#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cx7 n LEU 3 N 0.00 4.00 -3.20 4.31 4.77 -1.26 -3.11 117.00 122.50 2cx7 n LEU 3 Ca 0.00 1.09 -0.23 0.00 -0.03 0.00 0.00 56.01 56.83 2cx7 n LEU 3 Cb 0.00 -1.49 0.04 0.00 -2.33 0.00 0.00 43.42 39.64 2cx7 n LEU 3 CO 0.00 -0.75 0.04 0.49 -1.33 0.00 0.00 177.39 175.84 2cx7 n PHE 4 N -0.32 -2.11 -4.34 -1.77 3.01 -1.26 -5.01 117.46 105.65 2cx7 n PHE 4 Ca 0.07 0.61 -0.24 0.00 1.01 0.00 0.00 57.45 58.90 2cx7 n PHE 4 Cb 0.40 -4.34 -0.08 0.00 -0.01 0.00 0.00 39.48 35.44 2cx7 n PHE 4 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 2cx7 s THR 5 N -3.17 3.12 0.26 4.37 -4.23 -1.18 -4.86 115.64 109.95 2cx7 s THR 5 Ca 0.38 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.86 2cx7 s THR 5 Cb -0.17 -2.64 0.27 0.00 1.34 0.00 0.00 72.50 71.30 2cx7 s THR 5 CO 0.47 -0.33 1.89 -0.08 -0.54 0.00 0.00 174.62 176.03 2cx7 h GLU 6 N 2.21 1.16 -0.81 3.99 4.57 -1.90 0.02 114.58 123.82 2cx7 h GLU 6 Ca -0.44 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 57.66 2cx7 h GLU 6 Cb 1.24 -0.26 -0.04 0.00 -0.16 0.00 0.00 28.75 29.53 2cx7 h GLU 6 CO 0.59 0.77 0.43 0.00 -1.18 0.00 0.00 179.01 179.62 2cx7 h ALA 7 N 1.44 1.24 -0.07 2.92 0.00 -1.96 -1.43 119.26 121.40 2cx7 h ALA 7 Ca 0.43 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 2cx7 h ALA 7 Cb 0.13 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 2cx7 h ALA 7 CO -0.16 0.61 -0.02 2.35 0.00 0.00 0.00 179.25 182.03 2cx7 h TRP 8 N 1.13 0.16 -0.69 0.00 7.01 -1.44 -1.74 115.95 120.39 2cx7 h TRP 8 Ca 0.28 -0.03 0.11 0.00 2.11 0.00 0.00 58.89 61.36 2cx7 h TRP 8 Cb 0.04 -0.04 -0.08 0.00 -2.10 0.00 0.00 29.16 26.98 2cx7 h TRP 8 CO 0.01 0.47 0.28 0.00 -2.79 0.00 0.00 178.44 176.41 2cx7 h ALA 9 N 0.66 0.93 -0.40 2.65 0.00 -0.74 0.28 119.26 122.65 2cx7 h ALA 9 Ca 0.02 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2cx7 h ALA 9 Cb 0.42 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2cx7 h ALA 9 CO 0.01 -0.17 0.01 1.96 0.00 0.00 0.00 179.25 181.05 2cx7 h GLN 10 N 0.45 0.70 -0.13 0.00 4.20 -1.21 -1.66 115.11 117.46 2cx7 h GLN 10 Ca 0.36 -0.22 -0.07 0.00 0.06 0.00 0.00 58.65 58.78 2cx7 h GLN 10 Cb 0.48 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 2cx7 h GLN 10 CO -0.34 0.78 -0.23 0.00 -0.67 0.00 0.00 178.83 178.36 2cx7 h ALA 11 N 0.89 1.36 -0.15 3.87 0.00 -0.38 -2.32 119.26 122.53 2cx7 h ALA 11 Ca 0.11 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 2cx7 h ALA 11 Cb 0.46 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2cx7 h ALA 11 CO 0.02 0.44 -0.17 -0.92 0.00 0.00 0.00 179.25 178.62 2cx7 h TYR 12 N 0.21 0.47 -0.55 0.00 3.20 -0.26 -1.20 116.97 118.84 2cx7 h TYR 12 Ca 0.04 -0.15 0.03 0.00 3.14 0.00 0.00 58.73 61.79 2cx7 h TYR 12 Cb 0.54 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.67 2cx7 h TYR 12 CO 0.01 0.79 0.31 0.00 -1.64 0.00 0.00 178.16 177.63 2cx7 h ARG 14 N 0.61 0.60 -0.70 0.00 2.43 -1.37 -1.62 114.38 114.32 2cx7 h ARG 14 Ca 0.23 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 2cx7 h ARG 14 Cb 0.07 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.47 2cx7 h ARG 14 CO -0.12 0.48 0.40 0.87 -1.51 0.00 0.00 179.97 180.08 2cx7 h LYS 15 N 0.55 0.96 -0.50 0.20 1.79 -0.57 -1.66 116.57 117.35 2cx7 h LYS 15 Ca 0.15 -0.10 -0.10 0.00 -2.18 0.00 0.00 60.65 58.42 2cx7 h LYS 15 Cb 0.06 -0.20 -0.02 0.00 -1.58 0.00 0.00 32.23 30.50 2cx7 h LYS 15 CO -0.02 0.70 -0.11 -0.07 -1.08 0.00 0.00 179.45 178.87 2cx7 h LEU 16 N 0.97 0.91 -1.49 2.94 3.38 -0.64 -2.03 115.31 119.36 2cx7 h LEU 16 Ca 0.25 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2cx7 h LEU 16 Cb 0.01 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 2cx7 h LEU 16 CO -0.04 1.03 -0.02 0.78 0.09 0.00 0.00 178.44 180.28 2cx7 h ASN 17 N 0.82 0.00 0.14 -0.43 2.35 -0.58 -2.58 115.58 115.30 2cx7 h ASN 17 Ca 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2cx7 h ASN 17 Cb 0.64 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.01 2cx7 h ASN 17 CO 0.04 0.02 -0.31 -0.62 -1.65 0.00 0.00 177.43 174.91 2cx7 n GLU 18 N -3.13 1.02 -3.19 0.81 1.02 -0.69 -4.84 120.64 111.64 2cx7 n GLU 18 Ca 0.00 -0.70 -0.43 0.00 -0.02 0.00 0.00 57.16 56.01 2cx7 n GLU 18 Cb 0.31 -1.49 -0.07 0.00 -0.02 0.00 0.00 31.44 30.17 2cx7 n GLU 18 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2cx7 s SER 19 N -2.46 6.25 0.37 1.62 0.15 -0.81 -4.92 113.70 113.89 2cx7 s SER 19 Ca 0.23 -0.65 0.08 0.00 0.70 0.00 0.00 55.95 56.31 2cx7 s SER 19 Cb 0.19 -2.28 0.71 0.00 -1.71 0.00 0.00 66.02 62.93 2cx7 s SER 19 CO 0.52 -0.76 1.88 -0.33 1.20 0.00 0.00 173.24 175.75 2cx7 h GLU 20 N 8.88 0.29 -0.28 5.44 5.08 -1.88 -1.06 114.58 131.05 2cx7 h GLU 20 Ca -0.26 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 57.98 2cx7 h GLU 20 Cb 1.10 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 2cx7 h GLU 20 CO 0.89 0.44 0.00 0.00 -1.00 0.00 0.00 179.01 179.34 2cx7 h ALA 21 N 1.59 0.37 -0.46 3.43 0.00 -1.96 -1.22 119.26 121.01 2cx7 h ALA 21 Ca 0.05 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 2cx7 h ALA 21 Cb 0.42 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2cx7 h ALA 21 CO 0.03 0.11 -0.12 -0.92 0.00 0.00 0.00 179.25 178.34 2cx7 h TYR 22 N 0.28 1.02 -0.74 0.00 3.20 -1.86 -1.80 116.97 117.07 2cx7 h TYR 22 Ca 0.08 -0.22 0.08 0.00 3.14 0.00 0.00 58.73 61.80 2cx7 h TYR 22 Cb 0.42 -0.25 -0.06 0.00 1.54 0.00 0.00 36.73 38.38 2cx7 h TYR 22 CO 0.04 1.00 0.41 -0.09 -1.64 0.00 0.00 178.16 177.88 2cx7 h ARG 23 N 0.74 0.70 -0.03 1.82 2.43 -1.03 -0.35 114.38 118.67 2cx7 h ARG 23 Ca 0.12 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 2cx7 h ARG 23 Cb 0.68 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.07 2cx7 h ARG 23 CO 0.05 0.47 -0.03 0.87 -1.51 0.00 0.00 179.97 179.81 2cx7 h LYS 24 N 0.73 0.07 -0.59 0.20 1.57 -1.12 -2.89 116.57 114.53 2cx7 h LYS 24 Ca 0.35 -0.04 0.04 0.00 -1.87 0.00 0.00 60.65 59.13 2cx7 h LYS 24 Cb 0.28 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 2cx7 h LYS 24 CO -0.22 0.56 0.39 0.00 -0.57 0.00 0.00 179.45 179.61 2cx7 h ALA 25 N 0.51 1.73 -0.49 3.86 0.00 -0.96 -2.70 119.26 121.22 2cx7 h ALA 25 Ca 0.00 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 2cx7 h ALA 25 Cb 0.55 -0.18 -0.07 0.00 0.00 0.00 0.00 17.79 18.10 2cx7 h ALA 25 CO 0.01 0.19 0.09 0.00 0.00 0.00 0.00 179.25 179.54 2cx7 n ALA 26 N -2.47 3.89 -0.32 0.00 0.00 -0.17 -4.33 120.51 117.11 2cx7 n ALA 26 Ca 0.07 -2.41 0.22 0.00 0.00 0.00 0.00 53.44 51.32 2cx7 n ALA 26 Cb 0.17 -0.97 0.50 0.00 0.00 0.00 0.00 19.45 19.15 2cx7 n ALA 26 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2cx7 h SER 27 N 2.25 0.47 -0.26 0.00 4.64 -1.25 0.60 113.55 119.99 2cx7 h SER 27 Ca 0.13 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2cx7 h SER 27 Cb 1.88 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.98 2cx7 h SER 27 CO 0.48 0.10 0.00 0.35 -0.87 0.00 0.00 176.83 176.88 2cx7 n THR 28 N -4.64 2.01 -2.64 2.95 -2.24 -1.26 -4.29 114.28 104.17 2cx7 n THR 28 Ca 0.25 -1.73 -0.40 0.00 -2.27 0.00 0.00 64.05 59.90 2cx7 n THR 28 Cb 0.86 -0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.93 2cx7 n THR 28 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2cx7 s TRP 29 N -2.47 3.79 -0.01 4.78 -0.11 -0.41 -4.84 118.94 119.68 2cx7 s TRP 29 Ca 0.38 1.79 0.00 0.00 1.22 0.00 0.00 56.10 59.48 2cx7 s TRP 29 Cb 0.29 -3.12 0.01 0.00 -1.50 0.00 0.00 33.47 29.16 2cx7 s TRP 29 CO 0.10 -0.01 0.01 -1.21 -4.62 0.00 0.00 176.95 171.22 2cx7 s GLU 30 N -0.83 0.01 0.00 5.86 2.02 -1.26 0.31 118.70 124.81 2cx7 s GLU 30 Ca 0.45 0.07 0.00 0.00 0.02 0.00 0.00 54.97 55.50 2cx7 s GLU 30 Cb -0.27 -0.12 0.00 0.00 0.10 0.00 0.00 34.13 33.83 2cx7 s GLU 30 CO 0.34 -0.06 0.00 0.41 0.02 0.00 0.00 175.26 175.97 2cx7 n GLY 31 N 3.52 4.25 3.84 -1.39 0.00 -1.19 -5.04 105.19 109.19 2cx7 n GLY 31 Ca -0.18 -1.29 -0.32 0.00 0.00 0.00 0.00 46.02 44.22 2cx7 n GLY 31 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cx7 s SER 32 N 0.00 6.69 -0.04 1.61 1.04 -1.26 -3.67 113.70 118.07 2cx7 s SER 32 Ca 0.00 1.52 0.01 0.00 0.48 0.00 0.00 55.95 57.95 2cx7 s SER 32 Cb 0.00 -2.48 0.02 0.00 0.10 0.00 0.00 66.02 63.66 2cx7 s SER 32 CO 0.00 -0.49 -0.03 -0.22 0.98 0.00 0.00 173.24 173.48 2cx7 s LEU 33 N -3.78 1.21 -0.15 2.42 2.96 -0.19 -1.77 118.68 119.37 2cx7 s LEU 33 Ca 0.58 -0.10 -0.03 0.00 -0.22 0.00 0.00 54.13 54.36 2cx7 s LEU 33 Cb -0.10 -0.40 -0.02 0.00 0.50 0.00 0.00 46.19 46.17 2cx7 s LEU 33 CO 0.26 -0.08 -0.07 0.00 -1.32 0.00 0.00 176.35 175.15 2cx7 s ALA 34 N 1.07 2.87 -0.44 5.97 0.00 0.11 -0.28 121.76 131.06 2cx7 s ALA 34 Ca -0.09 -0.85 -0.11 0.00 0.00 0.00 0.00 51.96 50.91 2cx7 s ALA 34 Cb -0.14 -1.45 0.08 0.00 0.00 0.00 0.00 23.12 21.61 2cx7 s ALA 34 CO -0.01 0.20 0.31 -0.51 0.00 0.00 0.00 175.76 175.75 2cx7 s LEU 35 N 0.39 5.35 -0.12 0.00 1.43 -0.10 -1.15 118.68 124.49 2cx7 s LEU 35 Ca -0.06 -1.50 -0.04 0.00 -1.03 0.00 0.00 54.13 51.50 2cx7 s LEU 35 Cb -0.15 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 2cx7 s LEU 35 CO 0.04 -0.59 0.04 0.00 0.23 0.00 0.00 176.35 176.06 2cx7 s ALA 36 N 1.48 3.39 -0.21 4.21 0.00 0.18 -1.48 121.76 129.33 2cx7 s ALA 36 Ca 0.03 -0.76 -0.07 0.00 0.00 0.00 0.00 51.96 51.16 2cx7 s ALA 36 Cb -0.24 -1.67 -0.04 0.00 0.00 0.00 0.00 23.12 21.18 2cx7 s ALA 36 CO 0.03 0.47 0.07 0.08 0.00 0.00 0.00 175.76 176.41 2cx7 s VAL 37 N -0.52 4.63 0.74 0.00 1.01 0.11 -1.26 120.40 125.10 2cx7 s VAL 37 Ca 0.10 -0.08 -0.14 0.00 0.00 0.00 0.00 61.98 61.86 2cx7 s VAL 37 Cb -0.12 -3.11 0.04 0.00 0.00 0.00 0.00 36.38 33.19 2cx7 s VAL 37 CO 0.02 0.41 1.14 -0.13 0.00 0.00 0.00 175.10 176.54 2cx7 s ARG 38 N 0.84 2.26 0.17 2.72 0.52 -0.54 -2.10 118.95 122.81 2cx7 s ARG 38 Ca 0.04 1.49 -0.33 0.00 -0.52 0.00 0.00 55.73 56.40 2cx7 s ARG 38 Cb -0.14 -1.87 -0.15 0.00 0.52 0.00 0.00 34.95 33.31 2cx7 s ARG 38 CO 0.02 -1.69 1.27 -2.30 0.02 0.00 0.00 175.30 172.62 2cx7 n PRO 39 N -2.95 1.39 -3.09 3.54 -0.02 -1.26 -4.54 135.00 128.07 2cx7 n PRO 39 Ca 0.11 0.50 -0.14 0.00 -2.02 0.00 0.00 63.50 61.95 2cx7 n PRO 39 Cb 0.52 -2.07 -0.04 0.00 -0.02 0.00 0.00 33.50 31.89 2cx7 n PRO 39 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2cx7 s ASP 40 N 0.19 -0.07 0.26 2.55 -1.08 0.29 -4.89 116.67 113.93 2cx7 s ASP 40 Ca 0.74 -2.18 -0.01 0.00 -0.52 0.00 0.00 52.55 50.59 2cx7 s ASP 40 Cb -0.82 0.87 0.52 0.00 -1.46 0.00 0.00 42.92 42.03 2cx7 s ASP 40 CO 0.50 -0.13 1.79 -0.65 0.52 0.00 0.00 175.17 177.20 2cx7 h PRO 41 N 5.58 0.72 -0.01 4.34 0.11 -1.84 -1.18 132.00 139.72 2cx7 h PRO 41 Ca 0.14 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.21 2cx7 h PRO 41 Cb 1.03 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.98 2cx7 h PRO 41 CO 0.17 0.47 0.01 0.87 -0.21 0.00 0.00 178.00 179.32 2cx7 h LYS 42 N 0.74 0.00 -0.24 1.05 1.79 -1.95 -1.19 116.57 116.76 2cx7 h LYS 42 Ca 0.46 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.93 2cx7 h LYS 42 Cb 0.57 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.22 2cx7 h LYS 42 CO -0.32 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.05 2cx7 n ALA 43 N -2.37 2.46 -0.70 3.86 0.00 -0.52 -4.94 120.51 118.29 2cx7 n ALA 43 Ca -0.03 -0.80 0.00 0.00 0.00 0.00 0.00 53.44 52.61 2cx7 n ALA 43 Cb 0.10 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 18.63 2cx7 n ALA 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cx7 n GLY 44 N 1.38 0.61 2.52 0.00 0.00 -0.45 -4.98 105.19 104.27 2cx7 n GLY 44 Ca 0.17 -0.40 -0.25 0.00 0.00 0.00 0.00 46.02 45.55 2cx7 n GLY 44 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2cx7 n PHE 45 N -2.70 2.70 0.21 1.61 0.99 -0.73 -4.94 117.46 114.60 2cx7 n PHE 45 Ca 0.00 -3.97 0.17 0.00 -0.00 0.00 0.00 57.45 53.65 2cx7 n PHE 45 Cb 0.00 -0.49 0.83 0.00 -1.00 0.00 0.00 39.48 38.82 2cx7 n PHE 45 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.76 175.76 2cx7 h PRO 46 N 3.60 0.00 -0.15 -1.08 0.13 -1.83 0.11 132.00 132.78 2cx7 h PRO 46 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 2cx7 h PRO 46 Cb 0.68 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.81 2cx7 h PRO 46 CO 0.73 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.13 2cx7 n LYS 47 N -3.84 1.47 0.00 0.86 5.02 -1.26 -4.51 118.16 115.90 2cx7 n LYS 47 Ca 0.01 -1.54 0.00 0.00 -2.02 0.00 0.00 58.31 54.77 2cx7 n LYS 47 Cb 0.31 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 34.07 2cx7 n LYS 47 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2cx7 n GLY 48 N 0.64 -0.54 3.44 0.72 0.00 -0.72 -3.73 105.19 105.00 2cx7 n GLY 48 Ca 0.09 -1.72 -0.11 0.00 0.00 0.00 0.00 46.02 44.28 2cx7 n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cx7 s VAL 49 N -1.89 0.02 0.12 1.61 0.11 -0.89 -1.10 120.40 118.37 2cx7 s VAL 49 Ca 0.00 -0.31 -0.16 0.00 -2.93 0.00 0.00 61.98 58.58 2cx7 s VAL 49 Cb 0.00 -1.19 0.03 0.00 -1.53 0.00 0.00 36.38 33.70 2cx7 s VAL 49 CO 0.00 -0.09 0.39 0.00 -3.33 0.00 0.00 175.10 172.07 2cx7 s ALA 50 N -3.79 -0.89 -0.17 1.54 0.00 0.30 0.10 121.76 118.85 2cx7 s ALA 50 Ca 0.03 -0.08 0.01 0.00 0.00 0.00 0.00 51.96 51.92 2cx7 s ALA 50 Cb -0.01 0.68 0.01 0.00 0.00 0.00 0.00 23.12 23.81 2cx7 s ALA 50 CO -0.10 -0.64 -0.20 0.08 0.00 0.00 0.00 175.76 174.90 2cx7 s VAL 51 N -3.81 2.14 -0.21 0.00 1.01 -0.55 -0.21 120.40 118.77 2cx7 s VAL 51 Ca 0.03 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 61.04 2cx7 s VAL 51 Cb 0.02 -1.89 -0.02 0.00 0.00 0.00 0.00 36.38 34.50 2cx7 s VAL 51 CO -0.12 0.54 -0.01 -0.69 0.00 0.00 0.00 175.10 174.82 2cx7 s VAL 52 N 1.10 3.72 -0.20 2.92 1.01 0.15 -0.92 120.40 128.18 2cx7 s VAL 52 Ca 0.00 -0.38 -0.06 0.00 0.00 0.00 0.00 61.98 61.54 2cx7 s VAL 52 Cb -0.14 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.51 2cx7 s VAL 52 CO -0.08 0.41 0.04 -0.76 0.00 0.00 0.00 175.10 174.72 2cx7 s LEU 53 N 1.28 3.55 -0.96 3.92 1.43 0.61 -1.99 118.68 126.53 2cx7 s LEU 53 Ca 0.04 -0.07 -0.16 0.00 -1.03 0.00 0.00 54.13 52.91 2cx7 s LEU 53 Cb -0.15 -1.91 0.17 0.00 0.03 0.00 0.00 46.19 44.34 2cx7 s LEU 53 CO 0.00 0.10 1.08 -0.62 0.23 0.00 0.00 176.35 177.14 2cx7 s ASP 54 N 0.79 6.80 0.04 2.29 2.15 0.52 -1.02 116.67 128.24 2cx7 s ASP 54 Ca 0.02 -2.51 -0.12 0.00 0.43 0.00 0.00 52.55 50.37 2cx7 s ASP 54 Cb -0.14 -2.33 -0.06 0.00 -0.30 0.00 0.00 42.92 40.09 2cx7 s ASP 54 CO 0.02 -0.81 0.41 -0.76 -0.17 0.00 0.00 175.17 173.86 2cx7 s LEU 55 N 1.49 4.41 -0.30 -1.34 1.43 -1.24 -0.34 118.68 122.79 2cx7 s LEU 55 Ca 0.30 0.88 -0.06 0.00 -1.03 0.00 0.00 54.13 54.23 2cx7 s LEU 55 Cb -0.06 -2.78 0.16 0.00 0.03 0.00 0.00 46.19 43.53 2cx7 s LEU 55 CO -0.08 0.25 0.61 0.86 0.23 0.00 0.00 176.35 178.22 2cx7 s TRP 56 N -1.24 -1.44 -1.56 0.29 -0.11 -0.28 -3.15 118.94 111.45 2cx7 s TRP 56 Ca 0.28 1.99 -0.11 0.00 1.22 0.00 0.00 56.10 59.48 2cx7 s TRP 56 Cb -0.15 0.66 0.09 0.00 -1.50 0.00 0.00 33.47 32.57 2cx7 s TRP 56 CO 0.15 -0.76 0.71 0.72 -4.62 0.00 0.00 176.95 173.15 2cx7 n HIS 57 N 5.44 -1.84 0.00 5.86 8.25 0.15 -1.53 115.22 131.54 2cx7 n HIS 57 Ca -0.07 0.81 0.00 0.00 -0.26 0.00 0.00 57.72 58.20 2cx7 n HIS 57 Cb 0.50 -3.48 0.00 0.00 1.12 0.00 0.00 29.99 28.13 2cx7 n HIS 57 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cx7 n GLY 58 N -1.65 0.94 3.71 -1.41 0.00 0.07 -4.53 105.19 102.31 2cx7 n GLY 58 Ca -0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 2cx7 n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cx7 s ALA 59 N -2.25 3.39 -0.33 4.61 0.00 -0.58 -4.06 121.76 122.54 2cx7 s ALA 59 Ca 0.00 -1.73 -0.04 0.00 0.00 0.00 0.00 51.96 50.18 2cx7 s ALA 59 Cb 0.00 -0.79 0.05 0.00 0.00 0.00 0.00 23.12 22.37 2cx7 s ALA 59 CO 0.00 0.13 0.07 0.00 0.00 0.00 0.00 175.76 175.96 2cx7 n ARG 61 N 4.73 0.02 0.00 0.00 1.74 0.54 -4.90 116.66 118.79 2cx7 n ARG 61 Ca -0.12 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 56.98 2cx7 n ARG 61 Cb 0.44 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.35 2cx7 n ARG 61 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2cx7 n GLY 62 N 1.48 2.56 3.20 -0.13 0.00 -1.23 -4.97 105.19 106.11 2cx7 n GLY 62 Ca 0.07 -0.59 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 2cx7 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cx7 s ALA 63 N -2.00 0.70 -0.24 4.61 0.00 -1.26 -0.36 121.76 123.21 2cx7 s ALA 63 Ca 0.00 -1.37 -0.27 0.00 0.00 0.00 0.00 51.96 50.33 2cx7 s ALA 63 Cb 0.00 0.92 0.13 0.00 0.00 0.00 0.00 23.12 24.17 2cx7 s ALA 63 CO 0.00 -0.54 1.08 -1.59 0.00 0.00 0.00 175.76 174.71 2cx7 s LYS 64 N -4.04 0.47 -0.14 0.00 -2.85 -0.84 -4.83 119.74 107.51 2cx7 s LYS 64 Ca 0.24 0.38 -0.12 0.00 -1.00 0.00 0.00 55.97 55.47 2cx7 s LYS 64 Cb 0.06 0.23 -0.05 0.00 -2.06 0.00 0.00 37.83 36.01 2cx7 s LYS 64 CO 0.03 -0.09 0.26 0.00 0.10 0.00 0.00 175.35 175.64 2cx7 s ALA 65 N -0.26 3.67 -0.04 0.59 0.00 -1.26 -0.68 121.76 123.78 2cx7 s ALA 65 Ca 0.02 -0.49 0.04 0.00 0.00 0.00 0.00 51.96 51.53 2cx7 s ALA 65 Cb -0.03 -2.29 -0.00 0.00 0.00 0.00 0.00 23.12 20.79 2cx7 s ALA 65 CO -0.05 0.24 -0.15 0.08 0.00 0.00 0.00 175.76 175.88 2cx7 s VAL 66 N 0.01 1.23 0.13 0.00 1.01 0.70 -4.86 120.40 118.61 2cx7 s VAL 66 Ca 0.16 -0.60 -0.28 0.00 0.00 0.00 0.00 61.98 61.26 2cx7 s VAL 66 Cb -0.13 -1.07 -0.07 0.00 0.00 0.00 0.00 36.38 35.11 2cx7 s VAL 66 CO 0.04 0.36 0.87 -0.70 0.00 0.00 0.00 175.10 175.68 2cx7 s GLU 67 N 0.11 4.65 2.25 2.72 2.12 -1.26 -0.54 118.70 128.75 2cx7 s GLU 67 Ca -0.04 1.31 0.00 0.00 0.36 0.00 0.00 54.97 56.60 2cx7 s GLU 67 Cb -0.11 -3.33 0.00 0.00 0.26 0.00 0.00 34.13 30.95 2cx7 s GLU 67 CO 0.02 0.36 0.00 0.41 -0.54 0.00 0.00 175.26 175.50 2cx7 n GLY 68 N 2.02 -0.89 3.77 -1.50 0.00 -0.26 -4.88 105.19 103.44 2cx7 n GLY 68 Ca -0.01 -1.29 -0.40 0.00 0.00 0.00 0.00 46.02 44.32 2cx7 n GLY 68 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cx7 s GLU 69 N 0.00 4.36 0.06 1.61 0.41 -1.26 -4.14 118.70 119.74 2cx7 s GLU 69 Ca 0.00 2.00 0.08 0.00 -0.41 0.00 0.00 54.97 56.64 2cx7 s GLU 69 Cb 0.00 -3.01 -0.03 0.00 -1.78 0.00 0.00 34.13 29.31 2cx7 s GLU 69 CO 0.00 -0.10 -0.22 0.00 -0.49 0.00 0.00 175.26 174.45 2cx7 s ALA 70 N -1.21 1.85 -0.14 5.21 0.00 -1.26 -5.04 121.76 121.16 2cx7 s ALA 70 Ca 0.50 -1.14 -0.08 0.00 0.00 0.00 0.00 51.96 51.24 2cx7 s ALA 70 Cb -0.35 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 2cx7 s ALA 70 CO 0.46 0.41 0.15 -1.21 0.00 0.00 0.00 175.76 175.57 2cx7 s GLU 71 N -1.37 3.68 0.08 0.00 8.01 -1.26 -5.03 118.70 122.81 2cx7 s GLU 71 Ca 0.08 -0.14 -0.27 0.00 0.01 0.00 0.00 54.97 54.66 2cx7 s GLU 71 Cb -0.09 -3.26 0.08 0.00 -4.31 0.00 0.00 34.13 26.55 2cx7 s GLU 71 CO 0.02 0.63 0.95 0.00 0.01 0.00 0.00 175.26 176.88 2cx7 s ALA 72 N -0.61 -1.76 0.25 5.21 0.00 -1.26 -4.90 121.76 118.69 2cx7 s ALA 72 Ca 0.13 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.62 2cx7 s ALA 72 Cb -0.12 0.53 0.30 0.00 0.00 0.00 0.00 23.12 23.83 2cx7 s ALA 72 CO 0.03 -0.90 1.65 -0.44 0.00 0.00 0.00 175.76 176.09 2cx7 h ASP 73 N 2.00 0.54 -3.89 0.00 3.32 -1.86 -3.42 116.42 113.10 2cx7 h ASP 73 Ca -0.23 -0.22 -0.50 0.00 0.02 0.00 0.00 57.03 56.10 2cx7 h ASP 73 Cb 1.23 -0.15 -0.31 0.00 0.22 0.00 0.00 39.33 40.32 2cx7 h ASP 73 CO 0.28 0.84 -0.81 -0.36 -1.72 0.00 0.00 179.24 177.46 2cx7 s PHE 74 N -4.33 1.36 -0.10 4.55 0.40 -0.73 -4.12 117.98 115.01 2cx7 s PHE 74 Ca -0.07 -0.36 -0.00 0.00 -0.60 0.00 0.00 56.93 55.90 2cx7 s PHE 74 Cb 0.13 -0.93 0.02 0.00 0.51 0.00 0.00 43.02 42.75 2cx7 s PHE 74 CO 0.81 -0.13 -0.07 0.08 0.70 0.00 0.00 175.22 176.61 2cx7 s VAL 75 N 0.08 0.94 -0.22 -0.44 1.01 -0.78 -0.71 120.40 120.28 2cx7 s VAL 75 Ca -0.03 -0.26 -0.00 0.00 0.00 0.00 0.00 61.98 61.69 2cx7 s VAL 75 Cb -0.10 -0.96 0.02 0.00 0.00 0.00 0.00 36.38 35.35 2cx7 s VAL 75 CO 0.01 0.35 -0.12 -0.63 0.00 0.00 0.00 175.10 174.71 2cx7 s ILE 76 N 1.54 2.56 0.11 2.22 1.01 -0.30 -0.28 121.20 128.05 2cx7 s ILE 76 Ca 0.01 -0.98 0.06 0.00 0.00 0.00 0.00 60.65 59.74 2cx7 s ILE 76 Cb -0.13 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 2cx7 s ILE 76 CO -0.06 0.34 -0.05 -0.70 0.00 0.00 0.00 174.94 174.47 2cx7 s GLU 77 N 1.31 2.33 0.07 2.79 2.12 0.32 -0.65 118.70 126.99 2cx7 s GLU 77 Ca 0.02 -0.95 -0.27 0.00 0.36 0.00 0.00 54.97 54.12 2cx7 s GLU 77 Cb -0.15 -2.41 0.09 0.00 0.26 0.00 0.00 34.13 31.91 2cx7 s GLU 77 CO -0.08 0.52 0.95 0.00 -0.54 0.00 0.00 175.26 176.11 2cx7 s ALA 78 N -1.31 -1.77 0.50 6.30 0.00 -0.39 -0.32 121.76 124.78 2cx7 s ALA 78 Ca 0.24 0.57 -0.21 0.00 0.00 0.00 0.00 51.96 52.57 2cx7 s ALA 78 Cb -0.11 0.51 -0.07 0.00 0.00 0.00 0.00 23.12 23.45 2cx7 s ALA 78 CO 0.16 -0.88 1.10 -0.51 0.00 0.00 0.00 175.76 175.63 2cx7 s ASP 79 N -2.73 6.05 0.23 0.00 1.11 -1.26 -1.47 116.67 118.59 2cx7 s ASP 79 Ca 0.09 2.12 -0.07 0.00 0.18 0.00 0.00 52.55 54.87 2cx7 s ASP 79 Cb -0.01 -2.58 0.39 0.00 1.07 0.00 0.00 42.92 41.79 2cx7 s ASP 79 CO -0.03 -0.99 1.70 0.25 1.18 0.00 0.00 175.17 177.28 2cx7 h LEU 80 N 1.53 0.06 -1.00 1.23 5.85 -1.94 -1.00 115.31 120.04 2cx7 h LEU 80 Ca -0.50 0.12 0.11 0.00 0.84 0.00 0.00 57.88 58.46 2cx7 h LEU 80 Cb 1.24 0.16 -0.08 0.00 0.37 0.00 0.00 40.66 42.35 2cx7 h LEU 80 CO 0.58 0.01 0.63 0.00 -0.34 0.00 0.00 178.44 179.32 2cx7 h ALA 81 N 1.54 1.49 -0.14 1.25 0.00 -1.99 0.11 119.26 121.51 2cx7 h ALA 81 Ca 0.37 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.28 2cx7 h ALA 81 Cb 0.58 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2cx7 h ALA 81 CO -0.44 0.25 0.02 1.15 0.00 0.00 0.00 179.25 180.23 2cx7 h THR 82 N 1.01 1.22 -0.77 0.00 2.02 -1.57 -1.90 112.91 112.92 2cx7 h THR 82 Ca 0.49 -0.70 -0.00 0.00 0.77 0.00 0.00 66.41 66.97 2cx7 h THR 82 Cb 0.44 1.41 -0.04 0.00 -1.74 0.00 0.00 68.15 68.22 2cx7 h THR 82 CO -0.25 0.21 0.47 -0.50 0.37 0.00 0.00 175.52 175.81 2cx7 h TRP 83 N 0.02 1.01 -0.67 3.16 -0.00 -0.70 -0.39 115.95 118.38 2cx7 h TRP 83 Ca 0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.93 2cx7 h TRP 83 Cb 0.30 -0.33 -0.03 0.00 -0.00 0.00 0.00 29.16 29.09 2cx7 h TRP 83 CO 0.02 0.67 0.38 1.96 -0.00 0.00 0.00 178.44 181.46 2cx7 h GLN 84 N 1.06 0.92 -0.31 0.49 4.20 -0.61 0.14 115.11 121.00 2cx7 h GLN 84 Ca 0.28 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.87 2cx7 h GLN 84 Cb -0.05 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.53 2cx7 h GLN 84 CO -0.05 0.68 0.12 0.93 -0.67 0.00 0.00 178.83 179.84 2cx7 h GLU 85 N 0.91 0.47 0.17 1.46 5.08 -0.55 -2.31 114.58 119.81 2cx7 h GLU 85 Ca 0.24 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 2cx7 h GLU 85 Cb 0.02 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.19 2cx7 h GLU 85 CO -0.04 0.48 -0.08 0.28 -1.00 0.00 0.00 179.01 178.65 2cx7 h VAL 86 N 0.35 0.94 0.00 3.13 2.07 -0.75 0.78 116.25 122.77 2cx7 h VAL 86 Ca 0.10 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 67.05 2cx7 h VAL 86 Cb 0.19 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.25 2cx7 h VAL 86 CO -0.01 0.13 0.00 0.18 0.02 0.00 0.00 177.57 177.89 2cx7 n LEU 87 N -5.07 0.00 -0.21 2.57 4.77 0.46 -1.74 117.00 117.79 2cx7 n LEU 87 Ca -0.09 0.07 0.02 0.00 -0.03 0.00 0.00 56.01 55.98 2cx7 n LEU 87 Cb 0.21 -0.07 0.04 0.00 -2.33 0.00 0.00 43.42 41.28 2cx7 n LEU 87 CO 0.32 -0.03 0.46 -0.62 -1.33 0.00 0.00 177.39 176.19 2cx7 n GLU 88 N -1.07 1.66 -0.99 3.23 1.02 -0.87 -3.82 120.64 119.80 2cx7 n GLU 88 Ca 0.11 -1.34 0.00 0.00 -0.02 0.00 0.00 57.16 55.92 2cx7 n GLU 88 Cb 0.07 -1.09 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 2cx7 n GLU 88 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2cx7 n GLY 89 N 0.01 0.58 0.00 0.62 0.00 -0.71 -4.90 105.19 100.80 2cx7 n GLY 89 Ca 0.04 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.18 2cx7 n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cx7 n ARG 90 N -2.45 0.00 -3.74 1.61 1.74 0.22 -4.77 116.66 109.28 2cx7 n ARG 90 Ca 0.00 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.90 2cx7 n ARG 90 Cb 0.03 -1.50 -0.17 0.00 -1.02 0.00 0.00 32.46 29.80 2cx7 n ARG 90 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2cx7 s LEU 91 N -3.02 0.55 0.02 0.55 2.96 -1.10 -4.94 118.68 113.70 2cx7 s LEU 91 Ca 0.12 0.04 -0.30 0.00 -0.22 0.00 0.00 54.13 53.77 2cx7 s LEU 91 Cb 0.18 -0.16 -0.06 0.00 0.50 0.00 0.00 46.19 46.65 2cx7 s LEU 91 CO 0.65 -0.20 1.38 -0.70 -1.32 0.00 0.00 176.35 176.17 2cx7 s GLU 92 N 1.72 4.30 0.20 1.98 -6.30 -1.26 -4.36 118.70 114.98 2cx7 s GLU 92 Ca -0.01 1.96 -0.11 0.00 -2.50 0.00 0.00 54.97 54.32 2cx7 s GLU 92 Cb -0.12 -3.52 0.13 0.00 0.00 0.00 0.00 34.13 30.61 2cx7 s GLU 92 CO -0.03 -0.54 1.83 -1.00 0.02 0.00 0.00 175.26 175.54 2cx7 h PRO 93 N 7.64 0.96 -0.36 4.30 0.13 -1.97 -2.26 132.00 140.43 2cx7 h PRO 93 Ca -0.38 -0.10 -0.01 0.00 -0.87 0.00 0.00 66.00 64.63 2cx7 h PRO 93 Cb 1.18 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 32.10 2cx7 h PRO 93 CO 0.89 0.70 0.17 -0.07 -0.23 0.00 0.00 178.00 179.46 2cx7 h LEU 94 N 0.95 0.48 -0.90 1.56 3.38 -1.96 -0.51 115.31 118.31 2cx7 h LEU 94 Ca 0.25 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 2cx7 h LEU 94 Cb -0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2cx7 h LEU 94 CO -0.04 0.47 -0.25 0.28 0.09 0.00 0.00 178.44 178.99 2cx7 h SER 95 N 0.45 0.53 -0.62 -0.43 0.02 -1.98 -2.76 113.55 108.75 2cx7 h SER 95 Ca 0.13 -0.18 -0.06 0.00 -0.84 0.00 0.00 61.79 60.84 2cx7 h SER 95 Cb 0.12 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.49 2cx7 h SER 95 CO -0.02 0.77 0.17 0.00 -1.14 0.00 0.00 176.83 176.61 2cx7 h ALA 96 N 1.28 1.08 0.00 3.77 0.00 -0.99 -1.73 119.26 122.66 2cx7 h ALA 96 Ca 0.07 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2cx7 h ALA 96 Cb 0.68 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2cx7 h ALA 96 CO 0.05 0.62 0.00 -0.11 0.00 0.00 0.00 179.25 179.81 2cx7 n LEU 97 N -4.25 1.23 0.00 0.00 7.94 -0.23 -1.04 117.00 120.64 2cx7 n LEU 97 Ca 0.05 -0.61 0.00 0.00 -1.11 0.00 0.00 56.01 54.34 2cx7 n LEU 97 Cb 0.24 -0.22 0.00 0.00 0.53 0.00 0.00 43.42 43.96 2cx7 n LEU 97 CO 0.41 0.21 0.00 0.54 -1.11 0.00 0.00 177.39 177.44 2cx7 n ARG 99 N 0.71 0.00 -0.47 1.96 1.74 -0.65 -4.62 116.66 115.33 2cx7 n ARG 99 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2cx7 n ARG 99 Cb 0.21 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.65 2cx7 n ARG 99 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2cx7 n GLY 100 N 0.00 0.75 0.35 -0.13 0.00 -0.82 -4.92 105.19 100.41 2cx7 n GLY 100 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 2cx7 n GLY 100 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2cx7 h LEU 101 N 0.00 1.11 -8.70 0.99 3.38 -1.34 -3.29 115.31 107.46 2cx7 h LEU 101 Ca 0.00 -0.13 -0.65 0.00 0.09 0.00 0.00 57.88 57.19 2cx7 h LEU 101 Cb 0.00 -0.29 -0.21 0.00 0.09 0.00 0.00 40.66 40.25 2cx7 h LEU 101 CO 0.00 0.93 -0.59 -0.76 0.09 0.00 0.00 178.44 178.11 2cx7 s LEU 102 N -9.82 3.64 -0.25 1.67 1.43 -0.89 -4.62 118.68 109.84 2cx7 s LEU 102 Ca -0.12 -0.18 -0.10 0.00 -1.03 0.00 0.00 54.13 52.70 2cx7 s LEU 102 Cb 0.16 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 2cx7 s LEU 102 CO 0.83 -0.05 0.14 -0.70 0.23 0.00 0.00 176.35 176.80 2cx7 s GLU 103 N 1.65 3.92 -0.69 1.70 2.12 0.57 -4.26 118.70 123.71 2cx7 s GLU 103 Ca 0.06 -0.34 -0.27 0.00 0.36 0.00 0.00 54.97 54.78 2cx7 s GLU 103 Cb -0.15 -3.51 0.03 0.00 0.26 0.00 0.00 34.13 30.75 2cx7 s GLU 103 CO 0.06 -0.08 1.29 -1.17 -0.54 0.00 0.00 175.26 174.82 2cx7 s LEU 104 N 1.41 3.24 0.13 2.70 2.96 -1.26 -0.52 118.68 127.33 2cx7 s LEU 104 Ca 0.07 -0.27 0.12 0.00 -0.22 0.00 0.00 54.13 53.82 2cx7 s LEU 104 Cb -0.15 -2.71 -0.12 0.00 0.50 0.00 0.00 46.19 43.71 2cx7 s LEU 104 CO 0.07 -1.78 1.16 0.11 -1.32 0.00 0.00 176.35 174.59 2cx7 h LYS 105 N 10.16 0.00 -3.28 1.98 1.79 -1.02 -3.46 116.57 122.75 2cx7 h LYS 105 Ca -0.27 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 57.98 2cx7 h LYS 105 Cb 1.06 0.00 -0.30 0.00 -1.58 0.00 0.00 32.23 31.41 2cx7 h LYS 105 CO 1.25 0.66 -0.57 0.21 -1.08 0.00 0.00 179.45 179.93 2cx7 s LYS 106 N -2.80 0.13 0.00 3.15 2.20 -1.11 -4.93 119.74 116.39 2cx7 s LYS 106 Ca 0.00 0.33 0.00 0.00 -0.36 0.00 0.00 55.97 55.94 2cx7 s LYS 106 Cb 0.09 -0.08 0.00 0.00 -1.51 0.00 0.00 37.83 36.32 2cx7 s LYS 106 CO 0.80 -0.12 0.00 0.41 -0.36 0.00 0.00 175.35 176.08 2cx7 n GLY 107 N 3.79 2.11 3.38 5.54 0.00 -1.26 -1.87 105.19 116.89 2cx7 n GLY 107 Ca -0.22 -2.01 -0.28 0.00 0.00 0.00 0.00 46.02 43.52 2cx7 n GLY 107 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2cx7 s THR 108 N -2.38 2.20 0.24 2.61 -4.23 -1.26 -5.02 115.64 107.80 2cx7 s THR 108 Ca 0.00 -1.80 -0.07 0.00 -1.18 0.00 0.00 61.69 58.64 2cx7 s THR 108 Cb 0.00 -1.97 0.22 0.00 1.34 0.00 0.00 72.50 72.09 2cx7 s THR 108 CO 0.00 0.01 1.89 0.40 -0.54 0.00 0.00 174.62 176.38 2cx7 h ILE 109 N 3.73 1.16 -0.98 2.99 2.04 -1.97 -1.18 117.51 123.29 2cx7 h ILE 109 Ca -0.49 -0.39 0.12 0.00 1.00 0.00 0.00 64.86 65.10 2cx7 h ILE 109 Cb 1.18 -0.07 -0.09 0.00 -0.74 0.00 0.00 36.82 37.10 2cx7 h ILE 109 CO 0.41 0.21 0.61 0.00 0.00 0.00 0.00 178.15 179.38 2cx7 h ALA 110 N 1.36 1.48 0.00 1.87 0.00 -2.00 0.97 119.26 122.95 2cx7 h ALA 110 Ca 0.35 0.03 -0.17 0.00 0.00 0.00 0.00 54.91 55.12 2cx7 h ALA 110 Cb -0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2cx7 h ALA 110 CO -0.11 0.18 -0.80 0.00 0.00 0.00 0.00 179.25 178.52 2cx7 h ALA 111 N 1.54 0.60 0.01 0.00 0.00 -1.71 -3.35 119.26 116.36 2cx7 h ALA 111 Ca 0.49 -0.73 -0.30 0.00 0.00 0.00 0.00 54.91 54.37 2cx7 h ALA 111 Cb 0.51 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 2cx7 h ALA 111 CO -0.28 1.00 -1.78 -0.11 0.00 0.00 0.00 179.25 178.08 2cx7 n LEU 112 N -3.47 1.02 -0.26 0.00 7.94 -0.51 -4.45 117.00 117.28 2cx7 n LEU 112 Ca -0.00 0.37 0.06 0.00 -1.11 0.00 0.00 56.01 55.33 2cx7 n LEU 112 Cb 0.80 0.05 0.18 0.00 0.53 0.00 0.00 43.42 44.98 2cx7 n LEU 112 CO 0.44 0.44 0.84 0.00 -1.11 0.00 0.00 177.39 178.00 2cx7 h ALA 113 N 0.90 0.85 0.00 1.96 0.00 0.80 0.19 119.26 123.96 2cx7 h ALA 113 Ca -0.31 0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2cx7 h ALA 113 Cb 2.03 0.41 0.00 0.00 0.00 0.00 0.00 17.79 20.23 2cx7 h ALA 113 CO 0.08 -0.43 0.00 -1.35 0.00 0.00 0.00 179.25 177.55 2cx7 h PRO 114 N 0.12 0.00 -0.64 0.00 0.11 -1.78 -2.52 132.00 127.28 2cx7 h PRO 114 Ca 0.43 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 66.23 2cx7 h PRO 114 Cb 0.78 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 31.70 2cx7 h PRO 114 CO -0.67 0.00 0.25 0.66 -0.21 0.00 0.00 178.00 178.03 2cx7 n TYR 115 N -2.75 1.99 -0.35 0.65 4.02 0.05 -4.70 117.16 116.07 2cx7 n TYR 115 Ca -0.02 -1.65 0.07 0.00 -0.01 0.00 0.00 57.90 56.29 2cx7 n TYR 115 Cb 0.07 -0.69 0.25 0.00 -0.02 0.00 0.00 39.34 38.95 2cx7 n TYR 115 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2cx7 h ALA 116 N 1.15 1.54 -0.51 -0.72 0.00 -1.52 -1.51 119.26 117.70 2cx7 h ALA 116 Ca 0.39 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.20 2cx7 h ALA 116 Cb 2.20 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.76 2cx7 h ALA 116 CO 0.70 0.23 -0.11 0.37 0.00 0.00 0.00 179.25 180.43 2cx7 h GLN 117 N 0.99 0.95 -0.81 0.00 4.15 -1.88 -0.55 115.11 117.96 2cx7 h GLN 117 Ca 0.48 -0.34 -0.04 0.00 0.77 0.00 0.00 58.65 59.52 2cx7 h GLN 117 Cb 0.47 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 28.06 2cx7 h GLN 117 CO -0.25 1.01 0.36 0.00 -1.93 0.00 0.00 178.83 178.02 2cx7 h ALA 118 N 1.01 1.12 -0.36 3.38 0.00 -1.53 -0.15 119.26 122.73 2cx7 h ALA 118 Ca 0.13 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2cx7 h ALA 118 Cb 0.66 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2cx7 h ALA 118 CO 0.05 0.65 0.12 0.00 0.00 0.00 0.00 179.25 180.07 2cx7 h ALA 119 N 1.23 0.47 -0.87 0.00 0.00 -0.88 0.18 119.26 119.40 2cx7 h ALA 119 Ca 0.27 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.04 2cx7 h ALA 119 Cb 0.16 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 2cx7 h ALA 119 CO -0.03 0.11 0.57 1.96 0.00 0.00 0.00 179.25 181.86 2cx7 h GLN 120 N 0.44 1.12 -0.39 0.00 4.20 -0.68 -2.06 115.11 117.73 2cx7 h GLN 120 Ca 0.12 -0.07 -0.16 0.00 0.06 0.00 0.00 58.65 58.60 2cx7 h GLN 120 Cb 0.24 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 2cx7 h GLN 120 CO -0.00 0.74 -0.38 0.93 -0.67 0.00 0.00 178.83 179.45 2cx7 h GLU 121 N 1.15 0.95 -0.60 1.46 4.39 -0.62 -0.77 114.58 120.54 2cx7 h GLU 121 Ca 0.33 -0.49 0.09 0.00 0.34 0.00 0.00 59.36 59.63 2cx7 h GLU 121 Cb -0.09 0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 28.51 2cx7 h GLU 121 CO -0.09 1.15 0.22 -0.07 -1.16 0.00 0.00 179.01 179.07 2cx7 h LEU 122 N 0.77 0.22 -0.27 1.33 3.38 -0.25 0.16 115.31 120.65 2cx7 h LEU 122 Ca 0.06 0.08 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 2cx7 h LEU 122 Cb 0.97 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.77 2cx7 h LEU 122 CO 0.09 0.14 -0.25 0.58 0.09 0.00 0.00 178.44 179.09 2cx7 h VAL 123 N 0.40 1.31 -0.94 1.22 2.07 -1.26 -1.73 116.25 117.33 2cx7 h VAL 123 Ca 0.30 -1.40 -0.00 0.00 0.82 0.00 0.00 66.70 66.41 2cx7 h VAL 123 Cb 0.36 1.60 -0.05 0.00 -1.52 0.00 0.00 31.29 31.68 2cx7 h VAL 123 CO -0.30 0.45 0.58 0.11 0.02 0.00 0.00 177.57 178.42 2cx7 h LYS 124 N 0.38 1.27 -0.44 1.57 1.57 -0.53 -1.98 116.57 118.41 2cx7 h LYS 124 Ca 0.05 -0.11 -0.12 0.00 -1.87 0.00 0.00 60.65 58.60 2cx7 h LYS 124 Cb 0.80 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 2cx7 h LYS 124 CO 0.06 0.88 -0.19 0.28 -0.57 0.00 0.00 179.45 179.91 2cx7 h VAL 125 N 1.29 1.27 -0.92 0.50 2.07 -0.64 -2.98 116.25 116.84 2cx7 h VAL 125 Ca 0.34 -1.33 0.08 0.00 0.82 0.00 0.00 66.70 66.60 2cx7 h VAL 125 Cb -0.07 1.20 -0.07 0.00 -1.52 0.00 0.00 31.29 30.83 2cx7 h VAL 125 CO -0.07 0.45 0.57 0.00 0.02 0.00 0.00 177.57 178.55 2cx7 h ALA 126 N 0.84 1.30 -0.01 1.67 0.00 -0.84 -0.90 119.26 121.32 2cx7 h ALA 126 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2cx7 h ALA 126 Cb 0.75 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2cx7 h ALA 126 CO 0.06 0.28 0.01 0.00 0.00 0.00 0.00 179.25 179.59 2cx7 h ARG 127 N 1.00 0.00 -0.16 0.00 3.08 -1.22 -2.21 114.38 114.87 2cx7 h ARG 127 Ca 0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.47 2cx7 h ARG 127 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2cx7 h ARG 127 CO -0.20 0.00 0.00 0.39 -1.07 0.00 0.00 179.97 179.09 2cx7 n GLU 128 N -4.29 1.83 -2.73 0.04 -0.58 -0.35 -4.90 120.64 109.66 2cx7 n GLU 128 Ca -0.03 -1.24 -0.41 0.00 -0.42 0.00 0.00 57.16 55.06 2cx7 n GLU 128 Cb 0.09 -1.42 -0.05 0.00 -0.57 0.00 0.00 31.44 29.49 2cx7 n GLU 128 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2cx7 s VAL 129 N -1.80 4.45 -1.76 2.62 1.01 -0.83 -5.12 120.40 118.97 2cx7 s VAL 129 Ca 0.34 2.07 0.00 0.00 0.00 0.00 0.00 61.98 64.39 2cx7 s VAL 129 Cb 0.19 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 32.25 2cx7 s VAL 129 CO 0.28 0.33 0.44 0.00 0.00 0.00 0.00 175.10 176.16