#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ii7 s LEU 2 N 0.00 3.41 -0.66 2.46 1.02 -1.24 -4.82 118.68 118.85 2ii7 s LEU 2 Ca 0.00 1.22 -0.02 0.00 0.02 0.00 0.00 54.13 55.34 2ii7 s LEU 2 Cb 0.00 -2.95 0.33 0.00 0.02 0.00 0.00 46.19 43.60 2ii7 s LEU 2 CO 0.00 -2.36 2.13 -1.54 0.02 0.00 0.00 176.35 174.60 2ii7 n SER 3 N 13.35 7.34 -4.79 2.29 3.41 -1.26 -2.90 113.62 131.06 2ii7 n SER 3 Ca 0.30 -3.64 -0.33 0.00 -0.26 0.00 0.00 58.87 54.93 2ii7 n SER 3 Cb 0.50 -1.06 0.01 0.00 -0.26 0.00 0.00 64.21 63.40 2ii7 n SER 3 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2ii7 s ILE 4 N -4.28 3.60 0.00 -1.33 1.01 -1.26 -4.87 121.20 114.06 2ii7 s ILE 4 Ca 0.55 0.84 0.00 0.00 0.00 0.00 0.00 60.65 62.05 2ii7 s ILE 4 Cb 0.44 -3.33 0.00 0.00 0.01 0.00 0.00 42.46 39.57 2ii7 s ILE 4 CO -0.19 -0.36 0.00 0.61 0.00 0.00 0.00 174.94 175.00 2ii7 n GLY 5 N -0.55 -1.76 3.26 6.18 0.00 -1.26 -3.67 105.19 107.39 2ii7 n GLY 5 Ca 0.10 -1.68 -0.15 0.00 0.00 0.00 0.00 46.02 44.29 2ii7 n GLY 5 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2ii7 s ARG 6 N 0.00 1.45 0.00 1.61 1.70 -0.70 -4.66 118.95 118.34 2ii7 s ARG 6 Ca 0.00 -1.76 0.23 0.00 -0.47 0.00 0.00 55.73 53.74 2ii7 s ARG 6 Cb 0.00 0.31 0.82 0.00 -0.57 0.00 0.00 34.95 35.51 2ii7 s ARG 6 CO 0.00 -0.52 1.60 0.25 -1.08 0.00 0.00 175.30 175.55 2ii7 n THR 7 N -0.42 0.15 -3.70 4.99 -2.24 -1.26 -1.47 114.28 110.33 2ii7 n THR 7 Ca 0.04 -0.34 -0.11 0.00 -2.27 0.00 0.00 64.05 61.37 2ii7 n THR 7 Cb 0.64 0.46 -0.12 0.00 -2.10 0.00 0.00 70.33 69.22 2ii7 n THR 7 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ii7 s TRP 9 N 1.41 1.13 -0.04 0.00 0.52 0.10 -4.99 118.94 117.08 2ii7 s TRP 9 Ca -0.09 -0.90 -0.07 0.00 0.02 0.00 0.00 56.10 55.06 2ii7 s TRP 9 Cb -0.09 -0.63 0.01 0.00 -1.15 0.00 0.00 33.47 31.61 2ii7 s TRP 9 CO -0.11 -0.10 0.16 0.00 0.02 0.00 0.00 176.95 176.92 2ii7 s ALA 10 N -3.54 -0.40 -0.19 0.98 0.00 -1.26 -0.67 121.76 116.68 2ii7 s ALA 10 Ca 0.18 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.40 2ii7 s ALA 10 Cb 0.05 -0.13 0.04 0.00 0.00 0.00 0.00 23.12 23.08 2ii7 s ALA 10 CO 0.00 -0.13 -0.07 0.42 0.00 0.00 0.00 175.76 175.98 2ii7 s ILE 11 N -0.49 1.34 0.10 0.00 1.01 0.31 -5.00 121.20 118.47 2ii7 s ILE 11 Ca -0.06 -0.83 0.21 0.00 0.00 0.00 0.00 60.65 59.97 2ii7 s ILE 11 Cb -0.04 -1.49 0.18 0.00 0.01 0.00 0.00 42.46 41.11 2ii7 s ILE 11 CO 0.01 0.11 1.74 0.00 0.00 0.00 0.00 174.94 176.80 2ii7 h ALA 12 N 8.05 0.96 -2.83 9.38 0.00 -1.91 -0.39 119.26 132.52 2ii7 h ALA 12 Ca -0.25 -0.29 -0.59 0.00 0.00 0.00 0.00 54.91 53.79 2ii7 h ALA 12 Cb 1.10 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 2ii7 h ALA 12 CO 0.43 0.39 -0.54 -2.00 0.00 0.00 0.00 179.25 177.53 2ii7 s GLU 13 N -3.53 3.11 -0.30 0.00 2.56 -1.26 -4.46 118.70 114.81 2ii7 s GLU 13 Ca 0.01 -0.69 -0.17 0.00 0.00 0.00 0.00 54.97 54.12 2ii7 s GLU 13 Cb 0.10 -2.80 0.20 0.00 2.00 0.00 0.00 34.13 33.62 2ii7 s GLU 13 CO 0.67 0.53 1.23 0.20 -0.56 0.00 0.00 175.26 177.34 2ii7 s GLY 14 N -2.85 0.43 -0.30 -1.50 0.00 -0.63 -4.65 107.32 97.83 2ii7 s GLY 14 Ca 0.32 3.69 -0.13 0.00 0.00 0.00 0.00 44.72 48.61 2ii7 s GLY 14 CO 0.25 2.99 0.79 -0.47 0.00 0.00 0.00 173.10 176.65 2ii7 s TYR 15 N 1.47 -1.04 -0.18 1.90 5.04 -1.26 -1.06 117.35 122.23 2ii7 s TYR 15 Ca -0.05 1.85 -0.05 0.00 -2.44 0.00 0.00 57.07 56.39 2ii7 s TYR 15 Cb -0.02 0.62 -0.03 0.00 0.35 0.00 0.00 41.96 42.88 2ii7 s TYR 15 CO -0.13 -0.51 -0.01 0.42 -1.34 0.00 0.00 175.55 173.98 2ii7 s ILE 16 N 2.43 4.00 0.00 3.14 1.01 -1.26 -4.74 121.20 125.78 2ii7 s ILE 16 Ca -0.06 -0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.28 2ii7 s ILE 16 Cb -0.08 -2.78 0.00 0.00 0.01 0.00 0.00 42.46 39.60 2ii7 s ILE 16 CO -0.18 0.46 0.00 -2.65 0.00 0.00 0.00 174.94 172.57 2ii7 n PRO 17 N 3.82 0.00 0.00 2.79 -0.02 -1.26 0.13 135.00 140.46 2ii7 n PRO 17 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 2ii7 n PRO 17 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 2ii7 n PRO 17 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2ii7 n PRO 25 N 0.00 0.00 0.00 0.52 -0.02 -1.26 -4.59 135.00 129.65 2ii7 n PRO 25 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2ii7 n PRO 25 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2ii7 n PRO 25 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2ii7 n GLN 26 N 1.75 0.28 0.00 -0.52 -0.06 -1.26 -4.74 117.38 112.84 2ii7 n GLN 26 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 2ii7 n GLN 26 Cb 0.00 -0.96 0.00 0.00 -4.06 0.00 0.00 30.24 25.22 2ii7 n GLN 26 CO 0.00 0.00 0.00 1.97 -0.20 0.00 0.00 177.06 178.83 2ii7 n PHE 27 N -2.37 0.00 -4.18 3.69 -1.74 -1.26 -4.74 117.46 106.86 2ii7 n PHE 27 Ca 0.00 0.00 -0.35 0.00 -0.56 0.00 0.00 57.45 56.54 2ii7 n PHE 27 Cb 0.46 -0.01 -0.09 0.00 1.52 0.00 0.00 39.48 41.36 2ii7 n PHE 27 CO 0.00 0.00 0.00 0.42 -0.56 0.00 0.00 176.76 176.62 2ii7 s ILE 28 N -1.86 4.68 0.31 1.97 1.09 -1.26 -4.96 121.20 121.17 2ii7 s ILE 28 Ca 0.00 -0.10 0.07 0.00 -1.10 0.00 0.00 60.65 59.53 2ii7 s ILE 28 Cb 0.00 -3.02 -0.03 0.00 -1.06 0.00 0.00 42.46 38.35 2ii7 s ILE 28 CO 0.00 0.58 0.27 -0.94 -0.10 0.00 0.00 174.94 174.75 2ii7 s SER 29 N -0.61 5.40 0.01 3.58 1.04 -1.26 -5.04 113.70 116.81 2ii7 s SER 29 Ca 0.11 -0.40 -0.00 0.00 0.48 0.00 0.00 55.95 56.13 2ii7 s SER 29 Cb -0.12 -1.12 0.00 0.00 0.10 0.00 0.00 66.02 64.88 2ii7 s SER 29 CO 0.02 -0.26 0.02 0.00 0.98 0.00 0.00 173.24 174.00 2ii7 n HIS 30 N -1.33 -0.57 -1.43 5.02 1.44 -1.26 -4.97 115.22 112.11 2ii7 n HIS 30 Ca -0.04 -0.06 -0.13 0.00 -2.01 0.00 0.00 57.72 55.48 2ii7 n HIS 30 Cb 0.59 0.02 -0.11 0.00 0.12 0.00 0.00 29.99 30.61 2ii7 n HIS 30 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 2ii7 n GLU 31 N -0.02 0.19 -4.32 -1.40 -0.58 -1.26 -4.87 120.64 108.38 2ii7 n GLU 31 Ca -0.00 -0.61 -0.21 0.00 -0.42 0.00 0.00 57.16 55.91 2ii7 n GLU 31 Cb 0.02 -2.43 -0.13 0.00 -0.57 0.00 0.00 31.44 28.33 2ii7 n GLU 31 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2ii7 s THR 32 N 8.14 1.31 -0.31 2.62 2.01 -1.26 -1.08 115.64 127.07 2ii7 s THR 32 Ca 0.83 -1.24 -0.01 0.00 0.31 0.00 0.00 61.69 61.58 2ii7 s THR 32 Cb -0.30 -1.20 0.06 0.00 0.01 0.00 0.00 72.50 71.07 2ii7 s THR 32 CO 0.23 -0.05 0.02 -0.69 -0.69 0.00 0.00 174.62 173.43 2ii7 s VAL 33 N -1.04 2.91 -0.14 3.82 1.01 0.87 -4.54 120.40 123.29 2ii7 s VAL 33 Ca 0.02 -1.54 -0.18 0.00 0.00 0.00 0.00 61.98 60.28 2ii7 s VAL 33 Cb -0.09 -2.74 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 2ii7 s VAL 33 CO 0.02 -0.19 0.49 0.00 0.00 0.00 0.00 175.10 175.42 2ii7 s ILE 35 N 0.88 1.95 0.00 0.00 1.01 -0.46 -1.50 121.20 123.09 2ii7 s ILE 35 Ca 0.26 -1.39 0.05 0.00 0.00 0.00 0.00 60.65 59.57 2ii7 s ILE 35 Cb -0.15 -1.69 -0.02 0.00 0.01 0.00 0.00 42.46 40.61 2ii7 s ILE 35 CO 0.10 0.23 -0.16 -0.22 0.00 0.00 0.00 174.94 174.90 2ii7 s LEU 36 N -1.39 2.07 -0.41 2.97 2.96 -0.26 -0.59 118.68 124.03 2ii7 s LEU 36 Ca 0.10 -0.34 0.01 0.00 -0.22 0.00 0.00 54.13 53.68 2ii7 s LEU 36 Cb -0.10 -0.79 0.14 0.00 0.50 0.00 0.00 46.19 45.95 2ii7 s LEU 36 CO 0.03 0.16 0.24 0.21 -1.32 0.00 0.00 176.35 175.67 2ii7 s ASN 37 N -0.60 3.26 0.00 3.68 3.04 -0.04 -1.40 114.94 122.88 2ii7 s ASN 37 Ca 0.05 -2.51 0.09 0.00 0.04 0.00 0.00 52.86 50.53 2ii7 s ASN 37 Cb -0.07 -0.75 0.36 0.00 -1.54 0.00 0.00 41.25 39.25 2ii7 s ASN 37 CO 0.00 -0.27 1.26 0.00 -3.04 0.00 0.00 177.10 175.05 2ii7 n ALA 38 N 3.66 2.50 -1.95 1.71 0.00 -1.26 -0.60 120.51 124.58 2ii7 n ALA 38 Ca 0.12 -0.27 -0.28 0.00 0.00 0.00 0.00 53.44 53.01 2ii7 n ALA 38 Cb 0.36 -1.05 0.15 0.00 0.00 0.00 0.00 19.45 18.91 2ii7 n ALA 38 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2ii7 s GLY 39 N -1.16 1.76 0.00 0.00 0.00 -1.14 -3.62 107.32 103.15 2ii7 s GLY 39 Ca 0.16 -1.28 0.25 0.00 0.00 0.00 0.00 44.72 43.84 2ii7 s GLY 39 CO 0.12 -0.62 1.37 1.22 0.00 0.00 0.00 173.10 175.19 2ii7 n ASP 40 N -3.42 2.04 -4.37 1.64 8.00 -1.26 -0.52 116.55 118.65 2ii7 n ASP 40 Ca 0.14 -1.55 -0.32 0.00 0.71 0.00 0.00 54.79 53.77 2ii7 n ASP 40 Cb 0.60 0.17 -0.15 0.00 -0.02 0.00 0.00 41.12 41.72 2ii7 n ASP 40 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2ii7 s GLU 41 N -2.24 2.58 0.43 -1.24 2.12 -1.26 -4.80 118.70 114.30 2ii7 s GLU 41 Ca 0.27 -0.79 -0.25 0.00 0.36 0.00 0.00 54.97 54.55 2ii7 s GLU 41 Cb 0.19 -2.30 -0.09 0.00 0.26 0.00 0.00 34.13 32.19 2ii7 s GLU 41 CO 0.43 0.48 1.23 -0.25 -0.54 0.00 0.00 175.26 176.61 2ii7 n ASP 42 N 2.69 2.33 -4.52 -1.70 9.92 -1.26 -4.20 116.55 119.80 2ii7 n ASP 42 Ca -0.17 1.08 -0.39 0.00 -0.53 0.00 0.00 54.79 54.78 2ii7 n ASP 42 Cb 0.52 -1.48 -0.11 0.00 -0.64 0.00 0.00 41.12 39.41 2ii7 n ASP 42 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2ii7 s ALA 43 N -1.22 3.45 -0.86 2.24 0.00 0.19 -4.82 121.76 120.74 2ii7 s ALA 43 Ca 0.62 -1.28 -0.16 0.00 0.00 0.00 0.00 51.96 51.14 2ii7 s ALA 43 Cb -0.51 -2.52 0.17 0.00 0.00 0.00 0.00 23.12 20.27 2ii7 s ALA 43 CO 0.57 -0.80 0.92 -1.01 0.00 0.00 0.00 175.76 175.44 2ii7 s HIS 44 N 1.71 3.42 0.28 0.00 3.76 -1.26 -0.30 115.29 122.89 2ii7 s HIS 44 Ca 0.06 -1.65 -0.28 0.00 -0.15 0.00 0.00 55.06 53.04 2ii7 s HIS 44 Cb -0.17 -4.04 -0.09 0.00 1.11 0.00 0.00 32.58 29.39 2ii7 s HIS 44 CO 0.09 -1.24 0.97 0.08 -0.85 0.00 0.00 174.74 173.79 2ii7 s VAL 45 N 1.48 4.03 -0.12 -0.90 1.01 -0.27 -3.72 120.40 121.91 2ii7 s VAL 45 Ca 0.24 1.88 -0.01 0.00 0.00 0.00 0.00 61.98 64.09 2ii7 s VAL 45 Cb -0.09 -4.14 0.03 0.00 0.00 0.00 0.00 36.38 32.19 2ii7 s VAL 45 CO -0.08 0.33 -0.04 -1.61 0.00 0.00 0.00 175.10 173.69 2ii7 s GLU 46 N -1.59 1.22 -0.11 2.72 2.02 0.21 -2.14 118.70 121.02 2ii7 s GLU 46 Ca 0.46 -0.23 -0.04 0.00 0.02 0.00 0.00 54.97 55.18 2ii7 s GLU 46 Cb -0.24 -1.56 -0.03 0.00 0.10 0.00 0.00 34.13 32.40 2ii7 s GLU 46 CO 0.30 -0.33 0.03 0.42 0.02 0.00 0.00 175.26 175.69 2ii7 s ILE 47 N 1.77 4.52 -0.07 -1.63 1.01 -0.71 -1.58 121.20 124.51 2ii7 s ILE 47 Ca 0.04 -0.16 0.05 0.00 0.00 0.00 0.00 60.65 60.58 2ii7 s ILE 47 Cb -0.13 -2.94 -0.00 0.00 0.01 0.00 0.00 42.46 39.39 2ii7 s ILE 47 CO -0.07 0.57 -0.22 -0.89 0.00 0.00 0.00 174.94 174.33 2ii7 s THR 48 N -0.56 1.85 -0.15 2.92 2.01 -0.37 -0.59 115.64 120.75 2ii7 s THR 48 Ca 0.10 -0.92 -0.05 0.00 0.31 0.00 0.00 61.69 61.12 2ii7 s THR 48 Cb -0.12 -1.59 -0.04 0.00 0.01 0.00 0.00 72.50 70.77 2ii7 s THR 48 CO 0.02 0.52 0.03 -0.63 -0.69 0.00 0.00 174.62 173.87 2ii7 s ILE 49 N 0.15 4.54 0.10 1.82 -1.09 -1.22 -0.94 121.20 124.55 2ii7 s ILE 49 Ca -0.11 -0.13 0.07 0.00 -2.23 0.00 0.00 60.65 58.25 2ii7 s ILE 49 Cb -0.15 -3.00 -0.04 0.00 -1.58 0.00 0.00 42.46 37.69 2ii7 s ILE 49 CO 0.05 0.51 -0.12 -0.31 -1.23 0.00 0.00 174.94 173.84 2ii7 s TYR 50 N -0.03 2.68 0.39 3.97 1.51 0.18 -1.71 117.35 124.35 2ii7 s TYR 50 Ca 0.05 -0.18 0.05 0.00 -1.01 0.00 0.00 57.07 55.97 2ii7 s TYR 50 Cb -0.12 -1.43 -0.06 0.00 -0.11 0.00 0.00 41.96 40.24 2ii7 s TYR 50 CO 0.01 0.40 0.04 0.71 -1.11 0.00 0.00 175.55 175.60 2ii7 s TYR 51 N -1.16 2.13 -0.45 2.71 2.02 -1.26 -0.97 117.35 120.38 2ii7 s TYR 51 Ca 0.20 -0.89 0.23 0.00 -0.37 0.00 0.00 57.07 56.24 2ii7 s TYR 51 Cb -0.11 -1.50 0.21 0.00 -0.40 0.00 0.00 41.96 40.16 2ii7 s TYR 51 CO 0.12 0.17 1.25 0.66 -1.57 0.00 0.00 175.55 176.17 2ii7 h SER 52 N 1.83 0.00 0.00 2.29 4.64 -1.99 -3.41 113.55 116.92 2ii7 h SER 52 Ca -0.42 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 2ii7 h SER 52 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2ii7 h SER 52 CO 0.73 0.05 -0.60 -0.90 -0.87 0.00 0.00 176.83 175.24 2ii7 n ASP 53 N -2.47 3.00 -4.50 4.97 5.68 -1.26 -5.10 116.55 116.87 2ii7 n ASP 53 Ca 0.02 0.00 -0.24 0.00 -0.50 0.00 0.00 54.79 54.07 2ii7 n ASP 53 Cb 0.50 0.59 -0.10 0.00 -1.14 0.00 0.00 41.12 40.96 2ii7 n ASP 53 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 2ii7 s LYS 54 N -1.22 1.72 0.97 0.11 -2.85 -1.26 -5.14 119.74 112.08 2ii7 s LYS 54 Ca 0.00 -1.87 -0.11 0.00 -1.00 0.00 0.00 55.97 52.99 2ii7 s LYS 54 Cb 0.00 -1.55 0.17 0.00 -2.06 0.00 0.00 37.83 34.39 2ii7 s LYS 54 CO 0.00 0.13 1.10 -1.21 0.10 0.00 0.00 175.35 175.48 2ii7 s GLU 55 N -3.63 0.62 0.46 1.78 0.41 -1.26 -4.13 118.70 112.94 2ii7 s GLU 55 Ca 0.31 1.26 -0.24 0.00 -0.41 0.00 0.00 54.97 55.89 2ii7 s GLU 55 Cb 0.02 -1.70 -0.08 0.00 -1.78 0.00 0.00 34.13 30.59 2ii7 s GLU 55 CO 0.15 -2.81 1.33 -2.14 -0.49 0.00 0.00 175.26 171.30 2ii7 s PRO 56 N -4.65 3.67 -0.27 0.39 0.02 -1.26 -4.67 135.00 128.23 2ii7 s PRO 56 Ca 0.66 2.20 -0.18 0.00 0.02 0.00 0.00 61.00 63.71 2ii7 s PRO 56 Cb -0.22 -2.57 -0.02 0.00 0.02 0.00 0.00 34.50 31.70 2ii7 s PRO 56 CO 0.59 -0.75 0.52 0.08 -0.33 0.00 0.00 177.00 177.11 2ii7 s VAL 57 N -1.29 5.06 0.00 3.83 1.01 -0.69 -4.98 120.40 123.34 2ii7 s VAL 57 Ca 0.62 0.83 0.00 0.00 0.00 0.00 0.00 61.98 63.44 2ii7 s VAL 57 Cb -0.39 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.15 2ii7 s VAL 57 CO 0.49 0.05 0.00 0.61 0.00 0.00 0.00 175.10 176.25 2ii7 n GLY 58 N 4.43 0.00 3.63 4.51 0.00 -1.26 -3.46 105.19 113.04 2ii7 n GLY 58 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 2ii7 n GLY 58 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2ii7 s PRO 59 N 0.00 3.69 -0.61 1.61 0.02 -1.26 -4.58 135.00 133.86 2ii7 s PRO 59 Ca 0.00 1.93 -0.21 0.00 0.02 0.00 0.00 61.00 62.74 2ii7 s PRO 59 Cb 0.00 -4.15 0.08 0.00 0.02 0.00 0.00 34.50 30.46 2ii7 s PRO 59 CO 0.00 -1.44 0.82 0.71 -0.33 0.00 0.00 177.00 176.76 2ii7 s TYR 60 N 5.86 2.85 0.64 6.54 1.51 0.25 -4.48 117.35 130.51 2ii7 s TYR 60 Ca 0.82 -0.72 -0.13 0.00 -1.01 0.00 0.00 57.07 56.03 2ii7 s TYR 60 Cb -0.30 -4.11 -0.02 0.00 -0.11 0.00 0.00 41.96 37.42 2ii7 s TYR 60 CO 0.33 -1.44 1.05 1.03 -1.11 0.00 0.00 175.55 175.41 2ii7 s ARG 61 N 3.33 3.22 -0.24 -0.62 0.52 -1.26 -1.74 118.95 122.16 2ii7 s ARG 61 Ca 0.17 1.01 -0.32 0.00 -0.52 0.00 0.00 55.73 56.07 2ii7 s ARG 61 Cb -0.20 -2.03 0.16 0.00 0.52 0.00 0.00 34.95 33.41 2ii7 s ARG 61 CO 0.09 -0.88 1.27 -1.17 0.02 0.00 0.00 175.30 174.63 2ii7 s LEU 62 N -5.05 -0.11 0.01 2.53 0.20 -0.91 -4.96 118.68 110.39 2ii7 s LEU 62 Ca 0.59 0.08 0.06 0.00 0.69 0.00 0.00 54.13 55.55 2ii7 s LEU 62 Cb -0.14 1.27 -0.02 0.00 -0.43 0.00 0.00 46.19 46.88 2ii7 s LEU 62 CO 0.47 -0.13 -0.18 -0.89 -0.29 0.00 0.00 176.35 175.33 2ii7 s THR 63 N -1.54 1.45 -0.25 3.68 2.01 -1.26 -1.11 115.64 118.61 2ii7 s THR 63 Ca 0.08 -0.91 0.02 0.00 0.31 0.00 0.00 61.69 61.18 2ii7 s THR 63 Cb -0.01 -1.23 0.06 0.00 0.01 0.00 0.00 72.50 71.33 2ii7 s THR 63 CO -0.05 0.30 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.43 2ii7 s VAL 64 N -0.57 1.79 0.57 3.82 1.01 0.59 -4.97 120.40 122.64 2ii7 s VAL 64 Ca 0.06 -1.46 -0.20 0.00 0.00 0.00 0.00 61.98 60.38 2ii7 s VAL 64 Cb -0.08 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 2ii7 s VAL 64 CO 0.00 -0.13 1.24 -2.65 0.00 0.00 0.00 175.10 173.57 2ii7 n PRO 65 N 4.56 1.39 -1.55 2.72 -0.02 -1.26 0.56 135.00 141.40 2ii7 n PRO 65 Ca -0.11 0.52 -0.42 0.00 -2.02 0.00 0.00 63.50 61.47 2ii7 n PRO 65 Cb 0.43 -2.45 0.01 0.00 -0.02 0.00 0.00 33.50 31.47 2ii7 n PRO 65 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ii7 n ALA 66 N -1.32 -0.49 -3.95 3.55 0.00 -1.26 -2.22 120.51 114.81 2ii7 n ALA 66 Ca 0.12 0.21 -0.28 0.00 0.00 0.00 0.00 53.44 53.50 2ii7 n ALA 66 Cb 0.45 -1.96 -0.00 0.00 0.00 0.00 0.00 19.45 17.94 2ii7 n ALA 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2ii7 n ARG 67 N 0.31 -4.04 -3.94 0.00 1.74 0.32 -4.96 116.66 106.08 2ii7 n ARG 67 Ca 0.11 0.48 -0.09 0.00 -0.77 0.00 0.00 57.85 57.58 2ii7 n ARG 67 Cb 0.39 -4.97 -0.08 0.00 -1.02 0.00 0.00 32.46 26.78 2ii7 n ARG 67 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2ii7 s ARG 68 N -6.54 0.92 0.45 5.56 1.81 -0.65 -4.97 118.95 115.53 2ii7 s ARG 68 Ca 0.29 -1.10 0.06 0.00 -1.72 0.00 0.00 55.73 53.26 2ii7 s ARG 68 Cb -0.15 0.33 -0.04 0.00 -0.45 0.00 0.00 34.95 34.63 2ii7 s ARG 68 CO 0.87 -0.30 0.13 -0.08 -0.68 0.00 0.00 175.30 175.24 2ii7 s THR 69 N -3.92 1.92 -0.30 0.02 -1.32 -1.26 -0.86 115.64 109.92 2ii7 s THR 69 Ca 0.11 -1.81 -0.15 0.00 -1.21 0.00 0.00 61.69 58.63 2ii7 s THR 69 Cb 0.05 -2.72 0.17 0.00 -1.51 0.00 0.00 72.50 68.49 2ii7 s THR 69 CO -0.06 0.00 1.04 -0.75 -2.21 0.00 0.00 174.62 172.64 2ii7 s LYS 70 N -3.90 0.23 -0.03 7.08 2.20 0.24 -4.93 119.74 120.63 2ii7 s LYS 70 Ca 0.32 0.53 -0.20 0.00 -0.36 0.00 0.00 55.97 56.25 2ii7 s LYS 70 Cb 0.04 0.31 -0.05 0.00 -1.51 0.00 0.00 37.83 36.63 2ii7 s LYS 70 CO 0.17 -0.13 0.58 -1.01 -0.36 0.00 0.00 175.35 174.61 2ii7 s HIS 71 N 2.53 3.64 -0.18 4.03 3.76 -1.26 -1.35 115.29 126.46 2ii7 s HIS 71 Ca -0.01 1.15 0.01 0.00 -0.15 0.00 0.00 55.06 56.06 2ii7 s HIS 71 Cb -0.07 -2.62 0.03 0.00 1.11 0.00 0.00 32.58 31.04 2ii7 s HIS 71 CO -0.16 0.30 -0.13 0.08 -0.85 0.00 0.00 174.74 173.98 2ii7 s VAL 72 N 0.04 1.73 -0.01 -0.90 1.01 0.01 -4.94 120.40 117.35 2ii7 s VAL 72 Ca 0.31 -0.92 -0.30 0.00 0.00 0.00 0.00 61.98 61.07 2ii7 s VAL 72 Cb -0.18 -1.71 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 2ii7 s VAL 72 CO 0.16 0.31 0.99 -0.13 0.00 0.00 0.00 175.10 176.43 2ii7 s ARG 73 N 1.39 4.55 0.35 2.72 0.52 -1.26 -0.09 118.95 127.12 2ii7 s ARG 73 Ca 0.01 1.43 0.04 0.00 -0.52 0.00 0.00 55.73 56.69 2ii7 s ARG 73 Cb -0.15 -3.46 0.66 0.00 0.52 0.00 0.00 34.95 32.52 2ii7 s ARG 73 CO -0.10 -0.07 1.94 0.74 0.02 0.00 0.00 175.30 177.83 2ii7 h PHE 74 N 6.82 0.61 -0.44 -0.53 0.04 -1.48 -1.84 116.94 120.12 2ii7 h PHE 74 Ca -0.40 -0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.36 2ii7 h PHE 74 Cb 1.21 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 39.15 2ii7 h PHE 74 CO 0.68 0.49 0.29 -0.97 -0.60 0.00 0.00 178.31 178.20 2ii7 h ASN 75 N 0.61 0.45 0.59 2.17 -0.73 -1.91 -1.27 115.58 115.49 2ii7 h ASN 75 Ca 0.15 -0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.31 2ii7 h ASN 75 Cb 0.15 -0.11 0.00 0.00 0.27 0.00 0.00 38.32 38.63 2ii7 h ASN 75 CO -0.01 0.32 0.00 0.47 -0.37 0.00 0.00 177.43 177.84 2ii7 n ASP 76 N -4.48 0.00 -4.74 1.15 9.92 -0.69 -4.75 116.55 112.96 2ii7 n ASP 76 Ca 0.04 0.32 -0.41 0.00 -0.53 0.00 0.00 54.79 54.22 2ii7 n ASP 76 Cb 0.11 -0.43 -0.04 0.00 -0.64 0.00 0.00 41.12 40.12 2ii7 n ASP 76 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2ii7 s LEU 77 N -2.85 4.49 0.00 0.64 1.02 -0.48 -4.87 118.68 116.62 2ii7 s LEU 77 Ca 0.13 2.18 0.00 0.00 0.02 0.00 0.00 54.13 56.46 2ii7 s LEU 77 Cb 0.14 -3.61 0.00 0.00 0.02 0.00 0.00 46.19 42.74 2ii7 s LEU 77 CO 0.35 -0.26 0.00 -0.46 0.02 0.00 0.00 176.35 176.00 2ii7 n ASN 78 N 2.18 0.00 -4.39 2.29 0.23 -1.26 -4.12 115.26 110.20 2ii7 n ASN 78 Ca 0.03 0.00 -0.34 0.00 -0.53 0.00 0.00 54.58 53.74 2ii7 n ASN 78 Cb 0.45 0.00 -0.14 0.00 -2.08 0.00 0.00 39.78 38.02 2ii7 n ASN 78 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2ii7 s ASP 79 N -0.70 4.26 0.27 0.53 2.15 -1.26 -0.38 116.67 121.55 2ii7 s ASP 79 Ca 0.00 -0.29 -0.01 0.00 0.43 0.00 0.00 52.55 52.67 2ii7 s ASP 79 Cb 0.00 -1.68 0.47 0.00 -0.30 0.00 0.00 42.92 41.41 2ii7 s ASP 79 CO 0.00 0.12 1.84 -0.65 -0.17 0.00 0.00 175.17 176.31 2ii7 h PRO 80 N 7.03 0.96 -3.45 4.34 0.11 -1.88 -3.41 132.00 135.70 2ii7 h PRO 80 Ca -0.31 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.69 2ii7 h PRO 80 Cb 1.19 -0.22 -0.12 0.00 0.11 0.00 0.00 31.00 31.97 2ii7 h PRO 80 CO 0.59 0.64 -0.09 0.00 -0.21 0.00 0.00 178.00 178.92 2ii7 s ALA 81 N -6.00 -0.78 0.56 -0.75 0.00 0.49 -5.14 121.76 110.14 2ii7 s ALA 81 Ca -0.12 -0.23 -0.17 0.00 0.00 0.00 0.00 51.96 51.43 2ii7 s ALA 81 Cb 0.21 0.74 -0.05 0.00 0.00 0.00 0.00 23.12 24.02 2ii7 s ALA 81 CO 0.80 -0.68 1.06 -2.14 0.00 0.00 0.00 175.76 174.81 2ii7 s PRO 82 N -3.85 3.42 -0.23 0.00 0.02 -1.11 -4.01 135.00 129.25 2ii7 s PRO 82 Ca 0.06 1.31 -0.24 0.00 0.02 0.00 0.00 61.00 62.16 2ii7 s PRO 82 Cb 0.01 -2.04 -0.01 0.00 0.02 0.00 0.00 34.50 32.48 2ii7 s PRO 82 CO -0.08 -0.74 0.80 0.42 -0.33 0.00 0.00 177.00 177.07 2ii7 s ILE 83 N -2.22 4.87 -0.06 2.83 1.09 -1.26 -4.98 121.20 121.46 2ii7 s ILE 83 Ca 0.66 1.53 -0.37 0.00 -1.10 0.00 0.00 60.65 61.37 2ii7 s ILE 83 Cb -0.17 -4.10 -0.15 0.00 -1.06 0.00 0.00 42.46 36.98 2ii7 s ILE 83 CO 0.31 -0.03 1.62 -2.65 -0.10 0.00 0.00 174.94 174.09 2ii7 n PRO 84 N 5.77 1.52 -1.34 2.79 -0.02 -1.26 -4.94 135.00 137.51 2ii7 n PRO 84 Ca 0.05 0.55 -0.29 0.00 -2.02 0.00 0.00 63.50 61.79 2ii7 n PRO 84 Cb 0.48 -2.27 0.17 0.00 -0.02 0.00 0.00 33.50 31.86 2ii7 n PRO 84 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2ii7 s HIS 85 N 2.30 2.10 -1.65 6.00 3.76 -1.26 -3.67 115.29 122.86 2ii7 s HIS 85 Ca 0.90 0.85 -0.15 0.00 -0.15 0.00 0.00 55.06 56.51 2ii7 s HIS 85 Cb -0.90 -3.37 0.13 0.00 1.11 0.00 0.00 32.58 29.55 2ii7 s HIS 85 CO 0.53 -2.78 0.68 -3.47 -0.85 0.00 0.00 174.74 168.85 2ii7 n ASP 86 N -4.06 -2.55 -3.80 1.40 -0.08 0.12 -4.94 116.55 102.65 2ii7 n ASP 86 Ca 0.07 -1.03 -0.18 0.00 -1.51 0.00 0.00 54.79 52.13 2ii7 n ASP 86 Cb 0.58 -2.71 -0.17 0.00 2.34 0.00 0.00 41.12 41.17 2ii7 n ASP 86 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2ii7 s THR 87 N -3.45 0.17 -0.15 5.18 2.01 -1.24 -5.03 115.64 113.13 2ii7 s THR 87 Ca 0.58 0.13 -0.29 0.00 0.31 0.00 0.00 61.69 62.42 2ii7 s THR 87 Cb -0.32 -0.30 -0.01 0.00 0.01 0.00 0.00 72.50 71.88 2ii7 s THR 87 CO 0.93 0.16 1.16 -1.81 -0.69 0.00 0.00 174.62 174.37 2ii7 s ASP 88 N 1.28 7.05 0.35 3.53 1.01 -1.26 -4.37 116.67 124.25 2ii7 s ASP 88 Ca -0.06 1.62 0.04 0.00 0.71 0.00 0.00 52.55 54.86 2ii7 s ASP 88 Cb -0.13 -2.55 -0.02 0.00 1.01 0.00 0.00 42.92 41.24 2ii7 s ASP 88 CO -0.02 -0.66 0.15 2.22 0.21 0.00 0.00 175.17 177.07 2ii7 n PHE 89 N 6.00 -0.04 -4.00 4.23 -1.74 -0.22 -4.32 117.46 117.37 2ii7 n PHE 89 Ca 0.12 -2.34 -0.10 0.00 -0.56 0.00 0.00 57.45 54.57 2ii7 n PHE 89 Cb 0.46 0.05 -0.08 0.00 1.52 0.00 0.00 39.48 41.43 2ii7 n PHE 89 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2ii7 s ALA 90 N -3.02 0.19 0.09 1.98 0.00 -0.14 -1.60 121.76 119.27 2ii7 s ALA 90 Ca 0.21 -1.02 -0.07 0.00 0.00 0.00 0.00 51.96 51.09 2ii7 s ALA 90 Cb 0.01 0.86 -0.01 0.00 0.00 0.00 0.00 23.12 23.97 2ii7 s ALA 90 CO 0.15 -0.61 0.15 -1.54 0.00 0.00 0.00 175.76 173.91 2ii7 s SER 91 N -2.98 0.20 -0.09 0.00 1.04 -0.16 0.51 113.70 112.22 2ii7 s SER 91 Ca 0.19 -0.80 0.01 0.00 0.48 0.00 0.00 55.95 55.83 2ii7 s SER 91 Cb 0.04 0.32 0.02 0.00 0.10 0.00 0.00 66.02 66.50 2ii7 s SER 91 CO 0.00 -0.73 -0.11 -0.69 0.98 0.00 0.00 173.24 172.70 2ii7 s VAL 92 N -3.90 1.15 -0.18 5.02 1.01 -0.12 -0.53 120.40 122.85 2ii7 s VAL 92 Ca 0.09 -0.43 -0.03 0.00 0.00 0.00 0.00 61.98 61.61 2ii7 s VAL 92 Cb 0.05 -1.09 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 2ii7 s VAL 92 CO -0.08 0.37 -0.06 -0.63 0.00 0.00 0.00 175.10 174.70 2ii7 s ILE 93 N 1.13 3.48 0.17 2.22 1.09 0.15 -1.24 121.20 128.21 2ii7 s ILE 93 Ca -0.05 -0.48 0.09 0.00 -1.10 0.00 0.00 60.65 59.10 2ii7 s ILE 93 Cb -0.14 -2.54 -0.04 0.00 -1.06 0.00 0.00 42.46 38.68 2ii7 s ILE 93 CO -0.02 0.47 -0.18 -1.10 -0.10 0.00 0.00 174.94 174.00 2ii7 s GLN 94 N 0.84 1.29 0.13 2.79 -0.21 -0.62 0.03 119.66 123.92 2ii7 s GLN 94 Ca -0.02 -1.42 -0.08 0.00 0.02 0.00 0.00 55.36 53.86 2ii7 s GLN 94 Cb -0.15 -1.35 -0.01 0.00 1.00 0.00 0.00 33.01 32.50 2ii7 s GLN 94 CO 0.01 0.27 0.23 0.45 -2.12 0.00 0.00 175.29 174.13 2ii7 s SER 95 N -2.70 0.09 0.27 5.90 0.15 -0.50 -0.62 113.70 116.29 2ii7 s SER 95 Ca 0.16 -0.80 0.20 0.00 0.70 0.00 0.00 55.95 56.21 2ii7 s SER 95 Cb -0.06 0.38 0.10 0.00 -1.71 0.00 0.00 66.02 64.74 2ii7 s SER 95 CO 0.07 -0.81 1.28 -0.55 1.20 0.00 0.00 173.24 174.42 2ii7 h ASN 96 N 2.65 0.00 -4.20 5.45 -1.07 -1.88 -3.45 115.58 113.08 2ii7 h ASN 96 Ca -0.33 0.00 -0.36 0.00 0.07 0.00 0.00 56.30 55.68 2ii7 h ASN 96 Cb 1.21 0.00 -0.18 0.00 -2.07 0.00 0.00 38.32 37.29 2ii7 h ASN 96 CO 0.52 0.20 -0.74 0.68 0.07 0.00 0.00 177.43 178.16 2ii7 s VAL 97 N -3.16 1.12 0.18 6.14 -7.23 -1.26 -5.05 120.40 111.14 2ii7 s VAL 97 Ca 0.02 -1.71 -0.33 0.00 -1.81 0.00 0.00 61.98 58.16 2ii7 s VAL 97 Cb 0.08 -1.47 -0.13 0.00 0.56 0.00 0.00 36.38 35.41 2ii7 s VAL 97 CO 0.75 -0.52 1.59 -2.65 -0.31 0.00 0.00 175.10 173.96 2ii7 n PRO 98 N 0.48 2.30 -4.20 4.82 -0.02 -1.26 -4.60 135.00 132.51 2ii7 n PRO 98 Ca -0.15 0.83 -0.12 0.00 -2.02 0.00 0.00 63.50 62.04 2ii7 n PRO 98 Cb 0.58 -2.60 -0.10 0.00 -0.02 0.00 0.00 33.50 31.35 2ii7 n PRO 98 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 2ii7 s ILE 99 N 0.83 0.46 -0.16 4.25 -4.36 -0.54 -4.75 121.20 116.93 2ii7 s ILE 99 Ca 0.76 -1.94 -0.02 0.00 -0.26 0.00 0.00 60.65 59.19 2ii7 s ILE 99 Cb -0.63 -2.02 -0.02 0.00 1.25 0.00 0.00 42.46 41.04 2ii7 s ILE 99 CO 0.38 -0.54 -0.08 -0.69 0.24 0.00 0.00 174.94 174.26 2ii7 s VAL 100 N -3.80 3.41 -0.08 8.37 1.01 -0.49 -1.73 120.40 127.08 2ii7 s VAL 100 Ca 0.22 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 61.72 2ii7 s VAL 100 Cb 0.07 -2.49 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 2ii7 s VAL 100 CO 0.02 0.49 -0.23 -0.69 0.00 0.00 0.00 175.10 174.68 2ii7 s VAL 101 N 0.68 2.22 -0.01 2.92 1.01 -1.26 -1.10 120.40 124.86 2ii7 s VAL 101 Ca -0.04 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 60.97 2ii7 s VAL 101 Cb -0.15 -1.84 0.01 0.00 0.00 0.00 0.00 36.38 34.40 2ii7 s VAL 101 CO 0.02 0.56 -0.02 -1.58 0.00 0.00 0.00 175.10 174.08 2ii7 s GLN 102 N 0.09 0.31 -0.01 2.72 0.74 -0.56 -5.01 119.66 117.94 2ii7 s GLN 102 Ca -0.11 -0.06 -0.01 0.00 0.05 0.00 0.00 55.36 55.24 2ii7 s GLN 102 Cb -0.16 -0.37 0.01 0.00 1.10 0.00 0.00 33.01 33.59 2ii7 s GLN 102 CO 0.06 0.00 0.03 -1.58 -0.55 0.00 0.00 175.29 173.25 2ii7 s HIS 103 N 0.32 -0.03 -0.01 1.67 5.65 -1.26 -1.49 115.29 120.14 2ii7 s HIS 103 Ca -0.03 0.08 -0.24 0.00 0.25 0.00 0.00 55.06 55.12 2ii7 s HIS 103 Cb -0.06 -0.01 -0.04 0.00 -1.18 0.00 0.00 32.58 31.28 2ii7 s HIS 103 CO -0.01 -0.02 0.75 0.99 -0.65 0.00 0.00 174.74 175.80 2ii7 s THR 104 N 0.12 4.89 -0.14 0.89 2.01 -1.26 -4.97 115.64 117.18 2ii7 s THR 104 Ca -0.01 1.56 -0.29 0.00 0.31 0.00 0.00 61.69 63.27 2ii7 s THR 104 Cb -0.01 -4.09 -0.06 0.00 0.01 0.00 0.00 72.50 68.35 2ii7 s THR 104 CO -0.00 0.30 2.10 0.00 -0.69 0.00 0.00 174.62 176.33 2ii7 s ARG 105 N 0.41 3.48 0.03 4.92 1.70 -1.26 -4.78 118.95 123.45 2ii7 s ARG 105 Ca 0.39 2.18 -0.05 0.00 -0.47 0.00 0.00 55.73 57.78 2ii7 s ARG 105 Cb -0.19 -4.29 -0.00 0.00 -0.57 0.00 0.00 34.95 29.90 2ii7 s ARG 105 CO 0.21 -1.70 0.26 -0.11 -1.08 0.00 0.00 175.30 172.88 2ii7 n LEU 106 N 10.19 -0.16 0.05 -1.89 7.94 -1.26 0.47 117.00 132.34 2ii7 n LEU 106 Ca 0.26 0.30 -0.11 0.00 -1.11 0.00 0.00 56.01 55.34 2ii7 n LEU 106 Cb 0.44 -0.05 -0.05 0.00 0.53 0.00 0.00 43.42 44.30 2ii7 n LEU 106 CO 0.67 -0.25 0.66 -2.24 -1.11 0.00 0.00 177.39 175.12 2ii7 h ASP 107 N 0.00 -0.89 -0.94 1.96 2.03 -2.00 -1.45 116.42 115.12 2ii7 h ASP 107 Ca 0.03 0.12 0.11 0.00 -0.73 0.00 0.00 57.03 56.57 2ii7 h ASP 107 Cb 0.08 0.37 -0.08 0.00 -0.83 0.00 0.00 39.33 38.86 2ii7 h ASP 107 CO -0.16 -0.36 0.57 0.77 -1.03 0.00 0.00 179.24 179.03 2ii7 h SER 108 N -0.43 0.83 0.83 4.15 4.64 -0.34 -0.77 113.55 122.45 2ii7 h SER 108 Ca 0.07 0.05 -0.04 0.00 -0.47 0.00 0.00 61.79 61.40 2ii7 h SER 108 Cb 0.53 -0.11 0.01 0.00 -0.31 0.00 0.00 62.40 62.51 2ii7 h SER 108 CO -0.27 0.45 -0.42 -0.09 -0.87 0.00 0.00 176.83 175.63 2ii7 h ARG 109 N 0.91 -1.10 -0.83 4.77 2.43 -0.89 -0.82 114.38 118.86 2ii7 h ARG 109 Ca 0.46 0.08 0.18 0.00 -0.81 0.00 0.00 59.98 59.89 2ii7 h ARG 109 Cb 0.46 0.25 -0.11 0.00 -0.42 0.00 0.00 29.97 30.14 2ii7 h ARG 109 CO -0.26 -0.73 0.32 1.96 -1.51 0.00 0.00 179.97 179.75 2ii7 h GLN 110 N -1.14 0.39 -0.08 0.20 4.20 -0.94 -1.59 115.11 116.15 2ii7 h GLN 110 Ca -0.11 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.57 2ii7 h GLN 110 Cb 0.89 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.58 2ii7 h GLN 110 CO 0.17 0.26 0.05 0.00 -0.67 0.00 0.00 178.83 178.64 2ii7 h ALA 111 N 1.64 0.10 -0.03 3.87 0.00 -0.96 -1.46 119.26 122.42 2ii7 h ALA 111 Ca 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.39 2ii7 h ALA 111 Cb 0.85 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 2ii7 h ALA 111 CO -0.49 -0.40 0.01 0.93 0.00 0.00 0.00 179.25 179.30 2ii7 h GLU 112 N 0.10 0.03 -0.57 0.00 5.08 -0.32 -1.48 114.58 117.43 2ii7 h GLU 112 Ca 0.03 -0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.50 2ii7 h GLU 112 Cb -0.01 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 2ii7 h GLU 112 CO -0.01 0.02 0.39 -0.91 -1.00 0.00 0.00 179.01 177.50 2ii7 h ASN 113 N 0.03 0.27 0.20 1.42 -0.26 -1.19 0.89 115.58 116.94 2ii7 h ASN 113 Ca 0.01 0.01 -0.01 0.00 -0.56 0.00 0.00 56.30 55.75 2ii7 h ASN 113 Cb 0.00 -0.05 0.00 0.00 -1.06 0.00 0.00 38.32 37.22 2ii7 h ASN 113 CO -0.01 0.16 -0.10 0.00 -1.06 0.00 0.00 177.43 176.42 2ii7 h ALA 114 N 1.72 -0.27 -0.70 -0.83 0.00 -0.28 0.21 119.26 119.12 2ii7 h ALA 114 Ca 0.27 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2ii7 h ALA 114 Cb 0.66 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 2ii7 h ALA 114 CO -0.06 -0.55 0.38 -0.07 0.00 0.00 0.00 179.25 178.95 2ii7 h LEU 115 N -0.47 0.86 0.24 0.00 3.38 -0.45 -2.16 115.31 116.72 2ii7 h LEU 115 Ca -0.03 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2ii7 h LEU 115 Cb 0.36 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2ii7 h LEU 115 CO 0.04 0.70 -0.12 0.25 0.09 0.00 0.00 178.44 179.40 2ii7 h LEU 116 N 0.97 -0.28 -0.17 1.67 5.85 -0.74 -3.29 115.31 119.33 2ii7 h LEU 116 Ca 0.25 -0.24 0.02 0.00 0.84 0.00 0.00 57.88 58.75 2ii7 h LEU 116 Cb 0.03 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 2ii7 h LEU 116 CO -0.04 0.13 -0.17 0.28 -0.34 0.00 0.00 178.44 178.30 2ii7 h SER 117 N -0.75 -0.59 0.00 1.25 0.02 -0.45 -3.37 113.55 109.67 2ii7 h SER 117 Ca -0.03 0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 60.97 2ii7 h SER 117 Cb 0.50 0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.28 2ii7 h SER 117 CO 0.06 -0.11 0.43 0.41 -1.14 0.00 0.00 176.83 176.48 2ii7 n THR 118 N -3.56 0.00 0.00 -2.27 -1.04 -0.82 -5.10 114.28 101.49 2ii7 n THR 118 Ca -0.01 -0.18 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 2ii7 n THR 118 Cb 0.10 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.61 2ii7 n THR 118 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05