#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 0.00 0.60 3.04 0.00 -1.26 -4.96 120.51 117.93 2k07 n ALA 2 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.51 2k07 n ALA 2 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 2k07 n ALA 2 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2k07 n ASP 3 N 0.00 1.81 -0.04 0.00 2.03 -1.26 -4.59 116.55 114.50 2k07 n ASP 3 Ca 0.00 -1.40 -0.01 0.00 0.52 0.00 0.00 54.79 53.90 2k07 n ASP 3 Cb 0.00 0.24 0.28 0.00 -0.72 0.00 0.00 41.12 40.92 2k07 n ASP 3 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 2k07 h GLU 4 N 2.14 0.62 -0.31 -0.67 9.09 -1.98 0.44 114.58 123.91 2k07 h GLU 4 Ca 0.00 -0.12 -0.07 0.00 0.05 0.00 0.00 59.36 59.22 2k07 h GLU 4 Cb 0.53 -0.10 -0.01 0.00 -1.65 0.00 0.00 28.75 27.52 2k07 h GLU 4 CO 0.00 0.59 -0.08 0.00 0.05 0.00 0.00 179.01 179.57 2k07 h ALA 5 N 1.48 0.42 -0.31 1.06 0.00 -2.00 -2.38 119.26 117.54 2k07 h ALA 5 Ca 0.13 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2k07 h ALA 5 Cb 0.28 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2k07 h ALA 5 CO 0.00 0.26 0.07 1.15 0.00 0.00 0.00 179.25 180.73 2k07 h THR 6 N 0.37 1.22 -0.00 0.00 2.02 -1.53 -2.59 112.91 112.40 2k07 h THR 6 Ca 0.08 -0.74 -0.06 0.00 0.77 0.00 0.00 66.41 66.46 2k07 h THR 6 Cb 0.57 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 2k07 h THR 6 CO 0.03 0.25 -0.28 0.08 0.37 0.00 0.00 175.52 175.97 2k07 h ARG 7 N 0.33 0.00 -0.49 6.66 -0.00 -0.19 -2.07 114.38 118.62 2k07 h ARG 7 Ca 0.10 -0.00 -0.09 0.00 -0.00 0.00 0.00 59.98 59.99 2k07 h ARG 7 Cb 0.30 -0.00 -0.02 0.00 -0.00 0.00 0.00 29.97 30.25 2k07 h ARG 7 CO 0.00 0.28 -0.04 -0.09 -0.00 0.00 0.00 179.97 180.12 2k07 h ARG 8 N 0.00 0.89 -0.43 0.08 2.43 -1.19 -0.64 114.38 115.53 2k07 h ARG 8 Ca -0.00 -0.31 0.02 0.00 -0.81 0.00 0.00 59.98 58.88 2k07 h ARG 8 Cb 0.49 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 2k07 h ARG 8 CO 0.04 0.95 0.25 0.28 -1.51 0.00 0.00 179.97 179.97 2k07 h VAL 9 N 0.75 1.03 0.00 0.20 2.07 -1.01 0.93 116.25 120.22 2k07 h VAL 9 Ca 0.13 -0.17 -0.06 0.00 0.82 0.00 0.00 66.70 67.42 2k07 h VAL 9 Cb 0.57 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 2k07 h VAL 9 CO 0.03 0.09 -0.28 0.58 0.02 0.00 0.00 177.57 178.01 2k07 h VAL 10 N 0.50 1.09 0.04 2.57 2.07 -1.27 -1.76 116.25 119.48 2k07 h VAL 10 Ca 0.17 -1.01 -0.24 0.00 0.82 0.00 0.00 66.70 66.44 2k07 h VAL 10 Cb 0.02 1.56 0.01 0.00 -1.52 0.00 0.00 31.29 31.36 2k07 h VAL 10 CO -0.09 0.28 -1.04 -1.28 0.02 0.00 0.00 177.57 175.46 2k07 h SER 11 N 0.00 0.57 0.29 0.57 0.87 -0.06 -3.13 113.55 112.66 2k07 h SER 11 Ca -0.00 -0.49 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 2k07 h SER 11 Cb 0.54 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 2k07 h SER 11 CO 0.04 1.31 -0.13 -0.62 -0.53 0.00 0.00 176.83 176.89 2k07 n GLU 12 N -3.72 0.80 -3.90 2.24 1.02 0.22 -4.27 120.64 113.03 2k07 n GLU 12 Ca -0.08 -0.34 -0.30 0.00 -0.02 0.00 0.00 57.16 56.42 2k07 n GLU 12 Cb 0.89 -1.49 -0.13 0.00 -0.02 0.00 0.00 31.44 30.69 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 -2.43 2.85 0.58 -3.67 1.01 -0.68 -4.59 121.20 114.27 2k07 s ILE 13 Ca 0.29 -3.65 -0.18 0.00 0.00 0.00 0.00 60.65 57.11 2k07 s ILE 13 Cb 0.20 -2.92 -0.06 0.00 0.01 0.00 0.00 42.46 39.69 2k07 s ILE 13 CO 0.47 -0.89 0.83 -0.81 0.00 0.00 0.00 174.94 174.55 2k07 n PRO 14 N 2.72 0.79 -1.62 2.79 -0.04 -1.26 -4.79 135.00 133.58 2k07 n PRO 14 Ca 0.11 0.31 -0.30 0.00 -0.04 0.00 0.00 63.50 63.58 2k07 n PRO 14 Cb 0.34 -2.02 0.18 0.00 -0.04 0.00 0.00 33.50 31.96 2k07 n PRO 14 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2k07 s VAL 15 N -1.57 1.90 0.30 0.52 -7.23 -1.26 -4.80 120.40 108.27 2k07 s VAL 15 Ca 0.73 0.00 0.06 0.00 -1.81 0.00 0.00 61.98 60.96 2k07 s VAL 15 Cb -0.43 -2.81 -0.02 0.00 0.56 0.00 0.00 36.38 33.68 2k07 s VAL 15 CO 0.50 0.00 0.43 -0.76 -0.31 0.00 0.00 175.10 174.95 2k07 s LEU 16 N -6.15 4.06 -0.17 1.32 1.02 -1.15 -5.01 118.68 112.60 2k07 s LEU 16 Ca 0.69 -0.12 0.02 0.00 0.02 0.00 0.00 54.13 54.74 2k07 s LEU 16 Cb -0.09 -2.76 -0.12 0.00 0.02 0.00 0.00 46.19 43.24 2k07 s LEU 16 CO 0.53 -0.32 -0.15 1.17 0.02 0.00 0.00 176.35 177.61 2k07 n LYS 17 N -1.56 0.48 -3.22 1.70 0.00 -1.26 -4.67 118.16 109.63 2k07 n LYS 17 Ca -0.03 0.10 -0.39 0.00 0.00 0.00 0.00 58.31 57.99 2k07 n LYS 17 Cb 0.58 -1.35 -0.06 0.00 0.00 0.00 0.00 35.03 34.20 2k07 n LYS 17 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 2k07 s THR 18 N -2.35 4.88 -0.17 3.15 2.01 -1.26 -4.95 115.64 116.95 2k07 s THR 18 Ca -0.23 1.24 -0.06 0.00 0.31 0.00 0.00 61.69 62.95 2k07 s THR 18 Cb 0.06 -3.93 0.08 0.00 0.01 0.00 0.00 72.50 68.72 2k07 s THR 18 CO 0.41 0.44 0.36 0.21 -0.69 0.00 0.00 174.62 175.34 2k07 s ASN 19 N -0.35 -0.07 0.35 3.53 2.47 -1.26 -4.62 114.94 114.98 2k07 s ASN 19 Ca 0.31 0.82 -0.10 0.00 0.42 0.00 0.00 52.86 54.31 2k07 s ASN 19 Cb -0.18 1.03 0.04 0.00 -1.45 0.00 0.00 41.25 40.68 2k07 s ASN 19 CO 0.17 -0.23 0.63 0.00 -3.72 0.00 0.00 177.10 173.96 2k07 n ALA 20 N 5.21 -1.19 -2.18 1.71 0.00 -1.26 -5.06 120.51 117.73 2k07 n ALA 20 Ca -0.10 -1.27 -0.18 0.00 0.00 0.00 0.00 53.44 51.89 2k07 n ALA 20 Cb 0.50 1.02 -0.00 0.00 0.00 0.00 0.00 19.45 20.97 2k07 n ALA 20 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2k07 s GLY 21 N -2.93 1.89 0.00 0.00 0.00 -1.26 -4.44 107.32 100.58 2k07 s GLY 21 Ca 0.19 -1.65 0.10 0.00 0.00 0.00 0.00 44.72 43.35 2k07 s GLY 21 CO 0.14 -1.50 1.26 -1.05 0.00 0.00 0.00 173.10 171.94 2k07 n PRO 22 N -1.72 0.08 0.02 2.90 -0.02 -1.26 -2.49 135.00 132.51 2k07 n PRO 22 Ca 0.05 0.25 -0.13 0.00 -2.02 0.00 0.00 63.50 61.65 2k07 n PRO 22 Cb 0.59 -1.50 -0.09 0.00 -0.02 0.00 0.00 33.50 32.48 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 -0.08 -6.07 -0.52 3.08 -1.94 -3.39 114.38 105.45 2k07 h ARG 23 Ca 0.00 0.01 -0.51 0.00 0.07 0.00 0.00 59.98 59.55 2k07 h ARG 23 Cb 0.13 0.02 -0.08 0.00 0.08 0.00 0.00 29.97 30.12 2k07 h ARG 23 CO 0.00 0.39 1.21 -0.51 -1.07 0.00 0.00 179.97 180.00 2k07 s ASP 24 N -5.60 5.98 0.12 7.04 1.11 -1.04 -4.88 116.67 119.40 2k07 s ASP 24 Ca -0.15 -0.81 -0.23 0.00 0.18 0.00 0.00 52.55 51.53 2k07 s ASP 24 Cb 0.01 -2.56 -0.06 0.00 1.07 0.00 0.00 42.92 41.39 2k07 s ASP 24 CO 0.63 -1.96 1.67 0.03 1.18 0.00 0.00 175.17 176.72 2k07 h ARG 25 N 10.81 -0.23 -0.11 8.23 3.08 -1.83 0.46 114.38 134.80 2k07 h ARG 25 Ca 0.00 0.02 -0.15 0.00 0.07 0.00 0.00 59.98 59.92 2k07 h ARG 25 Cb 1.04 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 2k07 h ARG 25 CO 1.32 -0.15 -0.56 1.05 -1.07 0.00 0.00 179.97 180.56 2k07 h GLU 26 N -0.23 0.35 -0.01 0.04 4.11 -1.95 -0.90 114.58 115.98 2k07 h GLU 26 Ca 0.06 -0.22 -0.20 0.00 0.07 0.00 0.00 59.36 59.07 2k07 h GLU 26 Cb 0.32 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 2k07 h GLU 26 CO -0.18 0.82 -0.85 -0.07 0.07 0.00 0.00 179.01 178.80 2k07 h LEU 27 N 0.27 0.31 0.05 3.06 -0.00 -1.83 -1.88 115.31 115.28 2k07 h LEU 27 Ca 0.00 -0.24 -0.00 0.00 -0.00 0.00 0.00 57.88 57.64 2k07 h LEU 27 Cb 1.07 -0.09 0.00 0.00 -0.00 0.00 0.00 40.66 41.64 2k07 h LEU 27 CO 0.09 1.02 -0.02 -0.25 -0.00 0.00 0.00 178.44 179.28 2k07 h TRP 28 N 0.14 -0.06 -0.27 1.13 2.91 0.15 -0.31 115.95 119.64 2k07 h TRP 28 Ca -0.04 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.98 2k07 h TRP 28 Cb 1.46 0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 30.12 2k07 h TRP 28 CO 0.03 0.21 0.17 0.28 -1.03 0.00 0.00 178.44 178.10 2k07 h VAL 29 N -0.33 1.07 -0.04 2.65 2.07 -1.20 0.44 116.25 120.91 2k07 h VAL 29 Ca -0.01 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 2k07 h VAL 29 Cb 0.30 0.69 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 2k07 h VAL 29 CO 0.01 0.07 -0.01 -0.61 0.02 0.00 0.00 177.57 177.06 2k07 h GLN 30 N 0.37 0.08 0.00 1.57 4.15 -1.03 -1.36 115.11 118.88 2k07 h GLN 30 Ca 0.10 -0.03 -0.08 0.00 0.77 0.00 0.00 58.65 59.40 2k07 h GLN 30 Cb -0.03 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.65 2k07 h GLN 30 CO -0.02 0.42 -0.39 0.07 -1.93 0.00 0.00 178.83 176.98 2k07 h ARG 31 N -0.26 0.00 -0.43 1.69 0.11 -0.58 -1.58 114.38 113.32 2k07 h ARG 31 Ca 0.01 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.07 2k07 h ARG 31 Cb 0.39 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.45 2k07 h ARG 31 CO 0.00 0.39 0.19 1.25 0.10 0.00 0.00 179.97 181.90 2k07 h LEU 32 N 0.00 0.58 -0.61 0.08 7.12 0.09 0.26 115.31 122.84 2k07 h LEU 32 Ca -0.00 -0.15 -0.15 0.00 0.13 0.00 0.00 57.88 57.71 2k07 h LEU 32 Cb 0.82 -0.15 -0.02 0.00 -0.53 0.00 0.00 40.66 40.78 2k07 h LEU 32 CO 0.05 0.57 -0.68 0.07 -0.13 0.00 0.00 178.44 178.32 2k07 h LYS 33 N 0.56 0.09 0.00 1.25 2.10 -1.07 0.23 116.57 119.73 2k07 h LYS 33 Ca 0.15 -0.07 0.02 0.00 -2.00 0.00 0.00 60.65 58.74 2k07 h LYS 33 Cb 0.16 0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 31.48 2k07 h LYS 33 CO -0.02 0.73 -0.10 0.93 -2.00 0.00 0.00 179.45 178.99 2k07 h GLU 34 N 0.06 -0.17 -0.69 0.07 4.39 -0.85 0.16 114.58 117.54 2k07 h GLU 34 Ca -0.01 0.01 -0.07 0.00 0.34 0.00 0.00 59.36 59.63 2k07 h GLU 34 Cb 1.21 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.87 2k07 h GLU 34 CO 0.10 -0.12 0.15 1.49 -1.16 0.00 0.00 179.01 179.47 2k07 h GLU 35 N -0.18 1.11 -0.70 2.33 4.57 -0.32 -1.88 114.58 119.51 2k07 h GLU 35 Ca 0.04 -0.27 -0.02 0.00 -1.18 0.00 0.00 59.36 57.93 2k07 h GLU 35 Cb 0.23 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.64 2k07 h GLU 35 CO -0.10 0.99 0.37 -0.92 -1.18 0.00 0.00 179.01 178.16 2k07 h TYR 36 N 1.05 0.97 -0.67 0.92 5.03 -0.22 0.26 116.97 124.30 2k07 h TYR 36 Ca 0.22 -0.03 -0.07 0.00 2.58 0.00 0.00 58.73 61.43 2k07 h TYR 36 Cb 0.39 -0.31 -0.03 0.00 1.55 0.00 0.00 36.73 38.33 2k07 h TYR 36 CO 0.03 0.70 0.16 1.96 -1.32 0.00 0.00 178.16 179.69 2k07 h GLN 37 N 0.96 1.06 -0.62 1.82 1.08 -0.46 0.28 115.11 119.24 2k07 h GLN 37 Ca 0.24 -0.25 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 2k07 h GLN 37 Cb 0.06 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.32 2k07 h GLN 37 CO -0.04 0.94 0.33 1.03 -0.95 0.00 0.00 178.83 180.15 2k07 h SER 38 N 1.01 0.78 0.22 1.46 0.87 -0.68 0.81 113.55 118.02 2k07 h SER 38 Ca 0.21 -0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.66 2k07 h SER 38 Cb 0.36 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.12 2k07 h SER 38 CO 0.00 0.66 -0.11 -0.07 -0.53 0.00 0.00 176.83 176.77 2k07 h LEU 39 N 0.84 -0.27 -1.67 2.23 3.38 0.08 -2.49 115.31 117.40 2k07 h LEU 39 Ca 0.22 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.23 2k07 h LEU 39 Cb 0.06 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2k07 h LEU 39 CO -0.03 -0.19 0.26 0.40 0.09 0.00 0.00 178.44 178.97 2k07 h ILE 40 N -0.31 1.03 -0.51 1.22 2.04 -0.27 0.92 117.51 121.64 2k07 h ILE 40 Ca -0.03 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 2k07 h ILE 40 Cb 0.24 0.57 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 2k07 h ILE 40 CO 0.05 0.08 0.30 -0.09 0.00 0.00 0.00 178.15 178.48 2k07 h ARG 41 N 0.43 0.69 -0.32 2.37 9.65 -0.52 0.42 114.38 127.11 2k07 h ARG 41 Ca 0.16 -0.07 -0.10 0.00 -1.10 0.00 0.00 59.98 58.87 2k07 h ARG 41 Cb 0.11 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.54 2k07 h ARG 41 CO -0.04 0.52 -0.18 -0.92 2.80 0.00 0.00 179.97 182.15 2k07 h TYR 42 N 0.68 0.79 -0.81 2.20 3.20 -0.77 -2.18 116.97 120.07 2k07 h TYR 42 Ca 0.18 -0.20 0.02 0.00 3.14 0.00 0.00 58.73 61.87 2k07 h TYR 42 Cb 0.01 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.06 2k07 h TYR 42 CO -0.02 0.91 0.53 0.28 -1.64 0.00 0.00 178.16 178.22 2k07 h VAL 43 N 0.44 1.17 -0.30 1.81 2.07 -0.58 -1.56 116.25 119.31 2k07 h VAL 43 Ca 0.07 -0.36 0.01 0.00 0.82 0.00 0.00 66.70 67.23 2k07 h VAL 43 Cb 0.71 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2k07 h VAL 43 CO 0.05 0.19 0.18 -0.08 0.02 0.00 0.00 177.57 177.93 2k07 h GLU 44 N 1.06 0.35 -0.90 1.57 4.22 -0.05 0.90 114.58 121.74 2k07 h GLU 44 Ca 0.31 -0.02 0.11 0.00 0.08 0.00 0.00 59.36 59.84 2k07 h GLU 44 Cb -0.07 -0.08 -0.08 0.00 0.50 0.00 0.00 28.75 29.02 2k07 h GLU 44 CO -0.09 0.23 0.53 -0.91 -2.18 0.00 0.00 179.01 176.60 2k07 h ASN 45 N 0.37 0.75 -0.47 1.04 2.35 -0.88 0.33 115.58 119.07 2k07 h ASN 45 Ca 0.11 0.05 -0.11 0.00 -0.55 0.00 0.00 56.30 55.81 2k07 h ASN 45 Cb -0.01 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 2k07 h ASN 45 CO -0.05 0.40 -0.12 0.78 -1.65 0.00 0.00 177.43 176.79 2k07 h ASN 46 N 0.85 0.91 0.50 5.81 2.35 -0.44 -2.90 115.58 122.66 2k07 h ASN 46 Ca 0.44 -0.37 -0.06 0.00 -0.55 0.00 0.00 56.30 55.76 2k07 h ASN 46 Cb 0.45 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 2k07 h ASN 46 CO -0.27 1.07 -0.31 0.11 -1.65 0.00 0.00 177.43 176.38 2k07 h LYS 47 N 0.75 0.00 -0.87 0.81 1.79 0.33 0.41 116.57 119.79 2k07 h LYS 47 Ca 0.12 0.00 0.06 0.00 -2.18 0.00 0.00 60.65 58.65 2k07 h LYS 47 Cb 0.67 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.26 2k07 h LYS 47 CO 0.05 0.31 0.54 -0.91 -1.08 0.00 0.00 179.45 178.35 2k07 h ASN 48 N 0.00 0.85 -0.19 0.86 -0.26 -0.77 -2.31 115.58 113.77 2k07 h ASN 48 Ca -0.00 0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 2k07 h ASN 48 Cb 0.64 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 37.74 2k07 h ASN 48 CO 0.04 0.54 0.00 0.00 -1.06 0.00 0.00 177.43 176.95 2k07 n ALA 49 N -2.35 2.38 -2.59 -0.83 0.00 -1.06 -4.96 120.51 111.10 2k07 n ALA 49 Ca 0.12 -0.84 -0.21 0.00 0.00 0.00 0.00 53.44 52.52 2k07 n ALA 49 Cb 0.17 -0.52 0.00 0.00 0.00 0.00 0.00 19.45 19.10 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 0.83 -5.82 -1.50 0.00 2.03 0.11 -4.86 116.55 107.34 2k07 n ASP 50 Ca 0.11 -0.08 0.08 0.00 0.52 0.00 0.00 54.79 55.42 2k07 n ASP 50 Cb 0.41 -4.81 0.32 0.00 -0.72 0.00 0.00 41.12 36.33 2k07 n ASP 50 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 2k07 n ASN 51 N -2.14 4.45 -4.73 1.67 6.94 0.82 -4.95 115.26 117.31 2k07 n ASN 51 Ca -0.20 -2.49 -0.42 0.00 -0.02 0.00 0.00 54.58 51.45 2k07 n ASN 51 Cb 0.66 -0.57 -0.01 0.00 -2.36 0.00 0.00 39.78 37.51 2k07 n ASN 51 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 2k07 n ASP 52 N 0.87 3.32 0.00 0.53 2.03 -1.22 -4.91 116.55 117.18 2k07 n ASP 52 Ca 0.23 1.20 0.00 0.00 0.52 0.00 0.00 54.79 56.74 2k07 n ASP 52 Cb 0.86 -1.55 0.00 0.00 -0.72 0.00 0.00 41.12 39.71 2k07 n ASP 52 CO 0.00 0.00 0.00 -2.67 -1.92 0.00 0.00 177.20 172.61 2k07 n TRP 53 N 0.74 0.00 -3.82 -0.67 4.27 -1.26 -5.04 117.44 111.66 2k07 n TRP 53 Ca 0.04 0.00 -0.13 0.00 -3.89 0.00 0.00 57.50 53.52 2k07 n TRP 53 Cb 0.37 0.01 -0.15 0.00 -1.36 0.00 0.00 31.31 30.18 2k07 n TRP 53 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 2k07 s PHE 54 N 0.00 -0.01 -0.08 -2.67 5.36 -1.26 -0.47 117.98 118.85 2k07 s PHE 54 Ca 0.00 0.10 0.01 0.00 -0.96 0.00 0.00 56.93 56.08 2k07 s PHE 54 Cb 0.00 -0.10 0.02 0.00 -0.34 0.00 0.00 43.02 42.60 2k07 s PHE 54 CO 0.00 -0.05 -0.08 1.03 -1.46 0.00 0.00 175.22 174.66 2k07 s ARG 55 N 0.52 1.43 -0.11 10.12 1.81 -0.94 -5.04 118.95 126.74 2k07 s ARG 55 Ca -0.04 -0.27 0.03 0.00 -1.72 0.00 0.00 55.73 53.73 2k07 s ARG 55 Cb -0.06 -1.37 0.01 0.00 -0.45 0.00 0.00 34.95 33.07 2k07 s ARG 55 CO -0.02 -0.14 -0.20 -1.17 -0.68 0.00 0.00 175.30 173.10 2k07 s LEU 56 N 1.23 1.96 0.28 2.53 0.20 -1.26 -1.45 118.68 122.17 2k07 s LEU 56 Ca -0.04 -0.52 0.11 0.00 0.69 0.00 0.00 54.13 54.37 2k07 s LEU 56 Cb -0.14 -1.29 -0.05 0.00 -0.43 0.00 0.00 46.19 44.28 2k07 s LEU 56 CO -0.02 0.08 -0.14 -1.61 -0.29 0.00 0.00 176.35 174.37 2k07 s GLU 57 N 0.72 1.86 0.26 1.98 0.41 0.50 -4.99 118.70 119.43 2k07 s GLU 57 Ca -0.11 -1.69 -0.20 0.00 -0.41 0.00 0.00 54.97 52.57 2k07 s GLU 57 Cb -0.16 -1.87 0.02 0.00 -1.78 0.00 0.00 34.13 30.34 2k07 s GLU 57 CO 0.02 0.33 0.67 -1.54 -0.49 0.00 0.00 175.26 174.24 2k07 s SER 58 N -3.56 -0.27 0.96 -0.19 1.04 -1.26 -0.79 113.70 109.62 2k07 s SER 58 Ca 0.31 -0.59 -0.14 0.00 0.48 0.00 0.00 55.95 56.01 2k07 s SER 58 Cb -0.05 0.69 0.17 0.00 0.10 0.00 0.00 66.02 66.93 2k07 s SER 58 CO 0.16 -1.27 1.18 0.54 0.98 0.00 0.00 173.24 174.83 2k07 s ASN 59 N -2.91 3.12 0.26 7.02 2.20 -1.22 -4.92 114.94 118.49 2k07 s ASN 59 Ca 0.11 0.75 0.24 0.00 -0.94 0.00 0.00 52.86 53.03 2k07 s ASN 59 Cb -0.05 -1.15 0.96 0.00 -2.00 0.00 0.00 41.25 39.01 2k07 s ASN 59 CO 0.05 -2.77 1.73 0.29 -2.94 0.00 0.00 177.10 173.46 2k07 n LYS 60 N -3.88 0.22 0.10 3.55 4.01 -1.26 -1.51 118.16 119.39 2k07 n LYS 60 Ca 0.09 0.39 0.12 0.00 -0.51 0.00 0.00 58.31 58.40 2k07 n LYS 60 Cb 0.59 -1.87 0.08 0.00 -0.51 0.00 0.00 35.03 33.32 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 -1.32 1.97 5.08 -1.97 -3.48 114.58 114.86 2k07 h GLU 61 Ca 0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.05 2k07 h GLU 61 Cb 0.44 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.61 2k07 h GLU 61 CO 0.00 0.00 -0.33 0.41 -1.00 0.00 0.00 179.01 178.09 2k07 n GLY 62 N 1.23 0.85 0.30 -3.84 0.00 -0.57 -4.87 105.19 98.28 2k07 n GLY 62 Ca 0.02 -0.27 0.13 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.13 0.00 -3.68 2.61 -2.24 -1.26 -4.79 114.28 101.79 2k07 n THR 63 Ca -0.17 -0.15 -0.10 0.00 -2.27 0.00 0.00 64.05 61.36 2k07 n THR 63 Cb 0.56 0.48 -0.10 0.00 -2.10 0.00 0.00 70.33 69.17 2k07 n THR 63 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2k07 s ARG 64 N -2.44 0.41 -0.04 -0.78 3.52 -1.26 -0.73 118.95 117.63 2k07 s ARG 64 Ca 0.26 0.87 0.07 0.00 -0.13 0.00 0.00 55.73 56.79 2k07 s ARG 64 Cb 0.19 0.05 -0.01 0.00 -1.56 0.00 0.00 34.95 33.62 2k07 s ARG 64 CO 0.50 -0.17 -0.25 -1.58 -0.81 0.00 0.00 175.30 172.99 2k07 s TRP 65 N 1.62 2.33 -0.02 5.12 0.52 -0.14 -3.38 118.94 124.99 2k07 s TRP 65 Ca -0.08 -0.60 -0.01 0.00 0.02 0.00 0.00 56.10 55.42 2k07 s TRP 65 Cb -0.09 -1.52 0.01 0.00 -1.15 0.00 0.00 33.47 30.72 2k07 s TRP 65 CO -0.13 -0.15 0.04 -0.59 0.02 0.00 0.00 176.95 176.13 2k07 s PHE 66 N -0.30 -0.04 0.21 -1.98 -0.71 0.03 -1.18 117.98 114.00 2k07 s PHE 66 Ca 0.01 0.11 -0.15 0.00 -1.04 0.00 0.00 56.93 55.86 2k07 s PHE 66 Cb -0.12 -0.00 0.05 0.00 -1.21 0.00 0.00 43.02 41.74 2k07 s PHE 66 CO 0.02 -0.03 0.73 0.41 -1.34 0.00 0.00 175.22 175.02 2k07 n GLY 67 N 3.15 0.93 3.01 1.99 0.00 -0.16 -0.37 105.19 113.73 2k07 n GLY 67 Ca -0.13 -1.14 -0.22 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.05 1.28 -0.14 1.61 2.20 -0.53 -0.36 119.74 121.75 2k07 s LYS 68 Ca 0.16 -0.35 -0.01 0.00 -0.36 0.00 0.00 55.97 55.41 2k07 s LYS 68 Cb -0.03 -1.13 -0.02 0.00 -1.51 0.00 0.00 37.83 35.14 2k07 s LYS 68 CO 0.06 0.08 -0.10 0.00 -0.36 0.00 0.00 175.35 175.03 2k07 s TRP 70 N 0.33 3.27 -0.19 0.00 0.51 0.38 -0.80 118.94 122.44 2k07 s TRP 70 Ca -0.09 0.11 0.00 0.00 -2.12 0.00 0.00 56.10 54.00 2k07 s TRP 70 Cb -0.15 -2.05 0.02 0.00 -0.81 0.00 0.00 33.47 30.47 2k07 s TRP 70 CO 0.05 0.21 -0.16 -0.47 -0.51 0.00 0.00 176.95 176.07 2k07 s TYR 71 N 0.21 2.84 -0.27 -1.98 5.04 0.13 -4.80 117.35 118.52 2k07 s TYR 71 Ca 0.04 -1.53 -0.10 0.00 -2.44 0.00 0.00 57.07 53.05 2k07 s TYR 71 Cb -0.12 -1.96 -0.04 0.00 0.35 0.00 0.00 41.96 40.18 2k07 s TYR 71 CO 0.00 -0.76 0.16 0.42 -1.34 0.00 0.00 175.55 174.03 2k07 s ILE 72 N 1.32 5.00 -0.20 3.14 -1.09 -1.26 -0.80 121.20 127.31 2k07 s ILE 72 Ca 0.05 0.05 -0.05 0.00 -2.23 0.00 0.00 60.65 58.47 2k07 s ILE 72 Cb -0.14 -3.38 0.07 0.00 -1.58 0.00 0.00 42.46 37.44 2k07 s ILE 72 CO -0.11 0.27 0.11 -2.28 -1.23 0.00 0.00 174.94 171.70 2k07 s HIS 73 N 1.71 0.19 -0.94 3.97 5.65 -0.08 -4.96 115.29 120.84 2k07 s HIS 73 Ca 0.07 -0.43 -0.07 0.00 0.25 0.00 0.00 55.06 54.88 2k07 s HIS 73 Cb -0.16 -0.72 -0.02 0.00 -1.18 0.00 0.00 32.58 30.50 2k07 s HIS 73 CO 0.09 -0.60 0.77 -3.47 -0.65 0.00 0.00 174.74 170.88 2k07 n ASP 74 N 5.27 -6.52 0.00 9.88 2.03 -1.26 -2.08 116.55 123.88 2k07 n ASP 74 Ca -0.07 -0.59 0.00 0.00 0.52 0.00 0.00 54.79 54.65 2k07 n ASP 74 Cb 0.47 -4.36 0.00 0.00 -0.72 0.00 0.00 41.12 36.51 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 -2.88 0.64 -4.64 -2.67 7.99 -1.26 -4.95 117.00 109.23 2k07 n LEU 75 Ca -0.08 0.00 -0.35 0.00 -0.01 0.00 0.00 56.01 55.57 2k07 n LEU 75 Cb 0.58 -1.14 -0.10 0.00 -0.11 0.00 0.00 43.42 42.65 2k07 n LEU 75 CO 0.60 -0.39 -0.32 -0.76 -1.51 0.00 0.00 177.39 175.01 2k07 s LEU 76 N 0.00 3.50 -0.24 2.23 1.43 -0.88 -3.52 118.68 121.20 2k07 s LEU 76 Ca 0.00 0.08 0.01 0.00 -1.03 0.00 0.00 54.13 53.18 2k07 s LEU 76 Cb 0.00 -1.81 0.04 0.00 0.03 0.00 0.00 46.19 44.45 2k07 s LEU 76 CO 0.00 0.32 -0.10 -0.75 0.23 0.00 0.00 176.35 176.05 2k07 s LYS 77 N -0.56 2.61 -0.20 1.70 2.20 -1.26 -0.90 119.74 123.33 2k07 s LYS 77 Ca 0.09 -1.11 -0.03 0.00 -0.36 0.00 0.00 55.97 54.56 2k07 s LYS 77 Cb -0.12 -2.88 -0.01 0.00 -1.51 0.00 0.00 37.83 33.32 2k07 s LYS 77 CO 0.02 -0.44 -0.06 0.71 -0.36 0.00 0.00 175.35 175.22 2k07 s TYR 78 N 1.23 2.93 -0.04 4.03 2.02 0.02 -4.95 117.35 122.59 2k07 s TYR 78 Ca -0.03 -0.88 0.05 0.00 -0.37 0.00 0.00 57.07 55.84 2k07 s TYR 78 Cb -0.17 -2.05 -0.02 0.00 -0.40 0.00 0.00 41.96 39.31 2k07 s TYR 78 CO -0.06 -0.47 -0.17 -1.83 -1.57 0.00 0.00 175.55 171.45 2k07 s GLU 79 N 1.22 2.42 -0.09 -0.62 -1.05 -1.26 0.21 118.70 119.53 2k07 s GLU 79 Ca 0.03 -0.75 0.01 0.00 -0.15 0.00 0.00 54.97 54.11 2k07 s GLU 79 Cb -0.14 -2.31 0.02 0.00 -0.44 0.00 0.00 34.13 31.25 2k07 s GLU 79 CO -0.02 0.61 -0.12 -0.06 0.95 0.00 0.00 175.26 176.62 2k07 s PHE 80 N -0.72 1.63 -0.14 4.83 0.08 0.02 -4.95 117.98 118.73 2k07 s PHE 80 Ca 0.11 -0.71 -0.23 0.00 0.12 0.00 0.00 56.93 56.23 2k07 s PHE 80 Cb -0.10 -1.22 -0.03 0.00 -0.57 0.00 0.00 43.02 41.10 2k07 s PHE 80 CO 0.00 -0.40 0.70 -0.51 -0.10 0.00 0.00 175.22 174.91 2k07 s ASP 81 N 1.01 6.86 0.14 1.36 1.11 -1.26 -1.09 116.67 124.80 2k07 s ASP 81 Ca -0.07 1.04 0.08 0.00 0.18 0.00 0.00 52.55 53.78 2k07 s ASP 81 Cb -0.15 -2.39 -0.04 0.00 1.07 0.00 0.00 42.92 41.41 2k07 s ASP 81 CO -0.01 -0.24 -0.19 0.27 1.18 0.00 0.00 175.17 176.19 2k07 s ILE 82 N 1.52 1.76 0.04 0.77 -4.36 0.52 -4.55 121.20 116.91 2k07 s ILE 82 Ca 0.34 -1.78 -0.11 0.00 -0.26 0.00 0.00 60.65 58.84 2k07 s ILE 82 Cb -0.17 -1.73 0.01 0.00 1.25 0.00 0.00 42.46 41.82 2k07 s ILE 82 CO 0.13 -0.23 0.23 -1.83 0.24 0.00 0.00 174.94 173.48 2k07 s GLU 83 N -2.49 0.74 0.03 0.37 -1.05 -1.04 -0.99 118.70 114.27 2k07 s GLU 83 Ca 0.12 -0.61 -0.27 0.00 -0.15 0.00 0.00 54.97 54.06 2k07 s GLU 83 Cb -0.07 0.31 0.09 0.00 -0.44 0.00 0.00 34.13 34.02 2k07 s GLU 83 CO 0.06 -0.22 0.81 -0.59 0.95 0.00 0.00 175.26 176.26 2k07 s PHE 84 N -2.63 -0.41 0.42 4.83 -0.71 -0.33 -1.65 117.98 117.50 2k07 s PHE 84 Ca -0.04 0.29 0.08 0.00 -1.04 0.00 0.00 56.93 56.21 2k07 s PHE 84 Cb -0.01 0.54 -0.01 0.00 -1.21 0.00 0.00 43.02 42.33 2k07 s PHE 84 CO -0.04 -0.62 0.45 0.16 -1.34 0.00 0.00 175.22 173.84 2k07 s ASP 85 N -2.45 5.27 -0.58 1.98 -4.77 -1.26 -0.96 116.67 113.89 2k07 s ASP 85 Ca 0.03 -0.63 -0.01 0.00 -3.30 0.00 0.00 52.55 48.65 2k07 s ASP 85 Cb -0.01 -0.59 0.15 0.00 -1.09 0.00 0.00 42.92 41.38 2k07 s ASP 85 CO -0.09 -0.70 0.37 -0.63 0.70 0.00 0.00 175.17 174.82 2k07 s ILE 86 N -2.43 3.33 0.94 2.11 -1.09 0.09 -4.84 121.20 119.30 2k07 s ILE 86 Ca 0.51 -3.03 -0.12 0.00 -2.23 0.00 0.00 60.65 55.78 2k07 s ILE 86 Cb -0.06 -3.22 0.05 0.00 -1.58 0.00 0.00 42.46 37.66 2k07 s ILE 86 CO 0.30 -0.84 0.52 -0.81 -1.23 0.00 0.00 174.94 172.88 2k07 n PRO 87 N 3.42 -0.29 0.23 2.79 -0.04 -1.26 -4.89 135.00 134.96 2k07 n PRO 87 Ca 0.07 -0.04 0.15 0.00 -0.04 0.00 0.00 63.50 63.64 2k07 n PRO 87 Cb 0.36 -1.94 0.57 0.00 -0.04 0.00 0.00 33.50 32.46 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 -1.56 0.00 -0.30 0.52 1.08 -1.99 -2.17 117.51 113.10 2k07 h ILE 88 Ca -0.43 -0.50 0.00 0.00 -0.39 0.00 0.00 64.86 63.54 2k07 h ILE 88 Cb 1.28 1.43 0.00 0.00 -3.07 0.00 0.00 36.82 36.46 2k07 h ILE 88 CO 0.36 0.00 0.00 0.41 -0.69 0.00 0.00 178.15 178.23 2k07 n THR 89 N -2.85 0.40 -2.87 -0.27 -1.04 -1.26 -4.52 114.28 101.86 2k07 n THR 89 Ca 0.02 -0.41 -0.36 0.00 -2.04 0.00 0.00 64.05 61.26 2k07 n THR 89 Cb 0.32 0.22 -0.06 0.00 -1.82 0.00 0.00 70.33 68.98 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 -1.60 3.58 -1.58 -1.42 5.04 -0.82 -0.46 117.35 120.09 2k07 s TYR 90 Ca 0.23 1.64 0.13 0.00 -2.44 0.00 0.00 57.07 56.63 2k07 s TYR 90 Cb 0.12 -2.83 0.46 0.00 0.35 0.00 0.00 41.96 40.06 2k07 s TYR 90 CO 0.16 0.15 1.35 -0.35 -1.34 0.00 0.00 175.55 175.52 2k07 n PRO 91 N 0.25 2.53 0.24 4.97 -0.05 -1.26 -4.27 135.00 137.41 2k07 n PRO 91 Ca 0.02 -1.84 0.11 0.00 -0.05 0.00 0.00 63.50 61.75 2k07 n PRO 91 Cb 0.51 -1.55 0.71 0.00 -0.05 0.00 0.00 33.50 33.12 2k07 n PRO 91 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 175.50 176.60 2k07 h THR 92 N 2.78 0.86 -3.62 0.52 2.02 -1.56 -3.39 112.91 110.52 2k07 h THR 92 Ca 0.00 0.00 -0.51 0.00 0.77 0.00 0.00 66.41 66.67 2k07 h THR 92 Cb 0.88 0.97 -0.32 0.00 -1.74 0.00 0.00 68.15 67.94 2k07 h THR 92 CO 0.09 0.00 -0.82 -0.89 0.37 0.00 0.00 175.52 174.27 2k07 s THR 93 N -4.96 1.16 0.35 3.16 2.01 0.40 -4.86 115.64 112.90 2k07 s THR 93 Ca -0.05 -0.53 -0.26 0.00 0.31 0.00 0.00 61.69 61.17 2k07 s THR 93 Cb 0.17 -1.04 -0.10 0.00 0.01 0.00 0.00 72.50 71.55 2k07 s THR 93 CO 0.64 0.35 1.00 0.00 -0.69 0.00 0.00 174.62 175.93 2k07 s ALA 94 N 0.40 3.18 0.77 7.40 0.00 -1.26 -4.17 121.76 128.08 2k07 s ALA 94 Ca -0.10 0.63 -0.07 0.00 0.00 0.00 0.00 51.96 52.42 2k07 s ALA 94 Cb -0.13 -3.23 0.11 0.00 0.00 0.00 0.00 23.12 19.87 2k07 s ALA 94 CO 0.03 -0.01 1.08 -1.25 0.00 0.00 0.00 175.76 175.61 2k07 s PRO 95 N -2.18 1.68 -0.27 0.00 0.04 -1.26 -5.07 135.00 127.93 2k07 s PRO 95 Ca 0.53 -0.52 -0.06 0.00 0.04 0.00 0.00 61.00 60.99 2k07 s PRO 95 Cb -0.21 -2.13 -0.00 0.00 0.04 0.00 0.00 34.50 32.19 2k07 s PRO 95 CO 0.27 -1.58 0.04 -1.21 0.04 0.00 0.00 177.00 174.56 2k07 s GLU 96 N -5.37 3.25 0.09 4.56 2.02 -1.26 -5.04 118.70 116.95 2k07 s GLU 96 Ca 0.65 -0.74 -0.30 0.00 0.02 0.00 0.00 54.97 54.60 2k07 s GLU 96 Cb -0.08 -3.26 -0.06 0.00 0.10 0.00 0.00 34.13 30.83 2k07 s GLU 96 CO 0.47 -0.34 1.10 0.42 0.02 0.00 0.00 175.26 176.93 2k07 s ILE 97 N 1.51 4.17 -0.17 -1.63 1.01 -1.26 -4.56 121.20 120.27 2k07 s ILE 97 Ca 0.04 1.68 -0.05 0.00 0.00 0.00 0.00 60.65 62.32 2k07 s ILE 97 Cb -0.16 -4.07 -0.03 0.00 0.01 0.00 0.00 42.46 38.20 2k07 s ILE 97 CO 0.01 0.20 0.00 0.00 0.00 0.00 0.00 174.94 175.15 2k07 s ALA 98 N 0.51 3.14 -0.56 9.38 0.00 -0.66 -1.30 121.76 132.26 2k07 s ALA 98 Ca 0.53 -0.83 0.04 0.00 0.00 0.00 0.00 51.96 51.70 2k07 s ALA 98 Cb -0.27 -1.72 0.15 0.00 0.00 0.00 0.00 23.12 21.27 2k07 s ALA 98 CO 0.31 0.13 0.34 0.08 0.00 0.00 0.00 175.76 176.62 2k07 s VAL 99 N 0.49 2.36 0.19 0.00 1.01 -1.18 -2.50 120.40 120.77 2k07 s VAL 99 Ca -0.01 -3.48 0.34 0.00 0.00 0.00 0.00 61.98 58.83 2k07 s VAL 99 Cb -0.14 -2.61 0.35 0.00 0.00 0.00 0.00 36.38 33.99 2k07 s VAL 99 CO 0.02 -0.91 2.03 -0.65 0.00 0.00 0.00 175.10 175.59 2k07 h PRO 100 N 6.11 0.00 0.00 2.72 0.11 -1.76 -1.83 132.00 137.35 2k07 h PRO 100 Ca 0.03 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.97 2k07 h PRO 100 Cb 0.85 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.94 2k07 h PRO 100 CO 0.65 0.00 -0.84 1.49 -0.21 0.00 0.00 178.00 179.09 2k07 h GLU 101 N 0.00 0.00 0.00 1.05 4.57 -1.86 -3.16 114.58 115.18 2k07 h GLU 101 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2k07 h GLU 101 Cb 0.14 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.73 2k07 h GLU 101 CO 0.00 0.71 -0.75 -0.07 -1.18 0.00 0.00 179.01 177.72 2k07 h LEU 102 N 0.00 0.00 -8.98 1.64 3.38 -1.70 -3.41 115.31 106.24 2k07 h LEU 102 Ca -0.03 -0.09 -0.60 0.00 0.09 0.00 0.00 57.88 57.25 2k07 h LEU 102 Cb 1.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.35 2k07 h LEU 102 CO 0.09 0.05 1.40 -0.67 0.09 0.00 0.00 178.44 179.40 2k07 n ASP 103 N -2.47 3.18 0.00 -0.43 2.03 -0.98 -0.91 116.55 116.96 2k07 n ASP 103 Ca 0.02 0.43 0.00 0.00 0.52 0.00 0.00 54.79 55.76 2k07 n ASP 103 Cb 0.50 -1.47 0.00 0.00 -0.72 0.00 0.00 41.12 39.43 2k07 n ASP 103 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k07 n GLY 104 N 5.60 2.65 0.13 0.27 0.00 -1.26 -4.81 105.19 107.77 2k07 n GLY 104 Ca 0.30 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.10 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 0.66 -2.33 1.61 4.81 -0.09 -4.92 118.16 115.90 2k07 n LYS 105 Ca 0.00 0.33 -0.37 0.00 -0.87 0.00 0.00 58.31 57.40 2k07 n LYS 105 Cb 0.00 -1.65 -0.02 0.00 0.02 0.00 0.00 35.03 33.38 2k07 n LYS 105 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2k07 s THR 106 N -2.49 3.25 0.21 3.15 2.01 -0.59 -4.94 115.64 116.25 2k07 s THR 106 Ca -0.29 0.99 -0.15 0.00 0.31 0.00 0.00 61.69 62.55 2k07 s THR 106 Cb 0.08 -3.53 0.21 0.00 0.01 0.00 0.00 72.50 69.28 2k07 s THR 106 CO 0.64 0.04 1.62 0.00 -0.69 0.00 0.00 174.62 176.23 2k07 h ALA 107 N 2.40 0.31 -3.42 7.40 0.00 -1.91 -3.34 119.26 120.71 2k07 h ALA 107 Ca -0.49 0.23 -0.57 0.00 0.00 0.00 0.00 54.91 54.08 2k07 h ALA 107 Cb 1.23 0.55 -0.38 0.00 0.00 0.00 0.00 17.79 19.19 2k07 h ALA 107 CO 0.62 -0.48 -0.79 0.21 0.00 0.00 0.00 179.25 178.81 2k07 s LYS 108 N -6.19 1.42 -0.03 0.00 2.47 -1.26 -5.10 119.74 111.06 2k07 s LYS 108 Ca -0.14 -0.66 -0.04 0.00 -1.56 0.00 0.00 55.97 53.56 2k07 s LYS 108 Cb 0.19 -2.22 0.01 0.00 -1.46 0.00 0.00 37.83 34.35 2k07 s LYS 108 CO 0.73 -0.51 0.11 1.41 0.16 0.00 0.00 175.35 177.25 2k07 s MET 109 N 1.58 0.20 0.67 4.03 -2.45 -1.26 -5.11 119.30 116.96 2k07 s MET 109 Ca -0.02 0.04 -0.13 0.00 -1.25 0.00 0.00 55.69 54.34 2k07 s MET 109 Cb -0.17 0.09 0.00 0.00 1.25 0.00 0.00 34.83 36.00 2k07 s MET 109 CO -0.07 -0.03 1.07 0.71 1.05 0.00 0.00 175.02 177.75 2k07 s TYR 110 N -0.23 2.91 -0.17 4.11 2.02 -1.26 -4.81 117.35 119.93 2k07 s TYR 110 Ca -0.03 1.49 -0.29 0.00 -0.37 0.00 0.00 57.07 57.87 2k07 s TYR 110 Cb -0.02 -2.99 -0.02 0.00 -0.40 0.00 0.00 41.96 38.53 2k07 s TYR 110 CO 0.00 -1.35 1.35 0.50 -1.57 0.00 0.00 175.55 174.48 2k07 s ARG 111 N -4.59 4.16 0.00 -0.62 3.52 -1.26 -3.82 118.95 116.34 2k07 s ARG 111 Ca 0.61 1.69 0.00 0.00 -0.13 0.00 0.00 55.73 57.91 2k07 s ARG 111 Cb -0.16 -3.83 0.00 0.00 -1.56 0.00 0.00 34.95 29.40 2k07 s ARG 111 CO 0.48 -0.81 0.00 0.41 -0.81 0.00 0.00 175.30 174.56 2k07 n GLY 112 N 3.84 1.66 0.00 8.12 0.00 -1.26 -4.61 105.19 112.94 2k07 n GLY 112 Ca 0.15 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.19 4.05 -0.02 0.00 -1.25 -2.85 105.19 103.92 2k07 n GLY 113 Ca 0.00 0.71 -0.33 0.00 0.00 0.00 0.00 46.02 46.40 2k07 n GLY 113 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k07 n LYS 114 N 0.00 -3.93 -2.35 1.61 5.02 -0.42 -4.46 118.16 113.63 2k07 n LYS 114 Ca 0.00 0.45 -0.41 0.00 -2.02 0.00 0.00 58.31 56.33 2k07 n LYS 114 Cb 0.00 -5.24 -0.03 0.00 -0.02 0.00 0.00 35.03 29.74 2k07 n LYS 114 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2k07 s ILE 115 N -3.24 3.48 0.14 -0.18 -4.36 -0.52 -4.84 121.20 111.67 2k07 s ILE 115 Ca 0.69 1.26 0.06 0.00 -0.26 0.00 0.00 60.65 62.40 2k07 s ILE 115 Cb -0.37 -3.81 -0.04 0.00 1.25 0.00 0.00 42.46 39.50 2k07 s ILE 115 CO 0.85 0.21 0.04 0.00 0.24 0.00 0.00 174.94 176.29 2k07 n LEU 117 N 0.03 0.00 -4.75 0.00 4.77 -1.26 -5.04 117.00 110.75 2k07 n LEU 117 Ca -0.10 -0.29 -0.39 0.00 -0.03 0.00 0.00 56.01 55.20 2k07 n LEU 117 Cb 0.54 -0.10 0.03 0.00 -2.33 0.00 0.00 43.42 41.57 2k07 n LEU 117 CO 0.40 -0.58 0.99 0.28 -1.33 0.00 0.00 177.39 177.16 2k07 s THR 118 N -0.34 2.12 0.51 -5.08 -1.32 -1.26 -4.88 115.64 105.39 2k07 s THR 118 Ca 0.10 0.10 0.17 0.00 -1.21 0.00 0.00 61.69 60.84 2k07 s THR 118 Cb -0.01 -3.05 0.31 0.00 -1.51 0.00 0.00 72.50 68.24 2k07 s THR 118 CO 0.06 0.00 2.09 -0.78 -2.21 0.00 0.00 174.62 173.79 2k07 h ASP 119 N 1.66 0.08 -0.57 8.08 3.58 -2.03 -0.08 116.42 127.13 2k07 h ASP 119 Ca -0.51 -0.00 0.15 0.00 0.42 0.00 0.00 57.03 57.09 2k07 h ASP 119 Cb 1.29 -0.02 -0.03 0.00 1.72 0.00 0.00 39.33 42.30 2k07 h ASP 119 CO 0.58 0.05 0.40 -0.74 -2.88 0.00 0.00 179.24 176.65 2k07 h HIS 120 N 0.09 0.11 -0.13 0.28 2.76 -2.03 -1.86 115.15 114.37 2k07 h HIS 120 Ca 0.10 0.00 -0.11 0.00 -2.20 0.00 0.00 60.37 58.16 2k07 h HIS 120 Cb 0.29 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.20 2k07 h HIS 120 CO -0.00 0.05 -0.42 0.27 -1.30 0.00 0.00 177.93 176.53 2k07 h PHE 121 N 0.10 0.35 0.62 5.26 -0.00 -1.35 -2.80 116.94 119.11 2k07 h PHE 121 Ca 0.27 -0.10 -0.03 0.00 -0.00 0.00 0.00 57.97 58.12 2k07 h PHE 121 Cb 0.95 -0.08 -0.00 0.00 -0.00 0.00 0.00 35.95 36.82 2k07 h PHE 121 CO -0.00 0.67 -0.36 -0.22 -0.00 0.00 0.00 178.31 178.40 2k07 h LYS 122 N 0.25 -0.88 -0.28 6.09 3.11 -1.46 0.35 116.57 123.74 2k07 h LYS 122 Ca 0.02 0.06 -0.09 0.00 -2.81 0.00 0.00 60.65 57.83 2k07 h LYS 122 Cb 0.84 0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 32.26 2k07 h LYS 122 CO 0.07 -0.58 -0.22 -1.00 -2.81 0.00 0.00 179.45 174.91 2k07 h PRO 123 N -0.91 0.52 -0.75 1.90 0.13 -1.71 -3.04 132.00 128.14 2k07 h PRO 123 Ca -0.08 -0.19 -0.01 0.00 -0.87 0.00 0.00 66.00 64.86 2k07 h PRO 123 Cb 0.73 -0.04 -0.04 0.00 0.13 0.00 0.00 31.00 31.79 2k07 h PRO 123 CO 0.09 0.71 0.44 1.25 -0.23 0.00 0.00 178.00 180.26 2k07 h LEU 124 N 0.47 0.91 0.45 1.56 5.85 -1.17 -0.74 115.31 122.63 2k07 h LEU 124 Ca 0.07 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 2k07 h LEU 124 Cb 0.63 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.44 2k07 h LEU 124 CO 0.05 0.71 -0.22 -0.25 -0.34 0.00 0.00 178.44 178.39 2k07 h TRP 125 N 1.04 -0.56 -0.28 1.25 2.91 -0.20 -2.00 115.95 118.11 2k07 h TRP 125 Ca 0.27 -0.01 -0.03 0.00 1.13 0.00 0.00 58.89 60.25 2k07 h TRP 125 Cb -0.02 0.19 -0.02 0.00 -0.51 0.00 0.00 29.16 28.80 2k07 h TRP 125 CO 0.01 -0.32 0.05 0.00 -1.03 0.00 0.00 178.44 177.15 2k07 h ALA 126 N -0.14 1.57 -0.55 2.65 0.00 -1.49 -1.01 119.26 120.29 2k07 h ALA 126 Ca -0.06 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2k07 h ALA 126 Cb 0.50 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 2k07 h ALA 126 CO 0.10 0.32 0.14 0.00 0.00 0.00 0.00 179.25 179.82 2k07 h ARG 127 N 0.40 0.84 0.00 0.00 3.08 -0.95 -3.34 114.38 114.41 2k07 h ARG 127 Ca 0.09 -0.17 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2k07 h ARG 127 Cb 0.19 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2k07 h ARG 127 CO -0.00 0.75 -0.15 -0.91 -1.07 0.00 0.00 179.97 178.59 2k07 h ASN 128 N 0.81 0.00 -1.76 7.04 2.35 -0.54 -3.47 115.58 120.01 2k07 h ASN 128 Ca 0.18 0.00 -0.67 0.00 -0.55 0.00 0.00 56.30 55.26 2k07 h ASN 128 Cb 0.29 0.00 0.07 0.00 0.05 0.00 0.00 38.32 38.73 2k07 h ASN 128 CO -0.00 0.51 0.29 0.52 -1.65 0.00 0.00 177.43 177.10 2k07 n VAL 129 N -4.40 0.59 -0.41 2.81 0.31 -0.47 -4.58 118.33 112.17 2k07 n VAL 129 Ca -0.02 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 2k07 n VAL 129 Cb 0.08 -0.75 0.00 0.00 -0.91 0.00 0.00 33.84 32.26 2k07 n VAL 129 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2k07 n PRO 130 N 1.95 0.42 -0.01 5.55 -0.04 -1.26 -4.92 135.00 136.70 2k07 n PRO 130 Ca 0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 2k07 n PRO 130 Cb 0.22 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.68 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 -0.52 0.00 -4.09 0.54 5.02 -1.26 -4.97 118.16 112.89 2k07 n LYS 131 Ca 0.00 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.00 2k07 n LYS 131 Cb 0.00 -2.30 -0.07 0.00 -0.02 0.00 0.00 35.03 32.64 2k07 n LYS 131 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2k07 s PHE 132 N -2.38 3.11 0.00 2.13 5.36 -1.26 -2.95 117.98 122.00 2k07 s PHE 132 Ca 0.00 0.02 0.00 0.00 -0.96 0.00 0.00 56.93 55.99 2k07 s PHE 132 Cb 0.00 -1.56 0.00 0.00 -0.34 0.00 0.00 43.02 41.12 2k07 s PHE 132 CO 0.00 0.51 0.00 0.41 -1.46 0.00 0.00 175.22 174.68 2k07 n GLY 133 N 0.27 2.27 0.20 13.12 0.00 -1.26 -4.85 105.19 114.94 2k07 n GLY 133 Ca -0.09 -0.64 -0.09 0.00 0.00 0.00 0.00 46.02 45.20 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 0.56 -0.82 0.99 5.85 -1.98 0.77 115.31 120.69 2k07 h LEU 134 Ca 0.00 -0.17 0.03 0.00 0.84 0.00 0.00 57.88 58.59 2k07 h LEU 134 Cb 0.00 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 40.83 2k07 h LEU 134 CO 0.00 0.58 0.52 0.00 -0.34 0.00 0.00 178.44 179.20 2k07 h ALA 135 N 1.01 1.07 -0.05 1.25 0.00 -1.96 0.39 119.26 120.97 2k07 h ALA 135 Ca 0.14 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.86 2k07 h ALA 135 Cb 0.19 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2k07 h ALA 135 CO -0.01 0.35 -0.65 0.45 0.00 0.00 0.00 179.25 179.38 2k07 h HIS 136 N 1.02 0.27 -0.07 0.00 3.86 -1.84 -2.72 115.15 115.66 2k07 h HIS 136 Ca 0.33 -0.11 -0.01 0.00 -1.16 0.00 0.00 60.37 59.41 2k07 h HIS 136 Cb 0.01 -0.05 -0.00 0.00 1.06 0.00 0.00 27.41 28.43 2k07 h HIS 136 CO -0.03 0.80 -0.01 1.25 0.86 0.00 0.00 177.93 180.80 2k07 h LEU 137 N 0.15 0.13 -1.08 2.43 5.85 0.33 -2.17 115.31 120.95 2k07 h LEU 137 Ca -0.01 -0.33 -0.07 0.00 0.84 0.00 0.00 57.88 58.31 2k07 h LEU 137 Cb 1.17 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.15 2k07 h LEU 137 CO 0.10 0.43 -0.09 0.00 -0.34 0.00 0.00 178.44 178.54 2k07 h MET 138 N -0.17 0.54 -0.21 1.25 -0.00 -0.99 0.19 114.93 115.54 2k07 h MET 138 Ca 0.02 -0.15 -0.06 0.00 -0.00 0.00 0.00 59.70 59.51 2k07 h MET 138 Cb 0.37 -0.06 -0.01 0.00 -0.00 0.00 0.00 31.60 31.90 2k07 h MET 138 CO 0.01 0.64 -0.09 0.00 -0.00 0.00 0.00 176.91 177.46 2k07 h ALA 139 N 1.40 0.30 0.00 -3.00 0.00 -1.43 -1.07 119.26 115.46 2k07 h ALA 139 Ca 0.10 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2k07 h ALA 139 Cb 0.47 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2k07 h ALA 139 CO 0.03 0.13 -0.88 1.28 0.00 0.00 0.00 179.25 179.80 2k07 n LEU 140 N -4.55 0.68 -0.00 0.00 4.77 -0.82 -4.20 117.00 112.88 2k07 n LEU 140 Ca -0.05 0.16 -0.01 0.00 -0.03 0.00 0.00 56.01 56.08 2k07 n LEU 140 Cb 0.32 -0.12 -0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2k07 n LEU 140 CO 0.39 -0.05 -0.09 0.61 -1.33 0.00 0.00 177.39 176.93 2k07 n GLY 141 N 1.31 -0.20 0.17 -0.72 0.00 0.66 -4.60 105.19 101.81 2k07 n GLY 141 Ca 0.02 -0.04 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.13 0.45 0.36 0.99 5.85 -1.42 -0.77 115.31 120.64 2k07 h LEU 142 Ca 0.00 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 2k07 h LEU 142 Cb 0.13 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 2k07 h LEU 142 CO 0.00 0.37 -0.40 1.23 -0.34 0.00 0.00 178.44 179.30 2k07 h GLY 143 N 0.48 -1.16 1.56 3.75 0.00 -1.39 -1.65 103.07 104.67 2k07 h GLY 143 Ca 0.13 0.54 0.01 0.00 0.00 0.00 0.00 47.33 48.02 2k07 h GLY 143 CO -0.02 -0.35 0.27 -2.55 0.00 0.00 0.00 176.54 173.89 2k07 h PRO 144 N -0.78 0.50 0.12 4.80 0.11 -1.75 -0.94 132.00 134.07 2k07 h PRO 144 Ca -0.04 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 66.04 2k07 h PRO 144 Cb 0.68 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.66 2k07 h PRO 144 CO -0.07 0.33 -0.16 2.35 -0.21 0.00 0.00 178.00 180.24 2k07 h TRP 145 N 0.52 -0.40 -0.33 0.65 7.01 -0.86 -2.19 115.95 120.34 2k07 h TRP 145 Ca 0.16 0.00 -0.10 0.00 2.11 0.00 0.00 58.89 61.06 2k07 h TRP 145 Cb 0.00 0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 27.21 2k07 h TRP 145 CO -0.00 -0.23 -0.23 -0.07 -2.79 0.00 0.00 178.44 175.12 2k07 h LEU 146 N -0.32 0.64 -2.04 0.65 3.38 -1.00 -2.26 115.31 114.36 2k07 h LEU 146 Ca 0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 2k07 h LEU 146 Cb 0.32 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 2k07 h LEU 146 CO -0.06 0.86 -0.09 0.00 0.09 0.00 0.00 178.44 179.24 2k07 h ALA 147 N 1.19 1.27 0.00 1.53 0.00 -0.75 -2.56 119.26 119.94 2k07 h ALA 147 Ca 0.08 -0.08 -0.20 0.00 0.00 0.00 0.00 54.91 54.72 2k07 h ALA 147 Cb 0.69 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2k07 h ALA 147 CO 0.05 0.11 -1.55 0.28 0.00 0.00 0.00 179.25 178.14 2k07 n VAL 148 N -3.58 1.32 0.07 0.00 0.31 -0.86 -4.62 118.33 110.96 2k07 n VAL 148 Ca -0.02 -0.07 -0.09 0.00 -0.01 0.00 0.00 64.34 64.15 2k07 n VAL 148 Cb 0.21 -1.98 0.03 0.00 -0.91 0.00 0.00 33.84 31.19 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 -0.79 0.32 -0.01 5.55 4.39 -1.49 -3.31 114.58 119.24 2k07 h GLU 149 Ca -0.30 -0.28 -0.00 0.00 0.34 0.00 0.00 59.36 59.12 2k07 h GLU 149 Cb 1.16 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.87 2k07 h GLU 149 CO -0.18 0.94 -0.00 0.82 -1.16 0.00 0.00 179.01 179.43 2k07 h ILE 150 N 0.21 1.26 -1.00 3.13 1.08 -1.64 -2.02 117.51 118.53 2k07 h ILE 150 Ca -0.03 -0.78 0.21 0.00 -0.39 0.00 0.00 64.86 63.88 2k07 h ILE 150 Cb 1.33 1.76 -0.11 0.00 -3.07 0.00 0.00 36.82 36.74 2k07 h ILE 150 CO 0.12 0.20 0.61 -0.65 -0.69 0.00 0.00 178.15 177.75 2k07 h PRO 151 N -0.30 0.65 -0.26 2.37 0.11 -1.73 0.57 132.00 133.41 2k07 h PRO 151 Ca 0.00 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 65.94 2k07 h PRO 151 Cb 0.33 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.29 2k07 h PRO 151 CO 0.00 0.43 -0.37 0.22 -0.21 0.00 0.00 178.00 178.07 2k07 h ASP 152 N 0.67 0.77 -0.60 -2.05 3.58 -1.63 -0.82 116.42 116.35 2k07 h ASP 152 Ca 0.60 -0.51 0.02 0.00 0.42 0.00 0.00 57.03 57.56 2k07 h ASP 152 Cb 1.06 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 41.86 2k07 h ASP 152 CO -0.40 1.13 0.40 0.25 -2.88 0.00 0.00 179.24 177.74 2k07 h LEU 153 N 0.44 0.65 0.18 2.28 5.85 -0.39 0.16 115.31 124.48 2k07 h LEU 153 Ca 0.03 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2k07 h LEU 153 Cb 0.96 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.83 2k07 h LEU 153 CO 0.09 0.46 -0.09 0.40 -0.34 0.00 0.00 178.44 178.96 2k07 h ILE 154 N 0.76 0.89 0.00 4.05 2.04 -0.80 -2.76 117.51 121.69 2k07 h ILE 154 Ca 0.23 -0.96 -0.03 0.00 1.00 0.00 0.00 64.86 65.10 2k07 h ILE 154 Cb -0.02 1.41 -0.00 0.00 -0.74 0.00 0.00 36.82 37.47 2k07 h ILE 154 CO -0.06 0.20 -0.15 0.06 0.00 0.00 0.00 178.15 178.21 2k07 h GLN 155 N -0.76 0.00 0.00 2.37 3.07 -0.81 -0.63 115.11 118.35 2k07 h GLN 155 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.72 2k07 h GLN 155 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.07 2k07 h GLN 155 CO 0.04 0.15 0.00 1.17 0.09 0.00 0.00 178.83 180.28 2k07 n LYS 156 N -3.88 0.19 -0.45 0.06 4.81 0.53 -4.86 118.16 114.55 2k07 n LYS 156 Ca -0.02 0.39 0.00 0.00 -0.87 0.00 0.00 58.31 57.81 2k07 n LYS 156 Cb 0.24 -1.84 0.00 0.00 0.02 0.00 0.00 35.03 33.45 2k07 n LYS 156 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2k07 n GLY 157 N 0.11 0.74 0.04 3.14 0.00 -0.24 -4.99 105.19 103.98 2k07 n GLY 157 Ca 0.02 -0.33 -0.00 0.00 0.00 0.00 0.00 46.02 45.71 2k07 n GLY 157 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2k07 h VAL 158 N 0.00 0.00 -3.12 1.61 2.07 -1.64 -3.43 116.25 111.75 2k07 h VAL 158 Ca 0.00 -0.73 -0.76 0.00 0.82 0.00 0.00 66.70 66.04 2k07 h VAL 158 Cb 0.00 0.00 -0.24 0.00 -1.52 0.00 0.00 31.29 29.53 2k07 h VAL 158 CO 0.00 0.00 -0.24 0.27 0.02 0.00 0.00 177.57 177.62 2k07 s ILE 159 N -1.45 5.11 -0.25 4.57 -4.36 -1.22 -5.01 121.20 118.61 2k07 s ILE 159 Ca -0.01 -1.51 -0.00 0.00 -0.26 0.00 0.00 60.65 58.87 2k07 s ILE 159 Cb 0.00 -4.28 0.07 0.00 1.25 0.00 0.00 42.46 39.51 2k07 s ILE 159 CO 0.01 -0.85 0.01 -1.10 0.24 0.00 0.00 174.94 173.26 2k07 s GLN 160 N 1.58 1.15 0.57 0.37 -1.52 -1.26 -4.62 119.66 115.92 2k07 s GLN 160 Ca 0.03 -0.94 0.07 0.00 -1.95 0.00 0.00 55.36 52.58 2k07 s GLN 160 Cb -0.29 -2.38 0.07 0.00 -0.22 0.00 0.00 33.01 30.20 2k07 s GLN 160 CO 0.03 -0.73 0.78 -1.01 -0.25 0.00 0.00 175.29 174.11 2k07 s HIS 161 N 1.53 1.84 0.76 0.91 3.76 -1.26 -5.12 115.29 117.70 2k07 s HIS 161 Ca 0.00 -0.52 -0.04 0.00 -0.15 0.00 0.00 55.06 54.35 2k07 s HIS 161 Cb -0.18 -2.43 0.13 0.00 1.11 0.00 0.00 32.58 31.22 2k07 s HIS 161 CO -0.11 -1.08 1.05 0.15 -0.85 0.00 0.00 174.74 173.89 2k07 s LYS 162 N -4.69 1.55 -0.39 1.40 1.02 -1.26 -4.95 119.74 112.42 2k07 s LYS 162 Ca 0.61 -0.95 -0.35 0.00 0.02 0.00 0.00 55.97 55.30 2k07 s LYS 162 Cb -0.07 -2.24 -0.12 0.00 -0.52 0.00 0.00 37.83 34.88 2k07 s LYS 162 CO 0.39 -1.58 2.22 -1.91 -0.92 0.00 0.00 175.35 173.54 2k07 n GLU 163 N -2.98 0.98 0.01 1.68 2.13 -1.26 -4.82 120.64 116.38 2k07 n GLU 163 Ca 0.15 0.25 -0.05 0.00 0.66 0.00 0.00 57.16 58.17 2k07 n GLU 163 Cb 0.60 -2.43 -0.11 0.00 0.27 0.00 0.00 31.44 29.77 2k07 n GLU 163 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 2k07 h LYS 164 N 12.59 0.00 -4.54 5.31 1.79 -1.93 -3.47 116.57 126.32 2k07 h LYS 164 Ca -0.25 0.00 -0.26 0.00 -2.18 0.00 0.00 60.65 57.96 2k07 h LYS 164 Cb 1.32 0.00 -0.21 0.00 -1.58 0.00 0.00 32.23 31.77 2k07 h LYS 164 CO 1.04 0.50 -0.73 0.00 -1.08 0.00 0.00 179.45 179.19 2k07 s ASN 166 N -1.73 5.11 -0.02 0.00 0.01 -1.26 -4.91 114.94 112.14 2k07 s ASN 166 Ca -0.08 1.72 -0.06 0.00 -0.71 0.00 0.00 52.86 53.74 2k07 s ASN 166 Cb -0.08 -2.51 -0.24 0.00 0.41 0.00 0.00 41.25 38.83 2k07 s ASN 166 CO -0.00 -1.63 3.50 1.67 -1.51 0.00 0.00 177.10 179.13 2k07 n GLN 167 N -3.13 1.97 -4.27 -0.60 -0.06 -1.26 -4.82 117.38 105.21 2k07 n GLN 167 Ca 0.08 -1.02 -0.15 0.00 -2.00 0.00 0.00 57.00 53.92 2k07 n GLN 167 Cb 0.53 -1.95 -0.10 0.00 -4.06 0.00 0.00 30.24 24.66 2k07 n GLN 167 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 2k07 s LEU 168 N -0.11 2.37 0.27 1.69 1.43 -1.26 -5.17 118.68 117.89 2k07 s LEU 168 Ca 0.63 -1.10 0.02 0.00 -1.03 0.00 0.00 54.13 52.65 2k07 s LEU 168 Cb 0.31 -0.26 -0.04 0.00 0.03 0.00 0.00 46.19 46.22 2k07 s LEU 168 CO -0.01 -0.43 0.14 -1.83 0.23 0.00 0.00 176.35 174.45 2k07 s GLU 169 N -3.81 1.45 -0.32 1.70 4.04 -1.26 -5.14 118.70 115.36 2k07 s GLU 169 Ca 0.21 -1.81 0.04 0.00 0.04 0.00 0.00 54.97 53.45 2k07 s GLU 169 Cb 0.04 -0.02 0.17 0.00 0.02 0.00 0.00 34.13 34.35 2k07 s GLU 169 CO 0.03 -0.41 0.49 -1.58 -1.84 0.00 0.00 175.26 171.95 2k07 s HIS 170 N -3.78 -1.27 -0.60 4.83 2.46 -1.26 -5.11 115.29 110.56 2k07 s HIS 170 Ca 0.37 0.38 -0.28 0.00 0.47 0.00 0.00 55.06 56.01 2k07 s HIS 170 Cb 0.06 0.02 0.03 0.00 -0.13 0.00 0.00 32.58 32.56 2k07 s HIS 170 CO 0.16 -1.04 1.18 -1.58 -2.47 0.00 0.00 174.74 170.98 2k07 s HIS 171 N 2.37 2.58 -0.18 3.88 5.04 -1.26 -5.00 115.29 122.73 2k07 s HIS 171 Ca 0.12 0.29 -0.17 0.00 -1.54 0.00 0.00 55.06 53.76 2k07 s HIS 171 Cb -0.11 -4.49 -0.04 0.00 0.04 0.00 0.00 32.58 27.99 2k07 s HIS 171 CO -0.22 -1.64 0.43 -3.38 -2.34 0.00 0.00 174.74 167.59 2k07 s HIS 172 N 4.96 3.42 -0.03 3.88 -3.43 -1.26 -5.02 115.29 117.81 2k07 s HIS 172 Ca 0.40 0.71 -0.30 0.00 -0.80 0.00 0.00 55.06 55.08 2k07 s HIS 172 Cb -0.08 -2.54 -0.06 0.00 -1.43 0.00 0.00 32.58 28.46 2k07 s HIS 172 CO 0.23 0.04 1.68 -1.58 -2.00 0.00 0.00 174.74 173.11 2k07 s HIS 173 N 1.12 1.97 -0.18 0.38 2.46 -1.26 -4.99 115.29 114.79 2k07 s HIS 173 Ca 0.21 0.14 -0.07 0.00 0.47 0.00 0.00 55.06 55.82 2k07 s HIS 173 Cb -0.15 -3.96 -0.04 0.00 -0.13 0.00 0.00 32.58 28.31 2k07 s HIS 173 CO 0.08 -4.03 0.04 -1.58 -2.47 0.00 0.00 174.74 166.79 2k07 s HIS 174 N 3.86 3.19 -0.48 3.88 5.04 -1.26 -5.35 115.29 124.17 2k07 s HIS 174 Ca 0.75 -0.05 0.04 0.00 -1.54 0.00 0.00 55.06 54.26 2k07 s HIS 174 Cb -0.35 -2.07 0.03 0.00 0.04 0.00 0.00 32.58 30.23 2k07 s HIS 174 CO 0.31 0.07 0.62 -2.39 -2.34 0.00 0.00 174.74 171.01