#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3n s GLU 3 N 0.00 4.24 -0.69 0.00 -1.05 -1.26 -4.92 118.70 115.02 3h3n s GLU 3 Ca 0.00 1.98 -0.19 0.00 -0.15 0.00 0.00 54.97 56.61 3h3n s GLU 3 Cb 0.00 -3.73 0.11 0.00 -0.44 0.00 0.00 34.13 30.07 3h3n s GLU 3 CO 0.00 -0.68 0.86 0.15 0.95 0.00 0.00 175.26 176.54 3h3n s LYS 4 N 3.08 3.20 -0.06 -4.83 -0.14 -1.26 -4.51 119.74 115.22 3h3n s LYS 4 Ca 0.65 -1.35 0.11 0.00 -1.36 0.00 0.00 55.97 54.02 3h3n s LYS 4 Cb -0.30 -4.39 0.32 0.00 -1.68 0.00 0.00 37.83 31.78 3h3n s LYS 4 CO 0.25 -1.64 1.25 0.09 -0.76 0.00 0.00 175.35 174.54 3h3n n ASN 5 N 6.58 3.00 -3.87 2.83 3.02 -0.90 -4.72 115.26 121.21 3h3n n ASN 5 Ca -0.00 -2.36 -0.09 0.00 -0.03 0.00 0.00 54.58 52.09 3h3n n ASN 5 Cb 0.45 -0.30 -0.08 0.00 -0.61 0.00 0.00 39.78 39.24 3h3n n ASN 5 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3h3n s TYR 6 N -1.65 0.15 0.03 3.10 2.02 -1.08 -3.79 117.35 116.13 3h3n s TYR 6 Ca 0.25 -0.53 0.04 0.00 -0.37 0.00 0.00 57.07 56.47 3h3n s TYR 6 Cb 0.17 -0.07 -0.02 0.00 -0.40 0.00 0.00 41.96 41.65 3h3n s TYR 6 CO 0.10 -0.51 -0.13 0.08 -1.57 0.00 0.00 175.55 173.53 3h3n s VAL 7 N -3.53 1.00 0.00 0.71 1.01 -0.62 0.41 120.40 119.37 3h3n s VAL 7 Ca 0.02 -0.89 0.04 0.00 0.00 0.00 0.00 61.98 61.15 3h3n s VAL 7 Cb 0.04 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.48 3h3n s VAL 7 CO -0.09 0.01 -0.12 -0.32 0.00 0.00 0.00 175.10 174.58 3h3n s MET 8 N -1.00 2.41 -0.06 2.72 1.75 -0.80 -0.95 119.30 123.37 3h3n s MET 8 Ca 0.01 -0.79 0.05 0.00 -1.25 0.00 0.00 55.69 53.71 3h3n s MET 8 Cb -0.07 -2.39 -0.00 0.00 2.84 0.00 0.00 34.83 35.21 3h3n s MET 8 CO 0.01 0.59 -0.21 0.00 -0.65 0.00 0.00 175.02 174.76 3h3n s ALA 9 N -0.91 1.86 -0.16 4.11 0.00 -0.07 -0.79 121.76 125.80 3h3n s ALA 9 Ca 0.15 -0.86 -0.01 0.00 0.00 0.00 0.00 51.96 51.24 3h3n s ALA 9 Cb -0.11 -0.62 -0.01 0.00 0.00 0.00 0.00 23.12 22.39 3h3n s ALA 9 CO 0.05 0.33 -0.13 0.42 0.00 0.00 0.00 175.76 176.43 3h3n s ILE 10 N 0.03 2.87 -0.32 0.00 1.01 -0.09 -1.19 121.20 123.51 3h3n s ILE 10 Ca -0.06 -0.70 0.02 0.00 0.00 0.00 0.00 60.65 59.91 3h3n s ILE 10 Cb -0.14 -2.23 0.09 0.00 0.01 0.00 0.00 42.46 40.19 3h3n s ILE 10 CO 0.04 0.50 0.02 -0.62 0.00 0.00 0.00 174.94 174.88 3h3n s ASP 11 N 0.80 4.75 -0.64 3.58 2.15 0.69 -0.59 116.67 127.41 3h3n s ASP 11 Ca -0.05 -1.85 -0.20 0.00 0.43 0.00 0.00 52.55 50.88 3h3n s ASP 11 Cb -0.15 -1.64 0.10 0.00 -0.30 0.00 0.00 42.92 40.93 3h3n s ASP 11 CO 0.01 -0.34 0.80 -1.58 -0.17 0.00 0.00 175.17 173.89 3h3n s GLN 12 N 1.02 3.12 0.24 4.34 -0.44 -0.41 -0.82 119.66 126.71 3h3n s GLN 12 Ca 0.04 -1.28 -0.01 0.00 -2.50 0.00 0.00 55.36 51.60 3h3n s GLN 12 Cb -0.20 -4.31 0.05 0.00 -1.64 0.00 0.00 33.01 26.91 3h3n s GLN 12 CO -0.06 -1.62 0.33 0.41 0.50 0.00 0.00 175.29 174.86 3h3n n GLY 13 N 5.26 0.23 0.23 2.59 0.00 0.29 -1.00 105.19 112.78 3h3n n GLY 13 Ca -0.05 -1.90 -0.12 0.00 0.00 0.00 0.00 46.02 43.94 3h3n n GLY 13 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3h3n h THR 14 N -0.65 1.29 0.00 2.61 2.02 -1.96 -3.36 112.91 112.85 3h3n h THR 14 Ca -0.11 -1.35 0.00 0.00 0.77 0.00 0.00 66.41 65.72 3h3n h THR 14 Cb 0.37 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.19 3h3n h THR 14 CO 0.11 0.44 0.00 0.35 0.37 0.00 0.00 175.52 176.79 3h3n n THR 15 N -4.28 0.00 -3.60 3.16 -2.24 -1.26 -5.01 114.28 101.06 3h3n n THR 15 Ca -0.03 -0.49 -0.10 0.00 -2.27 0.00 0.00 64.05 61.16 3h3n n THR 15 Cb 0.43 1.01 -0.03 0.00 -2.10 0.00 0.00 70.33 69.64 3h3n n THR 15 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3h3n s SER 16 N -0.23 -0.39 0.19 3.42 1.04 -1.26 -3.06 113.70 113.40 3h3n s SER 16 Ca 0.00 -0.26 0.11 0.00 0.48 0.00 0.00 55.95 56.28 3h3n s SER 16 Cb 0.00 0.59 -0.04 0.00 0.10 0.00 0.00 66.02 66.67 3h3n s SER 16 CO 0.00 -1.02 -0.21 -0.44 0.98 0.00 0.00 173.24 172.55 3h3n s SER 17 N -2.81 3.59 -0.04 7.02 0.01 -0.30 -0.55 113.70 120.62 3h3n s SER 17 Ca 0.05 -0.80 -0.13 0.00 1.31 0.00 0.00 55.95 56.38 3h3n s SER 17 Cb -0.01 -0.35 0.02 0.00 0.21 0.00 0.00 66.02 65.90 3h3n s SER 17 CO -0.07 0.12 0.29 -0.60 0.41 0.00 0.00 173.24 173.39 3h3n s ARG 18 N -2.67 0.57 -0.02 12.44 3.52 -0.00 -1.35 118.95 131.44 3h3n s ARG 18 Ca 0.21 -0.06 0.03 0.00 -0.13 0.00 0.00 55.73 55.77 3h3n s ARG 18 Cb -0.08 0.26 -0.00 0.00 -1.56 0.00 0.00 34.95 33.56 3h3n s ARG 18 CO 0.11 -0.14 -0.09 0.00 -0.81 0.00 0.00 175.30 174.37 3h3n s ALA 19 N -0.97 0.81 -0.01 6.12 0.00 -0.55 -0.22 121.76 126.93 3h3n s ALA 19 Ca -0.10 -0.36 0.01 0.00 0.00 0.00 0.00 51.96 51.50 3h3n s ALA 19 Cb -0.05 -0.26 0.01 0.00 0.00 0.00 0.00 23.12 22.82 3h3n s ALA 19 CO 0.03 0.16 -0.03 0.42 0.00 0.00 0.00 175.76 176.35 3h3n s ILE 20 N -0.01 0.29 -0.18 0.00 1.01 -0.33 -1.78 121.20 120.21 3h3n s ILE 20 Ca 0.00 -0.09 -0.05 0.00 0.00 0.00 0.00 60.65 60.51 3h3n s ILE 20 Cb -0.06 -0.30 -0.03 0.00 0.01 0.00 0.00 42.46 42.08 3h3n s ILE 20 CO 0.00 0.12 0.01 -0.63 0.00 0.00 0.00 174.94 174.44 3h3n s ILE 21 N 0.34 4.27 0.13 2.92 1.01 -0.22 -0.89 121.20 128.75 3h3n s ILE 21 Ca -0.03 -0.22 0.10 0.00 0.00 0.00 0.00 60.65 60.50 3h3n s ILE 21 Cb -0.06 -2.91 -0.04 0.00 0.01 0.00 0.00 42.46 39.46 3h3n s ILE 21 CO -0.01 0.47 -0.20 -0.36 0.00 0.00 0.00 174.94 174.84 3h3n s PHE 22 N 0.50 2.46 0.62 3.97 0.08 -0.13 -0.54 117.98 124.95 3h3n s PHE 22 Ca -0.00 -0.30 0.07 0.00 0.12 0.00 0.00 56.93 56.81 3h3n s PHE 22 Cb -0.14 -1.30 0.10 0.00 -0.57 0.00 0.00 43.02 41.12 3h3n s PHE 22 CO 0.02 0.39 0.86 0.16 -0.10 0.00 0.00 175.22 176.55 3h3n s ASP 23 N -2.20 4.84 0.67 1.36 1.47 -0.72 -1.60 116.67 120.50 3h3n s ASP 23 Ca 0.17 -0.73 0.32 0.00 1.18 0.00 0.00 52.55 53.49 3h3n s ASP 23 Cb -0.10 0.25 1.72 0.00 -0.34 0.00 0.00 42.92 44.46 3h3n s ASP 23 CO 0.09 -1.53 1.97 -0.09 0.68 0.00 0.00 175.17 176.30 3h3n h ARG 24 N -0.05 0.00 -0.15 2.11 9.65 -1.92 0.80 114.38 124.82 3h3n h ARG 24 Ca -0.31 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.57 3h3n h ARG 24 Cb 1.28 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.86 3h3n h ARG 24 CO 0.40 0.00 0.00 0.09 2.80 0.00 0.00 179.97 183.26 3h3n n ASN 25 N -2.91 2.54 0.00 -3.80 3.02 -1.26 -4.93 115.26 107.92 3h3n n ASN 25 Ca -0.02 -1.84 0.00 0.00 -0.03 0.00 0.00 54.58 52.69 3h3n n ASN 25 Cb 0.35 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 3h3n n ASN 25 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h3n n GLY 26 N 1.31 0.51 3.79 7.41 0.00 0.27 -4.98 105.19 113.51 3h3n n GLY 26 Ca 0.17 -0.34 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 3h3n n GLY 26 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h3n s LYS 27 N -0.67 4.35 -0.06 1.61 2.20 -1.26 -4.82 119.74 121.09 3h3n s LYS 27 Ca 0.00 0.90 -0.30 0.00 -0.36 0.00 0.00 55.97 56.21 3h3n s LYS 27 Cb 0.00 -3.26 -0.03 0.00 -1.51 0.00 0.00 37.83 33.03 3h3n s LYS 27 CO 0.00 0.57 1.21 0.21 -0.36 0.00 0.00 175.35 176.99 3h3n s LYS 28 N -0.98 4.34 -0.20 4.03 2.20 -1.26 -1.75 119.74 126.12 3h3n s LYS 28 Ca 0.32 1.68 0.13 0.00 -0.36 0.00 0.00 55.97 57.74 3h3n s LYS 28 Cb -0.21 -3.57 -0.21 0.00 -1.51 0.00 0.00 37.83 32.33 3h3n s LYS 28 CO 0.21 -0.47 -0.01 -0.89 -0.36 0.00 0.00 175.35 173.83 3h3n n ILE 29 N 4.67 1.33 -3.64 5.43 2.08 0.30 -4.98 119.36 124.55 3h3n n ILE 29 Ca 0.11 -0.73 -0.15 0.00 0.56 0.00 0.00 62.75 62.54 3h3n n ILE 29 Cb 0.46 -0.74 -0.08 0.00 -0.75 0.00 0.00 39.64 38.54 3h3n n ILE 29 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 3h3n s GLY 30 N -5.63 -0.43 0.01 7.39 0.00 -1.20 -4.18 107.32 103.28 3h3n s GLY 30 Ca -0.16 1.28 -0.14 0.00 0.00 0.00 0.00 44.72 45.70 3h3n s GLY 30 CO 0.72 1.01 0.29 -0.45 0.00 0.00 0.00 173.10 174.67 3h3n s SER 31 N -0.50 -0.14 -0.13 1.64 0.15 -1.26 -1.06 113.70 112.39 3h3n s SER 31 Ca -0.06 -0.04 -0.17 0.00 0.70 0.00 0.00 55.95 56.38 3h3n s SER 31 Cb -0.03 0.31 0.04 0.00 -1.71 0.00 0.00 66.02 64.64 3h3n s SER 31 CO 0.05 -0.49 0.46 -0.55 1.20 0.00 0.00 173.24 173.90 3h3n s SER 32 N -1.57 -0.44 0.01 5.45 0.15 -0.73 -4.51 113.70 112.05 3h3n s SER 32 Ca -0.11 0.75 0.00 0.00 0.70 0.00 0.00 55.95 57.30 3h3n s SER 32 Cb -0.04 0.79 -0.01 0.00 -1.71 0.00 0.00 66.02 65.05 3h3n s SER 32 CO 0.02 -0.26 -0.02 -1.58 1.20 0.00 0.00 173.24 172.60 3h3n s GLN 33 N -0.19 0.19 -0.16 5.44 0.74 -1.26 -1.49 119.66 122.93 3h3n s GLN 33 Ca -0.04 -0.27 -0.11 0.00 0.05 0.00 0.00 55.36 54.99 3h3n s GLN 33 Cb -0.03 -0.04 0.05 0.00 1.10 0.00 0.00 33.01 34.09 3h3n s GLN 33 CO 0.02 0.00 0.41 0.21 -0.55 0.00 0.00 175.29 175.38 3h3n s LYS 34 N -0.58 0.42 0.65 1.67 2.20 -0.46 -4.98 119.74 118.66 3h3n s LYS 34 Ca -0.05 0.70 -0.11 0.00 -0.36 0.00 0.00 55.97 56.15 3h3n s LYS 34 Cb -0.04 0.07 -0.02 0.00 -1.51 0.00 0.00 37.83 36.33 3h3n s LYS 34 CO -0.00 -0.12 1.05 -1.21 -0.36 0.00 0.00 175.35 174.71 3h3n s GLU 35 N 0.94 3.32 0.04 4.03 2.02 -1.26 -1.15 118.70 126.64 3h3n s GLU 35 Ca -0.06 0.69 -0.01 0.00 0.02 0.00 0.00 54.97 55.61 3h3n s GLU 35 Cb -0.06 -2.05 -0.03 0.00 0.10 0.00 0.00 34.13 32.08 3h3n s GLU 35 CO -0.08 -0.75 -0.02 -0.59 0.02 0.00 0.00 175.26 173.84 3h3n s PHE 36 N -3.21 0.40 0.25 1.61 -0.12 -1.17 -4.90 117.98 110.83 3h3n s PHE 36 Ca 0.56 -0.83 -0.30 0.00 -0.05 0.00 0.00 56.93 56.31 3h3n s PHE 36 Cb -0.11 -0.30 -0.14 0.00 -0.63 0.00 0.00 43.02 41.84 3h3n s PHE 36 CO 0.54 -0.31 1.17 -2.30 -0.05 0.00 0.00 175.22 174.27 3h3n n PRO 37 N 0.72 1.53 -4.75 1.99 -0.02 -1.26 -4.84 135.00 128.37 3h3n n PRO 37 Ca -0.18 0.54 -0.33 0.00 -2.02 0.00 0.00 63.50 61.51 3h3n n PRO 37 Cb 0.59 -2.03 -0.13 0.00 -0.02 0.00 0.00 33.50 31.90 3h3n n PRO 37 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3h3n s GLN 38 N -1.01 3.14 -0.07 -0.52 -1.52 -1.26 -4.60 119.66 113.82 3h3n s GLN 38 Ca 0.64 -0.66 0.04 0.00 -1.95 0.00 0.00 55.36 53.44 3h3n s GLN 38 Cb -0.72 -2.60 -0.02 0.00 -0.22 0.00 0.00 33.01 29.46 3h3n s GLN 38 CO 0.56 0.36 -0.19 0.71 -0.25 0.00 0.00 175.29 176.48 3h3n s TYR 39 N -0.03 2.62 -0.55 0.91 2.02 -0.42 -5.00 117.35 116.90 3h3n s TYR 39 Ca -0.02 -0.53 0.06 0.00 -0.37 0.00 0.00 57.07 56.20 3h3n s TYR 39 Cb -0.14 -1.67 0.22 0.00 -0.40 0.00 0.00 41.96 39.97 3h3n s TYR 39 CO 0.04 -0.09 0.56 1.19 -1.57 0.00 0.00 175.55 175.67 3h3n n PHE 40 N 2.91 1.65 0.27 2.71 3.72 -1.26 -0.88 117.46 126.58 3h3n n PHE 40 Ca -0.18 -3.88 0.13 0.00 -0.05 0.00 0.00 57.45 53.48 3h3n n PHE 40 Cb 0.52 -0.37 0.81 0.00 -0.94 0.00 0.00 39.48 39.51 3h3n n PHE 40 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3h3n h PRO 41 N 4.67 0.00 -3.04 -1.08 0.13 -1.98 -3.44 132.00 127.27 3h3n h PRO 41 Ca 0.17 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.20 3h3n h PRO 41 Cb 0.79 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 31.74 3h3n h PRO 41 CO 0.62 0.00 -0.18 0.21 -0.23 0.00 0.00 178.00 178.43 3h3n s LYS 42 N -4.79 0.82 -0.11 0.86 2.20 -1.26 -5.05 119.74 112.41 3h3n s LYS 42 Ca -0.05 -0.31 -0.36 0.00 -0.36 0.00 0.00 55.97 54.89 3h3n s LYS 42 Cb 0.16 0.36 -0.14 0.00 -1.51 0.00 0.00 37.83 36.71 3h3n s LYS 42 CO 0.59 -0.26 1.76 0.45 -0.36 0.00 0.00 175.35 177.53 3h3n n SER 43 N 0.78 2.93 0.00 1.43 2.88 -1.26 -0.23 113.62 120.15 3h3n n SER 43 Ca -0.19 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.37 3h3n n SER 43 Cb 0.58 -1.29 0.00 0.00 -0.75 0.00 0.00 64.21 62.75 3h3n n SER 43 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3h3n n GLY 44 N 4.07 2.03 3.78 0.46 0.00 -1.26 -4.99 105.19 109.29 3h3n n GLY 44 Ca 0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 3h3n n GLY 44 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3h3n s TRP 45 N -2.40 3.72 -0.05 1.61 0.52 0.68 -1.13 118.94 121.89 3h3n s TRP 45 Ca 0.00 1.19 -0.01 0.00 0.02 0.00 0.00 56.10 57.30 3h3n s TRP 45 Cb 0.00 -2.53 0.03 0.00 -1.15 0.00 0.00 33.47 29.81 3h3n s TRP 45 CO 0.00 0.46 0.00 0.08 0.02 0.00 0.00 176.95 177.51 3h3n s VAL 46 N -0.57 0.29 0.07 4.03 1.01 -1.26 -4.31 120.40 119.66 3h3n s VAL 46 Ca 0.29 0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.41 3h3n s VAL 46 Cb -0.18 -0.43 -0.03 0.00 0.00 0.00 0.00 36.38 35.74 3h3n s VAL 46 CO 0.17 0.22 -0.07 -1.61 0.00 0.00 0.00 175.10 173.81 3h3n s GLU 47 N 1.62 0.69 0.08 2.72 2.02 -0.06 -2.11 118.70 123.67 3h3n s GLU 47 Ca -0.01 -1.08 0.06 0.00 0.02 0.00 0.00 54.97 53.96 3h3n s GLU 47 Cb -0.13 -0.22 -0.03 0.00 0.10 0.00 0.00 34.13 33.85 3h3n s GLU 47 CO -0.03 0.01 -0.17 -1.01 0.02 0.00 0.00 175.26 174.08 3h3n s HIS 48 N -2.68 1.42 -0.36 1.61 3.76 -0.61 -1.31 115.29 117.13 3h3n s HIS 48 Ca 0.02 -0.45 -0.20 0.00 -0.15 0.00 0.00 55.06 54.28 3h3n s HIS 48 Cb -0.01 -0.79 0.00 0.00 1.11 0.00 0.00 32.58 32.89 3h3n s HIS 48 CO -0.03 0.11 0.63 1.21 -0.85 0.00 0.00 174.74 175.81 3h3n s ASN 49 N -1.80 6.42 0.55 1.40 3.84 -1.26 0.48 114.94 124.56 3h3n s ASN 49 Ca 0.01 0.14 0.23 0.00 0.21 0.00 0.00 52.86 53.45 3h3n s ASN 49 Cb -0.10 -2.32 1.47 0.00 -0.55 0.00 0.00 41.25 39.75 3h3n s ASN 49 CO 0.03 -0.59 2.13 0.00 -2.79 0.00 0.00 177.10 175.88 3h3n h ALA 50 N 8.46 1.96 -0.01 1.71 0.00 -1.93 -0.54 119.26 128.91 3h3n h ALA 50 Ca -0.26 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.45 3h3n h ALA 50 Cb 1.11 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 3h3n h ALA 50 CO 0.83 -0.18 -0.84 -0.91 0.00 0.00 0.00 179.25 178.16 3h3n h ASN 51 N 0.00 0.31 0.34 0.00 2.35 -1.97 -1.92 115.58 114.69 3h3n h ASN 51 Ca 0.06 -0.24 -0.15 0.00 -0.55 0.00 0.00 56.30 55.42 3h3n h ASN 51 Cb 0.28 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 3h3n h ASN 51 CO -0.00 1.02 -0.61 -0.33 -1.65 0.00 0.00 177.43 175.86 3h3n h GLU 52 N 0.15 0.27 -0.34 0.81 5.08 -1.56 -1.02 114.58 117.97 3h3n h GLU 52 Ca -0.04 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.10 3h3n h GLU 52 Cb 1.45 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.71 3h3n h GLU 52 CO 0.13 0.80 0.09 0.82 -1.00 0.00 0.00 179.01 179.85 3h3n h ILE 53 N 0.20 1.22 -0.68 3.13 2.04 -1.12 -1.13 117.51 121.17 3h3n h ILE 53 Ca -0.01 -0.72 0.02 0.00 1.00 0.00 0.00 64.86 65.16 3h3n h ILE 53 Cb 1.12 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 38.21 3h3n h ILE 53 CO 0.10 0.24 0.43 -0.25 0.00 0.00 0.00 178.15 178.67 3h3n h TRP 54 N 0.39 0.81 -0.36 1.37 -0.00 -1.06 -1.71 115.95 115.39 3h3n h TRP 54 Ca 0.11 0.02 -0.06 0.00 -0.00 0.00 0.00 58.89 58.95 3h3n h TRP 54 Cb 0.28 -0.27 -0.02 0.00 -0.00 0.00 0.00 29.16 29.16 3h3n h TRP 54 CO 0.01 0.47 -0.05 -0.91 -0.00 0.00 0.00 178.44 177.97 3h3n h ASN 55 N 0.85 0.55 0.11 2.65 2.35 -0.91 -0.99 115.58 120.19 3h3n h ASN 55 Ca 0.27 -0.12 -0.08 0.00 -0.55 0.00 0.00 56.30 55.81 3h3n h ASN 55 Cb -0.01 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 3h3n h ASN 55 CO -0.09 0.65 -0.28 0.77 -1.65 0.00 0.00 177.43 176.83 3h3n h SER 56 N 0.54 0.27 -0.21 5.81 4.64 -0.44 -0.69 113.55 123.46 3h3n h SER 56 Ca 0.11 -0.09 -0.20 0.00 -0.47 0.00 0.00 61.79 61.14 3h3n h SER 56 Cb 0.42 -0.07 0.01 0.00 -0.31 0.00 0.00 62.40 62.44 3h3n h SER 56 CO 0.02 0.55 -0.64 0.58 -0.87 0.00 0.00 176.83 176.48 3h3n h VAL 57 N 0.24 1.28 -0.92 0.95 2.07 -0.74 -1.99 116.25 117.15 3h3n h VAL 57 Ca 0.04 -1.83 -0.02 0.00 0.82 0.00 0.00 66.70 65.71 3h3n h VAL 57 Cb 0.63 1.83 -0.04 0.00 -1.52 0.00 0.00 31.29 32.18 3h3n h VAL 57 CO 0.05 0.59 0.51 1.56 0.02 0.00 0.00 177.57 180.30 3h3n h GLN 58 N 0.56 1.27 -0.31 1.57 4.20 -0.87 -1.61 115.11 119.92 3h3n h GLN 58 Ca -0.02 -0.14 -0.03 0.00 0.06 0.00 0.00 58.65 58.52 3h3n h GLN 58 Cb 1.26 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 28.77 3h3n h GLN 58 CO 0.14 0.92 0.09 0.77 -0.67 0.00 0.00 178.83 180.08 3h3n h SER 59 N 1.28 0.45 0.77 1.46 0.02 -0.95 -2.55 113.55 114.03 3h3n h SER 59 Ca 0.32 -0.21 -0.14 0.00 -0.84 0.00 0.00 61.79 60.92 3h3n h SER 59 Cb 0.01 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 3h3n h SER 59 CO -0.05 0.54 -0.66 -0.37 -1.14 0.00 0.00 176.83 175.15 3h3n h VAL 60 N 0.33 1.39 -0.20 2.27 -1.51 -1.21 0.38 116.25 117.71 3h3n h VAL 60 Ca 0.10 -2.31 -0.01 0.00 -1.23 0.00 0.00 66.70 63.24 3h3n h VAL 60 Cb 0.26 2.27 -0.01 0.00 -2.13 0.00 0.00 31.29 31.68 3h3n h VAL 60 CO -0.00 0.64 0.07 0.40 -1.23 0.00 0.00 177.57 177.46 3h3n h ILE 61 N 0.00 1.17 -0.39 7.19 2.04 -1.26 0.19 117.51 126.46 3h3n h ILE 61 Ca -0.01 -0.54 -0.02 0.00 1.00 0.00 0.00 64.86 65.30 3h3n h ILE 61 Cb 1.22 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 38.44 3h3n h ILE 61 CO 0.09 0.17 0.15 0.00 0.00 0.00 0.00 178.15 178.56 3h3n h ALA 62 N 0.91 0.50 -0.99 1.87 0.00 -1.32 -2.45 119.26 117.77 3h3n h ALA 62 Ca 0.07 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 54.92 3h3n h ALA 62 Cb 0.20 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 3h3n h ALA 62 CO -0.00 0.10 0.64 0.78 0.00 0.00 0.00 179.25 180.77 3h3n h GLY 63 N 0.48 1.53 0.99 0.00 0.00 -0.64 0.30 103.07 105.73 3h3n h GLY 63 Ca 0.13 -0.45 -0.09 0.00 0.00 0.00 0.00 47.33 46.92 3h3n h GLY 63 CO -0.01 0.28 -0.07 0.00 0.00 0.00 0.00 176.54 176.74 3h3n h ALA 64 N 1.49 0.59 -0.59 3.60 0.00 -0.71 -1.26 119.26 122.39 3h3n h ALA 64 Ca 0.45 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 3h3n h ALA 64 Cb 0.28 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3h3n h ALA 64 CO -0.20 0.44 0.13 0.74 0.00 0.00 0.00 179.25 180.37 3h3n h PHE 65 N 0.64 1.01 -0.48 0.00 0.04 -0.95 -1.54 116.94 115.66 3h3n h PHE 65 Ca 0.12 -0.13 -0.01 0.00 2.80 0.00 0.00 57.97 60.74 3h3n h PHE 65 Cb 0.59 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.43 3h3n h PHE 65 CO 0.05 0.86 0.25 0.82 -0.60 0.00 0.00 178.31 179.69 3h3n h ILE 66 N 0.86 1.18 -0.20 -0.55 2.04 -0.72 0.89 117.51 121.02 3h3n h ILE 66 Ca 0.18 -0.49 -0.12 0.00 1.00 0.00 0.00 64.86 65.44 3h3n h ILE 66 Cb 0.37 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 3h3n h ILE 66 CO 0.01 0.20 -0.38 -0.08 0.00 0.00 0.00 178.15 177.89 3h3n h GLU 67 N 0.64 0.45 0.07 2.37 4.81 -1.11 -3.25 114.58 118.56 3h3n h GLU 67 Ca 0.17 -0.22 -0.25 0.00 -0.13 0.00 0.00 59.36 58.93 3h3n h GLU 67 Cb 0.09 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 3h3n h GLU 67 CO -0.02 0.77 -1.19 0.66 -0.73 0.00 0.00 179.01 178.49 3h3n h SER 68 N 0.38 0.24 -0.09 1.04 4.64 -1.08 -3.46 113.55 115.22 3h3n h SER 68 Ca 0.04 -0.27 -0.04 0.00 -0.47 0.00 0.00 61.79 61.05 3h3n h SER 68 Cb 0.84 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.83 3h3n h SER 68 CO 0.07 1.21 -0.04 0.61 -0.87 0.00 0.00 176.83 177.82 3h3n n GLY 69 N 1.47 0.54 3.85 -0.77 0.00 0.29 -4.94 105.19 105.64 3h3n n GLY 69 Ca -0.06 -0.46 -0.34 0.00 0.00 0.00 0.00 46.02 45.16 3h3n n GLY 69 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3n s ILE 70 N -1.98 4.84 0.21 -0.61 -1.09 -1.25 -5.08 121.20 116.24 3h3n s ILE 70 Ca 0.00 0.76 -0.17 0.00 -2.23 0.00 0.00 60.65 59.01 3h3n s ILE 70 Cb 0.00 -3.69 -0.08 0.00 -1.58 0.00 0.00 42.46 37.11 3h3n s ILE 70 CO 0.00 0.08 0.66 -0.13 -1.23 0.00 0.00 174.94 174.32 3h3n s ARG 71 N -2.37 4.11 0.45 2.79 0.52 -1.26 -4.89 118.95 118.30 3h3n s ARG 71 Ca 0.43 0.69 0.13 0.00 -0.52 0.00 0.00 55.73 56.46 3h3n s ARG 71 Cb -0.13 -2.84 1.04 0.00 0.52 0.00 0.00 34.95 33.54 3h3n s ARG 71 CO 0.20 0.39 2.05 -1.35 0.02 0.00 0.00 175.30 176.61 3h3n h PRO 72 N 3.30 0.34 0.00 3.54 0.11 -1.93 -1.13 132.00 136.23 3h3n h PRO 72 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3h3n h PRO 72 Cb 1.19 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3h3n h PRO 72 CO 0.66 0.22 0.00 -0.85 -0.21 0.00 0.00 178.00 177.82 3h3n n GLU 73 N -4.48 0.18 -0.10 1.05 0.28 -1.26 -1.83 120.64 114.48 3h3n n GLU 73 Ca 0.04 0.17 0.12 0.00 -0.16 0.00 0.00 57.16 57.33 3h3n n GLU 73 Cb 0.21 -1.50 0.21 0.00 1.43 0.00 0.00 31.44 31.79 3h3n n GLU 73 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3h3n n ALA 74 N -1.28 2.46 -2.67 -1.84 0.00 -0.43 -4.67 120.51 112.08 3h3n n ALA 74 Ca 0.06 -0.79 -0.41 0.00 0.00 0.00 0.00 53.44 52.30 3h3n n ALA 74 Cb 0.10 -0.90 -0.05 0.00 0.00 0.00 0.00 19.45 18.60 3h3n n ALA 74 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3h3n s ILE 75 N -1.75 4.96 0.06 0.00 -1.09 -0.76 -2.11 121.20 120.52 3h3n s ILE 75 Ca 0.34 1.40 0.09 0.00 -2.23 0.00 0.00 60.65 60.25 3h3n s ILE 75 Cb 0.21 -4.03 -0.18 0.00 -1.58 0.00 0.00 42.46 36.88 3h3n s ILE 75 CO 0.31 0.09 1.23 0.00 -1.23 0.00 0.00 174.94 175.34 3h3n h ALA 76 N 7.34 0.44 -1.72 9.38 0.00 -0.33 -3.46 119.26 130.90 3h3n h ALA 76 Ca -0.32 -0.91 0.22 0.00 0.00 0.00 0.00 54.91 53.90 3h3n h ALA 76 Cb 1.14 -0.07 -0.17 0.00 0.00 0.00 0.00 17.79 18.69 3h3n h ALA 76 CO 0.80 1.20 0.72 0.20 0.00 0.00 0.00 179.25 182.17 3h3n s GLY 77 N -4.72 -0.35 -0.04 0.00 0.00 -1.26 -4.54 107.32 96.41 3h3n s GLY 77 Ca 0.01 1.27 0.06 0.00 0.00 0.00 0.00 44.72 46.06 3h3n s GLY 77 CO 0.81 0.41 -0.24 -0.42 0.00 0.00 0.00 173.10 173.66 3h3n s ILE 78 N -2.64 1.96 -0.03 0.90 1.01 -0.08 -1.90 121.20 120.42 3h3n s ILE 78 Ca 0.09 -1.03 0.05 0.00 0.00 0.00 0.00 60.65 59.76 3h3n s ILE 78 Cb -0.00 -1.65 -0.03 0.00 0.01 0.00 0.00 42.46 40.79 3h3n s ILE 78 CO -0.05 0.55 -0.17 -0.83 0.00 0.00 0.00 174.94 174.44 3h3n s GLY 79 N -0.26 1.50 -0.07 6.18 0.00 0.03 -1.52 107.32 113.18 3h3n s GLY 79 Ca 0.00 -1.04 0.03 0.00 0.00 0.00 0.00 44.72 43.71 3h3n s GLY 79 CO 0.02 -0.86 -0.18 -0.42 0.00 0.00 0.00 173.10 171.67 3h3n s ILE 80 N -0.76 1.58 0.09 0.90 1.01 0.32 -0.91 121.20 123.43 3h3n s ILE 80 Ca 0.12 -0.75 0.04 0.00 0.00 0.00 0.00 60.65 60.06 3h3n s ILE 80 Cb -0.10 -1.38 -0.03 0.00 0.01 0.00 0.00 42.46 40.95 3h3n s ILE 80 CO 0.01 0.45 -0.12 0.28 0.00 0.00 0.00 174.94 175.57 3h3n s THR 81 N 0.39 1.01 0.16 2.92 -1.32 0.24 -2.19 115.64 116.86 3h3n s THR 81 Ca -0.14 -1.50 -0.16 0.00 -1.21 0.00 0.00 61.69 58.68 3h3n s THR 81 Cb -0.16 -1.23 0.03 0.00 -1.51 0.00 0.00 72.50 69.63 3h3n s THR 81 CO 0.05 -0.42 0.46 0.54 -2.21 0.00 0.00 174.62 173.04 3h3n s ASN 82 N -2.16 -0.23 0.25 8.08 4.22 -1.19 -1.28 114.94 122.63 3h3n s ASN 82 Ca 0.02 -0.44 -0.31 0.00 -2.14 0.00 0.00 52.86 49.99 3h3n s ASN 82 Cb -0.06 0.53 -0.11 0.00 1.28 0.00 0.00 41.25 42.88 3h3n s ASN 82 CO 0.01 -0.96 1.64 0.00 -2.04 0.00 0.00 177.10 175.75 3h3n s GLN 83 N -3.85 4.13 0.77 3.55 -2.07 -0.17 -0.32 119.66 121.69 3h3n s GLN 83 Ca 0.07 2.57 -0.07 0.00 -1.82 0.00 0.00 55.36 56.11 3h3n s GLN 83 Cb 0.00 -3.05 0.11 0.00 -1.09 0.00 0.00 33.01 28.99 3h3n s GLN 83 CO -0.06 -0.67 1.08 1.03 -1.32 0.00 0.00 175.29 175.35 3h3n s ARG 84 N 0.22 1.68 0.00 9.60 0.52 -1.26 -4.46 118.95 125.24 3h3n s ARG 84 Ca 0.68 -0.53 0.00 0.00 -0.52 0.00 0.00 55.73 55.35 3h3n s ARG 84 Cb -0.48 -2.14 0.00 0.00 0.52 0.00 0.00 34.95 32.85 3h3n s ARG 84 CO 0.41 -1.57 0.00 0.39 0.02 0.00 0.00 175.30 174.55 3h3n n GLU 85 N -3.09 0.00 -1.54 3.54 4.71 -1.26 -4.40 120.64 118.59 3h3n n GLU 85 Ca 0.12 0.00 -0.57 0.00 -0.01 0.00 0.00 57.16 56.69 3h3n n GLU 85 Cb 0.60 -0.41 -0.07 0.00 -1.01 0.00 0.00 31.44 30.55 3h3n n GLU 85 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 3h3n n THR 86 N 0.00 0.00 -4.85 2.62 -1.04 -1.26 -4.07 114.28 105.68 3h3n n THR 86 Ca 0.00 -0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.68 3h3n n THR 86 Cb 0.00 -0.29 -0.14 0.00 -1.82 0.00 0.00 70.33 68.08 3h3n n THR 86 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 3h3n s THR 87 N 0.30 2.99 -0.01 12.58 2.01 -0.17 -3.70 115.64 129.63 3h3n s THR 87 Ca 0.90 -0.71 0.07 0.00 0.31 0.00 0.00 61.69 62.25 3h3n s THR 87 Cb -1.18 -2.21 -0.02 0.00 0.01 0.00 0.00 72.50 69.10 3h3n s THR 87 CO 0.55 0.55 -0.21 -0.69 -0.69 0.00 0.00 174.62 174.13 3h3n s VAL 88 N -0.07 1.68 -0.08 3.82 1.01 -0.05 -1.81 120.40 124.90 3h3n s VAL 88 Ca -0.03 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.04 3h3n s VAL 88 Cb -0.14 -1.40 0.02 0.00 0.00 0.00 0.00 36.38 34.85 3h3n s VAL 88 CO 0.04 0.46 -0.11 -0.69 0.00 0.00 0.00 175.10 174.80 3h3n s VAL 89 N -0.52 1.10 0.13 2.92 1.01 -1.26 -1.25 120.40 122.53 3h3n s VAL 89 Ca 0.08 -0.43 -0.01 0.00 0.00 0.00 0.00 61.98 61.62 3h3n s VAL 89 Cb -0.08 -1.03 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 3h3n s VAL 89 CO -0.01 0.36 0.06 -1.66 0.00 0.00 0.00 175.10 173.85 3h3n s TRP 90 N 0.92 0.84 -0.13 5.22 -2.14 -0.11 -1.36 118.94 122.18 3h3n s TRP 90 Ca -0.10 -1.22 -0.27 0.00 2.66 0.00 0.00 56.10 57.17 3h3n s TRP 90 Cb -0.15 -0.47 -0.02 0.00 -3.10 0.00 0.00 33.47 29.73 3h3n s TRP 90 CO 0.01 -0.52 0.89 0.34 -2.66 0.00 0.00 176.95 175.01 3h3n s ASP 91 N -3.04 7.08 0.30 -2.66 -1.08 -0.70 -0.19 116.67 116.38 3h3n s ASP 91 Ca 0.23 1.32 -0.02 0.00 -0.52 0.00 0.00 52.55 53.57 3h3n s ASP 91 Cb 0.07 -2.49 0.45 0.00 -1.46 0.00 0.00 42.92 39.49 3h3n s ASP 91 CO 0.01 -0.39 1.96 0.07 0.52 0.00 0.00 175.17 177.34 3h3n h LYS 92 N 7.18 1.06 -0.02 4.34 2.10 -1.67 0.64 116.57 130.19 3h3n h LYS 92 Ca -0.31 -0.08 -0.07 0.00 -2.00 0.00 0.00 60.65 58.19 3h3n h LYS 92 Cb 1.14 -0.23 0.00 0.00 -0.90 0.00 0.00 32.23 32.25 3h3n h LYS 92 CO 0.84 0.72 -0.27 1.15 -2.00 0.00 0.00 179.45 179.88 3h3n h THR 93 N 1.08 1.50 0.00 0.07 2.02 -1.93 -3.35 112.91 112.31 3h3n h THR 93 Ca 0.29 -1.86 -0.09 0.00 0.77 0.00 0.00 66.41 65.52 3h3n h THR 93 Cb -0.09 2.63 -0.01 0.00 -1.74 0.00 0.00 68.15 68.94 3h3n h THR 93 CO -0.06 0.52 -1.14 0.71 0.37 0.00 0.00 175.52 175.92 3h3n h THR 94 N -0.40 0.28 -0.13 3.16 1.35 -1.94 -3.48 112.91 111.75 3h3n h THR 94 Ca -0.03 -1.53 -0.06 0.00 -0.55 0.00 0.00 66.41 64.25 3h3n h THR 94 Cb 0.99 1.81 -0.02 0.00 -1.73 0.00 0.00 68.15 69.20 3h3n h THR 94 CO 0.05 0.16 -0.05 0.61 -0.25 0.00 0.00 175.52 176.04 3h3n n GLY 95 N 1.28 0.57 3.70 5.82 0.00 0.22 -5.00 105.19 111.78 3h3n n GLY 95 Ca -0.04 -0.32 -0.38 0.00 0.00 0.00 0.00 46.02 45.27 3h3n n GLY 95 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h3n s GLN 96 N -1.43 4.24 0.59 1.61 -1.52 -1.24 -4.78 119.66 117.13 3h3n s GLN 96 Ca 0.00 0.25 -0.20 0.00 -1.95 0.00 0.00 55.36 53.46 3h3n s GLN 96 Cb 0.00 -3.49 -0.03 0.00 -0.22 0.00 0.00 33.01 29.27 3h3n s GLN 96 CO 0.00 0.07 1.33 -2.30 -0.25 0.00 0.00 175.29 174.14 3h3n n PRO 97 N 4.08 1.45 0.05 2.91 -0.02 -1.26 -1.71 135.00 140.50 3h3n n PRO 97 Ca -0.09 0.54 0.13 0.00 -2.02 0.00 0.00 63.50 62.07 3h3n n PRO 97 Cb 0.51 -2.56 0.50 0.00 -0.02 0.00 0.00 33.50 31.94 3h3n n PRO 97 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 3h3n n ILE 98 N -1.41 0.36 -3.96 4.25 -5.35 -0.46 -4.86 119.36 107.93 3h3n n ILE 98 Ca 0.13 -0.10 0.02 0.00 -0.27 0.00 0.00 62.75 62.52 3h3n n ILE 98 Cb 0.46 -0.60 0.01 0.00 -1.74 0.00 0.00 39.64 37.77 3h3n n ILE 98 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3h3n n ALA 99 N -1.64 -2.11 -1.36 -1.28 0.00 -1.26 -5.06 120.51 107.81 3h3n n ALA 99 Ca 0.06 -0.44 -0.34 0.00 0.00 0.00 0.00 53.44 52.72 3h3n n ALA 99 Cb 0.37 0.06 0.09 0.00 0.00 0.00 0.00 19.45 19.97 3h3n n ALA 99 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3h3n s ASN 100 N -2.64 4.31 0.46 0.00 0.01 -1.26 -4.81 114.94 111.02 3h3n s ASN 100 Ca 0.18 2.28 -0.21 0.00 -0.71 0.00 0.00 52.86 54.40 3h3n s ASN 100 Cb -0.00 -2.58 -0.09 0.00 0.41 0.00 0.00 41.25 38.98 3h3n s ASN 100 CO -0.01 -2.18 1.00 0.00 -1.51 0.00 0.00 177.10 174.41 3h3n s ALA 101 N -2.08 2.94 -0.27 0.60 0.00 0.18 -4.88 121.76 118.24 3h3n s ALA 101 Ca 0.73 0.52 -0.10 0.00 0.00 0.00 0.00 51.96 53.11 3h3n s ALA 101 Cb -0.27 -3.21 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 3h3n s ALA 101 CO 0.45 -0.13 0.16 0.42 0.00 0.00 0.00 175.76 176.66 3h3n s ILE 102 N -2.06 5.09 0.57 0.00 1.01 -0.75 -1.57 121.20 123.48 3h3n s ILE 102 Ca 0.65 0.09 -0.17 0.00 0.00 0.00 0.00 60.65 61.22 3h3n s ILE 102 Cb -0.13 -3.42 -0.05 0.00 0.01 0.00 0.00 42.46 38.87 3h3n s ILE 102 CO 0.17 0.26 1.06 -0.69 0.00 0.00 0.00 174.94 175.75 3h3n s VAL 103 N 1.73 3.73 0.56 2.92 1.01 -0.90 -1.00 120.40 128.45 3h3n s VAL 103 Ca 0.07 0.89 0.26 0.00 0.00 0.00 0.00 61.98 63.20 3h3n s VAL 103 Cb -0.16 -3.38 0.38 0.00 0.00 0.00 0.00 36.38 33.22 3h3n s VAL 103 CO 0.09 -0.42 2.02 4.11 0.00 0.00 0.00 175.10 180.90 3h3n h TRP 104 N 0.71 0.00 0.00 5.22 5.08 -1.84 -0.89 115.95 124.22 3h3n h TRP 104 Ca -0.48 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 59.47 3h3n h TRP 104 Cb 1.22 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.38 3h3n h TRP 104 CO 0.57 0.00 -0.12 1.96 -1.28 0.00 0.00 178.44 179.58 3h3n h GLN 105 N 0.00 0.00 -6.94 0.12 4.20 -1.90 -3.42 115.11 107.17 3h3n h GLN 105 Ca 0.18 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.37 3h3n h GLN 105 Cb 0.84 0.00 0.09 0.00 0.30 0.00 0.00 27.48 28.70 3h3n h GLN 105 CO -0.00 0.12 0.63 0.45 -0.67 0.00 0.00 178.83 179.36 3h3n s SER 106 N -6.01 6.32 0.00 1.46 0.15 -0.34 -4.80 113.70 110.47 3h3n s SER 106 Ca 0.02 2.71 0.10 0.00 0.70 0.00 0.00 55.95 59.48 3h3n s SER 106 Cb 0.09 -2.64 0.25 0.00 -1.71 0.00 0.00 66.02 62.00 3h3n s SER 106 CO 0.61 -0.85 1.15 0.54 1.20 0.00 0.00 173.24 175.89 3h3n n ARG 107 N 0.19 2.32 0.25 5.44 5.12 -0.28 -4.60 116.66 125.09 3h3n n ARG 107 Ca 0.03 -1.82 0.16 0.00 -1.93 0.00 0.00 57.85 54.29 3h3n n ARG 107 Cb 0.43 -1.25 0.88 0.00 -1.16 0.00 0.00 32.46 31.36 3h3n n ARG 107 CO 0.00 0.00 0.00 -0.56 -1.93 0.00 0.00 177.63 175.14 3h3n h GLN 108 N 1.99 0.00 -0.65 5.56 3.07 -1.93 -1.11 115.11 122.04 3h3n h GLN 108 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3h3n h GLN 108 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.22 3h3n h GLN 108 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 178.83 177.79 3h3n n SER 109 N -3.81 4.78 0.01 0.06 3.41 -1.26 -4.54 113.62 112.27 3h3n n SER 109 Ca -0.01 -2.48 0.02 0.00 -0.26 0.00 0.00 58.87 56.14 3h3n n SER 109 Cb 0.21 -0.59 0.37 0.00 -0.26 0.00 0.00 64.21 63.94 3h3n n SER 109 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3h3n h SER 110 N 4.02 0.46 -0.19 4.04 4.64 -1.55 -2.22 113.55 122.76 3h3n h SER 110 Ca 0.00 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.26 3h3n h SER 110 Cb 1.48 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.44 3h3n h SER 110 CO 0.26 0.43 0.10 -0.65 -0.87 0.00 0.00 176.83 176.10 3h3n h PRO 111 N 0.52 0.30 -0.19 4.77 0.11 -1.82 0.17 132.00 135.86 3h3n h PRO 111 Ca 0.13 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 66.09 3h3n h PRO 111 Cb 0.12 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.17 3h3n h PRO 111 CO -0.01 0.25 -0.36 0.82 -0.21 0.00 0.00 178.00 178.48 3h3n h ILE 112 N 0.31 1.34 -0.41 4.15 2.04 -1.75 -2.40 117.51 120.78 3h3n h ILE 112 Ca 0.08 -1.60 -0.02 0.00 1.00 0.00 0.00 64.86 64.32 3h3n h ILE 112 Cb 0.05 1.90 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 3h3n h ILE 112 CO -0.01 0.49 0.19 0.00 0.00 0.00 0.00 178.15 178.83 3h3n h ALA 113 N 0.59 0.53 -0.65 1.87 0.00 -1.07 -2.33 119.26 118.20 3h3n h ALA 113 Ca 0.01 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.86 3h3n h ALA 113 Cb 0.96 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 3h3n h ALA 113 CO 0.08 0.09 0.37 -0.44 0.00 0.00 0.00 179.25 179.35 3h3n h ASP 114 N 0.52 0.56 -0.91 0.00 3.32 -0.68 -1.91 116.42 117.32 3h3n h ASP 114 Ca 0.14 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 3h3n h ASP 114 Cb 0.13 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.54 3h3n h ASP 114 CO -0.02 0.37 0.54 -0.61 -1.72 0.00 0.00 179.24 177.81 3h3n h GLN 115 N 0.69 1.23 -0.58 3.56 5.75 -1.18 -1.54 115.11 123.04 3h3n h GLN 115 Ca 0.28 -0.11 -0.01 0.00 -0.15 0.00 0.00 58.65 58.66 3h3n h GLN 115 Cb 0.14 -0.26 -0.03 0.00 1.07 0.00 0.00 27.48 28.41 3h3n h GLN 115 CO -0.16 0.86 0.32 -0.07 -2.65 0.00 0.00 178.83 177.13 3h3n h LEU 116 N 1.25 0.70 -0.18 -2.39 3.38 -0.82 -2.34 115.31 114.92 3h3n h LEU 116 Ca 0.32 -0.05 -0.12 0.00 0.09 0.00 0.00 57.88 58.13 3h3n h LEU 116 Cb -0.05 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.52 3h3n h LEU 116 CO -0.06 0.56 -0.35 0.11 0.09 0.00 0.00 178.44 178.79 3h3n h LYS 117 N 0.80 0.55 -0.19 1.13 1.57 -0.81 -2.85 116.57 116.78 3h3n h LYS 117 Ca 0.21 -0.36 0.04 0.00 -1.87 0.00 0.00 60.65 58.67 3h3n h LYS 117 Cb 0.01 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3h3n h LYS 117 CO -0.03 0.97 0.13 0.28 -0.57 0.00 0.00 179.45 180.23 3h3n h VAL 118 N 0.21 0.94 0.00 0.50 2.07 -1.00 0.12 116.25 119.08 3h3n h VAL 118 Ca 0.01 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.51 3h3n h VAL 118 Cb 0.95 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 3h3n h VAL 118 CO 0.08 0.01 0.00 0.47 0.02 0.00 0.00 177.57 178.15 3h3n n ASP 119 N -4.49 0.00 -0.44 0.57 8.00 -0.91 -4.91 116.55 114.38 3h3n n ASP 119 Ca 0.01 -0.81 -0.04 0.00 0.71 0.00 0.00 54.79 54.66 3h3n n ASP 119 Cb 0.23 -0.05 -0.01 0.00 -0.02 0.00 0.00 41.12 41.27 3h3n n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h3n n GLY 120 N 0.93 0.39 0.23 0.44 0.00 0.43 -4.95 105.19 102.66 3h3n n GLY 120 Ca 0.21 -0.77 0.14 0.00 0.00 0.00 0.00 46.02 45.61 3h3n n GLY 120 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3h3n n HIS 121 N -3.57 0.00 0.02 1.61 8.25 -1.08 -4.46 115.22 115.99 3h3n n HIS 121 Ca -0.05 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.27 3h3n n HIS 121 Cb 0.39 -0.07 -0.09 0.00 1.12 0.00 0.00 29.99 31.34 3h3n n HIS 121 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 3h3n h THR 122 N 1.13 0.00 -0.98 1.59 2.02 -1.84 0.60 112.91 115.43 3h3n h THR 122 Ca 0.00 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.25 3h3n h THR 122 Cb 0.34 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.68 3h3n h THR 122 CO 0.00 0.00 0.64 -0.33 0.37 0.00 0.00 175.52 176.20 3h3n h GLU 123 N -0.55 1.11 0.13 6.66 4.39 -1.98 -0.77 114.58 123.57 3h3n h GLU 123 Ca 0.02 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 3h3n h GLU 123 Cb 0.62 -0.25 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 3h3n h GLU 123 CO -0.35 0.74 -0.06 1.98 -1.16 0.00 0.00 179.01 180.15 3h3n h MET 124 N 1.15 -0.16 -0.61 2.33 4.05 -1.69 -1.19 114.93 118.81 3h3n h MET 124 Ca 0.42 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.83 3h3n h MET 124 Cb 0.17 0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 30.98 3h3n h MET 124 CO -0.17 -0.07 0.30 0.82 0.23 0.00 0.00 176.91 178.02 3h3n h ILE 125 N -0.21 1.21 -0.84 1.77 1.08 -0.54 -2.81 117.51 117.17 3h3n h ILE 125 Ca -0.02 -0.59 -0.02 0.00 -0.39 0.00 0.00 64.86 63.85 3h3n h ILE 125 Cb 0.17 0.47 -0.04 0.00 -3.07 0.00 0.00 36.82 34.35 3h3n h ILE 125 CO 0.03 0.24 0.45 -0.74 -0.69 0.00 0.00 178.15 177.44 3h3n h HIS 126 N 0.84 1.16 -0.36 1.37 2.76 -0.99 0.43 115.15 120.35 3h3n h HIS 126 Ca 0.21 -0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.36 3h3n h HIS 126 Cb 0.11 -0.37 -0.02 0.00 1.55 0.00 0.00 27.41 28.68 3h3n h HIS 126 CO -0.00 0.81 0.21 0.93 -1.30 0.00 0.00 177.93 178.58 3h3n h GLU 127 N 1.17 0.42 0.11 5.26 5.08 -1.02 0.79 114.58 126.39 3h3n h GLU 127 Ca 0.29 -0.03 -0.23 0.00 -1.00 0.00 0.00 59.36 58.40 3h3n h GLU 127 Cb 0.04 -0.09 0.02 0.00 0.50 0.00 0.00 28.75 29.22 3h3n h GLU 127 CO -0.05 0.28 -0.97 0.87 -1.00 0.00 0.00 179.01 178.14 3h3n h LYS 128 N 0.43 0.47 0.00 2.33 1.57 -1.29 -3.41 116.57 116.67 3h3n h LYS 128 Ca 0.14 -0.65 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 3h3n h LYS 128 Cb -0.00 0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3h3n h LYS 128 CO -0.06 1.28 -1.60 0.25 -0.57 0.00 0.00 179.45 178.75 3h3n n THR 129 N -4.00 0.00 -0.99 -0.16 -2.24 0.12 -1.44 114.28 105.57 3h3n n THR 129 Ca -0.13 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 3h3n n THR 129 Cb 0.87 0.26 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 3h3n n THR 129 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h3n n GLY 130 N 1.55 0.84 3.90 3.38 0.00 0.27 -4.74 105.19 110.39 3h3n n GLY 130 Ca -0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.79 3h3n n GLY 130 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h3n s LEU 131 N 0.00 3.30 0.04 0.99 1.43 -1.26 -1.31 118.68 121.87 3h3n s LEU 131 Ca 0.00 -0.79 -0.00 0.00 -1.03 0.00 0.00 54.13 52.31 3h3n s LEU 131 Cb 0.00 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.22 3h3n s LEU 131 CO 0.00 -0.78 0.15 -0.69 0.23 0.00 0.00 176.35 175.26 3h3n s VAL 132 N -2.52 5.09 -0.29 -1.59 1.01 -1.26 -3.77 120.40 117.07 3h3n s VAL 132 Ca 0.48 -0.43 -0.29 0.00 0.00 0.00 0.00 61.98 61.74 3h3n s VAL 132 Cb -0.04 -3.42 -0.01 0.00 0.00 0.00 0.00 36.38 32.91 3h3n s VAL 132 CO 0.28 0.22 1.41 -0.63 0.00 0.00 0.00 175.10 176.38 3h3n s ILE 133 N -1.38 3.98 0.11 2.22 1.01 -1.26 -4.95 121.20 120.92 3h3n s ILE 133 Ca 0.30 1.09 -0.23 0.00 0.00 0.00 0.00 60.65 61.80 3h3n s ILE 133 Cb -0.13 -4.02 0.06 0.00 0.01 0.00 0.00 42.46 38.39 3h3n s ILE 133 CO 0.22 -0.45 0.58 -0.62 0.00 0.00 0.00 174.94 174.67 3h3n s ASP 134 N 3.38 -0.53 0.00 3.58 2.15 -1.26 -4.95 116.67 119.03 3h3n s ASP 134 Ca 0.61 0.10 0.14 0.00 0.43 0.00 0.00 52.55 53.84 3h3n s ASP 134 Cb -0.19 0.56 0.67 0.00 -0.30 0.00 0.00 42.92 43.66 3h3n s ASP 134 CO 0.26 -0.87 1.40 0.00 -0.17 0.00 0.00 175.17 175.79 3h3n n ALA 135 N -0.07 1.74 -0.22 3.66 0.00 -1.26 -2.95 120.51 121.41 3h3n n ALA 135 Ca -0.17 -0.06 -0.03 0.00 0.00 0.00 0.00 53.44 53.18 3h3n n ALA 135 Cb 0.63 -1.23 0.15 0.00 0.00 0.00 0.00 19.45 19.01 3h3n n ALA 135 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 3h3n h TYR 136 N 0.00 1.03 -4.00 0.00 3.20 -1.81 -3.45 116.97 111.94 3h3n h TYR 136 Ca 0.00 -0.06 -0.50 0.00 3.14 0.00 0.00 58.73 61.31 3h3n h TYR 136 Cb 0.17 -0.32 0.05 0.00 1.54 0.00 0.00 36.73 38.17 3h3n h TYR 136 CO 0.00 0.77 0.28 -0.06 -1.64 0.00 0.00 178.16 177.51 3h3n s PHE 137 N -5.51 3.57 0.31 -3.82 0.08 -1.15 -4.71 117.98 106.75 3h3n s PHE 137 Ca -0.11 1.05 0.01 0.00 0.12 0.00 0.00 56.93 57.99 3h3n s PHE 137 Cb 0.16 -2.56 0.54 0.00 -0.57 0.00 0.00 43.02 40.59 3h3n s PHE 137 CO 0.81 -0.54 1.95 0.77 -0.10 0.00 0.00 175.22 178.11 3h3n h SER 138 N -0.10 0.87 -0.61 1.36 0.02 -1.60 -3.33 113.55 110.16 3h3n h SER 138 Ca -0.45 -0.01 0.08 0.00 -0.84 0.00 0.00 61.79 60.57 3h3n h SER 138 Cb 1.20 -0.20 -0.10 0.00 0.14 0.00 0.00 62.40 63.44 3h3n h SER 138 CO 0.62 0.59 -0.49 0.00 -1.14 0.00 0.00 176.83 176.42 3h3n h ALA 139 N 1.52 -0.45 0.00 3.77 0.00 -0.80 -0.25 119.26 123.05 3h3n h ALA 139 Ca 0.33 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.31 3h3n h ALA 139 Cb 0.06 1.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 3h3n h ALA 139 CO -0.10 -0.90 -0.09 1.79 0.00 0.00 0.00 179.25 179.96 3h3n h THR 140 N -0.23 0.23 -0.29 0.00 1.35 -1.86 -2.66 112.91 109.45 3h3n h THR 140 Ca 0.16 -0.74 -0.17 0.00 -0.55 0.00 0.00 66.41 65.10 3h3n h THR 140 Cb 0.55 1.61 -0.00 0.00 -1.73 0.00 0.00 68.15 68.58 3h3n h THR 140 CO -0.71 0.09 -0.49 0.11 -0.25 0.00 0.00 175.52 174.26 3h3n h LYS 141 N 0.00 0.80 -0.32 4.72 1.57 -1.21 0.13 116.57 122.25 3h3n h LYS 141 Ca -0.00 -0.47 -0.06 0.00 -1.87 0.00 0.00 60.65 58.24 3h3n h LYS 141 Cb 0.60 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 3h3n h LYS 141 CO 0.01 1.10 -0.04 0.28 -0.57 0.00 0.00 179.45 180.23 3h3n h VAL 142 N 0.63 1.27 -0.52 0.50 2.07 -1.11 -1.61 116.25 117.48 3h3n h VAL 142 Ca 0.03 -1.05 0.04 0.00 0.82 0.00 0.00 66.70 66.53 3h3n h VAL 142 Cb 1.08 1.31 -0.04 0.00 -1.52 0.00 0.00 31.29 32.11 3h3n h VAL 142 CO 0.11 0.34 0.28 -0.09 0.02 0.00 0.00 177.57 178.23 3h3n h ARG 143 N 0.38 0.53 -0.47 1.57 9.65 -1.35 0.11 114.38 124.79 3h3n h ARG 143 Ca 0.09 -0.03 0.06 0.00 -1.10 0.00 0.00 59.98 58.99 3h3n h ARG 143 Cb 0.52 -0.12 -0.05 0.00 -1.39 0.00 0.00 29.97 28.93 3h3n h ARG 143 CO 0.02 0.35 0.19 2.35 2.80 0.00 0.00 179.97 185.68 3h3n h TRP 144 N 0.54 0.34 -0.72 2.20 7.01 -0.77 0.66 115.95 125.20 3h3n h TRP 144 Ca 0.22 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 61.18 3h3n h TRP 144 Cb 0.10 -0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 27.05 3h3n h TRP 144 CO -0.09 0.13 0.21 -0.07 -2.79 0.00 0.00 178.44 175.84 3h3n h LEU 145 N 0.38 1.06 -0.58 0.65 3.38 -0.41 0.64 115.31 120.42 3h3n h LEU 145 Ca 0.22 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3h3n h LEU 145 Cb 0.19 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3h3n h LEU 145 CO -0.20 0.99 0.00 -0.07 0.09 0.00 0.00 178.44 179.24 3h3n h LEU 146 N 1.08 0.00 0.10 1.67 3.38 -0.02 -1.97 115.31 119.55 3h3n h LEU 146 Ca 0.23 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.84 3h3n h LEU 146 Cb 0.32 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3h3n h LEU 146 CO -0.01 0.00 -2.00 0.47 0.09 0.00 0.00 178.44 177.00 3h3n n ASP 147 N -2.58 2.09 0.01 -0.43 8.00 0.15 -3.86 116.55 119.93 3h3n n ASP 147 Ca 0.03 0.19 0.11 0.00 0.71 0.00 0.00 54.79 55.83 3h3n n ASP 147 Cb 0.35 -0.83 -0.09 0.00 -0.02 0.00 0.00 41.12 40.53 3h3n n ASP 147 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3h3n n ASN 148 N -3.55 0.50 -4.56 -2.24 3.02 0.17 -4.85 115.26 103.75 3h3n n ASN 148 Ca -0.34 -0.34 -0.41 0.00 -0.03 0.00 0.00 54.58 53.46 3h3n n ASN 148 Cb 1.01 1.30 -0.08 0.00 -0.61 0.00 0.00 39.78 41.40 3h3n n ASN 148 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3h3n s ILE 149 N -3.27 5.04 -0.23 2.41 -1.09 -0.74 -5.00 121.20 118.31 3h3n s ILE 149 Ca 0.00 0.34 -0.40 0.00 -2.23 0.00 0.00 60.65 58.37 3h3n s ILE 149 Cb 0.15 -3.94 -0.16 0.00 -1.58 0.00 0.00 42.46 36.93 3h3n s ILE 149 CO 0.86 -0.18 1.71 -1.84 -1.23 0.00 0.00 174.94 174.26 3h3n n GLU 150 N 5.68 1.20 -0.76 2.79 0.00 -1.26 -1.39 120.64 126.90 3h3n n GLU 150 Ca -0.05 0.44 0.00 0.00 0.00 0.00 0.00 57.16 57.55 3h3n n GLU 150 Cb 0.49 -2.12 0.00 0.00 0.00 0.00 0.00 31.44 29.81 3h3n n GLU 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3h3n n GLY 151 N 4.04 1.12 0.22 -1.84 0.00 -1.26 -4.91 105.19 102.56 3h3n n GLY 151 Ca 0.25 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.20 3h3n n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3n h ALA 152 N 0.00 0.64 -0.87 4.61 0.00 -1.52 -2.00 119.26 120.12 3h3n h ALA 152 Ca 0.00 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.81 3h3n h ALA 152 Cb 0.00 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.54 3h3n h ALA 152 CO 0.00 0.21 0.57 0.37 0.00 0.00 0.00 179.25 180.40 3h3n h GLN 153 N 0.66 1.09 -0.16 0.00 5.75 -1.79 0.26 115.11 120.93 3h3n h GLN 153 Ca 0.17 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.59 3h3n h GLN 153 Cb 0.13 -0.25 -0.01 0.00 1.07 0.00 0.00 27.48 28.42 3h3n h GLN 153 CO -0.02 0.72 0.05 1.49 -2.65 0.00 0.00 178.83 178.43 3h3n h GLU 154 N 1.13 0.24 -0.75 1.69 4.81 -1.87 -0.11 114.58 119.72 3h3n h GLU 154 Ca 0.34 -0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.57 3h3n h GLU 154 Cb -0.05 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.24 3h3n h GLU 154 CO -0.10 0.35 0.45 0.87 -0.73 0.00 0.00 179.01 179.86 3h3n h LYS 155 N 0.08 0.81 -0.66 1.92 1.57 -0.97 -0.52 116.57 118.80 3h3n h LYS 155 Ca 0.05 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 3h3n h LYS 155 Cb 0.21 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 3h3n h LYS 155 CO -0.00 0.54 0.27 0.00 -0.57 0.00 0.00 179.45 179.68 3h3n h ALA 156 N 1.36 0.86 0.00 3.86 0.00 -0.65 -1.46 119.26 123.23 3h3n h ALA 156 Ca 0.32 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3h3n h ALA 156 Cb 0.14 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3h3n h ALA 156 CO -0.16 0.48 -0.19 -0.44 0.00 0.00 0.00 179.25 178.94 3h3n h ASP 157 N 0.94 0.00 -0.33 0.00 3.32 -0.28 -1.50 116.42 118.56 3h3n h ASP 157 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 3h3n h ASP 157 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 3h3n h ASP 157 CO -0.02 0.19 0.00 0.59 -1.72 0.00 0.00 179.24 178.28 3h3n n ASN 158 N -3.65 2.15 -2.50 6.45 3.02 -0.27 -4.92 115.26 115.55 3h3n n ASN 158 Ca -0.01 -2.09 -0.21 0.00 -0.03 0.00 0.00 54.58 52.24 3h3n n ASN 158 Cb 0.31 -0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 3h3n n ASN 158 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h3n n GLY 159 N 0.90 -0.47 0.02 7.41 0.00 -0.56 -4.89 105.19 107.60 3h3n n GLY 159 Ca 0.12 0.01 0.09 0.00 0.00 0.00 0.00 46.02 46.24 3h3n n GLY 159 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h3n n GLU 160 N -3.25 0.76 -4.27 1.61 1.02 -0.63 -4.96 120.64 110.91 3h3n n GLU 160 Ca -0.20 -0.05 -0.30 0.00 -0.02 0.00 0.00 57.16 56.59 3h3n n GLU 160 Cb 0.66 -1.40 -0.10 0.00 -0.02 0.00 0.00 31.44 30.58 3h3n n GLU 160 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3h3n s LEU 161 N -2.87 2.97 0.02 -4.62 1.43 -1.25 -1.73 118.68 112.63 3h3n s LEU 161 Ca 0.08 -0.41 0.06 0.00 -1.03 0.00 0.00 54.13 52.83 3h3n s LEU 161 Cb 0.14 -1.77 -0.02 0.00 0.03 0.00 0.00 46.19 44.58 3h3n s LEU 161 CO 0.77 0.19 -0.19 -0.76 0.23 0.00 0.00 176.35 176.58 3h3n s LEU 162 N -2.12 2.12 0.13 1.79 1.43 0.73 -4.06 118.68 118.71 3h3n s LEU 162 Ca 0.20 -0.45 0.05 0.00 -1.03 0.00 0.00 54.13 52.90 3h3n s LEU 162 Cb -0.11 -0.92 -0.04 0.00 0.03 0.00 0.00 46.19 45.15 3h3n s LEU 162 CO 0.12 0.17 0.09 0.12 0.23 0.00 0.00 176.35 177.08 3h3n s PHE 163 N -0.68 3.12 -0.27 0.29 5.36 0.50 -0.93 117.98 125.37 3h3n s PHE 163 Ca 0.07 0.00 -0.27 0.00 -0.96 0.00 0.00 56.93 55.77 3h3n s PHE 163 Cb -0.08 -1.54 0.16 0.00 -0.34 0.00 0.00 43.02 41.22 3h3n s PHE 163 CO 0.01 0.52 1.22 0.20 -1.46 0.00 0.00 175.22 175.71 3h3n s GLY 164 N -2.76 0.05 0.97 13.12 0.00 -0.38 -4.47 107.32 113.85 3h3n s GLY 164 Ca 0.29 2.89 -0.17 0.00 0.00 0.00 0.00 44.72 47.74 3h3n s GLY 164 CO 0.22 1.61 1.32 -1.30 0.00 0.00 0.00 173.10 174.96 3h3n n THR 165 N 1.46 0.00 -0.18 0.90 -2.24 -1.26 -0.87 114.28 112.08 3h3n n THR 165 Ca -0.09 -0.97 0.00 0.00 -2.27 0.00 0.00 64.05 60.72 3h3n n THR 165 Cb 0.57 -1.51 0.25 0.00 -2.10 0.00 0.00 70.33 67.54 3h3n n THR 165 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 3h3n h ILE 166 N -1.77 1.19 -0.31 2.28 1.08 -1.81 -2.37 117.51 115.80 3h3n h ILE 166 Ca -0.43 -0.43 0.03 0.00 -0.39 0.00 0.00 64.86 63.64 3h3n h ILE 166 Cb 1.18 0.25 -0.03 0.00 -3.07 0.00 0.00 36.82 35.14 3h3n h ILE 166 CO 0.30 0.20 0.12 -2.24 -0.69 0.00 0.00 178.15 175.84 3h3n h ASP 167 N 0.93 0.14 -0.84 1.72 2.03 -1.93 -1.14 116.42 117.34 3h3n h ASP 167 Ca 0.24 0.03 -0.03 0.00 -0.73 0.00 0.00 57.03 56.54 3h3n h ASP 167 Cb -0.03 0.01 -0.04 0.00 -0.83 0.00 0.00 39.33 38.44 3h3n h ASP 167 CO -0.04 0.12 0.40 -1.28 -1.03 0.00 0.00 179.24 177.40 3h3n h SER 168 N 0.26 1.11 -0.57 4.15 0.87 -1.61 -2.12 113.55 115.64 3h3n h SER 168 Ca 0.13 -0.14 -0.03 0.00 -1.23 0.00 0.00 61.79 60.52 3h3n h SER 168 Cb 0.09 -0.29 -0.02 0.00 -0.44 0.00 0.00 62.40 61.74 3h3n h SER 168 CO -0.13 0.94 0.22 -0.25 -0.53 0.00 0.00 176.83 177.08 3h3n h TRP 169 N 1.20 0.87 -0.51 2.24 2.91 -1.02 -1.37 115.95 120.27 3h3n h TRP 169 Ca 0.29 -0.07 -0.10 0.00 1.13 0.00 0.00 58.89 60.14 3h3n h TRP 169 Cb 0.13 -0.26 -0.02 0.00 -0.51 0.00 0.00 29.16 28.51 3h3n h TRP 169 CO 0.02 0.71 -0.09 -0.07 -1.03 0.00 0.00 178.44 177.97 3h3n h LEU 170 N 0.78 0.96 -0.83 0.65 3.38 -0.91 -1.60 115.31 117.75 3h3n h LEU 170 Ca 0.19 -0.35 -0.11 0.00 0.09 0.00 0.00 57.88 57.70 3h3n h LEU 170 Cb 0.21 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3h3n h LEU 170 CO -0.01 1.08 -0.30 0.58 0.09 0.00 0.00 178.44 179.88 3h3n h VAL 171 N 0.83 1.28 -0.49 1.22 2.07 -1.32 0.33 116.25 120.16 3h3n h VAL 171 Ca 0.13 -1.37 -0.02 0.00 0.82 0.00 0.00 66.70 66.26 3h3n h VAL 171 Cb 0.64 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 3h3n h VAL 171 CO 0.04 0.44 0.22 -0.25 0.02 0.00 0.00 177.57 178.04 3h3n h TRP 172 N 0.46 0.72 -0.35 1.57 7.01 -0.99 -0.97 115.95 123.40 3h3n h TRP 172 Ca 0.06 -0.04 -0.04 0.00 2.11 0.00 0.00 58.89 60.97 3h3n h TRP 172 Cb 0.75 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.57 3h3n h TRP 172 CO 0.03 0.58 0.05 0.87 -2.79 0.00 0.00 178.44 177.19 3h3n h LYS 173 N 0.65 0.59 -0.09 2.65 1.79 -0.93 0.14 116.57 121.37 3h3n h LYS 173 Ca 0.17 -0.16 -0.04 0.00 -2.18 0.00 0.00 60.65 58.44 3h3n h LYS 173 Cb 0.14 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.72 3h3n h LYS 173 CO -0.02 0.66 -0.15 -0.07 -1.08 0.00 0.00 179.45 178.80 3h3n h LEU 174 N 0.42 0.13 -2.80 2.94 3.38 -0.72 -2.09 115.31 116.57 3h3n h LEU 174 Ca 0.11 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3h3n h LEU 174 Cb 0.36 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3h3n h LEU 174 CO 0.01 0.29 0.00 0.35 0.09 0.00 0.00 178.44 179.18 3h3n n THR 175 N -4.30 1.06 -4.08 0.22 -2.24 -0.39 -1.81 114.28 102.74 3h3n n THR 175 Ca -0.01 -1.02 -0.35 0.00 -2.27 0.00 0.00 64.05 60.39 3h3n n THR 175 Cb 0.25 0.47 -0.02 0.00 -2.10 0.00 0.00 70.33 68.93 3h3n n THR 175 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3h3n n ASP 176 N 1.43 -1.89 0.00 3.42 2.03 -0.28 -1.89 116.55 119.36 3h3n n ASP 176 Ca 0.23 -1.20 0.00 0.00 0.52 0.00 0.00 54.79 54.34 3h3n n ASP 176 Cb 0.61 -2.15 0.00 0.00 -0.72 0.00 0.00 41.12 38.86 3h3n n ASP 176 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3h3n n GLY 177 N -2.18 0.85 0.13 0.27 0.00 0.34 -4.93 105.19 99.68 3h3n n GLY 177 Ca -0.22 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.85 3h3n n GLY 177 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3h3n h GLN 178 N 2.63 0.00 -4.58 1.61 4.20 -1.62 -3.45 115.11 113.90 3h3n h GLN 178 Ca 0.00 0.00 -0.54 0.00 0.06 0.00 0.00 58.65 58.17 3h3n h GLN 178 Cb 0.00 0.00 -0.34 0.00 0.30 0.00 0.00 27.48 27.44 3h3n h GLN 178 CO 0.00 0.25 -0.82 0.08 -0.67 0.00 0.00 178.83 177.67 3h3n s VAL 179 N -3.08 1.23 -0.38 -0.54 1.01 -1.26 -5.08 120.40 112.29 3h3n s VAL 179 Ca 0.01 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.50 3h3n s VAL 179 Cb 0.08 -1.13 0.11 0.00 0.00 0.00 0.00 36.38 35.44 3h3n s VAL 179 CO 0.76 0.38 0.15 -2.28 0.00 0.00 0.00 175.10 174.11 3h3n s HIS 180 N 0.82 2.45 0.20 5.22 2.46 -1.26 -3.80 115.29 121.38 3h3n s HIS 180 Ca -0.11 -2.43 -0.02 0.00 0.47 0.00 0.00 55.06 52.97 3h3n s HIS 180 Cb -0.15 -2.19 -0.04 0.00 -0.13 0.00 0.00 32.58 30.07 3h3n s HIS 180 CO 0.02 -0.85 0.16 0.54 -2.47 0.00 0.00 174.74 172.14 3h3n s VAL 181 N 0.82 0.01 0.09 0.89 0.11 -1.26 -2.18 120.40 118.87 3h3n s VAL 181 Ca 0.13 -1.92 -0.15 0.00 -2.93 0.00 0.00 61.98 57.11 3h3n s VAL 181 Cb -0.21 -2.43 0.03 0.00 -1.53 0.00 0.00 36.38 32.24 3h3n s VAL 181 CO -0.10 -0.04 0.35 0.28 -3.33 0.00 0.00 175.10 172.26 3h3n s THR 182 N -4.13 0.08 0.44 5.04 -1.32 -0.52 -3.98 115.64 111.25 3h3n s THR 182 Ca 0.36 -0.66 0.03 0.00 -1.21 0.00 0.00 61.69 60.21 3h3n s THR 182 Cb 0.06 -1.11 0.01 0.00 -1.51 0.00 0.00 72.50 69.95 3h3n s THR 182 CO 0.11 -0.36 0.64 1.51 -2.21 0.00 0.00 174.62 174.30 3h3n s ASP 183 N -2.51 5.70 0.25 8.08 -4.77 -1.26 -1.03 116.67 121.13 3h3n s ASP 183 Ca 0.00 0.01 -0.03 0.00 -3.30 0.00 0.00 52.55 49.23 3h3n s ASP 183 Cb 0.01 -1.19 0.45 0.00 -1.09 0.00 0.00 42.92 41.10 3h3n s ASP 183 CO -0.08 -0.76 1.77 1.88 0.70 0.00 0.00 175.17 178.68 3h3n h TYR 184 N 0.46 0.72 -0.17 2.11 0.05 -1.51 -1.08 116.97 117.55 3h3n h TYR 184 Ca -0.44 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.36 3h3n h TYR 184 Cb 1.27 -0.20 -0.01 0.00 1.01 0.00 0.00 36.73 38.80 3h3n h TYR 184 CO 0.42 0.21 0.06 0.66 -1.05 0.00 0.00 178.16 178.46 3h3n h SER 185 N 0.63 0.24 -0.37 3.88 4.64 -1.86 -1.22 113.55 119.50 3h3n h SER 185 Ca 0.42 -0.19 -0.12 0.00 -0.47 0.00 0.00 61.79 61.42 3h3n h SER 185 Cb 0.52 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 3h3n h SER 185 CO -0.32 0.37 -0.21 0.78 -0.87 0.00 0.00 176.83 176.59 3h3n h ASN 186 N 0.10 0.87 -0.48 4.97 2.35 -1.85 -2.99 115.58 118.55 3h3n h ASN 186 Ca 0.06 -0.31 -0.03 0.00 -0.55 0.00 0.00 56.30 55.46 3h3n h ASN 186 Cb 0.21 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.32 3h3n h ASN 186 CO -0.00 1.05 0.19 0.00 -1.65 0.00 0.00 177.43 177.02 3h3n h ALA 187 N 1.02 1.34 0.00 -0.83 0.00 -1.04 -2.35 119.26 117.40 3h3n h ALA 187 Ca 0.10 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3h3n h ALA 187 Cb 0.74 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3h3n h ALA 187 CO 0.06 0.49 0.00 0.66 0.00 0.00 0.00 179.25 180.46 3h3n h SER 188 N 0.77 0.00 0.09 0.00 4.64 -1.07 -2.46 113.55 115.52 3h3n h SER 188 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 3h3n h SER 188 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 3h3n h SER 188 CO -0.01 0.00 -0.06 0.54 -0.87 0.00 0.00 176.83 176.42 3h3n n ARG 189 N -2.96 1.28 0.16 4.77 5.12 -0.88 -4.03 116.66 120.11 3h3n n ARG 189 Ca 0.00 -0.64 0.07 0.00 -1.93 0.00 0.00 57.85 55.35 3h3n n ARG 189 Cb 0.25 -1.49 0.07 0.00 -1.16 0.00 0.00 32.46 30.13 3h3n n ARG 189 CO 0.00 0.00 0.00 1.79 -1.93 0.00 0.00 177.63 177.49 3h3n h THR 190 N 1.56 0.43 -0.46 0.55 1.35 -1.49 -3.27 112.91 111.58 3h3n h THR 190 Ca 0.00 -1.64 -0.19 0.00 -0.55 0.00 0.00 66.41 64.03 3h3n h THR 190 Cb 0.41 2.15 -0.07 0.00 -1.73 0.00 0.00 68.15 68.91 3h3n h THR 190 CO 0.00 0.25 -0.17 0.80 -0.25 0.00 0.00 175.52 176.14 3h3n n MET 191 N -3.10 -0.65 0.00 4.72 1.56 -1.26 -0.07 117.12 118.32 3h3n n MET 191 Ca 0.02 0.82 0.00 0.00 -0.27 0.00 0.00 57.70 58.27 3h3n n MET 191 Cb 0.65 -4.72 0.00 0.00 2.15 0.00 0.00 33.22 31.30 3h3n n MET 191 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 3h3n n LEU 192 N -1.07 0.68 -4.38 -0.89 4.77 -1.26 -4.82 117.00 110.04 3h3n n LEU 192 Ca -0.09 -0.73 -0.33 0.00 -0.03 0.00 0.00 56.01 54.82 3h3n n LEU 192 Cb 0.31 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.26 3h3n n LEU 192 CO 0.14 0.17 -0.45 -0.47 -1.33 0.00 0.00 177.39 175.45 3h3n s TYR 193 N -0.10 2.81 -0.41 -1.77 5.04 -1.26 -1.05 117.35 120.61 3h3n s TYR 193 Ca 0.00 -0.62 -0.27 0.00 -2.44 0.00 0.00 57.07 53.74 3h3n s TYR 193 Cb 0.00 -1.83 0.02 0.00 0.35 0.00 0.00 41.96 40.50 3h3n s TYR 193 CO 0.00 -0.19 1.00 1.21 -1.34 0.00 0.00 175.55 176.23 3h3n s ASN 194 N 0.29 6.66 0.00 4.32 3.84 0.36 -4.30 114.94 126.12 3h3n s ASN 194 Ca -0.10 0.51 0.31 0.00 0.21 0.00 0.00 52.86 53.79 3h3n s ASN 194 Cb -0.16 -2.49 1.66 0.00 -0.55 0.00 0.00 41.25 39.71 3h3n s ASN 194 CO 0.05 -1.00 2.11 2.30 -2.79 0.00 0.00 177.10 177.78 3h3n n ILE 195 N 6.27 0.00 -0.11 -5.21 -5.35 -0.52 -0.84 119.36 113.60 3h3n n ILE 195 Ca 0.09 -0.01 -0.14 0.00 -0.27 0.00 0.00 62.75 62.42 3h3n n ILE 195 Cb 0.48 -0.47 -0.12 0.00 -1.74 0.00 0.00 39.64 37.79 3h3n n ILE 195 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 3h3n n HIS 196 N -1.15 0.00 0.58 4.28 8.25 -1.26 -4.42 115.22 121.50 3h3n n HIS 196 Ca 0.18 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.75 3h3n n HIS 196 Cb 0.19 -0.92 0.02 0.00 1.12 0.00 0.00 29.99 30.40 3h3n n HIS 196 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3h3n n LYS 197 N -3.04 0.28 -3.27 -0.41 5.02 -1.24 -5.00 118.16 110.50 3h3n n LYS 197 Ca -0.39 -0.01 -0.15 0.00 -2.02 0.00 0.00 58.31 55.75 3h3n n LYS 197 Cb 1.00 -1.59 0.06 0.00 -0.02 0.00 0.00 35.03 34.48 3h3n n LYS 197 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3h3n n LEU 198 N -1.95 -5.50 -3.45 -0.35 4.77 -0.02 -5.04 117.00 105.45 3h3n n LEU 198 Ca 0.02 -0.68 -0.14 0.00 -0.03 0.00 0.00 56.01 55.18 3h3n n LEU 198 Cb 0.43 -3.15 -0.03 0.00 -2.33 0.00 0.00 43.42 38.34 3h3n n LEU 198 CO 0.40 0.02 0.42 -1.61 -1.33 0.00 0.00 177.39 175.30 3h3n s GLU 199 N -4.40 1.19 0.31 3.23 2.02 -1.06 -5.01 118.70 114.99 3h3n s GLU 199 Ca 0.42 -0.24 -0.29 0.00 0.02 0.00 0.00 54.97 54.88 3h3n s GLU 199 Cb -0.06 0.55 -0.10 0.00 0.10 0.00 0.00 34.13 34.62 3h3n s GLU 199 CO 0.75 -0.48 1.41 -1.58 0.02 0.00 0.00 175.26 175.38 3h3n s TRP 200 N -2.93 2.92 -0.57 1.61 0.52 -1.26 -0.49 118.94 118.74 3h3n s TRP 200 Ca -0.03 1.20 -0.25 0.00 0.02 0.00 0.00 56.10 57.05 3h3n s TRP 200 Cb -0.01 -3.82 0.04 0.00 -1.15 0.00 0.00 33.47 28.53 3h3n s TRP 200 CO -0.06 -2.47 0.99 0.34 0.02 0.00 0.00 176.95 175.77 3h3n s ASP 201 N -0.08 6.33 0.43 2.95 2.15 -0.21 -4.77 116.67 123.47 3h3n s ASP 201 Ca 0.54 -0.37 0.12 0.00 0.43 0.00 0.00 52.55 53.28 3h3n s ASP 201 Cb -0.42 -2.45 1.00 0.00 -0.30 0.00 0.00 42.92 40.74 3h3n s ASP 201 CO 0.52 -1.30 2.00 1.56 -0.17 0.00 0.00 175.17 177.78 3h3n h GLN 202 N 9.39 0.42 -0.26 4.34 1.08 -1.91 -1.16 115.11 127.01 3h3n h GLN 202 Ca -0.26 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 56.89 3h3n h GLN 202 Cb 1.07 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 28.39 3h3n h GLN 202 CO 1.12 0.28 0.08 1.49 -0.95 0.00 0.00 178.83 180.85 3h3n h GLU 203 N 0.43 0.40 -0.38 1.46 4.81 -1.98 -0.22 114.58 119.12 3h3n h GLU 203 Ca 0.24 -0.09 -0.16 0.00 -0.13 0.00 0.00 59.36 59.23 3h3n h GLU 203 Cb 0.40 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 3h3n h GLU 203 CO -0.07 0.47 -0.39 0.82 -0.73 0.00 0.00 179.01 179.11 3h3n h ILE 204 N 0.26 1.27 -0.71 2.32 2.04 -1.81 -1.32 117.51 119.56 3h3n h ILE 204 Ca 0.08 -1.56 -0.00 0.00 1.00 0.00 0.00 64.86 64.38 3h3n h ILE 204 Cb 0.23 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 3h3n h ILE 204 CO -0.00 0.52 0.43 -0.07 0.00 0.00 0.00 178.15 179.03 3h3n h LEU 205 N 0.75 0.86 -0.40 1.44 3.38 -1.10 -0.90 115.31 119.33 3h3n h LEU 205 Ca 0.06 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 3h3n h LEU 205 Cb 0.98 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 3h3n h LEU 205 CO 0.09 0.67 0.01 -0.78 0.09 0.00 0.00 178.44 178.53 3h3n h ASP 206 N 0.97 0.67 -1.00 -0.43 3.58 -0.94 0.27 116.42 119.55 3h3n h ASP 206 Ca 0.26 -0.30 0.08 0.00 0.42 0.00 0.00 57.03 57.49 3h3n h ASP 206 Cb -0.03 -0.18 -0.07 0.00 1.72 0.00 0.00 39.33 40.77 3h3n h ASP 206 CO -0.05 0.81 0.64 0.25 -2.88 0.00 0.00 179.24 178.01 3h3n h LEU 207 N 0.52 0.99 -2.16 2.28 5.85 -0.73 -1.98 115.31 120.08 3h3n h LEU 207 Ca 0.11 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.85 3h3n h LEU 207 Cb 0.45 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.30 3h3n h LEU 207 CO 0.02 0.60 0.00 0.18 -0.34 0.00 0.00 178.44 178.90 3h3n n LEU 208 N -4.53 3.21 -3.83 2.25 4.77 -0.39 -4.97 117.00 113.52 3h3n n LEU 208 Ca 0.16 -1.43 -0.26 0.00 -0.03 0.00 0.00 56.01 54.45 3h3n n LEU 208 Cb 0.24 -0.27 0.03 0.00 -2.33 0.00 0.00 43.42 41.09 3h3n n LEU 208 CO 0.31 0.71 0.03 -3.20 -1.33 0.00 0.00 177.39 173.92 3h3n n ASN 209 N 1.31 -3.31 -4.43 -1.43 5.15 -0.06 -4.88 115.26 107.61 3h3n n ASN 209 Ca 0.19 -0.80 -0.38 0.00 -0.60 0.00 0.00 54.58 53.00 3h3n n ASN 209 Cb 0.56 -3.96 -0.12 0.00 -0.53 0.00 0.00 39.78 35.73 3h3n n ASN 209 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3h3n s ILE 210 N -3.46 4.43 0.44 -1.44 1.01 -0.34 -5.03 121.20 116.79 3h3n s ILE 210 Ca 0.39 -0.37 -0.25 0.00 0.00 0.00 0.00 60.65 60.42 3h3n s ILE 210 Cb -0.19 -3.20 -0.08 0.00 0.01 0.00 0.00 42.46 39.00 3h3n s ILE 210 CO 0.82 0.16 1.29 -2.84 0.00 0.00 0.00 174.94 174.37 3h3n s PRO 211 N 1.60 3.80 0.48 2.79 0.02 -1.26 -4.65 135.00 137.79 3h3n s PRO 211 Ca 0.05 2.11 0.27 0.00 0.02 0.00 0.00 61.00 63.44 3h3n s PRO 211 Cb -0.16 -2.62 1.18 0.00 0.02 0.00 0.00 34.50 32.91 3h3n s PRO 211 CO 0.05 -0.61 1.94 0.77 -0.33 0.00 0.00 177.00 178.81 3h3n h SER 212 N 2.38 0.00 0.00 2.53 0.02 -1.97 -2.83 113.55 113.68 3h3n h SER 212 Ca -0.50 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 3h3n h SER 212 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 3h3n h SER 212 CO 0.61 0.16 0.03 0.77 -1.14 0.00 0.00 176.83 177.27 3h3n h SER 213 N 0.00 0.00 1.48 3.07 4.64 -1.91 -1.20 113.55 119.62 3h3n h SER 213 Ca -0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 3h3n h SER 213 Cb 0.57 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.65 3h3n h SER 213 CO 0.02 0.00 -0.54 0.24 -0.87 0.00 0.00 176.83 175.68 3h3n h MET 214 N 0.00 0.00 -6.67 4.77 2.86 -1.64 -3.45 114.93 110.79 3h3n h MET 214 Ca 0.00 0.00 -0.50 0.00 -2.06 0.00 0.00 59.70 57.14 3h3n h MET 214 Cb 0.06 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 3h3n h MET 214 CO 0.00 0.28 0.35 -0.51 1.06 0.00 0.00 176.91 178.09 3h3n s LEU 215 N -6.18 4.59 0.63 1.22 1.43 -0.46 -0.37 118.68 119.55 3h3n s LEU 215 Ca 0.03 1.88 -0.10 0.00 -1.03 0.00 0.00 54.13 54.92 3h3n s LEU 215 Cb 0.07 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.69 3h3n s LEU 215 CO 0.74 0.07 1.00 -2.16 0.23 0.00 0.00 176.35 176.23 3h3n s PRO 216 N -0.71 3.17 0.45 1.29 0.04 -1.26 -5.00 135.00 132.98 3h3n s PRO 216 Ca 0.43 0.43 -0.23 0.00 0.04 0.00 0.00 61.00 61.67 3h3n s PRO 216 Cb -0.25 -2.13 -0.08 0.00 0.04 0.00 0.00 34.50 32.09 3h3n s PRO 216 CO 0.31 -0.74 1.10 -1.21 0.04 0.00 0.00 177.00 176.50 3h3n s GLU 217 N -5.17 3.87 -0.19 4.56 2.02 -0.93 -4.81 118.70 118.06 3h3n s GLU 217 Ca 0.55 1.61 -0.06 0.00 0.02 0.00 0.00 54.97 57.09 3h3n s GLU 217 Cb -0.11 -2.37 -0.03 0.00 0.10 0.00 0.00 34.13 31.72 3h3n s GLU 217 CO 0.50 -0.42 0.02 0.08 0.02 0.00 0.00 175.26 175.46 3h3n s VAL 218 N -1.67 4.26 0.38 2.63 1.01 -1.26 -1.44 120.40 124.30 3h3n s VAL 218 Ca 0.63 -0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.43 3h3n s VAL 218 Cb -0.24 -2.91 -0.01 0.00 0.00 0.00 0.00 36.38 33.21 3h3n s VAL 218 CO 0.29 0.45 0.13 0.29 0.00 0.00 0.00 175.10 176.26 3h3n n LYS 219 N 3.85 0.62 -1.25 2.72 5.02 -0.19 -4.96 118.16 123.97 3h3n n LYS 219 Ca -0.17 -3.15 -0.29 0.00 -2.02 0.00 0.00 58.31 52.68 3h3n n LYS 219 Cb 0.52 1.68 0.20 0.00 -0.02 0.00 0.00 35.03 37.41 3h3n n LYS 219 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3h3n s SER 220 N -3.29 2.07 0.00 4.39 1.04 -1.26 -1.46 113.70 115.19 3h3n s SER 220 Ca 0.18 0.84 0.27 0.00 0.48 0.00 0.00 55.95 57.72 3h3n s SER 220 Cb 0.01 -1.26 0.92 0.00 0.10 0.00 0.00 66.02 65.79 3h3n s SER 220 CO 0.13 -3.43 1.69 0.59 0.98 0.00 0.00 173.24 173.19 3h3n n ASN 221 N -4.33 0.41 -3.46 7.02 3.02 -0.77 -4.62 115.26 112.53 3h3n n ASN 221 Ca 0.09 -0.20 -0.27 0.00 -0.03 0.00 0.00 54.58 54.18 3h3n n ASN 221 Cb 0.59 -0.05 -0.12 0.00 -0.61 0.00 0.00 39.78 39.59 3h3n n ASN 221 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3h3n s SER 222 N -2.81 2.78 -0.16 6.41 0.15 -1.25 -2.39 113.70 116.43 3h3n s SER 222 Ca 0.18 -1.86 -0.32 0.00 0.70 0.00 0.00 55.95 54.64 3h3n s SER 222 Cb 0.19 -0.22 0.14 0.00 -1.71 0.00 0.00 66.02 64.41 3h3n s SER 222 CO 0.58 -0.33 1.12 -1.83 1.20 0.00 0.00 173.24 173.97 3h3n s GLU 223 N 1.38 0.44 -0.48 5.44 -1.05 -0.77 -4.75 118.70 118.90 3h3n s GLU 223 Ca 0.16 -0.08 -0.28 0.00 -0.15 0.00 0.00 54.97 54.61 3h3n s GLU 223 Cb -0.20 0.21 0.02 0.00 -0.44 0.00 0.00 34.13 33.71 3h3n s GLU 223 CO -0.09 -0.18 1.36 0.08 0.95 0.00 0.00 175.26 177.38 3h3n s VAL 224 N -2.12 3.92 -0.27 1.83 1.01 -1.26 -4.18 120.40 119.33 3h3n s VAL 224 Ca 0.06 0.88 0.18 0.00 0.00 0.00 0.00 61.98 63.11 3h3n s VAL 224 Cb -0.01 -4.38 0.18 0.00 0.00 0.00 0.00 36.38 32.17 3h3n s VAL 224 CO -0.05 -0.97 1.52 1.88 0.00 0.00 0.00 175.10 177.48 3h3n h TYR 225 N 10.54 0.00 0.00 5.22 -1.99 -1.44 -3.49 116.97 125.81 3h3n h TYR 225 Ca -0.26 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.47 3h3n h TYR 225 Cb 1.09 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.82 3h3n h TYR 225 CO 1.00 0.29 0.00 0.41 -0.00 0.00 0.00 178.16 179.86 3h3n n GLY 226 N 1.17 -0.50 3.07 3.88 0.00 -1.24 -5.01 105.19 106.57 3h3n n GLY 226 Ca 0.03 -1.04 -0.08 0.00 0.00 0.00 0.00 46.02 44.92 3h3n n GLY 226 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3h3n s HIS 227 N -3.08 0.53 0.52 1.61 -3.43 -1.26 -0.99 115.29 109.19 3h3n s HIS 227 Ca 0.00 -0.87 -0.21 0.00 -0.80 0.00 0.00 55.06 53.18 3h3n s HIS 227 Cb 0.00 -0.36 -0.06 0.00 -1.43 0.00 0.00 32.58 30.73 3h3n s HIS 227 CO 0.00 -0.28 1.17 0.95 -2.00 0.00 0.00 174.74 174.59 3h3n s THR 228 N -3.09 2.96 0.42 -5.38 -4.23 0.44 -4.62 115.64 102.15 3h3n s THR 228 Ca 0.01 0.65 -0.24 0.00 -1.18 0.00 0.00 61.69 60.93 3h3n s THR 228 Cb 0.02 -3.29 -0.08 0.00 1.34 0.00 0.00 72.50 70.48 3h3n s THR 228 CO -0.06 -0.08 1.18 -0.13 -0.54 0.00 0.00 174.62 174.99 3h3n s ARG 229 N -3.05 3.93 0.23 3.99 1.81 -0.75 -4.08 118.95 121.01 3h3n s ARG 229 Ca 0.70 1.86 -0.08 0.00 -1.72 0.00 0.00 55.73 56.48 3h3n s ARG 229 Cb -0.28 -2.58 0.37 0.00 -0.45 0.00 0.00 34.95 32.00 3h3n s ARG 229 CO 0.32 -0.43 1.67 0.66 -0.68 0.00 0.00 175.30 176.84 3h3n h SER 230 N 2.42 -0.17 0.11 0.23 4.64 -1.88 0.43 113.55 119.32 3h3n h SER 230 Ca -0.49 0.15 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 3h3n h SER 230 Cb 1.24 0.25 0.00 0.00 -0.31 0.00 0.00 62.40 63.58 3h3n h SER 230 CO 0.62 -0.09 0.00 0.00 -0.87 0.00 0.00 176.83 176.49 3h3n n TYR 231 N -5.24 0.00 0.88 4.77 0.18 -1.26 -0.38 117.16 116.11 3h3n n TYR 231 Ca 0.11 0.00 0.10 0.00 1.88 0.00 0.00 57.90 59.99 3h3n n TYR 231 Cb 0.40 -0.07 -0.00 0.00 -0.38 0.00 0.00 39.34 39.29 3h3n n TYR 231 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 3h3n n ARG 232 N -1.07 1.42 -2.87 -3.48 5.12 0.15 -4.60 116.66 111.33 3h3n n ARG 232 Ca 0.16 -0.93 -0.12 0.00 -1.93 0.00 0.00 57.85 55.03 3h3n n ARG 232 Cb 0.11 -1.39 0.03 0.00 -1.16 0.00 0.00 32.46 30.04 3h3n n ARG 232 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 3h3n n PHE 233 N -0.05 -0.35 -4.05 -1.55 -0.00 -1.03 -4.87 117.46 105.57 3h3n n PHE 233 Ca 0.08 -2.94 -0.32 0.00 -0.00 0.00 0.00 57.45 54.27 3h3n n PHE 233 Cb 0.42 0.20 -0.00 0.00 -0.00 0.00 0.00 39.48 40.10 3h3n n PHE 233 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 3h3n n TYR 234 N 0.05 -1.99 0.00 -5.13 4.02 -1.23 -1.74 117.16 111.14 3h3n n TYR 234 Ca 0.13 0.84 0.00 0.00 -0.01 0.00 0.00 57.90 58.86 3h3n n TYR 234 Cb 0.75 -3.51 0.00 0.00 -0.02 0.00 0.00 39.34 36.55 3h3n n TYR 234 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3h3n n GLY 235 N -1.58 1.19 3.79 2.72 0.00 0.49 -4.95 105.19 106.84 3h3n n GLY 235 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 3h3n n GLY 235 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h3n s SER 236 N -2.37 5.63 -0.67 1.61 0.01 -0.71 -4.81 113.70 112.38 3h3n s SER 236 Ca 0.00 0.03 -0.10 0.00 1.31 0.00 0.00 55.95 57.19 3h3n s SER 236 Cb 0.00 -1.54 0.17 0.00 0.21 0.00 0.00 66.02 64.86 3h3n s SER 236 CO 0.00 0.18 0.56 -1.61 0.41 0.00 0.00 173.24 172.78 3h3n s GLU 237 N -2.37 3.00 -0.08 12.44 2.02 -1.26 -4.06 118.70 128.38 3h3n s GLU 237 Ca 0.30 -2.29 -0.13 0.00 0.02 0.00 0.00 54.97 52.86 3h3n s GLU 237 Cb -0.12 -4.09 -0.05 0.00 0.10 0.00 0.00 34.13 29.96 3h3n s GLU 237 CO 0.22 -1.24 0.31 0.08 0.02 0.00 0.00 175.26 174.66 3h3n s VAL 238 N 0.43 5.23 0.21 2.63 1.01 -1.26 -4.75 120.40 123.90 3h3n s VAL 238 Ca 0.14 0.60 -0.31 0.00 0.00 0.00 0.00 61.98 62.42 3h3n s VAL 238 Cb -0.18 -3.62 -0.10 0.00 0.00 0.00 0.00 36.38 32.48 3h3n s VAL 238 CO -0.05 0.52 1.48 -2.84 0.00 0.00 0.00 175.10 174.21 3h3n s PRO 239 N -0.51 4.25 -0.40 2.72 0.02 -1.26 -0.42 135.00 139.40 3h3n s PRO 239 Ca 0.19 2.30 -0.13 0.00 0.02 0.00 0.00 61.00 63.39 3h3n s PRO 239 Cb -0.14 -3.14 0.03 0.00 0.02 0.00 0.00 34.50 31.27 3h3n s PRO 239 CO 0.08 -0.48 0.26 0.42 -0.33 0.00 0.00 177.00 176.95 3h3n s ILE 240 N 0.47 4.89 0.00 2.83 1.01 -0.16 -0.90 121.20 129.33 3h3n s ILE 240 Ca 0.63 -0.82 0.00 0.00 0.00 0.00 0.00 60.65 60.46 3h3n s ILE 240 Cb -0.42 -3.75 0.00 0.00 0.01 0.00 0.00 42.46 38.30 3h3n s ILE 240 CO 0.38 -0.30 0.74 0.00 0.00 0.00 0.00 174.94 175.76 3h3n n ALA 241 N 5.08 1.54 -3.53 9.38 0.00 -0.57 -1.08 120.51 131.32 3h3n n ALA 241 Ca -0.11 -0.74 -0.13 0.00 0.00 0.00 0.00 53.44 52.45 3h3n n ALA 241 Cb 0.46 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.78 3h3n n ALA 241 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3h3n s GLY 242 N -0.52 -0.09 -0.11 0.00 0.00 -1.14 -1.86 107.32 103.60 3h3n s GLY 242 Ca 0.00 0.70 -0.08 0.00 0.00 0.00 0.00 44.72 45.34 3h3n s GLY 242 CO 0.00 0.89 0.29 1.06 0.00 0.00 0.00 173.10 175.34 3h3n s MET 243 N 0.87 0.30 -0.16 2.90 -1.94 -1.01 -0.52 119.30 119.75 3h3n s MET 243 Ca -0.06 0.48 -0.30 0.00 -1.71 0.00 0.00 55.69 54.10 3h3n s MET 243 Cb -0.08 0.06 0.13 0.00 2.01 0.00 0.00 34.83 36.94 3h3n s MET 243 CO -0.05 -0.09 1.01 0.00 -0.01 0.00 0.00 175.02 175.88 3h3n s ALA 244 N 0.63 -1.94 0.56 3.03 0.00 -0.93 -4.46 121.76 118.65 3h3n s ALA 244 Ca -0.04 1.56 -0.20 0.00 0.00 0.00 0.00 51.96 53.28 3h3n s ALA 244 Cb -0.05 -0.65 -0.04 0.00 0.00 0.00 0.00 23.12 22.37 3h3n s ALA 244 CO -0.04 -0.34 1.24 0.20 0.00 0.00 0.00 175.76 176.82 3h3n s GLY 245 N -1.23 2.79 0.27 0.00 0.00 -1.26 -3.19 107.32 104.70 3h3n s GLY 245 Ca -0.01 1.08 0.00 0.00 0.00 0.00 0.00 44.72 45.80 3h3n s GLY 245 CO 0.00 1.51 1.78 1.29 0.00 0.00 0.00 173.10 177.68 3h3n h ASP 246 N 1.17 0.66 0.08 1.64 3.04 -1.00 -0.18 116.42 121.83 3h3n h ASP 246 Ca -0.50 0.08 -0.11 0.00 -3.24 0.00 0.00 57.03 53.26 3h3n h ASP 246 Cb 1.29 -0.03 -0.01 0.00 -1.04 0.00 0.00 39.33 39.54 3h3n h ASP 246 CO 0.56 0.29 -0.36 1.56 -2.04 0.00 0.00 179.24 179.25 3h3n h GLN 247 N 0.73 0.39 -0.05 4.15 1.08 -1.91 -1.37 115.11 118.12 3h3n h GLN 247 Ca 0.48 -0.17 -0.19 0.00 -1.45 0.00 0.00 58.65 57.32 3h3n h GLN 247 Cb 0.65 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 28.06 3h3n h GLN 247 CO -0.34 0.70 -0.79 1.96 -0.95 0.00 0.00 178.83 179.40 3h3n h GLN 248 N 0.33 0.36 -0.58 1.46 7.50 -1.65 -2.51 115.11 120.02 3h3n h GLN 248 Ca 0.04 -0.33 -0.06 0.00 0.50 0.00 0.00 58.65 58.80 3h3n h GLN 248 Cb 0.79 0.08 -0.03 0.00 0.05 0.00 0.00 27.48 28.37 3h3n h GLN 248 CO 0.06 0.99 0.13 0.00 -1.50 0.00 0.00 178.83 178.51 3h3n h ALA 249 N 0.91 1.15 -0.46 3.87 0.00 -0.76 -1.27 119.26 122.69 3h3n h ALA 249 Ca -0.04 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 3h3n h ALA 249 Cb 1.39 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 3h3n h ALA 249 CO 0.13 0.58 -0.12 0.00 0.00 0.00 0.00 179.25 179.84 3h3n h ALA 250 N 1.28 0.92 -0.56 0.00 0.00 -1.13 0.23 119.26 120.01 3h3n h ALA 250 Ca 0.19 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3h3n h ALA 250 Cb 0.32 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3h3n h ALA 250 CO 0.00 0.63 0.32 1.25 0.00 0.00 0.00 179.25 181.45 3h3n h LEU 251 N 0.76 0.69 -0.55 0.00 5.85 -0.98 0.73 115.31 121.81 3h3n h LEU 251 Ca 0.12 -0.08 -0.11 0.00 0.84 0.00 0.00 57.88 58.66 3h3n h LEU 251 Cb 0.62 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 3h3n h LEU 251 CO 0.04 0.57 -0.08 0.15 -0.34 0.00 0.00 178.44 178.78 3h3n h PHE 252 N 0.76 1.13 0.00 1.25 3.57 -0.79 -2.08 116.94 120.77 3h3n h PHE 252 Ca 0.20 -0.23 -0.04 0.00 3.53 0.00 0.00 57.97 61.44 3h3n h PHE 252 Cb 0.02 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.47 3h3n h PHE 252 CO -0.02 1.04 -0.17 0.78 -2.23 0.00 0.00 178.31 177.71 3h3n h GLY 253 N 0.89 0.00 0.53 2.40 0.00 -0.05 -0.98 103.07 105.85 3h3n h GLY 253 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.47 3h3n h GLY 253 CO 0.04 0.00 -0.03 -1.06 0.00 0.00 0.00 176.54 175.49 3h3n n GLN 254 N -3.58 1.10 -3.14 4.80 1.13 0.20 -4.78 117.38 113.12 3h3n n GLN 254 Ca -0.01 -0.37 -0.22 0.00 -1.94 0.00 0.00 57.00 54.46 3h3n n GLN 254 Cb 0.32 -1.49 0.05 0.00 0.11 0.00 0.00 30.24 29.22 3h3n n GLN 254 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 3h3n n MET 255 N -0.63 -5.51 -2.21 -1.09 2.81 -0.37 -4.90 117.12 105.22 3h3n n MET 255 Ca 0.19 0.85 -0.42 0.00 -1.81 0.00 0.00 57.70 56.51 3h3n n MET 255 Cb 0.24 -5.68 0.00 0.00 -0.71 0.00 0.00 33.22 27.08 3h3n n MET 255 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3h3n n ALA 256 N -3.87 5.36 0.70 3.04 0.00 -0.80 -4.68 120.51 120.25 3h3n n ALA 256 Ca -0.08 -4.21 0.12 0.00 0.00 0.00 0.00 53.44 49.27 3h3n n ALA 256 Cb 0.60 -3.12 0.25 0.00 0.00 0.00 0.00 19.45 17.19 3h3n n ALA 256 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3h3n n PHE 257 N 4.46 0.45 -4.24 0.00 3.72 -1.26 -4.78 117.46 115.80 3h3n n PHE 257 Ca 0.43 0.13 -0.25 0.00 -0.05 0.00 0.00 57.45 57.71 3h3n n PHE 257 Cb 0.37 -0.60 -0.07 0.00 -0.94 0.00 0.00 39.48 38.24 3h3n n PHE 257 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 3h3n s GLU 258 N -3.11 2.38 0.20 -1.08 2.02 -1.26 -4.97 118.70 112.88 3h3n s GLU 258 Ca 0.08 -1.25 -0.32 0.00 0.02 0.00 0.00 54.97 53.50 3h3n s GLU 258 Cb 0.15 -2.27 -0.14 0.00 0.10 0.00 0.00 34.13 31.96 3h3n s GLU 258 CO 0.69 0.41 1.41 1.17 0.02 0.00 0.00 175.26 178.95 3h3n n LYS 259 N -0.55 1.87 0.00 1.61 4.81 -1.26 -1.77 118.16 122.87 3h3n n LYS 259 Ca -0.08 0.67 0.00 0.00 -0.87 0.00 0.00 58.31 58.03 3h3n n LYS 259 Cb 0.57 -2.33 0.00 0.00 0.02 0.00 0.00 35.03 33.29 3h3n n LYS 259 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3h3n n GLY 260 N 2.44 3.12 3.72 3.14 0.00 0.84 -4.99 105.19 113.46 3h3n n GLY 260 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 3h3n n GLY 260 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h3n s MET 261 N -0.37 4.27 0.03 1.61 -1.94 -0.73 -4.77 119.30 117.40 3h3n s MET 261 Ca 0.00 2.22 0.03 0.00 -1.71 0.00 0.00 55.69 56.23 3h3n s MET 261 Cb 0.00 -3.21 -0.02 0.00 2.01 0.00 0.00 34.83 33.61 3h3n s MET 261 CO 0.00 -0.53 -0.09 -1.50 -0.01 0.00 0.00 175.02 172.89 3h3n s ILE 262 N 1.16 0.71 0.14 2.53 2.07 -1.26 -0.96 121.20 125.59 3h3n s ILE 262 Ca 0.67 -0.90 -0.02 0.00 -1.41 0.00 0.00 60.65 58.99 3h3n s ILE 262 Cb -0.40 -0.70 -0.04 0.00 0.13 0.00 0.00 42.46 41.46 3h3n s ILE 262 CO 0.31 -0.17 0.09 -1.59 -1.91 0.00 0.00 174.94 171.67 3h3n s LYS 263 N -1.19 0.98 -0.04 3.50 0.00 -0.48 -2.53 119.74 119.98 3h3n s LYS 263 Ca -0.04 -1.42 0.00 0.00 0.00 0.00 0.00 55.97 54.51 3h3n s LYS 263 Cb -0.08 0.26 0.03 0.00 0.00 0.00 0.00 37.83 38.04 3h3n s LYS 263 CO 0.01 -0.29 -0.00 1.21 0.00 0.00 0.00 175.35 176.27 3h3n s ASN 264 N -3.05 0.75 -0.22 0.03 2.47 0.00 -1.09 114.94 113.84 3h3n s ASN 264 Ca 0.24 -0.04 -0.06 0.00 0.42 0.00 0.00 52.86 53.42 3h3n s ASN 264 Cb 0.07 -0.29 -0.02 0.00 -1.45 0.00 0.00 41.25 39.56 3h3n s ASN 264 CO 0.02 -0.12 0.02 -0.89 -3.72 0.00 0.00 177.10 172.41 3h3n s THR 265 N 1.23 3.99 -0.41 -5.21 2.01 -0.99 -2.19 115.64 114.07 3h3n s THR 265 Ca -0.07 -0.29 -0.16 0.00 0.31 0.00 0.00 61.69 61.48 3h3n s THR 265 Cb -0.13 -2.83 0.02 0.00 0.01 0.00 0.00 72.50 69.56 3h3n s THR 265 CO -0.02 0.40 0.36 -0.31 -0.69 0.00 0.00 174.62 174.35 3h3n s TYR 266 N 1.28 3.21 0.00 4.92 2.02 0.04 -2.41 117.35 126.41 3h3n s TYR 266 Ca 0.04 -0.45 0.00 0.00 -0.37 0.00 0.00 57.07 56.29 3h3n s TYR 266 Cb -0.15 -2.71 0.00 0.00 -0.40 0.00 0.00 41.96 38.70 3h3n s TYR 266 CO 0.01 -0.61 0.00 0.41 -1.57 0.00 0.00 175.55 173.79 3h3n n GLY 267 N 5.12 5.17 0.35 0.71 0.00 -1.26 -2.15 105.19 113.13 3h3n n GLY 267 Ca -0.09 -0.70 0.05 0.00 0.00 0.00 0.00 46.02 45.27 3h3n n GLY 267 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3h3n h THR 268 N 0.00 0.97 -1.83 2.61 2.02 -1.93 -0.38 112.91 114.37 3h3n h THR 268 Ca 0.00 -0.35 -0.60 0.00 0.77 0.00 0.00 66.41 66.23 3h3n h THR 268 Cb 0.00 -0.13 -0.13 0.00 -1.74 0.00 0.00 68.15 66.15 3h3n h THR 268 CO 0.00 0.18 -0.52 -0.83 0.37 0.00 0.00 175.52 174.73 3h3n s GLY 269 N -3.38 2.76 -0.03 2.16 0.00 -1.26 -1.62 107.32 105.95 3h3n s GLY 269 Ca -0.12 -0.95 0.06 0.00 0.00 0.00 0.00 44.72 43.71 3h3n s GLY 269 CO 0.80 -1.96 -0.22 0.00 0.00 0.00 0.00 173.10 171.72 3h3n s ALA 270 N -3.08 1.84 -0.09 3.20 0.00 0.44 -4.62 121.76 119.45 3h3n s ALA 270 Ca 0.18 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 51.19 3h3n s ALA 270 Cb 0.02 -0.51 0.04 0.00 0.00 0.00 0.00 23.12 22.67 3h3n s ALA 270 CO 0.11 0.42 0.03 -0.06 0.00 0.00 0.00 175.76 176.25 3h3n s PHE 271 N -0.37 0.52 -0.20 0.00 0.08 -1.01 -0.81 117.98 116.19 3h3n s PHE 271 Ca 0.05 -0.17 -0.16 0.00 0.12 0.00 0.00 56.93 56.77 3h3n s PHE 271 Cb -0.10 -0.74 -0.04 0.00 -0.57 0.00 0.00 43.02 41.57 3h3n s PHE 271 CO 0.00 -0.35 0.41 0.42 -0.10 0.00 0.00 175.22 175.61 3h3n s ILE 272 N 2.02 5.19 -0.06 0.64 1.09 -0.76 -2.35 121.20 126.96 3h3n s ILE 272 Ca 0.04 0.73 0.02 0.00 -1.10 0.00 0.00 60.65 60.33 3h3n s ILE 272 Cb -0.13 -3.74 0.02 0.00 -1.06 0.00 0.00 42.46 37.55 3h3n s ILE 272 CO -0.05 0.24 -0.10 -0.69 -0.10 0.00 0.00 174.94 174.24 3h3n s VAL 273 N 1.36 0.97 -0.07 2.92 1.01 -0.25 -1.11 120.40 125.23 3h3n s VAL 273 Ca 0.19 -0.37 0.05 0.00 0.00 0.00 0.00 61.98 61.85 3h3n s VAL 273 Cb -0.15 -0.92 -0.01 0.00 0.00 0.00 0.00 36.38 35.31 3h3n s VAL 273 CO 0.08 0.32 -0.25 -0.32 0.00 0.00 0.00 175.10 174.94 3h3n s MET 274 N 0.81 2.74 0.02 2.72 1.75 -0.55 -1.38 119.30 125.40 3h3n s MET 274 Ca -0.12 -0.89 -0.30 0.00 -1.25 0.00 0.00 55.69 53.12 3h3n s MET 274 Cb -0.15 -2.21 -0.05 0.00 2.84 0.00 0.00 34.83 35.26 3h3n s MET 274 CO 0.02 0.30 1.18 1.21 -0.65 0.00 0.00 175.02 177.08 3h3n s ASN 275 N 0.04 7.10 -0.04 1.11 3.84 -0.14 -1.09 114.94 125.76 3h3n s ASN 275 Ca -0.10 1.91 0.09 0.00 0.21 0.00 0.00 52.86 54.98 3h3n s ASN 275 Cb -0.15 -2.57 0.25 0.00 -0.55 0.00 0.00 41.25 38.23 3h3n s ASN 275 CO 0.06 -0.49 1.20 0.35 -2.79 0.00 0.00 177.10 175.43 3h3n n THR 276 N 4.16 1.29 -4.12 -5.21 -2.24 -0.31 -0.11 114.28 107.72 3h3n n THR 276 Ca 0.09 -1.26 0.00 0.00 -2.27 0.00 0.00 64.05 60.62 3h3n n THR 276 Cb 0.47 0.31 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 3h3n n THR 276 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h3n n GLY 277 N -0.13 -1.58 0.06 3.38 0.00 -1.24 -4.10 105.19 101.58 3h3n n GLY 277 Ca 0.10 -1.31 0.12 0.00 0.00 0.00 0.00 46.02 44.93 3h3n n GLY 277 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h3n n GLU 278 N -0.12 0.12 -3.92 1.61 1.02 -1.26 -0.42 120.64 117.66 3h3n n GLU 278 Ca 0.00 0.18 -0.30 0.00 -0.02 0.00 0.00 57.16 57.01 3h3n n GLU 278 Cb 0.00 -1.66 -0.15 0.00 -0.02 0.00 0.00 31.44 29.61 3h3n n GLU 278 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3h3n s GLU 279 N -3.08 1.48 0.00 3.49 0.41 -1.26 -4.81 118.70 114.93 3h3n s GLU 279 Ca 0.10 -1.13 0.00 0.00 -0.41 0.00 0.00 54.97 53.53 3h3n s GLU 279 Cb 0.14 -2.60 0.00 0.00 -1.78 0.00 0.00 34.13 29.89 3h3n s GLU 279 CO 0.49 -0.70 0.98 -0.35 -0.49 0.00 0.00 175.26 175.18 3h3n n PRO 280 N 4.63 0.57 -1.76 0.39 -0.04 -1.26 -4.74 135.00 132.79 3h3n n PRO 280 Ca -0.08 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.19 3h3n n PRO 280 Cb 0.43 -1.22 -0.09 0.00 -0.04 0.00 0.00 33.50 32.59 3h3n n PRO 280 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 3h3n s GLN 281 N 0.74 1.70 -0.00 0.54 -1.52 -1.26 -4.77 119.66 115.09 3h3n s GLN 281 Ca 0.00 -0.43 -0.01 0.00 -1.95 0.00 0.00 55.36 52.98 3h3n s GLN 281 Cb 0.00 -5.02 0.00 0.00 -0.22 0.00 0.00 33.01 27.78 3h3n s GLN 281 CO 0.00 -4.75 0.03 1.47 -0.25 0.00 0.00 175.29 171.80 3h3n n LEU 282 N 17.69 0.00 -4.80 2.90 -0.00 -1.26 -5.09 117.00 126.44 3h3n n LEU 282 Ca 0.43 -0.01 -0.37 0.00 -0.00 0.00 0.00 56.01 56.06 3h3n n LEU 282 Cb 0.46 0.05 -0.06 0.00 -0.00 0.00 0.00 43.42 43.87 3h3n n LEU 282 CO 0.60 -0.00 0.41 -0.55 -0.00 0.00 0.00 177.39 177.85 3h3n s SER 283 N -1.08 7.15 -0.16 1.45 0.15 -1.23 -4.97 113.70 115.01 3h3n s SER 283 Ca 0.01 1.45 0.16 0.00 0.70 0.00 0.00 55.95 58.27 3h3n s SER 283 Cb -0.00 -2.43 0.43 0.00 -1.71 0.00 0.00 66.02 62.31 3h3n s SER 283 CO -0.00 0.12 1.19 -0.90 1.20 0.00 0.00 173.24 174.86 3h3n n ASP 284 N 1.12 1.86 -4.68 5.45 5.75 -1.26 -4.46 116.55 120.33 3h3n n ASP 284 Ca -0.05 -3.18 -0.45 0.00 -0.01 0.00 0.00 54.79 51.10 3h3n n ASP 284 Cb 0.50 -0.43 -0.04 0.00 -1.03 0.00 0.00 41.12 40.12 3h3n n ASP 284 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 3h3n n ASN 285 N -0.54 3.32 0.00 -1.12 5.15 -1.26 -1.40 115.26 119.41 3h3n n ASN 285 Ca 0.17 1.06 0.00 0.00 -0.60 0.00 0.00 54.58 55.21 3h3n n ASN 285 Cb 0.87 -1.45 0.00 0.00 -0.53 0.00 0.00 39.78 38.67 3h3n n ASN 285 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 3h3n n ASP 286 N 3.97 -1.96 -3.73 1.20 8.00 -1.26 -4.96 116.55 117.81 3h3n n ASP 286 Ca 0.17 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.45 3h3n n ASP 286 Cb 0.30 -1.50 -0.05 0.00 -0.02 0.00 0.00 41.12 39.85 3h3n n ASP 286 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3h3n n LEU 287 N 0.00 0.00 -4.46 0.64 4.77 -0.49 -4.45 117.00 113.01 3h3n n LEU 287 Ca 0.00 -2.45 -0.33 0.00 -0.03 0.00 0.00 56.01 53.21 3h3n n LEU 287 Cb 0.10 0.52 -0.13 0.00 -2.33 0.00 0.00 43.42 41.58 3h3n n LEU 287 CO 0.00 -0.36 -0.45 -0.76 -1.33 0.00 0.00 177.39 174.49 3h3n s LEU 288 N 0.00 2.72 -0.24 2.23 1.43 -0.40 -4.87 118.68 119.55 3h3n s LEU 288 Ca 0.07 -0.22 -0.08 0.00 -1.03 0.00 0.00 54.13 52.88 3h3n s LEU 288 Cb 0.00 -1.56 -0.03 0.00 0.03 0.00 0.00 46.19 44.63 3h3n s LEU 288 CO 0.05 0.32 0.08 -0.89 0.23 0.00 0.00 176.35 176.14 3h3n s THR 289 N -0.59 4.48 0.26 5.49 2.01 -0.42 -0.65 115.64 126.21 3h3n s THR 289 Ca 0.08 -0.12 0.03 0.00 0.31 0.00 0.00 61.69 61.99 3h3n s THR 289 Cb -0.11 -3.08 -0.04 0.00 0.01 0.00 0.00 72.50 69.28 3h3n s THR 289 CO 0.01 0.35 0.20 0.28 -0.69 0.00 0.00 174.62 174.77 3h3n s THR 290 N 1.39 0.02 -0.21 -0.82 -1.32 -0.63 -4.30 115.64 109.77 3h3n s THR 290 Ca 0.05 -2.00 -0.20 0.00 -1.21 0.00 0.00 61.69 58.33 3h3n s THR 290 Cb -0.15 -2.50 -0.03 0.00 -1.51 0.00 0.00 72.50 68.32 3h3n s THR 290 CO 0.04 0.00 0.60 -0.63 -2.21 0.00 0.00 174.62 172.42 3h3n s ILE 291 N -3.81 5.03 -0.06 5.08 1.01 -1.26 -0.43 121.20 126.76 3h3n s ILE 291 Ca 0.40 1.12 -0.21 0.00 0.00 0.00 0.00 60.65 61.95 3h3n s ILE 291 Cb 0.05 -3.92 -0.16 0.00 0.01 0.00 0.00 42.46 38.44 3h3n s ILE 291 CO 0.19 0.10 0.85 1.23 0.00 0.00 0.00 174.94 177.32 3h3n h GLY 292 N 8.33 -0.20 -4.48 6.18 0.00 -0.61 -3.40 103.07 108.88 3h3n h GLY 292 Ca -0.31 0.08 0.24 0.00 0.00 0.00 0.00 47.33 47.34 3h3n h GLY 292 CO 0.76 -0.07 0.89 -2.52 0.00 0.00 0.00 176.54 175.60 3h3n s TYR 293 N -3.34 -0.09 -0.17 5.60 -0.85 -0.97 -4.76 117.35 112.78 3h3n s TYR 293 Ca -0.13 0.12 0.01 0.00 -0.52 0.00 0.00 57.07 56.55 3h3n s TYR 293 Cb 0.00 0.50 0.01 0.00 0.38 0.00 0.00 41.96 42.85 3h3n s TYR 293 CO 0.48 -0.10 -0.19 0.20 -1.52 0.00 0.00 175.55 174.42 3h3n s GLY 294 N -1.43 1.40 0.03 5.49 0.00 -1.26 -0.84 107.32 110.71 3h3n s GLY 294 Ca 0.08 -1.15 -0.11 0.00 0.00 0.00 0.00 44.72 43.54 3h3n s GLY 294 CO -0.05 0.15 0.23 -0.26 0.00 0.00 0.00 173.10 173.17 3h3n s ILE 295 N 1.07 0.09 -1.49 0.90 -4.36 -0.54 -1.85 121.20 115.02 3h3n s ILE 295 Ca -0.01 -0.77 -0.12 0.00 -0.26 0.00 0.00 60.65 59.49 3h3n s ILE 295 Cb -0.14 -0.85 0.08 0.00 1.25 0.00 0.00 42.46 42.80 3h3n s ILE 295 CO -0.07 -0.43 0.81 0.59 0.24 0.00 0.00 174.94 176.09 3h3n n ASN 296 N 0.78 -4.60 0.00 4.36 3.02 -1.26 -1.32 115.26 116.25 3h3n n ASN 296 Ca -0.19 -0.65 0.00 0.00 -0.03 0.00 0.00 54.58 53.71 3h3n n ASN 296 Cb 0.58 -3.70 0.00 0.00 -0.61 0.00 0.00 39.78 36.05 3h3n n ASN 296 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h3n n GLY 297 N -1.53 0.27 3.47 7.41 0.00 -1.26 -5.00 105.19 108.56 3h3n n GLY 297 Ca 0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 3h3n n GLY 297 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h3n s LYS 298 N -0.94 1.68 -0.14 1.61 -0.14 -0.44 -5.13 119.74 116.24 3h3n s LYS 298 Ca 0.00 -1.62 0.02 0.00 -1.36 0.00 0.00 55.97 53.01 3h3n s LYS 298 Cb 0.00 -1.85 0.01 0.00 -1.68 0.00 0.00 37.83 34.32 3h3n s LYS 298 CO 0.00 0.37 -0.20 0.08 -0.76 0.00 0.00 175.35 174.83 3h3n s VAL 299 N -2.13 1.96 -0.22 3.17 1.01 -1.26 -1.47 120.40 121.46 3h3n s VAL 299 Ca 0.26 -0.91 -0.07 0.00 0.00 0.00 0.00 61.98 61.26 3h3n s VAL 299 Cb -0.06 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 3h3n s VAL 299 CO 0.13 0.53 0.04 -0.31 0.00 0.00 0.00 175.10 175.50 3h3n s TYR 300 N 0.93 3.10 0.60 5.22 2.02 -0.02 -4.23 117.35 124.97 3h3n s TYR 300 Ca -0.05 -0.34 -0.03 0.00 -0.37 0.00 0.00 57.07 56.28 3h3n s TYR 300 Cb -0.15 -2.15 0.03 0.00 -0.40 0.00 0.00 41.96 39.29 3h3n s TYR 300 CO -0.04 -0.22 0.87 0.71 -1.57 0.00 0.00 175.55 175.30 3h3n s TYR 301 N 1.17 3.01 0.07 2.71 2.02 0.44 0.04 117.35 126.80 3h3n s TYR 301 Ca 0.04 0.31 -0.10 0.00 -0.37 0.00 0.00 57.07 56.95 3h3n s TYR 301 Cb -0.14 -2.84 0.01 0.00 -0.40 0.00 0.00 41.96 38.58 3h3n s TYR 301 CO 0.03 -0.98 0.23 0.00 -1.57 0.00 0.00 175.55 173.26 3h3n s ALA 302 N -2.95 -0.40 -0.14 3.71 0.00 0.42 -1.17 121.76 121.24 3h3n s ALA 302 Ca 0.56 -0.39 -0.04 0.00 0.00 0.00 0.00 51.96 52.10 3h3n s ALA 302 Cb -0.10 0.43 -0.03 0.00 0.00 0.00 0.00 23.12 23.41 3h3n s ALA 302 CO 0.42 -0.47 -0.00 -0.51 0.00 0.00 0.00 175.76 175.19 3h3n s LEU 303 N -2.55 3.47 0.03 0.00 1.43 -0.25 -1.61 118.68 119.21 3h3n s LEU 303 Ca 0.01 -0.01 0.03 0.00 -1.03 0.00 0.00 54.13 53.14 3h3n s LEU 303 Cb 0.02 -1.84 -0.02 0.00 0.03 0.00 0.00 46.19 44.39 3h3n s LEU 303 CO -0.08 0.23 -0.10 -0.70 0.23 0.00 0.00 176.35 175.92 3h3n s GLU 304 N 0.03 0.72 -0.17 1.70 2.12 0.18 -1.48 118.70 121.79 3h3n s GLU 304 Ca 0.02 -0.63 0.01 0.00 0.36 0.00 0.00 54.97 54.73 3h3n s GLU 304 Cb -0.13 -0.65 0.03 0.00 0.26 0.00 0.00 34.13 33.63 3h3n s GLU 304 CO 0.02 0.16 -0.13 0.20 -0.54 0.00 0.00 175.26 174.96 3h3n s GLY 305 N -1.03 1.20 -0.21 -1.50 0.00 -0.27 -1.27 107.32 104.24 3h3n s GLY 305 Ca -0.01 -1.04 -0.10 0.00 0.00 0.00 0.00 44.72 43.57 3h3n s GLY 305 CO 0.01 0.56 0.13 -0.56 0.00 0.00 0.00 173.10 173.24 3h3n s SER 306 N 1.44 6.07 -0.37 1.64 0.01 -1.26 -1.83 113.70 119.39 3h3n s SER 306 Ca 0.03 0.16 -0.00 0.00 1.31 0.00 0.00 55.95 57.45 3h3n s SER 306 Cb -0.14 -2.07 0.10 0.00 0.21 0.00 0.00 66.02 64.12 3h3n s SER 306 CO -0.10 0.14 0.13 -0.63 0.41 0.00 0.00 173.24 173.19 3h3n s ILE 307 N 0.59 2.92 0.19 1.44 1.01 0.01 -1.21 121.20 126.15 3h3n s ILE 307 Ca 0.07 -2.07 -0.12 0.00 0.00 0.00 0.00 60.65 58.53 3h3n s ILE 307 Cb -0.12 -3.00 0.10 0.00 0.01 0.00 0.00 42.46 39.44 3h3n s ILE 307 CO 0.00 -0.59 1.82 -0.26 0.00 0.00 0.00 174.94 175.91 3h3n h PHE 308 N 7.90 0.65 -3.58 3.97 0.04 -1.92 0.13 116.94 124.13 3h3n h PHE 308 Ca -0.11 0.02 -0.67 0.00 2.80 0.00 0.00 57.97 60.01 3h3n h PHE 308 Cb 1.04 -0.21 -0.27 0.00 2.20 0.00 0.00 35.95 38.71 3h3n h PHE 308 CO 0.53 0.36 -0.66 0.08 -0.60 0.00 0.00 178.31 178.03 3h3n s VAL 309 N -6.13 3.69 0.00 -0.55 1.01 -1.26 -4.04 120.40 113.12 3h3n s VAL 309 Ca -0.13 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.10 3h3n s VAL 309 Cb 0.14 -2.88 0.00 0.00 0.00 0.00 0.00 36.38 33.64 3h3n s VAL 309 CO 0.75 0.13 0.00 0.00 0.00 0.00 0.00 175.10 175.98 3h3n n ALA 310 N 4.82 2.85 0.10 5.51 0.00 -0.72 -4.80 120.51 128.27 3h3n n ALA 310 Ca -0.15 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.24 3h3n n ALA 310 Cb 0.48 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.97 3h3n n ALA 310 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3h3n h GLY 311 N 0.00 0.06 2.00 0.00 0.00 -0.08 -3.21 103.07 101.85 3h3n h GLY 311 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.23 3h3n h GLY 311 CO 0.00 0.09 0.00 1.48 0.00 0.00 0.00 176.54 178.11 3h3n h SER 312 N 0.03 0.00 -0.01 0.19 4.64 -1.67 -1.00 113.55 115.73 3h3n h SER 312 Ca -0.02 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.15 3h3n h SER 312 Cb 1.40 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.48 3h3n h SER 312 CO 0.11 0.00 -0.49 0.00 -0.87 0.00 0.00 176.83 175.57 3h3n h ALA 313 N 2.04 0.74 -0.12 5.18 0.00 -1.84 -1.37 119.26 123.90 3h3n h ALA 313 Ca 0.00 -0.49 -0.16 0.00 0.00 0.00 0.00 54.91 54.26 3h3n h ALA 313 Cb 0.27 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3h3n h ALA 313 CO 0.00 0.67 -0.62 0.82 0.00 0.00 0.00 179.25 180.12 3h3n h ILE 314 N 0.45 1.36 -0.58 0.00 1.08 -1.35 -2.41 117.51 116.06 3h3n h ILE 314 Ca 0.02 -1.95 -0.04 0.00 -0.39 0.00 0.00 64.86 62.50 3h3n h ILE 314 Cb 1.03 1.94 -0.03 0.00 -3.07 0.00 0.00 36.82 36.69 3h3n h ILE 314 CO 0.09 0.59 0.22 1.56 -0.69 0.00 0.00 178.15 179.92 3h3n h GLN 315 N 0.30 0.85 -0.56 2.37 4.20 -1.12 -2.11 115.11 119.03 3h3n h GLN 315 Ca -0.01 -0.14 -0.10 0.00 0.06 0.00 0.00 58.65 58.46 3h3n h GLN 315 Cb 1.16 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.77 3h3n h GLN 315 CO 0.11 0.71 -0.04 2.35 -0.67 0.00 0.00 178.83 181.29 3h3n h TRP 316 N 0.84 1.10 -0.43 2.96 7.01 -0.97 0.22 115.95 126.68 3h3n h TRP 316 Ca 0.20 -0.20 -0.05 0.00 2.11 0.00 0.00 58.89 60.95 3h3n h TRP 316 Cb 0.19 -0.29 -0.02 0.00 -2.10 0.00 0.00 29.16 26.94 3h3n h TRP 316 CO 0.01 1.00 0.07 -0.07 -2.79 0.00 0.00 178.44 176.66 3h3n h LEU 317 N 0.92 0.61 0.02 0.65 3.38 -0.95 0.43 115.31 120.36 3h3n h LEU 317 Ca 0.16 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 3h3n h LEU 317 Cb 0.58 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3h3n h LEU 317 CO 0.04 0.63 -0.01 -0.09 0.09 0.00 0.00 178.44 179.10 3h3n h ARG 318 N 0.64 -0.02 0.03 1.13 2.43 -0.98 0.36 114.38 117.96 3h3n h ARG 318 Ca 0.14 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 58.98 3h3n h ARG 318 Cb 0.29 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.79 3h3n h ARG 318 CO 0.00 0.72 -1.95 -0.25 -1.51 0.00 0.00 179.97 176.97 3h3n n ASP 319 N -4.73 1.03 0.00 -3.80 8.00 0.75 -3.48 116.55 114.32 3h3n n ASP 319 Ca -0.09 0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.67 3h3n n ASP 319 Cb 0.37 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.42 3h3n n ASP 319 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h3n n GLY 320 N 1.73 -0.48 0.24 0.44 0.00 0.14 -4.47 105.19 102.79 3h3n n GLY 320 Ca -0.25 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.90 3h3n n GLY 320 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3h3n h LEU 321 N 0.00 0.00 -0.60 0.99 3.38 -1.47 -3.47 115.31 114.13 3h3n h LEU 321 Ca 0.00 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.55 3h3n h LEU 321 Cb 0.00 0.00 0.08 0.00 0.09 0.00 0.00 40.66 40.83 3h3n h LEU 321 CO 0.00 0.01 -0.69 0.54 0.09 0.00 0.00 178.44 178.39 3h3n n ARG 322 N -3.10 -6.84 0.05 1.13 1.74 -0.08 -4.89 116.66 104.66 3h3n n ARG 322 Ca 0.03 0.77 -0.08 0.00 -0.77 0.00 0.00 57.85 57.79 3h3n n ARG 322 Cb 0.46 -5.75 -0.13 0.00 -1.02 0.00 0.00 32.46 26.02 3h3n n ARG 322 CO 0.00 0.00 0.00 1.98 -1.52 0.00 0.00 177.63 178.09 3h3n h MET 323 N -2.34 0.03 -5.97 5.56 4.05 -0.62 -3.46 114.93 112.18 3h3n h MET 323 Ca -0.56 -0.05 -0.52 0.00 -0.28 0.00 0.00 59.70 58.28 3h3n h MET 323 Cb 1.37 0.02 -0.20 0.00 -0.80 0.00 0.00 31.60 31.99 3h3n h MET 323 CO 0.59 0.93 -0.80 0.96 0.23 0.00 0.00 176.91 178.82 3h3n s ILE 324 N -2.68 1.69 0.02 1.77 -4.36 -1.22 -5.03 121.20 111.39 3h3n s ILE 324 Ca -0.01 -1.70 -0.17 0.00 -0.26 0.00 0.00 60.65 58.52 3h3n s ILE 324 Cb 0.09 -1.65 -0.35 0.00 1.25 0.00 0.00 42.46 41.80 3h3n s ILE 324 CO 0.83 -0.20 0.97 -0.08 0.24 0.00 0.00 174.94 176.70 3h3n h GLU 325 N 3.71 0.51 -4.60 0.37 4.81 -1.91 -3.40 114.58 114.07 3h3n h GLU 325 Ca -0.44 -0.87 -0.24 0.00 -0.13 0.00 0.00 59.36 57.68 3h3n h GLU 325 Cb 1.19 0.33 -0.18 0.00 0.63 0.00 0.00 28.75 30.72 3h3n h GLU 325 CO 0.45 1.42 -0.71 0.95 -0.73 0.00 0.00 179.01 180.39 3h3n s THR 326 N -2.58 0.61 0.21 0.32 -4.23 -1.26 -5.03 115.64 103.68 3h3n s THR 326 Ca -0.10 -1.53 -0.09 0.00 -1.18 0.00 0.00 61.69 58.79 3h3n s THR 326 Cb 0.04 -1.18 0.16 0.00 1.34 0.00 0.00 72.50 72.86 3h3n s THR 326 CO 0.93 -0.65 1.82 0.28 -0.54 0.00 0.00 174.62 176.46 3h3n h SER 327 N 3.68 1.00 0.29 3.99 0.02 -1.91 -2.20 113.55 118.42 3h3n h SER 327 Ca -0.35 -0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 60.46 3h3n h SER 327 Cb 1.18 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 63.46 3h3n h SER 327 CO 0.54 0.83 -0.12 -0.65 -1.14 0.00 0.00 176.83 176.29 3h3n h PRO 328 N 1.10 0.00 0.00 3.45 0.11 -1.99 -1.94 132.00 132.73 3h3n h PRO 328 Ca 0.27 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.38 3h3n h PRO 328 Cb 0.07 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.18 3h3n h PRO 328 CO -0.04 0.12 -0.02 0.37 -0.21 0.00 0.00 178.00 178.22 3h3n h GLN 329 N 0.00 0.00 -0.99 1.05 4.15 -1.81 -2.45 115.11 115.06 3h3n h GLN 329 Ca -0.00 0.00 0.11 0.00 0.77 0.00 0.00 58.65 59.53 3h3n h GLN 329 Cb 0.30 0.00 -0.08 0.00 0.21 0.00 0.00 27.48 27.91 3h3n h GLN 329 CO 0.02 0.02 0.62 0.66 -1.93 0.00 0.00 178.83 178.22 3h3n h SER 330 N 0.00 0.92 -0.70 -0.69 4.64 -1.41 -1.30 113.55 115.00 3h3n h SER 330 Ca -0.00 0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.33 3h3n h SER 330 Cb 0.05 -0.14 -0.03 0.00 -0.31 0.00 0.00 62.40 61.96 3h3n h SER 330 CO 0.00 0.50 0.30 -0.08 -0.87 0.00 0.00 176.83 176.68 3h3n h GLU 331 N 1.00 1.04 -0.46 4.77 4.81 -1.63 -0.87 114.58 123.24 3h3n h GLU 331 Ca 0.48 -0.18 -0.03 0.00 -0.13 0.00 0.00 59.36 59.51 3h3n h GLU 331 Cb 0.44 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 3h3n h GLU 331 CO -0.25 0.85 0.19 1.49 -0.73 0.00 0.00 179.01 180.56 3h3n h GLU 332 N 1.00 0.69 -0.36 1.92 4.22 -1.39 -2.41 114.58 118.26 3h3n h GLU 332 Ca 0.24 -0.12 -0.10 0.00 0.08 0.00 0.00 59.36 59.46 3h3n h GLU 332 Cb 0.19 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 3h3n h GLU 332 CO -0.02 0.62 -0.15 -0.07 -2.18 0.00 0.00 179.01 177.21 3h3n h LEU 333 N 0.60 0.75 -1.14 1.64 3.38 -1.10 -3.18 115.31 116.27 3h3n h LEU 333 Ca 0.15 -0.40 -0.07 0.00 0.09 0.00 0.00 57.88 57.66 3h3n h LEU 333 Cb 0.19 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3h3n h LEU 333 CO -0.01 0.98 -0.12 0.00 0.09 0.00 0.00 178.44 179.38 3h3n h ALA 334 N 0.80 1.29 0.00 1.53 0.00 -1.12 -2.15 119.26 119.60 3h3n h ALA 334 Ca 0.08 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3h3n h ALA 334 Cb 0.69 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3h3n h ALA 334 CO 0.05 0.47 0.00 0.00 0.00 0.00 0.00 179.25 179.77 3h3n h ALA 335 N 1.45 1.00 -0.26 0.00 0.00 -1.41 -2.56 119.26 117.48 3h3n h ALA 335 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3h3n h ALA 335 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3h3n h ALA 335 CO 0.03 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.91 3h3n n LYS 336 N -2.89 2.37 -1.94 0.00 5.02 -0.81 -4.97 118.16 114.94 3h3n n LYS 336 Ca -0.00 -2.05 -0.42 0.00 -2.02 0.00 0.00 58.31 53.82 3h3n n LYS 336 Cb 0.21 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.70 3h3n n LYS 336 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h3n s ALA 337 N -1.68 3.73 -1.11 7.82 0.00 -0.97 -4.91 121.76 124.63 3h3n s ALA 337 Ca 0.35 1.38 0.09 0.00 0.00 0.00 0.00 51.96 53.78 3h3n s ALA 337 Cb 0.22 -3.60 0.10 0.00 0.00 0.00 0.00 23.12 19.83 3h3n s ALA 337 CO 0.31 -0.79 0.86 1.63 0.00 0.00 0.00 175.76 177.77 3h3n n LYS 338 N 3.29 0.68 -0.87 0.00 4.76 -1.26 -4.99 118.16 119.76 3h3n n LYS 338 Ca 0.11 -1.19 -0.29 0.00 -2.87 0.00 0.00 58.31 54.07 3h3n n LYS 338 Cb 0.39 -1.19 0.21 0.00 -1.84 0.00 0.00 35.03 32.60 3h3n n LYS 338 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3h3n s GLY 339 N -0.81 1.57 0.00 0.72 0.00 -1.26 -4.87 107.32 102.66 3h3n s GLY 339 Ca 0.12 -0.19 0.16 0.00 0.00 0.00 0.00 44.72 44.81 3h3n s GLY 339 CO 0.12 0.45 1.38 1.34 0.00 0.00 0.00 173.10 176.39 3h3n n ASP 340 N -4.49 0.00 -3.08 1.64 2.03 -1.26 -4.83 116.55 106.56 3h3n n ASP 340 Ca 0.05 -0.51 -0.17 0.00 0.52 0.00 0.00 54.79 54.68 3h3n n ASP 340 Cb 0.55 0.00 0.07 0.00 -0.72 0.00 0.00 41.12 41.03 3h3n n ASP 340 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 3h3n n ASN 341 N -1.00 -3.54 -0.21 1.67 2.85 -1.26 -4.92 115.26 108.85 3h3n n ASN 341 Ca 0.12 -0.50 0.02 0.00 -0.11 0.00 0.00 54.58 54.12 3h3n n ASN 341 Cb 0.06 -4.38 0.04 0.00 1.24 0.00 0.00 39.78 36.74 3h3n n ASN 341 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 3h3n n GLU 342 N -3.92 1.40 -3.21 1.20 0.28 -1.26 -4.98 120.64 110.15 3h3n n GLU 342 Ca -0.14 -1.27 -0.39 0.00 -0.16 0.00 0.00 57.16 55.21 3h3n n GLU 342 Cb 0.61 -1.09 -0.06 0.00 1.43 0.00 0.00 31.44 32.33 3h3n n GLU 342 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 3h3n s VAL 343 N -0.70 4.94 -0.07 3.84 1.01 -1.26 -4.49 120.40 123.68 3h3n s VAL 343 Ca 0.07 1.23 0.04 0.00 0.00 0.00 0.00 61.98 63.31 3h3n s VAL 343 Cb 0.04 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.50 3h3n s VAL 343 CO 0.06 0.40 -0.19 -0.31 0.00 0.00 0.00 175.10 175.06 3h3n s TYR 344 N -0.06 1.98 -0.14 5.22 2.02 -0.49 -4.75 117.35 121.12 3h3n s TYR 344 Ca 0.31 -0.71 0.01 0.00 -0.37 0.00 0.00 57.07 56.31 3h3n s TYR 344 Cb -0.18 -1.35 -0.00 0.00 -0.40 0.00 0.00 41.96 40.02 3h3n s TYR 344 CO 0.17 -0.29 -0.17 0.08 -1.57 0.00 0.00 175.55 173.77 3h3n s VAL 345 N 0.32 2.61 -0.53 0.71 1.01 -1.26 -0.62 120.40 122.64 3h3n s VAL 345 Ca -0.12 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.08 3h3n s VAL 345 Cb -0.15 -2.08 0.13 0.00 0.00 0.00 0.00 36.38 34.28 3h3n s VAL 345 CO 0.05 0.53 0.28 -0.69 0.00 0.00 0.00 175.10 175.27 3h3n s VAL 346 N 0.65 2.79 -1.53 2.92 1.01 0.15 -4.62 120.40 121.77 3h3n s VAL 346 Ca -0.09 -3.20 -0.10 0.00 0.00 0.00 0.00 61.98 58.60 3h3n s VAL 346 Cb -0.16 -2.92 -0.08 0.00 0.00 0.00 0.00 36.38 33.23 3h3n s VAL 346 CO 0.02 -0.80 2.82 -0.81 0.00 0.00 0.00 175.10 176.33 3h3n n PRO 347 N 3.24 3.45 -1.67 2.72 -0.04 -1.26 -1.30 135.00 140.15 3h3n n PRO 347 Ca 0.05 -2.13 -0.32 0.00 -0.04 0.00 0.00 63.50 61.07 3h3n n PRO 347 Cb 0.34 -2.78 -0.04 0.00 -0.04 0.00 0.00 33.50 30.97 3h3n n PRO 347 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h3n n ALA 348 N 3.81 6.64 -0.33 0.55 0.00 -1.26 -4.66 120.51 125.26 3h3n n ALA 348 Ca 0.73 -3.43 0.15 0.00 0.00 0.00 0.00 53.44 50.89 3h3n n ALA 348 Cb 0.23 -2.46 0.34 0.00 0.00 0.00 0.00 19.45 17.56 3h3n n ALA 348 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3h3n h PHE 349 N 3.73 0.88 -0.33 0.00 0.04 -1.85 -1.69 116.94 117.72 3h3n h PHE 349 Ca 0.53 0.04 -0.23 0.00 2.80 0.00 0.00 57.97 61.10 3h3n h PHE 349 Cb 0.58 -0.24 -0.18 0.00 2.20 0.00 0.00 35.95 38.31 3h3n h PHE 349 CO 1.56 0.06 -0.57 0.25 -0.60 0.00 0.00 178.31 179.01 3h3n n THR 350 N -4.92 2.38 0.00 -1.55 -2.24 -1.26 -4.62 114.28 102.07 3h3n n THR 350 Ca 0.24 -3.58 0.00 0.00 -2.27 0.00 0.00 64.05 58.44 3h3n n THR 350 Cb 0.67 -0.60 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 3h3n n THR 350 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h3n n GLY 351 N -0.96 1.49 3.80 3.38 0.00 -0.66 -4.86 105.19 107.39 3h3n n GLY 351 Ca 0.30 -1.99 -0.38 0.00 0.00 0.00 0.00 46.02 43.96 3h3n n GLY 351 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h3n s LEU 352 N 0.00 4.39 0.00 0.99 1.43 0.46 -4.65 118.68 121.31 3h3n s LEU 352 Ca 0.00 0.79 0.00 0.00 -1.03 0.00 0.00 54.13 53.89 3h3n s LEU 352 Cb 0.00 -2.50 0.00 0.00 0.03 0.00 0.00 46.19 43.72 3h3n s LEU 352 CO 0.00 0.24 0.00 0.61 0.23 0.00 0.00 176.35 177.43 3h3n n GLY 353 N 2.36 0.48 3.76 -3.19 0.00 -1.26 -1.88 105.19 105.46 3h3n n GLY 353 Ca -0.13 -1.68 -0.38 0.00 0.00 0.00 0.00 46.02 43.83 3h3n n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3n s ALA 354 N -3.59 2.93 -1.68 4.61 0.00 -0.35 -0.78 121.76 122.91 3h3n s ALA 354 Ca 0.00 1.27 0.11 0.00 0.00 0.00 0.00 51.96 53.35 3h3n s ALA 354 Cb 0.00 -3.53 0.38 0.00 0.00 0.00 0.00 23.12 19.97 3h3n s ALA 354 CO 0.00 -1.19 1.27 -0.35 0.00 0.00 0.00 175.76 175.49 3h3n n PRO 355 N -0.75 2.22 -0.06 0.00 -0.04 -1.26 -4.69 135.00 130.41 3h3n n PRO 355 Ca 0.09 -1.52 -0.09 0.00 -0.04 0.00 0.00 63.50 61.94 3h3n n PRO 355 Cb 0.45 -1.45 -0.08 0.00 -0.04 0.00 0.00 33.50 32.37 3h3n n PRO 355 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3h3n h TYR 356 N 2.33 -0.00 -5.91 0.54 0.05 -1.24 -3.45 116.97 109.29 3h3n h TYR 356 Ca 0.00 -0.00 -0.38 0.00 0.05 0.00 0.00 58.73 58.40 3h3n h TYR 356 Cb 0.72 0.00 0.10 0.00 1.01 0.00 0.00 36.73 38.56 3h3n h TYR 356 CO 0.35 0.62 -0.81 0.91 -1.05 0.00 0.00 178.16 178.18 3h3n n TRP 357 N -4.68 -2.03 -3.65 4.88 7.02 -0.18 -4.96 117.44 113.85 3h3n n TRP 357 Ca -0.06 0.87 -0.39 0.00 -1.02 0.00 0.00 57.50 56.91 3h3n n TRP 357 Cb 0.30 -4.65 -0.09 0.00 -2.42 0.00 0.00 31.31 24.45 3h3n n TRP 357 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 3h3n s ASP 358 N -4.34 5.52 0.27 -0.99 -1.08 -0.79 -4.95 116.67 110.31 3h3n s ASP 358 Ca 0.01 -2.27 0.25 0.00 -0.52 0.00 0.00 52.55 50.02 3h3n s ASP 358 Cb -0.00 -1.93 0.96 0.00 -1.46 0.00 0.00 42.92 40.49 3h3n s ASP 358 CO 0.78 -0.55 1.74 0.77 0.52 0.00 0.00 175.17 178.43 3h3n h SER 359 N 7.89 0.00 1.33 -0.34 4.64 -1.89 0.13 113.55 125.31 3h3n h SER 359 Ca -0.11 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.20 3h3n h SER 359 Cb 1.03 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.12 3h3n h SER 359 CO 0.76 0.00 -0.68 -0.33 -0.87 0.00 0.00 176.83 175.72 3h3n h GLU 360 N 0.00 0.00 -7.12 4.77 5.08 -1.92 -3.38 114.58 112.01 3h3n h GLU 360 Ca 0.00 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.85 3h3n h GLU 360 Cb 0.45 0.00 0.09 0.00 0.50 0.00 0.00 28.75 29.80 3h3n h GLU 360 CO 0.00 0.02 0.43 0.00 -1.00 0.00 0.00 179.01 178.46 3h3n s ALA 361 N -3.29 2.57 0.36 3.43 0.00 -1.20 -4.92 121.76 118.71 3h3n s ALA 361 Ca 0.02 0.82 0.03 0.00 0.00 0.00 0.00 51.96 52.83 3h3n s ALA 361 Cb 0.08 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 3h3n s ALA 361 CO 0.75 -1.05 0.10 1.03 0.00 0.00 0.00 175.76 176.59 3h3n s ARG 362 N -3.51 1.78 0.38 0.00 1.81 -1.25 -2.72 118.95 115.44 3h3n s ARG 362 Ca 0.73 -2.04 -0.28 0.00 -1.72 0.00 0.00 55.73 52.42 3h3n s ARG 362 Cb -0.25 -0.69 -0.11 0.00 -0.45 0.00 0.00 34.95 33.45 3h3n s ARG 362 CO 0.33 -0.35 1.47 0.20 -0.68 0.00 0.00 175.30 176.27 3h3n s GLY 363 N -3.54 2.94 0.11 -3.53 0.00 -1.09 -4.47 107.32 97.75 3h3n s GLY 363 Ca 0.30 1.56 -0.07 0.00 0.00 0.00 0.00 44.72 46.50 3h3n s GLY 363 CO 0.15 2.23 0.18 0.00 0.00 0.00 0.00 173.10 175.66 3h3n s ALA 364 N -1.13 -0.00 -0.00 3.20 0.00 -0.42 -4.92 121.76 118.49 3h3n s ALA 364 Ca 0.53 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.69 3h3n s ALA 364 Cb -0.46 0.59 -0.00 0.00 0.00 0.00 0.00 23.12 23.25 3h3n s ALA 364 CO 0.62 -0.53 -0.03 0.08 0.00 0.00 0.00 175.76 175.90 3h3n s VAL 365 N -3.91 0.25 0.15 0.00 1.01 -1.26 -0.68 120.40 115.96 3h3n s VAL 365 Ca 0.10 -0.14 0.02 0.00 0.00 0.00 0.00 61.98 61.96 3h3n s VAL 365 Cb 0.05 -0.21 -0.04 0.00 0.00 0.00 0.00 36.38 36.17 3h3n s VAL 365 CO -0.07 0.07 -0.02 -0.36 0.00 0.00 0.00 175.10 174.71 3h3n s PHE 366 N -0.08 1.11 -0.84 5.22 0.08 0.21 -4.89 117.98 118.78 3h3n s PHE 366 Ca 0.01 -0.98 0.00 0.00 0.12 0.00 0.00 56.93 56.08 3h3n s PHE 366 Cb -0.01 -0.63 0.00 0.00 -0.57 0.00 0.00 43.02 41.81 3h3n s PHE 366 CO -0.00 -0.19 0.00 0.41 -0.10 0.00 0.00 175.22 175.34 3h3n n GLY 367 N -0.17 0.45 3.73 4.36 0.00 -1.26 -1.39 105.19 110.90 3h3n n GLY 367 Ca -0.08 -0.56 -0.41 0.00 0.00 0.00 0.00 46.02 44.96 3h3n n GLY 367 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h3n s LEU 368 N -2.35 4.50 0.33 0.99 1.43 -1.26 -4.44 118.68 117.88 3h3n s LEU 368 Ca 0.00 1.96 0.03 0.00 -1.03 0.00 0.00 54.13 55.09 3h3n s LEU 368 Cb 0.00 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.58 3h3n s LEU 368 CO 0.00 -0.14 0.12 0.42 0.23 0.00 0.00 176.35 176.97 3h3n s THR 369 N -0.17 0.65 0.54 5.49 -4.23 -1.26 -5.02 115.64 111.64 3h3n s THR 369 Ca 0.48 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 59.26 3h3n s THR 369 Cb -0.27 -2.56 0.32 0.00 1.34 0.00 0.00 72.50 71.34 3h3n s THR 369 CO 0.33 0.00 2.19 -0.09 -0.54 0.00 0.00 174.62 176.51 3h3n h ARG 370 N 2.10 0.00 -0.01 3.99 9.65 -2.07 -1.80 114.38 126.25 3h3n h ARG 370 Ca -0.37 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.51 3h3n h ARG 370 Cb 1.25 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.83 3h3n h ARG 370 CO 0.59 0.04 -0.04 0.41 2.80 0.00 0.00 179.97 183.77 3h3n n GLY 371 N -1.19 -0.51 3.68 2.80 0.00 -1.26 -4.88 105.19 103.83 3h3n n GLY 371 Ca -0.03 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 3h3n n GLY 371 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h3n s THR 372 N -2.14 3.55 0.43 2.61 2.01 -0.68 -4.95 115.64 116.48 3h3n s THR 372 Ca 0.38 0.91 0.08 0.00 0.31 0.00 0.00 61.69 63.36 3h3n s THR 372 Cb 0.21 -3.59 -0.01 0.00 0.01 0.00 0.00 72.50 69.12 3h3n s THR 372 CO 0.39 -0.02 0.41 0.42 -0.69 0.00 0.00 174.62 175.13 3h3n s THR 373 N 2.73 2.58 0.23 -0.82 -4.23 -1.26 -4.96 115.64 109.91 3h3n s THR 373 Ca 0.67 -1.31 -0.06 0.00 -1.18 0.00 0.00 61.69 59.80 3h3n s THR 373 Cb -0.33 -2.90 0.19 0.00 1.34 0.00 0.00 72.50 70.81 3h3n s THR 373 CO 0.28 0.00 1.84 0.50 -0.54 0.00 0.00 174.62 176.70 3h3n h LYS 374 N 0.94 0.86 -0.42 3.99 3.64 -1.99 -0.83 116.57 122.77 3h3n h LYS 374 Ca -0.40 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 58.97 3h3n h LYS 374 Cb 1.27 -0.19 -0.04 0.00 -0.41 0.00 0.00 32.23 32.86 3h3n h LYS 374 CO 0.56 0.57 0.18 0.93 -2.27 0.00 0.00 179.45 179.42 3h3n h GLU 375 N 0.89 0.36 -0.61 1.90 3.07 -1.95 0.12 114.58 118.36 3h3n h GLU 375 Ca 0.35 -0.02 -0.04 0.00 -0.50 0.00 0.00 59.36 59.15 3h3n h GLU 375 Cb 0.18 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 27.98 3h3n h GLU 375 CO -0.18 0.24 0.23 -0.44 -1.40 0.00 0.00 179.01 177.46 3h3n h ASP 376 N 0.37 0.86 -0.25 1.42 3.32 -1.67 -0.96 116.42 119.51 3h3n h ASP 376 Ca 0.19 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 3h3n h ASP 376 Cb 0.13 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 3h3n h ASP 376 CO -0.16 0.81 0.11 0.15 -1.72 0.00 0.00 179.24 178.43 3h3n h PHE 377 N 0.86 0.37 -0.67 4.55 3.57 -0.64 -0.75 116.94 124.24 3h3n h PHE 377 Ca 0.20 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.63 3h3n h PHE 377 Cb 0.23 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 3h3n h PHE 377 CO 0.01 0.37 0.22 0.28 -2.23 0.00 0.00 178.31 176.96 3h3n h VAL 378 N 0.26 1.25 -0.59 1.41 2.07 -0.88 -1.70 116.25 118.07 3h3n h VAL 378 Ca 0.08 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 3h3n h VAL 378 Cb 0.15 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 3h3n h VAL 378 CO -0.01 0.33 0.33 -0.09 0.02 0.00 0.00 177.57 178.16 3h3n h ARG 379 N 0.98 0.81 -0.86 1.57 2.43 -0.95 -1.53 114.38 116.83 3h3n h ARG 379 Ca 0.22 -0.09 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 3h3n h ARG 379 Cb 0.29 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.64 3h3n h ARG 379 CO -0.01 0.61 0.45 0.00 -1.51 0.00 0.00 179.97 179.51 3h3n h ALA 380 N 1.16 1.18 -0.67 2.80 0.00 -0.86 -0.94 119.26 121.92 3h3n h ALA 380 Ca 0.21 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3h3n h ALA 380 Cb 0.02 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 3h3n h ALA 380 CO -0.04 0.65 0.27 1.15 0.00 0.00 0.00 179.25 181.28 3h3n h THR 381 N 1.20 1.24 -0.52 0.00 2.02 -0.84 -2.63 112.91 113.39 3h3n h THR 381 Ca 0.30 -0.75 -0.10 0.00 0.77 0.00 0.00 66.41 66.62 3h3n h THR 381 Cb 0.06 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 3h3n h THR 381 CO -0.04 0.30 -0.07 -0.07 0.37 0.00 0.00 175.52 176.00 3h3n h LEU 382 N 0.95 0.96 -1.93 2.58 3.38 -0.80 -3.07 115.31 117.37 3h3n h LEU 382 Ca 0.22 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 3h3n h LEU 382 Cb 0.21 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 3h3n h LEU 382 CO -0.02 1.07 -0.08 1.56 0.09 0.00 0.00 178.44 181.06 3h3n h GLN 383 N 0.82 0.00 -0.95 1.13 4.20 -0.99 -3.19 115.11 116.14 3h3n h GLN 383 Ca 0.14 0.00 0.13 0.00 0.06 0.00 0.00 58.65 58.97 3h3n h GLN 383 Cb 0.62 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.32 3h3n h GLN 383 CO 0.04 0.08 0.58 0.00 -0.67 0.00 0.00 178.83 178.86 3h3n h ALA 384 N 1.92 1.44 0.00 3.87 0.00 -1.37 -0.49 119.26 124.63 3h3n h ALA 384 Ca -0.00 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 3h3n h ALA 384 Cb 0.35 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3h3n h ALA 384 CO 0.01 0.13 -0.44 -0.24 0.00 0.00 0.00 179.25 178.71 3h3n h VAL 385 N 0.89 1.22 -0.31 0.00 3.04 -1.75 -1.80 116.25 117.53 3h3n h VAL 385 Ca 0.48 -1.56 -0.17 0.00 -1.01 0.00 0.00 66.70 64.45 3h3n h VAL 385 Cb 0.53 1.86 -0.00 0.00 -2.01 0.00 0.00 31.29 31.68 3h3n h VAL 385 CO -0.29 0.43 -0.46 0.00 -1.01 0.00 0.00 177.57 176.25 3h3n h ALA 386 N 1.56 0.47 -0.12 3.17 0.00 -1.30 -1.80 119.26 121.24 3h3n h ALA 386 Ca -0.00 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 3h3n h ALA 386 Cb 0.83 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 3h3n h ALA 386 CO 0.06 0.63 0.01 1.88 0.00 0.00 0.00 179.25 181.82 3h3n h TYR 387 N 0.64 0.22 0.00 0.00 0.05 -1.07 -2.73 116.97 114.09 3h3n h TYR 387 Ca 0.03 -0.03 -0.06 0.00 0.05 0.00 0.00 58.73 58.71 3h3n h TYR 387 Cb 1.06 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 38.73 3h3n h TYR 387 CO 0.07 0.42 -0.29 0.37 -1.05 0.00 0.00 178.16 177.68 3h3n h GLN 388 N -0.04 0.00 -0.23 4.88 4.15 -1.37 -1.33 115.11 121.17 3h3n h GLN 388 Ca 0.04 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.39 3h3n h GLN 388 Cb 0.32 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 3h3n h GLN 388 CO 0.00 0.29 -0.16 0.77 -1.93 0.00 0.00 178.83 177.81 3h3n h SER 389 N 0.00 0.39 -0.38 -0.69 0.02 -1.18 -1.41 113.55 110.30 3h3n h SER 389 Ca -0.00 -0.10 -0.14 0.00 -0.84 0.00 0.00 61.79 60.70 3h3n h SER 389 Cb 0.62 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 3h3n h SER 389 CO 0.04 0.58 -0.33 0.50 -1.14 0.00 0.00 176.83 176.48 3h3n h LYS 390 N 0.37 0.88 -0.76 3.45 3.64 -0.96 -0.78 116.57 122.41 3h3n h LYS 390 Ca 0.07 -0.45 0.08 0.00 -1.27 0.00 0.00 60.65 59.08 3h3n h LYS 390 Cb 0.50 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.27 3h3n h LYS 390 CO 0.03 1.10 0.43 -0.44 -2.27 0.00 0.00 179.45 178.30 3h3n h ASP 391 N 0.69 0.62 -0.16 4.20 3.32 -0.69 0.20 116.42 124.61 3h3n h ASP 391 Ca 0.07 0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.09 3h3n h ASP 391 Cb 0.91 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.38 3h3n h ASP 391 CO 0.08 0.38 -0.16 0.58 -1.72 0.00 0.00 179.24 178.40 3h3n h VAL 392 N 0.75 1.34 -0.42 -1.35 2.07 -1.11 -2.70 116.25 114.83 3h3n h VAL 392 Ca 0.36 -1.32 -0.08 0.00 0.82 0.00 0.00 66.70 66.48 3h3n h VAL 392 Cb 0.29 1.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.89 3h3n h VAL 392 CO -0.22 0.39 -0.06 0.40 0.02 0.00 0.00 177.57 178.10 3h3n h ILE 393 N 0.02 1.24 -0.53 4.57 2.04 -0.83 -0.42 117.51 123.60 3h3n h ILE 393 Ca 0.02 -1.05 -0.07 0.00 1.00 0.00 0.00 64.86 64.76 3h3n h ILE 393 Cb 0.69 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 3h3n h ILE 393 CO 0.04 0.36 0.04 0.44 0.00 0.00 0.00 178.15 179.03 3h3n h ASP 394 N 0.66 0.83 -0.52 1.72 3.32 -1.00 -1.46 116.42 119.97 3h3n h ASP 394 Ca 0.12 -0.19 -0.09 0.00 0.02 0.00 0.00 57.03 56.89 3h3n h ASP 394 Cb 0.50 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 3h3n h ASP 394 CO 0.03 0.87 -0.04 0.74 -1.72 0.00 0.00 179.24 179.11 3h3n h THR 395 N 0.81 1.27 -0.62 0.35 2.02 -1.07 -2.24 112.91 113.43 3h3n h THR 395 Ca 0.16 -1.16 -0.04 0.00 0.77 0.00 0.00 66.41 66.14 3h3n h THR 395 Cb 0.43 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.79 3h3n h THR 395 CO 0.02 0.41 0.24 0.24 0.37 0.00 0.00 175.52 176.79 3h3n h MET 396 N 0.81 0.94 -0.67 6.66 2.86 -0.77 -0.55 114.93 124.21 3h3n h MET 396 Ca 0.14 -0.18 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 3h3n h MET 396 Cb 0.58 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 32.06 3h3n h MET 396 CO 0.03 0.80 0.42 -0.22 1.06 0.00 0.00 176.91 179.01 3h3n h LYS 397 N 0.88 0.90 -0.55 1.72 3.64 -1.16 0.17 116.57 122.17 3h3n h LYS 397 Ca 0.21 -0.07 -0.12 0.00 -1.27 0.00 0.00 60.65 59.40 3h3n h LYS 397 Cb 0.22 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 3h3n h LYS 397 CO -0.02 0.62 -0.12 0.87 -2.27 0.00 0.00 179.45 178.54 3h3n h LYS 398 N 0.91 1.04 -0.25 1.90 1.57 -1.09 0.53 116.57 121.19 3h3n h LYS 398 Ca 0.24 -0.39 -0.15 0.00 -1.87 0.00 0.00 60.65 58.48 3h3n h LYS 398 Cb -0.06 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.19 3h3n h LYS 398 CO -0.05 1.09 -0.43 -0.44 -0.57 0.00 0.00 179.45 179.05 3h3n h ASP 399 N 0.92 0.82 1.36 0.86 3.32 -0.77 -3.23 116.42 119.70 3h3n h ASP 399 Ca 0.14 -0.53 -0.08 0.00 0.02 0.00 0.00 57.03 56.58 3h3n h ASP 399 Cb 0.69 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 3h3n h ASP 399 CO 0.05 1.19 -0.66 0.77 -1.72 0.00 0.00 179.24 178.87 3h3n h SER 400 N 0.47 0.00 0.00 6.45 4.64 -0.67 -3.26 113.55 121.19 3h3n h SER 400 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3h3n h SER 400 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 3h3n h SER 400 CO 0.10 0.33 0.00 0.61 -0.87 0.00 0.00 176.83 176.99 3h3n n GLY 401 N 1.23 2.65 3.90 -0.77 0.00 0.19 -4.98 105.19 107.40 3h3n n GLY 401 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 3h3n n GLY 401 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3h3n n ILE 402 N -1.94 0.00 -4.22 -0.61 -5.35 -1.24 -4.96 119.36 101.05 3h3n n ILE 402 Ca 0.00 -1.19 -0.32 0.00 -0.27 0.00 0.00 62.75 60.97 3h3n n ILE 402 Cb 0.00 -1.30 -0.08 0.00 -1.74 0.00 0.00 39.64 36.52 3h3n n ILE 402 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3h3n s ASP 403 N -5.64 5.10 -0.48 7.28 3.68 -1.26 -4.71 116.67 120.64 3h3n s ASP 403 Ca 0.73 -0.07 0.02 0.00 2.13 0.00 0.00 52.55 55.36 3h3n s ASP 403 Cb -0.03 -1.29 0.13 0.00 -1.45 0.00 0.00 42.92 40.28 3h3n s ASP 403 CO 0.50 0.24 0.23 -0.63 0.13 0.00 0.00 175.17 175.64 3h3n s ILE 404 N -1.18 2.76 -0.84 4.11 1.01 -1.26 -4.94 121.20 120.86 3h3n s ILE 404 Ca 0.22 -2.92 0.26 0.00 0.00 0.00 0.00 60.65 58.21 3h3n s ILE 404 Cb -0.12 -2.92 0.13 0.00 0.01 0.00 0.00 42.46 39.57 3h3n s ILE 404 CO 0.14 -0.76 1.57 -0.81 0.00 0.00 0.00 174.94 175.09 3h3n n PRO 405 N 3.57 0.14 -3.76 2.79 -0.04 -1.26 -4.88 135.00 131.56 3h3n n PRO 405 Ca 0.05 0.07 -0.13 0.00 -0.04 0.00 0.00 63.50 63.44 3h3n n PRO 405 Cb 0.36 -1.62 -0.14 0.00 -0.04 0.00 0.00 33.50 32.07 3h3n n PRO 405 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3h3n s LEU 406 N -3.68 0.78 -0.16 1.53 2.96 -1.26 -2.91 118.68 115.94 3h3n s LEU 406 Ca 0.10 0.35 0.02 0.00 -0.22 0.00 0.00 54.13 54.38 3h3n s LEU 406 Cb 0.16 0.48 0.01 0.00 0.50 0.00 0.00 46.19 47.34 3h3n s LEU 406 CO 0.65 -0.13 -0.20 -0.22 -1.32 0.00 0.00 176.35 175.12 3h3n s LEU 407 N 0.99 2.18 0.00 -0.68 2.96 -0.15 -4.67 118.68 119.31 3h3n s LEU 407 Ca -0.07 -0.60 -0.18 0.00 -0.22 0.00 0.00 54.13 53.06 3h3n s LEU 407 Cb -0.09 -1.48 -0.06 0.00 0.50 0.00 0.00 46.19 45.06 3h3n s LEU 407 CO -0.05 0.05 0.50 -0.54 -1.32 0.00 0.00 176.35 174.99 3h3n s LYS 408 N 0.98 4.14 0.14 1.98 1.02 -1.05 -0.53 119.74 126.41 3h3n s LYS 408 Ca -0.03 0.57 0.06 0.00 0.02 0.00 0.00 55.97 56.59 3h3n s LYS 408 Cb -0.15 -3.28 -0.04 0.00 -0.52 0.00 0.00 37.83 33.84 3h3n s LYS 408 CO -0.05 0.54 -0.13 0.14 -0.92 0.00 0.00 175.35 174.93 3h3n s VAL 409 N -0.68 1.32 0.27 3.17 -7.23 -0.23 -0.82 120.40 116.20 3h3n s VAL 409 Ca 0.27 -1.85 -0.11 0.00 -1.81 0.00 0.00 61.98 58.47 3h3n s VAL 409 Cb -0.18 -1.66 0.04 0.00 0.56 0.00 0.00 36.38 35.15 3h3n s VAL 409 CO 0.15 -0.52 0.60 -0.90 -0.31 0.00 0.00 175.10 174.12 3h3n n ASP 410 N 0.25 -1.62 0.00 4.85 5.68 -0.93 -1.42 116.55 123.37 3h3n n ASP 410 Ca -0.13 -2.09 0.00 0.00 -0.50 0.00 0.00 54.79 52.07 3h3n n ASP 410 Cb 0.58 2.68 0.00 0.00 -1.14 0.00 0.00 41.12 43.25 3h3n n ASP 410 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3h3n n GLY 411 N -0.41 2.13 0.15 6.12 0.00 -0.97 -0.78 105.19 111.44 3h3n n GLY 411 Ca -0.06 -1.94 -0.06 0.00 0.00 0.00 0.00 46.02 43.96 3h3n n GLY 411 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3h3n h GLY 412 N 0.00 0.22 2.00 -0.02 0.00 -1.72 -2.29 103.07 101.26 3h3n h GLY 412 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.45 3h3n h GLY 412 CO 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 176.54 176.41 3h3n h ALA 413 N 1.30 1.00 0.00 3.60 0.00 -1.84 -2.39 119.26 120.93 3h3n h ALA 413 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3h3n h ALA 413 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3h3n h ALA 413 CO -0.34 0.00 0.00 0.00 0.00 0.00 0.00 179.25 178.91 3h3n n ALA 414 N -1.88 1.50 0.28 0.00 0.00 -0.86 -2.23 120.51 117.32 3h3n n ALA 414 Ca -0.00 0.04 0.17 0.00 0.00 0.00 0.00 53.44 53.65 3h3n n ALA 414 Cb 0.16 -1.27 0.72 0.00 0.00 0.00 0.00 19.45 19.06 3h3n n ALA 414 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3h3n h LYS 415 N 0.00 0.00 -6.37 0.00 3.64 -1.58 -3.42 116.57 108.85 3h3n h LYS 415 Ca 0.00 0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 58.84 3h3n h LYS 415 Cb 0.23 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 31.98 3h3n h LYS 415 CO 0.00 0.02 1.09 1.21 -2.27 0.00 0.00 179.45 179.51 3h3n s ASN 416 N -5.71 6.09 0.26 4.20 3.84 -0.94 -4.91 114.94 117.77 3h3n s ASN 416 Ca 0.00 -0.03 -0.05 0.00 0.21 0.00 0.00 52.86 52.99 3h3n s ASN 416 Cb 0.10 -2.55 0.32 0.00 -0.55 0.00 0.00 41.25 38.56 3h3n s ASN 416 CO 0.54 -1.80 1.91 0.44 -2.79 0.00 0.00 177.10 175.40 3h3n h ASP 417 N 10.86 1.12 -0.81 -4.21 3.32 -1.90 -1.91 116.42 122.88 3h3n h ASP 417 Ca -0.27 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 56.73 3h3n h ASP 417 Cb 1.08 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 40.33 3h3n h ASP 417 CO 1.23 0.78 0.36 -0.07 -1.72 0.00 0.00 179.24 179.82 3h3n h LEU 418 N 1.30 1.09 -0.31 1.55 3.38 -1.97 -1.10 115.31 119.25 3h3n h LEU 418 Ca 0.39 -0.15 -0.13 0.00 0.09 0.00 0.00 57.88 58.08 3h3n h LEU 418 Cb -0.05 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.42 3h3n h LEU 418 CO -0.11 0.94 -0.32 0.25 0.09 0.00 0.00 178.44 179.29 3h3n h LEU 419 N 1.17 0.83 -0.94 1.67 5.85 -1.82 -1.56 115.31 120.51 3h3n h LEU 419 Ca 0.28 -0.47 -0.09 0.00 0.84 0.00 0.00 57.88 58.43 3h3n h LEU 419 Cb 0.16 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 3h3n h LEU 419 CO -0.03 1.13 -0.21 0.24 -0.34 0.00 0.00 178.44 179.23 3h3n h MET 420 N 0.54 0.53 -0.51 1.25 2.86 -1.19 0.59 114.93 119.00 3h3n h MET 420 Ca 0.05 -0.19 -0.12 0.00 -2.06 0.00 0.00 59.70 57.38 3h3n h MET 420 Cb 0.90 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.51 3h3n h MET 420 CO 0.08 0.71 -0.16 0.37 1.06 0.00 0.00 176.91 178.97 3h3n h GLN 421 N 0.48 1.01 -0.70 1.72 5.75 -1.13 -1.60 115.11 120.64 3h3n h GLN 421 Ca 0.08 -0.41 -0.04 0.00 -0.15 0.00 0.00 58.65 58.13 3h3n h GLN 421 Cb 0.63 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 29.10 3h3n h GLN 421 CO 0.04 1.09 0.28 0.35 -2.65 0.00 0.00 178.83 177.95 3h3n h PHE 422 N 0.88 1.06 -0.24 3.99 3.57 -0.82 0.06 116.94 125.43 3h3n h PHE 422 Ca 0.13 -0.08 0.01 0.00 3.53 0.00 0.00 57.97 61.56 3h3n h PHE 422 Cb 0.74 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 3h3n h PHE 422 CO 0.05 0.81 0.13 0.37 -2.23 0.00 0.00 178.31 177.45 3h3n h GLN 423 N 0.99 0.27 -0.70 1.11 5.75 -0.56 -0.60 115.11 121.37 3h3n h GLN 423 Ca 0.23 -0.02 -0.07 0.00 -0.15 0.00 0.00 58.65 58.65 3h3n h GLN 423 Cb 0.20 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.66 3h3n h GLN 423 CO -0.02 0.18 0.16 0.00 -2.65 0.00 0.00 178.83 176.50 3h3n h ALA 424 N 1.11 0.92 -0.25 3.38 0.00 -1.02 -2.04 119.26 121.35 3h3n h ALA 424 Ca 0.09 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.76 3h3n h ALA 424 Cb 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3h3n h ALA 424 CO -0.05 0.65 0.15 -0.44 0.00 0.00 0.00 179.25 179.56 3h3n h ASP 425 N 1.05 0.26 0.21 0.00 3.32 -0.56 0.20 116.42 120.89 3h3n h ASP 425 Ca 0.22 -0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.12 3h3n h ASP 425 Cb 0.38 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 3h3n h ASP 425 CO 0.00 0.19 -0.55 -0.29 -1.72 0.00 0.00 179.24 176.87 3h3n h ILE 426 N 0.32 1.35 0.00 0.35 6.09 -1.04 -3.18 117.51 121.39 3h3n h ILE 426 Ca 0.10 -1.84 -0.20 0.00 -1.37 0.00 0.00 64.86 61.54 3h3n h ILE 426 Cb -0.02 1.86 -0.03 0.00 0.47 0.00 0.00 36.82 39.11 3h3n h ILE 426 CO -0.04 0.56 -0.96 -0.07 -3.07 0.00 0.00 178.15 174.57 3h3n h LEU 427 N 0.28 0.00 -0.58 2.19 3.38 -1.23 -3.48 115.31 115.87 3h3n h LEU 427 Ca 0.00 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.72 3h3n h LEU 427 Cb 1.06 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.89 3h3n h LEU 427 CO 0.09 0.96 -0.43 -0.67 0.09 0.00 0.00 178.44 178.49 3h3n n ASP 428 N -3.35 -4.75 -3.94 -0.43 2.03 0.67 -5.03 116.55 101.76 3h3n n ASP 428 Ca 0.00 -0.31 -0.08 0.00 0.52 0.00 0.00 54.79 54.92 3h3n n ASP 428 Cb 0.92 -3.40 -0.08 0.00 -0.72 0.00 0.00 41.12 37.84 3h3n n ASP 428 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 3h3n s ILE 429 N -3.14 0.16 0.28 5.18 -4.36 -1.20 -4.97 121.20 113.14 3h3n s ILE 429 Ca 0.33 -1.39 -0.29 0.00 -0.26 0.00 0.00 60.65 59.04 3h3n s ILE 429 Cb -0.15 -1.44 -0.10 0.00 1.25 0.00 0.00 42.46 42.03 3h3n s ILE 429 CO 0.41 -0.72 1.13 -1.81 0.24 0.00 0.00 174.94 174.19 3h3n s ASP 430 N -2.89 7.20 -0.23 4.36 1.01 -1.15 -4.44 116.67 120.54 3h3n s ASP 430 Ca 0.07 2.31 0.01 0.00 0.71 0.00 0.00 52.55 55.65 3h3n s ASP 430 Cb 0.06 -2.63 0.04 0.00 1.01 0.00 0.00 42.92 41.40 3h3n s ASP 430 CO -0.10 -0.20 -0.13 -0.69 0.21 0.00 0.00 175.17 174.26 3h3n s VAL 431 N -1.08 2.26 -0.33 -1.27 1.01 -0.18 -0.98 120.40 119.84 3h3n s VAL 431 Ca 0.45 -1.31 -0.09 0.00 0.00 0.00 0.00 61.98 61.03 3h3n s VAL 431 Cb -0.33 -2.18 0.01 0.00 0.00 0.00 0.00 36.38 33.88 3h3n s VAL 431 CO 0.42 0.19 0.15 -1.58 0.00 0.00 0.00 175.10 174.28 3h3n s GLN 432 N 1.20 3.10 0.18 2.72 0.74 0.31 -0.17 119.66 127.74 3h3n s GLN 432 Ca -0.03 -0.88 -0.27 0.00 0.05 0.00 0.00 55.36 54.23 3h3n s GLN 432 Cb -0.17 -3.58 -0.08 0.00 1.10 0.00 0.00 33.01 30.28 3h3n s GLN 432 CO -0.07 -0.52 0.83 0.50 -0.55 0.00 0.00 175.29 175.48 3h3n s ARG 433 N 1.56 4.66 0.46 1.67 3.52 0.09 -1.06 118.95 129.84 3h3n s ARG 433 Ca 0.03 1.27 -0.24 0.00 -0.13 0.00 0.00 55.73 56.66 3h3n s ARG 433 Cb -0.18 -3.28 -0.07 0.00 -1.56 0.00 0.00 34.95 29.86 3h3n s ARG 433 CO 0.05 0.52 1.24 0.00 -0.81 0.00 0.00 175.30 176.31 3h3n s ALA 434 N -1.05 3.03 0.28 6.12 0.00 -0.51 -3.23 121.76 126.41 3h3n s ALA 434 Ca 0.38 1.10 0.01 0.00 0.00 0.00 0.00 51.96 53.44 3h3n s ALA 434 Cb -0.24 -3.45 0.59 0.00 0.00 0.00 0.00 23.12 20.02 3h3n s ALA 434 CO 0.28 -0.83 1.77 0.00 0.00 0.00 0.00 175.76 176.98 3h3n h ALA 435 N 2.15 1.40 -3.21 0.00 0.00 -1.85 -3.37 119.26 114.38 3h3n h ALA 435 Ca -0.50 0.08 -0.58 0.00 0.00 0.00 0.00 54.91 53.91 3h3n h ALA 435 Cb 1.26 -0.06 -0.35 0.00 0.00 0.00 0.00 17.79 18.64 3h3n h ALA 435 CO 0.60 -0.04 -0.83 0.54 0.00 0.00 0.00 179.25 179.52 3h3n s ASN 436 N -5.45 2.47 0.47 0.00 6.03 -1.26 -5.02 114.94 112.17 3h3n s ASN 436 Ca -0.12 -0.43 0.20 0.00 -1.03 0.00 0.00 52.86 51.49 3h3n s ASN 436 Cb 0.23 -1.08 1.20 0.00 -3.03 0.00 0.00 41.25 38.57 3h3n s ASN 436 CO 0.79 -0.03 1.94 -0.07 -2.03 0.00 0.00 177.10 177.70 3h3n h LEU 437 N 7.73 0.23 -5.47 3.54 3.38 -1.90 -3.24 115.31 119.57 3h3n h LEU 437 Ca -0.34 0.01 -0.70 0.00 0.09 0.00 0.00 57.88 56.95 3h3n h LEU 437 Cb 1.16 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.84 3h3n h LEU 437 CO 0.49 0.12 3.26 -1.84 0.09 0.00 0.00 178.44 180.56 3h3n n GLU 438 N -4.43 3.69 0.13 1.13 0.00 -1.26 -2.28 120.64 117.62 3h3n n GLU 438 Ca 0.13 -2.66 0.13 0.00 0.00 0.00 0.00 57.16 54.76 3h3n n GLU 438 Cb 0.59 -2.88 0.42 0.00 0.00 0.00 0.00 31.44 29.57 3h3n n GLU 438 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.13 178.92 3h3n h THR 439 N 3.20 0.00 0.07 3.84 1.35 -1.94 -2.82 112.91 116.61 3h3n h THR 439 Ca 0.73 -0.46 -0.00 0.00 -0.55 0.00 0.00 66.41 66.13 3h3n h THR 439 Cb 0.39 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 68.20 3h3n h THR 439 CO 1.74 0.00 -0.03 0.74 -0.25 0.00 0.00 175.52 177.71 3h3n h THR 440 N 0.00 1.09 -0.59 6.82 2.02 -1.83 0.98 112.91 121.39 3h3n h THR 440 Ca 0.00 -0.53 -0.09 0.00 0.77 0.00 0.00 66.41 66.57 3h3n h THR 440 Cb 0.66 1.43 -0.02 0.00 -1.74 0.00 0.00 68.15 68.47 3h3n h THR 440 CO 0.00 0.13 0.03 0.00 0.37 0.00 0.00 175.52 176.05 3h3n h ALA 441 N 0.59 0.93 -0.73 6.16 0.00 -1.89 -2.40 119.26 121.93 3h3n h ALA 441 Ca -0.01 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 3h3n h ALA 441 Cb 0.29 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 3h3n h ALA 441 CO 0.02 0.65 0.44 1.25 0.00 0.00 0.00 179.25 181.60 3h3n h LEU 442 N 0.93 0.87 -0.73 0.00 5.85 -1.36 -0.69 115.31 120.17 3h3n h LEU 442 Ca 0.17 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 3h3n h LEU 442 Cb 0.50 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 3h3n h LEU 442 CO 0.02 0.67 0.44 1.23 -0.34 0.00 0.00 178.44 180.47 3h3n h GLY 443 N 0.99 1.06 1.02 3.75 0.00 -0.46 0.10 103.07 109.53 3h3n h GLY 443 Ca 0.26 -0.44 -0.07 0.00 0.00 0.00 0.00 47.33 47.09 3h3n h GLY 443 CO -0.05 0.43 0.10 0.00 0.00 0.00 0.00 176.54 177.02 3h3n h ALA 444 N 1.23 0.77 -0.64 3.60 0.00 -0.97 -1.99 119.26 121.26 3h3n h ALA 444 Ca 0.26 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3h3n h ALA 444 Cb -0.04 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 3h3n h ALA 444 CO -0.05 0.51 0.33 0.00 0.00 0.00 0.00 179.25 180.04 3h3n h ALA 445 N 1.01 0.83 -0.53 0.00 0.00 -0.71 -1.84 119.26 118.02 3h3n h ALA 445 Ca 0.18 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3h3n h ALA 445 Cb 0.40 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3h3n h ALA 445 CO 0.01 0.37 0.28 1.88 0.00 0.00 0.00 179.25 181.80 3h3n h TYR 446 N 0.88 0.73 -0.56 0.00 0.05 -0.76 0.23 116.97 117.54 3h3n h TYR 446 Ca 0.22 -0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.98 3h3n h TYR 446 Cb 0.09 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 37.57 3h3n h TYR 446 CO -0.00 0.54 0.33 -0.07 -1.05 0.00 0.00 178.16 177.91 3h3n h LEU 447 N 0.70 0.67 -0.35 3.88 3.38 -1.10 -0.94 115.31 121.56 3h3n h LEU 447 Ca 0.18 -0.07 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 3h3n h LEU 447 Cb 0.06 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3h3n h LEU 447 CO -0.03 0.54 -0.27 0.00 0.09 0.00 0.00 178.44 178.77 3h3n h ALA 448 N 1.16 0.50 -0.71 1.53 0.00 -1.13 -2.83 119.26 117.78 3h3n h ALA 448 Ca 0.20 -0.40 0.03 0.00 0.00 0.00 0.00 54.91 54.74 3h3n h ALA 448 Cb -0.00 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 3h3n h ALA 448 CO -0.04 0.52 0.45 0.78 0.00 0.00 0.00 179.25 180.96 3h3n h GLY 449 N 0.59 1.03 1.15 0.00 0.00 -0.28 -2.16 103.07 103.39 3h3n h GLY 449 Ca 0.06 -0.34 -0.07 0.00 0.00 0.00 0.00 47.33 46.99 3h3n h GLY 449 CO 0.07 0.28 0.15 1.41 0.00 0.00 0.00 176.54 178.45 3h3n h LEU 450 N 0.87 1.00 -1.13 3.11 3.38 -1.16 0.17 115.31 121.55 3h3n h LEU 450 Ca 0.29 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 3h3n h LEU 450 Cb 0.03 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 3h3n h LEU 450 CO -0.11 0.97 -0.13 0.00 0.09 0.00 0.00 178.44 179.25 3h3n h ALA 451 N 1.15 1.28 -0.42 1.53 0.00 -1.15 -2.97 119.26 118.69 3h3n h ALA 451 Ca 0.21 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3h3n h ALA 451 Cb 0.37 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3h3n h ALA 451 CO 0.00 0.48 0.00 1.33 0.00 0.00 0.00 179.25 181.06 3h3n n VAL 452 N -4.21 0.55 -1.00 0.00 0.24 -0.91 -4.77 118.33 108.23 3h3n n VAL 452 Ca 0.00 -0.78 0.00 0.00 -2.04 0.00 0.00 64.34 61.53 3h3n n VAL 452 Cb 0.32 0.94 0.00 0.00 -1.47 0.00 0.00 33.84 33.63 3h3n n VAL 452 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h3n n GLY 453 N 1.49 0.51 0.36 7.63 0.00 -0.79 -4.90 105.19 109.50 3h3n n GLY 453 Ca 0.20 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.24 3h3n n GLY 453 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3h3n h PHE 454 N 0.00 0.96 -3.90 1.61 3.57 -0.96 -3.38 116.94 114.84 3h3n h PHE 454 Ca 0.00 0.02 -0.56 0.00 3.53 0.00 0.00 57.97 60.96 3h3n h PHE 454 Cb 0.00 -0.32 -0.31 0.00 2.79 0.00 0.00 35.95 38.11 3h3n h PHE 454 CO 0.00 0.56 -0.84 -1.58 -2.23 0.00 0.00 178.31 174.23 3h3n s TRP 455 N -5.85 1.71 0.15 0.41 0.51 -1.13 -5.01 118.94 109.72 3h3n s TRP 455 Ca -0.11 -0.49 -0.03 0.00 -2.12 0.00 0.00 56.10 53.35 3h3n s TRP 455 Cb 0.19 -1.15 -0.04 0.00 -0.81 0.00 0.00 33.47 31.66 3h3n s TRP 455 CO 0.79 -0.16 1.35 0.87 -0.51 0.00 0.00 176.95 179.29 3h3n h LYS 456 N 6.25 0.42 -2.59 4.98 1.79 -1.89 -3.38 116.57 122.14 3h3n h LYS 456 Ca -0.33 -0.40 0.13 0.00 -2.18 0.00 0.00 60.65 57.87 3h3n h LYS 456 Cb 1.17 0.10 -0.05 0.00 -1.58 0.00 0.00 32.23 31.87 3h3n h LYS 456 CO 0.48 1.06 0.42 0.16 -1.08 0.00 0.00 179.45 180.49 3h3n s ASP 457 N -7.04 -0.14 0.45 0.86 3.84 -1.26 -5.03 116.67 108.36 3h3n s ASP 457 Ca -0.06 -0.59 0.16 0.00 -0.00 0.00 0.00 52.55 52.06 3h3n s ASP 457 Cb 0.09 0.59 1.10 0.00 -1.38 0.00 0.00 42.92 43.33 3h3n s ASP 457 CO 0.86 -1.11 1.97 -0.07 -0.00 0.00 0.00 175.17 176.81 3h3n h LEU 458 N 2.00 0.30 -0.98 2.11 3.38 -1.99 -0.97 115.31 119.15 3h3n h LEU 458 Ca -0.25 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.68 3h3n h LEU 458 Cb 1.23 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 3h3n h LEU 458 CO 0.29 0.17 0.09 0.44 0.09 0.00 0.00 178.44 179.52 3h3n h ASP 459 N 0.33 0.78 -0.55 -0.43 3.32 -1.99 -0.59 116.42 117.29 3h3n h ASP 459 Ca 0.29 -0.16 -0.09 0.00 0.02 0.00 0.00 57.03 57.09 3h3n h ASP 459 Cb 0.69 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.02 3h3n h ASP 459 CO -0.07 0.79 -0.01 -0.08 -1.72 0.00 0.00 179.24 178.14 3h3n h GLU 460 N 0.79 1.01 0.22 3.56 4.81 -1.58 -2.27 114.58 121.12 3h3n h GLU 460 Ca 0.17 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 3h3n h GLU 460 Cb 0.35 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 3h3n h GLU 460 CO 0.01 1.00 -0.21 -0.07 -0.73 0.00 0.00 179.01 179.00 3h3n h LEU 461 N 0.92 -0.56 -2.08 1.64 3.38 -1.15 -2.57 115.31 114.88 3h3n h LEU 461 Ca 0.16 0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.28 3h3n h LEU 461 Cb 0.55 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 3h3n h LEU 461 CO 0.03 -0.31 0.29 0.11 0.09 0.00 0.00 178.44 178.65 3h3n h LYS 462 N -0.46 0.00 0.00 1.13 1.57 -0.89 -0.88 116.57 117.04 3h3n h LYS 462 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3h3n h LYS 462 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 3h3n h LYS 462 CO -0.04 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 177.71 3h3n n SER 463 N -4.05 0.26 0.00 0.86 3.41 -0.87 -1.93 113.62 111.31 3h3n n SER 463 Ca 0.05 0.56 0.11 0.00 -0.26 0.00 0.00 58.87 59.33 3h3n n SER 463 Cb 0.46 -0.62 0.10 0.00 -0.26 0.00 0.00 64.21 63.89 3h3n n SER 463 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3h3n n MET 464 N -1.79 0.05 -1.52 4.33 2.81 -0.34 -4.96 117.12 115.70 3h3n n MET 464 Ca 0.03 0.00 -0.50 0.00 -1.81 0.00 0.00 57.70 55.42 3h3n n MET 464 Cb 0.21 -1.52 -0.04 0.00 -0.71 0.00 0.00 33.22 31.16 3h3n n MET 464 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3h3n n ALA 465 N -1.55 -1.72 -2.37 3.04 0.00 -0.81 -5.00 120.51 112.09 3h3n n ALA 465 Ca 0.04 0.47 -0.29 0.00 0.00 0.00 0.00 53.44 53.67 3h3n n ALA 465 Cb 0.35 -1.88 -0.14 0.00 0.00 0.00 0.00 19.45 17.78 3h3n n ALA 465 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3h3n s GLU 466 N -0.57 1.65 -0.18 0.00 2.12 -1.26 -5.12 118.70 115.34 3h3n s GLU 466 Ca 0.73 -1.15 -0.21 0.00 0.36 0.00 0.00 54.97 54.70 3h3n s GLU 466 Cb -0.93 -1.90 -0.03 0.00 0.26 0.00 0.00 34.13 31.54 3h3n s GLU 466 CO 0.55 0.48 0.64 -2.00 -0.54 0.00 0.00 175.26 174.39 3h3n s GLU 467 N -1.44 4.24 0.36 4.30 2.56 -1.26 -4.61 118.70 122.84 3h3n s GLU 467 Ca 0.12 0.65 0.07 0.00 0.00 0.00 0.00 54.97 55.80 3h3n s GLU 467 Cb -0.10 -3.56 -0.01 0.00 2.00 0.00 0.00 34.13 32.46 3h3n s GLU 467 CO 0.03 -0.21 0.47 0.20 -0.56 0.00 0.00 175.26 175.20 3h3n s GLY 468 N 1.15 1.71 -0.05 -1.50 0.00 -1.24 -4.76 107.32 102.63 3h3n s GLY 468 Ca 0.30 -1.54 -0.39 0.00 0.00 0.00 0.00 44.72 43.09 3h3n s GLY 468 CO 0.11 -1.43 1.43 -0.18 0.00 0.00 0.00 173.10 173.02 3h3n n GLN 469 N -1.66 0.93 -3.83 2.90 -0.06 -1.20 -4.54 117.38 109.93 3h3n n GLN 469 Ca 0.02 0.34 -0.35 0.00 -2.00 0.00 0.00 57.00 55.00 3h3n n GLN 469 Cb 0.59 -1.96 -0.09 0.00 -4.06 0.00 0.00 30.24 24.71 3h3n n GLN 469 CO 0.00 0.00 0.00 1.41 -0.20 0.00 0.00 177.06 178.27 3h3n s MET 470 N 1.37 4.05 -0.24 3.69 -2.45 -1.26 -0.73 119.30 123.72 3h3n s MET 470 Ca 0.90 -0.29 -0.05 0.00 -1.25 0.00 0.00 55.69 54.99 3h3n s MET 470 Cb -1.06 -3.36 -0.01 0.00 1.25 0.00 0.00 34.83 31.65 3h3n s MET 470 CO 0.55 0.21 0.01 -0.06 1.05 0.00 0.00 175.02 176.78 3h3n s PHE 471 N 0.60 3.03 -0.02 4.11 0.08 0.76 -4.99 117.98 121.54 3h3n s PHE 471 Ca 0.06 -0.74 0.00 0.00 0.12 0.00 0.00 56.93 56.37 3h3n s PHE 471 Cb -0.12 -2.17 -0.04 0.00 -0.57 0.00 0.00 43.02 40.12 3h3n s PHE 471 CO 0.01 -0.48 0.02 -0.08 -0.10 0.00 0.00 175.22 174.60 3h3n s THR 472 N 1.53 4.36 0.51 0.64 -1.32 -1.26 -1.01 115.64 119.09 3h3n s THR 472 Ca 0.06 -0.46 -0.23 0.00 -1.21 0.00 0.00 61.69 59.85 3h3n s THR 472 Cb -0.15 -2.93 -0.07 0.00 -1.51 0.00 0.00 72.50 67.84 3h3n s THR 472 CO -0.00 0.43 1.34 -2.65 -2.21 0.00 0.00 174.62 171.53 3h3n n PRO 473 N 1.52 1.83 -1.19 7.08 -0.02 -1.26 -4.81 135.00 138.14 3h3n n PRO 473 Ca -0.15 0.66 -0.02 0.00 -2.02 0.00 0.00 63.50 61.97 3h3n n PRO 473 Cb 0.53 -2.54 -0.03 0.00 -0.02 0.00 0.00 33.50 31.44 3h3n n PRO 473 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3h3n n GLU 474 N -0.64 0.00 -5.12 -0.52 0.28 -1.26 -5.01 120.64 108.38 3h3n n GLU 474 Ca 0.09 -1.38 -0.30 0.00 -0.16 0.00 0.00 57.16 55.40 3h3n n GLU 474 Cb 0.43 0.29 -0.17 0.00 1.43 0.00 0.00 31.44 33.42 3h3n n GLU 474 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 177.13 178.38 3h3n s MET 475 N 0.00 2.67 0.70 3.44 1.75 -1.26 -5.11 119.30 121.49 3h3n s MET 475 Ca 0.14 -0.81 -0.17 0.00 -1.25 0.00 0.00 55.69 53.60 3h3n s MET 475 Cb 0.15 -2.10 0.01 0.00 2.84 0.00 0.00 34.83 35.74 3h3n s MET 475 CO -0.07 0.21 1.20 -2.30 -0.65 0.00 0.00 175.02 173.41 3h3n n PRO 476 N 3.40 0.77 -0.30 4.11 -0.02 -1.26 -4.81 135.00 136.89 3h3n n PRO 476 Ca -0.19 0.32 0.02 0.00 -2.02 0.00 0.00 63.50 61.64 3h3n n PRO 476 Cb 0.53 -2.44 0.21 0.00 -0.02 0.00 0.00 33.50 31.78 3h3n n PRO 476 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h3n h ALA 477 N 0.04 1.46 -0.47 3.55 0.00 -1.99 -2.36 119.26 119.50 3h3n h ALA 477 Ca -0.49 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 3h3n h ALA 477 Cb 1.33 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 3h3n h ALA 477 CO 0.50 0.44 0.21 1.49 0.00 0.00 0.00 179.25 181.89 3h3n h GLU 478 N 1.10 0.68 0.18 0.00 4.81 -1.99 -0.99 114.58 118.37 3h3n h GLU 478 Ca 0.37 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.48 3h3n h GLU 478 Cb 0.08 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.34 3h3n h GLU 478 CO -0.12 0.60 -0.08 1.49 -0.73 0.00 0.00 179.01 180.16 3h3n h GLU 479 N 0.61 -0.23 -0.07 1.92 4.81 -1.85 -1.96 114.58 117.81 3h3n h GLU 479 Ca 0.16 0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.38 3h3n h GLU 479 Cb 0.15 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 3h3n h GLU 479 CO -0.02 0.12 -0.09 0.07 -0.73 0.00 0.00 179.01 178.37 3h3n h ARG 480 N -0.61 0.11 -0.44 1.92 0.11 -1.47 -0.40 114.38 113.60 3h3n h ARG 480 Ca -0.02 -0.02 -0.12 0.00 0.10 0.00 0.00 59.98 59.92 3h3n h ARG 480 Cb 0.45 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.50 3h3n h ARG 480 CO 0.04 0.20 -0.18 -0.44 0.10 0.00 0.00 179.97 179.69 3h3n h ASP 481 N 0.10 0.92 -0.39 0.08 5.19 -1.12 -1.74 116.42 119.47 3h3n h ASP 481 Ca 0.02 -0.39 -0.16 0.00 -0.62 0.00 0.00 57.03 55.89 3h3n h ASP 481 Cb 0.22 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.47 3h3n h ASP 481 CO 0.01 1.10 -0.38 0.78 -3.12 0.00 0.00 179.24 177.64 3h3n h ASN 482 N 0.73 1.00 -0.05 6.45 2.35 -0.58 -1.06 115.58 124.42 3h3n h ASN 482 Ca 0.10 -0.46 -0.00 0.00 -0.55 0.00 0.00 56.30 55.39 3h3n h ASN 482 Cb 0.74 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.82 3h3n h ASN 482 CO 0.06 1.26 0.03 -0.07 -1.65 0.00 0.00 177.43 177.05 3h3n h LEU 483 N 0.76 0.06 -0.99 1.61 3.38 -1.05 -1.85 115.31 117.24 3h3n h LEU 483 Ca 0.06 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 3h3n h LEU 483 Cb 0.97 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 3h3n h LEU 483 CO 0.09 0.12 -0.22 0.22 0.09 0.00 0.00 178.44 178.74 3h3n h TYR 484 N -0.01 0.52 -0.67 1.13 3.20 -1.32 -2.63 116.97 117.20 3h3n h TYR 484 Ca 0.02 -0.10 -0.06 0.00 3.14 0.00 0.00 58.73 61.73 3h3n h TYR 484 Cb 0.07 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.18 3h3n h TYR 484 CO -0.05 0.66 0.20 1.49 -1.64 0.00 0.00 178.16 178.81 3h3n h GLU 485 N 0.42 1.04 -0.81 1.82 4.57 -1.00 -0.62 114.58 120.00 3h3n h GLU 485 Ca 0.07 -0.23 -0.02 0.00 -1.18 0.00 0.00 59.36 58.00 3h3n h GLU 485 Cb 0.62 -0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 29.02 3h3n h GLU 485 CO 0.04 0.91 0.44 0.78 -1.18 0.00 0.00 179.01 180.00 3h3n h GLY 486 N 0.97 1.21 0.94 1.92 0.00 -1.09 -1.59 103.07 105.45 3h3n h GLY 486 Ca 0.21 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 3h3n h GLY 486 CO -0.00 0.53 0.16 -0.25 0.00 0.00 0.00 176.54 176.98 3h3n h TRP 487 N 1.13 0.47 -0.74 5.60 2.91 -1.08 0.12 115.95 124.36 3h3n h TRP 487 Ca 0.28 -0.02 0.05 0.00 1.13 0.00 0.00 58.89 60.33 3h3n h TRP 487 Cb 0.04 -0.15 -0.05 0.00 -0.51 0.00 0.00 29.16 28.49 3h3n h TRP 487 CO 0.00 0.41 0.44 0.87 -1.03 0.00 0.00 178.44 179.14 3h3n h LYS 488 N 0.40 0.81 0.00 2.65 1.57 -0.77 0.12 116.57 121.34 3h3n h LYS 488 Ca 0.11 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.75 3h3n h LYS 488 Cb 0.11 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 3h3n h LYS 488 CO -0.01 0.53 -0.46 1.96 -0.57 0.00 0.00 179.45 180.90 3h3n h GLN 489 N 0.83 0.00 -0.21 3.15 4.20 -0.93 -1.66 115.11 120.49 3h3n h GLN 489 Ca 0.32 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.91 3h3n h GLN 489 Cb 0.13 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.91 3h3n h GLN 489 CO -0.15 0.46 -0.31 0.00 -0.67 0.00 0.00 178.83 178.16 3h3n h ALA 490 N 1.54 0.32 -0.65 3.87 0.00 0.07 -1.86 119.26 122.55 3h3n h ALA 490 Ca -0.00 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.42 3h3n h ALA 490 Cb 0.91 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 3h3n h ALA 490 CO 0.06 0.35 0.12 0.28 0.00 0.00 0.00 179.25 180.06 3h3n h VAL 491 N 0.26 1.26 -0.56 0.00 2.07 -0.88 -0.72 116.25 117.69 3h3n h VAL 491 Ca 0.02 -0.99 0.01 0.00 0.82 0.00 0.00 66.70 66.55 3h3n h VAL 491 Cb 0.89 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 3h3n h VAL 491 CO 0.07 0.37 0.37 0.00 0.02 0.00 0.00 177.57 178.40 3h3n h ALA 492 N 1.04 0.71 -0.45 1.67 0.00 -1.25 -0.33 119.26 120.65 3h3n h ALA 492 Ca 0.20 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 3h3n h ALA 492 Cb 0.41 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3h3n h ALA 492 CO 0.01 0.14 -0.06 0.00 0.00 0.00 0.00 179.25 179.34 3h3n h ALA 493 N 1.21 1.06 -0.83 0.00 0.00 -1.08 -2.55 119.26 117.07 3h3n h ALA 493 Ca 0.21 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3h3n h ALA 493 Cb -0.08 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 3h3n h ALA 493 CO -0.05 0.58 0.47 1.15 0.00 0.00 0.00 179.25 181.40 3h3n h THR 494 N 0.71 1.24 0.00 0.00 2.02 -0.35 -2.04 112.91 114.49 3h3n h THR 494 Ca 0.13 -0.57 0.00 0.00 0.77 0.00 0.00 66.41 66.74 3h3n h THR 494 Cb 0.52 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.04 3h3n h THR 494 CO 0.03 0.26 0.00 1.56 0.37 0.00 0.00 175.52 177.74 3h3n h GLN 495 N 1.15 0.00 0.00 6.66 4.20 -0.68 -2.78 115.11 123.65 3h3n h GLN 495 Ca 0.29 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.00 3h3n h GLN 495 Cb 0.00 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.78 3h3n h GLN 495 CO -0.05 0.00 -0.32 1.79 -0.67 0.00 0.00 178.83 179.58 3h3n h THR 496 N 0.00 0.00 -2.51 -0.54 1.35 -1.06 -3.42 112.91 106.73 3h3n h THR 496 Ca 0.00 -1.01 -0.61 0.00 -0.55 0.00 0.00 66.41 64.25 3h3n h THR 496 Cb 0.39 1.84 -0.13 0.00 -1.73 0.00 0.00 68.15 68.53 3h3n h THR 496 CO 0.00 0.00 0.72 0.12 -0.25 0.00 0.00 175.52 176.12 3h3n s PHE 497 N -3.26 2.59 -0.25 4.73 5.36 -1.05 -4.83 117.98 121.28 3h3n s PHE 497 Ca 0.05 -0.48 0.13 0.00 -0.96 0.00 0.00 56.93 55.67 3h3n s PHE 497 Cb 0.06 -4.39 0.47 0.00 -0.34 0.00 0.00 43.02 38.82 3h3n s PHE 497 CO 0.71 -1.76 1.17 1.63 -1.46 0.00 0.00 175.22 175.51 3h3n n LYS 498 N 8.11 2.53 -1.67 10.12 4.76 -1.26 -4.70 118.16 136.04 3h3n n LYS 498 Ca 0.01 -3.70 -0.47 0.00 -2.87 0.00 0.00 58.31 51.28 3h3n n LYS 498 Cb 0.47 -1.82 -0.04 0.00 -1.84 0.00 0.00 35.03 31.79 3h3n n LYS 498 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 3h3n n PHE 499 N -0.64 2.26 -3.90 2.13 7.35 -1.26 -4.98 117.46 118.41 3h3n n PHE 499 Ca 0.27 0.19 -0.30 0.00 -0.76 0.00 0.00 57.45 56.85 3h3n n PHE 499 Cb 0.90 -2.58 -0.16 0.00 0.35 0.00 0.00 39.48 37.99 3h3n n PHE 499 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 3h3n s LYS 500 N 2.09 1.46 0.24 -4.13 1.02 -1.26 -5.11 119.74 114.05 3h3n s LYS 500 Ca 0.84 -0.85 -0.31 0.00 0.02 0.00 0.00 55.97 55.67 3h3n s LYS 500 Cb -0.70 -2.46 -0.13 0.00 -0.52 0.00 0.00 37.83 34.03 3h3n s LYS 500 CO 0.44 -0.59 1.57 0.00 -0.92 0.00 0.00 175.35 175.85 3h3n n ALA 501 N 4.75 2.02 1.01 5.17 0.00 -1.26 -5.36 120.51 126.84 3h3n n ALA 501 Ca -0.12 0.40 0.12 0.00 0.00 0.00 0.00 53.44 53.85 3h3n n ALA 501 Cb 0.45 -2.41 0.11 0.00 0.00 0.00 0.00 19.45 17.60 3h3n n ALA 501 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86