#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b3p s LYS 3 N 0.00 4.15 0.00 4.33 2.20 -1.26 -2.08 119.74 127.07 2b3p s LYS 3 Ca 0.00 2.54 0.00 0.00 -0.36 0.00 0.00 55.97 58.15 2b3p s LYS 3 Cb 0.00 -3.47 0.00 0.00 -1.51 0.00 0.00 37.83 32.85 2b3p s LYS 3 CO 0.00 -0.80 0.00 0.41 -0.36 0.00 0.00 175.35 174.60 2b3p n GLY 4 N 4.12 2.70 0.30 5.54 0.00 -1.26 -2.53 105.19 114.06 2b3p n GLY 4 Ca 0.17 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.21 2b3p n GLY 4 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2b3p h GLU 5 N 2.02 0.56 0.00 1.61 4.81 -1.66 -2.20 114.58 119.72 2b3p h GLU 5 Ca 0.00 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.16 2b3p h GLU 5 Cb 0.00 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.27 2b3p h GLU 5 CO 0.00 0.46 -0.01 0.93 -0.73 0.00 0.00 179.01 179.66 2b3p h GLU 6 N 0.57 0.00 0.00 1.92 3.07 -1.90 -0.94 114.58 117.29 2b3p h GLU 6 Ca 0.14 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 2b3p h GLU 6 Cb 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.00 2b3p h GLU 6 CO -0.02 0.01 0.00 -0.07 -1.40 0.00 0.00 179.01 177.53 2b3p h LEU 7 N 0.00 0.00 -2.96 1.33 3.38 -1.79 -3.20 115.31 112.07 2b3p h LEU 7 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2b3p h LEU 7 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2b3p h LEU 7 CO 0.00 0.00 0.00 0.49 0.09 0.00 0.00 178.44 179.02 2b3p n PHE 8 N -2.37 0.86 -1.96 1.13 3.72 -0.36 -5.00 117.46 113.49 2b3p n PHE 8 Ca 0.03 -0.57 -0.40 0.00 -0.05 0.00 0.00 57.45 56.46 2b3p n PHE 8 Cb 0.33 -0.10 -0.00 0.00 -0.94 0.00 0.00 39.48 38.76 2b3p n PHE 8 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2b3p s THR 9 N -1.41 2.40 0.00 4.37 -4.23 -1.21 -4.31 115.64 111.25 2b3p s THR 9 Ca 0.37 0.37 0.00 0.00 -1.18 0.00 0.00 61.69 61.25 2b3p s THR 9 Cb 0.22 -3.22 0.00 0.00 1.34 0.00 0.00 72.50 70.84 2b3p s THR 9 CO 0.21 0.06 0.00 0.61 -0.54 0.00 0.00 174.62 174.96 2b3p n GLY 10 N 0.63 0.22 3.71 3.99 0.00 -1.26 -4.71 105.19 107.77 2b3p n GLY 10 Ca 0.03 -0.90 -0.37 0.00 0.00 0.00 0.00 46.02 44.78 2b3p n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b3p s VAL 11 N 0.00 5.31 -0.13 1.61 1.01 -1.26 -4.38 120.40 122.55 2b3p s VAL 11 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 61.98 62.48 2b3p s VAL 11 Cb 0.00 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 2b3p s VAL 11 CO 0.00 0.36 -0.14 -0.69 0.00 0.00 0.00 175.10 174.63 2b3p s VAL 12 N 0.69 2.92 0.47 2.92 1.01 -0.17 -4.93 120.40 123.30 2b3p s VAL 12 Ca 0.15 -0.71 -0.23 0.00 0.00 0.00 0.00 61.98 61.19 2b3p s VAL 12 Cb -0.13 -2.21 -0.07 0.00 0.00 0.00 0.00 36.38 33.97 2b3p s VAL 12 CO 0.04 0.53 1.24 -2.84 0.00 0.00 0.00 175.10 174.07 2b3p s PRO 13 N 0.36 3.66 -0.02 2.72 0.02 -1.26 -0.54 135.00 139.94 2b3p s PRO 13 Ca -0.12 1.97 0.05 0.00 0.02 0.00 0.00 61.00 62.93 2b3p s PRO 13 Cb -0.16 -2.46 -0.01 0.00 0.02 0.00 0.00 34.50 31.89 2b3p s PRO 13 CO 0.06 -0.69 -0.17 0.42 -0.33 0.00 0.00 177.00 176.29 2b3p s ILE 14 N -1.42 1.37 -0.06 2.83 1.01 0.03 -1.07 121.20 123.90 2b3p s ILE 14 Ca 0.64 -0.73 0.02 0.00 0.00 0.00 0.00 60.65 60.58 2b3p s ILE 14 Cb -0.34 -1.15 0.01 0.00 0.01 0.00 0.00 42.46 40.99 2b3p s ILE 14 CO 0.41 0.39 -0.12 -0.22 0.00 0.00 0.00 174.94 175.41 2b3p s LEU 15 N -0.29 1.66 -0.05 2.97 2.96 -0.58 -1.83 118.68 123.51 2b3p s LEU 15 Ca 0.04 -0.28 0.03 0.00 -0.22 0.00 0.00 54.13 53.70 2b3p s LEU 15 Cb -0.08 -0.78 0.00 0.00 0.50 0.00 0.00 46.19 45.84 2b3p s LEU 15 CO -0.00 0.04 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.24 2b3p s VAL 16 N 0.58 1.21 -0.05 1.68 1.01 0.19 -1.02 120.40 124.00 2b3p s VAL 16 Ca -0.12 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.30 2b3p s VAL 16 Cb -0.15 -1.07 0.02 0.00 0.00 0.00 0.00 36.38 35.19 2b3p s VAL 16 CO 0.03 0.36 -0.03 -1.61 0.00 0.00 0.00 175.10 173.85 2b3p s GLU 17 N 0.34 0.71 -0.03 2.72 2.02 -0.15 -0.00 118.70 124.31 2b3p s GLU 17 Ca -0.09 -0.04 0.03 0.00 0.02 0.00 0.00 54.97 54.89 2b3p s GLU 17 Cb -0.13 -0.82 0.00 0.00 0.10 0.00 0.00 34.13 33.29 2b3p s GLU 17 CO 0.03 -0.13 -0.10 -1.17 0.02 0.00 0.00 175.26 173.91 2b3p s LEU 18 N 1.13 1.77 -0.08 1.80 0.20 0.09 -0.41 118.68 123.18 2b3p s LEU 18 Ca -0.08 -0.20 0.04 0.00 0.69 0.00 0.00 54.13 54.58 2b3p s LEU 18 Cb -0.14 -0.59 -0.01 0.00 -0.43 0.00 0.00 46.19 45.02 2b3p s LEU 18 CO -0.01 0.07 -0.23 -1.81 -0.29 0.00 0.00 176.35 174.08 2b3p s ASP 19 N 0.23 3.23 0.15 3.68 1.01 -0.69 -0.50 116.67 123.77 2b3p s ASP 19 Ca -0.04 -0.50 -0.02 0.00 0.71 0.00 0.00 52.55 52.71 2b3p s ASP 19 Cb -0.09 -1.16 -0.04 0.00 1.01 0.00 0.00 42.92 42.64 2b3p s ASP 19 CO 0.01 0.21 0.09 -0.83 0.21 0.00 0.00 175.17 174.85 2b3p s GLY 20 N 0.08 1.04 -0.23 0.21 0.00 0.47 -1.00 107.32 107.88 2b3p s GLY 20 Ca -0.10 -1.47 -0.03 0.00 0.00 0.00 0.00 44.72 43.11 2b3p s GLY 20 CO 0.06 -1.33 0.36 -0.35 0.00 0.00 0.00 173.10 171.85 2b3p s ASP 21 N -3.07 0.29 -0.22 1.64 -1.08 -0.49 -1.30 116.67 112.43 2b3p s ASP 21 Ca 0.27 0.28 -0.00 0.00 -0.52 0.00 0.00 52.55 52.58 2b3p s ASP 21 Cb 0.07 1.07 0.03 0.00 -1.46 0.00 0.00 42.92 42.62 2b3p s ASP 21 CO 0.04 -0.29 -0.12 -0.69 0.52 0.00 0.00 175.17 174.63 2b3p s VAL 22 N 2.53 2.50 -1.40 1.11 1.01 -0.40 0.42 120.40 126.17 2b3p s VAL 22 Ca 0.10 -1.05 -0.11 0.00 0.00 0.00 0.00 61.98 60.92 2b3p s VAL 22 Cb -0.15 -2.22 0.08 0.00 0.00 0.00 0.00 36.38 34.10 2b3p s VAL 22 CO -0.15 0.31 0.62 0.59 0.00 0.00 0.00 175.10 176.47 2b3p n ASN 23 N 4.62 -4.02 0.00 3.32 4.13 -0.03 -0.53 115.26 122.76 2b3p n ASN 23 Ca -0.18 -0.53 0.00 0.00 1.68 0.00 0.00 54.58 55.55 2b3p n ASN 23 Cb 0.48 -3.29 0.00 0.00 -1.54 0.00 0.00 39.78 35.43 2b3p n ASN 23 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2b3p n GLY 24 N -1.31 1.13 3.54 7.41 0.00 -1.26 -5.02 105.19 109.67 2b3p n GLY 24 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2b3p n GLY 24 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2b3p s HIS 25 N -2.47 2.97 0.15 1.61 3.76 0.32 -5.03 115.29 116.60 2b3p s HIS 25 Ca 0.00 0.13 -0.24 0.00 -0.15 0.00 0.00 55.06 54.80 2b3p s HIS 25 Cb 0.00 -3.71 -0.08 0.00 1.11 0.00 0.00 32.58 29.91 2b3p s HIS 25 CO 0.00 -1.03 0.73 0.15 -0.85 0.00 0.00 174.74 173.75 2b3p s LYS 26 N 3.34 4.47 0.20 1.40 1.02 -1.26 -1.27 119.74 127.63 2b3p s LYS 26 Ca 0.30 1.05 -0.22 0.00 0.02 0.00 0.00 55.97 57.12 2b3p s LYS 26 Cb -0.12 -3.22 0.05 0.00 -0.52 0.00 0.00 37.83 34.01 2b3p s LYS 26 CO 0.22 0.57 0.62 -0.59 -0.92 0.00 0.00 175.35 175.25 2b3p s PHE 27 N -1.17 -0.38 0.02 3.18 -0.12 -0.42 -4.98 117.98 114.11 2b3p s PHE 27 Ca 0.35 0.09 0.01 0.00 -0.05 0.00 0.00 56.93 57.33 2b3p s PHE 27 Cb -0.22 0.57 -0.02 0.00 -0.63 0.00 0.00 43.02 42.72 2b3p s PHE 27 CO 0.24 -0.96 -0.05 -1.12 -0.05 0.00 0.00 175.22 173.29 2b3p s SER 28 N -2.81 0.50 -0.02 1.98 0.01 -1.26 -0.40 113.70 111.71 2b3p s SER 28 Ca 0.05 -0.41 0.03 0.00 1.31 0.00 0.00 55.95 56.93 2b3p s SER 28 Cb -0.02 0.04 -0.00 0.00 0.21 0.00 0.00 66.02 66.25 2b3p s SER 28 CO -0.06 -0.18 -0.10 -0.69 0.41 0.00 0.00 173.24 172.62 2b3p s VAL 29 N -1.08 0.83 -0.05 3.43 1.01 0.34 -1.47 120.40 123.40 2b3p s VAL 29 Ca -0.09 -0.42 0.03 0.00 0.00 0.00 0.00 61.98 61.50 2b3p s VAL 29 Cb -0.08 -0.72 0.00 0.00 0.00 0.00 0.00 36.38 35.59 2b3p s VAL 29 CO -0.00 0.25 -0.15 -0.60 0.00 0.00 0.00 175.10 174.59 2b3p s ARG 30 N -0.03 1.77 0.07 2.72 3.52 -0.55 -0.73 118.95 125.72 2b3p s ARG 30 Ca 0.00 -0.53 0.04 0.00 -0.13 0.00 0.00 55.73 55.12 2b3p s ARG 30 Cb -0.06 -1.49 -0.03 0.00 -1.56 0.00 0.00 34.95 31.81 2b3p s ARG 30 CO 0.00 0.15 -0.13 0.20 -0.81 0.00 0.00 175.30 174.72 2b3p s GLY 31 N 0.29 0.80 0.00 8.12 0.00 1.00 -1.12 107.32 116.41 2b3p s GLY 31 Ca -0.09 -0.97 -0.04 0.00 0.00 0.00 0.00 44.72 43.62 2b3p s GLY 31 CO 0.03 -1.00 0.08 -0.54 0.00 0.00 0.00 173.10 171.67 2b3p s GLU 32 N -1.77 0.37 0.00 2.90 2.02 -0.72 -0.64 118.70 120.86 2b3p s GLU 32 Ca -0.03 -0.37 0.00 0.00 0.02 0.00 0.00 54.97 54.59 2b3p s GLU 32 Cb -0.10 0.15 0.00 0.00 0.10 0.00 0.00 34.13 34.28 2b3p s GLU 32 CO 0.02 -0.08 0.00 0.41 0.02 0.00 0.00 175.26 175.63 2b3p n GLY 33 N 1.77 -0.73 3.30 -1.39 0.00 -0.76 -1.36 105.19 106.03 2b3p n GLY 33 Ca -0.21 -0.40 -0.11 0.00 0.00 0.00 0.00 46.02 45.30 2b3p n GLY 33 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2b3p s GLU 34 N -0.46 0.96 0.03 1.61 -1.05 -0.39 -0.79 118.70 118.61 2b3p s GLU 34 Ca 0.00 -0.57 0.05 0.00 -0.15 0.00 0.00 54.97 54.30 2b3p s GLU 34 Cb 0.00 0.42 -0.02 0.00 -0.44 0.00 0.00 34.13 34.09 2b3p s GLU 34 CO 0.00 -0.34 -0.14 0.20 0.95 0.00 0.00 175.26 175.93 2b3p s GLY 35 N -2.40 0.77 -0.57 -3.83 0.00 0.30 -1.78 107.32 99.80 2b3p s GLY 35 Ca -0.01 -0.79 0.04 0.00 0.00 0.00 0.00 44.72 43.96 2b3p s GLY 35 CO -0.07 -0.75 0.36 -0.35 0.00 0.00 0.00 173.10 172.29 2b3p s ASP 36 N -1.01 4.15 0.39 1.64 -1.08 0.58 -1.00 116.67 120.34 2b3p s ASP 36 Ca 0.02 -3.31 0.08 0.00 -0.52 0.00 0.00 52.55 48.82 2b3p s ASP 36 Cb -0.07 -1.42 0.83 0.00 -1.46 0.00 0.00 42.92 40.80 2b3p s ASP 36 CO 0.01 -0.17 2.00 0.00 0.52 0.00 0.00 175.17 177.53 2b3p h ALA 37 N 5.99 1.76 -0.56 3.66 0.00 -1.75 0.30 119.26 128.66 2b3p h ALA 37 Ca 0.06 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.00 2b3p h ALA 37 Cb 0.84 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 2b3p h ALA 37 CO 0.64 0.16 0.37 1.15 0.00 0.00 0.00 179.25 181.56 2b3p h THR 38 N 0.63 1.01 -0.16 0.00 2.02 -1.86 -1.51 112.91 113.03 2b3p h THR 38 Ca 0.25 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 67.24 2b3p h THR 38 Cb 0.19 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 2b3p h THR 38 CO -0.07 0.10 0.00 0.59 0.37 0.00 0.00 175.52 176.51 2b3p n ASN 39 N -4.47 2.77 -2.73 4.18 3.02 -0.63 -4.90 115.26 112.49 2b3p n ASN 39 Ca 0.07 -1.82 -0.22 0.00 -0.03 0.00 0.00 54.58 52.59 2b3p n ASN 39 Cb 0.21 -0.10 0.01 0.00 -0.61 0.00 0.00 39.78 39.30 2b3p n ASN 39 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b3p n GLY 40 N 1.06 -0.51 3.49 7.41 0.00 0.00 -4.83 105.19 111.80 2b3p n GLY 40 Ca 0.13 0.07 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 2b3p n GLY 40 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2b3p s LYS 41 N -5.40 2.74 -0.00 1.61 2.20 -0.73 -0.79 119.74 119.36 2b3p s LYS 41 Ca 0.16 -0.65 0.03 0.00 -0.36 0.00 0.00 55.97 55.16 2b3p s LYS 41 Cb -0.07 -2.49 -0.01 0.00 -1.51 0.00 0.00 37.83 33.75 2b3p s LYS 41 CO 0.20 0.56 -0.11 -0.51 -0.36 0.00 0.00 175.35 175.14 2b3p s LEU 42 N -0.56 2.04 -0.06 5.43 1.43 0.24 -0.31 118.68 126.89 2b3p s LEU 42 Ca 0.08 -0.22 -0.01 0.00 -1.03 0.00 0.00 54.13 52.95 2b3p s LEU 42 Cb -0.12 -0.54 0.03 0.00 0.03 0.00 0.00 46.19 45.59 2b3p s LEU 42 CO 0.02 0.11 -0.01 0.42 0.23 0.00 0.00 176.35 177.12 2b3p s THR 43 N -0.32 0.39 0.03 5.49 -4.23 -0.74 -0.92 115.64 115.34 2b3p s THR 43 Ca 0.04 0.08 -0.08 0.00 -1.18 0.00 0.00 61.69 60.55 2b3p s THR 43 Cb -0.04 -0.52 -0.00 0.00 1.34 0.00 0.00 72.50 73.28 2b3p s THR 43 CO -0.00 0.24 0.15 -0.76 -0.54 0.00 0.00 174.62 173.71 2b3p s LEU 44 N 1.71 1.56 -0.09 4.79 1.43 -0.30 -1.26 118.68 126.51 2b3p s LEU 44 Ca 0.01 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.72 2b3p s LEU 44 Cb -0.13 0.79 0.01 0.00 0.03 0.00 0.00 46.19 46.89 2b3p s LEU 44 CO -0.04 -0.52 -0.15 -0.75 0.23 0.00 0.00 176.35 175.12 2b3p s LYS 45 N -2.44 2.14 0.03 1.70 2.20 -0.46 -0.28 119.74 122.62 2b3p s LYS 45 Ca -0.06 -0.55 0.06 0.00 -0.36 0.00 0.00 55.97 55.06 2b3p s LYS 45 Cb -0.02 -1.78 -0.03 0.00 -1.51 0.00 0.00 37.83 34.49 2b3p s LYS 45 CO -0.03 -0.01 -0.16 -0.06 -0.36 0.00 0.00 175.35 174.73 2b3p s PHE 46 N 0.81 2.62 0.02 4.03 0.08 0.56 -1.75 117.98 124.35 2b3p s PHE 46 Ca -0.11 -0.22 0.02 0.00 0.12 0.00 0.00 56.93 56.75 2b3p s PHE 46 Cb -0.16 -1.50 -0.01 0.00 -0.57 0.00 0.00 43.02 40.78 2b3p s PHE 46 CO 0.01 0.26 -0.08 0.96 -0.10 0.00 0.00 175.22 176.28 2b3p s ILE 47 N -0.92 0.59 -0.35 0.64 -4.36 -0.27 -0.87 121.20 115.66 2b3p s ILE 47 Ca 0.15 -0.66 -0.23 0.00 -0.26 0.00 0.00 60.65 59.64 2b3p s ILE 47 Cb -0.11 -0.57 0.01 0.00 1.25 0.00 0.00 42.46 43.05 2b3p s ILE 47 CO 0.05 -0.07 0.77 0.00 0.24 0.00 0.00 174.94 175.93 2b3p n THR 49 N 5.72 0.01 -0.11 0.00 -2.24 -0.54 -3.61 114.28 113.50 2b3p n THR 49 Ca 0.03 -0.10 0.04 0.00 -2.27 0.00 0.00 64.05 61.74 2b3p n THR 49 Cb 0.48 -0.09 0.10 0.00 -2.10 0.00 0.00 70.33 68.72 2b3p n THR 49 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2b3p n THR 50 N -0.52 1.00 0.00 4.28 -2.24 -1.25 -4.95 114.28 110.60 2b3p n THR 50 Ca 0.22 -1.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.00 2b3p n THR 50 Cb 0.21 0.50 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 2b3p n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b3p n GLY 51 N 0.16 0.31 3.74 3.38 0.00 -1.24 -4.99 105.19 106.55 2b3p n GLY 51 Ca 0.07 -1.43 -0.40 0.00 0.00 0.00 0.00 46.02 44.27 2b3p n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b3p s LYS 52 N 0.00 4.47 0.00 1.61 0.00 -1.26 -4.44 119.74 120.13 2b3p s LYS 52 Ca 0.00 1.02 -0.30 0.00 0.00 0.00 0.00 55.97 56.68 2b3p s LYS 52 Cb 0.00 -3.38 -0.05 0.00 0.00 0.00 0.00 37.83 34.40 2b3p s LYS 52 CO 0.00 0.25 1.34 -1.17 0.00 0.00 0.00 175.35 175.77 2b3p s LEU 53 N 0.08 4.32 0.00 2.77 2.96 -1.26 -4.90 118.68 122.65 2b3p s LEU 53 Ca 0.38 2.06 0.19 0.00 -0.22 0.00 0.00 54.13 56.55 2b3p s LEU 53 Cb -0.20 -3.56 0.92 0.00 0.50 0.00 0.00 46.19 43.85 2b3p s LEU 53 CO 0.22 -0.66 1.62 -0.81 -1.32 0.00 0.00 176.35 175.39 2b3p n PRO 54 N 5.08 0.16 -4.25 0.98 -0.04 -1.26 -4.78 135.00 130.89 2b3p n PRO 54 Ca 0.12 0.13 -0.14 0.00 -0.04 0.00 0.00 63.50 63.57 2b3p n PRO 54 Cb 0.44 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.30 2b3p n PRO 54 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2b3p s VAL 55 N -2.75 0.95 0.31 0.52 -7.23 -1.26 -4.76 120.40 106.18 2b3p s VAL 55 Ca 0.15 -2.02 -0.29 0.00 -1.81 0.00 0.00 61.98 58.01 2b3p s VAL 55 Cb 0.13 -2.00 -0.10 0.00 0.56 0.00 0.00 36.38 34.97 2b3p s VAL 55 CO 0.32 -0.60 1.31 -2.84 -0.31 0.00 0.00 175.10 172.98 2b3p s PRO 56 N -3.83 4.36 0.27 4.82 0.02 -1.26 -4.92 135.00 134.46 2b3p s PRO 56 Ca 0.20 2.19 -0.00 0.00 0.02 0.00 0.00 61.00 63.41 2b3p s PRO 56 Cb 0.04 -3.09 0.56 0.00 0.02 0.00 0.00 34.50 32.03 2b3p s PRO 56 CO 0.02 -0.19 1.75 -1.49 -0.33 0.00 0.00 177.00 176.77 2b3p h TRP 57 N 3.66 0.75 -0.49 6.54 4.06 -1.96 -1.72 115.95 126.79 2b3p h TRP 57 Ca -0.48 0.03 0.13 0.00 2.06 0.00 0.00 58.89 60.63 2b3p h TRP 57 Cb 1.22 -0.20 -0.02 0.00 -1.00 0.00 0.00 29.16 29.16 2b3p h TRP 57 CO 0.57 0.15 0.35 -1.35 -3.56 0.00 0.00 178.44 174.60 2b3p h PRO 58 N 0.60 0.06 0.00 0.49 0.11 -1.89 -0.85 132.00 130.52 2b3p h PRO 58 Ca 0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.58 2b3p h PRO 58 Cb 0.70 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.80 2b3p h PRO 58 CO -0.38 0.04 0.00 0.25 -0.21 0.00 0.00 178.00 177.70 2b3p n THR 59 N -4.41 0.92 0.78 -1.15 -2.24 -0.65 -2.72 114.28 104.80 2b3p n THR 59 Ca 0.09 0.27 0.09 0.00 -2.27 0.00 0.00 64.05 62.22 2b3p n THR 59 Cb 0.52 -1.16 -0.01 0.00 -2.10 0.00 0.00 70.33 67.58 2b3p n THR 59 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2b3p n LEU 60 N -2.02 1.64 -0.13 3.22 4.77 -0.33 -4.65 117.00 119.50 2b3p n LEU 60 Ca 0.02 -0.74 -0.04 0.00 -0.03 0.00 0.00 56.01 55.22 2b3p n LEU 60 Cb 0.20 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.32 2b3p n LEU 60 CO 0.17 0.32 0.86 0.58 -1.33 0.00 0.00 177.39 177.99 2b3p h VAL 61 N 1.78 0.71 0.00 4.08 2.07 -1.51 -1.14 116.25 122.25 2b3p h VAL 61 Ca 0.00 -0.05 -0.06 0.00 0.82 0.00 0.00 66.70 67.42 2b3p h VAL 61 Cb 0.58 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 2b3p h VAL 61 CO 0.00 0.02 -0.27 0.71 0.02 0.00 0.00 177.57 178.05 2b3p h THR 62 N 0.13 0.65 0.08 2.57 1.35 -1.82 -2.96 112.91 112.92 2b3p h THR 62 Ca 0.21 -1.26 -0.23 0.00 -0.55 0.00 0.00 66.41 64.57 2b3p h THR 62 Cb 0.29 1.83 0.02 0.00 -1.73 0.00 0.00 68.15 68.55 2b3p h THR 62 CO -0.32 0.27 -0.96 0.74 -0.25 0.00 0.00 175.52 174.99 2b3p h THR 63 N 0.00 1.37 0.00 6.82 2.02 -1.72 -3.47 112.91 117.93 2b3p h THR 63 Ca -0.00 -2.35 -0.03 0.00 0.77 0.00 0.00 66.41 64.80 2b3p h THR 63 Cb 0.80 2.75 -0.01 0.00 -1.74 0.00 0.00 68.15 69.95 2b3p h THR 63 CO 0.04 0.70 0.05 0.18 0.37 0.00 0.00 175.52 176.85 2b3p n LEU 64 N -3.99 2.17 0.00 2.58 4.77 -0.48 -5.02 117.00 117.04 2b3p n LEU 64 Ca -0.13 -1.19 0.00 0.00 -0.03 0.00 0.00 56.01 54.66 2b3p n LEU 64 Cb 0.86 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 2b3p n LEU 64 CO 0.53 0.41 0.00 1.33 -1.33 0.00 0.00 177.39 178.33 2b3p n VAL 68 N 2.13 0.00 0.09 4.08 0.24 -1.26 -5.00 118.33 118.61 2b3p n VAL 68 Ca 0.06 0.00 0.01 0.00 -2.04 0.00 0.00 64.34 62.37 2b3p n VAL 68 Cb 0.26 0.00 0.05 0.00 -1.47 0.00 0.00 33.84 32.68 2b3p n VAL 68 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2b3p n GLN 69 N 0.00 0.02 0.00 7.34 6.02 -1.26 -1.50 117.38 128.00 2b3p n GLN 69 Ca 0.00 0.30 0.08 0.00 -0.01 0.00 0.00 57.00 57.37 2b3p n GLN 69 Cb 0.00 -1.50 0.40 0.00 1.02 0.00 0.00 30.24 30.16 2b3p n GLN 69 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b3p n PHE 71 N -1.36 0.80 -2.23 0.00 3.72 -0.56 -4.71 117.46 113.12 2b3p n PHE 71 Ca 0.07 -0.39 -0.37 0.00 -0.05 0.00 0.00 57.45 56.71 2b3p n PHE 71 Cb 0.15 -0.01 -0.00 0.00 -0.94 0.00 0.00 39.48 38.68 2b3p n PHE 71 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2b3p s SER 72 N -0.99 6.01 -0.51 4.37 0.01 -0.93 -4.12 113.70 117.53 2b3p s SER 72 Ca 0.39 2.30 -0.20 0.00 1.31 0.00 0.00 55.95 59.75 2b3p s SER 72 Cb 0.20 -2.60 0.06 0.00 0.21 0.00 0.00 66.02 63.89 2b3p s SER 72 CO 0.26 -1.03 0.66 -0.60 0.41 0.00 0.00 173.24 172.94 2b3p s ARG 73 N -2.85 3.14 -0.01 12.44 3.52 -0.35 -4.79 118.95 130.06 2b3p s ARG 73 Ca 0.66 -0.85 -0.18 0.00 -0.13 0.00 0.00 55.73 55.23 2b3p s ARG 73 Cb -0.28 -4.10 -0.06 0.00 -1.56 0.00 0.00 34.95 28.95 2b3p s ARG 73 CO 0.33 -1.26 0.51 0.71 -0.81 0.00 0.00 175.30 174.79 2b3p s TYR 74 N 2.75 3.69 0.78 5.12 1.51 -1.26 -1.42 117.35 128.52 2b3p s TYR 74 Ca 0.16 1.10 -0.13 0.00 -1.01 0.00 0.00 57.07 57.19 2b3p s TYR 74 Cb -0.19 -2.48 0.07 0.00 -0.11 0.00 0.00 41.96 39.24 2b3p s TYR 74 CO 0.12 0.45 1.17 -2.14 -1.11 0.00 0.00 175.55 174.05 2b3p s PRO 75 N -0.49 1.91 0.34 -1.71 0.02 -1.26 -4.75 135.00 129.06 2b3p s PRO 75 Ca 0.27 1.62 0.11 0.00 0.02 0.00 0.00 61.00 63.02 2b3p s PRO 75 Cb -0.17 -1.82 0.88 0.00 0.02 0.00 0.00 34.50 33.40 2b3p s PRO 75 CO 0.15 -1.98 1.79 0.38 -0.33 0.00 0.00 177.00 177.01 2b3p h ASP 76 N -0.77 0.65 -0.08 2.53 -0.00 -1.99 -0.21 116.42 116.55 2b3p h ASP 76 Ca -0.46 0.08 0.00 0.00 -0.00 0.00 0.00 57.03 56.66 2b3p h ASP 76 Cb 1.28 -0.03 0.00 0.00 -0.00 0.00 0.00 39.33 40.58 2b3p h ASP 76 CO 0.48 0.21 0.00 0.00 -0.00 0.00 0.00 179.24 179.94 2b3p n HIS 77 N -4.69 0.10 -0.27 4.15 1.44 -1.26 -3.62 115.22 111.07 2b3p n HIS 77 Ca 0.23 -0.05 0.00 0.00 -2.01 0.00 0.00 57.72 55.89 2b3p n HIS 77 Cb 0.66 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.77 2b3p n HIS 77 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 2b3p n MET 78 N -0.29 0.11 -0.27 -1.40 2.81 -0.12 -4.87 117.12 113.09 2b3p n MET 78 Ca 0.13 -0.61 0.05 0.00 -1.81 0.00 0.00 57.70 55.46 2b3p n MET 78 Cb 0.17 -0.86 0.15 0.00 -0.71 0.00 0.00 33.22 31.97 2b3p n MET 78 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 2b3p h LYS 79 N 0.00 0.07 0.00 0.03 1.79 -1.54 -0.17 116.57 116.74 2b3p h LYS 79 Ca 0.00 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2b3p h LYS 79 Cb 0.28 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 2b3p h LYS 79 CO 0.00 0.05 0.00 0.07 -1.08 0.00 0.00 179.45 178.49 2b3p h ARG 80 N 0.07 0.00 -0.09 3.15 0.11 -1.89 -1.74 114.38 113.99 2b3p h ARG 80 Ca 0.42 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.50 2b3p h ARG 80 Cb 0.73 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.81 2b3p h ARG 80 CO -0.71 0.00 0.00 0.72 0.10 0.00 0.00 179.97 180.08 2b3p n HIS 81 N -2.53 0.11 -2.77 4.08 8.25 -0.08 -4.66 115.22 117.63 2b3p n HIS 81 Ca -0.00 -0.06 -0.43 0.00 -0.26 0.00 0.00 57.72 56.97 2b3p n HIS 81 Cb 0.13 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.23 2b3p n HIS 81 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2b3p s ASP 82 N -1.58 6.69 0.21 0.41 -1.08 -0.65 -4.65 116.67 116.01 2b3p s ASP 82 Ca 0.30 -2.07 -0.08 0.00 -0.52 0.00 0.00 52.55 50.18 2b3p s ASP 82 Cb 0.15 -2.48 0.14 0.00 -1.46 0.00 0.00 42.92 39.28 2b3p s ASP 82 CO 0.24 -1.16 1.76 0.15 0.52 0.00 0.00 175.17 176.68 2b3p h PHE 83 N 8.69 1.19 -0.27 -5.34 3.57 -1.88 -2.72 116.94 120.18 2b3p h PHE 83 Ca 0.23 -0.10 0.06 0.00 3.53 0.00 0.00 57.97 61.69 2b3p h PHE 83 Cb 0.97 -0.35 -0.06 0.00 2.79 0.00 0.00 35.95 39.30 2b3p h PHE 83 CO 1.22 0.92 -0.12 0.74 -2.23 0.00 0.00 178.31 178.84 2b3p h PHE 84 N 1.12 -0.30 -0.00 0.41 0.04 -1.91 -1.80 116.94 114.50 2b3p h PHE 84 Ca 0.25 0.03 -0.18 0.00 2.80 0.00 0.00 57.97 60.87 2b3p h PHE 84 Cb 0.26 0.17 -0.02 0.00 2.20 0.00 0.00 35.95 38.56 2b3p h PHE 84 CO 0.02 -0.19 -0.81 0.87 -0.60 0.00 0.00 178.31 177.61 2b3p h LYS 85 N -0.08 0.09 0.00 1.51 1.57 -1.84 -3.16 116.57 114.66 2b3p h LYS 85 Ca 0.14 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 2b3p h LYS 85 Cb 0.30 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 2b3p h LYS 85 CO -0.33 0.85 -0.03 0.77 -0.57 0.00 0.00 179.45 180.14 2b3p h SER 86 N 0.05 0.00 0.16 0.86 0.02 -1.05 -1.52 113.55 112.07 2b3p h SER 86 Ca -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2b3p h SER 86 Cb 1.41 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.95 2b3p h SER 86 CO 0.11 0.03 -0.13 0.00 -1.14 0.00 0.00 176.83 175.70 2b3p n ALA 87 N -2.20 2.83 -2.24 3.77 0.00 -0.74 -4.32 120.51 117.60 2b3p n ALA 87 Ca -0.02 -0.39 -0.29 0.00 0.00 0.00 0.00 53.44 52.74 2b3p n ALA 87 Cb 0.13 -1.20 -0.02 0.00 0.00 0.00 0.00 19.45 18.36 2b3p n ALA 87 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2b3p s MET 88 N -2.29 3.69 0.24 0.00 1.00 -0.57 -0.26 119.30 121.10 2b3p s MET 88 Ca 0.31 0.34 0.25 0.00 0.00 0.00 0.00 55.69 56.59 2b3p s MET 88 Cb 0.20 -2.41 0.69 0.00 0.00 0.00 0.00 34.83 33.31 2b3p s MET 88 CO 0.44 -0.06 1.70 -1.00 0.00 0.00 0.00 175.02 176.10 2b3p h PRO 89 N 0.98 0.00 -0.87 2.03 0.13 -1.91 -3.44 132.00 128.93 2b3p h PRO 89 Ca -0.47 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 64.81 2b3p h PRO 89 Cb 1.19 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.26 2b3p h PRO 89 CO 0.63 0.00 0.56 0.93 -0.23 0.00 0.00 178.00 179.90 2b3p h GLU 90 N 0.00 0.61 0.00 0.86 5.08 -1.92 -2.80 114.58 116.41 2b3p h GLU 90 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2b3p h GLU 90 Cb 0.78 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.89 2b3p h GLU 90 CO 0.00 0.40 0.00 0.41 -1.00 0.00 0.00 179.01 178.82 2b3p n GLY 91 N -1.45 -1.90 3.19 -3.84 0.00 0.64 -4.72 105.19 97.12 2b3p n GLY 91 Ca 0.17 -1.92 -0.08 0.00 0.00 0.00 0.00 46.02 44.18 2b3p n GLY 91 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2b3p s TYR 92 N -0.06 0.24 -0.16 1.61 -0.85 -0.28 -1.17 117.35 116.67 2b3p s TYR 92 Ca 0.00 -0.69 -0.11 0.00 -0.52 0.00 0.00 57.07 55.75 2b3p s TYR 92 Cb 0.00 -0.13 -0.05 0.00 0.38 0.00 0.00 41.96 42.17 2b3p s TYR 92 CO 0.00 -0.52 0.20 0.08 -1.52 0.00 0.00 175.55 173.79 2b3p s VAL 93 N -3.88 5.38 -0.18 -3.49 1.01 0.49 -1.34 120.40 118.38 2b3p s VAL 93 Ca 0.06 0.34 0.01 0.00 0.00 0.00 0.00 61.98 62.39 2b3p s VAL 93 Cb 0.05 -3.52 0.03 0.00 0.00 0.00 0.00 36.38 32.94 2b3p s VAL 93 CO -0.10 0.47 -0.16 -1.58 0.00 0.00 0.00 175.10 173.72 2b3p s GLN 94 N 0.06 2.57 0.01 2.72 0.74 0.24 -1.37 119.66 124.63 2b3p s GLN 94 Ca 0.13 -0.82 0.08 0.00 0.05 0.00 0.00 55.36 54.80 2b3p s GLN 94 Cb -0.12 -2.46 -0.03 0.00 1.10 0.00 0.00 33.01 31.50 2b3p s GLN 94 CO 0.02 -0.29 -0.24 -1.21 -0.55 0.00 0.00 175.29 173.02 2b3p s GLU 95 N 1.34 2.02 0.05 1.67 2.02 0.00 -0.64 118.70 125.16 2b3p s GLU 95 Ca 0.02 -0.99 -0.06 0.00 0.02 0.00 0.00 54.97 53.96 2b3p s GLU 95 Cb -0.14 -2.08 -0.01 0.00 0.10 0.00 0.00 34.13 32.00 2b3p s GLU 95 CO -0.11 0.54 0.12 1.03 0.02 0.00 0.00 175.26 176.87 2b3p s ARG 96 N -1.02 0.65 -0.13 1.61 0.52 -0.43 -0.87 118.95 119.27 2b3p s ARG 96 Ca 0.12 -0.79 0.00 0.00 -0.52 0.00 0.00 55.73 54.54 2b3p s ARG 96 Cb -0.10 0.26 0.02 0.00 0.52 0.00 0.00 34.95 35.65 2b3p s ARG 96 CO 0.01 -0.17 -0.12 0.99 0.02 0.00 0.00 175.30 176.03 2b3p s THR 97 N -2.86 1.39 -0.25 0.02 2.01 -0.66 -0.92 115.64 114.38 2b3p s THR 97 Ca -0.03 -0.52 -0.03 0.00 0.31 0.00 0.00 61.69 61.42 2b3p s THR 97 Cb 0.00 -1.33 0.02 0.00 0.01 0.00 0.00 72.50 71.20 2b3p s THR 97 CO -0.06 0.43 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.63 2b3p s ILE 98 N 1.53 3.08 -0.36 1.82 1.01 0.40 -1.55 121.20 127.13 2b3p s ILE 98 Ca 0.04 -0.90 -0.11 0.00 0.00 0.00 0.00 60.65 59.68 2b3p s ILE 98 Cb -0.13 -2.54 0.02 0.00 0.01 0.00 0.00 42.46 39.82 2b3p s ILE 98 CO -0.09 0.22 0.20 -0.44 0.00 0.00 0.00 174.94 174.83 2b3p s SER 99 N 1.37 5.71 -0.21 3.58 0.01 0.37 -0.67 113.70 123.86 2b3p s SER 99 Ca 0.01 -0.89 -0.27 0.00 1.31 0.00 0.00 55.95 56.11 2b3p s SER 99 Cb -0.16 -2.03 0.00 0.00 0.21 0.00 0.00 66.02 64.04 2b3p s SER 99 CO -0.03 -0.35 0.95 -0.36 0.41 0.00 0.00 173.24 173.86 2b3p s PHE 100 N 1.57 3.36 0.05 2.43 0.40 -0.42 -0.66 117.98 124.70 2b3p s PHE 100 Ca 0.03 1.36 -0.35 0.00 -0.60 0.00 0.00 56.93 57.36 2b3p s PHE 100 Cb -0.19 -3.17 -0.14 0.00 0.51 0.00 0.00 43.02 40.03 2b3p s PHE 100 CO 0.07 -0.40 1.59 1.17 0.70 0.00 0.00 175.22 178.34 2b3p n LYS 101 N 5.97 1.77 -2.16 0.44 4.81 -0.25 -0.78 118.16 127.97 2b3p n LYS 101 Ca 0.09 0.64 -0.20 0.00 -0.87 0.00 0.00 58.31 57.97 2b3p n LYS 101 Cb 0.47 -2.38 -0.03 0.00 0.02 0.00 0.00 35.03 33.11 2b3p n LYS 101 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2b3p n ASP 102 N 3.97 -5.53 0.00 3.14 4.64 -1.26 -4.82 116.55 116.69 2b3p n ASP 102 Ca 0.19 0.15 0.00 0.00 -1.38 0.00 0.00 54.79 53.76 2b3p n ASP 102 Cb 0.25 -4.70 0.00 0.00 -1.04 0.00 0.00 41.12 35.63 2b3p n ASP 102 CO 0.00 0.00 0.00 -0.67 -0.82 0.00 0.00 177.20 175.71 2b3p n ASP 103 N -1.77 0.00 -2.91 1.67 -0.08 0.04 -4.93 116.55 108.58 2b3p n ASP 103 Ca -0.22 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 52.93 2b3p n ASP 103 Cb 0.67 0.00 0.10 0.00 2.34 0.00 0.00 41.12 44.23 2b3p n ASP 103 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2b3p n GLY 104 N 0.00 -2.05 3.06 0.27 0.00 -1.22 -4.58 105.19 100.67 2b3p n GLY 104 Ca 0.00 -1.56 -0.17 0.00 0.00 0.00 0.00 46.02 44.29 2b3p n GLY 104 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b3p s THR 105 N -2.04 0.73 -0.10 2.61 2.01 -0.57 -1.31 115.64 116.97 2b3p s THR 105 Ca 0.32 -0.75 -0.01 0.00 0.31 0.00 0.00 61.69 61.56 2b3p s THR 105 Cb -0.02 -0.68 -0.03 0.00 0.01 0.00 0.00 72.50 71.78 2b3p s THR 105 CO 0.24 -0.05 -0.05 -0.31 -0.69 0.00 0.00 174.62 173.76 2b3p s TYR 106 N -0.73 3.00 -0.13 4.92 4.12 0.16 -1.20 117.35 127.48 2b3p s TYR 106 Ca -0.01 -0.06 0.02 0.00 0.02 0.00 0.00 57.07 57.04 2b3p s TYR 106 Cb -0.06 -1.80 0.00 0.00 -1.52 0.00 0.00 41.96 38.58 2b3p s TYR 106 CO 0.00 0.23 -0.21 0.21 0.02 0.00 0.00 175.55 175.81 2b3p s LYS 107 N -0.44 3.07 0.05 -0.62 2.20 0.00 -0.46 119.74 123.55 2b3p s LYS 107 Ca 0.07 -0.84 0.05 0.00 -0.36 0.00 0.00 55.97 54.89 2b3p s LYS 107 Cb -0.12 -2.45 -0.02 0.00 -1.51 0.00 0.00 37.83 33.73 2b3p s LYS 107 CO 0.02 0.04 -0.13 0.95 -0.36 0.00 0.00 175.35 175.87 2b3p s THR 108 N 0.70 1.01 -0.03 3.43 -4.23 -0.10 -1.12 115.64 115.30 2b3p s THR 108 Ca -0.09 -1.13 -0.00 0.00 -1.18 0.00 0.00 61.69 59.29 2b3p s THR 108 Cb -0.16 -0.96 0.03 0.00 1.34 0.00 0.00 72.50 72.75 2b3p s THR 108 CO 0.01 -0.15 0.02 -0.60 -0.54 0.00 0.00 174.62 173.35 2b3p s ARG 109 N -1.45 0.16 0.05 3.99 3.52 -0.79 -1.31 118.95 123.10 2b3p s ARG 109 Ca -0.02 0.14 -0.00 0.00 -0.13 0.00 0.00 55.73 55.72 2b3p s ARG 109 Cb -0.09 -0.42 -0.03 0.00 -1.56 0.00 0.00 34.95 32.84 2b3p s ARG 109 CO 0.02 -0.17 -0.03 0.00 -0.81 0.00 0.00 175.30 174.30 2b3p s ALA 110 N 1.18 0.46 -0.11 6.12 0.00 0.19 -1.22 121.76 128.38 2b3p s ALA 110 Ca -0.08 -1.06 0.02 0.00 0.00 0.00 0.00 51.96 50.85 2b3p s ALA 110 Cb -0.13 0.22 0.01 0.00 0.00 0.00 0.00 23.12 23.23 2b3p s ALA 110 CO -0.02 -0.30 -0.17 -1.21 0.00 0.00 0.00 175.76 174.06 2b3p s GLU 111 N -3.24 2.37 -0.20 0.00 2.02 -0.18 -0.59 118.70 118.87 2b3p s GLU 111 Ca 0.01 -0.62 -0.01 0.00 0.02 0.00 0.00 54.97 54.37 2b3p s GLU 111 Cb 0.03 -1.98 0.01 0.00 0.10 0.00 0.00 34.13 32.28 2b3p s GLU 111 CO -0.07 -0.05 -0.12 0.08 0.02 0.00 0.00 175.26 175.13 2b3p s VAL 112 N 0.94 2.74 0.23 2.63 1.01 -0.45 -1.80 120.40 125.70 2b3p s VAL 112 Ca -0.07 -0.73 -0.23 0.00 0.00 0.00 0.00 61.98 60.96 2b3p s VAL 112 Cb -0.15 -2.22 0.04 0.00 0.00 0.00 0.00 36.38 34.05 2b3p s VAL 112 CO -0.01 0.46 0.82 -1.59 0.00 0.00 0.00 175.10 174.78 2b3p s LYS 113 N 1.38 1.55 0.09 2.72 -2.85 -0.63 -1.13 119.74 120.88 2b3p s LYS 113 Ca 0.05 -0.86 -0.21 0.00 -1.00 0.00 0.00 55.97 53.95 2b3p s LYS 113 Cb -0.14 0.53 -0.07 0.00 -2.06 0.00 0.00 37.83 36.09 2b3p s LYS 113 CO -0.08 -0.71 0.63 -0.06 0.10 0.00 0.00 175.35 175.23 2b3p s PHE 114 N -3.63 3.83 -0.41 1.78 0.40 -1.06 -0.51 117.98 118.37 2b3p s PHE 114 Ca 0.12 1.37 0.02 0.00 -0.60 0.00 0.00 56.93 57.84 2b3p s PHE 114 Cb -0.04 -2.58 0.12 0.00 0.51 0.00 0.00 43.02 41.04 2b3p s PHE 114 CO 0.05 0.56 0.19 -1.21 0.70 0.00 0.00 175.22 175.51 2b3p s GLU 115 N -1.08 1.33 6.05 0.44 2.02 0.10 -4.94 118.70 122.63 2b3p s GLU 115 Ca 0.31 -1.92 0.00 0.00 0.02 0.00 0.00 54.97 53.38 2b3p s GLU 115 Cb -0.20 -2.59 0.00 0.00 0.10 0.00 0.00 34.13 31.44 2b3p s GLU 115 CO 0.21 -1.08 0.00 0.41 0.02 0.00 0.00 175.26 174.82 2b3p n GLY 116 N 3.82 0.95 0.84 -1.39 0.00 -1.26 -2.55 105.19 105.61 2b3p n GLY 116 Ca 0.05 -0.62 0.11 0.00 0.00 0.00 0.00 46.02 45.56 2b3p n GLY 116 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2b3p n ASP 117 N 6.00 2.54 -4.72 1.61 8.00 -1.26 -4.90 116.55 123.82 2b3p n ASP 117 Ca 0.00 -1.85 -0.35 0.00 0.71 0.00 0.00 54.79 53.30 2b3p n ASP 117 Cb 0.00 -0.15 -0.08 0.00 -0.02 0.00 0.00 41.12 40.86 2b3p n ASP 117 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2b3p s THR 118 N -1.69 5.09 -0.20 -3.53 2.01 -1.06 -4.24 115.64 112.01 2b3p s THR 118 Ca 0.35 0.07 -0.23 0.00 0.31 0.00 0.00 61.69 62.19 2b3p s THR 118 Cb 0.20 -3.27 -0.02 0.00 0.01 0.00 0.00 72.50 69.42 2b3p s THR 118 CO 0.29 0.50 0.73 -0.22 -0.69 0.00 0.00 174.62 175.23 2b3p s LEU 119 N -0.07 4.13 0.03 4.42 1.98 -0.23 -0.72 118.68 128.22 2b3p s LEU 119 Ca 0.08 0.96 0.09 0.00 -2.89 0.00 0.00 54.13 52.37 2b3p s LEU 119 Cb -0.12 -3.05 -0.03 0.00 0.66 0.00 0.00 46.19 43.66 2b3p s LEU 119 CO 0.01 -0.36 -0.26 -0.69 -1.89 0.00 0.00 176.35 173.15 2b3p s VAL 120 N 2.21 2.06 -0.27 1.68 1.01 0.34 -1.53 120.40 125.90 2b3p s VAL 120 Ca 0.33 -1.29 0.01 0.00 0.00 0.00 0.00 61.98 61.02 2b3p s VAL 120 Cb -0.16 -1.75 0.07 0.00 0.00 0.00 0.00 36.38 34.54 2b3p s VAL 120 CO 0.10 0.41 -0.02 0.21 0.00 0.00 0.00 175.10 175.80 2b3p s ASN 121 N -1.06 4.09 -0.23 3.32 2.47 -0.19 -1.61 114.94 121.72 2b3p s ASN 121 Ca 0.11 -1.44 -0.06 0.00 0.42 0.00 0.00 52.86 51.89 2b3p s ASN 121 Cb -0.10 -1.24 -0.02 0.00 -1.45 0.00 0.00 41.25 38.44 2b3p s ASN 121 CO 0.01 -0.28 0.02 -0.13 -3.72 0.00 0.00 177.10 173.00 2b3p s ARG 122 N 1.31 3.54 0.10 0.43 0.52 -0.74 -0.98 118.95 123.13 2b3p s ARG 122 Ca -0.01 -0.54 0.07 0.00 -0.52 0.00 0.00 55.73 54.73 2b3p s ARG 122 Cb -0.19 -3.18 -0.03 0.00 0.52 0.00 0.00 34.95 32.07 2b3p s ARG 122 CO -0.09 -0.17 -0.17 0.42 0.02 0.00 0.00 175.30 175.31 2b3p s ILE 123 N 1.49 1.41 -0.12 1.52 1.01 0.45 -1.01 121.20 125.96 2b3p s ILE 123 Ca 0.06 -1.52 0.02 0.00 0.00 0.00 0.00 60.65 59.21 2b3p s ILE 123 Cb -0.15 -1.39 0.01 0.00 0.01 0.00 0.00 42.46 40.95 2b3p s ILE 123 CO 0.01 -0.22 -0.18 -1.61 0.00 0.00 0.00 174.94 172.94 2b3p s GLU 124 N -2.07 2.52 -0.06 2.79 8.01 -0.35 -1.71 118.70 127.83 2b3p s GLU 124 Ca 0.04 -0.67 0.02 0.00 0.01 0.00 0.00 54.97 54.37 2b3p s GLU 124 Cb -0.09 -2.07 0.02 0.00 -4.31 0.00 0.00 34.13 27.68 2b3p s GLU 124 CO 0.03 -0.02 -0.09 -1.17 0.01 0.00 0.00 175.26 174.02 2b3p s LEU 125 N 0.86 1.52 -0.14 1.80 0.20 -0.17 -1.89 118.68 120.86 2b3p s LEU 125 Ca -0.08 -0.24 0.01 0.00 0.69 0.00 0.00 54.13 54.52 2b3p s LEU 125 Cb -0.15 -0.69 0.02 0.00 -0.43 0.00 0.00 46.19 44.94 2b3p s LEU 125 CO -0.00 -0.00 -0.17 -0.75 -0.29 0.00 0.00 176.35 175.13 2b3p s LYS 126 N 0.78 2.52 -0.13 1.98 2.20 -0.28 -1.40 119.74 125.42 2b3p s LYS 126 Ca -0.13 -0.66 -0.02 0.00 -0.36 0.00 0.00 55.97 54.80 2b3p s LYS 126 Cb -0.15 -2.17 -0.03 0.00 -1.51 0.00 0.00 37.83 33.97 2b3p s LYS 126 CO 0.02 -0.13 -0.04 0.20 -0.36 0.00 0.00 175.35 175.05 2b3p s GLY 127 N 1.15 1.74 0.07 5.54 0.00 0.17 -0.82 107.32 115.17 2b3p s GLY 127 Ca -0.01 -0.83 0.01 0.00 0.00 0.00 0.00 44.72 43.89 2b3p s GLY 127 CO -0.06 -0.28 -0.06 -0.26 0.00 0.00 0.00 173.10 172.44 2b3p s ILE 128 N -0.09 0.57 -1.71 0.90 -4.36 -0.34 -0.85 121.20 115.32 2b3p s ILE 128 Ca 0.02 -1.63 0.00 0.00 -0.26 0.00 0.00 60.65 58.78 2b3p s ILE 128 Cb -0.13 -1.30 0.00 0.00 1.25 0.00 0.00 42.46 42.28 2b3p s ILE 128 CO 0.03 -0.73 0.00 0.47 0.24 0.00 0.00 174.94 174.94 2b3p n ASP 129 N 0.47 -5.34 -4.75 4.36 10.43 -1.26 -1.52 116.55 118.95 2b3p n ASP 129 Ca -0.16 0.13 -0.40 0.00 2.57 0.00 0.00 54.79 56.93 2b3p n ASP 129 Cb 0.59 -4.42 -0.05 0.00 1.84 0.00 0.00 41.12 39.07 2b3p n ASP 129 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 2b3p s PHE 130 N -2.85 3.79 0.25 1.24 0.08 -1.26 -3.38 117.98 115.84 2b3p s PHE 130 Ca 0.00 1.80 -0.16 0.00 0.12 0.00 0.00 56.93 58.69 2b3p s PHE 130 Cb 0.00 -3.12 -0.08 0.00 -0.57 0.00 0.00 43.02 39.25 2b3p s PHE 130 CO 0.00 -0.02 0.68 -1.59 -0.10 0.00 0.00 175.22 174.18 2b3p s LYS 131 N -1.05 4.06 0.26 0.44 -2.85 -1.26 -4.89 119.74 114.44 2b3p s LYS 131 Ca 0.44 0.66 -0.30 0.00 -1.00 0.00 0.00 55.97 55.77 2b3p s LYS 131 Cb -0.28 -2.70 -0.09 0.00 -2.06 0.00 0.00 37.83 32.70 2b3p s LYS 131 CO 0.35 0.31 1.28 -2.00 0.10 0.00 0.00 175.35 175.39 2b3p s GLU 132 N -2.44 4.41 -1.00 1.78 2.12 -1.26 -2.28 118.70 120.03 2b3p s GLU 132 Ca 0.47 2.08 0.00 0.00 0.36 0.00 0.00 54.97 57.88 2b3p s GLU 132 Cb -0.13 -3.15 0.00 0.00 0.26 0.00 0.00 34.13 31.11 2b3p s GLU 132 CO 0.19 -0.16 0.00 -3.47 -0.54 0.00 0.00 175.26 171.28 2b3p n ASP 133 N 1.75 -4.26 -4.32 -1.70 2.03 -1.26 -5.01 116.55 103.78 2b3p n ASP 133 Ca 0.03 0.23 -0.27 0.00 0.52 0.00 0.00 54.79 55.31 2b3p n ASP 133 Cb 0.43 -2.59 0.16 0.00 -0.72 0.00 0.00 41.12 38.40 2b3p n ASP 133 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2b3p s GLY 134 N -2.82 1.78 0.42 0.27 0.00 -0.96 -4.79 107.32 101.22 2b3p s GLY 134 Ca 0.00 -1.62 0.16 0.00 0.00 0.00 0.00 44.72 43.25 2b3p s GLY 134 CO 0.00 -0.90 1.92 3.43 0.00 0.00 0.00 173.10 177.55 2b3p h ASN 135 N -1.14 0.00 0.00 1.64 -0.26 -1.93 -0.76 115.58 113.13 2b3p h ASN 135 Ca -0.39 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.35 2b3p h ASN 135 Cb 1.24 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.50 2b3p h ASN 135 CO 0.35 0.26 -0.09 0.40 -1.06 0.00 0.00 177.43 177.29 2b3p h ILE 136 N 0.00 0.00 0.00 2.81 5.03 -1.93 -1.50 117.51 121.91 2b3p h ILE 136 Ca -0.00 -0.46 -0.00 0.00 -0.12 0.00 0.00 64.86 64.27 2b3p h ILE 136 Cb 0.49 0.00 -0.00 0.00 -3.03 0.00 0.00 36.82 34.28 2b3p h ILE 136 CO 0.03 0.00 -0.01 -0.07 -0.68 0.00 0.00 178.15 177.43 2b3p h LEU 137 N -0.46 0.00 -1.02 1.44 3.38 -1.80 -1.99 115.31 114.86 2b3p h LEU 137 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2b3p h LEU 137 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2b3p h LEU 137 CO 0.00 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.15 2b3p n GLY 138 N -0.23 0.10 3.73 0.83 0.00 -0.29 -4.83 105.19 104.50 2b3p n GLY 138 Ca -0.00 -0.44 -0.33 0.00 0.00 0.00 0.00 46.02 45.25 2b3p n GLY 138 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2b3p n HIS 139 N 0.24 -1.85 -0.07 1.61 8.25 -0.75 -4.91 115.22 117.74 2b3p n HIS 139 Ca 0.18 0.42 0.06 0.00 -0.26 0.00 0.00 57.72 58.13 2b3p n HIS 139 Cb 0.35 -3.39 0.15 0.00 1.12 0.00 0.00 29.99 28.22 2b3p n HIS 139 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2b3p n LYS 140 N -4.27 2.49 -3.31 -0.41 5.02 -0.57 -4.98 118.16 112.13 2b3p n LYS 140 Ca -0.10 -1.96 -0.38 0.00 -2.02 0.00 0.00 58.31 53.84 2b3p n LYS 140 Cb 0.59 -1.29 -0.06 0.00 -0.02 0.00 0.00 35.03 34.25 2b3p n LYS 140 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2b3p s LEU 141 N -1.01 4.41 0.63 -0.35 1.43 -1.24 -0.35 118.68 122.21 2b3p s LEU 141 Ca 0.24 1.04 -0.16 0.00 -1.03 0.00 0.00 54.13 54.22 2b3p s LEU 141 Cb 0.13 -2.78 -0.02 0.00 0.03 0.00 0.00 46.19 43.55 2b3p s LEU 141 CO 0.17 0.16 1.11 -1.61 0.23 0.00 0.00 176.35 176.41 2b3p s GLU 142 N -0.34 2.97 -1.32 1.70 2.02 -0.19 -4.84 118.70 118.70 2b3p s GLU 142 Ca 0.28 1.42 -0.12 0.00 0.02 0.00 0.00 54.97 56.56 2b3p s GLU 142 Cb -0.17 -1.97 0.13 0.00 0.10 0.00 0.00 34.13 32.21 2b3p s GLU 142 CO 0.15 -1.12 1.89 0.98 0.02 0.00 0.00 175.26 177.18 2b3p n TYR 143 N -2.13 3.58 -3.86 1.61 9.36 -1.26 -4.83 117.16 119.63 2b3p n TYR 143 Ca 0.10 -2.93 -0.11 0.00 3.32 0.00 0.00 57.90 58.29 2b3p n TYR 143 Cb 0.52 -2.21 0.01 0.00 -0.63 0.00 0.00 39.34 37.02 2b3p n TYR 143 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 2b3p n ASN 144 N 5.15 -1.88 -3.69 2.98 0.23 -1.26 -4.87 115.26 111.92 2b3p n ASN 144 Ca 0.43 -2.63 -0.12 0.00 -0.53 0.00 0.00 54.58 51.73 2b3p n ASN 144 Cb 0.39 3.22 -0.09 0.00 -2.08 0.00 0.00 39.78 41.22 2b3p n ASN 144 CO 0.00 0.00 0.00 0.12 -0.93 0.00 0.00 177.26 176.45 2b3p s PHE 145 N -2.68 -0.62 0.66 -2.53 5.36 -1.26 -4.87 117.98 112.03 2b3p s PHE 145 Ca 0.20 1.42 -0.03 0.00 -0.96 0.00 0.00 56.93 57.56 2b3p s PHE 145 Cb -0.03 0.26 0.06 0.00 -0.34 0.00 0.00 43.02 42.97 2b3p s PHE 145 CO 0.15 -0.32 0.93 -0.80 -1.46 0.00 0.00 175.22 173.72 2b3p s ASN 146 N 0.71 4.90 0.02 6.13 0.01 -1.26 -4.65 114.94 120.79 2b3p s ASN 146 Ca -0.04 0.20 -0.15 0.00 -0.71 0.00 0.00 52.86 52.16 2b3p s ASN 146 Cb -0.05 -0.90 -0.06 0.00 0.41 0.00 0.00 41.25 40.65 2b3p s ASN 146 CO -0.05 -1.48 0.44 -0.44 -1.51 0.00 0.00 177.10 174.06 2b3p s SER 147 N -4.51 6.85 0.31 -1.22 0.01 -1.26 -4.48 113.70 109.39 2b3p s SER 147 Ca 0.60 1.02 0.03 0.00 1.31 0.00 0.00 55.95 58.91 2b3p s SER 147 Cb -0.10 -2.27 -0.04 0.00 0.21 0.00 0.00 66.02 63.82 2b3p s SER 147 CO 0.42 0.31 0.16 -1.00 0.41 0.00 0.00 173.24 173.54 2b3p s HIS 148 N -1.10 1.61 -0.08 2.43 3.76 -0.79 -4.98 115.29 116.14 2b3p s HIS 148 Ca 0.25 -1.37 0.03 0.00 -0.15 0.00 0.00 55.06 53.82 2b3p s HIS 148 Cb -0.17 -0.86 0.01 0.00 1.11 0.00 0.00 32.58 32.66 2b3p s HIS 148 CO 0.15 -0.52 -0.18 -0.80 -0.85 0.00 0.00 174.74 172.54 2b3p s ASN 149 N -3.38 2.36 -0.35 1.40 -0.87 -1.26 -0.74 114.94 112.11 2b3p s ASN 149 Ca 0.35 -0.41 -0.11 0.00 -1.57 0.00 0.00 52.86 51.12 2b3p s ASN 149 Cb 0.05 -1.06 0.01 0.00 -0.02 0.00 0.00 41.25 40.23 2b3p s ASN 149 CO 0.18 0.10 0.20 -0.69 -2.57 0.00 0.00 177.10 174.31 2b3p s VAL 150 N 0.48 4.71 -0.33 1.60 1.01 0.44 -4.66 120.40 123.65 2b3p s VAL 150 Ca -0.16 -0.61 -0.23 0.00 0.00 0.00 0.00 61.98 60.98 2b3p s VAL 150 Cb -0.16 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2b3p s VAL 150 CO 0.06 -0.10 0.79 -0.31 0.00 0.00 0.00 175.10 175.53 2b3p s TYR 151 N 1.60 3.16 -0.08 5.22 2.02 -0.87 -0.80 117.35 127.60 2b3p s TYR 151 Ca 0.04 0.70 -0.02 0.00 -0.37 0.00 0.00 57.07 57.41 2b3p s TYR 151 Cb -0.18 -3.30 -0.03 0.00 -0.40 0.00 0.00 41.96 38.05 2b3p s TYR 151 CO 0.07 -0.64 0.03 0.42 -1.57 0.00 0.00 175.55 173.86 2b3p s ILE 152 N 3.02 4.51 0.03 2.71 1.01 0.35 -1.46 121.20 131.37 2b3p s ILE 152 Ca 0.32 -0.20 -0.06 0.00 0.00 0.00 0.00 60.65 60.71 2b3p s ILE 152 Cb -0.14 -2.92 -0.01 0.00 0.01 0.00 0.00 42.46 39.40 2b3p s ILE 152 CO 0.14 0.59 0.10 0.28 0.00 0.00 0.00 174.94 176.05 2b3p s THR 153 N -0.93 0.13 0.52 2.92 -1.32 -0.45 -2.39 115.64 114.12 2b3p s THR 153 Ca 0.14 -1.05 -0.20 0.00 -1.21 0.00 0.00 61.69 59.37 2b3p s THR 153 Cb -0.11 -0.85 -0.07 0.00 -1.51 0.00 0.00 72.50 69.96 2b3p s THR 153 CO 0.03 -0.58 1.09 0.00 -2.21 0.00 0.00 174.62 172.95 2b3p s ALA 154 N -2.49 2.77 -0.57 11.08 0.00 -1.26 -0.78 121.76 130.52 2b3p s ALA 154 Ca -0.06 0.71 0.04 0.00 0.00 0.00 0.00 51.96 52.65 2b3p s ALA 154 Cb -0.02 -3.31 0.16 0.00 0.00 0.00 0.00 23.12 19.96 2b3p s ALA 154 CO -0.04 -0.57 0.40 0.34 0.00 0.00 0.00 175.76 175.89 2b3p s ASP 155 N -1.90 3.63 0.23 0.00 3.68 0.35 -4.67 116.67 117.98 2b3p s ASP 155 Ca 0.70 -3.38 -0.09 0.00 2.13 0.00 0.00 52.55 51.91 2b3p s ASP 155 Cb -0.20 -1.19 0.36 0.00 -1.45 0.00 0.00 42.92 40.44 2b3p s ASP 155 CO 0.24 -0.15 1.67 0.07 0.13 0.00 0.00 175.17 177.13 2b3p h LYS 156 N 5.75 0.15 -0.65 4.34 5.09 -1.96 -0.93 116.57 128.37 2b3p h LYS 156 Ca 0.14 -0.01 0.11 0.00 0.09 0.00 0.00 60.65 60.98 2b3p h LYS 156 Cb 0.83 -0.03 -0.08 0.00 0.10 0.00 0.00 32.23 33.05 2b3p h LYS 156 CO 0.58 0.10 0.24 -0.56 -2.09 0.00 0.00 179.45 177.72 2b3p h GLN 157 N 0.16 0.40 -0.44 0.07 3.07 -1.95 -1.43 115.11 114.99 2b3p h GLN 157 Ca 0.36 -0.02 0.00 0.00 0.09 0.00 0.00 58.65 59.07 2b3p h GLN 157 Cb 0.60 -0.09 0.00 0.00 0.08 0.00 0.00 27.48 28.07 2b3p h GLN 157 CO -0.54 0.27 0.00 0.36 0.09 0.00 0.00 178.83 179.00 2b3p n LYS 158 N -5.00 2.24 -4.00 0.06 2.85 -0.92 -4.93 118.16 108.46 2b3p n LYS 158 Ca 0.10 -1.91 -0.31 0.00 -1.05 0.00 0.00 58.31 55.15 2b3p n LYS 158 Cb 0.31 -1.45 0.00 0.00 -0.65 0.00 0.00 35.03 33.25 2b3p n LYS 158 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 2b3p n ASN 159 N 1.07 -3.36 0.00 -5.58 5.15 -0.43 -4.65 115.26 107.47 2b3p n ASN 159 Ca 0.18 -0.89 0.00 0.00 -0.60 0.00 0.00 54.58 53.27 2b3p n ASN 159 Cb 0.48 -3.42 0.00 0.00 -0.53 0.00 0.00 39.78 36.31 2b3p n ASN 159 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2b3p n GLY 160 N -1.63 4.95 3.15 8.20 0.00 -0.73 -4.45 105.19 114.68 2b3p n GLY 160 Ca -0.03 -0.67 -0.10 0.00 0.00 0.00 0.00 46.02 45.22 2b3p n GLY 160 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2b3p s ILE 161 N 1.10 0.11 0.11 -0.61 -4.36 -0.79 -0.50 121.20 116.27 2b3p s ILE 161 Ca 0.00 -1.92 0.05 0.00 -0.26 0.00 0.00 60.65 58.53 2b3p s ILE 161 Cb 0.00 -2.06 -0.04 0.00 1.25 0.00 0.00 42.46 41.61 2b3p s ILE 161 CO 0.00 -0.45 -0.13 -0.54 0.24 0.00 0.00 174.94 174.06 2b3p s LYS 162 N -4.05 0.97 0.01 0.37 1.02 0.04 -0.99 119.74 117.11 2b3p s LYS 162 Ca 0.25 -1.21 -0.05 0.00 0.02 0.00 0.00 55.97 54.98 2b3p s LYS 162 Cb 0.07 -0.80 -0.01 0.00 -0.52 0.00 0.00 37.83 36.58 2b3p s LYS 162 CO 0.02 0.15 0.08 0.00 -0.92 0.00 0.00 175.35 174.68 2b3p s ALA 163 N -2.21 -0.17 -0.01 5.17 0.00 -0.15 -1.34 121.76 123.04 2b3p s ALA 163 Ca 0.08 -0.27 -0.01 0.00 0.00 0.00 0.00 51.96 51.76 2b3p s ALA 163 Cb -0.04 0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.20 2b3p s ALA 163 CO 0.02 -0.19 0.03 -0.80 0.00 0.00 0.00 175.76 174.82 2b3p s ASN 164 N -1.36 -0.02 0.02 0.00 -0.87 -0.53 -0.55 114.94 111.63 2b3p s ASN 164 Ca -0.15 0.06 -0.28 0.00 -1.57 0.00 0.00 52.86 50.91 2b3p s ASN 164 Cb -0.08 0.04 0.10 0.00 -0.02 0.00 0.00 41.25 41.29 2b3p s ASN 164 CO 0.01 -0.02 0.97 0.72 -2.57 0.00 0.00 177.10 176.21 2b3p s PHE 165 N 0.12 -0.24 -0.18 2.20 -0.12 -1.04 -2.06 117.98 116.67 2b3p s PHE 165 Ca -0.01 0.07 0.01 0.00 -0.05 0.00 0.00 56.93 56.95 2b3p s PHE 165 Cb -0.01 0.57 0.03 0.00 -0.63 0.00 0.00 43.02 42.97 2b3p s PHE 165 CO -0.00 -0.57 -0.15 0.15 -0.05 0.00 0.00 175.22 174.60 2b3p s LYS 166 N -3.04 2.45 0.08 1.99 1.02 -1.26 -0.30 119.74 120.67 2b3p s LYS 166 Ca 0.08 -0.75 -0.22 0.00 0.02 0.00 0.00 55.97 55.10 2b3p s LYS 166 Cb -0.01 -2.36 -0.07 0.00 -0.52 0.00 0.00 37.83 34.88 2b3p s LYS 166 CO -0.05 -0.29 0.67 0.42 -0.92 0.00 0.00 175.35 175.18 2b3p s ILE 167 N 1.38 4.67 -0.33 2.17 -1.09 -0.19 -4.90 121.20 122.92 2b3p s ILE 167 Ca 0.03 1.43 -0.05 0.00 -2.23 0.00 0.00 60.65 59.83 2b3p s ILE 167 Cb -0.14 -4.01 0.05 0.00 -1.58 0.00 0.00 42.46 36.77 2b3p s ILE 167 CO -0.11 0.48 0.09 -0.13 -1.23 0.00 0.00 174.94 174.05 2b3p s ARG 168 N -0.73 2.55 -0.28 2.79 0.52 -1.26 -0.77 118.95 121.78 2b3p s ARG 168 Ca 0.33 -1.23 -0.12 0.00 -0.52 0.00 0.00 55.73 54.19 2b3p s ARG 168 Cb -0.20 -3.41 -0.05 0.00 0.52 0.00 0.00 34.95 31.81 2b3p s ARG 168 CO 0.21 -0.68 0.24 -1.01 0.02 0.00 0.00 175.30 174.09 2b3p s HIS 169 N 1.36 3.23 0.18 -0.53 3.76 0.22 -4.43 115.29 119.08 2b3p s HIS 169 Ca -0.02 0.19 -0.31 0.00 -0.15 0.00 0.00 55.06 54.77 2b3p s HIS 169 Cb -0.20 -2.44 -0.09 0.00 1.11 0.00 0.00 32.58 30.96 2b3p s HIS 169 CO 0.02 -0.19 1.44 -0.80 -0.85 0.00 0.00 174.74 174.36 2b3p s ASN 170 N 1.73 6.72 0.07 1.40 -0.87 -1.26 -0.22 114.94 122.50 2b3p s ASN 170 Ca 0.09 2.52 0.01 0.00 -1.57 0.00 0.00 52.86 53.91 2b3p s ASN 170 Cb -0.16 -2.60 -0.04 0.00 -0.02 0.00 0.00 41.25 38.43 2b3p s ASN 170 CO 0.11 -0.69 0.19 -0.69 -2.57 0.00 0.00 177.10 173.44 2b3p s VAL 171 N 0.59 5.24 0.57 1.60 1.01 -0.10 -1.03 120.40 128.28 2b3p s VAL 171 Ca 0.63 -0.46 0.27 0.00 0.00 0.00 0.00 61.98 62.42 2b3p s VAL 171 Cb -0.40 -3.55 0.38 0.00 0.00 0.00 0.00 36.38 32.81 2b3p s VAL 171 CO 0.36 0.13 2.00 1.05 0.00 0.00 0.00 175.10 178.64 2b3p h GLU 172 N 3.10 0.00 -0.32 2.72 4.11 -0.99 -0.98 114.58 122.21 2b3p h GLU 172 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 2b3p h GLU 172 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2b3p h GLU 172 CO 0.74 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.42 2b3p n ASP 173 N -4.00 1.87 0.00 3.06 3.85 -1.26 -4.89 116.55 115.18 2b3p n ASP 173 Ca 0.07 -1.94 0.00 0.00 -0.71 0.00 0.00 54.79 52.20 2b3p n ASP 173 Cb 0.54 -0.21 0.00 0.00 -1.35 0.00 0.00 41.12 40.10 2b3p n ASP 173 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2b3p n GLY 174 N 1.08 0.85 3.95 6.12 0.00 -0.37 -5.06 105.19 111.76 2b3p n GLY 174 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2b3p n GLY 174 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b3p s SER 175 N -2.57 3.04 -0.05 1.61 1.04 -1.25 -4.81 113.70 110.69 2b3p s SER 175 Ca 0.00 0.02 0.03 0.00 0.48 0.00 0.00 55.95 56.48 2b3p s SER 175 Cb 0.00 -0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.11 2b3p s SER 175 CO 0.00 -2.76 -0.14 -0.69 0.98 0.00 0.00 173.24 170.63 2b3p s VAL 176 N -3.82 1.24 -0.34 5.02 1.01 -1.26 -0.92 120.40 121.32 2b3p s VAL 176 Ca 0.75 -0.58 -0.12 0.00 0.00 0.00 0.00 61.98 62.04 2b3p s VAL 176 Cb -0.02 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.25 2b3p s VAL 176 CO 0.52 0.37 0.21 -1.58 0.00 0.00 0.00 175.10 174.62 2b3p s GLN 177 N 0.35 3.33 0.20 2.72 2.00 0.69 -4.92 119.66 124.03 2b3p s GLN 177 Ca -0.09 -0.74 -0.18 0.00 -2.00 0.00 0.00 55.36 52.34 2b3p s GLN 177 Cb -0.13 -3.73 -0.08 0.00 0.80 0.00 0.00 33.01 29.87 2b3p s GLN 177 CO 0.03 -0.48 0.68 -0.51 -0.50 0.00 0.00 175.29 174.51 2b3p s LEU 178 N 1.66 4.34 -0.26 3.68 1.43 -1.26 -0.61 118.68 127.66 2b3p s LEU 178 Ca 0.05 1.33 -0.02 0.00 -1.03 0.00 0.00 54.13 54.46 2b3p s LEU 178 Cb -0.18 -3.51 0.08 0.00 0.03 0.00 0.00 46.19 42.62 2b3p s LEU 178 CO 0.09 0.05 0.07 0.00 0.23 0.00 0.00 176.35 176.79 2b3p s ALA 179 N -1.51 1.25 -0.06 4.21 0.00 0.05 -1.08 121.76 124.62 2b3p s ALA 179 Ca 0.42 -1.23 -0.30 0.00 0.00 0.00 0.00 51.96 50.85 2b3p s ALA 179 Cb -0.16 -1.43 -0.03 0.00 0.00 0.00 0.00 23.12 21.51 2b3p s ALA 179 CO 0.20 -1.47 1.13 -0.51 0.00 0.00 0.00 175.76 175.12 2b3p s ASP 180 N 1.76 7.13 -0.18 0.00 1.01 0.16 -1.02 116.67 125.54 2b3p s ASP 180 Ca 0.05 1.74 -0.05 0.00 0.71 0.00 0.00 52.55 55.00 2b3p s ASP 180 Cb -0.17 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.17 2b3p s ASP 180 CO -0.20 -0.51 -0.01 -1.00 0.21 0.00 0.00 175.17 173.66 2b3p s HIS 181 N 1.99 3.07 -0.17 4.23 3.76 0.59 -0.48 115.29 128.28 2b3p s HIS 181 Ca 0.54 -0.28 0.01 0.00 -0.15 0.00 0.00 55.06 55.17 2b3p s HIS 181 Cb -0.23 -2.02 0.01 0.00 1.11 0.00 0.00 32.58 31.45 2b3p s HIS 181 CO 0.22 -0.07 -0.19 -0.47 -0.85 0.00 0.00 174.74 173.37 2b3p s TYR 182 N 0.59 2.76 0.04 1.40 5.04 -0.60 -2.49 117.35 124.09 2b3p s TYR 182 Ca -0.01 -1.45 0.06 0.00 -2.44 0.00 0.00 57.07 53.23 2b3p s TYR 182 Cb -0.14 -1.90 -0.02 0.00 0.35 0.00 0.00 41.96 40.25 2b3p s TYR 182 CO 0.02 -0.70 -0.18 -1.14 -1.34 0.00 0.00 175.55 172.22 2b3p s GLN 183 N 1.11 1.19 -0.03 4.97 0.74 0.29 -1.65 119.66 126.29 2b3p s GLN 183 Ca 0.00 -0.85 0.01 0.00 0.05 0.00 0.00 55.36 54.57 2b3p s GLN 183 Cb -0.14 -1.25 0.02 0.00 1.10 0.00 0.00 33.01 32.74 2b3p s GLN 183 CO -0.08 0.32 -0.01 -0.65 -0.55 0.00 0.00 175.29 174.32 2b3p s GLN 184 N -1.13 0.36 -0.06 1.67 -0.21 -0.05 -0.98 119.66 119.27 2b3p s GLN 184 Ca 0.05 0.02 0.04 0.00 0.02 0.00 0.00 55.36 55.48 2b3p s GLN 184 Cb -0.08 -0.48 0.00 0.00 1.00 0.00 0.00 33.01 33.45 2b3p s GLN 184 CO 0.01 -0.09 -0.17 -0.80 -2.12 0.00 0.00 175.29 172.12 2b3p s ASN 185 N 0.79 2.25 -0.03 5.90 -0.87 -0.16 -0.82 114.94 122.00 2b3p s ASN 185 Ca -0.08 -0.38 0.03 0.00 -1.57 0.00 0.00 52.86 50.86 2b3p s ASN 185 Cb -0.12 -0.84 0.00 0.00 -0.02 0.00 0.00 41.25 40.27 2b3p s ASN 185 CO -0.01 0.12 -0.12 -0.89 -2.57 0.00 0.00 177.10 173.62 2b3p s THR 186 N 0.29 1.06 0.35 1.60 2.01 -0.47 -1.88 115.64 118.60 2b3p s THR 186 Ca -0.10 -0.51 -0.27 0.00 0.31 0.00 0.00 61.69 61.11 2b3p s THR 186 Cb -0.14 -0.93 -0.09 0.00 0.01 0.00 0.00 72.50 71.35 2b3p s THR 186 CO 0.04 0.32 1.18 -2.16 -0.69 0.00 0.00 174.62 173.31 2b3p s PRO 187 N 0.14 4.31 0.08 4.92 0.04 -1.26 -0.38 135.00 142.85 2b3p s PRO 187 Ca -0.04 1.92 -0.07 0.00 0.04 0.00 0.00 61.00 62.85 2b3p s PRO 187 Cb -0.10 -2.93 -0.25 0.00 0.04 0.00 0.00 34.50 31.27 2b3p s PRO 187 CO 0.01 -0.12 1.16 0.82 0.04 0.00 0.00 177.00 178.91 2b3p h ILE 188 N 2.74 1.42 0.00 0.56 2.04 -1.45 -3.46 117.51 119.36 2b3p h ILE 188 Ca -0.48 -2.78 0.00 0.00 1.00 0.00 0.00 64.86 62.60 2b3p h ILE 188 Cb 1.22 2.80 0.00 0.00 -0.74 0.00 0.00 36.82 40.10 2b3p h ILE 188 CO 0.65 0.82 0.00 0.61 0.00 0.00 0.00 178.15 180.23 2b3p n GLY 189 N 1.39 2.60 3.74 5.37 0.00 -1.26 -5.04 105.19 112.00 2b3p n GLY 189 Ca -0.10 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.36 2b3p n GLY 189 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2b3p s ASP 190 N 1.00 7.36 0.00 1.61 -0.00 -1.26 -5.05 116.67 120.33 2b3p s ASP 190 Ca 0.00 2.08 0.00 0.00 -0.00 0.00 0.00 52.55 54.63 2b3p s ASP 190 Cb 0.00 -2.61 0.00 0.00 -0.00 0.00 0.00 42.92 40.31 2b3p s ASP 190 CO 0.00 -0.12 0.00 0.61 -0.00 0.00 0.00 175.17 175.66 2b3p n GLY 191 N 1.74 4.83 3.81 0.21 0.00 -1.26 -4.37 105.19 110.15 2b3p n GLY 191 Ca 0.01 -2.05 -0.31 0.00 0.00 0.00 0.00 46.02 43.67 2b3p n GLY 191 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2b3p s PRO 192 N 1.62 2.58 0.18 1.61 0.04 -1.26 -4.85 135.00 134.92 2b3p s PRO 192 Ca 0.00 0.90 -0.09 0.00 0.04 0.00 0.00 61.00 61.85 2b3p s PRO 192 Cb 0.00 -1.95 0.06 0.00 0.04 0.00 0.00 34.50 32.64 2b3p s PRO 192 CO 0.00 -1.34 1.62 0.28 0.04 0.00 0.00 177.00 177.60 2b3p h VAL 193 N -0.89 1.27 -4.38 -0.36 2.07 -1.96 -3.42 116.25 108.57 2b3p h VAL 193 Ca -0.45 -1.22 -0.61 0.00 0.82 0.00 0.00 66.70 65.24 2b3p h VAL 193 Cb 1.23 0.87 -0.29 0.00 -1.52 0.00 0.00 31.29 31.58 2b3p h VAL 193 CO 0.57 0.44 -0.86 -0.76 0.02 0.00 0.00 177.57 176.98 2b3p s LEU 194 N -9.27 2.08 0.53 2.57 1.02 -1.26 -5.13 118.68 109.21 2b3p s LEU 194 Ca -0.12 -0.43 -0.18 0.00 0.02 0.00 0.00 54.13 53.43 2b3p s LEU 194 Cb 0.13 -1.08 -0.07 0.00 0.02 0.00 0.00 46.19 45.19 2b3p s LEU 194 CO 0.86 0.24 1.02 -0.76 0.02 0.00 0.00 176.35 177.74 2b3p s LEU 195 N -0.69 3.68 0.70 1.79 1.43 -1.26 -4.95 118.68 119.38 2b3p s LEU 195 Ca 0.08 1.78 -0.15 0.00 -1.03 0.00 0.00 54.13 54.81 2b3p s LEU 195 Cb -0.08 -4.54 0.02 0.00 0.03 0.00 0.00 46.19 41.62 2b3p s LEU 195 CO -0.00 -0.83 1.15 -2.16 0.23 0.00 0.00 176.35 174.74 2b3p s PRO 196 N -3.73 2.44 0.68 1.29 0.04 -1.26 -5.01 135.00 129.45 2b3p s PRO 196 Ca 0.63 1.54 -0.08 0.00 0.04 0.00 0.00 61.00 63.14 2b3p s PRO 196 Cb -0.14 -1.89 0.04 0.00 0.04 0.00 0.00 34.50 32.55 2b3p s PRO 196 CO 0.28 -1.56 1.01 -0.51 0.04 0.00 0.00 177.00 176.26 2b3p s ASP 197 N -2.38 5.13 0.27 6.66 1.01 -1.26 -4.05 116.67 122.04 2b3p s ASP 197 Ca 0.70 0.67 -0.31 0.00 0.71 0.00 0.00 52.55 54.33 2b3p s ASP 197 Cb -0.24 -1.44 -0.12 0.00 1.01 0.00 0.00 42.92 42.13 2b3p s ASP 197 CO 0.44 -1.42 1.60 0.59 0.21 0.00 0.00 175.17 176.59 2b3p n ASN 198 N -2.87 3.74 -2.60 0.27 4.13 -1.26 -4.82 115.26 111.85 2b3p n ASN 198 Ca 0.07 1.13 -0.05 0.00 1.68 0.00 0.00 54.58 57.40 2b3p n ASN 198 Cb 0.59 -1.57 0.02 0.00 -1.54 0.00 0.00 39.78 37.28 2b3p n ASN 198 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2b3p n HIS 199 N 2.48 -1.78 -4.07 3.10 1.44 -1.00 -4.70 115.22 110.70 2b3p n HIS 199 Ca 0.10 -1.33 -0.09 0.00 -2.01 0.00 0.00 57.72 54.39 2b3p n HIS 199 Cb 0.36 0.66 -0.09 0.00 0.12 0.00 0.00 29.99 31.04 2b3p n HIS 199 CO 0.00 0.00 0.00 1.52 -2.81 0.00 0.00 176.34 175.05 2b3p s TYR 200 N -3.24 0.65 -0.09 -1.40 -0.85 -0.42 -0.50 117.35 111.50 2b3p s TYR 200 Ca 0.15 -1.04 0.01 0.00 -0.52 0.00 0.00 57.07 55.67 2b3p s TYR 200 Cb -0.03 -0.32 -0.02 0.00 0.38 0.00 0.00 41.96 41.97 2b3p s TYR 200 CO 0.08 -0.57 -0.10 -0.51 -1.52 0.00 0.00 175.55 172.92 2b3p s LEU 201 N -3.00 2.94 -0.24 -3.49 1.43 0.02 -1.10 118.68 115.23 2b3p s LEU 201 Ca 0.20 -0.17 -0.09 0.00 -1.03 0.00 0.00 54.13 53.04 2b3p s LEU 201 Cb 0.06 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 2b3p s LEU 201 CO -0.00 0.28 0.11 -0.55 0.23 0.00 0.00 176.35 176.42 2b3p s SER 202 N -0.30 5.61 0.06 2.29 0.15 0.18 -0.42 113.70 121.27 2b3p s SER 202 Ca 0.03 -0.05 0.09 0.00 0.70 0.00 0.00 55.95 56.72 2b3p s SER 202 Cb -0.13 -2.01 -0.03 0.00 -1.71 0.00 0.00 66.02 62.14 2b3p s SER 202 CO 0.03 0.02 -0.24 0.42 1.20 0.00 0.00 173.24 174.66 2b3p s THR 203 N 1.33 2.38 -0.07 6.45 -4.23 0.08 -1.60 115.64 119.98 2b3p s THR 203 Ca 0.06 -1.41 -0.03 0.00 -1.18 0.00 0.00 61.69 59.13 2b3p s THR 203 Cb -0.15 -1.98 0.03 0.00 1.34 0.00 0.00 72.50 71.75 2b3p s THR 203 CO 0.05 0.29 0.15 -1.10 -0.54 0.00 0.00 174.62 173.48 2b3p s GLN 204 N -1.49 0.11 0.07 3.99 1.11 -0.53 -1.88 119.66 121.04 2b3p s GLN 204 Ca 0.13 0.35 0.04 0.00 0.01 0.00 0.00 55.36 55.89 2b3p s GLN 204 Cb -0.10 -0.13 -0.03 0.00 -1.01 0.00 0.00 33.01 31.74 2b3p s GLN 204 CO 0.04 -0.14 -0.13 -1.12 0.01 0.00 0.00 175.29 173.96 2b3p s SER 205 N 0.96 1.50 -0.10 5.90 0.01 -1.26 -0.98 113.70 119.73 2b3p s SER 205 Ca -0.07 -0.63 -0.01 0.00 1.31 0.00 0.00 55.95 56.55 2b3p s SER 205 Cb -0.09 -0.03 0.03 0.00 0.21 0.00 0.00 66.02 66.14 2b3p s SER 205 CO -0.05 -0.12 -0.05 -0.69 0.41 0.00 0.00 173.24 172.74 2b3p s VAL 206 N -1.43 0.79 -0.11 3.43 1.01 0.23 -4.63 120.40 119.69 2b3p s VAL 206 Ca -0.03 -0.16 -0.06 0.00 0.00 0.00 0.00 61.98 61.74 2b3p s VAL 206 Cb -0.09 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 2b3p s VAL 206 CO 0.02 0.31 0.10 -0.76 0.00 0.00 0.00 175.10 174.77 2b3p s LEU 207 N 1.80 4.14 0.36 3.92 1.43 -1.26 -1.58 118.68 127.49 2b3p s LEU 207 Ca 0.05 0.36 -0.02 0.00 -1.03 0.00 0.00 54.13 53.49 2b3p s LEU 207 Cb -0.13 -1.99 0.01 0.00 0.03 0.00 0.00 46.19 44.11 2b3p s LEU 207 CO -0.07 0.39 0.50 -0.94 0.23 0.00 0.00 176.35 176.46 2b3p s SER 208 N -0.94 1.07 0.12 2.29 1.04 -0.10 -4.94 113.70 112.24 2b3p s SER 208 Ca 0.14 -1.55 0.09 0.00 0.48 0.00 0.00 55.95 55.10 2b3p s SER 208 Cb -0.12 0.69 -0.04 0.00 0.10 0.00 0.00 66.02 66.66 2b3p s SER 208 CO 0.03 -1.35 -0.21 -0.54 0.98 0.00 0.00 173.24 172.15 2b3p s LYS 209 N -2.85 1.18 -0.38 4.02 -0.14 -1.26 -1.51 119.74 118.79 2b3p s LYS 209 Ca 0.31 -1.24 -0.19 0.00 -1.36 0.00 0.00 55.97 53.48 2b3p s LYS 209 Cb -0.01 -1.41 0.01 0.00 -1.68 0.00 0.00 37.83 34.73 2b3p s LYS 209 CO 0.22 0.32 0.57 0.34 -0.76 0.00 0.00 175.35 176.04 2b3p s ASP 210 N -2.11 6.34 0.62 2.83 -1.08 -1.26 -4.94 116.67 117.06 2b3p s ASP 210 Ca 0.09 -0.12 0.33 0.00 -0.52 0.00 0.00 52.55 52.33 2b3p s ASP 210 Cb -0.09 -2.29 1.86 0.00 -1.46 0.00 0.00 42.92 40.94 2b3p s ASP 210 CO 0.05 -0.60 2.16 1.55 0.52 0.00 0.00 175.17 178.85 2b3p h PRO 211 N 8.60 0.00 -0.56 4.34 0.13 -2.03 -1.49 132.00 140.98 2b3p h PRO 211 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2b3p h PRO 211 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2b3p h PRO 211 CO 0.82 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.68 2b3p n ASN 212 N -3.52 4.89 -4.28 1.44 3.02 -1.26 -4.89 115.26 110.66 2b3p n ASN 212 Ca -0.01 -2.66 -0.36 0.00 -0.03 0.00 0.00 54.58 51.52 2b3p n ASN 212 Cb 0.23 -0.59 -0.13 0.00 -0.61 0.00 0.00 39.78 38.68 2b3p n ASN 212 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2b3p s GLU 213 N -2.23 2.89 0.27 3.52 2.56 -0.56 -4.96 118.70 120.19 2b3p s GLU 213 Ca 0.50 -0.97 0.18 0.00 0.00 0.00 0.00 54.97 54.68 2b3p s GLU 213 Cb 0.35 -3.28 0.09 0.00 2.00 0.00 0.00 34.13 33.29 2b3p s GLU 213 CO 0.19 -0.48 1.33 1.57 -0.56 0.00 0.00 175.26 177.31 2b3p h LYS 214 N 8.16 0.00 -7.30 4.30 2.10 -1.90 -3.47 116.57 118.46 2b3p h LYS 214 Ca -0.29 0.00 -0.50 0.00 -2.00 0.00 0.00 60.65 57.85 2b3p h LYS 214 Cb 1.11 0.00 0.07 0.00 -0.90 0.00 0.00 32.23 32.51 2b3p h LYS 214 CO 0.59 0.28 0.38 1.03 -2.00 0.00 0.00 179.45 179.73 2b3p s ARG 215 N -3.06 3.25 0.06 0.07 0.52 -1.26 -4.97 118.95 113.56 2b3p s ARG 215 Ca 0.03 0.95 -0.31 0.00 -0.52 0.00 0.00 55.73 55.89 2b3p s ARG 215 Cb 0.07 -2.03 -0.08 0.00 0.52 0.00 0.00 34.95 33.44 2b3p s ARG 215 CO 0.74 -0.85 1.56 0.34 0.02 0.00 0.00 175.30 177.11 2b3p s ASP 216 N -3.63 6.69 0.34 0.23 -1.08 -1.26 -4.94 116.67 113.01 2b3p s ASP 216 Ca 0.58 2.37 -0.09 0.00 -0.52 0.00 0.00 52.55 54.89 2b3p s ASP 216 Cb -0.13 -2.57 0.02 0.00 -1.46 0.00 0.00 42.92 38.78 2b3p s ASP 216 CO 0.49 -0.82 0.59 -1.38 0.52 0.00 0.00 175.17 174.57 2b3p s HIS 217 N 2.40 0.58 -0.16 -5.34 -3.43 -1.26 -1.17 115.29 106.90 2b3p s HIS 217 Ca 0.70 -0.99 -0.07 0.00 -0.80 0.00 0.00 55.06 53.90 2b3p s HIS 217 Cb -0.37 0.30 0.07 0.00 -1.43 0.00 0.00 32.58 31.15 2b3p s HIS 217 CO 0.30 -1.26 0.36 1.41 -2.00 0.00 0.00 174.74 173.55 2b3p s MET 218 N -3.01 0.30 -0.20 -0.38 1.75 -0.05 -4.98 119.30 112.73 2b3p s MET 218 Ca 0.23 0.81 -0.10 0.00 -1.25 0.00 0.00 55.69 55.38 2b3p s MET 218 Cb -0.02 0.06 -0.05 0.00 2.84 0.00 0.00 34.83 37.65 2b3p s MET 218 CO 0.15 -0.21 0.12 0.08 -0.65 0.00 0.00 175.02 174.52 2b3p s VAL 219 N 1.88 5.29 -0.02 10.11 1.01 -0.57 -0.33 120.40 137.77 2b3p s VAL 219 Ca -0.06 0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.11 2b3p s VAL 219 Cb -0.10 -3.42 -0.01 0.00 0.00 0.00 0.00 36.38 32.85 2b3p s VAL 219 CO -0.11 0.43 -0.14 -0.22 0.00 0.00 0.00 175.10 175.06 2b3p s LEU 220 N 0.50 1.95 -0.10 3.92 2.96 0.61 -0.92 118.68 127.59 2b3p s LEU 220 Ca 0.07 -0.26 0.02 0.00 -0.22 0.00 0.00 54.13 53.74 2b3p s LEU 220 Cb -0.12 -0.74 0.01 0.00 0.50 0.00 0.00 46.19 45.84 2b3p s LEU 220 CO -0.00 0.15 -0.17 -0.22 -1.32 0.00 0.00 176.35 174.78 2b3p s LEU 221 N -0.14 1.84 0.02 -0.68 2.96 -0.61 -1.15 118.68 120.92 2b3p s LEU 221 Ca 0.02 -0.46 0.03 0.00 -0.22 0.00 0.00 54.13 53.50 2b3p s LEU 221 Cb -0.07 -1.16 -0.01 0.00 0.50 0.00 0.00 46.19 45.44 2b3p s LEU 221 CO 0.00 0.06 -0.10 -0.70 -1.32 0.00 0.00 176.35 174.29 2b3p s GLU 222 N 0.79 0.70 -0.12 1.98 2.12 -0.10 -0.60 118.70 123.46 2b3p s GLU 222 Ca -0.10 -0.52 -0.00 0.00 0.36 0.00 0.00 54.97 54.71 2b3p s GLU 222 Cb -0.16 -0.64 0.02 0.00 0.26 0.00 0.00 34.13 33.61 2b3p s GLU 222 CO 0.01 0.16 -0.09 -0.06 -0.54 0.00 0.00 175.26 174.74 2b3p s PHE 223 N -0.62 1.66 -0.03 5.30 2.99 -0.15 -0.59 117.98 126.53 2b3p s PHE 223 Ca -0.00 -0.85 0.02 0.00 0.00 0.00 0.00 56.93 56.10 2b3p s PHE 223 Cb -0.06 -1.32 0.01 0.00 0.00 0.00 0.00 43.02 41.65 2b3p s PHE 223 CO 0.00 -0.54 -0.07 0.08 -0.00 0.00 0.00 175.22 174.69 2b3p s VAL 224 N 1.61 0.69 0.12 -0.44 1.01 0.03 -1.45 120.40 121.97 2b3p s VAL 224 Ca 0.04 -0.28 0.03 0.00 0.00 0.00 0.00 61.98 61.78 2b3p s VAL 224 Cb -0.13 -0.64 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 2b3p s VAL 224 CO -0.08 0.23 -0.09 0.42 0.00 0.00 0.00 175.10 175.59 2b3p s THR 225 N 0.44 0.95 0.10 3.92 -4.23 -0.63 -1.21 115.64 114.98 2b3p s THR 225 Ca -0.07 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.50 2b3p s THR 225 Cb -0.11 -1.76 -0.04 0.00 1.34 0.00 0.00 72.50 71.93 2b3p s THR 225 CO 0.01 -0.80 -0.03 0.00 -0.54 0.00 0.00 174.62 173.26 2b3p s ALA 226 N -3.45 3.21 0.22 3.99 0.00 -0.51 0.47 121.76 125.70 2b3p s ALA 226 Ca 0.14 -1.15 -0.08 0.00 0.00 0.00 0.00 51.96 50.87 2b3p s ALA 226 Cb 0.04 -1.12 0.03 0.00 0.00 0.00 0.00 23.12 22.07 2b3p s ALA 226 CO -0.02 0.68 0.44 0.00 0.00 0.00 0.00 175.76 176.87 2b3p n ALA 227 N 0.59 -0.97 0.00 0.00 0.00 -0.26 -4.37 120.51 115.49 2b3p n ALA 227 Ca -0.11 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.60 2b3p n ALA 227 Cb 0.52 0.58 0.00 0.00 0.00 0.00 0.00 19.45 20.55 2b3p n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b3p n GLY 228 N -0.31 1.32 3.12 0.00 0.00 -1.26 -1.30 105.19 106.77 2b3p n GLY 228 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 2b3p n GLY 228 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b3p s ILE 229 N -2.12 1.72 0.31 -0.61 1.01 -1.26 -4.84 121.20 115.41 2b3p s ILE 229 Ca 0.00 -0.79 -0.23 0.00 0.00 0.00 0.00 60.65 59.63 2b3p s ILE 229 Cb 0.00 -1.53 -0.10 0.00 0.01 0.00 0.00 42.46 40.84 2b3p s ILE 229 CO 0.00 0.48 0.87 0.42 0.00 0.00 0.00 174.94 176.71 2b3p s THR 230 N 0.74 4.37 0.13 2.92 -4.23 -1.26 -4.95 115.64 113.36 2b3p s THR 230 Ca -0.11 1.55 -0.31 0.00 -1.18 0.00 0.00 61.69 61.64 2b3p s THR 230 Cb -0.16 -3.87 -0.09 0.00 1.34 0.00 0.00 72.50 69.73 2b3p s THR 230 CO 0.02 0.05 1.44 -2.28 -0.54 0.00 0.00 174.62 173.32 2b3p s HIS 231 N -1.72 3.19 -1.10 3.99 2.46 -1.26 -5.06 115.29 115.80 2b3p s HIS 231 Ca 0.51 0.85 0.00 0.00 0.47 0.00 0.00 55.06 56.89 2b3p s HIS 231 Cb -0.16 -3.76 0.00 0.00 -0.13 0.00 0.00 32.58 28.53 2b3p s HIS 231 CO 0.21 -2.71 0.27 0.41 -2.47 0.00 0.00 174.74 170.45