#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xs7 s SER 46 N 0.00 -0.51 -0.75 1.61 1.04 -1.26 -2.20 113.70 111.62 1xs7 s SER 46 Ca 0.00 0.86 0.03 0.00 0.48 0.00 0.00 55.95 57.31 1xs7 s SER 46 Cb 0.00 1.13 0.33 0.00 0.10 0.00 0.00 66.02 67.58 1xs7 s SER 46 CO 0.00 -0.14 1.25 0.49 0.98 0.00 0.00 173.24 175.82 1xs7 n PHE 47 N 3.39 3.55 -0.44 5.02 3.01 -1.26 -4.88 117.46 125.85 1xs7 n PHE 47 Ca -0.17 -3.48 0.34 0.00 1.01 0.00 0.00 57.45 55.15 1xs7 n PHE 47 Cb 0.57 -0.76 0.53 0.00 -0.01 0.00 0.00 39.48 39.82 1xs7 n PHE 47 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 1xs7 n VAL 48 N -0.07 -0.05 -0.05 -4.37 0.24 -1.26 0.36 118.33 113.12 1xs7 n VAL 48 Ca 0.36 1.08 -0.08 0.00 -2.04 0.00 0.00 64.34 63.66 1xs7 n VAL 48 Cb 0.35 -1.79 -0.02 0.00 -1.47 0.00 0.00 33.84 30.91 1xs7 n VAL 48 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 1xs7 h GLU 1 N 0.00 0.05 0.00 7.34 4.11 -1.99 -3.06 114.58 121.02 1xs7 h GLU 1 Ca 0.63 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.06 1xs7 h GLU 1 Cb 2.38 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.62 1xs7 h GLU 1 CO -0.10 0.03 -0.42 -1.33 0.07 0.00 0.00 179.01 177.26 1xs7 n MET 2 N -5.17 0.09 -1.74 1.06 2.81 0.16 -4.79 117.12 109.55 1xs7 n MET 2 Ca -0.02 0.03 -0.42 0.00 -1.81 0.00 0.00 57.70 55.49 1xs7 n MET 2 Cb 0.13 -1.57 -0.02 0.00 -0.71 0.00 0.00 33.22 31.05 1xs7 n MET 2 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1xs7 n VAL 3 N -1.71 0.64 -1.25 2.03 0.31 -1.16 -2.55 118.33 114.65 1xs7 n VAL 3 Ca 0.05 -0.16 -0.08 0.00 -0.01 0.00 0.00 64.34 64.14 1xs7 n VAL 3 Cb 0.37 -1.98 -0.04 0.00 -0.91 0.00 0.00 33.84 31.28 1xs7 n VAL 3 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1xs7 n ASP 4 N 2.83 -4.05 -0.16 4.52 10.43 -1.24 -4.91 116.55 123.98 1xs7 n ASP 4 Ca 0.11 0.21 0.08 0.00 2.57 0.00 0.00 54.79 57.76 1xs7 n ASP 4 Cb 0.36 -2.30 0.40 0.00 1.84 0.00 0.00 41.12 41.43 1xs7 n ASP 4 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 1xs7 n ASN 5 N 0.57 0.46 -4.98 -2.24 0.23 -1.06 -4.83 115.26 103.42 1xs7 n ASN 5 Ca -0.08 -1.60 -0.19 0.00 -0.53 0.00 0.00 54.58 52.17 1xs7 n ASN 5 Cb 0.28 -0.04 -0.01 0.00 -2.08 0.00 0.00 39.78 37.94 1xs7 n ASN 5 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1xs7 s LEU 6 N -1.45 3.91 -0.09 -4.53 1.43 -0.53 -4.37 118.68 113.04 1xs7 s LEU 6 Ca 0.24 -0.24 -0.22 0.00 -1.03 0.00 0.00 54.13 52.88 1xs7 s LEU 6 Cb 0.12 -2.68 0.05 0.00 0.03 0.00 0.00 46.19 43.70 1xs7 s LEU 6 CO 0.19 -0.45 0.52 -0.13 0.23 0.00 0.00 176.35 176.71 1xs7 s ARG 7 N -4.17 0.79 0.00 1.70 0.52 -0.64 -2.34 118.95 114.81 1xs7 s ARG 7 Ca 0.45 0.30 0.00 0.00 -0.52 0.00 0.00 55.73 55.96 1xs7 s ARG 7 Cb -0.09 0.37 0.00 0.00 0.52 0.00 0.00 34.95 35.75 1xs7 s ARG 7 CO 0.31 -0.20 0.00 0.41 0.02 0.00 0.00 175.30 175.84 1xs7 n GLY 8 N 1.69 0.57 3.56 -3.53 0.00 -1.26 -1.02 105.19 105.20 1xs7 n GLY 8 Ca -0.18 -2.09 -0.11 0.00 0.00 0.00 0.00 46.02 43.64 1xs7 n GLY 8 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xs7 s LYS 9 N -0.55 1.69 0.52 1.61 -2.85 -1.18 -4.50 119.74 114.49 1xs7 s LYS 9 Ca 0.00 -1.43 0.28 0.00 -1.00 0.00 0.00 55.97 53.82 1xs7 s LYS 9 Cb 0.00 0.47 1.44 0.00 -2.06 0.00 0.00 37.83 37.67 1xs7 s LYS 9 CO 0.00 -0.71 2.06 0.66 0.10 0.00 0.00 175.35 177.46 1xs7 h SER 10 N 2.21 0.00 0.00 0.03 4.64 -1.90 0.74 113.55 119.27 1xs7 h SER 10 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1xs7 h SER 10 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1xs7 h SER 10 CO 0.38 0.12 0.00 0.61 -0.87 0.00 0.00 176.83 177.06 1xs7 n GLY 11 N -0.64 -2.66 0.07 -0.77 0.00 -1.26 -3.98 105.19 95.96 1xs7 n GLY 11 Ca -0.02 0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.17 1xs7 n GLY 11 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1xs7 h GLN 12 N 0.00 0.00 0.00 1.61 4.20 -1.97 -3.47 115.11 115.48 1xs7 h GLN 12 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1xs7 h GLN 12 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1xs7 h GLN 12 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 1xs7 n GLY 13 N 1.32 2.78 3.42 3.46 0.00 0.25 -4.98 105.19 111.44 1xs7 n GLY 13 Ca 0.03 -1.97 -0.39 0.00 0.00 0.00 0.00 46.02 43.69 1xs7 n GLY 13 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xs7 s TYR 14 N -2.87 3.19 0.27 1.61 1.51 -1.25 -3.09 117.35 116.71 1xs7 s TYR 14 Ca 0.00 -0.68 0.08 0.00 -1.01 0.00 0.00 57.07 55.46 1xs7 s TYR 14 Cb 0.00 -2.36 -0.04 0.00 -0.11 0.00 0.00 41.96 39.45 1xs7 s TYR 14 CO 0.00 -0.50 0.09 1.52 -1.11 0.00 0.00 175.55 175.55 1xs7 s TYR 15 N 1.59 2.85 0.33 2.71 -0.85 -0.19 -1.61 117.35 122.18 1xs7 s TYR 15 Ca 0.04 -0.19 0.06 0.00 -0.52 0.00 0.00 57.07 56.46 1xs7 s TYR 15 Cb -0.17 -1.31 -0.06 0.00 0.38 0.00 0.00 41.96 40.79 1xs7 s TYR 15 CO 0.06 0.56 -0.01 0.54 -1.52 0.00 0.00 175.55 175.17 1xs7 s VAL 16 N -2.26 1.63 -0.06 -3.49 0.11 0.58 -1.63 120.40 115.29 1xs7 s VAL 16 Ca 0.33 -2.07 -0.13 0.00 -2.93 0.00 0.00 61.98 57.18 1xs7 s VAL 16 Cb -0.07 -2.69 -0.05 0.00 -1.53 0.00 0.00 36.38 32.04 1xs7 s VAL 16 CO 0.22 -0.14 0.33 -0.70 -3.33 0.00 0.00 175.10 171.49 1xs7 s GLU 17 N -3.76 3.87 0.03 1.54 2.12 -1.26 0.44 118.70 121.67 1xs7 s GLU 17 Ca 0.33 0.24 -0.12 0.00 0.36 0.00 0.00 54.97 55.78 1xs7 s GLU 17 Cb 0.06 -3.25 0.01 0.00 0.26 0.00 0.00 34.13 31.22 1xs7 s GLU 17 CO 0.15 0.62 0.26 -1.64 -0.54 0.00 0.00 175.26 174.11 1xs7 s MET 18 N -0.76 0.71 -0.17 4.30 -1.94 -0.22 -4.06 119.30 117.16 1xs7 s MET 18 Ca 0.21 -0.46 -0.02 0.00 -1.71 0.00 0.00 55.69 53.70 1xs7 s MET 18 Cb -0.15 0.30 -0.02 0.00 2.01 0.00 0.00 34.83 36.98 1xs7 s MET 18 CO 0.10 -0.21 -0.07 0.95 -0.01 0.00 0.00 175.02 175.77 1xs7 s THR 19 N -2.16 3.38 -0.16 2.05 -4.23 -0.41 0.13 115.64 114.24 1xs7 s THR 19 Ca -0.08 -0.52 -0.03 0.00 -1.18 0.00 0.00 61.69 59.88 1xs7 s THR 19 Cb -0.03 -2.48 -0.02 0.00 1.34 0.00 0.00 72.50 71.31 1xs7 s THR 19 CO -0.01 0.48 -0.05 0.68 -0.54 0.00 0.00 174.62 175.18 1xs7 s VAL 20 N 0.77 3.71 0.00 2.29 -7.23 -0.77 -1.85 120.40 117.32 1xs7 s VAL 20 Ca -0.03 -0.42 0.00 0.00 -1.81 0.00 0.00 61.98 59.72 1xs7 s VAL 20 Cb -0.15 -2.63 0.00 0.00 0.56 0.00 0.00 36.38 34.16 1xs7 s VAL 20 CO 0.02 0.48 0.00 0.61 -0.31 0.00 0.00 175.10 175.90 1xs7 n GLY 21 N 3.74 -2.27 2.93 2.32 0.00 0.16 -2.27 105.19 109.80 1xs7 n GLY 21 Ca -0.18 -1.57 -0.28 0.00 0.00 0.00 0.00 46.02 44.00 1xs7 n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xs7 s SER 22 N -3.06 2.61 0.95 1.61 0.01 -1.26 -2.87 113.70 111.68 1xs7 s SER 22 Ca 0.00 -0.51 -0.14 0.00 1.31 0.00 0.00 55.95 56.61 1xs7 s SER 22 Cb 0.00 -0.96 0.16 0.00 0.21 0.00 0.00 66.02 65.43 1xs7 s SER 22 CO 0.00 -0.13 1.16 -2.16 0.41 0.00 0.00 173.24 172.52 1xs7 s PRO 23 N 1.61 0.80 0.15 12.44 0.04 -1.26 0.96 135.00 149.75 1xs7 s PRO 23 Ca 0.03 0.16 -0.34 0.00 0.04 0.00 0.00 61.00 60.89 1xs7 s PRO 23 Cb -0.14 -1.81 -0.15 0.00 0.04 0.00 0.00 34.50 32.44 1xs7 s PRO 23 CO -0.09 -2.40 1.41 -2.30 0.04 0.00 0.00 177.00 173.66 1xs7 n PRO 24 N -3.88 1.66 -3.97 0.56 -0.02 -1.14 -4.88 135.00 123.32 1xs7 n PRO 24 Ca 0.08 0.60 -0.31 0.00 -2.02 0.00 0.00 63.50 61.85 1xs7 n PRO 24 Cb 0.59 -2.26 -0.14 0.00 -0.02 0.00 0.00 33.50 31.67 1xs7 n PRO 24 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1xs7 s GLN 25 N 0.35 1.72 0.38 -0.52 -0.21 -0.96 -4.90 119.66 115.52 1xs7 s GLN 25 Ca 0.78 -2.16 -0.27 0.00 0.02 0.00 0.00 55.36 53.73 1xs7 s GLN 25 Cb -0.79 -3.28 -0.11 0.00 1.00 0.00 0.00 33.01 29.83 1xs7 s GLN 25 CO 0.45 -1.01 1.37 2.41 -2.12 0.00 0.00 175.29 176.38 1xs7 n THR 26 N 3.84 2.22 -3.68 -0.19 -1.04 -1.26 -1.84 114.28 112.33 1xs7 n THR 26 Ca 0.04 -0.50 -0.13 0.00 -2.04 0.00 0.00 64.05 61.42 1xs7 n THR 26 Cb 0.38 -1.73 -0.08 0.00 -1.82 0.00 0.00 70.33 67.08 1xs7 n THR 26 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1xs7 s LEU 27 N -1.70 -0.25 -0.38 -4.42 1.43 0.12 -4.92 118.68 108.57 1xs7 s LEU 27 Ca 0.57 1.18 -0.21 0.00 -1.03 0.00 0.00 54.13 54.64 1xs7 s LEU 27 Cb -0.51 1.99 0.01 0.00 0.03 0.00 0.00 46.19 47.71 1xs7 s LEU 27 CO 0.61 -0.20 0.65 0.20 0.23 0.00 0.00 176.35 177.84 1xs7 s ASN 28 N 0.41 6.41 -0.24 2.29 0.02 -1.26 -1.06 114.94 121.51 1xs7 s ASN 28 Ca -0.01 0.05 -0.13 0.00 -1.02 0.00 0.00 52.86 51.75 1xs7 s ASN 28 Cb -0.04 -2.33 -0.04 0.00 0.02 0.00 0.00 41.25 38.85 1xs7 s ASN 28 CO -0.01 -0.65 0.27 -0.63 0.02 0.00 0.00 177.10 176.11 1xs7 s ILE 29 N 2.77 5.27 0.16 0.60 -1.09 0.17 -1.00 121.20 128.08 1xs7 s ILE 29 Ca 0.25 0.41 -0.31 0.00 -2.23 0.00 0.00 60.65 58.76 1xs7 s ILE 29 Cb -0.14 -3.61 -0.09 0.00 -1.58 0.00 0.00 42.46 37.04 1xs7 s ILE 29 CO 0.16 0.27 1.46 -0.22 -1.23 0.00 0.00 174.94 175.38 1xs7 s LEU 30 N 1.43 4.37 -0.48 2.97 0.20 0.20 -0.31 118.68 127.07 1xs7 s LEU 30 Ca 0.12 2.49 -0.25 0.00 0.69 0.00 0.00 54.13 57.18 1xs7 s LEU 30 Cb -0.15 -3.59 0.03 0.00 -0.43 0.00 0.00 46.19 42.05 1xs7 s LEU 30 CO 0.07 -0.72 0.93 -0.69 -0.29 0.00 0.00 176.35 175.65 1xs7 s VAL 31 N 0.93 4.45 -0.25 1.68 1.01 -0.63 -0.41 120.40 127.19 1xs7 s VAL 31 Ca 0.66 0.64 0.01 0.00 0.00 0.00 0.00 61.98 63.29 1xs7 s VAL 31 Cb -0.40 -4.46 0.06 0.00 0.00 0.00 0.00 36.38 31.58 1xs7 s VAL 31 CO 0.33 -0.90 -0.05 -0.62 0.00 0.00 0.00 175.10 173.86 1xs7 s ASP 32 N 2.39 3.97 0.00 3.32 2.15 -0.94 -4.18 116.67 123.38 1xs7 s ASP 32 Ca 0.36 -1.26 0.19 0.00 0.43 0.00 0.00 52.55 52.27 1xs7 s ASP 32 Cb -0.11 -1.23 0.89 0.00 -0.30 0.00 0.00 42.92 42.17 1xs7 s ASP 32 CO 0.25 -0.24 1.61 0.35 -0.17 0.00 0.00 175.17 176.96 1xs7 n THR 33 N 4.63 0.12 -0.53 1.71 -2.24 -1.26 -1.20 114.28 115.51 1xs7 n THR 33 Ca -0.11 -0.20 0.09 0.00 -2.27 0.00 0.00 64.05 61.56 1xs7 n THR 33 Cb 0.44 0.09 0.29 0.00 -2.10 0.00 0.00 70.33 69.04 1xs7 n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xs7 n GLY 34 N 0.98 2.92 3.38 3.38 0.00 -1.26 -3.97 105.19 110.60 1xs7 n GLY 34 Ca 0.15 -0.75 -0.14 0.00 0.00 0.00 0.00 46.02 45.28 1xs7 n GLY 34 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xs7 s SER 35 N -1.10 0.75 0.00 1.61 1.04 -1.25 -4.97 113.70 109.79 1xs7 s SER 35 Ca 0.42 -1.45 0.00 0.00 0.48 0.00 0.00 55.95 55.41 1xs7 s SER 35 Cb 0.27 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.94 1xs7 s SER 35 CO 0.21 -1.09 0.29 -1.20 0.98 0.00 0.00 173.24 172.44 1xs7 n SER 36 N -0.98 0.47 -4.87 7.02 7.64 -1.25 0.09 113.62 121.73 1xs7 n SER 36 Ca 0.02 -1.08 -0.33 0.00 1.01 0.00 0.00 58.87 58.50 1xs7 n SER 36 Cb 0.63 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.77 1xs7 n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1xs7 s ASN 37 N -0.08 6.68 -0.43 6.43 -0.87 -1.26 -4.38 114.94 121.04 1xs7 s ASN 37 Ca 0.00 0.97 -0.06 0.00 -1.57 0.00 0.00 52.86 52.20 1xs7 s ASN 37 Cb 0.00 -2.24 0.11 0.00 -0.02 0.00 0.00 41.25 39.09 1xs7 s ASN 37 CO 0.00 -0.02 0.25 0.12 -2.57 0.00 0.00 177.10 174.88 1xs7 s PHE 38 N -1.71 3.48 -0.15 2.20 5.99 -1.26 -0.32 117.98 126.21 1xs7 s PHE 38 Ca 0.45 -2.08 0.00 0.00 0.00 0.00 0.00 56.93 55.30 1xs7 s PHE 38 Cb -0.12 -3.22 0.03 0.00 0.00 0.00 0.00 43.02 39.71 1xs7 s PHE 38 CO 0.20 -0.95 -0.11 0.00 -0.00 0.00 0.00 175.22 174.36 1xs7 s ALA 39 N 1.26 1.74 0.19 11.12 0.00 -0.69 -0.22 121.76 135.17 1xs7 s ALA 39 Ca 0.06 -0.88 0.08 0.00 0.00 0.00 0.00 51.96 51.22 1xs7 s ALA 39 Cb -0.24 -1.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.77 1xs7 s ALA 39 CO -0.02 -0.51 -0.04 0.14 0.00 0.00 0.00 175.76 175.33 1xs7 s VAL 40 N 1.53 3.45 0.19 0.00 -7.23 -1.12 -0.94 120.40 116.28 1xs7 s VAL 40 Ca 0.03 -1.59 -0.31 0.00 -1.81 0.00 0.00 61.98 58.30 1xs7 s VAL 40 Cb -0.14 -2.74 -0.10 0.00 0.56 0.00 0.00 36.38 33.97 1xs7 s VAL 40 CO -0.09 -0.15 1.48 -0.83 -0.31 0.00 0.00 175.10 175.20 1xs7 s GLY 41 N -2.99 1.95 -0.19 2.32 0.00 0.08 -1.16 107.32 107.32 1xs7 s GLY 41 Ca 0.27 1.30 0.14 0.00 0.00 0.00 0.00 44.72 46.42 1xs7 s GLY 41 CO 0.17 2.43 1.20 0.00 0.00 0.00 0.00 173.10 176.90 1xs7 n ALA 42 N 3.32 3.63 -3.65 3.20 0.00 -0.42 0.76 120.51 127.35 1xs7 n ALA 42 Ca 0.11 -3.19 -0.07 0.00 0.00 0.00 0.00 53.44 50.28 1xs7 n ALA 42 Cb 0.40 -0.45 -0.02 0.00 0.00 0.00 0.00 19.45 19.38 1xs7 n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xs7 s ALA 43 N -2.75 -1.59 0.39 0.00 0.00 -1.25 -4.80 121.76 111.75 1xs7 s ALA 43 Ca 0.39 0.32 -0.25 0.00 0.00 0.00 0.00 51.96 52.42 1xs7 s ALA 43 Cb 0.38 0.68 -0.09 0.00 0.00 0.00 0.00 23.12 24.09 1xs7 s ALA 43 CO -0.06 -0.90 1.15 -1.25 0.00 0.00 0.00 175.76 174.70 1xs7 s PRO 44 N -3.47 4.09 -0.16 0.00 0.04 -1.26 -4.80 135.00 129.44 1xs7 s PRO 44 Ca 0.08 1.80 -0.22 0.00 0.04 0.00 0.00 61.00 62.69 1xs7 s PRO 44 Cb -0.02 -2.68 0.06 0.00 0.04 0.00 0.00 34.50 31.89 1xs7 s PRO 44 CO -0.02 -0.27 0.57 -1.58 0.04 0.00 0.00 177.00 175.74 1xs7 s HIS 45 N -1.43 -0.59 0.24 0.56 2.46 -1.26 -5.05 115.29 110.22 1xs7 s HIS 45 Ca 0.57 1.32 -0.06 0.00 0.47 0.00 0.00 55.06 57.35 1xs7 s HIS 45 Cb -0.30 0.25 0.41 0.00 -0.13 0.00 0.00 32.58 32.81 1xs7 s HIS 45 CO 0.37 -0.39 1.33 -2.30 -2.47 0.00 0.00 174.74 171.28 1xs7 n PRO 46 N 2.17 -0.08 -0.24 2.88 -0.02 -1.26 -0.79 135.00 137.67 1xs7 n PRO 46 Ca -0.16 1.32 0.09 0.00 -2.02 0.00 0.00 63.50 62.73 1xs7 n PRO 46 Cb 0.56 -1.98 0.24 0.00 -0.02 0.00 0.00 33.50 32.30 1xs7 n PRO 46 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1xs7 n PHE 47 N -5.37 0.62 -4.00 6.00 0.99 -1.26 -4.89 117.46 109.55 1xs7 n PHE 47 Ca 0.14 -0.31 -0.35 0.00 -0.00 0.00 0.00 57.45 56.93 1xs7 n PHE 47 Cb 0.44 0.00 -0.13 0.00 -1.00 0.00 0.00 39.48 38.79 1xs7 n PHE 47 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 1xs7 s LEU 48 N -1.11 3.20 0.32 4.37 1.43 0.03 -4.74 118.68 122.18 1xs7 s LEU 48 Ca 0.35 -0.24 0.17 0.00 -1.03 0.00 0.00 54.13 53.38 1xs7 s LEU 48 Cb 0.18 -1.82 0.17 0.00 0.03 0.00 0.00 46.19 44.75 1xs7 s LEU 48 CO 0.25 0.03 1.50 -0.74 0.23 0.00 0.00 176.35 177.62 1xs7 h HIS 49 N 7.73 0.00 -1.90 0.29 -0.00 -1.90 -3.42 115.15 115.95 1xs7 h HIS 49 Ca -0.37 0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 59.97 1xs7 h HIS 49 Cb 1.17 0.00 -0.20 0.00 -0.00 0.00 0.00 27.41 28.38 1xs7 h HIS 49 CO 0.60 0.38 0.26 -0.98 -0.00 0.00 0.00 177.93 178.19 1xs7 s ARG 50 N -3.05 0.91 0.34 5.26 1.70 -1.26 -5.15 118.95 117.70 1xs7 s ARG 50 Ca 0.04 0.38 0.05 0.00 -0.47 0.00 0.00 55.73 55.73 1xs7 s ARG 50 Cb 0.07 0.43 -0.03 0.00 -0.57 0.00 0.00 34.95 34.85 1xs7 s ARG 50 CO 0.72 -0.25 0.21 1.52 -1.08 0.00 0.00 175.30 176.42 1xs7 s TYR 51 N -0.84 1.70 -0.10 5.89 -0.85 -1.26 -4.85 117.35 117.04 1xs7 s TYR 51 Ca -0.07 -1.49 -0.30 0.00 -0.52 0.00 0.00 57.07 54.69 1xs7 s TYR 51 Cb -0.01 -0.85 -0.03 0.00 0.38 0.00 0.00 41.96 41.45 1xs7 s TYR 51 CO 0.06 -0.64 1.25 -0.47 -1.52 0.00 0.00 175.55 174.23 1xs7 s TYR 52 N -3.46 3.00 -0.80 -3.49 5.04 0.23 -4.96 117.35 112.91 1xs7 s TYR 52 Ca 0.35 1.08 0.02 0.00 -2.44 0.00 0.00 57.07 56.07 1xs7 s TYR 52 Cb 0.03 -3.49 0.19 0.00 0.35 0.00 0.00 41.96 39.05 1xs7 s TYR 52 CO 0.21 -1.62 0.64 1.04 -1.34 0.00 0.00 175.55 174.48 1xs7 n GLN 53 N 5.83 2.23 -0.25 4.97 6.02 -1.26 -4.28 117.38 130.64 1xs7 n GLN 53 Ca 0.12 -4.49 0.06 0.00 -0.01 0.00 0.00 57.00 52.68 1xs7 n GLN 53 Cb 0.45 -2.35 0.18 0.00 1.02 0.00 0.00 30.24 29.54 1xs7 n GLN 53 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1xs7 h ARG 54 N 5.64 0.16 -0.70 -1.09 3.08 -1.93 0.30 114.38 119.83 1xs7 h ARG 54 Ca 0.16 -0.01 0.20 0.00 0.07 0.00 0.00 59.98 60.40 1xs7 h ARG 54 Cb 0.78 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.76 1xs7 h ARG 54 CO 0.79 0.10 0.73 1.96 -1.07 0.00 0.00 179.97 182.48 1xs7 h GLN 55 N 0.16 0.00 -0.03 0.04 4.20 -2.01 0.39 115.11 117.86 1xs7 h GLN 55 Ca 0.42 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.13 1xs7 h GLN 55 Cb 0.75 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.53 1xs7 h GLN 55 CO -0.61 0.00 -0.05 1.28 -0.67 0.00 0.00 178.83 178.79 1xs7 n LEU 56 N -3.62 2.90 -4.57 1.46 4.77 0.10 -4.89 117.00 113.15 1xs7 n LEU 56 Ca 0.15 -0.98 -0.39 0.00 -0.03 0.00 0.00 56.01 54.76 1xs7 n LEU 56 Cb 0.98 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.97 1xs7 n LEU 56 CO 0.28 0.49 -0.09 -0.55 -1.33 0.00 0.00 177.39 176.18 1xs7 s SER 57 N -2.04 6.09 0.16 -1.43 0.15 0.14 -4.19 113.70 112.57 1xs7 s SER 57 Ca 0.27 -0.07 0.20 0.00 0.70 0.00 0.00 55.95 57.05 1xs7 s SER 57 Cb 0.20 -2.15 0.83 0.00 -1.71 0.00 0.00 66.02 63.19 1xs7 s SER 57 CO 0.33 -0.15 1.60 -1.54 1.20 0.00 0.00 173.24 174.68 1xs7 n SER 58 N 5.16 0.40 -0.24 5.45 3.41 0.27 -2.84 113.62 125.23 1xs7 n SER 58 Ca -0.12 0.60 0.02 0.00 -0.26 0.00 0.00 58.87 59.11 1xs7 n SER 58 Cb 0.51 -0.69 0.05 0.00 -0.26 0.00 0.00 64.21 63.83 1xs7 n SER 58 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1xs7 n THR 59 N -1.95 0.89 -1.98 6.66 -2.24 -1.26 -5.01 114.28 109.39 1xs7 n THR 59 Ca 0.02 -0.95 -0.40 0.00 -2.27 0.00 0.00 64.05 60.45 1xs7 n THR 59 Cb 0.20 0.56 -0.01 0.00 -2.10 0.00 0.00 70.33 68.98 1xs7 n THR 59 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1xs7 s TYR 60 N -0.93 2.81 -0.08 4.78 5.04 -1.13 -4.52 117.35 123.32 1xs7 s TYR 60 Ca 0.08 1.33 0.02 0.00 -2.44 0.00 0.00 57.07 56.06 1xs7 s TYR 60 Cb 0.05 -3.80 0.01 0.00 0.35 0.00 0.00 41.96 38.56 1xs7 s TYR 60 CO 0.06 -2.35 -0.15 1.03 -1.34 0.00 0.00 175.55 172.80 1xs7 s ARG 61 N -2.03 2.07 0.13 4.97 0.52 0.16 -4.95 118.95 119.81 1xs7 s ARG 61 Ca 0.53 -0.53 -0.20 0.00 -0.52 0.00 0.00 55.73 55.00 1xs7 s ARG 61 Cb -0.42 -1.69 -0.07 0.00 0.52 0.00 0.00 34.95 33.29 1xs7 s ARG 61 CO 0.56 0.03 0.64 0.34 0.02 0.00 0.00 175.30 176.89 1xs7 s ASP 62 N 0.70 7.11 -0.04 0.23 -1.08 -1.26 -0.48 116.67 121.85 1xs7 s ASP 62 Ca -0.13 1.36 0.07 0.00 -0.52 0.00 0.00 52.55 53.33 1xs7 s ASP 62 Cb -0.16 -2.39 0.16 0.00 -1.46 0.00 0.00 42.92 39.06 1xs7 s ASP 62 CO 0.03 0.19 1.11 0.18 0.52 0.00 0.00 175.17 177.20 1xs7 n LEU 63 N 1.38 2.36 -3.76 -1.34 4.77 -1.07 -4.93 117.00 114.41 1xs7 n LEU 63 Ca -0.07 -2.34 -0.21 0.00 -0.03 0.00 0.00 56.01 53.36 1xs7 n LEU 63 Cb 0.50 -0.18 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 1xs7 n LEU 63 CO 0.43 0.60 -0.13 0.54 -1.33 0.00 0.00 177.39 177.50 1xs7 n ARG 64 N -0.58 -0.73 -3.70 3.23 1.74 -1.26 -4.88 116.66 110.47 1xs7 n ARG 64 Ca 0.07 -0.16 -0.11 0.00 -0.77 0.00 0.00 57.85 56.89 1xs7 n ARG 64 Cb 0.42 -1.04 -0.11 0.00 -1.02 0.00 0.00 32.46 30.71 1xs7 n ARG 64 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1xs7 s LYS 65 N -5.92 0.41 0.47 5.56 2.20 -1.26 -5.08 119.74 116.11 1xs7 s LYS 65 Ca 0.17 0.75 0.05 0.00 -0.36 0.00 0.00 55.97 56.58 1xs7 s LYS 65 Cb -0.10 0.02 0.08 0.00 -1.51 0.00 0.00 37.83 36.32 1xs7 s LYS 65 CO 0.49 -0.14 0.64 0.41 -0.36 0.00 0.00 175.35 176.39 1xs7 n GLY 66 N 4.04 1.51 3.64 5.54 0.00 -1.26 -0.72 105.19 117.93 1xs7 n GLY 66 Ca -0.22 -2.14 -0.06 0.00 0.00 0.00 0.00 46.02 43.61 1xs7 n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xs7 s VAL 67 N -1.86 -0.03 -0.03 1.61 0.11 -0.23 -4.69 120.40 115.28 1xs7 s VAL 67 Ca 0.46 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.52 1xs7 s VAL 67 Cb -0.03 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.78 1xs7 s VAL 67 CO 0.30 0.00 0.01 -0.47 -3.33 0.00 0.00 175.10 171.61 1xs7 s TYR 68 N 1.63 3.13 -0.17 1.54 5.04 -1.26 -1.24 117.35 126.02 1xs7 s TYR 68 Ca -0.10 0.13 -0.05 0.00 -2.44 0.00 0.00 57.07 54.62 1xs7 s TYR 68 Cb -0.05 -1.71 0.09 0.00 0.35 0.00 0.00 41.96 40.63 1xs7 s TYR 68 CO -0.19 0.47 0.30 0.08 -1.34 0.00 0.00 175.55 174.87 1xs7 s VAL 69 N -1.04 -0.47 0.17 3.14 1.01 -0.32 -4.88 120.40 118.02 1xs7 s VAL 69 Ca 0.18 0.13 -0.04 0.00 0.00 0.00 0.00 61.98 62.25 1xs7 s VAL 69 Cb -0.12 -0.59 -0.05 0.00 0.00 0.00 0.00 36.38 35.63 1xs7 s VAL 69 CO 0.08 0.01 0.40 -2.16 0.00 0.00 0.00 175.10 173.43 1xs7 s PRO 70 N 2.45 3.60 0.06 2.72 0.04 -1.26 -0.98 135.00 141.63 1xs7 s PRO 70 Ca 0.04 -0.13 0.04 0.00 0.04 0.00 0.00 61.00 60.98 1xs7 s PRO 70 Cb -0.13 -2.82 -0.03 0.00 0.04 0.00 0.00 34.50 31.56 1xs7 s PRO 70 CO -0.11 0.43 -0.11 0.71 0.04 0.00 0.00 177.00 177.95 1xs7 s TYR 71 N -1.75 0.98 0.33 0.56 2.02 0.52 -4.88 117.35 115.13 1xs7 s TYR 71 Ca 0.41 -0.49 0.24 0.00 -0.37 0.00 0.00 57.07 56.86 1xs7 s TYR 71 Cb -0.12 -0.56 1.12 0.00 -0.40 0.00 0.00 41.96 42.00 1xs7 s TYR 71 CO 0.26 -0.00 1.19 2.41 -1.57 0.00 0.00 175.55 177.83 1xs7 n THR 72 N 1.32 -0.20 -3.20 -0.71 -1.04 -1.26 -1.93 114.28 107.25 1xs7 n THR 72 Ca -0.22 1.38 -0.20 0.00 -2.04 0.00 0.00 64.05 62.98 1xs7 n THR 72 Cb 0.54 -2.26 -0.07 0.00 -1.82 0.00 0.00 70.33 66.72 1xs7 n THR 72 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1xs7 s GLN 73 N -4.87 0.94 0.00 -2.82 2.00 -1.26 -5.12 119.66 108.53 1xs7 s GLN 73 Ca -0.06 -1.72 0.00 0.00 -2.00 0.00 0.00 55.36 51.58 1xs7 s GLN 73 Cb 0.24 -0.96 0.00 0.00 0.80 0.00 0.00 33.01 33.08 1xs7 s GLN 73 CO 0.62 -1.36 0.00 0.41 -0.50 0.00 0.00 175.29 174.46 1xs7 n GLY 74 N 2.96 1.31 0.00 2.59 0.00 -0.82 -4.83 105.19 106.40 1xs7 n GLY 74 Ca 0.25 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 44.31 1xs7 n GLY 74 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1xs7 n LYS 75 N -1.88 0.00 -4.36 1.61 -0.00 -1.18 0.20 118.16 112.55 1xs7 n LYS 75 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 58.31 58.10 1xs7 n LYS 75 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 35.03 34.93 1xs7 n LYS 75 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.40 179.07 1xs7 s TRP 76 N -0.77 1.83 -0.07 5.58 1.48 -0.16 -1.96 118.94 124.87 1xs7 s TRP 76 Ca 0.00 -0.50 0.02 0.00 -1.06 0.00 0.00 56.10 54.56 1xs7 s TRP 76 Cb 0.00 -0.87 0.01 0.00 -1.16 0.00 0.00 33.47 31.46 1xs7 s TRP 76 CO 0.00 0.39 -0.12 -2.00 -4.06 0.00 0.00 176.95 171.16 1xs7 s GLU 77 N -3.28 1.74 0.36 3.25 2.12 0.12 -1.17 118.70 121.85 1xs7 s GLU 77 Ca 0.21 -0.42 -0.02 0.00 0.36 0.00 0.00 54.97 55.10 1xs7 s GLU 77 Cb -0.03 -1.48 0.01 0.00 0.26 0.00 0.00 34.13 32.89 1xs7 s GLU 77 CO 0.08 -0.01 0.51 0.20 -0.54 0.00 0.00 175.26 175.49 1xs7 s GLY 78 N 0.79 1.57 -0.27 -1.50 0.00 -0.37 -1.41 107.32 106.13 1xs7 s GLY 78 Ca -0.12 -1.56 -0.03 0.00 0.00 0.00 0.00 44.72 43.01 1xs7 s GLY 78 CO 0.02 -1.00 -0.02 -0.54 0.00 0.00 0.00 173.10 171.56 1xs7 s GLU 79 N -2.84 2.81 0.34 2.90 2.02 -0.47 -1.07 118.70 122.38 1xs7 s GLU 79 Ca 0.30 -1.01 -0.29 0.00 0.02 0.00 0.00 54.97 54.00 1xs7 s GLU 79 Cb -0.01 -3.10 -0.11 0.00 0.10 0.00 0.00 34.13 31.01 1xs7 s GLU 79 CO 0.22 -0.45 1.40 -0.51 0.02 0.00 0.00 175.26 175.94 1xs7 s LEU 80 N 1.35 4.38 0.00 1.80 1.43 0.10 -2.59 118.68 125.14 1xs7 s LEU 80 Ca -0.00 2.83 0.00 0.00 -1.03 0.00 0.00 54.13 55.93 1xs7 s LEU 80 Cb -0.17 -3.65 0.00 0.00 0.03 0.00 0.00 46.19 42.39 1xs7 s LEU 80 CO -0.02 -0.69 0.00 0.61 0.23 0.00 0.00 176.35 176.47 1xs7 n GLY 81 N 0.89 2.65 3.25 -3.19 0.00 -0.97 -2.61 105.19 105.21 1xs7 n GLY 81 Ca 0.01 -0.73 -0.11 0.00 0.00 0.00 0.00 46.02 45.19 1xs7 n GLY 81 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xs7 s THR 82 N -2.84 0.09 0.29 2.61 -4.23 0.37 -1.61 115.64 110.32 1xs7 s THR 82 Ca 0.00 -0.73 -0.19 0.00 -1.18 0.00 0.00 61.69 59.59 1xs7 s THR 82 Cb 0.00 -1.02 0.06 0.00 1.34 0.00 0.00 72.50 72.88 1xs7 s THR 82 CO 0.00 -0.40 0.87 -0.62 -0.54 0.00 0.00 174.62 173.93 1xs7 s ASP 83 N -2.25 -0.05 -0.17 3.99 -1.08 -1.18 0.36 116.67 116.28 1xs7 s ASP 83 Ca -0.03 -0.85 -0.21 0.00 -0.52 0.00 0.00 52.55 50.94 1xs7 s ASP 83 Cb 0.00 0.69 -0.03 0.00 -1.46 0.00 0.00 42.92 42.13 1xs7 s ASP 83 CO -0.05 -1.36 0.62 -0.76 0.52 0.00 0.00 175.17 174.15 1xs7 s LEU 84 N -3.13 4.19 0.07 -1.34 1.43 -1.26 -2.58 118.68 116.05 1xs7 s LEU 84 Ca 0.16 0.89 0.07 0.00 -1.03 0.00 0.00 54.13 54.22 1xs7 s LEU 84 Cb -0.04 -2.90 -0.04 0.00 0.03 0.00 0.00 46.19 43.24 1xs7 s LEU 84 CO 0.08 -0.22 -0.17 -0.69 0.23 0.00 0.00 176.35 175.59 1xs7 s VAL 85 N 1.60 2.92 0.02 -1.59 1.01 0.75 0.37 120.40 125.47 1xs7 s VAL 85 Ca 0.30 -1.28 -0.07 0.00 0.00 0.00 0.00 61.98 60.93 1xs7 s VAL 85 Cb -0.16 -2.28 -0.00 0.00 0.00 0.00 0.00 36.38 33.93 1xs7 s VAL 85 CO 0.11 0.24 0.13 -0.44 0.00 0.00 0.00 175.10 175.14 1xs7 s SER 86 N -1.76 0.08 -0.56 3.32 0.01 -0.77 -0.57 113.70 113.46 1xs7 s SER 86 Ca 0.17 -0.35 -0.01 0.00 1.31 0.00 0.00 55.95 57.06 1xs7 s SER 86 Cb -0.11 0.22 0.14 0.00 0.21 0.00 0.00 66.02 66.49 1xs7 s SER 86 CO 0.08 -0.45 0.35 -0.63 0.41 0.00 0.00 173.24 173.00 1xs7 s ILE 87 N -2.00 3.37 0.04 1.44 1.01 -1.26 -1.28 121.20 122.51 1xs7 s ILE 87 Ca -0.10 -2.84 -0.07 0.00 0.00 0.00 0.00 60.65 57.64 1xs7 s ILE 87 Cb -0.04 -3.25 -0.02 0.00 0.01 0.00 0.00 42.46 39.16 1xs7 s ILE 87 CO -0.01 -0.82 0.83 -2.65 0.00 0.00 0.00 174.94 172.29 1xs7 n PRO 88 N 3.64 -0.10 -2.48 2.79 -0.02 -1.26 -0.75 135.00 136.83 1xs7 n PRO 88 Ca 0.05 0.82 -0.42 0.00 -2.02 0.00 0.00 63.50 61.94 1xs7 n PRO 88 Cb 0.38 -1.23 0.01 0.00 -0.02 0.00 0.00 33.50 32.64 1xs7 n PRO 88 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1xs7 n HIS 89 N -3.42 2.64 -3.14 6.00 8.25 -1.26 -4.88 115.22 119.41 1xs7 n HIS 89 Ca 0.00 -2.71 0.00 0.00 -0.26 0.00 0.00 57.72 54.76 1xs7 n HIS 89 Cb 0.06 -1.65 0.00 0.00 1.12 0.00 0.00 29.99 29.52 1xs7 n HIS 89 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xs7 n GLY 90 N 1.83 2.34 3.66 -1.41 0.00 0.07 -4.64 105.19 107.04 1xs7 n GLY 90 Ca 0.42 -1.11 -0.40 0.00 0.00 0.00 0.00 46.02 44.92 1xs7 n GLY 90 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1xs7 n PRO 91 N 0.00 1.55 -2.52 1.61 -0.04 -1.26 -4.80 135.00 129.54 1xs7 n PRO 91 Ca 0.00 0.56 -0.41 0.00 -0.04 0.00 0.00 63.50 63.61 1xs7 n PRO 91 Cb 0.00 -2.25 -0.01 0.00 -0.04 0.00 0.00 33.50 31.19 1xs7 n PRO 91 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1xs7 s ASN 92 N -0.75 6.56 0.09 3.54 3.84 -1.26 -4.67 114.94 122.29 1xs7 s ASN 92 Ca 0.65 -2.13 -0.10 0.00 0.21 0.00 0.00 52.86 51.49 1xs7 s ASN 92 Cb -0.50 -2.58 0.01 0.00 -0.55 0.00 0.00 41.25 37.63 1xs7 s ASN 92 CO 0.55 -1.46 0.23 0.68 -2.79 0.00 0.00 177.10 174.32 1xs7 s VAL 93 N 5.16 0.12 -0.14 -5.21 -7.23 -1.26 -5.15 120.40 106.70 1xs7 s VAL 93 Ca 0.54 -1.02 0.00 0.00 -1.81 0.00 0.00 61.98 59.69 1xs7 s VAL 93 Cb 0.02 -1.25 0.03 0.00 0.56 0.00 0.00 36.38 35.74 1xs7 s VAL 93 CO 0.05 -0.56 -0.11 -0.89 -0.31 0.00 0.00 175.10 173.27 1xs7 s THR 94 N -3.68 1.33 0.10 5.32 2.01 -1.26 -4.21 115.64 115.26 1xs7 s THR 94 Ca 0.03 -0.51 0.09 0.00 0.31 0.00 0.00 61.69 61.60 1xs7 s THR 94 Cb 0.04 -1.30 -0.04 0.00 0.01 0.00 0.00 72.50 71.21 1xs7 s THR 94 CO -0.10 0.39 -0.22 0.68 -0.69 0.00 0.00 174.62 174.68 1xs7 s VAL 95 N 1.58 1.79 -0.27 3.82 -7.23 0.27 -4.91 120.40 115.46 1xs7 s VAL 95 Ca 0.04 -1.57 -0.15 0.00 -1.81 0.00 0.00 61.98 58.49 1xs7 s VAL 95 Cb -0.13 -1.62 -0.04 0.00 0.56 0.00 0.00 36.38 35.15 1xs7 s VAL 95 CO -0.09 -0.03 0.40 -0.60 -0.31 0.00 0.00 175.10 174.46 1xs7 s ARG 96 N -1.91 4.03 0.12 4.82 3.52 -1.26 -0.18 118.95 128.09 1xs7 s ARG 96 Ca 0.08 0.09 0.04 0.00 -0.13 0.00 0.00 55.73 55.80 1xs7 s ARG 96 Cb -0.10 -3.65 -0.04 0.00 -1.56 0.00 0.00 34.95 29.60 1xs7 s ARG 96 CO 0.04 -0.29 -0.10 0.00 -0.81 0.00 0.00 175.30 174.15 1xs7 s ALA 97 N 2.10 1.28 0.11 6.12 0.00 -1.07 -4.93 121.76 125.38 1xs7 s ALA 97 Ca 0.16 -1.35 -0.31 0.00 0.00 0.00 0.00 51.96 50.46 1xs7 s ALA 97 Cb -0.16 0.04 -0.09 0.00 0.00 0.00 0.00 23.12 22.92 1xs7 s ALA 97 CO 0.10 -0.07 1.56 -0.80 0.00 0.00 0.00 175.76 176.55 1xs7 s ASN 98 N -2.83 6.64 -0.19 0.00 0.01 -1.26 -3.13 114.94 114.18 1xs7 s ASN 98 Ca 0.11 2.49 0.01 0.00 -0.71 0.00 0.00 52.86 54.77 1xs7 s ASN 98 Cb 0.00 -2.58 0.03 0.00 0.41 0.00 0.00 41.25 39.11 1xs7 s ASN 98 CO 0.00 -0.82 -0.18 -0.63 -1.51 0.00 0.00 177.10 173.96 1xs7 s ILE 99 N 1.78 2.01 -0.64 0.60 1.01 -0.63 -4.45 121.20 120.89 1xs7 s ILE 99 Ca 0.70 -0.99 -0.21 0.00 0.00 0.00 0.00 60.65 60.16 1xs7 s ILE 99 Cb -0.40 -1.86 0.09 0.00 0.01 0.00 0.00 42.46 40.29 1xs7 s ILE 99 CO 0.31 0.46 0.84 0.00 0.00 0.00 0.00 174.94 176.55 1xs7 s ALA 100 N 1.29 3.28 -0.56 9.38 0.00 0.70 -2.30 121.76 133.55 1xs7 s ALA 100 Ca 0.03 -2.08 -0.27 0.00 0.00 0.00 0.00 51.96 49.65 1xs7 s ALA 100 Cb -0.14 -3.70 -0.02 0.00 0.00 0.00 0.00 23.12 19.26 1xs7 s ALA 100 CO -0.12 -2.57 1.87 0.00 0.00 0.00 0.00 175.76 174.94 1xs7 s ALA 101 N 3.30 2.27 -0.12 0.00 0.00 -1.07 -2.80 121.76 123.34 1xs7 s ALA 101 Ca 0.17 -0.47 -0.29 0.00 0.00 0.00 0.00 51.96 51.36 1xs7 s ALA 101 Cb -0.20 -4.26 -0.05 0.00 0.00 0.00 0.00 23.12 18.61 1xs7 s ALA 101 CO 0.07 -3.71 1.81 0.42 0.00 0.00 0.00 175.76 174.36 1xs7 s ILE 102 N 8.83 3.39 -0.08 0.00 1.01 -0.31 -1.36 121.20 132.68 1xs7 s ILE 102 Ca 0.70 0.45 0.15 0.00 0.00 0.00 0.00 60.65 61.96 1xs7 s ILE 102 Cb -0.14 -3.37 -0.22 0.00 0.01 0.00 0.00 42.46 38.74 1xs7 s ILE 102 CO 0.23 -0.12 0.35 0.35 0.00 0.00 0.00 174.94 175.75 1xs7 n THR 103 N 6.19 0.00 -3.72 2.92 -2.24 -0.50 -1.30 114.28 115.64 1xs7 n THR 103 Ca 0.20 -0.32 -0.13 0.00 -2.27 0.00 0.00 64.05 61.53 1xs7 n THR 103 Cb 0.44 0.24 -0.10 0.00 -2.10 0.00 0.00 70.33 68.81 1xs7 n THR 103 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1xs7 s GLU 104 N -2.96 0.54 -0.17 -0.78 2.56 -0.64 -4.92 118.70 112.33 1xs7 s GLU 104 Ca -0.04 0.59 -0.28 0.00 0.00 0.00 0.00 54.97 55.23 1xs7 s GLU 104 Cb 0.10 0.26 0.08 0.00 2.00 0.00 0.00 34.13 36.56 1xs7 s GLU 104 CO 0.61 -0.07 0.73 -1.54 -0.56 0.00 0.00 175.26 174.43 1xs7 s SER 105 N 0.15 -0.68 -0.12 -1.70 1.04 -1.26 0.16 113.70 111.29 1xs7 s SER 105 Ca -0.01 1.05 0.03 0.00 0.48 0.00 0.00 55.95 57.50 1xs7 s SER 105 Cb -0.03 0.97 0.01 0.00 0.10 0.00 0.00 66.02 67.07 1xs7 s SER 105 CO 0.01 -0.41 -0.20 -0.62 0.98 0.00 0.00 173.24 173.00 1xs7 s ASP 106 N -0.39 2.88 -1.06 7.02 2.15 -0.83 -4.81 116.67 121.63 1xs7 s ASP 106 Ca -0.05 -0.54 -0.19 0.00 0.43 0.00 0.00 52.55 52.20 1xs7 s ASP 106 Cb -0.03 -1.32 0.01 0.00 -0.30 0.00 0.00 42.92 41.28 1xs7 s ASP 106 CO 0.05 0.08 0.71 0.29 -0.17 0.00 0.00 175.17 176.13 1xs7 n LYS 107 N 3.95 -0.98 0.11 4.34 5.02 -1.26 -3.09 118.16 126.24 1xs7 n LYS 107 Ca -0.20 0.48 0.00 0.00 -2.02 0.00 0.00 58.31 56.58 1xs7 n LYS 107 Cb 0.52 -3.36 0.00 0.00 -0.02 0.00 0.00 35.03 32.17 1xs7 n LYS 107 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1xs7 n PHE 108 N -3.94 -1.68 -2.07 2.13 7.35 -1.26 -4.09 117.46 113.89 1xs7 n PHE 108 Ca -0.14 0.30 -0.43 0.00 -0.76 0.00 0.00 57.45 56.42 1xs7 n PHE 108 Cb 0.60 0.42 -0.03 0.00 0.35 0.00 0.00 39.48 40.82 1xs7 n PHE 108 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 1xs7 s PHE 109 N -2.00 2.04 0.17 -5.13 0.40 -1.26 -4.96 117.98 107.23 1xs7 s PHE 109 Ca 0.00 0.47 -0.30 0.00 -0.60 0.00 0.00 56.93 56.50 1xs7 s PHE 109 Cb 0.00 -3.97 -0.07 0.00 0.51 0.00 0.00 43.02 39.49 1xs7 s PHE 109 CO 0.00 -3.18 0.99 0.42 0.70 0.00 0.00 175.22 174.15 1xs7 s ILE 110 N 5.09 4.22 -0.38 0.64 1.01 -1.26 -4.93 121.20 125.59 1xs7 s ILE 110 Ca 0.73 1.97 -0.29 0.00 0.00 0.00 0.00 60.65 63.06 1xs7 s ILE 110 Cb -0.27 -4.26 0.01 0.00 0.01 0.00 0.00 42.46 37.96 1xs7 s ILE 110 CO 0.29 0.36 1.22 0.21 0.00 0.00 0.00 174.94 177.03 1xs7 s ASN 111 N -0.39 6.66 0.00 3.58 3.04 -1.26 -3.06 114.94 123.50 1xs7 s ASN 111 Ca 0.46 0.88 0.00 0.00 0.04 0.00 0.00 52.86 54.24 1xs7 s ASN 111 Cb -0.26 -2.54 0.00 0.00 -1.54 0.00 0.00 41.25 36.91 1xs7 s ASN 111 CO 0.32 -1.15 0.00 0.61 -3.04 0.00 0.00 177.10 173.84 1xs7 n GLY 112 N 4.51 2.84 0.31 1.21 0.00 -1.26 -4.94 105.19 107.86 1xs7 n GLY 112 Ca 0.14 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.29 1xs7 n GLY 112 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1xs7 h SER 113 N 0.21 0.01 0.00 1.61 4.64 -1.91 -3.46 113.55 114.65 1xs7 h SER 113 Ca 0.00 0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1xs7 h SER 113 Cb 0.00 0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1xs7 h SER 113 CO 0.00 -0.17 0.00 -3.20 -0.87 0.00 0.00 176.83 172.59 1xs7 n ASN 114 N -5.23 -2.33 -4.37 4.97 5.15 -1.26 -4.98 115.26 107.20 1xs7 n ASN 114 Ca 0.22 0.00 -0.31 0.00 -0.60 0.00 0.00 54.58 53.89 1xs7 n ASN 114 Cb 0.71 -0.39 -0.15 0.00 -0.53 0.00 0.00 39.78 39.42 1xs7 n ASN 114 CO 0.00 0.00 0.00 -1.66 1.40 0.00 0.00 177.26 177.00 1xs7 s TRP 115 N -2.00 2.45 -1.31 1.20 1.48 -1.26 -4.69 118.94 114.80 1xs7 s TRP 115 Ca 0.00 -0.35 0.14 0.00 -1.06 0.00 0.00 56.10 54.83 1xs7 s TRP 115 Cb 0.00 -1.53 0.01 0.00 -1.16 0.00 0.00 33.47 30.79 1xs7 s TRP 115 CO 0.00 0.05 0.79 0.39 -4.06 0.00 0.00 176.95 174.12 1xs7 n GLU 116 N 2.33 1.73 -4.17 3.25 4.71 -0.17 -4.87 120.64 123.46 1xs7 n GLU 116 Ca -0.16 -0.81 -0.14 0.00 -0.01 0.00 0.00 57.16 56.04 1xs7 n GLU 116 Cb 0.51 -1.20 -0.08 0.00 -1.01 0.00 0.00 31.44 29.66 1xs7 n GLU 116 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1xs7 s GLY 117 N -1.60 1.56 -0.04 0.62 0.00 -1.10 -0.74 107.32 106.01 1xs7 s GLY 117 Ca 0.12 -1.64 0.01 0.00 0.00 0.00 0.00 44.72 43.21 1xs7 s GLY 117 CO 0.32 -1.22 -0.05 -1.50 0.00 0.00 0.00 173.10 170.65 1xs7 s ILE 118 N -3.71 0.58 -0.44 0.90 2.07 -0.11 0.60 121.20 121.09 1xs7 s ILE 118 Ca 0.35 -0.16 -0.13 0.00 -1.41 0.00 0.00 60.65 59.30 1xs7 s ILE 118 Cb 0.03 -0.59 0.06 0.00 0.13 0.00 0.00 42.46 42.09 1xs7 s ILE 118 CO 0.18 0.23 0.33 -0.22 -1.91 0.00 0.00 174.94 173.54 1xs7 s LEU 119 N 0.84 5.34 -0.85 8.50 2.96 0.46 -1.70 118.68 134.24 1xs7 s LEU 119 Ca -0.12 -1.30 -0.25 0.00 -0.22 0.00 0.00 54.13 52.23 1xs7 s LEU 119 Cb -0.14 -2.11 0.04 0.00 0.50 0.00 0.00 46.19 44.48 1xs7 s LEU 119 CO 0.01 -0.57 1.35 -0.83 -1.32 0.00 0.00 176.35 174.99 1xs7 s GLY 120 N 2.26 1.02 0.00 7.98 0.00 0.57 -2.22 107.32 116.93 1xs7 s GLY 120 Ca 0.04 -1.71 0.23 0.00 0.00 0.00 0.00 44.72 43.28 1xs7 s GLY 120 CO 0.06 2.67 1.77 1.04 0.00 0.00 0.00 173.10 178.63 1xs7 n LEU 121 N 9.22 0.00 0.00 0.66 4.77 -0.34 -3.96 117.00 127.35 1xs7 n LEU 121 Ca 0.15 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1xs7 n LEU 121 Cb 0.50 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 1xs7 n LEU 121 CO 0.69 -0.05 0.00 0.00 -1.33 0.00 0.00 177.39 176.70 1xs7 n ALA 122 N -1.22 0.00 -2.91 -1.18 0.00 0.11 -4.94 120.51 110.37 1xs7 n ALA 122 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.31 1xs7 n ALA 122 Cb 0.16 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.58 1xs7 n ALA 122 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1xs7 s TYR 123 N -0.44 3.48 0.18 0.00 1.51 -0.61 -4.77 117.35 116.71 1xs7 s TYR 123 Ca 0.00 0.13 -0.22 0.00 -1.01 0.00 0.00 57.07 55.97 1xs7 s TYR 123 Cb 0.00 -1.68 0.07 0.00 -0.11 0.00 0.00 41.96 40.24 1xs7 s TYR 123 CO 0.00 0.47 1.42 0.00 -1.11 0.00 0.00 175.55 176.33 1xs7 n ALA 124 N -0.75 -0.36 -0.05 3.71 0.00 -1.26 -2.09 120.51 119.71 1xs7 n ALA 124 Ca -0.07 0.85 0.01 0.00 0.00 0.00 0.00 53.44 54.23 1xs7 n ALA 124 Cb 0.55 -0.26 0.03 0.00 0.00 0.00 0.00 19.45 19.76 1xs7 n ALA 124 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1xs7 n GLU 125 N -5.25 -0.01 -0.06 0.00 4.07 -1.26 0.28 120.64 118.41 1xs7 n GLU 125 Ca 0.05 0.24 0.12 0.00 -0.06 0.00 0.00 57.16 57.51 1xs7 n GLU 125 Cb 0.30 -0.36 0.34 0.00 -0.06 0.00 0.00 31.44 31.67 1xs7 n GLU 125 CO 0.00 0.00 0.00 0.44 -0.06 0.00 0.00 177.13 177.51 1xs7 n ILE 126 N -4.18 0.17 -1.24 6.31 -5.35 -0.89 -4.66 119.36 109.52 1xs7 n ILE 126 Ca 0.03 -0.41 -0.33 0.00 -0.27 0.00 0.00 62.75 61.77 1xs7 n ILE 126 Cb 0.09 0.70 0.11 0.00 -1.74 0.00 0.00 39.64 38.79 1xs7 n ILE 126 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1xs7 s ALA 127 N -1.83 2.00 -0.02 -1.28 0.00 0.80 -4.66 121.76 116.77 1xs7 s ALA 127 Ca 0.34 0.67 0.08 0.00 0.00 0.00 0.00 51.96 53.05 1xs7 s ALA 127 Cb 0.20 -3.42 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 1xs7 s ALA 127 CO 0.30 -2.04 -0.25 1.03 0.00 0.00 0.00 175.76 174.80 1xs7 s ARG 128 N -4.28 2.04 -0.01 0.00 1.81 -1.26 -3.95 118.95 113.30 1xs7 s ARG 128 Ca 0.69 -0.89 -0.25 0.00 -1.72 0.00 0.00 55.73 53.56 1xs7 s ARG 128 Cb -0.25 -1.96 -0.19 0.00 -0.45 0.00 0.00 34.95 32.10 1xs7 s ARG 128 CO 0.50 0.53 1.33 -1.35 -0.68 0.00 0.00 175.30 175.62 1xs7 h PRO 129 N 5.55 0.02 0.00 3.54 0.11 -1.89 -3.47 132.00 135.85 1xs7 h PRO 129 Ca -0.42 -0.01 -0.64 0.00 0.11 0.00 0.00 66.00 65.05 1xs7 h PRO 129 Cb 1.13 -0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.11 1xs7 h PRO 129 CO 0.47 0.44 -0.47 -0.40 -0.21 0.00 0.00 178.00 177.83 1xs7 n ASP 130 N -4.87 3.12 -0.18 -2.05 3.85 -1.25 -5.02 116.55 110.14 1xs7 n ASP 130 Ca -0.08 -3.17 0.00 0.00 -0.71 0.00 0.00 54.79 50.82 1xs7 n ASP 130 Cb 0.23 0.43 0.00 0.00 -1.35 0.00 0.00 41.12 40.43 1xs7 n ASP 130 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 1xs7 n ASP 131 N -1.33 0.35 0.00 -1.12 5.75 -1.26 -3.22 116.55 115.72 1xs7 n ASP 131 Ca -0.19 -1.92 0.11 0.00 -0.01 0.00 0.00 54.79 52.78 1xs7 n ASP 131 Cb 0.63 -0.17 -0.02 0.00 -1.03 0.00 0.00 41.12 40.52 1xs7 n ASP 131 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1xs7 n SER 132 N -0.31 0.75 -4.54 -1.12 3.41 -1.26 -4.69 113.62 105.85 1xs7 n SER 132 Ca 0.00 -0.62 -0.42 0.00 -0.26 0.00 0.00 58.87 57.56 1xs7 n SER 132 Cb 0.09 0.87 -0.01 0.00 -0.26 0.00 0.00 64.21 64.90 1xs7 n SER 132 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1xs7 s LEU 133 N -3.28 3.99 -0.44 1.04 2.96 -1.20 -4.93 118.68 116.81 1xs7 s LEU 133 Ca 0.07 -2.09 -0.39 0.00 -0.22 0.00 0.00 54.13 51.50 1xs7 s LEU 133 Cb 0.16 -2.53 -0.17 0.00 0.50 0.00 0.00 46.19 44.14 1xs7 s LEU 133 CO 0.82 -1.24 1.89 1.21 -1.32 0.00 0.00 176.35 177.71 1xs7 n GLU 134 N 8.05 0.00 -0.73 1.98 2.13 -1.26 -4.88 120.64 125.94 1xs7 n GLU 134 Ca 0.39 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.88 1xs7 n GLU 134 Cb 0.48 -1.33 0.15 0.00 0.27 0.00 0.00 31.44 31.01 1xs7 n GLU 134 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 1xs7 n PRO 135 N 6.58 -0.73 0.14 5.31 -0.02 -1.26 -4.50 135.00 140.52 1xs7 n PRO 135 Ca 0.48 -0.17 -0.14 0.00 -2.02 0.00 0.00 63.50 61.65 1xs7 n PRO 135 Cb -0.04 -1.95 -0.08 0.00 -0.02 0.00 0.00 33.50 31.41 1xs7 n PRO 135 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1xs7 h PHE 136 N -1.81 -0.30 -0.37 6.00 3.57 -1.81 -2.87 116.94 119.36 1xs7 h PHE 136 Ca -0.47 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.13 1xs7 h PHE 136 Cb 1.30 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 40.12 1xs7 h PHE 136 CO 0.36 -0.07 0.40 0.35 -2.23 0.00 0.00 178.31 177.12 1xs7 h PHE 137 N -0.49 0.00 0.04 0.41 3.57 -1.91 0.57 116.94 119.13 1xs7 h PHE 137 Ca -0.03 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.47 1xs7 h PHE 137 Cb 0.37 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.11 1xs7 h PHE 137 CO -0.01 0.00 -0.02 -0.44 -2.23 0.00 0.00 178.31 175.61 1xs7 h ASP 138 N 0.00 -0.05 -0.83 0.41 3.32 -1.87 -1.06 116.42 116.35 1xs7 h ASP 138 Ca 0.18 -0.60 0.19 0.00 0.02 0.00 0.00 57.03 56.81 1xs7 h ASP 138 Cb 0.97 0.01 -0.11 0.00 0.22 0.00 0.00 39.33 40.42 1xs7 h ASP 138 CO -0.00 0.61 0.33 0.28 -1.72 0.00 0.00 179.24 178.74 1xs7 h SER 139 N -0.75 0.26 0.04 6.45 0.02 -0.76 0.42 113.55 119.22 1xs7 h SER 139 Ca -0.01 0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1xs7 h SER 139 Cb 0.64 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.31 1xs7 h SER 139 CO 0.01 0.03 -0.02 0.25 -1.14 0.00 0.00 176.83 175.96 1xs7 h LEU 140 N 0.40 -0.04 -1.28 5.07 5.85 -0.95 0.15 115.31 124.51 1xs7 h LEU 140 Ca 0.49 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 59.12 1xs7 h LEU 140 Cb 0.86 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 1xs7 h LEU 140 CO -0.49 -0.01 -0.34 0.58 -0.34 0.00 0.00 178.44 177.84 1xs7 h VAL 141 N -0.07 1.09 0.10 1.05 2.07 0.34 -1.91 116.25 118.92 1xs7 h VAL 141 Ca -0.00 -1.24 -0.19 0.00 0.82 0.00 0.00 66.70 66.09 1xs7 h VAL 141 Cb 0.06 1.70 0.02 0.00 -1.52 0.00 0.00 31.29 31.55 1xs7 h VAL 141 CO 0.01 0.34 -0.81 0.11 0.02 0.00 0.00 177.57 177.24 1xs7 h LYS 142 N 0.00 0.36 0.00 1.57 1.57 0.12 -3.35 116.57 116.84 1xs7 h LYS 142 Ca -0.00 -0.53 0.00 0.00 -1.87 0.00 0.00 60.65 58.25 1xs7 h LYS 142 Cb 0.67 0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.16 1xs7 h LYS 142 CO 0.04 1.22 0.00 1.96 -0.57 0.00 0.00 179.45 182.10 1xs7 h GLN 143 N -0.23 0.00 0.00 3.15 4.20 -0.69 -3.47 115.11 118.06 1xs7 h GLN 143 Ca -0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.58 1xs7 h GLN 143 Cb 1.59 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.37 1xs7 h GLN 143 CO 0.15 0.00 0.00 0.25 -0.67 0.00 0.00 178.83 178.56 1xs7 n THR 144 N -2.82 0.00 -0.06 -0.54 -2.24 -0.72 -5.06 114.28 102.84 1xs7 n THR 144 Ca 0.04 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.76 1xs7 n THR 144 Cb 0.46 0.00 -0.15 0.00 -2.10 0.00 0.00 70.33 68.55 1xs7 n THR 144 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1xs7 n HIS 145 N 0.00 0.26 -0.13 4.78 8.25 -1.26 -4.79 115.22 122.32 1xs7 n HIS 145 Ca 0.00 0.09 -0.05 0.00 -0.26 0.00 0.00 57.72 57.50 1xs7 n HIS 145 Cb 0.00 -0.97 -0.01 0.00 1.12 0.00 0.00 29.99 30.14 1xs7 n HIS 145 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1xs7 n VAL 146 N -2.74 0.00 -1.62 1.59 0.31 -1.26 -4.72 118.33 109.89 1xs7 n VAL 146 Ca -0.24 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.68 1xs7 n VAL 146 Cb 1.02 -0.04 0.02 0.00 -0.91 0.00 0.00 33.84 33.93 1xs7 n VAL 146 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1xs7 n PRO 147 N 0.30 1.36 -1.45 5.55 -0.02 -1.26 -4.74 135.00 134.74 1xs7 n PRO 147 Ca 0.02 0.49 -0.42 0.00 -2.02 0.00 0.00 63.50 61.57 1xs7 n PRO 147 Cb -0.00 -2.09 -0.03 0.00 -0.02 0.00 0.00 33.50 31.36 1xs7 n PRO 147 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1xs7 n ASN 148 N 0.36 3.34 -3.63 2.55 5.15 -1.26 -4.44 115.26 117.33 1xs7 n ASN 148 Ca 0.09 -2.76 -0.09 0.00 -0.60 0.00 0.00 54.58 51.23 1xs7 n ASN 148 Cb 0.40 -1.40 -0.07 0.00 -0.53 0.00 0.00 39.78 38.18 1xs7 n ASN 148 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1xs7 s LEU 149 N 1.67 -0.43 0.03 1.20 0.20 -1.26 -1.70 118.68 118.39 1xs7 s LEU 149 Ca 0.52 0.77 0.00 0.00 0.69 0.00 0.00 54.13 56.12 1xs7 s LEU 149 Cb 0.14 1.85 -0.02 0.00 -0.43 0.00 0.00 46.19 47.73 1xs7 s LEU 149 CO 0.01 -0.17 -0.04 0.72 -0.29 0.00 0.00 176.35 176.58 1xs7 s PHE 150 N 0.02 0.35 0.20 5.38 -0.71 -0.77 0.10 117.98 122.56 1xs7 s PHE 150 Ca 0.03 -0.61 0.09 0.00 -1.04 0.00 0.00 56.93 55.39 1xs7 s PHE 150 Cb -0.04 -0.25 -0.05 0.00 -1.21 0.00 0.00 43.02 41.47 1xs7 s PHE 150 CO -0.05 -0.21 -0.17 -1.54 -1.34 0.00 0.00 175.22 171.91 1xs7 s SER 151 N -1.72 2.84 -0.02 1.98 1.04 -0.64 0.11 113.70 117.29 1xs7 s SER 151 Ca -0.11 -0.95 0.03 0.00 0.48 0.00 0.00 55.95 55.40 1xs7 s SER 151 Cb -0.07 -0.18 -0.01 0.00 0.10 0.00 0.00 66.02 65.86 1xs7 s SER 151 CO -0.02 -0.07 -0.12 -0.76 0.98 0.00 0.00 173.24 173.25 1xs7 s LEU 152 N -3.07 1.95 -0.34 2.42 1.43 0.27 -1.83 118.68 119.51 1xs7 s LEU 152 Ca 0.21 -0.23 -0.00 0.00 -1.03 0.00 0.00 54.13 53.08 1xs7 s LEU 152 Cb -0.04 -0.65 0.11 0.00 0.03 0.00 0.00 46.19 45.65 1xs7 s LEU 152 CO 0.08 0.13 0.14 -1.58 0.23 0.00 0.00 176.35 175.35 1xs7 s GLN 153 N -0.13 0.80 -0.08 1.70 0.74 0.32 -0.86 119.66 122.15 1xs7 s GLN 153 Ca 0.02 -1.27 -0.11 0.00 0.05 0.00 0.00 55.36 54.04 1xs7 s GLN 153 Cb -0.06 -1.96 -0.05 0.00 1.10 0.00 0.00 33.01 32.04 1xs7 s GLN 153 CO 0.00 -1.05 0.27 -0.51 -0.55 0.00 0.00 175.29 173.46 1xs7 s LEU 154 N 1.32 4.40 -0.19 3.68 1.43 -1.26 0.33 118.68 128.39 1xs7 s LEU 154 Ca 0.12 0.67 0.01 0.00 -1.03 0.00 0.00 54.13 53.91 1xs7 s LEU 154 Cb -0.19 -2.33 0.03 0.00 0.03 0.00 0.00 46.19 43.73 1xs7 s LEU 154 CO -0.18 0.32 -0.17 0.00 0.23 0.00 0.00 176.35 176.55 1xs7 s GLY 156 N 1.31 2.51 0.49 0.00 0.00 -1.26 -4.72 107.32 105.64 1xs7 s GLY 156 Ca 0.03 -0.07 0.21 0.00 0.00 0.00 0.00 44.72 44.89 1xs7 s GLY 156 CO -0.11 0.78 2.05 0.00 0.00 0.00 0.00 173.10 175.81 1xs7 h ALA 157 N 6.19 1.52 0.00 3.20 0.00 -1.93 -3.43 119.26 124.82 1xs7 h ALA 157 Ca -0.43 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1xs7 h ALA 157 Cb 1.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1xs7 h ALA 157 CO 0.72 0.18 0.00 0.41 0.00 0.00 0.00 179.25 180.56 1xs7 n GLY 158 N -0.92 1.98 3.16 0.00 0.00 -1.26 -4.98 105.19 103.16 1xs7 n GLY 158 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 1xs7 n GLY 158 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1xs7 s PHE 159 N -2.33 0.94 0.24 1.61 -0.71 -1.26 -4.82 117.98 111.65 1xs7 s PHE 159 Ca 0.00 -1.25 -0.30 0.00 -1.04 0.00 0.00 56.93 54.34 1xs7 s PHE 159 Cb 0.00 -0.51 -0.09 0.00 -1.21 0.00 0.00 43.02 41.21 1xs7 s PHE 159 CO 0.00 -0.53 1.16 -1.25 -1.34 0.00 0.00 175.22 173.26 1xs7 s PRO 160 N -4.06 4.55 0.09 1.99 0.04 -1.26 -4.92 135.00 131.42 1xs7 s PRO 160 Ca 0.27 1.87 0.08 0.00 0.04 0.00 0.00 61.00 63.26 1xs7 s PRO 160 Cb 0.07 -3.20 -0.04 0.00 0.04 0.00 0.00 34.50 31.38 1xs7 s PRO 160 CO 0.04 0.04 -0.18 -0.51 0.04 0.00 0.00 177.00 176.43 1xs7 s LEU 161 N -0.95 2.69 0.15 -3.56 1.02 -1.26 -5.02 118.68 111.74 1xs7 s LEU 161 Ca 0.48 -0.50 -0.07 0.00 0.02 0.00 0.00 54.13 54.06 1xs7 s LEU 161 Cb -0.33 -1.55 -0.06 0.00 0.02 0.00 0.00 46.19 44.27 1xs7 s LEU 161 CO 0.40 0.21 0.42 0.54 0.02 0.00 0.00 176.35 177.94 1xs7 s ASN 162 N -1.89 6.55 0.63 2.29 4.22 -1.26 -4.85 114.94 120.63 1xs7 s ASN 162 Ca 0.17 0.71 0.04 0.00 -2.14 0.00 0.00 52.86 51.64 1xs7 s ASN 162 Cb -0.11 -2.14 0.23 0.00 1.28 0.00 0.00 41.25 40.52 1xs7 s ASN 162 CO 0.09 0.05 1.11 -0.61 -2.04 0.00 0.00 177.10 175.69 1xs7 h GLN 163 N 2.93 0.00 0.08 3.55 4.15 -1.99 1.66 115.11 125.48 1xs7 h GLN 163 Ca -0.47 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 58.81 1xs7 h GLN 163 Cb 1.17 0.00 0.02 0.00 0.21 0.00 0.00 27.48 28.88 1xs7 h GLN 163 CO 0.71 0.00 -0.60 0.77 -1.93 0.00 0.00 178.83 177.77 1xs7 h SER 164 N 0.00 0.39 -0.67 -0.69 0.02 -2.00 -3.20 113.55 107.40 1xs7 h SER 164 Ca 0.00 -0.90 -0.03 0.00 -0.84 0.00 0.00 61.79 60.01 1xs7 h SER 164 Cb 1.76 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 64.15 1xs7 h SER 164 CO 0.00 1.26 0.29 -0.33 -1.14 0.00 0.00 176.83 176.91 1xs7 h GLU 165 N -0.42 0.99 0.28 3.45 5.08 0.21 -1.87 114.58 122.30 1xs7 h GLU 165 Ca -0.10 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1xs7 h GLU 165 Cb 1.42 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 30.47 1xs7 h GLU 165 CO 0.11 0.81 -0.52 0.28 -1.00 0.00 0.00 179.01 178.69 1xs7 h VAL 166 N 0.94 0.01 -0.51 3.13 2.07 -1.48 -1.82 116.25 118.58 1xs7 h VAL 166 Ca 0.23 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.85 1xs7 h VAL 166 Cb 0.17 0.01 -0.10 0.00 -1.52 0.00 0.00 31.29 29.85 1xs7 h VAL 166 CO -0.02 0.00 -0.14 -0.07 0.02 0.00 0.00 177.57 177.35 1xs7 h LEU 167 N -0.86 -0.52 -5.25 2.57 3.38 -1.52 -2.22 115.31 110.89 1xs7 h LEU 167 Ca -0.03 0.16 -0.73 0.00 0.09 0.00 0.00 57.88 57.37 1xs7 h LEU 167 Cb 0.81 0.33 -0.24 0.00 0.09 0.00 0.00 40.66 41.66 1xs7 h LEU 167 CO -0.20 -0.18 1.05 0.00 0.09 0.00 0.00 178.44 179.19 1xs7 n ALA 168 N -2.90 6.44 -2.74 1.53 0.00 -0.71 -4.92 120.51 117.20 1xs7 n ALA 168 Ca 0.05 -4.03 -0.11 0.00 0.00 0.00 0.00 53.44 49.35 1xs7 n ALA 168 Cb 0.28 -2.14 -0.07 0.00 0.00 0.00 0.00 19.45 17.52 1xs7 n ALA 168 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1xs7 s SER 169 N -0.75 0.05 -0.90 0.00 0.15 -0.72 -4.85 113.70 106.68 1xs7 s SER 169 Ca 0.51 -1.15 -0.01 0.00 0.70 0.00 0.00 55.95 56.00 1xs7 s SER 169 Cb 0.35 0.50 0.25 0.00 -1.71 0.00 0.00 66.02 65.41 1xs7 s SER 169 CO -0.29 -1.01 0.94 0.52 1.20 0.00 0.00 173.24 174.60 1xs7 n VAL 170 N -0.34 3.46 -0.25 4.45 0.31 -1.26 -4.83 118.33 119.86 1xs7 n VAL 170 Ca 0.00 -5.32 -0.07 0.00 -0.01 0.00 0.00 64.34 58.94 1xs7 n VAL 170 Cb 0.64 -2.27 -0.06 0.00 -0.91 0.00 0.00 33.84 31.24 1xs7 n VAL 170 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xs7 n GLY 171 N 1.82 -1.96 0.00 2.92 0.00 -0.99 -4.80 105.19 102.19 1xs7 n GLY 171 Ca 0.24 0.78 0.00 0.00 0.00 0.00 0.00 46.02 47.05 1xs7 n GLY 171 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xs7 n GLY 172 N -1.15 2.32 3.19 -0.02 0.00 -1.22 -1.10 105.19 107.22 1xs7 n GLY 172 Ca 0.01 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.50 1xs7 n GLY 172 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xs7 s SER 173 N 2.00 -0.27 -0.40 1.61 0.01 0.15 -1.45 113.70 115.35 1xs7 s SER 173 Ca 0.00 0.81 -0.04 0.00 1.31 0.00 0.00 55.95 58.03 1xs7 s SER 173 Cb 0.00 0.85 0.10 0.00 0.21 0.00 0.00 66.02 67.18 1xs7 s SER 173 CO 0.00 -0.21 0.20 -0.32 0.41 0.00 0.00 173.24 173.32 1xs7 s MET 174 N 1.85 2.16 -0.54 12.44 0.00 -1.26 -0.52 119.30 133.43 1xs7 s MET 174 Ca -0.06 -1.70 -0.28 0.00 0.00 0.00 0.00 55.69 53.65 1xs7 s MET 174 Cb -0.10 -3.58 0.03 0.00 0.00 0.00 0.00 34.83 31.18 1xs7 s MET 174 CO -0.11 -1.01 1.13 0.42 0.00 0.00 0.00 175.02 175.44 1xs7 s ILE 175 N 1.20 4.15 -0.37 10.11 -1.09 -0.76 -4.91 121.20 129.53 1xs7 s ILE 175 Ca 0.06 0.91 -0.29 0.00 -2.23 0.00 0.00 60.65 59.09 1xs7 s ILE 175 Cb -0.23 -4.65 0.02 0.00 -1.58 0.00 0.00 42.46 36.02 1xs7 s ILE 175 CO -0.03 -1.18 1.19 -0.63 -1.23 0.00 0.00 174.94 173.06 1xs7 s ILE 176 N 4.60 4.26 -0.33 2.92 -1.09 -1.26 -1.62 121.20 128.67 1xs7 s ILE 176 Ca 0.42 1.39 -0.01 0.00 -2.23 0.00 0.00 60.65 60.22 1xs7 s ILE 176 Cb -0.08 -4.38 0.00 0.00 -1.58 0.00 0.00 42.46 36.42 1xs7 s ILE 176 CO 0.27 -0.66 0.13 0.61 -1.23 0.00 0.00 174.94 174.05 1xs7 n GLY 177 N 4.40 0.42 0.00 6.18 0.00 0.11 -4.74 105.19 111.56 1xs7 n GLY 177 Ca 0.13 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1xs7 n GLY 177 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xs7 n GLY 178 N -0.91 -1.20 2.74 -0.02 0.00 -1.20 -4.45 105.19 100.15 1xs7 n GLY 178 Ca -0.02 -0.96 -0.24 0.00 0.00 0.00 0.00 46.02 44.79 1xs7 n GLY 178 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xs7 s ILE 179 N -2.34 0.35 -0.39 -0.61 1.01 -1.26 -4.01 121.20 113.95 1xs7 s ILE 179 Ca 0.00 -0.08 -0.16 0.00 0.00 0.00 0.00 60.65 60.40 1xs7 s ILE 179 Cb 0.00 -0.66 0.01 0.00 0.01 0.00 0.00 42.46 41.82 1xs7 s ILE 179 CO 0.00 0.07 0.39 -0.62 0.00 0.00 0.00 174.94 174.78 1xs7 s ASP 180 N 1.97 6.18 0.56 3.58 3.68 -1.26 -4.16 116.67 127.21 1xs7 s ASP 180 Ca 0.03 -0.53 0.26 0.00 2.13 0.00 0.00 52.55 54.43 1xs7 s ASP 180 Cb -0.14 -2.20 1.50 0.00 -1.45 0.00 0.00 42.92 40.62 1xs7 s ASP 180 CO -0.06 -0.47 2.06 0.45 0.13 0.00 0.00 175.17 177.28 1xs7 h HIS 181 N 8.62 0.00 0.00 -5.34 3.86 -1.82 -2.47 115.15 118.00 1xs7 h HIS 181 Ca -0.28 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.93 1xs7 h HIS 181 Cb 1.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.59 1xs7 h HIS 181 CO 0.64 0.00 0.00 -1.13 0.86 0.00 0.00 177.93 178.30 1xs7 n SER 182 N -4.11 0.47 -0.23 2.45 3.41 -1.26 -2.42 113.62 111.93 1xs7 n SER 182 Ca 0.04 0.67 0.13 0.00 -0.26 0.00 0.00 58.87 59.45 1xs7 n SER 182 Cb 0.40 -0.75 0.38 0.00 -0.26 0.00 0.00 64.21 63.99 1xs7 n SER 182 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1xs7 n LEU 183 N -2.08 0.98 -3.87 1.04 4.77 -0.93 -4.80 117.00 112.11 1xs7 n LEU 183 Ca 0.00 -0.24 -0.09 0.00 -0.03 0.00 0.00 56.01 55.65 1xs7 n LEU 183 Cb 0.10 -0.13 -0.06 0.00 -2.33 0.00 0.00 43.42 41.00 1xs7 n LEU 183 CO 0.12 0.18 0.04 -0.72 -1.33 0.00 0.00 177.39 175.68 1xs7 s TYR 184 N -2.52 0.21 0.50 -1.77 1.13 -1.01 0.87 117.35 114.76 1xs7 s TYR 184 Ca 0.24 -0.58 0.01 0.00 -1.41 0.00 0.00 57.07 55.34 1xs7 s TYR 184 Cb 0.19 0.06 -0.01 0.00 -1.10 0.00 0.00 41.96 41.10 1xs7 s TYR 184 CO 0.52 -0.73 0.02 0.95 -2.51 0.00 0.00 175.55 173.80 1xs7 s THR 185 N -3.92 1.05 0.38 -3.49 -4.23 -0.38 -4.80 115.64 100.24 1xs7 s THR 185 Ca 0.12 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.63 1xs7 s THR 185 Cb 0.03 -2.14 0.00 0.00 1.34 0.00 0.00 72.50 71.73 1xs7 s THR 185 CO -0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.66 1xs7 n GLY 186 N -1.24 -2.12 3.84 3.99 0.00 -1.26 -3.51 105.19 104.90 1xs7 n GLY 186 Ca -0.18 -1.14 -0.29 0.00 0.00 0.00 0.00 46.02 44.40 1xs7 n GLY 186 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xs7 s SER 187 N -7.12 3.25 -0.30 1.61 0.01 -1.26 -4.86 113.70 105.03 1xs7 s SER 187 Ca 0.00 0.62 0.00 0.00 1.31 0.00 0.00 55.95 57.88 1xs7 s SER 187 Cb 0.00 -0.94 0.06 0.00 0.21 0.00 0.00 66.02 65.36 1xs7 s SER 187 CO 0.00 -2.68 -0.02 -0.22 0.41 0.00 0.00 173.24 170.73 1xs7 s LEU 188 N -6.00 3.92 0.22 2.44 0.20 -1.26 -4.56 118.68 113.63 1xs7 s LEU 188 Ca 0.68 -1.45 -0.13 0.00 0.69 0.00 0.00 54.13 53.92 1xs7 s LEU 188 Cb -0.09 -1.66 -0.08 0.00 -0.43 0.00 0.00 46.19 43.93 1xs7 s LEU 188 CO 0.53 -0.27 0.60 0.26 -0.29 0.00 0.00 176.35 177.18 1xs7 s TRP 189 N 1.16 3.50 0.01 5.38 0.52 -0.28 -4.82 118.94 124.42 1xs7 s TRP 189 Ca -0.04 1.06 0.08 0.00 0.02 0.00 0.00 56.10 57.22 1xs7 s TRP 189 Cb -0.20 -2.39 -0.02 0.00 -1.15 0.00 0.00 33.47 29.71 1xs7 s TRP 189 CO -0.03 0.30 -0.25 0.71 0.02 0.00 0.00 176.95 177.69 1xs7 s TYR 190 N -1.70 2.36 -0.02 -1.98 1.51 -1.26 -0.69 117.35 115.56 1xs7 s TYR 190 Ca 0.45 -0.40 0.07 0.00 -1.01 0.00 0.00 57.07 56.18 1xs7 s TYR 190 Cb -0.13 -1.46 -0.02 0.00 -0.11 0.00 0.00 41.96 40.25 1xs7 s TYR 190 CO 0.20 0.06 -0.24 -0.08 -1.11 0.00 0.00 175.55 174.38 1xs7 s THR 191 N -0.72 1.89 0.74 -0.71 -1.32 -1.00 -3.69 115.64 110.83 1xs7 s THR 191 Ca 0.11 -1.02 -0.14 0.00 -1.21 0.00 0.00 61.69 59.43 1xs7 s THR 191 Cb -0.10 -1.57 0.05 0.00 -1.51 0.00 0.00 72.50 69.37 1xs7 s THR 191 CO 0.01 0.53 1.15 -2.84 -2.21 0.00 0.00 174.62 171.26 1xs7 s PRO 192 N -0.55 2.19 -0.32 7.08 0.02 -1.26 -1.35 135.00 140.81 1xs7 s PRO 192 Ca 0.09 1.52 -0.13 0.00 0.02 0.00 0.00 61.00 62.50 1xs7 s PRO 192 Cb -0.09 -1.86 -0.03 0.00 0.02 0.00 0.00 34.50 32.54 1xs7 s PRO 192 CO -0.01 -1.75 0.25 0.42 -0.33 0.00 0.00 177.00 175.58 1xs7 s ILE 193 N -2.34 5.27 0.00 2.83 1.01 -1.09 -4.59 121.20 122.30 1xs7 s ILE 193 Ca 0.69 -0.03 0.00 0.00 0.00 0.00 0.00 60.65 61.31 1xs7 s ILE 193 Cb -0.24 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.56 1xs7 s ILE 193 CO 0.48 0.07 0.72 -1.14 0.00 0.00 0.00 174.94 175.07 1xs7 n ARG 194 N 5.14 0.00 -5.26 2.79 0.63 -0.10 -4.76 116.66 115.10 1xs7 n ARG 194 Ca -0.12 0.30 -0.31 0.00 -0.92 0.00 0.00 57.85 56.79 1xs7 n ARG 194 Cb 0.50 -1.22 -0.16 0.00 0.45 0.00 0.00 32.46 32.03 1xs7 n ARG 194 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 1xs7 s ARG 195 N -1.89 2.56 -0.91 -0.14 3.52 -1.26 -5.04 118.95 115.80 1xs7 s ARG 195 Ca 0.00 -0.90 -0.07 0.00 -0.13 0.00 0.00 55.73 54.63 1xs7 s ARG 195 Cb 0.00 -2.16 -0.10 0.00 -1.56 0.00 0.00 34.95 31.13 1xs7 s ARG 195 CO 0.00 0.37 2.56 0.39 -0.81 0.00 0.00 175.30 177.81 1xs7 n GLU 196 N 2.98 2.44 0.00 5.12 1.02 -1.26 -4.15 120.64 126.79 1xs7 n GLU 196 Ca -0.17 -1.51 0.00 0.00 -0.02 0.00 0.00 57.16 55.46 1xs7 n GLU 196 Cb 0.52 -2.41 0.00 0.00 -0.02 0.00 0.00 31.44 29.53 1xs7 n GLU 196 CO 0.00 0.00 0.00 -2.67 1.18 0.00 0.00 177.13 175.64 1xs7 n TRP 197 N 3.61 0.00 -2.50 -0.32 4.27 -1.26 -4.65 117.44 116.59 1xs7 n TRP 197 Ca 0.52 0.00 -0.25 0.00 -3.89 0.00 0.00 57.50 53.88 1xs7 n TRP 197 Cb 0.30 0.00 0.13 0.00 -1.36 0.00 0.00 31.31 30.38 1xs7 n TRP 197 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 1xs7 s TYR 198 N -0.35 1.40 -1.04 -2.67 2.02 -1.26 -1.57 117.35 113.89 1xs7 s TYR 198 Ca 0.00 -0.25 -0.15 0.00 -0.37 0.00 0.00 57.07 56.30 1xs7 s TYR 198 Cb 0.00 -3.17 0.18 0.00 -0.40 0.00 0.00 41.96 38.58 1xs7 s TYR 198 CO 0.00 -1.94 1.17 0.71 -1.57 0.00 0.00 175.55 173.92 1xs7 s TYR 199 N -3.28 3.54 -0.06 2.71 1.51 -1.26 -4.83 117.35 115.68 1xs7 s TYR 199 Ca 0.69 -1.95 -0.19 0.00 -1.01 0.00 0.00 57.07 54.61 1xs7 s TYR 199 Cb -0.04 -4.15 -0.05 0.00 -0.11 0.00 0.00 41.96 37.61 1xs7 s TYR 199 CO 0.46 -1.29 0.51 -2.00 -1.11 0.00 0.00 175.55 172.12 1xs7 s GLU 200 N 1.28 4.27 0.45 -0.62 2.12 -1.26 -1.82 118.70 123.12 1xs7 s GLU 200 Ca 0.33 0.56 0.03 0.00 0.36 0.00 0.00 54.97 56.25 1xs7 s GLU 200 Cb -0.06 -3.37 -0.01 0.00 0.26 0.00 0.00 34.13 30.95 1xs7 s GLU 200 CO -0.06 0.32 0.12 0.14 -0.54 0.00 0.00 175.26 175.24 1xs7 s VAL 201 N 0.06 0.61 -0.05 3.70 -7.23 -0.53 -0.92 120.40 116.03 1xs7 s VAL 201 Ca 0.28 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.46 1xs7 s VAL 201 Cb -0.17 -2.22 0.02 0.00 0.56 0.00 0.00 36.38 34.58 1xs7 s VAL 201 CO 0.13 0.00 -0.05 -0.63 -0.31 0.00 0.00 175.10 174.24 1xs7 s ILE 202 N -3.11 0.61 -0.09 -0.62 1.01 -1.26 -4.19 121.20 113.56 1xs7 s ILE 202 Ca 0.17 -0.16 -0.13 0.00 0.00 0.00 0.00 60.65 60.54 1xs7 s ILE 202 Cb 0.01 -0.63 -0.05 0.00 0.01 0.00 0.00 42.46 41.80 1xs7 s ILE 202 CO 0.12 0.25 0.31 -0.63 0.00 0.00 0.00 174.94 174.99 1xs7 s ILE 203 N 0.97 5.23 -0.02 2.92 1.01 -1.26 -2.13 121.20 127.93 1xs7 s ILE 203 Ca -0.10 0.61 0.08 0.00 0.00 0.00 0.00 60.65 61.24 1xs7 s ILE 203 Cb -0.14 -3.62 -0.13 0.00 0.01 0.00 0.00 42.46 38.58 1xs7 s ILE 203 CO 0.00 0.51 0.19 1.33 0.00 0.00 0.00 174.94 176.97 1xs7 n VAL 204 N 2.54 0.00 -3.62 2.92 0.24 0.15 -4.71 118.33 115.86 1xs7 n VAL 204 Ca -0.14 -0.19 -0.16 0.00 -2.04 0.00 0.00 64.34 61.81 1xs7 n VAL 204 Cb 0.53 0.32 -0.07 0.00 -1.47 0.00 0.00 33.84 33.14 1xs7 n VAL 204 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1xs7 s ARG 205 N -2.57 0.86 -0.05 7.34 3.52 -1.23 -4.70 118.95 122.12 1xs7 s ARG 205 Ca -0.03 0.30 -0.01 0.00 -0.13 0.00 0.00 55.73 55.86 1xs7 s ARG 205 Cb 0.05 0.41 0.03 0.00 -1.56 0.00 0.00 34.95 33.88 1xs7 s ARG 205 CO 0.35 -0.23 0.00 0.08 -0.81 0.00 0.00 175.30 174.69 1xs7 s VAL 206 N -0.82 0.30 0.22 7.11 1.01 -1.26 -0.49 120.40 126.47 1xs7 s VAL 206 Ca -0.09 0.11 0.11 0.00 0.00 0.00 0.00 61.98 62.11 1xs7 s VAL 206 Cb -0.02 -0.43 -0.05 0.00 0.00 0.00 0.00 36.38 35.88 1xs7 s VAL 206 CO 0.06 0.22 -0.18 -1.61 0.00 0.00 0.00 175.10 173.59 1xs7 s GLU 207 N 1.60 1.73 -0.21 2.72 2.02 -0.71 -0.21 118.70 125.64 1xs7 s GLU 207 Ca -0.01 -1.53 -0.02 0.00 0.02 0.00 0.00 54.97 53.42 1xs7 s GLU 207 Cb -0.13 -1.91 0.06 0.00 0.10 0.00 0.00 34.13 32.25 1xs7 s GLU 207 CO -0.03 0.38 0.03 0.42 0.02 0.00 0.00 175.26 176.08 1xs7 s ILE 208 N -1.95 0.67 -1.82 -1.63 -1.09 -0.67 -2.39 121.20 112.31 1xs7 s ILE 208 Ca 0.25 -0.70 0.00 0.00 -2.23 0.00 0.00 60.65 57.96 1xs7 s ILE 208 Cb -0.07 -1.17 0.00 0.00 -1.58 0.00 0.00 42.46 39.64 1xs7 s ILE 208 CO 0.13 -0.23 0.00 0.59 -1.23 0.00 0.00 174.94 174.20 1xs7 n ASN 209 N 4.99 -5.17 0.00 3.58 4.13 -0.55 -1.23 115.26 121.02 1xs7 n ASN 209 Ca -0.09 0.34 0.00 0.00 1.68 0.00 0.00 54.58 56.52 1xs7 n ASN 209 Cb 0.46 -4.24 0.00 0.00 -1.54 0.00 0.00 39.78 34.46 1xs7 n ASN 209 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1xs7 n GLY 210 N -0.83 0.87 3.60 7.41 0.00 -1.26 -5.00 105.19 109.97 1xs7 n GLY 210 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 1xs7 n GLY 210 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xs7 s GLN 211 N -0.68 3.81 0.12 1.61 0.74 -0.36 -4.96 119.66 119.94 1xs7 s GLN 211 Ca 0.00 0.45 -0.32 0.00 0.05 0.00 0.00 55.36 55.54 1xs7 s GLN 211 Cb 0.00 -3.80 -0.11 0.00 1.10 0.00 0.00 33.01 30.20 1xs7 s GLN 211 CO 0.00 -0.87 1.81 -3.47 -0.55 0.00 0.00 175.29 172.21 1xs7 n ASP 212 N 6.53 3.92 0.07 6.67 2.03 -1.26 -1.67 116.55 132.84 1xs7 n ASP 212 Ca 0.05 1.00 0.07 0.00 0.52 0.00 0.00 54.79 56.43 1xs7 n ASP 212 Cb 0.48 -1.52 0.33 0.00 -0.72 0.00 0.00 41.12 39.68 1xs7 n ASP 212 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1xs7 n LEU 213 N 5.40 0.29 -3.87 -2.67 7.94 0.71 -4.89 117.00 119.91 1xs7 n LEU 213 Ca 0.18 0.60 -0.35 0.00 -1.11 0.00 0.00 56.01 55.33 1xs7 n LEU 213 Cb 0.36 -0.60 0.02 0.00 0.53 0.00 0.00 43.42 43.72 1xs7 n LEU 213 CO 0.66 -0.57 -0.15 1.17 -1.11 0.00 0.00 177.39 177.39 1xs7 n LYS 214 N -1.85 -0.86 -4.40 1.96 4.81 -1.26 -5.01 118.16 111.55 1xs7 n LYS 214 Ca 0.01 0.42 -0.22 0.00 -0.87 0.00 0.00 58.31 57.65 1xs7 n LYS 214 Cb 0.10 -2.91 -0.10 0.00 0.02 0.00 0.00 35.03 32.13 1xs7 n LYS 214 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 1xs7 s MET 215 N -6.20 1.48 -0.13 1.64 -1.94 -1.26 -5.06 119.30 107.84 1xs7 s MET 215 Ca 0.32 -1.63 -0.29 0.00 -1.71 0.00 0.00 55.69 52.38 1xs7 s MET 215 Cb -0.16 -1.48 -0.06 0.00 2.01 0.00 0.00 34.83 35.14 1xs7 s MET 215 CO 0.92 0.28 2.00 0.34 -0.01 0.00 0.00 175.02 178.55 1xs7 s ASP 216 N -3.24 6.00 0.34 3.03 3.68 -1.26 -4.81 116.67 120.40 1xs7 s ASP 216 Ca 0.24 2.11 0.13 0.00 2.13 0.00 0.00 52.55 57.17 1xs7 s ASP 216 Cb -0.04 -2.52 1.06 0.00 -1.45 0.00 0.00 42.92 39.97 1xs7 s ASP 216 CO 0.10 -1.49 1.64 0.00 0.13 0.00 0.00 175.17 175.55 1xs7 h LYS 218 N 0.22 0.13 -0.72 0.00 1.57 -1.84 0.61 116.57 116.54 1xs7 h LYS 218 Ca 0.72 -0.01 0.19 0.00 -1.87 0.00 0.00 60.65 59.68 1xs7 h LYS 218 Cb 1.68 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 33.92 1xs7 h LYS 218 CO -0.67 0.08 0.50 0.93 -0.57 0.00 0.00 179.45 179.73 1xs7 h GLU 219 N 0.13 0.14 -0.03 3.15 4.39 -1.06 0.51 114.58 121.81 1xs7 h GLU 219 Ca 0.63 -0.01 -0.15 0.00 0.34 0.00 0.00 59.36 60.17 1xs7 h GLU 219 Cb 1.38 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.98 1xs7 h GLU 219 CO -0.74 0.09 -0.66 1.88 -1.16 0.00 0.00 179.01 178.42 1xs7 h TYR 220 N 0.14 0.20 -0.50 4.33 0.99 0.10 -2.91 116.97 119.32 1xs7 h TYR 220 Ca 0.35 -0.08 0.00 0.00 2.00 0.00 0.00 58.73 61.00 1xs7 h TYR 220 Cb 1.18 -0.03 0.00 0.00 1.00 0.00 0.00 36.73 38.88 1xs7 h TYR 220 CO -0.00 0.77 0.00 0.09 -0.00 0.00 0.00 178.16 179.02 1xs7 n ASN 221 N -3.80 3.63 -4.47 3.88 3.02 0.75 -4.49 115.26 113.77 1xs7 n ASN 221 Ca -0.02 -1.99 -0.60 0.00 -0.03 0.00 0.00 54.58 51.94 1xs7 n ASN 221 Cb 0.66 -0.33 -0.10 0.00 -0.61 0.00 0.00 39.78 39.40 1xs7 n ASN 221 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xs7 n TYR 222 N 1.54 1.52 0.00 3.10 9.36 0.15 -0.65 117.16 132.18 1xs7 n TYR 222 Ca 0.21 0.73 0.00 0.00 3.32 0.00 0.00 57.90 62.16 1xs7 n TYR 222 Cb 0.61 -2.35 0.00 0.00 -0.63 0.00 0.00 39.34 36.97 1xs7 n TYR 222 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 1xs7 n ASP 223 N 6.81 0.00 0.00 2.98 4.64 -1.26 -3.54 116.55 126.18 1xs7 n ASP 223 Ca 0.42 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.83 1xs7 n ASP 223 Cb 0.03 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.11 1xs7 n ASP 223 CO 0.00 0.00 0.00 2.29 -0.82 0.00 0.00 177.20 178.67 1xs7 n LYS 224 N 0.00 0.00 -4.43 -0.67 2.85 0.18 -4.84 118.16 111.25 1xs7 n LYS 224 Ca 0.00 0.00 -0.31 0.00 -1.05 0.00 0.00 58.31 56.95 1xs7 n LYS 224 Cb 0.00 0.00 -0.17 0.00 -0.65 0.00 0.00 35.03 34.21 1xs7 n LYS 224 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 1xs7 s SER 225 N 0.00 2.77 0.15 -5.58 0.01 -1.26 0.64 113.70 110.44 1xs7 s SER 225 Ca 0.00 -0.52 0.06 0.00 1.31 0.00 0.00 55.95 56.80 1xs7 s SER 225 Cb 0.00 -1.26 -0.04 0.00 0.21 0.00 0.00 66.02 64.93 1xs7 s SER 225 CO 0.00 0.03 -0.13 0.27 0.41 0.00 0.00 173.24 173.82 1xs7 s ILE 226 N 1.03 1.40 -0.57 1.44 -4.36 -0.27 -1.45 121.20 118.42 1xs7 s ILE 226 Ca -0.04 -1.97 -0.11 0.00 -0.26 0.00 0.00 60.65 58.27 1xs7 s ILE 226 Cb -0.15 -1.78 0.14 0.00 1.25 0.00 0.00 42.46 41.93 1xs7 s ILE 226 CO -0.04 -0.57 0.47 -0.69 0.24 0.00 0.00 174.94 174.35 1xs7 s VAL 227 N -2.75 4.70 -0.40 8.37 1.01 -0.75 -0.96 120.40 129.62 1xs7 s VAL 227 Ca 0.15 -1.92 0.03 0.00 0.00 0.00 0.00 61.98 60.24 1xs7 s VAL 227 Cb -0.01 -4.03 0.11 0.00 0.00 0.00 0.00 36.38 32.45 1xs7 s VAL 227 CO 0.03 -0.86 0.13 -0.62 0.00 0.00 0.00 175.10 173.78 1xs7 s ASP 228 N 2.68 4.76 0.46 3.32 2.15 -1.05 -4.58 116.67 124.42 1xs7 s ASP 228 Ca 0.08 -2.34 0.26 0.00 0.43 0.00 0.00 52.55 50.98 1xs7 s ASP 228 Cb -0.24 -1.67 1.43 0.00 -0.30 0.00 0.00 42.92 42.14 1xs7 s ASP 228 CO -0.01 -0.37 1.78 0.77 -0.17 0.00 0.00 175.17 177.17 1xs7 h SER 229 N 7.42 0.00 0.55 -0.34 4.64 -1.86 -1.00 113.55 122.96 1xs7 h SER 229 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1xs7 h SER 229 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 1xs7 h SER 229 CO 0.58 0.00 -0.20 0.61 -0.87 0.00 0.00 176.83 176.95 1xs7 n GLY 230 N -1.23 -1.15 3.82 -0.77 0.00 -1.26 -4.34 105.19 100.26 1xs7 n GLY 230 Ca -0.02 -0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 1xs7 n GLY 230 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xs7 s THR 231 N -2.76 4.99 -0.11 2.61 2.01 -0.38 -4.98 115.64 117.01 1xs7 s THR 231 Ca 0.20 -0.23 -0.06 0.00 0.31 0.00 0.00 61.69 61.91 1xs7 s THR 231 Cb 0.19 -3.26 -0.02 0.00 0.01 0.00 0.00 72.50 69.42 1xs7 s THR 231 CO 0.56 0.41 -0.11 0.74 -0.69 0.00 0.00 174.62 175.53 1xs7 h THR 232 N 3.33 0.00 -3.46 -0.82 2.02 -1.86 0.54 112.91 112.67 1xs7 h THR 232 Ca -0.50 -0.88 -0.41 0.00 0.77 0.00 0.00 66.41 65.39 1xs7 h THR 232 Cb 1.19 0.00 0.20 0.00 -1.74 0.00 0.00 68.15 67.80 1xs7 h THR 232 CO 0.62 0.00 0.12 0.20 0.37 0.00 0.00 175.52 176.83 1xs7 s ASN 233 N -5.41 0.71 -0.51 4.18 0.01 -1.26 -2.29 114.94 110.38 1xs7 s ASN 233 Ca -0.09 0.61 -0.16 0.00 -0.71 0.00 0.00 52.86 52.51 1xs7 s ASN 233 Cb 0.01 -0.83 0.10 0.00 0.41 0.00 0.00 41.25 40.94 1xs7 s ASN 233 CO 0.14 -4.25 0.46 -0.22 -1.51 0.00 0.00 177.10 171.72 1xs7 s LEU 234 N -7.02 5.86 -0.01 0.60 0.20 -0.67 -2.94 118.68 114.70 1xs7 s LEU 234 Ca 0.71 -1.52 -0.26 0.00 0.69 0.00 0.00 54.13 53.74 1xs7 s LEU 234 Cb -0.09 -2.20 -0.04 0.00 -0.43 0.00 0.00 46.19 43.42 1xs7 s LEU 234 CO 0.56 -0.76 0.82 -0.13 -0.29 0.00 0.00 176.35 176.55 1xs7 s ARG 235 N 1.67 4.50 -0.00 1.98 1.81 0.34 -2.22 118.95 127.03 1xs7 s ARG 235 Ca 0.04 1.13 0.04 0.00 -1.72 0.00 0.00 55.73 55.22 1xs7 s ARG 235 Cb -0.27 -3.43 -0.01 0.00 -0.45 0.00 0.00 34.95 30.79 1xs7 s ARG 235 CO 0.05 0.08 -0.13 -0.51 -0.68 0.00 0.00 175.30 174.11 1xs7 s LEU 236 N 0.64 2.05 0.35 2.53 1.43 0.26 -0.55 118.68 125.39 1xs7 s LEU 236 Ca 0.43 -0.27 -0.27 0.00 -1.03 0.00 0.00 54.13 52.99 1xs7 s LEU 236 Cb -0.20 -0.67 -0.12 0.00 0.03 0.00 0.00 46.19 45.23 1xs7 s LEU 236 CO 0.23 0.14 1.20 -2.65 0.23 0.00 0.00 176.35 175.50 1xs7 n PRO 237 N 2.63 1.85 0.00 1.29 -0.02 -1.25 0.08 135.00 139.58 1xs7 n PRO 237 Ca -0.15 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1xs7 n PRO 237 Cb 0.55 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 1xs7 n PRO 237 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1xs7 n LYS 238 N 0.47 0.00 -0.35 -0.52 4.81 -1.25 0.30 118.16 121.62 1xs7 n LYS 238 Ca 0.06 0.84 0.33 0.00 -0.87 0.00 0.00 58.31 58.68 1xs7 n LYS 238 Cb 0.36 -1.29 0.60 0.00 0.02 0.00 0.00 35.03 34.72 1xs7 n LYS 238 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 1xs7 h LYS 239 N 0.00 0.01 0.07 1.64 3.64 -1.94 0.14 116.57 120.13 1xs7 h LYS 239 Ca 0.00 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1xs7 h LYS 239 Cb 0.00 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1xs7 h LYS 239 CO 0.00 0.01 -0.03 0.28 -2.27 0.00 0.00 179.45 177.43 1xs7 h VAL 240 N 0.01 0.00 -0.77 2.00 2.07 -1.29 -3.16 116.25 115.12 1xs7 h VAL 240 Ca 0.85 -0.38 0.17 0.00 0.82 0.00 0.00 66.70 68.17 1xs7 h VAL 240 Cb 2.33 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 31.96 1xs7 h VAL 240 CO -0.71 0.00 -0.12 0.33 0.02 0.00 0.00 177.57 177.09 1xs7 n PHE 241 N -3.31 0.35 -0.36 1.57 7.35 0.15 0.17 117.46 123.38 1xs7 n PHE 241 Ca -0.01 0.94 -0.02 0.00 -0.76 0.00 0.00 57.45 57.60 1xs7 n PHE 241 Cb 0.04 -0.99 0.11 0.00 0.35 0.00 0.00 39.48 38.98 1xs7 n PHE 241 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 1xs7 h GLU 242 N 0.00 1.25 -0.42 -4.13 5.08 -0.89 0.22 114.58 115.69 1xs7 h GLU 242 Ca 0.41 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.57 1xs7 h GLU 242 Cb 0.71 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 1xs7 h GLU 242 CO -0.77 0.82 -0.22 0.00 -1.00 0.00 0.00 179.01 177.84 1xs7 h ALA 243 N 1.37 0.59 0.34 3.43 0.00 0.18 -2.12 119.26 123.05 1xs7 h ALA 243 Ca 0.36 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1xs7 h ALA 243 Cb -0.11 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 1xs7 h ALA 243 CO -0.09 0.57 -0.19 0.00 0.00 0.00 0.00 179.25 179.53 1xs7 h ALA 244 N 0.82 -0.50 -0.97 0.00 0.00 0.33 -2.30 119.26 116.64 1xs7 h ALA 244 Ca 0.09 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.95 1xs7 h ALA 244 Cb 0.79 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.75 1xs7 h ALA 244 CO 0.06 -0.79 0.63 0.28 0.00 0.00 0.00 179.25 179.44 1xs7 h VAL 245 N -0.51 1.12 -0.45 0.00 2.07 -0.57 0.17 116.25 118.08 1xs7 h VAL 245 Ca -0.04 -0.40 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 1xs7 h VAL 245 Cb 0.41 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 1xs7 h VAL 245 CO 0.05 0.21 0.27 0.11 0.02 0.00 0.00 177.57 178.23 1xs7 h LYS 246 N 1.17 0.60 0.20 1.57 1.57 -1.16 0.17 116.57 120.69 1xs7 h LYS 246 Ca 0.41 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 59.13 1xs7 h LYS 246 Cb 0.11 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1xs7 h LYS 246 CO -0.14 0.43 -0.10 1.03 -0.57 0.00 0.00 179.45 180.10 1xs7 h SER 247 N 0.62 -0.23 -0.97 0.86 0.87 -0.47 -2.14 113.55 112.09 1xs7 h SER 247 Ca 0.16 -0.12 0.19 0.00 -1.23 0.00 0.00 61.79 60.80 1xs7 h SER 247 Cb -0.02 0.06 -0.09 0.00 -0.44 0.00 0.00 62.40 61.91 1xs7 h SER 247 CO -0.03 0.28 0.61 0.40 -0.53 0.00 0.00 176.83 177.56 1xs7 h ILE 248 N -1.03 0.71 0.63 2.23 2.04 -0.66 0.66 117.51 122.08 1xs7 h ILE 248 Ca -0.03 -0.22 -0.03 0.00 1.00 0.00 0.00 64.86 65.58 1xs7 h ILE 248 Cb 0.33 0.01 0.01 0.00 -0.74 0.00 0.00 36.82 36.43 1xs7 h ILE 248 CO 0.05 0.12 -0.30 0.11 0.00 0.00 0.00 178.15 178.12 1xs7 h LYS 249 N 0.64 -0.81 -0.89 2.37 1.57 -0.72 -2.88 116.57 115.85 1xs7 h LYS 249 Ca 0.53 0.06 0.12 0.00 -1.87 0.00 0.00 60.65 59.49 1xs7 h LYS 249 Cb 0.99 0.18 -0.08 0.00 0.08 0.00 0.00 32.23 33.40 1xs7 h LYS 249 CO -0.29 -0.50 0.52 0.00 -0.57 0.00 0.00 179.45 178.61 1xs7 h ALA 250 N -0.70 1.33 0.00 3.86 0.00 -0.53 -1.08 119.26 122.14 1xs7 h ALA 250 Ca -0.09 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1xs7 h ALA 250 Cb 0.69 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1xs7 h ALA 250 CO 0.14 0.09 -0.05 0.00 0.00 0.00 0.00 179.25 179.43 1xs7 h ALA 251 N 1.51 1.03 -0.19 0.00 0.00 -0.90 -2.86 119.26 117.85 1xs7 h ALA 251 Ca 0.45 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.31 1xs7 h ALA 251 Cb 0.49 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1xs7 h ALA 251 CO -0.28 0.06 -0.00 -1.13 0.00 0.00 0.00 179.25 177.89 1xs7 n SER 252 N -3.19 3.40 0.16 0.00 3.41 -0.50 -4.71 113.62 112.19 1xs7 n SER 252 Ca -0.00 -3.07 0.19 0.00 -0.26 0.00 0.00 58.87 55.73 1xs7 n SER 252 Cb 0.29 -0.52 0.78 0.00 -0.26 0.00 0.00 64.21 64.51 1xs7 n SER 252 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1xs7 h SER 253 N 1.26 0.00 -0.09 4.04 4.64 -1.07 -0.87 113.55 121.46 1xs7 h SER 253 Ca 0.01 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.35 1xs7 h SER 253 Cb 1.33 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1xs7 h SER 253 CO 0.16 0.00 0.35 0.71 -0.87 0.00 0.00 176.83 177.18 1xs7 h THR 254 N 0.00 0.10 -3.76 2.95 1.35 -1.86 -3.36 112.91 108.33 1xs7 h THR 254 Ca 0.14 0.00 -0.48 0.00 -0.55 0.00 0.00 66.41 65.52 1xs7 h THR 254 Cb 0.84 0.67 -0.32 0.00 -1.73 0.00 0.00 68.15 67.62 1xs7 h THR 254 CO -0.00 0.00 -0.80 -1.61 -0.25 0.00 0.00 175.52 172.85 1xs7 s GLU 255 N -4.23 1.30 0.05 4.72 2.02 -0.33 -5.14 118.70 117.09 1xs7 s GLU 255 Ca -0.04 -0.40 0.03 0.00 0.02 0.00 0.00 54.97 54.58 1xs7 s GLU 255 Cb 0.10 -1.16 -0.04 0.00 0.10 0.00 0.00 34.13 33.14 1xs7 s GLU 255 CO 0.34 0.13 0.04 0.15 0.02 0.00 0.00 175.26 175.94 1xs7 s LYS 256 N 0.26 2.80 0.09 1.61 -0.14 -1.26 -4.88 119.74 118.23 1xs7 s LYS 256 Ca -0.06 -0.67 0.04 0.00 -1.36 0.00 0.00 55.97 53.92 1xs7 s LYS 256 Cb -0.11 -2.69 -0.03 0.00 -1.68 0.00 0.00 37.83 33.32 1xs7 s LYS 256 CO 0.01 0.59 -0.11 -0.06 -0.76 0.00 0.00 175.35 175.02 1xs7 s PHE 257 N -1.26 1.08 0.60 3.18 0.40 -1.26 -5.14 117.98 115.58 1xs7 s PHE 257 Ca 0.25 -0.60 -0.19 0.00 -0.60 0.00 0.00 56.93 55.79 1xs7 s PHE 257 Cb -0.12 -0.59 -0.03 0.00 0.51 0.00 0.00 43.02 42.79 1xs7 s PHE 257 CO 0.17 0.01 1.27 -1.25 0.70 0.00 0.00 175.22 176.12 1xs7 s PRO 258 N -2.51 2.84 0.31 0.24 0.04 -1.26 -4.89 135.00 129.77 1xs7 s PRO 258 Ca 0.03 2.00 0.06 0.00 0.04 0.00 0.00 61.00 63.14 1xs7 s PRO 258 Cb -0.05 -1.96 0.74 0.00 0.04 0.00 0.00 34.50 33.27 1xs7 s PRO 258 CO 0.01 -1.36 1.80 -0.44 0.04 0.00 0.00 177.00 177.05 1xs7 h ASP 259 N 0.87 0.77 -0.78 6.66 3.32 -2.00 -0.60 116.42 124.66 1xs7 h ASP 259 Ca -0.51 0.08 0.18 0.00 0.02 0.00 0.00 57.03 56.80 1xs7 h ASP 259 Cb 1.31 -0.07 -0.13 0.00 0.22 0.00 0.00 39.33 40.67 1xs7 h ASP 259 CO 0.55 0.32 0.13 1.23 -1.72 0.00 0.00 179.24 179.74 1xs7 h GLY 260 N 0.78 1.04 0.80 2.75 0.00 -1.94 -0.91 103.07 105.59 1xs7 h GLY 260 Ca 0.54 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.88 1xs7 h GLY 260 CO -0.32 -0.28 -0.32 -2.75 0.00 0.00 0.00 176.54 172.87 1xs7 h PHE 261 N 0.19 -0.85 -0.01 5.60 3.57 -1.26 -1.92 116.94 122.27 1xs7 h PHE 261 Ca 0.45 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.95 1xs7 h PHE 261 Cb 0.82 0.31 -0.00 0.00 2.79 0.00 0.00 35.95 39.87 1xs7 h PHE 261 CO -0.32 -0.48 0.02 -1.49 -2.23 0.00 0.00 178.31 173.81 1xs7 h TRP 262 N -0.76 0.00 -0.82 0.41 -0.00 -1.31 -0.19 115.95 113.28 1xs7 h TRP 262 Ca -0.05 0.00 -0.47 0.00 -0.00 0.00 0.00 58.89 58.37 1xs7 h TRP 262 Cb 0.64 0.00 -0.25 0.00 -0.00 0.00 0.00 29.16 29.55 1xs7 h TRP 262 CO -0.12 0.00 0.60 1.28 -0.00 0.00 0.00 178.44 180.20 1xs7 n LEU 263 N -3.38 6.46 -0.27 -4.49 4.77 -0.43 -4.90 117.00 114.76 1xs7 n LEU 263 Ca -0.03 -3.46 -0.02 0.00 -0.03 0.00 0.00 56.01 52.48 1xs7 n LEU 263 Cb 0.10 -0.85 -0.01 0.00 -2.33 0.00 0.00 43.42 40.33 1xs7 n LEU 263 CO 0.23 1.08 -0.02 0.61 -1.33 0.00 0.00 177.39 177.96 1xs7 n GLY 264 N -0.75 0.17 0.06 -0.72 0.00 -0.08 -4.79 105.19 99.07 1xs7 n GLY 264 Ca 0.50 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.49 1xs7 n GLY 264 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1xs7 h GLU 265 N 0.00 0.00 -6.41 1.61 5.08 -1.51 -3.44 114.58 109.90 1xs7 h GLU 265 Ca -0.04 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.83 1xs7 h GLU 265 Cb 0.42 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 1xs7 h GLU 265 CO 0.05 0.00 -0.24 1.14 -1.00 0.00 0.00 179.01 178.97 1xs7 s GLN 266 N -2.03 3.51 0.61 2.33 -2.07 -1.15 -4.97 119.66 115.89 1xs7 s GLN 266 Ca -0.12 -0.31 -0.03 0.00 -1.82 0.00 0.00 55.36 53.07 1xs7 s GLN 266 Cb 0.02 -2.72 0.04 0.00 -1.09 0.00 0.00 33.01 29.25 1xs7 s GLN 266 CO 0.18 0.24 0.88 -0.48 -1.32 0.00 0.00 175.29 174.79 1xs7 s LEU 267 N -3.92 3.12 -0.03 2.60 0.05 -1.26 -4.14 118.68 115.10 1xs7 s LEU 267 Ca 0.40 0.34 0.05 0.00 0.05 0.00 0.00 54.13 54.97 1xs7 s LEU 267 Cb -0.10 -3.12 -0.01 0.00 -2.05 0.00 0.00 46.19 40.91 1xs7 s LEU 267 CO 0.33 -1.27 -0.19 -0.69 -0.55 0.00 0.00 176.35 173.98 1xs7 s VAL 268 N -2.98 1.51 0.12 1.48 1.01 -0.05 -4.91 120.40 116.58 1xs7 s VAL 268 Ca 0.57 -0.79 0.09 0.00 0.00 0.00 0.00 61.98 61.85 1xs7 s VAL 268 Cb -0.10 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 1xs7 s VAL 268 CO 0.42 0.43 -0.19 0.00 0.00 0.00 0.00 175.10 175.76 1xs7 s TRP 270 N -1.12 0.45 0.65 0.00 0.51 -0.80 -4.98 118.94 113.65 1xs7 s TRP 270 Ca 0.17 -0.61 -0.18 0.00 -2.12 0.00 0.00 56.10 53.37 1xs7 s TRP 270 Cb -0.10 -0.30 -0.02 0.00 -0.81 0.00 0.00 33.47 32.24 1xs7 s TRP 270 CO 0.09 -0.18 1.16 0.94 -0.51 0.00 0.00 176.95 178.45 1xs7 n GLN 271 N 1.29 0.94 -1.59 4.98 -0.06 -1.26 -1.32 117.38 120.36 1xs7 n GLN 271 Ca -0.22 0.38 -0.62 0.00 -2.00 0.00 0.00 57.00 54.54 1xs7 n GLN 271 Cb 0.56 -2.39 -0.09 0.00 -4.06 0.00 0.00 30.24 24.26 1xs7 n GLN 271 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1xs7 n ALA 272 N -1.99 -2.70 -4.18 1.69 0.00 -1.24 -1.93 120.51 110.14 1xs7 n ALA 272 Ca 0.15 0.56 -0.35 0.00 0.00 0.00 0.00 53.44 53.79 1xs7 n ALA 272 Cb 0.48 -1.84 -0.02 0.00 0.00 0.00 0.00 19.45 18.07 1xs7 n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xs7 n GLY 273 N 2.43 -0.45 0.06 0.00 0.00 -1.26 -4.82 105.19 101.16 1xs7 n GLY 273 Ca 0.24 0.14 0.02 0.00 0.00 0.00 0.00 46.02 46.42 1xs7 n GLY 273 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xs7 n THR 274 N -4.42 0.76 -1.68 2.61 -2.24 -0.81 -5.05 114.28 103.44 1xs7 n THR 274 Ca 0.06 -0.82 -0.46 0.00 -2.27 0.00 0.00 64.05 60.57 1xs7 n THR 274 Cb 0.50 0.52 -0.04 0.00 -2.10 0.00 0.00 70.33 69.21 1xs7 n THR 274 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1xs7 n THR 275 N -0.46 0.35 -0.61 4.28 -1.04 -1.26 -4.83 114.28 110.71 1xs7 n THR 275 Ca 0.03 -0.06 -0.08 0.00 -2.04 0.00 0.00 64.05 61.89 1xs7 n THR 275 Cb 0.43 -1.86 -0.10 0.00 -1.82 0.00 0.00 70.33 66.98 1xs7 n THR 275 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1xs7 n PRO 276 N 5.38 1.25 -0.66 -2.82 -0.04 -1.26 -4.70 135.00 132.15 1xs7 n PRO 276 Ca 0.19 -0.65 0.51 0.00 -0.04 0.00 0.00 63.50 63.52 1xs7 n PRO 276 Cb 0.32 -1.84 0.81 0.00 -0.04 0.00 0.00 33.50 32.76 1xs7 n PRO 276 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1xs7 h TRP 277 N 4.32 0.00 0.00 0.54 4.06 -1.95 0.27 115.95 123.19 1xs7 h TRP 277 Ca 0.14 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 61.01 1xs7 h TRP 277 Cb 0.87 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.02 1xs7 h TRP 277 CO 1.50 0.00 -0.34 -2.95 -3.56 0.00 0.00 178.44 173.09 1xs7 h ASN 278 N 0.00 0.00 0.97 -3.49 7.08 -2.00 -3.22 115.58 114.92 1xs7 h ASN 278 Ca 0.90 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 54.12 1xs7 h ASN 278 Cb 3.63 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 39.87 1xs7 h ASN 278 CO -0.01 0.34 -0.06 2.30 -2.08 0.00 0.00 177.43 177.93 1xs7 n ILE 279 N -3.28 0.03 -3.68 6.14 -5.35 0.95 -4.78 119.36 109.39 1xs7 n ILE 279 Ca 0.02 -0.01 -0.36 0.00 -0.27 0.00 0.00 62.75 62.12 1xs7 n ILE 279 Cb 0.60 -0.42 -0.06 0.00 -1.74 0.00 0.00 39.64 38.02 1xs7 n ILE 279 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1xs7 s PHE 280 N -3.00 3.63 0.54 4.28 0.08 -1.22 -3.69 117.98 118.60 1xs7 s PHE 280 Ca 0.14 0.72 -0.15 0.00 0.12 0.00 0.00 56.93 57.76 1xs7 s PHE 280 Cb 0.19 -2.09 -0.07 0.00 -0.57 0.00 0.00 43.02 40.47 1xs7 s PHE 280 CO 0.55 0.64 1.00 -1.25 -0.10 0.00 0.00 175.22 176.06 1xs7 s PRO 281 N -1.40 3.84 0.13 0.24 0.04 -1.26 -4.79 135.00 131.79 1xs7 s PRO 281 Ca 0.24 0.88 -0.11 0.00 0.04 0.00 0.00 61.00 62.06 1xs7 s PRO 281 Cb -0.14 -2.12 -0.06 0.00 0.04 0.00 0.00 34.50 32.21 1xs7 s PRO 281 CO 0.13 -0.36 0.47 0.14 0.04 0.00 0.00 177.00 177.42 1xs7 s VAL 282 N -2.79 5.00 -0.18 -0.36 -7.23 -1.26 -4.32 120.40 109.26 1xs7 s VAL 282 Ca 0.58 0.54 -0.04 0.00 -1.81 0.00 0.00 61.98 61.24 1xs7 s VAL 282 Cb -0.10 -3.67 -0.02 0.00 0.56 0.00 0.00 36.38 33.15 1xs7 s VAL 282 CO 0.38 0.20 -0.02 -0.63 -0.31 0.00 0.00 175.10 174.73 1xs7 s ILE 283 N -1.50 3.87 -0.25 -0.62 1.01 0.29 -1.48 121.20 122.52 1xs7 s ILE 283 Ca 0.37 -0.35 -0.02 0.00 0.00 0.00 0.00 60.65 60.65 1xs7 s ILE 283 Cb -0.14 -2.73 0.03 0.00 0.01 0.00 0.00 42.46 39.63 1xs7 s ILE 283 CO 0.19 0.45 -0.05 -0.44 0.00 0.00 0.00 174.94 175.10 1xs7 s SER 284 N 0.77 4.41 -0.25 3.58 0.01 -1.01 -0.13 113.70 121.08 1xs7 s SER 284 Ca -0.01 -0.88 -0.10 0.00 1.31 0.00 0.00 55.95 56.27 1xs7 s SER 284 Cb -0.14 -1.68 -0.05 0.00 0.21 0.00 0.00 66.02 64.36 1xs7 s SER 284 CO 0.02 -0.14 0.15 -0.76 0.41 0.00 0.00 173.24 172.92 1xs7 s LEU 285 N 1.33 3.96 -0.23 2.44 1.43 0.11 -1.75 118.68 125.98 1xs7 s LEU 285 Ca -0.00 0.02 -0.17 0.00 -1.03 0.00 0.00 54.13 52.95 1xs7 s LEU 285 Cb -0.17 -2.07 -0.03 0.00 0.03 0.00 0.00 46.19 43.95 1xs7 s LEU 285 CO -0.04 0.02 0.47 -0.31 0.23 0.00 0.00 176.35 176.73 1xs7 s TYR 286 N 1.32 3.32 0.09 0.29 1.51 0.36 -0.67 117.35 123.57 1xs7 s TYR 286 Ca 0.07 0.65 0.05 0.00 -1.01 0.00 0.00 57.07 56.83 1xs7 s TYR 286 Cb -0.15 -2.65 -0.04 0.00 -0.11 0.00 0.00 41.96 39.02 1xs7 s TYR 286 CO 0.06 -0.16 -0.02 -0.51 -1.11 0.00 0.00 175.55 173.81 1xs7 s LEU 287 N 1.86 3.36 0.51 -1.29 1.43 0.12 -0.67 118.68 123.99 1xs7 s LEU 287 Ca 0.21 -0.22 -0.22 0.00 -1.03 0.00 0.00 54.13 52.87 1xs7 s LEU 287 Cb -0.15 -2.10 -0.06 0.00 0.03 0.00 0.00 46.19 43.91 1xs7 s LEU 287 CO 0.09 0.18 1.27 -0.32 0.23 0.00 0.00 176.35 177.81 1xs7 s MET 288 N -2.24 3.42 0.55 1.70 -2.45 -0.90 -2.03 119.30 117.35 1xs7 s MET 288 Ca 0.24 2.04 0.08 0.00 -1.25 0.00 0.00 55.69 56.80 1xs7 s MET 288 Cb -0.12 -2.33 0.07 0.00 1.25 0.00 0.00 34.83 33.70 1xs7 s MET 288 CO 0.17 -0.90 0.66 0.20 1.05 0.00 0.00 175.02 176.20 1xs7 s GLY 289 N -1.12 1.92 0.13 2.11 0.00 -0.76 -4.03 107.32 105.58 1xs7 s GLY 289 Ca 0.68 -1.88 0.16 0.00 0.00 0.00 0.00 44.72 43.68 1xs7 s GLY 289 CO 0.42 -1.74 1.03 0.83 0.00 0.00 0.00 173.10 173.64 1xs7 h GLU 290 N 0.39 0.00 -5.72 2.90 5.08 -1.79 -3.41 114.58 112.02 1xs7 h GLU 290 Ca -0.33 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.44 1xs7 h GLU 290 Cb 1.29 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.45 1xs7 h GLU 290 CO 0.46 0.35 0.22 0.08 -1.00 0.00 0.00 179.01 179.12 1xs7 s VAL 291 N -2.95 4.97 0.43 3.13 1.01 -1.26 -5.00 120.40 120.73 1xs7 s VAL 291 Ca -0.01 1.32 -0.17 0.00 0.00 0.00 0.00 61.98 63.12 1xs7 s VAL 291 Cb 0.08 -4.00 -0.14 0.00 0.00 0.00 0.00 36.38 32.32 1xs7 s VAL 291 CO 0.79 0.07 -0.06 0.41 0.00 0.00 0.00 175.10 176.31 1xs7 n THR 292 N 4.80 0.17 -4.41 3.92 -1.04 -1.26 -1.80 114.28 114.66 1xs7 n THR 292 Ca 0.01 -0.46 -0.37 0.00 -2.04 0.00 0.00 64.05 61.19 1xs7 n THR 292 Cb 0.49 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.92 1xs7 n THR 292 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1xs7 n ASN 293 N 2.25 -0.62 -3.72 8.00 3.02 -1.26 -4.92 115.26 118.00 1xs7 n ASN 293 Ca 0.08 -1.24 -0.12 0.00 -0.03 0.00 0.00 54.58 53.27 1xs7 n ASN 293 Cb 0.41 -1.72 -0.12 0.00 -0.61 0.00 0.00 39.78 37.74 1xs7 n ASN 293 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1xs7 s GLN 294 N -7.27 0.26 0.17 3.52 0.74 -0.75 -3.73 119.66 112.61 1xs7 s GLN 294 Ca 0.43 0.58 0.02 0.00 0.05 0.00 0.00 55.36 56.44 1xs7 s GLN 294 Cb -0.25 -0.07 -0.05 0.00 1.10 0.00 0.00 33.01 33.74 1xs7 s GLN 294 CO 1.01 -0.15 -0.01 -1.54 -0.55 0.00 0.00 175.29 174.04 1xs7 s SER 295 N 1.20 1.32 0.34 6.67 1.04 0.12 -1.83 113.70 122.54 1xs7 s SER 295 Ca -0.09 -1.16 0.03 0.00 0.48 0.00 0.00 55.95 55.22 1xs7 s SER 295 Cb -0.09 0.10 -0.04 0.00 0.10 0.00 0.00 66.02 66.09 1xs7 s SER 295 CO -0.09 -0.54 0.14 0.72 0.98 0.00 0.00 173.24 174.45 1xs7 s PHE 296 N -3.60 1.71 0.04 5.02 -0.12 -0.86 0.10 117.98 120.26 1xs7 s PHE 296 Ca 0.23 -1.29 -0.01 0.00 -0.05 0.00 0.00 56.93 55.81 1xs7 s PHE 296 Cb 0.06 -1.00 -0.03 0.00 -0.63 0.00 0.00 43.02 41.41 1xs7 s PHE 296 CO 0.04 -0.38 -0.01 -0.98 -0.05 0.00 0.00 175.22 173.83 1xs7 s ARG 297 N -3.80 0.53 -0.04 1.99 1.70 0.33 -0.70 118.95 118.96 1xs7 s ARG 297 Ca 0.32 -1.00 0.07 0.00 -0.47 0.00 0.00 55.73 54.65 1xs7 s ARG 297 Cb 0.05 0.19 -0.01 0.00 -0.57 0.00 0.00 34.95 34.60 1xs7 s ARG 297 CO 0.16 -0.10 -0.25 0.96 -1.08 0.00 0.00 175.30 174.99 1xs7 s ILE 298 N -3.12 2.11 -0.08 4.99 -4.36 0.16 -1.11 121.20 119.78 1xs7 s ILE 298 Ca -0.00 -1.06 0.03 0.00 -0.26 0.00 0.00 60.65 59.35 1xs7 s ILE 298 Cb 0.02 -1.75 0.01 0.00 1.25 0.00 0.00 42.46 41.99 1xs7 s ILE 298 CO -0.07 0.57 -0.17 -0.89 0.24 0.00 0.00 174.94 174.62 1xs7 s THR 299 N -0.34 1.50 0.14 8.37 2.01 0.41 0.04 115.64 127.78 1xs7 s THR 299 Ca 0.02 -0.69 0.09 0.00 0.31 0.00 0.00 61.69 61.42 1xs7 s THR 299 Cb -0.12 -1.33 -0.04 0.00 0.01 0.00 0.00 72.50 71.02 1xs7 s THR 299 CO 0.02 0.44 -0.17 0.27 -0.69 0.00 0.00 174.62 174.49 1xs7 s ILE 300 N 0.53 2.86 0.54 1.82 -4.36 0.81 -1.93 121.20 121.47 1xs7 s ILE 300 Ca -0.16 -1.62 0.07 0.00 -0.26 0.00 0.00 60.65 58.68 1xs7 s ILE 300 Cb -0.17 -2.35 0.06 0.00 1.25 0.00 0.00 42.46 41.26 1xs7 s ILE 300 CO 0.06 0.02 0.74 -0.76 0.24 0.00 0.00 174.94 175.24 1xs7 s LEU 301 N -2.39 3.29 0.00 0.37 1.43 -1.26 -0.55 118.68 119.58 1xs7 s LEU 301 Ca 0.20 -0.56 0.16 0.00 -1.03 0.00 0.00 54.13 52.90 1xs7 s LEU 301 Cb -0.10 -2.14 0.78 0.00 0.03 0.00 0.00 46.19 44.76 1xs7 s LEU 301 CO 0.11 -1.20 1.45 -0.81 0.23 0.00 0.00 176.35 176.14 1xs7 n PRO 302 N -2.20 0.21 0.00 1.29 -0.04 -1.26 -1.52 135.00 131.48 1xs7 n PRO 302 Ca 0.12 0.15 0.14 0.00 -0.04 0.00 0.00 63.50 63.87 1xs7 n PRO 302 Cb 0.60 -1.50 0.73 0.00 -0.04 0.00 0.00 33.50 33.29 1xs7 n PRO 302 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1xs7 n GLN 303 N -1.30 0.50 -0.10 0.54 3.00 -1.26 -0.63 117.38 118.13 1xs7 n GLN 303 Ca 0.07 0.02 -0.18 0.00 -0.01 0.00 0.00 57.00 56.90 1xs7 n GLN 303 Cb 0.13 -1.50 -0.08 0.00 0.00 0.00 0.00 30.24 28.79 1xs7 n GLN 303 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1xs7 n GLN 304 N -1.23 0.43 0.01 -1.09 3.00 -0.58 -4.64 117.38 113.29 1xs7 n GLN 304 Ca 0.15 0.15 0.12 0.00 -0.01 0.00 0.00 57.00 57.42 1xs7 n GLN 304 Cb 0.20 -1.26 0.34 0.00 0.00 0.00 0.00 30.24 29.51 1xs7 n GLN 304 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.06 179.54 1xs7 n TYR 305 N -3.56 0.05 -3.41 1.08 0.18 -1.17 -4.55 117.16 105.78 1xs7 n TYR 305 Ca -0.36 0.02 -0.44 0.00 1.88 0.00 0.00 57.90 58.99 1xs7 n TYR 305 Cb 0.80 -0.35 -0.07 0.00 -0.38 0.00 0.00 39.34 39.34 1xs7 n TYR 305 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1xs7 s LEU 306 N -3.11 5.85 -0.07 -3.48 1.43 0.20 0.50 118.68 120.00 1xs7 s LEU 306 Ca 0.11 -1.68 -0.30 0.00 -1.03 0.00 0.00 54.13 51.23 1xs7 s LEU 306 Cb 0.17 -2.14 -0.03 0.00 0.03 0.00 0.00 46.19 44.22 1xs7 s LEU 306 CO 0.66 -0.74 1.26 -0.60 0.23 0.00 0.00 176.35 177.16 1xs7 s ARG 307 N 1.54 4.31 0.10 1.70 3.52 -0.34 -4.76 118.95 125.02 1xs7 s ARG 307 Ca 0.04 1.74 -0.31 0.00 -0.13 0.00 0.00 55.73 57.07 1xs7 s ARG 307 Cb -0.27 -3.61 -0.07 0.00 -1.56 0.00 0.00 34.95 29.43 1xs7 s ARG 307 CO 0.03 -0.54 1.29 -2.14 -0.81 0.00 0.00 175.30 173.13 1xs7 s PRO 308 N 2.57 4.38 0.30 5.12 0.02 -1.26 -1.32 135.00 144.80 1xs7 s PRO 308 Ca 0.58 1.93 0.02 0.00 0.02 0.00 0.00 61.00 63.55 1xs7 s PRO 308 Cb -0.25 -3.29 -0.05 0.00 0.02 0.00 0.00 34.50 30.92 1xs7 s PRO 308 CO 0.21 -0.34 0.09 0.14 -0.33 0.00 0.00 177.00 176.78 1xs7 s VAL 309 N 1.01 0.75 0.38 3.83 -7.23 -0.83 -4.63 120.40 113.68 1xs7 s VAL 309 Ca 0.61 -2.00 -0.23 0.00 -1.81 0.00 0.00 61.98 58.55 1xs7 s VAL 309 Cb -0.33 -2.66 -0.10 0.00 0.56 0.00 0.00 36.38 33.85 1xs7 s VAL 309 CO 0.30 0.00 0.95 -0.70 -0.31 0.00 0.00 175.10 175.34 1xs7 s GLU 310 N -3.94 4.39 0.29 4.82 2.56 -1.26 -4.31 118.70 121.24 1xs7 s GLU 310 Ca 0.36 1.24 -0.26 0.00 0.00 0.00 0.00 54.97 56.31 1xs7 s GLU 310 Cb 0.07 -2.48 -0.15 0.00 2.00 0.00 0.00 34.13 33.57 1xs7 s GLU 310 CO 0.15 0.11 0.63 -3.47 -0.56 0.00 0.00 175.26 172.12 1xs7 n ASP 311 N -0.06 -0.55 -0.30 -1.70 -0.08 -1.26 -4.79 116.55 107.81 1xs7 n ASP 311 Ca 0.05 1.07 0.19 0.00 -1.51 0.00 0.00 54.79 54.59 1xs7 n ASP 311 Cb 0.52 -1.08 0.37 0.00 2.34 0.00 0.00 41.12 43.27 1xs7 n ASP 311 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1xs7 n VAL 312 N -0.21 -0.38 -2.66 5.18 0.31 -1.26 -0.32 118.33 118.99 1xs7 n VAL 312 Ca 0.13 1.93 -0.18 0.00 -0.01 0.00 0.00 64.34 66.21 1xs7 n VAL 312 Cb 0.32 -2.93 0.01 0.00 -0.91 0.00 0.00 33.84 30.32 1xs7 n VAL 312 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xs7 n ALA 313 N -2.87 3.99 -3.14 3.52 0.00 -1.26 -5.02 120.51 115.73 1xs7 n ALA 313 Ca 0.26 -3.71 -0.10 0.00 0.00 0.00 0.00 53.44 49.90 1xs7 n ALA 313 Cb 0.88 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 19.55 1xs7 n ALA 313 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xs7 n THR 314 N -0.20 -0.95 0.00 0.00 -2.24 0.57 -4.91 114.28 106.54 1xs7 n THR 314 Ca 0.23 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 1xs7 n THR 314 Cb 0.72 -0.84 0.00 0.00 -2.10 0.00 0.00 70.33 68.10 1xs7 n THR 314 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1xs7 n SER 315 N -0.37 0.00 0.00 3.42 3.41 -1.26 -4.96 113.62 113.86 1xs7 n SER 315 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.52 1xs7 n SER 315 Cb 0.21 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.16 1xs7 n SER 315 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xs7 n GLN 316 N 0.00 1.39 -1.77 4.33 6.02 -1.26 -4.95 117.38 121.14 1xs7 n GLN 316 Ca 0.00 -1.01 -0.29 0.00 -0.01 0.00 0.00 57.00 55.68 1xs7 n GLN 316 Cb 0.00 -0.90 0.15 0.00 1.02 0.00 0.00 30.24 30.51 1xs7 n GLN 316 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1xs7 s ASP 317 N -0.55 3.51 -0.20 1.08 1.11 -1.26 -3.70 116.67 116.66 1xs7 s ASP 317 Ca 0.00 0.62 0.01 0.00 0.18 0.00 0.00 52.55 53.36 1xs7 s ASP 317 Cb 0.00 -0.94 0.04 0.00 1.07 0.00 0.00 42.92 43.09 1xs7 s ASP 317 CO 0.00 -2.52 -0.12 -1.81 1.18 0.00 0.00 175.17 171.90 1xs7 s ASP 318 N -4.53 3.49 0.19 0.27 -0.00 -0.44 -4.76 116.67 110.89 1xs7 s ASP 318 Ca 0.67 -0.91 0.09 0.00 -0.00 0.00 0.00 52.55 52.40 1xs7 s ASP 318 Cb -0.09 -1.32 -0.04 0.00 -0.00 0.00 0.00 42.92 41.47 1xs7 s ASP 318 CO 0.52 -0.13 -0.19 0.00 -0.00 0.00 0.00 175.17 175.37 1xs7 s TYR 320 N -2.09 0.89 0.02 0.00 1.51 -0.85 -1.96 117.35 114.87 1xs7 s TYR 320 Ca 0.19 -1.15 0.06 0.00 -1.01 0.00 0.00 57.07 55.15 1xs7 s TYR 320 Cb -0.06 -0.07 -0.02 0.00 -0.11 0.00 0.00 41.96 41.70 1xs7 s TYR 320 CO 0.08 -1.04 -0.18 0.15 -1.11 0.00 0.00 175.55 173.45 1xs7 s LYS 321 N -3.44 1.31 -0.08 -0.62 1.02 -0.43 -0.87 119.74 116.63 1xs7 s LYS 321 Ca 0.29 -0.76 -0.30 0.00 0.02 0.00 0.00 55.97 55.23 1xs7 s LYS 321 Cb 0.00 -1.33 -0.05 0.00 -0.52 0.00 0.00 37.83 35.93 1xs7 s LYS 321 CO 0.16 0.35 1.67 0.12 -0.92 0.00 0.00 175.35 176.73 1xs7 s PHE 322 N -0.63 1.96 -0.68 3.18 5.36 -1.26 -1.19 117.98 124.72 1xs7 s PHE 322 Ca 0.06 0.24 -0.02 0.00 -0.96 0.00 0.00 56.93 56.25 1xs7 s PHE 322 Cb -0.08 -3.93 0.44 0.00 -0.34 0.00 0.00 43.02 39.11 1xs7 s PHE 322 CO 0.01 -3.76 2.03 0.00 -1.46 0.00 0.00 175.22 172.03 1xs7 n ALA 323 N 7.44 6.35 -3.92 11.12 0.00 0.18 -4.21 120.51 137.46 1xs7 n ALA 323 Ca 0.18 -3.55 -0.28 0.00 0.00 0.00 0.00 53.44 49.79 1xs7 n ALA 323 Cb 0.43 -1.78 -0.16 0.00 0.00 0.00 0.00 19.45 17.94 1xs7 n ALA 323 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1xs7 s ILE 324 N -4.85 1.22 0.17 0.00 1.01 -1.26 -1.66 121.20 115.82 1xs7 s ILE 324 Ca 0.64 -0.60 0.05 0.00 0.00 0.00 0.00 60.65 60.73 1xs7 s ILE 324 Cb 0.50 -1.31 -0.05 0.00 0.01 0.00 0.00 42.46 41.62 1xs7 s ILE 324 CO -0.05 0.23 -0.10 -0.94 0.00 0.00 0.00 174.94 174.08 1xs7 s SER 325 N 1.60 1.98 0.68 3.58 1.04 -0.94 -4.70 113.70 116.93 1xs7 s SER 325 Ca 0.02 -1.03 -0.13 0.00 0.48 0.00 0.00 55.95 55.28 1xs7 s SER 325 Cb -0.14 -0.04 0.01 0.00 0.10 0.00 0.00 66.02 65.94 1xs7 s SER 325 CO -0.08 -0.31 1.08 0.00 0.98 0.00 0.00 173.24 174.91 1xs7 s GLN 326 N -3.73 2.83 -0.02 4.02 -2.07 -1.25 -0.57 119.66 118.86 1xs7 s GLN 326 Ca 0.19 1.21 0.01 0.00 -1.82 0.00 0.00 55.36 54.95 1xs7 s GLN 326 Cb 0.02 -1.97 0.01 0.00 -1.09 0.00 0.00 33.01 29.99 1xs7 s GLN 326 CO 0.03 -1.20 -0.03 0.45 -1.32 0.00 0.00 175.29 173.22 1xs7 s SER 327 N -3.05 0.49 0.00 12.60 0.15 0.11 -4.61 113.70 119.39 1xs7 s SER 327 Ca 0.63 -0.06 0.27 0.00 0.70 0.00 0.00 55.95 57.49 1xs7 s SER 327 Cb -0.17 -0.15 0.81 0.00 -1.71 0.00 0.00 66.02 64.79 1xs7 s SER 327 CO 0.46 -0.01 1.60 -1.54 1.20 0.00 0.00 173.24 174.95 1xs7 n SER 328 N 3.50 1.04 -1.36 5.45 3.41 -1.26 -3.82 113.62 120.58 1xs7 n SER 328 Ca -0.19 -0.93 -0.09 0.00 -0.26 0.00 0.00 58.87 57.40 1xs7 n SER 328 Cb 0.55 0.11 0.11 0.00 -0.26 0.00 0.00 64.21 64.72 1xs7 n SER 328 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1xs7 n THR 329 N -0.58 2.32 -2.43 6.66 -2.24 -1.26 -5.06 114.28 111.69 1xs7 n THR 329 Ca 0.13 -3.70 0.00 0.00 -2.27 0.00 0.00 64.05 58.21 1xs7 n THR 329 Cb 0.35 -0.65 0.00 0.00 -2.10 0.00 0.00 70.33 67.93 1xs7 n THR 329 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xs7 n GLY 330 N -0.88 -1.00 3.80 3.38 0.00 -1.23 -4.55 105.19 104.70 1xs7 n GLY 330 Ca 0.31 -1.50 -0.37 0.00 0.00 0.00 0.00 46.02 44.47 1xs7 n GLY 330 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xs7 s THR 331 N 0.00 5.31 -0.31 2.61 2.01 0.21 -3.86 115.64 121.60 1xs7 s THR 331 Ca 0.00 0.48 0.01 0.00 0.31 0.00 0.00 61.69 62.50 1xs7 s THR 331 Cb 0.00 -3.56 0.10 0.00 0.01 0.00 0.00 72.50 69.04 1xs7 s THR 331 CO 0.00 0.52 0.06 -0.69 -0.69 0.00 0.00 174.62 173.81 1xs7 s VAL 332 N -0.41 1.57 -1.12 3.82 1.01 0.29 -1.12 120.40 124.44 1xs7 s VAL 332 Ca 0.17 -1.79 -0.20 0.00 0.00 0.00 0.00 61.98 60.16 1xs7 s VAL 332 Cb -0.13 -2.13 0.07 0.00 0.00 0.00 0.00 36.38 34.19 1xs7 s VAL 332 CO 0.06 -0.57 1.51 -0.04 0.00 0.00 0.00 175.10 176.06 1xs7 s MET 333 N 1.28 3.77 0.11 2.72 -1.94 -0.13 -0.50 119.30 124.60 1xs7 s MET 333 Ca 0.08 -1.60 -0.02 0.00 -1.71 0.00 0.00 55.69 52.45 1xs7 s MET 333 Cb -0.18 -5.35 0.02 0.00 2.01 0.00 0.00 34.83 31.33 1xs7 s MET 333 CO -0.15 -2.15 0.15 0.41 -0.01 0.00 0.00 175.02 173.27 1xs7 n GLY 334 N 6.02 -0.72 0.33 -0.03 0.00 -1.15 -2.52 105.19 107.12 1xs7 n GLY 334 Ca 0.38 -1.74 0.06 0.00 0.00 0.00 0.00 46.02 44.71 1xs7 n GLY 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xs7 n ALA 335 N -3.08 0.23 0.05 4.61 0.00 0.19 -2.17 120.51 120.34 1xs7 n ALA 335 Ca -0.02 1.01 -0.05 0.00 0.00 0.00 0.00 53.44 54.37 1xs7 n ALA 335 Cb 0.07 -0.61 -0.03 0.00 0.00 0.00 0.00 19.45 18.88 1xs7 n ALA 335 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1xs7 h VAL 336 N 0.00 0.00 -0.88 0.00 -1.51 -1.71 0.18 116.25 112.34 1xs7 h VAL 336 Ca 0.44 0.00 0.23 0.00 -1.23 0.00 0.00 66.70 66.15 1xs7 h VAL 336 Cb 0.68 0.00 -0.15 0.00 -2.13 0.00 0.00 31.29 29.69 1xs7 h VAL 336 CO -0.94 0.00 0.15 0.40 -1.23 0.00 0.00 177.57 175.95 1xs7 h ILE 337 N -0.25 0.26 -0.67 7.19 1.08 -1.73 0.71 117.51 124.11 1xs7 h ILE 337 Ca -0.01 -0.05 -0.00 0.00 -0.39 0.00 0.00 64.86 64.41 1xs7 h ILE 337 Cb 0.23 0.10 -0.03 0.00 -3.07 0.00 0.00 36.82 34.05 1xs7 h ILE 337 CO -0.06 0.03 0.40 0.24 -0.69 0.00 0.00 178.15 178.06 1xs7 h MET 338 N 0.14 0.90 0.00 2.37 2.86 -0.90 -0.73 114.93 119.58 1xs7 h MET 338 Ca 0.54 -0.08 0.00 0.00 -2.06 0.00 0.00 59.70 58.10 1xs7 h MET 338 Cb 1.08 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 32.55 1xs7 h MET 338 CO -0.71 0.64 0.07 0.39 1.06 0.00 0.00 176.91 178.36 1xs7 n GLU 339 N -4.40 0.10 0.00 1.72 1.02 0.25 -0.20 120.64 119.13 1xs7 n GLU 339 Ca 0.07 0.59 0.11 0.00 -0.02 0.00 0.00 57.16 57.91 1xs7 n GLU 339 Cb 0.07 -1.91 0.15 0.00 -0.02 0.00 0.00 31.44 29.73 1xs7 n GLU 339 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xs7 n GLY 340 N -1.32 -1.14 3.29 0.62 0.00 -0.28 -4.39 105.19 101.97 1xs7 n GLY 340 Ca -0.01 -0.43 -0.14 0.00 0.00 0.00 0.00 46.02 45.44 1xs7 n GLY 340 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xs7 s PHE 341 N -2.97 1.21 -0.37 1.61 0.40 0.71 -3.05 117.98 115.52 1xs7 s PHE 341 Ca 0.11 -1.37 -0.08 0.00 -0.60 0.00 0.00 56.93 54.99 1xs7 s PHE 341 Cb 0.17 -0.47 0.05 0.00 0.51 0.00 0.00 43.02 43.28 1xs7 s PHE 341 CO 0.74 -0.79 0.16 -0.47 0.70 0.00 0.00 175.22 175.57 1xs7 s TYR 342 N -3.86 3.28 -0.21 0.36 5.04 -0.52 -4.45 117.35 117.00 1xs7 s TYR 342 Ca 0.37 -1.37 -0.12 0.00 -2.44 0.00 0.00 57.07 53.50 1xs7 s TYR 342 Cb 0.04 -2.49 -0.05 0.00 0.35 0.00 0.00 41.96 39.82 1xs7 s TYR 342 CO 0.16 -0.74 0.24 0.08 -1.34 0.00 0.00 175.55 173.95 1xs7 s VAL 343 N 1.43 5.31 -0.44 3.14 1.01 -0.04 -2.25 120.40 128.57 1xs7 s VAL 343 Ca 0.00 0.39 -0.13 0.00 0.00 0.00 0.00 61.98 62.25 1xs7 s VAL 343 Cb -0.20 -3.58 0.07 0.00 0.00 0.00 0.00 36.38 32.67 1xs7 s VAL 343 CO 0.03 0.34 0.33 -0.69 0.00 0.00 0.00 175.10 175.12 1xs7 s VAL 344 N 0.90 4.81 -1.20 2.92 1.01 -0.53 0.97 120.40 129.30 1xs7 s VAL 344 Ca 0.12 -1.16 -0.17 0.00 0.00 0.00 0.00 61.98 60.77 1xs7 s VAL 344 Cb -0.13 -3.88 0.12 0.00 0.00 0.00 0.00 36.38 32.48 1xs7 s VAL 344 CO 0.04 -0.52 1.52 -0.36 0.00 0.00 0.00 175.10 175.78 1xs7 s PHE 345 N 1.56 3.09 -1.11 5.22 0.08 0.12 0.17 117.98 127.10 1xs7 s PHE 345 Ca 0.04 -1.73 -0.15 0.00 0.12 0.00 0.00 56.93 55.21 1xs7 s PHE 345 Cb -0.23 -4.52 0.17 0.00 -0.57 0.00 0.00 43.02 37.87 1xs7 s PHE 345 CO 0.05 -1.62 1.29 0.34 -0.10 0.00 0.00 175.22 175.19 1xs7 s ASP 346 N 3.67 6.97 0.27 1.36 2.15 -0.98 -1.84 116.67 128.27 1xs7 s ASP 346 Ca 0.46 -2.80 -0.04 0.00 0.43 0.00 0.00 52.55 50.60 1xs7 s ASP 346 Cb -0.00 -2.37 0.34 0.00 -0.30 0.00 0.00 42.92 40.59 1xs7 s ASP 346 CO 0.01 -0.77 1.93 0.03 -0.17 0.00 0.00 175.17 176.20 1xs7 h ARG 347 N 7.55 1.23 0.06 4.34 3.08 -1.76 -1.95 114.38 126.92 1xs7 h ARG 347 Ca 0.25 -0.07 0.01 0.00 0.07 0.00 0.00 59.98 60.24 1xs7 h ARG 347 Cb 0.92 -0.28 -0.03 0.00 0.08 0.00 0.00 29.97 30.66 1xs7 h ARG 347 CO 1.16 0.81 -0.30 0.00 -1.07 0.00 0.00 179.97 180.57 1xs7 h ALA 348 N 1.42 -0.80 -0.26 0.04 0.00 -1.65 -1.57 119.26 116.45 1xs7 h ALA 348 Ca 0.37 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.10 1xs7 h ALA 348 Cb -0.08 0.71 -0.07 0.00 0.00 0.00 0.00 17.79 18.36 1xs7 h ALA 348 CO -0.10 -0.88 0.14 0.54 0.00 0.00 0.00 179.25 178.96 1xs7 n ARG 349 N -4.15 1.57 -3.89 0.00 1.74 -1.21 -4.89 116.66 105.83 1xs7 n ARG 349 Ca -0.05 -0.89 -0.28 0.00 -0.77 0.00 0.00 57.85 55.87 1xs7 n ARG 349 Cb 0.23 -1.44 -0.02 0.00 -1.02 0.00 0.00 32.46 30.20 1xs7 n ARG 349 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1xs7 n LYS 350 N 0.06 -0.68 -3.69 5.56 4.81 -0.59 -4.92 118.16 118.72 1xs7 n LYS 350 Ca 0.15 -0.04 -0.13 0.00 -0.87 0.00 0.00 58.31 57.42 1xs7 n LYS 350 Cb 0.76 -1.89 -0.07 0.00 0.02 0.00 0.00 35.03 33.85 1xs7 n LYS 350 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 1xs7 s ARG 351 N -6.44 0.87 -0.13 1.64 1.70 -0.76 -2.65 118.95 113.18 1xs7 s ARG 351 Ca 0.19 -0.35 -0.04 0.00 -0.47 0.00 0.00 55.73 55.06 1xs7 s ARG 351 Cb -0.11 0.39 -0.03 0.00 -0.57 0.00 0.00 34.95 34.63 1xs7 s ARG 351 CO 0.69 -0.29 0.01 0.42 -1.08 0.00 0.00 175.30 175.05 1xs7 s ILE 352 N -2.31 4.33 0.12 4.99 1.01 -0.46 -2.31 121.20 126.55 1xs7 s ILE 352 Ca -0.06 -0.22 -0.09 0.00 0.00 0.00 0.00 60.65 60.28 1xs7 s ILE 352 Cb -0.01 -2.87 -0.06 0.00 0.01 0.00 0.00 42.46 39.52 1xs7 s ILE 352 CO -0.01 0.54 0.42 -0.83 0.00 0.00 0.00 174.94 175.06 1xs7 s GLY 353 N -0.24 2.32 -0.05 6.18 0.00 0.45 -2.36 107.32 113.61 1xs7 s GLY 353 Ca 0.06 -0.39 -0.01 0.00 0.00 0.00 0.00 44.72 44.38 1xs7 s GLY 353 CO 0.02 -0.20 0.02 -1.36 0.00 0.00 0.00 173.10 171.58 1xs7 s PHE 354 N -1.51 0.39 0.14 1.90 0.40 0.13 -1.45 117.98 117.98 1xs7 s PHE 354 Ca 0.37 0.02 0.00 0.00 -0.60 0.00 0.00 56.93 56.72 1xs7 s PHE 354 Cb -0.13 -0.63 -0.04 0.00 0.51 0.00 0.00 43.02 42.73 1xs7 s PHE 354 CO 0.20 -0.25 0.02 0.00 0.70 0.00 0.00 175.22 175.89 1xs7 s ALA 355 N 1.92 1.05 -0.33 5.36 0.00 -0.95 -1.12 121.76 127.68 1xs7 s ALA 355 Ca 0.03 -1.50 -0.29 0.00 0.00 0.00 0.00 51.96 50.21 1xs7 s ALA 355 Cb -0.12 0.65 0.02 0.00 0.00 0.00 0.00 23.12 23.67 1xs7 s ALA 355 CO -0.04 -0.40 1.06 0.08 0.00 0.00 0.00 175.76 176.46 1xs7 s VAL 356 N -3.85 4.51 0.18 0.00 1.01 -1.23 -1.44 120.40 119.58 1xs7 s VAL 356 Ca 0.22 1.65 -0.31 0.00 0.00 0.00 0.00 61.98 63.54 1xs7 s VAL 356 Cb 0.07 -4.41 -0.10 0.00 0.00 0.00 0.00 36.38 31.94 1xs7 s VAL 356 CO 0.01 -0.51 1.55 -0.55 0.00 0.00 0.00 175.10 175.61 1xs7 s SER 357 N 1.72 6.58 0.00 3.32 0.15 -1.17 -1.25 113.70 123.05 1xs7 s SER 357 Ca 0.45 2.64 0.04 0.00 0.70 0.00 0.00 55.95 59.77 1xs7 s SER 357 Cb -0.12 -2.60 0.23 0.00 -1.71 0.00 0.00 66.02 61.82 1xs7 s SER 357 CO 0.16 -0.81 0.61 0.00 1.20 0.00 0.00 173.24 174.40 1xs7 n ALA 358 N 3.67 1.88 -2.20 5.45 0.00 0.25 -2.70 120.51 126.86 1xs7 n ALA 358 Ca 0.13 -0.02 0.02 0.00 0.00 0.00 0.00 53.44 53.57 1xs7 n ALA 358 Cb 0.39 -1.06 0.02 0.00 0.00 0.00 0.00 19.45 18.79 1xs7 n ALA 358 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xs7 s HIS 360 N -0.19 3.59 0.35 0.00 -0.00 -1.10 -4.57 115.29 113.38 1xs7 s HIS 360 Ca 0.18 1.35 -0.27 0.00 -0.00 0.00 0.00 55.06 56.33 1xs7 s HIS 360 Cb 0.21 -2.60 -0.09 0.00 -0.00 0.00 0.00 32.58 30.09 1xs7 s HIS 360 CO -0.08 0.28 1.15 0.08 -0.00 0.00 0.00 174.74 176.16 1xs7 s VAL 361 N -1.63 3.28 0.20 -5.38 1.01 -1.26 -5.02 120.40 111.60 1xs7 s VAL 361 Ca 0.46 1.15 -0.22 0.00 0.00 0.00 0.00 61.98 63.36 1xs7 s VAL 361 Cb -0.15 -3.68 0.07 0.00 0.00 0.00 0.00 36.38 32.62 1xs7 s VAL 361 CO 0.20 0.17 0.98 -1.38 0.00 0.00 0.00 175.10 175.07 1xs7 s HIS 362 N -1.34 0.02 0.53 5.22 -0.00 -1.26 -4.81 115.29 113.65 1xs7 s HIS 362 Ca 0.52 -0.43 0.01 0.00 -0.00 0.00 0.00 55.06 55.16 1xs7 s HIS 362 Cb -0.31 0.70 0.00 0.00 -0.00 0.00 0.00 32.58 32.98 1xs7 s HIS 362 CO 0.40 -0.99 0.08 0.16 -0.00 0.00 0.00 174.74 174.38 1xs7 s ASP 363 N -3.23 4.24 0.00 7.38 1.47 -1.19 -5.03 116.67 120.31 1xs7 s ASP 363 Ca 0.18 -1.61 0.26 0.00 1.18 0.00 0.00 52.55 52.57 1xs7 s ASP 363 Cb -0.03 0.59 1.52 0.00 -0.34 0.00 0.00 42.92 44.66 1xs7 s ASP 363 CO 0.05 -0.94 1.92 1.21 0.68 0.00 0.00 175.17 178.09 1xs7 n GLU 364 N -1.38 0.74 -0.00 2.11 2.13 -1.26 -3.51 120.64 119.47 1xs7 n GLU 364 Ca -0.17 0.01 0.05 0.00 0.66 0.00 0.00 57.16 57.71 1xs7 n GLU 364 Cb 0.67 -1.50 -0.07 0.00 0.27 0.00 0.00 31.44 30.80 1xs7 n GLU 364 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1xs7 n PHE 365 N -1.05 0.00 -3.78 4.31 3.01 -1.26 -5.01 117.46 113.69 1xs7 n PHE 365 Ca 0.18 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.52 1xs7 n PHE 365 Cb 0.11 -0.20 -0.13 0.00 -0.01 0.00 0.00 39.48 39.25 1xs7 n PHE 365 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1xs7 s ARG 366 N -2.60 0.21 0.07 -1.08 0.52 -1.23 -5.16 118.95 109.68 1xs7 s ARG 366 Ca -0.03 0.36 0.07 0.00 -0.52 0.00 0.00 55.73 55.61 1xs7 s ARG 366 Cb 0.06 0.02 -0.03 0.00 0.52 0.00 0.00 34.95 35.52 1xs7 s ARG 366 CO 0.39 -0.08 -0.18 -0.08 0.02 0.00 0.00 175.30 175.37 1xs7 s THR 367 N 0.54 1.45 1.22 0.02 -1.32 -1.26 -3.16 115.64 113.13 1xs7 s THR 367 Ca -0.04 -1.31 -0.16 0.00 -1.21 0.00 0.00 61.69 58.98 1xs7 s THR 367 Cb -0.05 -1.32 0.30 0.00 -1.51 0.00 0.00 72.50 69.92 1xs7 s THR 367 CO -0.03 -0.02 1.02 0.00 -2.21 0.00 0.00 174.62 173.37 1xs7 s ALA 368 N -1.04 -0.35 0.14 11.08 0.00 -1.26 -4.95 121.76 125.38 1xs7 s ALA 368 Ca 0.04 -0.42 -0.24 0.00 0.00 0.00 0.00 51.96 51.34 1xs7 s ALA 368 Cb -0.09 -3.12 0.07 0.00 0.00 0.00 0.00 23.12 19.97 1xs7 s ALA 368 CO 0.03 -3.93 0.74 0.00 0.00 0.00 0.00 175.76 172.60 1xs7 s ALA 369 N -2.52 -1.58 -0.32 0.00 0.00 -0.81 -4.97 121.76 111.56 1xs7 s ALA 369 Ca 0.68 0.41 -0.02 0.00 0.00 0.00 0.00 51.96 53.03 1xs7 s ALA 369 Cb -0.20 0.74 0.12 0.00 0.00 0.00 0.00 23.12 23.78 1xs7 s ALA 369 CO 0.62 -0.84 0.16 0.08 0.00 0.00 0.00 175.76 175.78 1xs7 s VAL 370 N -3.58 0.02 0.06 0.00 1.01 -1.26 -0.44 120.40 116.21 1xs7 s VAL 370 Ca 0.05 -1.16 0.06 0.00 0.00 0.00 0.00 61.98 60.93 1xs7 s VAL 370 Cb -0.02 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 1xs7 s VAL 370 CO -0.06 -0.84 -0.13 -1.61 0.00 0.00 0.00 175.10 172.46 1xs7 s GLU 371 N 1.66 2.18 0.11 2.72 2.02 -0.27 -4.85 118.70 122.27 1xs7 s GLU 371 Ca 0.13 -0.95 -0.26 0.00 0.02 0.00 0.00 54.97 53.91 1xs7 s GLU 371 Cb -0.19 -2.29 0.08 0.00 0.10 0.00 0.00 34.13 31.83 1xs7 s GLU 371 CO -0.21 0.54 1.07 0.20 0.02 0.00 0.00 175.26 176.88 1xs7 s GLY 372 N -1.71 -0.19 0.54 -1.39 0.00 -1.26 -0.51 107.32 102.81 1xs7 s GLY 372 Ca 0.17 0.14 0.04 0.00 0.00 0.00 0.00 44.72 45.07 1xs7 s GLY 372 CO 0.09 0.84 0.76 2.56 0.00 0.00 0.00 173.10 177.34 1xs7 s PRO 373 N -2.77 2.46 -0.03 2.90 0.04 -1.26 -5.08 135.00 131.27 1xs7 s PRO 373 Ca 0.16 -1.05 -0.00 0.00 0.04 0.00 0.00 61.00 60.15 1xs7 s PRO 373 Cb -0.00 -2.55 0.03 0.00 0.04 0.00 0.00 34.50 32.01 1xs7 s PRO 373 CO 0.01 -0.72 0.02 -0.06 0.04 0.00 0.00 177.00 176.29 1xs7 s PHE 374 N -2.70 0.20 -0.77 0.56 0.40 0.28 -4.92 117.98 111.03 1xs7 s PHE 374 Ca 0.59 0.07 -0.25 0.00 -0.60 0.00 0.00 56.93 56.74 1xs7 s PHE 374 Cb -0.09 -0.38 0.05 0.00 0.51 0.00 0.00 43.02 43.11 1xs7 s PHE 374 CO 0.38 -0.14 1.21 0.08 0.70 0.00 0.00 175.22 177.45 1xs7 s VAL 375 N 1.25 4.00 0.20 -0.44 1.01 -1.26 0.10 120.40 125.25 1xs7 s VAL 375 Ca -0.07 -0.14 0.09 0.00 0.00 0.00 0.00 61.98 61.87 1xs7 s VAL 375 Cb -0.13 -4.86 -0.05 0.00 0.00 0.00 0.00 36.38 31.34 1xs7 s VAL 375 CO -0.02 -1.73 -0.18 -0.89 0.00 0.00 0.00 175.10 172.28 1xs7 s THR 376 N 4.92 1.94 0.46 3.92 2.01 -1.24 -5.01 115.64 122.64 1xs7 s THR 376 Ca 0.33 -2.12 0.04 0.00 0.31 0.00 0.00 61.69 60.25 1xs7 s THR 376 Cb -0.09 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.36 1xs7 s THR 376 CO 0.08 -0.42 0.02 -0.76 -0.69 0.00 0.00 174.62 172.85 1xs7 s LEU 377 N -3.05 2.58 -0.69 4.42 1.43 -1.26 -3.94 118.68 118.17 1xs7 s LEU 377 Ca 0.21 -1.51 -0.16 0.00 -1.03 0.00 0.00 54.13 51.64 1xs7 s LEU 377 Cb -0.04 -0.83 0.02 0.00 0.03 0.00 0.00 46.19 45.37 1xs7 s LEU 377 CO 0.08 -0.67 0.41 0.47 0.23 0.00 0.00 176.35 176.87 1xs7 n ASP 378 N -1.14 -2.70 0.12 2.29 10.43 -1.26 -4.83 116.55 119.46 1xs7 n ASP 378 Ca -0.12 -0.77 0.12 0.00 2.57 0.00 0.00 54.79 56.59 1xs7 n ASP 378 Cb 0.67 -0.99 0.02 0.00 1.84 0.00 0.00 41.12 42.66 1xs7 n ASP 378 CO 0.00 0.00 0.00 0.24 -1.07 0.00 0.00 177.20 176.37 1xs7 h MET 379 N -0.31 0.00 0.00 -1.24 2.86 -2.01 -3.22 114.93 111.02 1xs7 h MET 379 Ca -0.44 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.20 1xs7 h MET 379 Cb 0.89 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.55 1xs7 h MET 379 CO 0.30 0.00 0.00 0.93 1.06 0.00 0.00 176.91 179.20 1xs7 h GLU 380 N 0.00 0.00 -0.03 1.72 5.08 -1.98 -1.18 114.58 118.18 1xs7 h GLU 380 Ca 0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 1xs7 h GLU 380 Cb 1.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 1xs7 h GLU 380 CO 0.00 0.00 -0.79 -0.44 -1.00 0.00 0.00 179.01 176.78 1xs7 h ASP 381 N 0.00 0.34 -0.03 1.42 3.32 -1.93 -2.85 116.42 116.69 1xs7 h ASP 381 Ca 0.00 -0.24 0.01 0.00 0.02 0.00 0.00 57.03 56.82 1xs7 h ASP 381 Cb 0.36 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.81 1xs7 h ASP 381 CO 0.00 0.99 0.11 0.00 -1.72 0.00 0.00 179.24 178.62 1xs7 s GLY 383 N -4.04 2.43 -0.15 0.00 0.00 -1.08 -3.88 107.32 100.61 1xs7 s GLY 383 Ca -0.05 0.90 -0.03 0.00 0.00 0.00 0.00 44.72 45.55 1xs7 s GLY 383 CO 0.42 1.30 -0.07 -0.47 0.00 0.00 0.00 173.10 174.28 1xs7 s TYR 384 N -1.91 2.96 0.00 1.90 5.04 -1.26 -4.91 117.35 119.17 1xs7 s TYR 384 Ca 0.75 -0.42 0.00 0.00 -2.44 0.00 0.00 57.07 54.96 1xs7 s TYR 384 Cb -0.29 -1.93 0.00 0.00 0.35 0.00 0.00 41.96 40.09 1xs7 s TYR 384 CO 0.43 -0.10 0.21 0.09 -1.34 0.00 0.00 175.55 174.84