#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 5.23 -1.89 3.04 0.00 -1.26 -4.95 120.51 120.68 2k07 n ALA 2 Ca 0.00 -1.78 -0.42 0.00 0.00 0.00 0.00 53.44 51.24 2k07 n ALA 2 Cb 0.00 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 17.99 2k07 n ALA 2 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k07 s ASP 3 N 0.14 6.57 0.35 0.00 1.11 -1.26 -4.89 116.67 118.69 2k07 s ASP 3 Ca 0.33 2.53 0.10 0.00 0.18 0.00 0.00 52.55 55.70 2k07 s ASP 3 Cb 0.26 -2.56 0.64 0.00 1.07 0.00 0.00 42.92 42.32 2k07 s ASP 3 CO -0.02 -0.91 1.79 1.05 1.18 0.00 0.00 175.17 178.27 2k07 h GLU 4 N 8.42 0.09 -0.35 8.23 4.11 -2.00 -3.05 114.58 130.05 2k07 h GLU 4 Ca -0.43 -0.04 0.06 0.00 0.07 0.00 0.00 59.36 59.02 2k07 h GLU 4 Cb 1.20 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.39 2k07 h GLU 4 CO 0.93 0.45 0.01 0.00 0.07 0.00 0.00 179.01 180.48 2k07 h ALA 5 N 1.55 0.32 0.38 1.06 0.00 -1.99 0.75 119.26 121.34 2k07 h ALA 5 Ca 0.01 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2k07 h ALA 5 Cb 0.69 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2k07 h ALA 5 CO 0.05 -0.39 -0.18 1.15 0.00 0.00 0.00 179.25 179.88 2k07 h THR 6 N 0.11 0.63 0.00 0.00 2.02 -1.94 -1.97 112.91 111.76 2k07 h THR 6 Ca 0.17 -0.05 -0.04 0.00 0.77 0.00 0.00 66.41 67.26 2k07 h THR 6 Cb 0.23 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 2k07 h THR 6 CO -0.27 0.01 -0.21 0.08 0.37 0.00 0.00 175.52 175.50 2k07 h ARG 7 N -0.54 0.00 -0.22 6.66 -0.00 -1.48 0.42 114.38 119.21 2k07 h ARG 7 Ca -0.05 0.00 -0.15 0.00 -0.00 0.00 0.00 59.98 59.78 2k07 h ARG 7 Cb 0.41 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.37 2k07 h ARG 7 CO 0.09 0.21 -0.49 0.00 -0.00 0.00 0.00 179.97 179.78 2k07 h ARG 8 N 0.00 0.60 -0.11 0.08 3.08 -0.64 -1.14 114.38 116.24 2k07 h ARG 8 Ca -0.00 -0.35 -0.13 0.00 0.07 0.00 0.00 59.98 59.57 2k07 h ARG 8 Cb 0.39 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.47 2k07 h ARG 8 CO 0.03 0.95 -0.43 0.28 -1.07 0.00 0.00 179.97 179.73 2k07 h VAL 9 N 0.48 1.37 0.00 2.04 2.07 -0.53 -3.08 116.25 118.60 2k07 h VAL 9 Ca 0.02 -1.75 0.00 0.00 0.82 0.00 0.00 66.70 65.80 2k07 h VAL 9 Cb 1.02 2.15 0.00 0.00 -1.52 0.00 0.00 31.29 32.94 2k07 h VAL 9 CO 0.10 0.52 0.00 0.52 0.02 0.00 0.00 177.57 178.73 2k07 n VAL 10 N -4.29 0.89 0.04 2.57 0.31 0.05 -0.32 118.33 117.58 2k07 n VAL 10 Ca -0.08 0.33 -0.05 0.00 -0.01 0.00 0.00 64.34 64.53 2k07 n VAL 10 Cb 0.56 -1.26 0.16 0.00 -0.91 0.00 0.00 33.84 32.39 2k07 n VAL 10 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 2k07 h SER 11 N 0.00 0.44 0.31 4.52 0.87 -1.11 -2.90 113.55 115.69 2k07 h SER 11 Ca 0.00 -0.19 -0.04 0.00 -1.23 0.00 0.00 61.79 60.33 2k07 h SER 11 Cb 0.29 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.12 2k07 h SER 11 CO 0.00 0.79 -1.73 -0.62 -0.53 0.00 0.00 176.83 174.75 2k07 n GLU 12 N -4.03 0.65 -3.84 2.24 1.02 -0.40 -4.55 120.64 111.73 2k07 n GLU 12 Ca -0.01 -0.07 -0.31 0.00 -0.02 0.00 0.00 57.16 56.75 2k07 n GLU 12 Cb 0.49 -1.62 -0.11 0.00 -0.02 0.00 0.00 31.44 30.18 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 -3.35 3.25 0.96 -3.67 1.01 0.57 -4.89 121.20 115.08 2k07 s ILE 13 Ca -0.06 -4.02 -0.15 0.00 0.00 0.00 0.00 60.65 56.42 2k07 s ILE 13 Cb 0.12 -3.11 0.18 0.00 0.01 0.00 0.00 42.46 39.65 2k07 s ILE 13 CO 0.86 -1.00 1.21 -2.16 0.00 0.00 0.00 174.94 173.86 2k07 s PRO 14 N -1.24 0.70 0.48 2.79 0.04 -1.10 -4.34 135.00 132.32 2k07 s PRO 14 Ca 0.24 -0.06 -0.19 0.00 0.04 0.00 0.00 61.00 61.04 2k07 s PRO 14 Cb -0.08 -1.82 -0.09 0.00 0.04 0.00 0.00 34.50 32.55 2k07 s PRO 14 CO -0.13 -2.43 0.97 0.14 0.04 0.00 0.00 177.00 175.59 2k07 s VAL 15 N -3.51 4.42 0.02 -0.36 -7.23 -1.26 -4.85 120.40 107.62 2k07 s VAL 15 Ca 0.68 1.33 -0.23 0.00 -1.81 0.00 0.00 61.98 61.95 2k07 s VAL 15 Cb -0.09 -3.65 -0.05 0.00 0.56 0.00 0.00 36.38 33.15 2k07 s VAL 15 CO 0.53 -0.50 0.68 -0.76 -0.31 0.00 0.00 175.10 174.73 2k07 s LEU 16 N -3.66 4.43 -0.01 1.32 1.02 -0.33 -4.96 118.68 116.48 2k07 s LEU 16 Ca 0.61 1.29 0.08 0.00 0.02 0.00 0.00 54.13 56.13 2k07 s LEU 16 Cb -0.10 -3.07 -0.24 0.00 0.02 0.00 0.00 46.19 42.81 2k07 s LEU 16 CO 0.23 0.06 0.80 0.11 0.02 0.00 0.00 176.35 177.56 2k07 h LYS 17 N 5.68 0.06 -5.04 1.70 6.56 -1.96 -3.38 116.57 120.18 2k07 h LYS 17 Ca -0.44 -0.10 -0.68 0.00 -1.06 0.00 0.00 60.65 58.37 2k07 h LYS 17 Cb 1.20 0.04 -0.18 0.00 -0.57 0.00 0.00 32.23 32.72 2k07 h LYS 17 CO 0.70 0.74 0.08 0.99 -2.06 0.00 0.00 179.45 179.91 2k07 s THR 18 N -2.62 4.84 -0.06 -0.16 2.01 -1.26 -5.00 115.64 113.39 2k07 s THR 18 Ca -0.05 -0.41 0.04 0.00 0.31 0.00 0.00 61.69 61.57 2k07 s THR 18 Cb 0.08 -4.31 0.00 0.00 0.01 0.00 0.00 72.50 68.28 2k07 s THR 18 CO 0.82 -0.81 -0.18 0.21 -0.69 0.00 0.00 174.62 173.98 2k07 s ASN 19 N 2.66 2.28 0.14 3.53 2.47 -1.26 -4.43 114.94 120.33 2k07 s ASN 19 Ca 0.16 -0.38 -0.25 0.00 0.42 0.00 0.00 52.86 52.81 2k07 s ASN 19 Cb -0.19 -0.79 0.07 0.00 -1.45 0.00 0.00 41.25 38.89 2k07 s ASN 19 CO 0.13 0.14 0.90 0.00 -3.72 0.00 0.00 177.10 174.54 2k07 s ALA 20 N 0.20 -1.63 0.44 1.71 0.00 -1.26 -5.02 121.76 116.19 2k07 s ALA 20 Ca -0.08 0.26 0.08 0.00 0.00 0.00 0.00 51.96 52.21 2k07 s ALA 20 Cb -0.14 0.64 0.02 0.00 0.00 0.00 0.00 23.12 23.64 2k07 s ALA 20 CO 0.04 -0.96 0.59 0.20 0.00 0.00 0.00 175.76 175.63 2k07 s GLY 21 N -2.85 1.93 0.04 0.00 0.00 -1.26 -4.60 107.32 100.58 2k07 s GLY 21 Ca 0.10 -1.70 0.05 0.00 0.00 0.00 0.00 44.72 43.18 2k07 s GLY 21 CO -0.00 -1.49 1.16 -1.05 0.00 0.00 0.00 173.10 171.72 2k07 n PRO 22 N -1.90 0.02 0.20 2.90 -0.02 -1.26 -1.45 135.00 133.49 2k07 n PRO 22 Ca 0.09 0.47 0.06 0.00 -2.02 0.00 0.00 63.50 62.10 2k07 n PRO 22 Cb 0.59 -1.56 0.42 0.00 -0.02 0.00 0.00 33.50 32.94 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 -4.25 -0.52 2.47 -1.93 -3.37 114.38 106.78 2k07 h ARG 23 Ca 0.00 0.00 -0.69 0.00 -1.26 0.00 0.00 59.98 58.03 2k07 h ARG 23 Cb 0.05 0.00 -0.35 0.00 -1.65 0.00 0.00 29.97 28.02 2k07 h ARG 23 CO 0.00 0.32 -0.50 0.34 0.56 0.00 0.00 179.97 180.69 2k07 s ASP 24 N -6.53 5.25 0.39 7.04 -1.08 -0.53 -4.95 116.67 116.26 2k07 s ASP 24 Ca -0.01 -2.25 0.14 0.00 -0.52 0.00 0.00 52.55 49.91 2k07 s ASP 24 Cb 0.12 -1.84 0.80 0.00 -1.46 0.00 0.00 42.92 40.54 2k07 s ASP 24 CO 0.68 -0.50 1.86 0.03 0.52 0.00 0.00 175.17 177.76 2k07 h ARG 25 N 7.79 0.00 0.30 4.34 3.08 -1.81 0.14 114.38 128.21 2k07 h ARG 25 Ca -0.10 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 2k07 h ARG 25 Cb 1.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.08 2k07 h ARG 25 CO 0.71 0.33 -0.14 1.49 -1.07 0.00 0.00 179.97 181.28 2k07 h GLU 26 N 0.00 -0.38 0.00 0.04 4.57 -1.95 0.97 114.58 117.83 2k07 h GLU 26 Ca -0.00 0.03 -0.11 0.00 -1.18 0.00 0.00 59.36 58.09 2k07 h GLU 26 Cb 0.59 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.26 2k07 h GLU 26 CO 0.04 -0.17 -0.53 -0.07 -1.18 0.00 0.00 179.01 177.11 2k07 h LEU 27 N -0.53 0.00 -0.26 1.64 -0.00 -1.92 -3.11 115.31 111.14 2k07 h LEU 27 Ca -0.04 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.82 2k07 h LEU 27 Cb 0.39 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.04 2k07 h LEU 27 CO 0.07 0.53 0.07 -0.25 -0.00 0.00 0.00 178.44 178.85 2k07 h TRP 28 N 0.00 0.42 -0.92 1.13 2.91 -0.50 0.13 115.95 119.12 2k07 h TRP 28 Ca -0.01 -0.05 0.01 0.00 1.13 0.00 0.00 58.89 59.97 2k07 h TRP 28 Cb 1.19 -0.12 -0.05 0.00 -0.51 0.00 0.00 29.16 29.67 2k07 h TRP 28 CO 0.00 0.48 0.61 0.28 -1.03 0.00 0.00 178.44 178.78 2k07 h VAL 29 N 0.24 1.24 -0.39 2.65 2.07 -0.80 0.35 116.25 121.61 2k07 h VAL 29 Ca 0.08 -0.43 -0.09 0.00 0.82 0.00 0.00 66.70 67.08 2k07 h VAL 29 Cb 0.27 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 29.91 2k07 h VAL 29 CO -0.00 0.23 -0.10 1.56 0.02 0.00 0.00 177.57 179.28 2k07 h GLN 30 N 1.24 0.76 -0.30 1.57 4.20 -1.45 -2.63 115.11 118.50 2k07 h GLN 30 Ca 0.34 -0.29 -0.07 0.00 0.06 0.00 0.00 58.65 58.69 2k07 h GLN 30 Cb -0.14 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.58 2k07 h GLN 30 CO -0.07 0.90 -0.09 -0.09 -0.67 0.00 0.00 178.83 178.80 2k07 h ARG 31 N 0.57 0.50 -0.48 1.46 2.43 -0.08 -1.74 114.38 117.05 2k07 h ARG 31 Ca 0.10 -0.13 -0.03 0.00 -0.81 0.00 0.00 59.98 59.10 2k07 h ARG 31 Cb 0.62 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 2k07 h ARG 31 CO 0.04 0.60 0.17 1.25 -1.51 0.00 0.00 179.97 180.52 2k07 h LEU 32 N 0.47 0.67 -0.66 3.80 7.12 -0.13 0.40 115.31 126.99 2k07 h LEU 32 Ca 0.09 -0.18 -0.10 0.00 0.13 0.00 0.00 57.88 57.81 2k07 h LEU 32 Cb 0.45 -0.18 -0.01 0.00 -0.53 0.00 0.00 40.66 40.39 2k07 h LEU 32 CO 0.02 0.68 -0.50 0.07 -0.13 0.00 0.00 178.44 178.58 2k07 h LYS 33 N 0.63 0.00 -0.16 1.25 2.10 -1.28 -0.23 116.57 118.88 2k07 h LYS 33 Ca 0.16 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.64 2k07 h LYS 33 Cb 0.23 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.55 2k07 h LYS 33 CO -0.01 0.50 -0.58 0.93 -2.00 0.00 0.00 179.45 178.29 2k07 h GLU 34 N 0.00 0.52 -0.68 0.07 4.39 -0.90 -2.50 114.58 115.48 2k07 h GLU 34 Ca -0.00 -0.34 -0.06 0.00 0.34 0.00 0.00 59.36 59.29 2k07 h GLU 34 Cb 1.10 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.76 2k07 h GLU 34 CO 0.06 0.95 0.18 1.49 -1.16 0.00 0.00 179.01 180.53 2k07 h GLU 35 N 0.39 1.07 -0.98 2.33 4.57 0.18 -2.37 114.58 119.77 2k07 h GLU 35 Ca 0.00 -0.25 0.11 0.00 -1.18 0.00 0.00 59.36 58.04 2k07 h GLU 35 Cb 1.12 -0.15 -0.08 0.00 -0.16 0.00 0.00 28.75 29.49 2k07 h GLU 35 CO 0.11 0.95 0.61 1.88 -1.18 0.00 0.00 179.01 181.38 2k07 h TYR 36 N 1.00 1.11 -0.13 0.92 0.05 -0.87 0.19 116.97 119.23 2k07 h TYR 36 Ca 0.21 0.03 0.01 0.00 0.05 0.00 0.00 58.73 59.04 2k07 h TYR 36 Cb 0.35 -0.35 -0.02 0.00 1.01 0.00 0.00 36.73 37.72 2k07 h TYR 36 CO 0.03 0.46 0.03 1.96 -1.05 0.00 0.00 178.16 179.59 2k07 h GLN 37 N 0.99 0.09 -0.83 4.88 1.08 -0.99 0.27 115.11 120.60 2k07 h GLN 37 Ca 0.47 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.64 2k07 h GLN 37 Cb 0.43 -0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 27.80 2k07 h GLN 37 CO -0.25 0.06 0.41 1.03 -0.95 0.00 0.00 178.83 179.13 2k07 h SER 38 N 0.09 1.08 0.38 1.46 0.87 -0.99 -2.01 113.55 114.43 2k07 h SER 38 Ca 0.06 -0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.48 2k07 h SER 38 Cb 0.04 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 61.73 2k07 h SER 38 CO -0.07 0.90 -0.18 -0.07 -0.53 0.00 0.00 176.83 176.88 2k07 h LEU 39 N 1.18 -0.43 -0.63 2.23 3.38 -0.17 -2.32 115.31 118.56 2k07 h LEU 39 Ca 0.29 -0.11 0.09 0.00 0.09 0.00 0.00 57.88 58.24 2k07 h LEU 39 Cb 0.10 0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.89 2k07 h LEU 39 CO -0.04 -0.11 0.26 0.40 0.09 0.00 0.00 178.44 179.03 2k07 h ILE 40 N -0.76 0.79 -0.54 1.22 2.04 -0.40 0.10 117.51 119.97 2k07 h ILE 40 Ca -0.05 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 2k07 h ILE 40 Cb 0.52 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 2k07 h ILE 40 CO 0.08 0.08 0.29 0.03 0.00 0.00 0.00 178.15 178.64 2k07 h ARG 41 N 0.45 0.76 -0.43 2.37 2.47 -1.39 0.18 114.38 118.79 2k07 h ARG 41 Ca 0.31 -0.09 -0.05 0.00 -1.26 0.00 0.00 59.98 58.89 2k07 h ARG 41 Cb 0.37 -0.15 -0.02 0.00 -1.65 0.00 0.00 29.97 28.53 2k07 h ARG 41 CO -0.29 0.59 0.07 -0.92 0.56 0.00 0.00 179.97 179.98 2k07 h TYR 42 N 0.73 0.76 -0.11 3.04 3.20 -0.66 -1.19 116.97 122.73 2k07 h TYR 42 Ca 0.19 -0.10 -0.16 0.00 3.14 0.00 0.00 58.73 61.80 2k07 h TYR 42 Cb 0.06 -0.21 0.01 0.00 1.54 0.00 0.00 36.73 38.13 2k07 h TYR 42 CO -0.01 0.72 -0.54 0.28 -1.64 0.00 0.00 178.16 176.97 2k07 h VAL 43 N 0.57 1.35 0.00 1.81 2.07 -0.64 -2.94 116.25 118.48 2k07 h VAL 43 Ca 0.13 -1.85 -0.11 0.00 0.82 0.00 0.00 66.70 65.70 2k07 h VAL 43 Cb 0.37 2.16 -0.02 0.00 -1.52 0.00 0.00 31.29 32.28 2k07 h VAL 43 CO 0.01 0.56 -0.52 -0.33 0.02 0.00 0.00 177.57 177.30 2k07 h GLU 44 N 0.19 0.00 -0.09 1.57 3.07 -0.66 -1.54 114.58 117.12 2k07 h GLU 44 Ca -0.04 0.00 -0.06 0.00 -0.50 0.00 0.00 59.36 58.76 2k07 h GLU 44 Cb 1.19 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.08 2k07 h GLU 44 CO 0.11 0.52 -0.23 -0.91 -1.40 0.00 0.00 179.01 177.10 2k07 h ASN 45 N 0.00 0.15 -0.22 1.42 4.21 -1.23 -0.39 115.58 119.51 2k07 h ASN 45 Ca -0.01 -0.04 -0.19 0.00 1.21 0.00 0.00 56.30 57.28 2k07 h ASN 45 Cb 0.98 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 38.15 2k07 h ASN 45 CO 0.07 0.39 -0.57 0.78 -1.29 0.00 0.00 177.43 176.81 2k07 h ASN 46 N 0.14 0.92 -0.19 5.81 2.35 -1.18 -2.96 115.58 120.47 2k07 h ASN 46 Ca 0.02 -0.51 -0.03 0.00 -0.55 0.00 0.00 56.30 55.24 2k07 h ASN 46 Cb 0.50 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 2k07 h ASN 46 CO 0.03 1.30 0.04 0.11 -1.65 0.00 0.00 177.43 177.26 2k07 h LYS 47 N 0.63 0.40 0.00 0.81 1.57 -0.74 0.18 116.57 119.42 2k07 h LYS 47 Ca 0.01 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2k07 h LYS 47 Cb 1.17 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.41 2k07 h LYS 47 CO 0.12 0.40 0.00 0.09 -0.57 0.00 0.00 179.45 179.49 2k07 n ASN 48 N -4.36 0.65 -0.82 0.86 3.02 -0.21 -0.63 115.26 113.78 2k07 n ASN 48 Ca 0.01 0.70 0.08 0.00 -0.03 0.00 0.00 54.58 55.34 2k07 n ASN 48 Cb 0.18 -0.82 0.15 0.00 -0.61 0.00 0.00 39.78 38.68 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 -1.78 2.37 -2.14 5.41 0.00 -0.28 -4.95 120.51 119.14 2k07 n ALA 49 Ca 0.01 -0.93 -0.18 0.00 0.00 0.00 0.00 53.44 52.35 2k07 n ALA 49 Cb 0.17 -0.61 -0.02 0.00 0.00 0.00 0.00 19.45 18.98 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 0.99 -5.13 -3.49 0.00 2.03 0.20 -4.94 116.55 106.21 2k07 n ASP 50 Ca 0.14 0.09 -0.27 0.00 0.52 0.00 0.00 54.79 55.26 2k07 n ASP 50 Cb 0.47 -4.20 -0.09 0.00 -0.72 0.00 0.00 41.12 36.58 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 -1.23 3.26 -4.42 1.67 5.15 0.48 -4.97 115.26 115.20 2k07 n ASN 51 Ca -0.20 -3.32 -0.45 0.00 -0.60 0.00 0.00 54.58 50.01 2k07 n ASN 51 Cb 0.64 -0.68 -0.02 0.00 -0.53 0.00 0.00 39.78 39.19 2k07 n ASN 51 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2k07 s ASP 52 N -2.14 6.72 0.00 1.20 2.15 -1.26 -4.31 116.67 119.02 2k07 s ASP 52 Ca 0.37 -2.33 0.22 0.00 0.43 0.00 0.00 52.55 51.23 2k07 s ASP 52 Cb 0.11 -2.34 -0.14 0.00 -0.30 0.00 0.00 42.92 40.25 2k07 s ASP 52 CO -0.05 -0.89 0.97 -2.67 -0.17 0.00 0.00 175.17 172.36 2k07 n TRP 53 N 5.69 0.00 -3.58 -5.34 4.27 -1.26 -4.95 117.44 112.27 2k07 n TRP 53 Ca 0.22 0.00 -0.15 0.00 -3.89 0.00 0.00 57.50 53.68 2k07 n TRP 53 Cb 0.48 -0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 30.36 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 -2.82 -0.67 -0.07 -2.67 -0.71 -1.26 -0.18 117.98 109.60 2k07 s PHE 54 Ca 0.12 1.43 -0.03 0.00 -1.04 0.00 0.00 56.93 57.41 2k07 s PHE 54 Cb 0.17 0.35 0.04 0.00 -1.21 0.00 0.00 43.02 42.37 2k07 s PHE 54 CO 0.76 -0.46 0.15 1.03 -1.34 0.00 0.00 175.22 175.36 2k07 s ARG 55 N -0.39 0.05 -0.07 1.99 0.52 -0.96 -5.03 118.95 115.06 2k07 s ARG 55 Ca -0.04 0.47 0.01 0.00 -0.52 0.00 0.00 55.73 55.65 2k07 s ARG 55 Cb -0.03 -0.25 0.02 0.00 0.52 0.00 0.00 34.95 35.22 2k07 s ARG 55 CO 0.04 -0.25 -0.08 -1.17 0.02 0.00 0.00 175.30 173.86 2k07 s LEU 56 N 1.80 1.42 0.48 2.53 0.20 -1.26 -2.46 118.68 121.39 2k07 s LEU 56 Ca -0.02 -0.23 0.02 0.00 0.69 0.00 0.00 54.13 54.59 2k07 s LEU 56 Cb -0.12 -0.69 -0.02 0.00 -0.43 0.00 0.00 46.19 44.93 2k07 s LEU 56 CO -0.06 -0.03 0.02 -1.61 -0.29 0.00 0.00 176.35 174.38 2k07 s GLU 57 N 0.97 2.12 0.29 1.98 2.02 -0.09 -4.93 118.70 121.06 2k07 s GLU 57 Ca -0.09 -2.33 -0.03 0.00 0.02 0.00 0.00 54.97 52.53 2k07 s GLU 57 Cb -0.15 -1.42 -0.01 0.00 0.10 0.00 0.00 34.13 32.65 2k07 s GLU 57 CO 0.00 -0.33 0.38 -1.54 0.02 0.00 0.00 175.26 173.79 2k07 s SER 58 N -3.81 0.60 0.87 -0.19 1.04 -1.26 -0.12 113.70 110.83 2k07 s SER 58 Ca 0.12 -1.37 -0.12 0.00 0.48 0.00 0.00 55.95 55.07 2k07 s SER 58 Cb 0.03 0.57 0.11 0.00 0.10 0.00 0.00 66.02 66.83 2k07 s SER 58 CO 0.07 -1.14 1.10 0.54 0.98 0.00 0.00 173.24 174.80 2k07 s ASN 59 N -3.18 3.80 0.00 7.02 2.20 -1.17 -4.93 114.94 118.68 2k07 s ASN 59 Ca 0.32 1.26 0.24 0.00 -0.94 0.00 0.00 52.86 53.74 2k07 s ASN 59 Cb 0.01 -1.94 1.24 0.00 -2.00 0.00 0.00 41.25 38.57 2k07 s ASN 59 CO 0.17 -2.40 1.81 1.17 -2.94 0.00 0.00 177.10 174.91 2k07 n LYS 60 N -3.70 0.36 0.08 3.55 3.00 -1.26 -1.36 118.16 118.83 2k07 n LYS 60 Ca 0.07 0.05 -0.11 0.00 -0.00 0.00 0.00 58.31 58.32 2k07 n LYS 60 Cb 0.57 -1.50 -0.10 0.00 0.00 0.00 0.00 35.03 34.00 2k07 n LYS 60 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2k07 h GLU 61 N 0.00 0.16 -0.05 1.64 4.39 -1.95 -3.48 114.58 115.29 2k07 h GLU 61 Ca 0.00 -0.24 -0.02 0.00 0.34 0.00 0.00 59.36 59.44 2k07 h GLU 61 Cb 0.22 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 2k07 h GLU 61 CO 0.00 1.07 -0.02 0.41 -1.16 0.00 0.00 179.01 179.31 2k07 n GLY 62 N 1.29 0.49 0.26 -3.84 0.00 -0.46 -4.89 105.19 98.04 2k07 n GLY 62 Ca -0.04 -0.32 0.12 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.88 0.00 -3.69 2.61 -2.24 -1.26 -4.75 114.28 102.06 2k07 n THR 63 Ca -0.01 -0.14 -0.10 0.00 -2.27 0.00 0.00 64.05 61.53 2k07 n THR 63 Cb 0.08 0.56 -0.11 0.00 -2.10 0.00 0.00 70.33 68.75 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 -2.55 0.36 0.11 -0.78 3.52 -1.26 -0.19 118.95 118.15 2k07 s ARG 64 Ca 0.22 0.81 0.08 0.00 -0.13 0.00 0.00 55.73 56.71 2k07 s ARG 64 Cb 0.19 0.03 -0.04 0.00 -1.56 0.00 0.00 34.95 33.57 2k07 s ARG 64 CO 0.55 -0.18 -0.16 -1.58 -0.81 0.00 0.00 175.30 173.13 2k07 s TRP 65 N 1.63 2.59 -0.21 5.12 0.52 0.10 -3.05 118.94 125.64 2k07 s TRP 65 Ca -0.08 -0.23 -0.20 0.00 0.02 0.00 0.00 56.10 55.60 2k07 s TRP 65 Cb -0.09 -1.38 0.06 0.00 -1.15 0.00 0.00 33.47 30.91 2k07 s TRP 65 CO -0.12 0.39 0.58 -0.59 0.02 0.00 0.00 176.95 177.22 2k07 s PHE 66 N -1.14 -0.63 0.01 -1.98 -0.71 0.83 -1.10 117.98 113.26 2k07 s PHE 66 Ca 0.19 1.51 -0.13 0.00 -1.04 0.00 0.00 56.93 57.45 2k07 s PHE 66 Cb -0.11 0.22 0.04 0.00 -1.21 0.00 0.00 43.02 41.97 2k07 s PHE 66 CO 0.11 -0.32 0.61 0.41 -1.34 0.00 0.00 175.22 174.69 2k07 n GLY 67 N 2.65 0.52 3.41 1.99 0.00 -0.73 -0.91 105.19 112.13 2k07 n GLY 67 Ca -0.14 -0.96 -0.30 0.00 0.00 0.00 0.00 46.02 44.62 2k07 n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k07 s LYS 68 N -2.01 1.92 -0.07 1.61 1.02 -1.03 -2.05 119.74 119.14 2k07 s LYS 68 Ca 0.14 -1.06 0.01 0.00 0.02 0.00 0.00 55.97 55.09 2k07 s LYS 68 Cb -0.01 -2.09 0.02 0.00 -0.52 0.00 0.00 37.83 35.23 2k07 s LYS 68 CO 0.00 0.52 -0.09 0.00 -0.92 0.00 0.00 175.35 174.87 2k07 s TRP 70 N 0.99 1.22 0.03 0.00 -2.14 0.75 -0.27 118.94 119.53 2k07 s TRP 70 Ca -0.09 -0.38 0.08 0.00 2.66 0.00 0.00 56.10 58.37 2k07 s TRP 70 Cb -0.15 -0.89 -0.03 0.00 -3.10 0.00 0.00 33.47 29.30 2k07 s TRP 70 CO 0.00 -0.19 -0.23 -0.47 -2.66 0.00 0.00 176.95 173.41 2k07 s TYR 71 N 0.44 2.43 -0.30 1.66 5.04 -1.09 -4.57 117.35 120.96 2k07 s TYR 71 Ca -0.09 -0.35 -0.09 0.00 -2.44 0.00 0.00 57.07 54.11 2k07 s TYR 71 Cb -0.13 -1.45 -0.01 0.00 0.35 0.00 0.00 41.96 40.73 2k07 s TYR 71 CO 0.02 0.15 0.13 0.42 -1.34 0.00 0.00 175.55 174.93 2k07 s ILE 72 N -0.81 4.46 -0.26 3.14 -1.09 -1.26 -3.43 121.20 121.94 2k07 s ILE 72 Ca 0.12 -0.43 0.00 0.00 -2.23 0.00 0.00 60.65 58.12 2k07 s ILE 72 Cb -0.10 -3.25 0.07 0.00 -1.58 0.00 0.00 42.46 37.60 2k07 s ILE 72 CO 0.03 0.11 0.00 -2.28 -1.23 0.00 0.00 174.94 171.57 2k07 s HIS 73 N 1.59 2.24 -1.15 3.97 5.65 -0.80 -4.86 115.29 121.94 2k07 s HIS 73 Ca 0.04 -1.79 -0.15 0.00 0.25 0.00 0.00 55.06 53.41 2k07 s HIS 73 Cb -0.17 -1.71 -0.02 0.00 -1.18 0.00 0.00 32.58 29.51 2k07 s HIS 73 CO 0.05 -0.80 0.79 -0.25 -0.65 0.00 0.00 174.74 173.89 2k07 n ASP 74 N 4.71 -4.94 0.00 9.88 9.92 -1.26 -1.80 116.55 133.06 2k07 n ASP 74 Ca -0.07 -0.94 0.00 0.00 -0.53 0.00 0.00 54.79 53.25 2k07 n ASP 74 Cb 0.44 -3.80 0.00 0.00 -0.64 0.00 0.00 41.12 37.12 2k07 n ASP 74 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2k07 n LEU 75 N -4.02 0.00 -4.65 0.64 7.99 -1.26 -4.93 117.00 110.77 2k07 n LEU 75 Ca -0.12 0.00 -0.43 0.00 -0.01 0.00 0.00 56.01 55.45 2k07 n LEU 75 Cb 0.61 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.90 2k07 n LEU 75 CO 0.66 0.00 1.22 -0.76 -1.51 0.00 0.00 177.39 177.00 2k07 s LEU 76 N 0.00 4.10 -0.12 2.23 1.43 -0.74 -5.00 118.68 120.57 2k07 s LEU 76 Ca 0.00 1.72 -0.04 0.00 -1.03 0.00 0.00 54.13 54.78 2k07 s LEU 76 Cb 0.00 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.65 2k07 s LEU 76 CO 0.00 -0.96 0.02 -0.75 0.23 0.00 0.00 176.35 174.89 2k07 s LYS 77 N 3.99 3.39 -0.14 1.70 2.20 -1.26 -1.91 119.74 127.71 2k07 s LYS 77 Ca 0.63 -0.39 -0.04 0.00 -0.36 0.00 0.00 55.97 55.81 2k07 s LYS 77 Cb -0.24 -2.95 0.07 0.00 -1.51 0.00 0.00 37.83 33.20 2k07 s LYS 77 CO 0.23 0.52 0.18 1.52 -0.36 0.00 0.00 175.35 177.43 2k07 s TYR 78 N -0.36 -0.17 -0.12 4.03 1.13 -1.22 -4.84 117.35 115.80 2k07 s TYR 78 Ca 0.08 0.34 -0.04 0.00 -1.41 0.00 0.00 57.07 56.04 2k07 s TYR 78 Cb -0.12 -0.35 -0.03 0.00 -1.10 0.00 0.00 41.96 40.35 2k07 s TYR 78 CO 0.02 -0.44 0.02 -1.83 -2.51 0.00 0.00 175.55 170.81 2k07 s GLU 79 N 2.29 3.32 -0.04 -3.49 1.03 -1.26 -2.66 118.70 117.89 2k07 s GLU 79 Ca 0.04 -0.39 0.05 0.00 0.03 0.00 0.00 54.97 54.71 2k07 s GLU 79 Cb -0.14 -2.93 -0.02 0.00 -0.80 0.00 0.00 34.13 30.24 2k07 s GLU 79 CO -0.09 0.55 -0.20 -0.06 -1.33 0.00 0.00 175.26 174.14 2k07 s PHE 80 N -0.45 2.53 -0.34 4.83 0.08 0.63 -4.93 117.98 120.33 2k07 s PHE 80 Ca 0.09 -0.34 -0.18 0.00 0.12 0.00 0.00 56.93 56.61 2k07 s PHE 80 Cb -0.12 -1.58 -0.01 0.00 -0.57 0.00 0.00 43.02 40.74 2k07 s PHE 80 CO 0.02 0.04 0.53 -0.51 -0.10 0.00 0.00 175.22 175.20 2k07 s ASP 81 N -0.59 6.35 0.12 1.36 1.11 -1.26 -1.75 116.67 122.00 2k07 s ASP 81 Ca 0.09 0.07 0.07 0.00 0.18 0.00 0.00 52.55 52.96 2k07 s ASP 81 Cb -0.11 -2.28 -0.04 0.00 1.07 0.00 0.00 42.92 41.57 2k07 s ASP 81 CO 0.00 -0.47 -0.17 0.27 1.18 0.00 0.00 175.17 175.98 2k07 s ILE 82 N 2.42 1.54 0.14 0.77 -4.36 -0.87 -4.84 121.20 116.00 2k07 s ILE 82 Ca 0.20 -1.63 -0.14 0.00 -0.26 0.00 0.00 60.65 58.82 2k07 s ILE 82 Cb -0.15 -1.53 0.02 0.00 1.25 0.00 0.00 42.46 42.05 2k07 s ILE 82 CO 0.13 -0.24 0.37 -1.83 0.24 0.00 0.00 174.94 173.62 2k07 s GLU 83 N -2.27 1.11 -0.01 0.37 1.03 -1.24 -1.77 118.70 115.92 2k07 s GLU 83 Ca 0.08 -0.85 -0.29 0.00 0.03 0.00 0.00 54.97 53.94 2k07 s GLU 83 Cb -0.08 0.45 0.07 0.00 -0.80 0.00 0.00 34.13 33.77 2k07 s GLU 83 CO 0.04 -0.43 0.67 -0.59 -1.33 0.00 0.00 175.26 173.62 2k07 s PHE 84 N -3.85 -0.63 0.38 4.83 -0.71 -0.25 -2.58 117.98 115.17 2k07 s PHE 84 Ca 0.07 0.96 0.07 0.00 -1.04 0.00 0.00 56.93 56.99 2k07 s PHE 84 Cb 0.02 0.44 -0.00 0.00 -1.21 0.00 0.00 43.02 42.27 2k07 s PHE 84 CO -0.08 -0.66 0.50 0.16 -1.34 0.00 0.00 175.22 173.80 2k07 s ASP 85 N -1.51 5.72 -0.70 1.98 -4.77 -1.26 0.02 116.67 116.14 2k07 s ASP 85 Ca -0.08 -0.36 -0.06 0.00 -3.30 0.00 0.00 52.55 48.75 2k07 s ASP 85 Cb -0.00 -0.89 0.18 0.00 -1.09 0.00 0.00 42.92 41.12 2k07 s ASP 85 CO 0.05 -0.60 0.55 -0.63 0.70 0.00 0.00 175.17 175.24 2k07 s ILE 86 N -2.29 4.24 1.03 2.11 -1.09 0.73 -4.15 121.20 121.79 2k07 s ILE 86 Ca 0.50 -2.92 -0.13 0.00 -2.23 0.00 0.00 60.65 55.87 2k07 s ILE 86 Cb -0.09 -3.71 0.15 0.00 -1.58 0.00 0.00 42.46 37.23 2k07 s ILE 86 CO 0.32 -0.93 0.71 -2.65 -1.23 0.00 0.00 174.94 171.15 2k07 n PRO 87 N 3.50 -1.16 0.02 2.79 -0.02 -1.26 -4.88 135.00 134.00 2k07 n PRO 87 Ca 0.10 -0.30 0.11 0.00 -2.02 0.00 0.00 63.50 61.39 2k07 n PRO 87 Cb 0.40 -2.06 0.45 0.00 -0.02 0.00 0.00 33.50 32.26 2k07 n PRO 87 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2k07 n ILE 88 N -4.31 0.60 1.30 4.25 5.41 -1.26 -1.74 119.36 123.61 2k07 n ILE 88 Ca 0.06 0.11 0.14 0.00 1.00 0.00 0.00 62.75 64.07 2k07 n ILE 88 Cb 0.55 -0.81 0.69 0.00 -0.71 0.00 0.00 39.64 39.36 2k07 n ILE 88 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2k07 n THR 89 N -1.65 0.00 -2.57 1.39 -2.24 -1.26 -4.81 114.28 103.14 2k07 n THR 89 Ca 0.05 -0.01 -0.38 0.00 -2.27 0.00 0.00 64.05 61.44 2k07 n THR 89 Cb 0.26 -0.42 -0.04 0.00 -2.10 0.00 0.00 70.33 68.02 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 -2.68 3.43 -1.72 4.78 5.04 -0.71 -0.26 117.35 125.22 2k07 s TYR 90 Ca 0.24 1.69 0.15 0.00 -2.44 0.00 0.00 57.07 56.71 2k07 s TYR 90 Cb 0.20 -3.13 0.48 0.00 0.35 0.00 0.00 41.96 39.86 2k07 s TYR 90 CO 0.49 -0.45 1.39 -0.35 -1.34 0.00 0.00 175.55 175.28 2k07 n PRO 91 N 0.37 2.50 -0.07 4.97 -0.04 -1.26 -4.44 135.00 137.03 2k07 n PRO 91 Ca 0.03 -1.95 -0.03 0.00 -0.04 0.00 0.00 63.50 61.51 2k07 n PRO 91 Cb 0.48 -1.52 0.20 0.00 -0.04 0.00 0.00 33.50 32.62 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 3.02 1.23 -3.94 0.52 2.02 -1.43 -3.41 112.91 110.92 2k07 h THR 92 Ca 0.00 -0.97 -0.69 0.00 0.77 0.00 0.00 66.41 65.52 2k07 h THR 92 Cb 0.86 0.93 -0.22 0.00 -1.74 0.00 0.00 68.15 67.98 2k07 h THR 92 CO 0.06 0.33 -0.75 -0.89 0.37 0.00 0.00 175.52 174.64 2k07 s THR 93 N -4.94 3.19 0.46 3.16 2.01 0.64 -4.50 115.64 115.66 2k07 s THR 93 Ca -0.09 -0.71 -0.23 0.00 0.31 0.00 0.00 61.69 60.97 2k07 s THR 93 Cb 0.15 -2.27 -0.07 0.00 0.01 0.00 0.00 72.50 70.31 2k07 s THR 93 CO 0.80 0.57 1.17 0.00 -0.69 0.00 0.00 174.62 176.46 2k07 s ALA 94 N -0.77 2.98 0.67 7.40 0.00 -1.26 -4.03 121.76 126.75 2k07 s ALA 94 Ca 0.12 0.95 -0.16 0.00 0.00 0.00 0.00 51.96 52.87 2k07 s ALA 94 Cb -0.11 -3.39 0.01 0.00 0.00 0.00 0.00 23.12 19.63 2k07 s ALA 94 CO 0.01 -0.67 1.16 -1.25 0.00 0.00 0.00 175.76 175.01 2k07 s PRO 95 N -2.68 2.59 -0.98 0.00 0.04 -1.26 -4.93 135.00 127.77 2k07 s PRO 95 Ca 0.63 1.58 -0.23 0.00 0.04 0.00 0.00 61.00 63.03 2k07 s PRO 95 Cb -0.29 -1.91 0.06 0.00 0.04 0.00 0.00 34.50 32.41 2k07 s PRO 95 CO 0.35 -1.45 1.38 -1.21 0.04 0.00 0.00 177.00 176.11 2k07 s GLU 96 N -3.90 3.56 -0.17 4.56 0.41 -1.26 -4.98 118.70 116.93 2k07 s GLU 96 Ca 0.71 -1.17 -0.29 0.00 -0.41 0.00 0.00 54.97 53.81 2k07 s GLU 96 Cb -0.25 -5.20 -0.02 0.00 -1.78 0.00 0.00 34.13 26.88 2k07 s GLU 96 CO 0.41 -2.13 1.28 0.42 -0.49 0.00 0.00 175.26 174.75 2k07 s ILE 97 N 4.64 4.25 -0.16 -1.63 1.01 -1.26 -4.34 121.20 123.70 2k07 s ILE 97 Ca 0.43 1.50 -0.05 0.00 0.00 0.00 0.00 60.65 62.53 2k07 s ILE 97 Cb -0.01 -3.98 -0.03 0.00 0.01 0.00 0.00 42.46 38.44 2k07 s ILE 97 CO -0.08 -0.14 -0.00 0.00 0.00 0.00 0.00 174.94 174.71 2k07 s ALA 98 N 3.56 3.16 -0.54 9.38 0.00 -1.06 -1.80 121.76 134.46 2k07 s ALA 98 Ca 0.56 -0.79 0.05 0.00 0.00 0.00 0.00 51.96 51.78 2k07 s ALA 98 Cb -0.22 -1.67 0.19 0.00 0.00 0.00 0.00 23.12 21.42 2k07 s ALA 98 CO 0.15 0.23 0.47 0.28 0.00 0.00 0.00 175.76 176.90 2k07 n VAL 99 N 3.42 0.31 0.28 0.00 0.31 -0.05 -3.65 118.33 118.95 2k07 n VAL 99 Ca -0.17 -4.24 0.17 0.00 -0.01 0.00 0.00 64.34 60.08 2k07 n VAL 99 Cb 0.52 -1.94 0.81 0.00 -0.91 0.00 0.00 33.84 32.33 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 5.12 0.00 -0.48 5.55 0.11 -1.89 -2.81 132.00 137.60 2k07 h PRO 100 Ca 0.19 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.36 2k07 h PRO 100 Cb 0.82 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.90 2k07 h PRO 100 CO 0.56 0.06 0.32 1.49 -0.21 0.00 0.00 178.00 180.22 2k07 h GLU 101 N 0.00 0.40 -0.06 1.05 4.57 -1.93 -1.97 114.58 116.64 2k07 h GLU 101 Ca -0.00 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 2k07 h GLU 101 Cb 0.36 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 2k07 h GLU 101 CO 0.01 0.26 0.00 1.28 -1.18 0.00 0.00 179.01 179.38 2k07 n LEU 102 N -4.47 1.07 0.18 1.64 4.77 -1.06 -3.86 117.00 115.27 2k07 n LEU 102 Ca 0.06 -0.40 0.14 0.00 -0.03 0.00 0.00 56.01 55.78 2k07 n LEU 102 Cb 0.25 -0.03 0.59 0.00 -2.33 0.00 0.00 43.42 41.89 2k07 n LEU 102 CO 0.35 0.20 0.90 -2.24 -1.33 0.00 0.00 177.39 175.27 2k07 h ASP 103 N 1.56 0.00 0.00 -1.43 2.03 -1.52 -2.26 116.42 114.80 2k07 h ASP 103 Ca 0.00 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.24 2k07 h ASP 103 Cb 0.34 0.00 -0.14 0.00 -0.83 0.00 0.00 39.33 38.70 2k07 h ASP 103 CO 0.00 0.00 -0.61 0.61 -1.03 0.00 0.00 179.24 178.21 2k07 n GLY 104 N -0.22 2.68 0.95 7.15 0.00 -1.25 -4.80 105.19 109.70 2k07 n GLY 104 Ca 0.01 -0.85 -0.01 0.00 0.00 0.00 0.00 46.02 45.17 2k07 n GLY 104 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k07 n LYS 105 N -0.37 0.06 -0.67 1.61 4.76 -0.87 -5.10 118.16 117.58 2k07 n LYS 105 Ca 0.10 0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 2k07 n LYS 105 Cb 0.85 -0.60 0.00 0.00 -1.84 0.00 0.00 35.03 33.44 2k07 n LYS 105 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 2k07 n THR 106 N -3.57 0.00 -1.63 -0.18 5.66 -1.11 -4.93 114.28 108.52 2k07 n THR 106 Ca -0.02 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.60 2k07 n THR 106 Cb 0.09 -0.59 0.05 0.00 -1.55 0.00 0.00 70.33 68.33 2k07 n THR 106 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2k07 n ALA 107 N -3.00 0.34 -1.73 1.79 0.00 -1.26 -4.86 120.51 111.79 2k07 n ALA 107 Ca 0.00 0.04 -0.35 0.00 0.00 0.00 0.00 53.44 53.13 2k07 n ALA 107 Cb 0.00 -2.14 0.01 0.00 0.00 0.00 0.00 19.45 17.32 2k07 n ALA 107 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2k07 s LYS 108 N -2.70 3.24 0.52 0.00 -2.85 -1.26 -4.90 119.74 111.79 2k07 s LYS 108 Ca 0.74 1.60 -0.04 0.00 -1.00 0.00 0.00 55.97 57.27 2k07 s LYS 108 Cb -0.43 -1.99 -0.01 0.00 -2.06 0.00 0.00 37.83 33.34 2k07 s LYS 108 CO 0.48 -0.94 0.80 -1.64 0.10 0.00 0.00 175.35 174.15 2k07 s MET 109 N -3.41 3.11 -0.03 1.78 -1.94 -1.26 -5.03 119.30 112.52 2k07 s MET 109 Ca 0.72 -0.12 -0.23 0.00 -1.71 0.00 0.00 55.69 54.36 2k07 s MET 109 Cb -0.24 -2.39 -0.16 0.00 2.01 0.00 0.00 34.83 34.05 2k07 s MET 109 CO 0.30 -0.44 1.01 1.88 -0.01 0.00 0.00 175.02 177.76 2k07 h TYR 110 N 0.11 -0.27 -1.90 -0.03 0.05 -1.96 -3.47 116.97 109.50 2k07 h TYR 110 Ca -0.46 -0.01 0.04 0.00 0.05 0.00 0.00 58.73 58.36 2k07 h TYR 110 Cb 1.24 0.09 -0.22 0.00 1.01 0.00 0.00 36.73 38.85 2k07 h TYR 110 CO 0.49 0.12 0.08 0.50 -1.05 0.00 0.00 178.16 178.31 2k07 s ARG 111 N -3.91 0.63 0.00 4.88 6.06 -1.26 -4.96 118.95 120.39 2k07 s ARG 111 Ca -0.13 1.13 0.00 0.00 -2.50 0.00 0.00 55.73 54.23 2k07 s ARG 111 Cb 0.01 0.18 0.00 0.00 0.06 0.00 0.00 34.95 35.20 2k07 s ARG 111 CO 0.50 -0.14 0.00 0.41 -2.50 0.00 0.00 175.30 173.57 2k07 n GLY 112 N 4.29 0.67 2.44 8.12 0.00 -1.26 -3.72 105.19 115.73 2k07 n GLY 112 Ca -0.19 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.61 0.83 3.85 -0.02 0.00 -1.26 -4.85 105.19 101.13 2k07 n GLY 113 Ca 0.00 -0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 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 -4.10 3.97 0.42 1.61 -0.14 -1.24 -0.87 119.74 119.40 2k07 s LYS 114 Ca 0.00 0.59 -0.23 0.00 -1.36 0.00 0.00 55.97 54.97 2k07 s LYS 114 Cb 0.00 -2.52 -0.08 0.00 -1.68 0.00 0.00 37.83 33.55 2k07 s LYS 114 CO 0.00 0.21 1.10 0.96 -0.76 0.00 0.00 175.35 176.86 2k07 s ILE 115 N -1.90 3.48 -0.21 2.17 -4.36 -0.74 -4.74 121.20 114.89 2k07 s ILE 115 Ca 0.52 1.12 -0.10 0.00 -0.26 0.00 0.00 60.65 61.92 2k07 s ILE 115 Cb -0.11 -3.57 -0.05 0.00 1.25 0.00 0.00 42.46 39.98 2k07 s ILE 115 CO 0.18 -0.01 0.14 0.00 0.24 0.00 0.00 174.94 175.50 2k07 s LEU 117 N 0.58 2.58 0.60 0.00 1.43 -1.26 -5.12 118.68 117.49 2k07 s LEU 117 Ca 0.08 -1.02 -0.19 0.00 -1.03 0.00 0.00 54.13 51.97 2k07 s LEU 117 Cb -0.12 -1.06 -0.03 0.00 0.03 0.00 0.00 46.19 45.01 2k07 s LEU 117 CO 0.00 0.02 1.21 0.28 0.23 0.00 0.00 176.35 178.10 2k07 s THR 118 N -2.52 2.60 0.65 5.49 -1.32 -1.26 -4.90 115.64 114.38 2k07 s THR 118 Ca 0.29 0.37 0.40 0.00 -1.21 0.00 0.00 61.69 61.54 2k07 s THR 118 Cb -0.05 -3.14 0.41 0.00 -1.51 0.00 0.00 72.50 68.21 2k07 s THR 118 CO 0.14 -0.08 2.29 0.44 -2.21 0.00 0.00 174.62 175.20 2k07 h ASP 119 N 0.84 0.00 0.30 8.08 5.19 -2.03 -1.06 116.42 127.75 2k07 h ASP 119 Ca -0.50 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 55.84 2k07 h ASP 119 Cb 1.30 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.80 2k07 h ASP 119 CO 0.55 0.00 -0.32 0.45 -3.12 0.00 0.00 179.24 176.80 2k07 h HIS 120 N 0.00 0.03 -0.21 4.55 3.86 -2.03 -3.01 115.15 118.35 2k07 h HIS 120 Ca 0.01 -0.01 -0.12 0.00 -1.16 0.00 0.00 60.37 59.09 2k07 h HIS 120 Cb 0.09 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 2k07 h HIS 120 CO 0.00 0.35 -0.38 0.35 0.86 0.00 0.00 177.93 179.11 2k07 h PHE 121 N 0.03 0.54 0.76 2.45 3.57 -1.55 -2.64 116.94 120.09 2k07 h PHE 121 Ca 0.00 -0.15 -0.03 0.00 3.53 0.00 0.00 57.97 61.32 2k07 h PHE 121 Cb 0.58 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.20 2k07 h PHE 121 CO 0.00 0.78 -0.43 0.87 -2.23 0.00 0.00 178.31 177.30 2k07 h LYS 122 N 0.39 -1.07 -0.05 1.11 1.57 -1.64 0.14 116.57 117.03 2k07 h LYS 122 Ca 0.04 0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 58.79 2k07 h LYS 122 Cb 0.84 0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.38 2k07 h LYS 122 CO 0.07 -0.71 -0.44 -1.00 -0.57 0.00 0.00 179.45 176.80 2k07 h PRO 123 N -1.11 0.11 -0.06 3.15 0.13 -1.71 -2.90 132.00 129.61 2k07 h PRO 123 Ca -0.10 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 2k07 h PRO 123 Cb 0.88 -0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.00 2k07 h PRO 123 CO 0.12 0.53 0.04 1.25 -0.23 0.00 0.00 178.00 179.71 2k07 h LEU 124 N 0.09 0.07 0.65 1.56 5.85 -1.16 -0.72 115.31 121.64 2k07 h LEU 124 Ca 0.01 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 2k07 h LEU 124 Cb 0.81 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 41.83 2k07 h LEU 124 CO 0.06 0.07 -0.31 -0.25 -0.34 0.00 0.00 178.44 177.67 2k07 h TRP 125 N 0.06 -0.81 0.00 1.25 2.91 -0.69 -2.71 115.95 115.96 2k07 h TRP 125 Ca 0.02 -0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.01 2k07 h TRP 125 Cb 0.01 0.27 -0.00 0.00 -0.51 0.00 0.00 29.16 28.93 2k07 h TRP 125 CO -0.07 -0.50 -0.07 0.00 -1.03 0.00 0.00 178.44 176.77 2k07 h ALA 126 N -0.51 1.35 0.00 2.65 0.00 -1.46 -1.13 119.26 120.17 2k07 h ALA 126 Ca -0.09 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 2k07 h ALA 126 Cb 0.67 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2k07 h ALA 126 CO 0.15 0.09 -0.57 -0.09 0.00 0.00 0.00 179.25 178.82 2k07 h ARG 127 N 0.00 0.00 -0.34 0.00 2.43 -0.97 -3.17 114.38 112.34 2k07 h ARG 127 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2k07 h ARG 127 Cb 0.21 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2k07 h ARG 127 CO 0.01 0.57 0.00 0.09 -1.51 0.00 0.00 179.97 179.13 2k07 n ASN 128 N -3.30 2.84 -4.83 -3.80 3.02 -0.45 -4.85 115.26 103.89 2k07 n ASN 128 Ca 0.01 -1.91 -0.37 0.00 -0.03 0.00 0.00 54.58 52.28 2k07 n ASN 128 Cb 0.74 -0.22 -0.06 0.00 -0.61 0.00 0.00 39.78 39.63 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 -1.57 5.25 0.00 2.41 1.01 -1.05 -3.80 120.40 122.65 2k07 s VAL 129 Ca 0.36 0.57 0.00 0.00 0.00 0.00 0.00 61.98 62.91 2k07 s VAL 129 Cb 0.21 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 33.00 2k07 s VAL 129 CO 0.29 0.56 0.00 -0.81 0.00 0.00 0.00 175.10 175.14 2k07 n PRO 130 N 2.21 1.94 -0.94 2.72 -0.04 -1.26 -5.00 135.00 134.63 2k07 n PRO 130 Ca -0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 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 -0.09 -0.25 -3.31 0.54 5.02 -1.26 -5.01 118.16 113.80 2k07 n LYS 131 Ca 0.00 0.06 -0.38 0.00 -2.02 0.00 0.00 58.31 55.97 2k07 n LYS 131 Cb 0.00 -3.25 -0.06 0.00 -0.02 0.00 0.00 35.03 31.70 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 -2.49 3.64 0.18 2.13 5.36 -1.25 -1.19 117.98 124.37 2k07 s PHE 132 Ca 0.00 1.06 0.06 0.00 -0.96 0.00 0.00 56.93 57.09 2k07 s PHE 132 Cb 0.00 -2.52 -0.04 0.00 -0.34 0.00 0.00 43.02 40.13 2k07 s PHE 132 CO 0.00 0.37 0.08 0.20 -1.46 0.00 0.00 175.22 174.40 2k07 s GLY 133 N -0.16 1.70 0.25 13.12 0.00 -1.26 -4.87 107.32 116.10 2k07 s GLY 133 Ca 0.28 -1.31 -0.03 0.00 0.00 0.00 0.00 44.72 43.65 2k07 s GLY 133 CO 0.14 -1.33 1.78 -2.00 0.00 0.00 0.00 173.10 171.69 2k07 h LEU 134 N 2.44 0.86 -1.97 0.66 5.85 -1.98 -2.10 115.31 119.07 2k07 h LEU 134 Ca -0.47 -0.18 0.15 0.00 0.84 0.00 0.00 57.88 58.23 2k07 h LEU 134 Cb 1.21 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 2k07 h LEU 134 CO 0.61 0.86 0.39 0.00 -0.34 0.00 0.00 178.44 179.96 2k07 h ALA 135 N 1.25 2.48 -0.07 1.25 0.00 -1.91 0.21 119.26 122.47 2k07 h ALA 135 Ca 0.18 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 2k07 h ALA 135 Cb 0.36 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2k07 h ALA 135 CO 0.00 -0.63 -0.35 0.45 0.00 0.00 0.00 179.25 178.72 2k07 h HIS 136 N 0.03 0.15 -0.37 0.00 3.86 -1.76 -2.53 115.15 114.53 2k07 h HIS 136 Ca 0.26 -0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.37 2k07 h HIS 136 Cb 1.00 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 29.42 2k07 h HIS 136 CO -0.00 0.47 -0.06 1.25 0.86 0.00 0.00 177.93 180.45 2k07 h LEU 137 N 0.11 0.58 -0.34 2.43 5.85 -0.66 0.23 115.31 123.51 2k07 h LEU 137 Ca 0.01 -0.14 -0.05 0.00 0.84 0.00 0.00 57.88 58.55 2k07 h LEU 137 Cb 0.69 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 2k07 h LEU 137 CO 0.05 0.69 0.03 0.24 -0.34 0.00 0.00 178.44 179.12 2k07 h MET 138 N 0.57 0.58 -0.13 1.25 2.86 -1.40 0.18 114.93 118.84 2k07 h MET 138 Ca 0.11 -0.17 -0.20 0.00 -2.06 0.00 0.00 59.70 57.38 2k07 h MET 138 Cb 0.45 -0.06 0.01 0.00 0.06 0.00 0.00 31.60 32.06 2k07 h MET 138 CO 0.02 0.68 -0.71 0.00 1.06 0.00 0.00 176.91 177.96 2k07 h ALA 139 N 0.88 0.26 -0.01 6.32 0.00 -1.22 0.30 119.26 125.79 2k07 h ALA 139 Ca 0.10 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2k07 h ALA 139 Cb 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2k07 h ALA 139 CO 0.01 0.59 -0.63 1.28 0.00 0.00 0.00 179.25 180.50 2k07 n LEU 140 N -4.02 1.46 0.06 0.00 4.77 0.76 -4.49 117.00 115.53 2k07 n LEU 140 Ca -0.08 -0.56 0.00 0.00 -0.03 0.00 0.00 56.01 55.34 2k07 n LEU 140 Cb 0.71 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.77 2k07 n LEU 140 CO 0.51 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 2k07 n GLY 141 N 1.44 -0.12 0.12 -0.72 0.00 0.47 -4.80 105.19 101.58 2k07 n GLY 141 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 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 0.00 -0.21 0.46 0.99 5.85 -0.88 -1.86 115.31 119.65 2k07 h LEU 142 Ca 0.00 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 2k07 h LEU 142 Cb 0.00 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 2k07 h LEU 142 CO 0.00 -0.11 -0.41 1.23 -0.34 0.00 0.00 178.44 178.81 2k07 h GLY 143 N -0.12 -1.16 1.55 3.75 0.00 -1.16 -1.39 103.07 104.54 2k07 h GLY 143 Ca 0.04 0.52 0.04 0.00 0.00 0.00 0.00 47.33 47.94 2k07 h GLY 143 CO -0.09 -0.36 0.20 -0.56 0.00 0.00 0.00 176.54 175.73 2k07 h PRO 144 N -0.85 0.21 0.01 4.80 0.13 -1.79 -0.63 132.00 133.87 2k07 h PRO 144 Ca -0.06 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2k07 h PRO 144 Cb 0.73 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.81 2k07 h PRO 144 CO -0.02 0.14 -0.00 2.35 -0.23 0.00 0.00 178.00 180.23 2k07 h TRP 145 N 0.21 -0.01 -0.59 1.56 7.01 -1.09 -3.00 115.95 120.04 2k07 h TRP 145 Ca 0.13 -0.00 -0.06 0.00 2.11 0.00 0.00 58.89 61.07 2k07 h TRP 145 Cb 0.25 0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 27.28 2k07 h TRP 145 CO -0.00 0.29 0.14 -0.07 -2.79 0.00 0.00 178.44 176.00 2k07 h LEU 146 N -0.30 0.87 -0.94 0.65 3.38 -0.80 -2.23 115.31 115.94 2k07 h LEU 146 Ca -0.00 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2k07 h LEU 146 Cb 0.30 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2k07 h LEU 146 CO 0.00 0.85 0.00 0.00 0.09 0.00 0.00 178.44 179.38 2k07 n ALA 147 N -2.46 1.37 -0.10 1.53 0.00 -0.29 -1.67 120.51 118.89 2k07 n ALA 147 Ca 0.04 0.12 -0.21 0.00 0.00 0.00 0.00 53.44 53.40 2k07 n ALA 147 Cb 0.24 -1.33 -0.07 0.00 0.00 0.00 0.00 19.45 18.29 2k07 n ALA 147 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2k07 n VAL 148 N -2.17 1.13 0.07 0.00 0.31 -0.98 -4.66 118.33 112.02 2k07 n VAL 148 Ca 0.01 -0.26 -0.12 0.00 -0.01 0.00 0.00 64.34 63.96 2k07 n VAL 148 Cb 0.13 -1.80 -0.13 0.00 -0.91 0.00 0.00 33.84 31.13 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 -0.73 0.14 0.28 5.55 4.39 -1.40 -3.35 114.58 119.46 2k07 h GLU 149 Ca -0.49 -0.24 -0.01 0.00 0.34 0.00 0.00 59.36 58.96 2k07 h GLU 149 Cb 1.41 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 30.15 2k07 h GLU 149 CO -0.30 1.05 -0.14 0.82 -1.16 0.00 0.00 179.01 179.29 2k07 h ILE 150 N 0.04 0.73 -0.94 3.13 1.08 -1.54 -2.52 117.51 117.49 2k07 h ILE 150 Ca -0.12 -0.64 0.16 0.00 -0.39 0.00 0.00 64.86 63.87 2k07 h ILE 150 Cb 1.91 1.06 -0.10 0.00 -3.07 0.00 0.00 36.82 36.62 2k07 h ILE 150 CO 0.16 0.12 0.55 1.55 -0.69 0.00 0.00 178.15 179.84 2k07 h PRO 151 N -0.74 0.74 -0.36 2.37 0.13 -1.73 0.18 132.00 132.58 2k07 h PRO 151 Ca -0.04 -0.04 -0.12 0.00 -0.87 0.00 0.00 66.00 64.93 2k07 h PRO 151 Cb 0.49 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.44 2k07 h PRO 151 CO 0.06 0.49 -0.24 0.22 -0.23 0.00 0.00 178.00 178.30 2k07 h ASP 152 N 0.77 0.75 0.36 1.44 3.58 -1.69 -2.03 116.42 119.58 2k07 h ASP 152 Ca 0.51 -0.27 -0.11 0.00 0.42 0.00 0.00 57.03 57.58 2k07 h ASP 152 Cb 0.70 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.53 2k07 h ASP 152 CO -0.35 0.96 -0.47 0.25 -2.88 0.00 0.00 179.24 176.76 2k07 h LEU 153 N 0.64 0.14 0.25 2.28 5.85 -0.58 0.65 115.31 124.54 2k07 h LEU 153 Ca 0.09 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2k07 h LEU 153 Cb 0.74 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.74 2k07 h LEU 153 CO 0.06 0.59 -0.12 0.40 -0.34 0.00 0.00 178.44 179.03 2k07 h ILE 154 N 0.11 0.80 0.00 4.05 2.04 -0.81 -2.96 117.51 120.73 2k07 h ILE 154 Ca 0.01 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.21 2k07 h ILE 154 Cb 0.87 1.15 0.00 0.00 -0.74 0.00 0.00 36.82 38.10 2k07 h ILE 154 CO 0.07 0.14 0.00 -0.61 0.00 0.00 0.00 178.15 177.74 2k07 h GLN 155 N -0.70 0.00 0.00 2.37 5.75 -1.29 -0.55 115.11 120.69 2k07 h GLN 155 Ca -0.03 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 2k07 h GLN 155 Cb 0.48 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.03 2k07 h GLN 155 CO 0.06 0.00 0.00 -0.22 -2.65 0.00 0.00 178.83 176.02 2k07 h LYS 156 N 0.00 0.00 0.00 1.69 3.64 -0.78 -3.46 116.57 117.65 2k07 h LYS 156 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2k07 h LYS 156 Cb 0.42 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 2k07 h LYS 156 CO 0.00 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 177.59 2k07 n GLY 157 N -0.15 0.67 0.13 5.01 0.00 -0.21 -4.97 105.19 105.67 2k07 n GLY 157 Ca 0.01 -0.65 -0.24 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.64 1.51 -2.53 1.61 0.31 -1.13 -4.78 118.33 110.68 2k07 n VAL 158 Ca 0.00 -0.48 -0.41 0.00 -0.01 0.00 0.00 64.34 63.44 2k07 n VAL 158 Cb 0.04 -1.65 -0.03 0.00 -0.91 0.00 0.00 33.84 31.29 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 -2.51 3.84 -0.59 2.52 1.01 -1.21 -4.89 121.20 119.37 2k07 s ILE 159 Ca -0.37 -0.39 0.04 0.00 0.00 0.00 0.00 60.65 59.93 2k07 s ILE 159 Cb 0.12 -4.97 0.14 0.00 0.01 0.00 0.00 42.46 37.76 2k07 s ILE 159 CO 0.55 -1.87 0.35 -1.58 0.00 0.00 0.00 174.94 172.38 2k07 s GLN 160 N 5.29 2.15 0.01 2.79 0.74 -1.26 -4.87 119.66 124.51 2k07 s GLN 160 Ca 0.44 -2.89 0.01 0.00 0.05 0.00 0.00 55.36 52.97 2k07 s GLN 160 Cb -0.03 -3.35 -0.26 0.00 1.10 0.00 0.00 33.01 30.48 2k07 s GLN 160 CO -0.02 -1.18 0.86 1.25 -0.55 0.00 0.00 175.29 175.66 2k07 h HIS 161 N 6.08 0.30 -2.58 1.67 -0.00 -1.90 -3.48 115.15 115.24 2k07 h HIS 161 Ca 0.00 -0.22 -0.07 0.00 -0.00 0.00 0.00 60.37 60.09 2k07 h HIS 161 Cb 0.84 -0.01 -0.18 0.00 -0.00 0.00 0.00 27.41 28.06 2k07 h HIS 161 CO 0.58 1.27 0.03 0.21 -0.00 0.00 0.00 177.93 180.03 2k07 s LYS 162 N -2.63 0.99 1.01 5.26 2.47 -1.26 -5.11 119.74 120.47 2k07 s LYS 162 Ca -0.07 -0.08 -0.11 0.00 -1.56 0.00 0.00 55.97 54.15 2k07 s LYS 162 Cb 0.07 0.45 0.20 0.00 -1.46 0.00 0.00 37.83 37.10 2k07 s LYS 162 CO 0.84 -0.33 1.11 -2.00 0.16 0.00 0.00 175.35 175.12 2k07 s GLU 163 N -1.90 0.26 0.15 4.03 2.12 -1.26 -4.93 118.70 117.17 2k07 s GLU 163 Ca -0.08 1.33 -0.27 0.00 0.36 0.00 0.00 54.97 56.30 2k07 s GLU 163 Cb -0.01 -1.66 -0.02 0.00 0.26 0.00 0.00 34.13 32.71 2k07 s GLU 163 CO 0.03 -3.08 1.58 0.87 -0.54 0.00 0.00 175.26 174.12 2k07 h LYS 164 N -2.18 -0.36 -6.15 4.30 6.56 -2.01 -3.46 116.57 113.27 2k07 h LYS 164 Ca -0.50 0.02 -0.44 0.00 -1.06 0.00 0.00 60.65 58.68 2k07 h LYS 164 Cb 1.29 0.08 0.02 0.00 -0.57 0.00 0.00 32.23 33.06 2k07 h LYS 164 CO 0.44 -0.24 -0.77 0.00 -2.06 0.00 0.00 179.45 176.82 2k07 n ASN 166 N -2.94 2.26 -4.56 0.00 6.94 -1.26 -4.69 115.26 111.01 2k07 n ASN 166 Ca -0.09 -1.58 -0.36 0.00 -0.02 0.00 0.00 54.58 52.53 2k07 n ASN 166 Cb 0.59 -0.40 -0.04 0.00 -2.36 0.00 0.00 39.78 37.57 2k07 n ASN 166 CO 0.00 0.00 0.00 -1.58 -1.03 0.00 0.00 177.26 174.65 2k07 s GLN 167 N 0.12 3.02 -0.04 -3.83 -0.44 -1.26 -4.95 119.66 112.26 2k07 s GLN 167 Ca 0.00 -0.43 -0.25 0.00 -2.50 0.00 0.00 55.36 52.18 2k07 s GLN 167 Cb 0.00 -4.93 -0.04 0.00 -1.64 0.00 0.00 33.01 26.41 2k07 s GLN 167 CO 0.00 -2.69 0.77 -0.51 0.50 0.00 0.00 175.29 173.35 2k07 s LEU 168 N 7.53 4.34 0.09 3.68 1.43 -1.26 -5.03 118.68 129.46 2k07 s LEU 168 Ca 0.56 1.31 -0.28 0.00 -1.03 0.00 0.00 54.13 54.70 2k07 s LEU 168 Cb -0.05 -3.20 -0.06 0.00 0.03 0.00 0.00 46.19 42.90 2k07 s LEU 168 CO 0.02 -0.14 0.88 -1.61 0.23 0.00 0.00 176.35 175.72 2k07 s GLU 169 N 0.79 4.62 -0.40 1.70 0.41 -1.26 -5.01 118.70 119.55 2k07 s GLU 169 Ca 0.41 1.29 -0.28 0.00 -0.41 0.00 0.00 54.97 55.98 2k07 s GLU 169 Cb -0.19 -3.36 0.02 0.00 -1.78 0.00 0.00 34.13 28.82 2k07 s GLU 169 CO 0.21 0.27 1.05 -1.58 -0.49 0.00 0.00 175.26 174.72 2k07 s HIS 170 N -0.12 2.99 -0.35 1.61 5.65 -1.26 -5.00 115.29 118.80 2k07 s HIS 170 Ca 0.43 0.84 -0.22 0.00 0.25 0.00 0.00 55.06 56.35 2k07 s HIS 170 Cb -0.22 -3.99 0.01 0.00 -1.18 0.00 0.00 32.58 27.19 2k07 s HIS 170 CO 0.27 -1.00 0.75 -1.58 -0.65 0.00 0.00 174.74 172.53 2k07 s HIS 171 N 3.92 3.14 0.13 3.88 2.46 -1.26 -4.96 115.29 122.61 2k07 s HIS 171 Ca 0.44 0.57 -0.30 0.00 0.47 0.00 0.00 55.06 56.23 2k07 s HIS 171 Cb -0.10 -3.29 -0.07 0.00 -0.13 0.00 0.00 32.58 29.00 2k07 s HIS 171 CO 0.23 -0.66 1.57 0.45 -2.47 0.00 0.00 174.74 173.86 2k07 h HIS 172 N 8.39 -1.36 -3.30 3.88 3.86 -2.05 -3.40 115.15 121.16 2k07 h HIS 172 Ca -0.25 0.06 -0.30 0.00 -1.16 0.00 0.00 60.37 58.72 2k07 h HIS 172 Cb 1.10 0.62 -0.35 0.00 1.06 0.00 0.00 27.41 29.84 2k07 h HIS 172 CO 0.78 -0.49 -0.67 -1.01 0.86 0.00 0.00 177.93 177.39 2k07 s HIS 173 N -5.82 -0.07 -0.20 2.45 3.76 -1.26 -4.98 115.29 109.17 2k07 s HIS 173 Ca -0.15 0.37 0.17 0.00 -0.15 0.00 0.00 55.06 55.29 2k07 s HIS 173 Cb 0.09 -0.25 -0.24 0.00 1.11 0.00 0.00 32.58 33.29 2k07 s HIS 173 CO 0.63 -0.17 0.05 -2.39 -0.85 0.00 0.00 174.74 172.01 2k07 n HIS 174 N 4.67 0.01 -1.84 1.40 1.44 -1.26 -5.28 115.22 114.36 2k07 n HIS 174 Ca -0.17 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.54 2k07 n HIS 174 Cb 0.50 -1.00 0.00 0.00 0.12 0.00 0.00 29.99 29.61 2k07 n HIS 174 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25