#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oz8 s SER 2 N 0.00 6.21 0.11 -1.43 0.01 -1.26 -4.45 113.70 112.89 2oz8 s SER 2 Ca 0.00 0.95 -0.31 0.00 1.31 0.00 0.00 55.95 57.90 2oz8 s SER 2 Cb 0.00 -2.22 -0.08 0.00 0.21 0.00 0.00 66.02 63.93 2oz8 s SER 2 CO 0.00 -0.63 1.43 -0.76 0.41 0.00 0.00 173.24 173.69 2oz8 s LEU 3 N -4.79 4.36 -0.07 2.44 1.43 -0.39 0.17 118.68 121.84 2oz8 s LEU 3 Ca 0.48 2.36 -0.00 0.00 -1.03 0.00 0.00 54.13 55.93 2oz8 s LEU 3 Cb -0.10 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.49 2oz8 s LEU 3 CO 0.46 -0.70 -0.07 -1.54 0.23 0.00 0.00 176.35 174.73 2oz8 n SER 4 N 4.18 2.78 -3.85 2.29 3.41 0.22 -1.26 113.62 121.39 2oz8 n SER 4 Ca 0.12 -0.01 -0.09 0.00 -0.26 0.00 0.00 58.87 58.63 2oz8 n SER 4 Cb 0.42 -0.13 -0.07 0.00 -0.26 0.00 0.00 64.21 64.17 2oz8 n SER 4 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 2oz8 s HIS 5 N -2.13 0.16 0.22 7.33 -3.43 -1.15 -4.95 115.29 111.34 2oz8 s HIS 5 Ca -0.09 -0.55 0.11 0.00 -0.80 0.00 0.00 55.06 53.73 2oz8 s HIS 5 Cb 0.03 0.01 -0.05 0.00 -1.43 0.00 0.00 32.58 31.14 2oz8 s HIS 5 CO 0.14 -0.64 -0.21 -0.59 -2.00 0.00 0.00 174.74 171.45 2oz8 s PHE 6 N -3.88 2.20 -0.02 0.38 -0.12 -1.26 -0.79 117.98 114.48 2oz8 s PHE 6 Ca 0.08 -0.37 0.00 0.00 -0.05 0.00 0.00 56.93 56.59 2oz8 s PHE 6 Cb 0.04 -1.04 0.02 0.00 -0.63 0.00 0.00 43.02 41.42 2oz8 s PHE 6 CO -0.08 0.55 0.00 0.50 -0.05 0.00 0.00 175.22 176.15 2oz8 s ARG 7 N -3.05 0.23 -0.19 1.99 3.52 0.18 -4.96 118.95 116.67 2oz8 s ARG 7 Ca 0.24 0.07 -0.01 0.00 -0.13 0.00 0.00 55.73 55.89 2oz8 s ARG 7 Cb -0.06 -0.40 0.00 0.00 -1.56 0.00 0.00 34.95 32.93 2oz8 s ARG 7 CO 0.11 -0.11 -0.12 0.42 -0.81 0.00 0.00 175.30 174.79 2oz8 s ILE 8 N 0.87 2.80 -0.23 4.11 -1.09 -1.26 -0.98 121.20 125.42 2oz8 s ILE 8 Ca -0.08 -0.70 -0.01 0.00 -2.23 0.00 0.00 60.65 57.62 2oz8 s ILE 8 Cb -0.12 -2.22 0.02 0.00 -1.58 0.00 0.00 42.46 38.56 2oz8 s ILE 8 CO -0.02 0.49 -0.09 -0.89 -1.23 0.00 0.00 174.94 173.20 2oz8 s THR 9 N 1.18 2.79 -0.02 2.92 2.01 -0.53 -4.95 115.64 119.05 2oz8 s THR 9 Ca 0.02 -0.91 -0.22 0.00 0.31 0.00 0.00 61.69 60.89 2oz8 s THR 9 Cb -0.14 -2.34 -0.05 0.00 0.01 0.00 0.00 72.50 69.98 2oz8 s THR 9 CO -0.05 0.31 0.64 -0.60 -0.69 0.00 0.00 174.62 174.24 2oz8 s ARG 10 N 1.34 4.38 0.08 4.92 3.52 -1.26 -0.76 118.95 131.17 2oz8 s ARG 10 Ca 0.02 0.81 0.09 0.00 -0.13 0.00 0.00 55.73 56.52 2oz8 s ARG 10 Cb -0.15 -3.38 -0.03 0.00 -1.56 0.00 0.00 34.95 29.82 2oz8 s ARG 10 CO -0.06 0.26 -0.25 -0.06 -0.81 0.00 0.00 175.30 174.38 2oz8 s PHE 11 N 0.16 2.13 -0.28 5.12 0.08 0.12 0.17 117.98 125.49 2oz8 s PHE 11 Ca 0.34 -0.40 0.01 0.00 0.12 0.00 0.00 56.93 57.00 2oz8 s PHE 11 Cb -0.18 -1.23 0.17 0.00 -0.57 0.00 0.00 43.02 41.21 2oz8 s PHE 11 CO 0.18 0.19 0.50 -1.14 -0.10 0.00 0.00 175.22 174.84 2oz8 s GLN 12 N -1.54 0.47 0.05 0.44 0.74 -1.26 -2.21 119.66 116.35 2oz8 s GLN 12 Ca 0.11 0.61 -0.04 0.00 0.05 0.00 0.00 55.36 56.08 2oz8 s GLN 12 Cb -0.10 0.03 -0.02 0.00 1.10 0.00 0.00 33.01 34.03 2oz8 s GLN 12 CO 0.03 -0.80 0.07 -0.59 -0.55 0.00 0.00 175.29 173.45 2oz8 s PHE 13 N 2.70 0.30 0.46 1.67 -0.12 -0.84 -4.96 117.98 117.18 2oz8 s PHE 13 Ca 0.14 -0.71 -0.23 0.00 -0.05 0.00 0.00 56.93 56.09 2oz8 s PHE 13 Cb -0.14 -0.21 -0.08 0.00 -0.63 0.00 0.00 43.02 41.97 2oz8 s PHE 13 CO -0.22 -0.40 1.15 0.00 -0.05 0.00 0.00 175.22 175.70 2oz8 s ALA 14 N -3.22 2.98 0.55 1.99 0.00 -1.26 -0.47 121.76 122.32 2oz8 s ALA 14 Ca 0.00 0.90 -0.07 0.00 0.00 0.00 0.00 51.96 52.80 2oz8 s ALA 14 Cb 0.03 -3.37 -0.02 0.00 0.00 0.00 0.00 23.12 19.76 2oz8 s ALA 14 CO -0.07 -0.61 0.87 1.03 0.00 0.00 0.00 175.76 176.98 2oz8 s ARG 15 N -2.70 3.31 0.23 0.00 0.52 0.96 -4.07 118.95 117.20 2oz8 s ARG 15 Ca 0.63 0.23 0.26 0.00 -0.52 0.00 0.00 55.73 56.33 2oz8 s ARG 15 Cb -0.28 -2.28 0.83 0.00 0.52 0.00 0.00 34.95 33.74 2oz8 s ARG 15 CO 0.33 -0.46 1.77 -0.40 0.02 0.00 0.00 175.30 176.56 2oz8 n ASP 16 N -2.48 0.82 -3.74 0.23 5.75 -1.26 -4.71 116.55 111.16 2oz8 n ASP 16 Ca 0.03 0.59 -0.10 0.00 -0.01 0.00 0.00 54.79 55.31 2oz8 n ASP 16 Cb 0.56 -0.81 -0.05 0.00 -1.03 0.00 0.00 41.12 39.79 2oz8 n ASP 16 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2oz8 s ARG 17 N -3.14 1.15 0.15 0.11 1.70 -1.26 -5.13 118.95 112.53 2oz8 s ARG 17 Ca 0.10 -0.86 -0.30 0.00 -0.47 0.00 0.00 55.73 54.19 2oz8 s ARG 17 Cb 0.12 0.46 -0.07 0.00 -0.57 0.00 0.00 34.95 34.88 2oz8 s ARG 17 CO 0.57 -0.45 1.18 0.08 -1.08 0.00 0.00 175.30 175.59 2oz8 s VAL 18 N -3.86 3.77 0.20 4.99 1.01 -1.26 -4.76 120.40 120.48 2oz8 s VAL 18 Ca 0.07 1.42 0.08 0.00 0.00 0.00 0.00 61.98 63.55 2oz8 s VAL 18 Cb 0.02 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.45 2oz8 s VAL 18 CO -0.07 0.20 0.02 0.27 0.00 0.00 0.00 175.10 175.52 2oz8 s ILE 19 N 0.24 3.76 -4.78 2.22 -4.36 -0.40 -4.61 121.20 113.27 2oz8 s ILE 19 Ca 0.54 -1.50 0.00 0.00 -0.26 0.00 0.00 60.65 59.43 2oz8 s ILE 19 Cb -0.31 -2.92 0.00 0.00 1.25 0.00 0.00 42.46 40.47 2oz8 s ILE 19 CO 0.34 -0.18 0.00 0.61 0.24 0.00 0.00 174.94 175.95 2oz8 n GLY 20 N -0.36 -0.91 0.00 6.27 0.00 -0.08 -1.32 105.19 108.80 2oz8 n GLY 20 Ca -0.09 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.78 2oz8 n GLY 20 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2oz8 n ASP 21 N 1.33 0.00 0.12 1.61 5.68 -0.20 -3.20 116.55 121.88 2oz8 n ASP 21 Ca 0.00 -0.99 0.10 0.00 -0.50 0.00 0.00 54.79 53.40 2oz8 n ASP 21 Cb 0.00 0.00 0.47 0.00 -1.14 0.00 0.00 41.12 40.45 2oz8 n ASP 21 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2oz8 n SER 22 N -1.63 0.50 -0.00 -1.12 3.41 -1.26 -2.35 113.62 111.17 2oz8 n SER 22 Ca 0.00 0.68 0.02 0.00 -0.26 0.00 0.00 58.87 59.31 2oz8 n SER 22 Cb 0.00 -0.76 -0.02 0.00 -0.26 0.00 0.00 64.21 63.16 2oz8 n SER 22 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2oz8 n GLN 23 N -2.11 1.72 -3.91 4.33 1.13 -1.26 -5.03 117.38 112.24 2oz8 n GLN 23 Ca 0.00 -0.02 -0.10 0.00 -1.94 0.00 0.00 57.00 54.94 2oz8 n GLN 23 Cb 0.11 -0.96 -0.10 0.00 0.11 0.00 0.00 30.24 29.40 2oz8 n GLN 23 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2oz8 s VAL 24 N -1.97 0.09 -0.00 5.09 1.01 -0.99 -5.16 120.40 118.46 2oz8 s VAL 24 Ca -0.01 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.27 2oz8 s VAL 24 Cb 0.02 -0.35 -0.01 0.00 0.00 0.00 0.00 36.38 36.05 2oz8 s VAL 24 CO 0.13 -0.40 -0.06 -0.60 0.00 0.00 0.00 175.10 174.17 2oz8 s ARG 25 N -1.31 0.51 -0.17 2.72 3.52 -1.26 -1.04 118.95 121.93 2oz8 s ARG 25 Ca -0.14 -0.24 -0.09 0.00 -0.13 0.00 0.00 55.73 55.13 2oz8 s ARG 25 Cb -0.08 -0.49 0.06 0.00 -1.56 0.00 0.00 34.95 32.88 2oz8 s ARG 25 CO 0.01 0.13 0.41 0.00 -0.81 0.00 0.00 175.30 175.04 2oz8 s ALA 26 N -0.17 -1.04 -0.59 6.12 0.00 -0.44 -5.00 121.76 120.64 2oz8 s ALA 26 Ca 0.02 1.52 0.07 0.00 0.00 0.00 0.00 51.96 53.57 2oz8 s ALA 26 Cb -0.03 -0.93 0.19 0.00 0.00 0.00 0.00 23.12 22.35 2oz8 s ALA 26 CO -0.00 -0.27 1.15 -0.40 0.00 0.00 0.00 175.76 176.23 2oz8 n ASP 27 N 4.28 2.55 -4.28 0.00 5.68 -1.26 -1.27 116.55 122.24 2oz8 n ASP 27 Ca -0.23 -1.98 -0.18 0.00 -0.50 0.00 0.00 54.79 51.90 2oz8 n ASP 27 Cb 0.55 -0.14 -0.10 0.00 -1.14 0.00 0.00 41.12 40.29 2oz8 n ASP 27 CO 0.00 0.00 0.00 1.51 -1.33 0.00 0.00 177.20 177.38 2oz8 s ASP 28 N -0.99 1.52 -0.05 -1.12 1.47 -1.26 -0.03 116.67 116.22 2oz8 s ASP 28 Ca 0.14 -1.42 0.02 0.00 1.18 0.00 0.00 52.55 52.47 2oz8 s ASP 28 Cb 0.07 0.17 0.01 0.00 -0.34 0.00 0.00 42.92 42.83 2oz8 s ASP 28 CO 0.10 -0.74 -0.11 -0.69 0.68 0.00 0.00 175.17 174.40 2oz8 s VAL 29 N -3.63 1.02 -0.23 2.11 1.01 0.39 -4.78 120.40 116.29 2oz8 s VAL 29 Ca 0.37 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.92 2oz8 s VAL 29 Cb 0.07 -0.93 0.05 0.00 0.00 0.00 0.00 36.38 35.58 2oz8 s VAL 29 CO 0.15 0.32 -0.08 0.20 0.00 0.00 0.00 175.10 175.69 2oz8 s ASN 30 N 0.49 3.84 -0.21 3.32 0.01 -1.26 -2.00 114.94 119.13 2oz8 s ASN 30 Ca -0.10 -1.14 -0.19 0.00 -0.71 0.00 0.00 52.86 50.72 2oz8 s ASN 30 Cb -0.13 -1.27 0.06 0.00 0.41 0.00 0.00 41.25 40.31 2oz8 s ASN 30 CO 0.02 -0.20 0.56 0.54 -1.51 0.00 0.00 177.10 176.51 2oz8 s VAL 31 N 1.34 -0.00 -0.03 1.60 0.11 -0.94 -1.73 120.40 120.74 2oz8 s VAL 31 Ca -0.05 0.00 0.05 0.00 -2.93 0.00 0.00 61.98 59.05 2oz8 s VAL 31 Cb -0.18 -0.78 -0.01 0.00 -1.53 0.00 0.00 36.38 33.88 2oz8 s VAL 31 CO -0.07 0.00 -0.17 0.00 -3.33 0.00 0.00 175.10 171.54 2oz8 s ALA 32 N 0.36 1.46 0.07 1.54 0.00 -0.44 0.14 121.76 124.89 2oz8 s ALA 32 Ca -0.01 -0.70 -0.26 0.00 0.00 0.00 0.00 51.96 51.00 2oz8 s ALA 32 Cb -0.04 -0.44 -0.06 0.00 0.00 0.00 0.00 23.12 22.58 2oz8 s ALA 32 CO -0.00 0.30 0.81 0.00 0.00 0.00 0.00 175.76 176.86 2oz8 s ALA 33 N -0.13 3.35 -0.21 0.00 0.00 0.06 -0.48 121.76 124.36 2oz8 s ALA 33 Ca 0.00 0.35 -0.02 0.00 0.00 0.00 0.00 51.96 52.29 2oz8 s ALA 33 Cb -0.09 -3.05 -0.00 0.00 0.00 0.00 0.00 23.12 19.98 2oz8 s ALA 33 CO 0.01 0.07 -0.09 -1.17 0.00 0.00 0.00 175.76 174.59 2oz8 s LEU 34 N -0.18 2.69 -0.14 0.00 2.96 0.11 -1.45 118.68 122.67 2oz8 s LEU 34 Ca 0.40 -0.45 0.01 0.00 -0.22 0.00 0.00 54.13 53.86 2oz8 s LEU 34 Cb -0.21 -1.67 -0.00 0.00 0.50 0.00 0.00 46.19 44.81 2oz8 s LEU 34 CO 0.25 -0.01 -0.17 -1.61 -1.32 0.00 0.00 176.35 173.49 2oz8 s GLU 35 N 1.38 3.19 -0.24 1.98 2.02 -0.15 -1.20 118.70 125.69 2oz8 s GLU 35 Ca 0.05 -0.77 -0.04 0.00 0.02 0.00 0.00 54.97 54.23 2oz8 s GLU 35 Cb -0.14 -2.55 -0.00 0.00 0.10 0.00 0.00 34.13 31.53 2oz8 s GLU 35 CO -0.05 0.07 -0.02 -0.51 0.02 0.00 0.00 175.26 174.76 2oz8 s LEU 36 N 0.68 3.09 -0.19 1.80 1.43 0.89 -0.65 118.68 125.73 2oz8 s LEU 36 Ca -0.08 -0.51 -0.07 0.00 -1.03 0.00 0.00 54.13 52.44 2oz8 s LEU 36 Cb -0.16 -1.75 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 2oz8 s LEU 36 CO 0.02 -0.06 0.05 -0.69 0.23 0.00 0.00 176.35 175.90 2oz8 s VAL 37 N 1.46 4.58 0.63 -1.59 1.01 0.03 -0.27 120.40 126.25 2oz8 s VAL 37 Ca 0.04 -0.10 0.03 0.00 0.00 0.00 0.00 61.98 61.95 2oz8 s VAL 37 Cb -0.15 -3.07 0.09 0.00 0.00 0.00 0.00 36.38 33.25 2oz8 s VAL 37 CO -0.02 0.44 0.87 -0.94 0.00 0.00 0.00 175.10 175.44 2oz8 s SER 38 N 0.64 4.80 0.00 3.32 1.04 -0.39 -0.61 113.70 122.51 2oz8 s SER 38 Ca 0.03 -0.45 0.30 0.00 0.48 0.00 0.00 55.95 56.30 2oz8 s SER 38 Cb -0.13 -0.11 1.39 0.00 0.10 0.00 0.00 66.02 67.27 2oz8 s SER 38 CO 0.02 -1.52 2.00 -1.84 0.98 0.00 0.00 173.24 172.87 2oz8 n GLU 39 N -2.51 0.26 0.00 4.02 0.28 0.13 -2.17 120.64 120.65 2oz8 n GLU 39 Ca 0.14 -0.01 0.12 0.00 -0.16 0.00 0.00 57.16 57.25 2oz8 n GLU 39 Cb 0.61 -1.50 0.58 0.00 1.43 0.00 0.00 31.44 32.55 2oz8 n GLU 39 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 2oz8 n SER 40 N -1.36 0.00 0.00 -1.84 3.41 -1.26 -4.84 113.62 107.72 2oz8 n SER 40 Ca 0.11 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.82 2oz8 n SER 40 Cb 0.28 -0.34 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 2oz8 n SER 40 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2oz8 n GLY 41 N 0.81 1.16 3.77 5.00 0.00 -0.92 -5.05 105.19 109.96 2oz8 n GLY 41 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 2oz8 n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oz8 s GLU 42 N -0.70 3.96 -0.05 1.61 0.41 -1.26 -4.78 118.70 117.89 2oz8 s GLU 42 Ca 0.00 1.68 0.05 0.00 -0.41 0.00 0.00 54.97 56.30 2oz8 s GLU 42 Cb 0.00 -2.50 -0.01 0.00 -1.78 0.00 0.00 34.13 29.84 2oz8 s GLU 42 CO 0.00 -0.36 -0.21 0.08 -0.49 0.00 0.00 175.26 174.27 2oz8 s VAL 43 N -1.57 1.76 -0.11 2.63 1.01 -1.26 -1.26 120.40 121.61 2oz8 s VAL 43 Ca 0.60 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.63 2oz8 s VAL 43 Cb -0.26 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 2oz8 s VAL 43 CO 0.33 0.50 0.06 -0.83 0.00 0.00 0.00 175.10 175.15 2oz8 s GLY 44 N -0.13 1.96 -0.07 4.51 0.00 0.62 -4.51 107.32 109.71 2oz8 s GLY 44 Ca -0.02 -0.74 0.05 0.00 0.00 0.00 0.00 44.72 44.00 2oz8 s GLY 44 CO 0.02 -0.43 -0.20 -2.27 0.00 0.00 0.00 173.10 170.22 2oz8 s LEU 45 N -0.78 2.34 0.32 0.66 2.96 -1.26 -0.08 118.68 122.84 2oz8 s LEU 45 Ca 0.12 -0.40 -0.04 0.00 -0.22 0.00 0.00 54.13 53.59 2oz8 s LEU 45 Cb -0.12 -1.46 -0.00 0.00 0.50 0.00 0.00 46.19 45.12 2oz8 s LEU 45 CO 0.03 0.26 0.44 -0.83 -1.32 0.00 0.00 176.35 174.93 2oz8 s GLY 46 N -0.23 1.37 -0.10 7.98 0.00 -0.34 -3.26 107.32 112.74 2oz8 s GLY 46 Ca -0.01 -1.45 0.03 0.00 0.00 0.00 0.00 44.72 43.29 2oz8 s GLY 46 CO 0.03 -0.99 -0.21 -1.36 0.00 0.00 0.00 173.10 170.58 2oz8 s PHE 47 N -3.30 2.32 -0.46 1.90 0.08 -1.26 0.05 117.98 117.30 2oz8 s PHE 47 Ca 0.30 -0.99 -0.11 0.00 0.12 0.00 0.00 56.93 56.25 2oz8 s PHE 47 Cb 0.00 -1.58 0.10 0.00 -0.57 0.00 0.00 43.02 40.97 2oz8 s PHE 47 CO 0.18 -0.43 0.34 0.42 -0.10 0.00 0.00 175.22 175.63 2oz8 s ILE 48 N 0.55 4.55 -0.12 0.64 1.01 0.37 -4.11 121.20 124.09 2oz8 s ILE 48 Ca -0.15 -1.46 -0.03 0.00 0.00 0.00 0.00 60.65 59.01 2oz8 s ILE 48 Cb -0.17 -3.85 -0.03 0.00 0.01 0.00 0.00 42.46 38.42 2oz8 s ILE 48 CO 0.05 -0.65 -0.03 -1.58 0.00 0.00 0.00 174.94 172.73 2oz8 s GLN 49 N 1.47 3.37 -0.06 2.79 0.74 -1.26 -1.33 119.66 125.38 2oz8 s GLN 49 Ca 0.04 -0.49 0.00 0.00 0.05 0.00 0.00 55.36 54.96 2oz8 s GLN 49 Cb -0.25 -2.84 -0.03 0.00 1.10 0.00 0.00 33.01 30.99 2oz8 s GLN 49 CO 0.02 0.42 -0.04 0.95 -0.55 0.00 0.00 175.29 176.10 2oz8 s THR 50 N -0.13 3.96 -0.20 -0.34 -4.23 -0.71 -4.88 115.64 109.12 2oz8 s THR 50 Ca 0.03 -0.45 0.16 0.00 -1.18 0.00 0.00 61.69 60.25 2oz8 s THR 50 Cb -0.13 -2.67 -0.24 0.00 1.34 0.00 0.00 72.50 70.81 2oz8 s THR 50 CO 0.02 0.55 0.03 0.18 -0.54 0.00 0.00 174.62 174.86 2oz8 n LEU 51 N 2.00 0.36 -0.03 4.79 4.77 -1.26 -4.23 117.00 123.40 2oz8 n LEU 51 Ca -0.17 -0.02 -0.04 0.00 -0.03 0.00 0.00 56.01 55.75 2oz8 n LEU 51 Cb 0.53 0.32 -0.04 0.00 -2.33 0.00 0.00 43.42 41.91 2oz8 n LEU 51 CO 0.29 0.54 -0.73 0.49 -1.33 0.00 0.00 177.39 176.65 2oz8 n PHE 52 N -2.80 0.00 -4.18 -1.77 3.72 -1.26 -4.99 117.46 106.18 2oz8 n PHE 52 Ca -0.34 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 56.77 2oz8 n PHE 52 Cb 1.13 -0.29 -0.08 0.00 -0.94 0.00 0.00 39.48 39.29 2oz8 n PHE 52 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 2oz8 s ASN 53 N -4.37 4.75 0.85 4.37 -0.87 -1.26 -5.13 114.94 113.27 2oz8 s ASN 53 Ca -0.08 -0.31 -0.12 0.00 -1.57 0.00 0.00 52.86 50.78 2oz8 s ASN 53 Cb 0.02 -1.03 0.10 0.00 -0.02 0.00 0.00 41.25 40.33 2oz8 s ASN 53 CO 0.20 0.15 1.10 -2.16 -2.57 0.00 0.00 177.10 173.82 2oz8 s PRO 54 N -2.49 1.69 0.52 -0.60 0.05 -1.26 -4.67 135.00 128.23 2oz8 s PRO 54 Ca 0.25 0.58 -0.20 0.00 0.05 0.00 0.00 61.00 61.68 2oz8 s PRO 54 Cb -0.11 -1.88 -0.07 0.00 0.05 0.00 0.00 34.50 32.49 2oz8 s PRO 54 CO 0.17 -1.88 1.09 -0.51 0.05 0.00 0.00 177.00 175.91 2oz8 s LEU 55 N -5.93 3.79 0.00 -3.56 1.43 -1.26 -5.03 118.68 108.12 2oz8 s LEU 55 Ca 0.62 2.06 -0.12 0.00 -1.03 0.00 0.00 54.13 55.66 2oz8 s LEU 55 Cb -0.15 -4.57 0.17 0.00 0.03 0.00 0.00 46.19 41.67 2oz8 s LEU 55 CO 0.55 -1.01 0.59 -0.81 0.23 0.00 0.00 176.35 175.89 2oz8 n PRO 56 N -1.15 -2.33 -1.77 1.29 -0.04 -1.26 -4.74 135.00 125.00 2oz8 n PRO 56 Ca 0.10 -0.94 -0.38 0.00 -0.04 0.00 0.00 63.50 62.25 2oz8 n PRO 56 Cb 0.52 -0.91 0.05 0.00 -0.04 0.00 0.00 33.50 33.12 2oz8 n PRO 56 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2oz8 s ASP 57 N -3.07 5.03 0.32 3.54 1.01 -1.26 -4.72 116.67 117.52 2oz8 s ASP 57 Ca 0.39 2.72 0.05 0.00 0.71 0.00 0.00 52.55 56.42 2oz8 s ASP 57 Cb -0.04 -2.63 0.86 0.00 1.01 0.00 0.00 42.92 42.12 2oz8 s ASP 57 CO 0.30 -1.73 1.58 -0.61 0.21 0.00 0.00 175.17 174.92 2oz8 h GLN 58 N 1.13 0.03 -0.45 8.23 4.15 -0.52 0.31 115.11 127.98 2oz8 h GLN 58 Ca -0.51 -0.00 -0.09 0.00 0.77 0.00 0.00 58.65 58.81 2oz8 h GLN 58 Cb 1.31 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.98 2oz8 h GLN 58 CO 0.56 0.02 -0.10 0.37 -1.93 0.00 0.00 178.83 177.75 2oz8 h GLN 59 N 0.03 0.82 -0.35 1.69 4.15 -1.89 -1.08 115.11 118.47 2oz8 h GLN 59 Ca 0.64 -0.27 -0.04 0.00 0.77 0.00 0.00 58.65 59.75 2oz8 h GLN 59 Cb 1.41 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 29.02 2oz8 h GLN 59 CO -0.87 0.88 0.07 1.49 -1.93 0.00 0.00 178.83 178.48 2oz8 h GLU 60 N 0.74 0.56 -0.37 1.69 4.57 -0.76 -1.70 114.58 119.31 2oz8 h GLU 60 Ca 0.13 -0.14 0.05 0.00 -1.18 0.00 0.00 59.36 58.21 2oz8 h GLU 60 Cb 0.59 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 29.07 2oz8 h GLU 60 CO 0.04 0.63 0.12 0.82 -1.18 0.00 0.00 179.01 179.43 2oz8 h ILE 61 N 0.41 0.88 -0.90 2.32 2.04 -0.92 -1.80 117.51 119.54 2oz8 h ILE 61 Ca 0.11 -0.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 2oz8 h ILE 61 Cb 0.33 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 2oz8 h ILE 61 CO 0.00 0.05 0.49 -0.33 0.00 0.00 0.00 178.15 178.36 2oz8 h GLU 62 N 0.27 1.25 -0.15 2.37 5.08 -1.12 -0.81 114.58 121.47 2oz8 h GLU 62 Ca 0.17 -0.15 -0.18 0.00 -1.00 0.00 0.00 59.36 58.20 2oz8 h GLU 62 Cb 0.16 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 2oz8 h GLU 62 CO -0.18 0.92 -0.64 0.77 -1.00 0.00 0.00 179.01 178.87 2oz8 h SER 63 N 1.26 0.64 -0.03 1.42 0.02 -0.92 -1.47 113.55 114.46 2oz8 h SER 63 Ca 0.31 -0.38 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 2oz8 h SER 63 Cb 0.03 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.39 2oz8 h SER 63 CO -0.05 1.12 -0.07 0.58 -1.14 0.00 0.00 176.83 177.27 2oz8 h VAL 64 N 0.41 1.45 -0.35 2.27 2.07 -1.23 -2.24 116.25 118.63 2oz8 h VAL 64 Ca -0.01 -1.44 0.06 0.00 0.82 0.00 0.00 66.70 66.13 2oz8 h VAL 64 Cb 1.21 2.35 -0.06 0.00 -1.52 0.00 0.00 31.29 33.27 2oz8 h VAL 64 CO 0.12 0.39 0.00 0.15 0.02 0.00 0.00 177.57 178.25 2oz8 h PHE 65 N -0.46 -0.01 -0.76 1.57 3.57 -1.17 0.22 116.94 119.90 2oz8 h PHE 65 Ca -0.00 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.63 2oz8 h PHE 65 Cb 0.67 0.06 -0.08 0.00 2.79 0.00 0.00 35.95 39.39 2oz8 h PHE 65 CO 0.13 -0.06 0.39 1.49 -2.23 0.00 0.00 178.31 178.03 2oz8 h GLU 66 N 0.10 0.62 0.09 1.11 4.81 -1.28 -0.02 114.58 120.01 2oz8 h GLU 66 Ca 0.17 -0.04 -0.27 0.00 -0.13 0.00 0.00 59.36 59.09 2oz8 h GLU 66 Cb 0.23 -0.14 0.02 0.00 0.63 0.00 0.00 28.75 29.49 2oz8 h GLU 66 CO -0.28 0.41 -1.15 1.25 -0.73 0.00 0.00 179.01 178.50 2oz8 h HIS 67 N 0.64 0.77 0.02 0.92 2.76 -0.83 -3.34 115.15 116.09 2oz8 h HIS 67 Ca 0.39 -0.48 -0.39 0.00 -2.20 0.00 0.00 60.37 57.68 2oz8 h HIS 67 Cb 0.44 -0.06 -0.06 0.00 1.55 0.00 0.00 27.41 29.27 2oz8 h HIS 67 CO -0.10 1.33 -2.38 0.39 -1.30 0.00 0.00 177.93 175.87 2oz8 n GLU 68 N -3.71 0.66 -0.06 5.26 1.02 0.73 -4.77 120.64 119.77 2oz8 n GLU 68 Ca -0.10 0.19 -0.07 0.00 -0.02 0.00 0.00 57.16 57.16 2oz8 n GLU 68 Cb 0.95 -1.55 -0.07 0.00 -0.02 0.00 0.00 31.44 30.75 2oz8 n GLU 68 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 2oz8 n VAL 69 N -3.45 0.70 -0.35 2.62 3.14 -0.40 -4.77 118.33 115.83 2oz8 n VAL 69 Ca -0.45 -0.33 0.10 0.00 -2.96 0.00 0.00 64.34 60.70 2oz8 n VAL 69 Cb 0.98 -0.86 0.27 0.00 -1.06 0.00 0.00 33.84 33.16 2oz8 n VAL 69 CO 0.00 0.00 0.00 -0.25 -6.46 0.00 0.00 176.83 170.12 2oz8 h TRP 70 N 0.00 1.05 -0.29 1.45 -0.00 -1.18 -1.34 115.95 115.64 2oz8 h TRP 70 Ca -0.27 0.03 0.08 0.00 -0.00 0.00 0.00 58.89 58.73 2oz8 h TRP 70 Cb 1.50 -0.32 -0.01 0.00 -0.00 0.00 0.00 29.16 30.33 2oz8 h TRP 70 CO 0.01 0.31 0.21 -1.35 -0.00 0.00 0.00 178.44 177.62 2oz8 h PRO 71 N 0.83 0.00 0.00 2.65 0.11 -1.86 -0.51 132.00 133.23 2oz8 h PRO 71 Ca 0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.64 2oz8 h PRO 71 Cb 0.69 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.80 2oz8 h PRO 71 CO -0.33 0.00 -0.22 -1.13 -0.21 0.00 0.00 178.00 176.10 2oz8 n SER 72 N -4.39 0.26 -0.10 -2.05 3.41 -0.51 -4.08 113.62 106.16 2oz8 n SER 72 Ca 0.04 0.19 -0.12 0.00 -0.26 0.00 0.00 58.87 58.72 2oz8 n SER 72 Cb 0.37 -0.19 -0.11 0.00 -0.26 0.00 0.00 64.21 64.02 2oz8 n SER 72 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2oz8 n LEU 73 N -1.55 1.70 -4.75 1.04 4.77 -0.36 -4.92 117.00 112.93 2oz8 n LEU 73 Ca 0.06 -0.07 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 2oz8 n LEU 73 Cb 0.34 -0.25 -0.01 0.00 -2.33 0.00 0.00 43.42 41.17 2oz8 n LEU 73 CO 0.31 0.67 1.24 1.17 -1.33 0.00 0.00 177.39 179.45 2oz8 n LYS 74 N -2.91 2.72 -0.97 3.23 4.81 -0.34 -2.41 118.16 122.29 2oz8 n LYS 74 Ca -0.34 0.97 0.00 0.00 -0.87 0.00 0.00 58.31 58.07 2oz8 n LYS 74 Cb 0.97 -2.75 0.00 0.00 0.02 0.00 0.00 35.03 33.27 2oz8 n LYS 74 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2oz8 n GLY 75 N 1.94 0.68 3.73 3.14 0.00 -0.39 -4.94 105.19 109.34 2oz8 n GLY 75 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 2oz8 n GLY 75 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2oz8 s ASN 76 N -2.47 5.15 0.04 1.61 0.01 -1.01 -4.70 114.94 113.56 2oz8 s ASN 76 Ca 0.00 -0.25 -0.26 0.00 -0.71 0.00 0.00 52.86 51.64 2oz8 s ASN 76 Cb 0.00 -1.23 -0.05 0.00 0.41 0.00 0.00 41.25 40.38 2oz8 s ASN 76 CO 0.00 0.09 0.81 -0.13 -1.51 0.00 0.00 177.10 176.36 2oz8 s ARG 77 N -2.97 4.53 0.19 -0.60 1.81 -1.26 -1.26 118.95 119.38 2oz8 s ARG 77 Ca 0.29 1.15 -0.15 0.00 -1.72 0.00 0.00 55.73 55.30 2oz8 s ARG 77 Cb -0.10 -3.39 0.18 0.00 -0.45 0.00 0.00 34.95 31.19 2oz8 s ARG 77 CO 0.21 0.20 1.65 0.00 -0.68 0.00 0.00 175.30 176.68 2oz8 h ALA 78 N 5.93 0.37 0.00 2.13 0.00 -1.88 -1.68 119.26 124.12 2oz8 h ALA 78 Ca -0.43 0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2oz8 h ALA 78 Cb 1.21 0.39 -0.00 0.00 0.00 0.00 0.00 17.79 19.38 2oz8 h ALA 78 CO 0.72 -0.43 -0.07 0.97 0.00 0.00 0.00 179.25 180.44 2oz8 h ILE 79 N 0.01 0.46 0.05 0.00 6.09 -1.90 -1.36 117.51 120.86 2oz8 h ILE 79 Ca 0.26 -0.34 -0.18 0.00 -1.37 0.00 0.00 64.86 63.22 2oz8 h ILE 79 Cb 0.39 1.23 0.02 0.00 0.47 0.00 0.00 36.82 38.93 2oz8 h ILE 79 CO -0.53 0.07 -0.74 0.00 -3.07 0.00 0.00 178.15 173.87 2oz8 h ALA 80 N 1.93 0.03 -0.63 0.18 0.00 -1.74 -3.36 119.26 115.67 2oz8 h ALA 80 Ca -0.00 -0.63 -0.08 0.00 0.00 0.00 0.00 54.91 54.21 2oz8 h ALA 80 Cb 0.22 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2oz8 h ALA 80 CO 0.01 0.41 0.10 -0.07 0.00 0.00 0.00 179.25 179.69 2oz8 h LEU 81 N -0.11 0.99 -0.19 0.00 3.38 -0.55 -2.01 115.31 116.82 2oz8 h LEU 81 Ca -0.11 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2oz8 h LEU 81 Cb 1.47 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2oz8 h LEU 81 CO 0.14 0.99 0.00 1.33 0.09 0.00 0.00 178.44 180.99 2oz8 n VAL 82 N -4.22 1.26 0.67 1.22 0.24 -0.86 -2.00 118.33 114.64 2oz8 n VAL 82 Ca 0.04 0.35 0.11 0.00 -2.04 0.00 0.00 64.34 62.80 2oz8 n VAL 82 Cb 0.29 -1.21 -0.07 0.00 -1.47 0.00 0.00 33.84 31.38 2oz8 n VAL 82 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2oz8 n HIS 83 N -1.65 0.07 -1.69 6.34 8.25 -0.76 -4.97 115.22 120.81 2oz8 n HIS 83 Ca 0.02 0.02 -0.44 0.00 -0.26 0.00 0.00 57.72 57.06 2oz8 n HIS 83 Cb 0.12 -0.24 -0.02 0.00 1.12 0.00 0.00 29.99 30.97 2oz8 n HIS 83 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 2oz8 n ARG 84 N -1.78 2.19 -3.71 -0.41 0.63 -0.85 -4.97 116.66 107.76 2oz8 n ARG 84 Ca 0.02 0.78 -0.37 0.00 -0.92 0.00 0.00 57.85 57.35 2oz8 n ARG 84 Cb 0.41 -2.45 -0.12 0.00 0.45 0.00 0.00 32.46 30.75 2oz8 n ARG 84 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2oz8 s VAL 85 N -0.23 4.46 0.07 5.15 1.01 -1.26 -5.10 120.40 124.50 2oz8 s VAL 85 Ca 0.65 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 62.39 2oz8 s VAL 85 Cb -0.60 -3.18 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 2oz8 s VAL 85 CO 0.52 0.21 -0.02 0.20 0.00 0.00 0.00 175.10 176.00 2oz8 s ASN 86 N 1.61 4.91 0.25 3.32 0.01 -1.26 -5.12 114.94 118.66 2oz8 s ASN 86 Ca 0.05 -0.17 -0.18 0.00 -0.71 0.00 0.00 52.86 51.85 2oz8 s ASN 86 Cb -0.16 -1.16 -0.08 0.00 0.41 0.00 0.00 41.25 40.26 2oz8 s ASN 86 CO 0.05 0.21 0.72 -0.13 -1.51 0.00 0.00 177.10 176.43 2oz8 s ARG 87 N -2.05 4.16 0.04 -0.60 0.52 -1.26 -4.98 118.95 114.78 2oz8 s ARG 87 Ca 0.23 0.78 -0.13 0.00 -0.52 0.00 0.00 55.73 56.09 2oz8 s ARG 87 Cb -0.11 -2.75 -0.05 0.00 0.52 0.00 0.00 34.95 32.55 2oz8 s ARG 87 CO 0.15 0.33 1.21 -1.35 0.02 0.00 0.00 175.30 175.67 2oz8 h PRO 88 N 3.09 -0.26 0.00 3.54 0.11 -2.07 -3.57 132.00 132.83 2oz8 h PRO 88 Ca -0.48 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2oz8 h PRO 88 Cb 1.19 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2oz8 h PRO 88 CO 0.65 -0.18 0.00 -2.13 -0.21 0.00 0.00 178.00 176.14 2oz8 n ARG 89 N -3.64 0.00 -3.87 1.05 0.63 -1.26 -5.30 116.66 104.28 2oz8 n ARG 89 Ca -0.03 0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 56.79 2oz8 n ARG 89 Cb 0.16 0.00 -0.10 0.00 0.45 0.00 0.00 32.46 32.97 2oz8 n ARG 89 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2oz8 s TYR 96 N 0.00 0.05 -0.21 -0.14 2.02 -1.26 -5.31 117.35 112.50 2oz8 s TYR 96 Ca 0.00 -0.17 0.29 0.00 -0.37 0.00 0.00 57.07 56.81 2oz8 s TYR 96 Cb 0.00 -0.05 1.07 0.00 -0.40 0.00 0.00 41.96 42.58 2oz8 s TYR 96 CO 0.00 -0.32 1.84 1.03 -1.57 0.00 0.00 175.55 176.53 2oz8 h SER 97 N 4.07 0.00 -5.04 2.29 0.87 -2.02 -3.44 113.55 110.28 2oz8 h SER 97 Ca -0.31 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.09 2oz8 h SER 97 Cb 1.19 0.00 -0.19 0.00 -0.44 0.00 0.00 62.40 62.97 2oz8 h SER 97 CO 0.43 0.00 -0.70 -0.76 -0.53 0.00 0.00 176.83 175.27 2oz8 s LEU 98 N -5.56 2.34 -1.08 2.23 1.43 -1.26 -5.09 118.68 111.69 2oz8 s LEU 98 Ca 0.04 -0.70 -0.22 0.00 -1.03 0.00 0.00 54.13 52.21 2oz8 s LEU 98 Cb 0.09 0.11 -0.00 0.00 0.03 0.00 0.00 46.19 46.41 2oz8 s LEU 98 CO 0.52 -0.41 1.75 -2.16 0.23 0.00 0.00 176.35 176.29 2oz8 s PRO 99 N -2.45 3.14 0.06 1.29 0.04 -1.26 -4.71 135.00 131.11 2oz8 s PRO 99 Ca -0.06 -1.07 0.22 0.00 0.04 0.00 0.00 61.00 60.13 2oz8 s PRO 99 Cb -0.03 -5.29 -0.10 0.00 0.04 0.00 0.00 34.50 29.13 2oz8 s PRO 99 CO -0.04 -2.93 0.86 1.19 0.04 0.00 0.00 177.00 176.11 2oz8 n PHE 100 N 11.42 0.34 0.10 0.56 3.72 -1.26 -4.59 117.46 127.74 2oz8 n PHE 100 Ca 0.41 0.10 -0.13 0.00 -0.05 0.00 0.00 57.45 57.78 2oz8 n PHE 100 Cb 0.48 -0.55 -0.06 0.00 -0.94 0.00 0.00 39.48 38.40 2oz8 n PHE 100 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2oz8 h HIS 101 N 0.00 -0.96 0.22 1.38 2.76 -1.99 -1.02 115.15 115.55 2oz8 h HIS 101 Ca 0.00 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.18 2oz8 h HIS 101 Cb 0.86 0.41 0.00 0.00 1.55 0.00 0.00 27.41 30.23 2oz8 h HIS 101 CO 0.00 -0.45 -0.10 1.49 -1.30 0.00 0.00 177.93 177.57 2oz8 h GLU 102 N -0.55 -0.28 -0.59 5.26 4.81 -1.92 -2.82 114.58 118.48 2oz8 h GLU 102 Ca 0.04 0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.37 2oz8 h GLU 102 Cb 0.60 0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.98 2oz8 h GLU 102 CO -0.23 -0.17 0.24 0.00 -0.73 0.00 0.00 179.01 178.12 2oz8 h ALA 103 N 0.48 0.76 -0.48 2.92 0.00 -1.68 -0.92 119.26 120.34 2oz8 h ALA 103 Ca -0.03 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.97 2oz8 h ALA 103 Cb 0.24 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2oz8 h ALA 103 CO 0.05 -0.16 0.28 0.28 0.00 0.00 0.00 179.25 179.70 2oz8 h VAL 104 N 0.44 1.04 -0.47 0.00 2.07 -1.17 0.11 116.25 118.27 2oz8 h VAL 104 Ca 0.29 -0.19 -0.13 0.00 0.82 0.00 0.00 66.70 67.49 2oz8 h VAL 104 Cb 0.32 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 2oz8 h VAL 104 CO -0.27 0.10 -0.20 1.56 0.02 0.00 0.00 177.57 178.78 2oz8 h GLN 105 N 0.56 0.97 -0.22 1.57 4.20 -1.00 0.97 115.11 122.15 2oz8 h GLN 105 Ca 0.19 -0.41 -0.02 0.00 0.06 0.00 0.00 58.65 58.48 2oz8 h GLN 105 Cb 0.03 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 2oz8 h GLN 105 CO -0.09 1.08 0.07 0.28 -0.67 0.00 0.00 178.83 179.50 2oz8 h VAL 106 N 0.82 1.19 -0.28 -0.54 2.07 -1.07 -1.88 116.25 116.55 2oz8 h VAL 106 Ca 0.11 -0.59 -0.03 0.00 0.82 0.00 0.00 66.70 67.01 2oz8 h VAL 106 Cb 0.77 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 2oz8 h VAL 106 CO 0.06 0.19 0.04 0.00 0.02 0.00 0.00 177.57 177.88 2oz8 h ALA 107 N 0.90 0.37 -0.25 1.67 0.00 -0.65 -1.46 119.26 119.85 2oz8 h ALA 107 Ca 0.07 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.83 2oz8 h ALA 107 Cb 0.22 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 2oz8 h ALA 107 CO -0.00 0.07 -0.01 -0.07 0.00 0.00 0.00 179.25 179.23 2oz8 h LEU 108 N 0.28 -0.12 -1.04 0.00 3.38 -0.82 -1.37 115.31 115.63 2oz8 h LEU 108 Ca 0.09 0.06 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 2oz8 h LEU 108 Cb 0.34 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2oz8 h LEU 108 CO 0.01 -0.03 -0.31 -0.50 0.09 0.00 0.00 178.44 177.70 2oz8 h TRP 109 N 0.06 0.35 0.28 1.13 4.06 -1.34 0.17 115.95 120.66 2oz8 h TRP 109 Ca 0.12 -0.08 -0.01 0.00 2.06 0.00 0.00 58.89 60.98 2oz8 h TRP 109 Cb 0.16 -0.08 0.00 0.00 -1.00 0.00 0.00 29.16 28.24 2oz8 h TRP 109 CO -0.21 0.59 -0.14 0.22 -3.56 0.00 0.00 178.44 175.34 2oz8 h ASP 110 N 0.27 -0.32 -0.43 -3.49 3.58 -1.07 -1.46 116.42 113.49 2oz8 h ASP 110 Ca 0.04 -0.01 0.05 0.00 0.42 0.00 0.00 57.03 57.53 2oz8 h ASP 110 Cb 0.68 0.08 -0.05 0.00 1.72 0.00 0.00 39.33 41.77 2oz8 h ASP 110 CO 0.05 -0.21 0.16 0.25 -2.88 0.00 0.00 179.24 176.61 2oz8 h LEU 111 N -0.41 0.18 -0.54 2.28 5.85 -1.16 -0.64 115.31 120.87 2oz8 h LEU 111 Ca -0.04 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2oz8 h LEU 111 Cb 0.31 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 2oz8 h LEU 111 CO 0.06 0.14 0.34 0.00 -0.34 0.00 0.00 178.44 178.64 2oz8 h ALA 112 N 1.28 0.69 0.01 1.25 0.00 -0.90 -0.91 119.26 120.68 2oz8 h ALA 112 Ca 0.20 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2oz8 h ALA 112 Cb 0.18 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2oz8 h ALA 112 CO -0.20 0.15 -0.01 0.00 0.00 0.00 0.00 179.25 179.19 2oz8 h ALA 113 N 1.18 -0.02 -0.34 0.00 0.00 -1.17 -0.83 119.26 118.08 2oz8 h ALA 113 Ca 0.20 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.13 2oz8 h ALA 113 Cb -0.05 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 2oz8 h ALA 113 CO -0.04 -0.48 0.03 0.87 0.00 0.00 0.00 179.25 179.63 2oz8 h LYS 114 N -0.07 0.13 0.00 0.00 1.57 -0.91 0.12 116.57 117.42 2oz8 h LYS 114 Ca -0.00 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 2oz8 h LYS 114 Cb 0.07 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 2oz8 h LYS 114 CO 0.00 0.09 -0.22 0.93 -0.57 0.00 0.00 179.45 179.68 2oz8 h GLU 115 N 0.14 0.00 -0.00 3.15 5.08 -1.13 0.21 114.58 122.02 2oz8 h GLU 115 Ca 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2oz8 h GLU 115 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2oz8 h GLU 115 CO -0.25 0.22 -0.08 0.00 -1.00 0.00 0.00 179.01 177.89 2oz8 n ALA 116 N -2.36 2.65 -2.71 3.43 0.00 -0.32 -4.93 120.51 116.27 2oz8 n ALA 116 Ca -0.02 -0.20 -0.08 0.00 0.00 0.00 0.00 53.44 53.14 2oz8 n ALA 116 Cb 0.31 -1.40 0.04 0.00 0.00 0.00 0.00 19.45 18.40 2oz8 n ALA 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oz8 n GLY 117 N 1.33 0.20 3.13 0.00 0.00 0.72 -5.05 105.19 105.52 2oz8 n GLY 117 Ca 0.13 -0.26 -0.11 0.00 0.00 0.00 0.00 46.02 45.77 2oz8 n GLY 117 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oz8 s LEU 118 N -3.70 1.50 0.35 0.99 1.43 0.22 -5.02 118.68 114.45 2oz8 s LEU 118 Ca 0.08 -0.26 -0.28 0.00 -1.03 0.00 0.00 54.13 52.64 2oz8 s LEU 118 Cb -0.04 0.77 -0.10 0.00 0.03 0.00 0.00 46.19 46.84 2oz8 s LEU 118 CO 0.30 -0.43 1.38 -2.84 0.23 0.00 0.00 176.35 174.98 2oz8 s PRO 119 N -1.79 4.23 0.20 1.29 0.02 -1.22 -1.47 135.00 136.26 2oz8 s PRO 119 Ca -0.11 2.36 -0.14 0.00 0.02 0.00 0.00 61.00 63.13 2oz8 s PRO 119 Cb -0.05 -3.01 0.21 0.00 0.02 0.00 0.00 34.50 31.67 2oz8 s PRO 119 CO -0.00 -0.35 1.65 1.25 -0.33 0.00 0.00 177.00 179.22 2oz8 h LEU 120 N 3.18 -0.41 -1.00 -5.54 5.85 0.04 -2.49 115.31 114.94 2oz8 h LEU 120 Ca -0.50 0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.46 2oz8 h LEU 120 Cb 1.23 0.31 -0.07 0.00 0.37 0.00 0.00 40.66 42.49 2oz8 h LEU 120 CO 0.65 -0.15 0.64 1.12 -0.34 0.00 0.00 178.44 180.35 2oz8 h HIS 121 N 0.04 1.18 -0.22 1.25 2.07 -1.83 0.19 115.15 117.82 2oz8 h HIS 121 Ca 0.27 0.03 -0.02 0.00 -2.85 0.00 0.00 60.37 57.81 2oz8 h HIS 121 Cb 0.42 -0.38 -0.01 0.00 2.57 0.00 0.00 27.41 30.01 2oz8 h HIS 121 CO -0.42 0.56 0.08 0.28 -3.07 0.00 0.00 177.93 175.36 2oz8 h VAL 122 N 1.11 1.18 -0.73 6.12 2.07 -1.77 0.70 116.25 124.93 2oz8 h VAL 122 Ca 0.45 -0.56 0.11 0.00 0.82 0.00 0.00 66.70 67.53 2oz8 h VAL 122 Cb 0.28 1.14 -0.05 0.00 -1.52 0.00 0.00 31.29 31.14 2oz8 h VAL 122 CO -0.21 0.18 0.48 0.25 0.02 0.00 0.00 177.57 178.30 2oz8 h LEU 123 N 0.19 0.52 0.00 2.57 5.85 -1.09 -0.33 115.31 123.01 2oz8 h LEU 123 Ca 0.07 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.81 2oz8 h LEU 123 Cb 0.21 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.15 2oz8 h LEU 123 CO -0.00 0.30 0.00 0.18 -0.34 0.00 0.00 178.44 178.58 2oz8 n LEU 124 N -4.49 0.00 0.00 2.25 4.77 0.60 -4.87 117.00 115.27 2oz8 n LEU 124 Ca 0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2oz8 n LEU 124 Cb 0.38 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 2oz8 n LEU 124 CO 0.33 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 2oz8 n GLY 125 N 0.54 0.66 3.69 -0.72 0.00 -0.13 -4.90 105.19 104.33 2oz8 n GLY 125 Ca 0.18 -0.44 -0.32 0.00 0.00 0.00 0.00 46.02 45.44 2oz8 n GLY 125 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2oz8 s SER 126 N -2.40 3.39 0.00 1.61 1.04 0.14 -4.92 113.70 112.56 2oz8 s SER 126 Ca 0.00 2.25 0.00 0.00 0.48 0.00 0.00 55.95 58.68 2oz8 s SER 126 Cb 0.00 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.55 2oz8 s SER 126 CO 0.00 -2.79 0.07 0.54 0.98 0.00 0.00 173.24 172.04 2oz8 n ARG 127 N -3.70 5.58 -4.44 4.02 1.74 -1.26 -4.81 116.66 113.79 2oz8 n ARG 127 Ca 0.12 -0.07 -0.21 0.00 -0.77 0.00 0.00 57.85 56.92 2oz8 n ARG 127 Cb 0.51 -0.56 -0.10 0.00 -1.02 0.00 0.00 32.46 31.29 2oz8 n ARG 127 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2oz8 s ARG 128 N -0.82 1.67 0.00 5.56 1.70 -1.26 -5.06 118.95 120.74 2oz8 s ARG 128 Ca 0.00 -1.95 0.00 0.00 -0.47 0.00 0.00 55.73 53.31 2oz8 s ARG 128 Cb 0.00 -0.68 0.00 0.00 -0.57 0.00 0.00 34.95 33.70 2oz8 s ARG 128 CO 0.00 -0.28 0.81 0.27 -1.08 0.00 0.00 175.30 175.02 2oz8 n ASN 129 N -0.79 1.36 -3.89 -2.89 6.94 -1.26 -4.81 115.26 109.93 2oz8 n ASN 129 Ca -0.03 -1.65 -0.09 0.00 -0.02 0.00 0.00 54.58 52.79 2oz8 n ASN 129 Cb 0.66 0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 38.00 2oz8 n ASN 129 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2oz8 s ARG 130 N -0.65 0.73 -0.00 -3.83 1.70 -1.26 -0.93 118.95 114.71 2oz8 s ARG 130 Ca 0.00 -0.86 -0.02 0.00 -0.47 0.00 0.00 55.73 54.38 2oz8 s ARG 130 Cb 0.00 0.29 -0.00 0.00 -0.57 0.00 0.00 34.95 34.67 2oz8 s ARG 130 CO 0.00 -0.21 0.04 0.54 -1.08 0.00 0.00 175.30 174.59 2oz8 s VAL 131 N -3.29 0.05 0.38 4.99 0.11 -0.17 -4.80 120.40 117.68 2oz8 s VAL 131 Ca 0.01 -0.43 -0.28 0.00 -2.93 0.00 0.00 61.98 58.35 2oz8 s VAL 131 Cb 0.03 -0.21 -0.11 0.00 -1.53 0.00 0.00 36.38 34.55 2oz8 s VAL 131 CO -0.08 -0.24 1.47 0.29 -3.33 0.00 0.00 175.10 173.22 2oz8 n LYS 132 N 2.27 2.61 -5.02 1.54 5.02 -1.22 0.79 118.16 124.15 2oz8 n LYS 132 Ca -0.18 0.92 -0.31 0.00 -2.02 0.00 0.00 58.31 56.71 2oz8 n LYS 132 Cb 0.57 -2.65 -0.14 0.00 -0.02 0.00 0.00 35.03 32.79 2oz8 n LYS 132 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2oz8 s ALA 133 N -1.12 2.38 0.18 7.82 0.00 0.08 -1.33 121.76 129.77 2oz8 s ALA 133 Ca 0.54 -1.12 0.09 0.00 0.00 0.00 0.00 51.96 51.47 2oz8 s ALA 133 Cb -0.48 -0.68 -0.04 0.00 0.00 0.00 0.00 23.12 21.92 2oz8 s ALA 133 CO 0.63 0.54 -0.12 1.52 0.00 0.00 0.00 175.76 178.34 2oz8 s TYR 134 N -0.73 2.58 -0.16 0.00 -0.85 -0.76 -4.70 117.35 112.73 2oz8 s TYR 134 Ca 0.11 -0.24 -0.16 0.00 -0.52 0.00 0.00 57.07 56.26 2oz8 s TYR 134 Cb -0.10 -1.27 -0.04 0.00 0.38 0.00 0.00 41.96 40.93 2oz8 s TYR 134 CO 0.01 0.50 0.41 0.00 -1.52 0.00 0.00 175.55 174.95 2oz8 s ALA 135 N -1.66 3.53 -0.12 9.51 0.00 0.08 -1.92 121.76 131.18 2oz8 s ALA 135 Ca 0.24 -0.36 -0.00 0.00 0.00 0.00 0.00 51.96 51.84 2oz8 s ALA 135 Cb -0.09 -2.59 0.02 0.00 0.00 0.00 0.00 23.12 20.47 2oz8 s ALA 135 CO 0.14 -0.08 -0.10 0.45 0.00 0.00 0.00 175.76 176.17 2oz8 s SER 136 N 0.73 2.32 0.12 0.00 0.15 -0.16 -0.44 113.70 116.42 2oz8 s SER 136 Ca 0.22 -0.36 0.15 0.00 0.70 0.00 0.00 55.95 56.65 2oz8 s SER 136 Cb -0.14 -0.95 -0.10 0.00 -1.71 0.00 0.00 66.02 63.12 2oz8 s SER 136 CO 0.08 -0.09 1.04 1.23 1.20 0.00 0.00 173.24 176.69 2oz8 h GLY 137 N 8.08 0.00 -6.39 9.45 0.00 -1.78 -3.37 103.07 109.06 2oz8 h GLY 137 Ca -0.32 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.52 2oz8 h GLY 137 CO 0.45 0.00 -0.82 1.04 0.00 0.00 0.00 176.54 177.21 2oz8 n LEU 138 N -3.05 -2.42 -1.33 3.11 4.77 -1.26 -4.84 117.00 111.97 2oz8 n LEU 138 Ca -0.06 -0.89 0.09 0.00 -0.03 0.00 0.00 56.01 55.12 2oz8 n LEU 138 Cb 0.84 -2.41 0.31 0.00 -2.33 0.00 0.00 43.42 39.84 2oz8 n LEU 138 CO 0.43 0.41 0.77 -0.90 -1.33 0.00 0.00 177.39 176.77 2oz8 n ASP 139 N -2.88 4.34 0.26 -1.43 5.75 -1.23 -0.90 116.55 120.46 2oz8 n ASP 139 Ca -0.10 -2.47 0.09 0.00 -0.01 0.00 0.00 54.79 52.30 2oz8 n ASP 139 Cb 0.59 -0.52 0.66 0.00 -1.03 0.00 0.00 41.12 40.82 2oz8 n ASP 139 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 2oz8 h PHE 140 N 3.40 0.00 -0.00 2.11 3.57 -1.82 -2.69 116.94 121.50 2oz8 h PHE 140 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2oz8 h PHE 140 Cb 1.34 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.08 2oz8 h PHE 140 CO 0.64 0.06 -0.67 0.72 -2.23 0.00 0.00 178.31 176.83 2oz8 n HIS 141 N -4.30 0.00 -1.75 0.41 8.25 -1.26 -4.97 115.22 111.60 2oz8 n HIS 141 Ca -0.03 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.02 2oz8 n HIS 141 Cb 0.14 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.24 2oz8 n HIS 141 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2oz8 n LEU 142 N -0.98 4.48 -4.76 2.41 4.32 -1.02 -5.00 117.00 116.45 2oz8 n LEU 142 Ca 0.05 1.17 -0.35 0.00 -0.02 0.00 0.00 56.01 56.86 2oz8 n LEU 142 Cb 0.30 -1.60 0.03 0.00 -1.62 0.00 0.00 43.42 40.53 2oz8 n LEU 142 CO 0.31 0.14 0.79 1.51 -1.22 0.00 0.00 177.39 178.92 2oz8 s ASP 143 N 0.27 5.29 0.39 -1.43 1.47 -1.26 -4.80 116.67 116.61 2oz8 s ASP 143 Ca 0.60 2.21 0.21 0.00 1.18 0.00 0.00 52.55 56.76 2oz8 s ASP 143 Cb -0.49 -2.58 1.20 0.00 -0.34 0.00 0.00 42.92 40.71 2oz8 s ASP 143 CO 0.54 -1.51 1.69 0.44 0.68 0.00 0.00 175.17 177.01 2oz8 h ASP 144 N 0.71 0.41 -0.21 2.11 3.32 -1.98 -0.62 116.42 120.16 2oz8 h ASP 144 Ca -0.49 0.13 -0.05 0.00 0.02 0.00 0.00 57.03 56.64 2oz8 h ASP 144 Cb 1.27 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.90 2oz8 h ASP 144 CO 0.55 -0.06 -0.05 -0.78 -1.72 0.00 0.00 179.24 177.18 2oz8 h ASP 145 N 0.28 0.41 -0.49 6.45 3.58 -2.01 -2.89 116.42 121.76 2oz8 h ASP 145 Ca 0.71 -0.37 -0.03 0.00 0.42 0.00 0.00 57.03 57.76 2oz8 h ASP 145 Cb 1.89 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 42.80 2oz8 h ASP 145 CO -0.42 0.69 0.21 0.00 -2.88 0.00 0.00 179.24 176.84 2oz8 h ALA 146 N 0.74 1.36 0.42 -0.78 0.00 -1.50 -2.71 119.26 116.79 2oz8 h ALA 146 Ca 0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2oz8 h ALA 146 Cb 0.51 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2oz8 h ALA 146 CO 0.02 0.48 -0.20 0.35 0.00 0.00 0.00 179.25 179.90 2oz8 h PHE 147 N 0.77 -0.52 -0.21 0.00 3.57 -1.35 -1.38 116.94 117.82 2oz8 h PHE 147 Ca 0.18 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.60 2oz8 h PHE 147 Cb 0.16 0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 2oz8 h PHE 147 CO 0.01 -0.30 -0.17 -0.24 -2.23 0.00 0.00 178.31 175.37 2oz8 h VAL 148 N -0.60 1.22 -0.22 1.41 3.04 -1.52 -0.84 116.25 118.74 2oz8 h VAL 148 Ca -0.06 -1.01 -0.00 0.00 -1.01 0.00 0.00 66.70 64.62 2oz8 h VAL 148 Cb 0.45 1.26 -0.01 0.00 -2.01 0.00 0.00 31.29 30.98 2oz8 h VAL 148 CO 0.09 0.32 0.13 -1.28 -1.01 0.00 0.00 177.57 175.82 2oz8 h SER 149 N 0.33 0.27 -0.09 3.17 0.87 -1.38 0.44 113.55 117.16 2oz8 h SER 149 Ca 0.06 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.54 2oz8 h SER 149 Cb 0.50 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.39 2oz8 h SER 149 CO 0.03 0.26 0.02 0.25 -0.53 0.00 0.00 176.83 176.86 2oz8 h LEU 150 N 0.26 0.13 -0.51 2.23 6.46 -0.83 -1.42 115.31 121.63 2oz8 h LEU 150 Ca 0.08 -0.23 -0.17 0.00 -0.12 0.00 0.00 57.88 57.44 2oz8 h LEU 150 Cb 0.04 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 39.93 2oz8 h LEU 150 CO -0.01 0.33 -0.66 -0.26 -0.62 0.00 0.00 178.44 177.21 2oz8 h PHE 151 N -0.07 0.46 -0.05 1.25 0.04 -1.00 0.88 116.94 118.45 2oz8 h PHE 151 Ca 0.03 -0.19 -0.16 0.00 2.80 0.00 0.00 57.97 60.45 2oz8 h PHE 151 Cb 0.25 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.31 2oz8 h PHE 151 CO 0.01 0.91 -0.69 0.66 -0.60 0.00 0.00 178.31 178.59 2oz8 h SER 152 N 0.25 0.29 -0.19 2.17 4.64 -0.19 -1.95 113.55 118.56 2oz8 h SER 152 Ca -0.02 -0.19 0.04 0.00 -0.47 0.00 0.00 61.79 61.15 2oz8 h SER 152 Cb 1.21 -0.09 -0.04 0.00 -0.31 0.00 0.00 62.40 63.18 2oz8 h SER 152 CO 0.11 0.89 -0.04 -0.74 -0.87 0.00 0.00 176.83 176.18 2oz8 h HIS 153 N 0.17 -0.10 -0.62 4.77 -0.00 -0.96 -0.30 115.15 118.12 2oz8 h HIS 153 Ca -0.02 0.02 0.09 0.00 -0.00 0.00 0.00 60.37 60.46 2oz8 h HIS 153 Cb 1.24 0.07 -0.07 0.00 -0.00 0.00 0.00 27.41 28.65 2oz8 h HIS 153 CO 0.03 -0.08 0.25 0.00 -0.00 0.00 0.00 177.93 178.13 2oz8 h ALA 154 N 1.19 0.80 -0.76 5.26 0.00 -0.60 -1.71 119.26 123.45 2oz8 h ALA 154 Ca 0.09 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2oz8 h ALA 154 Cb 0.14 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 2oz8 h ALA 154 CO -0.19 -0.16 0.40 0.00 0.00 0.00 0.00 179.25 179.30 2oz8 h ALA 155 N 1.41 0.97 -0.83 0.00 0.00 -1.25 -2.56 119.26 117.00 2oz8 h ALA 155 Ca 0.31 -0.13 0.20 0.00 0.00 0.00 0.00 54.91 55.29 2oz8 h ALA 155 Cb 0.35 -0.30 -0.15 0.00 0.00 0.00 0.00 17.79 17.70 2oz8 h ALA 155 CO -0.29 0.49 0.03 0.77 0.00 0.00 0.00 179.25 180.25 2oz8 h SER 156 N 1.05 -0.36 -0.63 0.00 0.02 -0.10 -1.81 113.55 111.72 2oz8 h SER 156 Ca 0.26 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 61.43 2oz8 h SER 156 Cb 0.06 0.38 0.00 0.00 0.14 0.00 0.00 62.40 62.97 2oz8 h SER 156 CO -0.04 -0.22 0.00 2.30 -1.14 0.00 0.00 176.83 177.73 2oz8 n ILE 157 N -5.37 1.91 0.00 3.27 -5.35 -1.09 -4.97 119.36 107.76 2oz8 n ILE 157 Ca 0.16 -1.23 0.00 0.00 -0.27 0.00 0.00 62.75 61.41 2oz8 n ILE 157 Cb 0.55 0.09 0.00 0.00 -1.74 0.00 0.00 39.64 38.55 2oz8 n ILE 157 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2oz8 n GLY 158 N 1.04 1.02 3.76 3.28 0.00 -0.68 -3.79 105.19 109.82 2oz8 n GLY 158 Ca 0.26 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.89 2oz8 n GLY 158 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2oz8 s TYR 159 N -2.00 2.66 0.00 1.61 2.02 -1.00 -2.90 117.35 117.75 2oz8 s TYR 159 Ca 0.00 1.38 0.00 0.00 -0.37 0.00 0.00 57.07 58.08 2oz8 s TYR 159 Cb 0.00 -3.72 0.00 0.00 -0.40 0.00 0.00 41.96 37.84 2oz8 s TYR 159 CO 0.00 -2.35 0.35 -1.13 -1.57 0.00 0.00 175.55 170.84 2oz8 n SER 160 N -0.17 0.64 -4.06 2.29 3.41 -1.26 -4.50 113.62 109.97 2oz8 n SER 160 Ca 0.05 -1.07 -0.20 0.00 -0.26 0.00 0.00 58.87 57.39 2oz8 n SER 160 Cb 0.44 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.24 2oz8 n SER 160 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2oz8 s ALA 161 N -0.07 0.92 -0.05 7.33 0.00 -1.26 -0.17 121.76 128.46 2oz8 s ALA 161 Ca 0.00 -0.50 -0.02 0.00 0.00 0.00 0.00 51.96 51.44 2oz8 s ALA 161 Cb 0.00 -0.23 0.03 0.00 0.00 0.00 0.00 23.12 22.93 2oz8 s ALA 161 CO 0.00 0.22 0.11 -0.06 0.00 0.00 0.00 175.76 176.03 2oz8 s PHE 162 N -0.31 -0.10 -0.10 0.00 0.08 -0.54 -0.74 117.98 116.27 2oz8 s PHE 162 Ca 0.04 0.35 0.04 0.00 0.12 0.00 0.00 56.93 57.48 2oz8 s PHE 162 Cb -0.05 -0.11 -0.00 0.00 -0.57 0.00 0.00 43.02 42.29 2oz8 s PHE 162 CO -0.00 -0.13 -0.24 0.21 -0.10 0.00 0.00 175.22 174.96 2oz8 s LYS 163 N 1.00 3.02 0.26 0.44 2.20 0.42 -1.36 119.74 125.71 2oz8 s LYS 163 Ca -0.08 -0.88 0.12 0.00 -0.36 0.00 0.00 55.97 54.77 2oz8 s LYS 163 Cb -0.10 -2.30 -0.05 0.00 -1.51 0.00 0.00 37.83 33.87 2oz8 s LYS 163 CO -0.04 0.20 -0.21 0.96 -0.36 0.00 0.00 175.35 175.89 2oz8 s ILE 164 N 0.30 2.44 -0.09 5.43 -4.36 -0.85 -2.45 121.20 121.62 2oz8 s ILE 164 Ca -0.18 -2.30 -0.15 0.00 -0.26 0.00 0.00 60.65 57.76 2oz8 s ILE 164 Cb -0.18 -2.25 -0.05 0.00 1.25 0.00 0.00 42.46 41.24 2oz8 s ILE 164 CO 0.09 -0.32 0.39 -0.54 0.24 0.00 0.00 174.94 174.79 2oz8 s LYS 165 N -3.28 4.14 0.00 0.37 -0.14 -1.26 -1.58 119.74 117.99 2oz8 s LYS 165 Ca 0.27 0.32 0.00 0.00 -1.36 0.00 0.00 55.97 55.21 2oz8 s LYS 165 Cb -0.06 -3.35 0.00 0.00 -1.68 0.00 0.00 37.83 32.74 2oz8 s LYS 165 CO 0.13 0.38 0.00 1.33 -0.76 0.00 0.00 175.35 176.44 2oz8 n VAL 166 N 2.95 0.00 0.00 3.17 0.24 -0.81 -4.69 118.33 119.19 2oz8 n VAL 166 Ca -0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 2oz8 n VAL 166 Cb 0.52 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.89 2oz8 n VAL 166 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2oz8 n GLY 167 N 2.69 1.19 3.60 7.63 0.00 -1.26 -4.20 105.19 114.84 2oz8 n GLY 167 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.56 2oz8 n GLY 167 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2oz8 n HIS 168 N -1.30 1.48 -0.34 1.61 8.25 -1.26 -4.89 115.22 118.77 2oz8 n HIS 168 Ca 0.00 0.64 0.21 0.00 -0.26 0.00 0.00 57.72 58.31 2oz8 n HIS 168 Cb 0.00 -2.30 0.46 0.00 1.12 0.00 0.00 29.99 29.26 2oz8 n HIS 168 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2oz8 h ARG 169 N 2.91 0.46 -4.69 -0.41 3.08 -1.99 -3.32 114.38 110.42 2oz8 h ARG 169 Ca -0.42 -0.03 -0.71 0.00 0.07 0.00 0.00 59.98 58.90 2oz8 h ARG 169 Cb 1.33 -0.10 -0.20 0.00 0.08 0.00 0.00 29.97 31.08 2oz8 h ARG 169 CO 0.67 0.30 -0.23 0.34 -1.07 0.00 0.00 179.97 179.98 2oz8 s ASP 170 N -5.20 6.17 0.54 7.04 2.15 -1.26 -4.94 116.67 121.17 2oz8 s ASP 170 Ca -0.10 -0.89 0.24 0.00 0.43 0.00 0.00 52.55 52.23 2oz8 s ASP 170 Cb 0.26 -2.21 1.41 0.00 -0.30 0.00 0.00 42.92 42.08 2oz8 s ASP 170 CO 0.80 -0.62 2.03 0.15 -0.17 0.00 0.00 175.17 177.36 2oz8 h PHE 171 N 8.76 0.00 -0.31 -5.34 3.57 -1.98 -1.30 116.94 120.34 2oz8 h PHE 171 Ca -0.27 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.24 2oz8 h PHE 171 Cb 1.11 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.83 2oz8 h PHE 171 CO 0.63 0.00 0.20 -0.44 -2.23 0.00 0.00 178.31 176.48 2oz8 h ASP 172 N 0.00 0.32 -0.56 0.41 3.32 -1.92 -1.55 116.42 116.45 2oz8 h ASP 172 Ca 0.19 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.22 2oz8 h ASP 172 Cb 0.79 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 40.24 2oz8 h ASP 172 CO -0.00 0.23 0.28 -0.09 -1.72 0.00 0.00 179.24 177.94 2oz8 h ARG 173 N 0.38 0.79 -0.64 3.56 2.43 -1.61 0.58 114.38 119.88 2oz8 h ARG 173 Ca 0.12 -0.11 0.02 0.00 -0.81 0.00 0.00 59.98 59.20 2oz8 h ARG 173 Cb 0.01 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 29.37 2oz8 h ARG 173 CO -0.03 0.63 0.41 -0.44 -1.51 0.00 0.00 179.97 179.03 2oz8 h ASP 174 N 0.75 0.69 -0.10 -3.80 3.32 -1.54 -0.25 116.42 115.49 2oz8 h ASP 174 Ca 0.19 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.14 2oz8 h ASP 174 Cb 0.09 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2oz8 h ASP 174 CO -0.03 0.49 -0.22 -0.07 -1.72 0.00 0.00 179.24 177.70 2oz8 h LEU 175 N 0.82 0.52 -0.35 1.55 3.38 -0.93 -2.50 115.31 117.81 2oz8 h LEU 175 Ca 0.24 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 2oz8 h LEU 175 Cb -0.04 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2oz8 h LEU 175 CO -0.07 0.74 0.05 -0.09 0.09 0.00 0.00 178.44 179.15 2oz8 h ARG 176 N 0.46 0.58 -0.99 1.13 2.43 -0.63 -1.24 114.38 116.12 2oz8 h ARG 176 Ca 0.07 -0.16 0.07 0.00 -0.81 0.00 0.00 59.98 59.15 2oz8 h ARG 176 Cb 0.63 -0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 30.05 2oz8 h ARG 176 CO 0.05 0.66 0.63 0.00 -1.51 0.00 0.00 179.97 179.80 2oz8 h ARG 177 N 0.41 1.09 -0.30 0.20 2.47 -0.90 0.23 114.38 117.58 2oz8 h ARG 177 Ca 0.10 -0.07 -0.05 0.00 -1.26 0.00 0.00 59.98 58.71 2oz8 h ARG 177 Cb 0.37 -0.25 -0.01 0.00 -1.65 0.00 0.00 29.97 28.43 2oz8 h ARG 177 CO 0.01 0.72 0.00 -0.07 0.56 0.00 0.00 179.97 181.19 2oz8 h LEU 178 N 1.13 0.52 -0.32 3.04 3.38 -1.28 0.08 115.31 121.87 2oz8 h LEU 178 Ca 0.44 -0.31 0.03 0.00 0.09 0.00 0.00 57.88 58.13 2oz8 h LEU 178 Cb 0.22 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2oz8 h LEU 178 CO -0.19 0.70 0.12 -0.33 0.09 0.00 0.00 178.44 178.84 2oz8 h GLU 179 N 0.33 0.26 -0.56 1.13 5.08 -0.87 -1.65 114.58 118.29 2oz8 h GLU 179 Ca 0.09 -0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.50 2oz8 h GLU 179 Cb 0.43 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.57 2oz8 h GLU 179 CO 0.02 0.17 0.26 -0.07 -1.00 0.00 0.00 179.01 178.38 2oz8 h LEU 180 N 0.26 0.33 -0.90 1.33 3.38 -0.39 -2.41 115.31 116.91 2oz8 h LEU 180 Ca 0.14 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.20 2oz8 h LEU 180 Cb 0.10 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.78 2oz8 h LEU 180 CO -0.13 0.22 0.58 0.25 0.09 0.00 0.00 178.44 179.44 2oz8 h LEU 181 N 0.48 0.94 -1.43 1.67 5.85 -0.76 -2.42 115.31 119.64 2oz8 h LEU 181 Ca 0.26 -0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.94 2oz8 h LEU 181 Cb 0.23 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2oz8 h LEU 181 CO -0.22 0.64 -0.06 0.50 -0.34 0.00 0.00 178.44 178.96 2oz8 h LYS 182 N 1.10 0.29 0.00 1.25 3.64 -0.81 -1.59 116.57 120.45 2oz8 h LYS 182 Ca 0.37 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 2oz8 h LYS 182 Cb 0.05 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 2oz8 h LYS 182 CO -0.13 0.37 0.00 0.25 -2.27 0.00 0.00 179.45 177.67 2oz8 n THR 183 N -4.31 0.57 -0.36 1.00 -2.24 -0.92 -3.77 114.28 104.25 2oz8 n THR 183 Ca -0.00 0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 2oz8 n THR 183 Cb 0.23 -0.84 0.00 0.00 -2.10 0.00 0.00 70.33 67.62 2oz8 n THR 183 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2oz8 s VAL 185 N -0.55 1.52 0.56 0.00 -7.23 -1.15 -4.23 120.40 109.31 2oz8 s VAL 185 Ca 0.00 -1.56 -0.20 0.00 -1.81 0.00 0.00 61.98 58.41 2oz8 s VAL 185 Cb 0.00 -1.47 -0.06 0.00 0.56 0.00 0.00 36.38 35.41 2oz8 s VAL 185 CO 0.00 -0.19 0.96 -2.65 -0.31 0.00 0.00 175.10 172.91 2oz8 n PRO 186 N 0.95 1.01 -1.66 4.82 -0.02 -1.26 -4.89 135.00 133.95 2oz8 n PRO 186 Ca -0.18 0.38 -0.45 0.00 -2.02 0.00 0.00 63.50 61.23 2oz8 n PRO 186 Cb 0.55 -2.12 -0.03 0.00 -0.02 0.00 0.00 33.50 31.88 2oz8 n PRO 186 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2oz8 n ALA 187 N -1.42 0.81 -0.95 3.55 0.00 -1.26 -2.86 120.51 118.38 2oz8 n ALA 187 Ca 0.12 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.97 2oz8 n ALA 187 Cb 0.45 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.68 2oz8 n ALA 187 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oz8 n GLY 188 N 1.91 0.52 3.68 0.00 0.00 -1.26 -5.04 105.19 105.00 2oz8 n GLY 188 Ca 0.11 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 2oz8 n GLY 188 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2oz8 n SER 189 N 0.13 1.41 -4.80 1.61 7.64 -1.14 -5.03 113.62 113.45 2oz8 n SER 189 Ca 0.00 0.76 -0.39 0.00 1.01 0.00 0.00 58.87 60.25 2oz8 n SER 189 Cb 0.00 -1.49 -0.06 0.00 -1.01 0.00 0.00 64.21 61.65 2oz8 n SER 189 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2oz8 s LYS 190 N -3.35 4.30 -0.04 1.43 1.02 0.76 -4.98 119.74 118.87 2oz8 s LYS 190 Ca 0.79 0.83 0.03 0.00 0.02 0.00 0.00 55.97 57.64 2oz8 s LYS 190 Cb -0.37 -3.26 0.00 0.00 -0.52 0.00 0.00 37.83 33.68 2oz8 s LYS 190 CO 0.44 0.58 -0.14 0.08 -0.92 0.00 0.00 175.35 175.39 2oz8 s VAL 191 N -0.96 1.21 0.07 3.17 1.01 -1.26 -1.47 120.40 122.17 2oz8 s VAL 191 Ca 0.31 -0.58 0.09 0.00 0.00 0.00 0.00 61.98 61.79 2oz8 s VAL 191 Cb -0.20 -1.06 -0.03 0.00 0.00 0.00 0.00 36.38 35.09 2oz8 s VAL 191 CO 0.20 0.36 -0.25 -0.04 0.00 0.00 0.00 175.10 175.38 2oz8 s MET 192 N 0.18 1.54 0.10 2.72 -1.94 -0.47 -0.51 119.30 120.93 2oz8 s MET 192 Ca -0.05 -1.12 0.09 0.00 -1.71 0.00 0.00 55.69 52.89 2oz8 s MET 192 Cb -0.11 -1.78 -0.04 0.00 2.01 0.00 0.00 34.83 34.90 2oz8 s MET 192 CO 0.02 0.45 -0.19 0.96 -0.01 0.00 0.00 175.02 176.24 2oz8 s ILE 193 N -0.89 2.74 -0.35 2.53 -4.36 -0.89 -2.01 121.20 117.97 2oz8 s ILE 193 Ca 0.11 -1.48 -0.00 0.00 -0.26 0.00 0.00 60.65 59.01 2oz8 s ILE 193 Cb -0.10 -2.23 0.12 0.00 1.25 0.00 0.00 42.46 41.50 2oz8 s ILE 193 CO 0.03 0.15 0.16 -0.62 0.24 0.00 0.00 174.94 174.90 2oz8 s ASP 194 N -1.98 3.61 0.20 4.36 -1.08 -0.62 -0.50 116.67 120.65 2oz8 s ASP 194 Ca 0.17 -1.94 0.24 0.00 -0.52 0.00 0.00 52.55 50.50 2oz8 s ASP 194 Cb -0.10 -0.71 0.91 0.00 -1.46 0.00 0.00 42.92 41.56 2oz8 s ASP 194 CO 0.08 -0.36 1.73 -2.65 0.52 0.00 0.00 175.17 174.49 2oz8 n PRO 195 N 4.42 0.18 -3.92 4.34 -0.02 -1.24 -1.92 135.00 136.84 2oz8 n PRO 195 Ca 0.03 0.30 -0.27 0.00 -2.02 0.00 0.00 63.50 61.54 2oz8 n PRO 195 Cb 0.39 -1.78 -0.01 0.00 -0.02 0.00 0.00 33.50 32.08 2oz8 n PRO 195 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2oz8 n ASN 196 N -2.12 -1.21 -0.08 2.55 2.85 -1.11 -1.91 115.26 114.23 2oz8 n ASN 196 Ca 0.04 -1.02 -0.01 0.00 -0.11 0.00 0.00 54.58 53.47 2oz8 n ASN 196 Cb 0.30 -3.03 -0.00 0.00 1.24 0.00 0.00 39.78 38.29 2oz8 n ASN 196 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2oz8 n GLU 197 N -4.39 -0.71 0.30 1.20 1.02 0.63 -4.74 120.64 113.95 2oz8 n GLU 197 Ca -0.27 0.26 0.18 0.00 -0.02 0.00 0.00 57.16 57.31 2oz8 n GLU 197 Cb 0.67 -3.85 0.97 0.00 -0.02 0.00 0.00 31.44 29.21 2oz8 n GLU 197 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2oz8 h ALA 198 N 0.00 1.13 -2.84 0.62 0.00 -1.46 -3.37 119.26 113.34 2oz8 h ALA 198 Ca -0.02 -0.03 -0.59 0.00 0.00 0.00 0.00 54.91 54.27 2oz8 h ALA 198 Cb 0.39 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.10 2oz8 h ALA 198 CO 0.03 0.04 -0.58 -1.58 0.00 0.00 0.00 179.25 177.16 2oz8 s TRP 199 N -4.13 3.16 0.53 0.00 0.51 -0.88 -5.05 118.94 113.08 2oz8 s TRP 199 Ca -0.03 0.01 -0.04 0.00 -2.12 0.00 0.00 56.10 53.92 2oz8 s TRP 199 Cb 0.13 -1.54 -0.00 0.00 -0.81 0.00 0.00 33.47 31.24 2oz8 s TRP 199 CO 0.49 0.52 0.81 0.95 -0.51 0.00 0.00 176.95 179.21 2oz8 s THR 200 N -1.65 3.92 0.13 2.01 -4.23 -1.26 -4.17 115.64 110.40 2oz8 s THR 200 Ca 0.30 -0.14 -0.19 0.00 -1.18 0.00 0.00 61.69 60.48 2oz8 s THR 200 Cb -0.11 -3.51 -0.01 0.00 1.34 0.00 0.00 72.50 70.21 2oz8 s THR 200 CO 0.23 -0.47 1.70 0.77 -0.54 0.00 0.00 174.62 176.31 2oz8 h SER 201 N 0.07 -0.20 0.42 3.99 4.64 -1.94 0.29 113.55 120.82 2oz8 h SER 201 Ca -0.46 0.07 -0.17 0.00 -0.47 0.00 0.00 61.79 60.76 2oz8 h SER 201 Cb 1.25 0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 63.46 2oz8 h SER 201 CO 0.60 -0.07 -0.73 0.50 -0.87 0.00 0.00 176.83 176.26 2oz8 h LYS 202 N 0.01 0.26 -0.29 4.77 1.63 -1.96 -2.14 116.57 118.84 2oz8 h LYS 202 Ca 0.11 -0.22 0.03 0.00 -0.85 0.00 0.00 60.65 59.72 2oz8 h LYS 202 Cb 0.17 0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.82 2oz8 h LYS 202 CO -0.23 0.88 0.12 1.49 -3.45 0.00 0.00 179.45 178.26 2oz8 h GLU 203 N 0.17 0.26 -0.37 1.90 4.81 -1.89 -0.62 114.58 118.84 2oz8 h GLU 203 Ca -0.03 -0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.27 2oz8 h GLU 203 Cb 1.29 -0.06 -0.08 0.00 0.63 0.00 0.00 28.75 30.54 2oz8 h GLU 203 CO 0.12 0.17 -0.13 0.00 -0.73 0.00 0.00 179.01 178.43 2oz8 h ALA 204 N 1.17 0.18 -0.70 2.92 0.00 -0.21 -1.18 119.26 121.44 2oz8 h ALA 204 Ca 0.13 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 2oz8 h ALA 204 Cb 0.07 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2oz8 h ALA 204 CO -0.11 -0.50 0.27 1.25 0.00 0.00 0.00 179.25 180.16 2oz8 h LEU 205 N -0.05 0.98 -0.74 0.00 5.85 -1.13 0.11 115.31 120.33 2oz8 h LEU 205 Ca 0.18 -0.18 -0.13 0.00 0.84 0.00 0.00 57.88 58.59 2oz8 h LEU 205 Cb 0.33 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 2oz8 h LEU 205 CO -0.41 0.90 -0.57 0.71 -0.34 0.00 0.00 178.44 178.73 2oz8 h THR 206 N 1.01 1.38 -0.41 1.05 1.35 -0.90 -1.47 112.91 114.93 2oz8 h THR 206 Ca 0.23 -1.91 -0.07 0.00 -0.55 0.00 0.00 66.41 64.11 2oz8 h THR 206 Cb 0.23 1.97 -0.01 0.00 -1.73 0.00 0.00 68.15 68.60 2oz8 h THR 206 CO -0.02 0.56 -0.02 0.11 -0.25 0.00 0.00 175.52 175.91 2oz8 h LYS 207 N 0.14 0.73 -0.86 4.72 1.57 -0.90 -1.53 116.57 120.44 2oz8 h LYS 207 Ca -0.00 -0.24 0.03 0.00 -1.87 0.00 0.00 60.65 58.57 2oz8 h LYS 207 Cb 1.04 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 33.24 2oz8 h LYS 207 CO 0.09 0.83 0.57 -0.07 -0.57 0.00 0.00 179.45 180.29 2oz8 h LEU 208 N 0.56 0.93 -0.32 2.94 3.38 -0.66 -0.11 115.31 122.03 2oz8 h LEU 208 Ca 0.11 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 2oz8 h LEU 208 Cb 0.51 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2oz8 h LEU 208 CO 0.02 0.64 0.04 0.58 0.09 0.00 0.00 178.44 179.82 2oz8 h VAL 209 N 1.08 1.24 -0.49 1.22 2.07 -1.10 -1.61 116.25 118.65 2oz8 h VAL 209 Ca 0.34 -0.84 -0.02 0.00 0.82 0.00 0.00 66.70 67.01 2oz8 h VAL 209 Cb 0.02 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 2oz8 h VAL 209 CO -0.10 0.28 0.25 0.00 0.02 0.00 0.00 177.57 178.01 2oz8 h ALA 210 N 0.88 0.64 -0.96 1.67 0.00 -0.81 0.57 119.26 121.25 2oz8 h ALA 210 Ca 0.10 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2oz8 h ALA 210 Cb 0.36 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 2oz8 h ALA 210 CO 0.01 0.19 0.63 0.82 0.00 0.00 0.00 179.25 180.89 2oz8 h ILE 211 N 0.65 1.17 -0.27 0.00 2.04 -0.99 -0.20 117.51 119.92 2oz8 h ILE 211 Ca 0.17 -0.42 -0.11 0.00 1.00 0.00 0.00 64.86 65.51 2oz8 h ILE 211 Cb 0.10 -0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.03 2oz8 h ILE 211 CO -0.02 0.22 -0.25 -0.09 0.00 0.00 0.00 178.15 178.01 2oz8 h ARG 212 N 1.21 0.64 0.00 2.37 2.43 -0.35 -2.18 114.38 118.51 2oz8 h ARG 212 Ca 0.38 -0.33 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 2oz8 h ARG 212 Cb -0.00 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 2oz8 h ARG 212 CO -0.11 0.93 -0.10 0.93 -1.51 0.00 0.00 179.97 180.11 2oz8 h GLU 213 N 0.37 0.00 -0.00 0.20 5.08 -0.42 -0.78 114.58 119.02 2oz8 h GLU 213 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2oz8 h GLU 213 Cb 0.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.06 2oz8 h GLU 213 CO 0.06 0.10 -0.02 0.00 -1.00 0.00 0.00 179.01 178.15 2oz8 n ALA 214 N -2.32 2.66 -0.21 3.43 0.00 -0.13 -4.91 120.51 119.03 2oz8 n ALA 214 Ca -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.16 2oz8 n ALA 214 Cb 0.20 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.25 2oz8 n ALA 214 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oz8 n GLY 215 N 1.12 0.89 3.51 0.00 0.00 -0.30 -5.06 105.19 105.35 2oz8 n GLY 215 Ca 0.20 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 2oz8 n GLY 215 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2oz8 s HIS 216 N -2.00 3.21 -0.24 1.61 3.76 -0.83 -5.04 115.29 115.76 2oz8 s HIS 216 Ca 0.00 -0.29 -0.18 0.00 -0.15 0.00 0.00 55.06 54.44 2oz8 s HIS 216 Cb 0.00 -2.43 -0.03 0.00 1.11 0.00 0.00 32.58 31.23 2oz8 s HIS 216 CO 0.00 -0.37 0.50 -0.51 -0.85 0.00 0.00 174.74 173.51 2oz8 s ASP 217 N 1.69 6.46 -0.14 1.40 1.11 -1.26 -4.13 116.67 121.80 2oz8 s ASP 217 Ca 0.06 0.56 -0.04 0.00 0.18 0.00 0.00 52.55 53.30 2oz8 s ASP 217 Cb -0.17 -2.28 -0.03 0.00 1.07 0.00 0.00 42.92 41.51 2oz8 s ASP 217 CO 0.09 -0.24 0.01 -0.76 1.18 0.00 0.00 175.17 175.45 2oz8 s LEU 218 N 2.05 3.57 0.09 1.23 1.43 -1.26 -4.28 118.68 121.50 2oz8 s LEU 218 Ca 0.22 0.04 -0.18 0.00 -1.03 0.00 0.00 54.13 53.17 2oz8 s LEU 218 Cb -0.15 -1.86 -0.07 0.00 0.03 0.00 0.00 46.19 44.13 2oz8 s LEU 218 CO 0.09 0.25 1.56 0.25 0.23 0.00 0.00 176.35 178.73 2oz8 h LEU 219 N 6.15 0.42 -7.00 1.79 5.85 -1.16 -3.43 115.31 117.94 2oz8 h LEU 219 Ca -0.40 -0.27 -0.02 0.00 0.84 0.00 0.00 57.88 58.04 2oz8 h LEU 219 Cb 1.18 -0.11 -0.14 0.00 0.37 0.00 0.00 40.66 41.96 2oz8 h LEU 219 CO 0.62 0.58 0.24 -1.66 -0.34 0.00 0.00 178.44 177.88 2oz8 s TRP 220 N -5.16 -0.55 -0.15 1.25 -2.14 -1.24 -3.04 118.94 107.90 2oz8 s TRP 220 Ca -0.14 0.52 -0.03 0.00 2.66 0.00 0.00 56.10 59.12 2oz8 s TRP 220 Cb 0.08 0.52 -0.02 0.00 -3.10 0.00 0.00 33.47 30.94 2oz8 s TRP 220 CO 0.74 -0.75 -0.07 0.08 -2.66 0.00 0.00 176.95 174.29 2oz8 s VAL 221 N -3.01 3.59 -0.12 -0.66 1.01 -0.31 -2.10 120.40 118.80 2oz8 s VAL 221 Ca -0.02 -0.46 -0.03 0.00 0.00 0.00 0.00 61.98 61.47 2oz8 s VAL 221 Cb -0.01 -2.56 -0.03 0.00 0.00 0.00 0.00 36.38 33.78 2oz8 s VAL 221 CO -0.07 0.50 -0.02 -0.70 0.00 0.00 0.00 175.10 174.81 2oz8 s GLU 222 N 0.44 3.33 -1.24 2.72 2.12 0.34 -0.19 118.70 126.22 2oz8 s GLU 222 Ca -0.06 -0.47 -0.28 0.00 0.36 0.00 0.00 54.97 54.53 2oz8 s GLU 222 Cb -0.15 -2.85 0.04 0.00 0.26 0.00 0.00 34.13 31.43 2oz8 s GLU 222 CO 0.03 0.47 0.52 -0.25 -0.54 0.00 0.00 175.26 175.50 2oz8 n ASP 223 N 2.86 -2.96 0.26 -1.70 8.00 -0.01 -3.59 116.55 119.41 2oz8 n ASP 223 Ca -0.18 -1.27 0.15 0.00 0.71 0.00 0.00 54.79 54.21 2oz8 n ASP 223 Cb 0.53 -1.53 0.60 0.00 -0.02 0.00 0.00 41.12 40.70 2oz8 n ASP 223 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2oz8 h PRO 224 N -2.34 0.00 -4.01 -0.24 0.13 -1.84 0.19 132.00 123.89 2oz8 h PRO 224 Ca -0.68 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.33 2oz8 h PRO 224 Cb 1.36 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.36 2oz8 h PRO 224 CO 0.54 0.05 -0.41 0.96 -0.23 0.00 0.00 178.00 178.91 2oz8 s ILE 225 N -3.63 0.09 -0.26 -3.56 -4.36 -1.26 -2.07 121.20 106.14 2oz8 s ILE 225 Ca 0.01 -1.50 -0.24 0.00 -0.26 0.00 0.00 60.65 58.66 2oz8 s ILE 225 Cb 0.09 -1.83 -0.10 0.00 1.25 0.00 0.00 42.46 41.87 2oz8 s ILE 225 CO 0.57 -0.39 0.91 -0.11 0.24 0.00 0.00 174.94 176.16 2oz8 n LEU 226 N -0.16 0.58 0.25 0.37 7.94 -1.26 -4.50 117.00 120.21 2oz8 n LEU 226 Ca -0.08 0.56 0.17 0.00 -1.11 0.00 0.00 56.01 55.55 2oz8 n LEU 226 Cb 0.63 -0.47 0.84 0.00 0.53 0.00 0.00 43.42 44.95 2oz8 n LEU 226 CO 0.26 -0.43 1.01 0.08 -1.11 0.00 0.00 177.39 177.19 2oz8 h ARG 227 N 3.13 0.00 -0.01 1.96 0.11 -1.95 -0.41 114.38 117.21 2oz8 h ARG 227 Ca -0.19 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.89 2oz8 h ARG 227 Cb 0.73 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.81 2oz8 h ARG 227 CO 0.53 0.00 -0.18 0.72 0.10 0.00 0.00 179.97 181.13 2oz8 n HIS 228 N -2.77 0.00 -2.58 4.08 8.25 -1.26 -4.61 115.22 116.33 2oz8 n HIS 228 Ca -0.01 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.02 2oz8 n HIS 228 Cb 0.14 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.14 2oz8 n HIS 228 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2oz8 n ASP 229 N -0.59 4.95 -0.12 0.41 2.03 -0.16 -4.74 116.55 118.33 2oz8 n ASP 229 Ca 0.14 -2.97 -0.12 0.00 0.52 0.00 0.00 54.79 52.36 2oz8 n ASP 229 Cb 0.33 -1.62 -0.02 0.00 -0.72 0.00 0.00 41.12 39.09 2oz8 n ASP 229 CO 0.00 0.00 0.00 0.45 -1.92 0.00 0.00 177.20 175.73 2oz8 h HIS 230 N 6.87 0.93 -0.31 -0.67 3.86 -1.85 0.13 115.15 124.10 2oz8 h HIS 230 Ca 0.40 -0.24 0.02 0.00 -1.16 0.00 0.00 60.37 59.40 2oz8 h HIS 230 Cb 0.80 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 29.03 2oz8 h HIS 230 CO 1.27 0.99 0.14 0.22 0.86 0.00 0.00 177.93 181.41 2oz8 h ASP 231 N 0.59 0.20 -0.31 2.45 3.58 -1.95 -0.22 116.42 120.76 2oz8 h ASP 231 Ca 0.08 0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.52 2oz8 h ASP 231 Cb 0.76 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.78 2oz8 h ASP 231 CO 0.06 0.15 0.12 1.23 -2.88 0.00 0.00 179.24 177.92 2oz8 h GLY 232 N 0.30 0.56 1.27 -0.78 0.00 -1.89 -1.50 103.07 101.03 2oz8 h GLY 232 Ca 0.13 -0.27 -0.17 0.00 0.00 0.00 0.00 47.33 47.02 2oz8 h GLY 232 CO -0.10 0.26 -0.52 1.41 0.00 0.00 0.00 176.54 177.59 2oz8 h LEU 233 N 0.52 0.85 -0.26 3.11 3.38 0.10 -1.91 115.31 121.10 2oz8 h LEU 233 Ca 0.13 -0.44 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 2oz8 h LEU 233 Cb 0.15 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2oz8 h LEU 233 CO -0.01 1.21 0.12 0.03 0.09 0.00 0.00 178.44 179.88 2oz8 h ARG 234 N 0.60 0.37 -0.70 1.13 3.08 -0.87 0.14 114.38 118.14 2oz8 h ARG 234 Ca 0.02 -0.06 0.11 0.00 0.07 0.00 0.00 59.98 60.12 2oz8 h ARG 234 Cb 1.10 -0.06 -0.08 0.00 0.08 0.00 0.00 29.97 31.01 2oz8 h ARG 234 CO 0.11 0.38 0.30 1.15 -1.07 0.00 0.00 179.97 180.84 2oz8 h THR 235 N 0.27 0.76 -0.61 2.04 2.02 -1.17 0.14 112.91 116.37 2oz8 h THR 235 Ca 0.09 -0.17 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 2oz8 h THR 235 Cb 0.14 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 66.74 2oz8 h THR 235 CO -0.01 0.09 0.29 -0.07 0.37 0.00 0.00 175.52 176.19 2oz8 h LEU 236 N 0.50 0.81 -0.78 2.58 3.38 -0.80 -1.57 115.31 119.42 2oz8 h LEU 236 Ca 0.36 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 2oz8 h LEU 236 Cb 0.46 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2oz8 h LEU 236 CO -0.32 0.72 0.36 0.03 0.09 0.00 0.00 178.44 179.32 2oz8 h ARG 237 N 0.84 1.13 0.00 1.13 3.08 0.71 -1.56 114.38 119.71 2oz8 h ARG 237 Ca 0.21 -0.18 -0.18 0.00 0.07 0.00 0.00 59.98 59.90 2oz8 h ARG 237 Cb 0.13 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 2oz8 h ARG 237 CO -0.02 0.89 -0.85 0.45 -1.07 0.00 0.00 179.97 179.36 2oz8 h HIS 238 N 1.11 0.10 0.00 3.04 3.86 -0.64 -3.38 115.15 119.24 2oz8 h HIS 238 Ca 0.27 -0.06 -0.35 0.00 -1.16 0.00 0.00 60.37 59.07 2oz8 h HIS 238 Cb 0.14 -0.01 -0.06 0.00 1.06 0.00 0.00 27.41 28.53 2oz8 h HIS 238 CO 0.01 0.88 -2.23 0.00 0.86 0.00 0.00 177.93 177.46 2oz8 n ALA 239 N -2.41 1.52 -2.89 2.45 0.00 -0.60 -4.71 120.51 113.87 2oz8 n ALA 239 Ca -0.02 -1.20 -0.44 0.00 0.00 0.00 0.00 53.44 51.79 2oz8 n ALA 239 Cb 0.80 -0.34 -0.03 0.00 0.00 0.00 0.00 19.45 19.88 2oz8 n ALA 239 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2oz8 s VAL 240 N -2.53 4.63 -1.51 0.00 1.01 -0.60 -4.81 120.40 116.59 2oz8 s VAL 240 Ca -0.09 -1.42 0.25 0.00 0.00 0.00 0.00 61.98 60.72 2oz8 s VAL 240 Cb 0.07 -4.80 0.13 0.00 0.00 0.00 0.00 36.38 31.78 2oz8 s VAL 240 CO 0.83 -1.54 1.42 0.35 0.00 0.00 0.00 175.10 176.16 2oz8 n THR 241 N 5.65 0.00 0.86 3.92 -2.24 -1.26 -4.10 114.28 117.11 2oz8 n THR 241 Ca 0.23 -0.09 0.09 0.00 -2.27 0.00 0.00 64.05 62.00 2oz8 n THR 241 Cb 0.49 0.49 -0.05 0.00 -2.10 0.00 0.00 70.33 69.16 2oz8 n THR 241 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 2oz8 n TRP 242 N -0.89 0.00 -3.97 4.78 2.14 -1.26 -5.03 117.44 113.21 2oz8 n TRP 242 Ca 0.09 0.00 -0.10 0.00 2.07 0.00 0.00 57.50 59.56 2oz8 n TRP 242 Cb 0.36 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.82 2oz8 n TRP 242 CO 0.00 0.00 0.00 -0.08 2.07 0.00 0.00 177.69 179.68 2oz8 s THR 243 N -2.43 0.00 -0.03 -1.67 -1.32 -1.26 -4.79 115.64 104.14 2oz8 s THR 243 Ca 0.12 -1.33 -0.03 0.00 -1.21 0.00 0.00 61.69 59.25 2oz8 s THR 243 Cb 0.15 -2.38 -0.04 0.00 -1.51 0.00 0.00 72.50 68.72 2oz8 s THR 243 CO 0.60 0.00 0.13 -1.10 -2.21 0.00 0.00 174.62 172.05 2oz8 s GLN 244 N -3.53 3.30 -0.40 7.08 -0.21 -1.17 -4.91 119.66 119.82 2oz8 s GLN 244 Ca 0.21 -0.34 -0.15 0.00 0.02 0.00 0.00 55.36 55.10 2oz8 s GLN 244 Cb -0.02 -3.03 0.01 0.00 1.00 0.00 0.00 33.01 30.98 2oz8 s GLN 244 CO 0.11 0.69 0.32 0.42 -2.12 0.00 0.00 175.29 174.71 2oz8 s ILE 245 N -1.20 5.23 -0.21 1.08 -1.09 -1.26 -1.16 121.20 122.58 2oz8 s ILE 245 Ca 0.23 -0.52 -0.09 0.00 -2.23 0.00 0.00 60.65 58.04 2oz8 s ILE 245 Cb -0.12 -3.92 -0.05 0.00 -1.58 0.00 0.00 42.46 36.79 2oz8 s ILE 245 CO 0.14 -0.29 0.11 0.21 -1.23 0.00 0.00 174.94 173.88 2oz8 s ASN 246 N 1.71 5.89 0.02 3.58 3.84 0.73 -1.27 114.94 129.44 2oz8 s ASN 246 Ca 0.07 0.11 -0.05 0.00 0.21 0.00 0.00 52.86 53.19 2oz8 s ASN 246 Cb -0.18 -2.03 -0.01 0.00 -0.55 0.00 0.00 41.25 38.47 2oz8 s ASN 246 CO 0.11 0.13 0.09 -0.55 -2.79 0.00 0.00 177.10 174.08 2oz8 s SER 247 N 0.66 0.14 0.00 -4.21 0.15 -0.28 -0.83 113.70 109.33 2oz8 s SER 247 Ca 0.06 -0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.29 2oz8 s SER 247 Cb -0.13 0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.38 2oz8 s SER 247 CO 0.01 -0.42 0.00 0.61 1.20 0.00 0.00 173.24 174.64 2oz8 n GLY 248 N 1.14 -0.78 3.77 9.45 0.00 -1.26 -1.58 105.19 115.93 2oz8 n GLY 248 Ca -0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 2oz8 n GLY 248 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2oz8 s GLU 249 N 0.00 3.79 0.00 1.61 2.56 -1.26 -2.74 118.70 122.66 2oz8 s GLU 249 Ca 0.00 2.43 0.00 0.00 0.00 0.00 0.00 54.97 57.40 2oz8 s GLU 249 Cb 0.00 -2.73 0.00 0.00 2.00 0.00 0.00 34.13 33.40 2oz8 s GLU 249 CO 0.00 -0.74 0.00 0.66 -0.56 0.00 0.00 175.26 174.62 2oz8 n TYR 250 N -0.04 0.00 -4.23 5.30 4.02 -1.26 -4.92 117.16 116.04 2oz8 n TYR 250 Ca 0.04 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.59 2oz8 n TYR 250 Cb 0.41 -0.24 -0.08 0.00 -0.02 0.00 0.00 39.34 39.42 2oz8 n TYR 250 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2oz8 s LEU 251 N 0.00 3.73 0.00 7.72 1.43 -1.11 -5.11 118.68 125.34 2oz8 s LEU 251 Ca 0.00 0.14 -0.06 0.00 -1.03 0.00 0.00 54.13 53.18 2oz8 s LEU 251 Cb 0.00 -2.02 0.11 0.00 0.03 0.00 0.00 46.19 44.31 2oz8 s LEU 251 CO 0.00 0.33 0.66 -0.90 0.23 0.00 0.00 176.35 176.67 2oz8 n ASP 252 N 1.67 0.33 -0.17 2.29 5.68 -1.26 -4.75 116.55 120.34 2oz8 n ASP 252 Ca -0.16 -1.41 -0.02 0.00 -0.50 0.00 0.00 54.79 52.70 2oz8 n ASP 252 Cb 0.53 -0.48 0.08 0.00 -1.14 0.00 0.00 41.12 40.11 2oz8 n ASP 252 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 2oz8 h LEU 253 N 0.00 0.10 -0.76 -2.12 6.46 -1.99 0.40 115.31 117.40 2oz8 h LEU 253 Ca -0.21 0.08 -0.03 0.00 -0.12 0.00 0.00 57.88 57.59 2oz8 h LEU 253 Cb 0.66 0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 40.64 2oz8 h LEU 253 CO 0.18 0.08 0.35 1.56 -0.62 0.00 0.00 178.44 179.98 2oz8 h GLN 254 N 0.31 1.11 -0.48 1.25 7.50 -1.99 -1.01 115.11 121.80 2oz8 h GLN 254 Ca 0.26 -0.18 -0.13 0.00 0.50 0.00 0.00 58.65 59.11 2oz8 h GLN 254 Cb 0.33 -0.19 -0.01 0.00 0.05 0.00 0.00 27.48 27.66 2oz8 h GLN 254 CO -0.30 0.88 -0.21 0.78 -1.50 0.00 0.00 178.83 178.47 2oz8 h GLY 255 N 1.09 1.08 0.91 3.46 0.00 -1.51 -0.26 103.07 107.83 2oz8 h GLY 255 Ca 0.26 -0.95 -0.03 0.00 0.00 0.00 0.00 47.33 46.61 2oz8 h GLY 255 CO -0.03 0.87 0.09 0.50 0.00 0.00 0.00 176.54 177.97 2oz8 h LYS 256 N 0.86 0.48 -0.38 4.80 1.57 -0.05 0.10 116.57 123.95 2oz8 h LYS 256 Ca 0.11 -0.11 0.03 0.00 -1.87 0.00 0.00 60.65 58.82 2oz8 h LYS 256 Cb 0.79 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 33.00 2oz8 h LYS 256 CO 0.07 0.53 0.18 -0.09 -0.57 0.00 0.00 179.45 179.57 2oz8 h ARG 257 N 0.34 0.36 -0.40 3.15 2.43 -1.05 -0.36 114.38 118.86 2oz8 h ARG 257 Ca 0.10 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.20 2oz8 h ARG 257 Cb 0.25 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 2oz8 h ARG 257 CO -0.00 0.24 0.02 -0.07 -1.51 0.00 0.00 179.97 178.65 2oz8 h LEU 258 N 0.37 0.58 -0.71 3.80 3.38 -0.86 -1.50 115.31 120.38 2oz8 h LEU 258 Ca 0.16 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2oz8 h LEU 258 Cb 0.08 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2oz8 h LEU 258 CO -0.12 0.64 0.40 0.25 0.09 0.00 0.00 178.44 179.70 2oz8 h LEU 259 N 0.59 0.88 -0.58 1.67 5.85 -0.36 -2.00 115.31 121.36 2oz8 h LEU 259 Ca 0.13 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 2oz8 h LEU 259 Cb 0.34 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 2oz8 h LEU 259 CO 0.01 0.71 0.25 -0.07 -0.34 0.00 0.00 178.44 179.01 2oz8 h LEU 260 N 0.98 0.79 -1.75 2.25 3.38 -0.34 -2.74 115.31 117.87 2oz8 h LEU 260 Ca 0.25 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 2oz8 h LEU 260 Cb 0.02 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 2oz8 h LEU 260 CO -0.04 0.72 -0.15 -0.33 0.09 0.00 0.00 178.44 178.73 2oz8 h GLU 261 N 0.80 0.00 -0.00 1.13 5.08 -0.90 -1.27 114.58 119.41 2oz8 h GLU 261 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 2oz8 h GLU 261 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2oz8 h GLU 261 CO -0.02 0.15 -0.03 0.00 -1.00 0.00 0.00 179.01 178.11 2oz8 n ALA 262 N -2.47 2.67 -3.33 3.43 0.00 -0.79 -4.93 120.51 115.09 2oz8 n ALA 262 Ca -0.02 -0.25 -0.24 0.00 0.00 0.00 0.00 53.44 52.92 2oz8 n ALA 262 Cb 0.22 -1.40 0.05 0.00 0.00 0.00 0.00 19.45 18.32 2oz8 n ALA 262 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2oz8 n HIS 263 N -0.82 -2.33 -0.57 0.00 8.25 -0.48 -4.91 115.22 114.36 2oz8 n HIS 263 Ca 0.19 0.73 0.08 0.00 -0.26 0.00 0.00 57.72 58.47 2oz8 n HIS 263 Cb 0.22 -4.57 0.29 0.00 1.12 0.00 0.00 29.99 27.04 2oz8 n HIS 263 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2oz8 n ALA 264 N -4.19 2.81 -3.52 -1.41 0.00 -1.16 -4.72 120.51 108.32 2oz8 n ALA 264 Ca -0.05 -1.61 -0.12 0.00 0.00 0.00 0.00 53.44 51.66 2oz8 n ALA 264 Cb 0.59 -0.80 -0.12 0.00 0.00 0.00 0.00 19.45 19.11 2oz8 n ALA 264 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2oz8 s ALA 265 N -1.78 -0.66 0.11 0.00 0.00 -1.26 -4.70 121.76 113.46 2oz8 s ALA 265 Ca 0.42 0.98 -0.00 0.00 0.00 0.00 0.00 51.96 53.36 2oz8 s ALA 265 Cb 0.28 -0.60 -0.20 0.00 0.00 0.00 0.00 23.12 22.60 2oz8 s ALA 265 CO 0.20 -0.18 1.23 -0.44 0.00 0.00 0.00 175.76 176.57 2oz8 h ASP 266 N 6.65 0.30 -3.88 0.00 3.32 -1.53 -3.46 116.42 117.82 2oz8 h ASP 266 Ca -0.35 -0.30 -0.37 0.00 0.02 0.00 0.00 57.03 56.03 2oz8 h ASP 266 Cb 1.17 -0.09 -0.30 0.00 0.22 0.00 0.00 39.33 40.33 2oz8 h ASP 266 CO 0.35 1.19 -0.77 -0.63 -1.72 0.00 0.00 179.24 177.67 2oz8 s ILE 267 N -2.81 0.57 -0.25 0.35 1.01 -0.97 -4.27 121.20 114.82 2oz8 s ILE 267 Ca -0.03 -0.28 -0.14 0.00 0.00 0.00 0.00 60.65 60.21 2oz8 s ILE 267 Cb 0.08 -0.50 -0.04 0.00 0.01 0.00 0.00 42.46 42.01 2oz8 s ILE 267 CO 0.86 0.17 0.33 -0.22 0.00 0.00 0.00 174.94 176.08 2oz8 s LEU 268 N 0.03 4.07 0.12 2.97 2.96 -0.72 -1.13 118.68 126.97 2oz8 s LEU 268 Ca 0.00 0.27 -0.22 0.00 -0.22 0.00 0.00 54.13 53.97 2oz8 s LEU 268 Cb -0.05 -2.37 -0.07 0.00 0.50 0.00 0.00 46.19 44.20 2oz8 s LEU 268 CO -0.00 -0.12 0.66 0.54 -1.32 0.00 0.00 176.35 176.11 2oz8 s ASN 269 N 1.47 7.20 0.25 3.68 2.20 -0.61 -1.00 114.94 128.13 2oz8 s ASN 269 Ca 0.14 1.43 0.01 0.00 -0.94 0.00 0.00 52.86 53.50 2oz8 s ASN 269 Cb -0.15 -2.42 -0.04 0.00 -2.00 0.00 0.00 41.25 36.64 2oz8 s ASN 269 CO 0.09 0.24 0.15 0.68 -2.94 0.00 0.00 177.10 175.32 2oz8 s VAL 270 N -1.14 0.14 0.00 3.54 -7.23 -0.50 -4.63 120.40 110.59 2oz8 s VAL 270 Ca 0.32 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.49 2oz8 s VAL 270 Cb -0.21 -2.52 0.00 0.00 0.56 0.00 0.00 36.38 34.21 2oz8 s VAL 270 CO 0.22 0.00 0.00 1.41 -0.31 0.00 0.00 175.10 176.42 2oz8 n HIS 271 N -0.41 0.00 -0.89 2.82 8.25 -1.26 -0.69 115.22 123.04 2oz8 n HIS 271 Ca 0.02 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.57 2oz8 n HIS 271 Cb 0.65 0.00 0.26 0.00 1.12 0.00 0.00 29.99 32.03 2oz8 n HIS 271 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2oz8 n GLY 272 N 5.00 3.77 3.56 -1.41 0.00 -1.26 -4.83 105.19 110.03 2oz8 n GLY 272 Ca 0.00 -0.95 -0.30 0.00 0.00 0.00 0.00 46.02 44.77 2oz8 n GLY 272 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2oz8 s GLN 273 N -2.59 2.78 0.18 1.61 1.11 -1.26 -4.64 119.66 116.85 2oz8 s GLN 273 Ca 0.41 -0.69 -0.22 0.00 0.01 0.00 0.00 55.36 54.88 2oz8 s GLN 273 Cb 0.32 -5.17 0.10 0.00 -1.01 0.00 0.00 33.01 27.25 2oz8 s GLN 273 CO 0.11 -3.26 1.59 0.28 0.01 0.00 0.00 175.29 174.02 2oz8 h VAL 274 N 6.88 0.18 -0.41 1.09 2.07 -1.85 0.75 116.25 124.96 2oz8 h VAL 274 Ca 0.16 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.62 2oz8 h VAL 274 Cb 0.99 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 2oz8 h VAL 274 CO 1.26 0.00 0.03 0.74 0.02 0.00 0.00 177.57 179.62 2oz8 h THR 275 N -0.19 1.25 -0.92 2.57 2.02 -1.88 -2.03 112.91 113.73 2oz8 h THR 275 Ca 0.21 -0.96 0.01 0.00 0.77 0.00 0.00 66.41 66.44 2oz8 h THR 275 Cb 0.55 1.07 -0.05 0.00 -1.74 0.00 0.00 68.15 67.98 2oz8 h THR 275 CO -0.64 0.33 0.61 0.44 0.37 0.00 0.00 175.52 176.62 2oz8 h ASP 276 N 0.55 1.06 -0.48 4.18 3.32 -1.66 -2.33 116.42 121.07 2oz8 h ASP 276 Ca 0.12 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.08 2oz8 h ASP 276 Cb 0.44 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 2oz8 h ASP 276 CO 0.02 0.77 0.08 0.58 -1.72 0.00 0.00 179.24 178.97 2oz8 h VAL 277 N 1.25 1.25 -0.01 -1.35 2.07 -0.71 0.13 116.25 118.88 2oz8 h VAL 277 Ca 0.34 -0.90 -0.09 0.00 0.82 0.00 0.00 66.70 66.86 2oz8 h VAL 277 Cb -0.14 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 2oz8 h VAL 277 CO -0.07 0.32 -0.42 0.24 0.02 0.00 0.00 177.57 177.66 2oz8 h MET 278 N 0.66 0.01 -0.04 1.57 2.86 -1.31 0.34 114.93 119.02 2oz8 h MET 278 Ca 0.15 -0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.73 2oz8 h MET 278 Cb 0.38 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.04 2oz8 h MET 278 CO 0.01 0.43 -0.17 0.00 1.06 0.00 0.00 176.91 178.24 2oz8 h ARG 279 N 0.01 0.19 0.00 1.72 3.08 -1.09 -1.74 114.38 116.56 2oz8 h ARG 279 Ca -0.00 -0.15 -0.08 0.00 0.07 0.00 0.00 59.98 59.81 2oz8 h ARG 279 Cb 0.75 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 2oz8 h ARG 279 CO 0.06 0.79 -0.39 0.97 -1.07 0.00 0.00 179.97 180.33 2oz8 h ILE 280 N -0.37 1.27 -0.12 2.04 6.09 -0.71 -2.44 117.51 123.28 2oz8 h ILE 280 Ca -0.01 -1.35 -0.08 0.00 -1.37 0.00 0.00 64.86 62.04 2oz8 h ILE 280 Cb 0.82 1.73 -0.01 0.00 0.47 0.00 0.00 36.82 39.83 2oz8 h ILE 280 CO 0.04 0.39 -0.31 1.23 -3.07 0.00 0.00 178.15 176.42 2oz8 h GLY 281 N 1.20 0.24 0.77 8.18 0.00 -0.31 0.25 103.07 113.40 2oz8 h GLY 281 Ca -0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.10 2oz8 h GLY 281 CO 0.05 0.18 -0.29 -0.25 0.00 0.00 0.00 176.54 176.22 2oz8 h TRP 282 N 0.20 -0.76 -0.11 5.60 7.01 -0.90 -2.68 115.95 124.30 2oz8 h TRP 282 Ca 0.03 -0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.04 2oz8 h TRP 282 Cb 0.65 0.25 -0.06 0.00 -2.10 0.00 0.00 29.16 27.90 2oz8 h TRP 282 CO 0.01 -0.42 -0.54 1.25 -2.79 0.00 0.00 178.44 175.94 2oz8 h LEU 283 N -1.06 -1.72 -1.07 0.65 5.85 -1.41 -1.61 115.31 114.94 2oz8 h LEU 283 Ca -0.08 0.20 0.22 0.00 0.84 0.00 0.00 57.88 59.06 2oz8 h LEU 283 Cb 0.68 0.67 -0.11 0.00 0.37 0.00 0.00 40.66 42.27 2oz8 h LEU 283 CO 0.14 -0.49 0.61 0.00 -0.34 0.00 0.00 178.44 178.36 2oz8 h ALA 284 N -0.32 1.81 -0.46 1.25 0.00 -1.06 -0.14 119.26 120.34 2oz8 h ALA 284 Ca 0.03 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 2oz8 h ALA 284 Cb 0.69 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2oz8 h ALA 284 CO -0.42 -0.22 0.04 0.00 0.00 0.00 0.00 179.25 178.65 2oz8 h ALA 285 N 1.67 1.22 -0.05 0.00 0.00 -0.98 0.26 119.26 121.39 2oz8 h ALA 285 Ca 0.60 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 55.16 2oz8 h ALA 285 Cb 1.11 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2oz8 h ALA 285 CO -0.40 0.52 -0.56 0.93 0.00 0.00 0.00 179.25 179.75 2oz8 h GLU 286 N 0.69 0.14 0.00 0.00 4.39 -0.16 -3.19 114.58 116.46 2oz8 h GLU 286 Ca 0.14 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.75 2oz8 h GLU 286 Cb 0.36 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 2oz8 h GLU 286 CO 0.01 0.66 -0.84 -0.07 -1.16 0.00 0.00 179.01 177.61 2oz8 h LEU 287 N 0.11 0.00 0.00 1.33 3.38 -0.89 -3.48 115.31 115.76 2oz8 h LEU 287 Ca -0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2oz8 h LEU 287 Cb 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2oz8 h LEU 287 CO 0.08 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.22 2oz8 n GLY 288 N 1.17 0.61 3.68 0.83 0.00 -0.03 -5.06 105.19 106.38 2oz8 n GLY 288 Ca 0.01 -0.72 -0.38 0.00 0.00 0.00 0.00 46.02 44.93 2oz8 n GLY 288 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2oz8 s ILE 289 N -2.00 5.24 0.85 -0.61 -1.09 -0.51 -5.03 121.20 118.05 2oz8 s ILE 289 Ca 0.00 0.61 -0.12 0.00 -2.23 0.00 0.00 60.65 58.91 2oz8 s ILE 289 Cb 0.00 -3.68 0.10 0.00 -1.58 0.00 0.00 42.46 37.30 2oz8 s ILE 289 CO 0.00 0.29 1.13 -2.16 -1.23 0.00 0.00 174.94 172.98 2oz8 s PRO 290 N 1.10 1.62 -0.00 2.79 0.04 -1.26 -4.35 135.00 134.94 2oz8 s PRO 290 Ca 0.17 0.34 0.01 0.00 0.04 0.00 0.00 61.00 61.57 2oz8 s PRO 290 Cb -0.14 -1.89 -0.00 0.00 0.04 0.00 0.00 34.50 32.50 2oz8 s PRO 290 CO 0.07 -1.87 -0.04 0.42 0.04 0.00 0.00 177.00 175.61 2oz8 s ILE 291 N -3.32 0.34 -0.01 0.56 1.01 -0.61 -1.76 121.20 117.41 2oz8 s ILE 291 Ca 0.62 -0.21 0.05 0.00 0.00 0.00 0.00 60.65 61.11 2oz8 s ILE 291 Cb -0.14 -0.30 -0.03 0.00 0.01 0.00 0.00 42.46 42.01 2oz8 s ILE 291 CO 0.53 0.08 -0.15 -0.94 0.00 0.00 0.00 174.94 174.45 2oz8 s SER 292 N -0.15 3.97 -0.28 3.58 1.04 -0.17 -4.08 113.70 117.62 2oz8 s SER 292 Ca 0.01 -0.29 -0.17 0.00 0.48 0.00 0.00 55.95 55.98 2oz8 s SER 292 Cb -0.02 -0.76 -0.02 0.00 0.10 0.00 0.00 66.02 65.31 2oz8 s SER 292 CO -0.00 0.30 0.49 -0.63 0.98 0.00 0.00 173.24 174.38 2oz8 s ILE 293 N -0.83 5.07 0.28 -1.02 -1.09 -0.82 -1.40 121.20 121.39 2oz8 s ILE 293 Ca 0.13 0.73 -0.04 0.00 -2.23 0.00 0.00 60.65 59.24 2oz8 s ILE 293 Cb -0.11 -3.83 0.06 0.00 -1.58 0.00 0.00 42.46 37.01 2oz8 s ILE 293 CO 0.03 0.04 0.39 0.61 -1.23 0.00 0.00 174.94 174.78 2oz8 n GLY 294 N 4.52 -0.82 3.67 6.18 0.00 0.13 -0.16 105.19 118.70 2oz8 n GLY 294 Ca -0.05 -1.75 -0.52 0.00 0.00 0.00 0.00 46.02 43.70 2oz8 n GLY 294 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2oz8 n ASN 295 N -3.20 2.67 -4.45 1.61 5.03 -1.26 -4.38 115.26 111.28 2oz8 n ASN 295 Ca 0.05 1.05 -0.31 0.00 0.87 0.00 0.00 54.58 56.24 2oz8 n ASN 295 Cb 0.18 -1.26 -0.13 0.00 -1.02 0.00 0.00 39.78 37.55 2oz8 n ASN 295 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2oz8 s THR 296 N 2.79 2.79 -0.09 3.41 -4.23 -1.26 -4.69 115.64 114.35 2oz8 s THR 296 Ca 0.91 -1.04 -0.33 0.00 -1.18 0.00 0.00 61.69 60.05 2oz8 s THR 296 Cb -0.88 -2.13 -0.11 0.00 1.34 0.00 0.00 72.50 70.72 2oz8 s THR 296 CO 0.54 0.44 1.93 0.33 -0.54 0.00 0.00 174.62 177.32 2oz8 n PHE 297 N 1.87 2.31 -1.80 3.99 7.35 -1.26 -1.42 117.46 128.50 2oz8 n PHE 297 Ca -0.16 -0.06 -0.21 0.00 -0.76 0.00 0.00 57.45 56.26 2oz8 n PHE 297 Cb 0.52 -2.69 -0.07 0.00 0.35 0.00 0.00 39.48 37.60 2oz8 n PHE 297 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2oz8 n LEU 298 N 7.21 -1.60 -1.24 -2.13 4.77 -1.26 -3.37 117.00 119.39 2oz8 n LEU 298 Ca 0.24 0.38 -0.14 0.00 -0.03 0.00 0.00 56.01 56.46 2oz8 n LEU 298 Cb 0.32 -2.85 -0.04 0.00 -2.33 0.00 0.00 43.42 38.52 2oz8 n LEU 298 CO 0.72 -0.86 -0.15 -0.62 -1.33 0.00 0.00 177.39 175.15 2oz8 n GLU 299 N -2.52 -1.00 -0.35 3.23 4.71 -0.51 -4.48 120.64 119.72 2oz8 n GLU 299 Ca -0.22 0.86 0.24 0.00 -0.01 0.00 0.00 57.16 58.03 2oz8 n GLU 299 Cb 0.68 -5.00 0.49 0.00 -1.01 0.00 0.00 31.44 26.60 2oz8 n GLU 299 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2oz8 h ALA 300 N 0.24 2.12 0.00 0.62 0.00 -1.77 -1.26 119.26 119.21 2oz8 h ALA 300 Ca -0.30 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2oz8 h ALA 300 Cb 1.02 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2oz8 h ALA 300 CO 0.40 -0.64 0.00 0.41 0.00 0.00 0.00 179.25 179.42 2oz8 n GLY 301 N -1.38 -0.40 0.42 0.00 0.00 -1.26 -2.65 105.19 99.92 2oz8 n GLY 301 Ca 0.30 -0.04 0.23 0.00 0.00 0.00 0.00 46.02 46.51 2oz8 n GLY 301 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2oz8 h VAL 302 N 0.00 0.65 -0.02 1.61 3.04 -1.62 -1.33 116.25 118.58 2oz8 h VAL 302 Ca 0.00 -0.04 -0.26 0.00 -1.01 0.00 0.00 66.70 65.38 2oz8 h VAL 302 Cb 0.04 0.51 0.02 0.00 -2.01 0.00 0.00 31.29 29.85 2oz8 h VAL 302 CO 0.00 0.02 -1.01 0.45 -1.01 0.00 0.00 177.57 176.02 2oz8 h HIS 303 N 0.13 1.06 -0.10 3.17 3.86 -1.77 -1.45 115.15 120.04 2oz8 h HIS 303 Ca 0.39 -0.56 -0.15 0.00 -1.16 0.00 0.00 60.37 58.89 2oz8 h HIS 303 Cb 1.34 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 29.68 2oz8 h HIS 303 CO -0.00 1.40 -0.58 0.52 0.86 0.00 0.00 177.93 180.13 2oz8 h MET 304 N 0.42 0.31 -0.26 2.45 2.86 -1.74 -2.05 114.93 116.92 2oz8 h MET 304 Ca -0.12 -0.21 -0.02 0.00 -2.06 0.00 0.00 59.70 57.30 2oz8 h MET 304 Cb 1.66 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 33.34 2oz8 h MET 304 CO 0.20 0.80 0.10 0.00 1.06 0.00 0.00 176.91 179.08 2oz8 h ALA 305 N 1.15 0.34 0.00 6.32 0.00 -1.00 -1.05 119.26 125.02 2oz8 h ALA 305 Ca -0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 2oz8 h ALA 305 Cb 1.09 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2oz8 h ALA 305 CO 0.09 -0.06 -0.26 -0.39 0.00 0.00 0.00 179.25 178.63 2oz8 h VAL 306 N 0.27 0.51 0.00 0.00 -1.51 -1.32 -3.32 116.25 110.88 2oz8 h VAL 306 Ca 0.09 -1.43 -0.20 0.00 -1.23 0.00 0.00 66.70 63.93 2oz8 h VAL 306 Cb 0.19 2.01 -0.03 0.00 -2.13 0.00 0.00 31.29 31.33 2oz8 h VAL 306 CO -0.01 0.25 -1.24 0.00 -1.23 0.00 0.00 177.57 175.35 2oz8 h ALA 307 N 1.74 0.62 -2.68 5.19 0.00 -0.75 -3.41 119.26 119.97 2oz8 h ALA 307 Ca -0.00 -0.98 -0.54 0.00 0.00 0.00 0.00 54.91 53.39 2oz8 h ALA 307 Cb 0.99 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2oz8 h ALA 307 CO 0.03 1.15 0.17 -0.51 0.00 0.00 0.00 179.25 180.10 2oz8 s LEU 308 N -6.22 4.51 0.32 0.00 1.43 -0.46 -4.57 118.68 113.69 2oz8 s LEU 308 Ca -0.01 1.53 0.16 0.00 -1.03 0.00 0.00 54.13 54.78 2oz8 s LEU 308 Cb 0.09 -3.26 0.34 0.00 0.03 0.00 0.00 46.19 43.38 2oz8 s LEU 308 CO 0.81 0.09 1.57 1.55 0.23 0.00 0.00 176.35 180.59 2oz8 h PRO 309 N 5.14 0.00 -0.15 1.29 0.13 -1.88 -3.23 132.00 133.30 2oz8 h PRO 309 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2oz8 h PRO 309 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2oz8 h PRO 309 CO 0.69 0.47 0.00 -0.85 -0.23 0.00 0.00 178.00 178.08 2oz8 n GLU 310 N -3.37 1.30 -4.13 0.86 0.00 -1.26 -4.79 120.64 109.24 2oz8 n GLU 310 Ca 0.01 -0.44 -0.35 0.00 0.00 0.00 0.00 57.16 56.38 2oz8 n GLU 310 Cb 0.64 -1.11 -0.12 0.00 0.00 0.00 0.00 31.44 30.84 2oz8 n GLU 310 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2oz8 s VAL 311 N -1.82 3.95 -0.11 3.84 1.01 -1.22 -1.58 120.40 124.48 2oz8 s VAL 311 Ca 0.08 -0.32 0.05 0.00 0.00 0.00 0.00 61.98 61.79 2oz8 s VAL 311 Cb 0.04 -2.78 -0.06 0.00 0.00 0.00 0.00 36.38 33.59 2oz8 s VAL 311 CO 0.05 0.44 0.15 -1.84 0.00 0.00 0.00 175.10 173.90 2oz8 n GLU 312 N 4.10 2.75 -4.46 2.72 0.28 -1.26 -4.92 120.64 119.85 2oz8 n GLU 312 Ca -0.17 -0.02 -0.20 0.00 -0.16 0.00 0.00 57.16 56.61 2oz8 n GLU 312 Cb 0.52 -0.92 -0.15 0.00 1.43 0.00 0.00 31.44 32.32 2oz8 n GLU 312 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 2oz8 s TRP 313 N -1.89 0.98 -0.05 -1.84 0.52 -1.26 -3.41 118.94 111.99 2oz8 s TRP 313 Ca -0.00 -0.20 0.04 0.00 0.02 0.00 0.00 56.10 55.96 2oz8 s TRP 313 Cb 0.03 -0.64 0.00 0.00 -1.15 0.00 0.00 33.47 31.71 2oz8 s TRP 313 CO 0.19 -0.03 -0.16 -1.17 0.02 0.00 0.00 176.95 175.80 2oz8 s LEU 314 N -0.17 1.87 0.06 2.99 0.20 -0.44 -1.95 118.68 121.24 2oz8 s LEU 314 Ca 0.03 -0.34 -0.30 0.00 0.69 0.00 0.00 54.13 54.20 2oz8 s LEU 314 Cb -0.05 -0.94 -0.05 0.00 -0.43 0.00 0.00 46.19 44.72 2oz8 s LEU 314 CO -0.00 0.13 1.00 -0.70 -0.29 0.00 0.00 176.35 176.48 2oz8 s GLU 315 N 0.19 4.61 -0.05 1.98 2.12 0.77 -1.84 118.70 126.47 2oz8 s GLU 315 Ca -0.07 1.48 0.03 0.00 0.36 0.00 0.00 54.97 56.77 2oz8 s GLU 315 Cb -0.13 -3.40 0.01 0.00 0.26 0.00 0.00 34.13 30.87 2oz8 s GLU 315 CO 0.03 0.05 -0.12 -0.47 -0.54 0.00 0.00 175.26 174.21 2oz8 s TYR 316 N 0.51 1.36 -0.02 5.30 5.04 -0.81 -4.32 117.35 124.41 2oz8 s TYR 316 Ca 0.50 -0.44 0.03 0.00 -2.44 0.00 0.00 57.07 54.72 2oz8 s TYR 316 Cb -0.23 -0.98 0.05 0.00 0.35 0.00 0.00 41.96 41.15 2oz8 s TYR 316 CO 0.29 -0.21 0.98 0.43 -1.34 0.00 0.00 175.55 175.71 2oz8 n SER 317 N 3.58 1.85 -2.72 4.32 7.64 -1.26 -0.99 113.62 126.03 2oz8 n SER 317 Ca -0.21 -2.09 -0.20 0.00 1.01 0.00 0.00 58.87 57.38 2oz8 n SER 317 Cb 0.52 -0.07 0.01 0.00 -1.01 0.00 0.00 64.21 63.66 2oz8 n SER 317 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2oz8 n PHE 318 N -0.60 -1.50 -2.16 1.43 3.72 -1.26 -4.84 117.46 112.25 2oz8 n PHE 318 Ca 0.03 0.22 -0.34 0.00 -0.05 0.00 0.00 57.45 57.31 2oz8 n PHE 318 Cb 0.34 -3.77 0.01 0.00 -0.94 0.00 0.00 39.48 35.12 2oz8 n PHE 318 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 2oz8 s GLN 319 N -5.37 3.26 -1.28 -1.08 -0.21 -1.26 -4.81 119.66 108.92 2oz8 s GLN 319 Ca 0.15 1.53 -0.15 0.00 0.02 0.00 0.00 55.36 56.91 2oz8 s GLN 319 Cb -0.07 -2.00 0.12 0.00 1.00 0.00 0.00 33.01 32.06 2oz8 s GLN 319 CO 0.18 -0.90 1.67 0.27 -2.12 0.00 0.00 175.29 174.39 2oz8 n ASN 320 N -1.55 4.98 0.00 5.90 6.94 -1.26 -4.52 115.26 125.75 2oz8 n ASN 320 Ca 0.11 -2.96 0.00 0.00 -0.02 0.00 0.00 54.58 51.71 2oz8 n ASN 320 Cb 0.51 -1.63 0.00 0.00 -2.36 0.00 0.00 39.78 36.30 2oz8 n ASN 320 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 2oz8 n PHE 321 N 6.44 0.00 0.22 -2.53 3.72 -1.26 -4.83 117.46 119.22 2oz8 n PHE 321 Ca 0.43 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.89 2oz8 n PHE 321 Cb 0.43 0.00 0.50 0.00 -0.94 0.00 0.00 39.48 39.47 2oz8 n PHE 321 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2oz8 h ASP 322 N 0.00 0.00 0.08 4.37 5.19 -1.92 -2.31 116.42 121.83 2oz8 h ASP 322 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2oz8 h ASP 322 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 2oz8 h ASP 322 CO 0.00 0.25 0.00 1.12 -3.12 0.00 0.00 179.24 177.49 2oz8 h HIS 323 N 0.00 0.00 0.00 4.55 2.07 -1.90 -2.08 115.15 117.79 2oz8 h HIS 323 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2oz8 h HIS 323 Cb 0.49 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.47 2oz8 h HIS 323 CO 0.00 0.00 0.00 -0.07 -3.07 0.00 0.00 177.93 174.79 2oz8 h LEU 324 N 0.00 0.00 -8.91 6.12 3.38 -1.80 -3.41 115.31 110.68 2oz8 h LEU 324 Ca 0.00 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.53 2oz8 h LEU 324 Cb 0.04 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.65 2oz8 h LEU 324 CO 0.00 0.00 -0.72 0.68 0.09 0.00 0.00 178.44 178.49 2oz8 s VAL 325 N -3.22 1.62 -0.00 1.22 -7.23 -0.78 -0.18 120.40 111.83 2oz8 s VAL 325 Ca 0.08 -2.17 -0.24 0.00 -1.81 0.00 0.00 61.98 57.84 2oz8 s VAL 325 Cb 0.09 -2.12 -0.15 0.00 0.56 0.00 0.00 36.38 34.75 2oz8 s VAL 325 CO 0.60 -0.54 1.12 -0.33 -0.31 0.00 0.00 175.10 175.64 2oz8 h GLU 326 N 2.52 -0.46 -3.75 4.82 5.08 -1.10 -3.43 114.58 118.25 2oz8 h GLU 326 Ca -0.38 0.03 -0.49 0.00 -1.00 0.00 0.00 59.36 57.52 2oz8 h GLU 326 Cb 1.22 0.11 -0.39 0.00 0.50 0.00 0.00 28.75 30.19 2oz8 h GLU 326 CO 0.63 -0.14 -0.77 1.14 -1.00 0.00 0.00 179.01 178.87 2oz8 s GLN 327 N -4.39 0.81 0.94 2.33 -2.07 -1.26 -5.06 119.66 110.94 2oz8 s GLN 327 Ca -0.13 -0.18 -0.12 0.00 -1.82 0.00 0.00 55.36 53.11 2oz8 s GLN 327 Cb 0.02 -1.54 0.15 0.00 -1.09 0.00 0.00 33.01 30.55 2oz8 s GLN 327 CO 0.49 -0.43 1.10 -1.25 -1.32 0.00 0.00 175.29 173.88 2oz8 s PRO 328 N 1.87 0.94 0.08 9.60 0.04 -1.26 -4.70 135.00 141.56 2oz8 s PRO 328 Ca 0.03 0.65 -0.31 0.00 0.04 0.00 0.00 61.00 61.40 2oz8 s PRO 328 Cb -0.14 -1.79 -0.08 0.00 0.04 0.00 0.00 34.50 32.53 2oz8 s PRO 328 CO -0.07 -2.42 1.63 0.42 0.04 0.00 0.00 177.00 176.61 2oz8 s ILE 329 N -2.98 3.03 0.14 0.56 -1.09 -1.26 -4.98 121.20 114.62 2oz8 s ILE 329 Ca 0.64 0.51 -0.31 0.00 -2.23 0.00 0.00 60.65 59.26 2oz8 s ILE 329 Cb -0.18 -3.33 -0.10 0.00 -1.58 0.00 0.00 42.46 37.27 2oz8 s ILE 329 CO 0.57 0.00 1.76 -0.70 -1.23 0.00 0.00 174.94 175.34 2oz8 s GLU 330 N 2.48 4.15 -0.17 2.79 2.12 -1.26 -4.92 118.70 123.88 2oz8 s GLU 330 Ca 0.73 2.54 0.00 0.00 0.36 0.00 0.00 54.97 58.61 2oz8 s GLU 330 Cb -0.40 -3.42 0.03 0.00 0.26 0.00 0.00 34.13 30.61 2oz8 s GLU 330 CO 0.32 -0.78 -0.11 0.42 -0.54 0.00 0.00 175.26 174.57 2oz8 s ILE 331 N 2.17 1.52 -0.08 -3.70 1.01 -1.26 -0.96 121.20 119.90 2oz8 s ILE 331 Ca 0.77 -0.79 0.00 0.00 0.00 0.00 0.00 60.65 60.63 2oz8 s ILE 331 Cb -0.46 -1.55 0.02 0.00 0.01 0.00 0.00 42.46 40.49 2oz8 s ILE 331 CO 0.34 0.27 -0.07 -0.60 0.00 0.00 0.00 174.94 174.89 2oz8 s ARG 332 N 1.47 1.25 -1.48 2.79 3.52 0.17 -4.83 118.95 121.85 2oz8 s ARG 332 Ca 0.01 -0.19 -0.08 0.00 -0.13 0.00 0.00 55.73 55.34 2oz8 s ARG 332 Cb -0.15 -1.28 0.06 0.00 -1.56 0.00 0.00 34.95 32.02 2oz8 s ARG 332 CO -0.09 -0.17 0.76 -0.25 -0.81 0.00 0.00 175.30 174.74 2oz8 n ASP 333 N 4.55 -2.66 -0.20 -2.12 8.00 -1.25 -2.04 116.55 120.83 2oz8 n ASP 333 Ca -0.16 -0.88 -0.03 0.00 0.71 0.00 0.00 54.79 54.44 2oz8 n ASP 333 Cb 0.51 -3.57 -0.01 0.00 -0.02 0.00 0.00 41.12 38.02 2oz8 n ASP 333 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2oz8 n GLY 334 N -1.68 0.56 3.26 0.44 0.00 -1.14 -4.73 105.19 101.91 2oz8 n GLY 334 Ca -0.12 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.27 2oz8 n GLY 334 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2oz8 s TYR 335 N -1.93 2.39 -0.06 1.61 2.02 -0.87 -0.74 117.35 119.77 2oz8 s TYR 335 Ca 0.00 -0.69 -0.12 0.00 -0.37 0.00 0.00 57.07 55.88 2oz8 s TYR 335 Cb 0.00 -1.56 -0.05 0.00 -0.40 0.00 0.00 41.96 39.95 2oz8 s TYR 335 CO 0.00 -0.20 0.32 0.00 -1.57 0.00 0.00 175.55 174.09 2oz8 s ALA 336 N -0.18 3.73 -0.17 3.71 0.00 0.24 -0.66 121.76 128.42 2oz8 s ALA 336 Ca -0.03 -0.37 -0.00 0.00 0.00 0.00 0.00 51.96 51.56 2oz8 s ALA 336 Cb -0.13 -2.27 0.00 0.00 0.00 0.00 0.00 23.12 20.71 2oz8 s ALA 336 CO 0.03 0.45 -0.14 0.71 0.00 0.00 0.00 175.76 176.81 2oz8 s TYR 337 N -0.81 2.81 -0.22 0.00 2.02 -0.13 -1.00 117.35 120.03 2oz8 s TYR 337 Ca 0.20 -1.12 -0.29 0.00 -0.37 0.00 0.00 57.07 55.49 2oz8 s TYR 337 Cb -0.15 -1.93 0.00 0.00 -0.40 0.00 0.00 41.96 39.49 2oz8 s TYR 337 CO 0.09 -0.54 1.15 0.00 -1.57 0.00 0.00 175.55 174.68 2oz8 s ALA 338 N 0.99 3.64 0.79 3.71 0.00 -0.11 -4.21 121.76 126.58 2oz8 s ALA 338 Ca -0.02 0.26 -0.11 0.00 0.00 0.00 0.00 51.96 52.10 2oz8 s ALA 338 Cb -0.15 -3.60 0.07 0.00 0.00 0.00 0.00 23.12 19.44 2oz8 s ALA 338 CO -0.03 -1.18 1.09 -1.25 0.00 0.00 0.00 175.76 174.39 2oz8 s PRO 339 N 3.42 2.10 -0.20 0.00 0.04 -1.26 -4.88 135.00 134.22 2oz8 s PRO 339 Ca 0.49 1.08 0.07 0.00 0.04 0.00 0.00 61.00 62.69 2oz8 s PRO 339 Cb -0.17 -1.88 0.52 0.00 0.04 0.00 0.00 34.50 33.00 2oz8 s PRO 339 CO 0.11 -1.73 1.42 -3.47 0.04 0.00 0.00 177.00 173.37 2oz8 n ASP 340 N -3.57 3.98 -4.93 6.66 2.03 -1.26 -4.86 116.55 114.60 2oz8 n ASP 340 Ca 0.09 -2.76 -0.25 0.00 0.52 0.00 0.00 54.79 52.39 2oz8 n ASP 340 Cb 0.53 -0.66 0.01 0.00 -0.72 0.00 0.00 41.12 40.29 2oz8 n ASP 340 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2oz8 s ARG 341 N -2.19 3.14 0.68 -0.67 0.52 -1.26 -4.81 118.95 114.37 2oz8 s ARG 341 Ca 0.37 -0.20 -0.13 0.00 -0.52 0.00 0.00 55.73 55.25 2oz8 s ARG 341 Cb 0.29 -2.45 0.00 0.00 0.52 0.00 0.00 34.95 33.32 2oz8 s ARG 341 CO 0.10 -0.35 1.07 -1.25 0.02 0.00 0.00 175.30 174.88 2oz8 s PRO 342 N -4.70 2.90 3.00 3.54 0.04 -1.26 -3.38 135.00 135.14 2oz8 s PRO 342 Ca 0.49 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.65 2oz8 s PRO 342 Cb -0.10 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.46 2oz8 s PRO 342 CO 0.41 -1.14 0.00 0.41 0.04 0.00 0.00 177.00 176.73 2oz8 n GLY 343 N -1.37 0.07 0.09 0.56 0.00 -0.54 -3.15 105.19 100.85 2oz8 n GLY 343 Ca 0.08 -0.95 0.15 0.00 0.00 0.00 0.00 46.02 45.30 2oz8 n GLY 343 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2oz8 n HIS 344 N 0.00 0.00 -0.78 1.61 1.44 -1.26 0.70 115.22 116.93 2oz8 n HIS 344 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2oz8 n HIS 344 Cb 0.00 -0.14 0.00 0.00 0.12 0.00 0.00 29.99 29.97 2oz8 n HIS 344 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2oz8 n GLY 345 N 1.19 0.81 3.65 -1.39 0.00 -1.19 -4.83 105.19 103.44 2oz8 n GLY 345 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 2oz8 n GLY 345 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oz8 s LEU 346 N 0.00 4.09 -0.07 0.99 1.43 -1.26 -4.75 118.68 119.12 2oz8 s LEU 346 Ca 0.00 0.10 0.02 0.00 -1.03 0.00 0.00 54.13 53.22 2oz8 s LEU 346 Cb 0.00 -2.10 0.01 0.00 0.03 0.00 0.00 46.19 44.13 2oz8 s LEU 346 CO 0.00 0.06 -0.13 -0.69 0.23 0.00 0.00 176.35 175.83 2oz8 s VAL 347 N 1.08 1.16 0.37 -1.59 1.01 -1.26 -4.82 120.40 116.35 2oz8 s VAL 347 Ca 0.07 -0.49 -0.28 0.00 0.00 0.00 0.00 61.98 61.28 2oz8 s VAL 347 Cb -0.14 -1.06 -0.11 0.00 0.00 0.00 0.00 36.38 35.08 2oz8 s VAL 347 CO 0.05 0.36 1.48 -0.22 0.00 0.00 0.00 175.10 176.77 2oz8 s LEU 348 N 0.64 4.32 -0.11 3.92 2.96 -1.26 -0.62 118.68 128.54 2oz8 s LEU 348 Ca -0.15 3.03 -0.27 0.00 -0.22 0.00 0.00 54.13 56.52 2oz8 s LEU 348 Cb -0.16 -3.67 -0.02 0.00 0.50 0.00 0.00 46.19 42.85 2oz8 s LEU 348 CO 0.04 -0.86 0.90 -0.55 -1.32 0.00 0.00 176.35 174.56 2oz8 s SER 349 N -0.15 7.12 0.23 3.68 0.15 0.74 -4.55 113.70 120.93 2oz8 s SER 349 Ca 0.53 1.37 -0.05 0.00 0.70 0.00 0.00 55.95 58.49 2oz8 s SER 349 Cb -0.46 -2.50 0.22 0.00 -1.71 0.00 0.00 66.02 61.57 2oz8 s SER 349 CO 0.62 -0.37 1.74 -0.33 1.20 0.00 0.00 173.24 176.10 2oz8 h GLU 350 N 7.11 0.98 -0.66 5.44 4.39 -1.92 -0.11 114.58 129.81 2oz8 h GLU 350 Ca -0.33 -0.25 0.05 0.00 0.34 0.00 0.00 59.36 59.18 2oz8 h GLU 350 Cb 1.15 -0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 29.63 2oz8 h GLU 350 CO 0.83 0.91 0.37 0.87 -1.16 0.00 0.00 179.01 180.83 2oz8 h LYS 351 N 0.92 0.67 -0.25 2.33 1.57 -1.95 -2.60 116.57 117.27 2oz8 h LYS 351 Ca 0.19 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.91 2oz8 h LYS 351 Cb 0.41 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 2oz8 h LYS 351 CO 0.01 0.45 0.09 0.00 -0.57 0.00 0.00 179.45 179.43 2oz8 h ALA 352 N 1.33 0.33 -0.10 3.86 0.00 -1.60 -1.36 119.26 121.72 2oz8 h ALA 352 Ca 0.29 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.10 2oz8 h ALA 352 Cb 0.16 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2oz8 h ALA 352 CO -0.17 -0.06 0.24 -0.09 0.00 0.00 0.00 179.25 179.17 2oz8 h ARG 353 N 0.25 0.00 0.00 0.00 2.43 -0.83 0.08 114.38 116.30 2oz8 h ARG 353 Ca 0.08 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 59.07 2oz8 h ARG 353 Cb 0.21 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.73 2oz8 h ARG 353 CO -0.00 0.00 -1.07 0.78 -1.51 0.00 0.00 179.97 178.16 2oz8 h GLY 354 N 0.00 0.00 1.11 2.80 0.00 -1.01 -3.31 103.07 102.67 2oz8 h GLY 354 Ca 0.05 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.22 2oz8 h GLY 354 CO -0.00 0.00 -0.40 0.83 0.00 0.00 0.00 176.54 176.97 2oz8 h GLU 355 N -1.00 0.90 -0.01 4.80 5.08 -1.22 -3.37 114.58 119.77 2oz8 h GLU 355 Ca -0.28 -0.49 0.00 0.00 -1.00 0.00 0.00 59.36 57.59 2oz8 h GLU 355 Cb 1.17 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2oz8 h GLU 355 CO -0.17 1.14 -0.46 0.91 -1.00 0.00 0.00 179.01 179.43 2oz8 n TRP 356 N -4.08 0.00 -1.74 4.33 7.02 0.01 -4.98 117.44 118.00 2oz8 n TRP 356 Ca -0.03 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.03 2oz8 n TRP 356 Cb 0.55 0.00 -0.01 0.00 -2.42 0.00 0.00 31.31 29.43 2oz8 n TRP 356 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2oz8 n SER 357 N -0.50 3.78 -3.54 -0.99 2.88 -1.25 -4.58 113.62 109.42 2oz8 n SER 357 Ca 0.06 1.15 -0.29 0.00 -1.33 0.00 0.00 58.87 58.46 2oz8 n SER 357 Cb 0.31 -1.59 -0.12 0.00 -0.75 0.00 0.00 64.21 62.07 2oz8 n SER 357 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2oz8 s ARG 358 N -0.64 0.92 0.53 -1.46 1.81 0.13 -4.99 118.95 115.24 2oz8 s ARG 358 Ca 0.63 -1.75 0.29 0.00 -1.72 0.00 0.00 55.73 53.18 2oz8 s ARG 358 Cb -0.50 -1.73 1.50 0.00 -0.45 0.00 0.00 34.95 33.77 2oz8 s ARG 358 CO 0.50 -1.23 2.08 -1.35 -0.68 0.00 0.00 175.30 174.62 2oz8 h PRO 359 N 6.62 0.00 -5.30 3.54 0.11 -1.94 -3.41 132.00 131.62 2oz8 h PRO 359 Ca 0.08 0.00 -0.66 0.00 0.11 0.00 0.00 66.00 65.53 2oz8 h PRO 359 Cb 0.94 0.00 -0.29 0.00 0.11 0.00 0.00 31.00 31.76 2oz8 h PRO 359 CO 0.37 0.10 -0.79 0.50 -0.21 0.00 0.00 178.00 177.97 2oz8 s ARG 360 N -4.14 3.30 0.08 1.05 6.06 -1.26 0.22 118.95 124.26 2oz8 s ARG 360 Ca -0.03 -0.73 -0.31 0.00 -2.50 0.00 0.00 55.73 52.17 2oz8 s ARG 360 Cb 0.13 -2.57 -0.09 0.00 0.06 0.00 0.00 34.95 32.47 2oz8 s ARG 360 CO 0.57 0.17 1.81 0.50 -2.50 0.00 0.00 175.30 175.86 2oz8 s ARG 361 N 0.43 4.15 0.20 5.12 3.52 -1.26 -5.00 118.95 126.11 2oz8 s ARG 361 Ca -0.11 2.52 0.05 0.00 -0.13 0.00 0.00 55.73 58.06 2oz8 s ARG 361 Cb -0.16 -3.75 -0.04 0.00 -1.56 0.00 0.00 34.95 29.44 2oz8 s ARG 361 CO 0.05 -0.85 0.21 -0.51 -0.81 0.00 0.00 175.30 173.40 2oz8 s LEU 362 N 3.19 3.97 0.67 -0.88 1.43 -1.26 -5.06 118.68 120.74 2oz8 s LEU 362 Ca 0.81 -0.10 -0.15 0.00 -1.03 0.00 0.00 54.13 53.66 2oz8 s LEU 362 Cb -0.43 -2.53 0.01 0.00 0.03 0.00 0.00 46.19 43.26 2oz8 s LEU 362 CO 0.36 0.01 1.12 0.00 0.23 0.00 0.00 176.35 178.07 2oz8 s ALA 363 N -1.92 2.40 0.31 4.21 0.00 -1.26 -4.96 121.76 120.54 2oz8 s ALA 363 Ca 0.33 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.88 2oz8 s ALA 363 Cb -0.09 -3.34 0.52 0.00 0.00 0.00 0.00 23.12 20.21 2oz8 s ALA 363 CO 0.26 -1.39 1.93 -0.09 0.00 0.00 0.00 175.76 176.47 2oz8 h ARG 364 N -0.06 1.01 0.00 0.00 9.65 -2.03 -2.52 114.38 120.43 2oz8 h ARG 364 Ca -0.47 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.35 2oz8 h ARG 364 Cb 1.25 -0.23 0.00 0.00 -1.39 0.00 0.00 29.97 29.61 2oz8 h ARG 364 CO 0.53 0.67 0.00 0.66 2.80 0.00 0.00 179.97 184.63 2oz8 h SER 365 N 1.04 0.00 -0.37 -3.80 4.64 -2.01 -2.81 113.55 110.24 2oz8 h SER 365 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 2oz8 h SER 365 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2oz8 h SER 365 CO -0.12 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.22 2oz8 n GLU 366 N -2.69 1.92 0.10 4.77 1.02 -0.95 -4.49 120.64 120.33 2oz8 n GLU 366 Ca -0.00 -1.43 0.12 0.00 -0.02 0.00 0.00 57.16 55.83 2oz8 n GLU 366 Cb 0.16 -1.33 0.23 0.00 -0.02 0.00 0.00 31.44 30.48 2oz8 n GLU 366 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2oz8 h LEU 367 N 2.41 0.00 0.00 -4.62 4.07 -1.62 -3.48 115.31 112.06 2oz8 h LEU 367 Ca 0.00 -0.09 0.09 0.00 0.08 0.00 0.00 57.88 57.96 2oz8 h LEU 367 Cb 0.55 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.26 2oz8 h LEU 367 CO 0.00 0.05 -0.12 0.61 -1.08 0.00 0.00 178.44 177.90 2oz8 n GLY 368 N 1.28 -1.80 3.66 0.83 0.00 -1.26 -4.59 105.19 103.31 2oz8 n GLY 368 Ca 0.04 -1.28 -0.38 0.00 0.00 0.00 0.00 46.02 44.39 2oz8 n GLY 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oz8 n ALA 369 N -0.76 0.67 -1.77 4.61 0.00 -1.26 -4.59 120.51 117.41 2oz8 n ALA 369 Ca 0.00 0.07 -0.39 0.00 0.00 0.00 0.00 53.44 53.12 2oz8 n ALA 369 Cb 0.15 -2.19 -0.01 0.00 0.00 0.00 0.00 19.45 17.39 2oz8 n ALA 369 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2oz8 s ALA 370 N -1.40 3.28 0.42 0.00 0.00 -1.26 -4.64 121.76 118.15 2oz8 s ALA 370 Ca 0.73 1.18 -0.24 0.00 0.00 0.00 0.00 51.96 53.63 2oz8 s ALA 370 Cb -0.43 -3.46 -0.11 0.00 0.00 0.00 0.00 23.12 19.12 2oz8 s ALA 370 CO 0.49 -0.73 0.97 -2.30 0.00 0.00 0.00 175.76 174.19 2oz8 n PRO 371 N 0.24 1.27 -1.86 0.00 -0.02 -1.26 -4.94 135.00 128.44 2oz8 n PRO 371 Ca 0.03 0.46 -0.35 0.00 -2.02 0.00 0.00 63.50 61.61 2oz8 n PRO 371 Cb 0.44 -1.98 0.05 0.00 -0.02 0.00 0.00 33.50 31.98 2oz8 n PRO 371 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2oz8 s GLU 372 N -1.97 2.77 -0.52 -0.52 2.02 -1.26 -4.73 118.70 114.49 2oz8 s GLU 372 Ca 0.63 1.76 0.04 0.00 0.02 0.00 0.00 54.97 57.42 2oz8 s GLU 372 Cb -0.57 -1.91 0.14 0.00 0.10 0.00 0.00 34.13 31.89 2oz8 s GLU 372 CO 0.57 -1.35 0.29 1.21 0.02 0.00 0.00 175.26 176.00 2oz8 s ASN 373 N -1.80 4.10 0.00 -0.19 2.47 -1.26 -4.87 114.94 113.39 2oz8 s ASN 373 Ca 0.76 -3.02 0.08 0.00 0.42 0.00 0.00 52.86 51.09 2oz8 s ASN 373 Cb -0.29 -1.42 0.39 0.00 -1.45 0.00 0.00 41.25 38.48 2oz8 s ASN 373 CO 0.37 -0.22 1.13 -0.81 -3.72 0.00 0.00 177.10 173.85 2oz8 n PRO 374 N 3.07 0.10 0.03 0.43 -0.04 -1.26 -2.14 135.00 135.18 2oz8 n PRO 374 Ca 0.09 0.23 0.12 0.00 -0.04 0.00 0.00 63.50 63.90 2oz8 n PRO 374 Cb 0.34 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.50 2oz8 n PRO 374 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2oz8 n ARG 375 N -1.31 0.15 -4.41 0.54 5.12 -1.26 -4.82 116.66 110.67 2oz8 n ARG 375 Ca 0.04 0.03 -0.24 0.00 -1.93 0.00 0.00 57.85 55.75 2oz8 n ARG 375 Cb 0.07 -1.58 -0.09 0.00 -1.16 0.00 0.00 32.46 29.69 2oz8 n ARG 375 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2oz8 s LEU 376 N -3.59 2.86 0.00 0.55 1.43 -0.91 -4.98 118.68 114.03 2oz8 s LEU 376 Ca 0.08 -0.98 0.14 0.00 -1.03 0.00 0.00 54.13 52.34 2oz8 s LEU 376 Cb 0.16 -1.28 0.84 0.00 0.03 0.00 0.00 46.19 45.94 2oz8 s LEU 376 CO 0.71 -0.11 1.26 -2.65 0.23 0.00 0.00 176.35 175.80