#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 4.31 0.67 5.56 2.20 -1.26 -4.98 119.74 126.25 2btm s LYS 2 Ca 0.00 1.96 -0.16 0.00 -0.36 0.00 0.00 55.97 57.41 2btm s LYS 2 Cb 0.00 -3.46 0.01 0.00 -1.51 0.00 0.00 37.83 32.86 2btm s LYS 2 CO 0.00 -0.50 1.17 -1.25 -0.36 0.00 0.00 175.35 174.42 2btm s PRO 3 N 1.90 2.55 -0.07 4.03 0.04 -1.26 -4.84 135.00 137.36 2btm s PRO 3 Ca 0.63 1.65 -0.01 0.00 0.04 0.00 0.00 61.00 63.31 2btm s PRO 3 Cb -0.32 -1.90 0.03 0.00 0.04 0.00 0.00 34.50 32.35 2btm s PRO 3 CO 0.28 -1.49 0.01 -1.50 0.04 0.00 0.00 177.00 174.33 2btm s ILE 4 N -2.01 0.32 -0.23 0.56 2.07 -0.76 -0.95 121.20 120.19 2btm s ILE 4 Ca 0.73 0.15 -0.02 0.00 -1.41 0.00 0.00 60.65 60.10 2btm s ILE 4 Cb -0.26 -0.49 0.01 0.00 0.13 0.00 0.00 42.46 41.85 2btm s ILE 4 CO 0.41 0.25 -0.08 -0.63 -1.91 0.00 0.00 174.94 172.98 2btm s ILE 5 N 2.00 2.90 -0.09 2.00 1.01 0.08 -2.66 121.20 126.44 2btm s ILE 5 Ca 0.05 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 59.86 2btm s ILE 5 Cb -0.12 -2.39 -0.02 0.00 0.01 0.00 0.00 42.46 39.93 2btm s ILE 5 CO -0.05 0.32 -0.12 0.00 0.00 0.00 0.00 174.94 175.08 2btm s ALA 6 N 1.37 2.71 -0.22 9.38 0.00 0.06 -1.41 121.76 133.63 2btm s ALA 6 Ca 0.03 -0.93 -0.09 0.00 0.00 0.00 0.00 51.96 50.97 2btm s ALA 6 Cb -0.15 -1.12 -0.04 0.00 0.00 0.00 0.00 23.12 21.80 2btm s ALA 6 CO -0.05 0.43 0.11 0.20 0.00 0.00 0.00 175.76 176.44 2btm s GLY 7 N -0.30 1.91 -0.44 0.00 0.00 0.24 -0.01 107.32 108.72 2btm s GLY 7 Ca 0.03 -0.89 -0.05 0.00 0.00 0.00 0.00 44.72 43.80 2btm s GLY 7 CO 0.03 0.31 0.27 0.21 0.00 0.00 0.00 173.10 173.92 2btm s ASN 8 N 0.95 5.43 0.40 1.64 3.04 0.13 0.61 114.94 127.15 2btm s ASN 8 Ca 0.06 -2.03 0.29 0.00 0.04 0.00 0.00 52.86 51.21 2btm s ASN 8 Cb -0.14 -1.90 1.16 0.00 -1.54 0.00 0.00 41.25 38.83 2btm s ASN 8 CO 0.03 -0.59 1.84 -0.50 -3.04 0.00 0.00 177.10 174.84 2btm h TRP 9 N 8.16 0.00 -0.03 0.43 6.55 -1.67 -3.38 115.95 126.01 2btm h TRP 9 Ca -0.15 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.69 2btm h TRP 9 Cb 1.05 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.35 2btm h TRP 9 CO 0.59 0.00 0.00 1.63 -1.05 0.00 0.00 178.44 179.61 2btm n LYS 10 N -2.66 0.00 -2.02 0.49 5.02 -1.26 -3.17 118.16 114.56 2btm n LYS 10 Ca 0.01 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.89 2btm n LYS 10 Cb 0.28 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.28 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 0.00 3.72 -4.10 1.97 0.00 -1.26 -4.37 117.12 113.08 2btm n MET 11 Ca 0.00 -3.18 -0.12 0.00 -0.00 0.00 0.00 57.70 54.40 2btm n MET 11 Cb 0.00 -2.91 -0.11 0.00 0.00 0.00 0.00 33.22 30.20 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 1.32 0.93 0.00 6.12 0.01 -1.19 -5.13 114.94 116.99 2btm s ASN 12 Ca 0.48 -0.76 0.00 0.00 -0.71 0.00 0.00 52.86 51.87 2btm s ASN 12 Cb 0.14 0.07 0.00 0.00 0.41 0.00 0.00 41.25 41.87 2btm s ASN 12 CO -0.04 -0.34 0.00 0.61 -1.51 0.00 0.00 177.10 175.82 2btm n GLY 13 N 0.78 0.99 3.25 0.66 0.00 -1.26 -4.80 105.19 104.80 2btm n GLY 13 Ca -0.18 -1.95 -0.16 0.00 0.00 0.00 0.00 46.02 43.73 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 -2.00 1.25 0.16 2.61 -4.23 -1.26 -5.01 115.64 107.16 2btm s THR 14 Ca 0.00 -1.91 -0.23 0.00 -1.18 0.00 0.00 61.69 58.37 2btm s THR 14 Cb 0.00 -1.70 0.05 0.00 1.34 0.00 0.00 72.50 72.19 2btm s THR 14 CO 0.00 -0.60 1.60 0.25 -0.54 0.00 0.00 174.62 175.33 2btm h LEU 15 N 3.10 -1.08 -0.57 4.79 5.85 -1.97 0.86 115.31 126.29 2btm h LEU 15 Ca -0.38 0.19 0.09 0.00 0.84 0.00 0.00 57.88 58.62 2btm h LEU 15 Cb 1.20 0.50 -0.07 0.00 0.37 0.00 0.00 40.66 42.66 2btm h LEU 15 CO 0.58 -0.32 0.16 0.00 -0.34 0.00 0.00 178.44 178.52 2btm h ALA 16 N 0.73 0.69 -0.59 1.25 0.00 -1.99 0.03 119.26 119.38 2btm h ALA 16 Ca 0.17 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 2btm h ALA 16 Cb 0.54 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2btm h ALA 16 CO -0.53 -0.26 0.04 0.93 0.00 0.00 0.00 179.25 179.44 2btm h GLU 17 N 0.32 0.99 -0.76 0.00 5.08 -1.72 -1.50 114.58 116.98 2btm h GLU 17 Ca 0.29 -0.27 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 2btm h GLU 17 Cb 0.38 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 2btm h GLU 17 CO -0.33 0.94 0.34 0.00 -1.00 0.00 0.00 179.01 178.96 2btm h ALA 18 N 1.12 0.98 -0.28 3.43 0.00 0.27 -0.74 119.26 124.05 2btm h ALA 18 Ca 0.18 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2btm h ALA 18 Cb 0.47 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2btm h ALA 18 CO 0.02 0.56 -0.09 0.28 0.00 0.00 0.00 179.25 180.03 2btm h VAL 19 N 1.07 1.29 -0.78 0.00 2.07 -0.78 -2.63 116.25 116.49 2btm h VAL 19 Ca 0.26 -1.13 0.04 0.00 0.82 0.00 0.00 66.70 66.69 2btm h VAL 19 Cb 0.15 1.45 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 2btm h VAL 19 CO -0.03 0.36 0.48 1.56 0.02 0.00 0.00 177.57 179.96 2btm h GLN 20 N 0.30 0.89 0.32 1.57 1.08 -1.03 0.11 115.11 118.34 2btm h GLN 20 Ca 0.07 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 2btm h GLN 20 Cb 0.57 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.78 2btm h GLN 20 CO 0.03 0.59 -0.35 0.35 -0.95 0.00 0.00 178.83 178.49 2btm h PHE 21 N 0.92 -0.96 -0.96 2.96 3.04 -1.00 0.35 116.94 121.28 2btm h PHE 21 Ca 0.33 0.01 0.02 0.00 3.98 0.00 0.00 57.97 62.31 2btm h PHE 21 Cb 0.09 0.38 -0.05 0.00 2.56 0.00 0.00 35.95 38.93 2btm h PHE 21 CO -0.04 -0.49 0.63 0.28 -2.02 0.00 0.00 178.31 176.67 2btm h VAL 22 N -0.71 1.21 -0.39 1.41 2.07 -1.19 -0.95 116.25 117.70 2btm h VAL 22 Ca -0.02 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.07 2btm h VAL 22 Cb 0.66 -0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 2btm h VAL 22 CO -0.08 0.23 0.26 -0.08 0.02 0.00 0.00 177.57 177.91 2btm h GLU 23 N 1.26 0.52 0.00 1.57 4.57 -0.03 0.52 114.58 122.98 2btm h GLU 23 Ca 0.36 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.49 2btm h GLU 23 Cb -0.08 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 28.39 2btm h GLU 23 CO -0.09 0.35 -0.08 -0.44 -1.18 0.00 0.00 179.01 177.57 2btm h ASP 24 N 0.53 0.00 0.00 1.04 3.32 0.19 -3.38 116.42 118.12 2btm h ASP 24 Ca 0.14 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.91 2btm h ASP 24 Cb -0.05 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.45 2btm h ASP 24 CO -0.03 0.08 -2.07 0.52 -1.72 0.00 0.00 179.24 176.02 2btm n VAL 25 N -3.15 1.07 -0.55 -1.35 0.31 -0.41 -4.67 118.33 109.58 2btm n VAL 25 Ca 0.02 -0.40 0.44 0.00 -0.01 0.00 0.00 64.34 64.39 2btm n VAL 25 Cb 0.45 -1.19 0.74 0.00 -0.91 0.00 0.00 33.84 32.93 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 -0.03 0.03 0.00 5.55 2.10 -0.15 0.21 116.57 124.28 2btm h LYS 26 Ca -0.42 -0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.20 2btm h LYS 26 Cb 1.64 -0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 32.96 2btm h LYS 26 CO -0.08 0.02 -0.89 0.78 -2.00 0.00 0.00 179.45 177.28 2btm h GLY 27 N 0.03 0.00 -2.45 0.07 0.00 -1.81 -3.36 103.07 95.55 2btm h GLY 27 Ca 0.86 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.19 2btm h GLY 27 CO -0.22 0.00 0.00 1.42 0.00 0.00 0.00 176.54 177.74 2btm n HIS 28 N -2.79 1.13 -3.02 5.60 8.25 0.05 -4.97 115.22 119.48 2btm n HIS 28 Ca -0.01 -0.61 -0.34 0.00 -0.26 0.00 0.00 57.72 56.50 2btm n HIS 28 Cb 0.59 -0.17 -0.06 0.00 1.12 0.00 0.00 29.99 31.47 2btm n HIS 28 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2btm s VAL 29 N -1.68 4.52 0.97 1.59 0.11 -1.12 -5.01 120.40 119.79 2btm s VAL 29 Ca 0.44 1.29 -0.12 0.00 -2.93 0.00 0.00 61.98 60.66 2btm s VAL 29 Cb 0.28 -3.75 0.13 0.00 -1.53 0.00 0.00 36.38 31.50 2btm s VAL 29 CO 0.22 -0.03 0.84 -2.65 -3.33 0.00 0.00 175.10 170.16 2btm n PRO 30 N 0.10 -0.69 -2.13 1.54 -0.02 -1.26 -4.92 135.00 127.61 2btm n PRO 30 Ca 0.02 -0.15 -0.39 0.00 -2.02 0.00 0.00 63.50 60.96 2btm n PRO 30 Cb 0.52 -2.16 -0.01 0.00 -0.02 0.00 0.00 33.50 31.83 2btm n PRO 30 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2btm s PRO 31 N -4.24 4.07 0.41 0.52 0.04 -1.26 -4.81 135.00 129.72 2btm s PRO 31 Ca 0.63 2.08 0.20 0.00 0.04 0.00 0.00 61.00 63.95 2btm s PRO 31 Cb -0.22 -2.80 1.15 0.00 0.04 0.00 0.00 34.50 32.67 2btm s PRO 31 CO 0.62 -0.38 1.76 0.00 0.04 0.00 0.00 177.00 179.04 2btm h ALA 32 N 2.81 2.30 0.00 8.56 0.00 -1.89 0.84 119.26 131.88 2btm h ALA 32 Ca -0.49 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2btm h ALA 32 Cb 1.24 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2btm h ALA 32 CO 0.63 -0.72 0.00 0.38 0.00 0.00 0.00 179.25 179.54 2btm h ASP 33 N 0.35 0.00 0.00 0.00 2.03 -2.00 -3.22 116.42 113.58 2btm h ASP 33 Ca 0.61 0.00 -0.36 0.00 -0.73 0.00 0.00 57.03 56.55 2btm h ASP 33 Cb 1.61 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 40.04 2btm h ASP 33 CO -0.29 0.00 -2.35 -0.62 -1.03 0.00 0.00 179.24 174.95 2btm n GLU 34 N -2.38 0.72 -3.75 4.15 1.02 0.24 -5.02 120.64 115.61 2btm n GLU 34 Ca 0.02 0.08 -0.13 0.00 -0.02 0.00 0.00 57.16 57.11 2btm n GLU 34 Cb 0.26 -1.49 -0.10 0.00 -0.02 0.00 0.00 31.44 30.10 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 -2.47 0.02 -0.40 2.62 1.01 -0.90 -4.28 120.40 115.99 2btm s VAL 35 Ca -0.24 -0.17 -0.19 0.00 0.00 0.00 0.00 61.98 61.39 2btm s VAL 35 Cb 0.07 -0.54 0.01 0.00 0.00 0.00 0.00 36.38 35.93 2btm s VAL 35 CO 0.64 -0.09 0.53 -0.63 0.00 0.00 0.00 175.10 175.55 2btm s ILE 36 N -0.36 4.97 -0.32 2.22 -1.09 -0.13 -4.17 121.20 122.33 2btm s ILE 36 Ca -0.05 0.03 -0.11 0.00 -2.23 0.00 0.00 60.65 58.29 2btm s ILE 36 Cb -0.03 -4.07 -0.02 0.00 -1.58 0.00 0.00 42.46 36.76 2btm s ILE 36 CO 0.02 -0.42 0.19 -0.44 -1.23 0.00 0.00 174.94 173.06 2btm s SER 37 N 1.86 5.79 -0.01 3.58 0.01 -1.26 -0.74 113.70 122.93 2btm s SER 37 Ca 0.18 -0.42 0.05 0.00 1.31 0.00 0.00 55.95 57.07 2btm s SER 37 Cb -0.15 -2.07 -0.01 0.00 0.21 0.00 0.00 66.02 64.00 2btm s SER 37 CO 0.15 -0.19 -0.18 -0.69 0.41 0.00 0.00 173.24 172.75 2btm s VAL 38 N 1.67 1.39 -0.19 3.43 1.01 -0.50 -0.92 120.40 126.29 2btm s VAL 38 Ca 0.05 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.28 2btm s VAL 38 Cb -0.17 -1.16 0.04 0.00 0.00 0.00 0.00 36.38 35.09 2btm s VAL 38 CO 0.08 0.39 -0.11 -0.69 0.00 0.00 0.00 175.10 174.77 2btm s VAL 39 N -0.42 1.66 -0.46 2.92 1.01 -0.27 0.79 120.40 125.63 2btm s VAL 39 Ca 0.07 -0.95 -0.13 0.00 0.00 0.00 0.00 61.98 60.97 2btm s VAL 39 Cb -0.07 -1.69 0.08 0.00 0.00 0.00 0.00 36.38 34.71 2btm s VAL 39 CO -0.01 0.24 0.37 0.00 0.00 0.00 0.00 175.10 175.70 2btm s ALA 41 N 1.56 4.21 0.57 0.00 0.00 -1.00 -2.06 121.76 125.06 2btm s ALA 41 Ca 0.04 -1.82 -0.21 0.00 0.00 0.00 0.00 51.96 49.97 2btm s ALA 41 Cb -0.25 -1.12 -0.04 0.00 0.00 0.00 0.00 23.12 21.72 2btm s ALA 41 CO 0.05 -0.30 1.32 -2.14 0.00 0.00 0.00 175.76 174.69 2btm s PRO 42 N -4.21 3.02 0.31 0.00 0.02 -1.26 -4.17 135.00 128.70 2btm s PRO 42 Ca 0.49 2.12 0.06 0.00 0.02 0.00 0.00 61.00 63.69 2btm s PRO 42 Cb -0.04 -2.13 0.83 0.00 0.02 0.00 0.00 34.50 33.18 2btm s PRO 42 CO 0.29 -1.25 1.65 0.74 -0.33 0.00 0.00 177.00 178.10 2btm h PHE 43 N 1.21 0.53 -0.19 6.54 0.04 -1.96 -1.23 116.94 121.88 2btm h PHE 43 Ca -0.51 0.05 0.06 0.00 2.80 0.00 0.00 57.97 60.36 2btm h PHE 43 Cb 1.31 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 39.37 2btm h PHE 43 CO 0.45 -0.21 0.14 -0.07 -0.60 0.00 0.00 178.31 178.03 2btm h LEU 44 N 0.24 0.00 0.00 1.54 3.38 -2.04 -2.96 115.31 115.47 2btm h LEU 44 Ca 0.61 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.58 2btm h LEU 44 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 2btm h LEU 44 CO -0.65 0.00 -1.22 0.49 0.09 0.00 0.00 178.44 177.16 2btm n PHE 45 N -4.40 0.24 -0.26 1.13 3.72 -0.47 -4.55 117.46 112.88 2btm n PHE 45 Ca 0.02 0.07 0.06 0.00 -0.05 0.00 0.00 57.45 57.55 2btm n PHE 45 Cb 0.28 -0.44 0.18 0.00 -0.94 0.00 0.00 39.48 38.56 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 -0.19 0.16 4.37 3.38 -1.46 -0.57 115.31 121.01 2btm h LEU 46 Ca 0.00 0.18 0.02 0.00 0.09 0.00 0.00 57.88 58.16 2btm h LEU 46 Cb 0.78 0.29 -0.04 0.00 0.09 0.00 0.00 40.66 41.78 2btm h LEU 46 CO 0.00 -0.13 -0.38 -0.78 0.09 0.00 0.00 178.44 177.24 2btm h ASP 47 N 0.17 -1.10 -0.14 -0.43 3.58 -1.80 0.15 116.42 116.85 2btm h ASP 47 Ca 0.43 0.12 -0.10 0.00 0.42 0.00 0.00 57.03 57.89 2btm h ASP 47 Cb 0.77 0.41 -0.01 0.00 1.72 0.00 0.00 39.33 42.21 2btm h ASP 47 CO -0.61 -0.47 -0.24 0.03 -2.88 0.00 0.00 179.24 175.07 2btm h ARG 48 N -0.64 0.59 -0.82 0.28 3.08 -1.79 -2.40 114.38 112.68 2btm h ARG 48 Ca 0.02 -0.23 -0.04 0.00 0.07 0.00 0.00 59.98 59.80 2btm h ARG 48 Cb 0.65 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.63 2btm h ARG 48 CO -0.20 0.78 0.37 -0.07 -1.07 0.00 0.00 179.97 179.78 2btm h LEU 49 N 0.52 1.09 -0.62 3.04 4.07 -0.66 0.15 115.31 122.89 2btm h LEU 49 Ca 0.07 -0.14 -0.14 0.00 0.08 0.00 0.00 57.88 57.76 2btm h LEU 49 Cb 0.69 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 2btm h LEU 49 CO 0.05 0.93 -0.39 0.58 -1.08 0.00 0.00 178.44 178.54 2btm h VAL 50 N 1.17 1.29 0.38 1.22 2.07 -0.55 -1.37 116.25 120.47 2btm h VAL 50 Ca 0.28 -1.55 -0.02 0.00 0.82 0.00 0.00 66.70 66.23 2btm h VAL 50 Cb 0.15 1.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 2btm h VAL 50 CO -0.03 0.50 -0.18 -0.61 0.02 0.00 0.00 177.57 177.26 2btm h GLN 51 N 0.54 -0.49 -0.28 1.57 5.75 -0.90 -2.19 115.11 119.12 2btm h GLN 51 Ca 0.05 0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.56 2btm h GLN 51 Cb 0.91 0.11 -0.01 0.00 1.07 0.00 0.00 27.48 29.55 2btm h GLN 51 CO 0.08 -0.28 0.10 0.00 -2.65 0.00 0.00 178.83 176.08 2btm h ALA 52 N 0.03 1.65 -0.01 3.38 0.00 -0.64 -2.58 119.26 121.09 2btm h ALA 52 Ca -0.05 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2btm h ALA 52 Cb 0.43 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2btm h ALA 52 CO 0.08 0.27 -0.11 0.00 0.00 0.00 0.00 179.25 179.49 2btm n ALA 53 N -2.49 2.80 -1.71 0.00 0.00 -0.52 -4.91 120.51 113.68 2btm n ALA 53 Ca 0.01 -0.39 -0.43 0.00 0.00 0.00 0.00 53.44 52.63 2btm n ALA 53 Cb 0.14 -1.19 -0.02 0.00 0.00 0.00 0.00 19.45 18.37 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 -0.36 3.39 -0.07 0.00 2.03 -0.83 -1.92 116.55 118.79 2btm n ASP 54 Ca 0.16 1.13 -0.01 0.00 0.52 0.00 0.00 54.79 56.60 2btm n ASP 54 Cb 0.33 -1.52 -0.00 0.00 -0.72 0.00 0.00 41.12 39.21 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 2.38 0.48 2.93 0.27 0.00 -1.26 -5.03 105.19 104.97 2btm n GLY 55 Ca 0.11 -0.66 -0.23 0.00 0.00 0.00 0.00 46.02 45.24 2btm n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2btm n THR 56 N -2.95 0.00 0.86 2.61 -2.24 -0.81 -5.05 114.28 106.70 2btm n THR 56 Ca -0.01 -2.06 0.11 0.00 -2.27 0.00 0.00 64.05 59.82 2btm n THR 56 Cb 0.04 0.70 0.12 0.00 -2.10 0.00 0.00 70.33 69.09 2btm n THR 56 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2btm n ASP 57 N -1.55 0.64 -4.68 3.42 8.00 -1.26 -4.88 116.55 116.23 2btm n ASP 57 Ca -0.07 -0.36 -0.42 0.00 0.71 0.00 0.00 54.79 54.65 2btm n ASP 57 Cb 0.53 0.52 -0.03 0.00 -0.02 0.00 0.00 41.12 42.13 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 -3.31 4.34 -0.07 0.64 1.98 -1.26 -4.53 118.68 116.47 2btm s LEU 58 Ca 0.08 2.33 -0.03 0.00 -2.89 0.00 0.00 54.13 53.62 2btm s LEU 58 Cb 0.16 -3.56 -0.04 0.00 0.66 0.00 0.00 46.19 43.42 2btm s LEU 58 CO 0.76 -0.84 0.09 -0.54 -1.89 0.00 0.00 176.35 173.93 2btm s LYS 59 N 2.77 3.20 -0.17 1.98 -0.14 -0.10 -4.88 119.74 122.41 2btm s LYS 59 Ca 0.71 -0.32 -0.07 0.00 -1.36 0.00 0.00 55.97 54.92 2btm s LYS 59 Cb -0.36 -2.98 -0.04 0.00 -1.68 0.00 0.00 37.83 32.77 2btm s LYS 59 CO 0.30 0.71 0.07 0.42 -0.76 0.00 0.00 175.35 176.09 2btm s ILE 60 N -1.06 4.86 0.27 2.17 -1.09 -1.26 -1.11 121.20 123.98 2btm s ILE 60 Ca 0.18 -0.01 0.06 0.00 -2.23 0.00 0.00 60.65 58.64 2btm s ILE 60 Cb -0.12 -3.17 -0.06 0.00 -1.58 0.00 0.00 42.46 37.53 2btm s ILE 60 CO 0.08 0.49 -0.04 -0.83 -1.23 0.00 0.00 174.94 173.40 2btm s GLY 61 N 0.09 1.78 0.17 6.18 0.00 0.28 -1.33 107.32 114.49 2btm s GLY 61 Ca 0.06 -1.88 0.05 0.00 0.00 0.00 0.00 44.72 42.95 2btm s GLY 61 CO 0.01 -1.80 0.14 0.00 0.00 0.00 0.00 173.10 171.44 2btm s ALA 62 N -3.11 3.56 -1.58 3.20 0.00 0.53 -2.36 121.76 122.00 2btm s ALA 62 Ca 0.29 -1.23 0.27 0.00 0.00 0.00 0.00 51.96 51.29 2btm s ALA 62 Cb 0.04 -1.35 0.84 0.00 0.00 0.00 0.00 23.12 22.66 2btm s ALA 62 CO 0.11 0.48 1.62 1.04 0.00 0.00 0.00 175.76 179.02 2btm n GLN 63 N -0.40 0.64 -3.61 0.00 6.02 -1.26 -0.52 117.38 118.25 2btm n GLN 63 Ca -0.08 -0.34 0.04 0.00 -0.01 0.00 0.00 57.00 56.61 2btm n GLN 63 Cb 0.55 -1.49 0.01 0.00 1.02 0.00 0.00 30.24 30.32 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 -0.88 0.00 -3.64 5.09 5.66 -1.19 -4.32 114.28 115.00 2btm n THR 64 Ca 0.11 -0.02 0.04 0.00 -3.05 0.00 0.00 64.05 61.13 2btm n THR 64 Cb 0.33 0.41 0.00 0.00 -1.55 0.00 0.00 70.33 69.52 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 0.08 0.58 1.09 0.23 -1.26 -4.84 119.30 113.17 2btm s MET 65 Ca 0.26 -0.04 0.05 0.00 -1.03 0.00 0.00 55.69 54.92 2btm s MET 65 Cb -0.00 0.03 0.07 0.00 -1.53 0.00 0.00 34.83 33.39 2btm s MET 65 CO -0.02 -0.04 0.80 -1.58 -2.03 0.00 0.00 175.02 172.15 2btm s HIS 66 N -2.07 2.06 -0.13 3.16 2.46 0.64 -4.92 115.29 116.49 2btm s HIS 66 Ca 0.18 -0.39 0.18 0.00 0.47 0.00 0.00 55.06 55.50 2btm s HIS 66 Cb 0.06 -2.57 -0.20 0.00 -0.13 0.00 0.00 32.58 29.74 2btm s HIS 66 CO -0.06 -1.09 0.56 1.97 -2.47 0.00 0.00 174.74 173.65 2btm n PHE 67 N -2.34 0.54 -2.37 3.88 1.16 -1.26 -4.28 117.46 112.80 2btm n PHE 67 Ca 0.12 0.18 -0.32 0.00 -1.87 0.00 0.00 57.45 55.56 2btm n PHE 67 Cb 0.60 -0.95 -0.03 0.00 -1.61 0.00 0.00 39.48 37.49 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 -2.92 3.00 0.20 1.98 0.00 -1.26 -4.75 121.76 118.00 2btm s ALA 68 Ca -0.06 0.25 0.16 0.00 0.00 0.00 0.00 51.96 52.31 2btm s ALA 68 Cb 0.09 -3.15 0.56 0.00 0.00 0.00 0.00 23.12 20.62 2btm s ALA 68 CO 0.83 -0.32 1.69 -0.44 0.00 0.00 0.00 175.76 177.52 2btm h ASP 69 N 0.92 0.00 -5.60 0.00 3.32 -1.98 -3.38 116.42 109.69 2btm h ASP 69 Ca -0.47 0.00 0.31 0.00 0.02 0.00 0.00 57.03 56.89 2btm h ASP 69 Cb 1.19 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.62 2btm h ASP 69 CO 0.61 0.46 0.80 0.00 -1.72 0.00 0.00 179.24 179.39 2btm s GLN 70 N -3.60 0.45 0.00 3.56 -2.07 -1.26 -4.62 119.66 112.12 2btm s GLN 70 Ca -0.00 -0.24 0.00 0.00 -1.82 0.00 0.00 55.36 53.29 2btm s GLN 70 Cb 0.12 0.16 0.00 0.00 -1.09 0.00 0.00 33.01 32.19 2btm s GLN 70 CO 0.71 -0.20 0.00 0.41 -1.32 0.00 0.00 175.29 174.89 2btm n GLY 71 N -0.45 -0.02 3.32 2.60 0.00 -1.26 -4.98 105.19 104.40 2btm n GLY 71 Ca -0.08 -1.75 -0.41 0.00 0.00 0.00 0.00 46.02 43.78 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 -0.71 3.84 -3.24 4.61 0.00 -1.26 -4.68 120.51 119.07 2btm n ALA 72 Ca 0.00 -3.71 -0.25 0.00 0.00 0.00 0.00 53.44 49.48 2btm n ALA 72 Cb 0.00 -3.58 -0.07 0.00 0.00 0.00 0.00 19.45 15.80 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 8.51 -0.02 -1.61 0.00 4.01 -1.26 -5.11 117.16 121.68 2btm n TYR 73 Ca 0.49 -3.60 -0.53 0.00 -0.16 0.00 0.00 57.90 54.10 2btm n TYR 73 Cb 0.44 -0.31 -0.06 0.00 -0.31 0.00 0.00 39.34 39.10 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 1.51 0.06 0.00 -0.72 -1.04 -1.26 -1.02 114.28 111.81 2btm n THR 74 Ca 0.23 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.23 2btm n THR 74 Cb 0.51 -0.88 0.00 0.00 -1.82 0.00 0.00 70.33 68.14 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 2.82 2.66 3.87 3.41 0.00 -1.26 -5.04 105.19 111.64 2btm n GLY 75 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.49 3.84 -0.12 1.61 0.41 -0.18 -5.08 118.70 118.69 2btm s GLU 76 Ca 0.00 0.55 0.01 0.00 -0.41 0.00 0.00 54.97 55.12 2btm s GLU 76 Cb 0.00 -2.38 -0.01 0.00 -1.78 0.00 0.00 34.13 29.96 2btm s GLU 76 CO 0.00 -0.01 -0.15 0.08 -0.49 0.00 0.00 175.26 174.69 2btm s VAL 77 N -2.30 2.89 0.35 2.63 1.01 -1.26 -4.97 120.40 118.74 2btm s VAL 77 Ca 0.52 -0.73 -0.07 0.00 0.00 0.00 0.00 61.98 61.71 2btm s VAL 77 Cb -0.10 -2.19 -0.05 0.00 0.00 0.00 0.00 36.38 34.03 2btm s VAL 77 CO 0.28 0.54 0.65 -0.94 0.00 0.00 0.00 175.10 175.63 2btm s SER 78 N 0.25 6.46 0.46 3.32 1.04 -1.26 -0.26 113.70 123.70 2btm s SER 78 Ca -0.10 0.87 0.13 0.00 0.48 0.00 0.00 55.95 57.34 2btm s SER 78 Cb -0.16 -2.21 1.03 0.00 0.10 0.00 0.00 66.02 64.78 2btm s SER 78 CO 0.06 -0.30 2.03 1.55 0.98 0.00 0.00 173.24 177.56 2btm h PRO 79 N 1.40 0.09 -0.06 4.02 0.13 -1.74 -1.74 132.00 134.09 2btm h PRO 79 Ca -0.47 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2btm h PRO 79 Cb 1.19 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 2btm h PRO 79 CO 0.65 0.18 0.03 0.28 -0.23 0.00 0.00 178.00 178.91 2btm h VAL 80 N 0.09 1.07 -0.92 1.56 2.07 -1.87 0.17 116.25 118.42 2btm h VAL 80 Ca 0.02 -0.21 0.06 0.00 0.82 0.00 0.00 66.70 67.40 2btm h VAL 80 Cb 0.20 1.10 -0.06 0.00 -1.52 0.00 0.00 31.29 31.01 2btm h VAL 80 CO 0.01 0.06 0.58 0.24 0.02 0.00 0.00 177.57 178.49 2btm h MET 81 N 0.02 1.03 -0.14 1.57 2.86 -1.69 0.10 114.93 118.68 2btm h MET 81 Ca 0.02 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 57.55 2btm h MET 81 Cb 0.07 -0.23 -0.00 0.00 0.06 0.00 0.00 31.60 31.50 2btm h MET 81 CO -0.00 0.68 -0.11 -0.07 1.06 0.00 0.00 176.91 178.46 2btm h LEU 82 N 1.06 0.33 -0.00 1.22 3.38 -0.90 -2.20 115.31 118.20 2btm h LEU 82 Ca 0.40 -0.46 0.01 0.00 0.09 0.00 0.00 57.88 57.92 2btm h LEU 82 Cb 0.18 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2btm h LEU 82 CO -0.18 0.72 -0.03 0.50 0.09 0.00 0.00 178.44 179.54 2btm h LYS 83 N -0.05 -0.06 -0.93 1.13 3.11 -0.41 -1.77 116.57 117.59 2btm h LYS 83 Ca 0.02 0.00 0.15 0.00 -2.81 0.00 0.00 60.65 58.02 2btm h LYS 83 Cb 0.62 0.01 -0.08 0.00 -1.00 0.00 0.00 32.23 31.79 2btm h LYS 83 CO 0.03 -0.04 0.59 0.22 -2.81 0.00 0.00 179.45 177.44 2btm h ASP 84 N -0.06 0.71 0.84 4.20 3.58 -0.99 -0.35 116.42 124.35 2btm h ASP 84 Ca 0.02 0.05 -0.05 0.00 0.42 0.00 0.00 57.03 57.47 2btm h ASP 84 Cb 0.08 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.03 2btm h ASP 84 CO -0.04 0.35 -0.22 0.25 -2.88 0.00 0.00 179.24 176.70 2btm h LEU 85 N 0.74 0.00 0.00 2.28 6.46 -0.85 -3.46 115.31 120.48 2btm h LEU 85 Ca 0.47 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 58.23 2btm h LEU 85 Cb 0.72 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.65 2btm h LEU 85 CO -0.24 0.22 0.00 0.61 -0.62 0.00 0.00 178.44 178.41 2btm n GLY 86 N 0.04 1.18 3.76 3.75 0.00 -0.14 -4.93 105.19 108.85 2btm n GLY 86 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 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 3.66 -0.07 1.61 1.01 -0.72 -4.82 120.40 119.07 2btm s VAL 87 Ca 0.00 1.57 0.07 0.00 0.00 0.00 0.00 61.98 63.62 2btm s VAL 87 Cb 0.00 -3.97 -0.10 0.00 0.00 0.00 0.00 36.38 32.32 2btm s VAL 87 CO 0.00 0.31 0.03 0.35 0.00 0.00 0.00 175.10 175.79 2btm n THR 88 N 0.97 0.51 -4.36 3.92 -2.24 -0.44 -4.42 114.28 108.22 2btm n THR 88 Ca 0.00 -0.32 -0.24 0.00 -2.27 0.00 0.00 64.05 61.21 2btm n THR 88 Cb 0.46 -0.76 -0.09 0.00 -2.10 0.00 0.00 70.33 67.85 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 -2.20 2.53 -0.15 4.78 1.51 -1.18 0.04 117.35 122.68 2btm s TYR 89 Ca -0.04 -0.27 -0.08 0.00 -1.01 0.00 0.00 57.07 55.68 2btm s TYR 89 Cb 0.02 -1.15 0.06 0.00 -0.11 0.00 0.00 41.96 40.78 2btm s TYR 89 CO 0.32 0.61 0.36 0.54 -1.11 0.00 0.00 175.55 176.27 2btm s VAL 90 N -2.17 -0.05 -0.00 0.71 0.11 -0.64 -0.35 120.40 118.01 2btm s VAL 90 Ca 0.28 0.11 -0.26 0.00 -2.93 0.00 0.00 61.98 59.18 2btm s VAL 90 Cb -0.07 -0.55 -0.04 0.00 -1.53 0.00 0.00 36.38 34.20 2btm s VAL 90 CO 0.16 0.05 0.82 -0.63 -3.33 0.00 0.00 175.10 172.17 2btm s ILE 91 N 1.41 4.87 -0.01 7.04 1.01 0.32 -0.88 121.20 134.95 2btm s ILE 91 Ca -0.09 1.73 0.05 0.00 0.00 0.00 0.00 60.65 62.34 2btm s ILE 91 Cb -0.09 -4.17 -0.01 0.00 0.01 0.00 0.00 42.46 38.20 2btm s ILE 91 CO -0.12 0.26 -0.15 -0.76 0.00 0.00 0.00 174.94 174.17 2btm s LEU 92 N 0.59 2.02 -1.14 2.97 1.43 0.10 -3.16 118.68 121.49 2btm s LEU 92 Ca 0.43 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 53.25 2btm s LEU 92 Cb -0.20 -0.79 0.00 0.00 0.03 0.00 0.00 46.19 45.24 2btm s LEU 92 CO 0.23 0.18 0.00 0.61 0.23 0.00 0.00 176.35 177.60 2btm n GLY 93 N 2.75 0.57 3.73 -3.19 0.00 -1.26 -0.53 105.19 107.25 2btm n GLY 93 Ca -0.15 -0.43 -0.42 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 -3.35 2.68 -0.17 1.61 -0.00 -1.26 -4.36 115.22 110.37 2btm n HIS 94 Ca -0.13 0.39 0.25 0.00 0.46 0.00 0.00 57.72 58.68 2btm n HIS 94 Cb 0.50 -2.53 0.66 0.00 -0.12 0.00 0.00 29.99 28.51 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 3.80 0.11 -0.80 0.26 4.64 -1.93 0.11 113.55 119.74 2btm h SER 95 Ca -0.47 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2btm h SER 95 Cb 1.25 -0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 63.29 2btm h SER 95 CO 0.72 0.04 0.50 -0.33 -0.87 0.00 0.00 176.83 176.89 2btm h GLU 96 N 0.11 1.07 0.05 4.77 5.08 -1.99 0.16 114.58 123.84 2btm h GLU 96 Ca 0.41 -0.08 -0.25 0.00 -1.00 0.00 0.00 59.36 58.44 2btm h GLU 96 Cb 1.46 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 2btm h GLU 96 CO -0.05 0.73 -1.23 0.00 -1.00 0.00 0.00 179.01 177.46 2btm h ARG 97 N 1.10 0.12 -0.12 2.33 3.08 -1.16 -2.25 114.38 117.48 2btm h ARG 97 Ca 0.29 -0.20 -0.08 0.00 0.07 0.00 0.00 59.98 60.06 2btm h ARG 97 Cb -0.08 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2btm h ARG 97 CO -0.06 1.03 -0.30 0.00 -1.07 0.00 0.00 179.97 179.57 2btm h ARG 98 N 0.03 0.22 0.09 0.04 3.08 -0.84 -0.49 114.38 116.51 2btm h ARG 98 Ca -0.11 -0.08 -0.31 0.00 0.07 0.00 0.00 59.98 59.55 2btm h ARG 98 Cb 1.89 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.91 2btm h ARG 98 CO 0.15 0.51 -1.62 1.96 -1.07 0.00 0.00 179.97 179.90 2btm h GLN 99 N 0.20 0.18 0.00 0.04 4.20 -0.72 -3.37 115.11 115.63 2btm h GLN 99 Ca 0.03 -0.31 -0.06 0.00 0.06 0.00 0.00 58.65 58.36 2btm h GLN 99 Cb 0.64 0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 2btm h GLN 99 CO 0.05 0.99 -1.49 -1.33 -0.67 0.00 0.00 178.83 176.38 2btm n MET 100 N -3.36 1.16 -0.83 1.46 2.81 -0.85 -4.75 117.12 112.76 2btm n MET 100 Ca -0.18 -0.05 -0.00 0.00 -1.81 0.00 0.00 57.70 55.65 2btm n MET 100 Cb 1.04 -1.22 0.18 0.00 -0.71 0.00 0.00 33.22 32.51 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 -2.01 0.61 -2.33 2.03 3.72 -0.23 -4.97 117.46 114.28 2btm n PHE 101 Ca -0.06 -1.63 -0.19 0.00 -0.05 0.00 0.00 57.45 55.51 2btm n PHE 101 Cb 0.45 -0.33 -0.02 0.00 -0.94 0.00 0.00 39.48 38.64 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 -1.07 -0.62 -2.49 4.37 0.00 -1.19 -4.93 120.51 114.59 2btm n ALA 102 Ca 0.26 0.17 -0.43 0.00 0.00 0.00 0.00 53.44 53.44 2btm n ALA 102 Cb 0.80 -2.06 -0.02 0.00 0.00 0.00 0.00 19.45 18.17 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 -4.91 4.32 0.44 0.00 2.56 -0.99 -5.00 118.70 115.11 2btm s GLU 103 Ca 0.00 1.61 0.06 0.00 0.00 0.00 0.00 54.97 56.65 2btm s GLU 103 Cb 0.00 -3.62 -0.04 0.00 2.00 0.00 0.00 34.13 32.47 2btm s GLU 103 CO 0.00 -0.52 0.17 0.95 -0.56 0.00 0.00 175.26 175.30 2btm s THR 104 N 2.63 2.09 0.32 -1.70 -4.23 -1.26 -4.31 115.64 109.18 2btm s THR 104 Ca 0.54 -1.74 0.01 0.00 -1.18 0.00 0.00 61.69 59.31 2btm s THR 104 Cb -0.22 -2.83 0.21 0.00 1.34 0.00 0.00 72.50 71.00 2btm s THR 104 CO 0.18 0.00 1.93 0.44 -0.54 0.00 0.00 174.62 176.63 2btm h ASP 105 N 1.39 0.74 -0.22 3.99 3.32 -1.97 0.15 116.42 123.82 2btm h ASP 105 Ca -0.42 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.55 2btm h ASP 105 Cb 1.26 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.61 2btm h ASP 105 CO 0.70 0.62 0.10 -0.08 -1.72 0.00 0.00 179.24 178.87 2btm h GLU 106 N 0.82 0.32 -0.00 3.56 4.57 -1.95 0.85 114.58 122.74 2btm h GLU 106 Ca 0.21 -0.05 -0.13 0.00 -1.18 0.00 0.00 59.36 58.20 2btm h GLU 106 Cb 0.08 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 2btm h GLU 106 CO -0.03 0.35 -0.62 1.79 -1.18 0.00 0.00 179.01 179.32 2btm h THR 107 N 0.21 1.44 -0.30 0.32 1.35 -1.84 -1.51 112.91 112.58 2btm h THR 107 Ca 0.07 -2.11 -0.04 0.00 -0.55 0.00 0.00 66.41 63.78 2btm h THR 107 Cb 0.14 2.13 -0.01 0.00 -1.73 0.00 0.00 68.15 68.69 2btm h THR 107 CO -0.01 0.60 0.03 0.58 -0.25 0.00 0.00 175.52 176.48 2btm h VAL 108 N 0.01 1.24 -0.48 6.82 2.07 -0.45 -0.74 116.25 124.73 2btm h VAL 108 Ca -0.01 -0.85 0.01 0.00 0.82 0.00 0.00 66.70 66.67 2btm h VAL 108 Cb 1.10 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 2btm h VAL 108 CO 0.08 0.28 0.31 -1.13 0.02 0.00 0.00 177.57 177.13 2btm h ASN 109 N 0.32 0.54 -0.66 0.57 -0.00 -0.63 0.19 115.58 115.91 2btm h ASN 109 Ca 0.09 -0.01 0.02 0.00 -0.00 0.00 0.00 56.30 56.40 2btm h ASN 109 Cb 0.38 -0.13 -0.04 0.00 -0.00 0.00 0.00 38.32 38.52 2btm h ASN 109 CO 0.01 0.39 0.42 0.11 -0.00 0.00 0.00 177.43 178.36 2btm h LYS 110 N 0.64 0.82 -0.50 6.67 1.57 -1.08 -1.31 116.57 123.38 2btm h LYS 110 Ca 0.18 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.81 2btm h LYS 110 Cb -0.07 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.04 2btm h LYS 110 CO -0.04 0.54 -0.09 0.87 -0.57 0.00 0.00 179.45 180.16 2btm h LYS 111 N 0.84 0.90 -0.52 3.15 1.57 -0.59 -0.42 116.57 121.50 2btm h LYS 111 Ca 0.26 -0.30 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2btm h LYS 111 Cb -0.03 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 2btm h LYS 111 CO -0.09 0.94 0.25 0.28 -0.57 0.00 0.00 179.45 180.27 2btm h VAL 112 N 0.81 1.20 -0.54 0.50 2.07 -0.13 0.33 116.25 120.49 2btm h VAL 112 Ca 0.14 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 2btm h VAL 112 Cb 0.60 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 2btm h VAL 112 CO 0.04 0.22 0.25 -0.07 0.02 0.00 0.00 177.57 178.03 2btm h LEU 113 N 0.69 0.70 -1.16 2.57 3.38 -1.05 -2.42 115.31 118.03 2btm h LEU 113 Ca 0.18 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2btm h LEU 113 Cb 0.12 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2btm h LEU 113 CO -0.02 0.64 0.29 0.00 0.09 0.00 0.00 178.44 179.44 2btm h ALA 114 N 1.09 1.35 0.22 1.53 0.00 -0.51 -1.47 119.26 121.47 2btm h ALA 114 Ca 0.18 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2btm h ALA 114 Cb 0.13 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2btm h ALA 114 CO -0.02 0.51 -0.11 0.00 0.00 0.00 0.00 179.25 179.63 2btm h ALA 115 N 1.44 -0.30 0.00 0.00 0.00 0.10 -0.77 119.26 119.74 2btm h ALA 115 Ca 0.22 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2btm h ALA 115 Cb 0.10 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2btm h ALA 115 CO -0.03 -0.66 -0.26 0.74 0.00 0.00 0.00 179.25 179.05 2btm h PHE 116 N -0.32 0.00 -0.02 0.00 0.04 -1.25 -0.66 116.94 114.73 2btm h PHE 116 Ca -0.03 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.61 2btm h PHE 116 Cb 0.24 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.38 2btm h PHE 116 CO -0.06 0.26 -0.58 1.15 -0.60 0.00 0.00 178.31 178.48 2btm h THR 117 N 0.00 1.40 -0.57 -1.55 2.02 -0.88 -3.21 112.91 110.13 2btm h THR 117 Ca -0.00 -1.96 0.00 0.00 0.77 0.00 0.00 66.41 65.22 2btm h THR 117 Cb 0.48 2.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.93 2btm h THR 117 CO 0.03 0.57 0.00 0.54 0.37 0.00 0.00 175.52 177.03 2btm n ARG 118 N -3.87 2.95 -2.20 6.66 5.12 -0.33 -4.98 116.66 120.01 2btm n ARG 118 Ca -0.02 -2.50 -0.05 0.00 -1.93 0.00 0.00 57.85 53.36 2btm n ARG 118 Cb 0.58 -1.53 0.00 0.00 -1.16 0.00 0.00 32.46 30.36 2btm n ARG 118 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2btm n GLY 119 N 1.07 0.24 3.45 -0.13 0.00 -0.63 -4.78 105.19 104.42 2btm n GLY 119 Ca 0.20 -0.65 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.57 2.61 -0.18 0.99 1.43 -0.35 -4.93 118.68 116.69 2btm s LEU 120 Ca 0.02 -0.32 -0.24 0.00 -1.03 0.00 0.00 54.13 52.57 2btm s LEU 120 Cb -0.01 -1.52 -0.02 0.00 0.03 0.00 0.00 46.19 44.67 2btm s LEU 120 CO 0.03 0.31 0.77 -0.63 0.23 0.00 0.00 176.35 177.05 2btm s ILE 121 N -0.80 4.92 -0.04 -0.59 -1.09 0.11 -4.00 121.20 119.71 2btm s ILE 121 Ca 0.13 1.48 -0.18 0.00 -2.23 0.00 0.00 60.65 59.85 2btm s ILE 121 Cb -0.10 -4.07 -0.05 0.00 -1.58 0.00 0.00 42.46 36.65 2btm s ILE 121 CO 0.02 0.05 0.50 -2.16 -1.23 0.00 0.00 174.94 172.11 2btm s PRO 122 N 2.13 4.20 -0.50 2.79 0.04 -1.26 -1.62 135.00 140.79 2btm s PRO 122 Ca 0.35 0.54 -0.08 0.00 0.04 0.00 0.00 61.00 61.84 2btm s PRO 122 Cb -0.16 -3.33 0.13 0.00 0.04 0.00 0.00 34.50 31.17 2btm s PRO 122 CO 0.11 0.41 0.37 0.42 0.04 0.00 0.00 177.00 178.35 2btm s ILE 123 N -0.23 4.17 -0.25 0.56 1.01 -0.06 -1.20 121.20 125.20 2btm s ILE 123 Ca 0.27 -1.95 -0.23 0.00 0.00 0.00 0.00 60.65 58.75 2btm s ILE 123 Cb -0.17 -3.75 -0.01 0.00 0.01 0.00 0.00 42.46 38.55 2btm s ILE 123 CO 0.14 -0.79 0.73 -0.63 0.00 0.00 0.00 174.94 174.39 2btm s ILE 124 N 1.16 4.91 -0.05 2.92 1.01 0.19 -0.72 121.20 130.61 2btm s ILE 124 Ca 0.08 1.36 -0.16 0.00 0.00 0.00 0.00 60.65 61.93 2btm s ILE 124 Cb -0.25 -4.03 -0.05 0.00 0.01 0.00 0.00 42.46 38.14 2btm s ILE 124 CO -0.02 -0.02 0.42 0.00 0.00 0.00 0.00 174.94 175.32 2btm n GLY 127 N 0.34 2.25 3.94 0.00 0.00 -1.26 -0.08 105.19 110.38 2btm n GLY 127 Ca -0.16 -0.33 -0.24 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.79 3.50 0.73 1.61 1.03 -1.26 -4.67 118.70 117.84 2btm s GLU 128 Ca 0.00 -0.28 -0.03 0.00 0.03 0.00 0.00 54.97 54.70 2btm s GLU 128 Cb 0.00 -2.64 0.12 0.00 -0.80 0.00 0.00 34.13 30.81 2btm s GLU 128 CO 0.00 0.13 1.01 -1.54 -1.33 0.00 0.00 175.26 173.53 2btm s SER 129 N -3.99 4.31 0.08 0.83 1.04 -1.26 -0.68 113.70 114.03 2btm s SER 129 Ca 0.41 -0.23 -0.23 0.00 0.48 0.00 0.00 55.95 56.38 2btm s SER 129 Cb -0.10 -0.17 -0.16 0.00 0.10 0.00 0.00 66.02 65.70 2btm s SER 129 CO 0.36 -1.89 1.69 0.25 0.98 0.00 0.00 173.24 174.64 2btm h LEU 130 N -0.61 -0.02 -0.52 2.42 5.85 -1.98 -0.40 115.31 120.05 2btm h LEU 130 Ca -0.38 -0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.35 2btm h LEU 130 Cb 1.27 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.25 2btm h LEU 130 CO 0.42 0.03 0.24 -0.33 -0.34 0.00 0.00 178.44 178.46 2btm h GLU 131 N -0.06 0.45 -0.66 1.25 3.07 -1.98 0.22 114.58 116.87 2btm h GLU 131 Ca -0.00 -0.03 -0.07 0.00 -0.50 0.00 0.00 59.36 58.76 2btm h GLU 131 Cb 0.06 -0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 27.84 2btm h GLU 131 CO 0.00 0.30 0.13 0.93 -1.40 0.00 0.00 179.01 178.97 2btm h GLU 132 N 0.46 1.07 -0.15 2.33 5.08 -1.90 -0.52 114.58 120.95 2btm h GLU 132 Ca 0.24 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2btm h GLU 132 Cb 0.20 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2btm h GLU 132 CO -0.20 0.97 0.07 -0.09 -1.00 0.00 0.00 179.01 178.76 2btm h ARG 133 N 1.01 0.22 0.00 2.33 9.65 -0.14 0.64 114.38 128.09 2btm h ARG 133 Ca 0.21 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 59.05 2btm h ARG 133 Cb 0.40 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 28.94 2btm h ARG 133 CO 0.01 0.27 -0.03 0.93 2.80 0.00 0.00 179.97 183.95 2btm h GLU 134 N 0.11 0.00 -0.19 0.20 5.08 -0.30 -0.83 114.58 118.65 2btm h GLU 134 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2btm h GLU 134 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2btm h GLU 134 CO -0.01 0.03 0.00 0.00 -1.00 0.00 0.00 179.01 178.03 2btm n ALA 135 N -2.12 2.50 -2.85 3.43 0.00 -0.23 -4.92 120.51 116.33 2btm n ALA 135 Ca -0.01 -0.59 -0.18 0.00 0.00 0.00 0.00 53.44 52.66 2btm n ALA 135 Cb 0.25 -1.05 0.03 0.00 0.00 0.00 0.00 19.45 18.68 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 1.19 -0.31 0.80 0.00 0.00 -0.32 -4.90 105.19 101.66 2btm n GLY 136 Ca 0.17 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.22 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 -3.40 2.15 -0.22 1.61 6.02 0.17 -4.72 117.38 118.99 2btm n GLN 137 Ca -0.10 -1.94 -0.11 0.00 -0.01 0.00 0.00 57.00 54.84 2btm n GLN 137 Cb 0.60 -1.35 -0.07 0.00 1.02 0.00 0.00 30.24 30.44 2btm n GLN 137 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 2btm h THR 138 N 2.98 0.03 -0.82 5.09 2.02 -1.84 1.00 112.91 121.36 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 0.76 0.03 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 2btm h THR 138 CO 0.00 0.00 0.51 0.78 0.37 0.00 0.00 175.52 177.18 2btm h ASN 139 N -0.25 0.97 -0.24 4.18 -0.26 -1.95 -0.48 115.58 117.55 2btm h ASN 139 Ca 0.13 -0.05 -0.08 0.00 -0.56 0.00 0.00 56.30 55.74 2btm h ASN 139 Cb 0.55 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 37.56 2btm h ASN 139 CO -0.71 0.74 -0.18 0.00 -1.06 0.00 0.00 177.43 176.22 2btm h ALA 140 N 1.43 0.35 0.11 -0.83 0.00 -1.70 -0.04 119.26 118.58 2btm h ALA 140 Ca 0.30 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2btm h ALA 140 Cb -0.07 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2btm h ALA 140 CO -0.06 0.27 -0.05 0.28 0.00 0.00 0.00 179.25 179.69 2btm h VAL 141 N 0.26 0.95 -0.44 0.00 2.07 -0.55 -0.66 116.25 117.88 2btm h VAL 141 Ca 0.05 -0.18 -0.05 0.00 0.82 0.00 0.00 66.70 67.33 2btm h VAL 141 Cb 0.71 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 2btm h VAL 141 CO 0.05 0.05 0.07 0.58 0.02 0.00 0.00 177.57 178.33 2btm h VAL 142 N -0.23 1.21 -0.12 2.57 2.07 -1.11 -1.45 116.25 119.19 2btm h VAL 142 Ca -0.01 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.70 2btm h VAL 142 Cb 0.18 0.80 -0.00 0.00 -1.52 0.00 0.00 31.29 30.75 2btm h VAL 142 CO 0.02 0.28 0.01 0.00 0.02 0.00 0.00 177.57 177.91 2btm h ALA 143 N 1.43 0.17 -0.75 1.67 0.00 -0.76 -1.76 119.26 119.26 2btm h ALA 143 Ca 0.14 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.91 2btm h ALA 143 Cb 0.30 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2btm h ALA 143 CO 0.00 -0.16 0.48 1.03 0.00 0.00 0.00 179.25 180.60 2btm h SER 144 N -0.04 0.79 -0.37 0.00 0.87 -0.83 0.44 113.55 114.41 2btm h SER 144 Ca 0.04 -0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.50 2btm h SER 144 Cb 0.33 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 2btm h SER 144 CO 0.00 0.55 -0.11 1.56 -0.53 0.00 0.00 176.83 178.31 2btm h GLN 145 N 0.94 0.73 -0.56 2.24 4.20 -1.19 -1.82 115.11 119.64 2btm h GLN 145 Ca 0.30 -0.29 -0.08 0.00 0.06 0.00 0.00 58.65 58.64 2btm h GLN 145 Cb -0.00 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 2btm h GLN 145 CO -0.10 0.89 0.05 0.28 -0.67 0.00 0.00 178.83 179.27 2btm h VAL 146 N 0.53 1.26 -0.11 -0.54 2.07 -1.08 -0.55 116.25 117.84 2btm h VAL 146 Ca 0.09 -1.05 -0.00 0.00 0.82 0.00 0.00 66.70 66.56 2btm h VAL 146 Cb 0.63 0.83 -0.00 0.00 -1.52 0.00 0.00 31.29 31.22 2btm h VAL 146 CO 0.04 0.38 0.05 -0.33 0.02 0.00 0.00 177.57 177.73 2btm h GLU 147 N 0.85 0.15 -0.24 1.57 5.08 -0.84 -1.72 114.58 119.43 2btm h GLU 147 Ca 0.17 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.39 2btm h GLU 147 Cb 0.48 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2btm h GLU 147 CO 0.02 0.22 -0.33 0.87 -1.00 0.00 0.00 179.01 178.80 2btm h LYS 148 N 0.04 0.51 -0.34 2.33 1.57 -1.27 -2.32 116.57 117.09 2btm h LYS 148 Ca 0.04 -0.22 -0.08 0.00 -1.87 0.00 0.00 60.65 58.51 2btm h LYS 148 Cb 0.12 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 2btm h LYS 148 CO -0.00 0.78 -0.11 0.00 -0.57 0.00 0.00 179.45 179.54 2btm h ALA 149 N 1.21 0.47 -0.01 3.86 0.00 -0.96 -3.15 119.26 120.68 2btm h ALA 149 Ca 0.05 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2btm h ALA 149 Cb 0.79 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2btm h ALA 149 CO 0.06 0.34 -0.11 1.28 0.00 0.00 0.00 179.25 180.83 2btm n LEU 150 N -4.39 0.67 -4.68 0.00 4.77 -0.66 -4.42 117.00 108.30 2btm n LEU 150 Ca -0.02 -0.11 -0.48 0.00 -0.03 0.00 0.00 56.01 55.36 2btm n LEU 150 Cb 0.36 -0.13 -0.05 0.00 -2.33 0.00 0.00 43.42 41.28 2btm n LEU 150 CO 0.42 0.12 1.39 0.00 -1.33 0.00 0.00 177.39 177.99 2btm n ALA 151 N -0.74 0.97 0.00 -1.18 0.00 -0.88 -1.84 120.51 116.85 2btm n ALA 151 Ca 0.16 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.93 2btm n ALA 151 Cb 0.28 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.29 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 4.08 0.35 3.92 0.00 0.00 -1.26 -4.95 105.19 107.32 2btm n GLY 152 Ca 0.21 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.96 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 3.83 0.32 0.99 1.43 -0.77 -5.08 118.68 119.40 2btm s LEU 153 Ca 0.00 0.75 -0.01 0.00 -1.03 0.00 0.00 54.13 53.84 2btm s LEU 153 Cb 0.00 -3.65 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 2btm s LEU 153 CO 0.00 -0.42 0.54 0.42 0.23 0.00 0.00 176.35 177.12 2btm s THR 154 N -2.48 5.09 0.39 5.49 -4.23 -1.26 -4.94 115.64 113.70 2btm s THR 154 Ca 0.45 -0.31 0.09 0.00 -1.18 0.00 0.00 61.69 60.73 2btm s THR 154 Cb -0.10 -3.82 0.30 0.00 1.34 0.00 0.00 72.50 70.22 2btm s THR 154 CO 0.39 -0.47 1.98 -0.65 -0.54 0.00 0.00 174.62 175.33 2btm h PRO 155 N 1.10 0.59 -0.60 3.99 0.11 -1.97 -1.27 132.00 133.96 2btm h PRO 155 Ca -0.49 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 2btm h PRO 155 Cb 1.21 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 2btm h PRO 155 CO 0.63 0.39 0.30 0.93 -0.21 0.00 0.00 178.00 180.04 2btm h GLU 156 N 0.60 0.83 -0.00 1.05 5.08 -1.95 -2.39 114.58 117.80 2btm h GLU 156 Ca 0.28 -0.10 -0.24 0.00 -1.00 0.00 0.00 59.36 58.30 2btm h GLU 156 Cb 0.31 -0.16 0.02 0.00 0.50 0.00 0.00 28.75 29.41 2btm h GLU 156 CO -0.08 0.63 -0.93 1.96 -1.00 0.00 0.00 179.01 179.58 2btm h GLN 157 N 0.83 0.64 -0.71 2.33 4.20 -1.66 -3.18 115.11 117.56 2btm h GLN 157 Ca 0.21 -0.68 0.12 0.00 0.06 0.00 0.00 58.65 58.35 2btm h GLN 157 Cb 0.06 0.19 -0.05 0.00 0.30 0.00 0.00 27.48 27.99 2btm h GLN 157 CO -0.03 1.28 0.47 0.28 -0.67 0.00 0.00 178.83 180.16 2btm h VAL 158 N 0.28 0.87 -0.56 -0.54 2.07 -1.01 0.24 116.25 117.60 2btm h VAL 158 Ca -0.12 -0.17 0.06 0.00 0.82 0.00 0.00 66.70 67.29 2btm h VAL 158 Cb 1.60 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 2btm h VAL 158 CO 0.18 0.09 0.37 0.11 0.02 0.00 0.00 177.57 178.34 2btm h LYS 159 N 0.49 0.52 0.00 1.57 1.57 -1.41 -1.91 116.57 117.40 2btm h LYS 159 Ca 0.34 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 2btm h LYS 159 Cb 0.64 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.83 2btm h LYS 159 CO -0.11 0.34 -0.69 1.04 -0.57 0.00 0.00 179.45 179.46 2btm n GLN 160 N -4.47 0.21 -1.96 3.15 3.00 0.01 -3.86 117.38 113.46 2btm n GLN 160 Ca 0.08 0.04 -0.34 0.00 -0.01 0.00 0.00 57.00 56.77 2btm n GLN 160 Cb 0.23 -1.61 0.03 0.00 0.00 0.00 0.00 30.24 28.89 2btm n GLN 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2btm s ALA 161 N -3.13 2.57 -0.13 -1.58 0.00 -0.72 -4.72 121.76 114.06 2btm s ALA 161 Ca 0.07 0.65 0.02 0.00 0.00 0.00 0.00 51.96 52.69 2btm s ALA 161 Cb 0.15 -3.33 0.01 0.00 0.00 0.00 0.00 23.12 19.95 2btm s ALA 161 CO 0.74 -1.06 -0.17 0.08 0.00 0.00 0.00 175.76 175.34 2btm s VAL 162 N -2.12 1.68 -0.15 0.00 1.01 -0.34 -3.66 120.40 116.81 2btm s VAL 162 Ca 0.69 -0.74 -0.05 0.00 0.00 0.00 0.00 61.98 61.88 2btm s VAL 162 Cb -0.22 -1.53 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 2btm s VAL 162 CO 0.36 0.48 0.01 -0.51 0.00 0.00 0.00 175.10 175.44 2btm s ILE 163 N 1.02 4.36 -0.31 2.22 1.10 -0.66 0.55 121.20 129.47 2btm s ILE 163 Ca -0.05 -0.20 -0.02 0.00 -0.51 0.00 0.00 60.65 59.88 2btm s ILE 163 Cb -0.15 -2.92 0.06 0.00 0.15 0.00 0.00 42.46 39.60 2btm s ILE 163 CO -0.03 0.50 0.02 0.00 -2.11 0.00 0.00 174.94 173.32 2btm s ALA 164 N 0.10 2.85 -0.28 1.50 0.00 0.20 -0.04 121.76 126.08 2btm s ALA 164 Ca 0.02 -1.84 -0.27 0.00 0.00 0.00 0.00 51.96 49.88 2btm s ALA 164 Cb -0.13 -1.98 0.01 0.00 0.00 0.00 0.00 23.12 21.02 2btm s ALA 164 CO 0.02 -1.33 0.94 -0.47 0.00 0.00 0.00 175.76 174.92 2btm s TYR 165 N 1.24 3.24 -0.34 0.00 5.04 0.13 -1.70 117.35 124.96 2btm s TYR 165 Ca -0.04 1.14 -0.01 0.00 -2.44 0.00 0.00 57.07 55.73 2btm s TYR 165 Cb -0.20 -3.33 0.12 0.00 0.35 0.00 0.00 41.96 38.89 2btm s TYR 165 CO -0.01 -0.57 0.16 -1.21 -1.34 0.00 0.00 175.55 172.57 2btm s GLU 166 N 3.19 0.71 0.08 4.97 2.02 0.88 -0.80 118.70 129.75 2btm s GLU 166 Ca 0.39 -1.23 -0.33 0.00 0.02 0.00 0.00 54.97 53.83 2btm s GLU 166 Cb -0.14 -1.78 -0.12 0.00 0.10 0.00 0.00 34.13 32.19 2btm s GLU 166 CO 0.11 -1.07 1.75 -0.35 0.02 0.00 0.00 175.26 175.71 2btm n PRO 167 N 4.48 2.38 -0.31 0.39 -0.04 -1.26 -4.15 135.00 136.50 2btm n PRO 167 Ca 0.02 0.87 0.12 0.00 -0.04 0.00 0.00 63.50 64.47 2btm n PRO 167 Cb 0.39 -2.70 0.35 0.00 -0.04 0.00 0.00 33.50 31.51 2btm n PRO 167 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2btm h ILE 168 N 4.45 0.79 0.00 0.52 2.04 -1.17 0.97 117.51 125.11 2btm h ILE 168 Ca -0.46 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.14 2btm h ILE 168 Cb 1.25 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 2btm h ILE 168 CO 0.93 0.14 0.00 -2.67 0.00 0.00 0.00 178.15 176.54 2btm n TRP 169 N -4.62 0.27 1.03 1.37 4.27 -1.26 -2.20 117.44 116.30 2btm n TRP 169 Ca 0.20 0.12 0.11 0.00 -3.89 0.00 0.00 57.50 54.04 2btm n TRP 169 Cb 0.51 -0.69 0.03 0.00 -1.36 0.00 0.00 31.31 29.80 2btm n TRP 169 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2btm n ALA 170 N -1.60 3.62 -2.64 -1.67 0.00 0.33 -4.64 120.51 113.92 2btm n ALA 170 Ca 0.02 -0.61 -0.43 0.00 0.00 0.00 0.00 53.44 52.42 2btm n ALA 170 Cb 0.12 -0.83 -0.02 0.00 0.00 0.00 0.00 19.45 18.71 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 -2.53 4.50 -1.15 0.00 1.01 -0.94 -1.91 121.20 120.18 2btm s ILE 171 Ca 0.18 1.73 0.00 0.00 0.00 0.00 0.00 60.65 62.56 2btm s ILE 171 Cb 0.18 -4.42 0.00 0.00 0.01 0.00 0.00 42.46 38.23 2btm s ILE 171 CO 0.59 -0.49 0.00 0.61 0.00 0.00 0.00 174.94 175.65 2btm n GLY 172 N 3.89 1.03 0.04 6.18 0.00 -1.26 -4.80 105.19 110.27 2btm n GLY 172 Ca 0.12 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.95 0.18 -0.14 2.61 -2.24 -1.25 -4.95 114.28 106.54 2btm n THR 173 Ca -0.11 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 2btm n THR 173 Cb 0.51 0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 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 1.33 1.49 3.29 3.38 0.00 -1.26 -5.00 105.19 108.42 2btm n GLY 174 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 2btm n GLY 174 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2btm s LYS 175 N -0.43 2.63 0.26 1.61 1.02 -1.26 -5.03 119.74 118.54 2btm s LYS 175 Ca 0.00 -1.28 0.06 0.00 0.02 0.00 0.00 55.97 54.76 2btm s LYS 175 Cb 0.00 -3.63 -0.03 0.00 -0.52 0.00 0.00 37.83 33.65 2btm s LYS 175 CO 0.00 -0.79 0.34 -1.54 -0.92 0.00 0.00 175.35 172.44 2btm s SER 176 N 1.70 6.11 0.63 2.83 1.04 -1.26 -4.08 113.70 120.66 2btm s SER 176 Ca 0.01 -0.03 -0.14 0.00 0.48 0.00 0.00 55.95 56.27 2btm s SER 176 Cb -0.21 -1.68 -0.02 0.00 0.10 0.00 0.00 66.02 64.21 2btm s SER 176 CO 0.03 -0.11 1.05 -0.55 0.98 0.00 0.00 173.24 174.64 2btm s SER 177 N -3.98 5.70 0.58 7.02 0.15 -1.26 -5.02 113.70 116.90 2btm s SER 177 Ca 0.35 1.72 -0.15 0.00 0.70 0.00 0.00 55.95 58.57 2btm s SER 177 Cb -0.09 -2.52 -0.04 0.00 -1.71 0.00 0.00 66.02 61.66 2btm s SER 177 CO 0.28 -1.23 1.04 0.42 1.20 0.00 0.00 173.24 174.96 2btm s THR 178 N -2.69 3.98 0.26 6.45 -4.23 -1.26 -4.84 115.64 113.30 2btm s THR 178 Ca 0.61 0.92 -0.03 0.00 -1.18 0.00 0.00 61.69 62.01 2btm s THR 178 Cb -0.15 -3.46 0.25 0.00 1.34 0.00 0.00 72.50 70.48 2btm s THR 178 CO 0.43 -0.57 1.86 -0.65 -0.54 0.00 0.00 174.62 175.15 2btm h PRO 179 N 0.45 1.01 0.08 3.99 0.11 -1.95 -0.11 132.00 135.58 2btm h PRO 179 Ca -0.47 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 65.58 2btm h PRO 179 Cb 1.21 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.09 2btm h PRO 179 CO 0.58 0.67 -0.04 0.93 -0.21 0.00 0.00 178.00 179.93 2btm h GLU 180 N 1.04 -0.11 -0.34 1.05 3.07 -1.92 0.35 114.58 117.72 2btm h GLU 180 Ca 0.42 0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 59.27 2btm h GLU 180 Cb 0.24 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 2btm h GLU 180 CO -0.19 -0.05 0.16 -0.44 -1.40 0.00 0.00 179.01 177.08 2btm h ASP 181 N -0.14 0.45 -0.53 1.42 3.32 -1.85 0.13 116.42 119.23 2btm h ASP 181 Ca -0.01 -0.14 -0.04 0.00 0.02 0.00 0.00 57.03 56.86 2btm h ASP 181 Cb 0.11 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.51 2btm h ASP 181 CO 0.02 0.47 0.21 0.00 -1.72 0.00 0.00 179.24 178.22 2btm h ALA 182 N 1.01 1.30 -0.39 3.45 0.00 -0.89 -0.72 119.26 123.02 2btm h ALA 182 Ca 0.12 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 2btm h ALA 182 Cb 0.14 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2btm h ALA 182 CO -0.01 0.51 -0.21 -0.97 0.00 0.00 0.00 179.25 178.57 2btm h ASN 183 N 0.82 0.77 -0.18 0.00 -1.24 0.11 0.02 115.58 115.88 2btm h ASN 183 Ca 0.19 -0.27 -0.02 0.00 0.71 0.00 0.00 56.30 56.91 2btm h ASN 183 Cb 0.19 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.02 2btm h ASN 183 CO -0.02 0.97 0.04 0.28 -1.29 0.00 0.00 177.43 177.41 2btm h SER 184 N 0.67 0.27 -0.51 1.15 0.02 -0.22 0.28 113.55 115.20 2btm h SER 184 Ca 0.09 -0.24 -0.04 0.00 -0.84 0.00 0.00 61.79 60.76 2btm h SER 184 Cb 0.72 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 2btm h SER 184 CO 0.06 0.45 0.15 0.58 -1.14 0.00 0.00 176.83 176.92 2btm h VAL 185 N 0.09 1.23 -0.19 2.27 2.07 -1.01 -0.18 116.25 120.52 2btm h VAL 185 Ca 0.05 -0.80 -0.07 0.00 0.82 0.00 0.00 66.70 66.71 2btm h VAL 185 Cb 0.28 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 2btm h VAL 185 CO 0.00 0.29 -0.18 0.00 0.02 0.00 0.00 177.57 177.70 2btm h GLY 187 N 0.90 0.92 1.15 0.00 0.00 0.07 0.37 103.07 106.49 2btm h GLY 187 Ca 0.05 -0.75 -0.09 0.00 0.00 0.00 0.00 47.33 46.54 2btm h GLY 187 CO 0.03 0.68 -0.01 0.84 0.00 0.00 0.00 176.54 178.09 2btm h HIS 188 N 0.75 1.10 -0.32 5.60 -0.00 -0.06 0.63 115.15 122.85 2btm h HIS 188 Ca 0.11 -0.19 -0.03 0.00 -0.00 0.00 0.00 60.37 60.27 2btm h HIS 188 Cb 0.68 -0.29 -0.01 0.00 -0.00 0.00 0.00 27.41 27.79 2btm h HIS 188 CO 0.04 0.98 0.08 0.82 -0.00 0.00 0.00 177.93 179.85 2btm h ILE 189 N 0.93 1.22 -0.91 6.26 2.04 -0.39 0.15 117.51 126.81 2btm h ILE 189 Ca 0.17 -0.74 0.01 0.00 1.00 0.00 0.00 64.86 65.29 2btm h ILE 189 Cb 0.55 1.09 -0.05 0.00 -0.74 0.00 0.00 36.82 37.68 2btm h ILE 189 CO 0.03 0.25 0.60 -0.09 0.00 0.00 0.00 178.15 178.94 2btm h ARG 190 N 0.37 1.19 -0.65 2.37 2.43 -0.64 0.07 114.38 119.52 2btm h ARG 190 Ca 0.10 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.14 2btm h ARG 190 Cb 0.30 -0.27 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 2btm h ARG 190 CO 0.00 0.79 0.18 1.03 -1.51 0.00 0.00 179.97 180.46 2btm h SER 191 N 1.22 0.93 -0.55 -3.80 0.87 -0.37 0.18 113.55 112.03 2btm h SER 191 Ca 0.33 -0.17 -0.07 0.00 -1.23 0.00 0.00 61.79 60.65 2btm h SER 191 Cb -0.13 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 61.56 2btm h SER 191 CO -0.07 0.89 0.10 0.58 -0.53 0.00 0.00 176.83 177.79 2btm h VAL 192 N 0.96 1.25 -0.44 2.23 2.07 0.31 -1.63 116.25 121.00 2btm h VAL 192 Ca 0.21 -0.96 -0.09 0.00 0.82 0.00 0.00 66.70 66.69 2btm h VAL 192 Cb 0.30 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 2btm h VAL 192 CO -0.00 0.35 -0.07 0.58 0.02 0.00 0.00 177.57 178.45 2btm h VAL 193 N 0.90 1.27 -0.55 2.57 2.07 -0.23 -2.42 116.25 119.86 2btm h VAL 193 Ca 0.18 -1.16 -0.02 0.00 0.82 0.00 0.00 66.70 66.53 2btm h VAL 193 Cb 0.39 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 2btm h VAL 193 CO 0.01 0.39 0.26 -1.28 0.02 0.00 0.00 177.57 176.97 2btm h SER 194 N 0.66 0.69 1.80 0.57 0.87 -0.31 0.33 113.55 118.15 2btm h SER 194 Ca 0.12 -0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 2btm h SER 194 Cb 0.59 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.37 2btm h SER 194 CO 0.04 0.59 0.00 0.03 -0.53 0.00 0.00 176.83 176.96 2btm h ARG 195 N 0.77 0.00 0.01 2.24 3.08 -1.18 0.30 114.38 119.60 2btm h ARG 195 Ca 0.19 0.00 -0.36 0.00 0.07 0.00 0.00 59.98 59.88 2btm h ARG 195 Cb 0.09 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.08 2btm h ARG 195 CO -0.02 0.00 -2.26 1.28 -1.07 0.00 0.00 179.97 177.90 2btm n LEU 196 N -2.90 1.30 0.00 3.04 4.77 -0.82 -4.70 117.00 117.69 2btm n LEU 196 Ca 0.04 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 2btm n LEU 196 Cb 0.49 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 2btm n LEU 196 CO 0.32 0.65 0.20 0.49 -1.33 0.00 0.00 177.39 177.72 2btm n PHE 197 N -3.03 0.00 0.00 -1.77 3.72 0.11 -5.05 117.46 111.44 2btm n PHE 197 Ca -0.34 -0.05 0.00 0.00 -0.05 0.00 0.00 57.45 57.01 2btm n PHE 197 Cb 1.08 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.62 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 -0.05 1.60 0.29 1.37 0.00 0.09 -4.44 105.19 104.05 2btm n GLY 198 Ca 0.00 -1.77 0.12 0.00 0.00 0.00 0.00 46.02 44.37 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 0.00 -0.22 1.61 0.13 -1.90 -2.68 132.00 128.95 2btm h PRO 199 Ca 0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.05 2btm h PRO 199 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 2btm h PRO 199 CO 0.00 0.00 -0.16 0.93 -0.23 0.00 0.00 178.00 178.54 2btm h GLU 200 N 0.00 0.50 -0.54 0.86 5.08 -1.94 -1.40 114.58 117.14 2btm h GLU 200 Ca 0.04 -0.24 -0.08 0.00 -1.00 0.00 0.00 59.36 58.07 2btm h GLU 200 Cb 0.16 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2btm h GLU 200 CO -0.00 0.81 0.01 0.00 -1.00 0.00 0.00 179.01 178.83 2btm h ALA 201 N 0.68 0.73 0.00 3.43 0.00 -1.71 -2.78 119.26 119.61 2btm h ALA 201 Ca 0.04 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 2btm h ALA 201 Cb 0.69 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2btm h ALA 201 CO 0.04 0.54 -0.30 0.00 0.00 0.00 0.00 179.25 179.53 2btm h ALA 202 N 0.96 1.19 0.00 0.00 0.00 -1.45 0.06 119.26 120.02 2btm h ALA 202 Ca 0.16 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2btm h ALA 202 Cb 0.52 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2btm h ALA 202 CO 0.03 0.38 -0.01 1.49 0.00 0.00 0.00 179.25 181.14 2btm h GLU 203 N 0.00 0.00 0.00 0.00 4.81 -1.06 -3.34 114.58 114.99 2btm h GLU 203 Ca -0.00 0.00 -0.38 0.00 -0.13 0.00 0.00 59.36 58.85 2btm h GLU 203 Cb 0.67 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.98 2btm h GLU 203 CO 0.04 0.00 -2.42 0.00 -0.73 0.00 0.00 179.01 175.90 2btm n ALA 204 N -2.05 1.47 -1.70 2.92 0.00 -0.94 -4.79 120.51 115.42 2btm n ALA 204 Ca 0.04 -1.18 -0.43 0.00 0.00 0.00 0.00 53.44 51.87 2btm n ALA 204 Cb 0.51 -0.12 -0.03 0.00 0.00 0.00 0.00 19.45 19.81 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 -3.05 0.15 -3.30 0.00 3.06 -0.03 -4.90 119.36 111.29 2btm n ILE 205 Ca -0.40 -0.04 -0.38 0.00 -2.50 0.00 0.00 62.75 59.43 2btm n ILE 205 Cb 1.05 -1.82 -0.06 0.00 0.54 0.00 0.00 39.64 39.34 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 0.84 4.35 -0.22 9.51 0.52 -1.24 -4.97 118.95 127.73 2btm s ARG 206 Ca 0.75 0.47 -0.02 0.00 -0.52 0.00 0.00 55.73 56.42 2btm s ARG 206 Cb -0.56 -3.44 0.01 0.00 0.52 0.00 0.00 34.95 31.49 2btm s ARG 206 CO 0.36 0.15 -0.09 0.42 0.02 0.00 0.00 175.30 176.17 2btm s ILE 207 N 0.63 2.82 0.34 1.52 1.01 -1.26 -1.66 121.20 124.60 2btm s ILE 207 Ca 0.27 -0.86 0.03 0.00 0.00 0.00 0.00 60.65 60.09 2btm s ILE 207 Cb -0.15 -2.34 -0.02 0.00 0.01 0.00 0.00 42.46 39.96 2btm s ILE 207 CO 0.11 0.34 0.51 -1.10 0.00 0.00 0.00 174.94 174.80 2btm s GLN 208 N 1.36 3.30 0.04 2.79 -0.21 0.94 -0.06 119.66 127.82 2btm s GLN 208 Ca 0.03 -0.62 0.05 0.00 0.02 0.00 0.00 55.36 54.84 2btm s GLN 208 Cb -0.15 -2.73 -0.03 0.00 1.00 0.00 0.00 33.01 31.09 2btm s GLN 208 CO -0.06 0.10 -0.11 -0.47 -2.12 0.00 0.00 175.29 172.63 2btm s TYR 209 N -2.26 2.74 -0.02 0.91 5.04 0.04 -0.69 117.35 123.12 2btm s TYR 209 Ca 0.41 -0.14 -0.08 0.00 -2.44 0.00 0.00 57.07 54.82 2btm s TYR 209 Cb -0.10 -1.52 0.01 0.00 0.35 0.00 0.00 41.96 40.71 2btm s TYR 209 CO 0.34 0.35 0.17 0.20 -1.34 0.00 0.00 175.55 175.27 2btm s GLY 210 N -1.63 -0.02 0.00 8.97 0.00 0.02 -1.43 107.32 113.23 2btm s GLY 210 Ca 0.17 0.08 0.00 0.00 0.00 0.00 0.00 44.72 44.98 2btm s GLY 210 CO 0.08 -0.05 0.00 0.61 0.00 0.00 0.00 173.10 173.75 2btm n GLY 211 N 1.78 1.80 2.66 0.20 0.00 -1.26 -3.98 105.19 106.40 2btm n GLY 211 Ca -0.20 -0.52 -0.18 0.00 0.00 0.00 0.00 46.02 45.12 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 -5.18 -4.74 1.61 7.64 -0.80 -4.37 113.62 107.77 2btm n SER 212 Ca 0.00 -0.18 -0.41 0.00 1.01 0.00 0.00 58.87 59.29 2btm n SER 212 Cb 0.00 -4.09 -0.04 0.00 -1.01 0.00 0.00 64.21 59.07 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 -3.01 3.96 0.16 0.44 1.01 -1.26 -4.72 120.40 116.99 2btm s VAL 213 Ca 0.19 1.72 0.05 0.00 0.00 0.00 0.00 61.98 63.94 2btm s VAL 213 Cb -0.08 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 2btm s VAL 213 CO 0.23 0.31 -0.12 -0.54 0.00 0.00 0.00 175.10 174.99 2btm s LYS 214 N -0.44 1.13 0.32 2.72 3.01 -1.26 -4.57 119.74 120.64 2btm s LYS 214 Ca 0.48 -1.48 0.21 0.00 -1.01 0.00 0.00 55.97 54.17 2btm s LYS 214 Cb -0.28 -0.78 1.14 0.00 -1.01 0.00 0.00 37.83 36.90 2btm s LYS 214 CO 0.34 0.11 1.64 -0.35 0.51 0.00 0.00 175.35 177.60 2btm n PRO 215 N -0.21 0.14 0.00 -1.68 -0.04 -1.26 -0.56 135.00 131.39 2btm n PRO 215 Ca -0.10 0.63 0.12 0.00 -0.04 0.00 0.00 63.50 64.12 2btm n PRO 215 Cb 0.60 -1.96 0.26 0.00 -0.04 0.00 0.00 33.50 32.36 2btm n PRO 215 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2btm n ASP 216 N -2.24 1.18 0.00 3.54 5.68 -1.26 -4.32 116.55 119.12 2btm n ASP 216 Ca -0.01 -0.96 0.00 0.00 -0.50 0.00 0.00 54.79 53.32 2btm n ASP 216 Cb 0.05 0.26 0.00 0.00 -1.14 0.00 0.00 41.12 40.29 2btm n ASP 216 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 2btm n ASN 217 N -0.65 0.37 -0.20 -1.12 0.23 0.28 -4.82 115.26 109.35 2btm n ASN 217 Ca 0.10 -1.01 -0.06 0.00 -0.53 0.00 0.00 54.58 53.08 2btm n ASN 217 Cb 0.37 0.00 0.03 0.00 -2.08 0.00 0.00 39.78 38.10 2btm n ASN 217 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 2btm h ILE 218 N 0.69 1.16 -0.97 1.53 5.03 -1.33 -2.49 117.51 121.12 2btm h ILE 218 Ca 0.00 -0.34 0.15 0.00 -0.12 0.00 0.00 64.86 64.55 2btm h ILE 218 Cb 0.34 0.35 -0.10 0.00 -3.03 0.00 0.00 36.82 34.38 2btm h ILE 218 CO 0.00 0.16 0.59 0.03 -0.68 0.00 0.00 178.15 178.25 2btm h ARG 219 N 0.78 0.81 -0.62 2.37 -0.00 -1.86 0.41 114.38 116.27 2btm h ARG 219 Ca 0.21 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.98 59.62 2btm h ARG 219 Cb -0.05 -0.18 -0.03 0.00 0.00 0.00 0.00 29.97 29.71 2btm h ARG 219 CO -0.04 0.54 0.29 -0.44 0.00 0.00 0.00 179.97 180.32 2btm h ASP 220 N 0.83 0.80 0.00 7.04 3.32 -1.78 0.11 116.42 126.74 2btm h ASP 220 Ca 0.52 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.49 2btm h ASP 220 Cb 0.68 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.03 2btm h ASP 220 CO -0.33 0.68 -0.03 -0.26 -1.72 0.00 0.00 179.24 177.58 2btm h PHE 221 N 0.88 0.02 -0.70 4.55 0.04 -0.98 -3.31 116.94 117.45 2btm h PHE 221 Ca 0.22 -0.01 0.11 0.00 2.80 0.00 0.00 57.97 61.08 2btm h PHE 221 Cb 0.10 -0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.20 2btm h PHE 221 CO 0.01 0.91 0.46 -0.07 -0.60 0.00 0.00 178.31 179.02 2btm h LEU 222 N -0.87 0.48 -2.26 1.54 4.07 -0.11 -0.13 115.31 118.04 2btm h LEU 222 Ca -0.00 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.96 2btm h LEU 222 Cb 0.92 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 42.57 2btm h LEU 222 CO 0.01 0.28 -0.04 0.00 -1.08 0.00 0.00 178.44 177.61 2btm h ALA 223 N 1.65 1.50 -2.87 1.53 0.00 -0.87 -3.43 119.26 116.76 2btm h ALA 223 Ca 0.33 -0.04 -0.53 0.00 0.00 0.00 0.00 54.91 54.67 2btm h ALA 223 Cb 0.56 -0.01 0.08 0.00 0.00 0.00 0.00 17.79 18.42 2btm h ALA 223 CO -0.11 0.05 0.61 -0.65 0.00 0.00 0.00 179.25 179.16 2btm s GLN 224 N -4.54 3.98 0.31 0.00 -1.52 -0.06 -4.93 119.66 112.89 2btm s GLN 224 Ca -0.04 2.15 0.03 0.00 -1.95 0.00 0.00 55.36 55.55 2btm s GLN 224 Cb 0.15 -2.76 0.50 0.00 -0.22 0.00 0.00 33.01 30.68 2btm s GLN 224 CO 0.57 -0.49 1.82 0.37 -0.25 0.00 0.00 175.29 177.31 2btm h GLN 225 N 2.69 0.57 -0.00 2.91 5.75 -1.86 -2.97 115.11 122.19 2btm h GLN 225 Ca -0.50 -0.15 0.00 0.00 -0.15 0.00 0.00 58.65 57.86 2btm h GLN 225 Cb 1.25 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.73 2btm h GLN 225 CO 0.63 0.64 -0.46 1.04 -2.65 0.00 0.00 178.83 178.02 2btm n GLN 226 N -4.23 0.19 -3.69 1.69 1.13 -1.26 -4.81 117.38 106.39 2btm n GLN 226 Ca 0.01 -0.11 -0.37 0.00 -1.94 0.00 0.00 57.00 54.59 2btm n GLN 226 Cb 0.29 -1.50 -0.12 0.00 0.11 0.00 0.00 30.24 29.03 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 -2.89 4.59 -2.26 5.09 1.01 -1.12 -4.56 121.20 121.05 2btm s ILE 227 Ca 0.14 -0.19 0.20 0.00 0.00 0.00 0.00 60.65 60.80 2btm s ILE 227 Cb 0.18 -3.21 0.29 0.00 0.01 0.00 0.00 42.46 39.73 2btm s ILE 227 CO 0.66 0.24 1.25 0.47 0.00 0.00 0.00 174.94 177.56 2btm n ASP 228 N 4.97 3.02 0.00 3.58 8.00 0.91 -4.62 116.55 132.41 2btm n ASP 228 Ca -0.15 -1.90 0.00 0.00 0.71 0.00 0.00 54.79 53.45 2btm n ASP 228 Cb 0.51 -0.14 0.00 0.00 -0.02 0.00 0.00 41.12 41.47 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 1.21 -1.69 2.98 0.44 0.00 -1.24 -1.84 105.19 105.06 2btm n GLY 229 Ca 0.15 -1.11 -0.15 0.00 0.00 0.00 0.00 46.02 44.92 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 -1.45 0.44 -0.32 4.61 0.00 -1.09 -0.78 121.76 123.18 2btm s ALA 230 Ca 0.00 -0.37 -0.10 0.00 0.00 0.00 0.00 51.96 51.49 2btm s ALA 230 Cb 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.06 2btm s ALA 230 CO 0.00 0.06 0.17 -1.17 0.00 0.00 0.00 175.76 174.81 2btm s LEU 231 N -0.56 4.18 -0.16 0.00 0.20 -0.51 -0.76 118.68 121.07 2btm s LEU 231 Ca -0.02 -0.52 0.01 0.00 0.69 0.00 0.00 54.13 54.29 2btm s LEU 231 Cb -0.04 -2.02 0.01 0.00 -0.43 0.00 0.00 46.19 43.70 2btm s LEU 231 CO -0.00 -0.20 -0.17 -0.69 -0.29 0.00 0.00 176.35 174.99 2btm s VAL 232 N 1.63 2.42 0.00 1.68 1.01 0.98 -3.99 120.40 124.13 2btm s VAL 232 Ca 0.05 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.18 2btm s VAL 232 Cb -0.17 -2.01 0.00 0.00 0.00 0.00 0.00 36.38 34.20 2btm s VAL 232 CO 0.07 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.30 2btm n GLY 233 N 4.26 0.83 0.34 4.51 0.00 -1.26 0.23 105.19 114.09 2btm n GLY 233 Ca -0.20 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.80 2btm n GLY 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2btm n GLY 234 N 3.91 -1.85 0.00 -0.02 0.00 -1.26 -0.57 105.19 105.39 2btm n GLY 234 Ca 0.00 0.97 0.02 0.00 0.00 0.00 0.00 46.02 47.01 2btm n GLY 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2btm n ALA 235 N -3.51 2.08 0.67 4.61 0.00 -1.26 -2.42 120.51 120.67 2btm n ALA 235 Ca 0.07 -0.03 0.08 0.00 0.00 0.00 0.00 53.44 53.57 2btm n ALA 235 Cb 0.32 -1.08 0.06 0.00 0.00 0.00 0.00 19.45 18.75 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 -0.63 2.24 0.16 0.00 3.41 0.26 -3.79 113.62 115.27 2btm n SER 236 Ca 0.04 -1.62 0.02 0.00 -0.26 0.00 0.00 58.87 57.04 2btm n SER 236 Cb 0.02 0.06 0.23 0.00 -0.26 0.00 0.00 64.21 64.26 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 2.97 0.00 -9.27 1.04 3.38 -1.59 -3.44 115.31 108.41 2btm h LEU 237 Ca 0.00 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.32 2btm h LEU 237 Cb 0.65 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.26 2btm h LEU 237 CO 0.00 0.52 -0.57 -1.61 0.09 0.00 0.00 178.44 176.87 2btm s GLU 238 N -3.53 3.54 0.17 1.13 2.02 -1.26 -5.02 118.70 115.74 2btm s GLU 238 Ca -0.00 -0.32 -0.16 0.00 0.02 0.00 0.00 54.97 54.51 2btm s GLU 238 Cb 0.11 -3.07 0.12 0.00 0.10 0.00 0.00 34.13 31.40 2btm s GLU 238 CO 0.73 0.52 1.68 -1.35 0.02 0.00 0.00 175.26 176.86 2btm h PRO 239 N 5.83 0.07 -0.44 0.39 0.11 -1.92 -0.46 132.00 135.57 2btm h PRO 239 Ca -0.45 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.68 2btm h PRO 239 Cb 1.19 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 2btm h PRO 239 CO 0.62 0.05 0.26 0.00 -0.21 0.00 0.00 178.00 178.72 2btm h ALA 240 N 1.39 0.56 -0.05 -0.75 0.00 -1.97 -1.03 119.26 117.41 2btm h ALA 240 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2btm h ALA 240 Cb 0.31 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2btm h ALA 240 CO -0.38 -0.06 0.03 1.03 0.00 0.00 0.00 179.25 179.87 2btm h SER 241 N 0.52 0.06 -0.66 0.00 0.87 -1.73 -2.54 113.55 110.07 2btm h SER 241 Ca 0.18 -0.03 0.09 0.00 -1.23 0.00 0.00 61.79 60.80 2btm h SER 241 Cb 0.02 -0.02 -0.07 0.00 -0.44 0.00 0.00 62.40 61.90 2btm h SER 241 CO -0.09 0.07 0.31 0.15 -0.53 0.00 0.00 176.83 176.74 2btm h PHE 242 N 0.05 0.55 -0.95 2.24 3.57 -0.76 -1.64 116.94 120.01 2btm h PHE 242 Ca 0.02 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.57 2btm h PHE 242 Cb 0.02 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.56 2btm h PHE 242 CO -0.07 0.20 0.62 -0.07 -2.23 0.00 0.00 178.31 176.76 2btm h LEU 243 N 0.54 1.05 -1.06 0.59 3.38 -0.96 -1.61 115.31 117.24 2btm h LEU 243 Ca 0.32 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.21 2btm h LEU 243 Cb 0.33 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2btm h LEU 243 CO -0.26 0.74 -0.01 1.56 0.09 0.00 0.00 178.44 180.55 2btm h GLN 244 N 1.23 0.66 0.65 1.13 4.20 -0.91 -0.46 115.11 121.61 2btm h GLN 244 Ca 0.37 -0.16 -0.03 0.00 0.06 0.00 0.00 58.65 58.88 2btm h GLN 244 Cb -0.05 -0.08 0.01 0.00 0.30 0.00 0.00 27.48 27.65 2btm h GLN 244 CO -0.11 0.68 -0.31 -0.07 -0.67 0.00 0.00 178.83 178.35 2btm h LEU 245 N 0.62 -0.74 -1.58 1.46 3.38 -0.60 -2.72 115.31 115.13 2btm h LEU 245 Ca 0.13 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 2btm h LEU 245 Cb 0.41 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2btm h LEU 245 CO 0.02 -0.40 0.11 -0.37 0.09 0.00 0.00 178.44 177.89 2btm h VAL 246 N -1.11 1.11 -0.71 1.22 -1.51 -1.30 -2.17 116.25 111.78 2btm h VAL 246 Ca -0.09 -0.36 0.02 0.00 -1.23 0.00 0.00 66.70 65.04 2btm h VAL 246 Cb 0.71 0.79 -0.04 0.00 -2.13 0.00 0.00 31.29 30.62 2btm h VAL 246 CO 0.15 0.14 0.47 -0.08 -1.23 0.00 0.00 177.57 177.01 2btm h GLU 247 N 0.39 0.88 0.00 5.19 4.57 -0.99 -1.16 114.58 123.45 2btm h GLU 247 Ca 0.10 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 2btm h GLU 247 Cb 0.09 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.48 2btm h GLU 247 CO -0.01 0.58 0.00 0.00 -1.18 0.00 0.00 179.01 178.40 2btm h ALA 248 N 1.57 1.00 0.00 2.92 0.00 -1.07 -2.16 119.26 121.53 2btm h ALA 248 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2btm h ALA 248 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2btm h ALA 248 CO -0.07 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.59 2btm n GLY 249 N -0.71 -1.17 3.79 0.00 0.00 -0.44 -4.81 105.19 101.85 2btm n GLY 249 Ca -0.00 -0.12 -0.38 0.00 0.00 0.00 0.00 46.02 45.51 2btm n GLY 249 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2btm s ARG 250 N -2.59 4.50 0.00 1.61 0.52 -0.82 -4.74 118.95 117.43 2btm s ARG 250 Ca 0.24 1.12 0.00 0.00 -0.52 0.00 0.00 55.73 56.58 2btm s ARG 250 Cb 0.18 -3.06 0.00 0.00 0.52 0.00 0.00 34.95 32.58 2btm s ARG 250 CO 0.41 0.46 0.00 1.58 0.02 0.00 0.00 175.30 177.77