#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bil n ASN -1 N 0.00 -0.67 -4.12 1.61 4.13 -0.98 -3.63 115.26 111.59 1bil n ASN -1 Ca 0.00 -2.54 -0.11 0.00 1.68 0.00 0.00 54.58 53.61 1bil n ASN -1 Cb 0.00 -0.29 -0.11 0.00 -1.54 0.00 0.00 39.78 37.85 1bil n ASN -1 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1bil s THR 0 N -0.17 0.62 -0.25 3.41 2.01 -0.99 -4.77 115.64 115.50 1bil s THR 0 Ca 0.33 -1.58 -0.15 0.00 0.31 0.00 0.00 61.69 60.60 1bil s THR 0 Cb 0.08 -1.23 0.07 0.00 0.01 0.00 0.00 72.50 71.43 1bil s THR 0 CO -0.17 -0.67 0.62 -0.89 -0.69 0.00 0.00 174.62 172.82 1bil s THR 1 N -2.70 -0.01 -0.20 -0.82 2.01 -1.26 0.05 115.64 112.71 1bil s THR 1 Ca 0.03 0.02 0.01 0.00 0.31 0.00 0.00 61.69 62.06 1bil s THR 1 Cb -0.01 -0.90 0.04 0.00 0.01 0.00 0.00 72.50 71.64 1bil s THR 1 CO -0.03 0.01 -0.13 -0.55 -0.69 0.00 0.00 174.62 173.23 1bil s SER 2 N 1.40 3.39 0.17 3.53 0.15 -0.61 -4.95 113.70 116.79 1bil s SER 2 Ca -0.08 -0.85 -0.22 0.00 0.70 0.00 0.00 55.95 55.49 1bil s SER 2 Cb -0.06 -1.34 -0.08 0.00 -1.71 0.00 0.00 66.02 62.84 1bil s SER 2 CO -0.15 -0.10 0.72 -0.55 1.20 0.00 0.00 173.24 174.35 1bil s SER 3 N 1.34 7.21 -0.12 5.45 0.15 -1.26 -1.26 113.70 125.21 1bil s SER 3 Ca -0.00 1.50 0.00 0.00 0.70 0.00 0.00 55.95 58.15 1bil s SER 3 Cb -0.16 -2.45 0.02 0.00 -1.71 0.00 0.00 66.02 61.73 1bil s SER 3 CO -0.09 0.15 -0.10 -0.69 1.20 0.00 0.00 173.24 173.71 1bil s VAL 4 N -1.29 1.19 0.23 4.45 1.01 0.43 -4.64 120.40 121.78 1bil s VAL 4 Ca 0.37 -0.40 -0.30 0.00 0.00 0.00 0.00 61.98 61.66 1bil s VAL 4 Cb -0.20 -1.16 -0.09 0.00 0.00 0.00 0.00 36.38 34.93 1bil s VAL 4 CO 0.23 0.39 1.04 -0.63 0.00 0.00 0.00 175.10 176.13 1bil s ILE 5 N 1.54 3.83 0.03 2.22 1.01 -1.26 -1.73 121.20 126.83 1bil s ILE 5 Ca 0.03 1.75 0.08 0.00 0.00 0.00 0.00 60.65 62.51 1bil s ILE 5 Cb -0.13 -4.11 -0.03 0.00 0.01 0.00 0.00 42.46 38.20 1bil s ILE 5 CO -0.08 0.38 -0.24 -0.76 0.00 0.00 0.00 174.94 174.24 1bil s LEU 6 N -1.00 2.24 0.10 2.97 1.43 -0.67 -4.33 118.68 119.42 1bil s LEU 6 Ca 0.45 -0.52 -0.07 0.00 -1.03 0.00 0.00 54.13 52.95 1bil s LEU 6 Cb -0.29 -1.35 -0.06 0.00 0.03 0.00 0.00 46.19 44.53 1bil s LEU 6 CO 0.36 0.27 0.38 -0.89 0.23 0.00 0.00 176.35 176.70 1bil s THR 7 N -0.78 5.14 -0.16 5.49 2.01 0.14 -2.62 115.64 124.86 1bil s THR 7 Ca 0.12 0.26 0.01 0.00 0.31 0.00 0.00 61.69 62.39 1bil s THR 7 Cb -0.10 -3.63 0.01 0.00 0.01 0.00 0.00 72.50 68.79 1bil s THR 7 CO 0.02 0.19 -0.18 0.21 -0.69 0.00 0.00 174.62 174.17 1bil s ASN 8 N -2.02 3.42 -0.31 3.53 3.04 -1.26 -1.50 114.94 119.83 1bil s ASN 8 Ca 0.36 -0.54 -0.02 0.00 0.04 0.00 0.00 52.86 52.70 1bil s ASN 8 Cb -0.13 -1.52 0.05 0.00 -1.54 0.00 0.00 41.25 38.12 1bil s ASN 8 CO 0.20 0.07 0.02 -0.47 -3.04 0.00 0.00 177.10 173.88 1bil s TYR 9 N 0.92 3.30 -1.59 0.43 5.04 -0.13 -4.69 117.35 120.63 1bil s TYR 9 Ca -0.04 -1.91 0.00 0.00 -2.44 0.00 0.00 57.07 52.69 1bil s TYR 9 Cb -0.15 -2.22 0.00 0.00 0.35 0.00 0.00 41.96 39.94 1bil s TYR 9 CO -0.03 -0.82 0.00 -1.33 -1.34 0.00 0.00 175.55 172.04 1bil n MET 10 N 4.63 -1.42 -0.93 4.97 2.81 -1.26 -1.91 117.12 124.01 1bil n MET 10 Ca -0.12 0.89 0.00 0.00 -1.81 0.00 0.00 57.70 56.66 1bil n MET 10 Cb 0.43 -5.21 0.00 0.00 -0.71 0.00 0.00 33.22 27.73 1bil n MET 10 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1bil n ASP 11 N -0.88 -3.92 -0.01 7.83 8.00 -1.26 -4.74 116.55 121.57 1bil n ASP 11 Ca -0.16 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.36 1bil n ASP 11 Cb 0.52 -2.31 -0.04 0.00 -0.02 0.00 0.00 41.12 39.27 1bil n ASP 11 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1bil n THR 12 N -2.26 0.08 -4.24 -3.53 -2.24 -0.80 -4.94 114.28 96.34 1bil n THR 12 Ca 0.00 -0.15 -0.23 0.00 -2.27 0.00 0.00 64.05 61.39 1bil n THR 12 Cb 0.26 0.10 -0.17 0.00 -2.10 0.00 0.00 70.33 68.42 1bil n THR 12 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1bil s GLN 13 N -2.35 1.29 -0.11 -0.78 -0.21 -0.94 -4.57 119.66 112.00 1bil s GLN 13 Ca -0.02 -0.24 0.02 0.00 0.02 0.00 0.00 55.36 55.14 1bil s GLN 13 Cb 0.03 -1.23 0.01 0.00 1.00 0.00 0.00 33.01 32.83 1bil s GLN 13 CO 0.24 -0.10 -0.16 0.71 -2.12 0.00 0.00 175.29 173.86 1bil s TYR 14 N 1.07 2.08 0.07 0.91 1.51 -1.26 -0.95 117.35 120.79 1bil s TYR 14 Ca -0.08 -0.99 -0.08 0.00 -1.01 0.00 0.00 57.07 54.91 1bil s TYR 14 Cb -0.14 -1.48 -0.00 0.00 -0.11 0.00 0.00 41.96 40.22 1bil s TYR 14 CO -0.01 -0.50 0.17 1.52 -1.11 0.00 0.00 175.55 175.63 1bil s TYR 15 N 0.95 0.16 0.33 2.71 1.13 -0.56 -4.52 117.35 117.55 1bil s TYR 15 Ca -0.07 -0.56 0.03 0.00 -1.41 0.00 0.00 57.07 55.06 1bil s TYR 15 Cb -0.15 -0.08 -0.04 0.00 -1.10 0.00 0.00 41.96 40.59 1bil s TYR 15 CO -0.01 -0.50 0.14 0.20 -2.51 0.00 0.00 175.55 172.86 1bil s GLY 16 N -2.69 2.18 0.19 5.49 0.00 -0.76 0.25 107.32 111.99 1bil s GLY 16 Ca 0.03 -1.68 -0.06 0.00 0.00 0.00 0.00 44.72 43.01 1bil s GLY 16 CO -0.09 -1.68 0.46 -0.54 0.00 0.00 0.00 173.10 171.25 1bil s GLU 17 N -3.81 3.68 0.06 2.90 2.02 -1.26 -0.41 118.70 121.88 1bil s GLU 17 Ca 0.33 0.03 0.01 0.00 0.02 0.00 0.00 54.97 55.37 1bil s GLU 17 Cb 0.05 -2.75 -0.03 0.00 0.10 0.00 0.00 34.13 31.49 1bil s GLU 17 CO 0.16 0.38 -0.06 0.96 0.02 0.00 0.00 175.26 176.72 1bil s ILE 18 N -1.77 0.52 -0.12 -1.63 -4.36 0.04 -4.70 121.20 109.18 1bil s ILE 18 Ca 0.43 -1.44 0.02 0.00 -0.26 0.00 0.00 60.65 59.40 1bil s ILE 18 Cb -0.12 -1.04 -0.01 0.00 1.25 0.00 0.00 42.46 42.54 1bil s ILE 18 CO 0.24 -0.63 -0.18 -0.83 0.24 0.00 0.00 174.94 173.78 1bil s GLY 19 N -2.22 1.44 -0.16 6.27 0.00 -0.94 -0.05 107.32 111.66 1bil s GLY 19 Ca -0.01 -0.94 -0.02 0.00 0.00 0.00 0.00 44.72 43.75 1bil s GLY 19 CO -0.03 -0.23 -0.08 -0.42 0.00 0.00 0.00 173.10 172.34 1bil s ILE 20 N 0.39 3.35 0.00 0.90 1.01 -0.55 0.23 121.20 126.53 1bil s ILE 20 Ca -0.14 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 59.97 1bil s ILE 20 Cb -0.17 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 39.84 1bil s ILE 20 CO 0.07 0.49 0.00 0.61 0.00 0.00 0.00 174.94 176.10 1bil n GLY 21 N 3.88 -3.44 2.86 6.18 0.00 0.21 -0.74 105.19 114.14 1bil n GLY 21 Ca -0.18 -1.86 -0.28 0.00 0.00 0.00 0.00 46.02 43.71 1bil n GLY 21 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bil s THR 22 N -1.00 0.98 0.66 2.61 2.01 -1.26 0.10 115.64 119.75 1bil s THR 22 Ca 0.00 -0.59 -0.13 0.00 0.31 0.00 0.00 61.69 61.28 1bil s THR 22 Cb 0.00 -1.21 -0.00 0.00 0.01 0.00 0.00 72.50 71.29 1bil s THR 22 CO 0.00 0.08 1.07 -2.16 -0.69 0.00 0.00 174.62 172.92 1bil s PRO 23 N 1.68 2.95 0.67 4.92 0.04 -1.26 -1.16 135.00 142.84 1bil s PRO 23 Ca 0.00 1.15 -0.17 0.00 0.04 0.00 0.00 61.00 62.03 1bil s PRO 23 Cb -0.15 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.40 1bil s PRO 23 CO -0.07 -1.11 1.28 -1.25 0.04 0.00 0.00 177.00 175.89 1bil s PRO 24 N -4.50 2.43 -0.06 0.56 0.04 0.12 -4.94 135.00 128.65 1bil s PRO 24 Ca 0.62 2.00 -0.03 0.00 0.04 0.00 0.00 61.00 63.63 1bil s PRO 24 Cb -0.16 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 1bil s PRO 24 CO 0.46 -1.68 0.11 -0.65 0.04 0.00 0.00 177.00 175.28 1bil s GLN 25 N -3.50 3.25 -0.17 4.56 -0.21 0.08 -4.84 119.66 118.82 1bil s GLN 25 Ca 0.81 -0.33 -0.06 0.00 0.02 0.00 0.00 55.36 55.80 1bil s GLN 25 Cb -0.36 -3.00 -0.04 0.00 1.00 0.00 0.00 33.01 30.62 1bil s GLN 25 CO 0.41 0.71 0.02 0.99 -2.12 0.00 0.00 175.29 175.30 1bil s THR 26 N -1.12 4.46 0.20 -0.19 2.01 -1.26 -1.48 115.64 118.26 1bil s THR 26 Ca 0.20 -0.15 0.09 0.00 0.31 0.00 0.00 61.69 62.13 1bil s THR 26 Cb -0.12 -2.99 -0.04 0.00 0.01 0.00 0.00 72.50 69.36 1bil s THR 26 CO 0.10 0.48 -0.17 -0.36 -0.69 0.00 0.00 174.62 173.98 1bil s PHE 27 N 0.30 1.83 -0.19 4.92 0.40 0.93 -4.95 117.98 121.22 1bil s PHE 27 Ca 0.01 -0.50 -0.11 0.00 -0.60 0.00 0.00 56.93 55.73 1bil s PHE 27 Cb -0.13 -0.87 -0.05 0.00 0.51 0.00 0.00 43.02 42.48 1bil s PHE 27 CO 0.01 0.39 0.17 0.15 0.70 0.00 0.00 175.22 176.64 1bil s LYS 28 N -3.24 4.18 0.17 0.44 1.02 -1.26 -0.78 119.74 120.26 1bil s LYS 28 Ca 0.20 -0.14 0.03 0.00 0.02 0.00 0.00 55.97 56.08 1bil s LYS 28 Cb -0.03 -3.41 -0.05 0.00 -0.52 0.00 0.00 37.83 33.82 1bil s LYS 28 CO 0.08 0.31 -0.03 0.14 -0.92 0.00 0.00 175.35 174.92 1bil s VAL 29 N 0.33 0.84 -0.18 3.17 -7.23 0.45 -0.11 120.40 117.67 1bil s VAL 29 Ca 0.10 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.23 1bil s VAL 29 Cb -0.11 -2.04 -0.03 0.00 0.56 0.00 0.00 36.38 34.75 1bil s VAL 29 CO -0.00 -0.56 -0.02 -0.69 -0.31 0.00 0.00 175.10 173.52 1bil s VAL 30 N -3.54 3.95 -0.60 1.32 1.01 -0.75 -1.83 120.40 119.96 1bil s VAL 30 Ca 0.22 -0.32 -0.20 0.00 0.00 0.00 0.00 61.98 61.67 1bil s VAL 30 Cb 0.05 -2.76 0.09 0.00 0.00 0.00 0.00 36.38 33.76 1bil s VAL 30 CO 0.03 0.46 0.79 -0.36 0.00 0.00 0.00 175.10 176.02 1bil s PHE 31 N 0.66 2.88 -0.34 5.22 0.40 -1.26 0.20 117.98 125.74 1bil s PHE 31 Ca -0.01 -0.74 -0.08 0.00 -0.60 0.00 0.00 56.93 55.50 1bil s PHE 31 Cb -0.14 -4.06 0.03 0.00 0.51 0.00 0.00 43.02 39.35 1bil s PHE 31 CO 0.02 -1.39 0.14 0.34 0.70 0.00 0.00 175.22 175.03 1bil s ASP 32 N 3.52 5.43 0.00 1.36 2.15 -0.91 -4.30 116.67 123.92 1bil s ASP 32 Ca 0.16 -0.98 0.23 0.00 0.43 0.00 0.00 52.55 52.39 1bil s ASP 32 Cb -0.21 -1.93 1.09 0.00 -0.30 0.00 0.00 42.92 41.57 1bil s ASP 32 CO 0.09 -0.31 1.73 0.35 -0.17 0.00 0.00 175.17 176.86 1bil n THR 33 N 4.89 0.34 1.61 1.71 -2.24 -1.26 0.32 114.28 119.66 1bil n THR 33 Ca -0.13 0.09 0.14 0.00 -2.27 0.00 0.00 64.05 61.87 1bil n THR 33 Cb 0.46 -0.71 0.61 0.00 -2.10 0.00 0.00 70.33 68.59 1bil n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bil n GLY 34 N 0.68 -0.27 3.71 3.38 0.00 -1.26 -4.07 105.19 107.37 1bil n GLY 34 Ca 0.09 -0.36 -0.09 0.00 0.00 0.00 0.00 46.02 45.66 1bil n GLY 34 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bil s SER 35 N -1.90 -0.02 0.00 1.61 1.04 -1.11 -4.94 113.70 108.37 1bil s SER 35 Ca 0.39 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.90 1bil s SER 35 Cb 0.20 0.70 0.00 0.00 0.10 0.00 0.00 66.02 67.02 1bil s SER 35 CO 0.32 -1.34 0.56 -1.20 0.98 0.00 0.00 173.24 172.57 1bil n SER 36 N -0.72 1.05 -4.85 7.02 7.64 -1.26 0.14 113.62 122.63 1bil n SER 36 Ca -0.03 -1.27 -0.33 0.00 1.01 0.00 0.00 58.87 58.25 1bil n SER 36 Cb 0.60 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.75 1bil n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1bil s ASN 37 N -0.27 6.09 -0.19 6.43 -0.87 -1.26 -4.32 114.94 120.55 1bil s ASN 37 Ca 0.00 0.27 -0.08 0.00 -1.57 0.00 0.00 52.86 51.47 1bil s ASN 37 Cb 0.00 -1.85 -0.04 0.00 -0.02 0.00 0.00 41.25 39.33 1bil s ASN 37 CO 0.00 0.27 0.09 -0.69 -2.57 0.00 0.00 177.10 174.19 1bil s VAL 38 N -1.27 4.95 -0.02 1.60 1.01 -1.26 -1.48 120.40 123.94 1bil s VAL 38 Ca 0.25 0.03 -0.07 0.00 0.00 0.00 0.00 61.98 62.19 1bil s VAL 38 Cb -0.12 -3.25 0.01 0.00 0.00 0.00 0.00 36.38 33.02 1bil s VAL 38 CO 0.17 0.44 0.16 -1.66 0.00 0.00 0.00 175.10 174.20 1bil s TRP 39 N 0.48 -0.04 0.14 5.22 1.48 -0.41 -1.69 118.94 124.12 1bil s TRP 39 Ca 0.05 0.08 0.01 0.00 -1.06 0.00 0.00 56.10 55.17 1bil s TRP 39 Cb -0.12 -0.01 -0.04 0.00 -1.16 0.00 0.00 33.47 32.14 1bil s TRP 39 CO 0.00 -0.23 0.01 0.14 -4.06 0.00 0.00 176.95 172.81 1bil s VAL 40 N -0.92 0.43 0.32 -0.66 -7.23 -0.55 -1.93 120.40 109.86 1bil s VAL 40 Ca -0.10 -1.93 -0.28 0.00 -1.81 0.00 0.00 61.98 57.86 1bil s VAL 40 Cb -0.06 -1.98 -0.09 0.00 0.56 0.00 0.00 36.38 34.81 1bil s VAL 40 CO 0.01 -0.57 1.08 -2.84 -0.31 0.00 0.00 175.10 172.47 1bil s PRO 41 N -3.95 4.49 -0.05 4.82 0.02 -1.26 -0.07 135.00 139.00 1bil s PRO 41 Ca 0.21 1.70 -0.14 0.00 0.02 0.00 0.00 61.00 62.78 1bil s PRO 41 Cb 0.07 -2.98 -0.05 0.00 0.02 0.00 0.00 34.50 31.55 1bil s PRO 41 CO 0.01 0.11 0.37 0.45 -0.33 0.00 0.00 177.00 177.60 1bil s SER 42 N -1.11 6.69 0.55 2.53 0.15 -0.34 0.20 113.70 122.36 1bil s SER 42 Ca 0.49 0.82 0.25 0.00 0.70 0.00 0.00 55.95 58.20 1bil s SER 42 Cb -0.29 -2.22 1.47 0.00 -1.71 0.00 0.00 66.02 63.27 1bil s SER 42 CO 0.36 0.26 2.07 0.77 1.20 0.00 0.00 173.24 177.91 1bil h SER 43 N 5.28 0.00 0.00 5.45 4.64 -1.63 0.99 113.55 128.29 1bil h SER 43 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1bil h SER 43 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1bil h SER 43 CO 0.65 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.90 1bil n LYS 44 N -4.18 0.71 -3.28 4.77 5.02 -1.26 -4.80 118.16 115.15 1bil n LYS 44 Ca 0.04 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.94 1bil n LYS 44 Cb 0.38 -1.19 -0.06 0.00 -0.02 0.00 0.00 35.03 34.14 1bil n LYS 44 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1bil s SER 46 N -0.78 6.49 0.00 0.00 0.15 -1.26 -4.95 113.70 113.35 1bil s SER 46 Ca 0.29 2.16 0.25 0.00 0.70 0.00 0.00 55.95 59.35 1bil s SER 46 Cb -0.19 -2.59 1.39 0.00 -1.71 0.00 0.00 66.02 62.92 1bil s SER 46 CO 0.18 -0.69 1.86 0.54 1.20 0.00 0.00 173.24 176.32 1bil n ARG 46 N -0.26 0.58 -0.35 5.44 5.12 -1.26 -2.55 116.66 123.38 1bil n ARG 46 Ca 0.06 0.03 0.07 0.00 -1.93 0.00 0.00 57.85 56.08 1bil n ARG 46 Cb 0.49 -1.50 0.25 0.00 -1.16 0.00 0.00 32.46 30.54 1bil n ARG 46 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 1bil h LEU 46 N 0.00 0.91 -8.86 0.55 4.07 -2.01 -3.35 115.31 106.64 1bil h LEU 46 Ca 0.00 0.04 -0.58 0.00 0.08 0.00 0.00 57.88 57.42 1bil h LEU 46 Cb 0.11 -0.15 -0.08 0.00 1.08 0.00 0.00 40.66 41.63 1bil h LEU 46 CO 0.00 0.50 0.77 -0.31 -1.08 0.00 0.00 178.44 178.32 1bil s TYR 47 N -5.93 3.05 0.32 1.13 2.02 -1.06 -4.95 117.35 111.93 1bil s TYR 47 Ca -0.12 0.93 0.21 0.00 -0.37 0.00 0.00 57.07 57.72 1bil s TYR 47 Cb 0.22 -3.84 1.03 0.00 -0.40 0.00 0.00 41.96 38.97 1bil s TYR 47 CO 0.81 -0.90 1.91 1.79 -1.57 0.00 0.00 175.55 177.58 1bil h THR 48 N 5.88 0.82 -0.39 -0.71 1.35 -1.85 -3.10 112.91 114.91 1bil h THR 48 Ca -0.22 -1.00 0.08 0.00 -0.55 0.00 0.00 66.41 64.72 1bil h THR 48 Cb 1.07 1.61 -0.09 0.00 -1.73 0.00 0.00 68.15 69.01 1bil h THR 48 CO 1.03 0.25 -0.22 0.00 -0.25 0.00 0.00 175.52 176.33 1bil h ALA 49 N 1.75 0.03 0.02 6.62 0.00 -1.89 0.60 119.26 126.38 1bil h ALA 49 Ca -0.00 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1bil h ALA 49 Cb 0.58 0.52 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1bil h ALA 49 CO 0.03 -0.60 -0.01 0.00 0.00 0.00 0.00 179.25 178.68 1bil h VAL 51 N -0.05 0.43 -0.99 0.00 2.07 -1.21 -0.31 116.25 116.19 1bil h VAL 51 Ca -0.00 0.00 -0.60 0.00 0.82 0.00 0.00 66.70 66.91 1bil h VAL 51 Cb 0.04 0.45 -0.38 0.00 -1.52 0.00 0.00 31.29 29.88 1bil h VAL 51 CO 0.00 0.00 -0.23 -1.22 0.02 0.00 0.00 177.57 176.15 1bil n TYR 52 N -4.13 2.98 -3.71 1.57 4.01 0.09 -4.99 117.16 112.98 1bil n TYR 52 Ca 0.22 -2.56 -0.14 0.00 -0.16 0.00 0.00 57.90 55.26 1bil n TYR 52 Cb 1.13 -0.66 -0.09 0.00 -0.31 0.00 0.00 39.34 39.41 1bil n TYR 52 CO 0.00 0.00 0.00 -1.01 -0.46 0.00 0.00 176.86 175.39 1bil s HIS 53 N -3.69 -0.35 0.34 -0.72 3.76 -0.13 -4.99 115.29 109.53 1bil s HIS 53 Ca 0.54 0.68 -0.28 0.00 -0.15 0.00 0.00 55.06 55.85 1bil s HIS 53 Cb 0.44 0.17 -0.12 0.00 1.11 0.00 0.00 32.58 34.18 1bil s HIS 53 CO -0.03 -0.37 1.42 1.17 -0.85 0.00 0.00 174.74 176.08 1bil n LYS 54 N 1.72 2.43 -4.58 1.40 4.81 -1.26 -4.91 118.16 117.77 1bil n LYS 54 Ca -0.19 0.86 -0.30 0.00 -0.87 0.00 0.00 58.31 57.81 1bil n LYS 54 Cb 0.56 -2.53 -0.12 0.00 0.02 0.00 0.00 35.03 32.96 1bil n LYS 54 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1bil s LEU 55 N -1.32 2.60 -0.14 3.14 1.43 -1.26 -4.33 118.68 118.81 1bil s LEU 55 Ca 0.56 -0.47 -0.26 0.00 -1.03 0.00 0.00 54.13 52.93 1bil s LEU 55 Cb -0.52 -1.51 -0.02 0.00 0.03 0.00 0.00 46.19 44.17 1bil s LEU 55 CO 0.60 0.24 0.87 0.12 0.23 0.00 0.00 176.35 178.41 1bil s PHE 56 N -0.97 3.47 -0.63 0.29 5.36 0.53 -4.67 117.98 121.35 1bil s PHE 56 Ca 0.15 1.36 -0.08 0.00 -0.96 0.00 0.00 56.93 57.41 1bil s PHE 56 Cb -0.10 -3.05 0.16 0.00 -0.34 0.00 0.00 43.02 39.69 1bil s PHE 56 CO 0.06 -0.20 0.49 0.34 -1.46 0.00 0.00 175.22 174.46 1bil s ASP 57 N 1.10 5.80 0.50 6.13 -1.08 -1.26 -1.80 116.67 126.05 1bil s ASP 57 Ca 0.41 -2.50 0.26 0.00 -0.52 0.00 0.00 52.55 50.21 1bil s ASP 57 Cb -0.17 -2.00 1.34 0.00 -1.46 0.00 0.00 42.92 40.63 1bil s ASP 57 CO 0.15 -0.53 1.89 0.00 0.52 0.00 0.00 175.17 177.20 1bil h ALA 58 N 7.70 2.60 -0.24 3.66 0.00 -1.97 0.45 119.26 131.46 1bil h ALA 58 Ca -0.05 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.92 1bil h ALA 58 Cb 1.02 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1bil h ALA 58 CO 0.77 -0.86 0.18 0.66 0.00 0.00 0.00 179.25 180.01 1bil h SER 59 N 0.14 0.00 0.01 0.00 4.64 -2.04 -0.02 113.55 116.28 1bil h SER 59 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 1bil h SER 59 Cb 1.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.55 1bil h SER 59 CO -0.07 0.00 -0.01 0.47 -0.87 0.00 0.00 176.83 176.35 1bil n ASP 60 N -4.36 1.16 -4.52 4.97 9.92 0.16 -4.83 116.55 119.05 1bil n ASP 60 Ca 0.03 -1.35 -0.40 0.00 -0.53 0.00 0.00 54.79 52.53 1bil n ASP 60 Cb 0.33 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.70 1bil n ASP 60 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 1bil s SER 61 N -2.03 6.00 0.14 -2.24 0.15 -0.02 -4.51 113.70 111.18 1bil s SER 61 Ca 0.39 -0.44 -0.22 0.00 0.70 0.00 0.00 55.95 56.38 1bil s SER 61 Cb 0.21 -2.12 0.01 0.00 -1.71 0.00 0.00 66.02 62.41 1bil s SER 61 CO 0.35 -0.23 1.65 -1.28 1.20 0.00 0.00 173.24 174.93 1bil h SER 62 N 8.47 -0.63 0.70 5.45 0.87 -1.45 -2.78 113.55 124.18 1bil h SER 62 Ca -0.31 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 1bil h SER 62 Cb 1.16 0.30 0.00 0.00 -0.44 0.00 0.00 62.40 63.41 1bil h SER 62 CO 0.63 -0.24 0.00 -1.54 -0.53 0.00 0.00 176.83 175.15 1bil n SER 63 N -5.34 0.00 -4.36 6.23 3.41 -1.26 -4.95 113.62 107.35 1bil n SER 63 Ca -0.02 0.38 -0.33 0.00 -0.26 0.00 0.00 58.87 58.64 1bil n SER 63 Cb 0.26 -0.45 0.12 0.00 -0.26 0.00 0.00 64.21 63.88 1bil n SER 63 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bil n TYR 64 N -1.45 -1.75 -3.54 7.33 9.36 -1.05 -4.73 117.16 121.33 1bil n TYR 64 Ca 0.07 0.20 -0.07 0.00 3.32 0.00 0.00 57.90 61.42 1bil n TYR 64 Cb 0.24 -1.72 -0.08 0.00 -0.63 0.00 0.00 39.34 37.16 1bil n TYR 64 CO 0.00 0.00 0.00 0.21 0.22 0.00 0.00 176.86 177.29 1bil s LYS 65 N -3.46 0.38 0.87 2.98 2.47 -0.77 -4.98 119.74 117.23 1bil s LYS 65 Ca 0.55 0.97 -0.11 0.00 -1.56 0.00 0.00 55.97 55.82 1bil s LYS 65 Cb -0.19 0.24 0.12 0.00 -1.46 0.00 0.00 37.83 36.53 1bil s LYS 65 CO 0.68 -0.37 1.17 -1.58 0.16 0.00 0.00 175.35 175.42 1bil s HIS 66 N 2.66 1.70 0.30 4.03 5.65 -1.26 -2.57 115.29 125.79 1bil s HIS 66 Ca 0.03 1.74 0.00 0.00 0.25 0.00 0.00 55.06 57.08 1bil s HIS 66 Cb -0.13 -3.41 0.00 0.00 -1.18 0.00 0.00 32.58 27.86 1bil s HIS 66 CO -0.15 -2.83 0.00 -1.71 -0.65 0.00 0.00 174.74 169.40 1bil n ASN 67 N -3.83 -2.62 0.00 9.88 2.85 -1.25 -4.82 115.26 115.48 1bil n ASN 67 Ca 0.13 0.58 0.00 0.00 -0.11 0.00 0.00 54.58 55.18 1bil n ASN 67 Cb 0.51 2.60 0.00 0.00 1.24 0.00 0.00 39.78 44.14 1bil n ASN 67 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1bil n GLY 68 N -1.30 1.10 3.73 8.20 0.00 -0.27 -4.97 105.19 111.69 1bil n GLY 68 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1bil n GLY 68 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bil s THR 69 N -3.30 2.02 0.55 2.61 2.01 -1.26 -4.56 115.64 113.72 1bil s THR 69 Ca 0.00 0.02 -0.18 0.00 0.31 0.00 0.00 61.69 61.83 1bil s THR 69 Cb 0.00 -3.01 -0.05 0.00 0.01 0.00 0.00 72.50 69.45 1bil s THR 69 CO 0.00 0.00 1.08 -1.61 -0.69 0.00 0.00 174.62 173.41 1bil s GLU 70 N 0.76 3.41 -0.19 4.92 0.41 -1.26 0.32 118.70 127.08 1bil s GLU 70 Ca 0.72 1.42 -0.17 0.00 -0.41 0.00 0.00 54.97 56.53 1bil s GLU 70 Cb -0.49 -2.03 0.05 0.00 -1.78 0.00 0.00 34.13 29.87 1bil s GLU 70 CO 0.36 -0.76 0.50 -0.48 -0.49 0.00 0.00 175.26 174.39 1bil s LEU 71 N -3.98 0.08 -0.19 1.80 0.05 0.18 -4.83 118.68 111.79 1bil s LEU 71 Ca 0.68 1.01 0.01 0.00 0.05 0.00 0.00 54.13 55.88 1bil s LEU 71 Cb -0.19 1.71 0.02 0.00 -2.05 0.00 0.00 46.19 45.68 1bil s LEU 71 CO 0.29 -0.17 -0.18 -0.89 -0.55 0.00 0.00 176.35 174.84 1bil s THR 72 N 0.31 2.20 -0.23 5.48 2.01 -1.26 0.27 115.64 124.43 1bil s THR 72 Ca -0.00 -0.95 -0.08 0.00 0.31 0.00 0.00 61.69 60.96 1bil s THR 72 Cb -0.04 -1.96 -0.04 0.00 0.01 0.00 0.00 72.50 70.47 1bil s THR 72 CO 0.00 0.48 0.09 -0.76 -0.69 0.00 0.00 174.62 173.75 1bil s LEU 73 N 1.29 3.73 -0.16 4.42 2.01 0.37 -4.99 118.68 125.35 1bil s LEU 73 Ca 0.04 -0.04 -0.02 0.00 0.01 0.00 0.00 54.13 54.12 1bil s LEU 73 Cb -0.14 -1.98 -0.02 0.00 0.01 0.00 0.00 46.19 44.06 1bil s LEU 73 CO -0.11 0.05 -0.09 -0.13 1.01 0.00 0.00 176.35 177.07 1bil s ARG 74 N 1.13 3.43 0.34 1.70 3.00 -1.26 -1.95 118.95 125.34 1bil s ARG 74 Ca 0.05 -0.64 0.07 0.00 0.00 0.00 0.00 55.73 55.21 1bil s ARG 74 Cb -0.14 -2.77 -0.02 0.00 0.00 0.00 0.00 34.95 32.01 1bil s ARG 74 CO 0.04 0.12 0.35 0.71 0.00 0.00 0.00 175.30 176.52 1bil s TYR 75 N 0.63 2.95 0.42 -0.53 2.02 0.78 -4.99 117.35 118.63 1bil s TYR 75 Ca -0.05 -0.29 0.14 0.00 -0.37 0.00 0.00 57.07 56.50 1bil s TYR 75 Cb -0.15 -1.88 1.01 0.00 -0.40 0.00 0.00 41.96 40.54 1bil s TYR 75 CO 0.03 0.11 1.93 0.77 -1.57 0.00 0.00 175.55 176.82 1bil h SER 76 N 1.13 0.42 -0.00 2.29 0.02 -1.99 -2.60 113.55 112.83 1bil h SER 76 Ca -0.45 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 1bil h SER 76 Cb 1.26 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1bil h SER 76 CO 0.57 0.23 -0.97 0.35 -1.14 0.00 0.00 176.83 175.86 1bil n THR 77 N -4.48 0.00 -3.99 -2.27 -2.24 -1.26 -5.04 114.28 94.99 1bil n THR 77 Ca 0.13 -0.01 0.03 0.00 -2.27 0.00 0.00 64.05 61.93 1bil n THR 77 Cb 0.47 1.01 0.01 0.00 -2.10 0.00 0.00 70.33 69.72 1bil n THR 77 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bil n GLY 78 N 1.49 0.25 3.02 3.38 0.00 -0.98 -4.44 105.19 107.92 1bil n GLY 78 Ca 0.04 -1.02 -0.16 0.00 0.00 0.00 0.00 46.02 44.88 1bil n GLY 78 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bil s THR 79 N -2.03 0.59 0.01 2.61 2.01 -1.26 0.27 115.64 117.84 1bil s THR 79 Ca 0.27 -0.60 -0.01 0.00 0.31 0.00 0.00 61.69 61.67 1bil s THR 79 Cb -0.01 -0.55 -0.01 0.00 0.01 0.00 0.00 72.50 71.95 1bil s THR 79 CO -0.01 -0.03 0.00 -0.69 -0.69 0.00 0.00 174.62 173.20 1bil s VAL 80 N -0.60 0.06 0.02 3.82 1.01 -0.82 -4.42 120.40 119.46 1bil s VAL 80 Ca -0.01 -0.46 -0.01 0.00 0.00 0.00 0.00 61.98 61.49 1bil s VAL 80 Cb -0.05 -0.16 -0.01 0.00 0.00 0.00 0.00 36.38 36.15 1bil s VAL 80 CO 0.00 -0.25 0.01 -0.44 0.00 0.00 0.00 175.10 174.41 1bil s SER 81 N -0.75 0.19 0.00 3.32 0.01 -1.12 -0.48 113.70 114.86 1bil s SER 81 Ca -0.08 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 56.76 1bil s SER 81 Cb -0.05 0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.30 1bil s SER 81 CO -0.00 -0.30 0.00 0.61 0.41 0.00 0.00 173.24 173.95 1bil n GLY 82 N 1.63 1.16 3.39 3.44 0.00 0.14 -0.26 105.19 114.69 1bil n GLY 82 Ca -0.23 -0.57 -0.20 0.00 0.00 0.00 0.00 46.02 45.02 1bil n GLY 82 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1bil s PHE 83 N -2.01 1.79 -0.33 1.61 -0.71 -0.87 0.50 117.98 117.96 1bil s PHE 83 Ca 0.00 -0.93 -0.12 0.00 -1.04 0.00 0.00 56.93 54.84 1bil s PHE 83 Cb 0.00 -1.10 -0.02 0.00 -1.21 0.00 0.00 43.02 40.69 1bil s PHE 83 CO 0.00 0.00 0.22 -1.17 -1.34 0.00 0.00 175.22 172.93 1bil s LEU 84 N -3.40 4.38 0.00 -1.99 0.20 0.15 0.11 118.68 118.13 1bil s LEU 84 Ca 0.33 -0.39 0.01 0.00 0.69 0.00 0.00 54.13 54.77 1bil s LEU 84 Cb 0.07 -2.11 0.01 0.00 -0.43 0.00 0.00 46.19 43.73 1bil s LEU 84 CO 0.12 -0.20 0.11 -1.20 -0.29 0.00 0.00 176.35 174.89 1bil n SER 85 N 5.08 1.49 -3.79 3.68 7.64 0.61 -1.11 113.62 127.22 1bil n SER 85 Ca -0.13 -1.52 -0.13 0.00 1.01 0.00 0.00 58.87 58.11 1bil n SER 85 Cb 0.50 -0.01 -0.10 0.00 -1.01 0.00 0.00 64.21 63.59 1bil n SER 85 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1bil s GLN 86 N -2.61 0.49 0.04 1.43 0.74 -1.06 -0.46 119.66 118.23 1bil s GLN 86 Ca 0.08 0.01 -0.14 0.00 0.05 0.00 0.00 55.36 55.37 1bil s GLN 86 Cb -0.01 0.22 0.05 0.00 1.10 0.00 0.00 33.01 34.37 1bil s GLN 86 CO 0.05 -0.11 0.63 -3.47 -0.55 0.00 0.00 175.29 171.84 1bil n ASP 87 N 2.00 -0.79 -4.67 6.67 -0.08 -0.40 -1.84 116.55 117.44 1bil n ASP 87 Ca -0.18 -1.31 -0.35 0.00 -1.51 0.00 0.00 54.79 51.44 1bil n ASP 87 Cb 0.57 1.26 -0.09 0.00 2.34 0.00 0.00 41.12 45.19 1bil n ASP 87 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 1bil s ILE 88 N -2.18 4.86 -0.16 5.18 -4.36 -1.26 0.49 121.20 123.76 1bil s ILE 88 Ca 0.14 -0.01 -0.05 0.00 -0.26 0.00 0.00 60.65 60.47 1bil s ILE 88 Cb -0.01 -3.18 -0.03 0.00 1.25 0.00 0.00 42.46 40.49 1bil s ILE 88 CO 0.01 0.48 -0.01 -0.63 0.24 0.00 0.00 174.94 175.04 1bil s ILE 89 N 0.16 4.15 -0.31 8.37 1.01 -0.43 0.67 121.20 134.82 1bil s ILE 89 Ca 0.05 -0.26 -0.12 0.00 0.00 0.00 0.00 60.65 60.32 1bil s ILE 89 Cb -0.12 -2.83 -0.03 0.00 0.01 0.00 0.00 42.46 39.48 1bil s ILE 89 CO 0.00 0.49 0.21 -0.89 0.00 0.00 0.00 174.94 174.75 1bil s THR 90 N 0.35 5.23 -0.37 2.92 2.01 0.62 -2.52 115.64 123.87 1bil s THR 90 Ca -0.02 -0.08 0.02 0.00 0.31 0.00 0.00 61.69 61.93 1bil s THR 90 Cb -0.14 -3.60 0.11 0.00 0.01 0.00 0.00 72.50 68.88 1bil s THR 90 CO 0.02 0.11 0.10 -0.69 -0.69 0.00 0.00 174.62 173.47 1bil s VAL 91 N 1.73 2.53 0.00 3.82 1.01 0.84 -2.22 120.40 128.11 1bil s VAL 91 Ca 0.06 -2.37 0.00 0.00 0.00 0.00 0.00 61.98 59.67 1bil s VAL 91 Cb -0.17 -2.83 0.00 0.00 0.00 0.00 0.00 36.38 33.39 1bil s VAL 91 CO 0.10 -0.64 0.00 0.61 0.00 0.00 0.00 175.10 175.18 1bil n GLY 92 N 4.23 2.65 0.44 4.51 0.00 -1.26 -1.92 105.19 113.83 1bil n GLY 92 Ca 0.03 -0.32 0.11 0.00 0.00 0.00 0.00 46.02 45.84 1bil n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bil n GLY 93 N 0.00 -0.08 3.86 -0.02 0.00 -1.26 -4.97 105.19 102.72 1bil n GLY 93 Ca 0.00 -0.63 -0.31 0.00 0.00 0.00 0.00 46.02 45.07 1bil n GLY 93 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bil s ILE 94 N -2.53 4.67 -0.02 -0.61 -1.09 -0.81 -5.09 121.20 115.72 1bil s ILE 94 Ca 0.18 0.89 -0.01 0.00 -2.23 0.00 0.00 60.65 59.47 1bil s ILE 94 Cb 0.18 -3.72 0.02 0.00 -1.58 0.00 0.00 42.46 37.36 1bil s ILE 94 CO 0.60 -0.56 0.05 -0.89 -1.23 0.00 0.00 174.94 172.91 1bil s THR 95 N -2.44 -0.03 -0.05 2.92 2.01 -1.26 -0.11 115.64 116.68 1bil s THR 95 Ca 0.55 0.10 -0.16 0.00 0.31 0.00 0.00 61.69 62.48 1bil s THR 95 Cb -0.10 -0.10 0.03 0.00 0.01 0.00 0.00 72.50 72.34 1bil s THR 95 CO 0.30 0.04 0.37 0.54 -0.69 0.00 0.00 174.62 175.18 1bil s VAL 96 N 0.55 0.04 -0.53 3.82 0.11 -1.05 -4.99 120.40 118.35 1bil s VAL 96 Ca -0.04 -0.30 -0.28 0.00 -2.93 0.00 0.00 61.98 58.42 1bil s VAL 96 Cb -0.06 -0.64 0.03 0.00 -1.53 0.00 0.00 36.38 34.18 1bil s VAL 96 CO -0.02 -0.17 1.15 -0.89 -3.33 0.00 0.00 175.10 171.84 1bil s THR 97 N -0.92 4.13 -0.04 5.04 2.01 -1.26 -1.32 115.64 123.28 1bil s THR 97 Ca -0.10 1.00 0.00 0.00 0.31 0.00 0.00 61.69 62.90 1bil s THR 97 Cb -0.04 -4.66 -0.03 0.00 0.01 0.00 0.00 72.50 67.78 1bil s THR 97 CO 0.04 -1.18 0.00 -1.10 -0.69 0.00 0.00 174.62 171.69 1bil s GLN 99 N 4.66 2.87 -0.02 4.92 -1.52 0.18 -4.92 119.66 125.83 1bil s GLN 99 Ca 0.44 -0.52 -0.22 0.00 -1.95 0.00 0.00 55.36 53.11 1bil s GLN 99 Cb -0.08 -2.72 -0.05 0.00 -0.22 0.00 0.00 33.01 29.94 1bil s GLN 99 CO 0.28 0.66 0.64 1.41 -0.25 0.00 0.00 175.29 178.03 1bil s MET 100 N -1.25 4.38 0.12 2.91 -2.45 -1.26 -1.28 119.30 120.46 1bil s MET 100 Ca 0.17 0.80 -0.12 0.00 -1.25 0.00 0.00 55.69 55.29 1bil s MET 100 Cb -0.11 -3.38 0.01 0.00 1.25 0.00 0.00 34.83 32.60 1bil s MET 100 CO 0.07 0.27 0.29 -0.59 1.05 0.00 0.00 175.02 176.10 1bil s PHE 101 N 0.13 0.05 0.10 4.11 -0.71 0.39 -4.76 117.98 117.29 1bil s PHE 101 Ca 0.33 -0.43 -0.17 0.00 -1.04 0.00 0.00 56.93 55.63 1bil s PHE 101 Cb -0.18 0.07 -0.07 0.00 -1.21 0.00 0.00 43.02 41.64 1bil s PHE 101 CO 0.18 -0.64 0.55 0.20 -1.34 0.00 0.00 175.22 174.16 1bil s GLY 102 N -2.86 2.57 -0.44 1.99 0.00 -0.68 -0.28 107.32 107.62 1bil s GLY 102 Ca 0.06 -0.06 -0.12 0.00 0.00 0.00 0.00 44.72 44.61 1bil s GLY 102 CO -0.09 0.31 0.31 -0.54 0.00 0.00 0.00 173.10 173.08 1bil s GLU 103 N -1.45 2.75 0.15 2.90 2.02 0.12 -1.48 118.70 123.71 1bil s GLU 103 Ca 0.32 -1.42 -0.30 0.00 0.02 0.00 0.00 54.97 53.59 1bil s GLU 103 Cb -0.17 -3.92 -0.07 0.00 0.10 0.00 0.00 34.13 30.07 1bil s GLU 103 CO 0.18 -0.98 1.16 0.08 0.02 0.00 0.00 175.26 175.72 1bil s VAL 104 N 1.51 3.80 -0.03 2.63 1.01 0.90 -2.04 120.40 128.19 1bil s VAL 104 Ca 0.03 1.47 0.02 0.00 0.00 0.00 0.00 61.98 63.50 1bil s VAL 104 Cb -0.23 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.18 1bil s VAL 104 CO 0.04 0.21 0.05 0.35 0.00 0.00 0.00 175.10 175.75 1bil n THR 105 N 2.79 0.00 -3.83 3.92 -2.24 0.64 -1.20 114.28 114.35 1bil n THR 105 Ca 0.05 -0.16 -0.27 0.00 -2.27 0.00 0.00 64.05 61.40 1bil n THR 105 Cb 0.46 0.61 -0.17 0.00 -2.10 0.00 0.00 70.33 69.13 1bil n THR 105 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1bil s GLU 106 N -1.86 1.09 -0.16 -0.78 2.02 -0.73 -4.17 118.70 114.10 1bil s GLU 106 Ca -0.00 -0.36 -0.04 0.00 0.02 0.00 0.00 54.97 54.58 1bil s GLU 106 Cb 0.01 -1.82 0.07 0.00 0.10 0.00 0.00 34.13 32.49 1bil s GLU 106 CO 0.08 -0.45 0.14 0.00 0.02 0.00 0.00 175.26 175.04 1bil s MET 107 N 1.75 0.09 0.67 1.61 0.23 -1.26 -2.81 119.30 119.57 1bil s MET 107 Ca 0.01 0.12 -0.17 0.00 -1.03 0.00 0.00 55.69 54.62 1bil s MET 107 Cb -0.15 -1.34 0.00 0.00 -1.53 0.00 0.00 34.83 31.81 1bil s MET 107 CO -0.07 -0.59 1.28 -2.14 -2.03 0.00 0.00 175.02 171.47 1bil s PRO 108 N 2.22 2.44 0.31 3.16 0.01 -1.26 -4.45 135.00 137.42 1bil s PRO 108 Ca 0.04 2.02 0.05 0.00 0.01 0.00 0.00 61.00 63.12 1bil s PRO 108 Cb -0.15 -1.84 0.51 0.00 0.01 0.00 0.00 34.50 33.03 1bil s PRO 108 CO -0.09 -1.67 1.76 0.00 0.01 0.00 0.00 177.00 177.00 1bil h ALA 109 N 0.36 1.19 -2.60 -1.55 0.00 -1.99 -2.21 119.26 112.47 1bil h ALA 109 Ca -0.50 -0.33 -0.73 0.00 0.00 0.00 0.00 54.91 53.34 1bil h ALA 109 Cb 1.33 -0.10 -0.27 0.00 0.00 0.00 0.00 17.79 18.74 1bil h ALA 109 CO 0.52 0.52 -0.39 -1.17 0.00 0.00 0.00 179.25 178.73 1bil s LEU 110 N -8.56 5.53 0.00 0.00 2.96 -1.26 -0.08 118.68 117.28 1bil s LEU 110 Ca -0.06 -1.67 0.10 0.00 -0.22 0.00 0.00 54.13 52.28 1bil s LEU 110 Cb 0.14 -2.04 0.26 0.00 0.50 0.00 0.00 46.19 45.05 1bil s LEU 110 CO 0.77 -0.65 1.19 -0.81 -1.32 0.00 0.00 176.35 175.53 1bil n PRO 111 N 4.98 2.54 0.26 0.98 -0.04 -1.26 -4.86 135.00 137.60 1bil n PRO 111 Ca -0.10 -1.90 0.17 0.00 -0.04 0.00 0.00 63.50 61.63 1bil n PRO 111 Cb 0.42 -1.25 0.87 0.00 -0.04 0.00 0.00 33.50 33.50 1bil n PRO 111 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1bil h PHE 112 N 1.97 0.00 0.00 0.54 0.04 -0.74 -1.20 116.94 117.55 1bil h PHE 112 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1bil h PHE 112 Cb 0.68 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.83 1bil h PHE 112 CO 0.19 0.00 0.00 -1.33 -0.60 0.00 0.00 178.31 176.57 1bil n MET 113 N -2.75 0.55 0.00 1.51 2.81 0.89 -2.37 117.12 117.75 1bil n MET 113 Ca -0.01 0.03 0.05 0.00 -1.81 0.00 0.00 57.70 55.96 1bil n MET 113 Cb 0.12 -1.50 0.03 0.00 -0.71 0.00 0.00 33.22 31.16 1bil n MET 113 CO 0.00 0.00 0.00 1.47 1.51 0.00 0.00 175.97 178.95 1bil n LEU 114 N -1.15 1.70 -4.79 4.03 -0.00 -0.46 -4.98 117.00 111.35 1bil n LEU 114 Ca 0.15 -0.95 -0.39 0.00 -0.00 0.00 0.00 56.01 54.82 1bil n LEU 114 Cb 0.14 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.50 1bil n LEU 114 CO 0.16 0.33 0.39 0.00 -0.00 0.00 0.00 177.39 178.27 1bil s ALA 115 N -0.93 3.50 -0.82 1.47 0.00 -1.00 -4.97 121.76 119.01 1bil s ALA 115 Ca 0.11 0.21 0.22 0.00 0.00 0.00 0.00 51.96 52.50 1bil s ALA 115 Cb 0.08 -2.82 -0.14 0.00 0.00 0.00 0.00 23.12 20.23 1bil s ALA 115 CO 0.15 0.31 0.90 0.39 0.00 0.00 0.00 175.76 177.51 1bil n GLU 116 N 1.80 0.13 -3.54 0.00 -0.58 -1.26 -4.95 120.64 112.23 1bil n GLU 116 Ca -0.07 -0.03 -0.23 0.00 -0.42 0.00 0.00 57.16 56.41 1bil n GLU 116 Cb 0.50 -1.51 0.01 0.00 -0.57 0.00 0.00 31.44 29.87 1bil n GLU 116 CO 0.00 0.00 0.00 -0.59 -0.48 0.00 0.00 177.13 176.06 1bil s PHE 117 N -3.10 1.76 -0.23 -0.32 -0.71 -1.26 -5.00 117.98 109.13 1bil s PHE 117 Ca 0.06 -0.74 -0.00 0.00 -1.04 0.00 0.00 56.93 55.21 1bil s PHE 117 Cb 0.16 -2.06 -0.19 0.00 -1.21 0.00 0.00 43.02 39.71 1bil s PHE 117 CO 0.85 -0.64 -0.09 -0.25 -1.34 0.00 0.00 175.22 173.76 1bil n ASP 118 N -1.89 2.02 -0.38 1.98 8.00 0.84 -4.96 116.55 122.16 1bil n ASP 118 Ca 0.05 -0.05 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1bil n ASP 118 Cb 0.63 -0.52 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 1bil n ASP 118 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bil n GLY 119 N 2.19 3.19 2.93 0.44 0.00 -0.93 -4.42 105.19 108.61 1bil n GLY 119 Ca -0.43 -1.03 -0.12 0.00 0.00 0.00 0.00 46.02 44.44 1bil n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bil s VAL 120 N -2.57 0.17 -0.49 1.61 0.11 -0.81 -1.81 120.40 116.61 1bil s VAL 120 Ca 0.00 -0.38 -0.03 0.00 -2.93 0.00 0.00 61.98 58.63 1bil s VAL 120 Cb 0.00 -0.20 0.13 0.00 -1.53 0.00 0.00 36.38 34.78 1bil s VAL 120 CO 0.00 -0.14 0.29 -0.69 -3.33 0.00 0.00 175.10 171.23 1bil s VAL 121 N -0.53 3.49 -0.15 2.04 1.01 0.13 -1.29 120.40 125.11 1bil s VAL 121 Ca -0.05 -2.34 -0.33 0.00 0.00 0.00 0.00 61.98 59.26 1bil s VAL 121 Cb -0.04 -3.35 -0.10 0.00 0.00 0.00 0.00 36.38 32.89 1bil s VAL 121 CO -0.00 -0.76 2.01 0.61 0.00 0.00 0.00 175.10 176.96 1bil n GLY 122 N 4.24 1.25 1.01 4.51 0.00 -0.55 -2.14 105.19 113.51 1bil n GLY 122 Ca 0.01 0.86 0.11 0.00 0.00 0.00 0.00 46.02 47.00 1bil n GLY 122 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1bil n MET 123 N 7.40 2.32 -1.00 1.61 2.81 0.15 -4.50 117.12 125.91 1bil n MET 123 Ca 0.27 -2.00 -0.30 0.00 -1.81 0.00 0.00 57.70 53.86 1bil n MET 123 Cb 0.32 -1.48 0.25 0.00 -0.71 0.00 0.00 33.22 31.60 1bil n MET 123 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1bil s GLY 124 N -1.48 1.57 0.53 3.03 0.00 0.36 -4.79 107.32 106.53 1bil s GLY 124 Ca 0.37 -0.96 -0.06 0.00 0.00 0.00 0.00 44.72 44.08 1bil s GLY 124 CO 0.30 -0.05 0.84 -1.36 0.00 0.00 0.00 173.10 172.84 1bil s PHE 125 N -2.93 3.47 0.45 1.90 0.08 -1.26 -4.71 117.98 114.98 1bil s PHE 125 Ca 0.71 0.80 0.22 0.00 0.12 0.00 0.00 56.93 58.78 1bil s PHE 125 Cb -0.10 -2.48 1.30 0.00 -0.57 0.00 0.00 43.02 41.18 1bil s PHE 125 CO 0.56 -0.49 2.06 0.97 -0.10 0.00 0.00 175.22 178.23 1bil h ILE 126 N 0.05 0.81 -0.70 0.64 2.10 -1.91 -2.52 117.51 115.97 1bil h ILE 126 Ca -0.46 -0.51 0.18 0.00 1.08 0.00 0.00 64.86 65.14 1bil h ILE 126 Cb 1.22 1.30 -0.04 0.00 -1.09 0.00 0.00 36.82 38.21 1bil h ILE 126 CO 0.61 0.13 0.48 -0.33 -1.08 0.00 0.00 178.15 177.97 1bil h GLU 127 N 0.00 0.16 -0.62 2.19 3.07 -1.95 -0.27 114.58 117.16 1bil h GLU 127 Ca -0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1bil h GLU 127 Cb 0.29 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.16 1bil h GLU 127 CO 0.02 0.10 0.00 1.04 -1.40 0.00 0.00 179.01 178.77 1bil n GLN 128 N -4.40 2.95 -2.55 2.33 1.13 -0.95 -4.96 117.38 110.93 1bil n GLN 128 Ca 0.14 -2.57 -0.43 0.00 -1.94 0.00 0.00 57.00 52.19 1bil n GLN 128 Cb 0.65 -1.57 -0.02 0.00 0.11 0.00 0.00 30.24 29.42 1bil n GLN 128 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1bil s ALA 129 N -1.20 3.35 -0.21 -1.58 0.00 -0.11 -4.38 121.76 117.63 1bil s ALA 129 Ca 0.43 -0.13 -0.29 0.00 0.00 0.00 0.00 51.96 51.97 1bil s ALA 129 Cb 0.24 -3.78 -0.06 0.00 0.00 0.00 0.00 23.12 19.52 1bil s ALA 129 CO 0.27 -1.82 2.19 -0.89 0.00 0.00 0.00 175.76 175.51 1bil n ILE 130 N 6.28 0.37 -0.37 0.00 2.08 -1.26 -0.90 119.36 125.56 1bil n ILE 130 Ca 0.13 -0.40 0.00 0.00 0.56 0.00 0.00 62.75 63.04 1bil n ILE 130 Cb 0.47 -2.40 0.00 0.00 -0.75 0.00 0.00 39.64 36.96 1bil n ILE 130 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1bil n GLY 131 N 5.71 0.77 3.98 7.39 0.00 -1.26 -4.15 105.19 117.63 1bil n GLY 131 Ca 0.30 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 1bil n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bil n ARG 132 N -2.37 -0.84 -3.11 1.61 1.74 -0.08 -4.89 116.66 108.72 1bil n ARG 132 Ca 0.00 0.10 -0.39 0.00 -0.77 0.00 0.00 57.85 56.79 1bil n ARG 132 Cb 0.00 -3.46 -0.06 0.00 -1.02 0.00 0.00 32.46 27.92 1bil n ARG 132 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1bil s VAL 133 N -3.35 4.53 -0.02 1.55 -7.23 -1.26 -5.02 120.40 109.61 1bil s VAL 133 Ca 0.41 1.47 -0.30 0.00 -1.81 0.00 0.00 61.98 61.75 1bil s VAL 133 Cb -0.24 -4.01 -0.04 0.00 0.56 0.00 0.00 36.38 32.64 1bil s VAL 133 CO 0.83 0.50 1.27 -0.89 -0.31 0.00 0.00 175.10 176.50 1bil s THR 134 N -1.18 4.02 0.72 5.32 2.01 -1.26 -4.85 115.64 120.41 1bil s THR 134 Ca 0.34 1.38 -0.16 0.00 0.31 0.00 0.00 61.69 63.57 1bil s THR 134 Cb -0.21 -3.89 0.03 0.00 0.01 0.00 0.00 72.50 68.44 1bil s THR 134 CO 0.23 0.02 1.23 -2.84 -0.69 0.00 0.00 174.62 172.56 1bil s PRO 135 N 2.08 2.18 0.24 4.92 0.02 -1.26 -4.78 135.00 138.40 1bil s PRO 135 Ca 0.59 1.84 -0.04 0.00 0.02 0.00 0.00 61.00 63.40 1bil s PRO 135 Cb -0.28 -1.83 0.42 0.00 0.02 0.00 0.00 34.50 32.83 1bil s PRO 135 CO 0.25 -1.82 1.77 0.97 -0.33 0.00 0.00 177.00 177.84 1bil h ILE 136 N -0.15 0.80 -0.55 2.83 2.10 -1.82 -2.11 117.51 118.60 1bil h ILE 136 Ca -0.48 -0.21 0.03 0.00 1.08 0.00 0.00 64.86 65.27 1bil h ILE 136 Cb 1.31 0.12 -0.04 0.00 -1.09 0.00 0.00 36.82 37.12 1bil h ILE 136 CO 0.50 0.11 0.33 0.15 -1.08 0.00 0.00 178.15 178.16 1bil h PHE 137 N 0.62 0.61 -0.69 2.19 3.57 -1.90 0.38 116.94 121.71 1bil h PHE 137 Ca 0.40 0.02 0.12 0.00 3.53 0.00 0.00 57.97 62.04 1bil h PHE 137 Cb 0.49 -0.19 -0.09 0.00 2.79 0.00 0.00 35.95 38.95 1bil h PHE 137 CO -0.10 0.34 0.26 -0.44 -2.23 0.00 0.00 178.31 176.14 1bil h ASP 138 N 0.64 0.25 -0.49 0.41 5.19 -1.74 0.08 116.42 120.76 1bil h ASP 138 Ca 0.23 0.10 -0.03 0.00 -0.62 0.00 0.00 57.03 56.70 1bil h ASP 138 Cb 0.04 0.08 -0.02 0.00 0.18 0.00 0.00 39.33 39.61 1bil h ASP 138 CO -0.11 0.12 0.18 0.78 -3.12 0.00 0.00 179.24 177.08 1bil h ASN 139 N 0.43 0.69 -0.44 6.45 4.21 -1.09 -2.33 115.58 123.50 1bil h ASN 139 Ca 0.37 -0.19 0.00 0.00 1.21 0.00 0.00 56.30 57.70 1bil h ASN 139 Cb 0.52 -0.18 -0.02 0.00 -1.12 0.00 0.00 38.32 37.52 1bil h ASN 139 CO -0.37 0.69 0.29 0.40 -1.29 0.00 0.00 177.43 177.15 1bil h ILE 140 N 0.65 1.11 -0.07 2.81 2.04 0.92 -3.05 117.51 121.92 1bil h ILE 140 Ca 0.16 -0.21 0.04 0.00 1.00 0.00 0.00 64.86 65.85 1bil h ILE 140 Cb 0.23 0.47 -0.05 0.00 -0.74 0.00 0.00 36.82 36.73 1bil h ILE 140 CO -0.01 0.11 -0.23 0.16 0.00 0.00 0.00 178.15 178.18 1bil h ILE 141 N 0.60 0.45 -0.99 -0.67 3.07 -1.03 -0.84 117.51 118.10 1bil h ILE 141 Ca 0.16 0.00 0.30 0.00 1.55 0.00 0.00 64.86 66.87 1bil h ILE 141 Cb -0.07 0.45 -0.18 0.00 -0.27 0.00 0.00 36.82 36.76 1bil h ILE 141 CO -0.03 0.00 0.14 0.28 -1.05 0.00 0.00 178.15 177.49 1bil h SER 142 N -0.32 -0.30 0.00 2.16 0.02 -1.32 0.69 113.55 114.48 1bil h SER 142 Ca 0.08 0.27 0.00 0.00 -0.84 0.00 0.00 61.79 61.31 1bil h SER 142 Cb 0.44 0.43 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1bil h SER 142 CO -0.26 -0.37 0.00 0.00 -1.14 0.00 0.00 176.83 175.07 1bil n GLN 143 N -5.43 0.64 0.00 3.45 10.64 -0.32 -4.91 117.38 121.45 1bil n GLN 143 Ca 0.26 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.43 1bil n GLN 143 Cb 0.87 -1.16 0.00 0.00 -0.86 0.00 0.00 30.24 29.09 1bil n GLN 143 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1bil n GLY 144 N 0.16 2.58 5.01 2.61 0.00 0.24 -4.86 105.19 110.93 1bil n GLY 144 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1bil n GLY 144 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1bil n VAL 145 N 0.00 0.00 -2.10 1.61 3.14 -1.26 -4.64 118.33 115.07 1bil n VAL 145 Ca 0.00 0.00 -0.37 0.00 -2.96 0.00 0.00 64.34 61.01 1bil n VAL 145 Cb 0.00 0.00 0.01 0.00 -1.06 0.00 0.00 33.84 32.79 1bil n VAL 145 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 1bil s LEU 146 N 0.00 3.83 0.08 6.55 1.43 -1.26 -2.32 118.68 127.00 1bil s LEU 146 Ca 0.00 2.39 -0.19 0.00 -1.03 0.00 0.00 54.13 55.29 1bil s LEU 146 Cb 0.00 -4.41 -0.09 0.00 0.03 0.00 0.00 46.19 41.72 1bil s LEU 146 CO 0.00 -1.28 1.55 0.11 0.23 0.00 0.00 176.35 176.96 1bil h LYS 147 N 1.45 0.38 -5.43 1.70 6.56 -0.45 -2.72 116.57 118.06 1bil h LYS 147 Ca -0.50 -0.10 -0.41 0.00 -1.06 0.00 0.00 60.65 58.57 1bil h LYS 147 Cb 1.27 -0.04 -0.17 0.00 -0.57 0.00 0.00 32.23 32.72 1bil h LYS 147 CO 0.58 0.52 -0.75 -1.21 -2.06 0.00 0.00 179.45 176.53 1bil s GLU 148 N -5.16 1.10 -1.37 3.15 0.41 -1.03 -4.66 118.70 111.15 1bil s GLU 148 Ca -0.14 -1.35 -0.07 0.00 -0.41 0.00 0.00 54.97 53.00 1bil s GLU 148 Cb 0.07 -0.93 0.09 0.00 -1.78 0.00 0.00 34.13 31.58 1bil s GLU 148 CO 0.73 0.17 2.42 -0.25 -0.49 0.00 0.00 175.26 177.84 1bil n ASP 149 N 0.22 7.80 -4.00 -0.19 9.92 -1.26 -4.14 116.55 124.90 1bil n ASP 149 Ca -0.13 -3.05 -0.09 0.00 -0.53 0.00 0.00 54.79 50.99 1bil n ASP 149 Cb 0.58 -1.41 -0.08 0.00 -0.64 0.00 0.00 41.12 39.57 1bil n ASP 149 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1bil s VAL 150 N -0.41 0.09 0.03 2.53 -7.23 -1.26 -1.17 120.40 112.98 1bil s VAL 150 Ca 0.55 -1.50 0.01 0.00 -1.81 0.00 0.00 61.98 59.23 1bil s VAL 150 Cb 0.17 -1.80 -0.02 0.00 0.56 0.00 0.00 36.38 35.29 1bil s VAL 150 CO -0.08 -0.43 -0.06 0.72 -0.31 0.00 0.00 175.10 174.95 1bil s PHE 151 N -3.97 0.48 0.13 2.82 -0.71 -0.84 0.18 117.98 116.07 1bil s PHE 151 Ca 0.16 -0.51 0.06 0.00 -1.04 0.00 0.00 56.93 55.60 1bil s PHE 151 Cb 0.05 -0.31 -0.04 0.00 -1.21 0.00 0.00 43.02 41.51 1bil s PHE 151 CO -0.02 -0.13 -0.13 -1.12 -1.34 0.00 0.00 175.22 172.48 1bil s SER 152 N -1.51 1.97 -0.04 1.98 0.01 0.98 -0.42 113.70 116.67 1bil s SER 152 Ca -0.13 -0.86 0.03 0.00 1.31 0.00 0.00 55.95 56.30 1bil s SER 152 Cb -0.10 -0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.08 1bil s SER 152 CO -0.00 -0.19 -0.12 -0.36 0.41 0.00 0.00 173.24 172.98 1bil s PHE 153 N -2.42 1.24 -0.15 2.43 0.40 -0.04 -0.43 117.98 119.01 1bil s PHE 153 Ca 0.11 -0.35 0.02 0.00 -0.60 0.00 0.00 56.93 56.11 1bil s PHE 153 Cb -0.03 -0.87 0.01 0.00 0.51 0.00 0.00 43.02 42.64 1bil s PHE 153 CO 0.03 -0.15 -0.20 -0.47 0.70 0.00 0.00 175.22 175.13 1bil s TYR 154 N 0.24 2.59 -0.10 0.36 5.04 0.76 -1.75 117.35 124.49 1bil s TYR 154 Ca -0.05 -1.38 0.01 0.00 -2.44 0.00 0.00 57.07 53.21 1bil s TYR 154 Cb -0.11 -1.79 -0.02 0.00 0.35 0.00 0.00 41.96 40.40 1bil s TYR 154 CO 0.01 -0.66 -0.15 0.71 -1.34 0.00 0.00 175.55 174.12 1bil s TYR 155 N 1.03 2.74 0.22 4.97 2.02 -1.26 -1.40 117.35 125.67 1bil s TYR 155 Ca -0.02 -0.58 0.04 0.00 -0.37 0.00 0.00 57.07 56.14 1bil s TYR 155 Cb -0.14 -1.77 -0.03 0.00 -0.40 0.00 0.00 41.96 39.61 1bil s TYR 155 CO -0.06 -0.14 0.35 1.21 -1.57 0.00 0.00 175.55 175.34 1bil s ASN 156 N 0.08 6.33 -0.01 2.29 3.04 -0.03 -4.41 114.94 122.23 1bil s ASN 156 Ca -0.06 0.15 -0.29 0.00 0.04 0.00 0.00 52.86 52.69 1bil s ASN 156 Cb -0.15 -1.90 -0.03 0.00 -1.54 0.00 0.00 41.25 37.63 1bil s ASN 156 CO 0.05 -0.05 0.95 -0.13 -3.04 0.00 0.00 177.10 174.88 1bil s ARG 157 N -3.74 4.54 0.40 0.43 0.52 -1.26 -4.90 118.95 114.94 1bil s ARG 157 Ca 0.35 1.36 -0.26 0.00 -0.52 0.00 0.00 55.73 56.65 1bil s ARG 157 Cb -0.10 -3.46 -0.09 0.00 0.52 0.00 0.00 34.95 31.82 1bil s ARG 157 CO 0.29 -0.04 1.34 0.34 0.02 0.00 0.00 175.30 177.25 1bil s ASP 158 N 0.99 6.32 -0.00 0.23 2.15 -1.26 -4.85 116.67 120.25 1bil s ASP 158 Ca 0.50 2.74 -0.03 0.00 0.43 0.00 0.00 52.55 56.19 1bil s ASP 158 Cb -0.21 -2.65 -0.01 0.00 -0.30 0.00 0.00 42.92 39.76 1bil s ASP 158 CO 0.27 -0.85 -0.07 -1.20 -0.17 0.00 0.00 175.17 173.15 1bil n SER 159 N 0.21 0.72 0.00 -0.34 7.64 -1.26 -5.03 113.62 115.56 1bil n SER 159 Ca 0.03 0.11 0.00 0.00 1.01 0.00 0.00 58.87 60.02 1bil n SER 159 Cb 0.43 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 1bil n SER 159 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1bil n SER 160 N -3.19 0.00 -4.68 6.43 7.64 -1.26 -5.23 113.62 113.33 1bil n SER 160 Ca -0.03 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.43 1bil n SER 160 Cb 0.10 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.27 1bil n SER 160 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1bil s LEU 161 N 0.00 4.24 0.15 -3.43 2.96 -1.26 -4.93 118.68 116.41 1bil s LEU 161 Ca 0.00 1.63 0.10 0.00 -0.22 0.00 0.00 54.13 55.64 1bil s LEU 161 Cb 0.00 -3.55 -0.14 0.00 0.50 0.00 0.00 46.19 43.00 1bil s LEU 161 CO 0.00 -0.54 1.29 1.23 -1.32 0.00 0.00 176.35 177.01 1bil h GLY 162 N 8.30 0.00 0.00 7.98 0.00 -1.89 -3.42 103.07 114.04 1bil h GLY 162 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.02 1bil h GLY 162 CO 0.88 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.03 1bil n GLY 163 N 1.33 -1.02 3.61 4.60 0.00 -1.08 -0.85 105.19 111.78 1bil n GLY 163 Ca -0.00 -1.17 -0.14 0.00 0.00 0.00 0.00 46.02 44.70 1bil n GLY 163 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1bil s GLN 164 N -2.00 0.83 -0.16 1.61 0.74 -0.49 -1.66 119.66 118.53 1bil s GLN 164 Ca 0.00 0.78 -0.01 0.00 0.05 0.00 0.00 55.36 56.17 1bil s GLN 164 Cb 0.00 0.40 -0.01 0.00 1.10 0.00 0.00 33.01 34.50 1bil s GLN 164 CO 0.00 -0.14 -0.10 0.42 -0.55 0.00 0.00 175.29 174.91 1bil s ILE 165 N 0.01 3.14 -0.23 -2.34 1.01 -0.71 -0.17 121.20 121.90 1bil s ILE 165 Ca -0.02 -0.61 -0.03 0.00 0.00 0.00 0.00 60.65 59.99 1bil s ILE 165 Cb -0.04 -2.36 0.01 0.00 0.01 0.00 0.00 42.46 40.08 1bil s ILE 165 CO 0.02 0.49 -0.05 -0.69 0.00 0.00 0.00 174.94 174.72 1bil s VAL 166 N 0.73 3.18 -0.28 2.92 1.01 0.42 -0.43 120.40 127.96 1bil s VAL 166 Ca -0.05 -0.71 -0.17 0.00 0.00 0.00 0.00 61.98 61.05 1bil s VAL 166 Cb -0.15 -2.51 -0.03 0.00 0.00 0.00 0.00 36.38 33.69 1bil s VAL 166 CO 0.02 0.33 0.48 -0.76 0.00 0.00 0.00 175.10 175.16 1bil s LEU 167 N 1.42 4.09 0.00 3.92 1.43 -0.39 -0.01 118.68 129.14 1bil s LEU 167 Ca 0.04 0.38 0.00 0.00 -1.03 0.00 0.00 54.13 53.52 1bil s LEU 167 Cb -0.15 -2.59 0.00 0.00 0.03 0.00 0.00 46.19 43.48 1bil s LEU 167 CO -0.04 -0.29 0.00 0.61 0.23 0.00 0.00 176.35 176.86 1bil n GLY 168 N 4.53 0.73 0.00 -3.19 0.00 0.13 -1.57 105.19 105.82 1bil n GLY 168 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1bil n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bil n GLY 169 N -1.23 -0.56 3.09 -0.02 0.00 -1.11 -2.48 105.19 102.88 1bil n GLY 169 Ca 0.00 -0.69 -0.08 0.00 0.00 0.00 0.00 46.02 45.25 1bil n GLY 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bil s SER 170 N -4.00 0.37 -0.38 1.61 1.04 -1.26 -3.41 113.70 107.67 1bil s SER 170 Ca 0.00 -0.82 -0.09 0.00 0.48 0.00 0.00 55.95 55.52 1bil s SER 170 Cb 0.00 0.20 0.05 0.00 0.10 0.00 0.00 66.02 66.37 1bil s SER 170 CO 0.00 -0.55 0.19 -0.62 0.98 0.00 0.00 173.24 173.24 1bil s ASP 171 N -2.56 5.57 0.00 7.02 -1.08 -1.26 -4.94 116.67 119.41 1bil s ASP 171 Ca 0.01 -1.20 0.12 0.00 -0.52 0.00 0.00 52.55 50.96 1bil s ASP 171 Cb 0.03 -1.96 0.71 0.00 -1.46 0.00 0.00 42.92 40.25 1bil s ASP 171 CO -0.08 -0.41 1.15 -0.81 0.52 0.00 0.00 175.17 175.53 1bil n PRO 172 N 4.91 0.50 0.07 4.34 -0.04 -1.26 -1.58 135.00 141.94 1bil n PRO 172 Ca -0.11 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.46 1bil n PRO 172 Cb 0.45 -1.38 -0.01 0.00 -0.04 0.00 0.00 33.50 32.52 1bil n PRO 172 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1bil n GLN 173 N -0.88 0.53 -0.35 0.54 7.27 -1.26 -3.99 117.38 119.25 1bil n GLN 173 Ca 0.09 0.04 0.07 0.00 0.07 0.00 0.00 57.00 57.28 1bil n GLN 173 Cb 0.04 -1.72 0.23 0.00 2.41 0.00 0.00 30.24 31.19 1bil n GLN 173 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 1bil n HIS 174 N -2.44 0.81 -3.65 3.69 8.25 -0.61 -4.78 115.22 116.49 1bil n HIS 174 Ca -0.00 -0.65 -0.15 0.00 -0.26 0.00 0.00 57.72 56.66 1bil n HIS 174 Cb 0.52 -0.17 -0.07 0.00 1.12 0.00 0.00 29.99 31.40 1bil n HIS 174 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 1bil s TYR 175 N -1.79 -0.36 0.14 4.41 1.13 -1.25 -2.02 117.35 117.60 1bil s TYR 175 Ca 0.35 0.54 0.03 0.00 -1.41 0.00 0.00 57.07 56.58 1bil s TYR 175 Cb 0.24 0.23 -0.04 0.00 -1.10 0.00 0.00 41.96 41.29 1bil s TYR 175 CO 0.15 -0.51 0.18 -1.21 -2.51 0.00 0.00 175.55 171.65 1bil s GLU 176 N -1.58 3.13 2.16 -3.49 2.02 0.07 -4.87 118.70 116.14 1bil s GLU 176 Ca -0.11 -0.71 0.00 0.00 0.02 0.00 0.00 54.97 54.17 1bil s GLU 176 Cb -0.02 -2.80 0.00 0.00 0.10 0.00 0.00 34.13 31.40 1bil s GLU 176 CO 0.04 0.52 0.00 0.41 0.02 0.00 0.00 175.26 176.25 1bil n GLY 177 N -0.23 -0.79 3.57 -1.39 0.00 -1.26 -3.87 105.19 101.22 1bil n GLY 177 Ca -0.08 -1.15 -0.23 0.00 0.00 0.00 0.00 46.02 44.56 1bil n GLY 177 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1bil s ASN 178 N -4.00 4.11 0.66 1.61 -0.87 -1.26 -5.02 114.94 110.18 1bil s ASN 178 Ca 0.00 -0.83 -0.17 0.00 -1.57 0.00 0.00 52.86 50.29 1bil s ASN 178 Cb 0.00 -0.59 0.00 0.00 -0.02 0.00 0.00 41.25 40.64 1bil s ASN 178 CO 0.00 0.00 1.20 -0.36 -2.57 0.00 0.00 177.10 175.38 1bil s PHE 179 N -2.42 2.25 -0.07 2.20 0.08 -1.26 -4.75 117.98 114.01 1bil s PHE 179 Ca 0.31 1.55 0.02 0.00 0.12 0.00 0.00 56.93 58.93 1bil s PHE 179 Cb -0.05 -3.46 0.01 0.00 -0.57 0.00 0.00 43.02 38.95 1bil s PHE 179 CO 0.18 -2.38 -0.12 -1.58 -0.10 0.00 0.00 175.22 171.21 1bil s HIS 180 N -1.81 1.50 0.08 0.36 5.65 -1.00 -4.89 115.29 115.17 1bil s HIS 180 Ca 0.76 -0.57 0.02 0.00 0.25 0.00 0.00 55.06 55.51 1bil s HIS 180 Cb -0.29 -1.10 -0.04 0.00 -1.18 0.00 0.00 32.58 29.97 1bil s HIS 180 CO 0.39 -0.29 0.16 0.71 -0.65 0.00 0.00 174.74 175.06 1bil s TYR 181 N 0.70 3.37 -0.16 3.88 2.02 -1.26 -1.25 117.35 124.64 1bil s TYR 181 Ca -0.14 0.16 -0.01 0.00 -0.37 0.00 0.00 57.07 56.71 1bil s TYR 181 Cb -0.16 -1.69 0.05 0.00 -0.40 0.00 0.00 41.96 39.76 1bil s TYR 181 CO 0.03 0.56 -0.01 0.42 -1.57 0.00 0.00 175.55 174.98 1bil s ILE 182 N -1.48 0.77 0.78 2.71 1.09 -0.94 -4.88 121.20 119.25 1bil s ILE 182 Ca 0.32 -0.49 -0.12 0.00 -1.10 0.00 0.00 60.65 59.27 1bil s ILE 182 Cb -0.12 -1.07 0.06 0.00 -1.06 0.00 0.00 42.46 40.27 1bil s ILE 182 CO 0.25 0.01 1.12 0.20 -0.10 0.00 0.00 174.94 176.42 1bil s ASN 183 N 1.77 4.24 0.51 3.58 0.02 -1.26 -2.28 114.94 121.53 1bil s ASN 183 Ca 0.01 1.98 -0.19 0.00 -1.02 0.00 0.00 52.86 53.63 1bil s ASN 183 Cb -0.16 -2.54 -0.07 0.00 0.02 0.00 0.00 41.25 38.50 1bil s ASN 183 CO -0.07 -2.22 1.07 -0.76 0.02 0.00 0.00 177.10 175.14 1bil s LEU 184 N -5.82 3.78 0.16 0.60 1.43 -0.83 -4.66 118.68 113.33 1bil s LEU 184 Ca 0.64 1.98 -0.06 0.00 -1.03 0.00 0.00 54.13 55.67 1bil s LEU 184 Cb -0.20 -4.56 0.00 0.00 0.03 0.00 0.00 46.19 41.46 1bil s LEU 184 CO 0.53 -0.95 1.42 0.40 0.23 0.00 0.00 176.35 177.98 1bil h ILE 185 N 1.33 1.32 -1.89 -0.59 1.08 -1.72 -3.46 117.51 113.57 1bil h ILE 185 Ca -0.49 -1.94 0.03 0.00 -0.39 0.00 0.00 64.86 62.07 1bil h ILE 185 Cb 1.23 1.91 -0.20 0.00 -3.07 0.00 0.00 36.82 36.69 1bil h ILE 185 CO 0.58 0.60 0.40 -1.59 -0.69 0.00 0.00 178.15 177.46 1bil s LYS 186 N -3.83 0.82 0.76 2.37 -2.85 -1.26 -5.11 119.74 110.63 1bil s LYS 186 Ca -0.08 0.08 -0.12 0.00 -1.00 0.00 0.00 55.97 54.86 1bil s LYS 186 Cb 0.10 0.38 0.05 0.00 -2.06 0.00 0.00 37.83 36.31 1bil s LYS 186 CO 0.86 -0.28 1.11 0.99 0.10 0.00 0.00 175.35 178.13 1bil s THR 187 N -1.58 3.08 0.00 3.79 2.01 -1.26 -4.09 115.64 117.59 1bil s THR 187 Ca -0.04 0.39 0.00 0.00 0.31 0.00 0.00 61.69 62.36 1bil s THR 187 Cb -0.00 -2.83 0.00 0.00 0.01 0.00 0.00 72.50 69.67 1bil s THR 187 CO 0.02 -0.41 0.00 0.61 -0.69 0.00 0.00 174.62 174.15 1bil n GLY 188 N -0.76 2.21 3.01 4.40 0.00 -1.26 -5.05 105.19 107.73 1bil n GLY 188 Ca 0.10 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.01 1bil n GLY 188 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1bil s VAL 189 N -2.33 0.26 -1.49 1.61 -7.23 -1.26 -4.36 120.40 105.61 1bil s VAL 189 Ca 0.00 -0.93 -0.10 0.00 -1.81 0.00 0.00 61.98 59.13 1bil s VAL 189 Cb 0.00 -0.38 0.01 0.00 0.56 0.00 0.00 36.38 36.57 1bil s VAL 189 CO 0.00 -0.43 2.53 0.79 -0.31 0.00 0.00 175.10 177.67 1bil n TRP 190 N 1.62 2.84 -4.26 2.82 5.03 -1.26 -4.84 117.44 119.38 1bil n TRP 190 Ca -0.23 -2.98 -0.21 0.00 3.03 0.00 0.00 57.50 57.11 1bil n TRP 190 Cb 0.55 -2.35 -0.16 0.00 -1.03 0.00 0.00 31.31 28.32 1bil n TRP 190 CO 0.00 0.00 0.00 -1.14 -0.03 0.00 0.00 177.69 176.52 1bil s GLN 191 N 1.73 1.03 0.36 -0.99 0.74 -1.26 -1.10 119.66 120.17 1bil s GLN 191 Ca 0.57 -0.18 0.09 0.00 0.05 0.00 0.00 55.36 55.89 1bil s GLN 191 Cb 0.16 -0.97 -0.06 0.00 1.10 0.00 0.00 33.01 33.24 1bil s GLN 191 CO -0.07 -0.06 -0.03 0.96 -0.55 0.00 0.00 175.29 175.55 1bil s ILE 192 N 0.85 2.35 -0.01 -2.34 -4.36 0.02 -1.95 121.20 115.76 1bil s ILE 192 Ca -0.12 -2.06 -0.20 0.00 -0.26 0.00 0.00 60.65 58.01 1bil s ILE 192 Cb -0.15 -2.77 -0.05 0.00 1.25 0.00 0.00 42.46 40.74 1bil s ILE 192 CO 0.01 -0.16 0.58 -1.58 0.24 0.00 0.00 174.94 174.03 1bil s GLN 193 N -3.68 4.30 0.07 0.37 0.74 -1.26 0.12 119.66 120.32 1bil s GLN 193 Ca 0.34 0.70 0.06 0.00 0.05 0.00 0.00 55.36 56.51 1bil s GLN 193 Cb 0.03 -3.35 -0.04 0.00 1.10 0.00 0.00 33.01 30.75 1bil s GLN 193 CO 0.18 0.36 -0.09 1.41 -0.55 0.00 0.00 175.29 176.60 1bil s MET 194 N -0.15 2.27 -0.38 1.67 -2.45 0.15 -4.50 119.30 115.90 1bil s MET 194 Ca 0.30 -0.93 0.13 0.00 -1.25 0.00 0.00 55.69 53.94 1bil s MET 194 Cb -0.18 -2.37 0.42 0.00 1.25 0.00 0.00 34.83 33.95 1bil s MET 194 CO 0.17 0.54 0.95 1.17 1.05 0.00 0.00 175.02 178.89 1bil n LYS 195 N 0.98 1.87 0.00 4.11 4.81 -0.57 -0.52 118.16 128.84 1bil n LYS 195 Ca -0.14 -3.73 0.00 0.00 -0.87 0.00 0.00 58.31 53.57 1bil n LYS 195 Cb 0.52 -1.67 0.00 0.00 0.02 0.00 0.00 35.03 33.91 1bil n LYS 195 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1bil n GLY 196 N -0.12 4.14 3.15 3.14 0.00 -0.67 -4.71 105.19 110.11 1bil n GLY 196 Ca 0.21 -1.21 -0.32 0.00 0.00 0.00 0.00 46.02 44.70 1bil n GLY 196 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bil s VAL 197 N -0.69 2.00 -0.05 1.61 1.01 -0.77 -0.59 120.40 122.92 1bil s VAL 197 Ca 0.00 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.05 1bil s VAL 197 Cb 0.00 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.57 1bil s VAL 197 CO 0.00 0.54 -0.04 -0.44 0.00 0.00 0.00 175.10 175.16 1bil s SER 198 N 0.91 4.89 -0.29 3.32 0.01 0.56 -1.74 113.70 121.37 1bil s SER 198 Ca -0.05 0.01 -0.09 0.00 1.31 0.00 0.00 55.95 57.13 1bil s SER 198 Cb -0.15 -1.27 -0.02 0.00 0.21 0.00 0.00 66.02 64.79 1bil s SER 198 CO -0.04 0.34 0.14 -0.69 0.41 0.00 0.00 173.24 173.41 1bil s VAL 199 N -0.91 4.70 0.00 3.43 1.01 -0.89 -1.57 120.40 126.19 1bil s VAL 199 Ca 0.15 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 61.92 1bil s VAL 199 Cb -0.11 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 32.96 1bil s VAL 199 CO 0.04 0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.93 1bil n GLY 200 N 4.99 2.04 0.12 4.51 0.00 0.71 -1.52 105.19 116.03 1bil n GLY 200 Ca -0.14 0.40 -0.15 0.00 0.00 0.00 0.00 46.02 46.12 1bil n GLY 200 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1bil h SER 201 N 0.00 0.43 -3.80 1.61 4.64 -1.91 -3.47 113.55 111.05 1bil h SER 201 Ca 0.00 -0.43 -0.68 0.00 -0.47 0.00 0.00 61.79 60.21 1bil h SER 201 Cb 0.00 -0.14 -0.30 0.00 -0.31 0.00 0.00 62.40 61.65 1bil h SER 201 CO 0.00 1.30 -0.85 -0.44 -0.87 0.00 0.00 176.83 175.97 1bil s SER 202 N -7.12 3.37 -0.19 4.97 0.01 -0.58 -5.04 113.70 109.12 1bil s SER 202 Ca -0.04 -0.44 -0.33 0.00 1.31 0.00 0.00 55.95 56.45 1bil s SER 202 Cb 0.08 -1.06 -0.10 0.00 0.21 0.00 0.00 66.02 65.15 1bil s SER 202 CO 0.88 0.23 2.07 0.41 0.41 0.00 0.00 173.24 177.24 1bil n THR 203 N 3.04 0.42 -0.01 1.44 -1.04 -1.26 -2.08 114.28 114.78 1bil n THR 203 Ca -0.18 -0.25 0.04 0.00 -2.04 0.00 0.00 64.05 61.62 1bil n THR 203 Cb 0.52 -2.03 -0.08 0.00 -1.82 0.00 0.00 70.33 66.92 1bil n THR 203 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1bil n LEU 204 N 9.02 0.00 -4.11 -4.42 7.94 -0.71 -4.93 117.00 119.79 1bil n LEU 204 Ca 0.30 0.00 -0.11 0.00 -1.11 0.00 0.00 56.01 55.09 1bil n LEU 204 Cb 0.32 0.04 -0.08 0.00 0.53 0.00 0.00 43.42 44.23 1bil n LEU 204 CO 0.72 0.04 -0.08 -0.76 -1.11 0.00 0.00 177.39 176.19 1bil s LEU 205 N -3.89 0.89 -1.50 -1.96 1.43 -0.96 -4.86 118.68 107.84 1bil s LEU 205 Ca -0.04 -1.17 -0.14 0.00 -1.03 0.00 0.00 54.13 51.74 1bil s LEU 205 Cb 0.06 0.92 0.12 0.00 0.03 0.00 0.00 46.19 47.32 1bil s LEU 205 CO 0.44 -0.94 0.69 0.00 0.23 0.00 0.00 176.35 176.77 1bil h GLU 207 N -1.35 0.22 -2.30 0.00 4.39 -1.89 -1.71 114.58 111.94 1bil h GLU 207 Ca -0.52 -0.01 -0.72 0.00 0.34 0.00 0.00 59.36 58.45 1bil h GLU 207 Cb 1.34 -0.05 -0.33 0.00 -0.10 0.00 0.00 28.75 29.61 1bil h GLU 207 CO 0.66 0.15 0.31 -0.25 -1.16 0.00 0.00 179.01 178.72 1bil n ASP 208 N -5.14 6.06 -0.82 1.42 8.00 -1.26 -4.72 116.55 120.09 1bil n ASP 208 Ca 0.07 -3.66 0.10 0.00 0.71 0.00 0.00 54.79 52.00 1bil n ASP 208 Cb 0.28 -0.92 -0.05 0.00 -0.02 0.00 0.00 41.12 40.41 1bil n ASP 208 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bil n GLY 209 N -0.01 -3.08 2.99 0.44 0.00 -1.03 -5.07 105.19 99.43 1bil n GLY 209 Ca 0.39 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1bil n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bil s LEU 211 N 0.00 3.24 -0.05 0.00 1.43 -1.26 -0.68 118.68 121.36 1bil s LEU 211 Ca 0.21 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 53.01 1bil s LEU 211 Cb -0.01 -1.99 0.02 0.00 0.03 0.00 0.00 46.19 44.24 1bil s LEU 211 CO 0.01 0.16 -0.08 0.00 0.23 0.00 0.00 176.35 176.68 1bil s ALA 212 N -1.33 0.92 0.07 4.21 0.00 0.32 -0.98 121.76 124.97 1bil s ALA 212 Ca 0.24 -0.21 -0.20 0.00 0.00 0.00 0.00 51.96 51.79 1bil s ALA 212 Cb -0.11 -0.49 -0.07 0.00 0.00 0.00 0.00 23.12 22.45 1bil s ALA 212 CO 0.16 0.02 0.60 -0.51 0.00 0.00 0.00 175.76 176.04 1bil s LEU 213 N 0.84 4.52 -0.55 0.00 1.43 0.13 -0.80 118.68 124.24 1bil s LEU 213 Ca -0.12 1.30 -0.17 0.00 -1.03 0.00 0.00 54.13 54.10 1bil s LEU 213 Cb -0.15 -2.95 0.11 0.00 0.03 0.00 0.00 46.19 43.23 1bil s LEU 213 CO 0.01 0.24 0.59 -0.69 0.23 0.00 0.00 176.35 176.73 1bil s VAL 214 N -0.98 5.02 -0.43 -1.59 1.01 -0.26 0.11 120.40 123.28 1bil s VAL 214 Ca 0.30 -1.17 -0.06 0.00 0.00 0.00 0.00 61.98 61.05 1bil s VAL 214 Cb -0.20 -4.39 0.10 0.00 0.00 0.00 0.00 36.38 31.90 1bil s VAL 214 CO 0.20 -0.95 0.25 -0.62 0.00 0.00 0.00 175.10 173.97 1bil s ASP 215 N 3.47 5.47 0.54 3.32 -1.08 0.74 -4.65 116.67 124.47 1bil s ASP 215 Ca 0.08 -1.84 0.36 0.00 -0.52 0.00 0.00 52.55 50.63 1bil s ASP 215 Cb -0.26 -1.92 1.87 0.00 -1.46 0.00 0.00 42.92 41.15 1bil s ASP 215 CO 0.05 -0.58 2.10 0.71 0.52 0.00 0.00 175.17 177.97 1bil h THR 216 N 6.23 0.00 -0.61 1.71 1.35 -1.84 -1.52 112.91 118.22 1bil h THR 216 Ca -0.18 -0.09 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1bil h THR 216 Cb 1.06 0.94 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 1bil h THR 216 CO 0.76 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.64 1bil n GLY 217 N -0.91 2.85 3.49 5.82 0.00 -1.26 -4.79 105.19 110.40 1bil n GLY 217 Ca -0.02 -0.89 -0.34 0.00 0.00 0.00 0.00 46.02 44.77 1bil n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bil s ALA 218 N -2.32 3.08 -0.01 4.61 0.00 -0.57 -5.02 121.76 121.53 1bil s ALA 218 Ca 0.53 -0.90 -0.25 0.00 0.00 0.00 0.00 51.96 51.34 1bil s ALA 218 Cb 0.37 -1.73 -0.19 0.00 0.00 0.00 0.00 23.12 21.58 1bil s ALA 218 CO 0.20 0.02 1.30 0.77 0.00 0.00 0.00 175.76 178.05 1bil h SER 219 N 7.11 -0.06 -1.26 0.00 0.02 -1.87 0.13 113.55 117.63 1bil h SER 219 Ca -0.34 -0.38 -0.54 0.00 -0.84 0.00 0.00 61.79 59.69 1bil h SER 219 Cb 1.18 0.02 -0.05 0.00 0.14 0.00 0.00 62.40 63.68 1bil h SER 219 CO 0.63 0.36 -0.39 -0.31 -1.14 0.00 0.00 176.83 175.97 1bil s TYR 220 N -4.50 2.36 0.12 3.45 1.51 -1.26 -3.00 117.35 116.03 1bil s TYR 220 Ca -0.15 -0.62 -0.25 0.00 -1.01 0.00 0.00 57.07 55.03 1bil s TYR 220 Cb 0.02 -2.03 -0.07 0.00 -0.11 0.00 0.00 41.96 39.77 1bil s TYR 220 CO 0.64 -0.13 0.78 0.42 -1.11 0.00 0.00 175.55 176.16 1bil s ILE 221 N -2.60 4.51 0.31 2.71 1.01 -1.01 -3.77 121.20 122.35 1bil s ILE 221 Ca 0.42 1.70 0.06 0.00 0.00 0.00 0.00 60.65 62.83 1bil s ILE 221 Cb -0.01 -4.14 -0.06 0.00 0.01 0.00 0.00 42.46 38.26 1bil s ILE 221 CO 0.24 0.45 -0.02 -0.94 0.00 0.00 0.00 174.94 174.67 1bil s SER 222 N -0.67 2.81 0.18 3.58 1.04 -0.85 -1.32 113.70 118.47 1bil s SER 222 Ca 0.37 -1.26 -0.13 0.00 0.48 0.00 0.00 55.95 55.42 1bil s SER 222 Cb -0.22 -0.18 0.01 0.00 0.10 0.00 0.00 66.02 65.73 1bil s SER 222 CO 0.25 -0.42 0.39 -0.83 0.98 0.00 0.00 173.24 173.61 1bil s GLY 223 N -3.49 0.23 0.87 7.32 0.00 -1.09 -1.75 107.32 109.41 1bil s GLY 223 Ca 0.32 -0.60 -0.11 0.00 0.00 0.00 0.00 44.72 44.32 1bil s GLY 223 CO 0.14 -0.59 1.17 -1.35 0.00 0.00 0.00 173.10 172.47 1bil s SER 224 N -2.93 3.23 0.29 1.64 1.04 -1.25 -0.81 113.70 114.92 1bil s SER 224 Ca 0.14 2.25 0.05 0.00 0.48 0.00 0.00 55.95 58.86 1bil s SER 224 Cb 0.01 -2.57 0.71 0.00 0.10 0.00 0.00 66.02 64.27 1bil s SER 224 CO -0.01 -2.90 1.76 0.74 0.98 0.00 0.00 173.24 173.80 1bil h THR 225 N -1.47 0.66 -0.21 2.02 2.02 -1.92 -0.21 112.91 113.80 1bil h THR 225 Ca -0.44 -0.23 -0.16 0.00 0.77 0.00 0.00 66.41 66.35 1bil h THR 225 Cb 1.28 -0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.62 1bil h THR 225 CO 0.44 0.12 -0.53 0.77 0.37 0.00 0.00 175.52 176.69 1bil h SER 226 N 0.66 0.66 -0.09 4.18 4.64 -1.98 -2.25 113.55 119.38 1bil h SER 226 Ca 0.56 -0.34 -0.17 0.00 -0.47 0.00 0.00 61.79 61.37 1bil h SER 226 Cb 0.91 -0.19 0.01 0.00 -0.31 0.00 0.00 62.40 62.82 1bil h SER 226 CO -0.41 1.06 -0.61 0.28 -0.87 0.00 0.00 176.83 176.29 1bil h SER 227 N 0.46 0.68 -0.53 4.97 0.02 -1.59 -2.84 113.55 114.73 1bil h SER 227 Ca 0.01 -0.67 -0.00 0.00 -0.84 0.00 0.00 61.79 60.30 1bil h SER 227 Cb 1.08 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.39 1bil h SER 227 CO 0.10 1.24 0.33 0.40 -1.14 0.00 0.00 176.83 177.77 1bil h ILE 228 N 0.17 1.15 0.46 3.27 1.08 -1.08 0.20 117.51 122.76 1bil h ILE 228 Ca -0.05 -0.32 -0.02 0.00 -0.39 0.00 0.00 64.86 64.07 1bil h ILE 228 Cb 1.26 0.39 0.00 0.00 -3.07 0.00 0.00 36.82 35.40 1bil h ILE 228 CO 0.12 0.15 -0.22 -0.33 -0.69 0.00 0.00 178.15 177.19 1bil h GLU 229 N 0.73 -0.59 -0.18 2.37 5.08 -1.46 0.36 114.58 120.90 1bil h GLU 229 Ca 0.19 0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.65 1bil h GLU 229 Cb -0.04 0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.28 1bil h GLU 229 CO -0.04 -0.39 -0.22 -0.22 -1.00 0.00 0.00 179.01 177.14 1bil h LYS 230 N -0.62 -0.25 -0.26 2.33 3.64 -1.22 -0.83 116.57 119.36 1bil h LYS 230 Ca -0.06 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1bil h LYS 230 Cb 0.47 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.33 1bil h LYS 230 CO 0.10 -0.17 0.14 1.25 -2.27 0.00 0.00 179.45 178.51 1bil h LEU 231 N -0.26 0.22 -1.07 5.20 5.85 -0.36 -2.62 115.31 122.27 1bil h LEU 231 Ca 0.12 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.75 1bil h LEU 231 Cb 0.44 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 1bil h LEU 231 CO -0.33 0.17 -0.36 0.24 -0.34 0.00 0.00 178.44 177.82 1bil h MET 232 N 0.29 0.20 -0.43 1.25 2.86 0.04 -1.61 114.93 117.54 1bil h MET 232 Ca 0.10 -0.08 -0.06 0.00 -2.06 0.00 0.00 59.70 57.60 1bil h MET 232 Cb 0.01 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 1bil h MET 232 CO -0.06 0.53 0.02 1.49 1.06 0.00 0.00 176.91 179.95 1bil h GLU 233 N 0.17 0.69 0.00 1.72 4.81 -1.02 1.63 114.58 122.58 1bil h GLU 233 Ca 0.02 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 1bil h GLU 233 Cb 0.72 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.00 1bil h GLU 233 CO 0.05 0.69 0.00 0.00 -0.73 0.00 0.00 179.01 179.02 1bil h ALA 234 N 1.37 1.00 0.00 2.92 0.00 -0.93 -2.23 119.26 121.39 1bil h ALA 234 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.78 1bil h ALA 234 Cb 0.38 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 1bil h ALA 234 CO 0.01 0.00 -2.13 1.28 0.00 0.00 0.00 179.25 178.42 1bil n LEU 235 N -2.95 0.00 -0.68 0.00 4.32 -0.94 -4.99 117.00 111.77 1bil n LEU 235 Ca 0.02 0.00 -0.02 0.00 -0.02 0.00 0.00 56.01 55.99 1bil n LEU 235 Cb 0.39 0.35 0.01 0.00 -1.62 0.00 0.00 43.42 42.54 1bil n LEU 235 CO 0.29 0.35 0.01 0.61 -1.22 0.00 0.00 177.39 177.44 1bil n GLY 236 N 1.85 0.76 3.97 -0.72 0.00 0.54 -4.97 105.19 106.63 1bil n GLY 236 Ca -0.24 -0.63 -0.21 0.00 0.00 0.00 0.00 46.02 44.94 1bil n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bil s ALA 237 N -2.90 4.01 0.02 4.61 0.00 -0.29 -4.95 121.76 122.25 1bil s ALA 237 Ca 0.04 -1.26 0.04 0.00 0.00 0.00 0.00 51.96 50.78 1bil s ALA 237 Cb -0.02 -1.85 -0.02 0.00 0.00 0.00 0.00 23.12 21.23 1bil s ALA 237 CO 0.05 -0.08 -0.13 0.15 0.00 0.00 0.00 175.76 175.75 1bil s LYS 238 N -4.26 0.96 -0.05 0.00 1.02 -0.03 -4.66 119.74 112.72 1bil s LYS 238 Ca 0.43 -0.61 -0.30 0.00 0.02 0.00 0.00 55.97 55.52 1bil s LYS 238 Cb -0.10 -0.95 -0.07 0.00 -0.52 0.00 0.00 37.83 36.20 1bil s LYS 238 CO 0.33 0.25 1.85 0.21 -0.92 0.00 0.00 175.35 177.06 1bil s LYS 239 N -0.75 4.00 -0.38 1.68 2.47 -1.26 0.14 119.74 125.64 1bil s LYS 239 Ca 0.03 2.29 0.02 0.00 -1.56 0.00 0.00 55.97 56.75 1bil s LYS 239 Cb -0.06 -4.11 0.11 0.00 -1.46 0.00 0.00 37.83 32.30 1bil s LYS 239 CO 0.00 -1.09 0.11 0.50 0.16 0.00 0.00 175.35 175.04 1bil s ARG 240 N 4.55 1.68 0.60 4.03 3.52 0.41 -4.92 118.95 128.82 1bil s ARG 240 Ca 0.83 -1.93 0.00 0.00 -0.13 0.00 0.00 55.73 54.49 1bil s ARG 240 Cb -0.36 -3.33 0.00 0.00 -1.56 0.00 0.00 34.95 29.70 1bil s ARG 240 CO 0.35 -0.99 0.00 1.28 -0.81 0.00 0.00 175.30 175.13 1bil n LEU 242 N 4.24 0.00 -0.01 -0.88 4.77 -1.26 -0.45 117.00 123.40 1bil n LEU 242 Ca 0.03 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.88 1bil n LEU 242 Cb 0.41 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.41 1bil n LEU 242 CO 0.26 0.00 0.67 -0.26 -1.33 0.00 0.00 177.39 176.73 1bil h PHE 243 N 0.00 0.04 -4.09 -1.77 -1.00 -1.99 -3.47 116.94 104.65 1bil h PHE 243 Ca 0.00 -0.01 -0.14 0.00 2.81 0.00 0.00 57.97 60.63 1bil h PHE 243 Cb 0.00 -0.01 -0.03 0.00 3.61 0.00 0.00 35.95 39.52 1bil h PHE 243 CO 0.00 0.45 -0.11 -0.25 -1.61 0.00 0.00 178.31 176.79 1bil n ASP 244 N -4.86 2.09 -4.55 2.17 8.00 0.40 -5.00 116.55 114.80 1bil n ASP 244 Ca -0.08 -1.49 -0.34 0.00 0.71 0.00 0.00 54.79 53.59 1bil n ASP 244 Cb 0.23 0.11 -0.11 0.00 -0.02 0.00 0.00 41.12 41.32 1bil n ASP 244 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1bil s TYR 245 N -1.49 3.05 0.31 1.24 2.02 -1.26 0.15 117.35 121.37 1bil s TYR 245 Ca 0.01 -0.14 0.10 0.00 -0.37 0.00 0.00 57.07 56.67 1bil s TYR 245 Cb 0.00 -1.90 -0.05 0.00 -0.40 0.00 0.00 41.96 39.61 1bil s TYR 245 CO 0.01 0.12 -0.09 0.14 -1.57 0.00 0.00 175.55 174.15 1bil s VAL 246 N -0.02 2.61 0.03 0.71 -7.23 0.12 -1.46 120.40 115.16 1bil s VAL 246 Ca 0.02 -2.18 -0.04 0.00 -1.81 0.00 0.00 61.98 57.97 1bil s VAL 246 Cb -0.13 -2.59 -0.01 0.00 0.56 0.00 0.00 36.38 34.21 1bil s VAL 246 CO 0.02 -0.30 0.06 0.54 -0.31 0.00 0.00 175.10 175.12 1bil s VAL 247 N -2.51 0.12 0.21 1.32 0.11 -0.09 -0.85 120.40 118.72 1bil s VAL 247 Ca 0.32 -1.01 -0.30 0.00 -2.93 0.00 0.00 61.98 58.05 1bil s VAL 247 Cb -0.02 -0.68 -0.09 0.00 -1.53 0.00 0.00 36.38 34.05 1bil s VAL 247 CO 0.17 -0.56 1.35 -0.54 -3.33 0.00 0.00 175.10 172.20 1bil s LYS 248 N -2.15 4.35 0.26 1.54 -0.14 -1.26 -0.04 119.74 122.30 1bil s LYS 248 Ca -0.09 2.13 -0.03 0.00 -1.36 0.00 0.00 55.97 56.62 1bil s LYS 248 Cb -0.04 -3.17 0.54 0.00 -1.68 0.00 0.00 37.83 33.48 1bil s LYS 248 CO -0.03 -0.31 1.65 0.00 -0.76 0.00 0.00 175.35 175.90 1bil h ASN 250 N 0.17 0.00 0.72 0.00 -1.07 -1.82 -2.60 115.58 110.98 1bil h ASN 250 Ca 0.47 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.84 1bil h ASN 250 Cb 0.87 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.12 1bil h ASN 250 CO -0.64 0.17 -0.09 -0.62 0.07 0.00 0.00 177.43 176.31 1bil n GLU 251 N -3.35 0.22 -0.16 4.14 1.02 -0.57 -4.21 120.64 117.74 1bil n GLU 251 Ca 0.00 -0.04 -0.08 0.00 -0.02 0.00 0.00 57.16 57.02 1bil n GLU 251 Cb 0.38 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.28 1bil n GLU 251 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1bil h GLY 252 N 4.99 -0.41 1.77 0.62 0.00 -1.29 -0.79 103.07 107.96 1bil h GLY 252 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 47.33 47.84 1bil h GLY 252 CO 0.00 -0.18 0.00 -1.05 0.00 0.00 0.00 176.54 175.31 1bil n PRO 253 N -5.42 0.00 0.05 4.80 -0.02 -1.26 -1.75 135.00 131.40 1bil n PRO 253 Ca 0.01 0.39 0.09 0.00 -2.02 0.00 0.00 63.50 61.96 1bil n PRO 253 Cb 0.35 -1.50 -0.08 0.00 -0.02 0.00 0.00 33.50 32.25 1bil n PRO 253 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1bil n THR 254 N -1.39 0.55 -1.87 3.45 -1.04 -0.30 -4.94 114.28 108.73 1bil n THR 254 Ca 0.00 -0.57 -0.34 0.00 -2.04 0.00 0.00 64.05 61.10 1bil n THR 254 Cb 0.00 -0.30 0.04 0.00 -1.82 0.00 0.00 70.33 68.26 1bil n THR 254 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1bil s LEU 255 N -5.16 3.51 0.70 -4.42 1.43 -0.72 -5.03 118.68 108.99 1bil s LEU 255 Ca -0.04 2.16 -0.11 0.00 -1.03 0.00 0.00 54.13 55.11 1bil s LEU 255 Cb 0.11 -4.57 0.01 0.00 0.03 0.00 0.00 46.19 41.77 1bil s LEU 255 CO 0.83 -1.63 1.09 -2.16 0.23 0.00 0.00 176.35 174.72 1bil s PRO 256 N -3.74 2.88 0.41 1.29 0.04 -1.26 -4.61 135.00 130.01 1bil s PRO 256 Ca 0.71 0.51 -0.23 0.00 0.04 0.00 0.00 61.00 62.03 1bil s PRO 256 Cb -0.24 -2.02 -0.10 0.00 0.04 0.00 0.00 34.50 32.18 1bil s PRO 256 CO 0.37 -1.03 1.00 -0.51 0.04 0.00 0.00 177.00 176.87 1bil s ASP 257 N -4.30 6.85 -0.12 6.66 1.01 -1.26 -4.30 116.67 121.21 1bil s ASP 257 Ca 0.58 1.88 0.02 0.00 0.71 0.00 0.00 52.55 55.75 1bil s ASP 257 Cb -0.11 -2.57 -0.00 0.00 1.01 0.00 0.00 42.92 41.25 1bil s ASP 257 CO 0.52 -0.42 -0.20 -0.63 0.21 0.00 0.00 175.17 174.65 1bil s ILE 258 N -1.85 2.43 -0.07 0.77 1.01 0.01 -0.21 121.20 123.30 1bil s ILE 258 Ca 0.59 -0.88 0.05 0.00 0.00 0.00 0.00 60.65 60.41 1bil s ILE 258 Cb -0.17 -1.97 -0.00 0.00 0.01 0.00 0.00 42.46 40.33 1bil s ILE 258 CO 0.21 0.54 -0.21 -0.44 0.00 0.00 0.00 174.94 175.05 1bil s SER 259 N 0.41 2.70 -0.27 3.58 0.01 -0.61 0.33 113.70 119.85 1bil s SER 259 Ca -0.15 -0.46 -0.08 0.00 1.31 0.00 0.00 55.95 56.57 1bil s SER 259 Cb -0.17 -0.92 -0.02 0.00 0.21 0.00 0.00 66.02 65.11 1bil s SER 259 CO 0.07 0.18 0.09 -0.36 0.41 0.00 0.00 173.24 173.63 1bil s PHE 260 N 0.10 3.12 -0.63 2.43 0.08 -0.39 -0.32 117.98 122.37 1bil s PHE 260 Ca -0.09 -0.48 -0.25 0.00 0.12 0.00 0.00 56.93 56.24 1bil s PHE 260 Cb -0.14 -2.27 0.05 0.00 -0.57 0.00 0.00 43.02 40.08 1bil s PHE 260 CO 0.05 -0.39 1.04 -1.01 -0.10 0.00 0.00 175.22 174.81 1bil s HIS 261 N 1.61 2.63 -0.07 0.36 3.76 0.24 0.26 115.29 124.08 1bil s HIS 261 Ca 0.06 -0.16 0.03 0.00 -0.15 0.00 0.00 55.06 54.84 1bil s HIS 261 Cb -0.16 -4.31 0.01 0.00 1.11 0.00 0.00 32.58 29.24 1bil s HIS 261 CO 0.04 -1.62 -0.14 -0.51 -0.85 0.00 0.00 174.74 171.66 1bil s LEU 262 N 4.46 1.72 -1.61 0.89 1.43 -0.56 -1.51 118.68 123.49 1bil s LEU 262 Ca 0.30 -0.34 -0.16 0.00 -1.03 0.00 0.00 54.13 52.90 1bil s LEU 262 Cb -0.13 -0.91 0.13 0.00 0.03 0.00 0.00 46.19 45.31 1bil s LEU 262 CO 0.16 0.06 0.85 0.61 0.23 0.00 0.00 176.35 178.25 1bil n GLY 263 N 3.73 -0.47 2.36 -3.19 0.00 -1.26 -1.90 105.19 104.46 1bil n GLY 263 Ca -0.22 0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1bil n GLY 263 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bil n GLY 264 N -1.48 1.62 3.72 -0.02 0.00 -1.26 -4.98 105.19 102.79 1bil n GLY 264 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 1bil n GLY 264 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bil s LYS 265 N -0.21 2.18 -0.12 1.61 1.02 -0.80 -5.14 119.74 118.28 1bil s LYS 265 Ca 0.00 -1.91 -0.04 0.00 0.02 0.00 0.00 55.97 54.04 1bil s LYS 265 Cb 0.00 -1.92 -0.04 0.00 -0.52 0.00 0.00 37.83 35.36 1bil s LYS 265 CO 0.00 -0.12 0.05 -1.21 -0.92 0.00 0.00 175.35 173.15 1bil s GLU 266 N -3.88 3.31 -0.33 1.68 0.41 -1.26 -1.50 118.70 117.13 1bil s GLU 266 Ca 0.39 -0.33 -0.03 0.00 -0.41 0.00 0.00 54.97 54.60 1bil s GLU 266 Cb 0.05 -2.98 0.06 0.00 -1.78 0.00 0.00 34.13 29.48 1bil s GLU 266 CO 0.21 0.63 0.07 0.71 -0.49 0.00 0.00 175.26 176.39 1bil s TYR 267 N -0.64 3.35 -0.13 1.61 1.51 0.14 -4.91 117.35 118.28 1bil s TYR 267 Ca 0.11 -1.96 -0.05 0.00 -1.01 0.00 0.00 57.07 54.16 1bil s TYR 267 Cb -0.12 -2.42 -0.04 0.00 -0.11 0.00 0.00 41.96 39.27 1bil s TYR 267 CO 0.02 -0.84 0.07 0.99 -1.11 0.00 0.00 175.55 174.69 1bil s THR 268 N 1.24 4.89 -0.18 -0.71 2.01 -1.26 -1.26 115.64 120.37 1bil s THR 268 Ca -0.01 -0.02 -0.00 0.00 0.31 0.00 0.00 61.69 61.97 1bil s THR 268 Cb -0.20 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 69.18 1bil s THR 268 CO -0.01 0.56 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.57 1bil s LEU 269 N -0.52 2.43 0.52 4.42 1.02 0.15 -4.97 118.68 121.74 1bil s LEU 269 Ca 0.11 -0.52 -0.04 0.00 0.02 0.00 0.00 54.13 53.70 1bil s LEU 269 Cb -0.12 -1.56 -0.00 0.00 0.02 0.00 0.00 46.19 44.52 1bil s LEU 269 CO 0.02 0.04 0.80 0.42 0.02 0.00 0.00 176.35 177.65 1bil s THR 270 N 1.10 4.01 0.58 5.49 -4.23 -1.26 -0.81 115.64 120.52 1bil s THR 270 Ca 0.00 -0.12 0.30 0.00 -1.18 0.00 0.00 61.69 60.69 1bil s THR 270 Cb -0.14 -3.54 0.42 0.00 1.34 0.00 0.00 72.50 70.57 1bil s THR 270 CO -0.05 -0.50 1.82 0.77 -0.54 0.00 0.00 174.62 176.12 1bil h SER 271 N 0.09 0.00 0.41 3.99 4.64 -1.82 0.67 113.55 121.53 1bil h SER 271 Ca -0.46 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.85 1bil h SER 271 Cb 1.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1bil h SER 271 CO 0.60 0.00 -0.06 0.00 -0.87 0.00 0.00 176.83 176.49 1bil h ALA 272 N 1.36 1.17 0.00 5.18 0.00 -1.89 0.41 119.26 125.48 1bil h ALA 272 Ca 0.33 -0.06 -0.30 0.00 0.00 0.00 0.00 54.91 54.88 1bil h ALA 272 Cb 1.61 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 19.33 1bil h ALA 272 CO -0.00 0.08 -2.04 -0.25 0.00 0.00 0.00 179.25 177.04 1bil n ASP 273 N -3.41 0.38 -0.11 0.00 8.00 0.21 -4.53 116.55 117.10 1bil n ASP 273 Ca -0.02 0.18 0.07 0.00 0.71 0.00 0.00 54.79 55.73 1bil n ASP 273 Cb 0.21 0.61 -0.05 0.00 -0.02 0.00 0.00 41.12 41.87 1bil n ASP 273 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bil n TYR 274 N -2.84 0.00 -4.19 1.24 0.18 -1.01 -4.94 117.16 105.61 1bil n TYR 274 Ca -0.24 0.00 -0.34 0.00 1.88 0.00 0.00 57.90 59.20 1bil n TYR 274 Cb 1.06 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.92 1bil n TYR 274 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 1bil s VAL 275 N -2.08 4.48 -1.06 -3.48 1.01 0.14 -1.43 120.40 117.99 1bil s VAL 275 Ca 0.07 -0.15 -0.20 0.00 0.00 0.00 0.00 61.98 61.69 1bil s VAL 275 Cb 0.11 -2.97 0.08 0.00 0.00 0.00 0.00 36.38 33.60 1bil s VAL 275 CO 0.48 0.51 1.43 -0.36 0.00 0.00 0.00 175.10 177.16 1bil s PHE 276 N -0.02 2.78 -1.30 5.22 0.08 0.20 -4.76 117.98 120.18 1bil s PHE 276 Ca 0.04 -1.20 -0.18 0.00 0.12 0.00 0.00 56.93 55.71 1bil s PHE 276 Cb -0.13 -4.59 0.03 0.00 -0.57 0.00 0.00 43.02 37.77 1bil s PHE 276 CO 0.02 -1.77 1.88 1.04 -0.10 0.00 0.00 175.22 176.28 1bil n GLN 277 N 8.02 2.86 0.17 0.44 1.13 -1.26 -4.20 117.38 124.54 1bil n GLN 277 Ca 0.34 -2.97 0.02 0.00 -1.94 0.00 0.00 57.00 52.45 1bil n GLN 277 Cb 0.49 -3.45 0.35 0.00 0.11 0.00 0.00 30.24 27.74 1bil n GLN 277 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 1bil h GLU 278 N 7.48 0.06 0.00 -1.09 4.39 -1.96 -3.45 114.58 120.00 1bil h GLU 278 Ca 0.45 -0.02 -0.37 0.00 0.34 0.00 0.00 59.36 59.76 1bil h GLU 278 Cb 0.82 -0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.37 1bil h GLU 278 CO 1.55 0.40 -0.33 -1.13 -1.16 0.00 0.00 179.01 178.34 1bil n SER 279 N -4.12 0.42 -3.55 1.42 3.41 -1.26 -5.23 113.62 104.72 1bil n SER 279 Ca -0.02 -2.54 -0.29 0.00 -0.26 0.00 0.00 58.87 55.76 1bil n SER 279 Cb 0.39 0.93 -0.12 0.00 -0.26 0.00 0.00 64.21 65.15 1bil n SER 279 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1bil s TYR 279 N -2.77 1.20 0.00 7.33 1.51 -1.26 -4.74 117.35 118.61 1bil s TYR 279 Ca 0.21 -1.96 0.00 0.00 -1.01 0.00 0.00 57.07 54.31 1bil s TYR 279 Cb 0.01 -1.26 0.00 0.00 -0.11 0.00 0.00 41.96 40.60 1bil s TYR 279 CO 0.15 -0.81 0.00 -1.13 -1.11 0.00 0.00 175.55 172.65 1bil n SER 279 N 3.77 1.58 -0.36 2.29 3.41 -1.26 -3.84 113.62 119.21 1bil n SER 279 Ca 0.12 -0.16 0.13 0.00 -0.26 0.00 0.00 58.87 58.70 1bil n SER 279 Cb 0.37 0.63 0.34 0.00 -0.26 0.00 0.00 64.21 65.29 1bil n SER 279 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1bil n LYS 279 N -0.79 1.13 -4.33 4.33 5.02 -1.26 -4.86 118.16 117.41 1bil n LYS 279 Ca 0.00 -0.73 -0.22 0.00 -2.02 0.00 0.00 58.31 55.35 1bil n LYS 279 Cb 0.00 -1.48 -0.11 0.00 -0.02 0.00 0.00 35.03 33.41 1bil n LYS 279 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1bil s LYS 280 N -2.37 1.25 -0.02 1.97 1.02 -1.26 -5.03 119.74 115.30 1bil s LYS 280 Ca 0.27 -1.39 -0.16 0.00 0.02 0.00 0.00 55.97 54.70 1bil s LYS 280 Cb 0.19 -1.30 -0.05 0.00 -0.52 0.00 0.00 37.83 36.15 1bil s LYS 280 CO 0.48 0.26 0.45 -0.51 -0.92 0.00 0.00 175.35 175.11 1bil s LEU 281 N -2.64 4.43 0.05 3.17 1.43 -1.26 0.66 118.68 124.52 1bil s LEU 281 Ca 0.15 0.96 0.07 0.00 -1.03 0.00 0.00 54.13 54.28 1bil s LEU 281 Cb -0.06 -2.65 -0.03 0.00 0.03 0.00 0.00 46.19 43.48 1bil s LEU 281 CO 0.06 0.23 -0.18 0.00 0.23 0.00 0.00 176.35 176.69 1bil s THR 283 N -0.96 5.08 -0.06 0.00 2.01 -1.26 -0.92 115.64 119.53 1bil s THR 283 Ca 0.15 0.64 -0.13 0.00 0.31 0.00 0.00 61.69 62.66 1bil s THR 283 Cb -0.11 -3.67 -0.05 0.00 0.01 0.00 0.00 72.50 68.69 1bil s THR 283 CO 0.06 0.46 0.34 -0.76 -0.69 0.00 0.00 174.62 174.03 1bil s LEU 284 N -1.43 4.40 -0.64 4.42 1.43 -0.53 -0.63 118.68 125.70 1bil s LEU 284 Ca 0.27 0.77 -0.03 0.00 -1.03 0.00 0.00 54.13 54.11 1bil s LEU 284 Cb -0.15 -2.46 0.17 0.00 0.03 0.00 0.00 46.19 43.78 1bil s LEU 284 CO 0.15 0.27 2.48 0.00 0.23 0.00 0.00 176.35 179.48 1bil n ALA 285 N 2.32 6.49 -3.10 4.21 0.00 -0.51 -4.69 120.51 125.23 1bil n ALA 285 Ca -0.14 -3.51 -0.20 0.00 0.00 0.00 0.00 53.44 49.60 1bil n ALA 285 Cb 0.53 -2.12 -0.15 0.00 0.00 0.00 0.00 19.45 17.70 1bil n ALA 285 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1bil s ILE 286 N -3.25 0.70 0.05 0.00 1.01 -1.26 -2.41 121.20 116.03 1bil s ILE 286 Ca 0.56 -0.30 -0.03 0.00 0.00 0.00 0.00 60.65 60.88 1bil s ILE 286 Cb 0.39 -0.63 -0.03 0.00 0.01 0.00 0.00 42.46 42.20 1bil s ILE 286 CO -0.29 0.23 0.02 -1.00 0.00 0.00 0.00 174.94 173.90 1bil s HIS 287 N 0.28 0.40 0.15 3.97 3.76 -0.43 -4.73 115.29 118.69 1bil s HIS 287 Ca -0.04 -0.88 -0.21 0.00 -0.15 0.00 0.00 55.06 53.79 1bil s HIS 287 Cb -0.09 -0.29 -0.08 0.00 1.11 0.00 0.00 32.58 33.24 1bil s HIS 287 CO 0.00 -0.38 0.67 0.00 -0.85 0.00 0.00 174.74 174.18 1bil s ALA 288 N -3.51 3.50 -0.10 -1.40 0.00 -1.26 -2.69 121.76 116.29 1bil s ALA 288 Ca 0.03 0.15 -0.05 0.00 0.00 0.00 0.00 51.96 52.09 1bil s ALA 288 Cb 0.05 -2.77 0.05 0.00 0.00 0.00 0.00 23.12 20.45 1bil s ALA 288 CO -0.09 0.35 0.23 -1.64 0.00 0.00 0.00 175.76 174.62 1bil s MET 289 N -1.48 0.17 -0.43 0.00 -1.94 0.01 -4.87 119.30 110.77 1bil s MET 289 Ca 0.36 0.53 -0.11 0.00 -1.71 0.00 0.00 55.69 54.76 1bil s MET 289 Cb -0.19 -0.13 0.08 0.00 2.01 0.00 0.00 34.83 36.60 1bil s MET 289 CO 0.22 -0.18 0.30 -0.51 -0.01 0.00 0.00 175.02 174.83 1bil s ASP 290 N 1.42 5.78 -0.11 3.03 1.01 -1.26 -3.85 116.67 122.69 1bil s ASP 290 Ca -0.08 -1.46 -0.25 0.00 0.71 0.00 0.00 52.55 51.48 1bil s ASP 290 Cb -0.11 -2.04 -0.03 0.00 1.01 0.00 0.00 42.92 41.75 1bil s ASP 290 CO -0.08 -0.57 0.78 -0.63 0.21 0.00 0.00 175.17 174.88 1bil s ILE 291 N 1.48 4.96 0.37 0.77 -1.09 -1.26 -5.07 121.20 121.36 1bil s ILE 291 Ca 0.03 1.57 -0.22 0.00 -2.23 0.00 0.00 60.65 59.80 1bil s ILE 291 Cb -0.23 -4.10 -0.10 0.00 -1.58 0.00 0.00 42.46 36.44 1bil s ILE 291 CO 0.03 0.14 0.92 -2.16 -1.23 0.00 0.00 174.94 172.64 1bil s PRO 292 N 1.46 4.35 0.98 2.79 0.04 -1.26 -3.41 135.00 139.95 1bil s PRO 292 Ca 0.39 1.15 -0.12 0.00 0.04 0.00 0.00 61.00 62.46 1bil s PRO 292 Cb -0.17 -2.49 0.14 0.00 0.04 0.00 0.00 34.50 32.02 1bil s PRO 292 CO 0.16 0.13 0.89 -0.35 0.04 0.00 0.00 177.00 177.87 1bil n PRO 293 N -0.06 -0.80 0.19 0.56 -0.05 -1.19 -2.15 135.00 131.50 1bil n PRO 293 Ca 0.04 -0.18 0.04 0.00 -0.05 0.00 0.00 63.50 63.35 1bil n PRO 293 Cb 0.52 -2.18 0.37 0.00 -0.05 0.00 0.00 33.50 32.15 1bil n PRO 293 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 175.50 174.45 1bil h PRO 294 N -1.96 0.00 0.53 0.54 0.13 -2.05 -3.44 132.00 125.76 1bil h PRO 294 Ca -0.47 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.65 1bil h PRO 294 Cb 1.29 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.40 1bil h PRO 294 CO 0.40 0.38 -0.44 1.15 -0.23 0.00 0.00 178.00 179.27 1bil h THR 295 N 0.00 0.12 -4.02 1.56 2.02 -1.85 -3.45 112.91 107.29 1bil h THR 295 Ca -0.00 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 1bil h THR 295 Cb 0.75 0.12 0.01 0.00 -1.74 0.00 0.00 68.15 67.28 1bil h THR 295 CO 0.05 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.55 1bil n GLY 296 N -1.54 1.48 3.69 2.16 0.00 -0.91 -4.57 105.19 105.49 1bil n GLY 296 Ca -0.12 -2.07 -0.44 0.00 0.00 0.00 0.00 46.02 43.38 1bil n GLY 296 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1bil n PRO 297 N -1.19 2.45 -3.72 1.61 -0.02 -1.22 -3.18 135.00 129.73 1bil n PRO 297 Ca 0.02 0.89 -0.12 0.00 -2.02 0.00 0.00 63.50 62.27 1bil n PRO 297 Cb 0.07 -2.70 -0.07 0.00 -0.02 0.00 0.00 33.50 30.78 1bil n PRO 297 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1bil s THR 298 N 1.35 0.07 0.31 3.45 -1.32 -1.26 -4.64 115.64 113.59 1bil s THR 298 Ca 0.78 -0.59 -0.14 0.00 -1.21 0.00 0.00 61.69 60.54 1bil s THR 298 Cb -0.60 -0.92 -0.09 0.00 -1.51 0.00 0.00 72.50 69.39 1bil s THR 298 CO 0.36 -0.32 0.71 0.26 -2.21 0.00 0.00 174.62 173.42 1bil s TRP 299 N -2.44 3.38 -0.19 9.09 0.52 -0.15 -4.38 118.94 124.76 1bil s TRP 299 Ca -0.06 1.15 0.01 0.00 0.02 0.00 0.00 56.10 57.23 1bil s TRP 299 Cb -0.01 -2.49 0.03 0.00 -1.15 0.00 0.00 33.47 29.86 1bil s TRP 299 CO -0.02 0.11 -0.14 0.00 0.02 0.00 0.00 176.95 176.91 1bil s ALA 300 N -1.98 2.17 -0.53 0.98 0.00 -0.72 0.19 121.76 121.88 1bil s ALA 300 Ca 0.53 -1.24 -0.19 0.00 0.00 0.00 0.00 51.96 51.06 1bil s ALA 300 Cb -0.10 -1.25 0.07 0.00 0.00 0.00 0.00 23.12 21.83 1bil s ALA 300 CO 0.19 -0.64 0.65 -0.51 0.00 0.00 0.00 175.76 175.45 1bil s LEU 301 N 1.33 5.01 0.00 0.00 1.43 0.29 -2.01 118.68 124.74 1bil s LEU 301 Ca 0.01 -1.00 0.00 0.00 -1.03 0.00 0.00 54.13 52.11 1bil s LEU 301 Cb -0.15 -2.43 0.00 0.00 0.03 0.00 0.00 46.19 43.64 1bil s LEU 301 CO -0.10 -0.95 0.00 0.61 0.23 0.00 0.00 176.35 176.14 1bil n GLY 302 N 5.19 1.57 0.45 -3.19 0.00 -1.25 -0.19 105.19 107.79 1bil n GLY 302 Ca -0.07 -2.01 0.26 0.00 0.00 0.00 0.00 46.02 44.21 1bil n GLY 302 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bil h ALA 303 N -0.80 2.59 -1.00 4.61 0.00 -0.64 -2.11 119.26 121.92 1bil h ALA 303 Ca 0.00 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.00 1bil h ALA 303 Cb 0.00 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.76 1bil h ALA 303 CO 0.00 -1.07 0.63 1.15 0.00 0.00 0.00 179.25 179.96 1bil h THR 304 N 0.00 0.94 0.11 0.00 2.02 -1.82 0.79 112.91 114.94 1bil h THR 304 Ca 0.36 -0.35 -0.25 0.00 0.77 0.00 0.00 66.41 66.94 1bil h THR 304 Cb 1.71 -0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 67.95 1bil h THR 304 CO -0.00 0.18 -1.28 0.15 0.37 0.00 0.00 175.52 174.95 1bil h PHE 305 N 1.01 0.41 0.00 3.16 3.57 -1.74 -3.34 116.94 120.01 1bil h PHE 305 Ca 0.49 -0.30 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 1bil h PHE 305 Cb 0.45 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.17 1bil h PHE 305 CO -0.00 1.50 -0.09 0.82 -2.23 0.00 0.00 178.31 178.31 1bil h ILE 306 N -0.38 0.35 -0.40 1.41 2.04 -1.30 0.22 117.51 119.45 1bil h ILE 306 Ca -0.27 -0.51 -0.08 0.00 1.00 0.00 0.00 64.86 65.00 1bil h ILE 306 Cb 1.69 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 39.12 1bil h ILE 306 CO 0.05 0.08 -0.06 0.03 0.00 0.00 0.00 178.15 178.25 1bil h ARG 307 N 0.00 0.68 0.22 2.37 3.08 -0.96 -3.20 114.38 116.58 1bil h ARG 307 Ca -0.00 -0.19 -0.34 0.00 0.07 0.00 0.00 59.98 59.52 1bil h ARG 307 Cb 0.36 -0.07 0.03 0.00 0.08 0.00 0.00 29.97 30.37 1bil h ARG 307 CO 0.01 0.74 -1.53 -0.22 -1.07 0.00 0.00 179.97 177.90 1bil h LYS 308 N 0.63 0.47 -4.58 0.04 3.11 -1.46 -3.45 116.57 111.33 1bil h LYS 308 Ca 0.12 -0.81 -0.64 0.00 -2.81 0.00 0.00 60.65 56.51 1bil h LYS 308 Cb 0.49 0.30 -0.38 0.00 -1.00 0.00 0.00 32.23 31.64 1bil h LYS 308 CO 0.03 1.38 -0.78 -0.06 -2.81 0.00 0.00 179.45 177.21 1bil s PHE 309 N -2.60 2.98 0.04 1.91 0.08 -0.02 -2.16 117.98 118.21 1bil s PHE 309 Ca -0.10 -2.24 -0.35 0.00 0.12 0.00 0.00 56.93 54.36 1bil s PHE 309 Cb 0.05 -2.00 -0.14 0.00 -0.57 0.00 0.00 43.02 40.36 1bil s PHE 309 CO 0.92 -0.86 1.62 0.98 -0.10 0.00 0.00 175.22 177.78 1bil n TYR 310 N 4.50 2.10 -4.69 0.36 4.19 0.47 -4.36 117.16 119.73 1bil n TYR 310 Ca -0.09 0.31 -0.33 0.00 3.31 0.00 0.00 57.90 61.09 1bil n TYR 310 Cb 0.43 -2.52 -0.12 0.00 0.49 0.00 0.00 39.34 37.61 1bil n TYR 310 CO 0.00 0.00 0.00 0.99 0.91 0.00 0.00 176.86 178.76 1bil s THR 311 N 1.87 3.44 -0.13 2.97 2.01 -0.71 -1.82 115.64 123.27 1bil s THR 311 Ca 0.85 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 62.30 1bil s THR 311 Cb -0.78 -2.41 0.02 0.00 0.01 0.00 0.00 72.50 69.33 1bil s THR 311 CO 0.46 0.57 -0.13 -0.70 -0.69 0.00 0.00 174.62 174.12 1bil s GLU 312 N -0.42 2.16 -0.40 4.92 2.12 -0.77 -0.86 118.70 125.46 1bil s GLU 312 Ca 0.06 -0.51 -0.12 0.00 0.36 0.00 0.00 54.97 54.75 1bil s GLU 312 Cb -0.12 -1.96 0.04 0.00 0.26 0.00 0.00 34.13 32.34 1bil s GLU 312 CO 0.02 -0.19 0.26 -0.06 -0.54 0.00 0.00 175.26 174.75 1bil s PHE 313 N 1.37 3.25 -0.56 5.30 0.08 0.44 0.69 117.98 128.55 1bil s PHE 313 Ca 0.02 -0.93 -0.16 0.00 0.12 0.00 0.00 56.93 55.97 1bil s PHE 313 Cb -0.13 -2.61 0.14 0.00 -0.57 0.00 0.00 43.02 39.84 1bil s PHE 313 CO -0.08 -0.67 0.53 0.34 -0.10 0.00 0.00 175.22 175.24 1bil s ASP 314 N 1.76 6.23 0.28 1.36 -1.08 -0.40 -2.00 116.67 122.82 1bil s ASP 314 Ca 0.03 -1.84 0.05 0.00 -0.52 0.00 0.00 52.55 50.27 1bil s ASP 314 Cb -0.20 -2.21 0.39 0.00 -1.46 0.00 0.00 42.92 39.44 1bil s ASP 314 CO 0.07 -0.85 1.67 0.03 0.52 0.00 0.00 175.17 176.61 1bil h ARG 315 N 8.82 0.29 -0.38 4.34 2.47 -1.41 0.56 114.38 129.07 1bil h ARG 315 Ca -0.27 -0.15 0.06 0.00 -1.26 0.00 0.00 59.98 58.36 1bil h ARG 315 Cb 1.10 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 29.36 1bil h ARG 315 CO 1.02 0.67 0.06 -0.09 0.56 0.00 0.00 179.97 182.20 1bil h ARG 316 N 0.24 0.18 -0.29 0.04 9.65 -1.90 -3.08 114.38 119.21 1bil h ARG 316 Ca 0.02 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 1bil h ARG 316 Cb 0.86 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.40 1bil h ARG 316 CO 0.07 0.12 0.00 0.09 2.80 0.00 0.00 179.97 183.05 1bil n ASN 317 N -5.11 2.84 -3.71 -3.80 3.02 -1.21 -4.99 115.26 102.29 1bil n ASN 317 Ca 0.02 -1.86 -0.27 0.00 -0.03 0.00 0.00 54.58 52.45 1bil n ASN 317 Cb 0.18 -0.19 0.01 0.00 -0.61 0.00 0.00 39.78 39.17 1bil n ASN 317 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1bil n ASN 318 N 0.81 -5.27 -3.78 6.41 3.02 0.15 -4.83 115.26 111.77 1bil n ASN 318 Ca 0.13 -0.91 -0.11 0.00 -0.03 0.00 0.00 54.58 53.66 1bil n ASN 318 Cb 0.44 -2.58 -0.08 0.00 -0.61 0.00 0.00 39.78 36.95 1bil n ASN 318 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1bil s ARG 319 N -5.34 0.77 -0.15 3.52 1.70 -0.99 -1.97 118.95 116.49 1bil s ARG 319 Ca 0.19 -0.53 -0.02 0.00 -0.47 0.00 0.00 55.73 54.90 1bil s ARG 319 Cb -0.09 0.33 -0.02 0.00 -0.57 0.00 0.00 34.95 34.60 1bil s ARG 319 CO 0.88 -0.24 -0.07 0.42 -1.08 0.00 0.00 175.30 175.21 1bil s ILE 320 N -2.52 3.51 0.27 4.99 1.01 -0.96 -1.27 121.20 126.22 1bil s ILE 320 Ca -0.05 -0.49 0.07 0.00 0.00 0.00 0.00 60.65 60.18 1bil s ILE 320 Cb -0.01 -2.53 -0.03 0.00 0.01 0.00 0.00 42.46 39.90 1bil s ILE 320 CO -0.03 0.50 0.20 -0.83 0.00 0.00 0.00 174.94 174.77 1bil s GLY 321 N 0.50 1.48 -0.01 6.18 0.00 0.22 -2.20 107.32 113.48 1bil s GLY 321 Ca -0.06 -1.47 0.02 0.00 0.00 0.00 0.00 44.72 43.21 1bil s GLY 321 CO 0.03 -1.49 -0.06 -1.36 0.00 0.00 0.00 173.10 170.22 1bil s PHE 322 N -2.17 0.61 0.06 1.90 0.08 -0.38 -1.84 117.98 116.23 1bil s PHE 322 Ca 0.34 -0.12 -0.02 0.00 0.12 0.00 0.00 56.93 57.24 1bil s PHE 322 Cb -0.07 -0.42 -0.03 0.00 -0.57 0.00 0.00 43.02 41.92 1bil s PHE 322 CO 0.25 -0.04 0.01 0.00 -0.10 0.00 0.00 175.22 175.34 1bil s ALA 323 N 0.03 0.36 0.02 5.36 0.00 -0.75 -2.39 121.76 124.39 1bil s ALA 323 Ca 0.00 -1.07 -0.30 0.00 0.00 0.00 0.00 51.96 50.58 1bil s ALA 323 Cb -0.05 0.30 -0.05 0.00 0.00 0.00 0.00 23.12 23.32 1bil s ALA 323 CO -0.00 -0.39 1.33 -1.17 0.00 0.00 0.00 175.76 175.53 1bil s LEU 324 N -2.85 4.33 0.70 0.00 2.96 -1.25 -0.40 118.68 122.17 1bil s LEU 324 Ca 0.06 2.08 -0.11 0.00 -0.22 0.00 0.00 54.13 55.93 1bil s LEU 324 Cb 0.07 -3.57 0.01 0.00 0.50 0.00 0.00 46.19 43.20 1bil s LEU 324 CO -0.10 -0.64 1.07 0.00 -1.32 0.00 0.00 176.35 175.36 1bil s ALA 325 N 1.95 2.73 0.00 5.97 0.00 -0.92 -0.75 121.76 130.74 1bil s ALA 325 Ca 0.62 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1bil s ALA 325 Cb -0.31 -3.11 0.00 0.00 0.00 0.00 0.00 23.12 19.70 1bil s ALA 325 CO 0.27 -1.19 0.00 2.89 0.00 0.00 0.00 175.76 177.73