#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2we3 s GLU 2 N 0.00 3.33 -0.32 0.03 2.02 -1.26 -4.83 118.70 117.67 2we3 s GLU 2 Ca 0.00 -0.73 0.17 0.00 0.02 0.00 0.00 54.97 54.43 2we3 s GLU 2 Cb 0.00 -4.61 0.46 0.00 0.10 0.00 0.00 34.13 30.08 2we3 s GLU 2 CO 0.00 -2.08 1.00 0.00 0.02 0.00 0.00 175.26 174.19 2we3 n ALA 3 N 8.73 3.46 -3.35 5.21 0.00 -1.26 -5.04 120.51 128.26 2we3 n ALA 3 Ca 0.13 -3.19 -0.37 0.00 0.00 0.00 0.00 53.44 50.01 2we3 n ALA 3 Cb 0.49 -0.88 -0.13 0.00 0.00 0.00 0.00 19.45 18.93 2we3 n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2we3 n PRO 5 N 4.77 0.76 -1.21 0.00 -0.02 -1.26 -4.70 135.00 133.33 2we3 n PRO 5 Ca -0.14 0.31 -0.37 0.00 -2.02 0.00 0.00 63.50 61.29 2we3 n PRO 5 Cb 0.46 -2.34 0.06 0.00 -0.02 0.00 0.00 33.50 31.65 2we3 n PRO 5 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2we3 n HIS 6 N -2.23 -1.77 -3.31 6.00 8.25 -1.26 -4.66 115.22 116.23 2we3 n HIS 6 Ca 0.14 0.32 -0.43 0.00 -0.26 0.00 0.00 57.72 57.49 2we3 n HIS 6 Cb 0.49 -1.81 -0.09 0.00 1.12 0.00 0.00 29.99 29.70 2we3 n HIS 6 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2we3 s ILE 7 N -1.95 5.07 0.16 1.59 1.01 0.16 -4.57 121.20 122.68 2we3 s ILE 7 Ca 0.60 -0.33 -0.30 0.00 0.00 0.00 0.00 60.65 60.62 2we3 s ILE 7 Cb -0.35 -4.05 -0.07 0.00 0.01 0.00 0.00 42.46 38.00 2we3 s ILE 7 CO 0.63 -0.44 0.97 -0.13 0.00 0.00 0.00 174.94 175.97 2we3 s ARG 8 N 2.17 4.75 0.07 2.79 0.52 -1.25 -0.94 118.95 127.05 2we3 s ARG 8 Ca 0.13 1.49 -0.18 0.00 -0.52 0.00 0.00 55.73 56.65 2we3 s ARG 8 Cb -0.17 -3.33 0.04 0.00 0.52 0.00 0.00 34.95 32.01 2we3 s ARG 8 CO 0.14 0.31 0.41 1.52 0.02 0.00 0.00 175.30 177.70 2we3 s TYR 9 N -0.45 -0.25 0.02 -0.53 -0.85 -1.05 -0.24 117.35 114.00 2we3 s TYR 9 Ca 0.45 0.12 0.03 0.00 -0.52 0.00 0.00 57.07 57.15 2we3 s TYR 9 Cb -0.25 0.24 -0.01 0.00 0.38 0.00 0.00 41.96 42.32 2we3 s TYR 9 CO 0.31 -0.62 -0.08 0.00 -1.52 0.00 0.00 175.55 173.64 2we3 s ALA 10 N -2.95 0.66 -0.09 9.51 0.00 -0.48 0.03 121.76 128.44 2we3 s ALA 10 Ca -0.02 -0.55 -0.07 0.00 0.00 0.00 0.00 51.96 51.32 2we3 s ALA 10 Cb 0.00 -0.08 0.03 0.00 0.00 0.00 0.00 23.12 23.08 2we3 s ALA 10 CO -0.06 0.09 0.23 0.12 0.00 0.00 0.00 175.76 176.14 2we3 s PHE 11 N -0.72 -0.28 -0.27 0.00 5.36 -1.26 -1.47 117.98 119.35 2we3 s PHE 11 Ca -0.02 0.67 -0.03 0.00 -0.96 0.00 0.00 56.93 56.59 2we3 s PHE 11 Cb -0.06 0.06 0.16 0.00 -0.34 0.00 0.00 43.02 42.84 2we3 s PHE 11 CO 0.00 -0.17 0.51 -1.14 -1.46 0.00 0.00 175.22 172.96 2we3 s GLN 12 N 0.62 0.47 -0.30 10.12 2.00 -0.52 -5.02 119.66 127.03 2we3 s GLN 12 Ca -0.04 0.87 -0.13 0.00 -2.00 0.00 0.00 55.36 54.05 2we3 s GLN 12 Cb -0.06 0.18 0.18 0.00 0.80 0.00 0.00 33.01 34.11 2we3 s GLN 12 CO -0.04 -0.57 1.03 1.21 -0.50 0.00 0.00 175.29 176.42 2we3 s ASN 13 N 2.73 -0.51 0.00 6.67 3.84 -1.26 -4.31 114.94 122.10 2we3 s ASN 13 Ca 0.14 0.43 0.27 0.00 0.21 0.00 0.00 52.86 53.91 2we3 s ASN 13 Cb -0.15 1.47 1.14 0.00 -0.55 0.00 0.00 41.25 43.16 2we3 s ASN 13 CO -0.18 -0.10 1.79 -0.90 -2.79 0.00 0.00 177.10 174.92 2we3 n ASP 14 N 5.28 1.20 -0.29 -4.21 3.85 -1.26 -2.48 116.55 118.63 2we3 n ASP 14 Ca -0.07 -1.45 0.12 0.00 -0.71 0.00 0.00 54.79 52.68 2we3 n ASP 14 Cb 0.53 -0.02 0.17 0.00 -1.35 0.00 0.00 41.12 40.46 2we3 n ASP 14 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 2we3 n LYS 15 N -0.05 0.82 -4.85 0.11 5.02 -1.26 -4.91 118.16 113.03 2we3 n LYS 15 Ca 0.19 -0.59 -0.26 0.00 -2.02 0.00 0.00 58.31 55.63 2we3 n LYS 15 Cb 0.29 -1.49 -0.16 0.00 -0.02 0.00 0.00 35.03 33.65 2we3 n LYS 15 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2we3 s LEU 16 N -2.59 1.91 -0.23 -0.35 1.43 -1.04 -0.39 118.68 117.43 2we3 s LEU 16 Ca 0.19 -0.36 -0.19 0.00 -1.03 0.00 0.00 54.13 52.74 2we3 s LEU 16 Cb 0.18 -1.00 -0.03 0.00 0.03 0.00 0.00 46.19 45.38 2we3 s LEU 16 CO 0.59 0.15 0.56 -0.22 0.23 0.00 0.00 176.35 177.66 2we3 s LEU 17 N 0.08 4.10 -0.25 1.79 2.96 0.47 -4.76 118.68 123.07 2we3 s LEU 17 Ca -0.05 0.66 -0.29 0.00 -0.22 0.00 0.00 54.13 54.23 2we3 s LEU 17 Cb -0.12 -2.75 -0.01 0.00 0.50 0.00 0.00 46.19 43.81 2we3 s LEU 17 CO 0.03 -0.26 1.33 -0.22 -1.32 0.00 0.00 176.35 175.91 2we3 s LEU 18 N 2.03 3.96 0.28 -0.68 2.96 -1.26 -0.81 118.68 125.16 2we3 s LEU 18 Ca 0.24 1.39 0.23 0.00 -0.22 0.00 0.00 54.13 55.77 2we3 s LEU 18 Cb -0.16 -3.54 0.23 0.00 0.50 0.00 0.00 46.19 43.22 2we3 s LEU 18 CO 0.09 -1.02 1.34 1.56 -1.32 0.00 0.00 176.35 177.00 2we3 h GLN 19 N 9.18 0.00 0.00 1.98 4.20 -1.41 -3.49 115.11 125.57 2we3 h GLN 19 Ca -0.27 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.36 2we3 h GLN 19 Cb 1.11 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.88 2we3 h GLN 19 CO 1.01 0.00 -0.05 1.04 -0.67 0.00 0.00 178.83 180.17 2we3 n GLN 20 N -2.73 1.57 0.00 1.46 1.13 -1.24 -4.97 117.38 112.60 2we3 n GLN 20 Ca 0.02 -0.47 0.00 0.00 -1.94 0.00 0.00 57.00 54.61 2we3 n GLN 20 Cb 0.52 0.08 0.00 0.00 0.11 0.00 0.00 30.24 30.95 2we3 n GLN 20 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2we3 n GLY 24 N 4.15 0.00 2.88 1.08 0.00 -1.16 -4.85 105.19 107.30 2we3 n GLY 24 Ca -0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.81 2we3 n GLY 24 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2we3 s ARG 25 N -1.28 0.81 -0.04 1.61 3.52 -1.26 -4.20 118.95 118.11 2we3 s ARG 25 Ca 0.00 -0.09 -0.15 0.00 -0.13 0.00 0.00 55.73 55.37 2we3 s ARG 25 Cb 0.00 -0.85 -0.05 0.00 -1.56 0.00 0.00 34.95 32.49 2we3 s ARG 25 CO 0.00 -0.10 0.39 -1.17 -0.81 0.00 0.00 175.30 173.61 2we3 s LEU 26 N 1.00 4.42 -0.02 -0.88 0.20 0.63 -4.93 118.68 119.10 2we3 s LEU 26 Ca -0.10 0.87 0.02 0.00 0.69 0.00 0.00 54.13 55.61 2we3 s LEU 26 Cb -0.14 -2.54 0.01 0.00 -0.43 0.00 0.00 46.19 43.08 2we3 s LEU 26 CO -0.00 0.27 -0.07 -0.89 -0.29 0.00 0.00 176.35 175.36 2we3 s THR 27 N -0.70 0.63 0.09 3.68 2.01 -1.25 -0.45 115.64 119.64 2we3 s THR 27 Ca 0.23 -0.26 0.09 0.00 0.31 0.00 0.00 61.69 62.05 2we3 s THR 27 Cb -0.16 -0.58 -0.04 0.00 0.01 0.00 0.00 72.50 71.74 2we3 s THR 27 CO 0.11 0.21 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.29 2we3 s LEU 28 N 0.30 2.56 0.08 4.42 1.43 0.57 -0.94 118.68 127.11 2we3 s LEU 28 Ca -0.04 -0.56 0.09 0.00 -1.03 0.00 0.00 54.13 52.59 2we3 s LEU 28 Cb -0.09 -1.46 -0.03 0.00 0.03 0.00 0.00 46.19 44.64 2we3 s LEU 28 CO 0.00 0.21 -0.24 -0.69 0.23 0.00 0.00 176.35 175.86 2we3 s VAL 29 N -1.04 2.40 0.22 -1.59 1.01 0.01 0.10 120.40 121.50 2we3 s VAL 29 Ca 0.16 -1.50 -0.30 0.00 0.00 0.00 0.00 61.98 60.34 2we3 s VAL 29 Cb -0.10 -2.02 -0.08 0.00 0.00 0.00 0.00 36.38 34.17 2we3 s VAL 29 CO 0.07 0.23 0.98 0.54 0.00 0.00 0.00 175.10 176.92 2we3 s ASN 30 N -1.69 7.55 -0.00 3.32 4.22 -1.05 -0.39 114.94 126.89 2we3 s ASN 30 Ca 0.14 1.98 0.19 0.00 -2.14 0.00 0.00 52.86 53.02 2we3 s ASN 30 Cb -0.10 -2.61 -0.19 0.00 1.28 0.00 0.00 41.25 39.63 2we3 s ASN 30 CO 0.05 0.05 0.61 0.29 -2.04 0.00 0.00 177.10 176.07 2we3 n LYS 31 N 1.73 0.64 -4.48 3.55 5.02 0.48 -0.88 118.16 124.23 2we3 n LYS 31 Ca -0.01 0.07 -0.24 0.00 -2.02 0.00 0.00 58.31 56.11 2we3 n LYS 31 Cb 0.47 -1.69 -0.10 0.00 -0.02 0.00 0.00 35.03 33.69 2we3 n LYS 31 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2we3 s THR 32 N -3.00 2.47 0.38 -0.18 -4.23 -1.26 -4.59 115.64 105.22 2we3 s THR 32 Ca -0.05 -2.38 -0.26 0.00 -1.18 0.00 0.00 61.69 57.82 2we3 s THR 32 Cb 0.09 -2.35 -0.09 0.00 1.34 0.00 0.00 72.50 71.49 2we3 s THR 32 CO 0.83 -0.37 1.16 0.42 -0.54 0.00 0.00 174.62 176.12 2we3 s THR 33 N -2.52 3.23 -0.21 3.99 -4.23 -1.26 -4.21 115.64 110.43 2we3 s THR 33 Ca 0.30 1.07 -0.03 0.00 -1.18 0.00 0.00 61.69 61.85 2we3 s THR 33 Cb -0.04 -3.61 -0.01 0.00 1.34 0.00 0.00 72.50 70.18 2we3 s THR 33 CO 0.15 0.13 -0.06 -0.63 -0.54 0.00 0.00 174.62 173.67 2we3 s ILE 34 N -1.38 3.31 -0.14 2.99 1.01 0.69 -4.91 121.20 122.76 2we3 s ILE 34 Ca 0.55 -0.52 -0.13 0.00 0.00 0.00 0.00 60.65 60.55 2we3 s ILE 34 Cb -0.31 -2.49 -0.05 0.00 0.01 0.00 0.00 42.46 39.63 2we3 s ILE 34 CO 0.39 0.44 0.27 -0.22 0.00 0.00 0.00 174.94 175.82 2we3 s LEU 35 N 1.33 4.29 -0.23 2.97 0.20 -1.26 0.12 118.68 126.11 2we3 s LEU 35 Ca 0.04 0.53 -0.05 0.00 0.69 0.00 0.00 54.13 55.33 2we3 s LEU 35 Cb -0.14 -2.33 -0.02 0.00 -0.43 0.00 0.00 46.19 43.27 2we3 s LEU 35 CO -0.03 0.18 0.01 -0.76 -0.29 0.00 0.00 176.35 175.46 2we3 s LEU 36 N 0.07 3.18 0.62 -0.68 1.02 0.22 -4.98 118.68 118.12 2we3 s LEU 36 Ca 0.16 -0.28 -0.18 0.00 0.02 0.00 0.00 54.13 53.85 2we3 s LEU 36 Cb -0.13 -1.83 -0.02 0.00 0.02 0.00 0.00 46.19 44.23 2we3 s LEU 36 CO 0.04 -0.00 1.23 -0.13 0.02 0.00 0.00 176.35 177.50 2we3 s ARG 37 N 1.41 2.81 0.52 1.70 1.81 -1.26 -1.19 118.95 124.75 2we3 s ARG 37 Ca 0.05 1.87 -0.16 0.00 -1.72 0.00 0.00 55.73 55.77 2we3 s ARG 37 Cb -0.15 -1.90 -0.07 0.00 -0.45 0.00 0.00 34.95 32.38 2we3 s ARG 37 CO 0.01 -1.34 0.98 -1.25 -0.68 0.00 0.00 175.30 173.01 2we3 s PRO 38 N -3.40 3.91 0.00 3.54 0.04 -1.26 -4.02 135.00 133.82 2we3 s PRO 38 Ca 0.78 0.91 0.00 0.00 0.04 0.00 0.00 61.00 62.73 2we3 s PRO 38 Cb -0.32 -2.15 0.00 0.00 0.04 0.00 0.00 34.50 32.08 2we3 s PRO 38 CO 0.36 -0.28 0.00 -1.33 0.04 0.00 0.00 177.00 175.78 2we3 n MET 39 N -1.66 -1.22 -4.23 4.56 2.81 -1.25 -4.94 117.12 111.19 2we3 n MET 39 Ca 0.06 0.31 -0.16 0.00 -1.81 0.00 0.00 57.70 56.10 2we3 n MET 39 Cb 0.54 -4.36 -0.11 0.00 -0.71 0.00 0.00 33.22 28.59 2we3 n MET 39 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2we3 s LYS 40 N -1.32 1.01 0.04 0.03 -0.14 -1.26 -3.42 119.74 114.68 2we3 s LYS 40 Ca 0.00 -1.31 -0.30 0.00 -1.36 0.00 0.00 55.97 52.99 2we3 s LYS 40 Cb 0.00 -0.73 -0.04 0.00 -1.68 0.00 0.00 37.83 35.38 2we3 s LYS 40 CO 0.00 0.12 1.03 0.99 -0.76 0.00 0.00 175.35 176.73 2we3 s THR 41 N -2.68 4.59 -0.11 2.17 2.01 -1.26 -4.47 115.64 115.89 2we3 s THR 41 Ca 0.12 1.91 -0.01 0.00 0.31 0.00 0.00 61.69 64.01 2we3 s THR 41 Cb -0.02 -4.22 -0.03 0.00 0.01 0.00 0.00 72.50 68.24 2we3 s THR 41 CO 0.02 0.18 -0.05 -0.89 -0.69 0.00 0.00 174.62 173.19 2we3 s THR 42 N 0.82 3.87 -0.02 -0.82 2.01 -0.66 -4.97 115.64 115.87 2we3 s THR 42 Ca 0.53 -0.39 0.07 0.00 0.31 0.00 0.00 61.69 62.20 2we3 s THR 42 Cb -0.24 -2.64 -0.02 0.00 0.01 0.00 0.00 72.50 69.62 2we3 s THR 42 CO 0.29 0.56 -0.22 0.28 -0.69 0.00 0.00 174.62 174.84 2we3 s THR 43 N -0.32 1.71 -0.25 -0.82 -1.32 -1.26 -0.06 115.64 113.32 2we3 s THR 43 Ca 0.05 -0.92 -0.00 0.00 -1.21 0.00 0.00 61.69 59.61 2we3 s THR 43 Cb -0.12 -1.42 0.04 0.00 -1.51 0.00 0.00 72.50 69.48 2we3 s THR 43 CO 0.02 0.48 -0.08 -0.69 -2.21 0.00 0.00 174.62 172.15 2we3 s VAL 44 N -0.47 2.66 -0.10 5.08 1.01 0.45 -4.97 120.40 124.06 2we3 s VAL 44 Ca 0.07 -1.20 -0.30 0.00 0.00 0.00 0.00 61.98 60.56 2we3 s VAL 44 Cb -0.09 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 2we3 s VAL 44 CO -0.01 0.14 1.10 -1.81 0.00 0.00 0.00 175.10 174.53 2we3 s ASP 45 N 1.26 7.14 0.17 3.32 1.01 -1.26 -1.56 116.67 126.75 2we3 s ASP 45 Ca -0.02 1.64 0.22 0.00 0.71 0.00 0.00 52.55 55.10 2we3 s ASP 45 Cb -0.17 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.16 2we3 s ASP 45 CO -0.05 -0.54 0.97 0.18 0.21 0.00 0.00 175.17 175.94 2we3 n LEU 46 N 5.31 0.77 -1.49 1.23 4.77 -1.01 -4.93 117.00 121.64 2we3 n LEU 46 Ca 0.10 0.30 -0.17 0.00 -0.03 0.00 0.00 56.01 56.21 2we3 n LEU 46 Cb 0.47 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 41.46 2we3 n LEU 46 CO 0.53 -0.15 -0.18 0.61 -1.33 0.00 0.00 177.39 176.88 2we3 n GLY 47 N 1.20 1.19 3.22 -0.72 0.00 -1.26 -4.65 105.19 104.17 2we3 n GLY 47 Ca -0.01 -0.18 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 2we3 n GLY 47 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2we3 s LEU 48 N -4.21 2.33 0.03 0.99 2.96 -1.26 -1.44 118.68 118.08 2we3 s LEU 48 Ca 0.00 -0.53 0.07 0.00 -0.22 0.00 0.00 54.13 53.45 2we3 s LEU 48 Cb 0.00 -1.52 -0.03 0.00 0.50 0.00 0.00 46.19 45.14 2we3 s LEU 48 CO 0.00 0.07 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.61 2we3 s TYR 49 N 0.89 2.56 -0.28 5.38 1.51 -0.54 0.08 117.35 126.94 2we3 s TYR 49 Ca -0.04 -0.26 -0.15 0.00 -1.01 0.00 0.00 57.07 55.60 2we3 s TYR 49 Cb -0.15 -1.47 0.09 0.00 -0.11 0.00 0.00 41.96 40.31 2we3 s TYR 49 CO -0.02 0.24 0.70 0.00 -1.11 0.00 0.00 175.55 175.35 2we3 s ALA 50 N -0.90 -1.92 -0.38 3.71 0.00 -1.26 -1.38 121.76 119.63 2we3 s ALA 50 Ca 0.14 2.41 -0.18 0.00 0.00 0.00 0.00 51.96 54.33 2we3 s ALA 50 Cb -0.10 -1.48 0.01 0.00 0.00 0.00 0.00 23.12 21.54 2we3 s ALA 50 CO 0.05 -0.44 0.50 1.03 0.00 0.00 0.00 175.76 176.90 2we3 s ARG 51 N 1.76 3.44 0.13 0.00 1.81 0.67 -4.95 118.95 121.81 2we3 s ARG 51 Ca -0.10 -0.36 -0.31 0.00 -1.72 0.00 0.00 55.73 53.24 2we3 s ARG 51 Cb -0.06 -3.87 -0.11 0.00 -0.45 0.00 0.00 34.95 30.47 2we3 s ARG 51 CO -0.20 -0.73 1.82 -2.30 -0.68 0.00 0.00 175.30 173.21 2we3 n PRO 52 N 5.75 2.79 -1.48 3.54 -0.02 -1.26 -3.97 135.00 140.35 2we3 n PRO 52 Ca -0.05 1.01 -0.30 0.00 -2.02 0.00 0.00 63.50 62.14 2we3 n PRO 52 Cb 0.48 -2.90 0.11 0.00 -0.02 0.00 0.00 33.50 31.17 2we3 n PRO 52 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2we3 s PRO 53 N 2.51 1.75 0.20 0.52 0.04 -1.26 -4.82 135.00 133.94 2we3 s PRO 53 Ca 0.81 0.61 -0.33 0.00 0.04 0.00 0.00 61.00 62.14 2we3 s PRO 53 Cb -0.49 -1.88 -0.13 0.00 0.04 0.00 0.00 34.50 32.04 2we3 s PRO 53 CO 0.37 -1.85 1.53 -1.91 0.04 0.00 0.00 177.00 175.18 2we3 n GLU 54 N -3.58 2.20 -0.03 4.56 2.13 -1.26 -1.31 120.64 123.35 2we3 n GLU 54 Ca 0.07 0.79 0.00 0.00 0.66 0.00 0.00 57.16 58.68 2we3 n GLU 54 Cb 0.57 -2.53 0.00 0.00 0.27 0.00 0.00 31.44 29.75 2we3 n GLU 54 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2we3 n GLY 55 N 2.94 1.30 3.40 8.31 0.00 -1.26 -4.85 105.19 115.03 2we3 n GLY 55 Ca 0.14 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 2we3 n GLY 55 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2we3 s HIS 56 N -2.47 2.02 0.52 1.61 3.76 -0.43 -3.04 115.29 117.25 2we3 s HIS 56 Ca 0.00 -0.44 0.02 0.00 -0.15 0.00 0.00 55.06 54.49 2we3 s HIS 56 Cb 0.00 -0.92 0.02 0.00 1.11 0.00 0.00 32.58 32.78 2we3 s HIS 56 CO 0.00 0.51 0.14 0.41 -0.85 0.00 0.00 174.74 174.95 2we3 n GLY 57 N -0.30 3.29 3.37 -2.22 0.00 -0.02 -4.47 105.19 104.84 2we3 n GLY 57 Ca -0.08 -2.35 -0.29 0.00 0.00 0.00 0.00 46.02 43.30 2we3 n GLY 57 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2we3 s LEU 58 N 0.00 2.27 -0.14 0.99 1.43 -0.77 -2.27 118.68 120.18 2we3 s LEU 58 Ca 0.11 -0.69 0.00 0.00 -1.03 0.00 0.00 54.13 52.51 2we3 s LEU 58 Cb -0.01 -1.22 -0.01 0.00 0.03 0.00 0.00 46.19 44.98 2we3 s LEU 58 CO 0.07 0.20 -0.14 -0.32 0.23 0.00 0.00 176.35 176.39 2we3 s MET 59 N -1.78 3.29 -0.09 1.70 1.75 0.48 0.25 119.30 124.91 2we3 s MET 59 Ca 0.13 -0.72 0.02 0.00 -1.25 0.00 0.00 55.69 53.87 2we3 s MET 59 Cb -0.10 -2.63 -0.02 0.00 2.84 0.00 0.00 34.83 34.92 2we3 s MET 59 CO 0.05 0.10 -0.16 -1.17 -0.65 0.00 0.00 175.02 173.19 2we3 s LEU 60 N 0.62 2.59 -0.03 4.11 2.96 0.10 -2.03 118.68 127.00 2we3 s LEU 60 Ca -0.08 -0.33 -0.24 0.00 -0.22 0.00 0.00 54.13 53.26 2we3 s LEU 60 Cb -0.16 -1.54 0.05 0.00 0.50 0.00 0.00 46.19 45.04 2we3 s LEU 60 CO 0.03 0.24 0.53 -1.66 -1.32 0.00 0.00 176.35 174.16 2we3 s TRP 61 N -0.08 -0.46 0.08 5.38 -2.14 -0.33 0.01 118.94 121.40 2we3 s TRP 61 Ca -0.03 0.75 -0.09 0.00 2.66 0.00 0.00 56.10 59.39 2we3 s TRP 61 Cb -0.14 0.29 -0.06 0.00 -3.10 0.00 0.00 33.47 30.46 2we3 s TRP 61 CO 0.04 -0.53 0.40 0.20 -2.66 0.00 0.00 176.95 174.39 2we3 s GLY 62 N -1.32 2.33 -0.08 3.67 0.00 -1.26 -0.63 107.32 110.03 2we3 s GLY 62 Ca -0.11 -0.40 0.01 0.00 0.00 0.00 0.00 44.72 44.22 2we3 s GLY 62 CO 0.07 -0.19 -0.10 -0.45 0.00 0.00 0.00 173.10 172.43 2we3 s SER 63 N -1.83 1.85 0.09 1.64 0.15 0.45 -4.66 113.70 111.39 2we3 s SER 63 Ca 0.34 -0.28 -0.15 0.00 0.70 0.00 0.00 55.95 56.55 2we3 s SER 63 Cb -0.14 -0.79 0.03 0.00 -1.71 0.00 0.00 66.02 63.41 2we3 s SER 63 CO 0.19 -0.04 0.37 0.28 1.20 0.00 0.00 173.24 175.24 2we3 s THR 64 N 1.11 0.08 -1.51 6.45 -1.32 -1.26 -1.60 115.64 117.58 2we3 s THR 64 Ca -0.06 -0.62 0.16 0.00 -1.21 0.00 0.00 61.69 59.96 2we3 s THR 64 Cb -0.14 -1.09 0.42 0.00 -1.51 0.00 0.00 72.50 70.18 2we3 s THR 64 CO -0.01 -0.34 1.34 -1.54 -2.21 0.00 0.00 174.62 171.85 2we3 n SER 65 N 0.12 3.28 -4.91 8.08 3.41 -1.26 -4.97 113.62 117.37 2we3 n SER 65 Ca -0.17 -1.96 -0.28 0.00 -0.26 0.00 0.00 58.87 56.20 2we3 n SER 65 Cb 0.62 -0.31 0.07 0.00 -0.26 0.00 0.00 64.21 64.33 2we3 n SER 65 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2we3 s ARG 66 N -1.06 2.30 -1.39 4.33 1.81 -1.26 -4.93 118.95 118.75 2we3 s ARG 66 Ca 0.33 0.07 -0.09 0.00 -1.72 0.00 0.00 55.73 54.33 2we3 s ARG 66 Cb 0.18 -2.05 -0.08 0.00 -0.45 0.00 0.00 34.95 32.54 2we3 s ARG 66 CO 0.24 -1.30 2.76 -0.35 -0.68 0.00 0.00 175.30 175.96 2we3 n PRO 67 N -3.08 3.22 -4.20 3.54 -0.04 -1.26 -4.81 135.00 128.37 2we3 n PRO 67 Ca 0.07 -1.96 -0.17 0.00 -0.04 0.00 0.00 63.50 61.41 2we3 n PRO 67 Cb 0.60 -2.68 -0.15 0.00 -0.04 0.00 0.00 33.50 31.23 2we3 n PRO 67 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2we3 s VAL 68 N 2.46 0.48 -0.12 0.52 1.01 -1.26 -1.26 120.40 122.23 2we3 s VAL 68 Ca 0.62 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 62.37 2we3 s VAL 68 Cb 0.16 -0.41 -0.00 0.00 0.00 0.00 0.00 36.38 36.13 2we3 s VAL 68 CO -0.05 0.14 -0.20 -0.89 0.00 0.00 0.00 175.10 174.10 2we3 s THR 69 N -0.07 2.36 0.10 3.92 2.01 -0.17 -4.90 115.64 118.89 2we3 s THR 69 Ca 0.01 -0.90 -0.18 0.00 0.31 0.00 0.00 61.69 60.93 2we3 s THR 69 Cb -0.03 -1.94 -0.07 0.00 0.01 0.00 0.00 72.50 70.47 2we3 s THR 69 CO -0.00 0.54 0.58 -0.55 -0.69 0.00 0.00 174.62 174.50 2we3 s SER 70 N 0.46 7.01 0.26 3.53 0.15 -1.26 -0.23 113.70 123.62 2we3 s SER 70 Ca -0.14 1.23 -0.30 0.00 0.70 0.00 0.00 55.95 57.45 2we3 s SER 70 Cb -0.17 -2.35 -0.10 0.00 -1.71 0.00 0.00 66.02 61.70 2we3 s SER 70 CO 0.06 0.22 1.36 -2.28 1.20 0.00 0.00 173.24 173.80 2we3 s HIS 71 N -1.22 3.10 -0.39 3.44 2.46 0.31 -4.90 115.29 118.09 2we3 s HIS 71 Ca 0.32 1.19 -0.20 0.00 0.47 0.00 0.00 55.06 56.84 2we3 s HIS 71 Cb -0.18 -3.71 0.01 0.00 -0.13 0.00 0.00 32.58 28.56 2we3 s HIS 71 CO 0.19 -2.20 0.63 0.08 -2.47 0.00 0.00 174.74 170.97 2we3 s VAL 72 N -0.29 4.87 -0.07 0.89 1.01 -1.26 -4.55 120.40 120.99 2we3 s VAL 72 Ca 0.56 0.38 -0.17 0.00 0.00 0.00 0.00 61.98 62.75 2we3 s VAL 72 Cb -0.40 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 31.81 2we3 s VAL 72 CO 0.44 -0.42 0.45 -0.83 0.00 0.00 0.00 175.10 174.74 2we3 s GLY 73 N 1.88 2.43 -0.30 4.51 0.00 0.10 -4.55 107.32 111.38 2we3 s GLY 73 Ca 0.23 -0.20 -0.16 0.00 0.00 0.00 0.00 44.72 44.60 2we3 s GLY 73 CO 0.16 0.56 0.40 -0.42 0.00 0.00 0.00 173.10 173.80 2we3 s ILE 74 N 0.03 5.14 -0.31 0.90 -1.09 -1.26 -0.72 121.20 123.90 2we3 s ILE 74 Ca 0.25 0.39 -0.16 0.00 -2.23 0.00 0.00 60.65 58.90 2we3 s ILE 74 Cb -0.16 -3.78 -0.02 0.00 -1.58 0.00 0.00 42.46 36.92 2we3 s ILE 74 CO 0.11 0.02 0.43 -0.63 -1.23 0.00 0.00 174.94 173.65 2we3 s ILE 75 N 2.11 5.11 0.40 2.92 -1.09 0.14 -4.97 121.20 125.83 2we3 s ILE 75 Ca 0.15 0.43 -0.23 0.00 -2.23 0.00 0.00 60.65 58.77 2we3 s ILE 75 Cb -0.16 -3.82 -0.10 0.00 -1.58 0.00 0.00 42.46 36.80 2we3 s ILE 75 CO 0.11 -0.01 0.97 -1.81 -1.23 0.00 0.00 174.94 172.96 2we3 s ASP 76 N 1.68 6.98 0.45 3.58 1.01 -1.26 -1.84 116.67 127.27 2we3 s ASP 76 Ca 0.16 1.78 0.15 0.00 0.71 0.00 0.00 52.55 55.36 2we3 s ASP 76 Cb -0.16 -2.56 1.08 0.00 1.01 0.00 0.00 42.92 42.30 2we3 s ASP 76 CO 0.11 -0.33 1.98 -0.65 0.21 0.00 0.00 175.17 176.49 2we3 h PRO 77 N 2.29 0.34 0.00 8.23 0.11 -1.83 -1.06 132.00 140.08 2we3 h PRO 77 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2we3 h PRO 77 Cb 1.19 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2we3 h PRO 77 CO 0.62 0.23 0.00 0.41 -0.21 0.00 0.00 178.00 179.05 2we3 n GLY 78 N -1.53 -1.13 3.69 -0.55 0.00 -1.26 -4.07 105.19 100.33 2we3 n GLY 78 Ca 0.10 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2we3 n GLY 78 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2we3 s TYR 79 N -2.86 3.48 0.00 1.61 5.04 -0.40 -4.89 117.35 119.33 2we3 s TYR 79 Ca 0.13 1.56 0.00 0.00 -2.44 0.00 0.00 57.07 56.32 2we3 s TYR 79 Cb 0.14 -3.21 0.00 0.00 0.35 0.00 0.00 41.96 39.24 2we3 s TYR 79 CO 0.36 -0.31 0.70 0.25 -1.34 0.00 0.00 175.55 175.21 2we3 n THR 80 N 4.59 0.49 -2.05 4.34 -2.24 -1.26 -4.87 114.28 113.27 2we3 n THR 80 Ca 0.09 -0.62 -0.04 0.00 -2.27 0.00 0.00 64.05 61.21 2we3 n THR 80 Cb 0.48 0.84 0.02 0.00 -2.10 0.00 0.00 70.33 69.58 2we3 n THR 80 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2we3 n GLY 81 N -0.25 0.33 3.73 3.38 0.00 -1.26 -4.96 105.19 106.16 2we3 n GLY 81 Ca 0.00 -1.90 -0.41 0.00 0.00 0.00 0.00 46.02 43.71 2we3 n GLY 81 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2we3 s GLU 82 N -2.97 4.70 0.28 1.61 2.12 -1.26 -4.56 118.70 118.62 2we3 s GLU 82 Ca 0.11 1.42 -0.29 0.00 0.36 0.00 0.00 54.97 56.57 2we3 s GLU 82 Cb -0.01 -3.36 -0.10 0.00 0.26 0.00 0.00 34.13 30.93 2we3 s GLU 82 CO 0.08 0.27 1.25 -0.51 -0.54 0.00 0.00 175.26 175.80 2we3 s LEU 83 N -0.18 4.46 -0.02 2.70 1.43 0.11 -4.97 118.68 122.21 2we3 s LEU 83 Ca 0.45 2.50 0.05 0.00 -1.03 0.00 0.00 54.13 56.10 2we3 s LEU 83 Cb -0.23 -3.63 -0.01 0.00 0.03 0.00 0.00 46.19 42.34 2we3 s LEU 83 CO 0.29 -0.42 -0.17 -0.60 0.23 0.00 0.00 176.35 175.68 2we3 s ARG 84 N -1.27 1.51 -0.10 1.70 3.52 -1.26 -2.40 118.95 120.64 2we3 s ARG 84 Ca 0.50 -0.62 -0.09 0.00 -0.13 0.00 0.00 55.73 55.39 2we3 s ARG 84 Cb -0.37 -1.41 -0.04 0.00 -1.56 0.00 0.00 34.95 31.56 2we3 s ARG 84 CO 0.46 0.34 0.19 -1.17 -0.81 0.00 0.00 175.30 174.31 2we3 s LEU 85 N -0.29 4.40 -0.16 -0.88 2.96 -0.60 -4.94 118.68 119.16 2we3 s LEU 85 Ca 0.04 0.56 -0.01 0.00 -0.22 0.00 0.00 54.13 54.50 2we3 s LEU 85 Cb -0.08 -2.18 -0.00 0.00 0.50 0.00 0.00 46.19 44.43 2we3 s LEU 85 CO 0.00 0.38 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.65 2we3 s ILE 86 N -0.95 2.84 0.13 6.68 1.01 -1.26 -0.41 121.20 129.23 2we3 s ILE 86 Ca 0.16 -0.71 0.09 0.00 0.00 0.00 0.00 60.65 60.19 2we3 s ILE 86 Cb -0.13 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.09 2we3 s ILE 86 CO 0.06 0.50 -0.20 -0.76 0.00 0.00 0.00 174.94 174.53 2we3 s LEU 87 N 0.89 2.36 0.13 2.97 1.43 0.91 -0.53 118.68 126.85 2we3 s LEU 87 Ca -0.03 -0.77 0.06 0.00 -1.03 0.00 0.00 54.13 52.36 2we3 s LEU 87 Cb -0.15 -0.89 -0.04 0.00 0.03 0.00 0.00 46.19 45.14 2we3 s LEU 87 CO -0.01 0.03 -0.14 -1.10 0.23 0.00 0.00 176.35 175.37 2we3 s GLN 88 N -2.30 1.06 -0.20 1.70 -1.52 0.68 -1.66 119.66 117.42 2we3 s GLN 88 Ca 0.11 -1.29 -0.10 0.00 -1.95 0.00 0.00 55.36 52.13 2we3 s GLN 88 Cb -0.08 -0.90 -0.05 0.00 -0.22 0.00 0.00 33.01 31.75 2we3 s GLN 88 CO 0.06 0.17 0.14 1.21 -0.25 0.00 0.00 175.29 176.61 2we3 s ASN 89 N -2.60 6.21 0.38 5.90 3.84 -1.26 -1.00 114.94 126.42 2we3 s ASN 89 Ca 0.11 0.23 0.25 0.00 0.21 0.00 0.00 52.86 53.67 2we3 s ASN 89 Cb -0.04 -2.09 0.66 0.00 -0.55 0.00 0.00 41.25 39.23 2we3 s ASN 89 CO 0.03 0.17 1.72 1.56 -2.79 0.00 0.00 177.10 177.79 2we3 h GLN 90 N 6.72 0.00 -6.21 0.43 4.20 -1.54 -3.43 115.11 115.27 2we3 h GLN 90 Ca -0.41 0.00 -0.47 0.00 0.06 0.00 0.00 58.65 57.83 2we3 h GLN 90 Cb 1.15 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.91 2we3 h GLN 90 CO 0.75 0.00 -0.44 1.03 -0.67 0.00 0.00 178.83 179.50 2we3 s ARG 91 N -3.26 3.22 0.00 1.46 1.81 -1.26 -5.02 118.95 115.89 2we3 s ARG 91 Ca 0.07 -0.91 0.29 0.00 -1.72 0.00 0.00 55.73 53.46 2we3 s ARG 91 Cb 0.08 -2.77 1.28 0.00 -0.45 0.00 0.00 34.95 33.08 2we3 s ARG 91 CO 0.61 0.34 1.92 0.54 -0.68 0.00 0.00 175.30 178.04 2we3 n ARG 92 N -1.39 0.22 -4.63 3.54 1.74 -1.26 -4.50 116.66 110.39 2we3 n ARG 92 Ca -0.07 -0.03 -0.29 0.00 -0.77 0.00 0.00 57.85 56.70 2we3 n ARG 92 Cb 0.58 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.42 2we3 n ARG 92 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 2we3 s TYR 93 N -2.79 2.07 0.28 -1.55 1.13 -1.26 -4.74 117.35 110.49 2we3 s TYR 93 Ca 0.20 -0.92 -0.30 0.00 -1.41 0.00 0.00 57.07 54.65 2we3 s TYR 93 Cb 0.19 -1.55 -0.13 0.00 -1.10 0.00 0.00 41.96 39.38 2we3 s TYR 93 CO 0.51 0.19 1.33 0.09 -2.51 0.00 0.00 175.55 175.16 2we3 n ASN 94 N -1.09 2.63 -4.42 -0.18 3.02 -1.26 -4.22 115.26 109.73 2we3 n ASN 94 Ca -0.10 1.17 -0.33 0.00 -0.03 0.00 0.00 54.58 55.29 2we3 n ASN 94 Cb 0.67 -1.43 -0.14 0.00 -0.61 0.00 0.00 39.78 38.26 2we3 n ASN 94 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2we3 s SER 95 N 0.01 3.91 -0.09 6.41 0.01 -0.34 -4.95 113.70 118.66 2we3 s SER 95 Ca 0.63 -0.27 -0.01 0.00 1.31 0.00 0.00 55.95 57.61 2we3 s SER 95 Cb -0.63 -1.03 -0.03 0.00 0.21 0.00 0.00 66.02 64.54 2we3 s SER 95 CO 0.55 0.29 -0.02 -0.89 0.41 0.00 0.00 173.24 173.58 2we3 s THR 96 N -0.39 4.13 -0.40 1.44 2.01 -1.26 0.69 115.64 121.85 2we3 s THR 96 Ca 0.04 -0.31 -0.06 0.00 0.31 0.00 0.00 61.69 61.67 2we3 s THR 96 Cb -0.12 -2.73 0.09 0.00 0.01 0.00 0.00 72.50 69.74 2we3 s THR 96 CO 0.02 0.59 0.21 -0.76 -0.69 0.00 0.00 174.62 173.99 2we3 s LEU 97 N -0.73 5.06 0.81 4.42 1.43 0.33 -4.93 118.68 125.07 2we3 s LEU 97 Ca 0.11 -1.71 -0.11 0.00 -1.03 0.00 0.00 54.13 51.39 2we3 s LEU 97 Cb -0.11 -1.89 0.08 0.00 0.03 0.00 0.00 46.19 44.30 2we3 s LEU 97 CO 0.02 -0.51 1.12 -0.13 0.23 0.00 0.00 176.35 177.08 2we3 s ARG 98 N 1.29 1.82 0.50 1.70 0.52 -1.26 -0.22 118.95 123.30 2we3 s ARG 98 Ca 0.04 1.37 -0.22 0.00 -0.52 0.00 0.00 55.73 56.41 2we3 s ARG 98 Cb -0.23 -1.83 -0.08 0.00 0.52 0.00 0.00 34.95 33.33 2we3 s ARG 98 CO -0.01 -2.00 1.05 -2.30 0.02 0.00 0.00 175.30 172.06 2we3 n PRO 99 N -3.65 1.29 0.00 3.54 -0.02 -1.26 -1.07 135.00 133.83 2we3 n PRO 99 Ca 0.11 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 2we3 n PRO 99 Cb 0.52 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 2we3 n PRO 99 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2we3 n SER 100 N -0.14 0.00 0.20 2.55 7.64 -0.06 -4.85 113.62 118.95 2we3 n SER 100 Ca 0.11 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.12 2we3 n SER 100 Cb 0.43 -0.46 0.43 0.00 -1.01 0.00 0.00 64.21 63.60 2we3 n SER 100 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2we3 h GLU 101 N 1.29 0.00 -5.05 1.43 5.08 -1.38 -3.43 114.58 112.52 2we3 h GLU 101 Ca 0.00 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.69 2we3 h GLU 101 Cb 0.00 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 28.93 2we3 h GLU 101 CO 0.00 0.00 -0.81 -1.17 -1.00 0.00 0.00 179.01 176.03 2we3 s LEU 102 N -5.55 2.40 -0.07 1.33 2.96 -1.26 -4.38 118.68 114.10 2we3 s LEU 102 Ca 0.05 -0.55 -0.03 0.00 -0.22 0.00 0.00 54.13 53.38 2we3 s LEU 102 Cb 0.08 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 45.17 2we3 s LEU 102 CO 0.57 0.00 0.06 -0.54 -1.32 0.00 0.00 176.35 175.12 2we3 s LYS 103 N 1.31 3.14 -0.19 1.98 1.02 -0.63 -2.53 119.74 123.84 2we3 s LYS 103 Ca 0.04 -0.35 0.01 0.00 0.02 0.00 0.00 55.97 55.70 2we3 s LYS 103 Cb -0.14 -2.93 0.03 0.00 -0.52 0.00 0.00 37.83 34.28 2we3 s LYS 103 CO -0.09 0.71 -0.16 0.42 -0.92 0.00 0.00 175.35 175.32 2we3 s ILE 104 N -1.01 1.94 -0.04 2.17 1.01 0.11 -0.41 121.20 124.97 2we3 s ILE 104 Ca 0.16 -1.04 0.01 0.00 0.00 0.00 0.00 60.65 59.79 2we3 s ILE 104 Cb -0.12 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.46 2we3 s ILE 104 CO 0.06 0.36 -0.05 -1.00 0.00 0.00 0.00 174.94 174.31 2we3 s HIS 105 N 1.30 2.98 -0.06 3.97 3.76 0.20 -0.31 115.29 127.13 2we3 s HIS 105 Ca 0.01 0.04 0.01 0.00 -0.15 0.00 0.00 55.06 54.97 2we3 s HIS 105 Cb -0.15 -1.68 0.02 0.00 1.11 0.00 0.00 32.58 31.88 2we3 s HIS 105 CO -0.10 0.39 -0.07 -1.17 -0.85 0.00 0.00 174.74 172.94 2we3 s LEU 106 N -1.14 1.33 0.10 0.89 2.96 0.40 -1.19 118.68 122.04 2we3 s LEU 106 Ca 0.15 -0.20 -0.15 0.00 -0.22 0.00 0.00 54.13 53.71 2we3 s LEU 106 Cb -0.11 -0.61 0.03 0.00 0.50 0.00 0.00 46.19 45.99 2we3 s LEU 106 CO 0.05 -0.05 0.37 0.00 -1.32 0.00 0.00 176.35 175.40 2we3 s ALA 107 N 1.05 -0.84 0.42 5.97 0.00 -0.86 -0.27 121.76 127.24 2we3 s ALA 107 Ca -0.08 -0.06 0.00 0.00 0.00 0.00 0.00 51.96 51.82 2we3 s ALA 107 Cb -0.14 0.59 -0.01 0.00 0.00 0.00 0.00 23.12 23.56 2we3 s ALA 107 CO -0.00 -0.58 0.64 0.00 0.00 0.00 0.00 175.76 175.81 2we3 s ALA 108 N -3.53 3.75 -0.09 0.00 0.00 -1.26 -0.39 121.76 120.24 2we3 s ALA 108 Ca 0.01 -1.02 -0.23 0.00 0.00 0.00 0.00 51.96 50.72 2we3 s ALA 108 Cb 0.02 -2.13 0.05 0.00 0.00 0.00 0.00 23.12 21.06 2we3 s ALA 108 CO -0.10 -0.28 0.55 -0.59 0.00 0.00 0.00 175.76 175.34 2we3 s PHE 109 N -2.49 -0.53 0.22 0.00 -0.12 -0.96 -1.14 117.98 112.96 2we3 s PHE 109 Ca 0.46 1.05 -0.21 0.00 -0.05 0.00 0.00 56.93 58.17 2we3 s PHE 109 Cb -0.10 0.27 -0.08 0.00 -0.63 0.00 0.00 43.02 42.48 2we3 s PHE 109 CO 0.37 -0.46 0.75 1.03 -0.05 0.00 0.00 175.22 176.87 2we3 s ARG 110 N -0.74 4.35 0.09 1.99 0.52 -1.26 -0.84 118.95 123.06 2we3 s ARG 110 Ca -0.08 0.97 -0.01 0.00 -0.52 0.00 0.00 55.73 56.08 2we3 s ARG 110 Cb -0.03 -2.96 -0.04 0.00 0.52 0.00 0.00 34.95 32.45 2we3 s ARG 110 CO 0.06 0.43 0.02 1.52 0.02 0.00 0.00 175.30 177.34 2we3 s TYR 111 N -1.45 0.70 0.20 -0.53 -0.85 -1.17 -1.99 117.35 112.26 2we3 s TYR 111 Ca 0.42 -1.15 0.10 0.00 -0.52 0.00 0.00 57.07 55.92 2we3 s TYR 111 Cb -0.18 -0.43 -0.04 0.00 0.38 0.00 0.00 41.96 41.68 2we3 s TYR 111 CO 0.22 -0.46 -0.21 0.00 -1.52 0.00 0.00 175.55 173.59 2we3 s ALA 112 N -3.99 2.34 -0.16 9.51 0.00 -0.99 -4.85 121.76 123.61 2we3 s ALA 112 Ca 0.16 -1.62 -0.02 0.00 0.00 0.00 0.00 51.96 50.48 2we3 s ALA 112 Cb 0.08 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.93 2we3 s ALA 112 CO -0.04 0.31 -0.08 0.99 0.00 0.00 0.00 175.76 176.95 2we3 s THR 113 N -2.01 3.38 0.70 0.00 2.01 -1.26 -4.23 115.64 114.22 2we3 s THR 113 Ca 0.20 -0.53 -0.11 0.00 0.31 0.00 0.00 61.69 61.57 2we3 s THR 113 Cb -0.06 -2.48 0.01 0.00 0.01 0.00 0.00 72.50 69.98 2we3 s THR 113 CO 0.09 0.49 1.06 -2.16 -0.69 0.00 0.00 174.62 173.41 2we3 s PRO 114 N 0.68 2.92 -0.99 4.92 0.04 -1.26 -5.17 135.00 136.14 2we3 s PRO 114 Ca -0.04 0.95 -0.19 0.00 0.04 0.00 0.00 61.00 61.76 2we3 s PRO 114 Cb -0.15 -1.99 0.12 0.00 0.04 0.00 0.00 34.50 32.52 2we3 s PRO 114 CO 0.02 -1.12 1.24 -0.65 0.04 0.00 0.00 177.00 176.53 2we3 s GLN 115 N -5.04 3.66 0.00 4.56 -0.21 -1.26 -5.21 119.66 116.16 2we3 s GLN 115 Ca 0.58 -1.73 0.00 0.00 0.02 0.00 0.00 55.36 54.23 2we3 s GLN 115 Cb -0.14 -5.03 0.00 0.00 1.00 0.00 0.00 33.01 28.84 2we3 s GLN 115 CO 0.55 -1.87 0.00 -2.30 -2.12 0.00 0.00 175.29 169.55 2we3 n PRO 129 N 6.94 0.00 -0.23 2.91 -0.02 -1.26 -5.05 135.00 138.30 2we3 n PRO 129 Ca 0.28 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 2we3 n PRO 129 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.97 2we3 n PRO 129 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2we3 n GLY 130 N 0.00 -0.50 2.52 -1.23 0.00 -1.26 -4.62 105.19 100.10 2we3 n GLY 130 Ca 0.00 -0.70 -0.30 0.00 0.00 0.00 0.00 46.02 45.02 2we3 n GLY 130 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2we3 n ASP 131 N 0.00 -3.19 0.06 1.61 8.00 -1.26 -4.60 116.55 117.17 2we3 n ASP 131 Ca 0.00 0.45 -0.20 0.00 0.71 0.00 0.00 54.79 55.75 2we3 n ASP 131 Cb 0.00 -0.66 -0.14 0.00 -0.02 0.00 0.00 41.12 40.31 2we3 n ASP 131 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2we3 h VAL 132 N -0.13 1.44 -2.12 2.53 2.07 -1.96 -3.48 116.25 114.60 2we3 h VAL 132 Ca -0.33 -2.45 -0.45 0.00 0.82 0.00 0.00 66.70 64.30 2we3 h VAL 132 Cb 1.12 2.99 0.00 0.00 -1.52 0.00 0.00 31.29 33.88 2we3 h VAL 132 CO 0.30 0.71 -0.34 -0.83 0.02 0.00 0.00 177.57 177.43 2we3 s GLY 133 N -4.37 1.42 -0.19 2.17 0.00 -1.26 -4.73 107.32 100.36 2we3 s GLY 133 Ca -0.12 -1.29 -0.03 0.00 0.00 0.00 0.00 44.72 43.28 2we3 s GLY 133 CO 0.86 -1.24 -0.07 -2.27 0.00 0.00 0.00 173.10 170.38 2we3 s LEU 134 N -4.14 2.83 0.35 0.66 2.96 0.00 -4.87 118.68 116.47 2we3 s LEU 134 Ca 0.41 -0.38 -0.27 0.00 -0.22 0.00 0.00 54.13 53.67 2we3 s LEU 134 Cb -0.09 -1.70 -0.09 0.00 0.50 0.00 0.00 46.19 44.81 2we3 s LEU 134 CO 0.31 0.04 1.13 -1.81 -1.32 0.00 0.00 176.35 174.70 2we3 s ASP 135 N 1.13 6.87 -0.13 3.68 1.01 -1.26 -0.50 116.67 127.47 2we3 s ASP 135 Ca 0.01 2.29 -0.02 0.00 0.71 0.00 0.00 52.55 55.54 2we3 s ASP 135 Cb -0.14 -2.62 -0.03 0.00 1.01 0.00 0.00 42.92 41.14 2we3 s ASP 135 CO -0.02 -0.42 -0.06 -0.69 0.21 0.00 0.00 175.17 174.19 2we3 s VAL 136 N -1.34 3.70 -0.02 -1.27 1.01 0.53 -4.88 120.40 118.13 2we3 s VAL 136 Ca 0.52 -0.44 -0.21 0.00 0.00 0.00 0.00 61.98 61.85 2we3 s VAL 136 Cb -0.30 -2.59 -0.05 0.00 0.00 0.00 0.00 36.38 33.44 2we3 s VAL 136 CO 0.39 0.52 0.62 -0.44 0.00 0.00 0.00 175.10 176.19 2we3 s SER 137 N 0.11 6.97 -0.02 3.32 0.01 -1.26 -1.34 113.70 121.48 2we3 s SER 137 Ca -0.02 1.16 -0.30 0.00 1.31 0.00 0.00 55.95 58.10 2we3 s SER 137 Cb -0.14 -2.38 -0.05 0.00 0.21 0.00 0.00 66.02 63.66 2we3 s SER 137 CO 0.03 0.04 1.45 -0.76 0.41 0.00 0.00 173.24 174.41 2we3 s LEU 138 N 0.11 4.31 0.00 2.44 1.43 -0.19 -4.83 118.68 121.94 2we3 s LEU 138 Ca 0.33 2.11 0.26 0.00 -1.03 0.00 0.00 54.13 55.80 2we3 s LEU 138 Cb -0.18 -3.55 1.32 0.00 0.03 0.00 0.00 46.19 43.81 2we3 s LEU 138 CO 0.17 -0.77 1.88 -0.81 0.23 0.00 0.00 176.35 177.05 2we3 n PRO 139 N 5.83 0.39 -3.87 1.29 -0.04 -1.26 0.83 135.00 138.18 2we3 n PRO 139 Ca 0.14 0.04 -0.09 0.00 -0.04 0.00 0.00 63.50 63.55 2we3 n PRO 139 Cb 0.43 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.33 2we3 n PRO 139 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 2we3 s LYS 140 N -2.54 1.02 0.52 0.54 -2.85 -1.26 -4.88 119.74 110.28 2we3 s LYS 140 Ca 0.25 -1.02 -0.21 0.00 -1.00 0.00 0.00 55.97 54.00 2we3 s LYS 140 Cb 0.17 0.38 -0.06 0.00 -2.06 0.00 0.00 37.83 36.26 2we3 s LYS 140 CO 0.39 -0.36 1.17 -0.51 0.10 0.00 0.00 175.35 176.13 2we3 s ASP 141 N -2.90 5.81 -0.03 0.03 1.01 -1.26 -3.63 116.67 115.69 2we3 s ASP 141 Ca 0.10 2.28 -0.01 0.00 0.71 0.00 0.00 52.55 55.63 2we3 s ASP 141 Cb 0.04 -2.59 0.03 0.00 1.01 0.00 0.00 42.92 41.40 2we3 s ASP 141 CO -0.06 -1.16 0.06 -0.22 0.21 0.00 0.00 175.17 173.99 2we3 s LEU 142 N -3.51 0.55 -0.10 1.23 0.20 0.50 -4.89 118.68 112.66 2we3 s LEU 142 Ca 0.70 0.09 -0.02 0.00 0.69 0.00 0.00 54.13 55.59 2we3 s LEU 142 Cb -0.27 -0.07 -0.03 0.00 -0.43 0.00 0.00 46.19 45.39 2we3 s LEU 142 CO 0.32 -0.19 -0.02 0.00 -0.29 0.00 0.00 176.35 176.16 2we3 s ALA 143 N 1.67 3.17 -0.14 5.97 0.00 -1.26 0.15 121.76 131.33 2we3 s ALA 143 Ca -0.02 -0.83 -0.02 0.00 0.00 0.00 0.00 51.96 51.10 2we3 s ALA 143 Cb -0.12 -1.45 0.04 0.00 0.00 0.00 0.00 23.12 21.58 2we3 s ALA 143 CO -0.03 0.50 -0.01 -0.51 0.00 0.00 0.00 175.76 175.71 2we3 s LEU 144 N -0.60 1.08 0.68 0.00 1.02 0.14 -4.96 118.68 116.05 2we3 s LEU 144 Ca 0.10 -0.48 -0.11 0.00 0.02 0.00 0.00 54.13 53.66 2we3 s LEU 144 Cb -0.12 -0.64 -0.00 0.00 0.02 0.00 0.00 46.19 45.45 2we3 s LEU 144 CO 0.02 -0.22 1.06 0.72 0.02 0.00 0.00 176.35 177.95 2we3 s PHE 145 N 1.83 3.23 0.12 0.29 -0.71 -1.26 0.85 117.98 122.33 2we3 s PHE 145 Ca 0.02 1.36 -0.35 0.00 -1.04 0.00 0.00 56.93 56.92 2we3 s PHE 145 Cb -0.15 -2.86 -0.16 0.00 -1.21 0.00 0.00 43.02 38.64 2we3 s PHE 145 CO -0.07 -1.13 1.32 -2.30 -1.34 0.00 0.00 175.22 171.70 2we3 n PRO 146 N -3.05 1.26 -1.06 1.99 -0.02 -1.23 -1.52 135.00 131.36 2we3 n PRO 146 Ca 0.07 0.45 -0.02 0.00 -2.02 0.00 0.00 63.50 61.98 2we3 n PRO 146 Cb 0.54 -2.07 -0.01 0.00 -0.02 0.00 0.00 33.50 31.94 2we3 n PRO 146 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2we3 n HIS 147 N 2.34 0.00 -2.88 6.00 8.25 0.12 -5.00 115.22 124.05 2we3 n HIS 147 Ca 0.17 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.24 2we3 n HIS 147 Cb 0.21 -1.51 -0.06 0.00 1.12 0.00 0.00 29.99 29.76 2we3 n HIS 147 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2we3 s GLN 148 N -1.61 4.69 -0.20 -0.41 0.74 -0.58 -4.78 119.66 117.51 2we3 s GLN 148 Ca 0.00 1.30 -0.07 0.00 0.05 0.00 0.00 55.36 56.64 2we3 s GLN 148 Cb 0.00 -3.28 -0.04 0.00 1.10 0.00 0.00 33.01 30.79 2we3 s GLN 148 CO 0.00 0.52 0.06 0.99 -0.55 0.00 0.00 175.29 176.32 2we3 s THR 149 N -1.06 4.64 0.14 -0.34 2.01 -1.26 -0.91 115.64 118.86 2we3 s THR 149 Ca 0.38 -0.08 0.02 0.00 0.31 0.00 0.00 61.69 62.32 2we3 s THR 149 Cb -0.24 -3.11 -0.04 0.00 0.01 0.00 0.00 72.50 69.11 2we3 s THR 149 CO 0.29 0.42 -0.02 0.54 -0.69 0.00 0.00 174.62 175.16 2we3 s VAL 150 N 0.74 0.65 0.14 3.82 0.11 0.31 -4.97 120.40 121.19 2we3 s VAL 150 Ca 0.03 -1.96 0.08 0.00 -2.93 0.00 0.00 61.98 57.21 2we3 s VAL 150 Cb -0.13 -1.94 -0.04 0.00 -1.53 0.00 0.00 36.38 32.74 2we3 s VAL 150 CO 0.02 -0.64 -0.19 -0.94 -3.33 0.00 0.00 175.10 170.02 2we3 s SER 151 N -3.11 2.63 -0.14 3.54 1.04 -1.26 0.55 113.70 116.94 2we3 s SER 151 Ca 0.19 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.82 2we3 s SER 151 Cb 0.06 -0.15 0.02 0.00 0.10 0.00 0.00 66.02 66.05 2we3 s SER 151 CO 0.00 -0.00 -0.13 -0.69 0.98 0.00 0.00 173.24 173.40 2we3 s VAL 152 N -1.73 1.51 -0.08 5.02 1.01 0.26 -4.90 120.40 121.50 2we3 s VAL 152 Ca 0.12 -0.59 -0.25 0.00 0.00 0.00 0.00 61.98 61.26 2we3 s VAL 152 Cb -0.07 -1.43 -0.03 0.00 0.00 0.00 0.00 36.38 34.85 2we3 s VAL 152 CO 0.06 0.45 0.80 -0.89 0.00 0.00 0.00 175.10 175.51 2we3 s THR 153 N 1.50 4.96 -0.14 3.92 2.01 -1.26 -1.15 115.64 125.49 2we3 s THR 153 Ca 0.05 1.63 -0.01 0.00 0.31 0.00 0.00 61.69 63.67 2we3 s THR 153 Cb -0.13 -4.13 -0.02 0.00 0.01 0.00 0.00 72.50 68.24 2we3 s THR 153 CO -0.10 0.16 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.12 2we3 s LEU 154 N 1.26 2.80 -0.14 4.42 1.43 0.75 -4.97 118.68 124.23 2we3 s LEU 154 Ca 0.41 -0.30 -0.05 0.00 -1.03 0.00 0.00 54.13 53.16 2we3 s LEU 154 Cb -0.18 -1.64 -0.07 0.00 0.03 0.00 0.00 46.19 44.33 2we3 s LEU 154 CO 0.18 0.16 -0.16 1.07 0.23 0.00 0.00 176.35 177.83 2we3 n THR 155 N 3.56 0.77 -2.08 5.49 5.66 -1.26 -0.81 114.28 125.61 2we3 n THR 155 Ca -0.18 -0.23 -0.43 0.00 -3.05 0.00 0.00 64.05 60.17 2we3 n THR 155 Cb 0.53 -1.47 -0.03 0.00 -1.55 0.00 0.00 70.33 67.81 2we3 n THR 155 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2we3 s VAL 156 N -2.26 3.66 0.30 1.08 1.01 -1.26 -4.53 120.40 118.40 2we3 s VAL 156 Ca -0.19 0.76 -0.29 0.00 0.00 0.00 0.00 61.98 62.26 2we3 s VAL 156 Cb 0.07 -3.62 -0.11 0.00 0.00 0.00 0.00 36.38 32.72 2we3 s VAL 156 CO 0.27 -0.21 1.49 -2.84 0.00 0.00 0.00 175.10 173.81 2we3 s PRO 157 N 4.51 4.19 0.75 2.72 0.02 -1.26 -5.00 135.00 140.93 2we3 s PRO 157 Ca 0.72 2.45 -0.11 0.00 0.02 0.00 0.00 61.00 64.08 2we3 s PRO 157 Cb -0.27 -3.05 0.04 0.00 0.02 0.00 0.00 34.50 31.24 2we3 s PRO 157 CO 0.29 -0.50 1.08 -1.25 -0.33 0.00 0.00 177.00 176.29 2we3 s PRO 158 N -0.89 2.45 0.24 5.54 0.04 -1.26 -4.95 135.00 136.18 2we3 s PRO 158 Ca 0.59 0.89 -0.31 0.00 0.04 0.00 0.00 61.00 62.20 2we3 s PRO 158 Cb -0.45 -1.94 -0.12 0.00 0.04 0.00 0.00 34.50 32.03 2we3 s PRO 158 CO 0.50 -1.42 1.62 -2.30 0.04 0.00 0.00 177.00 175.44 2we3 n PRO 159 N -3.34 2.60 -2.05 0.56 -0.02 -1.26 -4.94 135.00 126.55 2we3 n PRO 159 Ca 0.08 0.93 -0.41 0.00 -2.02 0.00 0.00 63.50 62.08 2we3 n PRO 159 Cb 0.54 -2.72 -0.02 0.00 -0.02 0.00 0.00 33.50 31.28 2we3 n PRO 159 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2we3 s SER 160 N 0.77 6.69 -0.13 2.55 0.15 -1.26 -5.03 113.70 117.45 2we3 s SER 160 Ca 0.70 2.67 0.02 0.00 0.70 0.00 0.00 55.95 60.05 2we3 s SER 160 Cb -0.54 -2.63 0.01 0.00 -1.71 0.00 0.00 66.02 61.15 2we3 s SER 160 CO 0.41 -0.65 -0.20 -0.63 1.20 0.00 0.00 173.24 173.37 2we3 s ILE 161 N -0.37 1.91 0.10 6.45 1.01 -1.26 -5.09 121.20 123.96 2we3 s ILE 161 Ca 0.56 -0.89 -0.31 0.00 0.00 0.00 0.00 60.65 60.00 2we3 s ILE 161 Cb -0.41 -1.70 -0.11 0.00 0.01 0.00 0.00 42.46 40.26 2we3 s ILE 161 CO 0.46 0.52 1.85 -2.65 0.00 0.00 0.00 174.94 175.13 2we3 n PRO 162 N 4.05 2.77 -0.56 2.79 -0.02 -1.26 -2.07 135.00 140.69 2we3 n PRO 162 Ca -0.20 1.01 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 2we3 n PRO 162 Cb 0.52 -2.91 0.00 0.00 -0.02 0.00 0.00 33.50 31.09 2we3 n PRO 162 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2we3 n HIS 163 N 5.88 0.00 -4.26 6.00 8.25 -1.26 -5.04 115.22 124.79 2we3 n HIS 163 Ca 0.18 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.46 2we3 n HIS 163 Cb 0.37 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.37 2we3 n HIS 163 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2we3 s HIS 164 N -2.09 1.48 -0.11 4.41 3.76 -0.88 -1.06 115.29 120.79 2we3 s HIS 164 Ca 0.00 -0.53 0.02 0.00 -0.15 0.00 0.00 55.06 54.39 2we3 s HIS 164 Cb 0.00 -0.77 0.01 0.00 1.11 0.00 0.00 32.58 32.94 2we3 s HIS 164 CO 0.00 0.17 -0.17 1.03 -0.85 0.00 0.00 174.74 174.93 2we3 s ARG 165 N -2.64 2.39 0.21 1.40 1.81 0.11 -4.68 118.95 117.54 2we3 s ARG 165 Ca 0.10 -0.62 -0.30 0.00 -1.72 0.00 0.00 55.73 53.18 2we3 s ARG 165 Cb -0.05 -1.99 -0.09 0.00 -0.45 0.00 0.00 34.95 32.37 2we3 s ARG 165 CO 0.04 -0.04 1.33 -1.25 -0.68 0.00 0.00 175.30 174.70 2we3 s PRO 166 N 0.91 4.37 0.00 3.54 0.04 -1.26 -0.52 135.00 142.08 2we3 s PRO 166 Ca -0.07 2.10 -0.05 0.00 0.04 0.00 0.00 61.00 63.01 2we3 s PRO 166 Cb -0.15 -3.18 -0.00 0.00 0.04 0.00 0.00 34.50 31.21 2we3 s PRO 166 CO -0.01 -0.28 0.09 0.95 0.04 0.00 0.00 177.00 177.79 2we3 s THR 167 N 0.08 0.08 -0.17 1.26 -4.23 0.18 -1.21 115.64 111.64 2we3 s THR 167 Ca 0.57 -0.68 -0.04 0.00 -1.18 0.00 0.00 61.69 60.35 2we3 s THR 167 Cb -0.37 -0.36 -0.03 0.00 1.34 0.00 0.00 72.50 73.08 2we3 s THR 167 CO 0.39 -0.37 -0.02 -0.63 -0.54 0.00 0.00 174.62 173.45 2we3 s ILE 168 N -1.26 4.01 0.34 2.99 -1.09 0.79 -0.63 121.20 126.34 2we3 s ILE 168 Ca -0.14 -0.31 0.09 0.00 -2.23 0.00 0.00 60.65 58.07 2we3 s ILE 168 Cb -0.08 -2.78 -0.06 0.00 -1.58 0.00 0.00 42.46 37.96 2we3 s ILE 168 CO 0.01 0.47 -0.10 -0.36 -1.23 0.00 0.00 174.94 173.73 2we3 s PHE 169 N 0.54 2.37 0.69 3.97 0.40 -0.58 -1.73 117.98 123.65 2we3 s PHE 169 Ca -0.02 -0.51 -0.05 0.00 -0.60 0.00 0.00 56.93 55.76 2we3 s PHE 169 Cb -0.14 -1.35 0.08 0.00 0.51 0.00 0.00 43.02 42.12 2we3 s PHE 169 CO 0.02 0.57 0.98 0.20 0.70 0.00 0.00 175.22 177.70 2we3 s GLY 170 N -3.59 1.74 0.04 4.36 0.00 -1.26 -1.42 107.32 107.19 2we3 s GLY 170 Ca 0.32 -1.16 0.02 0.00 0.00 0.00 0.00 44.72 43.90 2we3 s GLY 170 CO 0.16 -0.73 0.05 0.50 0.00 0.00 0.00 173.10 173.08 2we3 s ARG 171 N -5.17 2.85 0.23 2.90 0.52 -1.26 -4.68 118.95 114.34 2we3 s ARG 171 Ca 0.62 -0.65 -0.05 0.00 -0.52 0.00 0.00 55.73 55.13 2we3 s ARG 171 Cb -0.09 -2.72 0.24 0.00 0.52 0.00 0.00 34.95 32.90 2we3 s ARG 171 CO 0.44 0.59 1.75 0.77 0.02 0.00 0.00 175.30 178.88 2we3 h SER 172 N 3.74 0.94 -0.06 0.23 0.02 -1.97 -2.14 113.55 114.31 2we3 h SER 172 Ca -0.48 -0.20 0.04 0.00 -0.84 0.00 0.00 61.79 60.31 2we3 h SER 172 Cb 1.17 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 63.42 2we3 h SER 172 CO 0.62 0.92 -0.19 1.23 -1.14 0.00 0.00 176.83 178.28 2we3 h GLY 173 N 1.04 -0.20 0.99 -3.77 0.00 -1.97 0.24 103.07 99.39 2we3 h GLY 173 Ca 0.20 0.23 -0.03 0.00 0.00 0.00 0.00 47.33 47.72 2we3 h GLY 173 CO 0.01 -0.17 0.25 1.41 0.00 0.00 0.00 176.54 178.03 2we3 h LEU 174 N -0.27 0.78 -0.50 3.11 3.38 -1.86 -2.67 115.31 117.28 2we3 h LEU 174 Ca 0.08 -0.15 0.09 0.00 0.09 0.00 0.00 57.88 57.99 2we3 h LEU 174 Cb 0.38 -0.20 -0.08 0.00 0.09 0.00 0.00 40.66 40.85 2we3 h LEU 174 CO -0.22 0.72 0.03 0.00 0.09 0.00 0.00 178.44 179.07 2we3 h ALA 175 N 1.09 0.51 -0.64 1.53 0.00 -1.01 -0.39 119.26 120.36 2we3 h ALA 175 Ca 0.20 0.14 0.14 0.00 0.00 0.00 0.00 54.91 55.39 2we3 h ALA 175 Cb 0.17 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 2we3 h ALA 175 CO -0.02 -0.36 0.44 0.52 0.00 0.00 0.00 179.25 179.82 2we3 h MET 176 N 0.15 0.22 0.00 0.00 2.86 -0.19 0.14 114.93 118.11 2we3 h MET 176 Ca 0.25 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 2we3 h MET 176 Cb 0.37 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.98 2we3 h MET 176 CO -0.39 0.15 0.00 1.04 1.06 0.00 0.00 176.91 178.77 2we3 n GLN 177 N -4.43 0.20 -0.03 1.72 6.02 -0.23 -4.66 117.38 115.97 2we3 n GLN 177 Ca 0.12 0.07 0.00 0.00 -0.01 0.00 0.00 57.00 57.18 2we3 n GLN 177 Cb 0.54 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.30 2we3 n GLN 177 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2we3 n GLY 178 N 0.86 0.85 3.52 1.08 0.00 0.48 -4.62 105.19 107.36 2we3 n GLY 178 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2we3 n GLY 178 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2we3 s ILE 179 N -2.02 5.27 -0.05 -0.61 -1.09 -0.74 -0.06 121.20 121.91 2we3 s ILE 179 Ca 0.00 -0.25 -0.02 0.00 -2.23 0.00 0.00 60.65 58.15 2we3 s ILE 179 Cb 0.00 -3.76 -0.04 0.00 -1.58 0.00 0.00 42.46 37.08 2we3 s ILE 179 CO 0.00 -0.07 0.07 -0.76 -1.23 0.00 0.00 174.94 172.95 2we3 s LEU 180 N 1.76 3.90 -0.16 2.97 1.43 -0.73 -2.48 118.68 125.37 2we3 s LEU 180 Ca 0.07 0.21 -0.08 0.00 -1.03 0.00 0.00 54.13 53.30 2we3 s LEU 180 Cb -0.18 -2.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.89 2we3 s LEU 180 CO 0.11 0.33 0.10 -0.69 0.23 0.00 0.00 176.35 176.42 2we3 s VAL 181 N -1.08 5.15 -0.21 -1.59 1.01 -1.26 -1.29 120.40 121.14 2we3 s VAL 181 Ca 0.19 0.09 -0.29 0.00 0.00 0.00 0.00 61.98 61.97 2we3 s VAL 181 Cb -0.12 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 32.97 2we3 s VAL 181 CO 0.09 0.51 1.08 -0.75 0.00 0.00 0.00 175.10 176.03 2we3 s LYS 182 N -0.12 4.27 0.42 2.72 2.36 -0.85 -4.47 119.74 124.06 2we3 s LYS 182 Ca 0.09 1.42 -0.26 0.00 -2.55 0.00 0.00 55.97 54.67 2we3 s LYS 182 Cb -0.12 -3.65 -0.10 0.00 -1.05 0.00 0.00 37.83 32.91 2we3 s LYS 182 CO 0.01 -0.62 1.40 -2.30 1.55 0.00 0.00 175.35 175.38 2we3 n PRO 183 N 6.25 2.27 -3.53 4.03 -0.02 -1.26 -4.68 135.00 138.07 2we3 n PRO 183 Ca 0.12 0.80 -0.13 0.00 -2.02 0.00 0.00 63.50 62.28 2we3 n PRO 183 Cb 0.46 -2.55 -0.04 0.00 -0.02 0.00 0.00 33.50 31.35 2we3 n PRO 183 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2we3 s ARG 185 N -3.11 4.65 -0.88 0.00 3.52 -1.26 -0.15 118.95 121.72 2we3 s ARG 185 Ca -0.02 1.70 -0.16 0.00 -0.13 0.00 0.00 55.73 57.13 2we3 s ARG 185 Cb -0.00 -3.25 0.18 0.00 -1.56 0.00 0.00 34.95 30.32 2we3 s ARG 185 CO -0.07 0.19 0.93 -0.46 -0.81 0.00 0.00 175.30 175.08 2we3 s TRP 186 N -0.66 3.50 0.59 5.12 -0.11 -0.35 -4.87 118.94 122.15 2we3 s TRP 186 Ca 0.46 -1.75 -0.14 0.00 1.22 0.00 0.00 56.10 55.89 2we3 s TRP 186 Cb -0.30 -4.02 -0.04 0.00 -1.50 0.00 0.00 33.47 27.61 2we3 s TRP 186 CO 0.36 -1.21 1.03 1.03 -4.62 0.00 0.00 176.95 173.55 2we3 s ARG 187 N 1.23 3.52 0.47 5.86 0.52 -1.26 -4.66 118.95 124.64 2we3 s ARG 187 Ca 0.25 1.00 0.21 0.00 -0.52 0.00 0.00 55.73 56.67 2we3 s ARG 187 Cb -0.08 -2.07 1.22 0.00 0.52 0.00 0.00 34.95 34.55 2we3 s ARG 187 CO -0.09 -0.63 1.92 0.00 0.02 0.00 0.00 175.30 176.52 2we3 h ARG 188 N 0.30 0.23 0.00 3.54 3.08 -1.99 0.14 114.38 119.68 2we3 h ARG 188 Ca -0.46 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.58 2we3 h ARG 188 Cb 1.20 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.20 2we3 h ARG 188 CO 0.59 0.15 0.00 0.41 -1.07 0.00 0.00 179.97 180.05 2we3 n GLY 189 N -1.59 -0.99 0.00 0.04 0.00 -1.26 -4.85 105.19 96.54 2we3 n GLY 189 Ca 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2we3 n GLY 189 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2we3 n GLY 190 N 0.62 2.22 3.14 -0.02 0.00 0.49 -4.95 105.19 106.68 2we3 n GLY 190 Ca 0.06 -2.06 -0.19 0.00 0.00 0.00 0.00 46.02 43.82 2we3 n GLY 190 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2we3 s VAL 191 N -2.19 1.06 -0.44 1.61 0.11 0.01 -4.14 120.40 116.42 2we3 s VAL 191 Ca 0.00 -1.03 -0.08 0.00 -2.93 0.00 0.00 61.98 57.94 2we3 s VAL 191 Cb 0.00 -0.98 0.11 0.00 -1.53 0.00 0.00 36.38 33.98 2we3 s VAL 191 CO 0.00 -0.05 0.29 -1.81 -3.33 0.00 0.00 175.10 170.20 2we3 s ASP 192 N -1.23 5.59 -0.36 3.54 1.01 -1.26 -0.18 116.67 123.77 2we3 s ASP 192 Ca 0.00 -1.84 -0.24 0.00 0.71 0.00 0.00 52.55 51.18 2we3 s ASP 192 Cb -0.08 -1.96 0.01 0.00 1.01 0.00 0.00 42.92 41.89 2we3 s ASP 192 CO 0.01 -0.63 0.81 -0.69 0.21 0.00 0.00 175.17 174.89 2we3 s VAL 193 N 1.33 4.71 -0.20 -1.27 1.01 -0.30 -4.82 120.40 120.86 2we3 s VAL 193 Ca 0.05 0.96 -0.24 0.00 0.00 0.00 0.00 61.98 62.76 2we3 s VAL 193 Cb -0.25 -4.23 -0.01 0.00 0.00 0.00 0.00 36.38 31.89 2we3 s VAL 193 CO -0.01 -0.44 0.78 -0.55 0.00 0.00 0.00 175.10 174.88 2we3 s SER 194 N 1.83 6.85 -0.04 3.32 0.15 -1.26 -0.57 113.70 123.98 2we3 s SER 194 Ca 0.33 1.04 0.04 0.00 0.70 0.00 0.00 55.95 58.06 2we3 s SER 194 Cb -0.13 -2.42 -0.03 0.00 -1.71 0.00 0.00 66.02 61.73 2we3 s SER 194 CO 0.17 -0.41 -0.15 -0.76 1.20 0.00 0.00 173.24 173.30 2we3 s LEU 195 N 2.32 2.71 -0.09 3.45 1.43 0.19 -2.01 118.68 126.67 2we3 s LEU 195 Ca 0.35 -0.23 0.03 0.00 -1.03 0.00 0.00 54.13 53.24 2we3 s LEU 195 Cb -0.16 -1.55 0.01 0.00 0.03 0.00 0.00 46.19 44.52 2we3 s LEU 195 CO 0.10 0.33 -0.17 -0.89 0.23 0.00 0.00 176.35 175.96 2we3 s THR 196 N -0.76 1.53 -0.50 5.49 2.01 -0.41 -0.53 115.64 122.47 2we3 s THR 196 Ca 0.12 -0.69 -0.21 0.00 0.31 0.00 0.00 61.69 61.22 2we3 s THR 196 Cb -0.11 -1.37 0.04 0.00 0.01 0.00 0.00 72.50 71.08 2we3 s THR 196 CO 0.01 0.44 0.73 0.21 -0.69 0.00 0.00 174.62 175.32 2we3 s ASN 197 N 0.70 6.29 0.00 3.53 2.47 -0.09 -1.77 114.94 126.07 2we3 s ASN 197 Ca -0.13 -0.56 0.22 0.00 0.42 0.00 0.00 52.86 52.82 2we3 s ASN 197 Cb -0.16 -2.34 0.58 0.00 -1.45 0.00 0.00 41.25 37.88 2we3 s ASN 197 CO 0.03 -0.96 1.47 0.49 -3.72 0.00 0.00 177.10 174.42 2we3 n PHE 198 N 6.59 0.30 -2.60 0.43 3.01 0.92 0.11 117.46 126.21 2we3 n PHE 198 Ca -0.02 -0.15 -0.22 0.00 1.01 0.00 0.00 57.45 58.07 2we3 n PHE 198 Cb 0.47 0.00 0.05 0.00 -0.01 0.00 0.00 39.48 39.99 2we3 n PHE 198 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2we3 s SER 199 N -1.59 5.08 0.00 4.37 1.04 -1.26 -3.84 113.70 117.50 2we3 s SER 199 Ca 0.35 -0.05 0.23 0.00 0.48 0.00 0.00 55.95 56.95 2we3 s SER 199 Cb 0.20 -0.73 0.93 0.00 0.10 0.00 0.00 66.02 66.52 2we3 s SER 199 CO 0.29 -1.30 1.65 -0.90 0.98 0.00 0.00 173.24 173.96 2we3 n ASP 200 N -2.46 1.30 -4.73 7.02 5.68 -1.22 -3.87 116.55 118.27 2we3 n ASP 200 Ca 0.09 -1.58 -0.28 0.00 -0.50 0.00 0.00 54.79 52.52 2we3 n ASP 200 Cb 0.60 -0.06 -0.07 0.00 -1.14 0.00 0.00 41.12 40.45 2we3 n ASP 200 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 2we3 s GLN 201 N -1.88 2.67 -0.12 0.11 -1.52 -1.26 -4.78 119.66 112.89 2we3 s GLN 201 Ca 0.34 -0.88 -0.30 0.00 -1.95 0.00 0.00 55.36 52.58 2we3 s GLN 201 Cb 0.18 -2.56 -0.02 0.00 -0.22 0.00 0.00 33.01 30.39 2we3 s GLN 201 CO 0.28 0.51 1.13 0.99 -0.25 0.00 0.00 175.29 177.95 2we3 s THR 202 N -1.53 4.48 -0.20 -0.19 2.01 -1.26 -3.55 115.64 115.41 2we3 s THR 202 Ca 0.28 1.78 -0.08 0.00 0.31 0.00 0.00 61.69 63.98 2we3 s THR 202 Cb -0.11 -4.15 -0.04 0.00 0.01 0.00 0.00 72.50 68.21 2we3 s THR 202 CO 0.20 -0.05 0.08 -0.69 -0.69 0.00 0.00 174.62 173.47 2we3 s VAL 203 N 2.53 4.86 -0.29 3.82 1.01 0.25 -4.89 120.40 127.69 2we3 s VAL 203 Ca 0.52 -0.00 -0.08 0.00 0.00 0.00 0.00 61.98 62.41 2we3 s VAL 203 Cb -0.21 -3.21 -0.00 0.00 0.00 0.00 0.00 36.38 32.96 2we3 s VAL 203 CO 0.17 0.43 0.10 -0.36 0.00 0.00 0.00 175.10 175.44 2we3 s PHE 204 N 0.61 3.14 -0.25 5.22 0.40 -1.26 0.26 117.98 126.11 2we3 s PHE 204 Ca 0.04 -0.73 -0.08 0.00 -0.60 0.00 0.00 56.93 55.56 2we3 s PHE 204 Cb -0.13 -2.28 -0.04 0.00 0.51 0.00 0.00 43.02 41.09 2we3 s PHE 204 CO 0.01 -0.49 0.10 -0.51 0.70 0.00 0.00 175.22 175.03 2we3 s LEU 205 N 1.56 3.64 0.32 -0.37 1.43 0.40 -4.97 118.68 120.69 2we3 s LEU 205 Ca 0.04 -0.12 -0.28 0.00 -1.03 0.00 0.00 54.13 52.74 2we3 s LEU 205 Cb -0.17 -1.98 -0.09 0.00 0.03 0.00 0.00 46.19 43.98 2we3 s LEU 205 CO 0.04 -0.02 1.09 0.20 0.23 0.00 0.00 176.35 177.89 2we3 s ASN 206 N 1.52 7.08 0.14 2.29 0.01 -1.26 -0.37 114.94 124.35 2we3 s ASN 206 Ca 0.06 2.22 -0.31 0.00 -0.71 0.00 0.00 52.86 54.12 2we3 s ASN 206 Cb -0.15 -2.62 -0.18 0.00 0.41 0.00 0.00 41.25 38.72 2we3 s ASN 206 CO 0.05 -0.27 0.67 1.17 -1.51 0.00 0.00 177.10 177.21 2we3 n LYS 207 N 0.78 0.00 -0.53 -0.60 4.81 -1.24 -1.16 118.16 120.22 2we3 n LYS 207 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.45 2we3 n LYS 207 Cb 0.46 -1.13 0.00 0.00 0.02 0.00 0.00 35.03 34.38 2we3 n LYS 207 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2we3 n TYR 208 N 0.41 0.00 -1.82 5.64 0.53 0.24 -4.94 117.16 117.23 2we3 n TYR 208 Ca 0.18 0.00 -0.42 0.00 -1.02 0.00 0.00 57.90 56.65 2we3 n TYR 208 Cb 0.20 -0.21 -0.02 0.00 -1.03 0.00 0.00 39.34 38.28 2we3 n TYR 208 CO 0.00 0.00 0.00 0.50 -1.02 0.00 0.00 176.86 176.34 2we3 s ARG 209 N -0.09 4.16 -0.72 -0.72 3.52 -0.31 -4.42 118.95 120.36 2we3 s ARG 209 Ca 0.00 2.52 -0.26 0.00 -0.13 0.00 0.00 55.73 57.86 2we3 s ARG 209 Cb 0.00 -3.07 -0.01 0.00 -1.56 0.00 0.00 34.95 30.31 2we3 s ARG 209 CO 0.00 -0.64 1.73 1.03 -0.81 0.00 0.00 175.30 176.61 2we3 s ARG 210 N 0.35 2.79 0.00 5.12 3.00 -1.26 -1.02 118.95 127.92 2we3 s ARG 210 Ca 0.68 0.16 0.20 0.00 0.00 0.00 0.00 55.73 56.76 2we3 s ARG 210 Cb -0.47 -4.54 0.06 0.00 0.00 0.00 0.00 34.95 30.00 2we3 s ARG 210 CO 0.39 -2.70 1.04 1.97 0.00 0.00 0.00 175.30 176.00 2we3 n PHE 211 N 12.06 0.00 -3.67 -0.53 1.16 -0.45 -4.85 117.46 121.17 2we3 n PHE 211 Ca 0.21 0.00 -0.01 0.00 -1.87 0.00 0.00 57.45 55.79 2we3 n PHE 211 Cb 0.50 0.00 0.01 0.00 -1.61 0.00 0.00 39.48 38.38 2we3 n PHE 211 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2we3 s GLN 213 N -2.02 0.20 -0.19 0.00 -2.07 -0.50 -0.35 119.66 114.73 2we3 s GLN 213 Ca 0.09 -0.31 -0.13 0.00 -1.82 0.00 0.00 55.36 53.19 2we3 s GLN 213 Cb -0.01 -0.02 -0.05 0.00 -1.09 0.00 0.00 33.01 31.84 2we3 s GLN 213 CO 0.01 -0.00 0.24 -1.17 -1.32 0.00 0.00 175.29 173.05 2we3 s LEU 214 N -0.70 4.19 -0.11 2.60 2.96 0.34 -1.53 118.68 126.44 2we3 s LEU 214 Ca -0.07 0.36 0.02 0.00 -0.22 0.00 0.00 54.13 54.22 2we3 s LEU 214 Cb -0.05 -2.27 0.01 0.00 0.50 0.00 0.00 46.19 44.38 2we3 s LEU 214 CO -0.00 0.08 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.27 2we3 s VAL 215 N 0.70 1.51 -0.68 1.68 1.01 0.20 -0.82 120.40 124.00 2we3 s VAL 215 Ca 0.13 -0.65 -0.22 0.00 0.00 0.00 0.00 61.98 61.24 2we3 s VAL 215 Cb -0.13 -1.37 0.08 0.00 0.00 0.00 0.00 36.38 34.95 2we3 s VAL 215 CO 0.03 0.44 0.97 -0.31 0.00 0.00 0.00 175.10 176.23 2we3 s TYR 216 N 0.95 2.71 0.16 5.22 1.51 -1.26 -0.64 117.35 126.00 2we3 s TYR 216 Ca -0.07 -0.62 -0.26 0.00 -1.01 0.00 0.00 57.07 55.10 2we3 s TYR 216 Cb -0.15 -4.28 -0.08 0.00 -0.11 0.00 0.00 41.96 37.34 2we3 s TYR 216 CO -0.01 -1.63 0.80 -0.51 -1.11 0.00 0.00 175.55 173.09 2we3 s LEU 217 N 3.93 4.59 0.29 -1.29 1.43 0.32 -2.34 118.68 125.60 2we3 s LEU 217 Ca 0.22 1.66 -0.30 0.00 -1.03 0.00 0.00 54.13 54.69 2we3 s LEU 217 Cb -0.16 -3.33 -0.12 0.00 0.03 0.00 0.00 46.19 42.60 2we3 s LEU 217 CO 0.09 0.18 1.42 1.57 0.23 0.00 0.00 176.35 179.84 2we3 n HIS 218 N 1.71 2.42 0.21 0.29 -0.00 -0.84 0.07 115.22 119.08 2we3 n HIS 218 Ca -0.05 0.43 0.17 0.00 -0.00 0.00 0.00 57.72 58.26 2we3 n HIS 218 Cb 0.49 -2.48 0.82 0.00 -0.00 0.00 0.00 29.99 28.82 2we3 n HIS 218 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.34 177.91 2we3 h LYS 219 N 3.78 0.00 -0.02 1.57 2.10 -1.41 -1.29 116.57 121.30 2we3 h LYS 219 Ca -0.46 0.00 0.01 0.00 -2.00 0.00 0.00 60.65 58.20 2we3 h LYS 219 Cb 1.26 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.59 2we3 h LYS 219 CO 0.72 0.00 0.07 1.25 -2.00 0.00 0.00 179.45 179.49 2we3 h HIS 220 N 0.00 0.00 -0.00 0.07 2.76 -1.89 -2.70 115.15 113.39 2we3 h HIS 220 Ca 0.08 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 2we3 h HIS 220 Cb 0.43 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.39 2we3 h HIS 220 CO 0.00 0.00 -0.21 0.72 -1.30 0.00 0.00 177.93 177.14 2we3 n HIS 221 N -3.30 0.00 -4.94 5.26 8.25 -0.48 -4.64 115.22 115.38 2we3 n HIS 221 Ca -0.02 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.11 2we3 n HIS 221 Cb 0.14 -0.19 -0.15 0.00 1.12 0.00 0.00 29.99 30.91 2we3 n HIS 221 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2we3 s LEU 222 N -2.60 2.50 -0.09 2.41 1.43 -1.02 -0.99 118.68 120.32 2we3 s LEU 222 Ca 0.24 -0.40 -0.08 0.00 -1.03 0.00 0.00 54.13 52.85 2we3 s LEU 222 Cb 0.19 -1.54 0.02 0.00 0.03 0.00 0.00 46.19 44.90 2we3 s LEU 222 CO 0.53 0.17 0.24 0.28 0.23 0.00 0.00 176.35 177.80 2we3 s THR 223 N 0.30 -0.00 -2.03 5.49 -1.32 -1.00 -4.97 115.64 112.12 2we3 s THR 223 Ca -0.13 0.00 0.29 0.00 -1.21 0.00 0.00 61.69 60.65 2we3 s THR 223 Cb -0.16 -0.34 0.60 0.00 -1.51 0.00 0.00 72.50 71.08 2we3 s THR 223 CO 0.07 0.00 1.91 -1.20 -2.21 0.00 0.00 174.62 173.18 2we3 n SER 224 N 2.97 0.71 -4.53 8.08 7.64 -1.26 -0.89 113.62 126.33 2we3 n SER 224 Ca -0.13 -1.01 -0.31 0.00 1.01 0.00 0.00 58.87 58.43 2we3 n SER 224 Cb 0.58 -0.02 -0.11 0.00 -1.01 0.00 0.00 64.21 63.65 2we3 n SER 224 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2we3 s PHE 225 N -2.19 2.71 -0.80 1.43 0.40 -1.26 -4.91 117.98 113.35 2we3 s PHE 225 Ca 0.37 -0.16 -0.25 0.00 -0.60 0.00 0.00 56.93 56.29 2we3 s PHE 225 Cb 0.21 -1.52 -0.04 0.00 0.51 0.00 0.00 43.02 42.19 2we3 s PHE 225 CO 0.40 0.32 1.90 0.71 0.70 0.00 0.00 175.22 179.26 2we3 s TYR 226 N -0.99 1.77 0.32 0.36 1.51 -1.26 -4.89 117.35 114.17 2we3 s TYR 226 Ca 0.16 0.66 0.08 0.00 -1.01 0.00 0.00 57.07 56.96 2we3 s TYR 226 Cb -0.11 -4.07 -0.03 0.00 -0.11 0.00 0.00 41.96 37.64 2we3 s TYR 226 CO 0.07 -1.95 0.23 -1.12 -1.11 0.00 0.00 175.55 171.67 2we3 s SER 227 N 7.99 5.14 0.53 2.29 0.01 -1.26 -5.09 113.70 123.30 2we3 s SER 227 Ca 0.68 -0.54 -0.22 0.00 1.31 0.00 0.00 55.95 57.18 2we3 s SER 227 Cb -0.09 -0.96 -0.05 0.00 0.21 0.00 0.00 66.02 65.13 2we3 s SER 227 CO 0.07 -0.28 1.37 -2.84 0.41 0.00 0.00 173.24 171.96 2we3 s PRO 228 N -3.92 3.21 -1.34 12.44 0.02 -1.26 -3.53 135.00 140.63 2we3 s PRO 228 Ca 0.39 2.25 -0.02 0.00 0.02 0.00 0.00 61.00 63.64 2we3 s PRO 228 Cb -0.05 -2.31 0.01 0.00 0.02 0.00 0.00 34.50 32.17 2we3 s PRO 228 CO 0.25 -1.14 0.72 0.72 -0.33 0.00 0.00 177.00 177.22 2we3 n HIS 229 N -0.92 -1.95 -4.20 6.54 8.25 -1.26 -4.95 115.22 116.73 2we3 n HIS 229 Ca 0.10 0.85 -0.12 0.00 -0.26 0.00 0.00 57.72 58.28 2we3 n HIS 229 Cb 0.45 -4.33 -0.10 0.00 1.12 0.00 0.00 29.99 27.12 2we3 n HIS 229 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2we3 s SER 230 N -4.25 0.68 -0.08 0.41 1.04 -1.23 -3.50 113.70 106.78 2we3 s SER 230 Ca 0.08 -1.23 -0.03 0.00 0.48 0.00 0.00 55.95 55.25 2we3 s SER 230 Cb -0.04 0.23 0.04 0.00 0.10 0.00 0.00 66.02 66.36 2we3 s SER 230 CO 0.82 -0.69 0.17 -0.62 0.98 0.00 0.00 173.24 173.90 2we3 s ASP 231 N -3.12 0.05 0.11 7.02 -1.08 -0.35 -4.93 116.67 114.36 2we3 s ASP 231 Ca 0.26 0.35 0.24 0.00 -0.52 0.00 0.00 52.55 52.88 2we3 s ASP 231 Cb 0.07 0.26 0.93 0.00 -1.46 0.00 0.00 42.92 42.72 2we3 s ASP 231 CO 0.04 -0.17 1.74 0.00 0.52 0.00 0.00 175.17 177.30 2we3 n ALA 232 N 4.47 2.03 -0.01 3.66 0.00 -1.26 -1.06 120.51 128.34 2we3 n ALA 232 Ca -0.22 -0.03 -0.07 0.00 0.00 0.00 0.00 53.44 53.12 2we3 n ALA 232 Cb 0.51 -1.40 0.11 0.00 0.00 0.00 0.00 19.45 18.67 2we3 n ALA 232 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2we3 h GLY 233 N 3.75 0.62 0.03 0.00 0.00 -1.87 -3.41 103.07 102.20 2we3 h GLY 233 Ca 0.00 -0.61 -0.00 0.00 0.00 0.00 0.00 47.33 46.72 2we3 h GLY 233 CO 0.00 0.55 -0.01 -2.08 0.00 0.00 0.00 176.54 175.01 2we3 h VAL 234 N 0.47 0.87 -0.69 4.60 2.07 -1.89 -3.38 116.25 118.30 2we3 h VAL 234 Ca 0.04 -1.61 0.00 0.00 0.82 0.00 0.00 66.70 65.96 2we3 h VAL 234 Cb 0.89 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 32.29 2we3 h VAL 234 CO 0.08 0.29 0.00 0.18 0.02 0.00 0.00 177.57 178.14 2we3 n LEU 235 N -4.72 3.85 0.00 2.57 4.77 -1.26 -4.56 117.00 117.65 2we3 n LEU 235 Ca -0.05 -1.97 0.00 0.00 -0.03 0.00 0.00 56.01 53.96 2we3 n LEU 235 Cb 0.24 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.87 2we3 n LEU 235 CO 0.17 0.96 0.00 0.61 -1.33 0.00 0.00 177.39 177.80 2we3 n GLY 236 N 1.55 0.48 0.11 -0.72 0.00 -1.26 -4.44 105.19 100.92 2we3 n GLY 236 Ca 0.23 -2.18 0.05 0.00 0.00 0.00 0.00 46.02 44.12 2we3 n GLY 236 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2we3 h PRO 237 N 7.78 0.00 -0.30 1.61 0.14 -1.94 -3.37 132.00 135.93 2we3 h PRO 237 Ca 0.00 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.14 2we3 h PRO 237 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 31.00 31.14 2we3 h PRO 237 CO 0.00 0.17 0.00 0.54 0.14 0.00 0.00 178.00 178.85 2we3 n ARG 238 N -2.83 2.26 -4.20 0.86 1.74 -1.26 -4.98 116.66 108.26 2we3 n ARG 238 Ca -0.04 -2.08 -0.12 0.00 -0.77 0.00 0.00 57.85 54.84 2we3 n ARG 238 Cb 0.70 -1.44 -0.10 0.00 -1.02 0.00 0.00 32.46 30.60 2we3 n ARG 238 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2we3 s SER 239 N -1.40 1.24 0.14 0.55 1.04 -1.26 -4.56 113.70 109.45 2we3 s SER 239 Ca 0.32 -1.06 0.10 0.00 0.48 0.00 0.00 55.95 55.80 2we3 s SER 239 Cb 0.19 0.09 -0.04 0.00 0.10 0.00 0.00 66.02 66.36 2we3 s SER 239 CO 0.27 -0.48 -0.20 -0.76 0.98 0.00 0.00 173.24 173.06 2we3 s LEU 240 N -3.10 2.61 -0.23 2.42 1.02 -0.07 -4.47 118.68 116.86 2we3 s LEU 240 Ca 0.16 -0.66 -0.16 0.00 0.02 0.00 0.00 54.13 53.49 2we3 s LEU 240 Cb 0.05 -1.42 -0.04 0.00 0.02 0.00 0.00 46.19 44.81 2we3 s LEU 240 CO -0.02 0.16 0.40 0.12 0.02 0.00 0.00 176.35 177.03 2we3 s PHE 241 N -1.31 3.31 -0.30 0.29 5.36 -0.22 -2.37 117.98 122.74 2we3 s PHE 241 Ca 0.19 0.53 -0.04 0.00 -0.96 0.00 0.00 56.93 56.65 2we3 s PHE 241 Cb -0.10 -2.56 0.03 0.00 -0.34 0.00 0.00 43.02 40.06 2we3 s PHE 241 CO 0.10 -0.12 0.03 0.50 -1.46 0.00 0.00 175.22 174.27 2we3 s ARG 242 N 1.69 2.70 0.72 10.12 3.52 -0.16 -1.21 118.95 136.33 2we3 s ARG 242 Ca 0.17 -1.09 -0.10 0.00 -0.13 0.00 0.00 55.73 54.58 2we3 s ARG 242 Cb -0.15 -3.24 0.04 0.00 -1.56 0.00 0.00 34.95 30.04 2we3 s ARG 242 CO 0.09 -0.54 1.08 1.67 -0.81 0.00 0.00 175.30 176.78 2we3 s TRP 243 N 1.36 3.10 0.36 5.12 -2.14 -1.23 -4.15 118.94 121.36 2we3 s TRP 243 Ca -0.02 0.76 -0.27 0.00 2.66 0.00 0.00 56.10 59.23 2we3 s TRP 243 Cb -0.18 -3.19 -0.09 0.00 -3.10 0.00 0.00 33.47 26.91 2we3 s TRP 243 CO -0.00 -1.37 1.22 0.00 -2.66 0.00 0.00 176.95 174.14 2we3 s ALA 244 N -3.35 3.32 -0.65 2.67 0.00 -0.29 -4.96 121.76 118.50 2we3 s ALA 244 Ca 0.59 1.09 -0.21 0.00 0.00 0.00 0.00 51.96 53.43 2we3 s ALA 244 Cb -0.11 -3.42 0.08 0.00 0.00 0.00 0.00 23.12 19.68 2we3 s ALA 244 CO 0.48 -0.56 0.88 -1.54 0.00 0.00 0.00 175.76 175.03 2we3 s SER 245 N -0.83 6.20 0.31 0.00 1.04 -1.26 -4.53 113.70 114.63 2we3 s SER 245 Ca 0.53 -1.20 0.07 0.00 0.48 0.00 0.00 55.95 55.83 2we3 s SER 245 Cb -0.35 -2.38 -0.06 0.00 0.10 0.00 0.00 66.02 63.33 2we3 s SER 245 CO 0.45 -1.31 -0.06 0.00 0.98 0.00 0.00 173.24 173.30 2we3 s THR 247 N -2.90 3.69 0.11 0.00 2.01 -1.26 -2.99 115.64 114.31 2we3 s THR 247 Ca 0.31 -0.44 -0.28 0.00 0.31 0.00 0.00 61.69 61.59 2we3 s THR 247 Cb 0.04 -2.59 -0.06 0.00 0.01 0.00 0.00 72.50 69.90 2we3 s THR 247 CO 0.14 0.52 0.89 -0.36 -0.69 0.00 0.00 174.62 175.12 2we3 s PHE 248 N 0.13 3.82 -0.17 4.92 0.40 -1.26 0.38 117.98 126.21 2we3 s PHE 248 Ca -0.02 1.72 -0.04 0.00 -0.60 0.00 0.00 56.93 57.98 2we3 s PHE 248 Cb -0.14 -2.96 0.06 0.00 0.51 0.00 0.00 43.02 40.49 2we3 s PHE 248 CO 0.03 0.28 0.07 -2.00 0.70 0.00 0.00 175.22 174.30 2we3 s GLU 249 N -0.24 0.21 -0.05 0.44 2.12 -0.12 -4.89 118.70 116.18 2we3 s GLU 249 Ca 0.43 -0.13 -0.29 0.00 0.36 0.00 0.00 54.97 55.34 2we3 s GLU 249 Cb -0.23 -1.80 -0.07 0.00 0.26 0.00 0.00 34.13 32.29 2we3 s GLU 249 CO 0.28 -0.63 1.99 -2.00 -0.54 0.00 0.00 175.26 174.35 2we3 s GLU 250 N 2.07 3.87 -0.41 4.30 2.12 -1.26 -2.51 118.70 126.88 2we3 s GLU 250 Ca 0.02 2.38 0.03 0.00 0.36 0.00 0.00 54.97 57.75 2we3 s GLU 250 Cb -0.16 -4.20 0.12 0.00 0.26 0.00 0.00 34.13 30.15 2we3 s GLU 250 CO -0.08 -1.26 0.16 0.08 -0.54 0.00 0.00 175.26 173.62 2we3 s VAL 251 N 5.43 1.97 0.47 3.70 1.01 0.10 -4.89 120.40 128.20 2we3 s VAL 251 Ca 0.89 -2.53 0.36 0.00 0.00 0.00 0.00 61.98 60.70 2we3 s VAL 251 Cb -0.38 -2.42 0.38 0.00 0.00 0.00 0.00 36.38 33.96 2we3 s VAL 251 CO 0.38 -0.73 2.19 -0.65 0.00 0.00 0.00 175.10 176.30 2we3 h PRO 252 N 7.18 0.00 0.00 2.72 0.11 -1.94 -2.10 132.00 137.98 2we3 h PRO 252 Ca -0.06 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.05 2we3 h PRO 252 Cb 0.96 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.07 2we3 h PRO 252 CO 0.56 0.04 -0.00 0.66 -0.21 0.00 0.00 178.00 179.04 2we3 h SER 253 N 0.00 0.00 -0.13 -2.05 4.64 -1.94 -2.06 113.55 112.00 2we3 h SER 253 Ca -0.00 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.36 2we3 h SER 253 Cb 0.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2we3 h SER 253 CO 0.00 0.00 0.11 -0.07 -0.87 0.00 0.00 176.83 176.01 2we3 h LEU 254 N 0.00 0.00-10.31 5.97 3.38 -1.74 -3.44 115.31 109.18 2we3 h LEU 254 Ca -0.00 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.48 2we3 h LEU 254 Cb 0.34 0.00 0.15 0.00 0.09 0.00 0.00 40.66 41.24 2we3 h LEU 254 CO 0.00 0.00 0.25 0.00 0.09 0.00 0.00 178.44 178.78 2we3 s ALA 255 N -4.85 1.57 0.00 1.53 0.00 -0.78 -4.96 121.76 114.28 2we3 s ALA 255 Ca -0.05 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.03 2we3 s ALA 255 Cb 0.17 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 20.03 2we3 s ALA 255 CO 0.62 -2.37 0.00 -1.33 0.00 0.00 0.00 175.76 172.68