#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p2q n GLY 2 N 0.00 0.14 2.83 0.00 0.00 -0.47 -4.73 105.19 102.96 1p2q n GLY 2 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1p2q n GLY 2 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1p2q s VAL 3 N -1.32 1.85 0.41 1.61 1.01 -1.26 -0.72 120.40 121.97 1p2q s VAL 3 Ca 0.00 -2.70 -0.27 0.00 0.00 0.00 0.00 61.98 59.02 1p2q s VAL 3 Cb 0.00 -2.31 -0.10 0.00 0.00 0.00 0.00 36.38 33.97 1p2q s VAL 3 CO 0.00 -0.81 1.42 -2.65 0.00 0.00 0.00 175.10 173.06 1p2q n PRO 4 N 3.58 2.38 0.08 2.72 -0.02 -1.26 -4.89 135.00 137.59 1p2q n PRO 4 Ca 0.06 0.84 -0.03 0.00 -2.02 0.00 0.00 63.50 62.35 1p2q n PRO 4 Cb 0.35 -2.59 0.19 0.00 -0.02 0.00 0.00 33.50 31.44 1p2q n PRO 4 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1p2q h ALA 5 N 2.57 1.04 -2.85 3.55 0.00 -1.88 -3.36 119.26 118.33 1p2q h ALA 5 Ca -0.50 -0.43 -0.71 0.00 0.00 0.00 0.00 54.91 53.26 1p2q h ALA 5 Cb 1.26 -0.09 -0.28 0.00 0.00 0.00 0.00 17.79 18.68 1p2q h ALA 5 CO 0.62 0.62 -0.49 0.42 0.00 0.00 0.00 179.25 180.42 1p2q s ILE 6 N -4.10 4.18 0.19 0.00 1.01 -1.26 -5.06 121.20 116.16 1p2q s ILE 6 Ca -0.05 -1.33 -0.32 0.00 0.00 0.00 0.00 60.65 58.96 1p2q s ILE 6 Cb 0.13 -3.52 -0.11 0.00 0.01 0.00 0.00 42.46 38.97 1p2q s ILE 6 CO 0.78 -0.44 1.73 -1.58 0.00 0.00 0.00 174.94 175.43 1p2q s GLN 7 N 1.43 4.13 0.51 2.79 0.74 -1.26 -4.16 119.66 123.83 1p2q s GLN 7 Ca 0.02 2.59 -0.20 0.00 0.05 0.00 0.00 55.36 57.82 1p2q s GLN 7 Cb -0.22 -3.17 -0.07 0.00 1.10 0.00 0.00 33.01 30.64 1p2q s GLN 7 CO 0.02 -0.76 1.08 -1.25 -0.55 0.00 0.00 175.29 173.84 1p2q s PRO 8 N 1.46 3.61 -0.20 1.67 0.04 -1.26 -4.91 135.00 135.41 1p2q s PRO 8 Ca 0.76 1.50 0.01 0.00 0.04 0.00 0.00 61.00 63.31 1p2q s PRO 8 Cb -0.49 -2.08 0.03 0.00 0.04 0.00 0.00 34.50 32.00 1p2q s PRO 8 CO 0.33 -0.61 -0.17 0.08 0.04 0.00 0.00 177.00 176.67 1p2q s VAL 9 N -1.86 1.99 -0.20 -0.36 1.01 -1.26 -5.08 120.40 114.65 1p2q s VAL 9 Ca 0.69 -1.06 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 1p2q s VAL 9 Cb -0.20 -1.89 -0.00 0.00 0.00 0.00 0.00 36.38 34.28 1p2q s VAL 9 CO 0.24 0.37 -0.10 -0.76 0.00 0.00 0.00 175.10 174.86 1p2q s LEU 10 N 1.28 2.66 0.06 3.92 1.43 -1.26 -4.75 118.68 122.02 1p2q s LEU 10 Ca 0.01 -0.45 -0.35 0.00 -1.03 0.00 0.00 54.13 52.31 1p2q s LEU 10 Cb -0.15 -1.65 -0.20 0.00 0.03 0.00 0.00 46.19 44.23 1p2q s LEU 10 CO -0.11 0.01 1.59 0.77 0.23 0.00 0.00 176.35 178.85 1p2q h SER 11 N 7.85 -0.93 -1.12 2.29 4.64 -1.99 -3.52 113.55 120.77 1p2q h SER 11 Ca -0.40 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1p2q h SER 11 Cb 1.16 0.24 0.00 0.00 -0.31 0.00 0.00 62.40 63.49 1p2q h SER 11 CO 0.61 -0.66 0.00 -0.38 -0.87 0.00 0.00 176.83 175.53 1p2q n ILE 16 N -5.56 -0.75 -3.11 0.95 5.41 0.49 -5.18 119.36 111.62 1p2q n ILE 16 Ca -0.15 0.00 -0.39 0.00 1.00 0.00 0.00 62.75 63.21 1p2q n ILE 16 Cb 0.44 -0.75 -0.05 0.00 -0.71 0.00 0.00 39.64 38.56 1p2q n ILE 16 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1p2q s VAL 17 N 0.00 5.02 -1.21 1.39 1.01 0.13 -3.95 120.40 122.80 1p2q s VAL 17 Ca 0.00 1.35 0.00 0.00 0.00 0.00 0.00 61.98 63.33 1p2q s VAL 17 Cb 0.00 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.38 1p2q s VAL 17 CO 0.00 0.30 0.00 -3.20 0.00 0.00 0.00 175.10 172.20 1p2q n ASN 18 N 3.53 -4.25 -0.81 3.32 4.05 -1.26 -2.23 115.26 117.62 1p2q n ASN 18 Ca -0.03 0.10 0.00 0.00 0.45 0.00 0.00 54.58 55.10 1p2q n ASN 18 Cb 0.51 -3.26 0.00 0.00 1.23 0.00 0.00 39.78 38.27 1p2q n ASN 18 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1p2q n GLY 19 N -1.13 1.39 3.21 8.20 0.00 -1.25 -4.80 105.19 110.80 1p2q n GLY 19 Ca -0.15 -1.87 -0.09 0.00 0.00 0.00 0.00 46.02 43.92 1p2q n GLY 19 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1p2q s GLU 20 N 2.51 0.86 0.18 1.61 -1.05 0.05 -4.95 118.70 117.92 1p2q s GLU 20 Ca 0.00 -1.07 -0.31 0.00 -0.15 0.00 0.00 54.97 53.45 1p2q s GLU 20 Cb 0.00 0.32 -0.09 0.00 -0.44 0.00 0.00 34.13 33.92 1p2q s GLU 20 CO 0.00 -0.27 1.39 -2.00 0.95 0.00 0.00 175.26 175.34 1p2q s GLU 21 N -3.90 4.32 0.52 -4.83 2.12 -1.26 -0.61 118.70 115.05 1p2q s GLU 21 Ca 0.08 2.15 -0.13 0.00 0.36 0.00 0.00 54.97 57.44 1p2q s GLU 21 Cb 0.05 -3.19 -0.06 0.00 0.26 0.00 0.00 34.13 31.19 1p2q s GLU 21 CO -0.08 -0.39 0.94 0.00 -0.54 0.00 0.00 175.26 175.19 1p2q s ALA 22 N 0.51 3.16 0.13 6.30 0.00 -0.47 -4.83 121.76 126.55 1p2q s ALA 22 Ca 0.61 -0.01 -0.31 0.00 0.00 0.00 0.00 51.96 52.25 1p2q s ALA 22 Cb -0.39 -2.99 -0.09 0.00 0.00 0.00 0.00 23.12 19.66 1p2q s ALA 22 CO 0.36 -0.31 1.44 0.08 0.00 0.00 0.00 175.76 177.33 1p2q s VAL 23 N -2.72 3.11 0.00 0.00 1.01 -1.26 -4.88 120.40 115.67 1p2q s VAL 23 Ca 0.55 0.80 -0.36 0.00 0.00 0.00 0.00 61.98 62.97 1p2q s VAL 23 Cb -0.10 -3.51 -0.15 0.00 0.00 0.00 0.00 36.38 32.61 1p2q s VAL 23 CO 0.38 0.06 1.58 -2.65 0.00 0.00 0.00 175.10 174.47 1p2q n PRO 24 N 3.91 1.58 -0.94 2.72 -0.02 -1.26 -1.60 135.00 139.39 1p2q n PRO 24 Ca 0.12 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1p2q n PRO 24 Cb 0.41 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 1p2q n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1p2q n GLY 25 N 3.41 0.58 0.00 -1.23 0.00 -1.26 -4.91 105.19 101.78 1p2q n GLY 25 Ca 0.20 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.36 1p2q n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1p2q n SER 26 N -0.12 0.00 -3.18 1.61 3.41 -0.63 -3.59 113.62 111.13 1p2q n SER 26 Ca 0.00 -0.54 -0.24 0.00 -0.26 0.00 0.00 58.87 57.84 1p2q n SER 26 Cb 0.06 -0.13 -0.05 0.00 -0.26 0.00 0.00 64.21 63.82 1p2q n SER 26 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1p2q n TRP 27 N -1.13 1.69 0.31 7.33 7.02 -1.26 -4.29 117.44 127.11 1p2q n TRP 27 Ca 0.18 -3.87 0.12 0.00 -1.02 0.00 0.00 57.50 52.91 1p2q n TRP 27 Cb 0.16 -0.45 0.63 0.00 -2.42 0.00 0.00 31.31 29.23 1p2q n TRP 27 CO 0.00 0.00 0.00 -1.00 -2.02 0.00 0.00 177.69 174.67 1p2q h PRO 28 N 3.51 0.00 0.00 -0.99 0.13 -1.76 -0.62 132.00 132.26 1p2q h PRO 28 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1p2q h PRO 28 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1p2q h PRO 28 CO 0.64 0.00 -0.70 -2.67 -0.23 0.00 0.00 178.00 175.04 1p2q n TRP 29 N -2.70 0.39 -2.11 1.56 2.14 -1.08 -2.23 117.44 113.42 1p2q n TRP 29 Ca -0.02 0.11 -0.42 0.00 2.07 0.00 0.00 57.50 59.25 1p2q n TRP 29 Cb 0.46 -0.54 -0.03 0.00 -0.81 0.00 0.00 31.31 30.39 1p2q n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1p2q s GLN 30 N -3.15 4.23 0.29 -2.67 2.00 -0.24 -0.92 119.66 119.20 1p2q s GLN 30 Ca 0.06 2.08 0.10 0.00 -2.00 0.00 0.00 55.36 55.61 1p2q s GLN 30 Cb 0.14 -3.73 -0.05 0.00 0.80 0.00 0.00 33.01 30.17 1p2q s GLN 30 CO 0.74 -0.71 -0.15 0.14 -0.50 0.00 0.00 175.29 174.81 1p2q s VAL 31 N 3.08 2.25 -0.16 1.34 -7.23 -0.43 -4.41 120.40 114.84 1p2q s VAL 31 Ca 0.68 -2.30 -0.02 0.00 -1.81 0.00 0.00 61.98 58.53 1p2q s VAL 31 Cb -0.33 -2.39 -0.02 0.00 0.56 0.00 0.00 36.38 34.20 1p2q s VAL 31 CO 0.27 -0.35 -0.08 -0.55 -0.31 0.00 0.00 175.10 174.08 1p2q s SER 32 N -3.51 4.32 -0.25 4.85 0.15 -0.30 -2.07 113.70 116.89 1p2q s SER 32 Ca 0.30 -0.28 -0.15 0.00 0.70 0.00 0.00 55.95 56.52 1p2q s SER 32 Cb -0.01 -1.70 -0.04 0.00 -1.71 0.00 0.00 66.02 62.56 1p2q s SER 32 CO 0.14 0.12 0.36 -0.76 1.20 0.00 0.00 173.24 174.30 1p2q s LEU 33 N 0.64 4.07 0.14 3.45 1.43 0.65 -0.79 118.68 128.27 1p2q s LEU 33 Ca -0.05 0.32 0.06 0.00 -1.03 0.00 0.00 54.13 53.44 1p2q s LEU 33 Cb -0.15 -2.41 -0.04 0.00 0.03 0.00 0.00 46.19 43.62 1p2q s LEU 33 CO 0.03 -0.13 -0.14 -1.10 0.23 0.00 0.00 176.35 175.23 1p2q s GLN 34 N 1.79 1.09 0.94 1.70 -0.21 -0.59 -1.35 119.66 123.03 1p2q s GLN 34 Ca 0.15 -1.33 -0.13 0.00 0.02 0.00 0.00 55.36 54.07 1p2q s GLN 34 Cb -0.15 -0.92 0.21 0.00 1.00 0.00 0.00 33.01 33.14 1p2q s GLN 34 CO 0.09 0.17 1.28 0.16 -2.12 0.00 0.00 175.29 174.87 1p2q s ASP 35 N -2.70 3.11 0.48 5.90 1.47 -0.66 -0.37 116.67 123.91 1p2q s ASP 35 Ca 0.12 -0.01 0.28 0.00 1.18 0.00 0.00 52.55 54.12 1p2q s ASP 35 Cb -0.03 0.00 1.50 0.00 -0.34 0.00 0.00 42.92 44.05 1p2q s ASP 35 CO 0.03 -2.71 1.83 0.07 0.68 0.00 0.00 175.17 175.07 1p2q h LYS 36 N -1.51 0.00 -0.00 2.11 2.10 -1.92 -0.74 116.57 116.61 1p2q h LYS 36 Ca -0.42 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.23 1p2q h LYS 36 Cb 1.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.55 1p2q h LYS 36 CO 0.32 0.00 -0.72 0.25 -2.00 0.00 0.00 179.45 177.30 1p2q n THR 37 N -2.55 0.00 0.00 0.07 -2.24 -1.26 -4.94 114.28 103.35 1p2q n THR 37 Ca -0.02 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1p2q n THR 37 Cb 0.17 0.63 0.00 0.00 -2.10 0.00 0.00 70.33 69.02 1p2q n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1p2q n GLY 38 N 1.49 1.02 3.65 3.38 0.00 -0.28 -5.06 105.19 109.39 1p2q n GLY 38 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 1p2q n GLY 38 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1p2q s PHE 39 N -2.00 3.25 -0.12 1.61 5.36 -1.26 -4.79 117.98 120.03 1p2q s PHE 39 Ca 0.00 1.29 -0.29 0.00 -0.96 0.00 0.00 56.93 56.97 1p2q s PHE 39 Cb 0.00 -3.43 -0.03 0.00 -0.34 0.00 0.00 43.02 39.22 1p2q s PHE 39 CO 0.00 -0.60 1.32 -1.58 -1.46 0.00 0.00 175.22 172.90 1p2q s HIS 40 N 3.36 2.76 0.00 10.12 5.65 -1.26 -1.65 115.29 134.27 1p2q s HIS 40 Ca 0.43 0.90 0.00 0.00 0.25 0.00 0.00 55.06 56.64 1p2q s HIS 40 Cb -0.14 -3.57 0.00 0.00 -1.18 0.00 0.00 32.58 27.70 1p2q s HIS 40 CO 0.10 -2.03 0.00 1.97 -0.65 0.00 0.00 174.74 174.14 1p2q n PHE 41 N 6.39 0.00 -3.63 3.88 1.16 -0.46 -5.00 117.46 119.80 1p2q n PHE 41 Ca 0.14 0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.64 1p2q n PHE 41 Cb 0.45 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.30 1p2q n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1p2q s GLY 43 N -2.78 2.06 0.15 0.00 0.00 0.11 -0.25 107.32 106.61 1p2q s GLY 43 Ca 0.07 -1.68 -0.25 0.00 0.00 0.00 0.00 44.72 42.86 1p2q s GLY 43 CO -0.03 -1.83 1.00 -0.32 0.00 0.00 0.00 173.10 171.92 1p2q s GLY 44 N -4.49 -0.18 -0.05 0.20 0.00 -0.88 -3.70 107.32 98.23 1p2q s GLY 44 Ca 0.47 0.09 0.01 0.00 0.00 0.00 0.00 44.72 45.29 1p2q s GLY 44 CO 0.30 0.42 -0.04 -0.56 0.00 0.00 0.00 173.10 173.22 1p2q s SER 45 N -3.03 1.04 0.13 1.64 0.01 -0.47 -1.32 113.70 111.71 1p2q s SER 45 Ca 0.14 -0.13 -0.30 0.00 1.31 0.00 0.00 55.95 56.97 1p2q s SER 45 Cb -0.01 -0.46 -0.07 0.00 0.21 0.00 0.00 66.02 65.69 1p2q s SER 45 CO 0.02 -0.07 1.22 -0.76 0.41 0.00 0.00 173.24 174.06 1p2q s LEU 46 N 1.02 4.41 -0.01 2.44 1.43 -0.10 -0.92 118.68 126.96 1p2q s LEU 46 Ca -0.09 2.16 0.12 0.00 -1.03 0.00 0.00 54.13 55.28 1p2q s LEU 46 Cb -0.14 -3.59 -0.15 0.00 0.03 0.00 0.00 46.19 42.33 1p2q s LEU 46 CO -0.01 -0.43 0.40 2.30 0.23 0.00 0.00 176.35 178.84 1p2q n ILE 47 N 3.17 0.00 -3.84 -0.59 -5.35 -0.58 -1.45 119.36 110.72 1p2q n ILE 47 Ca 0.07 -0.25 -0.01 0.00 -0.27 0.00 0.00 62.75 62.29 1p2q n ILE 47 Cb 0.45 0.68 0.01 0.00 -1.74 0.00 0.00 39.64 39.05 1p2q n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1p2q n ASN 48 N -1.54 -1.21 0.30 7.28 0.23 -1.23 -4.67 115.26 114.43 1p2q n ASN 48 Ca 0.00 -1.54 0.18 0.00 -0.53 0.00 0.00 54.58 52.69 1p2q n ASN 48 Cb 0.23 1.94 0.89 0.00 -2.08 0.00 0.00 39.78 40.77 1p2q n ASN 48 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1p2q h GLU 49 N 0.00 0.00 -0.00 -3.83 9.09 -1.97 -3.22 114.58 114.64 1p2q h GLU 49 Ca -0.19 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.22 1p2q h GLU 49 Cb 0.91 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.01 1p2q h GLU 49 CO 0.27 0.03 -0.06 0.09 0.05 0.00 0.00 179.01 179.38 1p2q n ASN 50 N -3.21 1.08 -4.07 3.06 3.02 -1.26 -0.23 115.26 113.66 1p2q n ASN 50 Ca -0.01 -1.04 -0.19 0.00 -0.03 0.00 0.00 54.58 53.31 1p2q n ASN 50 Cb 0.21 0.29 -0.14 0.00 -0.61 0.00 0.00 39.78 39.53 1p2q n ASN 50 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1p2q s TRP 51 N -0.73 0.93 -0.03 3.10 0.52 -1.22 -0.74 118.94 120.77 1p2q s TRP 51 Ca 0.05 -0.25 0.05 0.00 0.02 0.00 0.00 56.10 55.96 1p2q s TRP 51 Cb 0.04 -0.58 -0.01 0.00 -1.15 0.00 0.00 33.47 31.77 1p2q s TRP 51 CO 0.10 -0.01 -0.18 0.08 0.02 0.00 0.00 176.95 176.97 1p2q s VAL 52 N -0.53 1.44 -0.11 4.03 1.01 -0.41 -1.52 120.40 124.31 1p2q s VAL 52 Ca 0.02 -0.74 -0.03 0.00 0.00 0.00 0.00 61.98 61.23 1p2q s VAL 52 Cb -0.06 -1.22 -0.03 0.00 0.00 0.00 0.00 36.38 35.07 1p2q s VAL 52 CO 0.00 0.41 -0.01 0.54 0.00 0.00 0.00 175.10 176.05 1p2q s VAL 53 N -0.12 4.23 0.02 2.92 0.11 -0.10 -0.32 120.40 127.14 1p2q s VAL 53 Ca -0.00 -0.26 -0.00 0.00 -2.93 0.00 0.00 61.98 58.78 1p2q s VAL 53 Cb -0.10 -2.80 0.00 0.00 -1.53 0.00 0.00 36.38 31.95 1p2q s VAL 53 CO 0.01 0.56 0.02 1.07 -3.33 0.00 0.00 175.10 173.44 1p2q n THR 54 N 2.61 0.00 -3.38 5.04 5.66 -0.02 -1.36 114.28 122.83 1p2q n THR 54 Ca -0.18 -0.09 -0.33 0.00 -3.05 0.00 0.00 64.05 60.40 1p2q n THR 54 Cb 0.53 0.05 -0.06 0.00 -1.55 0.00 0.00 70.33 69.31 1p2q n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1p2q s ALA 55 N -1.63 3.56 0.27 1.79 0.00 -1.26 -0.86 121.76 123.62 1p2q s ALA 55 Ca 0.01 -0.20 0.04 0.00 0.00 0.00 0.00 51.96 51.81 1p2q s ALA 55 Cb -0.00 -2.49 0.36 0.00 0.00 0.00 0.00 23.12 20.99 1p2q s ALA 55 CO 0.01 0.48 1.66 0.00 0.00 0.00 0.00 175.76 177.91 1p2q h ALA 56 N 2.95 1.01 0.00 0.00 0.00 -1.74 -2.90 119.26 118.58 1p2q h ALA 56 Ca -0.48 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.01 1p2q h ALA 56 Cb 1.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1p2q h ALA 56 CO 0.68 0.61 0.00 -2.39 0.00 0.00 0.00 179.25 178.15 1p2q n HIS 57 N -4.03 0.06 0.32 0.00 1.44 -1.26 -2.27 115.22 109.49 1p2q n HIS 57 Ca -0.02 0.02 0.15 0.00 -2.01 0.00 0.00 57.72 55.87 1p2q n HIS 57 Cb 0.49 -0.54 0.65 0.00 0.12 0.00 0.00 29.99 30.72 1p2q n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1p2q n GLY 59 N -0.19 -0.51 3.77 0.00 0.00 -0.96 -4.94 105.19 102.36 1p2q n GLY 59 Ca 0.01 0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1p2q n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1p2q s VAL 60 N -3.25 2.26 0.34 1.61 1.01 -1.26 -5.04 120.40 116.07 1p2q s VAL 60 Ca 0.58 0.23 0.03 0.00 0.00 0.00 0.00 61.98 62.82 1p2q s VAL 60 Cb -0.28 -3.13 -0.06 0.00 0.00 0.00 0.00 36.38 32.91 1p2q s VAL 60 CO 0.71 0.03 0.07 0.42 0.00 0.00 0.00 175.10 176.33 1p2q s THR 61 N -1.23 1.04 -1.30 3.92 -4.23 -1.26 -4.96 115.64 107.62 1p2q s THR 61 Ca 0.60 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 59.25 1p2q s THR 61 Cb -0.42 -2.70 0.20 0.00 1.34 0.00 0.00 72.50 70.93 1p2q s THR 61 CO 0.53 0.00 1.38 0.35 -0.54 0.00 0.00 174.62 176.35 1p2q n THR 62 N -0.72 0.77 0.56 3.99 -2.24 -1.26 -1.65 114.28 113.73 1p2q n THR 62 Ca -0.03 0.19 0.12 0.00 -2.27 0.00 0.00 64.05 62.06 1p2q n THR 62 Cb 0.66 -0.96 0.23 0.00 -2.10 0.00 0.00 70.33 68.16 1p2q n THR 62 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1p2q h SER 63 N 0.00 0.00 -3.72 3.42 0.02 -1.95 -3.40 113.55 107.91 1p2q h SER 63 Ca 0.00 -0.14 -0.47 0.00 -0.84 0.00 0.00 61.79 60.35 1p2q h SER 63 Cb 0.16 0.00 0.07 0.00 0.14 0.00 0.00 62.40 62.77 1p2q h SER 63 CO 0.00 0.07 0.21 -1.81 -1.14 0.00 0.00 176.83 174.15 1p2q s ASP 64 N -4.43 5.26 0.09 3.07 1.01 -0.66 -3.98 116.67 117.04 1p2q s ASP 64 Ca 0.07 0.62 0.06 0.00 0.71 0.00 0.00 52.55 54.01 1p2q s ASP 64 Cb 0.13 -1.46 -0.03 0.00 1.01 0.00 0.00 42.92 42.56 1p2q s ASP 64 CO 0.68 -1.30 -0.15 0.54 0.21 0.00 0.00 175.17 175.16 1p2q s VAL 65 N -3.11 1.26 -0.24 -1.27 0.11 0.50 -4.04 120.40 113.61 1p2q s VAL 65 Ca 0.57 -1.46 -0.10 0.00 -2.93 0.00 0.00 61.98 58.06 1p2q s VAL 65 Cb -0.11 -1.27 -0.05 0.00 -1.53 0.00 0.00 36.38 33.42 1p2q s VAL 65 CO 0.45 -0.26 0.15 -0.69 -3.33 0.00 0.00 175.10 171.42 1p2q s VAL 66 N -1.52 5.24 -0.28 2.04 1.01 0.13 -1.54 120.40 125.48 1p2q s VAL 66 Ca 0.02 0.14 -0.05 0.00 0.00 0.00 0.00 61.98 62.09 1p2q s VAL 66 Cb -0.08 -3.44 0.01 0.00 0.00 0.00 0.00 36.38 32.87 1p2q s VAL 66 CO 0.03 0.35 0.04 -0.69 0.00 0.00 0.00 175.10 174.83 1p2q s VAL 67 N 1.07 3.65 0.23 2.92 1.01 0.03 0.50 120.40 129.80 1p2q s VAL 67 Ca 0.07 -0.80 0.07 0.00 0.00 0.00 0.00 61.98 61.32 1p2q s VAL 67 Cb -0.14 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 1p2q s VAL 67 CO 0.04 0.10 0.11 0.00 0.00 0.00 0.00 175.10 175.35 1p2q s ALA 68 N 1.45 3.42 -0.97 5.51 0.00 -0.07 -1.15 121.76 129.94 1p2q s ALA 68 Ca 0.02 -1.43 0.00 0.00 0.00 0.00 0.00 51.96 50.54 1p2q s ALA 68 Cb -0.17 -1.13 0.00 0.00 0.00 0.00 0.00 23.12 21.82 1p2q s ALA 68 CO 0.01 0.33 0.00 0.41 0.00 0.00 0.00 175.76 176.51 1p2q n GLY 69 N -0.80 0.75 3.90 0.00 0.00 -1.26 -1.35 105.19 106.43 1p2q n GLY 69 Ca -0.08 -0.55 -0.32 0.00 0.00 0.00 0.00 46.02 45.06 1p2q n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1p2q s GLU 70 N -3.36 3.56 0.18 1.61 2.12 -1.26 -4.63 118.70 116.92 1p2q s GLU 70 Ca 0.00 -0.17 0.00 0.00 0.36 0.00 0.00 54.97 55.16 1p2q s GLU 70 Cb 0.00 -2.96 0.00 0.00 0.26 0.00 0.00 34.13 31.43 1p2q s GLU 70 CO 0.00 0.55 0.00 0.34 -0.54 0.00 0.00 175.26 175.61 1p2q n PHE 71 N 0.43 -1.24 -3.54 5.30 7.35 -1.26 -4.80 117.46 119.70 1p2q n PHE 71 Ca -0.05 0.22 -0.42 0.00 -0.76 0.00 0.00 57.45 56.44 1p2q n PHE 71 Cb 0.52 0.31 -0.09 0.00 0.35 0.00 0.00 39.48 40.57 1p2q n PHE 71 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1p2q s ASP 72 N -5.42 5.79 0.00 -2.13 -1.08 -1.26 -1.50 116.67 111.06 1p2q s ASP 72 Ca 0.00 -1.52 0.16 0.00 -0.52 0.00 0.00 52.55 50.67 1p2q s ASP 72 Cb 0.00 -2.04 0.70 0.00 -1.46 0.00 0.00 42.92 40.12 1p2q s ASP 72 CO 0.00 -0.59 1.50 0.00 0.52 0.00 0.00 175.17 176.59 1p2q n GLN 73 N 5.00 0.05 0.00 4.34 6.02 0.43 -1.82 117.38 131.39 1p2q n GLN 73 Ca -0.10 0.21 0.12 0.00 -0.01 0.00 0.00 57.00 57.22 1p2q n GLN 73 Cb 0.43 -1.50 0.24 0.00 1.02 0.00 0.00 30.24 30.43 1p2q n GLN 73 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1p2q n GLY 74 N 0.12 -0.26 3.54 1.08 0.00 -1.26 -4.82 105.19 103.58 1p2q n GLY 74 Ca 0.05 -0.51 -0.41 0.00 0.00 0.00 0.00 46.02 45.15 1p2q n GLY 74 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1p2q s SER 75 N -2.43 6.17 0.40 1.61 0.15 -0.76 -4.94 113.70 113.89 1p2q s SER 75 Ca 0.23 -0.27 0.22 0.00 0.70 0.00 0.00 55.95 56.83 1p2q s SER 75 Cb 0.19 -2.19 0.28 0.00 -1.71 0.00 0.00 66.02 62.59 1p2q s SER 75 CO 0.52 -0.33 1.54 -1.28 1.20 0.00 0.00 173.24 174.88 1p2q h SER 76 N 8.47 0.00 1.30 5.45 0.87 -1.87 -3.27 113.55 124.49 1p2q h SER 76 Ca -0.30 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 1p2q h SER 76 Cb 1.14 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 1p2q h SER 76 CO 0.69 0.06 -0.68 0.77 -0.53 0.00 0.00 176.83 177.14 1p2q h SER 77 N 0.00 0.00 -2.39 6.23 4.64 -1.96 -3.47 113.55 116.60 1p2q h SER 77 Ca -0.00 -0.01 -0.60 0.00 -0.47 0.00 0.00 61.79 60.71 1p2q h SER 77 Cb 1.04 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.21 1p2q h SER 77 CO 0.01 0.00 0.61 1.21 -0.87 0.00 0.00 176.83 177.79 1p2q n GLU 78 N -2.77 1.88 -2.51 4.77 2.13 -1.24 -4.90 120.64 118.00 1p2q n GLU 78 Ca 0.01 0.67 -0.43 0.00 0.66 0.00 0.00 57.16 58.08 1p2q n GLU 78 Cb 0.54 -2.34 -0.02 0.00 0.27 0.00 0.00 31.44 29.89 1p2q n GLU 78 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1p2q s LYS 79 N 0.03 4.27 0.21 5.31 1.02 -1.26 -5.00 119.74 124.32 1p2q s LYS 79 Ca 0.73 1.57 -0.02 0.00 0.02 0.00 0.00 55.97 58.27 1p2q s LYS 79 Cb -0.71 -3.69 -0.04 0.00 -0.52 0.00 0.00 37.83 32.88 1p2q s LYS 79 CO 0.46 -0.62 0.17 0.96 -0.92 0.00 0.00 175.35 175.40 1p2q s ILE 80 N 3.13 0.00 -0.25 2.17 -4.36 -1.26 -4.72 121.20 115.91 1p2q s ILE 80 Ca 0.52 -1.95 0.01 0.00 -0.26 0.00 0.00 60.65 58.96 1p2q s ILE 80 Cb -0.20 -2.48 0.04 0.00 1.25 0.00 0.00 42.46 41.07 1p2q s ILE 80 CO 0.14 0.00 -0.10 -1.10 0.24 0.00 0.00 174.94 174.12 1p2q s GLN 81 N -4.11 2.56 -0.44 0.37 -0.21 -0.46 -4.98 119.66 112.39 1p2q s GLN 81 Ca 0.38 -1.15 -0.20 0.00 0.02 0.00 0.00 55.36 54.41 1p2q s GLN 81 Cb 0.06 -2.89 0.03 0.00 1.00 0.00 0.00 33.01 31.21 1p2q s GLN 81 CO 0.13 -0.46 0.60 0.15 -2.12 0.00 0.00 175.29 173.58 1p2q s LYS 82 N 1.21 3.23 -0.18 2.91 1.02 -1.26 -0.89 119.74 125.77 1p2q s LYS 82 Ca -0.04 -0.50 -0.05 0.00 0.02 0.00 0.00 55.97 55.41 1p2q s LYS 82 Cb -0.18 -3.97 -0.03 0.00 -0.52 0.00 0.00 37.83 33.14 1p2q s LYS 82 CO -0.06 -1.00 -0.00 -0.51 -0.92 0.00 0.00 175.35 172.85 1p2q s LEU 83 N 2.68 3.32 0.51 3.17 1.43 0.18 -4.95 118.68 125.02 1p2q s LEU 83 Ca 0.20 -0.14 -0.19 0.00 -1.03 0.00 0.00 54.13 52.96 1p2q s LEU 83 Cb -0.15 -1.83 -0.07 0.00 0.03 0.00 0.00 46.19 44.17 1p2q s LEU 83 CO 0.17 0.11 1.04 -0.54 0.23 0.00 0.00 176.35 177.37 1p2q s LYS 84 N 0.72 3.68 -0.25 1.70 1.02 -1.26 -0.70 119.74 124.65 1p2q s LYS 84 Ca -0.00 1.32 -0.11 0.00 0.02 0.00 0.00 55.97 57.20 1p2q s LYS 84 Cb -0.14 -2.08 -0.05 0.00 -0.52 0.00 0.00 37.83 35.04 1p2q s LYS 84 CO 0.02 -0.52 0.19 0.42 -0.92 0.00 0.00 175.35 174.54 1p2q s ILE 85 N -2.09 5.33 -0.08 2.17 1.01 -1.26 -0.64 121.20 125.64 1p2q s ILE 85 Ca 0.66 0.23 -0.21 0.00 0.00 0.00 0.00 60.65 61.33 1p2q s ILE 85 Cb -0.16 -3.53 -0.29 0.00 0.01 0.00 0.00 42.46 38.48 1p2q s ILE 85 CO 0.24 0.31 0.76 0.00 0.00 0.00 0.00 174.94 176.25 1p2q h ALA 86 N 7.77 0.01 -2.48 9.38 0.00 -0.75 -3.44 119.26 129.75 1p2q h ALA 86 Ca -0.37 -0.81 -0.11 0.00 0.00 0.00 0.00 54.91 53.63 1p2q h ALA 86 Cb 1.17 0.22 -0.21 0.00 0.00 0.00 0.00 17.79 18.97 1p2q h ALA 86 CO 0.63 0.48 -0.16 0.21 0.00 0.00 0.00 179.25 180.41 1p2q s LYS 87 N -2.42 0.68 -0.17 0.00 2.20 -1.02 -4.97 119.74 114.05 1p2q s LYS 87 Ca -0.16 0.20 -0.04 0.00 -0.36 0.00 0.00 55.97 55.60 1p2q s LYS 87 Cb 0.02 0.32 -0.03 0.00 -1.51 0.00 0.00 37.83 36.63 1p2q s LYS 87 CO 0.79 -0.16 -0.02 0.08 -0.36 0.00 0.00 175.35 175.68 1p2q s VAL 88 N -0.70 3.93 -0.53 4.02 1.01 -1.26 -1.14 120.40 125.73 1p2q s VAL 88 Ca -0.08 -0.34 0.01 0.00 0.00 0.00 0.00 61.98 61.57 1p2q s VAL 88 Cb -0.04 -2.74 0.14 0.00 0.00 0.00 0.00 36.38 33.74 1p2q s VAL 88 CO 0.04 0.47 0.30 -0.36 0.00 0.00 0.00 175.10 175.55 1p2q s PHE 89 N 0.57 3.37 0.09 5.22 0.40 0.89 -4.99 117.98 123.53 1p2q s PHE 89 Ca -0.02 -2.92 -0.26 0.00 -0.60 0.00 0.00 56.93 53.13 1p2q s PHE 89 Cb -0.14 -3.01 -0.06 0.00 0.51 0.00 0.00 43.02 40.32 1p2q s PHE 89 CO 0.02 -0.82 0.82 0.21 0.70 0.00 0.00 175.22 176.15 1p2q s LYS 90 N 0.06 4.57 0.08 0.44 2.20 -1.26 -0.58 119.74 125.25 1p2q s LYS 90 Ca 0.15 1.19 -0.31 0.00 -0.36 0.00 0.00 55.97 56.65 1p2q s LYS 90 Cb -0.23 -3.35 -0.09 0.00 -1.51 0.00 0.00 37.83 32.66 1p2q s LYS 90 CO -0.03 0.32 1.79 1.21 -0.36 0.00 0.00 175.35 178.29 1p2q s ASN 91 N -0.27 6.50 0.41 1.43 3.84 -0.91 -4.83 114.94 121.10 1p2q s ASN 91 Ca 0.40 2.63 0.28 0.00 0.21 0.00 0.00 52.86 56.39 1p2q s ASN 91 Cb -0.22 -2.56 1.40 0.00 -0.55 0.00 0.00 41.25 39.32 1p2q s ASN 91 CO 0.26 -0.98 1.86 0.77 -2.79 0.00 0.00 177.10 176.22 1p2q h SER 92 N 8.97 0.00 0.08 -4.21 4.64 -1.94 -1.64 113.55 119.46 1p2q h SER 92 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1p2q h SER 92 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1p2q h SER 92 CO 0.94 0.00 -0.07 0.29 -0.87 0.00 0.00 176.83 177.12 1p2q n LYS 93 N -2.54 1.31 -1.69 4.77 5.02 -1.26 -4.89 118.16 118.88 1p2q n LYS 93 Ca -0.00 -0.69 -0.45 0.00 -2.02 0.00 0.00 58.31 55.15 1p2q n LYS 93 Cb 0.14 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.62 1p2q n LYS 93 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 1p2q n TYR 94 N -0.25 2.47 -3.53 2.13 9.36 -0.62 -4.68 117.16 122.05 1p2q n TYR 94 Ca 0.17 0.12 -0.42 0.00 3.32 0.00 0.00 57.90 61.09 1p2q n TYR 94 Cb 0.32 -2.62 -0.10 0.00 -0.63 0.00 0.00 39.34 36.31 1p2q n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1p2q s ASN 95 N 1.54 5.89 0.00 2.98 3.84 -0.42 -4.95 114.94 123.83 1p2q s ASN 95 Ca 0.79 -1.12 0.12 0.00 0.21 0.00 0.00 52.86 52.87 1p2q s ASN 95 Cb -0.60 -2.08 0.61 0.00 -0.55 0.00 0.00 41.25 38.62 1p2q s ASN 95 CO 0.37 -0.48 1.32 -1.54 -2.79 0.00 0.00 177.10 173.98 1p2q n SER 96 N 5.06 0.00 -0.13 -4.21 3.41 -1.26 0.43 113.62 116.92 1p2q n SER 96 Ca -0.11 0.17 -0.25 0.00 -0.26 0.00 0.00 58.87 58.42 1p2q n SER 96 Cb 0.45 -0.32 -0.10 0.00 -0.26 0.00 0.00 64.21 63.99 1p2q n SER 96 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1p2q n LEU 97 N -1.32 2.17 0.05 1.04 4.77 -1.26 -4.58 117.00 117.87 1p2q n LEU 97 Ca 0.05 0.19 0.12 0.00 -0.03 0.00 0.00 56.01 56.34 1p2q n LEU 97 Cb 0.10 -0.79 0.09 0.00 -2.33 0.00 0.00 43.42 40.49 1p2q n LEU 97 CO 0.10 0.65 0.16 0.35 -1.33 0.00 0.00 177.39 177.32 1p2q n THR 98 N -3.89 0.31 -1.17 -5.08 -2.24 -1.19 -4.96 114.28 96.06 1p2q n THR 98 Ca -0.49 -0.30 -0.06 0.00 -2.27 0.00 0.00 64.05 60.93 1p2q n THR 98 Cb 0.89 -0.03 -0.02 0.00 -2.10 0.00 0.00 70.33 69.07 1p2q n THR 98 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1p2q n ILE 99 N -2.12 0.00 -2.45 2.28 2.08 0.17 -4.95 119.36 114.36 1p2q n ILE 99 Ca 0.02 0.00 -0.33 0.00 0.56 0.00 0.00 62.75 63.00 1p2q n ILE 99 Cb 0.45 -0.89 -0.03 0.00 -0.75 0.00 0.00 39.64 38.43 1p2q n ILE 99 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 1p2q s ASN 100 N -2.58 6.34 -1.19 4.38 2.47 -1.23 -3.80 114.94 119.34 1p2q s ASN 100 Ca 0.00 1.82 -0.05 0.00 0.42 0.00 0.00 52.86 55.05 1p2q s ASN 100 Cb 0.00 -2.54 0.01 0.00 -1.45 0.00 0.00 41.25 37.26 1p2q s ASN 100 CO 0.00 -0.78 1.02 0.59 -3.72 0.00 0.00 177.10 174.21 1p2q n ASN 101 N -1.25 -4.33 -4.11 -4.21 3.02 -1.26 -1.30 115.26 101.82 1p2q n ASN 101 Ca 0.08 -0.53 -0.42 0.00 -0.03 0.00 0.00 54.58 53.68 1p2q n ASN 101 Cb 0.53 -4.70 0.00 0.00 -0.61 0.00 0.00 39.78 35.00 1p2q n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1p2q n ASP 102 N -2.78 4.38 -3.80 6.41 2.03 -1.25 -3.93 116.55 117.61 1p2q n ASP 102 Ca -0.11 -2.88 -0.13 0.00 0.52 0.00 0.00 54.79 52.19 1p2q n ASP 102 Cb 0.60 -1.69 -0.11 0.00 -0.72 0.00 0.00 41.12 39.19 1p2q n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1p2q s ILE 103 N 3.52 0.01 -0.01 5.18 2.07 -1.26 -3.65 121.20 127.07 1p2q s ILE 103 Ca 0.50 -0.09 -0.02 0.00 -1.41 0.00 0.00 60.65 59.63 1p2q s ILE 103 Cb 0.09 -0.36 0.00 0.00 0.13 0.00 0.00 42.46 42.33 1p2q s ILE 103 CO -0.01 -0.05 0.04 -0.89 -1.91 0.00 0.00 174.94 172.12 1p2q s THR 104 N -0.09 0.02 -0.04 4.00 2.01 -0.04 -2.13 115.64 119.37 1p2q s THR 104 Ca -0.02 -0.19 0.02 0.00 0.31 0.00 0.00 61.69 61.80 1p2q s THR 104 Cb -0.02 -0.13 -0.03 0.00 0.01 0.00 0.00 72.50 72.33 1p2q s THR 104 CO 0.01 -0.11 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.01 1p2q s LEU 105 N -0.31 3.19 -0.17 4.42 1.43 0.26 -0.84 118.68 126.66 1p2q s LEU 105 Ca -0.04 -0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.01 1p2q s LEU 105 Cb -0.02 -1.75 0.01 0.00 0.03 0.00 0.00 46.19 44.46 1p2q s LEU 105 CO -0.00 0.33 -0.18 -0.76 0.23 0.00 0.00 176.35 175.97 1p2q s LEU 106 N -1.05 2.23 -0.23 1.79 1.43 0.56 -0.08 118.68 123.33 1p2q s LEU 106 Ca 0.14 -0.60 -0.14 0.00 -1.03 0.00 0.00 54.13 52.50 1p2q s LEU 106 Cb -0.11 -1.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.56 1p2q s LEU 106 CO 0.04 0.02 0.34 -0.75 0.23 0.00 0.00 176.35 176.23 1p2q s LYS 107 N 1.18 4.09 0.35 1.70 2.20 -0.29 -1.29 119.74 127.68 1p2q s LYS 107 Ca 0.02 0.05 -0.26 0.00 -0.36 0.00 0.00 55.97 55.42 1p2q s LYS 107 Cb -0.14 -3.58 -0.09 0.00 -1.51 0.00 0.00 37.83 32.50 1p2q s LYS 107 CO -0.09 -0.11 1.00 -0.51 -0.36 0.00 0.00 175.35 175.28 1p2q s LEU 108 N 1.55 4.29 0.11 5.43 1.43 0.08 -0.13 118.68 131.44 1p2q s LEU 108 Ca 0.15 1.96 -0.14 0.00 -1.03 0.00 0.00 54.13 55.07 1p2q s LEU 108 Cb -0.15 -4.03 -0.06 0.00 0.03 0.00 0.00 46.19 41.98 1p2q s LEU 108 CO 0.08 -0.23 1.46 0.28 0.23 0.00 0.00 176.35 178.17 1p2q h SER 109 N 3.00 0.78 -3.95 2.29 0.02 -1.15 -3.41 113.55 111.13 1p2q h SER 109 Ca -0.47 -0.43 -0.60 0.00 -0.84 0.00 0.00 61.79 59.44 1p2q h SER 109 Cb 1.20 -0.22 -0.31 0.00 0.14 0.00 0.00 62.40 63.21 1p2q h SER 109 CO 0.64 1.04 -0.85 -0.89 -1.14 0.00 0.00 176.83 175.63 1p2q s THR 110 N -4.52 1.62 0.67 -2.27 2.01 -1.26 -4.97 115.64 106.93 1p2q s THR 110 Ca -0.12 -0.82 -0.17 0.00 0.31 0.00 0.00 61.69 60.89 1p2q s THR 110 Cb 0.09 -1.38 0.01 0.00 0.01 0.00 0.00 72.50 71.23 1p2q s THR 110 CO 0.83 0.46 1.22 0.00 -0.69 0.00 0.00 174.62 176.44 1p2q s ALA 111 N -0.03 2.31 0.44 7.40 0.00 -1.26 -4.78 121.76 125.83 1p2q s ALA 111 Ca -0.03 0.98 -0.20 0.00 0.00 0.00 0.00 51.96 52.71 1p2q s ALA 111 Cb -0.12 -3.48 -0.10 0.00 0.00 0.00 0.00 23.12 19.42 1p2q s ALA 111 CO 0.03 -1.59 0.94 0.00 0.00 0.00 0.00 175.76 175.13 1p2q s ALA 112 N -1.75 3.07 -0.50 0.00 0.00 0.68 -5.02 121.76 118.24 1p2q s ALA 112 Ca 0.77 0.33 -0.16 0.00 0.00 0.00 0.00 51.96 52.90 1p2q s ALA 112 Cb -0.31 -3.11 0.09 0.00 0.00 0.00 0.00 23.12 19.79 1p2q s ALA 112 CO 0.40 0.08 0.44 0.45 0.00 0.00 0.00 175.76 177.14 1p2q s SER 113 N -2.35 6.17 0.35 0.00 0.15 -1.26 -4.82 113.70 111.94 1p2q s SER 113 Ca 0.61 -1.48 -0.29 0.00 0.70 0.00 0.00 55.95 55.49 1p2q s SER 113 Cb -0.09 -2.20 -0.11 0.00 -1.71 0.00 0.00 66.02 61.91 1p2q s SER 113 CO 0.17 -0.73 1.48 -0.36 1.20 0.00 0.00 173.24 174.99 1p2q s PHE 114 N 1.67 2.68 0.00 3.44 0.40 -1.26 -4.78 117.98 120.13 1p2q s PHE 114 Ca 0.04 1.13 0.00 0.00 -0.60 0.00 0.00 56.93 57.50 1p2q s PHE 114 Cb -0.26 -3.99 0.00 0.00 0.51 0.00 0.00 43.02 39.28 1p2q s PHE 114 CO 0.05 -2.96 0.00 -1.13 0.70 0.00 0.00 175.22 171.89 1p2q n SER 115 N 0.85 0.00 -0.26 1.36 3.41 0.17 -4.94 113.62 114.22 1p2q n SER 115 Ca 0.02 -0.70 0.13 0.00 -0.26 0.00 0.00 58.87 58.07 1p2q n SER 115 Cb 0.39 0.00 0.40 0.00 -0.26 0.00 0.00 64.21 64.74 1p2q n SER 115 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1p2q h GLN 116 N 0.00 0.62 -0.12 4.33 4.15 -1.98 -2.54 115.11 119.57 1p2q h GLN 116 Ca 0.00 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.38 1p2q h GLN 116 Cb 0.00 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.55 1p2q h GLN 116 CO 0.00 0.41 0.00 0.25 -1.93 0.00 0.00 178.83 177.56 1p2q n THR 117 N -4.56 0.27 -3.70 2.39 -2.24 -1.26 -4.17 114.28 101.01 1p2q n THR 117 Ca 0.17 -0.64 -0.26 0.00 -2.27 0.00 0.00 64.05 61.06 1p2q n THR 117 Cb 0.50 1.05 -0.17 0.00 -2.10 0.00 0.00 70.33 69.61 1p2q n THR 117 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1p2q s VAL 118 N -1.01 0.30 0.36 2.28 1.01 -0.96 -4.12 120.40 118.26 1p2q s VAL 118 Ca 0.17 -0.29 -0.16 0.00 0.00 0.00 0.00 61.98 61.70 1p2q s VAL 118 Cb 0.11 -0.79 0.04 0.00 0.00 0.00 0.00 36.38 35.75 1p2q s VAL 118 CO 0.16 -0.13 0.74 -0.94 0.00 0.00 0.00 175.10 174.93 1p2q s SER 119 N 1.97 0.02 0.21 3.32 1.04 -0.94 0.45 113.70 119.77 1p2q s SER 119 Ca 0.01 -1.06 0.01 0.00 0.48 0.00 0.00 55.95 55.39 1p2q s SER 119 Cb -0.16 0.80 -0.04 0.00 0.10 0.00 0.00 66.02 66.73 1p2q s SER 119 CO -0.08 -1.57 0.38 0.00 0.98 0.00 0.00 173.24 172.95 1p2q s ALA 120 N -2.75 3.86 0.25 5.32 0.00 -1.26 -2.62 121.76 124.55 1p2q s ALA 120 Ca 0.16 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 51.17 1p2q s ALA 120 Cb -0.05 -1.92 -0.04 0.00 0.00 0.00 0.00 23.12 21.11 1p2q s ALA 120 CO 0.11 0.37 0.43 0.54 0.00 0.00 0.00 175.76 177.22 1p2q s VAL 121 N -1.91 5.18 0.33 0.00 0.11 -0.53 -1.36 120.40 122.22 1p2q s VAL 121 Ca 0.37 -0.44 -0.13 0.00 -2.93 0.00 0.00 61.98 58.85 1p2q s VAL 121 Cb -0.11 -3.78 -0.08 0.00 -1.53 0.00 0.00 36.38 30.88 1p2q s VAL 121 CO 0.30 -0.29 0.73 0.00 -3.33 0.00 0.00 175.10 172.50 1p2q s LEU 123 N -3.17 4.02 0.82 0.00 1.43 -1.26 -0.84 118.68 119.69 1p2q s LEU 123 Ca 0.53 0.25 -0.10 0.00 -1.03 0.00 0.00 54.13 53.78 1p2q s LEU 123 Cb -0.10 -2.19 0.13 0.00 0.03 0.00 0.00 46.19 44.06 1p2q s LEU 123 CO 0.21 0.32 1.15 -2.16 0.23 0.00 0.00 176.35 176.10 1p2q s PRO 124 N -1.45 1.44 0.07 1.29 0.04 -1.26 -4.92 135.00 130.21 1p2q s PRO 124 Ca 0.20 -0.45 -0.08 0.00 0.04 0.00 0.00 61.00 60.70 1p2q s PRO 124 Cb -0.12 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.32 1p2q s PRO 124 CO 0.10 -1.79 0.36 -1.12 0.04 0.00 0.00 177.00 174.59 1p2q s SER 125 N -4.72 6.58 0.59 6.66 0.01 -1.26 -4.94 113.70 116.63 1p2q s SER 125 Ca 0.67 0.71 0.29 0.00 1.31 0.00 0.00 55.95 58.92 1p2q s SER 125 Cb -0.07 -2.14 1.46 0.00 0.21 0.00 0.00 66.02 65.48 1p2q s SER 125 CO 0.48 0.18 1.87 0.00 0.41 0.00 0.00 173.24 176.18 1p2q h ALA 126 N 3.67 2.17 -0.01 1.44 0.00 -1.92 0.16 119.26 124.77 1p2q h ALA 126 Ca -0.49 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1p2q h ALA 126 Cb 1.19 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1p2q h ALA 126 CO 0.67 -0.74 -0.43 -1.13 0.00 0.00 0.00 179.25 177.62 1p2q n SER 127 N -3.65 1.03 -4.74 0.00 3.41 -1.26 -4.73 113.62 103.68 1p2q n SER 127 Ca 0.08 -0.82 -0.40 0.00 -0.26 0.00 0.00 58.87 57.47 1p2q n SER 127 Cb 0.69 0.30 0.02 0.00 -0.26 0.00 0.00 64.21 64.97 1p2q n SER 127 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1p2q n ASP 128 N -0.86 3.01 -4.16 4.04 8.00 0.57 -5.00 116.55 122.14 1p2q n ASP 128 Ca 0.09 1.09 -0.33 0.00 0.71 0.00 0.00 54.79 56.35 1p2q n ASP 128 Cb 0.36 -1.57 -0.16 0.00 -0.02 0.00 0.00 41.12 39.73 1p2q n ASP 128 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1p2q s ASP 129 N -0.57 3.31 -0.45 -2.24 2.15 -1.26 -4.96 116.67 112.64 1p2q s ASP 129 Ca 0.63 -0.60 -0.03 0.00 0.43 0.00 0.00 52.55 52.99 1p2q s ASP 129 Cb -0.45 -1.51 0.12 0.00 -0.30 0.00 0.00 42.92 40.77 1p2q s ASP 129 CO 0.56 0.02 0.25 -0.36 -0.17 0.00 0.00 175.17 175.47 1p2q s PHE 130 N 1.19 3.55 0.40 -5.34 0.08 -1.26 -5.08 117.98 111.52 1p2q s PHE 130 Ca 0.02 -2.47 -0.24 0.00 0.12 0.00 0.00 56.93 54.36 1p2q s PHE 130 Cb -0.14 -3.22 -0.12 0.00 -0.57 0.00 0.00 43.02 38.97 1p2q s PHE 130 CO -0.09 -0.95 0.89 0.00 -0.10 0.00 0.00 175.22 174.97 1p2q n ALA 131 N 4.37 -0.35 -1.77 5.36 0.00 -1.26 -4.93 120.51 121.93 1p2q n ALA 131 Ca -0.00 0.24 -0.40 0.00 0.00 0.00 0.00 53.44 53.28 1p2q n ALA 131 Cb 0.41 -1.99 -0.01 0.00 0.00 0.00 0.00 19.45 17.86 1p2q n ALA 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p2q s ALA 132 N -1.28 3.36 0.00 0.00 0.00 -1.26 -2.17 121.76 120.41 1p2q s ALA 132 Ca 0.63 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.91 1p2q s ALA 132 Cb -0.60 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.01 1p2q s ALA 132 CO 0.57 -0.86 0.00 0.41 0.00 0.00 0.00 175.76 175.89 1p2q n GLY 133 N 0.66 1.60 3.75 0.00 0.00 0.90 -4.95 105.19 107.14 1p2q n GLY 133 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1p2q n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p2q s THR 134 N -2.35 2.39 -0.34 2.61 2.01 -0.92 -4.59 115.64 114.45 1p2q s THR 134 Ca 0.00 0.33 -0.25 0.00 0.31 0.00 0.00 61.69 62.08 1p2q s THR 134 Cb 0.00 -3.21 0.01 0.00 0.01 0.00 0.00 72.50 69.31 1p2q s THR 134 CO 0.00 0.05 0.89 -0.89 -0.69 0.00 0.00 174.62 173.99 1p2q s THR 135 N 0.00 4.65 0.21 -0.82 2.01 -1.26 -1.22 115.64 119.21 1p2q s THR 135 Ca 0.61 1.26 0.00 0.00 0.31 0.00 0.00 61.69 63.87 1p2q s THR 135 Cb -0.45 -4.28 -0.00 0.00 0.01 0.00 0.00 72.50 67.79 1p2q s THR 135 CO 0.45 -0.42 0.00 0.00 -0.69 0.00 0.00 174.62 173.96 1p2q s VAL 137 N -1.75 0.30 0.07 0.00 1.01 0.39 -1.23 120.40 119.19 1p2q s VAL 137 Ca 0.00 -0.55 0.06 0.00 0.00 0.00 0.00 61.98 61.49 1p2q s VAL 137 Cb 0.00 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 36.02 1p2q s VAL 137 CO 0.00 -0.17 -0.17 0.28 0.00 0.00 0.00 175.10 175.04 1p2q s THR 138 N -0.72 1.36 0.11 3.92 -1.32 -0.62 -0.16 115.64 118.21 1p2q s THR 138 Ca -0.05 -1.30 0.01 0.00 -1.21 0.00 0.00 61.69 59.13 1p2q s THR 138 Cb -0.05 -1.25 -0.04 0.00 -1.51 0.00 0.00 72.50 69.64 1p2q s THR 138 CO -0.00 -0.08 -0.03 0.42 -2.21 0.00 0.00 174.62 172.72 1p2q s THR 139 N -1.09 0.52 0.00 5.08 -4.23 -1.18 -1.60 115.64 113.14 1p2q s THR 139 Ca 0.02 -1.92 0.00 0.00 -1.18 0.00 0.00 61.69 58.62 1p2q s THR 139 Cb -0.09 -1.78 0.00 0.00 1.34 0.00 0.00 72.50 71.97 1p2q s THR 139 CO 0.03 -0.77 0.00 0.61 -0.54 0.00 0.00 174.62 173.94 1p2q n GLY 140 N -0.06 0.73 1.43 3.99 0.00 -0.75 -4.34 105.19 106.20 1p2q n GLY 140 Ca -0.11 -1.20 0.04 0.00 0.00 0.00 0.00 46.02 44.75 1p2q n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1p2q n TRP 141 N -1.00 1.60 -0.93 1.61 8.01 -1.26 -1.63 117.44 123.83 1p2q n TRP 141 Ca 0.00 -0.99 -0.29 0.00 -1.31 0.00 0.00 57.50 54.91 1p2q n TRP 141 Cb 0.00 -0.47 0.20 0.00 -2.01 0.00 0.00 31.31 29.03 1p2q n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1p2q s GLY 142 N -1.50 1.57 0.41 6.99 0.00 -1.26 -4.05 107.32 109.49 1p2q s GLY 142 Ca 0.49 -0.20 -0.25 0.00 0.00 0.00 0.00 44.72 44.76 1p2q s GLY 142 CO 0.11 0.43 1.06 1.04 0.00 0.00 0.00 173.10 175.73 1p2q n LEU 143 N -4.41 2.80 -0.24 0.66 4.77 -0.22 -2.52 117.00 117.84 1p2q n LEU 143 Ca 0.05 1.06 0.10 0.00 -0.03 0.00 0.00 56.01 57.19 1p2q n LEU 143 Cb 0.56 -1.37 -0.06 0.00 -2.33 0.00 0.00 43.42 40.21 1p2q n LEU 143 CO 0.57 -1.32 0.12 0.35 -1.33 0.00 0.00 177.39 175.78 1p2q n THR 144 N -0.38 0.00 -3.70 -5.08 -2.24 -1.26 -0.38 114.28 101.25 1p2q n THR 144 Ca 0.09 -0.14 -0.10 0.00 -2.27 0.00 0.00 64.05 61.62 1p2q n THR 144 Cb 0.39 1.12 -0.11 0.00 -2.10 0.00 0.00 70.33 69.63 1p2q n THR 144 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1p2q s ARG 145 N -2.67 0.38 -0.96 -0.78 3.03 -1.26 -4.01 118.95 112.67 1p2q s ARG 145 Ca 0.13 0.78 -0.22 0.00 2.03 0.00 0.00 55.73 58.45 1p2q s ARG 145 Cb 0.16 -0.02 0.08 0.00 -1.03 0.00 0.00 34.95 34.14 1p2q s ARG 145 CO 0.70 -0.16 1.31 -0.47 -1.13 0.00 0.00 175.30 175.54 1p2q s TYR 146 N 1.43 2.74 0.00 5.89 5.04 -1.26 -4.94 117.35 126.25 1p2q s TYR 146 Ca -0.09 -1.00 0.00 0.00 -2.44 0.00 0.00 57.07 53.54 1p2q s TYR 146 Cb -0.09 -4.53 0.00 0.00 0.35 0.00 0.00 41.96 37.69 1p2q s TYR 146 CO -0.12 -1.77 0.00 0.00 -1.34 0.00 0.00 175.55 172.32 1p2q n ALA 149 N 8.01 0.00 -2.61 3.97 0.00 -1.26 -5.13 120.51 123.49 1p2q n ALA 149 Ca 0.27 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.49 1p2q n ALA 149 Cb 0.50 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.90 1p2q n ALA 149 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1p2q s ASN 150 N 0.00 5.05 0.63 0.00 2.47 -1.26 -5.08 114.94 116.76 1p2q s ASN 150 Ca 0.00 -0.54 -0.16 0.00 0.42 0.00 0.00 52.86 52.59 1p2q s ASN 150 Cb 0.00 -0.99 -0.01 0.00 -1.45 0.00 0.00 41.25 38.79 1p2q s ASN 150 CO 0.00 -0.20 1.10 0.42 -3.72 0.00 0.00 177.10 174.70 1p2q s THR 151 N -2.30 3.34 0.50 -5.21 -4.23 -1.26 -4.73 115.64 101.74 1p2q s THR 151 Ca 0.36 0.65 -0.21 0.00 -1.18 0.00 0.00 61.69 61.31 1p2q s THR 151 Cb -0.05 -3.17 -0.07 0.00 1.34 0.00 0.00 72.50 70.54 1p2q s THR 151 CO 0.24 -0.36 1.12 -2.16 -0.54 0.00 0.00 174.62 172.91 1p2q s PRO 152 N -4.00 3.62 0.12 3.99 0.04 -1.26 -4.94 135.00 132.58 1p2q s PRO 152 Ca 0.67 1.60 -0.12 0.00 0.04 0.00 0.00 61.00 63.20 1p2q s PRO 152 Cb -0.20 -2.18 -0.10 0.00 0.04 0.00 0.00 34.50 32.06 1p2q s PRO 152 CO 0.39 -0.63 1.38 -0.44 0.04 0.00 0.00 177.00 177.74 1p2q h ASP 153 N 1.61 0.96 -2.96 6.66 3.32 -1.93 -3.45 116.42 120.61 1p2q h ASP 153 Ca -0.50 -0.55 -0.62 0.00 0.02 0.00 0.00 57.03 55.38 1p2q h ASP 153 Cb 1.25 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 40.46 1p2q h ASP 153 CO 0.59 1.35 -0.25 -0.13 -1.72 0.00 0.00 179.24 179.08 1p2q s ARG 154 N -4.00 3.82 0.21 3.56 0.52 -1.26 -0.43 118.95 121.37 1p2q s ARG 154 Ca -0.10 0.30 -0.32 0.00 -0.52 0.00 0.00 55.73 55.08 1p2q s ARG 154 Cb 0.10 -3.19 -0.14 0.00 0.52 0.00 0.00 34.95 32.23 1p2q s ARG 154 CO 0.90 0.69 1.40 -0.11 0.02 0.00 0.00 175.30 178.19 1p2q n LEU 155 N 1.74 2.78 -4.74 2.53 7.94 -0.56 -4.88 117.00 121.81 1p2q n LEU 155 Ca -0.14 1.13 -0.23 0.00 -1.11 0.00 0.00 56.01 55.66 1p2q n LEU 155 Cb 0.53 -1.38 -0.06 0.00 0.53 0.00 0.00 43.42 43.04 1p2q n LEU 155 CO 0.37 -0.61 -0.22 -1.10 -1.11 0.00 0.00 177.39 174.72 1p2q s GLN 156 N -0.11 2.52 0.07 1.96 -1.52 -0.65 -1.37 119.66 120.56 1p2q s GLN 156 Ca 0.72 -1.36 -0.08 0.00 -1.95 0.00 0.00 55.36 52.69 1p2q s GLN 156 Cb -0.70 -2.30 -0.01 0.00 -0.22 0.00 0.00 33.01 29.78 1p2q s GLN 156 CO 0.48 0.26 0.16 1.14 -0.25 0.00 0.00 175.29 177.08 1p2q s GLN 157 N -3.81 0.77 -0.22 2.91 -2.07 0.22 -1.82 119.66 115.65 1p2q s GLN 157 Ca 0.35 -0.90 -0.21 0.00 -1.82 0.00 0.00 55.36 52.78 1p2q s GLN 157 Cb -0.05 0.31 0.06 0.00 -1.09 0.00 0.00 33.01 32.23 1p2q s GLN 157 CO 0.23 -0.23 0.59 0.00 -1.32 0.00 0.00 175.29 174.56 1p2q s ALA 158 N -3.52 -1.47 0.01 2.60 0.00 -0.62 -0.77 121.76 117.99 1p2q s ALA 158 Ca 0.02 1.68 -0.14 0.00 0.00 0.00 0.00 51.96 53.52 1p2q s ALA 158 Cb 0.04 -0.97 -0.06 0.00 0.00 0.00 0.00 23.12 22.12 1p2q s ALA 158 CO -0.09 -0.28 0.41 -1.12 0.00 0.00 0.00 175.76 174.67 1p2q s SER 159 N 0.33 6.79 -0.04 0.00 0.01 -1.26 -1.59 113.70 117.93 1p2q s SER 159 Ca -0.00 0.94 -0.29 0.00 1.31 0.00 0.00 55.95 57.91 1p2q s SER 159 Cb -0.04 -2.24 0.06 0.00 0.21 0.00 0.00 66.02 64.01 1p2q s SER 159 CO 0.01 0.31 0.64 -1.48 0.41 0.00 0.00 173.24 173.12 1p2q s LEU 160 N -1.17 -0.49 0.28 2.44 2.34 -0.36 -4.92 118.68 116.79 1p2q s LEU 160 Ca 0.25 0.64 -0.19 0.00 0.06 0.00 0.00 54.13 54.89 1p2q s LEU 160 Cb -0.16 2.40 -0.09 0.00 -0.56 0.00 0.00 46.19 47.77 1p2q s LEU 160 CO 0.14 -0.60 0.76 -2.16 -1.06 0.00 0.00 176.35 173.43 1p2q s PRO 161 N -1.23 4.20 0.37 1.48 0.04 -1.26 -0.83 135.00 137.77 1p2q s PRO 161 Ca -0.11 0.86 -0.25 0.00 0.04 0.00 0.00 61.00 61.54 1p2q s PRO 161 Cb -0.01 -2.68 -0.09 0.00 0.04 0.00 0.00 34.50 31.76 1p2q s PRO 161 CO 0.09 0.28 1.01 -0.51 0.04 0.00 0.00 177.00 177.91 1p2q s LEU 162 N -2.39 4.20 0.10 -3.56 1.43 -0.36 -1.68 118.68 116.43 1p2q s LEU 162 Ca 0.48 1.94 0.06 0.00 -1.03 0.00 0.00 54.13 55.59 1p2q s LEU 162 Cb -0.14 -4.14 -0.04 0.00 0.03 0.00 0.00 46.19 41.89 1p2q s LEU 162 CO 0.20 -0.32 -0.05 -0.76 0.23 0.00 0.00 176.35 175.64 1p2q s LEU 163 N -2.45 3.26 0.54 1.79 1.43 0.15 -0.07 118.68 123.32 1p2q s LEU 163 Ca 0.55 -0.27 -0.18 0.00 -1.03 0.00 0.00 54.13 53.20 1p2q s LEU 163 Cb -0.20 -2.02 -0.06 0.00 0.03 0.00 0.00 46.19 43.94 1p2q s LEU 163 CO 0.25 0.18 1.04 -0.94 0.23 0.00 0.00 176.35 177.11 1p2q s SER 164 N -2.25 6.11 0.34 2.29 1.04 -1.26 -4.40 113.70 115.56 1p2q s SER 164 Ca 0.24 1.85 0.04 0.00 0.48 0.00 0.00 55.95 58.55 1p2q s SER 164 Cb -0.11 -2.54 0.66 0.00 0.10 0.00 0.00 66.02 64.12 1p2q s SER 164 CO 0.16 -0.94 1.95 0.78 0.98 0.00 0.00 173.24 176.17 1p2q h ASN 165 N 0.99 0.75 -0.61 7.02 2.35 -1.97 -0.53 115.58 123.58 1p2q h ASN 165 Ca -0.48 -0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.24 1p2q h ASN 165 Cb 1.22 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 39.40 1p2q h ASN 165 CO 0.58 0.50 0.27 0.74 -1.65 0.00 0.00 177.43 177.87 1p2q h THR 166 N 0.86 1.22 -0.30 2.81 2.02 -1.99 0.14 112.91 117.67 1p2q h THR 166 Ca 0.32 -0.67 -0.14 0.00 0.77 0.00 0.00 66.41 66.70 1p2q h THR 166 Cb 0.18 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 1p2q h THR 166 CO -0.11 0.27 -0.38 -1.13 0.37 0.00 0.00 175.52 174.54 1p2q h ASN 167 N 0.85 0.75 -0.25 4.18 -0.00 -1.73 -3.01 115.58 116.37 1p2q h ASN 167 Ca 0.21 -0.33 -0.03 0.00 -0.00 0.00 0.00 56.30 56.15 1p2q h ASN 167 Cb 0.16 -0.21 -0.01 0.00 -0.00 0.00 0.00 38.32 38.26 1p2q h ASN 167 CO -0.02 1.05 0.03 0.00 -0.00 0.00 0.00 177.43 178.49 1p2q h LYS 169 N 0.21 0.00 -0.02 0.00 1.57 -0.93 -0.62 116.57 116.78 1p2q h LYS 169 Ca 0.07 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.86 1p2q h LYS 169 Cb 0.34 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 1p2q h LYS 169 CO 0.01 0.00 0.04 0.87 -0.57 0.00 0.00 179.45 179.80 1p2q h LYS 170 N 0.00 0.00 0.00 3.15 1.57 -1.35 0.12 116.57 120.07 1p2q h LYS 170 Ca 0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 1p2q h LYS 170 Cb 0.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1p2q h LYS 170 CO 0.00 0.00 -0.92 0.98 -0.57 0.00 0.00 179.45 178.94 1p2q n TYR 171 N -3.50 0.00 1.03 -1.35 4.19 -0.31 -4.77 117.16 112.45 1p2q n TYR 171 Ca -0.02 0.00 0.14 0.00 3.31 0.00 0.00 57.90 61.32 1p2q n TYR 171 Cb 0.12 -0.32 0.58 0.00 0.49 0.00 0.00 39.34 40.22 1p2q n TYR 171 CO 0.00 0.00 0.00 0.91 0.91 0.00 0.00 176.86 178.68 1p2q n TRP 172 N -3.81 0.00 -2.73 2.98 7.02 -0.77 -5.01 117.44 115.12 1p2q n TRP 172 Ca -0.13 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.35 1p2q n TRP 172 Cb 0.40 -0.45 0.00 0.00 -2.42 0.00 0.00 31.31 28.84 1p2q n TRP 172 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1p2q n GLY 173 N 1.48 2.51 0.00 6.99 0.00 0.43 -2.09 105.19 114.51 1p2q n GLY 173 Ca 0.07 -0.29 0.07 0.00 0.00 0.00 0.00 46.02 45.87 1p2q n GLY 173 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1p2q n THR 174 N 0.00 0.00 0.48 2.61 -2.24 -1.26 -2.76 114.28 111.10 1p2q n THR 174 Ca 0.00 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 1p2q n THR 174 Cb 0.00 -0.67 0.44 0.00 -2.10 0.00 0.00 70.33 68.00 1p2q n THR 174 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1p2q h LYS 175 N 0.00 0.00 -5.99 -0.78 1.79 -1.84 -3.42 116.57 106.34 1p2q h LYS 175 Ca 0.00 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 57.88 1p2q h LYS 175 Cb 0.00 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 30.56 1p2q h LYS 175 CO 0.00 0.00 0.58 0.42 -1.08 0.00 0.00 179.45 179.37 1p2q s ILE 176 N -3.24 4.68 0.47 1.86 -1.09 -1.11 -5.02 121.20 117.75 1p2q s ILE 176 Ca 0.07 1.43 0.08 0.00 -2.23 0.00 0.00 60.65 60.00 1p2q s ILE 176 Cb 0.10 -4.26 0.02 0.00 -1.58 0.00 0.00 42.46 36.75 1p2q s ILE 176 CO 0.53 -0.33 0.52 -0.54 -1.23 0.00 0.00 174.94 173.89 1p2q s LYS 177 N 3.23 2.50 0.46 2.79 -0.14 -1.26 -5.03 119.74 122.29 1p2q s LYS 177 Ca 0.38 -1.57 0.31 0.00 -1.36 0.00 0.00 55.97 53.73 1p2q s LYS 177 Cb -0.13 -2.48 1.60 0.00 -1.68 0.00 0.00 37.83 35.14 1p2q s LYS 177 CO 0.13 -0.44 1.96 0.38 -0.76 0.00 0.00 175.35 176.62 1p2q h ASP 178 N 0.69 0.00 -0.56 2.83 3.04 -1.99 -2.48 116.42 117.96 1p2q h ASP 178 Ca -0.38 0.00 -0.25 0.00 -3.24 0.00 0.00 57.03 53.17 1p2q h ASP 178 Cb 1.28 0.00 -0.15 0.00 -1.04 0.00 0.00 39.33 39.42 1p2q h ASP 178 CO 0.51 0.00 0.17 0.00 -2.04 0.00 0.00 179.24 177.87 1p2q n ALA 179 N -1.92 4.51 -2.49 4.15 0.00 -1.26 -4.92 120.51 118.57 1p2q n ALA 179 Ca -0.01 -2.86 -0.25 0.00 0.00 0.00 0.00 53.44 50.31 1p2q n ALA 179 Cb 0.11 -0.99 -0.13 0.00 0.00 0.00 0.00 19.45 18.45 1p2q n ALA 179 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1p2q s MET 180 N -3.17 1.24 -0.01 0.00 -1.94 -0.93 -0.38 119.30 114.10 1p2q s MET 180 Ca 0.49 -1.17 0.00 0.00 -1.71 0.00 0.00 55.69 53.30 1p2q s MET 180 Cb 0.42 -1.54 0.01 0.00 2.01 0.00 0.00 34.83 35.74 1p2q s MET 180 CO 0.06 0.37 -0.00 -1.50 -0.01 0.00 0.00 175.02 173.93 1p2q s ILE 181 N -1.08 0.10 0.15 2.53 2.07 0.92 -4.63 121.20 121.26 1p2q s ILE 181 Ca 0.08 0.04 0.03 0.00 -1.41 0.00 0.00 60.65 59.39 1p2q s ILE 181 Cb -0.10 -0.15 -0.04 0.00 0.13 0.00 0.00 42.46 42.31 1p2q s ILE 181 CO 0.04 0.08 0.26 0.00 -1.91 0.00 0.00 174.94 173.41 1p2q s ALA 183 N -1.75 -1.63 0.00 0.00 0.00 -0.55 -0.68 121.76 117.16 1p2q s ALA 183 Ca 0.34 1.02 0.00 0.00 0.00 0.00 0.00 51.96 53.32 1p2q s ALA 183 Cb -0.11 0.22 0.00 0.00 0.00 0.00 0.00 23.12 23.23 1p2q s ALA 183 CO 0.28 -0.46 0.00 0.41 0.00 0.00 0.00 175.76 175.99 1p2q n GLY 184 N 0.62 0.67 2.37 0.00 0.00 -0.67 -0.62 105.19 107.55 1p2q n GLY 184 Ca -0.19 -1.69 -0.17 0.00 0.00 0.00 0.00 46.02 43.97 1p2q n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p2q n ALA 185 N 0.26 -0.45 -0.96 4.61 0.00 -1.09 -4.71 120.51 118.17 1p2q n ALA 185 Ca 0.00 0.22 0.09 0.00 0.00 0.00 0.00 53.44 53.75 1p2q n ALA 185 Cb 0.00 -1.82 0.17 0.00 0.00 0.00 0.00 19.45 17.80 1p2q n ALA 185 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1p2q n SER 186 N -1.39 2.80 0.00 0.00 3.41 -1.07 -4.63 113.62 112.73 1p2q n SER 186 Ca -0.19 -2.98 0.00 0.00 -0.26 0.00 0.00 58.87 55.45 1p2q n SER 186 Cb 0.61 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 1p2q n SER 186 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1p2q n GLY 187 N -1.06 0.67 3.27 5.00 0.00 -0.36 -5.06 105.19 107.66 1p2q n GLY 187 Ca 0.17 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.04 1p2q n GLY 187 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1p2q s VAL 188 N -2.00 0.69 -0.27 1.61 -7.23 -1.25 -4.70 120.40 107.24 1p2q s VAL 188 Ca 0.00 -1.99 -0.24 0.00 -1.81 0.00 0.00 61.98 57.94 1p2q s VAL 188 Cb 0.00 -2.28 0.08 0.00 0.56 0.00 0.00 36.38 34.74 1p2q s VAL 188 CO 0.00 -0.33 0.79 -0.55 -0.31 0.00 0.00 175.10 174.69 1p2q s SER 189 N -3.22 -0.70 0.80 4.85 0.15 -0.94 -4.23 113.70 110.40 1p2q s SER 189 Ca 0.28 1.33 -0.11 0.00 0.70 0.00 0.00 55.95 58.15 1p2q s SER 189 Cb 0.06 1.34 0.07 0.00 -1.71 0.00 0.00 66.02 65.78 1p2q s SER 189 CO 0.07 -0.23 1.09 -0.44 1.20 0.00 0.00 173.24 174.93 1p2q s SER 190 N 0.46 4.35 0.38 5.45 0.01 -1.26 0.20 113.70 123.29 1p2q s SER 190 Ca -0.00 1.69 -0.10 0.00 1.31 0.00 0.00 55.95 58.84 1p2q s SER 190 Cb -0.05 -2.40 0.04 0.00 0.21 0.00 0.00 66.02 63.81 1p2q s SER 190 CO -0.02 -2.11 0.67 0.00 0.41 0.00 0.00 173.24 172.19 1p2q n MET 192 N -0.55 0.07 0.00 0.00 1.56 -1.26 -0.47 117.12 116.47 1p2q n MET 192 Ca -0.05 0.02 0.00 0.00 -0.27 0.00 0.00 57.70 57.40 1p2q n MET 192 Cb 0.60 -1.55 0.00 0.00 2.15 0.00 0.00 33.22 34.42 1p2q n MET 192 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1p2q n GLY 193 N 6.50 1.88 0.13 -5.12 0.00 -1.26 -1.06 105.19 106.26 1p2q n GLY 193 Ca 0.48 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.57 1p2q n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1p2q h ASP 194 N 0.00 0.00 -1.63 1.61 3.32 -1.09 -3.35 116.42 115.28 1p2q h ASP 194 Ca 0.00 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.41 1p2q h ASP 194 Cb 0.00 0.00 0.12 0.00 0.22 0.00 0.00 39.33 39.67 1p2q h ASP 194 CO 0.00 0.23 -0.35 -1.20 -1.72 0.00 0.00 179.24 176.20 1p2q n SER 195 N -2.90 -0.58 0.00 6.45 7.64 -1.26 -1.39 113.62 121.57 1p2q n SER 195 Ca -0.01 1.10 0.00 0.00 1.01 0.00 0.00 58.87 60.96 1p2q n SER 195 Cb 0.65 -1.06 0.00 0.00 -1.01 0.00 0.00 64.21 62.79 1p2q n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1p2q n GLY 196 N 1.77 2.78 3.67 0.23 0.00 -0.02 0.10 105.19 113.72 1p2q n GLY 196 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1p2q n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1p2q s GLY 197 N -1.68 1.62 0.34 -0.02 0.00 -0.49 -3.34 107.32 103.76 1p2q s GLY 197 Ca 0.00 -0.99 -0.04 0.00 0.00 0.00 0.00 44.72 43.69 1p2q s GLY 197 CO 0.00 -0.13 0.61 2.56 0.00 0.00 0.00 173.10 176.14 1p2q s PRO 198 N -5.50 3.60 -0.28 2.90 0.04 -1.26 -1.41 135.00 133.10 1p2q s PRO 198 Ca 0.71 0.02 -0.01 0.00 0.04 0.00 0.00 61.00 61.76 1p2q s PRO 198 Cb -0.09 -2.58 0.09 0.00 0.04 0.00 0.00 34.50 31.96 1p2q s PRO 198 CO 0.55 0.11 0.07 -1.17 0.04 0.00 0.00 177.00 176.61 1p2q s LEU 199 N -3.92 2.00 0.11 -3.56 2.96 -0.55 -3.10 118.68 112.61 1p2q s LEU 199 Ca 0.44 -1.41 0.08 0.00 -0.22 0.00 0.00 54.13 53.02 1p2q s LEU 199 Cb -0.10 -0.82 -0.04 0.00 0.50 0.00 0.00 46.19 45.73 1p2q s LEU 199 CO 0.34 -0.38 -0.15 0.68 -1.32 0.00 0.00 176.35 175.52 1p2q s VAL 200 N 1.66 3.02 0.06 1.68 -7.23 0.77 -0.89 120.40 119.48 1p2q s VAL 200 Ca 0.06 -1.40 0.02 0.00 -1.81 0.00 0.00 61.98 58.85 1p2q s VAL 200 Cb -0.17 -2.39 -0.03 0.00 0.56 0.00 0.00 36.38 34.35 1p2q s VAL 200 CO -0.20 0.12 -0.07 0.00 -0.31 0.00 0.00 175.10 174.64 1p2q s LYS 202 N -2.40 4.65 -0.38 0.00 1.02 -1.26 -0.26 119.74 121.11 1p2q s LYS 202 Ca -0.02 1.48 0.01 0.00 0.02 0.00 0.00 55.97 57.46 1p2q s LYS 202 Cb -0.04 -3.01 0.14 0.00 -0.52 0.00 0.00 37.83 34.40 1p2q s LYS 202 CO -0.02 0.31 0.22 0.21 -0.92 0.00 0.00 175.35 175.16 1p2q s LYS 203 N -1.69 0.79 -0.69 1.68 2.20 0.27 -4.88 119.74 117.43 1p2q s LYS 203 Ca 0.47 -1.56 -0.01 0.00 -0.36 0.00 0.00 55.97 54.51 1p2q s LYS 203 Cb -0.24 -1.64 -0.01 0.00 -1.51 0.00 0.00 37.83 34.43 1p2q s LYS 203 CO 0.30 -1.19 0.58 0.09 -0.36 0.00 0.00 175.35 174.77 1p2q n ASN 204 N 3.87 -2.85 0.00 1.43 3.02 -1.26 -3.39 115.26 116.08 1p2q n ASN 204 Ca 0.11 -0.39 0.00 0.00 -0.03 0.00 0.00 54.58 54.27 1p2q n ASN 204 Cb 0.36 -3.28 0.00 0.00 -0.61 0.00 0.00 39.78 36.25 1p2q n ASN 204 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p2q n GLY 205 N -1.16 0.87 3.28 7.41 0.00 -1.26 -5.01 105.19 109.32 1p2q n GLY 205 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 1p2q n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p2q s ALA 206 N -3.58 1.77 -0.06 4.61 0.00 -1.22 -4.83 121.76 118.46 1p2q s ALA 206 Ca 0.00 -1.21 -0.25 0.00 0.00 0.00 0.00 51.96 50.50 1p2q s ALA 206 Cb 0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 23.12 22.84 1p2q s ALA 206 CO 0.00 0.36 0.78 -1.58 0.00 0.00 0.00 175.76 175.31 1p2q s TRP 207 N -1.13 3.59 -0.03 0.00 0.52 0.10 0.96 118.94 122.95 1p2q s TRP 207 Ca 0.06 1.36 0.07 0.00 0.02 0.00 0.00 56.10 57.61 1p2q s TRP 207 Cb -0.10 -2.89 -0.02 0.00 -1.15 0.00 0.00 33.47 29.31 1p2q s TRP 207 CO 0.04 0.05 -0.24 0.99 0.02 0.00 0.00 176.95 177.80 1p2q s THR 208 N 0.93 1.96 -0.43 2.01 2.01 0.64 -2.43 115.64 120.32 1p2q s THR 208 Ca 0.41 -1.04 -0.28 0.00 0.31 0.00 0.00 61.69 61.08 1p2q s THR 208 Cb -0.18 -1.63 0.00 0.00 0.01 0.00 0.00 72.50 70.69 1p2q s THR 208 CO 0.20 0.55 1.54 -0.22 -0.69 0.00 0.00 174.62 176.00 1p2q s LEU 209 N -0.43 3.52 -0.18 4.42 2.96 -0.02 -1.70 118.68 127.25 1p2q s LEU 209 Ca 0.05 0.83 0.18 0.00 -0.22 0.00 0.00 54.13 54.97 1p2q s LEU 209 Cb -0.11 -3.40 -0.25 0.00 0.50 0.00 0.00 46.19 42.93 1p2q s LEU 209 CO 0.01 -1.60 0.15 0.52 -1.32 0.00 0.00 176.35 174.10 1p2q n VAL 210 N 7.14 1.36 -3.88 1.68 0.31 -0.06 -4.30 118.33 120.57 1p2q n VAL 210 Ca 0.18 -0.84 -0.10 0.00 -0.01 0.00 0.00 64.34 63.57 1p2q n VAL 210 Cb 0.48 -0.50 -0.06 0.00 -0.91 0.00 0.00 33.84 32.85 1p2q n VAL 210 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1p2q s GLY 211 N -5.41 0.27 -0.10 2.92 0.00 -0.71 -2.09 107.32 102.20 1p2q s GLY 211 Ca -0.09 -0.65 0.02 0.00 0.00 0.00 0.00 44.72 44.01 1p2q s GLY 211 CO 0.83 -0.63 -0.17 -0.42 0.00 0.00 0.00 173.10 172.71 1p2q s ILE 212 N -3.93 1.62 -0.01 0.90 1.01 -0.80 -1.49 121.20 118.49 1p2q s ILE 212 Ca 0.14 -0.73 -0.36 0.00 0.00 0.00 0.00 60.65 59.70 1p2q s ILE 212 Cb 0.02 -1.45 -0.14 0.00 0.01 0.00 0.00 42.46 40.90 1p2q s ILE 212 CO -0.01 0.46 1.66 0.52 0.00 0.00 0.00 174.94 177.57 1p2q n VAL 213 N 3.97 0.24 0.00 2.92 0.31 -0.50 -0.84 118.33 124.44 1p2q n VAL 213 Ca -0.20 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 1p2q n VAL 213 Cb 0.52 -1.45 0.00 0.00 -0.91 0.00 0.00 33.84 32.00 1p2q n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1p2q n SER 214 N 4.64 0.00 -3.31 4.52 2.88 -1.09 -0.84 113.62 120.42 1p2q n SER 214 Ca 0.21 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.63 1p2q n SER 214 Cb 0.24 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.68 1p2q n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1p2q s TRP 215 N -0.63 0.68 -1.16 0.66 1.48 -0.49 -4.90 118.94 114.58 1p2q s TRP 215 Ca 0.00 -1.05 0.00 0.00 -1.06 0.00 0.00 56.10 53.99 1p2q s TRP 215 Cb 0.00 0.21 0.00 0.00 -1.16 0.00 0.00 33.47 32.52 1p2q s TRP 215 CO 0.00 -1.22 0.00 0.41 -4.06 0.00 0.00 176.95 172.08 1p2q n GLY 216 N -0.52 -0.73 3.65 3.67 0.00 -1.26 0.08 105.19 110.08 1p2q n GLY 216 Ca -0.02 -0.33 -0.46 0.00 0.00 0.00 0.00 46.02 45.21 1p2q n GLY 216 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1p2q n SER 217 N 0.00 2.52 0.00 1.61 2.88 -1.26 -4.85 113.62 114.52 1p2q n SER 217 Ca 0.00 1.13 0.10 0.00 -1.33 0.00 0.00 58.87 58.77 1p2q n SER 217 Cb 0.00 -1.37 0.51 0.00 -0.75 0.00 0.00 64.21 62.60 1p2q n SER 217 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1p2q n SER 218 N 2.46 0.00 -0.06 -3.46 7.64 -1.26 -2.21 113.62 116.73 1p2q n SER 218 Ca 0.14 0.03 0.04 0.00 1.01 0.00 0.00 58.87 60.08 1p2q n SER 218 Cb 0.29 -0.30 0.05 0.00 -1.01 0.00 0.00 64.21 63.24 1p2q n SER 218 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1p2q n THR 219 N -1.30 1.16 -3.83 0.44 -2.24 -1.26 -5.00 114.28 102.25 1p2q n THR 219 Ca 0.09 -1.30 -0.27 0.00 -2.27 0.00 0.00 64.05 60.30 1p2q n THR 219 Cb 0.17 0.28 0.03 0.00 -2.10 0.00 0.00 70.33 68.71 1p2q n THR 219 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1p2q s SER 221 N -3.58 6.68 0.00 0.00 0.15 -1.26 -4.75 113.70 110.93 1p2q s SER 221 Ca 0.49 2.53 0.24 0.00 0.70 0.00 0.00 55.95 59.91 1p2q s SER 221 Cb -0.24 -2.60 1.17 0.00 -1.71 0.00 0.00 66.02 62.64 1p2q s SER 221 CO 0.82 -0.74 1.78 0.35 1.20 0.00 0.00 173.24 176.64 1p2q n THR 222 N 3.62 0.27 -0.31 6.45 -2.24 -1.26 -2.66 114.28 118.16 1p2q n THR 222 Ca 0.12 0.07 0.09 0.00 -2.27 0.00 0.00 64.05 62.06 1p2q n THR 222 Cb 0.40 -0.67 0.26 0.00 -2.10 0.00 0.00 70.33 68.21 1p2q n THR 222 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1p2q n SER 223 N -1.32 3.59 -4.46 3.42 3.41 -1.26 -1.22 113.62 115.79 1p2q n SER 223 Ca 0.10 -2.02 -0.31 0.00 -0.26 0.00 0.00 58.87 56.38 1p2q n SER 223 Cb 0.20 -0.39 -0.13 0.00 -0.26 0.00 0.00 64.21 63.63 1p2q n SER 223 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1p2q s THR 224 N -1.04 2.85 0.22 6.66 2.01 -1.09 -4.77 115.64 120.49 1p2q s THR 224 Ca 0.39 -1.01 -0.30 0.00 0.31 0.00 0.00 61.69 61.08 1p2q s THR 224 Cb 0.21 -2.16 -0.09 0.00 0.01 0.00 0.00 72.50 70.47 1p2q s THR 224 CO 0.26 0.44 1.40 -2.84 -0.69 0.00 0.00 174.62 173.19 1p2q s PRO 225 N -1.13 4.31 0.18 4.92 0.02 -1.26 -2.66 135.00 139.38 1p2q s PRO 225 Ca 0.13 2.21 -0.16 0.00 0.02 0.00 0.00 61.00 63.20 1p2q s PRO 225 Cb -0.11 -3.15 -0.07 0.00 0.02 0.00 0.00 34.50 31.19 1p2q s PRO 225 CO 0.03 -0.37 0.62 0.20 -0.33 0.00 0.00 177.00 177.15 1p2q s GLY 226 N 0.42 2.51 -0.15 0.52 0.00 0.21 -4.49 107.32 106.34 1p2q s GLY 226 Ca 0.59 -0.02 -0.02 0.00 0.00 0.00 0.00 44.72 45.27 1p2q s GLY 226 CO 0.40 0.29 -0.08 0.14 0.00 0.00 0.00 173.10 173.85 1p2q s VAL 227 N -1.49 3.42 0.19 1.40 1.01 0.11 -1.48 120.40 123.55 1p2q s VAL 227 Ca 0.40 -0.52 0.11 0.00 0.00 0.00 0.00 61.98 61.97 1p2q s VAL 227 Cb -0.16 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1p2q s VAL 227 CO 0.20 0.50 -0.24 -0.31 0.00 0.00 0.00 175.10 175.25 1p2q s TYR 228 N 0.53 2.27 0.05 5.22 1.51 0.70 -1.40 117.35 126.23 1p2q s TYR 228 Ca -0.06 -0.37 -0.31 0.00 -1.01 0.00 0.00 57.07 55.33 1p2q s TYR 228 Cb -0.15 -1.13 -0.06 0.00 -0.11 0.00 0.00 41.96 40.51 1p2q s TYR 228 CO 0.03 0.48 1.31 0.00 -1.11 0.00 0.00 175.55 176.26 1p2q s ALA 229 N -1.65 3.51 -0.58 3.71 0.00 -0.02 -0.06 121.76 126.68 1p2q s ALA 229 Ca 0.20 0.91 -0.28 0.00 0.00 0.00 0.00 51.96 52.79 1p2q s ALA 229 Cb -0.08 -3.52 0.03 0.00 0.00 0.00 0.00 23.12 19.55 1p2q s ALA 229 CO 0.09 -0.65 1.23 0.50 0.00 0.00 0.00 175.76 176.93 1p2q s ARG 230 N 1.56 3.48 0.35 0.00 3.52 0.49 -1.91 118.95 126.44 1p2q s ARG 230 Ca 0.61 0.28 0.02 0.00 -0.13 0.00 0.00 55.73 56.52 1p2q s ARG 230 Cb -0.32 -4.03 0.63 0.00 -1.56 0.00 0.00 34.95 29.67 1p2q s ARG 230 CO 0.28 -1.73 2.00 0.28 -0.81 0.00 0.00 175.30 175.32 1p2q h VAL 231 N 6.19 1.15 -0.43 7.11 2.07 -1.71 -2.18 116.25 128.45 1p2q h VAL 231 Ca -0.25 -0.30 0.04 0.00 0.82 0.00 0.00 66.70 67.01 1p2q h VAL 231 Cb 1.06 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1p2q h VAL 231 CO 1.19 0.16 0.29 0.71 0.02 0.00 0.00 177.57 179.94 1p2q h THR 232 N 0.87 1.01 -0.00 2.57 1.35 -1.87 0.63 112.91 117.48 1p2q h THR 232 Ca 0.25 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.96 1p2q h THR 232 Cb -0.06 0.55 0.00 0.00 -1.73 0.00 0.00 68.15 66.90 1p2q h THR 232 CO -0.06 0.08 -0.06 0.00 -0.25 0.00 0.00 175.52 175.23 1p2q n ALA 233 N -2.50 2.48 -0.05 6.62 0.00 -0.83 -3.84 120.51 122.39 1p2q n ALA 233 Ca 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1p2q n ALA 233 Cb 0.19 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.20 1p2q n ALA 233 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1p2q n LEU 234 N -1.47 0.31 0.21 0.00 4.77 0.02 -4.75 117.00 116.09 1p2q n LEU 234 Ca 0.07 -0.59 0.05 0.00 -0.03 0.00 0.00 56.01 55.52 1p2q n LEU 234 Cb 0.33 0.00 0.48 0.00 -2.33 0.00 0.00 43.42 41.90 1p2q n LEU 234 CO 0.28 0.08 0.85 1.62 -1.33 0.00 0.00 177.39 178.88 1p2q h VAL 235 N 0.05 1.11 -0.53 4.08 3.04 0.06 -1.98 116.25 122.08 1p2q h VAL 235 Ca 0.00 -0.84 -0.08 0.00 -1.01 0.00 0.00 66.70 64.77 1p2q h VAL 235 Cb 0.02 1.46 -0.02 0.00 -2.01 0.00 0.00 31.29 30.74 1p2q h VAL 235 CO 0.00 0.24 0.02 0.78 -1.01 0.00 0.00 177.57 177.60 1p2q h ASN 236 N 0.00 0.84 -0.39 3.17 2.35 -1.84 -0.28 115.58 119.43 1p2q h ASN 236 Ca -0.00 -0.20 -0.10 0.00 -0.55 0.00 0.00 56.30 55.45 1p2q h ASN 236 Cb 0.44 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 1p2q h ASN 236 CO 0.03 0.89 -0.10 -0.25 -1.65 0.00 0.00 177.43 176.35 1p2q h TRP 237 N 0.82 0.92 0.15 1.19 7.01 -1.72 -1.92 115.95 122.40 1p2q h TRP 237 Ca 0.16 -0.17 -0.01 0.00 2.11 0.00 0.00 58.89 60.98 1p2q h TRP 237 Cb 0.46 -0.24 0.00 0.00 -2.10 0.00 0.00 29.16 27.28 1p2q h TRP 237 CO 0.03 0.90 -0.07 0.28 -2.79 0.00 0.00 178.44 176.78 1p2q h VAL 238 N 0.76 0.92 -0.85 2.65 2.07 -0.68 -1.50 116.25 119.60 1p2q h VAL 238 Ca 0.13 -0.26 0.02 0.00 0.82 0.00 0.00 66.70 67.41 1p2q h VAL 238 Cb 0.61 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 31.41 1p2q h VAL 238 CO 0.04 0.06 0.56 1.56 0.02 0.00 0.00 177.57 179.81 1p2q h GLN 239 N -0.32 1.08 -0.65 1.57 1.08 -0.99 -1.47 115.11 115.42 1p2q h GLN 239 Ca -0.02 -0.07 -0.04 0.00 -1.45 0.00 0.00 58.65 57.08 1p2q h GLN 239 Cb 0.25 -0.24 -0.03 0.00 -0.05 0.00 0.00 27.48 27.41 1p2q h GLN 239 CO 0.03 0.72 0.27 1.96 -0.95 0.00 0.00 178.83 180.86 1p2q h GLN 240 N 1.12 0.97 -0.43 1.46 4.20 -1.25 -0.50 115.11 120.67 1p2q h GLN 240 Ca 0.33 -0.17 -0.02 0.00 0.06 0.00 0.00 58.65 58.84 1p2q h GLN 240 Cb -0.06 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.54 1p2q h GLN 240 CO -0.09 0.81 0.18 1.15 -0.67 0.00 0.00 178.83 180.20 1p2q h THR 241 N 0.92 1.20 -0.17 -0.54 2.02 -0.79 -1.40 112.91 114.14 1p2q h THR 241 Ca 0.22 -0.60 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 1p2q h THR 241 Cb 0.19 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 1p2q h THR 241 CO -0.02 0.22 0.06 -0.07 0.37 0.00 0.00 175.52 176.08 1p2q h LEU 242 N 0.56 0.25 -1.52 2.58 4.07 -1.09 -2.44 115.31 117.72 1p2q h LEU 242 Ca 0.15 -0.20 0.05 0.00 0.08 0.00 0.00 57.88 57.95 1p2q h LEU 242 Cb 0.18 -0.07 -0.03 0.00 1.08 0.00 0.00 40.66 41.82 1p2q h LEU 242 CO -0.01 0.38 0.39 0.00 -1.08 0.00 0.00 178.44 178.11 1p2q h ALA 243 N 0.88 1.77 -0.01 1.53 0.00 -0.96 -1.52 119.26 120.95 1p2q h ALA 243 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1p2q h ALA 243 Cb 0.22 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1p2q h ALA 243 CO -0.00 0.15 -0.06 0.00 0.00 0.00 0.00 179.25 179.34 1p2q n ALA 244 N -2.47 2.70 -0.94 0.00 0.00 -0.54 -5.09 120.51 114.16 1p2q n ALA 244 Ca 0.08 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1p2q n ALA 244 Cb 0.19 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1p2q n ALA 244 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59