#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mqt s ASN 6 N 0.00 6.62 0.27 0.00 0.02 -1.26 -4.65 114.94 115.94 3mqt s ASN 6 Ca 0.00 1.45 -0.30 0.00 -1.02 0.00 0.00 52.86 52.99 3mqt s ASN 6 Cb 0.00 -2.46 -0.11 0.00 0.02 0.00 0.00 41.25 38.71 3mqt s ASN 6 CO 0.00 -0.50 1.49 -0.63 0.02 0.00 0.00 177.10 177.48 3mqt s ILE 7 N -2.50 2.43 -0.03 0.60 1.01 -0.33 -1.97 121.20 120.41 3mqt s ILE 7 Ca 0.57 0.36 0.05 0.00 0.00 0.00 0.00 60.65 61.63 3mqt s ILE 7 Cb -0.10 -3.23 -0.07 0.00 0.01 0.00 0.00 42.46 39.07 3mqt s ILE 7 CO 0.29 0.06 0.06 0.52 0.00 0.00 0.00 174.94 175.87 3mqt n VAL 8 N 2.17 0.21 -3.46 2.92 0.31 0.44 0.02 118.33 120.94 3mqt n VAL 8 Ca 0.07 -0.18 -0.14 0.00 -0.01 0.00 0.00 64.34 64.07 3mqt n VAL 8 Cb 0.39 -0.36 -0.04 0.00 -0.91 0.00 0.00 33.84 32.93 3mqt n VAL 8 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3mqt s SER 9 N -3.22 -0.60 -0.03 4.52 1.04 -1.04 -4.92 113.70 109.45 3mqt s SER 9 Ca -0.02 0.30 0.03 0.00 0.48 0.00 0.00 55.95 56.73 3mqt s SER 9 Cb 0.02 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.72 3mqt s SER 9 CO 0.22 -0.82 -0.10 -0.69 0.98 0.00 0.00 173.24 172.83 3mqt s VAL 10 N -2.68 0.87 -0.06 5.02 1.01 -1.26 -1.40 120.40 121.90 3mqt s VAL 10 Ca -0.04 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.55 3mqt s VAL 10 Cb -0.01 -0.77 0.02 0.00 0.00 0.00 0.00 36.38 35.62 3mqt s VAL 10 CO -0.03 0.27 -0.07 -0.70 0.00 0.00 0.00 175.10 174.57 3mqt s GLU 11 N 0.20 1.15 -0.31 2.72 2.12 0.31 -4.99 118.70 119.89 3mqt s GLU 11 Ca -0.04 -0.20 -0.15 0.00 0.36 0.00 0.00 54.97 54.94 3mqt s GLU 11 Cb -0.09 -1.10 -0.02 0.00 0.26 0.00 0.00 34.13 33.18 3mqt s GLU 11 CO 0.01 -0.08 0.37 -0.06 -0.54 0.00 0.00 175.26 174.96 3mqt s PHE 12 N 0.98 3.22 -0.45 5.30 2.99 -1.26 -0.97 117.98 127.79 3mqt s PHE 12 Ca -0.10 0.15 -0.05 0.00 0.00 0.00 0.00 56.93 56.93 3mqt s PHE 12 Cb -0.14 -2.64 0.12 0.00 0.00 0.00 0.00 43.02 40.35 3mqt s PHE 12 CO 0.00 -0.36 0.28 0.42 -0.00 0.00 0.00 175.22 175.56 3mqt s ILE 13 N 2.06 3.66 0.39 0.64 1.01 0.27 -4.85 121.20 124.37 3mqt s ILE 13 Ca 0.13 -2.05 -0.27 0.00 0.00 0.00 0.00 60.65 58.46 3mqt s ILE 13 Cb -0.16 -3.46 -0.10 0.00 0.01 0.00 0.00 42.46 38.75 3mqt s ILE 13 CO 0.11 -0.74 1.39 -2.84 0.00 0.00 0.00 174.94 172.86 3mqt s PRO 14 N 1.09 4.05 -0.22 2.79 0.02 -1.26 -0.80 135.00 140.68 3mqt s PRO 14 Ca 0.08 2.35 -0.02 0.00 0.02 0.00 0.00 61.00 63.44 3mqt s PRO 14 Cb -0.24 -2.88 0.07 0.00 0.02 0.00 0.00 34.50 31.47 3mqt s PRO 14 CO -0.03 -0.49 0.03 0.08 -0.33 0.00 0.00 177.00 176.25 3mqt s VAL 15 N -1.18 0.77 -0.21 3.83 1.01 0.07 -4.83 120.40 119.87 3mqt s VAL 15 Ca 0.54 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.71 3mqt s VAL 15 Cb -0.42 -1.28 0.05 0.00 0.00 0.00 0.00 36.38 34.73 3mqt s VAL 15 CO 0.56 -0.26 -0.07 0.21 0.00 0.00 0.00 175.10 175.54 3mqt s ASN 16 N 1.73 3.43 -0.29 3.32 3.84 -1.26 -1.54 114.94 124.17 3mqt s ASN 16 Ca -0.00 -0.95 -0.14 0.00 0.21 0.00 0.00 52.86 51.98 3mqt s ASN 16 Cb -0.17 -1.12 -0.03 0.00 -0.55 0.00 0.00 41.25 39.37 3mqt s ASN 16 CO -0.10 -0.19 0.30 -0.69 -2.79 0.00 0.00 177.10 173.63 3mqt s VAL 17 N 1.46 5.22 -0.92 -5.21 1.01 -0.79 -4.98 120.40 116.19 3mqt s VAL 17 Ca -0.03 0.28 -0.24 0.00 0.00 0.00 0.00 61.98 61.99 3mqt s VAL 17 Cb -0.17 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.57 3mqt s VAL 17 CO -0.07 0.12 1.48 0.00 0.00 0.00 0.00 175.10 176.63 3mqt s ALA 18 N 1.94 2.58 -0.09 5.51 0.00 -1.26 -4.28 121.76 126.15 3mqt s ALA 18 Ca 0.11 -1.90 0.00 0.00 0.00 0.00 0.00 51.96 50.17 3mqt s ALA 18 Cb -0.16 -4.46 -0.03 0.00 0.00 0.00 0.00 23.12 18.47 3mqt s ALA 18 CO 0.11 -3.69 -0.08 -1.54 0.00 0.00 0.00 175.76 170.55 3mqt s SER 23 N 5.17 4.50 -0.37 0.00 1.04 -1.26 -5.18 113.70 117.61 3mqt s SER 23 Ca 0.47 -0.11 -0.02 0.00 0.48 0.00 0.00 55.95 56.77 3mqt s SER 23 Cb -0.03 -1.30 0.09 0.00 0.10 0.00 0.00 66.02 64.88 3mqt s SER 23 CO -0.02 0.30 0.13 -0.70 0.98 0.00 0.00 173.24 173.93 3mqt s GLU 24 N -0.41 2.08 0.09 4.02 2.56 -1.26 -5.06 118.70 120.71 3mqt s GLU 24 Ca 0.06 -1.66 -0.16 0.00 0.00 0.00 0.00 54.97 53.21 3mqt s GLU 24 Cb -0.12 -3.43 0.03 0.00 2.00 0.00 0.00 34.13 32.61 3mqt s GLU 24 CO 0.02 -0.92 0.38 0.54 -0.56 0.00 0.00 175.26 174.72 3mqt s ASN 25 N 1.56 -0.21 0.30 -1.70 2.20 -1.26 -1.88 114.94 113.94 3mqt s ASN 25 Ca 0.05 -0.24 -0.13 0.00 -0.94 0.00 0.00 52.86 51.60 3mqt s ASN 25 Cb -0.21 0.44 0.01 0.00 -2.00 0.00 0.00 41.25 39.49 3mqt s ASN 25 CO -0.04 -0.77 0.57 0.28 -2.94 0.00 0.00 177.10 174.20 3mqt s THR 26 N -3.35 0.00 -0.20 0.54 -1.32 -0.59 -5.02 115.64 105.71 3mqt s THR 26 Ca 0.00 -1.31 0.01 0.00 -1.21 0.00 0.00 61.69 59.19 3mqt s THR 26 Cb 0.01 -2.38 0.03 0.00 -1.51 0.00 0.00 72.50 68.65 3mqt s THR 26 CO -0.09 0.00 -0.17 -0.69 -2.21 0.00 0.00 174.62 171.47 3mqt s VAL 27 N -3.49 2.02 -0.02 5.08 1.01 -1.24 -0.75 120.40 123.00 3mqt s VAL 27 Ca 0.21 -1.10 -0.25 0.00 0.00 0.00 0.00 61.98 60.84 3mqt s VAL 27 Cb -0.02 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 3mqt s VAL 27 CO 0.11 0.36 0.75 -0.63 0.00 0.00 0.00 175.10 175.70 3mqt s ILE 28 N 1.26 4.92 -0.25 2.22 1.01 0.02 -1.83 121.20 128.56 3mqt s ILE 28 Ca 0.01 1.58 -0.05 0.00 0.00 0.00 0.00 60.65 62.19 3mqt s ILE 28 Cb -0.15 -4.10 -0.00 0.00 0.01 0.00 0.00 42.46 38.22 3mqt s ILE 28 CO -0.10 0.28 -0.00 -0.69 0.00 0.00 0.00 174.94 174.42 3mqt s VAL 29 N 0.53 3.57 -0.21 2.92 1.01 0.38 0.94 120.40 129.54 3mqt s VAL 29 Ca 0.40 -0.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.78 3mqt s VAL 29 Cb -0.19 -2.71 0.01 0.00 0.00 0.00 0.00 36.38 33.49 3mqt s VAL 29 CO 0.21 0.30 -0.10 -0.75 0.00 0.00 0.00 175.10 174.76 3mqt s LYS 30 N 1.48 3.12 -0.16 2.72 2.20 -0.14 -0.90 119.74 128.06 3mqt s LYS 30 Ca 0.04 -0.77 -0.01 0.00 -0.36 0.00 0.00 55.97 54.87 3mqt s LYS 30 Cb -0.15 -2.87 -0.01 0.00 -1.51 0.00 0.00 37.83 33.29 3mqt s LYS 30 CO -0.01 -0.25 -0.11 0.08 -0.36 0.00 0.00 175.35 174.69 3mqt s VAL 31 N 1.38 3.02 -0.07 4.02 1.01 -0.72 -0.53 120.40 128.51 3mqt s VAL 31 Ca 0.04 -0.65 0.05 0.00 0.00 0.00 0.00 61.98 61.42 3mqt s VAL 31 Cb -0.14 -2.30 -0.01 0.00 0.00 0.00 0.00 36.38 33.93 3mqt s VAL 31 CO -0.07 0.50 -0.23 -0.89 0.00 0.00 0.00 175.10 174.41 3mqt s THR 32 N 0.79 1.93 0.30 3.92 2.01 -0.49 0.05 115.64 124.16 3mqt s THR 32 Ca -0.04 -0.98 0.01 0.00 0.31 0.00 0.00 61.69 60.98 3mqt s THR 32 Cb -0.15 -1.65 0.06 0.00 0.01 0.00 0.00 72.50 70.76 3mqt s THR 32 CO 0.01 0.54 0.42 -0.90 -0.69 0.00 0.00 174.62 173.99 3mqt n ASP 33 N 3.20 0.63 0.26 3.53 5.68 0.33 -0.42 116.55 129.76 3mqt n ASP 33 Ca -0.18 -1.51 0.17 0.00 -0.50 0.00 0.00 54.79 52.76 3mqt n ASP 33 Cb 0.52 -0.27 0.69 0.00 -1.14 0.00 0.00 41.12 40.93 3mqt n ASP 33 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3mqt h GLU 34 N 0.00 0.00 -0.24 0.11 5.08 -1.69 -2.16 114.58 115.68 3mqt h GLU 34 Ca -0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 3mqt h GLU 34 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 3mqt h GLU 34 CO 0.15 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.25 3mqt n ASN 35 N -2.95 2.87 0.00 1.42 3.02 -1.26 -4.95 115.26 113.42 3mqt n ASN 35 Ca 0.01 -1.91 0.00 0.00 -0.03 0.00 0.00 54.58 52.65 3mqt n ASN 35 Cb 0.27 -0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 3mqt n ASN 35 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3mqt n GLY 36 N 1.38 0.51 3.76 7.41 0.00 -0.81 -5.04 105.19 112.40 3mqt n GLY 36 Ca 0.18 -0.11 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3mqt n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mqt s VAL 37 N -2.00 3.54 0.24 1.61 1.01 -1.26 -4.82 120.40 118.72 3mqt s VAL 37 Ca 0.00 1.54 0.08 0.00 0.00 0.00 0.00 61.98 63.59 3mqt s VAL 37 Cb 0.00 -3.98 -0.05 0.00 0.00 0.00 0.00 36.38 32.35 3mqt s VAL 37 CO 0.00 0.36 -0.12 -0.72 0.00 0.00 0.00 175.10 174.62 3mqt s TYR 38 N -1.09 1.86 0.04 5.22 -0.85 -1.26 -0.51 117.35 120.75 3mqt s TYR 38 Ca 0.45 -0.58 0.08 0.00 -0.52 0.00 0.00 57.07 56.49 3mqt s TYR 38 Cb -0.31 -0.92 -0.03 0.00 0.38 0.00 0.00 41.96 41.08 3mqt s TYR 38 CO 0.40 0.38 -0.23 0.20 -1.52 0.00 0.00 175.55 174.78 3mqt s GLY 39 N -3.38 1.24 -0.06 5.49 0.00 0.11 -4.52 107.32 106.20 3mqt s GLY 39 Ca 0.26 -1.14 0.02 0.00 0.00 0.00 0.00 44.72 43.85 3mqt s GLY 39 CO 0.09 -1.05 -0.09 1.08 0.00 0.00 0.00 173.10 173.14 3mqt s LEU 40 N -1.16 3.06 0.00 0.66 1.43 -1.26 -1.76 118.68 119.65 3mqt s LEU 40 Ca 0.09 -0.07 0.03 0.00 -1.03 0.00 0.00 54.13 53.15 3mqt s LEU 40 Cb -0.09 -1.67 -0.01 0.00 0.03 0.00 0.00 46.19 44.45 3mqt s LEU 40 CO 0.02 0.35 0.37 0.61 0.23 0.00 0.00 176.35 177.93 3mqt n GLY 41 N 2.18 2.55 2.99 -3.19 0.00 -0.08 -3.66 105.19 105.99 3mqt n GLY 41 Ca -0.18 -1.74 -0.10 0.00 0.00 0.00 0.00 46.02 44.00 3mqt n GLY 41 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3mqt s GLU 42 N -3.03 0.26 0.02 1.61 -1.05 -1.26 -0.47 118.70 114.79 3mqt s GLU 42 Ca 0.33 -0.34 0.03 0.00 -0.15 0.00 0.00 54.97 54.83 3mqt s GLU 42 Cb 0.00 0.10 -0.04 0.00 -0.44 0.00 0.00 34.13 33.76 3mqt s GLU 42 CO 0.23 -0.05 -0.01 0.00 0.95 0.00 0.00 175.26 176.38 3mqt s ALA 43 N -0.95 3.23 0.92 -0.84 0.00 -0.76 -3.94 121.76 119.41 3mqt s ALA 43 Ca -0.10 -1.00 -0.12 0.00 0.00 0.00 0.00 51.96 50.73 3mqt s ALA 43 Cb -0.06 -1.26 0.14 0.00 0.00 0.00 0.00 23.12 21.94 3mqt s ALA 43 CO -0.00 0.65 1.11 0.34 0.00 0.00 0.00 175.76 177.86 3mqt s ASP 44 N -1.69 3.35 0.00 0.00 2.15 -0.85 -3.70 116.67 115.93 3mqt s ASP 44 Ca 0.20 1.15 0.00 0.00 0.43 0.00 0.00 52.55 54.33 3mqt s ASP 44 Cb -0.11 -1.79 0.00 0.00 -0.30 0.00 0.00 42.92 40.72 3mqt s ASP 44 CO 0.11 -2.67 0.00 0.61 -0.17 0.00 0.00 175.17 173.05 3mqt n GLY 45 N -1.70 2.62 3.65 2.66 0.00 -1.26 -4.78 105.19 106.39 3mqt n GLY 45 Ca 0.06 -2.01 -0.43 0.00 0.00 0.00 0.00 46.02 43.65 3mqt n GLY 45 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3mqt n PRO 46 N 0.03 2.75 -0.18 1.61 -0.02 -1.26 -4.79 135.00 133.15 3mqt n PRO 46 Ca 0.00 0.99 -0.07 0.00 -2.02 0.00 0.00 63.50 62.40 3mqt n PRO 46 Cb 0.00 -3.02 0.02 0.00 -0.02 0.00 0.00 33.50 30.48 3mqt n PRO 46 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3mqt h PRO 47 N 11.00 0.71 -0.43 0.52 0.11 -1.93 0.48 132.00 142.45 3mqt h PRO 47 Ca -0.49 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 65.48 3mqt h PRO 47 Cb 1.24 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 3mqt h PRO 47 CO 0.94 0.49 -0.10 0.93 -0.21 0.00 0.00 178.00 180.06 3mqt h GLU 48 N 0.71 0.76 -0.36 1.05 4.39 -1.95 -1.25 114.58 117.94 3mqt h GLU 48 Ca 0.19 -0.25 -0.14 0.00 0.34 0.00 0.00 59.36 59.51 3mqt h GLU 48 Cb -0.04 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 3mqt h GLU 48 CO -0.04 0.84 -0.32 0.00 -1.16 0.00 0.00 179.01 178.33 3mqt h MET 50 N 0.67 0.96 -0.42 0.00 2.86 -0.72 -0.52 114.93 117.76 3mqt h MET 50 Ca 0.07 -0.22 0.00 0.00 -2.06 0.00 0.00 59.70 57.49 3mqt h MET 50 Cb 0.87 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.38 3mqt h MET 50 CO 0.08 0.87 0.27 -0.22 1.06 0.00 0.00 176.91 178.97 3mqt h LYS 51 N 0.91 0.56 -0.80 1.72 3.64 -1.05 -1.91 116.57 119.66 3mqt h LYS 51 Ca 0.19 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 3mqt h LYS 51 Cb 0.36 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.02 3mqt h LYS 51 CO 0.00 0.39 0.50 0.00 -2.27 0.00 0.00 179.45 178.08 3mqt h ALA 52 N 1.14 1.01 -0.85 5.00 0.00 -1.06 -2.34 119.26 122.16 3mqt h ALA 52 Ca 0.15 -0.08 0.12 0.00 0.00 0.00 0.00 54.91 55.11 3mqt h ALA 52 Cb -0.04 -0.32 -0.08 0.00 0.00 0.00 0.00 17.79 17.35 3mqt h ALA 52 CO -0.03 0.46 0.47 0.35 0.00 0.00 0.00 179.25 180.50 3mqt h PHE 53 N 1.09 0.84 0.00 0.00 3.57 -0.70 -1.36 116.94 120.38 3mqt h PHE 53 Ca 0.29 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.82 3mqt h PHE 53 Cb -0.07 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.42 3mqt h PHE 53 CO -0.01 0.27 0.00 -1.13 -2.23 0.00 0.00 178.31 175.21 3mqt n SER 54 N -4.79 0.70 -0.75 0.41 3.41 -0.75 -3.43 113.62 108.42 3mqt n SER 54 Ca 0.16 0.61 0.07 0.00 -0.26 0.00 0.00 58.87 59.45 3mqt n SER 54 Cb 0.36 -0.78 0.17 0.00 -0.26 0.00 0.00 64.21 63.70 3mqt n SER 54 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3mqt n GLU 55 N -2.20 2.66 -1.52 4.33 1.02 -0.54 -4.65 120.64 119.73 3mqt n GLU 55 Ca 0.04 -2.08 -0.35 0.00 -0.02 0.00 0.00 57.16 54.75 3mqt n GLU 55 Cb 0.33 -1.32 0.09 0.00 -0.02 0.00 0.00 31.44 30.52 3mqt n GLU 55 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 3mqt s ILE 56 N -1.01 2.12 0.45 -3.67 -4.36 -1.03 -5.01 121.20 108.69 3mqt s ILE 56 Ca 0.27 0.07 -0.21 0.00 -0.26 0.00 0.00 60.65 60.51 3mqt s ILE 56 Cb 0.14 -2.80 -0.10 0.00 1.25 0.00 0.00 42.46 40.96 3mqt s ILE 56 CO 0.19 -0.03 0.99 -0.70 0.24 0.00 0.00 174.94 175.63 3mqt s GLU 57 N -3.69 4.06 0.64 0.37 2.56 -1.26 -4.29 118.70 117.08 3mqt s GLU 57 Ca 0.78 1.24 -0.18 0.00 0.00 0.00 0.00 54.97 56.81 3mqt s GLU 57 Cb -0.33 -2.17 -0.01 0.00 2.00 0.00 0.00 34.13 33.61 3mqt s GLU 57 CO 0.43 -0.19 1.27 -0.80 -0.56 0.00 0.00 175.26 175.41 3mqt s ASN 58 N -2.06 4.73 0.04 -1.70 0.01 -1.26 -4.52 114.94 110.18 3mqt s ASN 58 Ca 0.64 2.55 0.00 0.00 -0.71 0.00 0.00 52.86 55.34 3mqt s ASN 58 Cb -0.13 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 38.92 3mqt s ASN 58 CO 0.17 -1.92 0.00 -0.62 -1.51 0.00 0.00 177.10 173.22 3mqt n GLU 59 N -1.87 0.00 -1.73 -0.60 1.02 -0.19 -5.00 120.64 112.26 3mqt n GLU 59 Ca 0.15 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.27 3mqt n GLU 59 Cb 0.49 -0.14 0.01 0.00 -0.02 0.00 0.00 31.44 31.77 3mqt n GLU 59 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 3mqt n HIS 60 N -2.79 -1.35 -0.27 -0.32 1.44 -0.85 -5.00 115.22 106.08 3mqt n HIS 60 Ca 0.00 -0.49 0.17 0.00 -2.01 0.00 0.00 57.72 55.39 3mqt n HIS 60 Cb 0.12 0.24 0.45 0.00 0.12 0.00 0.00 29.99 30.92 3mqt n HIS 60 CO 0.00 0.00 0.00 -0.22 -2.81 0.00 0.00 176.34 173.31 3mqt h LYS 61 N 0.00 0.52 -0.26 -1.40 3.64 -1.99 -0.65 116.57 116.43 3mqt h LYS 61 Ca -0.09 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 3mqt h LYS 61 Cb 0.32 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 3mqt h LYS 61 CO 0.11 0.34 0.00 0.91 -2.27 0.00 0.00 179.45 178.55 3mqt n TRP 62 N -4.57 0.46 -3.65 1.91 8.01 -1.26 -4.60 117.44 113.74 3mqt n TRP 62 Ca 0.20 -0.59 -0.29 0.00 -1.31 0.00 0.00 57.50 55.50 3mqt n TRP 62 Cb 0.63 -0.09 -0.13 0.00 -2.01 0.00 0.00 31.31 29.71 3mqt n TRP 62 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.69 175.51 3mqt s LEU 63 N -1.41 2.12 0.17 -0.99 0.20 -0.25 -0.53 118.68 117.98 3mqt s LEU 63 Ca 0.23 -2.25 0.05 0.00 0.69 0.00 0.00 54.13 52.85 3mqt s LEU 63 Cb 0.15 -0.83 -0.05 0.00 -0.43 0.00 0.00 46.19 45.04 3mqt s LEU 63 CO 0.11 -0.32 -0.09 0.20 -0.29 0.00 0.00 176.35 175.97 3mqt s ASN 64 N 0.87 1.89 0.28 3.68 0.01 -0.69 -1.03 114.94 119.96 3mqt s ASN 64 Ca 0.16 -1.04 -0.30 0.00 -0.71 0.00 0.00 52.86 50.96 3mqt s ASN 64 Cb -0.22 -0.02 -0.11 0.00 0.41 0.00 0.00 41.25 41.30 3mqt s ASN 64 CO -0.06 -0.34 1.57 0.21 -1.51 0.00 0.00 177.10 176.96 3mqt s ASN 65 N -3.21 6.43 0.30 -1.22 3.84 -1.26 -4.72 114.94 115.11 3mqt s ASN 65 Ca 0.19 2.89 0.06 0.00 0.21 0.00 0.00 52.86 56.21 3mqt s ASN 65 Cb 0.03 -2.63 0.49 0.00 -0.55 0.00 0.00 41.25 38.58 3mqt s ASN 65 CO 0.02 -0.87 1.74 -0.29 -2.79 0.00 0.00 177.10 174.91 3mqt h ILE 66 N 3.43 1.27 -0.09 -5.21 2.10 -1.84 -2.92 117.51 114.26 3mqt h ILE 66 Ca -0.47 -1.33 0.01 0.00 1.08 0.00 0.00 64.86 64.16 3mqt h ILE 66 Cb 1.22 1.50 -0.00 0.00 -1.09 0.00 0.00 36.82 38.45 3mqt h ILE 66 CO 0.80 0.41 0.06 0.11 -1.08 0.00 0.00 178.15 178.44 3mqt h LYS 67 N 0.28 0.07 0.00 2.19 1.57 -1.91 -2.62 116.57 116.16 3mqt h LYS 67 Ca 0.04 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3mqt h LYS 67 Cb 0.70 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.00 3mqt h LYS 67 CO 0.05 0.05 0.00 0.39 -0.57 0.00 0.00 179.45 179.37 3mqt n GLU 68 N -4.52 0.19 0.13 3.15 1.02 -1.10 -1.41 120.64 118.09 3mqt n GLU 68 Ca -0.01 0.37 0.13 0.00 -0.02 0.00 0.00 57.16 57.62 3mqt n GLU 68 Cb 0.12 -1.82 0.42 0.00 -0.02 0.00 0.00 31.44 30.14 3mqt n GLU 68 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3mqt h ALA 69 N 2.34 1.00 0.00 0.62 0.00 -1.63 -3.35 119.26 118.23 3mqt h ALA 69 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3mqt h ALA 69 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3mqt h ALA 69 CO 0.00 0.00 -0.90 1.33 0.00 0.00 0.00 179.25 179.68 3mqt n VAL 70 N -2.36 0.00 -1.78 0.00 0.24 -0.69 -4.73 118.33 109.00 3mqt n VAL 70 Ca 0.04 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.92 3mqt n VAL 70 Cb 0.38 0.42 -0.03 0.00 -1.47 0.00 0.00 33.84 33.14 3mqt n VAL 70 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3mqt s ILE 71 N -1.80 2.24 0.00 1.34 -1.09 -0.50 -1.43 121.20 119.96 3mqt s ILE 71 Ca 0.00 0.14 0.00 0.00 -2.23 0.00 0.00 60.65 58.56 3mqt s ILE 71 Cb 0.00 -3.09 0.00 0.00 -1.58 0.00 0.00 42.46 37.79 3mqt s ILE 71 CO 0.00 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.33 3mqt n GLY 72 N 3.94 0.73 3.71 6.18 0.00 0.10 -4.97 105.19 114.89 3mqt n GLY 72 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 3mqt n GLY 72 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mqt s ARG 73 N -0.43 2.54 -0.28 1.61 1.81 -0.52 -4.78 118.95 118.91 3mqt s ARG 73 Ca 0.00 -1.16 -0.29 0.00 -1.72 0.00 0.00 55.73 52.56 3mqt s ARG 73 Cb 0.00 -2.38 0.01 0.00 -0.45 0.00 0.00 34.95 32.13 3mqt s ARG 73 CO 0.00 0.42 1.08 0.34 -0.68 0.00 0.00 175.30 176.46 3mqt s ASP 74 N -3.36 6.99 0.11 0.23 -1.08 -1.26 -1.18 116.67 117.12 3mqt s ASP 74 Ca 0.30 1.21 0.09 0.00 -0.52 0.00 0.00 52.55 53.63 3mqt s ASP 74 Cb -0.08 -2.54 0.45 0.00 -1.46 0.00 0.00 42.92 39.28 3mqt s ASP 74 CO 0.21 -0.80 1.27 -0.81 0.52 0.00 0.00 175.17 175.56 3mqt n PRO 75 N 6.65 0.05 0.24 4.34 -0.04 -1.26 -1.83 135.00 143.15 3mqt n PRO 75 Ca 0.12 0.53 0.11 0.00 -0.04 0.00 0.00 63.50 64.22 3mqt n PRO 75 Cb 0.47 -1.66 0.60 0.00 -0.04 0.00 0.00 33.50 32.86 3mqt n PRO 75 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3mqt h LEU 76 N 0.00 0.00 -7.14 1.53 6.46 -1.92 -3.39 115.31 110.85 3mqt h LEU 76 Ca 0.00 0.00 -0.74 0.00 -0.12 0.00 0.00 57.88 57.02 3mqt h LEU 76 Cb 0.03 0.00 -0.15 0.00 -0.73 0.00 0.00 40.66 39.81 3mqt h LEU 76 CO 0.00 0.18 1.79 -0.62 -0.62 0.00 0.00 178.44 179.17 3mqt n GLU 77 N -3.57 3.43 -0.02 1.25 1.02 -0.76 -4.83 120.64 117.15 3mqt n GLU 77 Ca -0.01 -3.61 -0.12 0.00 -0.02 0.00 0.00 57.16 53.41 3mqt n GLU 77 Cb 0.33 -3.05 -0.06 0.00 -0.02 0.00 0.00 31.44 28.64 3mqt n GLU 77 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 3mqt h PHE 78 N 6.56 0.17 -0.27 -0.32 0.04 -1.87 -1.29 116.94 119.96 3mqt h PHE 78 Ca 0.37 -0.02 -0.03 0.00 2.80 0.00 0.00 57.97 61.10 3mqt h PHE 78 Cb 0.76 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.85 3mqt h PHE 78 CO 1.21 0.30 0.05 0.00 -0.60 0.00 0.00 178.31 179.27 3mqt h ARG 79 N -0.02 0.44 -0.13 1.51 3.08 -1.97 -0.12 114.38 117.17 3mqt h ARG 79 Ca 0.03 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 3mqt h ARG 79 Cb 0.21 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 3mqt h ARG 79 CO -0.00 0.55 0.05 0.00 -1.07 0.00 0.00 179.97 179.50 3mqt h ALA 80 N 0.88 0.17 -0.32 0.04 0.00 -1.94 -1.22 119.26 116.86 3mqt h ALA 80 Ca 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3mqt h ALA 80 Cb 0.31 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3mqt h ALA 80 CO 0.00 -0.24 0.16 -0.91 0.00 0.00 0.00 179.25 178.27 3mqt h ASN 81 N 0.05 0.42 0.29 0.00 -0.26 -1.21 0.49 115.58 115.35 3mqt h ASN 81 Ca 0.04 -0.12 0.00 0.00 -0.56 0.00 0.00 56.30 55.67 3mqt h ASN 81 Cb 0.18 -0.11 -0.03 0.00 -1.06 0.00 0.00 38.32 37.30 3mqt h ASN 81 CO -0.00 0.42 -0.41 0.22 -1.06 0.00 0.00 177.43 176.60 3mqt h TYR 82 N 0.39 -1.13 -0.94 1.19 3.20 -0.96 0.57 116.97 119.28 3mqt h TYR 82 Ca 0.11 0.02 0.14 0.00 3.14 0.00 0.00 58.73 62.14 3mqt h TYR 82 Cb 0.11 0.46 -0.08 0.00 1.54 0.00 0.00 36.73 38.76 3mqt h TYR 82 CO -0.02 -0.54 0.60 -0.91 -1.64 0.00 0.00 178.16 175.65 3mqt h ASN 83 N -0.76 0.76 -0.24 -2.11 2.35 -1.20 0.60 115.58 114.99 3mqt h ASN 83 Ca -0.01 0.05 -0.09 0.00 -0.55 0.00 0.00 56.30 55.70 3mqt h ASN 83 Cb 0.71 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.98 3mqt h ASN 83 CO -0.14 0.38 -0.19 -0.09 -1.65 0.00 0.00 177.43 175.74 3mqt h ARG 84 N 0.80 0.55 -0.43 0.81 2.43 -0.53 -0.86 114.38 117.14 3mqt h ARG 84 Ca 0.48 -0.27 0.04 0.00 -0.81 0.00 0.00 59.98 59.42 3mqt h ARG 84 Cb 0.67 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.18 3mqt h ARG 84 CO -0.24 0.85 0.20 0.52 -1.51 0.00 0.00 179.97 179.78 3mqt h MET 85 N 0.25 0.39 -0.43 0.20 2.86 -0.12 -2.22 114.93 115.85 3mqt h MET 85 Ca 0.04 -0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 3mqt h MET 85 Cb 0.73 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.28 3mqt h MET 85 CO 0.05 0.26 0.15 -0.92 1.06 0.00 0.00 176.91 177.50 3mqt h TYR 86 N 0.40 0.68 -0.20 -0.22 3.20 -0.77 -2.94 116.97 117.13 3mqt h TYR 86 Ca 0.19 -0.06 -0.08 0.00 3.14 0.00 0.00 58.73 61.91 3mqt h TYR 86 Cb 0.12 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 38.19 3mqt h TYR 86 CO -0.11 0.61 -0.20 -0.44 -1.64 0.00 0.00 178.16 176.37 3mqt h ASP 87 N 0.55 0.53 0.84 -2.11 3.32 -1.03 -2.36 116.42 116.16 3mqt h ASP 87 Ca 0.14 -0.48 0.00 0.00 0.02 0.00 0.00 57.03 56.71 3mqt h ASP 87 Cb 0.24 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.64 3mqt h ASP 87 CO -0.01 0.90 0.00 0.35 -1.72 0.00 0.00 179.24 178.76 3mqt n THR 88 N -4.44 0.62 -0.04 0.35 -2.24 -0.85 -2.97 114.28 104.71 3mqt n THR 88 Ca -0.05 0.09 0.03 0.00 -2.27 0.00 0.00 64.05 61.85 3mqt n THR 88 Cb 0.41 -0.83 0.07 0.00 -2.10 0.00 0.00 70.33 67.88 3mqt n THR 88 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3mqt n THR 89 N -1.76 0.85 -0.34 4.28 -2.24 -1.11 -1.69 114.28 112.26 3mqt n THR 89 Ca 0.05 -0.92 0.24 0.00 -2.27 0.00 0.00 64.05 61.14 3mqt n THR 89 Cb 0.27 0.60 0.48 0.00 -2.10 0.00 0.00 70.33 69.57 3mqt n THR 89 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3mqt h LYS 90 N 1.09 0.33 -0.06 -0.78 1.57 -1.07 0.35 116.57 118.00 3mqt h LYS 90 Ca 0.00 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.69 3mqt h LYS 90 Cb 0.57 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 3mqt h LYS 90 CO 0.00 0.22 -0.30 2.35 -0.57 0.00 0.00 179.45 181.15 3mqt h TRP 91 N 0.34 0.12 -0.00 -1.35 2.91 -1.12 -3.07 115.95 113.77 3mqt h TRP 91 Ca 0.73 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.72 3mqt h TRP 91 Cb 1.67 -0.03 0.00 0.00 -0.51 0.00 0.00 29.16 30.29 3mqt h TRP 91 CO -0.01 0.40 -0.14 0.44 -1.03 0.00 0.00 178.44 178.10 3mqt n ILE 92 N -4.15 0.00 0.00 2.65 -5.35 -0.48 -4.98 119.36 107.05 3mqt n ILE 92 Ca -0.02 -0.43 0.00 0.00 -0.27 0.00 0.00 62.75 62.04 3mqt n ILE 92 Cb 0.37 1.08 0.00 0.00 -1.74 0.00 0.00 39.64 39.35 3mqt n ILE 92 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3mqt n GLY 93 N 0.76 1.20 5.00 3.28 0.00 0.11 -4.26 105.19 111.28 3mqt n GLY 93 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3mqt n GLY 93 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3mqt n MET 94 N 0.00 0.00 -4.12 1.61 1.56 -1.26 -4.67 117.12 110.24 3mqt n MET 94 Ca 0.00 0.00 -0.12 0.00 -0.27 0.00 0.00 57.70 57.31 3mqt n MET 94 Cb 0.00 0.00 -0.11 0.00 2.15 0.00 0.00 33.22 35.26 3mqt n MET 94 CO 0.00 0.00 0.00 1.03 -0.73 0.00 0.00 175.97 176.27 3mqt s ARG 95 N 0.00 0.69 2.35 2.12 1.81 -1.26 -4.85 118.95 119.80 3mqt s ARG 95 Ca 0.00 -1.02 0.00 0.00 -1.72 0.00 0.00 55.73 52.99 3mqt s ARG 95 Cb 0.00 -0.31 0.00 0.00 -0.45 0.00 0.00 34.95 34.19 3mqt s ARG 95 CO 0.00 0.03 0.00 0.41 -0.68 0.00 0.00 175.30 175.06 3mqt n GLY 96 N 0.80 0.48 0.30 -3.53 0.00 -1.26 -4.29 105.19 97.69 3mqt n GLY 96 Ca -0.18 -1.24 0.01 0.00 0.00 0.00 0.00 46.02 44.61 3mqt n GLY 96 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3mqt h LEU 97 N 0.00 0.60 -1.38 0.99 6.46 -1.92 0.79 115.31 120.84 3mqt h LEU 97 Ca 0.00 -0.06 0.18 0.00 -0.12 0.00 0.00 57.88 57.89 3mqt h LEU 97 Cb 0.00 -0.15 -0.07 0.00 -0.73 0.00 0.00 40.66 39.71 3mqt h LEU 97 CO 0.00 0.52 0.59 1.23 -0.62 0.00 0.00 178.44 180.16 3mqt h GLY 98 N 0.79 1.09 2.00 3.75 0.00 -1.75 -0.84 103.07 108.11 3mqt h GLY 98 Ca 0.17 -0.24 -0.08 0.00 0.00 0.00 0.00 47.33 47.18 3mqt h GLY 98 CO -0.02 0.01 -0.37 1.41 0.00 0.00 0.00 176.54 177.57 3mqt h LEU 99 N 0.54 0.00 -0.83 3.11 -0.00 -1.07 -2.75 115.31 114.31 3mqt h LEU 99 Ca 0.48 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 58.35 3mqt h LEU 99 Cb 1.00 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 41.62 3mqt h LEU 99 CO -0.21 0.37 0.50 -0.26 -0.00 0.00 0.00 178.44 178.84 3mqt h PHE 100 N 0.00 1.10 -0.49 1.13 0.04 -1.04 -1.52 116.94 116.16 3mqt h PHE 100 Ca -0.00 -0.01 -0.07 0.00 2.80 0.00 0.00 57.97 60.69 3mqt h PHE 100 Cb 0.84 -0.36 -0.02 0.00 2.20 0.00 0.00 35.95 38.61 3mqt h PHE 100 CO 0.00 0.74 0.04 0.00 -0.60 0.00 0.00 178.31 178.49 3mqt h ALA 101 N 1.27 0.65 -0.75 2.45 0.00 -1.41 -1.99 119.26 119.47 3mqt h ALA 101 Ca 0.30 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3mqt h ALA 101 Cb -0.04 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 3mqt h ALA 101 CO -0.05 0.42 0.27 0.82 0.00 0.00 0.00 179.25 180.71 3mqt h ILE 102 N 0.70 1.26 -0.54 0.00 2.04 -1.41 -2.68 117.51 116.89 3mqt h ILE 102 Ca 0.14 -0.85 0.05 0.00 1.00 0.00 0.00 64.86 65.20 3mqt h ILE 102 Cb 0.46 0.39 -0.05 0.00 -0.74 0.00 0.00 36.82 36.88 3mqt h ILE 102 CO 0.02 0.34 0.26 0.28 0.00 0.00 0.00 178.15 179.05 3mqt h SER 103 N 1.11 0.35 -0.41 1.72 0.02 -0.96 0.86 113.55 116.25 3mqt h SER 103 Ca 0.25 0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 61.18 3mqt h SER 103 Cb 0.26 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 3mqt h SER 103 CO -0.01 0.24 0.02 1.23 -1.14 0.00 0.00 176.83 177.17 3mqt h GLY 104 N 0.49 0.76 0.87 -3.77 0.00 -1.12 -1.33 103.07 98.97 3mqt h GLY 104 Ca 0.24 -0.54 -0.08 0.00 0.00 0.00 0.00 47.33 46.96 3mqt h GLY 104 CO -0.19 0.50 -0.14 -2.22 0.00 0.00 0.00 176.54 174.49 3mqt h ILE 105 N 0.54 1.30 -0.25 2.60 2.04 -1.27 -2.62 117.51 119.85 3mqt h ILE 105 Ca 0.12 -1.23 0.06 0.00 1.00 0.00 0.00 64.86 64.80 3mqt h ILE 105 Cb 0.44 1.55 -0.06 0.00 -0.74 0.00 0.00 36.82 38.01 3mqt h ILE 105 CO 0.02 0.39 -0.13 -0.78 0.00 0.00 0.00 178.15 177.65 3mqt h ASP 106 N 0.28 -0.42 -0.43 1.72 3.58 -0.76 -1.50 116.42 118.88 3mqt h ASP 106 Ca 0.06 0.10 0.09 0.00 0.42 0.00 0.00 57.03 57.70 3mqt h ASP 106 Cb 0.65 0.23 -0.09 0.00 1.72 0.00 0.00 39.33 41.84 3mqt h ASP 106 CO 0.04 -0.16 -0.21 -0.03 -2.88 0.00 0.00 179.24 176.00 3mqt h MET 107 N -0.10 -0.12 0.00 0.28 4.05 -1.23 -1.30 114.93 116.51 3mqt h MET 107 Ca 0.13 0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.55 3mqt h MET 107 Cb 0.30 0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 31.12 3mqt h MET 107 CO -0.31 -0.08 -0.07 0.00 0.23 0.00 0.00 176.91 176.68 3mqt h ALA 108 N 1.16 1.27 0.02 0.39 0.00 -1.07 -2.59 119.26 118.44 3mqt h ALA 108 Ca 0.21 -0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.84 3mqt h ALA 108 Cb 0.44 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3mqt h ALA 108 CO -0.51 0.09 -0.98 -0.07 0.00 0.00 0.00 179.25 177.78 3mqt h LEU 109 N 0.00 0.09 -0.71 0.00 3.38 -0.19 -0.10 115.31 117.78 3mqt h LEU 109 Ca -0.00 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 3mqt h LEU 109 Cb 0.23 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3mqt h LEU 109 CO 0.01 1.01 0.05 1.88 0.09 0.00 0.00 178.44 181.49 3mqt h TYR 110 N 0.02 1.13 -0.37 1.13 0.05 -1.20 0.25 116.97 117.99 3mqt h TYR 110 Ca -0.03 -0.17 -0.10 0.00 0.05 0.00 0.00 58.73 58.48 3mqt h TYR 110 Cb 1.70 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 39.13 3mqt h TYR 110 CO 0.01 0.97 -0.16 0.22 -1.05 0.00 0.00 178.16 178.15 3mqt h ASP 111 N 0.97 0.77 0.11 3.88 3.58 -1.37 -2.05 116.42 122.32 3mqt h ASP 111 Ca 0.18 -0.40 -0.01 0.00 0.42 0.00 0.00 57.03 57.23 3mqt h ASP 111 Cb 0.49 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.32 3mqt h ASP 111 CO 0.02 1.00 -0.05 0.25 -2.88 0.00 0.00 179.24 177.58 3mqt h LEU 112 N 0.55 -0.13 -0.80 2.28 5.85 -0.95 0.67 115.31 122.78 3mqt h LEU 112 Ca 0.08 -0.40 0.06 0.00 0.84 0.00 0.00 57.88 58.46 3mqt h LEU 112 Cb 0.70 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.71 3mqt h LEU 112 CO 0.05 0.38 0.48 0.00 -0.34 0.00 0.00 178.44 179.01 3mqt h ALA 113 N 0.08 1.09 -0.20 1.25 0.00 -1.03 0.25 119.26 120.70 3mqt h ALA 113 Ca -0.02 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.92 3mqt h ALA 113 Cb 0.52 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 3mqt h ALA 113 CO 0.03 0.20 0.03 0.78 0.00 0.00 0.00 179.25 180.28 3mqt h GLY 114 N 0.88 0.21 1.23 0.00 0.00 -1.33 -1.44 103.07 102.62 3mqt h GLY 114 Ca 0.35 -0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.70 3mqt h GLY 114 CO -0.18 -0.02 0.48 0.50 0.00 0.00 0.00 176.54 177.32 3mqt h LYS 115 N 0.10 0.89 -0.47 4.80 1.57 -0.18 -0.90 116.57 122.39 3mqt h LYS 115 Ca 0.09 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 3mqt h LYS 115 Cb 0.10 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 3mqt h LYS 115 CO -0.13 0.59 0.11 1.96 -0.57 0.00 0.00 179.45 181.40 3mqt h GLN 116 N 0.92 0.75 -0.01 3.15 4.20 -0.13 -3.12 115.11 120.88 3mqt h GLN 116 Ca 0.28 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.80 3mqt h GLN 116 Cb -0.02 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.66 3mqt h GLN 116 CO -0.07 0.75 -0.32 1.28 -0.67 0.00 0.00 178.83 179.80 3mqt n LEU 117 N -4.48 1.06 -0.90 1.46 4.77 -0.58 -4.94 117.00 113.38 3mqt n LEU 117 Ca 0.01 -0.28 -0.09 0.00 -0.03 0.00 0.00 56.01 55.62 3mqt n LEU 117 Cb 0.22 -0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 41.18 3mqt n LEU 117 CO 0.39 0.20 -0.10 0.61 -1.33 0.00 0.00 177.39 177.16 3mqt n GLY 118 N 1.37 0.31 3.38 -0.72 0.00 -0.42 -5.05 105.19 104.05 3mqt n GLY 118 Ca 0.11 -0.56 -0.25 0.00 0.00 0.00 0.00 46.02 45.32 3mqt n GLY 118 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3mqt s VAL 119 N -2.40 2.10 0.60 1.61 -7.23 -0.72 -4.74 120.40 109.62 3mqt s VAL 119 Ca 0.00 -1.93 -0.18 0.00 -1.81 0.00 0.00 61.98 58.06 3mqt s VAL 119 Cb 0.00 -1.97 -0.03 0.00 0.56 0.00 0.00 36.38 34.94 3mqt s VAL 119 CO 0.00 -0.17 1.17 -2.16 -0.31 0.00 0.00 175.10 173.63 3mqt s PRO 120 N -2.62 2.96 0.40 4.82 0.04 -1.25 -0.71 135.00 138.65 3mqt s PRO 120 Ca 0.17 1.70 0.12 0.00 0.04 0.00 0.00 61.00 63.04 3mqt s PRO 120 Cb -0.07 -1.94 0.82 0.00 0.04 0.00 0.00 34.50 33.35 3mqt s PRO 120 CO 0.08 -1.18 1.90 0.00 0.04 0.00 0.00 177.00 177.84 3mqt h ALA 121 N 0.73 1.51 -0.51 8.56 0.00 -0.75 -2.22 119.26 126.58 3mqt h ALA 121 Ca -0.50 -0.25 0.13 0.00 0.00 0.00 0.00 54.91 54.29 3mqt h ALA 121 Cb 1.28 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 3mqt h ALA 121 CO 0.55 0.36 0.36 0.10 0.00 0.00 0.00 179.25 180.62 3mqt h TYR 122 N 0.06 0.15 -0.60 0.00 -0.00 -1.82 0.36 116.97 115.11 3mqt h TYR 122 Ca 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 58.73 58.70 3mqt h TYR 122 Cb 0.48 -0.05 -0.03 0.00 0.00 0.00 0.00 36.73 37.14 3mqt h TYR 122 CO 0.00 0.06 0.21 0.87 -0.00 0.00 0.00 178.16 179.30 3mqt h LYS 123 N 0.13 0.89 0.00 0.10 1.57 -1.74 0.18 116.57 117.70 3mqt h LYS 123 Ca 0.24 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 3mqt h LYS 123 Cb 0.79 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.95 3mqt h LYS 123 CO -0.03 0.76 0.00 1.28 -0.57 0.00 0.00 179.45 180.89 3mqt n LEU 124 N -4.30 0.08 -1.35 2.94 4.77 0.12 -2.96 117.00 116.30 3mqt n LEU 124 Ca 0.05 0.51 0.10 0.00 -0.03 0.00 0.00 56.01 56.64 3mqt n LEU 124 Cb 0.19 -0.49 0.31 0.00 -2.33 0.00 0.00 43.42 41.11 3mqt n LEU 124 CO 0.40 -0.07 0.76 0.23 -1.33 0.00 0.00 177.39 177.38 3mqt n MET 125 N -1.58 2.97 0.00 3.23 2.81 -0.74 -4.90 117.12 118.91 3mqt n MET 125 Ca 0.06 -2.51 0.00 0.00 -1.81 0.00 0.00 57.70 53.44 3mqt n MET 125 Cb 0.32 -1.66 0.00 0.00 -0.71 0.00 0.00 33.22 31.16 3mqt n MET 125 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3mqt n GLY 126 N 1.36 2.36 0.00 3.03 0.00 -1.15 -5.01 105.19 105.78 3mqt n GLY 126 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 3mqt n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mqt n GLY 127 N -0.55 2.73 3.75 -0.02 0.00 0.00 -4.97 105.19 106.13 3mqt n GLY 127 Ca 0.00 -1.78 -0.41 0.00 0.00 0.00 0.00 46.02 43.82 3mqt n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mqt s ALA 128 N -2.20 3.65 0.00 4.61 0.00 -1.26 -4.56 121.76 122.01 3mqt s ALA 128 Ca 0.00 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.38 3mqt s ALA 128 Cb 0.00 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.53 3mqt s ALA 128 CO 0.00 -0.84 0.77 1.04 0.00 0.00 0.00 175.76 176.72 3mqt n GLN 129 N 2.00 1.62 -4.13 0.00 6.02 0.06 -4.97 117.38 117.98 3mqt n GLN 129 Ca 0.06 -1.04 -0.13 0.00 -0.01 0.00 0.00 57.00 55.89 3mqt n GLN 129 Cb 0.39 -0.79 -0.11 0.00 1.02 0.00 0.00 30.24 30.76 3mqt n GLN 129 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 3mqt s LYS 130 N -0.55 0.73 0.27 -1.09 -2.85 -1.13 -4.79 119.74 110.33 3mqt s LYS 130 Ca 0.00 -1.07 0.03 0.00 -1.00 0.00 0.00 55.97 53.93 3mqt s LYS 130 Cb 0.00 -0.34 0.38 0.00 -2.06 0.00 0.00 37.83 35.81 3mqt s LYS 130 CO 0.00 0.04 1.68 0.00 0.10 0.00 0.00 175.35 177.16 3mqt h ALA 131 N 3.70 1.04 -2.52 0.59 0.00 -1.96 -3.46 119.26 116.65 3mqt h ALA 131 Ca -0.36 -0.40 -0.12 0.00 0.00 0.00 0.00 54.91 54.03 3mqt h ALA 131 Cb 1.19 -0.10 -0.17 0.00 0.00 0.00 0.00 17.79 18.71 3mqt h ALA 131 CO 0.52 0.59 -0.53 -0.65 0.00 0.00 0.00 179.25 179.18 3mqt s GLN 132 N -4.28 0.63 -0.35 0.00 -0.21 -1.26 -5.11 119.66 109.09 3mqt s GLN 132 Ca -0.06 -0.88 -0.16 0.00 0.02 0.00 0.00 55.36 54.28 3mqt s GLN 132 Cb 0.13 0.24 -0.01 0.00 1.00 0.00 0.00 33.01 34.38 3mqt s GLN 132 CO 0.79 -0.16 0.39 -1.17 -2.12 0.00 0.00 175.29 173.02 3mqt s LEU 133 N -2.40 4.47 -0.40 2.90 2.96 -1.26 -4.97 118.68 119.98 3mqt s LEU 133 Ca -0.01 -0.25 0.03 0.00 -0.22 0.00 0.00 54.13 53.68 3mqt s LEU 133 Cb 0.02 -2.37 0.11 0.00 0.50 0.00 0.00 46.19 44.44 3mqt s LEU 133 CO -0.07 -0.38 0.13 -0.89 -1.32 0.00 0.00 176.35 173.83 3mqt s THR 134 N 2.07 2.53 0.79 3.68 2.01 -1.26 -1.32 115.64 124.14 3mqt s THR 134 Ca 0.13 -2.55 -0.10 0.00 0.31 0.00 0.00 61.69 59.47 3mqt s THR 134 Cb -0.16 -2.81 0.09 0.00 0.01 0.00 0.00 72.50 69.62 3mqt s THR 134 CO 0.12 -0.67 1.14 -2.16 -0.69 0.00 0.00 174.62 172.36 3mqt s PRO 135 N 0.63 1.86 -0.04 4.92 0.05 -1.26 -3.99 135.00 137.17 3mqt s PRO 135 Ca 0.12 -0.10 -0.01 0.00 0.05 0.00 0.00 61.00 61.06 3mqt s PRO 135 Cb -0.21 -2.02 -0.04 0.00 0.05 0.00 0.00 34.50 32.29 3mqt s PRO 135 CO -0.06 -1.58 0.05 1.52 0.05 0.00 0.00 177.00 176.99 3mqt s TYR 136 N -3.50 3.25 -0.22 0.56 -0.85 -0.57 -4.44 117.35 111.58 3mqt s TYR 136 Ca 0.63 0.21 -0.08 0.00 -0.52 0.00 0.00 57.07 57.32 3mqt s TYR 136 Cb -0.10 -1.76 -0.04 0.00 0.38 0.00 0.00 41.96 40.44 3mqt s TYR 136 CO 0.48 0.53 0.08 -0.06 -1.52 0.00 0.00 175.55 175.07 3mqt s PHE 137 N -1.08 3.19 0.00 -3.49 0.08 -0.86 -1.49 117.98 114.33 3mqt s PHE 137 Ca 0.19 -0.07 -0.29 0.00 0.12 0.00 0.00 56.93 56.89 3mqt s PHE 137 Cb -0.12 -2.17 -0.04 0.00 -0.57 0.00 0.00 43.02 40.13 3mqt s PHE 137 CO 0.09 -0.05 0.93 0.99 -0.10 0.00 0.00 175.22 177.08 3mqt s THR 138 N 0.95 4.85 -0.27 0.64 2.01 -1.08 -1.49 115.64 121.25 3mqt s THR 138 Ca 0.05 1.95 0.02 0.00 0.31 0.00 0.00 61.69 64.02 3mqt s THR 138 Cb -0.14 -4.27 0.06 0.00 0.01 0.00 0.00 72.50 68.16 3mqt s THR 138 CO 0.03 0.20 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.31 3mqt s LEU 139 N 0.82 3.56 -0.11 4.42 1.43 -0.32 -4.82 118.68 123.67 3mqt s LEU 139 Ca 0.49 -1.42 0.03 0.00 -1.03 0.00 0.00 54.13 52.20 3mqt s LEU 139 Cb -0.21 -1.57 0.01 0.00 0.03 0.00 0.00 46.19 44.45 3mqt s LEU 139 CO 0.26 -0.21 -0.21 -0.47 0.23 0.00 0.00 176.35 175.96 3mqt s TYR 140 N 1.11 2.39 0.30 0.29 5.04 -1.26 -4.28 117.35 120.93 3mqt s TYR 140 Ca -0.08 -1.05 -0.03 0.00 -2.44 0.00 0.00 57.07 53.47 3mqt s TYR 140 Cb -0.20 -1.63 -0.05 0.00 0.35 0.00 0.00 41.96 40.44 3mqt s TYR 140 CO -0.05 -0.46 0.54 -1.25 -1.34 0.00 0.00 175.55 172.99 3mqt s PRO 141 N 0.57 3.58 -0.50 4.97 0.04 -1.26 -4.93 135.00 137.48 3mqt s PRO 141 Ca -0.14 -0.12 -0.18 0.00 0.04 0.00 0.00 61.00 60.60 3mqt s PRO 141 Cb -0.17 -2.67 0.07 0.00 0.04 0.00 0.00 34.50 31.77 3mqt s PRO 141 CO 0.04 0.21 0.53 0.45 0.04 0.00 0.00 177.00 178.28 3mqt s SER 142 N -3.41 6.19 0.05 6.66 0.15 -1.26 -5.03 113.70 117.05 3mqt s SER 142 Ca 0.42 -1.12 -0.10 0.00 0.70 0.00 0.00 55.95 55.86 3mqt s SER 142 Cb -0.10 -2.25 0.00 0.00 -1.71 0.00 0.00 66.02 61.96 3mqt s SER 142 CO 0.32 -0.80 0.20 0.68 1.20 0.00 0.00 173.24 174.84 3mqt s VAL 143 N 2.22 0.11 0.76 4.45 -7.23 -1.26 -5.05 120.40 114.40 3mqt s VAL 143 Ca 0.10 -0.92 -0.12 0.00 -1.81 0.00 0.00 61.98 59.23 3mqt s VAL 143 Cb -0.22 -0.98 0.06 0.00 0.56 0.00 0.00 36.38 35.80 3mqt s VAL 143 CO 0.09 -0.51 1.13 0.00 -0.31 0.00 0.00 175.10 175.50 3mqt s ALA 144 N -2.77 2.13 0.61 1.32 0.00 -1.26 -4.95 121.76 116.83 3mqt s ALA 144 Ca -0.03 0.51 -0.19 0.00 0.00 0.00 0.00 51.96 52.25 3mqt s ALA 144 Cb -0.00 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.73 3mqt s ALA 144 CO -0.05 -1.86 1.14 0.00 0.00 0.00 0.00 175.76 174.98 3mqt n ALA 145 N -3.24 0.71 -2.19 0.00 0.00 -1.26 -2.31 120.51 112.22 3mqt n ALA 145 Ca 0.11 0.03 -0.17 0.00 0.00 0.00 0.00 53.44 53.40 3mqt n ALA 145 Cb 0.52 -2.22 -0.02 0.00 0.00 0.00 0.00 19.45 17.73 3mqt n ALA 145 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3mqt n ASP 146 N -1.16 -5.09 -4.70 0.00 5.75 -1.26 -4.97 116.55 105.13 3mqt n ASP 146 Ca 0.14 0.06 -0.42 0.00 -0.01 0.00 0.00 54.79 54.56 3mqt n ASP 146 Cb 0.47 -4.16 -0.03 0.00 -1.03 0.00 0.00 41.12 36.37 3mqt n ASP 146 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3mqt s ALA 147 N -2.83 3.47 0.86 2.12 0.00 -0.98 -5.05 121.76 119.36 3mqt s ALA 147 Ca 0.00 0.74 -0.11 0.00 0.00 0.00 0.00 51.96 52.58 3mqt s ALA 147 Cb 0.00 -3.50 0.11 0.00 0.00 0.00 0.00 23.12 19.72 3mqt s ALA 147 CO 0.00 -0.68 1.09 0.95 0.00 0.00 0.00 175.76 177.13 3mqt s THR 148 N 1.86 2.81 0.43 0.00 -4.23 -1.26 -4.84 115.64 110.41 3mqt s THR 148 Ca 0.58 0.26 0.09 0.00 -1.18 0.00 0.00 61.69 61.45 3mqt s THR 148 Cb -0.27 -2.81 0.25 0.00 1.34 0.00 0.00 72.50 71.01 3mqt s THR 148 CO 0.25 -0.35 2.06 -0.07 -0.54 0.00 0.00 174.62 175.98 3mqt h LEU 149 N -1.40 0.33 -0.77 4.79 3.38 -1.99 -1.30 115.31 118.34 3mqt h LEU 149 Ca -0.48 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.41 3mqt h LEU 149 Cb 1.28 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 3mqt h LEU 149 CO 0.55 0.27 0.19 -1.28 0.09 0.00 0.00 178.44 178.25 3mqt h SER 150 N 0.38 1.05 0.67 -0.43 0.87 -2.00 -1.24 113.55 112.85 3mqt h SER 150 Ca 0.10 -0.21 -0.13 0.00 -1.23 0.00 0.00 61.79 60.31 3mqt h SER 150 Cb 0.00 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.67 3mqt h SER 150 CO -0.02 0.99 -0.64 -0.33 -0.53 0.00 0.00 176.83 176.31 3mqt h GLU 151 N 1.06 0.00 -0.27 2.24 5.08 -1.63 -2.41 114.58 118.65 3mqt h GLU 151 Ca 0.22 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.45 3mqt h GLU 151 Cb 0.35 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 3mqt h GLU 151 CO -0.00 0.64 -0.40 0.82 -1.00 0.00 0.00 179.01 179.07 3mqt h ILE 152 N 0.00 1.29 0.20 3.13 2.04 -0.90 -1.60 117.51 121.67 3mqt h ILE 152 Ca -0.01 -1.56 -0.01 0.00 1.00 0.00 0.00 64.86 64.28 3mqt h ILE 152 Cb 1.14 1.51 0.00 0.00 -0.74 0.00 0.00 36.82 38.74 3mqt h ILE 152 CO 0.08 0.50 -0.10 0.58 0.00 0.00 0.00 178.15 179.21 3mqt h VAL 153 N 0.52 0.86 -0.72 1.67 2.07 -1.07 0.10 116.25 119.68 3mqt h VAL 153 Ca 0.05 -0.35 0.16 0.00 0.82 0.00 0.00 66.70 67.38 3mqt h VAL 153 Cb 0.91 1.07 -0.12 0.00 -1.52 0.00 0.00 31.29 31.63 3mqt h VAL 153 CO 0.08 0.08 0.02 -0.33 0.02 0.00 0.00 177.57 177.44 3mqt h GLU 154 N -0.44 0.11 -0.07 1.57 4.39 -1.45 -1.48 114.58 117.21 3mqt h GLU 154 Ca -0.03 -0.01 -0.09 0.00 0.34 0.00 0.00 59.36 59.58 3mqt h GLU 154 Cb 0.34 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 3mqt h GLU 154 CO 0.05 0.08 -0.36 0.00 -1.16 0.00 0.00 179.01 177.61 3mqt h ALA 155 N 1.67 1.27 -0.06 3.43 0.00 -0.70 -2.50 119.26 122.36 3mqt h ALA 155 Ca 0.39 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 3mqt h ALA 155 Cb 0.68 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3mqt h ALA 155 CO -0.62 0.51 -0.21 1.88 0.00 0.00 0.00 179.25 180.81 3mqt h TYR 156 N 0.12 0.11 -0.30 0.00 0.05 0.20 -3.35 116.97 113.81 3mqt h TYR 156 Ca 0.01 -0.01 0.04 0.00 0.05 0.00 0.00 58.73 58.82 3mqt h TYR 156 Cb 0.70 -0.03 -0.04 0.00 1.01 0.00 0.00 36.73 38.37 3mqt h TYR 156 CO 0.01 0.32 0.04 0.87 -1.05 0.00 0.00 178.16 178.34 3mqt h LYS 157 N 0.10 0.14 -0.04 4.88 1.57 -0.91 -0.42 116.57 121.89 3mqt h LYS 157 Ca 0.02 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 3mqt h LYS 157 Cb 0.43 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 3mqt h LYS 157 CO 0.03 0.09 -0.24 -1.00 -0.57 0.00 0.00 179.45 177.76 3mqt h PRO 158 N 0.14 0.07 -0.20 3.15 0.13 -1.74 -0.53 132.00 133.03 3mqt h PRO 158 Ca 0.14 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 65.19 3mqt h PRO 158 Cb 0.16 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.28 3mqt h PRO 158 CO -0.20 0.31 -0.09 -0.07 -0.23 0.00 0.00 178.00 177.72 3mqt h LEU 159 N 0.07 0.42 -0.94 1.56 3.38 -1.46 -1.69 115.31 116.65 3mqt h LEU 159 Ca 0.01 -0.41 -0.08 0.00 0.09 0.00 0.00 57.88 57.49 3mqt h LEU 159 Cb 0.46 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 3mqt h LEU 159 CO 0.03 0.74 -0.11 0.40 0.09 0.00 0.00 178.44 179.59 3mqt h ILE 160 N 0.10 1.25 -0.38 1.22 2.04 -0.90 -2.11 117.51 118.73 3mqt h ILE 160 Ca 0.04 -1.10 -0.02 0.00 1.00 0.00 0.00 64.86 64.79 3mqt h ILE 160 Cb 0.58 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 3mqt h ILE 160 CO 0.03 0.37 0.17 0.00 0.00 0.00 0.00 178.15 178.71 3mqt h ALA 161 N 1.28 0.49 -0.57 1.87 0.00 -1.05 -1.98 119.26 119.30 3mqt h ALA 161 Ca 0.11 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3mqt h ALA 161 Cb 0.54 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3mqt h ALA 161 CO 0.03 0.07 0.22 -0.22 0.00 0.00 0.00 179.25 179.35 3mqt h LYS 162 N 0.47 0.83 -0.49 0.00 3.64 -0.99 -1.23 116.57 118.79 3mqt h LYS 162 Ca 0.13 -0.13 -0.10 0.00 -1.27 0.00 0.00 60.65 59.27 3mqt h LYS 162 Cb 0.15 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 3mqt h LYS 162 CO -0.01 0.69 -0.11 0.00 -2.27 0.00 0.00 179.45 177.75 3mqt h ALA 163 N 1.42 0.88 -0.78 5.00 0.00 -1.18 -1.65 119.26 122.95 3mqt h ALA 163 Ca 0.19 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3mqt h ALA 163 Cb 0.18 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3mqt h ALA 163 CO -0.02 0.64 0.45 0.87 0.00 0.00 0.00 179.25 181.19 3mqt h LYS 164 N 0.82 1.08 -0.37 0.00 1.57 -0.89 -0.97 116.57 117.81 3mqt h LYS 164 Ca 0.13 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 3mqt h LYS 164 Cb 0.63 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 3mqt h LYS 164 CO 0.04 0.79 0.05 1.49 -0.57 0.00 0.00 179.45 181.25 3mqt h GLU 165 N 1.08 0.56 -0.01 3.15 4.22 -0.69 -1.64 114.58 121.26 3mqt h GLU 165 Ca 0.28 -0.11 0.00 0.00 0.08 0.00 0.00 59.36 59.61 3mqt h GLU 165 Cb 0.00 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.17 3mqt h GLU 165 CO -0.05 0.55 -0.06 0.54 -2.18 0.00 0.00 179.01 177.81 3mqt n ARG 166 N -4.30 1.01 -1.60 1.92 5.12 -0.67 -4.93 116.66 113.21 3mqt n ARG 166 Ca 0.02 -0.37 -0.03 0.00 -1.93 0.00 0.00 57.85 55.54 3mqt n ARG 166 Cb 0.22 -1.49 -0.01 0.00 -1.16 0.00 0.00 32.46 30.02 3mqt n ARG 166 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3mqt n GLY 167 N 1.19 0.41 3.67 -0.13 0.00 -0.62 -1.04 105.19 108.68 3mqt n GLY 167 Ca 0.18 -0.87 -0.44 0.00 0.00 0.00 0.00 46.02 44.89 3mqt n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mqt n ALA 168 N -0.12 0.98 0.25 4.61 0.00 -0.41 -1.59 120.51 124.23 3mqt n ALA 168 Ca -0.03 0.39 0.12 0.00 0.00 0.00 0.00 53.44 53.92 3mqt n ALA 168 Cb 0.32 -2.23 0.11 0.00 0.00 0.00 0.00 19.45 17.65 3mqt n ALA 168 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3mqt h LYS 169 N 3.23 0.00 -1.80 0.00 1.79 -1.82 -3.46 116.57 114.52 3mqt h LYS 169 Ca -0.45 0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.03 3mqt h LYS 169 Cb 1.29 0.00 -0.22 0.00 -1.58 0.00 0.00 32.23 31.71 3mqt h LYS 169 CO 0.68 0.00 0.31 0.00 -1.08 0.00 0.00 179.45 179.36 3mqt s ALA 170 N -3.27 -1.86 0.02 3.86 0.00 -1.26 -1.25 121.76 118.00 3mqt s ALA 170 Ca 0.04 1.76 0.01 0.00 0.00 0.00 0.00 51.96 53.76 3mqt s ALA 170 Cb 0.09 -0.93 -0.02 0.00 0.00 0.00 0.00 23.12 22.26 3mqt s ALA 170 CO 0.73 -0.31 -0.04 0.14 0.00 0.00 0.00 175.76 176.28 3mqt s VAL 171 N -0.25 0.21 -0.13 0.00 -7.23 -0.62 -2.03 120.40 110.35 3mqt s VAL 171 Ca -0.02 -0.76 -0.01 0.00 -1.81 0.00 0.00 61.98 59.38 3mqt s VAL 171 Cb -0.03 -0.31 -0.02 0.00 0.56 0.00 0.00 36.38 36.58 3mqt s VAL 171 CO 0.01 -0.36 -0.10 -0.75 -0.31 0.00 0.00 175.10 173.60 3mqt s LYS 172 N -1.18 3.44 0.40 4.82 2.20 -0.56 -0.87 119.74 128.00 3mqt s LYS 172 Ca -0.11 -0.62 0.08 0.00 -0.36 0.00 0.00 55.97 54.95 3mqt s LYS 172 Cb -0.08 -2.72 -0.04 0.00 -1.51 0.00 0.00 37.83 33.48 3mqt s LYS 172 CO -0.00 0.26 0.23 0.14 -0.36 0.00 0.00 175.35 175.62 3mqt s VAL 173 N 0.27 2.54 0.11 4.02 -7.23 -0.62 -1.17 120.40 118.32 3mqt s VAL 173 Ca -0.07 -1.59 0.07 0.00 -1.81 0.00 0.00 61.98 58.59 3mqt s VAL 173 Cb -0.15 -3.00 -0.04 0.00 0.56 0.00 0.00 36.38 33.76 3mqt s VAL 173 CO 0.04 -0.03 -0.18 0.00 -0.31 0.00 0.00 175.10 174.62 3mqt s ILE 175 N -1.52 5.13 -0.03 0.00 1.01 -0.49 -4.94 121.20 120.37 3mqt s ILE 175 Ca 0.07 -1.68 -0.38 0.00 0.00 0.00 0.00 60.65 58.66 3mqt s ILE 175 Cb -0.08 -4.52 -0.16 0.00 0.01 0.00 0.00 42.46 37.70 3mqt s ILE 175 CO 0.04 -1.14 1.49 -0.38 0.00 0.00 0.00 174.94 174.95 3mqt n ILE 176 N 4.96 0.11 -1.68 2.92 2.08 -1.26 -4.49 119.36 121.99 3mqt n ILE 176 Ca 0.05 -0.02 -0.45 0.00 0.56 0.00 0.00 62.75 62.89 3mqt n ILE 176 Cb 0.45 -1.00 -0.04 0.00 -0.75 0.00 0.00 39.64 38.30 3mqt n ILE 176 CO 0.00 0.00 0.00 -2.65 0.56 0.00 0.00 176.55 174.46 3mqt n PRO 177 N 3.54 2.31 -3.15 0.38 -0.02 -1.26 -4.94 135.00 131.85 3mqt n PRO 177 Ca 0.21 0.83 0.04 0.00 -2.02 0.00 0.00 63.50 62.56 3mqt n PRO 177 Cb 0.18 -2.62 -0.01 0.00 -0.02 0.00 0.00 33.50 31.03 3mqt n PRO 177 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3mqt s ASN 178 N 1.07 -1.44 0.00 2.55 3.04 -1.26 -5.03 114.94 113.86 3mqt s ASN 178 Ca 0.78 0.55 0.23 0.00 0.04 0.00 0.00 52.86 54.46 3mqt s ASN 178 Cb -0.64 2.07 0.60 0.00 -1.54 0.00 0.00 41.25 41.74 3mqt s ASN 178 CO 0.37 -0.27 1.48 -0.90 -3.04 0.00 0.00 177.10 174.74 3mqt n ASP 179 N 5.42 2.43 -0.35 -4.21 3.85 -1.26 -3.78 116.55 118.65 3mqt n ASP 179 Ca 0.02 -1.83 0.04 0.00 -0.71 0.00 0.00 54.79 52.31 3mqt n ASP 179 Cb 0.52 -0.14 0.16 0.00 -1.35 0.00 0.00 41.12 40.32 3mqt n ASP 179 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 3mqt n LYS 180 N 0.84 1.44 -4.72 0.11 5.02 -1.26 -4.87 118.16 114.71 3mqt n LYS 180 Ca 0.17 -0.68 -0.25 0.00 -2.02 0.00 0.00 58.31 55.54 3mqt n LYS 180 Cb 0.46 -1.19 -0.16 0.00 -0.02 0.00 0.00 35.03 34.12 3mqt n LYS 180 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3mqt s VAL 181 N -1.77 1.27 0.71 -0.18 0.11 -1.25 -5.14 120.40 114.15 3mqt s VAL 181 Ca 0.16 -0.63 -0.11 0.00 -2.93 0.00 0.00 61.98 58.47 3mqt s VAL 181 Cb 0.08 -1.09 0.02 0.00 -1.53 0.00 0.00 36.38 33.86 3mqt s VAL 181 CO 0.12 0.37 1.08 -0.94 -3.33 0.00 0.00 175.10 172.40 3mqt s SER 182 N 0.07 5.30 0.45 3.54 1.04 -1.26 -4.95 113.70 117.89 3mqt s SER 182 Ca -0.03 1.32 0.15 0.00 0.48 0.00 0.00 55.95 57.87 3mqt s SER 182 Cb -0.11 -2.16 1.03 0.00 0.10 0.00 0.00 66.02 64.88 3mqt s SER 182 CO 0.02 -1.45 2.00 0.44 0.98 0.00 0.00 173.24 175.22 3mqt h ASP 183 N -0.73 0.00 -0.34 7.02 3.32 -1.98 -0.87 116.42 122.84 3mqt h ASP 183 Ca -0.45 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.59 3mqt h ASP 183 Cb 1.24 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 3mqt h ASP 183 CO 0.61 0.17 0.17 0.50 -1.72 0.00 0.00 179.24 178.97 3mqt h LYS 184 N 0.00 0.48 -0.16 3.56 3.11 -2.00 0.60 116.57 122.16 3mqt h LYS 184 Ca -0.00 -0.07 -0.07 0.00 -2.81 0.00 0.00 60.65 57.70 3mqt h LYS 184 Cb 0.31 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 31.44 3mqt h LYS 184 CO 0.02 0.43 -0.22 0.93 -2.81 0.00 0.00 179.45 177.80 3mqt h GLU 185 N 0.41 0.28 -0.34 1.90 5.08 -1.80 -2.70 114.58 117.41 3mqt h GLU 185 Ca 0.12 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 3mqt h GLU 185 Cb 0.10 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3mqt h GLU 185 CO -0.02 0.49 0.12 0.82 -1.00 0.00 0.00 179.01 179.42 3mqt h ILE 186 N 0.26 1.20 -0.51 3.13 1.08 -0.67 -1.08 117.51 120.91 3mqt h ILE 186 Ca 0.04 -0.63 0.08 0.00 -0.39 0.00 0.00 64.86 63.96 3mqt h ILE 186 Cb 0.53 0.98 -0.06 0.00 -3.07 0.00 0.00 36.82 35.20 3mqt h ILE 186 CO 0.04 0.22 0.17 0.58 -0.69 0.00 0.00 178.15 178.46 3mqt h VAL 187 N 0.40 0.79 -0.04 1.67 2.07 -0.71 -0.56 116.25 119.87 3mqt h VAL 187 Ca 0.11 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 3mqt h VAL 187 Cb 0.22 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 3mqt h VAL 187 CO -0.01 0.06 0.02 0.00 0.02 0.00 0.00 177.57 177.66 3mqt h ALA 188 N 1.36 0.05 -0.77 1.67 0.00 -1.35 -0.20 119.26 120.02 3mqt h ALA 188 Ca 0.25 -0.08 0.15 0.00 0.00 0.00 0.00 54.91 55.23 3mqt h ALA 188 Cb 0.29 -0.01 -0.14 0.00 0.00 0.00 0.00 17.79 17.92 3mqt h ALA 188 CO -0.27 -0.38 -0.25 -0.92 0.00 0.00 0.00 179.25 177.44 3mqt h TYR 189 N -0.08 -0.59 -0.06 0.00 3.20 -0.83 0.30 116.97 118.91 3mqt h TYR 189 Ca 0.01 0.07 -0.21 0.00 3.14 0.00 0.00 58.73 61.75 3mqt h TYR 189 Cb 0.15 0.38 0.00 0.00 1.54 0.00 0.00 36.73 38.79 3mqt h TYR 189 CO -0.03 -0.36 -0.82 -0.07 -1.64 0.00 0.00 178.16 175.24 3mqt h LEU 190 N -0.04 0.57 -0.57 2.82 3.38 -0.79 -2.18 115.31 118.51 3mqt h LEU 190 Ca 0.35 -0.41 0.06 0.00 0.09 0.00 0.00 57.88 57.96 3mqt h LEU 190 Cb 0.58 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.10 3mqt h LEU 190 CO -0.80 1.18 0.28 0.03 0.09 0.00 0.00 178.44 179.22 3mqt h ARG 191 N 0.30 0.51 -0.36 1.13 3.08 -0.62 -1.76 114.38 116.66 3mqt h ARG 191 Ca -0.05 -0.03 0.06 0.00 0.07 0.00 0.00 59.98 60.02 3mqt h ARG 191 Cb 1.43 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 31.31 3mqt h ARG 191 CO 0.15 0.34 0.03 0.93 -1.07 0.00 0.00 179.97 180.35 3mqt h GLU 192 N 0.53 0.14 -0.08 0.04 5.08 -0.69 -2.34 114.58 117.25 3mqt h GLU 192 Ca 0.26 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.54 3mqt h GLU 192 Cb 0.20 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 3mqt h GLU 192 CO -0.19 0.09 -0.26 -0.07 -1.00 0.00 0.00 179.01 177.57 3mqt h LEU 193 N 0.14 0.14 -0.56 1.33 3.38 -1.00 -1.31 115.31 117.42 3mqt h LEU 193 Ca 0.17 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.99 3mqt h LEU 193 Cb 0.22 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3mqt h LEU 193 CO -0.26 0.41 -0.14 -0.09 0.09 0.00 0.00 178.44 178.45 3mqt h ARG 194 N 0.13 1.00 -0.49 1.13 9.65 -1.07 0.21 114.38 124.94 3mqt h ARG 194 Ca 0.02 -0.38 0.03 0.00 -1.10 0.00 0.00 59.98 58.55 3mqt h ARG 194 Cb 0.54 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 29.03 3mqt h ARG 194 CO 0.04 1.07 0.27 0.93 2.80 0.00 0.00 179.97 185.07 3mqt h GLU 195 N 0.88 0.52 -0.33 0.20 5.08 -0.84 0.53 114.58 120.61 3mqt h GLU 195 Ca 0.13 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.34 3mqt h GLU 195 Cb 0.71 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 3mqt h GLU 195 CO 0.05 0.34 -0.27 0.28 -1.00 0.00 0.00 179.01 178.42 3mqt h VAL 196 N 0.53 1.28 -0.26 3.13 2.07 -0.83 -3.14 116.25 119.02 3mqt h VAL 196 Ca 0.20 -1.38 -0.17 0.00 0.82 0.00 0.00 66.70 66.18 3mqt h VAL 196 Cb 0.07 1.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.14 3mqt h VAL 196 CO -0.12 0.45 -0.51 0.40 0.02 0.00 0.00 177.57 177.81 3mqt h ILE 197 N 0.59 1.29 0.00 4.57 2.04 -0.11 -3.49 117.51 122.41 3mqt h ILE 197 Ca 0.08 -1.71 0.00 0.00 1.00 0.00 0.00 64.86 64.22 3mqt h ILE 197 Cb 0.76 1.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.48 3mqt h ILE 197 CO 0.06 0.55 0.00 0.61 0.00 0.00 0.00 178.15 179.37 3mqt n GLY 198 N 0.25 -1.87 0.26 5.37 0.00 0.13 -4.66 105.19 104.68 3mqt n GLY 198 Ca -0.03 -1.76 0.08 0.00 0.00 0.00 0.00 46.02 44.30 3mqt n GLY 198 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3mqt n TRP 199 N 0.00 0.00 -0.06 1.61 7.02 -1.26 -4.53 117.44 120.22 3mqt n TRP 199 Ca 0.00 -0.95 0.07 0.00 -1.02 0.00 0.00 57.50 55.60 3mqt n TRP 199 Cb 0.00 -0.16 0.16 0.00 -2.42 0.00 0.00 31.31 28.89 3mqt n TRP 199 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 3mqt n ASP 200 N -1.14 2.92 -3.96 -0.99 2.03 -1.26 -4.96 116.55 109.19 3mqt n ASP 200 Ca 0.14 -1.91 -0.13 0.00 0.52 0.00 0.00 54.79 53.41 3mqt n ASP 200 Cb 0.67 -0.22 -0.13 0.00 -0.72 0.00 0.00 41.12 40.72 3mqt n ASP 200 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 3mqt s MET 201 N -1.02 0.32 0.49 -0.67 -1.94 -1.26 -4.90 119.30 110.31 3mqt s MET 201 Ca 0.26 -0.30 -0.22 0.00 -1.71 0.00 0.00 55.69 53.71 3mqt s MET 201 Cb 0.14 -0.21 -0.07 0.00 2.01 0.00 0.00 34.83 36.70 3mqt s MET 201 CO 0.19 0.05 1.15 -0.51 -0.01 0.00 0.00 175.02 175.89 3mqt s ASP 202 N -0.55 6.02 -0.18 3.03 1.01 -0.38 -4.93 116.67 120.69 3mqt s ASP 202 Ca -0.03 2.26 0.01 0.00 0.71 0.00 0.00 52.55 55.50 3mqt s ASP 202 Cb -0.04 -2.60 0.03 0.00 1.01 0.00 0.00 42.92 41.33 3mqt s ASP 202 CO -0.00 -1.02 -0.14 -0.32 0.21 0.00 0.00 175.17 173.90 3mqt s MET 203 N -2.90 2.38 0.21 8.23 -2.45 -1.26 -1.59 119.30 121.93 3mqt s MET 203 Ca 0.67 -0.78 0.07 0.00 -1.25 0.00 0.00 55.69 54.39 3mqt s MET 203 Cb -0.27 -2.38 -0.04 0.00 1.25 0.00 0.00 34.83 33.39 3mqt s MET 203 CO 0.32 -0.32 0.13 -1.64 1.05 0.00 0.00 175.02 174.56 3mqt s MET 204 N 1.38 2.78 -0.07 4.11 -1.94 -0.05 -0.56 119.30 124.95 3mqt s MET 204 Ca 0.02 -1.04 0.01 0.00 -1.71 0.00 0.00 55.69 52.97 3mqt s MET 204 Cb -0.15 -2.52 0.02 0.00 2.01 0.00 0.00 34.83 34.19 3mqt s MET 204 CO -0.10 0.43 -0.07 0.08 -0.01 0.00 0.00 175.02 175.35 3mqt s VAL 205 N -1.98 0.83 -0.41 -6.03 1.01 -0.91 -1.59 120.40 111.32 3mqt s VAL 205 Ca 0.31 -0.25 -0.16 0.00 0.00 0.00 0.00 61.98 61.89 3mqt s VAL 205 Cb -0.09 -0.83 0.02 0.00 0.00 0.00 0.00 36.38 35.49 3mqt s VAL 205 CO 0.23 0.31 0.36 -0.62 0.00 0.00 0.00 175.10 175.38 3mqt s ASP 206 N 1.16 6.15 0.03 3.32 -1.08 0.16 -0.11 116.67 126.29 3mqt s ASP 206 Ca -0.06 -0.79 0.27 0.00 -0.52 0.00 0.00 52.55 51.44 3mqt s ASP 206 Cb -0.14 -2.19 1.11 0.00 -1.46 0.00 0.00 42.92 40.24 3mqt s ASP 206 CO -0.01 -0.50 1.85 0.00 0.52 0.00 0.00 175.17 177.02 3mqt n LEU 208 N -1.60 -2.08 -2.32 0.00 4.77 -1.22 -2.28 117.00 112.28 3mqt n LEU 208 Ca 0.06 -0.94 -0.19 0.00 -0.03 0.00 0.00 56.01 54.91 3mqt n LEU 208 Cb 0.32 -2.26 0.01 0.00 -2.33 0.00 0.00 43.42 39.17 3mqt n LEU 208 CO 0.25 0.37 -0.12 -1.22 -1.33 0.00 0.00 177.39 175.34 3mqt n TYR 209 N -4.46 -1.25 -0.25 -1.77 4.01 0.22 -4.84 117.16 108.82 3mqt n TYR 209 Ca -0.03 0.21 -0.00 0.00 -0.16 0.00 0.00 57.90 57.92 3mqt n TYR 209 Cb 0.55 -3.78 0.12 0.00 -0.31 0.00 0.00 39.34 35.92 3mqt n TYR 209 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 3mqt h ARG 210 N -0.57 0.71 -5.97 -0.72 2.43 -1.61 -3.45 114.38 105.19 3mqt h ARG 210 Ca -0.44 -0.04 -0.64 0.00 -0.81 0.00 0.00 59.98 58.04 3mqt h ARG 210 Cb 1.32 -0.16 -0.08 0.00 -0.42 0.00 0.00 29.97 30.63 3mqt h ARG 210 CO 0.50 0.47 -0.55 -1.58 -1.51 0.00 0.00 179.97 177.29 3mqt s TRP 211 N -6.08 3.36 -0.07 2.20 0.51 -1.02 -5.00 118.94 112.85 3mqt s TRP 211 Ca -0.13 0.23 0.04 0.00 -2.12 0.00 0.00 56.10 54.13 3mqt s TRP 211 Cb 0.17 -1.74 -0.07 0.00 -0.81 0.00 0.00 33.47 31.02 3mqt s TRP 211 CO 0.77 0.58 -0.00 0.25 -0.51 0.00 0.00 176.95 178.03 3mqt n THR 212 N 0.91 0.43 -3.43 2.01 -2.24 -1.26 -3.36 114.28 107.34 3mqt n THR 212 Ca -0.11 -0.24 -0.40 0.00 -2.27 0.00 0.00 64.05 61.03 3mqt n THR 212 Cb 0.52 -0.82 -0.10 0.00 -2.10 0.00 0.00 70.33 67.83 3mqt n THR 212 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3mqt s ASP 213 N -4.00 6.16 0.57 3.42 2.15 -1.26 -4.79 116.67 118.92 3mqt s ASP 213 Ca -0.05 -0.15 0.26 0.00 0.43 0.00 0.00 52.55 53.04 3mqt s ASP 213 Cb 0.02 -2.18 1.66 0.00 -0.30 0.00 0.00 42.92 42.11 3mqt s ASP 213 CO 0.24 -0.27 2.21 4.11 -0.17 0.00 0.00 175.17 181.29 3mqt h TRP 214 N 8.41 0.00 0.00 -5.34 5.08 -1.93 -1.47 115.95 120.71 3mqt h TRP 214 Ca -0.31 0.00 -0.11 0.00 1.08 0.00 0.00 58.89 59.55 3mqt h TRP 214 Cb 1.15 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 27.30 3mqt h TRP 214 CO 0.70 0.00 -0.52 1.96 -1.28 0.00 0.00 178.44 179.30 3mqt h GLN 215 N 0.00 0.00 -0.14 0.12 1.08 -1.94 0.26 115.11 114.49 3mqt h GLN 215 Ca 0.01 0.00 -0.17 0.00 -1.45 0.00 0.00 58.65 57.05 3mqt h GLN 215 Cb 0.05 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.49 3mqt h GLN 215 CO -0.00 0.52 -0.56 -0.22 -0.95 0.00 0.00 178.83 177.63 3mqt h LYS 216 N 0.00 0.62 -0.44 1.46 3.64 -1.69 -1.97 116.57 118.20 3mqt h LYS 216 Ca -0.01 -0.48 0.03 0.00 -1.27 0.00 0.00 60.65 58.92 3mqt h LYS 216 Cb 0.95 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.83 3mqt h LYS 216 CO 0.07 1.11 0.23 0.00 -2.27 0.00 0.00 179.45 178.58 3mqt h ALA 217 N 0.52 0.55 -0.52 5.00 0.00 -1.27 -2.52 119.26 121.01 3mqt h ALA 217 Ca -0.03 0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.93 3mqt h ALA 217 Cb 1.19 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 3mqt h ALA 217 CO 0.12 -0.12 0.27 -0.09 0.00 0.00 0.00 179.25 179.43 3mqt h ARG 218 N 0.45 0.52 -0.45 0.00 2.43 -0.43 -1.51 114.38 115.38 3mqt h ARG 218 Ca 0.18 -0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.39 3mqt h ARG 218 Cb 0.08 -0.12 -0.06 0.00 -0.42 0.00 0.00 29.97 29.46 3mqt h ARG 218 CO -0.12 0.34 0.13 2.35 -1.51 0.00 0.00 179.97 181.17 3mqt h TRP 219 N 0.53 0.23 -0.08 2.20 7.01 -1.19 -1.44 115.95 123.22 3mqt h TRP 219 Ca 0.22 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.25 3mqt h TRP 219 Cb 0.12 -0.04 -0.00 0.00 -2.10 0.00 0.00 29.16 27.14 3mqt h TRP 219 CO -0.09 0.06 0.03 1.15 -2.79 0.00 0.00 178.44 176.80 3mqt h THR 220 N 0.29 1.13 0.00 2.65 2.02 -0.90 -2.74 112.91 115.36 3mqt h THR 220 Ca 0.22 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 67.00 3mqt h THR 220 Cb 0.24 1.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 3mqt h THR 220 CO -0.25 0.11 -0.19 0.49 0.37 0.00 0.00 175.52 176.06 3mqt n PHE 221 N -4.95 0.28 -0.14 3.16 3.72 -0.65 -2.25 117.46 116.63 3mqt n PHE 221 Ca -0.06 0.08 -0.11 0.00 -0.05 0.00 0.00 57.45 57.31 3mqt n PHE 221 Cb 0.10 -0.57 -0.01 0.00 -0.94 0.00 0.00 39.48 38.06 3mqt n PHE 221 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 3mqt h ARG 222 N 0.00 0.78 -0.14 -1.08 2.43 -1.15 -2.80 114.38 112.42 3mqt h ARG 222 Ca 0.00 -0.29 -0.01 0.00 -0.81 0.00 0.00 59.98 58.87 3mqt h ARG 222 Cb 0.59 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 3mqt h ARG 222 CO 0.00 0.90 0.03 1.96 -1.51 0.00 0.00 179.97 181.35 3mqt h GLN 223 N 0.59 0.20 -0.60 0.20 1.08 -1.15 -3.06 115.11 112.38 3mqt h GLN 223 Ca 0.11 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 3mqt h GLN 223 Cb 0.60 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.99 3mqt h GLN 223 CO 0.04 0.19 0.00 1.28 -0.95 0.00 0.00 178.83 179.39 3mqt n LEU 224 N -4.45 3.43 -0.15 1.46 4.77 -1.08 -4.28 117.00 116.70 3mqt n LEU 224 Ca -0.01 -1.72 0.07 0.00 -0.03 0.00 0.00 56.01 54.32 3mqt n LEU 224 Cb 0.13 -0.44 0.39 0.00 -2.33 0.00 0.00 43.42 41.17 3mqt n LEU 224 CO 0.35 0.74 1.21 -0.33 -1.33 0.00 0.00 177.39 178.03 3mqt h GLU 225 N 3.39 0.66 0.00 3.23 5.08 -1.39 -2.31 114.58 123.23 3mqt h GLU 225 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3mqt h GLU 225 Cb 0.94 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.05 3mqt h GLU 225 CO 0.07 0.43 0.00 -0.40 -1.00 0.00 0.00 179.01 178.11 3mqt n ASP 226 N -4.48 0.55 -0.38 1.42 5.68 -1.26 -1.93 116.55 116.15 3mqt n ASP 226 Ca 0.10 0.59 0.14 0.00 -0.50 0.00 0.00 54.79 55.12 3mqt n ASP 226 Cb 0.24 -0.73 0.47 0.00 -1.14 0.00 0.00 41.12 39.97 3mqt n ASP 226 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 3mqt n ILE 227 N -2.06 0.00 -3.39 2.12 -5.35 -0.87 -4.98 119.36 104.83 3mqt n ILE 227 Ca 0.04 -0.20 -0.17 0.00 -0.27 0.00 0.00 62.75 62.16 3mqt n ILE 227 Cb 0.30 0.44 0.09 0.00 -1.74 0.00 0.00 39.64 38.73 3mqt n ILE 227 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 3mqt n ASP 228 N -0.16 -2.94 -4.76 7.28 2.03 -0.81 -4.92 116.55 112.26 3mqt n ASP 228 Ca 0.16 -0.63 -0.41 0.00 0.52 0.00 0.00 54.79 54.43 3mqt n ASP 228 Cb 0.35 -5.12 -0.01 0.00 -0.72 0.00 0.00 41.12 35.62 3mqt n ASP 228 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3mqt s LEU 229 N -6.15 4.35 0.02 -2.67 1.43 -1.26 -4.71 118.68 109.68 3mqt s LEU 229 Ca 0.09 2.92 -0.18 0.00 -1.03 0.00 0.00 54.13 55.93 3mqt s LEU 229 Cb -0.01 -3.65 -0.27 0.00 0.03 0.00 0.00 46.19 42.29 3mqt s LEU 229 CO 0.73 -0.82 1.06 0.22 0.23 0.00 0.00 176.35 177.77 3mqt h TYR 230 N 3.94 0.77 -3.41 0.29 3.20 -1.19 -3.44 116.97 117.12 3mqt h TYR 230 Ca -0.49 -0.47 -0.06 0.00 3.14 0.00 0.00 58.73 60.86 3mqt h TYR 230 Cb 1.23 -0.07 -0.13 0.00 1.54 0.00 0.00 36.73 39.30 3mqt h TYR 230 CO 0.56 1.31 -0.10 -0.59 -1.64 0.00 0.00 178.16 177.71 3mqt s PHE 231 N -2.98 -0.18 -0.19 -3.82 -0.12 -1.26 -3.76 117.98 105.67 3mqt s PHE 231 Ca -0.12 -0.14 0.01 0.00 -0.05 0.00 0.00 56.93 56.63 3mqt s PHE 231 Cb 0.04 0.23 0.03 0.00 -0.63 0.00 0.00 43.02 42.69 3mqt s PHE 231 CO 0.87 -0.68 -0.18 0.42 -0.05 0.00 0.00 175.22 175.59 3mqt s ILE 232 N -3.76 2.09 0.05 -4.49 1.01 -0.59 -2.14 121.20 113.38 3mqt s ILE 232 Ca 0.03 -1.06 0.03 0.00 0.00 0.00 0.00 60.65 59.65 3mqt s ILE 232 Cb 0.02 -1.94 -0.04 0.00 0.01 0.00 0.00 42.46 40.51 3mqt s ILE 232 CO -0.12 0.44 0.01 -0.70 0.00 0.00 0.00 174.94 174.58 3mqt s GLU 233 N 1.26 2.70 -1.44 2.79 2.12 0.84 -1.14 118.70 125.82 3mqt s GLU 233 Ca 0.03 -0.73 -0.04 0.00 0.36 0.00 0.00 54.97 54.59 3mqt s GLU 233 Cb -0.14 -2.62 0.03 0.00 0.26 0.00 0.00 34.13 31.65 3mqt s GLU 233 CO -0.12 0.58 0.56 0.00 -0.54 0.00 0.00 175.26 175.74 3mqt n ALA 234 N 0.86 -1.85 -0.02 6.30 0.00 -1.26 -0.76 120.51 123.77 3mqt n ALA 234 Ca -0.12 -0.18 -0.16 0.00 0.00 0.00 0.00 53.44 52.99 3mqt n ALA 234 Cb 0.52 -2.07 -0.11 0.00 0.00 0.00 0.00 19.45 17.78 3mqt n ALA 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mqt s LEU 236 N -8.48 2.51 0.42 0.00 1.43 -1.26 -2.44 118.68 110.87 3mqt s LEU 236 Ca -0.15 -1.54 -0.25 0.00 -1.03 0.00 0.00 54.13 51.16 3mqt s LEU 236 Cb 0.01 -0.81 -0.08 0.00 0.03 0.00 0.00 46.19 45.34 3mqt s LEU 236 CO 0.75 -0.72 1.24 -1.10 0.23 0.00 0.00 176.35 176.76 3mqt s GLN 237 N -3.83 3.89 0.49 1.70 -1.52 -1.21 -4.81 119.66 114.36 3mqt s GLN 237 Ca 0.17 2.00 0.19 0.00 -1.95 0.00 0.00 55.36 55.77 3mqt s GLN 237 Cb 0.04 -2.63 1.21 0.00 -0.22 0.00 0.00 33.01 31.42 3mqt s GLN 237 CO 0.09 -0.51 2.05 1.25 -0.25 0.00 0.00 175.29 177.92 3mqt h HIS 238 N 2.46 0.00 0.00 0.91 2.76 -1.98 -2.06 115.15 117.23 3mqt h HIS 238 Ca -0.49 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.68 3mqt h HIS 238 Cb 1.25 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.21 3mqt h HIS 238 CO 0.53 0.14 -0.19 -0.44 -1.30 0.00 0.00 177.93 176.67 3mqt h ASP 239 N 0.00 0.00 -1.95 3.26 3.32 -2.04 -3.43 116.42 115.58 3mqt h ASP 239 Ca -0.00 -0.02 -0.71 0.00 0.02 0.00 0.00 57.03 56.31 3mqt h ASP 239 Cb 0.27 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.66 3mqt h ASP 239 CO 0.02 0.01 1.41 -0.62 -1.72 0.00 0.00 179.24 178.34 3mqt s ASP 240 N -5.36 6.93 0.13 6.45 2.15 -0.78 -4.79 116.67 121.41 3mqt s ASP 240 Ca 0.07 -2.67 -0.11 0.00 0.43 0.00 0.00 52.55 50.27 3mqt s ASP 240 Cb 0.09 -2.44 -0.07 0.00 -0.30 0.00 0.00 42.92 40.20 3mqt s ASP 240 CO 0.67 -0.91 1.42 -0.07 -0.17 0.00 0.00 175.17 176.11 3mqt h LEU 241 N 10.45 0.97 -0.79 -1.34 4.07 -1.85 -2.92 115.31 123.90 3mqt h LEU 241 Ca 0.31 -0.51 -0.07 0.00 0.08 0.00 0.00 57.88 57.69 3mqt h LEU 241 Cb 0.90 -0.28 -0.03 0.00 1.08 0.00 0.00 40.66 42.34 3mqt h LEU 241 CO 1.26 1.31 0.15 0.40 -1.08 0.00 0.00 178.44 180.48 3mqt h ILE 242 N 0.67 1.26 -0.59 1.22 2.04 -1.90 -1.70 117.51 118.51 3mqt h ILE 242 Ca 0.02 -0.96 -0.04 0.00 1.00 0.00 0.00 64.86 64.88 3mqt h ILE 242 Cb 1.14 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.78 3mqt h ILE 242 CO 0.12 0.36 0.21 1.23 0.00 0.00 0.00 178.15 180.07 3mqt h GLY 243 N 1.06 0.93 0.98 5.37 0.00 -1.96 -2.11 103.07 107.34 3mqt h GLY 243 Ca 0.21 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 46.97 3mqt h GLY 243 CO 0.00 0.46 -0.02 0.45 0.00 0.00 0.00 176.54 177.44 3mqt h HIS 244 N 0.85 0.88 -0.74 5.60 3.86 -1.31 -1.32 115.15 122.96 3mqt h HIS 244 Ca 0.20 -0.16 -0.06 0.00 -1.16 0.00 0.00 60.37 59.18 3mqt h HIS 244 Cb 0.21 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 28.42 3mqt h HIS 244 CO 0.01 0.86 0.22 -0.56 0.86 0.00 0.00 177.93 179.33 3mqt h GLN 245 N 0.64 1.16 -0.36 2.45 -0.00 -1.02 0.72 115.11 118.71 3mqt h GLN 245 Ca 0.12 -0.25 -0.13 0.00 -0.00 0.00 0.00 58.65 58.39 3mqt h GLN 245 Cb 0.53 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.48 27.84 3mqt h GLN 245 CO 0.03 0.99 -0.27 0.87 -0.00 0.00 0.00 178.83 180.45 3mqt h LYS 246 N 1.11 0.82 -0.01 0.06 1.57 -1.29 -2.45 116.57 116.37 3mqt h LYS 246 Ca 0.24 -0.40 -0.00 0.00 -1.87 0.00 0.00 60.65 58.62 3mqt h LYS 246 Cb 0.32 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 3mqt h LYS 246 CO -0.01 1.04 0.00 1.25 -0.57 0.00 0.00 179.45 181.16 3mqt h LEU 247 N 0.61 0.02 -0.90 2.94 5.85 -1.10 -2.28 115.31 120.44 3mqt h LEU 247 Ca 0.07 -0.15 0.13 0.00 0.84 0.00 0.00 57.88 58.77 3mqt h LEU 247 Cb 0.85 -0.00 -0.09 0.00 0.37 0.00 0.00 40.66 41.78 3mqt h LEU 247 CO 0.07 0.17 0.51 0.00 -0.34 0.00 0.00 178.44 178.85 3mqt h ALA 248 N 0.85 1.36 0.00 1.25 0.00 -0.81 -0.72 119.26 121.18 3mqt h ALA 248 Ca 0.00 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3mqt h ALA 248 Cb 0.15 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3mqt h ALA 248 CO -0.00 0.03 -0.25 0.00 0.00 0.00 0.00 179.25 179.03 3mqt h ALA 249 N 1.54 0.93 0.11 0.00 0.00 -1.40 -3.29 119.26 117.15 3mqt h ALA 249 Ca 0.47 -0.23 -0.29 0.00 0.00 0.00 0.00 54.91 54.86 3mqt h ALA 249 Cb 0.58 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3mqt h ALA 249 CO -0.32 0.32 -1.45 0.00 0.00 0.00 0.00 179.25 177.81 3mqt h ALA 250 N 1.75 0.27 -4.12 0.00 0.00 -0.57 -3.48 119.26 113.11 3mqt h ALA 250 Ca -0.00 -1.07 -0.33 0.00 0.00 0.00 0.00 54.91 53.50 3mqt h ALA 250 Cb 0.92 0.21 0.11 0.00 0.00 0.00 0.00 17.79 19.03 3mqt h ALA 250 CO 0.03 1.14 0.24 0.44 0.00 0.00 0.00 179.25 181.10 3mqt n ILE 251 N -3.44 0.00 -0.70 0.00 -5.35 -0.58 -5.02 119.36 104.26 3mqt n ILE 251 Ca -0.14 -0.89 0.03 0.00 -0.27 0.00 0.00 62.75 61.49 3mqt n ILE 251 Cb 1.03 -1.43 0.05 0.00 -1.74 0.00 0.00 39.64 37.55 3mqt n ILE 251 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 3mqt n ASN 252 N -3.41 1.66 -0.48 7.28 6.94 -1.26 -4.99 115.26 120.99 3mqt n ASN 252 Ca 0.13 -2.25 0.00 0.00 -0.02 0.00 0.00 54.58 52.44 3mqt n ASN 252 Cb 0.44 -0.17 0.00 0.00 -2.36 0.00 0.00 39.78 37.69 3mqt n ASN 252 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 3mqt n THR 253 N -0.71 0.00 -2.99 5.53 -1.04 -1.26 -5.13 114.28 108.68 3mqt n THR 253 Ca 0.05 0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.67 3mqt n THR 253 Cb 0.46 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.92 3mqt n THR 253 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 3mqt s ARG 254 N -0.11 4.50 -0.04 -2.82 0.52 -1.25 -4.99 118.95 114.77 3mqt s ARG 254 Ca 0.00 1.07 -0.01 0.00 -0.52 0.00 0.00 55.73 56.27 3mqt s ARG 254 Cb 0.00 -3.34 -0.04 0.00 0.52 0.00 0.00 34.95 32.09 3mqt s ARG 254 CO 0.00 0.34 0.05 -1.17 0.02 0.00 0.00 175.30 174.54 3mqt s LEU 255 N -0.28 3.77 0.34 2.53 2.96 -1.26 -1.54 118.68 125.20 3mqt s LEU 255 Ca 0.38 0.15 0.07 0.00 -0.22 0.00 0.00 54.13 54.51 3mqt s LEU 255 Cb -0.21 -2.05 -0.03 0.00 0.50 0.00 0.00 46.19 44.40 3mqt s LEU 255 CO 0.23 0.32 0.31 0.00 -1.32 0.00 0.00 176.35 175.90 3mqt s GLY 257 N -4.02 0.10 -0.15 0.00 0.00 -0.86 -4.40 107.32 97.99 3mqt s GLY 257 Ca 0.42 -0.34 0.00 0.00 0.00 0.00 0.00 44.72 44.80 3mqt s GLY 257 CO 0.27 1.56 0.00 0.00 0.00 0.00 0.00 173.10 174.93 3mqt n ALA 258 N -0.63 -0.02 -0.36 3.20 0.00 -1.26 -1.58 120.51 119.85 3mqt n ALA 258 Ca -0.04 0.02 0.07 0.00 0.00 0.00 0.00 53.44 53.49 3mqt n ALA 258 Cb 0.60 -0.45 0.24 0.00 0.00 0.00 0.00 19.45 19.83 3mqt n ALA 258 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3mqt h GLU 259 N 0.42 0.97 -0.10 0.00 4.81 -1.95 -2.34 114.58 116.39 3mqt h GLU 259 Ca -0.03 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3mqt h GLU 259 Cb 0.15 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.31 3mqt h GLU 259 CO 0.04 0.64 0.00 -1.33 -0.73 0.00 0.00 179.01 177.63 3mqt n MET 260 N -4.62 2.35 -1.54 1.92 2.81 -1.26 -4.35 117.12 112.43 3mqt n MET 260 Ca 0.19 -1.98 -0.30 0.00 -1.81 0.00 0.00 57.70 53.80 3mqt n MET 260 Cb 0.36 -1.47 0.08 0.00 -0.71 0.00 0.00 33.22 31.48 3mqt n MET 260 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3mqt s SER 261 N -1.90 4.67 0.04 7.83 1.04 -0.88 -5.01 113.70 119.49 3mqt s SER 261 Ca 0.30 1.39 0.05 0.00 0.48 0.00 0.00 55.95 58.18 3mqt s SER 261 Cb 0.21 -2.16 -0.02 0.00 0.10 0.00 0.00 66.02 64.14 3mqt s SER 261 CO 0.30 -1.87 -0.15 0.42 0.98 0.00 0.00 173.24 172.93 3mqt s THR 262 N -3.12 1.18 0.00 2.02 -4.23 -1.26 -4.48 115.64 105.75 3mqt s THR 262 Ca 0.60 -1.03 0.00 0.00 -1.18 0.00 0.00 61.69 60.08 3mqt s THR 262 Cb -0.14 -1.06 0.00 0.00 1.34 0.00 0.00 72.50 72.63 3mqt s THR 262 CO 0.54 0.03 0.00 0.35 -0.54 0.00 0.00 174.62 175.00 3mqt n THR 263 N 1.88 0.00 0.30 3.99 -2.24 -0.22 -4.10 114.28 113.90 3mqt n THR 263 Ca -0.18 0.00 0.17 0.00 -2.27 0.00 0.00 64.05 61.77 3mqt n THR 263 Cb 0.54 0.00 0.82 0.00 -2.10 0.00 0.00 70.33 69.59 3mqt n THR 263 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 3mqt h ARG 264 N 0.00 0.00 -0.15 -0.78 0.11 -1.87 -2.77 114.38 108.92 3mqt h ARG 264 Ca 0.00 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 59.93 3mqt h ARG 264 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 3mqt h ARG 264 CO 0.00 0.00 -0.50 0.74 0.10 0.00 0.00 179.97 180.31 3mqt h PHE 265 N 0.00 0.80 -0.15 4.08 0.04 -1.99 -1.54 116.94 118.18 3mqt h PHE 265 Ca 0.00 -0.33 -0.04 0.00 2.80 0.00 0.00 57.97 60.41 3mqt h PHE 265 Cb 0.22 -0.13 -0.00 0.00 2.20 0.00 0.00 35.95 38.23 3mqt h PHE 265 CO 0.00 1.11 -0.05 0.93 -0.60 0.00 0.00 178.31 179.69 3mqt h GLU 266 N 0.26 0.30 -0.43 1.51 5.08 -1.68 -2.09 114.58 117.53 3mqt h GLU 266 Ca -0.02 -0.12 0.08 0.00 -1.00 0.00 0.00 59.36 58.30 3mqt h GLU 266 Cb 1.13 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 30.29 3mqt h GLU 266 CO 0.11 0.60 -0.05 0.00 -1.00 0.00 0.00 179.01 178.67 3mqt h ALA 267 N 0.69 0.34 -0.58 3.43 0.00 -1.51 -0.50 119.26 121.13 3mqt h ALA 267 Ca 0.04 0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 3mqt h ALA 267 Cb 0.50 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 3mqt h ALA 267 CO 0.02 -0.42 0.16 0.37 0.00 0.00 0.00 179.25 179.38 3mqt h GLN 268 N 0.06 0.87 -0.15 0.00 4.15 -1.28 -1.48 115.11 117.28 3mqt h GLN 268 Ca 0.21 -0.17 -0.00 0.00 0.77 0.00 0.00 58.65 59.46 3mqt h GLN 268 Cb 0.31 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 3mqt h GLN 268 CO -0.39 0.77 0.09 1.49 -1.93 0.00 0.00 178.83 178.85 3mqt h GLU 269 N 0.85 0.21 -0.63 1.69 4.81 -0.45 -1.04 114.58 120.01 3mqt h GLU 269 Ca 0.19 -0.02 0.13 0.00 -0.13 0.00 0.00 59.36 59.53 3mqt h GLU 269 Cb 0.27 -0.04 -0.10 0.00 0.63 0.00 0.00 28.75 29.51 3mqt h GLU 269 CO -0.01 0.20 0.08 -1.49 -0.73 0.00 0.00 179.01 177.07 3mqt h TRP 270 N 0.16 0.11 -0.30 0.92 4.06 -0.82 0.11 115.95 120.18 3mqt h TRP 270 Ca 0.05 0.04 -0.03 0.00 2.06 0.00 0.00 58.89 61.02 3mqt h TRP 270 Cb 0.05 0.05 -0.01 0.00 -1.00 0.00 0.00 29.16 28.25 3mqt h TRP 270 CO -0.05 -0.10 0.08 -0.07 -3.56 0.00 0.00 178.44 174.74 3mqt h LEU 271 N 0.19 0.45 -0.22 -4.49 4.07 -0.90 -1.07 115.31 113.34 3mqt h LEU 271 Ca 0.34 -0.23 -0.05 0.00 0.08 0.00 0.00 57.88 58.01 3mqt h LEU 271 Cb 0.54 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.15 3mqt h LEU 271 CO -0.48 0.56 -0.07 -0.08 -1.08 0.00 0.00 178.44 177.29 3mqt h GLU 272 N 0.32 0.45 0.00 1.13 4.57 -0.83 -2.63 114.58 117.59 3mqt h GLU 272 Ca 0.09 -0.18 -0.16 0.00 -1.18 0.00 0.00 59.36 57.93 3mqt h GLU 272 Cb 0.28 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.83 3mqt h GLU 272 CO 0.00 0.70 -1.17 -0.22 -1.18 0.00 0.00 179.01 177.14 3mqt h LYS 273 N 0.17 0.00 0.00 1.92 3.64 -0.70 -3.41 116.57 118.19 3mqt h LYS 273 Ca 0.05 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.39 3mqt h LYS 273 Cb 0.54 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 3mqt h LYS 273 CO 0.03 0.40 -1.16 0.25 -2.27 0.00 0.00 179.45 176.71 3mqt n THR 274 N -3.02 0.15 -2.19 1.00 -2.24 -0.41 -4.62 114.28 102.95 3mqt n THR 274 Ca -0.06 -0.10 -0.14 0.00 -2.27 0.00 0.00 64.05 61.48 3mqt n THR 274 Cb 0.83 -0.89 -0.01 0.00 -2.10 0.00 0.00 70.33 68.16 3mqt n THR 274 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mqt n GLY 275 N 2.84 -0.05 3.61 3.38 0.00 -0.99 -4.11 105.19 109.87 3mqt n GLY 275 Ca -0.04 -0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.29 3mqt n GLY 275 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3mqt n ILE 276 N -3.88 2.70 0.74 -0.61 -5.35 -1.26 -4.89 119.36 106.81 3mqt n ILE 276 Ca -0.17 -0.50 0.10 0.00 -0.27 0.00 0.00 62.75 61.92 3mqt n ILE 276 Cb 0.61 -1.14 -0.09 0.00 -1.74 0.00 0.00 39.64 37.28 3mqt n ILE 276 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 3mqt n SER 277 N 0.22 0.72 -3.78 7.28 7.64 -0.49 -4.87 113.62 120.33 3mqt n SER 277 Ca 0.10 -0.65 -0.17 0.00 1.01 0.00 0.00 58.87 59.17 3mqt n SER 277 Cb 0.41 1.12 -0.16 0.00 -1.01 0.00 0.00 64.21 64.57 3mqt n SER 277 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3mqt s VAL 278 N -3.13 0.08 -0.13 0.44 1.01 -1.18 -0.65 120.40 116.84 3mqt s VAL 278 Ca 0.04 0.17 -0.03 0.00 0.00 0.00 0.00 61.98 62.16 3mqt s VAL 278 Cb 0.15 -0.21 -0.03 0.00 0.00 0.00 0.00 36.38 36.29 3mqt s VAL 278 CO 0.86 0.14 -0.01 -0.69 0.00 0.00 0.00 175.10 175.40 3mqt s VAL 279 N 1.22 4.17 -0.15 2.92 1.01 0.06 -2.03 120.40 127.58 3mqt s VAL 279 Ca -0.07 -0.28 0.17 0.00 0.00 0.00 0.00 61.98 61.80 3mqt s VAL 279 Cb -0.13 -2.80 0.35 0.00 0.00 0.00 0.00 36.38 33.80 3mqt s VAL 279 CO -0.02 0.53 1.21 0.00 0.00 0.00 0.00 175.10 176.82 3mqt n GLN 280 N 2.95 1.55 -1.65 2.72 6.02 -0.61 -1.22 117.38 127.14 3mqt n GLN 280 Ca -0.18 -2.75 -0.57 0.00 -0.01 0.00 0.00 57.00 53.49 3mqt n GLN 280 Cb 0.53 -1.57 -0.07 0.00 1.02 0.00 0.00 30.24 30.14 3mqt n GLN 280 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 3mqt n SER 281 N -1.27 1.64 -4.75 1.08 7.64 -1.20 -1.67 113.62 115.08 3mqt n SER 281 Ca 0.18 1.12 -0.40 0.00 1.01 0.00 0.00 58.87 60.78 3mqt n SER 281 Cb 0.69 -1.09 -0.05 0.00 -1.01 0.00 0.00 64.21 62.75 3mqt n SER 281 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3mqt s ASP 282 N 1.94 7.34 0.27 6.43 -1.08 -1.26 -3.76 116.67 126.55 3mqt s ASP 282 Ca 0.94 1.59 -0.02 0.00 -0.52 0.00 0.00 52.55 54.54 3mqt s ASP 282 Cb -1.12 -2.50 0.59 0.00 -1.46 0.00 0.00 42.92 38.43 3mqt s ASP 282 CO 0.60 0.08 1.62 1.88 0.52 0.00 0.00 175.17 179.87 3mqt h TYR 283 N 5.12 0.04 -0.62 -5.34 0.05 -1.89 -1.72 116.97 112.62 3mqt h TYR 283 Ca -0.45 0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.39 3mqt h TYR 283 Cb 1.21 0.12 0.00 0.00 1.01 0.00 0.00 36.73 39.06 3mqt h TYR 283 CO 0.65 -0.29 0.00 0.27 -1.05 0.00 0.00 178.16 177.74 3mqt n ASN 284 N -5.36 4.11 0.00 3.88 0.23 -1.26 -3.70 115.26 113.16 3mqt n ASN 284 Ca 0.18 -2.27 0.00 0.00 -0.53 0.00 0.00 54.58 51.96 3mqt n ASN 284 Cb 0.61 -0.52 0.00 0.00 -2.08 0.00 0.00 39.78 37.79 3mqt n ASN 284 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3mqt n ARG 285 N 1.17 0.00 0.01 -3.83 1.74 -0.89 -2.00 116.66 112.86 3mqt n ARG 285 Ca 0.23 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.43 3mqt n ARG 285 Cb 0.74 -0.73 0.22 0.00 -1.02 0.00 0.00 32.46 31.67 3mqt n ARG 285 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3mqt n GLY 287 N 1.46 0.45 0.00 0.00 0.00 -1.26 -1.06 105.19 104.78 3mqt n GLY 287 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3mqt n GLY 287 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mqt n GLY 288 N 0.00 -1.32 0.33 -0.02 0.00 -1.24 -3.80 105.19 99.14 3mqt n GLY 288 Ca 0.00 -2.10 -0.05 0.00 0.00 0.00 0.00 46.02 43.87 3mqt n GLY 288 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3mqt h VAL 289 N 0.00 1.25 -0.96 1.61 2.07 -1.86 -0.73 116.25 117.63 3mqt h VAL 289 Ca 0.00 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.69 3mqt h VAL 289 Cb 0.00 0.40 -0.05 0.00 -1.52 0.00 0.00 31.29 30.12 3mqt h VAL 289 CO 0.00 0.33 0.61 0.74 0.02 0.00 0.00 177.57 179.27 3mqt h THR 290 N 1.08 1.26 0.10 2.57 2.02 -1.92 -1.03 112.91 116.99 3mqt h THR 290 Ca 0.24 -0.52 -0.27 0.00 0.77 0.00 0.00 66.41 66.64 3mqt h THR 290 Cb 0.24 -0.13 0.01 0.00 -1.74 0.00 0.00 68.15 66.53 3mqt h THR 290 CO -0.02 0.26 -1.17 -0.08 0.37 0.00 0.00 175.52 174.88 3mqt h GLU 291 N 1.32 0.37 -0.83 6.66 4.57 -1.71 -3.19 114.58 121.77 3mqt h GLU 291 Ca 0.35 -0.54 0.03 0.00 -1.18 0.00 0.00 59.36 58.02 3mqt h GLU 291 Cb -0.10 0.18 -0.05 0.00 -0.16 0.00 0.00 28.75 28.63 3mqt h GLU 291 CO -0.07 1.22 0.55 -0.07 -1.18 0.00 0.00 179.01 179.46 3mqt h LEU 292 N 0.15 0.90 -0.98 1.64 3.38 -0.74 -1.22 115.31 118.44 3mqt h LEU 292 Ca -0.13 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 57.90 3mqt h LEU 292 Cb 1.86 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 42.33 3mqt h LEU 292 CO 0.20 0.63 0.63 -0.07 0.09 0.00 0.00 178.44 179.92 3mqt h LEU 293 N 1.06 0.98 -0.50 1.67 3.38 -1.19 0.20 115.31 120.91 3mqt h LEU 293 Ca 0.32 0.02 -0.13 0.00 0.09 0.00 0.00 57.88 58.18 3mqt h LEU 293 Cb -0.01 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3mqt h LEU 293 CO -0.09 0.60 -0.21 0.03 0.09 0.00 0.00 178.44 178.85 3mqt h ARG 294 N 1.10 1.00 -0.59 1.13 3.08 -1.27 -2.80 114.38 116.03 3mqt h ARG 294 Ca 0.44 -0.43 -0.05 0.00 0.07 0.00 0.00 59.98 60.01 3mqt h ARG 294 Cb 0.25 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 3mqt h ARG 294 CO -0.20 1.11 0.15 0.82 -1.07 0.00 0.00 179.97 180.78 3mqt h ILE 295 N 0.86 1.25 -0.64 2.04 2.04 -0.93 -2.48 117.51 119.65 3mqt h ILE 295 Ca 0.11 -0.88 0.11 0.00 1.00 0.00 0.00 64.86 65.20 3mqt h ILE 295 Cb 0.80 0.70 -0.08 0.00 -0.74 0.00 0.00 36.82 37.49 3mqt h ILE 295 CO 0.07 0.33 0.20 -0.03 0.00 0.00 0.00 178.15 178.72 3mqt h MET 296 N 0.85 0.34 -0.66 2.37 4.05 -0.43 0.23 114.93 121.67 3mqt h MET 296 Ca 0.19 -0.02 -0.04 0.00 -0.28 0.00 0.00 59.70 59.54 3mqt h MET 296 Cb 0.33 -0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 31.03 3mqt h MET 296 CO -0.00 0.23 0.24 -0.44 0.23 0.00 0.00 176.91 177.17 3mqt h ASP 297 N 0.35 0.93 -0.27 1.39 3.32 -1.24 -0.01 116.42 120.90 3mqt h ASP 297 Ca 0.33 -0.19 -0.06 0.00 0.02 0.00 0.00 57.03 57.14 3mqt h ASP 297 Cb 0.47 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 3mqt h ASP 297 CO -0.37 0.87 -0.06 0.40 -1.72 0.00 0.00 179.24 178.36 3mqt h ILE 298 N 0.94 1.28 -0.73 0.35 2.04 -0.91 -2.68 117.51 117.82 3mqt h ILE 298 Ca 0.22 -1.07 0.09 0.00 1.00 0.00 0.00 64.86 65.09 3mqt h ILE 298 Cb 0.24 1.42 -0.07 0.00 -0.74 0.00 0.00 36.82 37.68 3mqt h ILE 298 CO -0.01 0.34 0.38 0.00 0.00 0.00 0.00 178.15 178.85 3mqt h GLU 300 N 0.65 0.12 -0.96 0.00 4.81 -0.79 -1.04 114.58 117.38 3mqt h GLU 300 Ca 0.35 -0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.68 3mqt h GLU 300 Cb 0.34 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.62 3mqt h GLU 300 CO -0.25 0.08 0.61 1.25 -0.73 0.00 0.00 179.01 179.97 3mqt h HIS 301 N 0.12 1.07 -0.04 0.92 2.76 -1.21 -2.00 115.15 116.77 3mqt h HIS 301 Ca 0.16 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.36 3mqt h HIS 301 Cb 0.21 -0.34 0.00 0.00 1.55 0.00 0.00 27.41 28.83 3mqt h HIS 301 CO -0.22 0.48 0.00 0.72 -1.30 0.00 0.00 177.93 177.61 3mqt n HIS 302 N -4.55 0.04 -4.01 5.26 8.25 -0.69 -4.93 115.22 114.59 3mqt n HIS 302 Ca 0.17 -0.02 -0.29 0.00 -0.26 0.00 0.00 57.72 57.32 3mqt n HIS 302 Cb 0.31 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.40 3mqt n HIS 302 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3mqt n ASN 303 N -0.22 -1.89 -4.84 0.41 5.15 -0.52 -5.01 115.26 108.34 3mqt n ASN 303 Ca 0.19 -0.96 -0.23 0.00 -0.60 0.00 0.00 54.58 52.98 3mqt n ASN 303 Cb 0.25 -3.16 -0.04 0.00 -0.53 0.00 0.00 39.78 36.30 3mqt n ASN 303 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3mqt s ALA 304 N -3.65 3.63 0.17 5.20 0.00 -0.51 -5.01 121.76 121.59 3mqt s ALA 304 Ca 0.31 -1.35 -0.04 0.00 0.00 0.00 0.00 51.96 50.88 3mqt s ALA 304 Cb -0.17 -1.37 -0.05 0.00 0.00 0.00 0.00 23.12 21.53 3mqt s ALA 304 CO 0.89 0.30 0.40 -0.65 0.00 0.00 0.00 175.76 176.69 3mqt s GLN 305 N -3.71 3.60 -0.34 0.00 -0.21 0.17 -4.34 119.66 114.83 3mqt s GLN 305 Ca 0.33 -0.13 -0.03 0.00 0.02 0.00 0.00 55.36 55.55 3mqt s GLN 305 Cb -0.08 -2.82 0.07 0.00 1.00 0.00 0.00 33.01 31.17 3mqt s GLN 305 CO 0.25 0.43 0.09 -1.17 -2.12 0.00 0.00 175.29 172.77 3mqt s LEU 306 N -2.88 4.43 -0.63 2.90 2.96 -1.26 -0.76 118.68 123.43 3mqt s LEU 306 Ca 0.41 -1.47 0.05 0.00 -0.22 0.00 0.00 54.13 52.89 3mqt s LEU 306 Cb -0.12 -1.79 0.16 0.00 0.50 0.00 0.00 46.19 44.94 3mqt s LEU 306 CO 0.26 -0.37 0.42 -0.04 -1.32 0.00 0.00 176.35 175.30 3mqt s MET 307 N 1.26 2.19 0.27 1.98 -1.94 -0.36 -4.80 119.30 117.90 3mqt s MET 307 Ca -0.00 -3.03 -0.31 0.00 -1.71 0.00 0.00 55.69 50.64 3mqt s MET 307 Cb -0.21 -3.21 -0.12 0.00 2.01 0.00 0.00 34.83 33.30 3mqt s MET 307 CO -0.01 -1.25 1.55 -2.30 -0.01 0.00 0.00 175.02 173.00 3mqt n PRO 308 N 2.37 2.51 -1.74 2.03 -0.02 -1.26 -4.29 135.00 134.60 3mqt n PRO 308 Ca 0.16 0.89 -0.42 0.00 -2.02 0.00 0.00 63.50 62.12 3mqt n PRO 308 Cb 0.35 -2.64 -0.02 0.00 -0.02 0.00 0.00 33.50 31.17 3mqt n PRO 308 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 3mqt n HIS 309 N 2.19 2.84 -3.36 6.00 -0.00 -0.67 -4.24 115.22 117.97 3mqt n HIS 309 Ca 0.10 0.25 -0.19 0.00 -0.00 0.00 0.00 57.72 57.89 3mqt n HIS 309 Cb 0.35 -2.60 -0.08 0.00 -0.00 0.00 0.00 29.99 27.66 3mqt n HIS 309 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 3mqt s ASN 310 N 0.50 1.36 -0.45 0.26 2.47 -1.26 -3.72 114.94 114.11 3mqt s ASN 310 Ca 0.64 -1.74 0.06 0.00 0.42 0.00 0.00 52.86 52.24 3mqt s ASN 310 Cb -0.50 0.42 0.19 0.00 -1.45 0.00 0.00 41.25 39.91 3mqt s ASN 310 CO 0.48 -0.26 0.53 1.87 -3.72 0.00 0.00 177.10 176.00 3mqt n TRP 311 N 4.12 -1.94 0.00 0.43 -0.00 -1.26 -4.04 117.44 114.74 3mqt n TRP 311 Ca 0.12 -2.62 0.00 0.00 -0.00 0.00 0.00 57.50 55.00 3mqt n TRP 311 Cb 0.44 0.66 0.00 0.00 -0.00 0.00 0.00 31.31 32.41 3mqt n TRP 311 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 3mqt n LYS 312 N 2.57 0.00 -4.48 5.87 4.76 -1.26 -5.16 118.16 120.46 3mqt n LYS 312 Ca 0.23 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.45 3mqt n LYS 312 Cb 0.52 0.00 -0.11 0.00 -1.84 0.00 0.00 35.03 33.61 3mqt n LYS 312 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 3mqt s THR 313 N 1.65 1.35 -0.31 -0.18 2.01 -1.26 -4.71 115.64 114.20 3mqt s THR 313 Ca 0.00 -2.01 0.18 0.00 0.31 0.00 0.00 61.69 60.17 3mqt s THR 313 Cb 0.00 -2.82 0.18 0.00 0.01 0.00 0.00 72.50 69.87 3mqt s THR 313 CO 0.00 -0.01 1.54 0.61 -0.69 0.00 0.00 174.62 176.07 3mqt n GLY 314 N -0.73 -0.80 0.08 4.40 0.00 -1.26 -2.23 105.19 104.66 3mqt n GLY 314 Ca -0.03 0.17 -0.12 0.00 0.00 0.00 0.00 46.02 46.04 3mqt n GLY 314 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3mqt h ILE 315 N 0.00 1.25 -0.03 -0.61 2.04 -1.96 -2.49 117.51 115.70 3mqt h ILE 315 Ca 0.00 -0.77 -0.08 0.00 1.00 0.00 0.00 64.86 65.01 3mqt h ILE 315 Cb 0.03 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 3mqt h ILE 315 CO 0.00 0.22 -0.35 0.74 0.00 0.00 0.00 178.15 178.76 3mqt h THR 316 N -0.13 1.26 -0.99 -0.27 2.02 -1.85 -2.97 112.91 109.98 3mqt h THR 316 Ca 0.02 -1.23 0.02 0.00 0.77 0.00 0.00 66.41 65.99 3mqt h THR 316 Cb 0.34 1.62 -0.05 0.00 -1.74 0.00 0.00 68.15 68.32 3mqt h THR 316 CO 0.00 0.36 0.65 0.00 0.37 0.00 0.00 175.52 176.90 3mqt h ALA 317 N 1.60 1.28 -0.63 6.16 0.00 -1.32 0.61 119.26 126.96 3mqt h ALA 317 Ca 0.00 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3mqt h ALA 317 Cb 0.64 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 3mqt h ALA 317 CO 0.05 0.60 0.10 0.00 0.00 0.00 0.00 179.25 180.00 3mqt h ALA 318 N 1.38 0.98 -0.46 0.00 0.00 -1.30 -0.01 119.26 119.86 3mqt h ALA 318 Ca 0.38 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 3mqt h ALA 318 Cb -0.09 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 3mqt h ALA 318 CO -0.10 0.64 -0.04 0.00 0.00 0.00 0.00 179.25 179.75 3mqt h ALA 319 N 1.13 0.62 -0.27 0.00 0.00 -1.28 -2.78 119.26 116.68 3mqt h ALA 319 Ca 0.20 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 3mqt h ALA 319 Cb 0.42 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3mqt h ALA 319 CO 0.01 0.46 0.10 0.00 0.00 0.00 0.00 179.25 179.82 3mqt h ALA 320 N 0.90 1.67 -0.29 0.00 0.00 -0.34 0.59 119.26 121.79 3mqt h ALA 320 Ca 0.12 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3mqt h ALA 320 Cb 0.56 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3mqt h ALA 320 CO 0.03 0.26 -0.01 0.00 0.00 0.00 0.00 179.25 179.54 3mqt h ARG 321 N 0.38 0.51 -0.13 0.00 3.08 -0.80 0.14 114.38 117.56 3mqt h ARG 321 Ca 0.10 -0.17 -0.21 0.00 0.07 0.00 0.00 59.98 59.77 3mqt h ARG 321 Cb 0.09 -0.04 0.01 0.00 0.08 0.00 0.00 29.97 30.11 3mqt h ARG 321 CO -0.01 0.67 -0.74 0.45 -1.07 0.00 0.00 179.97 179.27 3mqt h HIS 322 N 0.30 1.00 -0.24 3.04 3.86 -1.29 -2.53 115.15 119.28 3mqt h HIS 322 Ca 0.08 -0.45 -0.14 0.00 -1.16 0.00 0.00 60.37 58.70 3mqt h HIS 322 Cb 0.44 -0.15 -0.00 0.00 1.06 0.00 0.00 27.41 28.76 3mqt h HIS 322 CO 0.04 1.27 -0.38 0.35 0.86 0.00 0.00 177.93 180.07 3mqt h PHE 323 N 0.44 0.85 -1.00 2.45 3.57 -0.92 -3.03 116.94 119.29 3mqt h PHE 323 Ca -0.06 -0.29 0.27 0.00 3.53 0.00 0.00 57.97 61.43 3mqt h PHE 323 Cb 1.38 -0.16 -0.13 0.00 2.79 0.00 0.00 35.95 39.82 3mqt h PHE 323 CO 0.09 1.05 0.59 0.78 -2.23 0.00 0.00 178.31 178.59 3mqt h GLY 324 N 0.40 1.97 1.76 2.40 0.00 -0.74 -0.88 103.07 107.97 3mqt h GLY 324 Ca 0.02 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.06 3mqt h GLY 324 CO 0.09 -0.33 -0.17 4.51 0.00 0.00 0.00 176.54 180.64 3mqt n ILE 325 N -4.94 0.47 -0.02 2.60 0.13 -0.96 -3.31 119.36 113.34 3mqt n ILE 325 Ca 0.29 -0.25 0.10 0.00 -1.10 0.00 0.00 62.75 61.78 3mqt n ILE 325 Cb 0.82 -0.44 -0.17 0.00 -0.84 0.00 0.00 39.64 39.02 3mqt n ILE 325 CO 0.00 0.00 0.00 0.52 2.80 0.00 0.00 176.55 179.87 3mqt n VAL 326 N -2.14 0.08 -2.57 9.51 0.31 -0.69 -0.76 118.33 122.07 3mqt n VAL 326 Ca 0.05 -0.52 -0.43 0.00 -0.01 0.00 0.00 64.34 63.43 3mqt n VAL 326 Cb 0.42 -0.02 0.00 0.00 -0.91 0.00 0.00 33.84 33.33 3mqt n VAL 326 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3mqt h HIS 328 N 6.53 0.00 0.00 0.00 2.07 -1.86 -2.19 115.15 119.70 3mqt h HIS 328 Ca 0.38 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.90 3mqt h HIS 328 Cb 0.76 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.74 3mqt h HIS 328 CO 1.22 0.00 0.00 0.44 -3.07 0.00 0.00 177.93 176.52 3mqt n ILE 329 N -2.63 0.42 -4.58 6.12 -5.35 -1.26 -4.75 119.36 107.33 3mqt n ILE 329 Ca -0.00 -0.04 -0.33 0.00 -0.27 0.00 0.00 62.75 62.10 3mqt n ILE 329 Cb 0.16 -0.66 -0.15 0.00 -1.74 0.00 0.00 39.64 37.25 3mqt n ILE 329 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 3mqt s SER 330 N -3.66 3.93 0.17 7.28 0.01 -0.82 -4.68 113.70 115.92 3mqt s SER 330 Ca 0.11 -0.38 -0.06 0.00 1.31 0.00 0.00 55.95 56.93 3mqt s SER 330 Cb 0.14 -1.61 0.04 0.00 0.21 0.00 0.00 66.02 64.80 3mqt s SER 330 CO 0.50 0.11 1.46 -0.08 0.41 0.00 0.00 173.24 175.65 3mqt h GLU 331 N 7.08 0.63 -5.21 12.44 4.81 -1.86 -3.45 114.58 129.02 3mqt h GLU 331 Ca -0.30 -0.42 -0.37 0.00 -0.13 0.00 0.00 59.36 58.14 3mqt h GLU 331 Cb 1.20 0.06 -0.14 0.00 0.63 0.00 0.00 28.75 30.49 3mqt h GLU 331 CO 0.57 1.04 -0.71 0.71 -0.73 0.00 0.00 179.01 179.89 3mqt s TYR 332 N -3.97 1.45 0.14 0.92 2.02 -1.26 -4.67 117.35 111.99 3mqt s TYR 332 Ca -0.08 -0.73 0.05 0.00 -0.37 0.00 0.00 57.07 55.93 3mqt s TYR 332 Cb 0.11 -0.74 -0.04 0.00 -0.40 0.00 0.00 41.96 40.89 3mqt s TYR 332 CO 0.86 0.14 -0.11 0.14 -1.57 0.00 0.00 175.55 175.01 3mqt s VAL 333 N -3.24 1.23 0.25 0.71 -7.23 -1.26 -4.71 120.40 106.15 3mqt s VAL 333 Ca 0.20 -1.94 -0.30 0.00 -1.81 0.00 0.00 61.98 58.14 3mqt s VAL 333 Cb 0.02 -1.72 -0.09 0.00 0.56 0.00 0.00 36.38 35.15 3mqt s VAL 333 CO 0.04 -0.63 1.28 -0.70 -0.31 0.00 0.00 175.10 174.77 3mqt s GLU 334 N -3.35 4.42 -0.03 4.82 2.12 -1.26 -1.51 118.70 123.91 3mqt s GLU 334 Ca 0.14 2.06 -0.00 0.00 0.36 0.00 0.00 54.97 57.53 3mqt s GLU 334 Cb -0.00 -3.16 0.03 0.00 0.26 0.00 0.00 34.13 31.26 3mqt s GLU 334 CO 0.02 -0.16 0.03 -0.47 -0.54 0.00 0.00 175.26 174.13 3mqt s TYR 335 N -0.42 0.13 -0.33 5.30 5.04 -0.56 -4.71 117.35 121.81 3mqt s TYR 335 Ca 0.53 0.11 -0.14 0.00 -2.44 0.00 0.00 57.07 55.13 3mqt s TYR 335 Cb -0.37 -0.34 -0.02 0.00 0.35 0.00 0.00 41.96 41.58 3mqt s TYR 335 CO 0.43 -0.13 0.30 -1.17 -1.34 0.00 0.00 175.55 173.64 3mqt s LEU 336 N 1.28 4.37 -0.04 6.97 2.96 -1.26 -2.62 118.68 130.34 3mqt s LEU 336 Ca -0.06 -0.22 0.05 0.00 -0.22 0.00 0.00 54.13 53.68 3mqt s LEU 336 Cb -0.13 -2.25 -0.02 0.00 0.50 0.00 0.00 46.19 44.29 3mqt s LEU 336 CO -0.03 -0.25 -0.19 -2.28 -1.32 0.00 0.00 176.35 172.28 3mqt s HIS 337 N 1.89 2.55 0.58 5.38 5.65 -1.26 -4.97 115.29 125.11 3mqt s HIS 337 Ca 0.10 -0.28 0.29 0.00 0.25 0.00 0.00 55.06 55.41 3mqt s HIS 337 Cb -0.17 -1.58 1.47 0.00 -1.18 0.00 0.00 32.58 31.13 3mqt s HIS 337 CO 0.11 0.09 1.91 -1.35 -0.65 0.00 0.00 174.74 174.84 3mqt h PRO 338 N 5.42 0.00 0.00 2.88 0.11 -1.86 -0.09 132.00 138.47 3mqt h PRO 338 Ca -0.45 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 3mqt h PRO 338 Cb 1.14 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 3mqt h PRO 338 CO 0.49 0.00 -0.04 -0.44 -0.21 0.00 0.00 178.00 177.79 3mqt h ASP 339 N 0.00 0.00 -0.01 -2.05 3.32 -1.97 -3.15 116.42 112.56 3mqt h ASP 339 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 3mqt h ASP 339 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 3mqt h ASP 339 CO -0.00 0.04 -0.23 0.49 -1.72 0.00 0.00 179.24 177.82 3mqt n PHE 340 N -4.17 0.00 -3.77 4.55 3.72 -0.06 -4.98 117.46 112.74 3mqt n PHE 340 Ca -0.03 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.24 3mqt n PHE 340 Cb 0.13 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.52 3mqt n PHE 340 CO 0.00 0.00 0.00 -0.46 -0.05 0.00 0.00 176.76 176.25 3mqt s TRP 341 N -1.41 -0.10 -1.29 1.38 -0.11 -1.14 -4.66 118.94 111.61 3mqt s TRP 341 Ca 0.08 0.34 0.18 0.00 1.22 0.00 0.00 56.10 57.92 3mqt s TRP 341 Cb 0.08 -0.10 0.60 0.00 -1.50 0.00 0.00 33.47 32.55 3mqt s TRP 341 CO 0.26 -0.12 1.52 -1.71 -4.62 0.00 0.00 176.95 172.28 3mqt n ASN 342 N 3.96 4.10 -4.59 5.86 5.15 -1.26 -4.58 115.26 123.90 3mqt n ASN 342 Ca -0.24 -2.26 -0.41 0.00 -0.60 0.00 0.00 54.58 51.08 3mqt n ASN 342 Cb 0.53 -0.48 0.02 0.00 -0.53 0.00 0.00 39.78 39.32 3mqt n ASN 342 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3mqt n GLY 343 N 1.06 -0.43 0.30 8.20 0.00 -1.26 -4.83 105.19 108.23 3mqt n GLY 343 Ca 0.22 0.08 -0.06 0.00 0.00 0.00 0.00 46.02 46.26 3mqt n GLY 343 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3mqt h THR 344 N 1.24 1.23 -0.30 2.61 2.02 -1.98 -1.24 112.91 116.50 3mqt h THR 344 Ca -0.45 -0.65 -0.14 0.00 0.77 0.00 0.00 66.41 65.95 3mqt h THR 344 Cb 1.35 0.36 -0.00 0.00 -1.74 0.00 0.00 68.15 68.12 3mqt h THR 344 CO 0.55 0.27 -0.34 -0.07 0.37 0.00 0.00 175.52 176.30 3mqt h LEU 345 N 0.98 0.82 -1.58 2.58 3.38 -1.94 -0.07 115.31 119.49 3mqt h LEU 345 Ca 0.24 -0.48 0.01 0.00 0.09 0.00 0.00 57.88 57.74 3mqt h LEU 345 Cb 0.11 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 3mqt h LEU 345 CO -0.03 1.14 0.30 0.74 0.09 0.00 0.00 178.44 180.67 3mqt h THR 346 N 0.52 1.10 0.00 0.22 2.02 -1.75 -0.15 112.91 114.86 3mqt h THR 346 Ca 0.04 -0.20 -0.19 0.00 0.77 0.00 0.00 66.41 66.83 3mqt h THR 346 Cb 0.92 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 67.77 3mqt h THR 346 CO 0.08 0.11 -1.58 0.00 0.37 0.00 0.00 175.52 174.49 3mqt n GLN 347 N -4.47 0.63 0.00 6.66 1.13 -0.50 -4.65 117.38 116.18 3mqt n GLN 347 Ca 0.04 0.19 0.00 0.00 -1.94 0.00 0.00 57.00 55.29 3mqt n GLN 347 Cb 0.08 -1.76 0.00 0.00 0.11 0.00 0.00 30.24 28.67 3mqt n GLN 347 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3mqt n GLN 348 N -2.86 2.49 0.05 -1.09 6.02 -0.05 -4.78 117.38 117.15 3mqt n GLN 348 Ca -0.13 0.00 -0.03 0.00 -0.01 0.00 0.00 57.00 56.83 3mqt n GLN 348 Cb 0.88 -0.96 0.21 0.00 1.02 0.00 0.00 30.24 31.39 3mqt n GLN 348 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 3mqt h LEU 349 N 0.00 0.39 -9.10 1.08 5.85 -1.17 -3.42 115.31 108.94 3mqt h LEU 349 Ca 0.00 -0.14 -0.65 0.00 0.84 0.00 0.00 57.88 57.93 3mqt h LEU 349 Cb 0.58 -0.11 -0.17 0.00 0.37 0.00 0.00 40.66 41.33 3mqt h LEU 349 CO 0.00 0.70 -0.80 0.42 -0.34 0.00 0.00 178.44 178.41 3mqt s THR 350 N -4.34 2.49 0.13 1.05 -4.23 -1.26 -1.23 115.64 108.25 3mqt s THR 350 Ca -0.06 -2.03 0.04 0.00 -1.18 0.00 0.00 61.69 58.46 3mqt s THR 350 Cb 0.14 -2.22 -0.04 0.00 1.34 0.00 0.00 72.50 71.72 3mqt s THR 350 CO 0.78 -0.15 0.14 -0.76 -0.54 0.00 0.00 174.62 174.09 3mqt s LEU 351 N -2.80 3.88 -1.28 4.79 1.43 0.27 -4.78 118.68 120.19 3mqt s LEU 351 Ca 0.23 -0.05 -0.05 0.00 -1.03 0.00 0.00 54.13 53.23 3mqt s LEU 351 Cb -0.08 -2.51 0.01 0.00 0.03 0.00 0.00 46.19 43.64 3mqt s LEU 351 CO 0.11 0.10 0.63 -3.20 0.23 0.00 0.00 176.35 174.23 3mqt n ASN 352 N -0.10 -5.51 -4.66 2.29 4.05 -1.26 -4.62 115.26 105.45 3mqt n ASN 352 Ca -0.08 -0.29 -0.46 0.00 0.45 0.00 0.00 54.58 54.19 3mqt n ASN 352 Cb 0.54 -4.29 -0.04 0.00 1.23 0.00 0.00 39.78 37.22 3mqt n ASN 352 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 3mqt n GLU 353 N -3.71 1.97 -1.63 1.20 -0.58 -1.26 -4.88 120.64 111.75 3mqt n GLU 353 Ca -0.07 0.71 -0.45 0.00 -0.42 0.00 0.00 57.16 56.92 3mqt n GLU 353 Cb 0.59 -2.43 -0.03 0.00 -0.57 0.00 0.00 31.44 29.01 3mqt n GLU 353 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 3mqt n PRO 354 N 2.90 1.67 -2.51 3.49 -0.02 -1.26 -4.95 135.00 134.33 3mqt n PRO 354 Ca 0.16 0.59 -0.33 0.00 -2.02 0.00 0.00 63.50 61.90 3mqt n PRO 354 Cb 0.28 -2.14 -0.04 0.00 -0.02 0.00 0.00 33.50 31.59 3mqt n PRO 354 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3mqt s LYS 355 N -0.83 3.91 -0.21 -0.52 2.47 -1.26 -4.96 119.74 118.35 3mqt s LYS 355 Ca 0.66 1.13 -0.29 0.00 -1.56 0.00 0.00 55.97 55.91 3mqt s LYS 355 Cb -0.70 -2.13 -0.00 0.00 -1.46 0.00 0.00 37.83 33.54 3mqt s LYS 355 CO 0.54 -0.31 1.15 0.42 0.16 0.00 0.00 175.35 177.32 3mqt s ILE 356 N -2.32 4.47 -0.25 5.43 1.01 -1.26 -4.50 121.20 123.76 3mqt s ILE 356 Ca 0.62 1.77 0.00 0.00 0.00 0.00 0.00 60.65 63.05 3mqt s ILE 356 Cb -0.12 -4.16 0.07 0.00 0.01 0.00 0.00 42.46 38.26 3mqt s ILE 356 CO 0.24 -0.18 -0.01 -0.63 0.00 0.00 0.00 174.94 174.36 3mqt s ILE 357 N 3.40 1.39 -1.43 2.92 1.01 -0.23 -4.74 121.20 123.52 3mqt s ILE 357 Ca 0.49 -1.30 -0.10 0.00 0.00 0.00 0.00 60.65 59.74 3mqt s ILE 357 Cb -0.18 -1.78 0.04 0.00 0.01 0.00 0.00 42.46 40.55 3mqt s ILE 357 CO 0.11 -0.26 1.07 -0.67 0.00 0.00 0.00 174.94 175.19 3mqt n ASP 358 N 4.70 -5.32 0.00 3.58 2.03 -1.03 -1.41 116.55 119.09 3mqt n ASP 358 Ca -0.08 -0.66 0.00 0.00 0.52 0.00 0.00 54.79 54.57 3mqt n ASP 358 Cb 0.44 -4.49 0.00 0.00 -0.72 0.00 0.00 41.12 36.35 3mqt n ASP 358 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3mqt n GLY 359 N -1.82 1.20 3.59 0.27 0.00 -0.20 -4.77 105.19 103.46 3mqt n GLY 359 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 3mqt n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mqt s ALA 360 N -3.72 3.01 -0.12 4.61 0.00 -0.50 -4.13 121.76 120.91 3mqt s ALA 360 Ca 0.00 -1.25 0.03 0.00 0.00 0.00 0.00 51.96 50.74 3mqt s ALA 360 Cb 0.00 -0.92 0.01 0.00 0.00 0.00 0.00 23.12 22.20 3mqt s ALA 360 CO 0.00 0.63 -0.21 0.96 0.00 0.00 0.00 175.76 177.14 3mqt s ILE 361 N -1.28 1.93 0.21 0.00 -5.25 -0.43 -1.06 121.20 115.31 3mqt s ILE 361 Ca 0.22 -0.92 -0.31 0.00 -0.99 0.00 0.00 60.65 58.65 3mqt s ILE 361 Cb -0.11 -1.70 -0.11 0.00 2.95 0.00 0.00 42.46 43.49 3mqt s ILE 361 CO 0.15 0.53 1.62 -1.61 -1.79 0.00 0.00 174.94 173.84 3mqt s GLU 362 N 0.65 4.17 -0.40 0.37 0.41 -1.26 -4.26 118.70 118.37 3mqt s GLU 362 Ca -0.12 2.49 -0.08 0.00 -0.41 0.00 0.00 54.97 56.85 3mqt s GLU 362 Cb -0.16 -3.10 0.08 0.00 -1.78 0.00 0.00 34.13 29.16 3mqt s GLU 362 CO 0.03 -0.65 0.23 0.08 -0.49 0.00 0.00 175.26 174.45 3mqt s VAL 363 N 0.90 4.00 0.77 2.63 1.01 -1.26 -4.92 120.40 123.54 3mqt s VAL 363 Ca 0.70 -1.46 -0.12 0.00 0.00 0.00 0.00 61.98 61.10 3mqt s VAL 363 Cb -0.47 -3.46 0.05 0.00 0.00 0.00 0.00 36.38 32.50 3mqt s VAL 363 CO 0.35 -0.48 1.12 -0.94 0.00 0.00 0.00 175.10 175.15 3mqt s SER 364 N 1.98 4.82 -0.08 3.32 1.04 -1.26 -4.95 113.70 118.57 3mqt s SER 364 Ca 0.03 1.06 0.06 0.00 0.48 0.00 0.00 55.95 57.58 3mqt s SER 364 Cb -0.23 -1.74 0.32 0.00 0.10 0.00 0.00 66.02 64.48 3mqt s SER 364 CO 0.01 -1.73 1.05 -0.90 0.98 0.00 0.00 173.24 172.65 3mqt n ASP 365 N -3.25 2.69 -4.63 7.02 3.85 -1.26 -4.90 116.55 116.08 3mqt n ASP 365 Ca 0.07 -2.31 -0.47 0.00 -0.71 0.00 0.00 54.79 51.37 3mqt n ASP 365 Cb 0.58 -0.51 -0.04 0.00 -1.35 0.00 0.00 41.12 39.81 3mqt n ASP 365 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.20 177.36 3mqt n LYS 366 N 0.28 1.67 -1.52 0.11 4.81 -1.26 -3.98 118.16 118.27 3mqt n LYS 366 Ca 0.11 0.60 -0.36 0.00 -0.87 0.00 0.00 58.31 57.79 3mqt n LYS 366 Cb 0.57 -2.23 0.08 0.00 0.02 0.00 0.00 35.03 33.46 3mqt n LYS 366 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 3mqt n PRO 367 N 2.34 0.75 0.00 1.64 -0.02 -1.26 -3.93 135.00 134.52 3mqt n PRO 367 Ca 0.15 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 3mqt n PRO 367 Cb 0.27 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 3mqt n PRO 367 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mqt n GLY 368 N 1.07 2.68 0.03 -1.23 0.00 0.12 -2.64 105.19 105.21 3mqt n GLY 368 Ca 0.14 -0.43 0.13 0.00 0.00 0.00 0.00 46.02 45.87 3mqt n GLY 368 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mqt n LEU 369 N 0.00 0.25 -2.08 0.99 4.77 -1.26 -0.11 117.00 119.56 3mqt n LEU 369 Ca 0.00 0.23 -0.11 0.00 -0.03 0.00 0.00 56.01 56.10 3mqt n LEU 369 Cb 0.00 -0.35 0.04 0.00 -2.33 0.00 0.00 43.42 40.79 3mqt n LEU 369 CO 0.00 0.06 0.10 0.61 -1.33 0.00 0.00 177.39 176.83 3mqt n GLY 370 N 1.44 0.16 3.72 -0.72 0.00 -1.08 -4.79 105.19 103.92 3mqt n GLY 370 Ca 0.09 -0.21 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 3mqt n GLY 370 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mqt s ILE 371 N -3.16 5.11 -0.68 -0.61 1.01 -1.26 -5.02 121.20 116.59 3mqt s ILE 371 Ca 0.20 1.22 -0.08 0.00 0.00 0.00 0.00 60.65 61.99 3mqt s ILE 371 Cb -0.09 -3.94 0.18 0.00 0.01 0.00 0.00 42.46 38.62 3mqt s ILE 371 CO 0.36 0.28 0.55 -0.70 0.00 0.00 0.00 174.94 175.43 3mqt s GLU 372 N 0.77 2.94 0.23 2.79 2.56 -1.26 -5.07 118.70 121.65 3mqt s GLU 372 Ca 0.32 -2.39 -0.30 0.00 0.00 0.00 0.00 54.97 52.60 3mqt s GLU 372 Cb -0.16 -4.02 -0.09 0.00 2.00 0.00 0.00 34.13 31.86 3mqt s GLU 372 CO 0.14 -1.22 1.07 -1.17 -0.56 0.00 0.00 175.26 173.52 3mqt s LEU 373 N 0.23 4.54 -1.19 2.70 2.96 -1.26 -0.56 118.68 126.09 3mqt s LEU 373 Ca 0.16 2.13 -0.19 0.00 -0.22 0.00 0.00 54.13 56.00 3mqt s LEU 373 Cb -0.17 -3.61 0.07 0.00 0.50 0.00 0.00 46.19 42.98 3mqt s LEU 373 CO -0.05 -0.12 1.60 0.21 -1.32 0.00 0.00 176.35 176.68 3mqt s ASN 374 N -0.61 6.75 0.21 3.68 3.84 -0.37 -4.80 114.94 123.64 3mqt s ASN 374 Ca 0.46 -2.18 -0.10 0.00 0.21 0.00 0.00 52.86 51.25 3mqt s ASN 374 Cb -0.30 -2.56 0.27 0.00 -0.55 0.00 0.00 41.25 38.12 3mqt s ASN 374 CO 0.37 -1.23 1.74 0.40 -2.79 0.00 0.00 177.10 175.59 3mqt h ILE 375 N 5.87 0.77 0.00 -5.21 1.08 -1.93 -1.95 117.51 116.15 3mqt h ILE 375 Ca 0.35 -0.14 -0.10 0.00 -0.39 0.00 0.00 64.86 64.58 3mqt h ILE 375 Cb 0.92 0.33 -0.01 0.00 -3.07 0.00 0.00 36.82 34.98 3mqt h ILE 375 CO 1.42 0.07 -0.47 -0.33 -0.69 0.00 0.00 178.15 178.15 3mqt h GLU 376 N 0.41 0.00 0.02 2.37 5.08 -1.99 -0.18 114.58 120.29 3mqt h GLU 376 Ca 0.30 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.66 3mqt h GLU 376 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 3mqt h GLU 376 CO -0.30 0.47 -0.01 0.35 -1.00 0.00 0.00 179.01 178.52 3mqt h PHE 377 N 0.00 -0.02 -0.22 4.33 3.57 -1.75 -0.82 116.94 122.04 3mqt h PHE 377 Ca -0.00 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.53 3mqt h PHE 377 Cb 0.86 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 3mqt h PHE 377 CO 0.00 0.20 0.00 0.28 -2.23 0.00 0.00 178.31 176.56 3mqt h VAL 378 N -0.24 0.85 -0.97 1.41 2.07 -1.17 -1.22 116.25 116.98 3mqt h VAL 378 Ca -0.00 -0.02 0.07 0.00 0.82 0.00 0.00 66.70 67.56 3mqt h VAL 378 Cb 0.23 0.77 -0.07 0.00 -1.52 0.00 0.00 31.29 30.70 3mqt h VAL 378 CO 0.00 0.01 0.62 -0.33 0.02 0.00 0.00 177.57 177.90 3mqt h GLU 379 N 0.07 1.10 -0.35 1.57 5.08 -1.01 0.48 114.58 121.51 3mqt h GLU 379 Ca 0.10 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.27 3mqt h GLU 379 Cb 0.13 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 3mqt h GLU 379 CO -0.17 0.72 -0.25 0.37 -1.00 0.00 0.00 179.01 178.68 3mqt h GLN 380 N 1.13 0.80 0.10 2.33 4.15 -0.86 -1.03 115.11 121.72 3mqt h GLN 380 Ca 0.42 -0.38 -0.26 0.00 0.77 0.00 0.00 58.65 59.20 3mqt h GLN 380 Cb 0.18 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.86 3mqt h GLN 380 CO -0.18 1.01 -1.16 -0.39 -1.93 0.00 0.00 178.83 176.18 3mqt h VAL 381 N 0.58 1.49 -0.09 2.39 -1.51 -0.87 -3.32 116.25 114.92 3mqt h VAL 381 Ca 0.07 -2.94 -0.12 0.00 -1.23 0.00 0.00 66.70 62.48 3mqt h VAL 381 Cb 0.82 2.83 0.01 0.00 -2.13 0.00 0.00 31.29 32.81 3mqt h VAL 381 CO 0.07 0.86 -0.42 0.71 -1.23 0.00 0.00 177.57 177.56 3mqt h THR 382 N 0.10 1.39 0.00 7.19 1.35 -1.00 -3.46 112.91 118.48 3mqt h THR 382 Ca -0.12 -1.77 0.00 0.00 -0.55 0.00 0.00 66.41 63.97 3mqt h THR 382 Cb 1.87 2.24 0.00 0.00 -1.73 0.00 0.00 68.15 70.53 3mqt h THR 382 CO 0.19 0.52 0.00 0.61 -0.25 0.00 0.00 175.52 176.60 3mqt n GLY 383 N 0.69 0.07 3.49 5.82 0.00 -0.39 -5.08 105.19 109.79 3mqt n GLY 383 Ca -0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 3mqt n GLY 383 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3mqt s HIS 384 N -2.00 2.56 0.42 1.61 -3.43 -1.24 -5.00 115.29 108.21 3mqt s HIS 384 Ca 0.00 -0.25 -0.25 0.00 -0.80 0.00 0.00 55.06 53.76 3mqt s HIS 384 Cb 0.00 -1.38 -0.08 0.00 -1.43 0.00 0.00 32.58 29.69 3mqt s HIS 384 CO 0.00 0.36 1.24 -1.59 -2.00 0.00 0.00 174.74 172.75 3mqt s LYS 385 N -2.00 3.92 0.00 -0.38 0.00 -1.26 -4.51 119.74 115.50 3mqt s LYS 385 Ca 0.18 1.99 0.27 0.00 0.00 0.00 0.00 55.97 58.40 3mqt s LYS 385 Cb -0.11 -2.65 0.82 0.00 0.00 0.00 0.00 37.83 35.89 3mqt s LYS 385 CO 0.09 -0.48 1.61 0.34 0.00 0.00 0.00 175.35 176.92