#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l7i s VAL 2 N 0.00 5.31 -0.04 6.31 1.01 -1.26 -3.76 120.40 127.97 1l7i s VAL 2 Ca 0.00 0.50 -0.11 0.00 0.00 0.00 0.00 61.98 62.38 1l7i s VAL 2 Cb 0.00 -3.60 0.02 0.00 0.00 0.00 0.00 36.38 32.80 1l7i s VAL 2 CO 0.00 0.45 0.24 0.00 0.00 0.00 0.00 175.10 175.79 1l7i s GLN 3 N 0.08 0.48 -0.10 2.72 -2.07 -0.69 -5.01 119.66 115.07 1l7i s GLN 3 Ca 0.16 -0.04 -0.01 0.00 -1.82 0.00 0.00 55.36 53.65 1l7i s GLN 3 Cb -0.13 0.21 0.03 0.00 -1.09 0.00 0.00 33.01 32.03 1l7i s GLN 3 CO 0.04 -0.11 -0.02 -0.51 -1.32 0.00 0.00 175.29 173.37 1l7i s LEU 4 N -0.79 0.90 -0.21 2.60 1.43 -1.26 -2.29 118.68 119.05 1l7i s LEU 4 Ca -0.09 -0.27 -0.00 0.00 -1.03 0.00 0.00 54.13 52.74 1l7i s LEU 4 Cb -0.05 -0.61 0.02 0.00 0.03 0.00 0.00 46.19 45.58 1l7i s LEU 4 CO 0.02 -0.18 -0.13 -0.69 0.23 0.00 0.00 176.35 175.59 1l7i s VAL 5 N 1.86 2.52 0.24 -1.59 1.01 -0.88 -4.07 120.40 119.50 1l7i s VAL 5 Ca 0.04 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.12 1l7i s VAL 5 Cb -0.13 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 1l7i s VAL 5 CO -0.07 0.41 0.43 -1.61 0.00 0.00 0.00 175.10 174.26 1l7i s GLU 6 N 1.33 3.51 0.14 2.72 8.01 -1.26 -1.14 118.70 132.00 1l7i s GLU 6 Ca 0.03 -0.39 -0.24 0.00 0.01 0.00 0.00 54.97 54.38 1l7i s GLU 6 Cb -0.14 -2.80 0.07 0.00 -4.31 0.00 0.00 34.13 26.94 1l7i s GLU 6 CO -0.09 0.34 0.79 -1.54 0.01 0.00 0.00 175.26 174.78 1l7i s SER 7 N -3.46 -0.35 0.00 -0.19 1.04 -0.66 -4.86 113.70 105.22 1l7i s SER 7 Ca 0.38 -0.24 0.00 0.00 0.48 0.00 0.00 55.95 56.57 1l7i s SER 7 Cb -0.10 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1l7i s SER 7 CO 0.30 -0.95 0.00 0.61 0.98 0.00 0.00 173.24 174.18 1l7i n GLY 8 N -0.39 1.04 3.71 7.32 0.00 -1.26 -0.73 105.19 114.89 1l7i n GLY 8 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 1l7i n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1l7i s GLY 9 N -2.15 1.66 0.00 -0.02 0.00 -1.26 -4.64 107.32 100.91 1l7i s GLY 9 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 44.72 45.00 1l7i s GLY 9 CO 0.00 0.70 0.00 0.61 0.00 0.00 0.00 173.10 174.41 1l7i n GLY 10 N -0.61 -1.20 3.80 0.20 0.00 -0.04 -4.90 105.19 102.44 1l7i n GLY 10 Ca 0.09 -1.10 -0.38 0.00 0.00 0.00 0.00 46.02 44.63 1l7i n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1l7i s LEU 11 N 0.00 4.45 -0.04 0.99 2.96 -1.26 -1.17 118.68 124.61 1l7i s LEU 11 Ca 0.00 1.07 -0.13 0.00 -0.22 0.00 0.00 54.13 54.85 1l7i s LEU 11 Cb 0.00 -2.77 0.02 0.00 0.50 0.00 0.00 46.19 43.95 1l7i s LEU 11 CO 0.00 0.22 0.29 -0.69 -1.32 0.00 0.00 176.35 174.85 1l7i s VAL 12 N -0.65 0.04 0.69 1.68 1.01 -0.49 -4.97 120.40 117.71 1l7i s VAL 12 Ca 0.27 -0.36 -0.11 0.00 0.00 0.00 0.00 61.98 61.78 1l7i s VAL 12 Cb -0.18 -0.55 0.00 0.00 0.00 0.00 0.00 36.38 35.66 1l7i s VAL 12 CO 0.15 -0.20 1.06 -1.10 0.00 0.00 0.00 175.10 175.02 1l7i s GLN 13 N -0.91 3.01 0.27 2.72 -0.21 -1.24 -1.51 119.66 121.79 1l7i s GLN 13 Ca -0.10 0.75 -0.30 0.00 0.02 0.00 0.00 55.36 55.73 1l7i s GLN 13 Cb -0.05 -2.01 -0.12 0.00 1.00 0.00 0.00 33.01 31.83 1l7i s GLN 13 CO 0.03 -0.99 1.51 -2.30 -2.12 0.00 0.00 175.29 171.42 1l7i n PRO 14 N -3.03 2.42 -0.84 2.91 -0.02 -1.26 0.12 135.00 135.30 1l7i n PRO 14 Ca 0.07 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.41 1l7i n PRO 14 Cb 0.55 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 1l7i n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1l7i n GLY 15 N 2.10 0.83 3.05 -1.23 0.00 0.19 -4.91 105.19 105.21 1l7i n GLY 15 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 1l7i n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l7i n GLY 16 N -2.23 -1.10 3.22 -0.02 0.00 0.12 -4.08 105.19 101.10 1l7i n GLY 16 Ca 0.00 -1.75 -0.17 0.00 0.00 0.00 0.00 46.02 44.10 1l7i n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1l7i s SER 17 N -4.74 1.81 -0.02 1.61 0.01 -1.26 -2.60 113.70 108.51 1l7i s SER 17 Ca 0.58 -0.82 -0.28 0.00 1.31 0.00 0.00 55.95 56.75 1l7i s SER 17 Cb -0.02 -0.04 0.06 0.00 0.21 0.00 0.00 66.02 66.23 1l7i s SER 17 CO 0.41 -0.19 0.62 -0.22 0.41 0.00 0.00 173.24 174.26 1l7i s LEU 18 N -2.48 -0.42 -0.13 2.44 2.96 -0.05 -4.99 118.68 116.01 1l7i s LEU 18 Ca 0.08 0.54 0.00 0.00 -0.22 0.00 0.00 54.13 54.53 1l7i s LEU 18 Cb -0.04 2.36 0.02 0.00 0.50 0.00 0.00 46.19 49.03 1l7i s LEU 18 CO 0.02 -0.63 -0.13 -0.60 -1.32 0.00 0.00 176.35 173.69 1l7i s ARG 19 N -1.52 2.08 -0.00 1.98 3.00 -1.26 0.11 118.95 123.33 1l7i s ARG 19 Ca -0.10 -0.48 -0.04 0.00 -1.00 0.00 0.00 55.73 54.11 1l7i s ARG 19 Cb -0.01 -1.92 -0.04 0.00 0.00 0.00 0.00 34.95 32.98 1l7i s ARG 19 CO 0.06 -0.20 0.21 -0.51 0.00 0.00 0.00 175.30 174.87 1l7i s LEU 20 N 1.41 4.37 0.08 -0.88 1.43 -0.41 -4.56 118.68 120.12 1l7i s LEU 20 Ca 0.02 0.42 0.08 0.00 -1.03 0.00 0.00 54.13 53.62 1l7i s LEU 20 Cb -0.13 -2.65 -0.03 0.00 0.03 0.00 0.00 46.19 43.41 1l7i s LEU 20 CO -0.08 0.25 -0.21 -0.94 0.23 0.00 0.00 176.35 175.60 1l7i s SER 21 N -1.88 2.56 -0.22 2.29 1.04 0.09 -1.14 113.70 116.45 1l7i s SER 21 Ca 0.28 -0.63 -0.02 0.00 0.48 0.00 0.00 55.95 56.06 1l7i s SER 21 Cb -0.13 -0.17 0.06 0.00 0.10 0.00 0.00 66.02 65.89 1l7i s SER 21 CO 0.18 0.10 0.02 0.00 0.98 0.00 0.00 173.24 174.52 1l7i s ALA 23 N 1.69 3.45 0.16 0.00 0.00 -0.30 -0.47 121.76 126.29 1l7i s ALA 23 Ca -0.01 -0.94 -0.03 0.00 0.00 0.00 0.00 51.96 50.97 1l7i s ALA 23 Cb -0.18 -3.14 -0.05 0.00 0.00 0.00 0.00 23.12 19.75 1l7i s ALA 23 CO -0.09 -1.36 0.37 0.00 0.00 0.00 0.00 175.76 174.68 1l7i s ALA 24 N 2.62 3.81 -0.07 0.00 0.00 0.23 -2.06 121.76 126.30 1l7i s ALA 24 Ca 0.22 -0.65 -0.29 0.00 0.00 0.00 0.00 51.96 51.24 1l7i s ALA 24 Cb -0.15 -2.08 0.11 0.00 0.00 0.00 0.00 23.12 21.00 1l7i s ALA 24 CO 0.15 0.61 0.90 0.45 0.00 0.00 0.00 175.76 177.86 1l7i s SER 25 N -2.65 -0.41 0.00 0.00 0.15 -0.97 -4.74 113.70 105.08 1l7i s SER 25 Ca 0.40 0.25 0.00 0.00 0.70 0.00 0.00 55.95 57.30 1l7i s SER 25 Cb -0.12 0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.57 1l7i s SER 25 CO 0.26 -0.52 0.00 0.61 1.20 0.00 0.00 173.24 174.79 1l7i n GLY 26 N 0.29 0.81 3.56 9.45 0.00 -1.25 -1.71 105.19 116.34 1l7i n GLY 26 Ca -0.11 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.84 1l7i n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1l7i s PHE 27 N -2.05 -0.30 -0.96 1.61 -0.71 -1.26 -4.45 117.98 109.86 1l7i s PHE 27 Ca 0.00 0.13 -0.24 0.00 -1.04 0.00 0.00 56.93 55.78 1l7i s PHE 27 Cb 0.00 0.56 -0.04 0.00 -1.21 0.00 0.00 43.02 42.33 1l7i s PHE 27 CO 0.00 -0.60 1.88 0.99 -1.34 0.00 0.00 175.22 176.15 1l7i s THR 28 N -3.14 3.54 0.26 -4.49 2.01 -1.26 -4.83 115.64 107.72 1l7i s THR 28 Ca 0.07 -0.52 0.02 0.00 0.31 0.00 0.00 61.69 61.57 1l7i s THR 28 Cb -0.01 -4.24 0.35 0.00 0.01 0.00 0.00 72.50 68.61 1l7i s THR 28 CO -0.07 -1.11 1.30 0.33 -0.69 0.00 0.00 174.62 174.39 1l7i n PHE 29 N 13.24 0.54 1.56 4.92 7.35 -1.26 0.12 117.46 143.92 1l7i n PHE 29 Ca 0.40 1.00 0.13 0.00 -0.76 0.00 0.00 57.45 58.22 1l7i n PHE 29 Cb 0.47 -1.13 0.75 0.00 0.35 0.00 0.00 39.48 39.93 1l7i n PHE 29 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 1l7i n THR 30 N -5.18 0.04 1.28 -2.13 -2.24 -1.26 -3.26 114.28 101.53 1l7i n THR 30 Ca 0.20 0.01 0.13 0.00 -2.27 0.00 0.00 64.05 62.12 1l7i n THR 30 Cb 0.65 -0.60 0.45 0.00 -2.10 0.00 0.00 70.33 68.74 1l7i n THR 30 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1l7i n ASP 31 N -1.06 0.81 -3.71 3.42 10.43 0.12 -4.72 116.55 121.83 1l7i n ASP 31 Ca 0.18 -0.74 -0.24 0.00 2.57 0.00 0.00 54.79 56.56 1l7i n ASP 31 Cb 0.11 0.06 -0.07 0.00 1.84 0.00 0.00 41.12 43.06 1l7i n ASP 31 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 1l7i n TYR 32 N -0.79 -0.15 -4.27 1.24 4.02 -1.20 -5.01 117.16 110.99 1l7i n TYR 32 Ca 0.13 -2.72 -0.27 0.00 -0.01 0.00 0.00 57.90 55.03 1l7i n TYR 32 Cb 0.32 0.09 -0.09 0.00 -0.02 0.00 0.00 39.34 39.64 1l7i n TYR 32 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1l7i s THR 33 N -3.19 3.25 0.07 -0.72 -4.23 -0.98 -4.33 115.64 105.50 1l7i s THR 33 Ca 0.27 -1.59 0.09 0.00 -1.18 0.00 0.00 61.69 59.28 1l7i s THR 33 Cb 0.01 -2.60 -0.03 0.00 1.34 0.00 0.00 72.50 71.22 1l7i s THR 33 CO 0.19 -0.08 -0.25 -0.04 -0.54 0.00 0.00 174.62 173.90 1l7i s MET 34 N -2.75 1.75 0.31 3.99 1.00 -0.40 -1.04 119.30 122.17 1l7i s MET 34 Ca 0.24 -1.15 0.03 0.00 0.00 0.00 0.00 55.69 54.82 1l7i s MET 34 Cb -0.09 -2.00 -0.05 0.00 0.00 0.00 0.00 34.83 32.68 1l7i s MET 34 CO 0.15 0.50 0.09 -0.51 0.00 0.00 0.00 175.02 175.25 1l7i s ASP 35 N -1.50 1.96 -0.05 3.03 1.11 -0.41 -0.46 116.67 120.34 1l7i s ASP 35 Ca 0.13 -1.44 0.02 0.00 0.18 0.00 0.00 52.55 51.45 1l7i s ASP 35 Cb -0.10 0.12 0.01 0.00 1.07 0.00 0.00 42.92 44.02 1l7i s ASP 35 CO 0.04 -0.72 -0.11 0.26 1.18 0.00 0.00 175.17 175.81 1l7i s TRP 36 N -3.47 1.32 -0.01 4.23 0.52 -0.56 -1.71 118.94 119.25 1l7i s TRP 36 Ca 0.35 -0.44 0.04 0.00 0.02 0.00 0.00 56.10 56.08 1l7i s TRP 36 Cb 0.07 -0.96 -0.01 0.00 -1.15 0.00 0.00 33.47 31.42 1l7i s TRP 36 CO 0.15 -0.22 -0.13 0.08 0.02 0.00 0.00 176.95 176.85 1l7i s VAL 37 N 0.52 1.06 0.31 4.03 1.01 -0.22 -0.51 120.40 126.60 1l7i s VAL 37 Ca -0.11 -0.57 0.10 0.00 0.00 0.00 0.00 61.98 61.40 1l7i s VAL 37 Cb -0.14 -0.89 -0.06 0.00 0.00 0.00 0.00 36.38 35.29 1l7i s VAL 37 CO 0.03 0.30 -0.12 0.00 0.00 0.00 0.00 175.10 175.30 1l7i s ARG 38 N -0.28 1.71 -0.22 2.72 1.70 -0.06 0.33 118.95 124.85 1l7i s ARG 38 Ca 0.04 -1.85 -0.03 0.00 -0.47 0.00 0.00 55.73 53.42 1l7i s ARG 38 Cb -0.06 -1.61 0.10 0.00 -0.57 0.00 0.00 34.95 32.81 1l7i s ARG 38 CO -0.00 0.18 0.23 -1.14 -1.08 0.00 0.00 175.30 173.49 1l7i s GLN 39 N -3.60 0.21 0.52 3.89 0.74 -0.41 -0.94 119.66 120.07 1l7i s GLN 39 Ca 0.31 0.14 -0.20 0.00 0.05 0.00 0.00 55.36 55.66 1l7i s GLN 39 Cb 0.00 -1.12 -0.07 0.00 1.10 0.00 0.00 33.01 32.92 1l7i s GLN 39 CO 0.15 -0.72 1.10 0.00 -0.55 0.00 0.00 175.29 175.28 1l7i s ALA 40 N 2.33 2.78 -0.49 1.58 0.00 -1.26 -1.58 121.76 125.11 1l7i s ALA 40 Ca 0.07 0.77 -0.47 0.00 0.00 0.00 0.00 51.96 52.34 1l7i s ALA 40 Cb -0.16 -3.33 -0.20 0.00 0.00 0.00 0.00 23.12 19.44 1l7i s ALA 40 CO -0.16 -0.62 1.61 -2.30 0.00 0.00 0.00 175.76 174.29 1l7i n PRO 41 N -1.10 0.05 -1.50 0.00 -0.02 -1.26 -0.42 135.00 130.75 1l7i n PRO 41 Ca 0.10 0.02 -0.17 0.00 -2.02 0.00 0.00 63.50 61.43 1l7i n PRO 41 Cb 0.51 -1.53 -0.07 0.00 -0.02 0.00 0.00 33.50 32.39 1l7i n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1l7i n GLY 42 N 4.01 1.70 0.79 -1.23 0.00 -1.26 -4.98 105.19 104.21 1l7i n GLY 42 Ca 0.31 -0.19 -0.06 0.00 0.00 0.00 0.00 46.02 46.07 1l7i n GLY 42 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1l7i n LYS 43 N -2.47 1.60 -0.13 1.61 4.81 0.44 -5.16 118.16 118.85 1l7i n LYS 43 Ca -0.17 -0.77 0.00 0.00 -0.87 0.00 0.00 58.31 56.50 1l7i n LYS 43 Cb 0.57 0.17 0.00 0.00 0.02 0.00 0.00 35.03 35.78 1l7i n LYS 43 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1l7i n GLY 44 N 3.67 0.29 3.83 3.14 0.00 -1.26 -4.74 105.19 110.11 1l7i n GLY 44 Ca -0.03 -1.82 -0.36 0.00 0.00 0.00 0.00 46.02 43.81 1l7i n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l7i s LEU 45 N 0.00 4.17 -0.08 0.99 1.43 -1.26 -4.17 118.68 119.76 1l7i s LEU 45 Ca 0.00 0.35 -0.01 0.00 -1.03 0.00 0.00 54.13 53.44 1l7i s LEU 45 Cb 0.00 -2.12 0.03 0.00 0.03 0.00 0.00 46.19 44.13 1l7i s LEU 45 CO 0.00 0.37 0.00 -0.70 0.23 0.00 0.00 176.35 176.25 1l7i s GLU 46 N -1.21 0.62 0.28 1.70 2.12 -0.11 -4.99 118.70 117.11 1l7i s GLU 46 Ca 0.17 0.08 -0.30 0.00 0.36 0.00 0.00 54.97 55.29 1l7i s GLU 46 Cb -0.12 -1.03 -0.10 0.00 0.26 0.00 0.00 34.13 33.13 1l7i s GLU 46 CO 0.07 -0.32 1.42 -0.46 -0.54 0.00 0.00 175.26 175.43 1l7i s TRP 47 N 1.97 2.98 -0.16 5.30 -0.00 -1.26 -0.89 118.94 126.88 1l7i s TRP 47 Ca 0.05 1.12 -0.13 0.00 -0.00 0.00 0.00 56.10 57.14 1l7i s TRP 47 Cb -0.12 -3.81 -0.07 0.00 -0.00 0.00 0.00 33.47 29.47 1l7i s TRP 47 CO -0.05 -2.54 -0.28 0.28 -0.00 0.00 0.00 176.95 174.36 1l7i n VAL 48 N 1.82 1.35 -3.60 5.86 0.31 0.33 -4.75 118.33 119.65 1l7i n VAL 48 Ca 0.05 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.33 1l7i n VAL 48 Cb 0.40 -2.04 -0.02 0.00 -0.91 0.00 0.00 33.84 31.28 1l7i n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1l7i s ALA 49 N -2.59 -1.90 0.04 3.52 0.00 -1.12 -1.08 121.76 118.62 1l7i s ALA 49 Ca -0.26 0.91 0.05 0.00 0.00 0.00 0.00 51.96 52.66 1l7i s ALA 49 Cb 0.06 0.33 -0.02 0.00 0.00 0.00 0.00 23.12 23.50 1l7i s ALA 49 CO 0.36 -0.80 -0.14 0.34 0.00 0.00 0.00 175.76 175.52 1l7i s ASP 50 N -2.58 1.62 -0.03 0.00 2.15 0.31 -1.50 116.67 116.64 1l7i s ASP 50 Ca 0.09 -0.48 -0.02 0.00 0.43 0.00 0.00 52.55 52.57 1l7i s ASP 50 Cb -0.00 -0.09 0.01 0.00 -0.30 0.00 0.00 42.92 42.54 1l7i s ASP 50 CO -0.05 0.01 0.08 0.54 -0.17 0.00 0.00 175.17 175.58 1l7i s VAL 51 N -0.91 -0.01 -0.42 1.11 0.11 0.39 -0.56 120.40 120.10 1l7i s VAL 51 Ca 0.01 0.05 -0.18 0.00 -2.93 0.00 0.00 61.98 58.93 1l7i s VAL 51 Cb -0.08 -0.13 0.02 0.00 -1.53 0.00 0.00 36.38 34.66 1l7i s VAL 51 CO 0.01 0.02 0.46 0.21 -3.33 0.00 0.00 175.10 172.48 1l7i s ASN 52 N 0.29 6.21 0.00 3.54 3.04 0.13 -1.27 114.94 126.88 1l7i s ASN 52 Ca -0.02 -0.62 0.05 0.00 0.04 0.00 0.00 52.86 52.30 1l7i s ASN 52 Cb -0.03 -2.24 0.24 0.00 -1.54 0.00 0.00 41.25 37.69 1l7i s ASN 52 CO -0.01 -0.60 0.90 -0.81 -3.04 0.00 0.00 177.10 173.54 1l7i n PRO 52 N 5.69 0.09 -0.07 0.43 -0.04 -1.26 0.79 135.00 140.63 1l7i n PRO 52 Ca -0.07 0.17 -0.19 0.00 -0.04 0.00 0.00 63.50 63.37 1l7i n PRO 52 Cb 0.47 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.30 1l7i n PRO 52 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1l7i n ASN 53 N -1.19 1.89 -0.00 3.54 3.02 -1.26 -4.59 115.26 116.66 1l7i n ASN 53 Ca 0.03 0.04 0.06 0.00 -0.03 0.00 0.00 54.58 54.68 1l7i n ASN 53 Cb 0.03 -0.51 -0.09 0.00 -0.61 0.00 0.00 39.78 38.59 1l7i n ASN 53 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1l7i n SER 54 N -3.32 2.03 0.00 6.41 3.41 -1.08 -4.99 113.62 116.09 1l7i n SER 54 Ca -0.38 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.14 1l7i n SER 54 Cb 1.03 1.49 0.00 0.00 -0.26 0.00 0.00 64.21 66.46 1l7i n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1l7i n GLY 55 N 1.75 0.84 3.76 5.00 0.00 0.24 -5.01 105.19 111.78 1l7i n GLY 55 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1l7i n GLY 55 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1l7i s GLY 56 N -1.92 3.03 0.04 -0.02 0.00 -1.24 -4.74 107.32 102.46 1l7i s GLY 56 Ca 0.00 1.04 0.02 0.00 0.00 0.00 0.00 44.72 45.78 1l7i s GLY 56 CO 0.00 1.65 -0.08 -1.35 0.00 0.00 0.00 173.10 173.33 1l7i s SER 57 N -0.75 0.85 -0.10 1.64 1.04 -1.26 -0.69 113.70 114.42 1l7i s SER 57 Ca 0.47 -0.51 0.03 0.00 0.48 0.00 0.00 55.95 56.42 1l7i s SER 57 Cb -0.35 0.03 -0.00 0.00 0.10 0.00 0.00 66.02 65.79 1l7i s SER 57 CO 0.45 -0.18 -0.22 -0.63 0.98 0.00 0.00 173.24 173.64 1l7i s ILE 58 N -1.28 2.27 0.25 -1.02 1.01 0.27 -4.98 121.20 117.72 1l7i s ILE 58 Ca -0.09 -0.95 0.10 0.00 0.00 0.00 0.00 60.65 59.71 1l7i s ILE 58 Cb -0.09 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.45 1l7i s ILE 58 CO 0.00 0.56 -0.06 -0.31 0.00 0.00 0.00 174.94 175.13 1l7i s TYR 59 N 0.26 2.61 0.10 3.97 1.51 -1.26 -0.53 117.35 124.01 1l7i s TYR 59 Ca -0.15 -0.24 -0.28 0.00 -1.01 0.00 0.00 57.07 55.39 1l7i s TYR 59 Cb -0.17 -1.18 -0.06 0.00 -0.11 0.00 0.00 41.96 40.44 1l7i s TYR 59 CO 0.08 0.61 0.88 1.21 -1.11 0.00 0.00 175.55 177.21 1l7i s ASN 60 N -3.41 7.41 0.00 2.29 3.84 -0.24 -4.97 114.94 119.85 1l7i s ASN 60 Ca 0.29 1.68 0.00 0.00 0.21 0.00 0.00 52.86 55.04 1l7i s ASN 60 Cb -0.07 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 38.09 1l7i s ASN 60 CO 0.18 0.00 0.17 0.00 -2.79 0.00 0.00 177.10 174.67 1l7i n GLN 61 N 2.58 0.00 0.00 0.43 1.13 -1.26 -1.23 117.38 119.03 1l7i n GLN 61 Ca -0.00 0.17 0.01 0.00 -1.94 0.00 0.00 57.00 55.24 1l7i n GLN 61 Cb 0.49 -0.30 0.03 0.00 0.11 0.00 0.00 30.24 30.57 1l7i n GLN 61 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 1l7i n ARG 62 N -1.23 0.02 0.00 -1.09 1.85 -1.26 -1.93 116.66 113.02 1l7i n ARG 62 Ca 0.00 0.19 0.10 0.00 -1.00 0.00 0.00 57.85 57.15 1l7i n ARG 62 Cb 0.00 -1.50 -0.08 0.00 -1.05 0.00 0.00 32.46 29.83 1l7i n ARG 62 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1l7i n PHE 63 N -1.20 0.01 -1.97 2.89 0.99 -0.37 -4.90 117.46 112.91 1l7i n PHE 63 Ca 0.01 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 57.04 1l7i n PHE 63 Cb 0.01 -0.07 -0.03 0.00 -1.00 0.00 0.00 39.48 38.39 1l7i n PHE 63 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 1l7i s LYS 64 N -3.03 4.22 0.00 -1.08 1.02 -0.82 -1.85 119.74 118.20 1l7i s LYS 64 Ca 0.07 2.29 0.00 0.00 0.02 0.00 0.00 55.97 58.35 1l7i s LYS 64 Cb 0.16 -3.49 0.00 0.00 -0.52 0.00 0.00 37.83 33.98 1l7i s LYS 64 CO 0.85 -0.68 0.00 0.41 -0.92 0.00 0.00 175.35 175.01 1l7i n GLY 65 N 3.89 1.59 0.00 -3.33 0.00 -1.26 -4.85 105.19 101.23 1l7i n GLY 65 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1l7i n GLY 65 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1l7i n ARG 66 N -0.08 5.06 -5.14 1.61 1.85 -0.96 -4.94 116.66 114.07 1l7i n ARG 66 Ca 0.00 0.00 -0.32 0.00 -1.00 0.00 0.00 57.85 56.53 1l7i n ARG 66 Cb 0.00 -0.40 -0.16 0.00 -1.05 0.00 0.00 32.46 30.85 1l7i n ARG 66 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1l7i s PHE 67 N -0.79 2.55 -0.07 2.89 0.40 -0.77 -0.59 117.98 121.59 1l7i s PHE 67 Ca 0.00 -0.73 -0.00 0.00 -0.60 0.00 0.00 56.93 55.60 1l7i s PHE 67 Cb 0.00 -1.67 0.03 0.00 0.51 0.00 0.00 43.02 41.89 1l7i s PHE 67 CO 0.00 -0.22 -0.03 0.99 0.70 0.00 0.00 175.22 176.66 1l7i s THR 68 N -0.03 0.59 0.04 0.64 2.01 0.03 -4.79 115.64 114.14 1l7i s THR 68 Ca -0.07 -0.05 -0.12 0.00 0.31 0.00 0.00 61.69 61.76 1l7i s THR 68 Cb -0.15 -0.68 -0.06 0.00 0.01 0.00 0.00 72.50 71.63 1l7i s THR 68 CO 0.05 0.28 0.40 -0.76 -0.69 0.00 0.00 174.62 173.90 1l7i s LEU 69 N 1.61 4.40 0.21 4.42 1.43 -1.26 -0.69 118.68 128.80 1l7i s LEU 69 Ca 0.00 0.86 -0.13 0.00 -1.03 0.00 0.00 54.13 53.84 1l7i s LEU 69 Cb -0.13 -2.79 0.00 0.00 0.03 0.00 0.00 46.19 43.31 1l7i s LEU 69 CO -0.04 0.24 0.43 -0.94 0.23 0.00 0.00 176.35 176.28 1l7i s SER 70 N -1.44 -0.11 -0.06 2.29 1.04 -0.81 -4.99 113.70 109.63 1l7i s SER 70 Ca 0.29 -0.77 -0.15 0.00 0.48 0.00 0.00 55.95 55.80 1l7i s SER 70 Cb -0.15 0.54 0.03 0.00 0.10 0.00 0.00 66.02 66.54 1l7i s SER 70 CO 0.16 -1.04 0.35 0.54 0.98 0.00 0.00 173.24 174.23 1l7i s VAL 71 N -3.96 0.03 -0.53 5.02 0.11 -1.26 -0.91 120.40 118.91 1l7i s VAL 71 Ca 0.16 -0.28 -0.03 0.00 -2.93 0.00 0.00 61.98 58.90 1l7i s VAL 71 Cb 0.00 -0.61 0.14 0.00 -1.53 0.00 0.00 36.38 34.38 1l7i s VAL 71 CO 0.02 -0.16 0.34 -0.62 -3.33 0.00 0.00 175.10 171.35 1l7i s ASP 72 N -0.80 5.27 0.00 3.54 2.15 -0.36 -4.95 116.67 121.51 1l7i s ASP 72 Ca -0.09 -2.47 0.00 0.00 0.43 0.00 0.00 52.55 50.43 1l7i s ASP 72 Cb -0.04 -1.85 0.00 0.00 -0.30 0.00 0.00 42.92 40.73 1l7i s ASP 72 CO 0.03 -0.46 0.29 -2.11 -0.17 0.00 0.00 175.17 172.75 1l7i n ARG 73 N 4.02 0.45 -0.00 4.34 1.85 -1.26 -1.78 116.66 124.28 1l7i n ARG 73 Ca 0.03 0.00 0.03 0.00 -1.00 0.00 0.00 57.85 56.91 1l7i n ARG 73 Cb 0.39 -1.16 -0.04 0.00 -1.05 0.00 0.00 32.46 30.60 1l7i n ARG 73 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1l7i n SER 74 N 0.06 0.57 0.00 2.89 3.41 -1.26 -4.59 113.62 114.71 1l7i n SER 74 Ca 0.00 -0.59 0.00 0.00 -0.26 0.00 0.00 58.87 58.02 1l7i n SER 74 Cb 0.08 1.03 0.00 0.00 -0.26 0.00 0.00 64.21 65.06 1l7i n SER 74 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1l7i n LYS 75 N -1.20 -0.22 -3.55 4.33 5.02 -0.73 -5.01 118.16 116.81 1l7i n LYS 75 Ca 0.01 -0.23 -0.22 0.00 -2.02 0.00 0.00 58.31 55.85 1l7i n LYS 75 Cb 0.10 -0.71 0.08 0.00 -0.02 0.00 0.00 35.03 34.48 1l7i n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1l7i n ASN 76 N -0.03 -5.41 -4.35 4.39 3.02 -0.89 -4.61 115.26 107.37 1l7i n ASN 76 Ca 0.00 -0.55 -0.30 0.00 -0.03 0.00 0.00 54.58 53.70 1l7i n ASN 76 Cb 0.12 -5.02 -0.14 0.00 -0.61 0.00 0.00 39.78 34.12 1l7i n ASN 76 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1l7i s THR 77 N -3.33 2.16 0.12 3.41 2.01 -1.18 0.76 115.64 119.60 1l7i s THR 77 Ca 0.45 -1.49 0.09 0.00 0.31 0.00 0.00 61.69 61.06 1l7i s THR 77 Cb -0.20 -1.86 -0.04 0.00 0.01 0.00 0.00 72.50 70.41 1l7i s THR 77 CO 0.72 0.29 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.99 1l7i s LEU 78 N -1.46 2.66 0.01 4.42 1.43 0.38 -1.23 118.68 124.89 1l7i s LEU 78 Ca 0.12 -0.59 0.03 0.00 -1.03 0.00 0.00 54.13 52.66 1l7i s LEU 78 Cb -0.10 -1.50 -0.01 0.00 0.03 0.00 0.00 46.19 44.61 1l7i s LEU 78 CO 0.03 0.17 -0.09 -0.31 0.23 0.00 0.00 176.35 176.38 1l7i s TYR 79 N -1.19 0.79 -0.30 0.29 1.51 -0.09 -0.13 117.35 118.24 1l7i s TYR 79 Ca 0.18 -0.23 0.02 0.00 -1.01 0.00 0.00 57.07 56.03 1l7i s TYR 79 Cb -0.10 -0.49 0.08 0.00 -0.11 0.00 0.00 41.96 41.34 1l7i s TYR 79 CO 0.10 -0.02 -0.00 -1.17 -1.11 0.00 0.00 175.55 173.35 1l7i s LEU 80 N -0.58 3.68 -0.09 -1.29 2.96 -0.29 -1.92 118.68 121.15 1l7i s LEU 80 Ca 0.01 -1.71 -0.22 0.00 -0.22 0.00 0.00 54.13 51.98 1l7i s LEU 80 Cb -0.05 -1.42 -0.04 0.00 0.50 0.00 0.00 46.19 45.18 1l7i s LEU 80 CO 0.00 -0.31 0.67 -1.58 -1.32 0.00 0.00 176.35 173.81 1l7i s GLN 81 N 1.14 4.40 -0.09 1.98 2.00 0.14 -1.29 119.66 127.94 1l7i s GLN 81 Ca 0.03 0.80 0.03 0.00 -2.00 0.00 0.00 55.36 54.22 1l7i s GLN 81 Cb -0.19 -3.46 0.01 0.00 0.80 0.00 0.00 33.01 30.17 1l7i s GLN 81 CO -0.09 0.05 -0.20 -1.64 -0.50 0.00 0.00 175.29 172.91 1l7i s MET 82 N 0.88 2.57 0.23 1.67 -1.94 0.12 -0.79 119.30 122.04 1l7i s MET 82 Ca 0.35 -0.71 0.03 0.00 -1.71 0.00 0.00 55.69 53.65 1l7i s MET 82 Cb -0.17 -1.99 -0.05 0.00 2.01 0.00 0.00 34.83 34.62 1l7i s MET 82 CO 0.16 0.11 0.01 0.54 -0.01 0.00 0.00 175.02 175.83 1l7i s ASN 82 N 0.50 1.73 -1.58 3.03 4.22 0.24 -0.87 114.94 122.20 1l7i s ASN 82 Ca -0.16 -1.24 -0.15 0.00 -2.14 0.00 0.00 52.86 49.17 1l7i s ASN 82 Cb -0.17 0.03 0.11 0.00 1.28 0.00 0.00 41.25 42.50 1l7i s ASN 82 CO 0.06 -0.54 0.88 -1.20 -2.04 0.00 0.00 177.10 174.26 1l7i n SER 82 N -0.42 -3.94 -4.75 3.54 7.64 -1.14 -4.70 113.62 109.86 1l7i n SER 82 Ca -0.05 -0.88 -0.42 0.00 1.01 0.00 0.00 58.87 58.54 1l7i n SER 82 Cb 0.64 -3.44 -0.01 0.00 -1.01 0.00 0.00 64.21 60.40 1l7i n SER 82 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1l7i n LEU 82 N -4.55 4.36 -4.68 -3.43 4.77 -1.07 -4.57 117.00 107.83 1l7i n LEU 82 Ca 0.03 1.21 -0.24 0.00 -0.03 0.00 0.00 56.01 56.98 1l7i n LEU 82 Cb 0.52 -1.58 -0.07 0.00 -2.33 0.00 0.00 43.42 39.97 1l7i n LEU 82 CO 0.79 -0.02 -0.30 -0.13 -1.33 0.00 0.00 177.39 176.40 1l7i s ARG 83 N -1.74 2.42 0.41 3.23 0.52 -1.26 0.56 118.95 123.09 1l7i s ARG 83 Ca 0.56 -1.28 0.14 0.00 -0.52 0.00 0.00 55.73 54.63 1l7i s ARG 83 Cb -0.51 -2.27 0.99 0.00 0.52 0.00 0.00 34.95 33.68 1l7i s ARG 83 CO 0.61 0.39 1.92 0.00 0.02 0.00 0.00 175.30 178.24 1l7i h ALA 84 N 2.04 2.03 0.00 2.13 0.00 -1.96 0.20 119.26 123.71 1l7i h ALA 84 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1l7i h ALA 84 Cb 1.24 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1l7i h ALA 84 CO 0.60 -0.22 0.00 0.39 0.00 0.00 0.00 179.25 180.02 1l7i n GLU 85 N -4.49 0.04 0.00 0.00 1.02 -1.26 -2.07 120.64 113.88 1l7i n GLU 85 Ca 0.14 0.27 0.14 0.00 -0.02 0.00 0.00 57.16 57.69 1l7i n GLU 85 Cb 0.48 -1.50 0.54 0.00 -0.02 0.00 0.00 31.44 30.93 1l7i n GLU 85 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1l7i n ASP 86 N -1.45 1.10 -4.67 1.62 8.00 0.72 -4.85 116.55 117.02 1l7i n ASP 86 Ca 0.03 -1.17 -0.42 0.00 0.71 0.00 0.00 54.79 53.94 1l7i n ASP 86 Cb 0.12 0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.22 1l7i n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1l7i s THR 87 N -2.20 3.26 -0.10 -3.53 2.01 -0.88 -4.87 115.64 109.34 1l7i s THR 87 Ca 0.34 0.49 -0.32 0.00 0.31 0.00 0.00 61.69 62.51 1l7i s THR 87 Cb 0.20 -3.31 0.14 0.00 0.01 0.00 0.00 72.50 69.54 1l7i s THR 87 CO 0.41 -0.03 1.43 0.00 -0.69 0.00 0.00 174.62 175.73 1l7i s ALA 88 N 3.57 -2.58 -0.20 7.40 0.00 -0.40 -4.44 121.76 125.11 1l7i s ALA 88 Ca 0.76 0.79 -0.16 0.00 0.00 0.00 0.00 51.96 53.35 1l7i s ALA 88 Cb -0.38 0.39 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 1l7i s ALA 88 CO 0.33 -1.09 0.40 0.08 0.00 0.00 0.00 175.76 175.48 1l7i s VAL 89 N -2.02 5.20 -0.24 0.00 1.01 -0.62 -0.78 120.40 122.95 1l7i s VAL 89 Ca 0.19 0.70 -0.08 0.00 0.00 0.00 0.00 61.98 62.79 1l7i s VAL 89 Cb 0.06 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 1l7i s VAL 89 CO -0.06 0.25 0.10 -0.31 0.00 0.00 0.00 175.10 175.07 1l7i s TYR 90 N 1.33 3.15 -0.05 5.22 1.51 -0.04 -1.29 117.35 127.18 1l7i s TYR 90 Ca 0.19 -0.20 -0.03 0.00 -1.01 0.00 0.00 57.07 56.02 1l7i s TYR 90 Cb -0.15 -2.24 -0.04 0.00 -0.11 0.00 0.00 41.96 39.43 1l7i s TYR 90 CO 0.08 -0.21 0.11 0.71 -1.11 0.00 0.00 175.55 175.13 1l7i s TYR 91 N 1.39 3.41 -0.09 2.71 1.51 0.15 -1.73 117.35 124.70 1l7i s TYR 91 Ca 0.06 0.33 -0.08 0.00 -1.01 0.00 0.00 57.07 56.36 1l7i s TYR 91 Cb -0.15 -1.82 -0.04 0.00 -0.11 0.00 0.00 41.96 39.84 1l7i s TYR 91 CO 0.05 0.61 0.20 0.00 -1.11 0.00 0.00 175.55 175.30 1l7i s ALA 93 N -1.07 -0.54 0.11 0.00 0.00 -0.70 -0.49 121.76 119.07 1l7i s ALA 93 Ca 0.18 0.36 -0.22 0.00 0.00 0.00 0.00 51.96 52.28 1l7i s ALA 93 Cb -0.13 -0.15 -0.07 0.00 0.00 0.00 0.00 23.12 22.77 1l7i s ALA 93 CO 0.07 -0.17 0.66 0.50 0.00 0.00 0.00 175.76 176.82 1l7i s ARG 94 N -0.60 4.37 -0.39 0.00 3.52 0.52 -1.29 118.95 125.07 1l7i s ARG 94 Ca -0.07 0.93 0.02 0.00 -0.13 0.00 0.00 55.73 56.48 1l7i s ARG 94 Cb -0.04 -3.25 0.11 0.00 -1.56 0.00 0.00 34.95 30.21 1l7i s ARG 94 CO 0.01 0.60 0.13 1.21 -0.81 0.00 0.00 175.30 176.45 1l7i s ASN 95 N -1.09 4.85 0.00 -2.12 3.84 -0.20 -2.36 114.94 117.86 1l7i s ASN 95 Ca 0.32 -2.28 0.00 0.00 0.21 0.00 0.00 52.86 51.11 1l7i s ASN 95 Cb -0.21 -1.69 0.00 0.00 -0.55 0.00 0.00 41.25 38.80 1l7i s ASN 95 CO 0.22 -0.40 0.25 0.00 -2.79 0.00 0.00 177.10 174.38 1l7i n LEU 96 N 4.14 1.13 -4.40 3.21 -0.00 -1.26 -2.33 117.00 117.48 1l7i n LEU 96 Ca 0.03 0.39 -0.29 0.00 -0.00 0.00 0.00 56.01 56.14 1l7i n LEU 96 Cb 0.40 -0.21 0.28 0.00 -0.00 0.00 0.00 43.42 43.89 1l7i n LEU 96 CO 0.27 -0.21 0.46 -0.83 -0.00 0.00 0.00 177.39 177.08 1l7i s GLY 97 N -1.07 1.49 0.43 1.47 0.00 -1.26 -4.79 107.32 103.59 1l7i s GLY 97 Ca 0.00 -0.31 0.20 0.00 0.00 0.00 0.00 44.72 44.61 1l7i s GLY 97 CO 0.00 0.52 1.88 -0.56 0.00 0.00 0.00 173.10 174.94 1l7i h PRO 98 N -2.98 0.00 -7.43 2.90 0.13 -1.97 -3.44 132.00 119.20 1l7i h PRO 98 Ca -0.59 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.10 1l7i h PRO 98 Cb 1.34 0.00 0.17 0.00 0.13 0.00 0.00 31.00 32.64 1l7i h PRO 98 CO 0.45 0.27 0.21 -1.12 -0.23 0.00 0.00 178.00 177.57 1l7i s SER 99 N -6.47 2.18 -0.86 1.44 0.01 -1.26 -4.97 113.70 103.76 1l7i s SER 99 Ca -0.02 0.87 -0.02 0.00 1.31 0.00 0.00 55.95 58.10 1l7i s SER 99 Cb 0.13 -1.33 0.35 0.00 0.21 0.00 0.00 66.02 65.37 1l7i s SER 99 CO 0.66 -3.37 1.96 0.49 0.41 0.00 0.00 173.24 173.39 1l7i n PHE 99 N -4.29 2.97 -4.98 2.43 3.72 -1.26 -4.82 117.46 111.22 1l7i n PHE 99 Ca 0.09 -2.40 -0.31 0.00 -0.05 0.00 0.00 57.45 54.78 1l7i n PHE 99 Cb 0.59 -1.15 -0.14 0.00 -0.94 0.00 0.00 39.48 37.84 1l7i n PHE 99 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 176.76 178.23 1l7i s TYR 99 N -4.10 2.49 -0.22 1.38 -0.85 -1.26 -5.12 117.35 109.68 1l7i s TYR 99 Ca 0.50 -0.31 -0.06 0.00 -0.52 0.00 0.00 57.07 56.68 1l7i s TYR 99 Cb 0.40 -1.52 -0.03 0.00 0.38 0.00 0.00 41.96 41.20 1l7i s TYR 99 CO -0.37 0.12 0.03 -0.06 -1.52 0.00 0.00 175.55 173.76 1l7i s PHE 100 N -0.74 3.07 -0.91 -3.49 0.40 -1.26 -4.39 117.98 110.65 1l7i s PHE 100 Ca 0.12 -0.44 0.26 0.00 -0.60 0.00 0.00 56.93 56.27 1l7i s PHE 100 Cb -0.10 -2.16 0.72 0.00 0.51 0.00 0.00 43.02 42.00 1l7i s PHE 100 CO 0.01 -0.29 1.58 -0.40 0.70 0.00 0.00 175.22 176.83 1l7i n ASP 101 N 4.54 0.41 -3.73 1.36 5.68 -0.99 -4.85 116.55 118.97 1l7i n ASP 101 Ca -0.17 0.11 -0.12 0.00 -0.50 0.00 0.00 54.79 54.11 1l7i n ASP 101 Cb 0.52 -0.08 -0.11 0.00 -1.14 0.00 0.00 41.12 40.31 1l7i n ASP 101 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 1l7i s TYR 102 N -3.04 -0.46 0.06 2.11 5.04 -1.26 -5.00 117.35 114.80 1l7i s TYR 102 Ca 0.11 1.05 0.07 0.00 -2.44 0.00 0.00 57.07 55.87 1l7i s TYR 102 Cb 0.17 0.17 -0.03 0.00 0.35 0.00 0.00 41.96 42.62 1l7i s TYR 102 CO 0.64 -0.25 -0.20 -1.58 -1.34 0.00 0.00 175.55 172.82 1l7i s TRP 103 N 0.82 1.76 0.95 4.97 0.52 -1.26 -0.36 118.94 126.34 1l7i s TRP 103 Ca -0.05 -0.39 -0.14 0.00 0.02 0.00 0.00 56.10 55.54 1l7i s TRP 103 Cb -0.06 -1.02 0.21 0.00 -1.15 0.00 0.00 33.47 31.44 1l7i s TRP 103 CO -0.06 0.12 1.30 0.20 0.02 0.00 0.00 176.95 178.53 1l7i s GLY 104 N -1.39 1.80 0.13 0.98 0.00 0.35 -4.81 107.32 104.39 1l7i s GLY 104 Ca 0.07 -1.36 0.24 0.00 0.00 0.00 0.00 44.72 43.67 1l7i s GLY 104 CO 0.02 -0.57 1.75 -0.18 0.00 0.00 0.00 173.10 174.12 1l7i n GLN 105 N -3.71 0.14 0.00 2.90 7.27 -1.26 -4.71 117.38 118.01 1l7i n GLN 105 Ca 0.16 0.21 0.00 0.00 0.07 0.00 0.00 57.00 57.44 1l7i n GLN 105 Cb 0.59 -1.69 0.00 0.00 2.41 0.00 0.00 30.24 31.55 1l7i n GLN 105 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1l7i n GLY 106 N 0.84 -1.02 2.90 1.69 0.00 -1.26 -4.99 105.19 103.35 1l7i n GLY 106 Ca 0.05 -1.61 -0.16 0.00 0.00 0.00 0.00 46.02 44.29 1l7i n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1l7i s THR 107 N -2.68 0.31 -0.08 2.61 -1.32 -0.71 -4.79 115.64 108.98 1l7i s THR 107 Ca 0.00 -0.10 -0.25 0.00 -1.21 0.00 0.00 61.69 60.12 1l7i s THR 107 Cb 0.00 -0.31 -0.03 0.00 -1.51 0.00 0.00 72.50 70.65 1l7i s THR 107 CO 0.00 0.12 0.79 -0.22 -2.21 0.00 0.00 174.62 173.10 1l7i s LEU 108 N 0.31 4.29 -0.17 9.08 2.96 -1.26 -0.87 118.68 133.02 1l7i s LEU 108 Ca -0.03 1.28 -0.00 0.00 -0.22 0.00 0.00 54.13 55.15 1l7i s LEU 108 Cb -0.06 -3.22 -0.00 0.00 0.50 0.00 0.00 46.19 43.40 1l7i s LEU 108 CO -0.01 -0.22 -0.14 -0.69 -1.32 0.00 0.00 176.35 173.98 1l7i s VAL 109 N 1.21 2.77 -0.18 1.68 1.01 0.04 -0.86 120.40 126.07 1l7i s VAL 109 Ca 0.41 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.66 1l7i s VAL 109 Cb -0.18 -2.19 0.02 0.00 0.00 0.00 0.00 36.38 34.03 1l7i s VAL 109 CO 0.19 0.50 -0.18 -0.89 0.00 0.00 0.00 175.10 174.72 1l7i s THR 110 N 0.92 2.25 -0.42 3.92 2.01 -0.32 -1.28 115.64 122.73 1l7i s THR 110 Ca -0.03 -0.88 -0.10 0.00 0.31 0.00 0.00 61.69 60.99 1l7i s THR 110 Cb -0.15 -1.96 0.07 0.00 0.01 0.00 0.00 72.50 70.47 1l7i s THR 110 CO -0.01 0.52 0.28 -0.69 -0.69 0.00 0.00 174.62 174.03 1l7i s VAL 111 N 1.30 4.45 0.05 3.82 1.01 -1.26 -1.40 120.40 128.36 1l7i s VAL 111 Ca 0.05 -1.27 -0.20 0.00 0.00 0.00 0.00 61.98 60.55 1l7i s VAL 111 Cb -0.13 -3.68 0.04 0.00 0.00 0.00 0.00 36.38 32.61 1l7i s VAL 111 CO -0.11 -0.48 0.47 -0.55 0.00 0.00 0.00 175.10 174.43 1l7i s SER 112 N 2.13 -0.37 0.00 3.32 0.15 -0.57 -4.62 113.70 113.74 1l7i s SER 112 Ca 0.03 0.10 0.26 0.00 0.70 0.00 0.00 55.95 57.04 1l7i s SER 112 Cb -0.23 0.46 0.69 0.00 -1.71 0.00 0.00 66.02 65.24 1l7i s SER 112 CO 0.03 -0.69 1.53 -1.54 1.20 0.00 0.00 173.24 173.77 1l7i n SER 113 N 0.45 0.92 -4.77 5.45 3.41 -1.26 -3.72 113.62 114.10 1l7i n SER 113 Ca -0.18 -0.76 -0.38 0.00 -0.26 0.00 0.00 58.87 57.28 1l7i n SER 113 Cb 0.60 0.17 -0.01 0.00 -0.26 0.00 0.00 64.21 64.71 1l7i n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1l7i s ALA 114 N -2.61 3.12 0.48 7.33 0.00 -1.26 -5.01 121.76 123.81 1l7i s ALA 114 Ca 0.21 1.08 -0.17 0.00 0.00 0.00 0.00 51.96 53.08 1l7i s ALA 114 Cb 0.19 -3.43 -0.09 0.00 0.00 0.00 0.00 23.12 19.79 1l7i s ALA 114 CO 0.56 -0.73 0.95 -1.12 0.00 0.00 0.00 175.76 175.42 1l7i s SER 115 N -1.04 6.71 0.29 0.00 0.01 -1.26 -5.00 113.70 113.40 1l7i s SER 115 Ca 0.60 1.56 -0.29 0.00 1.31 0.00 0.00 55.95 59.12 1l7i s SER 115 Cb -0.33 -2.50 -0.10 0.00 0.21 0.00 0.00 66.02 63.30 1l7i s SER 115 CO 0.42 -0.50 1.27 -0.89 0.41 0.00 0.00 173.24 173.95 1l7i s THR 116 N -2.46 2.98 -0.08 1.44 2.01 -1.26 -4.76 115.64 113.51 1l7i s THR 116 Ca 0.59 0.94 -0.04 0.00 0.31 0.00 0.00 61.69 63.48 1l7i s THR 116 Cb -0.10 -3.60 0.04 0.00 0.01 0.00 0.00 72.50 68.86 1l7i s THR 116 CO 0.26 0.20 0.19 -0.54 -0.69 0.00 0.00 174.62 174.04 1l7i s LYS 117 N -1.32 0.14 0.56 4.92 -0.14 0.12 -4.95 119.74 119.07 1l7i s LYS 117 Ca 0.50 0.42 -0.16 0.00 -1.36 0.00 0.00 55.97 55.37 1l7i s LYS 117 Cb -0.38 -0.14 -0.06 0.00 -1.68 0.00 0.00 37.83 35.58 1l7i s LYS 117 CO 0.47 -0.15 1.02 0.20 -0.76 0.00 0.00 175.35 176.13 1l7i s GLY 118 N 1.12 2.06 0.48 -3.33 0.00 -1.26 -1.27 107.32 105.12 1l7i s GLY 118 Ca -0.09 0.25 -0.12 0.00 0.00 0.00 0.00 44.72 44.77 1l7i s GLY 118 CO -0.06 0.54 0.87 2.56 0.00 0.00 0.00 173.10 177.01 1l7i s PRO 119 N -4.16 3.77 0.18 2.90 0.04 -1.26 -4.53 135.00 131.95 1l7i s PRO 119 Ca 0.61 0.62 -0.10 0.00 0.04 0.00 0.00 61.00 62.17 1l7i s PRO 119 Cb -0.13 -2.27 -0.07 0.00 0.04 0.00 0.00 34.50 32.08 1l7i s PRO 119 CO 0.35 -0.20 0.50 -1.12 0.04 0.00 0.00 177.00 176.57 1l7i s SER 120 N -3.39 6.64 -0.17 6.66 0.01 -0.03 -4.91 113.70 118.51 1l7i s SER 120 Ca 0.54 0.88 -0.00 0.00 1.31 0.00 0.00 55.95 58.67 1l7i s SER 120 Cb -0.10 -2.21 0.04 0.00 0.21 0.00 0.00 66.02 63.96 1l7i s SER 120 CO 0.36 0.01 -0.06 -0.69 0.41 0.00 0.00 173.24 173.27 1l7i s VAL 121 N -1.68 1.19 0.04 3.43 1.01 -1.26 -1.23 120.40 121.90 1l7i s VAL 121 Ca 0.43 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 61.77 1l7i s VAL 121 Cb -0.12 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 1l7i s VAL 121 CO 0.21 0.13 -0.15 -0.36 0.00 0.00 0.00 175.10 174.92 1l7i s PHE 122 N 1.59 2.63 0.40 5.22 0.08 -0.28 -4.95 117.98 122.67 1l7i s PHE 122 Ca 0.00 -0.21 -0.23 0.00 0.12 0.00 0.00 56.93 56.62 1l7i s PHE 122 Cb -0.15 -1.49 -0.10 0.00 -0.57 0.00 0.00 43.02 40.71 1l7i s PHE 122 CO -0.08 0.29 0.97 -1.25 -0.10 0.00 0.00 175.22 175.05 1l7i s PRO 123 N -1.50 4.31 -0.70 0.24 0.04 -1.26 -0.22 135.00 135.90 1l7i s PRO 123 Ca 0.16 1.25 -0.04 0.00 0.04 0.00 0.00 61.00 62.40 1l7i s PRO 123 Cb -0.11 -2.42 0.18 0.00 0.04 0.00 0.00 34.50 32.20 1l7i s PRO 123 CO 0.06 0.03 0.54 -0.51 0.04 0.00 0.00 177.00 177.17 1l7i s LEU 124 N -2.77 5.50 0.15 -3.56 1.43 0.14 -4.79 118.68 114.78 1l7i s LEU 124 Ca 0.58 -2.99 -0.31 0.00 -1.03 0.00 0.00 54.13 50.38 1l7i s LEU 124 Cb -0.14 -1.91 -0.09 0.00 0.03 0.00 0.00 46.19 44.08 1l7i s LEU 124 CO 0.19 -0.36 1.38 0.00 0.23 0.00 0.00 176.35 177.79 1l7i s ALA 125 N -0.27 3.59 0.38 4.21 0.00 -1.26 -1.27 121.76 127.14 1l7i s ALA 125 Ca 0.19 1.15 -0.25 0.00 0.00 0.00 0.00 51.96 53.05 1l7i s ALA 125 Cb -0.17 -3.53 -0.09 0.00 0.00 0.00 0.00 23.12 19.33 1l7i s ALA 125 CO -0.05 -0.62 1.07 -1.25 0.00 0.00 0.00 175.76 174.91 1l7i s PRO 126 N 0.62 4.23 0.17 0.00 0.04 -1.26 -4.80 135.00 134.01 1l7i s PRO 126 Ca 0.62 1.59 -0.06 0.00 0.04 0.00 0.00 61.00 63.19 1l7i s PRO 126 Cb -0.38 -2.66 0.02 0.00 0.04 0.00 0.00 34.50 31.53 1l7i s PRO 126 CO 0.34 -0.10 0.34 -1.13 0.04 0.00 0.00 177.00 176.48 1l7i n SER 127 N 0.15 -0.98 0.25 6.66 3.41 -1.26 -1.20 113.62 120.64 1l7i n SER 127 Ca 0.04 -1.72 0.08 0.00 -0.26 0.00 0.00 58.87 57.01 1l7i n SER 127 Cb 0.49 1.64 0.62 0.00 -0.26 0.00 0.00 64.21 66.70 1l7i n SER 127 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1l7i h SER 128 N 0.88 0.00 0.52 4.04 4.64 -1.82 -0.85 113.55 120.96 1l7i h SER 128 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1l7i h SER 128 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1l7i h SER 128 CO 0.19 0.07 0.00 0.29 -0.87 0.00 0.00 176.83 176.50 1l7i n LYS 129 N -4.37 0.06 -0.87 4.77 4.76 -1.26 -2.38 118.16 118.86 1l7i n LYS 129 Ca -0.03 0.32 0.05 0.00 -2.87 0.00 0.00 58.31 55.79 1l7i n LYS 129 Cb 0.15 -1.62 0.13 0.00 -1.84 0.00 0.00 35.03 31.85 1l7i n LYS 129 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1l7i n SER 130 N -1.73 1.42 -4.13 4.39 3.41 -0.34 -5.02 113.62 111.62 1l7i n SER 130 Ca 0.03 -3.07 -0.29 0.00 -0.26 0.00 0.00 58.87 55.27 1l7i n SER 130 Cb 0.17 -0.42 -0.17 0.00 -0.26 0.00 0.00 64.21 63.53 1l7i n SER 130 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1l7i s THR 131 N -1.90 1.71 -0.48 6.66 2.01 -1.00 -0.22 115.64 122.41 1l7i s THR 131 Ca 0.34 -0.80 0.03 0.00 0.31 0.00 0.00 61.69 61.57 1l7i s THR 131 Cb 0.35 -1.51 0.14 0.00 0.01 0.00 0.00 72.50 71.50 1l7i s THR 131 CO -0.09 0.48 0.29 -0.44 -0.69 0.00 0.00 174.62 174.16 1l7i s SER 132 N 0.58 3.66 1.35 3.53 0.01 0.21 -4.96 113.70 118.06 1l7i s SER 132 Ca -0.15 -2.88 0.00 0.00 1.31 0.00 0.00 55.95 54.23 1l7i s SER 132 Cb -0.17 -1.12 0.00 0.00 0.21 0.00 0.00 66.02 64.95 1l7i s SER 132 CO 0.05 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.08 1l7i n GLY 133 N 3.21 2.23 0.71 3.44 0.00 -1.26 -2.35 105.19 111.17 1l7i n GLY 133 Ca 0.12 -0.14 0.11 0.00 0.00 0.00 0.00 46.02 46.10 1l7i n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l7i n GLY 134 N 0.00 0.66 3.24 -0.02 0.00 -1.26 -4.72 105.19 103.09 1l7i n GLY 134 Ca 0.00 -0.50 -0.32 0.00 0.00 0.00 0.00 46.02 45.21 1l7i n GLY 134 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l7i s THR 135 N -1.70 2.04 0.03 2.61 2.01 -0.99 0.02 115.64 119.66 1l7i s THR 135 Ca 0.33 -1.03 0.06 0.00 0.31 0.00 0.00 61.69 61.36 1l7i s THR 135 Cb 0.18 -1.75 -0.02 0.00 0.01 0.00 0.00 72.50 70.92 1l7i s THR 135 CO 0.27 0.56 -0.18 0.00 -0.69 0.00 0.00 174.62 174.58 1l7i s ALA 136 N 0.13 1.52 0.08 7.40 0.00 -0.03 0.63 121.76 131.49 1l7i s ALA 136 Ca -0.12 -0.93 0.06 0.00 0.00 0.00 0.00 51.96 50.97 1l7i s ALA 136 Cb -0.16 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.63 1l7i s ALA 136 CO 0.07 0.33 -0.11 0.00 0.00 0.00 0.00 175.76 176.05 1l7i s ALA 137 N -0.75 2.90 0.27 0.00 0.00 0.69 -0.83 121.76 124.05 1l7i s ALA 137 Ca 0.05 -1.20 -0.17 0.00 0.00 0.00 0.00 51.96 50.65 1l7i s ALA 137 Cb -0.08 -0.91 0.01 0.00 0.00 0.00 0.00 23.12 22.14 1l7i s ALA 137 CO 0.01 0.63 0.61 -0.48 0.00 0.00 0.00 175.76 176.53 1l7i s LEU 138 N -1.95 0.04 0.00 0.00 0.05 -0.81 -4.26 118.68 111.75 1l7i s LEU 138 Ca 0.19 -0.80 0.00 0.00 0.05 0.00 0.00 54.13 53.58 1l7i s LEU 138 Cb -0.11 2.27 0.00 0.00 -2.05 0.00 0.00 46.19 46.30 1l7i s LEU 138 CO 0.11 -1.27 0.00 0.61 -0.55 0.00 0.00 176.35 175.25 1l7i n GLY 139 N -0.43 -0.87 2.90 -3.48 0.00 -0.40 -0.83 105.19 102.08 1l7i n GLY 139 Ca -0.03 -0.78 -0.14 0.00 0.00 0.00 0.00 46.02 45.07 1l7i n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l7i s LEU 141 N -0.03 4.06 -0.48 0.00 2.96 0.69 -0.94 118.68 124.94 1l7i s LEU 141 Ca 0.01 -0.44 -0.14 0.00 -0.22 0.00 0.00 54.13 53.34 1l7i s LEU 141 Cb -0.01 -2.01 0.10 0.00 0.50 0.00 0.00 46.19 44.76 1l7i s LEU 141 CO -0.00 -0.17 0.40 -0.69 -1.32 0.00 0.00 176.35 174.57 1l7i s VAL 142 N 1.63 4.94 0.09 1.68 1.01 0.11 -1.13 120.40 128.74 1l7i s VAL 142 Ca 0.05 -1.33 0.09 0.00 0.00 0.00 0.00 61.98 60.79 1l7i s VAL 142 Cb -0.17 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 1l7i s VAL 142 CO 0.07 -0.67 -0.20 -0.75 0.00 0.00 0.00 175.10 173.54 1l7i s LYS 143 N 1.56 1.80 -1.13 2.72 2.20 -0.36 -0.78 119.74 125.74 1l7i s LYS 143 Ca 0.04 -1.15 -0.03 0.00 -0.36 0.00 0.00 55.97 54.47 1l7i s LYS 143 Cb -0.26 -2.09 -0.03 0.00 -1.51 0.00 0.00 37.83 33.94 1l7i s LYS 143 CO 0.04 0.49 0.94 -0.25 -0.36 0.00 0.00 175.35 176.22 1l7i n ASP 144 N 1.12 -4.22 -4.55 1.43 8.00 -0.37 -0.85 116.55 117.11 1l7i n ASP 144 Ca -0.16 -0.68 -0.26 0.00 0.71 0.00 0.00 54.79 54.40 1l7i n ASP 144 Cb 0.52 -5.07 -0.11 0.00 -0.02 0.00 0.00 41.12 36.44 1l7i n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1l7i s TYR 145 N -3.39 2.39 -0.29 1.24 1.13 -0.92 -4.42 117.35 113.10 1l7i s TYR 145 Ca 0.22 -0.53 -0.23 0.00 -1.41 0.00 0.00 57.07 55.13 1l7i s TYR 145 Cb -0.03 -1.41 0.14 0.00 -1.10 0.00 0.00 41.96 39.56 1l7i s TYR 145 CO 0.74 0.55 1.11 0.12 -2.51 0.00 0.00 175.55 175.57 1l7i s PHE 146 N -2.64 -0.40 0.07 -3.49 2.19 -0.40 -0.70 117.98 112.62 1l7i s PHE 146 Ca 0.33 0.92 -0.00 0.00 0.33 0.00 0.00 56.93 58.51 1l7i s PHE 146 Cb 0.03 0.37 0.01 0.00 -1.31 0.00 0.00 43.02 42.13 1l7i s PHE 146 CO 0.16 -0.19 0.09 -0.35 1.83 0.00 0.00 175.22 176.77 1l7i n PRO 147 N 2.40 0.52 -1.42 10.12 -0.04 -1.26 0.16 135.00 145.47 1l7i n PRO 147 Ca -0.13 -0.25 -0.31 0.00 -0.04 0.00 0.00 63.50 62.77 1l7i n PRO 147 Cb 0.56 -0.07 0.07 0.00 -0.04 0.00 0.00 33.50 34.03 1l7i n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1l7i s GLU 148 N -2.67 2.58 0.47 0.54 0.41 -1.26 -4.78 118.70 113.99 1l7i s GLU 148 Ca 0.06 1.09 0.05 0.00 -0.41 0.00 0.00 54.97 55.76 1l7i s GLU 148 Cb -0.00 -1.94 -0.03 0.00 -1.78 0.00 0.00 34.13 30.38 1l7i s GLU 148 CO 0.04 -1.39 0.13 -1.25 -0.49 0.00 0.00 175.26 172.31 1l7i s PRO 149 N -4.91 2.17 0.09 0.39 0.04 -1.26 -4.96 135.00 126.56 1l7i s PRO 149 Ca 0.60 -2.11 0.08 0.00 0.04 0.00 0.00 61.00 59.61 1l7i s PRO 149 Cb -0.16 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 32.56 1l7i s PRO 149 CO 0.55 -0.28 -0.21 0.14 0.04 0.00 0.00 177.00 177.23 1l7i s VAL 150 N -2.75 1.74 -0.03 -0.36 -7.23 -1.26 -4.45 120.40 106.07 1l7i s VAL 150 Ca 0.27 -1.50 0.06 0.00 -1.81 0.00 0.00 61.98 59.00 1l7i s VAL 150 Cb 0.03 -1.57 -0.02 0.00 0.56 0.00 0.00 36.38 35.38 1l7i s VAL 150 CO 0.15 -0.00 -0.20 0.42 -0.31 0.00 0.00 175.10 175.15 1l7i s THR 151 N -1.09 2.57 -0.04 5.32 -4.23 -0.39 -4.98 115.64 112.81 1l7i s THR 151 Ca 0.07 -0.94 0.03 0.00 -1.18 0.00 0.00 61.69 59.67 1l7i s THR 151 Cb -0.10 -1.96 0.01 0.00 1.34 0.00 0.00 72.50 71.79 1l7i s THR 151 CO 0.04 0.57 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.90 1l7i s VAL 152 N -0.69 0.91 0.25 2.29 1.01 -1.26 -1.29 120.40 121.62 1l7i s VAL 152 Ca 0.11 -0.40 0.03 0.00 0.00 0.00 0.00 61.98 61.72 1l7i s VAL 152 Cb -0.10 -0.82 -0.05 0.00 0.00 0.00 0.00 36.38 35.41 1l7i s VAL 152 CO 0.00 0.29 0.03 -0.94 0.00 0.00 0.00 175.10 174.47 1l7i s SER 153 N 0.34 1.74 -0.09 3.32 1.04 -0.55 -4.97 113.70 114.53 1l7i s SER 153 Ca -0.06 -1.28 0.04 0.00 0.48 0.00 0.00 55.95 55.13 1l7i s SER 153 Cb -0.11 0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.05 1l7i s SER 153 CO 0.01 -0.58 -0.21 0.26 0.98 0.00 0.00 173.24 173.70 1l7i s TRP 154 N -3.49 2.28 -1.41 5.02 0.52 -1.26 -0.64 118.94 119.97 1l7i s TRP 154 Ca 0.31 -0.89 -0.04 0.00 0.02 0.00 0.00 56.10 55.50 1l7i s TRP 154 Cb 0.07 -1.54 0.03 0.00 -1.15 0.00 0.00 33.47 30.87 1l7i s TRP 154 CO 0.11 -0.36 0.68 0.09 0.02 0.00 0.00 176.95 177.48 1l7i n ASN 155 N 3.53 -1.75 -3.41 2.95 3.02 0.03 -1.32 115.26 118.30 1l7i n ASN 155 Ca -0.20 -0.88 -0.25 0.00 -0.03 0.00 0.00 54.58 53.22 1l7i n ASN 155 Cb 0.53 -3.64 0.03 0.00 -0.61 0.00 0.00 39.78 36.08 1l7i n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1l7i n SER 156 N -2.97 -5.19 0.00 6.41 7.64 -1.26 -1.25 113.62 117.00 1l7i n SER 156 Ca -0.21 -0.47 0.00 0.00 1.01 0.00 0.00 58.87 59.20 1l7i n SER 156 Cb 0.64 -4.18 0.00 0.00 -1.01 0.00 0.00 64.21 59.66 1l7i n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1l7i n GLY 157 N -1.54 0.91 0.15 0.23 0.00 -0.43 -4.90 105.19 99.61 1l7i n GLY 157 Ca -0.03 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.96 1l7i n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l7i h ALA 158 N 0.00 0.94 -3.05 4.61 0.00 -0.94 -3.41 119.26 117.42 1l7i h ALA 158 Ca 0.00 -0.55 -0.68 0.00 0.00 0.00 0.00 54.91 53.68 1l7i h ALA 158 Cb 0.00 -0.09 -0.27 0.00 0.00 0.00 0.00 17.79 17.43 1l7i h ALA 158 CO 0.00 0.75 -0.63 -1.17 0.00 0.00 0.00 179.25 178.20 1l7i s LEU 159 N -7.72 3.81 0.00 0.00 2.96 -0.97 -4.92 118.68 111.84 1l7i s LEU 159 Ca -0.02 -0.74 0.00 0.00 -0.22 0.00 0.00 54.13 53.15 1l7i s LEU 159 Cb 0.12 -1.86 0.00 0.00 0.50 0.00 0.00 46.19 44.95 1l7i s LEU 159 CO 0.77 -0.19 0.00 0.35 -1.32 0.00 0.00 176.35 175.96 1l7i n THR 160 N 4.85 0.00 -2.28 3.68 -2.24 -1.26 -4.12 114.28 112.91 1l7i n THR 160 Ca -0.15 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.23 1l7i n THR 160 Cb 0.48 -0.60 -0.03 0.00 -2.10 0.00 0.00 70.33 68.08 1l7i n THR 160 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1l7i s SER 161 N -3.00 6.99 0.00 3.42 1.04 -1.26 -2.74 113.70 118.14 1l7i s SER 161 Ca 0.00 2.43 0.00 0.00 0.48 0.00 0.00 55.95 58.86 1l7i s SER 161 Cb 0.00 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.49 1l7i s SER 161 CO 0.00 -0.40 0.00 0.61 0.98 0.00 0.00 173.24 174.43 1l7i n GLY 162 N 1.52 0.82 3.77 7.32 0.00 -1.26 -4.77 105.19 112.58 1l7i n GLY 162 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 1l7i n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1l7i s VAL 163 N -3.17 4.81 -0.21 1.61 1.01 -1.11 -1.86 120.40 121.48 1l7i s VAL 163 Ca 0.00 1.36 -0.03 0.00 0.00 0.00 0.00 61.98 63.31 1l7i s VAL 163 Cb 0.00 -3.98 0.07 0.00 0.00 0.00 0.00 36.38 32.47 1l7i s VAL 163 CO 0.00 0.43 0.06 -1.00 0.00 0.00 0.00 175.10 174.59 1l7i s HIS 164 N -0.37 0.89 -0.40 5.22 3.76 0.81 -4.99 115.29 120.20 1l7i s HIS 164 Ca 0.33 -0.84 -0.11 0.00 -0.15 0.00 0.00 55.06 54.29 1l7i s HIS 164 Cb -0.19 -1.02 0.05 0.00 1.11 0.00 0.00 32.58 32.53 1l7i s HIS 164 CO 0.19 -0.63 0.24 0.99 -0.85 0.00 0.00 174.74 174.68 1l7i s THR 165 N 1.90 4.47 0.56 1.30 2.01 -1.26 -0.63 115.64 123.99 1l7i s THR 165 Ca 0.01 -1.09 -0.18 0.00 0.31 0.00 0.00 61.69 60.74 1l7i s THR 165 Cb -0.17 -3.60 -0.05 0.00 0.01 0.00 0.00 72.50 68.69 1l7i s THR 165 CO -0.12 -0.37 1.10 -0.36 -0.69 0.00 0.00 174.62 174.19 1l7i s PHE 166 N 1.51 2.77 0.39 4.92 0.40 -0.71 -4.99 117.98 122.27 1l7i s PHE 166 Ca 0.02 1.55 -0.27 0.00 -0.60 0.00 0.00 56.93 57.63 1l7i s PHE 166 Cb -0.21 -3.19 -0.10 0.00 0.51 0.00 0.00 43.02 40.03 1l7i s PHE 166 CO 0.05 -1.39 1.46 -2.14 0.70 0.00 0.00 175.22 173.90 1l7i s PRO 167 N -3.49 4.03 0.65 0.24 0.02 -1.26 -4.62 135.00 130.56 1l7i s PRO 167 Ca 0.70 2.51 -0.16 0.00 0.02 0.00 0.00 61.00 64.07 1l7i s PRO 167 Cb -0.21 -2.90 -0.00 0.00 0.02 0.00 0.00 34.50 31.41 1l7i s PRO 167 CO 0.29 -0.58 1.15 0.00 -0.33 0.00 0.00 177.00 177.53 1l7i s ALA 168 N -1.14 2.43 0.02 -1.55 0.00 -1.26 -4.86 121.76 115.40 1l7i s ALA 168 Ca 0.54 0.73 0.07 0.00 0.00 0.00 0.00 51.96 53.31 1l7i s ALA 168 Cb -0.45 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.26 1l7i s ALA 168 CO 0.61 -1.33 -0.20 0.14 0.00 0.00 0.00 175.76 174.98 1l7i s VAL 169 N -2.07 2.58 -0.35 0.00 -7.23 -0.04 -4.93 120.40 108.38 1l7i s VAL 169 Ca 0.71 -1.16 -0.19 0.00 -1.81 0.00 0.00 61.98 59.53 1l7i s VAL 169 Cb -0.24 -2.03 -0.00 0.00 0.56 0.00 0.00 36.38 34.66 1l7i s VAL 169 CO 0.39 0.41 0.57 -0.22 -0.31 0.00 0.00 175.10 175.94 1l7i s LEU 170 N -1.18 4.29 0.84 1.32 2.96 -1.26 -1.51 118.68 124.15 1l7i s LEU 170 Ca 0.13 0.08 -0.12 0.00 -0.22 0.00 0.00 54.13 54.00 1l7i s LEU 170 Cb -0.10 -2.67 0.10 0.00 0.50 0.00 0.00 46.19 44.01 1l7i s LEU 170 CO 0.03 -0.52 1.16 -1.10 -1.32 0.00 0.00 176.35 174.60 1l7i s GLN 171 N 2.52 1.71 0.49 1.98 -0.21 -0.07 -4.93 119.66 121.15 1l7i s GLN 171 Ca 0.21 0.22 0.16 0.00 0.02 0.00 0.00 55.36 55.97 1l7i s GLN 171 Cb -0.15 -1.91 1.17 0.00 1.00 0.00 0.00 33.01 33.11 1l7i s GLN 171 CO 0.14 -1.79 2.08 0.77 -2.12 0.00 0.00 175.29 174.37 1l7i h SER 172 N -1.20 0.00 0.52 5.90 0.02 -1.97 -1.44 113.55 115.38 1l7i h SER 172 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 1l7i h SER 172 Cb 1.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.86 1l7i h SER 172 CO 0.64 0.08 0.00 0.77 -1.14 0.00 0.00 176.83 177.18 1l7i h SER 173 N 0.00 0.00 0.00 3.07 4.64 -2.03 -3.45 113.55 115.78 1l7i h SER 173 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1l7i h SER 173 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1l7i h SER 173 CO 0.01 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 1l7i n GLY 174 N -0.45 0.77 3.67 -0.77 0.00 -0.54 -5.07 105.19 102.80 1l7i n GLY 174 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1l7i n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l7i s LEU 175 N 0.00 3.40 0.48 0.99 1.43 -1.26 -4.88 118.68 118.85 1l7i s LEU 175 Ca 0.00 -0.17 -0.06 0.00 -1.03 0.00 0.00 54.13 52.87 1l7i s LEU 175 Cb 0.00 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 1l7i s LEU 175 CO 0.00 0.20 0.80 -0.31 0.23 0.00 0.00 176.35 177.27 1l7i s TYR 176 N -1.24 3.56 -0.15 0.29 2.02 0.13 -0.89 117.35 121.06 1l7i s TYR 176 Ca 0.24 0.87 -0.20 0.00 -0.37 0.00 0.00 57.07 57.60 1l7i s TYR 176 Cb -0.12 -2.34 0.05 0.00 -0.40 0.00 0.00 41.96 39.15 1l7i s TYR 176 CO 0.16 -0.29 0.53 0.45 -1.57 0.00 0.00 175.55 174.83 1l7i s SER 177 N -4.02 -0.52 0.17 2.29 0.15 -0.57 -1.24 113.70 109.96 1l7i s SER 177 Ca 0.48 0.88 -0.18 0.00 0.70 0.00 0.00 55.95 57.84 1l7i s SER 177 Cb -0.10 0.90 0.03 0.00 -1.71 0.00 0.00 66.02 65.14 1l7i s SER 177 CO 0.44 -0.30 0.50 -1.48 1.20 0.00 0.00 173.24 173.60 1l7i s LEU 178 N -0.19 0.09 0.12 3.45 0.05 0.04 -0.86 118.68 121.38 1l7i s LEU 178 Ca -0.04 -0.38 0.09 0.00 0.05 0.00 0.00 54.13 53.85 1l7i s LEU 178 Cb -0.03 2.11 -0.04 0.00 -2.05 0.00 0.00 46.19 46.17 1l7i s LEU 178 CO 0.03 -0.98 -0.21 -0.44 -0.55 0.00 0.00 176.35 174.20 1l7i s SER 179 N -2.84 2.68 -0.08 1.48 0.01 -1.26 0.09 113.70 113.79 1l7i s SER 179 Ca 0.06 -0.74 0.02 0.00 1.31 0.00 0.00 55.95 56.60 1l7i s SER 179 Cb -0.00 -0.16 0.01 0.00 0.21 0.00 0.00 66.02 66.09 1l7i s SER 179 CO -0.07 0.05 -0.13 -0.55 0.41 0.00 0.00 173.24 172.96 1l7i s SER 180 N -2.14 2.01 0.20 2.44 0.15 -0.11 -1.74 113.70 114.50 1l7i s SER 180 Ca 0.10 -0.33 0.07 0.00 0.70 0.00 0.00 55.95 56.48 1l7i s SER 180 Cb -0.09 -0.90 -0.05 0.00 -1.71 0.00 0.00 66.02 63.27 1l7i s SER 180 CO 0.05 0.01 -0.11 0.68 1.20 0.00 0.00 173.24 175.07 1l7i s VAL 181 N 0.87 1.55 -0.07 4.45 -7.23 0.20 -0.75 120.40 119.42 1l7i s VAL 181 Ca -0.10 -2.16 -0.06 0.00 -1.81 0.00 0.00 61.98 57.85 1l7i s VAL 181 Cb -0.15 -2.07 0.02 0.00 0.56 0.00 0.00 36.38 34.73 1l7i s VAL 181 CO 0.01 -0.57 0.18 0.54 -0.31 0.00 0.00 175.10 174.95 1l7i s VAL 182 N -3.09 0.00 -0.11 1.32 0.11 -0.01 -0.14 120.40 118.48 1l7i s VAL 182 Ca 0.22 -0.02 -0.03 0.00 -2.93 0.00 0.00 61.98 59.22 1l7i s VAL 182 Cb 0.01 -0.26 -0.03 0.00 -1.53 0.00 0.00 36.38 34.56 1l7i s VAL 182 CO 0.06 -0.01 0.02 0.42 -3.33 0.00 0.00 175.10 172.26 1l7i s THR 183 N 0.04 4.43 0.11 5.04 -4.23 -0.78 -1.93 115.64 118.33 1l7i s THR 183 Ca -0.01 -0.19 0.01 0.00 -1.18 0.00 0.00 61.69 60.32 1l7i s THR 183 Cb -0.01 -2.90 -0.04 0.00 1.34 0.00 0.00 72.50 70.88 1l7i s THR 183 CO 0.00 0.57 -0.03 0.68 -0.54 0.00 0.00 174.62 175.31 1l7i s VAL 184 N -0.54 0.51 0.34 2.29 -7.23 -0.01 -4.64 120.40 111.12 1l7i s VAL 184 Ca 0.09 -1.92 -0.28 0.00 -1.81 0.00 0.00 61.98 58.07 1l7i s VAL 184 Cb -0.12 -1.80 -0.10 0.00 0.56 0.00 0.00 36.38 34.92 1l7i s VAL 184 CO 0.02 -0.75 1.25 -2.16 -0.31 0.00 0.00 175.10 173.16 1l7i s PRO 185 N -3.90 4.32 0.53 4.82 0.04 -1.26 -0.85 135.00 138.69 1l7i s PRO 185 Ca 0.15 2.09 0.23 0.00 0.04 0.00 0.00 61.00 63.52 1l7i s PRO 185 Cb 0.06 -3.01 1.37 0.00 0.04 0.00 0.00 34.50 32.96 1l7i s PRO 185 CO -0.03 -0.17 2.03 0.77 0.04 0.00 0.00 177.00 179.64 1l7i h SER 186 N 3.28 0.00 0.56 6.66 0.02 -0.69 -1.39 113.55 122.00 1l7i h SER 186 Ca -0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 1l7i h SER 186 Cb 1.23 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.77 1l7i h SER 186 CO 0.65 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 174.80 1l7i n SER 187 N -4.42 0.19 0.00 3.07 3.41 -1.26 -2.89 113.62 111.73 1l7i n SER 187 Ca 0.07 0.55 0.11 0.00 -0.26 0.00 0.00 58.87 59.33 1l7i n SER 187 Cb 0.49 -0.59 -0.08 0.00 -0.26 0.00 0.00 64.21 63.77 1l7i n SER 187 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1l7i n SER 188 N -1.71 0.63 -0.02 4.04 3.41 -0.52 -4.60 113.62 114.84 1l7i n SER 188 Ca 0.03 -0.51 -0.01 0.00 -0.26 0.00 0.00 58.87 58.11 1l7i n SER 188 Cb 0.19 1.17 -0.01 0.00 -0.26 0.00 0.00 64.21 65.30 1l7i n SER 188 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1l7i h LEU 189 N 0.00 -0.20 0.00 1.04 3.38 -1.63 0.11 115.31 118.01 1l7i h LEU 189 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1l7i h LEU 189 Cb 0.69 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1l7i h LEU 189 CO 0.00 -0.04 0.00 0.61 0.09 0.00 0.00 178.44 179.10 1l7i n GLY 190 N -1.04 -0.90 0.07 0.83 0.00 -1.26 -3.23 105.19 99.65 1l7i n GLY 190 Ca -0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 46.02 45.93 1l7i n GLY 190 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1l7i n THR 191 N -1.37 0.87 -4.45 2.61 -2.24 -0.79 -4.98 114.28 103.92 1l7i n THR 191 Ca 0.06 -0.71 -0.31 0.00 -2.27 0.00 0.00 64.05 60.82 1l7i n THR 191 Cb 0.15 -0.30 -0.11 0.00 -2.10 0.00 0.00 70.33 67.97 1l7i n THR 191 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1l7i s GLN 192 N -2.83 2.39 -0.01 -0.78 2.00 0.31 -5.11 119.66 115.62 1l7i s GLN 192 Ca -0.09 -0.83 -0.16 0.00 -2.00 0.00 0.00 55.36 52.28 1l7i s GLN 192 Cb 0.09 -2.41 -0.06 0.00 0.80 0.00 0.00 33.01 31.43 1l7i s GLN 192 CO 0.83 0.57 0.45 0.99 -0.50 0.00 0.00 175.29 177.64 1l7i s THR 193 N -1.03 5.00 -0.19 -0.34 2.01 -1.26 -4.82 115.64 115.01 1l7i s THR 193 Ca 0.18 0.93 0.01 0.00 0.31 0.00 0.00 61.69 63.12 1l7i s THR 193 Cb -0.11 -3.77 0.04 0.00 0.01 0.00 0.00 72.50 68.67 1l7i s THR 193 CO 0.08 0.52 -0.11 -0.31 -0.69 0.00 0.00 174.62 174.12 1l7i s TYR 194 N -0.74 2.37 -0.08 4.92 2.02 -1.26 -4.96 117.35 119.63 1l7i s TYR 194 Ca 0.25 -1.53 0.03 0.00 -0.37 0.00 0.00 57.07 55.45 1l7i s TYR 194 Cb -0.17 -1.63 0.01 0.00 -0.40 0.00 0.00 41.96 39.77 1l7i s TYR 194 CO 0.14 -0.73 -0.18 0.42 -1.57 0.00 0.00 175.55 173.63 1l7i s ILE 195 N 1.41 1.58 -0.17 2.71 1.01 -1.26 -0.23 121.20 126.24 1l7i s ILE 195 Ca -0.00 -0.74 -0.10 0.00 0.00 0.00 0.00 60.65 59.80 1l7i s ILE 195 Cb -0.16 -1.39 -0.05 0.00 0.01 0.00 0.00 42.46 40.88 1l7i s ILE 195 CO -0.09 0.45 0.17 0.00 0.00 0.00 0.00 174.94 175.48 1l7i s ASN 197 N 0.03 5.52 -0.14 0.00 -0.87 0.19 -1.40 114.94 118.27 1l7i s ASN 197 Ca 0.12 -0.73 -0.03 0.00 -1.57 0.00 0.00 52.86 50.64 1l7i s ASN 197 Cb -0.12 -1.98 -0.03 0.00 -0.02 0.00 0.00 41.25 39.10 1l7i s ASN 197 CO 0.01 -0.26 -0.02 -0.69 -2.57 0.00 0.00 177.10 173.57 1l7i s VAL 198 N 1.56 4.07 -0.11 1.60 1.01 0.78 -1.48 120.40 127.83 1l7i s VAL 198 Ca 0.03 -0.31 -0.01 0.00 0.00 0.00 0.00 61.98 61.69 1l7i s VAL 198 Cb -0.18 -2.76 0.03 0.00 0.00 0.00 0.00 36.38 33.47 1l7i s VAL 198 CO 0.06 0.52 -0.04 0.21 0.00 0.00 0.00 175.10 175.84 1l7i s ASN 199 N 0.01 2.10 -0.62 3.32 3.04 -0.41 -0.42 114.94 121.96 1l7i s ASN 199 Ca 0.02 -0.30 0.00 0.00 0.04 0.00 0.00 52.86 52.62 1l7i s ASN 199 Cb -0.13 -0.71 0.16 0.00 -1.54 0.00 0.00 41.25 39.02 1l7i s ASN 199 CO 0.02 -0.16 0.41 -2.28 -3.04 0.00 0.00 177.10 172.05 1l7i s HIS 200 N 1.79 3.37 0.24 0.43 5.65 0.31 -1.26 115.29 125.82 1l7i s HIS 200 Ca 0.04 -2.97 -0.05 0.00 0.25 0.00 0.00 55.06 52.33 1l7i s HIS 200 Cb -0.13 -3.02 0.43 0.00 -1.18 0.00 0.00 32.58 28.68 1l7i s HIS 200 CO -0.07 -0.77 1.75 0.87 -0.65 0.00 0.00 174.74 175.87 1l7i h LYS 201 N 6.59 0.50 -0.99 2.88 1.57 -1.78 -1.79 116.57 123.54 1l7i h LYS 201 Ca -0.01 -0.03 0.23 0.00 -1.87 0.00 0.00 60.65 58.97 1l7i h LYS 201 Cb 0.90 -0.11 -0.09 0.00 0.08 0.00 0.00 32.23 33.01 1l7i h LYS 201 CO 0.71 0.33 0.63 -1.35 -0.57 0.00 0.00 179.45 179.21 1l7i h PRO 202 N 0.51 0.49 -0.48 3.15 0.11 -1.92 0.28 132.00 134.15 1l7i h PRO 202 Ca 0.40 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.48 1l7i h PRO 202 Cb 0.55 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.55 1l7i h PRO 202 CO -0.35 0.32 0.00 -1.13 -0.21 0.00 0.00 178.00 176.63 1l7i n SER 203 N -4.63 3.46 -3.97 -2.05 3.41 -0.90 -4.95 113.62 103.99 1l7i n SER 203 Ca 0.23 -1.96 -0.30 0.00 -0.26 0.00 0.00 58.87 56.58 1l7i n SER 203 Cb 0.74 -0.32 0.01 0.00 -0.26 0.00 0.00 64.21 64.38 1l7i n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1l7i n ASN 204 N 1.32 -3.48 -4.42 4.04 4.13 0.10 -4.93 115.26 112.02 1l7i n ASN 204 Ca 0.19 -0.87 -0.32 0.00 1.68 0.00 0.00 54.58 55.26 1l7i n ASN 204 Cb 0.56 -3.55 -0.14 0.00 -1.54 0.00 0.00 39.78 35.11 1l7i n ASN 204 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1l7i s THR 205 N -3.42 2.86 -0.05 3.41 -4.23 -0.85 -5.01 115.64 108.35 1l7i s THR 205 Ca 0.52 -0.79 -0.00 0.00 -1.18 0.00 0.00 61.69 60.24 1l7i s THR 205 Cb -0.27 -2.11 0.03 0.00 1.34 0.00 0.00 72.50 71.48 1l7i s THR 205 CO 0.86 0.58 -0.01 -0.54 -0.54 0.00 0.00 174.62 174.97 1l7i s LYS 206 N -0.49 0.57 0.01 3.99 1.02 -1.26 -0.53 119.74 123.04 1l7i s LYS 206 Ca 0.06 0.06 0.05 0.00 0.02 0.00 0.00 55.97 56.16 1l7i s LYS 206 Cb -0.12 -0.81 -0.02 0.00 -0.52 0.00 0.00 37.83 36.36 1l7i s LYS 206 CO 0.01 -0.21 -0.15 0.08 -0.92 0.00 0.00 175.35 174.17 1l7i s VAL 207 N 1.51 1.15 -0.03 3.17 1.01 0.44 -5.00 120.40 122.66 1l7i s VAL 207 Ca -0.02 -0.78 0.06 0.00 0.00 0.00 0.00 61.98 61.24 1l7i s VAL 207 Cb -0.13 -0.99 -0.02 0.00 0.00 0.00 0.00 36.38 35.23 1l7i s VAL 207 CO -0.03 0.20 -0.22 -1.81 0.00 0.00 0.00 175.10 173.25 1l7i s ASP 208 N -0.66 3.43 -0.10 3.32 1.01 -1.26 -0.16 116.67 122.24 1l7i s ASP 208 Ca 0.04 -0.37 -0.03 0.00 0.71 0.00 0.00 52.55 52.90 1l7i s ASP 208 Cb -0.06 -0.53 0.04 0.00 1.01 0.00 0.00 42.92 43.38 1l7i s ASP 208 CO 0.00 0.33 0.05 -0.75 0.21 0.00 0.00 175.17 175.01 1l7i s LYS 209 N -0.69 0.19 0.00 8.23 2.47 -0.49 -4.97 119.74 124.49 1l7i s LYS 209 Ca 0.11 0.09 -0.30 0.00 -1.56 0.00 0.00 55.97 54.30 1l7i s LYS 209 Cb -0.10 -1.19 -0.04 0.00 -1.46 0.00 0.00 37.83 35.04 1l7i s LYS 209 CO -0.00 -0.46 1.05 0.21 0.16 0.00 0.00 175.35 176.30 1l7i s LYS 210 N 2.08 4.51 -0.33 4.03 2.20 -1.26 -1.48 119.74 129.49 1l7i s LYS 210 Ca 0.03 1.52 -0.08 0.00 -0.36 0.00 0.00 55.97 57.08 1l7i s LYS 210 Cb -0.14 -3.44 0.02 0.00 -1.51 0.00 0.00 37.83 32.76 1l7i s LYS 210 CO -0.06 -0.14 0.13 0.08 -0.36 0.00 0.00 175.35 175.01 1l7i s VAL 211 N 1.15 4.23 0.04 4.02 1.01 0.68 -4.96 120.40 126.58 1l7i s VAL 211 Ca 0.54 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.79 1l7i s VAL 211 Cb -0.23 -3.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 1l7i s VAL 211 CO 0.27 -0.06 -0.04 -1.61 0.00 0.00 0.00 175.10 173.67 1l7i s GLU 212 N 1.52 2.53 0.72 2.72 2.02 -1.26 -4.42 118.70 122.52 1l7i s GLU 212 Ca 0.02 -0.78 -0.16 0.00 0.02 0.00 0.00 54.97 54.07 1l7i s GLU 212 Cb -0.18 -2.51 -0.01 0.00 0.10 0.00 0.00 34.13 31.53 1l7i s GLU 212 CO 0.04 0.57 0.86 -2.30 0.02 0.00 0.00 175.26 174.46 1l7i n PRO 213 N 1.09 0.47 -4.15 0.39 -0.02 -1.26 -4.33 135.00 127.19 1l7i n PRO 213 Ca -0.13 0.21 -0.10 0.00 -2.02 0.00 0.00 63.50 61.46 1l7i n PRO 213 Cb 0.52 -2.12 -0.10 0.00 -0.02 0.00 0.00 33.50 31.78 1l7i n PRO 213 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1l7i s LYS 214 N -3.17 0.88 -0.23 -0.52 2.20 -0.34 -4.92 119.74 113.64 1l7i s LYS 214 Ca 0.72 -1.40 -0.17 0.00 -0.36 0.00 0.00 55.97 54.76 1l7i s LYS 214 Cb -0.35 0.14 -0.03 0.00 -1.51 0.00 0.00 37.83 36.08 1l7i s LYS 214 CO 0.52 -0.20 0.45 0.45 -0.36 0.00 0.00 175.35 176.21 1l7i s SER 215 N -3.04 6.43 0.00 1.43 0.15 -1.26 -4.48 113.70 112.94 1l7i s SER 215 Ca 0.20 0.52 0.00 0.00 0.70 0.00 0.00 55.95 57.36 1l7i s SER 215 Cb 0.07 -2.25 0.00 0.00 -1.71 0.00 0.00 66.02 62.13 1l7i s SER 215 CO -0.01 -0.17 0.00 0.00 1.20 0.00 0.00 173.24 174.26