#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xup s VAL 7 N 0.00 0.91 -1.24 -0.72 1.01 -1.11 -2.87 120.40 116.39 1xup s VAL 7 Ca 0.00 -0.44 -0.08 0.00 0.00 0.00 0.00 61.98 61.46 1xup s VAL 7 Cb 0.00 -1.10 0.20 0.00 0.00 0.00 0.00 36.38 35.48 1xup s VAL 7 CO 0.00 0.15 1.80 0.23 0.00 0.00 0.00 175.10 177.28 1xup n MET 8 N 4.95 3.81 -2.28 2.72 2.81 0.38 0.18 117.12 129.69 1xup n MET 8 Ca -0.11 -3.74 -0.35 0.00 -1.81 0.00 0.00 57.70 51.69 1xup n MET 8 Cb 0.48 -2.84 -0.04 0.00 -0.71 0.00 0.00 33.22 30.12 1xup n MET 8 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1xup s ALA 9 N -0.30 2.21 -0.10 3.04 0.00 -1.16 -2.55 121.76 122.91 1xup s ALA 9 Ca 0.38 -1.65 -0.05 0.00 0.00 0.00 0.00 51.96 50.64 1xup s ALA 9 Cb 0.09 -4.48 -0.04 0.00 0.00 0.00 0.00 23.12 18.69 1xup s ALA 9 CO 0.03 -4.11 0.09 0.42 0.00 0.00 0.00 175.76 172.18 1xup s ILE 10 N 7.69 5.04 0.42 0.00 -1.09 -1.24 -3.00 121.20 129.02 1xup s ILE 10 Ca 0.57 -0.01 0.07 0.00 -2.23 0.00 0.00 60.65 59.06 1xup s ILE 10 Cb -0.05 -3.19 -0.07 0.00 -1.58 0.00 0.00 42.46 37.57 1xup s ILE 10 CO 0.00 0.58 0.07 -0.62 -1.23 0.00 0.00 174.94 173.75 1xup s ASP 11 N -1.07 4.07 0.00 3.58 2.15 -0.91 -0.45 116.67 124.05 1xup s ASP 11 Ca 0.15 -1.29 0.00 0.00 0.43 0.00 0.00 52.55 51.84 1xup s ASP 11 Cb -0.12 -0.37 0.00 0.00 -0.30 0.00 0.00 42.92 42.14 1xup s ASP 11 CO 0.05 -0.51 0.00 0.00 -0.17 0.00 0.00 175.17 174.54 1xup n GLN 12 N -1.08 3.35 0.00 4.34 1.13 -0.74 -3.70 117.38 120.69 1xup n GLN 12 Ca -0.04 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.02 1xup n GLN 12 Cb 0.66 -0.28 0.00 0.00 0.11 0.00 0.00 30.24 30.73 1xup n GLN 12 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1xup n GLY 13 N 0.00 2.10 0.02 1.08 0.00 -1.25 -1.91 105.19 105.24 1xup n GLY 13 Ca 0.00 0.39 -0.02 0.00 0.00 0.00 0.00 46.02 46.39 1xup n GLY 13 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xup n THR 14 N 0.00 0.31 0.00 2.61 -1.04 -1.26 -3.99 114.28 110.92 1xup n THR 14 Ca 0.00 -0.19 0.00 0.00 -2.04 0.00 0.00 64.05 61.82 1xup n THR 14 Cb 0.00 -0.86 0.00 0.00 -1.82 0.00 0.00 70.33 67.65 1xup n THR 14 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1xup n THR 15 N -2.21 0.00 -1.54 12.58 -1.04 -0.80 -4.95 114.28 116.31 1xup n THR 15 Ca -0.08 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.79 1xup n THR 15 Cb 0.64 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 69.05 1xup n THR 15 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1xup n SER 16 N -0.32 1.12 -4.61 8.00 7.64 -1.16 -4.44 113.62 119.85 1xup n SER 16 Ca 0.00 -1.39 -0.43 0.00 1.01 0.00 0.00 58.87 58.06 1xup n SER 16 Cb 0.00 -1.45 -0.02 0.00 -1.01 0.00 0.00 64.21 61.73 1xup n SER 16 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1xup s SER 17 N 8.60 6.31 0.24 6.43 0.01 -0.22 -3.90 113.70 131.17 1xup s SER 17 Ca 0.98 1.00 0.03 0.00 1.31 0.00 0.00 55.95 59.27 1xup s SER 17 Cb -0.25 -2.54 -0.01 0.00 0.21 0.00 0.00 66.02 63.43 1xup s SER 17 CO 0.18 -1.42 0.11 0.54 0.41 0.00 0.00 173.24 173.05 1xup n ARG 18 N 8.02 0.62 -0.29 12.44 1.74 -1.24 -1.78 116.66 136.16 1xup n ARG 18 Ca 0.17 -2.13 0.03 0.00 -0.77 0.00 0.00 57.85 55.15 1xup n ARG 18 Cb 0.47 1.28 -0.02 0.00 -1.02 0.00 0.00 32.46 33.18 1xup n ARG 18 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1xup n ALA 19 N -1.75 -0.75 -3.00 7.54 0.00 -1.17 -2.15 120.51 119.23 1xup n ALA 19 Ca -0.09 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1xup n ALA 19 Cb 0.38 -0.38 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1xup n ALA 19 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1xup n ILE 20 N -2.32 0.00 -2.11 0.00 -6.64 -1.16 -4.54 119.36 102.59 1xup n ILE 20 Ca -0.02 0.00 -0.29 0.00 -1.77 0.00 0.00 62.75 60.68 1xup n ILE 20 Cb 0.13 0.00 -0.05 0.00 -1.44 0.00 0.00 39.64 38.28 1xup n ILE 20 CO 0.00 0.00 0.00 -0.51 -1.77 0.00 0.00 176.55 174.27 1xup s ILE 21 N -2.16 3.53 -0.20 7.28 2.07 -1.26 -2.97 121.20 127.48 1xup s ILE 21 Ca 0.00 -0.55 -0.28 0.00 -1.41 0.00 0.00 60.65 58.41 1xup s ILE 21 Cb 0.00 -4.24 -0.05 0.00 0.13 0.00 0.00 42.46 38.30 1xup s ILE 21 CO 0.00 -1.07 2.04 -0.36 -1.91 0.00 0.00 174.94 173.64 1xup s PHE 22 N 9.65 1.40 -1.02 3.50 2.99 0.13 -4.41 117.98 130.21 1xup s PHE 22 Ca 0.67 0.41 -0.24 0.00 0.00 0.00 0.00 56.93 57.77 1xup s PHE 22 Cb -0.05 -4.02 -0.15 0.00 0.00 0.00 0.00 43.02 38.80 1xup s PHE 22 CO 0.01 -3.97 1.95 -0.25 -0.00 0.00 0.00 175.22 172.96 1xup n ASP 23 N 10.48 2.47 0.00 1.36 10.43 -1.16 -2.74 116.55 137.39 1xup n ASP 23 Ca 0.26 -2.64 0.00 0.00 2.57 0.00 0.00 54.79 54.98 1xup n ASP 23 Cb 0.45 -1.56 0.00 0.00 1.84 0.00 0.00 41.12 41.85 1xup n ASP 23 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1xup n ARG 24 N 8.04 0.00 -0.24 -1.24 1.74 -1.26 -3.92 116.66 119.78 1xup n ARG 24 Ca 0.45 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.53 1xup n ARG 24 Cb 0.45 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.89 1xup n ARG 24 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1xup n ASN 25 N 0.03 2.78 -3.14 0.55 4.13 -1.26 -4.66 115.26 113.70 1xup n ASN 25 Ca 0.00 -1.69 -0.10 0.00 1.68 0.00 0.00 54.58 54.47 1xup n ASN 25 Cb 0.00 -0.58 0.05 0.00 -1.54 0.00 0.00 39.78 37.71 1xup n ASN 25 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1xup n GLY 26 N 1.59 -1.13 3.33 7.41 0.00 -1.25 -5.04 105.19 110.10 1xup n GLY 26 Ca 0.00 0.53 -0.20 0.00 0.00 0.00 0.00 46.02 46.35 1xup n GLY 26 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xup s LYS 27 N -3.96 1.71 0.17 1.61 2.47 -1.26 -5.01 119.74 115.47 1xup s LYS 27 Ca 0.32 -1.99 0.04 0.00 -1.56 0.00 0.00 55.97 52.78 1xup s LYS 27 Cb -0.04 0.06 -0.05 0.00 -1.46 0.00 0.00 37.83 36.34 1xup s LYS 27 CO 0.72 -0.56 -0.08 0.15 0.16 0.00 0.00 175.35 175.74 1xup s LYS 28 N -3.64 1.14 -0.30 4.03 1.02 -1.26 -2.96 119.74 117.77 1xup s LYS 28 Ca 0.36 -1.51 0.10 0.00 0.02 0.00 0.00 55.97 54.94 1xup s LYS 28 Cb 0.03 -0.66 0.34 0.00 -0.52 0.00 0.00 37.83 37.03 1xup s LYS 28 CO 0.22 0.04 1.37 -0.89 -0.92 0.00 0.00 175.35 175.17 1xup n ILE 29 N -0.26 0.00 -3.62 2.17 2.08 -1.26 -4.81 119.36 113.66 1xup n ILE 29 Ca -0.09 -0.91 -0.05 0.00 0.56 0.00 0.00 62.75 62.26 1xup n ILE 29 Cb 0.61 0.92 -0.02 0.00 -0.75 0.00 0.00 39.64 40.41 1xup n ILE 29 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 1xup s GLY 30 N -0.95 -0.36 -0.41 7.39 0.00 -1.26 -2.75 107.32 108.98 1xup s GLY 30 Ca 0.09 0.79 0.11 0.00 0.00 0.00 0.00 44.72 45.71 1xup s GLY 30 CO -0.10 0.23 0.89 -1.26 0.00 0.00 0.00 173.10 172.85 1xup n SER 31 N -0.33 2.33 -4.57 1.64 2.88 -1.26 -4.92 113.62 109.39 1xup n SER 31 Ca -0.06 -3.19 -0.43 0.00 -1.33 0.00 0.00 58.87 53.87 1xup n SER 31 Cb 0.61 -0.56 -0.03 0.00 -0.75 0.00 0.00 64.21 63.48 1xup n SER 31 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1xup s SER 32 N -2.99 6.46 -0.29 -3.46 0.01 -1.26 -4.94 113.70 107.24 1xup s SER 32 Ca 0.40 0.06 0.02 0.00 1.31 0.00 0.00 55.95 57.74 1xup s SER 32 Cb 0.37 -2.51 0.16 0.00 0.21 0.00 0.00 66.02 64.25 1xup s SER 32 CO -0.08 -1.31 0.41 -1.10 0.41 0.00 0.00 173.24 171.56 1xup s GLN 33 N 4.44 0.42 -0.10 12.44 -0.21 -1.23 -3.05 119.66 132.37 1xup s GLN 33 Ca 0.40 0.10 -0.03 0.00 0.02 0.00 0.00 55.36 55.85 1xup s GLN 33 Cb -0.09 -0.32 0.04 0.00 1.00 0.00 0.00 33.01 33.64 1xup s GLN 33 CO 0.25 -1.04 0.06 0.15 -2.12 0.00 0.00 175.29 172.59 1xup s LYS 34 N 2.51 0.16 -0.45 2.91 1.02 -0.73 -5.01 119.74 120.15 1xup s LYS 34 Ca 0.10 0.12 -0.13 0.00 0.02 0.00 0.00 55.97 56.08 1xup s LYS 34 Cb -0.12 -1.12 0.08 0.00 -0.52 0.00 0.00 37.83 36.14 1xup s LYS 34 CO -0.30 -0.45 0.34 -1.21 -0.92 0.00 0.00 175.35 172.81 1xup s GLU 35 N 2.10 2.82 0.49 1.68 2.02 -1.26 -1.06 118.70 125.48 1xup s GLU 35 Ca 0.04 -1.40 -0.22 0.00 0.02 0.00 0.00 54.97 53.41 1xup s GLU 35 Cb -0.14 -3.98 -0.07 0.00 0.10 0.00 0.00 34.13 30.05 1xup s GLU 35 CO -0.06 -1.00 1.18 -0.06 0.02 0.00 0.00 175.26 175.35 1xup s PHE 36 N 1.55 2.75 -0.71 1.61 0.40 -1.26 -4.87 117.98 117.45 1xup s PHE 36 Ca 0.04 1.52 -0.26 0.00 -0.60 0.00 0.00 56.93 57.62 1xup s PHE 36 Cb -0.24 -3.41 -0.14 0.00 0.51 0.00 0.00 43.02 39.74 1xup s PHE 36 CO 0.05 -1.70 2.48 -2.30 0.70 0.00 0.00 175.22 174.44 1xup n PRO 37 N -0.74 0.61 -2.08 0.24 -0.02 -1.26 -4.93 135.00 126.82 1xup n PRO 37 Ca 0.09 -0.13 -0.39 0.00 -2.02 0.00 0.00 63.50 61.05 1xup n PRO 37 Cb 0.48 -2.78 -0.00 0.00 -0.02 0.00 0.00 33.50 31.18 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 8.48 3.81 0.08 -0.52 -1.52 -1.26 -5.03 119.66 123.70 1xup s GLN 38 Ca 1.10 2.05 0.06 0.00 -1.95 0.00 0.00 55.36 56.63 1xup s GLN 38 Cb -0.51 -2.60 -0.04 0.00 -0.22 0.00 0.00 33.01 29.64 1xup s GLN 38 CO 0.32 -0.59 -0.09 0.71 -0.25 0.00 0.00 175.29 175.39 1xup s TYR 39 N -1.34 2.79 -0.40 0.91 1.51 -1.26 -5.10 117.35 114.45 1xup s TYR 39 Ca 0.60 -0.13 0.01 0.00 -1.01 0.00 0.00 57.07 56.55 1xup s TYR 39 Cb -0.36 -1.48 0.14 0.00 -0.11 0.00 0.00 41.96 40.15 1xup s TYR 39 CO 0.45 0.41 0.22 0.12 -1.11 0.00 0.00 175.55 175.64 1xup s PHE 40 N -1.17 1.50 0.00 2.71 2.19 -1.26 -4.52 117.98 117.43 1xup s PHE 40 Ca 0.21 -2.11 0.00 0.00 0.33 0.00 0.00 56.93 55.36 1xup s PHE 40 Cb -0.11 -1.52 0.00 0.00 -1.31 0.00 0.00 43.02 40.08 1xup s PHE 40 CO 0.13 -0.80 0.00 -2.30 1.83 0.00 0.00 175.22 174.07 1xup n PRO 41 N 3.76 0.81 -1.83 10.12 -0.02 -1.26 -4.92 135.00 141.66 1xup n PRO 41 Ca 0.10 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.16 1xup n PRO 41 Cb 0.36 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.82 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 -0.24 4.16 0.00 -0.52 -2.85 -1.26 -4.25 119.74 114.77 1xup s LYS 42 Ca 0.00 2.51 0.00 0.00 -1.00 0.00 0.00 55.97 57.48 1xup s LYS 42 Cb 0.00 -3.05 0.00 0.00 -2.06 0.00 0.00 37.83 32.72 1xup s LYS 42 CO 0.00 -0.60 0.00 0.43 0.10 0.00 0.00 175.35 175.28 1xup n SER 43 N 2.48 0.00 -0.62 0.03 7.64 -1.26 -1.60 113.62 120.29 1xup n SER 43 Ca 0.09 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.94 1xup n SER 43 Cb 0.38 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.55 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 0.39 2.24 0.23 0.00 -1.26 -5.01 105.19 101.78 1xup n GLY 44 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 0.00 1.81 -2.55 1.61 7.02 -0.62 -4.41 117.44 120.29 1xup n TRP 45 Ca -0.11 -2.67 -0.40 0.00 -1.02 0.00 0.00 57.50 53.30 1xup n TRP 45 Cb 0.46 -2.23 -0.05 0.00 -2.42 0.00 0.00 31.31 27.07 1xup n TRP 45 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 1xup s VAL 46 N 1.68 3.69 -0.30 -0.99 1.01 -1.26 -4.20 120.40 120.03 1xup s VAL 46 Ca 0.68 1.67 -0.12 0.00 0.00 0.00 0.00 61.98 64.21 1xup s VAL 46 Cb 0.22 -4.06 0.17 0.00 0.00 0.00 0.00 36.38 32.71 1xup s VAL 46 CO -0.05 0.38 0.96 -1.83 0.00 0.00 0.00 175.10 174.56 1xup s GLU 47 N -1.23 0.29 -0.24 2.72 -1.05 -1.26 -3.89 118.70 114.03 1xup s GLU 47 Ca 0.44 0.60 -0.18 0.00 -0.15 0.00 0.00 54.97 55.68 1xup s GLU 47 Cb -0.30 0.35 -0.03 0.00 -0.44 0.00 0.00 34.13 33.71 1xup s GLU 47 CO 0.38 -0.22 0.50 -3.38 0.95 0.00 0.00 175.26 173.49 1xup s HIS 48 N 2.73 3.29 0.52 4.83 -3.43 -1.08 -4.69 115.29 117.46 1xup s HIS 48 Ca 0.02 0.65 -0.20 0.00 -0.80 0.00 0.00 55.06 54.73 1xup s HIS 48 Cb -0.09 -2.69 -0.10 0.00 -1.43 0.00 0.00 32.58 28.27 1xup s HIS 48 CO -0.15 -0.23 0.55 0.09 -2.00 0.00 0.00 174.74 173.00 1xup n ASN 49 N 5.31 -0.89 0.21 7.38 3.02 -1.26 -3.72 115.26 125.31 1xup n ASN 49 Ca -0.05 0.80 0.18 0.00 -0.03 0.00 0.00 54.58 55.49 1xup n ASN 49 Cb 0.50 -1.16 0.82 0.00 -0.61 0.00 0.00 39.78 39.33 1xup n ASN 49 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xup h ALA 50 N 0.49 1.75 -0.17 5.41 0.00 -1.80 -0.71 119.26 124.22 1xup h ALA 50 Ca -0.44 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.49 1xup h ALA 50 Cb 1.40 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.17 1xup h ALA 50 CO 0.49 -0.42 -0.02 -0.91 0.00 0.00 0.00 179.25 178.39 1xup h ASN 51 N 0.00 -0.11 -0.29 0.00 4.21 -1.89 -1.06 115.58 116.44 1xup h ASN 51 Ca 0.10 0.04 -0.04 0.00 1.21 0.00 0.00 56.30 57.61 1xup h ASN 51 Cb 0.72 0.08 -0.02 0.00 -1.12 0.00 0.00 38.32 37.99 1xup h ASN 51 CO -0.00 -0.03 0.07 -0.08 -1.29 0.00 0.00 177.43 176.10 1xup h GLU 52 N 0.03 0.56 0.67 0.81 4.81 -1.45 -1.58 114.58 118.44 1xup h GLU 52 Ca 0.08 -0.10 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 1xup h GLU 52 Cb 0.11 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.41 1xup h GLU 52 CO -0.15 0.53 -0.32 0.82 -0.73 0.00 0.00 179.01 179.16 1xup h ILE 53 N 0.55 0.09 -0.42 2.32 2.04 -1.34 -2.76 117.51 117.99 1xup h ILE 53 Ca 0.13 -0.32 0.01 0.00 1.00 0.00 0.00 64.86 65.68 1xup h ILE 53 Cb 0.24 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 1xup h ILE 53 CO -0.00 0.01 0.26 -0.25 0.00 0.00 0.00 178.15 178.17 1xup h TRP 54 N -1.19 0.49 -0.46 1.37 -0.00 -1.19 -0.75 115.95 114.22 1xup h TRP 54 Ca -0.09 0.01 0.04 0.00 -0.00 0.00 0.00 58.89 58.85 1xup h TRP 54 Cb 0.71 -0.16 -0.03 0.00 -0.00 0.00 0.00 29.16 29.69 1xup h TRP 54 CO 0.00 0.30 0.31 -0.97 -0.00 0.00 0.00 178.44 178.08 1xup h ASN 55 N 0.53 0.41 0.24 2.65 -1.24 -1.38 -1.60 115.58 115.20 1xup h ASN 55 Ca 0.16 -0.00 -0.34 0.00 0.71 0.00 0.00 56.30 56.83 1xup h ASN 55 Cb -0.02 -0.09 0.03 0.00 0.73 0.00 0.00 38.32 38.97 1xup h ASN 55 CO -0.06 0.28 -1.54 0.28 -1.29 0.00 0.00 177.43 175.11 1xup h SER 56 N 0.48 0.80 -0.73 1.15 0.02 -1.21 -3.30 113.55 110.76 1xup h SER 56 Ca 0.19 -0.93 0.04 0.00 -0.84 0.00 0.00 61.79 60.26 1xup h SER 56 Cb 0.16 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 62.39 1xup h SER 56 CO -0.05 1.73 0.44 0.58 -1.14 0.00 0.00 176.83 178.40 1xup h VAL 57 N 0.13 1.05 -0.51 2.27 2.07 -0.66 -1.88 116.25 118.71 1xup h VAL 57 Ca -0.28 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 1xup h VAL 57 Cb 2.15 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 32.03 1xup h VAL 57 CO 0.25 0.15 0.25 -0.61 0.02 0.00 0.00 177.57 177.64 1xup h GLN 58 N 0.84 0.71 -0.32 1.57 5.75 -1.43 -0.43 115.11 121.81 1xup h GLN 58 Ca 0.31 -0.08 -0.03 0.00 -0.15 0.00 0.00 58.65 58.69 1xup h GLN 58 Cb 0.09 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.49 1xup h GLN 58 CO -0.14 0.55 0.05 0.77 -2.65 0.00 0.00 178.83 177.41 1xup h SER 59 N 0.72 0.44 0.08 -0.69 0.02 -1.42 -2.98 113.55 109.72 1xup h SER 59 Ca 0.18 -0.06 -0.27 0.00 -0.84 0.00 0.00 61.79 60.79 1xup h SER 59 Cb 0.07 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1xup h SER 59 CO -0.03 0.47 -1.46 1.62 -1.14 0.00 0.00 176.83 176.30 1xup h VAL 60 N 0.47 0.92 0.00 2.27 3.04 -1.26 -2.96 116.25 118.74 1xup h VAL 60 Ca 0.11 -2.32 0.00 0.00 -1.01 0.00 0.00 66.70 63.48 1xup h VAL 60 Cb 0.23 2.54 0.00 0.00 -2.01 0.00 0.00 31.29 32.04 1xup h VAL 60 CO 0.00 0.63 0.00 -0.38 -1.01 0.00 0.00 177.57 176.81 1xup n ILE 61 N -4.00 0.00 0.20 3.17 2.08 -0.21 -0.58 119.36 120.02 1xup n ILE 61 Ca -0.28 1.22 0.08 0.00 0.56 0.00 0.00 62.75 64.33 1xup n ILE 61 Cb 0.85 -2.07 0.37 0.00 -0.75 0.00 0.00 39.64 38.04 1xup n ILE 61 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1xup h ALA 62 N -1.86 0.97 0.00 -1.39 0.00 -1.78 -3.12 119.26 112.08 1xup h ALA 62 Ca 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 1xup h ALA 62 Cb 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1xup h ALA 62 CO 0.00 0.38 -0.14 0.78 0.00 0.00 0.00 179.25 180.27 1xup h GLY 63 N 2.25 0.00 1.44 0.00 0.00 -1.50 -3.28 103.07 101.98 1xup h GLY 63 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1xup h GLY 63 CO 0.04 0.00 0.16 0.00 0.00 0.00 0.00 176.54 176.74 1xup n ALA 64 N -2.16 0.73 -2.56 3.60 0.00 0.25 -4.15 120.51 116.21 1xup n ALA 64 Ca 0.01 0.04 -0.42 0.00 0.00 0.00 0.00 53.44 53.07 1xup n ALA 64 Cb 0.43 -0.79 -0.00 0.00 0.00 0.00 0.00 19.45 19.08 1xup n ALA 64 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1xup s PHE 65 N -2.92 2.74 0.00 0.00 0.08 -1.24 -4.30 117.98 112.34 1xup s PHE 65 Ca -0.01 -1.53 0.00 0.00 0.12 0.00 0.00 56.93 55.52 1xup s PHE 65 Cb 0.01 -4.73 0.00 0.00 -0.57 0.00 0.00 43.02 37.73 1xup s PHE 65 CO 0.04 -1.80 0.00 -0.89 -0.10 0.00 0.00 175.22 172.48 1xup n ILE 66 N 6.47 0.00 -0.10 0.64 2.08 -1.26 -4.81 119.36 122.37 1xup n ILE 66 Ca 0.48 0.36 -0.14 0.00 0.56 0.00 0.00 62.75 64.01 1xup n ILE 66 Cb 0.46 -1.26 -0.05 0.00 -0.75 0.00 0.00 39.64 38.04 1xup n ILE 66 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1xup n GLU 67 N -2.00 0.54 -2.01 0.38 1.02 -1.11 -4.70 120.64 112.76 1xup n GLU 67 Ca 0.00 0.28 -0.42 0.00 -0.02 0.00 0.00 57.16 57.00 1xup n GLU 67 Cb 0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 29.93 1xup n GLU 67 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1xup n SER 68 N -4.43 4.32 -3.32 1.62 7.64 -1.26 -4.85 113.62 113.33 1xup n SER 68 Ca -0.24 -2.92 -0.38 0.00 1.01 0.00 0.00 58.87 56.35 1xup n SER 68 Cb 0.58 -1.63 -0.01 0.00 -1.01 0.00 0.00 64.21 62.14 1xup n SER 68 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xup n GLY 69 N 3.96 5.07 3.73 0.23 0.00 -1.26 -4.87 105.19 112.05 1xup n GLY 69 Ca 0.48 -2.02 -0.41 0.00 0.00 0.00 0.00 46.02 44.07 1xup n GLY 69 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xup s ILE 70 N -1.30 4.37 1.38 -0.61 1.01 -1.26 -5.04 121.20 119.75 1xup s ILE 70 Ca 0.55 1.92 -0.20 0.00 0.00 0.00 0.00 60.65 62.92 1xup s ILE 70 Cb 0.22 -4.23 0.35 0.00 0.01 0.00 0.00 42.46 38.81 1xup s ILE 70 CO -0.11 0.27 0.92 0.54 0.00 0.00 0.00 174.94 176.55 1xup n ARG 71 N 2.95 -4.03 0.17 2.79 5.12 -1.26 -4.58 116.66 117.83 1xup n ARG 71 Ca 0.03 -1.18 0.07 0.00 -1.93 0.00 0.00 57.85 54.84 1xup n ARG 71 Cb 0.49 -2.01 0.36 0.00 -1.16 0.00 0.00 32.46 30.13 1xup n ARG 71 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 1xup h PRO 72 N -3.31 0.00 0.00 5.56 0.11 -2.02 -2.66 132.00 129.68 1xup h PRO 72 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1xup h PRO 72 Cb 1.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.45 1xup h PRO 72 CO 0.34 0.00 0.00 -1.91 -0.21 0.00 0.00 178.00 176.22 1xup n GLU 73 N -2.08 0.18 0.00 1.05 2.13 -1.26 -3.87 120.64 116.80 1xup n GLU 73 Ca -0.01 0.08 0.00 0.00 0.66 0.00 0.00 57.16 57.89 1xup n GLU 73 Cb 0.35 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.56 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 -1.10 0.41 -1.00 4.31 0.00 -1.00 -5.05 120.51 117.07 1xup n ALA 74 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1xup n ALA 74 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.49 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 0.00 0.00 -1.85 0.00 -5.35 -1.23 0.54 119.36 111.46 1xup n ILE 75 Ca 0.00 0.79 0.00 0.00 -0.27 0.00 0.00 62.75 63.27 1xup n ILE 75 Cb 0.27 -1.59 0.00 0.00 -1.74 0.00 0.00 39.64 36.57 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 -0.56 0.00 -2.73 -1.28 0.00 -1.26 0.51 120.51 115.18 1xup n ALA 76 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 1xup n ALA 76 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 1xup n ALA 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xup n GLY 77 N 0.00 -0.50 3.72 0.00 0.00 -1.14 -2.89 105.19 104.39 1xup n GLY 77 Ca 0.00 0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1xup n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xup s ILE 78 N -2.69 4.34 -0.39 -0.61 1.01 -1.26 -0.47 121.20 121.13 1xup s ILE 78 Ca 0.13 1.81 0.04 0.00 0.00 0.00 0.00 60.65 62.62 1xup s ILE 78 Cb -0.07 -4.16 0.16 0.00 0.01 0.00 0.00 42.46 38.41 1xup s ILE 78 CO 0.16 0.21 0.43 -0.83 0.00 0.00 0.00 174.94 174.90 1xup s GLY 79 N 0.52 -0.11 -0.00 6.18 0.00 -1.06 -1.13 107.32 111.72 1xup s GLY 79 Ca 0.52 -0.99 -0.30 0.00 0.00 0.00 0.00 44.72 43.95 1xup s GLY 79 CO 0.30 2.83 2.01 -0.42 0.00 0.00 0.00 173.10 177.82 1xup s ILE 80 N 1.27 3.02 -0.87 0.90 1.01 -0.16 -3.26 121.20 123.11 1xup s ILE 80 Ca 0.20 0.02 0.01 0.00 0.00 0.00 0.00 60.65 60.88 1xup s ILE 80 Cb -0.11 -3.02 0.32 0.00 0.01 0.00 0.00 42.46 39.66 1xup s ILE 80 CO -0.04 -0.00 1.42 0.41 0.00 0.00 0.00 174.94 176.72 1xup n THR 81 N 5.89 4.76 -1.09 2.92 -1.04 0.41 -1.31 114.28 124.82 1xup n THR 81 Ca 0.21 -5.79 -0.30 0.00 -2.04 0.00 0.00 64.05 56.13 1xup n THR 81 Cb 0.42 -1.64 0.23 0.00 -1.82 0.00 0.00 70.33 67.52 1xup n THR 81 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1xup s ASN 82 N -2.15 1.05 0.70 8.00 4.22 -0.47 -1.79 114.94 124.50 1xup s ASN 82 Ca 0.41 0.68 0.00 0.00 -2.14 0.00 0.00 52.86 51.81 1xup s ASN 82 Cb 0.19 -0.96 0.00 0.00 1.28 0.00 0.00 41.25 41.76 1xup s ASN 82 CO -0.08 -4.05 0.00 0.00 -2.04 0.00 0.00 177.10 170.93 1xup n GLN 83 N -4.72 -0.02 -3.57 3.55 10.64 -1.26 0.07 117.38 122.08 1xup n GLN 83 Ca 0.12 0.00 -0.15 0.00 -1.83 0.00 0.00 57.00 55.14 1xup n GLN 83 Cb 0.59 0.00 -0.06 0.00 -0.86 0.00 0.00 30.24 29.91 1xup n GLN 83 CO 0.00 0.00 0.00 -0.98 -1.83 0.00 0.00 177.06 174.25 1xup s ARG 84 N -2.09 0.89 0.00 2.61 1.70 -1.26 -4.31 118.95 116.49 1xup s ARG 84 Ca 0.00 0.55 0.00 0.00 -0.47 0.00 0.00 55.73 55.81 1xup s ARG 84 Cb 0.00 0.43 0.00 0.00 -0.57 0.00 0.00 34.95 34.81 1xup s ARG 84 CO 0.00 -0.21 0.00 0.39 -1.08 0.00 0.00 175.30 174.40 1xup n GLU 85 N 1.65 0.00 -2.37 3.89 1.02 -1.26 -4.76 120.64 118.80 1xup n GLU 85 Ca -0.16 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.55 1xup n GLU 85 Cb 0.56 -0.37 -0.02 0.00 -0.02 0.00 0.00 31.44 31.59 1xup n GLU 85 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 1xup s THR 86 N -2.35 4.18 -0.45 2.62 -1.32 -1.26 -4.25 115.64 112.82 1xup s THR 86 Ca 0.00 1.44 -0.13 0.00 -1.21 0.00 0.00 61.69 61.79 1xup s THR 86 Cb 0.00 -3.93 0.07 0.00 -1.51 0.00 0.00 72.50 67.13 1xup s THR 86 CO 0.00 -0.11 0.34 -0.89 -2.21 0.00 0.00 174.62 171.74 1xup s THR 87 N 3.41 4.87 0.37 5.08 2.01 -1.26 -1.89 115.64 128.22 1xup s THR 87 Ca 0.57 -1.14 0.02 0.00 0.31 0.00 0.00 61.69 61.45 1xup s THR 87 Cb -0.24 -3.91 -0.02 0.00 0.01 0.00 0.00 72.50 68.35 1xup s THR 87 CO 0.17 -0.52 0.55 -0.69 -0.69 0.00 0.00 174.62 173.44 1xup s VAL 88 N 1.57 4.62 0.14 3.82 1.01 0.24 -4.02 120.40 127.78 1xup s VAL 88 Ca 0.04 -0.62 -0.00 0.00 0.00 0.00 0.00 61.98 61.40 1xup s VAL 88 Cb -0.23 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 1xup s VAL 88 CO 0.05 -0.40 0.04 0.54 0.00 0.00 0.00 175.10 175.33 1xup s VAL 89 N -2.33 0.28 -0.09 2.92 0.11 -1.26 -1.80 120.40 118.23 1xup s VAL 89 Ca 0.43 -1.93 -0.29 0.00 -2.93 0.00 0.00 61.98 57.25 1xup s VAL 89 Cb -0.10 -2.05 0.07 0.00 -1.53 0.00 0.00 36.38 32.77 1xup s VAL 89 CO 0.35 -0.48 0.67 -1.66 -3.33 0.00 0.00 175.10 170.65 1xup s TRP 90 N -3.92 -0.67 -0.39 1.54 -2.14 -1.21 -4.86 118.94 107.29 1xup s TRP 90 Ca 0.24 1.24 -0.19 0.00 2.66 0.00 0.00 56.10 60.04 1xup s TRP 90 Cb 0.07 0.38 0.01 0.00 -3.10 0.00 0.00 33.47 30.83 1xup s TRP 90 CO 0.02 -0.56 0.55 0.34 -2.66 0.00 0.00 176.95 174.64 1xup s ASP 91 N -0.93 6.30 0.10 -2.66 2.15 -1.26 -2.13 116.67 118.24 1xup s ASP 91 Ca -0.09 -0.23 -0.13 0.00 0.43 0.00 0.00 52.55 52.53 1xup s ASP 91 Cb -0.01 -2.28 -0.12 0.00 -0.30 0.00 0.00 42.92 40.21 1xup s ASP 91 CO 0.08 -0.60 1.35 0.50 -0.17 0.00 0.00 175.17 176.33 1xup h LYS 92 N 8.64 0.78 0.66 4.34 3.64 -1.45 -1.75 116.57 131.43 1xup h LYS 92 Ca -0.27 -0.55 -0.03 0.00 -1.27 0.00 0.00 60.65 58.53 1xup h LYS 92 Cb 1.11 0.09 0.01 0.00 -0.41 0.00 0.00 32.23 33.02 1xup h LYS 92 CO 0.82 1.17 -0.32 1.15 -2.27 0.00 0.00 179.45 180.00 1xup h THR 93 N 0.53 0.28 0.00 1.00 2.02 -1.93 -2.65 112.91 112.16 1xup h THR 93 Ca -0.01 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.00 1xup h THR 93 Cb 1.20 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.95 1xup h THR 93 CO 0.13 0.02 0.00 0.35 0.37 0.00 0.00 175.52 176.39 1xup n THR 94 N -5.43 0.72 -0.91 3.16 -2.24 -1.26 -4.88 114.28 103.45 1xup n THR 94 Ca -0.13 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1xup n THR 94 Cb 0.37 -0.93 0.00 0.00 -2.10 0.00 0.00 70.33 67.67 1xup n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xup n GLY 95 N 0.50 0.82 2.96 3.38 0.00 -0.67 -4.99 105.19 107.20 1xup n GLY 95 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1xup n GLY 95 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1xup s GLN 96 N -0.18 1.90 -0.18 1.61 1.03 -1.16 -4.93 119.66 117.75 1xup s GLN 96 Ca 0.00 -0.54 -0.32 0.00 0.04 0.00 0.00 55.36 54.54 1xup s GLN 96 Cb 0.00 -2.04 -0.09 0.00 0.03 0.00 0.00 33.01 30.91 1xup s GLN 96 CO 0.00 -0.32 2.10 -2.30 -2.54 0.00 0.00 175.29 172.22 1xup n PRO 97 N 4.81 1.92 -2.90 9.60 -0.02 -1.26 -4.18 135.00 142.97 1xup n PRO 97 Ca -0.14 0.61 -0.34 0.00 -2.02 0.00 0.00 63.50 61.61 1xup n PRO 97 Cb 0.49 -2.87 -0.02 0.00 -0.02 0.00 0.00 33.50 31.08 1xup n PRO 97 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1xup n ILE 98 N 6.67 4.30 -3.92 4.25 -5.35 -1.26 -4.91 119.36 119.13 1xup n ILE 98 Ca 0.29 -5.72 -0.01 0.00 -0.27 0.00 0.00 62.75 57.04 1xup n ILE 98 Cb 0.35 -1.60 0.02 0.00 -1.74 0.00 0.00 39.64 36.67 1xup n ILE 98 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1xup n ALA 99 N 0.10 -2.87 -2.67 -1.28 0.00 -1.26 -4.92 120.51 107.61 1xup n ALA 99 Ca 0.36 -0.95 0.00 0.00 0.00 0.00 0.00 53.44 52.85 1xup n ALA 99 Cb 0.34 0.45 0.00 0.00 0.00 0.00 0.00 19.45 20.24 1xup n ALA 99 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1xup n ASN 100 N -1.22 0.40 -3.59 0.00 0.23 -1.26 -4.45 115.26 105.38 1xup n ASN 100 Ca -0.00 -0.47 -0.20 0.00 -0.53 0.00 0.00 54.58 53.39 1xup n ASN 100 Cb 0.57 0.00 -0.15 0.00 -2.08 0.00 0.00 39.78 38.12 1xup n ASN 100 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1xup s ALA 101 N -2.00 -0.06 0.54 -2.53 0.00 -1.24 -4.41 121.76 112.06 1xup s ALA 101 Ca 0.00 0.24 -0.22 0.00 0.00 0.00 0.00 51.96 51.98 1xup s ALA 101 Cb 0.00 -1.05 -0.05 0.00 0.00 0.00 0.00 23.12 22.02 1xup s ALA 101 CO 0.00 -0.94 1.37 0.42 0.00 0.00 0.00 175.76 176.61 1xup s ILE 102 N 2.27 2.03 0.12 0.00 -1.09 -1.26 -2.64 121.20 120.63 1xup s ILE 102 Ca 0.04 0.02 0.06 0.00 -2.23 0.00 0.00 60.65 58.55 1xup s ILE 102 Cb -0.14 -3.01 -0.04 0.00 -1.58 0.00 0.00 42.46 37.69 1xup s ILE 102 CO -0.09 -0.00 -0.02 0.68 -1.23 0.00 0.00 174.94 174.29 1xup s VAL 103 N -1.29 3.80 -1.06 2.92 -7.23 -1.25 -3.99 120.40 112.31 1xup s VAL 103 Ca 0.71 -1.19 0.00 0.00 -1.81 0.00 0.00 61.98 59.69 1xup s VAL 103 Cb -0.41 -2.84 0.00 0.00 0.56 0.00 0.00 36.38 33.69 1xup s VAL 103 CO 0.49 0.04 0.47 -2.67 -0.31 0.00 0.00 175.10 173.12 1xup n TRP 104 N 0.34 0.00 -1.98 2.82 4.27 -1.26 -3.38 117.44 118.25 1xup n TRP 104 Ca -0.11 0.00 0.03 0.00 -3.89 0.00 0.00 57.50 53.53 1xup n TRP 104 Cb 0.53 -0.08 0.03 0.00 -1.36 0.00 0.00 31.31 30.43 1xup n TRP 104 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1xup n GLN 105 N 0.02 0.25 -3.57 -2.67 10.64 -1.26 -4.98 117.38 115.81 1xup n GLN 105 Ca 0.00 -1.58 -0.22 0.00 -1.83 0.00 0.00 57.00 53.37 1xup n GLN 105 Cb 0.21 -0.56 -0.15 0.00 -0.86 0.00 0.00 30.24 28.87 1xup n GLN 105 CO 0.00 0.00 0.00 -1.12 -1.83 0.00 0.00 177.06 174.11 1xup s SER 106 N -1.61 1.85 -1.15 2.61 0.01 -1.22 -4.76 113.70 109.43 1xup s SER 106 Ca 0.15 -0.39 -0.09 0.00 1.31 0.00 0.00 55.95 56.93 1xup s SER 106 Cb 0.15 0.02 -0.14 0.00 0.21 0.00 0.00 66.02 66.26 1xup s SER 106 CO -0.04 -0.33 3.17 -1.14 0.41 0.00 0.00 173.24 175.30 1xup n ARG 107 N 5.30 3.20 -0.14 12.44 0.63 -1.26 -4.52 116.66 132.31 1xup n ARG 107 Ca -0.06 -1.84 0.03 0.00 -0.92 0.00 0.00 57.85 55.05 1xup n ARG 107 Cb 0.49 -2.56 0.09 0.00 0.45 0.00 0.00 32.46 30.93 1xup n ARG 107 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1xup n GLN 108 N 3.26 1.62 0.03 -0.14 10.64 -1.26 -3.57 117.38 127.96 1xup n GLN 108 Ca 0.68 -0.75 0.11 0.00 -1.83 0.00 0.00 57.00 55.22 1xup n GLN 108 Cb 0.43 -1.31 0.03 0.00 -0.86 0.00 0.00 30.24 28.54 1xup n GLN 108 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 1xup n SER 109 N 0.10 0.62 0.30 2.61 7.64 -1.26 -4.33 113.62 119.30 1xup n SER 109 Ca 0.07 -0.14 0.16 0.00 1.01 0.00 0.00 58.87 59.97 1xup n SER 109 Cb 0.26 0.74 0.82 0.00 -1.01 0.00 0.00 64.21 65.03 1xup n SER 109 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1xup h SER 110 N 0.00 0.00 0.21 6.43 0.02 -1.91 -2.76 113.55 115.54 1xup h SER 110 Ca 0.00 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 1xup h SER 110 Cb 0.75 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.28 1xup h SER 110 CO 0.00 0.00 -0.30 -0.65 -1.14 0.00 0.00 176.83 174.74 1xup h PRO 111 N 0.00 0.16 0.00 3.45 0.11 -1.89 -3.36 132.00 130.46 1xup h PRO 111 Ca 0.03 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 66.02 1xup h PRO 111 Cb 0.70 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.78 1xup h PRO 111 CO -0.00 0.45 -1.22 1.51 -0.21 0.00 0.00 178.00 178.53 1xup n ILE 112 N -4.14 0.22 -0.32 4.15 3.06 -1.14 -4.78 119.36 116.41 1xup n ILE 112 Ca -0.01 -0.06 0.24 0.00 -2.50 0.00 0.00 62.75 60.41 1xup n ILE 112 Cb 0.38 -1.27 0.53 0.00 0.54 0.00 0.00 39.64 39.82 1xup n ILE 112 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1xup h ALA 113 N -0.10 2.32 0.00 1.51 0.00 -1.67 -1.85 119.26 119.48 1xup h ALA 113 Ca -0.10 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1xup h ALA 113 Cb 1.10 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1xup h ALA 113 CO -0.05 -0.72 -0.26 -0.44 0.00 0.00 0.00 179.25 177.78 1xup h ASP 114 N 0.35 0.00 1.66 0.00 5.19 -1.82 -2.96 116.42 118.83 1xup h ASP 114 Ca 0.59 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.99 1xup h ASP 114 Cb 1.58 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 41.09 1xup h ASP 114 CO -0.27 0.26 -0.06 0.06 -3.12 0.00 0.00 179.24 176.12 1xup h GLN 115 N 0.00 0.00 0.07 3.56 3.07 -1.65 -3.34 115.11 116.81 1xup h GLN 115 Ca -0.00 0.00 -0.33 0.00 0.09 0.00 0.00 58.65 58.40 1xup h GLN 115 Cb 0.47 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 28.00 1xup h GLN 115 CO 0.03 0.06 -1.89 1.47 0.09 0.00 0.00 178.83 178.59 1xup n LEU 116 N -3.13 1.83 0.00 0.06 -0.00 -1.13 -4.78 117.00 109.85 1xup n LEU 116 Ca 0.03 0.29 0.00 0.00 -0.00 0.00 0.00 56.01 56.33 1xup n LEU 116 Cb 0.49 -0.52 0.00 0.00 -0.00 0.00 0.00 43.42 43.38 1xup n LEU 116 CO 0.33 0.65 0.00 0.29 -0.00 0.00 0.00 177.39 178.66 1xup n LYS 117 N -3.27 0.00 0.00 1.47 5.02 -1.18 -4.67 118.16 115.53 1xup n LYS 117 Ca -0.26 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.03 1xup n LYS 117 Cb 1.05 -0.04 0.00 0.00 -0.02 0.00 0.00 35.03 36.02 1xup n LYS 117 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1xup n VAL 118 N 0.00 0.00 -0.64 -0.18 0.31 -1.26 -4.62 118.33 111.94 1xup n VAL 118 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.03 1xup n VAL 118 Cb 0.00 0.00 0.19 0.00 -0.91 0.00 0.00 33.84 33.12 1xup n VAL 118 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1xup s ASP 119 N -4.00 2.37 0.00 4.52 1.11 -1.26 -4.58 116.67 114.83 1xup s ASP 119 Ca 0.00 2.04 0.00 0.00 0.18 0.00 0.00 52.55 54.77 1xup s ASP 119 Cb 0.00 -2.52 0.00 0.00 1.07 0.00 0.00 42.92 41.47 1xup s ASP 119 CO 0.00 -3.42 0.00 0.61 1.18 0.00 0.00 175.17 173.54 1xup n GLY 120 N 0.41 0.00 0.16 0.21 0.00 -1.26 -0.65 105.19 104.06 1xup n GLY 120 Ca 0.10 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.21 1xup n GLY 120 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1xup n HIS 121 N -2.54 0.62 0.45 1.61 1.44 -1.26 -2.36 115.22 113.18 1xup n HIS 121 Ca 0.00 0.33 -0.19 0.00 -2.01 0.00 0.00 57.72 55.85 1xup n HIS 121 Cb 0.00 -0.95 -0.09 0.00 0.12 0.00 0.00 29.99 29.07 1xup n HIS 121 CO 0.00 0.00 0.00 1.15 -2.81 0.00 0.00 176.34 174.68 1xup h THR 122 N 0.00 0.13 -0.05 0.61 2.02 -1.13 -3.15 112.91 111.34 1xup h THR 122 Ca 0.00 -0.07 -0.16 0.00 0.77 0.00 0.00 66.41 66.96 1xup h THR 122 Cb 0.20 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.75 1xup h THR 122 CO 0.00 0.00 -0.66 -0.33 0.37 0.00 0.00 175.52 174.90 1xup h GLU 123 N -1.18 0.22 -0.57 6.66 3.07 -1.72 -3.35 114.58 117.70 1xup h GLU 123 Ca -0.12 -0.17 0.07 0.00 -0.50 0.00 0.00 59.36 58.65 1xup h GLU 123 Cb 0.87 0.03 -0.08 0.00 -0.84 0.00 0.00 28.75 28.73 1xup h GLU 123 CO 0.19 0.80 -0.28 -0.12 -1.40 0.00 0.00 179.01 178.20 1xup n MET 124 N -3.82 -0.19 -0.08 2.33 1.56 -1.01 0.35 117.12 116.25 1xup n MET 124 Ca -0.03 0.86 -0.11 0.00 -0.27 0.00 0.00 57.70 58.16 1xup n MET 124 Cb 0.66 -1.27 -0.04 0.00 2.15 0.00 0.00 33.22 34.72 1xup n MET 124 CO 0.00 0.00 0.00 0.97 -0.73 0.00 0.00 175.97 176.21 1xup h ILE 125 N 0.00 1.20 0.20 1.12 2.10 -1.70 -3.30 117.51 117.14 1xup h ILE 125 Ca 0.14 -0.65 -0.01 0.00 1.08 0.00 0.00 64.86 65.42 1xup h ILE 125 Cb 0.28 1.15 0.00 0.00 -1.09 0.00 0.00 36.82 37.16 1xup h ILE 125 CO -0.55 0.21 -0.10 -0.74 -1.08 0.00 0.00 178.15 175.90 1xup h HIS 126 N 0.24 -0.25 0.00 2.19 2.76 -0.11 0.05 115.15 120.02 1xup h HIS 126 Ca 0.08 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.24 1xup h HIS 126 Cb 0.25 0.08 0.00 0.00 1.55 0.00 0.00 27.41 29.30 1xup h HIS 126 CO 0.01 0.14 0.32 1.05 -1.30 0.00 0.00 177.93 178.15 1xup h GLU 127 N -0.88 0.00 0.00 5.26 4.11 -0.72 -2.06 114.58 120.29 1xup h GLU 127 Ca -0.03 0.00 -0.27 0.00 0.07 0.00 0.00 59.36 59.13 1xup h GLU 127 Cb 0.51 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.72 1xup h GLU 127 CO 0.05 0.00 -1.87 1.63 0.07 0.00 0.00 179.01 178.88 1xup n LYS 128 N -2.57 0.35 -0.05 1.06 4.01 -1.23 -4.89 118.16 114.85 1xup n LYS 128 Ca -0.02 0.15 -0.01 0.00 -0.51 0.00 0.00 58.31 57.93 1xup n LYS 128 Cb 0.36 -1.09 -0.01 0.00 -0.51 0.00 0.00 35.03 33.78 1xup n LYS 128 CO 0.00 0.00 0.00 1.15 -1.11 0.00 0.00 177.40 177.44 1xup h THR 129 N -0.60 0.09 0.00 -0.18 2.02 -0.74 -3.50 112.91 110.01 1xup h THR 129 Ca -0.41 -1.07 0.00 0.00 0.77 0.00 0.00 66.41 65.70 1xup h THR 129 Cb 1.34 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1xup h THR 129 CO -0.25 0.03 0.00 0.61 0.37 0.00 0.00 175.52 176.28 1xup n GLY 130 N 1.77 3.94 3.65 2.16 0.00 -0.80 -4.88 105.19 111.03 1xup n GLY 130 Ca -0.01 -0.70 -0.29 0.00 0.00 0.00 0.00 46.02 45.02 1xup n GLY 130 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xup s LEU 131 N 0.00 1.82 -0.00 0.99 2.96 -1.26 -4.58 118.68 118.61 1xup s LEU 131 Ca 0.00 1.49 -0.11 0.00 -0.22 0.00 0.00 54.13 55.29 1xup s LEU 131 Cb 0.00 -3.73 0.01 0.00 0.50 0.00 0.00 46.19 42.97 1xup s LEU 131 CO 0.00 -3.17 0.22 0.54 -1.32 0.00 0.00 176.35 172.61 1xup s VAL 132 N -2.80 0.07 -0.57 1.68 0.11 -1.26 -3.37 120.40 114.26 1xup s VAL 132 Ca 0.65 -0.60 -0.26 0.00 -2.93 0.00 0.00 61.98 58.84 1xup s VAL 132 Cb -0.20 -0.53 -0.23 0.00 -1.53 0.00 0.00 36.38 33.88 1xup s VAL 132 CO 0.59 -0.33 1.82 -0.38 -3.33 0.00 0.00 175.10 173.47 1xup n ILE 133 N 1.33 1.08 -2.15 7.04 5.41 -1.26 -4.79 119.36 126.01 1xup n ILE 133 Ca -0.22 -0.97 -0.43 0.00 1.00 0.00 0.00 62.75 62.13 1xup n ILE 133 Cb 0.56 -2.17 0.00 0.00 -0.71 0.00 0.00 39.64 37.32 1xup n ILE 133 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1xup n ASP 134 N 9.57 4.48 0.00 4.38 4.64 -1.26 -4.89 116.55 133.47 1xup n ASP 134 Ca 0.48 -2.93 0.00 0.00 -1.38 0.00 0.00 54.79 50.96 1xup n ASP 134 Cb 0.42 -1.64 0.00 0.00 -1.04 0.00 0.00 41.12 38.87 1xup n ASP 134 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1xup n ALA 135 N 6.12 0.00 0.74 -1.67 0.00 -1.26 -2.16 120.51 122.28 1xup n ALA 135 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1xup n ALA 135 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 1xup n ALA 135 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1xup n TYR 136 N 0.00 0.00 -2.75 0.00 0.18 -1.26 -3.56 117.16 109.77 1xup n TYR 136 Ca 0.00 0.00 -0.43 0.00 1.88 0.00 0.00 57.90 59.35 1xup n TYR 136 Cb 0.00 -0.02 -0.01 0.00 -0.38 0.00 0.00 39.34 38.93 1xup n TYR 136 CO 0.00 0.00 0.00 -0.06 -2.08 0.00 0.00 176.86 174.72 1xup s PHE 137 N -1.59 3.01 0.00 -3.48 2.99 -0.92 -4.77 117.98 113.22 1xup s PHE 137 Ca 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 56.93 55.36 1xup s PHE 137 Cb 0.00 -4.52 0.00 0.00 0.00 0.00 0.00 43.02 38.50 1xup s PHE 137 CO 0.00 -1.65 0.00 0.43 -0.00 0.00 0.00 175.22 174.00 1xup n SER 138 N 7.33 0.00 -0.27 1.36 7.64 -1.26 -1.53 113.62 126.90 1xup n SER 138 Ca 0.37 0.00 0.06 0.00 1.01 0.00 0.00 58.87 60.32 1xup n SER 138 Cb 0.47 0.00 0.18 0.00 -1.01 0.00 0.00 64.21 63.84 1xup n SER 138 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xup h ALA 139 N 0.00 0.86 -0.76 -0.43 0.00 -1.84 0.33 119.26 117.42 1xup h ALA 139 Ca 0.00 0.24 0.05 0.00 0.00 0.00 0.00 54.91 55.20 1xup h ALA 139 Cb 0.00 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 1xup h ALA 139 CO 0.00 -0.43 0.46 1.15 0.00 0.00 0.00 179.25 180.43 1xup h THR 140 N 0.12 1.05 -0.35 0.00 2.02 -1.51 -1.41 112.91 112.84 1xup h THR 140 Ca 0.44 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 67.29 1xup h THR 140 Cb 0.78 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 1xup h THR 140 CO -0.67 0.16 0.11 0.11 0.37 0.00 0.00 175.52 175.60 1xup h LYS 141 N 0.87 0.50 -0.13 6.66 1.57 -1.00 -2.48 116.57 122.56 1xup h LYS 141 Ca 0.32 -0.07 0.02 0.00 -1.87 0.00 0.00 60.65 59.05 1xup h LYS 141 Cb 0.10 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1xup h LYS 141 CO -0.15 0.44 0.09 0.28 -0.57 0.00 0.00 179.45 179.54 1xup h VAL 142 N 0.49 0.99 0.00 0.50 2.07 -0.59 -2.25 116.25 117.47 1xup h VAL 142 Ca 0.12 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1xup h VAL 142 Cb 0.16 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1xup h VAL 142 CO -0.01 0.02 0.00 0.54 0.02 0.00 0.00 177.57 178.14 1xup n ARG 143 N -4.51 0.05 -0.05 1.57 1.74 -0.93 -2.76 116.66 111.76 1xup n ARG 143 Ca -0.01 0.31 -0.09 0.00 -0.77 0.00 0.00 57.85 57.29 1xup n ARG 143 Cb 0.13 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.03 1xup n ARG 143 CO 0.00 0.00 0.00 1.87 -1.52 0.00 0.00 177.63 177.98 1xup n TRP 144 N -1.39 0.00 -0.09 -1.55 -0.00 -0.87 -4.81 117.44 108.73 1xup n TRP 144 Ca 0.02 0.00 -0.12 0.00 -0.00 0.00 0.00 57.50 57.41 1xup n TRP 144 Cb 0.06 -0.37 -0.06 0.00 -0.00 0.00 0.00 31.31 30.94 1xup n TRP 144 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 177.69 178.94 1xup h LEU 145 N -0.22 -1.52 -3.04 5.87 5.85 -1.31 -2.80 115.31 118.14 1xup h LEU 145 Ca -0.24 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1xup h LEU 145 Cb 1.27 0.64 0.00 0.00 0.37 0.00 0.00 40.66 42.94 1xup h LEU 145 CO -0.11 -0.40 0.00 0.18 -0.34 0.00 0.00 178.44 177.77 1xup n LEU 146 N -5.42 4.62 0.02 2.25 4.77 -1.17 -3.66 117.00 118.43 1xup n LEU 146 Ca -0.02 -2.09 0.00 0.00 -0.03 0.00 0.00 56.01 53.87 1xup n LEU 146 Cb 0.36 -0.97 0.00 0.00 -2.33 0.00 0.00 43.42 40.48 1xup n LEU 146 CO 0.05 0.87 0.00 0.47 -1.33 0.00 0.00 177.39 177.45 1xup n ASP 147 N 1.49 0.01 -0.07 -1.43 8.00 -1.06 -4.90 116.55 118.59 1xup n ASP 147 Ca 0.00 0.08 -0.06 0.00 0.71 0.00 0.00 54.79 55.52 1xup n ASP 147 Cb 0.44 0.05 0.12 0.00 -0.02 0.00 0.00 41.12 41.72 1xup n ASP 147 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1xup h ASN 148 N 0.00 0.73 -3.66 -2.24 7.08 -1.71 -3.42 115.58 112.36 1xup h ASN 148 Ca 0.00 -0.25 -0.57 0.00 -3.08 0.00 0.00 56.30 52.40 1xup h ASN 148 Cb 0.00 -0.20 -0.08 0.00 -2.08 0.00 0.00 38.32 35.96 1xup h ASN 148 CO 0.00 0.92 0.84 -0.63 -2.08 0.00 0.00 177.43 176.48 1xup s ILE 149 N -4.64 4.25 -0.08 6.14 1.01 -1.24 -4.60 121.20 122.05 1xup s ILE 149 Ca -0.09 1.07 -0.06 0.00 0.00 0.00 0.00 60.65 61.57 1xup s ILE 149 Cb 0.13 -4.58 0.02 0.00 0.01 0.00 0.00 42.46 38.05 1xup s ILE 149 CO 0.82 -1.00 0.12 -0.62 0.00 0.00 0.00 174.94 174.26 1xup n GLU 150 N 7.73 -3.41 -2.09 2.79 -0.58 -1.26 -4.85 120.64 118.97 1xup n GLU 150 Ca 0.10 2.68 -0.41 0.00 -0.42 0.00 0.00 57.16 59.11 1xup n GLU 150 Cb 0.49 -3.74 -0.03 0.00 -0.57 0.00 0.00 31.44 27.60 1xup n GLU 150 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1xup s GLY 151 N -0.45 0.54 -0.31 0.62 0.00 -1.26 -4.66 107.32 101.79 1xup s GLY 151 Ca -0.13 -0.32 0.06 0.00 0.00 0.00 0.00 44.72 44.32 1xup s GLY 151 CO 0.36 3.25 1.18 0.00 0.00 0.00 0.00 173.10 177.89 1xup n ALA 152 N 11.30 -0.12 -0.09 3.20 0.00 -1.26 -5.03 120.51 128.51 1xup n ALA 152 Ca 0.20 -0.77 -0.06 0.00 0.00 0.00 0.00 53.44 52.80 1xup n ALA 152 Cb 0.50 -0.91 -0.00 0.00 0.00 0.00 0.00 19.45 19.04 1xup n ALA 152 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1xup h GLN 153 N 1.27 -0.15 -0.88 0.00 7.50 -1.91 -1.18 115.11 119.76 1xup h GLN 153 Ca -0.38 0.01 0.05 0.00 0.50 0.00 0.00 58.65 58.83 1xup h GLN 153 Cb 1.24 0.03 -0.05 0.00 0.05 0.00 0.00 27.48 28.75 1xup h GLN 153 CO -0.13 -0.10 0.58 0.93 -1.50 0.00 0.00 178.83 178.60 1xup h GLU 154 N -0.16 1.02 -0.58 1.46 5.08 -2.00 -1.06 114.58 118.35 1xup h GLU 154 Ca 0.17 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 1xup h GLU 154 Cb 0.42 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 1xup h GLU 154 CO -0.43 0.68 0.31 0.87 -1.00 0.00 0.00 179.01 179.43 1xup h LYS 155 N 1.05 0.81 -0.03 2.33 1.57 -1.65 -1.22 116.57 119.43 1xup h LYS 155 Ca 0.36 -0.09 0.01 0.00 -1.87 0.00 0.00 60.65 59.06 1xup h LYS 155 Cb 0.09 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.24 1xup h LYS 155 CO -0.12 0.60 0.15 0.00 -0.57 0.00 0.00 179.45 179.52 1xup h ALA 156 N 1.53 1.25 -0.02 3.86 0.00 -0.46 -0.65 119.26 124.77 1xup h ALA 156 Ca 0.21 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1xup h ALA 156 Cb 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1xup h ALA 156 CO -0.03 -0.17 -0.01 -0.44 0.00 0.00 0.00 179.25 178.60 1xup h ASP 157 N 0.00 0.03 -0.43 0.00 3.32 -1.24 -3.21 116.42 114.89 1xup h ASP 157 Ca 0.01 -0.42 -0.29 0.00 0.02 0.00 0.00 57.03 56.35 1xup h ASP 157 Cb 0.32 -0.01 -0.11 0.00 0.22 0.00 0.00 39.33 39.75 1xup h ASP 157 CO -0.00 0.44 0.02 0.59 -1.72 0.00 0.00 179.24 178.57 1xup n ASN 158 N -4.86 5.83 0.00 6.45 3.02 -0.25 -4.89 115.26 120.55 1xup n ASN 158 Ca -0.08 -2.80 0.00 0.00 -0.03 0.00 0.00 54.58 51.67 1xup n ASN 158 Cb 0.23 -1.28 0.00 0.00 -0.61 0.00 0.00 39.78 38.11 1xup n ASN 158 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xup n GLY 159 N 1.57 1.65 5.73 7.41 0.00 -1.21 -4.90 105.19 115.44 1xup n GLY 159 Ca 0.39 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.63 1xup n GLY 159 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1xup n GLU 160 N 0.00 0.00 -3.46 1.61 2.13 -1.25 -3.75 120.64 115.93 1xup n GLU 160 Ca 0.00 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.40 1xup n GLU 160 Cb 0.00 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 31.68 1xup n GLU 160 CO 0.00 0.00 0.00 -0.48 -0.41 0.00 0.00 177.13 176.24 1xup s LEU 161 N 0.00 6.13 0.10 4.31 2.34 -1.25 -1.06 118.68 129.24 1xup s LEU 161 Ca 0.00 -3.31 -0.32 0.00 0.06 0.00 0.00 54.13 50.56 1xup s LEU 161 Cb 0.00 -2.09 -0.11 0.00 -0.56 0.00 0.00 46.19 43.43 1xup s LEU 161 CO 0.00 -0.34 1.83 0.18 -1.06 0.00 0.00 176.35 176.96 1xup n LEU 162 N 3.02 3.93 -4.94 1.48 7.99 -0.91 -4.60 117.00 122.97 1xup n LEU 162 Ca 0.19 0.99 -0.24 0.00 -0.01 0.00 0.00 56.01 56.93 1xup n LEU 162 Cb 0.40 -1.52 -0.01 0.00 -0.11 0.00 0.00 43.42 42.19 1xup n LEU 162 CO 0.39 0.12 0.22 0.72 -1.51 0.00 0.00 177.39 177.33 1xup s PHE 163 N 2.81 3.49 0.00 -1.77 -0.12 -1.26 -3.28 117.98 117.84 1xup s PHE 163 Ca 0.83 0.40 0.00 0.00 -0.05 0.00 0.00 56.93 58.11 1xup s PHE 163 Cb -0.51 -1.98 0.00 0.00 -0.63 0.00 0.00 43.02 39.90 1xup s PHE 163 CO 0.39 0.04 0.00 0.41 -0.05 0.00 0.00 175.22 176.01 1xup n GLY 164 N -1.87 1.13 3.65 1.99 0.00 -0.74 -4.71 105.19 104.64 1xup n GLY 164 Ca -0.04 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 45.09 1xup n GLY 164 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1xup s THR 165 N -2.00 1.73 0.32 2.61 -1.32 -1.26 -0.59 115.64 115.13 1xup s THR 165 Ca 0.00 0.00 0.08 0.00 -1.21 0.00 0.00 61.69 60.56 1xup s THR 165 Cb 0.00 -2.55 0.32 0.00 -1.51 0.00 0.00 72.50 68.75 1xup s THR 165 CO 0.00 0.00 1.79 -0.29 -2.21 0.00 0.00 174.62 173.91 1xup h ILE 166 N -2.32 0.69 0.29 5.08 2.10 -1.72 -0.82 117.51 120.81 1xup h ILE 166 Ca -0.47 -0.24 0.00 0.00 1.08 0.00 0.00 64.86 65.24 1xup h ILE 166 Cb 1.30 -0.06 -0.03 0.00 -1.09 0.00 0.00 36.82 36.93 1xup h ILE 166 CO 0.40 0.13 -0.44 0.44 -1.08 0.00 0.00 178.15 177.60 1xup h ASP 167 N 0.69 -1.25 0.01 2.19 5.19 -1.88 0.23 116.42 121.60 1xup h ASP 167 Ca 0.57 0.12 0.00 0.00 -0.62 0.00 0.00 57.03 57.10 1xup h ASP 167 Cb 0.98 0.44 0.00 0.00 0.18 0.00 0.00 39.33 40.93 1xup h ASP 167 CO -0.35 -0.55 0.00 0.28 -3.12 0.00 0.00 179.24 175.50 1xup h SER 168 N -0.79 0.00 0.00 6.45 0.02 -0.81 -2.26 113.55 116.15 1xup h SER 168 Ca -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1xup h SER 168 Cb 0.75 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.29 1xup h SER 168 CO -0.15 0.00 -0.17 -0.25 -1.14 0.00 0.00 176.83 175.12 1xup h TRP 169 N 0.00 0.00 -0.51 3.45 2.91 -0.01 -3.16 115.95 118.63 1xup h TRP 169 Ca 0.00 0.00 0.10 0.00 1.13 0.00 0.00 58.89 60.12 1xup h TRP 169 Cb 0.01 0.00 -0.09 0.00 -0.51 0.00 0.00 29.16 28.57 1xup h TRP 169 CO 0.00 0.00 -0.05 1.37 -1.03 0.00 0.00 178.44 178.73 1xup h LEU 170 N -0.56 -0.33 0.12 0.65 8.10 -0.57 -0.77 115.31 121.96 1xup h LEU 170 Ca 0.00 0.14 -0.01 0.00 0.11 0.00 0.00 57.88 58.12 1xup h LEU 170 Cb 0.17 0.26 0.00 0.00 -0.44 0.00 0.00 40.66 40.65 1xup h LEU 170 CO 0.00 -0.12 -0.06 0.58 -4.11 0.00 0.00 178.44 174.73 1xup h VAL 171 N 0.06 0.89 0.26 0.15 2.07 -1.62 0.15 116.25 118.21 1xup h VAL 171 Ca 0.25 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.74 1xup h VAL 171 Cb 0.39 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 1xup h VAL 171 CO -0.47 0.01 -0.51 -0.25 0.02 0.00 0.00 177.57 176.37 1xup h TRP 172 N -0.18 -1.46 -0.97 1.57 7.01 -1.33 -2.85 115.95 117.75 1xup h TRP 172 Ca -0.02 0.03 -0.60 0.00 2.11 0.00 0.00 58.89 60.42 1xup h TRP 172 Cb 0.14 0.60 -0.29 0.00 -2.10 0.00 0.00 29.16 27.51 1xup h TRP 172 CO -0.07 -0.62 0.77 1.17 -2.79 0.00 0.00 178.44 176.90 1xup n LYS 173 N -5.52 2.47 0.12 2.65 3.00 -0.37 -4.04 118.16 116.48 1xup n LYS 173 Ca -0.10 -3.07 -0.06 0.00 -0.00 0.00 0.00 58.31 55.08 1xup n LYS 173 Cb 0.43 -2.20 -0.03 0.00 0.00 0.00 0.00 35.03 33.23 1xup n LYS 173 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 1xup h LEU 174 N 1.63 -0.32 -8.62 3.14 6.46 -0.44 -3.47 115.31 113.69 1xup h LEU 174 Ca 0.60 0.01 -0.31 0.00 -0.12 0.00 0.00 57.88 58.06 1xup h LEU 174 Cb 1.59 0.08 -0.15 0.00 -0.73 0.00 0.00 40.66 41.46 1xup h LEU 174 CO 1.36 0.08 -0.71 -0.89 -0.62 0.00 0.00 178.44 177.66 1xup s THR 175 N -2.78 1.09 -0.18 1.05 2.01 -1.26 -5.07 115.64 110.50 1xup s THR 175 Ca -0.06 -2.04 -0.05 0.00 0.31 0.00 0.00 61.69 59.86 1xup s THR 175 Cb 0.01 -1.83 -0.03 0.00 0.01 0.00 0.00 72.50 70.66 1xup s THR 175 CO 0.17 -0.76 -0.01 -0.62 -0.69 0.00 0.00 174.62 172.70 1xup s ASP 176 N -3.15 4.83 0.00 3.53 -1.08 -1.26 -4.41 116.67 115.12 1xup s ASP 176 Ca 0.16 -0.17 0.00 0.00 -0.52 0.00 0.00 52.55 52.02 1xup s ASP 176 Cb 0.03 -1.81 0.00 0.00 -1.46 0.00 0.00 42.92 39.68 1xup s ASP 176 CO -0.00 0.11 0.00 0.61 0.52 0.00 0.00 175.17 176.40 1xup n GLY 177 N 3.96 4.02 0.00 2.66 0.00 -1.15 -4.04 105.19 110.64 1xup n GLY 177 Ca -0.17 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.13 1xup n GLY 177 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1xup n GLN 178 N 0.00 0.00 -3.71 1.61 -0.06 -1.26 -2.62 117.38 111.35 1xup n GLN 178 Ca 0.00 0.00 -0.34 0.00 -2.00 0.00 0.00 57.00 54.66 1xup n GLN 178 Cb 0.00 0.00 -0.05 0.00 -4.06 0.00 0.00 30.24 26.13 1xup n GLN 178 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 1xup s VAL 179 N -2.00 5.23 -1.07 1.69 0.11 -1.26 -4.83 120.40 118.27 1xup s VAL 179 Ca 0.00 0.17 -0.24 0.00 -2.93 0.00 0.00 61.98 58.98 1xup s VAL 179 Cb 0.00 -3.60 -0.16 0.00 -1.53 0.00 0.00 36.38 31.09 1xup s VAL 179 CO 0.00 0.26 1.98 1.41 -3.33 0.00 0.00 175.10 175.42 1xup n HIS 180 N 0.78 1.93 -3.02 1.54 8.25 -1.26 -4.66 115.22 118.78 1xup n HIS 180 Ca -0.08 -1.01 -0.28 0.00 -0.26 0.00 0.00 57.72 56.08 1xup n HIS 180 Cb 0.52 -2.46 -0.02 0.00 1.12 0.00 0.00 29.99 29.15 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 12.54 4.93 0.11 1.59 -7.23 -1.26 0.14 120.40 131.23 1xup s VAL 181 Ca 0.72 0.20 -0.00 0.00 -1.81 0.00 0.00 61.98 61.09 1xup s VAL 181 Cb -0.00 -3.78 0.00 0.00 0.56 0.00 0.00 36.38 33.16 1xup s VAL 181 CO 0.16 -0.54 0.14 0.41 -0.31 0.00 0.00 175.10 174.96 1xup n THR 182 N -1.47 0.00 -3.90 5.32 -1.04 0.45 -2.37 114.28 111.27 1xup n THR 182 Ca -0.00 -0.59 -0.10 0.00 -2.04 0.00 0.00 64.05 61.32 1xup n THR 182 Cb 0.54 0.35 -0.09 0.00 -1.82 0.00 0.00 70.33 69.31 1xup n THR 182 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 1xup s ASP 183 N -1.68 0.12 0.14 8.00 -4.77 -1.26 -0.50 116.67 116.71 1xup s ASP 183 Ca 0.10 -0.45 -0.29 0.00 -3.30 0.00 0.00 52.55 48.61 1xup s ASP 183 Cb -0.00 0.24 -0.05 0.00 -1.09 0.00 0.00 42.92 42.02 1xup s ASP 183 CO 0.07 -0.50 1.57 1.88 0.70 0.00 0.00 175.17 178.89 1xup h TYR 184 N 3.69 -1.33 -0.82 2.11 0.99 -1.78 0.27 116.97 120.10 1xup h TYR 184 Ca -0.32 0.06 0.15 0.00 2.00 0.00 0.00 58.73 60.62 1xup h TYR 184 Cb 1.19 0.62 -0.15 0.00 1.00 0.00 0.00 36.73 39.39 1xup h TYR 184 CO 0.54 -0.48 -0.31 0.77 -0.00 0.00 0.00 178.16 178.69 1xup h SER 185 N -0.44 -1.11 0.75 3.88 0.02 -1.93 -0.08 113.55 114.64 1xup h SER 185 Ca 0.09 0.27 -0.23 0.00 -0.84 0.00 0.00 61.79 61.08 1xup h SER 185 Cb 0.62 0.62 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 1xup h SER 185 CO -0.49 -0.29 -1.05 0.78 -1.14 0.00 0.00 176.83 174.65 1xup h ASN 186 N -0.05 0.22 -0.59 3.07 4.21 -1.86 -3.37 115.58 117.21 1xup h ASN 186 Ca 0.34 -0.22 0.08 0.00 1.21 0.00 0.00 56.30 57.71 1xup h ASN 186 Cb 0.59 -0.07 -0.10 0.00 -1.12 0.00 0.00 38.32 37.62 1xup h ASN 186 CO -0.86 1.13 -0.48 0.00 -1.29 0.00 0.00 177.43 175.93 1xup h ALA 187 N 0.85 -0.45 -0.71 -0.83 0.00 0.15 -1.50 119.26 116.76 1xup h ALA 187 Ca -0.06 0.09 0.13 0.00 0.00 0.00 0.00 54.91 55.07 1xup h ALA 187 Cb 1.76 1.05 -0.09 0.00 0.00 0.00 0.00 17.79 20.50 1xup h ALA 187 CO 0.16 -0.89 0.25 1.03 0.00 0.00 0.00 179.25 179.80 1xup h SER 188 N -0.24 0.20 -0.71 0.00 0.87 -1.67 -0.79 113.55 111.22 1xup h SER 188 Ca 0.16 0.11 0.03 0.00 -1.23 0.00 0.00 61.79 60.85 1xup h SER 188 Cb 0.56 0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 62.59 1xup h SER 188 CO -0.70 0.08 0.47 0.03 -0.53 0.00 0.00 176.83 176.17 1xup h ARG 189 N 0.39 0.85 0.00 2.24 -0.00 -1.49 -1.17 114.38 115.20 1xup h ARG 189 Ca 0.39 -0.05 0.00 0.00 -0.50 0.00 0.00 59.98 59.82 1xup h ARG 189 Cb 0.59 -0.19 0.00 0.00 0.00 0.00 0.00 29.97 30.37 1xup h ARG 189 CO -0.41 0.56 0.00 2.41 0.00 0.00 0.00 179.97 182.53 1xup n THR 190 N -4.45 1.26 0.00 2.04 -1.04 -0.31 -4.51 114.28 107.28 1xup n THR 190 Ca 0.09 0.32 0.00 0.00 -2.04 0.00 0.00 64.05 62.41 1xup n THR 190 Cb 0.11 -1.16 0.00 0.00 -1.82 0.00 0.00 70.33 67.46 1xup n THR 190 CO 0.00 0.00 0.00 0.80 -0.64 0.00 0.00 175.07 175.23 1xup n MET 191 N -1.46 0.00 -0.02 -2.82 1.56 -0.44 -2.75 117.12 111.18 1xup n MET 191 Ca 0.03 0.00 -0.07 0.00 -0.27 0.00 0.00 57.70 57.39 1xup n MET 191 Cb 0.10 -2.91 0.11 0.00 2.15 0.00 0.00 33.22 32.68 1xup n MET 191 CO 0.00 0.00 0.00 -0.07 -0.73 0.00 0.00 175.97 175.17 1xup h LEU 192 N 0.00 0.63 0.00 -0.89 3.38 -1.83 -3.42 115.31 113.17 1xup h LEU 192 Ca 0.00 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1xup h LEU 192 Cb 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1xup h LEU 192 CO 0.00 0.92 0.00 -1.22 0.09 0.00 0.00 178.44 178.23 1xup n TYR 193 N -4.06 0.00 0.00 1.13 4.02 -1.25 -3.39 117.16 113.60 1xup n TYR 193 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.88 1xup n TYR 193 Cb 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.80 1xup n TYR 193 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1xup n ASN 194 N 0.00 0.00 0.01 7.72 2.85 -1.26 -4.67 115.26 119.91 1xup n ASN 194 Ca 0.00 0.00 -0.19 0.00 -0.11 0.00 0.00 54.58 54.28 1xup n ASN 194 Cb 0.00 0.00 -0.09 0.00 1.24 0.00 0.00 39.78 40.93 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 0.82 1.29 -0.41 -1.44 -0.00 -1.94 0.32 117.51 116.14 1xup h ILE 195 Ca 0.00 -2.10 -0.28 0.00 -0.00 0.00 0.00 64.86 62.48 1xup h ILE 195 Cb 0.00 2.21 -0.12 0.00 -0.00 0.00 0.00 36.82 38.92 1xup h ILE 195 CO 0.00 0.66 0.36 1.41 -0.00 0.00 0.00 178.15 180.57 1xup n HIS 196 N -3.92 1.31 0.05 2.19 8.25 -1.26 -4.12 115.22 117.72 1xup n HIS 196 Ca -0.09 -1.82 0.00 0.00 -0.26 0.00 0.00 57.72 55.54 1xup n HIS 196 Cb 0.81 -0.89 0.00 0.00 1.12 0.00 0.00 29.99 31.03 1xup n HIS 196 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1xup n LYS 197 N 0.52 0.00 -1.21 -0.41 4.81 -1.20 -5.01 118.16 115.67 1xup n LYS 197 Ca 0.26 0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.62 1xup n LYS 197 Cb 0.56 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.58 1xup n LYS 197 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1xup n LEU 198 N -2.66 0.01 -4.63 3.14 4.77 0.11 -4.93 117.00 112.81 1xup n LEU 198 Ca 0.00 0.20 -0.29 0.00 -0.03 0.00 0.00 56.01 55.89 1xup n LEU 198 Cb 0.00 -2.57 -0.09 0.00 -2.33 0.00 0.00 43.42 38.43 1xup n LEU 198 CO 0.00 -1.00 -0.25 -1.61 -1.33 0.00 0.00 177.39 173.20 1xup s GLU 199 N -2.62 2.01 -0.86 3.23 2.02 -1.26 -4.93 118.70 116.28 1xup s GLU 199 Ca 0.00 -2.22 -0.25 0.00 0.02 0.00 0.00 54.97 52.52 1xup s GLU 199 Cb 0.00 -1.28 0.03 0.00 0.10 0.00 0.00 34.13 32.98 1xup s GLU 199 CO 0.00 -0.28 1.43 -1.58 0.02 0.00 0.00 175.26 174.85 1xup s TRP 200 N -2.96 2.31 -0.47 1.61 0.52 -1.26 -4.23 118.94 114.46 1xup s TRP 200 Ca 0.21 -0.28 -0.28 0.00 0.02 0.00 0.00 56.10 55.77 1xup s TRP 200 Cb 0.05 -4.58 -0.01 0.00 -1.15 0.00 0.00 33.47 27.78 1xup s TRP 200 CO 0.11 -2.02 1.66 0.34 0.02 0.00 0.00 176.95 177.06 1xup s ASP 201 N 4.83 5.86 0.00 2.95 3.68 -1.22 -4.95 116.67 127.83 1xup s ASP 201 Ca 0.44 0.72 0.00 0.00 2.13 0.00 0.00 52.55 55.84 1xup s ASP 201 Cb -0.05 -2.53 0.00 0.00 -1.45 0.00 0.00 42.92 38.89 1xup s ASP 201 CO 0.04 -1.84 0.00 0.00 0.13 0.00 0.00 175.17 173.50 1xup n GLN 202 N 8.62 0.00 0.00 4.34 1.13 -1.26 -4.23 117.38 125.98 1xup n GLN 202 Ca 0.19 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.25 1xup n GLN 202 Cb 0.49 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.84 1xup n GLN 202 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 1xup n GLU 203 N 0.00 0.00 -0.08 -1.09 2.13 -1.26 -0.32 120.64 120.02 1xup n GLU 203 Ca 0.00 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.72 1xup n GLU 203 Cb 0.00 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 31.68 1xup n GLU 203 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 1xup h ILE 204 N 0.00 1.13 -0.51 6.31 1.08 -2.02 -2.88 117.51 120.62 1xup h ILE 204 Ca 0.00 -0.34 0.15 0.00 -0.39 0.00 0.00 64.86 64.28 1xup h ILE 204 Cb 0.00 0.86 -0.02 0.00 -3.07 0.00 0.00 36.82 34.59 1xup h ILE 204 CO 0.00 0.13 0.46 -0.07 -0.69 0.00 0.00 178.15 177.97 1xup h LEU 205 N 0.32 0.00 0.00 1.44 4.07 -0.84 -1.82 115.31 118.47 1xup h LEU 205 Ca 0.09 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.05 1xup h LEU 205 Cb 0.07 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.81 1xup h LEU 205 CO -0.01 0.00 0.01 0.47 -1.08 0.00 0.00 178.44 177.82 1xup n ASP 206 N -3.94 0.00 -0.68 -0.43 10.43 -1.09 -1.76 116.55 119.07 1xup n ASP 206 Ca 0.09 0.06 0.13 0.00 2.57 0.00 0.00 54.79 57.65 1xup n ASP 206 Cb 0.66 -0.06 0.35 0.00 1.84 0.00 0.00 41.12 43.91 1xup n ASP 206 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1xup n LEU 207 N -1.02 2.12 -2.73 0.64 4.77 -0.69 -4.21 117.00 115.89 1xup n LEU 207 Ca 0.00 -0.74 -0.28 0.00 -0.03 0.00 0.00 56.01 54.96 1xup n LEU 207 Cb 0.01 -0.02 -0.08 0.00 -2.33 0.00 0.00 43.42 41.00 1xup n LEU 207 CO 0.00 0.37 2.19 0.18 -1.33 0.00 0.00 177.39 178.80 1xup n LEU 208 N 0.65 6.95 0.00 2.23 4.32 -0.72 -4.78 117.00 125.66 1xup n LEU 208 Ca 0.17 -4.03 0.00 0.00 -0.02 0.00 0.00 56.01 52.13 1xup n LEU 208 Cb 0.45 -1.39 0.00 0.00 -1.62 0.00 0.00 43.42 40.86 1xup n LEU 208 CO 0.16 1.87 0.00 -3.20 -1.22 0.00 0.00 177.39 175.00 1xup n ASN 209 N 2.18 0.00 -4.17 -1.43 5.15 -1.26 -4.81 115.26 110.92 1xup n ASN 209 Ca 0.57 0.00 -0.26 0.00 -0.60 0.00 0.00 54.58 54.29 1xup n ASN 209 Cb 0.53 0.00 -0.16 0.00 -0.53 0.00 0.00 39.78 39.62 1xup n ASN 209 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1xup s ILE 210 N 0.00 1.50 -0.33 -1.44 -4.36 -1.26 -5.05 121.20 110.26 1xup s ILE 210 Ca 0.00 -0.78 -0.12 0.00 -0.26 0.00 0.00 60.65 59.48 1xup s ILE 210 Cb 0.00 -1.27 -0.13 0.00 1.25 0.00 0.00 42.46 42.31 1xup s ILE 210 CO 0.00 0.43 1.54 -2.65 0.24 0.00 0.00 174.94 174.50 1xup n PRO 211 N 2.88 0.71 -1.73 0.37 -0.02 -1.26 -4.32 135.00 131.64 1xup n PRO 211 Ca -0.17 -1.05 -0.14 0.00 -2.02 0.00 0.00 63.50 60.12 1xup n PRO 211 Cb 0.53 -2.37 -0.04 0.00 -0.02 0.00 0.00 33.50 31.60 1xup n PRO 211 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1xup n SER 212 N 6.16 -3.91 -0.15 2.55 7.64 -1.26 -4.87 113.62 119.77 1xup n SER 212 Ca 0.29 0.29 -0.12 0.00 1.01 0.00 0.00 58.87 60.34 1xup n SER 212 Cb 0.19 -3.51 -0.07 0.00 -1.01 0.00 0.00 64.21 59.81 1xup n SER 212 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1xup h SER 213 N 0.00 -1.70 -0.65 6.43 4.64 -1.95 -3.03 113.55 117.31 1xup h SER 213 Ca -0.30 0.24 -0.73 0.00 -0.47 0.00 0.00 61.79 60.53 1xup h SER 213 Cb 1.02 0.72 -0.09 0.00 -0.31 0.00 0.00 62.40 63.74 1xup h SER 213 CO 0.42 -0.38 2.68 0.23 -0.87 0.00 0.00 176.83 178.91 1xup n MET 214 N -5.39 3.34 -2.80 4.77 2.81 -1.26 -4.97 117.12 113.62 1xup n MET 214 Ca -0.02 -3.01 -0.42 0.00 -1.81 0.00 0.00 57.70 52.44 1xup n MET 214 Cb 0.34 -3.06 -0.04 0.00 -0.71 0.00 0.00 33.22 29.76 1xup n MET 214 CO 0.00 0.00 0.00 -0.48 1.51 0.00 0.00 175.97 177.00 1xup s LEU 215 N 0.80 4.04 0.59 4.03 2.34 -1.15 -4.66 118.68 124.67 1xup s LEU 215 Ca 0.46 0.93 -0.17 0.00 0.06 0.00 0.00 54.13 55.40 1xup s LEU 215 Cb 0.13 -3.30 -0.03 0.00 -0.56 0.00 0.00 46.19 42.42 1xup s LEU 215 CO -0.05 -0.69 1.10 -2.84 -1.06 0.00 0.00 176.35 172.81 1xup s PRO 216 N 3.19 3.17 0.50 1.48 0.02 -1.26 -5.02 135.00 137.08 1xup s PRO 216 Ca 0.38 1.43 -0.03 0.00 0.02 0.00 0.00 61.00 62.80 1xup s PRO 216 Cb -0.14 -2.00 -0.01 0.00 0.02 0.00 0.00 34.50 32.38 1xup s PRO 216 CO 0.12 -0.96 0.77 -2.00 -0.33 0.00 0.00 177.00 174.60 1xup s GLU 217 N -3.74 3.14 0.16 5.54 2.12 0.38 -4.95 118.70 121.36 1xup s GLU 217 Ca 0.68 -0.16 0.08 0.00 0.36 0.00 0.00 54.97 55.93 1xup s GLU 217 Cb -0.20 -2.42 -0.04 0.00 0.26 0.00 0.00 34.13 31.72 1xup s GLU 217 CO 0.34 -0.38 -0.17 0.54 -0.54 0.00 0.00 175.26 175.05 1xup s VAL 218 N -2.73 1.71 0.02 3.70 0.11 -1.26 -0.41 120.40 121.53 1xup s VAL 218 Ca 0.49 -1.92 0.06 0.00 -2.93 0.00 0.00 61.98 57.69 1xup s VAL 218 Cb -0.10 -1.81 -0.03 0.00 -1.53 0.00 0.00 36.38 32.91 1xup s VAL 218 CO 0.42 -0.38 -0.18 -0.54 -3.33 0.00 0.00 175.10 171.09 1xup s LYS 219 N -2.89 2.15 0.00 1.54 -0.14 0.34 -4.77 119.74 115.98 1xup s LYS 219 Ca 0.15 -0.93 0.00 0.00 -1.36 0.00 0.00 55.97 53.84 1xup s LYS 219 Cb -0.05 -2.21 0.00 0.00 -1.68 0.00 0.00 37.83 33.89 1xup s LYS 219 CO 0.06 0.56 0.00 -1.13 -0.76 0.00 0.00 175.35 174.08 1xup n SER 220 N 1.74 0.00 -1.26 2.83 3.41 -1.26 -2.75 113.62 116.34 1xup n SER 220 Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 1xup n SER 220 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 1xup n SER 220 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1xup n ASN 221 N 0.00 0.00 -4.53 4.04 3.02 -1.26 -4.65 115.26 111.88 1xup n ASN 221 Ca 0.00 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.30 1xup n ASN 221 Cb 0.00 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.05 1xup n ASN 221 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1xup n SER 222 N 0.00 0.79 -3.23 6.41 7.64 -1.26 -4.79 113.62 119.19 1xup n SER 222 Ca 0.00 -0.75 -0.37 0.00 1.01 0.00 0.00 58.87 58.76 1xup n SER 222 Cb 0.00 -1.22 -0.04 0.00 -1.01 0.00 0.00 64.21 61.94 1xup n SER 222 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1xup n GLU 223 N 7.92 3.63 -1.78 1.43 0.00 -1.26 -4.88 120.64 125.71 1xup n GLU 223 Ca 0.54 -2.17 -0.20 0.00 0.00 0.00 0.00 57.16 55.33 1xup n GLU 223 Cb 0.31 -2.74 -0.09 0.00 0.00 0.00 0.00 31.44 28.93 1xup n GLU 223 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1xup s VAL 224 N 1.93 3.22 0.03 3.84 1.01 -1.24 -4.25 120.40 124.93 1xup s VAL 224 Ca 0.69 -0.33 0.03 0.00 0.00 0.00 0.00 61.98 62.37 1xup s VAL 224 Cb 0.19 -4.03 -0.02 0.00 0.00 0.00 0.00 36.38 32.52 1xup s VAL 224 CO -0.06 -0.41 -0.09 -0.72 0.00 0.00 0.00 175.10 173.83 1xup s TYR 225 N 14.39 0.77 0.00 5.22 -0.00 0.41 -4.75 117.35 133.38 1xup s TYR 225 Ca 0.78 -0.37 0.00 0.00 -0.00 0.00 0.00 57.07 57.48 1xup s TYR 225 Cb -0.05 -0.46 0.00 0.00 -0.00 0.00 0.00 41.96 41.45 1xup s TYR 225 CO 0.14 -0.03 0.00 0.41 -0.00 0.00 0.00 175.55 176.06 1xup n GLY 226 N 1.89 -0.50 0.00 5.49 0.00 -1.26 -2.91 105.19 107.90 1xup n GLY 226 Ca -0.19 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.10 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 -1.14 0.00 -0.89 1.61 -0.00 -1.26 -4.99 115.22 108.55 1xup n HIS 227 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 57.72 57.80 1xup n HIS 227 Cb 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 29.99 30.12 1xup n HIS 227 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.34 178.75 1xup n THR 228 N 0.00 1.78 0.00 1.59 -1.04 -1.08 -4.97 114.28 110.57 1xup n THR 228 Ca 0.00 -2.02 0.00 0.00 -2.04 0.00 0.00 64.05 59.99 1xup n THR 228 Cb 0.00 -0.12 0.00 0.00 -1.82 0.00 0.00 70.33 68.39 1xup n THR 228 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 1xup n ARG 229 N -1.18 0.00 -0.01 -2.82 0.00 -1.25 -2.92 116.66 108.47 1xup n ARG 229 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.99 1xup n ARG 229 Cb 0.60 0.00 -0.00 0.00 0.00 0.00 0.00 32.46 33.06 1xup n ARG 229 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 1xup n SER 230 N 0.00 -1.00 -1.60 6.15 7.64 -1.23 -4.47 113.62 119.11 1xup n SER 230 Ca 0.00 0.02 -0.01 0.00 1.01 0.00 0.00 58.87 59.89 1xup n SER 230 Cb 0.00 -0.07 0.02 0.00 -1.01 0.00 0.00 64.21 63.15 1xup n SER 230 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xup n TYR 231 N -0.37 -0.45 -0.16 1.43 9.36 -1.26 -4.88 117.16 120.83 1xup n TYR 231 Ca 0.00 -0.40 0.00 0.00 3.32 0.00 0.00 57.90 60.82 1xup n TYR 231 Cb 0.01 0.73 0.00 0.00 -0.63 0.00 0.00 39.34 39.45 1xup n TYR 231 CO 0.00 0.00 0.00 1.58 0.22 0.00 0.00 176.86 178.66 1xup n HIS 232 N -0.34 0.00 -4.23 2.98 -0.00 -1.26 -5.06 115.22 107.31 1xup n HIS 232 Ca -0.05 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 57.48 1xup n HIS 232 Cb 0.56 0.00 -0.12 0.00 -0.00 0.00 0.00 29.99 30.42 1xup n HIS 232 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 1xup s PHE 233 N -2.24 1.18 -1.09 1.57 0.40 -1.26 -5.08 117.98 111.45 1xup s PHE 233 Ca 0.00 -0.42 -0.22 0.00 -0.60 0.00 0.00 56.93 55.70 1xup s PHE 233 Cb 0.00 -0.68 0.06 0.00 0.51 0.00 0.00 43.02 42.91 1xup s PHE 233 CO 0.00 0.04 1.52 -0.47 0.70 0.00 0.00 175.22 177.01 1xup s TYR 234 N -1.10 2.60 -0.01 0.36 5.04 -1.26 -4.30 117.35 118.67 1xup s TYR 234 Ca -0.01 -1.04 0.02 0.00 -2.44 0.00 0.00 57.07 53.59 1xup s TYR 234 Cb -0.09 -4.71 -0.00 0.00 0.35 0.00 0.00 41.96 37.51 1xup s TYR 234 CO 0.02 -1.90 -0.05 0.20 -1.34 0.00 0.00 175.55 172.47 1xup s GLY 235 N 4.78 0.28 -1.33 8.97 0.00 -1.26 -4.76 107.32 114.00 1xup s GLY 235 Ca 0.48 -0.20 -0.01 0.00 0.00 0.00 0.00 44.72 44.99 1xup s GLY 235 CO -0.06 -0.11 0.72 1.44 0.00 0.00 0.00 173.10 175.10 1xup n SER 236 N 3.09 -1.44 -2.11 1.64 7.64 -1.26 -3.54 113.62 117.63 1xup n SER 236 Ca -0.15 -0.82 0.01 0.00 1.01 0.00 0.00 58.87 58.92 1xup n SER 236 Cb 0.57 -4.02 0.04 0.00 -1.01 0.00 0.00 64.21 59.79 1xup n SER 236 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1xup n GLU 237 N -4.31 1.01 -2.50 1.43 1.02 -1.26 -4.51 120.64 111.52 1xup n GLU 237 Ca -0.27 -2.84 -0.41 0.00 -0.02 0.00 0.00 57.16 53.62 1xup n GLU 237 Cb 0.67 -0.91 -0.04 0.00 -0.02 0.00 0.00 31.44 31.14 1xup n GLU 237 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1xup s VAL 238 N -2.09 3.75 0.00 2.62 0.11 -1.26 -4.24 120.40 119.28 1xup s VAL 238 Ca 0.32 1.58 0.00 0.00 -2.93 0.00 0.00 61.98 60.94 1xup s VAL 238 Cb 0.36 -4.01 0.00 0.00 -1.53 0.00 0.00 36.38 31.20 1xup s VAL 238 CO -0.10 0.30 0.00 -2.65 -3.33 0.00 0.00 175.10 169.32 1xup n PRO 239 N 2.04 2.38 0.00 1.54 -0.02 -1.26 -4.73 135.00 134.95 1xup n PRO 239 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 1xup n PRO 239 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.94 1xup n PRO 239 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1xup n ILE 240 N -1.13 0.00 -2.21 4.25 5.41 -1.14 -4.69 119.36 119.85 1xup n ILE 240 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1xup n ILE 240 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1xup n ILE 240 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1xup n ALA 241 N -1.17 0.00 0.00 -1.39 0.00 -0.28 0.15 120.51 117.82 1xup n ALA 241 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1xup n ALA 241 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00 1.28 3.69 0.00 0.00 -1.23 -0.99 105.19 107.94 1xup n GLY 242 Ca 0.00 -0.44 -0.26 0.00 0.00 0.00 0.00 46.02 45.32 1xup n GLY 242 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1xup n MET 243 N 0.00 -1.21 -4.14 1.61 1.56 -0.47 -4.78 117.12 109.69 1xup n MET 243 Ca 0.00 0.70 -0.12 0.00 -0.27 0.00 0.00 57.70 58.01 1xup n MET 243 Cb 0.00 -3.37 -0.08 0.00 2.15 0.00 0.00 33.22 31.92 1xup n MET 243 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1xup s ALA 244 N -3.19 0.80 0.34 -5.12 0.00 -0.43 -4.64 121.76 109.52 1xup s ALA 244 Ca 0.20 -1.49 -0.26 0.00 0.00 0.00 0.00 51.96 50.41 1xup s ALA 244 Cb -0.09 1.29 -0.10 0.00 0.00 0.00 0.00 23.12 24.23 1xup s ALA 244 CO 0.88 -0.69 0.99 0.20 0.00 0.00 0.00 175.76 177.14 1xup s GLY 245 N -3.15 2.82 0.13 0.00 0.00 -1.26 -1.37 107.32 104.49 1xup s GLY 245 Ca 0.34 0.62 -0.25 0.00 0.00 0.00 0.00 44.72 45.43 1xup s GLY 245 CO 0.13 1.08 1.44 -1.80 0.00 0.00 0.00 173.10 173.95 1xup h ASP 246 N 3.05 -1.73 -0.31 1.64 1.82 -0.54 0.67 116.42 121.01 1xup h ASP 246 Ca -0.47 0.26 -0.00 0.00 -0.39 0.00 0.00 57.03 56.43 1xup h ASP 246 Cb 1.20 0.76 -0.02 0.00 0.68 0.00 0.00 39.33 41.96 1xup h ASP 246 CO 0.64 -0.20 0.19 1.56 -1.61 0.00 0.00 179.24 179.83 1xup h GLN 247 N -0.02 0.44 -0.20 0.28 1.08 -1.93 -2.29 115.11 112.46 1xup h GLN 247 Ca 0.12 -0.03 -0.17 0.00 -1.45 0.00 0.00 58.65 57.12 1xup h GLN 247 Cb 0.34 -0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.67 1xup h GLN 247 CO -0.74 0.31 -0.57 1.96 -0.95 0.00 0.00 178.83 178.84 1xup h GLN 248 N 0.45 0.62 -0.49 1.46 7.50 -1.35 -2.78 115.11 120.53 1xup h GLN 248 Ca 0.12 -0.41 -0.09 0.00 0.50 0.00 0.00 58.65 58.77 1xup h GLN 248 Cb -0.01 0.05 -0.02 0.00 0.05 0.00 0.00 27.48 27.56 1xup h GLN 248 CO -0.02 1.02 -0.04 0.00 -1.50 0.00 0.00 178.83 178.29 1xup h ALA 249 N 0.89 0.66 -0.94 3.87 0.00 -0.55 -2.91 119.26 120.28 1xup h ALA 249 Ca 0.00 -0.31 0.05 0.00 0.00 0.00 0.00 54.91 54.66 1xup h ALA 249 Cb 1.13 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 1xup h ALA 249 CO 0.11 0.51 0.61 0.00 0.00 0.00 0.00 179.25 180.47 1xup h ALA 250 N 0.91 1.28 -0.22 0.00 0.00 -1.37 -1.16 119.26 118.71 1xup h ALA 250 Ca 0.13 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1xup h ALA 250 Cb 0.57 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 1xup h ALA 250 CO 0.03 0.42 -0.32 1.25 0.00 0.00 0.00 179.25 180.63 1xup h LEU 251 N 1.13 -1.08 0.00 0.00 5.85 -1.28 -2.94 115.31 117.00 1xup h LEU 251 Ca 0.40 0.14 -0.19 0.00 0.84 0.00 0.00 57.88 59.06 1xup h LEU 251 Cb 0.10 0.44 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 1xup h LEU 251 CO -0.15 -0.24 -1.13 2.19 -0.34 0.00 0.00 178.44 178.77 1xup h PHE 252 N -0.24 0.00 -0.88 1.25 -5.15 -1.62 -3.36 116.94 106.94 1xup h PHE 252 Ca 0.04 0.00 0.14 0.00 -0.20 0.00 0.00 57.97 57.95 1xup h PHE 252 Cb 0.35 0.00 -0.09 0.00 0.22 0.00 0.00 35.95 36.43 1xup h PHE 252 CO -0.66 0.79 0.48 0.78 -2.00 0.00 0.00 178.31 177.70 1xup h GLY 253 N 3.38 1.44 -4.96 6.09 0.00 -1.15 -3.19 103.07 104.69 1xup h GLY 253 Ca -0.10 -0.29 -0.64 0.00 0.00 0.00 0.00 47.33 46.30 1xup h GLY 253 CO 0.09 0.01 3.60 -1.06 0.00 0.00 0.00 176.54 179.17 1xup n GLN 254 N -4.81 3.57 -1.17 4.80 6.02 -1.12 -4.64 117.38 120.02 1xup n GLN 254 Ca 0.17 -2.11 -0.09 0.00 -0.01 0.00 0.00 57.00 54.96 1xup n GLN 254 Cb 0.42 -2.75 -0.04 0.00 1.02 0.00 0.00 30.24 28.89 1xup n GLN 254 CO 0.00 0.00 0.00 -0.12 -1.01 0.00 0.00 177.06 175.93 1xup n MET 255 N 3.54 -1.40 -1.75 -1.09 1.56 -1.22 -4.83 117.12 111.93 1xup n MET 255 Ca 0.76 0.59 -0.42 0.00 -0.27 0.00 0.00 57.70 58.36 1xup n MET 255 Cb 0.26 -4.68 -0.01 0.00 2.15 0.00 0.00 33.22 30.95 1xup n MET 255 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1xup n ALA 256 N 0.34 4.79 -2.48 -5.12 0.00 -1.21 -4.60 120.51 112.25 1xup n ALA 256 Ca -0.09 -3.75 -0.16 0.00 0.00 0.00 0.00 53.44 49.44 1xup n ALA 256 Cb 0.35 -3.56 0.02 0.00 0.00 0.00 0.00 19.45 16.26 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 6.88 2.22 -3.82 0.00 3.72 -1.26 -4.27 117.46 120.93 1xup n PHE 257 Ca 0.51 -2.56 -0.06 0.00 -0.05 0.00 0.00 57.45 55.29 1xup n PHE 257 Cb 0.40 -0.25 -0.00 0.00 -0.94 0.00 0.00 39.48 38.69 1xup n PHE 257 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1xup s GLU 258 N -3.53 1.61 0.51 -1.08 2.12 -1.26 -1.97 118.70 115.09 1xup s GLU 258 Ca 0.39 -0.95 -0.21 0.00 0.36 0.00 0.00 54.97 54.56 1xup s GLU 258 Cb 0.40 0.51 -0.06 0.00 0.26 0.00 0.00 34.13 35.23 1xup s GLU 258 CO -0.04 -0.74 1.17 0.15 -0.54 0.00 0.00 175.26 175.25 1xup s LYS 259 N -3.12 3.50 0.00 4.30 1.02 -1.26 -3.54 119.74 120.64 1xup s LYS 259 Ca 0.14 1.74 0.00 0.00 0.02 0.00 0.00 55.97 57.87 1xup s LYS 259 Cb -0.04 -2.20 0.00 0.00 -0.52 0.00 0.00 37.83 35.07 1xup s LYS 259 CO 0.06 -0.76 0.00 0.41 -0.92 0.00 0.00 175.35 174.15 1xup n GLY 260 N 0.36 0.31 3.65 -3.33 0.00 -1.23 -4.96 105.19 99.99 1xup n GLY 260 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 1xup n GLY 260 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xup s MET 261 N -0.89 4.08 0.12 1.61 -1.94 -1.23 -4.91 119.30 116.14 1xup s MET 261 Ca 0.00 1.47 0.08 0.00 -1.71 0.00 0.00 55.69 55.53 1xup s MET 261 Cb 0.00 -3.82 -0.04 0.00 2.01 0.00 0.00 34.83 32.98 1xup s MET 261 CO 0.00 -0.91 -0.20 0.96 -0.01 0.00 0.00 175.02 174.86 1xup s ILE 262 N 3.93 1.73 0.00 2.53 -0.00 -1.26 -3.36 121.20 124.77 1xup s ILE 262 Ca 0.56 -1.65 0.00 0.00 -0.00 0.00 0.00 60.65 59.56 1xup s ILE 262 Cb -0.19 -1.63 0.00 0.00 -0.00 0.00 0.00 42.46 40.64 1xup s ILE 262 CO 0.19 -0.14 0.00 2.29 -0.00 0.00 0.00 174.94 177.27 1xup n LYS 263 N 0.85 0.00 -3.60 0.37 -0.00 -1.24 -2.73 118.16 111.80 1xup n LYS 263 Ca -0.18 0.00 -0.11 0.00 -0.00 0.00 0.00 58.31 58.03 1xup n LYS 263 Cb 0.55 0.00 -0.06 0.00 -0.00 0.00 0.00 35.03 35.51 1xup n LYS 263 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 1xup s ASN 264 N -0.81 -0.46 -0.37 -5.58 3.84 0.22 -4.46 114.94 107.32 1xup s ASN 264 Ca 0.00 0.73 0.03 0.00 0.21 0.00 0.00 52.86 53.82 1xup s ASN 264 Cb 0.00 0.68 0.15 0.00 -0.55 0.00 0.00 41.25 41.53 1xup s ASN 264 CO 0.00 -0.27 0.36 -0.89 -2.79 0.00 0.00 177.10 173.51 1xup s THR 265 N -0.37 -0.29 -0.50 -5.21 2.01 -1.24 -2.11 115.64 107.93 1xup s THR 265 Ca -0.00 -1.04 -0.23 0.00 0.31 0.00 0.00 61.69 60.73 1xup s THR 265 Cb -0.03 -0.73 0.04 0.00 0.01 0.00 0.00 72.50 71.79 1xup s THR 265 CO -0.01 -0.62 0.83 -0.72 -0.69 0.00 0.00 174.62 173.41 1xup s TYR 266 N 1.44 2.92 0.00 4.92 -0.85 -1.24 -3.93 117.35 120.60 1xup s TYR 266 Ca 0.17 -0.01 0.00 0.00 -0.52 0.00 0.00 57.07 56.71 1xup s TYR 266 Cb -0.16 -3.82 0.00 0.00 0.38 0.00 0.00 41.96 38.36 1xup s TYR 266 CO -0.04 -1.15 0.00 0.41 -1.52 0.00 0.00 175.55 173.25 1xup n GLY 267 N 5.07 4.25 0.29 5.49 0.00 -1.26 -2.39 105.19 116.64 1xup n GLY 267 Ca 0.01 -0.47 0.15 0.00 0.00 0.00 0.00 46.02 45.71 1xup n GLY 267 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xup h THR 268 N 0.00 0.51 -3.18 2.61 2.02 -1.89 0.15 112.91 113.12 1xup h THR 268 Ca 0.00 -0.12 -0.15 0.00 0.77 0.00 0.00 66.41 66.91 1xup h THR 268 Cb 0.00 1.08 -0.24 0.00 -1.74 0.00 0.00 68.15 67.25 1xup h THR 268 CO 0.00 0.03 -0.41 -0.83 0.37 0.00 0.00 175.52 174.68 1xup s GLY 269 N -4.13 -0.14 -1.15 2.16 0.00 -1.26 -0.95 107.32 101.85 1xup s GLY 269 Ca -0.05 0.49 -0.09 0.00 0.00 0.00 0.00 44.72 45.07 1xup s GLY 269 CO 0.55 0.37 1.36 0.00 0.00 0.00 0.00 173.10 175.37 1xup n ALA 270 N 2.38 4.49 -2.65 3.20 0.00 -1.26 -4.49 120.51 122.18 1xup n ALA 270 Ca -0.16 -4.56 -0.38 0.00 0.00 0.00 0.00 53.44 48.34 1xup n ALA 270 Cb 0.57 -2.63 -0.09 0.00 0.00 0.00 0.00 19.45 17.30 1xup n ALA 270 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1xup s PHE 271 N -0.77 3.32 -0.12 0.00 0.40 -1.25 -4.75 117.98 114.80 1xup s PHE 271 Ca 0.35 0.39 0.02 0.00 -0.60 0.00 0.00 56.93 57.08 1xup s PHE 271 Cb -0.03 -2.43 -0.01 0.00 0.51 0.00 0.00 43.02 41.07 1xup s PHE 271 CO -0.01 -0.03 -0.18 0.42 0.70 0.00 0.00 175.22 176.12 1xup s ILE 272 N 1.39 2.59 0.08 0.64 1.09 -1.26 -3.66 121.20 122.07 1xup s ILE 272 Ca 0.13 -0.83 0.07 0.00 -1.10 0.00 0.00 60.65 58.92 1xup s ILE 272 Cb -0.15 -2.05 -0.03 0.00 -1.06 0.00 0.00 42.46 39.17 1xup s ILE 272 CO 0.07 0.54 -0.19 -0.69 -0.10 0.00 0.00 174.94 174.58 1xup s VAL 273 N 0.36 1.50 0.00 2.92 1.01 -1.26 -1.82 120.40 123.12 1xup s VAL 273 Ca -0.14 -1.39 0.00 0.00 0.00 0.00 0.00 61.98 60.44 1xup s VAL 273 Cb -0.17 -1.37 0.00 0.00 0.00 0.00 0.00 36.38 34.84 1xup s VAL 273 CO 0.07 -0.06 0.00 1.15 0.00 0.00 0.00 175.10 176.26 1xup n MET 274 N 1.30 2.84 -3.48 2.72 0.00 -1.08 -3.71 117.12 115.72 1xup n MET 274 Ca -0.20 0.00 -0.29 0.00 0.00 0.00 0.00 57.70 57.21 1xup n MET 274 Cb 0.54 0.00 -0.13 0.00 0.00 0.00 0.00 33.22 33.63 1xup n MET 274 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 1xup s ASN 275 N -0.18 3.10 -0.68 3.17 3.84 -1.21 -4.67 114.94 118.31 1xup s ASN 275 Ca 0.00 -1.97 -0.01 0.00 0.21 0.00 0.00 52.86 51.09 1xup s ASN 275 Cb 0.00 -0.39 0.41 0.00 -0.55 0.00 0.00 41.25 40.73 1xup s ASN 275 CO 0.00 -0.34 1.88 0.35 -2.79 0.00 0.00 177.10 176.20 1xup n THR 276 N 4.33 3.41 0.00 -5.21 -2.24 -1.14 -3.51 114.28 109.93 1xup n THR 276 Ca 0.08 -3.70 0.00 0.00 -2.27 0.00 0.00 64.05 58.16 1xup n THR 276 Cb 0.38 -1.19 0.00 0.00 -2.10 0.00 0.00 70.33 67.42 1xup n THR 276 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xup n GLY 277 N -0.73 3.50 2.67 3.38 0.00 -1.25 -2.32 105.19 110.44 1xup n GLY 277 Ca 0.56 -0.04 -0.32 0.00 0.00 0.00 0.00 46.02 46.22 1xup n GLY 277 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xup n GLU 278 N 14.00 3.17 -3.88 1.61 1.02 -1.26 -0.74 120.64 134.56 1xup n GLU 278 Ca 0.00 -4.11 -0.34 0.00 -0.02 0.00 0.00 57.16 52.69 1xup n GLU 278 Cb 0.00 -2.26 -0.13 0.00 -0.02 0.00 0.00 31.44 29.03 1xup n GLU 278 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1xup s GLU 279 N -3.77 1.81 -0.91 3.49 0.41 -0.98 -4.83 118.70 113.92 1xup s GLU 279 Ca 0.50 -1.82 -0.15 0.00 -0.41 0.00 0.00 54.97 53.09 1xup s GLU 279 Cb 0.41 -3.42 -0.10 0.00 -1.78 0.00 0.00 34.13 29.25 1xup s GLU 279 CO -0.28 -1.00 2.05 -2.30 -0.49 0.00 0.00 175.26 173.24 1xup n PRO 280 N 4.46 1.91 -1.69 0.39 -0.02 -1.26 -4.28 135.00 134.50 1xup n PRO 280 Ca -0.00 -1.76 -0.16 0.00 -2.02 0.00 0.00 63.50 59.55 1xup n PRO 280 Cb 0.42 -2.76 0.09 0.00 -0.02 0.00 0.00 33.50 31.23 1xup n PRO 280 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xup n GLN 281 N 5.73 -0.14 -3.70 -0.52 10.64 -1.26 -5.05 117.38 123.08 1xup n GLN 281 Ca 0.49 -1.64 -0.14 0.00 -1.83 0.00 0.00 57.00 53.88 1xup n GLN 281 Cb 0.29 -0.56 -0.09 0.00 -0.86 0.00 0.00 30.24 29.02 1xup n GLN 281 CO 0.00 0.00 0.00 -0.48 -1.83 0.00 0.00 177.06 174.75 1xup s LEU 282 N 0.00 0.13 -0.59 2.61 2.34 -1.26 -4.78 118.68 117.14 1xup s LEU 282 Ca 0.45 0.90 -0.22 0.00 0.06 0.00 0.00 54.13 55.31 1xup s LEU 282 Cb -0.02 1.71 0.06 0.00 -0.56 0.00 0.00 46.19 47.37 1xup s LEU 282 CO 0.30 -0.22 0.87 -0.44 -1.06 0.00 0.00 176.35 175.80 1xup s SER 283 N 0.03 6.24 0.62 1.48 0.01 -1.26 -4.89 113.70 115.93 1xup s SER 283 Ca -0.02 -0.78 0.23 0.00 1.31 0.00 0.00 55.95 56.70 1xup s SER 283 Cb -0.03 -2.39 0.98 0.00 0.21 0.00 0.00 66.02 64.79 1xup s SER 283 CO 0.02 -1.24 1.46 -2.24 0.41 0.00 0.00 173.24 171.65 1xup h ASP 284 N 9.34 0.00 0.00 2.44 2.03 -1.96 -1.85 116.42 126.42 1xup h ASP 284 Ca -0.28 0.00 -0.52 0.00 -0.73 0.00 0.00 57.03 55.50 1xup h ASP 284 Cb 1.08 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 39.60 1xup h ASP 284 CO 1.10 0.00 3.18 0.59 -1.03 0.00 0.00 179.24 183.08 1xup n ASN 285 N -3.21 6.57 -1.55 4.15 4.13 -1.26 -4.54 115.26 119.55 1xup n ASN 285 Ca 0.14 -2.45 -0.19 0.00 1.68 0.00 0.00 54.58 53.75 1xup n ASN 285 Cb 1.13 -1.32 -0.07 0.00 -1.54 0.00 0.00 39.78 37.98 1xup n ASN 285 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1xup n ASP 286 N 4.05 -5.34 -4.89 6.41 8.00 -1.22 -4.90 116.55 118.66 1xup n ASP 286 Ca 0.60 0.42 -0.27 0.00 0.71 0.00 0.00 54.79 56.26 1xup n ASP 286 Cb 0.19 -4.52 -0.04 0.00 -0.02 0.00 0.00 41.12 36.73 1xup n ASP 286 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xup s LEU 287 N -4.50 4.15 0.00 0.64 1.43 -0.70 -4.47 118.68 115.23 1xup s LEU 287 Ca 0.00 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.18 1xup s LEU 287 Cb 0.00 -2.74 0.00 0.00 0.03 0.00 0.00 46.19 43.48 1xup s LEU 287 CO 0.00 0.07 0.00 0.18 0.23 0.00 0.00 176.35 176.83 1xup n LEU 288 N -0.40 0.00 -4.17 1.79 4.77 -1.26 -4.37 117.00 113.35 1xup n LEU 288 Ca -0.07 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.80 1xup n LEU 288 Cb 0.54 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.53 1xup n LEU 288 CO 0.47 0.00 -0.38 -0.89 -1.33 0.00 0.00 177.39 175.26 1xup s THR 289 N 0.92 0.65 0.13 -5.08 2.01 -1.26 -4.33 115.64 108.68 1xup s THR 289 Ca 0.00 -1.93 -0.10 0.00 0.31 0.00 0.00 61.69 59.97 1xup s THR 289 Cb 0.00 -1.72 0.04 0.00 0.01 0.00 0.00 72.50 70.83 1xup s THR 289 CO 0.00 -0.84 0.49 1.07 -0.69 0.00 0.00 174.62 174.65 1xup n THR 290 N -0.05 0.00 -4.59 -0.82 5.66 -1.05 -4.82 114.28 108.61 1xup n THR 290 Ca -0.12 -0.36 -0.27 0.00 -3.05 0.00 0.00 64.05 60.26 1xup n THR 290 Cb 0.61 0.43 -0.11 0.00 -1.55 0.00 0.00 70.33 69.71 1xup n THR 290 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 1xup s ILE 291 N -2.39 1.94 0.00 1.09 -0.00 -1.26 -2.86 121.20 117.72 1xup s ILE 291 Ca 0.10 -2.03 0.00 0.00 -0.00 0.00 0.00 60.65 58.73 1xup s ILE 291 Cb -0.02 -2.92 0.00 0.00 -0.00 0.00 0.00 42.46 39.52 1xup s ILE 291 CO 0.04 -0.03 0.00 0.61 -0.00 0.00 0.00 174.94 175.56 1xup n GLY 292 N -0.91 4.55 3.39 6.27 0.00 -0.12 -4.52 105.19 113.85 1xup n GLY 292 Ca -0.05 -1.22 -0.10 0.00 0.00 0.00 0.00 46.02 44.66 1xup n GLY 292 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xup s TYR 293 N -1.55 0.27 0.00 1.61 1.51 -1.26 -0.78 117.35 117.15 1xup s TYR 293 Ca 0.00 -0.63 0.00 0.00 -1.01 0.00 0.00 57.07 55.43 1xup s TYR 293 Cb 0.00 0.06 0.00 0.00 -0.11 0.00 0.00 41.96 41.91 1xup s TYR 293 CO 0.00 -0.77 0.00 0.41 -1.11 0.00 0.00 175.55 174.08 1xup n GLY 294 N -0.25 1.18 5.82 0.71 0.00 -1.26 -4.54 105.19 106.86 1xup n GLY 294 Ca -0.08 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1xup n GLY 294 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1xup n ILE 295 N -0.18 0.00 -3.24 -0.61 5.41 -0.83 -4.52 119.36 115.39 1xup n ILE 295 Ca 0.00 0.00 -0.20 0.00 1.00 0.00 0.00 62.75 63.55 1xup n ILE 295 Cb 0.00 0.00 0.02 0.00 -0.71 0.00 0.00 39.64 38.95 1xup n ILE 295 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 1xup s ASN 296 N -4.00 5.20 -0.83 4.38 -0.87 -1.26 -4.59 114.94 112.97 1xup s ASN 296 Ca 0.00 -0.75 -0.25 0.00 -1.57 0.00 0.00 52.86 50.29 1xup s ASN 296 Cb 0.00 -0.13 -0.19 0.00 -0.02 0.00 0.00 41.25 40.91 1xup s ASN 296 CO 0.00 -1.01 1.90 0.61 -2.57 0.00 0.00 177.10 176.03 1xup n GLY 297 N -1.94 1.02 3.20 0.66 0.00 -1.26 -4.81 105.19 102.07 1xup n GLY 297 Ca 0.09 -0.73 -0.11 0.00 0.00 0.00 0.00 46.02 45.27 1xup n GLY 297 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xup s LYS 298 N 6.61 0.71 -0.15 1.61 -2.85 -1.26 -4.97 119.74 119.43 1xup s LYS 298 Ca 0.68 -0.52 -0.26 0.00 -1.00 0.00 0.00 55.97 54.87 1xup s LYS 298 Cb 0.05 0.30 -0.02 0.00 -2.06 0.00 0.00 37.83 36.11 1xup s LYS 298 CO 0.18 -0.21 0.85 0.08 0.10 0.00 0.00 175.35 176.35 1xup s VAL 299 N -2.31 4.88 0.22 1.79 1.01 -1.26 -3.98 120.40 120.74 1xup s VAL 299 Ca -0.07 1.68 0.03 0.00 0.00 0.00 0.00 61.98 63.62 1xup s VAL 299 Cb -0.02 -4.16 0.03 0.00 0.00 0.00 0.00 36.38 32.23 1xup s VAL 299 CO -0.02 0.04 0.25 -1.22 0.00 0.00 0.00 175.10 174.15 1xup n TYR 300 N 5.09 -2.05 -4.21 5.22 4.02 0.04 -4.95 117.16 120.32 1xup n TYR 300 Ca 0.05 -0.86 -0.20 0.00 -0.01 0.00 0.00 57.90 56.88 1xup n TYR 300 Cb 0.49 -0.20 -0.12 0.00 -0.02 0.00 0.00 39.34 39.49 1xup n TYR 300 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1xup s TYR 301 N -0.69 1.37 0.26 -0.72 2.02 0.08 -0.95 117.35 118.72 1xup s TYR 301 Ca 0.19 -0.46 -0.16 0.00 -0.37 0.00 0.00 57.07 56.26 1xup s TYR 301 Cb -0.01 -0.76 0.06 0.00 -0.40 0.00 0.00 41.96 40.85 1xup s TYR 301 CO 0.12 0.10 0.82 0.00 -1.57 0.00 0.00 175.55 175.02 1xup n ALA 302 N 1.14 -2.01 -2.22 3.71 0.00 -1.14 -2.89 120.51 117.10 1xup n ALA 302 Ca -0.20 -1.03 -0.21 0.00 0.00 0.00 0.00 53.44 52.00 1xup n ALA 302 Cb 0.54 0.71 -0.02 0.00 0.00 0.00 0.00 19.45 20.68 1xup n ALA 302 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xup s LEU 303 N 0.00 3.31 0.00 0.00 1.43 -1.26 -2.53 118.68 119.63 1xup s LEU 303 Ca 0.17 -0.80 0.02 0.00 -1.03 0.00 0.00 54.13 52.49 1xup s LEU 303 Cb -0.03 -1.95 -0.01 0.00 0.03 0.00 0.00 46.19 44.23 1xup s LEU 303 CO 0.08 -0.74 0.42 -1.84 0.23 0.00 0.00 176.35 174.50 1xup n GLU 304 N -1.61 0.60 -4.13 1.70 0.28 -1.26 -2.62 120.64 113.60 1xup n GLU 304 Ca 0.04 -3.02 -0.35 0.00 -0.16 0.00 0.00 57.16 53.66 1xup n GLU 304 Cb 0.62 2.74 -0.09 0.00 1.43 0.00 0.00 31.44 36.14 1xup n GLU 304 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1xup s GLY 305 N -3.25 1.93 -0.75 -1.84 0.00 -0.75 -4.49 107.32 98.16 1xup s GLY 305 Ca 0.33 -0.75 -0.20 0.00 0.00 0.00 0.00 44.72 44.11 1xup s GLY 305 CO 0.24 -0.26 0.94 -1.35 0.00 0.00 0.00 173.10 172.66 1xup s SER 306 N -0.37 6.37 0.04 1.64 1.04 -1.26 -4.67 113.70 116.49 1xup s SER 306 Ca 0.09 -1.59 0.05 0.00 0.48 0.00 0.00 55.95 54.97 1xup s SER 306 Cb -0.12 -2.37 -0.02 0.00 0.10 0.00 0.00 66.02 63.61 1xup s SER 306 CO 0.02 -1.16 -0.15 -0.51 0.98 0.00 0.00 173.24 172.41 1xup s ILE 307 N 2.95 1.20 -0.10 -1.02 1.10 -1.26 -2.04 121.20 122.02 1xup s ILE 307 Ca 0.23 -1.03 -0.03 0.00 -0.51 0.00 0.00 60.65 59.31 1xup s ILE 307 Cb -0.14 -1.08 -0.01 0.00 0.15 0.00 0.00 42.46 41.38 1xup s ILE 307 CO 0.01 0.04 -0.05 0.15 -2.11 0.00 0.00 174.94 172.97 1xup h PHE 308 N 4.92 0.00 -3.80 3.50 3.57 -1.93 -3.47 116.94 119.72 1xup h PHE 308 Ca -0.39 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 60.99 1xup h PHE 308 Cb 1.18 0.00 -0.09 0.00 2.79 0.00 0.00 35.95 39.83 1xup h PHE 308 CO 0.53 0.00 -0.15 0.14 -2.23 0.00 0.00 178.31 176.59 1xup s VAL 309 N -1.68 0.00 0.00 1.41 -7.23 -1.26 -4.91 120.40 106.73 1xup s VAL 309 Ca -0.04 -1.48 0.00 0.00 -1.81 0.00 0.00 61.98 58.65 1xup s VAL 309 Cb 0.01 -2.37 0.00 0.00 0.56 0.00 0.00 36.38 34.58 1xup s VAL 309 CO 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.86 1xup n ALA 310 N -0.42 1.83 0.71 1.32 0.00 -0.12 -4.73 120.51 119.10 1xup n ALA 310 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1xup n ALA 310 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 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 0.57 -0.35 0.26 0.00 0.00 0.51 -2.94 105.19 103.25 1xup n GLY 311 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1xup n GLY 311 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1xup h SER 312 N 0.01 0.95 -0.79 1.61 0.02 -1.83 -2.57 113.55 110.94 1xup h SER 312 Ca 0.00 -0.44 0.01 0.00 -0.84 0.00 0.00 61.79 60.52 1xup h SER 312 Cb 0.00 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.24 1xup h SER 312 CO 0.00 1.22 0.52 0.00 -1.14 0.00 0.00 176.83 177.43 1xup h ALA 313 N 0.82 1.42 -0.27 3.77 0.00 -1.92 0.13 119.26 123.22 1xup h ALA 313 Ca 0.06 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1xup h ALA 313 Cb 0.98 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1xup h ALA 313 CO 0.09 0.53 -0.22 0.82 0.00 0.00 0.00 179.25 180.47 1xup h ILE 314 N 1.07 1.31 0.00 0.00 2.04 -1.77 -2.88 117.51 117.28 1xup h ILE 314 Ca 0.29 -1.37 -0.02 0.00 1.00 0.00 0.00 64.86 64.76 1xup h ILE 314 Cb -0.11 1.60 -0.00 0.00 -0.74 0.00 0.00 36.82 37.57 1xup h ILE 314 CO -0.06 0.43 -0.11 -0.61 0.00 0.00 0.00 178.15 177.80 1xup h GLN 315 N 0.34 0.00 0.14 2.37 4.15 -1.08 -3.32 115.11 117.71 1xup h GLN 315 Ca 0.05 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.46 1xup h GLN 315 Cb 0.77 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.46 1xup h GLN 315 CO 0.06 0.11 -0.07 2.35 -1.93 0.00 0.00 178.83 179.35 1xup h TRP 316 N 0.00 -0.17 -0.81 3.99 7.01 -0.53 -3.26 115.95 122.16 1xup h TRP 316 Ca -0.00 -0.00 0.15 0.00 2.11 0.00 0.00 58.89 61.14 1xup h TRP 316 Cb 0.67 0.06 -0.10 0.00 -2.10 0.00 0.00 29.16 27.69 1xup h TRP 316 CO 0.00 -0.11 0.38 1.37 -2.79 0.00 0.00 178.44 177.29 1xup h LEU 317 N -0.25 0.43 -2.19 0.65 -0.00 -1.66 0.43 115.31 112.73 1xup h LEU 317 Ca -0.02 0.10 0.06 0.00 -0.00 0.00 0.00 57.88 58.02 1xup h LEU 317 Cb 0.14 0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 40.84 1xup h LEU 317 CO 0.03 0.17 0.22 0.08 -0.00 0.00 0.00 178.44 178.94 1xup h ARG 318 N 0.55 0.00 -0.79 0.17 0.11 -1.69 0.44 114.38 113.17 1xup h ARG 318 Ca 0.45 0.00 -0.53 0.00 0.10 0.00 0.00 59.98 59.99 1xup h ARG 318 Cb 0.66 0.00 -0.31 0.00 1.11 0.00 0.00 29.97 31.43 1xup h ARG 318 CO -0.38 0.00 0.05 -0.25 0.10 0.00 0.00 179.97 179.49 1xup n ASP 319 N -3.89 5.49 0.00 0.08 10.43 0.13 -4.49 116.55 124.30 1xup n ASP 319 Ca 0.02 -3.77 0.00 0.00 2.57 0.00 0.00 54.79 53.62 1xup n ASP 319 Cb 0.35 -0.67 0.00 0.00 1.84 0.00 0.00 41.12 42.64 1xup n ASP 319 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1xup n GLY 320 N -0.89 -1.50 2.98 0.44 0.00 0.47 -4.99 105.19 101.71 1xup n GLY 320 Ca 0.50 0.67 -0.42 0.00 0.00 0.00 0.00 46.02 46.76 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 6.31 0.00 0.99 4.77 0.13 -4.81 117.00 124.38 1xup n LEU 321 Ca 0.00 -4.16 0.00 0.00 -0.03 0.00 0.00 56.01 51.82 1xup n LEU 321 Cb 0.00 -1.66 0.00 0.00 -2.33 0.00 0.00 43.42 39.43 1xup n LEU 321 CO 0.00 0.89 0.45 0.54 -1.33 0.00 0.00 177.39 177.94 1xup n ARG 322 N 6.38 0.00 0.00 3.23 1.74 -0.65 -4.25 116.66 123.11 1xup n ARG 322 Ca 0.49 0.64 0.00 0.00 -0.77 0.00 0.00 57.85 58.21 1xup n ARG 322 Cb 0.41 -1.39 0.00 0.00 -1.02 0.00 0.00 32.46 30.45 1xup n ARG 322 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1xup n MET 323 N -2.11 0.00 0.00 5.56 2.81 -1.26 -2.70 117.12 119.42 1xup n MET 323 Ca 0.00 0.00 0.07 0.00 -1.81 0.00 0.00 57.70 55.96 1xup n MET 323 Cb 0.00 0.00 0.37 0.00 -0.71 0.00 0.00 33.22 32.88 1xup n MET 323 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 1xup n ILE 324 N 0.00 0.39 0.00 2.02 -5.35 -1.26 -4.90 119.36 110.25 1xup n ILE 324 Ca 0.00 0.10 0.00 0.00 -0.27 0.00 0.00 62.75 62.58 1xup n ILE 324 Cb 0.00 -0.87 0.00 0.00 -1.74 0.00 0.00 39.64 37.03 1xup n ILE 324 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1xup n GLU 325 N -1.18 0.00 -4.11 6.28 4.71 -1.10 -4.80 120.64 120.44 1xup n GLU 325 Ca 0.08 0.00 -0.31 0.00 -0.01 0.00 0.00 57.16 56.93 1xup n GLU 325 Cb 0.09 0.00 -0.07 0.00 -1.01 0.00 0.00 31.44 30.44 1xup n GLU 325 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 1xup s THR 326 N 0.00 4.23 0.11 2.62 -4.23 -1.26 -4.89 115.64 112.23 1xup s THR 326 Ca 0.00 -0.86 -0.03 0.00 -1.18 0.00 0.00 61.69 59.62 1xup s THR 326 Cb 0.00 -3.01 -0.22 0.00 1.34 0.00 0.00 72.50 70.61 1xup s THR 326 CO 0.00 0.15 1.25 0.77 -0.54 0.00 0.00 174.62 176.25 1xup h SER 327 N 3.48 0.43 0.00 3.99 4.64 -1.92 -3.26 113.55 120.92 1xup h SER 327 Ca -0.47 -0.40 0.00 0.00 -0.47 0.00 0.00 61.79 60.45 1xup h SER 327 Cb 1.17 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1xup h SER 327 CO 0.62 1.24 0.01 -2.65 -0.87 0.00 0.00 176.83 175.18 1xup n PRO 328 N -3.64 0.00 0.03 4.77 -0.02 -1.26 -2.81 135.00 132.07 1xup n PRO 328 Ca -0.07 0.05 0.22 0.00 -2.02 0.00 0.00 63.50 61.68 1xup n PRO 328 Cb 0.91 -1.51 0.73 0.00 -0.02 0.00 0.00 33.50 33.61 1xup n PRO 328 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1xup h GLN 329 N 0.00 0.00 -1.01 -0.52 5.75 -1.93 -1.01 115.11 116.39 1xup h GLN 329 Ca 0.00 0.00 0.24 0.00 -0.15 0.00 0.00 58.65 58.74 1xup h GLN 329 Cb 0.01 0.00 -0.10 0.00 1.07 0.00 0.00 27.48 28.47 1xup h GLN 329 CO 0.00 0.00 0.64 0.77 -2.65 0.00 0.00 178.83 177.59 1xup h SER 330 N 0.00 0.54 -0.13 -0.69 0.02 -1.84 0.16 113.55 111.62 1xup h SER 330 Ca 0.25 0.09 -0.22 0.00 -0.84 0.00 0.00 61.79 61.06 1xup h SER 330 Cb 1.26 -0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.81 1xup h SER 330 CO -0.00 0.14 -0.79 -0.08 -1.14 0.00 0.00 176.83 174.96 1xup h GLU 331 N 0.50 0.78 0.00 3.45 4.22 -1.49 -3.37 114.58 118.67 1xup h GLU 331 Ca 0.58 -0.65 0.00 0.00 0.08 0.00 0.00 59.36 59.37 1xup h GLU 331 Cb 1.29 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.68 1xup h GLU 331 CO -0.32 1.25 0.00 0.39 -2.18 0.00 0.00 179.01 178.15 1xup n GLU 332 N -3.93 0.00 -1.81 1.92 1.02 0.54 -4.63 120.64 113.74 1xup n GLU 332 Ca -0.07 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 56.81 1xup n GLU 332 Cb 0.75 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 32.09 1xup n GLU 332 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1xup n LEU 333 N 0.00 2.51 0.00 -4.62 4.32 -1.13 -2.50 117.00 115.59 1xup n LEU 333 Ca 0.00 -2.90 0.00 0.00 -0.02 0.00 0.00 56.01 53.09 1xup n LEU 333 Cb 0.00 -1.67 0.00 0.00 -1.62 0.00 0.00 43.42 40.13 1xup n LEU 333 CO 0.00 -2.35 0.00 0.00 -1.22 0.00 0.00 177.39 173.82 1xup n ALA 334 N 15.67 0.00 0.20 -1.18 0.00 -1.26 -4.82 120.51 129.12 1xup n ALA 334 Ca 0.44 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.71 1xup n ALA 334 Cb 0.46 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.82 1xup n ALA 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xup h ALA 335 N 0.00 -1.04 0.00 0.00 0.00 -1.65 -2.59 119.26 113.98 1xup h ALA 335 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1xup h ALA 335 Cb 0.00 0.80 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1xup h ALA 335 CO 0.00 -1.14 0.00 0.36 0.00 0.00 0.00 179.25 178.47 1xup n LYS 336 N -5.52 0.72 0.00 0.00 -0.00 -1.26 -4.07 118.16 108.03 1xup n LYS 336 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.21 1xup n LYS 336 Cb 0.43 -1.18 0.00 0.00 -0.00 0.00 0.00 35.03 34.29 1xup n LYS 336 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1xup n ALA 337 N -0.68 2.34 -0.77 0.58 0.00 -0.98 -4.93 120.51 116.08 1xup n ALA 337 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1xup n ALA 337 Cb 0.03 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1xup n ALA 337 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xup n LYS 338 N 0.47 0.00 -3.60 0.00 4.76 -1.26 -4.79 118.16 113.74 1xup n LYS 338 Ca 0.00 0.00 -0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1xup n LYS 338 Cb 0.38 0.00 0.01 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 0.49 0.39 0.72 0.00 -1.26 -5.06 105.19 100.47 1xup n GLY 339 Ca 0.00 -1.07 -0.15 0.00 0.00 0.00 0.00 46.02 44.80 1xup n GLY 339 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1xup h ASP 340 N 1.70 -1.06 -3.75 1.61 3.58 -1.89 -3.48 116.42 113.13 1xup h ASP 340 Ca -0.21 0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.35 1xup h ASP 340 Cb 1.02 0.38 0.00 0.00 1.72 0.00 0.00 39.33 42.45 1xup h ASP 340 CO 0.29 -0.49 -0.06 -3.20 -2.88 0.00 0.00 179.24 172.90 1xup n ASN 341 N -5.46 -3.88 0.00 2.28 5.15 -1.26 -4.29 115.26 107.80 1xup n ASN 341 Ca -0.08 0.05 0.00 0.00 -0.60 0.00 0.00 54.58 53.95 1xup n ASN 341 Cb 0.37 -2.39 0.00 0.00 -0.53 0.00 0.00 39.78 37.23 1xup n ASN 341 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 1xup n GLU 342 N -0.93 0.00 -1.79 1.20 0.28 -1.26 -4.88 120.64 113.26 1xup n GLU 342 Ca 0.02 0.00 -0.38 0.00 -0.16 0.00 0.00 57.16 56.63 1xup n GLU 342 Cb 0.36 -3.39 -0.04 0.00 1.43 0.00 0.00 31.44 29.80 1xup n GLU 342 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1xup n VAL 343 N -1.39 2.48 -2.64 3.84 0.31 -1.26 -4.49 118.33 115.19 1xup n VAL 343 Ca 0.00 -2.39 -0.43 0.00 -0.01 0.00 0.00 64.34 61.51 1xup n VAL 343 Cb 0.00 -2.32 0.00 0.00 -0.91 0.00 0.00 33.84 30.61 1xup n VAL 343 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1xup n TYR 344 N 9.67 4.62 -2.32 3.52 4.01 -1.26 -4.86 117.16 130.54 1xup n TYR 344 Ca 0.48 -3.03 -0.35 0.00 -0.16 0.00 0.00 57.90 54.85 1xup n TYR 344 Cb 0.43 -2.45 -0.04 0.00 -0.31 0.00 0.00 39.34 36.98 1xup n TYR 344 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1xup s VAL 345 N 3.06 3.74 -0.09 -0.72 1.01 -1.26 -4.79 120.40 121.34 1xup s VAL 345 Ca 0.49 -0.85 -0.29 0.00 0.00 0.00 0.00 61.98 61.32 1xup s VAL 345 Cb 0.03 -4.66 -0.06 0.00 0.00 0.00 0.00 36.38 31.69 1xup s VAL 345 CO 0.04 -1.47 1.79 0.68 0.00 0.00 0.00 175.10 176.13 1xup s VAL 346 N 7.52 3.40 -0.44 2.92 -7.23 -1.26 -4.80 120.40 120.50 1xup s VAL 346 Ca 0.59 0.47 -0.13 0.00 -1.81 0.00 0.00 61.98 61.10 1xup s VAL 346 Cb -0.02 -3.36 -0.12 0.00 0.56 0.00 0.00 36.38 33.45 1xup s VAL 346 CO -0.00 -0.10 1.46 -2.65 -0.31 0.00 0.00 175.10 173.50 1xup n PRO 347 N 7.55 0.04 -3.60 4.82 -0.02 -1.26 -4.58 135.00 137.94 1xup n PRO 347 Ca 0.20 -0.76 -0.39 0.00 -2.02 0.00 0.00 63.50 60.53 1xup n PRO 347 Cb 0.43 -2.30 -0.07 0.00 -0.02 0.00 0.00 33.50 31.55 1xup n PRO 347 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xup s ALA 348 N 7.78 3.79 -0.13 3.55 0.00 -1.26 -4.70 121.76 130.79 1xup s ALA 348 Ca 0.38 -3.35 -0.10 0.00 0.00 0.00 0.00 51.96 48.89 1xup s ALA 348 Cb -0.01 -2.92 -0.08 0.00 0.00 0.00 0.00 23.12 20.11 1xup s ALA 348 CO 0.10 -2.16 0.14 0.74 0.00 0.00 0.00 175.76 174.57 1xup h PHE 349 N 7.13 0.00 -2.93 0.00 0.04 -1.93 -0.89 116.94 118.37 1xup h PHE 349 Ca 0.04 0.00 -0.57 0.00 2.80 0.00 0.00 57.97 60.23 1xup h PHE 349 Cb 0.96 0.00 -0.40 0.00 2.20 0.00 0.00 35.95 38.71 1xup h PHE 349 CO 0.80 0.35 -0.78 0.95 -0.60 0.00 0.00 178.31 179.04 1xup s THR 350 N -1.92 0.56 0.00 -1.55 -4.23 -1.26 -3.65 115.64 103.60 1xup s THR 350 Ca -0.10 -1.44 0.00 0.00 -1.18 0.00 0.00 61.69 58.97 1xup s THR 350 Cb 0.00 -1.43 0.00 0.00 1.34 0.00 0.00 72.50 72.42 1xup s THR 350 CO 0.25 -0.78 0.00 0.61 -0.54 0.00 0.00 174.62 174.16 1xup n GLY 351 N 4.64 -1.05 0.34 3.99 0.00 -0.50 -4.30 105.19 108.31 1xup n GLY 351 Ca 0.01 -1.64 -0.16 0.00 0.00 0.00 0.00 46.02 44.23 1xup n GLY 351 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xup n LEU 352 N -1.80 1.59 0.00 0.99 4.32 -0.42 -4.42 117.00 117.26 1xup n LEU 352 Ca 0.00 0.27 0.00 0.00 -0.02 0.00 0.00 56.01 56.26 1xup n LEU 352 Cb 0.00 -0.63 0.00 0.00 -1.62 0.00 0.00 43.42 41.17 1xup n LEU 352 CO 0.00 0.09 0.00 0.61 -1.22 0.00 0.00 177.39 176.87 1xup n GLY 353 N 1.80 -0.28 7.00 -0.72 0.00 -0.41 -4.37 105.19 108.22 1xup n GLY 353 Ca -0.28 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.62 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 -0.60 0.00 1.46 4.61 0.00 -0.87 -0.17 120.51 124.95 1xup n ALA 354 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 1xup n ALA 354 Cb 0.00 0.00 0.73 0.00 0.00 0.00 0.00 19.45 20.18 1xup n ALA 354 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1xup n PRO 355 N -0.66 0.61 -0.04 0.00 -0.02 -1.26 -2.88 135.00 130.74 1xup n PRO 355 Ca 0.00 0.02 0.03 0.00 -2.02 0.00 0.00 63.50 61.53 1xup n PRO 355 Cb 0.00 -1.50 -0.16 0.00 -0.02 0.00 0.00 33.50 31.82 1xup n PRO 355 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1xup n TYR 356 N -1.15 0.00 0.00 6.00 4.01 -1.22 -4.86 117.16 119.95 1xup n TYR 356 Ca 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.90 1xup n TYR 356 Cb 0.15 -0.64 0.00 0.00 -0.31 0.00 0.00 39.34 38.55 1xup n TYR 356 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 1xup n TRP 357 N -2.39 0.00 -1.95 -0.72 7.02 0.75 -4.76 117.44 115.39 1xup n TRP 357 Ca -0.14 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.32 1xup n TRP 357 Cb 0.74 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.64 1xup n TRP 357 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1xup n ASP 358 N 0.70 -3.95 -0.35 -0.99 9.92 -1.26 -1.28 116.55 119.33 1xup n ASP 358 Ca 0.00 0.15 0.00 0.00 -0.53 0.00 0.00 54.79 54.41 1xup n ASP 358 Cb 0.00 -2.44 0.00 0.00 -0.64 0.00 0.00 41.12 38.04 1xup n ASP 358 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1xup n SER 359 N -0.53 0.59 0.00 -2.24 7.64 -1.26 -3.58 113.62 114.24 1xup n SER 359 Ca 0.03 -1.69 0.00 0.00 1.01 0.00 0.00 58.87 58.23 1xup n SER 359 Cb 0.19 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.10 1xup n SER 359 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1xup n GLU 360 N -0.10 2.81 -2.43 1.43 0.00 -1.26 -4.91 120.64 116.19 1xup n GLU 360 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 57.16 56.73 1xup n GLU 360 Cb 0.15 -0.31 -0.02 0.00 0.00 0.00 0.00 31.44 31.25 1xup n GLU 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1xup s ALA 361 N -0.25 3.52 -0.17 -1.84 0.00 -1.23 -4.92 121.76 116.86 1xup s ALA 361 Ca 0.00 0.28 -0.00 0.00 0.00 0.00 0.00 51.96 52.24 1xup s ALA 361 Cb 0.00 -3.69 0.01 0.00 0.00 0.00 0.00 23.12 19.43 1xup s ALA 361 CO 0.00 -1.46 -0.15 0.50 0.00 0.00 0.00 175.76 174.64 1xup s ARG 362 N 3.82 3.15 0.00 0.00 3.52 -1.26 -1.40 118.95 126.78 1xup s ARG 362 Ca 0.55 -0.76 0.00 0.00 -0.13 0.00 0.00 55.73 55.39 1xup s ARG 362 Cb -0.19 -2.66 0.00 0.00 -1.56 0.00 0.00 34.95 30.54 1xup s ARG 362 CO 0.18 -0.09 0.00 0.41 -0.81 0.00 0.00 175.30 174.99 1xup n GLY 363 N 4.36 -2.06 3.14 8.12 0.00 -0.34 -4.98 105.19 113.44 1xup n GLY 363 Ca -0.20 -1.30 0.01 0.00 0.00 0.00 0.00 46.02 44.53 1xup n GLY 363 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xup s ALA 364 N -2.71 -2.23 -0.01 4.61 0.00 -1.25 -4.94 121.76 115.22 1xup s ALA 364 Ca 0.00 0.61 -0.03 0.00 0.00 0.00 0.00 51.96 52.55 1xup s ALA 364 Cb 0.00 -2.56 -0.01 0.00 0.00 0.00 0.00 23.12 20.55 1xup s ALA 364 CO 0.00 -1.98 0.31 0.28 0.00 0.00 0.00 175.76 174.37 1xup h VAL 365 N 5.61 0.00 -1.94 0.00 2.07 -1.94 -3.37 116.25 116.68 1xup h VAL 365 Ca 0.01 -0.19 0.04 0.00 0.82 0.00 0.00 66.70 67.38 1xup h VAL 365 Cb 1.18 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1xup h VAL 365 CO 0.14 0.00 -0.06 0.49 0.02 0.00 0.00 177.57 178.17 1xup n PHE 366 N -2.77 -2.09 -3.93 1.57 0.99 -1.26 -4.29 117.46 105.67 1xup n PHE 366 Ca -0.01 0.20 -0.26 0.00 -0.00 0.00 0.00 57.45 57.37 1xup n PHE 366 Cb 0.04 -0.13 -0.01 0.00 -1.00 0.00 0.00 39.48 38.38 1xup n PHE 366 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1xup n GLY 367 N -0.47 -0.29 3.56 1.37 0.00 -1.26 -4.78 105.19 103.33 1xup n GLY 367 Ca 0.00 0.15 -0.20 0.00 0.00 0.00 0.00 46.02 45.97 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 -6.98 2.94 -0.07 0.99 2.01 -1.26 -4.79 118.68 111.53 1xup s LEU 368 Ca 0.15 -0.50 -0.05 0.00 0.01 0.00 0.00 54.13 53.74 1xup s LEU 368 Cb -0.08 -2.56 0.03 0.00 0.01 0.00 0.00 46.19 43.58 1xup s LEU 368 CO 0.87 -3.47 0.18 -0.89 1.01 0.00 0.00 176.35 174.05 1xup s THR 369 N 12.87 -0.02 0.58 5.49 2.01 -1.26 -5.03 115.64 130.29 1xup s THR 369 Ca 0.80 0.08 0.21 0.00 0.31 0.00 0.00 61.69 63.09 1xup s THR 369 Cb -0.08 -0.27 0.21 0.00 0.01 0.00 0.00 72.50 72.36 1xup s THR 369 CO 0.06 0.03 1.62 -0.09 -0.69 0.00 0.00 174.62 175.55 1xup h ARG 370 N 6.49 0.00 -0.43 4.92 9.65 -2.03 -0.94 114.38 132.04 1xup h ARG 370 Ca -0.33 0.00 0.12 0.00 -1.10 0.00 0.00 59.98 58.68 1xup h ARG 370 Cb 1.17 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.74 1xup h ARG 370 CO 0.40 0.00 0.33 0.78 2.80 0.00 0.00 179.97 184.28 1xup h GLY 371 N 0.00 0.00 -7.05 2.80 0.00 -1.95 -3.35 103.07 93.52 1xup h GLY 371 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.00 1xup h GLY 371 CO 0.00 0.00 0.93 -1.30 0.00 0.00 0.00 176.54 176.17 1xup n THR 372 N -4.28 0.66 0.00 4.70 -2.24 -0.36 -4.69 114.28 108.07 1xup n THR 372 Ca 0.07 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 1xup n THR 372 Cb 0.52 -2.08 0.00 0.00 -2.10 0.00 0.00 70.33 66.67 1xup n THR 372 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1xup n THR 373 N 7.82 0.00 -0.00 4.28 -2.24 -1.26 -4.95 114.28 117.93 1xup n THR 373 Ca 0.45 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 62.22 1xup n THR 373 Cb 0.45 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.67 1xup n THR 373 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1xup h LYS 374 N 0.00 -0.05 -0.01 -0.78 2.10 -1.97 -3.37 116.57 112.49 1xup h LYS 374 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1xup h LYS 374 Cb 0.00 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.34 1xup h LYS 374 CO 0.00 -0.04 0.00 0.39 -2.00 0.00 0.00 179.45 177.80 1xup n GLU 375 N -3.40 1.03 0.20 0.07 -0.58 -1.26 -4.15 120.64 112.55 1xup n GLU 375 Ca -0.01 -0.05 -0.12 0.00 -0.42 0.00 0.00 57.16 56.56 1xup n GLU 375 Cb 0.02 -1.07 -0.07 0.00 -0.57 0.00 0.00 31.44 29.76 1xup n GLU 375 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 1xup h ASP 376 N 0.09 -0.47 -1.40 1.62 1.82 -1.84 -3.30 116.42 112.94 1xup h ASP 376 Ca 0.00 -0.11 0.46 0.00 -0.39 0.00 0.00 57.03 56.99 1xup h ASP 376 Cb 0.02 0.12 -0.13 0.00 0.68 0.00 0.00 39.33 40.02 1xup h ASP 376 CO 0.00 -0.05 0.92 -0.26 -1.61 0.00 0.00 179.24 178.24 1xup h PHE 377 N -0.99 0.46 0.00 0.28 0.05 -1.81 -3.15 116.94 111.78 1xup h PHE 377 Ca -0.06 0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.75 1xup h PHE 377 Cb 0.54 -0.11 0.00 0.00 2.00 0.00 0.00 35.95 38.38 1xup h PHE 377 CO 0.02 -0.21 0.00 0.28 -0.18 0.00 0.00 178.31 178.22 1xup n VAL 378 N -4.63 0.00 0.29 -0.55 0.31 -1.24 -2.54 118.33 109.96 1xup n VAL 378 Ca 0.39 1.41 0.19 0.00 -0.01 0.00 0.00 64.34 66.31 1xup n VAL 378 Cb 1.53 -2.13 0.99 0.00 -0.91 0.00 0.00 33.84 33.32 1xup n VAL 378 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1xup h ARG 379 N 0.00 0.00 -0.47 5.55 2.43 -1.77 -2.83 114.38 117.30 1xup h ARG 379 Ca 0.00 0.00 0.08 0.00 -0.81 0.00 0.00 59.98 59.25 1xup h ARG 379 Cb 0.00 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.48 1xup h ARG 379 CO 0.00 0.00 0.05 0.00 -1.51 0.00 0.00 179.97 178.51 1xup h ALA 380 N 1.88 0.49 -0.48 2.80 0.00 -1.60 -2.11 119.26 120.24 1xup h ALA 380 Ca 0.00 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1xup h ALA 380 Cb 0.11 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1xup h ALA 380 CO 0.00 -0.35 0.16 0.00 0.00 0.00 0.00 179.25 179.06 1xup h THR 381 N 0.18 1.22 -0.38 0.00 1.03 -1.61 0.52 112.91 113.86 1xup h THR 381 Ca 0.23 -0.74 0.08 0.00 -0.01 0.00 0.00 66.41 65.98 1xup h THR 381 Cb 0.33 0.80 -0.08 0.00 -1.07 0.00 0.00 68.15 68.13 1xup h THR 381 CO -0.34 0.27 -0.13 0.25 -0.01 0.00 0.00 175.52 175.56 1xup h LEU 382 N 0.64 -0.46 0.24 0.00 6.46 -1.55 0.01 115.31 120.65 1xup h LEU 382 Ca 0.16 0.13 -0.01 0.00 -0.12 0.00 0.00 57.88 58.03 1xup h LEU 382 Cb 0.26 0.28 0.00 0.00 -0.73 0.00 0.00 40.66 40.47 1xup h LEU 382 CO -0.01 -0.16 -0.12 1.56 -0.62 0.00 0.00 178.44 179.09 1xup h GLN 383 N -0.05 -0.32 -0.35 1.25 1.08 -1.24 -3.25 115.11 112.24 1xup h GLN 383 Ca 0.19 0.02 0.07 0.00 -1.45 0.00 0.00 58.65 57.48 1xup h GLN 383 Cb 0.33 0.07 -0.09 0.00 -0.05 0.00 0.00 27.48 27.75 1xup h GLN 383 CO -0.42 -0.02 -0.37 0.00 -0.95 0.00 0.00 178.83 177.07 1xup h ALA 384 N 0.03 -0.33 -0.26 3.87 0.00 -0.54 -1.37 119.26 120.66 1xup h ALA 384 Ca -0.03 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.01 1xup h ALA 384 Cb 0.45 0.77 -0.07 0.00 0.00 0.00 0.00 17.79 18.94 1xup h ALA 384 CO 0.06 -0.80 -0.20 0.28 0.00 0.00 0.00 179.25 178.59 1xup h VAL 385 N -0.32 0.47 -0.44 0.00 2.07 -1.08 0.88 116.25 117.83 1xup h VAL 385 Ca 0.14 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.69 1xup h VAL 385 Cb 0.57 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 1xup h VAL 385 CO -0.52 0.00 0.23 0.00 0.02 0.00 0.00 177.57 177.30 1xup h ALA 386 N 0.94 0.56 -0.08 1.67 0.00 -1.53 -1.30 119.26 119.53 1xup h ALA 386 Ca 0.14 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1xup h ALA 386 Cb 0.40 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1xup h ALA 386 CO -0.37 -0.11 -0.16 1.88 0.00 0.00 0.00 179.25 180.49 1xup h TYR 387 N 0.47 0.13 -0.51 0.00 0.99 -0.04 -1.49 116.97 116.52 1xup h TYR 387 Ca 0.19 -0.01 -0.05 0.00 2.00 0.00 0.00 58.73 60.86 1xup h TYR 387 Cb 0.08 -0.04 -0.02 0.00 1.00 0.00 0.00 36.73 37.74 1xup h TYR 387 CO -0.09 0.29 0.13 1.96 -0.00 0.00 0.00 178.16 180.45 1xup h GLN 388 N 0.12 0.78 -0.46 4.88 4.20 0.19 0.87 115.11 125.69 1xup h GLN 388 Ca 0.02 -0.15 -0.10 0.00 0.06 0.00 0.00 58.65 58.48 1xup h GLN 388 Cb 0.36 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 1xup h GLN 388 CO 0.02 0.69 -0.12 0.77 -0.67 0.00 0.00 178.83 179.52 1xup h SER 389 N 0.75 0.90 -0.71 1.46 0.02 -0.64 -2.92 113.55 112.41 1xup h SER 389 Ca 0.17 -0.37 0.07 0.00 -0.84 0.00 0.00 61.79 60.82 1xup h SER 389 Cb 0.26 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.51 1xup h SER 389 CO -0.00 1.06 0.47 0.50 -1.14 0.00 0.00 176.83 177.71 1xup h LYS 390 N 0.73 0.70 -0.05 3.45 1.63 -0.17 -1.14 116.57 121.72 1xup h LYS 390 Ca 0.11 -0.04 0.04 0.00 -0.85 0.00 0.00 60.65 59.91 1xup h LYS 390 Cb 0.67 -0.16 -0.05 0.00 -0.60 0.00 0.00 32.23 32.10 1xup h LYS 390 CO 0.05 0.46 -0.26 0.22 -3.45 0.00 0.00 179.45 176.47 1xup h ASP 391 N 0.72 -0.79 0.31 4.20 -0.00 -0.69 -0.47 116.42 119.70 1xup h ASP 391 Ca 0.31 0.11 -0.19 0.00 -0.00 0.00 0.00 57.03 57.26 1xup h ASP 391 Cb 0.29 0.33 -0.00 0.00 -0.00 0.00 0.00 39.33 39.94 1xup h ASP 391 CO -0.10 -0.32 -0.78 -0.37 -0.00 0.00 0.00 179.24 177.67 1xup h VAL 392 N -0.37 1.40 0.89 2.25 -1.51 -1.57 -3.22 116.25 114.12 1xup h VAL 392 Ca 0.08 -2.24 -0.04 0.00 -1.23 0.00 0.00 66.70 63.26 1xup h VAL 392 Cb 0.48 2.20 0.01 0.00 -2.13 0.00 0.00 31.29 31.85 1xup h VAL 392 CO -0.26 0.67 -0.45 0.40 -1.23 0.00 0.00 177.57 176.70 1xup h ILE 393 N 0.24 0.08 -0.52 7.19 1.08 -0.86 -0.76 117.51 123.97 1xup h ILE 393 Ca -0.04 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.52 1xup h ILE 393 Cb 1.37 0.08 -0.07 0.00 -3.07 0.00 0.00 36.82 35.13 1xup h ILE 393 CO 0.13 0.00 0.09 0.44 -0.69 0.00 0.00 178.15 178.12 1xup h ASP 394 N -1.23 -0.02 -0.11 1.72 5.19 -1.21 -1.84 116.42 118.91 1xup h ASP 394 Ca -0.12 0.10 -0.08 0.00 -0.62 0.00 0.00 57.03 56.31 1xup h ASP 394 Cb 0.95 0.14 -0.02 0.00 0.18 0.00 0.00 39.33 40.58 1xup h ASP 394 CO 0.19 0.01 -0.15 0.71 -3.12 0.00 0.00 179.24 176.87 1xup h THR 395 N 0.23 1.24 -0.06 0.35 1.35 -1.55 -3.22 112.91 111.24 1xup h THR 395 Ca 0.26 -1.07 0.01 0.00 -0.55 0.00 0.00 66.41 65.07 1xup h THR 395 Cb 0.37 1.20 -0.01 0.00 -1.73 0.00 0.00 68.15 67.97 1xup h THR 395 CO -0.35 0.35 -0.02 -0.03 -0.25 0.00 0.00 175.52 175.21 1xup h MET 396 N 0.44 -0.01 -0.51 4.72 -1.53 -0.26 -2.71 114.93 115.07 1xup h MET 396 Ca 0.08 0.00 0.02 0.00 -3.44 0.00 0.00 59.70 56.36 1xup h MET 396 Cb 0.53 0.00 -0.03 0.00 -0.55 0.00 0.00 31.60 31.56 1xup h MET 396 CO 0.03 -0.01 0.34 -0.22 0.14 0.00 0.00 176.91 177.19 1xup h LYS 397 N -0.01 0.62 -0.07 0.39 3.64 -1.54 -1.25 116.57 118.35 1xup h LYS 397 Ca 0.03 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1xup h LYS 397 Cb 0.06 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1xup h LYS 397 CO -0.07 0.41 0.11 0.87 -2.27 0.00 0.00 179.45 178.51 1xup h LYS 398 N 0.64 0.00 0.00 1.90 1.79 -1.51 -2.00 116.57 117.39 1xup h LYS 398 Ca 0.20 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.64 1xup h LYS 398 Cb -0.00 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1xup h LYS 398 CO -0.05 0.00 -0.58 -3.47 -1.08 0.00 0.00 179.45 174.27 1xup n ASP 399 N -3.53 1.44 -0.23 0.86 2.03 -0.83 -4.78 116.55 111.51 1xup n ASP 399 Ca -0.01 0.22 -0.04 0.00 0.52 0.00 0.00 54.79 55.48 1xup n ASP 399 Cb 0.20 -0.51 0.06 0.00 -0.72 0.00 0.00 41.12 40.16 1xup n ASP 399 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1xup h SER 400 N -0.46 0.67 0.00 1.67 0.02 -1.35 -3.46 113.55 110.64 1xup h SER 400 Ca -0.03 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1xup h SER 400 Cb 0.54 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.93 1xup h SER 400 CO -0.02 0.47 0.00 0.61 -1.14 0.00 0.00 176.83 176.75 1xup n GLY 401 N -1.28 1.61 3.61 -3.77 0.00 -0.75 -5.01 105.19 99.60 1xup n GLY 401 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.83 4.54 0.40 -0.61 1.01 -1.26 -5.02 121.20 117.43 1xup s ILE 402 Ca 0.00 1.25 -0.24 0.00 0.00 0.00 0.00 60.65 61.66 1xup s ILE 402 Cb 0.00 -4.37 -0.09 0.00 0.01 0.00 0.00 42.46 38.02 1xup s ILE 402 CO 0.00 -0.58 1.10 -1.81 0.00 0.00 0.00 174.94 173.66 1xup s ASP 403 N 1.91 6.64 -0.25 3.58 1.01 -1.26 -4.72 116.67 123.57 1xup s ASP 403 Ca 0.40 2.18 -0.12 0.00 0.71 0.00 0.00 52.55 55.71 1xup s ASP 403 Cb -0.12 -2.60 -0.05 0.00 1.01 0.00 0.00 42.92 41.17 1xup s ASP 403 CO 0.19 -0.58 0.25 -0.63 0.21 0.00 0.00 175.17 174.61 1xup s ILE 404 N -1.54 5.28 0.00 0.77 1.01 -1.26 -5.08 121.20 120.38 1xup s ILE 404 Ca 0.58 0.35 0.00 0.00 0.00 0.00 0.00 60.65 61.57 1xup s ILE 404 Cb -0.26 -3.59 0.00 0.00 0.01 0.00 0.00 42.46 38.62 1xup s ILE 404 CO 0.32 0.27 0.00 -2.65 0.00 0.00 0.00 174.94 172.88 1xup n PRO 405 N 4.73 3.31 -2.12 2.79 -0.02 -1.26 -4.88 135.00 137.54 1xup n PRO 405 Ca -0.12 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.07 1xup n PRO 405 Cb 0.52 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.95 1xup n PRO 405 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 1xup s LEU 406 N 0.00 3.20 0.69 2.45 0.05 -1.25 -4.74 118.68 119.08 1xup s LEU 406 Ca 0.00 -1.01 -0.12 0.00 0.05 0.00 0.00 54.13 53.04 1xup s LEU 406 Cb 0.00 -2.57 0.01 0.00 -2.05 0.00 0.00 46.19 41.58 1xup s LEU 406 CO 0.00 -2.64 1.07 -1.48 -0.55 0.00 0.00 176.35 172.75 1xup s LEU 407 N 9.57 3.22 -0.00 1.48 2.34 -1.25 -4.50 118.68 129.54 1xup s LEU 407 Ca 0.67 1.76 -0.18 0.00 0.06 0.00 0.00 54.13 56.44 1xup s LEU 407 Cb -0.04 -4.52 -0.06 0.00 -0.56 0.00 0.00 46.19 41.01 1xup s LEU 407 CO 0.01 -1.55 0.51 -0.54 -1.06 0.00 0.00 176.35 173.71 1xup s LYS 408 N -4.66 4.17 0.03 1.48 3.01 -1.11 -0.96 119.74 121.70 1xup s LYS 408 Ca 0.61 0.58 0.03 0.00 -1.01 0.00 0.00 55.97 56.18 1xup s LYS 408 Cb -0.16 -3.29 -0.02 0.00 -1.01 0.00 0.00 37.83 33.35 1xup s LYS 408 CO 0.49 0.50 -0.10 0.14 0.51 0.00 0.00 175.35 176.89 1xup s VAL 409 N -0.57 0.80 0.27 3.17 -7.23 -1.21 0.72 120.40 116.35 1xup s VAL 409 Ca 0.27 -0.84 -0.21 0.00 -1.81 0.00 0.00 61.98 59.39 1xup s VAL 409 Cb -0.17 -0.75 0.04 0.00 0.56 0.00 0.00 36.38 36.05 1xup s VAL 409 CO 0.15 -0.07 0.80 1.51 -0.31 0.00 0.00 175.10 177.18 1xup s ASP 410 N -1.02 -0.17 0.00 4.85 -4.77 -0.90 -3.43 116.67 111.23 1xup s ASP 410 Ca -0.01 -0.68 0.00 0.00 -3.30 0.00 0.00 52.55 48.55 1xup s ASP 410 Cb -0.07 0.69 0.00 0.00 -1.09 0.00 0.00 42.92 42.45 1xup s ASP 410 CO 0.01 -1.31 0.00 0.61 0.70 0.00 0.00 175.17 175.18 1xup n GLY 411 N -0.49 4.30 0.18 2.12 0.00 -1.19 -3.67 105.19 106.45 1xup n GLY 411 Ca -0.05 -1.45 -0.08 0.00 0.00 0.00 0.00 46.02 44.43 1xup n GLY 411 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1xup h GLY 412 N 0.00 0.60 2.00 -0.02 0.00 -1.85 -2.38 103.07 101.42 1xup h GLY 412 Ca 0.00 -0.23 -0.12 0.00 0.00 0.00 0.00 47.33 46.99 1xup h GLY 412 CO 0.00 0.22 -0.55 0.00 0.00 0.00 0.00 176.54 176.21 1xup h ALA 413 N 1.15 0.73 0.00 3.60 0.00 -1.93 -3.18 119.26 119.64 1xup h ALA 413 Ca 0.16 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1xup h ALA 413 Cb -0.06 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1xup h ALA 413 CO -0.03 0.69 0.00 0.00 0.00 0.00 0.00 179.25 179.91 1xup n ALA 414 N -2.28 1.48 0.24 0.00 0.00 -0.91 -3.47 120.51 115.57 1xup n ALA 414 Ca 0.01 -0.02 0.13 0.00 0.00 0.00 0.00 53.44 53.56 1xup n ALA 414 Cb 0.69 -1.19 0.69 0.00 0.00 0.00 0.00 19.45 19.64 1xup n ALA 414 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1xup h LYS 415 N 0.00 0.00 -6.18 0.00 1.57 -1.49 -3.40 116.57 107.07 1xup h LYS 415 Ca 0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 1xup h LYS 415 Cb 0.19 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.45 1xup h LYS 415 CO 0.00 0.00 1.22 1.21 -0.57 0.00 0.00 179.45 181.31 1xup s ASN 416 N -4.15 5.70 0.33 0.86 2.47 -1.23 -4.86 114.94 114.07 1xup s ASN 416 Ca -0.03 0.19 0.11 0.00 0.42 0.00 0.00 52.86 53.55 1xup s ASN 416 Cb 0.07 -2.54 0.92 0.00 -1.45 0.00 0.00 41.25 38.25 1xup s ASN 416 CO 0.23 -2.07 1.73 0.44 -3.72 0.00 0.00 177.10 173.72 1xup h ASP 417 N 12.81 0.65 -0.44 -4.21 5.19 -1.95 0.11 116.42 128.58 1xup h ASP 417 Ca -0.27 0.13 0.05 0.00 -0.62 0.00 0.00 57.03 56.32 1xup h ASP 417 Cb 1.12 0.03 -0.02 0.00 0.18 0.00 0.00 39.33 40.64 1xup h ASP 417 CO 1.21 0.09 0.29 0.25 -3.12 0.00 0.00 179.24 177.97 1xup h LEU 418 N 0.55 0.34 -1.53 1.55 5.85 -1.92 -2.54 115.31 117.61 1xup h LEU 418 Ca 0.64 -0.00 0.05 0.00 0.84 0.00 0.00 57.88 59.41 1xup h LEU 418 Cb 1.28 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 1xup h LEU 418 CO -0.46 0.23 0.37 0.25 -0.34 0.00 0.00 178.44 178.49 1xup h LEU 419 N 0.39 0.51 -0.49 2.25 5.85 -1.32 -2.02 115.31 120.48 1xup h LEU 419 Ca 0.19 -0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.82 1xup h LEU 419 Cb 0.25 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1xup h LEU 419 CO -0.04 0.34 -0.04 0.24 -0.34 0.00 0.00 178.44 178.60 1xup h MET 420 N 0.59 0.90 0.08 1.25 2.86 -1.58 -3.20 114.93 115.83 1xup h MET 420 Ca 0.24 -0.31 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1xup h MET 420 Cb 0.19 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.78 1xup h MET 420 CO -0.07 0.95 -0.04 1.96 1.06 0.00 0.00 176.91 180.78 1xup h GLN 421 N 0.76 -0.11 -0.97 1.72 4.20 -1.47 -2.74 115.11 116.50 1xup h GLN 421 Ca 0.13 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.85 1xup h GLN 421 Cb 0.58 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.38 1xup h GLN 421 CO 0.03 0.08 0.00 0.34 -0.67 0.00 0.00 178.83 178.61 1xup n PHE 422 N -5.06 0.00 0.04 2.96 -0.00 -0.96 -3.67 117.46 110.78 1xup n PHE 422 Ca -0.08 -0.07 0.00 0.00 -0.00 0.00 0.00 57.45 57.29 1xup n PHE 422 Cb 0.14 -0.12 0.00 0.00 -0.00 0.00 0.00 39.48 39.50 1xup n PHE 422 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.76 177.70 1xup n GLN 423 N 0.10 0.00 0.17 -4.13 7.27 -1.11 -4.76 117.38 114.91 1xup n GLN 423 Ca 0.00 0.00 0.11 0.00 0.07 0.00 0.00 57.00 57.18 1xup n GLN 423 Cb 0.28 -0.38 0.59 0.00 2.41 0.00 0.00 30.24 33.14 1xup n GLN 423 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1xup h ALA 424 N 0.00 1.02 -0.16 1.69 0.00 -1.61 -3.31 119.26 116.89 1xup h ALA 424 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1xup h ALA 424 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 1xup h ALA 424 CO 0.00 -0.02 -0.38 0.38 0.00 0.00 0.00 179.25 179.23 1xup h ASP 425 N 0.00 -1.24 0.44 0.00 2.03 -1.83 -1.67 116.42 114.16 1xup h ASP 425 Ca 0.00 0.15 -0.05 0.00 -0.73 0.00 0.00 57.03 56.40 1xup h ASP 425 Cb 0.06 0.49 -0.01 0.00 -0.83 0.00 0.00 39.33 39.04 1xup h ASP 425 CO 0.00 -0.32 -0.25 -0.29 -1.03 0.00 0.00 179.24 177.35 1xup h ILE 426 N -0.36 0.90 0.00 4.15 2.10 -1.93 -2.66 117.51 119.71 1xup h ILE 426 Ca 0.03 -0.95 0.00 0.00 1.08 0.00 0.00 64.86 65.02 1xup h ILE 426 Cb 0.45 1.56 0.00 0.00 -1.09 0.00 0.00 36.82 37.74 1xup h ILE 426 CO -0.34 0.24 0.00 -0.07 -1.08 0.00 0.00 178.15 176.90 1xup h LEU 427 N 0.00 0.00 -2.03 2.19 3.38 -1.67 -3.48 115.31 113.70 1xup h LEU 427 Ca -0.00 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.64 1xup h LEU 427 Cb 0.54 0.00 0.16 0.00 0.09 0.00 0.00 40.66 41.44 1xup h LEU 427 CO 0.03 0.00 -0.82 0.47 0.09 0.00 0.00 178.44 178.21 1xup n ASP 428 N -2.52 -3.62 -3.35 -0.43 9.92 -0.66 -5.02 116.55 110.88 1xup n ASP 428 Ca 0.04 -0.71 -0.08 0.00 -0.53 0.00 0.00 54.79 53.52 1xup n ASP 428 Cb 0.42 -4.87 0.01 0.00 -0.64 0.00 0.00 41.12 36.03 1xup n ASP 428 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1xup s ILE 429 N -3.43 0.00 0.44 0.53 1.10 -1.23 -5.10 121.20 113.52 1xup s ILE 429 Ca 0.18 -0.96 0.08 0.00 -0.51 0.00 0.00 60.65 59.44 1xup s ILE 429 Cb -0.03 -2.50 0.02 0.00 0.15 0.00 0.00 42.46 40.10 1xup s ILE 429 CO 0.75 0.00 0.60 -1.81 -2.11 0.00 0.00 174.94 172.38 1xup s ASP 430 N -3.02 5.58 0.03 4.50 1.11 -1.26 -4.71 116.67 118.88 1xup s ASP 430 Ca 0.14 -0.46 -0.01 0.00 0.18 0.00 0.00 52.55 52.40 1xup s ASP 430 Cb -0.05 -0.54 -0.02 0.00 1.07 0.00 0.00 42.92 43.37 1xup s ASP 430 CO 0.09 -0.85 -0.02 -0.69 1.18 0.00 0.00 175.17 174.88 1xup s VAL 431 N -2.40 0.13 -0.13 -1.27 1.01 -1.26 -3.76 120.40 112.72 1xup s VAL 431 Ca 0.56 -1.10 -0.03 0.00 0.00 0.00 0.00 61.98 61.41 1xup s VAL 431 Cb -0.09 -0.56 0.05 0.00 0.00 0.00 0.00 36.38 35.77 1xup s VAL 431 CO 0.34 -0.61 0.04 0.00 0.00 0.00 0.00 175.10 174.87 1xup s GLN 432 N -2.03 0.44 -0.16 2.72 -2.07 -0.13 -3.92 119.66 114.52 1xup s GLN 432 Ca -0.11 -0.09 -0.29 0.00 -1.82 0.00 0.00 55.36 53.05 1xup s GLN 432 Cb -0.06 -1.51 -0.01 0.00 -1.09 0.00 0.00 33.01 30.35 1xup s GLN 432 CO -0.03 -0.50 1.13 -0.98 -1.32 0.00 0.00 175.29 173.59 1xup s ARG 433 N 1.99 4.30 0.33 9.60 1.70 -1.19 -3.34 118.95 132.32 1xup s ARG 433 Ca 0.02 1.51 -0.29 0.00 -0.47 0.00 0.00 55.73 56.50 1xup s ARG 433 Cb -0.15 -3.65 -0.11 0.00 -0.57 0.00 0.00 34.95 30.48 1xup s ARG 433 CO -0.07 -0.57 1.52 0.00 -1.08 0.00 0.00 175.30 175.11 1xup s ALA 434 N 2.91 3.65 -0.55 7.88 0.00 -1.22 -4.71 121.76 129.72 1xup s ALA 434 Ca 0.50 1.54 -0.27 0.00 0.00 0.00 0.00 51.96 53.73 1xup s ALA 434 Cb -0.19 -3.62 -0.26 0.00 0.00 0.00 0.00 23.12 19.05 1xup s ALA 434 CO 0.13 -0.98 1.82 0.00 0.00 0.00 0.00 175.76 176.73 1xup n ALA 435 N 1.37 1.47 0.00 0.00 0.00 -1.25 -4.54 120.51 117.55 1xup n ALA 435 Ca 0.04 -2.81 0.00 0.00 0.00 0.00 0.00 53.44 50.68 1xup n ALA 435 Cb 0.39 -3.61 0.00 0.00 0.00 0.00 0.00 19.45 16.22 1xup n ALA 435 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1xup n ASN 436 N 11.38 0.00 -0.22 0.00 2.85 -1.26 -5.01 115.26 123.00 1xup n ASN 436 Ca 0.46 0.00 0.07 0.00 -0.11 0.00 0.00 54.58 55.00 1xup n ASN 436 Cb 0.43 0.00 0.33 0.00 1.24 0.00 0.00 39.78 41.78 1xup n ASN 436 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1xup h LEU 437 N 0.00 0.72 -5.20 1.20 3.38 -1.96 -3.26 115.31 110.19 1xup h LEU 437 Ca 0.00 0.01 -0.46 0.00 0.09 0.00 0.00 57.88 57.52 1xup h LEU 437 Cb 0.00 -0.14 -0.41 0.00 0.09 0.00 0.00 40.66 40.20 1xup h LEU 437 CO 0.00 0.45 -1.06 -0.62 0.09 0.00 0.00 178.44 177.30 1xup n GLU 438 N -4.49 1.73 0.12 1.13 1.02 -1.26 -3.19 120.64 115.70 1xup n GLU 438 Ca 0.12 -3.68 0.19 0.00 -0.02 0.00 0.00 57.16 53.77 1xup n GLU 438 Cb 0.25 -1.65 0.65 0.00 -0.02 0.00 0.00 31.44 30.68 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 2.41 0.18 -0.71 2.62 2.02 -1.94 -2.51 112.91 114.98 1xup h THR 439 Ca 0.05 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.37 1xup h THR 439 Cb 1.01 0.49 -0.10 0.00 -1.74 0.00 0.00 68.15 67.81 1xup h THR 439 CO 0.60 0.00 0.20 0.74 0.37 0.00 0.00 175.52 177.43 1xup h THR 440 N 0.00 0.59 -0.72 3.16 2.02 -1.90 -2.13 112.91 113.93 1xup h THR 440 Ca 0.18 -0.11 0.06 0.00 0.77 0.00 0.00 66.41 67.31 1xup h THR 440 Cb 1.37 0.24 -0.04 0.00 -1.74 0.00 0.00 68.15 67.97 1xup h THR 440 CO -0.00 0.06 0.47 0.00 0.37 0.00 0.00 175.52 176.42 1xup h ALA 441 N 1.56 1.68 -0.28 6.16 0.00 -1.77 -2.67 119.26 123.93 1xup h ALA 441 Ca 0.39 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.24 1xup h ALA 441 Cb 0.63 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1xup h ALA 441 CO -0.45 0.22 -0.00 -0.07 0.00 0.00 0.00 179.25 178.94 1xup h LEU 442 N 0.77 0.39 0.06 0.00 3.38 -1.59 -2.77 115.31 115.56 1xup h LEU 442 Ca 0.30 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 1xup h LEU 442 Cb 0.21 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1xup h LEU 442 CO -0.10 0.46 -0.09 1.23 0.09 0.00 0.00 178.44 180.03 1xup h GLY 443 N 0.74 -0.96 1.21 0.83 0.00 -1.52 -1.50 103.07 101.87 1xup h GLY 443 Ca 0.09 0.43 0.03 0.00 0.00 0.00 0.00 47.33 47.88 1xup h GLY 443 CO 0.01 -0.34 0.46 0.00 0.00 0.00 0.00 176.54 176.67 1xup h ALA 444 N -1.51 1.59 -0.69 3.60 0.00 -1.71 -2.76 119.26 117.78 1xup h ALA 444 Ca -0.01 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.93 1xup h ALA 444 Cb 0.15 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 1xup h ALA 444 CO -0.03 0.34 0.38 0.00 0.00 0.00 0.00 179.25 179.94 1xup h ALA 445 N 1.59 0.93 -0.30 0.00 0.00 -1.30 -2.38 119.26 117.81 1xup h ALA 445 Ca 0.28 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.30 1xup h ALA 445 Cb 0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1xup h ALA 445 CO -0.08 0.04 0.24 1.88 0.00 0.00 0.00 179.25 181.34 1xup h TYR 446 N 0.69 0.00 0.00 0.00 0.05 -0.96 -2.81 116.97 113.94 1xup h TYR 446 Ca 0.31 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.09 1xup h TYR 446 Cb 0.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.96 1xup h TYR 446 CO -0.08 0.00 0.00 1.28 -1.05 0.00 0.00 178.16 178.31 1xup n LEU 447 N -4.18 0.00 -0.11 3.88 4.77 -0.90 -2.25 117.00 118.21 1xup n LEU 447 Ca 0.04 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.87 1xup n LEU 447 Cb 0.40 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.36 1xup n LEU 447 CO 0.33 0.00 -1.24 0.00 -1.33 0.00 0.00 177.39 175.14 1xup n ALA 448 N -0.67 1.44 0.27 -1.18 0.00 -1.06 -4.13 120.51 115.18 1xup n ALA 448 Ca 0.02 -1.16 0.16 0.00 0.00 0.00 0.00 53.44 52.46 1xup n ALA 448 Cb 0.01 -0.17 0.61 0.00 0.00 0.00 0.00 19.45 19.90 1xup n ALA 448 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1xup h GLY 449 N 2.71 0.00 -4.51 0.00 0.00 -1.68 -3.35 103.07 96.25 1xup h GLY 449 Ca -0.56 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 46.47 1xup h GLY 449 CO -0.04 0.00 1.04 1.04 0.00 0.00 0.00 176.54 178.59 1xup n LEU 450 N -3.11 5.45 0.15 3.11 4.32 -1.25 -2.11 117.00 123.55 1xup n LEU 450 Ca 0.01 -3.13 0.00 0.00 -0.02 0.00 0.00 56.01 52.87 1xup n LEU 450 Cb 0.34 -1.26 0.00 0.00 -1.62 0.00 0.00 43.42 40.88 1xup n LEU 450 CO 0.28 1.41 0.00 0.00 -1.22 0.00 0.00 177.39 177.87 1xup n ALA 451 N 3.01 0.00 1.00 -1.18 0.00 -1.26 -4.90 120.51 117.19 1xup n ALA 451 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1xup n ALA 451 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 1xup n ALA 451 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1xup n VAL 452 N -3.10 0.81 -2.41 0.00 3.14 -1.25 -4.80 118.33 110.72 1xup n VAL 452 Ca 0.00 0.00 -0.17 0.00 -2.96 0.00 0.00 64.34 61.21 1xup n VAL 452 Cb 0.00 -0.90 -0.01 0.00 -1.06 0.00 0.00 33.84 31.87 1xup n VAL 452 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1xup n GLY 453 N 0.41 -0.47 0.10 7.55 0.00 -1.24 -4.86 105.19 106.67 1xup n GLY 453 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1xup n GLY 453 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1xup h PHE 454 N 0.00 0.31 -3.32 1.61 3.04 -1.74 -3.44 116.94 113.41 1xup h PHE 454 Ca -0.41 -0.20 -0.65 0.00 3.98 0.00 0.00 57.97 60.69 1xup h PHE 454 Cb 1.30 -0.02 -0.26 0.00 2.56 0.00 0.00 35.95 39.53 1xup h PHE 454 CO 0.62 1.08 -0.74 -1.58 -2.02 0.00 0.00 178.31 175.67 1xup s TRP 455 N -2.70 2.87 0.01 0.41 0.51 -0.97 -5.02 118.94 114.06 1xup s TRP 455 Ca -0.16 -0.57 -0.11 0.00 -2.12 0.00 0.00 56.10 53.13 1xup s TRP 455 Cb 0.00 -1.88 -0.06 0.00 -0.81 0.00 0.00 33.47 30.72 1xup s TRP 455 CO 0.76 -0.18 1.07 0.87 -0.51 0.00 0.00 176.95 178.96 1xup h LYS 456 N 6.76 -0.39 -2.50 4.98 6.56 -1.89 -3.41 116.57 126.68 1xup h LYS 456 Ca -0.28 0.03 0.14 0.00 -1.06 0.00 0.00 60.65 59.48 1xup h LYS 456 Cb 1.21 0.09 -0.08 0.00 -0.57 0.00 0.00 32.23 32.87 1xup h LYS 456 CO 0.58 -0.26 0.42 0.34 -2.06 0.00 0.00 179.45 178.46 1xup s ASP 457 N -2.78 -0.22 0.46 0.86 3.68 -1.26 -5.04 116.67 112.37 1xup s ASP 457 Ca -0.06 -0.40 0.24 0.00 2.13 0.00 0.00 52.55 54.46 1xup s ASP 457 Cb 0.01 0.53 1.27 0.00 -1.45 0.00 0.00 42.92 43.28 1xup s ASP 457 CO 0.18 -0.98 1.83 -0.07 0.13 0.00 0.00 175.17 176.27 1xup h LEU 458 N 2.00 0.25 -8.04 -1.34 3.38 -1.94 -3.34 115.31 106.28 1xup h LEU 458 Ca -0.23 0.04 -0.53 0.00 0.09 0.00 0.00 57.88 57.24 1xup h LEU 458 Cb 1.24 -0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.91 1xup h LEU 458 CO 0.26 0.07 1.51 -1.81 0.09 0.00 0.00 178.44 178.56 1xup s ASP 459 N -5.46 6.16 0.04 -0.43 -0.00 -1.26 -3.88 116.67 111.84 1xup s ASP 459 Ca -0.07 -1.63 0.00 0.00 -0.00 0.00 0.00 52.55 50.85 1xup s ASP 459 Cb 0.23 -2.57 0.00 0.00 -0.00 0.00 0.00 42.92 40.58 1xup s ASP 459 CO 0.79 -1.84 0.00 1.21 -0.00 0.00 0.00 175.17 175.33 1xup n GLU 460 N 8.66 0.00 0.30 8.23 2.13 -1.25 -4.95 120.64 133.76 1xup n GLU 460 Ca 0.40 0.00 0.17 0.00 0.66 0.00 0.00 57.16 58.40 1xup n GLU 460 Cb 0.48 0.00 0.94 0.00 0.27 0.00 0.00 31.44 33.14 1xup n GLU 460 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1xup h LEU 461 N 0.00 0.00 -1.75 4.31 -0.00 -1.87 -3.23 115.31 112.77 1xup h LEU 461 Ca 0.00 0.00 0.32 0.00 -0.00 0.00 0.00 57.88 58.20 1xup h LEU 461 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 40.59 1xup h LEU 461 CO 0.00 0.04 0.79 0.11 -0.00 0.00 0.00 178.44 179.38 1xup h LYS 462 N 0.00 0.13 0.00 1.13 1.57 -1.92 0.46 116.57 117.94 1xup h LYS 462 Ca -0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1xup h LYS 462 Cb 0.16 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1xup h LYS 462 CO 0.00 0.09 0.00 0.77 -0.57 0.00 0.00 179.45 179.74 1xup h SER 463 N 0.14 0.00 -3.78 0.86 0.02 -1.99 -3.40 113.55 105.39 1xup h SER 463 Ca 0.59 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.86 1xup h SER 463 Cb 2.03 0.00 -0.33 0.00 0.14 0.00 0.00 62.40 64.23 1xup h SER 463 CO -0.13 0.00 -0.71 -0.04 -1.14 0.00 0.00 176.83 174.81 1xup s MET 464 N -3.38 2.41 0.13 3.45 -1.94 0.15 -5.07 119.30 115.05 1xup s MET 464 Ca 0.05 -1.28 -0.24 0.00 -1.71 0.00 0.00 55.69 52.51 1xup s MET 464 Cb 0.09 -3.15 0.07 0.00 2.01 0.00 0.00 34.83 33.85 1xup s MET 464 CO 0.52 -0.62 0.68 0.00 -0.01 0.00 0.00 175.02 175.59 1xup s ALA 465 N 1.23 -1.62 -0.12 3.03 0.00 -1.26 -4.98 121.76 118.04 1xup s ALA 465 Ca -0.06 0.54 -0.04 0.00 0.00 0.00 0.00 51.96 52.41 1xup s ALA 465 Cb -0.20 0.78 0.05 0.00 0.00 0.00 0.00 23.12 23.76 1xup s ALA 465 CO -0.02 -0.78 0.10 -2.00 0.00 0.00 0.00 175.76 173.07 1xup s GLU 466 N -3.62 0.03 -0.02 0.00 2.56 -1.26 -5.01 118.70 111.38 1xup s GLU 466 Ca 0.03 0.18 0.03 0.00 0.00 0.00 0.00 54.97 55.21 1xup s GLU 466 Cb -0.01 -1.15 0.06 0.00 2.00 0.00 0.00 34.13 35.02 1xup s GLU 466 CO -0.10 -0.52 1.03 0.39 -0.56 0.00 0.00 175.26 175.50 1xup n GLU 467 N 5.30 2.75 -1.44 4.30 4.71 -1.26 -3.84 120.64 131.14 1xup n GLU 467 Ca -0.05 -1.68 -0.37 0.00 -0.01 0.00 0.00 57.16 55.04 1xup n GLU 467 Cb 0.49 -1.09 -0.03 0.00 -1.01 0.00 0.00 31.44 29.80 1xup n GLU 467 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1xup n GLY 468 N -0.60 4.38 2.68 0.62 0.00 -1.26 -4.32 105.19 106.70 1xup n GLY 468 Ca 0.03 -1.61 -0.08 0.00 0.00 0.00 0.00 46.02 44.36 1xup n GLY 468 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xup n GLN 469 N 3.03 1.22 -4.06 1.61 1.13 -1.26 -5.08 117.38 113.98 1xup n GLN 469 Ca 0.72 -3.18 -0.30 0.00 -1.94 0.00 0.00 57.00 52.30 1xup n GLN 469 Cb 0.29 -1.20 -0.07 0.00 0.11 0.00 0.00 30.24 29.37 1xup n GLN 469 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 1xup s MET 470 N -2.99 2.86 -0.17 -1.09 -1.94 -1.26 -3.19 119.30 111.53 1xup s MET 470 Ca 0.27 -0.71 -0.10 0.00 -1.71 0.00 0.00 55.69 53.43 1xup s MET 470 Cb 0.44 -2.71 -0.05 0.00 2.01 0.00 0.00 34.83 34.52 1xup s MET 470 CO 0.02 0.56 0.18 -0.06 -0.01 0.00 0.00 175.02 175.71 1xup s PHE 471 N -1.40 3.48 0.16 -0.03 0.40 -1.25 -5.03 117.98 114.30 1xup s PHE 471 Ca 0.29 0.46 -0.32 0.00 -0.60 0.00 0.00 56.93 56.77 1xup s PHE 471 Cb -0.12 -2.16 -0.11 0.00 0.51 0.00 0.00 43.02 41.14 1xup s PHE 471 CO 0.22 0.39 1.66 0.99 0.70 0.00 0.00 175.22 179.18 1xup s THR 472 N 0.03 2.46 0.31 0.64 2.01 -1.26 -4.78 115.64 115.04 1xup s THR 472 Ca 0.12 0.26 -0.29 0.00 0.31 0.00 0.00 61.69 62.08 1xup s THR 472 Cb -0.12 -3.16 -0.11 0.00 0.01 0.00 0.00 72.50 69.12 1xup s THR 472 CO 0.01 0.02 1.48 -2.84 -0.69 0.00 0.00 174.62 172.60 1xup s PRO 473 N 1.52 4.19 -0.09 4.92 0.02 -1.26 -5.01 135.00 139.30 1xup s PRO 473 Ca 0.73 2.45 -0.05 0.00 0.02 0.00 0.00 61.00 64.15 1xup s PRO 473 Cb -0.46 -3.04 -0.04 0.00 0.02 0.00 0.00 34.50 30.99 1xup s PRO 473 CO 0.32 -0.48 0.12 -1.21 -0.33 0.00 0.00 177.00 175.42 1xup s GLU 474 N -1.11 3.34 0.09 5.54 2.02 -1.26 -5.03 118.70 122.29 1xup s GLU 474 Ca 0.57 -0.23 -0.23 0.00 0.02 0.00 0.00 54.97 55.10 1xup s GLU 474 Cb -0.45 -3.09 -0.15 0.00 0.10 0.00 0.00 34.13 30.55 1xup s GLU 474 CO 0.52 0.74 1.73 1.98 0.02 0.00 0.00 175.26 180.25 1xup h MET 475 N 4.78 -0.05 -6.05 1.61 1.85 -2.04 -3.41 114.93 111.62 1xup h MET 475 Ca -0.53 0.00 -0.59 0.00 -0.61 0.00 0.00 59.70 57.98 1xup h MET 475 Cb 1.21 0.01 -0.01 0.00 0.43 0.00 0.00 31.60 33.25 1xup h MET 475 CO 0.59 -0.03 1.45 -2.14 -0.40 0.00 0.00 176.91 176.38 1xup s PRO 476 N -6.18 3.16 0.00 0.39 0.02 -1.26 -4.40 135.00 126.72 1xup s PRO 476 Ca -0.13 1.89 0.00 0.00 0.02 0.00 0.00 61.00 62.78 1xup s PRO 476 Cb 0.06 -4.34 0.00 0.00 0.02 0.00 0.00 34.50 30.24 1xup s PRO 476 CO 0.66 -2.07 0.00 0.00 -0.33 0.00 0.00 177.00 175.26 1xup n ALA 477 N 11.45 0.00 -1.41 -1.55 0.00 -1.26 -5.07 120.51 122.67 1xup n ALA 477 Ca 0.28 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.47 1xup n ALA 477 Cb 0.45 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.80 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 0.00 0.45 0.00 0.00 1.02 -1.26 -0.72 120.64 120.13 1xup n GLU 478 Ca 0.00 -1.71 0.00 0.00 -0.02 0.00 0.00 57.16 55.43 1xup n GLU 478 Cb 0.00 -3.53 0.00 0.00 -0.02 0.00 0.00 31.44 27.89 1xup n GLU 478 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 1xup n GLU 479 N 8.06 0.00 0.00 3.49 0.28 -1.26 -5.09 120.64 126.12 1xup n GLU 479 Ca 0.44 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.44 1xup n GLU 479 Cb 0.45 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.32 1xup n GLU 479 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86 1xup n ARG 480 N 0.00 0.00 0.00 3.44 1.85 0.10 -1.94 116.66 120.11 1xup n ARG 480 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1xup n ARG 480 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1xup n ARG 480 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1xup n ASP 481 N 0.00 0.00 -0.35 2.89 8.00 -1.26 -2.42 116.55 123.41 1xup n ASP 481 Ca 0.00 0.29 0.14 0.00 0.71 0.00 0.00 54.79 55.93 1xup n ASP 481 Cb 0.00 -0.29 0.33 0.00 -0.02 0.00 0.00 41.12 41.14 1xup n ASP 481 CO 0.00 0.00 0.00 -1.13 -0.39 0.00 0.00 177.20 175.68 1xup h ASN 482 N 0.00 0.74 0.36 -2.24 -0.00 -1.81 0.62 115.58 113.25 1xup h ASN 482 Ca 0.00 0.11 -0.32 0.00 -0.00 0.00 0.00 56.30 56.08 1xup h ASN 482 Cb 0.42 -0.02 0.03 0.00 -0.00 0.00 0.00 38.32 38.75 1xup h ASN 482 CO 0.00 0.23 -1.44 -0.07 -0.00 0.00 0.00 177.43 176.15 1xup h LEU 483 N 0.71 0.73 -1.20 0.34 3.38 -1.79 -3.33 115.31 114.15 1xup h LEU 483 Ca 0.59 -0.79 0.34 0.00 0.09 0.00 0.00 57.88 58.11 1xup h LEU 483 Cb 0.97 -0.24 -0.13 0.00 0.09 0.00 0.00 40.66 41.35 1xup h LEU 483 CO -0.41 1.62 0.67 0.22 0.09 0.00 0.00 178.44 180.64 1xup h TYR 484 N 0.13 0.75 -0.68 1.13 3.20 -1.05 0.13 116.97 120.59 1xup h TYR 484 Ca -0.23 0.03 0.20 0.00 3.14 0.00 0.00 58.73 61.87 1xup h TYR 484 Cb 2.12 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 40.16 1xup h TYR 484 CO 0.11 -0.13 0.53 0.93 -1.64 0.00 0.00 178.16 177.96 1xup h GLU 485 N 0.27 0.00 -0.02 1.82 5.08 -1.49 0.17 114.58 120.41 1xup h GLU 485 Ca 0.73 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 59.09 1xup h GLU 485 Cb 1.90 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.15 1xup h GLU 485 CO -0.48 0.00 0.05 0.78 -1.00 0.00 0.00 179.01 178.36 1xup h GLY 486 N 0.00 0.00 2.00 -3.84 0.00 -0.97 0.73 103.07 100.99 1xup h GLY 486 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1xup h GLY 486 CO -0.00 0.00 0.00 1.49 0.00 0.00 0.00 176.54 178.03 1xup h TRP 487 N 0.00 0.00 -0.91 5.60 -0.00 -1.14 -3.00 115.95 116.49 1xup h TRP 487 Ca 0.01 0.00 -0.61 0.00 -0.00 0.00 0.00 58.89 58.29 1xup h TRP 487 Cb 0.11 0.00 -0.37 0.00 -0.00 0.00 0.00 29.16 28.89 1xup h TRP 487 CO 0.00 0.00 -0.13 0.36 -0.00 0.00 0.00 178.44 178.67 1xup n LYS 488 N -2.95 3.24 -3.57 0.49 2.85 0.24 -4.88 118.16 113.59 1xup n LYS 488 Ca 0.03 -3.84 -0.12 0.00 -1.05 0.00 0.00 58.31 53.33 1xup n LYS 488 Cb 0.41 -2.28 -0.05 0.00 -0.65 0.00 0.00 35.03 32.46 1xup n LYS 488 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 177.40 176.21 1xup s GLN 489 N -3.70 0.68 -0.33 -1.58 0.74 -1.13 -4.97 119.66 109.36 1xup s GLN 489 Ca 0.56 0.15 0.00 0.00 0.05 0.00 0.00 55.36 56.12 1xup s GLN 489 Cb 0.45 0.32 0.00 0.00 1.10 0.00 0.00 33.01 34.88 1xup s GLN 489 CO -0.00 -0.21 0.00 0.00 -0.55 0.00 0.00 175.29 174.52 1xup n ALA 490 N 0.73 -0.05 -3.71 1.58 0.00 -1.26 -4.87 120.51 112.93 1xup n ALA 490 Ca -0.12 0.05 -0.27 0.00 0.00 0.00 0.00 53.44 53.11 1xup n ALA 490 Cb 0.58 -1.35 -0.17 0.00 0.00 0.00 0.00 19.45 18.51 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 -1.13 0.35 0.00 0.00 0.11 -1.26 -4.97 120.40 113.49 1xup s VAL 491 Ca 0.00 -0.38 0.00 0.00 -2.93 0.00 0.00 61.98 58.67 1xup s VAL 491 Cb 0.00 -0.86 0.00 0.00 -1.53 0.00 0.00 36.38 33.99 1xup s VAL 491 CO 0.00 -0.17 0.00 0.00 -3.33 0.00 0.00 175.10 171.60