#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xup n VAL 7 N 0.00 3.03 -3.99 -0.72 0.31 -1.24 -4.50 118.33 111.21 1xup n VAL 7 Ca 0.00 -0.36 -0.15 0.00 -0.01 0.00 0.00 64.34 63.82 1xup n VAL 7 Cb 0.00 -1.19 -0.15 0.00 -0.91 0.00 0.00 33.84 31.60 1xup n VAL 7 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 1xup s MET 8 N -3.48 0.26 0.00 5.55 1.75 -1.26 -0.53 119.30 121.59 1xup s MET 8 Ca 0.75 -0.04 0.00 0.00 -1.25 0.00 0.00 55.69 55.15 1xup s MET 8 Cb -0.34 -0.31 -0.00 0.00 2.84 0.00 0.00 34.83 37.02 1xup s MET 8 CO 0.49 -0.01 -0.01 0.00 -0.65 0.00 0.00 175.02 174.85 1xup s ALA 9 N 0.30 0.04 0.05 4.11 0.00 -1.24 -2.82 121.76 122.21 1xup s ALA 9 Ca -0.03 -0.04 -0.04 0.00 0.00 0.00 0.00 51.96 51.86 1xup s ALA 9 Cb -0.05 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.04 1xup s ALA 9 CO -0.01 0.01 0.05 0.96 0.00 0.00 0.00 175.76 176.77 1xup s ILE 10 N -0.05 0.17 0.59 0.00 -4.36 -1.10 -3.59 121.20 112.85 1xup s ILE 10 Ca -0.00 -1.39 0.09 0.00 -0.26 0.00 0.00 60.65 59.09 1xup s ILE 10 Cb -0.00 -1.18 0.09 0.00 1.25 0.00 0.00 42.46 42.61 1xup s ILE 10 CO -0.00 -0.77 0.73 -0.62 0.24 0.00 0.00 174.94 174.52 1xup s ASP 11 N -2.53 4.92 -0.28 4.36 -1.08 -1.25 -1.17 116.67 119.63 1xup s ASP 11 Ca 0.01 -1.00 -0.20 0.00 -0.52 0.00 0.00 52.55 50.84 1xup s ASP 11 Cb 0.03 0.46 0.12 0.00 -1.46 0.00 0.00 42.92 42.07 1xup s ASP 11 CO -0.08 -1.36 0.90 -1.58 0.52 0.00 0.00 175.17 173.57 1xup s GLN 12 N -4.61 0.54 1.52 4.34 -0.44 -0.77 -4.75 119.66 115.49 1xup s GLN 12 Ca 0.55 0.80 0.00 0.00 -2.50 0.00 0.00 55.36 54.21 1xup s GLN 12 Cb -0.04 0.18 0.00 0.00 -1.64 0.00 0.00 33.01 31.50 1xup s GLN 12 CO 0.35 -0.09 0.00 0.41 0.50 0.00 0.00 175.29 176.46 1xup n GLY 13 N 3.27 1.06 5.76 2.59 0.00 -1.26 -2.00 105.19 114.61 1xup n GLY 13 Ca -0.16 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.76 1xup n GLY 13 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xup n THR 14 N 0.00 0.00 0.00 2.61 -2.24 -1.26 -3.07 114.28 110.32 1xup n THR 14 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1xup n THR 14 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1xup n THR 14 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1xup n THR 15 N 0.00 0.00 -3.41 4.28 -1.04 -1.26 -4.99 114.28 107.86 1xup n THR 15 Ca 0.00 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.84 1xup n THR 15 Cb 0.00 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.41 1xup n THR 15 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1xup s SER 16 N -0.46 1.48 -1.50 8.00 0.01 -1.18 -4.44 113.70 115.62 1xup s SER 16 Ca 0.00 -0.56 -0.13 0.00 1.31 0.00 0.00 55.95 56.58 1xup s SER 16 Cb 0.00 0.54 -0.01 0.00 0.21 0.00 0.00 66.02 66.76 1xup s SER 16 CO 0.00 -0.37 2.49 -1.20 0.41 0.00 0.00 173.24 174.58 1xup n SER 17 N 5.32 5.66 -3.78 2.44 7.64 -1.26 -4.86 113.62 124.78 1xup n SER 17 Ca -0.03 -2.73 -0.30 0.00 1.01 0.00 0.00 58.87 56.82 1xup n SER 17 Cb 0.47 -1.60 0.24 0.00 -1.01 0.00 0.00 64.21 62.31 1xup n SER 17 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1xup s ARG 18 N 2.86 -1.33 -0.01 1.43 0.52 -1.26 -4.51 118.95 116.65 1xup s ARG 18 Ca 0.56 -0.07 0.03 0.00 -0.52 0.00 0.00 55.73 55.72 1xup s ARG 18 Cb 0.15 -1.58 -0.01 0.00 0.52 0.00 0.00 34.95 34.03 1xup s ARG 18 CO -0.07 -3.78 -0.10 0.00 0.02 0.00 0.00 175.30 171.37 1xup s ALA 19 N -2.98 0.82 -0.29 2.13 0.00 -1.26 -4.23 121.76 115.95 1xup s ALA 19 Ca 0.71 -0.41 0.03 0.00 0.00 0.00 0.00 51.96 52.29 1xup s ALA 19 Cb -0.10 -0.23 0.08 0.00 0.00 0.00 0.00 23.12 22.88 1xup s ALA 19 CO 0.56 0.19 -0.02 0.42 0.00 0.00 0.00 175.76 176.91 1xup s ILE 20 N -0.15 1.95 0.25 0.00 1.01 -1.24 -3.31 121.20 119.71 1xup s ILE 20 Ca 0.03 -1.80 -0.16 0.00 0.00 0.00 0.00 60.65 58.72 1xup s ILE 20 Cb -0.05 -2.28 -0.08 0.00 0.01 0.00 0.00 42.46 40.07 1xup s ILE 20 CO -0.00 -0.32 0.67 -0.51 0.00 0.00 0.00 174.94 174.78 1xup s ILE 21 N 1.13 4.71 0.25 2.92 1.10 -1.26 -3.59 121.20 126.47 1xup s ILE 21 Ca 0.01 0.97 0.07 0.00 -0.51 0.00 0.00 60.65 61.19 1xup s ILE 21 Cb -0.19 -3.71 -0.04 0.00 0.15 0.00 0.00 42.46 38.67 1xup s ILE 21 CO -0.08 0.03 0.22 -0.36 -2.11 0.00 0.00 174.94 172.64 1xup s PHE 22 N -1.72 3.16 0.00 3.50 0.40 0.31 -1.79 117.98 121.84 1xup s PHE 22 Ca 0.47 -0.10 0.00 0.00 -0.60 0.00 0.00 56.93 56.70 1xup s PHE 22 Cb -0.13 -1.42 0.00 0.00 0.51 0.00 0.00 43.02 41.97 1xup s PHE 22 CO 0.19 0.51 0.00 -0.25 0.70 0.00 0.00 175.22 176.37 1xup n ASP 23 N -1.20 1.39 -4.75 1.36 9.92 0.88 -0.77 116.55 123.39 1xup n ASP 23 Ca -0.08 0.00 -0.41 0.00 -0.53 0.00 0.00 54.79 53.77 1xup n ASP 23 Cb 0.58 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 41.04 1xup n ASP 23 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1xup s ARG 24 N 1.24 4.15 0.00 -1.24 6.06 -1.26 -4.04 118.95 123.86 1xup s ARG 24 Ca 0.00 2.53 0.00 0.00 -2.50 0.00 0.00 55.73 55.76 1xup s ARG 24 Cb 0.00 -3.04 0.00 0.00 0.06 0.00 0.00 34.95 31.97 1xup s ARG 24 CO 0.00 -0.60 0.00 -1.71 -2.50 0.00 0.00 175.30 170.49 1xup n ASN 25 N 2.34 0.00 -2.88 -2.12 2.85 -1.26 -4.04 115.26 110.15 1xup n ASN 25 Ca 0.08 0.00 0.03 0.00 -0.11 0.00 0.00 54.58 54.58 1xup n ASN 25 Cb 0.38 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.40 1xup n ASN 25 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 1xup s GLY 26 N 0.00 -1.37 -0.09 8.20 0.00 -1.26 -5.04 107.32 107.76 1xup s GLY 26 Ca 0.00 1.47 -0.09 0.00 0.00 0.00 0.00 44.72 46.10 1xup s GLY 26 CO 0.00 4.24 0.25 0.54 0.00 0.00 0.00 173.10 178.12 1xup s LYS 27 N 2.23 0.30 -0.21 2.90 -0.14 -1.26 -4.96 119.74 118.61 1xup s LYS 27 Ca 0.18 0.32 -0.04 0.00 -1.36 0.00 0.00 55.97 55.08 1xup s LYS 27 Cb 0.02 0.15 -0.01 0.00 -1.68 0.00 0.00 37.83 36.30 1xup s LYS 27 CO -0.17 -0.04 -0.05 -1.59 -0.76 0.00 0.00 175.35 172.74 1xup s LYS 28 N 0.08 3.40 -0.02 1.68 0.00 -1.26 -0.08 119.74 123.53 1xup s LYS 28 Ca -0.01 -0.62 -0.04 0.00 0.00 0.00 0.00 55.97 55.31 1xup s LYS 28 Cb -0.02 -2.97 -0.15 0.00 0.00 0.00 0.00 37.83 34.69 1xup s LYS 28 CO 0.00 -0.13 2.95 -0.89 0.00 0.00 0.00 175.35 177.28 1xup n ILE 29 N 4.61 2.63 -4.98 3.79 5.41 -0.74 -4.97 119.36 125.11 1xup n ILE 29 Ca -0.18 -1.17 0.00 0.00 1.00 0.00 0.00 62.75 62.40 1xup n ILE 29 Cb 0.51 -1.78 0.00 0.00 -0.71 0.00 0.00 39.64 37.66 1xup n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1xup n GLY 30 N 2.03 -0.23 3.48 7.39 0.00 -1.26 -4.82 105.19 111.78 1xup n GLY 30 Ca 0.27 -0.94 -0.32 0.00 0.00 0.00 0.00 46.02 45.03 1xup n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xup s SER 31 N -4.00 3.99 0.61 1.61 0.01 -1.26 -4.34 113.70 110.31 1xup s SER 31 Ca 0.00 -0.31 -0.11 0.00 1.31 0.00 0.00 55.95 56.84 1xup s SER 31 Cb 0.00 -0.75 -0.04 0.00 0.21 0.00 0.00 66.02 65.43 1xup s SER 31 CO 0.00 0.29 1.02 -0.44 0.41 0.00 0.00 173.24 174.52 1xup s SER 32 N -1.19 6.25 -0.34 2.44 0.01 -1.21 -5.00 113.70 114.66 1xup s SER 32 Ca 0.14 1.41 0.03 0.00 1.31 0.00 0.00 55.95 58.84 1xup s SER 32 Cb -0.11 -2.46 0.10 0.00 0.21 0.00 0.00 66.02 63.76 1xup s SER 32 CO 0.04 -0.85 0.06 -1.10 0.41 0.00 0.00 173.24 171.80 1xup s GLN 33 N -5.11 1.63 -0.07 12.44 -1.52 -1.26 -4.71 119.66 121.06 1xup s GLN 33 Ca 0.55 -1.82 0.01 0.00 -1.95 0.00 0.00 55.36 52.15 1xup s GLN 33 Cb -0.11 -3.23 0.02 0.00 -0.22 0.00 0.00 33.01 29.47 1xup s GLN 33 CO 0.53 -0.92 -0.08 0.15 -0.25 0.00 0.00 175.29 174.72 1xup s LYS 34 N 0.96 1.33 -0.04 2.91 1.02 -1.26 -5.17 119.74 119.48 1xup s LYS 34 Ca 0.09 -0.25 -0.20 0.00 0.02 0.00 0.00 55.97 55.63 1xup s LYS 34 Cb -0.20 -1.26 0.04 0.00 -0.52 0.00 0.00 37.83 35.89 1xup s LYS 34 CO -0.07 -0.10 0.44 -2.00 -0.92 0.00 0.00 175.35 172.70 1xup s GLU 35 N 1.10 0.78 -0.10 1.68 2.12 -1.26 -4.44 118.70 118.59 1xup s GLU 35 Ca -0.07 0.03 -0.06 0.00 0.36 0.00 0.00 54.97 55.23 1xup s GLU 35 Cb -0.14 0.36 0.04 0.00 0.26 0.00 0.00 34.13 34.65 1xup s GLU 35 CO -0.01 -0.22 0.24 -0.06 -0.54 0.00 0.00 175.26 174.67 1xup s PHE 36 N -1.15 -0.32 0.52 5.30 2.99 -1.26 -5.05 117.98 119.01 1xup s PHE 36 Ca -0.12 0.76 -0.22 0.00 0.00 0.00 0.00 56.93 57.36 1xup s PHE 36 Cb -0.03 0.05 -0.07 0.00 0.00 0.00 0.00 43.02 42.97 1xup s PHE 36 CO 0.06 -0.22 1.14 -2.30 -0.00 0.00 0.00 175.22 173.90 1xup n PRO 37 N 4.03 1.40 -2.33 0.24 -0.02 -1.26 -4.84 135.00 132.21 1xup n PRO 37 Ca -0.23 0.51 -0.35 0.00 -2.02 0.00 0.00 63.50 61.41 1xup n PRO 37 Cb 0.54 -2.30 -0.04 0.00 -0.02 0.00 0.00 33.50 31.68 1xup n PRO 37 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1xup s GLN 38 N -2.56 3.18 0.08 -0.52 -1.52 -1.26 -4.84 119.66 112.22 1xup s GLN 38 Ca 0.70 -1.10 -0.31 0.00 -1.95 0.00 0.00 55.36 52.70 1xup s GLN 38 Cb -0.46 -5.30 -0.10 0.00 -0.22 0.00 0.00 33.01 26.93 1xup s GLN 38 CO 0.51 -2.88 1.89 0.98 -0.25 0.00 0.00 175.29 175.54 1xup n TYR 39 N 11.23 2.56 -3.77 0.91 4.19 -1.26 -4.99 117.16 126.02 1xup n TYR 39 Ca 0.41 -0.23 -0.13 0.00 3.31 0.00 0.00 57.90 61.26 1xup n TYR 39 Cb 0.48 -2.75 -0.14 0.00 0.49 0.00 0.00 39.34 37.41 1xup n TYR 39 CO 0.00 0.00 0.00 -0.59 0.91 0.00 0.00 176.86 177.18 1xup s PHE 40 N 3.45 -0.14 0.00 2.98 -0.71 -1.26 -3.73 117.98 118.56 1xup s PHE 40 Ca 0.85 0.41 0.00 0.00 -1.04 0.00 0.00 56.93 57.16 1xup s PHE 40 Cb -0.48 -0.06 0.00 0.00 -1.21 0.00 0.00 43.02 41.28 1xup s PHE 40 CO 0.40 -0.13 0.80 -2.30 -1.34 0.00 0.00 175.22 172.65 1xup n PRO 41 N 3.86 0.00 -3.66 1.99 -0.02 -1.26 -5.01 135.00 130.90 1xup n PRO 41 Ca -0.23 0.36 -0.04 0.00 -2.02 0.00 0.00 63.50 61.58 1xup n PRO 41 Cb 0.54 -1.30 -0.01 0.00 -0.02 0.00 0.00 33.50 32.70 1xup n PRO 41 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1xup s LYS 42 N -2.20 0.88 0.54 -0.52 -2.85 -1.25 -5.10 119.74 109.24 1xup s LYS 42 Ca 0.00 -0.45 0.00 0.00 -1.00 0.00 0.00 55.97 54.52 1xup s LYS 42 Cb 0.00 0.32 0.00 0.00 -2.06 0.00 0.00 37.83 36.09 1xup s LYS 42 CO 0.00 -0.40 0.00 0.43 0.10 0.00 0.00 175.35 175.48 1xup n SER 43 N -0.40 0.00 0.00 0.03 7.64 -1.26 -1.75 113.62 117.88 1xup n SER 43 Ca -0.07 0.00 0.15 0.00 1.01 0.00 0.00 58.87 59.97 1xup n SER 43 Cb 0.61 0.00 0.83 0.00 -1.01 0.00 0.00 64.21 64.65 1xup n SER 43 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xup n GLY 44 N 0.00 -1.17 2.62 0.23 0.00 -1.26 -4.36 105.19 101.26 1xup n GLY 44 Ca 0.00 -0.17 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1xup n GLY 44 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1xup n TRP 45 N -1.17 3.11 -1.70 1.61 7.02 -0.72 -3.47 117.44 122.11 1xup n TRP 45 Ca 0.18 -2.98 -0.42 0.00 -1.02 0.00 0.00 57.50 53.27 1xup n TRP 45 Cb 0.19 -2.43 -0.02 0.00 -2.42 0.00 0.00 31.31 26.63 1xup n TRP 45 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 1xup n VAL 46 N 4.29 2.95 -1.31 -0.99 0.31 -1.26 -3.93 118.33 118.38 1xup n VAL 46 Ca 0.58 -2.69 -0.37 0.00 -0.01 0.00 0.00 64.34 61.85 1xup n VAL 46 Cb 0.34 -2.46 -0.02 0.00 -0.91 0.00 0.00 33.84 30.78 1xup n VAL 46 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1xup n GLU 47 N 6.82 2.99 -1.71 5.55 2.13 -1.26 -3.26 120.64 131.90 1xup n GLU 47 Ca 0.50 -2.15 -0.42 0.00 0.66 0.00 0.00 57.16 55.75 1xup n GLU 47 Cb 0.41 -2.88 -0.03 0.00 0.27 0.00 0.00 31.44 29.21 1xup n GLU 47 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 1xup s HIS 48 N 2.92 1.35 -0.03 4.31 5.65 0.10 -4.59 115.29 125.01 1xup s HIS 48 Ca 0.57 -0.14 -0.34 0.00 0.25 0.00 0.00 55.06 55.41 1xup s HIS 48 Cb 0.15 -4.14 -0.12 0.00 -1.18 0.00 0.00 32.58 27.30 1xup s HIS 48 CO -0.05 -4.98 1.84 -1.71 -0.65 0.00 0.00 174.74 169.19 1xup n ASN 49 N 8.49 3.47 -0.14 9.88 2.85 -1.24 -3.21 115.26 135.35 1xup n ASN 49 Ca 0.22 0.99 -0.12 0.00 -0.11 0.00 0.00 54.58 55.56 1xup n ASN 49 Cb 0.42 -1.40 -0.01 0.00 1.24 0.00 0.00 39.78 40.03 1xup n ASN 49 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1xup h ALA 50 N 8.73 0.62 0.00 5.20 0.00 -1.90 -2.99 119.26 128.91 1xup h ALA 50 Ca -0.48 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.02 1xup h ALA 50 Cb 1.26 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1xup h ALA 50 CO 0.94 0.63 -0.06 -0.91 0.00 0.00 0.00 179.25 179.84 1xup h ASN 51 N 0.78 0.00 0.84 0.00 4.21 -1.97 -0.02 115.58 119.42 1xup h ASN 51 Ca 0.09 0.00 -0.04 0.00 1.21 0.00 0.00 56.30 57.56 1xup h ASN 51 Cb 0.83 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 38.04 1xup h ASN 51 CO 0.07 0.06 -0.41 -0.08 -1.29 0.00 0.00 177.43 175.79 1xup h GLU 52 N 0.00 -1.09 0.00 0.81 4.57 -1.92 0.18 114.58 117.13 1xup h GLU 52 Ca -0.00 0.07 -0.04 0.00 -1.18 0.00 0.00 59.36 58.22 1xup h GLU 52 Cb 0.12 0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 28.95 1xup h GLU 52 CO 0.01 -0.73 -0.17 0.97 -1.18 0.00 0.00 179.01 177.91 1xup h ILE 53 N -1.15 0.60 -0.23 2.32 6.09 -1.58 -3.03 117.51 120.53 1xup h ILE 53 Ca -0.12 -0.78 -0.06 0.00 -1.37 0.00 0.00 64.86 62.53 1xup h ILE 53 Cb 0.87 1.51 -0.01 0.00 0.47 0.00 0.00 36.82 39.66 1xup h ILE 53 CO 0.19 0.17 -0.10 -0.25 -3.07 0.00 0.00 178.15 175.08 1xup h TRP 54 N 0.00 0.54 -0.79 2.19 -0.00 -0.69 -3.05 115.95 114.15 1xup h TRP 54 Ca -0.00 -0.13 0.17 0.00 -0.00 0.00 0.00 58.89 58.92 1xup h TRP 54 Cb 0.49 -0.13 -0.11 0.00 -0.00 0.00 0.00 29.16 29.42 1xup h TRP 54 CO 0.00 0.74 0.29 -0.97 -0.00 0.00 0.00 178.44 178.50 1xup h ASN 55 N 0.18 0.22 -0.79 2.65 -0.73 -0.83 0.30 115.58 116.58 1xup h ASN 55 Ca 0.05 0.13 -0.03 0.00 1.87 0.00 0.00 56.30 58.32 1xup h ASN 55 Cb 0.60 0.13 -0.04 0.00 0.27 0.00 0.00 38.32 39.28 1xup h ASN 55 CO 0.03 0.04 0.38 -1.28 -0.37 0.00 0.00 177.43 176.24 1xup h SER 56 N 0.39 1.04 0.34 1.15 0.87 -1.65 -2.53 113.55 113.16 1xup h SER 56 Ca 0.45 -0.13 -0.08 0.00 -1.23 0.00 0.00 61.79 60.80 1xup h SER 56 Cb 0.76 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.44 1xup h SER 56 CO -0.47 0.88 -0.37 0.58 -0.53 0.00 0.00 176.83 176.93 1xup h VAL 57 N 1.12 1.27 -0.03 2.23 2.07 -0.40 -3.21 116.25 119.30 1xup h VAL 57 Ca 0.27 -1.30 0.04 0.00 0.82 0.00 0.00 66.70 66.53 1xup h VAL 57 Cb 0.12 1.67 -0.05 0.00 -1.52 0.00 0.00 31.29 31.51 1xup h VAL 57 CO -0.03 0.38 -0.33 1.56 0.02 0.00 0.00 177.57 179.16 1xup h GLN 58 N 0.04 -0.45 -0.06 1.57 1.08 -0.45 0.34 115.11 117.17 1xup h GLN 58 Ca 0.00 0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.21 1xup h GLN 58 Cb 0.67 0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 28.20 1xup h GLN 58 CO 0.05 -0.30 -0.06 0.77 -0.95 0.00 0.00 178.83 178.34 1xup h SER 59 N -0.46 0.08 0.08 1.46 0.02 -1.65 -1.20 113.55 111.87 1xup h SER 59 Ca 0.07 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 1xup h SER 59 Cb 0.56 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.08 1xup h SER 59 CO -0.29 0.16 -0.04 0.58 -1.14 0.00 0.00 176.83 176.10 1xup h VAL 60 N 0.09 0.74 -0.25 2.27 2.07 -0.98 0.34 116.25 120.54 1xup h VAL 60 Ca 0.02 -0.17 -0.20 0.00 0.82 0.00 0.00 66.70 67.18 1xup h VAL 60 Cb 0.17 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1xup h VAL 60 CO 0.01 0.04 -0.62 0.40 0.02 0.00 0.00 177.57 177.42 1xup h ILE 61 N 0.00 1.27 0.00 4.57 1.08 -0.15 -3.40 117.51 120.88 1xup h ILE 61 Ca -0.00 -1.81 0.00 0.00 -0.39 0.00 0.00 64.86 62.66 1xup h ILE 61 Cb 0.09 1.74 0.00 0.00 -3.07 0.00 0.00 36.82 35.58 1xup h ILE 61 CO 0.01 0.59 -0.25 0.00 -0.69 0.00 0.00 178.15 177.80 1xup n ALA 62 N -2.58 2.54 -0.09 1.87 0.00 -1.03 -4.86 120.51 116.36 1xup n ALA 62 Ca -0.05 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.49 1xup n ALA 62 Cb 0.67 0.13 0.47 0.00 0.00 0.00 0.00 19.45 20.72 1xup n ALA 62 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1xup h GLY 63 N 0.00 0.63 1.81 0.00 0.00 -0.74 -1.86 103.07 102.91 1xup h GLY 63 Ca 0.00 -0.19 0.01 0.00 0.00 0.00 0.00 47.33 47.15 1xup h GLY 63 CO 0.00 0.13 0.08 0.00 0.00 0.00 0.00 176.54 176.75 1xup h ALA 64 N 1.69 1.39 -0.67 3.60 0.00 -0.82 -2.68 119.26 121.78 1xup h ALA 64 Ca 0.27 -0.00 0.19 0.00 0.00 0.00 0.00 54.91 55.37 1xup h ALA 64 Cb 0.44 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1xup h ALA 64 CO -0.08 -0.10 0.50 0.74 0.00 0.00 0.00 179.25 180.31 1xup h PHE 65 N 0.00 0.00 -1.59 0.00 -1.00 -1.62 -2.89 116.94 109.84 1xup h PHE 65 Ca 0.02 0.00 0.48 0.00 2.81 0.00 0.00 57.97 61.28 1xup h PHE 65 Cb 0.18 0.00 -0.09 0.00 3.61 0.00 0.00 35.95 39.65 1xup h PHE 65 CO 0.00 0.00 1.10 -0.84 -1.61 0.00 0.00 178.31 176.96 1xup h ILE 66 N 0.00 0.12 0.01 -0.55 3.07 -1.70 -0.03 117.51 118.43 1xup h ILE 66 Ca 0.32 -0.01 0.01 0.00 1.55 0.00 0.00 64.86 66.72 1xup h ILE 66 Cb 1.30 0.08 -0.01 0.00 -0.27 0.00 0.00 36.82 37.92 1xup h ILE 66 CO -0.00 0.01 -0.03 -0.33 -1.05 0.00 0.00 178.15 176.74 1xup h GLU 67 N 0.04 -0.07 0.00 0.16 5.08 -1.80 -2.19 114.58 115.81 1xup h GLU 67 Ca 0.83 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.20 1xup h GLU 67 Cb 3.05 0.01 0.00 0.00 0.50 0.00 0.00 28.75 32.32 1xup h GLU 67 CO -0.18 -0.04 0.00 0.77 -1.00 0.00 0.00 179.01 178.56 1xup h SER 68 N -0.07 0.00 0.00 1.42 0.02 -1.30 -3.48 113.55 110.14 1xup h SER 68 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1xup h SER 68 Cb 0.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.62 1xup h SER 68 CO -0.03 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.27 1xup n GLY 69 N 1.22 2.17 3.74 -3.77 0.00 -0.59 -4.96 105.19 103.00 1xup n GLY 69 Ca 0.05 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.37 1xup n GLY 69 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1xup s ILE 70 N 0.00 2.74 0.33 -0.61 -5.25 -1.26 -4.64 121.20 112.51 1xup s ILE 70 Ca 0.00 0.33 0.04 0.00 -0.99 0.00 0.00 60.65 60.03 1xup s ILE 70 Cb 0.00 -2.80 0.04 0.00 2.95 0.00 0.00 42.46 42.65 1xup s ILE 70 CO 0.00 -0.23 0.33 0.54 -1.79 0.00 0.00 174.94 173.79 1xup n ARG 71 N -2.90 0.92 -0.08 0.37 5.12 -1.26 -4.67 116.66 114.16 1xup n ARG 71 Ca 0.12 -1.93 0.00 0.00 -1.93 0.00 0.00 57.85 54.11 1xup n ARG 71 Cb 0.51 0.07 0.00 0.00 -1.16 0.00 0.00 32.46 31.88 1xup n ARG 71 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 1xup n PRO 72 N -1.45 0.00 -0.27 5.56 -0.02 -1.26 -3.82 135.00 133.73 1xup n PRO 72 Ca 0.03 -0.25 0.01 0.00 -2.02 0.00 0.00 63.50 61.27 1xup n PRO 72 Cb 0.36 -1.59 0.02 0.00 -0.02 0.00 0.00 33.50 32.26 1xup n PRO 72 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1xup n GLU 73 N 3.81 0.38 -2.68 -0.52 2.13 -1.26 -4.83 120.64 117.67 1xup n GLU 73 Ca 0.00 -1.12 -0.05 0.00 0.66 0.00 0.00 57.16 56.65 1xup n GLU 73 Cb 0.00 -0.67 0.08 0.00 0.27 0.00 0.00 31.44 31.12 1xup n GLU 73 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1xup n ALA 74 N -0.23 -3.05 -4.07 4.31 0.00 -1.25 -5.17 120.51 111.05 1xup n ALA 74 Ca 0.02 -0.54 -0.12 0.00 0.00 0.00 0.00 53.44 52.81 1xup n ALA 74 Cb 0.61 -2.85 -0.03 0.00 0.00 0.00 0.00 19.45 17.18 1xup n ALA 74 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1xup n ILE 75 N 1.28 0.00 -2.39 0.00 -5.35 -1.26 -4.50 119.36 107.13 1xup n ILE 75 Ca 0.01 -0.93 0.00 0.00 -0.27 0.00 0.00 62.75 61.56 1xup n ILE 75 Cb 0.71 0.26 0.00 0.00 -1.74 0.00 0.00 39.64 38.87 1xup n ILE 75 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1xup n ALA 76 N -2.30 0.00 -1.92 -1.28 0.00 -1.26 -4.93 120.51 108.82 1xup n ALA 76 Ca -0.07 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.96 1xup n ALA 76 Cb 0.25 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.67 1xup n ALA 76 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1xup s GLY 77 N 0.00 2.64 -0.27 0.00 0.00 -1.26 -4.79 107.32 103.64 1xup s GLY 77 Ca 0.00 1.13 0.02 0.00 0.00 0.00 0.00 44.72 45.87 1xup s GLY 77 CO 0.00 1.98 -0.08 -0.42 0.00 0.00 0.00 173.10 174.59 1xup s ILE 78 N -0.31 2.39 -0.00 0.90 1.01 -1.26 -4.09 121.20 119.84 1xup s ILE 78 Ca 0.54 -1.60 -0.21 0.00 0.00 0.00 0.00 60.65 59.38 1xup s ILE 78 Cb -0.37 -2.41 -0.05 0.00 0.01 0.00 0.00 42.46 39.64 1xup s ILE 78 CO 0.42 -0.07 0.62 -0.83 0.00 0.00 0.00 174.94 175.08 1xup s GLY 79 N 1.14 2.63 -0.10 6.18 0.00 -1.13 -0.36 107.32 115.68 1xup s GLY 79 Ca -0.07 0.06 0.02 0.00 0.00 0.00 0.00 44.72 44.73 1xup s GLY 79 CO -0.04 0.82 -0.17 -0.42 0.00 0.00 0.00 173.10 173.29 1xup s ILE 80 N -0.10 2.76 -0.11 0.90 1.01 -1.23 -2.73 121.20 121.70 1xup s ILE 80 Ca 0.32 -0.79 0.03 0.00 0.00 0.00 0.00 60.65 60.21 1xup s ILE 80 Cb -0.18 -2.11 0.01 0.00 0.01 0.00 0.00 42.46 40.19 1xup s ILE 80 CO 0.18 0.55 -0.22 0.42 0.00 0.00 0.00 174.94 175.87 1xup s THR 81 N 0.03 1.96 0.05 2.92 -4.23 -0.32 -1.51 115.64 114.55 1xup s THR 81 Ca -0.06 -0.94 -0.00 0.00 -1.18 0.00 0.00 61.69 59.51 1xup s THR 81 Cb -0.15 -1.72 -0.04 0.00 1.34 0.00 0.00 72.50 71.94 1xup s THR 81 CO 0.05 0.53 -0.04 0.54 -0.54 0.00 0.00 174.62 175.16 1xup s ASN 82 N 0.58 0.61 0.14 3.99 4.22 -0.01 -1.84 114.94 122.63 1xup s ASN 82 Ca -0.14 -0.89 -0.31 0.00 -2.14 0.00 0.00 52.86 49.38 1xup s ASN 82 Cb -0.17 0.15 -0.11 0.00 1.28 0.00 0.00 41.25 42.41 1xup s ASN 82 CO 0.04 -0.50 1.78 0.00 -2.04 0.00 0.00 177.10 176.38 1xup s GLN 83 N -3.36 4.14 1.36 3.55 -2.07 -0.85 0.29 119.66 122.73 1xup s GLN 83 Ca 0.03 2.57 -0.22 0.00 -1.82 0.00 0.00 55.36 55.92 1xup s GLN 83 Cb 0.03 -3.45 0.34 0.00 -1.09 0.00 0.00 33.01 28.85 1xup s GLN 83 CO -0.07 -0.80 1.00 -0.98 -1.32 0.00 0.00 175.29 173.12 1xup s ARG 84 N 2.30 -2.47 6.44 9.60 1.70 -1.26 -4.64 118.95 130.62 1xup s ARG 84 Ca 0.79 -0.03 0.00 0.00 -0.47 0.00 0.00 55.73 56.02 1xup s ARG 84 Cb -0.46 -1.45 0.00 0.00 -0.57 0.00 0.00 34.95 32.47 1xup s ARG 84 CO 0.35 -4.54 0.00 0.39 -1.08 0.00 0.00 175.30 170.42 1xup n GLU 85 N -5.36 0.00 -3.71 3.89 4.71 -1.26 -3.93 120.64 114.98 1xup n GLU 85 Ca 0.14 0.00 -0.24 0.00 -0.01 0.00 0.00 57.16 57.05 1xup n GLU 85 Cb 0.60 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 31.04 1xup n GLU 85 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 1xup n THR 86 N 0.00 -3.94 -1.90 2.62 -1.04 -1.25 -2.76 114.28 106.00 1xup n THR 86 Ca 0.00 -0.01 -0.38 0.00 -2.04 0.00 0.00 64.05 61.62 1xup n THR 86 Cb 0.00 -3.32 0.03 0.00 -1.82 0.00 0.00 70.33 65.22 1xup n THR 86 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1xup s THR 87 N -2.83 2.34 -0.14 12.58 -1.32 -1.22 -0.54 115.64 124.51 1xup s THR 87 Ca 0.04 0.25 -0.07 0.00 -1.21 0.00 0.00 61.69 60.71 1xup s THR 87 Cb -0.00 -3.13 0.06 0.00 -1.51 0.00 0.00 72.50 67.92 1xup s THR 87 CO 0.88 -0.01 0.32 -0.69 -2.21 0.00 0.00 174.62 172.91 1xup s VAL 88 N -1.37 -0.16 -0.09 5.08 1.01 -1.16 -2.87 120.40 120.83 1xup s VAL 88 Ca 0.70 0.16 0.04 0.00 0.00 0.00 0.00 61.98 62.88 1xup s VAL 88 Cb -0.37 -0.49 -0.00 0.00 0.00 0.00 0.00 36.38 35.51 1xup s VAL 88 CO 0.44 0.06 -0.23 -0.69 0.00 0.00 0.00 175.10 174.69 1xup s VAL 89 N 1.63 2.21 0.17 2.92 1.01 -1.26 -3.82 120.40 123.27 1xup s VAL 89 Ca -0.07 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 60.95 1xup s VAL 89 Cb -0.10 -1.85 0.02 0.00 0.00 0.00 0.00 36.38 34.45 1xup s VAL 89 CO -0.10 0.56 0.13 0.79 0.00 0.00 0.00 175.10 176.48 1xup n TRP 90 N 3.36 -1.28 -3.25 5.22 8.01 -1.25 -3.05 117.44 125.20 1xup n TRP 90 Ca -0.18 -0.74 -0.35 0.00 -1.31 0.00 0.00 57.50 54.92 1xup n TRP 90 Cb 0.53 -0.14 -0.04 0.00 -2.01 0.00 0.00 31.31 29.65 1xup n TRP 90 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1xup n ASP 91 N -1.99 5.04 0.00 -0.99 10.43 -1.01 -2.40 116.55 125.64 1xup n ASP 91 Ca -0.00 -3.41 0.00 0.00 2.57 0.00 0.00 54.79 53.95 1xup n ASP 91 Cb 0.20 -0.98 0.00 0.00 1.84 0.00 0.00 41.12 42.18 1xup n ASP 91 CO 0.00 0.00 0.00 1.17 -1.07 0.00 0.00 177.20 177.30 1xup n LYS 92 N 1.19 0.00 0.00 -1.24 4.81 0.96 -0.38 118.16 123.50 1xup n LYS 92 Ca 0.27 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.71 1xup n LYS 92 Cb 0.37 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.42 1xup n LYS 92 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1xup n THR 93 N 0.00 0.00 -2.56 3.15 -1.04 -1.26 -4.97 114.28 107.59 1xup n THR 93 Ca 0.00 -0.26 -0.42 0.00 -2.04 0.00 0.00 64.05 61.33 1xup n THR 93 Cb 0.00 0.78 -0.03 0.00 -1.82 0.00 0.00 70.33 69.27 1xup n THR 93 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1xup s THR 94 N -1.15 4.46 0.27 12.58 2.01 0.49 -4.95 115.64 129.35 1xup s THR 94 Ca 0.00 1.76 -0.01 0.00 0.31 0.00 0.00 61.69 63.75 1xup s THR 94 Cb 0.00 -4.13 0.28 0.00 0.01 0.00 0.00 72.50 68.65 1xup s THR 94 CO 0.00 0.11 1.88 1.23 -0.69 0.00 0.00 174.62 177.15 1xup h GLY 95 N 7.07 1.52 -7.23 4.40 0.00 -1.95 -2.67 103.07 104.22 1xup h GLY 95 Ca -0.40 -0.46 -0.55 0.00 0.00 0.00 0.00 47.33 45.92 1xup h GLY 95 CO 0.80 0.31 1.59 -1.06 0.00 0.00 0.00 176.54 178.18 1xup n GLN 96 N -4.51 0.86 -0.93 4.80 3.00 -1.26 -4.70 117.38 114.63 1xup n GLN 96 Ca 0.16 0.12 -0.29 0.00 -0.01 0.00 0.00 57.00 56.98 1xup n GLN 96 Cb 0.21 -2.66 0.22 0.00 0.00 0.00 0.00 30.24 28.01 1xup n GLN 96 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1xup s PRO 97 N 7.67 -0.62 0.20 -1.09 0.04 -1.26 -3.62 135.00 136.33 1xup s PRO 97 Ca 1.11 0.41 0.22 0.00 0.04 0.00 0.00 61.00 62.78 1xup s PRO 97 Cb -0.66 -1.62 -0.00 0.00 0.04 0.00 0.00 34.50 32.25 1xup s PRO 97 CO 0.39 -3.41 1.05 -0.84 0.04 0.00 0.00 177.00 174.23 1xup h ILE 98 N -2.38 0.04 0.00 0.56 3.07 -1.82 -3.47 117.51 113.51 1xup h ILE 98 Ca -0.54 -1.07 0.00 0.00 1.55 0.00 0.00 64.86 64.80 1xup h ILE 98 Cb 1.33 1.55 0.00 0.00 -0.27 0.00 0.00 36.82 39.43 1xup h ILE 98 CO 0.49 0.02 0.00 0.00 -1.05 0.00 0.00 178.15 177.61 1xup n ALA 99 N -2.19 0.00 -3.00 0.16 0.00 -1.26 -5.10 120.51 109.11 1xup n ALA 99 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1xup n ALA 99 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 1xup n ALA 99 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1xup n ASN 100 N -0.16 0.00 -4.42 0.00 2.85 -1.26 -5.06 115.26 107.20 1xup n ASN 100 Ca 0.00 0.00 -0.35 0.00 -0.11 0.00 0.00 54.58 54.12 1xup n ASN 100 Cb 0.00 0.00 -0.13 0.00 1.24 0.00 0.00 39.78 40.89 1xup n ASN 100 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1xup s ALA 101 N -1.00 3.02 -0.85 5.20 0.00 -1.20 -4.40 121.76 122.53 1xup s ALA 101 Ca 0.00 -1.05 -0.17 0.00 0.00 0.00 0.00 51.96 50.75 1xup s ALA 101 Cb 0.00 -1.82 0.16 0.00 0.00 0.00 0.00 23.12 21.46 1xup s ALA 101 CO 0.00 -0.26 0.93 0.42 0.00 0.00 0.00 175.76 176.85 1xup s ILE 102 N 1.20 5.10 1.10 0.00 1.09 -1.14 0.02 121.20 128.57 1xup s ILE 102 Ca 0.03 -1.87 -0.14 0.00 -1.10 0.00 0.00 60.65 57.58 1xup s ILE 102 Cb -0.15 -4.62 0.19 0.00 -1.06 0.00 0.00 42.46 36.82 1xup s ILE 102 CO 0.01 -1.27 0.68 1.33 -0.10 0.00 0.00 174.94 175.60 1xup n VAL 103 N 4.88 0.00 -0.36 2.92 0.24 -1.20 -3.41 118.33 121.39 1xup n VAL 103 Ca 0.16 -0.31 0.31 0.00 -2.04 0.00 0.00 64.34 62.46 1xup n VAL 103 Cb 0.47 -0.84 0.64 0.00 -1.47 0.00 0.00 33.84 32.64 1xup n VAL 103 CO 0.00 0.00 0.00 4.11 -2.14 0.00 0.00 176.83 178.80 1xup h TRP 104 N -2.27 0.36 -2.91 6.34 5.08 -1.90 -3.25 115.95 117.39 1xup h TRP 104 Ca -0.54 0.01 -0.72 0.00 1.08 0.00 0.00 58.89 58.72 1xup h TRP 104 Cb 1.32 -0.10 -0.20 0.00 -3.00 0.00 0.00 29.16 27.18 1xup h TRP 104 CO 0.29 -0.01 0.53 -1.14 -1.28 0.00 0.00 178.44 176.83 1xup s GLN 105 N -5.22 3.55 0.06 0.12 0.74 -1.26 -4.93 119.66 112.71 1xup s GLN 105 Ca -0.07 -1.94 -0.26 0.00 0.05 0.00 0.00 55.36 53.13 1xup s GLN 105 Cb 0.25 -4.70 0.09 0.00 1.10 0.00 0.00 33.01 29.75 1xup s GLN 105 CO 0.81 -1.60 0.76 -1.12 -0.55 0.00 0.00 175.29 173.59 1xup s SER 106 N 3.15 -0.47 -0.29 6.67 0.01 -1.23 -4.74 113.70 116.81 1xup s SER 106 Ca 0.26 0.05 -0.05 0.00 1.31 0.00 0.00 55.95 57.52 1xup s SER 106 Cb -0.08 0.48 0.15 0.00 0.21 0.00 0.00 66.02 66.78 1xup s SER 106 CO -0.08 -0.76 0.58 -0.60 0.41 0.00 0.00 173.24 172.80 1xup s ARG 107 N -3.21 0.53 0.00 12.44 3.52 -1.23 -4.68 118.95 126.32 1xup s ARG 107 Ca 0.02 1.13 0.00 0.00 -0.13 0.00 0.00 55.73 56.76 1xup s ARG 107 Cb -0.01 0.56 0.00 0.00 -1.56 0.00 0.00 34.95 33.94 1xup s ARG 107 CO -0.09 -0.43 0.00 0.00 -0.81 0.00 0.00 175.30 173.96 1xup n GLN 108 N 5.43 0.00 0.13 5.12 10.64 -1.26 -4.54 117.38 132.90 1xup n GLN 108 Ca -0.06 0.00 0.11 0.00 -1.83 0.00 0.00 57.00 55.22 1xup n GLN 108 Cb 0.50 0.00 0.04 0.00 -0.86 0.00 0.00 30.24 29.92 1xup n GLN 108 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.06 176.00 1xup h SER 109 N 0.00 0.00 -0.29 2.61 0.02 -1.91 -3.41 113.55 110.57 1xup h SER 109 Ca 0.00 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 1xup h SER 109 Cb 0.27 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.75 1xup h SER 109 CO 0.00 0.02 -0.39 0.28 -1.14 0.00 0.00 176.83 175.61 1xup h SER 110 N 0.00 -1.30 -0.05 3.07 0.02 -1.91 -1.18 113.55 112.19 1xup h SER 110 Ca -0.01 0.17 0.02 0.00 -0.84 0.00 0.00 61.79 61.13 1xup h SER 110 Cb 1.02 0.53 -0.00 0.00 0.14 0.00 0.00 62.40 64.09 1xup h SER 110 CO 0.00 -0.28 0.13 -0.65 -1.14 0.00 0.00 176.83 174.89 1xup h PRO 111 N -0.27 0.00 0.18 3.45 0.11 -2.00 -2.30 132.00 131.18 1xup h PRO 111 Ca 0.05 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.85 1xup h PRO 111 Cb 0.41 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.53 1xup h PRO 111 CO -0.42 0.00 -1.43 0.82 -0.21 0.00 0.00 178.00 176.76 1xup h ILE 112 N 0.00 1.31 0.00 4.15 5.03 -1.52 -3.32 117.51 123.16 1xup h ILE 112 Ca 0.03 -2.83 0.00 0.00 -0.12 0.00 0.00 64.86 61.93 1xup h ILE 112 Cb 0.28 2.94 0.00 0.00 -3.03 0.00 0.00 36.82 37.01 1xup h ILE 112 CO -0.00 0.85 0.00 0.00 -0.68 0.00 0.00 178.15 178.32 1xup n ALA 113 N -2.66 1.91 0.10 1.87 0.00 -0.56 -3.81 120.51 117.36 1xup n ALA 113 Ca -0.14 -0.01 -0.13 0.00 0.00 0.00 0.00 53.44 53.16 1xup n ALA 113 Cb 1.06 -1.02 -0.06 0.00 0.00 0.00 0.00 19.45 19.44 1xup n ALA 113 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1xup h ASP 114 N 0.00 -0.86 0.00 0.00 3.32 -1.67 -1.83 116.42 115.37 1xup h ASP 114 Ca 0.00 0.10 -0.57 0.00 0.02 0.00 0.00 57.03 56.58 1xup h ASP 114 Cb 0.00 0.33 0.01 0.00 0.22 0.00 0.00 39.33 39.89 1xup h ASP 114 CO 0.00 -0.38 3.03 1.67 -1.72 0.00 0.00 179.24 181.84 1xup n GLN 115 N -5.40 3.32 0.12 3.56 -0.06 -1.25 -3.61 117.38 114.06 1xup n GLN 115 Ca -0.06 -1.94 0.00 0.00 -2.00 0.00 0.00 57.00 52.99 1xup n GLN 115 Cb 0.31 -2.64 0.00 0.00 -4.06 0.00 0.00 30.24 23.86 1xup n GLN 115 CO 0.00 0.00 0.00 -0.11 -0.20 0.00 0.00 177.06 176.75 1xup n LEU 116 N 3.40 -2.18 -0.18 1.69 7.94 -1.00 -4.96 117.00 121.72 1xup n LEU 116 Ca 0.71 0.57 -0.05 0.00 -1.11 0.00 0.00 56.01 56.13 1xup n LEU 116 Cb 0.35 2.22 0.05 0.00 0.53 0.00 0.00 43.42 46.57 1xup n LEU 116 CO 0.72 0.06 1.06 0.07 -1.11 0.00 0.00 177.39 178.18 1xup h LYS 117 N 0.00 0.58 -0.99 1.96 2.10 -1.40 -2.36 116.57 116.45 1xup h LYS 117 Ca 0.00 -0.03 -0.27 0.00 -2.00 0.00 0.00 60.65 58.35 1xup h LYS 117 Cb 0.00 -0.13 -0.16 0.00 -0.90 0.00 0.00 32.23 31.04 1xup h LYS 117 CO 0.00 0.38 0.34 1.33 -2.00 0.00 0.00 179.45 179.50 1xup n VAL 118 N -4.82 2.15 -0.14 0.07 0.24 -1.25 -4.03 118.33 110.55 1xup n VAL 118 Ca 0.05 -1.01 0.04 0.00 -2.04 0.00 0.00 64.34 61.38 1xup n VAL 118 Cb 0.11 -0.71 0.12 0.00 -1.47 0.00 0.00 33.84 31.89 1xup n VAL 118 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1xup n ASP 119 N -0.35 2.70 0.00 -1.34 8.00 -0.89 -4.99 116.55 119.68 1xup n ASP 119 Ca 0.31 -2.01 0.00 0.00 0.71 0.00 0.00 54.79 53.81 1xup n ASP 119 Cb 1.11 -0.18 0.00 0.00 -0.02 0.00 0.00 41.12 42.04 1xup n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xup n GLY 120 N 0.25 1.94 1.98 0.44 0.00 -1.26 -4.81 105.19 103.74 1xup n GLY 120 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 1xup n GLY 120 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1xup n HIS 121 N -0.29 0.00 0.00 1.61 8.25 -1.26 -3.15 115.22 120.39 1xup n HIS 121 Ca 0.00 -1.25 0.00 0.00 -0.26 0.00 0.00 57.72 56.21 1xup n HIS 121 Cb 0.00 -1.30 0.00 0.00 1.12 0.00 0.00 29.99 29.81 1xup n HIS 121 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1xup n THR 122 N 2.41 0.00 -0.33 1.59 -2.24 -1.26 -4.83 114.28 109.62 1xup n THR 122 Ca 0.32 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.10 1xup n THR 122 Cb 0.75 -0.28 0.14 0.00 -2.10 0.00 0.00 70.33 68.84 1xup n THR 122 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1xup h GLU 123 N 0.00 1.03 0.00 -0.78 4.39 -1.94 -1.30 114.58 115.98 1xup h GLU 123 Ca 0.00 -0.06 -0.03 0.00 0.34 0.00 0.00 59.36 59.61 1xup h GLU 123 Cb 0.31 -0.23 -0.00 0.00 -0.10 0.00 0.00 28.75 28.72 1xup h GLU 123 CO 0.00 0.68 -0.16 0.00 -1.16 0.00 0.00 179.01 178.38 1xup h MET 124 N 1.06 0.00 -0.14 2.33 -0.00 -1.88 -2.03 114.93 114.26 1xup h MET 124 Ca 0.37 0.00 0.04 0.00 -0.00 0.00 0.00 59.70 60.12 1xup h MET 124 Cb 0.10 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.69 1xup h MET 124 CO -0.15 0.16 0.13 0.82 -0.00 0.00 0.00 176.91 177.86 1xup h ILE 125 N 0.00 0.68 0.00 -0.10 1.08 -1.55 0.98 117.51 118.60 1xup h ILE 125 Ca -0.00 0.00 -0.10 0.00 -0.39 0.00 0.00 64.86 64.37 1xup h ILE 125 Cb 0.28 0.90 -0.01 0.00 -3.07 0.00 0.00 36.82 34.92 1xup h ILE 125 CO 0.02 0.00 -0.45 0.45 -0.69 0.00 0.00 178.15 177.48 1xup h HIS 126 N 0.00 0.00 0.01 1.37 3.86 -1.41 0.50 115.15 119.47 1xup h HIS 126 Ca 0.07 0.00 -0.38 0.00 -1.16 0.00 0.00 60.37 58.90 1xup h HIS 126 Cb 0.32 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.73 1xup h HIS 126 CO 0.00 0.45 -2.36 0.39 0.86 0.00 0.00 177.93 177.27 1xup n GLU 127 N -3.69 0.67 0.00 2.45 -0.58 -0.46 -3.69 120.64 115.34 1xup n GLU 127 Ca -0.01 0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.85 1xup n GLU 127 Cb 0.53 -1.55 0.00 0.00 -0.57 0.00 0.00 31.44 29.85 1xup n GLU 127 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1xup n LYS 128 N -3.10 0.00 0.12 3.49 5.02 0.22 -4.40 118.16 119.50 1xup n LYS 128 Ca -0.39 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 55.88 1xup n LYS 128 Cb 1.05 -0.53 0.11 0.00 -0.02 0.00 0.00 35.03 35.65 1xup n LYS 128 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1xup h THR 129 N 0.00 1.50 -2.81 -0.18 2.02 -1.75 -3.18 112.91 108.51 1xup h THR 129 Ca 0.00 -2.38 0.00 0.00 0.77 0.00 0.00 66.41 64.80 1xup h THR 129 Cb 0.00 2.28 0.00 0.00 -1.74 0.00 0.00 68.15 68.69 1xup h THR 129 CO 0.00 0.68 0.00 0.61 0.37 0.00 0.00 175.52 177.18 1xup n GLY 130 N 0.47 0.35 3.34 2.16 0.00 0.17 -4.56 105.19 107.11 1xup n GLY 130 Ca -0.01 -0.28 -0.20 0.00 0.00 0.00 0.00 46.02 45.54 1xup n GLY 130 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xup s LEU 131 N -2.34 1.73 0.00 0.99 1.43 -0.77 -3.07 118.68 116.65 1xup s LEU 131 Ca 0.00 -1.65 0.01 0.00 -1.03 0.00 0.00 54.13 51.46 1xup s LEU 131 Cb 0.00 0.29 -0.00 0.00 0.03 0.00 0.00 46.19 46.50 1xup s LEU 131 CO 0.00 -0.96 0.04 1.33 0.23 0.00 0.00 176.35 176.99 1xup n VAL 132 N -0.65 0.00 -2.86 -1.59 0.24 -1.26 -3.86 118.33 108.35 1xup n VAL 132 Ca 0.02 -0.60 -0.43 0.00 -2.04 0.00 0.00 64.34 61.29 1xup n VAL 132 Cb 0.64 0.23 -0.04 0.00 -1.47 0.00 0.00 33.84 33.19 1xup n VAL 132 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1xup s ILE 133 N -1.98 4.43 -0.23 1.34 1.09 -1.26 -4.98 121.20 119.60 1xup s ILE 133 Ca 0.06 0.26 -0.24 0.00 -1.10 0.00 0.00 60.65 59.62 1xup s ILE 133 Cb 0.00 -4.52 0.07 0.00 -1.06 0.00 0.00 42.46 36.95 1xup s ILE 133 CO 0.04 -1.07 0.68 -0.62 -0.10 0.00 0.00 174.94 173.87 1xup s ASP 134 N 2.79 -0.70 0.41 3.58 3.68 -1.26 -4.92 116.67 120.26 1xup s ASP 134 Ca 0.30 1.30 0.29 0.00 2.13 0.00 0.00 52.55 56.57 1xup s ASP 134 Cb -0.13 1.31 1.18 0.00 -1.45 0.00 0.00 42.92 43.83 1xup s ASP 134 CO 0.19 -0.27 1.86 0.00 0.13 0.00 0.00 175.17 177.07 1xup h ALA 135 N 4.86 1.00 0.00 3.66 0.00 -1.93 -3.38 119.26 123.46 1xup h ALA 135 Ca -0.29 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 53.98 1xup h ALA 135 Cb 1.16 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.96 1xup h ALA 135 CO 0.11 0.00 2.77 0.98 0.00 0.00 0.00 179.25 183.11 1xup n TYR 136 N -2.69 2.48 -3.69 0.00 9.36 -1.26 -4.79 117.16 116.57 1xup n TYR 136 Ca 0.01 -2.36 -0.15 0.00 3.32 0.00 0.00 57.90 58.72 1xup n TYR 136 Cb 0.27 -2.08 -0.15 0.00 -0.63 0.00 0.00 39.34 36.75 1xup n TYR 136 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 1xup s PHE 137 N 3.94 -0.22 0.14 2.98 2.99 -1.26 -5.00 117.98 121.54 1xup s PHE 137 Ca 0.53 0.65 -0.27 0.00 0.00 0.00 0.00 56.93 57.83 1xup s PHE 137 Cb 0.14 -0.15 -0.03 0.00 0.00 0.00 0.00 43.02 42.98 1xup s PHE 137 CO 0.01 -0.25 1.60 1.03 -0.00 0.00 0.00 175.22 177.61 1xup h SER 138 N 7.94 -1.07 -0.93 1.36 0.87 -1.59 -2.51 113.55 117.63 1xup h SER 138 Ca -0.24 0.15 0.23 0.00 -1.23 0.00 0.00 61.79 60.70 1xup h SER 138 Cb 1.13 0.45 -0.13 0.00 -0.44 0.00 0.00 62.40 63.41 1xup h SER 138 CO 0.24 -0.38 0.45 0.00 -0.53 0.00 0.00 176.83 176.61 1xup h ALA 139 N 0.35 1.54 -0.36 6.23 0.00 -1.87 0.22 119.26 125.37 1xup h ALA 139 Ca 0.09 0.15 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 1xup h ALA 139 Cb 0.57 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1xup h ALA 139 CO -0.37 -0.33 -0.04 1.15 0.00 0.00 0.00 179.25 179.66 1xup h THR 140 N 0.44 1.22 -0.56 0.00 2.02 -1.77 0.14 112.91 114.40 1xup h THR 140 Ca 0.59 -0.92 -0.08 0.00 0.77 0.00 0.00 66.41 66.77 1xup h THR 140 Cb 1.12 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 68.50 1xup h THR 140 CO -0.52 0.31 0.04 0.11 0.37 0.00 0.00 175.52 175.83 1xup h LYS 141 N 0.55 0.96 0.23 6.66 1.57 -0.42 0.37 116.57 126.50 1xup h LYS 141 Ca 0.11 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.59 1xup h LYS 141 Cb 0.42 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1xup h LYS 141 CO 0.02 0.95 -0.11 0.28 -0.57 0.00 0.00 179.45 180.02 1xup h VAL 142 N 0.85 0.83 -0.54 0.50 2.07 -0.72 -0.93 116.25 118.31 1xup h VAL 142 Ca 0.16 -0.49 0.10 0.00 0.82 0.00 0.00 66.70 67.29 1xup h VAL 142 Cb 0.49 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 1xup h VAL 142 CO 0.02 0.11 0.37 -0.09 0.02 0.00 0.00 177.57 178.00 1xup h ARG 143 N -0.57 0.29 0.88 1.57 2.43 -0.63 0.39 114.38 118.74 1xup h ARG 143 Ca -0.03 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.08 1xup h ARG 143 Cb 0.42 -0.07 0.01 0.00 -0.42 0.00 0.00 29.97 29.91 1xup h ARG 143 CO 0.05 0.19 -0.42 2.35 -1.51 0.00 0.00 179.97 180.63 1xup h TRP 144 N 0.30 -1.10 -0.58 2.20 7.01 0.15 0.17 115.95 124.11 1xup h TRP 144 Ca 0.25 -0.03 0.01 0.00 2.11 0.00 0.00 58.89 61.24 1xup h TRP 144 Cb 0.59 0.36 -0.03 0.00 -2.10 0.00 0.00 29.16 27.99 1xup h TRP 144 CO -0.00 -0.68 0.38 1.25 -2.79 0.00 0.00 178.44 176.60 1xup h LEU 145 N -1.28 0.64 -0.07 0.65 5.85 -0.30 -2.11 115.31 118.69 1xup h LEU 145 Ca -0.12 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 1xup h LEU 145 Cb 0.91 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.78 1xup h LEU 145 CO 0.20 0.45 0.04 0.25 -0.34 0.00 0.00 178.44 179.04 1xup h LEU 146 N 0.75 0.09 -3.54 2.25 5.85 -0.13 -2.44 115.31 118.13 1xup h LEU 146 Ca 0.22 -0.08 -0.39 0.00 0.84 0.00 0.00 57.88 58.47 1xup h LEU 146 Cb -0.04 -0.02 -0.17 0.00 0.37 0.00 0.00 40.66 40.80 1xup h LEU 146 CO -0.05 0.14 0.50 0.47 -0.34 0.00 0.00 178.44 179.16 1xup n ASP 147 N -5.00 6.41 0.03 1.25 8.00 0.03 -4.25 116.55 123.03 1xup n ASP 147 Ca -0.06 -3.18 0.00 0.00 0.71 0.00 0.00 54.79 52.26 1xup n ASP 147 Cb 0.07 -1.01 0.00 0.00 -0.02 0.00 0.00 41.12 40.16 1xup n ASP 147 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1xup n ASN 148 N 0.04 0.09 -4.77 -2.24 4.05 -0.89 -4.96 115.26 106.58 1xup n ASN 148 Ca 0.36 0.11 -0.40 0.00 0.45 0.00 0.00 54.58 55.10 1xup n ASN 148 Cb 0.65 0.04 0.00 0.00 1.23 0.00 0.00 39.78 41.70 1xup n ASN 148 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1xup s ILE 149 N -2.00 2.23 0.12 -1.44 -1.09 -1.04 -4.93 121.20 113.05 1xup s ILE 149 Ca 0.00 0.21 -0.31 0.00 -2.23 0.00 0.00 60.65 58.32 1xup s ILE 149 Cb 0.00 -3.13 -0.09 0.00 -1.58 0.00 0.00 42.46 37.66 1xup s ILE 149 CO 0.00 0.04 1.66 -1.61 -1.23 0.00 0.00 174.94 173.80 1xup s GLU 150 N -2.25 4.19 -1.07 2.79 0.41 -1.26 -2.71 118.70 118.80 1xup s GLU 150 Ca 0.57 2.41 0.00 0.00 -0.41 0.00 0.00 54.97 57.53 1xup s GLU 150 Cb -0.43 -3.42 0.00 0.00 -1.78 0.00 0.00 34.13 28.50 1xup s GLU 150 CO 0.57 -0.71 0.00 0.41 -0.49 0.00 0.00 175.26 175.03 1xup n GLY 151 N 3.96 0.96 0.37 -1.39 0.00 -1.26 -4.83 105.19 102.99 1xup n GLY 151 Ca 0.16 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.36 1xup n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xup h ALA 152 N 0.08 1.93 0.08 4.61 0.00 -1.83 -2.57 119.26 121.56 1xup h ALA 152 Ca -0.21 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.70 1xup h ALA 152 Cb 1.10 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1xup h ALA 152 CO 0.30 -0.50 -0.12 0.37 0.00 0.00 0.00 179.25 179.29 1xup h GLN 153 N 0.00 -0.24 -0.43 0.00 5.75 -1.86 -1.10 115.11 117.23 1xup h GLN 153 Ca 0.14 0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.63 1xup h GLN 153 Cb 0.84 0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.42 1xup h GLN 153 CO -0.00 -0.16 0.17 1.49 -2.65 0.00 0.00 178.83 177.67 1xup h GLU 154 N -0.25 0.64 -0.12 1.69 4.57 -1.87 -2.11 114.58 117.13 1xup h GLU 154 Ca 0.02 -0.12 0.03 0.00 -1.18 0.00 0.00 59.36 58.12 1xup h GLU 154 Cb 0.26 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.75 1xup h GLU 154 CO -0.07 0.60 0.18 -0.22 -1.18 0.00 0.00 179.01 178.31 1xup h LYS 155 N 0.54 0.00 0.10 1.92 3.64 -1.46 -3.03 116.57 118.29 1xup h LYS 155 Ca 0.14 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1xup h LYS 155 Cb 0.20 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1xup h LYS 155 CO -0.01 0.00 -0.05 0.00 -2.27 0.00 0.00 179.45 177.12 1xup h ALA 156 N 1.76 -0.39 -0.71 5.00 0.00 -0.49 -2.75 119.26 121.68 1xup h ALA 156 Ca 0.06 -0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.09 1xup h ALA 156 Cb 0.41 0.05 -0.13 0.00 0.00 0.00 0.00 17.79 18.12 1xup h ALA 156 CO -0.00 -0.38 -0.11 -0.44 0.00 0.00 0.00 179.25 178.32 1xup h ASP 157 N -0.32 -0.53 -1.01 0.00 5.19 -1.50 -1.54 116.42 116.71 1xup h ASP 157 Ca -0.01 0.20 0.24 0.00 -0.62 0.00 0.00 57.03 56.83 1xup h ASP 157 Cb 0.11 0.40 -0.11 0.00 0.18 0.00 0.00 39.33 39.90 1xup h ASP 157 CO 0.02 -0.21 0.61 -1.13 -3.12 0.00 0.00 179.24 175.42 1xup h ASN 158 N 0.04 0.66 0.00 6.45 -0.73 -1.69 -3.45 115.58 116.85 1xup h ASN 158 Ca 0.36 0.12 0.00 0.00 1.87 0.00 0.00 56.30 58.65 1xup h ASN 158 Cb 0.59 0.01 0.00 0.00 0.27 0.00 0.00 38.32 39.18 1xup h ASN 158 CO -0.69 0.14 0.00 0.61 -0.37 0.00 0.00 177.43 177.12 1xup n GLY 159 N -1.35 1.38 0.19 1.57 0.00 -0.58 -5.05 105.19 101.36 1xup n GLY 159 Ca 0.26 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.21 1xup n GLY 159 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1xup h GLU 160 N 1.05 -0.41 -6.94 1.61 5.08 -1.66 -3.40 114.58 109.92 1xup h GLU 160 Ca 0.00 0.03 -0.47 0.00 -1.00 0.00 0.00 59.36 57.92 1xup h GLU 160 Cb 0.00 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1xup h GLU 160 CO 0.00 -0.27 0.23 -0.48 -1.00 0.00 0.00 179.01 177.49 1xup s LEU 161 N -8.28 3.93 -0.02 1.33 0.05 -1.15 -0.03 118.68 114.51 1xup s LEU 161 Ca -0.06 1.47 0.03 0.00 0.05 0.00 0.00 54.13 55.62 1xup s LEU 161 Cb 0.01 -4.32 -0.00 0.00 -2.05 0.00 0.00 46.19 39.83 1xup s LEU 161 CO 0.19 -0.34 -0.11 -0.22 -0.55 0.00 0.00 176.35 175.32 1xup s LEU 162 N -3.29 1.89 0.09 1.48 2.96 -1.01 -4.69 118.68 116.11 1xup s LEU 162 Ca 0.58 -0.21 -0.31 0.00 -0.22 0.00 0.00 54.13 53.97 1xup s LEU 162 Cb -0.10 -0.61 -0.06 0.00 0.50 0.00 0.00 46.19 45.92 1xup s LEU 162 CO 0.19 0.10 1.21 -0.36 -1.32 0.00 0.00 176.35 176.17 1xup s PHE 163 N -0.00 3.42 0.16 5.38 0.40 -1.24 -3.89 117.98 122.21 1xup s PHE 163 Ca -0.00 1.30 -0.24 0.00 -0.60 0.00 0.00 56.93 57.39 1xup s PHE 163 Cb -0.07 -3.44 0.07 0.00 0.51 0.00 0.00 43.02 40.09 1xup s PHE 163 CO 0.00 -1.35 1.02 0.20 0.70 0.00 0.00 175.22 175.80 1xup s GLY 164 N 0.86 -0.07 0.00 4.36 0.00 -1.25 -4.18 107.32 107.04 1xup s GLY 164 Ca 0.58 -0.06 0.00 0.00 0.00 0.00 0.00 44.72 45.24 1xup s GLY 164 CO 0.31 1.19 0.00 -1.30 0.00 0.00 0.00 173.10 173.30 1xup n THR 165 N -0.59 0.00 0.10 0.90 -2.24 -1.25 -3.00 114.28 108.20 1xup n THR 165 Ca -0.05 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.76 1xup n THR 165 Cb 0.60 0.00 0.40 0.00 -2.10 0.00 0.00 70.33 69.23 1xup n THR 165 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1xup h ILE 166 N 0.26 1.16 -0.92 2.28 6.09 -0.63 -3.14 117.51 122.61 1xup h ILE 166 Ca 0.00 -0.65 0.20 0.00 -1.37 0.00 0.00 64.86 63.04 1xup h ILE 166 Cb 0.00 1.07 -0.07 0.00 0.47 0.00 0.00 36.82 38.29 1xup h ILE 166 CO 0.00 0.21 0.60 0.44 -3.07 0.00 0.00 178.15 176.33 1xup h ASP 167 N 0.29 0.47 0.12 2.19 5.19 -1.85 -3.27 116.42 119.56 1xup h ASP 167 Ca 0.06 0.05 -0.01 0.00 -0.62 0.00 0.00 57.03 56.52 1xup h ASP 167 Cb 0.29 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 39.76 1xup h ASP 167 CO 0.01 0.18 -0.06 0.28 -3.12 0.00 0.00 179.24 176.54 1xup h SER 168 N 0.46 -0.14 -0.72 6.45 0.02 -1.47 -3.37 113.55 114.79 1xup h SER 168 Ca 0.49 0.00 0.12 0.00 -0.84 0.00 0.00 61.79 61.56 1xup h SER 168 Cb 1.13 0.04 -0.12 0.00 0.14 0.00 0.00 62.40 63.58 1xup h SER 168 CO -0.21 0.03 -0.25 1.87 -1.14 0.00 0.00 176.83 177.13 1xup n TRP 169 N -3.13 0.09 -0.23 3.45 -0.00 -1.23 0.84 117.44 117.23 1xup n TRP 169 Ca -0.02 0.89 0.03 0.00 -0.00 0.00 0.00 57.50 58.40 1xup n TRP 169 Cb 0.06 -0.81 0.15 0.00 -0.00 0.00 0.00 31.31 30.71 1xup n TRP 169 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 1xup h LEU 170 N 0.00 -0.09 0.09 5.87 4.07 -1.74 -2.21 115.31 121.30 1xup h LEU 170 Ca 0.28 0.15 -0.14 0.00 0.08 0.00 0.00 57.88 58.24 1xup h LEU 170 Cb 0.46 0.22 0.01 0.00 1.08 0.00 0.00 40.66 42.43 1xup h LEU 170 CO -0.72 -0.06 -0.66 -0.37 -1.08 0.00 0.00 178.44 175.54 1xup h VAL 171 N 0.21 1.52 -0.63 1.22 -1.51 -0.06 -3.37 116.25 113.64 1xup h VAL 171 Ca 0.37 -2.45 0.06 0.00 -1.23 0.00 0.00 66.70 63.45 1xup h VAL 171 Cb 0.62 3.16 -0.08 0.00 -2.13 0.00 0.00 31.29 32.87 1xup h VAL 171 CO -0.51 0.67 -0.37 1.87 -1.23 0.00 0.00 177.57 178.00 1xup n TRP 172 N -4.26 -0.28 0.28 5.19 -0.00 0.25 0.02 117.44 118.64 1xup n TRP 172 Ca -0.15 0.79 0.13 0.00 -0.00 0.00 0.00 57.50 58.27 1xup n TRP 172 Cb 0.72 -0.54 0.82 0.00 -0.00 0.00 0.00 31.31 32.32 1xup n TRP 172 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 177.69 178.56 1xup h LYS 173 N 0.00 0.00 0.05 5.87 1.79 -1.64 0.48 116.57 123.12 1xup h LYS 173 Ca 0.10 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.57 1xup h LYS 173 Cb 0.26 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1xup h LYS 173 CO -0.59 0.00 -0.03 -0.07 -1.08 0.00 0.00 179.45 177.68 1xup h LEU 174 N 0.00 -0.06 -0.60 2.94 4.07 -0.56 -3.35 115.31 117.74 1xup h LEU 174 Ca 0.00 -0.53 0.05 0.00 0.08 0.00 0.00 57.88 57.49 1xup h LEU 174 Cb 0.01 0.02 -0.07 0.00 1.08 0.00 0.00 40.66 41.70 1xup h LEU 174 CO -0.00 0.65 -0.36 0.35 -1.08 0.00 0.00 178.44 178.00 1xup n THR 175 N -4.77 -0.41 0.00 0.22 -2.24 0.58 -1.56 114.28 106.10 1xup n THR 175 Ca -0.07 1.80 0.00 0.00 -2.27 0.00 0.00 64.05 63.52 1xup n THR 175 Cb 0.29 -2.26 0.00 0.00 -2.10 0.00 0.00 70.33 66.25 1xup n THR 175 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1xup n ASP 176 N -4.43 0.00 0.00 3.42 5.75 -1.03 -0.20 116.55 120.05 1xup n ASP 176 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.79 1xup n ASP 176 Cb 0.16 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.25 1xup n ASP 176 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1xup n GLY 177 N 0.00 0.47 2.62 6.12 0.00 0.13 -4.98 105.19 109.55 1xup n GLY 177 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1xup n GLY 177 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xup n GLN 178 N -1.42 4.91 -3.64 1.61 1.13 -1.26 -4.85 117.38 113.85 1xup n GLN 178 Ca 0.00 -4.10 -0.07 0.00 -1.94 0.00 0.00 57.00 50.89 1xup n GLN 178 Cb 0.00 -2.57 -0.07 0.00 0.11 0.00 0.00 30.24 27.71 1xup n GLN 178 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1xup s VAL 179 N -2.61 0.00 -0.41 5.09 0.11 -1.26 -2.89 120.40 118.42 1xup s VAL 179 Ca 0.44 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.54 1xup s VAL 179 Cb 0.17 -1.00 0.18 0.00 -1.53 0.00 0.00 36.38 34.20 1xup s VAL 179 CO -0.09 0.00 0.35 1.41 -3.33 0.00 0.00 175.10 173.45 1xup n HIS 180 N 3.18 -0.94 -3.72 1.54 8.25 -1.26 -4.62 115.22 117.66 1xup n HIS 180 Ca -0.16 -3.30 -0.21 0.00 -0.26 0.00 0.00 57.72 53.79 1xup n HIS 180 Cb 0.57 0.24 -0.03 0.00 1.12 0.00 0.00 29.99 31.89 1xup n HIS 180 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1xup s VAL 181 N -0.01 3.30 -0.30 1.59 -7.23 -1.26 -1.78 120.40 114.71 1xup s VAL 181 Ca 0.33 -1.35 0.02 0.00 -1.81 0.00 0.00 61.98 59.18 1xup s VAL 181 Cb 0.05 -3.13 0.20 0.00 0.56 0.00 0.00 36.38 34.05 1xup s VAL 181 CO -0.19 -0.12 0.70 -0.89 -0.31 0.00 0.00 175.10 174.28 1xup s THR 182 N -2.35 -0.82 0.32 5.32 2.01 -1.04 -2.91 115.64 116.17 1xup s THR 182 Ca 0.43 0.00 -0.29 0.00 0.31 0.00 0.00 61.69 62.14 1xup s THR 182 Cb -0.05 -0.76 -0.11 0.00 0.01 0.00 0.00 72.50 71.58 1xup s THR 182 CO 0.27 0.00 1.56 -0.90 -0.69 0.00 0.00 174.62 174.87 1xup n ASP 183 N 5.26 3.83 0.10 3.53 5.75 -1.26 -4.10 116.55 129.66 1xup n ASP 183 Ca 0.06 1.17 0.18 0.00 -0.01 0.00 0.00 54.79 56.19 1xup n ASP 183 Cb 0.55 -1.60 0.56 0.00 -1.03 0.00 0.00 41.12 39.60 1xup n ASP 183 CO 0.00 0.00 0.00 0.10 -0.11 0.00 0.00 177.20 177.19 1xup h TYR 184 N 4.28 0.00 -0.46 2.11 -0.00 -1.91 -2.03 116.97 118.95 1xup h TYR 184 Ca -0.48 0.00 0.12 0.00 -0.00 0.00 0.00 58.73 58.37 1xup h TYR 184 Cb 1.23 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 37.94 1xup h TYR 184 CO 0.57 0.00 0.33 0.77 -0.00 0.00 0.00 178.16 179.82 1xup h SER 185 N 0.00 0.08 0.00 0.10 0.02 -1.96 -1.24 113.55 110.55 1xup h SER 185 Ca 0.21 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 1xup h SER 185 Cb 1.66 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 64.19 1xup h SER 185 CO -0.00 0.04 0.00 -3.20 -1.14 0.00 0.00 176.83 172.53 1xup n ASN 186 N -4.42 0.00 -3.83 3.07 5.15 -0.76 -4.67 115.26 109.79 1xup n ASN 186 Ca 0.08 -1.77 -0.30 0.00 -0.60 0.00 0.00 54.58 51.99 1xup n ASN 186 Cb 0.48 0.00 0.26 0.00 -0.53 0.00 0.00 39.78 39.99 1xup n ASN 186 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1xup s ALA 187 N -2.00 -0.07 0.00 5.20 0.00 -0.47 -3.02 121.76 121.40 1xup s ALA 187 Ca 0.09 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.31 1xup s ALA 187 Cb 0.04 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1xup s ALA 187 CO 0.07 -3.98 0.00 0.43 0.00 0.00 0.00 175.76 172.28 1xup n SER 188 N -5.09 0.00 -0.10 0.00 7.64 -1.14 -4.14 113.62 110.79 1xup n SER 188 Ca 0.11 0.00 0.04 0.00 1.01 0.00 0.00 58.87 60.03 1xup n SER 188 Cb 0.59 0.00 0.37 0.00 -1.01 0.00 0.00 64.21 64.16 1xup n SER 188 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1xup h ARG 189 N 0.00 0.69 -5.40 1.43 2.47 -1.90 -3.29 114.38 108.38 1xup h ARG 189 Ca 0.00 -0.04 -0.65 0.00 -1.26 0.00 0.00 59.98 58.03 1xup h ARG 189 Cb 0.00 -0.16 -0.15 0.00 -1.65 0.00 0.00 29.97 28.02 1xup h ARG 189 CO 0.00 0.46 0.83 0.99 0.56 0.00 0.00 179.97 182.80 1xup s THR 190 N -5.62 4.41 0.36 2.04 2.01 -1.17 -1.55 115.64 116.13 1xup s THR 190 Ca -0.09 -0.90 0.19 0.00 0.31 0.00 0.00 61.69 61.20 1xup s THR 190 Cb 0.18 -4.79 0.35 0.00 0.01 0.00 0.00 72.50 68.25 1xup s THR 190 CO 0.75 -1.57 1.60 -0.03 -0.69 0.00 0.00 174.62 174.69 1xup h MET 191 N 9.31 0.09 -1.41 4.92 4.05 -1.91 0.59 114.93 130.57 1xup h MET 191 Ca -0.03 -0.01 -0.24 0.00 -0.28 0.00 0.00 59.70 59.15 1xup h MET 191 Cb 1.04 -0.02 -0.11 0.00 -0.80 0.00 0.00 31.60 31.71 1xup h MET 191 CO 1.19 0.06 0.30 1.28 0.23 0.00 0.00 176.91 179.97 1xup n LEU 192 N -5.19 5.62 -2.94 3.39 4.32 -1.26 -3.92 117.00 117.02 1xup n LEU 192 Ca 0.36 -2.84 -0.13 0.00 -0.02 0.00 0.00 56.01 53.38 1xup n LEU 192 Cb 1.21 -0.92 0.02 0.00 -1.62 0.00 0.00 43.42 42.11 1xup n LEU 192 CO 0.04 1.02 -0.00 0.00 -1.22 0.00 0.00 177.39 177.22 1xup n TYR 193 N 0.35 -0.63 -1.53 -1.77 -0.00 0.21 -2.65 117.16 111.14 1xup n TYR 193 Ca 0.23 -3.05 -0.57 0.00 -0.00 0.00 0.00 57.90 54.51 1xup n TYR 193 Cb 0.69 0.27 -0.09 0.00 -0.00 0.00 0.00 39.34 40.22 1xup n TYR 193 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.86 175.15 1xup n ASN 194 N 0.16 1.80 -0.00 2.98 2.85 -1.05 -2.90 115.26 119.09 1xup n ASN 194 Ca 0.15 0.80 0.03 0.00 -0.11 0.00 0.00 54.58 55.45 1xup n ASN 194 Cb 0.72 -1.09 0.41 0.00 1.24 0.00 0.00 39.78 41.05 1xup n ASN 194 CO 0.00 0.00 0.00 -0.29 -2.11 0.00 0.00 177.26 174.86 1xup h ILE 195 N 6.19 1.12 0.00 -1.44 2.10 -1.80 1.20 117.51 124.87 1xup h ILE 195 Ca -0.32 -0.27 -0.01 0.00 1.08 0.00 0.00 64.86 65.35 1xup h ILE 195 Cb 1.35 0.56 -0.00 0.00 -1.09 0.00 0.00 36.82 37.63 1xup h ILE 195 CO 1.01 0.12 -0.03 -0.74 -1.08 0.00 0.00 178.15 177.44 1xup h HIS 196 N 0.55 0.00 0.00 2.19 2.76 -1.86 -2.70 115.15 116.10 1xup h HIS 196 Ca 0.15 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 1xup h HIS 196 Cb -0.01 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.95 1xup h HIS 196 CO 0.00 0.03 -1.03 1.63 -1.30 0.00 0.00 177.93 177.26 1xup n LYS 197 N -3.17 1.82 -0.66 5.26 5.02 -0.10 -4.99 118.16 121.34 1xup n LYS 197 Ca -0.01 -0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 1xup n LYS 197 Cb 0.25 -1.14 0.00 0.00 -0.02 0.00 0.00 35.03 34.12 1xup n LYS 197 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1xup n LEU 198 N -1.58 0.91 -4.26 -0.35 4.32 0.39 -4.90 117.00 111.53 1xup n LEU 198 Ca -0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 56.01 55.85 1xup n LEU 198 Cb 0.23 -1.61 -0.10 0.00 -1.62 0.00 0.00 43.42 40.32 1xup n LEU 198 CO 0.23 -0.57 -0.25 -1.83 -1.22 0.00 0.00 177.39 173.74 1xup s GLU 199 N -1.14 1.30 0.44 3.23 -1.05 -1.20 -4.94 118.70 115.33 1xup s GLU 199 Ca 0.00 -1.69 -0.26 0.00 -0.15 0.00 0.00 54.97 52.87 1xup s GLU 199 Cb 0.00 -0.03 -0.09 0.00 -0.44 0.00 0.00 34.13 33.58 1xup s GLU 199 CO 0.00 -0.33 1.44 -1.58 0.95 0.00 0.00 175.26 175.75 1xup s TRP 200 N -3.93 2.47 -0.59 4.83 0.52 -1.25 -2.53 118.94 118.46 1xup s TRP 200 Ca 0.38 1.24 -0.21 0.00 0.02 0.00 0.00 56.10 57.53 1xup s TRP 200 Cb 0.07 -3.95 0.08 0.00 -1.15 0.00 0.00 33.47 28.52 1xup s TRP 200 CO 0.12 -2.98 0.79 0.34 0.02 0.00 0.00 176.95 175.24 1xup s ASP 201 N -0.42 6.20 0.50 2.95 2.15 -1.08 -4.88 116.67 122.09 1xup s ASP 201 Ca 0.59 -1.09 0.24 0.00 0.43 0.00 0.00 52.55 52.72 1xup s ASP 201 Cb -0.45 -2.35 1.31 0.00 -0.30 0.00 0.00 42.92 41.14 1xup s ASP 201 CO 0.58 -1.18 2.03 -0.61 -0.17 0.00 0.00 175.17 175.82 1xup h GLN 202 N 9.28 0.00 0.00 4.34 -0.00 -1.92 -3.37 115.11 123.44 1xup h GLN 202 Ca -0.29 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.36 1xup h GLN 202 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.56 1xup h GLN 202 CO 1.10 0.15 0.00 -1.91 0.00 0.00 0.00 178.83 178.17 1xup n GLU 203 N -3.76 0.00 -0.33 1.69 2.13 -1.26 -2.31 120.64 116.79 1xup n GLU 203 Ca -0.02 0.46 0.33 0.00 0.66 0.00 0.00 57.16 58.59 1xup n GLU 203 Cb 0.26 -1.11 0.69 0.00 0.27 0.00 0.00 31.44 31.55 1xup n GLU 203 CO 0.00 0.00 0.00 0.97 -0.41 0.00 0.00 177.13 177.69 1xup h ILE 204 N 0.00 0.41 -0.79 6.31 2.10 -2.03 -1.55 117.51 121.97 1xup h ILE 204 Ca 0.00 -0.03 0.16 0.00 1.08 0.00 0.00 64.86 66.07 1xup h ILE 204 Cb 0.00 0.31 -0.10 0.00 -1.09 0.00 0.00 36.82 35.93 1xup h ILE 204 CO 0.00 0.02 0.30 -0.07 -1.08 0.00 0.00 178.15 177.32 1xup h LEU 205 N 0.10 0.24 -1.50 2.19 3.38 -1.63 -0.45 115.31 117.65 1xup h LEU 205 Ca 0.59 0.13 0.10 0.00 0.09 0.00 0.00 57.88 58.79 1xup h LEU 205 Cb 2.13 0.12 -0.05 0.00 0.09 0.00 0.00 40.66 42.95 1xup h LEU 205 CO -0.10 0.06 0.47 0.44 0.09 0.00 0.00 178.44 179.40 1xup h ASP 206 N 0.41 0.50 -0.97 -0.43 3.32 -1.30 0.64 116.42 118.59 1xup h ASP 206 Ca 0.45 0.01 0.12 0.00 0.02 0.00 0.00 57.03 57.64 1xup h ASP 206 Cb 0.74 -0.09 -0.08 0.00 0.22 0.00 0.00 39.33 40.12 1xup h ASP 206 CO -0.45 0.30 0.61 0.25 -1.72 0.00 0.00 179.24 178.23 1xup h LEU 207 N 0.56 0.86 -2.97 1.55 5.85 -1.23 -0.98 115.31 118.94 1xup h LEU 207 Ca 0.33 0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.09 1xup h LEU 207 Cb 0.53 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.43 1xup h LEU 207 CO -0.11 0.45 0.00 0.18 -0.34 0.00 0.00 178.44 178.62 1xup n LEU 208 N -4.60 3.58 -3.63 2.25 7.99 -0.77 -4.96 117.00 116.86 1xup n LEU 208 Ca 0.18 -2.25 -0.23 0.00 -0.01 0.00 0.00 56.01 53.70 1xup n LEU 208 Cb 0.38 -0.39 0.07 0.00 -0.11 0.00 0.00 43.42 43.37 1xup n LEU 208 CO 0.28 0.78 0.16 0.59 -1.51 0.00 0.00 177.39 177.68 1xup n ASN 209 N 0.63 -4.50 -4.67 -1.43 5.03 -0.37 -4.96 115.26 104.99 1xup n ASN 209 Ca 0.18 -0.63 -0.41 0.00 0.87 0.00 0.00 54.58 54.58 1xup n ASN 209 Cb 0.62 -4.74 -0.04 0.00 -1.02 0.00 0.00 39.78 34.60 1xup n ASN 209 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1xup s ILE 210 N -3.36 4.88 0.30 2.41 1.01 0.12 -4.98 121.20 121.58 1xup s ILE 210 Ca 0.40 1.62 -0.30 0.00 0.00 0.00 0.00 60.65 62.37 1xup s ILE 210 Cb -0.18 -4.13 -0.12 0.00 0.01 0.00 0.00 42.46 38.04 1xup s ILE 210 CO 0.76 0.03 1.47 -2.65 0.00 0.00 0.00 174.94 174.55 1xup n PRO 211 N 5.23 2.42 -0.57 2.79 -0.02 -1.26 -4.53 135.00 139.06 1xup n PRO 211 Ca 0.04 0.86 0.05 0.00 -2.02 0.00 0.00 63.50 62.42 1xup n PRO 211 Cb 0.49 -2.56 0.26 0.00 -0.02 0.00 0.00 33.50 31.67 1xup n PRO 211 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1xup n SER 212 N 1.64 3.99 0.00 2.55 2.88 -1.26 -4.68 113.62 118.75 1xup n SER 212 Ca 0.07 -2.58 0.00 0.00 -1.33 0.00 0.00 58.87 55.04 1xup n SER 212 Cb 0.36 -0.61 0.00 0.00 -0.75 0.00 0.00 64.21 63.20 1xup n SER 212 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1xup n SER 213 N 0.41 0.00 -4.21 -3.46 3.41 -1.26 -4.86 113.62 103.65 1xup n SER 213 Ca 0.18 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.50 1xup n SER 213 Cb 0.84 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.70 1xup n SER 213 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 175.04 176.03 1xup n MET 214 N 0.00 0.62 -4.62 4.33 0.00 -1.26 -4.92 117.12 111.27 1xup n MET 214 Ca 0.00 -1.75 -0.30 0.00 0.00 0.00 0.00 57.70 55.65 1xup n MET 214 Cb 0.00 -3.44 -0.14 0.00 0.00 0.00 0.00 33.22 29.65 1xup n MET 214 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1xup s LEU 215 N 9.86 2.29 1.00 3.17 1.02 -1.26 -3.61 118.68 131.16 1xup s LEU 215 Ca 0.73 -0.65 -0.12 0.00 0.02 0.00 0.00 54.13 54.10 1xup s LEU 215 Cb 0.03 -1.28 0.14 0.00 0.02 0.00 0.00 46.19 45.10 1xup s LEU 215 CO 0.20 0.22 0.78 -2.65 0.02 0.00 0.00 176.35 174.92 1xup n PRO 216 N 1.30 -0.94 -4.09 1.29 -0.02 -1.26 -5.01 135.00 126.27 1xup n PRO 216 Ca -0.17 -0.23 -0.35 0.00 -2.02 0.00 0.00 63.50 60.73 1xup n PRO 216 Cb 0.52 -2.11 -0.09 0.00 -0.02 0.00 0.00 33.50 31.81 1xup n PRO 216 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1xup s GLU 217 N -4.16 3.63 -0.83 -0.52 -1.05 -0.73 -4.87 118.70 110.16 1xup s GLU 217 Ca 0.63 -0.32 -0.25 0.00 -0.15 0.00 0.00 54.97 54.87 1xup s GLU 217 Cb -0.22 -3.10 -0.07 0.00 -0.44 0.00 0.00 34.13 30.31 1xup s GLU 217 CO 0.63 0.47 2.08 0.08 0.95 0.00 0.00 175.26 179.48 1xup s VAL 218 N -0.20 3.30 0.00 1.83 1.01 -1.26 -2.49 120.40 122.59 1xup s VAL 218 Ca 0.07 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 61.85 1xup s VAL 218 Cb -0.12 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1xup s VAL 218 CO 0.01 -0.66 0.00 2.29 0.00 0.00 0.00 175.10 176.75 1xup n LYS 219 N 8.88 -0.19 -4.12 2.72 2.85 -1.26 -4.91 118.16 122.14 1xup n LYS 219 Ca 0.40 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 57.42 1xup n LYS 219 Cb 0.47 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.78 1xup n LYS 219 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 1xup s SER 220 N -1.16 4.47 0.00 -5.58 0.01 -1.26 -4.66 113.70 105.52 1xup s SER 220 Ca 0.00 -1.01 0.00 0.00 1.31 0.00 0.00 55.95 56.25 1xup s SER 220 Cb 0.00 -0.52 0.00 0.00 0.21 0.00 0.00 66.02 65.71 1xup s SER 220 CO 0.00 -0.49 0.00 0.59 0.41 0.00 0.00 173.24 173.75 1xup n ASN 221 N -1.22 3.26 -0.78 2.44 5.03 -1.26 -3.80 115.26 118.94 1xup n ASN 221 Ca -0.01 0.00 0.04 0.00 0.87 0.00 0.00 54.58 55.47 1xup n ASN 221 Cb 0.64 0.35 0.14 0.00 -1.02 0.00 0.00 39.78 39.89 1xup n ASN 221 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1xup n SER 222 N -1.44 2.16 -3.73 6.41 7.64 -1.26 -4.52 113.62 118.87 1xup n SER 222 Ca 0.00 -2.18 -0.05 0.00 1.01 0.00 0.00 58.87 57.65 1xup n SER 222 Cb 0.30 -0.38 -0.01 0.00 -1.01 0.00 0.00 64.21 63.11 1xup n SER 222 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1xup s GLU 223 N -1.65 1.44 1.02 1.43 1.03 -1.26 -3.90 118.70 116.81 1xup s GLU 223 Ca 0.20 -0.81 -0.17 0.00 0.03 0.00 0.00 54.97 54.22 1xup s GLU 223 Cb 0.13 0.48 0.09 0.00 -0.80 0.00 0.00 34.13 34.03 1xup s GLU 223 CO 0.09 -0.66 -0.06 1.55 -1.33 0.00 0.00 175.26 174.85 1xup n VAL 224 N -0.48 0.00 0.00 1.83 3.14 -1.25 -3.24 118.33 118.32 1xup n VAL 224 Ca -0.05 -0.12 0.00 0.00 -2.96 0.00 0.00 64.34 61.21 1xup n VAL 224 Cb 0.60 -0.44 0.00 0.00 -1.06 0.00 0.00 33.84 32.95 1xup n VAL 224 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1xup n TYR 225 N -4.22 0.00 0.00 1.45 4.19 0.27 -4.55 117.16 114.30 1xup n TYR 225 Ca 0.03 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.24 1xup n TYR 225 Cb 0.48 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.31 1xup n TYR 225 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1xup n GLY 226 N -0.44 1.61 0.00 2.98 0.00 -1.23 -4.49 105.19 103.63 1xup n GLY 226 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1xup n GLY 226 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1xup n HIS 227 N 0.00 0.00 -4.96 1.61 -0.00 -1.26 -4.37 115.22 106.24 1xup n HIS 227 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 57.72 57.40 1xup n HIS 227 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 29.99 29.85 1xup n HIS 227 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 1xup s THR 228 N -1.65 2.81 0.00 1.59 2.01 -1.14 -4.69 115.64 114.58 1xup s THR 228 Ca 0.00 -0.79 0.00 0.00 0.31 0.00 0.00 61.69 61.21 1xup s THR 228 Cb 0.00 -2.11 0.00 0.00 0.01 0.00 0.00 72.50 70.40 1xup s THR 228 CO 0.00 0.57 0.00 -1.14 -0.69 0.00 0.00 174.62 173.36 1xup n ARG 229 N 2.76 0.00 -1.58 4.92 0.63 -1.26 -4.44 116.66 117.69 1xup n ARG 229 Ca -0.17 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.46 1xup n ARG 229 Cb 0.52 0.00 0.10 0.00 0.45 0.00 0.00 32.46 33.53 1xup n ARG 229 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 1xup s SER 230 N -0.20 4.33 0.15 6.15 0.01 -1.26 -4.94 113.70 117.94 1xup s SER 230 Ca 0.00 1.20 -0.31 0.00 1.31 0.00 0.00 55.95 58.15 1xup s SER 230 Cb 0.00 -1.90 -0.10 0.00 0.21 0.00 0.00 66.02 64.23 1xup s SER 230 CO 0.00 -2.06 1.74 -0.31 0.41 0.00 0.00 173.24 173.02 1xup s TYR 231 N -3.21 2.53 0.00 2.43 1.51 -1.26 -4.08 117.35 115.27 1xup s TYR 231 Ca 0.61 0.22 0.00 0.00 -1.01 0.00 0.00 57.07 56.89 1xup s TYR 231 Cb -0.14 -4.10 0.00 0.00 -0.11 0.00 0.00 41.96 37.60 1xup s TYR 231 CO 0.54 -4.38 0.00 1.58 -1.11 0.00 0.00 175.55 172.18 1xup n HIS 232 N 4.95 0.00 -4.06 2.71 -0.00 -1.26 -4.93 115.22 112.63 1xup n HIS 232 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.88 1xup n HIS 232 Cb 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.37 1xup n HIS 232 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1xup n PHE 233 N 10.29 -0.90 0.00 1.57 -0.00 -1.26 -4.48 117.46 122.68 1xup n PHE 233 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1xup n PHE 233 Cb 0.00 0.17 0.00 0.00 -0.00 0.00 0.00 39.48 39.65 1xup n PHE 233 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 1xup n TYR 234 N -0.15 -0.87 -1.72 -5.13 4.01 -1.26 -4.92 117.16 107.12 1xup n TYR 234 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1xup n TYR 234 Cb 0.00 0.27 0.00 0.00 -0.31 0.00 0.00 39.34 39.30 1xup n TYR 234 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1xup n GLY 235 N -0.37 0.96 2.15 2.72 0.00 -1.26 -3.40 105.19 105.99 1xup n GLY 235 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1xup n GLY 235 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xup n SER 236 N 0.99 -0.33 0.00 1.61 7.64 -1.26 -3.68 113.62 118.59 1xup n SER 236 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1xup n SER 236 Cb 0.35 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 1xup n SER 236 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1xup n GLU 237 N -2.11 0.00 -1.58 1.43 2.13 0.72 -4.57 120.64 116.66 1xup n GLU 237 Ca 0.00 0.81 0.00 0.00 0.66 0.00 0.00 57.16 58.63 1xup n GLU 237 Cb 0.00 -1.22 0.00 0.00 0.27 0.00 0.00 31.44 30.49 1xup n GLU 237 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 1xup n VAL 238 N -2.79 -5.10 -1.63 6.31 3.14 -1.26 -3.74 118.33 113.26 1xup n VAL 238 Ca 0.00 2.28 -0.48 0.00 -2.96 0.00 0.00 64.34 63.19 1xup n VAL 238 Cb 0.00 -3.12 -0.05 0.00 -1.06 0.00 0.00 33.84 29.62 1xup n VAL 238 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 1xup n PRO 239 N -0.04 1.99 -3.30 1.45 -0.02 -1.26 -4.47 135.00 129.35 1xup n PRO 239 Ca 0.00 0.68 -0.18 0.00 -2.02 0.00 0.00 63.50 61.97 1xup n PRO 239 Cb 0.00 -2.73 -0.00 0.00 -0.02 0.00 0.00 33.50 30.74 1xup n PRO 239 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1xup s ILE 240 N 5.40 3.34 -0.39 4.25 1.09 -1.26 -4.83 121.20 128.80 1xup s ILE 240 Ca 0.97 -1.08 0.11 0.00 -1.10 0.00 0.00 60.65 59.56 1xup s ILE 240 Cb -0.65 -3.14 0.42 0.00 -1.06 0.00 0.00 42.46 38.03 1xup s ILE 240 CO 0.48 -0.07 0.98 0.00 -0.10 0.00 0.00 174.94 176.23 1xup n ALA 241 N -1.70 3.94 -0.72 9.38 0.00 0.51 0.95 120.51 132.87 1xup n ALA 241 Ca 0.04 -3.74 0.00 0.00 0.00 0.00 0.00 53.44 49.74 1xup n ALA 241 Cb 0.59 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 19.26 1xup n ALA 241 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xup n GLY 242 N -0.18 -0.24 3.54 0.00 0.00 -1.20 -3.89 105.19 103.21 1xup n GLY 242 Ca 0.24 -1.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.15 1xup n GLY 242 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1xup s MET 243 N 0.00 1.49 -0.18 1.61 1.75 -1.25 -3.49 119.30 119.23 1xup s MET 243 Ca 0.00 -1.28 -0.30 0.00 -1.25 0.00 0.00 55.69 52.86 1xup s MET 243 Cb 0.00 0.45 0.14 0.00 2.84 0.00 0.00 34.83 38.26 1xup s MET 243 CO 0.00 -0.61 1.09 0.00 -0.65 0.00 0.00 175.02 174.85 1xup s ALA 244 N -4.03 -1.98 -0.07 4.11 0.00 -0.57 -4.60 121.76 114.63 1xup s ALA 244 Ca 0.24 1.62 -0.29 0.00 0.00 0.00 0.00 51.96 53.52 1xup s ALA 244 Cb 0.00 -0.77 -0.07 0.00 0.00 0.00 0.00 23.12 22.28 1xup s ALA 244 CO 0.09 -0.34 2.09 0.20 0.00 0.00 0.00 175.76 177.79 1xup s GLY 245 N -1.27 1.04 0.10 0.00 0.00 -1.26 -0.83 107.32 105.11 1xup s GLY 245 Ca 0.02 1.10 -0.24 0.00 0.00 0.00 0.00 44.72 45.60 1xup s GLY 245 CO -0.02 3.63 1.70 1.29 0.00 0.00 0.00 173.10 179.71 1xup h ASP 246 N 12.56 -0.23 -1.08 1.64 2.03 -0.45 0.37 116.42 131.26 1xup h ASP 246 Ca -0.46 0.03 -0.55 0.00 -0.73 0.00 0.00 57.03 55.32 1xup h ASP 246 Cb 1.24 0.09 -0.16 0.00 -0.83 0.00 0.00 39.33 39.66 1xup h ASP 246 CO 0.95 -0.13 0.82 0.00 -1.03 0.00 0.00 179.24 179.85 1xup n GLN 247 N -5.20 2.88 0.00 4.15 6.02 -1.26 -1.50 117.38 122.47 1xup n GLN 247 Ca -0.07 -2.58 0.00 0.00 -0.01 0.00 0.00 57.00 54.34 1xup n GLN 247 Cb 0.13 -2.25 0.00 0.00 1.02 0.00 0.00 30.24 29.14 1xup n GLN 247 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1xup n GLN 248 N 1.07 0.00 0.16 -1.09 7.27 -1.16 -4.86 117.38 118.76 1xup n GLN 248 Ca 0.52 0.00 0.16 0.00 0.07 0.00 0.00 57.00 57.74 1xup n GLN 248 Cb 0.49 -0.00 0.74 0.00 2.41 0.00 0.00 30.24 33.87 1xup n GLN 248 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1xup h ALA 249 N 0.00 2.07 -0.16 1.69 0.00 -0.23 -1.21 119.26 121.43 1xup h ALA 249 Ca 0.00 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.95 1xup h ALA 249 Cb 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1xup h ALA 249 CO 0.00 -0.32 0.29 0.00 0.00 0.00 0.00 179.25 179.21 1xup h ALA 250 N 1.83 1.65 -0.85 0.00 0.00 -1.54 0.27 119.26 120.63 1xup h ALA 250 Ca 0.11 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.07 1xup h ALA 250 Cb 0.51 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 1xup h ALA 250 CO -0.00 -0.37 0.56 1.25 0.00 0.00 0.00 179.25 180.68 1xup h LEU 251 N 0.00 0.87 0.00 0.00 6.46 -1.52 -1.70 115.31 119.42 1xup h LEU 251 Ca 0.08 -0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.79 1xup h LEU 251 Cb 0.65 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.38 1xup h LEU 251 CO -0.00 0.58 -0.65 -0.26 -0.62 0.00 0.00 178.44 177.49 1xup h PHE 252 N 1.00 0.00 0.00 1.25 0.05 -0.67 -3.28 116.94 115.30 1xup h PHE 252 Ca 0.35 0.00 0.00 0.00 3.82 0.00 0.00 57.97 62.14 1xup h PHE 252 Cb 0.11 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.06 1xup h PHE 252 CO -0.00 0.19 0.00 0.78 -0.18 0.00 0.00 178.31 179.10 1xup h GLY 253 N 3.86 0.00 -4.41 -1.45 0.00 -0.97 -3.41 103.07 96.68 1xup h GLY 253 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 46.88 1xup h GLY 253 CO 0.02 0.00 -0.78 1.62 0.00 0.00 0.00 176.54 177.40 1xup s GLN 254 N -3.56 0.86 -0.80 4.80 2.00 -1.21 -4.83 119.66 116.91 1xup s GLN 254 Ca -0.02 -0.99 -0.06 0.00 -2.00 0.00 0.00 55.36 52.30 1xup s GLN 254 Cb 0.07 -0.88 -0.09 0.00 0.80 0.00 0.00 33.01 32.90 1xup s GLN 254 CO 0.25 0.20 2.41 -1.33 -0.50 0.00 0.00 175.29 176.32 1xup n MET 255 N 1.22 2.19 -1.26 1.67 2.81 -1.26 -4.68 117.12 117.82 1xup n MET 255 Ca -0.21 -1.38 -0.25 0.00 -1.81 0.00 0.00 57.70 54.05 1xup n MET 255 Cb 0.54 -2.35 -0.09 0.00 -0.71 0.00 0.00 33.22 30.61 1xup n MET 255 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1xup n ALA 256 N 3.65 6.83 -0.08 3.04 0.00 -1.25 -4.01 120.51 128.69 1xup n ALA 256 Ca 0.47 -2.76 -0.15 0.00 0.00 0.00 0.00 53.44 50.99 1xup n ALA 256 Cb 0.29 -2.69 -0.07 0.00 0.00 0.00 0.00 19.45 16.98 1xup n ALA 256 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1xup n PHE 257 N 2.57 0.00 -2.51 0.00 0.99 -1.26 -4.46 117.46 112.79 1xup n PHE 257 Ca 0.57 0.00 -0.33 0.00 -0.00 0.00 0.00 57.45 57.70 1xup n PHE 257 Cb 0.58 -0.60 -0.04 0.00 -1.00 0.00 0.00 39.48 38.42 1xup n PHE 257 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.76 174.93 1xup s GLU 258 N -2.31 3.90 -1.23 -1.08 -1.05 -1.26 -4.93 118.70 110.74 1xup s GLU 258 Ca -0.22 1.15 -0.18 0.00 -0.15 0.00 0.00 54.97 55.57 1xup s GLU 258 Cb 0.08 -2.12 -0.01 0.00 -0.44 0.00 0.00 34.13 31.63 1xup s GLU 258 CO 0.32 -0.32 1.99 1.63 0.95 0.00 0.00 175.26 179.83 1xup n LYS 259 N -1.19 2.47 0.00 -4.83 4.76 -1.26 -3.33 118.16 114.77 1xup n LYS 259 Ca 0.08 -2.60 0.00 0.00 -2.87 0.00 0.00 58.31 52.92 1xup n LYS 259 Cb 0.53 -3.33 0.00 0.00 -1.84 0.00 0.00 35.03 30.40 1xup n LYS 259 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xup n GLY 260 N 4.78 0.00 3.28 0.72 0.00 -1.26 -5.15 105.19 107.56 1xup n GLY 260 Ca 0.50 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.41 1xup n GLY 260 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1xup s MET 261 N 0.00 0.40 0.22 1.61 -2.45 -1.21 -5.00 119.30 112.86 1xup s MET 261 Ca 0.00 0.80 0.09 0.00 -1.25 0.00 0.00 55.69 55.33 1xup s MET 261 Cb 0.00 -0.02 -0.05 0.00 1.25 0.00 0.00 34.83 36.01 1xup s MET 261 CO 0.00 -0.16 -0.17 0.42 1.05 0.00 0.00 175.02 176.16 1xup s ILE 262 N 1.41 2.01 0.28 10.11 -1.09 -1.21 -4.74 121.20 127.97 1xup s ILE 262 Ca -0.10 -2.20 0.02 0.00 -2.23 0.00 0.00 60.65 56.15 1xup s ILE 262 Cb -0.08 -2.08 -0.04 0.00 -1.58 0.00 0.00 42.46 38.68 1xup s ILE 262 CO -0.13 -0.45 0.15 -1.59 -1.23 0.00 0.00 174.94 171.69 1xup s LYS 263 N -3.37 1.52 -0.22 2.79 0.00 -1.26 -3.40 119.74 115.81 1xup s LYS 263 Ca 0.23 -1.85 -0.10 0.00 0.00 0.00 0.00 55.97 54.25 1xup s LYS 263 Cb -0.03 -0.09 0.08 0.00 0.00 0.00 0.00 37.83 37.79 1xup s LYS 263 CO 0.09 -0.42 0.51 1.21 0.00 0.00 0.00 175.35 176.74 1xup s ASN 264 N -3.34 -0.62 -0.02 0.03 2.47 -0.76 -4.74 114.94 107.96 1xup s ASN 264 Ca 0.37 1.15 -0.00 0.00 0.42 0.00 0.00 52.86 54.80 1xup s ASN 264 Cb 0.06 1.30 -0.04 0.00 -1.45 0.00 0.00 41.25 41.12 1xup s ASN 264 CO 0.16 -0.22 0.04 -0.89 -3.72 0.00 0.00 177.10 172.48 1xup s THR 265 N 2.04 4.48 0.01 -5.21 2.01 -0.95 -2.45 115.64 115.57 1xup s THR 265 Ca -0.07 -0.44 -0.05 0.00 0.31 0.00 0.00 61.69 61.45 1xup s THR 265 Cb -0.09 -3.00 -0.02 0.00 0.01 0.00 0.00 72.50 69.40 1xup s THR 265 CO -0.15 0.41 -0.09 -1.22 -0.69 0.00 0.00 174.62 172.87 1xup n TYR 266 N 1.43 0.00 0.00 4.92 0.53 -1.22 -0.62 117.16 122.20 1xup n TYR 266 Ca -0.15 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.73 1xup n TYR 266 Cb 0.53 -0.15 0.00 0.00 -1.03 0.00 0.00 39.34 38.69 1xup n TYR 266 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1xup n GLY 267 N 2.89 0.00 0.00 2.72 0.00 0.39 -0.81 105.19 110.39 1xup n GLY 267 Ca -0.06 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1xup n GLY 267 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xup n THR 268 N 0.00 0.00 0.00 2.61 -1.04 -1.26 -4.48 114.28 110.11 1xup n THR 268 Ca 0.00 -0.08 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 1xup n THR 268 Cb 0.00 0.56 0.00 0.00 -1.82 0.00 0.00 70.33 69.07 1xup n THR 268 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xup n GLY 269 N 0.58 -0.74 3.19 3.41 0.00 0.01 -4.45 105.19 107.19 1xup n GLY 269 Ca 0.00 0.42 -0.07 0.00 0.00 0.00 0.00 46.02 46.37 1xup n GLY 269 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xup s ALA 270 N -1.16 -1.29 -0.34 4.61 0.00 -1.23 -4.51 121.76 117.83 1xup s ALA 270 Ca 0.00 1.44 -0.01 0.00 0.00 0.00 0.00 51.96 53.39 1xup s ALA 270 Cb 0.00 -1.52 0.12 0.00 0.00 0.00 0.00 23.12 21.73 1xup s ALA 270 CO 0.00 -0.95 0.18 -0.06 0.00 0.00 0.00 175.76 174.93 1xup s PHE 271 N 2.64 0.91 -0.15 0.00 0.40 0.20 -3.24 117.98 118.74 1xup s PHE 271 Ca 0.04 -1.57 -0.05 0.00 -0.60 0.00 0.00 56.93 54.75 1xup s PHE 271 Cb -0.13 -1.14 -0.04 0.00 0.51 0.00 0.00 43.02 42.22 1xup s PHE 271 CO -0.15 -0.83 0.03 0.42 0.70 0.00 0.00 175.22 175.40 1xup s ILE 272 N 1.28 4.55 0.09 0.64 1.09 -1.26 -2.25 121.20 125.34 1xup s ILE 272 Ca 0.15 -0.13 -0.24 0.00 -1.10 0.00 0.00 60.65 59.32 1xup s ILE 272 Cb -0.21 -3.00 0.06 0.00 -1.06 0.00 0.00 42.46 38.26 1xup s ILE 272 CO -0.11 0.52 0.59 0.54 -0.10 0.00 0.00 174.94 176.38 1xup s VAL 273 N -0.09 0.01 -0.04 2.92 0.11 -1.26 -4.36 120.40 117.69 1xup s VAL 273 Ca 0.05 -0.08 -0.29 0.00 -2.93 0.00 0.00 61.98 58.73 1xup s VAL 273 Cb -0.12 -1.01 0.09 0.00 -1.53 0.00 0.00 36.38 33.81 1xup s VAL 273 CO 0.02 -0.05 0.77 0.00 -3.33 0.00 0.00 175.10 172.51 1xup s MET 274 N -2.89 0.95 0.18 1.54 0.23 -1.19 -4.80 119.30 113.32 1xup s MET 274 Ca -0.03 0.07 -0.31 0.00 -1.03 0.00 0.00 55.69 54.39 1xup s MET 274 Cb -0.01 0.45 -0.09 0.00 -1.53 0.00 0.00 34.83 33.65 1xup s MET 274 CO -0.05 -0.33 1.48 1.21 -2.03 0.00 0.00 175.02 175.29 1xup s ASN 275 N -1.52 6.68 -0.18 -1.18 3.84 -1.26 -2.74 114.94 118.58 1xup s ASN 275 Ca -0.05 2.55 -0.17 0.00 0.21 0.00 0.00 52.86 55.39 1xup s ASN 275 Cb -0.00 -2.60 -0.06 0.00 -0.55 0.00 0.00 41.25 38.04 1xup s ASN 275 CO 0.03 -0.73 -0.34 0.41 -2.79 0.00 0.00 177.10 173.68 1xup n THR 276 N 3.45 1.50 -3.44 -5.21 -1.04 -0.80 -4.90 114.28 103.85 1xup n THR 276 Ca 0.11 0.13 0.00 0.00 -2.04 0.00 0.00 64.05 62.25 1xup n THR 276 Cb 0.40 -2.34 0.00 0.00 -1.82 0.00 0.00 70.33 66.57 1xup n THR 276 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xup n GLY 277 N 1.46 -1.10 0.21 3.41 0.00 -0.75 -5.01 105.19 103.41 1xup n GLY 277 Ca -0.15 -0.94 -0.16 0.00 0.00 0.00 0.00 46.02 44.77 1xup n GLY 277 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1xup h GLU 278 N 0.00 0.74 -5.88 1.61 -0.00 -1.98 -1.57 114.58 107.50 1xup h GLU 278 Ca 0.00 -0.55 -0.66 0.00 -0.00 0.00 0.00 59.36 58.15 1xup h GLU 278 Cb 0.00 0.10 -0.10 0.00 -0.00 0.00 0.00 28.75 28.75 1xup h GLU 278 CO 0.00 1.17 -0.55 -1.83 -0.00 0.00 0.00 179.01 177.79 1xup s GLU 279 N -3.88 3.18 -0.84 1.06 -1.05 -1.26 -4.53 118.70 111.38 1xup s GLU 279 Ca -0.11 -0.35 -0.22 0.00 -0.15 0.00 0.00 54.97 54.14 1xup s GLU 279 Cb 0.08 -2.95 -0.19 0.00 -0.44 0.00 0.00 34.13 30.63 1xup s GLU 279 CO 0.88 0.70 2.26 -2.30 0.95 0.00 0.00 175.26 177.74 1xup n PRO 280 N 1.63 0.36 -2.27 -4.83 -0.02 -1.26 -4.85 135.00 123.75 1xup n PRO 280 Ca -0.16 -0.78 -0.34 0.00 -2.02 0.00 0.00 63.50 60.20 1xup n PRO 280 Cb 0.54 -3.09 -0.04 0.00 -0.02 0.00 0.00 33.50 30.88 1xup n PRO 280 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1xup s GLN 281 N 8.33 3.07 -1.41 -0.52 -0.21 -1.26 -4.86 119.66 122.80 1xup s GLN 281 Ca 0.95 -1.25 -0.15 0.00 0.02 0.00 0.00 55.36 54.93 1xup s GLN 281 Cb -0.25 -5.31 0.05 0.00 1.00 0.00 0.00 33.01 28.50 1xup s GLN 281 CO 0.19 -3.16 2.09 1.28 -2.12 0.00 0.00 175.29 173.56 1xup n LEU 282 N 11.89 6.37 -4.56 2.90 7.99 -1.26 -4.91 117.00 135.42 1xup n LEU 282 Ca 0.44 -4.11 -0.43 0.00 -0.01 0.00 0.00 56.01 51.90 1xup n LEU 282 Cb 0.47 -1.67 -0.04 0.00 -0.11 0.00 0.00 43.42 42.07 1xup n LEU 282 CO 0.69 0.88 0.83 -0.44 -1.51 0.00 0.00 177.39 177.84 1xup s SER 283 N 3.35 6.47 -0.64 -1.43 0.01 -1.26 -4.95 113.70 115.25 1xup s SER 283 Ca 0.48 0.04 -0.26 0.00 1.31 0.00 0.00 55.95 57.52 1xup s SER 283 Cb 0.11 -2.47 -0.10 0.00 0.21 0.00 0.00 66.02 63.77 1xup s SER 283 CO -0.04 -1.18 2.42 -1.81 0.41 0.00 0.00 173.24 173.04 1xup s ASP 284 N 2.53 4.14 0.00 2.44 1.11 -1.26 -4.45 116.67 121.18 1xup s ASP 284 Ca 0.37 0.59 0.03 0.00 0.18 0.00 0.00 52.55 53.72 1xup s ASP 284 Cb -0.10 -2.52 0.04 0.00 1.07 0.00 0.00 42.92 41.41 1xup s ASP 284 CO 0.25 -3.39 0.93 -3.20 1.18 0.00 0.00 175.17 170.94 1xup n ASN 285 N 17.35 -0.60 0.00 0.27 5.15 -1.26 -5.03 115.26 131.14 1xup n ASN 285 Ca 0.42 -1.82 0.00 0.00 -0.60 0.00 0.00 54.58 52.58 1xup n ASN 285 Cb 0.49 0.17 0.00 0.00 -0.53 0.00 0.00 39.78 39.92 1xup n ASN 285 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1xup n ASP 286 N 0.05 0.00 -4.68 1.20 8.00 -1.26 -4.98 116.55 114.88 1xup n ASP 286 Ca -0.19 0.00 -0.45 0.00 0.71 0.00 0.00 54.79 54.86 1xup n ASP 286 Cb 0.71 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.77 1xup n ASP 286 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1xup n LEU 287 N 0.00 3.56 -4.93 0.64 7.99 -1.26 -4.94 117.00 118.06 1xup n LEU 287 Ca 0.00 1.03 -0.25 0.00 -0.01 0.00 0.00 56.01 56.78 1xup n LEU 287 Cb 0.00 -1.47 0.04 0.00 -0.11 0.00 0.00 43.42 41.88 1xup n LEU 287 CO 0.00 -0.04 0.51 -0.76 -1.51 0.00 0.00 177.39 175.58 1xup s LEU 288 N 2.05 3.14 -0.23 2.23 1.43 0.92 -4.79 118.68 123.43 1xup s LEU 288 Ca 0.82 0.47 -0.09 0.00 -1.03 0.00 0.00 54.13 54.30 1xup s LEU 288 Cb -0.60 -3.25 -0.04 0.00 0.03 0.00 0.00 46.19 42.33 1xup s LEU 288 CO 0.39 -1.22 0.11 0.42 0.23 0.00 0.00 176.35 176.28 1xup s THR 289 N -3.00 4.87 0.36 5.49 -4.23 -1.18 -0.19 115.64 117.76 1xup s THR 289 Ca 0.56 0.01 0.04 0.00 -1.18 0.00 0.00 61.69 61.12 1xup s THR 289 Cb -0.11 -3.26 -0.06 0.00 1.34 0.00 0.00 72.50 70.42 1xup s THR 289 CO 0.43 0.36 0.06 0.28 -0.54 0.00 0.00 174.62 175.21 1xup s THR 290 N 1.13 1.19 0.34 3.99 -1.32 0.46 -4.75 115.64 116.69 1xup s THR 290 Ca 0.06 -2.00 -0.26 0.00 -1.21 0.00 0.00 61.69 58.27 1xup s THR 290 Cb -0.14 -2.72 -0.09 0.00 -1.51 0.00 0.00 72.50 68.04 1xup s THR 290 CO 0.04 0.00 1.03 -0.63 -2.21 0.00 0.00 174.62 172.85 1xup s ILE 291 N -3.20 3.82 0.06 5.08 1.01 -1.26 -0.44 121.20 126.27 1xup s ILE 291 Ca 0.33 1.56 -0.26 0.00 0.00 0.00 0.00 60.65 62.27 1xup s ILE 291 Cb 0.08 -3.88 0.07 0.00 0.01 0.00 0.00 42.46 38.74 1xup s ILE 291 CO 0.15 0.17 0.66 -0.83 0.00 0.00 0.00 174.94 175.09 1xup s GLY 292 N -1.38 -0.58 0.17 6.18 0.00 -0.87 -4.75 107.32 106.09 1xup s GLY 292 Ca 0.51 0.87 0.00 0.00 0.00 0.00 0.00 44.72 46.10 1xup s GLY 292 CO 0.30 0.48 0.21 1.58 0.00 0.00 0.00 173.10 175.67 1xup n TYR 293 N 0.11 -0.81 -0.12 1.90 4.11 -1.26 -2.09 117.16 119.00 1xup n TYR 293 Ca -0.17 -1.17 0.00 0.00 -0.00 0.00 0.00 57.90 56.56 1xup n TYR 293 Cb 0.62 0.24 0.00 0.00 -0.00 0.00 0.00 39.34 40.20 1xup n TYR 293 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1xup n GLY 294 N -0.28 5.49 0.30 -7.48 0.00 -1.26 -4.92 105.19 97.03 1xup n GLY 294 Ca 0.01 -0.83 0.09 0.00 0.00 0.00 0.00 46.02 45.29 1xup n GLY 294 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1xup h ILE 295 N 0.00 0.28 -3.27 -0.61 1.08 -1.99 -3.27 117.51 109.72 1xup h ILE 295 Ca 0.00 -0.04 -0.64 0.00 -0.39 0.00 0.00 64.86 63.79 1xup h ILE 295 Cb 0.00 0.15 -0.14 0.00 -3.07 0.00 0.00 36.82 33.75 1xup h ILE 295 CO 0.00 0.02 0.34 0.20 -0.69 0.00 0.00 178.15 178.02 1xup s ASN 296 N -5.14 6.30 -0.78 1.72 0.01 -1.26 -4.94 114.94 110.85 1xup s ASN 296 Ca -0.13 -0.54 -0.25 0.00 -0.71 0.00 0.00 52.86 51.23 1xup s ASN 296 Cb 0.24 -2.37 -0.20 0.00 0.41 0.00 0.00 41.25 39.33 1xup s ASN 296 CO 0.76 -1.06 1.89 0.61 -1.51 0.00 0.00 177.10 177.79 1xup n GLY 297 N 5.12 1.16 3.40 0.66 0.00 -1.24 -4.82 105.19 109.48 1xup n GLY 297 Ca -0.01 -0.80 -0.20 0.00 0.00 0.00 0.00 46.02 45.01 1xup n GLY 297 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xup s LYS 298 N 6.46 1.51 -0.36 1.61 1.02 -1.26 -5.07 119.74 123.65 1xup s LYS 298 Ca 0.67 -1.81 -0.29 0.00 0.02 0.00 0.00 55.97 54.57 1xup s LYS 298 Cb 0.07 -0.76 0.01 0.00 -0.52 0.00 0.00 37.83 36.63 1xup s LYS 298 CO 0.19 -0.14 1.32 0.54 -0.92 0.00 0.00 175.35 176.33 1xup s VAL 299 N -3.35 4.07 0.43 3.17 0.11 -1.26 -4.49 120.40 119.08 1xup s VAL 299 Ca 0.33 1.16 0.03 0.00 -2.93 0.00 0.00 61.98 60.57 1xup s VAL 299 Cb 0.07 -4.23 -0.02 0.00 -1.53 0.00 0.00 36.38 30.66 1xup s VAL 299 CO 0.13 -0.64 0.10 -0.31 -3.33 0.00 0.00 175.10 171.04 1xup s TYR 300 N 4.76 1.82 0.06 1.54 4.12 -0.89 -5.01 117.35 123.75 1xup s TYR 300 Ca 0.57 -1.19 0.02 0.00 0.02 0.00 0.00 57.07 56.49 1xup s TYR 300 Cb -0.14 -1.28 -0.04 0.00 -1.52 0.00 0.00 41.96 38.98 1xup s TYR 300 CO 0.27 -0.15 0.10 0.71 0.02 0.00 0.00 175.55 176.50 1xup s TYR 301 N -3.12 3.26 0.20 2.71 2.02 -0.59 -2.06 117.35 119.76 1xup s TYR 301 Ca 0.20 0.13 -0.13 0.00 -0.37 0.00 0.00 57.07 56.90 1xup s TYR 301 Cb 0.03 -1.66 0.00 0.00 -0.40 0.00 0.00 41.96 39.93 1xup s TYR 301 CO 0.12 0.54 0.41 0.00 -1.57 0.00 0.00 175.55 175.05 1xup s ALA 302 N -1.38 -0.36 -0.01 3.71 0.00 0.41 -1.81 121.76 122.32 1xup s ALA 302 Ca 0.29 -0.67 0.04 0.00 0.00 0.00 0.00 51.96 51.61 1xup s ALA 302 Cb -0.12 0.92 -0.03 0.00 0.00 0.00 0.00 23.12 23.88 1xup s ALA 302 CO 0.22 -0.76 -0.10 -0.51 0.00 0.00 0.00 175.76 174.61 1xup s LEU 303 N -2.95 3.00 -0.03 0.00 1.02 -1.11 -0.40 118.68 118.21 1xup s LEU 303 Ca 0.16 -0.18 -0.29 0.00 0.02 0.00 0.00 54.13 53.84 1xup s LEU 303 Cb 0.01 -1.70 0.10 0.00 0.02 0.00 0.00 46.19 44.61 1xup s LEU 303 CO 0.02 0.30 0.83 -0.70 0.02 0.00 0.00 176.35 176.82 1xup s GLU 304 N -1.22 0.87 -0.31 1.70 2.12 0.73 -3.16 118.70 119.43 1xup s GLU 304 Ca 0.15 -0.08 0.04 0.00 0.36 0.00 0.00 54.97 55.44 1xup s GLU 304 Cb -0.11 0.41 0.17 0.00 0.26 0.00 0.00 34.13 34.85 1xup s GLU 304 CO 0.05 -0.33 1.12 0.41 -0.54 0.00 0.00 175.26 175.97 1xup n GLY 305 N 0.25 -0.01 3.31 -1.50 0.00 -1.26 -0.05 105.19 105.93 1xup n GLY 305 Ca -0.12 -0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 1xup n GLY 305 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xup n SER 306 N -0.56 -2.38 -4.35 1.61 7.64 -1.26 -4.60 113.62 109.71 1xup n SER 306 Ca -0.18 -0.22 -0.29 0.00 1.01 0.00 0.00 58.87 59.19 1xup n SER 306 Cb 0.70 -1.03 -0.14 0.00 -1.01 0.00 0.00 64.21 62.73 1xup n SER 306 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1xup s ILE 307 N -2.26 2.15 0.14 0.44 1.01 -1.20 -4.23 121.20 117.24 1xup s ILE 307 Ca 0.60 -1.52 -0.32 0.00 0.00 0.00 0.00 60.65 59.41 1xup s ILE 307 Cb -0.16 -1.86 -0.09 0.00 0.01 0.00 0.00 42.46 40.36 1xup s ILE 307 CO 0.63 0.25 1.55 -0.26 0.00 0.00 0.00 174.94 177.11 1xup h PHE 308 N 4.45 -1.74 -2.41 3.97 -1.00 -1.87 -3.39 116.94 114.96 1xup h PHE 308 Ca -0.48 0.10 -0.06 0.00 2.81 0.00 0.00 57.97 60.34 1xup h PHE 308 Cb 1.15 0.84 -0.18 0.00 3.61 0.00 0.00 35.95 41.38 1xup h PHE 308 CO 0.53 -0.45 0.11 0.08 -1.61 0.00 0.00 178.31 176.96 1xup s VAL 309 N -5.62 0.01 -0.48 -0.55 1.01 -1.26 -4.59 120.40 108.93 1xup s VAL 309 Ca -0.14 -0.11 0.08 0.00 0.00 0.00 0.00 61.98 61.81 1xup s VAL 309 Cb 0.10 -0.95 -0.06 0.00 0.00 0.00 0.00 36.38 35.46 1xup s VAL 309 CO 0.62 -0.06 0.40 0.00 0.00 0.00 0.00 175.10 176.06 1xup n ALA 310 N 0.68 2.93 0.00 5.51 0.00 -1.26 -4.81 120.51 123.56 1xup n ALA 310 Ca -0.19 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1xup n ALA 310 Cb 0.59 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.75 1xup n ALA 310 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xup n GLY 311 N 1.07 -1.56 3.56 0.00 0.00 -1.26 -4.01 105.19 102.99 1xup n GLY 311 Ca 0.02 0.54 -0.20 0.00 0.00 0.00 0.00 46.02 46.38 1xup n GLY 311 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xup s SER 312 N 0.00 4.35 0.00 1.61 0.01 -1.26 -4.63 113.70 113.78 1xup s SER 312 Ca 0.00 -0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.19 1xup s SER 312 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 1xup s SER 312 CO 0.00 -3.42 0.00 0.00 0.41 0.00 0.00 173.24 170.23 1xup n ALA 313 N 16.87 0.00 -0.32 1.44 0.00 -1.26 -2.40 120.51 134.84 1xup n ALA 313 Ca 0.43 0.00 0.24 0.00 0.00 0.00 0.00 53.44 54.11 1xup n ALA 313 Cb 0.46 0.00 0.45 0.00 0.00 0.00 0.00 19.45 20.36 1xup n ALA 313 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1xup n ILE 314 N 0.00 -0.40 0.15 0.00 -0.00 -1.26 -0.77 119.36 117.07 1xup n ILE 314 Ca 0.00 2.00 -0.08 0.00 -0.00 0.00 0.00 62.75 64.67 1xup n ILE 314 Cb 0.00 -3.12 -0.05 0.00 -0.00 0.00 0.00 39.64 36.47 1xup n ILE 314 CO 0.00 0.00 0.00 1.56 -0.00 0.00 0.00 176.55 178.11 1xup h GLN 315 N 0.00 -0.46 -0.32 0.38 7.50 -1.94 -0.49 115.11 119.78 1xup h GLN 315 Ca 0.72 0.03 -0.12 0.00 0.50 0.00 0.00 58.65 59.78 1xup h GLN 315 Cb 1.78 0.11 -0.01 0.00 0.05 0.00 0.00 27.48 29.41 1xup h GLN 315 CO -0.80 -0.31 -0.27 2.35 -1.50 0.00 0.00 178.83 178.31 1xup h TRP 316 N -0.48 0.88 -0.90 2.96 7.01 -0.97 -0.38 115.95 124.07 1xup h TRP 316 Ca -0.03 -0.25 0.03 0.00 2.11 0.00 0.00 58.89 60.74 1xup h TRP 316 Cb 0.41 -0.19 -0.05 0.00 -2.10 0.00 0.00 29.16 27.23 1xup h TRP 316 CO -0.12 1.00 0.59 -0.07 -2.79 0.00 0.00 178.44 177.05 1xup h LEU 317 N 0.50 0.99 0.00 0.65 3.38 -1.00 -2.29 115.31 117.54 1xup h LEU 317 Ca 0.06 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1xup h LEU 317 Cb 0.83 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1xup h LEU 317 CO 0.07 0.69 0.00 -1.14 0.09 0.00 0.00 178.44 178.15 1xup n ARG 318 N -4.50 0.00 -2.35 1.13 0.63 -0.19 -0.62 116.66 110.76 1xup n ARG 318 Ca 0.11 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.65 1xup n ARG 318 Cb 0.06 -0.35 -0.02 0.00 0.45 0.00 0.00 32.46 32.61 1xup n ARG 318 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1xup n ASP 319 N -0.51 4.34 0.00 6.15 9.92 -0.15 -0.75 116.55 135.55 1xup n ASP 319 Ca 0.00 -2.85 0.00 0.00 -0.53 0.00 0.00 54.79 51.41 1xup n ASP 319 Cb 0.00 -1.72 0.00 0.00 -0.64 0.00 0.00 41.12 38.76 1xup n ASP 319 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1xup n GLY 320 N 5.37 0.64 0.00 0.44 0.00 -1.15 -4.42 105.19 106.08 1xup n GLY 320 Ca 0.48 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.49 1xup n GLY 320 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xup n LEU 321 N 0.00 0.00 -2.10 0.99 4.77 -0.87 -5.03 117.00 114.76 1xup n LEU 321 Ca 0.00 -0.05 -0.17 0.00 -0.03 0.00 0.00 56.01 55.76 1xup n LEU 321 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1xup n LEU 321 CO 0.00 0.00 -0.20 0.54 -1.33 0.00 0.00 177.39 176.40 1xup n ARG 322 N -1.14 -1.75 0.19 3.23 1.74 0.21 -4.90 116.66 114.25 1xup n ARG 322 Ca 0.00 0.87 -0.08 0.00 -0.77 0.00 0.00 57.85 57.87 1xup n ARG 322 Cb 0.00 -5.40 -0.04 0.00 -1.02 0.00 0.00 32.46 26.00 1xup n ARG 322 CO 0.00 0.00 0.00 0.52 -1.52 0.00 0.00 177.63 176.63 1xup h MET 323 N 0.00 -0.51 0.00 5.56 2.86 -1.55 -3.17 114.93 118.13 1xup h MET 323 Ca -0.38 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.29 1xup h MET 323 Cb 1.23 0.11 0.00 0.00 0.06 0.00 0.00 31.60 33.00 1xup h MET 323 CO 0.48 -0.34 0.00 0.44 1.06 0.00 0.00 176.91 178.55 1xup n ILE 324 N -4.11 0.87 0.00 -1.22 -5.35 -1.25 -4.90 119.36 103.39 1xup n ILE 324 Ca -0.07 0.22 0.00 0.00 -0.27 0.00 0.00 62.75 62.63 1xup n ILE 324 Cb 0.21 -0.97 0.00 0.00 -1.74 0.00 0.00 39.64 37.14 1xup n ILE 324 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 1xup n GLU 325 N -1.43 0.00 -2.69 6.28 4.07 -1.20 -4.42 120.64 121.25 1xup n GLU 325 Ca 0.05 0.00 -0.43 0.00 -0.06 0.00 0.00 57.16 56.72 1xup n GLU 325 Cb 0.15 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.51 1xup n GLU 325 CO 0.00 0.00 0.00 0.95 -0.06 0.00 0.00 177.13 178.02 1xup s THR 326 N 0.00 4.39 0.04 6.31 -4.23 -1.26 -4.77 115.64 116.12 1xup s THR 326 Ca 0.00 1.21 0.03 0.00 -1.18 0.00 0.00 61.69 61.75 1xup s THR 326 Cb 0.00 -4.49 0.04 0.00 1.34 0.00 0.00 72.50 69.40 1xup s THR 326 CO 0.00 -0.79 0.15 -1.20 -0.54 0.00 0.00 174.62 172.24 1xup n SER 327 N 7.33 0.02 0.17 3.99 7.64 -1.26 -0.45 113.62 131.06 1xup n SER 327 Ca 0.10 0.14 0.03 0.00 1.01 0.00 0.00 58.87 60.15 1xup n SER 327 Cb 0.48 -0.07 0.43 0.00 -1.01 0.00 0.00 64.21 64.04 1xup n SER 327 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1xup h PRO 328 N 0.00 0.11 0.00 1.43 0.11 -1.91 -1.99 132.00 129.75 1xup h PRO 328 Ca 0.08 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1xup h PRO 328 Cb 0.26 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.35 1xup h PRO 328 CO -0.05 0.30 0.16 0.94 -0.21 0.00 0.00 178.00 179.14 1xup n GLN 329 N -4.27 0.01 0.00 1.05 7.27 0.40 -3.15 117.38 118.69 1xup n GLN 329 Ca -0.02 0.37 0.00 0.00 0.07 0.00 0.00 57.00 57.43 1xup n GLN 329 Cb 0.28 -1.69 0.00 0.00 2.41 0.00 0.00 30.24 31.24 1xup n GLN 329 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 1xup n SER 330 N -1.42 0.00 0.12 1.69 7.64 -0.75 -1.60 113.62 119.31 1xup n SER 330 Ca -0.00 0.39 0.06 0.00 1.01 0.00 0.00 58.87 60.33 1xup n SER 330 Cb 0.16 0.00 0.53 0.00 -1.01 0.00 0.00 64.21 63.89 1xup n SER 330 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1xup h GLU 331 N 0.00 0.28 -0.98 1.43 4.57 -1.85 0.40 114.58 118.44 1xup h GLU 331 Ca 0.00 -0.02 0.22 0.00 -1.18 0.00 0.00 59.36 58.38 1xup h GLU 331 Cb 0.00 -0.06 -0.09 0.00 -0.16 0.00 0.00 28.75 28.44 1xup h GLU 331 CO 0.00 0.19 0.62 1.49 -1.18 0.00 0.00 179.01 180.13 1xup h GLU 332 N 0.29 0.51 0.00 1.92 4.57 -1.52 -3.37 114.58 116.97 1xup h GLU 332 Ca 0.08 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 1xup h GLU 332 Cb -0.03 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.45 1xup h GLU 332 CO -0.02 0.34 -0.44 1.28 -1.18 0.00 0.00 179.01 178.99 1xup n LEU 333 N -4.63 1.19 -1.33 1.64 4.77 -0.63 -4.88 117.00 113.15 1xup n LEU 333 Ca 0.22 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1xup n LEU 333 Cb 0.71 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 1xup n LEU 333 CO 0.26 0.17 0.42 0.00 -1.33 0.00 0.00 177.39 176.91 1xup n ALA 334 N -2.02 2.47 -2.69 -1.18 0.00 0.14 -4.04 120.51 113.19 1xup n ALA 334 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1xup n ALA 334 Cb 0.22 -1.19 0.05 0.00 0.00 0.00 0.00 19.45 18.53 1xup n ALA 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xup n ALA 335 N 1.17 -3.28 0.20 0.00 0.00 -1.26 -4.76 120.51 112.57 1xup n ALA 335 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1xup n ALA 335 Cb 0.29 -2.89 0.00 0.00 0.00 0.00 0.00 19.45 16.85 1xup n ALA 335 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1xup n LYS 336 N 2.16 0.00 -3.82 0.00 2.85 -1.26 -4.97 118.16 113.12 1xup n LYS 336 Ca 0.08 0.00 -0.35 0.00 -1.05 0.00 0.00 58.31 57.00 1xup n LYS 336 Cb 0.66 0.00 -0.12 0.00 -0.65 0.00 0.00 35.03 34.92 1xup n LYS 336 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1xup s ALA 337 N -2.00 3.22 0.00 0.58 0.00 -1.26 -5.06 121.76 117.24 1xup s ALA 337 Ca 0.00 -2.77 0.00 0.00 0.00 0.00 0.00 51.96 49.19 1xup s ALA 337 Cb 0.00 -2.37 0.00 0.00 0.00 0.00 0.00 23.12 20.75 1xup s ALA 337 CO 0.00 -1.87 0.00 1.63 0.00 0.00 0.00 175.76 175.52 1xup n LYS 338 N 4.15 0.00 0.00 0.00 4.76 -1.26 -5.05 118.16 120.76 1xup n LYS 338 Ca 0.02 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 1xup n LYS 338 Cb 0.40 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.59 1xup n LYS 338 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xup n GLY 339 N 0.00 -0.95 6.34 0.72 0.00 -1.26 -4.92 105.19 105.12 1xup n GLY 339 Ca 0.00 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.70 1xup n GLY 339 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1xup n ASP 340 N 0.00 0.00 -2.55 1.61 -0.08 -1.26 -4.89 116.55 109.38 1xup n ASP 340 Ca 0.00 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.27 1xup n ASP 340 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1xup n ASP 340 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1xup n ASN 341 N 4.49 -7.19 0.00 1.67 5.15 -1.26 -3.87 115.26 114.25 1xup n ASN 341 Ca 0.00 1.18 0.00 0.00 -0.60 0.00 0.00 54.58 55.16 1xup n ASN 341 Cb 0.00 -4.74 0.00 0.00 -0.53 0.00 0.00 39.78 34.51 1xup n ASN 341 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1xup n GLU 342 N 0.54 0.00 -1.77 1.20 1.02 -1.26 -4.54 120.64 115.83 1xup n GLU 342 Ca 0.01 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.73 1xup n GLU 342 Cb 0.03 -2.19 -0.03 0.00 -0.02 0.00 0.00 31.44 29.23 1xup n GLU 342 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1xup s VAL 343 N -0.36 2.53 -0.36 2.62 1.01 -0.76 -4.50 120.40 120.58 1xup s VAL 343 Ca 0.00 0.14 -0.00 0.00 0.00 0.00 0.00 61.98 62.12 1xup s VAL 343 Cb 0.00 -3.09 0.12 0.00 0.00 0.00 0.00 36.38 33.41 1xup s VAL 343 CO 0.00 0.00 0.17 -0.31 0.00 0.00 0.00 175.10 174.96 1xup s TYR 344 N 2.32 1.38 -0.35 5.22 2.02 -1.25 -4.94 117.35 121.75 1xup s TYR 344 Ca 0.78 -1.82 -0.11 0.00 -0.37 0.00 0.00 57.07 55.55 1xup s TYR 344 Cb -0.46 -1.47 0.01 0.00 -0.40 0.00 0.00 41.96 39.64 1xup s TYR 344 CO 0.35 -0.83 0.20 0.08 -1.57 0.00 0.00 175.55 173.77 1xup s VAL 345 N 1.16 4.71 -0.27 0.71 1.01 -1.26 -3.68 120.40 122.77 1xup s VAL 345 Ca 0.14 -0.64 -0.15 0.00 0.00 0.00 0.00 61.98 61.33 1xup s VAL 345 Cb -0.21 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 1xup s VAL 345 CO -0.12 -0.13 0.38 -0.69 0.00 0.00 0.00 175.10 174.54 1xup s VAL 346 N 1.60 5.17 0.01 2.92 1.01 -1.11 -4.86 120.40 125.13 1xup s VAL 346 Ca 0.03 0.60 -0.30 0.00 0.00 0.00 0.00 61.98 62.31 1xup s VAL 346 Cb -0.18 -3.71 -0.08 0.00 0.00 0.00 0.00 36.38 32.41 1xup s VAL 346 CO 0.07 0.16 1.84 -2.84 0.00 0.00 0.00 175.10 174.33 1xup s PRO 347 N 2.06 4.16 -0.32 2.72 0.02 -1.26 -1.98 135.00 140.39 1xup s PRO 347 Ca 0.16 2.45 0.03 0.00 0.02 0.00 0.00 61.00 63.65 1xup s PRO 347 Cb -0.16 -4.07 0.22 0.00 0.02 0.00 0.00 34.50 30.51 1xup s PRO 347 CO 0.10 -0.91 1.27 0.00 -0.33 0.00 0.00 177.00 177.13 1xup n ALA 348 N 7.31 -2.78 0.05 -1.55 0.00 -1.26 -4.78 120.51 117.51 1xup n ALA 348 Ca 0.19 -0.43 -0.03 0.00 0.00 0.00 0.00 53.44 53.16 1xup n ALA 348 Cb 0.42 -2.26 -0.02 0.00 0.00 0.00 0.00 19.45 17.59 1xup n ALA 348 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1xup h PHE 349 N 1.76 -0.20 0.00 0.00 -1.00 -1.87 -3.36 116.94 112.26 1xup h PHE 349 Ca -0.42 -0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.24 1xup h PHE 349 Cb 1.23 0.07 -0.02 0.00 3.61 0.00 0.00 35.95 40.84 1xup h PHE 349 CO -0.12 -0.13 -1.08 0.25 -1.61 0.00 0.00 178.31 175.62 1xup n THR 350 N -4.45 1.48 -4.39 -1.55 -2.24 -1.26 -4.84 114.28 97.03 1xup n THR 350 Ca -0.03 0.06 -0.20 0.00 -2.27 0.00 0.00 64.05 61.62 1xup n THR 350 Cb 0.09 -2.24 -0.10 0.00 -2.10 0.00 0.00 70.33 65.97 1xup n THR 350 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1xup s GLY 351 N -4.73 1.62 0.00 3.38 0.00 -1.26 -4.65 107.32 101.68 1xup s GLY 351 Ca -0.25 -1.77 0.00 0.00 0.00 0.00 0.00 44.72 42.70 1xup s GLY 351 CO 0.39 -1.80 0.00 -0.10 0.00 0.00 0.00 173.10 171.58 1xup n LEU 352 N -0.48 0.45 0.00 0.66 7.94 -1.26 -4.22 117.00 120.09 1xup n LEU 352 Ca -0.07 0.05 0.00 0.00 -1.11 0.00 0.00 56.01 54.88 1xup n LEU 352 Cb 0.62 -0.19 0.00 0.00 0.53 0.00 0.00 43.42 44.38 1xup n LEU 352 CO 0.37 -0.19 0.00 0.61 -1.11 0.00 0.00 177.39 177.07 1xup n GLY 353 N 2.17 -1.11 1.43 -3.96 0.00 -1.26 -4.43 105.19 98.04 1xup n GLY 353 Ca 0.00 -1.23 0.18 0.00 0.00 0.00 0.00 46.02 44.97 1xup n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xup n ALA 354 N 2.67 -3.77 0.23 4.61 0.00 -1.26 -2.73 120.51 120.26 1xup n ALA 354 Ca 0.00 0.67 0.13 0.00 0.00 0.00 0.00 53.44 54.24 1xup n ALA 354 Cb 0.00 -1.43 0.70 0.00 0.00 0.00 0.00 19.45 18.72 1xup n ALA 354 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1xup h PRO 355 N -1.39 0.00 -0.10 0.00 0.11 -1.90 -0.62 132.00 128.10 1xup h PRO 355 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1xup h PRO 355 Cb 1.37 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.47 1xup h PRO 355 CO 0.05 0.00 0.06 1.88 -0.21 0.00 0.00 178.00 179.78 1xup h TYR 356 N 0.00 0.12 0.00 0.65 0.05 -1.98 -3.45 116.97 112.36 1xup h TYR 356 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1xup h TYR 356 Cb 0.29 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 37.99 1xup h TYR 356 CO 0.00 0.08 0.00 0.91 -1.05 0.00 0.00 178.16 178.10 1xup n TRP 357 N -5.02 0.00 -1.53 4.88 5.03 -0.24 -4.85 117.44 115.71 1xup n TRP 357 Ca -0.05 0.00 -0.43 0.00 3.03 0.00 0.00 57.50 60.05 1xup n TRP 357 Cb 0.03 0.00 -0.05 0.00 -1.03 0.00 0.00 31.31 30.26 1xup n TRP 357 CO 0.00 0.00 0.00 -0.25 -0.03 0.00 0.00 177.69 177.41 1xup n ASP 358 N 0.88 2.32 0.09 -0.99 8.00 -1.26 -4.54 116.55 121.05 1xup n ASP 358 Ca 0.00 0.03 0.20 0.00 0.71 0.00 0.00 54.79 55.73 1xup n ASP 358 Cb 0.00 -1.41 0.75 0.00 -0.02 0.00 0.00 41.12 40.44 1xup n ASP 358 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 1xup h SER 359 N 15.44 0.00 -0.01 -2.24 4.64 -1.97 -1.71 113.55 127.71 1xup h SER 359 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1xup h SER 359 Cb 1.28 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1xup h SER 359 CO 1.08 0.00 0.07 -0.33 -0.87 0.00 0.00 176.83 176.78 1xup h GLU 360 N 0.00 0.00 -5.15 4.77 4.39 -1.98 -3.33 114.58 113.28 1xup h GLU 360 Ca 0.19 0.00 -0.70 0.00 0.34 0.00 0.00 59.36 59.18 1xup h GLU 360 Cb 0.93 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.47 1xup h GLU 360 CO -0.00 0.00 2.11 0.00 -1.16 0.00 0.00 179.01 179.96 1xup n ALA 361 N -2.06 4.05 -1.59 3.43 0.00 -0.65 -4.95 120.51 118.74 1xup n ALA 361 Ca -0.03 -3.99 -0.44 0.00 0.00 0.00 0.00 53.44 48.98 1xup n ALA 361 Cb 0.14 -3.41 -0.04 0.00 0.00 0.00 0.00 19.45 16.14 1xup n ALA 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1xup n ARG 362 N 7.05 1.93 -3.64 0.00 5.12 -1.25 -4.96 116.66 120.90 1xup n ARG 362 Ca 0.46 0.55 -0.37 0.00 -1.93 0.00 0.00 57.85 56.56 1xup n ARG 362 Cb 0.43 -3.12 -0.06 0.00 -1.16 0.00 0.00 32.46 28.56 1xup n ARG 362 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1xup s GLY 363 N 7.82 2.35 0.00 -0.13 0.00 -1.26 -5.00 107.32 111.10 1xup s GLY 363 Ca 1.01 -0.39 0.00 0.00 0.00 0.00 0.00 44.72 45.33 1xup s GLY 363 CO 0.38 -0.10 0.00 0.00 0.00 0.00 0.00 173.10 173.38 1xup n ALA 364 N 1.63 0.00 -2.58 3.20 0.00 -0.84 -4.03 120.51 117.89 1xup n ALA 364 Ca -0.14 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.87 1xup n ALA 364 Cb 0.53 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.96 1xup n ALA 364 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1xup s VAL 365 N -2.23 4.55 0.18 0.00 1.01 -1.26 -2.75 120.40 119.90 1xup s VAL 365 Ca 0.00 1.86 0.00 0.00 0.00 0.00 0.00 61.98 63.84 1xup s VAL 365 Cb 0.00 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.18 1xup s VAL 365 CO 0.00 -0.11 0.00 0.49 0.00 0.00 0.00 175.10 175.48 1xup n PHE 366 N 5.97 -1.37 -0.77 5.22 3.01 -1.24 -4.95 117.46 123.33 1xup n PHE 366 Ca 0.12 0.24 -0.28 0.00 1.01 0.00 0.00 57.45 58.54 1xup n PHE 366 Cb 0.46 0.39 -0.04 0.00 -0.01 0.00 0.00 39.48 40.28 1xup n PHE 366 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xup n GLY 367 N 2.16 2.58 3.81 1.37 0.00 -1.26 -4.90 105.19 108.95 1xup n GLY 367 Ca 0.00 -0.89 -0.38 0.00 0.00 0.00 0.00 46.02 44.75 1xup n GLY 367 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xup s LEU 368 N 0.44 4.50 0.43 0.99 1.43 -1.26 -1.83 118.68 123.38 1xup s LEU 368 Ca 0.42 1.19 -0.04 0.00 -1.03 0.00 0.00 54.13 54.68 1xup s LEU 368 Cb 0.11 -2.83 -0.04 0.00 0.03 0.00 0.00 46.19 43.46 1xup s LEU 368 CO 0.05 0.27 0.70 -0.89 0.23 0.00 0.00 176.35 176.70 1xup s THR 369 N -0.99 4.97 0.51 5.49 2.01 -1.26 -5.00 115.64 121.37 1xup s THR 369 Ca 0.28 -0.00 -0.03 0.00 0.31 0.00 0.00 61.69 62.24 1xup s THR 369 Cb -0.19 -3.85 -0.00 0.00 0.01 0.00 0.00 72.50 68.47 1xup s THR 369 CO 0.18 -0.72 0.78 -0.60 -0.69 0.00 0.00 174.62 173.57 1xup s ARG 370 N -4.51 3.08 -0.04 4.92 6.06 -1.26 -4.12 118.95 123.08 1xup s ARG 370 Ca 0.45 -0.17 0.00 0.00 -2.50 0.00 0.00 55.73 53.51 1xup s ARG 370 Cb -0.10 -2.41 0.00 0.00 0.06 0.00 0.00 34.95 32.50 1xup s ARG 370 CO 0.41 -0.44 0.00 0.41 -2.50 0.00 0.00 175.30 173.18 1xup n GLY 371 N -2.32 0.46 3.67 8.12 0.00 -1.26 -5.01 105.19 108.86 1xup n GLY 371 Ca 0.02 -0.16 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 1xup n GLY 371 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xup s THR 372 N -1.93 5.09 0.49 2.61 -4.23 -1.26 -5.04 115.64 111.37 1xup s THR 372 Ca 0.00 1.02 -0.23 0.00 -1.18 0.00 0.00 61.69 61.30 1xup s THR 372 Cb 0.00 -3.87 -0.08 0.00 1.34 0.00 0.00 72.50 69.89 1xup s THR 372 CO 0.00 0.18 1.24 0.41 -0.54 0.00 0.00 174.62 175.90 1xup n THR 373 N 4.46 3.10 -0.29 3.99 -1.04 -1.26 -4.88 114.28 118.36 1xup n THR 373 Ca -0.04 -0.50 0.10 0.00 -2.04 0.00 0.00 64.05 61.57 1xup n THR 373 Cb 0.50 -1.51 0.24 0.00 -1.82 0.00 0.00 70.33 67.75 1xup n THR 373 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1xup h LYS 374 N 1.62 0.14 -3.99 -2.82 1.79 -2.03 -2.91 116.57 108.37 1xup h LYS 374 Ca -0.49 -0.01 -0.72 0.00 -2.18 0.00 0.00 60.65 57.25 1xup h LYS 374 Cb 1.31 -0.03 -0.08 0.00 -1.58 0.00 0.00 32.23 31.85 1xup h LYS 374 CO 0.57 0.09 2.67 -0.85 -1.08 0.00 0.00 179.45 180.86 1xup n GLU 375 N -5.30 3.14 -3.56 3.15 0.00 -1.26 -4.79 120.64 112.02 1xup n GLU 375 Ca 0.19 -2.98 -0.27 0.00 0.00 0.00 0.00 57.16 54.10 1xup n GLU 375 Cb 0.62 -3.18 -0.10 0.00 0.00 0.00 0.00 31.44 28.78 1xup n GLU 375 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 1xup n ASP 376 N 5.52 1.18 -3.29 -1.84 2.03 -1.10 -5.02 116.55 114.03 1xup n ASP 376 Ca 0.47 -2.79 -0.09 0.00 0.52 0.00 0.00 54.79 52.91 1xup n ASP 376 Cb 0.39 -0.64 -0.05 0.00 -0.72 0.00 0.00 41.12 40.10 1xup n ASP 376 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1xup s PHE 377 N -0.82 -0.96 0.11 -0.67 2.99 -1.26 -4.99 117.98 112.37 1xup s PHE 377 Ca 0.31 -0.24 0.00 0.00 0.00 0.00 0.00 56.93 57.00 1xup s PHE 377 Cb 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 43.02 42.97 1xup s PHE 377 CO -0.17 -1.05 0.00 1.33 -0.00 0.00 0.00 175.22 175.33 1xup n VAL 378 N 4.46 0.00 1.43 -0.44 0.24 -1.26 -4.84 118.33 117.92 1xup n VAL 378 Ca 0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.40 1xup n VAL 378 Cb 0.50 -0.28 0.00 0.00 -1.47 0.00 0.00 33.84 32.60 1xup n VAL 378 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1xup n ARG 379 N -2.78 0.84 0.00 7.34 5.12 -1.26 -4.29 116.66 121.63 1xup n ARG 379 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1xup n ARG 379 Cb 0.00 -1.13 0.00 0.00 -1.16 0.00 0.00 32.46 30.17 1xup n ARG 379 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1xup n ALA 380 N -0.33 0.00 -0.29 7.54 0.00 -1.26 -2.81 120.51 123.37 1xup n ALA 380 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 1xup n ALA 380 Cb 0.06 0.00 0.25 0.00 0.00 0.00 0.00 19.45 19.76 1xup n ALA 380 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1xup h THR 381 N 0.00 0.57 0.28 0.00 1.35 -1.89 -0.73 112.91 112.49 1xup h THR 381 Ca 0.00 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 1xup h THR 381 Cb 0.00 0.09 -0.04 0.00 -1.73 0.00 0.00 68.15 66.47 1xup h THR 381 CO 0.00 0.08 -0.51 -0.07 -0.25 0.00 0.00 175.52 174.77 1xup h LEU 382 N 0.44 -1.49 -0.89 3.87 3.38 -1.75 -0.91 115.31 117.95 1xup h LEU 382 Ca 0.49 0.14 -0.07 0.00 0.09 0.00 0.00 57.88 58.54 1xup h LEU 382 Cb 0.85 0.53 -0.02 0.00 0.09 0.00 0.00 40.66 42.10 1xup h LEU 382 CO -0.47 -0.60 0.08 1.56 0.09 0.00 0.00 178.44 179.10 1xup h GLN 383 N -0.86 0.90 -0.57 1.13 1.08 -1.30 -2.91 115.11 112.59 1xup h GLN 383 Ca -0.03 -0.22 0.06 0.00 -1.45 0.00 0.00 58.65 57.01 1xup h GLN 383 Cb 0.81 -0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 28.08 1xup h GLN 383 CO -0.19 0.84 0.38 0.00 -0.95 0.00 0.00 178.83 178.91 1xup h ALA 384 N 1.23 1.84 -0.49 3.87 0.00 -0.69 -2.99 119.26 122.03 1xup h ALA 384 Ca 0.18 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.16 1xup h ALA 384 Cb 0.39 -0.14 -0.10 0.00 0.00 0.00 0.00 17.79 17.94 1xup h ALA 384 CO 0.01 0.07 -0.32 0.28 0.00 0.00 0.00 179.25 179.28 1xup h VAL 385 N 0.54 0.21 -0.62 0.00 2.07 -0.96 -1.49 116.25 116.00 1xup h VAL 385 Ca 0.25 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.87 1xup h VAL 385 Cb 0.28 0.21 -0.08 0.00 -1.52 0.00 0.00 31.29 30.18 1xup h VAL 385 CO -0.07 0.00 0.22 0.00 0.02 0.00 0.00 177.57 177.74 1xup h ALA 386 N 0.89 0.80 -0.84 1.67 0.00 -1.70 0.27 119.26 120.35 1xup h ALA 386 Ca 0.20 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1xup h ALA 386 Cb 0.54 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 1xup h ALA 386 CO -0.60 -0.22 0.46 1.88 0.00 0.00 0.00 179.25 180.77 1xup h TYR 387 N 0.38 1.15 0.09 0.00 0.05 -1.40 -0.75 116.97 116.49 1xup h TYR 387 Ca 0.32 -0.03 -0.19 0.00 0.05 0.00 0.00 58.73 58.88 1xup h TYR 387 Cb 0.42 -0.37 0.02 0.00 1.01 0.00 0.00 36.73 37.82 1xup h TYR 387 CO -0.18 0.80 -0.80 0.37 -1.05 0.00 0.00 178.16 177.30 1xup h GLN 388 N 1.16 0.39 -0.54 4.88 5.75 -0.95 -3.09 115.11 122.71 1xup h GLN 388 Ca 0.29 -0.53 0.10 0.00 -0.15 0.00 0.00 58.65 58.36 1xup h GLN 388 Cb 0.03 0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.73 1xup h GLN 388 CO -0.05 1.21 0.37 0.77 -2.65 0.00 0.00 178.83 178.48 1xup h SER 389 N -0.18 0.28 -0.33 -0.69 0.02 -0.37 0.96 113.55 113.24 1xup h SER 389 Ca -0.12 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.76 1xup h SER 389 Cb 1.56 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 64.04 1xup h SER 389 CO 0.15 0.17 -0.08 0.11 -1.14 0.00 0.00 176.83 176.04 1xup h LYS 390 N 0.31 0.63 0.00 3.45 1.57 -1.16 0.41 116.57 121.78 1xup h LYS 390 Ca 0.25 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1xup h LYS 390 Cb 0.59 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.86 1xup h LYS 390 CO -0.06 0.81 0.00 -0.25 -0.57 0.00 0.00 179.45 179.38 1xup n ASP 391 N -4.44 0.47 -0.04 0.86 9.92 0.31 -1.14 116.55 122.48 1xup n ASP 391 Ca -0.02 0.71 -0.05 0.00 -0.53 0.00 0.00 54.79 54.89 1xup n ASP 391 Cb 0.33 -0.77 -0.04 0.00 -0.64 0.00 0.00 41.12 40.00 1xup n ASP 391 CO 0.00 0.00 0.00 0.55 0.13 0.00 0.00 177.20 177.88 1xup n VAL 392 N -2.12 0.49 0.00 2.53 3.14 -1.03 -4.43 118.33 116.92 1xup n VAL 392 Ca -0.01 -0.21 -0.17 0.00 -2.96 0.00 0.00 64.34 60.98 1xup n VAL 392 Cb 0.04 -0.81 -0.11 0.00 -1.06 0.00 0.00 33.84 31.90 1xup n VAL 392 CO 0.00 0.00 0.00 0.40 -6.46 0.00 0.00 176.83 170.77 1xup h ILE 393 N 0.00 1.43 -0.62 1.55 2.04 -0.84 -3.15 117.51 117.91 1xup h ILE 393 Ca -0.19 -2.09 -0.01 0.00 1.00 0.00 0.00 64.86 63.57 1xup h ILE 393 Cb 1.33 2.62 -0.03 0.00 -0.74 0.00 0.00 36.82 40.00 1xup h ILE 393 CO -0.02 0.61 0.35 0.44 0.00 0.00 0.00 178.15 179.53 1xup h ASP 394 N -0.12 0.76 -0.94 1.72 5.19 -1.32 -2.41 116.42 119.31 1xup h ASP 394 Ca -0.08 -0.08 0.04 0.00 -0.62 0.00 0.00 57.03 56.30 1xup h ASP 394 Cb 1.32 -0.19 -0.06 0.00 0.18 0.00 0.00 39.33 40.58 1xup h ASP 394 CO 0.12 0.62 0.62 0.71 -3.12 0.00 0.00 179.24 178.19 1xup h THR 395 N 0.84 1.14 -0.24 0.35 1.35 -1.71 0.55 112.91 115.19 1xup h THR 395 Ca 0.22 -0.40 -0.01 0.00 -0.55 0.00 0.00 66.41 65.67 1xup h THR 395 Cb 0.02 -0.12 -0.01 0.00 -1.73 0.00 0.00 68.15 66.31 1xup h THR 395 CO -0.04 0.21 0.11 -0.03 -0.25 0.00 0.00 175.52 175.52 1xup h MET 396 N 1.16 0.35 -0.35 4.72 -1.53 -1.41 -0.06 114.93 117.81 1xup h MET 396 Ca 0.38 -0.05 -0.03 0.00 -3.44 0.00 0.00 59.70 56.56 1xup h MET 396 Cb 0.06 -0.06 -0.01 0.00 -0.55 0.00 0.00 31.60 31.03 1xup h MET 396 CO -0.12 0.36 0.12 0.87 0.14 0.00 0.00 176.91 178.27 1xup h LYS 397 N 0.25 0.53 0.00 0.39 1.57 -0.92 -2.73 116.57 115.66 1xup h LYS 397 Ca 0.08 -0.11 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 1xup h LYS 397 Cb 0.13 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1xup h LYS 397 CO -0.01 0.55 -0.28 0.87 -0.57 0.00 0.00 179.45 180.01 1xup h LYS 398 N 0.41 0.00 0.27 3.15 1.57 -0.83 0.87 116.57 122.01 1xup h LYS 398 Ca 0.11 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 1xup h LYS 398 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1xup h LYS 398 CO -0.01 0.28 -0.13 0.22 -0.57 0.00 0.00 179.45 179.25 1xup h ASP 399 N 0.00 -0.31 -0.08 0.86 3.58 -0.72 -3.13 116.42 116.62 1xup h ASP 399 Ca -0.00 -0.12 -0.14 0.00 0.42 0.00 0.00 57.03 57.19 1xup h ASP 399 Cb 0.62 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.74 1xup h ASP 399 CO 0.04 -0.06 -0.42 0.28 -2.88 0.00 0.00 179.24 176.20 1xup h SER 400 N -0.55 0.66 0.00 2.28 0.02 -1.36 -3.47 113.55 111.12 1xup h SER 400 Ca -0.04 -0.30 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 1xup h SER 400 Cb 0.40 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1xup h SER 400 CO 0.06 0.99 0.00 0.61 -1.14 0.00 0.00 176.83 177.35 1xup n GLY 401 N 0.04 2.84 3.56 -3.77 0.00 0.29 -4.98 105.19 103.17 1xup n GLY 401 Ca -0.02 -0.72 -0.38 0.00 0.00 0.00 0.00 46.02 44.90 1xup n GLY 401 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xup s ILE 402 N 0.00 3.17 -0.02 -0.61 1.01 -1.26 -4.82 121.20 118.67 1xup s ILE 402 Ca 0.00 0.12 -0.30 0.00 0.00 0.00 0.00 60.65 60.47 1xup s ILE 402 Cb 0.00 -3.37 -0.05 0.00 0.01 0.00 0.00 42.46 39.06 1xup s ILE 402 CO 0.00 -0.33 1.31 -1.81 0.00 0.00 0.00 174.94 174.11 1xup s ASP 403 N 9.76 6.94 -0.25 3.58 1.01 -1.26 -4.92 116.67 131.53 1xup s ASP 403 Ca 0.87 1.99 -0.01 0.00 0.71 0.00 0.00 52.55 56.11 1xup s ASP 403 Cb -0.18 -2.56 0.03 0.00 1.01 0.00 0.00 42.92 41.22 1xup s ASP 403 CO 0.26 -0.65 -0.08 -0.63 0.21 0.00 0.00 175.17 174.28 1xup s ILE 404 N 2.27 2.68 -0.50 0.77 1.01 -1.26 -4.98 121.20 121.19 1xup s ILE 404 Ca 0.60 -1.17 0.22 0.00 0.00 0.00 0.00 60.65 60.30 1xup s ILE 404 Cb -0.29 -2.40 0.22 0.00 0.01 0.00 0.00 42.46 40.01 1xup s ILE 404 CO 0.25 0.15 1.66 -2.65 0.00 0.00 0.00 174.94 174.35 1xup n PRO 405 N 4.62 0.16 -2.75 2.79 -0.02 -1.26 -4.43 135.00 134.11 1xup n PRO 405 Ca -0.16 0.44 -0.44 0.00 -2.02 0.00 0.00 63.50 61.33 1xup n PRO 405 Cb 0.46 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 1xup n PRO 405 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1xup n LEU 406 N -2.15 5.47 -4.47 2.45 4.77 -1.26 -4.80 117.00 117.02 1xup n LEU 406 Ca 0.02 -4.40 -0.38 0.00 -0.03 0.00 0.00 56.01 51.22 1xup n LEU 406 Cb 0.19 -1.62 -0.12 0.00 -2.33 0.00 0.00 43.42 39.54 1xup n LEU 406 CO 0.17 0.76 -0.21 -0.76 -1.33 0.00 0.00 177.39 176.02 1xup s LEU 407 N 1.71 3.97 -0.01 2.23 1.02 -1.26 -3.29 118.68 123.04 1xup s LEU 407 Ca 0.44 -0.37 0.06 0.00 0.02 0.00 0.00 54.13 54.29 1xup s LEU 407 Cb 0.01 -2.01 -0.03 0.00 0.02 0.00 0.00 46.19 44.18 1xup s LEU 407 CO 0.01 -0.14 -0.20 -0.54 0.02 0.00 0.00 176.35 175.50 1xup s LYS 408 N 1.64 2.21 -0.08 1.70 1.02 -1.22 -1.82 119.74 123.19 1xup s LYS 408 Ca 0.05 -0.88 -0.01 0.00 0.02 0.00 0.00 55.97 55.16 1xup s LYS 408 Cb -0.16 -2.18 -0.03 0.00 -0.52 0.00 0.00 37.83 34.94 1xup s LYS 408 CO 0.07 0.57 -0.04 0.54 -0.92 0.00 0.00 175.35 175.57 1xup s VAL 409 N -0.73 3.99 -0.01 3.17 0.11 0.79 -1.83 120.40 125.88 1xup s VAL 409 Ca 0.12 -0.37 0.16 0.00 -2.93 0.00 0.00 61.98 58.96 1xup s VAL 409 Cb -0.10 -2.66 0.27 0.00 -1.53 0.00 0.00 36.38 32.36 1xup s VAL 409 CO 0.01 0.59 1.11 0.47 -3.33 0.00 0.00 175.10 173.96 1xup n ASP 410 N 2.27 0.24 -0.80 3.54 8.00 -1.02 -4.34 116.55 124.44 1xup n ASP 410 Ca -0.18 -2.00 0.07 0.00 0.71 0.00 0.00 54.79 53.39 1xup n ASP 410 Cb 0.53 -0.07 0.21 0.00 -0.02 0.00 0.00 41.12 41.77 1xup n ASP 410 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xup n GLY 411 N 0.27 3.29 7.00 0.44 0.00 -1.20 -3.17 105.19 111.81 1xup n GLY 411 Ca -0.07 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1xup n GLY 411 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xup n GLY 412 N 0.13 3.12 5.00 -0.02 0.00 -0.14 -0.46 105.19 112.83 1xup n GLY 412 Ca 0.16 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1xup n GLY 412 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xup n ALA 413 N 9.87 0.00 -1.34 4.61 0.00 -1.26 -4.55 120.51 127.83 1xup n ALA 413 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 1xup n ALA 413 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 1xup n ALA 413 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xup n ALA 414 N 0.00 1.31 0.14 0.00 0.00 -1.26 -4.54 120.51 116.15 1xup n ALA 414 Ca 0.00 -2.74 0.02 0.00 0.00 0.00 0.00 53.44 50.72 1xup n ALA 414 Cb 0.00 -3.54 0.03 0.00 0.00 0.00 0.00 19.45 15.95 1xup n ALA 414 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1xup h LYS 415 N 10.09 0.00 -6.51 0.00 3.64 -2.02 -3.42 116.57 118.35 1xup h LYS 415 Ca 0.20 0.00 -0.57 0.00 -1.27 0.00 0.00 60.65 59.00 1xup h LYS 415 Cb 0.85 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.59 1xup h LYS 415 CO 1.50 0.52 0.81 0.54 -2.27 0.00 0.00 179.45 180.55 1xup s ASN 416 N -6.47 6.60 0.20 4.20 4.22 -1.26 -4.90 114.94 117.53 1xup s ASN 416 Ca 0.04 0.38 0.05 0.00 -2.14 0.00 0.00 52.86 51.19 1xup s ASN 416 Cb 0.08 -2.52 0.30 0.00 1.28 0.00 0.00 41.25 40.39 1xup s ASN 416 CO 0.75 -1.17 0.96 -0.67 -2.04 0.00 0.00 177.10 174.92 1xup n ASP 417 N 7.58 0.14 -0.14 3.54 -0.08 -1.26 -2.70 116.55 123.63 1xup n ASP 417 Ca 0.10 0.36 -0.04 0.00 -1.51 0.00 0.00 54.79 53.70 1xup n ASP 417 Cb 0.49 -0.29 0.02 0.00 2.34 0.00 0.00 41.12 43.68 1xup n ASP 417 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1xup h LEU 418 N 0.00 -0.53 -0.66 -2.67 7.12 -1.91 -1.43 115.31 115.24 1xup h LEU 418 Ca 0.00 0.15 0.13 0.00 0.13 0.00 0.00 57.88 58.29 1xup h LEU 418 Cb 0.77 0.32 -0.10 0.00 -0.53 0.00 0.00 40.66 41.12 1xup h LEU 418 CO 0.00 -0.18 0.12 -0.07 -0.13 0.00 0.00 178.44 178.17 1xup h LEU 419 N -0.05 -0.06 -0.07 2.25 4.07 -1.89 0.15 115.31 119.71 1xup h LEU 419 Ca 0.22 0.13 -0.00 0.00 0.08 0.00 0.00 57.88 58.31 1xup h LEU 419 Cb 0.38 0.20 -0.00 0.00 1.08 0.00 0.00 40.66 42.31 1xup h LEU 419 CO -0.49 -0.04 0.03 -0.03 -1.08 0.00 0.00 178.44 176.83 1xup h MET 420 N 0.23 0.11 -1.29 1.13 4.05 -1.64 0.18 114.93 117.70 1xup h MET 420 Ca 0.36 -0.02 -0.21 0.00 -0.28 0.00 0.00 59.70 59.54 1xup h MET 420 Cb 0.57 -0.02 -0.11 0.00 -0.80 0.00 0.00 31.60 31.25 1xup h MET 420 CO -0.47 0.23 0.27 1.04 0.23 0.00 0.00 176.91 178.21 1xup n GLN 421 N -4.95 1.52 0.00 0.39 6.02 -0.28 -3.71 117.38 116.37 1xup n GLN 421 Ca -0.06 -1.12 0.00 0.00 -0.01 0.00 0.00 57.00 55.81 1xup n GLN 421 Cb 0.11 -1.44 0.00 0.00 1.02 0.00 0.00 30.24 29.93 1xup n GLN 421 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1xup n PHE 422 N 0.23 -1.34 -0.39 1.08 7.35 0.36 -4.92 117.46 119.83 1xup n PHE 422 Ca 0.22 0.00 0.34 0.00 -0.76 0.00 0.00 57.45 57.25 1xup n PHE 422 Cb 0.76 0.41 0.67 0.00 0.35 0.00 0.00 39.48 41.67 1xup n PHE 422 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 1xup h GLN 423 N 0.00 0.12 0.34 -4.13 5.75 -0.82 -2.55 115.11 113.83 1xup h GLN 423 Ca 0.00 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.48 1xup h GLN 423 Cb 0.00 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.53 1xup h GLN 423 CO 0.00 0.08 -0.16 0.00 -2.65 0.00 0.00 178.83 176.10 1xup h ALA 424 N 1.46 -1.06 -0.02 3.38 0.00 -1.65 -3.24 119.26 118.13 1xup h ALA 424 Ca 0.67 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.41 1xup h ALA 424 Cb 2.29 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 20.24 1xup h ALA 424 CO -0.17 -1.03 -0.30 -0.44 0.00 0.00 0.00 179.25 177.31 1xup h ASP 425 N -0.48 0.03 -0.08 0.00 3.45 -1.72 0.54 116.42 118.15 1xup h ASP 425 Ca -0.05 -0.01 0.02 0.00 0.43 0.00 0.00 57.03 57.43 1xup h ASP 425 Cb 0.35 -0.01 -0.00 0.00 -0.56 0.00 0.00 39.33 39.11 1xup h ASP 425 CO 0.08 0.33 0.09 0.40 -1.57 0.00 0.00 179.24 178.56 1xup h ILE 426 N 0.03 0.52 0.00 0.35 1.08 -1.55 -0.70 117.51 117.24 1xup h ILE 426 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1xup h ILE 426 Cb 0.55 0.93 0.00 0.00 -3.07 0.00 0.00 36.82 35.23 1xup h ILE 426 CO 0.04 0.00 0.00 -0.11 -0.69 0.00 0.00 178.15 177.39 1xup n LEU 427 N -3.86 1.37 0.00 1.44 7.94 -0.96 -4.95 117.00 117.97 1xup n LEU 427 Ca -0.01 -1.37 0.00 0.00 -1.11 0.00 0.00 56.01 53.52 1xup n LEU 427 Cb 0.19 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.14 1xup n LEU 427 CO 0.28 0.34 0.00 0.47 -1.11 0.00 0.00 177.39 177.37 1xup n ASP 428 N -0.22 0.00 -4.61 1.96 8.00 0.18 -4.91 116.55 116.95 1xup n ASP 428 Ca 0.00 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.07 1xup n ASP 428 Cb 0.14 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.22 1xup n ASP 428 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1xup s ILE 429 N 0.00 4.06 -0.52 0.53 1.01 -1.01 -4.58 121.20 120.70 1xup s ILE 429 Ca 0.00 1.14 -0.27 0.00 0.00 0.00 0.00 60.65 61.53 1xup s ILE 429 Cb 0.00 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.20 1xup s ILE 429 CO 0.00 -0.66 1.96 1.51 0.00 0.00 0.00 174.94 177.75 1xup s ASP 430 N 3.18 5.24 -0.63 3.58 -4.77 -1.26 -4.35 116.67 117.66 1xup s ASP 430 Ca 0.57 0.72 -0.26 0.00 -3.30 0.00 0.00 52.55 50.28 1xup s ASP 430 Cb -0.14 -2.52 -0.07 0.00 -1.09 0.00 0.00 42.92 39.10 1xup s ASP 430 CO 0.28 -2.33 2.22 -0.69 0.70 0.00 0.00 175.17 175.35 1xup s VAL 431 N 9.22 3.14 0.27 2.11 1.01 -1.26 -4.77 120.40 130.11 1xup s VAL 431 Ca 0.76 0.01 -0.29 0.00 0.00 0.00 0.00 61.98 62.46 1xup s VAL 431 Cb -0.16 -3.36 -0.09 0.00 0.00 0.00 0.00 36.38 32.77 1xup s VAL 431 CO 0.25 -0.34 1.24 -1.10 0.00 0.00 0.00 175.10 175.14 1xup s GLN 432 N 7.96 4.46 0.00 2.72 -0.21 -0.75 -4.80 119.66 129.03 1xup s GLN 432 Ca 0.86 2.02 0.00 0.00 0.02 0.00 0.00 55.36 58.26 1xup s GLN 432 Cb -0.14 -3.16 0.00 0.00 1.00 0.00 0.00 33.01 30.72 1xup s GLN 432 CO 0.18 -0.08 0.00 0.54 -2.12 0.00 0.00 175.29 173.81 1xup n ARG 433 N 1.59 1.96 -3.32 2.91 1.74 -1.26 -0.15 116.66 120.12 1xup n ARG 433 Ca 0.02 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.01 1xup n ARG 433 Cb 0.43 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 31.87 1xup n ARG 433 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1xup n ALA 434 N -3.00 -0.84 -0.04 7.54 0.00 -1.26 -4.77 120.51 118.14 1xup n ALA 434 Ca 0.00 -1.14 -0.00 0.00 0.00 0.00 0.00 53.44 52.30 1xup n ALA 434 Cb 0.00 0.91 -0.00 0.00 0.00 0.00 0.00 19.45 20.36 1xup n ALA 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xup h ALA 435 N 1.96 0.00 -1.61 0.00 0.00 -1.87 -3.42 119.26 114.32 1xup h ALA 435 Ca -0.24 -0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.12 1xup h ALA 435 Cb 0.96 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 1xup h ALA 435 CO 0.31 0.00 1.07 1.21 0.00 0.00 0.00 179.25 181.85 1xup s ASN 436 N -4.85 6.21 0.06 0.00 3.84 -1.26 -4.91 114.94 114.03 1xup s ASN 436 Ca -0.00 0.30 -0.33 0.00 0.21 0.00 0.00 52.86 53.04 1xup s ASN 436 Cb 0.00 -2.55 -0.19 0.00 -0.55 0.00 0.00 41.25 37.96 1xup s ASN 436 CO 0.00 -1.64 1.53 -0.07 -2.79 0.00 0.00 177.10 174.13 1xup h LEU 437 N 12.78 -0.87 -5.17 3.21 3.38 -1.95 -3.28 115.31 123.41 1xup h LEU 437 Ca -0.26 0.02 -0.63 0.00 0.09 0.00 0.00 57.88 57.09 1xup h LEU 437 Cb 1.09 0.23 0.02 0.00 0.09 0.00 0.00 40.66 42.08 1xup h LEU 437 CO 1.17 -0.59 3.61 -0.62 0.09 0.00 0.00 178.44 182.10 1xup n GLU 438 N -5.51 3.38 0.32 1.13 1.02 -1.26 -0.97 120.64 118.75 1xup n GLU 438 Ca -0.14 -2.12 0.20 0.00 -0.02 0.00 0.00 57.16 55.07 1xup n GLU 438 Cb 0.42 -2.79 1.10 0.00 -0.02 0.00 0.00 31.44 30.14 1xup n GLU 438 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1xup h THR 439 N 3.17 0.22 -0.64 2.62 2.02 -1.61 -3.08 112.91 115.61 1xup h THR 439 Ca 0.79 0.00 0.13 0.00 0.77 0.00 0.00 66.41 68.10 1xup h THR 439 Cb 0.30 1.00 -0.12 0.00 -1.74 0.00 0.00 68.15 67.59 1xup h THR 439 CO 1.75 0.00 -0.13 0.74 0.37 0.00 0.00 175.52 178.25 1xup h THR 440 N 0.00 0.38 -0.26 3.16 2.02 -1.82 -1.03 112.91 115.36 1xup h THR 440 Ca 0.00 -0.01 -0.19 0.00 0.77 0.00 0.00 66.41 66.99 1xup h THR 440 Cb 0.01 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 66.78 1xup h THR 440 CO -0.00 0.00 -0.57 0.00 0.37 0.00 0.00 175.52 175.32 1xup h ALA 441 N 1.63 0.50 -0.43 6.16 0.00 -1.88 -3.26 119.26 121.98 1xup h ALA 441 Ca 0.31 -0.52 0.07 0.00 0.00 0.00 0.00 54.91 54.77 1xup h ALA 441 Cb 0.49 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 1xup h ALA 441 CO -0.64 0.68 0.06 1.25 0.00 0.00 0.00 179.25 180.60 1xup h LEU 442 N 0.61 -0.06 0.00 0.00 5.85 -1.35 -0.73 115.31 119.63 1xup h LEU 442 Ca 0.01 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1xup h LEU 442 Cb 1.17 0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.33 1xup h LEU 442 CO 0.12 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.84 1xup n GLY 443 N -1.27 -0.64 0.14 3.75 0.00 -0.53 -3.08 105.19 103.56 1xup n GLY 443 Ca 0.04 -0.02 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 1xup n GLY 443 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xup h ALA 444 N 2.22 0.16 0.00 4.61 0.00 -1.22 -3.25 119.26 121.78 1xup h ALA 444 Ca 0.00 -0.45 -0.11 0.00 0.00 0.00 0.00 54.91 54.34 1xup h ALA 444 Cb 0.09 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1xup h ALA 444 CO 0.00 0.25 -0.54 0.00 0.00 0.00 0.00 179.25 178.95 1xup h ALA 445 N 0.46 0.89 0.00 0.00 0.00 -1.67 -2.92 119.26 116.02 1xup h ALA 445 Ca -0.02 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1xup h ALA 445 Cb 1.01 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1xup h ALA 445 CO 0.08 0.68 0.00 1.88 0.00 0.00 0.00 179.25 181.89 1xup h TYR 446 N 0.00 0.00 0.32 0.00 -1.99 -1.65 -2.75 116.97 110.89 1xup h TYR 446 Ca -0.01 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 1xup h TYR 446 Cb 1.10 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.84 1xup h TYR 446 CO 0.00 0.00 -0.15 -0.07 -0.00 0.00 0.00 178.16 177.94 1xup h LEU 447 N 0.00 -0.36 -1.82 3.88 3.38 -1.55 -3.28 115.31 115.56 1xup h LEU 447 Ca 0.00 0.01 0.13 0.00 0.09 0.00 0.00 57.88 58.11 1xup h LEU 447 Cb 0.41 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 1xup h LEU 447 CO 0.00 0.04 0.38 0.00 0.09 0.00 0.00 178.44 178.95 1xup h ALA 448 N -1.21 2.26 -0.49 1.53 0.00 -1.62 -2.69 119.26 117.04 1xup h ALA 448 Ca -0.04 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1xup h ALA 448 Cb 0.32 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1xup h ALA 448 CO 0.07 -0.41 0.18 0.78 0.00 0.00 0.00 179.25 179.88 1xup h GLY 449 N 0.19 0.80 0.27 0.00 0.00 -1.58 -3.13 103.07 99.61 1xup h GLY 449 Ca 0.26 -0.45 0.12 0.00 0.00 0.00 0.00 47.33 47.26 1xup h GLY 449 CO -0.04 0.43 0.29 1.41 0.00 0.00 0.00 176.54 178.62 1xup h LEU 450 N 0.66 0.30 -0.90 3.11 3.38 -1.53 -0.10 115.31 120.23 1xup h LEU 450 Ca 0.16 0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.18 1xup h LEU 450 Cb 0.22 0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1xup h LEU 450 CO -0.01 0.14 0.24 0.00 0.09 0.00 0.00 178.44 178.91 1xup h ALA 451 N 1.49 1.12 -0.17 1.53 0.00 -1.67 -1.01 119.26 120.54 1xup h ALA 451 Ca 0.38 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1xup h ALA 451 Cb 0.52 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1xup h ALA 451 CO -0.36 0.62 0.00 0.28 0.00 0.00 0.00 179.25 179.79 1xup n VAL 452 N -4.28 0.69 0.00 0.00 0.31 -0.20 -4.95 118.33 109.91 1xup n VAL 452 Ca 0.06 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 64.01 1xup n VAL 452 Cb 0.20 -0.33 0.00 0.00 -0.91 0.00 0.00 33.84 32.80 1xup n VAL 452 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xup n GLY 453 N 0.30 1.04 5.48 2.92 0.00 -0.34 -4.84 105.19 109.74 1xup n GLY 453 Ca 0.08 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.49 1xup n GLY 453 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1xup n PHE 454 N 0.00 0.00 1.26 1.61 7.35 -1.25 -0.39 117.46 126.04 1xup n PHE 454 Ca 0.00 0.00 0.13 0.00 -0.76 0.00 0.00 57.45 56.82 1xup n PHE 454 Cb 0.00 0.00 0.40 0.00 0.35 0.00 0.00 39.48 40.23 1xup n PHE 454 CO 0.00 0.00 0.00 0.91 -0.76 0.00 0.00 176.76 176.91 1xup n TRP 455 N 0.00 0.00 0.00 -5.13 8.01 -1.26 -4.96 117.44 114.10 1xup n TRP 455 Ca 0.00 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.19 1xup n TRP 455 Cb 0.00 -0.12 0.00 0.00 -2.01 0.00 0.00 31.31 29.18 1xup n TRP 455 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 1xup n LYS 456 N -0.65 0.00 0.00 -0.99 4.76 0.47 -4.34 118.16 117.40 1xup n LYS 456 Ca 0.12 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 1xup n LYS 456 Cb 0.34 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.53 1xup n LYS 456 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1xup n ASP 457 N 2.06 0.00 0.00 4.39 2.03 -1.26 -4.93 116.55 118.84 1xup n ASP 457 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1xup n ASP 457 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1xup n ASP 457 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1xup n LEU 458 N 0.00 0.00 0.00 -2.67 4.77 -1.26 -4.98 117.00 112.86 1xup n LEU 458 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1xup n LEU 458 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1xup n LEU 458 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.39 176.53 1xup n ASP 459 N 0.00 0.00 0.05 -1.43 8.00 -1.26 -2.16 116.55 119.74 1xup n ASP 459 Ca 0.00 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.40 1xup n ASP 459 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 40.97 1xup n ASP 459 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1xup h GLU 460 N 0.00 0.09 -1.15 -1.24 5.08 -1.96 -3.39 114.58 112.00 1xup h GLU 460 Ca 0.00 -0.15 0.42 0.00 -1.00 0.00 0.00 59.36 58.64 1xup h GLU 460 Cb 0.00 0.05 -0.14 0.00 0.50 0.00 0.00 28.75 29.16 1xup h GLU 460 CO 0.00 0.94 0.71 1.28 -1.00 0.00 0.00 179.01 180.94 1xup n LEU 461 N -3.33 0.23 -0.48 1.33 7.99 -0.92 -0.51 117.00 121.32 1xup n LEU 461 Ca -0.08 1.35 0.00 0.00 -0.01 0.00 0.00 56.01 57.27 1xup n LEU 461 Cb 1.00 -0.66 0.00 0.00 -0.11 0.00 0.00 43.42 43.64 1xup n LEU 461 CO 0.48 -1.48 0.25 2.29 -1.51 0.00 0.00 177.39 177.42 1xup n LYS 462 N -4.71 0.96 0.00 3.23 2.85 -1.26 -4.31 118.16 114.91 1xup n LYS 462 Ca 0.36 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.62 1xup n LYS 462 Cb 1.36 -1.45 0.00 0.00 -0.65 0.00 0.00 35.03 34.28 1xup n LYS 462 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1xup n SER 463 N -0.00 0.07 0.00 -5.58 7.64 0.33 -2.06 113.62 114.02 1xup n SER 463 Ca 0.00 -0.91 0.00 0.00 1.01 0.00 0.00 58.87 58.97 1xup n SER 463 Cb 0.23 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 1xup n SER 463 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 1xup n MET 464 N -0.38 1.67 -0.75 1.43 2.81 -1.26 -4.78 117.12 115.87 1xup n MET 464 Ca 0.00 -1.11 -0.08 0.00 -1.81 0.00 0.00 57.70 54.70 1xup n MET 464 Cb 0.02 -0.93 -0.02 0.00 -0.71 0.00 0.00 33.22 31.59 1xup n MET 464 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1xup n ALA 465 N -0.32 4.81 -2.14 3.04 0.00 -0.87 -4.79 120.51 120.25 1xup n ALA 465 Ca 0.00 -0.92 -0.34 0.00 0.00 0.00 0.00 53.44 52.18 1xup n ALA 465 Cb 0.22 -1.36 -0.04 0.00 0.00 0.00 0.00 19.45 18.27 1xup n ALA 465 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1xup s GLU 466 N -0.49 2.73 0.00 0.00 2.12 -1.26 -4.77 118.70 117.03 1xup s GLU 466 Ca 0.22 -0.00 0.29 0.00 0.36 0.00 0.00 54.97 55.83 1xup s GLU 466 Cb 0.14 -4.75 1.71 0.00 0.26 0.00 0.00 34.13 31.49 1xup s GLU 466 CO -0.02 -2.91 2.08 -0.85 -0.54 0.00 0.00 175.26 173.03 1xup n GLU 467 N 9.04 0.97 0.00 4.30 0.28 -1.26 -4.54 120.64 129.42 1xup n GLU 467 Ca 0.28 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.28 1xup n GLU 467 Cb 0.50 -1.46 0.00 0.00 1.43 0.00 0.00 31.44 31.90 1xup n GLU 467 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1xup n GLY 468 N 0.90 2.20 3.22 -1.84 0.00 -1.26 -4.77 105.19 103.63 1xup n GLY 468 Ca 0.21 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 1xup n GLY 468 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1xup s GLN 469 N 0.00 0.61 -0.10 1.61 -2.07 -1.26 -5.12 119.66 113.34 1xup s GLN 469 Ca 0.00 -0.16 -0.29 0.00 -1.82 0.00 0.00 55.36 53.08 1xup s GLN 469 Cb 0.00 0.27 -0.04 0.00 -1.09 0.00 0.00 33.01 32.15 1xup s GLN 469 CO 0.00 -0.16 1.57 1.41 -1.32 0.00 0.00 175.29 176.79 1xup s MET 470 N -1.20 4.13 -0.39 9.60 -2.45 -1.26 -4.92 119.30 122.81 1xup s MET 470 Ca -0.12 2.00 -0.28 0.00 -1.25 0.00 0.00 55.69 56.04 1xup s MET 470 Cb -0.05 -3.95 -0.03 0.00 1.25 0.00 0.00 34.83 32.05 1xup s MET 470 CO 0.04 -0.89 1.91 -0.06 1.05 0.00 0.00 175.02 177.07 1xup s PHE 471 N 4.12 1.64 0.14 4.11 0.40 -1.26 -4.91 117.98 122.21 1xup s PHE 471 Ca 0.69 0.74 -0.31 0.00 -0.60 0.00 0.00 56.93 57.45 1xup s PHE 471 Cb -0.30 -4.05 -0.10 0.00 0.51 0.00 0.00 43.02 39.08 1xup s PHE 471 CO 0.26 -2.90 1.73 0.99 0.70 0.00 0.00 175.22 176.01 1xup s THR 472 N 7.99 2.51 0.37 0.64 2.01 -1.26 -4.71 115.64 123.19 1xup s THR 472 Ca 0.81 0.18 -0.28 0.00 0.31 0.00 0.00 61.69 62.71 1xup s THR 472 Cb -0.21 -3.11 -0.11 0.00 0.01 0.00 0.00 72.50 69.07 1xup s THR 472 CO 0.30 0.01 1.50 -2.65 -0.69 0.00 0.00 174.62 173.09 1xup n PRO 473 N 5.00 2.68 -4.33 4.92 -0.02 -1.26 -5.02 135.00 136.97 1xup n PRO 473 Ca 0.16 0.94 -0.24 0.00 -2.02 0.00 0.00 63.50 62.35 1xup n PRO 473 Cb 0.38 -2.68 -0.08 0.00 -0.02 0.00 0.00 33.50 31.10 1xup n PRO 473 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1xup s GLU 474 N -1.98 2.12 0.10 -0.52 2.02 -1.26 -5.05 118.70 114.12 1xup s GLU 474 Ca 0.54 -1.47 -0.22 0.00 0.02 0.00 0.00 54.97 53.84 1xup s GLU 474 Cb -0.48 -2.07 -0.13 0.00 0.10 0.00 0.00 34.13 31.55 1xup s GLU 474 CO 0.63 0.37 1.73 0.52 0.02 0.00 0.00 175.26 178.53 1xup h MET 475 N 2.13 0.09 -4.98 1.61 2.86 -2.01 -3.35 114.93 111.28 1xup h MET 475 Ca -0.44 -0.01 -0.55 0.00 -2.06 0.00 0.00 59.70 56.64 1xup h MET 475 Cb 1.25 -0.02 0.13 0.00 0.06 0.00 0.00 31.60 33.02 1xup h MET 475 CO 0.59 0.08 1.33 -2.30 1.06 0.00 0.00 176.91 177.67 1xup n PRO 476 N -5.03 0.10 0.00 -0.22 -0.02 -1.26 -3.05 135.00 125.51 1xup n PRO 476 Ca -0.06 -1.10 0.00 0.00 -2.02 0.00 0.00 63.50 60.32 1xup n PRO 476 Cb 0.04 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 30.90 1xup n PRO 476 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xup n ALA 477 N 9.65 0.06 0.07 3.55 0.00 -1.26 -4.94 120.51 127.65 1xup n ALA 477 Ca 0.47 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.93 1xup n ALA 477 Cb 0.42 0.00 0.13 0.00 0.00 0.00 0.00 19.45 20.00 1xup n ALA 477 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1xup n GLU 478 N -0.23 0.03 -3.71 0.00 -0.58 -1.17 -4.02 120.64 110.96 1xup n GLU 478 Ca 0.00 0.38 -0.37 0.00 -0.42 0.00 0.00 57.16 56.74 1xup n GLU 478 Cb 0.00 -1.92 -0.10 0.00 -0.57 0.00 0.00 31.44 28.85 1xup n GLU 478 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 1xup s GLU 479 N -2.82 2.36 0.00 3.49 2.12 -1.26 -4.69 118.70 117.90 1xup s GLU 479 Ca -0.01 -2.15 0.00 0.00 0.36 0.00 0.00 54.97 53.17 1xup s GLU 479 Cb 0.01 -3.72 0.00 0.00 0.26 0.00 0.00 34.13 30.68 1xup s GLU 479 CO 0.04 -1.14 0.00 2.89 -0.54 0.00 0.00 175.26 176.51 1xup n ARG 480 N 4.12 2.56 0.30 4.30 0.00 -1.26 -4.87 116.66 121.80 1xup n ARG 480 Ca 0.02 0.00 0.19 0.00 -0.00 0.00 0.00 57.85 58.06 1xup n ARG 480 Cb 0.40 -0.25 1.00 0.00 -0.00 0.00 0.00 32.46 33.61 1xup n ARG 480 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 1xup h ASP 481 N 0.00 0.00 0.20 2.89 5.19 -1.92 -2.56 116.42 120.22 1xup h ASP 481 Ca 0.00 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.42 1xup h ASP 481 Cb 0.00 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.47 1xup h ASP 481 CO 0.00 0.00 -0.43 0.78 -3.12 0.00 0.00 179.24 176.47 1xup h ASN 482 N 0.00 -1.25 0.94 6.45 4.21 -1.96 -1.86 115.58 122.11 1xup h ASN 482 Ca 0.02 0.13 -0.05 0.00 1.21 0.00 0.00 56.30 57.61 1xup h ASN 482 Cb 0.24 0.45 -0.01 0.00 -1.12 0.00 0.00 38.32 37.89 1xup h ASN 482 CO -0.00 -0.52 -0.25 -0.07 -1.29 0.00 0.00 177.43 175.30 1xup h LEU 483 N -0.72 0.00 -0.21 1.61 4.07 -1.86 -3.18 115.31 115.02 1xup h LEU 483 Ca 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.94 1xup h LEU 483 Cb 0.71 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.44 1xup h LEU 483 CO -0.20 0.25 0.03 0.22 -1.08 0.00 0.00 178.44 177.66 1xup h TYR 484 N 0.00 0.38 0.00 1.13 3.20 -1.26 0.11 116.97 120.53 1xup h TYR 484 Ca -0.00 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.81 1xup h TYR 484 Cb 0.79 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.95 1xup h TYR 484 CO 0.00 0.49 0.00 0.39 -1.64 0.00 0.00 178.16 177.40 1xup n GLU 485 N -4.73 0.21 -0.05 1.82 1.02 -0.75 -1.37 120.64 116.80 1xup n GLU 485 Ca -0.04 0.12 -0.22 0.00 -0.02 0.00 0.00 57.16 57.00 1xup n GLU 485 Cb 0.19 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 29.99 1xup n GLU 485 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xup n GLY 486 N 0.34 -0.65 0.37 0.62 0.00 -0.80 -4.15 105.19 100.91 1xup n GLY 486 Ca 0.08 -0.11 -0.02 0.00 0.00 0.00 0.00 46.02 45.97 1xup n GLY 486 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1xup h TRP 487 N -0.43 1.21 0.00 1.61 2.91 -0.42 -0.63 115.95 120.21 1xup h TRP 487 Ca -0.42 0.00 -0.03 0.00 1.13 0.00 0.00 58.89 59.57 1xup h TRP 487 Cb 1.71 -0.40 -0.01 0.00 -0.51 0.00 0.00 29.16 29.95 1xup h TRP 487 CO 0.07 0.80 -0.05 1.63 -1.03 0.00 0.00 178.44 179.86 1xup n LYS 488 N -4.36 1.04 0.00 2.65 4.76 -0.47 -3.32 118.16 118.47 1xup n LYS 488 Ca 0.10 -0.17 0.00 0.00 -2.87 0.00 0.00 58.31 55.37 1xup n LYS 488 Cb 0.06 -1.23 0.00 0.00 -1.84 0.00 0.00 35.03 32.01 1xup n LYS 488 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 1xup n GLN 489 N 1.76 0.00 0.02 1.97 7.27 -0.96 -4.93 117.38 122.50 1xup n GLN 489 Ca 0.07 0.00 0.02 0.00 0.07 0.00 0.00 57.00 57.16 1xup n GLN 489 Cb 0.51 0.00 0.08 0.00 2.41 0.00 0.00 30.24 33.24 1xup n GLN 489 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1xup n ALA 490 N -2.40 1.07 -2.80 1.69 0.00 -0.28 -4.51 120.51 113.27 1xup n ALA 490 Ca 0.00 0.01 -0.34 0.00 0.00 0.00 0.00 53.44 53.11 1xup n ALA 490 Cb 0.00 -1.05 -0.11 0.00 0.00 0.00 0.00 19.45 18.29 1xup n ALA 490 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1xup s VAL 491 N -3.05 4.22 0.00 0.00 0.11 -1.23 -4.91 120.40 115.53 1xup s VAL 491 Ca 0.00 -0.26 0.00 0.00 -2.93 0.00 0.00 61.98 58.79 1xup s VAL 491 Cb 0.01 -2.82 0.00 0.00 -1.53 0.00 0.00 36.38 32.04 1xup s VAL 491 CO 0.04 0.54 0.13 0.00 -3.33 0.00 0.00 175.10 172.49