#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k07 n ALA 2 N 0.00 4.46 0.46 3.04 0.00 -1.26 -4.35 120.51 122.86 2k07 n ALA 2 Ca 0.00 -0.58 0.02 0.00 0.00 0.00 0.00 53.44 52.87 2k07 n ALA 2 Cb 0.00 -0.77 0.11 0.00 0.00 0.00 0.00 19.45 18.79 2k07 n ALA 2 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2k07 n ASP 3 N -1.61 2.36 -0.32 0.00 5.75 -1.26 -4.29 116.55 117.18 2k07 n ASP 3 Ca 0.03 -2.27 0.04 0.00 -0.01 0.00 0.00 54.79 52.58 2k07 n ASP 3 Cb 0.37 -0.55 0.19 0.00 -1.03 0.00 0.00 41.12 40.09 2k07 n ASP 3 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 2k07 h GLU 4 N 1.10 0.87 -0.58 0.11 5.08 -2.00 -1.15 114.58 118.01 2k07 h GLU 4 Ca 0.01 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2k07 h GLU 4 Cb 0.94 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 2k07 h GLU 4 CO 0.14 0.58 0.36 0.00 -1.00 0.00 0.00 179.01 179.09 2k07 h ALA 5 N 1.48 0.73 -0.69 3.43 0.00 -1.96 0.36 119.26 122.61 2k07 h ALA 5 Ca 0.43 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 2k07 h ALA 5 Cb 0.37 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2k07 h ALA 5 CO -0.24 0.20 0.40 1.15 0.00 0.00 0.00 179.25 180.76 2k07 h THR 6 N 0.78 1.20 -0.61 0.00 2.02 -1.58 -1.12 112.91 113.60 2k07 h THR 6 Ca 0.21 -0.47 -0.06 0.00 0.77 0.00 0.00 66.41 66.85 2k07 h THR 6 Cb -0.05 0.26 -0.03 0.00 -1.74 0.00 0.00 68.15 66.60 2k07 h THR 6 CO -0.04 0.22 0.13 0.03 0.37 0.00 0.00 175.52 176.22 2k07 h ARG 7 N 0.94 0.97 -0.79 6.66 2.47 -0.79 -2.63 114.38 121.22 2k07 h ARG 7 Ca 0.25 -0.23 -0.04 0.00 -1.26 0.00 0.00 59.98 58.70 2k07 h ARG 7 Cb -0.01 -0.13 -0.04 0.00 -1.65 0.00 0.00 29.97 28.15 2k07 h ARG 7 CO -0.04 0.88 0.34 0.00 0.56 0.00 0.00 179.97 181.70 2k07 h ARG 8 N 0.92 1.17 -0.32 0.04 3.08 -0.29 -1.20 114.38 117.78 2k07 h ARG 8 Ca 0.19 -0.20 0.02 0.00 0.07 0.00 0.00 59.98 60.06 2k07 h ARG 8 Cb 0.36 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.19 2k07 h ARG 8 CO 0.00 0.93 0.16 0.28 -1.07 0.00 0.00 179.97 180.28 2k07 h VAL 9 N 1.14 0.99 0.00 2.04 2.07 -0.88 0.20 116.25 121.81 2k07 h VAL 9 Ca 0.27 -0.11 -0.04 0.00 0.82 0.00 0.00 66.70 67.63 2k07 h VAL 9 Cb 0.19 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 2k07 h VAL 9 CO -0.03 0.06 -0.21 0.58 0.02 0.00 0.00 177.57 178.00 2k07 h VAL 10 N 0.33 0.72 0.22 2.57 2.07 -1.18 -1.74 116.25 119.24 2k07 h VAL 10 Ca 0.13 -0.86 -0.32 0.00 0.82 0.00 0.00 66.70 66.47 2k07 h VAL 10 Cb 0.04 1.53 0.03 0.00 -1.52 0.00 0.00 31.29 31.38 2k07 h VAL 10 CO -0.09 0.20 -1.48 0.28 0.02 0.00 0.00 177.57 176.50 2k07 h SER 11 N 0.00 0.73 1.17 0.57 0.02 -0.31 -3.30 113.55 112.43 2k07 h SER 11 Ca -0.00 -0.93 0.00 0.00 -0.84 0.00 0.00 61.79 60.02 2k07 h SER 11 Cb 0.52 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.82 2k07 h SER 11 CO 0.03 1.70 0.00 -0.62 -1.14 0.00 0.00 176.83 176.79 2k07 n GLU 12 N -3.74 0.12 -3.50 3.45 1.02 0.61 -4.16 120.64 114.44 2k07 n GLU 12 Ca -0.19 0.12 -0.42 0.00 -0.02 0.00 0.00 57.16 56.65 2k07 n GLU 12 Cb 1.06 -1.64 -0.05 0.00 -0.02 0.00 0.00 31.44 30.78 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 -3.06 4.82 0.59 -3.67 1.01 -0.67 -4.71 121.20 115.52 2k07 s ILE 13 Ca 0.12 -2.73 -0.18 0.00 0.00 0.00 0.00 60.65 57.86 2k07 s ILE 13 Cb 0.15 -4.03 -0.11 0.00 0.01 0.00 0.00 42.46 38.49 2k07 s ILE 13 CO 0.54 -0.97 0.21 -2.65 0.00 0.00 0.00 174.94 172.06 2k07 n PRO 14 N 3.70 0.26 -3.12 2.79 -0.02 -1.26 -4.82 135.00 132.53 2k07 n PRO 14 Ca 0.12 0.10 -0.36 0.00 -2.02 0.00 0.00 63.50 61.35 2k07 n PRO 14 Cb 0.43 -1.42 -0.06 0.00 -0.02 0.00 0.00 33.50 32.43 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 -1.87 4.60 0.04 -1.45 -7.23 -1.26 -4.86 120.40 108.37 2k07 s VAL 15 Ca 0.62 1.21 -0.25 0.00 -1.81 0.00 0.00 61.98 61.76 2k07 s VAL 15 Cb -0.43 -3.82 -0.05 0.00 0.56 0.00 0.00 36.38 32.63 2k07 s VAL 15 CO 0.61 0.16 0.75 -0.76 -0.31 0.00 0.00 175.10 175.55 2k07 s LEU 16 N -2.09 4.45 0.06 1.32 1.02 -1.17 -4.95 118.68 117.32 2k07 s LEU 16 Ca 0.44 1.42 0.02 0.00 0.02 0.00 0.00 54.13 56.03 2k07 s LEU 16 Cb -0.16 -3.20 -0.25 0.00 0.02 0.00 0.00 46.19 42.60 2k07 s LEU 16 CO 0.20 0.02 1.07 0.11 0.02 0.00 0.00 176.35 177.78 2k07 h LYS 17 N 5.66 0.14 -6.30 1.70 1.57 -1.95 -3.17 116.57 114.22 2k07 h LYS 17 Ca -0.44 -0.24 -0.54 0.00 -1.87 0.00 0.00 60.65 57.55 2k07 h LYS 17 Cb 1.20 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 33.57 2k07 h LYS 17 CO 0.71 1.04 0.15 0.99 -0.57 0.00 0.00 179.45 181.77 2k07 s THR 18 N -2.66 4.71 -0.36 -0.16 2.01 -1.26 -4.91 115.64 113.00 2k07 s THR 18 Ca -0.03 1.60 -0.00 0.00 0.31 0.00 0.00 61.69 63.57 2k07 s THR 18 Cb 0.08 -4.10 0.13 0.00 0.01 0.00 0.00 72.50 68.62 2k07 s THR 18 CO 0.85 0.39 0.19 0.21 -0.69 0.00 0.00 174.62 175.56 2k07 s ASN 19 N -0.19 3.46 0.12 3.53 2.47 -1.26 -4.78 114.94 118.29 2k07 s ASN 19 Ca 0.38 -2.09 -0.25 0.00 0.42 0.00 0.00 52.86 51.31 2k07 s ASN 19 Cb -0.21 -0.68 0.07 0.00 -1.45 0.00 0.00 41.25 38.99 2k07 s ASN 19 CO 0.23 -0.33 0.71 0.00 -3.72 0.00 0.00 177.10 173.99 2k07 s ALA 20 N 1.09 -1.63 0.39 1.71 0.00 -1.26 -4.92 121.76 117.14 2k07 s ALA 20 Ca 0.15 0.55 0.05 0.00 0.00 0.00 0.00 51.96 52.72 2k07 s ALA 20 Cb -0.21 0.74 0.05 0.00 0.00 0.00 0.00 23.12 23.70 2k07 s ALA 20 CO -0.09 -0.78 0.45 0.41 0.00 0.00 0.00 175.76 175.74 2k07 n GLY 21 N -0.35 2.29 0.00 0.00 0.00 -0.99 -4.18 105.19 101.96 2k07 n GLY 21 Ca -0.13 -2.22 0.04 0.00 0.00 0.00 0.00 46.02 43.71 2k07 n GLY 21 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2k07 n PRO 22 N -1.68 0.10 0.21 1.61 -0.02 -1.26 -2.08 135.00 131.88 2k07 n PRO 22 Ca 0.06 0.24 0.09 0.00 -2.02 0.00 0.00 63.50 61.87 2k07 n PRO 22 Cb 0.42 -1.50 0.44 0.00 -0.02 0.00 0.00 33.50 32.83 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 -4.15 -0.52 3.08 -1.94 -3.37 114.38 107.48 2k07 h ARG 23 Ca 0.00 0.00 -0.69 0.00 0.07 0.00 0.00 59.98 59.36 2k07 h ARG 23 Cb 0.09 0.00 -0.36 0.00 0.08 0.00 0.00 29.97 29.78 2k07 h ARG 23 CO 0.00 0.26 -0.51 0.34 -1.07 0.00 0.00 179.97 178.99 2k07 s ASP 24 N -6.27 5.16 0.36 7.04 -1.08 -0.88 -4.96 116.67 116.04 2k07 s ASP 24 Ca 0.00 -2.36 0.07 0.00 -0.52 0.00 0.00 52.55 49.75 2k07 s ASP 24 Cb 0.11 -1.81 0.70 0.00 -1.46 0.00 0.00 42.92 40.45 2k07 s ASP 24 CO 0.65 -0.46 1.89 0.03 0.52 0.00 0.00 175.17 177.80 2k07 h ARG 25 N 7.60 0.34 -0.21 4.34 3.08 -1.83 0.43 114.38 128.13 2k07 h ARG 25 Ca -0.08 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 59.82 2k07 h ARG 25 Cb 1.01 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.00 2k07 h ARG 25 CO 0.69 0.45 -0.11 1.49 -1.07 0.00 0.00 179.97 181.43 2k07 h GLU 26 N 0.32 0.45 0.00 0.04 4.81 -1.95 -0.04 114.58 118.21 2k07 h GLU 26 Ca 0.07 -0.20 -0.09 0.00 -0.13 0.00 0.00 59.36 59.01 2k07 h GLU 26 Cb 0.38 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 2k07 h GLU 26 CO 0.02 0.73 -0.41 -0.07 -0.73 0.00 0.00 179.01 178.56 2k07 h LEU 27 N 0.15 0.00 -0.61 1.64 -0.00 -1.87 -3.03 115.31 111.58 2k07 h LEU 27 Ca 0.05 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 57.88 2k07 h LEU 27 Cb 0.60 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.24 2k07 h LEU 27 CO 0.03 0.41 0.19 -0.25 -0.00 0.00 0.00 178.44 178.81 2k07 h TRP 28 N 0.00 0.99 -0.79 1.13 2.91 0.26 0.37 115.95 120.82 2k07 h TRP 28 Ca -0.00 -0.10 0.01 0.00 1.13 0.00 0.00 58.89 59.92 2k07 h TRP 28 Cb 0.90 -0.29 -0.04 0.00 -0.51 0.00 0.00 29.16 29.22 2k07 h TRP 28 CO 0.00 0.82 0.52 0.28 -1.03 0.00 0.00 178.44 179.03 2k07 h VAL 29 N 0.88 1.20 -0.37 2.65 2.07 -0.90 -0.61 116.25 121.18 2k07 h VAL 29 Ca 0.20 -0.38 -0.07 0.00 0.82 0.00 0.00 66.70 67.26 2k07 h VAL 29 Cb 0.30 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.10 2k07 h VAL 29 CO -0.01 0.20 -0.06 1.56 0.02 0.00 0.00 177.57 179.28 2k07 h GLN 30 N 1.07 0.69 -0.04 1.57 4.20 -1.29 -1.87 115.11 119.43 2k07 h GLN 30 Ca 0.29 -0.25 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 2k07 h GLN 30 Cb -0.12 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 2k07 h GLN 30 CO -0.06 0.83 -0.09 0.07 -0.67 0.00 0.00 178.83 178.90 2k07 h ARG 31 N 0.49 0.06 -0.04 1.46 -0.00 -0.44 -0.98 114.38 114.93 2k07 h ARG 31 Ca 0.10 -0.01 -0.00 0.00 -0.00 0.00 0.00 59.98 60.06 2k07 h ARG 31 Cb 0.56 -0.01 -0.00 0.00 -0.00 0.00 0.00 29.97 30.51 2k07 h ARG 31 CO 0.03 0.16 0.01 -0.07 -0.00 0.00 0.00 179.97 180.10 2k07 h LEU 32 N 0.06 0.06 -0.71 0.08 -0.00 -0.66 -1.11 115.31 113.02 2k07 h LEU 32 Ca 0.01 -0.26 -0.10 0.00 -0.00 0.00 0.00 57.88 57.53 2k07 h LEU 32 Cb 0.21 -0.02 -0.02 0.00 -0.00 0.00 0.00 40.66 40.83 2k07 h LEU 32 CO 0.01 0.31 -0.06 0.07 -0.00 0.00 0.00 178.44 178.77 2k07 h LYS 33 N -0.19 0.93 0.10 1.13 2.10 -0.85 0.30 116.57 120.09 2k07 h LYS 33 Ca 0.01 -0.30 -0.00 0.00 -2.00 0.00 0.00 60.65 58.35 2k07 h LYS 33 Cb 0.27 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 31.53 2k07 h LYS 33 CO 0.00 0.96 -0.05 0.93 -2.00 0.00 0.00 179.45 179.29 2k07 h GLU 34 N 0.84 -0.13 -0.63 0.07 4.39 -1.17 -0.41 114.58 117.54 2k07 h GLU 34 Ca 0.15 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.82 2k07 h GLU 34 Cb 0.58 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.23 2k07 h GLU 34 CO 0.04 -0.00 0.24 0.93 -1.16 0.00 0.00 179.01 179.06 2k07 h GLU 35 N -0.23 0.95 -0.53 2.33 4.39 -1.09 -2.73 114.58 117.67 2k07 h GLU 35 Ca -0.01 -0.18 0.02 0.00 0.34 0.00 0.00 59.36 59.53 2k07 h GLU 35 Cb 0.19 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.65 2k07 h GLU 35 CO 0.02 0.81 0.32 -0.92 -1.16 0.00 0.00 179.01 178.08 2k07 h TYR 36 N 0.89 0.60 -0.71 4.33 5.03 -0.16 0.45 116.97 127.39 2k07 h TYR 36 Ca 0.21 0.02 0.02 0.00 2.58 0.00 0.00 58.73 61.56 2k07 h TYR 36 Cb 0.22 -0.20 -0.04 0.00 1.55 0.00 0.00 36.73 38.26 2k07 h TYR 36 CO 0.01 0.35 0.45 1.96 -1.32 0.00 0.00 178.16 179.62 2k07 h GLN 37 N 0.64 0.87 -0.56 1.82 1.08 -0.97 0.19 115.11 118.19 2k07 h GLN 37 Ca 0.21 -0.05 -0.10 0.00 -1.45 0.00 0.00 58.65 57.26 2k07 h GLN 37 Cb 0.01 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.22 2k07 h GLN 37 CO -0.09 0.58 -0.03 0.77 -0.95 0.00 0.00 178.83 179.10 2k07 h SER 38 N 0.90 1.00 -0.08 1.46 0.02 -1.04 -2.61 113.55 113.19 2k07 h SER 38 Ca 0.28 -0.32 -0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2k07 h SER 38 Cb -0.02 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 62.25 2k07 h SER 38 CO -0.10 1.08 0.03 -0.07 -1.14 0.00 0.00 176.83 176.64 2k07 h LEU 39 N 0.90 0.11 -0.42 5.07 3.38 0.58 -0.88 115.31 124.04 2k07 h LEU 39 Ca 0.15 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 58.03 2k07 h LEU 39 Cb 0.59 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.26 2k07 h LEU 39 CO 0.04 0.23 0.12 0.40 0.09 0.00 0.00 178.44 179.32 2k07 h ILE 40 N -0.02 0.83 -0.82 1.22 2.04 -0.63 0.34 117.51 120.48 2k07 h ILE 40 Ca 0.03 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 2k07 h ILE 40 Cb 0.15 0.53 -0.04 0.00 -0.74 0.00 0.00 36.82 36.73 2k07 h ILE 40 CO -0.00 0.05 0.45 -0.09 0.00 0.00 0.00 178.15 178.56 2k07 h ARG 41 N 0.27 1.13 -0.09 2.37 9.65 -1.32 0.24 114.38 126.64 2k07 h ARG 41 Ca 0.20 -0.13 -0.08 0.00 -1.10 0.00 0.00 59.98 58.87 2k07 h ARG 41 Cb 0.21 -0.22 0.00 0.00 -1.39 0.00 0.00 29.97 28.57 2k07 h ARG 41 CO -0.23 0.83 -0.24 -0.92 2.80 0.00 0.00 179.97 182.21 2k07 h TYR 42 N 1.13 0.42 -0.61 2.20 3.20 -0.37 -0.66 116.97 122.28 2k07 h TYR 42 Ca 0.29 -0.16 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 2k07 h TYR 42 Cb 0.02 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.19 2k07 h TYR 42 CO 0.00 0.86 0.22 0.28 -1.64 0.00 0.00 178.16 177.88 2k07 h VAL 43 N -0.14 1.22 0.05 1.81 2.07 -0.26 0.16 116.25 121.17 2k07 h VAL 43 Ca -0.00 -0.72 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 2k07 h VAL 43 Cb 0.85 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 2k07 h VAL 43 CO 0.05 0.28 -0.02 -0.08 0.02 0.00 0.00 177.57 177.82 2k07 h GLU 44 N 0.88 -0.06 -0.41 1.57 4.57 -0.92 -1.73 114.58 118.47 2k07 h GLU 44 Ca 0.20 0.00 0.07 0.00 -1.18 0.00 0.00 59.36 58.46 2k07 h GLU 44 Cb 0.20 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 28.74 2k07 h GLU 44 CO -0.02 0.08 0.02 -0.91 -1.18 0.00 0.00 179.01 177.01 2k07 h ASN 45 N -0.20 -0.13 -0.79 1.04 2.35 -0.54 0.49 115.58 117.79 2k07 h ASN 45 Ca -0.01 0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 55.80 2k07 h ASN 45 Cb 0.18 0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.67 2k07 h ASN 45 CO 0.01 -0.03 0.37 0.78 -1.65 0.00 0.00 177.43 176.91 2k07 h ASN 46 N 0.13 1.05 -0.20 5.81 4.21 -0.58 0.28 115.58 126.26 2k07 h ASN 46 Ca 0.20 -0.13 -0.13 0.00 1.21 0.00 0.00 56.30 57.45 2k07 h ASN 46 Cb 0.28 -0.27 -0.01 0.00 -1.12 0.00 0.00 38.32 37.20 2k07 h ASN 46 CO -0.32 0.90 -0.33 0.11 -1.29 0.00 0.00 177.43 176.50 2k07 h LYS 47 N 1.14 0.72 -0.29 0.81 1.57 -0.80 0.37 116.57 120.08 2k07 h LYS 47 Ca 0.27 -0.34 -0.09 0.00 -1.87 0.00 0.00 60.65 58.63 2k07 h LYS 47 Cb 0.14 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 2k07 h LYS 47 CO -0.03 0.95 -0.18 -0.91 -0.57 0.00 0.00 179.45 178.70 2k07 h ASN 48 N 0.60 0.52 0.11 0.86 2.35 -0.23 -2.11 115.58 117.68 2k07 h ASN 48 Ca 0.06 -0.16 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 2k07 h ASN 48 Cb 0.85 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 39.08 2k07 h ASN 48 CO 0.07 0.72 -0.05 0.00 -1.65 0.00 0.00 177.43 176.53 2k07 n ALA 49 N -2.48 2.69 -2.34 -0.83 0.00 0.91 -4.91 120.51 113.54 2k07 n ALA 49 Ca 0.00 -0.33 -0.19 0.00 0.00 0.00 0.00 53.44 52.92 2k07 n ALA 49 Cb 0.37 -1.30 -0.01 0.00 0.00 0.00 0.00 19.45 18.50 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 -0.50 -5.55 -2.75 0.00 2.03 -0.20 -4.91 116.55 104.67 2k07 n ASP 50 Ca 0.19 -0.00 -0.25 0.00 0.52 0.00 0.00 54.79 55.24 2k07 n ASP 50 Cb 0.27 -4.60 -0.02 0.00 -0.72 0.00 0.00 41.12 36.05 2k07 n ASP 50 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2k07 n ASN 51 N -1.68 4.10 -4.46 1.67 4.05 0.11 -5.00 115.26 114.05 2k07 n ASN 51 Ca -0.23 -3.58 -0.43 0.00 0.45 0.00 0.00 54.58 50.78 2k07 n ASN 51 Cb 0.67 -0.52 -0.06 0.00 1.23 0.00 0.00 39.78 41.10 2k07 n ASN 51 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 2k07 s ASP 52 N -3.40 6.24 0.00 1.20 2.15 -1.24 -4.78 116.67 116.83 2k07 s ASP 52 Ca 0.46 -0.78 0.00 0.00 0.43 0.00 0.00 52.55 52.67 2k07 s ASP 52 Cb 0.35 -2.30 0.00 0.00 -0.30 0.00 0.00 42.92 40.67 2k07 s ASP 52 CO -0.14 -0.86 0.62 -2.67 -0.17 0.00 0.00 175.17 171.94 2k07 n TRP 53 N 6.20 0.00 -3.66 -5.34 4.27 -1.26 -5.02 117.44 112.63 2k07 n TRP 53 Ca -0.05 -0.19 -0.15 0.00 -3.89 0.00 0.00 57.50 53.22 2k07 n TRP 53 Cb 0.46 -0.02 -0.08 0.00 -1.36 0.00 0.00 31.31 30.31 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 -0.37 -0.46 -0.11 -2.67 -0.71 -1.26 -0.33 117.98 112.06 2k07 s PHE 54 Ca 0.00 0.90 0.01 0.00 -1.04 0.00 0.00 56.93 56.80 2k07 s PHE 54 Cb 0.00 0.23 0.02 0.00 -1.21 0.00 0.00 43.02 42.06 2k07 s PHE 54 CO 0.00 -0.43 -0.13 0.50 -1.34 0.00 0.00 175.22 173.82 2k07 s ARG 55 N -0.80 2.00 -0.13 1.99 6.06 0.16 -4.99 118.95 123.24 2k07 s ARG 55 Ca -0.09 -0.46 0.02 0.00 -2.50 0.00 0.00 55.73 52.70 2k07 s ARG 55 Cb -0.03 -1.80 0.01 0.00 0.06 0.00 0.00 34.95 33.19 2k07 s ARG 55 CO 0.05 -0.14 -0.20 -0.51 -2.50 0.00 0.00 175.30 172.00 2k07 s LEU 56 N 1.25 1.99 0.06 -0.88 1.43 -1.26 -0.85 118.68 120.42 2k07 s LEU 56 Ca -0.02 -0.56 0.03 0.00 -1.03 0.00 0.00 54.13 52.55 2k07 s LEU 56 Cb -0.14 -1.35 -0.03 0.00 0.03 0.00 0.00 46.19 44.71 2k07 s LEU 56 CO -0.05 0.05 -0.09 -1.61 0.23 0.00 0.00 176.35 174.89 2k07 s GLU 57 N 0.92 0.66 0.20 1.70 2.02 0.10 -4.96 118.70 119.34 2k07 s GLU 57 Ca -0.06 -0.94 0.08 0.00 0.02 0.00 0.00 54.97 54.08 2k07 s GLU 57 Cb -0.15 -0.39 -0.05 0.00 0.10 0.00 0.00 34.13 33.64 2k07 s GLU 57 CO -0.03 0.06 -0.15 -1.12 0.02 0.00 0.00 175.26 174.04 2k07 s SER 58 N -1.96 2.61 0.96 -0.19 0.01 -1.26 -1.11 113.70 112.76 2k07 s SER 58 Ca -0.03 -1.00 -0.14 0.00 1.31 0.00 0.00 55.95 56.09 2k07 s SER 58 Cb -0.07 -0.14 0.17 0.00 0.21 0.00 0.00 66.02 66.19 2k07 s SER 58 CO -0.00 -0.15 1.18 0.54 0.41 0.00 0.00 173.24 175.22 2k07 s ASN 59 N -3.23 3.07 0.15 2.44 2.20 -1.22 -4.90 114.94 113.45 2k07 s ASN 59 Ca 0.22 0.73 0.19 0.00 -0.94 0.00 0.00 52.86 53.05 2k07 s ASN 59 Cb -0.02 -1.11 0.82 0.00 -2.00 0.00 0.00 41.25 38.94 2k07 s ASN 59 CO 0.07 -2.80 1.59 0.29 -2.94 0.00 0.00 177.10 173.31 2k07 n LYS 60 N -3.89 0.11 0.08 3.55 4.01 -1.26 -0.99 118.16 119.77 2k07 n LYS 60 Ca 0.10 0.37 0.01 0.00 -0.51 0.00 0.00 58.31 58.28 2k07 n LYS 60 Cb 0.59 -1.72 -0.04 0.00 -0.51 0.00 0.00 35.03 33.36 2k07 n LYS 60 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 2k07 h GLU 61 N 0.00 0.00 -0.29 1.97 5.08 -1.96 -3.47 114.58 115.90 2k07 h GLU 61 Ca 0.00 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.23 2k07 h GLU 61 Cb 0.29 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.49 2k07 h GLU 61 CO 0.00 0.40 -0.11 0.41 -1.00 0.00 0.00 179.01 178.71 2k07 n GLY 62 N 1.32 0.84 0.07 -3.84 0.00 -0.16 -4.91 105.19 98.51 2k07 n GLY 62 Ca -0.04 -0.53 -0.08 0.00 0.00 0.00 0.00 46.02 45.37 2k07 n GLY 62 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2k07 h THR 63 N 0.00 1.39 -3.38 2.61 1.35 -1.92 -3.45 112.91 109.51 2k07 h THR 63 Ca -0.13 -3.15 -0.52 0.00 -0.55 0.00 0.00 66.41 62.07 2k07 h THR 63 Cb 0.49 2.70 -0.34 0.00 -1.73 0.00 0.00 68.15 69.27 2k07 h THR 63 CO 0.19 0.80 -0.81 -0.13 -0.25 0.00 0.00 175.52 175.31 2k07 s ARG 64 N -2.67 1.69 -0.17 4.72 0.52 -1.26 -1.20 118.95 120.58 2k07 s ARG 64 Ca -0.01 -0.39 -0.03 0.00 -0.52 0.00 0.00 55.73 54.77 2k07 s ARG 64 Cb 0.09 -1.45 -0.02 0.00 0.52 0.00 0.00 34.95 34.09 2k07 s ARG 64 CO 0.82 -0.02 -0.05 -1.58 0.02 0.00 0.00 175.30 174.49 2k07 s TRP 65 N 0.83 2.96 0.19 -0.53 0.52 0.18 -3.40 118.94 119.70 2k07 s TRP 65 Ca -0.11 -0.57 0.01 0.00 0.02 0.00 0.00 56.10 55.44 2k07 s TRP 65 Cb -0.15 -1.99 -0.05 0.00 -1.15 0.00 0.00 33.47 30.13 2k07 s TRP 65 CO 0.02 -0.25 0.06 -0.59 0.02 0.00 0.00 176.95 176.21 2k07 s PHE 66 N 0.76 1.23 0.00 -1.98 -0.71 -0.26 -0.10 117.98 116.92 2k07 s PHE 66 Ca -0.02 -1.16 0.00 0.00 -1.04 0.00 0.00 56.93 54.71 2k07 s PHE 66 Cb -0.15 -0.69 0.00 0.00 -1.21 0.00 0.00 43.02 40.97 2k07 s PHE 66 CO 0.02 -0.37 0.00 0.41 -1.34 0.00 0.00 175.22 173.94 2k07 n GLY 67 N -0.28 -0.72 3.35 1.99 0.00 -0.13 0.02 105.19 109.43 2k07 n GLY 67 Ca -0.03 -0.18 -0.11 0.00 0.00 0.00 0.00 46.02 45.69 2k07 n GLY 67 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k07 s LYS 68 N -1.02 0.50 -0.16 1.61 2.20 -0.03 -1.93 119.74 120.90 2k07 s LYS 68 Ca 0.00 0.77 0.02 0.00 -0.36 0.00 0.00 55.97 56.39 2k07 s LYS 68 Cb 0.00 0.13 0.01 0.00 -1.51 0.00 0.00 37.83 36.46 2k07 s LYS 68 CO 0.00 -0.11 -0.20 0.00 -0.36 0.00 0.00 175.35 174.67 2k07 s TRP 70 N 1.04 2.00 -0.07 0.00 -2.14 0.55 0.10 118.94 120.43 2k07 s TRP 70 Ca -0.01 -0.79 0.05 0.00 2.66 0.00 0.00 56.10 58.01 2k07 s TRP 70 Cb -0.14 -1.38 -0.01 0.00 -3.10 0.00 0.00 33.47 28.84 2k07 s TRP 70 CO -0.07 -0.35 -0.23 -0.47 -2.66 0.00 0.00 176.95 173.17 2k07 s TYR 71 N 0.51 2.35 -0.26 1.66 5.04 -0.98 -4.61 117.35 121.05 2k07 s TYR 71 Ca -0.17 -0.76 -0.14 0.00 -2.44 0.00 0.00 57.07 53.56 2k07 s TYR 71 Cb -0.17 -1.55 -0.04 0.00 0.35 0.00 0.00 41.96 40.55 2k07 s TYR 71 CO 0.06 -0.26 0.31 0.42 -1.34 0.00 0.00 175.55 174.75 2k07 s ILE 72 N -0.00 5.23 -0.16 3.14 -1.09 -1.26 -3.29 121.20 123.76 2k07 s ILE 72 Ca -0.07 0.46 -0.04 0.00 -2.23 0.00 0.00 60.65 58.76 2k07 s ILE 72 Cb -0.14 -3.64 0.08 0.00 -1.58 0.00 0.00 42.46 37.17 2k07 s ILE 72 CO 0.05 0.21 0.27 -2.28 -1.23 0.00 0.00 174.94 171.96 2k07 s HIS 73 N 1.76 -0.45 -1.10 3.97 2.46 -1.06 -4.92 115.29 115.95 2k07 s HIS 73 Ca 0.13 0.82 -0.09 0.00 0.47 0.00 0.00 55.06 56.39 2k07 s HIS 73 Cb -0.15 -0.09 -0.04 0.00 -0.13 0.00 0.00 32.58 32.16 2k07 s HIS 73 CO 0.09 -0.45 0.88 -0.25 -2.47 0.00 0.00 174.74 172.54 2k07 n ASP 74 N 5.35 -5.55 0.00 9.88 8.00 -1.26 -3.16 116.55 129.81 2k07 n ASP 74 Ca -0.06 -0.78 0.00 0.00 0.71 0.00 0.00 54.79 54.66 2k07 n ASP 74 Cb 0.50 -4.71 0.00 0.00 -0.02 0.00 0.00 41.12 36.89 2k07 n ASP 74 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2k07 n LEU 75 N -3.60 0.00 -4.75 0.64 4.77 -1.26 -4.92 117.00 107.87 2k07 n LEU 75 Ca -0.11 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.46 2k07 n LEU 75 Cb 0.62 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.69 2k07 n LEU 75 CO 0.62 0.00 1.01 -0.76 -1.33 0.00 0.00 177.39 176.93 2k07 s LEU 76 N 0.00 4.42 -0.43 2.23 1.43 -1.19 -5.00 118.68 120.14 2k07 s LEU 76 Ca 0.00 2.60 -0.07 0.00 -1.03 0.00 0.00 54.13 55.62 2k07 s LEU 76 Cb 0.00 -3.63 0.10 0.00 0.03 0.00 0.00 46.19 42.69 2k07 s LEU 76 CO 0.00 -0.57 0.26 -0.75 0.23 0.00 0.00 176.35 175.53 2k07 s LYS 77 N -0.95 2.42 -0.26 1.70 2.20 -1.26 -2.57 119.74 121.02 2k07 s LYS 77 Ca 0.54 -1.64 -0.08 0.00 -0.36 0.00 0.00 55.97 54.43 2k07 s LYS 77 Cb -0.39 -3.76 -0.03 0.00 -1.51 0.00 0.00 37.83 32.14 2k07 s LYS 77 CO 0.46 -1.05 0.10 1.52 -0.36 0.00 0.00 175.35 176.03 2k07 s TYR 78 N 1.33 3.12 -0.12 4.03 1.13 -1.21 -4.97 117.35 120.67 2k07 s TYR 78 Ca 0.05 -0.31 -0.04 0.00 -1.41 0.00 0.00 57.07 55.36 2k07 s TYR 78 Cb -0.24 -2.28 -0.03 0.00 -1.10 0.00 0.00 41.96 38.31 2k07 s TYR 78 CO -0.00 -0.32 0.02 -1.21 -2.51 0.00 0.00 175.55 171.53 2k07 s GLU 79 N 1.65 3.34 -0.23 -3.49 2.02 -1.26 -2.33 118.70 118.40 2k07 s GLU 79 Ca 0.06 -0.38 0.02 0.00 0.02 0.00 0.00 54.97 54.70 2k07 s GLU 79 Cb -0.15 -2.94 0.05 0.00 0.10 0.00 0.00 34.13 31.18 2k07 s GLU 79 CO 0.06 0.56 -0.12 -0.06 0.02 0.00 0.00 175.26 175.71 2k07 s PHE 80 N -0.46 2.96 -0.40 1.61 0.08 0.12 -4.96 117.98 116.93 2k07 s PHE 80 Ca 0.09 -2.03 -0.26 0.00 0.12 0.00 0.00 56.93 54.84 2k07 s PHE 80 Cb -0.12 -1.85 0.02 0.00 -0.57 0.00 0.00 43.02 40.50 2k07 s PHE 80 CO 0.02 -0.83 0.97 -0.51 -0.10 0.00 0.00 175.22 174.77 2k07 s ASP 81 N 1.21 6.65 0.46 1.36 1.11 -1.26 -0.32 116.67 125.89 2k07 s ASP 81 Ca -0.05 0.50 0.06 0.00 0.18 0.00 0.00 52.55 53.24 2k07 s ASP 81 Cb -0.18 -2.48 -0.02 0.00 1.07 0.00 0.00 42.92 41.30 2k07 s ASP 81 CO -0.07 -0.96 0.18 0.27 1.18 0.00 0.00 175.17 175.77 2k07 s ILE 82 N 3.69 1.89 0.06 0.77 -4.36 -0.81 -4.68 121.20 117.77 2k07 s ILE 82 Ca 0.40 -1.73 -0.26 0.00 -0.26 0.00 0.00 60.65 58.80 2k07 s ILE 82 Cb -0.11 -2.62 0.08 0.00 1.25 0.00 0.00 42.46 41.06 2k07 s ILE 82 CO 0.22 0.00 0.71 -1.83 0.24 0.00 0.00 174.94 174.28 2k07 s GLU 83 N -3.97 1.08 -0.10 0.37 -1.05 -0.90 -0.95 118.70 113.18 2k07 s GLU 83 Ca 0.32 -0.27 -0.30 0.00 -0.15 0.00 0.00 54.97 54.57 2k07 s GLU 83 Cb 0.02 0.50 0.08 0.00 -0.44 0.00 0.00 34.13 34.29 2k07 s GLU 83 CO 0.18 -0.45 0.72 -0.59 0.95 0.00 0.00 175.26 176.07 2k07 s PHE 84 N -2.99 -0.65 0.44 4.83 -0.12 0.85 -1.11 117.98 119.22 2k07 s PHE 84 Ca -0.00 1.22 0.00 0.00 -0.05 0.00 0.00 56.93 58.10 2k07 s PHE 84 Cb -0.01 0.39 -0.01 0.00 -0.63 0.00 0.00 43.02 42.76 2k07 s PHE 84 CO -0.07 -0.54 0.66 0.16 -0.05 0.00 0.00 175.22 175.38 2k07 s ASP 85 N -0.90 5.88 -0.67 1.98 -4.77 -1.26 -0.65 116.67 116.29 2k07 s ASP 85 Ca -0.08 0.30 -0.08 0.00 -3.30 0.00 0.00 52.55 49.40 2k07 s ASP 85 Cb -0.01 -1.58 0.17 0.00 -1.09 0.00 0.00 42.92 40.41 2k07 s ASP 85 CO 0.07 -0.66 0.53 -0.63 0.70 0.00 0.00 175.17 175.19 2k07 s ILE 86 N -2.53 4.42 0.45 2.11 -1.09 -0.34 -4.52 121.20 119.70 2k07 s ILE 86 Ca 0.48 -2.60 -0.20 0.00 -2.23 0.00 0.00 60.65 56.09 2k07 s ILE 86 Cb -0.10 -3.82 -0.15 0.00 -1.58 0.00 0.00 42.46 36.81 2k07 s ILE 86 CO 0.38 -0.91 0.05 -0.81 -1.23 0.00 0.00 174.94 172.41 2k07 n PRO 87 N 3.88 0.06 -0.34 2.79 -0.04 -1.26 -4.86 135.00 135.23 2k07 n PRO 87 Ca 0.07 0.02 0.01 0.00 -0.04 0.00 0.00 63.50 63.56 2k07 n PRO 87 Cb 0.41 -1.06 0.18 0.00 -0.04 0.00 0.00 33.50 32.99 2k07 n PRO 87 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2k07 h ILE 88 N 0.21 1.15 -0.17 0.52 1.08 -1.98 -2.60 117.51 115.72 2k07 h ILE 88 Ca -0.39 -0.41 -0.12 0.00 -0.39 0.00 0.00 64.86 63.55 2k07 h ILE 88 Cb 1.44 -0.15 -0.05 0.00 -3.07 0.00 0.00 36.82 35.00 2k07 h ILE 88 CO 0.45 0.22 0.13 0.35 -0.69 0.00 0.00 178.15 178.60 2k07 n THR 89 N -4.45 2.30 -2.68 -0.27 -2.24 -1.26 -4.15 114.28 101.53 2k07 n THR 89 Ca 0.13 -0.94 -0.35 0.00 -2.27 0.00 0.00 64.05 60.62 2k07 n THR 89 Cb 0.11 -1.47 -0.05 0.00 -2.10 0.00 0.00 70.33 66.82 2k07 n THR 89 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2k07 s TYR 90 N -0.57 3.32 -1.48 4.78 5.04 -0.98 -0.41 117.35 127.06 2k07 s TYR 90 Ca 0.13 1.65 0.15 0.00 -2.44 0.00 0.00 57.07 56.56 2k07 s TYR 90 Cb 0.09 -2.98 0.53 0.00 0.35 0.00 0.00 41.96 39.95 2k07 s TYR 90 CO -0.00 -0.31 1.41 -0.35 -1.34 0.00 0.00 175.55 174.95 2k07 n PRO 91 N -0.28 2.83 -0.09 4.97 -0.04 -1.26 -2.35 135.00 138.78 2k07 n PRO 91 Ca 0.06 -2.11 -0.00 0.00 -0.04 0.00 0.00 63.50 61.41 2k07 n PRO 91 Cb 0.52 -1.65 0.28 0.00 -0.04 0.00 0.00 33.50 32.61 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 3.14 1.19 -3.66 0.52 2.02 -1.73 -3.37 112.91 111.02 2k07 h THR 92 Ca 0.00 -0.59 -0.65 0.00 0.77 0.00 0.00 66.41 65.94 2k07 h THR 92 Cb 1.03 0.59 -0.22 0.00 -1.74 0.00 0.00 68.15 67.80 2k07 h THR 92 CO 0.12 0.23 -0.62 -0.89 0.37 0.00 0.00 175.52 174.74 2k07 s THR 93 N -5.34 4.37 0.44 3.16 2.01 0.46 -4.80 115.64 115.95 2k07 s THR 93 Ca -0.09 -0.18 -0.18 0.00 0.31 0.00 0.00 61.69 61.56 2k07 s THR 93 Cb 0.16 -3.06 -0.09 0.00 0.01 0.00 0.00 72.50 69.52 2k07 s THR 93 CO 0.77 0.31 0.92 0.00 -0.69 0.00 0.00 174.62 175.93 2k07 s ALA 94 N 1.62 3.12 0.28 7.40 0.00 -1.26 -4.33 121.76 128.58 2k07 s ALA 94 Ca 0.06 0.21 -0.30 0.00 0.00 0.00 0.00 51.96 51.94 2k07 s ALA 94 Cb -0.15 -3.04 -0.13 0.00 0.00 0.00 0.00 23.12 19.80 2k07 s ALA 94 CO 0.04 0.01 1.38 -2.30 0.00 0.00 0.00 175.76 174.89 2k07 n PRO 95 N -1.00 2.10 0.18 0.00 -0.02 -1.26 -4.87 135.00 130.13 2k07 n PRO 95 Ca 0.06 0.74 0.07 0.00 -2.02 0.00 0.00 63.50 62.35 2k07 n PRO 95 Cb 0.54 -2.38 0.11 0.00 -0.02 0.00 0.00 33.50 31.74 2k07 n PRO 95 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2k07 h GLU 96 N 3.71 0.00 -3.64 -0.52 5.08 -1.94 -3.50 114.58 113.77 2k07 h GLU 96 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 2k07 h GLU 96 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2k07 h GLU 96 CO 0.72 0.26 -0.70 -0.89 -1.00 0.00 0.00 179.01 177.40 2k07 n ILE 97 N -3.17-10.44 -5.27 3.13 5.41 -1.26 -3.53 119.36 104.23 2k07 n ILE 97 Ca 0.03 2.44 -0.31 0.00 1.00 0.00 0.00 62.75 65.91 2k07 n ILE 97 Cb 0.63 -4.85 -0.16 0.00 -0.71 0.00 0.00 39.64 34.55 2k07 n ILE 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2k07 s ALA 98 N -0.40 2.19 -0.54 -1.39 0.00 -0.27 -0.48 121.76 120.88 2k07 s ALA 98 Ca 0.00 -1.09 0.04 0.00 0.00 0.00 0.00 51.96 50.91 2k07 s ALA 98 Cb 0.00 -0.62 0.15 0.00 0.00 0.00 0.00 23.12 22.65 2k07 s ALA 98 CO 0.00 0.49 0.33 0.08 0.00 0.00 0.00 175.76 176.66 2k07 s VAL 99 N -0.46 2.16 0.64 0.00 1.01 0.11 -2.11 120.40 121.75 2k07 s VAL 99 Ca 0.05 -3.34 0.40 0.00 0.00 0.00 0.00 61.98 59.09 2k07 s VAL 99 Cb -0.11 -2.47 0.42 0.00 0.00 0.00 0.00 36.38 34.21 2k07 s VAL 99 CO 0.01 -0.93 2.34 -0.65 0.00 0.00 0.00 175.10 175.87 2k07 h PRO 100 N 6.16 0.00 0.00 2.72 0.11 -1.83 -1.16 132.00 137.99 2k07 h PRO 100 Ca 0.04 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.98 2k07 h PRO 100 Cb 0.86 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.95 2k07 h PRO 100 CO 0.61 0.00 -0.82 1.49 -0.21 0.00 0.00 178.00 179.08 2k07 h GLU 101 N 0.00 0.00 -0.16 1.05 4.22 -1.94 -3.15 114.58 114.60 2k07 h GLU 101 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2k07 h GLU 101 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2k07 h GLU 101 CO -0.00 0.82 0.00 1.28 -2.18 0.00 0.00 179.01 178.93 2k07 n LEU 102 N -3.54 1.69 -4.60 1.64 4.77 -0.44 -4.68 117.00 111.83 2k07 n LEU 102 Ca -0.00 -0.70 -0.43 0.00 -0.03 0.00 0.00 56.01 54.85 2k07 n LEU 102 Cb 0.79 -0.10 -0.03 0.00 -2.33 0.00 0.00 43.42 41.75 2k07 n LEU 102 CO 0.45 0.35 1.75 -0.62 -1.33 0.00 0.00 177.39 177.99 2k07 s ASP 103 N -1.59 5.62 0.00 -1.43 2.15 -1.19 -0.61 116.67 119.61 2k07 s ASP 103 Ca 0.33 1.77 0.00 0.00 0.43 0.00 0.00 52.55 55.08 2k07 s ASP 103 Cb 0.18 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.28 2k07 s ASP 103 CO 0.27 -1.85 0.00 0.61 -0.17 0.00 0.00 175.17 174.03 2k07 n GLY 104 N 5.60 1.11 0.36 2.66 0.00 -1.26 -4.84 105.19 108.82 2k07 n GLY 104 Ca 0.27 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.39 2k07 n GLY 104 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2k07 n LYS 105 N -2.00 1.22 -3.77 1.61 4.81 0.22 -4.97 118.16 115.28 2k07 n LYS 105 Ca 0.00 -0.74 -0.10 0.00 -0.87 0.00 0.00 58.31 56.60 2k07 n LYS 105 Cb 0.00 -1.41 -0.05 0.00 0.02 0.00 0.00 35.03 33.59 2k07 n LYS 105 CO 0.00 0.00 0.00 -0.08 1.17 0.00 0.00 177.40 178.49 2k07 s THR 106 N -2.40 0.05 -0.45 3.15 -1.32 -1.06 -5.04 115.64 108.57 2k07 s THR 106 Ca 0.15 -0.88 0.12 0.00 -1.21 0.00 0.00 61.69 59.86 2k07 s THR 106 Cb 0.16 -1.53 0.32 0.00 -1.51 0.00 0.00 72.50 69.95 2k07 s THR 106 CO 0.57 -0.23 1.25 0.00 -2.21 0.00 0.00 174.62 174.01 2k07 n ALA 107 N -0.27 2.41 -1.02 11.08 0.00 -1.26 -4.68 120.51 126.77 2k07 n ALA 107 Ca -0.11 -1.65 -0.25 0.00 0.00 0.00 0.00 53.44 51.43 2k07 n ALA 107 Cb 0.63 -0.44 0.10 0.00 0.00 0.00 0.00 19.45 19.73 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 -0.19 2.22 -4.16 0.00 3.00 -1.26 -4.92 118.16 112.85 2k07 n LYS 108 Ca 0.13 -2.57 -0.10 0.00 -0.00 0.00 0.00 58.31 55.77 2k07 n LYS 108 Cb 0.57 -2.01 -0.10 0.00 0.00 0.00 0.00 35.03 33.49 2k07 n LYS 108 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.40 175.76 2k07 s MET 109 N -2.92 0.92 0.77 1.64 -1.94 -1.26 -3.25 119.30 113.27 2k07 s MET 109 Ca 0.50 -1.43 -0.02 0.00 -1.71 0.00 0.00 55.69 53.02 2k07 s MET 109 Cb 0.40 0.16 0.15 0.00 2.01 0.00 0.00 34.83 37.56 2k07 s MET 109 CO 0.03 -0.23 1.06 0.71 -0.01 0.00 0.00 175.02 176.59 2k07 s TYR 110 N -3.98 1.31 -0.22 -0.03 2.02 0.20 -4.91 117.35 111.74 2k07 s TYR 110 Ca 0.22 -0.30 -0.29 0.00 -0.37 0.00 0.00 57.07 56.34 2k07 s TYR 110 Cb 0.07 -3.13 -0.04 0.00 -0.40 0.00 0.00 41.96 38.46 2k07 s TYR 110 CO 0.01 -1.96 1.94 0.50 -1.57 0.00 0.00 175.55 174.47 2k07 s ARG 111 N -5.27 3.46 0.00 -0.62 3.52 -1.26 -2.46 118.95 116.31 2k07 s ARG 111 Ca 0.69 1.86 0.00 0.00 -0.13 0.00 0.00 55.73 58.15 2k07 s ARG 111 Cb -0.04 -4.23 0.00 0.00 -1.56 0.00 0.00 34.95 29.12 2k07 s ARG 111 CO 0.46 -1.72 0.00 0.41 -0.81 0.00 0.00 175.30 173.65 2k07 n GLY 112 N 5.28 1.57 0.12 8.12 0.00 -1.26 -4.67 105.19 114.35 2k07 n GLY 112 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 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 0.97 3.80 -0.02 0.00 -1.03 -4.89 105.19 104.02 2k07 n GLY 113 Ca 0.00 -0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 2k07 n GLY 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k07 s LYS 114 N -0.70 4.10 0.72 1.61 1.02 -1.25 -0.71 119.74 124.53 2k07 s LYS 114 Ca 0.00 0.51 -0.10 0.00 0.02 0.00 0.00 55.97 56.41 2k07 s LYS 114 Cb 0.00 -3.28 0.05 0.00 -0.52 0.00 0.00 37.83 34.08 2k07 s LYS 114 CO 0.00 0.55 1.08 0.96 -0.92 0.00 0.00 175.35 177.01 2k07 s ILE 115 N -0.67 2.76 -0.24 2.17 -4.36 0.37 0.58 121.20 121.81 2k07 s ILE 115 Ca 0.26 0.09 -0.02 0.00 -0.26 0.00 0.00 60.65 60.71 2k07 s ILE 115 Cb -0.17 -3.21 0.02 0.00 1.25 0.00 0.00 42.46 40.34 2k07 s ILE 115 CO 0.14 -0.26 -0.06 0.00 0.24 0.00 0.00 174.94 175.01 2k07 n LEU 117 N 4.71 0.00 -4.73 0.00 4.77 -1.26 -5.00 117.00 115.49 2k07 n LEU 117 Ca -0.17 -0.93 -0.42 0.00 -0.03 0.00 0.00 56.01 54.46 2k07 n LEU 117 Cb 0.48 -0.45 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 2k07 n LEU 117 CO 0.28 -0.89 1.33 0.41 -1.33 0.00 0.00 177.39 177.19 2k07 n THR 118 N -2.60 0.39 0.11 -5.08 -1.04 -1.26 -4.89 114.28 99.90 2k07 n THR 118 Ca 0.09 -0.10 0.03 0.00 -2.04 0.00 0.00 64.05 62.03 2k07 n THR 118 Cb 0.31 -1.99 0.40 0.00 -1.82 0.00 0.00 70.33 67.23 2k07 n THR 118 CO 0.00 0.00 0.00 -2.24 -0.64 0.00 0.00 175.07 172.19 2k07 h ASP 119 N 6.04 0.26 1.36 8.00 2.03 -2.02 -1.62 116.42 130.46 2k07 h ASP 119 Ca -0.45 -0.04 -0.03 0.00 -0.73 0.00 0.00 57.03 55.78 2k07 h ASP 119 Cb 1.21 -0.07 -0.00 0.00 -0.83 0.00 0.00 39.33 39.64 2k07 h ASP 119 CO 0.90 0.37 -0.16 0.45 -1.03 0.00 0.00 179.24 179.77 2k07 h HIS 120 N 0.27 0.00 -0.10 4.15 3.86 -2.03 -3.12 115.15 118.18 2k07 h HIS 120 Ca 0.06 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.12 2k07 h HIS 120 Cb 0.30 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.76 2k07 h HIS 120 CO 0.01 0.16 -0.57 0.35 0.86 0.00 0.00 177.93 178.73 2k07 h PHE 121 N 0.00 0.40 0.32 2.45 3.57 -1.67 -2.72 116.94 119.30 2k07 h PHE 121 Ca -0.00 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.35 2k07 h PHE 121 Cb 0.88 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.52 2k07 h PHE 121 CO 0.00 0.81 -0.36 -0.22 -2.23 0.00 0.00 178.31 176.31 2k07 h LYS 122 N 0.24 -0.70 -0.07 1.11 3.64 -1.51 0.33 116.57 119.61 2k07 h LYS 122 Ca -0.00 0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.35 2k07 h LYS 122 Cb 1.08 0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 33.04 2k07 h LYS 122 CO 0.09 -0.47 -0.33 -1.00 -2.27 0.00 0.00 179.45 175.48 2k07 h PRO 123 N -0.73 0.13 -0.48 1.90 0.13 -1.73 -2.73 132.00 128.50 2k07 h PRO 123 Ca -0.02 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.06 2k07 h PRO 123 Cb 0.67 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.77 2k07 h PRO 123 CO -0.09 0.46 0.27 1.25 -0.23 0.00 0.00 178.00 179.66 2k07 h LEU 124 N 0.12 0.59 0.46 1.56 5.85 -1.08 -0.83 115.31 121.98 2k07 h LEU 124 Ca 0.01 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 2k07 h LEU 124 Cb 0.65 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.53 2k07 h LEU 124 CO 0.05 0.50 -0.23 -0.25 -0.34 0.00 0.00 178.44 178.17 2k07 h TRP 125 N 0.64 -0.59 0.00 1.25 2.91 -0.22 -2.44 115.95 117.51 2k07 h TRP 125 Ca 0.17 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.18 2k07 h TRP 125 Cb 0.03 0.20 0.00 0.00 -0.51 0.00 0.00 29.16 28.88 2k07 h TRP 125 CO -0.02 -0.36 0.00 0.00 -1.03 0.00 0.00 178.44 177.02 2k07 h ALA 126 N -0.08 1.00 0.00 2.65 0.00 -1.35 0.10 119.26 121.57 2k07 h ALA 126 Ca -0.06 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2k07 h ALA 126 Cb 0.48 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2k07 h ALA 126 CO 0.10 0.00 -0.76 -0.09 0.00 0.00 0.00 179.25 178.49 2k07 h ARG 127 N 0.00 0.00 -0.40 0.00 2.43 -0.79 -3.33 114.38 112.29 2k07 h ARG 127 Ca 0.00 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.03 2k07 h ARG 127 Cb 0.21 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 29.67 2k07 h ARG 127 CO 0.00 0.11 0.04 0.09 -1.51 0.00 0.00 179.97 178.70 2k07 n ASN 128 N -2.89 3.30 -4.75 -3.80 3.02 0.00 -4.94 115.26 105.20 2k07 n ASN 128 Ca -0.00 -3.43 -0.36 0.00 -0.03 0.00 0.00 54.58 50.76 2k07 n ASN 128 Cb 0.62 -0.63 -0.08 0.00 -0.61 0.00 0.00 39.78 39.08 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 -3.08 5.10 0.00 2.41 1.01 -1.09 -3.83 120.40 120.92 2k07 s VAL 129 Ca 0.46 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.50 2k07 s VAL 129 Cb 0.39 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 33.52 2k07 s VAL 129 CO 0.05 0.54 0.00 -0.81 0.00 0.00 0.00 175.10 174.88 2k07 n PRO 130 N 2.74 2.94 -0.97 2.72 -0.04 -1.26 -5.03 135.00 136.10 2k07 n PRO 130 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 2k07 n PRO 130 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 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 -0.26 -3.36 0.54 5.02 -1.20 -4.97 118.16 113.93 2k07 n LYS 131 Ca 0.00 0.07 -0.20 0.00 -2.02 0.00 0.00 58.31 56.16 2k07 n LYS 131 Cb 0.00 -3.23 -0.01 0.00 -0.02 0.00 0.00 35.03 31.78 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 -2.29 2.57 0.13 2.13 0.40 -1.25 -3.03 117.98 116.64 2k07 s PHE 132 Ca 0.00 -0.50 -0.25 0.00 -0.60 0.00 0.00 56.93 55.58 2k07 s PHE 132 Cb 0.00 -2.23 0.08 0.00 0.51 0.00 0.00 43.02 41.38 2k07 s PHE 132 CO 0.00 -0.33 1.09 0.20 0.70 0.00 0.00 175.22 176.88 2k07 s GLY 133 N -4.26 -0.05 0.30 4.36 0.00 -1.26 -4.59 107.32 101.82 2k07 s GLY 133 Ca 0.51 -0.07 -0.01 0.00 0.00 0.00 0.00 44.72 45.16 2k07 s GLY 133 CO 0.30 2.06 1.90 -2.00 0.00 0.00 0.00 173.10 175.36 2k07 h LEU 134 N 2.00 0.80 -1.05 0.66 5.85 -1.99 -1.46 115.31 120.13 2k07 h LEU 134 Ca -0.27 -0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.43 2k07 h LEU 134 Cb 1.21 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.98 2k07 h LEU 134 CO 0.32 0.69 0.63 0.00 -0.34 0.00 0.00 178.44 179.74 2k07 h ALA 135 N 1.44 1.42 -0.23 1.25 0.00 -1.96 0.74 119.26 121.92 2k07 h ALA 135 Ca 0.22 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 2k07 h ALA 135 Cb 0.10 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2k07 h ALA 135 CO -0.03 0.44 -0.44 0.45 0.00 0.00 0.00 179.25 179.67 2k07 h HIS 136 N 1.15 0.69 0.24 0.00 3.86 -1.68 -2.87 115.15 116.55 2k07 h HIS 136 Ca 0.42 -0.21 -0.01 0.00 -1.16 0.00 0.00 60.37 59.40 2k07 h HIS 136 Cb 0.15 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 28.48 2k07 h HIS 136 CO -0.00 0.91 -0.12 1.25 0.86 0.00 0.00 177.93 180.84 2k07 h LEU 137 N 0.47 -0.28 -1.27 2.43 5.85 -0.54 -2.33 115.31 119.64 2k07 h LEU 137 Ca 0.03 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.53 2k07 h LEU 137 Cb 0.95 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 2k07 h LEU 137 CO 0.09 0.07 0.20 0.00 -0.34 0.00 0.00 178.44 178.45 2k07 h MET 138 N -0.65 0.70 -0.24 1.25 -0.00 -0.97 0.36 114.93 115.39 2k07 h MET 138 Ca -0.03 -0.10 -0.16 0.00 -0.00 0.00 0.00 59.70 59.41 2k07 h MET 138 Cb 0.46 -0.13 0.00 0.00 -0.00 0.00 0.00 31.60 31.93 2k07 h MET 138 CO 0.05 0.58 -0.46 0.00 -0.00 0.00 0.00 176.91 177.09 2k07 h ALA 139 N 1.52 0.38 0.00 -3.00 0.00 -1.53 -2.82 119.26 113.81 2k07 h ALA 139 Ca 0.17 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2k07 h ALA 139 Cb 0.14 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2k07 h ALA 139 CO -0.02 0.52 -0.95 1.28 0.00 0.00 0.00 179.25 180.09 2k07 n LEU 140 N -4.15 0.69 -0.03 0.00 4.77 -0.88 -4.35 117.00 113.06 2k07 n LEU 140 Ca -0.05 -0.19 -0.08 0.00 -0.03 0.00 0.00 56.01 55.66 2k07 n LEU 140 Cb 0.57 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 2k07 n LEU 140 CO 0.48 0.14 -0.61 0.61 -1.33 0.00 0.00 177.39 176.68 2k07 n GLY 141 N 1.44 -0.18 0.26 -0.72 0.00 0.12 -4.63 105.19 101.48 2k07 n GLY 141 Ca 0.03 -0.08 -0.08 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.35 0.82 0.60 0.99 5.85 -1.58 -2.41 115.31 119.23 2k07 h LEU 142 Ca -0.15 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.32 2k07 h LEU 142 Cb 0.88 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 2k07 h LEU 142 CO -0.09 0.83 -0.42 1.23 -0.34 0.00 0.00 178.44 179.64 2k07 h GLY 143 N 0.77 -1.18 1.69 3.75 0.00 -1.76 -2.46 103.07 103.88 2k07 h GLY 143 Ca 0.17 0.50 0.04 0.00 0.00 0.00 0.00 47.33 48.05 2k07 h GLY 143 CO -0.00 -0.39 0.11 -2.55 0.00 0.00 0.00 176.54 173.71 2k07 h PRO 144 N -0.97 0.00 -0.43 4.80 0.11 -1.82 -2.18 132.00 131.52 2k07 h PRO 144 Ca -0.08 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.93 2k07 h PRO 144 Cb 0.79 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.89 2k07 h PRO 144 CO 0.05 0.00 -0.14 2.35 -0.21 0.00 0.00 178.00 180.05 2k07 h TRP 145 N 0.00 0.88 -0.91 0.65 7.01 -1.17 -2.99 115.95 119.42 2k07 h TRP 145 Ca 0.07 -0.17 0.11 0.00 2.11 0.00 0.00 58.89 61.01 2k07 h TRP 145 Cb 0.30 -0.22 -0.07 0.00 -2.10 0.00 0.00 29.16 27.06 2k07 h TRP 145 CO 0.00 0.88 0.58 -0.07 -2.79 0.00 0.00 178.44 177.05 2k07 h LEU 146 N 0.71 0.78 0.00 0.65 3.38 -0.92 -0.50 115.31 119.41 2k07 h LEU 146 Ca 0.11 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2k07 h LEU 146 Cb 0.63 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.26 2k07 h LEU 146 CO 0.04 0.43 0.00 0.00 0.09 0.00 0.00 178.44 179.01 2k07 n ALA 147 N -2.40 2.12 0.12 1.53 0.00 -1.13 -1.57 120.51 119.18 2k07 n ALA 147 Ca 0.16 -0.10 -0.24 0.00 0.00 0.00 0.00 53.44 53.26 2k07 n ALA 147 Cb 0.36 -1.36 -0.16 0.00 0.00 0.00 0.00 19.45 18.30 2k07 n ALA 147 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2k07 h VAL 148 N 0.00 1.15 0.00 0.00 2.07 -1.18 -3.44 116.25 114.84 2k07 h VAL 148 Ca 0.00 -2.62 0.00 0.00 0.82 0.00 0.00 66.70 64.90 2k07 h VAL 148 Cb 0.22 2.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.93 2k07 h VAL 148 CO 0.00 0.83 -0.75 1.21 0.02 0.00 0.00 177.57 178.88 2k07 n GLU 149 N -3.68 0.06 0.03 1.57 4.07 -1.20 -4.85 120.64 116.65 2k07 n GLU 149 Ca -0.20 0.00 -0.10 0.00 -0.06 0.00 0.00 57.16 56.80 2k07 n GLU 149 Cb 1.09 -0.87 -0.04 0.00 -0.06 0.00 0.00 31.44 31.56 2k07 n GLU 149 CO 0.00 0.00 0.00 0.82 -0.06 0.00 0.00 177.13 177.89 2k07 h ILE 150 N 0.00 0.56 -0.74 6.31 1.08 -1.57 0.47 117.51 123.62 2k07 h ILE 150 Ca 0.00 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 64.62 2k07 h ILE 150 Cb 0.75 0.56 -0.05 0.00 -3.07 0.00 0.00 36.82 35.01 2k07 h ILE 150 CO 0.00 0.00 0.50 1.55 -0.69 0.00 0.00 178.15 179.51 2k07 h PRO 151 N -0.26 0.37 0.00 2.37 0.13 -1.85 -1.11 132.00 131.64 2k07 h PRO 151 Ca 0.07 -0.02 -0.26 0.00 -0.87 0.00 0.00 66.00 64.92 2k07 h PRO 151 Cb 0.36 -0.08 -0.04 0.00 0.13 0.00 0.00 31.00 31.37 2k07 h PRO 151 CO -0.21 0.24 -1.47 0.22 -0.23 0.00 0.00 178.00 176.55 2k07 h ASP 152 N 0.38 0.00 -0.98 1.44 3.58 -1.62 -3.32 116.42 115.89 2k07 h ASP 152 Ca 0.36 0.00 0.07 0.00 0.42 0.00 0.00 57.03 57.89 2k07 h ASP 152 Cb 0.88 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 41.86 2k07 h ASP 152 CO -0.11 0.97 0.64 0.25 -2.88 0.00 0.00 179.24 178.10 2k07 h LEU 153 N 0.00 1.00 -0.72 2.28 5.85 0.12 0.54 115.31 124.37 2k07 h LEU 153 Ca -0.20 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.48 2k07 h LEU 153 Cb 1.91 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.71 2k07 h LEU 153 CO 0.09 0.62 0.21 0.40 -0.34 0.00 0.00 178.44 179.43 2k07 h ILE 154 N 1.12 1.26 -0.26 4.05 2.04 -1.56 -2.88 117.51 121.28 2k07 h ILE 154 Ca 0.43 -0.92 -0.09 0.00 1.00 0.00 0.00 64.86 65.28 2k07 h ILE 154 Cb 0.22 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 2k07 h ILE 154 CO -0.18 0.36 -0.22 -0.61 0.00 0.00 0.00 178.15 177.50 2k07 h GLN 155 N 1.07 0.49 -0.48 2.37 4.15 -1.15 -2.72 115.11 118.83 2k07 h GLN 155 Ca 0.23 -0.17 0.13 0.00 0.77 0.00 0.00 58.65 59.60 2k07 h GLN 155 Cb 0.32 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.96 2k07 h GLN 155 CO -0.00 0.68 0.34 0.87 -1.93 0.00 0.00 178.83 178.79 2k07 h LYS 156 N 0.44 0.08 0.00 1.69 1.57 -0.75 -3.45 116.57 116.14 2k07 h LYS 156 Ca 0.07 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2k07 h LYS 156 Cb 0.63 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.92 2k07 h LYS 156 CO 0.04 0.05 0.00 0.41 -0.57 0.00 0.00 179.45 179.39 2k07 n GLY 157 N -1.61 0.59 0.16 3.86 0.00 -1.03 -4.92 105.19 102.25 2k07 n GLY 157 Ca 0.08 -0.30 0.13 0.00 0.00 0.00 0.00 46.02 45.93 2k07 n GLY 157 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2k07 h VAL 158 N 0.00 0.00 -3.43 1.61 -1.51 -1.82 -3.43 116.25 107.67 2k07 h VAL 158 Ca 0.00 -0.70 -0.59 0.00 -1.23 0.00 0.00 66.70 64.18 2k07 h VAL 158 Cb 0.00 1.70 -0.10 0.00 -2.13 0.00 0.00 31.29 30.76 2k07 h VAL 158 CO 0.00 0.00 -0.08 -0.63 -1.23 0.00 0.00 177.57 175.63 2k07 s ILE 159 N -3.16 5.14 0.10 7.19 1.01 -1.26 -5.04 121.20 125.18 2k07 s ILE 159 Ca 0.09 0.93 -0.31 0.00 0.00 0.00 0.00 60.65 61.36 2k07 s ILE 159 Cb 0.09 -3.83 -0.07 0.00 0.01 0.00 0.00 42.46 38.66 2k07 s ILE 159 CO 0.62 0.22 1.30 -1.58 0.00 0.00 0.00 174.94 175.51 2k07 s GLN 160 N 1.34 4.37 -0.71 2.79 -0.44 -1.26 -4.91 119.66 120.84 2k07 s GLN 160 Ca 0.24 1.95 -0.26 0.00 -2.50 0.00 0.00 55.36 54.80 2k07 s GLN 160 Cb -0.15 -3.28 -0.05 0.00 -1.64 0.00 0.00 33.01 27.89 2k07 s GLN 160 CO 0.10 -0.34 2.02 -3.38 0.50 0.00 0.00 175.29 174.19 2k07 s HIS 161 N 0.96 1.57 0.00 1.67 0.00 -1.26 -4.94 115.29 113.29 2k07 s HIS 161 Ca 0.61 0.97 0.00 0.00 -3.00 0.00 0.00 55.06 53.65 2k07 s HIS 161 Cb -0.34 -3.94 0.00 0.00 -4.00 0.00 0.00 32.58 24.31 2k07 s HIS 161 CO 0.31 -2.08 0.00 1.63 -1.00 0.00 0.00 174.74 173.59 2k07 n LYS 162 N 9.02 1.18 -0.89 -0.38 5.02 -1.26 -4.61 118.16 126.24 2k07 n LYS 162 Ca 0.32 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.61 2k07 n LYS 162 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.51 2k07 n LYS 162 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2k07 n GLU 163 N -0.75 -0.84 0.01 1.97 -0.58 -1.26 -4.82 120.64 114.37 2k07 n GLU 163 Ca 0.00 0.21 -0.18 0.00 -0.42 0.00 0.00 57.16 56.77 2k07 n GLU 163 Cb 0.00 -4.09 -0.10 0.00 -0.57 0.00 0.00 31.44 26.68 2k07 n GLU 163 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2k07 h LYS 164 N 0.62 0.55 -6.49 3.49 1.57 -2.01 -3.43 116.57 110.88 2k07 h LYS 164 Ca 0.00 -0.56 -0.53 0.00 -1.87 0.00 0.00 60.65 57.69 2k07 h LYS 164 Cb 0.42 0.15 0.01 0.00 0.08 0.00 0.00 32.23 32.89 2k07 h LYS 164 CO 0.00 1.18 0.67 0.00 -0.57 0.00 0.00 179.45 180.72 2k07 s ASN 166 N 1.20 6.14 -0.12 0.00 2.47 -1.26 -4.97 114.94 118.41 2k07 s ASN 166 Ca 0.61 -0.91 -0.04 0.00 0.42 0.00 0.00 52.86 52.94 2k07 s ASN 166 Cb -0.32 -2.56 -0.03 0.00 -1.45 0.00 0.00 41.25 36.88 2k07 s ASN 166 CO 0.29 -1.82 0.02 -1.58 -3.72 0.00 0.00 177.10 170.29 2k07 s GLN 167 N 5.61 3.33 -0.04 0.43 0.74 -1.26 -5.11 119.66 123.35 2k07 s GLN 167 Ca 0.47 -0.38 0.06 0.00 0.05 0.00 0.00 55.36 55.57 2k07 s GLN 167 Cb -0.04 -2.94 -0.01 0.00 1.10 0.00 0.00 33.01 31.11 2k07 s GLN 167 CO 0.01 0.57 -0.24 -1.17 -0.55 0.00 0.00 175.29 173.91 2k07 s LEU 168 N -0.49 2.05 0.07 3.68 2.96 -1.26 -5.13 118.68 120.55 2k07 s LEU 168 Ca 0.09 -0.47 0.02 0.00 -0.22 0.00 0.00 54.13 53.55 2k07 s LEU 168 Cb -0.12 -1.30 -0.04 0.00 0.50 0.00 0.00 46.19 45.23 2k07 s LEU 168 CO 0.02 0.26 0.09 -1.83 -1.32 0.00 0.00 176.35 173.56 2k07 s GLU 169 N -0.30 2.94 -0.46 1.98 1.03 -1.26 -5.08 118.70 117.55 2k07 s GLU 169 Ca 0.01 -0.65 0.02 0.00 0.03 0.00 0.00 54.97 54.39 2k07 s GLU 169 Cb -0.12 -2.76 0.14 0.00 -0.80 0.00 0.00 34.13 30.59 2k07 s GLU 169 CO 0.02 0.58 0.26 -1.58 -1.33 0.00 0.00 175.26 173.21 2k07 s HIS 170 N -1.36 2.09 -0.45 4.83 2.46 -1.26 -5.08 115.29 116.51 2k07 s HIS 170 Ca 0.29 -2.51 -0.24 0.00 0.47 0.00 0.00 55.06 53.06 2k07 s HIS 170 Cb -0.12 -1.93 0.03 0.00 -0.13 0.00 0.00 32.58 30.43 2k07 s HIS 170 CO 0.21 -0.77 0.85 -1.58 -2.47 0.00 0.00 174.74 170.99 2k07 s HIS 171 N 0.19 2.96 -0.06 3.88 5.04 -1.26 -4.99 115.29 121.05 2k07 s HIS 171 Ca 0.19 0.28 -0.31 0.00 -1.54 0.00 0.00 55.06 53.68 2k07 s HIS 171 Cb -0.21 -3.81 -0.09 0.00 0.04 0.00 0.00 32.58 28.50 2k07 s HIS 171 CO -0.02 -1.04 2.00 1.58 -2.34 0.00 0.00 174.74 174.92 2k07 n HIS 172 N 6.94 2.33 -2.31 3.88 -0.00 -1.26 -4.98 115.22 119.81 2k07 n HIS 172 Ca 0.04 -0.21 -0.26 0.00 0.46 0.00 0.00 57.72 57.76 2k07 n HIS 172 Cb 0.48 -2.74 0.11 0.00 -0.12 0.00 0.00 29.99 27.72 2k07 n HIS 172 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2k07 s HIS 173 N 5.16 2.03 -0.37 1.57 3.76 -1.26 -4.96 115.29 121.22 2k07 s HIS 173 Ca 0.93 0.09 0.26 0.00 -0.15 0.00 0.00 55.06 56.19 2k07 s HIS 173 Cb -0.51 -3.33 1.03 0.00 1.11 0.00 0.00 32.58 30.88 2k07 s HIS 173 CO 0.44 -1.82 1.78 1.12 -0.85 0.00 0.00 174.74 175.41 2k07 h HIS 174 N -0.80 0.00 0.00 1.40 2.07 -2.07 -3.57 115.15 112.18 2k07 h HIS 174 Ca -0.41 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.11 2k07 h HIS 174 Cb 1.27 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.25 2k07 h HIS 174 CO -0.26 0.00 0.00 1.58 -3.07 0.00 0.00 177.93 176.18