#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h1h n GLY 20 N 0.00 -1.91 2.66 -1.23 0.00 -1.26 -4.95 105.19 98.50 3h1h n GLY 20 Ca 0.00 1.03 -0.03 0.00 0.00 0.00 0.00 46.02 47.01 3h1h n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1h n ALA 21 N 0.00 -2.89 -1.99 4.61 0.00 -1.26 -5.17 120.51 113.81 3h1h n ALA 21 Ca 0.00 -0.42 -0.24 0.00 0.00 0.00 0.00 53.44 52.77 3h1h n ALA 21 Cb 0.00 -2.55 0.12 0.00 0.00 0.00 0.00 19.45 17.03 3h1h n ALA 21 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3h1h s GLU 22 N 0.04 1.48 0.00 0.00 2.56 -1.26 -5.07 118.70 116.45 3h1h s GLU 22 Ca 0.16 -1.07 0.00 0.00 0.00 0.00 0.00 54.97 54.06 3h1h s GLU 22 Cb 0.24 -2.26 0.00 0.00 2.00 0.00 0.00 34.13 34.10 3h1h s GLU 22 CO -0.15 -1.62 0.05 -0.40 -0.56 0.00 0.00 175.26 172.57 3h1h n ASP 23 N -2.98 0.09 -0.64 -1.70 5.68 -1.26 -5.11 116.55 110.64 3h1h n ASP 23 Ca 0.16 -0.42 0.00 0.00 -0.50 0.00 0.00 54.79 54.03 3h1h n ASP 23 Cb 0.60 0.19 0.00 0.00 -1.14 0.00 0.00 41.12 40.78 3h1h n ASP 23 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 3h1h n LEU 24 N -0.19 -0.85 -4.90 -2.12 7.94 -1.26 -5.10 117.00 110.51 3h1h n LEU 24 Ca 0.00 0.00 -0.29 0.00 -1.11 0.00 0.00 56.01 54.61 3h1h n LEU 24 Cb 0.06 -0.43 0.12 0.00 0.53 0.00 0.00 43.42 43.71 3h1h n LEU 24 CO 0.00 0.00 0.81 -1.61 -1.11 0.00 0.00 177.39 175.48 3h1h s GLU 25 N -0.30 1.47 -0.34 1.96 2.02 -1.15 -4.91 118.70 117.45 3h1h s GLU 25 Ca 0.00 -0.04 -0.07 0.00 0.02 0.00 0.00 54.97 54.88 3h1h s GLU 25 Cb 0.00 -1.91 0.19 0.00 0.10 0.00 0.00 34.13 32.52 3h1h s GLU 25 CO 0.00 -1.91 1.02 -1.50 0.02 0.00 0.00 175.26 172.89 3h1h s ILE 26 N -3.65 -0.28 1.06 -1.63 2.07 -1.26 -2.58 121.20 114.93 3h1h s ILE 26 Ca 0.66 -0.07 -0.17 0.00 -1.41 0.00 0.00 60.65 59.65 3h1h s ILE 26 Cb -0.09 0.00 0.24 0.00 0.13 0.00 0.00 42.46 42.73 3h1h s ILE 26 CO 0.51 0.00 1.23 -0.89 -1.91 0.00 0.00 174.94 173.88 3h1h s THR 27 N 1.69 1.83 -0.49 4.00 2.01 -0.63 -4.86 115.64 119.21 3h1h s THR 27 Ca 0.17 0.00 0.06 0.00 0.31 0.00 0.00 61.69 62.24 3h1h s THR 27 Cb 0.05 -2.79 0.21 0.00 0.01 0.00 0.00 72.50 69.98 3h1h s THR 27 CO -0.13 0.00 0.74 1.17 -0.69 0.00 0.00 174.62 175.71 3h1h n LYS 28 N -4.18 0.62 -0.50 4.92 4.81 -1.26 -2.20 118.16 120.37 3h1h n LYS 28 Ca 0.14 -2.14 -0.17 0.00 -0.87 0.00 0.00 58.31 55.28 3h1h n LYS 28 Cb 0.59 -1.46 0.01 0.00 0.02 0.00 0.00 35.03 34.19 3h1h n LYS 28 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3h1h n LEU 29 N 2.27 -1.47 -0.09 3.14 4.77 -1.18 -4.74 117.00 119.71 3h1h n LEU 29 Ca 0.16 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.05 3h1h n LEU 29 Cb 0.58 -0.26 -0.02 0.00 -2.33 0.00 0.00 43.42 41.39 3h1h n LEU 29 CO 0.03 -1.26 0.98 -0.65 -1.33 0.00 0.00 177.39 175.16 3h1h h PRO 30 N -0.61 0.40 0.00 3.23 0.11 -2.02 -3.10 132.00 130.02 3h1h h PRO 30 Ca -0.17 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.91 3h1h h PRO 30 Cb 0.61 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.63 3h1h h PRO 30 CO 0.09 0.30 0.00 0.27 -0.21 0.00 0.00 178.00 178.45 3h1h n ASN 31 N -4.86 0.00 0.00 -2.05 2.04 -1.26 -4.86 115.26 104.27 3h1h n ASN 31 Ca -0.02 -0.24 0.00 0.00 -0.44 0.00 0.00 54.58 53.89 3h1h n ASN 31 Cb 0.05 -0.15 0.00 0.00 -2.53 0.00 0.00 39.78 37.15 3h1h n ASN 31 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3h1h n GLY 32 N 0.10 0.54 3.57 4.83 0.00 -1.17 -4.02 105.19 109.04 3h1h n GLY 32 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 3h1h n GLY 32 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h1h s LEU 33 N 0.00 3.34 0.24 0.99 2.96 -1.00 -4.45 118.68 120.77 3h1h s LEU 33 Ca 0.00 -0.03 -0.30 0.00 -0.22 0.00 0.00 54.13 53.58 3h1h s LEU 33 Cb 0.00 -2.93 -0.09 0.00 0.50 0.00 0.00 46.19 43.67 3h1h s LEU 33 CO 0.00 -1.67 1.11 -0.63 -1.32 0.00 0.00 176.35 173.84 3h1h s ILE 34 N 5.54 3.60 -0.29 6.68 1.01 -1.17 -3.09 121.20 133.48 3h1h s ILE 34 Ca 0.43 1.52 0.01 0.00 0.00 0.00 0.00 60.65 62.61 3h1h s ILE 34 Cb -0.08 -3.97 0.09 0.00 0.01 0.00 0.00 42.46 38.51 3h1h s ILE 34 CO 0.22 0.32 0.03 -0.63 0.00 0.00 0.00 174.94 174.88 3h1h s ILE 35 N -0.79 1.58 0.17 2.92 1.01 -0.93 -1.10 121.20 124.06 3h1h s ILE 35 Ca 0.47 -1.66 -0.00 0.00 0.00 0.00 0.00 60.65 59.46 3h1h s ILE 35 Cb -0.31 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.06 3h1h s ILE 35 CO 0.39 -0.45 0.35 0.00 0.00 0.00 0.00 174.94 175.23 3h1h s ALA 36 N 1.30 3.87 0.13 9.38 0.00 -1.25 -1.60 121.76 133.59 3h1h s ALA 36 Ca 0.05 -0.85 -0.22 0.00 0.00 0.00 0.00 51.96 50.94 3h1h s ALA 36 Cb -0.18 -1.94 0.06 0.00 0.00 0.00 0.00 23.12 21.05 3h1h s ALA 36 CO -0.13 0.51 0.55 0.45 0.00 0.00 0.00 175.76 177.14 3h1h s SER 37 N -3.07 -0.48 -0.30 0.00 0.15 -1.07 -2.66 113.70 106.28 3h1h s SER 37 Ca 0.37 -0.02 -0.09 0.00 0.70 0.00 0.00 55.95 56.91 3h1h s SER 37 Cb -0.11 0.55 0.18 0.00 -1.71 0.00 0.00 66.02 64.93 3h1h s SER 37 CO 0.28 -0.89 0.93 -0.22 1.20 0.00 0.00 173.24 174.54 3h1h s LEU 38 N -2.59 -0.72 -0.44 3.45 2.96 -1.19 -2.92 118.68 117.23 3h1h s LEU 38 Ca 0.00 0.39 -0.25 0.00 -0.22 0.00 0.00 54.13 54.06 3h1h s LEU 38 Cb -0.00 1.58 0.02 0.00 0.50 0.00 0.00 46.19 48.29 3h1h s LEU 38 CO -0.10 -0.13 0.89 -0.70 -1.32 0.00 0.00 176.35 174.98 3h1h s GLU 39 N 2.93 3.56 -0.15 1.98 2.56 -1.21 -1.04 118.70 127.32 3h1h s GLU 39 Ca 0.07 0.16 0.16 0.00 0.00 0.00 0.00 54.97 55.36 3h1h s GLU 39 Cb -0.11 -3.91 0.49 0.00 2.00 0.00 0.00 34.13 32.60 3h1h s GLU 39 CO -0.15 -1.15 1.39 0.27 -0.56 0.00 0.00 175.26 175.06 3h1h n ASN 40 N 7.00 3.69 -2.44 -1.70 6.94 -1.26 -4.69 115.26 122.79 3h1h n ASN 40 Ca 0.05 -2.83 -0.10 0.00 -0.02 0.00 0.00 54.58 51.68 3h1h n ASN 40 Cb 0.48 -0.48 -0.01 0.00 -2.36 0.00 0.00 39.78 37.41 3h1h n ASN 40 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 3h1h n PHE 41 N -0.33 -1.50 -2.49 -2.53 3.01 -1.26 -4.94 117.46 107.42 3h1h n PHE 41 Ca 0.19 0.00 -0.38 0.00 1.01 0.00 0.00 57.45 58.27 3h1h n PHE 41 Cb 0.80 -2.48 -0.04 0.00 -0.01 0.00 0.00 39.48 37.75 3h1h n PHE 41 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 3h1h s SER 42 N -2.02 6.99 0.00 4.37 0.15 -1.26 -4.87 113.70 117.05 3h1h s SER 42 Ca 0.00 2.17 0.03 0.00 0.70 0.00 0.00 55.95 58.85 3h1h s SER 42 Cb 0.00 -2.61 0.17 0.00 -1.71 0.00 0.00 66.02 61.87 3h1h s SER 42 CO 0.00 -0.33 0.72 -0.81 1.20 0.00 0.00 173.24 174.02 3h1h n PRO 43 N 0.55 0.08 -3.95 5.44 -0.04 -1.26 -4.58 135.00 131.24 3h1h n PRO 43 Ca 0.02 0.06 -0.12 0.00 -0.04 0.00 0.00 63.50 63.42 3h1h n PRO 43 Cb 0.47 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.30 3h1h n PRO 43 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h1h s ALA 44 N -2.14 0.13 0.43 0.55 0.00 -1.26 -3.16 121.76 116.32 3h1h s ALA 44 Ca 0.04 -0.25 0.02 0.00 0.00 0.00 0.00 51.96 51.78 3h1h s ALA 44 Cb 0.02 0.03 0.06 0.00 0.00 0.00 0.00 23.12 23.23 3h1h s ALA 44 CO 0.04 -0.03 0.44 0.43 0.00 0.00 0.00 175.76 176.64 3h1h n SER 45 N 2.55 0.83 -2.66 0.00 7.64 -0.47 -4.73 113.62 116.77 3h1h n SER 45 Ca -0.16 -1.64 -0.03 0.00 1.01 0.00 0.00 58.87 58.04 3h1h n SER 45 Cb 0.58 -0.26 0.05 0.00 -1.01 0.00 0.00 64.21 63.56 3h1h n SER 45 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 3h1h n ARG 46 N -1.77 0.05 -1.56 1.43 3.00 -0.94 -3.79 116.66 113.08 3h1h n ARG 46 Ca 0.08 -0.63 -0.31 0.00 -0.00 0.00 0.00 57.85 56.99 3h1h n ARG 46 Cb 0.29 0.22 0.06 0.00 0.00 0.00 0.00 32.46 33.03 3h1h n ARG 46 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 3h1h s ILE 47 N 0.78 3.82 -0.30 5.15 1.01 -1.02 -3.13 121.20 127.50 3h1h s ILE 47 Ca 0.23 0.59 -0.15 0.00 0.00 0.00 0.00 60.65 61.32 3h1h s ILE 47 Cb 0.16 -3.33 0.16 0.00 0.01 0.00 0.00 42.46 39.46 3h1h s ILE 47 CO -0.10 -0.77 0.99 -0.83 0.00 0.00 0.00 174.94 174.23 3h1h s GLY 48 N -3.81 -0.16 -0.32 6.18 0.00 0.90 -2.07 107.32 108.04 3h1h s GLY 48 Ca 0.59 3.07 -0.27 0.00 0.00 0.00 0.00 44.72 48.11 3h1h s GLY 48 CO 0.55 3.19 0.95 0.14 0.00 0.00 0.00 173.10 177.94 3h1h s VAL 49 N 2.36 4.62 0.06 1.40 1.01 0.20 -1.95 120.40 128.10 3h1h s VAL 49 Ca -0.03 1.49 -0.02 0.00 0.00 0.00 0.00 61.98 63.42 3h1h s VAL 49 Cb -0.06 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.97 3h1h s VAL 49 CO -0.17 -0.40 0.25 -0.36 0.00 0.00 0.00 175.10 174.42 3h1h s PHE 50 N 3.37 3.52 -0.02 5.22 0.40 -0.06 -0.01 117.98 130.39 3h1h s PHE 50 Ca 0.40 0.35 -0.14 0.00 -0.60 0.00 0.00 56.93 56.94 3h1h s PHE 50 Cb -0.13 -1.84 0.02 0.00 0.51 0.00 0.00 43.02 41.59 3h1h s PHE 50 CO 0.14 0.57 0.30 0.42 0.70 0.00 0.00 175.22 177.35 3h1h s ILE 51 N -1.50 0.05 -0.88 0.64 1.01 -0.61 -1.88 121.20 118.03 3h1h s ILE 51 Ca 0.35 -0.44 -0.17 0.00 0.00 0.00 0.00 60.65 60.38 3h1h s ILE 51 Cb -0.13 -0.59 0.15 0.00 0.01 0.00 0.00 42.46 41.90 3h1h s ILE 51 CO 0.25 -0.24 1.00 -0.54 0.00 0.00 0.00 174.94 175.41 3h1h s LYS 52 N -1.20 3.57 0.23 2.79 1.02 -0.85 -1.37 119.74 123.92 3h1h s LYS 52 Ca -0.12 -1.93 -0.20 0.00 0.02 0.00 0.00 55.97 53.73 3h1h s LYS 52 Cb -0.05 -4.73 0.03 0.00 -0.52 0.00 0.00 37.83 32.56 3h1h s LYS 52 CO 0.04 -1.62 0.62 0.00 -0.92 0.00 0.00 175.35 173.47 3h1h s ALA 53 N 1.97 -1.16 0.00 5.17 0.00 -1.21 -4.80 121.76 121.73 3h1h s ALA 53 Ca 0.27 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 52.08 3h1h s ALA 53 Cb -0.07 0.87 0.00 0.00 0.00 0.00 0.00 23.12 23.92 3h1h s ALA 53 CO -0.08 -0.90 0.00 0.41 0.00 0.00 0.00 175.76 175.18 3h1h n GLY 54 N -0.40 1.71 0.06 0.00 0.00 -1.26 -0.45 105.19 104.84 3h1h n GLY 54 Ca -0.08 -1.44 0.03 0.00 0.00 0.00 0.00 46.02 44.52 3h1h n GLY 54 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h1h n SER 55 N 0.00 0.14 0.18 1.61 3.41 -1.05 -0.89 113.62 117.02 3h1h n SER 55 Ca 0.00 0.44 0.02 0.00 -0.26 0.00 0.00 58.87 59.07 3h1h n SER 55 Cb 0.00 -0.43 0.33 0.00 -0.26 0.00 0.00 64.21 63.85 3h1h n SER 55 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3h1h h ARG 56 N 0.00 0.00 -0.05 4.33 2.43 -1.09 -2.84 114.38 117.15 3h1h h ARG 56 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3h1h h ARG 56 Cb 0.36 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 3h1h h ARG 56 CO 0.00 0.41 0.00 0.66 -1.51 0.00 0.00 179.97 179.53 3h1h n TYR 57 N -4.05 0.05 -2.31 2.20 4.02 -0.07 -4.35 117.16 112.65 3h1h n TYR 57 Ca -0.02 -0.02 -0.33 0.00 -0.01 0.00 0.00 57.90 57.52 3h1h n TYR 57 Cb 0.44 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.74 3h1h n TYR 57 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 3h1h s GLU 58 N -1.95 3.63 0.22 -0.72 2.02 -1.07 -5.01 118.70 115.81 3h1h s GLU 58 Ca 0.35 1.20 0.11 0.00 0.02 0.00 0.00 54.97 56.65 3h1h s GLU 58 Cb 0.20 -2.08 -0.04 0.00 0.10 0.00 0.00 34.13 32.31 3h1h s GLU 58 CO 0.32 -0.55 -0.18 0.99 0.02 0.00 0.00 175.26 175.85 3h1h s THR 59 N -2.32 2.64 0.61 3.63 2.01 -1.26 -4.84 115.64 116.11 3h1h s THR 59 Ca 0.64 -2.03 0.26 0.00 0.31 0.00 0.00 61.69 60.87 3h1h s THR 59 Cb -0.15 -2.32 0.37 0.00 0.01 0.00 0.00 72.50 70.42 3h1h s THR 59 CO 0.29 -0.20 1.44 0.00 -0.69 0.00 0.00 174.62 175.46 3h1h h THR 60 N 2.79 0.08 0.00 -0.82 1.03 -2.01 0.24 112.91 114.23 3h1h h THR 60 Ca -0.45 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 65.95 3h1h h THR 60 Cb 1.22 0.16 0.00 0.00 -1.07 0.00 0.00 68.15 68.46 3h1h h THR 60 CO 0.53 0.00 -0.37 0.00 -0.01 0.00 0.00 175.52 175.67 3h1h n ALA 61 N -2.22 2.74 -1.46 0.00 0.00 -1.26 -4.25 120.51 114.06 3h1h n ALA 61 Ca 0.18 -0.18 0.03 0.00 0.00 0.00 0.00 53.44 53.47 3h1h n ALA 61 Cb 1.29 -1.28 0.04 0.00 0.00 0.00 0.00 19.45 19.49 3h1h n ALA 61 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3h1h n ASN 62 N -2.05 0.79 -4.24 0.00 6.94 0.82 -5.10 115.26 112.43 3h1h n ASN 62 Ca 0.04 -2.16 -0.49 0.00 -0.02 0.00 0.00 54.58 51.95 3h1h n ASN 62 Cb 0.42 -0.22 -0.04 0.00 -2.36 0.00 0.00 39.78 37.57 3h1h n ASN 62 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 3h1h n LEU 63 N -0.43 -0.87 0.00 -4.53 4.77 -1.07 -1.21 117.00 113.67 3h1h n LEU 63 Ca 0.04 1.09 0.00 0.00 -0.03 0.00 0.00 56.01 57.11 3h1h n LEU 63 Cb 0.62 -0.90 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 3h1h n LEU 63 CO 0.00 -2.58 0.00 0.61 -1.33 0.00 0.00 177.39 174.10 3h1h n GLY 64 N 1.78 3.12 0.37 -0.72 0.00 -1.26 -4.82 105.19 103.66 3h1h n GLY 64 Ca 0.18 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.39 3h1h n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1h h THR 65 N 0.00 0.56 -0.14 2.61 1.03 -1.57 0.28 112.91 115.69 3h1h h THR 65 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 66.41 66.33 3h1h h THR 65 Cb 0.00 0.74 -0.00 0.00 -1.07 0.00 0.00 68.15 67.82 3h1h h THR 65 CO 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 175.52 175.31 3h1h h ALA 66 N 1.68 0.21 0.52 0.00 0.00 -1.89 -2.02 119.26 117.75 3h1h h ALA 66 Ca 0.19 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 3h1h h ALA 66 Cb 0.89 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 3h1h h ALA 66 CO -0.00 0.14 -0.34 1.25 0.00 0.00 0.00 179.25 180.30 3h1h h HIS 67 N -0.02 -0.92 -0.94 0.00 6.17 -0.82 -1.55 115.15 117.07 3h1h h HIS 67 Ca 0.01 -0.01 0.23 0.00 0.71 0.00 0.00 60.37 61.32 3h1h h HIS 67 Cb 0.76 0.33 -0.12 0.00 2.52 0.00 0.00 27.41 30.90 3h1h h HIS 67 CO 0.09 -0.50 0.49 1.25 0.71 0.00 0.00 177.93 179.97 3h1h h LEU 68 N -0.82 0.50 -0.70 0.26 5.85 -1.11 0.49 115.31 119.79 3h1h h LEU 68 Ca -0.07 0.14 0.07 0.00 0.84 0.00 0.00 57.88 58.86 3h1h h LEU 68 Cb 0.66 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.71 3h1h h LEU 68 CO 0.05 0.06 0.38 0.25 -0.34 0.00 0.00 178.44 178.84 3h1h h LEU 69 N 0.49 0.55 -0.68 2.25 5.85 -0.99 0.19 115.31 122.98 3h1h h LEU 69 Ca 0.59 0.04 0.07 0.00 0.84 0.00 0.00 57.88 59.42 3h1h h LEU 69 Cb 1.12 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 42.02 3h1h h LEU 69 CO -0.50 0.34 0.37 -0.09 -0.34 0.00 0.00 178.44 178.23 3h1h h ARG 70 N 0.69 0.65 0.00 1.25 2.43 0.98 -1.94 114.38 118.43 3h1h h ARG 70 Ca 0.32 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.39 3h1h h ARG 70 Cb 0.24 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 3h1h h ARG 70 CO -0.21 0.43 -0.29 -0.07 -1.51 0.00 0.00 179.97 178.32 3h1h h LEU 71 N 0.67 0.00 0.00 3.80 3.38 -0.66 -3.26 115.31 119.24 3h1h h LEU 71 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 3h1h h LEU 71 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 3h1h h LEU 71 CO -0.20 0.29 0.00 0.00 0.09 0.00 0.00 178.44 178.62 3h1h n ALA 72 N -2.20 2.36 -0.43 1.53 0.00 0.54 -4.29 120.51 118.01 3h1h n ALA 72 Ca 0.01 -0.14 0.38 0.00 0.00 0.00 0.00 53.44 53.70 3h1h n ALA 72 Cb 0.56 -1.40 0.73 0.00 0.00 0.00 0.00 19.45 19.34 3h1h n ALA 72 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3h1h h SER 73 N 0.00 0.08 -0.43 0.00 4.64 -1.60 -1.07 113.55 115.18 3h1h h SER 73 Ca 0.00 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3h1h h SER 73 Cb 0.07 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 3h1h h SER 73 CO 0.00 -0.01 0.00 -0.81 -0.87 0.00 0.00 176.83 175.14 3h1h n PRO 74 N -4.23 2.18 -1.48 4.77 -0.04 -1.26 -4.91 135.00 130.03 3h1h n PRO 74 Ca 0.31 -1.82 -0.31 0.00 -0.04 0.00 0.00 63.50 61.65 3h1h n PRO 74 Cb 1.41 -1.43 0.07 0.00 -0.04 0.00 0.00 33.50 33.51 3h1h n PRO 74 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3h1h s LEU 75 N -1.22 3.03 0.57 1.53 1.43 -0.41 -4.40 118.68 119.21 3h1h s LEU 75 Ca 0.35 1.63 -0.20 0.00 -1.03 0.00 0.00 54.13 54.89 3h1h s LEU 75 Cb 0.19 -4.43 -0.05 0.00 0.03 0.00 0.00 46.19 41.93 3h1h s LEU 75 CO 0.26 -1.68 1.13 0.35 0.23 0.00 0.00 176.35 176.64 3h1h n THR 76 N -3.28 3.74 -4.75 5.49 -2.24 -1.26 -4.53 114.28 107.44 3h1h n THR 76 Ca 0.08 -0.50 -0.33 0.00 -2.27 0.00 0.00 64.05 61.03 3h1h n THR 76 Cb 0.54 -1.35 -0.07 0.00 -2.10 0.00 0.00 70.33 67.35 3h1h n THR 76 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3h1h s THR 77 N -1.40 1.03 -0.12 4.28 -4.23 0.33 -2.66 115.64 112.87 3h1h s THR 77 Ca 0.74 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 59.49 3h1h s THR 77 Cb -0.43 -2.10 0.27 0.00 1.34 0.00 0.00 72.50 71.58 3h1h s THR 77 CO 0.48 0.00 1.71 0.11 -0.54 0.00 0.00 174.62 176.38 3h1h h LYS 78 N 1.35 0.00 0.00 3.99 1.57 -1.47 -3.31 116.57 118.70 3h1h h LYS 78 Ca -0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 3h1h h LYS 78 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.63 3h1h h LYS 78 CO 0.72 0.16 -0.76 0.41 -0.57 0.00 0.00 179.45 179.41 3h1h n GLY 79 N 0.66 -0.19 3.21 3.86 0.00 -1.26 -5.00 105.19 106.47 3h1h n GLY 79 Ca 0.02 -0.32 -0.12 0.00 0.00 0.00 0.00 46.02 45.60 3h1h n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1h s ALA 80 N -2.25 -0.84 0.40 4.61 0.00 -1.25 -5.11 121.76 117.33 3h1h s ALA 80 Ca 0.03 1.08 -0.16 0.00 0.00 0.00 0.00 51.96 52.91 3h1h s ALA 80 Cb 0.09 -0.64 -0.09 0.00 0.00 0.00 0.00 23.12 22.48 3h1h s ALA 80 CO 0.48 -0.19 0.84 -1.54 0.00 0.00 0.00 175.76 175.35 3h1h s SER 81 N 0.59 6.72 0.39 0.00 1.04 -1.26 -0.51 113.70 120.67 3h1h s SER 81 Ca -0.03 1.39 0.20 0.00 0.48 0.00 0.00 55.95 57.98 3h1h s SER 81 Cb -0.05 -2.42 1.16 0.00 0.10 0.00 0.00 66.02 64.81 3h1h s SER 81 CO -0.04 -0.36 1.71 -1.28 0.98 0.00 0.00 173.24 174.26 3h1h h SER 82 N 1.70 0.43 0.76 7.02 0.87 -1.80 0.53 113.55 123.06 3h1h h SER 82 Ca -0.48 0.12 -0.04 0.00 -1.23 0.00 0.00 61.79 60.17 3h1h h SER 82 Cb 1.18 0.07 0.01 0.00 -0.44 0.00 0.00 62.40 63.22 3h1h h SER 82 CO 0.63 -0.03 -0.36 0.15 -0.53 0.00 0.00 176.83 176.69 3h1h h PHE 83 N 0.32 -0.94 -0.74 2.24 3.57 -1.92 -2.81 116.94 116.66 3h1h h PHE 83 Ca 0.69 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 62.16 3h1h h PHE 83 Cb 1.78 0.31 -0.04 0.00 2.79 0.00 0.00 35.95 40.79 3h1h h PHE 83 CO -0.01 -0.57 0.45 -0.09 -2.23 0.00 0.00 178.31 175.87 3h1h h ARG 84 N -1.16 1.00 -0.48 1.11 2.43 -0.91 -0.19 114.38 116.19 3h1h h ARG 84 Ca -0.10 -0.09 0.06 0.00 -0.81 0.00 0.00 59.98 59.04 3h1h h ARG 84 Cb 0.80 -0.21 -0.05 0.00 -0.42 0.00 0.00 29.97 30.08 3h1h h ARG 84 CO 0.17 0.70 0.19 0.82 -1.51 0.00 0.00 179.97 180.34 3h1h h ILE 85 N 1.02 0.88 0.01 1.20 2.04 -0.12 1.27 117.51 123.81 3h1h h ILE 85 Ca 0.27 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 66.00 3h1h h ILE 85 Cb -0.04 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 3h1h h ILE 85 CO -0.05 0.07 -0.00 0.74 0.00 0.00 0.00 178.15 178.90 3h1h h THR 86 N 0.38 1.56 -0.63 -0.27 2.02 -1.17 -2.71 112.91 112.09 3h1h h THR 86 Ca 0.22 -1.99 0.00 0.00 0.77 0.00 0.00 66.41 65.41 3h1h h THR 86 Cb 0.20 2.86 -0.03 0.00 -1.74 0.00 0.00 68.15 69.44 3h1h h THR 86 CO -0.21 0.50 0.40 0.03 0.37 0.00 0.00 175.52 176.61 3h1h h ARG 87 N -0.91 0.84 0.02 6.66 2.47 -1.02 -1.82 114.38 120.63 3h1h h ARG 87 Ca -0.00 -0.06 0.03 0.00 -1.26 0.00 0.00 59.98 58.68 3h1h h ARG 87 Cb 0.82 -0.18 -0.05 0.00 -1.65 0.00 0.00 29.97 28.91 3h1h h ARG 87 CO 0.00 0.58 -0.29 0.78 0.56 0.00 0.00 179.97 181.60 3h1h h GLY 88 N 0.85 -0.47 1.08 0.04 0.00 0.15 -0.26 103.07 104.47 3h1h h GLY 88 Ca 0.23 0.35 -0.04 0.00 0.00 0.00 0.00 47.33 47.86 3h1h h GLY 88 CO -0.05 -0.22 0.35 -2.22 0.00 0.00 0.00 176.54 174.40 3h1h h ILE 89 N -0.45 1.26 -0.06 2.60 2.04 -1.38 -2.92 117.51 118.60 3h1h h ILE 89 Ca 0.06 -0.77 -0.09 0.00 1.00 0.00 0.00 64.86 65.06 3h1h h ILE 89 Cb 0.52 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 3h1h h ILE 89 CO -0.23 0.32 -0.37 -0.33 0.00 0.00 0.00 178.15 177.54 3h1h h GLU 90 N 1.15 0.12 0.00 2.37 5.08 -0.92 -0.14 114.58 122.25 3h1h h GLU 90 Ca 0.27 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 3h1h h GLU 90 Cb 0.17 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3h1h h GLU 90 CO -0.03 0.48 0.02 0.00 -1.00 0.00 0.00 179.01 178.48 3h1h h ALA 91 N 1.52 1.01 -0.31 3.43 0.00 -0.85 -2.12 119.26 121.95 3h1h h ALA 91 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.67 3h1h h ALA 91 Cb 0.71 0.00 -0.30 0.00 0.00 0.00 0.00 17.79 18.20 3h1h h ALA 91 CO 0.05 -0.01 -0.85 1.33 0.00 0.00 0.00 179.25 179.77 3h1h n VAL 92 N -2.29 1.60 -2.39 0.00 0.24 -1.14 -4.95 118.33 109.39 3h1h n VAL 92 Ca -0.01 -2.95 -0.13 0.00 -2.04 0.00 0.00 64.34 59.21 3h1h n VAL 92 Cb 0.05 0.14 -0.01 0.00 -1.47 0.00 0.00 33.84 32.55 3h1h n VAL 92 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h1h n GLY 93 N -0.53 -0.42 3.94 7.63 0.00 -0.80 -4.65 105.19 110.36 3h1h n GLY 93 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 3h1h n GLY 93 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h1h s GLY 94 N -2.03 1.80 -0.04 -0.02 0.00 -0.08 -4.72 107.32 102.23 3h1h s GLY 94 Ca 0.00 -1.27 -0.22 0.00 0.00 0.00 0.00 44.72 43.24 3h1h s GLY 94 CO 0.00 -0.47 0.48 -1.35 0.00 0.00 0.00 173.10 171.75 3h1h s SER 95 N -4.92 -0.41 -0.04 1.64 1.04 -0.98 -4.64 113.70 105.39 3h1h s SER 95 Ca 0.75 0.43 -0.01 0.00 0.48 0.00 0.00 55.95 57.59 3h1h s SER 95 Cb -0.03 0.47 0.03 0.00 0.10 0.00 0.00 66.02 66.59 3h1h s SER 95 CO 0.53 -0.49 0.08 -0.22 0.98 0.00 0.00 173.24 174.12 3h1h s LEU 96 N -1.13 0.64 0.08 2.42 2.96 -1.26 -2.31 118.68 120.08 3h1h s LEU 96 Ca -0.11 0.14 -0.03 0.00 -0.22 0.00 0.00 54.13 53.91 3h1h s LEU 96 Cb -0.03 0.04 -0.03 0.00 0.50 0.00 0.00 46.19 46.67 3h1h s LEU 96 CO 0.06 -0.18 0.04 -0.94 -1.32 0.00 0.00 176.35 174.02 3h1h s SER 97 N 1.51 0.37 -0.22 3.68 1.04 -0.48 -5.03 113.70 114.57 3h1h s SER 97 Ca -0.04 -0.97 -0.02 0.00 0.48 0.00 0.00 55.95 55.40 3h1h s SER 97 Cb -0.12 0.25 0.07 0.00 0.10 0.00 0.00 66.02 66.32 3h1h s SER 97 CO -0.04 -0.66 0.04 -0.69 0.98 0.00 0.00 173.24 172.87 3h1h s VAL 98 N -3.94 0.70 -0.08 5.02 1.01 -1.26 -1.96 120.40 119.90 3h1h s VAL 98 Ca 0.10 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.26 3h1h s VAL 98 Cb 0.07 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 3h1h s VAL 98 CO -0.08 -0.29 0.06 -0.31 0.00 0.00 0.00 175.10 174.49 3h1h s TYR 99 N 1.76 3.33 -0.20 5.22 1.51 -0.62 -4.94 117.35 123.41 3h1h s TYR 99 Ca 0.00 0.30 -0.17 0.00 -1.01 0.00 0.00 57.07 56.20 3h1h s TYR 99 Cb -0.17 -1.83 0.06 0.00 -0.11 0.00 0.00 41.96 39.91 3h1h s TYR 99 CO -0.11 0.57 0.53 -1.54 -1.11 0.00 0.00 175.55 173.89 3h1h s SER 100 N -1.11 -0.59 0.09 2.29 1.04 -1.26 -0.05 113.70 114.11 3h1h s SER 100 Ca 0.16 1.09 0.01 0.00 0.48 0.00 0.00 55.95 57.69 3h1h s SER 100 Cb -0.12 1.07 0.01 0.00 0.10 0.00 0.00 66.02 67.08 3h1h s SER 100 CO 0.05 -0.19 0.05 0.35 0.98 0.00 0.00 173.24 174.48 3h1h n THR 101 N 3.22 0.00 0.31 2.02 -2.24 -0.07 -4.96 114.28 112.56 3h1h n THR 101 Ca -0.16 -0.12 0.19 0.00 -2.27 0.00 0.00 64.05 61.69 3h1h n THR 101 Cb 0.56 -1.03 0.90 0.00 -2.10 0.00 0.00 70.33 68.67 3h1h n THR 101 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 3h1h h ARG 102 N 0.00 0.00 0.00 -0.78 3.08 -1.95 -3.29 114.38 111.44 3h1h h ARG 102 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3h1h h ARG 102 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 3h1h h ARG 102 CO 0.02 0.00 -0.24 -0.85 -1.07 0.00 0.00 179.97 177.84 3h1h n GLU 103 N -3.02 0.44 -3.71 0.04 0.28 -1.26 -0.81 120.64 112.61 3h1h n GLU 103 Ca -0.01 -1.12 -0.12 0.00 -0.16 0.00 0.00 57.16 55.75 3h1h n GLU 103 Cb 0.20 -0.68 -0.10 0.00 1.43 0.00 0.00 31.44 32.28 3h1h n GLU 103 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 177.13 175.38 3h1h s LYS 104 N -0.49 0.50 -0.15 3.44 0.00 0.41 -3.36 119.74 120.10 3h1h s LYS 104 Ca 0.04 0.68 0.00 0.00 0.00 0.00 0.00 55.97 56.70 3h1h s LYS 104 Cb 0.04 0.19 0.03 0.00 0.00 0.00 0.00 37.83 38.09 3h1h s LYS 104 CO 0.00 -0.09 -0.12 -1.64 0.00 0.00 0.00 175.35 173.51 3h1h s MET 105 N 0.53 2.05 -0.19 1.78 -1.94 -0.47 -0.90 119.30 120.16 3h1h s MET 105 Ca -0.02 -0.51 -0.05 0.00 -1.71 0.00 0.00 55.69 53.39 3h1h s MET 105 Cb -0.04 -2.01 -0.02 0.00 2.01 0.00 0.00 34.83 34.76 3h1h s MET 105 CO -0.03 -0.27 -0.00 0.99 -0.01 0.00 0.00 175.02 175.70 3h1h s THR 106 N 1.54 3.97 -0.44 2.05 2.01 0.93 -1.57 115.64 124.12 3h1h s THR 106 Ca 0.04 -0.31 -0.08 0.00 0.31 0.00 0.00 61.69 61.65 3h1h s THR 106 Cb -0.13 -2.79 0.10 0.00 0.01 0.00 0.00 72.50 69.69 3h1h s THR 106 CO -0.10 0.44 0.29 -0.31 -0.69 0.00 0.00 174.62 174.25 3h1h s TYR 107 N 0.91 3.40 0.26 4.92 1.51 0.98 -1.58 117.35 127.76 3h1h s TYR 107 Ca 0.01 -1.79 0.10 0.00 -1.01 0.00 0.00 57.07 54.38 3h1h s TYR 107 Cb -0.14 -3.24 -0.05 0.00 -0.11 0.00 0.00 41.96 38.42 3h1h s TYR 107 CO 0.02 -0.93 -0.16 0.00 -1.11 0.00 0.00 175.55 173.36 3h1h s VAL 109 N -2.70 0.47 0.16 0.00 -7.23 -0.88 -1.38 120.40 108.83 3h1h s VAL 109 Ca 0.28 -1.54 0.05 0.00 -1.81 0.00 0.00 61.98 58.95 3h1h s VAL 109 Cb -0.02 -1.17 -0.04 0.00 0.56 0.00 0.00 36.38 35.70 3h1h s VAL 109 CO 0.12 -0.72 -0.10 -1.61 -0.31 0.00 0.00 175.10 172.48 3h1h s GLU 110 N -2.94 1.11 0.00 4.82 2.02 -0.98 -2.45 118.70 120.29 3h1h s GLU 110 Ca 0.01 -1.48 0.00 0.00 0.02 0.00 0.00 54.97 53.52 3h1h s GLU 110 Cb -0.00 -0.70 0.00 0.00 0.10 0.00 0.00 34.13 33.53 3h1h s GLU 110 CO -0.04 0.08 0.00 0.00 0.02 0.00 0.00 175.26 175.32 3h1h s LEU 112 N 0.00 4.48 0.16 0.00 1.43 -1.26 -1.37 118.68 122.11 3h1h s LEU 112 Ca 0.00 1.48 -0.03 0.00 -1.03 0.00 0.00 54.13 54.55 3h1h s LEU 112 Cb 0.00 -3.33 0.30 0.00 0.03 0.00 0.00 46.19 43.19 3h1h s LEU 112 CO 0.00 0.15 0.84 0.54 0.23 0.00 0.00 176.35 178.11 3h1h n ARG 113 N 1.27 -0.05 0.28 1.70 1.74 -1.19 0.73 116.66 121.15 3h1h n ARG 113 Ca -0.05 0.82 0.18 0.00 -0.77 0.00 0.00 57.85 58.03 3h1h n ARG 113 Cb 0.50 -1.26 0.94 0.00 -1.02 0.00 0.00 32.46 31.63 3h1h n ARG 113 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3h1h h ASP 114 N 0.00 0.00 -0.26 0.55 3.32 -1.92 -2.90 116.42 115.22 3h1h h ASP 114 Ca 0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.33 3h1h h ASP 114 Cb 0.48 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.03 3h1h h ASP 114 CO -0.54 0.00 0.00 1.41 -1.72 0.00 0.00 179.24 178.39 3h1h n HIS 115 N -3.40 0.34 0.00 4.55 8.25 0.22 -4.72 115.22 120.48 3h1h n HIS 115 Ca -0.01 -0.49 -0.10 0.00 -0.26 0.00 0.00 57.72 56.86 3h1h n HIS 115 Cb 0.26 -0.03 -0.04 0.00 1.12 0.00 0.00 29.99 31.30 3h1h n HIS 115 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3h1h h VAL 116 N 1.53 0.34 -0.94 1.59 2.07 -1.53 -0.52 116.25 118.79 3h1h h VAL 116 Ca 0.00 0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.77 3h1h h VAL 116 Cb 0.67 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.72 3h1h h VAL 116 CO 0.00 0.00 0.65 -2.24 0.02 0.00 0.00 177.57 176.00 3h1h h ASP 117 N -0.36 0.18 0.15 0.57 2.03 -1.84 0.23 116.42 117.37 3h1h h ASP 117 Ca 0.10 0.02 -0.01 0.00 -0.73 0.00 0.00 57.03 56.41 3h1h h ASP 117 Cb 0.51 -0.01 0.00 0.00 -0.83 0.00 0.00 39.33 39.01 3h1h h ASP 117 CO -0.33 0.06 -0.07 0.74 -1.03 0.00 0.00 179.24 178.61 3h1h h THR 118 N 0.17 0.62 -0.20 1.15 2.02 -1.47 -3.26 112.91 111.93 3h1h h THR 118 Ca 0.47 -1.17 0.06 0.00 0.77 0.00 0.00 66.41 66.54 3h1h h THR 118 Cb 1.57 1.09 -0.01 0.00 -1.74 0.00 0.00 68.15 69.06 3h1h h THR 118 CO -0.09 0.18 0.15 0.58 0.37 0.00 0.00 175.52 176.70 3h1h h VAL 119 N -0.96 0.90 -0.75 3.16 2.07 -0.69 -2.62 116.25 117.36 3h1h h VAL 119 Ca -0.02 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.52 3h1h h VAL 119 Cb 0.44 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 3h1h h VAL 119 CO 0.03 0.00 0.49 -0.03 0.02 0.00 0.00 177.57 178.08 3h1h h MET 120 N 0.00 0.95 -0.00 1.57 -1.53 -0.60 -2.53 114.93 112.79 3h1h h MET 120 Ca 0.10 -0.06 0.02 0.00 -3.44 0.00 0.00 59.70 56.32 3h1h h MET 120 Cb 0.39 -0.21 -0.05 0.00 -0.55 0.00 0.00 31.60 31.18 3h1h h MET 120 CO -0.00 0.63 -0.45 1.49 0.14 0.00 0.00 176.91 178.71 3h1h h GLU 121 N 0.97 -0.55 -0.44 0.39 4.81 -1.52 0.43 114.58 118.68 3h1h h GLU 121 Ca 0.28 0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.62 3h1h h GLU 121 Cb -0.06 0.12 -0.06 0.00 0.63 0.00 0.00 28.75 29.38 3h1h h GLU 121 CO -0.08 -0.37 0.09 1.88 -0.73 0.00 0.00 179.01 179.81 3h1h h TYR 122 N -0.57 0.15 -0.38 0.92 -1.99 -1.67 0.51 116.97 113.94 3h1h h TYR 122 Ca 0.01 0.03 0.08 0.00 2.00 0.00 0.00 58.73 60.84 3h1h h TYR 122 Cb 0.61 -0.00 -0.08 0.00 2.00 0.00 0.00 36.73 39.26 3h1h h TYR 122 CO -0.50 0.01 -0.14 1.25 -0.00 0.00 0.00 178.16 178.79 3h1h h LEU 123 N 0.23 -0.49 0.22 3.88 5.85 -0.97 0.31 115.31 124.33 3h1h h LEU 123 Ca 0.21 0.13 0.01 0.00 0.84 0.00 0.00 57.88 59.07 3h1h h LEU 123 Cb 0.26 0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 3h1h h LEU 123 CO -0.28 -0.18 -0.26 0.25 -0.34 0.00 0.00 178.44 177.64 3h1h h LEU 124 N -0.07 -0.70 -0.62 2.25 6.46 0.15 -2.93 115.31 119.85 3h1h h LEU 124 Ca 0.19 0.07 0.10 0.00 -0.12 0.00 0.00 57.88 58.11 3h1h h LEU 124 Cb 0.35 0.25 -0.07 0.00 -0.73 0.00 0.00 40.66 40.45 3h1h h LEU 124 CO -0.42 -0.37 0.23 0.78 -0.62 0.00 0.00 178.44 178.04 3h1h h ASN 125 N -0.52 0.23 0.07 1.25 2.35 0.97 -2.00 115.58 117.92 3h1h h ASN 125 Ca 0.00 0.08 0.01 0.00 -0.55 0.00 0.00 56.30 55.84 3h1h h ASN 125 Cb 0.50 0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 3h1h h ASN 125 CO -0.08 0.13 -0.08 0.58 -1.65 0.00 0.00 177.43 176.33 3h1h h VAL 126 N 0.41 0.81 0.00 2.81 2.07 -0.29 0.80 116.25 122.87 3h1h h VAL 126 Ca 0.31 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.72 3h1h h VAL 126 Cb 0.39 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 3h1h h VAL 126 CO -0.31 0.00 -0.55 0.71 0.02 0.00 0.00 177.57 177.44 3h1h h THR 127 N -0.17 1.16 0.00 2.57 1.35 -1.37 -3.36 112.91 113.10 3h1h h THR 127 Ca 0.01 -2.06 0.00 0.00 -0.55 0.00 0.00 66.41 63.81 3h1h h THR 127 Cb 0.17 2.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 3h1h h THR 127 CO -0.03 0.54 -0.02 0.35 -0.25 0.00 0.00 175.52 176.11 3h1h n THR 128 N -3.55 1.03 -2.39 6.82 -2.24 -0.76 -4.81 114.28 108.38 3h1h n THR 128 Ca -0.00 -1.11 -0.01 0.00 -2.27 0.00 0.00 64.05 60.66 3h1h n THR 128 Cb 0.63 0.41 0.00 0.00 -2.10 0.00 0.00 70.33 69.28 3h1h n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h1h n ALA 129 N -0.61 2.93 -2.12 6.98 0.00 0.27 -4.83 120.51 123.13 3h1h n ALA 129 Ca 0.03 -1.69 -0.42 0.00 0.00 0.00 0.00 53.44 51.36 3h1h n ALA 129 Cb 0.37 -0.62 -0.03 0.00 0.00 0.00 0.00 19.45 19.16 3h1h n ALA 129 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3h1h s PRO 130 N -0.46 4.34 0.15 0.00 0.04 -1.25 -1.22 135.00 136.61 3h1h s PRO 130 Ca 0.19 2.07 0.22 0.00 0.04 0.00 0.00 61.00 63.51 3h1h s PRO 130 Cb 0.25 -3.23 -0.06 0.00 0.04 0.00 0.00 34.50 31.50 3h1h s PRO 130 CO -0.09 -0.38 0.94 0.39 0.04 0.00 0.00 177.00 177.90 3h1h n GLU 131 N 3.49 0.61 -4.02 4.56 1.02 -1.09 -4.89 120.64 120.32 3h1h n GLU 131 Ca 0.10 0.10 -0.42 0.00 -0.02 0.00 0.00 57.16 56.92 3h1h n GLU 131 Cb 0.42 -1.79 0.02 0.00 -0.02 0.00 0.00 31.44 30.07 3h1h n GLU 131 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3h1h n PHE 132 N -2.66 -1.37 -2.01 -0.32 0.99 -1.26 -4.82 117.46 106.00 3h1h n PHE 132 Ca -0.02 0.16 -0.41 0.00 -0.00 0.00 0.00 57.45 57.17 3h1h n PHE 132 Cb 0.60 -2.58 -0.02 0.00 -1.00 0.00 0.00 39.48 36.48 3h1h n PHE 132 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 3h1h s ARG 133 N -6.96 4.27 0.27 -1.08 0.52 -1.26 -4.73 118.95 109.97 3h1h s ARG 133 Ca 0.39 2.30 -0.07 0.00 -0.52 0.00 0.00 55.73 57.83 3h1h s ARG 133 Cb -0.22 -3.12 0.47 0.00 0.52 0.00 0.00 34.95 32.60 3h1h s ARG 133 CO 0.91 -0.43 1.59 -1.35 0.02 0.00 0.00 175.30 176.03 3h1h h PRO 134 N 5.23 0.02 0.47 3.54 0.11 -1.99 -0.01 132.00 139.38 3h1h h PRO 134 Ca -0.46 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 3h1h h PRO 134 Cb 1.22 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3h1h h PRO 134 CO 0.79 0.01 -0.23 0.11 -0.21 0.00 0.00 178.00 178.48 3h1h h TRP 135 N 0.02 -0.59 -0.96 0.65 0.09 -1.98 -0.14 115.95 113.05 3h1h h TRP 135 Ca 0.46 -0.01 0.18 0.00 0.09 0.00 0.00 58.89 59.60 3h1h h TRP 135 Cb 0.78 0.19 -0.17 0.00 0.08 0.00 0.00 29.16 30.04 3h1h h TRP 135 CO -0.61 -0.36 -0.28 0.39 0.09 0.00 0.00 178.44 177.67 3h1h n GLU 136 N -4.69 -0.13 0.39 0.12 1.02 -0.94 -0.17 120.64 116.24 3h1h n GLU 136 Ca -0.08 1.49 -0.19 0.00 -0.02 0.00 0.00 57.16 58.36 3h1h n GLU 136 Cb 0.25 -2.21 -0.10 0.00 -0.02 0.00 0.00 31.44 29.36 3h1h n GLU 136 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3h1h h VAL 137 N 0.00 0.08 -0.95 2.62 2.07 -1.02 -2.15 116.25 116.89 3h1h h VAL 137 Ca 0.42 0.00 0.26 0.00 0.82 0.00 0.00 66.70 68.20 3h1h h VAL 137 Cb 0.66 0.08 -0.13 0.00 -1.52 0.00 0.00 31.29 30.37 3h1h h VAL 137 CO -0.97 0.00 0.47 0.74 0.02 0.00 0.00 177.57 177.83 3h1h h THR 138 N -1.11 0.41 -0.00 2.57 2.02 0.14 0.40 112.91 117.34 3h1h h THR 138 Ca -0.09 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 66.95 3h1h h THR 138 Cb 0.90 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 3h1h h THR 138 CO 0.08 0.07 -0.00 0.47 0.37 0.00 0.00 175.52 176.51 3h1h n ASP 139 N -5.04 0.00 -0.05 4.18 8.00 0.15 -3.65 116.55 120.14 3h1h n ASP 139 Ca 0.26 0.37 -0.13 0.00 0.71 0.00 0.00 54.79 56.00 3h1h n ASP 139 Cb 0.78 -0.46 -0.14 0.00 -0.02 0.00 0.00 41.12 41.28 3h1h n ASP 139 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 3h1h n LEU 140 N -1.46 1.31 -0.28 0.64 7.94 0.13 -4.50 117.00 120.78 3h1h n LEU 140 Ca 0.08 0.17 0.07 0.00 -1.11 0.00 0.00 56.01 55.23 3h1h n LEU 140 Cb 0.32 -0.16 0.22 0.00 0.53 0.00 0.00 43.42 44.33 3h1h n LEU 140 CO 0.26 0.60 1.06 1.56 -1.11 0.00 0.00 177.39 179.76 3h1h h GLN 141 N 0.01 0.50 0.00 1.96 4.20 -1.35 0.14 115.11 120.58 3h1h h GLN 141 Ca -0.43 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.25 3h1h h GLN 141 Cb 2.07 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 29.73 3h1h h GLN 141 CO 0.04 0.33 0.17 -1.00 -0.67 0.00 0.00 178.83 177.70 3h1h h PRO 142 N 0.52 0.00 -0.25 1.46 0.13 -1.79 0.12 132.00 132.19 3h1h h PRO 142 Ca 0.46 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.52 3h1h h PRO 142 Cb 0.70 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.82 3h1h h PRO 142 CO -0.40 0.00 -0.13 0.37 -0.23 0.00 0.00 178.00 177.60 3h1h h GLN 143 N 0.00 0.42 -0.77 0.86 5.75 -1.01 -2.77 115.11 117.59 3h1h h GLN 143 Ca 0.00 -0.12 0.12 0.00 -0.15 0.00 0.00 58.65 58.51 3h1h h GLN 143 Cb 0.33 -0.05 -0.08 0.00 1.07 0.00 0.00 27.48 28.75 3h1h h GLN 143 CO 0.00 0.55 0.37 -0.07 -2.65 0.00 0.00 178.83 177.03 3h1h h LEU 144 N 0.39 0.43 -0.95 -2.39 3.38 -0.91 0.18 115.31 115.44 3h1h h LEU 144 Ca 0.07 0.08 0.15 0.00 0.09 0.00 0.00 57.88 58.28 3h1h h LEU 144 Cb 0.47 0.02 -0.09 0.00 0.09 0.00 0.00 40.66 41.15 3h1h h LEU 144 CO 0.03 0.21 0.56 0.50 0.09 0.00 0.00 178.44 179.83 3h1h h LYS 145 N 0.57 0.78 0.11 1.13 3.64 -1.64 0.13 116.57 121.28 3h1h h LYS 145 Ca 0.40 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.73 3h1h h LYS 145 Cb 0.53 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 3h1h h LYS 145 CO -0.34 0.51 -0.05 0.28 -2.27 0.00 0.00 179.45 177.59 3h1h h VAL 146 N 0.80 0.00 -0.99 2.00 2.07 -0.84 -2.55 116.25 116.73 3h1h h VAL 146 Ca 0.51 -0.28 0.33 0.00 0.82 0.00 0.00 66.70 68.08 3h1h h VAL 146 Cb 0.67 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.28 3h1h h VAL 146 CO -0.33 0.00 0.54 -0.78 0.02 0.00 0.00 177.57 177.02 3h1h h ASP 147 N -0.42 0.45 0.15 0.57 3.58 -0.75 0.71 116.42 120.71 3h1h h ASP 147 Ca -0.01 0.20 -0.15 0.00 0.42 0.00 0.00 57.03 57.49 3h1h h ASP 147 Cb 0.11 0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.31 3h1h h ASP 147 CO 0.02 -0.17 -0.54 0.50 -2.88 0.00 0.00 179.24 176.17 3h1h h LYS 148 N 0.28 0.43 -0.12 0.28 3.64 -0.85 -3.13 116.57 117.09 3h1h h LYS 148 Ca 0.74 -0.27 -0.14 0.00 -1.27 0.00 0.00 60.65 59.71 3h1h h LYS 148 Cb 1.70 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.54 3h1h h LYS 148 CO -0.63 0.86 -0.55 0.00 -2.27 0.00 0.00 179.45 176.86 3h1h h ALA 149 N 1.09 0.83 -0.01 5.00 0.00 0.86 -2.73 119.26 124.30 3h1h h ALA 149 Ca 0.01 -0.51 -0.17 0.00 0.00 0.00 0.00 54.91 54.23 3h1h h ALA 149 Cb 1.06 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 3h1h h ALA 149 CO 0.09 0.69 -0.79 -0.39 0.00 0.00 0.00 179.25 178.85 3h1h h VAL 150 N 0.28 1.50 -0.07 0.00 -1.51 -1.40 -3.27 116.25 111.79 3h1h h VAL 150 Ca 0.00 -2.53 -0.01 0.00 -1.23 0.00 0.00 66.70 62.93 3h1h h VAL 150 Cb 1.05 2.38 -0.00 0.00 -2.13 0.00 0.00 31.29 32.59 3h1h h VAL 150 CO 0.09 0.73 -0.01 0.00 -1.23 0.00 0.00 177.57 177.15 3h1h h ALA 151 N 1.12 0.09 0.00 5.19 0.00 -1.49 -2.83 119.26 121.34 3h1h h ALA 151 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3h1h h ALA 151 Cb 1.38 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3h1h h ALA 151 CO 0.11 -0.21 0.00 1.19 0.00 0.00 0.00 179.25 180.35 3h1h n PHE 152 N -4.83 0.00 0.26 0.00 3.01 -1.04 -2.14 117.46 112.73 3h1h n PHE 152 Ca -0.07 0.00 0.16 0.00 1.01 0.00 0.00 57.45 58.55 3h1h n PHE 152 Cb 0.21 0.00 0.56 0.00 -0.01 0.00 0.00 39.48 40.25 3h1h n PHE 152 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 3h1h h GLN 153 N 0.00 0.00 -4.84 -1.08 4.20 -1.57 -3.39 115.11 108.43 3h1h h GLN 153 Ca 0.00 0.00 -0.69 0.00 0.06 0.00 0.00 58.65 58.02 3h1h h GLN 153 Cb 0.00 0.00 -0.19 0.00 0.30 0.00 0.00 27.48 27.59 3h1h h GLN 153 CO 0.00 0.00 -0.25 -1.12 -0.67 0.00 0.00 178.83 176.79 3h1h s SER 154 N -5.82 6.18 0.50 1.46 0.01 -0.91 -4.91 113.70 110.21 3h1h s SER 154 Ca 0.03 -0.61 0.23 0.00 1.31 0.00 0.00 55.95 56.90 3h1h s SER 154 Cb 0.08 -2.21 1.30 0.00 0.21 0.00 0.00 66.02 65.39 3h1h s SER 154 CO 0.57 -0.52 1.97 -0.65 0.41 0.00 0.00 173.24 175.02 3h1h h PRO 155 N 8.67 0.12 -0.89 12.44 0.11 -1.88 -0.18 132.00 150.39 3h1h h PRO 155 Ca -0.27 -0.01 0.13 0.00 0.11 0.00 0.00 66.00 65.96 3h1h h PRO 155 Cb 1.12 -0.03 -0.14 0.00 0.11 0.00 0.00 31.00 32.06 3h1h h PRO 155 CO 0.77 0.08 -0.41 0.37 -0.21 0.00 0.00 178.00 178.60 3h1h h GLN 156 N 0.13 -0.05 -0.15 1.05 4.15 -1.93 0.65 115.11 118.95 3h1h h GLN 156 Ca 0.30 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.64 3h1h h GLN 156 Cb 1.00 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.69 3h1h h GLN 156 CO -0.04 -0.03 -0.28 -0.24 -1.93 0.00 0.00 178.83 176.31 3h1h h VAL 157 N -0.05 1.25 -0.06 2.39 3.04 -1.32 -3.14 116.25 118.36 3h1h h VAL 157 Ca 0.29 -1.20 0.00 0.00 -1.01 0.00 0.00 66.70 64.77 3h1h h VAL 157 Cb 0.56 1.45 -0.00 0.00 -2.01 0.00 0.00 31.29 31.29 3h1h h VAL 157 CO -0.90 0.37 0.04 1.23 -1.01 0.00 0.00 177.57 177.29 3h1h h GLY 158 N 1.02 0.08 1.51 3.17 0.00 -0.86 -2.78 103.07 105.20 3h1h h GLY 158 Ca 0.04 -0.03 -0.13 0.00 0.00 0.00 0.00 47.33 47.21 3h1h h GLY 158 CO 0.05 0.03 -0.38 -0.39 0.00 0.00 0.00 176.54 175.85 3h1h h VAL 159 N 0.07 1.30 -0.59 4.60 -1.51 -1.53 -2.94 116.25 115.65 3h1h h VAL 159 Ca 0.02 -1.52 0.01 0.00 -1.23 0.00 0.00 66.70 63.98 3h1h h VAL 159 Cb -0.00 1.52 -0.03 0.00 -2.13 0.00 0.00 31.29 30.65 3h1h h VAL 159 CO -0.00 0.48 0.39 -0.07 -1.23 0.00 0.00 177.57 177.13 3h1h h LEU 160 N 0.45 0.67 0.15 4.19 3.38 -1.49 0.67 115.31 123.33 3h1h h LEU 160 Ca 0.04 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.01 3h1h h LEU 160 Cb 0.86 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 3h1h h LEU 160 CO 0.07 0.48 -0.30 -0.33 0.09 0.00 0.00 178.44 178.46 3h1h h GLU 161 N 0.79 -0.51 0.00 1.13 4.39 -1.41 -0.19 114.58 118.78 3h1h h GLU 161 Ca 0.22 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.95 3h1h h GLU 161 Cb -0.08 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 3h1h h GLU 161 CO -0.05 -0.34 0.00 -0.91 -1.16 0.00 0.00 179.01 176.55 3h1h h ASN 162 N -0.53 0.00 0.20 1.42 2.35 -1.28 -2.47 115.58 115.27 3h1h h ASN 162 Ca 0.02 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.76 3h1h h ASN 162 Cb 0.55 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.92 3h1h h ASN 162 CO -0.15 0.00 -0.10 0.25 -1.65 0.00 0.00 177.43 175.78 3h1h h LEU 163 N 0.00 -0.23 -1.83 1.61 5.85 0.21 -1.93 115.31 118.99 3h1h h LEU 163 Ca 0.00 0.01 0.39 0.00 0.84 0.00 0.00 57.88 59.12 3h1h h LEU 163 Cb 0.29 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.31 3h1h h LEU 163 CO 0.00 -0.11 0.94 0.45 -0.34 0.00 0.00 178.44 179.38 3h1h h HIS 164 N -0.38 0.16 0.00 1.25 3.86 -1.24 1.58 115.15 120.38 3h1h h HIS 164 Ca -0.03 0.01 -0.10 0.00 -1.16 0.00 0.00 60.37 59.09 3h1h h HIS 164 Cb 0.21 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 3h1h h HIS 164 CO 0.10 -0.02 -0.46 0.00 0.86 0.00 0.00 177.93 178.41 3h1h h ALA 165 N 1.38 1.18 0.00 2.45 0.00 -1.24 -1.48 119.26 121.55 3h1h h ALA 165 Ca 0.68 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3h1h h ALA 165 Cb 2.50 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 20.21 3h1h h ALA 165 CO -0.10 0.58 -0.93 0.00 0.00 0.00 0.00 179.25 178.79 3h1h n ALA 166 N -2.43 3.83 0.06 0.00 0.00 0.51 -4.01 120.51 118.47 3h1h n ALA 166 Ca -0.01 -0.46 0.06 0.00 0.00 0.00 0.00 53.44 53.03 3h1h n ALA 166 Cb 0.49 -0.94 -0.06 0.00 0.00 0.00 0.00 19.45 18.95 3h1h n ALA 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h1h n ALA 167 N -1.67 2.30 -2.47 0.00 0.00 0.68 0.88 120.51 120.23 3h1h n ALA 167 Ca 0.03 -0.42 -0.24 0.00 0.00 0.00 0.00 53.44 52.81 3h1h n ALA 167 Cb 0.39 -0.97 -0.09 0.00 0.00 0.00 0.00 19.45 18.77 3h1h n ALA 167 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3h1h s TYR 168 N -3.19 1.79 -0.08 0.00 1.51 -0.58 -2.04 117.35 114.75 3h1h s TYR 168 Ca -0.03 -1.23 0.02 0.00 -1.01 0.00 0.00 57.07 54.82 3h1h s TYR 168 Cb 0.10 -1.13 -0.02 0.00 -0.11 0.00 0.00 41.96 40.79 3h1h s TYR 168 CO 0.81 -0.27 0.08 1.63 -1.11 0.00 0.00 175.55 176.69 3h1h n LYS 169 N -0.81 6.15 -0.68 -0.62 5.02 -0.99 -4.61 118.16 121.63 3h1h n LYS 169 Ca -0.04 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.25 3h1h n LYS 169 Cb 0.65 -0.60 0.00 0.00 -0.02 0.00 0.00 35.03 35.06 3h1h n LYS 169 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3h1h n THR 170 N -1.06 0.00 0.00 -0.18 -2.24 -1.26 -4.95 114.28 104.59 3h1h n THR 170 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3h1h n THR 170 Cb 0.03 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 3h1h n THR 170 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h1h n ALA 171 N -3.00 0.00 0.03 6.98 0.00 -1.26 0.66 120.51 123.92 3h1h n ALA 171 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 3h1h n ALA 171 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 3h1h n ALA 171 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3h1h h LEU 172 N 0.00 0.63 -0.28 0.00 3.38 -1.90 -3.01 115.31 114.13 3h1h h LEU 172 Ca 0.00 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.53 3h1h h LEU 172 Cb 0.00 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.56 3h1h h LEU 172 CO 0.00 1.21 0.06 0.00 0.09 0.00 0.00 178.44 179.80 3h1h n ALA 173 N -2.55 0.90 -2.29 1.53 0.00 0.21 -4.54 120.51 113.78 3h1h n ALA 173 Ca -0.06 0.04 -0.43 0.00 0.00 0.00 0.00 53.44 52.99 3h1h n ALA 173 Cb 0.75 -0.95 -0.02 0.00 0.00 0.00 0.00 19.45 19.22 3h1h n ALA 173 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3h1h s ASN 174 N -3.11 6.80 0.41 0.00 0.01 -1.14 -4.08 114.94 113.84 3h1h s ASN 174 Ca -0.00 1.79 -0.25 0.00 -0.71 0.00 0.00 52.86 53.69 3h1h s ASN 174 Cb 0.01 -2.54 -0.11 0.00 0.41 0.00 0.00 41.25 39.03 3h1h s ASN 174 CO 0.04 -0.87 1.05 -0.81 -1.51 0.00 0.00 177.10 174.99 3h1h n PRO 175 N 6.89 1.43 0.22 -0.60 -0.04 -1.26 -4.73 135.00 136.92 3h1h n PRO 175 Ca 0.15 0.51 0.12 0.00 -0.04 0.00 0.00 63.50 64.24 3h1h n PRO 175 Cb 0.44 -2.08 0.26 0.00 -0.04 0.00 0.00 33.50 32.09 3h1h n PRO 175 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3h1h h LEU 176 N 1.65 0.00 -8.43 1.53 5.85 -1.93 -3.44 115.31 110.54 3h1h h LEU 176 Ca -0.45 0.00 -0.67 0.00 0.84 0.00 0.00 57.88 57.60 3h1h h LEU 176 Cb 1.33 0.00 -0.31 0.00 0.37 0.00 0.00 40.66 42.05 3h1h h LEU 176 CO 0.58 0.06 -0.84 -0.31 -0.34 0.00 0.00 178.44 177.59 3h1h s TYR 177 N -3.28 2.66 -0.48 1.25 1.51 -1.26 -4.69 117.35 113.05 3h1h s TYR 177 Ca 0.05 -0.92 -0.46 0.00 -1.01 0.00 0.00 57.07 54.73 3h1h s TYR 177 Cb 0.06 -1.77 -0.20 0.00 -0.11 0.00 0.00 41.96 39.95 3h1h s TYR 177 CO 0.65 -0.36 1.64 0.00 -1.11 0.00 0.00 175.55 176.37 3h1h n PRO 179 N 4.27 1.13 -0.02 0.00 -0.04 -1.26 -4.89 135.00 134.18 3h1h n PRO 179 Ca 0.32 0.43 -0.11 0.00 -0.04 0.00 0.00 63.50 64.09 3h1h n PRO 179 Cb -0.04 -2.35 -0.05 0.00 -0.04 0.00 0.00 33.50 31.01 3h1h n PRO 179 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3h1h h ASP 180 N 0.72 -1.28 -0.64 3.54 3.32 -2.00 -2.45 116.42 117.64 3h1h h ASP 180 Ca -0.49 0.18 0.18 0.00 0.02 0.00 0.00 57.03 56.92 3h1h h ASP 180 Cb 1.34 0.53 -0.03 0.00 0.22 0.00 0.00 39.33 41.40 3h1h h ASP 180 CO 0.53 -0.40 0.56 0.10 -1.72 0.00 0.00 179.24 178.30 3h1h h TYR 181 N -0.44 0.00 -0.01 4.55 -0.00 -2.02 0.19 116.97 119.23 3h1h h TYR 181 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.82 3h1h h TYR 181 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.34 3h1h h TYR 181 CO -0.50 0.00 -0.01 0.54 -0.00 0.00 0.00 178.16 178.20 3h1h n ARG 182 N -3.94 1.52 -2.05 0.10 1.74 -0.92 -4.83 116.66 108.27 3h1h n ARG 182 Ca 0.13 -0.78 -0.42 0.00 -0.77 0.00 0.00 57.85 56.01 3h1h n ARG 182 Cb 0.80 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.73 3h1h n ARG 182 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3h1h s ILE 183 N -2.01 3.22 0.00 0.55 -1.09 0.05 -1.78 121.20 120.14 3h1h s ILE 183 Ca 0.40 0.72 0.00 0.00 -2.23 0.00 0.00 60.65 59.54 3h1h s ILE 183 Cb 0.21 -3.46 0.00 0.00 -1.58 0.00 0.00 42.46 37.63 3h1h s ILE 183 CO 0.35 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.68 3h1h n GLY 184 N 3.79 0.59 0.18 6.18 0.00 -1.26 -4.89 105.19 109.78 3h1h n GLY 184 Ca 0.14 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.19 3h1h n GLY 184 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h1h n LYS 185 N -2.80 1.30 -2.73 1.61 5.02 -0.73 -5.01 118.16 114.82 3h1h n LYS 185 Ca 0.00 -0.63 -0.34 0.00 -2.02 0.00 0.00 58.31 55.32 3h1h n LYS 185 Cb 0.00 -1.02 -0.06 0.00 -0.02 0.00 0.00 35.03 33.93 3h1h n LYS 185 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3h1h s ILE 186 N -0.78 4.19 0.22 -0.18 1.01 -1.25 -5.07 121.20 119.34 3h1h s ILE 186 Ca 0.06 1.41 0.10 0.00 0.00 0.00 0.00 60.65 62.22 3h1h s ILE 186 Cb 0.05 -3.60 -0.05 0.00 0.01 0.00 0.00 42.46 38.88 3h1h s ILE 186 CO 0.12 -0.25 -0.19 0.42 0.00 0.00 0.00 174.94 175.04 3h1h s THR 187 N -2.06 2.11 0.37 2.92 -4.23 -1.26 -4.99 115.64 108.51 3h1h s THR 187 Ca 0.62 -2.18 0.13 0.00 -1.18 0.00 0.00 61.69 59.09 3h1h s THR 187 Cb -0.12 -2.10 0.35 0.00 1.34 0.00 0.00 72.50 71.97 3h1h s THR 187 CO 0.16 -0.38 1.81 0.28 -0.54 0.00 0.00 174.62 175.95 3h1h h SER 188 N 2.74 0.56 0.00 3.99 0.02 -1.94 -1.43 113.55 117.49 3h1h h SER 188 Ca -0.41 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 3h1h h SER 188 Cb 1.23 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.74 3h1h h SER 188 CO 0.56 0.19 0.00 -0.62 -1.14 0.00 0.00 176.83 175.83 3h1h n GLU 189 N -4.62 0.00 -0.50 3.45 4.71 -1.26 -0.34 120.64 122.07 3h1h n GLU 189 Ca 0.22 0.47 0.41 0.00 -0.01 0.00 0.00 57.16 58.25 3h1h n GLU 189 Cb 0.68 -1.26 0.69 0.00 -1.01 0.00 0.00 31.44 30.55 3h1h n GLU 189 CO 0.00 0.00 0.00 1.96 0.09 0.00 0.00 177.13 179.18 3h1h h GLN 190 N 0.00 0.04 0.20 3.49 4.20 -1.74 0.81 115.11 122.12 3h1h h GLN 190 Ca 0.00 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 3h1h h GLN 190 Cb 0.00 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.77 3h1h h GLN 190 CO 0.00 0.03 -0.10 -0.07 -0.67 0.00 0.00 178.83 178.02 3h1h h LEU 191 N 0.04 -0.23 -0.02 1.46 3.38 -0.82 -1.00 115.31 118.11 3h1h h LEU 191 Ca 0.85 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 58.55 3h1h h LEU 191 Cb 2.86 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 43.62 3h1h h LEU 191 CO -0.35 0.26 -0.50 0.45 0.09 0.00 0.00 178.44 178.38 3h1h h HIS 192 N -0.82 -1.46 0.07 1.13 3.86 0.35 -1.34 115.15 116.94 3h1h h HIS 192 Ca -0.03 0.05 0.02 0.00 -1.16 0.00 0.00 60.37 59.25 3h1h h HIS 192 Cb 0.52 0.64 -0.05 0.00 1.06 0.00 0.00 27.41 29.58 3h1h h HIS 192 CO 0.06 -0.55 -0.41 0.45 0.86 0.00 0.00 177.93 178.34 3h1h h HIS 193 N -0.63 -1.17 -1.13 2.45 3.86 -0.87 0.39 115.15 118.05 3h1h h HIS 193 Ca 0.03 0.03 0.33 0.00 -1.16 0.00 0.00 60.37 59.60 3h1h h HIS 193 Cb 0.70 0.50 -0.11 0.00 1.06 0.00 0.00 27.41 29.56 3h1h h HIS 193 CO -0.50 -0.50 0.72 0.35 0.86 0.00 0.00 177.93 178.85 3h1h h PHE 194 N -0.62 0.64 0.22 2.45 3.57 -0.88 -0.02 116.94 122.32 3h1h h PHE 194 Ca 0.03 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 3h1h h PHE 194 Cb 0.66 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.23 3h1h h PHE 194 CO -0.38 -0.05 -0.11 0.28 -2.23 0.00 0.00 178.31 175.82 3h1h h VAL 195 N 0.29 0.27 -1.09 1.41 2.07 0.07 -2.97 116.25 116.30 3h1h h VAL 195 Ca 0.68 -0.91 0.30 0.00 0.82 0.00 0.00 66.70 67.60 3h1h h VAL 195 Cb 1.87 0.46 -0.06 0.00 -1.52 0.00 0.00 31.29 32.04 3h1h h VAL 195 CO -0.37 0.08 0.76 1.56 0.02 0.00 0.00 177.57 179.61 3h1h h GLN 196 N -1.04 0.13 -0.00 1.57 4.20 -0.03 0.47 115.11 120.40 3h1h h GLN 196 Ca -0.03 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.67 3h1h h GLN 196 Cb 0.35 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.10 3h1h h GLN 196 CO 0.05 0.08 -0.52 0.09 -0.67 0.00 0.00 178.83 177.86 3h1h n ASN 197 N -4.34 0.88 0.00 1.46 3.02 -0.11 -4.58 115.26 111.58 3h1h n ASN 197 Ca 0.24 -0.68 0.00 0.00 -0.03 0.00 0.00 54.58 54.11 3h1h n ASN 197 Cb 1.07 0.37 0.00 0.00 -0.61 0.00 0.00 39.78 40.62 3h1h n ASN 197 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3h1h n ASN 198 N -1.13 2.91 -3.50 6.41 3.02 -0.01 -2.44 115.26 120.52 3h1h n ASN 198 Ca 0.07 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.22 3h1h n ASN 198 Cb 0.35 0.20 -0.01 0.00 -0.61 0.00 0.00 39.78 39.71 3h1h n ASN 198 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3h1h n PHE 199 N -1.68 2.67 -4.31 3.10 3.01 0.14 -4.70 117.46 115.69 3h1h n PHE 199 Ca 0.00 -2.92 -0.34 0.00 1.01 0.00 0.00 57.45 55.20 3h1h n PHE 199 Cb 0.31 -2.12 -0.10 0.00 -0.01 0.00 0.00 39.48 37.56 3h1h n PHE 199 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 3h1h s THR 200 N 0.49 4.27 0.47 4.37 -4.23 -1.26 -4.86 115.64 114.89 3h1h s THR 200 Ca 0.56 -0.24 0.27 0.00 -1.18 0.00 0.00 61.69 61.10 3h1h s THR 200 Cb 0.17 -2.85 0.39 0.00 1.34 0.00 0.00 72.50 71.55 3h1h s THR 200 CO -0.07 0.54 1.09 -1.54 -0.54 0.00 0.00 174.62 174.10 3h1h n SER 201 N 2.84 0.00 -0.44 3.99 3.41 -1.23 0.17 113.62 122.36 3h1h n SER 201 Ca -0.18 0.66 0.13 0.00 -0.26 0.00 0.00 58.87 59.22 3h1h n SER 201 Cb 0.53 -0.26 0.52 0.00 -0.26 0.00 0.00 64.21 64.74 3h1h n SER 201 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h1h n ALA 202 N -2.24 2.57 -0.02 7.33 0.00 -1.25 -2.37 120.51 124.53 3h1h n ALA 202 Ca 0.23 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.24 3h1h n ALA 202 Cb 1.33 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 19.60 3h1h n ALA 202 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3h1h n ARG 203 N 0.08 0.24 -4.28 0.00 1.74 0.45 -4.93 116.66 109.96 3h1h n ARG 203 Ca 0.19 -0.79 -0.29 0.00 -0.77 0.00 0.00 57.85 56.18 3h1h n ARG 203 Cb 0.32 -0.99 -0.11 0.00 -1.02 0.00 0.00 32.46 30.67 3h1h n ARG 203 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 3h1h s MET 204 N -0.30 1.92 0.00 5.56 -1.94 -1.17 -2.01 119.30 121.36 3h1h s MET 204 Ca 0.00 -1.16 0.01 0.00 -1.71 0.00 0.00 55.69 52.83 3h1h s MET 204 Cb 0.00 -2.17 -0.00 0.00 2.01 0.00 0.00 34.83 34.67 3h1h s MET 204 CO 0.00 0.48 -0.03 0.00 -0.01 0.00 0.00 175.02 175.45 3h1h s ALA 205 N -1.29 0.28 -0.86 3.03 0.00 -0.79 -3.03 121.76 119.11 3h1h s ALA 205 Ca 0.20 -0.18 0.01 0.00 0.00 0.00 0.00 51.96 51.99 3h1h s ALA 205 Cb -0.10 -0.06 0.29 0.00 0.00 0.00 0.00 23.12 23.25 3h1h s ALA 205 CO 0.12 0.06 1.20 -0.11 0.00 0.00 0.00 175.76 177.03 3h1h n LEU 206 N 2.89 5.37 -4.77 0.00 7.94 -0.25 -0.88 117.00 127.30 3h1h n LEU 206 Ca -0.13 -5.37 -0.37 0.00 -1.11 0.00 0.00 56.01 49.02 3h1h n LEU 206 Cb 0.59 -0.96 0.01 0.00 0.53 0.00 0.00 43.42 43.58 3h1h n LEU 206 CO 0.25 1.94 0.86 -0.69 -1.11 0.00 0.00 177.39 178.65 3h1h s VAL 207 N -3.04 2.84 -0.29 1.96 1.01 -0.82 -3.85 120.40 118.20 3h1h s VAL 207 Ca 0.37 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.97 3h1h s VAL 207 Cb 0.13 -3.31 0.19 0.00 0.00 0.00 0.00 36.38 33.39 3h1h s VAL 207 CO 0.01 -0.02 0.69 -0.83 0.00 0.00 0.00 175.10 174.95 3h1h s GLY 208 N -1.29 -1.06 0.27 4.51 0.00 -1.09 -0.07 107.32 108.59 3h1h s GLY 208 Ca 0.67 1.58 -0.27 0.00 0.00 0.00 0.00 44.72 46.69 3h1h s GLY 208 CO 0.37 3.65 0.92 -0.42 0.00 0.00 0.00 173.10 177.63 3h1h s ILE 209 N 2.87 4.18 0.00 0.90 1.01 -1.18 -3.17 121.20 125.79 3h1h s ILE 209 Ca 0.15 1.91 0.00 0.00 0.00 0.00 0.00 60.65 62.70 3h1h s ILE 209 Cb -0.11 -4.15 0.00 0.00 0.01 0.00 0.00 42.46 38.22 3h1h s ILE 209 CO -0.23 0.32 0.00 0.61 0.00 0.00 0.00 174.94 175.64 3h1h n GLY 210 N 1.03 0.55 3.14 6.18 0.00 -0.21 -2.22 105.19 113.66 3h1h n GLY 210 Ca -0.00 -0.82 -0.08 0.00 0.00 0.00 0.00 46.02 45.11 3h1h n GLY 210 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h1h s VAL 211 N -2.00 0.16 -0.09 1.61 -7.23 -1.26 -4.67 120.40 106.92 3h1h s VAL 211 Ca 0.00 -1.74 -0.26 0.00 -1.81 0.00 0.00 61.98 58.17 3h1h s VAL 211 Cb 0.00 -1.70 -0.03 0.00 0.56 0.00 0.00 36.38 35.21 3h1h s VAL 211 CO 0.00 -0.72 0.84 -0.75 -0.31 0.00 0.00 175.10 174.15 3h1h s LYS 212 N -3.96 4.42 0.31 4.82 2.20 -1.26 -3.31 119.74 122.96 3h1h s LYS 212 Ca 0.13 1.10 0.07 0.00 -0.36 0.00 0.00 55.97 56.91 3h1h s LYS 212 Cb 0.07 -3.50 0.88 0.00 -1.51 0.00 0.00 37.83 33.77 3h1h s LYS 212 CO -0.05 -0.12 1.64 1.25 -0.36 0.00 0.00 175.35 177.71 3h1h h HIS 213 N 6.98 0.54 -0.61 4.03 -0.00 -1.94 -0.66 115.15 123.49 3h1h h HIS 213 Ca -0.36 0.05 0.02 0.00 -0.00 0.00 0.00 60.37 60.08 3h1h h HIS 213 Cb 1.18 -0.09 -0.04 0.00 -0.00 0.00 0.00 27.41 28.46 3h1h h HIS 213 CO 0.68 -0.23 0.38 0.66 -0.00 0.00 0.00 177.93 179.42 3h1h h SER 214 N 0.22 0.62 -0.02 3.26 4.64 -1.99 0.44 113.55 120.73 3h1h h SER 214 Ca 0.63 -0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.95 3h1h h SER 214 Cb 1.38 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3h1h h SER 214 CO -0.67 0.44 0.01 0.44 -0.87 0.00 0.00 176.83 176.18 3h1h h ASP 215 N 0.75 0.02 0.15 4.97 3.32 -1.53 0.12 116.42 124.22 3h1h h ASP 215 Ca 0.24 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.23 3h1h h ASP 215 Cb 0.00 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3h1h h ASP 215 CO -0.09 0.05 -0.16 0.25 -1.72 0.00 0.00 179.24 177.57 3h1h h LEU 216 N -0.00 0.03 0.03 1.55 5.85 -1.17 -2.83 115.31 118.77 3h1h h LEU 216 Ca 0.01 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 3h1h h LEU 216 Cb 0.03 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.05 3h1h h LEU 216 CO -0.00 0.19 -0.01 0.50 -0.34 0.00 0.00 178.44 178.77 3h1h h LYS 217 N 0.03 -0.04 -0.63 1.25 3.64 -0.42 -3.04 116.57 117.36 3h1h h LYS 217 Ca 0.00 0.00 0.18 0.00 -1.27 0.00 0.00 60.65 59.57 3h1h h LYS 217 Cb 0.30 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 3h1h h LYS 217 CO 0.02 0.54 0.50 0.37 -2.27 0.00 0.00 179.45 178.61 3h1h h GLN 218 N -0.64 0.00 0.30 1.90 4.15 -0.77 -1.27 115.11 118.79 3h1h h GLN 218 Ca -0.00 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.40 3h1h h GLN 218 Cb 0.59 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.28 3h1h h GLN 218 CO 0.01 0.00 -0.15 0.28 -1.93 0.00 0.00 178.83 177.04 3h1h h VAL 219 N 0.00 0.00 -0.88 2.39 2.07 -1.51 -3.06 116.25 115.26 3h1h h VAL 219 Ca 0.30 -0.54 0.19 0.00 0.82 0.00 0.00 66.70 67.47 3h1h h VAL 219 Cb 1.30 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.91 3h1h h VAL 219 CO -0.00 0.00 -0.16 0.00 0.02 0.00 0.00 177.57 177.43 3h1h h ALA 220 N -1.27 0.69 -3.00 1.67 0.00 -1.26 -2.20 119.26 113.89 3h1h h ALA 220 Ca -0.04 0.33 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3h1h h ALA 220 Cb 0.31 0.63 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3h1h h ALA 220 CO 0.07 -0.42 0.00 0.39 0.00 0.00 0.00 179.25 179.29 3h1h n GLU 221 N -5.53 0.00 0.00 0.00 1.02 -0.55 -2.01 120.64 113.58 3h1h n GLU 221 Ca 0.15 0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.43 3h1h n GLU 221 Cb 0.49 -0.90 0.00 0.00 -0.02 0.00 0.00 31.44 31.01 3h1h n GLU 221 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 3h1h n GLN 222 N -0.54 0.00 0.01 3.49 7.27 -1.16 -4.28 117.38 122.17 3h1h n GLN 222 Ca 0.00 0.47 0.00 0.00 0.07 0.00 0.00 57.00 57.54 3h1h n GLN 222 Cb 0.00 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.15 3h1h n GLN 222 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 3h1h n PHE 223 N -1.47 -0.02 -1.47 3.69 3.01 -0.83 -4.96 117.46 115.41 3h1h n PHE 223 Ca 0.00 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.31 3h1h n PHE 223 Cb 0.00 0.03 -0.13 0.00 -0.01 0.00 0.00 39.48 39.36 3h1h n PHE 223 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 3h1h n LEU 224 N -2.62 -0.07 -0.05 4.37 4.77 -0.85 -4.63 117.00 117.92 3h1h n LEU 224 Ca 0.00 -1.19 -0.05 0.00 -0.03 0.00 0.00 56.01 54.74 3h1h n LEU 224 Cb 0.00 -1.07 -0.07 0.00 -2.33 0.00 0.00 43.42 39.96 3h1h n LEU 224 CO 0.00 -2.12 -0.82 -3.20 -1.33 0.00 0.00 177.39 169.92 3h1h n ASN 225 N 11.64 2.89 -4.53 -1.43 5.15 -1.26 -4.86 115.26 122.86 3h1h n ASN 225 Ca 0.50 -0.02 -0.56 0.00 -0.60 0.00 0.00 54.58 53.90 3h1h n ASN 225 Cb 0.32 0.45 -0.08 0.00 -0.53 0.00 0.00 39.78 39.94 3h1h n ASN 225 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 3h1h n ILE 226 N -2.48 0.19 -0.97 -1.44 5.41 -1.26 -4.83 119.36 113.98 3h1h n ILE 226 Ca -0.16 -0.11 -0.38 0.00 1.00 0.00 0.00 62.75 63.09 3h1h n ILE 226 Cb 0.77 -1.20 0.05 0.00 -0.71 0.00 0.00 39.64 38.54 3h1h n ILE 226 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 3h1h n ARG 227 N 6.74 -0.15 0.00 0.38 1.74 -1.26 -4.27 116.66 119.84 3h1h n ARG 227 Ca 0.37 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.41 3h1h n ARG 227 Cb 0.12 -1.07 0.00 0.00 -1.02 0.00 0.00 32.46 30.49 3h1h n ARG 227 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3h1h n SER 228 N 2.97 -0.05 0.00 0.55 3.41 -1.26 -3.53 113.62 115.71 3h1h n SER 228 Ca -0.02 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.54 3h1h n SER 228 Cb 0.72 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.67 3h1h n SER 228 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h1h n GLY 229 N 3.55 -0.41 0.00 5.00 0.00 -1.26 -4.72 105.19 107.35 3h1h n GLY 229 Ca 0.00 -2.26 0.00 0.00 0.00 0.00 0.00 46.02 43.76 3h1h n GLY 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1h n ALA 230 N -0.60 1.37 -0.72 4.61 0.00 -1.26 -3.74 120.51 120.18 3h1h n ALA 230 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3h1h n ALA 230 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3h1h n ALA 230 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h1h n GLY 231 N 1.46 0.42 3.32 0.00 0.00 -1.26 -4.74 105.19 104.38 3h1h n GLY 231 Ca 0.00 -0.81 -0.46 0.00 0.00 0.00 0.00 46.02 44.75 3h1h n GLY 231 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3h1h n THR 232 N -0.39 1.77 -4.49 2.61 -1.04 -1.02 -4.95 114.28 106.77 3h1h n THR 232 Ca 0.00 -0.49 -0.33 0.00 -2.04 0.00 0.00 64.05 61.19 3h1h n THR 232 Cb 0.00 0.00 -0.16 0.00 -1.82 0.00 0.00 70.33 68.35 3h1h n THR 232 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 3h1h s SER 233 N -0.98 3.50 0.23 8.00 0.01 -1.26 -4.92 113.70 118.28 3h1h s SER 233 Ca 0.62 -0.52 -0.32 0.00 1.31 0.00 0.00 55.95 57.05 3h1h s SER 233 Cb -0.87 -1.53 -0.13 0.00 0.21 0.00 0.00 66.02 63.70 3h1h s SER 233 CO 0.56 0.07 1.60 -0.24 0.41 0.00 0.00 173.24 175.64 3h1h n SER 234 N 4.16 3.55 -4.73 2.44 2.88 -1.26 -4.95 113.62 115.71 3h1h n SER 234 Ca -0.19 1.11 -0.34 0.00 -1.33 0.00 0.00 58.87 58.11 3h1h n SER 234 Cb 0.51 -1.52 0.08 0.00 -0.75 0.00 0.00 64.21 62.53 3h1h n SER 234 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3h1h s ALA 235 N 0.55 2.21 0.37 -1.46 0.00 -1.26 -4.91 121.76 117.26 3h1h s ALA 235 Ca 0.71 0.87 -0.28 0.00 0.00 0.00 0.00 51.96 53.26 3h1h s ALA 235 Cb -0.56 -3.46 -0.11 0.00 0.00 0.00 0.00 23.12 18.99 3h1h s ALA 235 CO 0.41 -1.72 1.44 1.63 0.00 0.00 0.00 175.76 177.52 3h1h n LYS 236 N -2.53 2.53 -2.28 0.00 4.76 -1.26 -4.77 118.16 114.62 3h1h n LYS 236 Ca 0.13 0.89 -0.42 0.00 -2.87 0.00 0.00 58.31 56.03 3h1h n LYS 236 Cb 0.50 -2.58 -0.02 0.00 -1.84 0.00 0.00 35.03 31.09 3h1h n LYS 236 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3h1h s ALA 237 N -1.09 2.90 -0.20 7.82 0.00 -1.26 -4.78 121.76 125.15 3h1h s ALA 237 Ca 0.54 -0.23 -0.16 0.00 0.00 0.00 0.00 51.96 52.11 3h1h s ALA 237 Cb -0.50 -4.02 -0.04 0.00 0.00 0.00 0.00 23.12 18.56 3h1h s ALA 237 CO 0.63 -2.66 0.40 0.99 0.00 0.00 0.00 175.76 175.12 3h1h s THR 238 N 6.08 5.20 0.32 0.00 2.01 -1.26 -4.99 115.64 123.00 3h1h s THR 238 Ca 0.63 0.72 -0.28 0.00 0.31 0.00 0.00 61.69 63.08 3h1h s THR 238 Cb -0.14 -3.73 -0.09 0.00 0.01 0.00 0.00 72.50 68.54 3h1h s THR 238 CO 0.30 0.26 1.10 -0.47 -0.69 0.00 0.00 174.62 175.12 3h1h s TYR 239 N 1.26 3.44 -0.03 4.92 5.04 -1.26 -2.36 117.35 128.36 3h1h s TYR 239 Ca 0.19 1.67 -0.06 0.00 -2.44 0.00 0.00 57.07 56.43 3h1h s TYR 239 Cb -0.15 -3.26 -0.02 0.00 0.35 0.00 0.00 41.96 38.88 3h1h s TYR 239 CO 0.08 -0.67 -0.12 1.87 -1.34 0.00 0.00 175.55 175.37 3h1h n TRP 240 N 0.75 0.00 -0.87 4.97 -0.00 -0.87 -4.81 117.44 116.62 3h1h n TRP 240 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.51 3h1h n TRP 240 Cb 0.46 -0.17 0.00 0.00 -0.00 0.00 0.00 31.31 31.60 3h1h n TRP 240 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3h1h n GLY 241 N 2.46 0.87 3.85 5.87 0.00 -1.10 -5.03 105.19 112.10 3h1h n GLY 241 Ca -0.05 -0.49 -0.24 0.00 0.00 0.00 0.00 46.02 45.24 3h1h n GLY 241 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h1h s GLY 242 N -2.51 2.27 -0.10 -0.02 0.00 0.25 -4.79 107.32 102.43 3h1h s GLY 242 Ca 0.00 -1.73 -0.01 0.00 0.00 0.00 0.00 44.72 42.97 3h1h s GLY 242 CO 0.00 -1.84 -0.01 1.85 0.00 0.00 0.00 173.10 173.10 3h1h s GLU 243 N -4.12 0.78 -0.12 2.90 2.12 -1.26 -2.38 118.70 116.61 3h1h s GLU 243 Ca 0.41 -0.03 0.00 0.00 0.36 0.00 0.00 54.97 55.72 3h1h s GLU 243 Cb -0.01 -1.23 -0.01 0.00 0.26 0.00 0.00 34.13 33.13 3h1h s GLU 243 CO 0.24 -0.34 -0.15 0.42 -0.54 0.00 0.00 175.26 174.89 3h1h s ILE 244 N 1.91 2.91 -0.13 -3.70 1.01 -1.02 -5.01 121.20 117.17 3h1h s ILE 244 Ca 0.04 -0.71 0.01 0.00 0.00 0.00 0.00 60.65 59.99 3h1h s ILE 244 Cb -0.13 -2.21 0.02 0.00 0.01 0.00 0.00 42.46 40.15 3h1h s ILE 244 CO -0.06 0.53 -0.14 -0.13 0.00 0.00 0.00 174.94 175.14 3h1h s ARG 245 N 0.33 2.19 -0.45 2.79 0.52 -1.26 -2.29 118.95 120.79 3h1h s ARG 245 Ca -0.12 -0.53 -0.09 0.00 -0.52 0.00 0.00 55.73 54.47 3h1h s ARG 245 Cb -0.16 -1.97 0.11 0.00 0.52 0.00 0.00 34.95 33.45 3h1h s ARG 245 CO 0.06 -0.17 0.31 -2.00 0.02 0.00 0.00 175.30 173.53 3h1h s GLU 246 N 1.30 2.50 -0.42 3.54 2.12 -0.33 -5.02 118.70 122.39 3h1h s GLU 246 Ca 0.00 -1.67 -0.27 0.00 0.36 0.00 0.00 54.97 53.39 3h1h s GLU 246 Cb -0.14 -3.86 0.02 0.00 0.26 0.00 0.00 34.13 30.41 3h1h s GLU 246 CO -0.07 -1.11 1.03 -1.14 -0.54 0.00 0.00 175.26 173.43 3h1h s GLN 247 N 1.37 3.77 0.00 4.30 2.00 -1.26 -1.56 119.66 128.29 3h1h s GLN 247 Ca 0.05 0.57 0.00 0.00 -2.00 0.00 0.00 55.36 53.98 3h1h s GLN 247 Cb -0.25 -3.86 0.00 0.00 0.80 0.00 0.00 33.01 29.70 3h1h s GLN 247 CO 0.00 -1.16 0.00 0.27 -0.50 0.00 0.00 175.29 173.90 3h1h n ASN 248 N 7.27 0.71 0.00 6.67 2.04 -0.90 -4.94 115.26 126.11 3h1h n ASN 248 Ca 0.10 -0.19 0.00 0.00 -0.44 0.00 0.00 54.58 54.05 3h1h n ASN 248 Cb 0.48 0.52 0.00 0.00 -2.53 0.00 0.00 39.78 38.25 3h1h n ASN 248 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3h1h n GLY 249 N 0.73 2.07 3.65 4.83 0.00 -1.24 -4.93 105.19 110.30 3h1h n GLY 249 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3h1h n GLY 249 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3h1h n HIS 250 N -2.00 1.64 0.49 1.61 8.25 -1.26 -4.58 115.22 119.37 3h1h n HIS 250 Ca 0.00 0.56 0.06 0.00 -0.26 0.00 0.00 57.72 58.08 3h1h n HIS 250 Cb 0.00 -2.30 0.29 0.00 1.12 0.00 0.00 29.99 29.10 3h1h n HIS 250 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 3h1h n SER 251 N 0.52 0.00 -4.34 0.41 3.41 -1.26 -2.38 113.62 109.98 3h1h n SER 251 Ca 0.08 0.43 -0.33 0.00 -0.26 0.00 0.00 58.87 58.79 3h1h n SER 251 Cb 0.38 -0.46 -0.15 0.00 -0.26 0.00 0.00 64.21 63.72 3h1h n SER 251 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3h1h s LEU 252 N -2.92 2.57 -0.24 1.04 1.43 -1.26 -2.34 118.68 116.95 3h1h s LEU 252 Ca 0.08 -0.38 -0.09 0.00 -1.03 0.00 0.00 54.13 52.71 3h1h s LEU 252 Cb 0.09 -1.56 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 3h1h s LEU 252 CO 0.24 0.17 0.12 -0.69 0.23 0.00 0.00 176.35 176.42 3h1h s VAL 253 N 0.29 4.88 -0.12 -1.59 1.01 -0.25 -4.50 120.40 120.12 3h1h s VAL 253 Ca -0.12 0.02 -0.07 0.00 0.00 0.00 0.00 61.98 61.82 3h1h s VAL 253 Cb -0.16 -3.28 -0.04 0.00 0.00 0.00 0.00 36.38 32.90 3h1h s VAL 253 CO 0.06 0.33 0.12 -1.00 0.00 0.00 0.00 175.10 174.62 3h1h s HIS 254 N 1.34 3.54 -0.05 5.22 3.76 -0.47 -1.94 115.29 126.69 3h1h s HIS 254 Ca 0.06 0.48 -0.10 0.00 -0.15 0.00 0.00 55.06 55.35 3h1h s HIS 254 Cb -0.15 -1.94 0.02 0.00 1.11 0.00 0.00 32.58 31.63 3h1h s HIS 254 CO 0.06 0.68 0.24 0.00 -0.85 0.00 0.00 174.74 174.87 3h1h s ALA 255 N -0.93 -0.60 -0.03 -1.40 0.00 -0.60 -1.17 121.76 117.02 3h1h s ALA 255 Ca 0.14 0.41 -0.01 0.00 0.00 0.00 0.00 51.96 52.51 3h1h s ALA 255 Cb -0.12 -0.17 0.03 0.00 0.00 0.00 0.00 23.12 22.86 3h1h s ALA 255 CO 0.03 -0.18 0.05 0.00 0.00 0.00 0.00 175.76 175.67 3h1h s ALA 256 N -0.60 0.10 -0.15 0.00 0.00 -0.68 -0.06 121.76 120.38 3h1h s ALA 256 Ca -0.07 0.30 0.02 0.00 0.00 0.00 0.00 51.96 52.21 3h1h s ALA 256 Cb -0.04 -0.42 0.01 0.00 0.00 0.00 0.00 23.12 22.67 3h1h s ALA 256 CO 0.02 -0.27 -0.19 0.08 0.00 0.00 0.00 175.76 175.39 3h1h s VAL 257 N 1.54 1.92 0.39 0.00 1.01 -1.00 -1.37 120.40 122.88 3h1h s VAL 257 Ca -0.03 -0.88 0.06 0.00 0.00 0.00 0.00 61.98 61.13 3h1h s VAL 257 Cb -0.13 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.51 3h1h s VAL 257 CO -0.03 0.52 0.21 0.68 0.00 0.00 0.00 175.10 176.48 3h1h s VAL 258 N 1.05 0.28 0.05 2.92 -7.23 -0.74 -1.92 120.40 114.80 3h1h s VAL 258 Ca -0.02 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.06 3h1h s VAL 258 Cb -0.14 -2.37 0.00 0.00 0.56 0.00 0.00 36.38 34.43 3h1h s VAL 258 CO -0.06 0.00 0.18 -0.89 -0.31 0.00 0.00 175.10 174.02 3h1h s THR 259 N -3.26 0.12 -0.18 5.32 2.01 0.11 -1.43 115.64 118.33 3h1h s THR 259 Ca 0.30 -0.99 -0.35 0.00 0.31 0.00 0.00 61.69 60.96 3h1h s THR 259 Cb 0.02 -1.02 -0.12 0.00 0.01 0.00 0.00 72.50 71.39 3h1h s THR 259 CO 0.21 -0.55 1.93 1.21 -0.69 0.00 0.00 174.62 176.73 3h1h n GLU 260 N 0.51 1.80 0.00 4.92 2.13 -1.26 -1.33 120.64 127.41 3h1h n GLU 260 Ca -0.18 0.63 0.00 0.00 0.66 0.00 0.00 57.16 58.27 3h1h n GLU 260 Cb 0.60 -2.55 0.00 0.00 0.27 0.00 0.00 31.44 29.75 3h1h n GLU 260 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3h1h n GLY 261 N 4.81 1.54 3.93 8.31 0.00 0.29 -4.76 105.19 119.31 3h1h n GLY 261 Ca 0.27 -1.62 -0.20 0.00 0.00 0.00 0.00 46.02 44.47 3h1h n GLY 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1h s ALA 262 N -3.36 4.26 0.32 4.61 0.00 -1.26 -4.37 121.76 121.95 3h1h s ALA 262 Ca 0.00 -1.80 0.08 0.00 0.00 0.00 0.00 51.96 50.23 3h1h s ALA 262 Cb 0.00 -1.23 -0.03 0.00 0.00 0.00 0.00 23.12 21.86 3h1h s ALA 262 CO 0.00 -0.28 0.23 0.00 0.00 0.00 0.00 175.76 175.71 3h1h s ALA 263 N -2.45 3.69 0.17 0.00 0.00 -1.26 -2.72 121.76 119.19 3h1h s ALA 263 Ca 0.51 -1.64 -0.32 0.00 0.00 0.00 0.00 51.96 50.51 3h1h s ALA 263 Cb -0.06 -1.10 -0.11 0.00 0.00 0.00 0.00 23.12 21.86 3h1h s ALA 263 CO 0.30 0.08 1.67 0.08 0.00 0.00 0.00 175.76 177.88 3h1h s VAL 264 N -2.29 2.42 -0.48 0.00 1.01 -0.34 -2.22 120.40 118.49 3h1h s VAL 264 Ca 0.38 0.24 -0.02 0.00 0.00 0.00 0.00 61.98 62.57 3h1h s VAL 264 Cb -0.06 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.18 3h1h s VAL 264 CO 0.25 0.01 0.41 0.61 0.00 0.00 0.00 175.10 176.39 3h1h n GLY 265 N 3.92 0.35 3.58 4.51 0.00 -1.26 -4.89 105.19 111.40 3h1h n GLY 265 Ca 0.15 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 3h1h n GLY 265 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h1h s SER 266 N -3.21 4.41 0.13 1.61 0.15 -0.94 -5.02 113.70 110.83 3h1h s SER 266 Ca 0.16 -0.35 -0.16 0.00 0.70 0.00 0.00 55.95 56.30 3h1h s SER 266 Cb -0.07 -0.87 -0.01 0.00 -1.71 0.00 0.00 66.02 63.36 3h1h s SER 266 CO 0.26 0.19 1.65 0.00 1.20 0.00 0.00 173.24 176.55 3h1h h ALA 267 N 3.77 0.50 0.00 5.45 0.00 -1.96 -1.97 119.26 125.05 3h1h h ALA 267 Ca -0.49 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.26 3h1h h ALA 267 Cb 1.17 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3h1h h ALA 267 CO 0.52 0.15 0.00 -1.91 0.00 0.00 0.00 179.25 178.01 3h1h n GLU 268 N -4.61 0.17 0.01 0.00 2.13 -1.26 -3.92 120.64 113.16 3h1h n GLU 268 Ca -0.01 0.37 -0.01 0.00 0.66 0.00 0.00 57.16 58.17 3h1h n GLU 268 Cb 0.18 -1.80 -0.00 0.00 0.27 0.00 0.00 31.44 30.08 3h1h n GLU 268 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3h1h h ALA 269 N 2.34 -0.87 -0.34 4.31 0.00 -1.62 -2.43 119.26 120.65 3h1h h ALA 269 Ca 0.00 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.00 3h1h h ALA 269 Cb 0.39 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3h1h h ALA 269 CO 0.00 -0.87 0.64 -0.91 0.00 0.00 0.00 179.25 178.11 3h1h h ASN 270 N -0.04 0.00 0.19 0.00 2.35 -1.68 0.67 115.58 117.07 3h1h h ASN 270 Ca -0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 3h1h h ASN 270 Cb 0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.41 3h1h h ASN 270 CO 0.00 0.00 -0.09 0.00 -1.65 0.00 0.00 177.43 175.69 3h1h h ALA 271 N 1.04 -0.25 -0.62 -0.83 0.00 -1.61 -3.08 119.26 113.90 3h1h h ALA 271 Ca 0.16 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3h1h h ALA 271 Cb 1.44 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.30 3h1h h ALA 271 CO -0.00 -0.47 0.39 0.74 0.00 0.00 0.00 179.25 179.91 3h1h h PHE 272 N -0.60 0.80 -0.63 0.00 -1.00 -0.60 -1.51 116.94 113.39 3h1h h PHE 272 Ca -0.03 0.01 0.12 0.00 2.81 0.00 0.00 57.97 60.88 3h1h h PHE 272 Cb 0.44 -0.26 -0.09 0.00 3.61 0.00 0.00 35.95 39.65 3h1h h PHE 272 CO 0.03 0.52 0.16 0.77 -1.61 0.00 0.00 178.31 178.18 3h1h h SER 273 N 0.84 0.05 0.16 2.17 0.02 -1.58 1.19 113.55 116.39 3h1h h SER 273 Ca 0.22 0.11 -0.10 0.00 -0.84 0.00 0.00 61.79 61.18 3h1h h SER 273 Cb -0.06 0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 3h1h h SER 273 CO -0.05 0.02 -0.37 0.58 -1.14 0.00 0.00 176.83 175.88 3h1h h VAL 274 N 0.29 1.29 -0.21 2.27 2.07 -1.37 -1.58 116.25 119.01 3h1h h VAL 274 Ca 0.34 -1.44 -0.17 0.00 0.82 0.00 0.00 66.70 66.24 3h1h h VAL 274 Cb 0.50 1.60 -0.00 0.00 -1.52 0.00 0.00 31.29 31.87 3h1h h VAL 274 CO -0.41 0.44 -0.57 0.25 0.02 0.00 0.00 177.57 177.30 3h1h h LEU 275 N 0.25 0.75 0.14 2.57 5.85 0.15 -1.95 115.31 123.07 3h1h h LEU 275 Ca 0.03 -0.41 0.01 0.00 0.84 0.00 0.00 57.88 58.34 3h1h h LEU 275 Cb 0.77 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.55 3h1h h LEU 275 CO 0.06 1.16 -0.44 -0.61 -0.34 0.00 0.00 178.44 178.27 3h1h h GLN 276 N 0.51 -0.63 0.00 1.25 4.15 0.19 -0.70 115.11 119.88 3h1h h GLN 276 Ca 0.00 0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.46 3h1h h GLN 276 Cb 1.15 0.14 -0.00 0.00 0.21 0.00 0.00 27.48 28.98 3h1h h GLN 276 CO 0.11 -0.42 -0.01 0.45 -1.93 0.00 0.00 178.83 177.03 3h1h h HIS 277 N -0.66 0.00 -0.03 3.99 3.86 -1.28 0.13 115.15 121.15 3h1h h HIS 277 Ca -0.01 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.04 3h1h h HIS 277 Cb 0.65 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.10 3h1h h HIS 277 CO -0.40 0.01 -0.70 0.28 0.86 0.00 0.00 177.93 177.98 3h1h h VAL 278 N 0.00 1.44 0.11 2.45 2.07 -0.53 -3.17 116.25 118.63 3h1h h VAL 278 Ca -0.00 -2.24 -0.27 0.00 0.82 0.00 0.00 66.70 65.00 3h1h h VAL 278 Cb 0.04 2.19 -0.00 0.00 -1.52 0.00 0.00 31.29 32.00 3h1h h VAL 278 CO 0.00 0.65 -1.27 -0.07 0.02 0.00 0.00 177.57 176.90 3h1h h LEU 279 N 0.11 0.38 0.00 2.57 3.38 0.38 -3.20 115.31 118.92 3h1h h LEU 279 Ca -0.02 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.53 3h1h h LEU 279 Cb 1.24 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.87 3h1h h LEU 279 CO 0.10 1.33 0.00 0.61 0.09 0.00 0.00 178.44 180.58 3h1h n GLY 280 N 1.54 2.64 2.66 0.83 0.00 0.27 0.25 105.19 113.39 3h1h n GLY 280 Ca -0.09 -0.75 -0.27 0.00 0.00 0.00 0.00 46.02 44.90 3h1h n GLY 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1h n ALA 281 N 0.00 3.51 0.00 4.61 0.00 -1.26 -0.91 120.51 126.46 3h1h n ALA 281 Ca 0.00 -4.40 0.00 0.00 0.00 0.00 0.00 53.44 49.04 3h1h n ALA 281 Cb 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.50 3h1h n ALA 281 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h1h n GLY 282 N 1.67 -0.07 3.86 0.00 0.00 -1.26 -5.01 105.19 104.37 3h1h n GLY 282 Ca 0.24 -1.58 -0.32 0.00 0.00 0.00 0.00 46.02 44.36 3h1h n GLY 282 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3h1h s PRO 283 N -3.74 3.95 -0.00 1.61 0.04 -1.26 -4.98 135.00 130.62 3h1h s PRO 283 Ca 0.00 0.60 0.06 0.00 0.04 0.00 0.00 61.00 61.70 3h1h s PRO 283 Cb 0.00 -2.44 -0.07 0.00 0.04 0.00 0.00 34.50 32.02 3h1h s PRO 283 CO 0.00 0.14 0.24 1.28 0.04 0.00 0.00 177.00 178.70 3h1h n LEU 284 N -0.51 0.24 -4.25 -3.56 4.77 -1.26 -4.93 117.00 107.50 3h1h n LEU 284 Ca 0.03 -0.40 -0.34 0.00 -0.03 0.00 0.00 56.01 55.27 3h1h n LEU 284 Cb 0.53 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.47 3h1h n LEU 284 CO 0.43 0.06 -0.45 -0.63 -1.33 0.00 0.00 177.39 175.46 3h1h s ILE 285 N -1.75 2.79 -0.03 -0.08 1.01 -1.26 -5.07 121.20 116.81 3h1h s ILE 285 Ca 0.01 -0.70 -0.35 0.00 0.00 0.00 0.00 60.65 59.61 3h1h s ILE 285 Cb 0.05 -2.22 -0.14 0.00 0.01 0.00 0.00 42.46 40.16 3h1h s ILE 285 CO 0.26 0.49 1.70 1.17 0.00 0.00 0.00 174.94 178.56 3h1h n LYS 286 N 4.45 1.86 -1.08 2.79 4.81 -1.26 0.22 118.16 129.96 3h1h n LYS 286 Ca -0.19 0.68 -0.03 0.00 -0.87 0.00 0.00 58.31 57.90 3h1h n LYS 286 Cb 0.51 -2.45 -0.01 0.00 0.02 0.00 0.00 35.03 33.10 3h1h n LYS 286 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 3h1h n ARG 287 N 5.01 -1.82 -2.44 1.64 1.74 -1.26 -4.94 116.66 114.59 3h1h n ARG 287 Ca 0.21 0.57 -0.28 0.00 -0.77 0.00 0.00 57.85 57.58 3h1h n ARG 287 Cb 0.25 -4.97 0.01 0.00 -1.02 0.00 0.00 32.46 26.73 3h1h n ARG 287 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3h1h s GLY 288 N -2.11 1.55 0.47 -0.13 0.00 0.13 -5.08 107.32 102.17 3h1h s GLY 288 Ca 0.00 -0.51 -0.07 0.00 0.00 0.00 0.00 44.72 44.15 3h1h s GLY 288 CO 0.00 -0.29 0.79 -0.45 0.00 0.00 0.00 173.10 173.16 3h1h s SER 289 N -4.18 6.31 -0.37 1.64 0.15 -1.26 -4.87 113.70 111.12 3h1h s SER 289 Ca 0.51 0.99 -0.02 0.00 0.70 0.00 0.00 55.95 58.13 3h1h s SER 289 Cb -0.10 -2.27 0.09 0.00 -1.71 0.00 0.00 66.02 62.02 3h1h s SER 289 CO 0.46 -0.55 0.13 -0.44 1.20 0.00 0.00 173.24 174.04 3h1h s SER 290 N -3.91 5.11 0.01 5.45 0.01 -1.26 -4.89 113.70 114.23 3h1h s SER 290 Ca 0.48 -1.78 -0.10 0.00 1.31 0.00 0.00 55.95 55.86 3h1h s SER 290 Cb -0.10 -1.78 -0.32 0.00 0.21 0.00 0.00 66.02 64.03 3h1h s SER 290 CO 0.43 -0.44 0.91 0.58 0.41 0.00 0.00 173.24 175.13 3h1h h VAL 291 N 6.41 1.21 0.00 3.43 2.07 -1.99 -3.25 116.25 124.13 3h1h h VAL 291 Ca -0.15 -2.74 0.00 0.00 0.82 0.00 0.00 66.70 64.63 3h1h h VAL 291 Cb 1.05 2.90 0.00 0.00 -1.52 0.00 0.00 31.29 33.72 3h1h h VAL 291 CO 0.63 0.84 0.00 0.41 0.02 0.00 0.00 177.57 179.47 3h1h n THR 292 N -3.60 0.91 -3.10 2.57 -1.04 -1.26 -4.45 114.28 104.32 3h1h n THR 292 Ca -0.17 0.25 -0.44 0.00 -2.04 0.00 0.00 64.05 61.64 3h1h n THR 292 Cb 1.07 -1.11 -0.05 0.00 -1.82 0.00 0.00 70.33 68.42 3h1h n THR 292 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3h1h s SER 293 N -3.75 6.21 0.11 8.00 0.15 -1.23 -4.72 113.70 118.48 3h1h s SER 293 Ca 0.05 -1.07 -0.21 0.00 0.70 0.00 0.00 55.95 55.43 3h1h s SER 293 Cb 0.09 -2.31 -0.10 0.00 -1.71 0.00 0.00 66.02 61.99 3h1h s SER 293 CO 0.34 -1.03 1.76 0.11 1.20 0.00 0.00 173.24 175.62 3h1h h LYS 294 N 9.12 0.17 -0.20 5.44 1.57 -1.44 0.29 116.57 131.53 3h1h h LYS 294 Ca -0.28 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.53 3h1h h LYS 294 Cb 1.09 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 33.32 3h1h h LYS 294 CO 1.04 0.12 -0.07 1.25 -0.57 0.00 0.00 179.45 181.21 3h1h h LEU 295 N 0.18 -0.24 0.07 2.94 5.85 -0.46 0.78 115.31 124.43 3h1h h LEU 295 Ca 0.05 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 3h1h h LEU 295 Cb -0.02 0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.16 3h1h h LEU 295 CO -0.01 -0.09 -0.04 0.22 -0.34 0.00 0.00 178.44 178.18 3h1h h TYR 296 N -0.03 -0.09 -0.92 1.25 5.03 -1.59 -2.10 116.97 118.52 3h1h h TYR 296 Ca 0.10 -0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.42 3h1h h TYR 296 Cb 0.18 0.03 -0.05 0.00 1.55 0.00 0.00 36.73 38.45 3h1h h TYR 296 CO -0.23 0.06 0.61 1.96 -1.32 0.00 0.00 178.16 179.23 3h1h h GLN 297 N -0.23 1.19 -0.66 1.82 1.08 -0.04 -0.65 115.11 117.62 3h1h h GLN 297 Ca -0.01 -0.07 -0.06 0.00 -1.45 0.00 0.00 58.65 57.06 3h1h h GLN 297 Cb 0.19 -0.27 -0.03 0.00 -0.05 0.00 0.00 27.48 27.33 3h1h h GLN 297 CO 0.02 0.79 0.17 0.78 -0.95 0.00 0.00 178.83 179.63 3h1h h GLY 298 N 1.23 1.12 1.12 3.46 0.00 0.71 -2.72 103.07 108.00 3h1h h GLY 298 Ca 0.34 -0.70 -0.12 0.00 0.00 0.00 0.00 47.33 46.86 3h1h h GLY 298 CO -0.08 0.65 -0.12 -2.08 0.00 0.00 0.00 176.54 174.91 3h1h h VAL 299 N 0.97 1.27 -0.71 4.60 2.07 -1.08 -3.00 116.25 120.36 3h1h h VAL 299 Ca 0.21 -1.28 0.13 0.00 0.82 0.00 0.00 66.70 66.58 3h1h h VAL 299 Cb 0.35 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 31.05 3h1h h VAL 299 CO 0.00 0.45 0.47 0.00 0.02 0.00 0.00 177.57 178.52 3h1h h ALA 300 N 0.95 2.05 -0.00 1.67 0.00 -0.82 0.12 119.26 123.22 3h1h h ALA 300 Ca 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3h1h h ALA 300 Cb 0.69 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3h1h h ALA 300 CO 0.05 -0.22 -0.05 1.63 0.00 0.00 0.00 179.25 180.65 3h1h n LYS 301 N -4.48 0.29 -0.13 0.00 5.02 -1.09 -4.20 118.16 113.58 3h1h n LYS 301 Ca 0.13 -0.04 -0.26 0.00 -2.02 0.00 0.00 58.31 56.12 3h1h n LYS 301 Cb 0.46 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.88 3h1h n LYS 301 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h1h n ALA 302 N -1.32 1.09 -2.69 7.82 0.00 0.37 -5.01 120.51 120.76 3h1h n ALA 302 Ca 0.11 -0.98 -0.20 0.00 0.00 0.00 0.00 53.44 52.37 3h1h n ALA 302 Cb 0.29 0.04 -0.01 0.00 0.00 0.00 0.00 19.45 19.76 3h1h n ALA 302 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3h1h s THR 303 N -2.54 4.64 -0.14 0.00 -1.32 -0.89 -5.01 115.64 110.39 3h1h s THR 303 Ca -0.36 -0.96 0.10 0.00 -1.21 0.00 0.00 61.69 59.26 3h1h s THR 303 Cb 0.12 -3.63 -0.15 0.00 -1.51 0.00 0.00 72.50 67.33 3h1h s THR 303 CO 0.49 -0.26 0.00 0.41 -2.21 0.00 0.00 174.62 173.06 3h1h n THR 304 N -1.56 0.93 -2.34 5.08 -1.04 -1.26 -4.78 114.28 109.31 3h1h n THR 304 Ca -0.04 -0.53 -0.30 0.00 -2.04 0.00 0.00 64.05 61.15 3h1h n THR 304 Cb 0.57 -0.74 -0.00 0.00 -1.82 0.00 0.00 70.33 68.34 3h1h n THR 304 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 3h1h s GLN 305 N -2.33 3.63 0.69 -2.82 -1.52 -1.26 -5.04 119.66 111.02 3h1h s GLN 305 Ca -0.10 0.52 -0.17 0.00 -1.95 0.00 0.00 55.36 53.67 3h1h s GLN 305 Cb 0.04 -2.24 -0.02 0.00 -0.22 0.00 0.00 33.01 30.58 3h1h s GLN 305 CO 0.51 -0.33 0.88 -2.30 -0.25 0.00 0.00 175.29 173.80 3h1h n PRO 306 N -2.26 0.57 -1.12 2.91 -0.02 -1.26 -4.96 135.00 128.85 3h1h n PRO 306 Ca 0.04 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 3h1h n PRO 306 Cb 0.54 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 3h1h n PRO 306 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 3h1h n PHE 307 N -2.27 -0.54 -3.64 6.00 1.16 -1.26 -4.27 117.46 112.64 3h1h n PHE 307 Ca 0.13 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.62 3h1h n PHE 307 Cb 0.49 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.29 3h1h n PHE 307 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 3h1h s ASP 308 N -0.49 -0.77 0.00 5.98 2.15 -0.28 -5.00 116.67 118.26 3h1h s ASP 308 Ca 0.00 1.33 0.00 0.00 0.43 0.00 0.00 52.55 54.31 3h1h s ASP 308 Cb 0.00 1.33 -0.00 0.00 -0.30 0.00 0.00 42.92 43.95 3h1h s ASP 308 CO 0.00 -0.22 -0.02 0.00 -0.17 0.00 0.00 175.17 174.77 3h1h s ALA 309 N 1.06 0.12 0.15 3.66 0.00 -1.26 -1.11 121.76 124.38 3h1h s ALA 309 Ca -0.05 -0.16 -0.12 0.00 0.00 0.00 0.00 51.96 51.63 3h1h s ALA 309 Cb -0.05 0.00 0.01 0.00 0.00 0.00 0.00 23.12 23.08 3h1h s ALA 309 CO -0.11 -0.00 0.34 -1.12 0.00 0.00 0.00 175.76 174.87 3h1h s SER 310 N -0.29 -0.07 -0.38 0.00 0.01 -0.49 -4.60 113.70 107.88 3h1h s SER 310 Ca -0.02 -0.63 -0.23 0.00 1.31 0.00 0.00 55.95 56.38 3h1h s SER 310 Cb -0.02 0.46 0.01 0.00 0.21 0.00 0.00 66.02 66.68 3h1h s SER 310 CO -0.00 -0.89 0.79 0.00 0.41 0.00 0.00 173.24 173.55 3h1h s ALA 311 N -3.89 3.40 -0.11 1.44 0.00 -0.09 -0.96 121.76 121.55 3h1h s ALA 311 Ca 0.10 -0.72 -0.22 0.00 0.00 0.00 0.00 51.96 51.13 3h1h s ALA 311 Cb 0.02 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 3h1h s ALA 311 CO -0.05 -1.59 0.63 0.12 0.00 0.00 0.00 175.76 174.87 3h1h s PHE 312 N 3.17 3.52 -0.17 0.00 5.36 0.38 -4.81 117.98 125.43 3h1h s PHE 312 Ca 0.31 1.09 -0.05 0.00 -0.96 0.00 0.00 56.93 57.33 3h1h s PHE 312 Cb -0.13 -2.74 0.08 0.00 -0.34 0.00 0.00 43.02 39.89 3h1h s PHE 312 CO 0.18 0.05 0.30 1.21 -1.46 0.00 0.00 175.22 175.50 3h1h s ASN 313 N 0.84 0.38 -0.05 6.13 2.47 -1.26 -1.38 114.94 122.07 3h1h s ASN 313 Ca 0.33 0.50 0.05 0.00 0.42 0.00 0.00 52.86 54.16 3h1h s ASN 313 Cb -0.17 0.82 -0.01 0.00 -1.45 0.00 0.00 41.25 40.45 3h1h s ASN 313 CO 0.14 -0.26 -0.22 -0.69 -3.72 0.00 0.00 177.10 172.36 3h1h s VAL 314 N 2.46 1.79 -0.20 -5.21 1.01 0.00 -4.99 120.40 115.25 3h1h s VAL 314 Ca 0.03 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.11 3h1h s VAL 314 Cb -0.13 -1.52 0.04 0.00 0.00 0.00 0.00 36.38 34.77 3h1h s VAL 314 CO -0.11 0.50 -0.14 0.20 0.00 0.00 0.00 175.10 175.55 3h1h s ASN 315 N -0.04 3.52 0.34 3.32 0.01 -1.26 -0.02 114.94 120.81 3h1h s ASN 315 Ca -0.05 -0.91 0.08 0.00 -0.71 0.00 0.00 52.86 51.28 3h1h s ASN 315 Cb -0.13 -1.40 -0.04 0.00 0.41 0.00 0.00 41.25 40.09 3h1h s ASN 315 CO 0.03 -0.10 0.19 -0.31 -1.51 0.00 0.00 177.10 175.40 3h1h s TYR 316 N 1.29 2.77 0.16 2.20 4.12 0.35 -4.49 117.35 123.73 3h1h s TYR 316 Ca -0.01 -0.36 -0.28 0.00 0.02 0.00 0.00 57.07 56.45 3h1h s TYR 316 Cb -0.16 -1.68 -0.01 0.00 -1.52 0.00 0.00 41.96 38.59 3h1h s TYR 316 CO -0.09 0.29 1.56 0.66 0.02 0.00 0.00 175.55 178.00 3h1h h SER 317 N 1.46 -1.57 -0.31 2.29 4.64 -1.95 -0.84 113.55 117.26 3h1h h SER 317 Ca -0.44 0.24 -0.18 0.00 -0.47 0.00 0.00 61.79 60.94 3h1h h SER 317 Cb 1.25 0.69 -0.11 0.00 -0.31 0.00 0.00 62.40 63.92 3h1h h SER 317 CO 0.62 -0.36 -0.22 -0.90 -0.87 0.00 0.00 176.83 175.10 3h1h n ASP 318 N -5.40 2.59 0.00 4.97 3.85 -1.26 -4.33 116.55 116.97 3h1h n ASP 318 Ca -0.00 -3.83 0.00 0.00 -0.71 0.00 0.00 54.79 50.25 3h1h n ASP 318 Cb 0.35 -0.60 0.00 0.00 -1.35 0.00 0.00 41.12 39.52 3h1h n ASP 318 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.20 175.95 3h1h n SER 319 N -1.09 0.00 -3.47 -1.12 2.88 -1.08 -4.70 113.62 105.03 3h1h n SER 319 Ca 0.31 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.82 3h1h n SER 319 Cb 0.94 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 64.40 3h1h n SER 319 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3h1h s GLY 320 N 0.00 0.00 0.05 0.46 0.00 -1.10 0.13 107.32 106.87 3h1h s GLY 320 Ca 0.00 -0.20 0.03 0.00 0.00 0.00 0.00 44.72 44.55 3h1h s GLY 320 CO 0.00 1.09 -0.11 1.08 0.00 0.00 0.00 173.10 175.17 3h1h s LEU 321 N -3.17 2.26 -0.10 0.66 1.43 0.97 -0.55 118.68 120.18 3h1h s LEU 321 Ca 0.17 -0.57 -0.19 0.00 -1.03 0.00 0.00 54.13 52.51 3h1h s LEU 321 Cb -0.02 -0.32 0.04 0.00 0.03 0.00 0.00 46.19 45.92 3h1h s LEU 321 CO 0.05 -0.14 0.47 0.12 0.23 0.00 0.00 176.35 177.07 3h1h s PHE 322 N -1.31 -0.44 -5.00 0.29 5.36 -0.44 -0.82 117.98 115.62 3h1h s PHE 322 Ca -0.06 0.92 0.00 0.00 -0.96 0.00 0.00 56.93 56.83 3h1h s PHE 322 Cb -0.10 0.20 0.00 0.00 -0.34 0.00 0.00 43.02 42.78 3h1h s PHE 322 CO 0.01 -0.37 0.00 0.41 -1.46 0.00 0.00 175.22 173.81 3h1h n GLY 323 N 1.92 -0.48 3.63 13.12 0.00 -0.48 0.06 105.19 122.96 3h1h n GLY 323 Ca -0.17 -1.01 -0.28 0.00 0.00 0.00 0.00 46.02 44.56 3h1h n GLY 323 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3h1h s PHE 324 N -3.33 2.51 -0.04 1.61 -0.12 -0.81 0.14 117.98 117.94 3h1h s PHE 324 Ca 0.00 -0.67 0.01 0.00 -0.05 0.00 0.00 56.93 56.22 3h1h s PHE 324 Cb 0.00 -1.79 0.02 0.00 -0.63 0.00 0.00 43.02 40.63 3h1h s PHE 324 CO 0.00 0.43 -0.03 -0.47 -0.05 0.00 0.00 175.22 175.10 3h1h s TYR 325 N -2.71 0.59 -0.07 3.49 5.04 -0.13 -2.39 117.35 121.18 3h1h s TYR 325 Ca 0.35 -0.13 -0.00 0.00 -2.44 0.00 0.00 57.07 54.84 3h1h s TYR 325 Cb 0.09 -0.58 0.03 0.00 0.35 0.00 0.00 41.96 41.85 3h1h s TYR 325 CO 0.18 -0.18 -0.03 0.95 -1.34 0.00 0.00 175.55 175.14 3h1h s THR 326 N 1.01 0.52 -0.26 4.34 -4.23 0.91 -1.40 115.64 116.52 3h1h s THR 326 Ca -0.10 -0.02 -0.09 0.00 -1.18 0.00 0.00 61.69 60.30 3h1h s THR 326 Cb -0.14 -0.61 -0.04 0.00 1.34 0.00 0.00 72.50 73.05 3h1h s THR 326 CO -0.01 0.26 0.13 -0.63 -0.54 0.00 0.00 174.62 173.83 3h1h s ILE 327 N 1.56 4.81 0.21 2.99 1.01 -0.27 -1.56 121.20 129.95 3h1h s ILE 327 Ca -0.01 -0.00 -0.09 0.00 0.00 0.00 0.00 60.65 60.55 3h1h s ILE 327 Cb -0.13 -3.27 -0.01 0.00 0.01 0.00 0.00 42.46 39.06 3h1h s ILE 327 CO -0.04 0.30 0.34 -0.94 0.00 0.00 0.00 174.94 174.60 3h1h s SER 328 N 1.65 0.00 0.66 3.58 1.04 -0.82 -1.13 113.70 118.69 3h1h s SER 328 Ca 0.07 -1.00 -0.15 0.00 0.48 0.00 0.00 55.95 55.34 3h1h s SER 328 Cb -0.15 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.46 3h1h s SER 328 CO 0.07 -0.99 1.13 -1.10 0.98 0.00 0.00 173.24 173.33 3h1h s GLN 329 N -4.03 2.73 0.00 4.02 -0.21 -1.26 -1.09 119.66 119.83 3h1h s GLN 329 Ca 0.24 1.47 0.00 0.00 0.02 0.00 0.00 55.36 57.09 3h1h s GLN 329 Cb 0.02 -1.93 0.00 0.00 1.00 0.00 0.00 33.01 32.10 3h1h s GLN 329 CO 0.07 -1.32 0.91 0.00 -2.12 0.00 0.00 175.29 172.83 3h1h n ALA 330 N -2.37 -0.24 0.02 6.09 0.00 -0.99 -1.68 120.51 121.33 3h1h n ALA 330 Ca 0.11 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.77 3h1h n ALA 330 Cb 0.52 0.18 0.69 0.00 0.00 0.00 0.00 19.45 20.84 3h1h n ALA 330 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h1h h ALA 331 N -1.67 2.31 -0.55 0.00 0.00 -1.89 0.19 119.26 117.66 3h1h h ALA 331 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3h1h h ALA 331 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3h1h h ALA 331 CO 0.00 -0.90 0.00 0.72 0.00 0.00 0.00 179.25 179.07 3h1h n HIS 332 N -3.62 1.37 0.06 0.00 8.25 -1.05 -4.30 115.22 115.92 3h1h n HIS 332 Ca 0.11 -0.66 -0.04 0.00 -0.26 0.00 0.00 57.72 56.88 3h1h n HIS 332 Cb 0.82 -0.27 0.18 0.00 1.12 0.00 0.00 29.99 31.85 3h1h n HIS 332 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h1h h ALA 333 N 3.50 1.01 0.75 -1.41 0.00 0.31 -1.97 119.26 121.46 3h1h h ALA 333 Ca 0.00 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 3h1h h ALA 333 Cb 1.44 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 19.15 3h1h h ALA 333 CO 0.24 0.62 -0.36 0.78 0.00 0.00 0.00 179.25 180.53 3h1h h GLY 334 N 1.19 -1.05 0.42 0.00 0.00 -1.75 -1.45 103.07 100.44 3h1h h GLY 334 Ca 0.02 0.39 0.13 0.00 0.00 0.00 0.00 47.33 47.87 3h1h h GLY 334 CO 0.07 -0.38 0.58 0.83 0.00 0.00 0.00 176.54 177.64 3h1h h GLU 335 N -1.03 0.88 -0.41 4.80 5.08 -1.84 -1.82 114.58 120.23 3h1h h GLU 335 Ca -0.10 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.13 3h1h h GLU 335 Cb 0.77 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 3h1h h GLU 335 CO 0.17 0.58 -0.03 0.28 -1.00 0.00 0.00 179.01 179.01 3h1h h VAL 336 N 0.90 1.27 -0.00 3.13 2.07 -1.27 -2.46 116.25 119.89 3h1h h VAL 336 Ca 0.49 -1.07 -0.00 0.00 0.82 0.00 0.00 66.70 66.93 3h1h h VAL 336 Cb 0.52 1.14 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 3h1h h VAL 336 CO -0.28 0.36 -0.00 0.40 0.02 0.00 0.00 177.57 178.07 3h1h h ILE 337 N 0.57 1.37 -0.56 4.57 2.04 -0.84 -2.23 117.51 122.43 3h1h h ILE 337 Ca 0.11 -1.08 0.08 0.00 1.00 0.00 0.00 64.86 64.97 3h1h h ILE 337 Cb 0.53 2.10 -0.10 0.00 -0.74 0.00 0.00 36.82 38.60 3h1h h ILE 337 CO 0.03 0.28 -0.46 0.03 0.00 0.00 0.00 178.15 178.02 3h1h h ARG 338 N -0.45 -0.25 -0.07 2.37 2.47 -1.38 -1.26 114.38 115.82 3h1h h ARG 338 Ca 0.00 0.02 0.03 0.00 -1.26 0.00 0.00 59.98 58.77 3h1h h ARG 338 Cb 0.46 0.06 -0.06 0.00 -1.65 0.00 0.00 29.97 28.78 3h1h h ARG 338 CO 0.00 -0.16 -0.46 0.00 0.56 0.00 0.00 179.97 179.91 3h1h h ALA 339 N 0.48 -0.72 -0.91 0.04 0.00 -1.44 0.94 119.26 117.66 3h1h h ALA 339 Ca 0.16 -0.04 0.26 0.00 0.00 0.00 0.00 54.91 55.29 3h1h h ALA 339 Cb 0.57 0.83 -0.04 0.00 0.00 0.00 0.00 17.79 19.15 3h1h h ALA 339 CO -0.68 -0.99 0.82 0.00 0.00 0.00 0.00 179.25 178.41 3h1h h ALA 340 N -0.08 2.76 0.02 0.00 0.00 -0.62 -0.34 119.26 121.00 3h1h h ALA 340 Ca 0.05 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3h1h h ALA 340 Cb 0.66 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.52 3h1h h ALA 340 CO -0.37 -1.29 -0.01 0.52 0.00 0.00 0.00 179.25 178.10 3h1h h MET 341 N 0.00 -0.02 -0.98 0.00 2.07 0.05 -3.17 114.93 112.88 3h1h h MET 341 Ca 0.43 0.00 0.33 0.00 -2.07 0.00 0.00 59.70 58.39 3h1h h MET 341 Cb 2.07 0.00 -0.16 0.00 -1.87 0.00 0.00 31.60 31.65 3h1h h MET 341 CO -0.00 -0.01 0.49 -0.91 1.07 0.00 0.00 176.91 177.54 3h1h h ASN 342 N -0.92 0.36 0.84 1.22 2.35 0.22 1.59 115.58 121.26 3h1h h ASN 342 Ca -0.00 0.21 -0.00 0.00 -0.55 0.00 0.00 56.30 55.96 3h1h h ASN 342 Cb 0.02 0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.58 3h1h h ASN 342 CO 0.00 -0.20 -0.00 1.56 -1.65 0.00 0.00 177.43 177.14 3h1h h GLN 343 N 0.24 0.00 0.09 0.81 1.08 -1.24 0.39 115.11 116.48 3h1h h GLN 343 Ca 0.72 0.00 -0.33 0.00 -1.45 0.00 0.00 58.65 57.60 3h1h h GLN 343 Cb 1.68 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 29.09 3h1h h GLN 343 CO -0.66 0.00 -1.79 -0.07 -0.95 0.00 0.00 178.83 175.37 3h1h h LEU 344 N 0.00 0.29 0.00 1.46 3.38 0.23 -3.14 115.31 117.53 3h1h h LEU 344 Ca -0.00 -0.57 -0.00 0.00 0.09 0.00 0.00 57.88 57.40 3h1h h LEU 344 Cb 0.42 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3h1h h LEU 344 CO 0.00 1.50 -0.00 0.11 0.09 0.00 0.00 178.44 180.14 3h1h h LYS 345 N 0.05 -0.00 -0.34 1.13 1.57 -0.82 -2.37 116.57 115.78 3h1h h LYS 345 Ca -0.34 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.54 3h1h h LYS 345 Cb 2.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.32 3h1h h LYS 345 CO 0.11 0.52 0.51 0.00 -0.57 0.00 0.00 179.45 180.02 3h1h h ALA 346 N 0.46 1.97 0.24 3.86 0.00 -0.37 0.79 119.26 126.22 3h1h h ALA 346 Ca -0.00 -0.01 -0.34 0.00 0.00 0.00 0.00 54.91 54.56 3h1h h ALA 346 Cb 0.53 0.03 0.03 0.00 0.00 0.00 0.00 17.79 18.37 3h1h h ALA 346 CO 0.00 -0.69 -1.54 0.00 0.00 0.00 0.00 179.25 177.03 3h1h h ALA 347 N 1.29 -0.08 0.00 0.00 0.00 -1.44 -2.11 119.26 116.92 3h1h h ALA 347 Ca 0.16 -0.93 -0.08 0.00 0.00 0.00 0.00 54.91 54.06 3h1h h ALA 347 Cb 1.18 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 3h1h h ALA 347 CO -0.00 0.78 -0.39 0.00 0.00 0.00 0.00 179.25 179.65 3h1h h ALA 348 N 0.17 1.33 -0.12 0.00 0.00 0.96 -2.86 119.26 118.75 3h1h h ALA 348 Ca -0.27 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.21 3h1h h ALA 348 Cb 2.15 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.84 3h1h h ALA 348 CO 0.25 0.48 0.10 1.04 0.00 0.00 0.00 179.25 181.12 3h1h n GLN 349 N -4.03 1.18 -1.34 0.00 6.02 0.41 -4.74 117.38 114.87 3h1h n GLN 349 Ca -0.02 -0.39 -0.09 0.00 -0.01 0.00 0.00 57.00 56.49 3h1h n GLN 349 Cb 0.42 -1.15 -0.03 0.00 1.02 0.00 0.00 30.24 30.50 3h1h n GLN 349 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3h1h n GLY 350 N 0.75 0.96 2.36 1.08 0.00 -1.09 -4.94 105.19 104.31 3h1h n GLY 350 Ca 0.08 -0.63 -0.24 0.00 0.00 0.00 0.00 46.02 45.23 3h1h n GLY 350 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h1h n GLY 351 N -1.82 4.04 3.01 -0.02 0.00 -0.79 -4.87 105.19 104.74 3h1h n GLY 351 Ca -0.09 -1.71 -0.21 0.00 0.00 0.00 0.00 46.02 44.00 3h1h n GLY 351 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h1h s VAL 352 N -1.24 0.87 -0.01 1.61 1.01 -1.26 -4.67 120.40 116.72 3h1h s VAL 352 Ca 0.61 -0.39 -0.06 0.00 0.00 0.00 0.00 61.98 62.14 3h1h s VAL 352 Cb 0.35 -0.78 -0.05 0.00 0.00 0.00 0.00 36.38 35.90 3h1h s VAL 352 CO -0.15 0.28 0.25 -0.89 0.00 0.00 0.00 175.10 174.58 3h1h s THR 353 N 0.30 5.34 0.65 3.92 2.01 -1.26 -4.97 115.64 121.63 3h1h s THR 353 Ca -0.05 0.15 0.35 0.00 0.31 0.00 0.00 61.69 62.45 3h1h s THR 353 Cb -0.10 -3.55 0.37 0.00 0.01 0.00 0.00 72.50 69.23 3h1h s THR 353 CO 0.01 0.40 2.12 -0.08 -0.69 0.00 0.00 174.62 176.38 3h1h h GLU 354 N 4.11 0.00 0.00 4.92 4.57 -1.99 0.12 114.58 126.31 3h1h h GLU 354 Ca -0.51 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 57.64 3h1h h GLU 354 Cb 1.20 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.78 3h1h h GLU 354 CO 0.65 0.00 -0.22 1.49 -1.18 0.00 0.00 179.01 179.75 3h1h h GLU 355 N 0.00 0.00 -0.96 1.92 4.81 -1.99 -2.93 114.58 115.44 3h1h h GLU 355 Ca 0.02 0.00 0.29 0.00 -0.13 0.00 0.00 59.36 59.54 3h1h h GLU 355 Cb 0.41 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 29.64 3h1h h GLU 355 CO -0.00 0.89 0.44 -0.44 -0.73 0.00 0.00 179.01 179.17 3h1h h ASP 356 N -1.00 0.31 -0.01 1.04 5.19 -1.21 1.39 116.42 122.14 3h1h h ASP 356 Ca -0.06 0.20 -0.13 0.00 -0.62 0.00 0.00 57.03 56.42 3h1h h ASP 356 Cb 0.95 0.19 -0.01 0.00 0.18 0.00 0.00 39.33 40.64 3h1h h ASP 356 CO -0.04 -0.15 -0.40 0.58 -3.12 0.00 0.00 179.24 176.12 3h1h h VAL 357 N 0.28 1.30 -0.19 -1.35 2.07 -1.28 -1.88 116.25 115.20 3h1h h VAL 357 Ca 0.67 -1.55 -0.21 0.00 0.82 0.00 0.00 66.70 66.43 3h1h h VAL 357 Cb 1.46 1.56 0.01 0.00 -1.52 0.00 0.00 31.29 32.80 3h1h h VAL 357 CO -0.63 0.49 -0.70 0.74 0.02 0.00 0.00 177.57 177.49 3h1h h THR 358 N 0.43 1.28 0.59 2.57 2.02 0.18 -1.86 112.91 118.12 3h1h h THR 358 Ca 0.04 -1.90 -0.03 0.00 0.77 0.00 0.00 66.41 65.29 3h1h h THR 358 Cb 0.88 1.87 0.00 0.00 -1.74 0.00 0.00 68.15 69.17 3h1h h THR 358 CO 0.08 0.61 -0.30 0.11 0.37 0.00 0.00 175.52 176.38 3h1h h LYS 359 N 0.56 -0.79 0.00 6.66 1.57 0.04 -2.64 116.57 121.96 3h1h h LYS 359 Ca -0.03 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3h1h h LYS 359 Cb 1.31 0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.80 3h1h h LYS 359 CO 0.14 -0.53 0.00 0.00 -0.57 0.00 0.00 179.45 178.50 3h1h n ALA 360 N -2.47 -0.17 -0.23 3.86 0.00 -0.72 -1.34 120.51 119.45 3h1h n ALA 360 Ca -0.13 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.53 3h1h n ALA 360 Cb 0.34 0.31 0.40 0.00 0.00 0.00 0.00 19.45 20.51 3h1h n ALA 360 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3h1h n LYS 361 N -2.54 -0.04 0.01 0.00 5.02 -0.70 0.13 118.16 120.04 3h1h n LYS 361 Ca 0.00 0.97 -0.18 0.00 -2.02 0.00 0.00 58.31 57.08 3h1h n LYS 361 Cb 0.00 -1.74 -0.11 0.00 -0.02 0.00 0.00 35.03 33.17 3h1h n LYS 361 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 3h1h h ASN 362 N 0.00 0.66 -0.89 4.39 2.35 -0.84 -1.03 115.58 120.21 3h1h h ASN 362 Ca 0.59 -0.75 0.04 0.00 -0.55 0.00 0.00 56.30 55.63 3h1h h ASN 362 Cb 1.54 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 39.66 3h1h h ASN 362 CO -0.55 1.32 0.59 1.56 -1.65 0.00 0.00 177.43 178.70 3h1h h GLN 363 N 0.07 1.08 0.11 0.81 4.20 0.24 0.06 115.11 121.68 3h1h h GLN 363 Ca -0.09 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.55 3h1h h GLN 363 Cb 1.42 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.96 3h1h h GLN 363 CO 0.14 0.71 -0.05 1.25 -0.67 0.00 0.00 178.83 180.21 3h1h h LEU 364 N 1.11 -0.13 -0.11 1.46 5.85 -0.90 0.35 115.31 122.94 3h1h h LEU 364 Ca 0.36 -0.23 0.04 0.00 0.84 0.00 0.00 57.88 58.89 3h1h h LEU 364 Cb 0.03 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.03 3h1h h LEU 364 CO -0.11 0.16 -0.31 0.11 -0.34 0.00 0.00 178.44 177.95 3h1h h LYS 365 N -0.43 -0.38 0.00 1.25 1.57 -0.50 0.12 116.57 118.21 3h1h h LYS 365 Ca -0.02 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3h1h h LYS 365 Cb 0.35 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3h1h h LYS 365 CO 0.03 -0.25 0.00 0.00 -0.57 0.00 0.00 179.45 178.65 3h1h n ALA 366 N -2.80 -0.41 -0.29 3.86 0.00 -0.05 -0.86 120.51 119.96 3h1h n ALA 366 Ca -0.03 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.51 3h1h n ALA 366 Cb 0.32 0.09 0.21 0.00 0.00 0.00 0.00 19.45 20.07 3h1h n ALA 366 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3h1h n THR 367 N -2.17 -0.35 0.05 0.00 -1.04 0.11 0.19 114.28 111.07 3h1h n THR 367 Ca 0.00 1.83 -0.12 0.00 -2.04 0.00 0.00 64.05 63.73 3h1h n THR 367 Cb 0.00 -2.64 -0.06 0.00 -1.82 0.00 0.00 70.33 65.81 3h1h n THR 367 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 3h1h h TYR 368 N 0.00 -0.13 0.00 -1.42 3.20 -0.37 -0.73 116.97 117.52 3h1h h TYR 368 Ca 0.47 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.30 3h1h h TYR 368 Cb 0.91 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.23 3h1h h TYR 368 CO -0.48 -0.08 -0.21 -0.07 -1.64 0.00 0.00 178.16 175.68 3h1h h LEU 369 N -0.10 0.00 0.04 2.82 3.38 0.42 -3.02 115.31 118.84 3h1h h LEU 369 Ca 0.02 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 3h1h h LEU 369 Cb 0.12 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.88 3h1h h LEU 369 CO -0.04 0.21 -0.39 0.24 0.09 0.00 0.00 178.44 178.55 3h1h h MET 370 N 0.00 0.20 -2.63 1.13 2.86 -0.11 -3.33 114.93 113.04 3h1h h MET 370 Ca -0.00 -0.26 -0.19 0.00 -2.06 0.00 0.00 59.70 57.19 3h1h h MET 370 Cb 0.42 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.14 3h1h h MET 370 CO 0.03 1.05 0.63 0.43 1.06 0.00 0.00 176.91 180.10 3h1h n SER 371 N -4.39 3.70 0.00 1.22 7.64 -0.31 -1.69 113.62 119.80 3h1h n SER 371 Ca -0.11 -2.16 0.00 0.00 1.01 0.00 0.00 58.87 57.61 3h1h n SER 371 Cb 0.60 -0.93 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 3h1h n SER 371 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3h1h n VAL 372 N 3.04 0.00 -0.01 0.44 0.31 -1.25 -4.74 118.33 116.13 3h1h n VAL 372 Ca 0.31 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.50 3h1h n VAL 372 Cb 0.46 0.01 -0.04 0.00 -0.91 0.00 0.00 33.84 33.36 3h1h n VAL 372 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3h1h h GLU 373 N 0.00 0.69 -6.42 5.55 5.08 -1.51 -3.36 114.58 114.62 3h1h h GLU 373 Ca 0.00 -0.55 -0.53 0.00 -1.00 0.00 0.00 59.36 57.28 3h1h h GLU 373 Cb 0.42 0.11 0.02 0.00 0.50 0.00 0.00 28.75 29.80 3h1h h GLU 373 CO 0.00 1.16 1.10 0.99 -1.00 0.00 0.00 179.01 181.26 3h1h s THR 374 N -3.77 2.97 0.38 1.13 2.01 -1.26 -4.87 115.64 112.23 3h1h s THR 374 Ca -0.09 0.28 0.18 0.00 0.31 0.00 0.00 61.69 62.37 3h1h s THR 374 Cb 0.09 -3.18 0.38 0.00 0.01 0.00 0.00 72.50 69.80 3h1h s THR 374 CO 0.88 -0.01 1.72 0.00 -0.69 0.00 0.00 174.62 176.53 3h1h h ALA 375 N 9.14 2.17 -0.41 7.40 0.00 -2.00 0.54 119.26 136.10 3h1h h ALA 375 Ca -0.45 0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.44 3h1h h ALA 375 Cb 1.21 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 3h1h h ALA 375 CO 0.94 -0.65 -0.21 0.37 0.00 0.00 0.00 179.25 179.70 3h1h h GLN 376 N 0.38 0.86 -0.18 0.00 4.15 -1.94 -1.77 115.11 116.61 3h1h h GLN 376 Ca 0.66 -0.38 -0.04 0.00 0.77 0.00 0.00 58.65 59.66 3h1h h GLN 376 Cb 1.63 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 29.29 3h1h h GLN 376 CO -0.40 1.03 -0.07 0.78 -1.93 0.00 0.00 178.83 178.23 3h1h h GLY 377 N 0.68 0.29 0.27 2.39 0.00 -0.32 -1.50 103.07 104.88 3h1h h GLY 377 Ca 0.09 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 3h1h h GLY 377 CO 0.06 0.15 -0.13 -2.00 0.00 0.00 0.00 176.54 174.63 3h1h h LEU 378 N 0.26 -0.30 -1.87 3.11 5.85 -1.04 -1.89 115.31 119.42 3h1h h LEU 378 Ca 0.06 -0.01 0.20 0.00 0.84 0.00 0.00 57.88 58.96 3h1h h LEU 378 Cb 0.30 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 3h1h h LEU 378 CO 0.01 0.16 0.63 0.25 -0.34 0.00 0.00 178.44 179.15 3h1h h LEU 379 N -1.09 0.00 0.07 2.25 5.85 -1.29 0.22 115.31 121.31 3h1h h LEU 379 Ca -0.04 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.57 3h1h h LEU 379 Cb 0.29 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.34 3h1h h LEU 379 CO 0.06 0.00 -0.50 -1.13 -0.34 0.00 0.00 178.44 176.53 3h1h h ASN 380 N 0.00 0.33 0.11 1.25 -1.24 -1.28 -2.72 115.58 112.03 3h1h h ASN 380 Ca 0.32 -0.91 -0.01 0.00 0.71 0.00 0.00 56.30 56.42 3h1h h ASN 380 Cb 1.57 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 40.52 3h1h h ASN 380 CO -0.00 1.21 -0.05 -0.08 -1.29 0.00 0.00 177.43 177.21 3h1h h GLU 381 N -0.50 -0.15 -0.17 6.67 4.57 0.14 -1.27 114.58 123.88 3h1h h GLU 381 Ca -0.08 0.01 0.05 0.00 -1.18 0.00 0.00 59.36 58.16 3h1h h GLU 381 Cb 1.34 0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 29.90 3h1h h GLU 381 CO 0.10 -0.06 -0.29 0.82 -1.18 0.00 0.00 179.01 178.39 3h1h h ILE 382 N -0.19 0.32 -0.37 2.32 2.04 -0.87 -2.98 117.51 117.79 3h1h h ILE 382 Ca -0.02 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.75 3h1h h ILE 382 Cb 0.15 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 3h1h h ILE 382 CO 0.03 0.00 -0.16 1.23 0.00 0.00 0.00 178.15 179.25 3h1h h GLY 383 N -0.35 0.73 0.53 5.37 0.00 -1.42 -2.80 103.07 105.14 3h1h h GLY 383 Ca 0.11 -0.57 0.10 0.00 0.00 0.00 0.00 47.33 46.97 3h1h h GLY 383 CO -0.36 0.52 0.50 1.76 0.00 0.00 0.00 176.54 178.96 3h1h h SER 384 N 0.61 0.72 0.37 0.19 0.02 -1.07 -2.13 113.55 112.27 3h1h h SER 384 Ca 0.10 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 3h1h h SER 384 Cb 0.62 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.07 3h1h h SER 384 CO 0.04 0.41 -0.18 -0.33 -1.14 0.00 0.00 176.83 175.63 3h1h h GLU 385 N 0.83 -0.48 0.00 3.45 5.08 -1.54 -2.52 114.58 119.40 3h1h h GLU 385 Ca 0.41 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.80 3h1h h GLU 385 Cb 0.37 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3h1h h GLU 385 CO -0.25 -0.32 0.31 0.00 -1.00 0.00 0.00 179.01 177.75 3h1h n ALA 386 N -2.51 0.22 -0.08 3.43 0.00 -1.06 -1.09 120.51 119.42 3h1h n ALA 386 Ca -0.06 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.24 3h1h n ALA 386 Cb 0.20 -0.19 -0.05 0.00 0.00 0.00 0.00 19.45 19.41 3h1h n ALA 386 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3h1h n LEU 387 N -0.98 1.56 -2.48 0.00 7.94 -0.82 -4.08 117.00 118.13 3h1h n LEU 387 Ca 0.00 0.26 -0.33 0.00 -1.11 0.00 0.00 56.01 54.83 3h1h n LEU 387 Cb 0.31 -0.61 0.04 0.00 0.53 0.00 0.00 43.42 43.69 3h1h n LEU 387 CO 0.00 0.01 1.47 0.18 -1.11 0.00 0.00 177.39 177.94 3h1h n LEU 388 N -4.04 7.26 0.00 -1.96 4.77 -0.25 -4.60 117.00 118.18 3h1h n LEU 388 Ca -0.25 -4.28 0.00 0.00 -0.03 0.00 0.00 56.01 51.45 3h1h n LEU 388 Cb 0.58 -1.06 0.00 0.00 -2.33 0.00 0.00 43.42 40.60 3h1h n LEU 388 CO 0.09 1.57 0.00 -0.24 -1.33 0.00 0.00 177.39 177.48 3h1h n SER 389 N -0.31 0.00 0.00 -1.43 2.88 -0.65 -4.93 113.62 109.19 3h1h n SER 389 Ca 0.53 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.07 3h1h n SER 389 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 3h1h n SER 389 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3h1h n GLY 390 N 0.00 1.23 3.40 0.46 0.00 -1.06 -4.99 105.19 104.22 3h1h n GLY 390 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 3h1h n GLY 390 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h1h s THR 391 N -2.00 0.49 -0.39 2.61 -4.23 -1.26 -4.88 115.64 105.98 3h1h s THR 391 Ca 0.00 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.52 3h1h s THR 391 Cb 0.00 -2.50 0.12 0.00 1.34 0.00 0.00 72.50 71.47 3h1h s THR 391 CO 0.00 0.00 0.18 -2.28 -0.54 0.00 0.00 174.62 171.98 3h1h s HIS 392 N -3.45 1.87 0.11 3.99 2.46 -1.26 -3.53 115.29 115.47 3h1h s HIS 392 Ca 0.32 -2.16 -0.34 0.00 0.47 0.00 0.00 55.06 53.36 3h1h s HIS 392 Cb 0.05 -1.80 -0.13 0.00 -0.13 0.00 0.00 32.58 30.56 3h1h s HIS 392 CO 0.17 -0.82 1.68 2.41 -2.47 0.00 0.00 174.74 175.70 3h1h n THR 393 N 4.05 0.16 -2.07 0.89 -1.04 -1.26 -4.93 114.28 110.08 3h1h n THR 393 Ca 0.05 -0.03 -0.36 0.00 -2.04 0.00 0.00 64.05 61.67 3h1h n THR 393 Cb 0.37 -1.69 0.02 0.00 -1.82 0.00 0.00 70.33 67.21 3h1h n THR 393 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h1h s ALA 394 N 1.78 2.70 0.45 2.41 0.00 -1.26 -4.83 121.76 123.01 3h1h s ALA 394 Ca 0.82 1.02 0.10 0.00 0.00 0.00 0.00 51.96 53.90 3h1h s ALA 394 Cb -0.65 -3.44 1.00 0.00 0.00 0.00 0.00 23.12 20.02 3h1h s ALA 394 CO 0.40 -1.03 2.09 -1.00 0.00 0.00 0.00 175.76 176.22 3h1h h PRO 395 N 1.27 0.36 0.00 0.00 0.13 -1.99 -0.65 132.00 131.12 3h1h h PRO 395 Ca -0.50 -0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 64.49 3h1h h PRO 395 Cb 1.28 -0.08 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 3h1h h PRO 395 CO 0.57 0.24 -0.55 0.66 -0.23 0.00 0.00 178.00 178.69 3h1h h SER 396 N 0.37 0.00 0.00 1.44 4.64 -1.98 -2.42 113.55 115.60 3h1h h SER 396 Ca 0.10 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3h1h h SER 396 Cb -0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 3h1h h SER 396 CO -0.02 0.55 -0.00 0.58 -0.87 0.00 0.00 176.83 177.06 3h1h h VAL 397 N 0.00 1.50 -0.05 0.95 2.07 -1.59 0.53 116.25 119.66 3h1h h VAL 397 Ca -0.01 -1.48 0.02 0.00 0.82 0.00 0.00 66.70 66.05 3h1h h VAL 397 Cb 1.13 2.50 -0.00 0.00 -1.52 0.00 0.00 31.29 33.40 3h1h h VAL 397 CO 0.07 0.38 0.05 1.62 0.02 0.00 0.00 177.57 179.71 3h1h h VAL 398 N -0.63 0.71 0.05 2.57 3.04 -1.17 0.57 116.25 121.39 3h1h h VAL 398 Ca -0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.69 3h1h h VAL 398 Cb 0.63 0.96 0.00 0.00 -2.01 0.00 0.00 31.29 30.87 3h1h h VAL 398 CO 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 177.57 176.53 3h1h h ALA 399 N 1.95 -0.07 -0.19 3.17 0.00 -1.29 -1.13 119.26 121.70 3h1h h ALA 399 Ca 0.03 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.77 3h1h h ALA 399 Cb 0.12 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3h1h h ALA 399 CO -0.00 -0.09 0.52 0.37 0.00 0.00 0.00 179.25 180.05 3h1h h GLN 400 N -0.98 0.00 0.03 0.00 4.15 0.12 0.52 115.11 118.95 3h1h h GLN 400 Ca -0.01 0.00 -0.32 0.00 0.77 0.00 0.00 58.65 59.09 3h1h h GLN 400 Cb 0.47 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.11 3h1h h GLN 400 CO 0.01 0.00 -1.87 1.63 -1.93 0.00 0.00 178.83 176.67 3h1h n LYS 401 N -3.08 0.67 0.20 1.69 4.76 0.19 -3.87 118.16 118.70 3h1h n LYS 401 Ca 0.03 0.25 -0.10 0.00 -2.87 0.00 0.00 58.31 55.62 3h1h n LYS 401 Cb 0.61 -1.74 -0.05 0.00 -1.84 0.00 0.00 35.03 32.02 3h1h n LYS 401 CO 0.00 0.00 0.00 0.97 -1.37 0.00 0.00 177.40 177.00 3h1h h ILE 402 N 0.02 0.08 -0.26 -0.18 -0.00 0.13 -3.30 117.51 114.00 3h1h h ILE 402 Ca -0.36 -0.60 0.02 0.00 -0.00 0.00 0.00 64.86 63.93 3h1h h ILE 402 Cb 2.04 0.13 -0.01 0.00 -0.00 0.00 0.00 36.82 38.98 3h1h h ILE 402 CO 0.07 0.02 0.17 -2.24 -0.00 0.00 0.00 178.15 176.17 3h1h h ASP 403 N -1.13 0.23 0.00 2.19 3.04 -1.62 -3.26 116.42 115.86 3h1h h ASP 403 Ca -0.06 -0.00 -0.26 0.00 -3.24 0.00 0.00 57.03 53.47 3h1h h ASP 403 Cb 0.47 -0.05 0.01 0.00 -1.04 0.00 0.00 39.33 38.72 3h1h h ASP 403 CO 0.10 0.16 2.08 -1.54 -2.04 0.00 0.00 179.24 177.99 3h1h n SER 404 N -4.50 3.37 -3.59 4.15 3.41 -1.24 -4.63 113.62 110.58 3h1h n SER 404 Ca 0.02 -2.21 -0.28 0.00 -0.26 0.00 0.00 58.87 56.13 3h1h n SER 404 Cb 0.14 -0.90 -0.16 0.00 -0.26 0.00 0.00 64.21 63.02 3h1h n SER 404 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3h1h s VAL 405 N 3.89 0.01 0.89 -3.33 1.01 -1.23 -4.99 120.40 116.64 3h1h s VAL 405 Ca 0.27 -0.51 -0.12 0.00 0.00 0.00 0.00 61.98 61.62 3h1h s VAL 405 Cb 0.07 -0.83 0.07 0.00 0.00 0.00 0.00 36.38 35.69 3h1h s VAL 405 CO -0.02 -0.49 0.80 0.35 0.00 0.00 0.00 175.10 175.74 3h1h n THR 406 N 5.23 0.54 -0.35 3.92 -2.24 -1.26 -4.88 114.28 115.24 3h1h n THR 406 Ca -0.06 -0.15 0.01 0.00 -2.27 0.00 0.00 64.05 61.57 3h1h n THR 406 Cb 0.46 -0.86 0.16 0.00 -2.10 0.00 0.00 70.33 67.99 3h1h n THR 406 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 3h1h h SER 407 N -1.44 1.06 0.59 3.42 0.87 -1.97 -2.49 113.55 113.58 3h1h h SER 407 Ca -0.44 -0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.08 3h1h h SER 407 Cb 1.29 -0.24 0.01 0.00 -0.44 0.00 0.00 62.40 63.01 3h1h h SER 407 CO 0.39 0.72 -0.28 0.00 -0.53 0.00 0.00 176.83 177.13 3h1h h ALA 408 N 1.43 -0.79 -0.86 6.23 0.00 -1.99 -2.49 119.26 120.79 3h1h h ALA 408 Ca 0.39 -0.18 0.20 0.00 0.00 0.00 0.00 54.91 55.32 3h1h h ALA 408 Cb 0.02 0.30 -0.16 0.00 0.00 0.00 0.00 17.79 17.95 3h1h h ALA 408 CO -0.12 -0.94 -0.13 -0.25 0.00 0.00 0.00 179.25 177.81 3h1h n ASP 409 N -5.42 -0.23 0.15 0.00 8.00 -0.95 0.43 116.55 118.53 3h1h n ASP 409 Ca -0.13 1.48 -0.14 0.00 0.71 0.00 0.00 54.79 56.71 3h1h n ASP 409 Cb 0.33 -0.48 -0.08 0.00 -0.02 0.00 0.00 41.12 40.86 3h1h n ASP 409 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3h1h h VAL 410 N 0.00 0.78 0.00 2.53 2.07 -1.39 -1.20 116.25 119.04 3h1h h VAL 410 Ca 0.46 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.78 3h1h h VAL 410 Cb 0.80 0.89 -0.00 0.00 -1.52 0.00 0.00 31.29 31.46 3h1h h VAL 410 CO -0.86 0.04 -0.04 0.58 0.02 0.00 0.00 177.57 177.32 3h1h h VAL 411 N -0.44 0.64 -0.08 2.57 2.07 0.42 -1.52 116.25 119.91 3h1h h VAL 411 Ca -0.03 -0.15 -0.09 0.00 0.82 0.00 0.00 66.70 67.24 3h1h h VAL 411 Cb 0.33 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 3h1h h VAL 411 CO 0.06 0.04 -0.31 0.78 0.02 0.00 0.00 177.57 178.15 3h1h h ASN 412 N 0.00 0.42 -0.33 0.57 2.35 0.29 -1.75 115.58 117.12 3h1h h ASN 412 Ca -0.00 -0.63 0.06 0.00 -0.55 0.00 0.00 56.30 55.19 3h1h h ASN 412 Cb 0.09 -0.12 -0.06 0.00 0.05 0.00 0.00 38.32 38.28 3h1h h ASN 412 CO 0.00 0.97 -0.04 0.00 -1.65 0.00 0.00 177.43 176.72 3h1h h ALA 413 N 0.45 0.26 -0.42 -0.83 0.00 -0.45 -1.21 119.26 117.06 3h1h h ALA 413 Ca -0.02 0.11 0.09 0.00 0.00 0.00 0.00 54.91 55.09 3h1h h ALA 413 Cb 0.95 0.21 -0.09 0.00 0.00 0.00 0.00 17.79 18.85 3h1h h ALA 413 CO 0.07 -0.43 -0.20 0.00 0.00 0.00 0.00 179.25 178.69 3h1h h ALA 414 N 1.31 0.12 -0.04 0.00 0.00 -1.23 -1.88 119.26 117.53 3h1h h ALA 414 Ca 0.16 0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.25 3h1h h ALA 414 Cb 0.23 0.48 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 3h1h h ALA 414 CO -0.30 -0.55 -0.44 0.87 0.00 0.00 0.00 179.25 178.83 3h1h h LYS 415 N -0.11 -0.55 -0.94 0.00 1.57 -0.33 -2.10 116.57 114.12 3h1h h LYS 415 Ca 0.20 0.04 0.26 0.00 -1.87 0.00 0.00 60.65 59.28 3h1h h LYS 415 Cb 0.43 0.12 -0.17 0.00 0.08 0.00 0.00 32.23 32.69 3h1h h LYS 415 CO -0.50 -0.36 0.09 -0.22 -0.57 0.00 0.00 179.45 177.89 3h1h h LYS 416 N -0.57 0.06 -0.30 3.15 3.64 -0.47 0.29 116.57 122.37 3h1h h LYS 416 Ca 0.05 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 3h1h h LYS 416 Cb 0.66 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.45 3h1h h LYS 416 CO -0.35 0.04 0.13 0.35 -2.27 0.00 0.00 179.45 177.35 3h1h h PHE 417 N 0.06 0.45 0.00 1.91 3.57 -1.05 0.32 116.94 122.20 3h1h h PHE 417 Ca 0.58 -0.03 -0.04 0.00 3.53 0.00 0.00 57.97 62.02 3h1h h PHE 417 Cb 1.21 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.81 3h1h h PHE 417 CO -0.42 0.43 -0.18 0.28 -2.23 0.00 0.00 178.31 176.19 3h1h h VAL 418 N 0.35 0.58 0.00 1.41 2.07 -0.16 -3.32 116.25 117.18 3h1h h VAL 418 Ca 0.10 -0.84 -0.32 0.00 0.82 0.00 0.00 66.70 66.47 3h1h h VAL 418 Cb 0.16 1.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 3h1h h VAL 418 CO -0.01 0.18 -1.80 -1.54 0.02 0.00 0.00 177.57 174.42 3h1h n SER 419 N -3.53 1.91 -4.30 0.57 3.41 -0.08 -5.01 113.62 106.59 3h1h n SER 419 Ca -0.01 0.39 -0.33 0.00 -0.26 0.00 0.00 58.87 58.66 3h1h n SER 419 Cb 0.33 -0.88 0.15 0.00 -0.26 0.00 0.00 64.21 63.55 3h1h n SER 419 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h1h n GLY 420 N 1.36 -2.45 3.70 5.00 0.00 0.11 -4.89 105.19 108.03 3h1h n GLY 420 Ca -0.40 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.45 3h1h n GLY 420 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h1h s LYS 421 N -3.39 4.43 0.04 1.61 2.20 -1.26 -4.96 119.74 118.41 3h1h s LYS 421 Ca 0.55 1.65 -0.07 0.00 -0.36 0.00 0.00 55.97 57.73 3h1h s LYS 421 Cb -0.14 -3.44 -0.05 0.00 -1.51 0.00 0.00 37.83 32.69 3h1h s LYS 421 CO 0.67 -0.27 0.31 0.15 -0.36 0.00 0.00 175.35 175.85 3h1h s LYS 422 N 1.44 3.64 -0.11 4.03 1.02 -1.26 -4.41 119.74 124.09 3h1h s LYS 422 Ca 0.56 -0.01 0.01 0.00 0.02 0.00 0.00 55.97 56.55 3h1h s LYS 422 Cb -0.26 -3.04 0.02 0.00 -0.52 0.00 0.00 37.83 34.03 3h1h s LYS 422 CO 0.26 0.61 -0.11 -1.54 -0.92 0.00 0.00 175.35 173.65 3h1h s SER 423 N -1.77 2.19 0.15 2.83 1.04 -0.52 -4.58 113.70 113.05 3h1h s SER 423 Ca 0.30 -0.35 0.08 0.00 0.48 0.00 0.00 55.95 56.46 3h1h s SER 423 Cb -0.13 -0.93 -0.04 0.00 0.10 0.00 0.00 66.02 65.02 3h1h s SER 423 CO 0.17 -0.05 -0.07 -0.32 0.98 0.00 0.00 173.24 173.95 3h1h s MET 424 N 1.30 2.16 -0.11 4.02 0.00 -1.00 -1.80 119.30 123.87 3h1h s MET 424 Ca -0.02 -1.15 -0.04 0.00 0.00 0.00 0.00 55.69 54.49 3h1h s MET 424 Cb -0.14 -2.26 0.06 0.00 0.00 0.00 0.00 34.83 32.49 3h1h s MET 424 CO -0.05 0.46 0.20 0.00 0.00 0.00 0.00 175.02 175.64 3h1h s ALA 425 N -1.54 -0.30 0.11 4.11 0.00 -0.47 -2.44 121.76 121.23 3h1h s ALA 425 Ca 0.24 0.66 0.03 0.00 0.00 0.00 0.00 51.96 52.90 3h1h s ALA 425 Cb -0.10 -0.92 -0.04 0.00 0.00 0.00 0.00 23.12 22.07 3h1h s ALA 425 CO 0.15 -0.63 -0.09 0.00 0.00 0.00 0.00 175.76 175.19 3h1h s ALA 426 N 2.34 1.12 -0.11 0.00 0.00 -0.97 -1.68 121.76 122.46 3h1h s ALA 426 Ca 0.03 -1.28 -0.09 0.00 0.00 0.00 0.00 51.96 50.62 3h1h s ALA 426 Cb -0.12 0.07 0.04 0.00 0.00 0.00 0.00 23.12 23.10 3h1h s ALA 426 CO -0.07 -0.11 0.29 -1.54 0.00 0.00 0.00 175.76 174.33 3h1h s SER 427 N -2.73 -0.32 0.00 0.00 1.04 -0.32 -1.19 113.70 110.19 3h1h s SER 427 Ca 0.09 0.60 0.00 0.00 0.48 0.00 0.00 55.95 57.12 3h1h s SER 427 Cb 0.00 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.69 3h1h s SER 427 CO -0.01 -0.13 0.00 0.61 0.98 0.00 0.00 173.24 174.69 3h1h n GLY 428 N 3.40 0.89 3.49 7.32 0.00 -0.60 -1.36 105.19 118.32 3h1h n GLY 428 Ca -0.17 -1.79 -0.43 0.00 0.00 0.00 0.00 46.02 43.63 3h1h n GLY 428 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3h1h s ASP 429 N -4.00 6.79 0.00 1.61 -1.08 -1.00 -2.11 116.67 116.88 3h1h s ASP 429 Ca 0.00 -2.34 0.18 0.00 -0.52 0.00 0.00 52.55 49.88 3h1h s ASP 429 Cb 0.00 -2.46 0.96 0.00 -1.46 0.00 0.00 42.92 39.96 3h1h s ASP 429 CO 0.00 -1.05 1.55 0.18 0.52 0.00 0.00 175.17 176.37 3h1h n LEU 430 N 6.93 0.00 -0.28 -1.34 4.77 -1.26 -4.34 117.00 121.48 3h1h n LEU 430 Ca 0.34 0.23 0.25 0.00 -0.03 0.00 0.00 56.01 56.80 3h1h n LEU 430 Cb 0.47 -0.23 0.43 0.00 -2.33 0.00 0.00 43.42 41.75 3h1h n LEU 430 CO 0.61 -0.09 0.77 0.61 -1.33 0.00 0.00 177.39 177.96 3h1h n GLY 431 N 0.25 -0.53 0.36 -0.72 0.00 -1.26 0.17 105.19 103.45 3h1h n GLY 431 Ca 0.10 0.51 0.07 0.00 0.00 0.00 0.00 46.02 46.70 3h1h n GLY 431 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h1h n SER 432 N -4.18 1.59 -4.77 1.61 7.64 -1.26 -4.98 113.62 109.28 3h1h n SER 432 Ca 0.26 -1.30 -0.39 0.00 1.01 0.00 0.00 58.87 58.45 3h1h n SER 432 Cb 0.97 0.43 -0.04 0.00 -1.01 0.00 0.00 64.21 64.55 3h1h n SER 432 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3h1h s THR 433 N -1.73 3.65 0.49 0.44 2.01 0.44 -3.67 115.64 117.26 3h1h s THR 433 Ca 0.13 1.52 -0.04 0.00 0.31 0.00 0.00 61.69 63.61 3h1h s THR 433 Cb 0.12 -3.91 -0.02 0.00 0.01 0.00 0.00 72.50 68.70 3h1h s THR 433 CO 0.35 0.26 0.77 -2.16 -0.69 0.00 0.00 174.62 173.15 3h1h s PRO 434 N -1.76 3.28 0.35 4.92 0.04 -1.26 -4.98 135.00 135.58 3h1h s PRO 434 Ca 0.48 -0.05 -0.04 0.00 0.04 0.00 0.00 61.00 61.43 3h1h s PRO 434 Cb -0.28 -2.42 -0.05 0.00 0.04 0.00 0.00 34.50 31.80 3h1h s PRO 434 CO 0.35 -0.31 0.62 -0.06 0.04 0.00 0.00 177.00 177.64 3h1h s PHE 435 N -2.72 3.50 0.37 0.56 0.40 -1.26 -4.99 117.98 113.84 3h1h s PHE 435 Ca 0.48 0.65 0.15 0.00 -0.60 0.00 0.00 56.93 57.61 3h1h s PHE 435 Cb -0.10 -2.13 1.00 0.00 0.51 0.00 0.00 43.02 42.30 3h1h s PHE 435 CO 0.43 0.05 1.78 1.25 0.70 0.00 0.00 175.22 179.42 3h1h h LEU 436 N 1.15 0.54 -1.64 -0.37 5.85 -1.98 0.28 115.31 119.14 3h1h h LEU 436 Ca -0.48 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.31 3h1h h LEU 436 Cb 1.20 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.22 3h1h h LEU 436 CO 0.64 0.14 0.02 -0.90 -0.34 0.00 0.00 178.44 178.00 3h1h n ASP 437 N -4.67 2.13 -0.01 1.25 5.68 -1.26 -3.08 116.55 116.59 3h1h n ASP 437 Ca 0.24 -2.21 0.00 0.00 -0.50 0.00 0.00 54.79 52.32 3h1h n ASP 437 Cb 0.77 -0.54 0.00 0.00 -1.14 0.00 0.00 41.12 40.21 3h1h n ASP 437 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3h1h n GLU 438 N 0.13 1.68 0.00 0.11 1.02 0.09 -5.26 120.64 118.41 3h1h n GLU 438 Ca 0.07 -1.18 0.01 0.00 -0.02 0.00 0.00 57.16 56.03 3h1h n GLU 438 Cb 0.48 -1.00 0.01 0.00 -0.02 0.00 0.00 31.44 30.91 3h1h n GLU 438 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59