00 0.00 177.43 175.38 2d9h h TRP 25 N 0.60 0.00 0.00 1.19 2.91 -0.77 0.61 115.95 120.50 2d9h h TRP 25 Ca 0.51 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.53 2d9h h TRP 25 Cb 0.79 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.44 2d9h h TRP 25 CO -0.08 0.29 -0.77 1.25 -1.03 0.00 0.00 178.44 178.10 2d9h h HIS 26 N 0.00 0.00 0.06 2.65 2.76 0.11 -3.36 115.15 117.37 2d9h h HIS 26 Ca -0.00 0.00 -0.35 0.00 -2.20 0.00 0.00 60.37 57.82 2d9h h HIS 26 Cb 0.64 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 29.56 2d9h h HIS 26 CO 0.00 0.00 -2.02 1.04 -1.30 0.00 0.00 177.93 175.65 2d9h n GLN 27 N -2.18 0.70 -0.10 5.26 6.02 0.17 -4.13 117.38 123.11 2d9h n GLN 27 Ca 0.02 0.23 0.14 0.00 -0.01 0.00 0.00 57.00 57.38 2d9h n GLN 27 Cb 0.46 -1.69 0.52 0.00 1.02 0.00 0.00 30.24 30.55 2d9h n GLN 27 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 2d9h h ARG 28 N 0.03 0.36 -0.23 -1.09 0.11 -1.04 0.02 114.38 112.55 2d9h h ARG 28 Ca -0.42 -0.02 -0.13 0.00 0.10 0.00 0.00 59.98 59.51 2d9h h ARG 28 Cb 2.03 -0.08 -0.01 0.00 1.11 0.00 0.00 29.97 33.02 2d9h h ARG 28 CO 0.05 0.24 -0.39 1.57 0.10 0.00 0.00 179.97 181.55 2d9h h LYS 29 N 0.37 0.52 -1.00 0.08 2.10 -1.72 -3.02 116.57 113.90 2d9h h LYS 29 Ca 0.31 -0.25 0.11 0.00 -2.00 0.00 0.00 60.65 58.81 2d9h h LYS 29 Cb 0.70 -0.00 -0.08 0.00 -0.90 0.00 0.00 32.23 31.95 2d9h h LYS 29 CO -0.08 0.82 0.63 0.45 -2.00 0.00 0.00 179.45 179.27 2d9h h HIS 30 N 0.43 1.15 -0.61 0.07 3.86 -1.14 0.20 115.15 119.11 2d9h h HIS 30 Ca 0.04 0.03 0.03 0.00 -1.16 0.00 0.00 60.37 59.32 2d9h h HIS 30 Cb 0.87 -0.37 -0.03 0.00 1.06 0.00 0.00 27.41 28.94 2d9h h HIS 30 CO 0.03 0.49 0.40 0.00 0.86 0.00 0.00 177.93 179.71 2d9h h ALA 31 N 1.51 1.68 0.14 2.45 0.00 -1.48 0.18 119.26 123.75 2d9h h ALA 31 Ca 0.48 -0.03 -0.31 0.00 0.00 0.00 0.00 54.91 55.05 2d9h h ALA 31 Cb 0.41 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2d9h h ALA 31 CO -0.24 0.25 -1.50 0.93 0.00 0.00 0.00 179.25 178.69 2d9h h GLU 32 N 0.71 0.29 0.04 0.00 4.39 -1.15 -3.36 114.58 115.50 2d9h h GLU 32 Ca 0.24 -0.50 -0.00 0.00 0.34 0.00 0.00 59.36 59.44 2d9h h GLU 32 Cb 0.09 0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 2d9h h GLU 32 CO -0.07 1.18 -0.02 1.15 -1.16 0.00 0.00 179.01 180.10 2d9h h THR 33 N 0.08 1.18 -1.23 1.13 2.02 -0.18 -3.00 112.91 112.91 2d9h h THR 33 Ca -0.23 -0.72 0.40 0.00 0.77 0.00 0.00 66.41 66.62 2d9h h THR 33 Cb 2.03 1.66 -0.13 0.00 -1.74 0.00 0.00 68.15 69.97 2d9h h THR 33 CO 0.18 0.18 0.78 -0.37 0.37 0.00 0.00 175.52 176.67 2d9h h VAL 34 N -0.38 0.19 -0.11 3.16 -1.51 -0.82 0.32 116.25 117.10 2d9h h VAL 34 Ca -0.01 -0.05 0.03 0.00 -1.23 0.00 0.00 66.70 65.44 2d9h h VAL 34 Cb 0.34 0.03 -0.03 0.00 -2.13 0.00 0.00 31.29 29.51 2d9h h VAL 34 CO 0.01 0.03 -0.06 0.00 -1.23 0.00 0.00 177.57 176.31 2d9h h ALA 35 N 1.64 0.04 -0.46 5.19 0.00 -1.66 -3.08 119.26 120.93 2d9h h ALA 35 Ca 0.78 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.78 2d9h h ALA 35 Cb 2.32 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 20.19 2d9h h ALA 35 CO -0.43 -0.52 -0.34 0.00 0.00 0.00 0.00 179.25 177.96 2d9h h ALA 36 N 1.04 -0.42 -1.97 0.00 0.00 -0.45 -3.39 119.26 114.06 2d9h h ALA 36 Ca 0.07 0.04 -0.63 0.00 0.00 0.00 0.00 54.91 54.39 2d9h h ALA 36 Cb 0.16 1.12 0.05 0.00 0.00 0.00 0.00 17.79 19.12 2d9h h ALA 36 CO -0.15 -0.63 0.72 1.28 0.00 0.00 0.00 179.25 180.46 2d9h n LEU 37 N -4.31 2.56 -0.01 0.00 7.99 -1.16 -4.52 117.00 117.55 2d9h n LEU 37 Ca -0.00 1.08 -0.01 0.00 -0.01 0.00 0.00 56.01 57.07 2d9h n LEU 37 Cb 0.17 -1.31 -0.02 0.00 -0.11 0.00 0.00 43.42 42.15 2d9h n LEU 37 CO -0.06 -0.54 -0.59 0.54 -1.51 0.00 0.00 177.39 175.23 2d9h n ARG 38 N 3.65 2.98 -3.32 3.23 3.00 0.21 -4.79 116.66 121.62 2d9h n ARG 38 Ca 0.19 0.00 -0.45 0.00 -0.01 0.00 0.00 57.85 57.58 2d9h n ARG 38 Cb 0.24 -1.07 -0.06 0.00 0.00 0.00 0.00 32.46 31.57 2d9h n ARG 38 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2d9h s PHE 39 N -2.06 3.23 1.05 -1.55 0.40 -0.84 -4.94 117.98 113.26 2d9h s PHE 39 Ca -0.02 -1.11 -0.14 0.00 -0.60 0.00 0.00 56.93 55.06 2d9h s PHE 39 Cb 0.01 -3.57 0.22 0.00 0.51 0.00 0.00 43.02 40.18 2d9h s PHE 39 CO 0.10 -0.96 1.10 -1.25 0.70 0.00 0.00 175.22 174.91 2d9h s PRO 40 N 1.72 -0.00 -0.42 0.24 0.04 -1.26 -1.58 135.00 133.73 2d9h s PRO 40 Ca 0.04 0.37 -0.10 0.00 0.04 0.00 0.00 61.00 61.35 2d9h s PRO 40 Cb -0.27 -1.70 0.07 0.00 0.04 0.00 0.00 34.50 32.64 2d9h s PRO 40 CO 0.05 -2.99 0.26 0.00 0.04 0.00 0.00 177.00 174.36 2d9h n GLU 42 N 4.95 0.26 -0.10 0.00 0.28 -1.26 0.12 120.64 124.89 2d9h n GLU 42 Ca -0.10 0.07 -0.19 0.00 -0.16 0.00 0.00 57.16 56.77 2d9h n GLU 42 Cb 0.43 -1.50 -0.09 0.00 1.43 0.00 0.00 31.44 31.71 2d9h n GLU 42 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 2d9h n PHE 43 N -1.10 0.93 -0.01 -1.84 3.72 -1.26 -4.79 117.46 113.10 2d9h n PHE 43 Ca 0.07 0.40 -0.01 0.00 -0.05 0.00 0.00 57.45 57.85 2d9h n PHE 43 Cb 0.05 -1.02 -0.01 0.00 -0.94 0.00 0.00 39.48 37.55 2d9h n PHE 43 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2d9h n GLY 45 N 3.18 1.18 2.81 0.00 0.00 0.34 -5.01 105.19 107.68 2d9h n GLY 45 Ca -0.04 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.81 2d9h n GLY 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2d9h n LYS 46 N 0.00 -2.09 -3.79 1.61 5.02 -1.25 -3.97 118.16 113.69 2d9h n LYS 46 Ca 0.00 -0.83 -0.13 0.00 -2.02 0.00 0.00 58.31 55.34 2d9h n LYS 46 Cb 0.00 -1.45 -0.10 0.00 -0.02 0.00 0.00 35.03 33.46 2d9h n LYS 46 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2d9h s ARG 47 N -3.73 0.45 0.08 1.97 0.52 -1.26 0.18 118.95 117.16 2d9h s ARG 47 Ca 0.38 0.08 0.04 0.00 -0.52 0.00 0.00 55.73 55.71 2d9h s ARG 47 Cb -0.07 0.20 -0.03 0.00 0.52 0.00 0.00 34.95 35.57 2d9h s ARG 47 CO 0.32 -0.09 -0.11 -0.06 0.02 0.00 0.00 175.30 175.38 2d9h s PHE 48 N -0.54 1.05 0.12 -0.53 0.40 -0.62 -4.83 117.98 113.04 2d9h s PHE 48 Ca -0.06 -0.57 0.32 0.00 -0.60 0.00 0.00 56.93 56.02 2d9h s PHE 48 Cb -0.04 -0.59 1.63 0.00 0.51 0.00 0.00 43.02 44.54 2d9h s PHE 48 CO 0.02 0.01 1.98 1.05 0.70 0.00 0.00 175.22 178.98 2d9h h GLU 49 N 3.94 0.00 -3.43 0.44 4.11 -1.88 0.79 114.58 118.55 2d9h h GLU 49 Ca -0.38 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.00 2d9h h GLU 49 Cb 1.19 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.33 2d9h h GLU 49 CO 0.47 0.00 -0.07 -1.59 0.07 0.00 0.00 179.01 177.89 2d9h s LYS 50 N -3.75 1.22 0.12 1.06 -2.85 -1.26 -4.46 119.74 109.81 2d9h s LYS 50 Ca -0.02 -0.85 -0.13 0.00 -1.00 0.00 0.00 55.97 53.98 2d9h s LYS 50 Cb 0.10 0.48 -0.07 0.00 -2.06 0.00 0.00 37.83 36.28 2d9h s LYS 50 CO 0.36 -0.49 1.45 -1.00 0.10 0.00 0.00 175.35 175.77 2d9h h PRO 51 N 2.32 0.81 -1.04 1.78 0.13 -1.90 -3.10 132.00 131.00 2d9h h PRO 51 Ca -0.31 -0.43 0.33 0.00 -0.87 0.00 0.00 66.00 64.72 2d9h h PRO 51 Cb 1.25 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 32.26 2d9h h PRO 51 CO 0.43 1.06 0.61 0.22 -0.23 0.00 0.00 178.00 180.09 2d9h h ASP 52 N 0.59 0.49 1.14 1.44 1.82 -1.99 1.07 116.42 120.99 2d9h h ASP 52 Ca 0.05 0.17 -0.17 0.00 -0.39 0.00 0.00 57.03 56.70 2d9h h ASP 52 Cb 0.91 0.12 -0.02 0.00 0.68 0.00 0.00 39.33 41.02 2d9h h ASP 52 CO 0.08 -0.11 -0.79 -1.28 -1.61 0.00 0.00 179.24 175.53 2d9h h SER 53 N 0.32 0.00 0.24 2.28 0.87 -1.97 -3.05 113.55 112.23 2d9h h SER 53 Ca 0.73 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 61.11 2d9h h SER 53 Cb 1.73 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.69 2d9h h SER 53 CO -0.56 0.79 -0.70 0.58 -0.53 0.00 0.00 176.83 176.41 2d9h h VAL 54 N 0.00 1.37 -0.23 2.23 2.07 0.11 -1.45 116.25 120.34 2d9h h VAL 54 Ca -0.01 -2.09 -0.18 0.00 0.82 0.00 0.00 66.70 65.25 2d9h h VAL 54 Cb 1.58 2.07 -0.00 0.00 -1.52 0.00 0.00 31.29 33.41 2d9h h VAL 54 CO 0.10 0.63 -0.57 0.00 0.02 0.00 0.00 177.57 177.76 2d9h h ALA 55 N 0.96 0.56 -0.14 1.67 0.00 -0.61 -3.11 119.26 118.58 2d9h h ALA 55 Ca -0.02 -0.52 -0.22 0.00 0.00 0.00 0.00 54.91 54.14 2d9h h ALA 55 Cb 1.27 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.99 2d9h h ALA 55 CO 0.12 0.69 -0.79 0.00 0.00 0.00 0.00 179.25 179.26 2d9h h ALA 56 N 0.81 0.32 -0.71 0.00 0.00 -1.53 -3.16 119.26 114.98 2d9h h ALA 56 Ca 0.01 -0.61 0.12 0.00 0.00 0.00 0.00 54.91 54.43 2d9h h ALA 56 Cb 1.15 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.88 2d9h h ALA 56 CO 0.12 0.69 0.47 1.25 0.00 0.00 0.00 179.25 181.78 2d9h h HIS 57 N 0.52 0.53 0.00 0.00 6.17 -1.27 0.29 115.15 121.38 2d9h h HIS 57 Ca -0.06 0.01 -0.01 0.00 0.71 0.00 0.00 60.37 61.03 2d9h h HIS 57 Cb 1.42 -0.17 -0.00 0.00 2.52 0.00 0.00 27.41 31.18 2d9h h HIS 57 CO 0.09 0.22 -0.05 0.00 0.71 0.00 0.00 177.93 178.90 2d9h h ARG 58 N 0.47 0.00 -0.01 5.26 3.08 -1.51 0.62 114.38 122.30 2d9h h ARG 58 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 2d9h h ARG 58 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.73 2d9h h ARG 58 CO -0.11 0.05 -0.41 0.45 -1.07 0.00 0.00 179.97 178.88 2d9h n SER 59 N -3.15 1.01 -0.01 7.04 2.88 0.95 -0.21 113.62 122.14 2d9h n SER 59 Ca 0.01 -0.81 0.00 0.00 -1.33 0.00 0.00 58.87 56.75 2d9h n SER 59 Cb 0.37 0.28 -0.02 0.00 -0.75 0.00 0.00 64.21 64.09 2d9h n SER 59 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2d9h n LYS 60 N -0.87 1.93 -0.02 -1.46 5.02 -0.81 -4.35 118.16 117.60 2d9h n LYS 60 Ca 0.09 -0.01 -0.02 0.00 -2.02 0.00 0.00 58.31 56.35 2d9h n LYS 60 Cb 0.36 -1.05 -0.03 0.00 -0.02 0.00 0.00 35.03 34.28 2d9h n LYS 60 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2d9h n SER 61 N -1.84 3.89 -1.07 4.39 7.64 0.21 -4.69 113.62 122.17 2d9h n SER 61 Ca -0.02 -0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.82 2d9h n SER 61 Cb 0.32 0.52 0.16 0.00 -1.01 0.00 0.00 64.21 64.21 2d9h n SER 61 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2d9h n HIS 62 N -2.22 0.89 0.37 1.43 8.25 -0.46 -4.72 115.22 118.77 2d9h n HIS 62 Ca -0.07 -1.71 0.13 0.00 -0.26 0.00 0.00 57.72 55.80 2d9h n HIS 62 Cb 0.64 -0.35 0.53 0.00 1.12 0.00 0.00 29.99 31.92 2d9h n HIS 62 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2d9h h PRO 63 N 1.27 0.00 0.00 -0.41 0.13 -0.79 -2.34 132.00 129.87 2d9h h PRO 63 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 2d9h h PRO 63 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2d9h h PRO 63 CO 0.28 0.00 -0.98 0.00 -0.23 0.00 0.00 178.00 177.08 2d9h n ALA 64 N -1.83 3.32 -0.10 -0.56 0.00 -1.26 -4.34 120.51 115.74 2d9h n ALA 64 Ca 0.02 -0.38 -0.23 0.00 0.00 0.00 0.00 53.44 52.85 2d9h n ALA 64 Cb 0.24 -1.00 -0.12 0.00 0.00 0.00 0.00 19.45 18.57 2d9h n ALA 64 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2d9h n LEU 65 N -1.99 1.97 -0.26 0.00 4.77 -0.92 -4.26 117.00 116.31 2d9h n LEU 65 Ca 0.02 0.38 0.23 0.00 -0.03 0.00 0.00 56.01 56.61 2d9h n LEU 65 Cb 0.44 -0.96 0.42 0.00 -2.33 0.00 0.00 43.42 40.98 2d9h n LEU 65 CO 0.40 0.38 0.79 0.18 -1.33 0.00 0.00 177.39 177.81 2d9h n LEU 66 N -4.30 0.20 -4.18 2.23 4.77 -0.97 -4.40 117.00 110.36 2d9h n LEU 66 Ca -0.35 1.31 -0.26 0.00 -0.03 0.00 0.00 56.01 56.68 2d9h n LEU 66 Cb 0.75 -0.61 0.24 0.00 -2.33 0.00 0.00 43.42 41.47 2d9h n LEU 66 CO 0.19 -1.44 0.22 0.18 -1.33 0.00 0.00 177.39 175.20 2d9h n LEU 67 N -4.85 -0.93 -4.77 2.23 4.32 -1.26 -4.91 117.00 106.83 2d9h n LEU 67 Ca 0.28 -0.60 -0.40 0.00 -0.02 0.00 0.00 56.01 55.27 2d9h n LEU 67 Cb 0.93 -0.95 -0.02 0.00 -1.62 0.00 0.00 43.42 41.76 2d9h n LEU 67 CO -0.01 -3.96 0.92 0.00 -1.22 0.00 0.00 177.39 173.12 2d9h s ALA 68 N -2.14 3.32 -2.00 -1.18 0.00 -1.26 -4.88 121.76 113.62 2d9h s ALA 68 Ca 0.57 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.67 2d9h s ALA 68 Cb -0.12 -3.44 0.02 0.00 0.00 0.00 0.00 23.12 19.59 2d9h s ALA 68 CO 0.50 -0.62 0.51 -0.35 0.00 0.00 0.00 175.76 175.80 2d9h n PRO 69 N 0.42 0.49 -0.24 0.00 -0.04 -1.26 -3.97 135.00 130.40 2d9h n PRO 69 Ca 0.02 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.49 2d9h n PRO 69 Cb 0.44 -1.01 0.08 0.00 -0.04 0.00 0.00 33.50 32.97 2d9h n PRO 69 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 2d9h h GLN 70 N 0.00 0.00 -3.32 0.54 4.15 -1.99 -3.37 115.11 111.13 2d9h h GLN 70 Ca 0.00 -0.00 -0.47 0.00 0.77 0.00 0.00 58.65 58.95 2d9h h GLN 70 Cb 0.00 -0.00 -0.40 0.00 0.21 0.00 0.00 27.48 27.29 2d9h h GLN 70 CO 0.00 0.00 -0.76 -1.21 -1.93 0.00 0.00 178.83 174.94 2d9h s GLU 71 N -6.24 0.31 0.33 1.69 2.02 -1.25 -5.14 118.70 110.42 2d9h s GLU 71 Ca -0.14 -0.13 0.03 0.00 0.02 0.00 0.00 54.97 54.75 2d9h s GLU 71 Cb 0.21 -1.70 -0.04 0.00 0.10 0.00 0.00 34.13 32.70 2d9h s GLU 71 CO 0.74 -0.59 0.14 -1.12 0.02 0.00 0.00 175.26 174.46 2d9h s SER 72 N 2.03 1.98 -0.15 -0.19 0.01 -1.26 -5.04 113.70 111.07 2d9h s SER 72 Ca 0.02 -1.57 -0.05 0.00 1.31 0.00 0.00 55.95 55.66 2d9h s SER 72 Cb -0.16 0.36 0.08 0.00 0.21 0.00 0.00 66.02 66.51 2d9h s SER 72 CO -0.08 -0.87 0.30 -0.44 0.41 0.00 0.00 173.24 172.57 2d9h s SER 73 N -3.45 0.27 0.08 2.44 0.01 -1.26 -5.15 113.70 106.63 2d9h s SER 73 Ca 0.33 0.62 -0.26 0.00 1.31 0.00 0.00 55.95 57.94 2d9h s SER 73 Cb 0.05 0.85 0.08 0.00 0.21 0.00 0.00 66.02 67.21 2d9h s SER 73 CO 0.17 -0.25 0.81 -0.83 0.41 0.00 0.00 173.24 173.55 2d9h s GLY 74 N 2.46 -0.46 0.72 3.44 0.00 -1.26 -5.17 107.32 107.05 2d9h s GLY 74 Ca 0.02 0.69 -0.13 0.00 0.00 0.00 0.00 44.72 45.30 2d9h s GLY 74 CO -0.10 0.22 1.10 2.56 0.00 0.00 0.00 173.10 176.88 2d9h s PRO 75 N -3.36 2.50 0.35 2.90 0.04 -1.26 -5.02 135.00 131.15 2d9h s PRO 75 Ca 0.05 1.27 -0.21 0.00 0.04 0.00 0.00 61.00 62.15 2d9h s PRO 75 Cb -0.01 -1.92 -0.10 0.00 0.04 0.00 0.00 34.50 32.51 2d9h s PRO 75 CO -0.08 -1.47 0.88 -1.12 0.04 0.00 0.00 177.00 175.25 2d9h s SER 76 N -3.02 7.04 -1.13 6.66 0.01 -1.26 -3.92 113.70 118.08 2d9h s SER 76 Ca 0.64 1.62 -0.06 0.00 1.31 0.00 0.00 55.95 59.45 2d9h s SER 76 Cb -0.19 -2.50 0.01 0.00 0.21 0.00 0.00 66.02 63.55 2d9h s SER 76 CO 0.49 -0.19 0.99 -0.24 0.41 0.00 0.00 173.24 174.70 2d9h n SER 77 N -0.04 -5.16 0.00 2.44 2.88 -1.26 -5.36 113.62 107.11 2d9h n SER 77 Ca 0.04 -0.47 0.00 0.00 -1.33 0.00 0.00 58.87 57.11 2d9h n SER 77 Cb 0.52 -4.37 0.00 0.00 -0.75 0.00 0.00 64.21 59.61 2d9h n SER 77 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42