#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 1.41 -1.63 -1.09 -0.02 -1.26 -4.88 135.00 127.54 2r5u n PRO 24 Ca 0.00 0.53 -0.52 0.00 -2.02 0.00 0.00 63.50 61.49 2r5u n PRO 24 Cb 0.00 -2.53 -0.06 0.00 -0.02 0.00 0.00 33.50 30.90 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 -1.34 1.36 -3.46 0.52 -0.02 -1.26 -4.96 135.00 125.85 2r5u n PRO 25 Ca 0.13 0.49 -0.10 0.00 -2.02 0.00 0.00 63.50 62.00 2r5u n PRO 25 Cb 0.46 -2.17 -0.02 0.00 -0.02 0.00 0.00 33.50 31.74 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 1.24 1.05 -0.34 -0.52 -2.07 -1.26 -4.62 119.66 113.14 2r5u s GLN 26 Ca 0.86 -0.38 0.01 0.00 -1.82 0.00 0.00 55.36 54.03 2r5u s GLN 26 Cb -0.92 0.48 0.14 0.00 -1.09 0.00 0.00 33.01 31.63 2r5u s GLN 26 CO 0.49 -0.46 0.29 0.34 -1.32 0.00 0.00 175.29 174.63 2r5u s ASP 27 N -2.60 1.98 0.25 12.60 -1.08 -1.26 -5.02 116.67 121.54 2r5u s ASP 27 Ca 0.03 -1.52 -0.04 0.00 -0.52 0.00 0.00 52.55 50.50 2r5u s ASP 27 Cb -0.01 0.21 0.30 0.00 -1.46 0.00 0.00 42.92 41.96 2r5u s ASP 27 CO -0.11 -0.32 1.81 -0.07 0.52 0.00 0.00 175.17 177.00 2r5u h LEU 28 N 7.47 0.93 -0.33 -1.34 -0.00 -1.99 -1.66 115.31 118.38 2r5u h LEU 28 Ca -0.02 -0.15 -0.00 0.00 -0.00 0.00 0.00 57.88 57.71 2r5u h LEU 28 Cb 1.03 -0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 41.44 2r5u h LEU 28 CO 0.27 0.85 0.20 0.00 -0.00 0.00 0.00 178.44 179.76 2r5u h ALA 29 N 1.28 0.42 -0.35 1.53 0.00 -2.00 -1.69 119.26 118.45 2r5u h ALA 29 Ca 0.22 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2r5u h ALA 29 Cb 0.24 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2r5u h ALA 29 CO -0.01 -0.08 -0.09 0.00 0.00 0.00 0.00 179.25 179.07 2r5u h ALA 30 N 1.08 1.20 -0.56 0.00 0.00 -1.86 -1.97 119.26 117.16 2r5u h ALA 30 Ca 0.12 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.77 2r5u h ALA 30 Cb 0.01 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2r5u h ALA 30 CO -0.02 0.52 0.37 0.93 0.00 0.00 0.00 179.25 181.04 2r5u h GLU 31 N 0.54 0.72 -0.21 0.00 5.08 -0.98 -1.36 114.58 118.38 2r5u h GLU 31 Ca 0.10 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2r5u h GLU 31 Cb 0.48 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2r5u h GLU 31 CO 0.03 0.48 0.12 1.96 -1.00 0.00 0.00 179.01 180.60 2r5u h GLN 32 N 0.75 0.29 -0.82 2.33 4.20 -0.97 -2.29 115.11 118.59 2r5u h GLN 32 Ca 0.21 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.88 2r5u h GLN 32 Cb -0.08 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.60 2r5u h GLN 32 CO -0.05 0.25 0.50 0.77 -0.67 0.00 0.00 178.83 179.63 2r5u h SER 33 N 0.24 0.99 -0.20 1.46 0.02 -1.24 -0.22 113.55 114.60 2r5u h SER 33 Ca 0.07 -0.07 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 2r5u h SER 33 Cb 0.05 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.31 2r5u h SER 33 CO -0.01 0.77 0.03 0.58 -1.14 0.00 0.00 176.83 177.05 2r5u h VAL 34 N 1.13 0.90 -0.53 2.27 2.07 -1.17 -1.13 116.25 119.80 2r5u h VAL 34 Ca 0.30 -0.04 -0.12 0.00 0.82 0.00 0.00 66.70 67.66 2r5u h VAL 34 Cb -0.04 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 2r5u h VAL 34 CO -0.06 0.02 -0.14 -0.07 0.02 0.00 0.00 177.57 177.35 2r5u h LEU 35 N 0.11 1.04 -0.42 2.57 3.38 -1.04 -1.93 115.31 119.03 2r5u h LEU 35 Ca 0.09 -0.36 0.01 0.00 0.09 0.00 0.00 57.88 57.71 2r5u h LEU 35 Cb 0.09 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2r5u h LEU 35 CO -0.13 1.16 0.27 1.23 0.09 0.00 0.00 178.44 181.07 2r5u h GLY 36 N 0.92 0.58 0.99 0.83 0.00 -0.97 -2.28 103.07 103.14 2r5u h GLY 36 Ca 0.13 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2r5u h GLY 36 CO 0.05 0.21 0.08 -1.33 0.00 0.00 0.00 176.54 175.55 2r5u h GLY 37 N 0.56 0.17 0.59 4.60 0.00 -1.04 -2.84 103.07 105.12 2r5u h GLY 37 Ca 0.15 -0.07 0.10 0.00 0.00 0.00 0.00 47.33 47.52 2r5u h GLY 37 CO -0.04 0.07 0.63 -0.33 0.00 0.00 0.00 176.54 176.87 2r5u h MET 38 N 0.15 0.99 0.00 4.80 2.07 -1.28 -2.06 114.93 119.60 2r5u h MET 38 Ca 0.04 -0.06 0.00 0.00 -2.07 0.00 0.00 59.70 57.62 2r5u h MET 38 Cb -0.00 -0.22 0.00 0.00 -1.87 0.00 0.00 31.60 29.51 2r5u h MET 38 CO -0.01 0.65 0.00 -0.07 1.07 0.00 0.00 176.91 178.55 2r5u h LEU 39 N 1.02 0.00 0.00 1.22 3.38 -1.17 -3.18 115.31 116.57 2r5u h LEU 39 Ca 0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.43 2r5u h LEU 39 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2r5u h LEU 39 CO -0.22 0.00 -1.70 0.18 0.09 0.00 0.00 178.44 176.79 2r5u n LEU 40 N -2.70 0.25 -3.65 1.67 4.77 -0.81 -4.49 117.00 112.05 2r5u n LEU 40 Ca 0.01 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.93 2r5u n LEU 40 Cb 0.28 -0.02 -0.07 0.00 -2.33 0.00 0.00 43.42 41.28 2r5u n LEU 40 CO 0.24 -0.00 0.27 -0.55 -1.33 0.00 0.00 177.39 176.02 2r5u s SER 41 N -4.47 -0.88 0.30 -1.43 0.15 -1.02 -4.98 113.70 101.36 2r5u s SER 41 Ca -0.05 1.41 0.00 0.00 0.70 0.00 0.00 55.95 58.01 2r5u s SER 41 Cb 0.14 1.43 0.45 0.00 -1.71 0.00 0.00 66.02 66.33 2r5u s SER 41 CO 0.88 -0.23 1.84 0.50 1.20 0.00 0.00 173.24 177.44 2r5u h LYS 42 N 7.23 0.76 -0.59 5.44 3.64 -1.89 -2.58 116.57 128.58 2r5u h LYS 42 Ca -0.29 -0.15 0.05 0.00 -1.27 0.00 0.00 60.65 58.99 2r5u h LYS 42 Cb 1.20 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.87 2r5u h LYS 42 CO 0.17 0.69 0.39 -0.44 -2.27 0.00 0.00 179.45 178.00 2r5u h ASP 43 N 0.73 0.54 -0.40 4.20 3.32 -1.95 -2.41 116.42 120.45 2r5u h ASP 43 Ca 0.16 -0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.06 2r5u h ASP 43 Cb 0.29 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2r5u h ASP 43 CO -0.00 0.36 -0.32 0.00 -1.72 0.00 0.00 179.24 177.57 2r5u h ALA 44 N 1.67 0.58 -0.31 3.45 0.00 -1.76 -2.31 119.26 120.58 2r5u h ALA 44 Ca 0.25 -0.43 0.05 0.00 0.00 0.00 0.00 54.91 54.78 2r5u h ALA 44 Cb 0.19 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 2r5u h ALA 44 CO -0.07 0.64 0.03 0.82 0.00 0.00 0.00 179.25 180.67 2r5u h ILE 45 N 0.75 0.81 -0.61 0.00 2.04 -1.21 -1.13 117.51 118.16 2r5u h ILE 45 Ca 0.07 -0.04 0.03 0.00 1.00 0.00 0.00 64.86 65.92 2r5u h ILE 45 Cb 0.91 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 37.61 2r5u h ILE 45 CO 0.08 0.02 0.37 0.00 0.00 0.00 0.00 178.15 178.63 2r5u h ALA 46 N 1.25 0.78 -0.52 1.87 0.00 -1.35 -0.67 119.26 120.62 2r5u h ALA 46 Ca 0.15 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.07 2r5u h ALA 46 Cb 0.18 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 2r5u h ALA 46 CO -0.22 0.11 0.30 -0.44 0.00 0.00 0.00 179.25 179.01 2r5u h ASP 47 N 0.73 0.48 -0.49 0.00 3.32 -1.09 -2.97 116.42 116.40 2r5u h ASP 47 Ca 0.24 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.25 2r5u h ASP 47 Cb 0.02 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2r5u h ASP 47 CO -0.10 0.34 0.12 0.58 -1.72 0.00 0.00 179.24 178.46 2r5u h VAL 48 N 0.60 1.24 -0.28 -1.35 2.07 -0.66 -2.94 116.25 114.94 2r5u h VAL 48 Ca 0.21 -0.84 0.04 0.00 0.82 0.00 0.00 66.70 66.93 2r5u h VAL 48 Cb 0.04 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 2r5u h VAL 48 CO -0.11 0.30 0.19 -0.07 0.02 0.00 0.00 177.57 177.91 2r5u h LEU 49 N 0.68 0.19 -2.02 2.57 3.38 -1.04 -0.39 115.31 118.68 2r5u h LEU 49 Ca 0.15 -0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.23 2r5u h LEU 49 Cb 0.33 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2r5u h LEU 49 CO 0.00 0.13 0.27 -0.33 0.09 0.00 0.00 178.44 178.60 2r5u h GLU 50 N 0.22 0.00 0.00 1.13 4.39 -1.36 -3.32 114.58 115.65 2r5u h GLU 50 Ca 0.12 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.63 2r5u h GLU 50 Cb 0.19 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.81 2r5u h GLU 50 CO -0.02 0.00 -1.69 0.54 -1.16 0.00 0.00 179.01 176.67 2r5u n ARG 51 N -4.36 1.65 -3.96 2.33 1.74 -0.29 -5.04 116.66 108.73 2r5u n ARG 51 Ca 0.06 0.02 -0.30 0.00 -0.77 0.00 0.00 57.85 56.87 2r5u n ARG 51 Cb 0.45 -1.25 -0.04 0.00 -1.02 0.00 0.00 32.46 30.60 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 -5.09 4.23 0.23 0.55 1.43 -0.41 -4.84 118.68 114.78 2r5u s LEU 52 Ca -0.09 0.18 0.10 0.00 -1.03 0.00 0.00 54.13 53.29 2r5u s LEU 52 Cb 0.03 -2.84 -0.05 0.00 0.03 0.00 0.00 46.19 43.37 2r5u s LEU 52 CO 0.36 0.14 -0.19 -0.13 0.23 0.00 0.00 176.35 176.76 2r5u s ARG 53 N -2.69 1.50 0.22 1.70 1.81 -1.26 -4.78 118.95 115.45 2r5u s ARG 53 Ca 0.34 -1.62 -0.31 0.00 -1.72 0.00 0.00 55.73 52.42 2r5u s ARG 53 Cb -0.12 -1.57 -0.15 0.00 -0.45 0.00 0.00 34.95 32.66 2r5u s ARG 53 CO 0.27 0.30 1.08 -0.35 -0.68 0.00 0.00 175.30 175.92 2r5u n PRO 54 N -0.25 1.20 -0.12 3.54 -0.04 -1.26 -2.50 135.00 135.58 2r5u n PRO 54 Ca -0.08 0.42 0.00 0.00 -0.04 0.00 0.00 63.50 63.80 2r5u n PRO 54 Cb 0.59 -1.86 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 2r5u n PRO 54 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2r5u n GLY 55 N 1.73 0.89 0.28 0.55 0.00 -1.26 -4.95 105.19 102.44 2r5u n GLY 55 Ca 0.13 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.32 2r5u n GLY 55 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2r5u h ASP 56 N 0.00 0.00 -3.39 1.61 3.32 -1.89 -3.43 116.42 112.64 2r5u h ASP 56 Ca 0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 2r5u h ASP 56 Cb 0.00 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 2r5u h ASP 56 CO 0.00 0.01 0.22 -0.36 -1.72 0.00 0.00 179.24 177.39 2r5u s PHE 57 N -3.71 3.62 0.03 4.55 0.40 -1.26 -4.57 117.98 117.04 2r5u s PHE 57 Ca 0.01 1.47 -0.22 0.00 -0.60 0.00 0.00 56.93 57.58 2r5u s PHE 57 Cb 0.09 -2.95 -0.15 0.00 0.51 0.00 0.00 43.02 40.52 2r5u s PHE 57 CO 0.54 0.05 1.41 -0.92 0.70 0.00 0.00 175.22 177.00 2r5u h TYR 58 N 6.73 0.21 -3.15 0.36 5.03 -1.94 -3.44 116.97 120.78 2r5u h TYR 58 Ca -0.41 -0.05 -0.56 0.00 2.58 0.00 0.00 58.73 60.29 2r5u h TYR 58 Cb 1.21 -0.05 -0.04 0.00 1.55 0.00 0.00 36.73 39.40 2r5u h TYR 58 CO 0.66 0.51 0.69 0.50 -1.32 0.00 0.00 178.16 179.19 2r5u s ARG 59 N -4.71 4.35 0.25 1.82 3.52 -1.26 -4.95 118.95 117.97 2r5u s ARG 59 Ca -0.15 1.46 -0.03 0.00 -0.13 0.00 0.00 55.73 56.89 2r5u s ARG 59 Cb 0.04 -3.59 0.50 0.00 -1.56 0.00 0.00 34.95 30.34 2r5u s ARG 59 CO 0.71 -0.46 1.75 -1.35 -0.81 0.00 0.00 175.30 175.13 2r5u h PRO 60 N 7.36 0.52 -1.00 5.12 0.11 -2.00 -1.49 132.00 140.63 2r5u h PRO 60 Ca -0.28 -0.03 0.10 0.00 0.11 0.00 0.00 66.00 65.89 2r5u h PRO 60 Cb 1.12 -0.12 -0.08 0.00 0.11 0.00 0.00 31.00 32.04 2r5u h PRO 60 CO 0.90 0.35 0.63 0.00 -0.21 0.00 0.00 178.00 179.67 2r5u h ALA 61 N 1.55 1.45 -0.43 -0.75 0.00 -1.95 -1.47 119.26 117.66 2r5u h ALA 61 Ca 0.44 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.25 2r5u h ALA 61 Cb 0.64 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2r5u h ALA 61 CO -0.38 0.32 -0.13 0.45 0.00 0.00 0.00 179.25 179.51 2r5u h HIS 62 N 1.07 0.96 -0.91 0.00 3.86 -1.70 -2.01 115.15 116.42 2r5u h HIS 62 Ca 0.46 -0.21 0.01 0.00 -1.16 0.00 0.00 60.37 59.47 2r5u h HIS 62 Cb 0.34 -0.23 -0.05 0.00 1.06 0.00 0.00 27.41 28.54 2r5u h HIS 62 CO -0.01 0.97 0.60 0.37 0.86 0.00 0.00 177.93 180.73 2r5u h GLN 63 N 0.67 1.20 -0.35 2.45 5.75 -0.95 -1.08 115.11 122.80 2r5u h GLN 63 Ca 0.11 -0.07 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 2r5u h GLN 63 Cb 0.68 -0.27 -0.02 0.00 1.07 0.00 0.00 27.48 28.94 2r5u h GLN 63 CO 0.05 0.79 0.21 -0.91 -2.65 0.00 0.00 178.83 176.32 2r5u h ASN 64 N 1.23 0.42 -0.04 -0.69 2.35 -1.10 0.21 115.58 117.96 2r5u h ASN 64 Ca 0.33 -0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 56.03 2r5u h ASN 64 Cb -0.14 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 38.12 2r5u h ASN 64 CO -0.07 0.35 0.02 0.58 -1.65 0.00 0.00 177.43 176.65 2r5u h VAL 65 N 0.45 1.12 -0.45 2.81 2.07 -1.09 -1.57 116.25 119.60 2r5u h VAL 65 Ca 0.13 -0.35 0.06 0.00 0.82 0.00 0.00 66.70 67.36 2r5u h VAL 65 Cb 0.00 1.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.00 2r5u h VAL 65 CO -0.02 0.10 0.13 0.22 0.02 0.00 0.00 177.57 178.01 2r5u h TYR 66 N -0.07 0.23 -0.83 1.57 3.20 -1.03 -1.41 116.97 118.63 2r5u h TYR 66 Ca 0.01 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 2r5u h TYR 66 Cb 0.14 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.34 2r5u h TYR 66 CO -0.03 0.06 0.39 -0.44 -1.64 0.00 0.00 178.16 176.50 2r5u h ASP 67 N 0.28 1.09 -0.46 -2.11 3.32 -0.81 -0.89 116.42 116.85 2r5u h ASP 67 Ca 0.22 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 2r5u h ASP 67 Cb 0.24 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 2r5u h ASP 67 CO -0.25 0.93 0.19 0.00 -1.72 0.00 0.00 179.24 178.39 2r5u h ALA 68 N 1.24 0.59 -0.18 3.45 0.00 -0.80 0.26 119.26 123.81 2r5u h ALA 68 Ca 0.28 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2r5u h ALA 68 Cb 0.13 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2r5u h ALA 68 CO -0.03 0.20 0.12 0.82 0.00 0.00 0.00 179.25 180.35 2r5u h ILE 69 N 0.60 1.06 -0.72 0.00 2.04 -0.95 -2.21 117.51 117.32 2r5u h ILE 69 Ca 0.15 -0.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.88 2r5u h ILE 69 Cb 0.18 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 2r5u h ILE 69 CO -0.01 0.05 0.36 -0.07 0.00 0.00 0.00 178.15 178.48 2r5u h LEU 70 N 0.24 0.92 -0.30 1.44 3.38 -1.04 0.10 115.31 120.05 2r5u h LEU 70 Ca 0.07 -0.09 0.05 0.00 0.09 0.00 0.00 57.88 58.00 2r5u h LEU 70 Cb -0.02 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.45 2r5u h LEU 70 CO -0.01 0.77 -0.02 0.44 0.09 0.00 0.00 178.44 179.71 2r5u h ASP 71 N 1.02 -0.15 -0.09 -0.43 5.19 -0.64 -0.15 116.42 121.16 2r5u h ASP 71 Ca 0.25 0.07 -0.01 0.00 -0.62 0.00 0.00 57.03 56.73 2r5u h ASP 71 Cb 0.08 0.13 -0.00 0.00 0.18 0.00 0.00 39.33 39.72 2r5u h ASP 71 CO -0.04 -0.04 0.02 -0.07 -3.12 0.00 0.00 179.24 176.00 2r5u h LEU 72 N 0.07 0.13 -0.80 1.55 3.38 -1.00 -3.02 115.31 115.62 2r5u h LEU 72 Ca 0.14 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2r5u h LEU 72 Cb 0.20 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2r5u h LEU 72 CO -0.25 0.32 0.50 0.22 0.09 0.00 0.00 178.44 179.32 2r5u h TYR 73 N -0.06 1.03 0.00 1.13 3.20 -0.86 -1.07 116.97 120.35 2r5u h TYR 73 Ca 0.03 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.91 2r5u h TYR 73 Cb 0.23 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.16 2r5u h TYR 73 CO 0.00 0.67 0.00 0.78 -1.64 0.00 0.00 178.16 177.98 2r5u h GLY 74 N 1.09 0.00 -1.81 1.82 0.00 -1.03 -1.90 103.07 101.24 2r5u h GLY 74 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.62 2r5u h GLY 74 CO -0.06 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.02 2r5u n ARG 75 N -2.85 2.27 -1.38 4.80 1.74 -0.61 -4.95 116.66 115.67 2r5u n ARG 75 Ca -0.01 -1.88 -0.11 0.00 -0.77 0.00 0.00 57.85 55.08 2r5u n ARG 75 Cb 0.16 -1.48 -0.04 0.00 -1.02 0.00 0.00 32.46 30.09 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 1.37 1.11 3.91 -0.13 0.00 -0.71 -5.03 105.19 105.71 2r5u n GLY 76 Ca 0.16 -0.53 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 2r5u n GLY 76 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2r5u s GLU 77 N -3.04 3.44 0.54 1.61 2.02 -0.51 -5.02 118.70 117.75 2r5u s GLU 77 Ca 0.00 -0.38 -0.19 0.00 0.02 0.00 0.00 54.97 54.42 2r5u s GLU 77 Cb 0.00 -3.07 -0.06 0.00 0.10 0.00 0.00 34.13 31.10 2r5u s GLU 77 CO 0.00 0.64 1.10 -1.25 0.02 0.00 0.00 175.26 175.77 2r5u s PRO 78 N -2.24 3.46 -0.52 0.39 0.04 -1.26 -3.72 135.00 131.14 2r5u s PRO 78 Ca 0.31 1.50 0.02 0.00 0.04 0.00 0.00 61.00 62.88 2r5u s PRO 78 Cb -0.13 -2.03 0.13 0.00 0.04 0.00 0.00 34.50 32.51 2r5u s PRO 78 CO 0.24 -0.74 0.28 0.00 0.04 0.00 0.00 177.00 176.81 2r5u s ALA 79 N -1.91 3.33 0.42 8.56 0.00 -1.26 -4.79 121.76 126.11 2r5u s ALA 79 Ca 0.70 -3.20 0.00 0.00 0.00 0.00 0.00 51.96 49.46 2r5u s ALA 79 Cb -0.21 -2.25 0.00 0.00 0.00 0.00 0.00 23.12 20.66 2r5u s ALA 79 CO 0.26 -2.01 0.01 -0.40 0.00 0.00 0.00 175.76 173.63 2r5u n ASP 80 N 3.30 3.13 -0.35 0.00 5.68 -1.26 -4.49 116.55 122.55 2r5u n ASP 80 Ca 0.05 -2.81 0.09 0.00 -0.50 0.00 0.00 54.79 51.62 2r5u n ASP 80 Cb 0.34 0.28 0.27 0.00 -1.14 0.00 0.00 41.12 40.87 2r5u n ASP 80 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2r5u h ALA 81 N 1.19 1.59 0.05 2.12 0.00 -1.96 -1.33 119.26 120.91 2r5u h ALA 81 Ca -0.34 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 2r5u h ALA 81 Cb 1.04 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2r5u h ALA 81 CO 0.57 0.14 -0.02 0.28 0.00 0.00 0.00 179.25 180.21 2r5u h VAL 82 N 0.92 1.28 0.00 0.00 2.07 -1.99 -2.44 116.25 116.09 2r5u h VAL 82 Ca 0.51 -1.21 -0.11 0.00 0.82 0.00 0.00 66.70 66.71 2r5u h VAL 82 Cb 0.60 2.06 -0.02 0.00 -1.52 0.00 0.00 31.29 32.42 2r5u h VAL 82 CO -0.28 0.30 -0.53 0.71 0.02 0.00 0.00 177.57 177.79 2r5u h THR 83 N -0.61 1.38 -0.00 2.57 1.35 -1.82 -2.63 112.91 113.14 2r5u h THR 83 Ca -0.01 -1.83 -0.16 0.00 -0.55 0.00 0.00 66.41 63.86 2r5u h THR 83 Cb 0.54 1.99 0.01 0.00 -1.73 0.00 0.00 68.15 68.96 2r5u h THR 83 CO 0.01 0.52 -0.64 0.58 -0.25 0.00 0.00 175.52 175.75 2r5u h VAL 84 N 0.00 1.41 -0.76 6.82 2.07 -1.35 -1.83 116.25 122.61 2r5u h VAL 84 Ca -0.01 -2.09 0.08 0.00 0.82 0.00 0.00 66.70 65.50 2r5u h VAL 84 Cb 0.95 2.57 -0.05 0.00 -1.52 0.00 0.00 31.29 33.23 2r5u h VAL 84 CO 0.07 0.61 0.50 0.00 0.02 0.00 0.00 177.57 178.77 2r5u h ALA 85 N 0.33 1.72 -0.15 1.67 0.00 -1.41 0.53 119.26 121.94 2r5u h ALA 85 Ca -0.08 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.59 2r5u h ALA 85 Cb 1.34 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.95 2r5u h ALA 85 CO 0.13 0.15 -0.78 0.00 0.00 0.00 0.00 179.25 178.75 2r5u h ALA 86 N 1.60 0.33 -0.47 0.00 0.00 -1.47 0.07 119.26 119.32 2r5u h ALA 86 Ca 0.34 -0.60 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 2r5u h ALA 86 Cb 0.33 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2r5u h ALA 86 CO -0.12 0.69 0.22 1.49 0.00 0.00 0.00 179.25 181.53 2r5u h GLU 87 N 0.53 0.68 -0.48 0.00 4.57 -0.90 -0.65 114.58 118.32 2r5u h GLU 87 Ca -0.05 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 58.03 2r5u h GLU 87 Cb 1.40 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.85 2r5u h GLU 87 CO 0.16 0.58 0.31 -0.07 -1.18 0.00 0.00 179.01 178.81 2r5u h LEU 88 N 0.62 0.57 -0.90 1.64 3.38 -0.90 -2.63 115.31 117.09 2r5u h LEU 88 Ca 0.16 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.12 2r5u h LEU 88 Cb 0.13 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 2r5u h LEU 88 CO -0.02 0.43 0.59 -0.78 0.09 0.00 0.00 178.44 178.75 2r5u h ASP 89 N 0.65 1.00 -0.44 -0.43 3.58 -0.84 -0.46 116.42 119.47 2r5u h ASP 89 Ca 0.18 -0.02 0.03 0.00 0.42 0.00 0.00 57.03 57.64 2r5u h ASP 89 Cb -0.04 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 40.75 2r5u h ASP 89 CO -0.04 0.70 0.30 0.03 -2.88 0.00 0.00 179.24 177.35 2r5u h ARG 90 N 1.17 0.46 -0.01 0.28 3.08 -0.92 -1.78 114.38 116.67 2r5u h ARG 90 Ca 0.34 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.37 2r5u h ARG 90 Cb -0.06 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 29.88 2r5u h ARG 90 CO -0.10 0.31 -0.02 0.54 -1.07 0.00 0.00 179.97 179.63 2r5u n ARG 91 N -4.48 1.18 -1.25 0.04 1.74 -0.66 -4.91 116.66 108.33 2r5u n ARG 91 Ca 0.05 -0.40 -0.09 0.00 -0.77 0.00 0.00 57.85 56.64 2r5u n ARG 91 Cb 0.16 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.07 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 1.12 1.03 0.29 -0.13 0.00 -0.67 -4.92 105.19 101.91 2r5u n GLY 92 Ca 0.20 -0.50 0.06 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.98 1.41 -0.20 0.99 4.77 -0.27 -4.61 117.00 118.11 2r5u n LEU 93 Ca -0.09 -0.77 -0.07 0.00 -0.03 0.00 0.00 56.01 55.05 2r5u n LEU 93 Cb 0.32 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.43 2r5u n LEU 93 CO 0.13 0.28 1.00 0.25 -1.33 0.00 0.00 177.39 177.71 2r5u h LEU 94 N 1.43 0.75 -0.78 2.23 5.85 -1.86 -2.46 115.31 120.48 2r5u h LEU 94 Ca 0.00 -0.15 -0.13 0.00 0.84 0.00 0.00 57.88 58.45 2r5u h LEU 94 Cb 0.43 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 2r5u h LEU 94 CO 0.00 0.69 -0.48 0.03 -0.34 0.00 0.00 178.44 178.34 2r5u h ARG 95 N 0.76 0.31 -0.98 1.25 -0.00 -1.92 -0.08 114.38 113.73 2r5u h ARG 95 Ca 0.19 -0.17 0.18 0.00 -0.50 0.00 0.00 59.98 59.68 2r5u h ARG 95 Cb 0.15 0.01 -0.09 0.00 0.00 0.00 0.00 29.97 30.04 2r5u h ARG 95 CO -0.02 0.73 0.61 -0.09 0.00 0.00 0.00 179.97 181.20 2r5u h ARG 96 N 0.25 0.69 0.00 0.04 9.65 -1.70 -2.93 114.38 120.38 2r5u h ARG 96 Ca 0.01 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 2r5u h ARG 96 Cb 0.94 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 29.37 2r5u h ARG 96 CO 0.08 0.46 -1.06 0.44 2.80 0.00 0.00 179.97 182.68 2r5u n ILE 97 N -4.68 0.00 0.00 1.20 -5.35 -1.13 -4.99 119.36 104.41 2r5u n ILE 97 Ca 0.22 -0.06 0.00 0.00 -0.27 0.00 0.00 62.75 62.64 2r5u n ILE 97 Cb 0.57 0.91 0.00 0.00 -1.74 0.00 0.00 39.64 39.38 2r5u n ILE 97 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2r5u n GLY 98 N 1.47 1.55 3.04 3.28 0.00 -1.07 -4.81 105.19 108.65 2r5u n GLY 98 Ca 0.03 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.34 -1.99 0.33 -0.02 0.00 -0.07 -3.35 105.19 98.75 2r5u n GLY 99 Ca 0.00 -1.37 0.12 0.00 0.00 0.00 0.00 46.02 44.77 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 -0.39 2.11 -0.64 4.61 0.00 -1.94 -1.19 119.26 121.81 2r5u h ALA 100 Ca 0.01 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.99 2r5u h ALA 100 Cb 0.26 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 2r5u h ALA 100 CO 0.00 -0.19 0.43 -1.35 0.00 0.00 0.00 179.25 178.14 2r5u h PRO 101 N 0.18 0.53 -0.55 0.00 0.11 -2.00 -0.57 132.00 129.71 2r5u h PRO 101 Ca 0.17 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.21 2r5u h PRO 101 Cb 0.42 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.39 2r5u h PRO 101 CO -0.03 0.35 0.20 -0.92 -0.21 0.00 0.00 178.00 177.40 2r5u h TYR 102 N 0.55 0.85 -0.89 0.65 -0.00 -1.21 -0.77 116.97 116.14 2r5u h TYR 102 Ca 0.29 -0.07 0.01 0.00 -0.00 0.00 0.00 58.73 58.96 2r5u h TYR 102 Cb 0.42 -0.25 -0.05 0.00 -0.00 0.00 0.00 36.73 36.85 2r5u h TYR 102 CO -0.00 0.70 0.59 -0.07 -0.00 0.00 0.00 178.16 179.38 2r5u h LEU 103 N 0.75 1.01 -0.72 2.82 3.38 -1.20 -1.25 115.31 120.10 2r5u h LEU 103 Ca 0.18 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 2r5u h LEU 103 Cb 0.23 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 2r5u h LEU 103 CO -0.01 0.72 -0.13 0.45 0.09 0.00 0.00 178.44 179.56 2r5u h HIS 104 N 1.19 0.94 -0.29 1.13 3.86 -0.83 -1.89 115.15 119.26 2r5u h HIS 104 Ca 0.33 -0.18 0.01 0.00 -1.16 0.00 0.00 60.37 59.37 2r5u h HIS 104 Cb -0.10 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.11 2r5u h HIS 104 CO -0.00 0.92 0.17 1.15 0.86 0.00 0.00 177.93 181.02 2r5u h THR 105 N 0.75 1.03 -0.66 2.45 2.02 -0.70 -1.91 112.91 115.89 2r5u h THR 105 Ca 0.12 -0.12 0.06 0.00 0.77 0.00 0.00 66.41 67.24 2r5u h THR 105 Cb 0.64 0.65 -0.06 0.00 -1.74 0.00 0.00 68.15 67.65 2r5u h THR 105 CO 0.04 0.06 0.36 -0.07 0.37 0.00 0.00 175.52 176.29 2r5u h LEU 106 N 0.34 0.53 -0.82 2.58 3.38 -1.04 -2.00 115.31 118.28 2r5u h LEU 106 Ca 0.11 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2r5u h LEU 106 Cb -0.00 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 2r5u h LEU 106 CO -0.05 0.34 0.52 0.40 0.09 0.00 0.00 178.44 179.74 2r5u h ILE 107 N 0.67 1.22 0.00 1.22 2.04 -1.18 -2.46 117.51 119.01 2r5u h ILE 107 Ca 0.30 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.72 2r5u h ILE 107 Cb 0.20 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.31 2r5u h ILE 107 CO -0.19 0.22 0.00 0.28 0.00 0.00 0.00 178.15 178.46 2r5u h SER 108 N 1.12 0.00 0.95 1.72 0.02 -0.62 -2.68 113.55 114.06 2r5u h SER 108 Ca 0.30 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.20 2r5u h SER 108 Cb -0.09 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 2r5u h SER 108 CO -0.06 0.00 -0.24 0.71 -1.14 0.00 0.00 176.83 176.10 2r5u h THR 109 N 0.00 0.57 -4.27 -2.27 1.35 -1.00 -3.44 112.91 103.85 2r5u h THR 109 Ca 0.00 -1.17 -0.69 0.00 -0.55 0.00 0.00 66.41 63.99 2r5u h THR 109 Cb 0.18 1.79 -0.26 0.00 -1.73 0.00 0.00 68.15 68.13 2r5u h THR 109 CO 0.00 0.23 -0.84 0.68 -0.25 0.00 0.00 175.52 175.34 2r5u s VAL 110 N -3.63 2.44 0.00 6.82 -7.23 -1.01 -4.92 120.40 112.88 2r5u s VAL 110 Ca 0.01 -1.12 0.00 0.00 -1.81 0.00 0.00 61.98 59.05 2r5u s VAL 110 Cb 0.10 -1.94 0.00 0.00 0.56 0.00 0.00 36.38 35.10 2r5u s VAL 110 CO 0.64 0.47 0.08 -2.65 -0.31 0.00 0.00 175.10 173.34 2r5u n PRO 111 N 2.04 0.00 -1.22 4.82 -0.02 -1.26 -4.97 135.00 134.39 2r5u n PRO 111 Ca -0.16 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.22 2r5u n PRO 111 Cb 0.52 -0.50 0.05 0.00 -0.02 0.00 0.00 33.50 33.55 2r5u n PRO 111 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 2r5u n THR 112 N -0.10 0.00 -0.95 3.45 5.66 -1.26 -5.00 114.28 116.07 2r5u n THR 112 Ca 0.00 -0.55 0.07 0.00 -3.05 0.00 0.00 64.05 60.52 2r5u n THR 112 Cb 0.00 -1.33 0.36 0.00 -1.55 0.00 0.00 70.33 67.81 2r5u n THR 112 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2r5u n ALA 113 N -3.04 3.62 -0.22 1.79 0.00 -1.26 -4.68 120.51 116.73 2r5u n ALA 113 Ca -0.07 -2.08 -0.05 0.00 0.00 0.00 0.00 53.44 51.24 2r5u n ALA 113 Cb 0.22 -0.99 0.10 0.00 0.00 0.00 0.00 19.45 18.78 2r5u n ALA 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2r5u h ALA 114 N 3.23 1.06 -0.26 0.00 0.00 -1.94 -3.00 119.26 118.35 2r5u h ALA 114 Ca 0.01 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2r5u h ALA 114 Cb 1.82 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2r5u h ALA 114 CO 0.41 0.63 0.00 0.09 0.00 0.00 0.00 179.25 180.38 2r5u n ASN 115 N -4.25 2.12 -0.26 0.00 5.03 -1.26 -4.58 115.26 112.05 2r5u n ASN 115 Ca 0.05 -1.83 0.04 0.00 0.87 0.00 0.00 54.58 53.71 2r5u n ASN 115 Cb 0.23 -0.17 0.17 0.00 -1.02 0.00 0.00 39.78 39.00 2r5u n ASN 115 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2r5u h ALA 116 N 4.07 1.09 -0.68 5.41 0.00 -1.86 -1.05 119.26 126.24 2r5u h ALA 116 Ca 0.00 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 2r5u h ALA 116 Cb 0.59 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2r5u h ALA 116 CO 0.00 -0.09 0.14 0.78 0.00 0.00 0.00 179.25 180.08 2r5u h GLY 117 N 0.58 1.18 0.82 0.00 0.00 -1.85 -0.32 103.07 103.48 2r5u h GLY 117 Ca 0.40 -0.76 0.02 0.00 0.00 0.00 0.00 47.33 46.99 2r5u h GLY 117 CO -0.32 0.70 0.04 -1.82 0.00 0.00 0.00 176.54 175.14 2r5u h TYR 118 N 1.04 0.07 -0.21 5.60 5.03 -1.56 -0.98 116.97 125.95 2r5u h TYR 118 Ca 0.21 0.01 -0.09 0.00 2.58 0.00 0.00 58.73 61.44 2r5u h TYR 118 Cb 0.40 -0.01 -0.01 0.00 1.55 0.00 0.00 36.73 38.66 2r5u h TYR 118 CO 0.03 0.03 -0.28 1.88 -1.32 0.00 0.00 178.16 178.50 2r5u h TYR 119 N 0.11 0.46 -0.81 -3.82 -1.99 -1.09 -2.60 116.97 107.24 2r5u h TYR 119 Ca 0.08 -0.10 -0.02 0.00 2.00 0.00 0.00 58.73 60.69 2r5u h TYR 119 Cb 0.06 -0.11 -0.04 0.00 2.00 0.00 0.00 36.73 38.65 2r5u h TYR 119 CO -0.13 0.65 0.42 0.00 -0.00 0.00 0.00 178.16 179.10 2r5u h ALA 120 N 1.35 1.21 -0.40 3.88 0.00 -0.81 -1.84 119.26 122.66 2r5u h ALA 120 Ca 0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2r5u h ALA 120 Cb 0.67 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2r5u h ALA 120 CO 0.05 0.62 0.16 0.66 0.00 0.00 0.00 179.25 180.74 2r5u h SER 121 N 1.13 0.51 0.02 0.00 4.64 -0.79 0.56 113.55 119.63 2r5u h SER 121 Ca 0.28 -0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2r5u h SER 121 Cb 0.07 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 2r5u h SER 121 CO -0.04 0.46 -0.01 0.40 -0.87 0.00 0.00 176.83 176.77 2r5u h ILE 122 N 0.56 1.19 -0.91 0.95 1.08 -1.30 -1.75 117.51 117.33 2r5u h ILE 122 Ca 0.14 -0.66 0.02 0.00 -0.39 0.00 0.00 64.86 63.98 2r5u h ILE 122 Cb 0.11 1.63 -0.05 0.00 -3.07 0.00 0.00 36.82 35.44 2r5u h ILE 122 CO -0.01 0.17 0.60 0.58 -0.69 0.00 0.00 178.15 178.79 2r5u h VAL 123 N -0.32 1.19 -0.43 1.67 2.07 -0.88 -1.45 116.25 118.10 2r5u h VAL 123 Ca -0.00 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 2r5u h VAL 123 Cb 0.30 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.95 2r5u h VAL 123 CO 0.01 0.22 0.10 0.00 0.02 0.00 0.00 177.57 177.91 2r5u h ALA 124 N 1.36 0.57 -0.30 1.67 0.00 -0.87 -0.53 119.26 121.16 2r5u h ALA 124 Ca 0.35 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.07 2r5u h ALA 124 Cb -0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2r5u h ALA 124 CO -0.10 0.25 0.17 0.93 0.00 0.00 0.00 179.25 180.50 2r5u h GLU 125 N 0.56 0.33 -0.43 0.00 5.08 -0.96 0.49 114.58 119.65 2r5u h GLU 125 Ca 0.13 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.40 2r5u h GLU 125 Cb 0.33 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2r5u h GLU 125 CO 0.00 0.22 -0.02 0.87 -1.00 0.00 0.00 179.01 179.09 2r5u h LYS 126 N 0.34 0.71 -0.26 2.33 1.79 -1.20 -1.74 116.57 118.55 2r5u h LYS 126 Ca 0.12 -0.19 -0.03 0.00 -2.18 0.00 0.00 60.65 58.37 2r5u h LYS 126 Cb 0.01 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 30.56 2r5u h LYS 126 CO -0.06 0.74 0.05 0.00 -1.08 0.00 0.00 179.45 179.10 2r5u h ALA 127 N 1.31 0.35 -0.12 3.86 0.00 -0.81 -0.02 119.26 123.83 2r5u h ALA 127 Ca 0.13 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.91 2r5u h ALA 127 Cb 0.44 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.07 2r5u h ALA 127 CO 0.02 0.02 -0.33 1.25 0.00 0.00 0.00 179.25 180.21 2r5u h LEU 128 N 0.25 -1.01 -0.74 0.00 5.85 -0.54 -0.34 115.31 118.79 2r5u h LEU 128 Ca 0.08 0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.98 2r5u h LEU 128 Cb 0.31 0.43 -0.05 0.00 0.37 0.00 0.00 40.66 41.72 2r5u h LEU 128 CO 0.00 -0.36 0.46 -0.07 -0.34 0.00 0.00 178.44 178.13 2r5u h LEU 129 N -0.41 0.75 -0.63 2.25 3.38 -1.27 -1.77 115.31 117.61 2r5u h LEU 129 Ca 0.09 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2r5u h LEU 129 Cb 0.55 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 2r5u h LEU 129 CO -0.35 0.51 0.38 0.03 0.09 0.00 0.00 178.44 179.10 2r5u h ARG 130 N 0.89 0.86 0.00 1.13 3.08 -0.66 -1.33 114.38 118.35 2r5u h ARG 130 Ca 0.30 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 60.23 2r5u h ARG 130 Cb 0.05 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 2r5u h ARG 130 CO -0.12 0.62 -0.22 0.00 -1.07 0.00 0.00 179.97 179.17 2r5u h ARG 131 N 0.86 0.00 0.08 0.04 3.08 -0.69 0.07 114.38 117.81 2r5u h ARG 131 Ca 0.23 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.27 2r5u h ARG 131 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.03 2r5u h ARG 131 CO -0.04 0.22 -0.04 1.25 -1.07 0.00 0.00 179.97 180.29 2r5u h LEU 132 N 0.00 -0.09 -0.39 3.04 5.85 -0.97 0.91 115.31 123.66 2r5u h LEU 132 Ca -0.00 -0.39 0.08 0.00 0.84 0.00 0.00 57.88 58.41 2r5u h LEU 132 Cb 0.40 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.37 2r5u h LEU 132 CO 0.03 0.37 -0.17 0.58 -0.34 0.00 0.00 178.44 178.90 2r5u h VAL 133 N -0.57 0.46 -0.78 1.05 2.07 -1.07 0.60 116.25 118.02 2r5u h VAL 133 Ca -0.01 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.47 2r5u h VAL 133 Cb 0.48 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 2r5u h VAL 133 CO 0.02 0.00 0.33 -0.33 0.02 0.00 0.00 177.57 177.60 2r5u h GLU 134 N -0.10 1.15 -0.31 1.57 5.08 -0.96 -1.83 114.58 119.18 2r5u h GLU 134 Ca 0.19 -0.20 -0.10 0.00 -1.00 0.00 0.00 59.36 58.25 2r5u h GLU 134 Cb 0.39 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2r5u h GLU 134 CO -0.45 0.92 -0.20 0.00 -1.00 0.00 0.00 179.01 178.28 2r5u h ALA 135 N 1.17 0.44 -0.24 3.43 0.00 -0.56 -2.14 119.26 121.37 2r5u h ALA 135 Ca 0.26 -0.36 0.06 0.00 0.00 0.00 0.00 54.91 54.87 2r5u h ALA 135 Cb 0.19 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 2r5u h ALA 135 CO -0.02 0.39 -0.14 0.78 0.00 0.00 0.00 179.25 180.25 2r5u h GLY 136 N 0.44 0.04 2.00 0.00 0.00 -0.74 -0.44 103.07 104.38 2r5u h GLY 136 Ca 0.06 0.17 -0.08 0.00 0.00 0.00 0.00 47.33 47.48 2r5u h GLY 136 CO 0.06 -0.15 -0.40 -0.91 0.00 0.00 0.00 176.54 175.13 2r5u h THR 137 N -0.12 1.27 -0.61 4.70 1.35 -1.30 -1.23 112.91 116.97 2r5u h THR 137 Ca 0.13 -1.38 -0.04 0.00 -0.55 0.00 0.00 66.41 64.57 2r5u h THR 137 Cb 0.32 1.75 -0.03 0.00 -1.73 0.00 0.00 68.15 68.46 2r5u h THR 137 CO -0.31 0.39 0.22 -0.09 -0.25 0.00 0.00 175.52 175.48 2r5u h ARG 138 N 0.00 0.93 -0.25 4.72 2.43 -0.87 -1.27 114.38 120.07 2r5u h ARG 138 Ca -0.00 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 58.97 2r5u h ARG 138 Cb 0.72 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 2r5u h ARG 138 CO 0.05 0.81 0.10 0.28 -1.51 0.00 0.00 179.97 179.71 2r5u h VAL 139 N 0.86 1.17 -0.23 0.20 2.07 -0.16 -1.55 116.25 118.62 2r5u h VAL 139 Ca 0.20 -0.51 0.06 0.00 0.82 0.00 0.00 66.70 67.27 2r5u h VAL 139 Cb 0.24 1.03 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 2r5u h VAL 139 CO -0.01 0.17 -0.20 0.58 0.02 0.00 0.00 177.57 178.13 2r5u h VAL 140 N 0.26 0.48 -0.70 2.57 2.07 -1.21 -0.87 116.25 118.85 2r5u h VAL 140 Ca 0.08 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.73 2r5u h VAL 140 Cb 0.17 0.48 -0.09 0.00 -1.52 0.00 0.00 31.29 30.33 2r5u h VAL 140 CO -0.01 0.00 0.25 1.56 0.02 0.00 0.00 177.57 179.39 2r5u h GLN 141 N -0.20 0.38 -0.62 1.57 4.20 -0.98 -1.44 115.11 118.02 2r5u h GLN 141 Ca 0.13 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.77 2r5u h GLN 141 Cb 0.40 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.07 2r5u h GLN 141 CO -0.35 0.25 0.20 1.88 -0.67 0.00 0.00 178.83 180.15 2r5u h TYR 142 N 0.40 0.97 -0.19 2.96 0.99 -0.70 0.33 116.97 121.72 2r5u h TYR 142 Ca 0.37 -0.08 -0.00 0.00 2.00 0.00 0.00 58.73 61.02 2r5u h TYR 142 Cb 0.55 -0.29 -0.01 0.00 1.00 0.00 0.00 36.73 37.98 2r5u h TYR 142 CO -0.19 0.77 0.12 0.78 -0.00 0.00 0.00 178.16 179.64 2r5u h GLY 143 N 1.02 0.27 0.89 3.88 0.00 -0.19 -2.78 103.07 106.17 2r5u h GLY 143 Ca 0.21 -0.11 -0.09 0.00 0.00 0.00 0.00 47.33 47.34 2r5u h GLY 143 CO -0.01 0.11 -0.18 -0.97 0.00 0.00 0.00 176.54 175.49 2r5u h TYR 144 N 0.23 0.68 -1.70 5.60 0.99 -1.16 -3.25 116.97 118.36 2r5u h TYR 144 Ca 0.07 -0.18 -0.77 0.00 2.00 0.00 0.00 58.73 59.85 2r5u h TYR 144 Cb 0.02 -0.15 -0.20 0.00 1.00 0.00 0.00 36.73 37.40 2r5u h TYR 144 CO -0.05 0.86 1.67 0.00 -0.00 0.00 0.00 178.16 180.64 2r5u n ALA 145 N -2.45 6.44 -2.39 3.88 0.00 0.09 -5.01 120.51 121.08 2r5u n ALA 145 Ca -0.04 -4.31 -0.36 0.00 0.00 0.00 0.00 53.44 48.73 2r5u n ALA 145 Cb 0.39 -2.46 -0.06 0.00 0.00 0.00 0.00 19.45 17.33 2r5u n ALA 145 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2r5u s GLY 146 N -0.49 2.46 -0.04 0.00 0.00 -1.05 -4.28 107.32 103.91 2r5u s GLY 146 Ca 0.47 -0.16 0.00 0.00 0.00 0.00 0.00 44.72 45.03 2r5u s GLY 146 CO -0.12 0.13 0.00 0.00 0.00 0.00 0.00 173.10 173.11 2r5u n ALA 147 N 0.94 -0.01 -0.34 3.20 0.00 -1.26 -4.86 120.51 118.18 2r5u n ALA 147 Ca -0.07 0.01 0.06 0.00 0.00 0.00 0.00 53.44 53.44 2r5u n ALA 147 Cb 0.52 -1.26 0.13 0.00 0.00 0.00 0.00 19.45 18.84 2r5u n ALA 147 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2r5u n GLU 148 N 0.27 -0.09 -0.00 0.00 1.02 -1.26 -2.49 120.64 118.09 2r5u n GLU 148 Ca -0.00 1.46 0.02 0.00 -0.02 0.00 0.00 57.16 58.62 2r5u n GLU 148 Cb 0.42 -2.19 -0.03 0.00 -0.02 0.00 0.00 31.44 29.62 2r5u n GLU 148 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2r5u n GLY 149 N -1.59 -0.11 0.00 0.62 0.00 -1.26 -5.10 105.19 97.75 2r5u n GLY 149 Ca 0.15 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2r5u n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r5u n ALA 150 N -1.59 0.00 -1.46 4.61 0.00 -1.04 -5.08 120.51 115.96 2r5u n ALA 150 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.04 2r5u n ALA 150 Cb 0.11 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.59 2r5u n ALA 150 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2r5u n ASP 151 N 0.00 -1.07 0.29 0.00 2.03 -1.26 -5.00 116.55 111.53 2r5u n ASP 151 Ca 0.00 0.77 0.13 0.00 0.52 0.00 0.00 54.79 56.21 2r5u n ASP 151 Cb 0.00 -1.15 0.68 0.00 -0.72 0.00 0.00 41.12 39.93 2r5u n ASP 151 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 2r5u h VAL 152 N 0.38 0.00 -0.55 5.18 3.04 -1.98 -1.77 116.25 120.55 2r5u h VAL 152 Ca -0.44 0.00 -0.08 0.00 -1.01 0.00 0.00 66.70 65.17 2r5u h VAL 152 Cb 1.40 0.56 -0.02 0.00 -2.01 0.00 0.00 31.29 31.21 2r5u h VAL 152 CO 0.48 0.00 0.03 0.00 -1.01 0.00 0.00 177.57 177.07 2r5u h ALA 153 N 1.30 1.03 0.00 3.17 0.00 -1.99 -1.53 119.26 121.24 2r5u h ALA 153 Ca 0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 2r5u h ALA 153 Cb 0.64 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2r5u h ALA 153 CO 0.00 0.61 -0.19 0.93 0.00 0.00 0.00 179.25 180.60 2r5u h GLU 154 N 0.85 0.00 0.04 0.00 5.08 -1.75 -0.41 114.58 118.39 2r5u h GLU 154 Ca 0.16 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2r5u h GLU 154 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2r5u h GLU 154 CO 0.02 0.19 -0.02 0.28 -1.00 0.00 0.00 179.01 178.48 2r5u h VAL 155 N 0.00 1.21 -0.60 3.13 2.07 -1.53 -2.12 116.25 118.40 2r5u h VAL 155 Ca -0.00 -0.81 0.01 0.00 0.82 0.00 0.00 66.70 66.72 2r5u h VAL 155 Cb 0.94 1.75 -0.03 0.00 -1.52 0.00 0.00 31.29 32.43 2r5u h VAL 155 CO 0.03 0.20 0.40 0.58 0.02 0.00 0.00 177.57 178.80 2r5u h VAL 156 N -0.40 1.15 -0.79 2.57 2.07 -1.11 -1.78 116.25 117.96 2r5u h VAL 156 Ca -0.01 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 2r5u h VAL 156 Cb 0.37 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 2r5u h VAL 156 CO 0.01 0.15 0.47 -0.78 0.02 0.00 0.00 177.57 177.44 2r5u h ASP 157 N 0.81 0.94 -0.33 0.57 3.58 -1.10 -0.30 116.42 120.59 2r5u h ASP 157 Ca 0.22 -0.05 -0.03 0.00 0.42 0.00 0.00 57.03 57.59 2r5u h ASP 157 Cb -0.08 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 40.72 2r5u h ASP 157 CO -0.05 0.73 0.08 0.03 -2.88 0.00 0.00 179.24 177.15 2r5u h ARG 158 N 1.08 0.52 -0.39 0.28 2.47 -0.85 -0.79 114.38 116.70 2r5u h ARG 158 Ca 0.28 -0.12 0.07 0.00 -1.26 0.00 0.00 59.98 58.95 2r5u h ARG 158 Cb -0.04 -0.07 -0.07 0.00 -1.65 0.00 0.00 29.97 28.14 2r5u h ARG 158 CO -0.05 0.58 -0.02 0.00 0.56 0.00 0.00 179.97 181.03 2r5u h ALA 159 N 0.92 0.33 -0.60 0.04 0.00 -0.95 -2.48 119.26 116.53 2r5u h ALA 159 Ca 0.10 0.12 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 2r5u h ALA 159 Cb 0.29 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2r5u h ALA 159 CO 0.00 -0.41 -0.03 1.96 0.00 0.00 0.00 179.25 180.77 2r5u h GLN 160 N 0.08 1.08 -0.83 0.00 4.20 -0.86 -2.50 115.11 116.27 2r5u h GLN 160 Ca 0.19 -0.36 0.17 0.00 0.06 0.00 0.00 58.65 58.71 2r5u h GLN 160 Cb 0.28 -0.09 -0.06 0.00 0.30 0.00 0.00 27.48 27.91 2r5u h GLN 160 CO -0.34 1.06 0.55 0.00 -0.67 0.00 0.00 178.83 179.43 2r5u h ALA 161 N 0.98 2.13 -0.36 3.87 0.00 -0.92 -0.42 119.26 124.54 2r5u h ALA 161 Ca 0.17 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 2r5u h ALA 161 Cb 0.60 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2r5u h ALA 161 CO 0.04 -0.37 0.09 0.93 0.00 0.00 0.00 179.25 179.94 2r5u h GLU 162 N 0.43 0.57 0.01 0.00 4.39 -0.99 -2.56 114.58 116.44 2r5u h GLU 162 Ca 0.42 -0.13 -0.21 0.00 0.34 0.00 0.00 59.36 59.78 2r5u h GLU 162 Cb 0.98 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.54 2r5u h GLU 162 CO -0.15 0.61 -0.91 0.82 -1.16 0.00 0.00 179.01 178.22 2r5u h ILE 163 N 0.43 1.49 -0.52 3.13 1.08 -1.41 -3.06 117.51 118.65 2r5u h ILE 163 Ca 0.11 -2.63 0.08 0.00 -0.39 0.00 0.00 64.86 62.03 2r5u h ILE 163 Cb 0.29 2.49 -0.06 0.00 -3.07 0.00 0.00 36.82 36.47 2r5u h ILE 163 CO -0.00 0.77 0.17 0.22 -0.69 0.00 0.00 178.15 178.62 2r5u h TYR 164 N 0.12 0.30 -0.96 1.37 3.20 -1.07 0.35 116.97 120.28 2r5u h TYR 164 Ca -0.05 0.03 0.15 0.00 3.14 0.00 0.00 58.73 61.99 2r5u h TYR 164 Cb 1.54 -0.06 -0.09 0.00 1.54 0.00 0.00 36.73 39.66 2r5u h TYR 164 CO 0.03 0.08 0.57 -0.44 -1.64 0.00 0.00 178.16 176.77 2r5u h ASP 165 N 0.34 0.78 0.05 -2.11 3.45 -1.36 -3.02 116.42 114.55 2r5u h ASP 165 Ca 0.25 0.07 -0.00 0.00 0.43 0.00 0.00 57.03 57.78 2r5u h ASP 165 Cb 0.29 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 38.99 2r5u h ASP 165 CO -0.27 0.36 -0.02 0.58 -1.57 0.00 0.00 179.24 178.32 2r5u h VAL 166 N 0.83 1.17 0.00 -1.35 2.07 -1.23 -3.52 116.25 114.22 2r5u h VAL 166 Ca 0.51 -1.65 0.00 0.00 0.82 0.00 0.00 66.70 66.38 2r5u h VAL 166 Cb 0.65 2.12 0.00 0.00 -1.52 0.00 0.00 31.29 32.55 2r5u h VAL 166 CO -0.32 0.36 0.00 0.00 0.02 0.00 0.00 177.57 177.63