#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4h n ALA 3 N 0.00 -0.48 -3.57 4.61 0.00 -1.26 -4.94 120.51 114.86 2k4h n ALA 3 Ca 0.00 0.15 -0.34 0.00 0.00 0.00 0.00 53.44 53.25 2k4h n ALA 3 Cb 0.00 -1.88 -0.07 0.00 0.00 0.00 0.00 19.45 17.51 2k4h n ALA 3 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2k4h n ARG 4 N -2.63 2.71 -3.58 0.00 1.74 -1.26 -4.78 116.66 108.87 2k4h n ARG 4 Ca -0.20 -4.53 -0.20 0.00 -0.77 0.00 0.00 57.85 52.15 2k4h n ARG 4 Cb 0.65 -2.38 0.06 0.00 -1.02 0.00 0.00 32.46 29.77 2k4h n ARG 4 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2k4h n ASN 5 N 1.86 -2.45 -1.38 0.55 5.15 -1.26 -4.69 115.26 113.04 2k4h n ASN 5 Ca 0.24 -0.69 0.18 0.00 -0.60 0.00 0.00 54.58 53.70 2k4h n ASN 5 Cb 0.37 -4.66 -0.07 0.00 -0.53 0.00 0.00 39.78 34.89 2k4h n ASN 5 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2k4h n SER 6 N -3.07 -8.18 -0.02 1.20 3.41 -1.26 -4.76 113.62 100.94 2k4h n SER 6 Ca -0.23 1.06 -0.20 0.00 -0.26 0.00 0.00 58.87 59.23 2k4h n SER 6 Cb 0.65 -4.52 -0.14 0.00 -0.26 0.00 0.00 64.21 59.95 2k4h n SER 6 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2k4h n VAL 7 N -4.24 1.72 -1.72 -3.33 0.31 -1.26 -4.93 118.33 104.89 2k4h n VAL 7 Ca -0.05 -0.64 -0.41 0.00 -0.01 0.00 0.00 64.34 63.23 2k4h n VAL 7 Cb 0.65 -1.65 0.01 0.00 -0.91 0.00 0.00 33.84 31.94 2k4h n VAL 7 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2k4h n LEU 8 N -3.43 4.36 0.00 7.52 4.77 -1.26 -5.02 117.00 123.94 2k4h n LEU 8 Ca -0.34 1.11 -0.08 0.00 -0.03 0.00 0.00 56.01 56.66 2k4h n LEU 8 Cb 1.04 -1.53 0.03 0.00 -2.33 0.00 0.00 43.42 40.63 2k4h n LEU 8 CO 0.40 -0.52 0.16 -1.14 -1.33 0.00 0.00 177.39 174.96 2k4h n ARG 9 N -0.05 0.80 0.00 3.23 3.00 -1.26 -4.97 116.66 117.42 2k4h n ARG 9 Ca 0.06 -1.27 0.00 0.00 -0.00 0.00 0.00 57.85 56.64 2k4h n ARG 9 Cb 0.40 -0.11 0.00 0.00 0.00 0.00 0.00 32.46 32.75 2k4h n ARG 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2k4h n GLY 10 N 2.08 -0.29 0.34 5.14 0.00 -1.26 -2.83 105.19 108.36 2k4h n GLY 10 Ca 0.07 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.05 2k4h n GLY 10 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2k4h h LYS 11 N 0.00 1.12 -0.29 1.61 1.63 -2.01 -2.80 116.57 115.84 2k4h h LYS 11 Ca 0.00 -0.16 0.00 0.00 -0.85 0.00 0.00 60.65 59.64 2k4h h LYS 11 Cb 0.00 -0.21 -0.01 0.00 -0.60 0.00 0.00 32.23 31.41 2k4h h LYS 11 CO 0.00 0.86 0.19 0.87 -3.45 0.00 0.00 179.45 177.92 2k4h h LYS 12 N 1.12 0.38 -0.90 1.90 6.56 -1.99 -2.23 116.57 121.40 2k4h h LYS 12 Ca 0.27 -0.03 0.20 0.00 -1.06 0.00 0.00 60.65 60.03 2k4h h LYS 12 Cb 0.11 -0.08 -0.07 0.00 -0.57 0.00 0.00 32.23 31.62 2k4h h LYS 12 CO -0.03 0.26 0.59 0.00 -2.06 0.00 0.00 179.45 178.21 2k4h h ALA 13 N 1.09 2.16 -0.21 3.86 0.00 -1.34 0.30 119.26 125.13 2k4h h ALA 13 Ca 0.11 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2k4h h ALA 13 Cb -0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2k4h h ALA 13 CO -0.02 -0.45 0.09 0.22 0.00 0.00 0.00 179.25 179.09 2k4h h ASP 14 N 0.44 0.26 0.42 0.00 1.82 -1.32 0.23 116.42 118.28 2k4h h ASP 14 Ca 0.47 -0.02 -0.31 0.00 -0.39 0.00 0.00 57.03 56.78 2k4h h ASP 14 Cb 1.13 -0.07 -0.02 0.00 0.68 0.00 0.00 39.33 41.05 2k4h h ASP 14 CO -0.19 0.24 -1.63 -0.08 -1.61 0.00 0.00 179.24 175.97 2k4h h GLU 15 N 0.30 0.19 -0.21 0.28 4.22 -0.48 -3.09 114.58 115.78 2k4h h GLU 15 Ca 0.08 -0.33 -0.09 0.00 0.08 0.00 0.00 59.36 59.10 2k4h h GLU 15 Cb 0.05 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 2k4h h GLU 15 CO -0.01 1.01 -0.20 1.25 -2.18 0.00 0.00 179.01 178.87 2k4h h LEU 16 N 0.05 0.55 0.00 1.64 7.12 -0.68 -2.69 115.31 121.30 2k4h h LEU 16 Ca -0.27 -0.47 0.00 0.00 0.13 0.00 0.00 57.88 57.26 2k4h h LEU 16 Cb 2.01 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 41.99 2k4h h LEU 16 CO 0.13 0.90 0.00 -0.62 -0.13 0.00 0.00 178.44 178.73 2k4h n GLU 17 N -4.43 0.26 -0.02 1.25 1.02 0.78 -3.35 120.64 116.16 2k4h n GLU 17 Ca -0.05 0.06 -0.21 0.00 -0.02 0.00 0.00 57.16 56.94 2k4h n GLU 17 Cb 0.41 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.19 2k4h n GLU 17 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2k4h h ARG 18 N 0.00 0.18 -6.38 3.49 2.43 -1.41 -3.43 114.38 109.26 2k4h h ARG 18 Ca 0.00 -0.30 -0.64 0.00 -0.81 0.00 0.00 59.98 58.23 2k4h h ARG 18 Cb 0.29 0.11 0.05 0.00 -0.42 0.00 0.00 29.97 30.00 2k4h h ARG 18 CO 0.00 1.14 0.63 -0.89 -1.51 0.00 0.00 179.97 179.34 2k4h n ILE 19 N -4.09 0.01 -3.21 1.20 5.41 -1.04 -4.93 119.36 112.71 2k4h n ILE 19 Ca -0.24 -0.00 -0.39 0.00 1.00 0.00 0.00 62.75 63.12 2k4h n ILE 19 Cb 0.81 -1.17 -0.05 0.00 -0.71 0.00 0.00 39.64 38.52 2k4h n ILE 19 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 2k4h s ARG 20 N 0.77 4.35 0.50 0.38 0.52 -0.05 -3.09 118.95 122.33 2k4h s ARG 20 Ca 0.82 0.65 0.20 0.00 -0.52 0.00 0.00 55.73 56.89 2k4h s ARG 20 Cb -0.83 -3.41 1.28 0.00 0.52 0.00 0.00 34.95 32.51 2k4h s ARG 20 CO 0.43 0.20 2.02 -0.07 0.02 0.00 0.00 175.30 177.90 2k4h h LEU 21 N 6.39 0.09 -8.83 2.53 3.38 -0.80 0.95 115.31 119.02 2k4h h LEU 21 Ca -0.42 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.13 2k4h h LEU 21 Cb 1.19 -0.02 -0.14 0.00 0.09 0.00 0.00 40.66 41.78 2k4h h LEU 21 CO 0.74 0.06 -0.72 -0.13 0.09 0.00 0.00 178.44 178.47 2k4h s ARG 22 N -5.12 1.26 0.27 1.13 0.52 -1.26 -4.17 118.95 111.59 2k4h s ARG 22 Ca -0.06 -1.56 0.05 0.00 -0.52 0.00 0.00 55.73 53.65 2k4h s ARG 22 Cb 0.19 -0.97 0.38 0.00 0.52 0.00 0.00 34.95 35.07 2k4h s ARG 22 CO 0.72 0.14 1.65 -1.00 0.02 0.00 0.00 175.30 176.84 2k4h h PRO 23 N 2.61 0.27 0.00 3.54 0.13 -1.93 -3.35 132.00 133.27 2k4h h PRO 23 Ca -0.38 -0.14 -0.22 0.00 -0.87 0.00 0.00 66.00 64.39 2k4h h PRO 23 Cb 1.21 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 2k4h h PRO 23 CO 0.63 0.68 -1.85 0.41 -0.23 0.00 0.00 178.00 177.64 2k4h n GLY 24 N -0.05 -0.40 3.15 1.56 0.00 -1.26 -5.00 105.19 103.20 2k4h n GLY 24 Ca -0.02 -0.15 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 2k4h n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k4h n GLY 25 N 2.52 -3.04 0.08 -0.02 0.00 -1.26 -4.96 105.19 98.52 2k4h n GLY 25 Ca -0.23 -1.21 0.05 0.00 0.00 0.00 0.00 46.02 44.63 2k4h n GLY 25 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k4h n LYS 26 N -3.72 1.64 -3.30 1.61 5.02 -1.26 -4.78 118.16 113.37 2k4h n LYS 26 Ca 0.08 -1.95 -0.33 0.00 -2.02 0.00 0.00 58.31 54.09 2k4h n LYS 26 Cb 0.49 -1.18 -0.06 0.00 -0.02 0.00 0.00 35.03 34.26 2k4h n LYS 26 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2k4h s LYS 27 N -1.82 3.90 0.37 1.97 1.02 -1.26 -4.99 119.74 118.93 2k4h s LYS 27 Ca 0.17 0.45 0.07 0.00 0.02 0.00 0.00 55.97 56.68 2k4h s LYS 27 Cb 0.15 -2.61 -0.07 0.00 -0.52 0.00 0.00 37.83 34.78 2k4h s LYS 27 CO 0.02 0.28 -0.02 0.15 -0.92 0.00 0.00 175.35 174.86 2k4h s LYS 28 N -2.77 1.84 0.43 1.68 1.02 -1.26 -0.11 119.74 120.57 2k4h s LYS 28 Ca 0.49 -2.01 -0.24 0.00 0.02 0.00 0.00 55.97 54.23 2k4h s LYS 28 Cb -0.11 -1.51 -0.08 0.00 -0.52 0.00 0.00 37.83 35.61 2k4h s LYS 28 CO 0.20 -0.01 1.14 0.71 -0.92 0.00 0.00 175.35 176.46 2k4h s TYR 29 N -2.79 3.01 0.10 3.18 2.02 -1.18 -4.72 117.35 116.97 2k4h s TYR 29 Ca 0.34 1.56 -0.03 0.00 -0.37 0.00 0.00 57.07 58.57 2k4h s TYR 29 Cb 0.07 -3.32 -0.03 0.00 -0.40 0.00 0.00 41.96 38.28 2k4h s TYR 29 CO 0.17 -1.25 0.08 0.50 -1.57 0.00 0.00 175.55 173.47 2k4h s ARG 30 N -2.57 0.83 0.46 -0.62 3.52 -1.26 -4.56 118.95 114.75 2k4h s ARG 30 Ca 0.61 -1.25 0.26 0.00 -0.13 0.00 0.00 55.73 55.23 2k4h s ARG 30 Cb -0.27 0.27 1.31 0.00 -1.56 0.00 0.00 34.95 34.69 2k4h s ARG 30 CO 0.34 -0.23 1.78 -0.07 -0.81 0.00 0.00 175.30 176.31 2k4h h LEU 31 N 2.90 0.25 -0.84 -0.88 3.38 -2.00 0.20 115.31 118.32 2k4h h LEU 31 Ca -0.34 0.05 0.14 0.00 0.09 0.00 0.00 57.88 57.82 2k4h h LEU 31 Cb 1.18 0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.85 2k4h h LEU 31 CO 0.60 0.03 0.43 0.11 0.09 0.00 0.00 178.44 179.70 2k4h h LYS 32 N 0.21 0.60 0.00 1.13 1.57 -2.00 0.69 116.57 118.77 2k4h h LYS 32 Ca 0.59 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 59.23 2k4h h LYS 32 Cb 1.86 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 34.02 2k4h h LYS 32 CO -0.18 0.40 -0.48 0.45 -0.57 0.00 0.00 179.45 179.06 2k4h h HIS 33 N 0.62 0.00 -0.19 -1.35 3.86 -1.00 -2.93 115.15 114.16 2k4h h HIS 33 Ca 0.45 0.00 -0.20 0.00 -1.16 0.00 0.00 60.37 59.47 2k4h h HIS 33 Cb 0.63 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.10 2k4h h HIS 33 CO -0.09 0.48 -0.67 0.82 0.86 0.00 0.00 177.93 179.33 2k4h h ILE 34 N 0.00 1.30 0.03 2.45 2.04 -0.86 -3.06 117.51 119.41 2k4h h ILE 34 Ca -0.00 -1.90 -0.00 0.00 1.00 0.00 0.00 64.86 63.96 2k4h h ILE 34 Cb 0.87 1.86 0.00 0.00 -0.74 0.00 0.00 36.82 38.81 2k4h h ILE 34 CO 0.06 0.60 -0.02 0.58 0.00 0.00 0.00 178.15 179.38 2k4h h VAL 35 N 0.53 1.03 -0.18 1.67 2.07 -1.17 -2.14 116.25 118.06 2k4h h VAL 35 Ca -0.02 -0.19 0.05 0.00 0.82 0.00 0.00 66.70 67.36 2k4h h VAL 35 Cb 1.27 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 2k4h h VAL 35 CO 0.14 0.05 0.16 -0.25 0.02 0.00 0.00 177.57 177.69 2k4h h TRP 36 N -0.13 0.00 -0.08 1.57 7.01 -1.57 -1.73 115.95 121.01 2k4h h TRP 36 Ca -0.00 0.00 -0.09 0.00 2.11 0.00 0.00 58.89 60.91 2k4h h TRP 36 Cb 0.11 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.18 2k4h h TRP 36 CO -0.05 0.00 -0.29 0.00 -2.79 0.00 0.00 178.44 175.31 2k4h h ALA 37 N 1.85 0.15 -0.97 2.65 0.00 -1.30 -3.24 119.26 118.39 2k4h h ALA 37 Ca 0.09 -0.42 0.01 0.00 0.00 0.00 0.00 54.91 54.59 2k4h h ALA 37 Cb 0.41 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 2k4h h ALA 37 CO -0.00 0.17 0.64 0.00 0.00 0.00 0.00 179.25 180.06 2k4h h ALA 38 N 0.46 1.32 -0.48 0.00 0.00 -0.72 -1.54 119.26 118.31 2k4h h ALA 38 Ca -0.01 -0.06 0.12 0.00 0.00 0.00 0.00 54.91 54.96 2k4h h ALA 38 Cb 0.92 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2k4h h ALA 38 CO 0.06 0.62 0.34 -0.97 0.00 0.00 0.00 179.25 179.30 2k4h h ASN 39 N 1.29 0.09 0.06 0.00 -0.73 -1.45 -1.71 115.58 113.13 2k4h h ASN 39 Ca 0.36 0.00 -0.16 0.00 1.87 0.00 0.00 56.30 58.38 2k4h h ASN 39 Cb -0.12 -0.02 0.02 0.00 0.27 0.00 0.00 38.32 38.47 2k4h h ASN 39 CO -0.08 0.05 -0.65 0.50 -0.37 0.00 0.00 177.43 176.88 2k4h h LYS 40 N 0.10 0.34 -0.59 6.67 3.64 -1.33 -3.23 116.57 122.17 2k4h h LYS 40 Ca 0.23 -0.44 0.17 0.00 -1.27 0.00 0.00 60.65 59.34 2k4h h LYS 40 Cb 0.77 0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.71 2k4h h LYS 40 CO -0.02 1.15 0.57 -0.07 -2.27 0.00 0.00 179.45 178.80 2k4h h LEU 41 N -0.26 0.00 0.05 5.20 3.38 -0.94 -0.65 115.31 122.07 2k4h h LEU 41 Ca -0.10 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 2k4h h LEU 41 Cb 1.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.17 2k4h h LEU 41 CO 0.12 0.00 -0.02 0.44 0.09 0.00 0.00 178.44 179.07 2k4h h ASP 42 N 0.00 -0.05 -0.42 -0.43 5.19 -1.52 0.32 116.42 119.50 2k4h h ASP 42 Ca 0.28 -0.60 0.12 0.00 -0.62 0.00 0.00 57.03 56.21 2k4h h ASP 42 Cb 1.41 0.01 -0.02 0.00 0.18 0.00 0.00 39.33 40.92 2k4h h ASP 42 CO -0.00 0.62 0.55 -0.09 -3.12 0.00 0.00 179.24 177.19 2k4h h ARG 43 N -0.77 0.00 0.01 3.56 9.65 -1.16 -1.72 114.38 123.95 2k4h h ARG 43 Ca -0.01 0.00 -0.41 0.00 -1.10 0.00 0.00 59.98 58.47 2k4h h ARG 43 Cb 0.65 0.00 -0.06 0.00 -1.39 0.00 0.00 29.97 29.17 2k4h h ARG 43 CO 0.01 0.00 -2.35 1.19 2.80 0.00 0.00 179.97 181.62 2k4h n PHE 44 N -3.49 0.21 0.00 2.20 3.72 -1.07 -5.05 117.46 113.98 2k4h n PHE 44 Ca 0.08 0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.55 2k4h n PHE 44 Cb 0.72 -1.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.23 2k4h n PHE 44 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2k4h n GLY 45 N 1.67 4.23 3.42 1.37 0.00 0.10 -5.12 105.19 110.86 2k4h n GLY 45 Ca -0.48 -0.68 -0.47 0.00 0.00 0.00 0.00 46.02 44.39 2k4h n GLY 45 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k4h n LEU 46 N 0.00 -0.94 -4.75 0.99 4.32 -0.74 -4.75 117.00 111.13 2k4h n LEU 46 Ca 0.00 1.12 -0.40 0.00 -0.02 0.00 0.00 56.01 56.71 2k4h n LEU 46 Cb 0.00 -0.99 -0.05 0.00 -1.62 0.00 0.00 43.42 40.76 2k4h n LEU 46 CO 0.00 -2.85 0.75 0.00 -1.22 0.00 0.00 177.39 174.07 2k4h s ALA 47 N -1.04 3.38 0.16 -1.18 0.00 -1.26 -3.98 121.76 117.83 2k4h s ALA 47 Ca 0.63 0.80 0.35 0.00 0.00 0.00 0.00 51.96 53.74 2k4h s ALA 47 Cb -0.89 -3.30 1.54 0.00 0.00 0.00 0.00 23.12 20.46 2k4h s ALA 47 CO 0.57 -0.08 2.03 1.05 0.00 0.00 0.00 175.76 179.33 2k4h h GLU 48 N 4.32 0.00 0.00 0.00 4.11 -1.89 -2.19 114.58 118.93 2k4h h GLU 48 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 2k4h h GLU 48 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2k4h h GLU 48 CO 0.69 0.00 0.00 -1.13 0.07 0.00 0.00 179.01 178.64 2k4h n SER 49 N -3.01 0.16 -0.03 3.06 3.41 -1.26 -2.03 113.62 113.92 2k4h n SER 49 Ca -0.00 0.54 0.16 0.00 -0.26 0.00 0.00 58.87 59.30 2k4h n SER 49 Cb 0.25 -0.57 0.86 0.00 -0.26 0.00 0.00 64.21 64.49 2k4h n SER 49 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2k4h n LEU 50 N -1.68 0.09 0.00 1.04 4.77 -0.82 -3.27 117.00 117.13 2k4h n LEU 50 Ca 0.03 0.06 0.12 0.00 -0.03 0.00 0.00 56.01 56.19 2k4h n LEU 50 Cb 0.19 -0.09 0.70 0.00 -2.33 0.00 0.00 43.42 41.89 2k4h n LEU 50 CO 0.15 0.02 0.94 0.18 -1.33 0.00 0.00 177.39 177.35 2k4h n LEU 51 N -1.02 0.00 -1.58 2.23 4.77 -0.86 -3.08 117.00 117.46 2k4h n LEU 51 Ca 0.21 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 56.04 2k4h n LEU 51 Cb 0.17 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.34 2k4h n LEU 51 CO 0.20 0.00 0.33 -1.84 -1.33 0.00 0.00 177.39 174.74 2k4h n GLU 52 N -0.88 2.88 -3.64 3.23 0.28 -1.20 -4.98 120.64 116.33 2k4h n GLU 52 Ca 0.18 -3.82 -0.03 0.00 -0.16 0.00 0.00 57.16 53.33 2k4h n GLU 52 Cb 0.08 -2.06 -0.07 0.00 1.43 0.00 0.00 31.44 30.82 2k4h n GLU 52 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 2k4h s SER 53 N -3.34 -0.55 0.17 -1.84 1.04 -1.21 -5.05 113.70 102.93 2k4h s SER 53 Ca 0.48 0.89 -0.16 0.00 0.48 0.00 0.00 55.95 57.63 2k4h s SER 53 Cb 0.40 1.23 0.12 0.00 0.10 0.00 0.00 66.02 67.87 2k4h s SER 53 CO 0.00 -0.14 1.67 0.07 0.98 0.00 0.00 173.24 175.82 2k4h h LYS 54 N 6.17 0.02 -0.67 4.02 2.10 -1.86 0.34 116.57 126.69 2k4h h LYS 54 Ca -0.28 -0.00 0.13 0.00 -2.00 0.00 0.00 60.65 58.50 2k4h h LYS 54 Cb 1.20 -0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 32.43 2k4h h LYS 54 CO 0.19 0.01 0.18 0.93 -2.00 0.00 0.00 179.45 178.77 2k4h h GLU 55 N 0.02 0.30 -0.38 0.07 5.08 -1.97 0.30 114.58 118.00 2k4h h GLU 55 Ca 0.21 -0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.45 2k4h h GLU 55 Cb 0.32 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 2k4h h GLU 55 CO -0.43 0.20 -0.13 0.78 -1.00 0.00 0.00 179.01 178.43 2k4h h GLY 56 N 0.31 0.83 2.00 -3.84 0.00 -1.41 -2.94 103.07 98.02 2k4h h GLY 56 Ca 0.36 -0.72 -0.06 0.00 0.00 0.00 0.00 47.33 46.91 2k4h h GLY 56 CO -0.43 0.65 -0.30 0.00 0.00 0.00 0.00 176.54 176.46 2k4h h GLN 58 N 0.00 1.00 0.00 0.00 4.15 -0.28 -2.26 115.11 117.72 2k4h h GLN 58 Ca -0.00 -0.30 0.00 0.00 0.77 0.00 0.00 58.65 59.11 2k4h h GLN 58 Cb 0.54 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.13 2k4h h GLN 58 CO 0.04 0.98 0.00 0.87 -1.93 0.00 0.00 178.83 178.79 2k4h h LYS 59 N 0.91 0.00 0.08 1.69 1.57 -1.33 -2.82 116.57 116.67 2k4h h LYS 59 Ca 0.17 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.66 2k4h h LYS 59 Cb 0.53 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.87 2k4h h LYS 59 CO 0.03 0.00 -1.18 0.82 -0.57 0.00 0.00 179.45 178.55 2k4h h ILE 60 N 0.00 1.29 -0.56 1.86 2.04 -1.33 -3.08 117.51 117.73 2k4h h ILE 60 Ca 0.00 -2.41 -0.04 0.00 1.00 0.00 0.00 64.86 63.41 2k4h h ILE 60 Cb 0.43 2.60 -0.02 0.00 -0.74 0.00 0.00 36.82 39.08 2k4h h ILE 60 CO 0.00 0.74 0.21 -0.07 0.00 0.00 0.00 178.15 179.02 2k4h h LEU 61 N 0.31 0.78 -1.65 1.44 3.38 -1.29 -0.57 115.31 117.71 2k4h h LEU 61 Ca -0.17 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.58 2k4h h LEU 61 Cb 1.85 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.39 2k4h h LEU 61 CO 0.23 0.75 -0.18 0.00 0.09 0.00 0.00 178.44 179.33 2k4h h THR 62 N 0.77 1.10 0.16 0.22 1.03 -1.61 0.28 112.91 114.85 2k4h h THR 62 Ca 0.18 -0.62 -0.29 0.00 -0.01 0.00 0.00 66.41 65.67 2k4h h THR 62 Cb 0.23 1.34 0.02 0.00 -1.07 0.00 0.00 68.15 68.66 2k4h h THR 62 CO -0.01 0.18 -1.29 0.58 -0.01 0.00 0.00 175.52 174.96 2k4h h VAL 63 N 0.00 1.42 0.00 0.00 2.07 -1.34 -3.28 116.25 115.12 2k4h h VAL 63 Ca -0.00 -2.88 -0.02 0.00 0.82 0.00 0.00 66.70 64.62 2k4h h VAL 63 Cb 0.32 2.92 -0.00 0.00 -1.52 0.00 0.00 31.29 33.01 2k4h h VAL 63 CO 0.02 0.85 -0.18 -0.07 0.02 0.00 0.00 177.57 178.21 2k4h h LEU 64 N 0.12 0.00 0.06 2.57 3.38 -0.72 -3.28 115.31 117.44 2k4h h LEU 64 Ca -0.17 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.81 2k4h h LEU 64 Cb 2.00 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.71 2k4h h LEU 64 CO 0.22 0.12 -0.44 0.44 0.09 0.00 0.00 178.44 178.87 2k4h h ASP 65 N 0.00 -1.35 0.92 -0.43 5.19 -0.50 0.10 116.42 120.36 2k4h h ASP 65 Ca -0.00 0.15 0.00 0.00 -0.62 0.00 0.00 57.03 56.55 2k4h h ASP 65 Cb 1.09 0.50 0.00 0.00 0.18 0.00 0.00 39.33 41.10 2k4h h ASP 65 CO 0.01 -0.45 0.00 1.55 -3.12 0.00 0.00 179.24 177.23 2k4h h PRO 66 N -0.60 0.00 0.00 3.56 0.13 -1.72 -2.66 132.00 130.71 2k4h h PRO 66 Ca 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.04 2k4h h PRO 66 Cb 0.62 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.74 2k4h h PRO 66 CO -0.26 0.00 -0.43 0.52 -0.23 0.00 0.00 178.00 177.59 2k4h h MET 67 N 0.00 0.00 0.31 0.86 2.86 -1.36 -3.33 114.93 114.28 2k4h h MET 67 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2k4h h MET 67 Cb 0.46 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.09 2k4h h MET 67 CO 0.00 0.43 -0.41 0.28 1.06 0.00 0.00 176.91 178.27 2k4h h VAL 68 N 0.00 0.17 0.00 -2.22 2.07 -0.46 0.22 116.25 116.03 2k4h h VAL 68 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2k4h h VAL 68 Cb 1.28 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 2k4h h VAL 68 CO 0.06 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.84 2k4h n PRO 69 N -5.49 0.49 -1.60 1.57 -0.04 -1.25 -2.45 135.00 126.23 2k4h n PRO 69 Ca -0.09 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.39 2k4h n PRO 69 Cb 0.39 -1.45 0.05 0.00 -0.04 0.00 0.00 33.50 32.46 2k4h n PRO 69 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2k4h n THR 70 N -0.95 0.61 -4.22 0.52 -2.24 -0.36 -5.09 114.28 102.54 2k4h n THR 70 Ca 0.11 -1.74 -0.18 0.00 -2.27 0.00 0.00 64.05 59.97 2k4h n THR 70 Cb 0.05 0.80 -0.07 0.00 -2.10 0.00 0.00 70.33 69.01 2k4h n THR 70 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2k4h s GLY 71 N -2.52 2.06 0.00 3.38 0.00 0.64 -4.93 107.32 105.95 2k4h s GLY 71 Ca 0.34 -1.90 0.00 0.00 0.00 0.00 0.00 44.72 43.16 2k4h s GLY 71 CO -0.13 -1.33 0.00 -1.14 0.00 0.00 0.00 173.10 170.50 2k4h n SER 72 N -1.48 1.60 -0.16 1.64 3.41 -1.26 -4.90 113.62 112.47 2k4h n SER 72 Ca 0.05 -0.91 -0.02 0.00 -0.26 0.00 0.00 58.87 57.73 2k4h n SER 72 Cb 0.62 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.63 2k4h n SER 72 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2k4h h GLU 73 N 0.00 0.08 -0.50 4.33 3.07 -1.98 0.34 114.58 119.91 2k4h h GLU 73 Ca 0.00 -0.00 0.15 0.00 -0.50 0.00 0.00 59.36 59.00 2k4h h GLU 73 Cb 0.00 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 27.87 2k4h h GLU 73 CO 0.00 0.05 0.43 -0.91 -1.40 0.00 0.00 179.01 177.18 2k4h h ASN 74 N 0.08 0.00 0.01 1.42 4.21 -2.00 0.22 115.58 119.52 2k4h h ASN 74 Ca 0.26 0.00 -0.17 0.00 1.21 0.00 0.00 56.30 57.59 2k4h h ASN 74 Cb 0.39 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.57 2k4h h ASN 74 CO -0.45 0.00 -0.94 0.25 -1.29 0.00 0.00 177.43 175.00 2k4h h LEU 75 N 0.00 0.02 -1.50 1.61 6.46 -0.88 -3.36 115.31 117.66 2k4h h LEU 75 Ca 0.24 -0.65 0.07 0.00 -0.12 0.00 0.00 57.88 57.41 2k4h h LEU 75 Cb 1.09 -0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 40.98 2k4h h LEU 75 CO -0.00 1.37 0.42 0.11 -0.62 0.00 0.00 178.44 179.72 2k4h h LYS 76 N -0.97 0.59 -0.76 1.25 1.57 0.05 -1.75 116.57 116.56 2k4h h LYS 76 Ca -0.26 -0.04 0.10 0.00 -1.87 0.00 0.00 60.65 58.58 2k4h h LYS 76 Cb 1.25 -0.13 -0.07 0.00 0.08 0.00 0.00 32.23 33.35 2k4h h LYS 76 CO -0.14 0.39 0.41 0.77 -0.57 0.00 0.00 179.45 180.30 2k4h h SER 77 N 0.61 0.55 -0.19 0.86 0.02 -0.74 -1.93 113.55 112.73 2k4h h SER 77 Ca 0.27 0.06 -0.06 0.00 -0.84 0.00 0.00 61.79 61.22 2k4h h SER 77 Cb 0.30 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.79 2k4h h SER 77 CO -0.08 0.31 -0.11 0.25 -1.14 0.00 0.00 176.83 176.06 2k4h h LEU 78 N 0.68 0.43 -0.76 5.07 5.85 -1.47 -2.29 115.31 122.81 2k4h h LEU 78 Ca 0.37 -0.42 0.16 0.00 0.84 0.00 0.00 57.88 58.83 2k4h h LEU 78 Cb 0.38 -0.12 -0.11 0.00 0.37 0.00 0.00 40.66 41.18 2k4h h LEU 78 CO -0.26 0.76 0.25 0.15 -0.34 0.00 0.00 178.44 178.99 2k4h h PHE 79 N 0.10 0.41 -0.34 1.25 3.57 -1.08 0.37 116.94 121.21 2k4h h PHE 79 Ca 0.04 0.04 -0.15 0.00 3.53 0.00 0.00 57.97 61.43 2k4h h PHE 79 Cb 0.60 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 2k4h h PHE 79 CO 0.07 -0.03 -0.39 -0.91 -2.23 0.00 0.00 178.31 174.82 2k4h h ASN 80 N 0.35 0.89 -0.65 0.41 4.21 -1.33 -3.04 115.58 116.42 2k4h h ASN 80 Ca 0.43 -0.41 -0.08 0.00 1.21 0.00 0.00 56.30 57.46 2k4h h ASN 80 Cb 0.73 -0.25 -0.03 0.00 -1.12 0.00 0.00 38.32 37.65 2k4h h ASN 80 CO -0.47 1.17 0.09 0.74 -1.29 0.00 0.00 177.43 177.67 2k4h h THR 81 N 0.68 1.26 0.00 2.81 2.02 -0.39 -2.53 112.91 116.77 2k4h h THR 81 Ca 0.06 -1.05 -0.02 0.00 0.77 0.00 0.00 66.41 66.17 2k4h h THR 81 Cb 0.96 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 68.04 2k4h h THR 81 CO 0.09 0.39 -0.07 0.58 0.37 0.00 0.00 175.52 176.88 2k4h h VAL 82 N 1.01 0.91 -0.09 3.16 2.07 -0.32 -1.45 116.25 121.55 2k4h h VAL 82 Ca 0.20 -0.26 -0.09 0.00 0.82 0.00 0.00 66.70 67.36 2k4h h VAL 82 Cb 0.46 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 2k4h h VAL 82 CO 0.02 0.07 -0.37 0.00 0.02 0.00 0.00 177.57 177.30 2k4h h VAL 84 N 0.15 1.58 0.69 0.00 2.07 -1.26 -3.11 116.25 116.38 2k4h h VAL 84 Ca 0.02 -2.18 -0.03 0.00 0.82 0.00 0.00 66.70 65.32 2k4h h VAL 84 Cb 0.74 2.99 -0.00 0.00 -1.52 0.00 0.00 31.29 33.49 2k4h h VAL 84 CO 0.06 0.60 -0.41 0.40 0.02 0.00 0.00 177.57 178.24 2k4h h ILE 85 N -0.53 0.17 -0.75 4.57 1.08 -1.41 -2.64 117.51 118.01 2k4h h ILE 85 Ca -0.06 0.00 0.17 0.00 -0.39 0.00 0.00 64.86 64.58 2k4h h ILE 85 Cb 1.19 0.17 -0.12 0.00 -3.07 0.00 0.00 36.82 34.99 2k4h h ILE 85 CO 0.07 0.00 0.13 -0.25 -0.69 0.00 0.00 178.15 177.41 2k4h h TRP 86 N -1.03 0.18 -0.51 1.37 7.01 -1.52 0.03 115.95 121.47 2k4h h TRP 86 Ca -0.09 0.05 0.10 0.00 2.11 0.00 0.00 58.89 61.06 2k4h h TRP 86 Cb 0.83 0.04 -0.08 0.00 -2.10 0.00 0.00 29.16 27.84 2k4h h TRP 86 CO -0.09 -0.15 0.03 0.00 -2.79 0.00 0.00 178.44 175.44 2k4h h ILE 88 N 0.15 0.76 0.00 0.00 2.04 -0.63 0.34 117.51 120.17 2k4h h ILE 88 Ca 0.26 -0.23 -0.20 0.00 1.00 0.00 0.00 64.86 65.69 2k4h h ILE 88 Cb 0.39 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 2k4h h ILE 88 CO -0.41 0.12 -0.88 0.45 0.00 0.00 0.00 178.15 177.44 2k4h h HIS 89 N 0.67 0.31 -0.25 1.37 3.86 -0.80 -3.09 115.15 117.23 2k4h h HIS 89 Ca 0.50 -0.17 0.00 0.00 -1.16 0.00 0.00 60.37 59.54 2k4h h HIS 89 Cb 0.87 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.31 2k4h h HIS 89 CO -0.00 0.98 0.00 0.00 0.86 0.00 0.00 177.93 179.77 2k4h n ALA 90 N -2.47 2.46 -2.99 2.45 0.00 -0.08 -4.77 120.51 115.12 2k4h n ALA 90 Ca -0.04 -0.45 -0.12 0.00 0.00 0.00 0.00 53.44 52.83 2k4h n ALA 90 Cb 0.81 -0.98 0.06 0.00 0.00 0.00 0.00 19.45 19.33 2k4h n ALA 90 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2k4h n GLU 91 N 0.25 -3.40 -4.62 0.00 2.13 -0.49 -5.03 120.64 109.48 2k4h n GLU 91 Ca 0.09 0.67 -0.29 0.00 0.66 0.00 0.00 57.16 58.29 2k4h n GLU 91 Cb 0.22 -5.01 -0.17 0.00 0.27 0.00 0.00 31.44 26.75 2k4h n GLU 91 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2k4h s GLU 92 N -4.55 2.41 -0.20 5.31 0.41 -0.14 -5.02 118.70 116.92 2k4h s GLU 92 Ca 0.19 -0.64 -0.09 0.00 -0.41 0.00 0.00 54.97 54.02 2k4h s GLU 92 Cb -0.02 -1.98 -0.05 0.00 -1.78 0.00 0.00 34.13 30.30 2k4h s GLU 92 CO 0.57 -0.01 0.11 -1.59 -0.49 0.00 0.00 175.26 173.85 2k4h s LYS 93 N 0.83 4.05 -0.06 1.61 -2.85 -1.26 -4.16 119.74 117.90 2k4h s LYS 93 Ca -0.09 -0.29 0.03 0.00 -1.00 0.00 0.00 55.97 54.61 2k4h s LYS 93 Cb -0.16 -3.36 0.01 0.00 -2.06 0.00 0.00 37.83 32.26 2k4h s LYS 93 CO 0.01 0.22 -0.14 0.14 0.10 0.00 0.00 175.35 175.67 2k4h s VAL 94 N 0.57 1.27 0.05 1.79 -7.23 -1.26 -5.03 120.40 110.55 2k4h s VAL 94 Ca 0.06 -0.58 -0.25 0.00 -1.81 0.00 0.00 61.98 59.40 2k4h s VAL 94 Cb -0.12 -1.13 -0.17 0.00 0.56 0.00 0.00 36.38 35.52 2k4h s VAL 94 CO 0.01 0.38 1.55 0.11 -0.31 0.00 0.00 175.10 176.83 2k4h h LYS 95 N 6.75 -0.19 -4.80 4.82 1.79 -1.95 -3.39 116.57 119.59 2k4h h LYS 95 Ca -0.30 0.01 -0.29 0.00 -2.18 0.00 0.00 60.65 57.89 2k4h h LYS 95 Cb 1.19 0.04 -0.19 0.00 -1.58 0.00 0.00 32.23 31.69 2k4h h LYS 95 CO 0.48 -0.00 -0.73 0.16 -1.08 0.00 0.00 179.45 178.27 2k4h s ASP 96 N -5.15 1.21 0.22 0.86 1.47 -1.26 -0.87 116.67 113.14 2k4h s ASP 96 Ca -0.14 -0.74 -0.14 0.00 1.18 0.00 0.00 52.55 52.71 2k4h s ASP 96 Cb 0.04 0.03 0.25 0.00 -0.34 0.00 0.00 42.92 42.90 2k4h s ASP 96 CO 0.64 -0.26 1.62 0.74 0.68 0.00 0.00 175.17 178.58 2k4h h THR 97 N 3.85 0.31 -1.01 2.11 2.02 -0.96 0.63 112.91 119.86 2k4h h THR 97 Ca -0.37 0.00 0.29 0.00 0.77 0.00 0.00 66.41 67.10 2k4h h THR 97 Cb 1.19 0.31 -0.04 0.00 -1.74 0.00 0.00 68.15 67.87 2k4h h THR 97 CO 0.49 0.00 0.72 -0.33 0.37 0.00 0.00 175.52 176.78 2k4h h GLU 98 N -0.02 0.00 0.08 6.66 4.39 -1.85 0.30 114.58 124.15 2k4h h GLU 98 Ca 0.32 -0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.77 2k4h h GLU 98 Cb 0.50 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 2k4h h GLU 98 CO -0.70 0.00 -1.14 0.78 -1.16 0.00 0.00 179.01 176.79 2k4h h GLY 99 N 0.00 0.21 1.51 -3.84 0.00 -0.15 -3.28 103.07 97.52 2k4h h GLY 99 Ca 0.48 -0.52 -0.11 0.00 0.00 0.00 0.00 47.33 47.17 2k4h h GLY 99 CO -0.01 0.46 -0.32 0.00 0.00 0.00 0.00 176.54 176.67 2k4h h ALA 100 N 0.74 0.96 0.00 3.60 0.00 0.12 -2.55 119.26 122.13 2k4h h ALA 100 Ca -0.09 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 2k4h h ALA 100 Cb 1.88 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.55 2k4h h ALA 100 CO 0.18 0.61 -0.09 -0.22 0.00 0.00 0.00 179.25 179.72 2k4h h LYS 101 N 0.47 0.00 0.07 0.00 3.64 -1.42 -1.32 116.57 118.02 2k4h h LYS 101 Ca 0.06 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.16 2k4h h LYS 101 Cb 0.79 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.59 2k4h h LYS 101 CO 0.06 0.09 -1.41 0.37 -2.27 0.00 0.00 179.45 176.30 2k4h h GLN 102 N 0.00 0.16 -0.01 1.90 5.75 -1.52 -2.86 115.11 118.52 2k4h h GLN 102 Ca -0.00 -0.27 -0.03 0.00 -0.15 0.00 0.00 58.65 58.20 2k4h h GLN 102 Cb 0.39 0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.05 2k4h h GLN 102 CO 0.01 1.01 -0.09 0.82 -2.65 0.00 0.00 178.83 177.93 2k4h h ILE 103 N 0.04 1.55 -0.17 2.39 2.04 -1.14 -2.97 117.51 119.24 2k4h h ILE 103 Ca -0.19 -1.74 -0.01 0.00 1.00 0.00 0.00 64.86 63.93 2k4h h ILE 103 Cb 1.95 2.67 -0.01 0.00 -0.74 0.00 0.00 36.82 40.70 2k4h h ILE 103 CO 0.15 0.46 0.07 0.58 0.00 0.00 0.00 178.15 179.41 2k4h h VAL 104 N -0.60 1.15 -0.57 1.67 2.07 -1.41 -0.33 116.25 118.23 2k4h h VAL 104 Ca -0.01 -0.45 0.11 0.00 0.82 0.00 0.00 66.70 67.17 2k4h h VAL 104 Cb 0.81 1.13 -0.08 0.00 -1.52 0.00 0.00 31.29 31.63 2k4h h VAL 104 CO 0.02 0.14 0.10 -0.09 0.02 0.00 0.00 177.57 177.76 2k4h h ARG 105 N 0.13 0.23 -0.38 1.57 2.43 -1.62 -0.09 114.38 116.65 2k4h h ARG 105 Ca 0.06 -0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 59.08 2k4h h ARG 105 Cb 0.16 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 2k4h h ARG 105 CO -0.01 0.15 -0.30 0.00 -1.51 0.00 0.00 179.97 178.30 2k4h h ARG 106 N 0.23 0.83 0.00 0.20 3.08 -1.37 -2.88 114.38 114.47 2k4h h ARG 106 Ca 0.29 -0.38 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 2k4h h ARG 106 Cb 0.43 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2k4h h ARG 106 CO -0.39 1.02 -0.17 0.45 -1.07 0.00 0.00 179.97 179.80 2k4h h HIS 107 N 0.70 0.00 0.06 3.04 3.86 0.21 -2.44 115.15 120.58 2k4h h HIS 107 Ca 0.08 0.00 -0.25 0.00 -1.16 0.00 0.00 60.37 59.04 2k4h h HIS 107 Cb 0.85 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.34 2k4h h HIS 107 CO 0.05 0.17 -1.02 -0.07 0.86 0.00 0.00 177.93 177.92 2k4h h LEU 108 N 0.00 0.80 -1.55 2.43 3.38 -0.87 -3.25 115.31 116.26 2k4h h LEU 108 Ca -0.00 -0.79 -0.02 0.00 0.09 0.00 0.00 57.88 57.15 2k4h h LEU 108 Cb 0.33 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2k4h h LEU 108 CO 0.02 1.50 0.06 0.58 0.09 0.00 0.00 178.44 180.69 2k4h h VAL 109 N 0.19 1.12 0.00 1.22 2.07 -1.30 -0.38 116.25 119.18 2k4h h VAL 109 Ca -0.14 -0.44 -0.06 0.00 0.82 0.00 0.00 66.70 66.88 2k4h h VAL 109 Cb 1.71 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 32.34 2k4h h VAL 109 CO 0.20 0.16 -0.30 0.00 0.02 0.00 0.00 177.57 177.65 2k4h h ALA 110 N 1.72 1.39 0.00 1.67 0.00 -1.48 -2.80 119.26 119.76 2k4h h ALA 110 Ca 0.09 -0.27 -0.21 0.00 0.00 0.00 0.00 54.91 54.51 2k4h h ALA 110 Cb 0.15 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2k4h h ALA 110 CO -0.00 0.37 -1.45 0.93 0.00 0.00 0.00 179.25 179.10 2k4h h GLU 111 N 0.00 0.00 -0.30 0.00 5.08 -1.33 -3.34 114.58 114.69 2k4h h GLU 111 Ca -0.00 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.44 2k4h h GLU 111 Cb 0.57 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 2k4h h GLU 111 CO 0.04 0.40 0.29 1.15 -1.00 0.00 0.00 179.01 179.89 2k4h h THR 112 N 0.00 0.51 -0.57 1.13 2.02 -0.83 0.19 112.91 115.37 2k4h h THR 112 Ca -0.19 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 66.85 2k4h h THR 112 Cb 1.74 0.77 -0.08 0.00 -1.74 0.00 0.00 68.15 68.84 2k4h h THR 112 CO 0.06 0.00 0.18 0.61 0.37 0.00 0.00 175.52 176.74 2k4h n GLY 113 N -1.47 3.11 1.93 2.16 0.00 -1.23 -4.22 105.19 105.47 2k4h n GLY 113 Ca 0.04 -0.77 -0.01 0.00 0.00 0.00 0.00 46.02 45.28 2k4h n GLY 113 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2k4h n THR 114 N 0.06 0.00 -2.74 2.61 5.66 0.60 -5.00 114.28 115.47 2k4h n THR 114 Ca 0.30 -0.45 -0.04 0.00 -3.05 0.00 0.00 64.05 60.81 2k4h n THR 114 Cb 1.14 0.69 0.06 0.00 -1.55 0.00 0.00 70.33 70.68 2k4h n THR 114 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2k4h n ALA 115 N -0.70 2.77 -2.45 1.79 0.00 -0.74 -4.88 120.51 116.30 2k4h n ALA 115 Ca -0.10 -2.49 -0.03 0.00 0.00 0.00 0.00 53.44 50.82 2k4h n ALA 115 Cb 0.67 -0.91 0.06 0.00 0.00 0.00 0.00 19.45 19.27 2k4h n ALA 115 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2k4h n GLU 116 N -0.53 0.89 0.11 0.00 0.00 -1.26 -4.99 120.64 114.85 2k4h n GLU 116 Ca 0.03 -1.28 -0.09 0.00 0.00 0.00 0.00 57.16 55.82 2k4h n GLU 116 Cb 0.82 0.34 -0.06 0.00 0.00 0.00 0.00 31.44 32.54 2k4h n GLU 116 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 2k4h h LYS 117 N 0.74 -0.34 -6.65 5.31 1.63 -2.00 -3.46 116.57 111.81 2k4h h LYS 117 Ca -0.47 0.02 -0.69 0.00 -0.85 0.00 0.00 60.65 58.67 2k4h h LYS 117 Cb 1.35 0.08 -0.22 0.00 -0.60 0.00 0.00 32.23 32.84 2k4h h LYS 117 CO -0.20 -0.05 -0.82 -1.64 -3.45 0.00 0.00 179.45 173.29 2k4h s MET 118 N -3.32 1.93 0.80 1.90 -1.94 -1.26 -5.14 119.30 112.27 2k4h s MET 118 Ca -0.10 -1.06 -0.13 0.00 -1.71 0.00 0.00 55.69 52.69 2k4h s MET 118 Cb 0.01 -2.12 0.20 0.00 2.01 0.00 0.00 34.83 34.93 2k4h s MET 118 CO 0.35 0.52 0.71 -0.35 -0.01 0.00 0.00 175.02 176.24 2k4h n PRO 119 N 1.46 -2.40 -3.35 2.03 -0.04 -1.26 -5.10 135.00 126.34 2k4h n PRO 119 Ca -0.16 -1.13 0.02 0.00 -0.04 0.00 0.00 63.50 62.19 2k4h n PRO 119 Cb 0.52 -1.06 -0.03 0.00 -0.04 0.00 0.00 33.50 32.89 2k4h n PRO 119 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2k4h s SER 120 N -3.42 -0.65 -0.25 3.54 0.01 -1.26 -5.17 113.70 106.50 2k4h s SER 120 Ca 0.46 0.76 -0.30 0.00 1.31 0.00 0.00 55.95 58.18 2k4h s SER 120 Cb -0.05 1.69 0.17 0.00 0.21 0.00 0.00 66.02 68.04 2k4h s SER 120 CO 0.35 -0.12 1.26 0.28 0.41 0.00 0.00 173.24 175.42 2k4h s THR 121 N 2.59 0.00 -0.30 1.44 -1.32 -1.26 -5.16 115.64 111.63 2k4h s THR 121 Ca -0.01 0.00 -0.17 0.00 -1.21 0.00 0.00 61.69 60.31 2k4h s THR 121 Cb -0.08 -1.00 0.18 0.00 -1.51 0.00 0.00 72.50 70.09 2k4h s THR 121 CO -0.17 0.00 1.16 -0.55 -2.21 0.00 0.00 174.62 172.86 2k4h s SER 122 N -1.09 -0.25 -0.35 8.08 0.15 -1.26 -5.09 113.70 113.89 2k4h s SER 122 Ca 0.06 0.24 0.04 0.00 0.70 0.00 0.00 55.95 56.99 2k4h s SER 122 Cb -0.01 1.24 0.32 0.00 -1.71 0.00 0.00 66.02 65.86 2k4h s SER 122 CO -0.05 -0.05 1.33 -1.14 1.20 0.00 0.00 173.24 174.53 2k4h n ARG 123 N 5.11 0.28 -1.14 5.44 3.00 -1.26 -5.17 116.66 122.92 2k4h n ARG 123 Ca -0.08 -0.90 -0.29 0.00 -0.00 0.00 0.00 57.85 56.59 2k4h n ARG 123 Cb 0.54 -0.32 0.19 0.00 0.00 0.00 0.00 32.46 32.88 2k4h n ARG 123 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2k4h s PRO 124 N 0.10 0.04 0.12 -0.14 0.04 -1.26 -5.08 135.00 128.81 2k4h s PRO 124 Ca 0.22 0.39 0.09 0.00 0.04 0.00 0.00 61.00 61.73 2k4h s PRO 124 Cb 0.28 -1.70 -0.04 0.00 0.04 0.00 0.00 34.50 33.08 2k4h s PRO 124 CO -0.17 -2.97 -0.22 0.95 0.04 0.00 0.00 177.00 174.63 2k4h s THR 125 N -2.97 1.88 0.51 1.26 -4.23 -1.26 -5.14 115.64 105.68 2k4h s THR 125 Ca 0.66 -1.64 -0.10 0.00 -1.18 0.00 0.00 61.69 59.43 2k4h s THR 125 Cb -0.17 -1.71 -0.05 0.00 1.34 0.00 0.00 72.50 71.91 2k4h s THR 125 CO 0.57 -0.05 0.88 0.00 -0.54 0.00 0.00 174.62 175.49 2k4h s ALA 126 N -1.22 3.25 0.30 3.99 0.00 -1.26 -5.04 121.76 121.78 2k4h s ALA 126 Ca 0.09 -0.20 -0.29 0.00 0.00 0.00 0.00 51.96 51.56 2k4h s ALA 126 Cb -0.10 -2.84 -0.10 0.00 0.00 0.00 0.00 23.12 20.09 2k4h s ALA 126 CO 0.05 -0.34 1.23 -1.25 0.00 0.00 0.00 175.76 175.45 2k4h s PRO 127 N -4.52 4.46 0.24 0.00 0.04 -1.26 -5.04 135.00 128.92 2k4h s PRO 127 Ca 0.52 2.05 -0.02 0.00 0.04 0.00 0.00 61.00 63.59 2k4h s PRO 127 Cb -0.10 -3.12 -0.03 0.00 0.04 0.00 0.00 34.50 31.28 2k4h s PRO 127 CO 0.42 -0.05 0.25 -1.54 0.04 0.00 0.00 177.00 176.12 2k4h s SER 128 N -0.57 0.36 -0.12 6.66 1.04 -1.26 -5.06 113.70 114.76 2k4h s SER 128 Ca 0.48 -1.35 -0.08 0.00 0.48 0.00 0.00 55.95 55.47 2k4h s SER 128 Cb -0.37 0.47 0.03 0.00 0.10 0.00 0.00 66.02 66.25 2k4h s SER 128 CO 0.48 -0.97 0.17 -0.24 0.98 0.00 0.00 173.24 173.65 2k4h n SER 129 N -0.55 -2.49 -3.14 7.02 2.88 -1.26 -5.09 113.62 110.99 2k4h n SER 129 Ca 0.02 1.27 -0.16 0.00 -1.33 0.00 0.00 58.87 58.67 2k4h n SER 129 Cb 0.64 -4.66 -0.04 0.00 -0.75 0.00 0.00 64.21 59.40 2k4h n SER 129 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2k4h s GLU 130 N -0.75 1.96 0.89 -1.46 2.02 -1.26 -5.17 118.70 114.94 2k4h s GLU 130 Ca -0.19 -1.85 -0.12 0.00 0.02 0.00 0.00 54.97 52.83 2k4h s GLU 130 Cb 0.01 0.43 0.13 0.00 0.10 0.00 0.00 34.13 34.80 2k4h s GLU 130 CO 0.51 -0.80 1.10 -1.59 0.02 0.00 0.00 175.26 174.50 2k4h s LYS 131 N -2.97 1.29 0.36 1.61 -2.85 -1.26 -5.08 119.74 110.84 2k4h s LYS 131 Ca 0.32 0.63 0.04 0.00 -1.00 0.00 0.00 55.97 55.96 2k4h s LYS 131 Cb -0.00 -1.83 -0.03 0.00 -2.06 0.00 0.00 37.83 33.90 2k4h s LYS 131 CO 0.23 -2.17 0.13 0.20 0.10 0.00 0.00 175.35 173.84 2k4h s GLY 132 N -3.65 2.32 -0.23 0.59 0.00 -1.26 -5.15 107.32 99.95 2k4h s GLY 132 Ca 0.63 -1.58 -0.05 0.00 0.00 0.00 0.00 44.72 43.73 2k4h s GLY 132 CO 0.56 -1.73 0.41 -0.32 0.00 0.00 0.00 173.10 172.02 2k4h s GLY 133 N -3.50 -0.42 -0.13 0.20 0.00 -1.26 -5.05 107.32 97.16 2k4h s GLY 133 Ca 0.31 1.22 -0.14 0.00 0.00 0.00 0.00 44.72 46.11 2k4h s GLY 133 CO 0.16 2.58 -0.27 -2.01 0.00 0.00 0.00 173.10 173.57 2k4h n ASN 134 N 5.38 1.53 0.00 1.64 4.05 -1.26 -5.36 115.26 121.24 2k4h n ASN 134 Ca -0.06 0.26 0.00 0.00 0.45 0.00 0.00 54.58 55.23 2k4h n ASN 134 Cb 0.50 -0.67 0.00 0.00 1.23 0.00 0.00 39.78 40.84 2k4h n ASN 134 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 177.26 172.99