#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r5u n PRO 24 N 0.00 2.50 -1.67 -1.09 -0.02 -1.26 -4.82 135.00 128.64 2r5u n PRO 24 Ca 0.00 0.90 -0.49 0.00 -2.02 0.00 0.00 63.50 61.89 2r5u n PRO 24 Cb 0.00 -2.70 -0.05 0.00 -0.02 0.00 0.00 33.50 30.73 2r5u n PRO 24 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2r5u n PRO 25 N 3.45 1.90 -3.56 0.52 -0.02 -1.26 -4.93 135.00 131.09 2r5u n PRO 25 Ca 0.15 0.69 -0.07 0.00 -2.02 0.00 0.00 63.50 62.25 2r5u n PRO 25 Cb 0.33 -2.45 -0.03 0.00 -0.02 0.00 0.00 33.50 31.33 2r5u n PRO 25 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 2r5u s GLN 26 N 2.16 0.55 -0.34 -0.52 -2.07 -1.26 -4.56 119.66 113.62 2r5u s GLN 26 Ca 0.86 -0.14 -0.01 0.00 -1.82 0.00 0.00 55.36 54.25 2r5u s GLN 26 Cb -0.77 0.26 0.12 0.00 -1.09 0.00 0.00 33.01 31.53 2r5u s GLN 26 CO 0.47 -0.23 0.17 0.34 -1.32 0.00 0.00 175.29 174.72 2r5u s ASP 27 N -2.07 3.40 0.26 12.60 -1.08 -1.26 -5.02 116.67 123.50 2r5u s ASP 27 Ca 0.06 -1.89 -0.01 0.00 -0.52 0.00 0.00 52.55 50.19 2r5u s ASP 27 Cb -0.01 -0.55 0.34 0.00 -1.46 0.00 0.00 42.92 41.24 2r5u s ASP 27 CO -0.06 -0.36 1.71 -0.07 0.52 0.00 0.00 175.17 176.92 2r5u h LEU 28 N 7.57 0.65 -0.98 -1.34 3.38 -2.00 -1.55 115.31 121.03 2r5u h LEU 28 Ca -0.06 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.66 2r5u h LEU 28 Cb 0.98 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 2r5u h LEU 28 CO 0.38 0.82 0.20 0.00 0.09 0.00 0.00 178.44 179.93 2r5u h ALA 29 N 1.24 1.18 -0.55 1.53 0.00 -1.99 -0.05 119.26 120.62 2r5u h ALA 29 Ca 0.10 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 2r5u h ALA 29 Cb 0.61 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2r5u h ALA 29 CO 0.04 0.57 -0.05 0.00 0.00 0.00 0.00 179.25 179.81 2r5u h ALA 30 N 1.31 0.74 -0.13 0.00 0.00 -1.79 -1.51 119.26 117.88 2r5u h ALA 30 Ca 0.20 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2r5u h ALA 30 Cb 0.26 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2r5u h ALA 30 CO -0.01 0.61 0.08 0.93 0.00 0.00 0.00 179.25 180.87 2r5u h GLU 31 N 0.88 0.17 -0.79 0.00 5.08 -0.81 -0.22 114.58 118.88 2r5u h GLU 31 Ca 0.15 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2r5u h GLU 31 Cb 0.60 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 2r5u h GLU 31 CO 0.04 0.11 0.51 1.96 -1.00 0.00 0.00 179.01 180.63 2r5u h GLN 32 N 0.17 1.05 -0.02 2.33 4.20 -0.91 -2.41 115.11 119.52 2r5u h GLN 32 Ca 0.05 -0.07 -0.21 0.00 0.06 0.00 0.00 58.65 58.48 2r5u h GLN 32 Cb -0.01 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.53 2r5u h GLN 32 CO -0.02 0.71 -0.88 0.77 -0.67 0.00 0.00 178.83 178.73 2r5u h SER 33 N 1.08 0.49 -0.12 1.46 0.02 -1.05 0.23 113.55 115.66 2r5u h SER 33 Ca 0.29 -0.38 0.03 0.00 -0.84 0.00 0.00 61.79 60.89 2r5u h SER 33 Cb -0.11 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.25 2r5u h SER 33 CO -0.06 1.16 -0.07 0.58 -1.14 0.00 0.00 176.83 177.30 2r5u h VAL 34 N 0.23 0.78 -0.57 2.27 2.07 -0.86 -1.91 116.25 118.25 2r5u h VAL 34 Ca -0.06 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.40 2r5u h VAL 34 Cb 1.51 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 2r5u h VAL 34 CO 0.15 0.00 0.13 -0.07 0.02 0.00 0.00 177.57 177.80 2r5u h LEU 35 N -0.07 0.88 -0.63 2.57 3.38 -1.24 -2.24 115.31 117.97 2r5u h LEU 35 Ca 0.07 -0.24 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 2r5u h LEU 35 Cb 0.17 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2r5u h LEU 35 CO -0.17 0.89 0.08 1.23 0.09 0.00 0.00 178.44 180.56 2r5u h GLY 36 N 0.83 1.14 0.93 0.83 0.00 -0.93 -1.62 103.07 104.25 2r5u h GLY 36 Ca 0.18 -0.78 -0.04 0.00 0.00 0.00 0.00 47.33 46.69 2r5u h GLY 36 CO 0.00 0.72 0.11 -1.33 0.00 0.00 0.00 176.54 176.04 2r5u h GLY 37 N 0.97 0.68 1.30 4.60 0.00 -1.23 -2.13 103.07 107.25 2r5u h GLY 37 Ca 0.19 -0.42 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 2r5u h GLY 37 CO 0.02 0.39 0.28 -0.33 0.00 0.00 0.00 176.54 176.90 2r5u h MET 38 N 0.50 0.90 0.00 4.80 2.07 -1.21 -1.17 114.93 120.82 2r5u h MET 38 Ca 0.13 -0.13 -0.07 0.00 -2.07 0.00 0.00 59.70 57.56 2r5u h MET 38 Cb 0.29 -0.17 -0.01 0.00 -1.87 0.00 0.00 31.60 29.85 2r5u h MET 38 CO -0.00 0.71 -0.32 -0.07 1.07 0.00 0.00 176.91 178.31 2r5u h LEU 39 N 0.90 0.00 0.00 1.22 3.38 -1.10 -3.21 115.31 116.50 2r5u h LEU 39 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2r5u h LEU 39 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2r5u h LEU 39 CO -0.03 0.32 -0.86 0.18 0.09 0.00 0.00 178.44 178.14 2r5u n LEU 40 N -3.47 0.77 -3.65 1.67 4.77 -0.82 -4.30 117.00 111.97 2r5u n LEU 40 Ca -0.00 -0.27 -0.04 0.00 -0.03 0.00 0.00 56.01 55.67 2r5u n LEU 40 Cb 0.48 -0.09 -0.06 0.00 -2.33 0.00 0.00 43.42 41.42 2r5u n LEU 40 CO 0.35 0.18 0.18 -0.55 -1.33 0.00 0.00 177.39 176.23 2r5u s SER 41 N -3.13 -0.85 0.20 -1.43 0.15 -0.48 -5.04 113.70 103.13 2r5u s SER 41 Ca 0.08 1.38 -0.09 0.00 0.70 0.00 0.00 55.95 58.02 2r5u s SER 41 Cb 0.16 1.95 0.13 0.00 -1.71 0.00 0.00 66.02 66.56 2r5u s SER 41 CO 0.81 -0.22 1.77 0.50 1.20 0.00 0.00 173.24 177.30 2r5u h LYS 42 N 8.01 1.09 -0.34 5.44 3.64 -1.86 -2.31 116.57 130.24 2r5u h LYS 42 Ca -0.18 -0.18 0.02 0.00 -1.27 0.00 0.00 60.65 59.04 2r5u h LYS 42 Cb 1.11 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.73 2r5u h LYS 42 CO 0.11 0.88 0.23 -0.44 -2.27 0.00 0.00 179.45 177.96 2r5u h ASP 43 N 1.05 0.33 -0.85 4.20 3.32 -1.94 -2.11 116.42 120.42 2r5u h ASP 43 Ca 0.25 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 2r5u h ASP 43 Cb 0.18 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.61 2r5u h ASP 43 CO -0.02 0.23 0.51 0.00 -1.72 0.00 0.00 179.24 178.24 2r5u h ALA 44 N 1.80 1.28 -0.56 3.45 0.00 -1.70 -2.87 119.26 120.66 2r5u h ALA 44 Ca 0.13 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2r5u h ALA 44 Cb 0.06 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 2r5u h ALA 44 CO -0.03 0.61 0.36 0.82 0.00 0.00 0.00 179.25 181.01 2r5u h ILE 45 N 1.18 1.12 -0.79 0.00 2.04 -1.31 -1.26 117.51 118.50 2r5u h ILE 45 Ca 0.31 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.94 2r5u h ILE 45 Cb -0.04 0.32 -0.04 0.00 -0.74 0.00 0.00 36.82 36.32 2r5u h ILE 45 CO -0.06 0.13 0.51 0.00 0.00 0.00 0.00 178.15 178.74 2r5u h ALA 46 N 1.22 1.02 -0.62 1.87 0.00 -1.53 -1.16 119.26 120.06 2r5u h ALA 46 Ca 0.21 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 2r5u h ALA 46 Cb -0.06 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 2r5u h ALA 46 CO -0.06 0.36 0.08 -0.44 0.00 0.00 0.00 179.25 179.19 2r5u h ASP 47 N 1.02 0.98 0.08 0.00 3.32 -1.22 -3.15 116.42 117.45 2r5u h ASP 47 Ca 0.30 -0.23 -0.20 0.00 0.02 0.00 0.00 57.03 56.92 2r5u h ASP 47 Cb -0.05 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.24 2r5u h ASP 47 CO -0.09 0.99 -0.76 0.58 -1.72 0.00 0.00 179.24 178.24 2r5u h VAL 48 N 0.96 1.33 -0.88 -1.35 2.07 -0.98 -3.25 116.25 114.15 2r5u h VAL 48 Ca 0.19 -2.08 0.14 0.00 0.82 0.00 0.00 66.70 65.78 2r5u h VAL 48 Cb 0.44 2.06 -0.07 0.00 -1.52 0.00 0.00 31.29 32.21 2r5u h VAL 48 CO 0.01 0.64 0.57 -0.07 0.02 0.00 0.00 177.57 178.74 2r5u h LEU 49 N 0.39 0.63 0.00 2.57 3.38 -1.17 -0.81 115.31 120.30 2r5u h LEU 49 Ca -0.04 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2r5u h LEU 49 Cb 1.36 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2r5u h LEU 49 CO 0.14 0.32 0.00 -0.62 0.09 0.00 0.00 178.44 178.37 2r5u n GLU 50 N -4.55 0.48 0.00 1.13 1.02 -1.23 -3.91 120.64 113.58 2r5u n GLU 50 Ca 0.17 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 2r5u n GLU 50 Cb 0.48 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 2r5u n GLU 50 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2r5u n ARG 51 N -1.18 2.14 -4.26 3.49 1.74 -0.38 -5.11 116.66 113.09 2r5u n ARG 51 Ca 0.13 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 57.03 2r5u n ARG 51 Cb 0.15 -0.82 -0.11 0.00 -1.02 0.00 0.00 32.46 30.66 2r5u n ARG 51 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2r5u s LEU 52 N -1.94 2.43 0.15 0.55 1.43 -0.76 -4.77 118.68 115.77 2r5u s LEU 52 Ca 0.00 -0.84 0.10 0.00 -1.03 0.00 0.00 54.13 52.36 2r5u s LEU 52 Cb 0.00 -0.59 -0.04 0.00 0.03 0.00 0.00 46.19 45.59 2r5u s LEU 52 CO 0.00 -0.14 -0.21 -0.13 0.23 0.00 0.00 176.35 176.10 2r5u s ARG 53 N -2.82 1.63 0.53 1.70 1.81 -1.26 -4.82 118.95 115.71 2r5u s ARG 53 Ca 0.11 -1.36 0.31 0.00 -1.72 0.00 0.00 55.73 53.07 2r5u s ARG 53 Cb -0.04 -1.97 1.46 0.00 -0.45 0.00 0.00 34.95 33.94 2r5u s ARG 53 CO 0.04 0.44 1.89 -1.35 -0.68 0.00 0.00 175.30 175.63 2r5u h PRO 54 N 3.48 0.03 0.00 3.54 0.11 -1.98 0.13 132.00 137.30 2r5u h PRO 54 Ca -0.49 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2r5u h PRO 54 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2r5u h PRO 54 CO 0.46 0.02 0.00 0.78 -0.21 0.00 0.00 178.00 179.05 2r5u h GLY 55 N 0.03 0.00 2.00 -0.55 0.00 -1.95 -3.01 103.07 99.58 2r5u h GLY 55 Ca 0.43 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.76 2r5u h GLY 55 CO -0.02 0.00 -0.01 -0.55 0.00 0.00 0.00 176.54 175.96 2r5u h ASP 56 N 0.00 0.00 -3.44 0.19 3.32 -1.36 -3.44 116.42 111.69 2r5u h ASP 56 Ca 0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 2r5u h ASP 56 Cb 0.25 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 2r5u h ASP 56 CO 0.00 0.01 0.40 -0.36 -1.72 0.00 0.00 179.24 177.58 2r5u s PHE 57 N -3.48 3.67 0.01 4.55 0.40 -1.14 -4.58 117.98 117.42 2r5u s PHE 57 Ca 0.03 1.67 -0.22 0.00 -0.60 0.00 0.00 56.93 57.81 2r5u s PHE 57 Cb 0.07 -3.16 -0.17 0.00 0.51 0.00 0.00 43.02 40.28 2r5u s PHE 57 CO 0.60 -0.18 1.29 -0.92 0.70 0.00 0.00 175.22 176.71 2r5u h TYR 58 N 6.25 0.28 -2.88 0.36 5.03 -1.91 -3.44 116.97 120.67 2r5u h TYR 58 Ca -0.42 -0.09 -0.56 0.00 2.58 0.00 0.00 58.73 60.24 2r5u h TYR 58 Cb 1.22 -0.06 -0.02 0.00 1.55 0.00 0.00 36.73 39.41 2r5u h TYR 58 CO 0.66 0.69 0.90 1.03 -1.32 0.00 0.00 178.16 180.12 2r5u s ARG 59 N -4.16 4.25 0.29 1.82 1.81 -1.26 -4.94 118.95 116.75 2r5u s ARG 59 Ca -0.15 1.82 0.03 0.00 -1.72 0.00 0.00 55.73 55.71 2r5u s ARG 59 Cb 0.04 -3.74 0.63 0.00 -0.45 0.00 0.00 34.95 31.42 2r5u s ARG 59 CO 0.73 -0.67 1.79 -1.35 -0.68 0.00 0.00 175.30 175.12 2r5u h PRO 60 N 8.29 0.77 -0.73 3.54 0.11 -1.99 -2.04 132.00 139.95 2r5u h PRO 60 Ca -0.32 -0.05 0.10 0.00 0.11 0.00 0.00 66.00 65.84 2r5u h PRO 60 Cb 1.14 -0.17 -0.07 0.00 0.11 0.00 0.00 31.00 32.00 2r5u h PRO 60 CO 0.94 0.51 0.36 0.00 -0.21 0.00 0.00 178.00 179.60 2r5u h ALA 61 N 1.59 1.01 -0.65 -0.75 0.00 -1.92 -1.34 119.26 117.20 2r5u h ALA 61 Ca 0.52 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.43 2r5u h ALA 61 Cb 0.71 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2r5u h ALA 61 CO -0.34 -0.05 0.16 0.45 0.00 0.00 0.00 179.25 179.46 2r5u h HIS 62 N 0.60 1.10 -0.51 0.00 3.86 -1.79 -1.67 115.15 116.74 2r5u h HIS 62 Ca 0.36 -0.13 0.07 0.00 -1.16 0.00 0.00 60.37 59.51 2r5u h HIS 62 Cb 0.40 -0.31 -0.06 0.00 1.06 0.00 0.00 27.41 28.51 2r5u h HIS 62 CO -0.11 0.91 0.20 1.96 0.86 0.00 0.00 177.93 181.75 2r5u h GLN 63 N 0.97 0.38 -0.34 2.45 4.20 -0.67 -0.79 115.11 121.31 2r5u h GLN 63 Ca 0.20 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.86 2r5u h GLN 63 Cb 0.37 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 2r5u h GLN 63 CO 0.00 0.25 0.07 -0.91 -0.67 0.00 0.00 178.83 177.58 2r5u h ASN 64 N 0.39 0.52 -0.53 1.46 2.35 -1.15 -1.31 115.58 117.32 2r5u h ASN 64 Ca 0.24 -0.24 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 2r5u h ASN 64 Cb 0.24 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 2r5u h ASN 64 CO -0.23 0.63 0.33 0.58 -1.65 0.00 0.00 177.43 177.09 2r5u h VAL 65 N 0.39 1.08 -0.22 2.81 2.07 -1.14 -1.31 116.25 119.93 2r5u h VAL 65 Ca 0.10 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.39 2r5u h VAL 65 Cb 0.32 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 2r5u h VAL 65 CO 0.00 0.12 0.13 0.22 0.02 0.00 0.00 177.57 178.06 2r5u h TYR 66 N 0.66 0.29 -0.68 1.57 3.20 -1.03 -1.49 116.97 119.49 2r5u h TYR 66 Ca 0.21 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.12 2r5u h TYR 66 Cb -0.01 -0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.11 2r5u h TYR 66 CO -0.05 0.24 0.41 -0.44 -1.64 0.00 0.00 178.16 176.67 2r5u h ASP 67 N 0.26 0.63 -0.29 -2.11 3.32 -1.00 -1.06 116.42 116.17 2r5u h ASP 67 Ca 0.08 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2r5u h ASP 67 Cb 0.04 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2r5u h ASP 67 CO -0.01 0.42 0.19 0.00 -1.72 0.00 0.00 179.24 178.12 2r5u h ALA 68 N 1.32 0.37 -0.39 3.45 0.00 -0.94 0.52 119.26 123.59 2r5u h ALA 68 Ca 0.29 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.19 2r5u h ALA 68 Cb 0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2r5u h ALA 68 CO -0.15 -0.15 0.23 0.82 0.00 0.00 0.00 179.25 180.01 2r5u h ILE 69 N 0.38 1.05 -0.14 0.00 2.04 -1.04 -1.97 117.51 117.83 2r5u h ILE 69 Ca 0.11 -0.16 -0.08 0.00 1.00 0.00 0.00 64.86 65.72 2r5u h ILE 69 Cb -0.02 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 2r5u h ILE 69 CO -0.02 0.09 -0.28 -0.07 0.00 0.00 0.00 178.15 177.86 2r5u h LEU 70 N 0.47 0.26 0.56 1.44 3.38 -0.95 0.12 115.31 120.59 2r5u h LEU 70 Ca 0.15 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 2r5u h LEU 70 Cb -0.00 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 40.68 2r5u h LEU 70 CO -0.07 0.54 -0.27 -0.78 0.09 0.00 0.00 178.44 177.96 2r5u h ASP 71 N 0.23 -0.64 -0.60 -0.43 3.58 -0.68 0.48 116.42 118.36 2r5u h ASP 71 Ca 0.04 -0.04 0.11 0.00 0.42 0.00 0.00 57.03 57.55 2r5u h ASP 71 Cb 0.62 0.17 -0.12 0.00 1.72 0.00 0.00 39.33 41.72 2r5u h ASP 71 CO 0.04 -0.28 -0.28 -0.07 -2.88 0.00 0.00 179.24 175.77 2r5u h LEU 72 N -1.04 -1.00 -0.62 2.28 3.38 -1.27 -2.45 115.31 114.60 2r5u h LEU 72 Ca -0.08 0.22 0.03 0.00 0.09 0.00 0.00 57.88 58.14 2r5u h LEU 72 Cb 0.64 0.52 -0.04 0.00 0.09 0.00 0.00 40.66 41.88 2r5u h LEU 72 CO 0.13 -0.28 0.38 0.22 0.09 0.00 0.00 178.44 178.97 2r5u h TYR 73 N -0.12 0.70 0.00 1.13 3.20 -0.71 -0.69 116.97 120.48 2r5u h TYR 73 Ca 0.26 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.15 2r5u h TYR 73 Cb 0.54 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.58 2r5u h TYR 73 CO -0.60 0.40 0.00 0.78 -1.64 0.00 0.00 178.16 177.09 2r5u h GLY 74 N 0.74 0.00 -2.77 1.82 0.00 -0.43 -1.21 103.07 101.21 2r5u h GLY 74 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 2r5u h GLY 74 CO -0.11 0.00 0.00 0.54 0.00 0.00 0.00 176.54 176.97 2r5u n ARG 75 N -3.07 3.30 -1.71 4.80 1.74 -0.93 -4.95 116.66 115.84 2r5u n ARG 75 Ca -0.01 -2.76 -0.16 0.00 -0.77 0.00 0.00 57.85 54.16 2r5u n ARG 75 Cb 0.21 -1.73 -0.05 0.00 -1.02 0.00 0.00 32.46 29.87 2r5u n ARG 75 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2r5u n GLY 76 N 1.23 1.04 3.81 -0.13 0.00 -0.46 -5.01 105.19 105.67 2r5u n GLY 76 Ca 0.24 -0.26 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 2r5u n GLY 76 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2r5u s GLU 77 N -3.77 3.88 0.05 1.61 2.56 -0.31 -5.01 118.70 117.70 2r5u s GLU 77 Ca 0.00 0.07 -0.37 0.00 0.00 0.00 0.00 54.97 54.66 2r5u s GLU 77 Cb 0.00 -3.29 -0.17 0.00 2.00 0.00 0.00 34.13 32.67 2r5u s GLU 77 CO 0.00 0.55 1.33 -2.30 -0.56 0.00 0.00 175.26 174.28 2r5u n PRO 78 N 2.56 0.97 -3.77 4.30 -0.02 -1.26 -3.81 135.00 133.96 2r5u n PRO 78 Ca -0.16 0.35 -0.34 0.00 -2.02 0.00 0.00 63.50 61.33 2r5u n PRO 78 Cb 0.53 -1.98 -0.10 0.00 -0.02 0.00 0.00 33.50 31.93 2r5u n PRO 78 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2r5u s ALA 79 N 0.60 3.65 0.51 3.55 0.00 -1.26 -4.77 121.76 124.04 2r5u s ALA 79 Ca 0.86 -3.42 0.02 0.00 0.00 0.00 0.00 51.96 49.42 2r5u s ALA 79 Cb -1.01 -2.53 -0.01 0.00 0.00 0.00 0.00 23.12 19.57 2r5u s ALA 79 CO 0.50 -2.10 0.08 0.16 0.00 0.00 0.00 175.76 174.39 2r5u s ASP 80 N 0.12 4.22 0.27 0.00 1.47 -1.26 -4.42 116.67 117.07 2r5u s ASP 80 Ca 0.19 -1.57 -0.03 0.00 1.18 0.00 0.00 52.55 52.33 2r5u s ASP 80 Cb -0.18 0.47 0.56 0.00 -0.34 0.00 0.00 42.92 43.43 2r5u s ASP 80 CO -0.05 -0.89 1.63 0.00 0.68 0.00 0.00 175.17 176.54 2r5u h ALA 81 N 1.25 0.99 0.17 2.11 0.00 -1.96 -0.19 119.26 121.63 2r5u h ALA 81 Ca -0.43 0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2r5u h ALA 81 Cb 1.31 0.40 0.00 0.00 0.00 0.00 0.00 17.79 19.51 2r5u h ALA 81 CO 0.71 -0.45 -0.08 0.28 0.00 0.00 0.00 179.25 179.71 2r5u h VAL 82 N 0.13 0.91 -0.23 0.00 2.07 -1.97 -2.44 116.25 114.73 2r5u h VAL 82 Ca 0.48 -1.01 -0.09 0.00 0.82 0.00 0.00 66.70 66.90 2r5u h VAL 82 Cb 0.91 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 32.13 2r5u h VAL 82 CO -0.69 0.21 -0.23 0.71 0.02 0.00 0.00 177.57 177.59 2r5u h THR 83 N -0.77 1.25 -0.49 2.57 1.35 -1.83 -2.11 112.91 112.88 2r5u h THR 83 Ca -0.02 -1.19 -0.12 0.00 -0.55 0.00 0.00 66.41 64.53 2r5u h THR 83 Cb 0.52 1.33 -0.01 0.00 -1.73 0.00 0.00 68.15 68.25 2r5u h THR 83 CO 0.04 0.38 -0.16 0.58 -0.25 0.00 0.00 175.52 176.10 2r5u h VAL 84 N 0.38 1.27 -0.76 6.82 2.07 -1.10 -1.87 116.25 123.07 2r5u h VAL 84 Ca 0.06 -1.32 0.05 0.00 0.82 0.00 0.00 66.70 66.31 2r5u h VAL 84 Cb 0.61 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 31.41 2r5u h VAL 84 CO 0.04 0.46 0.46 0.00 0.02 0.00 0.00 177.57 178.56 2r5u h ALA 85 N 0.88 1.01 -0.79 1.67 0.00 -1.11 0.38 119.26 121.31 2r5u h ALA 85 Ca 0.12 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2r5u h ALA 85 Cb 0.74 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 2r5u h ALA 85 CO 0.06 0.22 0.47 0.00 0.00 0.00 0.00 179.25 180.00 2r5u h ALA 86 N 1.35 1.00 -0.35 0.00 0.00 -1.25 0.31 119.26 120.32 2r5u h ALA 86 Ca 0.32 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 2r5u h ALA 86 Cb 0.10 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2r5u h ALA 86 CO -0.14 0.47 -0.35 1.49 0.00 0.00 0.00 179.25 180.71 2r5u h GLU 87 N 1.08 0.81 -0.47 0.00 4.57 -0.69 -2.35 114.58 117.52 2r5u h GLU 87 Ca 0.28 -0.40 -0.11 0.00 -1.18 0.00 0.00 59.36 57.95 2r5u h GLU 87 Cb -0.04 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.54 2r5u h GLU 87 CO -0.05 1.03 -0.15 -0.07 -1.18 0.00 0.00 179.01 178.59 2r5u h LEU 88 N 0.67 0.95 -0.51 1.64 3.38 -0.70 -2.76 115.31 117.98 2r5u h LEU 88 Ca 0.06 -0.37 0.07 0.00 0.09 0.00 0.00 57.88 57.72 2r5u h LEU 88 Cb 0.91 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 41.34 2r5u h LEU 88 CO 0.08 1.11 0.20 -0.78 0.09 0.00 0.00 178.44 179.14 2r5u h ASP 89 N 0.78 0.22 -0.53 -0.43 1.82 -0.87 0.15 116.42 117.56 2r5u h ASP 89 Ca 0.12 0.06 -0.01 0.00 -0.39 0.00 0.00 57.03 56.80 2r5u h ASP 89 Cb 0.71 0.03 -0.03 0.00 0.68 0.00 0.00 39.33 40.72 2r5u h ASP 89 CO 0.05 0.15 0.31 0.03 -1.61 0.00 0.00 179.24 178.17 2r5u h ARG 90 N 0.38 0.75 -0.00 0.28 3.08 -1.33 -1.17 114.38 116.37 2r5u h ARG 90 Ca 0.24 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2r5u h ARG 90 Cb 0.24 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.14 2r5u h ARG 90 CO -0.23 0.55 -0.01 0.54 -1.07 0.00 0.00 179.97 179.75 2r5u n ARG 91 N -4.40 0.56 -2.80 0.04 1.74 -0.92 -4.92 116.66 105.96 2r5u n ARG 91 Ca 0.05 -0.02 -0.07 0.00 -0.77 0.00 0.00 57.85 57.04 2r5u n ARG 91 Cb 0.09 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 30.06 2r5u n ARG 91 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2r5u n GLY 92 N 1.23 0.52 0.00 -0.13 0.00 -0.44 -4.98 105.19 101.40 2r5u n GLY 92 Ca 0.16 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2r5u n GLY 92 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2r5u n LEU 93 N -1.77 0.28 -0.13 0.99 4.77 -0.02 -4.80 117.00 116.32 2r5u n LEU 93 Ca 0.00 -0.39 -0.08 0.00 -0.03 0.00 0.00 56.01 55.51 2r5u n LEU 93 Cb 0.52 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.61 2r5u n LEU 93 CO 0.18 0.07 1.02 0.25 -1.33 0.00 0.00 177.39 177.58 2r5u h LEU 94 N 0.00 0.46 -0.58 2.23 5.85 -1.84 -0.94 115.31 120.50 2r5u h LEU 94 Ca 0.00 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 2r5u h LEU 94 Cb 0.14 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 2r5u h LEU 94 CO 0.00 0.36 0.28 0.03 -0.34 0.00 0.00 178.44 178.77 2r5u h ARG 95 N 0.52 0.84 -0.46 1.25 -0.00 -1.92 1.06 114.38 115.68 2r5u h ARG 95 Ca 0.14 -0.12 -0.00 0.00 -0.50 0.00 0.00 59.98 59.50 2r5u h ARG 95 Cb -0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 29.97 29.77 2r5u h ARG 95 CO -0.03 0.68 0.28 0.07 0.00 0.00 0.00 179.97 180.97 2r5u h ARG 96 N 0.79 0.62 0.00 0.04 -0.00 -1.73 -2.10 114.38 112.00 2r5u h ARG 96 Ca 0.20 -0.06 0.00 0.00 -0.00 0.00 0.00 59.98 60.12 2r5u h ARG 96 Cb 0.12 -0.13 0.00 0.00 -0.00 0.00 0.00 29.97 29.96 2r5u h ARG 96 CO -0.03 0.46 0.00 0.44 -0.00 0.00 0.00 179.97 180.84 2r5u n ILE 97 N -4.72 0.42 0.00 0.08 -6.64 -0.41 -4.87 119.36 103.21 2r5u n ILE 97 Ca 0.01 0.10 0.00 0.00 -1.77 0.00 0.00 62.75 61.10 2r5u n ILE 97 Cb 0.05 -0.74 0.00 0.00 -1.44 0.00 0.00 39.64 37.51 2r5u n ILE 97 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 2r5u n GLY 98 N 0.62 1.07 4.87 3.28 0.00 -0.79 -4.85 105.19 109.39 2r5u n GLY 98 Ca 0.08 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.13 2r5u n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r5u n GLY 99 N -1.33 -1.74 0.35 -0.02 0.00 0.37 -2.89 105.19 99.92 2r5u n GLY 99 Ca 0.00 -1.27 0.07 0.00 0.00 0.00 0.00 46.02 44.82 2r5u n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r5u h ALA 100 N -0.52 1.72 -0.73 4.61 0.00 -1.97 -1.78 119.26 120.59 2r5u h ALA 100 Ca 0.00 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.98 2r5u h ALA 100 Cb 0.21 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 17.74 2r5u h ALA 100 CO 0.00 0.17 0.39 -1.35 0.00 0.00 0.00 179.25 178.46 2r5u h PRO 101 N 0.73 0.65 -0.57 0.00 0.11 -1.99 -1.20 132.00 129.75 2r5u h PRO 101 Ca 0.31 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 66.28 2r5u h PRO 101 Cb 0.27 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.21 2r5u h PRO 101 CO -0.10 0.43 -0.03 -0.92 -0.21 0.00 0.00 178.00 177.17 2r5u h TYR 102 N 0.67 1.12 -0.56 0.65 5.03 -1.20 -1.79 116.97 120.88 2r5u h TYR 102 Ca 0.35 -0.20 0.00 0.00 2.58 0.00 0.00 58.73 61.46 2r5u h TYR 102 Cb 0.33 -0.29 -0.03 0.00 1.55 0.00 0.00 36.73 38.29 2r5u h TYR 102 CO -0.09 1.01 0.36 -0.07 -1.32 0.00 0.00 178.16 178.05 2r5u h LEU 103 N 0.90 0.66 -0.67 2.82 3.38 -1.15 -1.08 115.31 120.18 2r5u h LEU 103 Ca 0.16 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 2r5u h LEU 103 Cb 0.58 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 2r5u h LEU 103 CO 0.03 0.49 0.08 -0.74 0.09 0.00 0.00 178.44 178.40 2r5u h HIS 104 N 0.77 1.20 -0.37 1.13 2.76 -0.87 -2.11 115.15 117.66 2r5u h HIS 104 Ca 0.21 -0.18 0.03 0.00 -2.20 0.00 0.00 60.37 58.23 2r5u h HIS 104 Cb -0.06 -0.32 -0.03 0.00 1.55 0.00 0.00 27.41 28.55 2r5u h HIS 104 CO 0.00 1.01 0.18 1.15 -1.30 0.00 0.00 177.93 178.97 2r5u h THR 105 N 1.04 0.97 -0.39 6.26 2.02 -0.37 -0.25 112.91 122.18 2r5u h THR 105 Ca 0.20 -0.13 0.04 0.00 0.77 0.00 0.00 66.41 67.29 2r5u h THR 105 Cb 0.48 0.57 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 2r5u h THR 105 CO 0.02 0.07 0.15 -0.07 0.37 0.00 0.00 175.52 176.06 2r5u h LEU 106 N 0.37 0.19 -1.00 2.58 3.38 -0.97 -0.78 115.31 119.07 2r5u h LEU 106 Ca 0.16 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.09 2r5u h LEU 106 Cb 0.08 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2r5u h LEU 106 CO -0.12 0.14 -0.03 0.40 0.09 0.00 0.00 178.44 178.93 2r5u h ILE 107 N 0.32 1.23 -0.06 1.22 2.04 -1.10 -2.36 117.51 118.81 2r5u h ILE 107 Ca 0.17 -0.98 -0.10 0.00 1.00 0.00 0.00 64.86 64.95 2r5u h ILE 107 Cb 0.13 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 2r5u h ILE 107 CO -0.16 0.34 -0.44 0.28 0.00 0.00 0.00 178.15 178.17 2r5u h SER 108 N 0.64 0.13 -0.01 1.72 0.02 -0.63 -3.36 113.55 112.07 2r5u h SER 108 Ca 0.13 -0.06 -0.13 0.00 -0.84 0.00 0.00 61.79 60.89 2r5u h SER 108 Cb 0.45 -0.04 0.01 0.00 0.14 0.00 0.00 62.40 62.96 2r5u h SER 108 CO 0.02 0.56 -0.51 0.74 -1.14 0.00 0.00 176.83 176.50 2r5u h THR 109 N 0.10 1.45 -2.05 -2.27 2.02 -0.60 -3.45 112.91 108.10 2r5u h THR 109 Ca 0.01 -2.02 -0.62 0.00 0.77 0.00 0.00 66.41 64.55 2r5u h THR 109 Cb 0.82 2.59 0.03 0.00 -1.74 0.00 0.00 68.15 69.85 2r5u h THR 109 CO 0.06 0.58 0.97 0.55 0.37 0.00 0.00 175.52 178.05 2r5u n VAL 110 N -4.28 0.36 0.37 3.16 3.14 -1.16 -4.89 118.33 115.03 2r5u n VAL 110 Ca -0.10 -0.07 -0.18 0.00 -2.96 0.00 0.00 64.34 61.04 2r5u n VAL 110 Cb 0.63 -1.68 -0.09 0.00 -1.06 0.00 0.00 33.84 31.63 2r5u n VAL 110 CO 0.00 0.00 0.00 -0.65 -6.46 0.00 0.00 176.83 169.72 2r5u h PRO 111 N 7.89 -0.91 -3.29 1.45 0.11 -1.91 -3.44 132.00 131.89 2r5u h PRO 111 Ca -0.47 0.06 -0.31 0.00 0.11 0.00 0.00 66.00 65.39 2r5u h PRO 111 Cb 1.27 0.21 -0.36 0.00 0.11 0.00 0.00 31.00 32.23 2r5u h PRO 111 CO 0.92 -0.61 -0.69 0.99 -0.21 0.00 0.00 178.00 178.41 2r5u s THR 112 N -6.03 -0.13 0.26 -1.15 2.01 -1.26 -5.06 115.64 104.27 2r5u s THR 112 Ca -0.18 0.32 -0.00 0.00 0.31 0.00 0.00 61.69 62.14 2r5u s THR 112 Cb 0.04 -0.19 0.06 0.00 0.01 0.00 0.00 72.50 72.42 2r5u s THR 112 CO 0.62 0.13 1.70 0.00 -0.69 0.00 0.00 174.62 176.38 2r5u h ALA 113 N 7.94 1.03 0.00 7.40 0.00 -1.91 -2.50 119.26 131.23 2r5u h ALA 113 Ca -0.26 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.31 2r5u h ALA 113 Cb 1.12 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2r5u h ALA 113 CO 0.27 0.58 0.00 0.00 0.00 0.00 0.00 179.25 180.11 2r5u n ALA 114 N -2.49 1.22 0.21 0.00 0.00 -1.26 -2.03 120.51 116.16 2r5u n ALA 114 Ca 0.00 0.12 0.09 0.00 0.00 0.00 0.00 53.44 53.65 2r5u n ALA 114 Cb 0.40 -1.26 0.25 0.00 0.00 0.00 0.00 19.45 18.84 2r5u n ALA 114 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2r5u n ASN 115 N -2.04 3.02 -0.27 0.00 3.02 -0.94 -4.58 115.26 113.47 2r5u n ASN 115 Ca 0.00 -2.01 0.20 0.00 -0.03 0.00 0.00 54.58 52.74 2r5u n ASN 115 Cb 0.08 -0.38 0.51 0.00 -0.61 0.00 0.00 39.78 39.38 2r5u n ASN 115 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2r5u h ALA 116 N 4.02 2.21 -0.68 5.41 0.00 -1.55 0.10 119.26 128.77 2r5u h ALA 116 Ca 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2r5u h ALA 116 Cb 0.76 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 2r5u h ALA 116 CO 0.01 -0.53 0.33 0.78 0.00 0.00 0.00 179.25 179.84 2r5u h GLY 117 N 0.41 1.04 1.11 0.00 0.00 -1.84 0.94 103.07 104.73 2r5u h GLY 117 Ca 0.51 -0.49 -0.10 0.00 0.00 0.00 0.00 47.33 47.25 2r5u h GLY 117 CO -0.21 0.47 -0.02 -0.97 0.00 0.00 0.00 176.54 175.81 2r5u h TYR 118 N 0.96 1.15 -0.37 5.60 0.05 -1.16 -1.43 116.97 121.77 2r5u h TYR 118 Ca 0.24 -0.20 -0.10 0.00 0.05 0.00 0.00 58.73 58.71 2r5u h TYR 118 Cb 0.09 -0.30 -0.02 0.00 1.01 0.00 0.00 36.73 37.51 2r5u h TYR 118 CO 0.01 1.02 -0.19 1.88 -1.05 0.00 0.00 178.16 179.83 2r5u h TYR 119 N 0.96 0.79 -0.65 4.88 0.99 -0.99 -2.85 116.97 120.10 2r5u h TYR 119 Ca 0.17 -0.16 -0.04 0.00 2.00 0.00 0.00 58.73 60.70 2r5u h TYR 119 Cb 0.57 -0.19 -0.03 0.00 1.00 0.00 0.00 36.73 38.08 2r5u h TYR 119 CO 0.04 0.84 0.27 0.00 -0.00 0.00 0.00 178.16 179.31 2r5u h ALA 120 N 1.16 0.84 -0.72 3.88 0.00 -0.61 -1.91 119.26 121.90 2r5u h ALA 120 Ca 0.09 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 54.91 2r5u h ALA 120 Cb 0.67 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 2r5u h ALA 120 CO 0.05 0.45 0.40 0.77 0.00 0.00 0.00 179.25 180.91 2r5u h SER 121 N 0.91 0.56 -0.04 0.00 0.02 -1.13 0.96 113.55 114.83 2r5u h SER 121 Ca 0.22 0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.22 2r5u h SER 121 Cb 0.19 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 2r5u h SER 121 CO -0.02 0.34 -0.03 0.40 -1.14 0.00 0.00 176.83 176.39 2r5u h ILE 122 N 0.70 0.92 -0.81 3.27 2.04 -1.24 -0.51 117.51 121.87 2r5u h ILE 122 Ca 0.34 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.22 2r5u h ILE 122 Cb 0.28 0.92 -0.04 0.00 -0.74 0.00 0.00 36.82 37.23 2r5u h ILE 122 CO -0.22 0.00 0.52 0.58 0.00 0.00 0.00 178.15 179.03 2r5u h VAL 123 N -0.03 1.16 -0.36 1.67 2.07 -0.83 -1.54 116.25 118.39 2r5u h VAL 123 Ca 0.03 -0.36 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 2r5u h VAL 123 Cb 0.07 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 29.85 2r5u h VAL 123 CO -0.06 0.19 0.11 0.00 0.02 0.00 0.00 177.57 177.83 2r5u h ALA 124 N 1.32 0.47 -0.66 1.67 0.00 -0.54 -0.33 119.26 121.20 2r5u h ALA 124 Ca 0.31 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2r5u h ALA 124 Cb -0.05 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2r5u h ALA 124 CO -0.09 0.11 0.42 1.49 0.00 0.00 0.00 179.25 181.18 2r5u h GLU 125 N 0.43 0.87 -0.45 0.00 4.81 -0.89 -0.62 114.58 118.73 2r5u h GLU 125 Ca 0.12 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.22 2r5u h GLU 125 Cb 0.25 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 2r5u h GLU 125 CO -0.00 0.59 0.02 0.87 -0.73 0.00 0.00 179.01 179.76 2r5u h LYS 126 N 0.89 0.72 -0.64 1.92 1.79 -1.05 -2.12 116.57 118.08 2r5u h LYS 126 Ca 0.24 -0.17 -0.04 0.00 -2.18 0.00 0.00 60.65 58.50 2r5u h LYS 126 Cb -0.08 -0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 30.45 2r5u h LYS 126 CO -0.05 0.72 0.26 0.00 -1.08 0.00 0.00 179.45 179.30 2r5u h ALA 127 N 1.34 0.83 -0.06 3.86 0.00 -0.38 0.25 119.26 125.11 2r5u h ALA 127 Ca 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2r5u h ALA 127 Cb 0.39 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2r5u h ALA 127 CO 0.01 0.45 0.04 1.25 0.00 0.00 0.00 179.25 181.00 2r5u h LEU 128 N 0.90 0.07 -0.95 0.00 5.85 -0.88 -0.09 115.31 120.20 2r5u h LEU 128 Ca 0.21 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.97 2r5u h LEU 128 Cb 0.21 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.16 2r5u h LEU 128 CO -0.02 0.06 0.62 -0.07 -0.34 0.00 0.00 178.44 178.69 2r5u h LEU 129 N 0.07 1.01 -0.74 2.25 3.38 -1.19 -1.75 115.31 118.33 2r5u h LEU 129 Ca 0.02 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 2r5u h LEU 129 Cb 0.00 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2r5u h LEU 129 CO -0.00 0.67 -0.36 -0.09 0.09 0.00 0.00 178.44 178.74 2r5u h ARG 130 N 1.16 0.55 -0.03 1.13 2.43 -0.57 -2.17 114.38 116.88 2r5u h ARG 130 Ca 0.40 -0.26 -0.09 0.00 -0.81 0.00 0.00 59.98 59.22 2r5u h ARG 130 Cb 0.08 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 2r5u h ARG 130 CO -0.15 0.83 -0.40 0.00 -1.51 0.00 0.00 179.97 178.75 2r5u h ARG 131 N 0.46 0.07 -0.00 0.20 3.08 -0.57 -1.50 114.38 116.12 2r5u h ARG 131 Ca 0.05 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 2r5u h ARG 131 Cb 0.84 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.89 2r5u h ARG 131 CO 0.07 0.46 0.00 1.25 -1.07 0.00 0.00 179.97 180.69 2r5u h LEU 132 N 0.06 0.01 -0.34 3.04 5.85 -0.85 0.99 115.31 124.07 2r5u h LEU 132 Ca 0.00 -0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.66 2r5u h LEU 132 Cb 0.74 -0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.72 2r5u h LEU 132 CO 0.05 0.12 0.05 0.58 -0.34 0.00 0.00 178.44 178.91 2r5u h VAL 133 N -0.11 0.81 -0.71 1.05 2.07 -1.25 -0.54 116.25 117.57 2r5u h VAL 133 Ca 0.00 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 2r5u h VAL 133 Cb 0.12 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 2r5u h VAL 133 CO -0.00 0.03 0.42 -0.33 0.02 0.00 0.00 177.57 177.71 2r5u h GLU 134 N 0.17 0.97 -0.01 1.57 5.08 -1.21 -0.71 114.58 120.44 2r5u h GLU 134 Ca 0.16 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2r5u h GLU 134 Cb 0.19 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 2r5u h GLU 134 CO -0.23 0.70 0.00 0.00 -1.00 0.00 0.00 179.01 178.48 2r5u h ALA 135 N 1.22 0.01 -0.57 3.43 0.00 -0.58 -2.31 119.26 120.47 2r5u h ALA 135 Ca 0.25 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.13 2r5u h ALA 135 Cb -0.01 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 2r5u h ALA 135 CO -0.05 -0.41 0.31 0.78 0.00 0.00 0.00 179.25 179.88 2r5u h GLY 136 N -0.15 0.81 0.83 0.00 0.00 -0.97 -0.89 103.07 102.70 2r5u h GLY 136 Ca 0.00 -0.22 0.03 0.00 0.00 0.00 0.00 47.33 47.15 2r5u h GLY 136 CO -0.00 0.15 0.33 -0.84 0.00 0.00 0.00 176.54 176.17 2r5u h THR 137 N 0.59 1.04 0.00 4.70 2.02 -1.10 -1.69 112.91 118.46 2r5u h THR 137 Ca 0.25 -0.22 -0.14 0.00 0.77 0.00 0.00 66.41 67.06 2r5u h THR 137 Cb 0.13 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 2r5u h THR 137 CO -0.15 0.12 -0.68 0.08 0.37 0.00 0.00 175.52 175.25 2r5u h ARG 138 N 0.64 0.00 -0.67 6.66 0.11 -0.86 -2.08 114.38 118.18 2r5u h ARG 138 Ca 0.23 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.26 2r5u h ARG 138 Cb 0.05 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.10 2r5u h ARG 138 CO -0.11 0.68 0.20 -0.39 0.10 0.00 0.00 179.97 180.45 2r5u h VAL 139 N 0.00 1.25 -0.19 0.08 -1.51 -0.91 -0.60 116.25 114.37 2r5u h VAL 139 Ca -0.01 -0.87 0.04 0.00 -1.23 0.00 0.00 66.70 64.64 2r5u h VAL 139 Cb 1.27 0.51 -0.04 0.00 -2.13 0.00 0.00 31.29 30.90 2r5u h VAL 139 CO 0.09 0.34 -0.07 0.58 -1.23 0.00 0.00 177.57 177.27 2r5u h VAL 140 N 1.00 0.75 -0.92 7.19 2.07 -1.13 -0.72 116.25 124.49 2r5u h VAL 140 Ca 0.22 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.81 2r5u h VAL 140 Cb 0.29 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 30.75 2r5u h VAL 140 CO -0.01 0.00 0.60 1.56 0.02 0.00 0.00 177.57 179.74 2r5u h GLN 141 N -0.04 1.00 -0.21 1.57 7.50 -1.02 -1.66 115.11 122.25 2r5u h GLN 141 Ca 0.10 -0.06 -0.10 0.00 0.50 0.00 0.00 58.65 59.09 2r5u h GLN 141 Cb 0.19 -0.23 -0.01 0.00 0.05 0.00 0.00 27.48 27.48 2r5u h GLN 141 CO -0.22 0.66 -0.28 1.88 -1.50 0.00 0.00 178.83 179.37 2r5u h TYR 142 N 1.03 0.46 -0.40 2.96 0.05 -0.53 -2.47 116.97 118.07 2r5u h TYR 142 Ca 0.40 -0.10 -0.02 0.00 0.05 0.00 0.00 58.73 59.06 2r5u h TYR 142 Cb 0.22 -0.11 -0.02 0.00 1.01 0.00 0.00 36.73 37.83 2r5u h TYR 142 CO -0.00 0.66 0.16 0.78 -1.05 0.00 0.00 178.16 178.70 2r5u h GLY 143 N 1.04 0.64 2.00 3.88 0.00 -0.21 -2.82 103.07 107.60 2r5u h GLY 143 Ca 0.05 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.03 2r5u h GLY 143 CO 0.05 0.33 0.00 -1.72 0.00 0.00 0.00 176.54 175.20 2r5u n TYR 144 N -4.64 0.44 -3.49 5.60 4.01 -0.95 -4.66 117.16 113.46 2r5u n TYR 144 Ca -0.00 0.15 -0.33 0.00 -0.16 0.00 0.00 57.90 57.55 2r5u n TYR 144 Cb 0.15 -0.74 -0.05 0.00 -0.31 0.00 0.00 39.34 38.39 2r5u n TYR 144 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2r5u s ALA 145 N -3.10 3.65 0.00 -0.72 0.00 -0.94 -5.11 121.76 115.54 2r5u s ALA 145 Ca 0.09 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 51.73 2r5u s ALA 145 Cb 0.13 -2.35 0.00 0.00 0.00 0.00 0.00 23.12 20.89 2r5u s ALA 145 CO 0.46 0.54 0.00 0.41 0.00 0.00 0.00 175.76 177.17 2r5u n GLY 146 N 0.37 2.95 0.07 0.00 0.00 -1.26 -4.89 105.19 102.43 2r5u n GLY 146 Ca -0.03 -0.25 0.01 0.00 0.00 0.00 0.00 46.02 45.74 2r5u n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r5u n ALA 153 N 11.19 0.02 0.15 4.61 0.00 -1.26 -5.06 120.51 130.17 2r5u n ALA 153 Ca 0.00 0.01 0.02 0.00 0.00 0.00 0.00 53.44 53.47 2r5u n ALA 153 Cb 0.00 -0.01 0.36 0.00 0.00 0.00 0.00 19.45 19.80 2r5u n ALA 153 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2r5u h GLU 154 N 0.00 0.13 0.00 0.00 9.09 -2.03 -2.96 114.58 118.80 2r5u h GLU 154 Ca 0.01 -0.04 -0.23 0.00 0.05 0.00 0.00 59.36 59.15 2r5u h GLU 154 Cb 0.39 -0.01 -0.04 0.00 -1.65 0.00 0.00 28.75 27.44 2r5u h GLU 154 CO -0.00 0.39 -1.88 0.28 0.05 0.00 0.00 179.01 177.85 2r5u n VAL 155 N -4.18 0.89 -0.31 -1.06 0.31 -1.26 -4.23 118.33 108.50 2r5u n VAL 155 Ca -0.01 -0.35 0.14 0.00 -0.01 0.00 0.00 64.34 64.11 2r5u n VAL 155 Cb 0.35 -1.04 0.39 0.00 -0.91 0.00 0.00 33.84 32.63 2r5u n VAL 155 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 2r5u h VAL 156 N 0.00 0.73 0.07 2.52 -1.51 -1.95 -1.39 116.25 114.71 2r5u h VAL 156 Ca -0.35 -0.23 -0.00 0.00 -1.23 0.00 0.00 66.70 64.89 2r5u h VAL 156 Cb 1.55 0.02 0.00 0.00 -2.13 0.00 0.00 31.29 30.72 2r5u h VAL 156 CO -0.05 0.12 -0.03 -2.24 -1.23 0.00 0.00 177.57 174.14 2r5u h ASP 157 N 0.66 -0.08 -0.83 4.19 3.04 -1.74 -1.88 116.42 119.78 2r5u h ASP 157 Ca 0.52 -0.46 -0.00 0.00 -3.24 0.00 0.00 57.03 53.85 2r5u h ASP 157 Cb 0.94 0.02 -0.04 0.00 -1.04 0.00 0.00 39.33 39.21 2r5u h ASP 157 CO -0.28 0.45 0.52 0.08 -2.04 0.00 0.00 179.24 177.97 2r5u h ARG 158 N -0.63 1.12 -0.30 4.15 -0.00 -1.67 -1.00 114.38 116.06 2r5u h ARG 158 Ca -0.01 -0.09 -0.18 0.00 -0.00 0.00 0.00 59.98 59.71 2r5u h ARG 158 Cb 0.53 -0.24 -0.00 0.00 -0.00 0.00 0.00 29.97 30.26 2r5u h ARG 158 CO 0.01 0.77 -0.51 0.00 -0.00 0.00 0.00 179.97 180.25 2r5u h ALA 159 N 1.43 0.54 -0.37 0.08 0.00 -1.33 -2.48 119.26 117.13 2r5u h ALA 159 Ca 0.30 -0.50 0.02 0.00 0.00 0.00 0.00 54.91 54.74 2r5u h ALA 159 Cb -0.08 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 2r5u h ALA 159 CO -0.06 0.68 0.19 0.37 0.00 0.00 0.00 179.25 180.43 2r5u h GLN 160 N 0.65 0.38 -0.50 0.00 4.15 -0.88 -2.78 115.11 116.14 2r5u h GLN 160 Ca 0.03 -0.02 0.06 0.00 0.77 0.00 0.00 58.65 59.48 2r5u h GLN 160 Cb 1.10 -0.09 -0.05 0.00 0.21 0.00 0.00 27.48 28.65 2r5u h GLN 160 CO 0.11 0.25 0.22 0.00 -1.93 0.00 0.00 178.83 177.48 2r5u h ALA 161 N 1.18 0.63 -0.73 3.38 0.00 -1.13 -2.97 119.26 119.61 2r5u h ALA 161 Ca 0.15 0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.21 2r5u h ALA 161 Cb 0.05 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 2r5u h ALA 161 CO -0.10 -0.16 0.48 0.93 0.00 0.00 0.00 179.25 180.41 2r5u h GLU 162 N 0.42 0.55 0.00 0.00 4.39 -1.15 -0.86 114.58 117.93 2r5u h GLU 162 Ca 0.23 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.90 2r5u h GLU 162 Cb 0.19 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 2r5u h GLU 162 CO -0.20 0.36 -1.77 1.51 -1.16 0.00 0.00 179.01 177.76 2r5u n ILE 163 N -4.49 0.13 0.34 3.13 0.13 -1.13 -3.60 119.36 113.87 2r5u n ILE 163 Ca 0.13 -0.50 0.12 0.00 -1.10 0.00 0.00 62.75 61.40 2r5u n ILE 163 Cb 0.39 -0.06 0.19 0.00 -0.84 0.00 0.00 39.64 39.32 2r5u n ILE 163 CO 0.00 0.00 0.00 1.88 2.80 0.00 0.00 176.55 181.23 2r5u h TYR 164 N 0.00 0.00 0.00 9.51 -1.99 -1.45 -3.28 116.97 119.76 2r5u h TYR 164 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2r5u h TYR 164 Cb 0.99 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.72 2r5u h TYR 164 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 178.16 174.69 2r5u n ASP 165 N -2.68 0.44 0.00 3.88 2.03 -0.34 -5.11 116.55 114.77 2r5u n ASP 165 Ca 0.03 0.57 0.03 0.00 0.52 0.00 0.00 54.79 55.94 2r5u n ASP 165 Cb 0.50 -0.68 0.16 0.00 -0.72 0.00 0.00 41.12 40.38 2r5u n ASP 165 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80