#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 5.99 0.21 -1.43 0.01 -1.26 -4.50 113.70 112.72 2oz8 s SER 2 Ca 0.00 0.99 -0.30 0.00 1.31 0.00 0.00 55.95 57.95 2oz8 s SER 2 Cb 0.00 -2.12 -0.09 0.00 0.21 0.00 0.00 66.02 64.02 2oz8 s SER 2 CO 0.00 -0.85 1.37 -0.76 0.41 0.00 0.00 173.24 173.41 2oz8 s LEU 3 N -4.97 4.40 0.00 2.44 1.43 0.33 0.28 118.68 122.60 2oz8 s LEU 3 Ca 0.52 2.51 0.00 0.00 -1.03 0.00 0.00 54.13 56.12 2oz8 s LEU 3 Cb -0.11 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.50 2oz8 s LEU 3 CO 0.48 -0.60 0.00 -1.54 0.23 0.00 0.00 176.35 174.91 2oz8 n SER 4 N 2.59 2.99 -3.94 2.29 3.41 -0.11 -1.41 113.62 119.44 2oz8 n SER 4 Ca 0.07 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.58 2oz8 n SER 4 Cb 0.42 0.30 -0.10 0.00 -0.26 0.00 0.00 64.21 64.57 2oz8 n SER 4 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2oz8 s HIS 5 N -1.59 0.19 0.30 7.33 3.76 -1.13 -4.98 115.29 119.16 2oz8 s HIS 5 Ca 0.00 -0.43 0.11 0.00 -0.15 0.00 0.00 55.06 54.59 2oz8 s HIS 5 Cb 0.00 -0.14 -0.05 0.00 1.11 0.00 0.00 32.58 33.49 2oz8 s HIS 5 CO 0.00 -0.28 -0.13 -0.59 -0.85 0.00 0.00 174.74 172.90 2oz8 s PHE 6 N -1.86 2.40 -0.03 1.40 -0.12 -1.26 0.06 117.98 118.57 2oz8 s PHE 6 Ca -0.12 -0.36 -0.01 0.00 -0.05 0.00 0.00 56.93 56.40 2oz8 s PHE 6 Cb -0.06 -1.15 0.03 0.00 -0.63 0.00 0.00 43.02 41.21 2oz8 s PHE 6 CO -0.02 0.65 0.06 0.50 -0.05 0.00 0.00 175.22 176.36 2oz8 s ARG 7 N -3.58 -0.02 -0.13 1.99 3.52 -0.07 -4.97 118.95 115.70 2oz8 s ARG 7 Ca 0.31 0.24 0.00 0.00 -0.13 0.00 0.00 55.73 56.15 2oz8 s ARG 7 Cb -0.03 -0.25 -0.01 0.00 -1.56 0.00 0.00 34.95 33.09 2oz8 s ARG 7 CO 0.16 -0.18 -0.13 0.42 -0.81 0.00 0.00 175.30 174.76 2oz8 s ILE 8 N 1.19 3.02 -0.20 4.11 -1.09 -1.26 -0.89 121.20 126.08 2oz8 s ILE 8 Ca -0.08 -0.67 0.01 0.00 -2.23 0.00 0.00 60.65 57.68 2oz8 s ILE 8 Cb -0.13 -2.27 0.04 0.00 -1.58 0.00 0.00 42.46 38.52 2oz8 s ILE 8 CO -0.04 0.53 -0.15 -0.89 -1.23 0.00 0.00 174.94 173.16 2oz8 s THR 9 N 0.33 1.96 0.18 2.92 2.01 -0.89 -4.97 115.64 117.18 2oz8 s THR 9 Ca -0.11 -1.11 -0.28 0.00 0.31 0.00 0.00 61.69 60.50 2oz8 s THR 9 Cb -0.16 -1.91 -0.08 0.00 0.01 0.00 0.00 72.50 70.36 2oz8 s THR 9 CO 0.06 0.31 0.86 -0.60 -0.69 0.00 0.00 174.62 174.56 2oz8 s ARG 10 N 1.28 4.69 0.11 4.92 3.52 -1.26 -0.52 118.95 131.69 2oz8 s ARG 10 Ca 0.00 1.31 0.09 0.00 -0.13 0.00 0.00 55.73 57.00 2oz8 s ARG 10 Cb -0.15 -3.29 -0.04 0.00 -1.56 0.00 0.00 34.95 29.91 2oz8 s ARG 10 CO -0.10 0.48 -0.22 -0.06 -0.81 0.00 0.00 175.30 174.59 2oz8 s PHE 11 N -0.92 1.94 -0.24 5.12 0.08 0.22 -1.07 117.98 123.10 2oz8 s PHE 11 Ca 0.39 -0.41 -0.06 0.00 0.12 0.00 0.00 56.93 56.98 2oz8 s PHE 11 Cb -0.24 -1.05 0.12 0.00 -0.57 0.00 0.00 43.02 41.28 2oz8 s PHE 11 CO 0.29 0.25 0.48 -1.14 -0.10 0.00 0.00 175.22 175.00 2oz8 s GLN 12 N -1.99 0.41 0.17 0.44 0.74 -1.26 -2.49 119.66 115.68 2oz8 s GLN 12 Ca 0.09 0.99 -0.10 0.00 0.05 0.00 0.00 55.36 56.39 2oz8 s GLN 12 Cb -0.10 0.27 -0.00 0.00 1.10 0.00 0.00 33.01 34.28 2oz8 s GLN 12 CO 0.05 -0.39 0.32 -0.59 -0.55 0.00 0.00 175.29 174.13 2oz8 s PHE 13 N 2.69 0.35 0.41 1.67 -0.12 -1.01 -4.95 117.98 117.02 2oz8 s PHE 13 Ca 0.04 -0.71 -0.13 0.00 -0.05 0.00 0.00 56.93 56.09 2oz8 s PHE 13 Cb -0.13 -0.00 -0.07 0.00 -0.63 0.00 0.00 43.02 42.18 2oz8 s PHE 13 CO -0.16 -0.75 0.80 0.00 -0.05 0.00 0.00 175.22 175.06 2oz8 s ALA 14 N -3.96 3.29 0.52 1.99 0.00 -1.26 -1.26 121.76 121.08 2oz8 s ALA 14 Ca 0.17 -0.08 -0.10 0.00 0.00 0.00 0.00 51.96 51.95 2oz8 s ALA 14 Cb 0.03 -2.80 -0.05 0.00 0.00 0.00 0.00 23.12 20.30 2oz8 s ALA 14 CO 0.00 0.02 0.90 1.03 0.00 0.00 0.00 175.76 177.72 2oz8 s ARG 15 N -3.71 3.68 0.00 0.00 0.52 0.17 -4.28 118.95 115.33 2oz8 s ARG 15 Ca 0.53 0.58 0.29 0.00 -0.52 0.00 0.00 55.73 56.61 2oz8 s ARG 15 Cb -0.10 -2.23 1.22 0.00 0.52 0.00 0.00 34.95 34.35 2oz8 s ARG 15 CO 0.28 -0.31 1.86 -0.40 0.02 0.00 0.00 175.30 176.75 2oz8 n ASP 16 N -2.13 0.36 -3.60 0.23 5.75 -1.26 -4.78 116.55 111.13 2oz8 n ASP 16 Ca 0.04 -0.40 -0.14 0.00 -0.01 0.00 0.00 54.79 54.28 2oz8 n ASP 16 Cb 0.54 -0.12 -0.06 0.00 -1.03 0.00 0.00 41.12 40.46 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 -2.57 0.98 -0.04 0.11 1.70 -1.26 -5.13 118.95 112.74 2oz8 s ARG 17 Ca 0.26 -0.18 -0.30 0.00 -0.47 0.00 0.00 55.73 55.04 2oz8 s ARG 17 Cb 0.20 0.45 -0.05 0.00 -0.57 0.00 0.00 34.95 34.97 2oz8 s ARG 17 CO 0.49 -0.34 1.57 0.08 -1.08 0.00 0.00 175.30 176.02 2oz8 s VAL 18 N -2.17 3.61 0.19 4.99 1.01 -1.26 -4.73 120.40 122.05 2oz8 s VAL 18 Ca -0.07 0.84 0.05 0.00 0.00 0.00 0.00 61.98 62.80 2oz8 s VAL 18 Cb -0.01 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 2oz8 s VAL 18 CO 0.00 -0.05 0.18 0.27 0.00 0.00 0.00 175.10 175.50 2oz8 s ILE 19 N 3.50 4.59 -4.34 2.22 -4.36 0.44 -4.57 121.20 118.67 2oz8 s ILE 19 Ca 0.70 -1.14 0.00 0.00 -0.26 0.00 0.00 60.65 59.95 2oz8 s ILE 19 Cb -0.33 -3.39 0.00 0.00 1.25 0.00 0.00 42.46 39.99 2oz8 s ILE 19 CO 0.28 -0.19 0.00 0.61 0.24 0.00 0.00 174.94 175.88 2oz8 n GLY 20 N -0.67 -1.30 1.52 6.27 0.00 -0.14 -0.88 105.19 110.00 2oz8 n GLY 20 Ca -0.08 -1.16 -0.06 0.00 0.00 0.00 0.00 46.02 44.71 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 2.39 -0.63 0.30 1.61 5.68 -0.42 -3.27 116.55 122.21 2oz8 n ASP 21 Ca 0.00 -1.84 0.18 0.00 -0.50 0.00 0.00 54.79 52.63 2oz8 n ASP 21 Cb 0.00 1.17 0.94 0.00 -1.14 0.00 0.00 41.12 42.08 2oz8 n ASP 21 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 2oz8 h SER 22 N 0.89 0.00 0.01 -1.12 4.64 -1.82 -2.63 113.55 113.52 2oz8 h SER 22 Ca -0.12 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.82 2oz8 h SER 22 Cb 0.53 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.56 2oz8 h SER 22 CO 0.17 0.00 -2.39 0.00 -0.87 0.00 0.00 176.83 173.73 2oz8 n GLN 23 N -3.13 0.68 -3.84 4.77 6.02 -1.26 -5.04 117.38 115.58 2oz8 n GLN 23 Ca -0.01 0.05 -0.12 0.00 -0.01 0.00 0.00 57.00 56.91 2oz8 n GLN 23 Cb 0.29 -1.53 -0.10 0.00 1.02 0.00 0.00 30.24 29.93 2oz8 n GLN 23 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2oz8 s VAL 24 N -2.50 0.08 -0.01 5.09 0.11 -0.99 -5.17 120.40 117.00 2oz8 s VAL 24 Ca -0.18 -0.64 0.03 0.00 -2.93 0.00 0.00 61.98 58.27 2oz8 s VAL 24 Cb 0.07 -0.48 -0.01 0.00 -1.53 0.00 0.00 36.38 34.44 2oz8 s VAL 24 CO 0.76 -0.35 -0.11 -0.60 -3.33 0.00 0.00 175.10 171.46 2oz8 s ARG 25 N -1.37 0.99 -0.13 1.54 3.52 -1.26 -1.30 118.95 120.95 2oz8 s ARG 25 Ca -0.14 -0.41 -0.08 0.00 -0.13 0.00 0.00 55.73 54.97 2oz8 s ARG 25 Cb -0.07 -0.94 0.04 0.00 -1.56 0.00 0.00 34.95 32.42 2oz8 s ARG 25 CO 0.02 0.23 0.31 0.00 -0.81 0.00 0.00 175.30 175.05 2oz8 s ALA 26 N -0.17 -0.76 -0.02 6.12 0.00 -0.06 -5.00 121.76 121.86 2oz8 s ALA 26 Ca 0.03 1.10 0.03 0.00 0.00 0.00 0.00 51.96 53.12 2oz8 s ALA 26 Cb -0.06 -0.67 0.05 0.00 0.00 0.00 0.00 23.12 22.44 2oz8 s ALA 26 CO -0.00 -0.20 0.91 -0.40 0.00 0.00 0.00 175.76 176.07 2oz8 n ASP 27 N 3.81 1.46 -4.00 0.00 5.68 -1.26 -0.42 116.55 121.81 2oz8 n ASP 27 Ca -0.21 -1.96 -0.17 0.00 -0.50 0.00 0.00 54.79 51.95 2oz8 n ASP 27 Cb 0.55 -0.09 -0.09 0.00 -1.14 0.00 0.00 41.12 40.35 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 -1.10 1.18 -0.06 -1.12 -4.77 -1.26 0.43 116.67 109.96 2oz8 s ASP 28 Ca 0.06 -1.52 0.01 0.00 -3.30 0.00 0.00 52.55 47.80 2oz8 s ASP 28 Cb 0.05 0.38 0.02 0.00 -1.09 0.00 0.00 42.92 42.27 2oz8 s ASP 28 CO 0.01 -0.88 -0.09 -0.69 0.70 0.00 0.00 175.17 174.22 2oz8 s VAL 29 N -3.74 0.89 -0.24 2.11 1.01 -0.39 -4.76 120.40 115.29 2oz8 s VAL 29 Ca 0.37 -0.32 0.01 0.00 0.00 0.00 0.00 61.98 62.04 2oz8 s VAL 29 Cb 0.05 -0.86 0.04 0.00 0.00 0.00 0.00 36.38 35.62 2oz8 s VAL 29 CO 0.17 0.31 -0.10 0.20 0.00 0.00 0.00 175.10 175.67 2oz8 s ASN 30 N 0.87 4.18 -0.07 3.32 0.01 -1.26 -2.39 114.94 119.60 2oz8 s ASN 30 Ca -0.11 -1.07 -0.09 0.00 -0.71 0.00 0.00 52.86 50.87 2oz8 s ASN 30 Cb -0.15 -1.59 0.02 0.00 0.41 0.00 0.00 41.25 39.95 2oz8 s ASN 30 CO 0.01 -0.14 0.24 0.54 -1.51 0.00 0.00 177.10 176.24 2oz8 s VAL 31 N 1.22 0.02 -0.08 1.60 0.11 -1.04 -2.04 120.40 120.19 2oz8 s VAL 31 Ca -0.03 -0.13 0.04 0.00 -2.93 0.00 0.00 61.98 58.93 2oz8 s VAL 31 Cb -0.18 -0.39 -0.01 0.00 -1.53 0.00 0.00 36.38 34.28 2oz8 s VAL 31 CO -0.06 -0.07 -0.22 0.00 -3.33 0.00 0.00 175.10 171.42 2oz8 s ALA 32 N -0.20 2.27 -0.04 1.54 0.00 -0.02 0.71 121.76 126.02 2oz8 s ALA 32 Ca -0.03 -1.00 -0.30 0.00 0.00 0.00 0.00 51.96 50.63 2oz8 s ALA 32 Cb -0.03 -0.82 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 2oz8 s ALA 32 CO 0.01 0.36 1.09 0.00 0.00 0.00 0.00 175.76 177.23 2oz8 s ALA 33 N 0.02 3.38 -0.22 0.00 0.00 0.33 -0.76 121.76 124.51 2oz8 s ALA 33 Ca -0.08 0.56 -0.07 0.00 0.00 0.00 0.00 51.96 52.37 2oz8 s ALA 33 Cb -0.15 -3.44 -0.03 0.00 0.00 0.00 0.00 23.12 19.49 2oz8 s ALA 33 CO 0.05 -0.55 0.07 -1.17 0.00 0.00 0.00 175.76 174.16 2oz8 s LEU 34 N 1.73 3.57 -0.18 0.00 2.96 1.00 -2.09 118.68 125.67 2oz8 s LEU 34 Ca 0.53 -0.10 -0.03 0.00 -0.22 0.00 0.00 54.13 54.31 2oz8 s LEU 34 Cb -0.23 -1.93 -0.02 0.00 0.50 0.00 0.00 46.19 44.51 2oz8 s LEU 34 CO 0.23 0.05 -0.06 -1.61 -1.32 0.00 0.00 176.35 173.64 2oz8 s GLU 35 N 1.14 3.50 -0.24 1.98 2.02 -0.07 -0.50 118.70 126.54 2oz8 s GLU 35 Ca 0.04 -0.59 -0.07 0.00 0.02 0.00 0.00 54.97 54.37 2oz8 s GLU 35 Cb -0.14 -2.90 -0.03 0.00 0.10 0.00 0.00 34.13 31.16 2oz8 s GLU 35 CO 0.03 0.06 0.05 -0.51 0.02 0.00 0.00 175.26 174.91 2oz8 s LEU 36 N 0.80 3.35 -0.16 1.80 1.43 0.22 -0.89 118.68 125.23 2oz8 s LEU 36 Ca -0.02 -0.23 -0.06 0.00 -1.03 0.00 0.00 54.13 52.79 2oz8 s LEU 36 Cb -0.15 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.15 2oz8 s LEU 36 CO 0.02 -0.02 0.04 -0.69 0.23 0.00 0.00 176.35 175.93 2oz8 s VAL 37 N 1.54 4.64 0.33 -1.59 1.01 0.11 -0.73 120.40 125.70 2oz8 s VAL 37 Ca 0.06 -0.10 0.04 0.00 0.00 0.00 0.00 61.98 61.99 2oz8 s VAL 37 Cb -0.15 -3.06 -0.02 0.00 0.00 0.00 0.00 36.38 33.16 2oz8 s VAL 37 CO 0.02 0.50 0.48 -0.94 0.00 0.00 0.00 175.10 175.16 2oz8 s SER 38 N 0.11 6.09 0.51 3.32 1.04 -0.45 -0.94 113.70 123.38 2oz8 s SER 38 Ca 0.04 0.05 0.27 0.00 0.48 0.00 0.00 55.95 56.79 2oz8 s SER 38 Cb -0.12 -1.57 1.45 0.00 0.10 0.00 0.00 66.02 65.87 2oz8 s SER 38 CO 0.01 -0.35 1.79 -0.33 0.98 0.00 0.00 173.24 175.34 2oz8 h GLU 39 N 0.87 0.00 -0.02 4.02 5.08 -0.40 -1.08 114.58 123.05 2oz8 h GLU 39 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 2oz8 h GLU 39 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2oz8 h GLU 39 CO 0.57 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 177.45 2oz8 n SER 40 N -2.58 0.78 0.00 1.42 3.41 -1.26 -4.86 113.62 110.52 2oz8 n SER 40 Ca -0.02 -1.30 0.00 0.00 -0.26 0.00 0.00 58.87 57.30 2oz8 n SER 40 Cb 0.24 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.18 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 1.07 3.15 3.77 5.00 0.00 -0.41 -5.03 105.19 112.74 2oz8 n GLY 41 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.38 4.10 -0.07 1.61 0.41 -1.26 -4.82 118.70 118.29 2oz8 s GLU 42 Ca 0.00 1.78 0.04 0.00 -0.41 0.00 0.00 54.97 56.38 2oz8 s GLU 42 Cb 0.00 -2.68 -0.02 0.00 -1.78 0.00 0.00 34.13 29.66 2oz8 s GLU 42 CO 0.00 -0.26 -0.20 0.08 -0.49 0.00 0.00 175.26 174.39 2oz8 s VAL 43 N -1.44 2.52 -0.15 2.63 1.01 -1.26 -1.34 120.40 122.36 2oz8 s VAL 43 Ca 0.57 -0.90 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 2oz8 s VAL 43 Cb -0.29 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 2oz8 s VAL 43 CO 0.37 0.57 0.02 -0.83 0.00 0.00 0.00 175.10 175.22 2oz8 s GLY 44 N -0.22 1.84 -0.12 4.51 0.00 0.09 -4.54 107.32 108.88 2oz8 s GLY 44 Ca -0.01 -0.78 -0.01 0.00 0.00 0.00 0.00 44.72 43.92 2oz8 s GLY 44 CO 0.03 -0.16 -0.07 -2.27 0.00 0.00 0.00 173.10 170.63 2oz8 s LEU 45 N -0.01 3.09 0.22 0.66 2.96 -1.26 0.70 118.68 125.04 2oz8 s LEU 45 Ca 0.04 -0.15 0.00 0.00 -0.22 0.00 0.00 54.13 53.80 2oz8 s LEU 45 Cb -0.13 -1.71 -0.04 0.00 0.50 0.00 0.00 46.19 44.81 2oz8 s LEU 45 CO 0.02 0.22 0.11 -0.83 -1.32 0.00 0.00 176.35 174.55 2oz8 s GLY 46 N 0.02 1.55 -0.12 7.98 0.00 0.35 -3.50 107.32 113.60 2oz8 s GLY 46 Ca -0.01 -1.76 0.02 0.00 0.00 0.00 0.00 44.72 42.97 2oz8 s GLY 46 CO 0.03 -1.49 -0.19 -1.36 0.00 0.00 0.00 173.10 170.09 2oz8 s PHE 47 N -3.97 2.33 -0.58 1.90 0.08 -1.26 -0.00 117.98 116.48 2oz8 s PHE 47 Ca 0.38 -1.11 -0.20 0.00 0.12 0.00 0.00 56.93 56.12 2oz8 s PHE 47 Cb 0.07 -1.61 0.08 0.00 -0.57 0.00 0.00 43.02 40.99 2oz8 s PHE 47 CO 0.12 -0.52 0.73 0.42 -0.10 0.00 0.00 175.22 175.87 2oz8 s ILE 48 N 0.81 4.74 -0.11 0.64 1.01 0.07 -4.16 121.20 124.20 2oz8 s ILE 48 Ca -0.09 -0.70 0.00 0.00 0.00 0.00 0.00 60.65 59.86 2oz8 s ILE 48 Cb -0.16 -4.47 -0.02 0.00 0.01 0.00 0.00 42.46 37.83 2oz8 s ILE 48 CO -0.00 -1.08 -0.11 -1.58 0.00 0.00 0.00 174.94 172.16 2oz8 s GLN 49 N 2.93 3.14 -0.08 2.79 0.74 -1.26 -0.84 119.66 127.08 2oz8 s GLN 49 Ca 0.15 -0.65 0.01 0.00 0.05 0.00 0.00 55.36 54.92 2oz8 s GLN 49 Cb -0.21 -2.60 -0.03 0.00 1.10 0.00 0.00 33.01 31.27 2oz8 s GLN 49 CO 0.09 0.37 -0.09 0.95 -0.55 0.00 0.00 175.29 176.06 2oz8 s THR 50 N -0.04 3.53 -0.13 -0.34 -4.23 -0.87 -4.93 115.64 108.63 2oz8 s THR 50 Ca -0.02 -0.54 0.13 0.00 -1.18 0.00 0.00 61.69 60.08 2oz8 s THR 50 Cb -0.14 -2.44 -0.18 0.00 1.34 0.00 0.00 72.50 71.08 2oz8 s THR 50 CO 0.04 0.58 0.07 0.18 -0.54 0.00 0.00 174.62 174.95 2oz8 n LEU 51 N 2.45 0.00 -0.08 4.79 4.77 -1.26 -4.28 117.00 123.38 2oz8 n LEU 51 Ca -0.18 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.72 2oz8 n LEU 51 Cb 0.53 0.33 -0.13 0.00 -2.33 0.00 0.00 43.42 41.82 2oz8 n LEU 51 CO 0.27 0.33 -1.03 0.49 -1.33 0.00 0.00 177.39 176.13 2oz8 n PHE 52 N -2.50 0.00 -4.03 -1.77 3.72 -1.26 -5.00 117.46 106.62 2oz8 n PHE 52 Ca -0.22 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.10 2oz8 n PHE 52 Cb 0.93 -0.80 -0.10 0.00 -0.94 0.00 0.00 39.48 38.57 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 -4.99 0.35 0.72 4.37 -0.87 -1.26 -5.16 114.94 108.10 2oz8 s ASN 53 Ca -0.08 -0.73 -0.11 0.00 -1.57 0.00 0.00 52.86 50.37 2oz8 s ASN 53 Cb 0.05 0.15 0.02 0.00 -0.02 0.00 0.00 41.25 41.46 2oz8 s ASN 53 CO 0.67 -0.45 1.08 -2.16 -2.57 0.00 0.00 177.10 173.66 2oz8 s PRO 54 N -2.65 2.72 0.61 -0.60 0.04 -1.26 -4.66 135.00 129.21 2oz8 s PRO 54 Ca -0.05 0.68 -0.14 0.00 0.04 0.00 0.00 61.00 61.53 2oz8 s PRO 54 Cb -0.01 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 2oz8 s PRO 54 CO -0.05 -1.18 1.05 -0.51 0.04 0.00 0.00 177.00 176.34 2oz8 s LEU 55 N -5.52 3.40 1.14 -3.56 1.43 -1.26 -5.04 118.68 109.27 2oz8 s LEU 55 Ca 0.59 1.71 -0.19 0.00 -1.03 0.00 0.00 54.13 55.20 2oz8 s LEU 55 Cb -0.13 -4.52 0.27 0.00 0.03 0.00 0.00 46.19 41.85 2oz8 s LEU 55 CO 0.54 -1.16 1.21 -2.16 0.23 0.00 0.00 176.35 175.00 2oz8 s PRO 56 N -4.40 -0.78 0.70 1.29 0.04 -1.26 -4.70 135.00 125.88 2oz8 s PRO 56 Ca 0.61 -0.31 -0.16 0.00 0.04 0.00 0.00 61.00 61.17 2oz8 s PRO 56 Cb -0.14 -1.67 -0.03 0.00 0.04 0.00 0.00 34.50 32.70 2oz8 s PRO 56 CO 0.42 -3.38 0.70 -0.25 0.04 0.00 0.00 177.00 174.54 2oz8 n ASP 57 N -4.47 -0.50 -0.25 6.66 9.92 -1.26 -4.67 116.55 121.97 2oz8 n ASP 57 Ca 0.16 0.64 0.03 0.00 -0.53 0.00 0.00 54.79 55.09 2oz8 n ASP 57 Cb 0.60 -1.29 0.11 0.00 -0.64 0.00 0.00 41.12 39.90 2oz8 n ASP 57 CO 0.00 0.00 0.00 -0.61 0.13 0.00 0.00 177.20 176.72 2oz8 h GLN 58 N -0.23 0.03 -0.06 -1.24 4.15 -0.82 -0.73 115.11 116.22 2oz8 h GLN 58 Ca -0.46 -0.00 -0.07 0.00 0.77 0.00 0.00 58.65 58.88 2oz8 h GLN 58 Cb 1.35 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 29.02 2oz8 h GLN 58 CO 0.45 0.02 -0.30 -0.56 -1.93 0.00 0.00 178.83 176.52 2oz8 h GLN 59 N 0.04 0.11 -0.24 1.69 3.07 -1.91 -1.10 115.11 116.76 2oz8 h GLN 59 Ca 0.38 -0.04 -0.05 0.00 0.09 0.00 0.00 58.65 59.03 2oz8 h GLN 59 Cb 0.62 -0.01 -0.01 0.00 0.08 0.00 0.00 27.48 28.16 2oz8 h GLN 59 CO -0.72 0.40 -0.03 1.49 0.09 0.00 0.00 178.83 180.06 2oz8 h GLU 60 N 0.10 0.45 -0.33 0.06 4.57 -1.53 -1.38 114.58 116.53 2oz8 h GLU 60 Ca 0.01 -0.16 0.03 0.00 -1.18 0.00 0.00 59.36 58.06 2oz8 h GLU 60 Cb 0.58 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.11 2oz8 h GLU 60 CO 0.04 0.66 0.15 0.82 -1.18 0.00 0.00 179.01 179.50 2oz8 h ILE 61 N 0.21 0.97 -0.55 2.32 2.04 -0.64 -2.25 117.51 119.61 2oz8 h ILE 61 Ca 0.06 -0.11 0.02 0.00 1.00 0.00 0.00 64.86 65.83 2oz8 h ILE 61 Cb 0.48 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 2oz8 h ILE 61 CO 0.02 0.06 0.35 -0.33 0.00 0.00 0.00 178.15 178.24 2oz8 h GLU 62 N 0.32 0.67 -0.08 2.37 5.08 -1.21 -1.01 114.58 120.71 2oz8 h GLU 62 Ca 0.14 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.30 2oz8 h GLU 62 Cb 0.07 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 2oz8 h GLU 62 CO -0.11 0.45 -0.65 1.03 -1.00 0.00 0.00 179.01 178.73 2oz8 h SER 63 N 0.69 0.38 -0.17 1.42 0.87 -0.98 -0.02 113.55 115.74 2oz8 h SER 63 Ca 0.21 -0.23 -0.20 0.00 -1.23 0.00 0.00 61.79 60.34 2oz8 h SER 63 Cb -0.03 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 61.83 2oz8 h SER 63 CO -0.07 0.92 -0.68 0.58 -0.53 0.00 0.00 176.83 177.05 2oz8 h VAL 64 N 0.23 1.28 -0.55 2.23 2.07 -1.26 -1.94 116.25 118.31 2oz8 h VAL 64 Ca -0.01 -1.88 -0.11 0.00 0.82 0.00 0.00 66.70 65.52 2oz8 h VAL 64 Cb 1.18 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 32.78 2oz8 h VAL 64 CO 0.11 0.60 -0.07 0.15 0.02 0.00 0.00 177.57 178.38 2oz8 h PHE 65 N 0.57 1.12 -0.56 1.57 3.57 -0.95 0.46 116.94 122.71 2oz8 h PHE 65 Ca -0.02 -0.21 -0.05 0.00 3.53 0.00 0.00 57.97 61.21 2oz8 h PHE 65 Cb 1.30 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.73 2oz8 h PHE 65 CO 0.08 1.02 0.15 1.49 -2.23 0.00 0.00 178.31 178.82 2oz8 h GLU 66 N 0.91 0.89 0.08 1.11 4.81 -0.96 0.21 114.58 121.64 2oz8 h GLU 66 Ca 0.15 -0.21 -0.22 0.00 -0.13 0.00 0.00 59.36 58.95 2oz8 h GLU 66 Cb 0.63 -0.12 0.02 0.00 0.63 0.00 0.00 28.75 29.91 2oz8 h GLU 66 CO 0.04 0.82 -0.91 1.25 -0.73 0.00 0.00 179.01 179.49 2oz8 h HIS 67 N 0.80 0.76 0.00 0.92 2.76 -1.20 -3.36 115.15 115.83 2oz8 h HIS 67 Ca 0.18 -0.47 0.00 0.00 -2.20 0.00 0.00 60.37 57.88 2oz8 h HIS 67 Cb 0.32 -0.06 0.00 0.00 1.55 0.00 0.00 27.41 29.22 2oz8 h HIS 67 CO 0.02 1.32 -1.21 -0.85 -1.30 0.00 0.00 177.93 175.92 2oz8 n GLU 68 N -4.03 1.28 0.00 5.26 0.28 0.14 -4.77 120.64 118.80 2oz8 n GLU 68 Ca -0.13 -0.07 0.00 0.00 -0.16 0.00 0.00 57.16 56.80 2oz8 n GLU 68 Cb 0.83 -1.28 0.00 0.00 1.43 0.00 0.00 31.44 32.42 2oz8 n GLU 68 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 2oz8 n VAL 69 N -1.70 0.00 -0.23 3.84 0.31 -0.12 -4.87 118.33 115.56 2oz8 n VAL 69 Ca -0.00 0.00 0.14 0.00 -0.01 0.00 0.00 64.34 64.47 2oz8 n VAL 69 Cb 0.31 -0.99 0.43 0.00 -0.91 0.00 0.00 33.84 32.69 2oz8 n VAL 69 CO 0.00 0.00 0.00 -0.25 -1.32 0.00 0.00 176.83 175.26 2oz8 h TRP 70 N 0.00 0.68 -0.63 3.52 2.91 -0.81 -2.12 115.95 119.50 2oz8 h TRP 70 Ca 0.00 0.02 0.11 0.00 1.13 0.00 0.00 58.89 60.15 2oz8 h TRP 70 Cb 0.73 -0.21 -0.04 0.00 -0.51 0.00 0.00 29.16 29.13 2oz8 h TRP 70 CO 0.00 0.25 0.42 -1.35 -1.03 0.00 0.00 178.44 176.73 2oz8 h PRO 71 N 0.57 0.36 0.00 2.65 0.11 -1.85 0.98 132.00 134.81 2oz8 h PRO 71 Ca 0.42 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.51 2oz8 h PRO 71 Cb 0.81 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.84 2oz8 h PRO 71 CO -0.17 0.24 -0.16 0.66 -0.21 0.00 0.00 178.00 178.36 2oz8 h SER 72 N 0.37 0.00 0.03 -2.05 4.64 -1.73 -3.36 113.55 111.45 2oz8 h SER 72 Ca 0.29 -0.04 -0.38 0.00 -0.47 0.00 0.00 61.79 61.19 2oz8 h SER 72 Cb 0.66 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.68 2oz8 h SER 72 CO -0.08 0.02 -2.38 0.18 -0.87 0.00 0.00 176.83 173.70 2oz8 n LEU 73 N -2.38 2.45 -4.76 5.97 4.77 -0.57 -4.92 117.00 117.56 2oz8 n LEU 73 Ca 0.05 -0.06 -0.41 0.00 -0.03 0.00 0.00 56.01 55.56 2oz8 n LEU 73 Cb 0.45 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 2oz8 n LEU 73 CO 0.32 0.85 1.10 1.17 -1.33 0.00 0.00 177.39 179.50 2oz8 n LYS 74 N -3.21 2.54 -0.41 3.23 4.81 0.23 -2.31 118.16 123.04 2oz8 n LYS 74 Ca -0.41 0.89 0.00 0.00 -0.87 0.00 0.00 58.31 57.92 2oz8 n LYS 74 Cb 1.02 -2.63 0.00 0.00 0.02 0.00 0.00 35.03 33.45 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 0.51 2.05 3.91 3.14 0.00 -0.50 -4.95 105.19 109.35 2oz8 n GLY 75 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 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 -3.50 6.08 -0.05 1.61 0.01 -0.98 -4.68 114.94 113.43 2oz8 s ASN 76 Ca 0.00 0.02 -0.24 0.00 -0.71 0.00 0.00 52.86 51.93 2oz8 s ASN 76 Cb 0.00 -1.74 -0.04 0.00 0.41 0.00 0.00 41.25 39.88 2oz8 s ASN 76 CO 0.00 -0.01 0.73 -0.13 -1.51 0.00 0.00 177.10 176.18 2oz8 s ARG 77 N -3.60 4.45 0.19 -0.60 1.81 -1.26 -0.51 118.95 119.44 2oz8 s ARG 77 Ca 0.34 0.94 -0.14 0.00 -1.72 0.00 0.00 55.73 55.14 2oz8 s ARG 77 Cb -0.10 -3.44 0.19 0.00 -0.45 0.00 0.00 34.95 31.15 2oz8 s ARG 77 CO 0.27 0.07 1.65 0.00 -0.68 0.00 0.00 175.30 176.62 2oz8 h ALA 78 N 6.69 0.40 0.00 2.13 0.00 -1.89 -0.94 119.26 125.65 2oz8 h ALA 78 Ca -0.41 0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 2oz8 h ALA 78 Cb 1.20 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 19.35 2oz8 h ALA 78 CO 0.75 -0.43 -0.11 0.97 0.00 0.00 0.00 179.25 180.43 2oz8 h ILE 79 N 0.03 0.80 0.05 0.00 6.09 -1.89 -2.46 117.51 120.13 2oz8 h ILE 79 Ca 0.26 -0.43 -0.00 0.00 -1.37 0.00 0.00 64.86 63.31 2oz8 h ILE 79 Cb 0.40 1.25 0.00 0.00 0.47 0.00 0.00 36.82 38.94 2oz8 h ILE 79 CO -0.51 0.11 -0.02 0.00 -3.07 0.00 0.00 178.15 174.65 2oz8 h ALA 80 N 1.89 -0.07 -0.88 0.18 0.00 -1.66 -3.34 119.26 115.38 2oz8 h ALA 80 Ca -0.00 -0.30 0.13 0.00 0.00 0.00 0.00 54.91 54.74 2oz8 h ALA 80 Cb 0.24 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 2oz8 h ALA 80 CO 0.01 -0.20 0.57 -0.07 0.00 0.00 0.00 179.25 179.57 2oz8 h LEU 81 N -0.75 0.67 -1.10 0.00 3.38 -0.92 -2.75 115.31 113.85 2oz8 h LEU 81 Ca -0.01 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2oz8 h LEU 81 Cb 0.63 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2oz8 h LEU 81 CO 0.01 0.36 0.00 -0.37 0.09 0.00 0.00 178.44 178.53 2oz8 h VAL 82 N 0.72 0.00 -0.01 1.22 -1.51 -1.56 -2.80 116.25 112.32 2oz8 h VAL 82 Ca 0.43 -0.44 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 2oz8 h VAL 82 Cb 0.64 1.34 0.00 0.00 -2.13 0.00 0.00 31.29 31.15 2oz8 h VAL 82 CO -0.19 0.00 -0.48 1.41 -1.23 0.00 0.00 177.57 177.08 2oz8 n HIS 83 N -2.78 0.00 -1.79 5.19 8.25 -1.04 -4.95 115.22 118.11 2oz8 n HIS 83 Ca 0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.05 2oz8 n HIS 83 Cb 0.29 -0.11 -0.03 0.00 1.12 0.00 0.00 29.99 31.27 2oz8 n HIS 83 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 2oz8 s ARG 84 N -2.69 4.15 -0.35 -0.41 3.52 -1.06 -4.98 118.95 117.13 2oz8 s ARG 84 Ca 0.17 2.54 -0.13 0.00 -0.13 0.00 0.00 55.73 58.19 2oz8 s ARG 84 Cb 0.18 -3.09 -0.01 0.00 -1.56 0.00 0.00 34.95 30.47 2oz8 s ARG 84 CO 0.63 -0.71 0.24 0.08 -0.81 0.00 0.00 175.30 174.73 2oz8 s VAL 85 N 1.09 5.21 0.16 7.11 1.01 -1.26 -5.09 120.40 128.63 2oz8 s VAL 85 Ca 0.73 -0.31 0.04 0.00 0.00 0.00 0.00 61.98 62.43 2oz8 s VAL 85 Cb -0.48 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 2oz8 s VAL 85 CO 0.33 -0.05 0.21 0.20 0.00 0.00 0.00 175.10 175.79 2oz8 s ASN 86 N 1.70 5.93 0.11 3.32 0.01 -1.26 -5.11 114.94 119.63 2oz8 s ASN 86 Ca 0.06 0.02 -0.20 0.00 -0.71 0.00 0.00 52.86 52.02 2oz8 s ASN 86 Cb -0.18 -1.67 -0.07 0.00 0.41 0.00 0.00 41.25 39.74 2oz8 s ASN 86 CO 0.10 0.06 0.62 -0.13 -1.51 0.00 0.00 177.10 176.23 2oz8 s ARG 87 N -3.19 4.26 0.00 -0.60 0.52 -1.26 -5.00 118.95 113.67 2oz8 s ARG 87 Ca 0.33 0.81 0.00 0.00 -0.52 0.00 0.00 55.73 56.35 2oz8 s ARG 87 Cb -0.10 -3.20 0.00 0.00 0.52 0.00 0.00 34.95 32.17 2oz8 s ARG 87 CO 0.26 0.60 0.81 -2.30 0.02 0.00 0.00 175.30 174.69 2oz8 n PRO 88 N 1.56 0.00 0.00 3.54 -0.02 -1.26 -5.33 135.00 133.50 2oz8 n PRO 88 Ca -0.09 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 2oz8 n PRO 88 Cb 0.50 -1.31 0.00 0.00 -0.02 0.00 0.00 33.50 32.67 2oz8 n PRO 88 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2oz8 n ARG 89 N -1.75 0.00 -4.31 -0.52 1.74 -1.26 -5.26 116.66 105.30 2oz8 n ARG 89 Ca 0.00 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.86 2oz8 n ARG 89 Cb 0.00 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 31.32 2oz8 n ARG 89 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2oz8 s TYR 96 N 0.00 1.76 0.26 -1.55 2.02 -1.26 -5.30 117.35 113.28 2oz8 s TYR 96 Ca 0.00 -0.46 0.18 0.00 -0.37 0.00 0.00 57.07 56.41 2oz8 s TYR 96 Cb 0.00 -0.91 0.75 0.00 -0.40 0.00 0.00 41.96 41.41 2oz8 s TYR 96 CO 0.00 0.28 1.78 1.03 -1.57 0.00 0.00 175.55 177.07 2oz8 h SER 97 N 3.50 0.00 -3.61 2.29 0.87 -1.99 -3.43 113.55 111.18 2oz8 h SER 97 Ca -0.43 0.00 -0.39 0.00 -1.23 0.00 0.00 61.79 59.74 2oz8 h SER 97 Cb 1.20 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 63.01 2oz8 h SER 97 CO 0.48 0.37 -0.70 -0.76 -0.53 0.00 0.00 176.83 175.69 2oz8 s LEU 98 N -7.40 2.44 -0.94 2.23 1.43 -1.26 -5.07 118.68 110.11 2oz8 s LEU 98 Ca -0.01 -1.10 -0.18 0.00 -1.03 0.00 0.00 54.13 51.81 2oz8 s LEU 98 Cb 0.12 -0.44 -0.11 0.00 0.03 0.00 0.00 46.19 45.79 2oz8 s LEU 98 CO 0.69 -0.34 2.03 -0.81 0.23 0.00 0.00 176.35 178.15 2oz8 n PRO 99 N -0.36 1.88 0.02 1.29 -0.04 -1.26 -4.66 135.00 131.86 2oz8 n PRO 99 Ca -0.08 -1.95 0.13 0.00 -0.04 0.00 0.00 63.50 61.56 2oz8 n PRO 99 Cb 0.62 -2.93 0.40 0.00 -0.04 0.00 0.00 33.50 31.54 2oz8 n PRO 99 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2oz8 n PHE 100 N 6.75 0.18 -0.04 0.54 3.72 -1.26 -4.53 117.46 122.82 2oz8 n PHE 100 Ca 0.50 0.05 -0.12 0.00 -0.05 0.00 0.00 57.45 57.84 2oz8 n PHE 100 Cb 0.37 -0.48 -0.06 0.00 -0.94 0.00 0.00 39.48 38.36 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 0.24 -0.32 1.38 2.76 -1.98 -0.04 115.15 117.18 2oz8 h HIS 101 Ca 0.00 -0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.04 2oz8 h HIS 101 Cb 0.56 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.45 2oz8 h HIS 101 CO 0.00 0.42 -0.16 1.49 -1.30 0.00 0.00 177.93 178.38 2oz8 h GLU 102 N -0.01 0.67 -0.67 5.26 4.81 -1.93 -2.71 114.58 120.01 2oz8 h GLU 102 Ca 0.04 -0.30 0.02 0.00 -0.13 0.00 0.00 59.36 58.99 2oz8 h GLU 102 Cb 0.31 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.63 2oz8 h GLU 102 CO 0.00 0.89 0.43 0.00 -0.73 0.00 0.00 179.01 179.60 2oz8 h ALA 103 N 0.77 0.86 -0.26 2.92 0.00 -1.66 -0.27 119.26 121.63 2oz8 h ALA 103 Ca 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2oz8 h ALA 103 Cb 0.69 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2oz8 h ALA 103 CO 0.05 0.22 0.08 0.28 0.00 0.00 0.00 179.25 179.87 2oz8 h VAL 104 N 0.85 1.20 -0.84 0.00 2.07 -1.04 0.10 116.25 118.59 2oz8 h VAL 104 Ca 0.26 -0.63 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 2oz8 h VAL 104 Cb -0.03 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 2oz8 h VAL 104 CO -0.08 0.21 0.40 1.56 0.02 0.00 0.00 177.57 179.67 2oz8 h GLN 105 N 0.26 1.20 -0.34 1.57 4.20 -1.12 -0.62 115.11 120.27 2oz8 h GLN 105 Ca 0.08 -0.18 -0.07 0.00 0.06 0.00 0.00 58.65 58.54 2oz8 h GLN 105 Cb 0.24 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 2oz8 h GLN 105 CO -0.00 0.93 -0.08 0.28 -0.67 0.00 0.00 178.83 179.28 2oz8 h VAL 106 N 1.19 1.28 -0.59 -0.54 2.07 -0.87 -1.84 116.25 116.95 2oz8 h VAL 106 Ca 0.29 -1.14 -0.09 0.00 0.82 0.00 0.00 66.70 66.58 2oz8 h VAL 106 Cb 0.12 1.33 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 2oz8 h VAL 106 CO -0.04 0.37 0.02 0.00 0.02 0.00 0.00 177.57 177.94 2oz8 h ALA 107 N 0.81 0.80 -0.19 1.67 0.00 -0.83 -1.13 119.26 120.38 2oz8 h ALA 107 Ca 0.08 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2oz8 h ALA 107 Cb 0.58 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2oz8 h ALA 107 CO 0.03 0.62 0.05 -0.07 0.00 0.00 0.00 179.25 179.88 2oz8 h LEU 108 N 0.93 0.29 -1.15 0.00 3.38 -1.02 -0.49 115.31 117.25 2oz8 h LEU 108 Ca 0.17 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 2oz8 h LEU 108 Cb 0.53 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2oz8 h LEU 108 CO 0.03 0.43 -0.36 -0.50 0.09 0.00 0.00 178.44 178.13 2oz8 h TRP 109 N 0.13 0.00 0.15 1.13 4.06 -1.32 0.15 115.95 120.24 2oz8 h TRP 109 Ca 0.06 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.00 2oz8 h TRP 109 Cb 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.42 2oz8 h TRP 109 CO 0.01 0.36 -0.07 0.22 -3.56 0.00 0.00 178.44 175.40 2oz8 h ASP 110 N 0.00 -0.18 -0.16 -3.49 3.58 -0.91 -2.19 116.42 113.07 2oz8 h ASP 110 Ca -0.00 -0.11 0.02 0.00 0.42 0.00 0.00 57.03 57.36 2oz8 h ASP 110 Cb 0.77 0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.84 2oz8 h ASP 110 CO 0.05 0.01 0.02 0.25 -2.88 0.00 0.00 179.24 176.69 2oz8 h LEU 111 N -0.35 -0.01 -0.59 2.28 5.85 -0.84 -2.36 115.31 119.29 2oz8 h LEU 111 Ca -0.02 0.03 0.06 0.00 0.84 0.00 0.00 57.88 58.79 2oz8 h LEU 111 Cb 0.28 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.29 2oz8 h LEU 111 CO 0.03 0.02 0.29 0.00 -0.34 0.00 0.00 178.44 178.44 2oz8 h ALA 112 N 1.12 0.77 -0.36 1.25 0.00 -0.73 -1.07 119.26 120.25 2oz8 h ALA 112 Ca 0.07 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 2oz8 h ALA 112 Cb 0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2oz8 h ALA 112 CO -0.11 -0.08 0.04 0.00 0.00 0.00 0.00 179.25 179.10 2oz8 h ALA 113 N 1.34 0.48 -0.13 0.00 0.00 -1.36 -1.48 119.26 118.10 2oz8 h ALA 113 Ca 0.27 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 55.01 2oz8 h ALA 113 Cb 0.23 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 2oz8 h ALA 113 CO -0.21 0.20 -0.30 0.87 0.00 0.00 0.00 179.25 179.82 2oz8 h LYS 114 N 0.43 -0.36 0.00 0.00 1.57 -1.13 0.14 116.57 117.22 2oz8 h LYS 114 Ca 0.11 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.89 2oz8 h LYS 114 Cb 0.39 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.78 2oz8 h LYS 114 CO 0.01 -0.24 -0.10 0.93 -0.57 0.00 0.00 179.45 179.49 2oz8 h GLU 115 N -0.37 0.00 -0.01 3.15 5.08 -1.08 0.42 114.58 121.76 2oz8 h GLU 115 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2oz8 h GLU 115 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2oz8 h GLU 115 CO -0.34 0.10 -0.05 0.00 -1.00 0.00 0.00 179.01 177.72 2oz8 n ALA 116 N -2.35 2.67 -3.29 3.43 0.00 -0.57 -4.96 120.51 115.45 2oz8 n ALA 116 Ca -0.02 -0.41 -0.17 0.00 0.00 0.00 0.00 53.44 52.84 2oz8 n ALA 116 Cb 0.19 -1.20 0.06 0.00 0.00 0.00 0.00 19.45 18.50 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 1.19 -0.14 3.08 0.00 0.00 0.15 -5.04 105.19 104.43 2oz8 n GLY 117 Ca 0.18 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 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 -5.57 2.23 0.46 0.99 1.43 0.37 -4.97 118.68 113.61 2oz8 s LEU 118 Ca 0.42 -0.52 -0.24 0.00 -1.03 0.00 0.00 54.13 52.76 2oz8 s LEU 118 Cb -0.18 -0.28 -0.07 0.00 0.03 0.00 0.00 46.19 45.69 2oz8 s LEU 118 CO 0.53 -0.14 1.30 -2.84 0.23 0.00 0.00 176.35 175.44 2oz8 s PRO 119 N -1.45 3.66 0.21 1.29 0.02 -1.21 -0.72 135.00 136.80 2oz8 s PRO 119 Ca -0.06 2.13 -0.12 0.00 0.02 0.00 0.00 61.00 62.96 2oz8 s PRO 119 Cb -0.09 -2.53 0.26 0.00 0.02 0.00 0.00 34.50 32.16 2oz8 s PRO 119 CO 0.01 -0.74 1.66 1.25 -0.33 0.00 0.00 177.00 178.85 2oz8 h LEU 120 N 2.16 -0.31 -1.47 -5.54 5.85 0.81 -2.39 115.31 114.43 2oz8 h LEU 120 Ca -0.50 0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.34 2oz8 h LEU 120 Cb 1.26 0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.56 2oz8 h LEU 120 CO 0.60 -0.12 0.03 1.12 -0.34 0.00 0.00 178.44 179.73 2oz8 h HIS 121 N 0.09 0.38 -0.22 1.25 2.07 -1.83 0.84 115.15 117.73 2oz8 h HIS 121 Ca 0.30 -0.02 -0.04 0.00 -2.85 0.00 0.00 60.37 57.76 2oz8 h HIS 121 Cb 0.48 -0.12 -0.01 0.00 2.57 0.00 0.00 27.41 30.33 2oz8 h HIS 121 CO -0.38 0.37 -0.01 0.28 -3.07 0.00 0.00 177.93 175.12 2oz8 h VAL 122 N 0.38 1.26 -0.30 6.12 2.07 -1.77 -1.30 116.25 122.72 2oz8 h VAL 122 Ca 0.09 -0.91 0.02 0.00 0.82 0.00 0.00 66.70 66.72 2oz8 h VAL 122 Cb 0.20 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 2oz8 h VAL 122 CO 0.00 0.28 0.20 0.25 0.02 0.00 0.00 177.57 178.32 2oz8 h LEU 123 N 0.16 0.26 -0.17 2.57 5.85 -0.84 -2.23 115.31 120.91 2oz8 h LEU 123 Ca 0.06 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2oz8 h LEU 123 Cb 0.42 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.39 2oz8 h LEU 123 CO 0.01 0.19 0.00 0.18 -0.34 0.00 0.00 178.44 178.48 2oz8 n LEU 124 N -4.49 0.26 0.00 2.25 4.77 0.16 -4.89 117.00 115.06 2oz8 n LEU 124 Ca 0.02 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 2oz8 n LEU 124 Cb 0.14 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 2oz8 n LEU 124 CO 0.35 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 2oz8 n GLY 125 N 0.86 0.78 3.73 -0.72 0.00 -0.84 -4.90 105.19 104.10 2oz8 n GLY 125 Ca 0.15 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.13 4.29 0.00 1.61 1.04 -0.51 -4.95 113.70 113.05 2oz8 s SER 126 Ca 0.00 2.28 0.03 0.00 0.48 0.00 0.00 55.95 58.73 2oz8 s SER 126 Cb 0.00 -2.58 0.05 0.00 0.10 0.00 0.00 66.02 63.59 2oz8 s SER 126 CO 0.00 -2.20 0.86 0.54 0.98 0.00 0.00 173.24 173.42 2oz8 n ARG 127 N -2.76 1.42 -4.01 4.02 1.74 -1.26 -4.84 116.66 110.96 2oz8 n ARG 127 Ca 0.13 -1.22 -0.09 0.00 -0.77 0.00 0.00 57.85 55.90 2oz8 n ARG 127 Cb 0.51 -1.06 -0.05 0.00 -1.02 0.00 0.00 32.46 30.83 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 -0.67 1.57 0.00 5.56 1.70 -1.26 -5.10 118.95 120.75 2oz8 s ARG 128 Ca 0.05 -1.29 0.00 0.00 -0.47 0.00 0.00 55.73 54.02 2oz8 s ARG 128 Cb 0.03 0.47 0.00 0.00 -0.57 0.00 0.00 34.95 34.87 2oz8 s ARG 128 CO 0.04 -0.65 0.74 0.27 -1.08 0.00 0.00 175.30 174.62 2oz8 n ASN 129 N -0.45 1.16 -4.11 -2.89 6.94 -1.26 -4.80 115.26 109.85 2oz8 n ASN 129 Ca -0.01 -1.53 -0.12 0.00 -0.02 0.00 0.00 54.58 52.89 2oz8 n ASN 129 Cb 0.62 0.00 -0.11 0.00 -2.36 0.00 0.00 39.78 37.93 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 -0.53 0.67 0.02 -3.83 1.70 -1.26 -0.68 118.95 115.02 2oz8 s ARG 130 Ca 0.00 -1.02 0.01 0.00 -0.47 0.00 0.00 55.73 54.25 2oz8 s ARG 130 Cb 0.00 -0.25 -0.01 0.00 -0.57 0.00 0.00 34.95 34.12 2oz8 s ARG 130 CO 0.00 0.02 -0.05 0.54 -1.08 0.00 0.00 175.30 174.73 2oz8 s VAL 131 N -2.41 0.37 0.25 4.99 0.11 -0.53 -4.80 120.40 118.38 2oz8 s VAL 131 Ca -0.00 -0.58 -0.31 0.00 -2.93 0.00 0.00 61.98 58.16 2oz8 s VAL 131 Cb -0.03 -0.39 -0.13 0.00 -1.53 0.00 0.00 36.38 34.30 2oz8 s VAL 131 CO -0.02 -0.14 1.43 0.29 -3.33 0.00 0.00 175.10 173.32 2oz8 n LYS 132 N 2.29 2.13 -4.82 1.54 5.02 -1.21 -0.52 118.16 122.58 2oz8 n LYS 132 Ca -0.18 0.76 -0.33 0.00 -2.02 0.00 0.00 58.31 56.54 2oz8 n LYS 132 Cb 0.57 -2.43 -0.13 0.00 -0.02 0.00 0.00 35.03 33.02 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 -0.09 2.73 0.17 7.82 0.00 0.04 -0.72 121.76 131.71 2oz8 s ALA 133 Ca 0.67 -0.95 0.09 0.00 0.00 0.00 0.00 51.96 51.77 2oz8 s ALA 133 Cb -0.62 -1.04 -0.04 0.00 0.00 0.00 0.00 23.12 21.41 2oz8 s ALA 133 CO 0.50 0.54 -0.12 1.52 0.00 0.00 0.00 175.76 178.19 2oz8 s TYR 134 N -0.67 2.58 -0.27 0.00 -0.85 -0.65 -4.69 117.35 112.81 2oz8 s TYR 134 Ca 0.10 -0.24 -0.20 0.00 -0.52 0.00 0.00 57.07 56.21 2oz8 s TYR 134 Cb -0.11 -1.28 -0.02 0.00 0.38 0.00 0.00 41.96 40.93 2oz8 s TYR 134 CO 0.01 0.49 0.62 0.00 -1.52 0.00 0.00 175.55 175.15 2oz8 s ALA 135 N -1.62 3.59 -0.16 9.51 0.00 0.04 -1.28 121.76 131.85 2oz8 s ALA 135 Ca 0.23 -0.49 0.01 0.00 0.00 0.00 0.00 51.96 51.71 2oz8 s ALA 135 Cb -0.09 -3.03 0.01 0.00 0.00 0.00 0.00 23.12 20.01 2oz8 s ALA 135 CO 0.14 -0.85 -0.19 0.45 0.00 0.00 0.00 175.76 175.30 2oz8 s SER 136 N 1.51 3.25 0.11 0.00 0.15 0.97 -0.53 113.70 119.16 2oz8 s SER 136 Ca 0.25 -0.59 0.24 0.00 0.70 0.00 0.00 55.95 56.55 2oz8 s SER 136 Cb -0.15 -1.49 0.28 0.00 -1.71 0.00 0.00 66.02 62.95 2oz8 s SER 136 CO 0.09 0.04 1.26 1.23 1.20 0.00 0.00 173.24 177.06 2oz8 h GLY 137 N 7.61 0.00 -6.89 9.45 0.00 -1.79 -3.36 103.07 108.09 2oz8 h GLY 137 Ca -0.38 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.37 2oz8 h GLY 137 CO 0.59 0.00 -0.91 1.04 0.00 0.00 0.00 176.54 177.26 2oz8 n LEU 138 N -2.11 -1.42 -1.08 3.11 4.77 -1.26 -4.82 117.00 114.18 2oz8 n LEU 138 Ca 0.03 -1.15 0.11 0.00 -0.03 0.00 0.00 56.01 54.97 2oz8 n LEU 138 Cb 0.44 -1.86 0.19 0.00 -2.33 0.00 0.00 43.42 39.87 2oz8 n LEU 138 CO 0.37 0.36 0.68 -0.90 -1.33 0.00 0.00 177.39 176.57 2oz8 n ASP 139 N -2.79 3.34 -0.34 -1.43 5.75 -1.24 -0.97 116.55 118.87 2oz8 n ASP 139 Ca -0.16 -1.97 0.16 0.00 -0.01 0.00 0.00 54.79 52.81 2oz8 n ASP 139 Cb 0.61 -0.22 0.37 0.00 -1.03 0.00 0.00 41.12 40.85 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 4.27 0.98 -0.56 2.11 3.57 -1.83 -1.13 116.94 124.34 2oz8 h PHE 140 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2oz8 h PHE 140 Cb 0.95 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.41 2oz8 h PHE 140 CO 0.22 0.08 0.00 0.72 -2.23 0.00 0.00 178.31 177.10 2oz8 n HIS 141 N -4.89 0.74 -2.77 0.41 8.25 -1.26 -4.93 115.22 110.78 2oz8 n HIS 141 Ca 0.26 -0.41 -0.40 0.00 -0.26 0.00 0.00 57.72 56.90 2oz8 n HIS 141 Cb 0.71 -0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.76 2oz8 n HIS 141 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2oz8 s LEU 142 N -1.14 4.63 0.65 2.41 2.96 -0.43 -4.97 118.68 122.79 2oz8 s LEU 142 Ca 0.41 1.91 -0.16 0.00 -0.22 0.00 0.00 54.13 56.07 2oz8 s LEU 142 Cb 0.22 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 43.33 2oz8 s LEU 142 CO 0.30 0.14 1.12 1.51 -1.32 0.00 0.00 176.35 178.11 2oz8 s ASP 143 N -1.07 5.12 0.28 3.68 3.84 -1.26 -4.77 116.67 122.48 2oz8 s ASP 143 Ca 0.41 2.06 -0.08 0.00 -0.00 0.00 0.00 52.55 54.95 2oz8 s ASP 143 Cb -0.25 -2.56 0.46 0.00 -1.38 0.00 0.00 42.92 39.18 2oz8 s ASP 143 CO 0.31 -1.63 1.53 0.47 -0.00 0.00 0.00 175.17 175.86 2oz8 n ASP 144 N -2.27 -0.35 -0.32 2.11 8.00 -1.26 -1.14 116.55 121.33 2oz8 n ASP 144 Ca 0.11 1.69 -0.04 0.00 0.71 0.00 0.00 54.79 57.26 2oz8 n ASP 144 Cb 0.52 -0.51 0.08 0.00 -0.02 0.00 0.00 41.12 41.19 2oz8 n ASP 144 CO 0.00 0.00 0.00 -0.78 -0.39 0.00 0.00 177.20 176.03 2oz8 h ASP 145 N 0.00 1.00 1.15 -2.24 3.58 -2.00 -1.81 116.42 116.10 2oz8 h ASP 145 Ca 0.47 -0.04 -0.10 0.00 0.42 0.00 0.00 57.03 57.78 2oz8 h ASP 145 Cb 0.73 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.51 2oz8 h ASP 145 CO -1.01 0.74 -0.49 0.00 -2.88 0.00 0.00 179.24 175.60 2oz8 h ALA 146 N 1.30 0.79 0.02 -0.78 0.00 -1.50 -2.14 119.26 116.95 2oz8 h ALA 146 Ca 0.31 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 2oz8 h ALA 146 Cb -0.11 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2oz8 h ALA 146 CO -0.06 0.61 -0.01 0.35 0.00 0.00 0.00 179.25 180.14 2oz8 h PHE 147 N 0.00 -0.03 -0.25 0.00 3.57 -0.70 -1.79 116.94 117.74 2oz8 h PHE 147 Ca -0.00 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 2oz8 h PHE 147 Cb 1.20 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.93 2oz8 h PHE 147 CO 0.00 0.26 -0.21 -0.39 -2.23 0.00 0.00 178.31 175.73 2oz8 h VAL 148 N -0.31 1.25 -0.12 1.41 -1.51 -1.32 -2.08 116.25 113.57 2oz8 h VAL 148 Ca -0.00 -1.17 -0.01 0.00 -1.23 0.00 0.00 66.70 64.29 2oz8 h VAL 148 Cb 0.30 1.30 -0.01 0.00 -2.13 0.00 0.00 31.29 30.75 2oz8 h VAL 148 CO 0.00 0.37 0.05 -1.28 -1.23 0.00 0.00 177.57 175.49 2oz8 h SER 149 N 0.41 0.17 -0.19 4.19 0.87 -1.20 0.18 113.55 117.97 2oz8 h SER 149 Ca 0.07 -0.14 -0.01 0.00 -1.23 0.00 0.00 61.79 60.47 2oz8 h SER 149 Cb 0.60 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.51 2oz8 h SER 149 CO 0.04 0.26 0.08 0.25 -0.53 0.00 0.00 176.83 176.93 2oz8 h LEU 150 N 0.06 0.27 -0.35 2.23 6.46 -1.17 -1.56 115.31 121.24 2oz8 h LEU 150 Ca 0.04 -0.16 -0.12 0.00 -0.12 0.00 0.00 57.88 57.52 2oz8 h LEU 150 Cb 0.14 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.00 2oz8 h LEU 150 CO -0.00 0.35 -0.26 -0.26 -0.62 0.00 0.00 178.44 177.65 2oz8 h PHE 151 N 0.16 0.94 -1.00 1.25 0.04 -1.23 -1.67 116.94 115.43 2oz8 h PHE 151 Ca 0.06 -0.26 0.09 0.00 2.80 0.00 0.00 57.97 60.66 2oz8 h PHE 151 Cb 0.17 -0.21 -0.07 0.00 2.20 0.00 0.00 35.95 38.04 2oz8 h PHE 151 CO -0.01 1.03 0.64 0.77 -0.60 0.00 0.00 178.31 180.14 2oz8 h SER 152 N 0.59 0.99 -0.55 2.17 0.02 -0.63 -0.62 113.55 115.52 2oz8 h SER 152 Ca 0.07 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.02 2oz8 h SER 152 Cb 0.83 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 2oz8 h SER 152 CO 0.07 0.60 0.25 -0.74 -1.14 0.00 0.00 176.83 175.87 2oz8 h HIS 153 N 1.11 0.80 -0.26 3.45 -0.00 -0.95 0.66 115.15 119.95 2oz8 h HIS 153 Ca 0.45 -0.04 -0.02 0.00 -0.00 0.00 0.00 60.37 60.76 2oz8 h HIS 153 Cb 0.28 -0.25 -0.01 0.00 -0.00 0.00 0.00 27.41 27.44 2oz8 h HIS 153 CO -0.00 0.63 0.10 0.00 -0.00 0.00 0.00 177.93 178.66 2oz8 h ALA 154 N 1.09 0.34 -0.64 5.26 0.00 -0.73 -1.92 119.26 122.67 2oz8 h ALA 154 Ca 0.19 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2oz8 h ALA 154 Cb 0.14 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2oz8 h ALA 154 CO -0.02 -0.05 0.26 0.00 0.00 0.00 0.00 179.25 179.44 2oz8 h ALA 155 N 0.94 1.27 0.00 0.00 0.00 -0.93 -2.38 119.26 118.17 2oz8 h ALA 155 Ca 0.09 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 2oz8 h ALA 155 Cb 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2oz8 h ALA 155 CO -0.01 0.55 -0.26 0.66 0.00 0.00 0.00 179.25 180.19 2oz8 h SER 156 N 0.91 0.00 -0.48 0.00 4.64 -0.14 -2.26 113.55 116.23 2oz8 h SER 156 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2oz8 h SER 156 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 2oz8 h SER 156 CO -0.02 0.26 0.00 2.30 -0.87 0.00 0.00 176.83 178.50 2oz8 n ILE 157 N -4.22 1.19 0.00 0.95 -5.35 -0.80 -4.94 119.36 106.20 2oz8 n ILE 157 Ca -0.02 -0.81 0.00 0.00 -0.27 0.00 0.00 62.75 61.65 2oz8 n ILE 157 Cb 0.31 0.07 0.00 0.00 -1.74 0.00 0.00 39.64 38.29 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 0.98 0.72 3.77 3.28 0.00 -0.85 -3.79 105.19 109.30 2oz8 n GLY 158 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 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 2.55 0.00 1.61 2.02 -0.94 -3.38 117.35 117.21 2oz8 s TYR 159 Ca 0.00 1.28 0.00 0.00 -0.37 0.00 0.00 57.07 57.98 2oz8 s TYR 159 Cb 0.00 -3.89 0.00 0.00 -0.40 0.00 0.00 41.96 37.67 2oz8 s TYR 159 CO 0.00 -2.77 0.31 -1.13 -1.57 0.00 0.00 175.55 170.38 2oz8 n SER 160 N -0.03 0.53 -4.05 2.29 3.41 -1.26 -4.52 113.62 109.98 2oz8 n SER 160 Ca 0.04 -1.07 -0.19 0.00 -0.26 0.00 0.00 58.87 57.39 2oz8 n SER 160 Cb 0.42 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.23 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 0.83 -0.02 7.33 0.00 -1.26 -0.69 121.76 127.87 2oz8 s ALA 161 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.46 2oz8 s ALA 161 Cb 0.00 -0.18 0.02 0.00 0.00 0.00 0.00 23.12 22.96 2oz8 s ALA 161 CO 0.00 0.18 -0.00 -0.06 0.00 0.00 0.00 175.76 175.88 2oz8 s PHE 162 N -0.43 0.21 -0.11 0.00 0.08 0.06 -0.78 117.98 117.02 2oz8 s PHE 162 Ca 0.02 0.02 0.03 0.00 0.12 0.00 0.00 56.93 57.12 2oz8 s PHE 162 Cb -0.05 -0.28 0.00 0.00 -0.57 0.00 0.00 43.02 42.12 2oz8 s PHE 162 CO -0.00 -0.08 -0.22 0.21 -0.10 0.00 0.00 175.22 175.02 2oz8 s LYS 163 N 0.69 2.93 0.18 0.44 2.20 0.31 -0.51 119.74 125.98 2oz8 s LYS 163 Ca -0.07 -0.83 0.11 0.00 -0.36 0.00 0.00 55.97 54.82 2oz8 s LYS 163 Cb -0.09 -2.27 -0.04 0.00 -1.51 0.00 0.00 37.83 33.92 2oz8 s LYS 163 CO -0.01 0.11 -0.24 0.96 -0.36 0.00 0.00 175.35 175.80 2oz8 s ILE 164 N 0.51 2.32 0.17 5.43 -4.36 -0.80 -2.62 121.20 121.84 2oz8 s ILE 164 Ca -0.15 -1.98 -0.15 0.00 -0.26 0.00 0.00 60.65 58.10 2oz8 s ILE 164 Cb -0.17 -2.09 -0.07 0.00 1.25 0.00 0.00 42.46 41.38 2oz8 s ILE 164 CO 0.05 -0.09 0.59 -0.54 0.24 0.00 0.00 174.94 175.20 2oz8 s LYS 165 N -2.56 4.04 0.00 0.37 -0.14 -1.26 -1.68 119.74 118.50 2oz8 s LYS 165 Ca 0.19 0.58 0.00 0.00 -1.36 0.00 0.00 55.97 55.38 2oz8 s LYS 165 Cb -0.08 -2.91 0.00 0.00 -1.68 0.00 0.00 37.83 33.15 2oz8 s LYS 165 CO 0.09 0.46 0.00 1.33 -0.76 0.00 0.00 175.35 176.47 2oz8 n VAL 166 N 0.77 0.00 0.00 3.17 0.24 -0.72 -4.71 118.33 117.08 2oz8 n VAL 166 Ca -0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.26 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 0.00 1.12 3.76 7.63 0.00 -1.26 -4.22 105.19 112.21 2oz8 n GLY 167 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2oz8 n GLY 167 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2oz8 s HIS 168 N -2.00 2.75 0.30 1.61 3.76 -1.26 -4.90 115.29 115.54 2oz8 s HIS 168 Ca 0.00 1.02 0.05 0.00 -0.15 0.00 0.00 55.06 55.97 2oz8 s HIS 168 Cb 0.00 -3.99 0.79 0.00 1.11 0.00 0.00 32.58 30.49 2oz8 s HIS 168 CO 0.00 -3.09 1.65 0.00 -0.85 0.00 0.00 174.74 172.45 2oz8 h ARG 169 N 4.02 0.24 -4.93 1.40 3.08 -1.99 -3.29 114.38 112.92 2oz8 h ARG 169 Ca -0.49 -0.01 -0.69 0.00 0.07 0.00 0.00 59.98 58.86 2oz8 h ARG 169 Cb 1.23 -0.05 -0.18 0.00 0.08 0.00 0.00 29.97 31.04 2oz8 h ARG 169 CO 0.72 0.16 -0.05 0.34 -1.07 0.00 0.00 179.97 180.07 2oz8 s ASP 170 N -5.06 6.22 0.55 7.04 2.15 -1.26 -4.92 116.67 121.40 2oz8 s ASP 170 Ca -0.12 -0.81 0.23 0.00 0.43 0.00 0.00 52.55 52.29 2oz8 s ASP 170 Cb 0.27 -2.26 1.53 0.00 -0.30 0.00 0.00 42.92 42.15 2oz8 s ASP 170 CO 0.78 -0.76 2.17 0.15 -0.17 0.00 0.00 175.17 177.33 2oz8 h PHE 171 N 8.88 0.00 -0.20 -5.34 3.57 -1.99 -1.03 116.94 120.82 2oz8 h PHE 171 Ca -0.27 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.21 2oz8 h PHE 171 Cb 1.10 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.83 2oz8 h PHE 171 CO 0.70 0.00 0.06 -0.44 -2.23 0.00 0.00 178.31 176.39 2oz8 h ASP 172 N 0.00 0.25 -0.47 0.41 3.32 -1.91 -1.48 116.42 116.54 2oz8 h ASP 172 Ca 0.03 -0.02 0.07 0.00 0.02 0.00 0.00 57.03 57.13 2oz8 h ASP 172 Cb 0.16 -0.06 -0.06 0.00 0.22 0.00 0.00 39.33 39.59 2oz8 h ASP 172 CO -0.00 0.26 0.15 0.03 -1.72 0.00 0.00 179.24 177.96 2oz8 h ARG 173 N 0.28 0.30 -0.07 3.56 2.47 -1.56 0.26 114.38 119.62 2oz8 h ARG 173 Ca 0.07 -0.02 0.02 0.00 -1.26 0.00 0.00 59.98 58.79 2oz8 h ARG 173 Cb 0.11 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.34 2oz8 h ARG 173 CO -0.00 0.20 -0.04 -0.44 0.56 0.00 0.00 179.97 180.25 2oz8 h ASP 174 N 0.31 -0.13 -0.84 7.04 3.32 -1.39 -2.08 116.42 122.66 2oz8 h ASP 174 Ca 0.23 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.29 2oz8 h ASP 174 Cb 0.25 0.07 -0.04 0.00 0.22 0.00 0.00 39.33 39.83 2oz8 h ASP 174 CO -0.25 -0.05 0.46 -0.07 -1.72 0.00 0.00 179.24 177.60 2oz8 h LEU 175 N -0.04 1.05 -1.30 1.55 3.38 -1.17 -2.28 115.31 116.51 2oz8 h LEU 175 Ca 0.04 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 2oz8 h LEU 175 Cb 0.10 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 2oz8 h LEU 175 CO -0.09 0.85 0.25 -0.09 0.09 0.00 0.00 178.44 179.45 2oz8 h ARG 176 N 1.17 0.74 -0.45 1.13 2.43 -0.19 -0.42 114.38 118.79 2oz8 h ARG 176 Ca 0.30 -0.09 -0.14 0.00 -0.81 0.00 0.00 59.98 59.24 2oz8 h ARG 176 Cb 0.04 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 2oz8 h ARG 176 CO -0.05 0.57 -0.26 -0.09 -1.51 0.00 0.00 179.97 178.64 2oz8 h ARG 177 N 0.74 0.95 -0.21 0.20 9.65 -0.99 0.43 114.38 125.14 2oz8 h ARG 177 Ca 0.19 -0.43 -0.12 0.00 -1.10 0.00 0.00 59.98 58.52 2oz8 h ARG 177 Cb 0.08 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.62 2oz8 h ARG 177 CO -0.03 1.09 -0.39 -0.07 2.80 0.00 0.00 179.97 183.38 2oz8 h LEU 178 N 0.81 0.50 -0.76 3.80 3.38 -1.15 0.19 115.31 122.08 2oz8 h LEU 178 Ca 0.10 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 2oz8 h LEU 178 Cb 0.83 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.42 2oz8 h LEU 178 CO 0.07 0.84 0.17 -0.33 0.09 0.00 0.00 178.44 179.28 2oz8 h GLU 179 N 0.40 1.11 -0.16 1.13 5.08 -0.54 -2.08 114.58 119.52 2oz8 h GLU 179 Ca 0.04 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.09 2oz8 h GLU 179 Cb 0.85 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 2oz8 h GLU 179 CO 0.07 0.98 -0.10 1.25 -1.00 0.00 0.00 179.01 180.21 2oz8 h LEU 180 N 1.05 0.35 -0.86 1.33 5.85 0.25 -2.72 115.31 120.56 2oz8 h LEU 180 Ca 0.22 -0.43 0.15 0.00 0.84 0.00 0.00 57.88 58.66 2oz8 h LEU 180 Cb 0.37 -0.10 -0.10 0.00 0.37 0.00 0.00 40.66 41.20 2oz8 h LEU 180 CO 0.00 0.71 0.44 0.25 -0.34 0.00 0.00 178.44 179.50 2oz8 h LEU 181 N -0.00 0.53 -1.13 2.25 5.85 -0.59 -2.51 115.31 119.71 2oz8 h LEU 181 Ca 0.03 0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 2oz8 h LEU 181 Cb 0.59 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 2oz8 h LEU 181 CO 0.03 0.21 0.06 0.50 -0.34 0.00 0.00 178.44 178.90 2oz8 h LYS 182 N 0.62 0.67 0.00 1.25 3.64 -1.07 -2.39 116.57 119.29 2oz8 h LYS 182 Ca 0.47 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 2oz8 h LYS 182 Cb 0.68 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 2oz8 h LYS 182 CO -0.37 0.65 0.00 1.79 -2.27 0.00 0.00 179.45 179.25 2oz8 h THR 183 N 0.64 0.00 -0.19 1.00 1.35 -1.26 -3.29 112.91 111.16 2oz8 h THR 183 Ca 0.14 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 2oz8 h THR 183 Cb 0.32 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 67.92 2oz8 h THR 183 CO 0.01 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.28 2oz8 s VAL 185 N -1.13 0.78 0.55 0.00 -7.23 -1.20 -4.26 120.40 107.90 2oz8 s VAL 185 Ca 0.15 -1.27 -0.21 0.00 -1.81 0.00 0.00 61.98 58.84 2oz8 s VAL 185 Cb 0.08 -0.91 -0.06 0.00 0.56 0.00 0.00 36.38 36.06 2oz8 s VAL 185 CO 0.09 -0.39 1.13 -2.65 -0.31 0.00 0.00 175.10 172.97 2oz8 n PRO 186 N 1.20 1.29 -1.77 4.82 -0.02 -1.26 -4.91 135.00 134.35 2oz8 n PRO 186 Ca -0.21 0.48 -0.39 0.00 -2.02 0.00 0.00 63.50 61.36 2oz8 n PRO 186 Cb 0.55 -2.31 0.03 0.00 -0.02 0.00 0.00 33.50 31.75 2oz8 n PRO 186 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2oz8 s ALA 187 N -1.38 3.06 0.00 3.55 0.00 -1.26 -2.73 121.76 123.00 2oz8 s ALA 187 Ca 0.72 1.43 0.00 0.00 0.00 0.00 0.00 51.96 54.11 2oz8 s ALA 187 Cb -0.44 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.09 2oz8 s ALA 187 CO 0.50 -1.30 0.00 0.41 0.00 0.00 0.00 175.76 175.36 2oz8 n GLY 188 N 0.64 0.73 3.79 0.00 0.00 -1.26 -5.06 105.19 104.03 2oz8 n GLY 188 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 2oz8 n GLY 188 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2oz8 s SER 189 N -2.41 6.25 0.11 1.61 0.01 -1.10 -5.01 113.70 113.15 2oz8 s SER 189 Ca 0.00 2.05 -0.27 0.00 1.31 0.00 0.00 55.95 59.04 2oz8 s SER 189 Cb 0.00 -2.57 -0.06 0.00 0.21 0.00 0.00 66.02 63.59 2oz8 s SER 189 CO 0.00 -0.85 0.84 -0.54 0.41 0.00 0.00 173.24 173.11 2oz8 s LYS 190 N -3.05 4.61 -0.08 12.44 3.01 0.13 -4.99 119.74 131.81 2oz8 s LYS 190 Ca 0.66 1.24 0.04 0.00 -1.01 0.00 0.00 55.97 56.90 2oz8 s LYS 190 Cb -0.20 -3.34 0.00 0.00 -1.01 0.00 0.00 37.83 33.28 2oz8 s LYS 190 CO 0.24 0.35 -0.19 0.08 0.51 0.00 0.00 175.35 176.34 2oz8 s VAL 191 N -0.38 1.67 0.11 3.17 1.01 -1.26 -0.76 120.40 123.96 2oz8 s VAL 191 Ca 0.41 -0.81 0.10 0.00 0.00 0.00 0.00 61.98 61.68 2oz8 s VAL 191 Cb -0.22 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 2oz8 s VAL 191 CO 0.27 0.47 -0.24 0.00 0.00 0.00 0.00 175.10 175.59 2oz8 s MET 192 N 0.35 1.33 0.18 2.72 0.23 0.33 0.15 119.30 124.59 2oz8 s MET 192 Ca -0.14 -1.25 0.11 0.00 -1.03 0.00 0.00 55.69 53.38 2oz8 s MET 192 Cb -0.16 -1.70 -0.04 0.00 -1.53 0.00 0.00 34.83 31.39 2oz8 s MET 192 CO 0.06 0.41 -0.23 0.96 -2.03 0.00 0.00 175.02 174.18 2oz8 s ILE 193 N -1.07 2.25 -0.35 3.16 -4.36 -0.95 -1.91 121.20 117.97 2oz8 s ILE 193 Ca 0.11 -1.99 -0.00 0.00 -0.26 0.00 0.00 60.65 58.51 2oz8 s ILE 193 Cb -0.10 -2.06 0.13 0.00 1.25 0.00 0.00 42.46 41.68 2oz8 s ILE 193 CO 0.05 -0.13 0.20 -0.62 0.24 0.00 0.00 174.94 174.67 2oz8 s ASP 194 N -2.62 3.21 0.04 4.36 -1.08 -0.68 -1.25 116.67 118.65 2oz8 s ASP 194 Ca 0.19 -2.10 0.17 0.00 -0.52 0.00 0.00 52.55 50.29 2oz8 s ASP 194 Cb -0.08 -0.52 0.73 0.00 -1.46 0.00 0.00 42.92 41.60 2oz8 s ASP 194 CO 0.09 -0.33 1.55 -2.65 0.52 0.00 0.00 175.17 174.35 2oz8 n PRO 195 N 4.17 0.03 -4.28 4.34 -0.02 -1.24 -1.76 135.00 136.25 2oz8 n PRO 195 Ca 0.08 0.24 -0.32 0.00 -2.02 0.00 0.00 63.50 61.48 2oz8 n PRO 195 Cb 0.38 -1.55 -0.08 0.00 -0.02 0.00 0.00 33.50 32.22 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 -1.60 0.41 -0.04 2.55 2.85 -1.16 -2.34 115.26 115.93 2oz8 n ASN 196 Ca 0.04 -1.27 -0.00 0.00 -0.11 0.00 0.00 54.58 53.24 2oz8 n ASN 196 Cb 0.20 -1.68 -0.00 0.00 1.24 0.00 0.00 39.78 39.54 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 -4.62 -0.25 0.21 1.20 1.02 0.12 -4.72 120.64 113.59 2oz8 n GLU 197 Ca -0.31 0.16 0.15 0.00 -0.02 0.00 0.00 57.16 57.14 2oz8 n GLU 197 Cb 0.69 -3.43 0.58 0.00 -0.02 0.00 0.00 31.44 29.26 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 1.00 -2.72 0.62 0.00 -1.54 -3.37 119.26 113.24 2oz8 h ALA 198 Ca -0.01 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.33 2oz8 h ALA 198 Cb 0.14 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 2oz8 h ALA 198 CO 0.01 0.00 -0.53 -1.58 0.00 0.00 0.00 179.25 177.15 2oz8 s TRP 199 N -3.49 3.28 0.62 0.00 0.51 -1.07 -5.06 118.94 113.73 2oz8 s TRP 199 Ca 0.03 0.05 -0.06 0.00 -2.12 0.00 0.00 56.10 54.00 2oz8 s TRP 199 Cb 0.09 -1.59 0.02 0.00 -0.81 0.00 0.00 33.47 31.18 2oz8 s TRP 199 CO 0.48 0.52 0.93 0.95 -0.51 0.00 0.00 176.95 179.33 2oz8 s THR 200 N -1.70 3.42 0.12 2.01 -4.23 -1.26 -3.96 115.64 110.04 2oz8 s THR 200 Ca 0.32 -0.01 -0.21 0.00 -1.18 0.00 0.00 61.69 60.61 2oz8 s THR 200 Cb -0.11 -3.38 -0.07 0.00 1.34 0.00 0.00 72.50 70.28 2oz8 s THR 200 CO 0.25 -0.40 1.71 0.77 -0.54 0.00 0.00 174.62 176.41 2oz8 h SER 201 N -0.28 -0.14 0.36 3.99 4.64 -1.94 0.16 113.55 120.34 2oz8 h SER 201 Ca -0.45 0.04 -0.21 0.00 -0.47 0.00 0.00 61.79 60.70 2oz8 h SER 201 Cb 1.27 0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 63.44 2oz8 h SER 201 CO 0.61 -0.05 -0.86 0.50 -0.87 0.00 0.00 176.83 176.16 2oz8 h LYS 202 N -0.01 0.37 -0.47 4.77 1.63 -1.96 -1.04 116.57 119.84 2oz8 h LYS 202 Ca 0.06 -0.36 0.05 0.00 -0.85 0.00 0.00 60.65 59.56 2oz8 h LYS 202 Cb 0.11 0.09 -0.05 0.00 -0.60 0.00 0.00 32.23 31.79 2oz8 h LYS 202 CO -0.14 1.03 0.19 1.49 -3.45 0.00 0.00 179.45 178.58 2oz8 h GLU 203 N 0.22 0.38 -0.52 1.90 4.81 -1.92 -0.65 114.58 118.80 2oz8 h GLU 203 Ca -0.06 -0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.21 2oz8 h GLU 203 Cb 1.47 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 30.72 2oz8 h GLU 203 CO 0.14 0.25 0.24 0.00 -0.73 0.00 0.00 179.01 178.91 2oz8 h ALA 204 N 1.29 0.66 -0.37 2.92 0.00 -0.44 -0.85 119.26 122.48 2oz8 h ALA 204 Ca 0.22 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 2oz8 h ALA 204 Cb 0.19 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2oz8 h ALA 204 CO -0.20 -0.13 -0.18 1.25 0.00 0.00 0.00 179.25 179.98 2oz8 h LEU 205 N 0.45 0.80 -0.79 0.00 5.85 -0.85 -0.81 115.31 119.96 2oz8 h LEU 205 Ca 0.24 -0.41 -0.10 0.00 0.84 0.00 0.00 57.88 58.45 2oz8 h LEU 205 Cb 0.20 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 2oz8 h LEU 205 CO -0.20 1.03 -0.16 0.71 -0.34 0.00 0.00 178.44 179.48 2oz8 h THR 206 N 0.57 1.26 -0.50 1.05 1.35 -0.90 -0.87 112.91 114.88 2oz8 h THR 206 Ca 0.08 -1.22 -0.08 0.00 -0.55 0.00 0.00 66.41 64.63 2oz8 h THR 206 Cb 0.73 1.13 -0.02 0.00 -1.73 0.00 0.00 68.15 68.26 2oz8 h THR 206 CO 0.06 0.41 -0.02 0.11 -0.25 0.00 0.00 175.52 175.83 2oz8 h LYS 207 N 0.66 0.86 -0.53 4.72 1.57 -1.09 -0.40 116.57 122.36 2oz8 h LYS 207 Ca 0.10 -0.25 -0.06 0.00 -1.87 0.00 0.00 60.65 58.57 2oz8 h LYS 207 Cb 0.64 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.83 2oz8 h LYS 207 CO 0.04 0.87 0.08 -0.07 -0.57 0.00 0.00 179.45 179.81 2oz8 h LEU 208 N 0.79 0.79 -0.02 2.94 3.38 -0.43 0.80 115.31 123.57 2oz8 h LEU 208 Ca 0.15 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2oz8 h LEU 208 Cb 0.50 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 2oz8 h LEU 208 CO 0.03 0.80 0.01 0.58 0.09 0.00 0.00 178.44 179.95 2oz8 h VAL 209 N 0.80 1.05 -0.36 1.22 2.07 -0.87 -1.80 116.25 118.35 2oz8 h VAL 209 Ca 0.17 -0.15 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 2oz8 h VAL 209 Cb 0.36 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 2oz8 h VAL 209 CO 0.01 0.04 0.08 0.00 0.02 0.00 0.00 177.57 177.72 2oz8 h ALA 210 N 0.95 1.47 -0.53 1.67 0.00 -0.66 -0.94 119.26 121.22 2oz8 h ALA 210 Ca 0.01 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.66 2oz8 h ALA 210 Cb 0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2oz8 h ALA 210 CO -0.00 0.39 -0.10 0.82 0.00 0.00 0.00 179.25 180.36 2oz8 h ILE 211 N 0.52 1.27 -0.24 0.00 2.04 -0.64 -2.25 117.51 118.21 2oz8 h ILE 211 Ca 0.12 -1.25 -0.00 0.00 1.00 0.00 0.00 64.86 64.73 2oz8 h ILE 211 Cb 0.21 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2oz8 h ILE 211 CO -0.00 0.44 0.14 -0.09 0.00 0.00 0.00 178.15 178.63 2oz8 h ARG 212 N 0.87 0.34 0.00 2.37 2.43 -0.75 -2.69 114.38 116.95 2oz8 h ARG 212 Ca 0.14 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.23 2oz8 h ARG 212 Cb 0.66 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 2oz8 h ARG 212 CO 0.05 0.29 -0.20 0.93 -1.51 0.00 0.00 179.97 179.53 2oz8 h GLU 213 N 0.29 0.00 -0.02 0.20 5.08 -1.04 0.70 114.58 119.80 2oz8 h GLU 213 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2oz8 h GLU 213 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2oz8 h GLU 213 CO -0.01 0.20 0.00 0.00 -1.00 0.00 0.00 179.01 178.20 2oz8 n ALA 214 N -2.30 2.56 -2.61 3.43 0.00 -0.86 -4.91 120.51 115.82 2oz8 n ALA 214 Ca -0.01 -0.12 -0.07 0.00 0.00 0.00 0.00 53.44 53.24 2oz8 n ALA 214 Cb 0.33 -1.18 0.02 0.00 0.00 0.00 0.00 19.45 18.61 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 0.72 0.39 3.17 0.00 0.00 0.24 -5.05 105.19 104.66 2oz8 n GLY 215 Ca 0.09 -0.47 -0.34 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.86 3.18 -0.31 1.61 3.76 -1.02 -5.05 115.29 114.60 2oz8 s HIS 216 Ca 0.12 -1.80 -0.20 0.00 -0.15 0.00 0.00 55.06 53.03 2oz8 s HIS 216 Cb -0.05 -2.06 -0.01 0.00 1.11 0.00 0.00 32.58 31.57 2oz8 s HIS 216 CO 0.15 -0.78 0.62 -0.51 -0.85 0.00 0.00 174.74 173.37 2oz8 s ASP 217 N 1.26 6.48 -0.02 1.40 1.01 -1.26 -4.15 116.67 121.39 2oz8 s ASP 217 Ca -0.03 0.38 -0.14 0.00 0.71 0.00 0.00 52.55 53.47 2oz8 s ASP 217 Cb -0.18 -2.33 -0.05 0.00 1.01 0.00 0.00 42.92 41.36 2oz8 s ASP 217 CO -0.03 -0.49 0.38 -0.76 0.21 0.00 0.00 175.17 174.49 2oz8 s LEU 218 N 2.61 4.45 -0.08 1.23 1.43 -1.26 -4.25 118.68 122.80 2oz8 s LEU 218 Ca 0.25 0.90 -0.21 0.00 -1.03 0.00 0.00 54.13 54.04 2oz8 s LEU 218 Cb -0.15 -2.54 -0.29 0.00 0.03 0.00 0.00 46.19 43.24 2oz8 s LEU 218 CO 0.12 0.31 0.75 0.25 0.23 0.00 0.00 176.35 178.01 2oz8 h LEU 219 N 4.89 0.36 -7.53 1.79 5.85 0.99 -3.44 115.31 118.23 2oz8 h LEU 219 Ca -0.51 -0.91 -0.07 0.00 0.84 0.00 0.00 57.88 57.23 2oz8 h LEU 219 Cb 1.22 -0.12 -0.14 0.00 0.37 0.00 0.00 40.66 41.99 2oz8 h LEU 219 CO 0.62 1.41 -0.17 -1.66 -0.34 0.00 0.00 178.44 178.30 2oz8 s TRP 220 N -2.41 -0.10 -0.15 1.25 -2.14 -1.24 -3.44 118.94 110.71 2oz8 s TRP 220 Ca -0.17 -0.23 -0.01 0.00 2.66 0.00 0.00 56.10 58.35 2oz8 s TRP 220 Cb 0.02 0.15 -0.01 0.00 -3.10 0.00 0.00 33.47 30.53 2oz8 s TRP 220 CO 0.78 -0.64 -0.11 0.54 -2.66 0.00 0.00 176.95 174.87 2oz8 s VAL 221 N -3.67 3.09 -0.10 -0.66 0.11 -0.15 -2.24 120.40 116.78 2oz8 s VAL 221 Ca 0.03 -0.63 -0.02 0.00 -2.93 0.00 0.00 61.98 58.43 2oz8 s VAL 221 Cb 0.02 -2.33 -0.03 0.00 -1.53 0.00 0.00 36.38 32.52 2oz8 s VAL 221 CO -0.11 0.50 -0.03 -0.70 -3.33 0.00 0.00 175.10 171.44 2oz8 s GLU 222 N 0.64 3.08 -0.91 1.54 2.12 -0.38 -0.41 118.70 124.39 2oz8 s GLU 222 Ca -0.06 -0.47 -0.18 0.00 0.36 0.00 0.00 54.97 54.62 2oz8 s GLU 222 Cb -0.15 -2.77 0.02 0.00 0.26 0.00 0.00 34.13 31.49 2oz8 s GLU 222 CO 0.03 0.58 0.34 -0.25 -0.54 0.00 0.00 175.26 175.42 2oz8 n ASP 223 N 2.50 -1.84 0.23 -1.70 8.00 0.03 -3.60 116.55 120.16 2oz8 n ASP 223 Ca -0.18 -0.91 0.09 0.00 0.71 0.00 0.00 54.79 54.50 2oz8 n ASP 223 Cb 0.53 -1.10 0.55 0.00 -0.02 0.00 0.00 41.12 41.08 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 -0.93 0.00 -4.67 -0.24 0.13 -1.83 0.34 132.00 124.81 2oz8 h PRO 224 Ca -0.49 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.31 2oz8 h PRO 224 Cb 0.98 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.97 2oz8 h PRO 224 CO 0.40 0.22 -0.53 0.96 -0.23 0.00 0.00 178.00 178.82 2oz8 s ILE 225 N -4.08 0.00 -0.19 -3.56 -4.36 -1.26 -2.59 121.20 105.16 2oz8 s ILE 225 Ca -0.02 -1.96 -0.40 0.00 -0.26 0.00 0.00 60.65 58.00 2oz8 s ILE 225 Cb 0.13 -2.50 -0.17 0.00 1.25 0.00 0.00 42.46 41.17 2oz8 s ILE 225 CO 0.64 0.00 1.54 -0.11 0.24 0.00 0.00 174.94 177.25 2oz8 n LEU 226 N -0.43 1.74 0.33 0.37 7.94 -1.25 -4.42 117.00 121.28 2oz8 n LEU 226 Ca 0.04 1.11 0.21 0.00 -1.11 0.00 0.00 56.01 56.26 2oz8 n LEU 226 Cb 0.64 -1.09 1.10 0.00 0.53 0.00 0.00 43.42 44.61 2oz8 n LEU 226 CO 0.32 -0.82 1.17 0.08 -1.11 0.00 0.00 177.39 177.03 2oz8 h ARG 227 N 5.70 0.00 -0.25 1.96 0.11 -1.94 -1.78 114.38 118.17 2oz8 h ARG 227 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.61 2oz8 h ARG 227 Cb 1.34 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.42 2oz8 h ARG 227 CO 0.88 0.00 0.00 -2.39 0.10 0.00 0.00 179.97 178.56 2oz8 n HIS 228 N -3.09 0.32 -1.57 4.08 1.44 -1.26 -4.67 115.22 110.48 2oz8 n HIS 228 Ca -0.03 -0.20 -0.42 0.00 -2.01 0.00 0.00 57.72 55.07 2oz8 n HIS 228 Cb 0.16 -0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.25 2oz8 n HIS 228 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 2oz8 n ASP 229 N 1.16 3.85 -0.16 4.39 2.03 -0.67 -4.77 116.55 122.38 2oz8 n ASP 229 Ca 0.15 -2.78 -0.04 0.00 0.52 0.00 0.00 54.79 52.63 2oz8 n ASP 229 Cb 0.51 -1.53 0.05 0.00 -0.72 0.00 0.00 41.12 39.44 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 6.36 0.40 -0.93 -0.67 3.86 -1.85 -0.60 115.15 121.72 2oz8 h HIS 230 Ca 0.55 0.02 0.08 0.00 -1.16 0.00 0.00 60.37 59.87 2oz8 h HIS 230 Cb 0.62 -0.11 -0.07 0.00 1.06 0.00 0.00 27.41 28.91 2oz8 h HIS 230 CO 1.44 0.18 0.58 0.22 0.86 0.00 0.00 177.93 181.21 2oz8 h ASP 231 N 0.44 0.88 -0.50 2.45 3.58 -1.95 -0.75 116.42 120.56 2oz8 h ASP 231 Ca 0.22 0.03 -0.11 0.00 0.42 0.00 0.00 57.03 57.59 2oz8 h ASP 231 Cb 0.17 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 2oz8 h ASP 231 CO -0.18 0.53 -0.13 1.23 -2.88 0.00 0.00 179.24 177.81 2oz8 h GLY 232 N 1.00 1.06 1.07 -0.78 0.00 -1.84 -1.85 103.07 101.72 2oz8 h GLY 232 Ca 0.42 -0.88 -0.08 0.00 0.00 0.00 0.00 47.33 46.80 2oz8 h GLY 232 CO -0.21 0.80 0.13 1.41 0.00 0.00 0.00 176.54 178.67 2oz8 h LEU 233 N 0.83 1.07 -0.53 3.11 3.38 -0.75 -0.86 115.31 121.56 2oz8 h LEU 233 Ca 0.13 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 2oz8 h LEU 233 Cb 0.69 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 2oz8 h LEU 233 CO 0.05 1.04 0.25 0.03 0.09 0.00 0.00 178.44 179.91 2oz8 h ARG 234 N 1.04 0.76 -0.36 1.13 3.08 -1.05 0.22 114.38 119.21 2oz8 h ARG 234 Ca 0.21 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2oz8 h ARG 234 Cb 0.42 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 2oz8 h ARG 234 CO 0.01 0.63 0.23 1.15 -1.07 0.00 0.00 179.97 180.92 2oz8 h THR 235 N 0.70 1.09 -0.32 2.04 2.02 -1.16 -1.28 112.91 116.00 2oz8 h THR 235 Ca 0.18 -0.16 0.03 0.00 0.77 0.00 0.00 66.41 67.23 2oz8 h THR 235 Cb 0.12 0.57 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 2oz8 h THR 235 CO -0.02 0.09 0.12 -0.07 0.37 0.00 0.00 175.52 176.00 2oz8 h LEU 236 N 0.48 0.14 -0.59 2.58 3.38 -0.99 -2.42 115.31 117.88 2oz8 h LEU 236 Ca 0.13 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.23 2oz8 h LEU 236 Cb -0.05 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 40.64 2oz8 h LEU 236 CO -0.03 0.12 0.18 0.03 0.09 0.00 0.00 178.44 178.82 2oz8 h ARG 237 N 0.26 0.32 0.00 1.13 3.08 0.24 -1.81 114.38 117.60 2oz8 h ARG 237 Ca 0.14 -0.02 -0.13 0.00 0.07 0.00 0.00 59.98 60.05 2oz8 h ARG 237 Cb 0.10 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 2oz8 h ARG 237 CO -0.14 0.21 -0.60 0.45 -1.07 0.00 0.00 179.97 178.83 2oz8 h HIS 238 N 0.33 0.00 0.00 3.04 3.86 -1.17 -3.34 115.15 117.86 2oz8 h HIS 238 Ca 0.30 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.43 2oz8 h HIS 238 Cb 0.41 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.87 2oz8 h HIS 238 CO -0.20 0.60 -1.77 0.00 0.86 0.00 0.00 177.93 177.42 2oz8 n ALA 239 N -2.28 2.27 -3.10 2.45 0.00 -0.92 -4.74 120.51 114.19 2oz8 n ALA 239 Ca 0.01 -0.53 -0.45 0.00 0.00 0.00 0.00 53.44 52.47 2oz8 n ALA 239 Cb 0.73 -0.36 -0.04 0.00 0.00 0.00 0.00 19.45 19.78 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 -2.82 4.86 -1.74 0.00 1.01 -0.70 -4.81 120.40 116.21 2oz8 s VAL 240 Ca -0.06 -1.16 0.24 0.00 0.00 0.00 0.00 61.98 61.00 2oz8 s VAL 240 Cb 0.08 -4.53 0.03 0.00 0.00 0.00 0.00 36.38 31.97 2oz8 s VAL 240 CO 0.60 -1.17 1.21 0.35 0.00 0.00 0.00 175.10 176.09 2oz8 n THR 241 N 5.42 0.00 0.78 3.92 -2.24 -1.26 -4.25 114.28 116.64 2oz8 n THR 241 Ca -0.04 -0.17 0.09 0.00 -2.27 0.00 0.00 64.05 61.66 2oz8 n THR 241 Cb 0.44 0.92 0.02 0.00 -2.10 0.00 0.00 70.33 69.61 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 -0.51 0.00 -3.83 4.78 2.14 -1.26 -5.02 117.44 113.74 2oz8 n TRP 242 Ca 0.09 0.00 -0.07 0.00 2.07 0.00 0.00 57.50 59.59 2oz8 n TRP 242 Cb 0.41 0.00 0.01 0.00 -0.81 0.00 0.00 31.31 30.92 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 -1.88 0.00 -0.02 -1.67 -1.32 -1.26 -4.78 115.64 104.72 2oz8 s THR 243 Ca 0.17 -0.92 0.01 0.00 -1.21 0.00 0.00 61.69 59.73 2oz8 s THR 243 Cb 0.15 -2.57 -0.04 0.00 -1.51 0.00 0.00 72.50 68.53 2oz8 s THR 243 CO 0.38 0.00 0.01 -1.10 -2.21 0.00 0.00 174.62 171.69 2oz8 s GLN 244 N -2.81 2.85 -0.41 7.08 -0.21 -1.22 -4.90 119.66 120.03 2oz8 s GLN 244 Ca 0.15 -0.56 -0.15 0.00 0.02 0.00 0.00 55.36 54.81 2oz8 s GLN 244 Cb -0.05 -2.71 0.02 0.00 1.00 0.00 0.00 33.01 31.27 2oz8 s GLN 244 CO 0.09 0.64 0.33 0.42 -2.12 0.00 0.00 175.29 174.65 2oz8 s ILE 245 N -1.05 5.22 -0.25 1.08 -1.09 -1.26 -0.98 121.20 122.87 2oz8 s ILE 245 Ca 0.19 -0.57 -0.13 0.00 -2.23 0.00 0.00 60.65 57.91 2oz8 s ILE 245 Cb -0.12 -3.95 -0.04 0.00 -1.58 0.00 0.00 42.46 36.77 2oz8 s ILE 245 CO 0.09 -0.33 0.27 0.21 -1.23 0.00 0.00 174.94 173.95 2oz8 s ASN 246 N 1.71 6.20 0.10 3.58 3.84 0.45 -1.31 114.94 129.51 2oz8 s ASN 246 Ca 0.07 0.22 0.02 0.00 0.21 0.00 0.00 52.86 53.37 2oz8 s ASN 246 Cb -0.18 -2.16 -0.04 0.00 -0.55 0.00 0.00 41.25 38.31 2oz8 s ASN 246 CO 0.11 -0.05 -0.07 -0.55 -2.79 0.00 0.00 177.10 173.75 2oz8 s SER 247 N 1.34 1.18 0.00 -4.21 0.15 0.44 -0.79 113.70 111.81 2oz8 s SER 247 Ca 0.12 -0.98 0.00 0.00 0.70 0.00 0.00 55.95 55.78 2oz8 s SER 247 Cb -0.15 0.08 0.00 0.00 -1.71 0.00 0.00 66.02 64.25 2oz8 s SER 247 CO 0.08 -0.44 0.00 0.61 1.20 0.00 0.00 173.24 174.69 2oz8 n GLY 248 N 0.03 0.86 3.65 9.45 0.00 -1.26 -1.10 105.19 116.81 2oz8 n GLY 248 Ca -0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 2oz8 n GLY 248 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2oz8 n GLU 249 N 0.00 1.56 -0.93 1.61 4.07 -1.26 -2.42 120.64 123.27 2oz8 n GLU 249 Ca 0.00 0.56 0.00 0.00 -0.06 0.00 0.00 57.16 57.66 2oz8 n GLU 249 Cb 0.00 -2.20 0.00 0.00 -0.06 0.00 0.00 31.44 29.18 2oz8 n GLU 249 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 2oz8 n TYR 250 N -0.46 0.00 -3.98 4.31 4.02 -1.26 -4.93 117.16 114.85 2oz8 n TYR 250 Ca 0.09 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.62 2oz8 n TYR 250 Cb 0.40 -0.36 -0.06 0.00 -0.02 0.00 0.00 39.34 39.29 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 4.22 0.00 7.72 1.43 -1.02 -5.11 118.68 125.92 2oz8 s LEU 251 Ca 0.00 0.37 -0.06 0.00 -1.03 0.00 0.00 54.13 53.41 2oz8 s LEU 251 Cb 0.00 -2.13 0.16 0.00 0.03 0.00 0.00 46.19 44.25 2oz8 s LEU 251 CO 0.00 0.37 1.03 -0.90 0.23 0.00 0.00 176.35 177.08 2oz8 n ASP 252 N 1.78 0.83 -0.22 2.29 5.68 -1.26 -4.76 116.55 120.89 2oz8 n ASP 252 Ca -0.18 -1.83 -0.05 0.00 -0.50 0.00 0.00 54.79 52.23 2oz8 n ASP 252 Cb 0.54 -0.72 0.05 0.00 -1.14 0.00 0.00 41.12 39.85 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 0.68 -0.84 -2.12 6.46 -1.99 0.30 115.31 117.81 2oz8 h LEU 253 Ca -0.34 -0.01 -0.03 0.00 -0.12 0.00 0.00 57.88 57.38 2oz8 h LEU 253 Cb 1.11 -0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 40.84 2oz8 h LEU 253 CO 0.31 0.49 0.41 1.56 -0.62 0.00 0.00 178.44 180.58 2oz8 h GLN 254 N 0.81 1.21 -0.60 1.25 7.50 -1.99 -1.53 115.11 121.75 2oz8 h GLN 254 Ca 0.24 -0.18 -0.09 0.00 0.50 0.00 0.00 58.65 59.12 2oz8 h GLN 254 Cb -0.05 -0.22 -0.02 0.00 0.05 0.00 0.00 27.48 27.23 2oz8 h GLN 254 CO -0.07 0.93 0.03 0.78 -1.50 0.00 0.00 178.83 179.00 2oz8 h GLY 255 N 1.19 1.11 1.12 3.46 0.00 -1.44 -1.39 103.07 107.12 2oz8 h GLY 255 Ca 0.29 -0.78 -0.10 0.00 0.00 0.00 0.00 47.33 46.74 2oz8 h GLY 255 CO -0.04 0.72 -0.05 0.50 0.00 0.00 0.00 176.54 177.67 2oz8 h LYS 256 N 0.95 1.04 -0.68 4.80 1.57 -0.38 -0.86 116.57 123.00 2oz8 h LYS 256 Ca 0.18 -0.35 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 2oz8 h LYS 256 Cb 0.51 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 2oz8 h LYS 256 CO 0.02 1.04 0.40 -0.09 -0.57 0.00 0.00 179.45 180.25 2oz8 h ARG 257 N 0.94 0.94 -0.56 3.15 2.43 -1.01 -1.46 114.38 118.80 2oz8 h ARG 257 Ca 0.16 -0.10 -0.07 0.00 -0.81 0.00 0.00 59.98 59.16 2oz8 h ARG 257 Cb 0.60 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.94 2oz8 h ARG 257 CO 0.04 0.69 0.08 -0.07 -1.51 0.00 0.00 179.97 179.19 2oz8 h LEU 258 N 0.93 0.87 -0.07 3.80 3.38 -1.13 0.32 115.31 123.41 2oz8 h LEU 258 Ca 0.24 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 58.05 2oz8 h LEU 258 Cb 0.00 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 2oz8 h LEU 258 CO -0.04 0.88 -0.08 0.25 0.09 0.00 0.00 178.44 179.54 2oz8 h LEU 259 N 0.86 -0.25 -0.47 1.67 5.85 -0.78 0.82 115.31 123.00 2oz8 h LEU 259 Ca 0.18 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.98 2oz8 h LEU 259 Cb 0.40 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 2oz8 h LEU 259 CO 0.01 -0.12 0.26 -0.07 -0.34 0.00 0.00 178.44 178.18 2oz8 h LEU 260 N -0.11 0.39 -1.73 2.25 3.38 -1.03 -2.48 115.31 115.99 2oz8 h LEU 260 Ca 0.06 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.11 2oz8 h LEU 260 Cb 0.19 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2oz8 h LEU 260 CO -0.14 0.27 0.30 -0.33 0.09 0.00 0.00 178.44 178.64 2oz8 h GLU 261 N 0.51 0.33 0.00 1.13 5.08 -0.47 -1.63 114.58 119.53 2oz8 h GLU 261 Ca 0.20 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 2oz8 h GLU 261 Cb 0.08 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2oz8 h GLU 261 CO -0.12 0.22 0.00 0.00 -1.00 0.00 0.00 179.01 178.10 2oz8 n ALA 262 N -2.52 2.36 -3.54 3.43 0.00 0.24 -4.92 120.51 115.55 2oz8 n ALA 262 Ca 0.06 -0.13 -0.22 0.00 0.00 0.00 0.00 53.44 53.14 2oz8 n ALA 262 Cb 0.27 -1.43 0.08 0.00 0.00 0.00 0.00 19.45 18.37 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 -1.22 -2.73 -1.14 0.00 8.25 -0.61 -4.90 115.22 112.87 2oz8 n HIS 263 Ca 0.14 0.97 0.06 0.00 -0.26 0.00 0.00 57.72 58.64 2oz8 n HIS 263 Cb 0.18 -4.90 0.21 0.00 1.12 0.00 0.00 29.99 26.61 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 -4.84 3.11 -3.58 -1.41 0.00 -1.15 -4.68 120.51 107.95 2oz8 n ALA 264 Ca -0.01 -2.61 -0.11 0.00 0.00 0.00 0.00 53.44 50.71 2oz8 n ALA 264 Cb 0.57 -0.62 -0.10 0.00 0.00 0.00 0.00 19.45 19.30 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 -2.95 -1.19 0.07 0.00 0.00 -1.26 -4.74 121.76 111.68 2oz8 s ALA 265 Ca 0.40 1.58 -0.04 0.00 0.00 0.00 0.00 51.96 53.91 2oz8 s ALA 265 Cb 0.34 -0.94 -0.28 0.00 0.00 0.00 0.00 23.12 22.24 2oz8 s ALA 265 CO 0.05 -0.27 1.10 -0.44 0.00 0.00 0.00 175.76 176.20 2oz8 h ASP 266 N 6.56 0.40 -4.32 0.00 3.32 -1.56 -3.46 116.42 117.35 2oz8 h ASP 266 Ca -0.33 -0.44 -0.31 0.00 0.02 0.00 0.00 57.03 55.97 2oz8 h ASP 266 Cb 1.19 -0.13 -0.25 0.00 0.22 0.00 0.00 39.33 40.36 2oz8 h ASP 266 CO 0.25 1.35 -0.75 -0.63 -1.72 0.00 0.00 179.24 177.74 2oz8 s ILE 267 N -2.65 0.52 -0.28 0.35 1.01 -0.86 -4.17 121.20 115.11 2oz8 s ILE 267 Ca -0.04 -0.66 -0.08 0.00 0.00 0.00 0.00 60.65 59.87 2oz8 s ILE 267 Cb 0.07 -0.51 -0.01 0.00 0.01 0.00 0.00 42.46 42.02 2oz8 s ILE 267 CO 0.88 -0.11 0.09 -0.22 0.00 0.00 0.00 174.94 175.57 2oz8 s LEU 268 N -0.85 3.75 0.13 2.97 2.96 -0.74 -0.42 118.68 126.48 2oz8 s LEU 268 Ca -0.03 -0.48 -0.27 0.00 -0.22 0.00 0.00 54.13 53.13 2oz8 s LEU 268 Cb -0.06 -1.92 -0.07 0.00 0.50 0.00 0.00 46.19 44.64 2oz8 s LEU 268 CO 0.00 -0.13 0.85 0.54 -1.32 0.00 0.00 176.35 176.28 2oz8 s ASN 269 N 1.57 7.41 0.23 3.68 2.20 -0.26 -1.90 114.94 127.87 2oz8 s ASN 269 Ca 0.05 1.67 0.01 0.00 -0.94 0.00 0.00 52.86 53.65 2oz8 s ASN 269 Cb -0.16 -2.53 -0.05 0.00 -2.00 0.00 0.00 41.25 36.51 2oz8 s ASN 269 CO 0.04 0.08 0.10 0.68 -2.94 0.00 0.00 177.10 175.05 2oz8 s VAL 270 N -0.55 0.39 0.00 3.54 -7.23 -0.57 -4.54 120.40 111.45 2oz8 s VAL 270 Ca 0.40 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.58 2oz8 s VAL 270 Cb -0.23 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.18 2oz8 s VAL 270 CO 0.27 -0.06 0.00 1.41 -0.31 0.00 0.00 175.10 176.41 2oz8 n HIS 271 N -0.37 0.00 -0.01 2.82 8.25 -1.26 -0.18 115.22 124.47 2oz8 n HIS 271 Ca -0.00 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.50 2oz8 n HIS 271 Cb 0.66 0.00 0.09 0.00 1.12 0.00 0.00 29.99 31.86 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 1.94 3.56 -1.41 0.00 -1.26 -4.82 105.19 108.20 2oz8 n GLY 272 Ca 0.00 -0.27 -0.23 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.92 2.25 0.18 1.61 1.11 -1.26 -4.73 119.66 117.90 2oz8 s GLN 273 Ca 0.15 -0.04 -0.17 0.00 0.01 0.00 0.00 55.36 55.32 2oz8 s GLN 273 Cb 0.09 -4.97 0.15 0.00 -1.01 0.00 0.00 33.01 27.26 2oz8 s GLN 273 CO 0.12 -3.71 1.63 0.28 0.01 0.00 0.00 175.29 173.61 2oz8 h VAL 274 N 7.39 0.38 -0.28 1.09 2.07 -1.86 0.12 116.25 125.16 2oz8 h VAL 274 Ca 0.06 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.52 2oz8 h VAL 274 Cb 1.01 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 2oz8 h VAL 274 CO 1.15 0.00 -0.06 0.74 0.02 0.00 0.00 177.57 179.42 2oz8 h THR 275 N -0.08 1.28 -0.57 2.57 2.02 -1.88 -1.60 112.91 114.64 2oz8 h THR 275 Ca 0.23 -1.07 0.00 0.00 0.77 0.00 0.00 66.41 66.35 2oz8 h THR 275 Cb 0.45 1.40 -0.03 0.00 -1.74 0.00 0.00 68.15 68.23 2oz8 h THR 275 CO -0.55 0.34 0.36 0.44 0.37 0.00 0.00 175.52 176.48 2oz8 h ASP 276 N 0.30 0.67 -0.44 4.18 3.32 -1.81 -1.64 116.42 120.99 2oz8 h ASP 276 Ca 0.07 -0.04 -0.11 0.00 0.02 0.00 0.00 57.03 56.98 2oz8 h ASP 276 Cb 0.53 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2oz8 h ASP 276 CO 0.03 0.51 -0.13 0.58 -1.72 0.00 0.00 179.24 178.50 2oz8 h VAL 277 N 0.77 1.27 -0.00 -1.35 2.07 -0.87 0.70 116.25 118.84 2oz8 h VAL 277 Ca 0.21 -1.26 -0.12 0.00 0.82 0.00 0.00 66.70 66.35 2oz8 h VAL 277 Cb -0.06 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 2oz8 h VAL 277 CO -0.04 0.44 -0.57 0.24 0.02 0.00 0.00 177.57 177.65 2oz8 h MET 278 N 0.82 0.00 -0.06 1.57 2.86 -1.16 0.33 114.93 119.29 2oz8 h MET 278 Ca 0.13 -0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.72 2oz8 h MET 278 Cb 0.67 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.33 2oz8 h MET 278 CO 0.05 0.58 -0.13 0.00 1.06 0.00 0.00 176.91 178.47 2oz8 h ARG 279 N 0.00 0.18 0.00 1.72 3.08 -0.75 -2.18 114.38 116.44 2oz8 h ARG 279 Ca -0.01 -0.12 -0.05 0.00 0.07 0.00 0.00 59.98 59.87 2oz8 h ARG 279 Cb 1.02 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.08 2oz8 h ARG 279 CO 0.07 0.72 -0.25 0.97 -1.07 0.00 0.00 179.97 180.42 2oz8 h ILE 280 N -0.33 0.82 -0.22 2.04 6.09 -0.89 -2.54 117.51 122.50 2oz8 h ILE 280 Ca -0.00 -0.99 -0.12 0.00 -1.37 0.00 0.00 64.86 62.38 2oz8 h ILE 280 Cb 0.72 1.60 -0.01 0.00 0.47 0.00 0.00 36.82 39.60 2oz8 h ILE 280 CO 0.03 0.24 -0.39 1.23 -3.07 0.00 0.00 178.15 176.19 2oz8 h GLY 281 N 1.29 0.53 0.91 8.18 0.00 -0.34 0.24 103.07 113.88 2oz8 h GLY 281 Ca -0.00 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.80 2oz8 h GLY 281 CO 0.03 0.47 0.10 -0.25 0.00 0.00 0.00 176.54 176.89 2oz8 h TRP 282 N 0.41 0.36 0.42 5.60 7.01 -1.11 -2.78 115.95 125.86 2oz8 h TRP 282 Ca 0.04 -0.03 -0.02 0.00 2.11 0.00 0.00 58.89 60.99 2oz8 h TRP 282 Cb 0.86 -0.11 0.00 0.00 -2.10 0.00 0.00 29.16 27.82 2oz8 h TRP 282 CO 0.03 0.38 -0.22 1.25 -2.79 0.00 0.00 178.44 177.09 2oz8 h LEU 283 N 0.24 -0.52 -1.33 0.65 5.85 -1.26 -2.09 115.31 116.85 2oz8 h LEU 283 Ca 0.08 0.02 0.19 0.00 0.84 0.00 0.00 57.88 59.02 2oz8 h LEU 283 Cb 0.17 0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.26 2oz8 h LEU 283 CO -0.01 -0.36 0.61 0.00 -0.34 0.00 0.00 178.44 178.34 2oz8 h ALA 284 N -0.01 2.01 -0.43 1.25 0.00 -0.61 -0.79 119.26 120.68 2oz8 h ALA 284 Ca -0.05 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 2oz8 h ALA 284 Cb 0.46 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2oz8 h ALA 284 CO 0.08 -0.32 -0.07 0.00 0.00 0.00 0.00 179.25 178.94 2oz8 h ALA 285 N 1.62 0.59 -0.09 0.00 0.00 -1.18 0.15 119.26 120.34 2oz8 h ALA 285 Ca 0.51 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 2oz8 h ALA 285 Cb 1.05 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2oz8 h ALA 285 CO -0.24 0.45 -0.07 0.93 0.00 0.00 0.00 179.25 180.31 2oz8 h GLU 286 N 0.64 0.13 0.00 0.00 4.39 -0.47 -2.91 114.58 116.36 2oz8 h GLU 286 Ca 0.11 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.79 2oz8 h GLU 286 Cb 0.60 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 2oz8 h GLU 286 CO 0.04 0.21 -0.97 1.28 -1.16 0.00 0.00 179.01 178.41 2oz8 n LEU 287 N -4.39 0.65 -0.61 1.33 4.77 -0.89 -5.00 117.00 112.86 2oz8 n LEU 287 Ca -0.02 0.12 -0.06 0.00 -0.03 0.00 0.00 56.01 56.02 2oz8 n LEU 287 Cb 0.19 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.16 2oz8 n LEU 287 CO 0.36 -0.03 -0.07 0.61 -1.33 0.00 0.00 177.39 176.93 2oz8 n GLY 288 N 1.32 0.28 3.61 -0.72 0.00 0.31 -5.05 105.19 104.95 2oz8 n GLY 288 Ca 0.02 -0.68 -0.38 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.27 5.32 0.84 -0.61 -1.09 -0.05 -5.04 121.20 118.30 2oz8 s ILE 289 Ca 0.00 0.20 -0.11 0.00 -2.23 0.00 0.00 60.65 58.50 2oz8 s ILE 289 Cb 0.00 -3.53 0.09 0.00 -1.58 0.00 0.00 42.46 37.44 2oz8 s ILE 289 CO 0.00 0.28 1.09 -2.16 -1.23 0.00 0.00 174.94 172.92 2oz8 s PRO 290 N 1.54 1.73 0.00 2.79 0.04 -1.26 -4.47 135.00 135.38 2oz8 s PRO 290 Ca 0.08 0.86 0.01 0.00 0.04 0.00 0.00 61.00 61.99 2oz8 s PRO 290 Cb -0.15 -1.86 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 2oz8 s PRO 290 CO 0.09 -1.92 -0.05 0.42 0.04 0.00 0.00 177.00 175.58 2oz8 s ILE 291 N -2.98 0.38 0.07 0.56 1.01 -0.61 -1.79 121.20 117.83 2oz8 s ILE 291 Ca 0.62 -0.35 0.08 0.00 0.00 0.00 0.00 60.65 61.00 2oz8 s ILE 291 Cb -0.17 -0.35 -0.03 0.00 0.01 0.00 0.00 42.46 41.92 2oz8 s ILE 291 CO 0.56 0.01 -0.20 -0.94 0.00 0.00 0.00 174.94 174.36 2oz8 s SER 292 N -0.38 3.66 -0.28 3.58 1.04 -0.80 -3.75 113.70 116.78 2oz8 s SER 292 Ca -0.01 -0.51 -0.12 0.00 0.48 0.00 0.00 55.95 55.79 2oz8 s SER 292 Cb -0.03 -0.50 -0.05 0.00 0.10 0.00 0.00 66.02 65.54 2oz8 s SER 292 CO -0.00 0.23 0.22 -0.63 0.98 0.00 0.00 173.24 174.04 2oz8 s ILE 293 N -0.96 5.29 0.00 -1.02 -1.09 -0.90 -1.51 121.20 121.01 2oz8 s ILE 293 Ca 0.15 0.22 0.00 0.00 -2.23 0.00 0.00 60.65 58.79 2oz8 s ILE 293 Cb -0.10 -3.56 0.00 0.00 -1.58 0.00 0.00 42.46 37.22 2oz8 s ILE 293 CO 0.06 0.23 0.00 0.61 -1.23 0.00 0.00 174.94 174.61 2oz8 n GLY 294 N 5.00 -1.22 3.68 6.18 0.00 0.75 -0.76 105.19 118.82 2oz8 n GLY 294 Ca -0.13 -1.60 -0.47 0.00 0.00 0.00 0.00 46.02 43.82 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 -1.51 3.46 -4.39 1.61 5.03 -1.26 -4.36 115.26 113.84 2oz8 n ASN 295 Ca 0.00 1.00 -0.27 0.00 0.87 0.00 0.00 54.58 56.18 2oz8 n ASN 295 Cb 0.00 -1.41 -0.12 0.00 -1.02 0.00 0.00 39.78 37.23 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 3.13 2.21 -0.01 3.41 -4.23 -1.26 -4.66 115.64 114.22 2oz8 s THR 296 Ca 0.88 -1.88 -0.30 0.00 -1.18 0.00 0.00 61.69 59.21 2oz8 s THR 296 Cb -0.65 -2.00 -0.07 0.00 1.34 0.00 0.00 72.50 71.12 2oz8 s THR 296 CO 0.46 -0.06 1.76 0.12 -0.54 0.00 0.00 174.62 176.37 2oz8 s PHE 297 N -1.45 1.76 -1.64 3.99 5.36 -1.26 -1.70 117.98 123.04 2oz8 s PHE 297 Ca 0.17 -0.03 0.00 0.00 -0.96 0.00 0.00 56.93 56.10 2oz8 s PHE 297 Cb -0.09 -4.04 0.00 0.00 -0.34 0.00 0.00 43.02 38.56 2oz8 s PHE 297 CO 0.08 -4.47 0.00 1.28 -1.46 0.00 0.00 175.22 170.65 2oz8 n LEU 298 N 7.18 -1.57 -1.40 6.12 4.77 -1.26 -3.11 117.00 127.73 2oz8 n LEU 298 Ca 0.18 0.17 -0.17 0.00 -0.03 0.00 0.00 56.01 56.16 2oz8 n LEU 298 Cb 0.42 -2.64 -0.06 0.00 -2.33 0.00 0.00 43.42 38.82 2oz8 n LEU 298 CO 0.64 -0.40 -0.17 -0.62 -1.33 0.00 0.00 177.39 175.51 2oz8 n GLU 299 N -2.73 -1.19 -0.33 3.23 4.71 -0.69 -4.54 120.64 119.09 2oz8 n GLU 299 Ca -0.20 1.04 0.21 0.00 -0.01 0.00 0.00 57.16 58.19 2oz8 n GLU 299 Cb 0.64 -5.29 0.43 0.00 -1.01 0.00 0.00 31.44 26.21 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 0.15 1.84 0.00 0.62 0.00 -1.77 -1.99 119.26 118.11 2oz8 h ALA 300 Ca -0.35 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2oz8 h ALA 300 Cb 1.13 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2oz8 h ALA 300 CO 0.50 -0.46 0.00 0.41 0.00 0.00 0.00 179.25 179.69 2oz8 n GLY 301 N -1.30 -0.78 0.48 0.00 0.00 -1.26 -2.69 105.19 99.63 2oz8 n GLY 301 Ca 0.29 -0.00 0.31 0.00 0.00 0.00 0.00 46.02 46.62 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 0.42 -0.50 1.61 3.04 -1.75 -0.13 116.25 118.94 2oz8 h VAL 302 Ca 0.00 -0.06 -0.11 0.00 -1.01 0.00 0.00 66.70 65.52 2oz8 h VAL 302 Cb 0.13 0.24 -0.02 0.00 -2.01 0.00 0.00 31.29 29.64 2oz8 h VAL 302 CO 0.00 0.03 -0.12 0.45 -1.01 0.00 0.00 177.57 176.92 2oz8 h HIS 303 N 0.16 1.08 -0.11 3.17 3.86 -1.76 -0.97 115.15 120.59 2oz8 h HIS 303 Ca 0.61 -0.23 -0.18 0.00 -1.16 0.00 0.00 60.37 59.40 2oz8 h HIS 303 Cb 2.03 -0.26 -0.00 0.00 1.06 0.00 0.00 27.41 30.23 2oz8 h HIS 303 CO -0.00 1.03 -0.68 0.52 0.86 0.00 0.00 177.93 179.67 2oz8 h MET 304 N 0.82 0.46 -0.72 2.45 2.86 -1.65 -2.74 114.93 116.42 2oz8 h MET 304 Ca 0.13 -0.35 -0.03 0.00 -2.06 0.00 0.00 59.70 57.39 2oz8 h MET 304 Cb 0.69 0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.38 2oz8 h MET 304 CO 0.05 0.97 0.34 0.00 1.06 0.00 0.00 176.91 179.33 2oz8 h ALA 305 N 0.93 0.93 0.00 6.32 0.00 -0.69 -0.55 119.26 126.20 2oz8 h ALA 305 Ca -0.02 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 2oz8 h ALA 305 Cb 1.24 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2oz8 h ALA 305 CO 0.12 0.50 -0.35 -0.39 0.00 0.00 0.00 179.25 179.13 2oz8 h VAL 306 N 1.01 0.64 0.00 0.00 -1.51 -1.23 -3.33 116.25 111.82 2oz8 h VAL 306 Ca 0.25 -1.77 -0.23 0.00 -1.23 0.00 0.00 66.70 63.72 2oz8 h VAL 306 Cb 0.13 2.21 -0.04 0.00 -2.13 0.00 0.00 31.29 31.47 2oz8 h VAL 306 CO -0.03 0.34 -1.19 0.00 -1.23 0.00 0.00 177.57 175.47 2oz8 h ALA 307 N 1.65 0.48 -2.30 5.19 0.00 -1.02 -3.42 119.26 119.84 2oz8 h ALA 307 Ca -0.00 -1.05 -0.55 0.00 0.00 0.00 0.00 54.91 53.30 2oz8 h ALA 307 Cb 1.19 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 2oz8 h ALA 307 CO 0.05 1.33 0.55 -0.51 0.00 0.00 0.00 179.25 180.66 2oz8 s LEU 308 N -6.52 4.28 0.30 0.00 1.43 -0.29 -4.59 118.68 113.27 2oz8 s LEU 308 Ca -0.01 1.60 -0.01 0.00 -1.03 0.00 0.00 54.13 54.69 2oz8 s LEU 308 Cb 0.09 -3.56 0.45 0.00 0.03 0.00 0.00 46.19 43.21 2oz8 s LEU 308 CO 0.82 -0.43 1.88 1.55 0.23 0.00 0.00 176.35 180.39 2oz8 h PRO 309 N 7.08 0.85 -0.44 1.29 0.13 -1.89 -2.98 132.00 136.06 2oz8 h PRO 309 Ca -0.33 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2oz8 h PRO 309 Cb 1.16 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2oz8 h PRO 309 CO 0.84 0.70 0.00 -0.85 -0.23 0.00 0.00 178.00 178.46 2oz8 n GLU 310 N -4.32 1.97 -3.72 0.86 0.00 -1.26 -4.79 120.64 109.38 2oz8 n GLU 310 Ca 0.05 -1.23 -0.35 0.00 0.00 0.00 0.00 57.16 55.63 2oz8 n GLU 310 Cb 0.17 -1.38 -0.09 0.00 0.00 0.00 0.00 31.44 30.14 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 -1.61 5.35 -0.04 3.84 1.01 -1.13 -1.57 120.40 126.25 2oz8 s VAL 311 Ca 0.22 0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.41 2oz8 s VAL 311 Cb 0.13 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 2oz8 s VAL 311 CO 0.13 0.41 0.09 -1.84 0.00 0.00 0.00 175.10 173.89 2oz8 n GLU 312 N 3.77 1.81 -4.17 2.72 0.28 -1.25 -4.94 120.64 118.86 2oz8 n GLU 312 Ca -0.16 -0.02 -0.16 0.00 -0.16 0.00 0.00 57.16 56.67 2oz8 n GLU 312 Cb 0.52 -0.95 -0.13 0.00 1.43 0.00 0.00 31.44 32.31 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 -1.94 0.62 -0.02 -1.84 0.52 -1.26 -3.34 118.94 111.67 2oz8 s TRP 313 Ca -0.00 -0.24 0.06 0.00 0.02 0.00 0.00 56.10 55.93 2oz8 s TRP 313 Cb 0.02 -0.39 -0.01 0.00 -1.15 0.00 0.00 33.47 31.94 2oz8 s TRP 313 CO 0.13 -0.03 -0.19 -1.17 0.02 0.00 0.00 176.95 175.71 2oz8 s LEU 314 N -0.64 2.01 0.06 2.99 0.20 0.10 -2.11 118.68 121.29 2oz8 s LEU 314 Ca -0.01 -0.36 -0.30 0.00 0.69 0.00 0.00 54.13 54.14 2oz8 s LEU 314 Cb -0.05 -1.02 -0.05 0.00 -0.43 0.00 0.00 46.19 44.64 2oz8 s LEU 314 CO 0.00 0.22 1.02 -0.70 -0.29 0.00 0.00 176.35 176.60 2oz8 s GLU 315 N -0.32 4.59 -0.10 1.98 2.12 0.06 -1.63 118.70 125.39 2oz8 s GLU 315 Ca 0.04 1.52 0.04 0.00 0.36 0.00 0.00 54.97 56.93 2oz8 s GLU 315 Cb -0.09 -3.40 0.00 0.00 0.26 0.00 0.00 34.13 30.91 2oz8 s GLU 315 CO 0.00 0.01 -0.21 -0.47 -0.54 0.00 0.00 175.26 174.05 2oz8 s TYR 316 N 0.56 2.34 -0.10 5.30 5.04 -0.40 -4.58 117.35 125.51 2oz8 s TYR 316 Ca 0.51 -0.97 0.15 0.00 -2.44 0.00 0.00 57.07 54.33 2oz8 s TYR 316 Cb -0.24 -1.59 0.23 0.00 0.35 0.00 0.00 41.96 40.71 2oz8 s TYR 316 CO 0.30 -0.40 1.11 0.43 -1.34 0.00 0.00 175.55 175.64 2oz8 n SER 317 N 3.62 2.13 -2.76 4.32 7.64 -1.26 -0.02 113.62 127.29 2oz8 n SER 317 Ca -0.20 -2.86 -0.21 0.00 1.01 0.00 0.00 58.87 56.61 2oz8 n SER 317 Cb 0.53 -0.35 0.01 0.00 -1.01 0.00 0.00 64.21 63.38 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 -1.21 -1.55 -2.61 1.43 3.72 -1.26 -4.86 117.46 111.11 2oz8 n PHE 318 Ca 0.13 0.28 -0.35 0.00 -0.05 0.00 0.00 57.45 57.47 2oz8 n PHE 318 Cb 0.59 -4.10 -0.04 0.00 -0.94 0.00 0.00 39.48 34.99 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 -5.43 4.00 -1.39 -1.08 -0.21 -1.26 -4.77 119.66 109.53 2oz8 s GLN 319 Ca 0.17 1.35 -0.12 0.00 0.02 0.00 0.00 55.36 56.79 2oz8 s GLN 319 Cb -0.08 -2.25 0.09 0.00 1.00 0.00 0.00 33.01 31.78 2oz8 s GLN 319 CO 0.21 -0.26 2.11 0.27 -2.12 0.00 0.00 175.29 175.51 2oz8 n ASN 320 N -0.62 4.72 -0.00 5.90 6.94 -1.26 -4.40 115.26 126.53 2oz8 n ASN 320 Ca 0.07 -2.96 0.01 0.00 -0.02 0.00 0.00 54.58 51.69 2oz8 n ASN 320 Cb 0.52 -1.57 -0.01 0.00 -2.36 0.00 0.00 39.78 36.36 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 4.89 0.00 0.32 -2.53 3.72 -1.26 -4.77 117.46 117.83 2oz8 n PHE 321 Ca 0.48 0.00 0.20 0.00 -0.05 0.00 0.00 57.45 58.08 2oz8 n PHE 321 Cb 0.37 -0.02 1.09 0.00 -0.94 0.00 0.00 39.48 39.97 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 0.76 4.37 5.19 -1.93 -1.97 116.42 122.84 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 0.05 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.56 2oz8 h ASP 322 CO 0.00 0.01 0.00 1.12 -3.12 0.00 0.00 179.24 177.25 2oz8 h HIS 323 N 0.00 0.00 0.00 4.55 2.07 -1.89 -3.06 115.15 116.82 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 0.06 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.04 2oz8 h HIS 323 CO 0.00 0.00 0.00 1.28 -3.07 0.00 0.00 177.93 176.14 2oz8 n LEU 324 N -2.76 0.00 -4.20 6.12 4.77 -0.74 -4.64 117.00 115.55 2oz8 n LEU 324 Ca 0.01 0.50 -0.12 0.00 -0.03 0.00 0.00 56.01 56.36 2oz8 n LEU 324 Cb 0.24 -0.50 -0.10 0.00 -2.33 0.00 0.00 43.42 40.73 2oz8 n LEU 324 CO 0.23 -0.05 -0.38 0.68 -1.33 0.00 0.00 177.39 176.54 2oz8 s VAL 325 N -2.99 0.80 0.06 4.08 -7.23 -1.16 -1.00 120.40 112.96 2oz8 s VAL 325 Ca 0.13 -1.97 -0.21 0.00 -1.81 0.00 0.00 61.98 58.11 2oz8 s VAL 325 Cb 0.17 -1.79 -0.13 0.00 0.56 0.00 0.00 36.38 35.20 2oz8 s VAL 325 CO 0.48 -0.79 1.50 -0.33 -0.31 0.00 0.00 175.10 175.65 2oz8 h GLU 326 N 2.88 0.23 -3.04 4.82 5.08 -0.80 -3.42 114.58 120.34 2oz8 h GLU 326 Ca -0.36 -0.07 -0.31 0.00 -1.00 0.00 0.00 59.36 57.62 2oz8 h GLU 326 Cb 1.18 -0.02 -0.36 0.00 0.50 0.00 0.00 28.75 30.04 2oz8 h GLU 326 CO 0.64 0.45 -0.65 1.14 -1.00 0.00 0.00 179.01 179.59 2oz8 s GLN 327 N -5.05 0.04 0.81 2.33 -2.07 -1.26 -5.06 119.66 109.41 2oz8 s GLN 327 Ca -0.14 0.47 -0.11 0.00 -1.82 0.00 0.00 55.36 53.76 2oz8 s GLN 327 Cb 0.06 -0.49 0.08 0.00 -1.09 0.00 0.00 33.01 31.56 2oz8 s GLN 327 CO 0.71 -0.37 1.09 -1.25 -1.32 0.00 0.00 175.29 174.15 2oz8 s PRO 328 N 2.28 1.96 0.32 9.60 0.04 -1.26 -4.66 135.00 143.27 2oz8 s PRO 328 Ca 0.04 1.03 -0.29 0.00 0.04 0.00 0.00 61.00 61.81 2oz8 s PRO 328 Cb -0.13 -1.87 -0.11 0.00 0.04 0.00 0.00 34.50 32.43 2oz8 s PRO 328 CO -0.06 -1.81 1.57 -0.89 0.04 0.00 0.00 177.00 175.84 2oz8 n ILE 329 N -3.62 1.32 -2.82 0.56 2.08 -1.26 -4.95 119.36 110.67 2oz8 n ILE 329 Ca 0.08 -0.33 -0.41 0.00 0.56 0.00 0.00 62.75 62.65 2oz8 n ILE 329 Cb 0.54 -1.97 -0.03 0.00 -0.75 0.00 0.00 39.64 37.42 2oz8 n ILE 329 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 2oz8 s GLU 330 N -1.00 4.48 -0.19 0.38 2.12 -1.26 -4.96 118.70 118.27 2oz8 s GLU 330 Ca 0.61 1.22 0.01 0.00 0.36 0.00 0.00 54.97 57.17 2oz8 s GLU 330 Cb -0.49 -3.48 0.02 0.00 0.26 0.00 0.00 34.13 30.45 2oz8 s GLU 330 CO 0.53 -0.08 -0.19 0.42 -0.54 0.00 0.00 175.26 175.40 2oz8 s ILE 331 N 1.21 2.03 -0.09 -3.70 1.01 -1.26 -1.19 121.20 119.22 2oz8 s ILE 331 Ca 0.46 -0.99 -0.00 0.00 0.00 0.00 0.00 60.65 60.12 2oz8 s ILE 331 Cb -0.19 -1.87 0.02 0.00 0.01 0.00 0.00 42.46 40.43 2oz8 s ILE 331 CO 0.22 0.47 -0.06 -0.60 0.00 0.00 0.00 174.94 174.98 2oz8 s ARG 332 N 1.29 1.22 -1.46 2.79 3.52 -0.40 -4.80 118.95 121.11 2oz8 s ARG 332 Ca 0.04 -0.16 -0.10 0.00 -0.13 0.00 0.00 55.73 55.38 2oz8 s ARG 332 Cb -0.14 -1.32 0.05 0.00 -1.56 0.00 0.00 34.95 31.99 2oz8 s ARG 332 CO -0.12 -0.22 0.81 -0.25 -0.81 0.00 0.00 175.30 174.71 2oz8 n ASP 333 N 4.77 -5.17 -0.36 -2.12 9.92 -1.25 -1.95 116.55 120.40 2oz8 n ASP 333 Ca -0.14 -0.53 -0.05 0.00 -0.53 0.00 0.00 54.79 53.55 2oz8 n ASP 333 Cb 0.50 -4.15 -0.02 0.00 -0.64 0.00 0.00 41.12 36.81 2oz8 n ASP 333 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2oz8 n GLY 334 N -1.59 0.73 3.15 0.44 0.00 -1.22 -4.65 105.19 102.06 2oz8 n GLY 334 Ca -0.01 -0.86 -0.29 0.00 0.00 0.00 0.00 46.02 44.86 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 -2.17 2.16 -0.11 1.61 2.02 -0.82 -0.78 117.35 119.26 2oz8 s TYR 335 Ca 0.00 -0.85 -0.10 0.00 -0.37 0.00 0.00 57.07 55.75 2oz8 s TYR 335 Cb 0.00 -1.47 -0.05 0.00 -0.40 0.00 0.00 41.96 40.04 2oz8 s TYR 335 CO 0.00 -0.36 0.22 0.00 -1.57 0.00 0.00 175.55 173.85 2oz8 s ALA 336 N 0.42 3.77 -0.17 3.71 0.00 0.32 -1.27 121.76 128.54 2oz8 s ALA 336 Ca -0.17 -0.52 -0.04 0.00 0.00 0.00 0.00 51.96 51.24 2oz8 s ALA 336 Cb -0.17 -2.16 -0.02 0.00 0.00 0.00 0.00 23.12 20.77 2oz8 s ALA 336 CO 0.07 0.45 -0.04 0.71 0.00 0.00 0.00 175.76 176.94 2oz8 s TYR 337 N -0.63 2.99 -0.23 0.00 2.02 -0.33 -1.46 117.35 119.73 2oz8 s TYR 337 Ca 0.16 -0.45 -0.29 0.00 -0.37 0.00 0.00 57.07 56.12 2oz8 s TYR 337 Cb -0.13 -1.99 0.00 0.00 -0.40 0.00 0.00 41.96 39.44 2oz8 s TYR 337 CO 0.05 -0.16 1.12 0.00 -1.57 0.00 0.00 175.55 174.99 2oz8 s ALA 338 N 0.63 3.64 0.67 3.71 0.00 0.14 -4.17 121.76 126.39 2oz8 s ALA 338 Ca -0.03 0.23 -0.13 0.00 0.00 0.00 0.00 51.96 52.03 2oz8 s ALA 338 Cb -0.14 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.38 2oz8 s ALA 338 CO 0.02 -1.18 1.08 -1.25 0.00 0.00 0.00 175.76 174.43 2oz8 s PRO 339 N 3.40 2.88 -0.32 0.00 0.04 -1.26 -4.91 135.00 134.82 2oz8 s PRO 339 Ca 0.48 1.19 0.00 0.00 0.04 0.00 0.00 61.00 62.71 2oz8 s PRO 339 Cb -0.17 -1.97 0.29 0.00 0.04 0.00 0.00 34.50 32.69 2oz8 s PRO 339 CO 0.11 -1.16 1.83 -3.47 0.04 0.00 0.00 177.00 174.34 2oz8 n ASP 340 N -2.69 5.43 -4.87 6.66 2.03 -1.26 -4.82 116.55 117.04 2oz8 n ASP 340 Ca 0.09 -3.05 -0.24 0.00 0.52 0.00 0.00 54.79 52.11 2oz8 n ASP 340 Cb 0.53 -0.91 -0.04 0.00 -0.72 0.00 0.00 41.12 39.97 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 -1.96 3.12 0.56 -0.67 0.52 -1.26 -4.86 118.95 114.40 2oz8 s ARG 341 Ca 0.33 -0.85 -0.20 0.00 -0.52 0.00 0.00 55.73 54.49 2oz8 s ARG 341 Cb 0.27 -2.73 -0.04 0.00 0.52 0.00 0.00 34.95 32.97 2oz8 s ARG 341 CO 0.02 0.46 1.28 -1.25 0.02 0.00 0.00 175.30 175.82 2oz8 s PRO 342 N -3.52 3.10 3.23 3.54 0.04 -1.26 -3.35 135.00 136.77 2oz8 s PRO 342 Ca 0.33 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.39 2oz8 s PRO 342 Cb -0.09 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.32 2oz8 s PRO 342 CO 0.26 -1.16 0.00 0.41 0.04 0.00 0.00 177.00 176.55 2oz8 n GLY 343 N 0.65 0.19 0.02 0.56 0.00 0.11 -3.38 105.19 103.34 2oz8 n GLY 343 Ca 0.12 -0.91 0.14 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.15 1.61 1.44 -1.26 0.13 115.22 116.98 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 -0.37 0.00 0.00 0.12 0.00 0.00 29.99 29.74 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 1.43 0.73 3.76 -1.39 0.00 -1.22 -4.76 105.19 103.75 2oz8 n GLY 345 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 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 4.29 -0.04 0.99 1.43 -1.26 -4.79 118.68 119.30 2oz8 s LEU 346 Ca 0.00 0.52 0.02 0.00 -1.03 0.00 0.00 54.13 53.64 2oz8 s LEU 346 Cb 0.00 -2.31 0.01 0.00 0.03 0.00 0.00 46.19 43.92 2oz8 s LEU 346 CO 0.00 0.19 -0.07 -0.69 0.23 0.00 0.00 176.35 176.00 2oz8 s VAL 347 N 0.03 0.72 0.31 -1.59 1.01 -1.26 -4.83 120.40 114.79 2oz8 s VAL 347 Ca 0.16 -0.27 -0.30 0.00 0.00 0.00 0.00 61.98 61.57 2oz8 s VAL 347 Cb -0.13 -0.68 -0.11 0.00 0.00 0.00 0.00 36.38 35.46 2oz8 s VAL 347 CO 0.04 0.25 1.55 -0.22 0.00 0.00 0.00 175.10 176.72 2oz8 s LEU 348 N 0.58 4.35 -0.17 3.92 2.96 -1.26 -0.16 118.68 128.89 2oz8 s LEU 348 Ca -0.09 2.93 -0.29 0.00 -0.22 0.00 0.00 54.13 56.46 2oz8 s LEU 348 Cb -0.12 -3.64 -0.00 0.00 0.50 0.00 0.00 46.19 42.93 2oz8 s LEU 348 CO 0.01 -0.87 1.02 -0.55 -1.32 0.00 0.00 176.35 174.64 2oz8 s SER 349 N 0.33 7.16 0.27 3.68 0.15 -0.17 -4.55 113.70 120.57 2oz8 s SER 349 Ca 0.60 1.44 -0.02 0.00 0.70 0.00 0.00 55.95 58.68 2oz8 s SER 349 Cb -0.47 -2.55 0.37 0.00 -1.71 0.00 0.00 66.02 61.67 2oz8 s SER 349 CO 0.51 -0.57 1.80 -0.33 1.20 0.00 0.00 173.24 175.85 2oz8 h GLU 350 N 7.29 0.82 -0.15 5.44 4.39 -1.92 0.80 114.58 131.26 2oz8 h GLU 350 Ca -0.24 -0.19 0.05 0.00 0.34 0.00 0.00 59.36 59.32 2oz8 h GLU 350 Cb 1.10 -0.11 -0.07 0.00 -0.10 0.00 0.00 28.75 29.57 2oz8 h GLU 350 CO 0.92 0.77 -0.36 0.87 -1.16 0.00 0.00 179.01 180.05 2oz8 h LYS 351 N 0.79 -0.41 -0.26 2.33 1.57 -1.96 -2.27 116.57 116.36 2oz8 h LYS 351 Ca 0.17 0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.86 2oz8 h LYS 351 Cb 0.35 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 2oz8 h LYS 351 CO 0.01 -0.27 -0.31 0.00 -0.57 0.00 0.00 179.45 178.30 2oz8 h ALA 352 N 0.33 0.98 -0.66 3.86 0.00 -1.75 -1.09 119.26 120.93 2oz8 h ALA 352 Ca 0.09 -0.39 0.12 0.00 0.00 0.00 0.00 54.91 54.73 2oz8 h ALA 352 Cb 0.58 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 2oz8 h ALA 352 CO -0.38 0.60 0.44 -0.09 0.00 0.00 0.00 179.25 179.82 2oz8 h ARG 353 N 0.46 0.40 0.00 0.00 2.43 -0.54 -0.43 114.38 116.70 2oz8 h ARG 353 Ca 0.06 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2oz8 h ARG 353 Cb 0.77 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2oz8 h ARG 353 CO 0.06 0.26 -0.00 0.78 -1.51 0.00 0.00 179.97 179.56 2oz8 h GLY 354 N 0.41 -0.01 0.94 2.80 0.00 -0.71 -3.26 103.07 103.25 2oz8 h GLY 354 Ca 0.31 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.63 2oz8 h GLY 354 CO -0.09 -0.00 0.15 0.83 0.00 0.00 0.00 176.54 177.42 2oz8 h GLU 355 N -0.97 0.41 -0.00 4.80 5.08 -1.11 -3.36 114.58 119.43 2oz8 h GLU 355 Ca -0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2oz8 h GLU 355 Cb 0.85 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.02 2oz8 h GLU 355 CO 0.00 0.38 -0.86 0.91 -1.00 0.00 0.00 179.01 178.44 2oz8 n TRP 356 N -4.80 0.00 -1.61 4.33 7.02 -0.18 -4.95 117.44 117.25 2oz8 n TRP 356 Ca -0.02 0.00 -0.49 0.00 -1.02 0.00 0.00 57.50 55.97 2oz8 n TRP 356 Cb 0.09 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 28.94 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 -1.33 1.83 -3.48 -0.99 2.88 -1.23 -4.40 113.62 106.91 2oz8 n SER 357 Ca 0.04 1.13 -0.28 0.00 -1.33 0.00 0.00 58.87 58.43 2oz8 n SER 357 Cb 0.31 -1.27 -0.11 0.00 -0.75 0.00 0.00 64.21 62.39 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 -0.06 1.02 0.53 -1.46 1.81 -0.23 -4.97 118.95 115.58 2oz8 s ARG 358 Ca 0.75 -2.08 0.34 0.00 -1.72 0.00 0.00 55.73 53.03 2oz8 s ARG 358 Cb -0.82 -1.66 1.48 0.00 -0.45 0.00 0.00 34.95 33.50 2oz8 s ARG 358 CO 0.49 -1.33 2.00 -1.35 -0.68 0.00 0.00 175.30 174.44 2oz8 h PRO 359 N 5.95 0.00 -5.41 3.54 0.11 -1.93 -3.42 132.00 130.84 2oz8 h PRO 359 Ca 0.20 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 65.67 2oz8 h PRO 359 Cb 0.91 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 31.82 2oz8 h PRO 359 CO 0.39 0.00 -0.65 1.03 -0.21 0.00 0.00 178.00 178.56 2oz8 s ARG 360 N -3.70 3.59 0.11 1.05 0.52 -1.26 -0.14 118.95 119.13 2oz8 s ARG 360 Ca 0.00 -0.49 -0.31 0.00 -0.52 0.00 0.00 55.73 54.42 2oz8 s ARG 360 Cb 0.10 -2.92 -0.10 0.00 0.52 0.00 0.00 34.95 32.54 2oz8 s ARG 360 CO 0.49 0.32 1.85 0.50 0.02 0.00 0.00 175.30 178.48 2oz8 s ARG 361 N 0.16 4.14 0.16 3.54 3.52 -1.26 -4.96 118.95 124.24 2oz8 s ARG 361 Ca -0.01 2.60 0.05 0.00 -0.13 0.00 0.00 55.73 58.24 2oz8 s ARG 361 Cb -0.13 -3.66 -0.04 0.00 -1.56 0.00 0.00 34.95 29.56 2oz8 s ARG 361 CO 0.02 -0.86 0.12 -0.51 -0.81 0.00 0.00 175.30 173.27 2oz8 s LEU 362 N 2.93 3.78 0.68 -0.88 1.43 -1.26 -5.00 118.68 120.36 2oz8 s LEU 362 Ca 0.82 -0.13 -0.15 0.00 -1.03 0.00 0.00 54.13 53.64 2oz8 s LEU 362 Cb -0.46 -2.40 0.01 0.00 0.03 0.00 0.00 46.19 43.37 2oz8 s LEU 362 CO 0.37 0.08 1.14 0.00 0.23 0.00 0.00 176.35 178.17 2oz8 s ALA 363 N -1.71 2.36 0.43 4.21 0.00 -1.26 -4.93 121.76 120.87 2oz8 s ALA 363 Ca 0.31 0.68 0.17 0.00 0.00 0.00 0.00 51.96 53.11 2oz8 s ALA 363 Cb -0.10 -3.37 1.09 0.00 0.00 0.00 0.00 23.12 20.73 2oz8 s ALA 363 CO 0.23 -1.45 1.89 -0.09 0.00 0.00 0.00 175.76 176.34 2oz8 h ARG 364 N -0.01 0.38 0.00 0.00 9.65 -2.03 -1.85 114.38 120.52 2oz8 h ARG 364 Ca -0.47 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.38 2oz8 h ARG 364 Cb 1.26 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.76 2oz8 h ARG 364 CO 0.53 0.25 0.00 -1.13 2.80 0.00 0.00 179.97 182.42 2oz8 n SER 365 N -4.48 0.00 -1.06 -3.80 3.41 -1.26 -3.19 113.62 103.24 2oz8 n SER 365 Ca 0.17 0.07 0.09 0.00 -0.26 0.00 0.00 58.87 58.94 2oz8 n SER 365 Cb 0.62 -0.34 0.25 0.00 -0.26 0.00 0.00 64.21 64.48 2oz8 n SER 365 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2oz8 n GLU 366 N -1.34 2.70 0.07 4.33 1.02 -0.70 -4.54 120.64 122.19 2oz8 n GLU 366 Ca 0.10 -2.37 0.12 0.00 -0.02 0.00 0.00 57.16 54.99 2oz8 n GLU 366 Cb 0.22 -1.45 0.27 0.00 -0.02 0.00 0.00 31.44 30.46 2oz8 n GLU 366 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2oz8 n LEU 367 N 1.21 0.69 0.00 -4.62 4.77 -1.19 -5.00 117.00 112.86 2oz8 n LEU 367 Ca 0.19 0.34 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 2oz8 n LEU 367 Cb 0.54 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 2oz8 n LEU 367 CO 0.13 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.72 2oz8 n GLY 368 N 1.35 0.12 3.76 -0.72 0.00 -1.26 -4.63 105.19 103.80 2oz8 n GLY 368 Ca 0.04 -0.95 -0.39 0.00 0.00 0.00 0.00 46.02 44.73 2oz8 n GLY 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oz8 s ALA 369 N -1.83 3.00 0.16 4.61 0.00 -1.26 -4.64 121.76 121.80 2oz8 s ALA 369 Ca 0.00 1.29 -0.31 0.00 0.00 0.00 0.00 51.96 52.94 2oz8 s ALA 369 Cb 0.00 -3.53 -0.08 0.00 0.00 0.00 0.00 23.12 19.51 2oz8 s ALA 369 CO 0.00 -1.14 1.34 0.00 0.00 0.00 0.00 175.76 175.97 2oz8 s ALA 370 N -1.31 3.55 0.20 0.00 0.00 -1.26 -4.62 121.76 118.31 2oz8 s ALA 370 Ca 0.66 1.11 -0.31 0.00 0.00 0.00 0.00 51.96 53.41 2oz8 s ALA 370 Cb -0.39 -3.51 -0.16 0.00 0.00 0.00 0.00 23.12 19.07 2oz8 s ALA 370 CO 0.48 -0.57 1.02 -2.30 0.00 0.00 0.00 175.76 174.38 2oz8 n PRO 371 N 3.27 0.97 -2.08 0.00 -0.02 -1.26 -4.87 135.00 131.01 2oz8 n PRO 371 Ca 0.09 0.34 -0.40 0.00 -2.02 0.00 0.00 63.50 61.51 2oz8 n PRO 371 Cb 0.43 -1.73 -0.01 0.00 -0.02 0.00 0.00 33.50 32.16 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 -0.77 4.09 -0.62 -0.52 2.02 -1.26 -4.74 118.70 116.89 2oz8 s GLU 372 Ca 0.69 2.16 -0.02 0.00 0.02 0.00 0.00 54.97 57.82 2oz8 s GLU 372 Cb -0.85 -2.84 0.16 0.00 0.10 0.00 0.00 34.13 30.70 2oz8 s GLU 372 CO 0.55 -0.39 0.43 1.21 0.02 0.00 0.00 175.26 177.08 2oz8 s ASN 373 N -0.68 5.12 0.00 -0.19 3.84 -1.26 -4.86 114.94 116.90 2oz8 s ASN 373 Ca 0.54 -2.92 0.05 0.00 0.21 0.00 0.00 52.86 50.74 2oz8 s ASN 373 Cb -0.38 -1.83 0.22 0.00 -0.55 0.00 0.00 41.25 38.71 2oz8 s ASN 373 CO 0.50 -0.34 1.03 -0.81 -2.79 0.00 0.00 177.10 174.68 2oz8 n PRO 374 N 3.38 0.05 0.08 0.43 -0.04 -1.26 -2.31 135.00 135.32 2oz8 n PRO 374 Ca 0.08 0.30 0.12 0.00 -0.04 0.00 0.00 63.50 63.96 2oz8 n PRO 374 Cb 0.37 -1.50 0.25 0.00 -0.04 0.00 0.00 33.50 32.58 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 -1.35 0.28 -4.37 0.54 5.12 -1.26 -4.83 116.66 110.78 2oz8 n ARG 375 Ca 0.02 0.13 -0.24 0.00 -1.93 0.00 0.00 57.85 55.83 2oz8 n ARG 375 Cb 0.04 -1.73 -0.09 0.00 -1.16 0.00 0.00 32.46 29.53 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 -4.32 2.86 0.00 0.55 1.43 -0.98 -4.98 118.68 113.24 2oz8 s LEU 376 Ca 0.08 -0.81 0.00 0.00 -1.03 0.00 0.00 54.13 52.37 2oz8 s LEU 376 Cb 0.13 -1.42 0.00 0.00 0.03 0.00 0.00 46.19 44.93 2oz8 s LEU 376 CO 0.68 0.04 0.36 -2.65 0.23 0.00 0.00 176.35 175.01