#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1if7 n HIS 4 N 0.00 -4.83 -1.25 1.57 -0.00 -1.26 -4.95 115.22 104.50 1if7 n HIS 4 Ca 0.00 2.57 -0.30 0.00 -0.00 0.00 0.00 57.72 59.99 1if7 n HIS 4 Cb 0.00 -3.76 0.11 0.00 -0.00 0.00 0.00 29.99 26.34 1if7 n HIS 4 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.34 178.01 1if7 s TRP 5 N -3.44 2.46 0.00 1.57 1.48 -1.26 -4.91 118.94 114.85 1if7 s TRP 5 Ca 0.00 1.38 0.00 0.00 -1.06 0.00 0.00 56.10 56.42 1if7 s TRP 5 Cb 0.00 -3.11 0.00 0.00 -1.16 0.00 0.00 33.47 29.20 1if7 s TRP 5 CO 0.00 -2.09 0.00 0.41 -4.06 0.00 0.00 176.95 171.21 1if7 n GLY 6 N -1.22 2.04 0.17 3.67 0.00 -0.33 -5.03 105.19 104.49 1if7 n GLY 6 Ca 0.08 -0.57 0.07 0.00 0.00 0.00 0.00 46.02 45.60 1if7 n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1if7 n TYR 7 N 0.00 0.00 -2.57 1.61 4.01 -1.26 -3.82 117.16 115.13 1if7 n TYR 7 Ca 0.00 -0.71 -0.24 0.00 -0.16 0.00 0.00 57.90 56.79 1if7 n TYR 7 Cb 0.00 -0.12 0.11 0.00 -0.31 0.00 0.00 39.34 39.03 1if7 n TYR 7 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1if7 s GLY 8 N -2.26 1.76 0.22 2.72 0.00 -1.26 -4.72 107.32 103.77 1if7 s GLY 8 Ca 0.22 -1.75 -0.08 0.00 0.00 0.00 0.00 44.72 43.11 1if7 s GLY 8 CO 0.02 -1.16 1.81 1.70 0.00 0.00 0.00 173.10 175.47 1if7 h LYS 9 N -0.59 0.68 -0.01 2.90 3.11 -1.98 0.61 116.57 121.29 1if7 h LYS 9 Ca -0.36 -0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.44 1if7 h LYS 9 Cb 1.26 -0.15 0.00 0.00 -1.00 0.00 0.00 32.23 32.34 1if7 h LYS 9 CO 0.39 0.45 -0.22 0.72 -2.81 0.00 0.00 179.45 177.98 1if7 n HIS 10 N -4.79 0.00 -1.95 1.91 8.25 -1.26 -4.30 115.22 113.07 1if7 n HIS 10 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 1if7 n HIS 10 Cb 0.20 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.23 1if7 n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1if7 n ASN 11 N -0.36 0.00 -3.34 0.41 6.94 -1.13 -4.88 115.26 112.89 1if7 n ASN 11 Ca 0.13 -1.70 -0.22 0.00 -0.02 0.00 0.00 54.58 52.78 1if7 n ASN 11 Cb 0.37 -0.14 0.17 0.00 -2.36 0.00 0.00 39.78 37.82 1if7 n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1if7 n GLY 12 N 0.00 -2.04 0.36 4.83 0.00 0.19 -1.19 105.19 107.35 1if7 n GLY 12 Ca 0.00 -1.59 0.28 0.00 0.00 0.00 0.00 46.02 44.71 1if7 n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1if7 h PRO 13 N 0.00 0.20 0.00 1.61 0.11 -1.86 0.21 132.00 132.27 1if7 h PRO 13 Ca -0.31 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1if7 h PRO 13 Cb 0.90 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1if7 h PRO 13 CO 0.21 0.13 0.00 -0.85 -0.21 0.00 0.00 178.00 177.28 1if7 n GLU 14 N -4.99 0.13 -0.01 1.05 0.00 -1.26 -2.58 120.64 112.98 1if7 n GLU 14 Ca 0.34 0.38 0.09 0.00 0.00 0.00 0.00 57.16 57.97 1if7 n GLU 14 Cb 1.14 -1.75 -0.13 0.00 0.00 0.00 0.00 31.44 30.71 1if7 n GLU 14 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1if7 n HIS 15 N -1.98 0.00 -0.29 -1.84 8.25 0.71 -4.62 115.22 115.45 1if7 n HIS 15 Ca 0.02 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.64 1if7 n HIS 15 Cb 0.20 -0.27 0.42 0.00 1.12 0.00 0.00 29.99 31.46 1if7 n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 1if7 h TRP 16 N 0.00 0.78 -0.32 4.41 6.55 -1.34 -1.99 115.95 124.04 1if7 h TRP 16 Ca 0.00 0.02 0.09 0.00 0.95 0.00 0.00 58.89 59.96 1if7 h TRP 16 Cb 0.68 -0.24 -0.01 0.00 -0.86 0.00 0.00 29.16 28.73 1if7 h TRP 16 CO 0.00 0.21 0.27 1.12 -1.05 0.00 0.00 178.44 178.99 1if7 h HIS 17 N 0.59 0.00 -0.76 0.49 2.07 -1.78 -0.00 115.15 115.76 1if7 h HIS 17 Ca 0.50 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 58.00 1if7 h HIS 17 Cb 0.99 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 30.94 1if7 h HIS 17 CO -0.00 0.00 0.38 0.87 -3.07 0.00 0.00 177.93 176.11 1if7 h LYS 18 N 0.00 1.08 0.00 5.12 1.57 -1.70 -2.96 116.57 119.67 1if7 h LYS 18 Ca 0.15 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1if7 h LYS 18 Cb 0.69 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.80 1if7 h LYS 18 CO -0.00 0.82 -1.95 -0.25 -0.57 0.00 0.00 179.45 177.50 1if7 n ASP 19 N -4.33 0.35 -3.73 0.86 8.00 -0.91 -4.72 116.55 112.07 1if7 n ASP 19 Ca 0.08 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.29 1if7 n ASP 19 Cb 0.12 1.88 -0.12 0.00 -0.02 0.00 0.00 41.12 42.99 1if7 n ASP 19 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1if7 s PHE 20 N -3.37 2.46 0.57 1.24 0.08 -0.06 -4.97 117.98 113.92 1if7 s PHE 20 Ca -0.08 -2.80 0.31 0.00 0.12 0.00 0.00 56.93 54.48 1if7 s PHE 20 Cb 0.13 -2.04 1.45 0.00 -0.57 0.00 0.00 43.02 41.99 1if7 s PHE 20 CO 0.84 -0.70 1.84 -1.35 -0.10 0.00 0.00 175.22 175.76 1if7 h PRO 21 N 5.97 0.00 0.00 0.24 0.11 -1.77 -0.45 132.00 136.09 1if7 h PRO 21 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1if7 h PRO 21 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 1if7 h PRO 21 CO 0.56 0.00 0.00 1.51 -0.21 0.00 0.00 178.00 179.86 1if7 n ILE 22 N -3.94 1.51 0.02 4.15 0.13 -1.26 -2.26 119.36 117.70 1if7 n ILE 22 Ca 0.15 0.45 0.14 0.00 -1.10 0.00 0.00 62.75 62.38 1if7 n ILE 22 Cb 0.90 -1.37 0.59 0.00 -0.84 0.00 0.00 39.64 38.92 1if7 n ILE 22 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1if7 h ALA 23 N 2.15 2.16 -0.87 1.51 0.00 -1.40 0.93 119.26 123.75 1if7 h ALA 23 Ca 0.00 -0.01 -0.41 0.00 0.00 0.00 0.00 54.91 54.49 1if7 h ALA 23 Cb 0.09 -0.03 -0.24 0.00 0.00 0.00 0.00 17.79 17.61 1if7 h ALA 23 CO 0.00 -0.27 0.49 1.63 0.00 0.00 0.00 179.25 181.10 1if7 n LYS 24 N -4.45 2.56 -0.44 0.00 5.02 -0.96 -4.95 118.16 114.94 1if7 n LYS 24 Ca 0.07 -3.05 -0.16 0.00 -2.02 0.00 0.00 58.31 53.16 1if7 n LYS 24 Cb 0.38 -2.15 0.14 0.00 -0.02 0.00 0.00 35.03 33.38 1if7 n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1if7 n GLY 25 N -0.91 -2.92 0.09 0.72 0.00 0.32 -5.00 105.19 97.49 1if7 n GLY 25 Ca 0.53 -1.42 0.11 0.00 0.00 0.00 0.00 46.02 45.23 1if7 n GLY 25 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1if7 n GLU 26 N -3.42 0.62 -3.01 1.61 4.07 -1.26 -4.47 120.64 114.77 1if7 n GLU 26 Ca 0.08 0.06 -0.22 0.00 -0.06 0.00 0.00 57.16 57.02 1if7 n GLU 26 Cb 0.31 -1.76 -0.03 0.00 -0.06 0.00 0.00 31.44 29.90 1if7 n GLU 26 CO 0.00 0.00 0.00 2.89 -0.06 0.00 0.00 177.13 179.96 1if7 n ARG 27 N -2.61 2.05 -3.28 5.31 1.85 -1.26 -4.68 116.66 114.04 1if7 n ARG 27 Ca -0.02 -4.04 -0.33 0.00 -1.00 0.00 0.00 57.85 52.46 1if7 n ARG 27 Cb 0.58 -1.93 -0.06 0.00 -1.05 0.00 0.00 32.46 30.00 1if7 n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1if7 s GLN 28 N -2.97 3.93 0.26 2.89 -1.52 -1.26 -2.61 119.66 118.38 1if7 s GLN 28 Ca 0.43 0.49 0.09 0.00 -1.95 0.00 0.00 55.36 54.43 1if7 s GLN 28 Cb 0.33 -2.62 -0.05 0.00 -0.22 0.00 0.00 33.01 30.45 1if7 s GLN 28 CO -0.10 0.28 -0.15 -1.12 -0.25 0.00 0.00 175.29 173.95 1if7 s SER 29 N -2.20 3.11 0.75 5.90 0.01 -1.26 -4.67 113.70 115.34 1if7 s SER 29 Ca 0.48 -1.07 -0.08 0.00 1.31 0.00 0.00 55.95 56.60 1if7 s SER 29 Cb -0.12 -0.22 0.08 0.00 0.21 0.00 0.00 66.02 65.97 1if7 s SER 29 CO 0.19 -0.12 1.07 -2.16 0.41 0.00 0.00 173.24 172.64 1if7 s PRO 30 N -3.60 1.95 0.19 12.44 0.04 -1.26 -4.57 135.00 140.20 1if7 s PRO 30 Ca 0.27 -0.27 0.03 0.00 0.04 0.00 0.00 61.00 61.07 1if7 s PRO 30 Cb -0.01 -2.11 -0.05 0.00 0.04 0.00 0.00 34.50 32.37 1if7 s PRO 30 CO 0.12 -1.44 -0.01 0.14 0.04 0.00 0.00 177.00 175.85 1if7 s VAL 31 N -3.36 0.88 -0.04 -0.36 -7.23 -1.26 0.73 120.40 109.76 1if7 s VAL 31 Ca 0.62 -2.01 -0.23 0.00 -1.81 0.00 0.00 61.98 58.55 1if7 s VAL 31 Cb -0.10 -2.18 -0.04 0.00 0.56 0.00 0.00 36.38 34.62 1if7 s VAL 31 CO 0.46 -0.44 0.68 -0.62 -0.31 0.00 0.00 175.10 174.86 1if7 s ASP 32 N -3.23 7.00 -0.55 4.85 2.15 -1.26 -3.41 116.67 122.22 1if7 s ASP 32 Ca 0.25 1.20 -0.20 0.00 0.43 0.00 0.00 52.55 54.23 1if7 s ASP 32 Cb 0.05 -2.40 0.07 0.00 -0.30 0.00 0.00 42.92 40.34 1if7 s ASP 32 CO 0.06 -0.05 0.72 -0.63 -0.17 0.00 0.00 175.17 175.10 1if7 s ILE 33 N 0.47 4.74 -0.62 4.11 -1.09 0.61 -4.94 121.20 124.48 1if7 s ILE 33 Ca 0.36 -0.52 -0.25 0.00 -2.23 0.00 0.00 60.65 58.01 1if7 s ILE 33 Cb -0.18 -4.42 0.05 0.00 -1.58 0.00 0.00 42.46 36.32 1if7 s ILE 33 CO 0.18 -1.00 1.05 -0.62 -1.23 0.00 0.00 174.94 173.32 1if7 s ASP 34 N 3.07 6.27 0.56 3.58 -1.08 -1.26 -0.18 116.67 127.63 1if7 s ASP 34 Ca 0.17 -0.48 0.24 0.00 -0.52 0.00 0.00 52.55 51.97 1if7 s ASP 34 Cb -0.19 -2.47 1.51 0.00 -1.46 0.00 0.00 42.92 40.30 1if7 s ASP 34 CO 0.11 -1.44 2.11 0.71 0.52 0.00 0.00 175.17 177.18 1if7 h THR 35 N 6.03 0.69 0.00 1.71 1.35 -1.95 -1.44 112.91 119.29 1if7 h THR 35 Ca -0.27 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1if7 h THR 35 Cb 1.07 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 68.36 1if7 h THR 35 CO 1.17 0.00 -0.17 1.41 -0.25 0.00 0.00 175.52 177.67 1if7 n HIS 36 N -4.15 0.33 0.22 4.73 8.25 -1.26 -3.77 115.22 119.58 1if7 n HIS 36 Ca 0.02 0.10 0.08 0.00 -0.26 0.00 0.00 57.72 57.65 1if7 n HIS 36 Cb 0.29 -0.60 -0.12 0.00 1.12 0.00 0.00 29.99 30.68 1if7 n HIS 36 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1if7 n THR 37 N -1.80 0.00 -2.12 1.59 -1.04 -0.58 -4.97 114.28 105.36 1if7 n THR 37 Ca 0.06 -0.30 -0.40 0.00 -2.04 0.00 0.00 64.05 61.36 1if7 n THR 37 Cb 0.38 0.38 -0.02 0.00 -1.82 0.00 0.00 70.33 69.25 1if7 n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1if7 s ALA 38 N -2.97 3.41 -0.26 2.41 0.00 -0.96 -4.85 121.76 118.55 1if7 s ALA 38 Ca -0.02 1.22 -0.12 0.00 0.00 0.00 0.00 51.96 53.04 1if7 s ALA 38 Cb 0.11 -3.47 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 1if7 s ALA 38 CO 0.68 -0.67 0.23 0.21 0.00 0.00 0.00 175.76 176.21 1if7 s LYS 39 N -1.93 4.02 -0.11 0.00 2.20 -0.55 -4.82 119.74 118.56 1if7 s LYS 39 Ca 0.51 -0.20 -0.29 0.00 -0.36 0.00 0.00 55.97 55.63 1if7 s LYS 39 Cb -0.38 -3.61 -0.05 0.00 -1.51 0.00 0.00 37.83 32.28 1if7 s LYS 39 CO 0.51 -0.10 1.66 -0.47 -0.36 0.00 0.00 175.35 176.59 1if7 s TYR 40 N 1.52 1.99 -0.37 4.03 5.04 -1.26 -0.86 117.35 127.43 1if7 s TYR 40 Ca 0.09 0.31 -0.05 0.00 -2.44 0.00 0.00 57.07 54.99 1if7 s TYR 40 Cb -0.15 -3.93 0.07 0.00 0.35 0.00 0.00 41.96 38.30 1if7 s TYR 40 CO 0.08 -3.58 0.15 0.34 -1.34 0.00 0.00 175.55 171.20 1if7 s ASP 41 N 3.78 5.29 0.24 4.32 -1.08 -0.69 -4.90 116.67 123.63 1if7 s ASP 41 Ca 0.74 -1.53 0.22 0.00 -0.52 0.00 0.00 52.55 51.46 1if7 s ASP 41 Cb -0.31 -1.85 0.95 0.00 -1.46 0.00 0.00 42.92 40.25 1if7 s ASP 41 CO 0.29 -0.43 1.67 -0.81 0.52 0.00 0.00 175.17 176.41 1if7 n PRO 42 N 4.73 0.17 0.00 4.34 -0.04 -1.26 -2.56 135.00 140.38 1if7 n PRO 42 Ca -0.09 0.43 0.14 0.00 -0.04 0.00 0.00 63.50 63.95 1if7 n PRO 42 Cb 0.43 -1.84 0.67 0.00 -0.04 0.00 0.00 33.50 32.72 1if7 n PRO 42 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1if7 n SER 43 N -2.16 0.15 -4.72 3.54 3.41 -1.26 -4.80 113.62 107.77 1if7 n SER 43 Ca 0.02 -0.17 -0.42 0.00 -0.26 0.00 0.00 58.87 58.04 1if7 n SER 43 Cb 0.20 -0.23 -0.03 0.00 -0.26 0.00 0.00 64.21 63.89 1if7 n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1if7 s LEU 44 N -2.63 4.39 0.54 1.04 1.43 -1.06 -5.02 118.68 117.37 1if7 s LEU 44 Ca 0.26 2.19 -0.05 0.00 -1.03 0.00 0.00 54.13 55.50 1if7 s LEU 44 Cb 0.20 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.82 1if7 s LEU 44 CO 0.49 -0.52 0.85 -0.54 0.23 0.00 0.00 176.35 176.85 1if7 s LYS 45 N 0.74 3.15 0.50 1.70 1.02 -1.24 -4.98 119.74 120.64 1if7 s LYS 45 Ca 0.59 0.04 -0.21 0.00 0.02 0.00 0.00 55.97 56.42 1if7 s LYS 45 Cb -0.33 -2.33 -0.07 0.00 -0.52 0.00 0.00 37.83 34.59 1if7 s LYS 45 CO 0.32 -0.50 1.14 -1.25 -0.92 0.00 0.00 175.35 174.14 1if7 s PRO 46 N -4.88 3.54 0.55 -1.68 0.04 -1.26 -2.76 135.00 128.56 1if7 s PRO 46 Ca 0.51 1.67 -0.20 0.00 0.04 0.00 0.00 61.00 63.03 1if7 s PRO 46 Cb -0.10 -2.18 -0.05 0.00 0.04 0.00 0.00 34.50 32.20 1if7 s PRO 46 CO 0.45 -0.71 1.17 -0.51 0.04 0.00 0.00 177.00 177.44 1if7 s LEU 47 N -3.45 3.75 -0.30 -3.56 1.43 -1.26 -2.17 118.68 113.12 1if7 s LEU 47 Ca 0.69 2.30 0.02 0.00 -1.03 0.00 0.00 54.13 56.11 1if7 s LEU 47 Cb -0.26 -4.53 0.09 0.00 0.03 0.00 0.00 46.19 41.52 1if7 s LEU 47 CO 0.30 -1.34 0.03 -0.55 0.23 0.00 0.00 176.35 175.02 1if7 s SER 48 N -1.61 4.31 -0.28 2.29 0.15 -0.02 -4.87 113.70 113.67 1if7 s SER 48 Ca 0.73 -1.74 -0.09 0.00 0.70 0.00 0.00 55.95 55.56 1if7 s SER 48 Cb -0.28 -1.28 -0.02 0.00 -1.71 0.00 0.00 66.02 62.73 1if7 s SER 48 CO 0.31 -0.35 0.12 -0.69 1.20 0.00 0.00 173.24 173.83 1if7 s VAL 49 N 1.25 4.61 -0.52 4.45 1.01 -1.26 -1.39 120.40 128.54 1if7 s VAL 49 Ca 0.06 -0.21 0.04 0.00 0.00 0.00 0.00 61.98 61.87 1if7 s VAL 49 Cb -0.18 -3.24 0.14 0.00 0.00 0.00 0.00 36.38 33.09 1if7 s VAL 49 CO -0.13 0.22 0.29 -0.44 0.00 0.00 0.00 175.10 175.03 1if7 s SER 50 N 1.64 4.08 -0.10 3.32 0.01 -0.59 -4.93 113.70 117.13 1if7 s SER 50 Ca 0.06 -3.01 0.14 0.00 1.31 0.00 0.00 55.95 54.46 1if7 s SER 50 Cb -0.16 -1.41 0.47 0.00 0.21 0.00 0.00 66.02 65.14 1if7 s SER 50 CO 0.06 -0.22 1.39 -1.22 0.41 0.00 0.00 173.24 173.66 1if7 n TYR 51 N 3.08 0.85 0.29 2.43 4.01 -1.26 -1.23 117.16 125.33 1if7 n TYR 51 Ca 0.09 -0.70 0.16 0.00 -0.16 0.00 0.00 57.90 57.29 1if7 n TYR 51 Cb 0.34 -0.20 0.86 0.00 -0.31 0.00 0.00 39.34 40.02 1if7 n TYR 51 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1if7 h ASP 52 N 2.19 0.00 -0.29 7.72 2.03 -1.92 -2.64 116.42 123.52 1if7 h ASP 52 Ca 0.00 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.24 1if7 h ASP 52 Cb 1.18 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 39.65 1if7 h ASP 52 CO 0.15 0.06 -0.01 0.00 -1.03 0.00 0.00 179.24 178.41 1if7 n GLN 53 N -3.49 2.50 -1.93 4.15 1.13 -1.23 -5.04 117.38 113.46 1if7 n GLN 53 Ca -0.02 -2.93 -0.42 0.00 -1.94 0.00 0.00 57.00 51.69 1if7 n GLN 53 Cb 0.19 -1.83 -0.03 0.00 0.11 0.00 0.00 30.24 28.68 1if7 n GLN 53 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1if7 s ALA 54 N -2.97 3.73 -0.35 -1.58 0.00 -1.00 -4.59 121.76 115.01 1if7 s ALA 54 Ca 0.43 1.39 0.01 0.00 0.00 0.00 0.00 51.96 53.79 1if7 s ALA 54 Cb 0.36 -3.61 0.09 0.00 0.00 0.00 0.00 23.12 19.97 1if7 s ALA 54 CO 0.06 -0.80 0.08 0.99 0.00 0.00 0.00 175.76 176.09 1if7 s THR 55 N 0.60 2.65 0.52 0.00 2.01 -1.26 -4.88 115.64 115.28 1if7 s THR 55 Ca 0.66 -2.10 -0.17 0.00 0.31 0.00 0.00 61.69 60.39 1if7 s THR 55 Cb -0.44 -2.83 -0.08 0.00 0.01 0.00 0.00 72.50 69.17 1if7 s THR 55 CO 0.38 -0.53 0.99 -0.94 -0.69 0.00 0.00 174.62 173.83 1if7 s SER 56 N 1.24 6.53 0.00 3.53 1.04 -1.26 -0.78 113.70 124.00 1if7 s SER 56 Ca 0.07 1.61 0.00 0.00 0.48 0.00 0.00 55.95 58.11 1if7 s SER 56 Cb -0.20 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.40 1if7 s SER 56 CO -0.06 -0.65 0.00 0.18 0.98 0.00 0.00 173.24 173.69 1if7 n LEU 57 N -1.59 0.78 -3.59 2.42 4.77 0.05 -4.14 117.00 115.71 1if7 n LEU 57 Ca 0.07 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.90 1if7 n LEU 57 Cb 0.54 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.57 1if7 n LEU 57 CO 0.46 0.13 0.28 -0.60 -1.33 0.00 0.00 177.39 176.33 1if7 s ARG 58 N -1.35 0.99 -0.05 3.23 3.52 -1.22 -1.12 118.95 122.95 1if7 s ARG 58 Ca 0.00 -0.14 0.06 0.00 -0.13 0.00 0.00 55.73 55.52 1if7 s ARG 58 Cb 0.00 0.46 -0.01 0.00 -1.56 0.00 0.00 34.95 33.84 1if7 s ARG 58 CO 0.00 -0.34 -0.23 -1.50 -0.81 0.00 0.00 175.30 172.42 1if7 s ILE 59 N -2.08 1.87 0.01 4.11 2.07 -0.42 -0.34 121.20 126.43 1if7 s ILE 59 Ca -0.07 -0.97 0.00 0.00 -1.41 0.00 0.00 60.65 58.19 1if7 s ILE 59 Cb -0.01 -1.58 -0.01 0.00 0.13 0.00 0.00 42.46 40.99 1if7 s ILE 59 CO 0.01 0.52 -0.02 -0.22 -1.91 0.00 0.00 174.94 173.33 1if7 s LEU 60 N -0.20 2.10 -0.36 8.50 2.96 -0.38 -0.98 118.68 130.33 1if7 s LEU 60 Ca -0.01 -0.22 -0.14 0.00 -0.22 0.00 0.00 54.13 53.54 1if7 s LEU 60 Cb -0.12 0.02 -0.01 0.00 0.50 0.00 0.00 46.19 46.58 1if7 s LEU 60 CO 0.02 -0.12 0.28 0.21 -1.32 0.00 0.00 176.35 175.42 1if7 s ASN 61 N -0.63 6.09 -0.14 3.68 3.84 -0.38 -1.09 114.94 126.32 1if7 s ASN 61 Ca -0.06 -0.54 0.17 0.00 0.21 0.00 0.00 52.86 52.63 1if7 s ASN 61 Cb -0.04 -2.15 0.69 0.00 -0.55 0.00 0.00 41.25 39.19 1if7 s ASN 61 CO -0.00 -0.32 1.61 -0.46 -2.79 0.00 0.00 177.10 175.13 1if7 n ASN 62 N 5.17 4.73 0.00 -4.21 0.23 -0.96 -0.76 115.26 119.46 1if7 n ASN 62 Ca -0.12 -2.58 0.00 0.00 -0.53 0.00 0.00 54.58 51.35 1if7 n ASN 62 Cb 0.49 -0.57 0.00 0.00 -2.08 0.00 0.00 39.78 37.62 1if7 n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1if7 n GLY 63 N 0.79 2.66 0.00 4.83 0.00 -1.26 -4.77 105.19 107.43 1if7 n GLY 63 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1if7 n GLY 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1if7 n HIS 64 N -2.00 0.00 -4.00 1.61 1.44 -1.26 -4.71 115.22 106.31 1if7 n HIS 64 Ca 0.00 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.74 1if7 n HIS 64 Cb 0.00 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.12 1if7 n HIS 64 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1if7 n ALA 65 N -0.46 -3.25 -2.83 1.59 0.00 -1.26 -4.87 120.51 109.44 1if7 n ALA 65 Ca 0.00 -0.71 -0.32 0.00 0.00 0.00 0.00 53.44 52.41 1if7 n ALA 65 Cb 0.00 0.12 -0.16 0.00 0.00 0.00 0.00 19.45 19.41 1if7 n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1if7 s PHE 66 N -2.13 2.56 -0.08 0.00 -0.71 -1.26 -2.28 117.98 114.09 1if7 s PHE 66 Ca 0.27 -0.67 0.01 0.00 -1.04 0.00 0.00 56.93 55.49 1if7 s PHE 66 Cb -0.01 -1.66 -0.03 0.00 -1.21 0.00 0.00 43.02 40.11 1if7 s PHE 66 CO -0.01 -0.19 -0.08 -0.80 -1.34 0.00 0.00 175.22 172.81 1if7 s ASN 67 N -0.08 4.55 -0.27 1.98 0.02 -0.25 -4.27 114.94 116.62 1if7 s ASN 67 Ca -0.05 -0.07 -0.08 0.00 -1.02 0.00 0.00 52.86 51.64 1if7 s ASN 67 Cb -0.14 -1.22 -0.02 0.00 0.02 0.00 0.00 41.25 39.88 1if7 s ASN 67 CO 0.04 0.33 0.10 -0.69 0.02 0.00 0.00 177.10 176.90 1if7 s VAL 68 N -0.61 4.47 0.11 1.60 1.01 -0.29 -1.24 120.40 125.44 1if7 s VAL 68 Ca 0.09 -0.21 -0.07 0.00 0.00 0.00 0.00 61.98 61.80 1if7 s VAL 68 Cb -0.12 -3.14 -0.06 0.00 0.00 0.00 0.00 36.38 33.07 1if7 s VAL 68 CO 0.02 0.26 0.37 -1.61 0.00 0.00 0.00 175.10 174.14 1if7 s GLU 69 N 1.63 3.66 0.22 2.72 2.02 0.54 -1.97 118.70 127.52 1if7 s GLU 69 Ca 0.06 -0.00 0.09 0.00 0.02 0.00 0.00 54.97 55.14 1if7 s GLU 69 Cb -0.16 -2.92 -0.05 0.00 0.10 0.00 0.00 34.13 31.11 1if7 s GLU 69 CO 0.05 0.51 -0.17 -0.06 0.02 0.00 0.00 175.26 175.61 1if7 s PHE 70 N -1.54 1.94 -0.49 1.61 0.40 -0.53 -0.77 117.98 118.60 1if7 s PHE 70 Ca 0.37 -0.47 -0.29 0.00 -0.60 0.00 0.00 56.93 55.95 1if7 s PHE 70 Cb -0.13 -0.90 0.02 0.00 0.51 0.00 0.00 43.02 42.53 1if7 s PHE 70 CO 0.21 0.46 1.29 0.34 0.70 0.00 0.00 175.22 178.23 1if7 s ASP 71 N -3.18 6.40 -0.27 1.36 3.68 0.04 -4.84 116.67 119.86 1if7 s ASP 71 Ca 0.23 0.48 0.11 0.00 2.13 0.00 0.00 52.55 55.50 1if7 s ASP 71 Cb -0.04 -2.55 0.56 0.00 -1.45 0.00 0.00 42.92 39.44 1if7 s ASP 71 CO 0.09 -1.44 1.53 -0.90 0.13 0.00 0.00 175.17 174.58 1if7 n ASP 72 N 8.62 3.30 0.18 -0.34 5.75 -1.26 -4.55 116.55 128.25 1if7 n ASP 72 Ca 0.13 -3.46 0.13 0.00 -0.01 0.00 0.00 54.79 51.59 1if7 n ASP 72 Cb 0.49 -0.64 0.41 0.00 -1.03 0.00 0.00 41.12 40.35 1if7 n ASP 72 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1if7 h SER 73 N 1.43 0.00 -5.24 -1.12 4.64 -1.95 -3.46 113.55 107.86 1if7 h SER 73 Ca 0.20 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.40 1if7 h SER 73 Cb 1.78 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.73 1if7 h SER 73 CO 0.44 0.00 -0.50 -1.10 -0.87 0.00 0.00 176.83 174.81 1if7 s GLN 74 N -3.30 0.84 -0.67 4.77 -0.21 -1.26 -5.05 119.66 114.78 1if7 s GLN 74 Ca 0.06 -1.15 -0.24 0.00 0.02 0.00 0.00 55.36 54.06 1if7 s GLN 74 Cb 0.09 0.29 -0.20 0.00 1.00 0.00 0.00 33.01 34.19 1if7 s GLN 74 CO 0.57 -0.25 1.87 -0.25 -2.12 0.00 0.00 175.29 175.11 1if7 n ASP 75 N -0.04 2.26 -0.08 5.90 8.00 -1.26 -4.54 116.55 126.79 1if7 n ASP 75 Ca -0.12 -2.64 -0.20 0.00 0.71 0.00 0.00 54.79 52.54 1if7 n ASP 75 Cb 0.62 -1.06 -0.12 0.00 -0.02 0.00 0.00 41.12 40.54 1if7 n ASP 75 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1if7 h LYS 76 N 8.51 0.05 -4.36 -1.24 1.57 -1.86 -3.45 116.57 115.79 1if7 h LYS 76 Ca 0.37 -0.08 -0.56 0.00 -1.87 0.00 0.00 60.65 58.51 1if7 h LYS 76 Cb 0.70 0.03 -0.37 0.00 0.08 0.00 0.00 32.23 32.68 1if7 h LYS 76 CO 1.90 1.04 -0.81 0.00 -0.57 0.00 0.00 179.45 181.01 1if7 s ALA 77 N -2.36 1.54 0.17 3.86 0.00 -1.26 -3.54 121.76 120.17 1if7 s ALA 77 Ca -0.25 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.01 1if7 s ALA 77 Cb 0.04 -1.01 -0.05 0.00 0.00 0.00 0.00 23.12 22.10 1if7 s ALA 77 CO 0.65 -0.49 -0.05 0.14 0.00 0.00 0.00 175.76 176.00 1if7 s VAL 78 N 1.62 0.98 -0.07 0.00 -7.23 -0.36 -1.70 120.40 113.63 1if7 s VAL 78 Ca 0.04 -2.02 0.03 0.00 -1.81 0.00 0.00 61.98 58.22 1if7 s VAL 78 Cb -0.13 -2.00 0.01 0.00 0.56 0.00 0.00 36.38 34.81 1if7 s VAL 78 CO -0.09 -0.60 -0.16 -0.22 -0.31 0.00 0.00 175.10 173.72 1if7 s LEU 79 N -3.19 1.80 0.29 1.32 2.96 -0.11 -1.55 118.68 120.20 1if7 s LEU 79 Ca 0.20 -0.37 0.02 0.00 -0.22 0.00 0.00 54.13 53.76 1if7 s LEU 79 Cb 0.04 -1.00 -0.03 0.00 0.50 0.00 0.00 46.19 45.71 1if7 s LEU 79 CO 0.03 0.08 0.28 -0.54 -1.32 0.00 0.00 176.35 174.88 1if7 s LYS 80 N 0.50 1.62 1.43 1.98 1.02 -0.49 -2.23 119.74 123.57 1if7 s LYS 80 Ca -0.14 -1.83 0.00 0.00 0.02 0.00 0.00 55.97 54.01 1if7 s LYS 80 Cb -0.16 0.34 0.00 0.00 -0.52 0.00 0.00 37.83 37.49 1if7 s LYS 80 CO 0.05 -0.60 0.00 0.41 -0.92 0.00 0.00 175.35 174.29 1if7 n GLY 81 N -0.50 -1.83 7.00 -3.33 0.00 -1.26 -0.84 105.19 104.43 1if7 n GLY 81 Ca 0.04 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1if7 n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1if7 n GLY 82 N 0.00 3.31 0.66 -0.02 0.00 -0.92 -1.70 105.19 106.51 1if7 n GLY 82 Ca 0.00 -0.20 0.07 0.00 0.00 0.00 0.00 46.02 45.88 1if7 n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1if7 n PRO 83 N 13.92 1.83 -3.60 1.61 -0.04 -1.26 -3.61 135.00 143.85 1if7 n PRO 83 Ca 0.00 -1.28 -0.33 0.00 -0.04 0.00 0.00 63.50 61.84 1if7 n PRO 83 Cb 0.00 -1.30 -0.05 0.00 -0.04 0.00 0.00 33.50 32.11 1if7 n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1if7 s LEU 84 N -1.08 4.31 -0.15 1.53 1.43 -0.69 -5.08 118.68 118.95 1if7 s LEU 84 Ca 0.26 0.74 0.00 0.00 -1.03 0.00 0.00 54.13 54.09 1if7 s LEU 84 Cb 0.13 -3.13 -0.00 0.00 0.03 0.00 0.00 46.19 43.22 1if7 s LEU 84 CO 0.18 0.12 -0.15 -1.81 0.23 0.00 0.00 176.35 174.92 1if7 s ASP 85 N -2.01 3.70 0.00 2.29 1.01 -1.26 -4.45 116.67 115.95 1if7 s ASP 85 Ca 0.36 -0.45 0.00 0.00 0.71 0.00 0.00 52.55 53.18 1if7 s ASP 85 Cb -0.13 -1.57 0.00 0.00 1.01 0.00 0.00 42.92 42.23 1if7 s ASP 85 CO 0.20 0.10 0.00 0.61 0.21 0.00 0.00 175.17 176.29 1if7 n GLY 86 N 3.94 -0.57 3.88 0.21 0.00 -1.26 -4.95 105.19 106.44 1if7 n GLY 86 Ca -0.19 -1.78 -0.37 0.00 0.00 0.00 0.00 46.02 43.68 1if7 n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1if7 s THR 87 N -1.00 5.47 -0.11 2.61 2.01 -1.26 -4.71 115.64 118.65 1if7 s THR 87 Ca 0.00 0.26 0.03 0.00 0.31 0.00 0.00 61.69 62.28 1if7 s THR 87 Cb 0.00 -3.42 0.01 0.00 0.01 0.00 0.00 72.50 69.09 1if7 s THR 87 CO 0.00 0.62 -0.19 -0.31 -0.69 0.00 0.00 174.62 174.04 1if7 s TYR 88 N -1.02 2.26 -0.03 4.92 1.51 -0.95 -0.72 117.35 123.32 1if7 s TYR 88 Ca 0.16 -1.02 -0.14 0.00 -1.01 0.00 0.00 57.07 55.05 1if7 s TYR 88 Cb -0.12 -1.56 -0.05 0.00 -0.11 0.00 0.00 41.96 40.11 1if7 s TYR 88 CO 0.05 -0.47 0.38 1.03 -1.11 0.00 0.00 175.55 175.42 1if7 s ARG 89 N 0.72 3.91 0.01 -0.62 0.52 -0.44 -0.93 118.95 122.11 1if7 s ARG 89 Ca -0.11 0.34 -0.30 0.00 -0.52 0.00 0.00 55.73 55.13 1if7 s ARG 89 Cb -0.16 -3.24 -0.05 0.00 0.52 0.00 0.00 34.95 32.02 1if7 s ARG 89 CO 0.02 0.64 1.28 -1.17 0.02 0.00 0.00 175.30 176.09 1if7 s LEU 90 N -0.89 4.33 -0.13 2.53 2.96 -0.69 -1.40 118.68 125.38 1if7 s LEU 90 Ca 0.22 2.01 0.04 0.00 -0.22 0.00 0.00 54.13 56.19 1if7 s LEU 90 Cb -0.16 -3.57 -0.11 0.00 0.50 0.00 0.00 46.19 42.85 1if7 s LEU 90 CO 0.12 -0.60 -0.08 0.00 -1.32 0.00 0.00 176.35 174.47 1if7 n ILE 91 N 4.36 0.81 -3.55 6.68 3.06 -0.37 -4.53 119.36 125.83 1if7 n ILE 91 Ca 0.11 -0.37 -0.07 0.00 -2.50 0.00 0.00 62.75 59.92 1if7 n ILE 91 Cb 0.45 -0.91 -0.02 0.00 0.54 0.00 0.00 39.64 39.70 1if7 n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1if7 s GLN 92 N -2.29 0.83 0.05 9.51 1.03 -1.21 -1.45 119.66 126.14 1if7 s GLN 92 Ca -0.15 -0.34 0.03 0.00 0.04 0.00 0.00 55.36 54.94 1if7 s GLN 92 Cb 0.04 0.36 -0.03 0.00 0.03 0.00 0.00 33.01 33.42 1if7 s GLN 92 CO 0.38 -0.37 -0.10 -0.59 -2.54 0.00 0.00 175.29 172.07 1if7 s PHE 93 N -3.07 0.84 0.28 9.60 -0.12 -0.83 -1.02 117.98 123.65 1if7 s PHE 93 Ca 0.07 -0.49 -0.13 0.00 -0.05 0.00 0.00 56.93 56.33 1if7 s PHE 93 Cb -0.01 -0.49 0.00 0.00 -0.63 0.00 0.00 43.02 41.89 1if7 s PHE 93 CO -0.07 -0.04 0.54 -3.38 -0.05 0.00 0.00 175.22 172.22 1if7 s HIS 94 N -1.37 0.35 0.21 3.49 -3.43 -0.87 -1.14 115.29 112.54 1if7 s HIS 94 Ca -0.07 -0.73 0.06 0.00 -0.80 0.00 0.00 55.06 53.51 1if7 s HIS 94 Cb -0.10 0.29 -0.05 0.00 -1.43 0.00 0.00 32.58 31.29 1if7 s HIS 94 CO 0.01 -1.10 -0.10 -0.06 -2.00 0.00 0.00 174.74 171.49 1if7 s PHE 95 N -3.74 1.63 -0.03 0.38 0.40 -1.26 -0.86 117.98 114.49 1if7 s PHE 95 Ca 0.21 -0.69 0.04 0.00 -0.60 0.00 0.00 56.93 55.89 1if7 s PHE 95 Cb -0.02 -0.83 -0.00 0.00 0.51 0.00 0.00 43.02 42.68 1if7 s PHE 95 CO 0.10 0.22 -0.15 -1.01 0.70 0.00 0.00 175.22 175.09 1if7 s HIS 96 N -3.12 1.44 0.24 0.36 3.76 -0.61 -4.75 115.29 112.61 1if7 s HIS 96 Ca 0.23 -0.38 -0.12 0.00 -0.15 0.00 0.00 55.06 54.65 1if7 s HIS 96 Cb 0.02 -0.98 -0.01 0.00 1.11 0.00 0.00 32.58 32.72 1if7 s HIS 96 CO 0.06 -0.12 0.44 1.67 -0.85 0.00 0.00 174.74 175.94 1if7 s TRP 97 N 0.01 0.42 0.49 1.40 -2.14 -1.21 -0.87 118.94 117.03 1if7 s TRP 97 Ca -0.02 -0.77 0.05 0.00 2.66 0.00 0.00 56.10 58.02 1if7 s TRP 97 Cb -0.10 0.11 -0.01 0.00 -3.10 0.00 0.00 33.47 30.38 1if7 s TRP 97 CO 0.01 -0.94 0.21 0.20 -2.66 0.00 0.00 176.95 173.77 1if7 s GLY 98 N -3.02 2.53 0.25 3.67 0.00 -1.18 -1.29 107.32 108.28 1if7 s GLY 98 Ca 0.23 -1.35 0.25 0.00 0.00 0.00 0.00 44.72 43.85 1if7 s GLY 98 CO 0.08 -2.00 1.62 1.48 0.00 0.00 0.00 173.10 174.28 1if7 h SER 99 N 1.16 0.00 -4.60 1.64 4.64 -1.89 -3.41 113.55 111.09 1if7 h SER 99 Ca -0.41 -0.04 -0.27 0.00 -0.47 0.00 0.00 61.79 60.61 1if7 h SER 99 Cb 1.29 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.20 1if7 h SER 99 CO 0.67 0.02 -0.72 -0.76 -0.87 0.00 0.00 176.83 175.16 1if7 s LEU 100 N -4.95 2.40 0.58 5.97 1.43 -1.26 -5.05 118.68 117.80 1if7 s LEU 100 Ca 0.08 -0.80 0.34 0.00 -1.03 0.00 0.00 54.13 52.72 1if7 s LEU 100 Cb 0.10 -0.16 1.80 0.00 0.03 0.00 0.00 46.19 47.96 1if7 s LEU 100 CO 0.65 -0.33 2.18 0.44 0.23 0.00 0.00 176.35 179.52 1if7 h ASP 101 N 3.63 0.00 -0.22 2.29 3.32 -1.92 -2.88 116.42 120.63 1if7 h ASP 101 Ca -0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.69 1if7 h ASP 101 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1if7 h ASP 101 CO 0.54 0.05 0.00 0.61 -1.72 0.00 0.00 179.24 178.71 1if7 n GLY 102 N -0.80 0.82 3.38 2.75 0.00 -1.26 -3.52 105.19 106.56 1if7 n GLY 102 Ca -0.02 -0.28 -0.12 0.00 0.00 0.00 0.00 46.02 45.60 1if7 n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1if7 s GLN 103 N -1.64 1.19 0.00 1.61 -2.07 -1.09 -4.73 119.66 112.93 1if7 s GLN 103 Ca 0.17 -0.52 0.00 0.00 -1.82 0.00 0.00 55.36 53.19 1if7 s GLN 103 Cb 0.10 0.54 0.00 0.00 -1.09 0.00 0.00 33.01 32.56 1if7 s GLN 103 CO 0.09 -0.50 0.00 0.41 -1.32 0.00 0.00 175.29 173.97 1if7 n GLY 104 N -0.26 2.41 3.81 2.60 0.00 -0.97 -3.13 105.19 109.65 1if7 n GLY 104 Ca -0.17 -0.26 -0.32 0.00 0.00 0.00 0.00 46.02 45.27 1if7 n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1if7 s SER 105 N 0.00 5.80 -0.18 1.61 1.04 -0.65 -3.34 113.70 117.98 1if7 s SER 105 Ca 0.00 1.73 -0.16 0.00 0.48 0.00 0.00 55.95 58.00 1if7 s SER 105 Cb 0.00 -2.52 -0.12 0.00 0.10 0.00 0.00 66.02 63.49 1if7 s SER 105 CO 0.00 -1.16 0.02 -0.62 0.98 0.00 0.00 173.24 172.46 1if7 n GLU 106 N -2.27 0.51 -2.34 4.02 1.02 -1.26 -4.83 120.64 115.50 1if7 n GLU 106 Ca 0.08 0.55 -0.33 0.00 -0.02 0.00 0.00 57.16 57.45 1if7 n GLU 106 Cb 0.53 -1.72 -0.02 0.00 -0.02 0.00 0.00 31.44 30.21 1if7 n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1if7 s HIS 107 N -2.31 3.27 0.12 -0.32 3.76 -1.26 -4.39 115.29 114.16 1if7 s HIS 107 Ca -0.22 1.50 0.05 0.00 -0.15 0.00 0.00 55.06 56.24 1if7 s HIS 107 Cb 0.04 -2.88 -0.04 0.00 1.11 0.00 0.00 32.58 30.81 1if7 s HIS 107 CO 0.42 -0.61 -0.13 0.95 -0.85 0.00 0.00 174.74 174.52 1if7 s THR 108 N -2.49 1.26 -0.24 1.30 -4.23 -1.22 -4.70 115.64 105.33 1if7 s THR 108 Ca 0.61 -1.70 -0.00 0.00 -1.18 0.00 0.00 61.69 59.41 1if7 s THR 108 Cb -0.12 -1.50 0.03 0.00 1.34 0.00 0.00 72.50 72.25 1if7 s THR 108 CO 0.31 -0.44 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.17 1if7 s VAL 109 N -2.19 2.64 -1.58 2.29 1.01 -0.93 -0.28 120.40 121.36 1if7 s VAL 109 Ca 0.08 -1.11 -0.15 0.00 0.00 0.00 0.00 61.98 60.80 1if7 s VAL 109 Cb -0.05 -2.34 0.10 0.00 0.00 0.00 0.00 36.38 34.10 1if7 s VAL 109 CO 0.02 0.21 0.91 0.47 0.00 0.00 0.00 175.10 176.72 1if7 n ASP 110 N 4.62 -4.20 0.00 3.32 8.00 0.75 -0.37 116.55 128.68 1if7 n ASP 110 Ca -0.17 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.48 1if7 n ASP 110 Cb 0.47 -3.54 0.00 0.00 -0.02 0.00 0.00 41.12 38.02 1if7 n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1if7 n LYS 111 N -4.59 0.00 -2.53 -1.24 4.76 -1.26 -5.02 118.16 108.28 1if7 n LYS 111 Ca 0.04 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.05 1if7 n LYS 111 Cb 0.52 -2.37 -0.03 0.00 -1.84 0.00 0.00 35.03 31.31 1if7 n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1if7 s LYS 112 N -0.07 4.38 -0.12 1.97 2.20 0.50 -5.01 119.74 123.60 1if7 s LYS 112 Ca 0.00 1.58 -0.08 0.00 -0.36 0.00 0.00 55.97 57.11 1if7 s LYS 112 Cb 0.00 -3.54 -0.04 0.00 -1.51 0.00 0.00 37.83 32.73 1if7 s LYS 112 CO 0.00 -0.39 0.17 0.15 -0.36 0.00 0.00 175.35 174.92 1if7 s LYS 113 N 2.09 3.62 0.46 4.03 1.02 -1.26 -2.19 119.74 127.51 1if7 s LYS 113 Ca 0.53 -0.07 0.07 0.00 0.02 0.00 0.00 55.97 56.52 1if7 s LYS 113 Cb -0.23 -3.23 0.02 0.00 -0.52 0.00 0.00 37.83 33.88 1if7 s LYS 113 CO 0.21 0.69 0.63 0.71 -0.92 0.00 0.00 175.35 176.67 1if7 s TYR 114 N -0.80 2.63 0.40 3.18 2.02 -1.26 -4.65 117.35 118.87 1if7 s TYR 114 Ca 0.15 -0.38 0.12 0.00 -0.37 0.00 0.00 57.07 56.60 1if7 s TYR 114 Cb -0.12 -2.43 0.82 0.00 -0.40 0.00 0.00 41.96 39.83 1if7 s TYR 114 CO 0.04 -0.60 1.90 0.00 -1.57 0.00 0.00 175.55 175.33 1if7 h ALA 115 N 0.48 1.51 -2.47 3.71 0.00 -1.47 -1.63 119.26 119.39 1if7 h ALA 115 Ca -0.39 -0.24 0.16 0.00 0.00 0.00 0.00 54.91 54.43 1if7 h ALA 115 Cb 1.28 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 1if7 h ALA 115 CO 0.45 0.36 0.52 0.00 0.00 0.00 0.00 179.25 180.58 1if7 s ALA 116 N -4.50 -1.56 -0.09 0.00 0.00 -1.19 -3.13 121.76 111.30 1if7 s ALA 116 Ca -0.04 -0.15 -0.04 0.00 0.00 0.00 0.00 51.96 51.73 1if7 s ALA 116 Cb 0.15 0.69 0.04 0.00 0.00 0.00 0.00 23.12 24.01 1if7 s ALA 116 CO 0.72 -1.05 0.20 -2.00 0.00 0.00 0.00 175.76 173.63 1if7 s GLU 117 N -2.69 0.14 -0.08 0.00 2.12 -0.05 -1.39 118.70 116.75 1if7 s GLU 117 Ca 0.17 0.49 -0.17 0.00 0.36 0.00 0.00 54.97 55.82 1if7 s GLU 117 Cb -0.02 -0.15 -0.05 0.00 0.26 0.00 0.00 34.13 34.17 1if7 s GLU 117 CO 0.04 -0.18 0.45 -1.17 -0.54 0.00 0.00 175.26 173.85 1if7 s LEU 118 N 1.39 4.35 -0.18 2.70 2.96 0.40 -1.57 118.68 128.72 1if7 s LEU 118 Ca -0.08 0.86 0.01 0.00 -0.22 0.00 0.00 54.13 54.70 1if7 s LEU 118 Cb -0.11 -2.65 0.03 0.00 0.50 0.00 0.00 46.19 43.96 1if7 s LEU 118 CO -0.07 0.12 -0.18 -1.00 -1.32 0.00 0.00 176.35 173.90 1if7 s HIS 119 N 0.01 2.70 -0.39 5.38 3.76 -0.04 -1.22 115.29 125.49 1if7 s HIS 119 Ca 0.25 -1.64 -0.11 0.00 -0.15 0.00 0.00 55.06 53.41 1if7 s HIS 119 Cb -0.16 -1.85 0.04 0.00 1.11 0.00 0.00 32.58 31.72 1if7 s HIS 119 CO 0.11 -0.79 0.23 -0.51 -0.85 0.00 0.00 174.74 172.94 1if7 s LEU 120 N 1.31 4.88 -0.19 0.89 1.43 -0.29 -2.04 118.68 124.67 1if7 s LEU 120 Ca 0.03 -1.10 -0.20 0.00 -1.03 0.00 0.00 54.13 51.83 1if7 s LEU 120 Cb -0.14 -2.04 -0.03 0.00 0.03 0.00 0.00 46.19 44.02 1if7 s LEU 120 CO -0.12 -0.44 0.60 -0.69 0.23 0.00 0.00 176.35 175.94 1if7 s VAL 121 N 1.55 5.04 0.09 -1.59 1.01 -0.19 -1.30 120.40 125.01 1if7 s VAL 121 Ca 0.02 1.13 0.08 0.00 0.00 0.00 0.00 61.98 63.21 1if7 s VAL 121 Cb -0.20 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.23 1if7 s VAL 121 CO 0.06 0.13 -0.20 -1.00 0.00 0.00 0.00 175.10 174.10 1if7 s HIS 122 N 1.81 1.70 0.02 5.22 3.76 -0.19 -1.24 115.29 126.37 1if7 s HIS 122 Ca 0.28 -0.42 0.08 0.00 -0.15 0.00 0.00 55.06 54.85 1if7 s HIS 122 Cb -0.16 -0.94 -0.02 0.00 1.11 0.00 0.00 32.58 32.57 1if7 s HIS 122 CO 0.10 0.17 -0.23 1.67 -0.85 0.00 0.00 174.74 175.61 1if7 s TRP 123 N -1.13 1.99 -0.16 1.40 1.48 -0.50 -1.69 118.94 120.34 1if7 s TRP 123 Ca 0.05 -0.38 -0.29 0.00 -1.06 0.00 0.00 56.10 54.42 1if7 s TRP 123 Cb -0.10 -1.22 -0.05 0.00 -1.16 0.00 0.00 33.47 30.94 1if7 s TRP 123 CO 0.04 0.05 2.01 1.21 -4.06 0.00 0.00 176.95 176.20 1if7 s ASN 124 N -0.95 5.91 0.62 -2.66 3.84 0.31 -1.33 114.94 120.68 1if7 s ASN 124 Ca 0.09 1.99 0.33 0.00 0.21 0.00 0.00 52.86 55.47 1if7 s ASN 124 Cb -0.09 -2.52 1.84 0.00 -0.55 0.00 0.00 41.25 39.93 1if7 s ASN 124 CO 0.01 -1.58 2.13 0.71 -2.79 0.00 0.00 177.10 175.58 1if7 h THR 125 N 6.55 0.27 -0.01 -5.21 1.35 -1.27 -1.17 112.91 113.42 1if7 h THR 125 Ca -0.41 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 1if7 h THR 125 Cb 1.22 0.84 -0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1if7 h THR 125 CO 0.97 0.00 0.04 0.50 -0.25 0.00 0.00 175.52 176.78 1if7 h LYS 127 N 0.00 0.00 -0.10 4.72 3.64 -1.89 -2.30 116.57 120.64 1if7 h LYS 127 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1if7 h LYS 127 Cb 0.40 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1if7 h LYS 127 CO -0.00 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.84 1if7 n TYR 128 N -3.20 0.11 0.00 1.91 4.01 -0.44 -4.99 117.16 114.56 1if7 n TYR 128 Ca -0.03 -0.06 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 1if7 n TYR 128 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 1if7 n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1if7 n GLY 129 N 1.26 1.29 3.50 2.72 0.00 -0.87 -4.54 105.19 108.56 1if7 n GLY 129 Ca 0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 1if7 n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1if7 s ASP 130 N 0.00 -0.09 0.22 1.61 1.47 -1.26 -5.06 116.67 113.56 1if7 s ASP 130 Ca 0.00 -0.82 -0.08 0.00 1.18 0.00 0.00 52.55 52.83 1if7 s ASP 130 Cb 0.00 0.54 0.17 0.00 -0.34 0.00 0.00 42.92 43.30 1if7 s ASP 130 CO 0.00 -1.05 1.83 0.15 0.68 0.00 0.00 175.17 176.78 1if7 h PHE 131 N 2.32 1.13 -0.09 2.11 3.57 -1.95 -2.22 116.94 121.82 1if7 h PHE 131 Ca -0.28 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.16 1if7 h PHE 131 Cb 1.25 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 39.62 1if7 h PHE 131 CO 0.39 0.79 -0.06 0.78 -2.23 0.00 0.00 178.31 177.98 1if7 h GLY 132 N 1.14 0.14 1.10 2.40 0.00 -1.97 -2.11 103.07 103.77 1if7 h GLY 132 Ca 0.29 -0.07 -0.28 0.00 0.00 0.00 0.00 47.33 47.27 1if7 h GLY 132 CO -0.04 0.06 -1.20 0.50 0.00 0.00 0.00 176.54 175.86 1if7 h LYS 133 N 0.13 0.52 -0.94 4.80 6.56 -1.77 -3.31 116.57 122.56 1if7 h LYS 133 Ca 0.03 -0.78 0.12 0.00 -1.06 0.00 0.00 60.65 58.96 1if7 h LYS 133 Cb 0.20 0.27 -0.07 0.00 -0.57 0.00 0.00 32.23 32.06 1if7 h LYS 133 CO 0.01 1.36 0.60 0.00 -2.06 0.00 0.00 179.45 179.36 1if7 h ALA 134 N 0.20 1.65 0.00 3.86 0.00 -0.85 -0.52 119.26 123.60 1if7 h ALA 134 Ca -0.20 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1if7 h ALA 134 Cb 1.91 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.52 1if7 h ALA 134 CO 0.23 0.12 0.00 1.33 0.00 0.00 0.00 179.25 180.93 1if7 n VAL 135 N -4.57 0.00 -0.05 0.00 0.24 -0.85 -1.99 118.33 111.12 1if7 n VAL 135 Ca 0.17 0.00 0.06 0.00 -2.04 0.00 0.00 64.34 62.54 1if7 n VAL 135 Cb 0.37 -0.32 0.15 0.00 -1.47 0.00 0.00 33.84 32.57 1if7 n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1if7 n GLN 136 N -0.64 2.41 -4.76 7.34 6.02 -0.20 -4.93 117.38 122.61 1if7 n GLN 136 Ca 0.04 -1.96 -0.27 0.00 -0.01 0.00 0.00 57.00 54.81 1if7 n GLN 136 Cb 0.02 -1.30 -0.14 0.00 1.02 0.00 0.00 30.24 29.84 1if7 n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1if7 s GLN 137 N -1.02 1.55 0.49 -1.09 -1.52 -0.84 -5.04 119.66 112.19 1if7 s GLN 137 Ca 0.24 -0.98 0.33 0.00 -1.95 0.00 0.00 55.36 53.01 1if7 s GLN 137 Cb 0.13 -1.66 1.59 0.00 -0.22 0.00 0.00 33.01 32.85 1if7 s GLN 137 CO 0.18 0.43 1.99 -1.00 -0.25 0.00 0.00 175.29 176.64 1if7 h PRO 138 N 4.92 0.00 -0.30 2.91 0.13 -1.86 -2.36 132.00 135.43 1if7 h PRO 138 Ca -0.43 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.46 1if7 h PRO 138 Cb 1.15 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.02 1if7 h PRO 138 CO 0.44 0.00 -0.79 -0.40 -0.23 0.00 0.00 178.00 177.02 1if7 n ASP 139 N -2.77 2.57 0.09 1.44 5.75 -1.26 -4.29 116.55 118.07 1if7 n ASP 139 Ca -0.01 -3.24 -0.07 0.00 -0.01 0.00 0.00 54.79 51.46 1if7 n ASP 139 Cb 0.17 -0.42 -0.00 0.00 -1.03 0.00 0.00 41.12 39.83 1if7 n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1if7 h GLY 140 N 1.61 0.12 -3.25 6.12 0.00 -1.31 -3.43 103.07 102.92 1if7 h GLY 140 Ca 0.05 -0.22 -0.61 0.00 0.00 0.00 0.00 47.33 46.55 1if7 h GLY 140 CO 0.28 0.19 -0.81 1.08 0.00 0.00 0.00 176.54 177.28 1if7 s LEU 141 N -7.27 2.43 -0.06 3.11 1.43 -0.36 -0.53 118.68 117.43 1if7 s LEU 141 Ca -0.02 -0.86 -0.01 0.00 -1.03 0.00 0.00 54.13 52.21 1if7 s LEU 141 Cb 0.11 -1.06 0.03 0.00 0.03 0.00 0.00 46.19 45.29 1if7 s LEU 141 CO 0.81 0.07 0.01 0.00 0.23 0.00 0.00 176.35 177.48 1if7 s ALA 142 N -1.76 0.59 -0.16 4.21 0.00 -0.68 -1.15 121.76 122.81 1if7 s ALA 142 Ca 0.19 -0.04 0.01 0.00 0.00 0.00 0.00 51.96 52.11 1if7 s ALA 142 Cb -0.07 -0.66 0.00 0.00 0.00 0.00 0.00 23.12 22.39 1if7 s ALA 142 CO 0.09 -0.39 -0.17 0.08 0.00 0.00 0.00 175.76 175.36 1if7 s VAL 143 N 1.83 2.44 -0.31 0.00 1.01 -1.03 -1.02 120.40 123.33 1if7 s VAL 143 Ca 0.02 -0.84 -0.19 0.00 0.00 0.00 0.00 61.98 60.97 1if7 s VAL 143 Cb -0.12 -2.02 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 1if7 s VAL 143 CO -0.04 0.52 0.57 -0.22 0.00 0.00 0.00 175.10 175.93 1if7 s LEU 144 N 0.93 4.17 -0.13 3.92 2.96 -0.42 -2.15 118.68 127.96 1if7 s LEU 144 Ca -0.04 0.32 -0.05 0.00 -0.22 0.00 0.00 54.13 54.14 1if7 s LEU 144 Cb -0.15 -2.72 -0.04 0.00 0.50 0.00 0.00 46.19 43.78 1if7 s LEU 144 CO -0.03 -0.44 0.06 -0.83 -1.32 0.00 0.00 176.35 173.79 1if7 s GLY 145 N 1.66 1.95 -0.06 7.98 0.00 -0.30 -1.14 107.32 117.41 1if7 s GLY 145 Ca 0.23 -0.74 0.01 0.00 0.00 0.00 0.00 44.72 44.22 1if7 s GLY 145 CO 0.12 -0.28 -0.08 -0.42 0.00 0.00 0.00 173.10 172.44 1if7 s ILE 146 N -0.43 0.80 0.31 0.90 1.01 -0.36 -1.46 121.20 121.97 1if7 s ILE 146 Ca 0.09 -0.27 -0.22 0.00 0.00 0.00 0.00 60.65 60.25 1if7 s ILE 146 Cb -0.12 -0.77 -0.09 0.00 0.01 0.00 0.00 42.46 41.48 1if7 s ILE 146 CO 0.02 0.28 0.85 -0.36 0.00 0.00 0.00 174.94 175.74 1if7 s PHE 147 N 0.85 3.58 -0.15 3.97 0.08 -1.26 -0.46 117.98 124.59 1if7 s PHE 147 Ca -0.12 1.57 -0.00 0.00 0.12 0.00 0.00 56.93 58.50 1if7 s PHE 147 Cb -0.15 -2.77 -0.01 0.00 -0.57 0.00 0.00 43.02 39.52 1if7 s PHE 147 CO 0.01 0.19 -0.14 -0.51 -0.10 0.00 0.00 175.22 174.67 1if7 s LEU 148 N -2.31 2.58 0.05 -0.37 1.02 -0.49 -0.71 118.68 118.46 1if7 s LEU 148 Ca 0.50 -0.42 0.05 0.00 0.02 0.00 0.00 54.13 54.27 1if7 s LEU 148 Cb -0.16 -1.59 -0.04 0.00 0.02 0.00 0.00 46.19 44.43 1if7 s LEU 148 CO 0.20 0.10 -0.06 -0.75 0.02 0.00 0.00 176.35 175.86 1if7 s LYS 149 N 0.75 2.45 -0.05 1.70 2.20 0.38 -2.12 119.74 125.04 1if7 s LYS 149 Ca -0.06 -0.82 -0.24 0.00 -0.36 0.00 0.00 55.97 54.49 1if7 s LYS 149 Cb -0.15 -2.46 -0.04 0.00 -1.51 0.00 0.00 37.83 33.67 1if7 s LYS 149 CO 0.01 0.56 0.74 0.08 -0.36 0.00 0.00 175.35 176.38 1if7 s VAL 150 N -1.13 5.02 0.00 4.02 1.01 -1.26 -0.95 120.40 127.11 1if7 s VAL 150 Ca 0.20 1.53 0.00 0.00 0.00 0.00 0.00 61.98 63.71 1if7 s VAL 150 Cb -0.11 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.19 1if7 s VAL 150 CO 0.12 0.24 0.00 0.61 0.00 0.00 0.00 175.10 176.07 1if7 n GLY 151 N 3.05 0.24 3.87 4.51 0.00 0.39 -4.85 105.19 112.40 1if7 n GLY 151 Ca -0.00 0.52 -0.30 0.00 0.00 0.00 0.00 46.02 46.24 1if7 n GLY 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1if7 s SER 152 N 2.00 6.45 0.63 1.61 1.04 -1.26 -3.89 113.70 120.27 1if7 s SER 152 Ca 0.00 1.23 -0.18 0.00 0.48 0.00 0.00 55.95 57.48 1if7 s SER 152 Cb 0.00 -2.37 -0.02 0.00 0.10 0.00 0.00 66.02 63.73 1if7 s SER 152 CO 0.00 -0.54 1.24 0.00 0.98 0.00 0.00 173.24 174.91 1if7 s ALA 153 N -2.62 2.43 -0.40 5.32 0.00 -1.26 -2.60 121.76 122.64 1if7 s ALA 153 Ca 0.53 1.06 -0.08 0.00 0.00 0.00 0.00 51.96 53.46 1if7 s ALA 153 Cb -0.10 -3.49 0.07 0.00 0.00 0.00 0.00 23.12 19.60 1if7 s ALA 153 CO 0.37 -1.40 0.21 0.21 0.00 0.00 0.00 175.76 175.16 1if7 s LYS 154 N -3.43 2.56 0.21 0.00 2.47 -1.25 -4.80 119.74 115.50 1if7 s LYS 154 Ca 0.79 -1.41 -0.16 0.00 -1.56 0.00 0.00 55.97 53.62 1if7 s LYS 154 Cb -0.32 -3.68 0.20 0.00 -1.46 0.00 0.00 37.83 32.57 1if7 s LYS 154 CO 0.37 -0.89 1.60 -1.35 0.16 0.00 0.00 175.35 175.24 1if7 h PRO 155 N 8.33 -0.07 0.00 4.03 0.11 -1.92 -1.70 132.00 140.77 1if7 h PRO 155 Ca -0.22 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1if7 h PRO 155 Cb 1.08 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1if7 h PRO 155 CO 0.71 -0.05 0.00 0.41 -0.21 0.00 0.00 178.00 178.86 1if7 n GLY 156 N -1.45 -0.94 0.08 -0.55 0.00 -1.26 -1.72 105.19 99.35 1if7 n GLY 156 Ca 0.07 0.19 0.11 0.00 0.00 0.00 0.00 46.02 46.39 1if7 n GLY 156 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1if7 n LEU 157 N -2.29 0.70 -0.19 0.99 7.94 -0.64 -4.41 117.00 119.10 1if7 n LEU 157 Ca -0.01 0.22 0.11 0.00 -1.11 0.00 0.00 56.01 55.22 1if7 n LEU 157 Cb 0.06 -0.08 0.42 0.00 0.53 0.00 0.00 43.42 44.36 1if7 n LEU 157 CO 0.11 -0.11 1.21 -0.61 -1.11 0.00 0.00 177.39 176.89 1if7 h GLN 158 N 0.00 0.58 -0.33 1.96 5.75 -1.34 -1.53 115.11 120.20 1if7 h GLN 158 Ca 0.00 -0.03 -0.05 0.00 -0.15 0.00 0.00 58.65 58.42 1if7 h GLN 158 Cb 0.91 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 29.32 1if7 h GLN 158 CO 0.00 0.38 0.01 -0.22 -2.65 0.00 0.00 178.83 176.35 1if7 h LYS 159 N 0.59 0.51 -0.25 1.69 3.64 -1.78 -0.84 116.57 120.14 1if7 h LYS 159 Ca 0.36 -0.11 -0.15 0.00 -1.27 0.00 0.00 60.65 59.49 1if7 h LYS 159 Cb 0.60 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 1if7 h LYS 159 CO -0.13 0.54 -0.44 0.28 -2.27 0.00 0.00 179.45 177.42 1if7 h VAL 160 N 0.49 1.30 -0.51 2.00 2.07 -1.58 -3.23 116.25 116.80 1if7 h VAL 160 Ca 0.11 -1.64 0.01 0.00 0.82 0.00 0.00 66.70 66.00 1if7 h VAL 160 Cb 0.31 1.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.78 1if7 h VAL 160 CO 0.01 0.52 0.33 0.58 0.02 0.00 0.00 177.57 179.03 1if7 h VAL 161 N 0.47 1.10 -0.86 2.57 2.07 -0.85 -3.12 116.25 117.64 1if7 h VAL 161 Ca 0.02 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 67.31 1if7 h VAL 161 Cb 1.04 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 1if7 h VAL 161 CO 0.10 0.12 0.56 0.44 0.02 0.00 0.00 177.57 178.81 1if7 h ASP 162 N 0.66 0.99 0.79 0.57 3.32 -1.20 -2.88 116.42 118.67 1if7 h ASP 162 Ca 0.19 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1if7 h ASP 162 Cb -0.05 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.26 1if7 h ASP 162 CO -0.06 0.72 -0.16 0.52 -1.72 0.00 0.00 179.24 178.54 1if7 n VAL 163 N -4.40 0.00 0.11 -1.35 0.31 -1.18 -4.07 118.33 107.74 1if7 n VAL 163 Ca 0.10 -0.00 0.18 0.00 -0.01 0.00 0.00 64.34 64.60 1if7 n VAL 163 Cb 0.03 -0.24 0.74 0.00 -0.91 0.00 0.00 33.84 33.46 1if7 n VAL 163 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1if7 h LEU 164 N 0.04 0.00 -1.61 7.52 3.38 -1.47 -1.02 115.31 122.15 1if7 h LEU 164 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1if7 h LEU 164 Cb 0.48 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 1if7 h LEU 164 CO 0.00 0.00 -0.03 0.44 0.09 0.00 0.00 178.44 178.94 1if7 h ASP 165 N 0.00 0.19 0.32 -0.43 3.32 -1.79 -2.54 116.42 115.48 1if7 h ASP 165 Ca 0.16 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1if7 h ASP 165 Cb 0.76 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.26 1if7 h ASP 165 CO -0.00 0.26 -0.15 -1.54 -1.72 0.00 0.00 179.24 176.09 1if7 n SER 166 N -4.38 0.65 -2.37 6.45 3.41 -0.39 -3.87 113.62 113.12 1if7 n SER 166 Ca -0.01 -0.68 -0.14 0.00 -0.26 0.00 0.00 58.87 57.78 1if7 n SER 166 Cb 0.18 -0.01 0.03 0.00 -0.26 0.00 0.00 64.21 64.15 1if7 n SER 166 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1if7 n ILE 167 N -0.84 1.99 -0.34 -1.33 -5.35 -0.97 -4.67 119.36 107.85 1if7 n ILE 167 Ca 0.14 -3.66 0.02 0.00 -0.27 0.00 0.00 62.75 58.98 1if7 n ILE 167 Cb 0.30 -0.09 0.19 0.00 -1.74 0.00 0.00 39.64 38.30 1if7 n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1if7 h LYS 168 N 2.37 1.12 -6.33 6.28 3.64 -1.65 -3.42 116.57 118.58 1if7 h LYS 168 Ca 0.15 -0.07 -0.60 0.00 -1.27 0.00 0.00 60.65 58.87 1if7 h LYS 168 Cb 1.42 -0.25 -0.12 0.00 -0.41 0.00 0.00 32.23 32.87 1if7 h LYS 168 CO 0.51 0.74 -0.69 0.95 -2.27 0.00 0.00 179.45 178.69 1if7 s THR 169 N -6.00 3.27 -0.07 1.00 -4.23 -1.26 -0.71 115.64 107.64 1if7 s THR 169 Ca -0.12 -1.79 -0.40 0.00 -1.18 0.00 0.00 61.69 58.20 1if7 s THR 169 Cb 0.20 -2.68 -0.18 0.00 1.34 0.00 0.00 72.50 71.18 1if7 s THR 169 CO 0.81 -0.23 1.32 1.17 -0.54 0.00 0.00 174.62 177.15 1if7 n LYS 170 N -0.36 0.56 0.00 3.99 4.81 -0.11 -1.73 118.16 125.32 1if7 n LYS 170 Ca -0.09 0.20 0.00 0.00 -0.87 0.00 0.00 58.31 57.56 1if7 n LYS 170 Cb 0.57 -1.78 0.00 0.00 0.02 0.00 0.00 35.03 33.84 1if7 n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1if7 n GLY 171 N 2.53 3.37 3.79 3.14 0.00 0.07 -4.48 105.19 113.60 1if7 n GLY 171 Ca 0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 1if7 n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1if7 s LYS 172 N -0.76 4.39 0.09 1.61 1.02 -0.71 -4.85 119.74 120.53 1if7 s LYS 172 Ca 0.00 1.33 -0.04 0.00 0.02 0.00 0.00 55.97 57.28 1if7 s LYS 172 Cb 0.00 -2.58 -0.03 0.00 -0.52 0.00 0.00 37.83 34.70 1if7 s LYS 172 CO 0.00 0.09 0.09 -1.54 -0.92 0.00 0.00 175.35 173.07 1if7 s SER 173 N -1.74 0.30 -0.02 2.83 1.04 -1.26 -1.24 113.70 113.61 1if7 s SER 173 Ca 0.55 -0.93 -0.05 0.00 0.48 0.00 0.00 55.95 56.00 1if7 s SER 173 Cb -0.17 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.24 1if7 s SER 173 CO 0.22 -0.70 0.11 0.00 0.98 0.00 0.00 173.24 173.85 1if7 s ALA 174 N -3.94 -0.26 0.28 5.32 0.00 -0.15 -4.91 121.76 118.10 1if7 s ALA 174 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 51.96 51.77 1if7 s ALA 174 Cb 0.06 -0.01 -0.11 0.00 0.00 0.00 0.00 23.12 23.06 1if7 s ALA 174 CO -0.07 -0.14 1.58 -0.51 0.00 0.00 0.00 175.76 176.62 1if7 s ASP 175 N -0.80 6.42 -0.42 0.00 1.01 -1.26 -1.29 116.67 120.33 1if7 s ASP 175 Ca -0.09 2.89 0.05 0.00 0.71 0.00 0.00 52.55 56.11 1if7 s ASP 175 Cb -0.05 -2.63 0.19 0.00 1.01 0.00 0.00 42.92 41.44 1if7 s ASP 175 CO 0.01 -0.88 0.39 0.33 0.21 0.00 0.00 175.17 175.23 1if7 n PHE 176 N 2.37 -0.57 -3.24 4.23 7.35 -0.28 -4.78 117.46 122.55 1if7 n PHE 176 Ca 0.09 -3.42 -0.23 0.00 -0.76 0.00 0.00 57.45 53.13 1if7 n PHE 176 Cb 0.38 0.08 -0.00 0.00 0.35 0.00 0.00 39.48 40.28 1if7 n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1if7 s THR 177 N -0.32 4.60 -1.53 -2.13 -4.23 -1.26 -2.74 115.64 108.04 1if7 s THR 177 Ca 0.33 -0.53 -0.04 0.00 -1.18 0.00 0.00 61.69 60.28 1if7 s THR 177 Cb 0.07 -3.68 0.01 0.00 1.34 0.00 0.00 72.50 70.24 1if7 s THR 177 CO -0.18 -0.44 0.42 0.59 -0.54 0.00 0.00 174.62 174.47 1if7 n ASN 178 N -1.88 -5.56 -4.73 3.99 4.13 -1.26 -4.97 115.26 104.99 1if7 n ASN 178 Ca -0.02 -0.21 -0.37 0.00 1.68 0.00 0.00 54.58 55.66 1if7 n ASN 178 Cb 0.57 -4.54 -0.06 0.00 -1.54 0.00 0.00 39.78 34.20 1if7 n ASN 178 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1if7 s PHE 179 N -3.07 3.49 -0.41 3.10 5.36 -1.26 -5.01 117.98 120.18 1if7 s PHE 179 Ca 0.23 0.76 -0.17 0.00 -0.96 0.00 0.00 56.93 56.79 1if7 s PHE 179 Cb -0.11 -2.45 0.02 0.00 -0.34 0.00 0.00 43.02 40.14 1if7 s PHE 179 CO 0.29 0.21 0.40 0.34 -1.46 0.00 0.00 175.22 175.00 1if7 s ASP 180 N 0.53 6.18 0.00 6.13 -1.08 -1.26 -4.45 116.67 122.72 1if7 s ASP 180 Ca 0.22 -0.64 0.18 0.00 -0.52 0.00 0.00 52.55 51.78 1if7 s ASP 180 Cb -0.14 -2.21 0.90 0.00 -1.46 0.00 0.00 42.92 40.01 1if7 s ASP 180 CO 0.07 -0.52 1.53 -0.81 0.52 0.00 0.00 175.17 175.96 1if7 n PRO 181 N 5.50 0.26 0.26 4.34 -0.04 -1.26 -2.74 135.00 141.32 1if7 n PRO 181 Ca -0.08 0.11 0.17 0.00 -0.04 0.00 0.00 63.50 63.66 1if7 n PRO 181 Cb 0.48 -1.50 0.74 0.00 -0.04 0.00 0.00 33.50 33.17 1if7 n PRO 181 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1if7 h ARG 182 N 0.00 0.00 0.00 0.54 3.08 -1.92 -2.22 114.38 113.86 1if7 h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1if7 h ARG 182 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 1if7 h ARG 182 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 1if7 n GLY 183 N -0.17 -1.22 0.96 0.04 0.00 -1.11 -3.06 105.19 100.63 1if7 n GLY 183 Ca 0.00 -0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.03 1if7 n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1if7 n LEU 184 N -1.35 3.01 -4.82 0.99 4.77 -0.83 -4.49 117.00 114.28 1if7 n LEU 184 Ca 0.11 -1.07 -0.38 0.00 -0.03 0.00 0.00 56.01 54.63 1if7 n LEU 184 Cb 0.24 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.23 1if7 n LEU 184 CO 0.21 0.53 0.22 -0.76 -1.33 0.00 0.00 177.39 176.26 1if7 s LEU 185 N -1.87 4.50 1.11 2.23 1.43 -1.17 -4.97 118.68 119.94 1if7 s LEU 185 Ca 0.29 1.16 -0.18 0.00 -1.03 0.00 0.00 54.13 54.37 1if7 s LEU 185 Cb 0.20 -2.84 0.25 0.00 0.03 0.00 0.00 46.19 43.83 1if7 s LEU 185 CO 0.29 0.28 1.17 -2.16 0.23 0.00 0.00 176.35 176.15 1if7 s PRO 186 N -1.18 -0.50 0.06 1.29 0.04 -1.26 -4.98 135.00 128.47 1if7 s PRO 186 Ca 0.28 -0.11 -0.19 0.00 0.04 0.00 0.00 61.00 61.03 1if7 s PRO 186 Cb -0.18 -1.68 -0.12 0.00 0.04 0.00 0.00 34.50 32.55 1if7 s PRO 186 CO 0.17 -3.23 1.39 1.49 0.04 0.00 0.00 177.00 176.87 1if7 h GLU 187 N -2.23 0.44 -5.98 4.56 4.81 -1.92 -3.45 114.58 110.81 1if7 h GLU 187 Ca -0.46 -0.21 -0.61 0.00 -0.13 0.00 0.00 59.36 57.95 1if7 h GLU 187 Cb 1.28 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.62 1if7 h GLU 187 CO 0.38 0.76 -0.43 0.45 -0.73 0.00 0.00 179.01 179.45 1if7 s SER 188 N -6.17 6.42 -0.19 1.04 0.15 -1.26 -5.01 113.70 108.67 1if7 s SER 188 Ca -0.14 0.41 0.16 0.00 0.70 0.00 0.00 55.95 57.08 1if7 s SER 188 Cb 0.06 -2.02 0.62 0.00 -1.71 0.00 0.00 66.02 62.97 1if7 s SER 188 CO 0.77 0.15 1.53 0.18 1.20 0.00 0.00 173.24 177.06 1if7 n LEU 189 N 0.37 4.47 -4.77 3.45 4.77 -1.26 -4.74 117.00 119.29 1if7 n LEU 189 Ca -0.05 -2.95 -0.40 0.00 -0.03 0.00 0.00 56.01 52.57 1if7 n LEU 189 Cb 0.52 -0.58 -0.01 0.00 -2.33 0.00 0.00 43.42 41.01 1if7 n LEU 189 CO 0.49 0.67 1.02 -1.81 -1.33 0.00 0.00 177.39 176.43 1if7 s ASP 190 N -1.53 6.48 0.24 -1.43 1.01 -1.26 -4.76 116.67 115.42 1if7 s ASP 190 Ca 0.46 2.79 -0.10 0.00 0.71 0.00 0.00 52.55 56.40 1if7 s ASP 190 Cb 0.36 -2.65 -0.01 0.00 1.01 0.00 0.00 42.92 41.63 1if7 s ASP 190 CO 0.12 -0.75 0.40 -0.72 0.21 0.00 0.00 175.17 174.43 1if7 s TYR 191 N -1.17 0.54 0.10 4.23 -0.85 -1.26 -1.17 117.35 117.77 1if7 s TYR 191 Ca 0.53 -0.87 0.09 0.00 -0.52 0.00 0.00 57.07 56.30 1if7 s TYR 191 Cb -0.41 0.02 -0.04 0.00 0.38 0.00 0.00 41.96 41.91 1if7 s TYR 191 CO 0.55 -0.92 -0.19 -1.58 -1.52 0.00 0.00 175.55 171.89 1if7 s TRP 192 N -4.05 2.52 0.01 -3.49 0.51 -0.13 -1.66 118.94 112.65 1if7 s TRP 192 Ca 0.26 -0.28 0.00 0.00 -2.12 0.00 0.00 56.10 53.97 1if7 s TRP 192 Cb 0.01 -1.37 -0.01 0.00 -0.81 0.00 0.00 33.47 31.29 1if7 s TRP 192 CO 0.10 0.34 -0.02 -0.08 -0.51 0.00 0.00 176.95 176.78 1if7 s THR 193 N -1.07 0.09 0.08 2.01 -1.32 0.09 -1.00 115.64 114.51 1if7 s THR 193 Ca 0.17 -0.55 -0.26 0.00 -1.21 0.00 0.00 61.69 59.83 1if7 s THR 193 Cb -0.10 -0.18 0.08 0.00 -1.51 0.00 0.00 72.50 70.79 1if7 s THR 193 CO 0.08 -0.29 0.68 -0.72 -2.21 0.00 0.00 174.62 172.16 1if7 s TYR 194 N -0.87 -0.53 -0.06 9.09 1.13 -1.04 -1.23 117.35 123.83 1if7 s TYR 194 Ca -0.09 0.49 -0.23 0.00 -1.41 0.00 0.00 57.07 55.82 1if7 s TYR 194 Cb -0.06 0.52 -0.04 0.00 -1.10 0.00 0.00 41.96 41.28 1if7 s TYR 194 CO -0.01 -0.73 0.69 -1.25 -2.51 0.00 0.00 175.55 171.74 1if7 s PRO 195 N -3.01 4.43 0.00 -3.49 0.04 -1.26 -1.05 135.00 130.66 1if7 s PRO 195 Ca -0.01 0.85 0.00 0.00 0.04 0.00 0.00 61.00 61.89 1if7 s PRO 195 Cb -0.01 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 31.09 1if7 s PRO 195 CO -0.07 0.09 0.00 0.41 0.04 0.00 0.00 177.00 177.47 1if7 n GLY 196 N 3.07 4.86 3.31 0.56 0.00 0.13 -4.84 105.19 112.27 1if7 n GLY 196 Ca -0.02 -0.72 -0.18 0.00 0.00 0.00 0.00 46.02 45.10 1if7 n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1if7 s SER 197 N 1.37 1.46 0.53 1.61 1.04 -1.07 -2.51 113.70 116.13 1if7 s SER 197 Ca 0.00 -1.69 -0.19 0.00 0.48 0.00 0.00 55.95 54.54 1if7 s SER 197 Cb 0.00 0.56 -0.06 0.00 0.10 0.00 0.00 66.02 66.61 1if7 s SER 197 CO 0.00 -1.08 1.08 -0.76 0.98 0.00 0.00 173.24 173.47 1if7 s LEU 198 N -3.34 3.75 0.00 2.42 1.43 -0.79 -4.47 118.68 117.69 1if7 s LEU 198 Ca 0.39 2.03 0.23 0.00 -1.03 0.00 0.00 54.13 55.75 1if7 s LEU 198 Cb 0.02 -4.57 0.54 0.00 0.03 0.00 0.00 46.19 42.21 1if7 s LEU 198 CO 0.26 -1.05 1.45 0.35 0.23 0.00 0.00 176.35 177.58 1if7 n THR 199 N -1.28 0.31 -4.22 5.49 -2.24 -1.26 -4.48 114.28 106.60 1if7 n THR 199 Ca 0.10 -0.55 -0.15 0.00 -2.27 0.00 0.00 64.05 61.18 1if7 n THR 199 Cb 0.52 0.81 -0.11 0.00 -2.10 0.00 0.00 70.33 69.46 1if7 n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1if7 s THR 200 N -1.69 1.11 0.53 4.28 -4.23 -1.26 -4.74 115.64 109.63 1if7 s THR 200 Ca 0.35 -1.81 -0.21 0.00 -1.18 0.00 0.00 61.69 58.85 1if7 s THR 200 Cb 0.20 -1.57 -0.08 0.00 1.34 0.00 0.00 72.50 72.40 1if7 s THR 200 CO 0.30 -0.60 0.91 -2.65 -0.54 0.00 0.00 174.62 172.04 1if7 n PRO 201 N 0.28 1.01 0.00 3.99 -0.02 -1.26 -0.57 135.00 138.43 1if7 n PRO 201 Ca -0.14 0.38 0.05 0.00 -2.02 0.00 0.00 63.50 61.77 1if7 n PRO 201 Cb 0.59 -2.04 0.31 0.00 -0.02 0.00 0.00 33.50 32.33 1if7 n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1if7 n PRO 202 N -0.40 0.68 -3.29 0.52 -0.04 -1.26 -5.00 135.00 126.20 1if7 n PRO 202 Ca 0.12 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.34 1if7 n PRO 202 Cb 0.44 -1.24 0.03 0.00 -0.04 0.00 0.00 33.50 32.69 1if7 n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1if7 n LEU 203 N -0.74 -2.36 -4.71 1.53 4.77 0.26 -4.89 117.00 110.86 1if7 n LEU 203 Ca 0.08 -0.40 -0.42 0.00 -0.03 0.00 0.00 56.01 55.23 1if7 n LEU 203 Cb 0.04 -2.65 -0.03 0.00 -2.33 0.00 0.00 43.42 38.44 1if7 n LEU 203 CO 0.06 0.27 1.35 -0.76 -1.33 0.00 0.00 177.39 176.98 1if7 s LEU 204 N -6.75 4.37 -1.33 2.23 1.02 -1.26 -4.44 118.68 112.52 1if7 s LEU 204 Ca 0.41 2.75 -0.14 0.00 0.02 0.00 0.00 54.13 57.16 1if7 s LEU 204 Cb -0.20 -3.59 0.10 0.00 0.02 0.00 0.00 46.19 42.52 1if7 s LEU 204 CO 0.50 -0.93 1.85 -0.62 0.02 0.00 0.00 176.35 177.17 1if7 n GLU 205 N 4.40 3.21 -0.20 1.70 1.02 -1.26 -1.88 120.64 127.63 1if7 n GLU 205 Ca 0.16 -3.24 0.02 0.00 -0.02 0.00 0.00 57.16 54.08 1if7 n GLU 205 Cb 0.37 -3.24 0.03 0.00 -0.02 0.00 0.00 31.44 28.58 1if7 n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1if7 s VAL 207 N -0.79 3.34 -0.40 0.00 1.01 -1.04 -1.22 120.40 121.30 1if7 s VAL 207 Ca 0.07 -0.58 -0.15 0.00 0.00 0.00 0.00 61.98 61.32 1if7 s VAL 207 Cb 0.06 -2.39 0.01 0.00 0.00 0.00 0.00 36.38 34.07 1if7 s VAL 207 CO 0.01 0.55 0.30 -0.89 0.00 0.00 0.00 175.10 175.07 1if7 s THR 208 N -0.13 5.25 0.00 3.92 2.01 -0.30 0.17 115.64 126.55 1if7 s THR 208 Ca 0.00 -0.53 -0.25 0.00 0.31 0.00 0.00 61.69 61.22 1if7 s THR 208 Cb -0.13 -3.90 -0.05 0.00 0.01 0.00 0.00 72.50 68.43 1if7 s THR 208 CO 0.03 -0.26 0.76 0.26 -0.69 0.00 0.00 174.62 174.73 1if7 s TRP 209 N 1.74 3.68 -0.32 4.92 0.52 -0.22 -2.45 118.94 126.81 1if7 s TRP 209 Ca 0.06 1.42 0.01 0.00 0.02 0.00 0.00 56.10 57.61 1if7 s TRP 209 Cb -0.18 -2.84 0.10 0.00 -1.15 0.00 0.00 33.47 29.39 1if7 s TRP 209 CO 0.10 0.19 0.08 0.42 0.02 0.00 0.00 176.95 177.76 1if7 s ILE 210 N 0.31 1.42 -0.24 2.03 1.01 -0.91 -2.51 121.20 122.31 1if7 s ILE 210 Ca 0.39 -1.77 -0.10 0.00 0.00 0.00 0.00 60.65 59.18 1if7 s ILE 210 Cb -0.20 -2.07 -0.05 0.00 0.01 0.00 0.00 42.46 40.16 1if7 s ILE 210 CO 0.22 -0.65 0.14 -0.69 0.00 0.00 0.00 174.94 173.96 1if7 s VAL 211 N 1.34 5.14 0.13 2.92 1.01 -0.17 -1.15 120.40 129.61 1if7 s VAL 211 Ca 0.10 0.10 -0.30 0.00 0.00 0.00 0.00 61.98 61.88 1if7 s VAL 211 Cb -0.18 -3.39 -0.07 0.00 0.00 0.00 0.00 36.38 32.74 1if7 s VAL 211 CO -0.19 0.35 1.11 -0.76 0.00 0.00 0.00 175.10 175.61 1if7 s LEU 212 N 1.14 4.45 0.17 3.92 1.43 -0.53 -0.96 118.68 128.30 1if7 s LEU 212 Ca 0.07 2.02 -0.12 0.00 -1.03 0.00 0.00 54.13 55.07 1if7 s LEU 212 Cb -0.14 -3.59 0.07 0.00 0.03 0.00 0.00 46.19 42.56 1if7 s LEU 212 CO 0.05 -0.28 1.73 0.50 0.23 0.00 0.00 176.35 178.58 1if7 h LYS 213 N 5.70 0.87 -5.68 1.70 3.64 -1.48 -3.43 116.57 117.89 1if7 h LYS 213 Ca -0.43 -0.15 -0.60 0.00 -1.27 0.00 0.00 60.65 58.19 1if7 h LYS 213 Cb 1.21 -0.14 -0.10 0.00 -0.41 0.00 0.00 32.23 32.79 1if7 h LYS 213 CO 0.75 0.74 0.34 -2.00 -2.27 0.00 0.00 179.45 177.01 1if7 s GLU 214 N -5.58 4.10 0.62 1.90 2.12 -1.26 -5.03 118.70 115.58 1if7 s GLU 214 Ca -0.13 0.71 -0.08 0.00 0.36 0.00 0.00 54.97 55.83 1if7 s GLU 214 Cb 0.13 -3.67 0.00 0.00 0.26 0.00 0.00 34.13 30.85 1if7 s GLU 214 CO 0.79 -0.52 0.97 -1.25 -0.54 0.00 0.00 175.26 174.71 1if7 s PRO 215 N 2.74 3.04 0.14 4.30 0.04 -1.26 -4.68 135.00 139.32 1if7 s PRO 215 Ca 0.31 0.26 0.03 0.00 0.04 0.00 0.00 61.00 61.64 1if7 s PRO 215 Cb -0.15 -2.18 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 1if7 s PRO 215 CO 0.09 -0.74 0.19 0.96 0.04 0.00 0.00 177.00 177.54 1if7 s ILE 216 N -3.11 4.90 -0.10 0.56 -4.36 0.12 -4.91 121.20 114.30 1if7 s ILE 216 Ca 0.55 -0.82 -0.06 0.00 -0.26 0.00 0.00 60.65 60.06 1if7 s ILE 216 Cb -0.11 -3.48 -0.04 0.00 1.25 0.00 0.00 42.46 40.08 1if7 s ILE 216 CO 0.48 -0.04 0.12 -0.44 0.24 0.00 0.00 174.94 175.30 1if7 s SER 217 N -2.99 6.18 0.04 4.36 0.01 -1.26 -0.47 113.70 119.58 1if7 s SER 217 Ca 0.32 0.40 0.03 0.00 1.31 0.00 0.00 55.95 58.01 1if7 s SER 217 Cb -0.11 -1.95 -0.02 0.00 0.21 0.00 0.00 66.02 64.14 1if7 s SER 217 CO 0.26 0.39 -0.09 0.68 0.41 0.00 0.00 173.24 174.88 1if7 s VAL 218 N -1.04 0.70 0.64 3.43 -7.23 -0.12 -3.77 120.40 113.01 1if7 s VAL 218 Ca 0.16 -1.04 -0.12 0.00 -1.81 0.00 0.00 61.98 59.17 1if7 s VAL 218 Cb -0.12 -0.72 -0.02 0.00 0.56 0.00 0.00 36.38 36.09 1if7 s VAL 218 CO 0.05 -0.27 1.05 -0.94 -0.31 0.00 0.00 175.10 174.68 1if7 s SER 219 N -1.44 5.75 0.27 4.85 1.04 -1.16 -0.47 113.70 122.54 1if7 s SER 219 Ca -0.06 1.61 -0.01 0.00 0.48 0.00 0.00 55.95 57.97 1if7 s SER 219 Cb -0.09 -2.50 0.47 0.00 0.10 0.00 0.00 66.02 64.00 1if7 s SER 219 CO 0.01 -1.19 1.85 -1.28 0.98 0.00 0.00 173.24 173.61 1if7 h SER 220 N -0.25 0.94 -0.72 7.02 0.87 -1.93 -1.48 113.55 117.99 1if7 h SER 220 Ca -0.45 0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.09 1if7 h SER 220 Cb 1.21 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.97 1if7 h SER 220 CO 0.58 0.55 0.24 -0.33 -0.53 0.00 0.00 176.83 177.34 1if7 h GLU 221 N 1.04 1.13 0.03 2.24 3.07 -1.95 -0.03 114.58 120.10 1if7 h GLU 221 Ca 0.46 -0.23 -0.00 0.00 -0.50 0.00 0.00 59.36 59.08 1if7 h GLU 221 Cb 0.34 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 1if7 h GLU 221 CO -0.22 0.95 -0.01 1.96 -1.40 0.00 0.00 179.01 180.28 1if7 h GLN 222 N 1.08 -0.03 0.00 2.33 4.20 -1.66 -2.95 115.11 118.08 1if7 h GLN 222 Ca 0.24 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.87 1if7 h GLN 222 Cb 0.28 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1if7 h GLN 222 CO -0.01 0.17 -0.37 -0.39 -0.67 0.00 0.00 178.83 177.56 1if7 h VAL 223 N -0.23 1.14 -0.74 -0.54 -1.51 -1.26 -2.72 116.25 110.39 1if7 h VAL 223 Ca -0.00 -1.31 0.05 0.00 -1.23 0.00 0.00 66.70 64.22 1if7 h VAL 223 Cb 0.22 1.73 -0.06 0.00 -2.13 0.00 0.00 31.29 31.05 1if7 h VAL 223 CO 0.01 0.36 0.44 -0.07 -1.23 0.00 0.00 177.57 177.07 1if7 h LEU 224 N 0.00 0.68 -1.68 4.19 3.38 -0.88 -2.14 115.31 118.87 1if7 h LEU 224 Ca -0.00 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1if7 h LEU 224 Cb 0.70 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1if7 h LEU 224 CO 0.05 0.45 0.07 0.11 0.09 0.00 0.00 178.44 179.21 1if7 h LYS 225 N 0.82 0.28 -0.70 1.13 1.57 -1.32 -1.54 116.57 116.81 1if7 h LYS 225 Ca 0.32 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 59.05 1if7 h LYS 225 Cb 0.15 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 1if7 h LYS 225 CO -0.16 0.24 0.34 0.74 -0.57 0.00 0.00 179.45 180.03 1if7 h PHE 226 N 0.28 1.00 0.00 -1.35 -1.00 -1.43 -2.65 116.94 111.79 1if7 h PHE 226 Ca 0.07 -0.05 0.00 0.00 2.81 0.00 0.00 57.97 60.80 1if7 h PHE 226 Cb 0.07 -0.31 0.00 0.00 3.61 0.00 0.00 35.95 39.32 1if7 h PHE 226 CO 0.00 0.75 0.00 0.54 -1.61 0.00 0.00 178.31 177.99 1if7 n ARG 227 N -4.44 0.10 -0.03 1.51 1.74 -0.59 -2.58 116.66 112.38 1if7 n ARG 227 Ca 0.06 0.23 0.13 0.00 -0.77 0.00 0.00 57.85 57.49 1if7 n ARG 227 Cb 0.13 -1.50 0.35 0.00 -1.02 0.00 0.00 32.46 30.42 1if7 n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1if7 n LYS 228 N -1.36 1.95 -1.79 5.56 5.02 -1.00 -4.46 118.16 122.08 1if7 n LYS 228 Ca 0.04 -1.39 -0.30 0.00 -2.02 0.00 0.00 58.31 54.64 1if7 n LYS 228 Cb 0.10 -1.47 0.05 0.00 -0.02 0.00 0.00 35.03 33.69 1if7 n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1if7 s LEU 229 N -1.90 2.95 -0.02 -0.35 1.43 -1.06 -4.91 118.68 114.82 1if7 s LEU 229 Ca 0.34 1.28 0.07 0.00 -1.03 0.00 0.00 54.13 54.79 1if7 s LEU 229 Cb 0.20 -4.12 -0.02 0.00 0.03 0.00 0.00 46.19 42.28 1if7 s LEU 229 CO 0.31 -1.35 -0.21 0.20 0.23 0.00 0.00 176.35 175.53 1if7 s ASN 230 N -4.18 3.45 0.10 2.29 0.02 0.11 -0.45 114.94 116.27 1if7 s ASN 230 Ca 0.58 -0.39 -0.13 0.00 -1.02 0.00 0.00 52.86 51.90 1if7 s ASN 230 Cb -0.12 -0.53 -0.16 0.00 0.02 0.00 0.00 41.25 40.47 1if7 s ASN 230 CO 0.53 0.32 1.30 -0.26 0.02 0.00 0.00 177.10 179.01 1if7 h PHE 231 N 5.29 1.06 -4.20 2.20 0.04 -1.51 -3.34 116.94 116.49 1if7 h PHE 231 Ca -0.45 -0.47 -0.50 0.00 2.80 0.00 0.00 57.97 59.36 1if7 h PHE 231 Cb 1.14 -0.17 0.14 0.00 2.20 0.00 0.00 35.95 39.26 1if7 h PHE 231 CO 0.45 1.30 0.28 0.54 -0.60 0.00 0.00 178.31 180.28 1if7 s ASN 232 N -7.08 3.98 0.65 2.17 4.22 -1.26 -4.26 114.94 113.37 1if7 s ASN 232 Ca -0.11 1.68 -0.02 0.00 -2.14 0.00 0.00 52.86 52.27 1if7 s ASN 232 Cb 0.08 -2.36 0.07 0.00 1.28 0.00 0.00 41.25 40.32 1if7 s ASN 232 CO 0.90 -2.34 0.92 -0.83 -2.04 0.00 0.00 177.10 173.70 1if7 s GLY 233 N -3.39 1.77 0.23 0.45 0.00 -1.26 -0.93 107.32 104.19 1if7 s GLY 233 Ca 0.62 -1.25 -0.31 0.00 0.00 0.00 0.00 44.72 43.78 1if7 s GLY 233 CO 0.57 -0.86 1.63 1.85 0.00 0.00 0.00 173.10 176.29 1if7 s GLU 234 N -5.04 4.15 0.00 2.90 2.12 -1.26 -2.43 118.70 119.14 1if7 s GLU 234 Ca 0.60 2.53 0.00 0.00 0.36 0.00 0.00 54.97 58.46 1if7 s GLU 234 Cb -0.09 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.22 1if7 s GLU 234 CO 0.42 -0.66 0.00 0.41 -0.54 0.00 0.00 175.26 174.89 1if7 n GLY 235 N 3.19 3.02 3.82 -1.50 0.00 -1.26 -5.05 105.19 107.40 1if7 n GLY 235 Ca 0.12 -0.37 -0.30 0.00 0.00 0.00 0.00 46.02 45.47 1if7 n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1if7 s GLU 236 N 0.00 2.14 0.60 1.61 2.02 -1.02 -5.01 118.70 119.04 1if7 s GLU 236 Ca 0.00 0.59 -0.19 0.00 0.02 0.00 0.00 54.97 55.38 1if7 s GLU 236 Cb 0.00 -1.93 -0.03 0.00 0.10 0.00 0.00 34.13 32.27 1if7 s GLU 236 CO 0.00 -1.57 1.28 -2.14 0.02 0.00 0.00 175.26 172.85 1if7 s PRO 237 N -5.20 2.88 -0.10 0.39 0.02 -1.26 -4.89 135.00 126.84 1if7 s PRO 237 Ca 0.61 2.02 -0.28 0.00 0.02 0.00 0.00 61.00 63.36 1if7 s PRO 237 Cb -0.14 -2.00 -0.02 0.00 0.02 0.00 0.00 34.50 32.37 1if7 s PRO 237 CO 0.54 -1.33 0.94 -2.00 -0.33 0.00 0.00 177.00 174.82 1if7 s GLU 238 N -3.22 4.42 -0.22 5.54 2.12 -1.26 -4.77 118.70 121.31 1if7 s GLU 238 Ca 0.78 1.27 0.00 0.00 0.36 0.00 0.00 54.97 57.38 1if7 s GLU 238 Cb -0.36 -3.53 0.06 0.00 0.26 0.00 0.00 34.13 30.56 1if7 s GLU 238 CO 0.39 -0.25 -0.05 -1.21 -0.54 0.00 0.00 175.26 173.61 1if7 s GLU 239 N 1.80 1.53 0.33 4.30 2.02 -1.26 -5.07 118.70 122.35 1if7 s GLU 239 Ca 0.46 -0.88 -0.29 0.00 0.02 0.00 0.00 54.97 54.28 1if7 s GLU 239 Cb -0.18 -2.48 -0.10 0.00 0.10 0.00 0.00 34.13 31.46 1if7 s GLU 239 CO 0.18 -0.58 1.38 -0.51 0.02 0.00 0.00 175.26 175.75 1if7 s LEU 240 N 1.47 4.39 -0.91 1.80 1.43 -1.26 -1.44 118.68 124.16 1if7 s LEU 240 Ca -0.05 2.79 -0.23 0.00 -1.03 0.00 0.00 54.13 55.61 1if7 s LEU 240 Cb -0.18 -3.65 0.06 0.00 0.03 0.00 0.00 46.19 42.44 1if7 s LEU 240 CO -0.07 -0.65 1.33 -0.32 0.23 0.00 0.00 176.35 176.87 1if7 s MET 241 N -1.67 3.45 0.04 1.70 -2.45 0.40 -4.64 119.30 116.12 1if7 s MET 241 Ca 0.51 -0.94 -0.04 0.00 -1.25 0.00 0.00 55.69 53.97 1if7 s MET 241 Cb -0.42 -4.90 -0.02 0.00 1.25 0.00 0.00 34.83 30.74 1if7 s MET 241 CO 0.54 -2.11 0.06 0.14 1.05 0.00 0.00 175.02 174.70 1if7 s VAL 242 N 4.82 0.15 -1.37 10.11 -7.23 -1.26 -4.53 120.40 121.10 1if7 s VAL 242 Ca 0.40 -1.22 -0.09 0.00 -1.81 0.00 0.00 61.98 59.26 1if7 s VAL 242 Cb -0.04 -0.95 0.02 0.00 0.56 0.00 0.00 36.38 35.96 1if7 s VAL 242 CO -0.02 -0.67 1.16 0.47 -0.31 0.00 0.00 175.10 175.73 1if7 n ASP 243 N 0.71 -6.01 -2.88 4.85 8.00 -0.41 -4.87 116.55 115.94 1if7 n ASP 243 Ca -0.18 -0.57 -0.31 0.00 0.71 0.00 0.00 54.79 54.44 1if7 n ASP 243 Cb 0.59 -4.94 -0.05 0.00 -0.02 0.00 0.00 41.12 36.70 1if7 n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1if7 n ASN 244 N -3.01 7.11 -4.16 -2.24 6.94 -1.15 -4.89 115.26 113.86 1if7 n ASN 244 Ca -0.00 -3.08 -0.19 0.00 -0.02 0.00 0.00 54.58 51.29 1if7 n ASN 244 Cb 0.56 -1.32 -0.13 0.00 -2.36 0.00 0.00 39.78 36.54 1if7 n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 1if7 s TRP 245 N -1.01 1.21 -0.11 -2.53 1.48 -1.26 -4.57 118.94 112.14 1if7 s TRP 245 Ca 0.59 -0.41 -0.10 0.00 -1.06 0.00 0.00 56.10 55.12 1if7 s TRP 245 Cb 0.29 -0.70 -0.05 0.00 -1.16 0.00 0.00 33.47 31.85 1if7 s TRP 245 CO -0.14 0.05 0.22 0.50 -4.06 0.00 0.00 176.95 173.51 1if7 s ARG 246 N -1.44 3.79 0.69 3.25 3.52 -1.26 -4.96 118.95 122.53 1if7 s ARG 246 Ca -0.00 0.00 -0.16 0.00 -0.13 0.00 0.00 55.73 55.44 1if7 s ARG 246 Cb -0.09 -3.27 0.02 0.00 -1.56 0.00 0.00 34.95 30.05 1if7 s ARG 246 CO 0.02 0.60 1.21 -2.14 -0.81 0.00 0.00 175.30 174.17 1if7 s PRO 247 N -0.57 2.37 0.32 5.12 0.02 -1.26 -4.70 135.00 136.29 1if7 s PRO 247 Ca 0.16 1.77 -0.29 0.00 0.02 0.00 0.00 61.00 62.66 1if7 s PRO 247 Cb -0.13 -1.86 -0.12 0.00 0.02 0.00 0.00 34.50 32.42 1if7 s PRO 247 CO 0.05 -1.66 1.55 0.00 -0.33 0.00 0.00 177.00 176.60 1if7 n ALA 248 N -2.42 2.41 -2.72 -1.55 0.00 -1.26 -4.47 120.51 110.49 1if7 n ALA 248 Ca 0.13 0.36 -0.20 0.00 0.00 0.00 0.00 53.44 53.74 1if7 n ALA 248 Cb 0.50 -2.44 -0.02 0.00 0.00 0.00 0.00 19.45 17.50 1if7 n ALA 248 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1if7 s GLN 249 N -1.03 3.22 0.26 0.00 -1.52 0.22 -4.94 119.66 115.87 1if7 s GLN 249 Ca 0.61 -0.92 -0.30 0.00 -1.95 0.00 0.00 55.36 52.79 1if7 s GLN 249 Cb -0.50 -2.81 -0.11 0.00 -0.22 0.00 0.00 33.01 29.38 1if7 s GLN 249 CO 0.54 0.26 1.51 -1.25 -0.25 0.00 0.00 175.29 176.09 1if7 s PRO 250 N -4.05 4.21 0.36 2.91 0.04 -1.26 -4.57 135.00 132.64 1if7 s PRO 250 Ca 0.39 2.40 0.10 0.00 0.04 0.00 0.00 61.00 63.93 1if7 s PRO 250 Cb -0.09 -3.08 0.67 0.00 0.04 0.00 0.00 34.50 32.04 1if7 s PRO 250 CO 0.29 -0.51 1.82 1.25 0.04 0.00 0.00 177.00 179.89 1if7 h LEU 251 N 5.15 0.13 0.00 -3.56 5.85 -1.95 -3.44 115.31 117.50 1if7 h LEU 251 Ca -0.46 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.22 1if7 h LEU 251 Cb 1.22 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1if7 h LEU 251 CO 0.80 0.45 0.00 0.29 -0.34 0.00 0.00 178.44 179.63 1if7 n LYS 252 N -4.13 0.00 -2.30 1.25 4.76 -1.26 -3.17 118.16 113.31 1if7 n LYS 252 Ca -0.01 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.02 1if7 n LYS 252 Cb 0.38 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.58 1if7 n LYS 252 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1if7 n ASN 253 N 2.32 7.46 -4.19 4.39 5.03 -1.26 -4.94 115.26 124.08 1if7 n ASN 253 Ca 0.00 -3.34 -0.13 0.00 0.87 0.00 0.00 54.58 51.98 1if7 n ASN 253 Cb 0.00 -1.30 -0.10 0.00 -1.02 0.00 0.00 39.78 37.35 1if7 n ASN 253 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1if7 s ARG 254 N -2.18 0.88 -0.04 3.52 0.52 -1.19 -5.14 118.95 115.32 1if7 s ARG 254 Ca 0.46 -1.25 0.04 0.00 -0.52 0.00 0.00 55.73 54.47 1if7 s ARG 254 Cb 0.17 -0.47 -0.00 0.00 0.52 0.00 0.00 34.95 35.17 1if7 s ARG 254 CO -0.08 0.06 -0.16 -1.14 0.02 0.00 0.00 175.30 173.99 1if7 s GLN 255 N -3.20 1.75 -0.28 3.54 0.74 -1.26 -5.04 119.66 115.91 1if7 s GLN 255 Ca 0.09 -0.58 -0.17 0.00 0.05 0.00 0.00 55.36 54.74 1if7 s GLN 255 Cb -0.00 -1.51 -0.03 0.00 1.10 0.00 0.00 33.01 32.57 1if7 s GLN 255 CO -0.01 0.22 0.49 0.42 -0.55 0.00 0.00 175.29 175.86 1if7 s ILE 256 N 0.10 5.08 0.05 -2.34 1.01 -1.26 -4.69 121.20 119.15 1if7 s ILE 256 Ca -0.05 0.75 -0.02 0.00 0.00 0.00 0.00 60.65 61.34 1if7 s ILE 256 Cb -0.12 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 1if7 s ILE 256 CO 0.02 0.05 0.23 -0.54 0.00 0.00 0.00 174.94 174.71 1if7 s LYS 257 N 2.29 3.47 0.03 2.79 1.02 -0.37 -1.48 119.74 127.49 1if7 s LYS 257 Ca 0.20 -0.34 0.08 0.00 0.02 0.00 0.00 55.97 55.93 1if7 s LYS 257 Cb -0.16 -3.03 -0.03 0.00 -0.52 0.00 0.00 37.83 34.09 1if7 s LYS 257 CO 0.10 0.61 -0.21 0.00 -0.92 0.00 0.00 175.35 174.93 1if7 s ALA 258 N -1.47 2.46 -2.22 5.17 0.00 -0.04 -0.73 121.76 124.93 1if7 s ALA 258 Ca 0.33 -1.19 0.19 0.00 0.00 0.00 0.00 51.96 51.29 1if7 s ALA 258 Cb -0.13 -0.66 0.58 0.00 0.00 0.00 0.00 23.12 22.92 1if7 s ALA 258 CO 0.24 0.56 1.45 -1.13 0.00 0.00 0.00 175.76 176.88 1if7 n SER 259 N 1.76 2.10 -4.14 0.00 3.41 -0.66 -1.70 113.62 114.39 1if7 n SER 259 Ca -0.16 -1.84 -0.10 0.00 -0.26 0.00 0.00 58.87 56.51 1if7 n SER 259 Cb 0.52 -0.18 -0.10 0.00 -0.26 0.00 0.00 64.21 64.19 1if7 n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1if7 s PHE 260 N -1.64 0.83 0.00 7.33 -0.71 -1.26 -4.89 117.98 117.63 1if7 s PHE 260 Ca 0.32 -1.21 0.00 0.00 -1.04 0.00 0.00 56.93 55.00 1if7 s PHE 260 Cb 0.17 -0.46 0.00 0.00 -1.21 0.00 0.00 43.02 41.52 1if7 s PHE 260 CO 0.25 -0.52 0.08 0.36 -1.34 0.00 0.00 175.22 174.05