#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k07 s ALA 2 N 0.00 3.10 -0.56 3.17 0.00 -1.26 -4.98 121.76 121.24 2k07 s ALA 2 Ca 0.00 -0.05 0.24 0.00 0.00 0.00 0.00 51.96 52.15 2k07 s ALA 2 Cb 0.00 -3.07 0.37 0.00 0.00 0.00 0.00 23.12 20.43 2k07 s ALA 2 CO 0.00 -0.59 1.40 0.22 0.00 0.00 0.00 175.76 176.78 2k07 h ASP 3 N -0.07 0.00 -0.20 0.00 1.82 -2.05 -3.28 116.42 112.65 2k07 h ASP 3 Ca -0.45 -0.11 -0.08 0.00 -0.39 0.00 0.00 57.03 56.00 2k07 h ASP 3 Cb 1.19 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 41.20 2k07 h ASP 3 CO 0.62 0.05 -0.20 -0.33 -1.61 0.00 0.00 179.24 177.77 2k07 h GLU 4 N 0.00 0.49 -0.60 0.28 5.08 -1.99 0.20 114.58 118.04 2k07 h GLU 4 Ca 0.00 -0.26 -0.07 0.00 -1.00 0.00 0.00 59.36 58.03 2k07 h GLU 4 Cb 0.82 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 2k07 h GLU 4 CO 0.00 0.84 0.11 0.00 -1.00 0.00 0.00 179.01 178.96 2k07 h ALA 5 N 0.64 0.80 -0.31 3.43 0.00 -1.99 -2.50 119.26 119.33 2k07 h ALA 5 Ca 0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2k07 h ALA 5 Cb 0.75 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2k07 h ALA 5 CO 0.05 0.54 0.14 1.15 0.00 0.00 0.00 179.25 181.13 2k07 h THR 6 N 0.89 1.17 0.00 0.00 2.02 -1.57 -2.73 112.91 112.68 2k07 h THR 6 Ca 0.18 -0.49 -0.07 0.00 0.77 0.00 0.00 66.41 66.80 2k07 h THR 6 Cb 0.40 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.72 2k07 h THR 6 CO 0.01 0.18 -0.33 0.08 0.37 0.00 0.00 175.52 175.83 2k07 h ARG 7 N 0.36 0.00 -0.17 6.66 0.11 -0.54 -1.55 114.38 119.26 2k07 h ARG 7 Ca 0.11 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.18 2k07 h ARG 7 Cb 0.15 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.22 2k07 h ARG 7 CO -0.01 0.33 0.08 -0.09 0.10 0.00 0.00 179.97 180.37 2k07 h ARG 8 N 0.00 0.25 -0.45 0.08 2.43 -1.20 -0.92 114.38 114.56 2k07 h ARG 8 Ca -0.00 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.17 2k07 h ARG 8 Cb 0.59 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.06 2k07 h ARG 8 CO 0.04 0.30 0.22 0.28 -1.51 0.00 0.00 179.97 179.30 2k07 h VAL 9 N 0.14 0.95 -0.69 0.20 2.07 -1.11 -0.04 116.25 117.76 2k07 h VAL 9 Ca 0.06 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2k07 h VAL 9 Cb 0.13 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.35 2k07 h VAL 9 CO -0.01 0.08 0.45 0.58 0.02 0.00 0.00 177.57 178.69 2k07 h VAL 10 N 0.43 1.18 0.01 2.57 2.07 -1.10 -2.68 116.25 118.73 2k07 h VAL 10 Ca 0.20 -0.34 -0.25 0.00 0.82 0.00 0.00 66.70 67.12 2k07 h VAL 10 Cb 0.12 0.17 0.01 0.00 -1.52 0.00 0.00 31.29 30.08 2k07 h VAL 10 CO -0.15 0.18 -1.01 0.28 0.02 0.00 0.00 177.57 176.88 2k07 h SER 11 N 0.94 0.73 -0.08 0.57 0.02 -0.34 -3.06 113.55 112.34 2k07 h SER 11 Ca 0.25 -0.60 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 2k07 h SER 11 Cb -0.09 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.22 2k07 h SER 11 CO -0.05 1.40 0.00 -0.62 -1.14 0.00 0.00 176.83 176.41 2k07 n GLU 12 N -3.80 1.20 -3.77 3.45 1.02 -0.11 -4.20 120.64 114.43 2k07 n GLU 12 Ca -0.09 -0.31 -0.35 0.00 -0.02 0.00 0.00 57.16 56.39 2k07 n GLU 12 Cb 0.87 -1.13 -0.10 0.00 -0.02 0.00 0.00 31.44 31.06 2k07 n GLU 12 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2k07 s ILE 13 N -1.90 3.48 0.29 -3.67 1.01 -1.03 -4.36 121.20 115.03 2k07 s ILE 13 Ca 0.12 -3.13 -0.25 0.00 0.00 0.00 0.00 60.65 57.39 2k07 s ILE 13 Cb 0.06 -3.29 -0.16 0.00 0.01 0.00 0.00 42.46 39.07 2k07 s ILE 13 CO 0.09 -0.88 0.33 -2.65 0.00 0.00 0.00 174.94 171.83 2k07 n PRO 14 N 3.30 0.00 -2.17 2.79 -0.02 -1.26 -4.94 135.00 132.70 2k07 n PRO 14 Ca 0.08 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.28 2k07 n PRO 14 Cb 0.36 -1.00 0.03 0.00 -0.02 0.00 0.00 33.50 32.87 2k07 n PRO 14 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2k07 s VAL 15 N -1.30 4.05 -0.11 -1.45 -7.23 -1.26 -4.58 120.40 108.51 2k07 s VAL 15 Ca 0.62 0.37 -0.13 0.00 -1.81 0.00 0.00 61.98 61.03 2k07 s VAL 15 Cb -0.80 -3.62 -0.05 0.00 0.56 0.00 0.00 36.38 32.47 2k07 s VAL 15 CO 0.59 -0.73 0.30 -0.76 -0.31 0.00 0.00 175.10 174.19 2k07 s LEU 16 N -5.10 4.34 0.01 1.32 1.02 -1.25 -4.95 118.68 114.07 2k07 s LEU 16 Ca 0.54 0.64 0.09 0.00 0.02 0.00 0.00 54.13 55.42 2k07 s LEU 16 Cb -0.11 -2.39 -0.23 0.00 0.02 0.00 0.00 46.19 43.49 2k07 s LEU 16 CO 0.49 0.22 0.87 0.50 0.02 0.00 0.00 176.35 178.45 2k07 h LYS 17 N 5.80 0.03 -5.30 1.70 3.64 -1.96 -3.37 116.57 117.11 2k07 h LYS 17 Ca -0.47 -0.05 -0.61 0.00 -1.27 0.00 0.00 60.65 58.25 2k07 h LYS 17 Cb 1.19 0.02 -0.12 0.00 -0.41 0.00 0.00 32.23 32.91 2k07 h LYS 17 CO 0.68 0.74 -0.34 0.99 -2.27 0.00 0.00 179.45 179.25 2k07 s THR 18 N -2.63 5.28 -0.27 1.00 2.01 -1.26 -5.04 115.64 114.72 2k07 s THR 18 Ca -0.04 0.48 -0.01 0.00 0.31 0.00 0.00 61.69 62.43 2k07 s THR 18 Cb 0.08 -3.62 0.08 0.00 0.01 0.00 0.00 72.50 69.05 2k07 s THR 18 CO 0.82 0.31 0.06 0.21 -0.69 0.00 0.00 174.62 175.33 2k07 s ASN 19 N 0.96 3.67 0.29 3.53 2.47 -1.26 -4.73 114.94 119.87 2k07 s ASN 19 Ca 0.14 -1.34 -0.08 0.00 0.42 0.00 0.00 52.86 52.00 2k07 s ASN 19 Cb -0.14 -0.82 -0.00 0.00 -1.45 0.00 0.00 41.25 38.84 2k07 s ASN 19 CO 0.06 -0.36 0.46 0.00 -3.72 0.00 0.00 177.10 173.54 2k07 s ALA 20 N 1.67 0.24 0.35 1.71 0.00 -1.26 -5.12 121.76 119.34 2k07 s ALA 20 Ca 0.05 -1.19 0.07 0.00 0.00 0.00 0.00 51.96 50.89 2k07 s ALA 20 Cb -0.17 1.11 -0.01 0.00 0.00 0.00 0.00 23.12 24.04 2k07 s ALA 20 CO -0.18 -0.81 0.43 0.20 0.00 0.00 0.00 175.76 175.40 2k07 s GLY 21 N -3.12 1.72 0.00 0.00 0.00 -1.26 -4.72 107.32 99.95 2k07 s GLY 21 Ca 0.27 -1.56 0.11 0.00 0.00 0.00 0.00 44.72 43.53 2k07 s GLY 21 CO 0.14 -1.46 1.14 -1.05 0.00 0.00 0.00 173.10 171.86 2k07 n PRO 22 N -1.60 0.28 0.22 2.90 -0.02 -1.26 -2.48 135.00 133.03 2k07 n PRO 22 Ca 0.01 0.06 0.15 0.00 -2.02 0.00 0.00 63.50 61.70 2k07 n PRO 22 Cb 0.59 -1.50 0.54 0.00 -0.02 0.00 0.00 33.50 33.10 2k07 n PRO 22 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2k07 h ARG 23 N 0.00 0.00 -4.86 -0.52 3.08 -1.94 -3.39 114.38 106.75 2k07 h ARG 23 Ca 0.00 0.00 -0.68 0.00 0.07 0.00 0.00 59.98 59.37 2k07 h ARG 23 Cb 0.03 0.00 -0.34 0.00 0.08 0.00 0.00 29.97 29.74 2k07 h ARG 23 CO 0.00 0.00 -0.75 0.34 -1.07 0.00 0.00 179.97 178.49 2k07 s ASP 24 N -5.31 4.49 0.10 7.04 -1.08 -1.04 -5.02 116.67 115.84 2k07 s ASP 24 Ca 0.04 -1.15 -0.24 0.00 -0.52 0.00 0.00 52.55 50.68 2k07 s ASP 24 Cb 0.09 -1.64 -0.12 0.00 -1.46 0.00 0.00 42.92 39.79 2k07 s ASP 24 CO 0.53 -0.18 1.70 0.03 0.52 0.00 0.00 175.17 177.77 2k07 h ARG 25 N 7.94 -0.18 -0.12 4.34 3.08 -1.87 0.18 114.38 127.74 2k07 h ARG 25 Ca -0.26 0.01 -0.18 0.00 0.07 0.00 0.00 59.98 59.63 2k07 h ARG 25 Cb 1.07 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 31.16 2k07 h ARG 25 CO 0.53 -0.12 -0.67 1.05 -1.07 0.00 0.00 179.97 179.69 2k07 h GLU 26 N -0.19 0.49 -0.19 0.04 4.11 -1.97 0.26 114.58 117.14 2k07 h GLU 26 Ca 0.01 -0.37 -0.12 0.00 0.07 0.00 0.00 59.36 58.96 2k07 h GLU 26 Cb 0.19 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 2k07 h GLU 26 CO -0.04 0.99 -0.39 -0.07 0.07 0.00 0.00 179.01 179.57 2k07 h LEU 27 N 0.35 0.44 -0.12 3.06 -0.00 -1.91 0.73 115.31 117.87 2k07 h LEU 27 Ca -0.02 -0.19 -0.02 0.00 -0.00 0.00 0.00 57.88 57.66 2k07 h LEU 27 Cb 1.23 -0.12 -0.00 0.00 -0.00 0.00 0.00 40.66 41.77 2k07 h LEU 27 CO 0.12 0.79 0.00 -0.25 -0.00 0.00 0.00 178.44 179.11 2k07 h TRP 28 N 0.35 0.23 -0.48 1.13 -0.00 -0.22 -0.88 115.95 116.08 2k07 h TRP 28 Ca 0.03 -0.04 -0.04 0.00 -0.00 0.00 0.00 58.89 58.85 2k07 h TRP 28 Cb 0.84 -0.06 -0.02 0.00 -0.00 0.00 0.00 29.16 29.92 2k07 h TRP 28 CO 0.03 0.44 0.13 0.28 -0.00 0.00 0.00 178.44 179.31 2k07 h VAL 29 N -0.05 1.20 -0.52 2.65 2.07 -0.38 0.32 116.25 121.54 2k07 h VAL 29 Ca 0.03 -0.71 -0.11 0.00 0.82 0.00 0.00 66.70 66.73 2k07 h VAL 29 Cb 0.35 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 2k07 h VAL 29 CO 0.01 0.27 -0.10 -0.61 0.02 0.00 0.00 177.57 177.15 2k07 h GLN 30 N 0.70 0.96 -0.38 1.57 4.15 -0.71 -1.00 115.11 120.40 2k07 h GLN 30 Ca 0.16 -0.34 -0.13 0.00 0.77 0.00 0.00 58.65 59.10 2k07 h GLN 30 Cb 0.24 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 2k07 h GLN 30 CO -0.00 1.01 -0.29 -0.09 -1.93 0.00 0.00 178.83 177.52 2k07 h ARG 31 N 0.86 0.82 -0.24 1.69 2.43 -0.52 -2.24 114.38 117.18 2k07 h ARG 31 Ca 0.14 -0.37 0.06 0.00 -0.81 0.00 0.00 59.98 58.99 2k07 h ARG 31 Cb 0.65 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 30.12 2k07 h ARG 31 CO 0.04 1.01 -0.18 -0.07 -1.51 0.00 0.00 179.97 179.26 2k07 h LEU 32 N 0.70 -0.57 -1.53 3.80 -0.00 0.07 -0.54 115.31 117.24 2k07 h LEU 32 Ca 0.08 0.12 -0.04 0.00 -0.00 0.00 0.00 57.88 58.03 2k07 h LEU 32 Cb 0.83 0.29 -0.01 0.00 -0.00 0.00 0.00 40.66 41.78 2k07 h LEU 32 CO 0.07 -0.22 -0.21 0.07 -0.00 0.00 0.00 178.44 178.16 2k07 h LYS 33 N -0.17 0.00 0.59 1.13 2.10 -1.12 0.39 116.57 119.49 2k07 h LYS 33 Ca 0.14 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.76 2k07 h LYS 33 Cb 0.38 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.71 2k07 h LYS 33 CO -0.34 0.21 -0.28 0.93 -2.00 0.00 0.00 179.45 177.96 2k07 h GLU 34 N 0.00 -0.77 0.00 0.07 4.39 -0.54 -2.37 114.58 115.36 2k07 h GLU 34 Ca -0.00 0.05 -0.08 0.00 0.34 0.00 0.00 59.36 59.67 2k07 h GLU 34 Cb 0.54 0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.35 2k07 h GLU 34 CO 0.03 -0.51 -0.39 1.05 -1.16 0.00 0.00 179.01 178.02 2k07 h GLU 35 N -0.96 0.00 -0.64 2.33 4.11 -1.07 -1.94 114.58 116.41 2k07 h GLU 35 Ca -0.08 0.00 0.11 0.00 0.07 0.00 0.00 59.36 59.46 2k07 h GLU 35 Cb 0.61 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.78 2k07 h GLU 35 CO 0.13 0.39 0.21 1.88 0.07 0.00 0.00 179.01 181.69 2k07 h TYR 36 N 0.00 0.35 -0.72 2.06 0.05 -0.29 0.32 116.97 118.74 2k07 h TYR 36 Ca -0.00 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.80 2k07 h TYR 36 Cb 0.96 -0.06 -0.03 0.00 1.01 0.00 0.00 36.73 38.61 2k07 h TYR 36 CO 0.00 0.04 0.43 1.96 -1.05 0.00 0.00 178.16 179.53 2k07 h GLN 37 N 0.36 0.98 -0.52 4.88 1.08 -0.80 0.13 115.11 121.21 2k07 h GLN 37 Ca 0.34 -0.09 0.02 0.00 -1.45 0.00 0.00 58.65 57.46 2k07 h GLN 37 Cb 0.48 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 27.67 2k07 h GLN 37 CO -0.37 0.70 0.32 0.77 -0.95 0.00 0.00 178.83 179.31 2k07 h SER 38 N 0.98 0.53 0.54 1.46 0.02 -0.93 0.15 113.55 116.31 2k07 h SER 38 Ca 0.26 -0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.18 2k07 h SER 38 Cb -0.02 -0.12 0.01 0.00 0.14 0.00 0.00 62.40 62.41 2k07 h SER 38 CO -0.05 0.38 -0.26 -0.07 -1.14 0.00 0.00 176.83 175.69 2k07 h LEU 39 N 0.65 -0.62 -1.07 5.07 3.38 0.17 -1.13 115.31 121.76 2k07 h LEU 39 Ca 0.21 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2k07 h LEU 39 Cb -0.00 0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 2k07 h LEU 39 CO -0.08 -0.42 0.59 0.40 0.09 0.00 0.00 178.44 179.02 2k07 h ILE 40 N -0.75 1.24 -0.51 1.22 2.04 -0.62 0.80 117.51 120.93 2k07 h ILE 40 Ca -0.07 -0.46 -0.09 0.00 1.00 0.00 0.00 64.86 65.23 2k07 h ILE 40 Cb 0.57 -0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 2k07 h ILE 40 CO 0.12 0.24 -0.05 -0.09 0.00 0.00 0.00 178.15 178.37 2k07 h ARG 41 N 1.25 0.94 -0.32 2.37 9.65 -0.61 0.31 114.38 127.97 2k07 h ARG 41 Ca 0.33 -0.32 -0.05 0.00 -1.10 0.00 0.00 59.98 58.84 2k07 h ARG 41 Cb -0.12 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.38 2k07 h ARG 41 CO -0.07 0.98 -0.00 -0.92 2.80 0.00 0.00 179.97 182.76 2k07 h TYR 42 N 0.80 0.62 -0.87 2.20 3.20 -0.64 -1.12 116.97 121.16 2k07 h TYR 42 Ca 0.14 -0.11 0.01 0.00 3.14 0.00 0.00 58.73 61.91 2k07 h TYR 42 Cb 0.59 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.65 2k07 h TYR 42 CO 0.04 0.69 0.58 0.28 -1.64 0.00 0.00 178.16 178.12 2k07 h VAL 43 N 0.37 1.21 0.72 1.81 2.07 -0.65 0.32 116.25 122.10 2k07 h VAL 43 Ca 0.09 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 2k07 h VAL 43 Cb 0.45 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 2k07 h VAL 43 CO 0.02 0.21 -0.50 -0.08 0.02 0.00 0.00 177.57 177.24 2k07 h GLU 44 N 1.17 -1.12 -0.61 1.57 4.81 -0.08 0.32 114.58 120.64 2k07 h GLU 44 Ca 0.33 0.08 0.03 0.00 -0.13 0.00 0.00 59.36 59.67 2k07 h GLU 44 Cb -0.11 0.25 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 2k07 h GLU 44 CO -0.08 -0.74 0.40 -0.91 -0.73 0.00 0.00 179.01 176.95 2k07 h ASN 45 N -1.16 0.61 -0.18 1.04 2.35 -0.90 -0.03 115.58 117.31 2k07 h ASN 45 Ca -0.09 -0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 55.59 2k07 h ASN 45 Cb 0.95 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 39.17 2k07 h ASN 45 CO 0.06 0.42 -0.09 -1.13 -1.65 0.00 0.00 177.43 175.03 2k07 h ASN 46 N 0.71 0.40 0.42 5.81 -1.24 -0.10 -3.01 115.58 118.57 2k07 h ASN 46 Ca 0.24 -0.42 -0.07 0.00 0.71 0.00 0.00 56.30 56.77 2k07 h ASN 46 Cb 0.09 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 39.02 2k07 h ASN 46 CO -0.07 0.73 -0.31 0.11 -1.29 0.00 0.00 177.43 176.60 2k07 h LYS 47 N 0.08 0.00 0.00 6.67 1.57 0.19 -1.29 116.57 123.79 2k07 h LYS 47 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2k07 h LYS 47 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 2k07 h LYS 47 CO 0.03 0.31 0.00 0.09 -0.57 0.00 0.00 179.45 179.31 2k07 n ASN 48 N -3.96 0.59 -1.53 0.86 3.02 -0.08 -0.48 115.26 113.69 2k07 n ASN 48 Ca -0.02 0.67 0.09 0.00 -0.03 0.00 0.00 54.58 55.30 2k07 n ASN 48 Cb 0.38 -0.79 0.35 0.00 -0.61 0.00 0.00 39.78 39.11 2k07 n ASN 48 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k07 n ALA 49 N -1.75 3.06 -0.90 5.41 0.00 -0.52 -4.92 120.51 120.88 2k07 n ALA 49 Ca 0.01 -1.62 0.00 0.00 0.00 0.00 0.00 53.44 51.83 2k07 n ALA 49 Cb 0.18 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.65 2k07 n ALA 49 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2k07 n ASP 50 N 1.03 -2.58 -4.83 0.00 2.03 0.37 -4.98 116.55 107.60 2k07 n ASP 50 Ca 0.25 0.00 -0.35 0.00 0.52 0.00 0.00 54.79 55.21 2k07 n ASP 50 Cb 0.88 -1.61 -0.07 0.00 -0.72 0.00 0.00 41.12 39.60 2k07 n ASP 50 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2k07 s ASN 51 N -2.22 6.01 -0.29 1.67 3.84 -0.98 -4.97 114.94 118.01 2k07 s ASN 51 Ca 0.00 0.31 -0.03 0.00 0.21 0.00 0.00 52.86 53.36 2k07 s ASN 51 Cb 0.00 -1.85 0.17 0.00 -0.55 0.00 0.00 41.25 39.02 2k07 s ASN 51 CO 0.00 0.35 0.56 -0.62 -2.79 0.00 0.00 177.10 174.59 2k07 s ASP 52 N -1.33 -1.02 0.00 -4.21 2.15 -1.26 -2.84 116.67 108.16 2k07 s ASP 52 Ca 0.19 0.84 0.00 0.00 0.43 0.00 0.00 52.55 54.00 2k07 s ASP 52 Cb -0.12 1.96 0.00 0.00 -0.30 0.00 0.00 42.92 44.46 2k07 s ASP 52 CO 0.09 -0.26 0.17 -2.67 -0.17 0.00 0.00 175.17 172.33 2k07 n TRP 53 N 5.42 0.00 -3.68 -5.34 4.27 -1.26 -4.80 117.44 112.04 2k07 n TRP 53 Ca -0.03 0.00 -0.12 0.00 -3.89 0.00 0.00 57.50 53.46 2k07 n TRP 53 Cb 0.51 0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 30.40 2k07 n TRP 53 CO 0.00 0.00 0.00 -0.59 -2.29 0.00 0.00 177.69 174.81 2k07 s PHE 54 N -0.15 -0.20 -0.29 -2.67 -0.71 -1.26 -0.76 117.98 111.94 2k07 s PHE 54 Ca 0.00 0.04 -0.14 0.00 -1.04 0.00 0.00 56.93 55.79 2k07 s PHE 54 Cb 0.00 0.19 0.11 0.00 -1.21 0.00 0.00 43.02 42.11 2k07 s PHE 54 CO 0.00 -0.59 0.74 -0.98 -1.34 0.00 0.00 175.22 173.04 2k07 s ARG 55 N -2.94 0.60 -0.19 1.99 1.70 -1.01 -5.01 118.95 114.10 2k07 s ARG 55 Ca -0.02 1.18 -0.10 0.00 -0.47 0.00 0.00 55.73 56.32 2k07 s ARG 55 Cb 0.00 0.34 -0.05 0.00 -0.57 0.00 0.00 34.95 34.68 2k07 s ARG 55 CO -0.06 -0.15 0.12 -0.51 -1.08 0.00 0.00 175.30 173.62 2k07 s LEU 56 N 1.98 4.16 0.28 -1.89 2.01 -1.26 -2.05 118.68 121.90 2k07 s LEU 56 Ca -0.08 0.22 0.11 0.00 0.01 0.00 0.00 54.13 54.39 2k07 s LEU 56 Cb -0.07 -2.07 -0.05 0.00 0.01 0.00 0.00 46.19 44.01 2k07 s LEU 56 CO -0.19 0.19 -0.18 -1.61 1.01 0.00 0.00 176.35 175.57 2k07 s GLU 57 N 0.31 1.65 0.32 1.70 2.02 0.27 -4.98 118.70 119.98 2k07 s GLU 57 Ca 0.08 -1.76 -0.12 0.00 0.02 0.00 0.00 54.97 53.18 2k07 s GLU 57 Cb -0.11 -1.68 0.02 0.00 0.10 0.00 0.00 34.13 32.45 2k07 s GLU 57 CO -0.01 0.30 0.60 -1.54 0.02 0.00 0.00 175.26 174.62 2k07 s SER 58 N -3.49 0.19 0.76 -0.19 1.04 -1.26 0.07 113.70 110.82 2k07 s SER 58 Ca 0.29 -1.10 -0.09 0.00 0.48 0.00 0.00 55.95 55.53 2k07 s SER 58 Cb -0.04 0.71 0.08 0.00 0.10 0.00 0.00 66.02 66.87 2k07 s SER 58 CO 0.14 -1.38 1.10 0.54 0.98 0.00 0.00 173.24 174.63 2k07 s ASN 59 N -3.08 4.56 0.51 7.02 2.20 -1.03 -4.94 114.94 120.18 2k07 s ASN 59 Ca 0.21 0.55 0.26 0.00 -0.94 0.00 0.00 52.86 52.95 2k07 s ASN 59 Cb -0.03 -1.09 1.36 0.00 -2.00 0.00 0.00 41.25 39.50 2k07 s ASN 59 CO 0.13 -1.81 2.04 0.11 -2.94 0.00 0.00 177.10 174.63 2k07 h LYS 60 N -0.85 0.00 0.00 3.55 1.79 -2.02 -0.30 116.57 118.74 2k07 h LYS 60 Ca -0.45 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 57.97 2k07 h LYS 60 Cb 1.32 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.96 2k07 h LYS 60 CO 0.61 0.14 -0.27 0.93 -1.08 0.00 0.00 179.45 179.77 2k07 h GLU 61 N 0.00 0.00 -0.71 3.15 4.39 -1.97 -3.47 114.58 115.98 2k07 h GLU 61 Ca -0.00 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.52 2k07 h GLU 61 Cb 0.39 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.99 2k07 h GLU 61 CO 0.02 0.27 -0.18 0.41 -1.16 0.00 0.00 179.01 178.36 2k07 n GLY 62 N 0.14 0.69 0.13 -3.84 0.00 -0.12 -4.92 105.19 97.26 2k07 n GLY 62 Ca -0.00 -0.60 -0.19 0.00 0.00 0.00 0.00 46.02 45.23 2k07 n GLY 62 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2k07 n THR 63 N -3.19 1.63 -3.83 2.61 -2.24 -1.26 -4.78 114.28 103.21 2k07 n THR 63 Ca -0.09 -0.63 -0.36 0.00 -2.27 0.00 0.00 64.05 60.70 2k07 n THR 63 Cb 0.39 -1.51 -0.13 0.00 -2.10 0.00 0.00 70.33 66.98 2k07 n THR 63 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2k07 s ARG 64 N -2.54 3.19 -0.12 -0.78 1.81 -1.26 -0.41 118.95 118.84 2k07 s ARG 64 Ca -0.27 -0.77 -0.01 0.00 -1.72 0.00 0.00 55.73 52.95 2k07 s ARG 64 Cb 0.08 -3.21 -0.03 0.00 -0.45 0.00 0.00 34.95 31.34 2k07 s ARG 64 CO 0.70 -0.34 -0.06 -1.58 -0.68 0.00 0.00 175.30 173.33 2k07 s TRP 65 N 1.48 2.96 -0.07 -0.53 0.52 -0.90 -2.47 118.94 119.93 2k07 s TRP 65 Ca 0.03 -0.22 0.02 0.00 0.02 0.00 0.00 56.10 55.95 2k07 s TRP 65 Cb -0.16 -1.84 0.02 0.00 -1.15 0.00 0.00 33.47 30.33 2k07 s TRP 65 CO -0.00 0.09 -0.10 -0.59 0.02 0.00 0.00 176.95 176.36 2k07 s PHE 66 N -0.11 1.33 -0.02 -1.98 -0.71 0.11 -1.37 117.98 115.23 2k07 s PHE 66 Ca 0.01 -0.50 0.05 0.00 -1.04 0.00 0.00 56.93 55.45 2k07 s PHE 66 Cb -0.13 -1.02 -0.01 0.00 -1.21 0.00 0.00 43.02 40.65 2k07 s PHE 66 CO 0.03 -0.29 -0.17 0.20 -1.34 0.00 0.00 175.22 173.64 2k07 s GLY 67 N 0.85 0.86 -0.18 1.99 0.00 0.10 -0.56 107.32 110.38 2k07 s GLY 67 Ca -0.11 -0.72 -0.09 0.00 0.00 0.00 0.00 44.72 43.80 2k07 s GLY 67 CO 0.01 -0.52 0.11 1.25 0.00 0.00 0.00 173.10 173.95 2k07 s LYS 68 N -0.25 3.97 -0.05 2.90 2.47 -0.87 -0.14 119.74 127.77 2k07 s LYS 68 Ca 0.03 -0.25 0.07 0.00 -1.56 0.00 0.00 55.97 54.26 2k07 s LYS 68 Cb -0.08 -3.30 -0.01 0.00 -1.46 0.00 0.00 37.83 32.97 2k07 s LYS 68 CO 0.00 0.39 -0.25 0.00 0.16 0.00 0.00 175.35 175.65 2k07 s TRP 70 N -0.27 1.87 -0.13 0.00 0.51 0.06 -0.87 118.94 120.11 2k07 s TRP 70 Ca -0.00 -0.94 -0.00 0.00 -2.12 0.00 0.00 56.10 53.03 2k07 s TRP 70 Cb -0.13 -1.40 0.03 0.00 -0.81 0.00 0.00 33.47 31.16 2k07 s TRP 70 CO 0.03 -0.53 -0.09 -0.47 -0.51 0.00 0.00 176.95 175.38 2k07 s TYR 71 N 1.30 1.69 -0.35 -1.98 5.04 -0.68 -4.26 117.35 118.11 2k07 s TYR 71 Ca -0.01 -0.92 -0.12 0.00 -2.44 0.00 0.00 57.07 53.58 2k07 s TYR 71 Cb -0.14 -1.33 -0.00 0.00 0.35 0.00 0.00 41.96 40.84 2k07 s TYR 71 CO -0.06 -0.57 0.22 0.42 -1.34 0.00 0.00 175.55 174.22 2k07 s ILE 72 N 1.64 5.00 -0.18 3.14 -1.09 -1.26 -3.01 121.20 125.44 2k07 s ILE 72 Ca 0.04 -0.42 -0.18 0.00 -2.23 0.00 0.00 60.65 57.86 2k07 s ILE 72 Cb -0.13 -3.63 0.05 0.00 -1.58 0.00 0.00 42.46 37.17 2k07 s ILE 72 CO -0.09 -0.07 0.51 -2.28 -1.23 0.00 0.00 174.94 171.79 2k07 s HIS 73 N 1.66 -0.55 -1.66 3.97 2.46 -1.02 -4.87 115.29 115.29 2k07 s HIS 73 Ca 0.05 1.33 0.00 0.00 0.47 0.00 0.00 55.06 56.91 2k07 s HIS 73 Cb -0.18 0.19 0.00 0.00 -0.13 0.00 0.00 32.58 32.47 2k07 s HIS 73 CO 0.09 -0.28 0.00 -3.47 -2.47 0.00 0.00 174.74 168.61 2k07 n ASP 74 N 2.71 -5.26 -0.26 9.88 2.03 -1.26 -1.30 116.55 123.09 2k07 n ASP 74 Ca -0.14 0.11 -0.03 0.00 0.52 0.00 0.00 54.79 55.25 2k07 n ASP 74 Cb 0.56 -4.33 -0.01 0.00 -0.72 0.00 0.00 41.12 36.62 2k07 n ASP 74 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2k07 n LEU 75 N -2.46 0.27 -4.65 -2.67 7.99 -1.26 -4.98 117.00 109.23 2k07 n LEU 75 Ca -0.21 0.08 -0.35 0.00 -0.01 0.00 0.00 56.01 55.53 2k07 n LEU 75 Cb 0.65 -1.92 -0.10 0.00 -0.11 0.00 0.00 43.42 41.94 2k07 n LEU 75 CO 0.26 -0.70 -0.29 -0.76 -1.51 0.00 0.00 177.39 174.39 2k07 s LEU 76 N -0.78 3.65 -0.29 2.23 1.43 -0.42 -5.06 118.68 119.45 2k07 s LEU 76 Ca 0.00 0.11 -0.13 0.00 -1.03 0.00 0.00 54.13 53.08 2k07 s LEU 76 Cb 0.00 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 2k07 s LEU 76 CO 0.00 0.29 0.28 -0.75 0.23 0.00 0.00 176.35 176.41 2k07 s LYS 77 N -0.37 3.91 -0.00 1.70 2.20 -1.26 -2.44 119.74 123.48 2k07 s LYS 77 Ca 0.08 -0.20 -0.01 0.00 -0.36 0.00 0.00 55.97 55.47 2k07 s LYS 77 Cb -0.12 -3.68 -0.00 0.00 -1.51 0.00 0.00 37.83 32.51 2k07 s LYS 77 CO 0.02 -0.27 0.03 1.52 -0.36 0.00 0.00 175.35 176.29 2k07 s TYR 78 N 1.91 0.04 0.04 4.03 1.13 -1.17 -4.98 117.35 118.36 2k07 s TYR 78 Ca 0.11 -0.08 0.02 0.00 -1.41 0.00 0.00 57.07 55.71 2k07 s TYR 78 Cb -0.16 -0.04 -0.02 0.00 -1.10 0.00 0.00 41.96 40.63 2k07 s TYR 78 CO 0.11 -0.09 -0.08 -1.83 -2.51 0.00 0.00 175.55 171.15 2k07 s GLU 79 N -0.48 0.53 0.01 -3.49 -1.05 -1.26 -1.69 118.70 111.27 2k07 s GLU 79 Ca -0.05 -0.70 0.01 0.00 -0.15 0.00 0.00 54.97 54.08 2k07 s GLU 79 Cb -0.03 -0.34 -0.01 0.00 -0.44 0.00 0.00 34.13 33.31 2k07 s GLU 79 CO -0.00 0.07 -0.03 -0.06 0.95 0.00 0.00 175.26 176.19 2k07 s PHE 80 N -1.21 0.26 -0.17 4.83 0.08 -0.05 -4.99 117.98 116.73 2k07 s PHE 80 Ca -0.08 -0.23 -0.04 0.00 0.12 0.00 0.00 56.93 56.69 2k07 s PHE 80 Cb -0.09 -0.17 -0.03 0.00 -0.57 0.00 0.00 43.02 42.16 2k07 s PHE 80 CO 0.00 -0.07 -0.02 0.16 -0.10 0.00 0.00 175.22 175.20 2k07 s ASP 81 N -0.65 4.86 0.14 1.36 -4.77 -1.26 -0.02 116.67 116.32 2k07 s ASP 81 Ca -0.05 -0.14 0.10 0.00 -3.30 0.00 0.00 52.55 49.16 2k07 s ASP 81 Cb -0.05 -1.81 -0.04 0.00 -1.09 0.00 0.00 42.92 39.94 2k07 s ASP 81 CO -0.00 0.14 -0.21 0.27 0.70 0.00 0.00 175.17 176.07 2k07 s ILE 82 N 0.55 2.64 0.04 2.11 -4.36 0.81 -3.94 121.20 119.04 2k07 s ILE 82 Ca -0.02 -1.67 0.00 0.00 -0.26 0.00 0.00 60.65 58.70 2k07 s ILE 82 Cb -0.14 -2.22 -0.03 0.00 1.25 0.00 0.00 42.46 41.32 2k07 s ILE 82 CO 0.02 0.05 -0.04 -1.83 0.24 0.00 0.00 174.94 173.38 2k07 s GLU 83 N -2.26 0.47 -0.01 0.37 -1.05 -1.26 0.00 118.70 114.96 2k07 s GLU 83 Ca 0.18 -0.87 -0.25 0.00 -0.15 0.00 0.00 54.97 53.88 2k07 s GLU 83 Cb -0.10 0.07 0.05 0.00 -0.44 0.00 0.00 34.13 33.71 2k07 s GLU 83 CO 0.09 -0.05 0.54 -0.59 0.95 0.00 0.00 175.26 176.20 2k07 s PHE 84 N -2.37 -0.47 -0.00 4.83 -0.71 -0.47 -1.95 117.98 116.84 2k07 s PHE 84 Ca -0.06 0.73 -0.05 0.00 -1.04 0.00 0.00 56.93 56.51 2k07 s PHE 84 Cb -0.03 0.31 -0.04 0.00 -1.21 0.00 0.00 43.02 42.05 2k07 s PHE 84 CO -0.04 -0.57 0.23 0.34 -1.34 0.00 0.00 175.22 173.84 2k07 s ASP 85 N -1.45 6.43 -0.71 1.98 2.15 -1.25 -2.12 116.67 121.70 2k07 s ASP 85 Ca -0.10 0.46 -0.07 0.00 0.43 0.00 0.00 52.55 53.27 2k07 s ASP 85 Cb -0.01 -2.05 0.19 0.00 -0.30 0.00 0.00 42.92 40.74 2k07 s ASP 85 CO 0.05 0.26 0.57 -0.63 -0.17 0.00 0.00 175.17 175.25 2k07 s ILE 86 N -1.31 4.46 0.96 4.11 -1.09 0.45 -4.19 121.20 124.59 2k07 s ILE 86 Ca 0.27 -2.81 -0.11 0.00 -2.23 0.00 0.00 60.65 55.77 2k07 s ILE 86 Cb -0.13 -3.83 0.17 0.00 -1.58 0.00 0.00 42.46 37.09 2k07 s ILE 86 CO 0.17 -0.94 1.09 -2.84 -1.23 0.00 0.00 174.94 171.19 2k07 s PRO 87 N -0.03 0.70 0.48 2.79 0.02 -1.26 -4.83 135.00 132.88 2k07 s PRO 87 Ca 0.18 1.10 0.32 0.00 0.02 0.00 0.00 61.00 62.61 2k07 s PRO 87 Cb -0.16 -1.72 1.34 0.00 0.02 0.00 0.00 34.50 33.98 2k07 s PRO 87 CO -0.06 -2.70 1.94 0.82 -0.33 0.00 0.00 177.00 176.67 2k07 h ILE 88 N -1.90 0.00 0.00 2.83 2.04 -1.98 -2.39 117.51 116.11 2k07 h ILE 88 Ca -0.50 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 64.97 2k07 h ILE 88 Cb 1.29 1.31 0.00 0.00 -0.74 0.00 0.00 36.82 38.68 2k07 h ILE 88 CO 0.49 0.00 0.00 0.41 0.00 0.00 0.00 178.15 179.05 2k07 n THR 89 N -2.85 0.00 -2.65 -0.27 -1.04 -1.26 -4.56 114.28 101.65 2k07 n THR 89 Ca 0.01 0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.61 2k07 n THR 89 Cb 0.26 -0.05 -0.05 0.00 -1.82 0.00 0.00 70.33 68.67 2k07 n THR 89 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 2k07 s TYR 90 N -2.00 3.83 -1.51 -1.42 5.04 -0.90 -0.35 117.35 120.05 2k07 s TYR 90 Ca 0.05 1.83 0.16 0.00 -2.44 0.00 0.00 57.07 56.66 2k07 s TYR 90 Cb 0.02 -3.10 0.56 0.00 0.35 0.00 0.00 41.96 39.80 2k07 s TYR 90 CO 0.04 0.07 1.45 -0.35 -1.34 0.00 0.00 175.55 175.42 2k07 n PRO 91 N 1.52 2.91 0.08 4.97 -0.04 -1.26 -4.55 135.00 138.62 2k07 n PRO 91 Ca -0.01 -2.25 0.09 0.00 -0.04 0.00 0.00 63.50 61.29 2k07 n PRO 91 Cb 0.46 -1.66 0.56 0.00 -0.04 0.00 0.00 33.50 32.82 2k07 n PRO 91 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2k07 h THR 92 N 3.37 0.97 -3.22 0.52 2.02 -1.12 -3.37 112.91 112.08 2k07 h THR 92 Ca 0.00 -0.08 -0.61 0.00 0.77 0.00 0.00 66.41 66.48 2k07 h THR 92 Cb 1.07 0.71 -0.35 0.00 -1.74 0.00 0.00 68.15 67.84 2k07 h THR 92 CO 0.12 0.04 -0.84 -0.89 0.37 0.00 0.00 175.52 174.32 2k07 s THR 93 N -5.25 1.67 0.41 3.16 2.01 0.53 -4.98 115.64 113.19 2k07 s THR 93 Ca -0.06 -0.74 -0.25 0.00 0.31 0.00 0.00 61.69 60.95 2k07 s THR 93 Cb 0.18 -1.52 -0.08 0.00 0.01 0.00 0.00 72.50 71.09 2k07 s THR 93 CO 0.71 0.47 1.21 0.00 -0.69 0.00 0.00 174.62 176.32 2k07 s ALA 94 N 1.02 3.16 0.69 7.40 0.00 -1.26 -4.20 121.76 128.57 2k07 s ALA 94 Ca -0.05 1.04 -0.14 0.00 0.00 0.00 0.00 51.96 52.81 2k07 s ALA 94 Cb -0.15 -3.41 0.02 0.00 0.00 0.00 0.00 23.12 19.58 2k07 s ALA 94 CO -0.03 -0.63 1.13 -2.14 0.00 0.00 0.00 175.76 174.08 2k07 s PRO 95 N -2.32 2.57 -0.31 0.00 0.02 -1.26 -5.02 135.00 128.68 2k07 s PRO 95 Ca 0.58 1.44 -0.11 0.00 0.02 0.00 0.00 61.00 62.93 2k07 s PRO 95 Cb -0.33 -1.92 -0.02 0.00 0.02 0.00 0.00 34.50 32.26 2k07 s PRO 95 CO 0.41 -1.43 0.18 -1.21 -0.33 0.00 0.00 177.00 174.61 2k07 s GLU 96 N -4.16 3.54 -0.29 5.54 2.02 -1.26 -4.99 118.70 119.10 2k07 s GLU 96 Ca 0.68 -0.59 -0.22 0.00 0.02 0.00 0.00 54.97 54.86 2k07 s GLU 96 Cb -0.22 -3.64 -0.01 0.00 0.10 0.00 0.00 34.13 30.37 2k07 s GLU 96 CO 0.44 -0.35 0.70 0.42 0.02 0.00 0.00 175.26 176.49 2k07 s ILE 97 N 1.68 4.89 -0.16 -1.63 1.09 -1.26 -3.87 121.20 121.93 2k07 s ILE 97 Ca 0.06 1.08 -0.13 0.00 -1.10 0.00 0.00 60.65 60.56 2k07 s ILE 97 Cb -0.17 -4.05 -0.23 0.00 -1.06 0.00 0.00 42.46 36.95 2k07 s ILE 97 CO 0.08 -0.15 0.30 0.00 -0.10 0.00 0.00 174.94 175.08 2k07 n ALA 98 N 5.98 0.85 -2.54 9.38 0.00 -0.82 -1.55 120.51 131.80 2k07 n ALA 98 Ca 0.01 -0.55 -0.02 0.00 0.00 0.00 0.00 53.44 52.88 2k07 n ALA 98 Cb 0.48 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 19.31 2k07 n ALA 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2k07 n VAL 99 N -3.86-10.07 0.26 0.00 0.31 -1.25 -4.18 118.33 99.54 2k07 n VAL 99 Ca -0.32 1.27 0.10 0.00 -0.01 0.00 0.00 64.34 65.37 2k07 n VAL 99 Cb 0.91 -6.54 0.70 0.00 -0.91 0.00 0.00 33.84 28.00 2k07 n VAL 99 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2k07 h PRO 100 N 2.23 0.00 -0.63 5.55 0.11 -1.91 -2.23 132.00 135.12 2k07 h PRO 100 Ca 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 2k07 h PRO 100 Cb 0.28 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.36 2k07 h PRO 100 CO 0.11 0.05 0.30 1.49 -0.21 0.00 0.00 178.00 179.74 2k07 h GLU 101 N 0.00 0.89 0.00 1.05 4.22 -1.91 -2.62 114.58 116.20 2k07 h GLU 101 Ca -0.00 -0.12 0.00 0.00 0.08 0.00 0.00 59.36 59.32 2k07 h GLU 101 Cb 0.09 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.18 2k07 h GLU 101 CO 0.01 0.69 -0.13 1.28 -2.18 0.00 0.00 179.01 178.68 2k07 n LEU 102 N -4.35 0.23 -4.61 1.64 4.77 -0.84 -4.39 117.00 109.45 2k07 n LEU 102 Ca 0.06 0.40 -0.43 0.00 -0.03 0.00 0.00 56.01 56.01 2k07 n LEU 102 Cb 0.13 -0.42 -0.03 0.00 -2.33 0.00 0.00 43.42 40.78 2k07 n LEU 102 CO 0.38 0.00 1.73 -0.62 -1.33 0.00 0.00 177.39 177.55 2k07 s ASP 103 N -3.24 5.78 0.00 -1.43 -1.08 -0.99 -1.18 116.67 114.53 2k07 s ASP 103 Ca 0.13 1.96 0.00 0.00 -0.52 0.00 0.00 52.55 54.11 2k07 s ASP 103 Cb 0.18 -2.52 0.00 0.00 -1.46 0.00 0.00 42.92 39.12 2k07 s ASP 103 CO 0.58 -1.70 0.00 0.61 0.52 0.00 0.00 175.17 175.18 2k07 n GLY 104 N 5.39 2.89 0.06 2.66 0.00 -1.26 -4.80 105.19 110.12 2k07 n GLY 104 Ca 0.26 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.25 2k07 n GLY 104 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2k07 h LYS 105 N 1.87 0.00 -6.15 1.61 1.63 -1.35 -3.45 116.57 110.73 2k07 h LYS 105 Ca 0.00 0.00 -0.57 0.00 -0.85 0.00 0.00 60.65 59.23 2k07 h LYS 105 Cb 0.00 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 31.59 2k07 h LYS 105 CO 0.00 0.00 0.91 0.99 -3.45 0.00 0.00 179.45 177.90 2k07 s THR 106 N -1.91 4.27 -1.29 1.00 2.01 -0.50 -4.92 115.64 114.30 2k07 s THR 106 Ca -0.09 1.53 -0.17 0.00 0.31 0.00 0.00 61.69 63.28 2k07 s THR 106 Cb 0.01 -3.99 0.00 0.00 0.01 0.00 0.00 72.50 68.53 2k07 s THR 106 CO 0.13 -0.14 2.07 0.00 -0.69 0.00 0.00 174.62 175.99 2k07 n ALA 107 N 6.64 4.59 -3.00 7.40 0.00 -1.26 -4.76 120.51 130.12 2k07 n ALA 107 Ca 0.14 -3.72 0.00 0.00 0.00 0.00 0.00 53.44 49.85 2k07 n ALA 107 Cb 0.45 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 16.33 2k07 n ALA 107 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2k07 n LYS 108 N 6.79 0.00 -2.07 0.00 4.81 -1.26 -5.12 118.16 121.30 2k07 n LYS 108 Ca 0.51 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.92 2k07 n LYS 108 Cb 0.41 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.43 2k07 n LYS 108 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 2k07 n MET 109 N 0.00 -2.46 -0.08 1.64 2.81 -1.26 -4.92 117.12 112.84 2k07 n MET 109 Ca 0.00 2.09 -0.07 0.00 -1.81 0.00 0.00 57.70 57.90 2k07 n MET 109 Cb 0.00 -3.16 -0.00 0.00 -0.71 0.00 0.00 33.22 29.35 2k07 n MET 109 CO 0.00 0.00 0.00 0.10 1.51 0.00 0.00 175.97 177.58 2k07 h TYR 110 N 2.17 0.19 -3.67 2.03 -0.00 -2.00 -3.46 116.97 112.24 2k07 h TYR 110 Ca -0.31 0.01 -0.14 0.00 -0.00 0.00 0.00 58.73 58.29 2k07 h TYR 110 Cb 0.69 -0.04 -0.06 0.00 -0.00 0.00 0.00 36.73 37.32 2k07 h TYR 110 CO 0.00 0.09 -0.03 1.03 -0.00 0.00 0.00 178.16 179.25 2k07 s ARG 111 N -6.17 1.92 0.00 0.10 0.52 -1.26 -4.98 118.95 109.07 2k07 s ARG 111 Ca -0.13 -1.53 0.00 0.00 -0.52 0.00 0.00 55.73 53.55 2k07 s ARG 111 Cb 0.11 0.51 0.00 0.00 0.52 0.00 0.00 34.95 36.08 2k07 s ARG 111 CO 0.70 -0.83 0.00 0.41 0.02 0.00 0.00 175.30 175.60 2k07 n GLY 112 N -0.51 1.68 1.25 -3.53 0.00 -1.26 -4.46 105.19 98.36 2k07 n GLY 112 Ca -0.02 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2k07 n GLY 112 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k07 n GLY 113 N 0.00 -0.13 3.61 -0.02 0.00 -1.26 -5.12 105.19 102.28 2k07 n GLY 113 Ca 0.00 -0.29 -0.07 0.00 0.00 0.00 0.00 46.02 45.66 2k07 n GLY 113 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k07 s LYS 114 N -2.75 1.16 0.18 1.61 -2.85 -1.26 -4.62 119.74 111.22 2k07 s LYS 114 Ca 0.00 -0.54 -0.30 0.00 -1.00 0.00 0.00 55.97 54.13 2k07 s LYS 114 Cb 0.00 0.46 -0.08 0.00 -2.06 0.00 0.00 37.83 36.15 2k07 s LYS 114 CO 0.00 -0.52 1.17 0.96 0.10 0.00 0.00 175.35 177.06 2k07 s ILE 115 N -3.40 3.65 -0.30 3.79 -4.36 -0.59 -4.91 121.20 115.07 2k07 s ILE 115 Ca 0.07 1.40 -0.15 0.00 -0.26 0.00 0.00 60.65 61.71 2k07 s ILE 115 Cb -0.02 -3.89 -0.03 0.00 1.25 0.00 0.00 42.46 39.77 2k07 s ILE 115 CO -0.04 0.23 0.35 0.00 0.24 0.00 0.00 174.94 175.71 2k07 s LEU 117 N 2.02 3.94 0.56 0.00 1.43 -1.26 -5.09 118.68 120.28 2k07 s LEU 117 Ca 0.13 -0.02 -0.18 0.00 -1.03 0.00 0.00 54.13 53.03 2k07 s LEU 117 Cb -0.16 -2.88 -0.05 0.00 0.03 0.00 0.00 46.19 43.13 2k07 s LEU 117 CO 0.11 -0.44 1.09 0.28 0.23 0.00 0.00 176.35 177.61 2k07 s THR 118 N -2.24 3.49 0.31 5.49 -1.32 -1.26 -4.94 115.64 115.16 2k07 s THR 118 Ca 0.44 0.83 0.19 0.00 -1.21 0.00 0.00 61.69 61.94 2k07 s THR 118 Cb -0.10 -3.32 0.17 0.00 -1.51 0.00 0.00 72.50 67.75 2k07 s THR 118 CO 0.33 -0.30 1.87 -0.78 -2.21 0.00 0.00 174.62 173.52 2k07 h ASP 119 N 0.88 0.00 0.96 8.08 3.58 -2.03 -2.53 116.42 125.37 2k07 h ASP 119 Ca -0.48 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.97 2k07 h ASP 119 Cb 1.24 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.29 2k07 h ASP 119 CO 0.57 0.29 0.00 0.45 -2.88 0.00 0.00 179.24 177.67 2k07 h HIS 120 N 0.00 0.00 -0.20 0.28 3.86 -2.02 -2.54 115.15 114.53 2k07 h HIS 120 Ca -0.00 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.12 2k07 h HIS 120 Cb 0.64 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.10 2k07 h HIS 120 CO 0.00 0.00 -0.26 0.35 0.86 0.00 0.00 177.93 178.88 2k07 h PHE 121 N 0.00 0.43 0.78 2.45 3.57 -1.84 -2.78 116.94 119.55 2k07 h PHE 121 Ca 0.00 -0.09 -0.03 0.00 3.53 0.00 0.00 57.97 61.38 2k07 h PHE 121 Cb 0.48 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.12 2k07 h PHE 121 CO 0.00 0.62 -0.45 0.87 -2.23 0.00 0.00 178.31 177.12 2k07 h LYS 122 N 0.34 -1.10 0.00 1.11 1.57 -1.60 0.12 116.57 117.02 2k07 h LYS 122 Ca 0.05 0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.88 2k07 h LYS 122 Cb 0.65 0.25 -0.00 0.00 0.08 0.00 0.00 32.23 33.20 2k07 h LYS 122 CO 0.05 -0.73 -0.13 -1.00 -0.57 0.00 0.00 179.45 177.06 2k07 h PRO 123 N -1.14 0.00 -0.17 3.15 0.13 -1.70 0.14 132.00 132.41 2k07 h PRO 123 Ca -0.10 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.00 2k07 h PRO 123 Cb 0.90 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 2k07 h PRO 123 CO 0.12 0.13 -0.00 1.25 -0.23 0.00 0.00 178.00 179.27 2k07 h LEU 124 N 0.00 0.29 0.09 1.56 5.85 -1.18 -2.18 115.31 119.74 2k07 h LEU 124 Ca -0.00 -0.31 -0.00 0.00 0.84 0.00 0.00 57.88 58.40 2k07 h LEU 124 Cb 0.30 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.25 2k07 h LEU 124 CO 0.02 0.54 -0.04 -0.25 -0.34 0.00 0.00 178.44 178.36 2k07 h TRP 125 N 0.04 -0.12 0.00 1.25 2.91 -0.21 -3.10 115.95 116.72 2k07 h TRP 125 Ca 0.05 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.06 2k07 h TRP 125 Cb 0.39 0.04 0.00 0.00 -0.51 0.00 0.00 29.16 29.08 2k07 h TRP 125 CO 0.04 0.24 0.00 0.00 -1.03 0.00 0.00 178.44 177.68 2k07 h ALA 126 N 0.37 1.00 0.15 2.65 0.00 -0.80 -1.72 119.26 120.92 2k07 h ALA 126 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.61 2k07 h ALA 126 Cb 0.40 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.22 2k07 h ALA 126 CO 0.02 0.00 -1.21 -0.09 0.00 0.00 0.00 179.25 177.97 2k07 h ARG 127 N 0.00 0.55 -2.76 0.00 2.43 -1.32 -3.39 114.38 109.89 2k07 h ARG 127 Ca 0.00 -0.80 -0.76 0.00 -0.81 0.00 0.00 59.98 57.62 2k07 h ARG 127 Cb 0.16 0.28 -0.32 0.00 -0.42 0.00 0.00 29.97 29.66 2k07 h ARG 127 CO 0.00 1.36 0.42 0.09 -1.51 0.00 0.00 179.97 180.34 2k07 n ASN 128 N -3.85 5.71 -3.96 -3.80 3.02 -0.65 -4.95 115.26 106.79 2k07 n ASN 128 Ca -0.14 -3.41 -0.23 0.00 -0.03 0.00 0.00 54.58 50.76 2k07 n ASN 128 Cb 0.98 -1.12 -0.17 0.00 -0.61 0.00 0.00 39.78 38.86 2k07 n ASN 128 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2k07 s VAL 129 N -2.66 0.90 0.00 2.41 1.01 -1.26 -3.99 120.40 116.81 2k07 s VAL 129 Ca 0.33 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 61.99 2k07 s VAL 129 Cb 0.07 -0.86 0.00 0.00 0.00 0.00 0.00 36.38 35.58 2k07 s VAL 129 CO 0.07 0.31 0.00 -0.81 0.00 0.00 0.00 175.10 174.67 2k07 n PRO 130 N 4.03 3.54 -0.21 2.72 -0.04 -1.26 -5.03 135.00 138.75 2k07 n PRO 130 Ca -0.22 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.24 2k07 n PRO 130 Cb 0.51 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.97 2k07 n PRO 130 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2k07 n LYS 131 N 0.00 0.00 -3.64 0.54 5.02 -1.26 -4.99 118.16 113.83 2k07 n LYS 131 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 2k07 n LYS 131 Cb 0.00 -2.27 -0.06 0.00 -0.02 0.00 0.00 35.03 32.68 2k07 n LYS 131 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2k07 s PHE 132 N -2.74 3.66 0.15 2.13 0.40 -1.26 -3.74 117.98 116.58 2k07 s PHE 132 Ca 0.00 0.80 0.00 0.00 -0.60 0.00 0.00 56.93 57.13 2k07 s PHE 132 Cb 0.00 -2.15 -0.00 0.00 0.51 0.00 0.00 43.02 41.38 2k07 s PHE 132 CO 0.00 0.65 0.18 0.41 0.70 0.00 0.00 175.22 177.16 2k07 n GLY 133 N 1.66 2.97 0.36 4.36 0.00 -1.26 -4.94 105.19 108.35 2k07 n GLY 133 Ca -0.14 -1.56 0.05 0.00 0.00 0.00 0.00 46.02 44.36 2k07 n GLY 133 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2k07 h LEU 134 N 0.00 0.86 -0.67 0.99 5.85 -1.98 -0.16 115.31 120.20 2k07 h LEU 134 Ca -0.11 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.65 2k07 h LEU 134 Cb 0.50 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.31 2k07 h LEU 134 CO 0.15 0.55 0.41 0.00 -0.34 0.00 0.00 178.44 179.21 2k07 h ALA 135 N 1.53 0.87 -0.21 1.25 0.00 -1.94 0.02 119.26 120.78 2k07 h ALA 135 Ca 0.39 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 55.12 2k07 h ALA 135 Cb 0.25 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2k07 h ALA 135 CO -0.15 0.17 -0.53 0.45 0.00 0.00 0.00 179.25 179.20 2k07 h HIS 136 N 0.81 0.75 -0.21 0.00 3.86 -1.59 -2.75 115.15 116.02 2k07 h HIS 136 Ca 0.27 -0.26 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 2k07 h HIS 136 Cb 0.03 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 2k07 h HIS 136 CO -0.05 1.00 0.13 1.25 0.86 0.00 0.00 177.93 181.13 2k07 h LEU 137 N 0.47 0.24 -0.52 2.43 5.85 -0.41 -0.65 115.31 122.73 2k07 h LEU 137 Ca 0.01 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 2k07 h LEU 137 Cb 1.08 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 2k07 h LEU 137 CO 0.10 0.19 0.17 0.24 -0.34 0.00 0.00 178.44 178.80 2k07 h MET 138 N 0.27 0.80 -0.27 1.25 2.86 -1.01 0.16 114.93 118.99 2k07 h MET 138 Ca 0.08 -0.17 -0.15 0.00 -2.06 0.00 0.00 59.70 57.40 2k07 h MET 138 Cb -0.01 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.52 2k07 h MET 138 CO -0.02 0.74 -0.43 0.00 1.06 0.00 0.00 176.91 178.27 2k07 h ALA 139 N 1.03 0.74 0.06 6.32 0.00 -1.34 0.11 119.26 126.17 2k07 h ALA 139 Ca 0.17 -0.46 -0.30 0.00 0.00 0.00 0.00 54.91 54.32 2k07 h ALA 139 Cb 0.27 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2k07 h ALA 139 CO -0.01 0.66 -1.59 -0.07 0.00 0.00 0.00 179.25 178.24 2k07 h LEU 140 N 0.55 0.19 0.00 0.00 3.38 -1.02 -3.36 115.31 115.04 2k07 h LEU 140 Ca 0.04 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2k07 h LEU 140 Cb 0.96 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.65 2k07 h LEU 140 CO 0.09 1.27 -0.48 0.61 0.09 0.00 0.00 178.44 180.02 2k07 n GLY 141 N 1.63 -0.54 0.20 0.83 0.00 0.53 -4.52 105.19 103.31 2k07 n GLY 141 Ca -0.16 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.59 2k07 n GLY 141 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2k07 h LEU 142 N -0.51 0.61 0.16 0.99 5.85 -1.42 -2.38 115.31 118.61 2k07 h LEU 142 Ca 0.00 -0.31 0.01 0.00 0.84 0.00 0.00 57.88 58.42 2k07 h LEU 142 Cb 0.48 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 2k07 h LEU 142 CO 0.00 0.77 -0.45 1.23 -0.34 0.00 0.00 178.44 179.65 2k07 h GLY 143 N 0.44 -1.18 1.86 3.75 0.00 -1.15 0.03 103.07 106.81 2k07 h GLY 143 Ca 0.10 0.62 -0.03 0.00 0.00 0.00 0.00 47.33 48.02 2k07 h GLY 143 CO 0.02 -0.31 -0.04 -2.55 0.00 0.00 0.00 176.54 173.66 2k07 h PRO 144 N -0.68 0.18 -0.32 4.80 0.11 -1.74 -2.70 132.00 131.64 2k07 h PRO 144 Ca -0.01 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.05 2k07 h PRO 144 Cb 0.66 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.73 2k07 h PRO 144 CO -0.21 0.24 0.15 2.35 -0.21 0.00 0.00 178.00 180.32 2k07 h TRP 145 N 0.18 0.47 -0.24 0.65 7.01 -0.85 -2.28 115.95 120.89 2k07 h TRP 145 Ca 0.04 -0.03 -0.05 0.00 2.11 0.00 0.00 58.89 60.97 2k07 h TRP 145 Cb 0.20 -0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 27.10 2k07 h TRP 145 CO 0.00 0.43 -0.06 -0.07 -2.79 0.00 0.00 178.44 175.95 2k07 h LEU 146 N 0.38 0.34 -1.51 0.65 3.38 -0.78 -0.27 115.31 117.51 2k07 h LEU 146 Ca 0.11 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2k07 h LEU 146 Cb 0.14 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2k07 h LEU 146 CO -0.01 0.45 0.00 0.00 0.09 0.00 0.00 178.44 178.97 2k07 h ALA 147 N 1.59 1.00 0.00 1.53 0.00 -1.11 -2.36 119.26 119.92 2k07 h ALA 147 Ca 0.08 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.78 2k07 h ALA 147 Cb 0.33 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2k07 h ALA 147 CO 0.01 0.00 -1.57 0.28 0.00 0.00 0.00 179.25 177.97 2k07 n VAL 148 N -2.79 1.31 0.08 0.00 0.31 -0.77 -4.65 118.33 111.82 2k07 n VAL 148 Ca 0.00 -0.08 -0.14 0.00 -0.01 0.00 0.00 64.34 64.12 2k07 n VAL 148 Cb 0.22 -1.97 -0.07 0.00 -0.91 0.00 0.00 33.84 31.11 2k07 n VAL 148 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2k07 h GLU 149 N -0.78 0.34 0.16 5.55 4.39 -1.15 -3.24 114.58 119.85 2k07 h GLU 149 Ca -0.31 -0.42 -0.01 0.00 0.34 0.00 0.00 59.36 58.96 2k07 h GLU 149 Cb 1.17 0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 29.95 2k07 h GLU 149 CO -0.18 1.12 -0.09 0.82 -1.16 0.00 0.00 179.01 179.52 2k07 h ILE 150 N 0.17 0.80 -0.72 3.13 1.08 -1.61 -0.82 117.51 119.54 2k07 h ILE 150 Ca -0.09 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.50 2k07 h ILE 150 Cb 1.69 0.80 -0.05 0.00 -3.07 0.00 0.00 36.82 36.20 2k07 h ILE 150 CO 0.17 0.00 0.48 -0.65 -0.69 0.00 0.00 178.15 177.46 2k07 h PRO 151 N -0.25 0.46 -0.35 2.37 0.11 -1.74 -0.13 132.00 132.47 2k07 h PRO 151 Ca -0.02 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.03 2k07 h PRO 151 Cb 0.20 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.20 2k07 h PRO 151 CO 0.02 0.30 0.07 0.22 -0.21 0.00 0.00 178.00 178.40 2k07 h ASP 152 N 0.47 0.54 0.37 -2.05 3.58 -1.40 0.14 116.42 118.07 2k07 h ASP 152 Ca 0.35 -0.25 -0.08 0.00 0.42 0.00 0.00 57.03 57.47 2k07 h ASP 152 Cb 0.70 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.60 2k07 h ASP 152 CO -0.11 0.65 -0.39 -0.07 -2.88 0.00 0.00 179.24 176.43 2k07 h LEU 153 N 0.41 0.03 -0.25 2.28 -0.00 -0.18 0.16 115.31 117.76 2k07 h LEU 153 Ca 0.11 -0.01 -0.14 0.00 -0.00 0.00 0.00 57.88 57.83 2k07 h LEU 153 Cb 0.33 -0.01 -0.00 0.00 -0.00 0.00 0.00 40.66 40.98 2k07 h LEU 153 CO 0.00 0.42 -0.40 0.40 -0.00 0.00 0.00 178.44 178.86 2k07 h ILE 154 N 0.02 1.31 -0.59 1.22 2.04 -0.75 0.13 117.51 120.90 2k07 h ILE 154 Ca -0.00 -1.60 -0.04 0.00 1.00 0.00 0.00 64.86 64.22 2k07 h ILE 154 Cb 0.70 1.72 -0.03 0.00 -0.74 0.00 0.00 36.82 38.48 2k07 h ILE 154 CO 0.05 0.51 0.22 -0.61 0.00 0.00 0.00 178.15 178.32 2k07 h GLN 155 N 0.44 0.88 -0.09 2.37 -0.00 -0.39 -2.39 115.11 115.94 2k07 h GLN 155 Ca 0.02 -0.17 -0.09 0.00 -0.00 0.00 0.00 58.65 58.41 2k07 h GLN 155 Cb 1.00 -0.14 -0.01 0.00 0.00 0.00 0.00 27.48 28.33 2k07 h GLN 155 CO 0.09 0.77 -0.36 -0.22 0.00 0.00 0.00 178.83 179.11 2k07 h LYS 156 N 0.81 0.19 -0.37 1.69 3.64 -0.64 -3.47 116.57 118.41 2k07 h LYS 156 Ca 0.19 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2k07 h LYS 156 Cb 0.22 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 2k07 h LYS 156 CO -0.01 0.53 -0.00 0.41 -2.27 0.00 0.00 179.45 178.10 2k07 n GLY 157 N -0.34 0.59 0.02 5.01 0.00 0.43 -4.96 105.19 105.94 2k07 n GLY 157 Ca -0.01 -0.81 0.11 0.00 0.00 0.00 0.00 46.02 45.30 2k07 n GLY 157 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2k07 n VAL 158 N -3.45 0.08 -2.32 1.61 0.31 -1.00 -4.71 118.33 108.84 2k07 n VAL 158 Ca -0.00 -0.24 -0.35 0.00 -0.01 0.00 0.00 64.34 63.74 2k07 n VAL 158 Cb 0.50 0.38 -0.04 0.00 -0.91 0.00 0.00 33.84 33.77 2k07 n VAL 158 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2k07 s ILE 159 N -3.23 3.73 -0.26 2.52 1.01 -1.26 -4.93 121.20 118.79 2k07 s ILE 159 Ca 0.02 -0.79 -0.24 0.00 0.00 0.00 0.00 60.65 59.64 2k07 s ILE 159 Cb 0.15 -4.65 -0.01 0.00 0.01 0.00 0.00 42.46 37.96 2k07 s ILE 159 CO 0.85 -1.49 0.79 -1.10 0.00 0.00 0.00 174.94 173.99 2k07 s GLN 160 N 5.78 4.12 0.03 2.79 -1.52 -1.26 -5.01 119.66 124.58 2k07 s GLN 160 Ca 0.58 0.80 -0.19 0.00 -1.95 0.00 0.00 55.36 54.60 2k07 s GLN 160 Cb -0.02 -3.67 0.04 0.00 -0.22 0.00 0.00 33.01 29.14 2k07 s GLN 160 CO -0.02 -0.54 0.42 -3.38 -0.25 0.00 0.00 175.29 171.53 2k07 s HIS 161 N 2.82 -0.29 0.61 0.91 -3.43 -1.26 -5.14 115.29 109.51 2k07 s HIS 161 Ca 0.33 0.30 -0.18 0.00 -0.80 0.00 0.00 55.06 54.71 2k07 s HIS 161 Cb -0.15 0.22 -0.02 0.00 -1.43 0.00 0.00 32.58 31.20 2k07 s HIS 161 CO 0.09 -0.56 1.17 0.21 -2.00 0.00 0.00 174.74 173.65 2k07 s LYS 162 N -2.27 2.90 -0.19 -0.38 2.47 -1.26 -4.40 119.74 116.60 2k07 s LYS 162 Ca -0.07 1.70 -0.00 0.00 -1.56 0.00 0.00 55.97 56.04 2k07 s LYS 162 Cb -0.01 -1.93 0.00 0.00 -1.46 0.00 0.00 37.83 34.42 2k07 s LYS 162 CO -0.01 -1.23 0.01 -1.91 0.16 0.00 0.00 175.35 172.37 2k07 n GLU 163 N -1.84 -2.17 0.00 4.03 2.13 -1.26 -4.95 120.64 116.58 2k07 n GLU 163 Ca 0.13 1.92 0.00 0.00 0.66 0.00 0.00 57.16 59.87 2k07 n GLU 163 Cb 0.50 -3.75 0.00 0.00 0.27 0.00 0.00 31.44 28.47 2k07 n GLU 163 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 2k07 n LYS 164 N 0.41 1.18 -4.01 5.31 2.85 -1.26 -4.76 118.16 117.88 2k07 n LYS 164 Ca 0.00 0.00 -0.16 0.00 -1.05 0.00 0.00 58.31 57.10 2k07 n LYS 164 Cb 0.01 -0.83 -0.15 0.00 -0.65 0.00 0.00 35.03 33.41 2k07 n LYS 164 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2k07 s ASN 166 N 0.60 4.90 -0.49 0.00 2.47 -1.26 -4.97 114.94 116.19 2k07 s ASN 166 Ca -0.06 -0.08 -0.26 0.00 0.42 0.00 0.00 52.86 52.88 2k07 s ASN 166 Cb -0.09 -0.61 -0.07 0.00 -1.45 0.00 0.00 41.25 39.03 2k07 s ASN 166 CO -0.01 -1.45 2.42 1.67 -3.72 0.00 0.00 177.10 176.01 2k07 n GLN 167 N -2.58 1.06 -2.28 0.43 0.00 -1.26 -4.88 117.38 107.86 2k07 n GLN 167 Ca 0.10 0.02 -0.41 0.00 -0.00 0.00 0.00 57.00 56.71 2k07 n GLN 167 Cb 0.60 -3.39 -0.03 0.00 0.00 0.00 0.00 30.24 27.42 2k07 n GLN 167 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2k07 s LEU 168 N 11.99 4.46 0.05 1.69 1.43 -1.26 -5.03 118.68 132.02 2k07 s LEU 168 Ca 0.99 2.43 0.04 0.00 -1.03 0.00 0.00 54.13 56.57 2k07 s LEU 168 Cb -0.21 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.34 2k07 s LEU 168 CO 0.27 -0.40 -0.02 -1.83 0.23 0.00 0.00 176.35 174.61 2k07 s GLU 169 N -1.06 2.58 -0.65 1.70 -1.05 -1.26 -5.05 118.70 113.91 2k07 s GLU 169 Ca 0.50 -0.77 -0.27 0.00 -0.15 0.00 0.00 54.97 54.28 2k07 s GLU 169 Cb -0.36 -2.55 0.00 0.00 -0.44 0.00 0.00 34.13 30.78 2k07 s GLU 169 CO 0.44 0.57 1.59 -1.58 0.95 0.00 0.00 175.26 177.23 2k07 s HIS 170 N -1.19 1.97 -0.45 4.83 5.65 -1.26 -4.82 115.29 120.02 2k07 s HIS 170 Ca 0.22 0.43 -0.34 0.00 0.25 0.00 0.00 55.06 55.63 2k07 s HIS 170 Cb -0.11 -4.33 -0.15 0.00 -1.18 0.00 0.00 32.58 26.80 2k07 s HIS 170 CO 0.14 -2.20 1.76 -2.39 -0.65 0.00 0.00 174.74 171.41 2k07 n HIS 171 N 11.09 0.87 0.00 3.88 -0.00 -1.26 -4.74 115.22 125.05 2k07 n HIS 171 Ca 0.13 0.58 0.00 0.00 -0.00 0.00 0.00 57.72 58.43 2k07 n HIS 171 Cb 0.50 -1.84 0.00 0.00 -0.00 0.00 0.00 29.99 28.66 2k07 n HIS 171 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2k07 n HIS 172 N 6.27 0.00 0.05 -1.40 1.44 -1.26 -4.82 115.22 115.50 2k07 n HIS 172 Ca 0.45 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.94 2k07 n HIS 172 Cb -0.03 0.00 -0.15 0.00 0.12 0.00 0.00 29.99 29.94 2k07 n HIS 172 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 2k07 h HIS 173 N 0.00 0.63 -1.92 -1.40 6.17 -1.98 -3.45 115.15 113.19 2k07 h HIS 173 Ca 0.00 -0.46 -0.44 0.00 0.71 0.00 0.00 60.37 60.18 2k07 h HIS 173 Cb 0.17 -0.03 0.01 0.00 2.52 0.00 0.00 27.41 30.08 2k07 h HIS 173 CO 0.00 1.72 -0.28 -1.01 0.71 0.00 0.00 177.93 179.07 2k07 s HIS 174 N -2.57 3.09 0.00 5.26 3.76 -1.26 -5.26 115.29 118.30 2k07 s HIS 174 Ca -0.19 -0.17 0.00 0.00 -0.15 0.00 0.00 55.06 54.56 2k07 s HIS 174 Cb 0.06 -2.11 0.00 0.00 1.11 0.00 0.00 32.58 31.63 2k07 s HIS 174 CO 0.82 -0.14 0.22 -2.39 -0.85 0.00 0.00 174.74 172.40