#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oye n VAL 33 N 0.00 0.00 -1.47 -1.45 0.24 -1.26 -4.66 118.33 109.73 2oye n VAL 33 Ca 0.00 0.00 -0.45 0.00 -2.04 0.00 0.00 64.34 61.85 2oye n VAL 33 Cb 0.00 -0.47 -0.08 0.00 -1.47 0.00 0.00 33.84 31.82 2oye n VAL 33 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2oye n ASN 34 N 4.47 1.63 -0.28 -1.34 2.85 -1.26 -4.74 115.26 116.59 2oye n ASN 34 Ca 0.34 0.14 0.34 0.00 -0.11 0.00 0.00 54.58 55.29 2oye n ASN 34 Cb -0.05 -1.23 0.72 0.00 1.24 0.00 0.00 39.78 40.45 2oye n ASN 34 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2oye h PRO 35 N 13.87 0.00 -0.21 1.20 0.13 -1.87 0.44 132.00 145.55 2oye h PRO 35 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 2oye h PRO 35 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2oye h PRO 35 CO 1.15 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.92 2oye h TYR 38 N 0.00 0.00 -4.33 0.00 -1.99 -1.73 -3.34 116.97 105.58 2oye h TYR 38 Ca 0.00 0.00 -0.15 0.00 2.00 0.00 0.00 58.73 60.58 2oye h TYR 38 Cb 0.88 0.00 0.11 0.00 2.00 0.00 0.00 36.73 39.72 2oye h TYR 38 CO 0.00 0.04 -0.47 0.66 -0.00 0.00 0.00 178.16 178.39 2oye n TYR 39 N -2.76 -1.36 0.14 4.88 4.01 -1.23 -4.95 117.16 115.89 2oye n TYR 39 Ca -0.00 0.49 -0.01 0.00 -0.16 0.00 0.00 57.90 58.22 2oye n TYR 39 Cb 0.57 -3.46 0.23 0.00 -0.31 0.00 0.00 39.34 36.36 2oye n TYR 39 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2oye h PRO 40 N -0.68 0.07 -6.50 -0.72 0.13 -1.87 -3.44 132.00 119.00 2oye h PRO 40 Ca -0.34 -0.04 -0.53 0.00 -0.87 0.00 0.00 66.00 64.22 2oye h PRO 40 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 2oye h PRO 40 CO 0.25 0.57 0.38 0.00 -0.23 0.00 0.00 178.00 178.97 2oye s GLN 42 N 0.48 2.56 -0.73 0.00 -1.52 0.28 -4.63 119.66 116.11 2oye s GLN 42 Ca 0.50 -1.48 0.00 0.00 -1.95 0.00 0.00 55.36 52.43 2oye s GLN 42 Cb -0.23 -2.37 0.00 0.00 -0.22 0.00 0.00 33.01 30.19 2oye s GLN 42 CO 0.29 -0.08 0.00 0.72 -0.25 0.00 0.00 175.29 175.97 2oye n HIS 43 N -1.45 -1.56 -0.93 0.91 8.25 -1.26 -0.81 115.22 118.37 2oye n HIS 43 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 2oye n HIS 43 Cb 0.61 -2.20 0.00 0.00 1.12 0.00 0.00 29.99 29.52 2oye n HIS 43 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2oye n GLN 44 N -2.66 0.00 -2.67 -0.41 6.02 -1.26 -4.81 117.38 111.58 2oye n GLN 44 Ca -0.10 0.25 -0.39 0.00 -0.01 0.00 0.00 57.00 56.75 2oye n GLN 44 Cb 0.56 -2.75 -0.05 0.00 1.02 0.00 0.00 30.24 29.02 2oye n GLN 44 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2oye s GLY 45 N -2.71 3.01 -0.23 1.08 0.00 0.01 -4.95 107.32 103.52 2oye s GLY 45 Ca 0.00 0.68 -0.23 0.00 0.00 0.00 0.00 44.72 45.17 2oye s GLY 45 CO 0.00 1.22 0.73 -0.42 0.00 0.00 0.00 173.10 174.63 2oye s ILE 46 N -1.31 4.92 0.08 0.90 1.09 -0.90 -4.61 121.20 121.37 2oye s ILE 46 Ca 0.45 1.37 -0.29 0.00 -1.10 0.00 0.00 60.65 61.08 2oye s ILE 46 Cb -0.26 -4.03 -0.05 0.00 -1.06 0.00 0.00 42.46 37.06 2oye s ILE 46 CO 0.32 -0.00 0.94 0.00 -0.10 0.00 0.00 174.94 176.10 2oye s VAL 48 N 0.19 -0.37 0.30 0.00 1.01 -0.73 -4.98 120.40 115.82 2oye s VAL 48 Ca 0.47 0.27 -0.29 0.00 0.00 0.00 0.00 61.98 62.43 2oye s VAL 48 Cb -0.22 -0.42 -0.10 0.00 0.00 0.00 0.00 36.38 35.63 2oye s VAL 48 CO 0.29 0.10 1.26 -0.13 0.00 0.00 0.00 175.10 176.62 2oye s ARG 49 N 2.38 4.42 -0.02 2.72 0.52 -1.26 -1.44 118.95 126.26 2oye s ARG 49 Ca 0.02 2.11 0.03 0.00 -0.52 0.00 0.00 55.73 57.37 2oye s ARG 49 Cb -0.12 -3.11 -0.00 0.00 0.52 0.00 0.00 34.95 32.23 2oye s ARG 49 CO -0.08 -0.11 -0.12 -0.06 0.02 0.00 0.00 175.30 174.95 2oye s PHE 50 N -0.97 1.16 0.00 -0.53 0.08 -0.72 -4.90 117.98 112.09 2oye s PHE 50 Ca 0.49 -0.28 0.00 0.00 0.12 0.00 0.00 56.93 57.26 2oye s PHE 50 Cb -0.38 -0.79 0.00 0.00 -0.57 0.00 0.00 43.02 41.28 2oye s PHE 50 CO 0.48 -0.09 0.00 0.41 -0.10 0.00 0.00 175.22 175.93 2oye n GLY 51 N 3.10 1.66 0.08 4.36 0.00 -1.26 -2.22 105.19 110.89 2oye n GLY 51 Ca -0.17 -0.65 -0.11 0.00 0.00 0.00 0.00 46.02 45.09 2oye n GLY 51 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oye n LEU 52 N 0.00 2.88 -0.01 0.99 4.77 -1.26 -4.77 117.00 119.59 2oye n LEU 52 Ca 0.00 -0.08 0.01 0.00 -0.03 0.00 0.00 56.01 55.91 2oye n LEU 52 Cb 0.00 -0.52 0.01 0.00 -2.33 0.00 0.00 43.42 40.58 2oye n LEU 52 CO 0.00 0.75 0.47 -0.90 -1.33 0.00 0.00 177.39 176.38 2oye n ASP 53 N -2.94 1.76 -4.92 -1.43 3.85 -1.26 -4.95 116.55 106.65 2oye n ASP 53 Ca -0.28 -1.96 -0.23 0.00 -0.71 0.00 0.00 54.79 51.61 2oye n ASP 53 Cb 0.80 -0.04 -0.00 0.00 -1.35 0.00 0.00 41.12 40.53 2oye n ASP 53 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 2oye s ARG 54 N -1.01 2.37 0.17 0.11 0.52 -0.94 -4.82 118.95 115.34 2oye s ARG 54 Ca 0.03 -1.77 -0.24 0.00 -0.52 0.00 0.00 55.73 53.23 2oye s ARG 54 Cb 0.02 -2.30 0.06 0.00 0.52 0.00 0.00 34.95 33.25 2oye s ARG 54 CO 0.00 -0.51 0.74 1.52 0.02 0.00 0.00 175.30 177.08 2oye s TYR 55 N -2.64 -0.34 -0.03 -0.53 -0.85 -1.26 -1.76 117.35 109.94 2oye s TYR 55 Ca 0.44 0.05 -0.09 0.00 -0.52 0.00 0.00 57.07 56.95 2oye s TYR 55 Cb -0.03 0.61 0.01 0.00 0.38 0.00 0.00 41.96 42.93 2oye s TYR 55 CO 0.27 -0.91 0.21 -0.65 -1.52 0.00 0.00 175.55 172.95 2oye s GLN 56 N -3.62 0.47 -0.12 -3.49 -0.21 -0.52 -4.87 119.66 107.29 2oye s GLN 56 Ca 0.06 -0.14 -0.06 0.00 0.02 0.00 0.00 55.36 55.25 2oye s GLN 56 Cb -0.03 0.20 -0.04 0.00 1.00 0.00 0.00 33.01 34.15 2oye s GLN 56 CO -0.04 -0.11 0.09 0.00 -2.12 0.00 0.00 175.29 173.11 2oye s ASP 58 N -0.72 6.46 -0.11 0.00 2.15 -0.30 -4.85 116.67 119.30 2oye s ASP 58 Ca 0.12 -2.14 0.09 0.00 0.43 0.00 0.00 52.55 51.05 2oye s ASP 58 Cb -0.12 -2.24 0.44 0.00 -0.30 0.00 0.00 42.92 40.71 2oye s ASP 58 CO 0.03 -0.79 1.21 0.00 -0.17 0.00 0.00 175.17 175.45 2oye n THR 60 N 0.41 1.46 -3.24 0.00 -1.04 -1.26 -1.69 114.28 108.92 2oye n THR 60 Ca 0.15 -0.37 -0.16 0.00 -2.04 0.00 0.00 64.05 61.64 2oye n THR 60 Cb 0.71 -1.13 -0.03 0.00 -1.82 0.00 0.00 70.33 68.06 2oye n THR 60 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2oye n ARG 61 N 1.28 -2.22 0.00 -2.82 1.74 -1.26 -4.74 116.66 108.64 2oye n ARG 61 Ca 0.11 0.08 0.10 0.00 -0.77 0.00 0.00 57.85 57.37 2oye n ARG 61 Cb 0.30 -4.62 -0.04 0.00 -1.02 0.00 0.00 32.46 27.08 2oye n ARG 61 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2oye n THR 62 N -3.11 0.00 -1.00 0.55 -2.24 -0.68 -4.93 114.28 102.87 2oye n THR 62 Ca 0.04 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 2oye n THR 62 Cb 0.49 0.87 0.00 0.00 -2.10 0.00 0.00 70.33 69.59 2oye n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oye n GLY 63 N 1.49 0.52 3.15 3.38 0.00 -1.26 -4.98 105.19 107.49 2oye n GLY 63 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 2oye n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2oye s TYR 64 N -2.08 0.80 0.34 1.61 1.51 -1.26 -1.69 117.35 116.58 2oye s TYR 64 Ca 0.00 -0.94 0.05 0.00 -1.01 0.00 0.00 57.07 55.17 2oye s TYR 64 Cb 0.00 -0.48 -0.03 0.00 -0.11 0.00 0.00 41.96 41.34 2oye s TYR 64 CO 0.00 -0.20 0.21 -1.54 -1.11 0.00 0.00 175.55 172.91 2oye s SER 65 N -2.99 1.91 0.00 2.29 1.04 -0.11 -4.79 113.70 111.05 2oye s SER 65 Ca 0.10 -1.69 0.00 0.00 0.48 0.00 0.00 55.95 54.85 2oye s SER 65 Cb 0.06 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.69 2oye s SER 65 CO -0.06 -0.99 0.00 0.61 0.98 0.00 0.00 173.24 173.78 2oye n GLY 66 N -0.69 0.88 0.33 7.32 0.00 -1.26 -2.18 105.19 109.60 2oye n GLY 66 Ca 0.02 -2.10 -0.02 0.00 0.00 0.00 0.00 46.02 43.92 2oye n GLY 66 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2oye h PRO 67 N 0.00 -0.09 -0.04 1.61 0.11 -2.00 -3.12 132.00 128.47 2oye h PRO 67 Ca 0.00 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.12 2oye h PRO 67 Cb 0.00 0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.13 2oye h PRO 67 CO 0.00 -0.06 0.00 0.09 -0.21 0.00 0.00 178.00 177.82 2oye n ASN 68 N -5.46 2.30 -2.44 -2.05 3.02 -1.26 -3.87 115.26 105.49 2oye n ASN 68 Ca 0.07 -2.43 -0.05 0.00 -0.03 0.00 0.00 54.58 52.13 2oye n ASN 68 Cb 0.37 -0.20 0.02 0.00 -0.61 0.00 0.00 39.78 39.37 2oye n ASN 68 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2oye n THR 70 N -2.09 0.00 -3.19 0.00 -2.24 -1.18 -4.42 114.28 101.16 2oye n THR 70 Ca -0.02 -0.28 -0.45 0.00 -2.27 0.00 0.00 64.05 61.02 2oye n THR 70 Cb 0.54 1.09 -0.04 0.00 -2.10 0.00 0.00 70.33 69.83 2oye n THR 70 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2oye s ILE 71 N -0.44 5.11 0.32 2.28 1.01 -0.93 -4.94 121.20 123.60 2oye s ILE 71 Ca 0.00 -1.58 -0.29 0.00 0.00 0.00 0.00 60.65 58.77 2oye s ILE 71 Cb 0.00 -4.49 -0.12 0.00 0.01 0.00 0.00 42.46 37.86 2oye s ILE 71 CO 0.00 -1.10 1.46 -0.81 0.00 0.00 0.00 174.94 174.49 2oye n PRO 72 N 5.49 2.44 -1.08 2.79 -0.04 -1.26 -0.94 135.00 142.40 2oye n PRO 72 Ca 0.00 0.86 -0.30 0.00 -0.04 0.00 0.00 63.50 64.03 2oye n PRO 72 Cb 0.44 -2.56 0.24 0.00 -0.04 0.00 0.00 33.50 31.58 2oye n PRO 72 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2oye s GLU 73 N -1.21 -1.15 0.11 0.54 1.03 -0.68 -4.72 118.70 112.62 2oye s GLU 73 Ca 0.60 -0.04 -0.28 0.00 0.03 0.00 0.00 54.97 55.28 2oye s GLU 73 Cb -0.54 -1.60 -0.10 0.00 -0.80 0.00 0.00 34.13 31.09 2oye s GLU 73 CO 0.56 -3.67 1.63 0.97 -1.33 0.00 0.00 175.26 173.42 2oye h ILE 74 N -2.55 0.39 -0.38 1.83 -0.00 -1.95 -2.38 117.51 112.47 2oye h ILE 74 Ca -0.45 0.00 -0.10 0.00 -0.00 0.00 0.00 64.86 64.31 2oye h ILE 74 Cb 1.30 0.39 -0.02 0.00 -0.00 0.00 0.00 36.82 38.49 2oye h ILE 74 CO 0.35 0.00 -0.17 -0.50 -0.00 0.00 0.00 178.15 177.83 2oye h TRP 75 N -0.55 0.79 -0.34 2.19 4.06 -1.95 -2.66 115.95 117.49 2oye h TRP 75 Ca 0.01 -0.16 0.03 0.00 2.06 0.00 0.00 58.89 60.83 2oye h TRP 75 Cb 0.54 -0.20 -0.03 0.00 -1.00 0.00 0.00 29.16 28.47 2oye h TRP 75 CO -0.23 0.83 0.17 1.15 -3.56 0.00 0.00 178.44 176.80 2oye h THR 76 N 0.63 0.98 -0.41 1.49 2.02 -1.82 1.91 112.91 117.71 2oye h THR 76 Ca 0.10 -0.12 0.08 0.00 0.77 0.00 0.00 66.41 67.24 2oye h THR 76 Cb 0.64 0.60 -0.07 0.00 -1.74 0.00 0.00 68.15 67.59 2oye h THR 76 CO 0.05 0.06 -0.01 -0.25 0.37 0.00 0.00 175.52 175.74 2oye h TRP 77 N 0.34 -0.04 0.44 3.16 7.01 -1.21 1.37 115.95 127.03 2oye h TRP 77 Ca 0.15 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.15 2oye h TRP 77 Cb 0.06 0.08 0.00 0.00 -2.10 0.00 0.00 29.16 27.21 2oye h TRP 77 CO -0.10 -0.09 -0.21 -0.07 -2.79 0.00 0.00 178.44 175.18 2oye h LEU 78 N 0.10 -0.50 -1.19 0.65 3.38 -0.89 -0.71 115.31 116.15 2oye h LEU 78 Ca 0.20 -0.06 0.25 0.00 0.09 0.00 0.00 57.88 58.37 2oye h LEU 78 Cb 0.29 0.13 -0.11 0.00 0.09 0.00 0.00 40.66 41.07 2oye h LEU 78 CO -0.35 -0.24 0.64 0.03 0.09 0.00 0.00 178.44 178.61 2oye h ARG 79 N -0.75 0.48 -0.18 1.13 3.08 0.37 0.41 114.38 118.93 2oye h ARG 79 Ca -0.06 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 59.87 2oye h ARG 79 Cb 0.53 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 2oye h ARG 79 CO 0.10 0.32 -0.24 1.15 -1.07 0.00 0.00 179.97 180.23 2oye h THR 80 N 0.50 1.34 -0.07 2.04 2.02 0.22 -2.81 112.91 116.15 2oye h THR 80 Ca 0.61 -1.45 -0.23 0.00 0.77 0.00 0.00 66.41 66.11 2oye h THR 80 Cb 1.35 1.87 0.01 0.00 -1.74 0.00 0.00 68.15 69.64 2oye h THR 80 CO -0.37 0.44 -0.89 0.71 0.37 0.00 0.00 175.52 175.77 2oye h THR 81 N 0.12 1.31 -0.23 3.16 1.35 0.45 -3.18 112.91 115.88 2oye h THR 81 Ca 0.02 -2.16 0.00 0.00 -0.55 0.00 0.00 66.41 63.72 2oye h THR 81 Cb 0.81 2.20 0.00 0.00 -1.73 0.00 0.00 68.15 69.43 2oye h THR 81 CO 0.06 0.67 0.00 0.18 -0.25 0.00 0.00 175.52 176.18 2oye n LEU 82 N -3.86 2.75 -4.41 3.87 4.77 0.13 -4.81 117.00 115.43 2oye n LEU 82 Ca -0.08 -1.39 -0.36 0.00 -0.03 0.00 0.00 56.01 54.15 2oye n LEU 82 Cb 0.80 -0.54 -0.13 0.00 -2.33 0.00 0.00 43.42 41.22 2oye n LEU 82 CO 0.53 0.40 -0.31 -0.13 -1.33 0.00 0.00 177.39 176.55 2oye s ARG 83 N -1.68 3.58 0.71 3.23 1.81 -1.06 -4.99 118.95 120.55 2oye s ARG 83 Ca 0.21 -0.52 -0.11 0.00 -1.72 0.00 0.00 55.73 53.59 2oye s ARG 83 Cb 0.16 -3.23 0.02 0.00 -0.45 0.00 0.00 34.95 31.44 2oye s ARG 83 CO 0.07 -0.18 1.07 -1.25 -0.68 0.00 0.00 175.30 174.32 2oye s PRO 84 N 1.55 2.83 0.63 3.54 0.04 -1.26 -4.99 135.00 137.34 2oye s PRO 84 Ca 0.06 0.76 -0.16 0.00 0.04 0.00 0.00 61.00 61.70 2oye s PRO 84 Cb -0.15 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.38 2oye s PRO 84 CO 0.02 -1.13 1.10 -1.54 0.04 0.00 0.00 177.00 175.49 2oye s SER 85 N -3.98 5.35 0.19 6.66 1.04 -1.26 -4.93 113.70 116.77 2oye s SER 85 Ca 0.58 1.97 -0.12 0.00 0.48 0.00 0.00 55.95 58.86 2oye s SER 85 Cb -0.13 -2.55 0.12 0.00 0.10 0.00 0.00 66.02 63.56 2oye s SER 85 CO 0.54 -1.46 1.85 -0.65 0.98 0.00 0.00 173.24 174.50 2oye h PRO 86 N 0.26 0.80 -0.50 4.02 0.11 -1.96 -2.20 132.00 132.53 2oye h PRO 86 Ca -0.47 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 65.62 2oye h PRO 86 Cb 1.24 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.14 2oye h PRO 86 CO 0.55 0.53 0.33 0.66 -0.21 0.00 0.00 178.00 179.87 2oye h SER 87 N 0.83 0.49 0.42 -2.05 4.64 -1.99 -0.83 113.55 115.07 2oye h SER 87 Ca 0.23 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.53 2oye h SER 87 Cb -0.07 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 61.91 2oye h SER 87 CO -0.06 0.34 -0.20 0.15 -0.87 0.00 0.00 176.83 176.19 2oye h PHE 88 N 0.57 -0.53 -0.58 4.77 -0.00 -1.78 -2.47 116.94 116.93 2oye h PHE 88 Ca 0.20 -0.01 0.12 0.00 -0.00 0.00 0.00 57.97 58.28 2oye h PHE 88 Cb 0.09 0.17 -0.09 0.00 -0.00 0.00 0.00 35.95 36.13 2oye h PHE 88 CO -0.00 -0.21 0.04 0.82 -0.00 0.00 0.00 178.31 178.95 2oye h ILE 89 N -0.84 0.56 -0.99 1.41 1.08 -1.14 0.18 117.51 117.78 2oye h ILE 89 Ca -0.06 -0.05 0.18 0.00 -0.39 0.00 0.00 64.86 64.54 2oye h ILE 89 Cb 0.55 0.39 -0.10 0.00 -3.07 0.00 0.00 36.82 34.59 2oye h ILE 89 CO 0.10 0.03 0.60 -0.74 -0.69 0.00 0.00 178.15 177.44 2oye h HIS 90 N 0.16 1.05 -0.58 1.37 2.76 -1.09 0.76 115.15 119.58 2oye h HIS 90 Ca 0.30 0.03 -0.10 0.00 -2.20 0.00 0.00 60.37 58.41 2oye h HIS 90 Cb 0.47 -0.32 -0.02 0.00 1.55 0.00 0.00 27.41 29.10 2oye h HIS 90 CO -0.32 0.24 -0.03 0.35 -1.30 0.00 0.00 177.93 176.88 2oye h PHE 91 N 0.76 1.13 -0.63 5.26 3.57 -0.18 -1.33 116.94 125.52 2oye h PHE 91 Ca 0.57 -0.20 -0.07 0.00 3.53 0.00 0.00 57.97 61.79 2oye h PHE 91 Cb 0.86 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.28 2oye h PHE 91 CO -0.01 1.01 0.11 -0.07 -2.23 0.00 0.00 178.31 177.11 2oye h LEU 92 N 0.94 1.00 -1.18 0.59 4.07 -0.13 -2.82 115.31 117.78 2oye h LEU 92 Ca 0.16 -0.26 0.00 0.00 0.08 0.00 0.00 57.88 57.87 2oye h LEU 92 Cb 0.58 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 42.05 2oye h LEU 92 CO 0.03 1.00 0.00 -0.07 -1.08 0.00 0.00 178.44 178.32 2oye h LEU 93 N 0.95 0.00 -3.26 1.67 3.38 -0.80 -3.17 115.31 114.08 2oye h LEU 93 Ca 0.19 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 2oye h LEU 93 Cb 0.42 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2oye h LEU 93 CO 0.01 0.00 -0.00 0.35 0.09 0.00 0.00 178.44 178.89 2oye n THR 94 N -3.08 2.30 0.00 0.22 -2.24 -0.52 -1.63 114.28 109.33 2oye n THR 94 Ca 0.01 -1.99 0.00 0.00 -2.27 0.00 0.00 64.05 59.80 2oye n THR 94 Cb 0.35 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.31 2oye n THR 94 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2oye n HIS 95 N -0.64 0.00 -0.02 4.78 8.25 -1.09 -4.95 115.22 121.56 2oye n HIS 95 Ca 0.23 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.68 2oye n HIS 95 Cb 0.90 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 32.01 2oye n HIS 95 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2oye n GLY 96 N 1.98 1.02 0.08 -1.41 0.00 -1.24 -4.69 105.19 100.93 2oye n GLY 96 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2oye n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oye n ARG 97 N 2.97 -0.04 -0.07 1.61 5.12 -1.26 -0.34 116.66 124.65 2oye n ARG 97 Ca 0.01 0.31 -0.08 0.00 -1.93 0.00 0.00 57.85 56.16 2oye n ARG 97 Cb 0.02 -0.47 -0.06 0.00 -1.16 0.00 0.00 32.46 30.79 2oye n ARG 97 CO 0.00 0.00 0.00 -1.49 -1.93 0.00 0.00 177.63 174.21 2oye h TRP 98 N 0.00 0.00 -1.46 -1.55 6.55 -2.02 -3.32 115.95 114.16 2oye h TRP 98 Ca 0.08 0.00 0.42 0.00 0.95 0.00 0.00 58.89 60.34 2oye h TRP 98 Cb 0.13 0.00 -0.06 0.00 -0.86 0.00 0.00 29.16 28.36 2oye h TRP 98 CO -0.17 0.50 1.04 1.25 -1.05 0.00 0.00 178.44 180.01 2oye h LEU 99 N -1.00 0.03 0.00 -4.49 5.85 -1.17 -0.66 115.31 113.88 2oye h LEU 99 Ca -0.04 0.01 -0.22 0.00 0.84 0.00 0.00 57.88 58.47 2oye h LEU 99 Cb 0.55 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 2oye h LEU 99 CO -0.02 -0.01 -1.23 -0.50 -0.34 0.00 0.00 178.44 176.34 2oye h TRP 100 N 0.02 0.00 -0.03 1.25 4.06 -0.83 -2.30 115.95 118.12 2oye h TRP 100 Ca 0.71 0.00 -0.10 0.00 2.06 0.00 0.00 58.89 61.56 2oye h TRP 100 Cb 2.77 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 30.92 2oye h TRP 100 CO -0.00 0.87 -0.43 -0.44 -3.56 0.00 0.00 178.44 174.88 2oye h ASP 101 N 0.00 0.08 0.41 -3.49 3.45 -1.21 0.45 116.42 116.10 2oye h ASP 101 Ca -0.12 -0.03 -0.02 0.00 0.43 0.00 0.00 57.03 57.28 2oye h ASP 101 Cb 1.77 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 40.52 2oye h ASP 101 CO 0.09 0.50 -0.20 0.15 -1.57 0.00 0.00 179.24 178.21 2oye h PHE 102 N 0.06 -0.51 -0.68 4.55 -0.00 -1.54 -2.12 116.94 116.71 2oye h PHE 102 Ca 0.00 -0.01 0.10 0.00 -0.00 0.00 0.00 57.97 58.06 2oye h PHE 102 Cb 0.78 0.17 -0.08 0.00 -0.00 0.00 0.00 35.95 36.82 2oye h PHE 102 CO 0.00 -0.31 0.30 0.28 -0.00 0.00 0.00 178.31 178.58 2oye h VAL 103 N -1.01 0.78 -0.72 1.41 2.07 -1.32 0.79 116.25 118.24 2oye h VAL 103 Ca -0.06 -0.17 0.04 0.00 0.82 0.00 0.00 66.70 67.33 2oye h VAL 103 Cb 0.42 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.39 2oye h VAL 103 CO 0.09 0.09 0.48 0.78 0.02 0.00 0.00 177.57 179.03 2oye h ASN 104 N 0.50 0.75 0.61 0.57 2.35 -0.19 -0.58 115.58 119.60 2oye h ASN 104 Ca 0.35 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.09 2oye h ASN 104 Cb 0.42 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.62 2oye h ASN 104 CO -0.31 0.51 -0.01 0.00 -1.65 0.00 0.00 177.43 175.98 2oye n ALA 105 N -2.43 2.49 -3.93 -0.83 0.00 0.12 -4.80 120.51 111.13 2oye n ALA 105 Ca 0.09 -0.14 -0.13 0.00 0.00 0.00 0.00 53.44 53.26 2oye n ALA 105 Cb 0.13 -1.48 -0.01 0.00 0.00 0.00 0.00 19.45 18.09 2oye n ALA 105 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2oye n THR 106 N -1.30 0.00 0.21 0.00 -2.24 -0.24 -5.02 114.28 105.70 2oye n THR 106 Ca 0.13 -0.95 0.10 0.00 -2.27 0.00 0.00 64.05 61.07 2oye n THR 106 Cb 0.25 -0.10 0.32 0.00 -2.10 0.00 0.00 70.33 68.71 2oye n THR 106 CO 0.00 0.00 0.00 2.19 -0.57 0.00 0.00 175.07 176.69 2oye h PHE 107 N 0.79 0.00 -0.87 4.78 -5.15 -1.90 -3.10 116.94 111.50 2oye h PHE 107 Ca -0.16 0.00 0.24 0.00 -0.20 0.00 0.00 57.97 57.85 2oye h PHE 107 Cb 0.53 0.00 -0.05 0.00 0.22 0.00 0.00 35.95 36.66 2oye h PHE 107 CO 0.00 0.18 0.61 0.82 -2.00 0.00 0.00 178.31 177.92 2oye h ILE 108 N 0.00 0.60 -0.49 0.88 2.04 -1.95 0.24 117.51 118.83 2oye h ILE 108 Ca -0.00 -0.04 0.09 0.00 1.00 0.00 0.00 64.86 65.91 2oye h ILE 108 Cb 0.92 0.47 -0.08 0.00 -0.74 0.00 0.00 36.82 37.39 2oye h ILE 108 CO 0.02 0.02 0.02 -0.09 0.00 0.00 0.00 178.15 178.12 2oye h ARG 109 N 0.12 0.13 -0.14 2.37 2.43 -1.44 0.93 114.38 118.78 2oye h ARG 109 Ca 0.43 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.57 2oye h ARG 109 Cb 1.50 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 31.02 2oye h ARG 109 CO -0.06 0.09 -0.01 -0.44 -1.51 0.00 0.00 179.97 178.04 2oye h ASP 110 N 0.13 0.25 -0.67 -3.80 3.32 -0.76 -1.14 116.42 113.75 2oye h ASP 110 Ca 0.25 -0.32 0.10 0.00 0.02 0.00 0.00 57.03 57.08 2oye h ASP 110 Cb 0.37 -0.07 -0.07 0.00 0.22 0.00 0.00 39.33 39.78 2oye h ASP 110 CO -0.40 0.51 0.29 0.74 -1.72 0.00 0.00 179.24 178.66 2oye h THR 111 N -0.02 0.78 -0.08 0.35 2.02 -0.97 0.29 112.91 115.29 2oye h THR 111 Ca 0.04 -0.17 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 2oye h THR 111 Cb 0.38 0.25 -0.00 0.00 -1.74 0.00 0.00 68.15 67.05 2oye h THR 111 CO 0.01 0.09 -0.02 -0.07 0.37 0.00 0.00 175.52 175.90 2oye h LEU 112 N 0.49 0.16 0.26 2.58 3.38 -0.74 -0.97 115.31 120.46 2oye h LEU 112 Ca 0.34 -0.37 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2oye h LEU 112 Cb 0.41 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2oye h LEU 112 CO -0.31 0.49 -0.31 -0.03 0.09 0.00 0.00 178.44 178.37 2oye h MET 113 N -0.18 -0.56 -1.29 1.13 4.05 -0.53 1.57 114.93 119.12 2oye h MET 113 Ca 0.02 0.04 0.37 0.00 -0.28 0.00 0.00 59.70 59.85 2oye h MET 113 Cb 0.42 0.13 -0.06 0.00 -0.80 0.00 0.00 31.60 31.29 2oye h MET 113 CO 0.01 -0.37 0.92 -0.09 0.23 0.00 0.00 176.91 177.60 2oye h ARG 114 N -0.58 0.04 0.09 0.39 2.43 -0.47 0.78 114.38 117.06 2oye h ARG 114 Ca -0.03 -0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.02 2oye h ARG 114 Cb 0.51 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.07 2oye h ARG 114 CO -0.06 0.02 -0.52 1.25 -1.51 0.00 0.00 179.97 179.15 2oye h LEU 115 N 0.04 0.30 -0.73 3.80 5.85 0.02 -3.20 115.31 121.39 2oye h LEU 115 Ca 0.63 -0.97 0.15 0.00 0.84 0.00 0.00 57.88 58.53 2oye h LEU 115 Cb 2.42 -0.10 -0.11 0.00 0.37 0.00 0.00 40.66 43.25 2oye h LEU 115 CO -0.05 1.25 0.20 0.58 -0.34 0.00 0.00 178.44 180.09 2oye h VAL 116 N -0.60 0.55 0.00 1.05 2.07 0.85 -3.00 116.25 117.17 2oye h VAL 116 Ca -0.09 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2oye h VAL 116 Cb 1.41 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 2oye h VAL 116 CO 0.10 0.06 0.00 0.18 0.02 0.00 0.00 177.57 177.92 2oye n LEU 117 N -5.12 0.00 0.00 2.57 4.77 0.82 -3.20 117.00 116.83 2oye n LEU 117 Ca 0.14 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 2oye n LEU 117 Cb 0.45 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 2oye n LEU 117 CO 0.14 0.00 0.00 0.35 -1.33 0.00 0.00 177.39 176.55 2oye n THR 118 N 0.00 0.00 0.00 -5.08 -2.24 -1.21 0.12 114.28 105.88 2oye n THR 118 Ca 0.00 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.67 2oye n THR 118 Cb 0.00 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.18 2oye n THR 118 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2oye h VAL 119 N 0.00 0.97 0.01 2.28 2.07 -1.69 -1.09 116.25 118.80 2oye h VAL 119 Ca 0.00 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2oye h VAL 119 Cb 0.00 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 30.67 2oye h VAL 119 CO 0.00 0.01 -0.02 0.03 0.02 0.00 0.00 177.57 177.61 2oye h ARG 120 N 0.06 -0.03 -0.38 1.57 -0.00 0.10 -2.96 114.38 112.75 2oye h ARG 120 Ca 0.04 0.00 0.11 0.00 -0.50 0.00 0.00 59.98 59.63 2oye h ARG 120 Cb 0.03 0.01 -0.02 0.00 0.00 0.00 0.00 29.97 29.99 2oye h ARG 120 CO -0.04 -0.02 0.50 0.77 0.00 0.00 0.00 179.97 181.18 2oye h SER 121 N -0.03 0.00 0.66 7.04 0.02 -1.56 -0.26 113.55 119.42 2oye h SER 121 Ca -0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2oye h SER 121 Cb 0.03 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.56 2oye h SER 121 CO -0.01 0.00 -0.05 -1.13 -1.14 0.00 0.00 176.83 174.50 2oye h ASN 122 N 0.00 0.00 0.81 3.07 -1.24 -1.01 -2.97 115.58 114.24 2oye h ASN 122 Ca 0.18 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.19 2oye h ASN 122 Cb 1.18 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.23 2oye h ASN 122 CO -0.00 0.05 0.00 0.18 -1.29 0.00 0.00 177.43 176.37 2oye n LEU 123 N -3.24 0.00 -4.58 0.34 4.77 -0.11 -4.74 117.00 109.45 2oye n LEU 123 Ca -0.01 0.48 -0.34 0.00 -0.03 0.00 0.00 56.01 56.11 2oye n LEU 123 Cb 0.26 -0.48 -0.11 0.00 -2.33 0.00 0.00 43.42 40.76 2oye n LEU 123 CO 0.27 -0.07 -0.31 -0.63 -1.33 0.00 0.00 177.39 175.32 2oye s ILE 124 N -2.95 4.28 0.49 -0.08 -1.09 -1.12 -5.05 121.20 115.67 2oye s ILE 124 Ca 0.13 -0.23 -0.22 0.00 -2.23 0.00 0.00 60.65 58.11 2oye s ILE 124 Cb 0.16 -2.88 -0.07 0.00 -1.58 0.00 0.00 42.46 38.10 2oye s ILE 124 CO 0.44 0.50 1.20 -2.16 -1.23 0.00 0.00 174.94 173.69 2oye s PRO 125 N 0.12 3.56 -0.30 2.79 0.04 -1.26 -5.04 135.00 134.91 2oye s PRO 125 Ca 0.02 1.84 -0.11 0.00 0.04 0.00 0.00 61.00 62.78 2oye s PRO 125 Cb -0.13 -2.31 0.15 0.00 0.04 0.00 0.00 34.50 32.25 2oye s PRO 125 CO 0.02 -0.74 0.78 0.45 0.04 0.00 0.00 177.00 177.55 2oye s SER 126 N -1.35 -0.94 0.97 6.66 0.15 -1.26 -4.12 113.70 113.81 2oye s SER 126 Ca 0.67 1.22 -0.14 0.00 0.70 0.00 0.00 55.95 58.40 2oye s SER 126 Cb -0.30 2.04 0.01 0.00 -1.71 0.00 0.00 66.02 66.06 2oye s SER 126 CO 0.36 -0.18 0.19 -0.81 1.20 0.00 0.00 173.24 174.00 2oye n PRO 127 N 5.28 -0.34 -0.54 5.44 -0.04 -1.26 -5.00 135.00 138.54 2oye n PRO 127 Ca -0.10 -0.07 -0.30 0.00 -0.04 0.00 0.00 63.50 63.00 2oye n PRO 127 Cb 0.51 -1.72 0.23 0.00 -0.04 0.00 0.00 33.50 32.48 2oye n PRO 127 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2oye n PRO 128 N -1.10 -2.23 0.01 0.54 -0.04 -1.26 -5.05 135.00 125.86 2oye n PRO 128 Ca 0.05 -0.63 -0.00 0.00 -0.04 0.00 0.00 63.50 62.88 2oye n PRO 128 Cb 0.55 -1.98 -0.00 0.00 -0.04 0.00 0.00 33.50 32.03 2oye n PRO 128 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2oye n THR 129 N -4.81 0.24 -4.38 0.52 -2.24 -1.26 -4.88 114.28 97.47 2oye n THR 129 Ca 0.02 0.11 -0.27 0.00 -2.27 0.00 0.00 64.05 61.64 2oye n THR 129 Cb 0.57 -1.17 -0.08 0.00 -2.10 0.00 0.00 70.33 67.55 2oye n THR 129 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2oye s TYR 130 N -1.21 2.41 0.16 4.78 4.12 -1.24 -4.45 117.35 121.92 2oye s TYR 130 Ca -0.01 -0.68 0.01 0.00 0.02 0.00 0.00 57.07 56.41 2oye s TYR 130 Cb 0.00 -1.85 -0.00 0.00 -1.52 0.00 0.00 41.96 38.59 2oye s TYR 130 CO 0.01 0.25 0.19 0.27 0.02 0.00 0.00 175.55 176.29 2oye n ASN 131 N -1.18 -0.53 0.10 2.29 0.23 -1.06 -1.05 115.26 114.07 2oye n ASN 131 Ca -0.05 -1.95 0.10 0.00 -0.53 0.00 0.00 54.58 52.16 2oye n ASN 131 Cb 0.66 1.05 0.44 0.00 -2.08 0.00 0.00 39.78 39.85 2oye n ASN 131 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2oye n ILE 132 N -0.28 0.91 -0.05 1.53 0.13 -1.26 -3.31 119.36 117.03 2oye n ILE 132 Ca 0.02 0.28 -0.22 0.00 -1.10 0.00 0.00 62.75 61.72 2oye n ILE 132 Cb 0.28 -1.17 -0.13 0.00 -0.84 0.00 0.00 39.64 37.78 2oye n ILE 132 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2oye n ALA 133 N -1.70 0.96 -2.79 1.51 0.00 -1.26 -4.96 120.51 112.26 2oye n ALA 133 Ca 0.02 -0.67 -0.30 0.00 0.00 0.00 0.00 53.44 52.49 2oye n ALA 133 Cb 0.20 -0.50 -0.16 0.00 0.00 0.00 0.00 19.45 18.98 2oye n ALA 133 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2oye s HIS 134 N -2.50 2.20 -0.57 0.00 3.76 -1.21 -5.01 115.29 111.96 2oye s HIS 134 Ca -0.27 -0.65 0.01 0.00 -0.15 0.00 0.00 55.06 54.00 2oye s HIS 134 Cb 0.07 -1.45 0.44 0.00 1.11 0.00 0.00 32.58 32.76 2oye s HIS 134 CO 0.68 -0.20 1.76 -0.25 -0.85 0.00 0.00 174.74 175.87 2oye n ASP 135 N 3.01 6.78 -3.57 1.40 8.00 -1.26 -2.58 116.55 128.33 2oye n ASP 135 Ca -0.18 -3.78 -0.08 0.00 0.71 0.00 0.00 54.79 51.46 2oye n ASP 135 Cb 0.52 -0.78 -0.02 0.00 -0.02 0.00 0.00 41.12 40.82 2oye n ASP 135 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2oye s TYR 136 N -3.78 -0.34 0.12 1.24 -0.85 -1.26 -4.95 117.35 107.53 2oye s TYR 136 Ca 0.59 0.12 -0.31 0.00 -0.52 0.00 0.00 57.07 56.95 2oye s TYR 136 Cb 0.47 0.58 -0.08 0.00 0.38 0.00 0.00 41.96 43.31 2oye s TYR 136 CO -0.04 -0.74 1.39 0.42 -1.52 0.00 0.00 175.55 175.05 2oye s ILE 137 N -3.39 3.30 -0.01 -3.49 1.09 -1.26 -4.74 121.20 112.70 2oye s ILE 137 Ca 0.06 0.93 -0.05 0.00 -1.10 0.00 0.00 60.65 60.49 2oye s ILE 137 Cb -0.02 -3.60 -0.00 0.00 -1.06 0.00 0.00 42.46 37.79 2oye s ILE 137 CO -0.06 0.07 0.10 -0.94 -0.10 0.00 0.00 174.94 174.01 2oye s SER 138 N 1.09 0.03 0.54 3.58 1.04 -1.26 -5.02 113.70 113.70 2oye s SER 138 Ca 0.64 -0.16 0.28 0.00 0.48 0.00 0.00 55.95 57.20 2oye s SER 138 Cb -0.37 0.19 1.52 0.00 0.10 0.00 0.00 66.02 67.47 2oye s SER 138 CO 0.30 -0.27 2.10 -0.25 0.98 0.00 0.00 173.24 176.10 2oye h TRP 139 N 4.77 0.00 0.00 5.02 2.91 -1.99 -2.31 115.95 124.36 2oye h TRP 139 Ca -0.30 0.00 -0.00 0.00 1.13 0.00 0.00 58.89 59.72 2oye h TRP 139 Cb 1.20 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.85 2oye h TRP 139 CO 0.56 0.10 -0.00 1.49 -1.03 0.00 0.00 178.44 179.56 2oye h GLU 140 N 0.00 -0.00 -0.45 2.65 4.57 -1.98 -1.41 114.58 117.95 2oye h GLU 140 Ca -0.00 0.00 0.05 0.00 -1.18 0.00 0.00 59.36 58.23 2oye h GLU 140 Cb 0.28 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.85 2oye h GLU 140 CO 0.01 0.48 0.30 1.03 -1.18 0.00 0.00 179.01 179.66 2oye h SER 141 N -0.49 0.37 -0.12 1.04 0.87 -1.82 0.30 113.55 113.70 2oye h SER 141 Ca -0.00 -0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.40 2oye h SER 141 Cb 0.49 -0.08 0.01 0.00 -0.44 0.00 0.00 62.40 62.37 2oye h SER 141 CO 0.00 0.25 -0.56 0.15 -0.53 0.00 0.00 176.83 176.14 2oye h PHE 142 N 0.43 0.78 0.01 2.24 3.57 -1.33 -3.38 116.94 119.26 2oye h PHE 142 Ca 0.19 -0.34 -0.27 0.00 3.53 0.00 0.00 57.97 61.08 2oye h PHE 142 Cb 0.23 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 2oye h PHE 142 CO -0.00 1.13 -1.52 0.66 -2.23 0.00 0.00 178.31 176.35 2oye h SER 143 N 0.21 0.02 -1.06 0.41 4.64 -0.43 -3.44 113.55 113.90 2oye h SER 143 Ca -0.04 -0.04 -0.62 0.00 -0.47 0.00 0.00 61.79 60.62 2oye h SER 143 Cb 1.20 -0.01 -0.10 0.00 -0.31 0.00 0.00 62.40 63.18 2oye h SER 143 CO 0.12 1.03 1.67 0.21 -0.87 0.00 0.00 176.83 178.99 2oye s ASN 144 N -6.30 6.59 0.57 4.97 3.84 0.99 -4.86 114.94 120.74 2oye s ASN 144 Ca -0.04 -1.71 0.29 0.00 0.21 0.00 0.00 52.86 51.62 2oye s ASN 144 Cb 0.08 -2.57 1.47 0.00 -0.55 0.00 0.00 41.25 39.68 2oye s ASN 144 CO 0.82 -1.42 1.90 0.58 -2.79 0.00 0.00 177.10 176.20 2oye h VAL 145 N 6.48 0.47 -0.89 -5.21 2.07 -1.87 -2.57 116.25 114.72 2oye h VAL 145 Ca 0.26 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.96 2oye h VAL 145 Cb 0.98 0.61 -0.07 0.00 -1.52 0.00 0.00 31.29 31.29 2oye h VAL 145 CO 1.43 0.00 0.58 0.28 0.02 0.00 0.00 177.57 179.88 2oye h SER 146 N 0.00 0.51 -4.06 0.57 0.02 -1.89 -3.43 113.55 105.27 2oye h SER 146 Ca 0.28 0.04 -0.47 0.00 -0.84 0.00 0.00 61.79 60.80 2oye h SER 146 Cb 1.32 -0.05 0.03 0.00 0.14 0.00 0.00 62.40 63.84 2oye h SER 146 CO -0.00 0.23 0.39 -0.31 -1.14 0.00 0.00 176.83 176.00 2oye s TYR 147 N -5.54 2.99 0.51 3.45 2.02 -0.97 0.03 117.35 119.86 2oye s TYR 147 Ca -0.09 1.58 -0.03 0.00 -0.37 0.00 0.00 57.07 58.16 2oye s TYR 147 Cb 0.22 -3.09 -0.00 0.00 -0.40 0.00 0.00 41.96 38.69 2oye s TYR 147 CO 0.78 -0.88 0.78 0.71 -1.57 0.00 0.00 175.55 175.38 2oye s TYR 148 N -1.93 3.26 0.24 2.71 2.02 -0.60 -4.80 117.35 118.26 2oye s TYR 148 Ca 0.67 0.46 0.11 0.00 -0.37 0.00 0.00 57.07 57.94 2oye s TYR 148 Cb -0.18 -2.50 -0.05 0.00 -0.40 0.00 0.00 41.96 38.84 2oye s TYR 148 CO 0.21 -0.56 -0.17 -0.08 -1.57 0.00 0.00 175.55 173.39 2oye s THR 149 N -2.76 2.68 0.20 -0.71 -1.32 -0.98 -4.45 115.64 108.30 2oye s THR 149 Ca 0.51 -2.15 0.11 0.00 -1.21 0.00 0.00 61.69 58.95 2oye s THR 149 Cb -0.10 -2.37 -0.04 0.00 -1.51 0.00 0.00 72.50 68.47 2oye s THR 149 CO 0.42 -0.29 -0.22 0.00 -2.21 0.00 0.00 174.62 172.32 2oye s ARG 150 N -3.25 1.60 -0.16 7.08 1.70 -0.21 -1.01 118.95 124.70 2oye s ARG 150 Ca 0.27 -1.53 -0.24 0.00 -0.47 0.00 0.00 55.73 53.76 2oye s ARG 150 Cb -0.06 -1.87 -0.21 0.00 -0.57 0.00 0.00 34.95 32.23 2oye s ARG 150 CO 0.14 0.39 0.52 0.82 -1.08 0.00 0.00 175.30 176.10 2oye h ILE 151 N 3.04 1.35 -3.00 4.99 1.08 -2.00 -3.30 117.51 119.66 2oye h ILE 151 Ca -0.46 -2.15 -0.63 0.00 -0.39 0.00 0.00 64.86 61.24 2oye h ILE 151 Cb 1.21 2.69 -0.06 0.00 -3.07 0.00 0.00 36.82 37.59 2oye h ILE 151 CO 0.50 0.46 -0.54 -0.76 -0.69 0.00 0.00 178.15 177.12 2oye s LEU 152 N -8.15 4.16 1.05 1.44 1.43 -1.26 -4.93 118.68 112.43 2oye s LEU 152 Ca -0.20 0.17 -0.12 0.00 -1.03 0.00 0.00 54.13 52.95 2oye s LEU 152 Cb -0.00 -2.79 0.22 0.00 0.03 0.00 0.00 46.19 43.65 2oye s LEU 152 CO 0.59 0.17 1.07 -2.16 0.23 0.00 0.00 176.35 176.25 2oye s PRO 153 N -2.45 -0.03 1.03 1.29 0.04 -1.26 -4.96 135.00 128.66 2oye s PRO 153 Ca 0.33 0.80 -0.17 0.00 0.04 0.00 0.00 61.00 61.99 2oye s PRO 153 Cb -0.13 -1.66 0.24 0.00 0.04 0.00 0.00 34.50 32.99 2oye s PRO 153 CO 0.26 -3.11 1.31 -1.13 0.04 0.00 0.00 177.00 174.37 2oye n SER 154 N -4.48 -0.21 -4.70 6.66 3.41 -1.26 -4.54 113.62 108.50 2oye n SER 154 Ca 0.05 -1.44 -0.42 0.00 -0.26 0.00 0.00 58.87 56.79 2oye n SER 154 Cb 0.55 -1.03 -0.03 0.00 -0.26 0.00 0.00 64.21 63.44 2oye n SER 154 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2oye s VAL 155 N -3.81 4.24 0.05 -3.33 1.01 0.83 -4.88 120.40 114.50 2oye s VAL 155 Ca 0.76 1.58 -0.36 0.00 0.00 0.00 0.00 61.98 63.96 2oye s VAL 155 Cb -0.03 -4.02 -0.15 0.00 0.00 0.00 0.00 36.38 32.19 2oye s VAL 155 CO 0.54 0.04 1.52 -2.65 0.00 0.00 0.00 175.10 174.54 2oye n PRO 156 N 4.79 1.57 -0.87 2.72 -0.02 -1.26 -4.76 135.00 137.16 2oye n PRO 156 Ca 0.10 0.57 -0.17 0.00 -2.02 0.00 0.00 63.50 61.98 2oye n PRO 156 Cb 0.47 -2.27 -0.10 0.00 -0.02 0.00 0.00 33.50 31.57 2oye n PRO 156 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2oye n ARG 157 N 3.56 2.03 -0.33 -0.52 5.12 -1.26 -2.90 116.66 122.35 2oye n ARG 157 Ca 0.19 -1.14 -0.01 0.00 -1.93 0.00 0.00 57.85 54.97 2oye n ARG 157 Cb 0.22 -2.14 -0.01 0.00 -1.16 0.00 0.00 32.46 29.38 2oye n ARG 157 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 2oye n ASP 158 N 3.02 -0.09 -4.91 0.55 5.75 -1.26 -5.15 116.55 114.46 2oye n ASP 158 Ca 0.44 -0.27 -0.28 0.00 -0.01 0.00 0.00 54.79 54.66 2oye n ASP 158 Cb 0.55 0.03 -0.03 0.00 -1.03 0.00 0.00 41.12 40.64 2oye n ASP 158 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2oye h PRO 160 N 1.62 -0.29 -6.53 0.00 0.11 -1.93 -3.43 132.00 121.56 2oye h PRO 160 Ca -0.48 0.02 -0.51 0.00 0.11 0.00 0.00 66.00 65.14 2oye h PRO 160 Cb 1.19 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 2oye h PRO 160 CO 0.66 -0.19 -0.12 0.95 -0.21 0.00 0.00 178.00 179.09 2oye s THR 161 N -4.27 5.01 0.66 -1.15 -4.23 -1.15 -4.97 115.64 105.53 2oye s THR 161 Ca -0.07 0.09 0.36 0.00 -1.18 0.00 0.00 61.69 60.88 2oye s THR 161 Cb 0.03 -3.74 0.37 0.00 1.34 0.00 0.00 72.50 70.50 2oye s THR 161 CO 0.28 -0.35 2.13 -0.65 -0.54 0.00 0.00 174.62 175.49 2oye h PRO 162 N 1.59 0.00 -0.11 3.99 0.11 -1.82 -1.81 132.00 133.95 2oye h PRO 162 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2oye h PRO 162 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2oye h PRO 162 CO 0.66 0.00 0.00 -1.33 -0.21 0.00 0.00 178.00 177.12 2oye n MET 163 N -3.11 1.23 0.00 1.05 2.81 -1.26 -4.96 117.12 112.88 2oye n MET 163 Ca -0.02 -1.39 0.00 0.00 -1.81 0.00 0.00 57.70 54.48 2oye n MET 163 Cb 0.25 -1.20 0.00 0.00 -0.71 0.00 0.00 33.22 31.56 2oye n MET 163 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2oye n GLY 164 N 0.49 1.25 0.00 3.03 0.00 -0.68 -4.51 105.19 104.77 2oye n GLY 164 Ca 0.07 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.68 2oye n GLY 164 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2oye n THR 165 N 0.00 0.00 -3.65 2.61 -1.04 -1.25 -2.95 114.28 108.00 2oye n THR 165 Ca 0.00 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.70 2oye n THR 165 Cb 0.00 -0.29 -0.04 0.00 -1.82 0.00 0.00 70.33 68.18 2oye n THR 165 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2oye s LYS 166 N -1.40 3.62 0.00 -2.82 1.02 -1.26 -4.58 119.74 114.31 2oye s LYS 166 Ca 0.00 -0.10 0.00 0.00 0.02 0.00 0.00 55.97 55.89 2oye s LYS 166 Cb 0.00 -2.83 0.00 0.00 -0.52 0.00 0.00 37.83 34.48 2oye s LYS 166 CO 0.00 0.44 0.00 0.41 -0.92 0.00 0.00 175.35 175.28 2oye n GLY 167 N -0.04 1.32 3.82 -3.33 0.00 -1.26 -4.61 105.19 101.08 2oye n GLY 167 Ca -0.02 -2.23 -0.36 0.00 0.00 0.00 0.00 46.02 43.41 2oye n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oye s LYS 168 N -1.35 4.23 0.58 1.61 1.02 -1.24 -4.95 119.74 119.64 2oye s LYS 168 Ca 0.00 0.86 0.34 0.00 0.02 0.00 0.00 55.97 57.19 2oye s LYS 168 Cb 0.00 -2.81 1.37 0.00 -0.52 0.00 0.00 37.83 35.87 2oye s LYS 168 CO 0.00 0.35 1.63 0.87 -0.92 0.00 0.00 175.35 177.28 2oye h LYS 169 N 3.23 0.00 -4.69 1.68 6.56 -1.96 -3.40 116.57 117.99 2oye h LYS 169 Ca -0.48 0.00 -0.37 0.00 -1.06 0.00 0.00 60.65 58.74 2oye h LYS 169 Cb 1.19 0.00 -0.27 0.00 -0.57 0.00 0.00 32.23 32.58 2oye h LYS 169 CO 0.65 0.00 -0.77 1.14 -2.06 0.00 0.00 179.45 178.41 2oye s GLN 170 N -4.68 0.66 0.52 3.15 1.03 -1.26 -4.54 119.66 114.54 2oye s GLN 170 Ca -0.04 -0.42 -0.16 0.00 0.04 0.00 0.00 55.36 54.78 2oye s GLN 170 Cb 0.19 -0.61 -0.07 0.00 0.03 0.00 0.00 33.01 32.54 2oye s GLN 170 CO 0.65 0.16 0.99 -0.51 -2.54 0.00 0.00 175.29 174.04 2oye s LEU 171 N -0.52 3.60 0.18 2.60 1.43 -1.26 -5.00 118.68 119.71 2oye s LEU 171 Ca 0.01 1.58 -0.33 0.00 -1.03 0.00 0.00 54.13 54.35 2oye s LEU 171 Cb -0.05 -4.51 -0.14 0.00 0.03 0.00 0.00 46.19 41.52 2oye s LEU 171 CO 0.00 -0.63 1.45 -2.65 0.23 0.00 0.00 176.35 174.75 2oye n PRO 172 N -1.66 1.90 -1.65 1.29 -0.02 -1.26 -4.80 135.00 128.79 2oye n PRO 172 Ca 0.07 0.68 -0.54 0.00 -2.02 0.00 0.00 63.50 61.69 2oye n PRO 172 Cb 0.54 -2.37 -0.07 0.00 -0.02 0.00 0.00 33.50 31.58 2oye n PRO 172 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2oye n ASP 173 N 2.72 2.62 0.33 2.55 5.75 -1.26 -4.76 116.55 124.50 2oye n ASP 173 Ca 0.15 0.93 0.21 0.00 -0.01 0.00 0.00 54.79 56.07 2oye n ASP 173 Cb 0.28 -1.22 1.11 0.00 -1.03 0.00 0.00 41.12 40.26 2oye n ASP 173 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2oye h ALA 174 N 8.68 1.15 0.02 2.12 0.00 -1.93 -0.40 119.26 128.90 2oye h ALA 174 Ca -0.43 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 2oye h ALA 174 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2oye h ALA 174 CO 0.97 -0.07 -0.01 1.05 0.00 0.00 0.00 179.25 181.19 2oye h GLU 175 N 0.00 -0.03 0.42 0.00 4.11 -1.92 -2.67 114.58 114.49 2oye h GLU 175 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.42 2oye h GLU 175 Cb 0.13 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2oye h GLU 175 CO -0.00 0.60 -0.22 0.35 0.07 0.00 0.00 179.01 179.81 2oye h PHE 176 N -0.69 -0.58 -1.31 2.06 3.57 -1.60 -1.85 116.94 116.54 2oye h PHE 176 Ca -0.00 -0.01 0.44 0.00 3.53 0.00 0.00 57.97 61.93 2oye h PHE 176 Cb 0.64 0.20 -0.14 0.00 2.79 0.00 0.00 35.95 39.44 2oye h PHE 176 CO 0.15 -0.34 0.83 1.25 -2.23 0.00 0.00 178.31 177.96 2oye h LEU 177 N -0.59 0.25 0.15 0.59 5.85 -1.27 0.33 115.31 120.63 2oye h LEU 177 Ca -0.06 0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2oye h LEU 177 Cb 0.46 0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.63 2oye h LEU 177 CO 0.08 -0.22 -0.07 0.28 -0.34 0.00 0.00 178.44 178.17 2oye h SER 178 N 0.06 -0.17 -0.33 1.25 0.02 -1.29 -2.72 113.55 110.38 2oye h SER 178 Ca 0.84 -0.32 0.04 0.00 -0.84 0.00 0.00 61.79 61.51 2oye h SER 178 Cb 2.60 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 65.14 2oye h SER 178 CO -0.47 0.41 0.09 0.03 -1.14 0.00 0.00 176.83 175.75 2oye h ARG 179 N -0.94 0.21 -0.61 3.45 -0.00 -0.18 0.55 114.38 116.85 2oye h ARG 179 Ca -0.02 -0.01 0.08 0.00 -0.50 0.00 0.00 59.98 59.53 2oye h ARG 179 Cb 0.48 -0.05 -0.07 0.00 0.00 0.00 0.00 29.97 30.33 2oye h ARG 179 CO 0.03 0.14 0.26 0.00 0.00 0.00 0.00 179.97 180.40 2oye h ARG 180 N 0.21 0.45 0.00 0.04 2.47 -0.55 -3.26 114.38 113.74 2oye h ARG 180 Ca 0.15 -0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 58.83 2oye h ARG 180 Cb 0.15 -0.10 -0.00 0.00 -1.65 0.00 0.00 29.97 28.36 2oye h ARG 180 CO -0.18 0.30 -1.05 1.19 0.56 0.00 0.00 179.97 180.79 2oye n PHE 181 N -4.95 0.00 0.62 3.04 0.99 -1.02 -4.79 117.46 111.35 2oye n PHE 181 Ca 0.08 0.00 0.11 0.00 -0.00 0.00 0.00 57.45 57.64 2oye n PHE 181 Cb 0.25 -0.04 0.01 0.00 -1.00 0.00 0.00 39.48 38.70 2oye n PHE 181 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 2oye n LEU 182 N -2.17 0.62 -4.72 4.37 4.77 0.17 0.33 117.00 120.38 2oye n LEU 182 Ca -0.01 -0.08 -0.42 0.00 -0.03 0.00 0.00 56.01 55.47 2oye n LEU 182 Cb 0.52 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.49 2oye n LEU 182 CO 0.01 0.07 0.91 -0.22 -1.33 0.00 0.00 177.39 176.84 2oye s LEU 183 N -3.77 4.38 0.44 2.23 2.96 -0.09 -1.18 118.68 123.65 2oye s LEU 183 Ca 0.04 2.09 -0.23 0.00 -0.22 0.00 0.00 54.13 55.81 2oye s LEU 183 Cb 0.15 -3.58 -0.08 0.00 0.50 0.00 0.00 46.19 43.17 2oye s LEU 183 CO 0.81 -0.48 1.11 -0.60 -1.32 0.00 0.00 176.35 175.87 2oye s ARG 184 N 0.88 3.92 0.00 1.98 3.52 0.20 -4.25 118.95 125.20 2oye s ARG 184 Ca 0.59 1.65 0.00 0.00 -0.13 0.00 0.00 55.73 57.84 2oye s ARG 184 Cb -0.31 -2.44 0.00 0.00 -1.56 0.00 0.00 34.95 30.64 2oye s ARG 184 CO 0.30 -0.38 0.00 0.54 -0.81 0.00 0.00 175.30 174.95 2oye n ARG 185 N -0.35 0.00 -4.26 5.12 3.00 -1.26 -4.78 116.66 114.14 2oye n ARG 185 Ca 0.06 0.00 -0.34 0.00 -0.01 0.00 0.00 57.85 57.56 2oye n ARG 185 Cb 0.49 -0.05 -0.11 0.00 0.00 0.00 0.00 32.46 32.79 2oye n ARG 185 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2oye s LYS 186 N -0.53 3.73 -0.19 5.56 3.01 -1.26 -5.05 119.74 125.00 2oye s LYS 186 Ca 0.00 -0.45 -0.29 0.00 -1.01 0.00 0.00 55.97 54.22 2oye s LYS 186 Cb 0.00 -3.01 -0.04 0.00 -1.01 0.00 0.00 37.83 33.77 2oye s LYS 186 CO 0.00 0.29 1.88 0.12 0.51 0.00 0.00 175.35 178.15 2oye s PHE 187 N 0.26 1.64 -0.50 3.18 2.19 -1.26 -4.95 117.98 118.55 2oye s PHE 187 Ca -0.00 0.37 -0.18 0.00 0.33 0.00 0.00 56.93 57.45 2oye s PHE 187 Cb -0.13 -4.04 0.06 0.00 -1.31 0.00 0.00 43.02 37.60 2oye s PHE 187 CO 0.02 -3.74 0.57 0.42 1.83 0.00 0.00 175.22 174.32 2oye s ILE 188 N 6.20 4.96 0.86 3.12 1.01 -1.26 -5.07 121.20 131.02 2oye s ILE 188 Ca 0.84 -0.62 -0.11 0.00 0.00 0.00 0.00 60.65 60.75 2oye s ILE 188 Cb -0.30 -4.26 0.10 0.00 0.01 0.00 0.00 42.46 38.02 2oye s ILE 188 CO 0.34 -0.75 1.09 -2.16 0.00 0.00 0.00 174.94 173.46 2oye s PRO 189 N 2.40 1.60 -0.22 2.79 0.04 -1.26 -0.74 135.00 139.62 2oye s PRO 189 Ca 0.13 0.76 -0.29 0.00 0.04 0.00 0.00 61.00 61.63 2oye s PRO 189 Cb -0.20 -1.85 -0.02 0.00 0.04 0.00 0.00 34.50 32.47 2oye s PRO 189 CO 0.11 -1.99 1.40 0.34 0.04 0.00 0.00 177.00 176.90 2oye s ASP 190 N -3.61 6.68 0.56 6.66 2.15 -0.61 -4.18 116.67 124.31 2oye s ASP 190 Ca 0.62 1.55 0.20 0.00 0.43 0.00 0.00 52.55 55.36 2oye s ASP 190 Cb -0.17 -2.54 1.08 0.00 -0.30 0.00 0.00 42.92 41.00 2oye s ASP 190 CO 0.56 -1.02 1.57 1.55 -0.17 0.00 0.00 175.17 177.66 2oye h PRO 191 N 9.36 0.00 -0.03 4.34 0.13 -1.90 -1.34 132.00 142.57 2oye h PRO 191 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2oye h PRO 191 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2oye h PRO 191 CO 1.00 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.81 2oye n GLN 192 N -2.56 1.89 -0.88 0.86 6.02 -1.26 -4.94 117.38 116.50 2oye n GLN 192 Ca -0.01 -1.29 0.00 0.00 -0.01 0.00 0.00 57.00 55.69 2oye n GLN 192 Cb 0.47 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.26 2oye n GLN 192 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2oye n GLY 193 N 1.23 0.57 3.68 1.08 0.00 -0.50 -4.91 105.19 106.34 2oye n GLY 193 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 2oye n GLY 193 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2oye n THR 194 N -2.85 1.42 -4.50 2.61 -1.04 -1.26 0.85 114.28 109.52 2oye n THR 194 Ca 0.00 -0.36 -0.30 0.00 -2.04 0.00 0.00 64.05 61.35 2oye n THR 194 Cb 0.00 -1.53 -0.07 0.00 -1.82 0.00 0.00 70.33 66.91 2oye n THR 194 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2oye s ASN 195 N 0.03 4.23 0.43 8.00 2.20 -1.17 -1.42 114.94 127.24 2oye s ASN 195 Ca 0.62 -1.48 0.22 0.00 -0.94 0.00 0.00 52.86 51.28 2oye s ASN 195 Cb -0.61 0.28 0.95 0.00 -2.00 0.00 0.00 41.25 39.88 2oye s ASN 195 CO 0.55 -0.82 1.86 -0.07 -2.94 0.00 0.00 177.10 175.68 2oye h LEU 196 N 1.29 0.00 -2.32 3.54 3.38 -0.60 -1.56 115.31 119.03 2oye h LEU 196 Ca -0.42 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.54 2oye h LEU 196 Cb 1.30 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.05 2oye h LEU 196 CO 0.71 0.27 -0.02 -0.03 0.09 0.00 0.00 178.44 179.46 2oye h MET 197 N 0.00 0.00 0.00 1.13 4.05 -1.42 -2.43 114.93 116.26 2oye h MET 197 Ca -0.00 0.00 -0.13 0.00 -0.28 0.00 0.00 59.70 59.28 2oye h MET 197 Cb 0.68 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.46 2oye h MET 197 CO 0.04 0.02 -0.74 0.35 0.23 0.00 0.00 176.91 176.80 2oye h PHE 198 N 0.00 0.00 -1.03 1.39 3.57 -1.53 -3.29 116.94 116.05 2oye h PHE 198 Ca -0.00 0.00 0.27 0.00 3.53 0.00 0.00 57.97 61.77 2oye h PHE 198 Cb 0.22 0.00 -0.12 0.00 2.79 0.00 0.00 35.95 38.84 2oye h PHE 198 CO 0.00 1.23 0.63 0.00 -2.23 0.00 0.00 178.31 177.94 2oye h ALA 199 N -0.34 2.01 0.02 2.41 0.00 -0.99 -0.07 119.26 122.30 2oye h ALA 199 Ca -0.20 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2oye h ALA 199 Cb 1.14 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2oye h ALA 199 CO -0.12 -0.47 -0.01 0.74 0.00 0.00 0.00 179.25 179.38 2oye h PHE 200 N 0.47 -0.03 -0.84 0.00 0.04 -1.62 -1.90 116.94 113.07 2oye h PHE 200 Ca 0.64 -0.00 0.21 0.00 2.80 0.00 0.00 57.97 61.62 2oye h PHE 200 Cb 1.42 0.01 -0.13 0.00 2.20 0.00 0.00 35.95 39.45 2oye h PHE 200 CO -0.01 0.68 0.21 0.35 -0.60 0.00 0.00 178.31 178.94 2oye h PHE 201 N -0.80 0.31 0.27 -0.55 3.57 -1.42 0.70 116.94 119.01 2oye h PHE 201 Ca -0.00 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.55 2oye h PHE 201 Cb 0.72 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.44 2oye h PHE 201 CO 0.18 -0.18 -0.27 0.00 -2.23 0.00 0.00 178.31 175.80 2oye h ALA 202 N 1.74 -0.57 0.30 2.41 0.00 -1.02 0.35 119.26 122.47 2oye h ALA 202 Ca 0.51 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.33 2oye h ALA 202 Cb 0.99 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 2oye h ALA 202 CO -0.62 -0.85 -0.20 0.37 0.00 0.00 0.00 179.25 177.94 2oye h GLN 203 N -0.58 -0.48 0.00 0.00 4.15 0.20 -1.34 115.11 117.07 2oye h GLN 203 Ca -0.01 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.44 2oye h GLN 203 Cb 0.54 0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.33 2oye h GLN 203 CO -0.06 -0.32 0.00 1.58 -1.93 0.00 0.00 178.83 178.10 2oye n HIS 204 N -5.33 0.00 -0.30 3.99 -0.00 0.21 -1.88 115.22 111.91 2oye n HIS 204 Ca -0.09 0.00 0.06 0.00 0.46 0.00 0.00 57.72 58.15 2oye n HIS 204 Cb 0.24 -0.27 0.14 0.00 -0.12 0.00 0.00 29.99 29.98 2oye n HIS 204 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 2oye n PHE 205 N -1.63 0.33 0.20 1.57 7.35 0.11 -0.06 117.46 125.34 2oye n PHE 205 Ca 0.00 1.02 0.05 0.00 -0.76 0.00 0.00 57.45 57.76 2oye n PHE 205 Cb 0.00 -1.01 0.41 0.00 0.35 0.00 0.00 39.48 39.23 2oye n PHE 205 CO 0.00 0.00 0.00 1.79 -0.76 0.00 0.00 176.76 177.79 2oye h THR 206 N 0.00 1.06 0.00 -2.13 1.35 -1.12 -2.98 112.91 109.09 2oye h THR 206 Ca 0.42 -1.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.04 2oye h THR 206 Cb 0.67 1.70 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 2oye h THR 206 CO -0.85 0.33 0.00 1.41 -0.25 0.00 0.00 175.52 176.16 2oye n HIS 207 N -3.87 0.00 0.56 4.73 8.25 0.92 -1.91 115.22 123.90 2oye n HIS 207 Ca -0.01 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.56 2oye n HIS 207 Cb 0.41 0.00 0.13 0.00 1.12 0.00 0.00 29.99 31.65 2oye n HIS 207 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2oye n GLN 208 N -0.82 0.30 0.00 -0.41 10.64 -1.13 -4.04 117.38 121.92 2oye n GLN 208 Ca 0.08 0.06 0.00 0.00 -1.83 0.00 0.00 57.00 55.32 2oye n GLN 208 Cb 0.04 -1.67 0.00 0.00 -0.86 0.00 0.00 30.24 27.75 2oye n GLN 208 CO 0.00 0.00 0.00 1.97 -1.83 0.00 0.00 177.06 177.20 2oye n PHE 209 N -2.08 0.00 -3.73 2.61 -1.74 -0.92 -4.63 117.46 106.96 2oye n PHE 209 Ca 0.03 0.00 -0.38 0.00 -0.56 0.00 0.00 57.45 56.54 2oye n PHE 209 Cb 0.44 0.00 -0.12 0.00 1.52 0.00 0.00 39.48 41.32 2oye n PHE 209 CO 0.00 0.00 0.00 -0.06 -0.56 0.00 0.00 176.76 176.14 2oye s PHE 210 N -0.95 3.18 -0.50 2.97 0.08 -0.80 -4.84 117.98 117.12 2oye s PHE 210 Ca 0.00 -1.05 0.07 0.00 0.12 0.00 0.00 56.93 56.07 2oye s PHE 210 Cb 0.00 -2.29 0.21 0.00 -0.57 0.00 0.00 43.02 40.37 2oye s PHE 210 CO 0.00 -0.61 0.77 1.63 -0.10 0.00 0.00 175.22 176.91 2oye n LYS 211 N 4.88 0.62 -2.13 0.44 5.02 -1.26 -4.55 118.16 121.17 2oye n LYS 211 Ca -0.14 -2.00 -0.42 0.00 -2.02 0.00 0.00 58.31 53.74 2oye n LYS 211 Cb 0.47 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 33.98 2oye n LYS 211 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2oye s THR 212 N 0.72 3.34 -0.58 -0.18 2.01 -1.26 -1.31 115.64 118.38 2oye s THR 212 Ca 0.31 0.88 -0.27 0.00 0.31 0.00 0.00 61.69 62.92 2oye s THR 212 Cb 0.09 -3.56 -0.03 0.00 0.01 0.00 0.00 72.50 69.01 2oye s THR 212 CO -0.13 0.03 1.94 -0.55 -0.69 0.00 0.00 174.62 175.22 2oye s SER 213 N 1.56 5.18 0.19 3.53 0.15 -0.88 -4.84 113.70 118.59 2oye s SER 213 Ca 0.66 0.51 -0.14 0.00 0.70 0.00 0.00 55.95 57.69 2oye s SER 213 Cb -0.36 -2.52 0.19 0.00 -1.71 0.00 0.00 66.02 61.62 2oye s SER 213 CO 0.29 -2.42 1.68 1.23 1.20 0.00 0.00 173.24 175.22 2oye h GLY 214 N 16.76 0.50 0.15 9.45 0.00 -1.90 1.36 103.07 129.40 2oye h GLY 214 Ca -0.26 0.08 0.01 0.00 0.00 0.00 0.00 47.33 47.16 2oye h GLY 214 CO 1.20 -0.15 -0.51 0.07 0.00 0.00 0.00 176.54 177.15 2oye h LYS 215 N 0.10 -0.71 0.00 4.80 -0.00 -2.01 -2.19 116.57 116.57 2oye h LYS 215 Ca 0.26 0.05 0.00 0.00 -0.00 0.00 0.00 60.65 60.95 2oye h LYS 215 Cb 0.39 0.16 0.00 0.00 -0.00 0.00 0.00 32.23 32.78 2oye h LYS 215 CO -0.44 -0.47 0.00 0.52 -0.00 0.00 0.00 179.45 179.06 2oye h MET 216 N -0.73 0.00 0.00 0.07 2.07 -1.89 -3.49 114.93 110.96 2oye h MET 216 Ca 0.00 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.63 2oye h MET 216 Cb 0.75 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.48 2oye h MET 216 CO -0.28 0.00 0.00 0.41 1.07 0.00 0.00 176.91 178.11 2oye n GLY 217 N 0.45 -1.46 3.83 8.32 0.00 0.46 -4.90 105.19 111.89 2oye n GLY 217 Ca 0.02 -2.08 -0.31 0.00 0.00 0.00 0.00 46.02 43.65 2oye n GLY 217 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2oye s PRO 218 N 0.00 3.04 0.00 1.61 0.02 -1.26 -3.66 135.00 134.75 2oye s PRO 218 Ca 0.00 0.92 0.00 0.00 0.02 0.00 0.00 61.00 61.94 2oye s PRO 218 Cb 0.00 -2.00 0.00 0.00 0.02 0.00 0.00 34.50 32.52 2oye s PRO 218 CO 0.00 -1.01 0.00 0.41 -0.33 0.00 0.00 177.00 176.07 2oye n GLY 219 N -2.12 0.56 3.27 0.52 0.00 -1.26 -5.01 105.19 101.15 2oye n GLY 219 Ca 0.07 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.90 2oye n GLY 219 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oye s PHE 220 N -2.47 1.53 -0.03 1.61 0.40 -1.24 -1.56 117.98 116.22 2oye s PHE 220 Ca 0.00 -0.52 0.00 0.00 -0.60 0.00 0.00 56.93 55.81 2oye s PHE 220 Cb 0.00 -0.79 0.03 0.00 0.51 0.00 0.00 43.02 42.76 2oye s PHE 220 CO 0.00 0.20 0.01 -0.08 0.70 0.00 0.00 175.22 176.05 2oye s THR 221 N -2.05 0.11 0.28 0.64 -1.32 0.11 -2.08 115.64 111.33 2oye s THR 221 Ca 0.10 0.14 0.06 0.00 -1.21 0.00 0.00 61.69 60.79 2oye s THR 221 Cb -0.05 -0.23 0.01 0.00 -1.51 0.00 0.00 72.50 70.72 2oye s THR 221 CO 0.04 0.14 1.66 0.11 -2.21 0.00 0.00 174.62 174.36 2oye h LYS 222 N 7.38 0.22 -5.65 7.08 1.57 -1.52 -3.37 116.57 122.29 2oye h LYS 222 Ca -0.41 -0.12 -0.49 0.00 -1.87 0.00 0.00 60.65 57.77 2oye h LYS 222 Cb 1.13 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 33.39 2oye h LYS 222 CO 0.45 0.65 1.57 0.00 -0.57 0.00 0.00 179.45 181.55 2oye s ALA 223 N -4.01 2.47 0.59 3.86 0.00 -1.26 -4.95 121.76 118.46 2oye s ALA 223 Ca -0.04 -2.49 -0.10 0.00 0.00 0.00 0.00 51.96 49.33 2oye s ALA 223 Cb 0.13 -4.66 -0.04 0.00 0.00 0.00 0.00 23.12 18.54 2oye s ALA 223 CO 0.78 -4.37 0.98 -0.51 0.00 0.00 0.00 175.76 172.63 2oye s LEU 224 N 8.00 3.32 0.00 0.00 1.43 -1.26 -3.83 118.68 126.35 2oye s LEU 224 Ca 0.62 1.33 0.00 0.00 -1.03 0.00 0.00 54.13 55.05 2oye s LEU 224 Cb 0.01 -4.36 0.00 0.00 0.03 0.00 0.00 46.19 41.87 2oye s LEU 224 CO 0.11 -0.80 0.00 0.61 0.23 0.00 0.00 176.35 176.49 2oye n GLY 225 N -2.61 3.23 4.83 -3.19 0.00 -1.26 -4.87 105.19 101.32 2oye n GLY 225 Ca 0.05 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.06 2oye n GLY 225 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2oye n HIS 226 N 0.00 0.00 -0.81 1.61 8.25 -1.25 -4.83 115.22 118.19 2oye n HIS 226 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2oye n HIS 226 Cb 0.00 -0.98 0.00 0.00 1.12 0.00 0.00 29.99 30.13 2oye n HIS 226 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2oye n GLY 227 N -1.86 3.91 2.95 -1.41 0.00 -1.26 -4.27 105.19 103.24 2oye n GLY 227 Ca 0.00 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.85 2oye n GLY 227 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2oye n VAL 228 N 0.00 5.15 0.78 1.61 0.31 -1.26 -4.62 118.33 120.30 2oye n VAL 228 Ca 0.00 -5.90 0.12 0.00 -0.01 0.00 0.00 64.34 58.55 2oye n VAL 228 Cb 0.00 -2.06 0.15 0.00 -0.91 0.00 0.00 33.84 31.02 2oye n VAL 228 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2oye n ASP 229 N 1.24 0.60 -0.97 4.52 5.75 -1.26 -4.82 116.55 121.62 2oye n ASP 229 Ca 0.27 -0.18 -0.09 0.00 -0.01 0.00 0.00 54.79 54.77 2oye n ASP 229 Cb 0.33 0.40 -0.01 0.00 -1.03 0.00 0.00 41.12 40.82 2oye n ASP 229 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2oye n LEU 230 N -1.77 -1.29 -0.91 -2.12 4.32 -1.26 -4.89 117.00 109.08 2oye n LEU 230 Ca 0.04 0.03 0.00 0.00 -0.02 0.00 0.00 56.01 56.06 2oye n LEU 230 Cb 0.39 -1.54 0.00 0.00 -1.62 0.00 0.00 43.42 40.65 2oye n LEU 230 CO 0.37 -0.15 0.25 0.61 -1.22 0.00 0.00 177.39 177.25 2oye n GLY 231 N -1.14 1.05 0.00 -0.72 0.00 -1.26 -0.71 105.19 102.40 2oye n GLY 231 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2oye n GLY 231 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2oye n HIS 232 N 0.64 0.00 0.00 1.61 1.44 -1.26 -3.33 115.22 114.32 2oye n HIS 232 Ca 0.00 -0.24 0.00 0.00 -2.01 0.00 0.00 57.72 55.47 2oye n HIS 232 Cb 0.25 -0.02 0.00 0.00 0.12 0.00 0.00 29.99 30.34 2oye n HIS 232 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 2oye n ILE 233 N -0.24 0.00 0.59 0.61 5.41 0.11 -3.58 119.36 122.26 2oye n ILE 233 Ca 0.00 0.00 0.01 0.00 1.00 0.00 0.00 62.75 63.76 2oye n ILE 233 Cb 0.24 -0.45 0.07 0.00 -0.71 0.00 0.00 39.64 38.79 2oye n ILE 233 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 2oye n TYR 234 N -1.33 0.00 -0.56 1.39 4.01 -1.09 -3.68 117.16 115.90 2oye n TYR 234 Ca 0.00 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.81 2oye n TYR 234 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 38.99 2oye n TYR 234 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2oye n GLY 235 N -0.26 -2.93 1.41 2.72 0.00 -1.25 -3.93 105.19 100.94 2oye n GLY 235 Ca 0.02 -1.29 0.09 0.00 0.00 0.00 0.00 46.02 44.84 2oye n GLY 235 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2oye n ASP 236 N -2.89 4.13 -3.91 1.61 5.68 -1.21 -4.53 116.55 115.44 2oye n ASP 236 Ca -0.04 -2.30 -0.10 0.00 -0.50 0.00 0.00 54.79 51.85 2oye n ASP 236 Cb 0.26 -0.52 -0.09 0.00 -1.14 0.00 0.00 41.12 39.63 2oye n ASP 236 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2oye s ASN 237 N -0.88 0.13 0.32 -1.12 4.22 -1.26 -4.88 114.94 111.47 2oye s ASN 237 Ca 0.45 -0.44 0.04 0.00 -2.14 0.00 0.00 52.86 50.78 2oye s ASN 237 Cb 0.28 0.22 0.54 0.00 1.28 0.00 0.00 41.25 43.57 2oye s ASN 237 CO 0.24 -0.47 1.82 0.25 -2.04 0.00 0.00 177.10 176.90 2oye h LEU 238 N 3.85 0.46 0.83 3.54 5.85 -1.93 -2.78 115.31 125.14 2oye h LEU 238 Ca -0.32 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.25 2oye h LEU 238 Cb 1.19 -0.12 0.01 0.00 0.37 0.00 0.00 40.66 42.10 2oye h LEU 238 CO 0.47 0.61 -0.40 -0.33 -0.34 0.00 0.00 178.44 178.46 2oye h GLU 239 N 0.45 -1.07 -1.13 1.25 3.07 -1.97 -0.90 114.58 114.28 2oye h GLU 239 Ca 0.08 0.07 0.31 0.00 -0.50 0.00 0.00 59.36 59.33 2oye h GLU 239 Cb 0.47 0.24 -0.09 0.00 -0.84 0.00 0.00 28.75 28.53 2oye h GLU 239 CO 0.03 -0.70 0.75 -0.09 -1.40 0.00 0.00 179.01 177.59 2oye h ARG 240 N -1.26 0.24 0.06 2.33 2.43 -1.91 1.53 114.38 117.80 2oye h ARG 240 Ca -0.11 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.04 2oye h ARG 240 Cb 0.86 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 2oye h ARG 240 CO 0.19 0.16 -0.03 0.37 -1.51 0.00 0.00 179.97 179.14 2oye h GLN 241 N 0.24 -0.08 0.00 0.20 4.15 -1.20 0.04 115.11 118.47 2oye h GLN 241 Ca 0.62 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 60.04 2oye h GLN 241 Cb 1.87 0.02 -0.00 0.00 0.21 0.00 0.00 27.48 29.58 2oye h GLN 241 CO -0.24 0.26 -0.03 1.88 -1.93 0.00 0.00 178.83 178.78 2oye h TYR 242 N -0.42 0.00 -0.00 3.99 0.99 0.30 1.53 116.97 123.36 2oye h TYR 242 Ca -0.01 0.00 -0.27 0.00 2.00 0.00 0.00 58.73 60.45 2oye h TYR 242 Cb 0.38 0.00 0.02 0.00 1.00 0.00 0.00 36.73 38.13 2oye h TYR 242 CO 0.04 0.03 -1.04 1.96 -0.00 0.00 0.00 178.16 179.15 2oye h GLN 243 N 0.00 0.71 0.00 4.88 7.50 0.17 -3.23 115.11 125.13 2oye h GLN 243 Ca -0.00 -0.76 -0.16 0.00 0.50 0.00 0.00 58.65 58.23 2oye h GLN 243 Cb 0.08 0.21 -0.03 0.00 0.05 0.00 0.00 27.48 27.80 2oye h GLN 243 CO 0.00 1.33 -1.03 -0.07 -1.50 0.00 0.00 178.83 177.56 2oye h LEU 244 N 0.40 0.00 -9.36 1.46 3.38 -0.02 -3.43 115.31 107.74 2oye h LEU 244 Ca -0.13 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.30 2oye h LEU 244 Cb 1.69 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.44 2oye h LEU 244 CO 0.21 0.63 0.86 -0.13 0.09 0.00 0.00 178.44 180.09 2oye s ARG 245 N -2.89 4.27 -0.25 1.13 0.52 0.51 -1.50 118.95 120.75 2oye s ARG 245 Ca 0.00 1.98 0.06 0.00 -0.52 0.00 0.00 55.73 57.25 2oye s ARG 245 Cb 0.08 -3.61 0.52 0.00 0.52 0.00 0.00 34.95 32.46 2oye s ARG 245 CO 0.79 -0.61 1.53 -0.11 0.02 0.00 0.00 175.30 176.92 2oye n LEU 246 N 5.54 5.06 -1.57 2.53 0.00 -1.15 -4.78 117.00 122.63 2oye n LEU 246 Ca 0.14 -2.64 0.00 0.00 0.00 0.00 0.00 56.01 53.51 2oye n LEU 246 Cb 0.43 -0.69 0.00 0.00 0.00 0.00 0.00 43.42 43.16 2oye n LEU 246 CO 0.59 0.72 0.00 0.49 0.00 0.00 0.00 177.39 179.19 2oye n PHE 247 N -0.17 0.00 -3.70 1.96 3.01 -1.26 -4.85 117.46 112.44 2oye n PHE 247 Ca 0.32 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.67 2oye n PHE 247 Cb 1.15 0.00 -0.12 0.00 -0.01 0.00 0.00 39.48 40.50 2oye n PHE 247 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 2oye s LYS 248 N -1.57 0.28 -1.31 -1.08 3.01 -1.26 -4.86 119.74 112.95 2oye s LYS 248 Ca 0.00 0.72 0.00 0.00 -1.01 0.00 0.00 55.97 55.68 2oye s LYS 248 Cb 0.00 -0.02 0.00 0.00 -1.01 0.00 0.00 37.83 36.80 2oye s LYS 248 CO 0.00 -0.19 0.00 -0.25 0.51 0.00 0.00 175.35 175.42 2oye n ASP 249 N 4.54 -4.08 0.00 2.83 8.00 -1.26 -2.14 116.55 124.45 2oye n ASP 249 Ca -0.20 0.22 0.00 0.00 0.71 0.00 0.00 54.79 55.53 2oye n ASP 249 Cb 0.53 -3.56 0.00 0.00 -0.02 0.00 0.00 41.12 38.07 2oye n ASP 249 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2oye n GLY 250 N -0.63 1.24 2.38 0.44 0.00 -1.26 -4.80 105.19 102.57 2oye n GLY 250 Ca -0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 2oye n GLY 250 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2oye n LYS 251 N -1.99 -3.82 -4.37 1.61 5.02 -0.91 -4.37 118.16 109.33 2oye n LYS 251 Ca 0.00 -1.12 -0.27 0.00 -2.02 0.00 0.00 58.31 54.90 2oye n LYS 251 Cb 0.00 -1.35 -0.13 0.00 -0.02 0.00 0.00 35.03 33.53 2oye n LYS 251 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2oye s LEU 252 N 0.00 2.34 0.93 -0.35 1.02 -1.26 -2.94 118.68 118.43 2oye s LEU 252 Ca 0.50 -0.76 -0.11 0.00 0.02 0.00 0.00 54.13 53.78 2oye s LEU 252 Cb -0.08 -1.12 0.14 0.00 0.02 0.00 0.00 46.19 45.15 2oye s LEU 252 CO 0.41 0.13 1.03 0.29 0.02 0.00 0.00 176.35 178.23 2oye n LYS 253 N 0.80 -0.52 0.00 1.70 5.02 -0.56 -4.73 118.16 119.86 2oye n LYS 253 Ca -0.17 -0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.03 2oye n LYS 253 Cb 0.54 -2.29 0.00 0.00 -0.02 0.00 0.00 35.03 33.26 2oye n LYS 253 CO 0.00 0.00 0.00 2.48 -0.52 0.00 0.00 177.40 179.36 2oye n TYR 254 N -4.20 0.00 -4.41 2.13 0.18 -1.26 -4.07 117.16 105.53 2oye n TYR 254 Ca 0.11 0.00 -0.25 0.00 1.88 0.00 0.00 57.90 59.64 2oye n TYR 254 Cb 0.52 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.38 2oye n TYR 254 CO 0.00 0.00 0.00 1.14 -2.08 0.00 0.00 176.86 175.92 2oye s GLN 255 N -2.00 1.75 -0.81 -3.48 -2.07 -0.98 -4.71 119.66 107.35 2oye s GLN 255 Ca 0.00 -1.60 -0.06 0.00 -1.82 0.00 0.00 55.36 51.88 2oye s GLN 255 Cb 0.00 -1.88 0.21 0.00 -1.09 0.00 0.00 33.01 30.24 2oye s GLN 255 CO 0.00 0.37 0.70 -1.64 -1.32 0.00 0.00 175.29 173.39 2oye s MET 256 N -3.19 3.23 -0.32 9.60 -1.94 -1.26 -2.08 119.30 123.34 2oye s MET 256 Ca 0.27 -2.80 -0.13 0.00 -1.71 0.00 0.00 55.69 51.32 2oye s MET 256 Cb -0.06 -4.08 -0.03 0.00 2.01 0.00 0.00 34.83 32.67 2oye s MET 256 CO 0.14 -1.24 0.26 -0.51 -0.01 0.00 0.00 175.02 173.66 2oye s LEU 257 N -0.49 4.35 0.00 -0.03 1.43 -0.66 -4.19 118.68 119.08 2oye s LEU 257 Ca 0.22 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 53.08 2oye s LEU 257 Cb -0.13 -2.19 0.00 0.00 0.03 0.00 0.00 46.19 43.90 2oye s LEU 257 CO -0.08 -0.20 0.00 0.59 0.23 0.00 0.00 176.35 176.89 2oye n ASN 258 N 5.16 0.00 0.00 2.29 3.02 -1.26 -1.75 115.26 122.72 2oye n ASN 258 Ca -0.12 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.43 2oye n ASN 258 Cb 0.50 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.24 2oye n ASN 258 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2oye n GLY 259 N -2.00 0.42 3.88 7.41 0.00 -1.26 -5.07 105.19 108.57 2oye n GLY 259 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2oye n GLY 259 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2oye s GLU 260 N -0.84 3.68 -0.02 1.61 1.03 -0.72 -5.03 118.70 118.42 2oye s GLU 260 Ca 0.00 0.04 -0.19 0.00 0.03 0.00 0.00 54.97 54.85 2oye s GLU 260 Cb 0.00 -2.88 -0.05 0.00 -0.80 0.00 0.00 34.13 30.39 2oye s GLU 260 CO 0.00 0.49 0.55 0.08 -1.33 0.00 0.00 175.26 175.05 2oye s VAL 261 N -1.57 4.96 0.26 1.83 1.01 -1.26 -1.66 120.40 123.96 2oye s VAL 261 Ca 0.38 1.14 -0.00 0.00 0.00 0.00 0.00 61.98 63.50 2oye s VAL 261 Cb -0.13 -3.88 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 2oye s VAL 261 CO 0.22 0.43 0.25 -0.31 0.00 0.00 0.00 175.10 175.69 2oye s TYR 262 N -0.23 1.21 0.47 5.22 1.51 -0.88 -4.95 117.35 119.69 2oye s TYR 262 Ca 0.29 -1.37 -0.24 0.00 -1.01 0.00 0.00 57.07 54.75 2oye s TYR 262 Cb -0.18 -0.46 -0.07 0.00 -0.11 0.00 0.00 41.96 41.15 2oye s TYR 262 CO 0.16 -0.80 1.30 -2.14 -1.11 0.00 0.00 175.55 172.96 2oye s PRO 263 N -3.83 3.63 0.67 -1.71 0.02 -1.26 -2.32 135.00 130.19 2oye s PRO 263 Ca 0.37 2.13 -0.15 0.00 0.02 0.00 0.00 61.00 63.36 2oye s PRO 263 Cb 0.04 -2.51 0.00 0.00 0.02 0.00 0.00 34.50 32.05 2oye s PRO 263 CO 0.17 -0.76 1.12 -1.25 -0.33 0.00 0.00 177.00 175.94 2oye s PRO 264 N -2.57 2.74 0.66 5.54 0.04 -1.26 -4.22 135.00 135.93 2oye s PRO 264 Ca 0.63 1.41 -0.11 0.00 0.04 0.00 0.00 61.00 62.97 2oye s PRO 264 Cb -0.37 -1.94 -0.01 0.00 0.04 0.00 0.00 34.50 32.22 2oye s PRO 264 CO 0.46 -1.30 1.06 -1.54 0.04 0.00 0.00 177.00 175.72 2oye s SER 265 N -2.56 5.77 0.63 6.66 1.04 -1.26 0.14 113.70 124.11 2oye s SER 265 Ca 0.67 1.22 0.39 0.00 0.48 0.00 0.00 55.95 58.71 2oye s SER 265 Cb -0.21 -2.13 2.14 0.00 0.10 0.00 0.00 66.02 65.91 2oye s SER 265 CO 0.42 -1.14 2.30 0.58 0.98 0.00 0.00 173.24 176.39 2oye h VAL 266 N -0.49 0.20 0.00 5.02 2.07 -1.31 -1.69 116.25 120.06 2oye h VAL 266 Ca -0.45 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.01 2oye h VAL 266 Cb 1.23 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 2oye h VAL 266 CO 0.63 0.01 0.00 -0.62 0.02 0.00 0.00 177.57 177.61 2oye n GLU 267 N -3.36 0.55 0.00 1.57 4.71 -1.26 -2.51 120.64 120.34 2oye n GLU 267 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.12 2oye n GLU 267 Cb 0.10 -1.25 0.00 0.00 -1.01 0.00 0.00 31.44 29.27 2oye n GLU 267 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 2oye n GLU 268 N 0.43 0.00 -3.82 3.49 2.13 -0.93 -4.99 120.64 116.95 2oye n GLU 268 Ca 0.00 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 57.53 2oye n GLU 268 Cb 0.19 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 31.80 2oye n GLU 268 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2oye n ALA 269 N -0.24 3.54 0.00 4.31 0.00 -0.68 -4.98 120.51 122.46 2oye n ALA 269 Ca 0.00 -4.57 0.00 0.00 0.00 0.00 0.00 53.44 48.87 2oye n ALA 269 Cb 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.32 2oye n ALA 269 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2oye n PRO 270 N 1.92 0.00 -4.21 0.00 -0.04 -1.16 -4.24 135.00 127.27 2oye n PRO 270 Ca 0.21 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.36 2oye n PRO 270 Cb 0.36 -1.22 -0.09 0.00 -0.04 0.00 0.00 33.50 32.51 2oye n PRO 270 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2oye s VAL 271 N 1.60 3.88 0.61 0.52 0.11 -1.26 -5.07 120.40 120.79 2oye s VAL 271 Ca 0.00 -0.95 -0.19 0.00 -2.93 0.00 0.00 61.98 57.91 2oye s VAL 271 Cb 0.00 -2.81 -0.03 0.00 -1.53 0.00 0.00 36.38 32.02 2oye s VAL 271 CO 0.00 0.19 1.30 -0.22 -3.33 0.00 0.00 175.10 173.04 2oye s LEU 272 N -2.07 3.67 0.00 2.54 2.96 -1.26 -4.92 118.68 119.60 2oye s LEU 272 Ca 0.23 2.64 0.00 0.00 -0.22 0.00 0.00 54.13 56.78 2oye s LEU 272 Cb -0.11 -4.51 0.00 0.00 0.50 0.00 0.00 46.19 42.06 2oye s LEU 272 CO 0.15 -1.83 0.00 0.23 -1.32 0.00 0.00 176.35 173.58 2oye n MET 273 N -1.60 0.00 -0.28 1.98 2.81 -1.26 -4.64 117.12 114.13 2oye n MET 273 Ca 0.14 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.03 2oye n MET 273 Cb 0.47 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.98 2oye n MET 273 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 2oye n HIS 274 N 0.00 0.00 -1.62 2.03 8.25 -1.14 -4.91 115.22 117.83 2oye n HIS 274 Ca 0.00 0.00 -0.45 0.00 -0.26 0.00 0.00 57.72 57.01 2oye n HIS 274 Cb 0.00 0.10 -0.02 0.00 1.12 0.00 0.00 29.99 31.18 2oye n HIS 274 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2oye n TYR 275 N 0.00 1.59 -2.04 4.41 4.01 -1.26 -4.90 117.16 118.97 2oye n TYR 275 Ca 0.00 0.62 -0.37 0.00 -0.16 0.00 0.00 57.90 57.99 2oye n TYR 275 Cb 0.55 -2.32 0.02 0.00 -0.31 0.00 0.00 39.34 37.28 2oye n TYR 275 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2oye s PRO 276 N -1.03 3.24 0.00 -0.72 0.04 -1.26 -4.76 135.00 130.51 2oye s PRO 276 Ca 0.64 1.90 -0.06 0.00 0.04 0.00 0.00 61.00 63.51 2oye s PRO 276 Cb -0.71 -2.14 -0.08 0.00 0.04 0.00 0.00 34.50 31.61 2oye s PRO 276 CO 0.56 -1.01 0.66 0.54 0.04 0.00 0.00 177.00 177.79 2oye n ARG 277 N -1.15 0.00 0.00 4.56 1.74 -1.26 -4.41 116.66 116.14 2oye n ARG 277 Ca 0.11 -0.24 0.00 0.00 -0.77 0.00 0.00 57.85 56.96 2oye n ARG 277 Cb 0.48 -1.37 0.00 0.00 -1.02 0.00 0.00 32.46 30.55 2oye n ARG 277 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2oye n GLY 278 N 3.65 0.19 2.54 -0.13 0.00 -1.26 -5.04 105.19 105.14 2oye n GLY 278 Ca 0.09 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.90 2oye n GLY 278 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2oye n ILE 279 N -0.86 1.36 0.28 -0.61 5.41 -1.26 -4.94 119.36 118.74 2oye n ILE 279 Ca 0.00 -4.86 0.00 0.00 1.00 0.00 0.00 62.75 58.89 2oye n ILE 279 Cb 0.00 -0.69 0.00 0.00 -0.71 0.00 0.00 39.64 38.24 2oye n ILE 279 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2oye n PRO 280 N -0.01 0.03 0.00 0.38 -0.02 -1.26 -3.64 135.00 130.48 2oye n PRO 280 Ca 0.27 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.55 2oye n PRO 280 Cb 0.57 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 2oye n PRO 280 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2oye n PRO 281 N -2.20 0.00 -1.66 0.52 -0.02 -1.26 -4.45 135.00 125.93 2oye n PRO 281 Ca 0.00 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.17 2oye n PRO 281 Cb 0.85 0.00 0.04 0.00 -0.02 0.00 0.00 33.50 34.37 2oye n PRO 281 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 2oye s GLN 282 N 0.00 3.12 0.00 -0.52 1.03 -1.24 -3.13 119.66 118.92 2oye s GLN 282 Ca 0.00 0.90 0.00 0.00 0.04 0.00 0.00 55.36 56.30 2oye s GLN 282 Cb 0.00 -2.01 0.00 0.00 0.03 0.00 0.00 33.01 31.03 2oye s GLN 282 CO 0.00 -0.95 0.00 0.43 -2.54 0.00 0.00 175.29 172.23 2oye n SER 283 N -3.02 0.00 -4.13 12.60 7.64 -1.26 -4.86 113.62 120.59 2oye n SER 283 Ca 0.07 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.58 2oye n SER 283 Cb 0.54 -0.34 -0.06 0.00 -1.01 0.00 0.00 64.21 63.33 2oye n SER 283 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 2oye s GLN 284 N -0.07 3.24 0.38 1.43 -0.44 -1.18 -4.90 119.66 118.12 2oye s GLN 284 Ca 0.00 -3.12 -0.14 0.00 -2.50 0.00 0.00 55.36 49.60 2oye s GLN 284 Cb 0.00 -3.98 -0.08 0.00 -1.64 0.00 0.00 33.01 27.31 2oye s GLN 284 CO 0.00 -1.25 0.80 -1.64 0.50 0.00 0.00 175.29 173.70 2oye s MET 285 N -1.07 3.94 -0.16 1.67 -1.94 -1.26 -1.15 119.30 119.33 2oye s MET 285 Ca 0.26 0.68 -0.08 0.00 -1.71 0.00 0.00 55.69 54.83 2oye s MET 285 Cb -0.10 -2.36 -0.04 0.00 2.01 0.00 0.00 34.83 34.34 2oye s MET 285 CO -0.11 0.02 0.12 0.00 -0.01 0.00 0.00 175.02 175.05 2oye s ALA 286 N -2.21 3.73 0.00 3.03 0.00 0.37 -4.75 121.76 121.94 2oye s ALA 286 Ca 0.55 -0.68 0.00 0.00 0.00 0.00 0.00 51.96 51.83 2oye s ALA 286 Cb -0.10 -2.04 0.00 0.00 0.00 0.00 0.00 23.12 20.98 2oye s ALA 286 CO 0.23 0.37 0.00 1.33 0.00 0.00 0.00 175.76 177.69 2oye n VAL 287 N 2.82 0.00 0.00 0.00 0.24 -1.26 -4.09 118.33 116.04 2oye n VAL 287 Ca -0.18 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 2oye n VAL 287 Cb 0.53 -0.27 0.00 0.00 -1.47 0.00 0.00 33.84 32.63 2oye n VAL 287 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2oye n GLY 288 N 1.96 1.66 2.88 7.63 0.00 -1.24 -4.35 105.19 113.74 2oye n GLY 288 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2oye n GLY 288 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2oye s GLN 289 N 0.00 1.45 0.23 1.61 -0.44 -1.23 -3.96 119.66 117.31 2oye s GLN 289 Ca 0.00 -1.98 0.13 0.00 -2.50 0.00 0.00 55.36 51.01 2oye s GLN 289 Cb 0.00 -2.84 0.83 0.00 -1.64 0.00 0.00 33.01 29.35 2oye s GLN 289 CO 0.00 -1.04 0.97 0.39 0.50 0.00 0.00 175.29 176.10 2oye n GLU 290 N 3.87 -0.04 0.00 1.67 4.71 -1.26 -0.16 120.64 129.43 2oye n GLU 290 Ca 0.04 0.84 0.14 0.00 -0.01 0.00 0.00 57.16 58.17 2oye n GLU 290 Cb 0.37 -1.52 0.56 0.00 -1.01 0.00 0.00 31.44 29.85 2oye n GLU 290 CO 0.00 0.00 0.00 1.55 0.09 0.00 0.00 177.13 178.77 2oye n VAL 291 N -4.37 0.00 0.81 2.62 3.14 -1.26 -2.91 118.33 116.37 2oye n VAL 291 Ca 0.23 -0.05 0.04 0.00 -2.96 0.00 0.00 64.34 61.60 2oye n VAL 291 Cb 0.79 -0.09 0.24 0.00 -1.06 0.00 0.00 33.84 33.73 2oye n VAL 291 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86 2oye n PHE 292 N -1.07 0.00 0.06 1.45 3.01 0.77 -2.35 117.46 119.32 2oye n PHE 292 Ca 0.12 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.40 2oye n PHE 292 Cb 0.29 0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 39.62 2oye n PHE 292 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2oye h GLY 293 N 2.19 0.32 -0.35 1.37 0.00 -1.81 -3.19 103.07 101.60 2oye h GLY 293 Ca 0.00 -0.82 0.32 0.00 0.00 0.00 0.00 47.33 46.83 2oye h GLY 293 CO 0.00 0.71 0.78 1.41 0.00 0.00 0.00 176.54 179.44 2oye h LEU 294 N 0.08 0.22 -7.97 3.11 3.38 -1.80 -3.42 115.31 108.91 2oye h LEU 294 Ca -0.29 0.05 -0.37 0.00 0.09 0.00 0.00 57.88 57.36 2oye h LEU 294 Cb 2.04 0.02 -0.29 0.00 0.09 0.00 0.00 40.66 42.52 2oye h LEU 294 CO 0.16 0.02 -0.77 -0.76 0.09 0.00 0.00 178.44 177.18 2oye s LEU 295 N -9.01 1.97 0.50 1.67 1.02 -1.26 0.15 118.68 113.72 2oye s LEU 295 Ca -0.07 -0.13 0.19 0.00 0.02 0.00 0.00 54.13 54.14 2oye s LEU 295 Cb 0.25 -0.39 1.25 0.00 0.02 0.00 0.00 46.19 47.32 2oye s LEU 295 CO 0.80 0.08 2.03 -0.65 0.02 0.00 0.00 176.35 178.64 2oye h PRO 296 N 6.04 0.12 -0.34 1.29 0.11 -1.80 -2.91 132.00 134.51 2oye h PRO 296 Ca -0.30 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.78 2oye h PRO 296 Cb 1.18 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2oye h PRO 296 CO 0.50 0.08 0.12 0.78 -0.21 0.00 0.00 178.00 179.27 2oye h GLY 297 N 0.13 0.56 0.66 -0.55 0.00 -1.96 0.90 103.07 102.81 2oye h GLY 297 Ca 0.20 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 2oye h GLY 297 CO -0.02 0.30 -0.01 1.41 0.00 0.00 0.00 176.54 178.22 2oye h LEU 298 N 0.40 0.05 -1.25 3.11 4.07 -1.81 -0.97 115.31 118.91 2oye h LEU 298 Ca 0.11 -0.36 0.06 0.00 0.08 0.00 0.00 57.88 57.78 2oye h LEU 298 Cb 0.21 -0.01 -0.05 0.00 1.08 0.00 0.00 40.66 41.89 2oye h LEU 298 CO -0.01 0.40 0.54 -0.03 -1.08 0.00 0.00 178.44 178.26 2oye h MET 299 N -0.30 0.89 0.45 1.13 4.05 -1.51 0.39 114.93 120.03 2oye h MET 299 Ca 0.01 -0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.36 2oye h MET 299 Cb 0.37 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 30.95 2oye h MET 299 CO 0.00 0.59 -0.50 1.25 0.23 0.00 0.00 176.91 178.48 2oye h LEU 300 N 0.91 -1.38 -0.39 3.39 5.85 -0.46 -0.12 115.31 123.12 2oye h LEU 300 Ca 0.35 0.12 0.01 0.00 0.84 0.00 0.00 57.88 59.20 2oye h LEU 300 Cb 0.21 0.46 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 2oye h LEU 300 CO -0.12 -0.65 0.24 1.88 -0.34 0.00 0.00 178.44 179.45 2oye h TYR 301 N -0.97 0.45 -0.95 1.25 0.05 0.10 -1.79 116.97 115.12 2oye h TYR 301 Ca -0.05 0.01 0.18 0.00 0.05 0.00 0.00 58.73 58.92 2oye h TYR 301 Cb 0.85 -0.15 -0.08 0.00 1.01 0.00 0.00 36.73 38.36 2oye h TYR 301 CO -0.27 0.27 0.60 0.00 -1.05 0.00 0.00 178.16 177.71 2oye h ALA 302 N 1.16 1.87 -0.19 3.88 0.00 -0.03 0.39 119.26 126.34 2oye h ALA 302 Ca 0.15 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2oye h ALA 302 Cb -0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2oye h ALA 302 CO -0.06 -0.17 0.00 1.15 0.00 0.00 0.00 179.25 180.18 2oye h THR 303 N 0.66 1.25 -0.27 0.00 2.02 -0.29 0.13 112.91 116.41 2oye h THR 303 Ca 0.51 -0.84 0.02 0.00 0.77 0.00 0.00 66.41 66.87 2oye h THR 303 Cb 0.91 1.44 -0.03 0.00 -1.74 0.00 0.00 68.15 68.74 2oye h THR 303 CO -0.26 0.26 0.11 0.40 0.37 0.00 0.00 175.52 176.39 2oye h ILE 304 N 0.08 0.96 0.11 3.11 2.04 -0.25 0.41 117.51 123.97 2oye h ILE 304 Ca 0.05 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 2oye h ILE 304 Cb 0.38 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 37.15 2oye h ILE 304 CO 0.01 0.04 -0.05 -0.50 0.00 0.00 0.00 178.15 177.65 2oye h TRP 305 N 0.25 -0.13 -0.71 1.37 -0.00 -0.95 -0.41 115.95 115.37 2oye h TRP 305 Ca 0.12 -0.00 0.07 0.00 -0.00 0.00 0.00 58.89 59.07 2oye h TRP 305 Cb 0.06 0.04 -0.06 0.00 -0.00 0.00 0.00 29.16 29.21 2oye h TRP 305 CO -0.11 0.16 0.39 1.25 -0.00 0.00 0.00 178.44 180.12 2oye h LEU 306 N -0.42 0.57 -1.58 -4.49 6.46 -0.54 0.40 115.31 115.71 2oye h LEU 306 Ca -0.01 0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.78 2oye h LEU 306 Cb 0.35 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 40.20 2oye h LEU 306 CO 0.02 0.36 0.00 -0.09 -0.62 0.00 0.00 178.44 178.11 2oye h ARG 307 N 0.71 0.00 0.00 1.25 2.43 -0.09 -2.89 114.38 115.79 2oye h ARG 307 Ca 0.32 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.49 2oye h ARG 307 Cb 0.23 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.78 2oye h ARG 307 CO -0.20 0.00 -0.02 1.49 -1.51 0.00 0.00 179.97 179.72 2oye h GLU 308 N 0.00 0.00 -0.09 0.20 4.57 0.13 -3.15 114.58 116.24 2oye h GLU 308 Ca 0.00 0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.22 2oye h GLU 308 Cb 0.47 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.00 2oye h GLU 308 CO 0.00 0.80 -0.41 1.25 -1.18 0.00 0.00 179.01 179.47 2oye h HIS 309 N -1.00 -1.17 -0.31 0.92 2.76 -0.34 0.32 115.15 116.33 2oye h HIS 309 Ca -0.01 0.04 0.09 0.00 -2.20 0.00 0.00 60.37 58.30 2oye h HIS 309 Cb 0.81 0.53 -0.01 0.00 1.55 0.00 0.00 27.41 30.28 2oye h HIS 309 CO 0.22 -0.48 0.29 -0.91 -1.30 0.00 0.00 177.93 175.75 2oye h ASN 310 N -0.51 0.00 0.13 3.26 4.21 -1.68 0.15 115.58 121.14 2oye h ASN 310 Ca 0.07 0.00 -0.21 0.00 1.21 0.00 0.00 56.30 57.36 2oye h ASN 310 Cb 0.63 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.83 2oye h ASN 310 CO -0.37 0.00 -0.82 -0.09 -1.29 0.00 0.00 177.43 174.86 2oye h ARG 311 N 0.00 0.55 -0.30 0.81 2.43 -0.46 -2.92 114.38 114.50 2oye h ARG 311 Ca 0.15 -0.50 -0.13 0.00 -0.81 0.00 0.00 59.98 58.70 2oye h ARG 311 Cb 0.72 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.37 2oye h ARG 311 CO -0.00 1.12 -0.34 0.28 -1.51 0.00 0.00 179.97 179.52 2oye h VAL 312 N 0.36 1.29 -0.53 0.20 2.07 0.19 -3.08 116.25 116.74 2oye h VAL 312 Ca -0.06 -1.48 0.03 0.00 0.82 0.00 0.00 66.70 66.01 2oye h VAL 312 Cb 1.44 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 32.60 2oye h VAL 312 CO 0.15 0.48 0.32 0.00 0.02 0.00 0.00 177.57 178.54 2oye h ASP 314 N 0.63 -0.74 -0.39 0.00 3.45 -1.42 -1.46 116.42 116.49 2oye h ASP 314 Ca 0.22 0.11 0.08 0.00 0.43 0.00 0.00 57.03 57.86 2oye h ASP 314 Cb 0.04 0.32 -0.07 0.00 -0.56 0.00 0.00 39.33 39.05 2oye h ASP 314 CO -0.10 -0.30 -0.05 -0.07 -1.57 0.00 0.00 179.24 177.15 2oye h LEU 315 N -0.34 -0.26 0.08 1.55 3.38 -1.47 -2.79 115.31 115.46 2oye h LEU 315 Ca 0.08 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2oye h LEU 315 Cb 0.46 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 2oye h LEU 315 CO -0.27 -0.09 -0.08 -0.07 0.09 0.00 0.00 178.44 178.02 2oye h LEU 316 N 0.05 -0.22 -1.94 1.67 3.38 -1.10 -2.33 115.31 114.82 2oye h LEU 316 Ca 0.19 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.28 2oye h LEU 316 Cb 0.28 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2oye h LEU 316 CO -0.36 -0.13 0.45 0.11 0.09 0.00 0.00 178.44 178.60 2oye h LYS 317 N -0.18 0.00 0.03 1.13 1.57 -1.02 0.70 116.57 118.80 2oye h LYS 317 Ca 0.01 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.55 2oye h LYS 317 Cb 0.18 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 2oye h LYS 317 CO -0.03 0.00 -1.19 0.00 -0.57 0.00 0.00 179.45 177.66 2oye h ALA 318 N 1.43 0.36 0.15 3.86 0.00 -1.17 -3.14 119.26 120.74 2oye h ALA 318 Ca 0.17 -1.00 -0.28 0.00 0.00 0.00 0.00 54.91 53.80 2oye h ALA 318 Cb 1.06 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.85 2oye h ALA 318 CO -0.00 1.24 -1.37 1.49 0.00 0.00 0.00 179.25 180.61 2oye h GLU 319 N 0.02 0.31 -2.49 0.00 4.57 0.27 -3.40 114.58 113.87 2oye h GLU 319 Ca -0.09 -0.53 -0.60 0.00 -1.18 0.00 0.00 59.36 56.96 2oye h GLU 319 Cb 1.86 0.20 -0.42 0.00 -0.16 0.00 0.00 28.75 30.23 2oye h GLU 319 CO 0.14 1.25 -0.63 0.72 -1.18 0.00 0.00 179.01 179.32 2oye n HIS 320 N -3.88 3.15 0.30 0.92 8.25 0.19 -4.91 115.22 119.23 2oye n HIS 320 Ca -0.22 -4.15 0.16 0.00 -0.26 0.00 0.00 57.72 53.25 2oye n HIS 320 Cb 0.94 -0.54 0.96 0.00 1.12 0.00 0.00 29.99 32.46 2oye n HIS 320 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2oye h PRO 321 N 4.62 0.00 0.00 -0.41 0.13 -1.76 -0.53 132.00 134.04 2oye h PRO 321 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2oye h PRO 321 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2oye h PRO 321 CO 0.76 0.01 -0.07 0.25 -0.23 0.00 0.00 178.00 178.72 2oye n THR 322 N -3.72 0.39 -0.64 1.56 -2.24 -1.26 -4.89 114.28 103.49 2oye n THR 322 Ca -0.03 -0.20 -0.31 0.00 -2.27 0.00 0.00 64.05 61.24 2oye n THR 322 Cb 0.09 -0.50 0.19 0.00 -2.10 0.00 0.00 70.33 68.01 2oye n THR 322 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 2oye n TRP 323 N -2.02 -1.02 -2.70 4.78 7.02 -0.21 -5.05 117.44 118.25 2oye n TRP 323 Ca 0.06 0.11 0.00 0.00 -1.02 0.00 0.00 57.50 56.65 2oye n TRP 323 Cb 0.40 -1.72 0.00 0.00 -2.42 0.00 0.00 31.31 27.57 2oye n TRP 323 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2oye n GLY 324 N 1.32 3.84 0.09 6.99 0.00 -1.26 -5.00 105.19 111.16 2oye n GLY 324 Ca 0.04 -2.07 -0.17 0.00 0.00 0.00 0.00 46.02 43.82 2oye n GLY 324 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2oye h ASP 325 N 0.00 0.06 -0.36 1.61 3.58 -1.95 -3.17 116.42 116.19 2oye h ASP 325 Ca 0.00 -0.86 0.07 0.00 0.42 0.00 0.00 57.03 56.66 2oye h ASP 325 Cb 0.00 -0.02 -0.09 0.00 1.72 0.00 0.00 39.33 40.94 2oye h ASP 325 CO 0.00 1.19 -0.37 -0.33 -2.88 0.00 0.00 179.24 176.85 2oye h GLU 326 N -0.91 -0.30 0.00 0.28 4.39 -1.97 -0.63 114.58 115.44 2oye h GLU 326 Ca -0.12 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.60 2oye h GLU 326 Cb 1.17 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 2oye h GLU 326 CO -0.04 -0.20 0.00 0.94 -1.16 0.00 0.00 179.01 178.55 2oye n GLN 327 N -5.42 0.00 -0.05 2.33 7.27 -1.26 -0.83 117.38 119.42 2oye n GLN 327 Ca -0.00 0.10 0.03 0.00 0.07 0.00 0.00 57.00 57.20 2oye n GLN 327 Cb 0.35 -0.97 0.06 0.00 2.41 0.00 0.00 30.24 32.09 2oye n GLN 327 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 2oye n LEU 328 N -0.57 0.01 0.00 1.69 4.77 -1.20 0.14 117.00 121.84 2oye n LEU 328 Ca 0.00 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 2oye n LEU 328 Cb 0.00 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 2oye n LEU 328 CO 0.00 -0.27 0.30 0.33 -1.33 0.00 0.00 177.39 176.42 2oye n PHE 329 N -3.69 0.00 -0.30 -1.77 7.35 -0.25 -2.55 117.46 116.26 2oye n PHE 329 Ca 0.05 0.00 0.11 0.00 -0.76 0.00 0.00 57.45 56.84 2oye n PHE 329 Cb 0.15 -0.47 0.25 0.00 0.35 0.00 0.00 39.48 39.75 2oye n PHE 329 CO 0.00 0.00 0.00 1.96 -0.76 0.00 0.00 176.76 177.96 2oye h GLN 330 N 0.00 0.11 -0.41 -4.13 1.08 0.33 0.49 115.11 112.58 2oye h GLN 330 Ca 0.00 -0.01 0.02 0.00 -1.45 0.00 0.00 58.65 57.21 2oye h GLN 330 Cb 0.00 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.38 2oye h GLN 330 CO 0.00 0.07 0.27 1.15 -0.95 0.00 0.00 178.83 179.38 2oye h THR 331 N 0.12 1.07 -0.01 -0.54 2.02 -1.10 -0.60 112.91 113.87 2oye h THR 331 Ca 0.52 -0.17 -0.20 0.00 0.77 0.00 0.00 66.41 67.33 2oye h THR 331 Cb 1.02 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 2oye h THR 331 CO -0.73 0.09 -0.85 0.00 0.37 0.00 0.00 175.52 174.40 2oye h ALA 332 N 1.75 0.53 -0.57 6.16 0.00 0.20 -2.34 119.26 125.00 2oye h ALA 332 Ca 0.16 -0.70 -0.09 0.00 0.00 0.00 0.00 54.91 54.28 2oye h ALA 332 Cb 0.01 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2oye h ALA 332 CO -0.04 0.87 0.01 -0.09 0.00 0.00 0.00 179.25 180.00 2oye h ARG 333 N 0.14 0.98 -0.33 0.00 2.43 0.20 -1.26 114.38 116.54 2oye h ARG 333 Ca -0.04 -0.29 -0.07 0.00 -0.81 0.00 0.00 59.98 58.77 2oye h ARG 333 Cb 1.46 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.90 2oye h ARG 333 CO 0.13 0.96 -0.05 -0.07 -1.51 0.00 0.00 179.97 179.43 2oye h LEU 334 N 0.90 0.62 -2.52 3.80 3.38 -1.26 -1.40 115.31 118.83 2oye h LEU 334 Ca 0.17 -0.35 0.01 0.00 0.09 0.00 0.00 57.88 57.80 2oye h LEU 334 Cb 0.52 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 2oye h LEU 334 CO 0.03 0.82 0.04 0.40 0.09 0.00 0.00 178.44 179.82 2oye h ILE 335 N 0.40 0.40 0.00 1.22 2.04 -1.00 -0.02 117.51 120.55 2oye h ILE 335 Ca 0.09 0.00 -0.21 0.00 1.00 0.00 0.00 64.86 65.73 2oye h ILE 335 Cb 0.54 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 2oye h ILE 335 CO 0.03 0.00 -1.54 0.18 0.00 0.00 0.00 178.15 176.82 2oye n LEU 336 N -3.67 0.84 0.15 1.44 4.77 -0.51 -2.26 117.00 117.75 2oye n LEU 336 Ca -0.02 0.38 -0.00 0.00 -0.03 0.00 0.00 56.01 56.33 2oye n LEU 336 Cb 0.12 0.11 0.24 0.00 -2.33 0.00 0.00 43.42 41.57 2oye n LEU 336 CO 0.26 0.23 0.59 0.40 -1.33 0.00 0.00 177.39 177.54 2oye h ILE 337 N 0.00 1.37 0.00 -0.08 2.04 -0.11 -1.78 117.51 118.95 2oye h ILE 337 Ca -0.21 -1.75 0.00 0.00 1.00 0.00 0.00 64.86 63.89 2oye h ILE 337 Cb 1.74 1.93 0.00 0.00 -0.74 0.00 0.00 36.82 39.74 2oye h ILE 337 CO 0.06 0.50 0.00 0.61 0.00 0.00 0.00 178.15 179.32 2oye n GLY 338 N -0.05 -1.23 0.65 5.37 0.00 -0.14 -2.48 105.19 107.31 2oye n GLY 338 Ca -0.02 0.00 0.50 0.00 0.00 0.00 0.00 46.02 46.50 2oye n GLY 338 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2oye n GLU 339 N -1.96 -0.01 0.03 1.61 1.02 -0.96 0.22 120.64 120.59 2oye n GLU 339 Ca 0.00 1.12 -0.11 0.00 -0.02 0.00 0.00 57.16 58.15 2oye n GLU 339 Cb 0.00 -2.47 -0.08 0.00 -0.02 0.00 0.00 31.44 28.87 2oye n GLU 339 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2oye h THR 340 N 0.00 0.95 -0.41 2.62 2.02 -1.38 -2.39 112.91 114.32 2oye h THR 340 Ca 0.92 -1.26 0.12 0.00 0.77 0.00 0.00 66.41 66.96 2oye h THR 340 Cb 3.51 1.63 -0.02 0.00 -1.74 0.00 0.00 68.15 71.53 2oye h THR 340 CO -0.13 0.26 0.30 0.40 0.37 0.00 0.00 175.52 176.72 2oye h ILE 341 N -0.85 0.77 0.48 3.11 2.04 0.09 0.19 117.51 123.34 2oye h ILE 341 Ca -0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 2oye h ILE 341 Cb 0.55 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 2oye h ILE 341 CO 0.03 0.00 -0.23 0.50 0.00 0.00 0.00 178.15 178.45 2oye h LYS 342 N 0.00 -0.62 -0.51 2.37 1.63 -1.14 -2.86 116.57 115.44 2oye h LYS 342 Ca 0.20 0.04 0.02 0.00 -0.85 0.00 0.00 60.65 60.06 2oye h LYS 342 Cb 0.80 0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 32.53 2oye h LYS 342 CO -0.00 -0.41 0.30 0.82 -3.45 0.00 0.00 179.45 176.71 2oye h ILE 343 N -1.05 1.05 -0.95 2.00 2.04 -0.95 -0.82 117.51 118.83 2oye h ILE 343 Ca -0.07 -0.21 0.12 0.00 1.00 0.00 0.00 64.86 65.71 2oye h ILE 343 Cb 0.49 0.39 -0.08 0.00 -0.74 0.00 0.00 36.82 36.88 2oye h ILE 343 CO 0.11 0.11 0.58 0.58 0.00 0.00 0.00 178.15 179.53 2oye h VAL 344 N 0.61 0.89 0.00 1.67 2.07 -0.75 -1.12 116.25 119.62 2oye h VAL 344 Ca 0.21 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 2oye h VAL 344 Cb 0.02 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 29.69 2oye h VAL 344 CO -0.09 0.16 -0.10 0.40 0.02 0.00 0.00 177.57 177.96 2oye h ILE 345 N 0.90 0.36 0.00 4.57 2.04 -1.20 -0.29 117.51 123.89 2oye h ILE 345 Ca 0.48 -1.28 0.00 0.00 1.00 0.00 0.00 64.86 65.05 2oye h ILE 345 Cb 0.50 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2oye h ILE 345 CO -0.28 0.12 0.00 -0.62 0.00 0.00 0.00 178.15 177.37 2oye n GLU 346 N -4.72 0.06 0.02 2.37 1.02 -0.36 -3.23 120.64 115.80 2oye n GLU 346 Ca -0.04 0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 2oye n GLU 346 Cb 0.14 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 2oye n GLU 346 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2oye n GLU 347 N -1.45 0.00 0.38 3.49 1.02 -0.53 -4.53 120.64 119.01 2oye n GLU 347 Ca 0.06 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 57.01 2oye n GLU 347 Cb 0.21 -0.25 -0.09 0.00 -0.02 0.00 0.00 31.44 31.29 2oye n GLU 347 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 2oye h TYR 348 N 0.00 -0.98 0.00 -0.32 3.20 -1.14 -1.43 116.97 116.30 2oye h TYR 348 Ca 0.00 -0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.72 2oye h TYR 348 Cb 0.39 0.34 -0.02 0.00 1.54 0.00 0.00 36.73 38.98 2oye h TYR 348 CO 0.00 -0.58 -0.62 0.28 -1.64 0.00 0.00 178.16 175.60 2oye h VAL 349 N -0.98 1.43 -0.59 1.81 2.07 -1.10 -2.41 116.25 116.49 2oye h VAL 349 Ca -0.09 -2.12 0.04 0.00 0.82 0.00 0.00 66.70 65.35 2oye h VAL 349 Cb 0.77 2.15 -0.04 0.00 -1.52 0.00 0.00 31.29 32.65 2oye h VAL 349 CO 0.12 0.60 0.34 -0.61 0.02 0.00 0.00 177.57 178.04 2oye h GLN 350 N 0.00 0.63 -0.14 1.57 5.75 -1.49 0.19 115.11 121.63 2oye h GLN 350 Ca -0.01 -0.04 -0.19 0.00 -0.15 0.00 0.00 58.65 58.26 2oye h GLN 350 Cb 1.10 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 29.51 2oye h GLN 350 CO 0.08 0.42 -0.70 0.37 -2.65 0.00 0.00 178.83 176.35 2oye h GLN 351 N 0.65 0.58 -0.26 1.69 5.75 -1.19 -3.08 115.11 119.25 2oye h GLN 351 Ca 0.25 -0.44 -0.14 0.00 -0.15 0.00 0.00 58.65 58.17 2oye h GLN 351 Cb 0.09 0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 2oye h GLN 351 CO -0.14 1.06 -0.42 1.25 -2.65 0.00 0.00 178.83 177.94 2oye h LEU 352 N 0.41 0.67 0.16 -2.39 5.85 -0.99 -3.31 115.31 115.70 2oye h LEU 352 Ca -0.03 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 2oye h LEU 352 Cb 1.28 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.13 2oye h LEU 352 CO 0.13 1.01 -0.08 0.77 -0.34 0.00 0.00 178.44 179.93 2oye h SER 353 N 0.51 -0.18 0.00 1.25 4.64 -0.63 -3.44 113.55 115.69 2oye h SER 353 Ca 0.04 -0.26 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 2oye h SER 353 Cb 0.95 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2oye h SER 353 CO 0.09 0.18 0.00 0.61 -0.87 0.00 0.00 176.83 176.84 2oye n GLY 354 N -0.21 0.62 3.80 -0.77 0.00 -1.17 -5.02 105.19 102.44 2oye n GLY 354 Ca -0.09 -0.38 -0.35 0.00 0.00 0.00 0.00 46.02 45.20 2oye n GLY 354 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2oye s TYR 355 N -2.00 3.33 -0.38 1.61 4.12 -1.26 -4.59 117.35 118.18 2oye s TYR 355 Ca 0.00 1.65 0.22 0.00 0.02 0.00 0.00 57.07 58.97 2oye s TYR 355 Cb 0.00 -2.97 -0.08 0.00 -1.52 0.00 0.00 41.96 37.39 2oye s TYR 355 CO 0.00 -0.28 0.88 1.19 0.02 0.00 0.00 175.55 177.36 2oye n PHE 356 N -0.28 0.36 -2.37 2.71 0.99 -0.65 -4.75 117.46 113.47 2oye n PHE 356 Ca 0.06 0.10 -0.42 0.00 -0.00 0.00 0.00 57.45 57.19 2oye n PHE 356 Cb 0.52 -0.56 -0.03 0.00 -1.00 0.00 0.00 39.48 38.41 2oye n PHE 356 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 2oye s LEU 357 N -4.40 4.29 -0.46 4.37 2.96 -1.26 -4.83 118.68 119.35 2oye s LEU 357 Ca -0.00 1.92 -0.27 0.00 -0.22 0.00 0.00 54.13 55.56 2oye s LEU 357 Cb 0.13 -3.56 0.03 0.00 0.50 0.00 0.00 46.19 43.29 2oye s LEU 357 CO 0.83 -0.64 1.04 -1.58 -1.32 0.00 0.00 176.35 174.68 2oye s GLN 358 N 2.34 3.67 0.83 1.98 0.74 -1.26 -5.01 119.66 122.95 2oye s GLN 358 Ca 0.59 0.43 -0.13 0.00 0.05 0.00 0.00 55.36 56.30 2oye s GLN 358 Cb -0.27 -3.90 0.09 0.00 1.10 0.00 0.00 33.01 30.02 2oye s GLN 358 CO 0.23 -1.28 1.12 1.28 -0.55 0.00 0.00 175.29 176.09 2oye n LEU 359 N 7.49 3.81 -3.79 3.68 4.77 -1.26 -5.03 117.00 126.67 2oye n LEU 359 Ca 0.09 0.54 -0.13 0.00 -0.03 0.00 0.00 56.01 56.49 2oye n LEU 359 Cb 0.49 -1.47 -0.11 0.00 -2.33 0.00 0.00 43.42 39.99 2oye n LEU 359 CO 0.68 -1.95 -0.08 -0.75 -1.33 0.00 0.00 177.39 173.96 2oye s LYS 360 N -4.13 0.33 -0.35 3.23 2.20 -1.26 -4.76 119.74 114.99 2oye s LYS 360 Ca 0.71 0.30 -0.07 0.00 -0.36 0.00 0.00 55.97 56.55 2oye s LYS 360 Cb -0.28 0.16 0.05 0.00 -1.51 0.00 0.00 37.83 36.24 2oye s LYS 360 CO 0.53 -0.05 0.14 0.12 -0.36 0.00 0.00 175.35 175.73 2oye s PHE 361 N -0.00 3.28 -0.29 4.03 5.36 -1.26 -4.95 117.98 124.14 2oye s PHE 361 Ca -0.01 -1.44 0.03 0.00 -0.96 0.00 0.00 56.93 54.55 2oye s PHE 361 Cb -0.02 -2.42 0.17 0.00 -0.34 0.00 0.00 43.02 40.41 2oye s PHE 361 CO 0.01 -0.75 0.48 0.34 -1.46 0.00 0.00 175.22 173.83 2oye s ASP 362 N 1.53 -0.37 0.52 6.13 2.15 -1.26 -5.04 116.67 120.33 2oye s ASP 362 Ca -0.00 -0.13 0.31 0.00 0.43 0.00 0.00 52.55 53.16 2oye s ASP 362 Cb -0.20 1.46 1.44 0.00 -0.30 0.00 0.00 42.92 45.32 2oye s ASP 362 CO 0.03 -0.33 1.85 -0.65 -0.17 0.00 0.00 175.17 175.90 2oye h PRO 363 N 8.10 0.07 0.00 4.34 0.11 -1.95 -1.34 132.00 141.32 2oye h PRO 363 Ca -0.07 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.04 2oye h PRO 363 Cb 1.15 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 2oye h PRO 363 CO 0.22 0.04 -0.00 0.93 -0.21 0.00 0.00 178.00 178.98 2oye h GLU 364 N 0.07 0.00 -0.10 1.05 5.08 -1.96 -2.23 114.58 116.48 2oye h GLU 364 Ca 0.49 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.88 2oye h GLU 364 Cb 1.83 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.07 2oye h GLU 364 CO -0.05 0.00 0.08 -0.07 -1.00 0.00 0.00 179.01 177.98 2oye h LEU 365 N 0.00 0.00 -2.03 1.33 3.38 -1.67 -2.27 115.31 114.06 2oye h LEU 365 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2oye h LEU 365 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2oye h LEU 365 CO 0.00 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.71 2oye n LEU 366 N -4.22 3.10 0.31 1.67 4.77 -0.84 -4.54 117.00 117.26 2oye n LEU 366 Ca -0.01 -1.13 0.21 0.00 -0.03 0.00 0.00 56.01 55.06 2oye n LEU 366 Cb 0.19 -0.06 1.10 0.00 -2.33 0.00 0.00 43.42 42.32 2oye n LEU 366 CO 0.32 0.56 1.13 -0.26 -1.33 0.00 0.00 177.39 177.81 2oye h PHE 367 N 4.61 0.00 0.00 -1.77 0.05 -1.51 -2.13 116.94 116.19 2oye h PHE 367 Ca 0.00 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.77 2oye h PHE 367 Cb 0.99 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 38.94 2oye h PHE 367 CO 0.06 0.00 -1.55 0.41 -0.18 0.00 0.00 178.31 177.05 2oye n GLY 368 N -0.95 -1.21 3.88 -1.45 0.00 -1.26 -4.97 105.19 99.22 2oye n GLY 368 Ca -0.02 -0.37 -0.30 0.00 0.00 0.00 0.00 46.02 45.32 2oye n GLY 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oye s ALA 369 N -3.40 1.93 -0.62 4.61 0.00 -0.80 -5.02 121.76 118.45 2oye s ALA 369 Ca -0.05 -1.22 -0.08 0.00 0.00 0.00 0.00 51.96 50.61 2oye s ALA 369 Cb 0.12 -2.77 0.16 0.00 0.00 0.00 0.00 23.12 20.62 2oye s ALA 369 CO 0.85 -2.70 0.50 -0.65 0.00 0.00 0.00 175.76 173.75 2oye s GLN 370 N -5.85 2.82 0.00 0.00 -0.21 -1.26 -5.05 119.66 110.11 2oye s GLN 370 Ca 0.75 -2.22 0.07 0.00 0.02 0.00 0.00 55.36 53.98 2oye s GLN 370 Cb -0.04 -4.00 -0.02 0.00 1.00 0.00 0.00 33.01 29.95 2oye s GLN 370 CO 0.54 -1.22 -0.22 0.12 -2.12 0.00 0.00 175.29 172.39 2oye s PHE 371 N 0.55 1.94 -0.31 0.91 5.36 -1.26 -5.09 117.98 120.07 2oye s PHE 371 Ca 0.13 -0.37 -0.11 0.00 -0.96 0.00 0.00 56.93 55.61 2oye s PHE 371 Cb -0.20 -1.22 -0.02 0.00 -0.34 0.00 0.00 43.02 41.23 2oye s PHE 371 CO -0.04 0.00 0.20 -0.65 -1.46 0.00 0.00 175.22 173.27 2oye s GLN 372 N -0.70 3.58 -1.33 10.12 -1.52 -1.26 -4.99 119.66 123.55 2oye s GLN 372 Ca 0.08 -0.57 -0.16 0.00 -1.95 0.00 0.00 55.36 52.76 2oye s GLN 372 Cb -0.09 -3.69 0.07 0.00 -0.22 0.00 0.00 33.01 29.09 2oye s GLN 372 CO -0.00 -0.36 1.85 0.66 -0.25 0.00 0.00 175.29 177.19 2oye n TYR 373 N 5.06 4.34 -3.44 0.91 4.02 -1.26 -4.77 117.16 122.02 2oye n TYR 373 Ca -0.13 -2.92 0.01 0.00 -0.01 0.00 0.00 57.90 54.85 2oye n TYR 373 Cb 0.50 -2.55 -0.05 0.00 -0.02 0.00 0.00 39.34 37.22 2oye n TYR 373 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 2oye s ARG 374 N 3.59 0.28 0.18 -0.72 3.52 -0.76 -4.62 118.95 120.41 2oye s ARG 374 Ca 0.51 0.65 0.11 0.00 -0.13 0.00 0.00 55.73 56.87 2oye s ARG 374 Cb 0.06 0.34 -0.04 0.00 -1.56 0.00 0.00 34.95 33.75 2oye s ARG 374 CO 0.03 -0.09 -0.21 1.21 -0.81 0.00 0.00 175.30 175.43 2oye s ASN 375 N 2.19 3.63 -0.28 -2.12 3.04 -1.25 -4.96 114.94 115.18 2oye s ASN 375 Ca -0.04 -0.77 -0.03 0.00 0.04 0.00 0.00 52.86 52.06 2oye s ASN 375 Cb -0.05 -0.37 0.11 0.00 -1.54 0.00 0.00 41.25 39.39 2oye s ASN 375 CO -0.17 0.13 0.16 -0.60 -3.04 0.00 0.00 177.10 173.59 2oye s ARG 376 N -2.59 0.21 0.09 0.43 6.06 -1.26 -4.69 118.95 117.20 2oye s ARG 376 Ca 0.21 -0.41 -0.36 0.00 -2.50 0.00 0.00 55.73 52.66 2oye s ARG 376 Cb -0.09 -1.09 -0.17 0.00 0.06 0.00 0.00 34.95 33.67 2oye s ARG 376 CO 0.10 -1.00 1.17 -0.89 -2.50 0.00 0.00 175.30 172.19 2oye n ILE 377 N 5.27 0.35 -3.98 4.11 2.08 -1.26 -4.68 119.36 121.24 2oye n ILE 377 Ca -0.05 -0.09 -0.23 0.00 0.56 0.00 0.00 62.75 62.95 2oye n ILE 377 Cb 0.43 -0.55 -0.03 0.00 -0.75 0.00 0.00 39.64 38.75 2oye n ILE 377 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2oye s ALA 378 N 0.09 3.89 0.21 -1.39 0.00 -1.26 -2.32 121.76 120.97 2oye s ALA 378 Ca 0.82 -1.20 0.06 0.00 0.00 0.00 0.00 51.96 51.64 2oye s ALA 378 Cb -1.01 -1.69 0.13 0.00 0.00 0.00 0.00 23.12 20.55 2oye s ALA 378 CO 0.52 0.32 1.47 0.00 0.00 0.00 0.00 175.76 178.07 2oye h MET 379 N 1.48 0.10 0.00 0.00 -0.00 -1.41 -2.39 114.93 112.72 2oye h MET 379 Ca -0.51 -0.10 -0.04 0.00 -0.00 0.00 0.00 59.70 59.05 2oye h MET 379 Cb 1.22 0.02 -0.01 0.00 -0.00 0.00 0.00 31.60 32.84 2oye h MET 379 CO 0.63 0.81 -0.21 0.93 -0.00 0.00 0.00 176.91 179.07 2oye h GLU 380 N 0.06 0.00 0.40 -0.10 3.07 -1.96 -0.90 114.58 115.16 2oye h GLU 380 Ca -0.02 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.82 2oye h GLU 380 Cb 1.34 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.25 2oye h GLU 380 CO 0.11 0.21 -0.19 0.35 -1.40 0.00 0.00 179.01 178.08 2oye h PHE 381 N 0.00 -0.50 -0.95 4.33 3.57 -1.86 -2.88 116.94 118.64 2oye h PHE 381 Ca -0.00 -0.01 0.25 0.00 3.53 0.00 0.00 57.97 61.74 2oye h PHE 381 Cb 0.66 0.17 -0.17 0.00 2.79 0.00 0.00 35.95 39.39 2oye h PHE 381 CO 0.00 -0.28 0.02 -0.97 -2.23 0.00 0.00 178.31 174.85 2oye h ASN 382 N -1.13 -0.46 -0.49 0.41 -0.73 -1.20 0.12 115.58 112.10 2oye h ASN 382 Ca -0.06 0.27 -0.02 0.00 1.87 0.00 0.00 56.30 58.36 2oye h ASN 382 Cb 0.45 0.46 -0.02 0.00 0.27 0.00 0.00 38.32 39.48 2oye h ASN 382 CO 0.09 -0.32 0.22 1.56 -0.37 0.00 0.00 177.43 178.61 2oye h GLN 383 N 0.03 0.71 -0.11 6.67 4.20 -1.18 -2.97 115.11 122.47 2oye h GLN 383 Ca 0.56 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 59.16 2oye h GLN 383 Cb 1.12 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.78 2oye h GLN 383 CO -0.88 0.62 0.00 1.47 -0.67 0.00 0.00 178.83 179.37 2oye n LEU 384 N -4.60 0.87 -1.31 1.46 -0.00 -0.02 -3.01 117.00 110.39 2oye n LEU 384 Ca 0.02 -0.38 0.09 0.00 -0.00 0.00 0.00 56.01 55.74 2oye n LEU 384 Cb 0.13 -0.07 0.31 0.00 -0.00 0.00 0.00 43.42 43.79 2oye n LEU 384 CO 0.37 0.19 0.77 0.00 -0.00 0.00 0.00 177.39 178.72 2oye n TYR 385 N -0.17 1.15 -1.94 1.47 -0.00 -0.89 -4.70 117.16 112.09 2oye n TYR 385 Ca 0.13 -0.59 -0.42 0.00 -0.00 0.00 0.00 57.90 57.02 2oye n TYR 385 Cb 0.19 -0.16 -0.00 0.00 -0.00 0.00 0.00 39.34 39.36 2oye n TYR 385 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.86 177.58 2oye n HIS 386 N 0.97 3.05 -1.01 2.98 8.25 -1.17 -4.81 115.22 123.49 2oye n HIS 386 Ca 0.23 -2.90 -0.13 0.00 -0.26 0.00 0.00 57.72 54.65 2oye n HIS 386 Cb 0.76 -2.23 -0.11 0.00 1.12 0.00 0.00 29.99 29.52 2oye n HIS 386 CO 0.00 0.00 0.00 0.91 0.64 0.00 0.00 176.34 177.89 2oye n TRP 387 N 4.42 0.39 0.28 4.41 8.01 -1.26 -4.60 117.44 129.08 2oye n TRP 387 Ca 0.52 -1.53 0.12 0.00 -1.31 0.00 0.00 57.50 55.30 2oye n TRP 387 Cb 0.34 -1.35 0.79 0.00 -2.01 0.00 0.00 31.31 29.08 2oye n TRP 387 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13 2oye h HIS 388 N 2.61 0.00 0.00 -5.99 3.86 -1.97 -1.89 115.15 111.76 2oye h HIS 388 Ca 0.21 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.42 2oye h HIS 388 Cb 1.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.72 2oye h HIS 388 CO 1.43 0.04 0.00 -0.35 0.86 0.00 0.00 177.93 179.91 2oye n PRO 389 N -3.99 0.55 0.19 2.45 -0.04 -1.26 -2.10 135.00 130.80 2oye n PRO 389 Ca -0.03 0.02 0.05 0.00 -0.04 0.00 0.00 63.50 63.50 2oye n PRO 389 Cb 0.13 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.46 2oye n PRO 389 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2oye h LEU 390 N 0.00 0.00 -9.53 1.53 3.38 -1.54 -3.34 115.31 105.80 2oye h LEU 390 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 2oye h LEU 390 Cb 0.03 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.80 2oye h LEU 390 CO 0.00 0.37 0.84 -0.04 0.09 0.00 0.00 178.44 179.70 2oye s MET 391 N -3.83 4.26 0.00 1.13 -1.94 -0.89 -0.88 119.30 117.15 2oye s MET 391 Ca -0.01 2.21 0.00 0.00 -1.71 0.00 0.00 55.69 56.18 2oye s MET 391 Cb 0.12 -3.31 0.00 0.00 2.01 0.00 0.00 34.83 33.66 2oye s MET 391 CO 0.69 -0.56 0.00 -0.35 -0.01 0.00 0.00 175.02 174.79 2oye n PRO 392 N 4.37 0.71 -0.12 2.03 -0.04 -1.26 -4.60 135.00 136.09 2oye n PRO 392 Ca 0.13 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.42 2oye n PRO 392 Cb 0.41 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.76 2oye n PRO 392 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2oye n ASP 393 N -0.31 2.13 -1.42 3.54 10.43 -1.26 -4.81 116.55 124.86 2oye n ASP 393 Ca 0.00 -0.09 -0.03 0.00 2.57 0.00 0.00 54.79 57.24 2oye n ASP 393 Cb 0.00 -0.41 -0.01 0.00 1.84 0.00 0.00 41.12 42.54 2oye n ASP 393 CO 0.00 0.00 0.00 -1.54 -1.07 0.00 0.00 177.20 174.59 2oye n SER 394 N -3.28 -0.19 -3.69 -2.24 3.41 -1.26 -4.67 113.62 101.70 2oye n SER 394 Ca -0.43 -1.41 -0.29 0.00 -0.26 0.00 0.00 58.87 56.48 2oye n SER 394 Cb 0.94 0.39 -0.13 0.00 -0.26 0.00 0.00 64.21 65.15 2oye n SER 394 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2oye s PHE 395 N -3.14 1.89 0.29 7.33 0.40 -0.16 -5.02 117.98 119.58 2oye s PHE 395 Ca 0.07 -2.37 -0.30 0.00 -0.60 0.00 0.00 56.93 53.73 2oye s PHE 395 Cb 0.00 -1.81 -0.10 0.00 0.51 0.00 0.00 43.02 41.61 2oye s PHE 395 CO 0.05 -0.78 1.45 -0.98 0.70 0.00 0.00 175.22 175.66 2oye s ARG 396 N 0.39 4.23 -0.40 0.44 3.03 -1.26 -3.26 118.95 122.12 2oye s ARG 396 Ca 0.18 2.38 0.09 0.00 2.03 0.00 0.00 55.73 60.41 2oye s ARG 396 Cb -0.24 -3.07 0.28 0.00 -1.03 0.00 0.00 34.95 30.90 2oye s ARG 396 CO 0.00 -0.44 0.67 0.28 -1.13 0.00 0.00 175.30 174.68 2oye n VAL 397 N 1.79 -0.42 -0.28 4.99 0.31 -1.16 -4.79 118.33 118.78 2oye n VAL 397 Ca 0.05 -3.69 0.00 0.00 -0.01 0.00 0.00 64.34 60.69 2oye n VAL 397 Cb 0.40 -0.82 0.00 0.00 -0.91 0.00 0.00 33.84 32.51 2oye n VAL 397 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2oye n GLY 398 N 1.05 0.52 0.16 2.92 0.00 -1.26 -3.72 105.19 104.86 2oye n GLY 398 Ca 0.20 -0.95 -0.03 0.00 0.00 0.00 0.00 46.02 45.24 2oye n GLY 398 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2oye h PRO 399 N 0.00 0.11 -7.25 1.61 0.13 -2.01 -3.45 132.00 121.14 2oye h PRO 399 Ca 0.00 -0.08 -0.43 0.00 -0.87 0.00 0.00 66.00 64.62 2oye h PRO 399 Cb 0.00 0.01 0.19 0.00 0.13 0.00 0.00 31.00 31.33 2oye h PRO 399 CO 0.00 0.67 0.08 -0.65 -0.23 0.00 0.00 178.00 177.87 2oye s GLN 400 N -3.73 -0.75 -0.42 0.86 1.11 -1.24 -5.05 119.66 110.43 2oye s GLN 400 Ca -0.03 0.48 0.04 0.00 0.01 0.00 0.00 55.36 55.86 2oye s GLN 400 Cb 0.12 -1.60 0.28 0.00 -1.01 0.00 0.00 33.01 30.80 2oye s GLN 400 CO 0.78 -3.52 1.10 -3.47 0.01 0.00 0.00 175.29 170.19 2oye n ASP 401 N -4.72 -2.18 -4.64 5.90 2.03 -1.26 -2.98 116.55 108.71 2oye n ASP 401 Ca 0.06 -2.89 -0.41 0.00 0.52 0.00 0.00 54.79 52.07 2oye n ASP 401 Cb 0.57 1.54 0.02 0.00 -0.72 0.00 0.00 41.12 42.52 2oye n ASP 401 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 2oye n TYR 402 N 1.09 1.40 -2.21 -0.67 4.01 -1.20 -4.63 117.16 114.95 2oye n TYR 402 Ca 0.04 0.52 -0.13 0.00 -0.16 0.00 0.00 57.90 58.17 2oye n TYR 402 Cb 0.68 -2.26 0.08 0.00 -0.31 0.00 0.00 39.34 37.53 2oye n TYR 402 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2oye n SER 403 N 0.18 0.57 -0.13 7.72 3.41 -1.26 -0.98 113.62 123.13 2oye n SER 403 Ca 0.09 -1.53 -0.11 0.00 -0.26 0.00 0.00 58.87 57.07 2oye n SER 403 Cb 0.41 -0.40 -0.02 0.00 -0.26 0.00 0.00 64.21 63.94 2oye n SER 403 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 2oye h TYR 404 N -0.73 0.71 -0.88 7.33 0.99 -1.96 -1.67 116.97 120.77 2oye h TYR 404 Ca -0.19 -0.13 0.19 0.00 2.00 0.00 0.00 58.73 60.60 2oye h TYR 404 Cb 0.65 -0.19 -0.06 0.00 1.00 0.00 0.00 36.73 38.13 2oye h TYR 404 CO 0.00 0.75 0.58 0.93 -0.00 0.00 0.00 178.16 180.42 2oye h GLU 405 N 0.47 0.42 0.00 4.88 4.39 -1.93 0.48 114.58 123.29 2oye h GLU 405 Ca 0.10 -0.03 -0.10 0.00 0.34 0.00 0.00 59.36 59.68 2oye h GLU 405 Cb 0.47 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 2oye h GLU 405 CO 0.02 0.28 -1.07 1.96 -1.16 0.00 0.00 179.01 179.04 2oye h GLN 406 N 0.43 0.00 0.00 2.33 4.20 -1.87 -3.40 115.11 116.80 2oye h GLN 406 Ca 0.45 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 59.01 2oye h GLN 406 Cb 1.08 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.84 2oye h GLN 406 CO -0.17 0.21 -0.88 0.35 -0.67 0.00 0.00 178.83 177.67 2oye h PHE 407 N 0.00 0.00 -3.92 2.96 3.57 -0.02 -3.40 116.94 116.14 2oye h PHE 407 Ca -0.08 0.00 -0.55 0.00 3.53 0.00 0.00 57.97 60.87 2oye h PHE 407 Cb 1.34 0.00 0.13 0.00 2.79 0.00 0.00 35.95 40.20 2oye h PHE 407 CO 0.00 1.27 0.64 1.28 -2.23 0.00 0.00 178.31 179.27 2oye n LEU 408 N -4.49 5.07 0.00 0.59 4.77 0.15 -2.26 117.00 120.83 2oye n LEU 408 Ca -0.25 1.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.81 2oye n LEU 408 Cb 0.60 -1.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.11 2oye n LEU 408 CO 0.22 -0.35 0.00 0.49 -1.33 0.00 0.00 177.39 176.42 2oye n PHE 409 N -0.45 0.00 -1.66 -1.77 3.01 0.12 -4.88 117.46 111.84 2oye n PHE 409 Ca 0.07 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.10 2oye n PHE 409 Cb 0.42 -1.32 -0.03 0.00 -0.01 0.00 0.00 39.48 38.54 2oye n PHE 409 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2oye n ASN 410 N 0.00 4.00 -1.91 4.37 2.85 -0.96 -4.86 115.26 118.75 2oye n ASN 410 Ca 0.00 0.85 -0.20 0.00 -0.11 0.00 0.00 54.58 55.12 2oye n ASN 410 Cb 0.00 -1.51 0.15 0.00 1.24 0.00 0.00 39.78 39.66 2oye n ASN 410 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2oye n THR 411 N 5.69 3.05 -1.06 -0.44 -2.24 -1.26 -4.43 114.28 113.58 2oye n THR 411 Ca 0.21 -2.59 0.00 0.00 -2.27 0.00 0.00 64.05 59.41 2oye n THR 411 Cb 0.40 -0.62 0.00 0.00 -2.10 0.00 0.00 70.33 68.00 2oye n THR 411 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2oye n SER 412 N -1.06 0.00 -0.13 3.42 3.41 -1.26 -4.83 113.62 113.18 2oye n SER 412 Ca 0.51 -0.39 -0.08 0.00 -0.26 0.00 0.00 58.87 58.65 2oye n SER 412 Cb 1.21 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.16 2oye n SER 412 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 2oye h MET 413 N 0.00 0.52 0.20 4.33 4.05 -1.98 -1.35 114.93 120.70 2oye h MET 413 Ca 0.00 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.38 2oye h MET 413 Cb 0.20 -0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 30.86 2oye h MET 413 CO 0.00 0.36 -0.28 1.25 0.23 0.00 0.00 176.91 178.46 2oye h LEU 414 N 0.53 -0.81 -2.02 3.39 5.85 -1.90 -2.15 115.31 118.20 2oye h LEU 414 Ca 0.14 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 2oye h LEU 414 Cb -0.05 0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.26 2oye h LEU 414 CO -0.03 -0.35 -0.10 0.58 -0.34 0.00 0.00 178.44 178.21 2oye h VAL 415 N -0.50 0.64 0.48 1.05 2.07 -1.92 -1.78 116.25 116.29 2oye h VAL 415 Ca -0.02 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 2oye h VAL 415 Cb 0.46 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 2oye h VAL 415 CO -0.08 0.09 -0.23 0.44 0.02 0.00 0.00 177.57 177.81 2oye h ASP 416 N 0.00 -0.54 -0.42 0.57 3.45 -1.05 -3.37 116.42 115.07 2oye h ASP 416 Ca -0.00 0.02 -0.04 0.00 0.43 0.00 0.00 57.03 57.44 2oye h ASP 416 Cb 0.24 0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 39.13 2oye h ASP 416 CO 0.01 -0.21 0.11 1.88 -1.57 0.00 0.00 179.24 179.46 2oye h TYR 417 N -1.00 0.69 -0.01 4.55 -1.99 -1.33 -3.50 116.97 114.38 2oye h TYR 417 Ca -0.07 -0.08 0.00 0.00 2.00 0.00 0.00 58.73 60.58 2oye h TYR 417 Cb 0.49 -0.20 0.00 0.00 2.00 0.00 0.00 36.73 39.02 2oye h TYR 417 CO 0.02 0.65 0.00 0.41 -0.00 0.00 0.00 178.16 179.24 2oye n GLY 418 N -0.60 1.45 0.35 3.88 0.00 -0.68 -4.48 105.19 105.11 2oye n GLY 418 Ca -0.00 -1.29 -0.09 0.00 0.00 0.00 0.00 46.02 44.64 2oye n GLY 418 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2oye n VAL 419 N 2.94 -0.56 -0.03 1.61 0.31 -1.26 -0.89 118.33 120.45 2oye n VAL 419 Ca 0.00 2.14 -0.01 0.00 -0.01 0.00 0.00 64.34 66.46 2oye n VAL 419 Cb 0.00 -2.66 -0.01 0.00 -0.91 0.00 0.00 33.84 30.27 2oye n VAL 419 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2oye n GLU 420 N -4.93 -0.03 -0.02 5.55 4.71 -1.26 0.49 120.64 125.15 2oye n GLU 420 Ca 0.02 0.74 0.16 0.00 -0.01 0.00 0.00 57.16 58.07 2oye n GLU 420 Cb 0.22 -1.10 0.61 0.00 -1.01 0.00 0.00 31.44 30.15 2oye n GLU 420 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2oye h ALA 421 N -0.60 2.28 0.01 0.62 0.00 -1.36 -1.39 119.26 118.82 2oye h ALA 421 Ca 0.01 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2oye h ALA 421 Cb 0.03 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.82 2oye h ALA 421 CO -0.06 -0.43 -0.26 -0.07 0.00 0.00 0.00 179.25 178.43 2oye h LEU 422 N 0.16 0.21 -0.61 0.00 3.38 0.20 -2.90 115.31 115.75 2oye h LEU 422 Ca 0.25 -0.81 0.12 0.00 0.09 0.00 0.00 57.88 57.53 2oye h LEU 422 Cb 0.78 -0.07 -0.09 0.00 0.09 0.00 0.00 40.66 41.38 2oye h LEU 422 CO -0.04 1.00 0.10 0.58 0.09 0.00 0.00 178.44 180.17 2oye h VAL 423 N -0.55 0.59 0.01 1.22 2.07 0.46 -0.59 116.25 119.45 2oye h VAL 423 Ca -0.04 -0.08 0.03 0.00 0.82 0.00 0.00 66.70 67.44 2oye h VAL 423 Cb 1.05 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 31.13 2oye h VAL 423 CO 0.05 0.04 -0.27 -0.78 0.02 0.00 0.00 177.57 176.63 2oye h ASP 424 N 0.22 -0.79 -0.30 0.57 3.58 -1.32 -1.36 116.42 117.02 2oye h ASP 424 Ca 0.32 0.11 0.09 0.00 0.42 0.00 0.00 57.03 57.97 2oye h ASP 424 Cb 0.50 0.32 -0.01 0.00 1.72 0.00 0.00 39.33 41.86 2oye h ASP 424 CO -0.44 -0.34 0.32 0.00 -2.88 0.00 0.00 179.24 175.91 2oye h ALA 425 N 0.39 1.97 0.02 -0.78 0.00 -0.90 -2.23 119.26 117.73 2oye h ALA 425 Ca 0.06 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.64 2oye h ALA 425 Cb 0.49 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 2oye h ALA 425 CO -0.23 -0.48 -1.91 1.19 0.00 0.00 0.00 179.25 177.83 2oye n PHE 426 N -3.77 0.85 1.35 0.00 3.72 -0.86 -3.55 117.46 115.20 2oye n PHE 426 Ca 0.05 0.27 0.09 0.00 -0.05 0.00 0.00 57.45 57.80 2oye n PHE 426 Cb 0.47 -1.14 0.51 0.00 -0.94 0.00 0.00 39.48 38.38 2oye n PHE 426 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2oye n SER 427 N -3.09 0.00 0.00 4.37 7.64 -0.57 -1.19 113.62 120.78 2oye n SER 427 Ca -0.24 -0.81 0.00 0.00 1.01 0.00 0.00 58.87 58.83 2oye n SER 427 Cb 1.07 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.27 2oye n SER 427 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2oye n ARG 428 N -0.90 5.34 -3.58 1.43 1.74 -1.07 -4.05 116.66 115.57 2oye n ARG 428 Ca 0.13 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.82 2oye n ARG 428 Cb 0.06 -0.56 -0.11 0.00 -1.02 0.00 0.00 32.46 30.83 2oye n ARG 428 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2oye s GLN 429 N -1.11 3.78 0.73 5.56 0.74 -1.12 -4.84 119.66 123.40 2oye s GLN 429 Ca 0.00 -0.44 -0.16 0.00 0.05 0.00 0.00 55.36 54.81 2oye s GLN 429 Cb 0.00 -3.70 -0.07 0.00 1.10 0.00 0.00 33.01 30.34 2oye s GLN 429 CO 0.00 -0.27 0.23 -0.35 -0.55 0.00 0.00 175.29 174.35 2oye n PRO 430 N 5.07 0.17 -4.69 1.67 -0.04 -1.26 -1.18 135.00 134.74 2oye n PRO 430 Ca -0.14 0.09 -0.31 0.00 -0.04 0.00 0.00 63.50 63.10 2oye n PRO 430 Cb 0.51 -1.57 -0.13 0.00 -0.04 0.00 0.00 33.50 32.27 2oye n PRO 430 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2oye s ALA 431 N -1.97 2.55 1.02 0.55 0.00 -0.51 -4.43 121.76 118.97 2oye s ALA 431 Ca 0.60 -1.20 -0.12 0.00 0.00 0.00 0.00 51.96 51.24 2oye s ALA 431 Cb -0.35 -0.70 0.20 0.00 0.00 0.00 0.00 23.12 22.27 2oye s ALA 431 CO 0.63 0.57 1.08 0.20 0.00 0.00 0.00 175.76 178.23 2oye s GLY 432 N -1.41 1.59 0.08 0.00 0.00 -0.06 -1.58 107.32 105.94 2oye s GLY 432 Ca 0.14 -0.09 -0.28 0.00 0.00 0.00 0.00 44.72 44.49 2oye s GLY 432 CO 0.05 0.50 0.88 -1.60 0.00 0.00 0.00 173.10 172.93 2oye s ARG 433 N -4.75 4.61 0.12 2.90 3.52 0.08 -4.21 118.95 121.23 2oye s ARG 433 Ca 0.66 1.29 -0.09 0.00 -0.13 0.00 0.00 55.73 57.46 2oye s ARG 433 Cb -0.21 -3.37 -0.10 0.00 -1.56 0.00 0.00 34.95 29.71 2oye s ARG 433 CO 0.60 0.25 1.33 0.82 -0.81 0.00 0.00 175.30 177.48 2oye h ILE 434 N 4.06 1.32 -3.92 4.11 2.04 -1.73 -3.43 117.51 119.96 2oye h ILE 434 Ca -0.43 -2.11 0.00 0.00 1.00 0.00 0.00 64.86 63.32 2oye h ILE 434 Cb 1.21 2.12 0.00 0.00 -0.74 0.00 0.00 36.82 39.41 2oye h ILE 434 CO 0.71 0.65 0.00 0.61 0.00 0.00 0.00 178.15 180.13 2oye n GLY 435 N 0.74 2.21 1.51 5.37 0.00 -0.87 -4.70 105.19 109.45 2oye n GLY 435 Ca -0.07 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 43.82 2oye n GLY 435 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oye n GLY 436 N 5.00 3.09 0.00 -0.02 0.00 -1.25 -4.90 105.19 107.11 2oye n GLY 436 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2oye n GLY 436 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oye n GLY 437 N -1.12 0.88 3.80 -0.02 0.00 -1.02 -4.91 105.19 102.81 2oye n GLY 437 Ca 0.00 -1.74 -0.33 0.00 0.00 0.00 0.00 46.02 43.95 2oye n GLY 437 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oye n ARG 438 N 0.93 -0.96 0.00 1.61 1.74 1.00 -4.90 116.66 116.09 2oye n ARG 438 Ca 0.00 0.48 0.00 0.00 -0.77 0.00 0.00 57.85 57.56 2oye n ARG 438 Cb 0.00 -3.21 0.00 0.00 -1.02 0.00 0.00 32.46 28.23 2oye n ARG 438 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2oye n ASN 439 N -2.41 0.00 -4.63 0.55 5.15 -1.14 -4.09 115.26 108.69 2oye n ASN 439 Ca -0.15 -1.00 -0.42 0.00 -0.60 0.00 0.00 54.58 52.41 2oye n ASN 439 Cb 0.60 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.80 2oye n ASN 439 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2oye s ILE 440 N 0.00 4.84 0.93 -1.44 1.01 -0.32 -4.60 121.20 121.62 2oye s ILE 440 Ca 0.00 1.37 -0.14 0.00 0.00 0.00 0.00 60.65 61.88 2oye s ILE 440 Cb 0.00 -4.10 -0.03 0.00 0.01 0.00 0.00 42.46 38.34 2oye s ILE 440 CO 0.00 -0.12 0.07 -0.67 0.00 0.00 0.00 174.94 174.22 2oye n ASP 441 N 6.04 -3.13 0.21 3.58 2.03 -1.26 -0.63 116.55 123.39 2oye n ASP 441 Ca 0.04 0.32 0.09 0.00 0.52 0.00 0.00 54.79 55.76 2oye n ASP 441 Cb 0.48 -1.08 0.41 0.00 -0.72 0.00 0.00 41.12 40.21 2oye n ASP 441 CO 0.00 0.00 0.00 1.12 -1.92 0.00 0.00 177.20 176.40 2oye h HIS 442 N -1.27 0.00 0.14 -0.67 2.07 -1.95 -2.90 115.15 110.58 2oye h HIS 442 Ca -0.44 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.08 2oye h HIS 442 Cb 1.30 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.28 2oye h HIS 442 CO 0.33 0.25 -0.07 0.45 -3.07 0.00 0.00 177.93 175.82 2oye h HIS 443 N 0.00 -0.18 0.00 6.12 3.86 -1.99 -3.28 115.15 119.68 2oye h HIS 443 Ca -0.00 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 2oye h HIS 443 Cb 0.82 0.06 0.00 0.00 1.06 0.00 0.00 27.41 29.35 2oye h HIS 443 CO 0.00 -0.11 0.00 0.44 0.86 0.00 0.00 177.93 179.12 2oye n ILE 444 N -2.79 0.10 0.00 2.45 -5.35 -1.25 -3.93 119.36 108.59 2oye n ILE 444 Ca -0.02 0.02 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 2oye n ILE 444 Cb 0.08 -0.76 0.00 0.00 -1.74 0.00 0.00 39.64 37.22 2oye n ILE 444 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68 2oye n LEU 445 N -1.05 0.00 0.12 7.28 7.94 -1.09 -0.50 117.00 129.70 2oye n LEU 445 Ca 0.12 0.27 -0.22 0.00 -1.11 0.00 0.00 56.01 55.07 2oye n LEU 445 Cb 0.07 -0.27 -0.14 0.00 0.53 0.00 0.00 43.42 43.61 2oye n LEU 445 CO 0.10 -0.27 -0.13 1.12 -1.11 0.00 0.00 177.39 177.09 2oye h HIS 446 N 0.00 0.91 -0.54 1.96 2.07 -1.85 -3.03 115.15 114.67 2oye h HIS 446 Ca 0.00 -0.62 0.11 0.00 -2.85 0.00 0.00 60.37 57.00 2oye h HIS 446 Cb 0.44 -0.05 -0.10 0.00 2.57 0.00 0.00 27.41 30.26 2oye h HIS 446 CO 0.00 1.48 -0.14 0.28 -3.07 0.00 0.00 177.93 176.48 2oye h VAL 447 N 0.18 0.46 -0.97 6.12 2.07 -1.13 0.08 116.25 123.07 2oye h VAL 447 Ca -0.21 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.41 2oye h VAL 447 Cb 2.03 0.46 -0.08 0.00 -1.52 0.00 0.00 31.29 32.19 2oye h VAL 447 CO 0.25 0.00 0.61 0.00 0.02 0.00 0.00 177.57 178.45 2oye h ALA 448 N 1.53 1.42 0.00 1.67 0.00 -1.63 -0.08 119.26 122.17 2oye h ALA 448 Ca 0.26 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 2oye h ALA 448 Cb 0.39 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2oye h ALA 448 CO -0.55 0.27 -0.49 0.28 0.00 0.00 0.00 179.25 178.76 2oye h VAL 449 N 1.02 1.09 -0.18 0.00 2.07 -0.94 -2.75 116.25 116.55 2oye h VAL 449 Ca 0.46 -1.84 -0.07 0.00 0.82 0.00 0.00 66.70 66.07 2oye h VAL 449 Cb 0.37 2.07 -0.00 0.00 -1.52 0.00 0.00 31.29 32.21 2oye h VAL 449 CO -0.23 0.48 -0.15 0.44 0.02 0.00 0.00 177.57 178.12 2oye h ASP 450 N 0.00 0.44 -0.30 0.57 3.32 0.68 0.66 116.42 121.78 2oye h ASP 450 Ca -0.00 -0.46 -0.00 0.00 0.02 0.00 0.00 57.03 56.58 2oye h ASP 450 Cb 1.04 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.45 2oye h ASP 450 CO 0.06 0.81 0.18 0.58 -1.72 0.00 0.00 179.24 179.16 2oye h VAL 451 N 0.07 1.10 0.02 -1.35 2.07 -1.09 0.61 116.25 117.68 2oye h VAL 451 Ca 0.03 -0.22 -0.23 0.00 0.82 0.00 0.00 66.70 67.10 2oye h VAL 451 Cb 0.68 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 2oye h VAL 451 CO 0.04 0.10 -0.98 0.40 0.02 0.00 0.00 177.57 177.15 2oye h ILE 452 N 0.43 1.42 -0.14 4.57 2.04 -1.32 -1.01 117.51 123.51 2oye h ILE 452 Ca 0.11 -2.55 -0.06 0.00 1.00 0.00 0.00 64.86 63.36 2oye h ILE 452 Cb -0.00 2.50 -0.00 0.00 -0.74 0.00 0.00 36.82 38.57 2oye h ILE 452 CO -0.02 0.76 -0.14 0.11 0.00 0.00 0.00 178.15 178.85 2oye h LYS 453 N 0.19 0.34 -0.13 2.37 1.57 0.38 -3.19 116.57 118.10 2oye h LYS 453 Ca -0.08 -0.18 -0.14 0.00 -1.87 0.00 0.00 60.65 58.37 2oye h LYS 453 Cb 1.62 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.93 2oye h LYS 453 CO 0.17 0.73 -0.53 1.49 -0.57 0.00 0.00 179.45 180.74 2oye h GLU 454 N -0.04 0.38 -0.92 3.15 4.81 0.10 -2.91 114.58 119.15 2oye h GLU 454 Ca 0.02 -0.23 0.23 0.00 -0.13 0.00 0.00 59.36 59.25 2oye h GLU 454 Cb 0.67 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.02 2oye h GLU 454 CO 0.04 0.82 0.63 1.03 -0.73 0.00 0.00 179.01 180.79 2oye h SER 455 N 0.30 0.28 0.92 1.04 0.87 -1.16 0.86 113.55 116.65 2oye h SER 455 Ca 0.01 0.03 -0.17 0.00 -1.23 0.00 0.00 61.79 60.43 2oye h SER 455 Cb 1.03 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.95 2oye h SER 455 CO 0.09 0.10 -1.17 0.03 -0.53 0.00 0.00 176.83 175.35 2oye h ARG 456 N 0.27 0.00 -0.46 2.24 3.08 -1.53 -2.61 114.38 115.37 2oye h ARG 456 Ca 0.47 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.50 2oye h ARG 456 Cb 1.40 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.43 2oye h ARG 456 CO -0.14 0.46 0.19 0.28 -1.07 0.00 0.00 179.97 179.69 2oye h VAL 457 N 0.00 1.20 0.00 2.04 2.07 -0.77 -2.40 116.25 118.39 2oye h VAL 457 Ca -0.12 -0.62 -0.07 0.00 0.82 0.00 0.00 66.70 66.72 2oye h VAL 457 Cb 1.62 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.13 2oye h VAL 457 CO 0.07 0.23 -0.33 -0.07 0.02 0.00 0.00 177.57 177.49 2oye h LEU 458 N 0.60 0.00 -1.89 2.57 3.38 -1.21 -3.48 115.31 115.28 2oye h LEU 458 Ca 0.15 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.94 2oye h LEU 458 Cb 0.18 0.00 0.10 0.00 0.09 0.00 0.00 40.66 41.03 2oye h LEU 458 CO -0.01 0.33 -0.44 0.54 0.09 0.00 0.00 178.44 178.94 2oye n ARG 459 N -3.52 -3.50 -2.42 1.13 1.74 -0.90 -4.71 116.66 104.47 2oye n ARG 459 Ca -0.00 0.48 -0.41 0.00 -0.77 0.00 0.00 57.85 57.15 2oye n ARG 459 Cb 0.48 -4.36 -0.04 0.00 -1.02 0.00 0.00 32.46 27.52 2oye n ARG 459 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2oye s LEU 460 N -4.46 4.48 1.15 0.55 1.43 -1.11 -0.12 118.68 120.60 2oye s LEU 460 Ca 0.03 2.22 -0.12 0.00 -1.03 0.00 0.00 54.13 55.22 2oye s LEU 460 Cb -0.00 -3.61 0.27 0.00 0.03 0.00 0.00 46.19 42.88 2oye s LEU 460 CO 0.41 -0.29 1.03 0.00 0.23 0.00 0.00 176.35 177.74 2oye n GLN 461 N 2.14 -2.23 -1.17 1.70 6.02 -1.26 -4.80 117.38 117.78 2oye n GLN 461 Ca 0.03 -0.61 -0.33 0.00 -0.01 0.00 0.00 57.00 56.07 2oye n GLN 461 Cb 0.45 -2.20 0.12 0.00 1.02 0.00 0.00 30.24 29.63 2oye n GLN 461 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.06 173.91 2oye s PRO 462 N -4.43 1.78 0.16 -1.09 0.02 -1.26 -4.44 135.00 125.73 2oye s PRO 462 Ca 0.68 1.64 -0.26 0.00 0.02 0.00 0.00 61.00 63.09 2oye s PRO 462 Cb -0.25 -1.80 0.02 0.00 0.02 0.00 0.00 34.50 32.49 2oye s PRO 462 CO 0.64 -2.09 1.57 0.35 -0.33 0.00 0.00 177.00 177.15 2oye h PHE 463 N -0.89 -1.21 -0.93 6.54 3.57 -1.44 -0.31 116.94 122.28 2oye h PHE 463 Ca -0.46 0.07 0.26 0.00 3.53 0.00 0.00 57.97 61.38 2oye h PHE 463 Cb 1.28 0.59 -0.04 0.00 2.79 0.00 0.00 35.95 40.57 2oye h PHE 463 CO 0.49 -0.43 0.66 -0.91 -2.23 0.00 0.00 178.31 175.89 2oye h ASN 464 N -0.28 0.06 0.24 0.41 2.35 -1.85 0.15 115.58 116.67 2oye h ASN 464 Ca 0.16 0.01 -0.16 0.00 -0.55 0.00 0.00 56.30 55.76 2oye h ASN 464 Cb 0.57 -0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 2oye h ASN 464 CO -0.61 0.02 -0.63 -0.33 -1.65 0.00 0.00 177.43 174.23 2oye h GLU 465 N 0.06 0.37 0.00 0.81 4.39 -1.40 -2.43 114.58 116.39 2oye h GLU 465 Ca 0.45 -0.26 -0.08 0.00 0.34 0.00 0.00 59.36 59.80 2oye h GLU 465 Cb 1.69 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 30.37 2oye h GLU 465 CO -0.04 0.88 -0.39 1.88 -1.16 0.00 0.00 179.01 180.18 2oye h TYR 466 N 0.27 0.00 0.52 4.33 0.05 -0.58 -1.72 116.97 119.85 2oye h TYR 466 Ca -0.01 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.74 2oye h TYR 466 Cb 1.16 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.91 2oye h TYR 466 CO 0.03 0.39 -0.25 0.00 -1.05 0.00 0.00 178.16 177.29 2oye h ARG 467 N 0.00 -0.67 0.00 4.88 2.47 -1.01 -2.81 114.38 117.23 2oye h ARG 467 Ca -0.00 0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.76 2oye h ARG 467 Cb 1.07 0.15 0.00 0.00 -1.65 0.00 0.00 29.97 29.55 2oye h ARG 467 CO 0.05 -0.37 0.00 1.63 0.56 0.00 0.00 179.97 181.84 2oye n LYS 468 N -5.30 0.00 0.19 0.04 5.02 -0.93 -1.67 118.16 115.50 2oye n LYS 468 Ca -0.11 0.51 0.03 0.00 -2.02 0.00 0.00 58.31 56.72 2oye n LYS 468 Cb 0.32 -1.28 0.05 0.00 -0.02 0.00 0.00 35.03 34.11 2oye n LYS 468 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2oye n ARG 469 N -1.69 0.02 -1.38 1.97 3.00 -0.65 0.12 116.66 118.05 2oye n ARG 469 Ca 0.00 0.74 -0.19 0.00 -0.00 0.00 0.00 57.85 58.40 2oye n ARG 469 Cb 0.00 -1.99 0.11 0.00 0.00 0.00 0.00 32.46 30.58 2oye n ARG 469 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 2oye n PHE 470 N -2.17 2.25 -3.50 -0.14 3.72 -0.67 -4.96 117.46 111.99 2oye n PHE 470 Ca 0.03 -2.18 -0.19 0.00 -0.05 0.00 0.00 57.45 55.06 2oye n PHE 470 Cb 0.84 -0.68 0.08 0.00 -0.94 0.00 0.00 39.48 38.78 2oye n PHE 470 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2oye n GLY 471 N -0.93 -0.37 3.17 1.37 0.00 0.32 -4.91 105.19 103.84 2oye n GLY 471 Ca 0.45 0.12 -0.11 0.00 0.00 0.00 0.00 46.02 46.49 2oye n GLY 471 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2oye s MET 472 N -5.58 1.05 -0.04 1.61 -1.94 -0.78 -5.00 119.30 108.61 2oye s MET 472 Ca 0.08 -1.52 -0.15 0.00 -1.71 0.00 0.00 55.69 52.38 2oye s MET 472 Cb -0.04 0.24 -0.05 0.00 2.01 0.00 0.00 34.83 36.99 2oye s MET 472 CO 0.74 -0.31 0.41 -1.59 -0.01 0.00 0.00 175.02 174.27 2oye s LYS 473 N -4.09 4.05 0.53 2.03 0.00 -1.26 -3.57 119.74 117.42 2oye s LYS 473 Ca 0.30 0.39 -0.21 0.00 0.00 0.00 0.00 55.97 56.46 2oye s LYS 473 Cb 0.07 -3.29 -0.06 0.00 0.00 0.00 0.00 37.83 34.56 2oye s LYS 473 CO 0.06 0.53 1.20 -1.25 0.00 0.00 0.00 175.35 175.89 2oye s PRO 474 N -0.54 3.37 0.48 1.78 0.04 -1.26 -4.84 135.00 134.02 2oye s PRO 474 Ca 0.24 1.83 -0.22 0.00 0.04 0.00 0.00 61.00 62.89 2oye s PRO 474 Cb -0.16 -2.18 -0.07 0.00 0.04 0.00 0.00 34.50 32.13 2oye s PRO 474 CO 0.12 -0.89 1.12 0.71 0.04 0.00 0.00 177.00 178.10 2oye s TYR 475 N -1.56 2.88 -2.66 0.56 1.51 -1.26 -4.94 117.35 111.89 2oye s TYR 475 Ca 0.70 1.56 0.23 0.00 -1.01 0.00 0.00 57.07 58.55 2oye s TYR 475 Cb -0.30 -3.28 0.26 0.00 -0.11 0.00 0.00 41.96 38.54 2oye s TYR 475 CO 0.35 -1.31 1.28 0.25 -1.11 0.00 0.00 175.55 175.00 2oye n THR 476 N -0.74 0.19 -3.56 -0.71 -2.24 -1.26 -4.82 114.28 101.14 2oye n THR 476 Ca 0.09 -0.59 -0.07 0.00 -2.27 0.00 0.00 64.05 61.20 2oye n THR 476 Cb 0.50 1.29 -0.03 0.00 -2.10 0.00 0.00 70.33 69.99 2oye n THR 476 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2oye s SER 477 N -1.72 -0.25 0.47 3.42 1.04 -1.26 -4.93 113.70 110.46 2oye s SER 477 Ca 0.30 0.07 0.21 0.00 0.48 0.00 0.00 55.95 57.00 2oye s SER 477 Cb 0.20 0.25 1.16 0.00 0.10 0.00 0.00 66.02 67.73 2oye s SER 477 CO 0.29 -0.39 1.99 -0.26 0.98 0.00 0.00 173.24 175.86 2oye h PHE 478 N 2.09 0.00 0.68 5.02 -1.00 -1.94 -2.08 116.94 119.72 2oye h PHE 478 Ca -0.15 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.60 2oye h PHE 478 Cb 1.19 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.75 2oye h PHE 478 CO 0.27 0.19 -0.43 1.96 -1.61 0.00 0.00 178.31 178.68 2oye h GLN 479 N 0.00 -1.02 0.00 1.51 4.20 -1.86 -1.26 115.11 116.68 2oye h GLN 479 Ca -0.00 0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 2oye h GLN 479 Cb 0.40 0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.41 2oye h GLN 479 CO 0.02 -0.68 -0.10 1.49 -0.67 0.00 0.00 178.83 178.89 2oye h GLU 480 N -1.06 0.00 0.25 1.46 4.81 -1.81 -3.14 114.58 115.08 2oye h GLU 480 Ca -0.09 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.13 2oye h GLU 480 Cb 0.86 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.24 2oye h GLU 480 CO 0.08 0.10 -0.12 1.25 -0.73 0.00 0.00 179.01 179.60 2oye h LEU 481 N 0.00 -0.28 -9.45 1.64 5.85 -0.95 -3.44 115.31 108.68 2oye h LEU 481 Ca -0.00 0.01 -0.54 0.00 0.84 0.00 0.00 57.88 58.19 2oye h LEU 481 Cb 0.21 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 2oye h LEU 481 CO 0.01 -0.14 0.40 0.42 -0.34 0.00 0.00 178.44 178.79 2oye s THR 482 N -3.11 4.68 -0.12 1.05 -4.23 -0.51 -2.62 115.64 110.77 2oye s THR 482 Ca -0.05 1.97 -0.02 0.00 -1.18 0.00 0.00 61.69 62.41 2oye s THR 482 Cb 0.00 -4.26 -0.06 0.00 1.34 0.00 0.00 72.50 69.53 2oye s THR 482 CO 0.15 0.18 1.37 0.61 -0.54 0.00 0.00 174.62 176.38 2oye n GLY 483 N 2.83 1.75 0.00 3.99 0.00 -1.26 -4.61 105.19 107.89 2oye n GLY 483 Ca 0.06 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.74 2oye n GLY 483 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2oye n GLU 484 N 3.37 0.00 0.00 1.61 -0.00 -1.26 -5.03 120.64 119.33 2oye n GLU 484 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.30 2oye n GLU 484 Cb 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.63 2oye n GLU 484 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.13 177.49 2oye n LYS 485 N 0.00 3.27 0.11 3.44 -0.00 -1.26 -4.76 118.16 118.96 2oye n LYS 485 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 58.31 58.27 2oye n LYS 485 Cb 0.00 -0.62 -0.02 0.00 -0.00 0.00 0.00 35.03 34.39 2oye n LYS 485 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.40 178.45 2oye h GLU 486 N 0.00 -0.28 -0.74 -1.58 -0.00 -1.97 -2.59 114.58 107.41 2oye h GLU 486 Ca 0.00 0.02 0.12 0.00 -0.00 0.00 0.00 59.36 59.50 2oye h GLU 486 Cb 0.08 0.06 -0.08 0.00 -0.00 0.00 0.00 28.75 28.81 2oye h GLU 486 CO 0.00 -0.19 0.34 0.52 -0.00 0.00 0.00 179.01 179.68 2oye h MET 487 N -0.33 0.51 -1.02 1.06 2.86 -1.99 -1.15 114.93 114.87 2oye h MET 487 Ca -0.03 -0.03 0.25 0.00 -2.06 0.00 0.00 59.70 57.83 2oye h MET 487 Cb 0.22 -0.12 -0.11 0.00 0.06 0.00 0.00 31.60 31.66 2oye h MET 487 CO 0.05 0.34 0.64 0.00 1.06 0.00 0.00 176.91 179.00 2oye h ALA 488 N 1.50 2.03 0.29 6.32 0.00 -1.85 -1.07 119.26 126.47 2oye h ALA 488 Ca 0.39 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.37 2oye h ALA 488 Cb 0.52 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2oye h ALA 488 CO -0.34 -0.45 -0.14 0.00 0.00 0.00 0.00 179.25 178.32 2oye h ALA 489 N 1.66 -0.39 -0.84 0.00 0.00 -0.78 -2.26 119.26 116.64 2oye h ALA 489 Ca 0.61 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.39 2oye h ALA 489 Cb 1.34 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 19.24 2oye h ALA 489 CO -0.36 -0.59 0.54 1.05 0.00 0.00 0.00 179.25 179.88 2oye h GLU 490 N -0.64 1.03 0.45 0.00 9.09 -1.34 -2.66 114.58 120.51 2oye h GLU 490 Ca -0.04 -0.06 -0.01 0.00 0.05 0.00 0.00 59.36 59.30 2oye h GLU 490 Cb 0.45 -0.23 -0.01 0.00 -1.65 0.00 0.00 28.75 27.31 2oye h GLU 490 CO 0.07 0.68 -0.32 -0.07 0.05 0.00 0.00 179.01 179.42 2oye h LEU 491 N 1.06 -0.81 -0.75 3.06 3.38 -1.19 -1.60 115.31 118.45 2oye h LEU 491 Ca 0.33 0.06 0.16 0.00 0.09 0.00 0.00 57.88 58.52 2oye h LEU 491 Cb -0.00 0.25 -0.11 0.00 0.09 0.00 0.00 40.66 40.89 2oye h LEU 491 CO -0.11 -0.48 0.22 -0.33 0.09 0.00 0.00 178.44 177.83 2oye h GLU 492 N -0.75 0.31 -0.01 1.13 4.39 -1.29 0.25 114.58 118.60 2oye h GLU 492 Ca -0.05 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.64 2oye h GLU 492 Cb 0.63 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2oye h GLU 492 CO 0.02 0.20 0.01 1.49 -1.16 0.00 0.00 179.01 179.57 2oye h GLU 493 N 0.31 0.00 0.00 2.33 4.81 -1.08 1.00 114.58 121.95 2oye h GLU 493 Ca 0.43 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.66 2oye h GLU 493 Cb 0.72 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.10 2oye h GLU 493 CO -0.49 0.00 -0.17 -0.07 -0.73 0.00 0.00 179.01 177.55 2oye h LEU 494 N 0.00 0.00 -1.29 1.64 3.38 0.39 -3.40 115.31 116.02 2oye h LEU 494 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2oye h LEU 494 Cb 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 2oye h LEU 494 CO -0.00 0.27 -0.07 1.88 0.09 0.00 0.00 178.44 180.61 2oye h TYR 495 N -0.37 0.00 0.00 1.13 -1.99 -1.17 -3.45 116.97 111.12 2oye h TYR 495 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2oye h TYR 495 Cb 0.17 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.90 2oye h TYR 495 CO -0.07 0.07 0.00 0.41 -0.00 0.00 0.00 178.16 178.56 2oye n GLY 496 N 0.12 2.51 3.39 3.88 0.00 0.34 -3.63 105.19 111.80 2oye n GLY 496 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 2oye n GLY 496 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2oye s ASP 497 N -0.21 -0.45 0.20 1.61 2.15 -1.26 -4.93 116.67 113.77 2oye s ASP 497 Ca 0.00 0.53 -0.11 0.00 0.43 0.00 0.00 52.55 53.40 2oye s ASP 497 Cb 0.00 0.55 0.14 0.00 -0.30 0.00 0.00 42.92 43.31 2oye s ASP 497 CO 0.00 -0.47 1.86 -0.29 -0.17 0.00 0.00 175.17 176.11 2oye h ILE 498 N 3.59 1.15 0.00 4.11 6.09 -1.91 -1.92 117.51 128.62 2oye h ILE 498 Ca -0.28 -0.31 0.00 0.00 -1.37 0.00 0.00 64.86 62.90 2oye h ILE 498 Cb 1.16 0.17 0.00 0.00 0.47 0.00 0.00 36.82 38.63 2oye h ILE 498 CO 0.35 0.16 0.00 0.47 -3.07 0.00 0.00 178.15 176.07 2oye n ASP 499 N -4.63 0.00 -0.00 2.19 8.00 -1.26 -1.44 116.55 119.41 2oye n ASP 499 Ca 0.06 0.09 0.08 0.00 0.71 0.00 0.00 54.79 55.73 2oye n ASP 499 Cb 0.03 -0.15 -0.11 0.00 -0.02 0.00 0.00 41.12 40.87 2oye n ASP 499 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2oye n ALA 500 N -1.15 3.25 -1.41 2.24 0.00 -0.72 -4.75 120.51 117.97 2oye n ALA 500 Ca 0.02 -0.42 -0.38 0.00 0.00 0.00 0.00 53.44 52.66 2oye n ALA 500 Cb 0.01 -0.57 0.04 0.00 0.00 0.00 0.00 19.45 18.93 2oye n ALA 500 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2oye n LEU 501 N -1.77 0.22 -4.94 0.00 7.94 -0.52 -4.81 117.00 113.11 2oye n LEU 501 Ca -0.00 0.70 -0.24 0.00 -1.11 0.00 0.00 56.01 55.36 2oye n LEU 501 Cb 0.35 -1.14 0.01 0.00 0.53 0.00 0.00 43.42 43.17 2oye n LEU 501 CO 0.34 -3.29 0.31 -1.61 -1.11 0.00 0.00 177.39 172.03 2oye s GLU 502 N -2.04 3.19 0.05 1.96 2.02 -1.26 -1.45 118.70 121.16 2oye s GLU 502 Ca 0.67 -0.32 -0.35 0.00 0.02 0.00 0.00 54.97 54.98 2oye s GLU 502 Cb -0.44 -2.52 -0.20 0.00 0.10 0.00 0.00 34.13 31.07 2oye s GLU 502 CO 0.56 -0.23 1.48 0.35 0.02 0.00 0.00 175.26 177.45 2oye h PHE 503 N 0.38 -1.15 0.62 1.61 3.57 -1.89 -2.03 116.94 118.04 2oye h PHE 503 Ca -0.47 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 60.97 2oye h PHE 503 Cb 1.24 0.38 0.01 0.00 2.79 0.00 0.00 35.95 40.37 2oye h PHE 503 CO 0.48 -0.72 -0.30 -0.92 -2.23 0.00 0.00 178.31 174.63 2oye h TYR 504 N -1.30 -0.77 -0.91 0.41 3.20 -1.95 -2.71 116.97 112.94 2oye h TYR 504 Ca -0.13 -0.02 0.19 0.00 3.14 0.00 0.00 58.73 61.91 2oye h TYR 504 Cb 0.96 0.26 -0.07 0.00 1.54 0.00 0.00 36.73 39.41 2oye h TYR 504 CO -0.00 -0.44 0.59 -1.35 -1.64 0.00 0.00 178.16 175.32 2oye h PRO 505 N -0.99 0.51 0.50 1.82 0.11 -1.98 -2.49 132.00 129.48 2oye h PRO 505 Ca -0.09 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.97 2oye h PRO 505 Cb 0.68 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.68 2oye h PRO 505 CO 0.14 0.34 -0.24 0.78 -0.21 0.00 0.00 178.00 178.81 2oye h GLY 506 N 0.52 -0.70 -0.98 -0.55 0.00 -1.30 -2.19 103.07 97.89 2oye h GLY 506 Ca 0.48 0.26 0.30 0.00 0.00 0.00 0.00 47.33 48.37 2oye h GLY 506 CO -0.21 -0.25 0.14 1.04 0.00 0.00 0.00 176.54 177.26 2oye n LEU 507 N -4.04 -0.01 0.02 3.11 4.77 -1.03 0.03 117.00 119.85 2oye n LEU 507 Ca -0.08 1.65 0.13 0.00 -0.03 0.00 0.00 56.01 57.68 2oye n LEU 507 Cb 0.26 -0.65 0.50 0.00 -2.33 0.00 0.00 43.42 41.21 2oye n LEU 507 CO 0.20 -1.71 0.83 0.18 -1.33 0.00 0.00 177.39 175.56 2oye n LEU 508 N -5.40 0.23 -0.57 2.23 4.77 -0.96 -3.55 117.00 113.76 2oye n LEU 508 Ca 0.26 0.41 0.06 0.00 -0.03 0.00 0.00 56.01 56.71 2oye n LEU 508 Cb 0.87 -0.42 0.11 0.00 -2.33 0.00 0.00 43.42 41.65 2oye n LEU 508 CO -0.05 -0.00 0.55 0.18 -1.33 0.00 0.00 177.39 176.73 2oye n LEU 509 N -1.63 2.52 -4.76 2.23 4.77 0.10 -2.42 117.00 117.81 2oye n LEU 509 Ca 0.06 -1.59 -0.39 0.00 -0.03 0.00 0.00 56.01 54.06 2oye n LEU 509 Cb 0.36 -0.14 -0.05 0.00 -2.33 0.00 0.00 43.42 41.26 2oye n LEU 509 CO 0.29 0.58 0.71 -0.70 -1.33 0.00 0.00 177.39 176.94 2oye s GLU 510 N -0.97 4.68 0.36 3.23 2.12 -0.68 -4.39 118.70 123.04 2oye s GLU 510 Ca 0.19 1.58 -0.28 0.00 0.36 0.00 0.00 54.97 56.83 2oye s GLU 510 Cb 0.11 -3.12 -0.12 0.00 0.26 0.00 0.00 34.13 31.27 2oye s GLU 510 CO 0.15 0.32 1.38 0.36 -0.54 0.00 0.00 175.26 176.93 2oye n LYS 511 N 1.11 2.38 -4.08 4.30 2.85 -1.08 -3.93 118.16 119.72 2oye n LYS 511 Ca -0.01 0.83 -0.31 0.00 -1.05 0.00 0.00 58.31 57.78 2oye n LYS 511 Cb 0.47 -2.49 -0.07 0.00 -0.65 0.00 0.00 35.03 32.29 2oye n LYS 511 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2oye s HIS 513 N -1.31 3.13 0.19 0.00 0.09 -1.26 -4.88 115.29 111.25 2oye s HIS 513 Ca 0.27 1.45 -0.33 0.00 -0.00 0.00 0.00 55.06 56.45 2oye s HIS 513 Cb -0.12 -3.62 -0.14 0.00 -0.00 0.00 0.00 32.58 28.70 2oye s HIS 513 CO 0.19 -1.66 1.50 -2.30 -0.00 0.00 0.00 174.74 172.47 2oye n PRO 514 N 0.89 2.07 -2.24 8.40 -0.02 -1.26 -1.27 135.00 141.57 2oye n PRO 514 Ca -0.00 0.74 -0.07 0.00 -2.02 0.00 0.00 63.50 62.15 2oye n PRO 514 Cb 0.42 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 2oye n PRO 514 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2oye n ASN 515 N 2.90 -2.69 -4.46 2.55 4.13 -1.26 -5.04 115.26 111.39 2oye n ASN 515 Ca 0.15 -0.03 -0.33 0.00 1.68 0.00 0.00 54.58 56.05 2oye n ASN 515 Cb 0.29 -1.91 -0.13 0.00 -1.54 0.00 0.00 39.78 36.49 2oye n ASN 515 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2oye s SER 516 N -2.76 3.96 0.43 6.41 0.01 -0.40 -4.57 113.70 116.78 2oye s SER 516 Ca 0.03 -0.23 0.21 0.00 1.31 0.00 0.00 55.95 57.27 2oye s SER 516 Cb -0.01 -0.88 0.97 0.00 0.21 0.00 0.00 66.02 66.31 2oye s SER 516 CO 0.04 0.33 1.88 -0.29 0.41 0.00 0.00 173.24 175.60 2oye h ILE 517 N 4.45 0.84 -3.16 1.44 2.10 -1.87 -3.44 117.51 117.86 2oye h ILE 517 Ca -0.44 -1.08 0.03 0.00 1.08 0.00 0.00 64.86 64.44 2oye h ILE 517 Cb 1.16 1.65 -0.06 0.00 -1.09 0.00 0.00 36.82 38.48 2oye h ILE 517 CO 0.50 0.27 0.15 0.72 -1.08 0.00 0.00 178.15 178.71 2oye s PHE 518 N -3.96 -0.02 1.12 2.19 -0.00 -1.26 -2.05 117.98 114.00 2oye s PHE 518 Ca -0.02 -0.43 -0.15 0.00 -0.00 0.00 0.00 56.93 56.33 2oye s PHE 518 Cb 0.12 0.59 0.25 0.00 -0.00 0.00 0.00 43.02 43.99 2oye s PHE 518 CO 0.66 -1.21 1.08 0.20 -0.00 0.00 0.00 175.22 175.95 2oye s GLY 519 N -2.96 1.55 0.16 1.99 0.00 -1.26 -4.54 107.32 102.26 2oye s GLY 519 Ca 0.14 -0.57 -0.23 0.00 0.00 0.00 0.00 44.72 44.07 2oye s GLY 519 CO 0.08 0.18 1.61 -2.09 0.00 0.00 0.00 173.10 172.88 2oye h GLU 520 N -2.34 -0.25 -0.99 2.90 4.81 -1.91 -2.60 114.58 114.21 2oye h GLU 520 Ca -0.52 0.02 0.04 0.00 -0.13 0.00 0.00 59.36 58.76 2oye h GLU 520 Cb 1.32 0.06 -0.06 0.00 0.63 0.00 0.00 28.75 30.70 2oye h GLU 520 CO 0.48 -0.16 0.64 0.77 -0.73 0.00 0.00 179.01 180.01 2oye h SER 521 N -0.26 1.07 -0.65 1.04 0.02 -1.93 -1.41 113.55 111.44 2oye h SER 521 Ca 0.16 -0.01 0.04 0.00 -0.84 0.00 0.00 61.79 61.14 2oye h SER 521 Cb 0.51 -0.24 -0.05 0.00 0.14 0.00 0.00 62.40 62.76 2oye h SER 521 CO -0.46 0.73 0.38 -0.03 -1.14 0.00 0.00 176.83 176.31 2oye h MET 522 N 1.24 0.71 0.32 3.45 1.85 -1.79 0.44 114.93 121.15 2oye h MET 522 Ca 0.40 -0.04 -0.02 0.00 -0.61 0.00 0.00 59.70 59.43 2oye h MET 522 Cb 0.02 -0.16 0.00 0.00 0.43 0.00 0.00 31.60 31.89 2oye h MET 522 CO -0.13 0.47 -0.15 0.82 -0.40 0.00 0.00 176.91 177.52 2oye h ILE 523 N 0.73 0.69 -0.56 1.77 2.04 -1.22 -2.39 117.51 118.57 2oye h ILE 523 Ca 0.27 -0.53 -0.08 0.00 1.00 0.00 0.00 64.86 65.52 2oye h ILE 523 Cb 0.09 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 2oye h ILE 523 CO -0.14 0.10 0.01 -0.33 0.00 0.00 0.00 178.15 177.80 2oye h GLU 524 N -0.73 0.95 0.01 2.37 4.39 -1.16 -2.71 114.58 117.71 2oye h GLU 524 Ca -0.04 -0.28 -0.15 0.00 0.34 0.00 0.00 59.36 59.23 2oye h GLU 524 Cb 0.49 -0.10 0.01 0.00 -0.10 0.00 0.00 28.75 29.06 2oye h GLU 524 CO 0.07 0.93 -0.57 0.52 -1.16 0.00 0.00 179.01 178.80 2oye h MET 525 N 0.88 0.38 0.00 2.33 2.86 -1.00 -3.39 114.93 116.99 2oye h MET 525 Ca 0.16 -0.41 -0.13 0.00 -2.06 0.00 0.00 59.70 57.26 2oye h MET 525 Cb 0.50 0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.26 2oye h MET 525 CO 0.02 1.09 -0.75 0.78 1.06 0.00 0.00 176.91 179.11 2oye h GLY 526 N -0.16 0.00 1.00 8.32 0.00 -1.51 -3.36 103.07 107.36 2oye h GLY 526 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.26 2oye h GLY 526 CO 0.11 0.00 0.32 0.00 0.00 0.00 0.00 176.54 176.97 2oye h ALA 527 N 1.41 0.64 -0.01 3.60 0.00 -1.67 0.11 119.26 123.35 2oye h ALA 527 Ca -0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2oye h ALA 527 Cb 1.48 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 2oye h ALA 527 CO 0.07 0.11 -0.02 -1.35 0.00 0.00 0.00 179.25 178.07 2oye h PRO 528 N 0.68 0.02 0.01 0.00 0.11 -1.76 0.13 132.00 131.19 2oye h PRO 528 Ca 0.18 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.27 2oye h PRO 528 Cb -0.04 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.07 2oye h PRO 528 CO -0.04 0.04 -0.09 0.74 -0.21 0.00 0.00 178.00 178.44 2oye h PHE 529 N 0.02 0.07 -0.32 0.65 0.05 -1.56 -2.86 116.94 113.00 2oye h PHE 529 Ca 0.00 -0.05 0.02 0.00 3.82 0.00 0.00 57.97 61.77 2oye h PHE 529 Cb 0.05 -0.01 -0.03 0.00 2.00 0.00 0.00 35.95 37.97 2oye h PHE 529 CO 0.00 0.95 0.16 0.77 -0.18 0.00 0.00 178.31 180.00 2oye h SER 530 N -0.82 0.23 -0.16 2.17 0.02 -0.32 -2.27 113.55 112.40 2oye h SER 530 Ca -0.01 0.01 -0.20 0.00 -0.84 0.00 0.00 61.79 60.75 2oye h SER 530 Cb 0.98 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.50 2oye h SER 530 CO 0.02 0.17 -0.67 -0.07 -1.14 0.00 0.00 176.83 175.14 2oye h LEU 531 N 0.33 0.91 -1.71 5.07 3.38 -0.90 0.70 115.31 123.09 2oye h LEU 531 Ca 0.13 -0.54 0.10 0.00 0.09 0.00 0.00 57.88 57.66 2oye h LEU 531 Cb 0.05 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 2oye h LEU 531 CO -0.09 1.33 0.37 0.50 0.09 0.00 0.00 178.44 180.65 2oye h LYS 532 N 0.57 0.32 0.00 1.13 1.63 -1.46 -0.89 116.57 117.87 2oye h LYS 532 Ca -0.02 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 2oye h LYS 532 Cb 1.28 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.84 2oye h LYS 532 CO 0.14 0.21 0.00 0.41 -3.45 0.00 0.00 179.45 176.76 2oye n GLY 533 N -1.54 -0.88 0.40 5.01 0.00 -0.86 -1.22 105.19 106.10 2oye n GLY 533 Ca 0.09 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.06 2oye n GLY 533 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2oye h LEU 534 N 0.00 -1.71 0.00 0.99 -0.00 -0.72 0.79 115.31 114.66 2oye h LEU 534 Ca 0.00 0.32 0.00 0.00 -0.00 0.00 0.00 57.88 58.20 2oye h LEU 534 Cb 0.00 0.83 0.00 0.00 -0.00 0.00 0.00 40.66 41.49 2oye h LEU 534 CO 0.00 -0.27 -0.08 0.18 -0.00 0.00 0.00 178.44 178.27 2oye n LEU 535 N -5.39 0.49 0.00 1.67 7.99 -0.35 -3.40 117.00 118.01 2oye n LEU 535 Ca 0.07 0.49 0.11 0.00 -0.01 0.00 0.00 56.01 56.67 2oye n LEU 535 Cb 0.35 -0.37 0.65 0.00 -0.11 0.00 0.00 43.42 43.94 2oye n LEU 535 CO -0.14 -0.09 0.91 0.61 -1.51 0.00 0.00 177.39 177.17 2oye n GLY 536 N 1.39 -0.96 3.73 -0.72 0.00 0.26 -4.73 105.19 104.16 2oye n GLY 536 Ca 0.06 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 2oye n GLY 536 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2oye s ASN 537 N -1.72 7.10 0.52 1.61 3.84 -1.18 -1.84 114.94 123.28 2oye s ASN 537 Ca 0.33 2.19 0.28 0.00 0.21 0.00 0.00 52.86 55.87 2oye s ASN 537 Cb 0.15 -2.60 1.41 0.00 -0.55 0.00 0.00 41.25 39.66 2oye s ASN 537 CO 0.25 -0.37 1.93 1.55 -2.79 0.00 0.00 177.10 177.67 2oye h PRO 538 N 5.45 0.04 0.00 0.43 0.13 -1.88 0.24 132.00 136.41 2oye h PRO 538 Ca -0.44 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2oye h PRO 538 Cb 1.21 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2oye h PRO 538 CO 0.75 0.03 0.00 0.44 -0.23 0.00 0.00 178.00 178.99 2oye n ILE 539 N -4.33 0.86 0.24 -3.56 -5.35 -1.26 -1.82 119.36 104.14 2oye n ILE 539 Ca 0.15 0.35 0.12 0.00 -0.27 0.00 0.00 62.75 63.10 2oye n ILE 539 Cb 0.80 -1.30 0.15 0.00 -1.74 0.00 0.00 39.64 37.56 2oye n ILE 539 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2oye s SER 541 N -5.85 4.47 0.26 0.00 1.04 -0.75 -4.78 113.70 108.09 2oye s SER 541 Ca 0.06 1.92 -0.03 0.00 0.48 0.00 0.00 55.95 58.38 2oye s SER 541 Cb 0.07 -2.54 0.36 0.00 0.10 0.00 0.00 66.02 64.02 2oye s SER 541 CO 0.69 -2.06 1.89 -0.65 0.98 0.00 0.00 173.24 174.10 2oye h PRO 542 N -0.89 1.19 -0.57 4.02 0.11 -1.90 -1.51 132.00 132.45 2oye h PRO 542 Ca -0.44 -0.07 0.08 0.00 0.11 0.00 0.00 66.00 65.67 2oye h PRO 542 Cb 1.24 -0.27 -0.06 0.00 0.11 0.00 0.00 31.00 32.02 2oye h PRO 542 CO 0.51 0.79 0.23 1.49 -0.21 0.00 0.00 178.00 180.81 2oye h GLU 543 N 1.22 0.42 0.08 1.05 4.57 -1.91 -3.28 114.58 116.73 2oye h GLU 543 Ca 0.41 -0.03 -0.34 0.00 -1.18 0.00 0.00 59.36 58.23 2oye h GLU 543 Cb 0.08 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.55 2oye h GLU 543 CO -0.15 0.28 -1.89 0.66 -1.18 0.00 0.00 179.01 176.73 2oye n TYR 544 N -4.96 1.16 -0.02 0.92 0.53 -1.01 -4.64 117.16 109.15 2oye n TYR 544 Ca 0.07 0.30 -0.00 0.00 -1.02 0.00 0.00 57.90 57.25 2oye n TYR 544 Cb 0.22 -1.17 -0.00 0.00 -1.03 0.00 0.00 39.34 37.36 2oye n TYR 544 CO 0.00 0.00 0.00 1.87 -1.02 0.00 0.00 176.86 177.71 2oye n TRP 545 N -3.32 0.00 -4.11 -0.72 -0.00 -0.60 -4.56 117.44 104.13 2oye n TRP 545 Ca -0.26 -0.03 -0.22 0.00 -0.00 0.00 0.00 57.50 56.98 2oye n TRP 545 Cb 1.05 -0.32 -0.06 0.00 -0.00 0.00 0.00 31.31 31.98 2oye n TRP 545 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 2oye s LYS 546 N 2.32 2.54 0.54 5.87 1.02 -1.26 -5.01 119.74 125.75 2oye s LYS 546 Ca 0.01 -1.35 0.33 0.00 0.02 0.00 0.00 55.97 54.97 2oye s LYS 546 Cb 0.00 -2.31 1.30 0.00 -0.52 0.00 0.00 37.83 36.30 2oye s LYS 546 CO 0.00 0.25 1.96 0.00 -0.92 0.00 0.00 175.35 176.64 2oye h ALA 547 N 1.58 1.00 -0.03 5.17 0.00 -1.87 -2.83 119.26 122.29 2oye h ALA 547 Ca -0.45 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.33 2oye h ALA 547 Cb 1.25 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 2oye h ALA 547 CO 0.61 0.00 -0.58 0.66 0.00 0.00 0.00 179.25 179.94 2oye h SER 548 N 0.00 0.10 0.07 0.00 4.64 -1.92 -2.91 113.55 113.52 2oye h SER 548 Ca 0.00 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.26 2oye h SER 548 Cb 0.54 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.60 2oye h SER 548 CO 0.00 0.66 -0.03 0.74 -0.87 0.00 0.00 176.83 177.33 2oye h THR 549 N 0.07 0.63 -0.56 2.95 2.02 -1.74 0.72 112.91 117.00 2oye h THR 549 Ca -0.00 -0.12 -0.36 0.00 0.77 0.00 0.00 66.41 66.70 2oye h THR 549 Cb 1.04 1.07 -0.23 0.00 -1.74 0.00 0.00 68.15 68.30 2oye h THR 549 CO 0.08 0.03 -0.16 0.49 0.37 0.00 0.00 175.52 176.33 2oye n PHE 550 N -3.93 1.86 -2.25 3.16 3.01 -1.15 -4.84 117.46 113.32 2oye n PHE 550 Ca -0.03 -2.00 0.00 0.00 1.01 0.00 0.00 57.45 56.43 2oye n PHE 550 Cb 0.12 -0.59 0.00 0.00 -0.01 0.00 0.00 39.48 39.00 2oye n PHE 550 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2oye n GLY 551 N -0.98 0.00 0.00 1.37 0.00 0.25 -3.42 105.19 102.41 2oye n GLY 551 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.43 2oye n GLY 551 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oye n GLY 552 N 1.65 -0.29 0.14 -0.02 0.00 -1.11 -4.06 105.19 101.50 2oye n GLY 552 Ca 0.00 -1.86 0.04 0.00 0.00 0.00 0.00 46.02 44.20 2oye n GLY 552 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2oye h GLU 553 N 0.00 0.00 -0.47 1.61 4.57 -1.86 -3.30 114.58 115.13 2oye h GLU 553 Ca 0.00 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.11 2oye h GLU 553 Cb 0.00 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 2oye h GLU 553 CO 0.00 0.36 0.01 -0.39 -1.18 0.00 0.00 179.01 177.81 2oye h VAL 554 N 0.00 1.24 -0.01 0.32 -1.51 -1.87 -1.27 116.25 113.15 2oye h VAL 554 Ca -0.03 -0.96 -0.00 0.00 -1.23 0.00 0.00 66.70 64.47 2oye h VAL 554 Cb 1.34 0.87 -0.00 0.00 -2.13 0.00 0.00 31.29 31.36 2oye h VAL 554 CO 0.05 0.34 -0.00 1.23 -1.23 0.00 0.00 177.57 177.96 2oye h GLY 555 N 0.96 0.02 0.61 5.19 0.00 -1.63 -2.82 103.07 105.41 2oye h GLY 555 Ca 0.14 -0.02 0.02 0.00 0.00 0.00 0.00 47.33 47.47 2oye h GLY 555 CO 0.02 0.02 -0.20 -2.75 0.00 0.00 0.00 176.54 173.62 2oye h PHE 556 N -0.32 -0.54 -0.56 5.60 3.04 -1.62 -1.78 116.94 120.77 2oye h PHE 556 Ca 0.00 0.01 0.08 0.00 3.98 0.00 0.00 57.97 62.05 2oye h PHE 556 Cb 0.36 0.23 -0.03 0.00 2.56 0.00 0.00 35.95 39.07 2oye h PHE 556 CO 0.05 -0.29 0.37 -0.91 -2.02 0.00 0.00 178.31 175.51 2oye h ASN 557 N -0.37 0.37 -0.49 0.41 2.35 -1.30 0.12 115.58 116.67 2oye h ASN 557 Ca 0.04 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 2oye h ASN 557 Cb 0.41 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.68 2oye h ASN 557 CO -0.14 0.23 0.26 -0.07 -1.65 0.00 0.00 177.43 176.06 2oye h LEU 558 N 0.42 0.62 -0.88 1.61 3.38 -1.07 0.17 115.31 119.57 2oye h LEU 558 Ca 0.25 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 2oye h LEU 558 Cb 0.45 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2oye h LEU 558 CO -0.07 0.55 -0.26 0.58 0.09 0.00 0.00 178.44 179.33 2oye h VAL 559 N 0.65 1.27 0.00 1.22 2.07 -0.60 -2.25 116.25 118.61 2oye h VAL 559 Ca 0.17 -1.31 -0.03 0.00 0.82 0.00 0.00 66.70 66.36 2oye h VAL 559 Cb 0.08 1.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2oye h VAL 559 CO -0.03 0.42 -0.12 0.11 0.02 0.00 0.00 177.57 177.97 2oye h LYS 560 N 0.47 0.00 0.00 1.57 1.57 -0.09 -3.33 116.57 116.76 2oye h LYS 560 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2oye h LYS 560 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.01 2oye h LYS 560 CO 0.05 0.12 -0.01 0.25 -0.57 0.00 0.00 179.45 179.30 2oye n THR 561 N -3.18 1.18 -1.68 -0.16 -2.24 0.54 -5.06 114.28 103.68 2oye n THR 561 Ca 0.02 -1.28 -0.41 0.00 -2.27 0.00 0.00 64.05 60.11 2oye n THR 561 Cb 0.47 0.32 0.01 0.00 -2.10 0.00 0.00 70.33 69.04 2oye n THR 561 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2oye n ALA 562 N -0.72 0.97 -2.38 6.98 0.00 -0.85 -5.01 120.51 119.49 2oye n ALA 562 Ca 0.04 0.26 -0.11 0.00 0.00 0.00 0.00 53.44 53.63 2oye n ALA 562 Cb 0.37 -2.21 -0.09 0.00 0.00 0.00 0.00 19.45 17.52 2oye n ALA 562 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2oye s THR 563 N -1.21 0.02 -0.05 0.00 2.01 -1.26 -4.65 115.64 110.50 2oye s THR 563 Ca 0.61 -1.85 -0.24 0.00 0.31 0.00 0.00 61.69 60.52 2oye s THR 563 Cb -0.53 -2.33 -0.23 0.00 0.01 0.00 0.00 72.50 69.42 2oye s THR 563 CO 0.58 -0.10 1.05 0.25 -0.69 0.00 0.00 174.62 175.71 2oye h LEU 564 N 2.60 0.21 -1.64 4.42 6.46 -1.95 -2.41 115.31 123.00 2oye h LEU 564 Ca -0.34 -0.75 0.18 0.00 -0.12 0.00 0.00 57.88 56.85 2oye h LEU 564 Cb 1.24 -0.07 -0.05 0.00 -0.73 0.00 0.00 40.66 41.05 2oye h LEU 564 CO 0.51 0.94 0.54 0.50 -0.62 0.00 0.00 178.44 180.30 2oye h LYS 565 N -0.49 0.32 0.02 1.25 3.64 -1.97 -0.76 116.57 118.58 2oye h LYS 565 Ca -0.03 -0.02 -0.24 0.00 -1.27 0.00 0.00 60.65 59.09 2oye h LYS 565 Cb 0.96 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.68 2oye h LYS 565 CO 0.04 0.21 -1.23 0.87 -2.27 0.00 0.00 179.45 177.08 2oye h LYS 566 N 0.33 0.03 -0.31 1.90 1.57 -1.95 -2.22 116.57 115.92 2oye h LYS 566 Ca 0.40 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 59.05 2oye h LYS 566 Cb 1.06 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.37 2oye h LYS 566 CO -0.12 0.90 -0.10 1.25 -0.57 0.00 0.00 179.45 180.81 2oye h LEU 567 N 0.01 0.50 0.00 2.94 5.85 -0.63 -2.76 115.31 121.23 2oye h LEU 567 Ca -0.10 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.49 2oye h LEU 567 Cb 1.86 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.76 2oye h LEU 567 CO 0.12 0.64 0.00 0.52 -0.34 0.00 0.00 178.44 179.39 2oye n VAL 568 N -4.21 0.00 0.00 1.05 0.31 -0.92 -4.05 118.33 110.51 2oye n VAL 568 Ca 0.01 0.44 0.00 0.00 -0.01 0.00 0.00 64.34 64.77 2oye n VAL 568 Cb 0.31 -1.35 0.00 0.00 -0.91 0.00 0.00 33.84 31.89 2oye n VAL 568 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2oye n LEU 570 N -1.29 1.24 -1.97 0.00 7.94 -1.04 -4.10 117.00 117.78 2oye n LEU 570 Ca 0.00 0.33 -0.11 0.00 -1.11 0.00 0.00 56.01 55.12 2oye n LEU 570 Cb 0.11 -0.11 0.26 0.00 0.53 0.00 0.00 43.42 44.21 2oye n LEU 570 CO 0.00 0.51 1.08 0.59 -1.11 0.00 0.00 177.39 178.46 2oye n ASN 571 N -3.12 4.31 -3.85 1.96 3.02 0.71 -4.97 115.26 113.31 2oye n ASN 571 Ca -0.22 -3.38 -0.24 0.00 -0.03 0.00 0.00 54.58 50.71 2oye n ASN 571 Cb 1.06 -0.76 -0.08 0.00 -0.61 0.00 0.00 39.78 39.39 2oye n ASN 571 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2oye s THR 572 N -3.10 0.37 -0.17 3.41 -4.23 -1.05 -5.01 115.64 105.86 2oye s THR 572 Ca 0.55 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.91 2oye s THR 572 Cb 0.45 -2.35 -0.09 0.00 1.34 0.00 0.00 72.50 71.85 2oye s THR 572 CO 0.12 0.00 -0.09 2.29 -0.54 0.00 0.00 174.62 176.39 2oye n LYS 573 N -0.85 0.50 -4.12 3.99 0.00 -1.26 -4.94 118.16 111.48 2oye n LYS 573 Ca -0.02 0.49 -0.32 0.00 -0.00 0.00 0.00 58.31 58.46 2oye n LYS 573 Cb 0.64 -1.67 -0.07 0.00 -0.00 0.00 0.00 35.03 33.93 2oye n LYS 573 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2oye s THR 574 N -2.36 4.53 -0.67 0.58 -4.23 -1.26 -5.07 115.64 107.16 2oye s THR 574 Ca -0.22 -0.59 -0.20 0.00 -1.18 0.00 0.00 61.69 59.50 2oye s THR 574 Cb 0.04 -3.10 0.10 0.00 1.34 0.00 0.00 72.50 70.88 2oye s THR 574 CO 0.37 0.27 0.86 0.00 -0.54 0.00 0.00 174.62 175.58 2oye n PRO 576 N 6.85 0.66 -3.70 0.00 -0.04 -1.26 -5.00 135.00 132.51 2oye n PRO 576 Ca -0.03 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.05 2oye n PRO 576 Cb 0.45 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.79 2oye n PRO 576 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 2oye s TYR 577 N -0.19 3.31 -0.07 0.54 5.04 -1.26 -5.01 117.35 119.71 2oye s TYR 577 Ca 0.00 -1.52 0.04 0.00 -2.44 0.00 0.00 57.07 53.15 2oye s TYR 577 Cb 0.00 -2.60 -0.02 0.00 0.35 0.00 0.00 41.96 39.70 2oye s TYR 577 CO 0.00 -0.79 -0.19 0.54 -1.34 0.00 0.00 175.55 173.77 2oye s VAL 578 N 1.39 2.60 -0.18 3.14 0.11 -1.26 -4.13 120.40 122.07 2oye s VAL 578 Ca 0.01 -0.87 -0.35 0.00 -2.93 0.00 0.00 61.98 57.84 2oye s VAL 578 Cb -0.21 -2.01 0.14 0.00 -1.53 0.00 0.00 36.38 32.78 2oye s VAL 578 CO 0.02 0.57 1.32 -0.94 -3.33 0.00 0.00 175.10 172.73 2oye s SER 579 N -0.21 -0.06 0.00 3.54 1.04 -1.26 -4.75 113.70 112.00 2oye s SER 579 Ca -0.01 -0.03 0.12 0.00 0.48 0.00 0.00 55.95 56.52 2oye s SER 579 Cb -0.13 0.08 0.35 0.00 0.10 0.00 0.00 66.02 66.42 2oye s SER 579 CO 0.03 -0.14 1.29 0.49 0.98 0.00 0.00 173.24 175.89 2oye n PHE 580 N -0.19 0.49 -3.78 5.02 0.99 -1.26 -4.50 117.46 114.23 2oye n PHE 580 Ca -0.01 -0.24 -0.13 0.00 -0.00 0.00 0.00 57.45 57.07 2oye n PHE 580 Cb 0.59 0.00 -0.10 0.00 -1.00 0.00 0.00 39.48 38.97 2oye n PHE 580 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.76 173.38 2oye s HIS 581 N -1.51 -0.26 0.44 1.38 -3.43 -1.26 -3.01 115.29 107.63 2oye s HIS 581 Ca 0.26 0.59 -0.24 0.00 -0.80 0.00 0.00 55.06 54.87 2oye s HIS 581 Cb 0.13 0.09 -0.10 0.00 -1.43 0.00 0.00 32.58 31.28 2oye s HIS 581 CO 0.18 -0.22 1.11 1.55 -2.00 0.00 0.00 174.74 175.35 2oye n VAL 582 N 2.40 2.62 -1.60 -5.38 3.14 0.25 -4.83 118.33 114.93 2oye n VAL 582 Ca -0.16 -0.50 -0.33 0.00 -2.96 0.00 0.00 64.34 60.39 2oye n VAL 582 Cb 0.57 -1.31 0.07 0.00 -1.06 0.00 0.00 33.84 32.11 2oye n VAL 582 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 2oye s PRO 583 N -2.16 2.49 0.00 1.45 0.04 -1.26 -5.00 135.00 130.56 2oye s PRO 583 Ca 0.64 1.53 0.00 0.00 0.04 0.00 0.00 61.00 63.21 2oye s PRO 583 Cb -0.53 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.11 2oye s PRO 583 CO 0.56 -1.52 0.00 -3.47 0.04 0.00 0.00 177.00 172.61