#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b76 s GLU 2 N 0.00 0.42 -0.06 0.00 2.02 -1.26 -5.18 118.70 114.64 2b76 s GLU 2 Ca 0.00 0.90 -0.19 0.00 0.02 0.00 0.00 54.97 55.70 2b76 s GLU 2 Cb 0.00 0.08 -0.05 0.00 0.10 0.00 0.00 34.13 34.26 2b76 s GLU 2 CO 0.00 -0.18 0.51 1.41 0.02 0.00 0.00 175.26 177.02 2b76 s MET 3 N 1.69 4.27 1.04 1.61 -2.45 -1.26 -5.08 119.30 119.11 2b76 s MET 3 Ca -0.08 0.55 -0.16 0.00 -1.25 0.00 0.00 55.69 54.74 2b76 s MET 3 Cb -0.09 -3.37 0.05 0.00 1.25 0.00 0.00 34.83 32.67 2b76 s MET 3 CO -0.14 0.31 0.07 1.63 1.05 0.00 0.00 175.02 177.94 2b76 n LYS 4 N 3.06 -0.88 -3.90 4.11 5.02 -1.21 -4.78 118.16 119.58 2b76 n LYS 4 Ca -0.08 -0.23 -0.27 0.00 -2.02 0.00 0.00 58.31 55.71 2b76 n LYS 4 Cb 0.51 -1.70 -0.17 0.00 -0.02 0.00 0.00 35.03 33.66 2b76 n LYS 4 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2b76 s ASN 5 N -1.84 2.35 0.23 4.39 -0.87 -1.26 -1.04 114.94 116.91 2b76 s ASN 5 Ca 0.55 -0.40 0.04 0.00 -1.57 0.00 0.00 52.86 51.48 2b76 s ASN 5 Cb -0.15 -0.86 -0.03 0.00 -0.02 0.00 0.00 41.25 40.19 2b76 s ASN 5 CO 0.68 -0.14 0.37 -0.22 -2.57 0.00 0.00 177.10 175.22 2b76 s LEU 6 N 1.69 4.29 -0.39 0.60 2.96 0.16 -4.91 118.68 123.08 2b76 s LEU 6 Ca 0.04 0.14 0.04 0.00 -0.22 0.00 0.00 54.13 54.13 2b76 s LEU 6 Cb -0.13 -2.93 0.11 0.00 0.50 0.00 0.00 46.19 43.74 2b76 s LEU 6 CO -0.08 -0.07 0.11 -0.75 -1.32 0.00 0.00 176.35 174.24 2b76 s LYS 7 N -3.85 1.59 0.22 1.98 2.20 -1.26 0.27 119.74 120.89 2b76 s LYS 7 Ca 0.35 -2.06 -0.26 0.00 -0.36 0.00 0.00 55.97 53.64 2b76 s LYS 7 Cb -0.10 -3.20 -0.09 0.00 -1.51 0.00 0.00 37.83 32.94 2b76 s LYS 7 CO 0.30 -0.99 0.84 0.42 -0.36 0.00 0.00 175.35 175.55 2b76 s ILE 8 N 0.60 4.30 -0.29 5.43 1.01 0.14 -4.50 121.20 127.88 2b76 s ILE 8 Ca 0.13 1.76 -0.03 0.00 0.00 0.00 0.00 60.65 62.50 2b76 s ILE 8 Cb -0.21 -4.13 0.03 0.00 0.01 0.00 0.00 42.46 38.17 2b76 s ILE 8 CO -0.06 0.41 0.01 -0.70 0.00 0.00 0.00 174.94 174.60 2b76 s GLU 9 N -1.42 2.75 -0.07 2.79 2.12 -0.30 -1.17 118.70 123.39 2b76 s GLU 9 Ca 0.40 -1.06 0.03 0.00 0.36 0.00 0.00 54.97 54.70 2b76 s GLU 9 Cb -0.22 -3.19 -0.02 0.00 0.26 0.00 0.00 34.13 30.96 2b76 s GLU 9 CO 0.27 -0.51 -0.16 0.08 -0.54 0.00 0.00 175.26 174.40 2b76 s VAL 10 N 1.35 2.87 -0.48 3.70 1.01 -0.88 -0.57 120.40 127.41 2b76 s VAL 10 Ca -0.01 -0.77 -0.23 0.00 0.00 0.00 0.00 61.98 60.97 2b76 s VAL 10 Cb -0.18 -2.14 0.03 0.00 0.00 0.00 0.00 36.38 34.10 2b76 s VAL 10 CO -0.01 0.57 0.83 -0.69 0.00 0.00 0.00 175.10 175.79 2b76 s VAL 11 N -0.30 4.58 0.31 2.92 1.01 -0.57 -2.95 120.40 125.40 2b76 s VAL 11 Ca 0.02 0.36 -0.09 0.00 0.00 0.00 0.00 61.98 62.27 2b76 s VAL 11 Cb -0.13 -4.38 -0.06 0.00 0.00 0.00 0.00 36.38 31.80 2b76 s VAL 11 CO 0.03 -0.83 0.63 -0.13 0.00 0.00 0.00 175.10 174.79 2b76 s ARG 12 N 3.45 3.75 -0.29 2.72 1.81 -0.18 -4.62 118.95 125.59 2b76 s ARG 12 Ca 0.30 0.27 0.03 0.00 -1.72 0.00 0.00 55.73 54.60 2b76 s ARG 12 Cb -0.12 -2.56 0.19 0.00 -0.45 0.00 0.00 34.95 32.01 2b76 s ARG 12 CO 0.22 0.17 0.55 -0.47 -0.68 0.00 0.00 175.30 175.09 2b76 s TYR 13 N -2.08 -1.60 -0.09 -0.53 5.04 -1.26 0.95 117.35 117.79 2b76 s TYR 13 Ca 0.48 1.13 -0.03 0.00 -2.44 0.00 0.00 57.07 56.22 2b76 s TYR 13 Cb -0.11 0.30 -0.03 0.00 0.35 0.00 0.00 41.96 42.47 2b76 s TYR 13 CO 0.27 -0.99 0.03 1.21 -1.34 0.00 0.00 175.55 174.72 2b76 s ASN 14 N 2.78 5.44 0.42 4.32 3.84 -1.26 -3.40 114.94 127.07 2b76 s ASN 14 Ca 0.13 0.20 0.20 0.00 0.21 0.00 0.00 52.86 53.60 2b76 s ASN 14 Cb -0.12 -1.58 0.90 0.00 -0.55 0.00 0.00 41.25 39.90 2b76 s ASN 14 CO -0.24 0.38 1.85 1.55 -2.79 0.00 0.00 177.10 177.84 2b76 h PRO 15 N 5.08 0.00 0.00 0.43 0.13 -1.83 -3.02 132.00 132.79 2b76 h PRO 15 Ca -0.51 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.60 2b76 h PRO 15 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 2b76 h PRO 15 CO 0.55 0.30 -0.20 1.49 -0.23 0.00 0.00 178.00 179.91 2b76 h GLU 16 N 0.00 0.00 0.00 0.86 4.81 -1.94 -3.42 114.58 114.89 2b76 h GLU 16 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2b76 h GLU 16 Cb 0.69 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.07 2b76 h GLU 16 CO 0.04 0.07 0.00 0.28 -0.73 0.00 0.00 179.01 178.67 2b76 n VAL 17 N -3.07 0.00 -0.64 0.32 0.31 -1.24 -5.09 118.33 108.93 2b76 n VAL 17 Ca 0.03 0.01 -0.31 0.00 -0.01 0.00 0.00 64.34 64.06 2b76 n VAL 17 Cb 0.56 -0.64 0.19 0.00 -0.91 0.00 0.00 33.84 33.04 2b76 n VAL 17 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2b76 n ASP 18 N -1.21 -0.07 -0.00 4.52 8.00 -1.14 -4.96 116.55 121.69 2b76 n ASP 18 Ca 0.00 0.31 0.06 0.00 0.71 0.00 0.00 54.79 55.87 2b76 n ASP 18 Cb 0.00 -1.44 -0.07 0.00 -0.02 0.00 0.00 41.12 39.59 2b76 n ASP 18 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 2b76 n THR 19 N -4.40 0.00 -3.73 -3.53 5.66 -1.26 -4.62 114.28 102.40 2b76 n THR 19 Ca 0.10 -0.23 -0.13 0.00 -3.05 0.00 0.00 64.05 60.75 2b76 n THR 19 Cb 0.52 0.84 -0.08 0.00 -1.55 0.00 0.00 70.33 70.07 2b76 n THR 19 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2b76 s ALA 20 N -2.29 -0.84 0.96 1.79 0.00 -1.26 -5.08 121.76 115.05 2b76 s ALA 20 Ca 0.03 0.25 -0.13 0.00 0.00 0.00 0.00 51.96 52.10 2b76 s ALA 20 Cb 0.09 0.22 0.03 0.00 0.00 0.00 0.00 23.12 23.46 2b76 s ALA 20 CO 0.50 -0.36 0.33 -2.30 0.00 0.00 0.00 175.76 173.93 2b76 n PRO 21 N 0.84 -0.34 -3.63 0.00 -0.02 -1.26 -4.73 135.00 125.87 2b76 n PRO 21 Ca -0.20 -0.06 -0.12 0.00 -2.02 0.00 0.00 63.50 61.10 2b76 n PRO 21 Cb 0.58 -1.81 -0.05 0.00 -0.02 0.00 0.00 33.50 32.19 2b76 n PRO 21 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2b76 s HIS 22 N -2.37 -0.30 1.13 6.00 -3.43 0.27 -4.96 115.29 111.62 2b76 s HIS 22 Ca 0.56 0.21 -0.16 0.00 -0.80 0.00 0.00 55.06 54.87 2b76 s HIS 22 Cb -0.21 0.27 0.25 0.00 -1.43 0.00 0.00 32.58 31.47 2b76 s HIS 22 CO 0.68 -0.63 1.09 -1.12 -2.00 0.00 0.00 174.74 172.76 2b76 s SER 23 N -2.21 1.50 -0.19 7.38 0.01 -1.26 -1.01 113.70 117.92 2b76 s SER 23 Ca -0.03 0.90 -0.29 0.00 1.31 0.00 0.00 55.95 57.84 2b76 s SER 23 Cb -0.00 -1.35 0.12 0.00 0.21 0.00 0.00 66.02 65.00 2b76 s SER 23 CO -0.05 -3.79 0.99 0.00 0.41 0.00 0.00 173.24 170.80 2b76 s ALA 24 N -2.93 -1.94 -0.10 1.44 0.00 -1.15 -4.69 121.76 112.39 2b76 s ALA 24 Ca 0.68 1.65 0.01 0.00 0.00 0.00 0.00 51.96 54.30 2b76 s ALA 24 Cb -0.14 -0.87 0.02 0.00 0.00 0.00 0.00 23.12 22.13 2b76 s ALA 24 CO 0.57 -0.29 -0.10 -0.06 0.00 0.00 0.00 175.76 175.88 2b76 s PHE 25 N -0.76 1.53 0.06 0.00 0.40 -1.26 -2.06 117.98 115.87 2b76 s PHE 25 Ca -0.01 -0.70 0.08 0.00 -0.60 0.00 0.00 56.93 55.70 2b76 s PHE 25 Cb -0.02 -1.20 -0.03 0.00 0.51 0.00 0.00 43.02 42.28 2b76 s PHE 25 CO -0.00 -0.44 -0.20 0.71 0.70 0.00 0.00 175.22 175.99 2b76 s TYR 26 N 1.29 2.49 -0.30 0.36 1.51 -0.32 -4.97 117.35 117.41 2b76 s TYR 26 Ca -0.03 -0.30 -0.06 0.00 -1.01 0.00 0.00 57.07 55.67 2b76 s TYR 26 Cb -0.14 -1.42 0.01 0.00 -0.11 0.00 0.00 41.96 40.31 2b76 s TYR 26 CO -0.04 0.25 0.07 -1.21 -1.11 0.00 0.00 175.55 173.51 2b76 s GLU 27 N -1.52 3.01 -0.13 -0.62 2.02 -1.26 0.23 118.70 120.43 2b76 s GLU 27 Ca 0.14 -0.91 -0.02 0.00 0.02 0.00 0.00 54.97 54.20 2b76 s GLU 27 Cb -0.10 -3.34 -0.03 0.00 0.10 0.00 0.00 34.13 30.76 2b76 s GLU 27 CO 0.05 -0.47 -0.05 0.08 0.02 0.00 0.00 175.26 174.89 2b76 s VAL 28 N 1.47 3.79 0.50 2.63 1.01 0.14 -4.91 120.40 125.02 2b76 s VAL 28 Ca 0.02 -0.41 -0.22 0.00 0.00 0.00 0.00 61.98 61.37 2b76 s VAL 28 Cb -0.17 -2.63 -0.06 0.00 0.00 0.00 0.00 36.38 33.52 2b76 s VAL 28 CO 0.02 0.53 1.19 -2.16 0.00 0.00 0.00 175.10 174.67 2b76 s PRO 29 N 0.04 3.55 -0.02 2.72 0.04 -1.26 -0.67 135.00 139.40 2b76 s PRO 29 Ca -0.00 1.81 -0.28 0.00 0.04 0.00 0.00 61.00 62.56 2b76 s PRO 29 Cb -0.14 -2.28 0.10 0.00 0.04 0.00 0.00 34.50 32.22 2b76 s PRO 29 CO 0.03 -0.74 0.84 1.52 0.04 0.00 0.00 177.00 178.69 2b76 s TYR 30 N -1.56 -0.42 0.27 0.56 -0.85 -0.21 -4.85 117.35 110.30 2b76 s TYR 30 Ca 0.67 0.42 0.02 0.00 -0.52 0.00 0.00 57.07 57.67 2b76 s TYR 30 Cb -0.29 0.51 -0.04 0.00 0.38 0.00 0.00 41.96 42.52 2b76 s TYR 30 CO 0.35 -0.56 0.17 0.16 -1.52 0.00 0.00 175.55 174.15 2b76 s ASP 31 N -2.10 1.04 0.00 -0.18 3.84 -1.26 -3.35 116.67 114.66 2b76 s ASP 31 Ca 0.01 -1.53 0.00 0.00 -0.00 0.00 0.00 52.55 51.03 2b76 s ASP 31 Cb -0.01 0.41 0.00 0.00 -1.38 0.00 0.00 42.92 41.94 2b76 s ASP 31 CO -0.05 -0.90 0.21 0.00 -0.00 0.00 0.00 175.17 174.42 2b76 n ALA 32 N -0.47 1.09 -0.04 2.11 0.00 -1.26 -1.93 120.51 120.02 2b76 n ALA 32 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2b76 n ALA 32 Cb 0.65 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 19.37 2b76 n ALA 32 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2b76 n THR 33 N -0.65 0.00 -1.87 0.00 -2.24 -1.26 -4.91 114.28 103.36 2b76 n THR 33 Ca 0.00 -0.45 -0.42 0.00 -2.27 0.00 0.00 64.05 60.90 2b76 n THR 33 Cb 0.00 1.04 -0.03 0.00 -2.10 0.00 0.00 70.33 69.24 2b76 n THR 33 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2b76 s THR 34 N -0.53 3.34 0.38 4.28 2.01 -0.81 -4.98 115.64 119.33 2b76 s THR 34 Ca 0.00 0.41 0.05 0.00 0.31 0.00 0.00 61.69 62.46 2b76 s THR 34 Cb 0.00 -3.29 -0.00 0.00 0.01 0.00 0.00 72.50 69.22 2b76 s THR 34 CO 0.00 -0.06 0.55 -0.94 -0.69 0.00 0.00 174.62 173.47 2b76 s SER 35 N 4.26 5.87 0.24 3.53 1.04 -1.26 -1.21 113.70 126.17 2b76 s SER 35 Ca 0.81 -0.08 -0.06 0.00 0.48 0.00 0.00 55.95 57.10 2b76 s SER 35 Cb -0.36 -1.24 0.25 0.00 0.10 0.00 0.00 66.02 64.77 2b76 s SER 35 CO 0.34 -0.57 1.84 0.25 0.98 0.00 0.00 173.24 176.08 2b76 h LEU 36 N 0.69 1.06 0.01 2.42 5.85 -0.02 0.27 115.31 125.60 2b76 h LEU 36 Ca -0.45 -0.12 0.01 0.00 0.84 0.00 0.00 57.88 58.16 2b76 h LEU 36 Cb 1.26 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 2b76 h LEU 36 CO 0.53 0.89 -0.07 0.25 -0.34 0.00 0.00 178.44 179.70 2b76 h LEU 37 N 1.16 -0.19 -0.63 2.25 5.85 0.22 0.56 115.31 124.53 2b76 h LEU 37 Ca 0.28 0.03 0.13 0.00 0.84 0.00 0.00 57.88 59.16 2b76 h LEU 37 Cb 0.10 0.08 -0.12 0.00 0.37 0.00 0.00 40.66 41.09 2b76 h LEU 37 CO -0.04 -0.10 -0.14 0.44 -0.34 0.00 0.00 178.44 178.27 2b76 h ASP 38 N -0.12 -0.55 -0.24 1.25 3.32 -1.44 0.04 116.42 118.68 2b76 h ASP 38 Ca 0.02 0.19 -0.04 0.00 0.02 0.00 0.00 57.03 57.21 2b76 h ASP 38 Cb 0.15 0.38 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 2b76 h ASP 38 CO -0.06 -0.20 -0.02 0.00 -1.72 0.00 0.00 179.24 177.23 2b76 h ALA 39 N 1.63 0.33 -0.98 3.45 0.00 -0.55 -1.83 119.26 121.31 2b76 h ALA 39 Ca 0.31 -0.24 0.27 0.00 0.00 0.00 0.00 54.91 55.25 2b76 h ALA 39 Cb 0.48 -0.09 -0.14 0.00 0.00 0.00 0.00 17.79 18.04 2b76 h ALA 39 CO -0.64 0.09 0.52 -0.07 0.00 0.00 0.00 179.25 179.15 2b76 h LEU 40 N 0.20 0.50 0.89 0.00 3.38 0.45 0.14 115.31 120.87 2b76 h LEU 40 Ca 0.07 0.17 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 2b76 h LEU 40 Cb 0.46 0.11 0.01 0.00 0.09 0.00 0.00 40.66 41.33 2b76 h LEU 40 CO 0.02 -0.03 -0.43 1.23 0.09 0.00 0.00 178.44 179.32 2b76 h GLY 41 N 0.42 -1.25 -0.26 0.83 0.00 -0.52 -2.69 103.07 99.61 2b76 h GLY 41 Ca 0.66 0.46 0.26 0.00 0.00 0.00 0.00 47.33 48.71 2b76 h GLY 41 CO -0.55 -0.45 0.55 -1.82 0.00 0.00 0.00 176.54 174.27 2b76 h TYR 42 N -1.24 0.93 0.79 5.60 3.20 0.01 0.27 116.97 126.52 2b76 h TYR 42 Ca -0.12 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.75 2b76 h TYR 42 Cb 0.92 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.94 2b76 h TYR 42 CO -0.01 -0.02 -0.42 0.82 -1.64 0.00 0.00 178.16 176.90 2b76 h ILE 43 N 0.48 0.00 -0.18 1.81 2.04 -1.00 -2.18 117.51 118.48 2b76 h ILE 43 Ca 0.66 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 66.45 2b76 h ILE 43 Cb 1.32 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 2b76 h ILE 43 CO -0.52 0.00 -0.19 0.50 0.00 0.00 0.00 178.15 177.93 2b76 h LYS 44 N -1.11 0.31 -0.69 2.37 3.64 -0.46 0.24 116.57 120.88 2b76 h LYS 44 Ca -0.11 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.16 2b76 h LYS 44 Cb 0.86 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.62 2b76 h LYS 44 CO 0.15 0.50 0.36 -0.44 -2.27 0.00 0.00 179.45 177.75 2b76 h ASP 45 N 0.28 0.87 0.00 4.20 3.45 -0.59 -2.39 116.42 122.24 2b76 h ASP 45 Ca 0.05 -0.11 0.00 0.00 0.43 0.00 0.00 57.03 57.40 2b76 h ASP 45 Cb 0.51 -0.22 0.00 0.00 -0.56 0.00 0.00 39.33 39.06 2b76 h ASP 45 CO 0.03 0.73 0.00 -0.46 -1.57 0.00 0.00 179.24 177.97 2b76 n ASN 46 N -4.49 0.38 0.00 6.45 2.04 -0.82 -4.89 115.26 113.92 2b76 n ASN 46 Ca 0.05 -1.14 0.00 0.00 -0.44 0.00 0.00 54.58 53.06 2b76 n ASN 46 Cb 0.10 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.35 2b76 n ASN 46 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2b76 n LEU 47 N -0.07 0.00 -3.23 -4.53 -0.00 0.34 -4.96 117.00 104.55 2b76 n LEU 47 Ca 0.00 -0.07 -0.14 0.00 -0.00 0.00 0.00 56.01 55.80 2b76 n LEU 47 Cb 0.34 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.70 2b76 n LEU 47 CO 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 177.39 177.29 2b76 s ALA 48 N -0.49 -0.69 0.51 1.47 0.00 0.58 -4.92 121.76 118.21 2b76 s ALA 48 Ca 0.00 -0.98 0.23 0.00 0.00 0.00 0.00 51.96 51.21 2b76 s ALA 48 Cb 0.00 -2.20 1.46 0.00 0.00 0.00 0.00 23.12 22.39 2b76 s ALA 48 CO 0.00 -2.15 2.14 -1.00 0.00 0.00 0.00 175.76 174.75 2b76 h PRO 49 N 6.41 0.00 0.00 0.00 0.13 -1.62 -2.73 132.00 134.18 2b76 h PRO 49 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 2b76 h PRO 49 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2b76 h PRO 49 CO 0.18 0.07 0.00 0.38 -0.23 0.00 0.00 178.00 178.39 2b76 h ASP 50 N 0.00 0.00 -3.00 1.44 2.03 -1.91 -3.45 116.42 111.53 2b76 h ASP 50 Ca -0.00 0.00 -0.52 0.00 -0.73 0.00 0.00 57.03 55.77 2b76 h ASP 50 Cb 0.15 0.00 0.05 0.00 -0.83 0.00 0.00 39.33 38.70 2b76 h ASP 50 CO 0.01 0.00 0.87 -0.22 -1.03 0.00 0.00 179.24 178.87 2b76 s LEU 51 N -5.16 4.37 0.10 0.15 2.96 -1.03 -5.02 118.68 115.05 2b76 s LEU 51 Ca 0.06 2.72 0.08 0.00 -0.22 0.00 0.00 54.13 56.76 2b76 s LEU 51 Cb 0.09 -3.61 -0.03 0.00 0.50 0.00 0.00 46.19 43.14 2b76 s LEU 51 CO 0.53 -0.83 -0.20 -0.94 -1.32 0.00 0.00 176.35 173.59 2b76 s SER 52 N 0.88 2.41 0.05 3.68 1.04 -1.26 -4.92 113.70 115.57 2b76 s SER 52 Ca 0.67 -0.67 -0.28 0.00 0.48 0.00 0.00 55.95 56.15 2b76 s SER 52 Cb -0.45 -0.13 0.09 0.00 0.10 0.00 0.00 66.02 65.64 2b76 s SER 52 CO 0.36 0.04 1.04 -0.72 0.98 0.00 0.00 173.24 174.95 2b76 s TYR 53 N -1.17 -0.16 -0.11 5.02 -0.85 -1.26 -3.39 117.35 115.43 2b76 s TYR 53 Ca 0.05 -0.04 -0.13 0.00 -0.52 0.00 0.00 57.07 56.43 2b76 s TYR 53 Cb -0.10 0.58 -0.05 0.00 0.38 0.00 0.00 41.96 42.78 2b76 s TYR 53 CO 0.04 -0.58 0.30 1.03 -1.52 0.00 0.00 175.55 174.82 2b76 s ARG 54 N -2.97 4.00 -0.13 -3.49 0.52 -1.26 -5.02 118.95 110.60 2b76 s ARG 54 Ca 0.11 0.15 -0.31 0.00 -0.52 0.00 0.00 55.73 55.16 2b76 s ARG 54 Cb 0.00 -3.32 0.13 0.00 0.52 0.00 0.00 34.95 32.28 2b76 s ARG 54 CO -0.02 0.47 1.04 1.67 0.02 0.00 0.00 175.30 178.47 2b76 s TRP 55 N -0.26 -0.28 0.06 -0.53 1.48 -1.26 -3.41 118.94 114.73 2b76 s TRP 55 Ca 0.18 0.33 0.00 0.00 -1.06 0.00 0.00 56.10 55.56 2b76 s TRP 55 Cb -0.14 0.50 0.00 0.00 -1.16 0.00 0.00 33.47 32.67 2b76 s TRP 55 CO 0.07 -0.35 0.00 0.45 -4.06 0.00 0.00 176.95 173.05 2b76 n SER 56 N 0.22 -0.49 0.16 -2.66 2.88 -1.26 -4.99 113.62 107.48 2b76 n SER 56 Ca -0.07 0.11 0.02 0.00 -1.33 0.00 0.00 58.87 57.61 2b76 n SER 56 Cb 0.59 0.85 0.38 0.00 -0.75 0.00 0.00 64.21 65.28 2b76 n SER 56 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2b76 n ARG 58 N -4.20 -0.41 -2.09 0.00 1.74 -1.26 -4.86 116.66 105.58 2b76 n ARG 58 Ca -0.02 0.10 -0.02 0.00 -0.77 0.00 0.00 57.85 57.15 2b76 n ARG 58 Cb 0.33 -3.69 0.05 0.00 -1.02 0.00 0.00 32.46 28.14 2b76 n ARG 58 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2b76 n MET 59 N -1.60 1.45 -3.96 5.56 0.00 -1.26 -4.94 117.12 112.37 2b76 n MET 59 Ca 0.00 -3.12 -0.28 0.00 0.00 0.00 0.00 57.70 54.30 2b76 n MET 59 Cb 0.10 -1.21 -0.00 0.00 0.00 0.00 0.00 33.22 32.11 2b76 n MET 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2b76 n ALA 60 N -0.33 -1.73 0.00 3.17 0.00 -1.26 -4.88 120.51 115.49 2b76 n ALA 60 Ca 0.13 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2b76 n ALA 60 Cb 0.92 -2.51 0.00 0.00 0.00 0.00 0.00 19.45 17.86 2b76 n ALA 60 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2b76 n ILE 61 N -4.43 0.00 0.13 0.00 2.08 -1.26 -4.81 119.36 111.07 2b76 n ILE 61 Ca -0.17 0.00 -0.02 0.00 0.56 0.00 0.00 62.75 63.13 2b76 n ILE 61 Cb 0.62 -0.50 0.19 0.00 -0.75 0.00 0.00 39.64 39.20 2b76 n ILE 61 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2b76 n GLY 63 N 0.13 0.63 0.11 0.00 0.00 -1.26 -4.87 105.19 99.93 2b76 n GLY 63 Ca -0.01 -0.76 -0.12 0.00 0.00 0.00 0.00 46.02 45.12 2b76 n GLY 63 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2b76 n SER 64 N 1.49 0.56 -0.45 1.61 7.64 -1.26 -4.26 113.62 118.96 2b76 n SER 64 Ca 0.00 -0.04 0.01 0.00 1.01 0.00 0.00 58.87 59.85 2b76 n SER 64 Cb 0.13 0.60 0.05 0.00 -1.01 0.00 0.00 64.21 63.98 2b76 n SER 64 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b76 s GLY 66 N -0.50 2.93 0.00 0.00 0.00 -1.26 -1.87 107.32 106.62 2b76 s GLY 66 Ca 0.06 1.49 -0.00 0.00 0.00 0.00 0.00 44.72 46.27 2b76 s GLY 66 CO 0.03 2.12 0.00 1.15 0.00 0.00 0.00 173.10 176.40 2b76 n MET 67 N 0.04 0.00 -4.35 2.90 0.00 0.22 -4.50 117.12 111.42 2b76 n MET 67 Ca 0.04 -0.00 -0.35 0.00 0.00 0.00 0.00 57.70 57.39 2b76 n MET 67 Cb 0.41 0.00 -0.10 0.00 0.00 0.00 0.00 33.22 33.53 2b76 n MET 67 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 175.97 174.33 2b76 s MET 68 N -2.00 3.10 -0.18 3.17 1.00 -0.79 0.15 119.30 123.76 2b76 s MET 68 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 55.69 55.28 2b76 s MET 68 Cb -0.00 -2.83 0.04 0.00 0.00 0.00 0.00 34.83 32.04 2b76 s MET 68 CO 0.00 0.64 -0.09 0.08 0.00 0.00 0.00 175.02 175.65 2b76 s VAL 69 N -0.70 1.43 -1.36 -6.03 1.01 0.60 -1.90 120.40 113.45 2b76 s VAL 69 Ca 0.11 -0.81 -0.06 0.00 0.00 0.00 0.00 61.98 61.22 2b76 s VAL 69 Cb -0.12 -1.52 0.00 0.00 0.00 0.00 0.00 36.38 34.74 2b76 s VAL 69 CO 0.02 0.19 0.47 0.59 0.00 0.00 0.00 175.10 176.37 2b76 n ASN 70 N 4.77 -1.30 0.00 3.32 3.02 0.23 -0.32 115.26 124.98 2b76 n ASN 70 Ca -0.14 -1.04 0.00 0.00 -0.03 0.00 0.00 54.58 53.37 2b76 n ASN 70 Cb 0.47 -2.94 0.00 0.00 -0.61 0.00 0.00 39.78 36.70 2b76 n ASN 70 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2b76 n ASN 71 N -2.88 -0.57 -4.65 6.41 3.02 -1.26 -4.97 115.26 110.36 2b76 n ASN 71 Ca -0.26 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 53.96 2b76 n ASN 71 Cb 0.66 -1.07 -0.09 0.00 -0.61 0.00 0.00 39.78 38.67 2b76 n ASN 71 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2b76 s VAL 72 N -2.66 3.95 0.17 2.41 1.01 0.56 -5.09 120.40 120.75 2b76 s VAL 72 Ca 0.00 -0.72 -0.30 0.00 0.00 0.00 0.00 61.98 60.96 2b76 s VAL 72 Cb 0.00 -2.77 -0.08 0.00 0.00 0.00 0.00 36.38 33.54 2b76 s VAL 72 CO 0.00 0.35 1.19 -2.16 0.00 0.00 0.00 175.10 174.48 2b76 s PRO 73 N -1.61 4.49 0.33 2.72 0.04 -1.26 -0.30 135.00 139.41 2b76 s PRO 73 Ca 0.19 1.85 -0.10 0.00 0.04 0.00 0.00 61.00 62.99 2b76 s PRO 73 Cb -0.11 -3.25 0.02 0.00 0.04 0.00 0.00 34.50 31.19 2b76 s PRO 73 CO 0.10 -0.09 0.58 0.15 0.04 0.00 0.00 177.00 177.78 2b76 s LYS 74 N -0.10 1.92 -0.26 4.56 1.02 0.41 -4.86 119.74 122.44 2b76 s LYS 74 Ca 0.53 -1.51 -0.12 0.00 0.02 0.00 0.00 55.97 54.89 2b76 s LYS 74 Cb -0.32 0.51 -0.05 0.00 -0.52 0.00 0.00 37.83 37.46 2b76 s LYS 74 CO 0.36 -0.84 0.25 -0.51 -0.92 0.00 0.00 175.35 173.69 2b76 s LEU 75 N -3.12 4.07 0.56 3.17 1.43 -1.26 0.70 118.68 124.23 2b76 s LEU 75 Ca 0.23 0.17 0.31 0.00 -1.03 0.00 0.00 54.13 53.81 2b76 s LEU 75 Cb -0.02 -2.24 1.46 0.00 0.03 0.00 0.00 46.19 45.41 2b76 s LEU 75 CO 0.14 -0.05 1.86 0.00 0.23 0.00 0.00 176.35 178.53 2b76 h ALA 76 N 7.94 2.61 -0.64 4.21 0.00 -1.71 0.36 119.26 132.03 2b76 h ALA 76 Ca -0.35 -0.03 0.13 0.00 0.00 0.00 0.00 54.91 54.66 2b76 h ALA 76 Cb 1.17 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.92 2b76 h ALA 76 CO 0.63 -1.01 0.06 0.00 0.00 0.00 0.00 179.25 178.92 2b76 n LYS 78 N -5.23 2.46 -4.18 0.00 4.81 0.11 -4.69 118.16 111.44 2b76 n LYS 78 Ca 0.10 -4.13 -0.22 0.00 -0.87 0.00 0.00 58.31 53.19 2b76 n LYS 78 Cb 0.37 -1.93 -0.17 0.00 0.02 0.00 0.00 35.03 33.32 2b76 n LYS 78 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2b76 s THR 79 N -4.19 0.70 -0.03 3.15 2.01 -1.19 -4.77 115.64 111.31 2b76 s THR 79 Ca 0.42 -0.19 0.01 0.00 0.31 0.00 0.00 61.69 62.24 2b76 s THR 79 Cb 0.37 -0.72 -0.03 0.00 0.01 0.00 0.00 72.50 72.13 2b76 s THR 79 CO -0.11 0.27 -0.01 -0.36 -0.69 0.00 0.00 174.62 173.72 2b76 s PHE 80 N 1.08 3.07 0.50 4.92 0.40 -1.26 0.06 117.98 126.75 2b76 s PHE 80 Ca -0.08 0.10 0.16 0.00 -0.60 0.00 0.00 56.93 56.51 2b76 s PHE 80 Cb -0.14 -1.70 1.22 0.00 0.51 0.00 0.00 43.02 42.91 2b76 s PHE 80 CO -0.01 0.44 2.10 -0.07 0.70 0.00 0.00 175.22 178.38 2b76 h LEU 81 N 4.69 0.09 -2.06 -0.37 3.38 -1.46 -1.93 115.31 117.64 2b76 h LEU 81 Ca -0.49 -0.00 0.11 0.00 0.09 0.00 0.00 57.88 57.58 2b76 h LEU 81 Cb 1.18 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 2b76 h LEU 81 CO 0.56 0.06 0.33 0.08 0.09 0.00 0.00 178.44 179.56 2b76 h ARG 82 N 0.10 0.00 -0.31 1.13 0.11 -1.85 -0.92 114.38 112.64 2b76 h ARG 82 Ca 0.09 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.17 2b76 h ARG 82 Cb 0.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.30 2b76 h ARG 82 CO -0.01 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 179.81 2b76 n ASP 83 N -4.00 1.67 -2.63 0.08 8.00 -0.72 -4.28 116.55 114.67 2b76 n ASP 83 Ca 0.06 -1.98 -0.12 0.00 0.71 0.00 0.00 54.79 53.46 2b76 n ASP 83 Cb 0.51 -0.20 0.03 0.00 -0.02 0.00 0.00 41.12 41.43 2b76 n ASP 83 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2b76 n TYR 84 N 0.41 1.57 -0.09 1.24 4.02 -0.35 -4.92 117.16 119.03 2b76 n TYR 84 Ca 0.11 -2.81 -0.08 0.00 -0.01 0.00 0.00 57.90 55.11 2b76 n TYR 84 Cb 0.27 -0.32 0.08 0.00 -0.02 0.00 0.00 39.34 39.35 2b76 n TYR 84 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 176.86 177.64 2b76 h THR 85 N 3.05 1.27 0.00 -0.72 1.35 -1.75 -2.82 112.91 113.30 2b76 h THR 85 Ca -0.03 -1.33 0.00 0.00 -0.55 0.00 0.00 66.41 64.50 2b76 h THR 85 Cb 1.14 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.75 2b76 h THR 85 CO 0.55 0.45 0.00 0.47 -0.25 0.00 0.00 175.52 176.73 2b76 n ASP 86 N -4.12 0.00 0.00 5.36 9.92 -1.26 -4.94 116.55 121.51 2b76 n ASP 86 Ca 0.00 -1.53 0.00 0.00 -0.53 0.00 0.00 54.79 52.73 2b76 n ASP 86 Cb 0.43 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.91 2b76 n ASP 86 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2b76 n GLY 87 N 0.51 4.18 2.88 0.44 0.00 -1.06 -5.13 105.19 107.01 2b76 n GLY 87 Ca 0.06 -1.41 -0.15 0.00 0.00 0.00 0.00 46.02 44.52 2b76 n GLY 87 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2b76 s MET 88 N -4.14 0.19 -0.22 1.61 1.75 -1.26 -4.86 119.30 112.37 2b76 s MET 88 Ca 0.00 0.47 -0.03 0.00 -1.25 0.00 0.00 55.69 54.88 2b76 s MET 88 Cb 0.00 -0.63 -0.00 0.00 2.84 0.00 0.00 34.83 37.04 2b76 s MET 88 CO 0.00 -0.50 -0.06 0.21 -0.65 0.00 0.00 175.02 174.02 2b76 s LYS 89 N 2.39 3.31 -0.37 4.11 2.20 -1.26 -1.15 119.74 128.97 2b76 s LYS 89 Ca 0.05 -0.67 -0.08 0.00 -0.36 0.00 0.00 55.97 54.92 2b76 s LYS 89 Cb -0.14 -2.97 0.05 0.00 -1.51 0.00 0.00 37.83 33.26 2b76 s LYS 89 CO -0.11 -0.21 0.17 0.08 -0.36 0.00 0.00 175.35 174.91 2b76 s VAL 90 N 1.45 4.05 0.53 4.02 1.01 0.26 0.76 120.40 132.49 2b76 s VAL 90 Ca 0.05 -1.17 0.06 0.00 0.00 0.00 0.00 61.98 60.93 2b76 s VAL 90 Cb -0.14 -3.35 0.04 0.00 0.00 0.00 0.00 36.38 32.92 2b76 s VAL 90 CO -0.04 -0.29 0.44 -1.61 0.00 0.00 0.00 175.10 173.60 2b76 s GLU 91 N 1.43 2.29 0.30 2.72 2.02 -0.80 -1.51 118.70 125.15 2b76 s GLU 91 Ca 0.01 -1.91 -0.28 0.00 0.02 0.00 0.00 54.97 52.80 2b76 s GLU 91 Cb -0.20 -2.19 -0.09 0.00 0.10 0.00 0.00 34.13 31.74 2b76 s GLU 91 CO 0.03 -0.58 1.04 0.00 0.02 0.00 0.00 175.26 175.77 2b76 s ALA 92 N -2.72 3.32 -0.41 5.21 0.00 -1.26 -1.89 121.76 124.01 2b76 s ALA 92 Ca 0.39 0.77 -0.41 0.00 0.00 0.00 0.00 51.96 52.71 2b76 s ALA 92 Cb -0.03 -3.28 -0.16 0.00 0.00 0.00 0.00 23.12 19.66 2b76 s ALA 92 CO 0.24 -0.06 2.02 -0.11 0.00 0.00 0.00 175.76 177.85 2b76 n LEU 93 N 0.97 1.57 -4.23 0.00 7.94 -1.26 -4.50 117.00 117.49 2b76 n LEU 93 Ca 0.00 0.72 -0.34 0.00 -1.11 0.00 0.00 56.01 55.28 2b76 n LEU 93 Cb 0.47 -1.06 0.09 0.00 0.53 0.00 0.00 43.42 43.44 2b76 n LEU 93 CO 0.51 -0.70 -0.66 0.00 -1.11 0.00 0.00 177.39 175.43 2b76 n ALA 94 N 7.50 -3.91 -0.92 1.96 0.00 -1.26 -3.63 120.51 120.25 2b76 n ALA 94 Ca 0.42 -0.68 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2b76 n ALA 94 Cb 0.08 -1.50 0.00 0.00 0.00 0.00 0.00 19.45 18.03 2b76 n ALA 94 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2b76 n ASN 95 N 0.73 -1.59 -4.32 0.00 4.13 -1.26 -4.48 115.26 108.48 2b76 n ASN 95 Ca 0.03 0.00 -0.19 0.00 1.68 0.00 0.00 54.58 56.10 2b76 n ASN 95 Cb 0.55 -0.97 -0.11 0.00 -1.54 0.00 0.00 39.78 37.72 2b76 n ASN 95 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 2b76 s PHE 96 N -2.56 1.66 -0.22 3.10 0.08 -1.24 -4.93 117.98 113.87 2b76 s PHE 96 Ca 0.00 -0.55 -0.21 0.00 0.12 0.00 0.00 56.93 56.29 2b76 s PHE 96 Cb 0.00 -0.81 -0.02 0.00 -0.57 0.00 0.00 43.02 41.62 2b76 s PHE 96 CO 0.00 0.29 0.63 -1.25 -0.10 0.00 0.00 175.22 174.79 2b76 s PRO 97 N -3.22 4.17 0.10 0.24 0.05 -1.26 -4.94 135.00 130.14 2b76 s PRO 97 Ca 0.18 0.59 -0.31 0.00 0.05 0.00 0.00 61.00 61.50 2b76 s PRO 97 Cb -0.03 -3.60 -0.09 0.00 0.05 0.00 0.00 34.50 30.83 2b76 s PRO 97 CO 0.06 -0.30 1.70 0.42 0.05 0.00 0.00 177.00 178.92 2b76 s ILE 98 N 2.12 2.81 -0.24 0.56 1.01 -1.26 -2.54 121.20 123.66 2b76 s ILE 98 Ca 0.28 0.34 -0.16 0.00 0.00 0.00 0.00 60.65 61.11 2b76 s ILE 98 Cb -0.16 -3.22 -0.16 0.00 0.01 0.00 0.00 42.46 38.94 2b76 s ILE 98 CO 0.10 0.00 -0.08 -0.62 0.00 0.00 0.00 174.94 174.33 2b76 n GLU 99 N 5.39 0.59 -3.63 2.79 -0.58 -0.89 -4.92 120.64 119.39 2b76 n GLU 99 Ca 0.16 0.39 -0.12 0.00 -0.42 0.00 0.00 57.16 57.17 2b76 n GLU 99 Cb 0.39 -1.61 -0.07 0.00 -0.57 0.00 0.00 31.44 29.59 2b76 n GLU 99 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 2b76 s ARG 100 N -2.45 0.71 0.00 3.49 3.52 -0.95 -4.16 118.95 119.11 2b76 s ARG 100 Ca -0.34 0.85 0.00 0.00 -0.13 0.00 0.00 55.73 56.11 2b76 s ARG 100 Cb 0.11 0.34 0.00 0.00 -1.56 0.00 0.00 34.95 33.83 2b76 s ARG 100 CO 0.55 -0.09 0.00 -0.25 -0.81 0.00 0.00 175.30 174.70 2b76 n ASP 101 N 2.56 0.00 -2.03 -2.12 8.00 -1.22 0.12 116.55 121.86 2b76 n ASP 101 Ca -0.14 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.18 2b76 n ASP 101 Cb 0.55 0.00 0.17 0.00 -0.02 0.00 0.00 41.12 41.82 2b76 n ASP 101 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2b76 n LEU 102 N 0.00 6.14 -4.25 0.64 4.77 -1.22 -4.65 117.00 118.43 2b76 n LEU 102 Ca 0.00 -3.26 -0.33 0.00 -0.03 0.00 0.00 56.01 52.39 2b76 n LEU 102 Cb 0.00 -0.78 -0.16 0.00 -2.33 0.00 0.00 43.42 40.15 2b76 n LEU 102 CO 0.00 0.95 -0.51 -0.69 -1.33 0.00 0.00 177.39 175.81 2b76 s VAL 103 N -2.81 2.45 0.05 4.08 1.01 0.32 -4.61 120.40 120.90 2b76 s VAL 103 Ca 0.49 -0.85 0.09 0.00 0.00 0.00 0.00 61.98 61.70 2b76 s VAL 103 Cb 0.41 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 2b76 s VAL 103 CO 0.10 0.53 -0.24 0.54 0.00 0.00 0.00 175.10 176.03 2b76 s VAL 104 N 0.67 2.33 -0.00 2.92 0.11 -1.26 -2.09 120.40 123.07 2b76 s VAL 104 Ca -0.09 -1.37 -0.30 0.00 -2.93 0.00 0.00 61.98 57.29 2b76 s VAL 104 Cb -0.16 -1.94 -0.07 0.00 -1.53 0.00 0.00 36.38 32.68 2b76 s VAL 104 CO 0.02 0.33 1.76 -0.62 -3.33 0.00 0.00 175.10 173.26 2b76 s ASP 105 N -1.37 6.58 -0.33 3.54 -1.08 -1.05 -4.86 116.67 118.10 2b76 s ASP 105 Ca 0.13 2.42 0.08 0.00 -0.52 0.00 0.00 52.55 54.66 2b76 s ASP 105 Cb -0.10 -2.54 0.54 0.00 -1.46 0.00 0.00 42.92 39.36 2b76 s ASP 105 CO 0.03 -0.96 1.55 0.23 0.52 0.00 0.00 175.17 176.54 2b76 n MET 106 N 6.99 1.92 -0.09 4.34 2.81 -1.26 -4.34 117.12 127.49 2b76 n MET 106 Ca 0.18 -3.18 -0.11 0.00 -1.81 0.00 0.00 57.70 52.78 2b76 n MET 106 Cb 0.42 -1.89 0.03 0.00 -0.71 0.00 0.00 33.22 31.06 2b76 n MET 106 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 2b76 h THR 107 N 1.01 1.28 -0.52 2.03 1.35 -2.00 -2.96 112.91 113.09 2b76 h THR 107 Ca 0.31 -1.53 0.07 0.00 -0.55 0.00 0.00 66.41 64.71 2b76 h THR 107 Cb 1.88 1.39 -0.06 0.00 -1.73 0.00 0.00 68.15 69.63 2b76 h THR 107 CO 0.54 0.50 0.20 -0.74 -0.25 0.00 0.00 175.52 175.77 2b76 h HIS 108 N 0.68 0.36 -0.35 4.73 6.17 -1.99 0.71 115.15 125.46 2b76 h HIS 108 Ca 0.06 0.03 0.07 0.00 0.71 0.00 0.00 60.37 61.24 2b76 h HIS 108 Cb 0.92 -0.08 -0.09 0.00 2.52 0.00 0.00 27.41 30.68 2b76 h HIS 108 CO 0.05 0.12 -0.37 0.35 0.71 0.00 0.00 177.93 178.80 2b76 h PHE 109 N 0.39 -1.03 0.84 5.26 -0.00 -1.90 -0.59 116.94 119.90 2b76 h PHE 109 Ca 0.25 0.06 -0.04 0.00 -0.00 0.00 0.00 57.97 58.24 2b76 h PHE 109 Cb 0.25 0.50 0.01 0.00 -0.00 0.00 0.00 35.95 36.72 2b76 h PHE 109 CO -0.15 -0.41 -0.40 0.82 -0.00 0.00 0.00 178.31 178.17 2b76 h ILE 110 N -0.31 0.15 -1.43 1.41 1.08 -1.19 0.17 117.51 117.39 2b76 h ILE 110 Ca 0.15 -0.05 0.46 0.00 -0.39 0.00 0.00 64.86 65.03 2b76 h ILE 110 Cb 0.56 0.16 -0.12 0.00 -3.07 0.00 0.00 36.82 34.35 2b76 h ILE 110 CO -0.52 0.00 0.95 -0.08 -0.69 0.00 0.00 178.15 177.81 2b76 h GLU 111 N -1.16 0.05 0.00 2.37 4.81 -0.55 1.35 114.58 121.45 2b76 h GLU 111 Ca -0.11 -0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.06 2b76 h GLU 111 Cb 0.87 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.23 2b76 h GLU 111 CO 0.19 0.03 -0.27 0.77 -0.73 0.00 0.00 179.01 179.01 2b76 h SER 112 N 0.05 0.00 -0.97 1.04 0.02 -0.85 -2.07 113.55 110.77 2b76 h SER 112 Ca 0.84 -0.83 0.26 0.00 -0.84 0.00 0.00 61.79 61.22 2b76 h SER 112 Cb 2.81 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 65.22 2b76 h SER 112 CO -0.35 1.07 0.51 -0.07 -1.14 0.00 0.00 176.83 176.85 2b76 h LEU 113 N -1.00 0.50 0.41 5.07 3.38 0.44 0.01 115.31 124.11 2b76 h LEU 113 Ca -0.07 0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 2b76 h LEU 113 Cb 1.00 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2b76 h LEU 113 CO -0.04 -0.01 -0.20 -0.33 0.09 0.00 0.00 178.44 177.95 2b76 h GLU 114 N 0.44 -0.53 -1.07 1.13 5.08 0.78 -3.36 114.58 117.05 2b76 h GLU 114 Ca 0.64 0.04 0.31 0.00 -1.00 0.00 0.00 59.36 59.35 2b76 h GLU 114 Cb 1.30 0.12 -0.13 0.00 0.50 0.00 0.00 28.75 30.54 2b76 h GLU 114 CO -0.54 -0.23 0.65 0.00 -1.00 0.00 0.00 179.01 177.89 2b76 h ALA 115 N -0.35 2.15 -0.07 3.43 0.00 -0.24 -1.60 119.26 122.58 2b76 h ALA 115 Ca -0.06 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2b76 h ALA 115 Cb 0.54 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2b76 h ALA 115 CO 0.09 -0.68 0.01 0.44 0.00 0.00 0.00 179.25 179.11 2b76 n ILE 116 N -4.84 0.38 -3.50 0.00 -6.64 -1.19 -4.93 119.36 98.64 2b76 n ILE 116 Ca 0.30 -0.16 -0.19 0.00 -1.77 0.00 0.00 62.75 60.93 2b76 n ILE 116 Cb 1.00 -0.51 0.01 0.00 -1.44 0.00 0.00 39.64 38.69 2b76 n ILE 116 CO 0.00 0.00 0.00 0.29 -1.77 0.00 0.00 176.55 175.07 2b76 n LYS 117 N 0.09 -1.59 -1.00 6.28 4.01 -0.60 -4.80 118.16 120.55 2b76 n LYS 117 Ca 0.03 1.13 -0.13 0.00 -0.51 0.00 0.00 58.31 58.83 2b76 n LYS 117 Cb 0.38 -3.43 -0.16 0.00 -0.51 0.00 0.00 35.03 31.31 2b76 n LYS 117 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 2b76 n PRO 118 N -1.95 2.06 -3.89 1.97 -0.04 -1.26 -4.81 135.00 127.08 2b76 n PRO 118 Ca -0.18 -1.05 -0.11 0.00 -0.04 0.00 0.00 63.50 62.13 2b76 n PRO 118 Cb 0.63 -2.04 -0.10 0.00 -0.04 0.00 0.00 33.50 31.95 2b76 n PRO 118 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2b76 s TYR 119 N 1.11 0.09 -0.10 0.54 -0.85 -1.26 -5.04 117.35 111.83 2b76 s TYR 119 Ca 0.66 -0.25 -0.37 0.00 -0.52 0.00 0.00 57.07 56.59 2b76 s TYR 119 Cb 0.31 -0.08 -0.14 0.00 0.38 0.00 0.00 41.96 42.43 2b76 s TYR 119 CO -0.00 -0.30 1.73 -0.89 -1.52 0.00 0.00 175.55 174.56 2b76 n ILE 120 N 1.28 0.34 -4.80 -3.49 2.08 -1.26 -4.93 119.36 108.58 2b76 n ILE 120 Ca -0.22 -0.06 -0.33 0.00 0.56 0.00 0.00 62.75 62.70 2b76 n ILE 120 Cb 0.56 -1.47 -0.14 0.00 -0.75 0.00 0.00 39.64 37.84 2b76 n ILE 120 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 2b76 s ILE 121 N 3.04 3.11 -1.12 1.39 1.01 -1.26 -4.77 121.20 122.59 2b76 s ILE 121 Ca 0.92 -0.67 -0.05 0.00 0.00 0.00 0.00 60.65 60.85 2b76 s ILE 121 Cb -0.86 -2.27 0.01 0.00 0.01 0.00 0.00 42.46 39.35 2b76 s ILE 121 CO 0.54 0.55 0.96 0.61 0.00 0.00 0.00 174.94 177.61 2b76 n GLY 122 N 3.01 -0.31 3.09 6.18 0.00 -1.26 0.21 105.19 116.12 2b76 n GLY 122 Ca -0.18 0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.57 2b76 n GLY 122 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2b76 s ASN 123 N -3.60 5.16 0.46 1.61 3.04 -1.26 -4.57 114.94 115.79 2b76 s ASN 123 Ca 0.32 -2.58 0.17 0.00 0.04 0.00 0.00 52.86 50.82 2b76 s ASN 123 Cb -0.14 -1.82 1.14 0.00 -1.54 0.00 0.00 41.25 38.88 2b76 s ASN 123 CO 0.63 -0.42 1.98 0.77 -3.04 0.00 0.00 177.10 177.02 2b76 h SER 124 N 7.34 0.26 -3.62 -4.21 4.64 -1.95 -3.45 113.55 112.56 2b76 h SER 124 Ca -0.06 0.01 -0.55 0.00 -0.47 0.00 0.00 61.79 60.72 2b76 h SER 124 Cb 0.98 -0.04 0.18 0.00 -0.31 0.00 0.00 62.40 63.21 2b76 h SER 124 CO 0.70 0.15 -0.09 -2.11 -0.87 0.00 0.00 176.83 174.61 2b76 n ARG 125 N -4.45 0.31 -4.27 4.77 1.85 -1.26 -5.01 116.66 108.60 2b76 n ARG 125 Ca 0.10 0.16 -0.17 0.00 -1.00 0.00 0.00 57.85 56.94 2b76 n ARG 125 Cb 0.45 -2.09 -0.10 0.00 -1.05 0.00 0.00 32.46 29.66 2b76 n ARG 125 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2b76 s THR 126 N -1.95 1.40 0.29 8.89 -4.23 -1.26 -5.06 115.64 113.71 2b76 s THR 126 Ca 0.69 -1.96 -0.02 0.00 -1.18 0.00 0.00 61.69 59.22 2b76 s THR 126 Cb -0.33 -1.77 0.38 0.00 1.34 0.00 0.00 72.50 72.12 2b76 s THR 126 CO 0.54 -0.56 1.59 0.00 -0.54 0.00 0.00 174.62 175.65 2b76 h ALA 127 N 3.03 1.00 -0.22 3.99 0.00 -1.95 0.37 119.26 125.48 2b76 h ALA 127 Ca -0.38 0.32 0.06 0.00 0.00 0.00 0.00 54.91 54.91 2b76 h ALA 127 Cb 1.20 0.57 -0.01 0.00 0.00 0.00 0.00 17.79 19.55 2b76 h ALA 127 CO 0.58 -0.50 0.20 0.38 0.00 0.00 0.00 179.25 179.90 2b76 h ASP 128 N 0.04 0.00 0.51 0.00 3.04 -2.03 0.29 116.42 118.27 2b76 h ASP 128 Ca 0.53 0.00 -0.06 0.00 -3.24 0.00 0.00 57.03 54.26 2b76 h ASP 128 Cb 1.02 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.31 2b76 h ASP 128 CO -0.86 0.00 -0.29 1.56 -2.04 0.00 0.00 179.24 177.60 2b76 h GLN 129 N 0.00 0.00 0.00 4.15 4.20 -0.67 -3.50 115.11 119.29 2b76 h GLN 129 Ca 0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.81 2b76 h GLN 129 Cb 0.50 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.28 2b76 h GLN 129 CO -0.00 0.29 0.00 0.41 -0.67 0.00 0.00 178.83 178.86 2b76 n GLY 130 N -0.34 0.71 3.79 3.46 0.00 0.10 -5.03 105.19 107.89 2b76 n GLY 130 Ca -0.01 -2.16 -0.29 0.00 0.00 0.00 0.00 46.02 43.56 2b76 n GLY 130 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2b76 s THR 131 N -1.15 1.98 0.86 2.61 -4.23 -1.26 -4.59 115.64 109.86 2b76 s THR 131 Ca 0.00 0.00 -0.09 0.00 -1.18 0.00 0.00 61.69 60.42 2b76 s THR 131 Cb 0.00 -2.75 0.18 0.00 1.34 0.00 0.00 72.50 71.26 2b76 s THR 131 CO 0.00 0.00 1.18 0.20 -0.54 0.00 0.00 174.62 175.46 2b76 s ASN 132 N -4.09 3.57 0.10 3.99 0.01 -1.26 -5.05 114.94 112.21 2b76 s ASN 132 Ca 0.65 -0.13 0.04 0.00 -0.71 0.00 0.00 52.86 52.72 2b76 s ASN 132 Cb -0.14 -0.01 -0.04 0.00 0.41 0.00 0.00 41.25 41.47 2b76 s ASN 132 CO 0.53 -2.41 0.04 -0.63 -1.51 0.00 0.00 177.10 173.13 2b76 s ILE 133 N -3.56 4.23 -0.29 0.60 1.01 -1.26 -5.07 121.20 116.86 2b76 s ILE 133 Ca 0.72 -0.95 -0.14 0.00 0.00 0.00 0.00 60.65 60.28 2b76 s ILE 133 Cb -0.04 -3.04 0.10 0.00 0.01 0.00 0.00 42.46 39.49 2b76 s ILE 133 CO 0.49 0.08 0.67 -1.58 0.00 0.00 0.00 174.94 174.61 2b76 s GLN 134 N -2.46 0.66 0.27 2.79 0.74 -1.26 -4.99 119.66 115.41 2b76 s GLN 134 Ca 0.28 1.30 -0.14 0.00 0.05 0.00 0.00 55.36 56.84 2b76 s GLN 134 Cb -0.12 0.38 -0.08 0.00 1.10 0.00 0.00 33.01 34.29 2b76 s GLN 134 CO 0.20 -0.17 0.67 0.95 -0.55 0.00 0.00 175.29 176.39 2b76 s THR 135 N 2.05 4.74 0.62 -0.34 -4.23 -1.26 -4.87 115.64 112.35 2b76 s THR 135 Ca -0.09 0.87 0.23 0.00 -1.18 0.00 0.00 61.69 61.52 2b76 s THR 135 Cb -0.07 -3.66 0.30 0.00 1.34 0.00 0.00 72.50 70.40 2b76 s THR 135 CO -0.20 -0.05 1.55 -0.65 -0.54 0.00 0.00 174.62 174.73 2b76 h PRO 136 N 2.64 0.00 0.19 3.99 0.11 -2.01 1.55 132.00 138.45 2b76 h PRO 136 Ca -0.48 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2b76 h PRO 136 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2b76 h PRO 136 CO 0.66 0.00 -0.09 0.00 -0.21 0.00 0.00 178.00 178.36 2b76 h ALA 137 N 0.87 -0.25 -0.89 -0.75 0.00 -2.01 -3.05 119.26 113.19 2b76 h ALA 137 Ca 0.22 -0.14 0.12 0.00 0.00 0.00 0.00 54.91 55.11 2b76 h ALA 137 Cb 1.77 0.10 -0.08 0.00 0.00 0.00 0.00 17.79 19.57 2b76 h ALA 137 CO -0.00 -0.26 0.51 1.96 0.00 0.00 0.00 179.25 181.47 2b76 h GLN 138 N -1.02 0.77 0.18 0.00 4.20 0.18 -1.60 115.11 117.82 2b76 h GLN 138 Ca -0.03 -0.05 0.01 0.00 0.06 0.00 0.00 58.65 58.65 2b76 h GLN 138 Cb 0.35 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 27.92 2b76 h GLN 138 CO 0.04 0.51 -0.44 1.98 -0.67 0.00 0.00 178.83 180.25 2b76 h MET 139 N 0.79 -0.69 -0.97 1.46 4.05 -1.18 -2.51 114.93 115.88 2b76 h MET 139 Ca 0.46 0.05 0.35 0.00 -0.28 0.00 0.00 59.70 60.28 2b76 h MET 139 Cb 0.52 0.16 -0.12 0.00 -0.80 0.00 0.00 31.60 31.36 2b76 h MET 139 CO -0.30 -0.46 0.60 0.00 0.23 0.00 0.00 176.91 176.98 2b76 n ALA 140 N -2.83 0.97 -0.08 0.39 0.00 -0.60 -1.50 120.51 116.85 2b76 n ALA 140 Ca -0.08 0.70 -0.07 0.00 0.00 0.00 0.00 53.44 54.00 2b76 n ALA 140 Cb 0.39 -0.81 -0.01 0.00 0.00 0.00 0.00 19.45 19.03 2b76 n ALA 140 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2b76 h LYS 141 N 0.00 -0.05 -0.01 0.00 1.63 -1.46 -3.07 116.57 113.60 2b76 h LYS 141 Ca 0.67 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.47 2b76 h LYS 141 Cb 2.05 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 33.69 2b76 h LYS 141 CO -0.43 -0.03 -0.33 2.48 -3.45 0.00 0.00 179.45 177.69 2b76 n TYR 142 N -5.29 0.00 -0.20 1.91 0.18 -0.57 -4.83 117.16 108.37 2b76 n TYR 142 Ca 0.00 0.00 -0.06 0.00 1.88 0.00 0.00 57.90 59.72 2b76 n TYR 142 Cb 0.20 0.00 -0.05 0.00 -0.38 0.00 0.00 39.34 39.11 2b76 n TYR 142 CO 0.00 0.00 0.00 1.25 -2.08 0.00 0.00 176.86 176.03 2b76 h HIS 143 N 1.83 -1.01 -0.82 -3.48 2.76 -1.25 -1.77 115.15 111.42 2b76 h HIS 143 Ca 0.00 0.07 0.15 0.00 -2.20 0.00 0.00 60.37 58.39 2b76 h HIS 143 Cb 0.55 0.50 -0.06 0.00 1.55 0.00 0.00 27.41 29.96 2b76 h HIS 143 CO 0.00 -0.21 0.54 0.37 -1.30 0.00 0.00 177.93 177.33 2b76 h GLN 144 N -0.04 0.49 0.00 5.26 4.15 -1.88 -0.81 115.11 122.28 2b76 h GLN 144 Ca 0.08 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.47 2b76 h GLN 144 Cb 0.24 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.82 2b76 h GLN 144 CO -0.47 0.32 0.00 1.19 -1.93 0.00 0.00 178.83 177.94 2b76 n PHE 145 N -4.51 0.00 0.23 3.99 3.72 -0.67 -1.96 117.46 118.27 2b76 n PHE 145 Ca 0.16 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.61 2b76 n PHE 145 Cb 0.53 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.15 2b76 n PHE 145 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2b76 n SER 146 N -0.57 2.26 -1.09 4.37 3.41 -0.31 -4.54 113.62 117.15 2b76 n SER 146 Ca 0.02 -1.64 0.09 0.00 -0.26 0.00 0.00 58.87 57.08 2b76 n SER 146 Cb 0.01 -0.08 0.26 0.00 -0.26 0.00 0.00 64.21 64.14 2b76 n SER 146 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b76 n GLY 147 N 0.57 1.76 3.73 5.00 0.00 -0.83 -4.94 105.19 110.49 2b76 n GLY 147 Ca 0.08 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 2b76 n GLY 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b76 n ILE 149 N 3.16 2.53 -3.84 0.00 -5.35 -1.26 -4.95 119.36 109.65 2b76 n ILE 149 Ca 0.08 -1.95 -0.30 0.00 -0.27 0.00 0.00 62.75 60.31 2b76 n ILE 149 Cb 0.43 -0.30 -0.00 0.00 -1.74 0.00 0.00 39.64 38.03 2b76 n ILE 149 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 2b76 n ASN 150 N -0.46 -3.90 0.11 7.28 4.13 -1.26 -4.41 115.26 116.76 2b76 n ASN 150 Ca 0.29 -0.73 -0.03 0.00 1.68 0.00 0.00 54.58 55.79 2b76 n ASN 150 Cb 1.06 -3.17 0.05 0.00 -1.54 0.00 0.00 39.78 36.18 2b76 n ASN 150 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2b76 n GLY 152 N 0.76 0.75 0.17 0.00 0.00 -1.26 -4.69 105.19 100.90 2b76 n GLY 152 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 2b76 n GLY 152 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2b76 h LEU 153 N 0.00 0.12 -0.50 0.99 3.38 -1.95 -2.48 115.31 114.87 2b76 h LEU 153 Ca 0.00 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.79 2b76 h LEU 153 Cb 0.00 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2b76 h LEU 153 CO 0.00 0.62 -0.18 0.00 0.09 0.00 0.00 178.44 178.98 2b76 h TYR 155 N 0.86 0.00 -0.70 0.00 -1.99 -1.86 -0.08 116.97 113.20 2b76 h TYR 155 Ca 0.12 0.00 -0.21 0.00 2.00 0.00 0.00 58.73 60.64 2b76 h TYR 155 Cb 0.75 0.00 -0.13 0.00 2.00 0.00 0.00 36.73 39.36 2b76 h TYR 155 CO 0.05 0.00 0.25 0.00 -0.00 0.00 0.00 178.16 178.46 2b76 n ALA 156 N -2.06 4.51 0.00 3.88 0.00 -0.40 -4.27 120.51 122.17 2b76 n ALA 156 Ca -0.02 -2.43 0.00 0.00 0.00 0.00 0.00 53.44 50.99 2b76 n ALA 156 Cb 0.09 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.36 2b76 n ALA 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b76 n ALA 157 N -0.29 1.17 -2.78 0.00 0.00 -0.06 -4.77 120.51 113.78 2b76 n ALA 157 Ca 0.40 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.41 2b76 n ALA 157 Cb 1.35 0.03 -0.04 0.00 0.00 0.00 0.00 19.45 20.79 2b76 n ALA 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b76 h PRO 159 N 9.61 0.37 -0.36 0.00 0.14 -1.94 0.18 132.00 140.01 2b76 h PRO 159 Ca -0.28 -0.02 0.10 0.00 0.14 0.00 0.00 66.00 65.94 2b76 h PRO 159 Cb 1.07 -0.08 -0.01 0.00 0.14 0.00 0.00 31.00 32.11 2b76 h PRO 159 CO 1.19 0.25 0.55 1.96 0.14 0.00 0.00 178.00 182.09 2b76 h GLN 160 N 0.39 0.00 0.11 0.86 1.08 -1.91 0.95 115.11 116.59 2b76 h GLN 160 Ca 0.25 0.00 -0.30 0.00 -1.45 0.00 0.00 58.65 57.15 2b76 h GLN 160 Cb 0.48 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.90 2b76 h GLN 160 CO -0.06 0.00 -1.58 0.35 -0.95 0.00 0.00 178.83 176.58 2b76 h PHE 161 N 0.00 0.43 0.00 2.96 3.57 -0.88 -3.11 116.94 119.90 2b76 h PHE 161 Ca 0.17 -0.31 0.00 0.00 3.53 0.00 0.00 57.97 61.36 2b76 h PHE 161 Cb 1.27 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.00 2b76 h PHE 161 CO 0.00 1.62 0.00 0.41 -2.23 0.00 0.00 178.31 178.11 2b76 n GLY 162 N 1.78 -0.10 0.00 2.40 0.00 0.30 -1.72 105.19 107.85 2b76 n GLY 162 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.74 2b76 n GLY 162 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2b76 n LEU 163 N -0.29 0.00 -3.25 0.99 4.77 0.36 -4.91 117.00 114.68 2b76 n LEU 163 Ca 0.00 -0.05 -0.15 0.00 -0.03 0.00 0.00 56.01 55.78 2b76 n LEU 163 Cb 0.07 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.10 2b76 n LEU 163 CO 0.00 0.00 -0.11 0.21 -1.33 0.00 0.00 177.39 176.16 2b76 s ASN 164 N -1.64 0.49 0.00 -1.43 2.47 -0.70 -5.03 114.94 109.10 2b76 s ASN 164 Ca 0.00 -1.82 0.05 0.00 0.42 0.00 0.00 52.86 51.51 2b76 s ASN 164 Cb 0.00 0.75 0.29 0.00 -1.45 0.00 0.00 41.25 40.84 2b76 s ASN 164 CO 0.00 -0.20 0.85 -2.65 -3.72 0.00 0.00 177.10 171.39 2b76 n PRO 165 N 3.75 0.13 0.00 0.43 -0.02 -1.10 -2.24 135.00 135.96 2b76 n PRO 165 Ca 0.16 0.08 0.11 0.00 -2.02 0.00 0.00 63.50 61.83 2b76 n PRO 165 Cb 0.49 -1.50 0.09 0.00 -0.02 0.00 0.00 33.50 32.56 2b76 n PRO 165 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2b76 n GLU 166 N -1.09 0.04 -1.94 -0.52 2.13 -1.26 -4.91 120.64 113.09 2b76 n GLU 166 Ca 0.03 -0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.43 2b76 n GLU 166 Cb 0.03 -1.51 -0.03 0.00 0.27 0.00 0.00 31.44 30.19 2b76 n GLU 166 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 2b76 s PHE 167 N -3.03 2.31 -1.07 4.31 5.36 -0.95 -4.85 117.98 120.06 2b76 s PHE 167 Ca 0.09 0.28 0.09 0.00 -0.96 0.00 0.00 56.93 56.43 2b76 s PHE 167 Cb 0.17 -3.96 0.40 0.00 -0.34 0.00 0.00 43.02 39.29 2b76 s PHE 167 CO 0.77 -3.90 1.27 0.44 -1.46 0.00 0.00 175.22 172.35 2b76 n ILE 168 N 4.88 1.27 -0.27 3.12 -5.35 -0.54 -4.97 119.36 117.51 2b76 n ILE 168 Ca 0.16 0.32 0.01 0.00 -0.27 0.00 0.00 62.75 62.97 2b76 n ILE 168 Cb 0.41 -1.16 -0.01 0.00 -1.74 0.00 0.00 39.64 37.14 2b76 n ILE 168 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2b76 n GLY 169 N -0.54 -2.90 0.00 3.28 0.00 -1.26 -4.35 105.19 99.41 2b76 n GLY 169 Ca 0.03 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.75 2b76 n GLY 169 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2b76 n PRO 170 N -2.03 0.00 -0.31 1.61 -0.04 -1.26 -2.46 135.00 130.51 2b76 n PRO 170 Ca -0.01 0.78 -0.05 0.00 -0.04 0.00 0.00 63.50 64.18 2b76 n PRO 170 Cb 0.10 -1.28 -0.03 0.00 -0.04 0.00 0.00 33.50 32.25 2b76 n PRO 170 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b76 n ALA 171 N -2.13 -0.34 -0.14 0.55 0.00 -1.26 -0.91 120.51 116.28 2b76 n ALA 171 Ca 0.00 0.69 -0.12 0.00 0.00 0.00 0.00 53.44 54.01 2b76 n ALA 171 Cb 0.00 -0.20 -0.07 0.00 0.00 0.00 0.00 19.45 19.18 2b76 n ALA 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b76 h ALA 172 N 0.64 -0.62 -0.35 0.00 0.00 -1.68 0.32 119.26 117.58 2b76 h ALA 172 Ca 0.18 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.13 2b76 h ALA 172 Cb 0.37 1.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 2b76 h ALA 172 CO -0.73 -0.97 0.21 0.82 0.00 0.00 0.00 179.25 178.58 2b76 h ILE 173 N -0.37 1.05 0.04 0.00 2.04 -0.76 -0.84 117.51 118.68 2b76 h ILE 173 Ca 0.10 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.83 2b76 h ILE 173 Cb 0.59 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 37.22 2b76 h ILE 173 CO -0.59 0.08 -0.40 0.74 0.00 0.00 0.00 178.15 177.98 2b76 h THR 174 N 0.43 0.00 -0.65 -0.27 2.02 0.00 0.53 112.91 114.98 2b76 h THR 174 Ca 0.13 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.42 2b76 h THR 174 Cb -0.01 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.28 2b76 h THR 174 CO -0.05 0.00 -0.35 0.25 0.37 0.00 0.00 175.52 175.74 2b76 h LEU 175 N -0.53 -1.21 0.38 2.58 5.85 -0.24 0.28 115.31 122.43 2b76 h LEU 175 Ca 0.00 0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 2b76 h LEU 175 Cb 0.55 0.60 -0.03 0.00 0.37 0.00 0.00 40.66 42.15 2b76 h LEU 175 CO -0.25 -0.30 -0.51 0.00 -0.34 0.00 0.00 178.44 177.04 2b76 h ALA 176 N 1.03 -1.10 -0.99 1.25 0.00 -0.35 -1.24 119.26 117.86 2b76 h ALA 176 Ca 0.25 -0.17 0.28 0.00 0.00 0.00 0.00 54.91 55.27 2b76 h ALA 176 Cb 0.56 0.78 -0.18 0.00 0.00 0.00 0.00 17.79 18.94 2b76 h ALA 176 CO -0.72 -1.16 0.04 1.58 0.00 0.00 0.00 179.25 178.99 2b76 n HIS 177 N -5.46 0.65 -0.26 0.00 -0.00 0.18 0.13 115.22 110.46 2b76 n HIS 177 Ca -0.11 1.19 0.01 0.00 -0.00 0.00 0.00 57.72 58.81 2b76 n HIS 177 Cb 0.44 -1.26 0.14 0.00 -0.00 0.00 0.00 29.99 29.31 2b76 n HIS 177 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.34 176.25 2b76 h ARG 178 N 0.00 0.70 -0.08 1.57 1.12 0.63 0.53 114.38 118.85 2b76 h ARG 178 Ca 0.61 -0.04 -0.18 0.00 -1.11 0.00 0.00 59.98 59.26 2b76 h ARG 178 Cb 1.28 -0.16 -0.01 0.00 -0.01 0.00 0.00 29.97 31.07 2b76 h ARG 178 CO -0.92 0.46 -0.72 1.88 -3.11 0.00 0.00 179.97 177.57 2b76 h TYR 179 N 0.72 0.52 -0.63 2.20 0.05 0.03 -2.67 116.97 117.19 2b76 h TYR 179 Ca 0.35 -0.23 -0.05 0.00 0.05 0.00 0.00 58.73 58.86 2b76 h TYR 179 Cb 0.30 -0.08 -0.03 0.00 1.01 0.00 0.00 36.73 37.93 2b76 h TYR 179 CO -0.08 0.98 0.21 -0.91 -1.05 0.00 0.00 178.16 177.31 2b76 h ASN 180 N 0.27 0.88 0.40 3.88 4.21 0.11 -2.33 115.58 123.00 2b76 h ASN 180 Ca -0.03 -0.14 0.00 0.00 1.21 0.00 0.00 56.30 57.34 2b76 h ASN 180 Cb 1.29 -0.23 0.00 0.00 -1.12 0.00 0.00 38.32 38.26 2b76 h ASN 180 CO 0.12 0.82 -0.16 -0.62 -1.29 0.00 0.00 177.43 176.30 2b76 n GLU 181 N -4.28 0.59 -2.82 0.81 -0.58 0.16 -4.85 120.64 109.68 2b76 n GLU 181 Ca 0.05 -0.24 -0.43 0.00 -0.42 0.00 0.00 57.16 56.13 2b76 n GLU 181 Cb 0.20 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 29.54 2b76 n GLU 181 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2b76 s ASP 182 N -2.57 6.64 0.62 1.62 3.68 -0.88 -4.45 116.67 121.33 2b76 s ASP 182 Ca 0.25 0.49 0.21 0.00 2.13 0.00 0.00 52.55 55.63 2b76 s ASP 182 Cb 0.20 -2.46 0.81 0.00 -1.45 0.00 0.00 42.92 40.02 2b76 s ASP 182 CO 0.51 -0.88 1.35 -1.28 0.13 0.00 0.00 175.17 174.99 2b76 h SER 183 N 8.57 0.00 -0.14 -0.34 0.87 -1.87 -0.66 113.55 119.99 2b76 h SER 183 Ca -0.23 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 2b76 h SER 183 Cb 1.08 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 2b76 h SER 183 CO 0.98 0.00 0.00 -2.11 -0.53 0.00 0.00 176.83 175.17 2b76 n ARG 184 N -3.10 2.16 -2.57 2.24 1.85 -1.26 -4.96 116.66 111.02 2b76 n ARG 184 Ca 0.14 -1.71 -0.30 0.00 -1.00 0.00 0.00 57.85 54.98 2b76 n ARG 184 Cb 1.21 -1.47 -0.01 0.00 -1.05 0.00 0.00 32.46 31.14 2b76 n ARG 184 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 2b76 s ASP 185 N -1.81 6.40 -0.18 2.89 -1.08 -0.26 -4.72 116.67 117.91 2b76 s ASP 185 Ca 0.33 1.15 0.23 0.00 -0.52 0.00 0.00 52.55 53.75 2b76 s ASP 185 Cb 0.21 -2.34 0.48 0.00 -1.46 0.00 0.00 42.92 39.80 2b76 s ASP 185 CO 0.31 -0.56 1.14 1.41 0.52 0.00 0.00 175.17 177.99 2b76 n HIS 186 N -1.89 0.77 -2.08 -5.34 8.25 0.57 -4.87 115.22 110.63 2b76 n HIS 186 Ca 0.03 -1.61 -0.12 0.00 -0.26 0.00 0.00 57.72 55.76 2b76 n HIS 186 Cb 0.54 -0.15 0.07 0.00 1.12 0.00 0.00 29.99 31.57 2b76 n HIS 186 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2b76 n GLY 187 N -0.28 5.14 0.22 -1.41 0.00 -1.18 -4.50 105.19 103.17 2b76 n GLY 187 Ca 0.06 -2.03 -0.09 0.00 0.00 0.00 0.00 46.02 43.96 2b76 n GLY 187 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2b76 h LYS 188 N 1.91 0.71 0.00 1.61 3.64 -1.92 -2.75 116.57 119.77 2b76 h LYS 188 Ca 0.18 -0.16 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 2b76 h LYS 188 Cb 1.40 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 33.10 2b76 h LYS 188 CO 0.47 0.69 -0.12 0.87 -2.27 0.00 0.00 179.45 179.08 2b76 h LYS 189 N 0.59 -0.20 -1.61 1.90 1.57 -2.01 -0.98 116.57 115.83 2b76 h LYS 189 Ca 0.14 0.01 0.47 0.00 -1.87 0.00 0.00 60.65 59.40 2b76 h LYS 189 Cb 0.29 0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.58 2b76 h LYS 189 CO -0.00 -0.14 1.15 0.93 -0.57 0.00 0.00 179.45 180.83 2b76 h GLU 190 N -0.21 0.00 0.00 3.15 3.07 -1.87 -2.42 114.58 116.30 2b76 h GLU 190 Ca 0.04 -0.00 -0.11 0.00 -0.50 0.00 0.00 59.36 58.80 2b76 h GLU 190 Cb 0.27 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 2b76 h GLU 190 CO -0.12 0.00 -1.95 0.54 -1.40 0.00 0.00 179.01 176.09 2b76 n ARG 191 N -4.07 0.78 -0.02 2.33 1.74 -0.60 -4.72 116.66 112.10 2b76 n ARG 191 Ca 0.36 -0.11 -0.12 0.00 -0.77 0.00 0.00 57.85 57.21 2b76 n ARG 191 Cb 1.66 -1.43 -0.07 0.00 -1.02 0.00 0.00 32.46 31.59 2b76 n ARG 191 CO 0.00 0.00 0.00 0.52 -1.52 0.00 0.00 177.63 176.63 2b76 h MET 192 N 0.00 0.15 -0.93 5.56 2.86 -0.69 -3.23 114.93 118.65 2b76 h MET 192 Ca -0.16 -0.04 0.36 0.00 -2.06 0.00 0.00 59.70 57.80 2b76 h MET 192 Cb 1.25 -0.02 -0.14 0.00 0.06 0.00 0.00 31.60 32.75 2b76 h MET 192 CO 0.01 0.36 0.55 0.00 1.06 0.00 0.00 176.91 178.89 2b76 n ALA 193 N -2.26 0.94 0.07 6.32 0.00 -1.25 -1.00 120.51 123.33 2b76 n ALA 193 Ca -0.06 0.79 -0.03 0.00 0.00 0.00 0.00 53.44 54.14 2b76 n ALA 193 Cb 0.17 -0.85 -0.01 0.00 0.00 0.00 0.00 19.45 18.75 2b76 n ALA 193 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2b76 h GLN 194 N 0.00 -0.19 -0.75 0.00 1.08 -1.89 -3.33 115.11 110.03 2b76 h GLN 194 Ca 0.71 0.01 0.25 0.00 -1.45 0.00 0.00 58.65 58.17 2b76 h GLN 194 Cb 2.02 0.04 -0.14 0.00 -0.05 0.00 0.00 27.48 29.35 2b76 h GLN 194 CO -0.54 -0.12 0.18 1.28 -0.95 0.00 0.00 178.83 178.67 2b76 n LEU 195 N -3.11 0.06 0.01 1.46 4.77 -0.63 -0.37 117.00 119.19 2b76 n LEU 195 Ca -0.02 1.27 0.11 0.00 -0.03 0.00 0.00 56.01 57.33 2b76 n LEU 195 Cb 0.08 -0.53 0.47 0.00 -2.33 0.00 0.00 43.42 41.12 2b76 n LEU 195 CO 0.06 -1.34 0.85 0.59 -1.33 0.00 0.00 177.39 176.23 2b76 n ASN 196 N -4.90 0.05 -3.79 -1.43 3.02 -0.17 -0.52 115.26 107.52 2b76 n ASN 196 Ca 0.22 0.51 -0.30 0.00 -0.03 0.00 0.00 54.58 54.98 2b76 n ASN 196 Cb 0.74 -0.52 0.24 0.00 -0.61 0.00 0.00 39.78 39.63 2b76 n ASN 196 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2b76 s SER 197 N -3.09 1.14 0.11 6.41 1.04 0.50 -4.90 113.70 114.91 2b76 s SER 197 Ca 0.11 0.52 -0.03 0.00 0.48 0.00 0.00 55.95 57.03 2b76 s SER 197 Cb 0.14 -0.70 -0.15 0.00 0.10 0.00 0.00 66.02 65.42 2b76 s SER 197 CO 0.41 -3.98 1.25 1.56 0.98 0.00 0.00 173.24 173.47 2b76 h GLN 198 N -2.49 0.33 -0.79 4.02 4.20 -1.90 -2.83 115.11 115.66 2b76 h GLN 198 Ca -0.44 -0.42 0.00 0.00 0.06 0.00 0.00 58.65 57.85 2b76 h GLN 198 Cb 1.28 0.13 0.00 0.00 0.30 0.00 0.00 27.48 29.19 2b76 h GLN 198 CO 0.33 1.13 0.00 0.09 -0.67 0.00 0.00 178.83 179.70 2b76 n ASN 199 N -3.66 2.79 -0.43 1.46 3.02 -1.26 -2.92 115.26 114.26 2b76 n ASN 199 Ca -0.07 -2.34 0.00 0.00 -0.03 0.00 0.00 54.58 52.14 2b76 n ASN 199 Cb 0.90 -0.54 0.00 0.00 -0.61 0.00 0.00 39.78 39.53 2b76 n ASN 199 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b76 n GLY 200 N 0.31 1.67 0.31 7.41 0.00 -1.07 -1.46 105.19 112.36 2b76 n GLY 200 Ca 0.11 -1.74 0.14 0.00 0.00 0.00 0.00 46.02 44.53 2b76 n GLY 200 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2b76 h VAL 201 N 0.00 0.70 0.00 1.61 -1.51 -1.00 -3.02 116.25 113.02 2b76 h VAL 201 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 2b76 h VAL 201 Cb 0.00 0.92 0.00 0.00 -2.13 0.00 0.00 31.29 30.08 2b76 h VAL 201 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 177.57 177.13 2b76 n TRP 202 N -4.13 0.00 -0.28 5.19 7.02 -1.26 -2.16 117.44 121.82 2b76 n TRP 202 Ca -0.00 0.00 0.09 0.00 -1.02 0.00 0.00 57.50 56.57 2b76 n TRP 202 Cb 0.22 -0.04 0.26 0.00 -2.42 0.00 0.00 31.31 29.32 2b76 n TRP 202 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2b76 n SER 203 N -0.16 3.55 -4.54 -0.99 2.88 -1.14 -4.94 113.62 108.28 2b76 n SER 203 Ca 0.00 -2.00 -0.39 0.00 -1.33 0.00 0.00 58.87 55.16 2b76 n SER 203 Cb 0.11 -0.39 -0.11 0.00 -0.75 0.00 0.00 64.21 63.07 2b76 n SER 203 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2b76 n THR 205 N 5.06 1.09 -3.52 0.00 -2.24 -1.26 -4.93 114.28 108.48 2b76 n THR 205 Ca -0.14 -0.86 -0.22 0.00 -2.27 0.00 0.00 64.05 60.57 2b76 n THR 205 Cb 0.51 0.24 0.08 0.00 -2.10 0.00 0.00 70.33 69.06 2b76 n THR 205 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2b76 n PHE 206 N 1.08 -2.65 -0.15 4.78 -0.00 -1.26 -4.91 117.46 114.35 2b76 n PHE 206 Ca 0.20 0.97 -0.04 0.00 -0.00 0.00 0.00 57.45 58.58 2b76 n PHE 206 Cb 0.61 -4.95 0.05 0.00 -0.00 0.00 0.00 39.48 35.19 2b76 n PHE 206 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 2b76 h VAL 207 N -2.45 0.91 0.00 -2.13 2.07 -2.00 -3.46 116.25 109.19 2b76 h VAL 207 Ca -0.56 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 66.82 2b76 h VAL 207 Cb 1.35 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 2b76 h VAL 207 CO 0.53 0.07 0.00 0.61 0.02 0.00 0.00 177.57 178.80 2b76 n GLY 208 N -1.25 0.70 0.33 2.17 0.00 -1.26 -4.95 105.19 100.92 2b76 n GLY 208 Ca 0.04 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.27 2b76 n GLY 208 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2b76 h TYR 209 N 0.00 0.00 -0.06 1.61 3.20 -1.89 -2.66 116.97 117.17 2b76 h TYR 209 Ca 0.00 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.83 2b76 h TYR 209 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 2b76 h TYR 209 CO 0.00 0.00 -0.12 0.00 -1.64 0.00 0.00 178.16 176.40 2b76 h SER 211 N -0.32 0.00 1.37 0.00 0.02 -1.86 -2.05 113.55 110.71 2b76 h SER 211 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2b76 h SER 211 Cb 0.71 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.25 2b76 h SER 211 CO 0.03 0.06 -0.02 -0.33 -1.14 0.00 0.00 176.83 175.43 2b76 h GLU 212 N 0.00 0.00 -0.00 3.45 4.39 -1.27 -3.33 114.58 117.81 2b76 h GLU 212 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2b76 h GLU 212 Cb 0.19 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 2b76 h GLU 212 CO 0.01 0.02 -0.21 1.33 -1.16 0.00 0.00 179.01 179.00 2b76 n VAL 213 N -3.11 0.00 -1.67 3.13 0.24 -0.79 -5.01 118.33 111.12 2b76 n VAL 213 Ca 0.02 -0.40 -0.46 0.00 -2.04 0.00 0.00 64.34 61.46 2b76 n VAL 213 Cb 0.40 1.07 -0.04 0.00 -1.47 0.00 0.00 33.84 33.80 2b76 n VAL 213 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2b76 n PRO 215 N 7.04 0.10 -0.68 0.00 -0.04 -1.26 -3.30 135.00 136.86 2b76 n PRO 215 Ca 0.22 0.24 0.01 0.00 -0.04 0.00 0.00 63.50 63.93 2b76 n PRO 215 Cb 0.34 -1.66 0.20 0.00 -0.04 0.00 0.00 33.50 32.35 2b76 n PRO 215 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2b76 n LYS 216 N -1.83 1.73 -3.97 0.54 4.76 -1.26 -5.01 118.16 113.11 2b76 n LYS 216 Ca 0.04 -3.22 -0.37 0.00 -2.87 0.00 0.00 58.31 51.89 2b76 n LYS 216 Cb 0.26 -1.72 0.01 0.00 -1.84 0.00 0.00 35.03 31.75 2b76 n LYS 216 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 2b76 n HIS 217 N -1.12 -1.22 -0.08 2.13 8.25 -1.21 -4.88 115.22 117.09 2b76 n HIS 217 Ca 0.26 0.13 -0.11 0.00 -0.26 0.00 0.00 57.72 57.75 2b76 n HIS 217 Cb 0.86 -2.29 -0.15 0.00 1.12 0.00 0.00 29.99 29.53 2b76 n HIS 217 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2b76 n VAL 218 N -4.11 1.46 -2.91 1.59 0.31 -1.26 -5.00 118.33 108.41 2b76 n VAL 218 Ca -0.12 -0.82 -0.01 0.00 -0.01 0.00 0.00 64.34 63.39 2b76 n VAL 218 Cb 0.48 -0.69 0.00 0.00 -0.91 0.00 0.00 33.84 32.72 2b76 n VAL 218 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2b76 n ASP 219 N -2.87 -7.32 -0.27 4.52 2.03 -1.26 -4.69 116.55 106.69 2b76 n ASP 219 Ca -0.30 -0.02 0.03 0.00 0.52 0.00 0.00 54.79 55.02 2b76 n ASP 219 Cb 1.12 -4.95 0.25 0.00 -0.72 0.00 0.00 41.12 36.82 2b76 n ASP 219 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2b76 h PRO 220 N 0.54 0.97 0.00 -0.67 0.13 -1.88 -2.34 132.00 128.74 2b76 h PRO 220 Ca 0.00 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 65.05 2b76 h PRO 220 Cb 0.99 -0.22 -0.00 0.00 0.13 0.00 0.00 31.00 31.90 2b76 h PRO 220 CO 0.27 0.64 -0.09 0.00 -0.23 0.00 0.00 178.00 178.58 2b76 h ALA 221 N 1.52 1.08 -0.00 -0.56 0.00 -1.92 -0.42 119.26 118.96 2b76 h ALA 221 Ca 0.35 -0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.99 2b76 h ALA 221 Cb 0.11 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2b76 h ALA 221 CO -0.11 0.11 -0.83 0.00 0.00 0.00 0.00 179.25 178.42 2b76 h ALA 222 N 1.91 0.61 -0.44 0.00 0.00 -1.76 -3.03 119.26 116.55 2b76 h ALA 222 Ca -0.00 -0.72 -0.10 0.00 0.00 0.00 0.00 54.91 54.09 2b76 h ALA 222 Cb 0.46 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2b76 h ALA 222 CO 0.01 0.94 -0.13 0.00 0.00 0.00 0.00 179.25 180.07 2b76 h ALA 223 N 1.08 0.95 -0.10 0.00 0.00 -1.09 -2.60 119.26 117.50 2b76 h ALA 223 Ca -0.03 -0.33 -0.19 0.00 0.00 0.00 0.00 54.91 54.37 2b76 h ALA 223 Cb 1.44 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 2b76 h ALA 223 CO 0.12 0.61 -0.72 0.82 0.00 0.00 0.00 179.25 180.09 2b76 h ILE 224 N 0.72 1.35 -0.25 0.00 2.04 -1.29 -1.17 117.51 118.91 2b76 h ILE 224 Ca 0.12 -2.07 -0.02 0.00 1.00 0.00 0.00 64.86 63.89 2b76 h ILE 224 Cb 0.62 2.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.74 2b76 h ILE 224 CO 0.04 0.63 0.06 -0.61 0.00 0.00 0.00 178.15 178.28 2b76 h GLN 225 N 0.34 0.40 -0.89 2.37 5.75 -1.46 0.88 115.11 122.51 2b76 h GLN 225 Ca -0.03 -0.10 0.09 0.00 -0.15 0.00 0.00 58.65 58.46 2b76 h GLN 225 Cb 1.30 -0.05 -0.06 0.00 1.07 0.00 0.00 27.48 29.73 2b76 h GLN 225 CO 0.13 0.50 0.58 1.96 -2.65 0.00 0.00 178.83 179.34 2b76 h GLN 226 N 0.23 0.90 0.07 1.69 4.20 -1.34 -0.08 115.11 120.79 2b76 h GLN 226 Ca 0.08 -0.05 0.01 0.00 0.06 0.00 0.00 58.65 58.74 2b76 h GLN 226 Cb 0.27 -0.20 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 2b76 h GLN 226 CO 0.00 0.60 -0.29 0.78 -0.67 0.00 0.00 178.83 179.25 2b76 h GLY 227 N 0.93 -1.19 -0.77 3.46 0.00 0.28 -1.33 103.07 104.45 2b76 h GLY 227 Ca 0.40 0.59 0.11 0.00 0.00 0.00 0.00 47.33 48.44 2b76 h GLY 227 CO -0.17 -0.36 -0.44 0.50 0.00 0.00 0.00 176.54 176.08 2b76 h LYS 228 N -0.42 -0.09 -0.35 4.80 1.57 0.61 1.47 116.57 124.17 2b76 h LYS 228 Ca -0.00 0.01 0.10 0.00 -1.87 0.00 0.00 60.65 58.88 2b76 h LYS 228 Cb 0.42 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 2b76 h LYS 228 CO -0.16 -0.06 0.35 0.28 -0.57 0.00 0.00 179.45 179.29 2b76 h VAL 229 N -0.09 0.47 0.13 0.50 2.07 -0.62 -0.87 116.25 117.84 2b76 h VAL 229 Ca 0.24 0.00 -0.35 0.00 0.82 0.00 0.00 66.70 67.42 2b76 h VAL 229 Cb 0.55 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 2b76 h VAL 229 CO -0.85 0.00 -1.85 -0.08 0.02 0.00 0.00 177.57 174.81 2b76 h GLU 230 N 0.00 0.27 0.32 1.57 4.57 0.30 -2.59 114.58 119.02 2b76 h GLU 230 Ca 0.17 -0.45 0.00 0.00 -1.18 0.00 0.00 59.36 57.89 2b76 h GLU 230 Cb 0.86 0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 29.58 2b76 h GLU 230 CO -0.00 1.15 -0.48 1.03 -1.18 0.00 0.00 179.01 179.52 2b76 h SER 231 N 0.07 -1.37 -0.85 1.04 0.87 0.27 -0.45 113.55 113.13 2b76 h SER 231 Ca -0.37 0.13 0.18 0.00 -1.23 0.00 0.00 61.79 60.50 2b76 h SER 231 Cb 2.05 0.48 -0.06 0.00 -0.44 0.00 0.00 62.40 64.43 2b76 h SER 231 CO 0.12 -0.59 0.56 0.28 -0.53 0.00 0.00 176.83 176.67 2b76 h SER 232 N -0.85 0.43 0.31 6.23 0.02 -1.31 0.62 113.55 119.00 2b76 h SER 232 Ca -0.03 0.04 -0.15 0.00 -0.84 0.00 0.00 61.79 60.81 2b76 h SER 232 Cb 0.79 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.28 2b76 h SER 232 CO -0.16 0.19 -0.61 0.50 -1.14 0.00 0.00 176.83 175.62 2b76 h LYS 233 N 0.44 0.30 -0.33 3.45 3.64 -0.99 -2.92 116.57 120.16 2b76 h LYS 233 Ca 0.43 -0.21 -0.05 0.00 -1.27 0.00 0.00 60.65 59.55 2b76 h LYS 233 Cb 1.02 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 2b76 h LYS 233 CO -0.16 0.82 -0.01 0.22 -2.27 0.00 0.00 179.45 178.05 2b76 h ASP 234 N 0.22 0.57 -0.85 4.20 -0.00 0.18 -2.39 116.42 118.36 2b76 h ASP 234 Ca -0.01 -0.31 0.02 0.00 -0.00 0.00 0.00 57.03 56.73 2b76 h ASP 234 Cb 1.13 -0.15 -0.05 0.00 -0.00 0.00 0.00 39.33 40.26 2b76 h ASP 234 CO 0.10 0.75 0.56 0.15 -0.00 0.00 0.00 179.24 180.80 2b76 h PHE 235 N 0.38 1.05 0.56 0.28 3.57 -1.01 -2.30 116.94 119.47 2b76 h PHE 235 Ca 0.09 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.59 2b76 h PHE 235 Cb 0.46 -0.35 0.01 0.00 2.79 0.00 0.00 35.95 38.85 2b76 h PHE 235 CO 0.04 0.63 -0.27 1.25 -2.23 0.00 0.00 178.31 177.73 2b76 h LEU 236 N 1.11 -0.64 -1.74 0.59 6.46 -1.30 -1.68 115.31 118.11 2b76 h LEU 236 Ca 0.33 -0.03 0.32 0.00 -0.12 0.00 0.00 57.88 58.38 2b76 h LEU 236 Cb -0.05 0.16 -0.07 0.00 -0.73 0.00 0.00 40.66 39.98 2b76 h LEU 236 CO -0.08 -0.25 0.79 0.40 -0.62 0.00 0.00 178.44 178.68 2b76 h ILE 237 N -1.12 0.43 -0.01 4.05 1.08 -1.36 0.93 117.51 121.51 2b76 h ILE 237 Ca -0.08 -0.05 0.00 0.00 -0.39 0.00 0.00 64.86 64.34 2b76 h ILE 237 Cb 0.63 0.27 0.00 0.00 -3.07 0.00 0.00 36.82 34.65 2b76 h ILE 237 CO 0.13 0.03 -0.14 0.00 -0.69 0.00 0.00 178.15 177.48 2b76 n ALA 238 N -2.65 2.82 0.29 1.87 0.00 -0.87 -1.12 120.51 120.85 2b76 n ALA 238 Ca 0.26 -0.31 0.11 0.00 0.00 0.00 0.00 53.44 53.51 2b76 n ALA 238 Cb 1.14 -1.28 -0.02 0.00 0.00 0.00 0.00 19.45 19.29 2b76 n ALA 238 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2b76 n THR 239 N -0.81 0.30 0.87 0.00 -1.04 0.32 -3.07 114.28 110.85 2b76 n THR 239 Ca 0.14 -0.40 0.12 0.00 -2.04 0.00 0.00 64.05 61.87 2b76 n THR 239 Cb 0.30 -0.03 0.17 0.00 -1.82 0.00 0.00 70.33 68.95 2b76 n THR 239 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2b76 n LEU 240 N -2.27 2.95 -0.09 -4.42 7.99 -0.82 -4.59 117.00 115.76 2b76 n LEU 240 Ca 0.00 -1.07 -0.19 0.00 -0.01 0.00 0.00 56.01 54.73 2b76 n LEU 240 Cb 0.50 -0.07 -0.12 0.00 -0.11 0.00 0.00 43.42 43.62 2b76 n LEU 240 CO 0.41 0.54 -0.23 0.50 -1.51 0.00 0.00 177.39 177.10 2b76 h LYS 241 N 4.38 0.01 0.00 3.23 3.64 -1.05 -3.42 116.57 123.37 2b76 h LYS 241 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2b76 h LYS 241 Cb 0.94 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 2b76 h LYS 241 CO 0.00 1.01 0.00 -2.30 -2.27 0.00 0.00 179.45 175.89 2b76 n PRO 242 N -4.47 0.00 0.00 1.90 -0.02 -1.25 -5.05 135.00 126.12 2b76 n PRO 242 Ca -0.25 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.23 2b76 n PRO 242 Cb 0.63 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.11 2b76 n PRO 242 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02