#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4h s ALA 3 N 0.00 -2.03 0.18 4.61 0.00 -1.26 -5.15 121.76 118.11 2k4h s ALA 3 Ca 0.00 2.33 0.00 0.00 0.00 0.00 0.00 51.96 54.29 2k4h s ALA 3 Cb 0.00 -1.53 0.00 0.00 0.00 0.00 0.00 23.12 21.59 2k4h s ALA 3 CO 0.00 -0.36 0.00 -2.13 0.00 0.00 0.00 175.76 173.27 2k4h n ARG 4 N 4.01 -1.53 0.26 0.00 0.63 -1.26 -4.42 116.66 114.36 2k4h n ARG 4 Ca -0.19 1.00 -0.14 0.00 -0.92 0.00 0.00 57.85 57.61 2k4h n ARG 4 Cb 0.58 -1.86 -0.07 0.00 0.45 0.00 0.00 32.46 31.56 2k4h n ARG 4 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 2k4h h ASN 5 N -0.70 -0.58 -2.36 6.15 2.35 -2.01 -3.45 115.58 114.98 2k4h h ASN 5 Ca 0.02 -0.06 -0.52 0.00 -0.55 0.00 0.00 56.30 55.18 2k4h h ASN 5 Cb 0.69 0.15 -0.05 0.00 0.05 0.00 0.00 38.32 39.16 2k4h h ASN 5 CO 0.01 -0.21 -0.53 -0.44 -1.65 0.00 0.00 177.43 174.60 2k4h s SER 6 N -4.76 5.57 -0.03 5.81 0.01 -1.26 -5.02 113.70 114.01 2k4h s SER 6 Ca -0.14 -0.19 -0.22 0.00 1.31 0.00 0.00 55.95 56.71 2k4h s SER 6 Cb 0.02 -1.44 -0.25 0.00 0.21 0.00 0.00 66.02 64.56 2k4h s SER 6 CO 0.46 -0.00 1.03 0.58 0.41 0.00 0.00 173.24 175.72 2k4h h VAL 7 N 1.65 1.50 -3.80 3.43 2.07 -1.88 -3.46 116.25 115.77 2k4h h VAL 7 Ca -0.48 -2.10 -0.43 0.00 0.82 0.00 0.00 66.70 64.51 2k4h h VAL 7 Cb 1.23 2.78 0.18 0.00 -1.52 0.00 0.00 31.29 33.95 2k4h h VAL 7 CO 0.62 0.59 0.31 -0.76 0.02 0.00 0.00 177.57 178.35 2k4h s LEU 8 N -8.34 1.91 1.21 2.57 1.43 -1.26 -5.03 118.68 111.17 2k4h s LEU 8 Ca -0.15 0.38 -0.13 0.00 -1.03 0.00 0.00 54.13 53.20 2k4h s LEU 8 Cb 0.02 -2.28 0.31 0.00 0.03 0.00 0.00 46.19 44.27 2k4h s LEU 8 CO 0.79 -3.33 1.01 -0.13 0.23 0.00 0.00 176.35 174.92 2k4h s ARG 9 N -5.72 -1.32 0.00 1.70 0.52 -1.26 -4.71 118.95 108.16 2k4h s ARG 9 Ca 0.73 0.80 -0.25 0.00 -0.52 0.00 0.00 55.73 56.50 2k4h s ARG 9 Cb -0.06 -1.51 -0.17 0.00 0.52 0.00 0.00 34.95 33.74 2k4h s ARG 9 CO 0.54 -3.98 1.25 0.78 0.02 0.00 0.00 175.30 173.90 2k4h h GLY 10 N -2.81 -0.32 0.63 -3.53 0.00 -1.95 0.19 103.07 95.28 2k4h h GLY 10 Ca -0.63 0.12 0.03 0.00 0.00 0.00 0.00 47.33 46.85 2k4h h GLY 10 CO 0.49 -0.12 -0.07 0.50 0.00 0.00 0.00 176.54 177.35 2k4h h LYS 11 N -0.68 -0.05 -0.57 4.80 6.56 -2.02 -2.04 116.57 122.59 2k4h h LYS 11 Ca -0.03 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.52 2k4h h LYS 11 Cb 0.47 0.01 -0.03 0.00 -0.57 0.00 0.00 32.23 32.12 2k4h h LYS 11 CO 0.05 -0.03 0.20 0.87 -2.06 0.00 0.00 179.45 178.48 2k4h h LYS 12 N -0.05 0.84 -0.55 3.15 6.56 -1.93 -2.23 116.57 122.35 2k4h h LYS 12 Ca 0.08 -0.14 0.11 0.00 -1.06 0.00 0.00 60.65 59.64 2k4h h LYS 12 Cb 0.17 -0.14 -0.03 0.00 -0.57 0.00 0.00 32.23 31.66 2k4h h LYS 12 CO -0.18 0.71 0.38 0.00 -2.06 0.00 0.00 179.45 178.30 2k4h h ALA 13 N 1.40 2.15 0.68 3.86 0.00 -0.23 -2.37 119.26 124.74 2k4h h ALA 13 Ca 0.19 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2k4h h ALA 13 Cb 0.20 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.96 2k4h h ALA 13 CO -0.01 -0.28 -0.33 0.22 0.00 0.00 0.00 179.25 178.85 2k4h h ASP 14 N 0.28 -0.77 -0.81 0.00 3.58 -1.04 0.93 116.42 118.59 2k4h h ASP 14 Ca 0.26 0.03 0.22 0.00 0.42 0.00 0.00 57.03 57.96 2k4h h ASP 14 Cb 0.65 0.20 -0.04 0.00 1.72 0.00 0.00 39.33 41.86 2k4h h ASP 14 CO -0.06 -0.54 0.57 -0.33 -2.88 0.00 0.00 179.24 176.00 2k4h h GLU 15 N -0.93 0.09 -0.02 0.28 3.07 -1.57 0.16 114.58 115.66 2k4h h GLU 15 Ca -0.09 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.75 2k4h h GLU 15 Cb 0.70 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.59 2k4h h GLU 15 CO 0.15 0.06 -0.04 1.25 -1.40 0.00 0.00 179.01 179.03 2k4h h LEU 16 N 0.09 0.07 0.00 1.33 7.12 -1.13 -2.66 115.31 120.14 2k4h h LEU 16 Ca 0.39 -0.59 0.00 0.00 0.13 0.00 0.00 57.88 57.82 2k4h h LEU 16 Cb 1.42 -0.02 0.00 0.00 -0.53 0.00 0.00 40.66 41.53 2k4h h LEU 16 CO -0.04 0.64 0.00 1.21 -0.13 0.00 0.00 178.44 180.12 2k4h n GLU 17 N -4.75 0.05 0.06 1.25 2.13 0.29 -2.83 120.64 116.84 2k4h n GLU 17 Ca -0.09 0.17 -0.21 0.00 0.66 0.00 0.00 57.16 57.70 2k4h n GLU 17 Cb 0.32 -1.50 -0.15 0.00 0.27 0.00 0.00 31.44 30.39 2k4h n GLU 17 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2k4h h ARG 18 N 0.00 0.34 -6.30 5.31 3.08 -0.65 -3.40 114.38 112.76 2k4h h ARG 18 Ca 0.00 -0.57 -0.66 0.00 0.07 0.00 0.00 59.98 58.82 2k4h h ARG 18 Cb 0.29 0.21 0.04 0.00 0.08 0.00 0.00 29.97 30.59 2k4h h ARG 18 CO 0.00 1.23 0.80 -0.89 -1.07 0.00 0.00 179.97 180.04 2k4h n ILE 19 N -3.53 0.21 -2.90 2.04 5.41 -1.01 -4.86 119.36 114.72 2k4h n ILE 19 Ca -0.23 -0.04 -0.40 0.00 1.00 0.00 0.00 62.75 63.08 2k4h n ILE 19 Cb 1.07 -1.33 -0.05 0.00 -0.71 0.00 0.00 39.64 38.61 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 2.17 4.56 0.42 0.38 0.52 0.62 -1.82 118.95 125.80 2k4h s ARG 20 Ca 0.88 1.19 0.12 0.00 -0.52 0.00 0.00 55.73 57.41 2k4h s ARG 20 Cb -0.86 -3.37 0.97 0.00 0.52 0.00 0.00 34.95 32.22 2k4h s ARG 20 CO 0.50 0.27 1.99 -0.07 0.02 0.00 0.00 175.30 178.01 2k4h h LEU 21 N 5.60 0.41 -8.60 2.53 3.38 -0.83 0.09 115.31 117.88 2k4h h LEU 21 Ca -0.44 0.01 -0.30 0.00 0.09 0.00 0.00 57.88 57.24 2k4h h LEU 21 Cb 1.21 -0.08 -0.15 0.00 0.09 0.00 0.00 40.66 41.73 2k4h h LEU 21 CO 0.71 0.26 -0.71 -0.13 0.09 0.00 0.00 178.44 178.66 2k4h s ARG 22 N -5.43 1.01 0.28 1.13 0.52 -1.26 -4.04 118.95 111.16 2k4h s ARG 22 Ca -0.08 -1.43 0.06 0.00 -0.52 0.00 0.00 55.73 53.76 2k4h s ARG 22 Cb 0.19 -0.50 0.40 0.00 0.52 0.00 0.00 34.95 35.56 2k4h s ARG 22 CO 0.75 0.04 1.66 -1.00 0.02 0.00 0.00 175.30 176.77 2k4h h PRO 23 N 2.81 0.25 0.00 3.54 0.13 -1.93 -3.33 132.00 133.46 2k4h h PRO 23 Ca -0.36 -0.13 -0.32 0.00 -0.87 0.00 0.00 66.00 64.32 2k4h h PRO 23 Cb 1.19 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.26 2k4h h PRO 23 CO 0.64 0.66 -2.20 0.41 -0.23 0.00 0.00 178.00 177.28 2k4h n GLY 24 N -0.07 -0.48 2.95 1.56 0.00 -1.26 -5.01 105.19 102.88 2k4h n GLY 24 Ca -0.02 -0.19 -0.23 0.00 0.00 0.00 0.00 46.02 45.58 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 2.30 -3.15 0.07 -0.02 0.00 -1.25 -4.97 105.19 98.16 2k4h n GLY 25 Ca -0.34 -1.02 0.03 0.00 0.00 0.00 0.00 46.02 44.68 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 -3.92 1.71 -3.11 1.61 5.02 -1.26 -4.80 118.16 113.40 2k4h n LYS 26 Ca 0.10 -1.57 -0.31 0.00 -2.02 0.00 0.00 58.31 54.52 2k4h n LYS 26 Cb 0.46 -1.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.43 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 -1.23 3.79 0.34 1.97 1.02 -1.26 -4.98 119.74 119.38 2k4h s LYS 27 Ca 0.09 0.36 0.08 0.00 0.02 0.00 0.00 55.97 56.53 2k4h s LYS 27 Cb 0.08 -2.50 -0.06 0.00 -0.52 0.00 0.00 37.83 34.82 2k4h s LYS 27 CO 0.01 0.11 -0.07 0.15 -0.92 0.00 0.00 175.35 174.63 2k4h s LYS 28 N -3.45 1.77 0.47 1.68 1.02 -1.26 -0.18 119.74 119.79 2k4h s LYS 28 Ca 0.49 -1.92 -0.23 0.00 0.02 0.00 0.00 55.97 54.34 2k4h s LYS 28 Cb -0.11 -1.55 -0.07 0.00 -0.52 0.00 0.00 37.83 35.58 2k4h s LYS 28 CO 0.27 0.09 1.18 0.71 -0.92 0.00 0.00 175.35 176.68 2k4h s TYR 29 N -2.73 2.81 0.21 3.18 2.02 -0.76 -4.66 117.35 117.43 2k4h s TYR 29 Ca 0.32 1.52 -0.10 0.00 -0.37 0.00 0.00 57.07 58.44 2k4h s TYR 29 Cb 0.04 -3.42 -0.01 0.00 -0.40 0.00 0.00 41.96 38.17 2k4h s TYR 29 CO 0.16 -1.65 0.37 0.50 -1.57 0.00 0.00 175.55 173.35 2k4h s ARG 30 N -2.73 1.36 0.48 -0.62 3.52 -1.26 -4.54 118.95 115.16 2k4h s ARG 30 Ca 0.65 -1.25 0.26 0.00 -0.13 0.00 0.00 55.73 55.25 2k4h s ARG 30 Cb -0.30 0.42 1.31 0.00 -1.56 0.00 0.00 34.95 34.82 2k4h s ARG 30 CO 0.36 -0.53 1.85 -0.07 -0.81 0.00 0.00 175.30 176.09 2k4h h LEU 31 N 2.39 0.20 -0.52 -0.88 3.38 -1.96 -0.61 115.31 117.32 2k4h h LEU 31 Ca -0.29 0.03 0.10 0.00 0.09 0.00 0.00 57.88 57.81 2k4h h LEU 31 Cb 1.24 -0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.90 2k4h h LEU 31 CO 0.42 0.06 -0.04 0.11 0.09 0.00 0.00 178.44 179.09 2k4h h LYS 32 N 0.19 0.08 0.00 1.13 1.79 -2.00 0.14 116.57 117.90 2k4h h LYS 32 Ca 0.48 -0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.91 2k4h h LYS 32 Cb 1.58 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 32.20 2k4h h LYS 32 CO -0.11 0.05 -0.20 0.45 -1.08 0.00 0.00 179.45 178.56 2k4h h HIS 33 N 0.08 0.00 -0.21 -1.35 3.86 -1.52 -2.66 115.15 113.35 2k4h h HIS 33 Ca 0.26 0.00 -0.20 0.00 -1.16 0.00 0.00 60.37 59.27 2k4h h HIS 33 Cb 0.40 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.88 2k4h h HIS 33 CO -0.36 0.20 -0.66 0.82 0.86 0.00 0.00 177.93 178.80 2k4h h ILE 34 N 0.00 1.29 0.23 2.45 2.04 -0.73 -2.35 117.51 120.43 2k4h h ILE 34 Ca -0.00 -1.86 -0.01 0.00 1.00 0.00 0.00 64.86 63.98 2k4h h ILE 34 Cb 0.45 1.82 0.00 0.00 -0.74 0.00 0.00 36.82 38.35 2k4h h ILE 34 CO 0.03 0.60 -0.11 0.58 0.00 0.00 0.00 178.15 179.24 2k4h h VAL 35 N 0.57 0.84 0.00 1.67 2.07 -1.04 -1.47 116.25 118.90 2k4h h VAL 35 Ca -0.02 -0.52 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 2k4h h VAL 35 Cb 1.27 1.14 -0.00 0.00 -1.52 0.00 0.00 31.29 32.18 2k4h h VAL 35 CO 0.14 0.11 -0.03 -0.25 0.02 0.00 0.00 177.57 177.57 2k4h h TRP 36 N -0.58 0.00 0.21 1.57 7.01 -1.56 -0.48 115.95 122.13 2k4h h TRP 36 Ca -0.03 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 60.96 2k4h h TRP 36 Cb 0.42 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.48 2k4h h TRP 36 CO 0.01 0.03 -0.10 0.00 -2.79 0.00 0.00 178.44 175.58 2k4h h ALA 37 N 1.97 -0.29 -0.71 2.65 0.00 -1.21 -3.06 119.26 118.61 2k4h h ALA 37 Ca -0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 2k4h h ALA 37 Cb 0.05 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2k4h h ALA 37 CO 0.00 -0.38 0.43 0.00 0.00 0.00 0.00 179.25 179.30 2k4h h ALA 38 N -0.34 0.91 -0.90 0.00 0.00 -1.03 -2.48 119.26 115.42 2k4h h ALA 38 Ca -0.03 -0.09 0.16 0.00 0.00 0.00 0.00 54.91 54.95 2k4h h ALA 38 Cb 0.51 -0.29 -0.10 0.00 0.00 0.00 0.00 17.79 17.92 2k4h h ALA 38 CO 0.05 0.39 0.49 -0.97 0.00 0.00 0.00 179.25 179.20 2k4h h ASN 39 N 0.97 0.61 -0.48 0.00 -1.24 -1.17 0.06 115.58 114.33 2k4h h ASN 39 Ca 0.26 0.09 -0.09 0.00 0.71 0.00 0.00 56.30 57.27 2k4h h ASN 39 Cb -0.03 -0.01 -0.02 0.00 0.73 0.00 0.00 38.32 39.00 2k4h h ASN 39 CO -0.05 0.24 -0.05 0.11 -1.29 0.00 0.00 177.43 176.40 2k4h h LYS 40 N 0.67 0.88 -0.32 6.67 1.79 -1.34 -2.80 116.57 122.11 2k4h h LYS 40 Ca 0.50 -0.30 -0.00 0.00 -2.18 0.00 0.00 60.65 58.66 2k4h h LYS 40 Cb 0.73 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.30 2k4h h LYS 40 CO -0.37 0.94 0.18 -0.07 -1.08 0.00 0.00 179.45 179.06 2k4h h LEU 41 N 0.73 0.40 -0.14 2.94 3.38 -0.79 0.26 115.31 122.09 2k4h h LEU 41 Ca 0.13 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.07 2k4h h LEU 41 Cb 0.58 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.18 2k4h h LEU 41 CO 0.03 0.36 -0.17 -0.78 0.09 0.00 0.00 178.44 177.98 2k4h h ASP 42 N 0.41 -0.52 -0.01 -0.43 3.58 -0.97 0.34 116.42 118.82 2k4h h ASP 42 Ca 0.11 0.10 -0.00 0.00 0.42 0.00 0.00 57.03 57.66 2k4h h ASP 42 Cb 0.04 0.25 -0.00 0.00 1.72 0.00 0.00 39.33 41.34 2k4h h ASP 42 CO -0.02 -0.21 -0.00 -0.09 -2.88 0.00 0.00 179.24 176.04 2k4h h ARG 43 N -0.20 0.02 -0.64 0.28 9.65 -1.35 -3.16 114.38 118.99 2k4h h ARG 43 Ca 0.10 -0.01 0.13 0.00 -1.10 0.00 0.00 59.98 59.11 2k4h h ARG 43 Cb 0.35 -0.00 -0.10 0.00 -1.39 0.00 0.00 29.97 28.83 2k4h h ARG 43 CO -0.26 0.34 0.06 0.74 2.80 0.00 0.00 179.97 183.65 2k4h h PHE 44 N -0.30 0.07 0.00 2.20 0.04 -0.25 -3.45 116.94 115.25 2k4h h PHE 44 Ca 0.00 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.82 2k4h h PHE 44 Cb 0.33 0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.55 2k4h h PHE 44 CO 0.04 -0.12 0.00 0.41 -0.60 0.00 0.00 178.31 178.03 2k4h n GLY 45 N -1.35 0.18 3.94 -1.45 0.00 0.18 -5.08 105.19 101.62 2k4h n GLY 45 Ca 0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 2k4h n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k4h s LEU 46 N 0.00 3.40 0.44 0.99 1.43 0.96 -4.96 118.68 120.94 2k4h s LEU 46 Ca 0.00 0.37 0.02 0.00 -1.03 0.00 0.00 54.13 53.49 2k4h s LEU 46 Cb 0.00 -3.22 0.00 0.00 0.03 0.00 0.00 46.19 43.00 2k4h s LEU 46 CO 0.00 -0.95 0.64 0.00 0.23 0.00 0.00 176.35 176.27 2k4h s ALA 47 N -2.77 3.90 -0.16 4.21 0.00 -1.26 -3.01 121.76 122.67 2k4h s ALA 47 Ca 0.52 -1.20 0.22 0.00 0.00 0.00 0.00 51.96 51.51 2k4h s ALA 47 Cb -0.10 -2.02 -0.21 0.00 0.00 0.00 0.00 23.12 20.79 2k4h s ALA 47 CO 0.41 -0.35 0.70 -0.85 0.00 0.00 0.00 175.76 175.67 2k4h n GLU 48 N -2.01 0.60 0.06 0.00 -0.00 -1.26 -4.07 120.64 113.95 2k4h n GLU 48 Ca 0.02 -0.08 0.08 0.00 -0.00 0.00 0.00 57.16 57.18 2k4h n GLU 48 Cb 0.58 -1.62 0.36 0.00 -0.00 0.00 0.00 31.44 30.76 2k4h n GLU 48 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 2k4h n SER 49 N -2.35 0.28 -0.33 -1.84 7.64 -1.26 -1.66 113.62 114.10 2k4h n SER 49 Ca -0.02 0.58 0.10 0.00 1.01 0.00 0.00 58.87 60.53 2k4h n SER 49 Cb 0.55 -0.64 0.42 0.00 -1.01 0.00 0.00 64.21 63.53 2k4h n SER 49 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2k4h n LEU 50 N -1.83 1.00 -0.36 -3.43 4.77 -1.26 -3.34 117.00 112.56 2k4h n LEU 50 Ca 0.02 -0.42 0.12 0.00 -0.03 0.00 0.00 56.01 55.70 2k4h n LEU 50 Cb 0.16 -0.07 0.14 0.00 -2.33 0.00 0.00 43.42 41.32 2k4h n LEU 50 CO 0.14 0.21 0.42 0.18 -1.33 0.00 0.00 177.39 177.01 2k4h n LEU 51 N -0.11 1.54 -1.46 2.23 4.77 -0.67 -0.04 117.00 123.26 2k4h n LEU 51 Ca 0.15 -0.53 -0.11 0.00 -0.03 0.00 0.00 56.01 55.48 2k4h n LEU 51 Cb 0.22 -0.05 0.16 0.00 -2.33 0.00 0.00 43.42 41.41 2k4h n LEU 51 CO 0.11 0.29 0.69 -1.84 -1.33 0.00 0.00 177.39 175.32 2k4h n GLU 52 N -0.40 2.22 -3.64 3.23 0.28 -1.21 -4.95 120.64 116.17 2k4h n GLU 52 Ca 0.10 -3.37 -0.04 0.00 -0.16 0.00 0.00 57.16 53.68 2k4h n GLU 52 Cb 0.41 -1.95 -0.07 0.00 1.43 0.00 0.00 31.44 31.26 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 -2.63 -0.43 0.19 -1.84 1.04 -1.26 -5.03 113.70 103.73 2k4h s SER 53 Ca 0.48 0.75 -0.12 0.00 0.48 0.00 0.00 55.95 57.54 2k4h s SER 53 Cb 0.42 1.01 0.16 0.00 0.10 0.00 0.00 66.02 67.71 2k4h s SER 53 CO 0.00 -0.12 1.79 0.07 0.98 0.00 0.00 173.24 175.96 2k4h h LYS 54 N 5.18 0.52 -0.75 4.02 2.10 -1.87 0.88 116.57 126.66 2k4h h LYS 54 Ca -0.28 -0.03 0.05 0.00 -2.00 0.00 0.00 60.65 58.39 2k4h h LYS 54 Cb 1.19 -0.12 -0.04 0.00 -0.90 0.00 0.00 32.23 32.35 2k4h h LYS 54 CO 0.17 0.35 0.49 1.49 -2.00 0.00 0.00 179.45 179.94 2k4h h GLU 55 N 0.54 0.82 -0.00 0.07 4.81 -1.96 -0.52 114.58 118.33 2k4h h GLU 55 Ca 0.24 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.38 2k4h h GLU 55 Cb 0.15 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.35 2k4h h GLU 55 CO -0.17 0.54 -0.16 0.78 -0.73 0.00 0.00 179.01 179.28 2k4h h GLY 56 N 0.84 0.12 1.81 1.92 0.00 -1.48 -3.18 103.07 103.10 2k4h h GLY 56 Ca 0.31 -0.21 0.02 0.00 0.00 0.00 0.00 47.33 47.45 2k4h h GLY 56 CO -0.10 0.19 0.09 0.00 0.00 0.00 0.00 176.54 176.71 2k4h h GLN 58 N 0.09 0.44 0.00 0.00 4.15 -1.14 -2.02 115.11 116.63 2k4h h GLN 58 Ca 0.05 -0.16 -0.02 0.00 0.77 0.00 0.00 58.65 59.29 2k4h h GLN 58 Cb 0.11 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 27.76 2k4h h GLN 58 CO -0.01 0.66 -0.10 0.87 -1.93 0.00 0.00 178.83 178.32 2k4h h LYS 59 N 0.39 0.00 0.14 1.69 6.56 -1.18 -2.92 116.57 121.25 2k4h h LYS 59 Ca 0.06 0.00 -0.27 0.00 -1.06 0.00 0.00 60.65 59.38 2k4h h LYS 59 Cb 0.64 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.31 2k4h h LYS 59 CO 0.05 0.10 -1.34 0.82 -2.06 0.00 0.00 179.45 177.01 2k4h h ILE 60 N 0.00 1.13 -0.25 1.86 2.04 -1.29 -3.32 117.51 117.68 2k4h h ILE 60 Ca -0.00 -2.46 0.02 0.00 1.00 0.00 0.00 64.86 63.42 2k4h h ILE 60 Cb 0.61 2.84 -0.01 0.00 -0.74 0.00 0.00 36.82 39.51 2k4h h ILE 60 CO 0.01 0.73 0.17 -0.07 0.00 0.00 0.00 178.15 178.99 2k4h h LEU 61 N -0.24 0.23 -1.30 1.44 3.38 -1.33 0.17 115.31 117.66 2k4h h LEU 61 Ca -0.27 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.62 2k4h h LEU 61 Cb 1.81 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.49 2k4h h LEU 61 CO 0.11 0.16 -0.34 0.00 0.09 0.00 0.00 178.44 178.46 2k4h h THR 62 N 0.27 1.10 0.10 0.22 1.03 -1.63 0.27 112.91 114.28 2k4h h THR 62 Ca 0.10 -1.21 -0.35 0.00 -0.01 0.00 0.00 66.41 64.93 2k4h h THR 62 Cb 0.07 1.68 -0.02 0.00 -1.07 0.00 0.00 68.15 68.80 2k4h h THR 62 CO -0.02 0.33 -1.94 0.52 -0.01 0.00 0.00 175.52 174.40 2k4h n VAL 63 N -3.93 1.75 0.19 0.00 0.31 -0.29 -4.10 118.33 112.25 2k4h n VAL 63 Ca -0.02 -0.68 0.07 0.00 -0.01 0.00 0.00 64.34 63.70 2k4h n VAL 63 Cb 0.40 -1.60 0.23 0.00 -0.91 0.00 0.00 33.84 31.95 2k4h n VAL 63 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2k4h h LEU 64 N 0.06 0.00 0.50 7.52 3.38 -0.69 -3.24 115.31 122.84 2k4h h LEU 64 Ca -0.40 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.56 2k4h h LEU 64 Cb 2.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.76 2k4h h LEU 64 CO 0.09 0.30 -0.51 -0.78 0.09 0.00 0.00 178.44 177.64 2k4h h ASP 65 N 0.00 -1.40 0.41 -0.43 3.58 -0.61 -1.77 116.42 116.21 2k4h h ASP 65 Ca -0.00 0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.56 2k4h h ASP 65 Cb 1.06 0.46 0.00 0.00 1.72 0.00 0.00 39.33 42.57 2k4h h ASP 65 CO 0.04 -0.67 0.00 -0.81 -2.88 0.00 0.00 179.24 174.92 2k4h n PRO 66 N -5.52 0.08 0.21 0.28 -0.04 -1.25 -2.35 135.00 126.41 2k4h n PRO 66 Ca -0.12 0.22 0.14 0.00 -0.04 0.00 0.00 63.50 63.70 2k4h n PRO 66 Cb 0.46 -1.50 0.41 0.00 -0.04 0.00 0.00 33.50 32.83 2k4h n PRO 66 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 2k4h h MET 67 N 0.00 0.00 0.85 0.54 4.05 -1.34 -3.25 114.93 115.78 2k4h h MET 67 Ca 0.00 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.38 2k4h h MET 67 Cb 0.21 0.00 0.01 0.00 -0.80 0.00 0.00 31.60 31.01 2k4h h MET 67 CO 0.00 0.00 -0.41 0.28 0.23 0.00 0.00 176.91 177.01 2k4h h VAL 68 N 0.00 0.06 0.00 -5.77 2.07 -1.41 -0.22 116.25 110.98 2k4h h VAL 68 Ca 0.00 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.39 2k4h h VAL 68 Cb 0.74 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 2k4h h VAL 68 CO 0.00 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.78 2k4h n PRO 69 N -5.54 0.33 -2.73 1.57 -0.04 -1.25 -3.17 135.00 124.18 2k4h n PRO 69 Ca -0.14 0.08 -0.10 0.00 -0.04 0.00 0.00 63.50 63.30 2k4h n PRO 69 Cb 0.45 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.44 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 -1.16 0.77 -2.88 0.52 -2.24 -1.05 -5.11 114.28 103.14 2k4h n THR 70 Ca 0.09 -3.13 0.00 0.00 -2.27 0.00 0.00 64.05 58.74 2k4h n THR 70 Cb 0.09 0.58 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 2k4h n THR 70 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k4h n GLY 71 N -0.05 3.02 0.07 3.38 0.00 -0.12 -4.79 105.19 106.70 2k4h n GLY 71 Ca 0.10 -1.10 -0.00 0.00 0.00 0.00 0.00 46.02 45.02 2k4h n GLY 71 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2k4h n SER 72 N -0.93 0.44 -0.03 1.61 3.41 -1.26 -5.01 113.62 111.85 2k4h n SER 72 Ca 0.00 -1.03 -0.15 0.00 -0.26 0.00 0.00 58.87 57.43 2k4h n SER 72 Cb 0.00 -0.01 -0.11 0.00 -0.26 0.00 0.00 64.21 63.83 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 0.17 -0.34 4.33 5.08 -1.99 -3.19 114.58 118.63 2k4h h GLU 73 Ca -0.01 -0.17 0.10 0.00 -1.00 0.00 0.00 59.36 58.28 2k4h h GLU 73 Cb 0.02 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2k4h h GLU 73 CO 0.01 0.89 0.34 -0.91 -1.00 0.00 0.00 179.01 178.34 2k4h h ASN 74 N -0.48 0.00 -0.32 1.42 2.35 -2.02 -0.02 115.58 116.51 2k4h h ASN 74 Ca -0.03 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.58 2k4h h ASN 74 Cb 0.96 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.33 2k4h h ASN 74 CO 0.05 0.00 -0.37 0.25 -1.65 0.00 0.00 177.43 175.70 2k4h h LEU 75 N 0.00 0.88 -2.00 1.61 6.46 -1.95 -2.97 115.31 117.35 2k4h h LEU 75 Ca 0.16 -0.48 0.25 0.00 -0.12 0.00 0.00 57.88 57.69 2k4h h LEU 75 Cb 0.84 -0.25 -0.03 0.00 -0.73 0.00 0.00 40.66 40.49 2k4h h LEU 75 CO -0.00 1.19 0.62 0.11 -0.62 0.00 0.00 178.44 179.74 2k4h h LYS 76 N 0.59 0.00 -0.12 1.25 1.57 -1.02 0.15 116.57 118.99 2k4h h LYS 76 Ca 0.04 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.62 2k4h h LYS 76 Cb 0.96 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.28 2k4h h LYS 76 CO 0.09 0.00 -0.74 0.77 -0.57 0.00 0.00 179.45 179.00 2k4h h SER 77 N 0.00 0.85 -0.03 0.86 0.02 -1.56 -2.89 113.55 110.81 2k4h h SER 77 Ca 0.41 -0.65 -0.00 0.00 -0.84 0.00 0.00 61.79 60.70 2k4h h SER 77 Cb 1.64 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 63.93 2k4h h SER 77 CO -0.00 1.37 0.01 0.25 -1.14 0.00 0.00 176.83 177.31 2k4h h LEU 78 N 0.40 0.04 -0.70 5.07 5.85 -0.75 -1.69 115.31 123.52 2k4h h LEU 78 Ca -0.06 -0.18 0.09 0.00 0.84 0.00 0.00 57.88 58.57 2k4h h LEU 78 Cb 1.38 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 42.33 2k4h h LEU 78 CO 0.15 0.21 0.35 0.15 -0.34 0.00 0.00 178.44 178.96 2k4h h PHE 79 N -0.14 0.63 -0.13 1.25 3.57 -1.38 -1.32 116.94 119.42 2k4h h PHE 79 Ca 0.01 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 2k4h h PHE 79 Cb 0.19 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 2k4h h PHE 79 CO -0.01 0.24 0.07 -0.91 -2.23 0.00 0.00 178.31 175.46 2k4h h ASN 80 N 0.61 0.16 -0.82 0.41 2.35 -1.36 -2.58 115.58 114.35 2k4h h ASN 80 Ca 0.34 -0.10 0.09 0.00 -0.55 0.00 0.00 56.30 56.08 2k4h h ASN 80 Cb 0.34 -0.04 -0.06 0.00 0.05 0.00 0.00 38.32 38.61 2k4h h ASN 80 CO -0.25 0.21 0.53 0.74 -1.65 0.00 0.00 177.43 177.01 2k4h h THR 81 N 0.10 0.97 -0.25 2.81 2.02 -0.69 -0.60 112.91 117.26 2k4h h THR 81 Ca 0.04 -0.27 -0.07 0.00 0.77 0.00 0.00 66.41 66.89 2k4h h THR 81 Cb 0.09 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.60 2k4h h THR 81 CO -0.01 0.14 -0.14 0.58 0.37 0.00 0.00 175.52 176.47 2k4h h VAL 82 N 0.79 1.22 0.00 3.16 2.07 -0.91 -2.10 116.25 120.49 2k4h h VAL 82 Ca 0.37 -0.98 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 2k4h h VAL 82 Cb 0.40 1.18 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2k4h h VAL 82 CO -0.15 0.31 -0.10 0.00 0.02 0.00 0.00 177.57 177.66 2k4h h VAL 84 N 0.00 0.00 -1.14 0.00 2.07 -1.28 -3.23 116.25 112.67 2k4h h VAL 84 Ca -0.00 -0.86 0.38 0.00 0.82 0.00 0.00 66.70 67.05 2k4h h VAL 84 Cb 0.31 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 29.94 2k4h h VAL 84 CO 0.01 0.00 0.69 0.40 0.02 0.00 0.00 177.57 178.70 2k4h h ILE 85 N -0.86 0.19 0.06 4.57 1.08 -1.48 0.32 117.51 121.38 2k4h h ILE 85 Ca 0.00 -0.06 -0.00 0.00 -0.39 0.00 0.00 64.86 64.41 2k4h h ILE 85 Cb 0.14 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.89 2k4h h ILE 85 CO 0.00 0.03 -0.03 -0.25 -0.69 0.00 0.00 178.15 177.21 2k4h h TRP 86 N 0.17 -0.07 -0.53 1.37 7.01 -1.63 -3.11 115.95 119.15 2k4h h TRP 86 Ca 0.78 -0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.89 2k4h h TRP 86 Cb 2.15 0.02 -0.09 0.00 -2.10 0.00 0.00 29.16 29.13 2k4h h TRP 86 CO -0.01 0.16 -0.05 0.00 -2.79 0.00 0.00 178.44 175.75 2k4h h ILE 88 N 0.06 0.49 0.10 0.00 2.04 -1.37 0.22 117.51 119.06 2k4h h ILE 88 Ca 0.27 -0.09 -0.28 0.00 1.00 0.00 0.00 64.86 65.76 2k4h h ILE 88 Cb 0.41 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2k4h h ILE 88 CO -0.49 0.05 -1.35 0.45 0.00 0.00 0.00 178.15 176.81 2k4h h HIS 89 N 0.26 0.38 -0.19 1.37 3.86 -0.71 -3.25 115.15 116.87 2k4h h HIS 89 Ca 0.58 -0.28 0.00 0.00 -1.16 0.00 0.00 60.37 59.51 2k4h h HIS 89 Cb 1.72 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 30.17 2k4h h HIS 89 CO -0.00 1.26 0.00 0.00 0.86 0.00 0.00 177.93 180.05 2k4h n ALA 90 N -2.56 2.48 -0.99 2.45 0.00 0.59 -4.80 120.51 117.68 2k4h n ALA 90 Ca -0.11 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 52.99 2k4h n ALA 90 Cb 1.02 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 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 0.05 -1.08 -2.14 0.00 2.13 -0.09 -4.94 120.64 114.58 2k4h n GLU 91 Ca 0.07 0.27 -0.43 0.00 0.66 0.00 0.00 57.16 57.74 2k4h n GLU 91 Cb 0.17 -4.10 -0.03 0.00 0.27 0.00 0.00 31.44 27.75 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 -1.10 3.99 -0.17 5.31 0.41 -0.17 -4.98 118.70 121.99 2k4h s GLU 92 Ca 0.00 1.82 -0.16 0.00 -0.41 0.00 0.00 54.97 56.22 2k4h s GLU 92 Cb 0.00 -3.97 -0.04 0.00 -1.78 0.00 0.00 34.13 28.34 2k4h s GLU 92 CO 0.00 -1.06 0.38 0.15 -0.49 0.00 0.00 175.26 174.25 2k4h s LYS 93 N 4.27 4.24 0.15 1.61 3.01 -1.26 -4.24 119.74 127.52 2k4h s LYS 93 Ca 0.69 0.22 0.01 0.00 -1.01 0.00 0.00 55.97 55.88 2k4h s LYS 93 Cb -0.27 -3.48 -0.00 0.00 -1.01 0.00 0.00 37.83 33.07 2k4h s LYS 93 CO 0.27 0.09 0.04 1.33 0.51 0.00 0.00 175.35 177.58 2k4h n VAL 94 N 3.96 0.00 0.00 3.17 0.24 -1.26 -5.04 118.33 119.40 2k4h n VAL 94 Ca -0.09 -0.81 0.00 0.00 -2.04 0.00 0.00 64.34 61.40 2k4h n VAL 94 Cb 0.51 0.26 0.00 0.00 -1.47 0.00 0.00 33.84 33.14 2k4h n VAL 94 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 2k4h n LYS 95 N -0.34 0.00 -4.25 7.34 2.85 -1.26 -4.82 118.16 117.68 2k4h n LYS 95 Ca -0.03 0.00 -0.15 0.00 -1.05 0.00 0.00 58.31 57.08 2k4h n LYS 95 Cb 0.21 -0.40 -0.10 0.00 -0.65 0.00 0.00 35.03 34.09 2k4h n LYS 95 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 2k4h s ASP 96 N -5.02 1.85 0.22 -5.58 1.47 -1.26 -0.27 116.67 108.08 2k4h s ASP 96 Ca 0.00 -0.99 -0.10 0.00 1.18 0.00 0.00 52.55 52.65 2k4h s ASP 96 Cb 0.00 -0.02 0.33 0.00 -0.34 0.00 0.00 42.92 42.89 2k4h s ASP 96 CO 0.00 -0.30 1.65 0.74 0.68 0.00 0.00 175.17 177.94 2k4h h THR 97 N 2.86 0.43 -0.11 2.11 2.02 -1.11 0.47 112.91 119.59 2k4h h THR 97 Ca -0.37 -0.03 0.01 0.00 0.77 0.00 0.00 66.41 66.78 2k4h h THR 97 Cb 1.19 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 2k4h h THR 97 CO 0.62 0.02 0.07 -0.33 0.37 0.00 0.00 175.52 176.27 2k4h h GLU 98 N 0.10 0.11 -0.08 6.66 3.07 -1.86 -1.82 114.58 120.78 2k4h h GLU 98 Ca 0.35 -0.01 -0.22 0.00 -0.50 0.00 0.00 59.36 58.98 2k4h h GLU 98 Cb 0.58 -0.03 0.01 0.00 -0.84 0.00 0.00 28.75 28.47 2k4h h GLU 98 CO -0.58 0.08 -0.84 0.78 -1.40 0.00 0.00 179.01 177.04 2k4h h GLY 99 N 0.12 0.67 1.68 -3.84 0.00 -0.52 -3.12 103.07 98.05 2k4h h GLY 99 Ca 0.04 -1.02 -0.12 0.00 0.00 0.00 0.00 47.33 46.24 2k4h h GLY 99 CO -0.01 0.90 -0.40 0.00 0.00 0.00 0.00 176.54 177.03 2k4h h ALA 100 N 0.67 1.02 0.00 3.60 0.00 -0.50 -2.71 119.26 121.34 2k4h h ALA 100 Ca -0.07 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 2k4h h ALA 100 Cb 1.46 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 2k4h h ALA 100 CO 0.16 0.61 -0.22 -0.22 0.00 0.00 0.00 179.25 179.58 2k4h h LYS 101 N 0.30 0.00 0.00 0.00 3.64 -1.37 -1.81 116.57 117.34 2k4h h LYS 101 Ca 0.03 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.22 2k4h h LYS 101 Cb 0.84 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.64 2k4h h LYS 101 CO 0.07 0.22 -0.85 1.96 -2.27 0.00 0.00 179.45 178.58 2k4h h GLN 102 N 0.00 0.09 0.22 1.90 4.20 -1.42 -1.63 115.11 118.48 2k4h h GLN 102 Ca -0.00 -0.10 -0.33 0.00 0.06 0.00 0.00 58.65 58.28 2k4h h GLN 102 Cb 0.57 0.03 0.04 0.00 0.30 0.00 0.00 27.48 28.41 2k4h h GLN 102 CO 0.03 0.88 -1.41 0.82 -0.67 0.00 0.00 178.83 178.48 2k4h h ILE 103 N 0.05 1.29 -0.07 2.54 2.04 -1.38 -3.14 117.51 118.84 2k4h h ILE 103 Ca -0.03 -2.63 -0.04 0.00 1.00 0.00 0.00 64.86 63.17 2k4h h ILE 103 Cb 1.47 2.96 -0.00 0.00 -0.74 0.00 0.00 36.82 40.51 2k4h h ILE 103 CO 0.12 0.79 -0.10 0.58 0.00 0.00 0.00 178.15 179.54 2k4h h VAL 104 N 0.17 1.39 -0.41 1.67 2.07 -1.40 -3.13 116.25 116.61 2k4h h VAL 104 Ca -0.24 -1.34 0.08 0.00 0.82 0.00 0.00 66.70 66.02 2k4h h VAL 104 Cb 2.09 2.12 -0.08 0.00 -1.52 0.00 0.00 31.29 33.91 2k4h h VAL 104 CO 0.27 0.37 -0.08 -0.09 0.02 0.00 0.00 177.57 178.06 2k4h h ARG 105 N -0.27 0.02 -0.90 1.57 2.43 -1.43 -0.44 114.38 115.36 2k4h h ARG 105 Ca 0.01 -0.00 0.14 0.00 -0.81 0.00 0.00 59.98 59.32 2k4h h ARG 105 Cb 0.65 -0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 30.11 2k4h h ARG 105 CO 0.02 0.02 0.50 -0.09 -1.51 0.00 0.00 179.97 178.91 2k4h h ARG 106 N 0.02 0.70 -0.02 0.20 2.43 -1.59 -0.85 114.38 115.28 2k4h h ARG 106 Ca 0.20 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 2k4h h ARG 106 Cb 0.30 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 2k4h h ARG 106 CO -0.41 0.47 -0.01 0.45 -1.51 0.00 0.00 179.97 178.96 2k4h h HIS 107 N 0.72 0.04 -0.92 2.20 3.86 -1.09 -2.83 115.15 117.14 2k4h h HIS 107 Ca 0.48 -0.01 0.10 0.00 -1.16 0.00 0.00 60.37 59.78 2k4h h HIS 107 Cb 0.64 -0.01 -0.08 0.00 1.06 0.00 0.00 27.41 29.03 2k4h h HIS 107 CO -0.06 0.45 0.56 -0.07 0.86 0.00 0.00 177.93 179.68 2k4h h LEU 108 N -0.38 0.84 -0.74 2.43 3.38 -0.51 -1.44 115.31 118.90 2k4h h LEU 108 Ca 0.00 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.05 2k4h h LEU 108 Cb 0.44 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 2k4h h LEU 108 CO 0.00 0.48 0.46 0.58 0.09 0.00 0.00 178.44 180.05 2k4h h VAL 109 N 0.95 1.08 0.00 1.22 2.07 -1.14 0.56 116.25 120.98 2k4h h VAL 109 Ca 0.44 -0.30 -0.04 0.00 0.82 0.00 0.00 66.70 67.62 2k4h h VAL 109 Cb 0.36 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 2k4h h VAL 109 CO -0.23 0.16 -0.19 0.00 0.02 0.00 0.00 177.57 177.33 2k4h h ALA 110 N 1.33 1.27 0.00 1.67 0.00 -1.03 -2.39 119.26 120.11 2k4h h ALA 110 Ca 0.30 -0.17 -0.19 0.00 0.00 0.00 0.00 54.91 54.85 2k4h h ALA 110 Cb 0.06 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2k4h h ALA 110 CO -0.13 0.23 -1.09 0.93 0.00 0.00 0.00 179.25 179.20 2k4h h GLU 111 N 0.00 0.00 -0.88 0.00 4.39 -0.61 -3.28 114.58 114.20 2k4h h GLU 111 Ca -0.00 0.00 -0.48 0.00 0.34 0.00 0.00 59.36 59.22 2k4h h GLU 111 Cb 0.47 0.00 -0.27 0.00 -0.10 0.00 0.00 28.75 28.84 2k4h h GLU 111 CO 0.02 0.64 0.52 2.41 -1.16 0.00 0.00 179.01 181.44 2k4h n THR 112 N -3.17 3.13 0.00 1.13 -1.04 0.05 -4.39 114.28 109.99 2k4h n THR 112 Ca -0.05 -2.22 0.00 0.00 -2.04 0.00 0.00 64.05 59.74 2k4h n THR 112 Cb 0.89 -0.53 0.00 0.00 -1.82 0.00 0.00 70.33 68.87 2k4h n THR 112 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2k4h n GLY 113 N -1.11 0.00 0.22 3.41 0.00 -0.99 -4.51 105.19 102.21 2k4h n GLY 113 Ca 0.55 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.66 2k4h n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k4h h THR 114 N 0.00 0.73 -0.85 2.61 1.03 -1.76 -3.22 112.91 111.45 2k4h h THR 114 Ca 0.00 -1.07 -0.40 0.00 -0.01 0.00 0.00 66.41 64.93 2k4h h THR 114 Cb 0.38 1.67 -0.41 0.00 -1.07 0.00 0.00 68.15 68.72 2k4h h THR 114 CO 0.00 0.25 -1.02 0.00 -0.01 0.00 0.00 175.52 174.74 2k4h n ALA 115 N -2.29 3.74 -1.41 0.00 0.00 -1.26 -4.85 120.51 114.44 2k4h n ALA 115 Ca -0.01 -3.34 -0.23 0.00 0.00 0.00 0.00 53.44 49.86 2k4h n ALA 115 Cb 0.39 -0.73 0.13 0.00 0.00 0.00 0.00 19.45 19.25 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 -0.44 2.44 -0.02 0.00 2.13 -1.22 -4.35 120.64 119.18 2k4h n GLU 116 Ca 0.20 -3.28 -0.02 0.00 0.66 0.00 0.00 57.16 54.72 2k4h n GLU 116 Cb 0.82 -2.14 -0.03 0.00 0.27 0.00 0.00 31.44 30.35 2k4h n GLU 116 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 2k4h n LYS 117 N -1.02 2.77 -2.81 5.31 2.85 -1.26 -5.03 118.16 118.97 2k4h n LYS 117 Ca 0.53 0.00 -0.07 0.00 -1.05 0.00 0.00 58.31 57.72 2k4h n LYS 117 Cb 1.13 -1.11 0.01 0.00 -0.65 0.00 0.00 35.03 34.40 2k4h n LYS 117 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 177.40 177.23 2k4h n MET 118 N -2.25 -2.40 -0.93 -1.58 0.00 -1.26 -5.01 117.12 103.68 2k4h n MET 118 Ca -0.08 2.13 -0.27 0.00 -0.00 0.00 0.00 57.70 59.48 2k4h n MET 118 Cb 0.64 -5.57 0.23 0.00 0.00 0.00 0.00 33.22 28.52 2k4h n MET 118 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 2k4h n PRO 119 N -0.24 -2.95 -1.62 2.12 -0.04 -1.26 -5.07 135.00 125.94 2k4h n PRO 119 Ca 0.11 -1.57 -0.15 0.00 -0.04 0.00 0.00 63.50 61.85 2k4h n PRO 119 Cb 0.42 -1.48 0.08 0.00 -0.04 0.00 0.00 33.50 32.49 2k4h n PRO 119 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2k4h n SER 120 N -4.69 0.63 -4.06 3.54 7.64 -1.26 -5.07 113.62 110.35 2k4h n SER 120 Ca 0.14 -1.59 -0.33 0.00 1.01 0.00 0.00 58.87 58.10 2k4h n SER 120 Cb 0.53 -0.44 -0.14 0.00 -1.01 0.00 0.00 64.21 63.15 2k4h n SER 120 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2k4h s THR 121 N -1.97 2.60 0.21 0.44 -4.23 -1.26 -5.08 115.64 106.35 2k4h s THR 121 Ca 0.41 -2.21 -0.08 0.00 -1.18 0.00 0.00 61.69 58.63 2k4h s THR 121 Cb -0.02 -2.85 -0.02 0.00 1.34 0.00 0.00 72.50 70.95 2k4h s THR 121 CO 0.27 -0.60 0.30 -0.55 -0.54 0.00 0.00 174.62 173.51 2k4h s SER 122 N 1.20 0.03 -0.02 3.99 0.15 -1.26 -5.18 113.70 112.62 2k4h s SER 122 Ca 0.09 -1.08 -0.08 0.00 0.70 0.00 0.00 55.95 55.59 2k4h s SER 122 Cb -0.20 0.47 0.01 0.00 -1.71 0.00 0.00 66.02 64.59 2k4h s SER 122 CO -0.07 -0.97 0.17 -0.13 1.20 0.00 0.00 173.24 173.44 2k4h s ARG 123 N -4.05 0.43 1.10 5.44 0.52 -1.26 -5.17 118.95 115.96 2k4h s ARG 123 Ca 0.27 -0.21 -0.19 0.00 -0.52 0.00 0.00 55.73 55.09 2k4h s ARG 123 Cb 0.03 0.19 0.27 0.00 0.52 0.00 0.00 34.95 35.96 2k4h s ARG 123 CO 0.08 -0.10 0.98 -0.35 0.02 0.00 0.00 175.30 175.93 2k4h n PRO 124 N 1.83 -2.94 -4.31 3.54 -0.04 -1.26 -5.08 135.00 126.74 2k4h n PRO 124 Ca -0.20 -1.56 -0.24 0.00 -0.04 0.00 0.00 63.50 61.46 2k4h n PRO 124 Cb 0.56 -1.47 -0.08 0.00 -0.04 0.00 0.00 33.50 32.47 2k4h n PRO 124 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2k4h s THR 125 N -2.77 2.94 0.39 0.52 -1.32 -1.26 -5.12 115.64 109.02 2k4h s THR 125 Ca 0.64 -1.97 -0.23 0.00 -1.21 0.00 0.00 61.69 58.91 2k4h s THR 125 Cb -0.06 -2.77 -0.10 0.00 -1.51 0.00 0.00 72.50 68.06 2k4h s THR 125 CO 0.49 -0.28 0.98 0.00 -2.21 0.00 0.00 174.62 173.59 2k4h s ALA 126 N -2.44 3.09 1.04 11.08 0.00 -1.26 -5.05 121.76 128.22 2k4h s ALA 126 Ca 0.33 0.52 -0.13 0.00 0.00 0.00 0.00 51.96 52.68 2k4h s ALA 126 Cb -0.03 -3.20 0.21 0.00 0.00 0.00 0.00 23.12 20.10 2k4h s ALA 126 CO 0.19 0.04 1.09 -1.25 0.00 0.00 0.00 175.76 175.83 2k4h s PRO 127 N -2.65 0.10 0.23 0.00 0.04 -1.26 -5.08 135.00 126.38 2k4h s PRO 127 Ca 0.57 0.41 0.11 0.00 0.04 0.00 0.00 61.00 62.14 2k4h s PRO 127 Cb -0.16 -1.71 -0.05 0.00 0.04 0.00 0.00 34.50 32.63 2k4h s PRO 127 CO 0.20 -2.93 -0.17 0.45 0.04 0.00 0.00 177.00 174.59 2k4h s SER 128 N -3.50 3.76 -0.30 6.66 0.15 -1.26 -5.12 113.70 114.10 2k4h s SER 128 Ca 0.66 -0.85 -0.06 0.00 0.70 0.00 0.00 55.95 56.41 2k4h s SER 128 Cb -0.18 -0.42 0.19 0.00 -1.71 0.00 0.00 66.02 63.90 2k4h s SER 128 CO 0.58 0.08 0.90 -0.55 1.20 0.00 0.00 173.24 175.44 2k4h s SER 129 N -3.11 -0.81 -0.12 5.45 0.15 -1.26 -5.16 113.70 108.84 2k4h s SER 129 Ca 0.26 0.13 -0.06 0.00 0.70 0.00 0.00 55.95 56.97 2k4h s SER 129 Cb -0.07 1.53 0.05 0.00 -1.71 0.00 0.00 66.02 65.82 2k4h s SER 129 CO 0.14 -0.15 0.29 -0.70 1.20 0.00 0.00 173.24 174.02 2k4h s GLU 130 N 2.92 0.25 -0.28 5.44 2.56 -1.26 -5.15 118.70 123.18 2k4h s GLU 130 Ca 0.20 0.60 -0.16 0.00 0.00 0.00 0.00 54.97 55.62 2k4h s GLU 130 Cb -0.05 -0.09 0.08 0.00 2.00 0.00 0.00 34.13 36.06 2k4h s GLU 130 CO -0.23 -0.16 0.69 -1.59 -0.56 0.00 0.00 175.26 173.41 2k4h s LYS 131 N 1.32 0.71 -0.79 4.30 0.00 -1.26 -5.06 119.74 118.96 2k4h s LYS 131 Ca -0.09 1.23 -0.05 0.00 0.00 0.00 0.00 55.97 57.05 2k4h s LYS 131 Cb -0.10 0.14 0.04 0.00 0.00 0.00 0.00 37.83 37.92 2k4h s LYS 131 CO -0.10 -0.15 2.72 0.41 0.00 0.00 0.00 175.35 178.24 2k4h n GLY 132 N 4.30 4.54 0.00 0.59 0.00 -1.26 -4.76 105.19 108.60 2k4h n GLY 132 Ca -0.20 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 43.96 2k4h n GLY 132 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k4h n GLY 133 N 1.48 4.01 3.64 -0.02 0.00 -1.26 -5.19 105.19 107.85 2k4h n GLY 133 Ca 0.55 -0.49 -0.06 0.00 0.00 0.00 0.00 46.02 46.03 2k4h n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k4h s ASN 134 N 1.00 -0.26 0.00 1.61 4.22 -1.26 -5.30 114.94 114.95 2k4h s ASN 134 Ca 0.00 -0.23 0.00 0.00 -2.14 0.00 0.00 52.86 50.49 2k4h s ASN 134 Cb 0.00 0.44 0.00 0.00 1.28 0.00 0.00 41.25 42.97 2k4h s ASN 134 CO 0.00 -0.78 0.39 0.00 -2.04 0.00 0.00 177.10 174.67