#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k07 s ALA 2 N 0.00 -0.30 0.00 3.04 0.00 -1.26 -4.90 121.76 118.34 2k07 s ALA 2 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.31 2k07 s ALA 2 Cb 0.00 0.81 0.00 0.00 0.00 0.00 0.00 23.12 23.93 2k07 s ALA 2 CO 0.00 -0.67 0.00 -3.47 0.00 0.00 0.00 175.76 171.62 2k07 n ASP 3 N -0.23 -0.64 0.15 0.00 2.03 -1.26 -4.86 116.55 111.73 2k07 n ASP 3 Ca -0.09 0.00 -0.14 0.00 0.52 0.00 0.00 54.79 55.08 2k07 n ASP 3 Cb 0.63 -1.27 -0.07 0.00 -0.72 0.00 0.00 41.12 39.69 2k07 n ASP 3 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2k07 h GLU 4 N 1.45 -0.33 -0.55 -0.67 5.08 -2.00 -0.91 114.58 116.65 2k07 h GLU 4 Ca 0.00 0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.28 2k07 h GLU 4 Cb 0.07 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 2k07 h GLU 4 CO 0.00 -0.22 -0.05 0.00 -1.00 0.00 0.00 179.01 177.73 2k07 h ALA 5 N 0.43 0.75 -0.19 3.43 0.00 -2.00 -2.66 119.26 119.03 2k07 h ALA 5 Ca -0.02 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 2k07 h ALA 5 Cb 0.29 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2k07 h ALA 5 CO 0.01 0.62 -0.01 1.79 0.00 0.00 0.00 179.25 181.66 2k07 h THR 6 N 0.89 1.26 0.00 0.00 1.35 -1.93 -1.32 112.91 113.16 2k07 h THR 6 Ca 0.15 -0.90 -0.05 0.00 -0.55 0.00 0.00 66.41 65.05 2k07 h THR 6 Cb 0.61 1.49 -0.01 0.00 -1.73 0.00 0.00 68.15 68.51 2k07 h THR 6 CO 0.04 0.27 -0.25 0.08 -0.25 0.00 0.00 175.52 175.41 2k07 h ARG 7 N 0.08 0.00 -0.34 4.72 0.11 -1.18 0.27 114.38 118.04 2k07 h ARG 7 Ca 0.05 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 60.05 2k07 h ARG 7 Cb 0.41 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.48 2k07 h ARG 7 CO 0.01 0.25 -0.10 -0.09 0.10 0.00 0.00 179.97 180.14 2k07 h ARG 8 N 0.00 0.67 -0.74 0.08 2.43 -1.17 -1.77 114.38 113.88 2k07 h ARG 8 Ca -0.00 -0.27 -0.05 0.00 -0.81 0.00 0.00 59.98 58.86 2k07 h ARG 8 Cb 0.51 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.99 2k07 h ARG 8 CO 0.03 0.85 0.28 0.28 -1.51 0.00 0.00 179.97 179.90 2k07 h VAL 9 N 0.45 1.25 0.00 0.20 2.07 -0.36 -2.20 116.25 117.66 2k07 h VAL 9 Ca 0.08 -0.82 -0.03 0.00 0.82 0.00 0.00 66.70 66.75 2k07 h VAL 9 Cb 0.61 0.41 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 2k07 h VAL 9 CO 0.04 0.33 -0.15 0.58 0.02 0.00 0.00 177.57 178.39 2k07 h VAL 10 N 1.07 0.84 0.00 2.57 2.07 -0.86 -1.04 116.25 120.90 2k07 h VAL 10 Ca 0.24 -0.57 -0.06 0.00 0.82 0.00 0.00 66.70 67.13 2k07 h VAL 10 Cb 0.23 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 2k07 h VAL 10 CO -0.02 0.15 -0.30 0.28 0.02 0.00 0.00 177.57 177.69 2k07 h SER 11 N 0.00 0.00 0.23 0.57 0.02 -0.67 -2.31 113.55 111.39 2k07 h SER 11 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2k07 h SER 11 Cb 0.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.86 2k07 h SER 11 CO 0.02 0.30 -0.55 -0.62 -1.14 0.00 0.00 176.83 174.84 2k07 n GLU 12 N -3.70 0.42 -3.89 3.45 -0.58 -0.49 -4.57 120.64 111.30 2k07 n GLU 12 Ca -0.01 -0.30 -0.31 0.00 -0.42 0.00 0.00 57.16 56.13 2k07 n GLU 12 Cb 0.41 -1.49 -0.12 0.00 -0.57 0.00 0.00 31.44 29.66 2k07 n GLU 12 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2k07 s ILE 13 N -2.78 2.91 0.65 -3.67 1.01 -0.65 -4.12 121.20 114.55 2k07 s ILE 13 Ca 0.15 -3.59 -0.17 0.00 0.00 0.00 0.00 60.65 57.04 2k07 s ILE 13 Cb 0.18 -2.96 -0.07 0.00 0.01 0.00 0.00 42.46 39.62 2k07 s ILE 13 CO 0.67 -0.88 0.45 -2.65 0.00 0.00 0.00 174.94 172.53 2k07 n PRO 14 N 2.78 0.37 -2.98 2.79 -0.02 -1.25 -4.76 135.00 131.94 2k07 n PRO 14 Ca 0.10 0.16 -0.32 0.00 -2.02 0.00 0.00 63.50 61.42 2k07 n PRO 14 Cb 0.34 -1.70 -0.05 0.00 -0.02 0.00 0.00 33.50 32.07 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 -1.83 4.68 0.02 -1.45 -7.23 -1.26 -4.74 120.40 108.59 2k07 s VAL 15 Ca 0.66 0.89 -0.23 0.00 -1.81 0.00 0.00 61.98 61.50 2k07 s VAL 15 Cb -0.40 -3.66 -0.05 0.00 0.56 0.00 0.00 36.38 32.84 2k07 s VAL 15 CO 0.57 -0.34 0.68 -0.76 -0.31 0.00 0.00 175.10 174.95 2k07 s LEU 16 N -3.35 4.43 -0.17 1.32 1.02 -0.09 -4.97 118.68 116.87 2k07 s LEU 16 Ca 0.54 1.30 -0.12 0.00 0.02 0.00 0.00 54.13 55.87 2k07 s LEU 16 Cb -0.10 -3.08 -0.22 0.00 0.02 0.00 0.00 46.19 42.81 2k07 s LEU 16 CO 0.22 0.05 0.23 1.17 0.02 0.00 0.00 176.35 178.04 2k07 n LYS 17 N 2.80 0.67 0.00 1.70 4.81 -1.26 -3.79 118.16 123.10 2k07 n LYS 17 Ca -0.05 0.37 0.00 0.00 -0.87 0.00 0.00 58.31 57.76 2k07 n LYS 17 Cb 0.51 -1.70 0.00 0.00 0.02 0.00 0.00 35.03 33.86 2k07 n LYS 17 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 2k07 n THR 18 N -3.85 0.00 -4.20 3.15 -1.04 -1.26 -4.89 114.28 102.19 2k07 n THR 18 Ca -0.34 0.95 -0.34 0.00 -2.04 0.00 0.00 64.05 62.28 2k07 n THR 18 Cb 0.91 -1.81 -0.04 0.00 -1.82 0.00 0.00 70.33 67.57 2k07 n THR 18 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2k07 n ASN 19 N -1.28 -1.97 0.00 8.00 5.15 -1.26 -4.92 115.26 118.98 2k07 n ASN 19 Ca 0.00 -1.06 0.00 0.00 -0.60 0.00 0.00 54.58 52.92 2k07 n ASN 19 Cb 0.00 -2.61 0.00 0.00 -0.53 0.00 0.00 39.78 36.64 2k07 n ASN 19 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k07 n ALA 20 N -4.38 0.00 0.00 5.20 0.00 -1.26 -4.75 120.51 115.32 2k07 n ALA 20 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2k07 n ALA 20 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 2k07 n ALA 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k07 n GLY 21 N 2.72 0.81 0.04 0.00 0.00 -1.26 -4.20 105.19 103.30 2k07 n GLY 21 Ca 0.00 -1.06 0.09 0.00 0.00 0.00 0.00 46.02 45.05 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 -0.64 0.06 -0.03 1.61 -0.02 -1.26 -3.04 135.00 131.68 2k07 n PRO 22 Ca 0.00 0.28 -0.12 0.00 -2.02 0.00 0.00 63.50 61.63 2k07 n PRO 22 Cb 0.00 -1.61 -0.08 0.00 -0.02 0.00 0.00 33.50 31.80 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 0.15 -6.05 -0.52 3.08 -1.91 -3.39 114.38 105.73 2k07 h ARG 23 Ca 0.00 -0.05 -0.59 0.00 0.07 0.00 0.00 59.98 59.41 2k07 h ARG 23 Cb 0.31 -0.01 -0.11 0.00 0.08 0.00 0.00 29.97 30.24 2k07 h ARG 23 CO 0.00 0.45 0.71 -0.51 -1.07 0.00 0.00 179.97 179.55 2k07 s ASP 24 N -5.70 6.34 0.10 7.04 1.01 -1.17 -4.93 116.67 119.36 2k07 s ASP 24 Ca -0.15 -0.30 -0.24 0.00 0.71 0.00 0.00 52.55 52.57 2k07 s ASP 24 Cb 0.04 -2.48 -0.11 0.00 1.01 0.00 0.00 42.92 41.39 2k07 s ASP 24 CO 0.70 -1.36 1.69 0.03 0.21 0.00 0.00 175.17 176.44 2k07 h ARG 25 N 9.45 -0.22 0.00 8.23 3.08 -1.84 0.49 114.38 133.58 2k07 h ARG 25 Ca -0.26 0.01 -0.08 0.00 0.07 0.00 0.00 59.98 59.72 2k07 h ARG 25 Cb 1.07 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.15 2k07 h ARG 25 CO 1.14 -0.14 -0.40 1.05 -1.07 0.00 0.00 179.97 180.54 2k07 h GLU 26 N -0.22 0.00 0.02 0.04 9.09 -1.95 -2.10 114.58 119.46 2k07 h GLU 26 Ca 0.02 0.00 -0.22 0.00 0.05 0.00 0.00 59.36 59.20 2k07 h GLU 26 Cb 0.23 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.31 2k07 h GLU 26 CO -0.06 0.40 -1.07 -0.07 0.05 0.00 0.00 179.01 178.27 2k07 h LEU 27 N 0.00 0.08 -0.17 3.06 -0.00 -1.78 -2.73 115.31 113.77 2k07 h LEU 27 Ca -0.00 -0.09 -0.04 0.00 -0.00 0.00 0.00 57.88 57.75 2k07 h LEU 27 Cb 0.95 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.58 2k07 h LEU 27 CO 0.05 1.07 -0.04 -0.25 -0.00 0.00 0.00 178.44 179.27 2k07 h TRP 28 N 0.01 0.37 -0.81 1.13 2.91 0.22 0.17 115.95 119.96 2k07 h TRP 28 Ca -0.04 -0.08 -0.00 0.00 1.13 0.00 0.00 58.89 59.90 2k07 h TRP 28 Cb 1.81 -0.09 -0.04 0.00 -0.51 0.00 0.00 29.16 30.33 2k07 h TRP 28 CO 0.01 0.59 0.49 0.28 -1.03 0.00 0.00 178.44 178.78 2k07 h VAL 29 N 0.04 1.22 -0.10 2.65 2.07 -1.46 0.17 116.25 120.85 2k07 h VAL 29 Ca 0.04 -0.48 -0.13 0.00 0.82 0.00 0.00 66.70 66.95 2k07 h VAL 29 Cb 0.47 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2k07 h VAL 29 CO 0.02 0.23 -0.51 -0.61 0.02 0.00 0.00 177.57 176.72 2k07 h GLN 30 N 1.11 0.27 -0.13 1.57 4.15 -1.34 -2.73 115.11 118.00 2k07 h GLN 30 Ca 0.29 -0.15 -0.11 0.00 0.77 0.00 0.00 58.65 59.44 2k07 h GLN 30 Cb -0.05 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.64 2k07 h GLN 30 CO -0.05 0.72 -0.42 -0.09 -1.93 0.00 0.00 178.83 177.05 2k07 h ARG 31 N 0.21 0.31 -0.78 1.69 2.43 0.56 -2.05 114.38 116.74 2k07 h ARG 31 Ca 0.01 -0.15 0.04 0.00 -0.81 0.00 0.00 59.98 59.06 2k07 h ARG 31 Cb 0.97 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.47 2k07 h ARG 31 CO 0.08 0.68 0.49 -0.07 -1.51 0.00 0.00 179.97 179.64 2k07 h LEU 32 N 0.25 0.80 -0.27 3.80 3.38 -0.42 0.84 115.31 123.70 2k07 h LEU 32 Ca 0.02 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.00 2k07 h LEU 32 Cb 0.85 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 2k07 h LEU 32 CO 0.07 0.55 0.16 0.11 0.09 0.00 0.00 178.44 179.42 2k07 h LYS 33 N 0.95 0.32 -0.38 1.13 1.57 -1.19 0.68 116.57 119.65 2k07 h LYS 33 Ca 0.32 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 59.14 2k07 h LYS 33 Cb 0.04 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.22 2k07 h LYS 33 CO -0.12 0.21 0.05 0.93 -0.57 0.00 0.00 179.45 179.95 2k07 h GLU 34 N 0.33 0.16 -0.16 3.15 4.39 -0.69 0.16 114.58 121.92 2k07 h GLU 34 Ca 0.10 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.79 2k07 h GLU 34 Cb -0.01 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 2k07 h GLU 34 CO -0.04 0.11 0.08 0.93 -1.16 0.00 0.00 179.01 178.93 2k07 h GLU 35 N 0.17 0.23 -0.16 2.33 4.39 -0.57 -2.64 114.58 118.32 2k07 h GLU 35 Ca 0.18 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.79 2k07 h GLU 35 Cb 0.23 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 2k07 h GLU 35 CO -0.26 0.24 -0.17 1.88 -1.16 0.00 0.00 179.01 179.54 2k07 h TYR 36 N 0.15 0.28 -0.50 4.33 0.05 -0.43 0.41 116.97 121.26 2k07 h TYR 36 Ca 0.06 -0.04 0.02 0.00 0.05 0.00 0.00 58.73 58.82 2k07 h TYR 36 Cb 0.09 -0.08 -0.03 0.00 1.01 0.00 0.00 36.73 37.72 2k07 h TYR 36 CO -0.04 0.43 0.30 1.96 -1.05 0.00 0.00 178.16 179.76 2k07 h GLN 37 N 0.24 0.59 -0.19 4.88 1.08 -0.50 0.30 115.11 121.51 2k07 h GLN 37 Ca 0.05 -0.04 -0.10 0.00 -1.45 0.00 0.00 58.65 57.11 2k07 h GLN 37 Cb 0.45 -0.13 -0.00 0.00 -0.05 0.00 0.00 27.48 27.74 2k07 h GLN 37 CO 0.03 0.39 -0.28 0.77 -0.95 0.00 0.00 178.83 178.79 2k07 h SER 38 N 0.61 0.58 0.54 1.46 0.02 -0.99 -2.74 113.55 113.03 2k07 h SER 38 Ca 0.20 -0.52 -0.03 0.00 -0.84 0.00 0.00 61.79 60.60 2k07 h SER 38 Cb 0.00 -0.16 0.01 0.00 0.14 0.00 0.00 62.40 62.39 2k07 h SER 38 CO -0.08 0.99 -0.26 -0.07 -1.14 0.00 0.00 176.83 176.26 2k07 h LEU 39 N 0.18 -0.62 -0.41 5.07 3.38 -0.00 -1.72 115.31 121.20 2k07 h LEU 39 Ca 0.02 0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.04 2k07 h LEU 39 Cb 0.86 0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.74 2k07 h LEU 39 CO 0.07 -0.43 0.21 0.40 0.09 0.00 0.00 178.44 178.77 2k07 h ILE 40 N -0.74 0.98 -0.15 1.22 2.04 -0.50 0.21 117.51 120.58 2k07 h ILE 40 Ca -0.07 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.65 2k07 h ILE 40 Cb 0.56 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 2k07 h ILE 40 CO 0.12 0.08 0.05 -0.09 0.00 0.00 0.00 178.15 178.31 2k07 h ARG 41 N 0.43 0.12 -0.01 2.37 9.65 -1.44 0.15 114.38 125.65 2k07 h ARG 41 Ca 0.18 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 59.05 2k07 h ARG 41 Cb 0.07 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 28.62 2k07 h ARG 41 CO -0.12 0.08 0.01 -0.92 2.80 0.00 0.00 179.97 181.82 2k07 h TYR 42 N 0.13 0.02 -0.45 2.20 3.20 -0.84 -0.41 116.97 120.81 2k07 h TYR 42 Ca 0.06 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.94 2k07 h TYR 42 Cb 0.04 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.28 2k07 h TYR 42 CO -0.11 0.16 0.28 0.28 -1.64 0.00 0.00 178.16 177.14 2k07 h VAL 43 N -0.13 1.08 -0.27 1.81 2.07 -0.39 -0.42 116.25 120.00 2k07 h VAL 43 Ca 0.00 -0.20 -0.10 0.00 0.82 0.00 0.00 66.70 67.23 2k07 h VAL 43 Cb 0.15 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 2k07 h VAL 43 CO -0.00 0.10 -0.24 -0.33 0.02 0.00 0.00 177.57 177.12 2k07 h GLU 44 N 0.57 0.52 -0.99 1.57 4.39 -0.64 0.22 114.58 120.23 2k07 h GLU 44 Ca 0.17 -0.20 0.01 0.00 0.34 0.00 0.00 59.36 59.68 2k07 h GLU 44 Cb -0.03 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.54 2k07 h GLU 44 CO -0.06 0.73 0.65 -0.91 -1.16 0.00 0.00 179.01 178.26 2k07 h ASN 45 N 0.46 1.15 0.37 1.42 2.35 -0.46 -1.04 115.58 119.84 2k07 h ASN 45 Ca 0.07 -0.04 -0.14 0.00 -0.55 0.00 0.00 56.30 55.64 2k07 h ASN 45 Cb 0.67 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 2k07 h ASN 45 CO 0.05 0.84 -0.58 0.78 -1.65 0.00 0.00 177.43 176.86 2k07 h ASN 46 N 1.35 0.24 -0.66 5.81 4.21 -0.15 -1.95 115.58 124.43 2k07 h ASN 46 Ca 0.36 -0.13 0.04 0.00 1.21 0.00 0.00 56.30 57.78 2k07 h ASN 46 Cb -0.14 -0.07 -0.05 0.00 -1.12 0.00 0.00 38.32 36.94 2k07 h ASN 46 CO -0.08 0.77 0.39 0.11 -1.29 0.00 0.00 177.43 177.34 2k07 h LYS 47 N 0.16 0.73 0.00 0.81 1.79 0.12 0.18 116.57 120.36 2k07 h LYS 47 Ca -0.00 -0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.40 2k07 h LYS 47 Cb 1.07 -0.16 -0.00 0.00 -1.58 0.00 0.00 32.23 31.56 2k07 h LYS 47 CO 0.09 0.48 -0.09 -0.91 -1.08 0.00 0.00 179.45 177.94 2k07 h ASN 48 N 0.75 0.00 -0.11 0.86 2.35 -0.97 -1.92 115.58 116.54 2k07 h ASN 48 Ca 0.28 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 2k07 h ASN 48 Cb 0.10 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.47 2k07 h ASN 48 CO -0.14 0.09 0.00 0.00 -1.65 0.00 0.00 177.43 175.73 2k07 n ALA 49 N -2.14 2.53 -1.82 -0.83 0.00 -0.65 -4.92 120.51 112.69 2k07 n ALA 49 Ca 0.01 -0.55 -0.17 0.00 0.00 0.00 0.00 53.44 52.73 2k07 n ALA 49 Cb 0.40 -1.07 -0.05 0.00 0.00 0.00 0.00 19.45 18.73 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 0.47 -5.10 -3.24 0.00 2.03 -0.26 -4.91 116.55 105.53 2k07 n ASP 50 Ca 0.17 0.26 -0.26 0.00 0.52 0.00 0.00 54.79 55.49 2k07 n ASP 50 Cb 0.39 -4.15 -0.06 0.00 -0.72 0.00 0.00 41.12 36.57 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 -1.01 3.07 -4.53 1.67 5.15 0.46 -5.01 115.26 115.07 2k07 n ASN 51 Ca -0.19 -3.34 -0.43 0.00 -0.60 0.00 0.00 54.58 50.03 2k07 n ASN 51 Cb 0.60 -0.63 -0.04 0.00 -0.53 0.00 0.00 39.78 39.18 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 -2.51 6.36 0.00 1.20 2.15 -1.25 -4.61 116.67 118.01 2k07 s ASP 52 Ca 0.41 -0.29 0.00 0.00 0.43 0.00 0.00 52.55 53.11 2k07 s ASP 52 Cb 0.21 -2.44 0.00 0.00 -0.30 0.00 0.00 42.92 40.39 2k07 s ASP 52 CO -0.07 -1.19 0.83 -2.67 -0.17 0.00 0.00 175.17 171.90 2k07 n TRP 53 N 7.39 0.00 -3.50 -5.34 4.27 -1.26 -4.84 117.44 114.16 2k07 n TRP 53 Ca 0.02 -0.33 -0.13 0.00 -3.89 0.00 0.00 57.50 53.17 2k07 n TRP 53 Cb 0.48 -0.03 -0.04 0.00 -1.36 0.00 0.00 31.31 30.35 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 -0.66 -0.52 -0.04 -2.67 -0.71 -1.26 0.22 117.98 112.33 2k07 s PHE 54 Ca 0.00 0.68 -0.01 0.00 -1.04 0.00 0.00 56.93 56.56 2k07 s PHE 54 Cb 0.00 0.48 0.03 0.00 -1.21 0.00 0.00 43.02 42.32 2k07 s PHE 54 CO 0.00 -0.61 0.03 -0.98 -1.34 0.00 0.00 175.22 172.32 2k07 s ARG 55 N -2.15 0.16 -0.16 1.99 1.70 -0.78 -5.00 118.95 114.71 2k07 s ARG 55 Ca -0.04 0.21 0.01 0.00 -0.47 0.00 0.00 55.73 55.44 2k07 s ARG 55 Cb -0.01 -0.55 0.00 0.00 -0.57 0.00 0.00 34.95 33.83 2k07 s ARG 55 CO -0.01 -0.24 -0.16 -1.17 -1.08 0.00 0.00 175.30 172.64 2k07 s LEU 56 N 1.63 2.40 0.11 -1.89 2.96 -1.26 -2.32 118.68 120.30 2k07 s LEU 56 Ca -0.01 -0.51 0.05 0.00 -0.22 0.00 0.00 54.13 53.43 2k07 s LEU 56 Cb -0.13 -1.54 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 2k07 s LEU 56 CO -0.03 0.07 -0.11 -1.61 -1.32 0.00 0.00 176.35 173.34 2k07 s GLU 57 N 0.90 0.93 0.33 1.98 2.02 0.94 -4.97 118.70 120.83 2k07 s GLU 57 Ca -0.04 -1.22 -0.05 0.00 0.02 0.00 0.00 54.97 53.69 2k07 s GLU 57 Cb -0.15 -0.68 0.00 0.00 0.10 0.00 0.00 34.13 33.41 2k07 s GLU 57 CO -0.02 0.11 0.49 0.45 0.02 0.00 0.00 175.26 176.31 2k07 s SER 58 N -2.52 0.69 0.82 -0.19 0.15 -1.26 -0.57 113.70 110.80 2k07 s SER 58 Ca 0.08 -1.38 -0.08 0.00 0.70 0.00 0.00 55.95 55.27 2k07 s SER 58 Cb -0.03 0.66 0.15 0.00 -1.71 0.00 0.00 66.02 65.08 2k07 s SER 58 CO 0.01 -1.29 1.13 0.54 1.20 0.00 0.00 173.24 174.83 2k07 s ASN 59 N -3.19 3.91 0.59 5.45 2.20 -1.25 -4.93 114.94 117.71 2k07 s ASN 59 Ca 0.29 0.01 0.38 0.00 -0.94 0.00 0.00 52.86 52.59 2k07 s ASN 59 Cb -0.01 -0.29 1.75 0.00 -2.00 0.00 0.00 41.25 40.71 2k07 s ASN 59 CO 0.18 -2.18 2.12 0.11 -2.94 0.00 0.00 177.10 174.39 2k07 h LYS 60 N -0.99 0.00 0.00 3.55 1.79 -2.02 -1.24 116.57 117.65 2k07 h LYS 60 Ca -0.41 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.06 2k07 h LYS 60 Cb 1.26 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.91 2k07 h LYS 60 CO 0.42 0.00 -0.65 0.93 -1.08 0.00 0.00 179.45 179.08 2k07 h GLU 61 N 0.00 0.00 -2.16 3.15 4.39 -1.99 -3.48 114.58 114.49 2k07 h GLU 61 Ca 0.00 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.37 2k07 h GLU 61 Cb 0.33 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.94 2k07 h GLU 61 CO 0.00 0.00 -0.41 0.41 -1.16 0.00 0.00 179.01 177.85 2k07 n GLY 62 N 1.24 -0.05 0.09 -3.84 0.00 -0.47 -4.90 105.19 97.27 2k07 n GLY 62 Ca 0.02 -0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.73 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 1.12 -3.30 2.61 1.35 -1.92 -3.45 112.91 109.32 2k07 h THR 63 Ca -0.39 -2.85 -0.55 0.00 -0.55 0.00 0.00 66.41 62.07 2k07 h THR 63 Cb 1.27 2.65 -0.38 0.00 -1.73 0.00 0.00 68.15 69.96 2k07 h THR 63 CO 0.47 0.75 -0.79 -0.13 -0.25 0.00 0.00 175.52 175.57 2k07 s ARG 64 N -2.62 1.45 -0.20 4.72 0.52 -1.26 -0.95 118.95 120.60 2k07 s ARG 64 Ca -0.07 -0.47 -0.09 0.00 -0.52 0.00 0.00 55.73 54.59 2k07 s ARG 64 Cb 0.08 -1.93 -0.04 0.00 0.52 0.00 0.00 34.95 33.58 2k07 s ARG 64 CO 0.83 -0.40 0.10 -1.58 0.02 0.00 0.00 175.30 174.27 2k07 s TRP 65 N 1.65 3.29 0.09 -0.53 0.52 -0.69 -3.97 118.94 119.30 2k07 s TRP 65 Ca 0.02 0.12 0.01 0.00 0.02 0.00 0.00 56.10 56.27 2k07 s TRP 65 Cb -0.15 -2.15 -0.04 0.00 -1.15 0.00 0.00 33.47 29.98 2k07 s TRP 65 CO -0.08 0.13 -0.06 -0.59 0.02 0.00 0.00 176.95 176.37 2k07 s PHE 66 N 0.60 0.82 -1.91 -1.98 -0.71 0.26 -1.45 117.98 113.61 2k07 s PHE 66 Ca 0.05 -0.92 0.00 0.00 -1.04 0.00 0.00 56.93 55.02 2k07 s PHE 66 Cb -0.13 -0.49 0.00 0.00 -1.21 0.00 0.00 43.02 41.20 2k07 s PHE 66 CO 0.01 -0.18 0.00 0.41 -1.34 0.00 0.00 175.22 174.12 2k07 n GLY 67 N 0.06 -0.97 2.96 1.99 0.00 -0.57 -0.04 105.19 108.62 2k07 n GLY 67 Ca -0.13 -0.89 -0.12 0.00 0.00 0.00 0.00 46.02 44.88 2k07 n GLY 67 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k07 s LYS 68 N -0.77 0.10 0.16 1.61 -2.85 -0.98 -1.54 119.74 115.47 2k07 s LYS 68 Ca 0.00 0.12 0.08 0.00 -1.00 0.00 0.00 55.97 55.17 2k07 s LYS 68 Cb 0.00 0.04 -0.04 0.00 -2.06 0.00 0.00 37.83 35.77 2k07 s LYS 68 CO 0.00 -0.02 -0.06 0.00 0.10 0.00 0.00 175.35 175.38 2k07 s TRP 70 N -1.59 2.77 -0.19 0.00 0.51 0.13 -0.29 118.94 120.29 2k07 s TRP 70 Ca 0.25 -1.25 -0.00 0.00 -2.12 0.00 0.00 56.10 52.98 2k07 s TRP 70 Cb -0.10 -1.90 0.01 0.00 -0.81 0.00 0.00 33.47 30.68 2k07 s TRP 70 CO 0.16 -0.59 -0.16 -0.47 -0.51 0.00 0.00 176.95 175.38 2k07 s TYR 71 N 0.99 2.81 -0.36 -1.98 5.04 0.34 -4.63 117.35 119.56 2k07 s TYR 71 Ca -0.02 -1.44 -0.22 0.00 -2.44 0.00 0.00 57.07 52.94 2k07 s TYR 71 Cb -0.15 -1.96 0.01 0.00 0.35 0.00 0.00 41.96 40.21 2k07 s TYR 71 CO -0.04 -0.72 0.75 0.42 -1.34 0.00 0.00 175.55 174.62 2k07 s ILE 72 N 1.28 4.78 -0.22 3.14 -1.09 -1.26 -1.27 121.20 126.56 2k07 s ILE 72 Ca 0.04 0.83 -0.03 0.00 -2.23 0.00 0.00 60.65 59.26 2k07 s ILE 72 Cb -0.14 -4.17 0.11 0.00 -1.58 0.00 0.00 42.46 36.69 2k07 s ILE 72 CO -0.10 -0.39 0.30 -2.28 -1.23 0.00 0.00 174.94 171.25 2k07 s HIS 73 N 2.99 -0.56 -0.63 3.97 2.46 -0.82 -4.97 115.29 117.73 2k07 s HIS 73 Ca 0.30 0.58 -0.03 0.00 0.47 0.00 0.00 55.06 56.37 2k07 s HIS 73 Cb -0.14 -0.15 -0.03 0.00 -0.13 0.00 0.00 32.58 32.13 2k07 s HIS 73 CO 0.16 -0.65 0.56 -3.47 -2.47 0.00 0.00 174.74 168.88 2k07 n ASP 74 N 5.34 -5.29 0.00 9.88 2.03 -1.26 -3.44 116.55 123.81 2k07 n ASP 74 Ca -0.05 -0.34 0.00 0.00 0.52 0.00 0.00 54.79 54.92 2k07 n ASP 74 Cb 0.50 -3.68 0.00 0.00 -0.72 0.00 0.00 41.12 37.22 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 -2.31 0.00 -4.58 -2.67 4.77 -1.26 -4.92 117.00 106.03 2k07 n LEU 75 Ca -0.03 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.61 2k07 n LEU 75 Cb 0.56 -0.20 -0.11 0.00 -2.33 0.00 0.00 43.42 41.34 2k07 n LEU 75 CO 0.38 0.00 -0.35 -0.76 -1.33 0.00 0.00 177.39 175.33 2k07 s LEU 76 N 0.00 3.30 -0.40 2.23 1.43 -1.22 -5.08 118.68 118.95 2k07 s LEU 76 Ca 0.00 -0.01 -0.19 0.00 -1.03 0.00 0.00 54.13 52.90 2k07 s LEU 76 Cb 0.00 -1.75 0.01 0.00 0.03 0.00 0.00 46.19 44.48 2k07 s LEU 76 CO 0.00 0.30 0.55 -0.75 0.23 0.00 0.00 176.35 176.69 2k07 s LYS 77 N -0.44 3.40 -0.18 1.70 2.20 -1.26 -1.94 119.74 123.22 2k07 s LYS 77 Ca 0.07 -0.34 -0.12 0.00 -0.36 0.00 0.00 55.97 55.22 2k07 s LYS 77 Cb -0.12 -3.89 -0.05 0.00 -1.51 0.00 0.00 37.83 32.26 2k07 s LYS 77 CO 0.02 -0.82 0.22 0.71 -0.36 0.00 0.00 175.35 175.12 2k07 s TYR 78 N 2.51 3.44 -0.11 4.03 1.51 -0.40 -4.91 117.35 123.43 2k07 s TYR 78 Ca 0.19 0.48 -0.11 0.00 -1.01 0.00 0.00 57.07 56.62 2k07 s TYR 78 Cb -0.15 -2.26 -0.05 0.00 -0.11 0.00 0.00 41.96 39.39 2k07 s TYR 78 CO 0.15 0.27 0.26 -1.21 -1.11 0.00 0.00 175.55 173.91 2k07 s GLU 79 N 0.39 3.89 -0.11 -0.62 8.01 -1.26 -0.51 118.70 128.49 2k07 s GLU 79 Ca 0.13 0.08 0.01 0.00 0.01 0.00 0.00 54.97 55.20 2k07 s GLU 79 Cb -0.12 -3.29 0.02 0.00 -4.31 0.00 0.00 34.13 26.43 2k07 s GLU 79 CO 0.01 0.55 -0.13 -0.06 0.01 0.00 0.00 175.26 175.64 2k07 s PHE 80 N -0.46 1.87 -0.07 1.61 0.08 0.60 -4.94 117.98 116.68 2k07 s PHE 80 Ca 0.17 -0.91 -0.21 0.00 0.12 0.00 0.00 56.93 56.10 2k07 s PHE 80 Cb -0.13 -1.39 -0.04 0.00 -0.57 0.00 0.00 43.02 40.88 2k07 s PHE 80 CO 0.06 -0.50 0.60 0.16 -0.10 0.00 0.00 175.22 175.44 2k07 s ASP 81 N 1.17 6.89 0.08 1.36 -4.77 -1.26 -0.35 116.67 119.78 2k07 s ASP 81 Ca -0.03 1.06 0.04 0.00 -3.30 0.00 0.00 52.55 50.33 2k07 s ASP 81 Cb -0.14 -2.36 -0.03 0.00 -1.09 0.00 0.00 42.92 39.30 2k07 s ASP 81 CO -0.04 -0.02 -0.12 0.27 0.70 0.00 0.00 175.17 175.95 2k07 s ILE 82 N 0.48 1.02 0.05 2.11 -4.36 -0.59 -4.20 121.20 115.72 2k07 s ILE 82 Ca 0.32 -1.37 -0.18 0.00 -0.26 0.00 0.00 60.65 59.16 2k07 s ILE 82 Cb -0.17 -1.09 0.04 0.00 1.25 0.00 0.00 42.46 42.48 2k07 s ILE 82 CO 0.15 -0.33 0.41 -1.83 0.24 0.00 0.00 174.94 173.59 2k07 s GLU 83 N -1.99 0.94 0.01 0.37 -1.05 -0.59 -1.51 118.70 114.88 2k07 s GLU 83 Ca -0.01 -0.40 -0.27 0.00 -0.15 0.00 0.00 54.97 54.13 2k07 s GLU 83 Cb -0.08 0.42 0.07 0.00 -0.44 0.00 0.00 34.13 34.09 2k07 s GLU 83 CO 0.02 -0.33 0.63 -0.59 0.95 0.00 0.00 175.26 175.94 2k07 s PHE 84 N -2.63 -0.58 0.19 4.83 -0.71 -0.53 -0.62 117.98 117.93 2k07 s PHE 84 Ca -0.04 0.84 0.01 0.00 -1.04 0.00 0.00 56.93 56.69 2k07 s PHE 84 Cb -0.00 0.42 -0.04 0.00 -1.21 0.00 0.00 43.02 42.18 2k07 s PHE 84 CO -0.03 -0.66 0.36 0.16 -1.34 0.00 0.00 175.22 173.71 2k07 s ASP 85 N -1.63 6.36 -0.70 1.98 1.47 -1.26 -1.70 116.67 121.19 2k07 s ASP 85 Ca -0.08 0.31 -0.09 0.00 1.18 0.00 0.00 52.55 53.87 2k07 s ASP 85 Cb -0.01 -1.97 0.18 0.00 -0.34 0.00 0.00 42.92 40.79 2k07 s ASP 85 CO 0.03 -0.02 0.58 -0.63 0.68 0.00 0.00 175.17 175.81 2k07 s ILE 86 N -1.85 4.63 0.74 2.11 -1.09 -0.12 -4.60 121.20 121.02 2k07 s ILE 86 Ca 0.37 -2.64 -0.16 0.00 -2.23 0.00 0.00 60.65 56.00 2k07 s ILE 86 Cb -0.11 -3.93 -0.00 0.00 -1.58 0.00 0.00 42.46 36.84 2k07 s ILE 86 CO 0.29 -0.94 0.81 -2.65 -1.23 0.00 0.00 174.94 171.23 2k07 n PRO 87 N 3.83 0.37 0.29 2.79 -0.02 -1.26 -4.88 135.00 136.12 2k07 n PRO 87 Ca 0.09 0.18 0.15 0.00 -2.02 0.00 0.00 63.50 61.90 2k07 n PRO 87 Cb 0.42 -2.09 0.88 0.00 -0.02 0.00 0.00 33.50 32.69 2k07 n PRO 87 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2k07 h ILE 88 N -0.41 0.51 -0.31 4.25 2.04 -1.98 -1.04 117.51 120.58 2k07 h ILE 88 Ca -0.46 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.26 2k07 h ILE 88 Cb 1.33 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 38.50 2k07 h ILE 88 CO 0.45 0.03 0.00 0.35 0.00 0.00 0.00 178.15 178.98 2k07 n THR 89 N -3.76 0.70 -2.66 -0.27 -2.24 -1.26 -4.45 114.28 100.33 2k07 n THR 89 Ca -0.03 -0.50 -0.36 0.00 -2.27 0.00 0.00 64.05 60.89 2k07 n THR 89 Cb 0.12 0.01 -0.05 0.00 -2.10 0.00 0.00 70.33 68.31 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 -1.63 3.45 -1.39 4.78 5.04 -0.39 -0.07 117.35 127.13 2k07 s TYR 90 Ca 0.23 1.70 0.11 0.00 -2.44 0.00 0.00 57.07 56.66 2k07 s TYR 90 Cb 0.14 -3.02 0.42 0.00 0.35 0.00 0.00 41.96 39.85 2k07 s TYR 90 CO 0.12 -0.24 1.28 -0.35 -1.34 0.00 0.00 175.55 175.02 2k07 n PRO 91 N 0.14 2.53 -0.16 4.97 -0.04 -1.26 -4.11 135.00 137.08 2k07 n PRO 91 Ca 0.04 -1.66 -0.08 0.00 -0.04 0.00 0.00 63.50 61.76 2k07 n PRO 91 Cb 0.50 -1.59 0.01 0.00 -0.04 0.00 0.00 33.50 32.38 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 2.42 1.18 -3.77 0.52 2.02 -1.28 -3.38 112.91 110.60 2k07 h THR 92 Ca 0.00 -0.48 -0.65 0.00 0.77 0.00 0.00 66.41 66.05 2k07 h THR 92 Cb 0.91 0.63 -0.20 0.00 -1.74 0.00 0.00 68.15 67.75 2k07 h THR 92 CO 0.12 0.19 -0.56 -0.89 0.37 0.00 0.00 175.52 174.75 2k07 s THR 93 N -5.78 4.88 0.41 3.16 2.01 0.90 -4.93 115.64 116.30 2k07 s THR 93 Ca -0.13 -0.03 -0.25 0.00 0.31 0.00 0.00 61.69 61.60 2k07 s THR 93 Cb 0.11 -3.33 -0.08 0.00 0.01 0.00 0.00 72.50 69.20 2k07 s THR 93 CO 0.75 0.25 1.16 0.00 -0.69 0.00 0.00 174.62 176.10 2k07 s ALA 94 N 1.69 3.13 0.89 7.40 0.00 -1.26 -4.18 121.76 129.42 2k07 s ALA 94 Ca 0.07 0.95 -0.14 0.00 0.00 0.00 0.00 51.96 52.84 2k07 s ALA 94 Cb -0.16 -3.37 0.13 0.00 0.00 0.00 0.00 23.12 19.72 2k07 s ALA 94 CO 0.08 -0.52 1.21 -1.25 0.00 0.00 0.00 175.76 175.28 2k07 s PRO 95 N -2.36 1.31 -0.22 0.00 0.04 -1.26 -5.03 135.00 127.47 2k07 s PRO 95 Ca 0.58 -0.03 -0.06 0.00 0.04 0.00 0.00 61.00 61.53 2k07 s PRO 95 Cb -0.30 -1.89 -0.02 0.00 0.04 0.00 0.00 34.50 32.33 2k07 s PRO 95 CO 0.37 -2.02 0.03 -1.21 0.04 0.00 0.00 177.00 174.21 2k07 s GLU 96 N -5.62 3.62 -0.07 4.56 2.02 -1.26 -5.08 118.70 116.86 2k07 s GLU 96 Ca 0.66 -0.51 -0.30 0.00 0.02 0.00 0.00 54.97 54.85 2k07 s GLU 96 Cb -0.09 -3.18 -0.03 0.00 0.10 0.00 0.00 34.13 30.92 2k07 s GLU 96 CO 0.51 -0.09 1.20 0.42 0.02 0.00 0.00 175.26 177.32 2k07 s ILE 97 N 1.31 4.27 -0.16 -1.63 -1.09 -1.26 -4.48 121.20 118.17 2k07 s ILE 97 Ca 0.04 1.59 -0.04 0.00 -2.23 0.00 0.00 60.65 60.02 2k07 s ILE 97 Cb -0.15 -4.02 -0.03 0.00 -1.58 0.00 0.00 42.46 36.69 2k07 s ILE 97 CO 0.02 -0.02 -0.04 0.00 -1.23 0.00 0.00 174.94 173.66 2k07 s ALA 98 N 2.42 2.98 -0.55 9.38 0.00 0.21 -0.57 121.76 135.62 2k07 s ALA 98 Ca 0.55 -0.84 0.04 0.00 0.00 0.00 0.00 51.96 51.72 2k07 s ALA 98 Cb -0.24 -1.55 0.14 0.00 0.00 0.00 0.00 23.12 21.48 2k07 s ALA 98 CO 0.21 0.19 0.33 0.08 0.00 0.00 0.00 175.76 176.56 2k07 s VAL 99 N 0.41 2.26 0.49 0.00 1.01 0.71 -1.54 120.40 123.74 2k07 s VAL 99 Ca -0.04 -3.38 0.15 0.00 0.00 0.00 0.00 61.98 58.71 2k07 s VAL 99 Cb -0.14 -2.54 0.30 0.00 0.00 0.00 0.00 36.38 33.99 2k07 s VAL 99 CO 0.03 -0.91 2.08 -0.65 0.00 0.00 0.00 175.10 175.66 2k07 h PRO 100 N 6.18 0.17 0.00 2.72 0.11 -1.76 -1.83 132.00 137.59 2k07 h PRO 100 Ca 0.02 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.04 2k07 h PRO 100 Cb 0.86 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.92 2k07 h PRO 100 CO 0.63 0.11 -0.38 1.49 -0.21 0.00 0.00 178.00 179.64 2k07 h GLU 101 N 0.17 0.00 -0.65 1.05 4.57 -1.94 -2.56 114.58 115.23 2k07 h GLU 101 Ca 0.11 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 2k07 h GLU 101 Cb 0.22 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 2k07 h GLU 101 CO -0.02 0.38 0.00 1.28 -1.18 0.00 0.00 179.01 179.47 2k07 n LEU 102 N -3.92 4.04 -4.57 1.64 4.77 -0.70 -4.85 117.00 113.42 2k07 n LEU 102 Ca -0.02 -2.03 -0.41 0.00 -0.03 0.00 0.00 56.01 53.52 2k07 n LEU 102 Cb 0.43 -0.51 -0.04 0.00 -2.33 0.00 0.00 43.42 40.98 2k07 n LEU 102 CO 0.38 0.78 1.92 -0.67 -1.33 0.00 0.00 177.39 178.47 2k07 n ASP 103 N 1.13 2.77 0.00 -1.43 -0.08 -0.97 -0.92 116.55 117.06 2k07 n ASP 103 Ca 0.23 -0.03 0.00 0.00 -1.51 0.00 0.00 54.79 53.48 2k07 n ASP 103 Cb 0.72 -1.53 0.00 0.00 2.34 0.00 0.00 41.12 42.66 2k07 n ASP 103 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2k07 n GLY 104 N 5.94 0.88 0.05 0.27 0.00 -1.26 -4.88 105.19 106.19 2k07 n GLY 104 Ca 0.34 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.47 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 -2.00 0.37 -4.08 1.61 4.01 -0.09 -4.93 118.16 113.05 2k07 n LYS 105 Ca 0.00 0.01 -0.13 0.00 -0.51 0.00 0.00 58.31 57.68 2k07 n LYS 105 Cb 0.00 -1.63 -0.11 0.00 -0.51 0.00 0.00 35.03 32.78 2k07 n LYS 105 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 2k07 s THR 106 N -3.25 0.57 -2.19 -0.18 -1.32 -1.22 -5.02 115.64 103.03 2k07 s THR 106 Ca 0.02 -1.20 0.28 0.00 -1.21 0.00 0.00 61.69 59.58 2k07 s THR 106 Cb 0.13 -0.76 0.70 0.00 -1.51 0.00 0.00 72.50 71.06 2k07 s THR 106 CO 0.80 -0.45 1.93 0.00 -2.21 0.00 0.00 174.62 174.70 2k07 n ALA 107 N 1.26 2.62 0.63 11.08 0.00 -1.26 -3.56 120.51 131.27 2k07 n ALA 107 Ca -0.21 -0.30 0.03 0.00 0.00 0.00 0.00 53.44 52.95 2k07 n ALA 107 Cb 0.55 -1.33 0.13 0.00 0.00 0.00 0.00 19.45 18.81 2k07 n ALA 107 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2k07 n LYS 108 N -0.45 2.10 -3.59 0.00 4.76 -1.26 -4.84 118.16 114.88 2k07 n LYS 108 Ca 0.20 -1.05 -0.36 0.00 -2.87 0.00 0.00 58.31 54.23 2k07 n LYS 108 Cb 0.21 -1.57 -0.07 0.00 -1.84 0.00 0.00 35.03 31.76 2k07 n LYS 108 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 2k07 s MET 109 N -1.63 4.20 0.00 1.97 -1.94 -1.23 -0.03 119.30 120.64 2k07 s MET 109 Ca 0.19 0.03 0.00 0.00 -1.71 0.00 0.00 55.69 54.20 2k07 s MET 109 Cb 0.13 -3.41 0.00 0.00 2.01 0.00 0.00 34.83 33.56 2k07 s MET 109 CO 0.08 0.29 0.00 0.66 -0.01 0.00 0.00 175.02 176.03 2k07 n TYR 110 N 3.44 0.00 -3.11 -0.03 4.02 -0.51 -4.88 117.16 116.10 2k07 n TYR 110 Ca -0.13 0.00 -0.45 0.00 -0.01 0.00 0.00 57.90 57.31 2k07 n TYR 110 Cb 0.52 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.83 2k07 n TYR 110 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2k07 s ARG 111 N -0.70 3.83 4.49 -0.72 1.81 -1.16 -4.90 118.95 121.60 2k07 s ARG 111 Ca 0.00 -2.41 0.00 0.00 -1.72 0.00 0.00 55.73 51.60 2k07 s ARG 111 Cb 0.00 -4.76 0.00 0.00 -0.45 0.00 0.00 34.95 29.74 2k07 s ARG 111 CO 0.00 -1.55 0.00 0.41 -0.68 0.00 0.00 175.30 173.48 2k07 n GLY 112 N 4.26 0.96 0.82 -3.53 0.00 -1.26 -1.04 105.19 105.40 2k07 n GLY 112 Ca 0.24 0.38 0.08 0.00 0.00 0.00 0.00 46.02 46.72 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 1.82 3.67 -0.02 0.00 -1.26 -4.70 105.19 104.70 2k07 n GLY 113 Ca 0.00 -0.51 -0.41 0.00 0.00 0.00 0.00 46.02 45.10 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 -1.11 4.29 0.63 1.61 1.02 -0.21 -0.21 119.74 125.76 2k07 s LYS 114 Ca 0.28 0.86 -0.13 0.00 0.02 0.00 0.00 55.97 57.01 2k07 s LYS 114 Cb 0.16 -3.56 -0.03 0.00 -0.52 0.00 0.00 37.83 33.89 2k07 s LYS 114 CO 0.22 -0.25 1.04 0.96 -0.92 0.00 0.00 175.35 176.40 2k07 s ILE 115 N 1.89 4.21 -0.20 2.17 -4.36 0.26 -1.42 121.20 123.76 2k07 s ILE 115 Ca 0.35 0.84 -0.18 0.00 -0.26 0.00 0.00 60.65 61.39 2k07 s ILE 115 Cb -0.16 -3.55 -0.03 0.00 1.25 0.00 0.00 42.46 39.96 2k07 s ILE 115 CO 0.12 -0.82 0.51 0.00 0.24 0.00 0.00 174.94 174.99 2k07 s LEU 117 N 1.65 3.52 0.62 0.00 1.43 -1.26 -5.00 118.68 119.63 2k07 s LEU 117 Ca 0.23 0.90 -0.16 0.00 -1.03 0.00 0.00 54.13 54.07 2k07 s LEU 117 Cb -0.15 -3.83 -0.02 0.00 0.03 0.00 0.00 46.19 42.21 2k07 s LEU 117 CO 0.09 -0.70 1.11 0.28 0.23 0.00 0.00 176.35 177.36 2k07 s THR 118 N -2.82 3.24 0.11 5.49 -1.32 -1.26 -4.95 115.64 114.14 2k07 s THR 118 Ca 0.49 0.63 -0.21 0.00 -1.21 0.00 0.00 61.69 61.40 2k07 s THR 118 Cb -0.10 -3.17 -0.08 0.00 -1.51 0.00 0.00 72.50 67.64 2k07 s THR 118 CO 0.45 -0.30 1.73 -0.78 -2.21 0.00 0.00 174.62 173.51 2k07 h ASP 119 N 0.40 -0.04 0.18 8.08 1.82 -2.04 -2.08 116.42 122.72 2k07 h ASP 119 Ca -0.48 0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.19 2k07 h ASP 119 Cb 1.25 0.05 0.00 0.00 0.68 0.00 0.00 39.33 41.31 2k07 h ASP 119 CO 0.55 -0.00 0.00 1.57 -1.61 0.00 0.00 179.24 179.75 2k07 n HIS 120 N -5.12 0.00 -0.05 0.28 -0.00 -1.26 -3.00 115.22 106.07 2k07 n HIS 120 Ca -0.04 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.02 2k07 n HIS 120 Cb 0.08 -0.20 -0.06 0.00 -0.12 0.00 0.00 29.99 29.68 2k07 n HIS 120 CO 0.00 0.00 0.00 0.35 0.46 0.00 0.00 176.34 177.15 2k07 h PHE 121 N 0.00 0.31 0.18 1.57 3.57 -1.74 -1.80 116.94 119.02 2k07 h PHE 121 Ca 0.00 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.44 2k07 h PHE 121 Cb 0.09 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 38.75 2k07 h PHE 121 CO 0.00 0.50 -0.10 0.87 -2.23 0.00 0.00 178.31 177.35 2k07 h LYS 122 N 0.03 -0.26 -0.89 1.11 1.79 -1.70 0.36 116.57 117.01 2k07 h LYS 122 Ca 0.05 0.02 0.08 0.00 -2.18 0.00 0.00 60.65 58.61 2k07 h LYS 122 Cb 0.37 0.06 -0.07 0.00 -1.58 0.00 0.00 32.23 31.01 2k07 h LYS 122 CO 0.01 -0.17 0.55 -1.35 -1.08 0.00 0.00 179.45 177.41 2k07 h PRO 123 N -0.26 0.94 -0.45 3.15 0.11 -1.75 -1.75 132.00 131.99 2k07 h PRO 123 Ca -0.02 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 65.93 2k07 h PRO 123 Cb 0.21 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.10 2k07 h PRO 123 CO 0.03 0.62 -0.15 1.25 -0.21 0.00 0.00 178.00 179.54 2k07 h LEU 124 N 0.97 0.85 0.68 2.35 5.85 -0.86 -0.45 115.31 124.69 2k07 h LEU 124 Ca 0.40 -0.28 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 2k07 h LEU 124 Cb 0.25 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.05 2k07 h LEU 124 CO -0.20 1.00 -0.37 -0.25 -0.34 0.00 0.00 178.44 178.28 2k07 h TRP 125 N 0.75 -0.97 0.00 1.25 2.91 0.22 -2.46 115.95 117.65 2k07 h TRP 125 Ca 0.12 -0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.11 2k07 h TRP 125 Cb 0.67 0.34 -0.00 0.00 -0.51 0.00 0.00 29.16 29.65 2k07 h TRP 125 CO 0.04 -0.58 -0.06 0.00 -1.03 0.00 0.00 178.44 176.81 2k07 h ALA 126 N -0.69 1.07 0.00 2.65 0.00 -1.29 -0.15 119.26 120.85 2k07 h ALA 126 Ca -0.09 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 2k07 h ALA 126 Cb 0.77 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2k07 h ALA 126 CO 0.12 0.08 -0.54 -0.09 0.00 0.00 0.00 179.25 178.82 2k07 h ARG 127 N 0.00 0.00 0.02 0.00 2.43 -0.76 -3.31 114.38 112.75 2k07 h ARG 127 Ca -0.00 0.00 -0.39 0.00 -0.81 0.00 0.00 59.98 58.78 2k07 h ARG 127 Cb 0.41 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.90 2k07 h ARG 127 CO 0.01 0.54 -2.41 0.09 -1.51 0.00 0.00 179.97 176.69 2k07 n ASN 128 N -3.80 1.93 -4.72 -3.80 3.02 -0.76 -4.96 115.26 102.17 2k07 n ASN 128 Ca -0.01 -0.08 -0.41 0.00 -0.03 0.00 0.00 54.58 54.05 2k07 n ASN 128 Cb 0.56 -0.42 0.02 0.00 -0.61 0.00 0.00 39.78 39.33 2k07 n ASN 128 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2k07 n VAL 129 N -3.27 2.68 -0.29 2.41 0.31 -0.14 -4.42 118.33 115.60 2k07 n VAL 129 Ca -0.43 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.40 2k07 n VAL 129 Cb 1.00 -1.63 0.00 0.00 -0.91 0.00 0.00 33.84 32.31 2k07 n VAL 129 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2k07 n PRO 130 N -0.07 0.67 0.00 5.55 -0.02 -1.26 -4.89 135.00 134.98 2k07 n PRO 130 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 2k07 n PRO 130 Cb 0.40 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.88 2k07 n PRO 130 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2k07 n LYS 131 N -0.32 0.00 -1.83 -0.52 5.02 -1.25 -4.96 118.16 114.29 2k07 n LYS 131 Ca 0.00 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.98 2k07 n LYS 131 Cb 0.00 -1.97 0.02 0.00 -0.02 0.00 0.00 35.03 33.06 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 -0.88 3.29 0.38 2.13 5.36 -1.26 -0.92 117.98 126.09 2k07 s PHE 132 Ca 0.00 1.40 -0.14 0.00 -0.96 0.00 0.00 56.93 57.23 2k07 s PHE 132 Cb 0.00 -2.84 0.06 0.00 -0.34 0.00 0.00 43.02 39.90 2k07 s PHE 132 CO 0.00 -0.94 0.76 0.41 -1.46 0.00 0.00 175.22 173.98 2k07 n GLY 133 N -2.02 1.05 0.30 13.12 0.00 -1.26 -4.75 105.19 111.63 2k07 n GLY 133 Ca 0.07 -1.26 -0.04 0.00 0.00 0.00 0.00 46.02 44.79 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 0.82 -0.95 0.99 5.85 -1.97 -0.84 115.31 119.21 2k07 h LEU 134 Ca -0.32 -0.17 0.08 0.00 0.84 0.00 0.00 57.88 58.30 2k07 h LEU 134 Cb 1.20 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 41.94 2k07 h LEU 134 CO 0.41 0.83 0.60 0.00 -0.34 0.00 0.00 178.44 179.94 2k07 h ALA 135 N 1.27 1.34 -0.16 1.25 0.00 -1.96 0.29 119.26 121.30 2k07 h ALA 135 Ca 0.17 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 2k07 h ALA 135 Cb 0.36 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2k07 h ALA 135 CO 0.01 0.34 -0.56 0.45 0.00 0.00 0.00 179.25 179.48 2k07 h HIS 136 N 1.06 0.60 -0.44 0.00 3.86 -1.72 -2.85 115.15 115.66 2k07 h HIS 136 Ca 0.43 -0.21 -0.09 0.00 -1.16 0.00 0.00 60.37 59.33 2k07 h HIS 136 Cb 0.24 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.58 2k07 h HIS 136 CO -0.01 0.93 -0.08 1.25 0.86 0.00 0.00 177.93 180.87 2k07 h LEU 137 N 0.36 0.76 -0.16 2.43 5.85 0.21 0.81 115.31 125.58 2k07 h LEU 137 Ca 0.00 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 2k07 h LEU 137 Cb 1.09 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 2k07 h LEU 137 CO 0.10 0.88 0.08 0.24 -0.34 0.00 0.00 178.44 179.39 2k07 h MET 138 N 0.71 0.23 -0.03 1.25 2.86 -0.37 0.10 114.93 119.68 2k07 h MET 138 Ca 0.13 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.72 2k07 h MET 138 Cb 0.55 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.16 2k07 h MET 138 CO 0.03 0.26 -0.04 0.00 1.06 0.00 0.00 176.91 178.22 2k07 h ALA 139 N 0.95 0.04 -0.58 6.32 0.00 -1.34 -2.76 119.26 121.90 2k07 h ALA 139 Ca 0.05 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2k07 h ALA 139 Cb 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2k07 h ALA 139 CO -0.01 -0.15 0.00 1.28 0.00 0.00 0.00 179.25 180.37 2k07 n LEU 140 N -4.76 3.11 0.02 0.00 4.77 0.26 -3.79 117.00 116.61 2k07 n LEU 140 Ca -0.08 -1.55 0.00 0.00 -0.03 0.00 0.00 56.01 54.34 2k07 n LEU 140 Cb 0.30 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 2k07 n LEU 140 CO 0.35 0.77 0.00 0.61 -1.33 0.00 0.00 177.39 177.79 2k07 n GLY 141 N 1.40 0.00 0.25 -0.72 0.00 0.35 -4.77 105.19 101.69 2k07 n GLY 141 Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.12 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 0.80 0.30 0.99 5.85 -1.41 -2.77 115.31 119.08 2k07 h LEU 142 Ca 0.00 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.43 2k07 h LEU 142 Cb 0.00 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 2k07 h LEU 142 CO 0.00 0.89 -0.45 1.23 -0.34 0.00 0.00 178.44 179.77 2k07 h GLY 143 N 0.69 -1.19 1.22 3.75 0.00 -1.62 -0.93 103.07 104.99 2k07 h GLY 143 Ca 0.14 0.59 0.02 0.00 0.00 0.00 0.00 47.33 48.07 2k07 h GLY 143 CO 0.02 -0.33 0.50 -0.56 0.00 0.00 0.00 176.54 176.16 2k07 h PRO 144 N -0.79 0.96 -0.52 4.80 0.13 -1.75 -2.66 132.00 132.18 2k07 h PRO 144 Ca -0.04 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 65.03 2k07 h PRO 144 Cb 0.72 -0.22 -0.02 0.00 0.13 0.00 0.00 31.00 31.61 2k07 h PRO 144 CO -0.13 0.64 0.29 2.35 -0.23 0.00 0.00 178.00 180.91 2k07 h TRP 145 N 0.99 0.70 -0.66 1.56 7.01 -1.21 -2.25 115.95 122.10 2k07 h TRP 145 Ca 0.29 -0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.30 2k07 h TRP 145 Cb -0.06 -0.23 -0.04 0.00 -2.10 0.00 0.00 29.16 26.74 2k07 h TRP 145 CO -0.00 0.51 0.44 -0.07 -2.79 0.00 0.00 178.44 176.53 2k07 h LEU 146 N 0.69 0.69 -0.59 0.65 3.38 -0.83 -1.49 115.31 117.82 2k07 h LEU 146 Ca 0.18 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2k07 h LEU 146 Cb 0.04 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.62 2k07 h LEU 146 CO -0.03 0.48 0.00 0.00 0.09 0.00 0.00 178.44 178.98 2k07 h ALA 147 N 1.61 1.00 0.00 1.53 0.00 -1.21 -2.09 119.26 120.11 2k07 h ALA 147 Ca 0.26 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.99 2k07 h ALA 147 Cb 0.04 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2k07 h ALA 147 CO -0.07 0.00 -1.26 0.28 0.00 0.00 0.00 179.25 178.19 2k07 n VAL 148 N -2.40 1.50 -0.04 0.00 0.31 -0.60 -4.68 118.33 112.42 2k07 n VAL 148 Ca 0.03 -0.01 -0.22 0.00 -0.01 0.00 0.00 64.34 64.14 2k07 n VAL 148 Cb 0.30 -2.15 -0.13 0.00 -0.91 0.00 0.00 33.84 30.96 2k07 n VAL 148 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2k07 n GLU 149 N -4.45 0.69 0.03 5.55 4.07 -0.94 -4.52 120.64 121.07 2k07 n GLU 149 Ca -0.27 0.36 -0.11 0.00 -0.06 0.00 0.00 57.16 57.07 2k07 n GLU 149 Cb 0.59 -1.71 -0.06 0.00 -0.06 0.00 0.00 31.44 30.19 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 -0.31 0.98 -0.44 6.31 1.08 -1.57 0.27 117.51 123.82 2k07 h ILE 150 Ca -0.41 -0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.16 2k07 h ILE 150 Cb 1.78 0.97 -0.02 0.00 -3.07 0.00 0.00 36.82 36.48 2k07 h ILE 150 CO -0.03 0.00 0.31 -0.65 -0.69 0.00 0.00 178.15 177.10 2k07 h PRO 151 N 0.01 0.09 0.13 2.37 0.11 -1.81 0.12 132.00 133.02 2k07 h PRO 151 Ca 0.01 -0.01 -0.34 0.00 0.11 0.00 0.00 66.00 65.78 2k07 h PRO 151 Cb 0.02 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 2k07 h PRO 151 CO -0.03 0.06 -1.78 0.22 -0.21 0.00 0.00 178.00 176.27 2k07 h ASP 152 N 0.09 0.43 -0.74 -2.05 3.58 -1.68 -3.23 116.42 112.82 2k07 h ASP 152 Ca 0.21 -0.75 0.02 0.00 0.42 0.00 0.00 57.03 56.93 2k07 h ASP 152 Cb 0.72 -0.14 -0.04 0.00 1.72 0.00 0.00 39.33 41.58 2k07 h ASP 152 CO -0.02 1.65 0.48 0.25 -2.88 0.00 0.00 179.24 178.72 2k07 h LEU 153 N 0.08 0.81 -0.76 2.28 7.12 0.68 0.54 115.31 126.05 2k07 h LEU 153 Ca -0.34 -0.01 -0.07 0.00 0.13 0.00 0.00 57.88 57.59 2k07 h LEU 153 Cb 2.05 -0.19 -0.03 0.00 -0.53 0.00 0.00 40.66 41.96 2k07 h LEU 153 CO 0.13 0.57 0.17 0.40 -0.13 0.00 0.00 178.44 179.59 2k07 h ILE 154 N 0.95 1.26 0.00 4.05 2.04 -0.96 -2.55 117.51 122.30 2k07 h ILE 154 Ca 0.29 -0.96 -0.05 0.00 1.00 0.00 0.00 64.86 65.14 2k07 h ILE 154 Cb -0.04 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 2k07 h ILE 154 CO -0.09 0.37 -0.22 -0.61 0.00 0.00 0.00 178.15 177.60 2k07 h GLN 155 N 1.06 0.00 0.00 2.37 4.15 -1.27 -0.78 115.11 120.64 2k07 h GLN 155 Ca 0.22 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.63 2k07 h GLN 155 Cb 0.36 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.05 2k07 h GLN 155 CO 0.00 0.22 -0.04 0.87 -1.93 0.00 0.00 178.83 177.95 2k07 h LYS 156 N 0.00 0.00 -0.23 1.69 1.57 -0.50 -3.46 116.57 115.64 2k07 h LYS 156 Ca -0.00 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 2k07 h LYS 156 Cb 0.48 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.75 2k07 h LYS 156 CO 0.03 0.04 -0.09 0.41 -0.57 0.00 0.00 179.45 179.27 2k07 n GLY 157 N -0.72 0.74 0.23 3.86 0.00 -0.30 -4.87 105.19 104.12 2k07 n GLY 157 Ca -0.02 -0.45 0.12 0.00 0.00 0.00 0.00 46.02 45.67 2k07 n GLY 157 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2k07 n VAL 158 N -2.73 0.00 -3.13 1.61 0.24 -1.26 -4.69 118.33 108.38 2k07 n VAL 158 Ca -0.05 -0.12 -0.44 0.00 -2.04 0.00 0.00 64.34 61.69 2k07 n VAL 158 Cb 0.23 0.55 -0.05 0.00 -1.47 0.00 0.00 33.84 33.10 2k07 n VAL 158 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2k07 s ILE 159 N -2.62 4.84 -0.14 1.34 1.01 -1.26 -5.03 121.20 119.34 2k07 s ILE 159 Ca 0.20 -0.87 -0.29 0.00 0.00 0.00 0.00 60.65 59.68 2k07 s ILE 159 Cb 0.19 -4.44 -0.01 0.00 0.01 0.00 0.00 42.46 38.21 2k07 s ILE 159 CO 0.58 -1.04 1.06 -1.58 0.00 0.00 0.00 174.94 173.96 2k07 s GLN 160 N 2.65 4.35 -0.00 2.79 2.00 -1.26 -5.02 119.66 125.17 2k07 s GLN 160 Ca 0.12 1.43 -0.04 0.00 -2.00 0.00 0.00 55.36 54.88 2k07 s GLN 160 Cb -0.23 -3.59 -0.00 0.00 0.80 0.00 0.00 33.01 29.99 2k07 s GLN 160 CO 0.08 -0.46 0.07 -1.58 -0.50 0.00 0.00 175.29 172.90 2k07 s HIS 161 N 2.51 0.08 0.95 1.67 5.65 -1.26 -5.15 115.29 119.74 2k07 s HIS 161 Ca 0.48 -0.17 -0.12 0.00 0.25 0.00 0.00 55.06 55.50 2k07 s HIS 161 Cb -0.18 -0.08 0.16 0.00 -1.18 0.00 0.00 32.58 31.31 2k07 s HIS 161 CO 0.14 -0.19 1.09 0.15 -0.65 0.00 0.00 174.74 175.28 2k07 s LYS 162 N -1.05 0.79 0.00 2.88 3.01 -1.26 -5.07 119.74 119.03 2k07 s LYS 162 Ca -0.11 0.65 0.00 0.00 -1.01 0.00 0.00 55.97 55.50 2k07 s LYS 162 Cb -0.07 -1.77 0.00 0.00 -1.01 0.00 0.00 37.83 34.99 2k07 s LYS 162 CO 0.00 -2.52 0.00 -0.85 0.51 0.00 0.00 175.35 172.49 2k07 n GLU 163 N -4.05 0.60 0.20 1.68 -0.00 -1.26 -5.03 120.64 112.78 2k07 n GLU 163 Ca 0.06 0.00 0.13 0.00 -0.00 0.00 0.00 57.16 57.35 2k07 n GLU 163 Cb 0.56 0.00 0.27 0.00 -0.00 0.00 0.00 31.44 32.28 2k07 n GLU 163 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 2k07 h LYS 164 N 0.00 0.00 -0.10 3.44 1.79 -1.99 -3.24 116.57 116.48 2k07 h LYS 164 Ca 0.00 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.33 2k07 h LYS 164 Cb 0.00 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 2k07 h LYS 164 CO 0.00 0.00 -0.54 0.00 -1.08 0.00 0.00 179.45 177.83 2k07 n ASN 166 N -3.93 3.40 -4.75 0.00 6.94 -1.22 -4.95 115.26 110.75 2k07 n ASN 166 Ca -0.02 -2.45 -0.38 0.00 -0.02 0.00 0.00 54.58 51.72 2k07 n ASN 166 Cb 0.58 -0.56 0.03 0.00 -2.36 0.00 0.00 39.78 37.46 2k07 n ASN 166 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2k07 s GLN 167 N -1.90 3.18 -0.10 -3.83 1.03 -1.06 -5.02 119.66 111.97 2k07 s GLN 167 Ca 0.29 2.09 0.00 0.00 0.04 0.00 0.00 55.36 57.78 2k07 s GLN 167 Cb 0.21 -2.21 0.02 0.00 0.03 0.00 0.00 33.01 31.07 2k07 s GLN 167 CO 0.10 -1.11 -0.07 -1.17 -2.54 0.00 0.00 175.29 170.49 2k07 s LEU 168 N -3.57 1.21 -0.84 2.60 2.96 -1.26 -5.08 118.68 114.71 2k07 s LEU 168 Ca 0.72 -0.27 -0.25 0.00 -0.22 0.00 0.00 54.13 54.11 2k07 s LEU 168 Cb -0.37 -0.77 0.02 0.00 0.50 0.00 0.00 46.19 45.57 2k07 s LEU 168 CO 0.43 -0.10 1.52 -1.61 -1.32 0.00 0.00 176.35 175.28 2k07 s GLU 169 N 1.50 3.15 -1.37 1.98 2.02 -1.26 -4.90 118.70 119.82 2k07 s GLU 169 Ca 0.01 -0.42 -0.09 0.00 0.02 0.00 0.00 54.97 54.49 2k07 s GLU 169 Cb -0.13 -4.74 0.09 0.00 0.10 0.00 0.00 34.13 29.45 2k07 s GLU 169 CO -0.05 -2.44 2.26 -2.39 0.02 0.00 0.00 175.26 172.66 2k07 n HIS 170 N 10.39 2.83 -3.56 1.61 1.44 -1.26 -4.71 115.22 121.97 2k07 n HIS 170 Ca 0.21 -2.87 -0.29 0.00 -2.01 0.00 0.00 57.72 52.76 2k07 n HIS 170 Cb 0.50 -2.09 -0.13 0.00 0.12 0.00 0.00 29.99 28.39 2k07 n HIS 170 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 2k07 s HIS 171 N 0.59 1.06 -0.08 -1.40 5.04 -1.26 -5.00 115.29 114.24 2k07 s HIS 171 Ca 0.50 -1.74 -0.09 0.00 -1.54 0.00 0.00 55.06 52.20 2k07 s HIS 171 Cb 0.14 -1.22 -0.29 0.00 0.04 0.00 0.00 32.58 31.26 2k07 s HIS 171 CO -0.05 -0.82 0.52 1.25 -2.34 0.00 0.00 174.74 173.30 2k07 h HIS 172 N 7.21 0.60 -2.71 3.88 2.76 -2.04 -3.48 115.15 121.38 2k07 h HIS 172 Ca -0.01 -0.44 -0.10 0.00 -2.20 0.00 0.00 60.37 57.62 2k07 h HIS 172 Cb 0.97 -0.02 -0.21 0.00 1.55 0.00 0.00 27.41 29.70 2k07 h HIS 172 CO 0.43 1.73 -0.15 -1.01 -1.30 0.00 0.00 177.93 177.62 2k07 s HIS 173 N -2.57 -0.36 -0.01 5.26 3.76 -1.26 -5.03 115.29 115.07 2k07 s HIS 173 Ca -0.19 0.68 -0.09 0.00 -0.15 0.00 0.00 55.06 55.30 2k07 s HIS 173 Cb 0.06 0.18 -0.31 0.00 1.11 0.00 0.00 32.58 33.63 2k07 s HIS 173 CO 0.81 -0.40 0.81 1.25 -0.85 0.00 0.00 174.74 176.36 2k07 h HIS 174 N 4.03 0.68 0.00 1.40 2.76 -2.04 -3.55 115.15 118.43 2k07 h HIS 174 Ca -0.28 -0.50 0.00 0.00 -2.20 0.00 0.00 60.37 57.39 2k07 h HIS 174 Cb 1.17 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 30.10 2k07 h HIS 174 CO 0.46 1.55 0.00 0.72 -1.30 0.00 0.00 177.93 179.36