#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 0.08 -4.77 1.61 5.15 0.41 -3.61 115.26 114.12 1bil n ASN -1 Ca 0.00 -0.39 -0.32 0.00 -0.60 0.00 0.00 54.58 53.27 1bil n ASN -1 Cb 0.00 0.50 0.06 0.00 -0.53 0.00 0.00 39.78 39.82 1bil n ASN -1 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1bil s THR 0 N -0.50 3.33 -0.05 -0.44 -4.23 0.29 -4.41 115.64 109.63 1bil s THR 0 Ca 0.00 0.53 -0.03 0.00 -1.18 0.00 0.00 61.69 61.01 1bil s THR 0 Cb 0.00 -3.05 0.02 0.00 1.34 0.00 0.00 72.50 70.81 1bil s THR 0 CO 0.00 -0.46 0.12 -0.89 -0.54 0.00 0.00 174.62 172.84 1bil s THR 1 N -2.60 -0.01 0.02 3.99 2.01 -1.26 0.17 115.64 117.96 1bil s THR 1 Ca 0.64 0.05 -0.09 0.00 0.31 0.00 0.00 61.69 62.60 1bil s THR 1 Cb -0.19 -0.18 0.00 0.00 0.01 0.00 0.00 72.50 72.15 1bil s THR 1 CO 0.48 0.02 0.18 -0.94 -0.69 0.00 0.00 174.62 173.67 1bil s SER 2 N 0.34 0.02 0.12 3.53 1.04 -0.36 -4.96 113.70 113.42 1bil s SER 2 Ca -0.02 -0.28 0.04 0.00 0.48 0.00 0.00 55.95 56.17 1bil s SER 2 Cb -0.04 0.26 -0.04 0.00 0.10 0.00 0.00 66.02 66.31 1bil s SER 2 CO -0.01 -0.48 -0.10 -0.94 0.98 0.00 0.00 173.24 172.68 1bil s SER 3 N -1.78 1.61 -0.11 7.02 1.04 -1.26 0.11 113.70 120.33 1bil s SER 3 Ca -0.09 -0.90 0.03 0.00 0.48 0.00 0.00 55.95 55.47 1bil s SER 3 Cb -0.04 -0.00 -0.00 0.00 0.10 0.00 0.00 66.02 66.08 1bil s SER 3 CO -0.01 -0.29 -0.21 -0.69 0.98 0.00 0.00 173.24 173.02 1bil s VAL 4 N -2.80 2.31 -0.03 5.02 1.01 0.17 -4.50 120.40 121.58 1bil s VAL 4 Ca 0.10 -0.93 -0.17 0.00 0.00 0.00 0.00 61.98 60.99 1bil s VAL 4 Cb -0.01 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.41 1bil s VAL 4 CO 0.00 0.55 0.46 -0.63 0.00 0.00 0.00 175.10 175.48 1bil s ILE 5 N 0.35 5.04 0.17 2.22 -1.09 -1.26 -1.25 121.20 125.38 1bil s ILE 5 Ca -0.17 0.94 0.06 0.00 -2.23 0.00 0.00 60.65 59.24 1bil s ILE 5 Cb -0.17 -3.78 -0.04 0.00 -1.58 0.00 0.00 42.46 36.89 1bil s ILE 5 CO 0.08 0.48 0.11 -0.76 -1.23 0.00 0.00 174.94 173.62 1bil s LEU 6 N -0.46 3.70 -0.11 2.97 1.43 -0.71 -4.48 118.68 121.01 1bil s LEU 6 Ca 0.25 -0.19 -0.05 0.00 -1.03 0.00 0.00 54.13 53.11 1bil s LEU 6 Cb -0.17 -2.31 -0.04 0.00 0.03 0.00 0.00 46.19 43.70 1bil s LEU 6 CO 0.13 0.07 0.08 -0.89 0.23 0.00 0.00 176.35 175.97 1bil s THR 7 N -1.75 4.99 -0.31 5.49 2.01 0.14 -3.17 115.64 123.03 1bil s THR 7 Ca 0.30 0.01 -0.09 0.00 0.31 0.00 0.00 61.69 62.23 1bil s THR 7 Cb -0.10 -3.15 0.00 0.00 0.01 0.00 0.00 72.50 69.27 1bil s THR 7 CO 0.22 0.61 0.13 0.21 -0.69 0.00 0.00 174.62 175.10 1bil s ASN 8 N -0.91 5.41 -0.46 3.53 3.04 -1.26 -1.91 114.94 122.38 1bil s ASN 8 Ca 0.14 -0.63 -0.14 0.00 0.04 0.00 0.00 52.86 52.26 1bil s ASN 8 Cb -0.12 -1.96 0.07 0.00 -1.54 0.00 0.00 41.25 37.70 1bil s ASN 8 CO 0.03 -0.21 0.36 -0.47 -3.04 0.00 0.00 177.10 173.77 1bil s TYR 9 N 1.57 3.26 -1.06 0.43 5.04 0.48 -4.66 117.35 122.40 1bil s TYR 9 Ca 0.04 -1.02 -0.05 0.00 -2.44 0.00 0.00 57.07 53.60 1bil s TYR 9 Cb -0.17 -3.08 0.04 0.00 0.35 0.00 0.00 41.96 39.10 1bil s TYR 9 CO 0.05 -0.79 0.27 -1.33 -1.34 0.00 0.00 175.55 172.41 1bil n MET 10 N 5.14 -2.89 -0.76 4.97 2.81 -1.26 -1.52 117.12 123.61 1bil n MET 10 Ca -0.12 0.45 0.00 0.00 -1.81 0.00 0.00 57.70 56.22 1bil n MET 10 Cb 0.44 -5.09 0.00 0.00 -0.71 0.00 0.00 33.22 27.85 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 -2.03 -0.66 -0.01 7.83 9.92 -1.26 -4.73 116.55 125.61 1bil n ASP 11 Ca -0.05 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.20 1bil n ASP 11 Cb 0.56 -1.52 -0.02 0.00 -0.64 0.00 0.00 41.12 39.50 1bil n ASP 11 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 1bil n THR 12 N -2.06 0.13 -4.80 -3.53 -2.24 -0.58 -4.90 114.28 96.30 1bil n THR 12 Ca 0.00 -0.08 -0.31 0.00 -2.27 0.00 0.00 64.05 61.38 1bil n THR 12 Cb 0.04 -0.83 -0.17 0.00 -2.10 0.00 0.00 70.33 67.28 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 -2.06 2.84 -0.24 -0.78 -0.21 -1.00 -4.42 119.66 113.80 1bil s GLN 13 Ca -0.01 -0.80 0.01 0.00 0.02 0.00 0.00 55.36 54.59 1bil s GLN 13 Cb 0.01 -2.26 0.06 0.00 1.00 0.00 0.00 33.01 31.82 1bil s GLN 13 CO 0.08 0.04 -0.07 0.71 -2.12 0.00 0.00 175.29 173.93 1bil s TYR 14 N 0.69 2.60 0.08 0.91 2.02 -1.26 -0.39 117.35 122.00 1bil s TYR 14 Ca -0.11 -1.86 0.05 0.00 -0.37 0.00 0.00 57.07 54.78 1bil s TYR 14 Cb -0.16 -1.67 -0.03 0.00 -0.40 0.00 0.00 41.96 39.70 1bil s TYR 14 CO 0.02 -0.79 -0.14 1.52 -1.57 0.00 0.00 175.55 174.58 1bil s TYR 15 N 1.33 1.27 0.44 2.71 1.13 -0.80 -4.37 117.35 119.05 1bil s TYR 15 Ca -0.06 -0.49 0.01 0.00 -1.41 0.00 0.00 57.07 55.12 1bil s TYR 15 Cb -0.19 -0.70 -0.00 0.00 -1.10 0.00 0.00 41.96 39.97 1bil s TYR 15 CO -0.06 0.08 0.04 0.41 -2.51 0.00 0.00 175.55 173.51 1bil n GLY 16 N 1.07 3.52 3.59 5.49 0.00 0.12 0.26 105.19 119.25 1bil n GLY 16 Ca -0.20 -2.29 -0.27 0.00 0.00 0.00 0.00 46.02 43.26 1bil n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bil s GLU 17 N -3.62 2.14 0.11 1.61 2.02 -1.26 -1.11 118.70 118.59 1bil s GLU 17 Ca 0.06 -1.18 0.02 0.00 0.02 0.00 0.00 54.97 53.89 1bil s GLU 17 Cb 0.00 -2.23 -0.04 0.00 0.10 0.00 0.00 34.13 31.96 1bil s GLU 17 CO 0.04 0.46 -0.06 0.96 0.02 0.00 0.00 175.26 176.68 1bil s ILE 18 N -1.58 0.69 -0.07 -1.63 -4.36 -0.54 -4.72 121.20 108.99 1bil s ILE 18 Ca 0.24 -1.94 0.05 0.00 -0.26 0.00 0.00 60.65 58.74 1bil s ILE 18 Cb -0.09 -1.74 -0.01 0.00 1.25 0.00 0.00 42.46 41.86 1bil s ILE 18 CO 0.15 -0.82 -0.21 -0.83 0.24 0.00 0.00 174.94 173.47 1bil s GLY 19 N -3.06 1.38 -0.05 6.27 0.00 -0.88 -1.23 107.32 109.75 1bil s GLY 19 Ca 0.13 -1.01 0.06 0.00 0.00 0.00 0.00 44.72 43.90 1bil s GLY 19 CO -0.04 -0.61 -0.22 -0.42 0.00 0.00 0.00 173.10 171.82 1bil s ILE 20 N -0.20 1.81 0.00 0.90 1.01 0.15 -0.48 121.20 124.39 1bil s ILE 20 Ca -0.02 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 59.69 1bil s ILE 20 Cb -0.13 -1.53 0.00 0.00 0.01 0.00 0.00 42.46 40.80 1bil s ILE 20 CO 0.03 0.51 0.00 0.61 0.00 0.00 0.00 174.94 176.09 1bil n GLY 21 N 2.94 -0.25 2.69 6.18 0.00 -0.18 0.39 105.19 116.96 1bil n GLY 21 Ca -0.17 -1.86 -0.27 0.00 0.00 0.00 0.00 46.02 43.72 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 -1.16 0.27 0.84 2.61 2.01 -1.26 -2.67 115.64 116.28 1bil s THR 22 Ca 0.00 -0.35 -0.11 0.00 0.31 0.00 0.00 61.69 61.54 1bil s THR 22 Cb 0.00 -0.81 0.10 0.00 0.01 0.00 0.00 72.50 71.80 1bil s THR 22 CO 0.00 -0.20 1.10 -2.16 -0.69 0.00 0.00 174.62 172.67 1bil s PRO 23 N 1.98 1.67 0.39 4.92 0.04 -1.26 -1.94 135.00 140.81 1bil s PRO 23 Ca 0.01 1.11 -0.27 0.00 0.04 0.00 0.00 61.00 61.89 1bil s PRO 23 Cb -0.16 -1.83 -0.09 0.00 0.04 0.00 0.00 34.50 32.45 1bil s PRO 23 CO -0.08 -2.04 1.37 -2.14 0.04 0.00 0.00 177.00 174.16 1bil s PRO 24 N -4.86 4.01 -0.22 0.56 0.02 -1.09 -4.91 135.00 128.51 1bil s PRO 24 Ca 0.63 2.33 -0.05 0.00 0.02 0.00 0.00 61.00 63.92 1bil s PRO 24 Cb -0.18 -2.84 -0.02 0.00 0.02 0.00 0.00 34.50 31.47 1bil s PRO 24 CO 0.57 -0.52 0.01 -0.65 -0.33 0.00 0.00 177.00 176.08 1bil s GLN 25 N -2.17 3.57 0.08 5.54 -0.21 0.16 -4.84 119.66 121.80 1bil s GLN 25 Ca 0.55 -0.53 -0.17 0.00 0.02 0.00 0.00 55.36 55.22 1bil s GLN 25 Cb -0.42 -3.13 -0.07 0.00 1.00 0.00 0.00 33.01 30.40 1bil s GLN 25 CO 0.55 -0.09 0.54 0.99 -2.12 0.00 0.00 175.29 175.16 1bil s THR 26 N 1.28 4.81 0.02 -0.19 2.01 -1.26 0.31 115.64 122.62 1bil s THR 26 Ca 0.04 1.07 0.01 0.00 0.31 0.00 0.00 61.69 63.12 1bil s THR 26 Cb -0.15 -3.83 -0.02 0.00 0.01 0.00 0.00 72.50 68.52 1bil s THR 26 CO 0.01 0.48 -0.05 -0.36 -0.69 0.00 0.00 174.62 174.01 1bil s PHE 27 N -1.19 0.46 -0.15 4.92 0.08 -0.37 -4.98 117.98 116.74 1bil s PHE 27 Ca 0.30 -0.34 -0.19 0.00 0.12 0.00 0.00 56.93 56.82 1bil s PHE 27 Cb -0.18 -0.29 -0.04 0.00 -0.57 0.00 0.00 43.02 41.95 1bil s PHE 27 CO 0.18 -0.08 0.53 0.15 -0.10 0.00 0.00 175.22 175.91 1bil s LYS 28 N -1.00 4.28 0.03 0.44 1.02 -1.26 -1.47 119.74 121.78 1bil s LYS 28 Ca -0.07 0.50 -0.02 0.00 0.02 0.00 0.00 55.97 56.40 1bil s LYS 28 Cb -0.07 -3.50 -0.03 0.00 -0.52 0.00 0.00 37.83 33.71 1bil s LYS 28 CO -0.00 -0.02 -0.00 0.14 -0.92 0.00 0.00 175.35 174.55 1bil s VAL 29 N 1.19 0.16 -0.12 3.17 -7.23 -0.27 -1.07 120.40 116.22 1bil s VAL 29 Ca 0.27 -1.28 -0.07 0.00 -1.81 0.00 0.00 61.98 59.08 1bil s VAL 29 Cb -0.16 -0.87 -0.04 0.00 0.56 0.00 0.00 36.38 35.88 1bil s VAL 29 CO 0.11 -0.71 0.12 -0.69 -0.31 0.00 0.00 175.10 173.62 1bil s VAL 30 N -2.62 5.36 -0.43 1.32 1.01 -0.86 -0.70 120.40 123.48 1bil s VAL 30 Ca -0.05 0.15 -0.15 0.00 0.00 0.00 0.00 61.98 61.93 1bil s VAL 30 Cb -0.01 -3.34 0.04 0.00 0.00 0.00 0.00 36.38 33.06 1bil s VAL 30 CO -0.05 0.60 0.34 -0.36 0.00 0.00 0.00 175.10 175.63 1bil s PHE 31 N -0.86 3.24 -0.25 5.22 0.40 -1.26 -0.59 117.98 123.87 1bil s PHE 31 Ca 0.14 -0.69 -0.03 0.00 -0.60 0.00 0.00 56.93 55.75 1bil s PHE 31 Cb -0.12 -2.79 0.02 0.00 0.51 0.00 0.00 43.02 40.64 1bil s PHE 31 CO 0.03 -0.66 -0.03 0.34 0.70 0.00 0.00 175.22 175.60 1bil s ASP 32 N 1.98 4.46 0.00 1.36 2.15 0.61 -4.25 116.67 122.98 1bil s ASP 32 Ca 0.05 -0.78 0.28 0.00 0.43 0.00 0.00 52.55 52.53 1bil s ASP 32 Cb -0.21 -1.71 1.36 0.00 -0.30 0.00 0.00 42.92 42.06 1bil s ASP 32 CO 0.09 -0.13 1.95 0.35 -0.17 0.00 0.00 175.17 177.26 1bil n THR 33 N 4.72 0.09 1.34 1.71 -2.24 -1.26 -0.06 114.28 118.58 1bil n THR 33 Ca -0.16 0.02 0.12 0.00 -2.27 0.00 0.00 64.05 61.76 1bil n THR 33 Cb 0.48 -0.56 0.44 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 1.17 0.20 3.35 3.38 0.00 -1.26 -4.18 105.19 107.84 1bil n GLY 34 Ca 0.12 -0.45 -0.10 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.81 0.04 0.00 1.61 1.04 -1.17 -4.98 113.70 108.42 1bil s SER 35 Ca 0.35 -0.88 0.00 0.00 0.48 0.00 0.00 55.95 55.90 1bil s SER 35 Cb 0.20 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.76 1bil s SER 35 CO 0.30 -0.90 0.69 -1.20 0.98 0.00 0.00 173.24 173.11 1bil n SER 36 N -0.22 0.99 -4.95 7.02 7.64 -1.26 -0.69 113.62 122.14 1bil n SER 36 Ca -0.07 -1.45 -0.24 0.00 1.01 0.00 0.00 58.87 58.12 1bil n SER 36 Cb 0.63 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.80 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 -0.45 6.32 -0.10 6.43 -0.87 -1.26 -4.49 114.94 120.52 1bil s ASN 37 Ca 0.00 0.12 -0.02 0.00 -1.57 0.00 0.00 52.86 51.39 1bil s ASN 37 Cb 0.00 -1.88 -0.03 0.00 -0.02 0.00 0.00 41.25 39.32 1bil s ASN 37 CO 0.00 -0.00 -0.03 -0.69 -2.57 0.00 0.00 177.10 173.81 1bil s VAL 38 N -1.85 4.04 0.03 1.60 1.01 -1.26 -0.88 120.40 123.10 1bil s VAL 38 Ca 0.34 -0.33 -0.11 0.00 0.00 0.00 0.00 61.98 61.88 1bil s VAL 38 Cb -0.10 -2.71 0.01 0.00 0.00 0.00 0.00 36.38 33.58 1bil s VAL 38 CO 0.29 0.57 0.24 -1.66 0.00 0.00 0.00 175.10 174.53 1bil s TRP 39 N -0.45 -0.03 0.14 5.22 1.48 -0.61 -1.17 118.94 123.52 1bil s TRP 39 Ca 0.07 -0.11 -0.01 0.00 -1.06 0.00 0.00 56.10 54.99 1bil s TRP 39 Cb -0.12 0.03 -0.04 0.00 -1.16 0.00 0.00 33.47 32.18 1bil s TRP 39 CO 0.02 -0.43 0.08 0.14 -4.06 0.00 0.00 176.95 172.70 1bil s VAL 40 N -2.27 0.08 0.40 -0.66 -7.23 -0.81 -2.88 120.40 107.03 1bil s VAL 40 Ca -0.07 -1.91 -0.25 0.00 -1.81 0.00 0.00 61.98 57.95 1bil s VAL 40 Cb -0.02 -2.12 -0.09 0.00 0.56 0.00 0.00 36.38 34.72 1bil s VAL 40 CO -0.02 -0.38 1.10 -2.84 -0.31 0.00 0.00 175.10 172.66 1bil s PRO 41 N -4.06 4.10 0.05 4.82 0.01 -1.26 -0.24 135.00 138.41 1bil s PRO 41 Ca 0.26 1.67 0.00 0.00 0.01 0.00 0.00 61.00 62.94 1bil s PRO 41 Cb 0.07 -2.61 -0.04 0.00 0.01 0.00 0.00 34.50 31.94 1bil s PRO 41 CO 0.03 -0.23 0.18 0.45 0.01 0.00 0.00 177.00 177.44 1bil s SER 42 N -1.36 6.18 0.62 2.53 0.15 -0.41 0.26 113.70 121.67 1bil s SER 42 Ca 0.57 0.23 0.37 0.00 0.70 0.00 0.00 55.95 57.83 1bil s SER 42 Cb -0.26 -1.87 2.05 0.00 -1.71 0.00 0.00 66.02 64.24 1bil s SER 42 CO 0.33 0.19 2.27 0.77 1.20 0.00 0.00 173.24 178.00 1bil h SER 43 N 3.27 0.00 0.00 5.45 4.64 -1.07 0.36 113.55 126.20 1bil h SER 43 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1bil h SER 43 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1bil h SER 43 CO 0.73 0.02 0.00 0.29 -0.87 0.00 0.00 176.83 176.99 1bil n LYS 44 N -3.37 0.97 -2.55 4.77 4.01 -1.26 -4.84 118.16 115.90 1bil n LYS 44 Ca -0.03 0.00 -0.42 0.00 -0.51 0.00 0.00 58.31 57.36 1bil n LYS 44 Cb 0.12 -1.45 -0.03 0.00 -0.51 0.00 0.00 35.03 33.15 1bil n LYS 44 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1bil s SER 46 N 0.61 6.50 0.00 0.00 0.15 -1.24 -4.84 113.70 114.88 1bil s SER 46 Ca 0.53 2.70 0.04 0.00 0.70 0.00 0.00 55.95 59.93 1bil s SER 46 Cb -0.27 -2.59 0.17 0.00 -1.71 0.00 0.00 66.02 61.63 1bil s SER 46 CO 0.31 -0.90 1.08 0.54 1.20 0.00 0.00 173.24 175.47 1bil n ARG 46 N 4.34 0.01 0.28 5.44 5.12 -1.26 -0.12 116.66 130.48 1bil n ARG 46 Ca 0.15 0.39 0.16 0.00 -1.93 0.00 0.00 57.85 56.62 1bil n ARG 46 Cb 0.38 -1.50 0.74 0.00 -1.16 0.00 0.00 32.46 30.92 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 0.00 -8.47 0.55 3.38 -1.97 -3.36 115.31 105.44 1bil h LEU 46 Ca 0.00 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.34 1bil h LEU 46 Cb 0.06 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.67 1bil h LEU 46 CO 0.00 0.06 0.43 -0.31 0.09 0.00 0.00 178.44 178.71 1bil s TYR 47 N -3.83 2.86 0.42 1.13 2.02 0.84 -4.91 117.35 115.88 1bil s TYR 47 Ca -0.01 -0.14 0.16 0.00 -0.37 0.00 0.00 57.07 56.72 1bil s TYR 47 Cb 0.10 -3.93 1.06 0.00 -0.40 0.00 0.00 41.96 38.79 1bil s TYR 47 CO 0.54 -1.26 1.89 1.15 -1.57 0.00 0.00 175.55 176.30 1bil h THR 48 N 5.98 0.75 -0.07 -0.71 2.02 -1.85 0.07 112.91 119.11 1bil h THR 48 Ca -0.26 -0.14 0.02 0.00 0.77 0.00 0.00 66.41 66.79 1bil h THR 48 Cb 1.08 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.78 1bil h THR 48 CO 1.05 0.08 0.10 0.00 0.37 0.00 0.00 175.52 177.12 1bil h ALA 49 N 1.63 1.49 -0.15 6.16 0.00 -1.88 0.13 119.26 126.65 1bil h ALA 49 Ca 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1bil h ALA 49 Cb 0.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1bil h ALA 49 CO -0.14 -0.14 0.00 0.00 0.00 0.00 0.00 179.25 178.97 1bil n VAL 51 N 0.42 0.00 0.00 0.00 0.31 0.44 -4.51 118.33 114.99 1bil n VAL 51 Ca 0.17 -0.33 0.07 0.00 -0.01 0.00 0.00 64.34 64.24 1bil n VAL 51 Cb 0.37 0.29 0.14 0.00 -0.91 0.00 0.00 33.84 33.73 1bil n VAL 51 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1bil n TYR 52 N -1.94 0.39 -4.13 3.52 4.02 -1.04 -5.00 117.16 112.98 1bil n TYR 52 Ca -0.02 -0.36 -0.11 0.00 -0.01 0.00 0.00 57.90 57.40 1bil n TYR 52 Cb 0.40 -0.02 -0.10 0.00 -0.02 0.00 0.00 39.34 39.59 1bil n TYR 52 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 1bil s HIS 53 N -1.02 0.81 0.27 -0.72 3.76 -1.17 -5.08 115.29 112.14 1bil s HIS 53 Ca 0.24 -0.78 -0.30 0.00 -0.15 0.00 0.00 55.06 54.07 1bil s HIS 53 Cb 0.13 -0.48 -0.10 0.00 1.11 0.00 0.00 32.58 33.24 1bil s HIS 53 CO 0.18 -0.13 1.45 0.15 -0.85 0.00 0.00 174.74 175.53 1bil s LYS 54 N -3.09 4.25 -0.01 1.40 1.02 -1.26 -4.90 119.74 117.14 1bil s LYS 54 Ca 0.04 2.34 0.01 0.00 0.02 0.00 0.00 55.97 58.39 1bil s LYS 54 Cb 0.00 -3.08 -0.04 0.00 -0.52 0.00 0.00 37.83 34.19 1bil s LYS 54 CO -0.03 -0.42 0.02 -0.51 -0.92 0.00 0.00 175.35 173.49 1bil s LEU 55 N -0.70 3.62 -0.15 3.17 1.43 -1.26 -4.37 118.68 120.42 1bil s LEU 55 Ca 0.58 0.05 -0.22 0.00 -1.03 0.00 0.00 54.13 53.51 1bil s LEU 55 Cb -0.43 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 43.71 1bil s LEU 55 CO 0.47 0.29 0.66 0.12 0.23 0.00 0.00 176.35 178.11 1bil s PHE 56 N -1.09 3.44 -0.47 0.29 5.36 0.14 -4.59 117.98 121.06 1bil s PHE 56 Ca 0.20 1.04 -0.06 0.00 -0.96 0.00 0.00 56.93 57.15 1bil s PHE 56 Cb -0.12 -2.80 0.12 0.00 -0.34 0.00 0.00 43.02 39.88 1bil s PHE 56 CO 0.10 -0.09 0.31 0.34 -1.46 0.00 0.00 175.22 174.43 1bil s ASP 57 N 1.04 5.51 0.56 6.13 -1.08 -1.26 -0.54 116.67 127.02 1bil s ASP 57 Ca 0.32 -2.08 0.25 0.00 -0.52 0.00 0.00 52.55 50.52 1bil s ASP 57 Cb -0.16 -1.93 1.51 0.00 -1.46 0.00 0.00 42.92 40.88 1bil s ASP 57 CO 0.12 -0.60 2.09 0.00 0.52 0.00 0.00 175.17 177.31 1bil h ALA 58 N 8.12 2.01 0.00 3.66 0.00 -1.95 -2.47 119.26 128.63 1bil h ALA 58 Ca -0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1bil h ALA 58 Cb 1.05 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1bil h ALA 58 CO 0.78 -0.31 0.00 -1.13 0.00 0.00 0.00 179.25 178.59 1bil n SER 59 N -4.12 0.00 -0.57 0.00 3.41 -1.26 -0.57 113.62 110.51 1bil n SER 59 Ca 0.02 0.35 0.05 0.00 -0.26 0.00 0.00 58.87 59.04 1bil n SER 59 Cb 0.33 -0.40 0.14 0.00 -0.26 0.00 0.00 64.21 64.02 1bil n SER 59 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1bil n ASP 60 N -1.40 2.87 -4.13 4.04 8.00 -0.93 -4.94 116.55 120.06 1bil n ASP 60 Ca 0.03 -2.07 -0.33 0.00 0.71 0.00 0.00 54.79 53.12 1bil n ASP 60 Cb 0.07 -0.22 -0.16 0.00 -0.02 0.00 0.00 41.12 40.79 1bil n ASP 60 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1bil s SER 61 N -1.07 3.16 0.34 -2.24 0.15 0.26 -4.29 113.70 110.01 1bil s SER 61 Ca 0.22 -0.64 0.17 0.00 0.70 0.00 0.00 55.95 56.39 1bil s SER 61 Cb 0.12 -1.48 0.57 0.00 -1.71 0.00 0.00 66.02 63.51 1bil s SER 61 CO 0.13 0.01 1.69 0.77 1.20 0.00 0.00 173.24 177.04 1bil h SER 62 N 7.90 0.00 -0.44 5.45 4.64 -1.67 -3.22 113.55 126.20 1bil h SER 62 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1bil h SER 62 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1bil h SER 62 CO 0.63 0.44 0.00 -1.54 -0.87 0.00 0.00 176.83 175.50 1bil n SER 63 N -3.58 2.85 -4.77 4.97 3.41 -1.26 -4.95 113.62 110.29 1bil n SER 63 Ca -0.00 -2.14 -0.38 0.00 -0.26 0.00 0.00 58.87 56.09 1bil n SER 63 Cb 0.55 -0.39 -0.05 0.00 -0.26 0.00 0.00 64.21 64.06 1bil n SER 63 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1bil s TYR 64 N -1.56 3.51 -0.13 7.33 6.14 -1.22 -4.53 117.35 126.89 1bil s TYR 64 Ca 0.32 1.71 0.01 0.00 0.64 0.00 0.00 57.07 59.75 1bil s TYR 64 Cb 0.19 -3.10 0.02 0.00 0.42 0.00 0.00 41.96 39.48 1bil s TYR 64 CO 0.18 -0.31 -0.13 0.15 0.64 0.00 0.00 175.55 176.08 1bil s LYS 65 N -2.03 2.06 0.53 4.97 -0.14 0.50 -4.99 119.74 120.64 1bil s LYS 65 Ca 0.51 -0.47 -0.21 0.00 -1.36 0.00 0.00 55.97 54.44 1bil s LYS 65 Cb -0.24 -1.89 -0.05 0.00 -1.68 0.00 0.00 37.83 33.97 1bil s LYS 65 CO 0.30 -0.20 1.28 -1.58 -0.76 0.00 0.00 175.35 174.40 1bil s HIS 66 N 1.40 2.44 0.07 3.18 5.65 -1.26 -2.00 115.29 124.78 1bil s HIS 66 Ca 0.02 1.44 0.00 0.00 0.25 0.00 0.00 55.06 56.77 1bil s HIS 66 Cb -0.13 -3.64 0.00 0.00 -1.18 0.00 0.00 32.58 27.62 1bil s HIS 66 CO -0.07 -2.44 0.00 -1.71 -0.65 0.00 0.00 174.74 169.86 1bil n ASN 67 N -1.01 0.10 0.00 9.88 2.85 -1.21 -4.84 115.26 121.04 1bil n ASN 67 Ca 0.10 0.12 0.00 0.00 -0.11 0.00 0.00 54.58 54.69 1bil n ASN 67 Cb 0.47 0.04 0.00 0.00 1.24 0.00 0.00 39.78 41.53 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 2.26 2.47 3.70 8.20 0.00 0.48 -4.97 105.19 117.34 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 -2.70 2.56 0.46 2.61 2.01 -1.26 -4.56 115.64 114.75 1bil s THR 69 Ca 0.00 0.23 -0.22 0.00 0.31 0.00 0.00 61.69 62.02 1bil s THR 69 Cb 0.00 -3.15 -0.09 0.00 0.01 0.00 0.00 72.50 69.27 1bil s THR 69 CO 0.00 0.01 1.04 -1.61 -0.69 0.00 0.00 174.62 173.37 1bil s GLU 70 N 2.00 3.92 -0.21 4.92 2.02 -1.26 0.95 118.70 131.05 1bil s GLU 70 Ca 0.75 1.42 -0.18 0.00 0.02 0.00 0.00 54.97 56.98 1bil s GLU 70 Cb -0.45 -2.25 0.06 0.00 0.10 0.00 0.00 34.13 31.59 1bil s GLU 70 CO 0.33 -0.33 0.55 -0.48 0.02 0.00 0.00 175.26 175.35 1bil s LEU 71 N -3.19 -0.14 -0.14 1.80 2.34 0.98 -4.83 118.68 115.49 1bil s LEU 71 Ca 0.64 1.11 -0.02 0.00 0.06 0.00 0.00 54.13 55.93 1bil s LEU 71 Cb -0.18 1.88 -0.02 0.00 -0.56 0.00 0.00 46.19 47.30 1bil s LEU 71 CO 0.23 -0.19 -0.09 -0.89 -1.06 0.00 0.00 176.35 174.34 1bil s THR 72 N 0.43 3.40 -0.26 5.48 2.01 -1.26 -0.32 115.64 125.13 1bil s THR 72 Ca -0.01 -0.53 -0.03 0.00 0.31 0.00 0.00 61.69 61.43 1bil s THR 72 Cb -0.04 -2.46 0.02 0.00 0.01 0.00 0.00 72.50 70.03 1bil s THR 72 CO -0.01 0.51 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.64 1bil s LEU 73 N 0.38 3.31 -0.21 4.42 1.43 0.37 -5.00 118.68 123.38 1bil s LEU 73 Ca -0.08 -0.82 -0.10 0.00 -1.03 0.00 0.00 54.13 52.11 1bil s LEU 73 Cb -0.15 -1.71 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 1bil s LEU 73 CO 0.04 -0.14 0.13 -0.13 0.23 0.00 0.00 176.35 176.49 1bil s ARG 74 N 1.37 4.15 0.35 1.70 0.52 -1.26 -1.82 118.95 123.96 1bil s ARG 74 Ca 0.01 -0.24 0.06 0.00 -0.52 0.00 0.00 55.73 55.04 1bil s ARG 74 Cb -0.17 -3.43 -0.07 0.00 0.52 0.00 0.00 34.95 31.81 1bil s ARG 74 CO -0.03 0.25 0.00 0.71 0.02 0.00 0.00 175.30 176.25 1bil s TYR 75 N 0.50 2.22 0.31 -0.53 2.02 0.14 -5.00 117.35 117.00 1bil s TYR 75 Ca 0.08 -0.75 0.04 0.00 -0.37 0.00 0.00 57.07 56.06 1bil s TYR 75 Cb -0.12 -1.45 0.64 0.00 -0.40 0.00 0.00 41.96 40.63 1bil s TYR 75 CO -0.01 0.29 1.85 0.77 -1.57 0.00 0.00 175.55 176.88 1bil h SER 76 N 2.01 0.84 -0.20 2.29 0.02 -2.00 -2.95 113.55 113.55 1bil h SER 76 Ca -0.42 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1bil h SER 76 Cb 1.24 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.66 1bil h SER 76 CO 0.74 0.44 0.00 0.35 -1.14 0.00 0.00 176.83 177.22 1bil n THR 77 N -4.60 2.04 0.00 -2.27 -2.24 -1.26 -5.04 114.28 100.91 1bil n THR 77 Ca 0.18 -1.85 0.00 0.00 -2.27 0.00 0.00 64.05 60.12 1bil n THR 77 Cb 0.38 -0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 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 -0.61 2.21 3.08 3.38 0.00 -1.12 -4.25 105.19 107.89 1bil n GLY 78 Ca 0.19 -1.07 -0.12 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.00 0.55 0.00 2.61 2.01 -1.26 0.25 115.64 117.81 1bil s THR 79 Ca 0.00 -1.22 -0.04 0.00 0.31 0.00 0.00 61.69 60.75 1bil s THR 79 Cb 0.00 -0.78 -0.00 0.00 0.01 0.00 0.00 72.50 71.73 1bil s THR 79 CO 0.00 -0.47 0.07 0.68 -0.69 0.00 0.00 174.62 174.21 1bil s VAL 80 N -1.76 0.07 0.16 3.82 -7.23 -0.76 -4.25 120.40 110.46 1bil s VAL 80 Ca -0.07 -0.61 0.09 0.00 -1.81 0.00 0.00 61.98 59.58 1bil s VAL 80 Cb -0.07 -0.30 -0.04 0.00 0.56 0.00 0.00 36.38 36.52 1bil s VAL 80 CO -0.01 -0.34 -0.19 -0.44 -0.31 0.00 0.00 175.10 173.82 1bil s SER 81 N -1.08 2.74 0.00 4.85 0.01 -0.80 -0.48 113.70 118.95 1bil s SER 81 Ca -0.12 -0.85 0.00 0.00 1.31 0.00 0.00 55.95 56.30 1bil s SER 81 Cb -0.07 -0.17 0.00 0.00 0.21 0.00 0.00 66.02 66.00 1bil s SER 81 CO 0.00 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.25 1bil n GLY 82 N 0.36 1.53 3.23 3.44 0.00 0.57 -0.48 105.19 113.85 1bil n GLY 82 Ca -0.14 -0.35 -0.09 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.17 0.41 0.19 1.61 -0.12 -0.64 -0.02 117.98 118.25 1bil s PHE 83 Ca 0.00 -0.82 -0.27 0.00 -0.05 0.00 0.00 56.93 55.79 1bil s PHE 83 Cb 0.00 -0.17 -0.08 0.00 -0.63 0.00 0.00 43.02 42.14 1bil s PHE 83 CO 0.00 -0.59 0.83 -0.51 -0.05 0.00 0.00 175.22 174.90 1bil s LEU 84 N -2.94 4.61 0.21 -1.99 1.43 0.27 -0.19 118.68 120.07 1bil s LEU 84 Ca 0.13 1.74 0.00 0.00 -1.03 0.00 0.00 54.13 54.98 1bil s LEU 84 Cb 0.05 -3.39 -0.05 0.00 0.03 0.00 0.00 46.19 42.83 1bil s LEU 84 CO -0.04 0.19 0.08 -0.44 0.23 0.00 0.00 176.35 176.37 1bil s SER 85 N -1.15 0.79 -0.02 2.29 0.01 0.45 -0.39 113.70 115.68 1bil s SER 85 Ca 0.37 -1.32 -0.00 0.00 1.31 0.00 0.00 55.95 56.31 1bil s SER 85 Cb -0.24 0.23 0.02 0.00 0.21 0.00 0.00 66.02 66.25 1bil s SER 85 CO 0.28 -0.73 0.03 -1.58 0.41 0.00 0.00 173.24 171.65 1bil s GLN 86 N -4.05 -0.02 0.32 12.44 0.74 -0.84 -0.63 119.66 127.62 1bil s GLN 86 Ca 0.34 0.16 -0.14 0.00 0.05 0.00 0.00 55.36 55.77 1bil s GLN 86 Cb 0.07 -0.19 0.05 0.00 1.10 0.00 0.00 33.01 34.04 1bil s GLN 86 CO 0.10 -0.13 0.72 -3.47 -0.55 0.00 0.00 175.29 171.95 1bil n ASP 87 N 3.95 -1.93 -4.71 6.67 -0.08 -0.93 -0.37 116.55 119.15 1bil n ASP 87 Ca -0.24 -2.29 -0.39 0.00 -1.51 0.00 0.00 54.79 50.35 1bil n ASP 87 Cb 0.52 3.20 -0.05 0.00 2.34 0.00 0.00 41.12 47.13 1bil n ASP 87 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1bil s ILE 88 N -2.21 5.07 -0.12 5.18 1.09 -1.26 -0.02 121.20 128.94 1bil s ILE 88 Ca 0.15 1.32 0.02 0.00 -1.10 0.00 0.00 60.65 61.03 1bil s ILE 88 Cb -0.04 -3.98 -0.01 0.00 -1.06 0.00 0.00 42.46 37.37 1bil s ILE 88 CO 0.09 0.25 -0.18 -0.63 -0.10 0.00 0.00 174.94 174.38 1bil s ILE 89 N 0.88 2.57 -0.23 2.92 1.01 0.80 -1.01 121.20 128.15 1bil s ILE 89 Ca 0.34 -0.83 -0.04 0.00 0.00 0.00 0.00 60.65 60.12 1bil s ILE 89 Cb -0.17 -2.05 -0.01 0.00 0.01 0.00 0.00 42.46 40.25 1bil s ILE 89 CO 0.16 0.54 -0.03 -0.89 0.00 0.00 0.00 174.94 174.71 1bil s THR 90 N 0.45 3.40 -0.12 2.92 2.01 0.36 -1.52 115.64 123.15 1bil s THR 90 Ca -0.13 -0.52 0.02 0.00 0.31 0.00 0.00 61.69 61.37 1bil s THR 90 Cb -0.17 -2.57 0.01 0.00 0.01 0.00 0.00 72.50 69.78 1bil s THR 90 CO 0.06 0.39 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.51 1bil s VAL 91 N 1.48 1.67 -0.95 3.82 1.01 0.66 -2.07 120.40 126.02 1bil s VAL 91 Ca 0.05 -0.75 -0.07 0.00 0.00 0.00 0.00 61.98 61.21 1bil s VAL 91 Cb -0.15 -1.51 0.06 0.00 0.00 0.00 0.00 36.38 34.79 1bil s VAL 91 CO -0.03 0.48 0.28 0.61 0.00 0.00 0.00 175.10 176.43 1bil n GLY 92 N 4.11 -0.48 0.26 4.51 0.00 -1.26 0.41 105.19 112.74 1bil n GLY 92 Ca -0.19 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.89 3.18 3.79 -0.02 0.00 -1.26 -4.42 105.19 105.57 1bil n GLY 93 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.83 4.42 -0.17 -0.61 1.09 0.16 -5.07 121.20 118.20 1bil s ILE 94 Ca 0.00 1.56 0.01 0.00 -1.10 0.00 0.00 60.65 61.12 1bil s ILE 94 Cb 0.00 -4.01 0.02 0.00 -1.06 0.00 0.00 42.46 37.41 1bil s ILE 94 CO 0.00 0.35 -0.20 -0.89 -0.10 0.00 0.00 174.94 174.10 1bil s THR 95 N -1.36 2.04 0.14 2.92 2.01 -1.26 -0.25 115.64 119.88 1bil s THR 95 Ca 0.40 -0.93 0.08 0.00 0.31 0.00 0.00 61.69 61.55 1bil s THR 95 Cb -0.20 -1.83 -0.04 0.00 0.01 0.00 0.00 72.50 70.44 1bil s THR 95 CO 0.24 0.54 -0.18 0.68 -0.69 0.00 0.00 174.62 175.21 1bil s VAL 96 N 1.20 1.66 -0.46 3.82 -7.23 -0.58 -4.97 120.40 113.85 1bil s VAL 96 Ca 0.03 -1.76 -0.19 0.00 -1.81 0.00 0.00 61.98 58.24 1bil s VAL 96 Cb -0.13 -1.68 0.04 0.00 0.56 0.00 0.00 36.38 35.16 1bil s VAL 96 CO -0.11 -0.28 0.60 -0.89 -0.31 0.00 0.00 175.10 174.11 1bil s THR 97 N -1.84 4.90 0.11 5.32 2.01 -1.26 -0.14 115.64 124.74 1bil s THR 97 Ca 0.11 -0.24 0.08 0.00 0.31 0.00 0.00 61.69 61.96 1bil s THR 97 Cb -0.07 -4.21 -0.04 0.00 0.01 0.00 0.00 72.50 68.19 1bil s THR 97 CO 0.05 -0.65 -0.16 -1.58 -0.69 0.00 0.00 174.62 171.59 1bil s GLN 99 N 2.61 1.89 -0.33 4.92 2.00 0.97 -4.95 119.66 126.78 1bil s GLN 99 Ca 0.17 -1.12 -0.14 0.00 -2.00 0.00 0.00 55.36 52.26 1bil s GLN 99 Cb -0.17 -2.17 -0.02 0.00 0.80 0.00 0.00 33.01 31.45 1bil s GLN 99 CO 0.15 0.49 0.33 -1.64 -0.50 0.00 0.00 175.29 174.12 1bil s MET 100 N -2.10 3.66 0.38 1.67 -1.94 -1.26 -2.19 119.30 117.51 1bil s MET 100 Ca 0.19 -0.37 0.04 0.00 -1.71 0.00 0.00 55.69 53.84 1bil s MET 100 Cb -0.11 -3.77 -0.03 0.00 2.01 0.00 0.00 34.83 32.93 1bil s MET 100 CO 0.11 -0.45 0.13 -0.59 -0.01 0.00 0.00 175.02 174.21 1bil s PHE 101 N 1.97 1.77 -0.09 -0.03 -0.71 0.20 -4.72 117.98 116.38 1bil s PHE 101 Ca 0.11 -1.28 -0.04 0.00 -1.04 0.00 0.00 56.93 54.68 1bil s PHE 101 Cb -0.16 -1.10 -0.04 0.00 -1.21 0.00 0.00 43.02 40.50 1bil s PHE 101 CO 0.11 -0.33 0.07 0.20 -1.34 0.00 0.00 175.22 173.93 1bil s GLY 102 N -3.55 2.00 -0.40 1.99 0.00 -0.32 -0.41 107.32 106.63 1bil s GLY 102 Ca 0.27 -0.75 -0.11 0.00 0.00 0.00 0.00 44.72 44.13 1bil s GLY 102 CO 0.16 -0.52 0.25 -0.54 0.00 0.00 0.00 173.10 172.45 1bil s GLU 103 N -1.07 2.78 -0.09 2.90 2.02 0.73 -1.93 118.70 124.04 1bil s GLU 103 Ca 0.15 -1.23 -0.26 0.00 0.02 0.00 0.00 54.97 53.65 1bil s GLU 103 Cb -0.12 -3.81 -0.02 0.00 0.10 0.00 0.00 34.13 30.27 1bil s GLU 103 CO 0.05 -0.82 0.84 0.08 0.02 0.00 0.00 175.26 175.42 1bil s VAL 104 N 1.53 4.92 -0.09 2.63 1.01 0.66 -1.61 120.40 129.46 1bil s VAL 104 Ca 0.03 1.70 0.04 0.00 0.00 0.00 0.00 61.98 63.74 1bil s VAL 104 Cb -0.21 -4.16 -0.05 0.00 0.00 0.00 0.00 36.38 31.96 1bil s VAL 104 CO 0.05 0.13 0.11 0.35 0.00 0.00 0.00 175.10 175.75 1bil n THR 105 N 4.23 0.00 -4.01 3.92 -2.24 0.37 -1.29 114.28 115.26 1bil n THR 105 Ca 0.03 -0.25 -0.31 0.00 -2.27 0.00 0.00 64.05 61.25 1bil n THR 105 Cb 0.50 0.71 -0.15 0.00 -2.10 0.00 0.00 70.33 69.29 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 -1.79 1.89 -0.30 -0.78 2.02 -0.67 -3.74 118.70 115.33 1bil s GLU 106 Ca -0.00 -1.28 0.00 0.00 0.02 0.00 0.00 54.97 53.71 1bil s GLU 106 Cb 0.02 -2.80 0.09 0.00 0.10 0.00 0.00 34.13 31.55 1bil s GLU 106 CO 0.15 -0.64 0.07 1.41 0.02 0.00 0.00 175.26 176.27 1bil s MET 107 N 1.19 0.96 0.70 1.61 1.75 -1.26 -1.90 119.30 122.35 1bil s MET 107 Ca -0.05 -1.22 -0.15 0.00 -1.25 0.00 0.00 55.69 53.02 1bil s MET 107 Cb -0.19 -2.32 0.02 0.00 2.84 0.00 0.00 34.83 35.17 1bil s MET 107 CO -0.06 -0.92 1.18 -1.25 -0.65 0.00 0.00 175.02 173.32 1bil s PRO 108 N 1.45 2.38 0.46 4.11 0.04 -1.26 -4.44 135.00 137.73 1bil s PRO 108 Ca 0.08 1.68 0.26 0.00 0.04 0.00 0.00 61.00 63.06 1bil s PRO 108 Cb -0.18 -1.87 0.99 0.00 0.04 0.00 0.00 34.50 33.48 1bil s PRO 108 CO -0.19 -1.63 1.85 0.00 0.04 0.00 0.00 177.00 177.07 1bil h ALA 109 N -0.10 1.02 -3.75 8.56 0.00 -1.97 -3.07 119.26 119.94 1bil h ALA 109 Ca -0.48 -0.16 -0.64 0.00 0.00 0.00 0.00 54.91 53.63 1bil h ALA 109 Cb 1.28 -0.03 -0.38 0.00 0.00 0.00 0.00 17.79 18.67 1bil h ALA 109 CO 0.51 0.22 -0.79 -0.51 0.00 0.00 0.00 179.25 178.68 1bil s LEU 110 N -6.65 3.01 0.02 0.00 2.01 -1.26 -1.13 118.68 114.68 1bil s LEU 110 Ca 0.01 -1.28 0.24 0.00 0.01 0.00 0.00 54.13 53.10 1bil s LEU 110 Cb 0.10 -1.37 0.23 0.00 0.01 0.00 0.00 46.19 45.16 1bil s LEU 110 CO 0.62 -0.21 1.20 -0.81 1.01 0.00 0.00 176.35 178.16 1bil n PRO 111 N 4.55 0.11 0.25 1.29 -0.04 -1.26 -4.89 135.00 135.01 1bil n PRO 111 Ca -0.13 0.01 0.18 0.00 -0.04 0.00 0.00 63.50 63.51 1bil n PRO 111 Cb 0.43 -1.54 0.86 0.00 -0.04 0.00 0.00 33.50 33.20 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 0.00 0.00 0.00 0.54 0.04 -1.55 -0.25 116.94 115.73 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 0.59 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.74 1bil h PHE 112 CO 0.00 0.00 0.00 0.52 -0.60 0.00 0.00 178.31 178.23 1bil h MET 113 N 0.00 0.00 -0.01 1.51 2.86 -1.33 -2.61 114.93 115.35 1bil h MET 113 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1bil h MET 113 Cb 0.63 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.29 1bil h MET 113 CO -0.00 0.00 -0.34 1.28 1.06 0.00 0.00 176.91 178.91 1bil n LEU 114 N -2.51 1.42 -4.69 1.22 4.77 -0.11 -4.92 117.00 112.18 1bil n LEU 114 Ca 0.04 -0.46 -0.42 0.00 -0.03 0.00 0.00 56.01 55.15 1bil n LEU 114 Cb 0.41 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.39 1bil n LEU 114 CO 0.29 0.26 0.71 0.00 -1.33 0.00 0.00 177.39 177.32 1bil s ALA 115 N -2.48 3.38 -0.04 -1.18 0.00 -0.98 -4.93 121.76 115.53 1bil s ALA 115 Ca 0.22 0.31 0.29 0.00 0.00 0.00 0.00 51.96 52.79 1bil s ALA 115 Cb 0.19 -3.34 1.02 0.00 0.00 0.00 0.00 23.12 20.99 1bil s ALA 115 CO 0.54 -0.52 1.86 0.93 0.00 0.00 0.00 175.76 178.57 1bil h GLU 116 N 7.07 0.00 -6.68 0.00 4.39 -1.91 -3.45 114.58 114.00 1bil h GLU 116 Ca -0.33 0.00 -0.45 0.00 0.34 0.00 0.00 59.36 58.92 1bil h GLU 116 Cb 1.16 0.00 0.04 0.00 -0.10 0.00 0.00 28.75 29.85 1bil h GLU 116 CO 0.83 0.04 -0.11 -0.59 -1.16 0.00 0.00 179.01 178.01 1bil s PHE 117 N -3.53 2.28 -0.24 4.33 -0.71 -1.26 -4.98 117.98 113.86 1bil s PHE 117 Ca 0.03 -0.38 -0.08 0.00 -1.04 0.00 0.00 56.93 55.45 1bil s PHE 117 Cb 0.08 -2.51 -0.12 0.00 -1.21 0.00 0.00 43.02 39.27 1bil s PHE 117 CO 0.59 -0.90 -0.28 -0.25 -1.34 0.00 0.00 175.22 173.04 1bil n ASP 118 N -2.20 1.85 0.00 1.98 8.00 -0.23 -5.01 116.55 120.94 1bil n ASP 118 Ca 0.11 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.79 1bil n ASP 118 Cb 0.60 -0.62 0.00 0.00 -0.02 0.00 0.00 41.12 41.08 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 1.73 4.47 3.05 0.44 0.00 -0.67 -4.37 105.19 109.84 1bil n GLY 119 Ca -0.46 -1.12 -0.16 0.00 0.00 0.00 0.00 46.02 44.29 1bil n GLY 119 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bil s VAL 120 N -1.27 0.64 -0.28 1.61 1.01 -1.14 -2.02 120.40 118.95 1bil s VAL 120 Ca 0.00 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.22 1bil s VAL 120 Cb 0.00 -0.62 0.05 0.00 0.00 0.00 0.00 36.38 35.81 1bil s VAL 120 CO 0.00 -0.11 -0.04 -0.69 0.00 0.00 0.00 175.10 174.27 1bil s VAL 121 N -0.80 2.76 0.02 2.92 1.01 0.24 -1.57 120.40 124.97 1bil s VAL 121 Ca -0.03 -1.41 -0.30 0.00 0.00 0.00 0.00 61.98 60.24 1bil s VAL 121 Cb -0.07 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 1bil s VAL 121 CO 0.00 -0.05 0.98 -0.83 0.00 0.00 0.00 175.10 175.21 1bil s GLY 122 N 1.22 2.91 -0.14 4.51 0.00 -0.06 -0.28 107.32 115.48 1bil s GLY 122 Ca -0.06 0.55 0.16 0.00 0.00 0.00 0.00 44.72 45.38 1bil s GLY 122 CO -0.02 1.67 1.33 1.03 0.00 0.00 0.00 173.10 177.10 1bil n MET 123 N 3.76 2.54 -0.76 2.90 2.81 0.91 -4.59 117.12 124.70 1bil n MET 123 Ca 0.06 -2.65 0.00 0.00 -1.81 0.00 0.00 57.70 53.29 1bil n MET 123 Cb 0.51 -1.68 0.00 0.00 -0.71 0.00 0.00 33.22 31.34 1bil n MET 123 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1bil n GLY 124 N -0.63 1.57 3.92 3.03 0.00 0.13 -4.67 105.19 108.55 1bil n GLY 124 Ca 0.18 -2.06 -0.26 0.00 0.00 0.00 0.00 46.02 43.88 1bil n GLY 124 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bil s PHE 125 N 0.90 3.36 0.03 1.61 0.40 -1.26 -4.74 117.98 118.28 1bil s PHE 125 Ca 0.00 0.59 0.32 0.00 -0.60 0.00 0.00 56.93 57.24 1bil s PHE 125 Cb 0.00 -2.45 1.45 0.00 0.51 0.00 0.00 43.02 42.53 1bil s PHE 125 CO 0.00 -0.49 1.96 0.97 0.70 0.00 0.00 175.22 178.36 1bil h ILE 126 N 0.14 0.00 -0.59 0.64 2.10 -1.92 0.08 117.51 117.96 1bil h ILE 126 Ca -0.46 -0.31 0.00 0.00 1.08 0.00 0.00 64.86 65.17 1bil h ILE 126 Cb 1.24 1.20 -0.03 0.00 -1.09 0.00 0.00 36.82 38.13 1bil h ILE 126 CO 0.60 0.00 0.37 -0.33 -1.08 0.00 0.00 178.15 177.71 1bil h GLU 127 N 0.00 0.79 -0.14 2.19 3.07 -1.94 -2.18 114.58 116.36 1bil h GLU 127 Ca 0.00 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 1bil h GLU 127 Cb 0.34 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 1bil h GLU 127 CO 0.00 0.54 0.00 1.04 -1.40 0.00 0.00 179.01 179.19 1bil n GLN 128 N -4.43 1.89 -2.56 2.33 1.13 0.01 -4.94 117.38 110.82 1bil n GLN 128 Ca 0.06 -1.33 -0.43 0.00 -1.94 0.00 0.00 57.00 53.36 1bil n GLN 128 Cb 0.06 -1.44 -0.02 0.00 0.11 0.00 0.00 30.24 28.94 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 -1.82 3.50 0.27 -1.58 0.00 -0.82 -4.44 121.76 116.86 1bil s ALA 129 Ca 0.34 0.46 -0.29 0.00 0.00 0.00 0.00 51.96 52.47 1bil s ALA 129 Cb 0.19 -3.50 -0.09 0.00 0.00 0.00 0.00 23.12 19.72 1bil s ALA 129 CO 0.29 -0.78 1.17 0.42 0.00 0.00 0.00 175.76 176.86 1bil s ILE 130 N 2.39 3.35 0.00 0.00 1.09 -1.26 -2.61 121.20 124.15 1bil s ILE 130 Ca 0.52 1.30 0.00 0.00 -1.10 0.00 0.00 60.65 61.36 1bil s ILE 130 Cb -0.21 -3.83 0.00 0.00 -1.06 0.00 0.00 42.46 37.37 1bil s ILE 130 CO 0.18 0.29 0.00 0.61 -0.10 0.00 0.00 174.94 175.91 1bil n GLY 131 N 1.35 0.85 2.46 6.18 0.00 -1.26 -3.64 105.19 111.12 1bil n GLY 131 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.19 -1.51 -2.71 1.61 3.00 -1.07 -4.92 116.66 108.86 1bil n ARG 132 Ca 0.00 1.09 -0.39 0.00 -0.01 0.00 0.00 57.85 58.53 1bil n ARG 132 Cb 0.00 -5.52 -0.06 0.00 0.00 0.00 0.00 32.46 26.89 1bil n ARG 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 1bil s VAL 133 N -2.71 4.00 0.22 1.55 -7.23 -1.24 -4.96 120.40 110.03 1bil s VAL 133 Ca 0.00 1.92 -0.31 0.00 -1.81 0.00 0.00 61.98 61.77 1bil s VAL 133 Cb 0.00 -4.18 -0.12 0.00 0.56 0.00 0.00 36.38 32.64 1bil s VAL 133 CO 0.00 0.38 1.67 -0.89 -0.31 0.00 0.00 175.10 175.95 1bil s THR 134 N -1.29 2.11 0.63 5.32 2.01 -1.26 -4.87 115.64 118.29 1bil s THR 134 Ca 0.44 0.08 -0.15 0.00 0.31 0.00 0.00 61.69 62.38 1bil s THR 134 Cb -0.25 -3.05 -0.02 0.00 0.01 0.00 0.00 72.50 69.19 1bil s THR 134 CO 0.31 0.01 1.07 -2.84 -0.69 0.00 0.00 174.62 172.48 1bil s PRO 135 N 0.75 3.11 0.17 4.92 0.02 -1.26 -4.75 135.00 137.96 1bil s PRO 135 Ca 0.71 1.23 -0.11 0.00 0.02 0.00 0.00 61.00 62.85 1bil s PRO 135 Cb -0.48 -2.00 0.07 0.00 0.02 0.00 0.00 34.50 32.11 1bil s PRO 135 CO 0.36 -0.98 1.70 0.97 -0.33 0.00 0.00 177.00 178.72 1bil h ILE 136 N 0.17 1.24 -0.66 2.83 2.10 -1.82 -1.85 117.51 119.52 1bil h ILE 136 Ca -0.46 -0.84 -0.01 0.00 1.08 0.00 0.00 64.86 64.63 1bil h ILE 136 Cb 1.23 0.64 -0.03 0.00 -1.09 0.00 0.00 36.82 37.57 1bil h ILE 136 CO 0.56 0.32 0.39 0.15 -1.08 0.00 0.00 178.15 178.49 1bil h PHE 137 N 0.87 0.86 -0.40 2.19 3.57 -1.92 -0.54 116.94 121.57 1bil h PHE 137 Ca 0.20 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.66 1bil h PHE 137 Cb 0.30 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 1bil h PHE 137 CO 0.02 0.58 0.10 -0.44 -2.23 0.00 0.00 178.31 176.34 1bil h ASP 138 N 0.91 0.61 -0.70 0.41 5.19 -1.86 0.39 116.42 121.37 1bil h ASP 138 Ca 0.24 -0.23 0.03 0.00 -0.62 0.00 0.00 57.03 56.45 1bil h ASP 138 Cb -0.03 -0.16 -0.04 0.00 0.18 0.00 0.00 39.33 39.28 1bil h ASP 138 CO -0.04 0.68 0.44 0.78 -3.12 0.00 0.00 179.24 177.98 1bil h ASN 139 N 0.51 0.73 0.47 6.45 -0.26 -0.45 -0.94 115.58 122.10 1bil h ASN 139 Ca 0.13 -0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.85 1bil h ASN 139 Cb 0.31 -0.16 -0.00 0.00 -1.06 0.00 0.00 38.32 37.41 1bil h ASN 139 CO 0.00 0.50 -0.28 0.40 -1.06 0.00 0.00 177.43 176.99 1bil h ILE 140 N 0.86 0.43 -0.60 2.81 2.04 -0.47 -0.22 117.51 122.36 1bil h ILE 140 Ca 0.28 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.32 1bil h ILE 140 Cb 0.02 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 1bil h ILE 140 CO -0.11 0.00 0.81 0.40 0.00 0.00 0.00 178.15 179.25 1bil h ILE 141 N -0.71 0.14 0.00 -0.67 1.08 0.52 0.26 117.51 118.14 1bil h ILE 141 Ca -0.06 0.00 -0.09 0.00 -0.39 0.00 0.00 64.86 64.32 1bil h ILE 141 Cb 0.57 0.32 -0.01 0.00 -3.07 0.00 0.00 36.82 34.63 1bil h ILE 141 CO 0.06 0.00 -0.43 0.28 -0.69 0.00 0.00 178.15 177.37 1bil h SER 142 N 0.00 0.00 0.86 1.72 0.02 0.30 -3.18 113.55 113.27 1bil h SER 142 Ca 0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.23 1bil h SER 142 Cb 1.90 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.44 1bil h SER 142 CO -0.00 0.43 0.00 -0.61 -1.14 0.00 0.00 176.83 175.51 1bil h GLN 143 N 0.00 0.00 -1.89 3.45 4.15 -0.23 -3.47 115.11 117.11 1bil h GLN 143 Ca -0.00 0.00 -0.30 0.00 0.77 0.00 0.00 58.65 59.11 1bil h GLN 143 Cb 1.29 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.95 1bil h GLN 143 CO 0.06 0.00 -0.37 0.41 -1.93 0.00 0.00 178.83 177.00 1bil n GLY 144 N -0.07 0.07 0.11 2.39 0.00 -1.20 -4.92 105.19 101.57 1bil n GLY 144 Ca 0.01 -0.26 -0.13 0.00 0.00 0.00 0.00 46.02 45.64 1bil n GLY 144 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1bil n VAL 145 N -3.75 1.49 -2.05 1.61 0.24 -1.26 -3.60 118.33 111.01 1bil n VAL 145 Ca -0.17 -0.75 -0.41 0.00 -2.04 0.00 0.00 64.34 60.96 1bil n VAL 145 Cb 0.61 -0.93 -0.02 0.00 -1.47 0.00 0.00 33.84 32.04 1bil n VAL 145 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1bil s LEU 146 N -6.00 4.40 0.08 1.34 1.43 -1.26 0.11 118.68 118.78 1bil s LEU 146 Ca -0.17 2.74 -0.24 0.00 -1.03 0.00 0.00 54.13 55.43 1bil s LEU 146 Cb 0.07 -3.65 -0.15 0.00 0.03 0.00 0.00 46.19 42.49 1bil s LEU 146 CO 0.76 -0.61 1.72 0.50 0.23 0.00 0.00 176.35 178.95 1bil h LYS 147 N 3.61 -0.08 -5.94 1.70 3.64 -0.34 -2.42 116.57 116.74 1bil h LYS 147 Ca -0.49 0.01 -0.54 0.00 -1.27 0.00 0.00 60.65 58.36 1bil h LYS 147 Cb 1.23 0.02 -0.15 0.00 -0.41 0.00 0.00 32.23 32.91 1bil h LYS 147 CO 0.67 -0.04 -0.76 -1.21 -2.27 0.00 0.00 179.45 175.84 1bil s GLU 148 N -6.12 1.46 -0.34 1.90 2.02 -0.30 -4.44 118.70 112.88 1bil s GLU 148 Ca -0.13 -1.61 -0.04 0.00 0.02 0.00 0.00 54.97 53.20 1bil s GLU 148 Cb 0.06 -1.44 -0.03 0.00 0.10 0.00 0.00 34.13 32.81 1bil s GLU 148 CO 0.66 0.27 3.00 -3.47 0.02 0.00 0.00 175.26 175.74 1bil n ASP 149 N -0.29 6.15 -4.18 -0.19 2.03 -1.26 -3.99 116.55 114.82 1bil n ASP 149 Ca -0.08 -3.01 -0.11 0.00 0.52 0.00 0.00 54.79 52.11 1bil n ASP 149 Cb 0.59 -1.28 -0.10 0.00 -0.72 0.00 0.00 41.12 39.61 1bil n ASP 149 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1bil s VAL 150 N -1.36 0.59 -0.01 5.18 -7.23 -1.26 -0.07 120.40 116.25 1bil s VAL 150 Ca 0.61 -1.94 -0.03 0.00 -1.81 0.00 0.00 61.98 58.81 1bil s VAL 150 Cb 0.37 -1.83 -0.00 0.00 0.56 0.00 0.00 36.38 35.48 1bil s VAL 150 CO -0.16 -0.73 0.07 0.72 -0.31 0.00 0.00 175.10 174.68 1bil s PHE 151 N -3.70 0.03 0.24 2.82 -0.12 -0.23 -0.16 117.98 116.86 1bil s PHE 151 Ca 0.16 -0.05 0.04 0.00 -0.05 0.00 0.00 56.93 57.03 1bil s PHE 151 Cb 0.06 -0.04 -0.05 0.00 -0.63 0.00 0.00 43.02 42.35 1bil s PHE 151 CO -0.02 -0.14 -0.02 -1.12 -0.05 0.00 0.00 175.22 173.87 1bil s SER 152 N -0.67 2.01 -0.03 1.98 0.01 0.02 -0.32 113.70 116.70 1bil s SER 152 Ca -0.07 -1.20 0.04 0.00 1.31 0.00 0.00 55.95 56.02 1bil s SER 152 Cb -0.05 -0.03 -0.00 0.00 0.21 0.00 0.00 66.02 66.16 1bil s SER 152 CO 0.00 -0.47 -0.14 -0.36 0.41 0.00 0.00 173.24 172.68 1bil s PHE 153 N -3.34 1.38 -0.18 2.43 0.40 0.11 -2.35 117.98 116.42 1bil s PHE 153 Ca 0.28 -0.35 0.01 0.00 -0.60 0.00 0.00 56.93 56.27 1bil s PHE 153 Cb 0.05 -0.93 0.03 0.00 0.51 0.00 0.00 43.02 42.68 1bil s PHE 153 CO 0.09 -0.11 -0.16 -0.47 0.70 0.00 0.00 175.22 175.27 1bil s TYR 154 N -0.01 2.60 -0.17 0.36 5.04 -0.43 -1.91 117.35 122.83 1bil s TYR 154 Ca -0.01 -1.59 -0.02 0.00 -2.44 0.00 0.00 57.07 53.01 1bil s TYR 154 Cb -0.09 -1.79 -0.01 0.00 0.35 0.00 0.00 41.96 40.42 1bil s TYR 154 CO 0.01 -0.77 -0.08 0.71 -1.34 0.00 0.00 175.55 174.08 1bil s TYR 155 N 1.34 2.91 0.62 4.97 2.02 -1.26 -0.79 117.35 127.16 1bil s TYR 155 Ca 0.03 -0.73 0.02 0.00 -0.37 0.00 0.00 57.07 56.01 1bil s TYR 155 Cb -0.14 -1.98 0.08 0.00 -0.40 0.00 0.00 41.96 39.52 1bil s TYR 155 CO -0.11 -0.34 0.86 1.21 -1.57 0.00 0.00 175.55 175.60 1bil s ASN 156 N 0.85 4.88 0.61 2.29 3.04 -0.54 -4.51 114.94 121.56 1bil s ASN 156 Ca -0.02 -0.29 -0.07 0.00 0.04 0.00 0.00 52.86 52.51 1bil s ASN 156 Cb -0.15 -0.34 0.00 0.00 -1.54 0.00 0.00 41.25 39.22 1bil s ASN 156 CO 0.01 -1.46 0.94 -0.13 -3.04 0.00 0.00 177.10 173.43 1bil s ARG 157 N -4.89 3.02 0.00 0.43 0.52 -1.26 -4.92 118.95 111.85 1bil s ARG 157 Ca 0.62 0.18 0.00 0.00 -0.52 0.00 0.00 55.73 56.00 1bil s ARG 157 Cb -0.08 -2.21 0.00 0.00 0.52 0.00 0.00 34.95 33.18 1bil s ARG 157 CO 0.41 -0.72 0.00 -3.47 0.02 0.00 0.00 175.30 171.54 1bil n ASP 158 N -2.66 0.00 -3.53 0.23 -0.08 -1.26 -4.84 116.55 104.41 1bil n ASP 158 Ca 0.05 0.00 -0.06 0.00 -1.51 0.00 0.00 54.79 53.27 1bil n ASP 158 Cb 0.57 0.00 -0.00 0.00 2.34 0.00 0.00 41.12 44.03 1bil n ASP 158 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1bil s SER 159 N -1.07 -0.13 0.00 1.67 0.01 -1.26 -4.69 113.70 108.23 1bil s SER 159 Ca 0.00 -0.68 0.31 0.00 1.31 0.00 0.00 55.95 56.89 1bil s SER 159 Cb 0.00 0.65 1.69 0.00 0.21 0.00 0.00 66.02 68.56 1bil s SER 159 CO 0.00 -1.24 2.12 -0.62 0.41 0.00 0.00 173.24 173.91 1bil n GLU 160 N -0.52 0.85 -2.96 12.44 -0.58 -1.26 -5.05 120.64 123.57 1bil n GLU 160 Ca -0.05 -0.08 0.00 0.00 -0.42 0.00 0.00 57.16 56.60 1bil n GLU 160 Cb 0.60 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.97 1bil n GLU 160 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1bil n SER 160 N -1.00 0.00 -4.66 1.62 3.41 -1.26 -5.28 113.62 106.45 1bil n SER 160 Ca 0.20 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.38 1bil n SER 160 Cb 0.18 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.10 1bil n SER 160 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1bil s LEU 161 N 0.00 4.12 0.55 1.04 2.96 -1.26 -4.93 118.68 121.16 1bil s LEU 161 Ca 0.00 1.35 0.26 0.00 -0.22 0.00 0.00 54.13 55.52 1bil s LEU 161 Cb 0.00 -3.48 1.44 0.00 0.50 0.00 0.00 46.19 44.65 1bil s LEU 161 CO 0.00 -0.60 2.00 1.23 -1.32 0.00 0.00 176.35 177.65 1bil h GLY 162 N 9.14 0.00 0.00 7.98 0.00 -1.90 -3.42 103.07 114.87 1bil h GLY 162 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1bil h GLY 162 CO 0.94 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.09 1bil n GLY 163 N -1.60 -0.11 3.64 4.60 0.00 -1.22 -1.46 105.19 109.03 1bil n GLY 163 Ca 0.09 -1.47 -0.10 0.00 0.00 0.00 0.00 46.02 44.54 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 -1.76 0.56 -0.10 1.61 0.74 0.03 -1.75 119.66 118.99 1bil s GLN 164 Ca 0.00 0.65 -0.00 0.00 0.05 0.00 0.00 55.36 56.06 1bil s GLN 164 Cb 0.00 0.27 -0.03 0.00 1.10 0.00 0.00 33.01 34.36 1bil s GLN 164 CO 0.00 -0.07 -0.07 0.42 -0.55 0.00 0.00 175.29 175.03 1bil s ILE 165 N 0.23 3.70 -0.23 -2.34 1.01 -0.38 -1.32 121.20 121.87 1bil s ILE 165 Ca 0.03 -0.46 -0.05 0.00 0.00 0.00 0.00 60.65 60.16 1bil s ILE 165 Cb -0.05 -2.54 -0.02 0.00 0.01 0.00 0.00 42.46 39.86 1bil s ILE 165 CO -0.05 0.57 -0.00 -0.69 0.00 0.00 0.00 174.94 174.76 1bil s VAL 166 N -0.41 3.73 -0.38 2.92 1.01 -0.99 0.43 120.40 126.71 1bil s VAL 166 Ca 0.06 -0.37 -0.17 0.00 0.00 0.00 0.00 61.98 61.49 1bil s VAL 166 Cb -0.12 -2.71 0.01 0.00 0.00 0.00 0.00 36.38 33.55 1bil s VAL 166 CO 0.02 0.40 0.46 -0.76 0.00 0.00 0.00 175.10 175.22 1bil s LEU 167 N 1.45 4.58 0.00 3.92 1.43 0.30 -0.79 118.68 129.56 1bil s LEU 167 Ca 0.05 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 52.79 1bil s LEU 167 Cb -0.15 -2.46 0.00 0.00 0.03 0.00 0.00 46.19 43.62 1bil s LEU 167 CO -0.00 -0.51 0.00 0.61 0.23 0.00 0.00 176.35 176.68 1bil n GLY 168 N 4.98 1.66 0.00 -3.19 0.00 0.77 -1.22 105.19 108.20 1bil n GLY 168 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.79 2.28 3.25 -0.02 0.00 -1.25 -1.15 105.19 107.53 1bil n GLY 169 Ca 0.00 -0.15 -0.14 0.00 0.00 0.00 0.00 46.02 45.73 1bil n GLY 169 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bil s SER 170 N 2.00 0.71 -0.26 1.61 0.01 -1.26 -3.78 113.70 112.73 1bil s SER 170 Ca 0.00 -1.37 0.02 0.00 1.31 0.00 0.00 55.95 55.92 1bil s SER 170 Cb 0.00 0.26 0.07 0.00 0.21 0.00 0.00 66.02 66.55 1bil s SER 170 CO 0.00 -0.77 -0.07 -0.62 0.41 0.00 0.00 173.24 172.20 1bil s ASP 171 N -3.23 4.24 0.00 2.44 -1.08 -1.26 -4.98 116.67 112.80 1bil s ASP 171 Ca 0.37 -1.40 0.09 0.00 -0.52 0.00 0.00 52.55 51.09 1bil s ASP 171 Cb 0.07 -1.40 0.41 0.00 -1.46 0.00 0.00 42.92 40.55 1bil s ASP 171 CO 0.12 -0.23 1.22 -2.65 0.52 0.00 0.00 175.17 174.14 1bil n PRO 172 N 4.52 0.07 0.00 4.34 -0.02 -1.26 -0.34 135.00 142.30 1bil n PRO 172 Ca -0.11 0.27 0.14 0.00 -2.02 0.00 0.00 63.50 61.78 1bil n PRO 172 Cb 0.43 -1.50 0.61 0.00 -0.02 0.00 0.00 33.50 33.02 1bil n PRO 172 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1bil n GLN 173 N -1.39 0.13 -0.14 -0.52 0.00 -1.26 -3.86 117.38 110.33 1bil n GLN 173 Ca 0.03 -0.02 0.04 0.00 -0.00 0.00 0.00 57.00 57.06 1bil n GLN 173 Cb 0.09 -1.50 0.12 0.00 0.00 0.00 0.00 30.24 28.95 1bil n GLN 173 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1bil n HIS 174 N -1.42 0.37 -3.93 3.69 8.25 0.54 -4.76 115.22 117.95 1bil n HIS 174 Ca 0.09 -0.52 -0.09 0.00 -0.26 0.00 0.00 57.72 56.93 1bil n HIS 174 Cb 0.32 -0.05 -0.05 0.00 1.12 0.00 0.00 29.99 31.33 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 -1.10 0.27 0.05 4.41 1.13 -1.25 -1.37 117.35 119.47 1bil s TYR 175 Ca 0.19 -0.62 -0.11 0.00 -1.41 0.00 0.00 57.07 55.11 1bil s TYR 175 Cb 0.10 0.17 0.01 0.00 -1.10 0.00 0.00 41.96 41.14 1bil s TYR 175 CO 0.12 -0.90 0.24 -1.83 -2.51 0.00 0.00 175.55 170.66 1bil s GLU 176 N -3.97 0.75 1.64 -3.49 -1.05 -0.41 -4.76 118.70 107.41 1bil s GLU 176 Ca 0.18 -0.61 0.00 0.00 -0.15 0.00 0.00 54.97 54.39 1bil s GLU 176 Cb 0.00 0.32 0.00 0.00 -0.44 0.00 0.00 34.13 34.01 1bil s GLU 176 CO 0.04 -0.23 0.00 0.41 0.95 0.00 0.00 175.26 176.43 1bil n GLY 177 N 0.57 -1.71 3.53 -3.83 0.00 -1.26 -3.61 105.19 98.87 1bil n GLY 177 Ca -0.18 -1.36 -0.24 0.00 0.00 0.00 0.00 46.02 44.24 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 3.93 0.74 1.61 0.01 -1.26 -4.98 114.94 111.00 1bil s ASN 178 Ca 0.00 -0.86 -0.12 0.00 -0.71 0.00 0.00 52.86 51.17 1bil s ASN 178 Cb 0.00 -0.50 0.04 0.00 0.41 0.00 0.00 41.25 41.20 1bil s ASN 178 CO 0.00 0.04 1.10 -0.36 -1.51 0.00 0.00 177.10 176.37 1bil s PHE 179 N -2.31 2.57 -0.15 2.20 0.08 -1.26 -4.68 117.98 114.43 1bil s PHE 179 Ca 0.29 1.56 -0.02 0.00 0.12 0.00 0.00 56.93 58.88 1bil s PHE 179 Cb -0.06 -3.09 0.05 0.00 -0.57 0.00 0.00 43.02 39.35 1bil s PHE 179 CO 0.16 -1.79 0.02 -1.01 -0.10 0.00 0.00 175.22 172.51 1bil s HIS 180 N -2.74 0.90 -0.08 0.36 3.76 -1.02 -4.93 115.29 111.54 1bil s HIS 180 Ca 0.63 -0.61 -0.16 0.00 -0.15 0.00 0.00 55.06 54.77 1bil s HIS 180 Cb -0.18 -0.95 -0.05 0.00 1.11 0.00 0.00 32.58 32.51 1bil s HIS 180 CO 0.52 -0.51 0.41 0.71 -0.85 0.00 0.00 174.74 175.02 1bil s TYR 181 N 1.90 3.58 -0.08 1.40 2.02 -1.26 -1.67 117.35 123.24 1bil s TYR 181 Ca 0.01 0.87 0.01 0.00 -0.37 0.00 0.00 57.07 57.59 1bil s TYR 181 Cb -0.15 -2.41 -0.03 0.00 -0.40 0.00 0.00 41.96 38.97 1bil s TYR 181 CO -0.07 0.36 -0.08 0.42 -1.57 0.00 0.00 175.55 174.61 1bil s ILE 182 N -0.04 3.61 0.22 2.71 1.09 0.12 -4.96 121.20 123.95 1bil s ILE 182 Ca 0.23 -0.51 -0.08 0.00 -1.10 0.00 0.00 60.65 59.20 1bil s ILE 182 Cb -0.15 -2.48 -0.07 0.00 -1.06 0.00 0.00 42.46 38.70 1bil s ILE 182 CO 0.10 0.58 0.51 0.20 -0.10 0.00 0.00 174.94 176.23 1bil s ASN 183 N -0.60 6.57 0.71 3.58 -0.87 -1.26 -1.53 114.94 121.54 1bil s ASN 183 Ca 0.09 0.81 -0.12 0.00 -1.57 0.00 0.00 52.86 52.07 1bil s ASN 183 Cb -0.12 -2.18 0.02 0.00 -0.02 0.00 0.00 41.25 38.96 1bil s ASN 183 CO 0.02 -0.06 1.09 -0.76 -2.57 0.00 0.00 177.10 174.81 1bil s LEU 184 N -2.89 3.19 0.24 0.60 1.43 -1.09 -4.62 118.68 115.54 1bil s LEU 184 Ca 0.45 1.83 -0.05 0.00 -1.03 0.00 0.00 54.13 55.33 1bil s LEU 184 Cb -0.11 -4.53 0.24 0.00 0.03 0.00 0.00 46.19 41.82 1bil s LEU 184 CO 0.23 -1.74 1.77 0.40 0.23 0.00 0.00 176.35 177.25 1bil h ILE 185 N -0.59 1.25 -2.18 -0.59 1.08 -1.82 -3.47 117.51 111.19 1bil h ILE 185 Ca -0.45 -0.88 0.07 0.00 -0.39 0.00 0.00 64.86 63.21 1bil h ILE 185 Cb 1.23 0.53 -0.17 0.00 -3.07 0.00 0.00 36.82 35.35 1bil h ILE 185 CO 0.54 0.34 0.44 -1.59 -0.69 0.00 0.00 178.15 177.19 1bil s LYS 186 N -5.32 0.85 0.68 2.37 -2.85 -1.26 -5.14 119.74 109.06 1bil s LYS 186 Ca -0.11 -0.17 -0.14 0.00 -1.00 0.00 0.00 55.97 54.55 1bil s LYS 186 Cb 0.15 0.39 0.01 0.00 -2.06 0.00 0.00 37.83 36.32 1bil s LYS 186 CO 0.83 -0.34 1.09 0.99 0.10 0.00 0.00 175.35 178.02 1bil s THR 187 N -2.58 3.40 0.00 3.79 2.01 -1.26 -3.91 115.64 117.09 1bil s THR 187 Ca 0.02 0.59 0.00 0.00 0.31 0.00 0.00 61.69 62.61 1bil s THR 187 Cb -0.01 -3.12 0.00 0.00 0.01 0.00 0.00 72.50 69.38 1bil s THR 187 CO -0.05 -0.46 0.00 0.61 -0.69 0.00 0.00 174.62 174.02 1bil n GLY 188 N -0.85 2.53 3.14 4.40 0.00 -1.26 -5.05 105.19 108.09 1bil n GLY 188 Ca 0.10 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.00 1bil n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bil s VAL 189 N -2.41 -0.03 -1.10 1.61 0.11 -1.25 -4.26 120.40 113.07 1bil s VAL 189 Ca 0.00 0.12 -0.15 0.00 -2.93 0.00 0.00 61.98 59.02 1bil s VAL 189 Cb 0.00 -0.46 -0.07 0.00 -1.53 0.00 0.00 36.38 34.32 1bil s VAL 189 CO 0.00 0.05 2.18 0.79 -3.33 0.00 0.00 175.10 174.79 1bil n TRP 190 N 4.15 2.30 -4.28 1.54 7.02 -1.26 -4.76 117.44 122.15 1bil n TRP 190 Ca -0.24 -2.33 -0.23 0.00 -1.02 0.00 0.00 57.50 53.68 1bil n TRP 190 Cb 0.54 -2.04 -0.12 0.00 -2.42 0.00 0.00 31.31 27.27 1bil n TRP 190 CO 0.00 0.00 0.00 -1.14 -2.02 0.00 0.00 177.69 174.53 1bil s GLN 191 N 3.80 1.11 0.14 -0.99 0.74 -1.26 -1.33 119.66 121.88 1bil s GLN 191 Ca 0.52 -1.18 -0.05 0.00 0.05 0.00 0.00 55.36 54.71 1bil s GLN 191 Cb 0.14 -1.32 -0.02 0.00 1.10 0.00 0.00 33.01 32.91 1bil s GLN 191 CO 0.01 0.30 0.17 0.96 -0.55 0.00 0.00 175.29 176.17 1bil s ILE 192 N -1.32 0.09 0.14 -2.34 -4.36 0.19 -2.59 121.20 111.01 1bil s ILE 192 Ca 0.07 -1.64 -0.30 0.00 -0.26 0.00 0.00 60.65 58.51 1bil s ILE 192 Cb -0.09 -1.92 -0.07 0.00 1.25 0.00 0.00 42.46 41.63 1bil s ILE 192 CO 0.04 -0.40 1.08 -1.58 0.24 0.00 0.00 174.94 174.33 1bil s GLN 193 N -4.00 4.59 -0.07 0.37 2.00 -1.26 -0.55 119.66 120.73 1bil s GLN 193 Ca 0.20 1.66 0.02 0.00 -2.00 0.00 0.00 55.36 55.24 1bil s GLN 193 Cb 0.05 -3.31 0.01 0.00 0.80 0.00 0.00 33.01 30.56 1bil s GLN 193 CO 0.00 0.05 -0.13 1.41 -0.50 0.00 0.00 175.29 176.12 1bil s MET 194 N -0.04 1.83 -0.86 1.67 -2.45 0.36 -4.44 119.30 115.37 1bil s MET 194 Ca 0.50 -0.45 -0.01 0.00 -1.25 0.00 0.00 55.69 54.48 1bil s MET 194 Cb -0.28 -1.50 0.21 0.00 1.25 0.00 0.00 34.83 34.51 1bil s MET 194 CO 0.33 0.03 0.73 0.15 1.05 0.00 0.00 175.02 177.30 1bil s LYS 195 N 0.68 3.14 0.00 4.11 3.01 -0.16 0.19 119.74 130.72 1bil s LYS 195 Ca -0.14 -3.26 0.00 0.00 -1.01 0.00 0.00 55.97 51.56 1bil s LYS 195 Cb -0.16 -3.88 0.00 0.00 -1.01 0.00 0.00 37.83 32.78 1bil s LYS 195 CO 0.04 -1.26 0.00 0.41 0.51 0.00 0.00 175.35 175.04 1bil n GLY 196 N 2.33 1.73 2.81 -3.33 0.00 -0.30 -4.50 105.19 103.93 1bil n GLY 196 Ca 0.21 -1.68 -0.19 0.00 0.00 0.00 0.00 46.02 44.36 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 -2.02 0.24 -0.10 1.61 1.01 0.11 -1.81 120.40 119.44 1bil s VAL 197 Ca 0.00 0.09 -0.00 0.00 0.00 0.00 0.00 61.98 62.07 1bil s VAL 197 Cb 0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 36.38 36.00 1bil s VAL 197 CO 0.00 0.18 -0.07 -0.44 0.00 0.00 0.00 175.10 174.77 1bil s SER 198 N 1.27 4.56 -0.14 3.32 0.01 0.12 -1.79 113.70 121.05 1bil s SER 198 Ca -0.06 -0.11 -0.04 0.00 1.31 0.00 0.00 55.95 57.05 1bil s SER 198 Cb -0.13 -1.40 -0.03 0.00 0.21 0.00 0.00 66.02 64.67 1bil s SER 198 CO -0.02 0.28 0.01 -0.69 0.41 0.00 0.00 173.24 173.23 1bil s VAL 199 N -0.29 4.36 0.00 3.43 1.01 -1.07 -0.36 120.40 127.47 1bil s VAL 199 Ca 0.04 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.82 1bil s VAL 199 Cb -0.13 -2.90 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1bil s VAL 199 CO 0.02 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.26 1bil n GLY 200 N 2.97 0.72 0.64 4.51 0.00 0.44 -2.86 105.19 111.61 1bil n GLY 200 Ca -0.18 0.48 -0.03 0.00 0.00 0.00 0.00 46.02 46.29 1bil n GLY 200 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1bil n SER 201 N 7.97 1.26 -4.64 1.61 3.41 -1.26 -4.73 113.62 117.23 1bil n SER 201 Ca 0.00 0.02 -0.43 0.00 -0.26 0.00 0.00 58.87 58.21 1bil n SER 201 Cb 0.00 -0.08 -0.02 0.00 -0.26 0.00 0.00 64.21 63.84 1bil n SER 201 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1bil s SER 202 N -5.01 6.63 -0.52 4.04 1.04 -1.13 -4.91 113.70 113.84 1bil s SER 202 Ca -0.05 1.64 -0.27 0.00 0.48 0.00 0.00 55.95 57.76 1bil s SER 202 Cb 0.02 -2.54 -0.26 0.00 0.10 0.00 0.00 66.02 63.34 1bil s SER 202 CO 0.06 -1.04 1.81 0.41 0.98 0.00 0.00 173.24 175.46 1bil n THR 203 N 5.96 0.82 -0.24 2.02 -1.04 -1.26 -2.60 114.28 117.93 1bil n THR 203 Ca 0.16 -0.75 0.09 0.00 -2.04 0.00 0.00 64.05 61.51 1bil n THR 203 Cb 0.45 -2.13 0.35 0.00 -1.82 0.00 0.00 70.33 67.19 1bil n THR 203 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1bil h LEU 204 N 17.13 0.69 -8.45 -4.42 -0.00 -1.85 -3.44 115.31 114.96 1bil h LEU 204 Ca 0.28 0.02 -0.21 0.00 -0.00 0.00 0.00 57.88 57.97 1bil h LEU 204 Cb 0.75 -0.12 -0.15 0.00 -0.00 0.00 0.00 40.66 41.14 1bil h LEU 204 CO 1.80 0.40 -0.67 -0.76 -0.00 0.00 0.00 178.44 179.21 1bil s LEU 205 N -9.79 2.21 -1.33 1.67 1.43 -0.74 -4.85 118.68 107.28 1bil s LEU 205 Ca -0.10 -1.10 -0.04 0.00 -1.03 0.00 0.00 54.13 51.86 1bil s LEU 205 Cb 0.21 0.09 0.00 0.00 0.03 0.00 0.00 46.19 46.52 1bil s LEU 205 CO 0.78 -0.59 0.56 0.00 0.23 0.00 0.00 176.35 177.34 1bil s GLU 207 N -5.58 2.26 0.00 0.00 1.03 -1.26 -1.15 118.70 114.00 1bil s GLU 207 Ca 0.28 1.43 0.00 0.00 0.03 0.00 0.00 54.97 56.71 1bil s GLU 207 Cb -0.12 -1.88 0.00 0.00 -0.80 0.00 0.00 34.13 31.33 1bil s GLU 207 CO 0.35 -1.68 0.00 -0.25 -1.33 0.00 0.00 175.26 172.35 1bil n ASP 208 N -3.04 0.00 0.00 0.83 8.00 -1.26 -4.80 116.55 116.28 1bil n ASP 208 Ca 0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.61 1bil n ASP 208 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 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 0.00 3.61 3.70 0.44 0.00 -1.03 -4.97 105.19 106.94 1bil n GLY 209 Ca 0.00 -1.76 -0.09 0.00 0.00 0.00 0.00 46.02 44.17 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 3.74 -0.04 0.00 1.43 -1.26 0.14 118.68 122.68 1bil s LEU 211 Ca 0.17 -0.05 -0.01 0.00 -1.03 0.00 0.00 54.13 53.21 1bil s LEU 211 Cb -0.05 -2.43 0.03 0.00 0.03 0.00 0.00 46.19 43.78 1bil s LEU 211 CO 0.12 0.17 0.02 0.00 0.23 0.00 0.00 176.35 176.90 1bil s ALA 212 N -1.38 0.38 -0.08 4.21 0.00 0.29 -1.60 121.76 123.57 1bil s ALA 212 Ca 0.29 0.10 -0.16 0.00 0.00 0.00 0.00 51.96 52.19 1bil s ALA 212 Cb -0.12 -0.54 -0.05 0.00 0.00 0.00 0.00 23.12 22.41 1bil s ALA 212 CO 0.21 -0.33 0.40 -1.17 0.00 0.00 0.00 175.76 174.87 1bil s LEU 213 N 1.70 4.35 -0.45 0.00 2.96 0.37 -0.64 118.68 126.96 1bil s LEU 213 Ca -0.00 0.79 -0.16 0.00 -0.22 0.00 0.00 54.13 54.54 1bil s LEU 213 Cb -0.13 -2.56 0.05 0.00 0.50 0.00 0.00 46.19 44.06 1bil s LEU 213 CO -0.03 0.16 0.39 -0.69 -1.32 0.00 0.00 176.35 174.85 1bil s VAL 214 N -0.11 5.21 -0.25 1.68 1.01 -0.44 0.52 120.40 128.01 1bil s VAL 214 Ca 0.23 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 61.34 1bil s VAL 214 Cb -0.15 -4.08 0.07 0.00 0.00 0.00 0.00 36.38 32.22 1bil s VAL 214 CO 0.10 -0.51 0.00 -0.62 0.00 0.00 0.00 175.10 174.07 1bil s ASP 215 N 2.29 3.78 0.49 3.32 2.15 -0.96 -4.65 116.67 123.09 1bil s ASP 215 Ca 0.06 -1.28 0.32 0.00 0.43 0.00 0.00 52.55 52.08 1bil s ASP 215 Cb -0.22 -1.04 1.36 0.00 -0.30 0.00 0.00 42.92 42.71 1bil s ASP 215 CO 0.08 -0.30 1.94 0.71 -0.17 0.00 0.00 175.17 177.44 1bil h THR 216 N 6.60 0.00 -0.19 1.71 1.35 -1.85 -3.04 112.91 117.49 1bil h THR 216 Ca -0.15 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 1bil h THR 216 Cb 1.07 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 68.81 1bil h THR 216 CO 0.42 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.30 1bil n GLY 217 N -0.08 1.55 2.97 5.82 0.00 -1.26 -4.68 105.19 109.51 1bil n GLY 217 Ca 0.01 -0.28 -0.28 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.58 1.57 0.18 4.61 0.00 -1.15 -5.03 121.76 120.36 1bil s ALA 218 Ca 0.17 -0.70 -0.11 0.00 0.00 0.00 0.00 51.96 51.32 1bil s ALA 218 Cb 0.12 -0.94 0.10 0.00 0.00 0.00 0.00 23.12 22.40 1bil s ALA 218 CO 0.06 -0.34 1.75 0.77 0.00 0.00 0.00 175.76 178.01 1bil h SER 219 N 7.98 0.88 -1.64 0.00 0.02 -1.87 1.00 113.55 119.92 1bil h SER 219 Ca -0.33 -0.16 -0.51 0.00 -0.84 0.00 0.00 61.79 59.95 1bil h SER 219 Cb 1.14 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 63.40 1bil h SER 219 CO 0.47 0.80 -0.43 -0.31 -1.14 0.00 0.00 176.83 176.21 1bil s TYR 220 N -5.61 2.73 0.25 3.45 1.51 -1.26 -2.41 117.35 116.00 1bil s TYR 220 Ca -0.13 -0.46 -0.17 0.00 -1.01 0.00 0.00 57.07 55.31 1bil s TYR 220 Cb 0.14 -1.99 -0.08 0.00 -0.11 0.00 0.00 41.96 39.91 1bil s TYR 220 CO 0.80 0.05 0.70 0.42 -1.11 0.00 0.00 175.55 176.42 1bil s ILE 221 N -2.46 4.66 0.00 2.71 1.01 -1.10 -2.64 121.20 123.39 1bil s ILE 221 Ca 0.44 1.06 0.01 0.00 0.00 0.00 0.00 60.65 62.16 1bil s ILE 221 Cb -0.02 -3.74 -0.01 0.00 0.01 0.00 0.00 42.46 38.70 1bil s ILE 221 CO 0.26 0.05 -0.03 -0.94 0.00 0.00 0.00 174.94 174.28 1bil s SER 222 N -1.93 0.29 0.44 3.58 1.04 -0.57 -1.14 113.70 115.41 1bil s SER 222 Ca 0.47 -0.13 0.03 0.00 0.48 0.00 0.00 55.95 56.80 1bil s SER 222 Cb -0.14 -0.01 -0.02 0.00 0.10 0.00 0.00 66.02 65.95 1bil s SER 222 CO 0.19 -0.03 0.09 -0.83 0.98 0.00 0.00 173.24 173.64 1bil s GLY 223 N -0.32 2.76 1.07 7.32 0.00 -0.96 -1.04 107.32 116.15 1bil s GLY 223 Ca -0.02 -0.96 -0.12 0.00 0.00 0.00 0.00 44.72 43.62 1bil s GLY 223 CO -0.00 -1.96 1.06 -1.35 0.00 0.00 0.00 173.10 170.85 1bil s SER 224 N -3.70 1.79 0.20 1.64 1.04 -1.26 -1.24 113.70 112.17 1bil s SER 224 Ca 0.18 1.57 -0.08 0.00 0.48 0.00 0.00 55.95 58.09 1bil s SER 224 Cb 0.02 -2.27 0.13 0.00 0.10 0.00 0.00 66.02 64.00 1bil s SER 224 CO 0.11 -3.71 1.74 0.74 0.98 0.00 0.00 173.24 173.10 1bil h THR 225 N -2.28 1.26 -0.14 2.02 2.02 -1.93 -0.08 112.91 113.78 1bil h THR 225 Ca -0.56 -0.90 -0.12 0.00 0.77 0.00 0.00 66.41 65.60 1bil h THR 225 Cb 1.32 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 68.17 1bil h THR 225 CO 0.50 0.36 -0.42 0.77 0.37 0.00 0.00 175.52 177.10 1bil h SER 226 N 1.09 0.34 -0.03 4.18 4.64 -1.99 -0.71 113.55 121.08 1bil h SER 226 Ca 0.24 -0.15 -0.01 0.00 -0.47 0.00 0.00 61.79 61.40 1bil h SER 226 Cb 0.30 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1bil h SER 226 CO -0.01 0.73 -0.02 0.28 -0.87 0.00 0.00 176.83 176.94 1bil h SER 227 N 0.27 0.06 0.16 4.97 0.02 -1.86 -2.36 113.55 114.81 1bil h SER 227 Ca 0.02 -0.48 -0.02 0.00 -0.84 0.00 0.00 61.79 60.48 1bil h SER 227 Cb 0.86 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.38 1bil h SER 227 CO 0.07 0.53 -0.10 0.40 -1.14 0.00 0.00 176.83 176.59 1bil h ILE 228 N -0.40 0.81 0.07 3.27 1.08 -0.91 0.10 117.51 121.54 1bil h ILE 228 Ca 0.00 -0.36 -0.00 0.00 -0.39 0.00 0.00 64.86 64.11 1bil h ILE 228 Cb 0.51 1.21 0.00 0.00 -3.07 0.00 0.00 36.82 35.47 1bil h ILE 228 CO 0.01 0.09 -0.04 -0.08 -0.69 0.00 0.00 178.15 177.44 1bil h GLU 229 N 0.00 -0.10 0.70 2.37 4.22 -1.06 0.42 114.58 121.14 1bil h GLU 229 Ca -0.00 0.01 -0.03 0.00 0.08 0.00 0.00 59.36 59.41 1bil h GLU 229 Cb 0.20 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1bil h GLU 229 CO 0.01 0.11 -0.37 0.87 -2.18 0.00 0.00 179.01 177.45 1bil h LYS 230 N -0.29 -0.96 -0.54 1.92 1.57 -0.71 -2.54 116.57 115.03 1bil h LYS 230 Ca -0.01 0.07 0.09 0.00 -1.87 0.00 0.00 60.65 58.93 1bil h LYS 230 Cb 0.25 0.22 -0.11 0.00 0.08 0.00 0.00 32.23 32.67 1bil h LYS 230 CO 0.02 -0.64 -0.36 1.25 -0.57 0.00 0.00 179.45 179.15 1bil h LEU 231 N -0.99 -1.23 -1.34 2.94 5.85 -0.64 0.30 115.31 120.21 1bil h LEU 231 Ca -0.09 0.22 0.11 0.00 0.84 0.00 0.00 57.88 58.96 1bil h LEU 231 Cb 0.78 0.59 -0.06 0.00 0.37 0.00 0.00 40.66 42.34 1bil h LEU 231 CO 0.13 -0.32 0.54 0.24 -0.34 0.00 0.00 178.44 178.69 1bil h MET 232 N -0.21 0.69 -0.44 1.25 2.86 -0.12 0.18 114.93 119.15 1bil h MET 232 Ca 0.20 -0.04 -0.12 0.00 -2.06 0.00 0.00 59.70 57.68 1bil h MET 232 Cb 0.55 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 1bil h MET 232 CO -0.65 0.45 -0.19 1.49 1.06 0.00 0.00 176.91 179.08 1bil h GLU 233 N 0.71 0.91 0.00 1.72 4.22 0.01 0.57 114.58 122.71 1bil h GLU 233 Ca 0.39 -0.39 0.02 0.00 0.08 0.00 0.00 59.36 59.47 1bil h GLU 233 Cb 0.55 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 1bil h GLU 233 CO -0.16 1.04 -0.15 0.00 -2.18 0.00 0.00 179.01 177.56 1bil h ALA 234 N 0.84 -0.18 0.00 2.92 0.00 -0.01 -1.26 119.26 121.57 1bil h ALA 234 Ca 0.10 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1bil h ALA 234 Cb 0.75 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1bil h ALA 234 CO 0.06 -0.65 0.00 1.28 0.00 0.00 0.00 179.25 179.94 1bil n LEU 235 N -5.29 0.00 -2.79 0.00 4.77 -0.46 -4.86 117.00 108.38 1bil n LEU 235 Ca -0.05 0.06 -0.21 0.00 -0.03 0.00 0.00 56.01 55.78 1bil n LEU 235 Cb 0.20 -0.06 0.02 0.00 -2.33 0.00 0.00 43.42 41.25 1bil n LEU 235 CO 0.26 -0.03 -0.06 0.61 -1.33 0.00 0.00 177.39 176.84 1bil n GLY 236 N 0.09 -0.48 3.87 -0.72 0.00 0.08 -4.96 105.19 103.07 1bil n GLY 236 Ca 0.12 0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 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 -3.13 3.29 -0.14 4.61 0.00 -0.56 -4.90 121.76 120.94 1bil s ALA 237 Ca 0.23 -0.14 0.02 0.00 0.00 0.00 0.00 51.96 52.07 1bil s ALA 237 Cb -0.10 -2.79 0.01 0.00 0.00 0.00 0.00 23.12 20.24 1bil s ALA 237 CO 0.28 -0.10 -0.19 0.21 0.00 0.00 0.00 175.76 175.96 1bil s LYS 238 N -3.98 2.72 -0.52 0.00 2.20 0.31 -4.73 119.74 115.73 1bil s LYS 238 Ca 0.53 -0.74 -0.27 0.00 -0.36 0.00 0.00 55.97 55.12 1bil s LYS 238 Cb -0.10 -2.26 -0.02 0.00 -1.51 0.00 0.00 37.83 33.93 1bil s LYS 238 CO 0.33 -0.07 1.86 0.21 -0.36 0.00 0.00 175.35 177.32 1bil s LYS 239 N 0.97 2.82 0.00 4.03 2.47 -1.26 -1.30 119.74 127.47 1bil s LYS 239 Ca -0.05 0.88 0.00 0.00 -1.56 0.00 0.00 55.97 55.24 1bil s LYS 239 Cb -0.15 -4.33 0.00 0.00 -1.46 0.00 0.00 37.83 31.89 1bil s LYS 239 CO -0.04 -2.49 0.00 0.54 0.16 0.00 0.00 175.35 173.52 1bil n ARG 240 N 8.93 1.01 0.00 4.03 1.74 0.18 -4.96 116.66 127.59 1bil n ARG 240 Ca 0.22 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.30 1bil n ARG 240 Cb 0.51 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.95 1bil n ARG 240 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1bil n LEU 242 N 0.00 0.00 -0.57 0.55 7.94 -1.26 -3.49 117.00 120.17 1bil n LEU 242 Ca 0.00 1.00 0.05 0.00 -1.11 0.00 0.00 56.01 55.95 1bil n LEU 242 Cb 0.00 -0.50 0.14 0.00 0.53 0.00 0.00 43.42 43.59 1bil n LEU 242 CO 0.00 -0.50 0.62 0.49 -1.11 0.00 0.00 177.39 176.89 1bil n PHE 243 N -2.65 0.45 -4.03 1.96 3.72 -1.26 -5.03 117.46 110.63 1bil n PHE 243 Ca 0.00 -0.56 -0.11 0.00 -0.05 0.00 0.00 57.45 56.73 1bil n PHE 243 Cb 0.00 -0.07 -0.04 0.00 -0.94 0.00 0.00 39.48 38.43 1bil n PHE 243 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 1bil s ASP 244 N -1.16 0.30 -0.00 4.37 -4.77 -1.23 -4.98 116.67 109.20 1bil s ASP 244 Ca 0.23 -1.18 0.03 0.00 -3.30 0.00 0.00 52.55 48.32 1bil s ASP 244 Cb 0.14 0.63 -0.03 0.00 -1.09 0.00 0.00 42.92 42.56 1bil s ASP 244 CO 0.12 -1.23 -0.05 -0.31 0.70 0.00 0.00 175.17 174.40 1bil s TYR 245 N -3.52 2.93 0.22 2.11 2.02 -1.26 0.47 117.35 120.32 1bil s TYR 245 Ca 0.26 -0.01 -0.00 0.00 -0.37 0.00 0.00 57.07 56.95 1bil s TYR 245 Cb -0.01 -1.63 -0.04 0.00 -0.40 0.00 0.00 41.96 39.88 1bil s TYR 245 CO 0.14 0.39 0.12 0.14 -1.57 0.00 0.00 175.55 174.76 1bil s VAL 246 N -1.01 0.18 -0.02 0.71 -7.23 -0.42 -2.60 120.40 110.02 1bil s VAL 246 Ca 0.17 -2.00 -0.18 0.00 -1.81 0.00 0.00 61.98 58.16 1bil s VAL 246 Cb -0.11 -2.53 0.03 0.00 0.56 0.00 0.00 36.38 34.33 1bil s VAL 246 CO 0.08 -0.01 0.39 0.54 -0.31 0.00 0.00 175.10 175.79 1bil s VAL 247 N -4.03 0.05 0.10 1.32 0.11 -0.53 -0.53 120.40 116.89 1bil s VAL 247 Ca 0.38 -0.38 -0.31 0.00 -2.93 0.00 0.00 61.98 58.75 1bil s VAL 247 Cb 0.07 -0.72 -0.10 0.00 -1.53 0.00 0.00 36.38 34.10 1bil s VAL 247 CO 0.12 -0.21 1.81 -0.54 -3.33 0.00 0.00 175.10 172.96 1bil s LYS 248 N -1.39 4.15 0.35 1.54 1.02 -1.26 0.11 119.74 124.25 1bil s LYS 248 Ca -0.12 2.55 0.15 0.00 0.02 0.00 0.00 55.97 58.57 1bil s LYS 248 Cb -0.04 -3.67 1.13 0.00 -0.52 0.00 0.00 37.83 34.74 1bil s LYS 248 CO 0.05 -0.84 1.64 0.00 -0.92 0.00 0.00 175.35 175.28 1bil h ASN 250 N 0.23 0.51 0.17 0.00 -1.07 -1.78 -1.42 115.58 112.22 1bil h ASN 250 Ca 0.75 -0.14 -0.03 0.00 0.07 0.00 0.00 56.30 56.96 1bil h ASN 250 Cb 1.79 -0.14 -0.00 0.00 -2.07 0.00 0.00 38.32 37.90 1bil h ASN 250 CO -0.66 0.67 -0.14 -0.33 0.07 0.00 0.00 177.43 177.04 1bil h GLU 251 N 0.48 0.00 -0.61 4.14 5.08 -0.82 -3.36 114.58 119.50 1bil h GLU 251 Ca 0.09 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.50 1bil h GLU 251 Cb 0.52 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.69 1bil h GLU 251 CO 0.03 0.14 -0.36 0.41 -1.00 0.00 0.00 179.01 178.23 1bil n GLY 252 N -1.06 -2.50 0.00 -3.84 0.00 -0.53 -2.55 105.19 94.71 1bil n GLY 252 Ca -0.02 0.90 0.02 0.00 0.00 0.00 0.00 46.02 46.91 1bil n GLY 252 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1bil n PRO 253 N -4.40 0.26 0.00 1.61 -0.02 -1.26 -2.62 135.00 128.57 1bil n PRO 253 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 1bil n PRO 253 Cb 0.16 -1.22 0.00 0.00 -0.02 0.00 0.00 33.50 32.41 1bil n PRO 253 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1bil n THR 254 N -0.72 0.00 -1.58 3.45 -2.24 -1.06 -4.95 114.28 107.18 1bil n THR 254 Ca 0.03 -0.33 -0.37 0.00 -2.27 0.00 0.00 64.05 61.11 1bil n THR 254 Cb 0.01 1.35 0.05 0.00 -2.10 0.00 0.00 70.33 69.64 1bil n THR 254 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1bil n LEU 255 N -0.00 3.33 -4.90 3.22 4.32 -1.08 -4.94 117.00 116.96 1bil n LEU 255 Ca 0.00 0.78 -0.29 0.00 -0.02 0.00 0.00 56.01 56.48 1bil n LEU 255 Cb 0.09 -1.36 0.03 0.00 -1.62 0.00 0.00 43.42 40.56 1bil n LEU 255 CO 0.00 -2.06 0.65 -2.16 -1.22 0.00 0.00 177.39 172.60 1bil s PRO 256 N -2.73 2.99 0.69 3.23 0.04 -1.26 -4.35 135.00 133.61 1bil s PRO 256 Ca 0.75 0.30 -0.14 0.00 0.04 0.00 0.00 61.00 61.95 1bil s PRO 256 Cb -0.41 -2.14 0.02 0.00 0.04 0.00 0.00 34.50 32.01 1bil s PRO 256 CO 0.48 -0.82 1.12 -0.51 0.04 0.00 0.00 177.00 177.30 1bil s ASP 257 N -4.31 4.85 -0.08 6.66 1.01 -1.26 -4.52 116.67 119.03 1bil s ASP 257 Ca 0.56 2.02 0.03 0.00 0.71 0.00 0.00 52.55 55.86 1bil s ASP 257 Cb -0.11 -2.55 0.01 0.00 1.01 0.00 0.00 42.92 41.28 1bil s ASP 257 CO 0.49 -1.80 -0.16 -0.63 0.21 0.00 0.00 175.17 173.27 1bil s ILE 258 N -2.40 1.46 0.07 0.77 1.01 -0.68 -0.42 121.20 121.01 1bil s ILE 258 Ca 0.67 -0.67 0.10 0.00 0.00 0.00 0.00 60.65 60.75 1bil s ILE 258 Cb -0.21 -1.30 -0.03 0.00 0.01 0.00 0.00 42.46 40.93 1bil s ILE 258 CO 0.45 0.43 -0.27 -0.44 0.00 0.00 0.00 174.94 175.11 1bil s SER 259 N 0.56 3.20 -0.24 3.58 0.01 0.51 -0.83 113.70 120.49 1bil s SER 259 Ca -0.16 -0.64 -0.01 0.00 1.31 0.00 0.00 55.95 56.45 1bil s SER 259 Cb -0.17 -0.27 0.02 0.00 0.21 0.00 0.00 66.02 65.82 1bil s SER 259 CO 0.05 0.23 -0.08 -0.36 0.41 0.00 0.00 173.24 173.50 1bil s PHE 260 N -0.88 3.03 -0.60 2.43 0.08 0.88 -0.71 117.98 122.20 1bil s PHE 260 Ca 0.12 -1.52 -0.20 0.00 0.12 0.00 0.00 56.93 55.46 1bil s PHE 260 Cb -0.10 -2.04 0.09 0.00 -0.57 0.00 0.00 43.02 40.40 1bil s PHE 260 CO 0.03 -0.72 0.76 -1.58 -0.10 0.00 0.00 175.22 173.61 1bil s HIS 261 N 1.33 2.92 -0.08 0.36 5.65 -0.75 0.14 115.29 124.87 1bil s HIS 261 Ca 0.01 -0.84 0.03 0.00 0.25 0.00 0.00 55.06 54.51 1bil s HIS 261 Cb -0.16 -4.05 0.01 0.00 -1.18 0.00 0.00 32.58 27.20 1bil s HIS 261 CO -0.05 -1.36 -0.16 -0.51 -0.65 0.00 0.00 174.74 172.01 1bil s LEU 262 N 3.00 1.78 -1.23 8.88 1.43 -0.56 -0.99 118.68 131.00 1bil s LEU 262 Ca 0.14 -0.38 -0.03 0.00 -1.03 0.00 0.00 54.13 52.83 1bil s LEU 262 Cb -0.22 -1.02 0.02 0.00 0.03 0.00 0.00 46.19 45.00 1bil s LEU 262 CO 0.07 0.07 0.20 0.61 0.23 0.00 0.00 176.35 177.54 1bil n GLY 263 N 3.75 -0.50 1.89 -3.19 0.00 -1.26 -0.66 105.19 105.22 1bil n GLY 263 Ca -0.21 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.01 2.24 3.91 -0.02 0.00 -1.26 -5.01 105.19 104.04 1bil n GLY 264 Ca -0.11 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.70 1bil n GLY 264 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bil s LYS 265 N -0.44 2.92 -0.14 1.61 2.20 0.17 -5.10 119.74 120.96 1bil s LYS 265 Ca 0.00 -1.15 -0.00 0.00 -0.36 0.00 0.00 55.97 54.46 1bil s LYS 265 Cb 0.00 -2.63 -0.01 0.00 -1.51 0.00 0.00 37.83 33.68 1bil s LYS 265 CO 0.00 0.12 -0.13 -2.00 -0.36 0.00 0.00 175.35 172.98 1bil s GLU 266 N -4.05 3.35 -0.33 4.03 2.12 -1.26 -1.49 118.70 121.07 1bil s GLU 266 Ca 0.42 -0.69 -0.08 0.00 0.36 0.00 0.00 54.97 54.97 1bil s GLU 266 Cb -0.07 -2.65 0.02 0.00 0.26 0.00 0.00 34.13 31.69 1bil s GLU 266 CO 0.28 0.15 0.12 0.71 -0.54 0.00 0.00 175.26 175.99 1bil s TYR 267 N 0.50 3.21 -0.11 5.30 2.02 0.12 -4.93 117.35 123.46 1bil s TYR 267 Ca -0.09 -1.09 -0.01 0.00 -0.37 0.00 0.00 57.07 55.51 1bil s TYR 267 Cb -0.16 -2.31 -0.02 0.00 -0.40 0.00 0.00 41.96 39.07 1bil s TYR 267 CO 0.04 -0.63 -0.08 0.99 -1.57 0.00 0.00 175.55 174.30 1bil s THR 268 N 1.49 3.55 -0.13 -0.71 2.01 -1.26 -0.09 115.64 120.50 1bil s THR 268 Ca 0.01 -0.50 -0.01 0.00 0.31 0.00 0.00 61.69 61.50 1bil s THR 268 Cb -0.18 -2.49 -0.02 0.00 0.01 0.00 0.00 72.50 69.81 1bil s THR 268 CO 0.04 0.54 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.64 1bil s LEU 269 N -0.09 2.86 0.37 4.42 1.43 -0.01 -4.98 118.68 122.68 1bil s LEU 269 Ca 0.00 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 1bil s LEU 269 Cb -0.13 -1.65 -0.02 0.00 0.03 0.00 0.00 46.19 44.41 1bil s LEU 269 CO 0.03 0.18 0.57 -0.89 0.23 0.00 0.00 176.35 176.47 1bil s THR 270 N 0.25 4.64 0.34 5.49 2.01 -1.26 -1.69 115.64 125.42 1bil s THR 270 Ca -0.07 -0.57 0.15 0.00 0.31 0.00 0.00 61.69 61.50 1bil s THR 270 Cb -0.15 -3.69 0.34 0.00 0.01 0.00 0.00 72.50 69.01 1bil s THR 270 CO 0.05 -0.43 1.64 -1.28 -0.69 0.00 0.00 174.62 173.91 1bil h SER 271 N 0.68 0.39 -0.35 3.53 0.87 -1.79 0.21 113.55 117.09 1bil h SER 271 Ca -0.48 0.21 0.04 0.00 -1.23 0.00 0.00 61.79 60.33 1bil h SER 271 Cb 1.23 0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 63.37 1bil h SER 271 CO 0.59 -0.22 0.23 0.00 -0.53 0.00 0.00 176.83 176.90 1bil h ALA 272 N 1.89 1.93 0.00 6.23 0.00 -1.89 -1.82 119.26 125.61 1bil h ALA 272 Ca 0.75 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.60 1bil h ALA 272 Cb 1.77 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 1bil h ALA 272 CO -0.66 0.01 -0.18 -0.44 0.00 0.00 0.00 179.25 177.98 1bil h ASP 273 N 0.31 0.00 0.00 0.00 3.32 -0.94 -3.38 116.42 115.73 1bil h ASP 273 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1bil h ASP 273 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 1bil h ASP 273 CO -0.03 0.18 0.00 0.00 -1.72 0.00 0.00 179.24 177.67 1bil n TYR 274 N -3.18 0.00 -4.63 4.55 0.18 -1.00 -4.93 117.16 108.14 1bil n TYR 274 Ca 0.02 -0.09 -0.33 0.00 1.88 0.00 0.00 57.90 59.38 1bil n TYR 274 Cb 0.55 -0.01 -0.14 0.00 -0.38 0.00 0.00 39.34 39.36 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 -0.18 3.18 -1.06 -3.48 1.01 -0.72 -0.04 120.40 119.10 1bil s VAL 275 Ca 0.00 -0.61 -0.21 0.00 0.00 0.00 0.00 61.98 61.16 1bil s VAL 275 Cb 0.00 -2.35 0.07 0.00 0.00 0.00 0.00 36.38 34.10 1bil s VAL 275 CO 0.00 0.51 1.46 -0.36 0.00 0.00 0.00 175.10 176.71 1bil s PHE 276 N 0.47 2.69 -1.16 5.22 0.08 0.12 -4.86 117.98 120.54 1bil s PHE 276 Ca -0.08 -1.10 -0.20 0.00 0.12 0.00 0.00 56.93 55.67 1bil s PHE 276 Cb -0.15 -4.64 -0.04 0.00 -0.57 0.00 0.00 43.02 37.61 1bil s PHE 276 CO 0.04 -1.84 1.94 0.94 -0.10 0.00 0.00 175.22 176.20 1bil n GLN 277 N 8.38 2.21 -0.08 0.44 -0.06 -1.26 -4.28 117.38 122.73 1bil n GLN 277 Ca 0.35 -2.53 0.07 0.00 -2.00 0.00 0.00 57.00 52.88 1bil n GLN 277 Cb 0.50 -3.37 0.27 0.00 -4.06 0.00 0.00 30.24 23.57 1bil n GLN 277 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 1bil n GLU 278 N 7.56 1.48 0.00 3.69 4.71 -1.26 -4.92 120.64 131.89 1bil n GLU 278 Ca 0.49 -0.73 0.00 0.00 -0.01 0.00 0.00 57.16 56.91 1bil n GLU 278 Cb 0.43 -1.26 0.00 0.00 -1.01 0.00 0.00 31.44 29.60 1bil n GLU 278 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 1bil n SER 279 N 0.02 0.00 -4.05 1.62 2.88 -1.26 -5.17 113.62 107.66 1bil n SER 279 Ca 0.11 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.31 1bil n SER 279 Cb 0.21 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.57 1bil n SER 279 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1bil s TYR 279 N -2.00 3.53 0.00 0.66 2.02 -1.26 -4.54 117.35 115.76 1bil s TYR 279 Ca 0.00 -2.98 0.00 0.00 -0.37 0.00 0.00 57.07 53.72 1bil s TYR 279 Cb 0.00 -3.08 0.00 0.00 -0.40 0.00 0.00 41.96 38.48 1bil s TYR 279 CO 0.00 -0.75 0.00 0.43 -1.57 0.00 0.00 175.55 173.66 1bil n SER 279 N 2.85 2.14 -1.63 2.29 7.64 -1.26 -3.09 113.62 122.55 1bil n SER 279 Ca 0.13 -0.19 0.03 0.00 1.01 0.00 0.00 58.87 59.84 1bil n SER 279 Cb 0.36 0.81 0.33 0.00 -1.01 0.00 0.00 64.21 64.70 1bil n SER 279 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1bil n LYS 279 N -1.03 3.84 -3.93 1.43 4.01 -1.26 -4.79 118.16 116.43 1bil n LYS 279 Ca 0.00 -3.07 -0.10 0.00 -0.51 0.00 0.00 58.31 54.63 1bil n LYS 279 Cb 0.00 -2.12 -0.10 0.00 -0.51 0.00 0.00 35.03 32.30 1bil n LYS 279 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1bil s LYS 280 N -2.89 0.40 -0.12 1.97 -0.14 -1.26 -5.08 119.74 112.63 1bil s LYS 280 Ca 0.51 -0.53 -0.05 0.00 -1.36 0.00 0.00 55.97 54.55 1bil s LYS 280 Cb 0.41 0.16 -0.04 0.00 -1.68 0.00 0.00 37.83 36.68 1bil s LYS 280 CO 0.12 -0.08 0.07 -0.51 -0.76 0.00 0.00 175.35 174.19 1bil s LEU 281 N -1.46 3.98 -0.08 3.17 1.43 -1.26 -1.07 118.68 123.38 1bil s LEU 281 Ca -0.15 0.28 0.03 0.00 -1.03 0.00 0.00 54.13 53.26 1bil s LEU 281 Cb -0.08 -1.95 -0.02 0.00 0.03 0.00 0.00 46.19 44.17 1bil s LEU 281 CO -0.00 0.36 -0.18 0.00 0.23 0.00 0.00 176.35 176.76 1bil s THR 283 N -0.16 3.35 0.02 0.00 2.01 -1.26 -1.45 115.64 118.16 1bil s THR 283 Ca -0.02 1.21 -0.18 0.00 0.31 0.00 0.00 61.69 63.00 1bil s THR 283 Cb -0.14 -3.77 -0.06 0.00 0.01 0.00 0.00 72.50 68.54 1bil s THR 283 CO 0.04 0.23 0.53 -0.76 -0.69 0.00 0.00 174.62 173.96 1bil s LEU 284 N -0.71 4.47 -0.38 4.42 1.43 -1.07 0.14 118.68 126.98 1bil s LEU 284 Ca 0.51 1.14 -0.04 0.00 -1.03 0.00 0.00 54.13 54.71 1bil s LEU 284 Cb -0.34 -2.81 0.02 0.00 0.03 0.00 0.00 46.19 43.08 1bil s LEU 284 CO 0.40 0.23 2.86 0.00 0.23 0.00 0.00 176.35 180.07 1bil n ALA 285 N 2.11 6.37 -3.13 4.21 0.00 0.94 -4.66 120.51 126.35 1bil n ALA 285 Ca -0.10 -2.78 -0.12 0.00 0.00 0.00 0.00 53.44 50.43 1bil n ALA 285 Cb 0.51 -2.13 -0.11 0.00 0.00 0.00 0.00 19.45 17.73 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 -1.75 0.04 0.29 0.00 1.01 -1.26 -2.70 121.20 116.82 1bil s ILE 286 Ca 0.58 -0.33 -0.19 0.00 0.00 0.00 0.00 60.65 60.71 1bil s ILE 286 Cb 0.37 -0.41 0.06 0.00 0.01 0.00 0.00 42.46 42.49 1bil s ILE 286 CO -0.18 -0.18 0.89 -1.38 0.00 0.00 0.00 174.94 174.09 1bil s HIS 287 N -0.67 0.07 0.11 3.97 -3.43 -0.29 -4.51 115.29 110.54 1bil s HIS 287 Ca -0.08 -0.61 -0.13 0.00 -0.80 0.00 0.00 55.06 53.44 1bil s HIS 287 Cb -0.04 0.77 -0.06 0.00 -1.43 0.00 0.00 32.58 31.81 1bil s HIS 287 CO 0.01 -1.27 0.50 0.00 -2.00 0.00 0.00 174.74 171.98 1bil s ALA 288 N -2.38 3.63 -0.27 -1.38 0.00 -1.26 -2.26 121.76 117.85 1bil s ALA 288 Ca 0.18 -0.20 -0.07 0.00 0.00 0.00 0.00 51.96 51.87 1bil s ALA 288 Cb -0.04 -2.44 0.13 0.00 0.00 0.00 0.00 23.12 20.77 1bil s ALA 288 CO 0.08 0.49 0.55 1.41 0.00 0.00 0.00 175.76 178.29 1bil s MET 289 N -1.85 0.48 -0.59 0.00 0.00 -0.37 -4.90 119.30 112.07 1bil s MET 289 Ca 0.35 1.16 -0.21 0.00 0.00 0.00 0.00 55.69 56.99 1bil s MET 289 Cb -0.15 0.52 0.08 0.00 0.00 0.00 0.00 34.83 35.28 1bil s MET 289 CO 0.18 -0.34 0.79 -0.51 0.00 0.00 0.00 175.02 175.14 1bil s ASP 290 N 2.77 6.20 -0.22 1.11 1.01 -1.26 -4.17 116.67 122.12 1bil s ASP 290 Ca 0.02 -1.09 -0.23 0.00 0.71 0.00 0.00 52.55 51.97 1bil s ASP 290 Cb -0.13 -2.35 -0.02 0.00 1.01 0.00 0.00 42.92 41.44 1bil s ASP 290 CO -0.17 -1.18 0.73 -0.63 0.21 0.00 0.00 175.17 174.13 1bil s ILE 291 N 3.20 4.93 0.64 0.77 1.01 -1.26 -5.05 121.20 125.45 1bil s ILE 291 Ca 0.17 1.37 -0.16 0.00 0.00 0.00 0.00 60.65 62.03 1bil s ILE 291 Cb -0.20 -4.03 -0.01 0.00 0.01 0.00 0.00 42.46 38.23 1bil s ILE 291 CO 0.10 0.02 1.12 -2.16 0.00 0.00 0.00 174.94 174.02 1bil s PRO 292 N 2.38 2.87 0.55 2.79 0.04 -1.26 -3.12 135.00 139.25 1bil s PRO 292 Ca 0.32 1.45 -0.20 0.00 0.04 0.00 0.00 61.00 62.60 1bil s PRO 292 Cb -0.16 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.38 1bil s PRO 292 CO 0.09 -1.21 1.25 -2.14 0.04 0.00 0.00 177.00 175.03 1bil s PRO 293 N -3.93 3.16 0.08 0.56 0.02 -1.14 -1.19 135.00 132.56 1bil s PRO 293 Ca 0.68 1.95 -0.16 0.00 0.02 0.00 0.00 61.00 63.49 1bil s PRO 293 Cb -0.22 -2.12 -0.11 0.00 0.02 0.00 0.00 34.50 32.08 1bil s PRO 293 CO 0.39 -1.09 1.38 -1.35 -0.33 0.00 0.00 177.00 176.01 1bil h PRO 294 N 1.28 0.64 0.13 5.54 0.11 -2.03 -3.44 132.00 134.23 1bil h PRO 294 Ca -0.50 -0.36 0.01 0.00 0.11 0.00 0.00 66.00 65.26 1bil h PRO 294 Cb 1.29 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.40 1bil h PRO 294 CO 0.57 0.97 -0.23 1.15 -0.21 0.00 0.00 178.00 180.26 1bil h THR 295 N 0.35 0.50 -2.65 -1.15 2.02 -1.91 -3.44 112.91 106.63 1bil h THR 295 Ca 0.03 0.00 -0.46 0.00 0.77 0.00 0.00 66.41 66.75 1bil h THR 295 Cb 0.89 0.50 0.10 0.00 -1.74 0.00 0.00 68.15 67.90 1bil h THR 295 CO 0.07 0.00 0.18 -0.83 0.37 0.00 0.00 175.52 175.31 1bil s GLY 296 N -2.39 1.76 0.38 2.16 0.00 -0.33 -4.57 107.32 104.33 1bil s GLY 296 Ca -0.15 -1.56 -0.26 0.00 0.00 0.00 0.00 44.72 42.74 1bil s GLY 296 CO 0.65 -0.97 1.16 2.56 0.00 0.00 0.00 173.10 176.51 1bil s PRO 297 N -5.30 4.17 0.26 2.90 0.05 -1.18 -2.90 135.00 133.00 1bil s PRO 297 Ca 0.67 1.84 -0.14 0.00 0.05 0.00 0.00 61.00 63.43 1bil s PRO 297 Cb -0.05 -2.77 0.00 0.00 0.05 0.00 0.00 34.50 31.72 1bil s PRO 297 CO 0.46 -0.22 0.53 0.99 0.05 0.00 0.00 177.00 178.81 1bil s THR 298 N -1.37 0.00 0.25 1.26 2.01 -1.26 -4.74 115.64 111.79 1bil s THR 298 Ca 0.55 -1.33 -0.01 0.00 0.31 0.00 0.00 61.69 61.21 1bil s THR 298 Cb -0.31 -2.20 -0.04 0.00 0.01 0.00 0.00 72.50 69.96 1bil s THR 298 CO 0.39 0.00 0.45 0.26 -0.69 0.00 0.00 174.62 175.04 1bil s TRP 299 N -3.93 3.48 -0.10 4.92 0.52 -0.63 -4.14 118.94 119.07 1bil s TRP 299 Ca 0.20 0.36 0.00 0.00 0.02 0.00 0.00 56.10 56.69 1bil s TRP 299 Cb -0.02 -1.88 0.02 0.00 -1.15 0.00 0.00 33.47 30.44 1bil s TRP 299 CO 0.09 0.29 -0.09 0.00 0.02 0.00 0.00 176.95 177.26 1bil s ALA 300 N -2.02 1.30 -0.50 0.98 0.00 -0.21 -0.48 121.76 120.83 1bil s ALA 300 Ca 0.39 -0.51 -0.21 0.00 0.00 0.00 0.00 51.96 51.64 1bil s ALA 300 Cb -0.10 -0.83 0.04 0.00 0.00 0.00 0.00 23.12 22.23 1bil s ALA 300 CO 0.31 -0.29 0.71 -0.51 0.00 0.00 0.00 175.76 175.98 1bil s LEU 301 N 1.46 4.61 0.00 0.00 1.43 0.18 -1.52 118.68 124.85 1bil s LEU 301 Ca 0.00 -0.60 0.00 0.00 -1.03 0.00 0.00 54.13 52.50 1bil s LEU 301 Cb -0.13 -2.63 0.00 0.00 0.03 0.00 0.00 46.19 43.46 1bil s LEU 301 CO -0.05 -0.94 0.00 0.61 0.23 0.00 0.00 176.35 176.19 1bil n GLY 302 N 5.12 0.17 0.41 -3.19 0.00 -1.08 -2.27 105.19 104.35 1bil n GLY 302 Ca -0.03 -1.80 0.23 0.00 0.00 0.00 0.00 46.02 44.42 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 -1.48 2.33 -0.52 4.61 0.00 0.13 -2.35 119.26 121.98 1bil h ALA 303 Ca 0.00 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1bil h ALA 303 Cb 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1bil h ALA 303 CO 0.00 -0.83 0.35 1.15 0.00 0.00 0.00 179.25 179.91 1bil h THR 304 N 0.00 1.10 0.00 0.00 2.02 -1.72 -2.05 112.91 112.26 1bil h THR 304 Ca 0.27 -0.22 -0.18 0.00 0.77 0.00 0.00 66.41 67.04 1bil h THR 304 Cb 1.35 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 68.12 1bil h THR 304 CO -0.00 0.12 -1.11 0.33 0.37 0.00 0.00 175.52 175.23 1bil n PHE 305 N -4.46 0.98 -0.26 3.16 -0.00 -0.90 -4.23 117.46 111.75 1bil n PHE 305 Ca 0.05 0.42 0.25 0.00 -0.00 0.00 0.00 57.45 58.18 1bil n PHE 305 Cb 0.09 -1.02 0.61 0.00 -0.00 0.00 0.00 39.48 39.16 1bil n PHE 305 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 1bil h ILE 306 N -1.00 0.56 -0.70 -2.13 1.08 -1.55 0.14 117.51 113.91 1bil h ILE 306 Ca -0.27 -0.08 0.05 0.00 -0.39 0.00 0.00 64.86 64.17 1bil h ILE 306 Cb 1.12 0.32 -0.04 0.00 -3.07 0.00 0.00 36.82 35.15 1bil h ILE 306 CO -0.17 0.04 0.46 0.03 -0.69 0.00 0.00 178.15 177.82 1bil h ARG 307 N 0.22 0.74 0.00 2.37 3.08 -1.54 -2.29 114.38 116.96 1bil h ARG 307 Ca 0.51 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 60.43 1bil h ARG 307 Cb 1.59 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.45 1bil h ARG 307 CO -0.13 0.49 -1.54 1.17 -1.07 0.00 0.00 179.97 178.89 1bil n LYS 308 N -4.47 0.63 -3.93 0.04 4.81 0.38 -4.78 118.16 110.85 1bil n LYS 308 Ca 0.10 0.04 -0.30 0.00 -0.87 0.00 0.00 58.31 57.27 1bil n LYS 308 Cb 0.19 -1.70 -0.15 0.00 0.02 0.00 0.00 35.03 33.38 1bil n LYS 308 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 1bil s PHE 309 N -3.22 2.49 0.19 5.64 0.08 -0.63 -1.29 117.98 121.24 1bil s PHE 309 Ca -0.04 -1.89 -0.33 0.00 0.12 0.00 0.00 56.93 54.79 1bil s PHE 309 Cb 0.10 -1.73 -0.15 0.00 -0.57 0.00 0.00 43.02 40.68 1bil s PHE 309 CO 0.84 -0.80 1.35 0.98 -0.10 0.00 0.00 175.22 177.48 1bil n TYR 310 N 4.64 1.84 -5.04 0.36 4.19 0.86 -4.41 117.16 119.60 1bil n TYR 310 Ca -0.10 0.51 -0.32 0.00 3.31 0.00 0.00 57.90 61.30 1bil n TYR 310 Cb 0.44 -2.40 -0.16 0.00 0.49 0.00 0.00 39.34 37.70 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 0.11 2.40 -0.22 2.97 2.01 -0.80 -1.67 115.64 120.42 1bil s THR 311 Ca 0.73 -0.90 -0.04 0.00 0.31 0.00 0.00 61.69 61.79 1bil s THR 311 Cb -0.75 -1.95 -0.01 0.00 0.01 0.00 0.00 72.50 69.80 1bil s THR 311 CO 0.48 0.55 -0.03 -0.70 -0.69 0.00 0.00 174.62 174.23 1bil s GLU 312 N 0.37 3.41 -0.39 4.92 2.12 -0.62 0.04 118.70 128.55 1bil s GLU 312 Ca -0.16 -0.61 -0.14 0.00 0.36 0.00 0.00 54.97 54.43 1bil s GLU 312 Cb -0.17 -3.04 0.01 0.00 0.26 0.00 0.00 34.13 31.18 1bil s GLU 312 CO 0.07 -0.19 0.28 -0.06 -0.54 0.00 0.00 175.26 174.82 1bil s PHE 313 N 1.48 3.24 -0.41 5.30 0.08 0.56 -1.70 117.98 126.53 1bil s PHE 313 Ca 0.06 -0.51 -0.08 0.00 0.12 0.00 0.00 56.93 56.52 1bil s PHE 313 Cb -0.14 -2.55 0.08 0.00 -0.57 0.00 0.00 43.02 39.84 1bil s PHE 313 CO -0.02 -0.53 0.24 0.34 -0.10 0.00 0.00 175.22 175.14 1bil s ASP 314 N 1.68 5.54 -0.06 1.36 -1.08 0.05 -1.06 116.67 123.09 1bil s ASP 314 Ca 0.05 -1.56 -0.26 0.00 -0.52 0.00 0.00 52.55 50.26 1bil s ASP 314 Cb -0.19 -1.95 -0.21 0.00 -1.46 0.00 0.00 42.92 39.12 1bil s ASP 314 CO 0.10 -0.52 1.04 0.03 0.52 0.00 0.00 175.17 176.34 1bil h ARG 315 N 8.33 -0.04 -0.82 4.34 2.47 -0.75 -1.00 114.38 126.91 1bil h ARG 315 Ca -0.21 0.00 0.11 0.00 -1.26 0.00 0.00 59.98 58.62 1bil h ARG 315 Cb 1.08 0.01 -0.12 0.00 -1.65 0.00 0.00 29.97 29.28 1bil h ARG 315 CO 0.74 0.59 -0.37 0.54 0.56 0.00 0.00 179.97 182.02 1bil n ARG 316 N -4.80 -0.24 -0.58 0.04 5.12 -1.09 -0.64 116.66 114.47 1bil n ARG 316 Ca -0.09 1.26 0.06 0.00 -1.93 0.00 0.00 57.85 57.15 1bil n ARG 316 Cb 0.32 -1.86 0.28 0.00 -1.16 0.00 0.00 32.46 30.04 1bil n ARG 316 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1bil n ASN 317 N -5.15 4.08 -3.67 0.55 4.13 -1.25 -5.00 115.26 108.95 1bil n ASN 317 Ca 0.06 -3.09 -0.26 0.00 1.68 0.00 0.00 54.58 52.97 1bil n ASN 317 Cb 0.29 -0.59 0.02 0.00 -1.54 0.00 0.00 39.78 37.96 1bil n ASN 317 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1bil n ASN 318 N -0.40 -5.44 -3.72 6.41 4.13 0.19 -4.90 115.26 111.52 1bil n ASN 318 Ca 0.25 -0.88 -0.09 0.00 1.68 0.00 0.00 54.58 55.54 1bil n ASN 318 Cb 0.99 -2.88 -0.02 0.00 -1.54 0.00 0.00 39.78 36.32 1bil n ASN 318 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1bil s ARG 319 N -5.31 1.60 -0.10 3.52 1.04 -0.67 -2.66 118.95 116.38 1bil s ARG 319 Ca 0.23 -0.83 0.04 0.00 -1.04 0.00 0.00 55.73 54.13 1bil s ARG 319 Cb -0.10 0.59 -0.00 0.00 -2.04 0.00 0.00 34.95 33.41 1bil s ARG 319 CO 0.87 -0.72 -0.23 0.42 -0.04 0.00 0.00 175.30 175.60 1bil s ILE 320 N -3.87 2.14 -0.07 4.99 1.01 -0.58 -0.77 121.20 124.05 1bil s ILE 320 Ca 0.08 -1.00 0.05 0.00 0.00 0.00 0.00 60.65 59.78 1bil s ILE 320 Cb -0.04 -1.81 -0.01 0.00 0.01 0.00 0.00 42.46 40.60 1bil s ILE 320 CO 0.00 0.56 -0.21 -0.83 0.00 0.00 0.00 174.94 174.46 1bil s GLY 321 N 0.28 1.38 0.03 6.18 0.00 -0.69 0.10 107.32 114.60 1bil s GLY 321 Ca -0.17 -1.01 0.05 0.00 0.00 0.00 0.00 44.72 43.59 1bil s GLY 321 CO 0.08 -0.61 -0.10 -1.36 0.00 0.00 0.00 173.10 171.11 1bil s PHE 322 N -0.22 2.78 0.14 1.90 0.08 -0.67 -1.59 117.98 120.40 1bil s PHE 322 Ca -0.01 -0.11 0.02 0.00 0.12 0.00 0.00 56.93 56.94 1bil s PHE 322 Cb -0.13 -1.55 -0.04 0.00 -0.57 0.00 0.00 43.02 40.73 1bil s PHE 322 CO 0.03 0.35 -0.03 0.00 -0.10 0.00 0.00 175.22 175.46 1bil s ALA 323 N -1.01 1.19 -0.38 5.36 0.00 -0.67 -2.42 121.76 123.82 1bil s ALA 323 Ca 0.17 -1.48 -0.29 0.00 0.00 0.00 0.00 51.96 50.37 1bil s ALA 323 Cb -0.11 0.35 0.00 0.00 0.00 0.00 0.00 23.12 23.36 1bil s ALA 323 CO 0.08 -0.27 1.54 -1.17 0.00 0.00 0.00 175.76 175.94 1bil s LEU 324 N -3.12 3.56 0.73 0.00 0.20 -1.24 -0.09 118.68 118.72 1bil s LEU 324 Ca 0.18 0.99 -0.14 0.00 0.69 0.00 0.00 54.13 55.85 1bil s LEU 324 Cb 0.05 -3.54 0.04 0.00 -0.43 0.00 0.00 46.19 42.32 1bil s LEU 324 CO -0.00 -1.52 1.15 0.00 -0.29 0.00 0.00 176.35 175.68 1bil s ALA 325 N 5.90 2.20 0.00 5.97 0.00 -0.41 -1.29 121.76 134.12 1bil s ALA 325 Ca 0.67 0.63 0.00 0.00 0.00 0.00 0.00 51.96 53.26 1bil s ALA 325 Cb -0.17 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.57 1bil s ALA 325 CO 0.33 -1.74 0.00 2.89 0.00 0.00 0.00 175.76 177.24