#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2btm s LYS 2 N 0.00 4.45 0.68 5.56 2.20 -1.26 -5.00 119.74 126.37 2btm s LYS 2 Ca 0.00 1.74 -0.15 0.00 -0.36 0.00 0.00 55.97 57.20 2btm s LYS 2 Cb 0.00 -3.36 0.01 0.00 -1.51 0.00 0.00 37.83 32.98 2btm s LYS 2 CO 0.00 -0.23 1.14 -1.25 -0.36 0.00 0.00 175.35 174.65 2btm s PRO 3 N 1.02 2.59 -0.06 4.03 0.04 -1.26 -4.88 135.00 136.49 2btm s PRO 3 Ca 0.58 1.52 -0.02 0.00 0.04 0.00 0.00 61.00 63.11 2btm s PRO 3 Cb -0.29 -1.91 0.04 0.00 0.04 0.00 0.00 34.50 32.38 2btm s PRO 3 CO 0.29 -1.43 0.11 -1.50 0.04 0.00 0.00 177.00 174.50 2btm s ILE 4 N -2.21 -0.15 -0.23 0.56 2.07 -0.52 -1.60 121.20 119.12 2btm s ILE 4 Ca 0.69 0.34 -0.02 0.00 -1.41 0.00 0.00 60.65 60.26 2btm s ILE 4 Cb -0.23 -0.21 0.01 0.00 0.13 0.00 0.00 42.46 42.16 2btm s ILE 4 CO 0.42 0.14 -0.08 -0.63 -1.91 0.00 0.00 174.94 172.88 2btm s ILE 5 N 1.94 2.90 -0.12 2.00 1.09 -0.36 -2.15 121.20 126.51 2btm s ILE 5 Ca 0.01 -0.83 0.01 0.00 -1.10 0.00 0.00 60.65 58.74 2btm s ILE 5 Cb -0.12 -2.38 -0.01 0.00 -1.06 0.00 0.00 42.46 38.89 2btm s ILE 5 CO -0.04 0.34 -0.17 0.00 -0.10 0.00 0.00 174.94 174.96 2btm s ALA 6 N 1.37 2.46 -0.19 9.38 0.00 -0.45 -1.28 121.76 133.06 2btm s ALA 6 Ca 0.03 -0.92 -0.13 0.00 0.00 0.00 0.00 51.96 50.94 2btm s ALA 6 Cb -0.15 -1.06 -0.05 0.00 0.00 0.00 0.00 23.12 21.86 2btm s ALA 6 CO -0.06 0.27 0.26 0.20 0.00 0.00 0.00 175.76 176.44 2btm s GLY 7 N 0.31 2.12 -0.53 0.00 0.00 0.12 -0.40 107.32 108.95 2btm s GLY 7 Ca -0.13 -0.58 -0.05 0.00 0.00 0.00 0.00 44.72 43.96 2btm s GLY 7 CO 0.07 0.45 0.36 0.21 0.00 0.00 0.00 173.10 174.19 2btm s ASN 8 N 0.66 5.48 0.37 1.64 2.47 0.21 -0.06 114.94 125.71 2btm s ASN 8 Ca 0.14 -2.32 0.27 0.00 0.42 0.00 0.00 52.86 51.38 2btm s ASN 8 Cb -0.13 -1.91 1.27 0.00 -1.45 0.00 0.00 41.25 39.02 2btm s ASN 8 CO 0.04 -0.53 1.82 -0.50 -3.72 0.00 0.00 177.10 174.20 2btm h TRP 9 N 7.81 0.00 0.00 0.43 6.55 -1.68 -3.39 115.95 125.66 2btm h TRP 9 Ca -0.10 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.74 2btm h TRP 9 Cb 1.02 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.32 2btm h TRP 9 CO 0.66 0.00 0.00 1.63 -1.05 0.00 0.00 178.44 179.68 2btm n LYS 10 N -2.48 0.00 -2.42 0.49 5.02 -1.26 -3.22 118.16 114.29 2btm n LYS 10 Ca 0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 2btm n LYS 10 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.18 2btm n LYS 10 CO 0.00 0.00 0.00 -0.12 -0.52 0.00 0.00 177.40 176.76 2btm n MET 11 N 3.03 3.55 -4.11 1.97 0.00 -1.26 -4.35 117.12 115.94 2btm n MET 11 Ca 0.00 -3.54 -0.10 0.00 -0.00 0.00 0.00 57.70 54.06 2btm n MET 11 Cb 0.00 -2.96 -0.10 0.00 0.00 0.00 0.00 33.22 30.15 2btm n MET 11 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 175.97 175.17 2btm s ASN 12 N 1.31 0.84 0.00 6.12 0.01 -1.20 -5.13 114.94 116.90 2btm s ASN 12 Ca 0.41 -0.85 0.00 0.00 -0.71 0.00 0.00 52.86 51.71 2btm s ASN 12 Cb 0.08 0.10 0.00 0.00 0.41 0.00 0.00 41.25 41.84 2btm s ASN 12 CO 0.00 -0.42 0.00 0.61 -1.51 0.00 0.00 177.10 175.78 2btm n GLY 13 N 0.51 -0.83 3.42 0.66 0.00 -1.26 -4.79 105.19 102.90 2btm n GLY 13 Ca -0.16 -1.67 -0.21 0.00 0.00 0.00 0.00 46.02 43.98 2btm n GLY 13 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2btm s THR 14 N -1.98 1.68 0.16 2.61 -4.23 -1.26 -5.01 115.64 107.60 2btm s THR 14 Ca 0.00 -2.14 -0.18 0.00 -1.18 0.00 0.00 61.69 58.19 2btm s THR 14 Cb 0.00 -2.39 0.07 0.00 1.34 0.00 0.00 72.50 71.52 2btm s THR 14 CO 0.00 -0.34 1.67 0.25 -0.54 0.00 0.00 174.62 175.66 2btm h LEU 15 N 2.32 -0.37 -0.18 4.79 5.85 -1.96 -1.51 115.31 124.25 2btm h LEU 15 Ca -0.40 0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.48 2btm h LEU 15 Cb 1.23 0.23 -0.04 0.00 0.37 0.00 0.00 40.66 42.46 2btm h LEU 15 CO 0.66 -0.13 -0.08 0.00 -0.34 0.00 0.00 178.44 178.55 2btm h ALA 16 N 1.32 0.08 -0.79 1.25 0.00 -1.99 -0.83 119.26 118.29 2btm h ALA 16 Ca 0.17 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2btm h ALA 16 Cb 0.28 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 2btm h ALA 16 CO -0.37 -0.51 0.47 0.93 0.00 0.00 0.00 179.25 179.77 2btm h GLU 17 N -0.06 1.08 -0.78 0.00 5.08 -1.91 -1.05 114.58 116.94 2btm h GLU 17 Ca 0.10 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2btm h GLU 17 Cb 0.20 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 2btm h GLU 17 CO -0.22 0.76 0.47 0.00 -1.00 0.00 0.00 179.01 179.02 2btm h ALA 18 N 1.25 1.00 -0.39 3.43 0.00 -0.80 0.80 119.26 124.55 2btm h ALA 18 Ca 0.28 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 2btm h ALA 18 Cb -0.03 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2btm h ALA 18 CO -0.05 0.47 -0.12 0.28 0.00 0.00 0.00 179.25 179.83 2btm h VAL 19 N 1.07 1.28 -0.74 0.00 2.07 -0.76 -2.27 116.25 116.90 2btm h VAL 19 Ca 0.28 -1.22 -0.03 0.00 0.82 0.00 0.00 66.70 66.55 2btm h VAL 19 Cb -0.03 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 2btm h VAL 19 CO -0.05 0.41 0.34 -0.61 0.02 0.00 0.00 177.57 177.68 2btm h GLN 20 N 0.57 1.08 -0.24 1.57 5.75 -0.86 -0.70 115.11 122.29 2btm h GLN 20 Ca 0.10 -0.17 0.04 0.00 -0.15 0.00 0.00 58.65 58.46 2btm h GLN 20 Cb 0.65 -0.19 -0.03 0.00 1.07 0.00 0.00 27.48 28.98 2btm h GLN 20 CO 0.04 0.85 0.02 0.35 -2.65 0.00 0.00 178.83 177.44 2btm h PHE 21 N 1.05 0.02 -0.26 3.99 3.04 -0.67 0.19 116.94 124.30 2btm h PHE 21 Ca 0.25 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.19 2btm h PHE 21 Cb 0.14 0.03 -0.01 0.00 2.56 0.00 0.00 35.95 38.67 2btm h PHE 21 CO 0.01 -0.02 0.06 0.28 -2.02 0.00 0.00 178.31 176.63 2btm h VAL 22 N 0.09 1.21 -1.00 1.41 2.07 -1.08 -2.05 116.25 116.91 2btm h VAL 22 Ca 0.11 -0.70 0.05 0.00 0.82 0.00 0.00 66.70 66.98 2btm h VAL 22 Cb 0.13 1.18 -0.06 0.00 -1.52 0.00 0.00 31.29 31.02 2btm h VAL 22 CO -0.17 0.23 0.65 -0.08 0.02 0.00 0.00 177.57 178.22 2btm h GLU 23 N 0.25 1.18 0.00 1.57 4.57 -0.78 0.68 114.58 122.06 2btm h GLU 23 Ca 0.08 -0.07 -0.13 0.00 -1.18 0.00 0.00 59.36 58.06 2btm h GLU 23 Cb 0.28 -0.27 -0.02 0.00 -0.16 0.00 0.00 28.75 28.59 2btm h GLU 23 CO 0.00 0.78 -0.62 -0.44 -1.18 0.00 0.00 179.01 177.55 2btm h ASP 24 N 1.22 0.00 0.00 1.04 3.32 -0.43 -3.38 116.42 118.19 2btm h ASP 24 Ca 0.42 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 57.12 2btm h ASP 24 Cb 0.09 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.58 2btm h ASP 24 CO -0.15 0.62 -2.32 0.52 -1.72 0.00 0.00 179.24 176.19 2btm n VAL 25 N -3.77 1.32 -0.32 -1.35 0.31 -0.79 -4.69 118.33 109.04 2btm n VAL 25 Ca -0.01 -0.60 0.22 0.00 -0.01 0.00 0.00 64.34 63.94 2btm n VAL 25 Cb 0.62 -1.08 0.44 0.00 -0.91 0.00 0.00 33.84 32.91 2btm n VAL 25 CO 0.00 0.00 0.00 0.07 -1.32 0.00 0.00 176.83 175.58 2btm h LYS 26 N 0.00 0.22 -0.01 5.55 2.10 0.19 0.56 116.57 125.19 2btm h LYS 26 Ca -0.52 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.12 2btm h LYS 26 Cb 1.92 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 33.20 2btm h LYS 26 CO -0.05 0.15 -0.10 0.41 -2.00 0.00 0.00 179.45 177.86 2btm n GLY 27 N -1.32 -0.56 0.20 0.07 0.00 -1.26 -3.89 105.19 98.43 2btm n GLY 27 Ca 0.30 -0.35 0.02 0.00 0.00 0.00 0.00 46.02 45.99 2btm n GLY 27 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2btm n HIS 28 N -0.51 0.13 -2.60 1.61 8.25 0.17 -5.01 115.22 117.25 2btm n HIS 28 Ca 0.17 -0.42 -0.34 0.00 -0.26 0.00 0.00 57.72 56.87 2btm n HIS 28 Cb 0.30 -0.04 -0.04 0.00 1.12 0.00 0.00 29.99 31.33 2btm n HIS 28 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2btm s VAL 29 N -0.88 3.90 1.05 1.59 1.01 -1.06 -5.02 120.40 121.00 2btm s VAL 29 Ca 0.07 1.22 -0.12 0.00 0.00 0.00 0.00 61.98 63.15 2btm s VAL 29 Cb 0.04 -3.51 0.20 0.00 0.00 0.00 0.00 36.38 33.11 2btm s VAL 29 CO 0.05 -0.23 0.97 -2.65 0.00 0.00 0.00 175.10 173.25 2btm n PRO 30 N -0.79 -1.43 -1.89 2.72 -0.02 -1.26 -4.92 135.00 127.41 2btm n PRO 30 Ca 0.08 -0.37 -0.40 0.00 -2.02 0.00 0.00 63.50 60.79 2btm n PRO 30 Cb 0.52 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 2btm n PRO 30 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2btm s PRO 31 N -4.39 3.96 0.40 0.52 0.02 -1.26 -4.80 135.00 129.44 2btm s PRO 31 Ca 0.66 2.39 0.07 0.00 0.02 0.00 0.00 61.00 64.15 2btm s PRO 31 Cb -0.23 -2.83 0.83 0.00 0.02 0.00 0.00 34.50 32.29 2btm s PRO 31 CO 0.62 -0.58 2.02 0.00 -0.33 0.00 0.00 177.00 178.73 2btm h ALA 32 N 2.74 1.74 0.00 -1.55 0.00 -1.88 -0.63 119.26 119.68 2btm h ALA 32 Ca -0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2btm h ALA 32 Cb 1.25 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2btm h ALA 32 CO 0.63 0.19 0.00 -0.40 0.00 0.00 0.00 179.25 179.67 2btm n ASP 33 N -4.47 0.67 -0.12 0.00 5.68 -1.26 -3.36 116.55 113.68 2btm n ASP 33 Ca 0.07 0.66 -0.26 0.00 -0.50 0.00 0.00 54.79 54.76 2btm n ASP 33 Cb 0.15 -0.81 -0.10 0.00 -1.14 0.00 0.00 41.12 39.22 2btm n ASP 33 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2btm n GLU 34 N -2.24 0.58 -3.84 0.11 1.02 -0.34 -5.01 120.64 110.91 2btm n GLU 34 Ca 0.02 0.41 -0.12 0.00 -0.02 0.00 0.00 57.16 57.45 2btm n GLU 34 Cb 0.23 -1.61 -0.13 0.00 -0.02 0.00 0.00 31.44 29.92 2btm n GLU 34 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2btm s VAL 35 N -2.45 0.01 -0.38 2.62 1.01 -0.63 -4.25 120.40 116.34 2btm s VAL 35 Ca -0.34 -0.11 -0.19 0.00 0.00 0.00 0.00 61.98 61.34 2btm s VAL 35 Cb 0.11 -0.19 0.01 0.00 0.00 0.00 0.00 36.38 36.30 2btm s VAL 35 CO 0.53 -0.06 0.57 -0.63 0.00 0.00 0.00 175.10 175.51 2btm s ILE 36 N -0.14 4.95 -0.29 2.22 1.01 -0.63 -4.16 121.20 124.15 2btm s ILE 36 Ca -0.02 0.30 -0.10 0.00 0.00 0.00 0.00 60.65 60.82 2btm s ILE 36 Cb -0.02 -4.05 -0.03 0.00 0.01 0.00 0.00 42.46 38.37 2btm s ILE 36 CO 0.00 -0.34 0.17 -0.44 0.00 0.00 0.00 174.94 174.33 2btm s SER 37 N 1.83 5.77 -0.00 3.58 0.01 -1.26 -1.22 113.70 122.40 2btm s SER 37 Ca 0.20 -0.25 0.06 0.00 1.31 0.00 0.00 55.95 57.28 2btm s SER 37 Cb -0.15 -2.06 -0.02 0.00 0.21 0.00 0.00 66.02 64.00 2btm s SER 37 CO 0.15 -0.12 -0.19 -0.69 0.41 0.00 0.00 173.24 172.80 2btm s VAL 38 N 1.69 1.53 -0.18 3.43 1.01 -0.40 -0.80 120.40 126.68 2btm s VAL 38 Ca 0.06 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.16 2btm s VAL 38 Cb -0.16 -1.28 0.03 0.00 0.00 0.00 0.00 36.38 34.97 2btm s VAL 38 CO 0.09 0.38 -0.13 -0.69 0.00 0.00 0.00 175.10 174.75 2btm s VAL 39 N -0.52 1.68 -0.43 2.92 1.01 -0.15 0.15 120.40 125.05 2btm s VAL 39 Ca 0.07 -0.88 -0.12 0.00 0.00 0.00 0.00 61.98 61.05 2btm s VAL 39 Cb -0.08 -1.66 0.07 0.00 0.00 0.00 0.00 36.38 34.71 2btm s VAL 39 CO -0.00 0.31 0.31 0.00 0.00 0.00 0.00 175.10 175.71 2btm s ALA 41 N 1.53 3.78 0.56 0.00 0.00 -0.93 -2.10 121.76 124.61 2btm s ALA 41 Ca 0.03 -1.77 -0.20 0.00 0.00 0.00 0.00 51.96 50.02 2btm s ALA 41 Cb -0.23 -0.98 -0.05 0.00 0.00 0.00 0.00 23.12 21.86 2btm s ALA 41 CO 0.05 -0.04 1.16 -2.30 0.00 0.00 0.00 175.76 174.62 2btm n PRO 42 N -1.34 1.27 -0.29 0.00 -0.02 -1.26 -4.12 135.00 129.23 2btm n PRO 42 Ca -0.01 0.48 0.12 0.00 -2.02 0.00 0.00 63.50 62.07 2btm n PRO 42 Cb 0.61 -2.35 0.28 0.00 -0.02 0.00 0.00 33.50 32.02 2btm n PRO 42 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2btm h PHE 43 N 0.97 0.48 -0.92 6.00 0.04 -1.96 -1.54 116.94 120.02 2btm h PHE 43 Ca -0.49 0.04 0.21 0.00 2.80 0.00 0.00 57.97 60.53 2btm h PHE 43 Cb 1.34 -0.07 -0.07 0.00 2.20 0.00 0.00 35.95 39.34 2btm h PHE 43 CO 0.41 -0.11 0.60 -0.07 -0.60 0.00 0.00 178.31 178.54 2btm h LEU 44 N 0.31 0.42 0.00 1.54 4.07 -2.04 -2.81 115.31 116.80 2btm h LEU 44 Ca 0.53 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.54 2btm h LEU 44 Cb 1.02 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.73 2btm h LEU 44 CO -0.57 0.16 -0.98 0.49 -1.08 0.00 0.00 178.44 176.46 2btm n PHE 45 N -4.52 0.38 -0.21 1.13 3.72 -0.58 -4.57 117.46 112.80 2btm n PHE 45 Ca 0.20 0.11 -0.03 0.00 -0.05 0.00 0.00 57.45 57.68 2btm n PHE 45 Cb 0.71 -0.54 0.03 0.00 -0.94 0.00 0.00 39.48 38.75 2btm n PHE 45 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2btm h LEU 46 N 0.00 -0.96 -0.34 4.37 3.38 -1.48 -2.11 115.31 118.18 2btm h LEU 46 Ca 0.00 0.22 0.04 0.00 0.09 0.00 0.00 57.88 58.23 2btm h LEU 46 Cb 0.77 0.52 -0.07 0.00 0.09 0.00 0.00 40.66 41.97 2btm h LEU 46 CO 0.00 -0.28 -0.45 -0.78 0.09 0.00 0.00 178.44 177.03 2btm h ASP 47 N -0.10 -1.50 -0.31 -0.43 3.58 -1.80 0.22 116.42 116.08 2btm h ASP 47 Ca 0.27 0.20 -0.04 0.00 0.42 0.00 0.00 57.03 57.88 2btm h ASP 47 Cb 0.53 0.62 -0.02 0.00 1.72 0.00 0.00 39.33 42.18 2btm h ASP 47 CO -0.69 -0.32 0.08 0.03 -2.88 0.00 0.00 179.24 175.46 2btm h ARG 48 N -0.31 0.57 -0.33 0.28 3.08 -1.83 -2.47 114.38 113.37 2btm h ARG 48 Ca 0.06 -0.10 -0.05 0.00 0.07 0.00 0.00 59.98 59.96 2btm h ARG 48 Cb 0.47 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 2btm h ARG 48 CO -0.48 0.53 0.01 -0.07 -1.07 0.00 0.00 179.97 178.89 2btm h LEU 49 N 0.56 0.55 -0.50 3.04 4.07 -0.64 -0.46 115.31 121.93 2btm h LEU 49 Ca 0.13 -0.30 0.01 0.00 0.08 0.00 0.00 57.88 57.81 2btm h LEU 49 Cb 0.23 -0.15 -0.03 0.00 1.08 0.00 0.00 40.66 41.79 2btm h LEU 49 CO -0.00 0.71 0.31 0.58 -1.08 0.00 0.00 178.44 178.96 2btm h VAL 50 N 0.38 1.09 -0.54 1.22 2.07 -0.33 0.20 116.25 120.33 2btm h VAL 50 Ca 0.09 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 2btm h VAL 50 Cb 0.42 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 2btm h VAL 50 CO 0.01 0.11 0.26 1.56 0.02 0.00 0.00 177.57 179.54 2btm h GLN 51 N 0.63 0.78 -0.35 1.57 4.20 -1.31 -1.10 115.11 119.53 2btm h GLN 51 Ca 0.19 -0.11 -0.13 0.00 0.06 0.00 0.00 58.65 58.65 2btm h GLN 51 Cb -0.03 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 2btm h GLN 51 CO -0.07 0.64 -0.32 0.00 -0.67 0.00 0.00 178.83 178.42 2btm h ALA 52 N 1.10 0.78 0.00 3.87 0.00 -0.65 -3.08 119.26 121.28 2btm h ALA 52 Ca 0.19 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2btm h ALA 52 Cb 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2btm h ALA 52 CO -0.02 0.65 -0.16 0.00 0.00 0.00 0.00 179.25 179.72 2btm n ALA 53 N -2.51 2.66 -1.66 0.00 0.00 0.65 -4.90 120.51 114.75 2btm n ALA 53 Ca -0.01 -0.16 -0.46 0.00 0.00 0.00 0.00 53.44 52.81 2btm n ALA 53 Cb 0.49 -1.37 -0.03 0.00 0.00 0.00 0.00 19.45 18.54 2btm n ALA 53 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2btm n ASP 54 N -1.62 2.56 0.00 0.00 2.03 -0.43 -1.72 116.55 117.37 2btm n ASP 54 Ca 0.06 1.14 0.00 0.00 0.52 0.00 0.00 54.79 56.51 2btm n ASP 54 Cb 0.35 -1.39 0.00 0.00 -0.72 0.00 0.00 41.12 39.36 2btm n ASP 54 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2btm n GLY 55 N 2.22 0.72 3.70 0.27 0.00 -1.26 -5.04 105.19 105.80 2btm n GLY 55 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2btm n GLY 55 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2btm s THR 56 N -2.54 1.02 -2.43 2.61 -4.23 -0.70 -5.03 115.64 104.34 2btm s THR 56 Ca 0.00 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 58.76 2btm s THR 56 Cb 0.00 -2.21 0.51 0.00 1.34 0.00 0.00 72.50 72.14 2btm s THR 56 CO 0.00 0.00 1.66 0.47 -0.54 0.00 0.00 174.62 176.21 2btm n ASP 57 N -1.28 1.62 -4.60 3.99 8.00 -1.26 -4.80 116.55 118.21 2btm n ASP 57 Ca -0.16 -1.59 -0.43 0.00 0.71 0.00 0.00 54.79 53.33 2btm n ASP 57 Cb 0.66 -0.04 -0.04 0.00 -0.02 0.00 0.00 41.12 41.68 2btm n ASP 57 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2btm s LEU 58 N -1.84 4.01 0.12 0.64 1.98 -1.26 -4.32 118.68 118.02 2btm s LEU 58 Ca 0.36 0.55 -0.07 0.00 -2.89 0.00 0.00 54.13 52.08 2btm s LEU 58 Cb 0.20 -3.23 -0.06 0.00 0.66 0.00 0.00 46.19 43.76 2btm s LEU 58 CO 0.31 -0.84 0.39 -0.54 -1.89 0.00 0.00 176.35 173.78 2btm s LYS 59 N 3.42 3.67 -0.15 1.98 3.01 0.02 -4.84 119.74 126.86 2btm s LYS 59 Ca 0.37 0.02 -0.04 0.00 -1.01 0.00 0.00 55.97 55.32 2btm s LYS 59 Cb -0.12 -2.89 -0.03 0.00 -1.01 0.00 0.00 37.83 33.78 2btm s LYS 59 CO 0.18 0.49 -0.03 0.42 0.51 0.00 0.00 175.35 176.93 2btm s ILE 60 N -1.57 4.01 0.31 2.17 -1.09 -1.26 -0.98 121.20 122.79 2btm s ILE 60 Ca 0.38 -0.32 0.07 0.00 -2.23 0.00 0.00 60.65 58.56 2btm s ILE 60 Cb -0.13 -2.75 -0.06 0.00 -1.58 0.00 0.00 42.46 37.94 2btm s ILE 60 CO 0.22 0.51 -0.06 -0.83 -1.23 0.00 0.00 174.94 173.54 2btm s GLY 61 N 0.19 2.00 0.26 6.18 0.00 0.21 -1.86 107.32 114.30 2btm s GLY 61 Ca -0.01 -1.99 0.07 0.00 0.00 0.00 0.00 44.72 42.78 2btm s GLY 61 CO 0.03 -1.92 0.26 0.00 0.00 0.00 0.00 173.10 171.47 2btm s ALA 62 N -2.88 3.73 -0.98 3.20 0.00 0.85 -2.18 121.76 123.50 2btm s ALA 62 Ca 0.31 -1.39 0.25 0.00 0.00 0.00 0.00 51.96 51.13 2btm s ALA 62 Cb 0.04 -1.42 0.51 0.00 0.00 0.00 0.00 23.12 22.25 2btm s ALA 62 CO 0.14 0.21 1.42 1.04 0.00 0.00 0.00 175.76 178.57 2btm n GLN 63 N -1.28 0.02 0.00 0.00 6.02 -1.26 -0.95 117.38 119.93 2btm n GLN 63 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.92 2btm n GLN 63 Cb 0.58 -1.51 0.00 0.00 1.02 0.00 0.00 30.24 30.33 2btm n GLN 63 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 2btm n THR 64 N -1.54 0.00 -3.65 5.09 5.66 -1.20 -4.33 114.28 114.32 2btm n THR 64 Ca 0.05 0.00 -0.02 0.00 -3.05 0.00 0.00 64.05 61.03 2btm n THR 64 Cb 0.34 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 69.11 2btm n THR 64 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2btm s MET 65 N -2.00 0.72 0.63 1.09 0.23 -1.26 -4.89 119.30 113.82 2btm s MET 65 Ca 0.00 -0.38 0.01 0.00 -1.03 0.00 0.00 55.69 54.29 2btm s MET 65 Cb 0.00 0.26 0.08 0.00 -1.53 0.00 0.00 34.83 33.64 2btm s MET 65 CO 0.00 -0.33 0.87 -1.58 -2.03 0.00 0.00 175.02 171.96 2btm s HIS 66 N -2.81 2.23 -0.13 3.16 2.46 0.31 -4.95 115.29 115.55 2btm s HIS 66 Ca 0.12 -0.16 0.21 0.00 0.47 0.00 0.00 55.06 55.70 2btm s HIS 66 Cb 0.01 -2.83 -0.19 0.00 -0.13 0.00 0.00 32.58 29.44 2btm s HIS 66 CO -0.02 -1.26 0.68 1.97 -2.47 0.00 0.00 174.74 173.64 2btm n PHE 67 N -2.56 0.47 -2.66 3.88 1.16 -1.26 -4.24 117.46 112.25 2btm n PHE 67 Ca 0.11 0.14 -0.32 0.00 -1.87 0.00 0.00 57.45 55.52 2btm n PHE 67 Cb 0.60 -0.78 -0.04 0.00 -1.61 0.00 0.00 39.48 37.65 2btm n PHE 67 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2btm s ALA 68 N -3.29 3.18 0.18 1.98 0.00 -1.26 -4.78 121.76 117.77 2btm s ALA 68 Ca -0.05 0.07 0.14 0.00 0.00 0.00 0.00 51.96 52.13 2btm s ALA 68 Cb 0.11 -2.96 0.45 0.00 0.00 0.00 0.00 23.12 20.72 2btm s ALA 68 CO 0.85 -0.07 1.63 -0.44 0.00 0.00 0.00 175.76 177.73 2btm h ASP 69 N 1.27 0.00 -5.60 0.00 3.32 -1.97 -3.38 116.42 110.05 2btm h ASP 69 Ca -0.47 0.00 0.26 0.00 0.02 0.00 0.00 57.03 56.84 2btm h ASP 69 Cb 1.18 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.64 2btm h ASP 69 CO 0.63 0.52 0.70 0.00 -1.72 0.00 0.00 179.24 179.36 2btm s GLN 70 N -3.50 0.75 0.00 3.56 -2.07 -1.26 -4.64 119.66 112.50 2btm s GLN 70 Ca -0.00 -0.43 0.00 0.00 -1.82 0.00 0.00 55.36 53.11 2btm s GLN 70 Cb 0.11 0.25 0.00 0.00 -1.09 0.00 0.00 33.01 32.28 2btm s GLN 70 CO 0.73 -0.34 0.00 0.41 -1.32 0.00 0.00 175.29 174.77 2btm n GLY 71 N -0.53 0.87 2.74 2.60 0.00 -1.26 -4.97 105.19 104.64 2btm n GLY 71 Ca -0.06 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.63 2btm n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2btm n ALA 72 N -0.96 5.51 -3.43 4.61 0.00 -1.26 -4.69 120.51 120.30 2btm n ALA 72 Ca 0.00 -3.85 -0.26 0.00 0.00 0.00 0.00 53.44 49.32 2btm n ALA 72 Cb 0.00 -3.54 -0.09 0.00 0.00 0.00 0.00 19.45 15.82 2btm n ALA 72 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2btm n TYR 73 N 6.10 1.14 -1.59 0.00 4.01 -1.26 -5.09 117.16 120.47 2btm n TYR 73 Ca 0.52 -3.78 -0.51 0.00 -0.16 0.00 0.00 57.90 53.97 2btm n TYR 73 Cb 0.39 -0.30 -0.06 0.00 -0.31 0.00 0.00 39.34 39.06 2btm n TYR 73 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 2btm n THR 74 N 1.73 0.14 0.00 -0.72 -1.04 -1.26 -1.11 114.28 112.02 2btm n THR 74 Ca 0.25 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.23 2btm n THR 74 Cb 0.46 -0.86 0.00 0.00 -1.82 0.00 0.00 70.33 68.11 2btm n THR 74 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2btm n GLY 75 N 2.48 2.43 3.88 3.41 0.00 -1.26 -5.04 105.19 111.09 2btm n GLY 75 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 2btm n GLY 75 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2btm s GLU 76 N -0.36 3.79 -0.11 1.61 0.41 -0.27 -5.09 118.70 118.69 2btm s GLU 76 Ca 0.00 0.38 0.02 0.00 -0.41 0.00 0.00 54.97 54.96 2btm s GLU 76 Cb 0.00 -2.49 -0.01 0.00 -1.78 0.00 0.00 34.13 29.85 2btm s GLU 76 CO 0.00 0.10 -0.19 0.08 -0.49 0.00 0.00 175.26 174.77 2btm s VAL 77 N -2.16 2.55 0.33 2.63 1.01 -1.26 -4.98 120.40 118.52 2btm s VAL 77 Ca 0.50 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.61 2btm s VAL 77 Cb -0.10 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 2btm s VAL 77 CO 0.27 0.55 0.57 -0.94 0.00 0.00 0.00 175.10 175.54 2btm s SER 78 N 0.26 6.35 0.49 3.32 1.04 -1.26 -0.53 113.70 123.38 2btm s SER 78 Ca -0.13 0.60 0.14 0.00 0.48 0.00 0.00 55.95 57.04 2btm s SER 78 Cb -0.16 -2.09 1.17 0.00 0.10 0.00 0.00 66.02 65.03 2btm s SER 78 CO 0.07 -0.28 2.11 1.55 0.98 0.00 0.00 173.24 177.68 2btm h PRO 79 N 1.10 0.09 -0.23 4.02 0.13 -1.74 -1.93 132.00 133.44 2btm h PRO 79 Ca -0.49 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.63 2btm h PRO 79 Cb 1.20 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2btm h PRO 79 CO 0.63 0.08 0.11 0.28 -0.23 0.00 0.00 178.00 178.87 2btm h VAL 80 N 0.09 1.15 -0.93 1.56 2.07 -1.87 0.20 116.25 118.52 2btm h VAL 80 Ca 0.02 -0.44 0.01 0.00 0.82 0.00 0.00 66.70 67.11 2btm h VAL 80 Cb 0.03 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 30.77 2btm h VAL 80 CO -0.00 0.15 0.62 0.24 0.02 0.00 0.00 177.57 178.59 2btm h MET 81 N 0.24 1.23 -0.08 1.57 2.86 -1.66 -0.80 114.93 118.28 2btm h MET 81 Ca 0.08 -0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2btm h MET 81 Cb 0.14 -0.28 -0.00 0.00 0.06 0.00 0.00 31.60 31.52 2btm h MET 81 CO -0.01 0.82 -0.03 -0.07 1.06 0.00 0.00 176.91 178.68 2btm h LEU 82 N 1.26 0.16 -0.09 1.22 3.38 -1.12 -1.73 115.31 118.39 2btm h LEU 82 Ca 0.34 -0.39 0.02 0.00 0.09 0.00 0.00 57.88 57.94 2btm h LEU 82 Cb -0.14 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2btm h LEU 82 CO -0.07 0.51 -0.03 0.50 0.09 0.00 0.00 178.44 179.45 2btm h LYS 83 N -0.19 -0.01 -0.94 1.13 3.11 -0.83 -1.52 116.57 117.31 2btm h LYS 83 Ca 0.02 0.00 0.17 0.00 -2.81 0.00 0.00 60.65 58.03 2btm h LYS 83 Cb 0.45 0.00 -0.10 0.00 -1.00 0.00 0.00 32.23 31.58 2btm h LYS 83 CO 0.01 -0.00 0.54 0.22 -2.81 0.00 0.00 179.45 177.40 2btm h ASP 84 N -0.01 0.67 0.83 4.20 3.58 -1.11 0.16 116.42 124.74 2btm h ASP 84 Ca 0.04 0.10 -0.02 0.00 0.42 0.00 0.00 57.03 57.57 2btm h ASP 84 Cb 0.07 -0.02 -0.00 0.00 1.72 0.00 0.00 39.33 41.10 2btm h ASP 84 CO -0.09 0.25 -0.11 -0.07 -2.88 0.00 0.00 179.24 176.33 2btm h LEU 85 N 0.70 0.00 0.00 2.28 3.38 -0.49 -3.46 115.31 117.72 2btm h LEU 85 Ca 0.53 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.50 2btm h LEU 85 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2btm h LEU 85 CO -0.38 0.11 0.00 0.61 0.09 0.00 0.00 178.44 178.87 2btm n GLY 86 N -0.09 1.18 3.73 0.83 0.00 0.57 -4.89 105.19 106.52 2btm n GLY 86 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2btm n GLY 86 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2btm s VAL 87 N -2.00 4.08 -0.22 1.61 1.01 -0.65 -4.88 120.40 119.34 2btm s VAL 87 Ca 0.00 1.67 0.05 0.00 0.00 0.00 0.00 61.98 63.71 2btm s VAL 87 Cb 0.00 -4.07 -0.17 0.00 0.00 0.00 0.00 36.38 32.14 2btm s VAL 87 CO 0.00 0.23 -0.14 0.35 0.00 0.00 0.00 175.10 175.54 2btm n THR 88 N 2.93 1.34 -4.26 3.92 -2.24 -0.78 -4.39 114.28 110.80 2btm n THR 88 Ca 0.04 -0.59 -0.26 0.00 -2.27 0.00 0.00 64.05 60.98 2btm n THR 88 Cb 0.47 -1.14 -0.08 0.00 -2.10 0.00 0.00 70.33 67.48 2btm n THR 88 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2btm s TYR 89 N -2.47 2.72 -0.13 4.78 1.51 -1.16 -0.70 117.35 121.90 2btm s TYR 89 Ca -0.27 -0.19 -0.07 0.00 -1.01 0.00 0.00 57.07 55.53 2btm s TYR 89 Cb 0.08 -1.29 0.05 0.00 -0.11 0.00 0.00 41.96 40.69 2btm s TYR 89 CO 0.60 0.55 0.30 0.54 -1.11 0.00 0.00 175.55 176.43 2btm s VAL 90 N -1.89 -0.03 0.11 0.71 0.11 -0.75 -0.10 120.40 118.55 2btm s VAL 90 Ca 0.28 0.12 -0.26 0.00 -2.93 0.00 0.00 61.98 59.18 2btm s VAL 90 Cb -0.08 -0.46 -0.07 0.00 -1.53 0.00 0.00 36.38 34.25 2btm s VAL 90 CO 0.18 0.05 0.81 -0.63 -3.33 0.00 0.00 175.10 172.17 2btm s ILE 91 N 1.23 4.52 -0.01 7.04 1.01 -0.12 -0.60 121.20 134.26 2btm s ILE 91 Ca -0.09 1.75 0.02 0.00 0.00 0.00 0.00 60.65 62.33 2btm s ILE 91 Cb -0.09 -4.17 -0.00 0.00 0.01 0.00 0.00 42.46 38.21 2btm s ILE 91 CO -0.09 0.43 -0.07 -0.76 0.00 0.00 0.00 174.94 174.44 2btm s LEU 92 N -0.53 1.94 -0.99 2.97 1.43 0.02 -3.23 118.68 120.28 2btm s LEU 92 Ca 0.39 -0.14 0.00 0.00 -1.03 0.00 0.00 54.13 53.35 2btm s LEU 92 Cb -0.22 -0.41 0.00 0.00 0.03 0.00 0.00 46.19 45.59 2btm s LEU 92 CO 0.26 0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.52 2btm n GLY 93 N 3.03 0.19 3.75 -3.19 0.00 -1.26 -1.17 105.19 106.53 2btm n GLY 93 Ca -0.15 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.02 2btm n GLY 93 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2btm n HIS 94 N -3.73 2.68 -0.06 1.61 -0.00 -1.26 -4.42 115.22 110.04 2btm n HIS 94 Ca -0.13 0.48 0.25 0.00 0.46 0.00 0.00 57.72 58.78 2btm n HIS 94 Cb 0.55 -2.48 0.72 0.00 -0.12 0.00 0.00 29.99 28.66 2btm n HIS 94 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 2btm h SER 95 N 2.66 0.00 -0.33 0.26 4.64 -1.93 0.17 113.55 119.03 2btm h SER 95 Ca -0.49 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.73 2btm h SER 95 Cb 1.26 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.34 2btm h SER 95 CO 0.63 0.00 -0.14 -0.33 -0.87 0.00 0.00 176.83 176.11 2btm h GLU 96 N 0.00 0.77 -0.13 4.77 5.08 -1.99 -1.14 114.58 121.94 2btm h GLU 96 Ca 0.32 -0.27 -0.12 0.00 -1.00 0.00 0.00 59.36 58.29 2btm h GLU 96 Cb 1.43 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.63 2btm h GLU 96 CO -0.00 0.88 -0.39 0.00 -1.00 0.00 0.00 179.01 178.49 2btm h ARG 97 N 0.69 0.49 -0.87 2.33 2.47 -1.03 -1.80 114.38 116.67 2btm h ARG 97 Ca 0.11 -0.36 -0.00 0.00 -1.26 0.00 0.00 59.98 58.47 2btm h ARG 97 Cb 0.63 0.06 -0.04 0.00 -1.65 0.00 0.00 29.97 28.97 2btm h ARG 97 CO 0.04 0.98 0.54 0.00 0.56 0.00 0.00 179.97 182.09 2btm h ARG 98 N 0.09 1.18 0.00 0.04 3.08 -1.20 0.18 114.38 117.75 2btm h ARG 98 Ca -0.01 -0.10 -0.17 0.00 0.07 0.00 0.00 59.98 59.76 2btm h ARG 98 Cb 1.01 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.78 2btm h ARG 98 CO 0.08 0.82 -1.29 -0.56 -1.07 0.00 0.00 179.97 177.95 2btm h GLN 99 N 1.20 0.00 0.00 0.04 -0.00 -1.27 -3.36 115.11 111.72 2btm h GLN 99 Ca 0.31 0.00 -0.16 0.00 -0.00 0.00 0.00 58.65 58.81 2btm h GLN 99 Cb -0.06 0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 27.39 2btm h GLN 99 CO -0.06 0.37 -1.78 -1.33 -0.00 0.00 0.00 178.83 176.03 2btm n MET 100 N -2.97 1.50 -0.66 0.06 2.81 -0.68 -4.76 117.12 112.42 2btm n MET 100 Ca -0.08 -0.04 0.06 0.00 -1.81 0.00 0.00 57.70 55.83 2btm n MET 100 Cb 0.85 -1.32 0.19 0.00 -0.71 0.00 0.00 33.22 32.23 2btm n MET 100 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 2btm n PHE 101 N -2.31 0.00 -2.27 2.03 3.72 0.63 -4.98 117.46 114.27 2btm n PHE 101 Ca -0.15 -1.40 -0.18 0.00 -0.05 0.00 0.00 57.45 55.67 2btm n PHE 101 Cb 0.74 -0.24 -0.01 0.00 -0.94 0.00 0.00 39.48 39.02 2btm n PHE 101 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2btm n ALA 102 N -0.99 -0.50 -2.65 4.37 0.00 -1.19 -4.94 120.51 114.61 2btm n ALA 102 Ca 0.18 0.15 -0.42 0.00 0.00 0.00 0.00 53.44 53.35 2btm n ALA 102 Cb 0.73 -1.92 -0.03 0.00 0.00 0.00 0.00 19.45 18.23 2btm n ALA 102 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2btm s GLU 103 N -4.77 4.19 0.47 0.00 2.56 -1.10 -5.00 118.70 115.05 2btm s GLU 103 Ca 0.00 1.11 0.06 0.00 0.00 0.00 0.00 54.97 56.13 2btm s GLU 103 Cb 0.00 -3.66 -0.02 0.00 2.00 0.00 0.00 34.13 32.45 2btm s GLU 103 CO 0.00 -0.61 0.20 0.95 -0.56 0.00 0.00 175.26 175.24 2btm s THR 104 N 3.08 1.90 0.29 -1.70 -4.23 -1.26 -4.13 115.64 109.58 2btm s THR 104 Ca 0.40 -1.70 -0.02 0.00 -1.18 0.00 0.00 61.69 59.18 2btm s THR 104 Cb -0.15 -2.60 0.23 0.00 1.34 0.00 0.00 72.50 71.32 2btm s THR 104 CO 0.08 0.00 1.92 0.44 -0.54 0.00 0.00 174.62 176.52 2btm h ASP 105 N 1.23 0.93 -0.25 3.99 3.32 -1.97 -0.50 116.42 123.17 2btm h ASP 105 Ca -0.41 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.57 2btm h ASP 105 Cb 1.28 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.58 2btm h ASP 105 CO 0.68 0.73 0.16 -0.08 -1.72 0.00 0.00 179.24 179.00 2btm h GLU 106 N 1.06 0.33 -0.23 3.56 4.57 -1.95 -0.62 114.58 121.30 2btm h GLU 106 Ca 0.27 -0.02 -0.14 0.00 -1.18 0.00 0.00 59.36 58.29 2btm h GLU 106 Cb -0.01 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.49 2btm h GLU 106 CO -0.05 0.24 -0.43 1.79 -1.18 0.00 0.00 179.01 179.38 2btm h THR 107 N 0.33 1.30 -0.25 0.32 1.35 -1.85 -2.02 112.91 112.09 2btm h THR 107 Ca 0.09 -1.61 -0.00 0.00 -0.55 0.00 0.00 66.41 64.34 2btm h THR 107 Cb -0.02 1.59 -0.01 0.00 -1.73 0.00 0.00 68.15 67.98 2btm h THR 107 CO -0.02 0.51 0.15 0.58 -0.25 0.00 0.00 175.52 176.49 2btm h VAL 108 N 0.46 1.10 -0.47 6.82 2.07 -0.87 -0.96 116.25 124.40 2btm h VAL 108 Ca 0.03 -0.26 0.04 0.00 0.82 0.00 0.00 66.70 67.34 2btm h VAL 108 Cb 0.94 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 2btm h VAL 108 CO 0.08 0.10 0.22 -1.13 0.02 0.00 0.00 177.57 176.87 2btm h ASN 109 N 0.31 0.31 -0.76 0.57 -0.00 -0.98 0.36 115.58 115.39 2btm h ASN 109 Ca 0.09 0.03 0.06 0.00 -0.00 0.00 0.00 56.30 56.49 2btm h ASN 109 Cb 0.03 -0.02 -0.05 0.00 -0.00 0.00 0.00 38.32 38.28 2btm h ASN 109 CO -0.02 0.22 0.50 0.11 -0.00 0.00 0.00 177.43 178.24 2btm h LYS 110 N 0.44 0.79 0.03 6.67 1.57 -0.99 -1.01 116.57 124.08 2btm h LYS 110 Ca 0.21 -0.05 -0.26 0.00 -1.87 0.00 0.00 60.65 58.68 2btm h LYS 110 Cb 0.14 -0.18 0.02 0.00 0.08 0.00 0.00 32.23 32.28 2btm h LYS 110 CO -0.16 0.53 -1.06 0.87 -0.57 0.00 0.00 179.45 179.06 2btm h LYS 111 N 0.82 0.58 -0.73 3.15 1.57 0.27 -1.22 116.57 121.02 2btm h LYS 111 Ca 0.33 -0.66 0.04 0.00 -1.87 0.00 0.00 60.65 58.48 2btm h LYS 111 Cb 0.24 0.20 -0.05 0.00 0.08 0.00 0.00 32.23 32.70 2btm h LYS 111 CO -0.11 1.26 0.45 0.28 -0.57 0.00 0.00 179.45 180.76 2btm h VAL 112 N 0.31 1.08 -0.38 0.50 2.07 0.31 0.47 116.25 120.61 2btm h VAL 112 Ca -0.13 -0.30 -0.14 0.00 0.82 0.00 0.00 66.70 66.96 2btm h VAL 112 Cb 1.71 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 2btm h VAL 112 CO 0.20 0.16 -0.29 -0.07 0.02 0.00 0.00 177.57 177.58 2btm h LEU 113 N 0.87 0.91 -0.62 2.57 3.38 -1.20 -2.38 115.31 118.84 2btm h LEU 113 Ca 0.30 -0.44 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 2btm h LEU 113 Cb 0.05 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 2btm h LEU 113 CO -0.12 1.16 0.27 0.00 0.09 0.00 0.00 178.44 179.84 2btm h ALA 114 N 0.78 0.81 0.06 1.53 0.00 -0.45 -1.25 119.26 120.74 2btm h ALA 114 Ca 0.07 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.84 2btm h ALA 114 Cb 0.87 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2btm h ALA 114 CO 0.08 0.40 -0.13 0.00 0.00 0.00 0.00 179.25 179.60 2btm h ALA 115 N 1.11 -0.21 -0.77 0.00 0.00 0.03 -0.61 119.26 118.81 2btm h ALA 115 Ca 0.21 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2btm h ALA 115 Cb 0.17 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 2btm h ALA 115 CO -0.02 -0.65 0.41 0.74 0.00 0.00 0.00 179.25 179.73 2btm h PHE 116 N -0.26 1.08 0.00 0.00 0.04 -1.25 0.19 116.94 116.73 2btm h PHE 116 Ca 0.03 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.76 2btm h PHE 116 Cb 0.28 -0.34 0.00 0.00 2.20 0.00 0.00 35.95 38.09 2btm h PHE 116 CO -0.16 0.77 0.00 0.25 -0.60 0.00 0.00 178.31 178.57 2btm n THR 117 N -4.42 0.79 0.43 -1.55 -2.24 -0.49 -2.84 114.28 103.96 2btm n THR 117 Ca 0.07 0.14 0.07 0.00 -2.27 0.00 0.00 64.05 62.07 2btm n THR 117 Cb 0.11 -1.03 0.08 0.00 -2.10 0.00 0.00 70.33 67.39 2btm n THR 117 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2btm n ARG 118 N -2.12 1.30 -1.64 -0.78 3.00 -0.26 -5.00 116.66 111.16 2btm n ARG 118 Ca 0.03 -1.49 0.00 0.00 -0.01 0.00 0.00 57.85 56.37 2btm n ARG 118 Cb 0.26 -1.28 0.00 0.00 0.00 0.00 0.00 32.46 31.44 2btm n ARG 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2btm n GLY 119 N 0.78 0.61 3.41 -0.13 0.00 -0.41 -4.84 105.19 104.61 2btm n GLY 119 Ca 0.09 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 45.03 2btm n GLY 119 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2btm s LEU 120 N 0.00 2.44 -0.38 0.99 1.43 -0.08 -4.93 118.68 118.15 2btm s LEU 120 Ca 0.00 -0.39 -0.19 0.00 -1.03 0.00 0.00 54.13 52.52 2btm s LEU 120 Cb 0.00 -1.45 0.01 0.00 0.03 0.00 0.00 46.19 44.77 2btm s LEU 120 CO 0.00 0.30 0.56 -0.63 0.23 0.00 0.00 176.35 176.81 2btm s ILE 121 N -0.77 4.96 0.23 -0.59 1.01 0.12 -3.90 121.20 122.25 2btm s ILE 121 Ca 0.12 0.27 -0.27 0.00 0.00 0.00 0.00 60.65 60.78 2btm s ILE 121 Cb -0.10 -4.05 -0.09 0.00 0.01 0.00 0.00 42.46 38.23 2btm s ILE 121 CO 0.02 -0.34 0.86 -2.16 0.00 0.00 0.00 174.94 173.32 2btm s PRO 122 N 2.53 4.65 -0.47 2.79 0.04 -1.26 -1.82 135.00 141.46 2btm s PRO 122 Ca 0.20 1.29 -0.04 0.00 0.04 0.00 0.00 61.00 62.49 2btm s PRO 122 Cb -0.15 -3.15 0.12 0.00 0.04 0.00 0.00 34.50 31.36 2btm s PRO 122 CO 0.15 0.48 0.28 0.42 0.04 0.00 0.00 177.00 178.38 2btm s ILE 123 N -1.28 3.53 -0.30 0.56 1.01 0.23 -2.12 121.20 122.83 2btm s ILE 123 Ca 0.41 -2.24 -0.25 0.00 0.00 0.00 0.00 60.65 58.57 2btm s ILE 123 Cb -0.23 -3.38 0.00 0.00 0.01 0.00 0.00 42.46 38.87 2btm s ILE 123 CO 0.27 -0.75 0.87 -0.63 0.00 0.00 0.00 174.94 174.70 2btm s ILE 124 N 0.88 4.72 0.04 2.92 1.01 0.11 -0.80 121.20 130.08 2btm s ILE 124 Ca 0.10 1.37 -0.17 0.00 0.00 0.00 0.00 60.65 61.95 2btm s ILE 124 Cb -0.23 -4.22 -0.06 0.00 0.01 0.00 0.00 42.46 37.97 2btm s ILE 124 CO -0.04 -0.29 0.49 0.00 0.00 0.00 0.00 174.94 175.10 2btm n GLY 127 N -0.04 2.37 3.80 0.00 0.00 -1.26 -0.09 105.19 109.97 2btm n GLY 127 Ca -0.13 -0.72 -0.26 0.00 0.00 0.00 0.00 46.02 44.91 2btm n GLY 127 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2btm s GLU 128 N -2.00 2.91 0.78 1.61 1.03 -1.26 -4.77 118.70 116.99 2btm s GLU 128 Ca 0.00 -0.90 -0.11 0.00 0.03 0.00 0.00 54.97 53.99 2btm s GLU 128 Cb 0.00 -2.63 0.06 0.00 -0.80 0.00 0.00 34.13 30.76 2btm s GLU 128 CO 0.00 0.47 1.15 -1.54 -1.33 0.00 0.00 175.26 174.01 2btm s SER 129 N -3.22 4.74 0.23 0.83 1.04 -1.26 -1.73 113.70 114.33 2btm s SER 129 Ca 0.31 0.83 -0.08 0.00 0.48 0.00 0.00 55.95 57.50 2btm s SER 129 Cb -0.10 -1.40 0.24 0.00 0.10 0.00 0.00 66.02 64.86 2btm s SER 129 CO 0.24 -1.76 1.88 0.25 0.98 0.00 0.00 173.24 174.83 2btm h LEU 130 N -0.93 0.92 0.65 2.42 5.85 -1.97 -1.15 115.31 121.09 2btm h LEU 130 Ca -0.46 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.23 2btm h LEU 130 Cb 1.31 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 42.13 2btm h LEU 130 CO 0.65 0.64 -0.37 -0.33 -0.34 0.00 0.00 178.44 178.69 2btm h GLU 131 N 1.08 -0.92 -0.56 1.25 3.07 -1.98 0.19 114.58 116.71 2btm h GLU 131 Ca 0.33 0.06 0.12 0.00 -0.50 0.00 0.00 59.36 59.37 2btm h GLU 131 Cb -0.02 0.21 -0.03 0.00 -0.84 0.00 0.00 28.75 28.07 2btm h GLU 131 CO -0.11 -0.61 0.38 0.93 -1.40 0.00 0.00 179.01 178.20 2btm h GLU 132 N -0.95 0.25 -0.03 2.33 5.08 -1.88 -0.71 114.58 118.67 2btm h GLU 132 Ca -0.08 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 2btm h GLU 132 Cb 0.76 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 2btm h GLU 132 CO 0.10 0.16 -0.04 -0.09 -1.00 0.00 0.00 179.01 178.15 2btm h ARG 133 N 0.25 0.08 0.00 2.33 9.65 -0.78 0.35 114.38 126.26 2btm h ARG 133 Ca 0.26 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 59.10 2btm h ARG 133 Cb 0.69 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.28 2btm h ARG 133 CO -0.05 0.56 0.00 0.93 2.80 0.00 0.00 179.97 184.20 2btm h GLU 134 N -0.40 0.00 -0.55 0.20 4.39 0.04 -1.86 114.58 116.40 2btm h GLU 134 Ca 0.00 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.59 2btm h GLU 134 Cb 0.55 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.13 2btm h GLU 134 CO 0.01 0.00 0.12 0.00 -1.16 0.00 0.00 179.01 177.98 2btm n ALA 135 N -1.98 4.04 -4.09 3.43 0.00 -0.37 -4.96 120.51 116.57 2btm n ALA 135 Ca -0.01 -2.34 -0.33 0.00 0.00 0.00 0.00 53.44 50.76 2btm n ALA 135 Cb 0.16 -1.04 -0.01 0.00 0.00 0.00 0.00 19.45 18.55 2btm n ALA 135 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2btm n GLY 136 N -0.19 -0.43 0.33 0.00 0.00 -0.70 -4.86 105.19 99.35 2btm n GLY 136 Ca 0.33 0.15 0.03 0.00 0.00 0.00 0.00 46.02 46.53 2btm n GLY 136 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2btm n GLN 137 N -4.47 2.55 0.02 1.61 3.00 0.10 -4.79 117.38 115.38 2btm n GLN 137 Ca 0.01 -1.68 -0.14 0.00 -0.01 0.00 0.00 57.00 55.19 2btm n GLN 137 Cb 0.53 -1.14 -0.07 0.00 0.00 0.00 0.00 30.24 29.55 2btm n GLN 137 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.06 178.21 2btm h THR 138 N 1.10 0.09 -0.77 5.09 2.02 -1.86 0.33 112.91 118.91 2btm h THR 138 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 2btm h THR 138 Cb 0.58 0.09 -0.04 0.00 -1.74 0.00 0.00 68.15 67.05 2btm h THR 138 CO 0.00 0.00 0.47 0.78 0.37 0.00 0.00 175.52 177.14 2btm h ASN 139 N -0.55 0.92 0.36 4.18 -0.26 -1.95 -1.37 115.58 116.90 2btm h ASN 139 Ca 0.05 -0.05 -0.02 0.00 -0.56 0.00 0.00 56.30 55.73 2btm h ASN 139 Cb 0.66 -0.23 0.00 0.00 -1.06 0.00 0.00 38.32 37.69 2btm h ASN 139 CO -0.39 0.70 -0.17 0.00 -1.06 0.00 0.00 177.43 176.51 2btm h ALA 140 N 1.46 -0.48 -0.23 -0.83 0.00 -1.74 -1.27 119.26 116.16 2btm h ALA 140 Ca 0.28 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 55.06 2btm h ALA 140 Cb -0.05 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 2btm h ALA 140 CO -0.05 -0.61 -0.13 0.28 0.00 0.00 0.00 179.25 178.73 2btm h VAL 141 N -0.80 0.61 -0.67 0.00 2.07 -0.25 -0.50 116.25 116.70 2btm h VAL 141 Ca -0.05 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.42 2btm h VAL 141 Cb 0.52 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 2btm h VAL 141 CO 0.08 0.00 0.23 0.58 0.02 0.00 0.00 177.57 178.48 2btm h VAL 142 N -0.11 1.24 -0.38 2.57 2.07 -1.30 -2.08 116.25 118.25 2btm h VAL 142 Ca 0.13 -0.80 -0.09 0.00 0.82 0.00 0.00 66.70 66.76 2btm h VAL 142 Cb 0.30 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 2btm h VAL 142 CO -0.30 0.32 -0.12 0.00 0.02 0.00 0.00 177.57 177.48 2btm h ALA 143 N 1.27 1.07 -0.32 1.67 0.00 -0.70 -1.80 119.26 120.44 2btm h ALA 143 Ca 0.22 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 2btm h ALA 143 Cb 0.24 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2btm h ALA 143 CO -0.01 0.57 0.00 1.03 0.00 0.00 0.00 179.25 180.84 2btm h SER 144 N 0.62 0.55 -0.61 0.00 0.87 -0.66 -1.41 113.55 112.91 2btm h SER 144 Ca 0.11 -0.30 -0.08 0.00 -1.23 0.00 0.00 61.79 60.28 2btm h SER 144 Cb 0.57 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.36 2btm h SER 144 CO 0.04 0.72 0.06 1.56 -0.53 0.00 0.00 176.83 178.67 2btm h GLN 145 N 0.37 1.04 -0.47 2.24 4.20 -1.26 -2.04 115.11 119.19 2btm h GLN 145 Ca 0.09 -0.30 -0.12 0.00 0.06 0.00 0.00 58.65 58.38 2btm h GLN 145 Cb 0.43 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 2btm h GLN 145 CO 0.02 0.99 -0.19 0.28 -0.67 0.00 0.00 178.83 179.25 2btm h VAL 146 N 0.94 1.27 0.32 -0.54 2.07 -1.27 0.02 116.25 119.06 2btm h VAL 146 Ca 0.18 -1.34 -0.02 0.00 0.82 0.00 0.00 66.70 66.34 2btm h VAL 146 Cb 0.48 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.37 2btm h VAL 146 CO 0.02 0.46 -0.15 -0.33 0.02 0.00 0.00 177.57 177.59 2btm h GLU 147 N 0.81 -0.41 -0.86 1.57 3.07 -1.13 -1.80 114.58 115.82 2btm h GLU 147 Ca 0.11 0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 59.00 2btm h GLU 147 Cb 0.75 0.09 -0.04 0.00 -0.84 0.00 0.00 28.75 28.71 2btm h GLU 147 CO 0.06 -0.14 0.53 0.87 -1.40 0.00 0.00 179.01 178.92 2btm h LYS 148 N -0.65 1.17 -0.76 2.33 1.57 -1.37 0.61 116.57 119.46 2btm h LYS 148 Ca -0.04 -0.10 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 2btm h LYS 148 Cb 0.46 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 2btm h LYS 148 CO 0.07 0.81 0.27 0.00 -0.57 0.00 0.00 179.45 180.03 2btm h ALA 149 N 1.29 1.03 0.00 3.86 0.00 -0.95 -3.11 119.26 121.38 2btm h ALA 149 Ca 0.31 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2btm h ALA 149 Cb -0.06 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.43 2btm h ALA 149 CO -0.06 0.66 -0.69 1.28 0.00 0.00 0.00 179.25 180.45 2btm n LEU 150 N -4.26 0.68 -4.70 0.00 4.77 -0.68 -4.37 117.00 108.44 2btm n LEU 150 Ca 0.07 0.19 -0.57 0.00 -0.03 0.00 0.00 56.01 55.67 2btm n LEU 150 Cb 0.21 -0.17 -0.07 0.00 -2.33 0.00 0.00 43.42 41.06 2btm n LEU 150 CO 0.41 -0.04 1.28 0.00 -1.33 0.00 0.00 177.39 177.71 2btm n ALA 151 N -1.82 -0.27 0.00 -1.18 0.00 0.18 -1.43 120.51 115.99 2btm n ALA 151 Ca 0.03 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2btm n ALA 151 Cb 0.44 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.67 2btm n ALA 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2btm n GLY 152 N 3.98 0.97 3.93 0.00 0.00 -1.26 -4.98 105.19 107.83 2btm n GLY 152 Ca 0.25 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.02 2btm n GLY 152 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2btm s LEU 153 N 0.00 3.40 0.22 0.99 1.43 -0.51 -5.09 118.68 119.12 2btm s LEU 153 Ca 0.00 0.59 0.05 0.00 -1.03 0.00 0.00 54.13 53.74 2btm s LEU 153 Cb 0.00 -3.45 -0.03 0.00 0.03 0.00 0.00 46.19 42.74 2btm s LEU 153 CO 0.00 -0.90 0.32 0.42 0.23 0.00 0.00 176.35 176.41 2btm s THR 154 N -2.83 5.14 0.45 5.49 -4.23 -1.26 -4.97 115.64 113.43 2btm s THR 154 Ca 0.51 -0.99 0.14 0.00 -1.18 0.00 0.00 61.69 60.17 2btm s THR 154 Cb -0.10 -3.76 0.32 0.00 1.34 0.00 0.00 72.50 70.30 2btm s THR 154 CO 0.43 -0.28 2.00 -0.65 -0.54 0.00 0.00 174.62 175.57 2btm h PRO 155 N 1.42 0.35 -0.68 3.99 0.11 -1.96 -1.57 132.00 133.66 2btm h PRO 155 Ca -0.51 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.55 2btm h PRO 155 Cb 1.22 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 2btm h PRO 155 CO 0.62 0.23 0.31 0.93 -0.21 0.00 0.00 178.00 179.88 2btm h GLU 156 N 0.36 0.99 0.00 1.05 5.08 -1.94 -2.60 114.58 117.51 2btm h GLU 156 Ca 0.24 -0.15 -0.16 0.00 -1.00 0.00 0.00 59.36 58.29 2btm h GLU 156 Cb 0.49 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2btm h GLU 156 CO -0.06 0.79 -0.80 -0.56 -1.00 0.00 0.00 179.01 177.38 2btm h GLN 157 N 0.95 0.00 -0.13 2.33 3.07 -1.81 -3.15 115.11 116.37 2btm h GLN 157 Ca 0.23 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.95 2btm h GLN 157 Cb 0.14 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.69 2btm h GLN 157 CO -0.03 0.73 -0.04 0.28 0.09 0.00 0.00 178.83 179.87 2btm h VAL 158 N 0.00 1.11 -0.25 1.86 2.07 -1.10 -0.78 116.25 119.16 2btm h VAL 158 Ca -0.02 -0.45 -0.03 0.00 0.82 0.00 0.00 66.70 67.02 2btm h VAL 158 Cb 1.59 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.41 2btm h VAL 158 CO 0.10 0.14 0.04 0.11 0.02 0.00 0.00 177.57 177.98 2btm h LYS 159 N 0.18 0.35 -0.00 1.57 1.57 -1.42 -2.22 116.57 116.59 2btm h LYS 159 Ca 0.04 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2btm h LYS 159 Cb 0.19 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.44 2btm h LYS 159 CO 0.01 0.35 -0.38 1.04 -0.57 0.00 0.00 179.45 179.90 2btm n GLN 160 N -4.38 0.26 -1.72 3.15 6.02 -0.35 -3.89 117.38 116.48 2btm n GLN 160 Ca 0.01 -0.14 -0.31 0.00 -0.01 0.00 0.00 57.00 56.55 2btm n GLN 160 Cb 0.17 -1.50 0.04 0.00 1.02 0.00 0.00 30.24 29.97 2btm n GLN 160 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2btm s ALA 161 N -2.84 2.82 -0.10 -1.58 0.00 -0.84 -4.79 121.76 114.44 2btm s ALA 161 Ca 0.16 -0.07 0.01 0.00 0.00 0.00 0.00 51.96 52.06 2btm s ALA 161 Cb 0.18 -3.11 0.02 0.00 0.00 0.00 0.00 23.12 20.21 2btm s ALA 161 CO 0.63 -1.06 -0.10 0.08 0.00 0.00 0.00 175.76 175.31 2btm s VAL 162 N -3.15 1.08 -0.12 0.00 1.01 -0.90 -3.66 120.40 114.67 2btm s VAL 162 Ca 0.57 -0.37 -0.05 0.00 0.00 0.00 0.00 61.98 62.13 2btm s VAL 162 Cb -0.13 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 2btm s VAL 162 CO 0.54 0.36 0.05 -0.63 0.00 0.00 0.00 175.10 175.43 2btm s ILE 163 N 1.28 4.73 -0.29 2.22 1.01 -0.54 0.06 121.20 129.67 2btm s ILE 163 Ca -0.03 -0.08 0.03 0.00 0.00 0.00 0.00 60.65 60.57 2btm s ILE 163 Cb -0.14 -3.05 0.08 0.00 0.01 0.00 0.00 42.46 39.36 2btm s ILE 163 CO -0.04 0.57 -0.03 0.00 0.00 0.00 0.00 174.94 175.44 2btm s ALA 164 N -0.57 2.52 -0.16 9.38 0.00 0.96 0.09 121.76 133.98 2btm s ALA 164 Ca 0.11 -1.97 -0.28 0.00 0.00 0.00 0.00 51.96 49.82 2btm s ALA 164 Cb -0.12 -1.70 -0.01 0.00 0.00 0.00 0.00 23.12 21.29 2btm s ALA 164 CO 0.02 -1.40 0.96 -0.47 0.00 0.00 0.00 175.76 174.87 2btm s TYR 165 N 1.11 3.44 -0.28 0.00 5.04 -0.20 -1.84 117.35 124.62 2btm s TYR 165 Ca -0.00 1.45 -0.03 0.00 -2.44 0.00 0.00 57.07 56.05 2btm s TYR 165 Cb -0.19 -3.15 0.09 0.00 0.35 0.00 0.00 41.96 39.06 2btm s TYR 165 CO -0.07 -0.29 0.11 -1.21 -1.34 0.00 0.00 175.55 172.74 2btm s GLU 166 N 2.35 0.42 -0.09 4.97 2.02 0.87 -0.42 118.70 128.82 2btm s GLU 166 Ca 0.44 -0.70 -0.33 0.00 0.02 0.00 0.00 54.97 54.41 2btm s GLU 166 Cb -0.17 -1.59 -0.11 0.00 0.10 0.00 0.00 34.13 32.36 2btm s GLU 166 CO 0.13 -0.95 1.95 -2.30 0.02 0.00 0.00 175.26 174.11 2btm n PRO 167 N 5.08 2.26 -0.28 0.39 -0.02 -1.25 -4.25 135.00 136.93 2btm n PRO 167 Ca -0.05 0.81 0.10 0.00 -2.02 0.00 0.00 63.50 62.34 2btm n PRO 167 Cb 0.43 -2.77 0.25 0.00 -0.02 0.00 0.00 33.50 31.39 2btm n PRO 167 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2btm h ILE 168 N 5.73 0.52 0.00 4.25 2.04 -1.64 0.49 117.51 128.90 2btm h ILE 168 Ca -0.47 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.26 2btm h ILE 168 Cb 1.27 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2btm h ILE 168 CO 0.95 0.07 0.00 4.11 0.00 0.00 0.00 178.15 183.28 2btm h TRP 169 N 0.37 0.00 -0.00 1.37 5.08 -1.87 -2.18 115.95 118.73 2btm h TRP 169 Ca 0.49 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.46 2btm h TRP 169 Cb 0.88 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.04 2btm h TRP 169 CO -0.18 0.00 -0.89 0.00 -1.28 0.00 0.00 178.44 176.09 2btm n ALA 170 N -1.81 4.50 -2.32 0.11 0.00 0.17 -4.68 120.51 116.49 2btm n ALA 170 Ca -0.01 -0.57 -0.43 0.00 0.00 0.00 0.00 53.44 52.44 2btm n ALA 170 Cb 0.09 -0.82 -0.02 0.00 0.00 0.00 0.00 19.45 18.70 2btm n ALA 170 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2btm s ILE 171 N -2.95 4.07 -0.60 0.00 1.01 -0.82 -2.24 121.20 119.67 2btm s ILE 171 Ca 0.09 1.27 0.00 0.00 0.00 0.00 0.00 60.65 62.01 2btm s ILE 171 Cb 0.16 -3.91 0.00 0.00 0.01 0.00 0.00 42.46 38.73 2btm s ILE 171 CO 0.82 -0.21 0.00 0.61 0.00 0.00 0.00 174.94 176.16 2btm n GLY 172 N 3.96 0.54 0.03 6.18 0.00 -1.26 -4.80 105.19 109.85 2btm n GLY 172 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 2btm n GLY 172 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2btm n THR 173 N -1.88 0.17 0.00 2.61 -2.24 -1.24 -4.93 114.28 106.77 2btm n THR 173 Ca -0.06 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 2btm n THR 173 Cb 0.48 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.92 2btm n THR 173 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2btm n GLY 174 N 1.38 2.14 3.25 3.38 0.00 -1.26 -4.96 105.19 109.12 2btm n GLY 174 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 2btm n GLY 174 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2btm s LYS 175 N -0.33 3.05 0.28 1.61 0.00 -1.26 -5.00 119.74 118.10 2btm s LYS 175 Ca 0.00 -2.20 -0.06 0.00 0.00 0.00 0.00 55.97 53.71 2btm s LYS 175 Cb 0.00 -4.16 -0.05 0.00 0.00 0.00 0.00 37.83 33.61 2btm s LYS 175 CO 0.00 -1.25 0.56 -1.54 0.00 0.00 0.00 175.35 173.11 2btm s SER 176 N 2.23 6.47 1.09 0.03 1.04 -1.26 -4.08 113.70 119.21 2btm s SER 176 Ca 0.13 0.75 -0.13 0.00 0.48 0.00 0.00 55.95 57.18 2btm s SER 176 Cb -0.19 -2.16 0.24 0.00 0.10 0.00 0.00 66.02 64.01 2btm s SER 176 CO -0.04 -0.18 1.06 -0.55 0.98 0.00 0.00 173.24 174.51 2btm s SER 177 N -3.04 1.80 0.30 7.02 0.15 -1.26 -5.00 113.70 113.67 2btm s SER 177 Ca 0.45 1.26 -0.15 0.00 0.70 0.00 0.00 55.95 58.20 2btm s SER 177 Cb -0.11 -1.96 -0.09 0.00 -1.71 0.00 0.00 66.02 62.15 2btm s SER 177 CO 0.29 -3.65 0.71 0.42 1.20 0.00 0.00 173.24 172.21 2btm s THR 178 N -2.77 4.70 0.24 6.45 -4.23 -1.26 -4.92 115.64 113.85 2btm s THR 178 Ca 0.67 0.93 -0.05 0.00 -1.18 0.00 0.00 61.69 62.06 2btm s THR 178 Cb -0.21 -3.64 0.20 0.00 1.34 0.00 0.00 72.50 70.19 2btm s THR 178 CO 0.60 -0.13 1.78 -0.65 -0.54 0.00 0.00 174.62 175.69 2btm h PRO 179 N 2.42 0.63 0.31 3.99 0.11 -1.95 0.01 132.00 137.52 2btm h PRO 179 Ca -0.48 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 2btm h PRO 179 Cb 1.18 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 2btm h PRO 179 CO 0.66 0.41 -0.26 0.93 -0.21 0.00 0.00 178.00 179.53 2btm h GLU 180 N 0.65 -0.56 -0.13 1.05 3.07 -1.93 0.15 114.58 116.89 2btm h GLU 180 Ca 0.38 0.04 0.02 0.00 -0.50 0.00 0.00 59.36 59.30 2btm h GLU 180 Cb 0.42 0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 28.43 2btm h GLU 180 CO -0.28 -0.37 0.01 0.22 -1.40 0.00 0.00 179.01 177.19 2btm h ASP 181 N -0.58 -0.02 -0.59 1.42 3.58 -1.86 -0.83 116.42 117.55 2btm h ASP 181 Ca -0.02 0.02 0.03 0.00 0.42 0.00 0.00 57.03 57.49 2btm h ASP 181 Cb 0.51 0.04 -0.03 0.00 1.72 0.00 0.00 39.33 41.57 2btm h ASP 181 CO -0.03 0.01 0.39 0.00 -2.88 0.00 0.00 179.24 176.73 2btm h ALA 182 N 1.10 1.69 -0.28 -0.78 0.00 -0.85 0.47 119.26 120.60 2btm h ALA 182 Ca 0.06 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2btm h ALA 182 Cb 0.06 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2btm h ALA 182 CO -0.09 0.25 -0.20 -0.97 0.00 0.00 0.00 179.25 178.24 2btm h ASN 183 N 0.69 0.52 0.07 0.00 -1.24 0.12 0.67 115.58 116.41 2btm h ASN 183 Ca 0.23 -0.16 -0.00 0.00 0.71 0.00 0.00 56.30 57.08 2btm h ASN 183 Cb 0.08 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 38.99 2btm h ASN 183 CO -0.06 0.72 -0.03 0.28 -1.29 0.00 0.00 177.43 177.05 2btm h SER 184 N 0.47 -0.08 -0.39 1.15 0.02 0.43 0.29 113.55 115.44 2btm h SER 184 Ca 0.08 -0.28 -0.00 0.00 -0.84 0.00 0.00 61.79 60.74 2btm h SER 184 Cb 0.61 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.15 2btm h SER 184 CO 0.04 0.25 0.24 0.58 -1.14 0.00 0.00 176.83 176.80 2btm h VAL 185 N -0.41 1.12 -0.42 2.27 2.07 -1.08 0.12 116.25 119.93 2btm h VAL 185 Ca -0.01 -0.26 -0.08 0.00 0.82 0.00 0.00 66.70 67.17 2btm h VAL 185 Cb 0.36 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 2btm h VAL 185 CO 0.02 0.12 -0.05 0.00 0.02 0.00 0.00 177.57 177.67 2btm h GLY 187 N 0.96 0.83 1.00 0.00 0.00 0.22 -0.33 103.07 105.74 2btm h GLY 187 Ca 0.12 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2btm h GLY 187 CO 0.03 0.39 0.24 0.84 0.00 0.00 0.00 176.54 178.04 2btm h HIS 188 N 0.72 0.48 0.05 5.60 2.76 -0.25 -1.27 115.15 123.25 2btm h HIS 188 Ca 0.18 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.38 2btm h HIS 188 Cb 0.11 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 28.88 2btm h HIS 188 CO -0.00 0.32 -0.21 0.82 -1.30 0.00 0.00 177.93 177.55 2btm h ILE 189 N 0.51 0.51 -0.82 6.26 2.04 -0.74 -0.11 117.51 125.16 2btm h ILE 189 Ca 0.14 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.13 2btm h ILE 189 Cb -0.04 0.51 -0.06 0.00 -0.74 0.00 0.00 36.82 36.50 2btm h ILE 189 CO -0.03 0.00 0.53 -0.09 0.00 0.00 0.00 178.15 178.56 2btm h ARG 190 N -0.36 0.60 -0.36 2.37 2.43 -0.79 0.83 114.38 119.08 2btm h ARG 190 Ca 0.05 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.13 2btm h ARG 190 Cb 0.42 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 2btm h ARG 190 CO -0.16 0.39 0.04 0.77 -1.51 0.00 0.00 179.97 179.51 2btm h SER 191 N 0.61 0.59 -0.75 -3.80 0.02 -0.05 -0.71 113.55 109.46 2btm h SER 191 Ca 0.40 -0.27 0.02 0.00 -0.84 0.00 0.00 61.79 61.09 2btm h SER 191 Cb 0.67 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 63.02 2btm h SER 191 CO -0.16 0.71 0.49 0.58 -1.14 0.00 0.00 176.83 177.31 2btm h VAL 192 N 0.44 1.14 -0.28 2.27 2.07 0.81 0.33 116.25 123.03 2btm h VAL 192 Ca 0.11 -0.33 -0.04 0.00 0.82 0.00 0.00 66.70 67.26 2btm h VAL 192 Cb 0.39 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 2btm h VAL 192 CO 0.01 0.18 0.02 0.58 0.02 0.00 0.00 177.57 178.37 2btm h VAL 193 N 0.97 1.16 -0.00 2.57 2.07 -0.63 -1.67 116.25 120.72 2btm h VAL 193 Ca 0.29 -0.63 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 2btm h VAL 193 Cb -0.04 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 2btm h VAL 193 CO -0.09 0.22 -0.01 -1.28 0.02 0.00 0.00 177.57 176.43 2btm h SER 194 N 0.41 0.01 0.15 0.57 0.87 0.52 0.44 113.55 116.53 2btm h SER 194 Ca 0.09 -0.58 0.00 0.00 -1.23 0.00 0.00 61.79 60.08 2btm h SER 194 Cb 0.25 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.21 2btm h SER 194 CO 0.00 0.59 0.00 0.03 -0.53 0.00 0.00 176.83 176.92 2btm h ARG 195 N -0.56 0.00 0.00 2.24 3.08 -0.19 0.52 114.38 119.47 2btm h ARG 195 Ca 0.00 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.79 2btm h ARG 195 Cb 0.59 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.59 2btm h ARG 195 CO 0.00 0.00 -1.98 1.28 -1.07 0.00 0.00 179.97 178.20 2btm n LEU 196 N -2.80 1.32 0.00 3.04 4.77 -0.65 -4.74 117.00 117.94 2btm n LEU 196 Ca -0.02 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 2btm n LEU 196 Cb 0.09 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2btm n LEU 196 CO 0.18 0.55 0.45 0.49 -1.33 0.00 0.00 177.39 177.72 2btm n PHE 197 N -2.74 0.00 0.00 -1.77 3.72 0.15 -5.03 117.46 111.80 2btm n PHE 197 Ca -0.27 -0.40 0.00 0.00 -0.05 0.00 0.00 57.45 56.73 2btm n PHE 197 Cb 0.90 -0.04 0.00 0.00 -0.94 0.00 0.00 39.48 39.40 2btm n PHE 197 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2btm n GLY 198 N -0.40 -1.35 0.25 1.37 0.00 0.18 -4.29 105.19 100.96 2btm n GLY 198 Ca 0.00 -1.58 -0.01 0.00 0.00 0.00 0.00 46.02 44.43 2btm n GLY 198 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2btm h PRO 199 N 0.00 0.46 -0.89 1.61 0.13 -1.89 -2.68 132.00 128.75 2btm h PRO 199 Ca 0.00 -0.13 0.08 0.00 -0.87 0.00 0.00 66.00 65.08 2btm h PRO 199 Cb 0.00 -0.05 -0.06 0.00 0.13 0.00 0.00 31.00 31.02 2btm h PRO 199 CO 0.00 0.59 0.57 0.93 -0.23 0.00 0.00 178.00 179.86 2btm h GLU 200 N 0.43 0.90 0.17 0.86 3.07 -1.96 -0.28 114.58 117.77 2btm h GLU 200 Ca 0.08 -0.05 -0.31 0.00 -0.50 0.00 0.00 59.36 58.58 2btm h GLU 200 Cb 0.48 -0.20 0.01 0.00 -0.84 0.00 0.00 28.75 28.20 2btm h GLU 200 CO 0.03 0.59 -1.43 0.00 -1.40 0.00 0.00 179.01 176.80 2btm h ALA 201 N 1.54 0.06 0.00 3.43 0.00 -1.71 -3.19 119.26 119.39 2btm h ALA 201 Ca 0.40 -0.95 -0.06 0.00 0.00 0.00 0.00 54.91 54.30 2btm h ALA 201 Cb 0.33 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2btm h ALA 201 CO -0.16 0.93 -0.27 0.00 0.00 0.00 0.00 179.25 179.75 2btm h ALA 202 N 0.39 1.53 0.00 0.00 0.00 -1.06 -0.13 119.26 119.99 2btm h ALA 202 Ca -0.22 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2btm h ALA 202 Cb 2.06 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.80 2btm h ALA 202 CO 0.21 0.33 -0.48 0.93 0.00 0.00 0.00 179.25 180.25 2btm h GLU 203 N 0.00 0.00 0.04 0.00 3.07 -1.16 -3.36 114.58 113.18 2btm h GLU 203 Ca -0.00 0.00 -0.37 0.00 -0.50 0.00 0.00 59.36 58.48 2btm h GLU 203 Cb 0.48 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.34 2btm h GLU 203 CO 0.03 0.00 -2.26 0.00 -1.40 0.00 0.00 179.01 175.39 2btm n ALA 204 N -1.93 1.25 -1.72 3.43 0.00 -0.99 -4.73 120.51 115.82 2btm n ALA 204 Ca 0.03 -0.92 -0.43 0.00 0.00 0.00 0.00 53.44 52.12 2btm n ALA 204 Cb 0.47 -0.36 -0.01 0.00 0.00 0.00 0.00 19.45 19.56 2btm n ALA 204 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 2btm n ILE 205 N -3.28 1.38 -3.76 0.00 3.06 -0.10 -4.91 119.36 111.75 2btm n ILE 205 Ca -0.38 -0.35 -0.36 0.00 -2.50 0.00 0.00 62.75 59.16 2btm n ILE 205 Cb 1.03 -1.75 -0.07 0.00 0.54 0.00 0.00 39.64 39.39 2btm n ILE 205 CO 0.00 0.00 0.00 -0.13 -2.50 0.00 0.00 176.55 173.92 2btm s ARG 206 N -1.05 3.94 -0.17 9.51 0.52 -1.24 -4.97 118.95 125.49 2btm s ARG 206 Ca 0.61 -0.16 0.01 0.00 -0.52 0.00 0.00 55.73 55.68 2btm s ARG 206 Cb -0.55 -3.34 0.01 0.00 0.52 0.00 0.00 34.95 31.59 2btm s ARG 206 CO 0.54 0.47 -0.19 0.42 0.02 0.00 0.00 175.30 176.56 2btm s ILE 207 N -0.13 2.25 0.26 1.52 1.01 -1.26 -1.47 121.20 123.39 2btm s ILE 207 Ca 0.11 -0.89 0.06 0.00 0.00 0.00 0.00 60.65 59.93 2btm s ILE 207 Cb -0.12 -1.94 -0.03 0.00 0.01 0.00 0.00 42.46 40.39 2btm s ILE 207 CO 0.01 0.53 0.32 -1.10 0.00 0.00 0.00 174.94 174.70 2btm s GLN 208 N 1.10 3.21 0.01 2.79 -0.21 0.11 -0.02 119.66 126.66 2btm s GLN 208 Ca 0.00 -0.91 0.02 0.00 0.02 0.00 0.00 55.36 54.49 2btm s GLN 208 Cb -0.14 -2.76 -0.04 0.00 1.00 0.00 0.00 33.01 31.07 2btm s GLN 208 CO -0.07 0.36 0.01 -0.47 -2.12 0.00 0.00 175.29 172.99 2btm s TYR 209 N -2.07 3.09 -0.02 0.91 5.04 -0.56 -1.03 117.35 122.71 2btm s TYR 209 Ca 0.35 0.08 -0.04 0.00 -2.44 0.00 0.00 57.07 55.02 2btm s TYR 209 Cb -0.09 -1.66 0.00 0.00 0.35 0.00 0.00 41.96 40.57 2btm s TYR 209 CO 0.28 0.47 0.10 0.20 -1.34 0.00 0.00 175.55 175.26 2btm s GLY 210 N -1.67 0.00 0.00 8.97 0.00 0.43 -1.41 107.32 113.65 2btm s GLY 210 Ca 0.21 0.04 0.00 0.00 0.00 0.00 0.00 44.72 44.97 2btm s GLY 210 CO 0.12 -0.03 0.00 0.61 0.00 0.00 0.00 173.10 173.80 2btm n GLY 211 N 2.36 2.49 2.47 0.20 0.00 -1.26 -3.76 105.19 107.69 2btm n GLY 211 Ca -0.17 -0.59 -0.21 0.00 0.00 0.00 0.00 46.02 45.05 2btm n GLY 211 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2btm n SER 212 N 0.00 -5.68 -4.74 1.61 7.64 -0.95 -4.42 113.62 107.08 2btm n SER 212 Ca 0.00 0.19 -0.41 0.00 1.01 0.00 0.00 58.87 59.66 2btm n SER 212 Cb 0.00 -4.84 -0.03 0.00 -1.01 0.00 0.00 64.21 58.33 2btm n SER 212 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2btm s VAL 213 N -2.92 3.36 0.24 0.44 1.01 -1.26 -4.70 120.40 116.57 2btm s VAL 213 Ca 0.00 1.12 0.04 0.00 0.00 0.00 0.00 61.98 63.14 2btm s VAL 213 Cb 0.00 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 2btm s VAL 213 CO 0.00 0.17 -0.03 -0.54 0.00 0.00 0.00 175.10 174.70 2btm s LYS 214 N -0.09 1.39 0.49 2.72 3.01 -1.26 -4.61 119.74 121.40 2btm s LYS 214 Ca 0.56 -1.70 0.16 0.00 -1.01 0.00 0.00 55.97 53.98 2btm s LYS 214 Cb -0.35 -0.78 1.20 0.00 -1.01 0.00 0.00 37.83 36.89 2btm s LYS 214 CO 0.37 -0.05 2.09 -1.35 0.51 0.00 0.00 175.35 176.92 2btm h PRO 215 N 2.43 0.14 -0.02 -1.68 0.11 -1.93 0.97 132.00 132.02 2btm h PRO 215 Ca -0.39 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2btm h PRO 215 Cb 1.22 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2btm h PRO 215 CO 0.65 0.09 0.00 -0.40 -0.21 0.00 0.00 178.00 178.13 2btm n ASP 216 N -4.49 0.60 0.00 -2.05 5.75 -1.26 -3.99 116.55 111.10 2btm n ASP 216 Ca 0.02 -1.26 0.00 0.00 -0.01 0.00 0.00 54.79 53.53 2btm n ASP 216 Cb 0.21 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 2btm n ASP 216 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 2btm n ASN 217 N -0.50 0.05 -0.36 -1.12 0.23 -0.60 -4.86 115.26 108.10 2btm n ASN 217 Ca 0.21 -0.45 -0.03 0.00 -0.53 0.00 0.00 54.58 53.78 2btm n ASN 217 Cb 0.20 0.07 0.10 0.00 -2.08 0.00 0.00 39.78 38.07 2btm n ASN 217 CO 0.00 0.00 0.00 -0.29 -0.93 0.00 0.00 177.26 176.04 2btm h ILE 218 N 0.36 1.26 -0.51 1.53 2.10 -0.98 -2.29 117.51 118.98 2btm h ILE 218 Ca 0.00 -0.51 0.00 0.00 1.08 0.00 0.00 64.86 65.43 2btm h ILE 218 Cb 0.18 -0.14 -0.03 0.00 -1.09 0.00 0.00 36.82 35.74 2btm h ILE 218 CO 0.00 0.26 0.32 0.03 -1.08 0.00 0.00 178.15 177.68 2btm h ARG 219 N 1.32 0.68 0.00 2.19 3.08 -1.85 -0.49 114.38 119.31 2btm h ARG 219 Ca 0.35 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.31 2btm h ARG 219 Cb -0.11 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.78 2btm h ARG 219 CO -0.07 0.47 -0.20 -0.44 -1.07 0.00 0.00 179.97 178.66 2btm h ASP 220 N 0.70 0.00 0.14 7.04 3.32 -1.76 -0.53 116.42 125.32 2btm h ASP 220 Ca 0.19 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.94 2btm h ASP 220 Cb -0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.50 2btm h ASP 220 CO -0.04 0.20 -1.48 -0.26 -1.72 0.00 0.00 179.24 175.94 2btm h PHE 221 N 0.00 0.54 0.00 4.55 0.04 -1.13 -3.34 116.94 117.60 2btm h PHE 221 Ca -0.00 -0.39 -0.05 0.00 2.80 0.00 0.00 57.97 60.33 2btm h PHE 221 Cb 0.47 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.59 2btm h PHE 221 CO 0.00 1.58 -0.23 -0.07 -0.60 0.00 0.00 178.31 178.99 2btm h LEU 222 N -0.18 0.00 -1.25 1.54 3.38 -0.97 -2.25 115.31 115.57 2btm h LEU 222 Ca -0.31 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.64 2btm h LEU 222 Cb 1.86 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.58 2btm h LEU 222 CO 0.10 0.23 0.26 0.00 0.09 0.00 0.00 178.44 179.12 2btm h ALA 223 N 1.77 1.42 -2.65 1.53 0.00 -1.21 -3.43 119.26 116.70 2btm h ALA 223 Ca -0.00 -0.12 -0.56 0.00 0.00 0.00 0.00 54.91 54.23 2btm h ALA 223 Cb 0.41 -0.23 0.11 0.00 0.00 0.00 0.00 17.79 18.08 2btm h ALA 223 CO 0.03 0.46 0.59 1.04 0.00 0.00 0.00 179.25 181.36 2btm n GLN 224 N -4.37 2.29 0.10 0.00 1.13 -0.85 -4.89 117.38 110.80 2btm n GLN 224 Ca 0.05 0.80 0.01 0.00 -1.94 0.00 0.00 57.00 55.92 2btm n GLN 224 Cb 0.13 -2.43 0.35 0.00 0.11 0.00 0.00 30.24 28.39 2btm n GLN 224 CO 0.00 0.00 0.00 -0.56 -1.44 0.00 0.00 177.06 175.06 2btm h GLN 225 N 2.70 0.27 -0.00 -1.09 3.07 -1.87 -3.01 115.11 115.18 2btm h GLN 225 Ca -0.47 -0.07 0.00 0.00 0.09 0.00 0.00 58.65 58.19 2btm h GLN 225 Cb 1.27 -0.03 0.00 0.00 0.08 0.00 0.00 27.48 28.80 2btm h GLN 225 CO 0.63 0.44 -0.37 1.04 0.09 0.00 0.00 178.83 180.66 2btm n GLN 226 N -4.22 0.21 -3.61 0.06 1.13 -1.26 -4.78 117.38 104.90 2btm n GLN 226 Ca -0.01 -0.11 -0.40 0.00 -1.94 0.00 0.00 57.00 54.54 2btm n GLN 226 Cb 0.31 -1.50 -0.11 0.00 0.11 0.00 0.00 30.24 29.05 2btm n GLN 226 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2btm s ILE 227 N -2.86 4.60 -2.01 5.09 1.01 -1.14 -4.58 121.20 121.31 2btm s ILE 227 Ca 0.15 -0.73 0.20 0.00 0.00 0.00 0.00 60.65 60.28 2btm s ILE 227 Cb 0.18 -3.51 0.58 0.00 0.01 0.00 0.00 42.46 39.73 2btm s ILE 227 CO 0.63 -0.15 1.49 0.47 0.00 0.00 0.00 174.94 177.38 2btm n ASP 228 N 5.00 3.54 0.00 3.58 8.00 0.97 -4.56 116.55 133.08 2btm n ASP 228 Ca -0.12 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.38 2btm n ASP 228 Cb 0.47 -0.44 0.00 0.00 -0.02 0.00 0.00 41.12 41.13 2btm n ASP 228 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2btm n GLY 229 N 1.55 -1.32 3.11 0.44 0.00 -1.24 -1.44 105.19 106.29 2btm n GLY 229 Ca 0.22 -1.17 -0.11 0.00 0.00 0.00 0.00 46.02 44.96 2btm n GLY 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2btm s ALA 230 N -1.00 -0.37 -0.35 4.61 0.00 -0.91 -1.49 121.76 122.25 2btm s ALA 230 Ca 0.00 0.01 -0.10 0.00 0.00 0.00 0.00 51.96 51.86 2btm s ALA 230 Cb 0.00 0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.17 2btm s ALA 230 CO 0.00 -0.19 0.18 -1.17 0.00 0.00 0.00 175.76 174.58 2btm s LEU 231 N -1.11 4.45 -0.11 0.00 0.20 -0.50 -1.34 118.68 120.27 2btm s LEU 231 Ca -0.12 -0.80 -0.01 0.00 0.69 0.00 0.00 54.13 53.89 2btm s LEU 231 Cb -0.06 -2.01 -0.02 0.00 -0.43 0.00 0.00 46.19 43.66 2btm s LEU 231 CO 0.01 -0.30 -0.08 -0.69 -0.29 0.00 0.00 176.35 175.00 2btm s VAL 232 N 1.57 3.50 0.00 1.68 1.01 0.46 -4.03 120.40 124.60 2btm s VAL 232 Ca 0.03 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.49 2btm s VAL 232 Cb -0.18 -2.47 0.00 0.00 0.00 0.00 0.00 36.38 33.72 2btm s VAL 232 CO 0.06 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.31 2btm n GLY 233 N 3.07 0.25 0.32 4.51 0.00 -1.26 0.67 105.19 112.74 2btm n GLY 233 Ca -0.18 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.02 2btm n GLY 233 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2btm h GLY 234 N 0.00 1.71 0.38 -0.02 0.00 -1.92 0.14 103.07 103.35 2btm h GLY 234 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.17 2btm h GLY 234 CO 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 176.54 176.15 2btm n ALA 235 N -2.48 2.29 0.70 3.60 0.00 -1.26 -2.77 120.51 120.59 2btm n ALA 235 Ca 0.26 -0.06 0.07 0.00 0.00 0.00 0.00 53.44 53.72 2btm n ALA 235 Cb 0.80 -1.15 -0.04 0.00 0.00 0.00 0.00 19.45 19.06 2btm n ALA 235 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2btm n SER 236 N -0.69 1.16 0.03 0.00 3.41 0.49 -3.77 113.62 114.25 2btm n SER 236 Ca 0.07 -1.08 -0.06 0.00 -0.26 0.00 0.00 58.87 57.54 2btm n SER 236 Cb 0.03 0.73 0.12 0.00 -0.26 0.00 0.00 64.21 64.84 2btm n SER 236 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2btm h LEU 237 N 0.89 0.47 -9.51 1.04 3.38 -1.62 -3.43 115.31 106.53 2btm h LEU 237 Ca 0.00 -0.22 -0.58 0.00 0.09 0.00 0.00 57.88 57.17 2btm h LEU 237 Cb 0.44 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 2btm h LEU 237 CO 0.00 0.87 -0.08 -1.61 0.09 0.00 0.00 178.44 177.71 2btm s GLU 238 N -4.10 4.25 0.15 1.13 0.41 -1.26 -4.99 118.70 114.29 2btm s GLU 238 Ca -0.06 0.61 -0.17 0.00 -0.41 0.00 0.00 54.97 54.94 2btm s GLU 238 Cb 0.12 -3.34 0.03 0.00 -1.78 0.00 0.00 34.13 29.16 2btm s GLU 238 CO 0.81 0.39 1.74 -1.35 -0.49 0.00 0.00 175.26 176.36 2btm h PRO 239 N 5.68 0.21 -0.58 0.39 0.11 -1.92 0.64 132.00 136.54 2btm h PRO 239 Ca -0.45 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 2btm h PRO 239 Cb 1.20 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 2btm h PRO 239 CO 0.69 0.14 0.35 0.00 -0.21 0.00 0.00 178.00 178.97 2btm h ALA 240 N 1.20 0.74 -0.41 -0.75 0.00 -1.97 -1.18 119.26 116.89 2btm h ALA 240 Ca 0.14 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2btm h ALA 240 Cb 0.12 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2btm h ALA 240 CO -0.16 0.22 0.05 1.03 0.00 0.00 0.00 179.25 180.40 2btm h SER 241 N 0.78 0.66 -0.99 0.00 0.87 -1.79 -2.74 113.55 110.35 2btm h SER 241 Ca 0.21 -0.27 0.03 0.00 -1.23 0.00 0.00 61.79 60.53 2btm h SER 241 Cb -0.01 -0.18 -0.06 0.00 -0.44 0.00 0.00 62.40 61.72 2btm h SER 241 CO -0.04 0.76 0.65 0.15 -0.53 0.00 0.00 176.83 177.82 2btm h PHE 242 N 0.53 1.22 -0.37 2.24 3.57 -0.55 -1.97 116.94 121.61 2btm h PHE 242 Ca 0.12 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.59 2btm h PHE 242 Cb 0.39 -0.41 -0.02 0.00 2.79 0.00 0.00 35.95 38.71 2btm h PHE 242 CO 0.03 0.72 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.72 2btm h LEU 243 N 1.27 0.57 -0.55 0.59 3.38 -1.02 -2.26 115.31 117.29 2btm h LEU 243 Ca 0.39 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 58.11 2btm h LEU 243 Cb -0.04 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2btm h LEU 243 CO -0.11 0.67 -0.10 1.56 0.09 0.00 0.00 178.44 180.55 2btm h GLN 244 N 0.57 1.04 -0.20 1.13 4.20 -1.08 -0.44 115.11 120.32 2btm h GLN 244 Ca 0.11 -0.38 -0.00 0.00 0.06 0.00 0.00 58.65 58.44 2btm h GLN 244 Cb 0.41 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 2btm h GLN 244 CO 0.02 1.07 0.12 -0.07 -0.67 0.00 0.00 178.83 179.30 2btm h LEU 245 N 0.92 0.24 -0.88 1.46 3.38 -1.11 -2.16 115.31 117.16 2btm h LEU 245 Ca 0.14 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 2btm h LEU 245 Cb 0.67 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 2btm h LEU 245 CO 0.05 0.22 -0.43 0.58 0.09 0.00 0.00 178.44 178.95 2btm h VAL 246 N 0.23 1.00 -0.16 1.22 2.07 -1.35 -2.84 116.25 116.43 2btm h VAL 246 Ca 0.07 -1.66 -0.11 0.00 0.82 0.00 0.00 66.70 65.82 2btm h VAL 246 Cb 0.03 1.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 2btm h VAL 246 CO -0.01 0.42 -0.37 -0.08 0.02 0.00 0.00 177.57 177.55 2btm h GLU 247 N 0.00 0.34 0.00 1.57 4.57 -0.75 -1.92 114.58 118.38 2btm h GLU 247 Ca -0.00 -0.15 0.00 0.00 -1.18 0.00 0.00 59.36 58.02 2btm h GLU 247 Cb 0.95 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.53 2btm h GLU 247 CO 0.06 0.66 0.00 0.00 -1.18 0.00 0.00 179.01 178.55 2btm h ALA 248 N 1.33 1.00 -0.13 2.92 0.00 -1.14 -2.33 119.26 120.91 2btm h ALA 248 Ca 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 2btm h ALA 248 Cb 0.79 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2btm h ALA 248 CO 0.06 0.00 -0.30 0.78 0.00 0.00 0.00 179.25 179.79 2btm h GLY 249 N 0.68 0.26 1.28 0.00 0.00 -1.42 -2.96 103.07 100.91 2btm h GLY 249 Ca 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 2btm h GLY 249 CO 0.00 0.19 0.33 3.21 0.00 0.00 0.00 176.54 180.27 2btm h ARG 250 N 0.21 0.93 0.00 4.80 3.08 -1.56 -3.46 114.38 118.39 2btm h ARG 250 Ca 0.03 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 59.96 2btm h ARG 250 Cb 0.64 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.51 2btm h ARG 250 CO 0.05 0.71 0.00 1.58 -1.07 0.00 0.00 179.97 181.24