#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a2z s ASP 9 N 0.00 5.99 0.24 1.08 1.01 -1.26 -4.35 116.67 119.37 3a2z s ASP 9 Ca 0.00 2.49 0.05 0.00 0.71 0.00 0.00 52.55 55.80 3a2z s ASP 9 Cb 0.00 -2.62 -0.03 0.00 1.01 0.00 0.00 42.92 41.28 3a2z s ASP 9 CO 0.00 -1.06 0.34 0.00 0.21 0.00 0.00 175.17 174.66 3a2z s ALA 10 N -1.42 3.88 0.81 5.23 0.00 0.50 -4.92 121.76 125.85 3a2z s ALA 10 Ca 0.64 -1.26 -0.14 0.00 0.00 0.00 0.00 51.96 51.21 3a2z s ALA 10 Cb -0.34 -1.67 0.07 0.00 0.00 0.00 0.00 23.12 21.18 3a2z s ALA 10 CO 0.41 0.24 1.05 -2.30 0.00 0.00 0.00 175.76 175.16 3a2z n PRO 11 N -1.38 0.14 -1.59 0.00 -0.02 -1.26 -4.68 135.00 126.21 3a2z n PRO 11 Ca -0.09 0.12 -0.49 0.00 -2.02 0.00 0.00 63.50 61.02 3a2z n PRO 11 Cb 0.57 -2.31 -0.04 0.00 -0.02 0.00 0.00 33.50 31.70 3a2z n PRO 11 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3a2z n PHE 12 N -3.24 1.39 -0.89 6.00 7.35 -1.24 -1.78 117.46 125.05 3a2z n PHE 12 Ca 0.12 0.65 0.00 0.00 -0.76 0.00 0.00 57.45 57.47 3a2z n PHE 12 Cb 0.51 -2.30 0.00 0.00 0.35 0.00 0.00 39.48 38.04 3a2z n PHE 12 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3a2z n GLY 13 N 2.06 0.89 3.74 7.13 0.00 -0.20 -4.96 105.19 113.85 3a2z n GLY 13 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3a2z n GLY 13 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a2z s THR 14 N -3.51 3.50 -0.04 2.61 2.01 -0.73 -4.64 115.64 114.84 3a2z s THR 14 Ca 0.00 1.27 -0.30 0.00 0.31 0.00 0.00 61.69 62.97 3a2z s THR 14 Cb 0.00 -3.81 -0.06 0.00 0.01 0.00 0.00 72.50 68.64 3a2z s THR 14 CO 0.00 0.21 1.63 -0.22 -0.69 0.00 0.00 174.62 175.55 3a2z s LEU 15 N -0.28 4.32 -0.02 4.42 2.96 -1.26 -0.84 118.68 127.98 3a2z s LEU 15 Ca 0.53 2.24 0.22 0.00 -0.22 0.00 0.00 54.13 56.90 3a2z s LEU 15 Cb -0.33 -3.54 -0.32 0.00 0.50 0.00 0.00 46.19 42.50 3a2z s LEU 15 CO 0.37 -0.90 0.55 0.18 -1.32 0.00 0.00 176.35 175.23 3a2z n LEU 16 N 6.86 0.19 0.00 -0.68 4.77 0.57 -4.88 117.00 123.83 3a2z n LEU 16 Ca 0.17 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 3a2z n LEU 16 Cb 0.43 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 3a2z n LEU 16 CO 0.62 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 3a2z n GLY 17 N 1.31 -0.80 3.02 -0.72 0.00 -1.22 -0.76 105.19 106.04 3a2z n GLY 17 Ca -0.02 -1.28 -0.17 0.00 0.00 0.00 0.00 46.02 44.55 3a2z n GLY 17 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a2z s TYR 18 N -2.92 0.71 0.64 1.61 1.51 -1.26 -0.90 117.35 116.74 3a2z s TYR 18 Ca 0.00 -0.23 -0.04 0.00 -1.01 0.00 0.00 57.07 55.79 3a2z s TYR 18 Cb 0.00 -0.44 0.04 0.00 -0.11 0.00 0.00 41.96 41.45 3a2z s TYR 18 CO 0.00 -0.02 0.92 0.00 -1.11 0.00 0.00 175.55 175.34 3a2z s ALA 19 N -0.50 3.37 0.34 3.71 0.00 0.73 -4.23 121.76 125.19 3a2z s ALA 19 Ca -0.00 -0.96 -0.27 0.00 0.00 0.00 0.00 51.96 50.73 3a2z s ALA 19 Cb -0.05 -2.47 -0.13 0.00 0.00 0.00 0.00 23.12 20.47 3a2z s ALA 19 CO 0.00 -1.03 1.11 -2.30 0.00 0.00 0.00 175.76 173.54 3a2z n PRO 20 N -2.69 1.64 -0.52 0.00 -0.02 -1.26 -1.76 135.00 130.40 3a2z n PRO 20 Ca 0.07 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 3a2z n PRO 20 Cb 0.60 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 3a2z n PRO 20 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3a2z n GLY 21 N 1.04 0.75 2.03 -1.23 0.00 -1.26 -4.13 105.19 102.40 3a2z n GLY 21 Ca 0.08 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.04 3a2z n GLY 21 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a2z n GLY 22 N -2.13 0.45 3.53 -0.02 0.00 -0.72 -4.98 105.19 101.32 3a2z n GLY 22 Ca 0.00 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.06 3a2z n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a2z s VAL 23 N -2.78 5.08 0.46 1.61 1.01 -0.98 -4.89 120.40 119.90 3a2z s VAL 23 Ca 0.09 0.04 -0.25 0.00 0.00 0.00 0.00 61.98 61.86 3a2z s VAL 23 Cb -0.04 -3.94 -0.08 0.00 0.00 0.00 0.00 36.38 32.32 3a2z s VAL 23 CO 0.11 -0.25 1.35 0.00 0.00 0.00 0.00 175.10 176.31 3a2z s ALA 24 N 2.21 3.14 -0.19 5.51 0.00 -1.26 -0.19 121.76 130.98 3a2z s ALA 24 Ca 0.15 1.32 -0.02 0.00 0.00 0.00 0.00 51.96 53.40 3a2z s ALA 24 Cb -0.16 -3.53 -0.00 0.00 0.00 0.00 0.00 23.12 19.42 3a2z s ALA 24 CO 0.13 -1.06 -0.10 0.42 0.00 0.00 0.00 175.76 175.15 3a2z s ILE 25 N -1.27 2.98 0.11 0.00 1.01 -0.07 -4.84 121.20 119.12 3a2z s ILE 25 Ca 0.62 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 60.69 3a2z s ILE 25 Cb -0.40 -2.31 -0.04 0.00 0.01 0.00 0.00 42.46 39.72 3a2z s ILE 25 CO 0.50 0.48 -0.05 -0.31 0.00 0.00 0.00 174.94 175.56 3a2z s TYR 26 N 1.12 2.85 0.41 3.97 1.51 -1.26 -0.31 117.35 125.63 3a2z s TYR 26 Ca 0.01 -0.11 -0.26 0.00 -1.01 0.00 0.00 57.07 55.71 3a2z s TYR 26 Cb -0.14 -1.46 -0.08 0.00 -0.11 0.00 0.00 41.96 40.16 3a2z s TYR 26 CO -0.03 0.46 1.27 0.45 -1.11 0.00 0.00 175.55 176.60 3a2z s SER 27 N -2.39 6.31 -0.02 2.29 0.15 -0.02 -4.62 113.70 115.41 3a2z s SER 27 Ca 0.24 2.58 0.07 0.00 0.70 0.00 0.00 55.95 59.54 3a2z s SER 27 Cb -0.11 -2.63 0.19 0.00 -1.71 0.00 0.00 66.02 61.76 3a2z s SER 27 CO 0.16 -0.84 1.15 -1.20 1.20 0.00 0.00 173.24 173.71 3a2z n SER 28 N 0.06 2.55 -4.56 5.45 7.64 -1.26 -1.03 113.62 122.47 3a2z n SER 28 Ca 0.04 -2.15 -0.38 0.00 1.01 0.00 0.00 58.87 57.39 3a2z n SER 28 Cb 0.44 -0.17 -0.03 0.00 -1.01 0.00 0.00 64.21 63.45 3a2z n SER 28 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3a2z s ASP 29 N -1.20 4.94 -0.38 6.43 3.68 -1.26 -4.77 116.67 124.11 3a2z s ASP 29 Ca 0.15 0.86 0.06 0.00 2.13 0.00 0.00 52.55 55.75 3a2z s ASP 29 Cb 0.09 -2.51 0.51 0.00 -1.45 0.00 0.00 42.92 39.56 3a2z s ASP 29 CO 0.08 -2.54 1.56 0.00 0.13 0.00 0.00 175.17 174.40 3a2z n TYR 30 N 13.98 2.05 0.23 -5.34 0.18 -1.26 -3.62 117.16 123.38 3a2z n TYR 30 Ca 0.29 -2.03 0.11 0.00 1.88 0.00 0.00 57.90 58.15 3a2z n TYR 30 Cb 0.53 -0.69 0.50 0.00 -0.38 0.00 0.00 39.34 39.29 3a2z n TYR 30 CO 0.00 0.00 0.00 0.66 -2.08 0.00 0.00 176.86 175.44 3a2z h SER 31 N 1.43 0.00 -0.58 9.48 4.64 -2.02 -2.88 113.55 123.62 3a2z h SER 31 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 3a2z h SER 31 Cb 1.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.70 3a2z h SER 31 CO 0.77 0.18 0.00 -1.20 -0.87 0.00 0.00 176.83 175.71 3a2z n SER 32 N -3.35 4.32 -4.69 4.97 7.64 -1.26 -4.95 113.62 116.30 3a2z n SER 32 Ca 0.00 -2.39 -0.28 0.00 1.01 0.00 0.00 58.87 57.22 3a2z n SER 32 Cb 0.40 -0.51 -0.07 0.00 -1.01 0.00 0.00 64.21 63.02 3a2z n SER 32 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3a2z s LEU 33 N -1.72 3.45 -0.21 -3.43 1.43 -1.09 -5.07 118.68 112.04 3a2z s LEU 33 Ca 0.46 -0.26 -0.29 0.00 -1.03 0.00 0.00 54.13 53.01 3a2z s LEU 33 Cb 0.29 -2.13 -0.03 0.00 0.03 0.00 0.00 46.19 44.35 3a2z s LEU 33 CO 0.23 0.12 1.64 -0.62 0.23 0.00 0.00 176.35 177.95 3a2z s ASP 34 N -2.70 6.36 0.27 2.29 3.68 -1.26 -4.89 116.67 120.42 3a2z s ASP 34 Ca 0.27 1.65 0.00 0.00 2.13 0.00 0.00 52.55 56.61 3a2z s ASP 34 Cb -0.10 -2.53 0.59 0.00 -1.45 0.00 0.00 42.92 39.42 3a2z s ASP 34 CO 0.19 -1.27 1.74 1.55 0.13 0.00 0.00 175.17 177.51 3a2z h PRO 35 N 10.82 0.52 0.39 4.34 0.13 -1.97 1.39 132.00 147.62 3a2z h PRO 35 Ca -0.34 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.74 3a2z h PRO 35 Cb 1.16 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 3a2z h PRO 35 CO 1.00 0.35 -0.24 0.37 -0.23 0.00 0.00 178.00 179.24 3a2z h GLN 36 N 0.54 -0.58 -0.57 0.86 5.75 -2.00 -0.78 115.11 118.33 3a2z h GLN 36 Ca 0.49 0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 59.00 3a2z h GLN 36 Cb 0.78 0.13 -0.03 0.00 1.07 0.00 0.00 27.48 29.43 3a2z h GLN 36 CO -0.42 -0.39 0.24 1.49 -2.65 0.00 0.00 178.83 177.10 3a2z h GLU 37 N -0.61 0.85 -0.94 1.69 4.57 -1.58 -1.58 114.58 116.99 3a2z h GLU 37 Ca -0.04 -0.15 0.01 0.00 -1.18 0.00 0.00 59.36 58.00 3a2z h GLU 37 Cb 0.50 -0.14 -0.05 0.00 -0.16 0.00 0.00 28.75 28.91 3a2z h GLU 37 CO 0.04 0.72 0.60 -0.92 -1.18 0.00 0.00 179.01 178.27 3a2z h TYR 38 N 0.78 1.19 0.00 0.92 3.20 0.20 -0.76 116.97 122.50 3a2z h TYR 38 Ca 0.19 0.02 -0.20 0.00 3.14 0.00 0.00 58.73 61.88 3a2z h TYR 38 Cb 0.19 -0.40 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 3a2z h TYR 38 CO 0.01 0.76 -0.87 0.93 -1.64 0.00 0.00 178.16 177.35 3a2z h GLU 39 N 1.27 0.21 0.01 1.82 4.39 -0.85 -3.39 114.58 118.03 3a2z h GLU 39 Ca 0.34 -0.23 -0.36 0.00 0.34 0.00 0.00 59.36 59.46 3a2z h GLU 39 Cb -0.12 0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 28.53 3a2z h GLU 39 CO -0.07 0.96 -2.24 -0.25 -1.16 0.00 0.00 179.01 176.25 3a2z n ASP 40 N -3.67 0.58 -4.73 1.42 8.00 -0.62 -4.98 116.55 112.55 3a2z n ASP 40 Ca -0.04 0.08 -0.42 0.00 0.71 0.00 0.00 54.79 55.13 3a2z n ASP 40 Cb 0.80 0.47 -0.03 0.00 -0.02 0.00 0.00 41.12 42.35 3a2z n ASP 40 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3a2z s ASP 41 N -5.85 6.93 0.51 -2.24 3.68 -0.32 -4.93 116.67 114.46 3a2z s ASP 41 Ca -0.13 2.32 0.34 0.00 2.13 0.00 0.00 52.55 57.21 3a2z s ASP 41 Cb 0.07 -2.60 1.75 0.00 -1.45 0.00 0.00 42.92 40.69 3a2z s ASP 41 CO 0.79 -0.52 2.04 0.00 0.13 0.00 0.00 175.17 177.62 3a2z h ALA 42 N 5.77 1.00 0.00 3.66 0.00 -1.94 -1.86 119.26 125.89 3a2z h ALA 42 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3a2z h ALA 42 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3a2z h ALA 42 CO 0.79 0.00 0.00 1.33 0.00 0.00 0.00 179.25 181.37 3a2z n VAL 43 N -2.77 1.15 -0.51 0.00 0.24 -1.26 -1.70 118.33 113.49 3a2z n VAL 43 Ca -0.01 0.35 0.10 0.00 -2.04 0.00 0.00 64.34 62.74 3a2z n VAL 43 Cb 0.12 -1.23 0.35 0.00 -1.47 0.00 0.00 33.84 31.61 3a2z n VAL 43 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 3a2z n PHE 44 N -1.80 1.31 -3.73 6.34 3.01 -0.70 -4.90 117.46 117.00 3a2z n PHE 44 Ca 0.02 -0.56 -0.37 0.00 1.01 0.00 0.00 57.45 57.55 3a2z n PHE 44 Cb 0.14 -0.15 -0.11 0.00 -0.01 0.00 0.00 39.48 39.35 3a2z n PHE 44 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3a2z s ARG 45 N -1.52 3.93 -0.14 -1.08 0.52 -0.69 -0.28 118.95 119.70 3a2z s ARG 45 Ca 0.51 -0.34 -0.17 0.00 -0.52 0.00 0.00 55.73 55.20 3a2z s ARG 45 Cb 0.30 -3.47 -0.04 0.00 0.52 0.00 0.00 34.95 32.27 3a2z s ARG 45 CO 0.28 -0.01 0.45 0.45 0.02 0.00 0.00 175.30 176.49 3a2z s SER 46 N 1.23 6.62 0.12 0.23 0.15 0.08 -4.90 113.70 117.23 3a2z s SER 46 Ca 0.06 0.73 0.06 0.00 0.70 0.00 0.00 55.95 57.51 3a2z s SER 46 Cb -0.14 -2.27 -0.04 0.00 -1.71 0.00 0.00 66.02 61.86 3a2z s SER 46 CO 0.05 -0.02 -0.14 -0.31 1.20 0.00 0.00 173.24 174.02 3a2z s TYR 47 N 0.80 1.42 -0.18 3.44 1.51 -1.26 -0.26 117.35 122.82 3a2z s TYR 47 Ca 0.24 -0.55 -0.02 0.00 -1.01 0.00 0.00 57.07 55.73 3a2z s TYR 47 Cb -0.15 -0.74 0.05 0.00 -0.11 0.00 0.00 41.96 41.01 3a2z s TYR 47 CO 0.09 0.15 0.01 0.42 -1.11 0.00 0.00 175.55 175.11 3a2z s ILE 48 N -2.16 0.72 -0.94 2.71 1.01 -0.13 -4.90 121.20 117.51 3a2z s ILE 48 Ca 0.09 -0.56 -0.11 0.00 0.00 0.00 0.00 60.65 60.08 3a2z s ILE 48 Cb -0.05 -1.10 0.01 0.00 0.01 0.00 0.00 42.46 41.33 3a2z s ILE 48 CO 0.03 -0.08 0.66 0.47 0.00 0.00 0.00 174.94 176.02 3a2z n ASP 49 N 4.99 -5.12 0.00 3.58 8.00 -1.26 -0.94 116.55 125.80 3a2z n ASP 49 Ca -0.10 -0.94 0.00 0.00 0.71 0.00 0.00 54.79 54.46 3a2z n ASP 49 Cb 0.47 -2.33 0.00 0.00 -0.02 0.00 0.00 41.12 39.24 3a2z n ASP 49 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3a2z n ASP 50 N -2.43 0.00 -4.65 -2.24 10.43 -1.26 -4.96 116.55 111.44 3a2z n ASP 50 Ca -0.21 0.00 -0.37 0.00 2.57 0.00 0.00 54.79 56.78 3a2z n ASP 50 Cb 0.63 -1.12 -0.09 0.00 1.84 0.00 0.00 41.12 42.38 3a2z n ASP 50 CO 0.00 0.00 0.00 -0.70 -1.07 0.00 0.00 177.20 175.43 3a2z s GLU 51 N -0.27 4.09 -0.10 -1.24 2.56 -0.12 -5.05 118.70 118.58 3a2z s GLU 51 Ca 0.00 -0.11 -0.30 0.00 0.00 0.00 0.00 54.97 54.57 3a2z s GLU 51 Cb 0.00 -3.56 -0.03 0.00 2.00 0.00 0.00 34.13 32.55 3a2z s GLU 51 CO 0.00 -0.02 1.25 -0.47 -0.56 0.00 0.00 175.26 175.47 3a2z s TYR 52 N 1.28 2.98 -0.18 5.30 6.14 -1.26 -0.96 117.35 130.65 3a2z s TYR 52 Ca 0.12 1.07 0.03 0.00 0.64 0.00 0.00 57.07 58.92 3a2z s TYR 52 Cb -0.14 -3.49 -0.22 0.00 0.42 0.00 0.00 41.96 38.53 3a2z s TYR 52 CO 0.06 -1.63 0.10 -1.33 0.64 0.00 0.00 175.55 173.40 3a2z n MET 53 N 5.89 0.69 -2.31 4.97 2.81 0.63 -4.96 117.12 124.84 3a2z n MET 53 Ca 0.13 0.18 0.00 0.00 -1.81 0.00 0.00 57.70 56.19 3a2z n MET 53 Cb 0.45 -1.61 0.00 0.00 -0.71 0.00 0.00 33.22 31.35 3a2z n MET 53 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3a2z n GLY 54 N 2.02 -0.23 3.72 3.03 0.00 -1.15 -4.28 105.19 108.29 3a2z n GLY 54 Ca -0.36 -1.50 -0.39 0.00 0.00 0.00 0.00 46.02 43.77 3a2z n GLY 54 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3a2z s HIS 55 N -2.70 3.54 0.20 1.61 2.46 -1.26 -0.75 115.29 118.40 3a2z s HIS 55 Ca 0.00 1.10 -0.30 0.00 0.47 0.00 0.00 55.06 56.32 3a2z s HIS 55 Cb 0.00 -2.71 -0.09 0.00 -0.13 0.00 0.00 32.58 29.65 3a2z s HIS 55 CO 0.00 0.11 1.37 0.15 -2.47 0.00 0.00 174.74 173.90 3a2z s LYS 56 N 0.78 4.33 -0.56 2.88 1.02 0.62 -1.11 119.74 127.70 3a2z s LYS 56 Ca 0.33 2.15 0.07 0.00 0.02 0.00 0.00 55.97 58.53 3a2z s LYS 56 Cb -0.17 -3.17 0.26 0.00 -0.52 0.00 0.00 37.83 34.24 3a2z s LYS 56 CO 0.15 -0.35 0.71 0.91 -0.92 0.00 0.00 175.35 175.85 3a2z n TRP 57 N 2.77 2.54 -2.19 3.18 7.02 -1.26 -4.98 117.44 124.53 3a2z n TRP 57 Ca 0.07 -3.98 -0.27 0.00 -1.02 0.00 0.00 57.50 52.31 3a2z n TRP 57 Cb 0.42 -0.49 0.11 0.00 -2.42 0.00 0.00 31.31 28.93 3a2z n TRP 57 CO 0.00 0.00 0.00 -0.65 -2.02 0.00 0.00 177.69 175.02 3a2z s GLN 58 N -2.26 1.60 0.18 -0.99 -0.21 -0.27 -4.06 119.66 113.65 3a2z s GLN 58 Ca 0.40 -0.47 -0.09 0.00 0.02 0.00 0.00 55.36 55.21 3a2z s GLN 58 Cb 0.18 -2.10 0.08 0.00 1.00 0.00 0.00 33.01 32.17 3a2z s GLN 58 CO -0.05 -1.66 1.67 0.00 -2.12 0.00 0.00 175.29 173.13 3a2z h VAL 60 N 0.99 1.24 -0.63 0.00 2.07 -1.91 -2.34 116.25 115.67 3a2z h VAL 60 Ca 0.19 -0.73 0.02 0.00 0.82 0.00 0.00 66.70 67.00 3a2z h VAL 60 Cb 0.46 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 3a2z h VAL 60 CO 0.02 0.30 0.40 -0.08 0.02 0.00 0.00 177.57 178.23 3a2z h GLU 61 N 1.04 0.78 -0.38 1.57 4.22 -1.68 -0.88 114.58 119.25 3a2z h GLU 61 Ca 0.25 -0.05 -0.04 0.00 0.08 0.00 0.00 59.36 59.60 3a2z h GLU 61 Cb 0.17 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 3a2z h GLU 61 CO -0.02 0.52 0.08 0.35 -2.18 0.00 0.00 179.01 177.76 3a2z h PHE 62 N 0.81 0.65 -0.74 0.92 3.57 -1.21 -0.99 116.94 119.95 3a2z h PHE 62 Ca 0.24 -0.08 -0.04 0.00 3.53 0.00 0.00 57.97 61.62 3a2z h PHE 62 Cb -0.05 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.48 3a2z h PHE 62 CO -0.04 0.64 0.30 0.00 -2.23 0.00 0.00 178.31 176.98 3a2z h ALA 63 N 0.93 0.96 -0.50 2.41 0.00 -1.08 0.76 119.26 122.74 3a2z h ALA 63 Ca 0.12 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 3a2z h ALA 63 Cb 0.33 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3a2z h ALA 63 CO 0.00 0.58 -0.16 -0.09 0.00 0.00 0.00 179.25 179.58 3a2z h ARG 64 N 1.06 0.99 -0.24 0.00 2.43 -1.10 -1.89 114.38 115.62 3a2z h ARG 64 Ca 0.25 -0.40 -0.14 0.00 -0.81 0.00 0.00 59.98 58.88 3a2z h ARG 64 Cb 0.20 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 3a2z h ARG 64 CO -0.02 1.07 -0.43 -0.09 -1.51 0.00 0.00 179.97 178.99 3a2z h ARG 65 N 0.85 0.59 -0.21 0.20 2.43 -0.86 -0.32 114.38 117.06 3a2z h ARG 65 Ca 0.12 -0.32 -0.00 0.00 -0.81 0.00 0.00 59.98 58.97 3a2z h ARG 65 Cb 0.73 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.29 3a2z h ARG 65 CO 0.06 0.91 0.12 0.35 -1.51 0.00 0.00 179.97 179.90 3a2z h PHE 66 N 0.48 0.29 -0.40 2.20 3.57 -0.76 -0.18 116.94 122.14 3a2z h PHE 66 Ca 0.03 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 3a2z h PHE 66 Cb 0.95 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.58 3a2z h PHE 66 CO 0.04 0.25 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.26 3a2z h LEU 67 N 0.24 0.62 -0.08 0.59 3.38 -1.16 -1.29 115.31 117.62 3a2z h LEU 67 Ca 0.07 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3a2z h LEU 67 Cb 0.05 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 3a2z h LEU 67 CO -0.01 0.71 0.01 0.15 0.09 0.00 0.00 178.44 179.39 3a2z h PHE 68 N 0.61 0.14 -0.06 1.13 3.57 -0.36 0.72 116.94 122.70 3a2z h PHE 68 Ca 0.12 -0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.47 3a2z h PHE 68 Cb 0.43 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 3a2z h PHE 68 CO 0.02 0.37 -0.54 -0.07 -2.23 0.00 0.00 178.31 175.85 3a2z h LEU 69 N -0.12 0.18 0.00 0.59 3.38 -0.94 -0.85 115.31 117.55 3a2z h LEU 69 Ca 0.02 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3a2z h LEU 69 Cb 0.30 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3a2z h LEU 69 CO 0.00 0.69 -1.17 0.59 0.09 0.00 0.00 178.44 178.64 3a2z n ASN 70 N -3.91 1.15 0.00 -0.43 3.02 -0.50 -4.68 115.26 109.90 3a2z n ASN 70 Ca -0.02 -0.42 0.00 0.00 -0.03 0.00 0.00 54.58 54.11 3a2z n ASN 70 Cb 0.56 1.34 0.00 0.00 -0.61 0.00 0.00 39.78 41.07 3a2z n ASN 70 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3a2z n TYR 71 N -1.67 0.00 -1.84 3.10 4.02 0.17 -5.03 117.16 115.91 3a2z n TYR 71 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.74 3a2z n TYR 71 Cb 0.30 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.59 3a2z n TYR 71 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3a2z n GLY 72 N 0.23 0.66 3.20 2.72 0.00 -0.32 -4.96 105.19 106.71 3a2z n GLY 72 Ca 0.00 -0.31 -0.12 0.00 0.00 0.00 0.00 46.02 45.59 3a2z n GLY 72 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3a2z s VAL 73 N -2.63 0.89 0.12 1.61 -7.23 -1.07 -1.60 120.40 110.49 3a2z s VAL 73 Ca 0.00 -1.97 0.00 0.00 -1.81 0.00 0.00 61.98 58.20 3a2z s VAL 73 Cb 0.00 -1.73 -0.04 0.00 0.56 0.00 0.00 36.38 35.17 3a2z s VAL 73 CO 0.00 -0.81 0.01 0.68 -0.31 0.00 0.00 175.10 174.67 3a2z s VAL 74 N -3.45 0.37 0.25 1.32 -7.23 -0.29 -1.93 120.40 109.44 3a2z s VAL 74 Ca 0.13 -1.91 0.07 0.00 -1.81 0.00 0.00 61.98 58.46 3a2z s VAL 74 Cb 0.04 -1.90 -0.04 0.00 0.56 0.00 0.00 36.38 35.04 3a2z s VAL 74 CO -0.02 -0.64 0.20 0.72 -0.31 0.00 0.00 175.10 175.04 3a2z s PHE 75 N -3.85 3.10 0.88 2.82 -0.12 -1.26 -0.79 117.98 118.76 3a2z s PHE 75 Ca 0.19 -0.12 -0.12 0.00 -0.05 0.00 0.00 56.93 56.83 3a2z s PHE 75 Cb 0.07 -1.41 0.12 0.00 -0.63 0.00 0.00 43.02 41.16 3a2z s PHE 75 CO -0.01 0.51 1.11 -0.08 -0.05 0.00 0.00 175.22 176.70 3a2z s THR 76 N -2.14 2.44 -1.10 -4.49 -1.32 -1.26 -4.91 115.64 102.86 3a2z s THR 76 Ca 0.33 0.14 -0.24 0.00 -1.21 0.00 0.00 61.69 60.71 3a2z s THR 76 Cb -0.08 -2.84 -0.14 0.00 -1.51 0.00 0.00 72.50 67.93 3a2z s THR 76 CO 0.25 -0.19 1.97 -0.67 -2.21 0.00 0.00 174.62 173.78 3a2z n ASP 77 N -3.70 2.50 -4.82 8.08 4.64 -1.26 -5.00 116.55 116.99 3a2z n ASP 77 Ca 0.07 -2.63 -0.33 0.00 -1.38 0.00 0.00 54.79 50.51 3a2z n ASP 77 Cb 0.58 -1.66 -0.04 0.00 -1.04 0.00 0.00 41.12 38.95 3a2z n ASP 77 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 3a2z s VAL 78 N 12.31 4.25 0.08 5.18 -7.23 -1.26 -4.98 120.40 128.74 3a2z s VAL 78 Ca 0.71 1.27 0.07 0.00 -1.81 0.00 0.00 61.98 62.22 3a2z s VAL 78 Cb -0.00 -3.58 -0.22 0.00 0.56 0.00 0.00 36.38 33.14 3a2z s VAL 78 CO 0.16 -0.43 1.12 1.23 -0.31 0.00 0.00 175.10 176.87 3a2z h GLY 79 N 1.39 0.02 -5.39 2.32 0.00 -1.99 -3.45 103.07 95.96 3a2z h GLY 79 Ca -0.48 -0.06 -0.41 0.00 0.00 0.00 0.00 47.33 46.38 3a2z h GLY 79 CO 0.60 0.05 -0.78 1.06 0.00 0.00 0.00 176.54 177.47 3a2z s MET 80 N -2.68 0.83 0.39 4.80 -1.94 -1.26 -5.04 119.30 114.40 3a2z s MET 80 Ca -0.01 -0.31 0.13 0.00 -1.71 0.00 0.00 55.69 53.79 3a2z s MET 80 Cb 0.09 -0.79 0.95 0.00 2.01 0.00 0.00 34.83 37.09 3a2z s MET 80 CO 0.82 0.15 1.89 0.00 -0.01 0.00 0.00 175.02 177.88 3a2z h ALA 81 N 6.15 1.99 0.00 3.03 0.00 -1.69 -0.58 119.26 128.17 3a2z h ALA 81 Ca -0.32 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 3a2z h ALA 81 Cb 1.17 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 3a2z h ALA 81 CO 0.49 -0.22 -0.02 0.11 0.00 0.00 0.00 179.25 179.61 3a2z h TRP 82 N 0.54 0.00 0.00 0.00 5.08 -1.59 -1.55 115.95 118.43 3a2z h TRP 82 Ca 0.41 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.38 3a2z h TRP 82 Cb 0.81 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.97 3a2z h TRP 82 CO -0.00 0.02 0.00 0.93 -1.28 0.00 0.00 178.44 178.11 3a2z h GLU 83 N 0.00 0.00 -0.03 0.12 5.08 -1.41 -2.72 114.58 115.63 3a2z h GLU 83 Ca -0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3a2z h GLU 83 Cb 0.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 3a2z h GLU 83 CO 0.00 0.00 0.02 0.82 -1.00 0.00 0.00 179.01 178.85 3a2z h ILE 84 N 0.00 0.98 0.00 3.13 2.04 -1.43 -1.00 117.51 121.23 3a2z h ILE 84 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3a2z h ILE 84 Cb 0.34 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 3a2z h ILE 84 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 178.15 178.48 3a2z n PHE 85 N -4.52 0.71 0.96 1.37 7.35 -1.02 -1.38 117.46 120.93 3a2z n PHE 85 Ca -0.02 0.32 0.11 0.00 -0.76 0.00 0.00 57.45 57.10 3a2z n PHE 85 Cb 0.12 -1.01 0.08 0.00 0.35 0.00 0.00 39.48 39.01 3a2z n PHE 85 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 3a2z n SER 86 N -2.19 2.81 -4.81 -2.13 7.64 -0.38 -4.75 113.62 109.80 3a2z n SER 86 Ca 0.01 -1.90 -0.33 0.00 1.01 0.00 0.00 58.87 57.65 3a2z n SER 86 Cb 0.13 0.06 -0.06 0.00 -1.01 0.00 0.00 64.21 63.34 3a2z n SER 86 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3a2z s LEU 87 N -1.99 3.90 -0.02 -3.43 1.43 -0.48 -4.98 118.68 113.11 3a2z s LEU 87 Ca 0.26 1.77 0.02 0.00 -1.03 0.00 0.00 54.13 55.15 3a2z s LEU 87 Cb 0.19 -4.55 0.04 0.00 0.03 0.00 0.00 46.19 41.90 3a2z s LEU 87 CO 0.32 -0.51 0.87 0.54 0.23 0.00 0.00 176.35 177.80 3a2z n ARG 88 N -0.78 1.69 -3.70 1.70 5.12 -1.26 -4.76 116.66 114.66 3a2z n ARG 88 Ca 0.08 -1.30 -0.10 0.00 -1.93 0.00 0.00 57.85 54.59 3a2z n ARG 88 Cb 0.53 -0.88 -0.05 0.00 -1.16 0.00 0.00 32.46 30.91 3a2z n ARG 88 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 3a2z s PHE 89 N -0.87 -0.11 0.17 -1.55 0.40 -1.26 -1.28 117.98 113.49 3a2z s PHE 89 Ca 0.04 -0.23 0.10 0.00 -0.60 0.00 0.00 56.93 56.24 3a2z s PHE 89 Cb 0.03 0.23 -0.04 0.00 0.51 0.00 0.00 43.02 43.75 3a2z s PHE 89 CO 0.00 -0.73 -0.21 -0.51 0.70 0.00 0.00 175.22 174.48 3a2z s LEU 90 N -2.83 2.42 -0.16 -0.37 1.43 0.12 -4.74 118.68 114.55 3a2z s LEU 90 Ca 0.05 -0.84 -0.02 0.00 -1.03 0.00 0.00 54.13 52.29 3a2z s LEU 90 Cb 0.02 -0.99 -0.02 0.00 0.03 0.00 0.00 46.19 45.23 3a2z s LEU 90 CO -0.09 0.05 -0.09 -0.60 0.23 0.00 0.00 176.35 175.84 3a2z s ARG 91 N -2.63 3.44 -0.19 1.70 3.52 0.03 -0.82 118.95 123.99 3a2z s ARG 91 Ca 0.17 -0.64 -0.29 0.00 -0.13 0.00 0.00 55.73 54.84 3a2z s ARG 91 Cb -0.07 -2.78 -0.01 0.00 -1.56 0.00 0.00 34.95 30.53 3a2z s ARG 91 CO 0.08 0.12 1.26 -2.00 -0.81 0.00 0.00 175.30 173.95 3a2z s GLU 92 N 0.62 4.18 0.35 5.12 2.12 0.32 -1.14 118.70 130.27 3a2z s GLU 92 Ca -0.05 1.57 0.13 0.00 0.36 0.00 0.00 54.97 56.97 3a2z s GLU 92 Cb -0.15 -3.78 0.65 0.00 0.26 0.00 0.00 34.13 31.11 3a2z s GLU 92 CO 0.03 -0.78 1.78 0.28 -0.54 0.00 0.00 175.26 176.03 3a2z h VAL 93 N 5.58 1.27 0.00 3.70 2.07 -1.62 0.13 116.25 127.37 3a2z h VAL 93 Ca -0.26 -1.47 -0.06 0.00 0.82 0.00 0.00 66.70 65.73 3a2z h VAL 93 Cb 1.10 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.66 3a2z h VAL 93 CO 0.98 0.41 -0.29 1.62 0.02 0.00 0.00 177.57 180.32 3a2z h VAL 94 N 0.00 0.99 0.00 2.57 3.04 -1.92 -3.35 116.25 117.58 3a2z h VAL 94 Ca -0.00 -1.07 0.00 0.00 -1.01 0.00 0.00 66.70 64.62 3a2z h VAL 94 Cb 0.77 1.61 0.00 0.00 -2.01 0.00 0.00 31.29 31.66 3a2z h VAL 94 CO 0.06 0.28 0.00 -0.46 -1.01 0.00 0.00 177.57 176.44 3a2z n ASN 95 N -3.88 0.00 -1.09 3.17 0.23 -1.18 -5.01 115.26 107.50 3a2z n ASN 95 Ca -0.02 -1.00 -0.14 0.00 -0.53 0.00 0.00 54.58 52.89 3a2z n ASN 95 Cb 0.37 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.01 3a2z n ASN 95 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 3a2z n ASP 96 N 0.00 -5.38 -4.78 0.53 8.00 0.45 -4.98 116.55 110.38 3a2z n ASP 96 Ca 0.00 0.35 -0.34 0.00 0.71 0.00 0.00 54.79 55.51 3a2z n ASP 96 Cb 0.42 -4.14 0.00 0.00 -0.02 0.00 0.00 41.12 37.39 3a2z n ASP 96 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 3a2z s ASN 97 N -2.60 5.75 -0.14 -2.24 0.02 -1.23 -4.73 114.94 109.76 3a2z s ASN 97 Ca 0.00 2.04 -0.05 0.00 -1.02 0.00 0.00 52.86 53.84 3a2z s ASN 97 Cb 0.00 -2.56 -0.03 0.00 0.02 0.00 0.00 41.25 38.67 3a2z s ASN 97 CO 0.00 -1.19 0.01 -0.63 0.02 0.00 0.00 177.10 175.31 3a2z s ILE 98 N -2.02 4.37 -0.00 0.60 -1.09 -1.26 -0.52 121.20 121.29 3a2z s ILE 98 Ca 0.69 -0.20 0.07 0.00 -2.23 0.00 0.00 60.65 58.99 3a2z s ILE 98 Cb -0.21 -2.91 -0.02 0.00 -1.58 0.00 0.00 42.46 37.74 3a2z s ILE 98 CO 0.29 0.52 -0.22 -0.76 -1.23 0.00 0.00 174.94 173.54 3a2z s LEU 99 N -0.04 2.32 0.49 2.97 1.43 -0.00 -4.97 118.68 120.88 3a2z s LEU 99 Ca 0.04 -0.43 -0.21 0.00 -1.03 0.00 0.00 54.13 52.50 3a2z s LEU 99 Cb -0.13 -1.41 -0.07 0.00 0.03 0.00 0.00 46.19 44.61 3a2z s LEU 99 CO 0.02 0.30 1.10 -2.16 0.23 0.00 0.00 176.35 175.84 3a2z s PRO 100 N -0.90 3.70 -0.04 1.29 0.04 -1.26 -0.70 135.00 137.13 3a2z s PRO 100 Ca 0.11 1.55 0.00 0.00 0.04 0.00 0.00 61.00 62.71 3a2z s PRO 100 Cb -0.10 -2.19 0.03 0.00 0.04 0.00 0.00 34.50 32.27 3a2z s PRO 100 CO 0.01 -0.55 -0.01 -1.17 0.04 0.00 0.00 177.00 175.32 3a2z s LEU 101 N -3.37 1.08 0.17 -3.56 2.96 -0.40 -2.21 118.68 113.36 3a2z s LEU 101 Ca 0.67 -0.05 0.10 0.00 -0.22 0.00 0.00 54.13 54.63 3a2z s LEU 101 Cb -0.22 -0.29 -0.04 0.00 0.50 0.00 0.00 46.19 46.14 3a2z s LEU 101 CO 0.26 -0.11 -0.19 -1.10 -1.32 0.00 0.00 176.35 173.89 3a2z s GLN 102 N 1.16 1.71 -0.14 1.98 -1.52 -0.41 -4.27 119.66 118.16 3a2z s GLN 102 Ca -0.08 -1.39 -0.08 0.00 -1.95 0.00 0.00 55.36 51.87 3a2z s GLN 102 Cb -0.13 -1.98 -0.04 0.00 -0.22 0.00 0.00 33.01 30.63 3a2z s GLN 102 CO -0.02 0.42 0.12 0.00 -0.25 0.00 0.00 175.29 175.57 3a2z s ALA 103 N -1.57 3.76 -0.20 6.09 0.00 -1.26 -1.64 121.76 126.95 3a2z s ALA 103 Ca 0.21 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.51 3a2z s ALA 103 Cb -0.09 -2.00 0.05 0.00 0.00 0.00 0.00 23.12 21.08 3a2z s ALA 103 CO 0.11 0.46 -0.08 -0.06 0.00 0.00 0.00 175.76 176.20 3a2z s PHE 104 N -0.54 2.23 0.60 0.00 0.40 0.51 -5.01 117.98 116.17 3a2z s PHE 104 Ca 0.12 -1.51 -0.19 0.00 -0.60 0.00 0.00 56.93 54.75 3a2z s PHE 104 Cb -0.12 -1.54 -0.03 0.00 0.51 0.00 0.00 43.02 41.84 3a2z s PHE 104 CO 0.02 -0.72 1.22 -2.14 0.70 0.00 0.00 175.22 174.29 3a2z s PRO 105 N 1.46 2.93 0.33 0.24 0.02 -1.26 -1.40 135.00 137.31 3a2z s PRO 105 Ca -0.02 1.85 -0.28 0.00 0.02 0.00 0.00 61.00 62.56 3a2z s PRO 105 Cb -0.17 -1.92 -0.13 0.00 0.02 0.00 0.00 34.50 32.31 3a2z s PRO 105 CO -0.07 -1.24 1.27 -1.71 -0.33 0.00 0.00 177.00 174.91 3a2z n ASN 106 N -1.63 2.61 0.00 2.53 5.15 -0.12 -1.49 115.26 122.32 3a2z n ASN 106 Ca 0.14 1.20 0.00 0.00 -0.60 0.00 0.00 54.58 55.32 3a2z n ASN 106 Cb 0.49 -1.46 0.00 0.00 -0.53 0.00 0.00 39.78 38.29 3a2z n ASN 106 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3a2z n GLY 107 N 0.93 0.75 3.78 8.20 0.00 0.28 -4.99 105.19 114.15 3a2z n GLY 107 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 3a2z n GLY 107 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3a2z s SER 108 N -2.49 5.41 0.00 1.61 0.15 -0.56 -4.14 113.70 113.69 3a2z s SER 108 Ca 0.00 1.93 0.30 0.00 0.70 0.00 0.00 55.95 58.88 3a2z s SER 108 Cb 0.00 -2.54 1.49 0.00 -1.71 0.00 0.00 66.02 63.26 3a2z s SER 108 CO 0.00 -1.42 2.04 -0.81 1.20 0.00 0.00 173.24 174.25 3a2z n PRO 109 N -2.22 0.39 -3.09 5.44 -0.04 -1.26 -1.09 135.00 133.14 3a2z n PRO 109 Ca 0.10 -0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.12 3a2z n PRO 109 Cb 0.52 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.42 3a2z n PRO 109 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 3a2z s ARG 110 N -2.61 3.28 0.56 0.54 6.06 -1.26 -4.87 118.95 120.65 3a2z s ARG 110 Ca 0.27 -0.38 -0.19 0.00 -2.50 0.00 0.00 55.73 52.93 3a2z s ARG 110 Cb 0.20 -3.96 -0.05 0.00 0.06 0.00 0.00 34.95 31.20 3a2z s ARG 110 CO 0.47 -1.05 1.15 0.00 -2.50 0.00 0.00 175.30 173.37 3a2z s ALA 111 N 2.88 2.64 0.84 6.12 0.00 -1.26 -4.91 121.76 128.07 3a2z s ALA 111 Ca 0.23 0.86 -0.11 0.00 0.00 0.00 0.00 51.96 52.94 3a2z s ALA 111 Cb -0.14 -3.38 0.10 0.00 0.00 0.00 0.00 23.12 19.69 3a2z s ALA 111 CO 0.19 -0.91 1.13 -2.14 0.00 0.00 0.00 175.76 174.03 3a2z s PRO 112 N -3.34 1.61 0.04 0.00 0.02 -1.26 -5.05 135.00 127.02 3a2z s PRO 112 Ca 0.74 1.44 -0.01 0.00 0.02 0.00 0.00 61.00 63.19 3a2z s PRO 112 Cb -0.25 -1.80 -0.03 0.00 0.02 0.00 0.00 34.50 32.43 3a2z s PRO 112 CO 0.29 -2.17 -0.02 0.14 -0.33 0.00 0.00 177.00 174.91 3a2z s VAL 113 N -2.65 0.19 0.29 3.83 -7.23 -1.26 -5.03 120.40 108.54 3a2z s VAL 113 Ca 0.66 -1.57 -0.30 0.00 -1.81 0.00 0.00 61.98 58.95 3a2z s VAL 113 Cb -0.21 -1.22 -0.12 0.00 0.56 0.00 0.00 36.38 35.39 3a2z s VAL 113 CO 0.55 -0.87 1.60 0.00 -0.31 0.00 0.00 175.10 176.08 3a2z n ALA 114 N 0.46 2.55 0.00 1.32 0.00 -1.26 -1.53 120.51 122.05 3a2z n ALA 114 Ca -0.16 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.65 3a2z n ALA 114 Cb 0.60 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.58 3a2z n ALA 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2z n GLY 115 N 2.20 1.48 3.78 0.00 0.00 0.14 -5.00 105.19 107.80 3a2z n GLY 115 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 3a2z n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a2z s ALA 116 N -2.33 2.93 0.15 4.61 0.00 -0.58 -4.74 121.76 121.81 3a2z s ALA 116 Ca 0.00 0.72 -0.30 0.00 0.00 0.00 0.00 51.96 52.38 3a2z s ALA 116 Cb 0.00 -3.29 -0.07 0.00 0.00 0.00 0.00 23.12 19.76 3a2z s ALA 116 CO 0.00 -0.40 1.02 -0.51 0.00 0.00 0.00 175.76 175.87 3a2z s LEU 117 N -3.18 4.51 -0.19 0.00 1.43 -1.13 -0.97 118.68 119.15 3a2z s LEU 117 Ca 0.64 1.93 -0.00 0.00 -1.03 0.00 0.00 54.13 55.67 3a2z s LEU 117 Cb -0.21 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.42 3a2z s LEU 117 CO 0.26 -0.11 -0.15 -0.22 0.23 0.00 0.00 176.35 176.36 3a2z s LEU 118 N -0.28 2.38 -0.08 1.79 2.96 0.13 -0.65 118.68 124.93 3a2z s LEU 118 Ca 0.47 -0.56 0.02 0.00 -0.22 0.00 0.00 54.13 53.85 3a2z s LEU 118 Cb -0.26 -1.56 -0.02 0.00 0.50 0.00 0.00 46.19 44.84 3a2z s LEU 118 CO 0.32 0.00 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.60 3a2z s ILE 119 N 1.30 3.15 -0.00 6.68 -1.09 -0.01 -1.04 121.20 130.19 3a2z s ILE 119 Ca 0.04 -0.67 0.00 0.00 -2.23 0.00 0.00 60.65 57.79 3a2z s ILE 119 Cb -0.14 -2.27 -0.04 0.00 -1.58 0.00 0.00 42.46 38.44 3a2z s ILE 119 CO -0.09 0.57 0.07 0.26 -1.23 0.00 0.00 174.94 174.52 3a2z s TRP 120 N -0.40 3.24 0.87 3.97 0.51 0.12 -0.44 118.94 126.81 3a2z s TRP 120 Ca 0.05 0.18 -0.13 0.00 -2.12 0.00 0.00 56.10 54.08 3a2z s TRP 120 Cb -0.12 -1.72 0.14 0.00 -0.81 0.00 0.00 33.47 30.95 3a2z s TRP 120 CO 0.02 0.53 1.23 0.34 -0.51 0.00 0.00 176.95 178.57 3a2z s ASP 121 N -1.73 3.88 0.72 2.95 -1.08 0.11 -2.67 116.67 118.86 3a2z s ASP 121 Ca 0.22 0.49 -0.14 0.00 -0.52 0.00 0.00 52.55 52.60 3a2z s ASP 121 Cb -0.12 -0.78 0.03 0.00 -1.46 0.00 0.00 42.92 40.60 3a2z s ASP 121 CO 0.13 -2.27 1.13 -1.59 0.52 0.00 0.00 175.17 173.10 3a2z s LYS 122 N -5.69 2.39 0.00 4.34 -2.85 -1.26 -4.12 119.74 112.54 3a2z s LYS 122 Ca 0.68 1.44 0.00 0.00 -1.00 0.00 0.00 55.97 57.09 3a2z s LYS 122 Cb -0.07 -1.89 0.00 0.00 -2.06 0.00 0.00 37.83 33.80 3a2z s LYS 122 CO 0.50 -1.58 0.00 0.41 0.10 0.00 0.00 175.35 174.78 3a2z n GLY 123 N -0.40 4.21 7.00 0.59 0.00 0.53 -4.69 105.19 112.43 3a2z n GLY 123 Ca 0.11 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.81 3a2z n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a2z n GLY 124 N -1.18 3.44 0.41 -0.02 0.00 -1.15 -1.60 105.19 105.08 3a2z n GLY 124 Ca 0.00 -0.13 0.23 0.00 0.00 0.00 0.00 46.02 46.11 3a2z n GLY 124 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3a2z h GLU 125 N 0.00 0.00 -0.59 1.61 4.57 -1.99 -0.40 114.58 117.78 3a2z h GLU 125 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3a2z h GLU 125 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 3a2z h GLU 125 CO 0.00 0.00 0.00 1.19 -1.18 0.00 0.00 179.01 179.02 3a2z n PHE 126 N -4.26 2.02 0.00 0.92 0.99 -0.63 -5.00 117.46 111.51 3a2z n PHE 126 Ca 0.12 -0.71 0.00 0.00 -0.00 0.00 0.00 57.45 56.86 3a2z n PHE 126 Cb 0.71 -0.48 0.00 0.00 -1.00 0.00 0.00 39.48 38.72 3a2z n PHE 126 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 3a2z n LYS 127 N 0.72 0.00 -0.03 -1.08 5.02 -0.16 -1.34 118.16 121.28 3a2z n LYS 127 Ca 0.28 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.68 3a2z n LYS 127 Cb 1.16 0.00 0.11 0.00 -0.02 0.00 0.00 35.03 36.29 3a2z n LYS 127 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3a2z n ASP 128 N 1.45 2.96 -0.06 4.39 8.00 -1.26 0.20 116.55 132.23 3a2z n ASP 128 Ca 0.00 -1.94 -0.01 0.00 0.71 0.00 0.00 54.79 53.55 3a2z n ASP 128 Cb 0.00 -0.04 -0.16 0.00 -0.02 0.00 0.00 41.12 40.90 3a2z n ASP 128 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3a2z n THR 129 N 1.29 0.85 -4.22 -3.53 -2.24 -0.84 -4.81 114.28 100.78 3a2z n THR 129 Ca 0.14 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 3a2z n THR 129 Cb 0.56 -0.31 0.00 0.00 -2.10 0.00 0.00 70.33 68.49 3a2z n THR 129 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3a2z n GLY 130 N 1.54 -1.07 3.46 3.38 0.00 -0.45 -1.94 105.19 110.11 3a2z n GLY 130 Ca -0.20 -1.22 -0.12 0.00 0.00 0.00 0.00 46.02 44.48 3a2z n GLY 130 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3a2z s HIS 131 N 0.00 -0.49 -0.00 1.61 2.46 -1.09 -4.76 115.29 113.01 3a2z s HIS 131 Ca 0.00 0.41 0.01 0.00 0.47 0.00 0.00 55.06 55.94 3a2z s HIS 131 Cb 0.00 0.53 -0.00 0.00 -0.13 0.00 0.00 32.58 32.98 3a2z s HIS 131 CO 0.00 -0.71 -0.03 0.54 -2.47 0.00 0.00 174.74 172.07 3a2z s VAL 132 N -3.14 0.22 0.22 0.89 0.11 -1.26 -0.70 120.40 116.74 3a2z s VAL 132 Ca 0.01 -0.11 0.01 0.00 -2.93 0.00 0.00 61.98 58.95 3a2z s VAL 132 Cb -0.01 -0.20 -0.05 0.00 -1.53 0.00 0.00 36.38 34.59 3a2z s VAL 132 CO -0.08 0.07 0.08 0.00 -3.33 0.00 0.00 175.10 171.83 3a2z s ALA 133 N -0.01 1.50 -0.14 1.54 0.00 -0.20 -4.70 121.76 119.75 3a2z s ALA 133 Ca 0.01 -1.76 -0.03 0.00 0.00 0.00 0.00 51.96 50.18 3a2z s ALA 133 Cb -0.02 0.98 -0.03 0.00 0.00 0.00 0.00 23.12 24.06 3a2z s ALA 133 CO -0.00 -0.45 -0.05 0.42 0.00 0.00 0.00 175.76 175.68 3a2z s ILE 134 N -3.82 3.80 0.01 0.00 -1.09 -0.17 -0.69 121.20 119.25 3a2z s ILE 134 Ca 0.34 -0.40 -0.30 0.00 -2.23 0.00 0.00 60.65 58.06 3a2z s ILE 134 Cb 0.07 -2.64 -0.04 0.00 -1.58 0.00 0.00 42.46 38.27 3a2z s ILE 134 CO 0.11 0.51 1.13 -0.63 -1.23 0.00 0.00 174.94 174.82 3a2z s ILE 135 N 0.20 4.35 -0.08 2.92 1.01 -0.14 -0.78 121.20 128.69 3a2z s ILE 135 Ca -0.03 1.68 0.07 0.00 0.00 0.00 0.00 60.65 62.38 3a2z s ILE 135 Cb -0.14 -4.08 -0.10 0.00 0.01 0.00 0.00 42.46 38.15 3a2z s ILE 135 CO 0.03 0.10 0.04 0.35 0.00 0.00 0.00 174.94 175.46 3a2z n THR 136 N 4.07 0.52 -3.86 2.92 -2.24 0.52 0.27 114.28 116.48 3a2z n THR 136 Ca 0.08 -0.34 -0.12 0.00 -2.27 0.00 0.00 64.05 61.41 3a2z n THR 136 Cb 0.48 -0.69 -0.12 0.00 -2.10 0.00 0.00 70.33 67.90 3a2z n THR 136 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3a2z s GLN 137 N -2.23 0.28 -0.12 -0.78 -0.21 -1.10 -4.75 119.66 110.75 3a2z s GLN 137 Ca -0.04 -0.12 -0.01 0.00 0.02 0.00 0.00 55.36 55.21 3a2z s GLN 137 Cb 0.03 0.12 -0.02 0.00 1.00 0.00 0.00 33.01 34.13 3a2z s GLN 137 CO 0.34 -0.05 -0.09 -0.51 -2.12 0.00 0.00 175.29 172.86 3a2z s LEU 138 N -0.62 3.00 0.34 2.90 2.01 -1.26 -1.39 118.68 123.67 3a2z s LEU 138 Ca -0.07 -0.18 0.04 0.00 0.01 0.00 0.00 54.13 53.93 3a2z s LEU 138 Cb -0.04 -1.68 -0.04 0.00 0.01 0.00 0.00 46.19 44.44 3a2z s LEU 138 CO 0.00 0.23 0.14 -1.00 1.01 0.00 0.00 176.35 176.74 3a2z s HIS 139 N -0.01 1.71 0.37 0.29 3.76 -0.20 -5.02 115.29 116.18 3a2z s HIS 139 Ca -0.01 -1.30 0.08 0.00 -0.15 0.00 0.00 55.06 53.68 3a2z s HIS 139 Cb -0.14 -1.00 0.72 0.00 1.11 0.00 0.00 32.58 33.27 3a2z s HIS 139 CO 0.03 -0.40 1.88 0.78 -0.85 0.00 0.00 174.74 176.19 3a2z h GLY 140 N 2.06 0.30 -0.39 -2.22 0.00 -2.00 -3.30 103.07 97.53 3a2z h GLY 140 Ca -0.35 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 46.79 3a2z h GLY 140 CO 0.55 0.18 -0.20 1.16 0.00 0.00 0.00 176.54 178.23 3a2z n ASN 141 N -4.25 1.07 -3.62 0.19 6.94 -1.26 -4.78 115.26 109.54 3a2z n ASN 141 Ca -0.00 -2.25 -0.05 0.00 -0.02 0.00 0.00 54.58 52.26 3a2z n ASN 141 Cb 0.29 -0.23 -0.02 0.00 -2.36 0.00 0.00 39.78 37.46 3a2z n ASN 141 CO 0.00 0.00 0.00 -1.59 -1.03 0.00 0.00 177.26 174.64 3a2z s LYS 142 N -1.13 0.82 0.10 -3.83 -2.85 -1.24 -1.20 119.74 110.41 3a2z s LYS 142 Ca 0.11 -0.39 0.07 0.00 -1.00 0.00 0.00 55.97 54.76 3a2z s LYS 142 Cb 0.10 0.32 -0.03 0.00 -2.06 0.00 0.00 37.83 36.15 3a2z s LYS 142 CO 0.01 -0.37 -0.17 0.14 0.10 0.00 0.00 175.35 175.06 3a2z s VAL 143 N -2.97 1.46 -0.04 1.79 -7.23 -0.17 -1.03 120.40 112.20 3a2z s VAL 143 Ca 0.10 -1.54 -0.02 0.00 -1.81 0.00 0.00 61.98 58.70 3a2z s VAL 143 Cb -0.00 -1.43 -0.04 0.00 0.56 0.00 0.00 36.38 35.47 3a2z s VAL 143 CO -0.04 -0.20 0.10 -0.13 -0.31 0.00 0.00 175.10 174.52 3a2z s ARG 144 N -2.08 3.20 0.17 4.82 3.00 -0.49 -0.87 118.95 126.70 3a2z s ARG 144 Ca 0.05 -0.37 0.05 0.00 0.00 0.00 0.00 55.73 55.46 3a2z s ARG 144 Cb -0.09 -2.96 -0.05 0.00 0.00 0.00 0.00 34.95 31.86 3a2z s ARG 144 CO 0.04 0.69 -0.11 0.96 0.00 0.00 0.00 175.30 176.88 3a2z s ILE 145 N -1.14 1.35 0.04 1.52 -4.36 -0.29 -0.35 121.20 117.97 3a2z s ILE 145 Ca 0.21 -2.11 0.06 0.00 -0.26 0.00 0.00 60.65 58.55 3a2z s ILE 145 Cb -0.12 -1.95 -0.02 0.00 1.25 0.00 0.00 42.46 41.61 3a2z s ILE 145 CO 0.11 -0.66 -0.18 0.00 0.24 0.00 0.00 174.94 174.45 3a2z s ALA 146 N -3.21 1.54 0.07 2.27 0.00 0.04 -0.54 121.76 121.93 3a2z s ALA 146 Ca 0.20 -0.97 -0.27 0.00 0.00 0.00 0.00 51.96 50.92 3a2z s ALA 146 Cb 0.02 -0.29 0.08 0.00 0.00 0.00 0.00 23.12 22.94 3a2z s ALA 146 CO 0.03 0.33 0.93 -1.83 0.00 0.00 0.00 175.76 175.23 3a2z s GLU 147 N -1.15 0.99 0.29 0.00 -1.05 -1.26 -0.99 118.70 115.53 3a2z s GLU 147 Ca 0.05 -0.47 0.07 0.00 -0.15 0.00 0.00 54.97 54.47 3a2z s GLU 147 Cb -0.08 0.39 -0.03 0.00 -0.44 0.00 0.00 34.13 33.96 3a2z s GLU 147 CO 0.02 -0.45 0.21 -0.65 0.95 0.00 0.00 175.26 175.34 3a2z s GLN 148 N -3.19 2.77 -0.07 -4.83 -0.21 -1.26 -4.74 119.66 108.13 3a2z s GLN 148 Ca 0.09 -1.20 0.00 0.00 0.02 0.00 0.00 55.36 54.27 3a2z s GLN 148 Cb -0.01 -2.47 0.00 0.00 1.00 0.00 0.00 33.01 31.52 3a2z s GLN 148 CO -0.03 0.27 0.00 -1.71 -2.12 0.00 0.00 175.29 171.70 3a2z n ASN 149 N -1.22 -3.16 0.06 5.90 2.85 -1.26 -3.95 115.26 114.48 3a2z n ASN 149 Ca -0.05 0.02 0.00 0.00 -0.11 0.00 0.00 54.58 54.43 3a2z n ASN 149 Cb 0.59 -0.72 0.00 0.00 1.24 0.00 0.00 39.78 40.89 3a2z n ASN 149 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 3a2z n VAL 150 N -2.96 0.92 -3.56 3.44 0.31 -1.26 -4.99 118.33 110.23 3a2z n VAL 150 Ca -0.01 0.31 -0.36 0.00 -0.01 0.00 0.00 64.34 64.26 3a2z n VAL 150 Cb 0.04 -1.38 -0.07 0.00 -0.91 0.00 0.00 33.84 31.52 3a2z n VAL 150 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3a2z s ILE 151 N -2.00 5.30 0.00 2.52 -1.09 -1.26 -4.95 121.20 119.73 3a2z s ILE 151 Ca 0.00 0.53 0.00 0.00 -2.23 0.00 0.00 60.65 58.95 3a2z s ILE 151 Cb 0.00 -3.62 0.00 0.00 -1.58 0.00 0.00 42.46 37.26 3a2z s ILE 151 CO 0.00 0.41 0.89 1.41 -1.23 0.00 0.00 174.94 176.42 3a2z n HIS 152 N 3.39 0.00 -4.29 3.97 8.25 -1.26 -4.78 115.22 120.50 3a2z n HIS 152 Ca -0.13 -0.39 -0.31 0.00 -0.26 0.00 0.00 57.72 56.63 3a2z n HIS 152 Cb 0.52 -0.04 -0.09 0.00 1.12 0.00 0.00 29.99 31.50 3a2z n HIS 152 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3a2z s SER 153 N -0.79 4.74 0.36 0.41 0.15 -1.26 -0.37 113.70 116.94 3a2z s SER 153 Ca 0.00 -0.20 -0.28 0.00 0.70 0.00 0.00 55.95 56.17 3a2z s SER 153 Cb 0.00 -1.08 -0.12 0.00 -1.71 0.00 0.00 66.02 63.11 3a2z s SER 153 CO 0.00 0.23 1.39 -2.65 1.20 0.00 0.00 173.24 173.40 3a2z n PRO 154 N 1.04 2.40 -2.30 5.44 -0.02 -1.26 -4.91 135.00 135.39 3a2z n PRO 154 Ca -0.13 0.84 -0.32 0.00 -2.02 0.00 0.00 63.50 61.86 3a2z n PRO 154 Cb 0.52 -2.49 -0.02 0.00 -0.02 0.00 0.00 33.50 31.49 3a2z n PRO 154 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3a2z s LEU 155 N -1.51 3.59 0.65 2.45 1.43 0.06 -5.00 118.68 120.35 3a2z s LEU 155 Ca 0.54 1.65 -0.18 0.00 -1.03 0.00 0.00 54.13 55.12 3a2z s LEU 155 Cb -0.52 -4.52 -0.02 0.00 0.03 0.00 0.00 46.19 41.15 3a2z s LEU 155 CO 0.63 -0.76 1.06 -2.65 0.23 0.00 0.00 176.35 174.86 3a2z n PRO 156 N -1.70 0.86 -1.71 1.29 -0.02 -1.26 -4.87 135.00 127.59 3a2z n PRO 156 Ca 0.07 0.34 -0.43 0.00 -2.02 0.00 0.00 63.50 61.46 3a2z n PRO 156 Cb 0.54 -2.29 -0.02 0.00 -0.02 0.00 0.00 33.50 31.71 3a2z n PRO 156 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3a2z n GLN 157 N -1.49 2.42 -0.49 -0.52 1.13 -1.26 -1.70 117.38 115.46 3a2z n GLN 157 Ca 0.14 0.86 0.00 0.00 -1.94 0.00 0.00 57.00 56.07 3a2z n GLN 157 Cb 0.48 -2.61 0.00 0.00 0.11 0.00 0.00 30.24 28.22 3a2z n GLN 157 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3a2z n GLY 158 N 2.50 1.82 3.60 1.08 0.00 -1.26 -5.00 105.19 107.94 3a2z n GLY 158 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 3a2z n GLY 158 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3a2z s GLN 159 N -0.07 3.94 -0.40 1.61 0.74 -0.69 -4.94 119.66 119.85 3a2z s GLN 159 Ca 0.00 0.27 0.05 0.00 0.05 0.00 0.00 55.36 55.73 3a2z s GLN 159 Cb 0.00 -3.71 0.48 0.00 1.10 0.00 0.00 33.01 30.88 3a2z s GLN 159 CO 0.00 -0.49 1.52 1.04 -0.55 0.00 0.00 175.29 176.80 3a2z n GLN 160 N 5.74 2.81 -3.80 1.67 6.02 -1.26 -4.63 117.38 123.93 3a2z n GLN 160 Ca -0.02 -3.62 -0.11 0.00 -0.01 0.00 0.00 57.00 53.23 3a2z n GLN 160 Cb 0.49 -2.14 -0.08 0.00 1.02 0.00 0.00 30.24 29.53 3a2z n GLN 160 CO 0.00 0.00 0.00 1.67 -1.01 0.00 0.00 177.06 177.72 3a2z s TRP 161 N -3.56 -0.02 -0.24 1.08 1.48 -1.26 -4.14 118.94 112.28 3a2z s TRP 161 Ca 0.53 -0.18 0.05 0.00 -1.06 0.00 0.00 56.10 55.43 3a2z s TRP 161 Cb 0.44 0.04 -0.19 0.00 -1.16 0.00 0.00 33.47 32.59 3a2z s TRP 161 CO 0.01 -0.48 -0.12 0.25 -4.06 0.00 0.00 176.95 172.55 3a2z n THR 162 N 0.54 1.49 -3.95 0.66 -2.24 0.30 -4.98 114.28 106.10 3a2z n THR 162 Ca -0.18 -0.64 -0.08 0.00 -2.27 0.00 0.00 64.05 60.88 3a2z n THR 162 Cb 0.60 -1.25 -0.09 0.00 -2.10 0.00 0.00 70.33 67.49 3a2z n THR 162 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3a2z s ARG 163 N -2.52 0.72 -0.06 -0.78 0.52 -1.17 -4.98 118.95 110.68 3a2z s ARG 163 Ca -0.29 -1.00 0.05 0.00 -0.52 0.00 0.00 55.73 53.97 3a2z s ARG 163 Cb 0.08 0.28 -0.01 0.00 0.52 0.00 0.00 34.95 35.81 3a2z s ARG 163 CO 0.66 -0.19 -0.22 -1.83 0.02 0.00 0.00 175.30 173.74 3a2z s GLU 164 N -3.62 2.58 -0.06 3.54 -1.05 -1.26 -1.13 118.70 117.70 3a2z s GLU 164 Ca 0.04 -0.85 0.04 0.00 -0.15 0.00 0.00 54.97 54.05 3a2z s GLU 164 Cb 0.05 -2.24 -0.02 0.00 -0.44 0.00 0.00 34.13 31.48 3a2z s GLU 164 CO -0.09 0.43 -0.20 -0.51 0.95 0.00 0.00 175.26 175.84 3a2z s LEU 165 N -0.26 2.39 0.36 1.83 1.43 -0.05 -4.85 118.68 119.54 3a2z s LEU 165 Ca -0.00 -0.37 -0.28 0.00 -1.03 0.00 0.00 54.13 52.45 3a2z s LEU 165 Cb -0.13 -1.47 -0.10 0.00 0.03 0.00 0.00 46.19 44.52 3a2z s LEU 165 CO 0.03 0.27 1.39 -0.70 0.23 0.00 0.00 176.35 177.57 3a2z s GLU 166 N -0.31 4.18 -0.12 1.70 2.12 -1.22 -1.00 118.70 124.04 3a2z s GLU 166 Ca 0.02 2.37 0.01 0.00 0.36 0.00 0.00 54.97 57.72 3a2z s GLU 166 Cb -0.13 -2.97 0.02 0.00 0.26 0.00 0.00 34.13 31.31 3a2z s GLU 166 CO 0.02 -0.39 -0.14 1.41 -0.54 0.00 0.00 175.26 175.62 3a2z s MET 167 N -2.00 2.13 -0.22 4.30 -2.45 -0.34 -1.12 119.30 119.60 3a2z s MET 167 Ca 0.52 -0.51 -0.10 0.00 -1.25 0.00 0.00 55.69 54.36 3a2z s MET 167 Cb -0.43 -1.91 -0.05 0.00 1.25 0.00 0.00 34.83 33.69 3a2z s MET 167 CO 0.57 -0.16 0.13 0.08 1.05 0.00 0.00 175.02 176.68 3a2z s VAL 168 N 1.29 5.21 -0.27 10.11 1.01 0.35 -4.21 120.40 133.89 3a2z s VAL 168 Ca -0.00 0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.11 3a2z s VAL 168 Cb -0.14 -3.40 0.05 0.00 0.00 0.00 0.00 36.38 32.90 3a2z s VAL 168 CO -0.06 0.40 -0.08 -0.69 0.00 0.00 0.00 175.10 174.67 3a2z s VAL 169 N 0.71 2.45 -0.11 2.92 1.01 -1.26 -1.41 120.40 124.72 3a2z s VAL 169 Ca 0.07 -1.48 -0.12 0.00 0.00 0.00 0.00 61.98 60.45 3a2z s VAL 169 Cb -0.13 -2.40 0.03 0.00 0.00 0.00 0.00 36.38 33.89 3a2z s VAL 169 CO 0.01 -0.00 0.33 -1.61 0.00 0.00 0.00 175.10 173.83 3a2z s GLU 170 N 1.17 0.43 -1.67 2.72 2.02 -0.64 -4.92 118.70 117.82 3a2z s GLU 170 Ca -0.06 0.36 -0.15 0.00 0.02 0.00 0.00 54.97 55.13 3a2z s GLU 170 Cb -0.19 0.20 0.13 0.00 0.10 0.00 0.00 34.13 34.37 3a2z s GLU 170 CO -0.04 -0.07 0.64 0.09 0.02 0.00 0.00 175.26 175.90 3a2z n ASN 171 N 2.65 -2.28 0.00 -0.19 3.02 -1.26 -0.58 115.26 116.62 3a2z n ASN 171 Ca -0.14 -1.06 0.00 0.00 -0.03 0.00 0.00 54.58 53.35 3a2z n ASN 171 Cb 0.57 -2.58 0.00 0.00 -0.61 0.00 0.00 39.78 37.17 3a2z n ASN 171 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3a2z n GLY 172 N -1.55 0.53 3.35 7.41 0.00 -1.26 -5.03 105.19 108.64 3a2z n GLY 172 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 3a2z n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a2z s TYR 174 N -1.54 2.85 -0.13 0.00 1.51 -0.25 -1.62 117.35 118.18 3a2z s TYR 174 Ca 0.14 -1.14 0.00 0.00 -1.01 0.00 0.00 57.07 55.06 3a2z s TYR 174 Cb -0.08 -1.98 0.02 0.00 -0.11 0.00 0.00 41.96 39.81 3a2z s TYR 174 CO 0.06 -0.58 -0.12 0.99 -1.11 0.00 0.00 175.55 174.80 3a2z s THR 175 N 1.18 1.35 0.11 -0.71 2.01 -0.50 -0.56 115.64 118.52 3a2z s THR 175 Ca 0.02 -0.50 -0.17 0.00 0.31 0.00 0.00 61.69 61.34 3a2z s THR 175 Cb -0.14 -1.29 -0.07 0.00 0.01 0.00 0.00 72.50 71.01 3a2z s THR 175 CO -0.05 0.42 0.57 -0.76 -0.69 0.00 0.00 174.62 174.12 3a2z s LEU 176 N 1.49 4.44 -0.14 4.42 1.43 -1.26 -0.50 118.68 128.55 3a2z s LEU 176 Ca 0.03 1.20 0.00 0.00 -1.03 0.00 0.00 54.13 54.33 3a2z s LEU 176 Cb -0.13 -3.09 -0.01 0.00 0.03 0.00 0.00 46.19 42.99 3a2z s LEU 176 CO -0.08 0.19 -0.15 -0.54 0.23 0.00 0.00 176.35 176.00 3a2z s LYS 177 N -1.51 3.27 0.80 1.70 1.02 -0.28 -4.99 119.74 119.76 3a2z s LYS 177 Ca 0.33 -0.73 -0.11 0.00 0.02 0.00 0.00 55.97 55.49 3a2z s LYS 177 Cb -0.17 -2.62 0.07 0.00 -0.52 0.00 0.00 37.83 34.59 3a2z s LYS 177 CO 0.19 0.09 1.09 0.34 -0.92 0.00 0.00 175.35 176.14 3a2z s ASP 178 N 0.64 4.33 0.38 2.83 2.15 -1.26 -3.45 116.67 122.28 3a2z s ASP 178 Ca -0.08 1.62 0.23 0.00 0.43 0.00 0.00 52.55 54.74 3a2z s ASP 178 Cb -0.16 -2.34 0.25 0.00 -0.30 0.00 0.00 42.92 40.37 3a2z s ASP 178 CO 0.03 -2.12 1.46 0.71 -0.17 0.00 0.00 175.17 175.08 3a2z h THR 179 N -1.19 0.03 -3.36 1.71 1.35 -2.00 -3.45 112.91 106.01 3a2z h THR 179 Ca -0.46 -1.04 -0.55 0.00 -0.55 0.00 0.00 66.41 63.81 3a2z h THR 179 Cb 1.25 1.89 -0.03 0.00 -1.73 0.00 0.00 68.15 69.53 3a2z h THR 179 CO 0.54 0.02 -0.16 -0.36 -0.25 0.00 0.00 175.52 175.31 3a2z s PHE 180 N -3.24 3.45 -0.26 4.73 0.40 -1.26 -5.03 117.98 116.78 3a2z s PHE 180 Ca 0.05 0.82 0.23 0.00 -0.60 0.00 0.00 56.93 57.42 3a2z s PHE 180 Cb 0.06 -2.21 -0.02 0.00 0.51 0.00 0.00 43.02 41.37 3a2z s PHE 180 CO 0.70 0.33 0.99 -0.25 0.70 0.00 0.00 175.22 177.69 3a2z n ASP 181 N 0.02 0.73 -0.80 1.36 10.43 -1.26 -4.36 116.55 122.67 3a2z n ASP 181 Ca -0.01 0.24 0.07 0.00 2.57 0.00 0.00 54.79 57.67 3a2z n ASP 181 Cb 0.52 0.64 0.22 0.00 1.84 0.00 0.00 41.12 44.33 3a2z n ASP 181 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 3a2z n ASP 182 N -2.55 3.49 -5.02 -2.24 5.68 -1.26 -5.02 116.55 109.64 3a2z n ASP 182 Ca -0.00 -2.57 -0.18 0.00 -0.50 0.00 0.00 54.79 51.54 3a2z n ASP 182 Cb 0.54 -0.41 0.03 0.00 -1.14 0.00 0.00 41.12 40.13 3a2z n ASP 182 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 3a2z s THR 183 N -2.02 2.74 -0.16 2.12 -4.23 -1.26 -2.93 115.64 109.90 3a2z s THR 183 Ca 0.34 -0.99 -0.02 0.00 -1.18 0.00 0.00 61.69 59.84 3a2z s THR 183 Cb 0.25 -2.75 0.05 0.00 1.34 0.00 0.00 72.50 71.38 3a2z s THR 183 CO 0.12 0.00 -0.01 -0.89 -0.54 0.00 0.00 174.62 173.30 3a2z s THR 184 N -2.45 0.75 -0.08 3.99 2.01 -1.26 -5.01 115.64 113.59 3a2z s THR 184 Ca 0.57 -0.48 -0.29 0.00 0.31 0.00 0.00 61.69 61.80 3a2z s THR 184 Cb -0.09 -1.06 -0.02 0.00 0.01 0.00 0.00 72.50 71.34 3a2z s THR 184 CO 0.35 0.01 0.95 -0.63 -0.69 0.00 0.00 174.62 174.60 3a2z s ILE 185 N 1.78 4.84 -0.10 1.82 1.01 -1.26 -0.71 121.20 128.58 3a2z s ILE 185 Ca 0.01 1.94 -0.22 0.00 0.00 0.00 0.00 60.65 62.38 3a2z s ILE 185 Cb -0.16 -4.27 -0.19 0.00 0.01 0.00 0.00 42.46 37.85 3a2z s ILE 185 CO -0.07 0.07 0.71 -0.07 0.00 0.00 0.00 174.94 175.58 3a2z h LEU 186 N 7.60 -0.04 0.00 2.97 3.38 -1.06 -3.43 115.31 124.74 3a2z h LEU 186 Ca -0.34 -0.65 0.00 0.00 0.09 0.00 0.00 57.88 56.97 3a2z h LEU 186 Cb 1.17 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.93 3a2z h LEU 186 CO 0.81 0.74 0.00 0.61 0.09 0.00 0.00 178.44 180.69 3a2z n GLY 187 N 1.30 -0.77 3.48 0.83 0.00 -1.07 -0.94 105.19 108.01 3a2z n GLY 187 Ca -0.08 -1.28 -0.25 0.00 0.00 0.00 0.00 46.02 44.41 3a2z n GLY 187 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3a2z s TRP 188 N -2.92 2.35 -0.03 1.61 -2.14 -0.49 -0.83 118.94 116.48 3a2z s TRP 188 Ca 0.00 -0.32 0.07 0.00 2.66 0.00 0.00 56.10 58.51 3a2z s TRP 188 Cb 0.00 -1.07 -0.02 0.00 -3.10 0.00 0.00 33.47 29.28 3a2z s TRP 188 CO 0.00 0.63 -0.23 -1.64 -2.66 0.00 0.00 176.95 173.05 3a2z s MET 189 N -3.23 2.21 -0.01 3.25 -1.94 0.18 -0.36 119.30 119.40 3a2z s MET 189 Ca 0.27 -0.87 0.03 0.00 -1.71 0.00 0.00 55.69 53.41 3a2z s MET 189 Cb -0.06 -2.13 -0.01 0.00 2.01 0.00 0.00 34.83 34.65 3a2z s MET 189 CO 0.14 0.57 -0.10 0.42 -0.01 0.00 0.00 175.02 176.04 3a2z s ILE 190 N -0.63 0.79 -0.64 2.53 1.01 -0.65 -2.85 121.20 120.76 3a2z s ILE 190 Ca 0.10 -0.41 -0.27 0.00 0.00 0.00 0.00 60.65 60.07 3a2z s ILE 190 Cb -0.10 -0.67 0.01 0.00 0.01 0.00 0.00 42.46 41.71 3a2z s ILE 190 CO -0.01 0.23 1.51 -1.58 0.00 0.00 0.00 174.94 175.10 3a2z s GLN 191 N -0.14 3.05 0.01 2.79 -0.44 -1.26 -1.29 119.66 122.37 3a2z s GLN 191 Ca 0.02 0.27 -0.29 0.00 -2.50 0.00 0.00 55.36 52.86 3a2z s GLN 191 Cb -0.05 -4.23 0.10 0.00 -1.64 0.00 0.00 33.01 27.19 3a2z s GLN 191 CO -0.00 -2.26 0.91 -0.08 0.50 0.00 0.00 175.29 174.36 3a2z s THR 192 N 6.91 0.00 0.59 -0.34 -1.32 -0.94 -4.97 115.64 115.56 3a2z s THR 192 Ca 0.51 -0.08 -0.07 0.00 -1.21 0.00 0.00 61.69 60.84 3a2z s THR 192 Cb -0.11 -1.13 -0.01 0.00 -1.51 0.00 0.00 72.50 69.75 3a2z s THR 192 CO 0.20 0.00 0.93 -0.70 -2.21 0.00 0.00 174.62 172.84 3a2z s GLU 193 N -3.10 3.17 -0.61 7.08 2.56 -1.26 -3.58 118.70 122.96 3a2z s GLU 193 Ca 0.06 0.25 -0.28 0.00 0.00 0.00 0.00 54.97 55.00 3a2z s GLU 193 Cb -0.01 -2.22 0.02 0.00 2.00 0.00 0.00 34.13 33.92 3a2z s GLU 193 CO -0.08 -0.61 1.35 0.34 -0.56 0.00 0.00 175.26 175.70 3a2z s ASP 194 N -4.24 6.17 -0.27 -1.70 3.68 -1.26 -4.82 116.67 114.23 3a2z s ASP 194 Ca 0.53 0.06 0.10 0.00 2.13 0.00 0.00 52.55 55.36 3a2z s ASP 194 Cb -0.11 -2.55 0.46 0.00 -1.45 0.00 0.00 42.92 39.27 3a2z s ASP 194 CO 0.48 -1.72 1.19 0.35 0.13 0.00 0.00 175.17 175.59 3a2z n THR 195 N 6.71 2.31 -4.27 1.71 -2.24 -1.26 -5.00 114.28 112.24 3a2z n THR 195 Ca 0.09 -3.90 -0.19 0.00 -2.27 0.00 0.00 64.05 57.79 3a2z n THR 195 Cb 0.49 -0.73 -0.15 0.00 -2.10 0.00 0.00 70.33 67.84 3a2z n THR 195 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3a2z s GLU 196 N -3.51 0.75 0.00 -0.78 2.02 -1.26 -5.29 118.70 110.63 3a2z s GLU 196 Ca 0.46 -0.23 0.00 0.00 0.02 0.00 0.00 54.97 55.23 3a2z s GLU 196 Cb 0.40 -0.72 0.00 0.00 0.10 0.00 0.00 34.13 33.90 3a2z s GLU 196 CO 0.01 0.08 0.26 0.98 0.02 0.00 0.00 175.26 176.61