#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gtt n ILE 6 N 0.00 1.54 -2.81 0.58 -6.64 -1.26 -5.05 119.36 105.72 2gtt n ILE 6 Ca 0.00 -2.40 -0.20 0.00 -1.77 0.00 0.00 62.75 58.39 2gtt n ILE 6 Cb 0.00 0.07 0.03 0.00 -1.44 0.00 0.00 39.64 38.30 2gtt n ILE 6 CO 0.00 0.00 0.00 -0.69 -1.77 0.00 0.00 176.55 174.09 2gtt s VAL 7 N -2.28 2.88 -0.04 7.28 1.01 -1.26 -4.58 120.40 123.41 2gtt s VAL 7 Ca 0.34 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.54 2gtt s VAL 7 Cb 0.34 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.71 2gtt s VAL 7 CO -0.07 -0.02 -0.02 -0.36 0.00 0.00 0.00 175.10 174.63 2gtt s PHE 8 N -2.59 0.51 -0.38 5.22 0.40 -0.98 -4.99 117.98 115.16 2gtt s PHE 8 Ca 0.56 -0.09 -0.16 0.00 -0.60 0.00 0.00 56.93 56.64 2gtt s PHE 8 Cb -0.10 -0.53 0.00 0.00 0.51 0.00 0.00 43.02 42.90 2gtt s PHE 8 CO 0.36 -0.16 0.37 0.15 0.70 0.00 0.00 175.22 176.64 2gtt s LYS 9 N 1.02 3.31 0.00 0.44 3.01 -1.26 -3.06 119.74 123.20 2gtt s LYS 9 Ca -0.10 -0.63 0.00 0.00 -1.01 0.00 0.00 55.97 54.23 2gtt s LYS 9 Cb -0.14 -3.89 0.00 0.00 -1.01 0.00 0.00 37.83 32.80 2gtt s LYS 9 CO -0.01 -0.66 0.00 0.28 0.51 0.00 0.00 175.35 175.47 2gtt n VAL 10 N 5.29 0.00 0.00 3.17 0.31 0.71 -4.92 118.33 122.89 2gtt n VAL 10 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 2gtt n VAL 10 Cb 0.48 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.41 2gtt n VAL 10 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2gtt n ASN 11 N 0.00 0.00 -0.13 4.52 5.15 -1.26 -4.06 115.26 119.48 2gtt n ASN 11 Ca 0.00 0.00 -0.26 0.00 -0.60 0.00 0.00 54.58 53.72 2gtt n ASN 11 Cb 0.00 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.15 2gtt n ASN 11 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2gtt n ASN 12 N 0.00 1.94 0.00 1.20 4.13 -1.26 -4.93 115.26 116.34 2gtt n ASN 12 Ca 0.00 0.36 0.00 0.00 1.68 0.00 0.00 54.58 56.62 2gtt n ASN 12 Cb 0.00 -0.84 0.00 0.00 -1.54 0.00 0.00 39.78 37.40 2gtt n ASN 12 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2gtt n GLN 13 N -4.31 0.00 0.00 3.52 3.00 -1.26 -5.07 117.38 113.26 2gtt n GLN 13 Ca -0.47 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.52 2gtt n GLN 13 Cb 0.81 -0.25 0.00 0.00 0.00 0.00 0.00 30.24 30.80 2gtt n GLN 13 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.06 178.39 2gtt n VAL 14 N -2.31 0.00 -4.23 5.09 0.24 -1.26 -5.13 118.33 110.73 2gtt n VAL 14 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.17 2gtt n VAL 14 Cb 0.09 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.36 2gtt n VAL 14 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2gtt s VAL 15 N 1.79 0.89 -0.02 3.34 1.01 -1.26 -4.80 120.40 121.34 2gtt s VAL 15 Ca 0.00 -2.00 -0.25 0.00 0.00 0.00 0.00 61.98 59.73 2gtt s VAL 15 Cb 0.00 -1.90 0.06 0.00 0.00 0.00 0.00 36.38 34.54 2gtt s VAL 15 CO 0.00 -0.69 0.56 -0.44 0.00 0.00 0.00 175.10 174.53 2gtt s SER 16 N -3.14 -0.51 -0.02 3.32 0.01 -1.26 -4.82 113.70 107.29 2gtt s SER 16 Ca 0.18 0.46 -0.07 0.00 1.31 0.00 0.00 55.95 57.82 2gtt s SER 16 Cb 0.05 0.48 0.01 0.00 0.21 0.00 0.00 66.02 66.76 2gtt s SER 16 CO 0.00 -0.60 0.16 -1.48 0.41 0.00 0.00 173.24 171.73 2gtt s LEU 17 N -1.39 1.44 -0.19 2.44 0.05 -1.26 -0.21 118.68 119.56 2gtt s LEU 17 Ca -0.10 -0.01 -0.29 0.00 0.05 0.00 0.00 54.13 53.78 2gtt s LEU 17 Cb -0.01 0.68 0.13 0.00 -2.05 0.00 0.00 46.19 44.94 2gtt s LEU 17 CO 0.06 -0.27 1.03 -1.59 -0.55 0.00 0.00 176.35 175.03 2gtt s LYS 18 N -0.90 0.54 0.02 1.48 -2.85 -1.17 -5.00 119.74 111.86 2gtt s LYS 18 Ca -0.10 0.23 -0.05 0.00 -1.00 0.00 0.00 55.97 55.05 2gtt s LYS 18 Cb -0.05 0.26 -0.05 0.00 -2.06 0.00 0.00 37.83 35.93 2gtt s LYS 18 CO 0.01 -0.15 0.26 -1.25 0.10 0.00 0.00 175.35 174.32 2gtt s PRO 19 N -0.81 3.55 -0.70 1.78 0.04 -1.26 -2.33 135.00 135.27 2gtt s PRO 19 Ca -0.00 -0.13 -0.16 0.00 0.04 0.00 0.00 61.00 60.75 2gtt s PRO 19 Cb -0.01 -3.06 0.16 0.00 0.04 0.00 0.00 34.50 31.63 2gtt s PRO 19 CO -0.01 0.64 0.70 -1.21 0.04 0.00 0.00 177.00 177.16 2gtt s GLU 20 N -1.89 3.31 -0.11 4.56 8.01 -1.26 -4.98 118.70 126.34 2gtt s GLU 20 Ca 0.29 -1.96 -0.29 0.00 0.01 0.00 0.00 54.97 53.02 2gtt s GLU 20 Cb -0.13 -4.40 -0.06 0.00 -4.31 0.00 0.00 34.13 25.23 2gtt s GLU 20 CO 0.18 -1.39 2.00 0.96 0.01 0.00 0.00 175.26 177.02 2gtt s ILE 21 N 1.28 3.14 -0.07 -1.63 -4.36 -1.26 -4.96 121.20 113.35 2gtt s ILE 21 Ca 0.13 0.16 0.03 0.00 -0.26 0.00 0.00 60.65 60.71 2gtt s ILE 21 Cb -0.19 -3.14 -0.02 0.00 1.25 0.00 0.00 42.46 40.36 2gtt s ILE 21 CO -0.03 -0.06 -0.16 -0.63 0.24 0.00 0.00 174.94 174.31 2gtt s ILE 22 N 6.09 2.90 0.33 8.37 -1.09 -1.26 -5.12 121.20 131.42 2gtt s ILE 22 Ca 0.90 -0.76 -0.28 0.00 -2.23 0.00 0.00 60.65 58.27 2gtt s ILE 22 Cb -0.36 -2.15 -0.10 0.00 -1.58 0.00 0.00 42.46 38.28 2gtt s ILE 22 CO 0.37 0.57 1.19 0.54 -1.23 0.00 0.00 174.94 176.38 2gtt s VAL 23 N -0.38 3.12 0.00 2.92 0.11 -1.26 -5.02 120.40 119.89 2gtt s VAL 23 Ca 0.04 1.09 0.00 0.00 -2.93 0.00 0.00 61.98 60.17 2gtt s VAL 23 Cb -0.12 -3.67 0.00 0.00 -1.53 0.00 0.00 36.38 31.05 2gtt s VAL 23 CO 0.02 0.23 0.00 -0.90 -3.33 0.00 0.00 175.10 171.12 2gtt n ASP 24 N 0.79 0.00 -1.58 3.54 5.75 -1.26 -5.21 116.55 118.58 2gtt n ASP 24 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 54.79 54.75 2gtt n ASP 24 Cb 0.44 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.53 2gtt n ASP 24 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2gtt n GLN 25 N -0.65 0.28 0.00 0.11 -0.00 -1.26 -5.19 117.38 110.67 2gtt n GLN 25 Ca 0.00 -0.77 0.00 0.00 -0.00 0.00 0.00 57.00 56.23 2gtt n GLN 25 Cb 0.00 0.83 0.00 0.00 -0.00 0.00 0.00 30.24 31.07 2gtt n GLN 25 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 2gtt n HIS 26 N -0.17 0.00 -0.81 2.61 8.25 -1.26 -5.15 115.22 118.68 2gtt n HIS 26 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2gtt n HIS 26 Cb 0.18 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.29 2gtt n HIS 26 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 2gtt n GLU 27 N 0.00 -1.12 -3.15 -0.41 0.00 -1.26 -5.11 120.64 109.59 2gtt n GLU 27 Ca 0.00 1.19 0.04 0.00 0.00 0.00 0.00 57.16 58.39 2gtt n GLU 27 Cb 0.00 -0.85 -0.01 0.00 0.00 0.00 0.00 31.44 30.58 2gtt n GLU 27 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 2gtt s TYR 28 N -0.10 -1.62 0.25 4.31 1.51 -1.26 -4.98 117.35 115.46 2gtt s TYR 28 Ca 0.00 1.42 -0.13 0.00 -1.01 0.00 0.00 57.07 57.35 2gtt s TYR 28 Cb 0.00 0.46 -0.08 0.00 -0.11 0.00 0.00 41.96 42.23 2gtt s TYR 28 CO 0.00 -0.91 0.62 0.15 -1.11 0.00 0.00 175.55 174.31 2gtt s LYS 29 N 2.86 3.93 0.27 -0.62 -0.14 -1.26 -5.01 119.74 119.77 2gtt s LYS 29 Ca 0.16 0.48 0.07 0.00 -1.36 0.00 0.00 55.97 55.33 2gtt s LYS 29 Cb -0.13 -2.63 -0.03 0.00 -1.68 0.00 0.00 37.83 33.36 2gtt s LYS 29 CO -0.22 0.29 0.20 0.71 -0.76 0.00 0.00 175.35 175.57 2gtt s TYR 30 N -1.80 3.03 -2.00 3.18 1.51 -1.26 -4.65 117.35 115.35 2gtt s TYR 30 Ca 0.48 -0.16 0.12 0.00 -1.01 0.00 0.00 57.07 56.49 2gtt s TYR 30 Cb -0.12 -1.48 0.70 0.00 -0.11 0.00 0.00 41.96 40.95 2gtt s TYR 30 CO 0.20 0.45 1.13 -2.30 -1.11 0.00 0.00 175.55 173.91 2gtt n PRO 31 N -1.20 0.49 -1.44 -1.71 -0.02 -1.26 -4.63 135.00 125.23 2gtt n PRO 31 Ca -0.06 0.00 -0.59 0.00 -2.02 0.00 0.00 63.50 60.83 2gtt n PRO 31 Cb 0.58 -1.37 -0.10 0.00 -0.02 0.00 0.00 33.50 32.59 2gtt n PRO 31 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gtt n ALA 32 N -0.87 0.13 -2.59 3.55 0.00 -1.26 -4.86 120.51 114.60 2gtt n ALA 32 Ca 0.09 0.20 -0.43 0.00 0.00 0.00 0.00 53.44 53.30 2gtt n ALA 32 Cb 0.04 -2.19 -0.05 0.00 0.00 0.00 0.00 19.45 17.25 2gtt n ALA 32 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2gtt s ILE 33 N 5.53 4.65 0.00 0.00 1.01 -1.26 -4.97 121.20 126.16 2gtt s ILE 33 Ca 1.12 0.21 0.00 0.00 0.00 0.00 0.00 60.65 61.99 2gtt s ILE 33 Cb -1.29 -4.35 0.00 0.00 0.01 0.00 0.00 42.46 36.84 2gtt s ILE 33 CO 0.64 -0.80 0.75 1.17 0.00 0.00 0.00 174.94 176.71 2gtt n LYS 34 N 6.73 0.00 -2.71 2.79 0.00 -1.26 -4.82 118.16 118.89 2gtt n LYS 34 Ca 0.00 0.30 -0.07 0.00 0.00 0.00 0.00 58.31 58.54 2gtt n LYS 34 Cb 0.48 -1.25 0.09 0.00 0.00 0.00 0.00 35.03 34.34 2gtt n LYS 34 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2gtt n ASP 35 N -1.32 -2.00 -3.55 3.14 4.64 -1.26 -5.05 116.55 111.15 2gtt n ASP 35 Ca 0.00 -2.86 -0.09 0.00 -1.38 0.00 0.00 54.79 50.46 2gtt n ASP 35 Cb 0.00 1.54 -0.04 0.00 -1.04 0.00 0.00 41.12 41.58 2gtt n ASP 35 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 2gtt s LEU 36 N -1.39 -0.35 0.00 -2.67 1.43 -1.26 -5.19 118.68 109.25 2gtt s LEU 36 Ca 0.24 0.23 0.00 0.00 -1.03 0.00 0.00 54.13 53.57 2gtt s LEU 36 Cb 0.27 1.88 0.00 0.00 0.03 0.00 0.00 46.19 48.37 2gtt s LEU 36 CO -0.13 -0.43 0.00 0.29 0.23 0.00 0.00 176.35 176.31 2gtt n LYS 37 N 0.32 0.61 -3.23 1.70 5.02 -1.26 -4.97 118.16 116.34 2gtt n LYS 37 Ca -0.09 0.00 -0.45 0.00 -2.02 0.00 0.00 58.31 55.75 2gtt n LYS 37 Cb 0.59 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.56 2gtt n LYS 37 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2gtt s LYS 38 N -0.82 3.02 0.41 1.97 -0.14 -1.26 -4.97 119.74 117.95 2gtt s LYS 38 Ca 0.00 -1.56 -0.10 0.00 -1.36 0.00 0.00 55.97 52.96 2gtt s LYS 38 Cb 0.00 -4.29 -0.06 0.00 -1.68 0.00 0.00 37.83 31.80 2gtt s LYS 38 CO 0.00 -1.42 0.76 -1.25 -0.76 0.00 0.00 175.35 172.68 2gtt s PRO 39 N 2.04 3.75 -0.12 -1.68 0.05 -1.25 -2.30 135.00 135.49 2gtt s PRO 39 Ca 0.07 0.42 -0.08 0.00 0.05 0.00 0.00 61.00 61.46 2gtt s PRO 39 Cb -0.27 -2.40 0.04 0.00 0.05 0.00 0.00 34.50 31.92 2gtt s PRO 39 CO 0.04 -0.05 0.29 0.00 0.05 0.00 0.00 177.00 177.34 2gtt s ILE 41 N 0.72 4.82 -0.07 0.00 1.01 -1.26 -4.34 121.20 122.09 2gtt s ILE 41 Ca -0.05 -2.79 0.21 0.00 0.00 0.00 0.00 60.65 58.03 2gtt s ILE 41 Cb -0.06 -4.02 0.39 0.00 0.01 0.00 0.00 42.46 38.78 2gtt s ILE 41 CO -0.05 -0.98 1.15 1.07 0.00 0.00 0.00 174.94 176.13 2gtt n THR 42 N 3.63 0.25 -0.68 2.92 5.66 -1.26 -5.13 114.28 119.66 2gtt n THR 42 Ca 0.12 -1.25 -0.32 0.00 -3.05 0.00 0.00 64.05 59.55 2gtt n THR 42 Cb 0.43 1.00 0.17 0.00 -1.55 0.00 0.00 70.33 70.37 2gtt n THR 42 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 2gtt n LEU 43 N 0.13 -2.15 0.00 1.09 7.94 -1.26 -4.66 117.00 118.08 2gtt n LEU 43 Ca 0.01 -0.09 0.00 0.00 -1.11 0.00 0.00 56.01 54.82 2gtt n LEU 43 Cb 1.01 -0.97 0.00 0.00 0.53 0.00 0.00 43.42 43.99 2gtt n LEU 43 CO -0.04 -3.13 0.00 0.61 -1.11 0.00 0.00 177.39 173.73 2gtt n GLY 44 N 1.99 0.43 1.36 -3.96 0.00 -1.26 -4.87 105.19 98.88 2gtt n GLY 44 Ca 0.01 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.20 2gtt n GLY 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2gtt n LYS 45 N 0.00 -2.81 -3.65 1.61 5.02 -1.26 -3.09 118.16 113.97 2gtt n LYS 45 Ca 0.00 2.09 -0.07 0.00 -2.02 0.00 0.00 58.31 58.31 2gtt n LYS 45 Cb 0.00 -3.42 -0.08 0.00 -0.02 0.00 0.00 35.03 31.52 2gtt n LYS 45 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2gtt s ALA 46 N -3.20 -1.68 0.00 7.82 0.00 -1.26 -4.51 121.76 118.93 2gtt s ALA 46 Ca 0.00 2.17 0.00 0.00 0.00 0.00 0.00 51.96 54.13 2gtt s ALA 46 Cb 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 23.12 21.75 2gtt s ALA 46 CO 0.00 -0.46 0.00 -2.30 0.00 0.00 0.00 175.76 173.00 2gtt n PRO 47 N 4.53 1.31 -0.02 0.00 -0.02 -1.26 -5.06 135.00 134.48 2gtt n PRO 47 Ca -0.19 0.00 -0.03 0.00 -2.02 0.00 0.00 63.50 61.26 2gtt n PRO 47 Cb 0.56 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 34.03 2gtt n PRO 47 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2gtt n ASP 48 N 0.00 1.00 -0.88 2.55 -0.08 -1.26 -4.70 116.55 113.18 2gtt n ASP 48 Ca 0.00 0.16 0.00 0.00 -1.51 0.00 0.00 54.79 53.44 2gtt n ASP 48 Cb 0.00 -0.48 0.00 0.00 2.34 0.00 0.00 41.12 42.98 2gtt n ASP 48 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2gtt n LEU 49 N -3.48 1.51 0.19 -2.67 4.77 -1.26 -2.61 117.00 113.45 2gtt n LEU 49 Ca -0.05 -0.76 0.03 0.00 -0.03 0.00 0.00 56.01 55.21 2gtt n LEU 49 Cb 0.20 -0.30 0.38 0.00 -2.33 0.00 0.00 43.42 41.36 2gtt n LEU 49 CO 0.08 0.26 0.73 0.78 -1.33 0.00 0.00 177.39 177.91 2gtt h ASN 50 N 0.70 0.00 -0.82 -1.43 -0.26 -1.98 -0.96 115.58 110.83 2gtt h ASN 50 Ca 0.00 0.00 0.14 0.00 -0.56 0.00 0.00 56.30 55.88 2gtt h ASN 50 Cb 0.53 0.00 -0.14 0.00 -1.06 0.00 0.00 38.32 37.65 2gtt h ASN 50 CO 0.00 0.36 -0.35 0.50 -1.06 0.00 0.00 177.43 176.88 2gtt h LYS 51 N 0.00 -0.06 -0.39 0.81 3.11 -1.88 0.16 116.57 118.31 2gtt h LYS 51 Ca -0.00 0.00 0.05 0.00 -2.81 0.00 0.00 60.65 57.89 2gtt h LYS 51 Cb 0.68 0.01 -0.07 0.00 -1.00 0.00 0.00 32.23 31.85 2gtt h LYS 51 CO 0.05 -0.04 -0.49 0.00 -2.81 0.00 0.00 179.45 176.15 2gtt h ALA 52 N 1.28 -0.71 -0.10 5.00 0.00 -1.45 0.58 119.26 123.85 2gtt h ALA 52 Ca 0.31 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.23 2gtt h ALA 52 Cb 0.58 1.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.45 2gtt h ALA 52 CO -0.86 -0.96 -0.10 -0.92 0.00 0.00 0.00 179.25 176.41 2gtt h TYR 53 N -0.33 -0.32 -0.45 0.00 3.20 -0.71 -1.88 116.97 116.48 2gtt h TYR 53 Ca 0.07 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.93 2gtt h TYR 53 Cb 0.51 0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.91 2gtt h TYR 53 CO -0.73 -0.08 0.18 1.57 -1.64 0.00 0.00 178.16 177.46 2gtt h LYS 54 N -0.05 0.64 0.00 1.82 2.10 -1.19 -1.31 116.57 118.58 2gtt h LYS 54 Ca 0.02 -0.08 0.00 0.00 -2.00 0.00 0.00 60.65 58.58 2gtt h LYS 54 Cb 0.10 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 31.31 2gtt h LYS 54 CO -0.13 0.52 0.01 0.45 -2.00 0.00 0.00 179.45 178.31 2gtt n SER 55 N -4.37 0.00 -2.36 7.07 2.88 0.20 -0.15 113.62 116.89 2gtt n SER 55 Ca 0.03 0.12 -0.26 0.00 -1.33 0.00 0.00 58.87 57.44 2gtt n SER 55 Cb 0.15 -0.12 -0.02 0.00 -0.75 0.00 0.00 64.21 63.47 2gtt n SER 55 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2gtt n VAL 56 N -1.09 3.22 0.21 2.46 0.31 -0.49 -4.00 118.33 118.96 2gtt n VAL 56 Ca 0.00 -2.74 0.04 0.00 -0.01 0.00 0.00 64.34 61.63 2gtt n VAL 56 Cb 0.01 -1.47 0.46 0.00 -0.91 0.00 0.00 33.84 31.93 2gtt n VAL 56 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2gtt h LEU 57 N 3.37 0.01 -0.87 7.52 3.38 -0.81 -3.22 115.31 124.69 2gtt h LEU 57 Ca 0.39 -0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.48 2gtt h LEU 57 Cb 0.72 -0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.39 2gtt h LEU 57 CO 0.94 0.24 0.50 0.28 0.09 0.00 0.00 178.44 180.49 2gtt h SER 58 N 0.01 0.68 -3.04 -0.43 0.02 -1.86 -3.07 113.55 105.86 2gtt h SER 58 Ca -0.00 0.06 -0.66 0.00 -0.84 0.00 0.00 61.79 60.35 2gtt h SER 58 Cb 0.42 -0.06 -0.16 0.00 0.14 0.00 0.00 62.40 62.74 2gtt h SER 58 CO 0.03 0.35 0.29 -0.83 -1.14 0.00 0.00 176.83 175.53 2gtt s GLY 59 N -3.41 1.60 -0.67 -3.77 0.00 -1.21 -4.98 107.32 94.88 2gtt s GLY 59 Ca -0.12 -1.74 -0.23 0.00 0.00 0.00 0.00 44.72 42.62 2gtt s GLY 59 CO 0.79 1.76 1.79 1.15 0.00 0.00 0.00 173.10 178.58 2gtt n MET 60 N 6.84 0.06 0.00 2.90 0.00 -1.16 -4.74 117.12 121.02 2gtt n MET 60 Ca -0.05 -1.26 0.00 0.00 0.00 0.00 0.00 57.70 56.39 2gtt n MET 60 Cb 0.45 -3.14 0.00 0.00 0.00 0.00 0.00 33.22 30.54 2gtt n MET 60 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 2gtt n SER 61 N 15.03 0.00 -4.17 3.17 3.41 -1.26 -5.02 113.62 124.77 2gtt n SER 61 Ca 0.35 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.76 2gtt n SER 61 Cb 0.45 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.31 2gtt n SER 61 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gtt s ALA 62 N 0.00 2.17 0.00 7.33 0.00 -1.26 -4.89 121.76 125.11 2gtt s ALA 62 Ca 0.00 -1.73 0.00 0.00 0.00 0.00 0.00 51.96 50.23 2gtt s ALA 62 Cb 0.00 0.96 0.00 0.00 0.00 0.00 0.00 23.12 24.08 2gtt s ALA 62 CO 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 175.76 175.33 2gtt n ALA 63 N -0.64 0.00 -1.26 0.00 0.00 -1.26 -5.01 120.51 112.34 2gtt n ALA 63 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2gtt n ALA 63 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 2gtt n ALA 63 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2gtt n LYS 64 N 0.00 0.00 0.15 0.00 2.85 -1.26 -4.76 118.16 115.14 2gtt n LYS 64 Ca 0.00 -0.46 0.04 0.00 -1.05 0.00 0.00 58.31 56.83 2gtt n LYS 64 Cb 0.00 -0.42 0.05 0.00 -0.65 0.00 0.00 35.03 34.01 2gtt n LYS 64 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 177.40 177.28 2gtt h LEU 65 N 0.00 0.00 0.63 -5.58 4.07 -2.00 -3.28 115.31 109.14 2gtt h LEU 65 Ca 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.93 2gtt h LEU 65 Cb 1.04 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.77 2gtt h LEU 65 CO 0.00 0.45 -0.37 0.44 -1.08 0.00 0.00 178.44 177.88 2gtt h ASP 66 N 0.00 -0.91 -0.82 -0.43 5.19 -1.99 -1.63 116.42 115.82 2gtt h ASP 66 Ca -0.00 0.05 0.25 0.00 -0.62 0.00 0.00 57.03 56.71 2gtt h ASP 66 Cb 1.34 0.26 -0.15 0.00 0.18 0.00 0.00 39.33 40.95 2gtt h ASP 66 CO 0.06 -0.58 0.11 -2.65 -3.12 0.00 0.00 179.24 173.06 2gtt n PRO 67 N -5.51 -0.06 0.10 3.56 -0.02 -1.24 0.17 135.00 132.00 2gtt n PRO 67 Ca -0.13 1.21 -0.02 0.00 -2.02 0.00 0.00 63.50 62.54 2gtt n PRO 67 Cb 0.40 -1.98 0.21 0.00 -0.02 0.00 0.00 33.50 32.10 2gtt n PRO 67 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2gtt h ASP 68 N 0.00 0.21 0.14 2.55 1.82 -1.48 -1.15 116.42 118.51 2gtt h ASP 68 Ca 0.54 -0.10 -0.01 0.00 -0.39 0.00 0.00 57.03 57.08 2gtt h ASP 68 Cb 1.21 -0.06 0.00 0.00 0.68 0.00 0.00 39.33 41.16 2gtt h ASP 68 CO -0.74 0.66 -0.07 -0.78 -1.61 0.00 0.00 179.24 176.70 2gtt h ASP 69 N 0.16 -0.16 -0.13 2.28 3.58 0.25 -1.91 116.42 120.49 2gtt h ASP 69 Ca 0.01 -0.11 0.04 0.00 0.42 0.00 0.00 57.03 57.38 2gtt h ASP 69 Cb 0.90 0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.98 2gtt h ASP 69 CO 0.07 0.37 0.43 0.58 -2.88 0.00 0.00 179.24 177.81 2gtt h VAL 70 N -1.03 0.10 0.02 2.25 2.07 0.86 -0.19 116.25 120.35 2gtt h VAL 70 Ca -0.02 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 2gtt h VAL 70 Cb 0.26 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 2gtt h VAL 70 CO 0.03 0.00 -0.01 0.00 0.02 0.00 0.00 177.57 177.61 2gtt h SER 72 N -0.89 0.00 0.28 0.00 4.64 -0.21 0.70 113.55 118.07 2gtt h SER 72 Ca -0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2gtt h SER 72 Cb 0.03 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 2gtt h SER 72 CO 0.01 0.00 -0.08 0.22 -0.87 0.00 0.00 176.83 176.10 2gtt h TYR 73 N 0.00 0.00 -1.27 4.77 3.20 -1.50 -2.37 116.97 119.80 2gtt h TYR 73 Ca 0.54 0.00 0.38 0.00 3.14 0.00 0.00 58.73 62.79 2gtt h TYR 73 Cb 2.30 0.00 -0.10 0.00 1.54 0.00 0.00 36.73 40.47 2gtt h TYR 73 CO 0.00 0.08 0.85 -0.07 -1.64 0.00 0.00 178.16 177.38 2gtt h LEU 74 N 0.00 0.24 0.01 2.82 3.38 0.25 0.74 115.31 122.75 2gtt h LEU 74 Ca -0.00 0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 2gtt h LEU 74 Cb 0.25 0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.06 2gtt h LEU 74 CO 0.01 -0.05 -0.27 0.00 0.09 0.00 0.00 178.44 178.22 2gtt h ALA 75 N 1.52 0.02 0.00 1.53 0.00 -1.61 -3.23 119.26 117.49 2gtt h ALA 75 Ca 0.72 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2gtt h ALA 75 Cb 2.30 0.02 0.00 0.00 0.00 0.00 0.00 17.79 20.11 2gtt h ALA 75 CO -0.28 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.08 2gtt n ALA 76 N -2.56 1.32 0.00 0.00 0.00 0.26 -4.20 120.51 115.33 2gtt n ALA 76 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2gtt n ALA 76 Cb 0.53 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.98 2gtt n ALA 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gtt n ALA 77 N -0.13 0.00 -2.89 0.00 0.00 -1.18 -5.01 120.51 111.30 2gtt n ALA 77 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 2gtt n ALA 77 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2gtt n ALA 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gtt n MET 78 N 0.00 0.92 -3.59 0.00 0.00 -1.26 -4.61 117.12 108.59 2gtt n MET 78 Ca 0.00 -0.11 -0.07 0.00 0.00 0.00 0.00 57.70 57.52 2gtt n MET 78 Cb 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 33.22 33.19 2gtt n MET 78 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 175.97 174.83 2gtt s GLN 79 N -2.16 1.02 -0.56 3.17 2.00 -0.63 -4.97 119.66 117.54 2gtt s GLN 79 Ca 0.02 -0.46 -0.28 0.00 -2.00 0.00 0.00 55.36 52.65 2gtt s GLN 79 Cb -0.00 0.42 0.01 0.00 0.80 0.00 0.00 33.01 34.24 2gtt s GLN 79 CO 0.01 -0.46 1.40 -0.06 -0.50 0.00 0.00 175.29 175.69 2gtt s PHE 80 N -3.27 2.30 1.18 1.67 2.99 -1.26 -1.89 117.98 119.71 2gtt s PHE 80 Ca 0.07 0.47 -0.18 0.00 0.00 0.00 0.00 56.93 57.30 2gtt s PHE 80 Cb -0.01 -4.40 0.21 0.00 0.00 0.00 0.00 43.02 38.82 2gtt s PHE 80 CO -0.05 -1.96 0.42 0.34 -0.00 0.00 0.00 175.22 173.98 2gtt n PHE 81 N 9.49 -2.08 0.00 0.36 7.35 -1.26 -4.59 117.46 126.73 2gtt n PHE 81 Ca 0.12 -0.14 0.00 0.00 -0.76 0.00 0.00 57.45 56.67 2gtt n PHE 81 Cb 0.49 -1.50 0.00 0.00 0.35 0.00 0.00 39.48 38.82 2gtt n PHE 81 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 2gtt n GLU 82 N -3.26 0.00 0.00 -4.13 -0.58 -1.26 -4.72 120.64 106.69 2gtt n GLU 82 Ca 0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 2gtt n GLU 82 Cb 0.54 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.41 2gtt n GLU 82 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2gtt n GLY 83 N 5.00 0.45 3.42 0.62 0.00 -1.26 -4.84 105.19 108.58 2gtt n GLY 83 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 2gtt n GLY 83 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2gtt s THR 84 N -0.27 0.02 -0.45 2.61 -1.32 -1.26 -4.77 115.64 110.19 2gtt s THR 84 Ca 0.00 -0.13 0.07 0.00 -1.21 0.00 0.00 61.69 60.42 2gtt s THR 84 Cb 0.00 -0.81 0.40 0.00 -1.51 0.00 0.00 72.50 70.59 2gtt s THR 84 CO 0.00 -0.07 1.04 0.00 -2.21 0.00 0.00 174.62 173.38 2gtt s PRO 86 N -3.44 4.74 0.00 0.00 0.05 -1.26 -3.33 135.00 131.76 2gtt s PRO 86 Ca 0.46 1.48 0.00 0.00 0.05 0.00 0.00 61.00 62.99 2gtt s PRO 86 Cb 0.38 -3.11 0.00 0.00 0.05 0.00 0.00 34.50 31.81 2gtt s PRO 86 CO -0.15 0.40 0.00 0.39 0.05 0.00 0.00 177.00 177.69 2gtt n GLU 87 N 1.15 1.91 0.00 4.56 1.02 -1.26 -4.82 120.64 123.19 2gtt n GLU 87 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 2gtt n GLU 87 Cb 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.90 2gtt n GLU 87 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2gtt n ASP 88 N 0.00 0.00 0.00 1.62 9.92 -1.26 -4.40 116.55 122.43 2gtt n ASP 88 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2gtt n ASP 88 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 2gtt n ASP 88 CO 0.00 0.00 0.00 1.87 0.13 0.00 0.00 177.20 179.20 2gtt n TRP 89 N -0.83 0.00 -3.77 1.24 -0.00 -1.26 -4.56 117.44 108.26 2gtt n TRP 89 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.50 57.40 2gtt n TRP 89 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 31.31 31.27 2gtt n TRP 89 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 177.69 177.61 2gtt s THR 90 N 1.85 0.04 0.00 5.87 -1.32 -1.26 -4.88 115.64 115.94 2gtt s THR 90 Ca 0.00 -0.87 0.00 0.00 -1.21 0.00 0.00 61.69 59.61 2gtt s THR 90 Cb 0.00 -1.59 0.00 0.00 -1.51 0.00 0.00 72.50 69.40 2gtt s THR 90 CO 0.00 -0.16 0.00 -1.20 -2.21 0.00 0.00 174.62 171.05 2gtt n SER 91 N -0.31 0.00 -2.99 8.08 7.64 -1.21 -4.71 113.62 120.12 2gtt n SER 91 Ca -0.10 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.62 2gtt n SER 91 Cb 0.63 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.78 2gtt n SER 91 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2gtt n TYR 92 N 0.00 0.12 0.00 1.43 4.02 -1.26 -4.98 117.16 116.49 2gtt n TYR 92 Ca 0.00 -1.61 0.00 0.00 -0.01 0.00 0.00 57.90 56.28 2gtt n TYR 92 Cb 0.00 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.30 2gtt n TYR 92 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2gtt n GLY 93 N 0.46 0.00 2.86 2.72 0.00 -1.26 -3.25 105.19 106.72 2gtt n GLY 93 Ca -0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.83 2gtt n GLY 93 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2gtt s ILE 94 N -1.96 -0.09 0.09 -0.61 -4.36 -1.26 -4.58 121.20 108.42 2gtt s ILE 94 Ca 0.00 0.24 0.00 0.00 -0.26 0.00 0.00 60.65 60.63 2gtt s ILE 94 Cb 0.00 -0.21 0.00 0.00 1.25 0.00 0.00 42.46 43.50 2gtt s ILE 94 CO 0.00 0.10 0.00 0.52 0.24 0.00 0.00 174.94 175.80 2gtt n VAL 95 N 4.47-10.26 -3.74 8.37 0.31 -1.26 -4.87 118.33 111.36 2gtt n VAL 95 Ca -0.22 2.52 -0.10 0.00 -0.01 0.00 0.00 64.34 66.53 2gtt n VAL 95 Cb 0.51 -4.65 -0.06 0.00 -0.91 0.00 0.00 33.84 28.73 2gtt n VAL 95 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 2gtt s ILE 96 N -0.42 0.10 0.58 2.52 -5.25 -0.79 -4.88 121.20 113.07 2gtt s ILE 96 Ca 0.00 -0.86 0.10 0.00 -0.99 0.00 0.00 60.65 58.90 2gtt s ILE 96 Cb 0.00 -1.24 0.09 0.00 2.95 0.00 0.00 42.46 44.26 2gtt s ILE 96 CO 0.00 -0.47 0.78 0.00 -1.79 0.00 0.00 174.94 173.46 2gtt s ALA 97 N -3.82 4.72 0.00 2.27 0.00 -1.26 -1.61 121.76 122.06 2gtt s ALA 97 Ca 0.04 -2.12 -0.00 0.00 0.00 0.00 0.00 51.96 49.87 2gtt s ALA 97 Cb 0.03 -1.40 -0.02 0.00 0.00 0.00 0.00 23.12 21.73 2gtt s ALA 97 CO -0.11 -0.88 0.67 0.54 0.00 0.00 0.00 175.76 175.97 2gtt n ARG 98 N -2.24 0.20 -2.78 0.00 3.00 -1.22 -4.34 116.66 109.27 2gtt n ARG 98 Ca 0.15 -0.08 -0.32 0.00 -0.01 0.00 0.00 57.85 57.59 2gtt n ARG 98 Cb 0.62 -1.52 -0.02 0.00 0.00 0.00 0.00 32.46 31.54 2gtt n ARG 98 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2gtt n LYS 99 N 2.60 3.92 -0.64 5.56 4.76 -1.26 -4.62 118.16 128.48 2gtt n LYS 99 Ca 0.03 -4.74 0.08 0.00 -2.87 0.00 0.00 58.31 50.82 2gtt n LYS 99 Cb 0.10 -2.31 0.33 0.00 -1.84 0.00 0.00 35.03 31.30 2gtt n LYS 99 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2gtt n GLY 100 N -0.22 3.42 3.28 0.72 0.00 -1.26 -4.96 105.19 106.18 2gtt n GLY 100 Ca 0.37 -0.95 -0.19 0.00 0.00 0.00 0.00 46.02 45.26 2gtt n GLY 100 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gtt s ASP 101 N -1.31 1.59 -0.03 1.61 -0.00 -1.26 -4.47 116.67 112.79 2gtt s ASP 101 Ca 0.48 -1.74 -0.00 0.00 -0.00 0.00 0.00 52.55 51.29 2gtt s ASP 101 Cb 0.36 0.55 0.03 0.00 -0.00 0.00 0.00 42.92 43.86 2gtt s ASP 101 CO 0.14 -1.06 0.02 -0.75 -0.00 0.00 0.00 175.17 173.52 2gtt s LYS 102 N -3.47 0.20 0.00 8.23 2.20 -0.97 -4.94 119.74 120.98 2gtt s LYS 102 Ca 0.41 0.15 0.00 0.00 -0.36 0.00 0.00 55.97 56.16 2gtt s LYS 102 Cb 0.03 -0.48 0.00 0.00 -1.51 0.00 0.00 37.83 35.87 2gtt s LYS 102 CO 0.27 -0.18 0.00 -0.89 -0.36 0.00 0.00 175.35 174.18 2gtt n ILE 103 N 4.40 0.00 -0.71 5.43 -0.00 -1.26 -1.67 119.36 125.54 2gtt n ILE 103 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.53 2gtt n ILE 103 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 40.14 2gtt n ILE 103 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2gtt n GLY 118 N 5.00 4.70 0.00 7.39 0.00 -1.18 -4.68 105.19 116.42 2gtt n GLY 118 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.33 2gtt n GLY 118 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2gtt n ASN 119 N 0.00 0.00 -0.16 1.61 5.15 -1.26 -5.11 115.26 115.48 2gtt n ASN 119 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2gtt n ASN 119 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 2gtt n ASN 119 CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 2gtt n TRP 120 N 0.00 0.00 -1.69 1.20 7.02 -1.26 -4.94 117.44 117.78 2gtt n TRP 120 Ca 0.00 0.00 -0.07 0.00 -1.02 0.00 0.00 57.50 56.41 2gtt n TRP 120 Cb 0.00 0.00 0.05 0.00 -2.42 0.00 0.00 31.31 28.94 2gtt n TRP 120 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2gtt n ALA 121 N -0.00 -0.23 -3.29 6.99 0.00 -1.26 -4.93 120.51 117.77 2gtt n ALA 121 Ca 0.00 -0.51 -0.06 0.00 0.00 0.00 0.00 53.44 52.87 2gtt n ALA 121 Cb 0.00 0.02 -0.06 0.00 0.00 0.00 0.00 19.45 19.41 2gtt n ALA 121 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2gtt s LEU 122 N 0.00 -0.86 -0.18 0.00 1.02 -1.26 -4.19 118.68 113.21 2gtt s LEU 122 Ca 0.20 0.17 0.13 0.00 0.02 0.00 0.00 54.13 54.65 2gtt s LEU 122 Cb -0.01 1.34 0.70 0.00 0.02 0.00 0.00 46.19 48.24 2gtt s LEU 122 CO 0.14 -0.31 1.57 0.35 0.02 0.00 0.00 176.35 178.12 2gtt n THR 123 N 5.38 2.23 -0.30 5.49 -2.24 -1.26 -5.00 114.28 118.57 2gtt n THR 123 Ca -0.02 -1.18 0.00 0.00 -2.27 0.00 0.00 64.05 60.59 2gtt n THR 123 Cb 0.50 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 2gtt n THR 123 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gtt n GLY 124 N 0.65 -3.53 0.00 3.38 0.00 -1.26 -4.79 105.19 99.64 2gtt n GLY 124 Ca 0.24 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2gtt n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gtt n GLY 125 N -0.20 0.14 3.66 -0.02 0.00 -1.26 -3.87 105.19 103.64 2gtt n GLY 125 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2gtt n GLY 125 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2gtt s MET 126 N 0.00 4.24 0.00 1.61 0.00 -1.26 -4.91 119.30 118.98 2gtt s MET 126 Ca 0.00 1.12 0.15 0.00 0.00 0.00 0.00 55.69 56.96 2gtt s MET 126 Cb 0.00 -3.63 0.23 0.00 0.00 0.00 0.00 34.83 31.44 2gtt s MET 126 CO 0.00 -0.51 1.12 0.39 0.00 0.00 0.00 175.02 176.02 2gtt n GLU 127 N 5.93 1.76 -2.12 4.11 1.02 -1.26 -4.92 120.64 125.16 2gtt n GLU 127 Ca 0.08 -1.73 -0.42 0.00 -0.02 0.00 0.00 57.16 55.07 2gtt n GLU 127 Cb 0.47 -1.32 -0.03 0.00 -0.02 0.00 0.00 31.44 30.54 2gtt n GLU 127 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2gtt s LEU 128 N -1.18 3.46 -0.17 -4.62 2.96 -1.26 -4.84 118.68 113.02 2gtt s LEU 128 Ca 0.23 0.87 0.03 0.00 -0.22 0.00 0.00 54.13 55.04 2gtt s LEU 128 Cb 0.14 -3.22 0.31 0.00 0.50 0.00 0.00 46.19 43.92 2gtt s LEU 128 CO 0.20 -1.82 1.32 0.35 -1.32 0.00 0.00 176.35 175.08 2gtt n THR 129 N 7.25 1.78 -1.00 3.68 -2.24 -1.26 -4.90 114.28 117.59 2gtt n THR 129 Ca 0.20 -0.78 0.00 0.00 -2.27 0.00 0.00 64.05 61.19 2gtt n THR 129 Cb 0.49 -0.68 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 2gtt n THR 129 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2gtt n ARG 130 N -0.10 0.00 -4.05 -0.78 1.85 -1.26 -5.18 116.66 107.14 2gtt n ARG 130 Ca 0.23 0.00 -0.31 0.00 -1.00 0.00 0.00 57.85 56.77 2gtt n ARG 130 Cb 0.93 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 32.28 2gtt n ARG 130 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2gtt s ASP 131 N 1.91 5.58 0.04 2.89 1.11 -1.26 -5.07 116.67 121.88 2gtt s ASP 131 Ca 0.00 0.02 -0.08 0.00 0.18 0.00 0.00 52.55 52.67 2gtt s ASP 131 Cb 0.00 -1.52 -0.05 0.00 1.07 0.00 0.00 42.92 42.42 2gtt s ASP 131 CO 0.00 0.19 0.33 -2.16 1.18 0.00 0.00 175.17 174.70 2gtt s PRO 132 N -2.31 3.66 0.54 8.23 0.04 -1.26 -5.09 135.00 138.81 2gtt s PRO 132 Ca 0.29 0.03 -0.14 0.00 0.04 0.00 0.00 61.00 61.22 2gtt s PRO 132 Cb -0.12 -3.04 -0.07 0.00 0.04 0.00 0.00 34.50 31.32 2gtt s PRO 132 CO 0.21 0.60 0.98 -0.08 0.04 0.00 0.00 177.00 178.75 2gtt s THR 133 N -1.35 4.61 0.23 1.26 -1.32 -1.26 -4.94 115.64 112.87 2gtt s THR 133 Ca 0.30 1.05 -0.06 0.00 -1.21 0.00 0.00 61.69 61.77 2gtt s THR 133 Cb -0.13 -3.77 0.19 0.00 -1.51 0.00 0.00 72.50 67.27 2gtt s THR 133 CO 0.17 -0.82 1.82 0.58 -2.21 0.00 0.00 174.62 174.16 2gtt h VAL 134 N 0.55 0.96 0.00 5.08 2.07 -1.98 -0.58 116.25 122.34 2gtt h VAL 134 Ca -0.46 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 66.79 2gtt h VAL 134 Cb 1.19 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2gtt h VAL 134 CO 0.62 0.14 0.62 -0.65 0.02 0.00 0.00 177.57 178.32 2gtt h PRO 135 N 0.79 0.00 0.00 1.57 0.11 -1.94 1.11 132.00 133.63 2gtt h PRO 135 Ca 0.35 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.28 2gtt h PRO 135 Cb 0.25 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.33 2gtt h PRO 135 CO -0.21 0.00 -2.12 0.39 -0.21 0.00 0.00 178.00 175.86 2gtt n GLU 136 N -2.31 0.67 0.31 1.05 1.02 -0.25 -2.78 120.64 118.35 2gtt n GLU 136 Ca -0.01 -0.08 -0.12 0.00 -0.02 0.00 0.00 57.16 56.93 2gtt n GLU 136 Cb 0.63 -1.55 -0.06 0.00 -0.02 0.00 0.00 31.44 30.45 2gtt n GLU 136 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2gtt h HIS 137 N 0.00 -0.75 -0.99 -0.32 3.86 0.14 -3.07 115.15 114.01 2gtt h HIS 137 Ca -0.26 -0.02 0.06 0.00 -1.16 0.00 0.00 60.37 58.99 2gtt h HIS 137 Cb 1.61 0.25 -0.06 0.00 1.06 0.00 0.00 27.41 30.26 2gtt h HIS 137 CO 0.00 -0.47 0.64 0.00 0.86 0.00 0.00 177.93 178.97 2gtt h ALA 138 N -1.37 1.40 0.00 2.45 0.00 -1.34 0.14 119.26 120.54 2gtt h ALA 138 Ca -0.08 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2gtt h ALA 138 Cb 0.62 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2gtt h ALA 138 CO 0.14 0.47 0.14 1.03 0.00 0.00 0.00 179.25 181.02 2gtt h SER 139 N 1.19 0.00 0.00 0.00 0.87 -1.63 0.83 113.55 114.81 2gtt h SER 139 Ca 0.42 0.00 -0.41 0.00 -1.23 0.00 0.00 61.79 60.57 2gtt h SER 139 Cb 0.12 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.02 2gtt h SER 139 CO -0.16 0.00 -2.35 -0.11 -0.53 0.00 0.00 176.83 173.68 2gtt n LEU 140 N -2.50 1.96 -0.33 2.23 7.94 0.37 -3.62 117.00 123.05 2gtt n LEU 140 Ca -0.02 0.34 0.21 0.00 -1.11 0.00 0.00 56.01 55.44 2gtt n LEU 140 Cb 0.18 -0.81 0.43 0.00 0.53 0.00 0.00 43.42 43.75 2gtt n LEU 140 CO 0.12 0.47 1.07 0.58 -1.11 0.00 0.00 177.39 178.51 2gtt h VAL 141 N -1.00 0.28 0.41 1.96 2.07 -0.74 0.47 116.25 119.70 2gtt h VAL 141 Ca -0.62 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 66.79 2gtt h VAL 141 Cb 1.54 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 2gtt h VAL 141 CO -0.37 0.05 -0.19 1.23 0.02 0.00 0.00 177.57 178.30 2gtt h GLY 142 N 0.28 -0.57 0.57 2.17 0.00 -1.05 -0.25 103.07 104.23 2gtt h GLY 142 Ca 0.69 0.21 0.16 0.00 0.00 0.00 0.00 47.33 48.40 2gtt h GLY 142 CO -0.63 -0.21 0.53 1.41 0.00 0.00 0.00 176.54 177.65 2gtt h LEU 143 N -0.71 0.42 0.04 3.11 3.38 -0.33 0.10 115.31 121.32 2gtt h LEU 143 Ca -0.06 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2gtt h LEU 143 Cb 0.50 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2gtt h LEU 143 CO 0.09 0.20 -0.02 -0.07 0.09 0.00 0.00 178.44 178.74 2gtt h LEU 144 N 0.44 -0.05 -1.16 1.67 3.38 -0.34 -3.27 115.31 115.98 2gtt h LEU 144 Ca 0.40 -0.64 0.10 0.00 0.09 0.00 0.00 57.88 57.83 2gtt h LEU 144 Cb 0.92 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.62 2gtt h LEU 144 CO -0.14 0.67 0.59 -0.07 0.09 0.00 0.00 178.44 179.58 2gtt h LEU 145 N -0.82 0.84 0.00 1.67 3.38 -0.57 0.29 115.31 120.10 2gtt h LEU 145 Ca -0.01 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2gtt h LEU 145 Cb 0.68 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2gtt h LEU 145 CO 0.01 0.49 0.00 -1.54 0.09 0.00 0.00 178.44 177.49 2gtt n SER 146 N -4.54 0.00 0.00 -0.43 3.41 0.31 -0.18 113.62 112.20 2gtt n SER 146 Ca 0.16 0.28 -0.17 0.00 -0.26 0.00 0.00 58.87 58.88 2gtt n SER 146 Cb 0.30 -0.31 -0.06 0.00 -0.26 0.00 0.00 64.21 63.88 2gtt n SER 146 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2gtt h LEU 147 N 0.00 0.86 -0.32 1.04 3.38 -0.47 -3.19 115.31 116.61 2gtt h LEU 147 Ca 0.00 -0.59 0.06 0.00 0.09 0.00 0.00 57.88 57.44 2gtt h LEU 147 Cb 0.03 -0.26 -0.08 0.00 0.09 0.00 0.00 40.66 40.44 2gtt h LEU 147 CO 0.00 1.38 -0.44 0.22 0.09 0.00 0.00 178.44 179.69 2gtt h TYR 148 N 0.47 -1.29 0.45 1.13 3.20 -0.69 0.38 116.97 120.61 2gtt h TYR 148 Ca -0.06 0.06 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 2gtt h TYR 148 Cb 1.45 0.61 -0.02 0.00 1.54 0.00 0.00 36.73 40.30 2gtt h TYR 148 CO 0.08 -0.46 -0.50 -0.09 -1.64 0.00 0.00 178.16 175.55 2gtt h ARG 149 N -0.39 -0.92 -0.99 1.82 2.43 -1.67 -2.39 114.38 112.27 2gtt h ARG 149 Ca 0.11 0.06 0.36 0.00 -0.81 0.00 0.00 59.98 59.71 2gtt h ARG 149 Cb 0.60 0.21 -0.17 0.00 -0.42 0.00 0.00 29.97 30.19 2gtt h ARG 149 CO -0.53 -0.61 0.47 -0.07 -1.51 0.00 0.00 179.97 177.72 2gtt h LEU 150 N -0.96 0.27 -0.16 3.80 3.38 -1.25 0.58 115.31 120.97 2gtt h LEU 150 Ca -0.06 0.24 0.05 0.00 0.09 0.00 0.00 57.88 58.20 2gtt h LEU 150 Cb 0.84 0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.80 2gtt h LEU 150 CO -0.09 -0.32 -0.15 -1.28 0.09 0.00 0.00 178.44 176.69 2gtt h SER 151 N 0.11 -0.47 -0.01 -0.43 0.87 -0.43 -2.85 113.55 110.34 2gtt h SER 151 Ca 0.77 0.09 -0.04 0.00 -1.23 0.00 0.00 61.79 61.38 2gtt h SER 151 Cb 1.89 0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 64.07 2gtt h SER 151 CO -0.73 -0.19 -0.08 0.11 -0.53 0.00 0.00 176.83 175.41 2gtt h LYS 152 N -0.17 0.23 -5.93 2.24 1.57 -0.83 -3.39 116.57 110.29 2gtt h LYS 152 Ca 0.10 -0.04 -0.51 0.00 -1.87 0.00 0.00 60.65 58.33 2gtt h LYS 152 Cb 0.32 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 2gtt h LYS 152 CO -0.26 0.33 1.43 0.42 -0.57 0.00 0.00 179.45 180.79 2gtt s ILE 153 N -4.82 3.26 -0.21 1.86 1.09 -1.08 -4.86 121.20 116.43 2gtt s ILE 153 Ca -0.06 0.19 -0.27 0.00 -1.10 0.00 0.00 60.65 59.41 2gtt s ILE 153 Cb 0.16 -3.57 0.11 0.00 -1.06 0.00 0.00 42.46 38.10 2gtt s ILE 153 CO 0.72 -0.51 0.94 -0.94 -0.10 0.00 0.00 174.94 175.05 2gtt s SER 154 N 8.90 -0.49 0.00 3.58 1.04 -1.26 -5.00 113.70 120.48 2gtt s SER 154 Ca 0.80 0.78 0.00 0.00 0.48 0.00 0.00 55.95 58.01 2gtt s SER 154 Cb -0.17 0.73 0.00 0.00 0.10 0.00 0.00 66.02 66.68 2gtt s SER 154 CO 0.25 -0.28 0.00 0.61 0.98 0.00 0.00 173.24 174.81 2gtt n GLY 155 N 1.65 -0.51 0.00 7.32 0.00 -1.26 -5.00 105.19 107.39 2gtt n GLY 155 Ca -0.13 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.59 2gtt n GLY 155 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2gtt n GLN 156 N 0.00 0.00 0.00 1.61 7.27 -1.26 -4.59 117.38 120.42 2gtt n GLN 156 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 2gtt n GLN 156 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 2gtt n GLN 156 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2gtt n ASN 157 N 0.00 0.00 -0.34 1.69 3.02 -1.26 -2.99 115.26 115.39 2gtt n ASN 157 Ca 0.00 0.00 0.36 0.00 -0.03 0.00 0.00 54.58 54.91 2gtt n ASN 157 Cb 0.00 0.00 0.71 0.00 -0.61 0.00 0.00 39.78 39.88 2gtt n ASN 157 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2gtt h THR 158 N 0.00 0.24 0.00 3.41 1.03 -1.95 -3.31 112.91 112.33 2gtt h THR 158 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.40 2gtt h THR 158 Cb 0.00 0.28 0.00 0.00 -1.07 0.00 0.00 68.15 67.36 2gtt h THR 158 CO 0.00 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 176.12 2gtt n GLY 159 N -1.76 -2.79 0.33 2.99 0.00 -1.16 -1.82 105.19 100.98 2gtt n GLY 159 Ca 0.27 0.56 -0.11 0.00 0.00 0.00 0.00 46.02 46.74 2gtt n GLY 159 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2gtt h ASN 160 N 0.00 -0.97 -1.00 1.61 2.35 -1.93 -1.32 115.58 114.33 2gtt h ASN 160 Ca 0.00 0.14 0.27 0.00 -0.55 0.00 0.00 56.30 56.16 2gtt h ASN 160 Cb 0.00 0.41 -0.13 0.00 0.05 0.00 0.00 38.32 38.65 2gtt h ASN 160 CO 0.00 -0.35 0.58 0.22 -1.65 0.00 0.00 177.43 176.22 2gtt h TYR 161 N -0.39 0.97 0.36 1.19 3.20 -1.77 -1.23 116.97 119.31 2gtt h TYR 161 Ca 0.09 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.98 2gtt h TYR 161 Cb 0.54 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 38.54 2gtt h TYR 161 CO -0.39 -0.01 -0.17 -0.22 -1.64 0.00 0.00 178.16 175.72 2gtt h LYS 162 N 0.50 -0.47 -1.83 1.82 3.64 -0.47 -2.27 116.57 117.50 2gtt h LYS 162 Ca 0.67 0.03 0.53 0.00 -1.27 0.00 0.00 60.65 60.61 2gtt h LYS 162 Cb 1.34 0.11 -0.08 0.00 -0.41 0.00 0.00 32.23 33.19 2gtt h LYS 162 CO -0.52 -0.31 1.31 1.79 -2.27 0.00 0.00 179.45 179.45 2gtt h THR 163 N -0.53 0.08 0.01 1.00 1.35 -0.85 0.10 112.91 114.07 2gtt h THR 163 Ca -0.05 -0.00 -0.10 0.00 -0.55 0.00 0.00 66.41 65.71 2gtt h THR 163 Cb 0.37 0.07 0.01 0.00 -1.73 0.00 0.00 68.15 66.88 2gtt h THR 163 CO 0.08 0.00 -0.41 0.78 -0.25 0.00 0.00 175.52 175.73 2gtt h ASN 164 N 0.00 0.34 0.45 5.36 4.21 -0.84 -2.13 115.58 122.97 2gtt h ASN 164 Ca 0.88 -0.80 -0.06 0.00 1.21 0.00 0.00 56.30 57.53 2gtt h ASN 164 Cb 3.49 -0.10 -0.01 0.00 -1.12 0.00 0.00 38.32 40.58 2gtt h ASN 164 CO -0.03 1.09 -0.30 0.16 -1.29 0.00 0.00 177.43 177.06 2gtt h ILE 165 N -0.38 1.02 0.06 2.81 3.07 -0.43 -0.40 117.51 123.26 2gtt h ILE 165 Ca -0.05 -1.12 -0.00 0.00 1.55 0.00 0.00 64.86 65.24 2gtt h ILE 165 Cb 1.17 1.64 0.00 0.00 -0.27 0.00 0.00 36.82 39.35 2gtt h ILE 165 CO 0.08 0.30 -0.03 0.00 -1.05 0.00 0.00 178.15 177.44 2gtt h ALA 166 N 1.70 -0.97 -0.90 0.16 0.00 -1.44 0.25 119.26 118.04 2gtt h ALA 166 Ca -0.00 -0.02 0.37 0.00 0.00 0.00 0.00 54.91 55.26 2gtt h ALA 166 Cb 0.61 0.09 -0.15 0.00 0.00 0.00 0.00 17.79 18.33 2gtt h ALA 166 CO 0.04 -0.97 0.50 -0.25 0.00 0.00 0.00 179.25 178.57 2gtt n ASP 167 N -2.30 0.30 0.20 0.00 9.92 -0.80 -0.44 116.55 123.43 2gtt n ASP 167 Ca -0.01 1.44 -0.09 0.00 -0.53 0.00 0.00 54.79 55.60 2gtt n ASP 167 Cb 0.04 -0.70 -0.04 0.00 -0.64 0.00 0.00 41.12 39.77 2gtt n ASP 167 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 2gtt h ARG 168 N 0.00 -0.55 -0.00 -1.24 3.08 -0.87 -2.97 114.38 111.82 2gtt h ARG 168 Ca 0.75 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.84 2gtt h ARG 168 Cb 2.01 0.13 -0.00 0.00 0.08 0.00 0.00 29.97 32.19 2gtt h ARG 168 CO -0.65 -0.37 0.01 -0.84 -1.07 0.00 0.00 179.97 177.05 2gtt h ILE 169 N -1.06 0.16 0.42 2.04 3.07 0.16 -2.41 117.51 119.89 2gtt h ILE 169 Ca -0.06 0.00 -0.02 0.00 1.55 0.00 0.00 64.86 66.33 2gtt h ILE 169 Cb 0.44 0.99 0.00 0.00 -0.27 0.00 0.00 36.82 37.98 2gtt h ILE 169 CO 0.10 0.00 -0.20 -0.08 -1.05 0.00 0.00 178.15 176.92 2gtt h GLU 170 N 0.00 -0.54 -0.63 0.16 4.81 -0.78 -3.22 114.58 114.37 2gtt h GLU 170 Ca 0.00 0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.33 2gtt h GLU 170 Cb 0.03 0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 2gtt h GLU 170 CO -0.00 -0.24 0.42 1.96 -0.73 0.00 0.00 179.01 180.42 2gtt h GLN 171 N -0.97 0.59 0.00 1.92 4.20 -1.27 -1.95 115.11 117.63 2gtt h GLN 171 Ca -0.06 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.62 2gtt h GLN 171 Cb 0.56 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.20 2gtt h GLN 171 CO 0.09 0.39 0.00 0.44 -0.67 0.00 0.00 178.83 179.09 2gtt n ILE 172 N -4.48 0.19 -2.31 2.54 -5.35 -1.12 -3.18 119.36 105.65 2gtt n ILE 172 Ca 0.09 0.05 -0.32 0.00 -0.27 0.00 0.00 62.75 62.30 2gtt n ILE 172 Cb 0.25 -0.60 0.01 0.00 -1.74 0.00 0.00 39.64 37.56 2gtt n ILE 172 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2gtt n PHE 173 N -1.45 3.27 -1.46 4.28 0.99 -0.73 -4.38 117.46 117.98 2gtt n PHE 173 Ca 0.08 -2.86 -0.01 0.00 -0.00 0.00 0.00 57.45 54.66 2gtt n PHE 173 Cb 0.28 -0.55 -0.01 0.00 -1.00 0.00 0.00 39.48 38.20 2gtt n PHE 173 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.76 175.91 2gtt n GLU 174 N -0.47 0.00 0.00 -1.08 0.28 -1.19 -4.30 120.64 113.88 2gtt n GLU 174 Ca 0.44 -0.14 0.00 0.00 -0.16 0.00 0.00 57.16 57.31 2gtt n GLU 174 Cb 0.47 0.22 0.00 0.00 1.43 0.00 0.00 31.44 33.57 2gtt n GLU 174 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 2gtt n THR 175 N 0.00 0.00 -0.07 3.84 5.66 -1.21 -4.24 114.28 118.26 2gtt n THR 175 Ca -0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.96 2gtt n THR 175 Cb 0.26 -0.07 0.00 0.00 -1.55 0.00 0.00 70.33 68.97 2gtt n THR 175 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2gtt n ALA 176 N -2.44 0.00 0.14 1.79 0.00 -1.26 -4.54 120.51 114.20 2gtt n ALA 176 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2gtt n ALA 176 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2gtt n ALA 176 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2gtt n PRO 177 N -0.69 0.01 -1.48 0.00 -0.01 -1.26 -4.56 135.00 127.02 2gtt n PRO 177 Ca 0.00 0.40 -0.31 0.00 -0.01 0.00 0.00 63.50 63.57 2gtt n PRO 177 Cb 0.00 -2.20 0.07 0.00 -0.01 0.00 0.00 33.50 31.35 2gtt n PRO 177 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 175.50 175.43 2gtt s PHE 178 N -2.80 2.79 -0.09 6.00 0.40 -1.26 -4.79 117.98 118.22 2gtt s PHE 178 Ca 0.00 1.51 0.03 0.00 -0.60 0.00 0.00 56.93 57.87 2gtt s PHE 178 Cb 0.00 -3.00 0.01 0.00 0.51 0.00 0.00 43.02 40.53 2gtt s PHE 178 CO 0.00 -1.55 -0.19 0.08 0.70 0.00 0.00 175.22 174.26 2gtt s VAL 179 N -2.85 1.70 -0.11 -0.44 1.01 -1.12 -3.31 120.40 115.28 2gtt s VAL 179 Ca 0.61 -0.80 -0.30 0.00 0.00 0.00 0.00 61.98 61.49 2gtt s VAL 179 Cb -0.16 -1.50 -0.08 0.00 0.00 0.00 0.00 36.38 34.64 2gtt s VAL 179 CO 0.53 0.48 2.10 1.17 0.00 0.00 0.00 175.10 179.37 2gtt n LYS 180 N 3.75 2.30 -0.00 2.72 4.81 -1.26 -4.55 118.16 125.93 2gtt n LYS 180 Ca -0.20 0.75 0.03 0.00 -0.87 0.00 0.00 58.31 58.02 2gtt n LYS 180 Cb 0.52 -3.06 -0.05 0.00 0.02 0.00 0.00 35.03 32.47 2gtt n LYS 180 CO 0.00 0.00 0.00 0.44 1.17 0.00 0.00 177.40 179.01 2gtt n ILE 181 N 6.62 0.00 -4.38 3.15 -5.35 -1.26 -5.06 119.36 113.08 2gtt n ILE 181 Ca 0.26 -0.24 -0.21 0.00 -0.27 0.00 0.00 62.75 62.30 2gtt n ILE 181 Cb 0.41 0.63 -0.09 0.00 -1.74 0.00 0.00 39.64 38.85 2gtt n ILE 181 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 2gtt s VAL 182 N -2.10 0.36 -0.29 7.28 -7.23 -1.26 -5.07 120.40 112.09 2gtt s VAL 182 Ca -0.00 -2.00 -0.14 0.00 -1.81 0.00 0.00 61.98 58.02 2gtt s VAL 182 Cb 0.05 -2.47 -0.03 0.00 0.56 0.00 0.00 36.38 34.48 2gtt s VAL 182 CO 0.27 0.00 0.34 -1.61 -0.31 0.00 0.00 175.10 173.79 2gtt s GLU 183 N -3.73 3.87 0.00 4.82 2.02 -1.26 -5.03 118.70 119.39 2gtt s GLU 183 Ca 0.33 -0.15 0.00 0.00 0.02 0.00 0.00 54.97 55.17 2gtt s GLU 183 Cb 0.04 -3.70 0.00 0.00 0.10 0.00 0.00 34.13 30.57 2gtt s GLU 183 CO 0.18 -0.34 0.00 0.72 0.02 0.00 0.00 175.26 175.85 2gtt n HIS 184 N 5.31 0.00 0.00 1.61 8.25 -1.26 -2.82 115.22 126.31 2gtt n HIS 184 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 2gtt n HIS 184 Cb 0.51 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.62 2gtt n HIS 184 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2gtt n HIS 185 N 0.00 0.00 -1.45 4.41 8.25 -1.26 -2.79 115.22 122.38 2gtt n HIS 185 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2gtt n HIS 185 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2gtt n HIS 185 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2gtt n THR 189 N 0.00 0.00 -0.39 1.59 -1.04 -1.24 -5.01 114.28 108.19 2gtt n THR 189 Ca 0.00 0.00 0.38 0.00 -2.04 0.00 0.00 64.05 62.39 2gtt n THR 189 Cb 0.00 0.00 0.75 0.00 -1.82 0.00 0.00 70.33 69.26 2gtt n THR 189 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2gtt h THR 190 N 2.52 0.29 0.02 12.58 1.03 -1.35 4.06 112.91 132.06 2gtt h THR 190 Ca 0.00 0.00 -0.23 0.00 -0.01 0.00 0.00 66.41 66.17 2gtt h THR 190 Cb 0.65 0.31 -0.03 0.00 -1.07 0.00 0.00 68.15 68.01 2gtt h THR 190 CO 0.00 0.00 -1.26 -0.74 -0.01 0.00 0.00 175.52 173.51 2gtt h HIS 191 N 0.00 0.08 -0.13 0.00 2.76 -1.78 -3.34 115.15 112.73 2gtt h HIS 191 Ca 0.63 -0.06 0.04 0.00 -2.20 0.00 0.00 60.37 58.78 2gtt h HIS 191 Cb 2.59 -0.00 -0.01 0.00 1.55 0.00 0.00 27.41 31.55 2gtt h HIS 191 CO 0.00 1.50 0.10 -0.22 -1.30 0.00 0.00 177.93 178.00 2gtt h LYS 192 N -0.84 0.00 0.00 5.26 1.63 -0.93 -2.39 116.57 119.30 2gtt h LYS 192 Ca -0.33 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.47 2gtt h LYS 192 Cb 1.39 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.02 2gtt h LYS 192 CO -0.15 0.00 0.00 -1.33 -3.45 0.00 0.00 179.45 174.52 2gtt n MET 193 N -4.41 0.02 -1.38 1.90 2.81 1.31 -3.10 117.12 114.27 2gtt n MET 193 Ca 0.00 0.37 -0.29 0.00 -1.81 0.00 0.00 57.70 55.97 2gtt n MET 193 Cb 0.22 -1.50 -0.07 0.00 -0.71 0.00 0.00 33.22 31.16 2gtt n MET 193 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2gtt n ALA 195 N 2.41 2.53 -2.83 0.00 0.00 -1.18 -3.74 120.51 117.70 2gtt n ALA 195 Ca 0.60 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.81 2gtt n ALA 195 Cb 0.50 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.93 2gtt n ALA 195 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2gtt n ASN 196 N 0.55 3.47 -3.67 0.00 4.13 -1.26 -5.10 115.26 113.38 2gtt n ASN 196 Ca 0.00 -3.45 -0.09 0.00 1.68 0.00 0.00 54.58 52.73 2gtt n ASN 196 Cb 0.49 -0.54 -0.02 0.00 -1.54 0.00 0.00 39.78 38.16 2gtt n ASN 196 CO 0.00 0.00 0.00 0.86 0.28 0.00 0.00 177.26 178.40 2gtt s TRP 197 N -3.25 -0.33 0.19 3.10 -0.11 -1.25 -4.95 118.94 112.35 2gtt s TRP 197 Ca 0.44 -0.01 -0.06 0.00 1.22 0.00 0.00 56.10 57.69 2gtt s TRP 197 Cb 0.35 0.64 0.03 0.00 -1.50 0.00 0.00 33.47 32.98 2gtt s TRP 197 CO -0.12 -1.02 0.37 0.43 -4.62 0.00 0.00 176.95 171.99 2gtt n SER 198 N -0.42 -1.06 -4.67 5.86 7.64 -1.26 -4.85 113.62 114.86 2gtt n SER 198 Ca -0.09 -1.81 -0.37 0.00 1.01 0.00 0.00 58.87 57.61 2gtt n SER 198 Cb 0.62 1.79 -0.09 0.00 -1.01 0.00 0.00 64.21 65.52 2gtt n SER 198 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2gtt s THR 199 N -2.57 5.30 -0.11 0.44 2.01 -1.26 -5.00 115.64 114.45 2gtt s THR 199 Ca 0.09 0.38 -0.07 0.00 0.31 0.00 0.00 61.69 62.40 2gtt s THR 199 Cb -0.02 -3.59 0.04 0.00 0.01 0.00 0.00 72.50 68.94 2gtt s THR 199 CO 0.07 0.31 0.27 0.27 -0.69 0.00 0.00 174.62 174.85 2gtt s ILE 200 N 1.12 -0.03 0.00 1.82 -4.36 -1.26 -5.08 121.20 113.41 2gtt s ILE 200 Ca 0.12 0.10 0.00 0.00 -0.26 0.00 0.00 60.65 60.61 2gtt s ILE 200 Cb -0.14 -0.41 0.00 0.00 1.25 0.00 0.00 42.46 43.16 2gtt s ILE 200 CO 0.06 0.04 0.00 -2.65 0.24 0.00 0.00 174.94 172.63 2gtt n PRO 201 N 3.92 0.00 -0.36 0.37 -0.02 -1.26 -1.47 135.00 136.18 2gtt n PRO 201 Ca -0.22 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.26 2gtt n PRO 201 Cb 0.55 0.00 0.14 0.00 -0.02 0.00 0.00 33.50 34.17 2gtt n PRO 201 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 2gtt h ASN 202 N 0.00 1.09 -0.24 2.55 2.35 -1.98 0.20 115.58 119.55 2gtt h ASN 202 Ca 0.00 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.71 2gtt h ASN 202 Cb 0.00 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.10 2gtt h ASN 202 CO 0.00 0.76 0.07 0.15 -1.65 0.00 0.00 177.43 176.76 2gtt h PHE 203 N 1.28 0.39 0.06 1.19 3.57 -1.69 -2.04 116.94 119.69 2gtt h PHE 203 Ca 0.38 -0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.84 2gtt h PHE 203 Cb -0.04 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.59 2gtt h PHE 203 CO -0.00 0.45 -0.04 -0.09 -2.23 0.00 0.00 178.31 176.40 2gtt h ARG 204 N 0.21 -0.10 -0.80 1.11 2.43 -1.31 -0.43 114.38 115.49 2gtt h ARG 204 Ca 0.08 0.01 0.19 0.00 -0.81 0.00 0.00 59.98 59.44 2gtt h ARG 204 Cb 0.25 0.02 -0.12 0.00 -0.42 0.00 0.00 29.97 29.70 2gtt h ARG 204 CO -0.00 -0.07 0.19 0.35 -1.51 0.00 0.00 179.97 178.93 2gtt h PHE 205 N -0.11 0.28 0.44 2.20 3.57 -0.45 0.42 116.94 123.30 2gtt h PHE 205 Ca -0.00 0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 2gtt h PHE 205 Cb 0.10 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.84 2gtt h PHE 205 CO -0.09 -0.14 -0.21 -0.07 -2.23 0.00 0.00 178.31 175.57 2gtt h LEU 206 N 0.24 -0.50 -0.98 0.59 3.38 -0.94 -0.98 115.31 116.11 2gtt h LEU 206 Ca 0.47 -0.09 0.27 0.00 0.09 0.00 0.00 57.88 58.61 2gtt h LEU 206 Cb 0.86 0.13 -0.18 0.00 0.09 0.00 0.00 40.66 41.55 2gtt h LEU 206 CO -0.58 -0.10 0.02 0.00 0.09 0.00 0.00 178.44 177.87 2gtt h ALA 207 N -0.73 1.15 0.40 1.53 0.00 -0.07 0.45 119.26 121.98 2gtt h ALA 207 Ca -0.06 0.34 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 2gtt h ALA 207 Cb 0.56 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2gtt h ALA 207 CO 0.10 -0.56 -0.28 0.78 0.00 0.00 0.00 179.25 179.28 2gtt h GLY 208 N 0.01 -0.93 -0.22 0.00 0.00 -0.11 -2.06 103.07 99.75 2gtt h GLY 208 Ca 0.59 0.40 0.19 0.00 0.00 0.00 0.00 47.33 48.51 2gtt h GLY 208 CO -0.92 -0.31 0.19 0.00 0.00 0.00 0.00 176.54 175.50 2gtt h THR 209 N -0.65 0.43 -0.69 4.70 1.03 0.11 0.17 112.91 118.02 2gtt h THR 209 Ca -0.05 -0.08 0.06 0.00 -0.01 0.00 0.00 66.41 66.32 2gtt h THR 209 Cb 0.53 0.16 -0.06 0.00 -1.07 0.00 0.00 68.15 67.72 2gtt h THR 209 CO 0.03 0.05 0.39 1.88 -0.01 0.00 0.00 175.52 177.85 2gtt h TYR 210 N 0.25 0.72 0.08 0.00 -1.99 -0.42 -1.43 116.97 114.18 2gtt h TYR 210 Ca 0.47 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 61.22 2gtt h TYR 210 Cb 0.85 -0.22 0.00 0.00 2.00 0.00 0.00 36.73 39.36 2gtt h TYR 210 CO -0.27 0.34 -0.04 0.22 -0.00 0.00 0.00 178.16 178.41 2gtt h ASP 211 N 0.72 -0.09 -0.90 3.88 3.58 0.02 -2.55 116.42 121.07 2gtt h ASP 211 Ca 0.31 -0.26 0.15 0.00 0.42 0.00 0.00 57.03 57.66 2gtt h ASP 211 Cb 0.19 0.02 -0.10 0.00 1.72 0.00 0.00 39.33 41.17 2gtt h ASP 211 CO -0.18 0.21 0.50 -0.03 -2.88 0.00 0.00 179.24 176.86 2gtt h MET 212 N -0.40 0.68 0.52 0.28 4.05 -0.94 0.13 114.93 119.25 2gtt h MET 212 Ca -0.01 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.34 2gtt h MET 212 Cb 0.34 -0.15 -0.00 0.00 -0.80 0.00 0.00 31.60 30.99 2gtt h MET 212 CO 0.02 0.45 -0.33 0.35 0.23 0.00 0.00 176.91 177.63 2gtt h PHE 213 N 0.71 -0.89 0.00 1.39 3.57 -1.14 -2.93 116.94 117.65 2gtt h PHE 213 Ca 0.49 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.99 2gtt h PHE 213 Cb 0.69 0.32 0.00 0.00 2.79 0.00 0.00 35.95 39.75 2gtt h PHE 213 CO -0.06 -0.49 0.00 0.74 -2.23 0.00 0.00 178.31 176.27 2gtt h PHE 214 N -0.80 0.00 -0.27 0.41 0.05 -0.96 -0.97 116.94 114.40 2gtt h PHE 214 Ca -0.07 0.00 -0.01 0.00 3.82 0.00 0.00 57.97 61.71 2gtt h PHE 214 Cb 0.65 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.59 2gtt h PHE 214 CO -0.05 0.00 0.12 1.03 -0.18 0.00 0.00 178.31 179.24 2gtt h SER 215 N 0.00 0.36 0.00 2.17 0.87 -0.58 -3.38 113.55 112.99 2gtt h SER 215 Ca 0.00 -0.14 -0.38 0.00 -1.23 0.00 0.00 61.79 60.04 2gtt h SER 215 Cb 0.12 -0.09 -0.06 0.00 -0.44 0.00 0.00 62.40 61.93 2gtt h SER 215 CO 0.00 0.40 -2.09 -1.14 -0.53 0.00 0.00 176.83 173.47 2gtt n ARG 216 N -4.79 0.59 -2.21 2.24 3.00 -0.83 -5.00 116.66 109.66 2gtt n ARG 216 Ca -0.02 0.37 -0.36 0.00 -0.00 0.00 0.00 57.85 57.83 2gtt n ARG 216 Cb 0.11 -1.59 0.00 0.00 0.00 0.00 0.00 32.46 30.99 2gtt n ARG 216 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2gtt s ILE 217 N -2.46 3.04 0.67 5.15 1.09 -0.43 -4.91 121.20 123.35 2gtt s ILE 217 Ca -0.35 0.70 -0.17 0.00 -1.10 0.00 0.00 60.65 59.73 2gtt s ILE 217 Cb 0.11 -3.31 0.00 0.00 -1.06 0.00 0.00 42.46 38.21 2gtt s ILE 217 CO 0.54 -0.09 1.28 -0.70 -0.10 0.00 0.00 174.94 175.86 2gtt s GLU 218 N -3.08 2.40 0.00 2.79 2.12 -1.26 -4.70 118.70 116.96 2gtt s GLU 218 Ca 0.70 2.00 -0.19 0.00 0.36 0.00 0.00 54.97 57.85 2gtt s GLU 218 Cb -0.27 -1.84 -0.23 0.00 0.26 0.00 0.00 34.13 32.06 2gtt s GLU 218 CO 0.31 -1.70 1.17 1.58 -0.54 0.00 0.00 175.26 176.09 2gtt n HIS 219 N -2.14 0.00 0.00 5.30 -0.00 -1.26 -4.74 115.22 112.37 2gtt n HIS 219 Ca 0.15 -0.33 0.00 0.00 -0.00 0.00 0.00 57.72 57.55 2gtt n HIS 219 Cb 0.49 -0.62 0.00 0.00 -0.00 0.00 0.00 29.99 29.86 2gtt n HIS 219 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.34 176.23 2gtt n LEU 220 N 6.89 0.94 -0.10 0.27 7.94 -1.26 -4.59 117.00 127.09 2gtt n LEU 220 Ca 0.29 0.40 0.04 0.00 -1.11 0.00 0.00 56.01 55.62 2gtt n LEU 220 Cb 0.33 -0.10 0.05 0.00 0.53 0.00 0.00 43.42 44.24 2gtt n LEU 220 CO 0.83 -0.10 0.45 -1.22 -1.11 0.00 0.00 177.39 176.25 2gtt n TYR 221 N -0.79 0.00 -0.03 1.96 4.02 -1.26 -4.88 117.16 116.18 2gtt n TYR 221 Ca 0.00 -0.53 0.17 0.00 -0.01 0.00 0.00 57.90 57.53 2gtt n TYR 221 Cb 0.00 -0.08 0.26 0.00 -0.02 0.00 0.00 39.34 39.50 2gtt n TYR 221 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2gtt n SER 222 N -0.69 0.00 0.00 7.72 3.41 -1.26 -1.20 113.62 121.60 2gtt n SER 222 Ca 0.06 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.28 2gtt n SER 222 Cb 0.49 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.28 2gtt n SER 222 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gtt n ALA 223 N -1.91 0.26 -0.11 7.33 0.00 -1.26 0.24 120.51 125.06 2gtt n ALA 223 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.45 2gtt n ALA 223 Cb 1.24 -0.24 -0.03 0.00 0.00 0.00 0.00 19.45 20.42 2gtt n ALA 223 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2gtt h ILE 224 N 0.00 1.28 -0.85 0.00 2.04 -1.56 -3.31 117.51 115.12 2gtt h ILE 224 Ca 0.00 -1.49 0.25 0.00 1.00 0.00 0.00 64.86 64.62 2gtt h ILE 224 Cb 0.65 1.43 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 2gtt h ILE 224 CO 0.00 0.49 1.02 0.54 0.00 0.00 0.00 178.15 180.20 2gtt n ARG 225 N -4.15 0.01 -0.24 2.37 1.74 0.14 -1.29 116.66 115.24 2gtt n ARG 225 Ca -0.03 0.85 0.24 0.00 -0.77 0.00 0.00 57.85 58.14 2gtt n ARG 225 Cb 0.50 -2.12 0.43 0.00 -1.02 0.00 0.00 32.46 30.26 2gtt n ARG 225 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2gtt n VAL 226 N -2.90 -0.30 -0.05 1.55 0.31 -1.25 0.14 118.33 115.83 2gtt n VAL 226 Ca 0.19 1.48 -0.19 0.00 -0.01 0.00 0.00 64.34 65.81 2gtt n VAL 226 Cb 1.28 -2.41 -0.13 0.00 -0.91 0.00 0.00 33.84 31.66 2gtt n VAL 226 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2gtt n GLY 227 N -1.20 -0.50 0.02 2.92 0.00 -0.41 -4.42 105.19 101.61 2gtt n GLY 227 Ca 0.28 -0.23 0.13 0.00 0.00 0.00 0.00 46.02 46.20 2gtt n GLY 227 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gtt n THR 228 N -3.36 0.12 -0.29 2.61 -2.24 0.14 -3.77 114.28 107.49 2gtt n THR 228 Ca -0.37 -0.07 0.04 0.00 -2.27 0.00 0.00 64.05 61.38 2gtt n THR 228 Cb 1.03 -0.33 0.18 0.00 -2.10 0.00 0.00 70.33 69.11 2gtt n THR 228 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 2gtt h VAL 229 N 0.00 0.86 0.00 2.28 3.04 0.11 -1.69 116.25 120.85 2gtt h VAL 229 Ca 0.00 -0.25 0.00 0.00 -1.01 0.00 0.00 66.70 65.44 2gtt h VAL 229 Cb 0.56 0.06 0.00 0.00 -2.01 0.00 0.00 31.29 29.89 2gtt h VAL 229 CO 0.00 0.14 0.00 1.33 -1.01 0.00 0.00 177.57 178.03 2gtt n VAL 230 N -4.78 0.53 1.07 1.51 0.24 -1.26 -0.42 118.33 115.23 2gtt n VAL 230 Ca 0.14 0.13 0.08 0.00 -2.04 0.00 0.00 64.34 62.65 2gtt n VAL 230 Cb 0.31 -1.04 0.26 0.00 -1.47 0.00 0.00 33.84 31.91 2gtt n VAL 230 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2gtt n THR 231 N -1.16 0.34 0.00 3.34 -2.24 -0.64 -4.45 114.28 109.46 2gtt n THR 231 Ca 0.03 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 2gtt n THR 231 Cb 0.03 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 2gtt n THR 231 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gtt n ALA 232 N 0.40 0.00 -0.56 6.98 0.00 0.44 -3.84 120.51 123.93 2gtt n ALA 232 Ca 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.56 2gtt n ALA 232 Cb 0.30 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.74 2gtt n ALA 232 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2gtt n TYR 233 N 0.00 0.06 -1.66 0.00 4.02 -1.25 -3.96 117.16 114.38 2gtt n TYR 233 Ca 0.00 -1.08 -0.54 0.00 -0.01 0.00 0.00 57.90 56.27 2gtt n TYR 233 Cb 0.00 -0.61 -0.06 0.00 -0.02 0.00 0.00 39.34 38.65 2gtt n TYR 233 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 2gtt n GLU 234 N 1.53 1.33 -1.60 -0.72 2.13 -1.25 -1.14 120.64 120.92 2gtt n GLU 234 Ca 0.05 0.48 -0.03 0.00 0.66 0.00 0.00 57.16 58.32 2gtt n GLU 234 Cb 0.54 -2.18 -0.01 0.00 0.27 0.00 0.00 31.44 30.06 2gtt n GLU 234 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2gtt n ASP 235 N 4.32 -2.50 -1.13 4.31 9.92 -1.26 -4.65 116.55 125.55 2gtt n ASP 235 Ca 0.22 0.03 0.04 0.00 -0.53 0.00 0.00 54.79 54.56 2gtt n ASP 235 Cb 0.18 -1.15 0.06 0.00 -0.64 0.00 0.00 41.12 39.57 2gtt n ASP 235 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2gtt h SER 237 N 0.82 0.00 0.56 0.00 4.64 -1.73 0.11 113.55 117.94 2gtt h SER 237 Ca -0.14 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.15 2gtt h SER 237 Cb 1.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.72 2gtt h SER 237 CO 0.06 0.02 -0.29 1.23 -0.87 0.00 0.00 176.83 176.98 2gtt h GLY 238 N 0.69 -0.82 0.96 -0.77 0.00 -1.15 0.50 103.07 102.47 2gtt h GLY 238 Ca -0.00 0.31 0.01 0.00 0.00 0.00 0.00 47.33 47.66 2gtt h GLY 238 CO 0.00 -0.30 0.40 -2.00 0.00 0.00 0.00 176.54 174.64 2gtt h LEU 239 N -0.78 0.67 -1.15 3.11 5.85 -0.71 -2.20 115.31 120.10 2gtt h LEU 239 Ca -0.07 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.59 2gtt h LEU 239 Cb 0.61 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2gtt h LEU 239 CO 0.11 0.48 0.10 0.58 -0.34 0.00 0.00 178.44 179.37 2gtt h VAL 240 N 0.80 1.21 -0.50 1.05 2.07 -0.57 -0.89 116.25 119.42 2gtt h VAL 240 Ca 0.23 -0.75 -0.11 0.00 0.82 0.00 0.00 66.70 66.89 2gtt h VAL 240 Cb -0.05 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 2gtt h VAL 240 CO -0.07 0.27 -0.13 0.28 0.02 0.00 0.00 177.57 177.95 2gtt h SER 241 N 0.67 0.97 0.13 0.57 0.02 0.39 -2.31 113.55 113.99 2gtt h SER 241 Ca 0.15 -0.36 -0.01 0.00 -0.84 0.00 0.00 61.79 60.73 2gtt h SER 241 Cb 0.27 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.55 2gtt h SER 241 CO -0.00 1.11 -0.06 0.15 -1.14 0.00 0.00 176.83 176.89 2gtt h PHE 242 N 0.82 -0.16 -0.67 3.45 3.57 -0.97 0.29 116.94 123.28 2gtt h PHE 242 Ca 0.13 -0.00 0.19 0.00 3.53 0.00 0.00 57.97 61.82 2gtt h PHE 242 Cb 0.69 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.45 2gtt h PHE 242 CO 0.05 0.23 0.50 0.00 -2.23 0.00 0.00 178.31 176.86 2gtt h THR 243 N -0.59 0.62 0.00 4.41 1.03 -1.17 -0.45 112.91 116.78 2gtt h THR 243 Ca -0.02 0.00 -0.00 0.00 -0.01 0.00 0.00 66.41 66.38 2gtt h THR 243 Cb 0.46 0.65 0.00 0.00 -1.07 0.00 0.00 68.15 68.19 2gtt h THR 243 CO 0.03 0.00 -0.00 1.23 -0.01 0.00 0.00 175.52 176.77 2gtt h GLY 244 N 0.00 -0.01 -0.99 2.99 0.00 -1.09 -3.31 103.07 100.66 2gtt h GLY 244 Ca 0.32 0.00 0.12 0.00 0.00 0.00 0.00 47.33 47.76 2gtt h GLY 244 CO -0.00 -0.00 -0.51 -2.75 0.00 0.00 0.00 176.54 173.28 2gtt h PHE 245 N -0.99 -1.57 -0.73 5.60 3.57 0.12 0.77 116.94 123.72 2gtt h PHE 245 Ca -0.00 0.12 0.01 0.00 3.53 0.00 0.00 57.97 61.63 2gtt h PHE 245 Cb 0.76 0.82 -0.04 0.00 2.79 0.00 0.00 35.95 40.28 2gtt h PHE 245 CO 0.21 -0.39 0.48 -0.84 -2.23 0.00 0.00 178.31 175.54 2gtt h ILE 246 N -0.00 1.18 0.07 1.41 3.07 -1.58 -3.18 117.51 118.46 2gtt h ILE 246 Ca 0.23 -0.33 -0.00 0.00 1.55 0.00 0.00 64.86 66.31 2gtt h ILE 246 Cb 0.49 0.12 0.00 0.00 -0.27 0.00 0.00 36.82 37.16 2gtt h ILE 246 CO -0.96 0.18 -0.03 0.50 -1.05 0.00 0.00 178.15 176.79 2gtt h LYS 247 N 0.97 -0.09 0.00 0.16 3.64 -1.07 -2.93 116.57 117.26 2gtt h LYS 247 Ca 0.27 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.65 2gtt h LYS 247 Cb -0.09 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 2gtt h LYS 247 CO -0.06 -0.06 0.00 0.94 -2.27 0.00 0.00 179.45 178.00 2gtt n GLN 248 N -4.83 -1.20 0.00 1.90 7.27 0.25 -4.51 117.38 116.26 2gtt n GLN 248 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.06 2gtt n GLN 248 Cb 0.04 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.69 2gtt n GLN 248 CO 0.00 0.00 0.00 -0.89 0.07 0.00 0.00 177.06 176.24 2gtt n ILE 249 N -2.57 0.00 -2.61 1.69 5.41 -1.26 -4.15 119.36 115.87 2gtt n ILE 249 Ca 0.00 0.00 -0.35 0.00 1.00 0.00 0.00 62.75 63.40 2gtt n ILE 249 Cb 0.00 0.00 -0.04 0.00 -0.71 0.00 0.00 39.64 38.89 2gtt n ILE 249 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2gtt s ASN 250 N -4.00 6.62 -1.00 4.38 4.22 -1.26 -4.96 114.94 118.95 2gtt s ASN 250 Ca 0.00 1.91 -0.01 0.00 -2.14 0.00 0.00 52.86 52.62 2gtt s ASN 250 Cb 0.00 -2.56 0.32 0.00 1.28 0.00 0.00 41.25 40.28 2gtt s ASN 250 CO 0.00 -0.59 1.67 -0.11 -2.04 0.00 0.00 177.10 176.04 2gtt n LEU 251 N -0.57 6.90 -4.97 3.54 7.94 -1.26 -4.17 117.00 124.41 2gtt n LEU 251 Ca 0.07 -5.38 -0.22 0.00 -1.11 0.00 0.00 56.01 49.37 2gtt n LEU 251 Cb 0.52 -1.13 0.05 0.00 0.53 0.00 0.00 43.42 43.38 2gtt n LEU 251 CO 0.41 2.00 0.41 -0.89 -1.11 0.00 0.00 177.39 178.22 2gtt s THR 252 N -4.01 2.57 -0.60 1.96 2.01 -1.11 -5.05 115.64 111.42 2gtt s THR 252 Ca 0.38 -0.61 0.04 0.00 0.31 0.00 0.00 61.69 61.82 2gtt s THR 252 Cb 0.17 -2.96 0.17 0.00 0.01 0.00 0.00 72.50 69.88 2gtt s THR 252 CO -0.08 0.00 0.43 0.00 -0.69 0.00 0.00 174.62 174.28 2gtt s ALA 253 N -2.86 2.98 0.00 7.40 0.00 -1.26 -4.44 121.76 123.58 2gtt s ALA 253 Ca 0.58 -3.33 0.00 0.00 0.00 0.00 0.00 51.96 49.21 2gtt s ALA 253 Cb -0.10 -1.98 0.00 0.00 0.00 0.00 0.00 23.12 21.04 2gtt s ALA 253 CO 0.40 -2.06 0.00 2.89 0.00 0.00 0.00 175.76 176.99 2gtt n ARG 254 N 2.36 0.00 0.17 0.00 1.85 -1.26 -4.36 116.66 115.42 2gtt n ARG 254 Ca 0.22 0.00 0.13 0.00 -1.00 0.00 0.00 57.85 57.20 2gtt n ARG 254 Cb 0.39 -1.71 0.48 0.00 -1.05 0.00 0.00 32.46 30.56 2gtt n ARG 254 CO 0.00 0.00 0.00 1.49 -0.01 0.00 0.00 177.63 179.11 2gtt h GLU 255 N 0.00 0.00 -0.80 2.89 4.22 -2.00 -3.24 114.58 115.65 2gtt h GLU 255 Ca 0.00 0.00 0.23 0.00 0.08 0.00 0.00 59.36 59.67 2gtt h GLU 255 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 2gtt h GLU 255 CO 0.00 0.00 0.75 0.00 -2.18 0.00 0.00 179.01 177.58 2gtt h ALA 256 N 2.24 2.63 -0.30 2.92 0.00 -1.91 0.22 119.26 125.06 2gtt h ALA 256 Ca 0.00 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.97 2gtt h ALA 256 Cb 0.56 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2gtt h ALA 256 CO 0.00 -1.16 0.54 0.82 0.00 0.00 0.00 179.25 179.45 2gtt h ILE 257 N 0.00 0.17 -0.12 0.00 2.04 -1.94 0.19 117.51 117.85 2gtt h ILE 257 Ca 0.38 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.27 2gtt h ILE 257 Cb 1.87 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 38.47 2gtt h ILE 257 CO -0.00 0.00 0.16 -0.07 0.00 0.00 0.00 178.15 178.23 2gtt h LEU 258 N 0.00 0.00 -0.30 1.44 4.07 -0.87 -1.10 115.31 118.56 2gtt h LEU 258 Ca 0.14 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.10 2gtt h LEU 258 Cb 1.22 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.96 2gtt h LEU 258 CO -0.00 0.00 -0.30 -1.22 -1.08 0.00 0.00 178.44 175.83 2gtt n TYR 259 N -3.64 0.00 -2.28 1.13 4.02 0.06 -4.63 117.16 111.81 2gtt n TYR 259 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.50 2gtt n TYR 259 Cb 0.26 -0.18 -0.02 0.00 -0.02 0.00 0.00 39.34 39.38 2gtt n TYR 259 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2gtt n PHE 260 N -0.97 3.87 -1.74 -0.72 3.01 -0.42 -4.87 117.46 115.63 2gtt n PHE 260 Ca 0.10 -2.41 -0.41 0.00 1.01 0.00 0.00 57.45 55.75 2gtt n PHE 260 Cb 0.34 -2.58 -0.01 0.00 -0.01 0.00 0.00 39.48 37.21 2gtt n PHE 260 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 2gtt n PHE 261 N 9.87 2.93 -3.61 1.38 0.99 -1.26 -4.88 117.46 122.87 2gtt n PHE 261 Ca 0.48 -2.96 -0.15 0.00 -0.00 0.00 0.00 57.45 54.82 2gtt n PHE 261 Cb 0.45 -2.32 -0.07 0.00 -1.00 0.00 0.00 39.48 36.54 2gtt n PHE 261 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.76 175.18 2gtt s HIS 262 N 1.72 -0.67 0.59 1.38 2.46 -1.26 -5.00 115.29 114.51 2gtt s HIS 262 Ca 0.54 1.47 0.29 0.00 0.47 0.00 0.00 55.06 57.84 2gtt s HIS 262 Cb 0.15 0.29 1.69 0.00 -0.13 0.00 0.00 32.58 34.58 2gtt s HIS 262 CO -0.06 -0.44 2.12 -0.22 -2.47 0.00 0.00 174.74 173.67 2gtt h LYS 263 N 4.34 0.00 -0.32 2.88 3.64 -2.04 -1.96 116.57 123.10 2gtt h LYS 263 Ca -0.28 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.04 2gtt h LYS 263 Cb 1.16 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.96 2gtt h LYS 263 CO 0.20 0.00 -0.04 -0.91 -2.27 0.00 0.00 179.45 176.43 2gtt h ASN 264 N 0.00 0.49 0.66 4.20 2.35 -1.96 -2.56 115.58 118.77 2gtt h ASN 264 Ca 0.07 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2gtt h ASN 264 Cb 0.43 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.67 2gtt h ASN 264 CO -0.00 0.59 0.00 -0.26 -1.65 0.00 0.00 177.43 176.11 2gtt h PHE 265 N 0.49 0.00 0.00 1.19 0.04 -1.69 -3.35 116.94 113.62 2gtt h PHE 265 Ca 0.10 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.87 2gtt h PHE 265 Cb 0.38 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.53 2gtt h PHE 265 CO 0.01 0.00 0.00 0.39 -0.60 0.00 0.00 178.31 178.11 2gtt n GLU 266 N -2.64 0.00 -0.30 1.51 1.02 -0.96 -0.47 120.64 118.79 2gtt n GLU 266 Ca 0.01 0.25 0.21 0.00 -0.02 0.00 0.00 57.16 57.60 2gtt n GLU 266 Cb 0.21 -1.03 0.39 0.00 -0.02 0.00 0.00 31.44 31.00 2gtt n GLU 266 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2gtt n GLU 267 N -0.82 -0.06 0.16 3.49 1.02 -1.25 -1.71 120.64 121.46 2gtt n GLU 267 Ca 0.00 1.31 -0.13 0.00 -0.02 0.00 0.00 57.16 58.33 2gtt n GLU 267 Cb 0.00 -2.21 -0.08 0.00 -0.02 0.00 0.00 31.44 29.14 2gtt n GLU 267 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2gtt h GLU 268 N 0.00 -0.41 -0.32 3.49 5.08 -1.64 0.26 114.58 121.03 2gtt h GLU 268 Ca 0.65 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 59.11 2gtt h GLU 268 Cb 1.56 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 30.82 2gtt h GLU 268 CO -0.78 -0.09 -0.26 0.82 -1.00 0.00 0.00 179.01 177.70 2gtt h ILE 269 N -0.82 0.33 -0.64 3.13 1.08 -0.06 0.11 117.51 120.64 2gtt h ILE 269 Ca -0.04 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.55 2gtt h ILE 269 Cb 0.52 0.33 -0.04 0.00 -3.07 0.00 0.00 36.82 34.56 2gtt h ILE 269 CO 0.07 0.00 0.44 -0.09 -0.69 0.00 0.00 178.15 177.88 2gtt h ARG 270 N -0.23 0.34 0.14 2.37 2.43 -1.30 0.50 114.38 118.63 2gtt h ARG 270 Ca 0.16 -0.02 -0.30 0.00 -0.81 0.00 0.00 59.98 59.01 2gtt h ARG 270 Cb 0.49 -0.08 0.03 0.00 -0.42 0.00 0.00 29.97 29.99 2gtt h ARG 270 CO -0.46 0.22 -1.27 -0.09 -1.51 0.00 0.00 179.97 176.86 2gtt h ARG 271 N 0.35 0.61 0.00 0.20 2.43 0.18 -3.22 114.38 114.94 2gtt h ARG 271 Ca 0.31 -0.85 0.00 0.00 -0.81 0.00 0.00 59.98 58.63 2gtt h ARG 271 Cb 0.72 0.29 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 2gtt h ARG 271 CO -0.08 1.39 -0.47 0.00 -1.51 0.00 0.00 179.97 179.30 2gtt n MET 272 N -3.79 0.06 -0.40 0.20 0.00 0.09 -3.69 117.12 109.59 2gtt n MET 272 Ca -0.14 0.02 0.08 0.00 0.00 0.00 0.00 57.70 57.65 2gtt n MET 272 Cb 1.00 -1.54 0.25 0.00 0.00 0.00 0.00 33.22 32.93 2gtt n MET 272 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 2gtt n PHE 273 N -1.63 0.92 -1.67 3.17 3.01 0.12 -4.99 117.46 116.39 2gtt n PHE 273 Ca 0.05 -0.71 -0.50 0.00 1.01 0.00 0.00 57.45 57.30 2gtt n PHE 273 Cb 0.36 -0.22 -0.05 0.00 -0.01 0.00 0.00 39.48 39.55 2gtt n PHE 273 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 2gtt n GLU 274 N 0.08 1.80 -1.51 -1.08 4.07 -1.21 -4.93 120.64 117.87 2gtt n GLU 274 Ca 0.19 0.66 -0.31 0.00 -0.06 0.00 0.00 57.16 57.63 2gtt n GLU 274 Cb 0.76 -2.42 0.06 0.00 -0.06 0.00 0.00 31.44 29.79 2gtt n GLU 274 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 2gtt s PRO 275 N 2.52 2.67 0.00 5.31 0.04 -1.26 -4.32 135.00 139.96 2gtt s PRO 275 Ca 0.89 1.12 0.00 0.00 0.04 0.00 0.00 61.00 63.05 2gtt s PRO 275 Cb -0.81 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 31.78 2gtt s PRO 275 CO 0.50 -1.32 0.00 0.41 0.04 0.00 0.00 177.00 176.63 2gtt n GLY 276 N -1.39 2.39 2.87 0.56 0.00 -1.26 -5.06 105.19 103.29 2gtt n GLY 276 Ca 0.09 -0.69 -0.47 0.00 0.00 0.00 0.00 46.02 44.95 2gtt n GLY 276 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2gtt n GLN 277 N 0.00 0.00 -0.99 1.61 3.00 -1.26 -4.73 117.38 115.01 2gtt n GLN 277 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.87 2gtt n GLN 277 Cb 0.00 -1.14 -0.16 0.00 0.00 0.00 0.00 30.24 28.94 2gtt n GLN 277 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 2gtt n GLU 278 N 1.14 1.97 -0.13 -1.09 1.02 -1.26 -4.45 120.64 117.84 2gtt n GLU 278 Ca 0.16 -1.00 0.09 0.00 -0.02 0.00 0.00 57.16 56.39 2gtt n GLU 278 Cb 0.10 -1.96 0.43 0.00 -0.02 0.00 0.00 31.44 29.98 2gtt n GLU 278 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2gtt h THR 279 N 1.96 0.96 -0.11 2.62 2.02 -1.96 -2.52 112.91 115.87 2gtt h THR 279 Ca 0.19 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 67.15 2gtt h THR 279 Cb 1.48 0.33 -0.00 0.00 -1.74 0.00 0.00 68.15 68.21 2gtt h THR 279 CO 0.24 0.10 0.00 0.00 0.37 0.00 0.00 175.52 176.24 2gtt h ALA 280 N 1.66 0.15 -2.42 6.16 0.00 -1.96 -3.45 119.26 119.40 2gtt h ALA 280 Ca 0.29 -0.18 -0.57 0.00 0.00 0.00 0.00 54.91 54.45 2gtt h ALA 280 Cb 0.39 -0.04 0.09 0.00 0.00 0.00 0.00 17.79 18.23 2gtt h ALA 280 CO -0.09 -0.16 0.61 0.28 0.00 0.00 0.00 179.25 179.89 2gtt n VAL 281 N -4.81 1.22 0.15 0.00 0.31 -0.95 -4.95 118.33 109.30 2gtt n VAL 281 Ca -0.06 -0.31 -0.01 0.00 -0.01 0.00 0.00 64.34 63.96 2gtt n VAL 281 Cb 0.20 -1.54 0.21 0.00 -0.91 0.00 0.00 33.84 31.80 2gtt n VAL 281 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2gtt h PRO 282 N 3.85 0.01 0.00 5.55 0.11 -1.88 -3.36 132.00 136.28 2gtt h PRO 282 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2gtt h PRO 282 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2gtt h PRO 282 CO 0.73 0.56 -0.24 0.72 -0.21 0.00 0.00 178.00 179.57 2gtt n HIS 283 N -3.88 0.00 -0.40 0.65 8.25 -1.26 -5.01 115.22 113.57 2gtt n HIS 283 Ca -0.01 -0.50 -0.28 0.00 -0.26 0.00 0.00 57.72 56.67 2gtt n HIS 283 Cb 0.56 -0.10 0.24 0.00 1.12 0.00 0.00 29.99 31.82 2gtt n HIS 283 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2gtt n SER 284 N -0.71 -3.18 -0.23 0.41 3.41 -1.26 -4.91 113.62 107.16 2gtt n SER 284 Ca 0.08 -0.52 -0.08 0.00 -0.26 0.00 0.00 58.87 58.09 2gtt n SER 284 Cb 0.66 -1.01 0.04 0.00 -0.26 0.00 0.00 64.21 63.64 2gtt n SER 284 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 2gtt h TYR 285 N -3.05 1.06 -0.87 7.33 -1.99 -1.93 -3.24 116.97 114.28 2gtt h TYR 285 Ca -0.44 -0.12 0.22 0.00 2.00 0.00 0.00 58.73 60.39 2gtt h TYR 285 Cb 1.22 -0.30 -0.16 0.00 2.00 0.00 0.00 36.73 39.48 2gtt h TYR 285 CO -2.23 0.87 -0.04 0.34 -0.00 0.00 0.00 178.16 177.10 2gtt n PHE 286 N -4.33 0.49 0.00 4.88 7.35 -1.26 0.15 117.46 124.74 2gtt n PHE 286 Ca 0.04 1.05 0.00 0.00 -0.76 0.00 0.00 57.45 57.78 2gtt n PHE 286 Cb 0.23 -1.11 0.00 0.00 0.35 0.00 0.00 39.48 38.95 2gtt n PHE 286 CO 0.00 0.00 0.00 0.44 -0.76 0.00 0.00 176.76 176.44 2gtt n ILE 287 N -5.29 0.37 -1.03 -2.13 -5.35 -1.22 -1.47 119.36 103.23 2gtt n ILE 287 Ca 0.19 0.12 0.00 0.00 -0.27 0.00 0.00 62.75 62.79 2gtt n ILE 287 Cb 0.61 -1.12 0.00 0.00 -1.74 0.00 0.00 39.64 37.39 2gtt n ILE 287 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 2gtt n HIS 288 N -1.00 0.00 -0.24 4.28 8.25 0.12 -3.81 115.22 122.83 2gtt n HIS 288 Ca 0.00 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.55 2gtt n HIS 288 Cb 0.03 0.01 0.18 0.00 1.12 0.00 0.00 29.99 31.34 2gtt n HIS 288 CO 0.00 0.00 0.00 1.97 0.64 0.00 0.00 176.34 178.95 2gtt n PHE 289 N 0.00 0.40 -0.14 4.41 1.16 0.10 0.02 117.46 123.41 2gtt n PHE 289 Ca 0.00 0.83 -0.04 0.00 -1.87 0.00 0.00 57.45 56.37 2gtt n PHE 289 Cb 0.15 -0.99 0.17 0.00 -1.61 0.00 0.00 39.48 37.19 2gtt n PHE 289 CO 0.00 0.00 0.00 -0.09 -1.87 0.00 0.00 176.76 174.80 2gtt h ARG 290 N 0.00 0.87 -0.00 3.97 9.65 -1.82 -1.98 114.38 125.06 2gtt h ARG 290 Ca 0.40 -0.18 0.00 0.00 -1.10 0.00 0.00 59.98 59.10 2gtt h ARG 290 Cb 0.80 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.25 2gtt h ARG 290 CO -0.65 0.78 -0.13 -1.13 2.80 0.00 0.00 179.97 181.64 2gtt n SER 291 N -4.26 0.15 -0.13 -3.80 3.41 0.10 -4.24 113.62 104.85 2gtt n SER 291 Ca 0.04 0.22 -0.26 0.00 -0.26 0.00 0.00 58.87 58.61 2gtt n SER 291 Cb 0.24 -0.28 -0.11 0.00 -0.26 0.00 0.00 64.21 63.79 2gtt n SER 291 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2gtt n LEU 292 N -1.46 2.25 0.00 1.04 4.77 -0.91 -3.14 117.00 119.56 2gtt n LEU 292 Ca 0.07 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 2gtt n LEU 292 Cb 0.33 -0.86 0.00 0.00 -2.33 0.00 0.00 43.42 40.56 2gtt n LEU 292 CO 0.29 0.66 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 2gtt n GLY 293 N 1.56 3.32 2.73 -0.72 0.00 -0.79 -4.92 105.19 106.37 2gtt n GLY 293 Ca -0.50 -1.20 -0.01 0.00 0.00 0.00 0.00 46.02 44.31 2gtt n GLY 293 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gtt n LEU 294 N 0.00 -7.51 0.00 0.99 4.77 -1.26 -4.76 117.00 109.23 2gtt n LEU 294 Ca 0.00 1.53 0.00 0.00 -0.03 0.00 0.00 56.01 57.51 2gtt n LEU 294 Cb 0.00 -3.25 0.00 0.00 -2.33 0.00 0.00 43.42 37.84 2gtt n LEU 294 CO 0.00 -3.28 0.00 -1.54 -1.33 0.00 0.00 177.39 171.24 2gtt n SER 295 N 0.91 0.00 0.00 -1.43 3.41 -1.26 -4.23 113.62 111.03 2gtt n SER 295 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.54 2gtt n SER 295 Cb 0.13 0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 2gtt n SER 295 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gtt n GLY 296 N -1.12 0.26 3.23 5.00 0.00 -1.26 -4.11 105.19 107.19 2gtt n GLY 296 Ca 0.00 0.68 -0.28 0.00 0.00 0.00 0.00 46.02 46.43 2gtt n GLY 296 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gtt s LYS 297 N 0.00 1.75 0.23 1.61 -0.14 -1.26 -5.11 119.74 116.83 2gtt s LYS 297 Ca 0.00 -0.77 -0.30 0.00 -1.36 0.00 0.00 55.97 53.54 2gtt s LYS 297 Cb 0.00 -1.69 -0.09 0.00 -1.68 0.00 0.00 37.83 34.37 2gtt s LYS 297 CO 0.00 0.46 1.27 0.45 -0.76 0.00 0.00 175.35 176.77 2gtt s SER 298 N -0.50 6.94 -0.29 2.83 0.15 -1.26 -4.43 113.70 117.14 2gtt s SER 298 Ca 0.08 2.42 0.03 0.00 0.70 0.00 0.00 55.95 59.18 2gtt s SER 298 Cb -0.08 -2.62 0.47 0.00 -1.71 0.00 0.00 66.02 62.07 2gtt s SER 298 CO -0.01 -0.46 1.60 -0.81 1.20 0.00 0.00 173.24 174.76 2gtt n PRO 299 N 2.13 2.01 0.00 5.44 -0.04 -1.26 -3.60 135.00 139.67 2gtt n PRO 299 Ca 0.04 -2.06 0.00 0.00 -0.04 0.00 0.00 63.50 61.44 2gtt n PRO 299 Cb 0.43 -1.82 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 2gtt n PRO 299 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2gtt n TYR 300 N -0.53 0.00 -1.64 0.54 4.02 -1.26 -4.47 117.16 113.81 2gtt n TYR 300 Ca 0.39 -0.03 -0.34 0.00 -0.01 0.00 0.00 57.90 57.91 2gtt n TYR 300 Cb 1.27 -0.00 0.07 0.00 -0.02 0.00 0.00 39.34 40.65 2gtt n TYR 300 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 2gtt s SER 301 N -0.07 4.71 0.54 7.72 1.04 -1.15 -0.79 113.70 125.71 2gtt s SER 301 Ca 0.00 2.20 0.28 0.00 0.48 0.00 0.00 55.95 58.91 2gtt s SER 301 Cb 0.00 -2.57 1.44 0.00 0.10 0.00 0.00 66.02 64.99 2gtt s SER 301 CO 0.00 -1.91 1.95 0.77 0.98 0.00 0.00 173.24 175.03 2gtt h SER 302 N -0.01 0.00 0.21 7.02 4.64 -1.86 0.81 113.55 124.36 2gtt h SER 302 Ca -0.48 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 60.61 2gtt h SER 302 Cb 1.27 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.37 2gtt h SER 302 CO 0.52 0.00 -0.94 0.78 -0.87 0.00 0.00 176.83 176.32 2gtt h ASN 303 N 0.00 0.66 0.15 4.97 4.21 -1.95 -2.87 115.58 120.75 2gtt h ASN 303 Ca 0.30 -0.51 -0.00 0.00 1.21 0.00 0.00 56.30 57.30 2gtt h ASN 303 Cb 1.26 -0.20 -0.01 0.00 -1.12 0.00 0.00 38.32 38.25 2gtt h ASN 303 CO -0.00 1.31 -0.19 0.00 -1.29 0.00 0.00 177.43 177.26 2gtt h ALA 304 N 0.66 -0.85 -1.07 -0.83 0.00 0.30 -2.96 119.26 114.51 2gtt h ALA 304 Ca -0.09 -0.06 -0.78 0.00 0.00 0.00 0.00 54.91 53.98 2gtt h ALA 304 Cb 1.58 0.47 -0.27 0.00 0.00 0.00 0.00 17.79 19.57 2gtt h ALA 304 CO 0.17 -0.87 1.06 1.55 0.00 0.00 0.00 179.25 181.16 2gtt n VAL 305 N -3.47 4.31 0.08 0.00 3.14 -0.60 -4.84 118.33 116.95 2gtt n VAL 305 Ca -0.04 -4.76 -0.13 0.00 -2.96 0.00 0.00 64.34 56.45 2gtt n VAL 305 Cb 0.16 -1.33 -0.06 0.00 -1.06 0.00 0.00 33.84 31.55 2gtt n VAL 305 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 2gtt h GLY 306 N 3.35 -0.66 0.30 7.55 0.00 -1.33 -2.52 103.07 109.76 2gtt h GLY 306 Ca 0.56 0.44 0.10 0.00 0.00 0.00 0.00 47.33 48.43 2gtt h GLY 306 CO 1.36 -0.25 0.18 0.45 0.00 0.00 0.00 176.54 178.28 2gtt h HIS 307 N -0.55 0.30 0.46 5.60 3.86 -1.87 0.10 115.15 123.05 2gtt h HIS 307 Ca 0.04 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.27 2gtt h HIS 307 Cb 0.61 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 29.02 2gtt h HIS 307 CO -0.36 0.04 -0.44 0.28 0.86 0.00 0.00 177.93 178.32 2gtt h VAL 308 N 0.33 0.00 -0.98 2.45 2.07 -1.90 -2.29 116.25 115.93 2gtt h VAL 308 Ca 0.30 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.97 2gtt h VAL 308 Cb 0.41 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.03 2gtt h VAL 308 CO -0.35 0.00 -0.41 0.15 0.02 0.00 0.00 177.57 176.98 2gtt h PHE 309 N -0.88 -1.20 -0.28 1.57 3.57 -0.90 0.19 116.94 119.01 2gtt h PHE 309 Ca -0.06 0.11 0.05 0.00 3.53 0.00 0.00 57.97 61.60 2gtt h PHE 309 Cb 0.76 0.66 -0.04 0.00 2.79 0.00 0.00 35.95 40.12 2gtt h PHE 309 CO -0.22 -0.40 -0.01 -0.91 -2.23 0.00 0.00 178.31 174.55 2gtt h ASN 310 N -0.01 -0.12 0.51 0.41 4.21 -0.86 -0.49 115.58 119.23 2gtt h ASN 310 Ca 0.32 0.06 -0.02 0.00 1.21 0.00 0.00 56.30 57.87 2gtt h ASN 310 Cb 0.57 0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 37.87 2gtt h ASN 310 CO -0.97 -0.03 -0.43 0.25 -1.29 0.00 0.00 177.43 174.96 2gtt h LEU 311 N 0.08 -1.16 -0.91 1.61 5.85 -0.15 0.26 115.31 120.87 2gtt h LEU 311 Ca 0.13 0.09 0.19 0.00 0.84 0.00 0.00 57.88 59.13 2gtt h LEU 311 Cb 0.18 0.37 -0.17 0.00 0.37 0.00 0.00 40.66 41.41 2gtt h LEU 311 CO -0.23 -0.60 -0.17 0.40 -0.34 0.00 0.00 178.44 177.50 2gtt h ILE 312 N -0.92 0.10 0.05 4.05 2.04 -0.42 0.18 117.51 122.59 2gtt h ILE 312 Ca -0.07 -0.00 -0.25 0.00 1.00 0.00 0.00 64.86 65.54 2gtt h ILE 312 Cb 0.78 0.09 0.01 0.00 -0.74 0.00 0.00 36.82 36.95 2gtt h ILE 312 CO -0.01 0.00 -1.06 0.45 0.00 0.00 0.00 178.15 177.53 2gtt h HIS 313 N 0.01 0.65 -0.86 1.37 3.86 -0.71 -0.87 115.15 118.59 2gtt h HIS 313 Ca 0.46 -0.39 0.07 0.00 -1.16 0.00 0.00 60.37 59.35 2gtt h HIS 313 Cb 0.75 -0.06 -0.06 0.00 1.06 0.00 0.00 27.41 29.10 2gtt h HIS 313 CO -0.66 1.23 0.53 0.74 0.86 0.00 0.00 177.93 180.64 2gtt h PHE 314 N 0.20 0.98 -0.33 2.45 -1.00 0.22 2.16 116.94 121.62 2gtt h PHE 314 Ca -0.11 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.70 2gtt h PHE 314 Cb 1.72 -0.31 -0.02 0.00 3.61 0.00 0.00 35.95 40.95 2gtt h PHE 314 CO 0.07 0.48 0.21 0.28 -1.61 0.00 0.00 178.31 177.74 2gtt h VAL 315 N 0.95 1.10 -0.26 -0.55 2.07 -0.77 0.24 116.25 119.03 2gtt h VAL 315 Ca 0.39 -0.22 0.05 0.00 0.82 0.00 0.00 66.70 67.74 2gtt h VAL 315 Cb 0.21 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.59 2gtt h VAL 315 CO -0.19 0.10 -0.04 1.23 0.02 0.00 0.00 177.57 178.69 2gtt h GLY 316 N 0.44 0.21 0.60 2.17 0.00 0.87 -1.60 103.07 105.76 2gtt h GLY 316 Ca 0.12 0.07 0.06 0.00 0.00 0.00 0.00 47.33 47.58 2gtt h GLY 316 CO -0.02 -0.09 0.24 0.00 0.00 0.00 0.00 176.54 176.67 2gtt h TYR 318 N 0.46 0.59 -0.00 0.00 3.20 0.16 -1.75 116.97 119.62 2gtt h TYR 318 Ca 0.25 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.14 2gtt h TYR 318 Cb 0.22 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.30 2gtt h TYR 318 CO -0.13 0.31 -0.06 -1.33 -1.64 0.00 0.00 178.16 175.31 2gtt n MET 319 N -4.48 0.94 0.00 1.82 2.81 -0.24 -4.89 117.12 113.08 2gtt n MET 319 Ca 0.09 -0.31 0.00 0.00 -1.81 0.00 0.00 57.70 55.67 2gtt n MET 319 Cb 0.25 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.27 2gtt n MET 319 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2gtt n GLY 320 N 1.19 2.73 1.23 3.03 0.00 -0.66 -5.03 105.19 107.69 2gtt n GLY 320 Ca 0.18 -0.37 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 2gtt n GLY 320 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2gtt n GLN 321 N 0.00 0.00 0.11 1.61 1.13 -1.09 -4.84 117.38 114.30 2gtt n GLN 321 Ca 0.00 0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 54.93 2gtt n GLN 321 Cb 0.00 -0.56 -0.08 0.00 0.11 0.00 0.00 30.24 29.71 2gtt n GLN 321 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2gtt h VAL 322 N 2.68 0.89 -0.15 5.09 2.07 -1.96 0.05 116.25 124.92 2gtt h VAL 322 Ca -0.03 -0.25 0.01 0.00 0.82 0.00 0.00 66.70 67.25 2gtt h VAL 322 Cb 0.52 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 2gtt h VAL 322 CO 0.43 0.06 -0.09 -1.14 0.02 0.00 0.00 177.57 176.85 2gtt n ARG 323 N -5.13 -0.07 -0.09 1.57 0.00 -1.26 0.36 116.66 112.04 2gtt n ARG 323 Ca -0.09 0.68 -0.08 0.00 -0.00 0.00 0.00 57.85 58.36 2gtt n ARG 323 Cb 0.16 -1.02 0.07 0.00 0.00 0.00 0.00 32.46 31.67 2gtt n ARG 323 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 2gtt h SER 324 N 0.00 0.81 -1.37 6.15 4.64 -1.90 -2.67 113.55 119.21 2gtt h SER 324 Ca 0.02 -0.31 0.40 0.00 -0.47 0.00 0.00 61.79 61.44 2gtt h SER 324 Cb 0.06 -0.22 -0.06 0.00 -0.31 0.00 0.00 62.40 61.87 2gtt h SER 324 CO -0.14 1.03 0.98 0.25 -0.87 0.00 0.00 176.83 178.07 2gtt h LEU 325 N 0.68 0.05 -4.65 5.97 5.85 0.20 0.20 115.31 123.60 2gtt h LEU 325 Ca 0.09 0.01 -0.48 0.00 0.84 0.00 0.00 57.88 58.34 2gtt h LEU 325 Cb 0.78 0.01 -0.41 0.00 0.37 0.00 0.00 40.66 41.41 2gtt h LEU 325 CO 0.06 -0.00 -0.93 -0.46 -0.34 0.00 0.00 178.44 176.77 2gtt n ASN 326 N -4.18 3.42 -4.94 1.25 0.23 -0.69 -1.21 115.26 109.14 2gtt n ASN 326 Ca 0.31 -3.25 -0.24 0.00 -0.53 0.00 0.00 54.58 50.87 2gtt n ASN 326 Cb 1.42 -0.47 -0.01 0.00 -2.08 0.00 0.00 39.78 38.64 2gtt n ASN 326 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2gtt s ALA 327 N -3.44 3.71 0.14 -2.53 0.00 0.70 -4.88 121.76 115.46 2gtt s ALA 327 Ca 0.40 -0.93 -0.25 0.00 0.00 0.00 0.00 51.96 51.18 2gtt s ALA 327 Cb 0.41 -2.12 -0.07 0.00 0.00 0.00 0.00 23.12 21.34 2gtt s ALA 327 CO -0.07 -0.07 0.76 0.95 0.00 0.00 0.00 175.76 177.33 2gtt s THR 328 N -2.35 4.46 -0.12 0.00 -4.23 -1.26 -1.44 115.64 110.69 2gtt s THR 328 Ca 0.41 1.67 -0.18 0.00 -1.18 0.00 0.00 61.69 62.41 2gtt s THR 328 Cb -0.10 -4.12 -0.04 0.00 1.34 0.00 0.00 72.50 69.58 2gtt s THR 328 CO 0.36 0.49 0.46 0.54 -0.54 0.00 0.00 174.62 175.94 2gtt s VAL 329 N -0.92 5.19 -0.47 2.29 0.11 -0.86 -4.86 120.40 120.89 2gtt s VAL 329 Ca 0.36 0.93 -0.27 0.00 -2.93 0.00 0.00 61.98 60.07 2gtt s VAL 329 Cb -0.22 -3.80 -0.03 0.00 -1.53 0.00 0.00 36.38 30.79 2gtt s VAL 329 CO 0.25 0.33 1.99 -0.63 -3.33 0.00 0.00 175.10 173.71 2gtt s ILE 330 N 0.60 3.29 0.18 7.04 -1.09 -1.26 -4.85 121.20 125.10 2gtt s ILE 330 Ca 0.25 0.23 -0.11 0.00 -2.23 0.00 0.00 60.65 58.80 2gtt s ILE 330 Cb -0.15 -3.58 0.08 0.00 -1.58 0.00 0.00 42.46 37.24 2gtt s ILE 330 CO 0.10 -0.49 1.71 0.00 -1.23 0.00 0.00 174.94 175.03 2gtt h ALA 331 N 15.30 0.82 -0.11 9.38 0.00 -1.97 -3.19 119.26 139.49 2gtt h ALA 331 Ca -0.29 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.42 2gtt h ALA 331 Cb 1.19 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2gtt h ALA 331 CO 1.13 0.49 0.05 0.00 0.00 0.00 0.00 179.25 180.92 2gtt h ALA 332 N 1.07 0.12 -0.03 0.00 0.00 -2.02 -3.37 119.26 115.04 2gtt h ALA 332 Ca 0.20 0.01 -0.64 0.00 0.00 0.00 0.00 54.91 54.48 2gtt h ALA 332 Cb 0.29 -0.01 0.04 0.00 0.00 0.00 0.00 17.79 18.11 2gtt h ALA 332 CO -0.01 -0.41 2.31 0.00 0.00 0.00 0.00 179.25 181.14 2gtt n ALA 334 N 7.71 -0.49 -0.05 0.00 0.00 -1.26 -4.68 120.51 121.74 2gtt n ALA 334 Ca 0.50 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.87 2gtt n ALA 334 Cb 0.41 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.97 2gtt n ALA 334 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2gtt h PRO 335 N 0.01 0.68 -0.42 0.00 0.11 -1.81 -2.73 132.00 127.84 2gtt h PRO 335 Ca 0.00 -0.28 0.09 0.00 0.11 0.00 0.00 66.00 65.92 2gtt h PRO 335 Cb 0.00 -0.03 -0.08 0.00 0.11 0.00 0.00 31.00 31.00 2gtt h PRO 335 CO 0.00 0.87 -0.14 0.45 -0.21 0.00 0.00 178.00 178.97 2gtt h HIS 336 N 0.59 -0.32 -0.36 0.65 3.86 -1.95 0.92 115.15 118.54 2gtt h HIS 336 Ca 0.08 0.04 -0.12 0.00 -1.16 0.00 0.00 60.37 59.21 2gtt h HIS 336 Cb 0.74 0.21 -0.01 0.00 1.06 0.00 0.00 27.41 29.41 2gtt h HIS 336 CO 0.03 -0.22 -0.27 1.49 0.86 0.00 0.00 177.93 179.83 2gtt h GLU 337 N -0.05 0.74 0.54 2.45 4.81 -1.90 -3.00 114.58 118.18 2gtt h GLU 337 Ca 0.20 -0.32 -0.03 0.00 -0.13 0.00 0.00 59.36 59.09 2gtt h GLU 337 Cb 0.36 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.72 2gtt h GLU 337 CO -0.46 0.93 -0.26 0.52 -0.73 0.00 0.00 179.01 179.01 2gtt h MET 338 N 0.64 -0.70 -1.76 1.92 2.86 -0.92 -2.61 114.93 114.36 2gtt h MET 338 Ca 0.08 0.05 0.51 0.00 -2.06 0.00 0.00 59.70 58.28 2gtt h MET 338 Cb 0.78 0.16 -0.07 0.00 0.06 0.00 0.00 31.60 32.53 2gtt h MET 338 CO 0.06 -0.40 1.37 -1.13 1.06 0.00 0.00 176.91 177.88 2gtt n SER 339 N -5.32 0.00 -0.04 1.22 3.41 0.31 0.57 113.62 113.77 2gtt n SER 339 Ca -0.11 0.93 -0.11 0.00 -0.26 0.00 0.00 58.87 59.32 2gtt n SER 339 Cb 0.33 -0.44 -0.10 0.00 -0.26 0.00 0.00 64.21 63.74 2gtt n SER 339 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2gtt h VAL 340 N 0.00 1.29 -0.73 -3.33 2.07 -1.32 -1.93 116.25 112.30 2gtt h VAL 340 Ca 0.84 -1.80 0.03 0.00 0.82 0.00 0.00 66.70 66.59 2gtt h VAL 340 Cb 3.57 2.36 -0.04 0.00 -1.52 0.00 0.00 31.29 35.66 2gtt h VAL 340 CO -0.01 0.41 0.48 0.25 0.02 0.00 0.00 177.57 178.72 2gtt h LEU 341 N -0.93 0.76 -1.83 2.57 5.85 -0.64 0.93 115.31 122.03 2gtt h LEU 341 Ca -0.00 -0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.79 2gtt h LEU 341 Cb 0.70 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 2gtt h LEU 341 CO 0.01 0.53 0.29 1.23 -0.34 0.00 0.00 178.44 180.15 2gtt h GLY 342 N 0.89 0.27 0.81 3.75 0.00 0.12 -0.82 103.07 108.09 2gtt h GLY 342 Ca 0.29 -0.08 -0.03 0.00 0.00 0.00 0.00 47.33 47.50 2gtt h GLY 342 CO -0.08 0.06 -0.33 -1.33 0.00 0.00 0.00 176.54 174.85 2gtt h GLY 343 N 0.20 -0.97 1.00 4.60 0.00 0.02 -1.91 103.07 106.01 2gtt h GLY 343 Ca 0.19 0.36 -0.00 0.00 0.00 0.00 0.00 47.33 47.88 2gtt h GLY 343 CO -0.03 -0.35 -0.01 -0.97 0.00 0.00 0.00 176.54 175.17 2gtt h TYR 344 N -1.13 -0.03 -0.08 5.60 -1.99 -1.31 0.18 116.97 118.21 2gtt h TYR 344 Ca -0.09 -0.00 0.04 0.00 2.00 0.00 0.00 58.73 60.68 2gtt h TYR 344 Cb 0.74 0.01 -0.05 0.00 2.00 0.00 0.00 36.73 39.43 2gtt h TYR 344 CO -0.00 -0.02 -0.27 -0.07 -0.00 0.00 0.00 178.16 177.80 2gtt h LEU 345 N -0.04 -0.81 -1.23 3.88 4.07 -1.27 -1.74 115.31 118.16 2gtt h LEU 345 Ca -0.00 0.12 0.04 0.00 0.08 0.00 0.00 57.88 58.11 2gtt h LEU 345 Cb 0.03 0.35 -0.05 0.00 1.08 0.00 0.00 40.66 42.07 2gtt h LEU 345 CO 0.01 -0.32 0.53 1.23 -1.08 0.00 0.00 178.44 178.81 2gtt h GLY 346 N -0.36 1.14 1.65 0.83 0.00 -1.04 -0.89 103.07 104.40 2gtt h GLY 346 Ca 0.09 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 2gtt h GLY 346 CO -0.29 0.33 0.09 -2.09 0.00 0.00 0.00 176.54 174.58 2gtt h GLU 347 N 0.99 0.45 0.00 4.80 4.81 0.02 0.53 114.58 126.18 2gtt h GLU 347 Ca 0.32 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.42 2gtt h GLU 347 Cb 0.06 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 2gtt h GLU 347 CO -0.10 0.41 -0.35 1.49 -0.73 0.00 0.00 179.01 179.73 2gtt h GLU 348 N 0.44 0.00 0.00 1.92 4.57 -0.33 -3.32 114.58 117.87 2gtt h GLU 348 Ca 0.11 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 2gtt h GLU 348 Cb 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 2gtt h GLU 348 CO -0.01 0.35 -1.19 1.19 -1.18 0.00 0.00 179.01 178.18 2gtt n PHE 349 N -3.29 0.00 -2.89 0.92 3.01 -0.85 -4.64 117.46 109.71 2gtt n PHE 349 Ca 0.01 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.06 2gtt n PHE 349 Cb 0.60 -0.17 -0.04 0.00 -0.01 0.00 0.00 39.48 39.85 2gtt n PHE 349 CO 0.00 0.00 0.00 0.12 1.01 0.00 0.00 176.76 177.89 2gtt s PHE 350 N -2.71 3.37 -1.39 1.38 5.36 0.12 -3.86 117.98 120.25 2gtt s PHE 350 Ca -0.00 1.20 0.00 0.00 -0.96 0.00 0.00 56.93 57.17 2gtt s PHE 350 Cb 0.10 -3.03 0.00 0.00 -0.34 0.00 0.00 43.02 39.75 2gtt s PHE 350 CO 0.61 -0.32 0.00 0.41 -1.46 0.00 0.00 175.22 174.47 2gtt n GLY 351 N 3.59 1.21 3.09 13.12 0.00 -1.26 -4.93 105.19 120.02 2gtt n GLY 351 Ca 0.05 -0.39 -0.11 0.00 0.00 0.00 0.00 46.02 45.57 2gtt n GLY 351 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2gtt s LYS 352 N -3.33 0.60 0.01 1.61 2.20 -1.25 -5.15 119.74 114.43 2gtt s LYS 352 Ca 0.00 -0.96 -0.20 0.00 -0.36 0.00 0.00 55.97 54.45 2gtt s LYS 352 Cb 0.00 -0.18 0.04 0.00 -1.51 0.00 0.00 37.83 36.18 2gtt s LYS 352 CO 0.00 0.00 0.44 0.20 -0.36 0.00 0.00 175.35 175.63 2gtt s GLY 353 N -2.13 -0.31 -0.33 5.54 0.00 -1.26 -4.85 107.32 103.99 2gtt s GLY 353 Ca -0.03 0.52 -0.13 0.00 0.00 0.00 0.00 44.72 45.08 2gtt s GLY 353 CO -0.02 0.26 0.26 -0.51 0.00 0.00 0.00 173.10 173.08 2gtt s THR 354 N -1.90 5.26 0.01 0.90 -4.23 -1.26 -5.08 115.64 109.35 2gtt s THR 354 Ca -0.09 -0.07 0.08 0.00 -1.18 0.00 0.00 61.69 60.43 2gtt s THR 354 Cb -0.02 -3.70 -0.02 0.00 1.34 0.00 0.00 72.50 70.10 2gtt s THR 354 CO 0.02 0.03 -0.23 -0.36 -0.54 0.00 0.00 174.62 173.53 2gtt s PHE 355 N 1.80 2.07 -0.01 3.99 0.40 -1.26 -5.12 117.98 119.85 2gtt s PHE 355 Ca 0.08 -0.39 -0.02 0.00 -0.60 0.00 0.00 56.93 56.00 2gtt s PHE 355 Cb -0.17 -1.29 -0.00 0.00 0.51 0.00 0.00 43.02 42.07 2gtt s PHE 355 CO 0.11 0.04 0.04 -1.83 0.70 0.00 0.00 175.22 174.28 2gtt s GLU 356 N -0.89 0.14 0.39 0.44 -1.05 -1.26 -5.13 118.70 111.35 2gtt s GLU 356 Ca 0.09 -0.10 -0.27 0.00 -0.15 0.00 0.00 54.97 54.55 2gtt s GLU 356 Cb -0.09 0.06 -0.09 0.00 -0.44 0.00 0.00 34.13 33.56 2gtt s GLU 356 CO 0.01 -0.02 1.35 1.03 0.95 0.00 0.00 175.26 178.57 2gtt s ARG 357 N -0.36 4.04 0.00 -4.83 0.52 -1.26 -4.88 118.95 112.18 2gtt s ARG 357 Ca -0.04 2.28 0.00 0.00 -0.52 0.00 0.00 55.73 57.45 2gtt s ARG 357 Cb -0.03 -2.85 0.00 0.00 0.52 0.00 0.00 34.95 32.59 2gtt s ARG 357 CO -0.00 -0.48 0.00 0.54 0.02 0.00 0.00 175.30 175.38 2gtt n ARG 358 N 0.29 4.54 -4.79 3.54 5.12 -1.26 -5.08 116.66 119.03 2gtt n ARG 358 Ca 0.03 0.00 -0.33 0.00 -1.93 0.00 0.00 57.85 55.62 2gtt n ARG 358 Cb 0.42 -0.39 -0.16 0.00 -1.16 0.00 0.00 32.46 31.18 2gtt n ARG 358 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 2gtt s PHE 359 N -0.02 2.72 0.18 -1.55 0.40 -1.26 -5.13 117.98 113.32 2gtt s PHE 359 Ca 0.00 -0.98 0.04 0.00 -0.60 0.00 0.00 56.93 55.39 2gtt s PHE 359 Cb 0.00 -1.82 -0.05 0.00 0.51 0.00 0.00 43.02 41.66 2gtt s PHE 359 CO 0.00 -0.41 -0.07 -0.06 0.70 0.00 0.00 175.22 175.37 2gtt s PHE 360 N 0.58 1.39 0.26 0.36 0.40 -1.26 -5.04 117.98 114.67 2gtt s PHE 360 Ca -0.10 -0.80 0.18 0.00 -0.60 0.00 0.00 56.93 55.60 2gtt s PHE 360 Cb -0.16 -0.74 0.78 0.00 0.51 0.00 0.00 43.02 43.40 2gtt s PHE 360 CO 0.03 0.06 1.79 0.00 0.70 0.00 0.00 175.22 177.81 2gtt h ARG 361 N 2.66 0.00 -1.81 0.44 3.08 -2.00 -3.46 114.38 113.29 2gtt h ARG 361 Ca -0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.68 2gtt h ARG 361 Cb 1.20 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 31.04 2gtt h ARG 361 CO 0.64 0.36 0.34 0.16 -1.07 0.00 0.00 179.97 180.39 2gtt s ASP 362 N -6.53 -0.54 0.43 7.04 3.84 -1.26 -5.01 116.67 114.64 2gtt s ASP 362 Ca -0.01 0.64 0.27 0.00 -0.00 0.00 0.00 52.55 53.45 2gtt s ASP 362 Cb 0.12 0.51 1.35 0.00 -1.38 0.00 0.00 42.92 43.53 2gtt s ASP 362 CO 0.69 -0.46 1.66 1.05 -0.00 0.00 0.00 175.17 178.10 2gtt h GLU 363 N 2.99 0.15 -0.27 2.11 9.09 -1.99 0.63 114.58 127.29 2gtt h GLU 363 Ca -0.24 -0.01 -0.10 0.00 0.05 0.00 0.00 59.36 59.06 2gtt h GLU 363 Cb 1.15 -0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 28.20 2gtt h GLU 363 CO 0.33 0.10 -0.27 0.87 0.05 0.00 0.00 179.01 180.08 2gtt h LYS 364 N 0.15 0.53 -0.22 1.06 1.57 -1.99 -1.05 116.57 116.62 2gtt h LYS 364 Ca 0.77 -0.21 -0.16 0.00 -1.87 0.00 0.00 60.65 59.18 2gtt h LYS 364 Cb 2.33 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 34.61 2gtt h LYS 364 CO -0.40 0.75 -0.52 1.49 -0.57 0.00 0.00 179.45 180.20 2gtt h GLU 365 N 0.46 0.64 -0.18 3.15 4.81 -0.15 -2.27 114.58 121.05 2gtt h GLU 365 Ca 0.06 -0.39 -0.07 0.00 -0.13 0.00 0.00 59.36 58.83 2gtt h GLU 365 Cb 0.71 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.12 2gtt h GLU 365 CO 0.05 1.00 -0.22 1.25 -0.73 0.00 0.00 179.01 180.37 2gtt h LEU 366 N 0.49 0.31 0.92 1.64 6.46 -1.12 -2.92 115.31 121.09 2gtt h LEU 366 Ca 0.02 -0.09 -0.05 0.00 -0.12 0.00 0.00 57.88 57.64 2gtt h LEU 366 Cb 1.07 -0.08 0.01 0.00 -0.73 0.00 0.00 40.66 40.93 2gtt h LEU 366 CO 0.10 0.54 -0.44 1.56 -0.62 0.00 0.00 178.44 179.58 2gtt h GLN 367 N 0.29 -1.19 -1.19 1.25 1.08 -0.64 0.21 115.11 114.91 2gtt h GLN 367 Ca 0.05 0.08 0.34 0.00 -1.45 0.00 0.00 58.65 57.67 2gtt h GLN 367 Cb 0.55 0.27 -0.09 0.00 -0.05 0.00 0.00 27.48 28.16 2gtt h GLN 367 CO 0.04 -0.79 0.79 0.93 -0.95 0.00 0.00 178.83 178.85 2gtt h GLU 368 N -1.30 0.20 0.00 1.46 5.08 -1.26 2.34 114.58 121.11 2gtt h GLU 368 Ca -0.13 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 2gtt h GLU 368 Cb 0.95 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.15 2gtt h GLU 368 CO 0.21 0.13 -0.44 -0.92 -1.00 0.00 0.00 179.01 176.99 2gtt h TYR 369 N 0.20 0.00 -0.65 4.33 3.20 -1.34 -2.65 116.97 120.07 2gtt h TYR 369 Ca 0.66 0.00 0.24 0.00 3.14 0.00 0.00 58.73 62.77 2gtt h TYR 369 Cb 2.06 0.00 -0.09 0.00 1.54 0.00 0.00 36.73 40.24 2gtt h TYR 369 CO -0.00 0.00 0.39 0.39 -1.64 0.00 0.00 178.16 177.30 2gtt n GLU 370 N -2.29 -0.03 0.00 1.82 1.02 0.79 -3.68 120.64 118.28 2gtt n GLU 370 Ca 0.04 0.71 0.00 0.00 -0.02 0.00 0.00 57.16 57.89 2gtt n GLU 370 Cb 0.45 -1.34 0.00 0.00 -0.02 0.00 0.00 31.44 30.53 2gtt n GLU 370 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2gtt n ALA 371 N -2.58 0.00 0.35 0.62 0.00 -1.26 -5.03 120.51 112.61 2gtt n ALA 371 Ca 0.21 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.73 2gtt n ALA 371 Cb 0.78 0.00 0.22 0.00 0.00 0.00 0.00 19.45 20.45 2gtt n ALA 371 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gtt n ALA 372 N 0.00 2.53 -1.34 0.00 0.00 -1.00 -3.90 120.51 116.81 2gtt n ALA 372 Ca 0.00 -0.91 -0.34 0.00 0.00 0.00 0.00 53.44 52.19 2gtt n ALA 372 Cb 0.00 -0.97 0.09 0.00 0.00 0.00 0.00 19.45 18.56 2gtt n ALA 372 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2gtt n GLU 373 N 0.89 2.67 0.00 0.00 -0.00 -1.26 -4.49 120.64 118.45 2gtt n GLU 373 Ca 0.17 -3.29 0.12 0.00 -0.00 0.00 0.00 57.16 54.16 2gtt n GLU 373 Cb 0.47 -2.28 0.09 0.00 -0.00 0.00 0.00 31.44 29.72 2gtt n GLU 373 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2gtt n LEU 374 N -0.93 2.68 -1.38 -1.84 4.77 -1.25 -5.24 117.00 113.79 2gtt n LEU 374 Ca 0.62 -0.91 0.10 0.00 -0.03 0.00 0.00 56.01 55.79 2gtt n LEU 374 Cb 0.75 -0.00 0.32 0.00 -2.33 0.00 0.00 43.42 42.16 2gtt n LEU 374 CO 0.77 0.46 0.77 0.41 -1.33 0.00 0.00 177.39 178.47 2gtt n THR 375 N 0.93 1.32 -5.16 -5.08 -1.04 -1.26 -5.26 114.28 98.73 2gtt n THR 375 Ca 0.13 -1.00 -0.32 0.00 -2.04 0.00 0.00 64.05 60.82 2gtt n THR 375 Cb 0.56 0.26 -0.17 0.00 -1.82 0.00 0.00 70.33 69.16 2gtt n THR 375 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2gtt s GLU 398 N -1.48 3.06 0.00 -2.82 -6.30 -1.26 -5.20 118.70 104.70 2gtt s GLU 398 Ca 0.46 -0.87 0.00 0.00 -2.50 0.00 0.00 54.97 52.06 2gtt s GLU 398 Cb 0.27 -2.32 0.00 0.00 0.00 0.00 0.00 34.13 32.08 2gtt s GLU 398 CO 0.27 0.17 0.00 -2.37 0.02 0.00 0.00 175.26 173.34 2gtt n THR 399 N 3.56 0.00 -3.36 -1.70 5.66 -1.26 -4.89 114.28 112.30 2gtt n THR 399 Ca -0.19 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.42 2gtt n THR 399 Cb 0.53 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.23 2gtt n THR 399 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 2gtt s ARG 400 N 0.00 4.14 -0.11 1.09 3.52 -1.26 -4.88 118.95 121.45 2gtt s ARG 400 Ca 0.00 0.21 -0.30 0.00 -0.13 0.00 0.00 55.73 55.52 2gtt s ARG 400 Cb 0.00 -3.57 0.11 0.00 -1.56 0.00 0.00 34.95 29.93 2gtt s ARG 400 CO 0.00 -0.12 0.93 -1.54 -0.81 0.00 0.00 175.30 173.76 2gtt s SER 401 N 1.20 -0.40 0.19 -2.12 1.04 -1.26 -5.01 113.70 107.34 2gtt s SER 401 Ca 0.19 0.33 -0.11 0.00 0.48 0.00 0.00 55.95 56.85 2gtt s SER 401 Cb -0.15 0.35 0.11 0.00 0.10 0.00 0.00 66.02 66.44 2gtt s SER 401 CO 0.09 -0.45 1.79 -0.65 0.98 0.00 0.00 173.24 175.00 2gtt h PRO 402 N 2.46 0.96 -0.62 4.02 0.11 -1.95 -0.83 132.00 136.15 2gtt h PRO 402 Ca -0.20 -0.13 0.13 0.00 0.11 0.00 0.00 66.00 65.91 2gtt h PRO 402 Cb 1.18 -0.18 -0.11 0.00 0.11 0.00 0.00 31.00 32.00 2gtt h PRO 402 CO 0.32 0.74 -0.01 0.93 -0.21 0.00 0.00 178.00 179.77 2gtt h GLU 403 N 0.93 0.10 0.73 1.05 3.07 -1.96 -1.50 114.58 117.00 2gtt h GLU 403 Ca 0.24 -0.01 -0.04 0.00 -0.50 0.00 0.00 59.36 59.05 2gtt h GLU 403 Cb 0.08 -0.02 0.01 0.00 -0.84 0.00 0.00 28.75 27.98 2gtt h GLU 403 CO -0.03 0.07 -0.35 0.00 -1.40 0.00 0.00 179.01 177.30 2gtt h ALA 404 N 1.57 -0.98 -0.38 3.43 0.00 -1.60 -2.76 119.26 118.54 2gtt h ALA 404 Ca 0.32 -0.21 0.08 0.00 0.00 0.00 0.00 54.91 55.10 2gtt h ALA 404 Cb 0.52 0.38 -0.07 0.00 0.00 0.00 0.00 17.79 18.62 2gtt h ALA 404 CO -0.54 -0.91 -0.11 0.28 0.00 0.00 0.00 179.25 177.97 2gtt h VAL 405 N -1.25 0.60 -0.10 0.00 2.07 -1.04 -0.99 116.25 115.54 2gtt h VAL 405 Ca -0.10 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.46 2gtt h VAL 405 Cb 0.75 0.60 -0.06 0.00 -1.52 0.00 0.00 31.29 31.06 2gtt h VAL 405 CO 0.16 0.00 -0.28 0.22 0.02 0.00 0.00 177.57 177.69 2gtt h TYR 406 N -0.02 -0.77 -0.29 1.57 3.20 -1.32 0.21 116.97 119.56 2gtt h TYR 406 Ca 0.18 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.10 2gtt h TYR 406 Cb 0.30 0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.91 2gtt h TYR 406 CO -0.35 -0.37 0.19 1.79 -1.64 0.00 0.00 178.16 177.79 2gtt h THR 407 N -0.37 1.05 -0.53 1.81 1.35 -1.11 0.12 112.91 115.23 2gtt h THR 407 Ca 0.09 -0.12 -0.05 0.00 -0.55 0.00 0.00 66.41 65.79 2gtt h THR 407 Cb 0.51 0.67 -0.02 0.00 -1.73 0.00 0.00 68.15 67.58 2gtt h THR 407 CO -0.31 0.06 0.15 -0.09 -0.25 0.00 0.00 175.52 175.08 2gtt h ARG 408 N 0.34 0.83 -0.93 4.72 2.43 0.32 -1.80 114.38 120.29 2gtt h ARG 408 Ca 0.11 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 2gtt h ARG 408 Cb 0.03 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.42 2gtt h ARG 408 CO -0.02 0.77 0.55 0.82 -1.51 0.00 0.00 179.97 180.58 2gtt h ILE 409 N 0.73 1.26 -0.09 1.20 2.04 0.19 -2.88 117.51 119.95 2gtt h ILE 409 Ca 0.17 -0.58 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 2gtt h ILE 409 Cb 0.30 -0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.34 2gtt h ILE 409 CO -0.00 0.27 0.03 0.24 0.00 0.00 0.00 178.15 178.69 2gtt h MET 410 N 1.29 0.13 0.00 2.37 2.86 -0.73 -2.53 114.93 118.31 2gtt h MET 410 Ca 0.33 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.94 2gtt h MET 410 Cb -0.04 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.60 2gtt h MET 410 CO -0.06 0.29 0.08 -1.33 1.06 0.00 0.00 176.91 176.95 2gtt n MET 411 N -4.91 0.00 -0.12 1.72 2.81 -0.71 0.17 117.12 116.08 2gtt n MET 411 Ca -0.06 0.16 0.09 0.00 -1.81 0.00 0.00 57.70 56.07 2gtt n MET 411 Cb 0.14 -1.58 0.12 0.00 -0.71 0.00 0.00 33.22 31.19 2gtt n MET 411 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2gtt n ASN 412 N -1.07 2.07 0.00 7.83 4.13 -0.98 -4.97 115.26 122.27 2gtt n ASN 412 Ca 0.00 -2.94 0.00 0.00 1.68 0.00 0.00 54.58 53.32 2gtt n ASN 412 Cb 0.08 -0.40 0.00 0.00 -1.54 0.00 0.00 39.78 37.92 2gtt n ASN 412 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2gtt n GLY 413 N -1.26 0.34 1.13 7.41 0.00 0.13 -2.34 105.19 110.60 2gtt n GLY 413 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2gtt n GLY 413 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gtt n GLY 414 N -1.78 0.99 3.15 -0.02 0.00 -1.09 -5.02 105.19 101.42 2gtt n GLY 414 Ca 0.00 -0.53 -0.28 0.00 0.00 0.00 0.00 46.02 45.21 2gtt n GLY 414 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2gtt s ARG 415 N -2.39 2.19 0.27 1.61 3.52 -0.99 -5.00 118.95 118.15 2gtt s ARG 415 Ca 0.00 -0.67 -0.29 0.00 -0.13 0.00 0.00 55.73 54.64 2gtt s ARG 415 Cb 0.00 -1.79 -0.15 0.00 -1.56 0.00 0.00 34.95 31.45 2gtt s ARG 415 CO 0.00 0.20 0.96 1.28 -0.81 0.00 0.00 175.30 176.93 2gtt n LEU 416 N 3.37 1.38 -4.79 -0.88 4.32 -1.26 -4.91 117.00 114.22 2gtt n LEU 416 Ca -0.19 1.17 -0.34 0.00 -0.02 0.00 0.00 56.01 56.63 2gtt n LEU 416 Cb 0.53 -1.24 -0.00 0.00 -1.62 0.00 0.00 43.42 41.08 2gtt n LEU 416 CO 0.26 -1.59 0.73 -0.54 -1.22 0.00 0.00 177.39 175.03 2gtt s LYS 417 N -1.36 3.45 0.59 3.23 1.02 -1.26 -4.92 119.74 120.50 2gtt s LYS 417 Ca 0.61 1.35 0.34 0.00 0.02 0.00 0.00 55.97 58.29 2gtt s LYS 417 Cb -0.75 -2.04 1.84 0.00 -0.52 0.00 0.00 37.83 36.36 2gtt s LYS 417 CO 0.59 -0.72 2.20 0.00 -0.92 0.00 0.00 175.35 176.50 2gtt h ARG 418 N 0.94 0.00 -0.09 1.68 3.08 -2.01 -1.48 114.38 116.50 2gtt h ARG 418 Ca -0.48 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.56 2gtt h ARG 418 Cb 1.23 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.28 2gtt h ARG 418 CO 0.58 0.04 0.03 0.77 -1.07 0.00 0.00 179.97 180.31 2gtt h SER 419 N 0.00 0.14 -0.13 7.04 0.02 -2.00 -2.00 113.55 116.62 2gtt h SER 419 Ca -0.00 -0.21 0.04 0.00 -0.84 0.00 0.00 61.79 60.78 2gtt h SER 419 Cb 0.17 -0.04 -0.07 0.00 0.14 0.00 0.00 62.40 62.61 2gtt h SER 419 CO 0.01 0.31 -0.48 0.45 -1.14 0.00 0.00 176.83 175.97 2gtt h HIS 420 N -0.04 -1.41 -0.38 3.45 3.86 -1.64 -2.10 115.15 116.89 2gtt h HIS 420 Ca 0.03 0.05 0.07 0.00 -1.16 0.00 0.00 60.37 59.37 2gtt h HIS 420 Cb 0.22 0.63 -0.07 0.00 1.06 0.00 0.00 27.41 29.26 2gtt h HIS 420 CO -0.00 -0.51 -0.08 0.82 0.86 0.00 0.00 177.93 179.02 2gtt h ILE 421 N -0.54 0.64 -0.79 2.45 2.04 -1.47 -0.60 117.51 119.23 2gtt h ILE 421 Ca 0.06 -0.01 0.18 0.00 1.00 0.00 0.00 64.86 66.09 2gtt h ILE 421 Cb 0.66 0.62 -0.12 0.00 -0.74 0.00 0.00 36.82 37.24 2gtt h ILE 421 CO -0.42 0.00 0.23 0.03 0.00 0.00 0.00 178.15 177.99 2gtt h ARG 422 N 0.02 0.29 -0.00 2.37 3.08 -0.84 -0.03 114.38 119.27 2gtt h ARG 422 Ca 0.18 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.21 2gtt h ARG 422 Cb 0.28 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 2gtt h ARG 422 CO -0.38 0.19 -0.00 -0.09 -1.07 0.00 0.00 179.97 178.62 2gtt h ARG 423 N 0.29 0.01 -0.32 0.04 9.65 -0.52 0.62 114.38 124.15 2gtt h ARG 423 Ca 0.47 -0.00 0.05 0.00 -1.10 0.00 0.00 59.98 59.40 2gtt h ARG 423 Cb 0.83 -0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 29.37 2gtt h ARG 423 CO -0.54 0.37 0.02 1.88 2.80 0.00 0.00 179.97 184.51 2gtt h TYR 424 N -0.36 0.02 -0.08 2.20 0.05 -0.80 0.11 116.97 118.11 2gtt h TYR 424 Ca 0.00 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.80 2gtt h TYR 424 Cb 0.37 0.04 -0.00 0.00 1.01 0.00 0.00 36.73 38.14 2gtt h TYR 424 CO 0.05 -0.03 0.05 0.28 -1.05 0.00 0.00 178.16 177.46 2gtt h VAL 425 N 0.12 1.06 -0.86 -2.88 2.07 -0.97 -1.47 116.25 113.31 2gtt h VAL 425 Ca 0.15 -0.15 0.12 0.00 0.82 0.00 0.00 66.70 67.64 2gtt h VAL 425 Cb 0.19 1.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.91 2gtt h VAL 425 CO -0.24 0.05 0.56 -1.28 0.02 0.00 0.00 177.57 176.68 2gtt h SER 426 N 0.07 0.70 0.72 0.57 0.87 -0.17 0.91 113.55 117.22 2gtt h SER 426 Ca 0.03 0.03 -0.23 0.00 -1.23 0.00 0.00 61.79 60.39 2gtt h SER 426 Cb 0.04 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 2gtt h SER 426 CO -0.01 0.39 -1.03 0.58 -0.53 0.00 0.00 176.83 176.23 2gtt h VAL 427 N 0.76 1.56 0.10 2.23 2.07 -0.61 -3.36 116.25 119.01 2gtt h VAL 427 Ca 0.41 -3.00 -0.34 0.00 0.82 0.00 0.00 66.70 64.59 2gtt h VAL 427 Cb 0.55 2.73 -0.02 0.00 -1.52 0.00 0.00 31.29 33.04 2gtt h VAL 427 CO -0.18 0.87 -1.89 0.77 0.02 0.00 0.00 177.57 177.16 2gtt h SER 428 N 0.06 0.34 -0.81 0.57 4.64 -0.17 -3.39 113.55 114.79 2gtt h SER 428 Ca -0.06 -0.72 0.15 0.00 -0.47 0.00 0.00 61.79 60.69 2gtt h SER 428 Cb 1.73 -0.11 -0.10 0.00 -0.31 0.00 0.00 62.40 63.62 2gtt h SER 428 CO 0.16 1.64 0.38 0.77 -0.87 0.00 0.00 176.83 178.90 2gtt h SER 429 N 0.06 0.41 -2.47 4.97 4.64 0.66 -2.93 113.55 118.90 2gtt h SER 429 Ca -0.38 0.10 -0.70 0.00 -0.47 0.00 0.00 61.79 60.34 2gtt h SER 429 Cb 2.03 0.05 -0.35 0.00 -0.31 0.00 0.00 62.40 63.82 2gtt h SER 429 CO 0.10 0.16 0.11 -0.46 -0.87 0.00 0.00 176.83 175.87 2gtt n ASN 430 N -4.94 5.31 -3.86 4.97 0.23 -1.26 -4.96 115.26 110.76 2gtt n ASN 430 Ca 0.16 -3.50 -0.11 0.00 -0.53 0.00 0.00 54.58 50.59 2gtt n ASN 430 Cb 0.44 -0.94 -0.10 0.00 -2.08 0.00 0.00 39.78 37.10 2gtt n ASN 430 CO 0.00 0.00 0.00 -2.28 -0.93 0.00 0.00 177.26 174.05 2gtt s HIS 431 N -2.99 0.02 -1.00 -2.53 2.46 -1.11 -5.01 115.29 105.12 2gtt s HIS 431 Ca 0.38 -0.07 -0.25 0.00 0.47 0.00 0.00 55.06 55.59 2gtt s HIS 431 Cb 0.14 -0.03 -0.13 0.00 -0.13 0.00 0.00 32.58 32.43 2gtt s HIS 431 CO -0.00 -0.27 2.10 -1.14 -2.47 0.00 0.00 174.74 172.96 2gtt s GLN 432 N -1.22 1.95 -0.09 2.88 2.00 -1.26 -4.89 119.66 119.03 2gtt s GLN 432 Ca -0.13 -0.38 -0.35 0.00 -2.00 0.00 0.00 55.36 52.51 2gtt s GLN 432 Cb -0.07 -5.02 -0.12 0.00 0.80 0.00 0.00 33.01 28.60 2gtt s GLN 432 CO 0.01 -4.36 1.85 0.00 -0.50 0.00 0.00 175.29 172.30 2gtt n ALA 433 N 16.71 0.81 -2.10 1.58 0.00 -1.26 -4.98 120.51 131.28 2gtt n ALA 433 Ca 0.43 0.30 -0.23 0.00 0.00 0.00 0.00 53.44 53.95 2gtt n ALA 433 Cb 0.46 -2.47 0.03 0.00 0.00 0.00 0.00 19.45 17.48 2gtt n ALA 433 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2gtt s ARG 434 N 3.80 2.72 0.00 0.00 0.52 -1.26 -4.95 118.95 119.78 2gtt s ARG 434 Ca 0.92 -0.51 0.00 0.00 -0.52 0.00 0.00 55.73 55.62 2gtt s ARG 434 Cb -0.72 -2.44 0.00 0.00 0.52 0.00 0.00 34.95 32.31 2gtt s ARG 434 CO 0.52 -0.64 0.19 -2.30 0.02 0.00 0.00 175.30 173.09 2gtt n PRO 435 N -2.37 0.00 -1.34 3.54 -0.02 -1.26 -3.53 135.00 130.02 2gtt n PRO 435 Ca 0.05 0.19 -0.28 0.00 -2.02 0.00 0.00 63.50 61.44 2gtt n PRO 435 Cb 0.59 -0.66 0.11 0.00 -0.02 0.00 0.00 33.50 33.51 2gtt n PRO 435 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2gtt n ASN 436 N -0.39 5.89 -4.89 2.55 3.02 -1.26 -4.81 115.26 115.37 2gtt n ASN 436 Ca 0.00 -3.74 -0.29 0.00 -0.03 0.00 0.00 54.58 50.52 2gtt n ASN 436 Cb 0.00 -0.84 0.01 0.00 -0.61 0.00 0.00 39.78 38.34 2gtt n ASN 436 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2gtt s SER 437 N -1.98 6.21 0.34 6.41 1.04 -1.23 -2.02 113.70 122.47 2gtt s SER 437 Ca 0.59 1.12 0.07 0.00 0.48 0.00 0.00 55.95 58.21 2gtt s SER 437 Cb 0.48 -2.31 0.75 0.00 0.10 0.00 0.00 66.02 65.04 2gtt s SER 437 CO 0.03 -0.72 1.87 -0.26 0.98 0.00 0.00 173.24 175.14 2gtt h PHE 438 N -0.02 0.88 0.01 5.02 -1.00 -1.39 -1.28 116.94 119.16 2gtt h PHE 438 Ca -0.46 0.03 0.03 0.00 2.81 0.00 0.00 57.97 60.37 2gtt h PHE 438 Cb 1.20 -0.28 -0.06 0.00 3.61 0.00 0.00 35.95 40.43 2gtt h PHE 438 CO 0.61 0.35 -0.46 0.00 -1.61 0.00 0.00 178.31 177.19 2gtt h ALA 439 N 1.58 -0.78 0.15 2.45 0.00 -1.43 0.11 119.26 121.34 2gtt h ALA 439 Ca 0.44 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2gtt h ALA 439 Cb 0.62 0.82 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 2gtt h ALA 439 CO -0.20 -1.02 -0.32 1.49 0.00 0.00 0.00 179.25 179.20 2gtt h GLU 440 N -0.62 -0.49 -0.96 0.00 4.81 -1.46 -0.76 114.58 115.09 2gtt h GLU 440 Ca 0.03 0.03 0.30 0.00 -0.13 0.00 0.00 59.36 59.60 2gtt h GLU 440 Cb 0.69 0.11 -0.15 0.00 0.63 0.00 0.00 28.75 30.03 2gtt h GLU 440 CO -0.33 -0.33 0.42 0.35 -0.73 0.00 0.00 179.01 178.39 2gtt h PHE 441 N -0.51 0.66 -0.32 0.92 3.57 -1.15 0.89 116.94 121.00 2gtt h PHE 441 Ca -0.02 0.04 -0.13 0.00 3.53 0.00 0.00 57.97 61.40 2gtt h PHE 441 Cb 0.49 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 2gtt h PHE 441 CO -0.33 -0.24 -0.32 -0.07 -2.23 0.00 0.00 178.31 175.12 2gtt h LEU 442 N 0.23 0.71 -0.38 0.59 3.38 -0.23 -1.35 115.31 118.26 2gtt h LEU 442 Ca 0.68 -0.29 -0.09 0.00 0.09 0.00 0.00 57.88 58.27 2gtt h LEU 442 Cb 1.53 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.07 2gtt h LEU 442 CO -0.66 0.98 -0.44 -1.13 0.09 0.00 0.00 178.44 177.27 2gtt h ASN 443 N 0.58 0.00 0.12 -0.43 -1.24 0.20 -2.80 115.58 112.01 2gtt h ASN 443 Ca 0.06 0.00 -0.28 0.00 0.71 0.00 0.00 56.30 56.79 2gtt h ASN 443 Cb 0.83 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.88 2gtt h ASN 443 CO 0.07 0.44 -1.44 0.11 -1.29 0.00 0.00 177.43 175.32 2gtt h LYS 444 N 0.00 0.25 0.03 6.67 1.79 0.02 -3.42 116.57 121.91 2gtt h LYS 444 Ca -0.00 -0.42 -0.00 0.00 -2.18 0.00 0.00 60.65 58.04 2gtt h LYS 444 Cb 1.19 0.16 0.00 0.00 -1.58 0.00 0.00 32.23 32.00 2gtt h LYS 444 CO 0.06 1.20 -0.01 1.79 -1.08 0.00 0.00 179.45 181.40 2gtt h THR 445 N -0.28 1.38 -3.20 -0.16 1.35 -1.32 -3.43 112.91 107.25 2gtt h THR 445 Ca -0.31 -1.74 -0.61 0.00 -0.55 0.00 0.00 66.41 63.20 2gtt h THR 445 Cb 1.78 2.48 -0.12 0.00 -1.73 0.00 0.00 68.15 70.55 2gtt h THR 445 CO 0.06 0.42 -0.50 -0.31 -0.25 0.00 0.00 175.52 174.94 2gtt s TYR 446 N -2.84 3.41 -0.22 4.73 1.51 -1.06 -4.97 117.35 117.92 2gtt s TYR 446 Ca -0.16 0.32 0.02 0.00 -1.01 0.00 0.00 57.07 56.24 2gtt s TYR 446 Cb -0.01 -2.12 0.08 0.00 -0.11 0.00 0.00 41.96 39.80 2gtt s TYR 446 CO 0.59 0.33 0.93 0.43 -1.11 0.00 0.00 175.55 176.72 2gtt n SER 447 N 3.33 -0.84 0.00 2.29 7.64 -1.26 -4.45 113.62 120.33 2gtt n SER 447 Ca -0.17 -1.51 0.00 0.00 1.01 0.00 0.00 58.87 58.20 2gtt n SER 447 Cb 0.52 0.67 0.00 0.00 -1.01 0.00 0.00 64.21 64.40 2gtt n SER 447 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83