#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bbs s THR 1 N 0.00 0.24 -0.03 12.58 2.01 -1.26 -0.13 115.64 129.04 1bbs s THR 1 Ca 0.00 0.06 0.05 0.00 0.31 0.00 0.00 61.69 62.11 1bbs s THR 1 Cb 0.00 -0.33 -0.01 0.00 0.01 0.00 0.00 72.50 72.18 1bbs s THR 1 CO 0.00 0.16 -0.16 -0.44 -0.69 0.00 0.00 174.62 173.49 1bbs s SER 2 N 1.07 2.00 0.06 3.53 0.01 -0.29 -4.96 113.70 115.12 1bbs s SER 2 Ca -0.09 -0.32 0.08 0.00 1.31 0.00 0.00 55.95 56.94 1bbs s SER 2 Cb -0.14 -0.40 -0.03 0.00 0.21 0.00 0.00 66.02 65.67 1bbs s SER 2 CO -0.02 0.17 -0.23 -0.94 0.41 0.00 0.00 173.24 172.63 1bbs s SER 3 N -0.15 2.82 -0.20 2.44 1.04 -1.26 0.71 113.70 119.10 1bbs s SER 3 Ca 0.01 -0.59 -0.03 0.00 0.48 0.00 0.00 55.95 55.83 1bbs s SER 3 Cb -0.09 -0.23 -0.01 0.00 0.10 0.00 0.00 66.02 65.79 1bbs s SER 3 CO 0.01 0.19 -0.07 -0.69 0.98 0.00 0.00 173.24 173.65 1bbs s VAL 4 N -0.86 3.24 0.04 5.02 1.01 0.91 -4.79 120.40 124.96 1bbs s VAL 4 Ca 0.10 -0.55 -0.27 0.00 0.00 0.00 0.00 61.98 61.26 1bbs s VAL 4 Cb -0.09 -2.45 -0.05 0.00 0.00 0.00 0.00 36.38 33.79 1bbs s VAL 4 CO 0.03 0.46 0.85 -0.63 0.00 0.00 0.00 175.10 175.80 1bbs s ILE 5 N 1.19 4.74 0.30 2.22 1.01 -1.26 -1.39 121.20 128.00 1bbs s ILE 5 Ca 0.02 1.81 0.07 0.00 0.00 0.00 0.00 60.65 62.55 1bbs s ILE 5 Cb -0.14 -4.20 -0.03 0.00 0.01 0.00 0.00 42.46 38.10 1bbs s ILE 5 CO -0.02 0.30 0.30 -0.76 0.00 0.00 0.00 174.94 174.76 1bbs s LEU 6 N 0.29 3.83 -0.11 2.97 1.43 -0.38 -4.46 118.68 122.26 1bbs s LEU 6 Ca 0.43 -0.28 -0.01 0.00 -1.03 0.00 0.00 54.13 53.23 1bbs s LEU 6 Cb -0.21 -2.44 -0.03 0.00 0.03 0.00 0.00 46.19 43.54 1bbs s LEU 6 CO 0.25 -0.23 -0.06 -0.89 0.23 0.00 0.00 176.35 175.66 1bbs s THR 7 N -2.18 3.76 -0.24 5.49 2.01 -0.72 -2.66 115.64 121.10 1bbs s THR 7 Ca 0.38 -0.43 -0.06 0.00 0.31 0.00 0.00 61.69 61.89 1bbs s THR 7 Cb -0.08 -2.59 -0.02 0.00 0.01 0.00 0.00 72.50 69.82 1bbs s THR 7 CO 0.27 0.55 0.03 0.21 -0.69 0.00 0.00 174.62 174.98 1bbs s ASN 8 N -0.21 4.80 -0.48 3.53 3.04 -1.26 -2.22 114.94 122.14 1bbs s ASN 8 Ca 0.03 -0.30 -0.04 0.00 0.04 0.00 0.00 52.86 52.59 1bbs s ASN 8 Cb -0.13 -1.85 0.13 0.00 -1.54 0.00 0.00 41.25 37.86 1bbs s ASN 8 CO 0.03 -0.03 0.30 -0.47 -3.04 0.00 0.00 177.10 173.88 1bbs s TYR 9 N 1.56 3.52 -1.55 0.43 5.04 0.21 -4.73 117.35 121.83 1bbs s TYR 9 Ca 0.06 -2.36 -0.13 0.00 -2.44 0.00 0.00 57.07 52.20 1bbs s TYR 9 Cb -0.15 -3.29 0.09 0.00 0.35 0.00 0.00 41.96 38.96 1bbs s TYR 9 CO 0.01 -0.95 0.84 0.00 -1.34 0.00 0.00 175.55 174.11 1bbs n MET 10 N 4.40 -4.56 -1.45 4.97 0.00 -1.26 -2.06 117.12 117.15 1bbs n MET 10 Ca -0.01 0.51 -0.14 0.00 0.00 0.00 0.00 57.70 58.06 1bbs n MET 10 Cb 0.41 -5.25 -0.06 0.00 0.00 0.00 0.00 33.22 28.32 1bbs n MET 10 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1bbs n ASP 11 N -2.82 -3.76 0.00 3.17 9.92 -1.26 -4.68 116.55 117.12 1bbs n ASP 11 Ca -0.02 0.34 0.00 0.00 -0.53 0.00 0.00 54.79 54.59 1bbs n ASP 11 Cb 0.55 -3.47 0.00 0.00 -0.64 0.00 0.00 41.12 37.56 1bbs n ASP 11 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 1bbs n THR 12 N -2.00 0.00 -3.63 -3.53 -2.24 -0.88 -4.90 114.28 97.10 1bbs n THR 12 Ca -0.14 -0.21 -0.20 0.00 -2.27 0.00 0.00 64.05 61.23 1bbs n THR 12 Cb 0.47 1.11 -0.16 0.00 -2.10 0.00 0.00 70.33 69.66 1bbs n THR 12 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1bbs s GLN 13 N -0.34 0.04 -0.29 -0.78 -0.21 -1.18 -4.48 119.66 112.42 1bbs s GLN 13 Ca 0.00 0.34 0.02 0.00 0.02 0.00 0.00 55.36 55.74 1bbs s GLN 13 Cb 0.00 -0.77 0.07 0.00 1.00 0.00 0.00 33.01 33.31 1bbs s GLN 13 CO 0.00 -0.43 -0.05 0.71 -2.12 0.00 0.00 175.29 173.40 1bbs s TYR 14 N 2.24 3.36 0.02 0.91 1.51 -1.25 -0.62 117.35 123.51 1bbs s TYR 14 Ca 0.04 -2.34 0.04 0.00 -1.01 0.00 0.00 57.07 53.81 1bbs s TYR 14 Cb -0.13 -2.17 -0.02 0.00 -0.11 0.00 0.00 41.96 39.53 1bbs s TYR 14 CO -0.07 -0.88 -0.13 1.52 -1.11 0.00 0.00 175.55 174.88 1bbs s TYR 15 N 1.11 1.15 0.00 2.71 -0.85 -0.94 -4.45 117.35 116.08 1bbs s TYR 15 Ca -0.05 -0.31 0.00 0.00 -0.52 0.00 0.00 57.07 56.20 1bbs s TYR 15 Cb -0.20 -0.70 0.00 0.00 0.38 0.00 0.00 41.96 41.44 1bbs s TYR 15 CO -0.05 0.01 0.00 0.41 -1.52 0.00 0.00 175.55 174.41 1bbs n GLY 16 N 2.17 4.44 3.01 5.49 0.00 0.16 -1.75 105.19 118.71 1bbs n GLY 16 Ca -0.17 -2.09 -0.23 0.00 0.00 0.00 0.00 46.02 43.54 1bbs n GLY 16 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bbs s GLU 17 N 0.39 1.31 0.21 1.61 2.12 -1.26 -0.71 118.70 122.38 1bbs s GLU 17 Ca 0.00 -0.36 0.09 0.00 0.36 0.00 0.00 54.97 55.06 1bbs s GLU 17 Cb 0.00 -1.16 -0.05 0.00 0.26 0.00 0.00 34.13 33.19 1bbs s GLU 17 CO 0.00 0.08 -0.16 0.96 -0.54 0.00 0.00 175.26 175.60 1bbs s ILE 18 N 0.42 1.90 -0.06 -3.70 -4.36 -0.56 -4.56 121.20 110.28 1bbs s ILE 18 Ca -0.08 -2.21 0.06 0.00 -0.26 0.00 0.00 60.65 58.16 1bbs s ILE 18 Cb -0.12 -2.07 -0.01 0.00 1.25 0.00 0.00 42.46 41.51 1bbs s ILE 18 CO 0.02 -0.51 -0.24 -0.83 0.24 0.00 0.00 174.94 173.62 1bbs s GLY 19 N -3.25 1.33 -0.13 6.27 0.00 -0.82 -1.63 107.32 109.09 1bbs s GLY 19 Ca 0.23 -1.04 0.01 0.00 0.00 0.00 0.00 44.72 43.92 1bbs s GLY 19 CO 0.08 -0.65 -0.17 -0.42 0.00 0.00 0.00 173.10 171.95 1bbs s ILE 20 N -0.20 2.68 0.00 0.90 1.01 -0.21 -0.06 121.20 125.32 1bbs s ILE 20 Ca -0.02 -0.79 0.00 0.00 0.00 0.00 0.00 60.65 59.84 1bbs s ILE 20 Cb -0.13 -2.10 0.00 0.00 0.01 0.00 0.00 42.46 40.23 1bbs s ILE 20 CO 0.03 0.53 0.00 0.61 0.00 0.00 0.00 174.94 176.12 1bbs n GLY 21 N 3.65 -1.74 2.98 6.18 0.00 -0.85 0.42 105.19 115.84 1bbs n GLY 21 Ca -0.19 -2.10 -0.05 0.00 0.00 0.00 0.00 46.02 43.68 1bbs n GLY 21 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bbs s THR 22 N -0.12 -0.71 0.82 2.61 2.01 -1.26 -2.72 115.64 116.25 1bbs s THR 22 Ca 0.00 -0.05 -0.12 0.00 0.31 0.00 0.00 61.69 61.83 1bbs s THR 22 Cb 0.00 -0.87 0.09 0.00 0.01 0.00 0.00 72.50 71.73 1bbs s THR 22 CO 0.00 -0.09 1.14 -2.16 -0.69 0.00 0.00 174.62 172.82 1bbs s PRO 23 N 2.63 1.74 0.33 4.92 0.05 -1.26 -1.06 135.00 142.35 1bbs s PRO 23 Ca 0.15 1.48 -0.29 0.00 0.05 0.00 0.00 61.00 62.39 1bbs s PRO 23 Cb -0.15 -1.81 -0.11 0.00 0.05 0.00 0.00 34.50 32.47 1bbs s PRO 23 CO -0.17 -2.08 1.48 -1.25 0.05 0.00 0.00 177.00 175.02 1bbs s PRO 24 N -4.52 4.17 -0.32 0.56 0.04 -1.10 -4.83 135.00 129.00 1bbs s PRO 24 Ca 0.67 2.48 -0.08 0.00 0.04 0.00 0.00 61.00 64.11 1bbs s PRO 24 Cb -0.22 -3.02 0.02 0.00 0.04 0.00 0.00 34.50 31.32 1bbs s PRO 24 CO 0.53 -0.49 0.11 -0.65 0.04 0.00 0.00 177.00 176.55 1bbs s GLN 25 N -1.40 2.93 0.13 4.56 -0.21 0.17 -4.83 119.66 121.01 1bbs s GLN 25 Ca 0.56 -0.97 -0.30 0.00 0.02 0.00 0.00 55.36 54.66 1bbs s GLN 25 Cb -0.45 -3.47 -0.07 0.00 1.00 0.00 0.00 33.01 30.02 1bbs s GLN 25 CO 0.55 -0.55 1.17 0.99 -2.12 0.00 0.00 175.29 175.34 1bbs s THR 26 N 1.49 3.84 0.01 -0.19 2.01 -1.26 -1.04 115.64 120.50 1bbs s THR 26 Ca 0.01 1.45 0.01 0.00 0.31 0.00 0.00 61.69 63.47 1bbs s THR 26 Cb -0.18 -3.93 -0.01 0.00 0.01 0.00 0.00 72.50 68.39 1bbs s THR 26 CO 0.04 0.19 -0.04 -0.36 -0.69 0.00 0.00 174.62 173.75 1bbs s PHE 27 N 0.37 0.33 -0.16 4.92 0.08 -0.65 -4.99 117.98 117.89 1bbs s PHE 27 Ca 0.54 -0.23 -0.22 0.00 0.12 0.00 0.00 56.93 57.14 1bbs s PHE 27 Cb -0.30 -0.21 -0.03 0.00 -0.57 0.00 0.00 43.02 41.91 1bbs s PHE 27 CO 0.33 -0.06 0.66 0.15 -0.10 0.00 0.00 175.22 176.20 1bbs s LYS 28 N -0.65 4.28 0.16 0.44 1.02 -1.26 -1.50 119.74 122.22 1bbs s LYS 28 Ca -0.05 0.70 -0.00 0.00 0.02 0.00 0.00 55.97 56.64 1bbs s LYS 28 Cb -0.05 -3.54 -0.04 0.00 -0.52 0.00 0.00 37.83 33.68 1bbs s LYS 28 CO -0.00 -0.16 0.06 0.14 -0.92 0.00 0.00 175.35 174.47 1bbs s VAL 29 N 1.63 0.20 -0.21 3.17 -7.23 0.12 0.07 120.40 118.15 1bbs s VAL 29 Ca 0.31 -1.94 -0.07 0.00 -1.81 0.00 0.00 61.98 58.47 1bbs s VAL 29 Cb -0.16 -2.19 -0.04 0.00 0.56 0.00 0.00 36.38 34.56 1bbs s VAL 29 CO 0.12 -0.34 0.06 -0.69 -0.31 0.00 0.00 175.10 173.94 1bbs s VAL 30 N -3.99 4.54 -0.53 1.32 1.01 -1.14 0.38 120.40 122.00 1bbs s VAL 30 Ca 0.28 -0.11 -0.18 0.00 0.00 0.00 0.00 61.98 61.96 1bbs s VAL 30 Cb 0.07 -3.07 0.08 0.00 0.00 0.00 0.00 36.38 33.46 1bbs s VAL 30 CO 0.05 0.41 0.62 -0.36 0.00 0.00 0.00 175.10 175.82 1bbs s PHE 31 N 0.89 3.06 -0.76 5.22 0.40 -1.26 -1.70 117.98 123.83 1bbs s PHE 31 Ca 0.03 -0.76 -0.24 0.00 -0.60 0.00 0.00 56.93 55.37 1bbs s PHE 31 Cb -0.14 -3.66 0.06 0.00 0.51 0.00 0.00 43.02 39.79 1bbs s PHE 31 CO 0.03 -1.09 1.17 0.34 0.70 0.00 0.00 175.22 176.36 1bbs s ASP 32 N 3.03 6.24 0.00 1.36 2.15 -0.92 -4.42 116.67 124.12 1bbs s ASP 32 Ca 0.12 -0.91 0.07 0.00 0.43 0.00 0.00 52.55 52.26 1bbs s ASP 32 Cb -0.22 -2.49 0.38 0.00 -0.30 0.00 0.00 42.92 40.29 1bbs s ASP 32 CO 0.09 -1.58 1.25 0.35 -0.17 0.00 0.00 175.17 175.11 1bbs n THR 33 N 6.19 0.05 0.20 1.71 -2.24 -1.26 -0.37 114.28 118.57 1bbs n THR 33 Ca 0.06 -0.06 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 1bbs n THR 33 Cb 0.48 -0.05 -0.14 0.00 -2.10 0.00 0.00 70.33 68.52 1bbs n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bbs n GLY 34 N 0.66 -1.05 0.12 3.38 0.00 -1.26 -4.49 105.19 102.55 1bbs n GLY 34 Ca 0.06 -0.51 -0.01 0.00 0.00 0.00 0.00 46.02 45.56 1bbs n GLY 34 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1bbs n SER 35 N -2.14 1.72 0.00 1.61 3.41 -1.21 -4.98 113.62 112.03 1bbs n SER 35 Ca -0.02 -1.08 0.00 0.00 -0.26 0.00 0.00 58.87 57.51 1bbs n SER 35 Cb 0.52 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 1bbs n SER 35 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1bbs n SER 36 N -1.32 0.00 -4.96 4.04 7.64 -1.26 -1.59 113.62 116.17 1bbs n SER 36 Ca -0.01 -0.82 -0.22 0.00 1.01 0.00 0.00 58.87 58.84 1bbs n SER 36 Cb 0.02 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.22 1bbs n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1bbs s ASN 37 N 0.00 6.11 -0.14 6.43 -0.87 -1.26 -4.44 114.94 120.76 1bbs s ASN 37 Ca 0.00 0.18 0.01 0.00 -1.57 0.00 0.00 52.86 51.48 1bbs s ASN 37 Cb 0.00 -1.68 -0.00 0.00 -0.02 0.00 0.00 41.25 39.55 1bbs s ASN 37 CO 0.00 -0.39 -0.17 -0.69 -2.57 0.00 0.00 177.10 173.28 1bbs s VAL 38 N -2.28 2.54 0.05 1.60 1.01 -1.26 -0.52 120.40 121.55 1bbs s VAL 38 Ca 0.42 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.55 1bbs s VAL 38 Cb -0.10 -2.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.20 1bbs s VAL 38 CO 0.34 0.53 0.04 -1.66 0.00 0.00 0.00 175.10 174.35 1bbs s TRP 39 N 0.73 0.36 0.02 5.22 1.48 0.13 -1.11 118.94 125.77 1bbs s TRP 39 Ca -0.07 -0.81 -0.09 0.00 -1.06 0.00 0.00 56.10 54.07 1bbs s TRP 39 Cb -0.16 -0.26 0.00 0.00 -1.16 0.00 0.00 33.47 31.90 1bbs s TRP 39 CO 0.01 -0.40 0.17 0.14 -4.06 0.00 0.00 176.95 172.81 1bbs s VAL 40 N -3.46 0.10 0.84 -0.66 -7.23 -1.19 -1.41 120.40 107.38 1bbs s VAL 40 Ca 0.02 -0.82 -0.11 0.00 -1.81 0.00 0.00 61.98 59.27 1bbs s VAL 40 Cb 0.04 -0.72 0.09 0.00 0.56 0.00 0.00 36.38 36.35 1bbs s VAL 40 CO -0.08 -0.45 1.10 -2.84 -0.31 0.00 0.00 175.10 172.51 1bbs s PRO 41 N -2.07 1.73 0.13 4.82 0.01 -1.26 -2.29 135.00 136.07 1bbs s PRO 41 Ca -0.09 1.14 0.08 0.00 0.01 0.00 0.00 61.00 62.14 1bbs s PRO 41 Cb -0.04 -1.84 -0.04 0.00 0.01 0.00 0.00 34.50 32.60 1bbs s PRO 41 CO -0.01 -2.00 -0.18 0.45 0.01 0.00 0.00 177.00 175.27 1bbs s SER 42 N -3.26 2.39 0.44 2.53 0.15 -0.80 -0.67 113.70 114.49 1bbs s SER 42 Ca 0.63 -0.78 0.20 0.00 0.70 0.00 0.00 55.95 56.70 1bbs s SER 42 Cb -0.18 -0.12 1.16 0.00 -1.71 0.00 0.00 66.02 65.17 1bbs s SER 42 CO 0.57 -0.04 1.86 0.77 1.20 0.00 0.00 173.24 177.60 1bbs h SER 43 N 3.64 0.33 0.00 5.45 4.64 -1.83 0.46 113.55 126.24 1bbs h SER 43 Ca -0.43 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1bbs h SER 43 Cb 1.19 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1bbs h SER 43 CO 0.47 0.13 0.00 0.29 -0.87 0.00 0.00 176.83 176.84 1bbs n LYS 44 N -4.47 0.69 -2.76 4.77 5.02 -1.26 -4.68 118.16 115.47 1bbs n LYS 44 Ca 0.19 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 56.06 1bbs n LYS 44 Cb 0.75 -1.10 -0.03 0.00 -0.02 0.00 0.00 35.03 34.63 1bbs n LYS 44 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1bbs n SER 46 N 6.22 3.57 0.00 0.00 2.88 -1.26 -4.87 113.62 120.17 1bbs n SER 46 Ca 0.09 1.03 0.04 0.00 -1.33 0.00 0.00 58.87 58.71 1bbs n SER 46 Cb 0.47 -1.48 0.22 0.00 -0.75 0.00 0.00 64.21 62.67 1bbs n SER 46 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1bbs n ARG 46 N 4.64 0.20 0.15 -1.46 5.12 -1.26 -1.32 116.66 122.74 1bbs n ARG 46 Ca 0.18 0.07 0.02 0.00 -1.93 0.00 0.00 57.85 56.19 1bbs n ARG 46 Cb 0.32 -1.50 0.14 0.00 -1.16 0.00 0.00 32.46 30.26 1bbs n ARG 46 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 1bbs h LEU 46 N 0.00 0.00 -8.35 0.55 3.38 -2.00 -3.38 115.31 105.50 1bbs h LEU 46 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 1bbs h LEU 46 Cb 0.02 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.70 1bbs h LEU 46 CO 0.00 0.52 1.17 -0.31 0.09 0.00 0.00 178.44 179.91 1bbs s TYR 47 N -3.22 2.15 0.64 1.13 2.02 -0.43 -4.83 117.35 114.81 1bbs s TYR 47 Ca 0.02 0.07 0.31 0.00 -0.37 0.00 0.00 57.07 57.10 1bbs s TYR 47 Cb 0.09 -4.49 1.66 0.00 -0.40 0.00 0.00 41.96 38.83 1bbs s TYR 47 CO 0.73 -2.10 1.97 1.15 -1.57 0.00 0.00 175.55 175.73 1bbs h THR 48 N 6.37 0.13 -0.51 -0.71 2.02 -1.86 -1.00 112.91 117.36 1bbs h THR 48 Ca -0.20 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 66.91 1bbs h THR 48 Cb 1.07 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 1bbs h THR 48 CO 1.28 0.00 0.02 0.00 0.37 0.00 0.00 175.52 177.20 1bbs h ALA 49 N 1.46 1.09 0.00 6.16 0.00 -1.88 -2.25 119.26 123.84 1bbs h ALA 49 Ca 0.05 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1bbs h ALA 49 Cb 0.69 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1bbs h ALA 49 CO -0.00 0.58 0.00 0.00 0.00 0.00 0.00 179.25 179.83 1bbs n VAL 51 N -2.23 0.60 0.93 0.00 0.31 -0.88 -4.12 118.33 112.95 1bbs n VAL 51 Ca 0.03 -0.55 0.10 0.00 -0.01 0.00 0.00 64.34 63.91 1bbs n VAL 51 Cb 0.27 -0.33 -0.02 0.00 -0.91 0.00 0.00 33.84 32.86 1bbs n VAL 51 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1bbs n TYR 52 N -2.65 0.00 -4.53 3.52 4.02 -0.87 -4.99 117.16 111.66 1bbs n TYR 52 Ca -0.01 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.63 1bbs n TYR 52 Cb 0.57 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.78 1bbs n TYR 52 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 1bbs s HIS 53 N -2.42 2.35 0.11 -0.72 3.76 -0.95 -5.10 115.29 112.33 1bbs s HIS 53 Ca 0.16 -0.49 -0.30 0.00 -0.15 0.00 0.00 55.06 54.27 1bbs s HIS 53 Cb 0.17 -1.31 -0.06 0.00 1.11 0.00 0.00 32.58 32.48 1bbs s HIS 53 CO 0.57 0.58 1.05 0.21 -0.85 0.00 0.00 174.74 176.30 1bbs s LYS 54 N -3.61 4.60 0.06 1.40 2.20 -1.26 -4.92 119.74 118.22 1bbs s LYS 54 Ca 0.32 1.60 0.03 0.00 -0.36 0.00 0.00 55.97 57.56 1bbs s LYS 54 Cb 0.02 -3.34 -0.04 0.00 -1.51 0.00 0.00 37.83 32.95 1bbs s LYS 54 CO 0.16 0.06 0.04 -0.51 -0.36 0.00 0.00 175.35 174.73 1bbs s LEU 55 N 0.15 3.64 -0.21 5.43 1.43 -1.26 -4.23 118.68 123.63 1bbs s LEU 55 Ca 0.50 -0.06 -0.22 0.00 -1.03 0.00 0.00 54.13 53.32 1bbs s LEU 55 Cb -0.26 -2.29 -0.02 0.00 0.03 0.00 0.00 46.19 43.65 1bbs s LEU 55 CO 0.31 0.20 0.72 0.12 0.23 0.00 0.00 176.35 177.93 1bbs s PHE 56 N -1.30 3.36 -0.34 0.29 2.19 0.16 -4.77 117.98 117.57 1bbs s PHE 56 Ca 0.26 1.03 -0.12 0.00 0.33 0.00 0.00 56.93 58.43 1bbs s PHE 56 Cb -0.12 -2.91 -0.01 0.00 -1.31 0.00 0.00 43.02 38.68 1bbs s PHE 56 CO 0.18 -0.26 0.22 0.34 1.83 0.00 0.00 175.22 177.53 1bbs s ASP 57 N 1.26 5.91 0.03 6.13 -1.08 -1.26 -2.88 116.67 124.78 1bbs s ASP 57 Ca 0.32 -0.50 0.28 0.00 -0.52 0.00 0.00 52.55 52.13 1bbs s ASP 57 Cb -0.16 -2.10 1.16 0.00 -1.46 0.00 0.00 42.92 40.36 1bbs s ASP 57 CO 0.10 -0.24 1.89 0.00 0.52 0.00 0.00 175.17 177.44 1bbs n ALA 58 N 5.07 2.35 0.78 3.66 0.00 -1.26 -2.70 120.51 128.41 1bbs n ALA 58 Ca -0.13 -0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.35 1bbs n ALA 58 Cb 0.49 -1.46 0.51 0.00 0.00 0.00 0.00 19.45 18.99 1bbs n ALA 58 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1bbs n SER 59 N -1.62 0.39 -0.95 0.00 3.41 -1.26 -2.67 113.62 110.91 1bbs n SER 59 Ca 0.07 0.54 0.08 0.00 -0.26 0.00 0.00 58.87 59.30 1bbs n SER 59 Cb 0.35 -0.64 0.23 0.00 -0.26 0.00 0.00 64.21 63.89 1bbs n SER 59 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1bbs n ASP 60 N -1.87 3.43 -4.04 4.04 8.00 -1.10 -4.90 116.55 120.12 1bbs n ASP 60 Ca 0.06 -2.06 -0.27 0.00 0.71 0.00 0.00 54.79 53.23 1bbs n ASP 60 Cb 0.37 -0.35 -0.17 0.00 -0.02 0.00 0.00 41.12 40.95 1bbs n ASP 60 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1bbs s SER 61 N -1.03 2.23 0.00 -2.24 0.15 -1.09 -4.10 113.70 107.63 1bbs s SER 61 Ca 0.35 -0.38 0.26 0.00 0.70 0.00 0.00 55.95 56.88 1bbs s SER 61 Cb 0.19 -1.00 0.91 0.00 -1.71 0.00 0.00 66.02 64.41 1bbs s SER 61 CO 0.22 0.02 1.66 -1.54 1.20 0.00 0.00 173.24 174.80 1bbs n SER 62 N 4.11 1.70 -0.67 5.45 3.41 -0.22 -3.96 113.62 123.44 1bbs n SER 62 Ca -0.20 -1.59 0.09 0.00 -0.26 0.00 0.00 58.87 56.92 1bbs n SER 62 Cb 0.51 -0.02 0.06 0.00 -0.26 0.00 0.00 64.21 64.50 1bbs n SER 62 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1bbs n SER 63 N 0.33 2.37 -4.67 4.04 3.41 -1.26 -4.98 113.62 112.85 1bbs n SER 63 Ca 0.18 -1.68 -0.42 0.00 -0.26 0.00 0.00 58.87 56.68 1bbs n SER 63 Cb 0.38 0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.44 1bbs n SER 63 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1bbs s TYR 64 N -1.76 2.05 -0.05 7.33 6.14 -1.25 -4.57 117.35 125.23 1bbs s TYR 64 Ca 0.20 0.12 0.05 0.00 0.64 0.00 0.00 57.07 58.08 1bbs s TYR 64 Cb 0.16 -4.01 -0.01 0.00 0.42 0.00 0.00 41.96 38.52 1bbs s TYR 64 CO 0.31 -4.22 -0.22 0.15 0.64 0.00 0.00 175.55 172.20 1bbs s LYS 65 N 3.45 2.30 1.05 4.97 1.02 0.13 -4.98 119.74 127.69 1bbs s LYS 65 Ca 0.77 -0.80 -0.15 0.00 0.02 0.00 0.00 55.97 55.80 1bbs s LYS 65 Cb -0.38 -1.95 0.10 0.00 -0.52 0.00 0.00 37.83 35.07 1bbs s LYS 65 CO 0.33 0.33 0.29 1.58 -0.92 0.00 0.00 175.35 176.96 1bbs n HIS 66 N 3.03 -1.33 0.00 3.18 -0.00 -1.26 -1.21 115.22 117.63 1bbs n HIS 66 Ca -0.18 0.16 0.00 0.00 -0.00 0.00 0.00 57.72 57.70 1bbs n HIS 66 Cb 0.52 -1.68 0.00 0.00 -0.00 0.00 0.00 29.99 28.83 1bbs n HIS 66 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.34 174.63 1bbs n ASN 67 N -1.92 0.00 -0.02 0.26 2.85 -1.26 -4.59 115.26 110.57 1bbs n ASN 67 Ca 0.04 0.00 -0.16 0.00 -0.11 0.00 0.00 54.58 54.35 1bbs n ASN 67 Cb 0.58 0.00 -0.14 0.00 1.24 0.00 0.00 39.78 41.46 1bbs n ASN 67 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1bbs n GLY 68 N 0.00 -0.74 0.00 8.20 0.00 -1.26 -4.37 105.19 107.03 1bbs n GLY 68 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1bbs n GLY 68 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1bbs n THR 69 N -3.25 0.00 -2.29 2.61 -1.04 -1.26 -3.85 114.28 105.20 1bbs n THR 69 Ca -0.27 0.00 -0.35 0.00 -2.04 0.00 0.00 64.05 61.39 1bbs n THR 69 Cb 1.05 0.00 -0.00 0.00 -1.82 0.00 0.00 70.33 69.56 1bbs n THR 69 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1bbs s GLU 70 N 0.00 3.41 -0.01 -2.82 2.02 -1.26 0.61 118.70 120.66 1bbs s GLU 70 Ca 0.00 1.55 0.01 0.00 0.02 0.00 0.00 54.97 56.55 1bbs s GLU 70 Cb 0.00 -2.02 0.00 0.00 0.10 0.00 0.00 34.13 32.21 1bbs s GLU 70 CO 0.00 -0.79 -0.03 -0.51 0.02 0.00 0.00 175.26 173.95 1bbs s LEU 71 N -3.80 1.91 -0.38 1.80 1.43 0.15 -4.81 118.68 114.99 1bbs s LEU 71 Ca 0.71 -0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.77 1bbs s LEU 71 Cb -0.22 -0.17 0.12 0.00 0.03 0.00 0.00 46.19 45.95 1bbs s LEU 71 CO 0.26 0.02 0.17 -0.89 0.23 0.00 0.00 176.35 176.15 1bbs s THR 72 N 0.05 1.25 -0.07 5.49 2.01 -1.26 -0.27 115.64 122.85 1bbs s THR 72 Ca -0.00 -2.09 -0.26 0.00 0.31 0.00 0.00 61.69 59.65 1bbs s THR 72 Cb -0.03 -1.91 -0.03 0.00 0.01 0.00 0.00 72.50 70.55 1bbs s THR 72 CO -0.00 -0.79 0.84 -0.76 -0.69 0.00 0.00 174.62 173.21 1bbs s LEU 73 N 0.89 4.30 -0.66 4.42 1.43 -0.37 -4.96 118.68 123.73 1bbs s LEU 73 Ca 0.14 1.36 -0.07 0.00 -1.03 0.00 0.00 54.13 54.53 1bbs s LEU 73 Cb -0.21 -3.30 0.17 0.00 0.03 0.00 0.00 46.19 42.88 1bbs s LEU 73 CO -0.10 -0.24 0.52 -0.13 0.23 0.00 0.00 176.35 176.63 1bbs s ARG 74 N 1.24 2.84 0.99 1.70 1.81 -1.26 -2.96 118.95 123.31 1bbs s ARG 74 Ca 0.43 -2.41 -0.15 0.00 -1.72 0.00 0.00 55.73 51.89 1bbs s ARG 74 Cb -0.19 -3.95 0.19 0.00 -0.45 0.00 0.00 34.95 30.55 1bbs s ARG 74 CO 0.20 -1.21 1.17 0.71 -0.68 0.00 0.00 175.30 175.49 1bbs s TYR 75 N 0.20 1.85 -0.50 -0.53 2.02 -0.25 -4.93 117.35 115.20 1bbs s TYR 75 Ca 0.16 0.67 0.24 0.00 -0.37 0.00 0.00 57.07 57.76 1bbs s TYR 75 Cb -0.18 -3.55 0.40 0.00 -0.40 0.00 0.00 41.96 38.24 1bbs s TYR 75 CO -0.05 -2.79 1.52 0.66 -1.57 0.00 0.00 175.55 173.32 1bbs h SER 76 N -1.79 0.00 0.00 2.29 4.64 -2.01 -3.34 113.55 113.34 1bbs h SER 76 Ca -0.48 -0.03 -0.31 0.00 -0.47 0.00 0.00 61.79 60.50 1bbs h SER 76 Cb 1.30 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.34 1bbs h SER 76 CO 0.51 0.01 -2.15 0.35 -0.87 0.00 0.00 176.83 174.68 1bbs n THR 77 N -2.70 1.15 -4.10 2.95 -2.24 -1.26 -5.05 114.28 103.04 1bbs n THR 77 Ca 0.04 -0.71 -0.13 0.00 -2.27 0.00 0.00 64.05 60.98 1bbs n THR 77 Cb 0.50 -0.57 -0.06 0.00 -2.10 0.00 0.00 70.33 68.10 1bbs n THR 77 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1bbs s GLY 78 N -5.08 1.25 0.05 3.38 0.00 -1.25 -4.68 107.32 100.98 1bbs s GLY 78 Ca -0.09 -1.41 0.04 0.00 0.00 0.00 0.00 44.72 43.26 1bbs s GLY 78 CO 0.68 -1.02 -0.12 -1.59 0.00 0.00 0.00 173.10 171.06 1bbs s THR 79 N -3.63 0.93 0.04 0.90 2.01 -1.26 -1.09 115.64 113.53 1bbs s THR 79 Ca 0.31 -1.09 -0.06 0.00 0.31 0.00 0.00 61.69 61.16 1bbs s THR 79 Cb 0.01 -0.89 -0.01 0.00 0.01 0.00 0.00 72.50 71.62 1bbs s THR 79 CO 0.15 -0.17 0.10 0.68 -0.69 0.00 0.00 174.62 174.70 1bbs s VAL 80 N -1.10 0.13 0.02 3.82 -7.23 -1.15 -4.18 120.40 110.70 1bbs s VAL 80 Ca -0.03 -1.06 -0.03 0.00 -1.81 0.00 0.00 61.98 59.05 1bbs s VAL 80 Cb -0.09 -0.88 -0.01 0.00 0.56 0.00 0.00 36.38 35.96 1bbs s VAL 80 CO 0.01 -0.59 0.05 -0.55 -0.31 0.00 0.00 175.10 173.71 1bbs s SER 81 N -2.10 0.18 0.00 4.85 0.15 -1.02 -1.24 113.70 114.53 1bbs s SER 81 Ca -0.05 -0.46 0.00 0.00 0.70 0.00 0.00 55.95 56.14 1bbs s SER 81 Cb -0.01 0.16 0.00 0.00 -1.71 0.00 0.00 66.02 64.46 1bbs s SER 81 CO -0.04 -0.39 0.00 0.61 1.20 0.00 0.00 173.24 174.62 1bbs n GLY 82 N 1.28 -0.80 3.11 9.45 0.00 0.63 0.34 105.19 119.21 1bbs n GLY 82 Ca -0.22 -0.29 -0.08 0.00 0.00 0.00 0.00 46.02 45.43 1bbs n GLY 82 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1bbs s PHE 83 N -3.99 0.63 0.52 1.61 -0.71 -0.85 0.35 117.98 115.52 1bbs s PHE 83 Ca 0.00 -0.97 -0.21 0.00 -1.04 0.00 0.00 56.93 54.71 1bbs s PHE 83 Cb 0.00 -0.42 -0.06 0.00 -1.21 0.00 0.00 43.02 41.33 1bbs s PHE 83 CO 0.00 -0.28 1.17 -0.51 -1.34 0.00 0.00 175.22 174.25 1bbs s LEU 84 N -2.83 3.85 0.09 -1.99 1.43 0.20 0.16 118.68 119.60 1bbs s LEU 84 Ca 0.07 2.28 -0.09 0.00 -1.03 0.00 0.00 54.13 55.36 1bbs s LEU 84 Cb 0.05 -4.43 -0.00 0.00 0.03 0.00 0.00 46.19 41.84 1bbs s LEU 84 CO -0.07 -1.16 0.19 -0.44 0.23 0.00 0.00 176.35 175.10 1bbs s SER 85 N -1.54 0.11 -0.02 2.29 0.01 -0.03 -4.20 113.70 110.32 1bbs s SER 85 Ca 0.70 -0.64 0.04 0.00 1.31 0.00 0.00 55.95 57.36 1bbs s SER 85 Cb -0.27 0.34 -0.01 0.00 0.21 0.00 0.00 66.02 66.29 1bbs s SER 85 CO 0.32 -0.72 -0.15 -1.58 0.41 0.00 0.00 173.24 171.52 1bbs s GLN 86 N -3.82 1.31 0.18 12.44 0.74 -0.35 -0.56 119.66 129.59 1bbs s GLN 86 Ca 0.05 -0.52 -0.17 0.00 0.05 0.00 0.00 55.36 54.76 1bbs s GLN 86 Cb 0.05 -1.22 0.06 0.00 1.10 0.00 0.00 33.01 33.00 1bbs s GLN 86 CO -0.11 0.27 0.85 -3.47 -0.55 0.00 0.00 175.29 172.29 1bbs n ASP 87 N 2.89 -1.55 -4.61 6.67 -0.08 -0.56 0.21 116.55 119.53 1bbs n ASP 87 Ca -0.16 -1.86 -0.37 0.00 -1.51 0.00 0.00 54.79 50.90 1bbs n ASP 87 Cb 0.54 2.53 -0.10 0.00 2.34 0.00 0.00 41.12 46.43 1bbs n ASP 87 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 1bbs s ILE 88 N -2.15 5.19 0.07 5.18 -4.36 -1.26 -0.48 121.20 123.39 1bbs s ILE 88 Ca 0.19 0.12 -0.06 0.00 -0.26 0.00 0.00 60.65 60.64 1bbs s ILE 88 Cb -0.03 -3.44 -0.05 0.00 1.25 0.00 0.00 42.46 40.20 1bbs s ILE 88 CO 0.05 0.32 0.33 -0.63 0.24 0.00 0.00 174.94 175.25 1bbs s ILE 89 N 1.35 5.22 -0.22 8.37 1.01 0.12 -2.00 121.20 135.04 1bbs s ILE 89 Ca 0.07 0.12 -0.00 0.00 0.00 0.00 0.00 60.65 60.83 1bbs s ILE 89 Cb -0.15 -3.61 0.02 0.00 0.01 0.00 0.00 42.46 38.74 1bbs s ILE 89 CO 0.07 0.21 -0.12 -0.89 0.00 0.00 0.00 174.94 174.21 1bbs s THR 90 N -1.47 2.52 -0.38 2.92 2.01 0.92 -0.33 115.64 121.84 1bbs s THR 90 Ca 0.34 -1.01 0.01 0.00 0.31 0.00 0.00 61.69 61.35 1bbs s THR 90 Cb -0.13 -2.21 0.11 0.00 0.01 0.00 0.00 72.50 70.28 1bbs s THR 90 CO 0.21 0.33 0.12 -0.69 -0.69 0.00 0.00 174.62 173.90 1bbs s VAL 91 N 1.30 2.72 -0.82 3.82 1.01 0.20 -1.94 120.40 126.68 1bbs s VAL 91 Ca 0.02 -2.26 -0.02 0.00 0.00 0.00 0.00 61.98 59.71 1bbs s VAL 91 Cb -0.15 -2.93 0.00 0.00 0.00 0.00 0.00 36.38 33.29 1bbs s VAL 91 CO -0.08 -0.65 0.65 0.61 0.00 0.00 0.00 175.10 175.64 1bbs n GLY 92 N 4.35 -1.26 2.04 4.51 0.00 -1.26 -2.86 105.19 110.70 1bbs n GLY 92 Ca 0.02 0.54 0.00 0.00 0.00 0.00 0.00 46.02 46.58 1bbs n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bbs n GLY 93 N -1.70 2.03 3.59 -0.02 0.00 -1.26 -4.44 105.19 103.39 1bbs n GLY 93 Ca -0.19 -0.37 -0.39 0.00 0.00 0.00 0.00 46.02 45.06 1bbs n GLY 93 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1bbs n ILE 94 N 0.00 2.95 -4.59 -0.61 5.41 -1.14 -5.01 119.36 116.37 1bbs n ILE 94 Ca 0.00 -0.50 -0.32 0.00 1.00 0.00 0.00 62.75 62.93 1bbs n ILE 94 Cb 0.00 -1.09 -0.16 0.00 -0.71 0.00 0.00 39.64 37.68 1bbs n ILE 94 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 1bbs s THR 95 N -1.45 1.97 0.01 1.39 2.01 -1.26 -0.63 115.64 117.68 1bbs s THR 95 Ca 0.69 -0.92 0.03 0.00 0.31 0.00 0.00 61.69 61.80 1bbs s THR 95 Cb -0.48 -1.75 -0.01 0.00 0.01 0.00 0.00 72.50 70.27 1bbs s THR 95 CO 0.52 0.53 -0.09 0.54 -0.69 0.00 0.00 174.62 175.43 1bbs s VAL 96 N 0.89 0.73 -0.21 3.82 0.11 0.55 -4.98 120.40 121.31 1bbs s VAL 96 Ca -0.06 -0.61 -0.28 0.00 -2.93 0.00 0.00 61.98 58.10 1bbs s VAL 96 Cb -0.15 -0.66 0.00 0.00 -1.53 0.00 0.00 36.38 34.05 1bbs s VAL 96 CO -0.03 0.05 0.99 -0.89 -3.33 0.00 0.00 175.10 171.90 1bbs s THR 97 N -0.52 4.73 0.06 5.04 2.01 -1.26 -0.71 115.64 124.98 1bbs s THR 97 Ca 0.01 1.94 0.05 0.00 0.31 0.00 0.00 61.69 64.00 1bbs s THR 97 Cb -0.05 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.16 1bbs s THR 97 CO 0.00 -0.13 -0.14 -1.58 -0.69 0.00 0.00 174.62 172.08 1bbs s GLN 99 N 2.95 0.82 -0.34 4.92 2.00 0.37 -4.91 119.66 125.47 1bbs s GLN 99 Ca 0.43 -0.89 -0.17 0.00 -2.00 0.00 0.00 55.36 52.73 1bbs s GLN 99 Cb -0.16 -0.81 -0.01 0.00 0.80 0.00 0.00 33.01 32.84 1bbs s GLN 99 CO 0.08 0.18 0.44 -1.64 -0.50 0.00 0.00 175.29 173.85 1bbs s MET 100 N -1.58 3.64 0.00 1.67 -1.94 -1.26 -1.49 119.30 118.33 1bbs s MET 100 Ca -0.02 -0.24 0.00 0.00 -1.71 0.00 0.00 55.69 53.72 1bbs s MET 100 Cb -0.09 -3.79 0.00 0.00 2.01 0.00 0.00 34.83 32.95 1bbs s MET 100 CO 0.02 -0.56 0.00 1.97 -0.01 0.00 0.00 175.02 176.44 1bbs n PHE 101 N 5.56 0.00 -5.23 -0.03 -1.74 0.27 -4.70 117.46 111.59 1bbs n PHE 101 Ca -0.07 0.00 -0.32 0.00 -0.56 0.00 0.00 57.45 56.51 1bbs n PHE 101 Cb 0.49 0.00 -0.16 0.00 1.52 0.00 0.00 39.48 41.33 1bbs n PHE 101 CO 0.00 0.00 0.00 0.20 -0.56 0.00 0.00 176.76 176.40 1bbs s GLY 102 N -0.89 1.32 -0.49 4.97 0.00 -0.26 -0.85 107.32 111.11 1bbs s GLY 102 Ca 0.00 -1.05 -0.22 0.00 0.00 0.00 0.00 44.72 43.45 1bbs s GLY 102 CO 0.00 -0.69 0.75 -0.54 0.00 0.00 0.00 173.10 172.62 1bbs s GLU 103 N -0.27 3.27 0.28 2.90 2.02 0.12 -3.20 118.70 123.82 1bbs s GLU 103 Ca -0.00 -0.46 -0.29 0.00 0.02 0.00 0.00 54.97 54.24 1bbs s GLU 103 Cb -0.13 -4.02 -0.10 0.00 0.10 0.00 0.00 34.13 29.98 1bbs s GLU 103 CO 0.03 -1.23 1.11 0.08 0.02 0.00 0.00 175.26 175.26 1bbs s VAL 104 N 3.17 3.45 0.00 2.63 1.01 -0.97 -2.02 120.40 127.67 1bbs s VAL 104 Ca 0.24 1.46 0.00 0.00 0.00 0.00 0.00 61.98 63.68 1bbs s VAL 104 Cb -0.15 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.30 1bbs s VAL 104 CO 0.17 0.35 0.00 0.35 0.00 0.00 0.00 175.10 175.97 1bbs n THR 105 N 1.17 0.00 -3.97 3.92 -2.24 0.15 -1.91 114.28 111.40 1bbs n THR 105 Ca -0.01 -0.34 -0.30 0.00 -2.27 0.00 0.00 64.05 61.13 1bbs n THR 105 Cb 0.45 0.93 -0.16 0.00 -2.10 0.00 0.00 70.33 69.45 1bbs n THR 105 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1bbs s GLU 106 N -0.84 1.90 -0.21 -0.78 2.02 -0.66 -4.18 118.70 115.95 1bbs s GLU 106 Ca 0.00 -0.79 -0.03 0.00 0.02 0.00 0.00 54.97 54.18 1bbs s GLU 106 Cb 0.00 -2.35 0.06 0.00 0.10 0.00 0.00 34.13 31.94 1bbs s GLU 106 CO 0.00 -0.44 0.04 -1.64 0.02 0.00 0.00 175.26 173.24 1bbs s MET 107 N 1.44 0.70 0.27 1.61 -1.94 -1.26 -2.43 119.30 117.68 1bbs s MET 107 Ca -0.01 -0.51 -0.29 0.00 -1.71 0.00 0.00 55.69 53.17 1bbs s MET 107 Cb -0.16 -2.11 -0.10 0.00 2.01 0.00 0.00 34.83 34.47 1bbs s MET 107 CO -0.08 -0.68 1.34 -2.14 -0.01 0.00 0.00 175.02 173.46 1bbs s PRO 108 N 1.82 4.34 0.32 2.03 0.02 -1.26 -4.53 135.00 137.75 1bbs s PRO 108 Ca -0.00 2.19 0.02 0.00 0.02 0.00 0.00 61.00 63.23 1bbs s PRO 108 Cb -0.17 -3.11 0.58 0.00 0.02 0.00 0.00 34.50 31.81 1bbs s PRO 108 CO -0.10 -0.26 1.95 0.00 -0.33 0.00 0.00 177.00 178.25 1bbs h ALA 109 N 4.37 1.54 -2.64 -1.55 0.00 -1.97 -3.11 119.26 115.90 1bbs h ALA 109 Ca -0.47 -0.03 -0.64 0.00 0.00 0.00 0.00 54.91 53.77 1bbs h ALA 109 Cb 1.22 -0.26 -0.16 0.00 0.00 0.00 0.00 17.79 18.59 1bbs h ALA 109 CO 0.72 0.36 -0.23 -0.51 0.00 0.00 0.00 179.25 179.58 1bbs s LEU 110 N -9.88 4.23 -0.00 0.00 1.43 -1.26 0.35 118.68 113.54 1bbs s LEU 110 Ca -0.11 0.05 0.22 0.00 -1.03 0.00 0.00 54.13 53.26 1bbs s LEU 110 Cb 0.19 -2.41 -0.22 0.00 0.03 0.00 0.00 46.19 43.78 1bbs s LEU 110 CO 0.79 -0.28 0.79 -0.81 0.23 0.00 0.00 176.35 177.06 1bbs n PRO 111 N 5.41 0.26 -0.60 1.29 -0.04 -1.26 -4.88 135.00 135.18 1bbs n PRO 111 Ca -0.08 -0.07 0.46 0.00 -0.04 0.00 0.00 63.50 63.77 1bbs n PRO 111 Cb 0.50 -1.52 0.70 0.00 -0.04 0.00 0.00 33.50 33.14 1bbs n PRO 111 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1bbs n PHE 112 N -1.82 0.00 0.54 0.54 3.72 -0.75 0.59 117.46 120.28 1bbs n PHE 112 Ca 0.01 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.54 1bbs n PHE 112 Cb 0.42 -0.42 0.43 0.00 -0.94 0.00 0.00 39.48 38.97 1bbs n PHE 112 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 176.76 177.23 1bbs h MET 113 N 0.00 0.00 0.00 -1.08 2.86 -0.31 -2.89 114.93 113.51 1bbs h MET 113 Ca 0.80 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.44 1bbs h MET 113 Cb 3.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 34.95 1bbs h MET 113 CO -0.01 0.00 -0.88 1.28 1.06 0.00 0.00 176.91 178.36 1bbs n LEU 114 N -2.30 0.67 -4.69 1.22 4.77 0.20 -4.96 117.00 111.91 1bbs n LEU 114 Ca 0.04 -0.14 -0.41 0.00 -0.03 0.00 0.00 56.01 55.47 1bbs n LEU 114 Cb 0.37 -0.11 -0.04 0.00 -2.33 0.00 0.00 43.42 41.31 1bbs n LEU 114 CO 0.27 0.12 0.57 0.00 -1.33 0.00 0.00 177.39 177.02 1bbs s ALA 115 N -3.09 3.39 -0.57 -1.18 0.00 -1.10 -4.94 121.76 114.27 1bbs s ALA 115 Ca 0.07 0.17 0.24 0.00 0.00 0.00 0.00 51.96 52.44 1bbs s ALA 115 Cb 0.16 -3.18 0.55 0.00 0.00 0.00 0.00 23.12 20.65 1bbs s ALA 115 CO 0.79 -0.41 1.66 0.93 0.00 0.00 0.00 175.76 178.74 1bbs h GLU 116 N 7.05 0.00 -6.84 0.00 4.39 -1.93 -3.46 114.58 113.80 1bbs h GLU 116 Ca -0.35 0.00 -0.46 0.00 0.34 0.00 0.00 59.36 58.89 1bbs h GLU 116 Cb 1.17 0.00 0.05 0.00 -0.10 0.00 0.00 28.75 29.87 1bbs h GLU 116 CO 0.80 0.00 -0.03 -0.59 -1.16 0.00 0.00 179.01 178.03 1bbs s PHE 117 N -3.16 2.03 -0.19 4.33 -0.71 -1.26 -4.99 117.98 114.04 1bbs s PHE 117 Ca 0.08 -0.33 0.04 0.00 -1.04 0.00 0.00 56.93 55.68 1bbs s PHE 117 Cb 0.09 -2.66 -0.14 0.00 -1.21 0.00 0.00 43.02 39.10 1bbs s PHE 117 CO 0.64 -1.19 -0.13 -0.25 -1.34 0.00 0.00 175.22 172.96 1bbs n ASP 118 N -2.43 2.22 0.00 1.98 8.00 0.11 -4.99 116.55 121.44 1bbs n ASP 118 Ca 0.12 -0.08 0.00 0.00 0.71 0.00 0.00 54.79 55.54 1bbs n ASP 118 Cb 0.60 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 1bbs n ASP 118 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bbs n GLY 119 N 2.46 4.84 3.26 0.44 0.00 -1.04 -4.25 105.19 110.89 1bbs n GLY 119 Ca -0.33 -0.98 -0.14 0.00 0.00 0.00 0.00 46.02 44.58 1bbs n GLY 119 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bbs s VAL 120 N 0.27 0.05 -0.23 1.61 1.01 -0.50 -2.87 120.40 119.74 1bbs s VAL 120 Ca 0.00 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.56 1bbs s VAL 120 Cb 0.00 -0.64 0.06 0.00 0.00 0.00 0.00 36.38 35.80 1bbs s VAL 120 CO 0.00 -0.24 -0.08 -0.69 0.00 0.00 0.00 175.10 174.10 1bbs s VAL 121 N -1.30 1.67 0.10 2.92 1.01 -0.69 -0.70 120.40 123.42 1bbs s VAL 121 Ca -0.13 -1.24 -0.30 0.00 0.00 0.00 0.00 61.98 60.30 1bbs s VAL 121 Cb -0.05 -1.86 -0.07 0.00 0.00 0.00 0.00 36.38 34.41 1bbs s VAL 121 CO 0.05 -0.02 1.22 -0.83 0.00 0.00 0.00 175.10 175.52 1bbs s GLY 122 N 1.34 2.43 -0.27 4.51 0.00 0.32 -2.16 107.32 113.51 1bbs s GLY 122 Ca -0.05 0.91 0.11 0.00 0.00 0.00 0.00 44.72 45.69 1bbs s GLY 122 CO -0.06 2.02 1.47 1.03 0.00 0.00 0.00 173.10 177.56 1bbs n MET 123 N 3.51 2.15 -2.44 2.90 2.81 0.51 -4.41 117.12 122.15 1bbs n MET 123 Ca 0.08 -3.07 -0.24 0.00 -1.81 0.00 0.00 57.70 52.65 1bbs n MET 123 Cb 0.45 -1.84 0.10 0.00 -0.71 0.00 0.00 33.22 31.23 1bbs n MET 123 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1bbs s GLY 124 N -2.31 1.76 0.74 3.03 0.00 -0.62 -4.83 107.32 105.09 1bbs s GLY 124 Ca 0.44 -1.48 -0.11 0.00 0.00 0.00 0.00 44.72 43.58 1bbs s GLY 124 CO 0.03 -0.94 1.08 -1.36 0.00 0.00 0.00 173.10 171.91 1bbs s PHE 125 N -3.21 3.07 -0.70 1.90 0.40 -1.26 -4.82 117.98 113.36 1bbs s PHE 125 Ca 0.65 1.19 0.00 0.00 -0.60 0.00 0.00 56.93 58.17 1bbs s PHE 125 Cb -0.07 -3.03 0.00 0.00 0.51 0.00 0.00 43.02 40.43 1bbs s PHE 125 CO 0.45 -1.44 0.40 1.51 0.70 0.00 0.00 175.22 176.83 1bbs n ILE 126 N -3.22 0.18 0.00 0.64 3.06 -1.26 -2.91 119.36 115.86 1bbs n ILE 126 Ca 0.07 0.00 0.04 0.00 -2.50 0.00 0.00 62.75 60.36 1bbs n ILE 126 Cb 0.56 -0.46 -0.05 0.00 0.54 0.00 0.00 39.64 40.23 1bbs n ILE 126 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 1bbs n GLU 127 N 0.35 0.31 0.00 9.51 1.02 -1.26 -4.04 120.64 126.53 1bbs n GLU 127 Ca 0.00 -0.06 0.13 0.00 -0.02 0.00 0.00 57.16 57.21 1bbs n GLU 127 Cb 0.20 -1.16 0.33 0.00 -0.02 0.00 0.00 31.44 30.79 1bbs n GLU 127 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1bbs n GLN 128 N -1.73 1.87 -1.70 3.49 6.02 -1.14 -4.88 117.38 119.30 1bbs n GLN 128 Ca -0.01 -1.33 -0.40 0.00 -0.01 0.00 0.00 57.00 55.26 1bbs n GLN 128 Cb 0.18 -1.47 -0.03 0.00 1.02 0.00 0.00 30.24 29.94 1bbs n GLN 128 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1bbs s ALA 129 N -2.04 2.21 0.05 -1.58 0.00 -1.22 -4.60 121.76 114.58 1bbs s ALA 129 Ca 0.33 0.19 -0.31 0.00 0.00 0.00 0.00 51.96 52.17 1bbs s ALA 129 Cb 0.20 -4.21 -0.06 0.00 0.00 0.00 0.00 23.12 19.05 1bbs s ALA 129 CO 0.34 -3.62 1.37 0.42 0.00 0.00 0.00 175.76 174.28 1bbs s ILE 130 N 9.83 3.61 0.00 0.00 1.01 -1.26 -2.08 121.20 132.32 1bbs s ILE 130 Ca 0.92 1.08 0.00 0.00 0.00 0.00 0.00 60.65 62.65 1bbs s ILE 130 Cb -0.22 -3.69 0.00 0.00 0.01 0.00 0.00 42.46 38.56 1bbs s ILE 130 CO 0.29 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.88 1bbs n GLY 131 N 3.55 0.39 1.53 6.18 0.00 -1.26 -3.99 105.19 111.59 1bbs n GLY 131 Ca 0.12 -0.97 -0.07 0.00 0.00 0.00 0.00 46.02 45.11 1bbs n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bbs n ARG 132 N -1.85 -1.17 -2.59 1.61 3.00 -0.88 -4.87 116.66 109.91 1bbs n ARG 132 Ca 0.00 0.39 -0.43 0.00 -0.01 0.00 0.00 57.85 57.80 1bbs n ARG 132 Cb 0.28 -4.49 -0.02 0.00 0.00 0.00 0.00 32.46 28.23 1bbs n ARG 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 1bbs s VAL 133 N -1.54 4.57 -0.27 1.55 -7.23 -1.26 -4.91 120.40 111.31 1bbs s VAL 133 Ca 0.00 1.88 -0.42 0.00 -1.81 0.00 0.00 61.98 61.64 1bbs s VAL 133 Cb 0.00 -4.22 -0.18 0.00 0.56 0.00 0.00 36.38 32.55 1bbs s VAL 133 CO 0.00 -0.14 1.57 0.41 -0.31 0.00 0.00 175.10 176.63 1bbs n THR 134 N 5.22 0.13 -1.38 5.32 -1.04 -1.26 -4.86 114.28 116.41 1bbs n THR 134 Ca 0.12 -0.02 -0.35 0.00 -2.04 0.00 0.00 64.05 61.75 1bbs n THR 134 Cb 0.46 -0.80 0.10 0.00 -1.82 0.00 0.00 70.33 68.27 1bbs n THR 134 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1bbs n PRO 135 N 4.12 0.57 0.13 -2.82 -0.04 -1.26 -4.83 135.00 130.87 1bbs n PRO 135 Ca 0.26 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.98 1bbs n PRO 135 Cb 0.07 -2.39 0.29 0.00 -0.04 0.00 0.00 33.50 31.43 1bbs n PRO 135 CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 1bbs h ILE 136 N -0.26 1.28 -0.57 0.52 2.10 -1.81 -2.94 117.51 115.84 1bbs h ILE 136 Ca -0.48 -1.32 -0.08 0.00 1.08 0.00 0.00 64.86 64.06 1bbs h ILE 136 Cb 1.32 1.60 -0.02 0.00 -1.09 0.00 0.00 36.82 38.64 1bbs h ILE 136 CO 0.48 0.39 0.05 0.15 -1.08 0.00 0.00 178.15 178.15 1bbs h PHE 137 N 0.14 1.04 -1.00 2.19 3.57 -1.92 -2.52 116.94 118.44 1bbs h PHE 137 Ca 0.02 -0.16 0.10 0.00 3.53 0.00 0.00 57.97 61.46 1bbs h PHE 137 Cb 0.69 -0.28 -0.08 0.00 2.79 0.00 0.00 35.95 39.07 1bbs h PHE 137 CO 0.01 0.92 0.64 -0.44 -2.23 0.00 0.00 178.31 177.21 1bbs h ASP 138 N 0.86 0.96 -0.32 0.41 5.19 -1.89 -0.12 116.42 121.50 1bbs h ASP 138 Ca 0.17 0.04 -0.08 0.00 -0.62 0.00 0.00 57.03 56.53 1bbs h ASP 138 Cb 0.47 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.81 1bbs h ASP 138 CO 0.02 0.54 -0.12 0.78 -3.12 0.00 0.00 179.24 177.35 1bbs h ASN 139 N 1.05 0.66 -0.54 6.45 -0.26 -1.31 -1.67 115.58 119.96 1bbs h ASN 139 Ca 0.48 -0.39 -0.02 0.00 -0.56 0.00 0.00 56.30 55.81 1bbs h ASN 139 Cb 0.40 -0.18 -0.03 0.00 -1.06 0.00 0.00 38.32 37.45 1bbs h ASN 139 CO -0.24 0.90 0.29 0.40 -1.06 0.00 0.00 177.43 177.72 1bbs h ILE 140 N 0.42 1.19 0.79 2.81 2.04 -0.91 -1.34 117.51 122.50 1bbs h ILE 140 Ca 0.08 -0.50 -0.04 0.00 1.00 0.00 0.00 64.86 65.40 1bbs h ILE 140 Cb 0.63 0.44 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1bbs h ILE 140 CO 0.04 0.21 -0.47 0.40 0.00 0.00 0.00 178.15 178.33 1bbs h ILE 141 N 0.80 0.00 -1.37 -0.67 1.08 -0.81 -2.19 117.51 114.35 1bbs h ILE 141 Ca 0.20 0.00 0.40 0.00 -0.39 0.00 0.00 64.86 65.08 1bbs h ILE 141 Cb 0.07 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 33.73 1bbs h ILE 141 CO -0.03 0.00 0.95 0.28 -0.69 0.00 0.00 178.15 178.66 1bbs h SER 142 N -1.18 0.13 0.40 1.72 0.02 -0.78 0.54 113.55 114.41 1bbs h SER 142 Ca -0.11 0.05 -0.06 0.00 -0.84 0.00 0.00 61.79 60.83 1bbs h SER 142 Cb 0.94 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.50 1bbs h SER 142 CO 0.12 -0.03 -0.30 1.56 -1.14 0.00 0.00 176.83 177.04 1bbs h GLN 143 N 0.09 0.00 -3.97 3.45 4.20 -0.59 -3.47 115.11 114.81 1bbs h GLN 143 Ca 0.72 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 59.34 1bbs h GLN 143 Cb 2.55 0.00 0.07 0.00 0.30 0.00 0.00 27.48 30.40 1bbs h GLN 143 CO -0.16 0.30 -0.29 0.41 -0.67 0.00 0.00 178.83 178.43 1bbs n GLY 144 N -0.50 -0.04 0.00 3.46 0.00 0.19 -4.99 105.19 103.31 1bbs n GLY 144 Ca -0.02 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1bbs n GLY 144 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1bbs n VAL 145 N -2.05 0.00 -0.66 1.61 0.24 -1.26 -5.03 118.33 111.18 1bbs n VAL 145 Ca -0.02 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 61.99 1bbs n VAL 145 Cb 0.54 -0.40 0.22 0.00 -1.47 0.00 0.00 33.84 32.74 1bbs n VAL 145 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1bbs s LEU 146 N -2.56 1.35 -0.00 1.34 1.43 -1.26 -0.26 118.68 118.72 1bbs s LEU 146 Ca 0.00 1.62 0.22 0.00 -1.03 0.00 0.00 54.13 54.93 1bbs s LEU 146 Cb 0.00 -3.67 -0.15 0.00 0.03 0.00 0.00 46.19 42.40 1bbs s LEU 146 CO 0.00 -3.83 0.93 1.17 0.23 0.00 0.00 176.35 174.85 1bbs n LYS 147 N -4.68 0.05 -3.62 1.70 4.81 0.81 -3.53 118.16 113.71 1bbs n LYS 147 Ca 0.05 -0.01 -0.13 0.00 -0.87 0.00 0.00 58.31 57.35 1bbs n LYS 147 Cb 0.54 -1.50 -0.07 0.00 0.02 0.00 0.00 35.03 34.02 1bbs n LYS 147 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1bbs s GLU 148 N -3.04 0.79 -1.31 1.64 2.02 -1.22 -4.91 118.70 112.68 1bbs s GLU 148 Ca 0.07 0.82 -0.09 0.00 0.02 0.00 0.00 54.97 55.79 1bbs s GLU 148 Cb 0.16 0.38 -0.12 0.00 0.10 0.00 0.00 34.13 34.65 1bbs s GLU 148 CO 0.85 -0.12 3.05 -3.47 0.02 0.00 0.00 175.26 175.59 1bbs n ASP 149 N 2.36 7.99 -3.21 -0.19 2.03 -1.26 -4.12 116.55 120.15 1bbs n ASP 149 Ca -0.14 -2.54 -0.17 0.00 0.52 0.00 0.00 54.79 52.46 1bbs n ASP 149 Cb 0.55 -1.51 -0.05 0.00 -0.72 0.00 0.00 41.12 39.39 1bbs n ASP 149 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1bbs s VAL 150 N 2.01 0.00 -0.21 5.18 -7.23 -1.26 -1.13 120.40 117.76 1bbs s VAL 150 Ca 0.68 -1.73 -0.27 0.00 -1.81 0.00 0.00 61.98 58.84 1bbs s VAL 150 Cb 0.20 -2.62 0.11 0.00 0.56 0.00 0.00 36.38 34.63 1bbs s VAL 150 CO -0.05 0.00 0.92 0.72 -0.31 0.00 0.00 175.10 176.39 1bbs s PHE 151 N -3.10 -0.52 0.26 2.82 -0.12 -1.21 -0.45 117.98 115.66 1bbs s PHE 151 Ca 0.34 1.11 0.07 0.00 -0.05 0.00 0.00 56.93 58.40 1bbs s PHE 151 Cb 0.00 0.38 -0.05 0.00 -0.63 0.00 0.00 43.02 42.72 1bbs s PHE 151 CO 0.24 -0.34 -0.09 -1.12 -0.05 0.00 0.00 175.22 173.86 1bbs s SER 152 N -0.35 2.75 -0.00 1.98 0.01 -1.07 -0.07 113.70 116.95 1bbs s SER 152 Ca -0.01 -1.14 0.08 0.00 1.31 0.00 0.00 55.95 56.19 1bbs s SER 152 Cb -0.03 -0.17 -0.02 0.00 0.21 0.00 0.00 66.02 66.01 1bbs s SER 152 CO -0.00 -0.28 -0.24 -0.36 0.41 0.00 0.00 173.24 172.77 1bbs s PHE 153 N -2.98 2.10 -0.08 2.43 0.40 -0.06 -2.06 117.98 117.73 1bbs s PHE 153 Ca 0.28 -0.40 -0.01 0.00 -0.60 0.00 0.00 56.93 56.20 1bbs s PHE 153 Cb 0.02 -1.33 0.03 0.00 0.51 0.00 0.00 43.02 42.25 1bbs s PHE 153 CO 0.11 0.00 -0.03 -0.47 0.70 0.00 0.00 175.22 175.53 1bbs s TYR 154 N -0.61 0.94 -0.12 0.36 5.04 -0.39 -2.24 117.35 120.32 1bbs s TYR 154 Ca 0.09 -0.35 0.01 0.00 -2.44 0.00 0.00 57.07 54.38 1bbs s TYR 154 Cb -0.09 -0.92 -0.01 0.00 0.35 0.00 0.00 41.96 41.28 1bbs s TYR 154 CO -0.00 -0.37 -0.14 0.71 -1.34 0.00 0.00 175.55 174.41 1bbs s TYR 155 N 1.75 2.77 0.46 4.97 2.02 -1.26 -1.09 117.35 126.98 1bbs s TYR 155 Ca 0.03 -0.62 0.08 0.00 -0.37 0.00 0.00 57.07 56.18 1bbs s TYR 155 Cb -0.13 -1.80 0.03 0.00 -0.40 0.00 0.00 41.96 39.66 1bbs s TYR 155 CO -0.05 -0.18 0.63 1.21 -1.57 0.00 0.00 175.55 175.58 1bbs s ASN 156 N 0.21 5.52 -0.86 2.29 3.04 -0.85 -4.45 114.94 119.84 1bbs s ASN 156 Ca -0.09 -0.45 -0.05 0.00 0.04 0.00 0.00 52.86 52.31 1bbs s ASN 156 Cb -0.15 -0.53 0.22 0.00 -1.54 0.00 0.00 41.25 39.24 1bbs s ASN 156 CO 0.05 -0.90 0.75 -0.13 -3.04 0.00 0.00 177.10 173.84 1bbs s ARG 157 N -4.45 3.32 0.00 0.43 0.52 -1.26 -4.93 118.95 112.58 1bbs s ARG 157 Ca 0.56 -2.96 0.00 0.00 -0.52 0.00 0.00 55.73 52.82 1bbs s ARG 157 Cb -0.09 -4.09 0.00 0.00 0.52 0.00 0.00 34.95 31.29 1bbs s ARG 157 CO 0.35 -1.24 0.00 -3.47 0.02 0.00 0.00 175.30 170.95 1bbs n ASP 158 N 2.94 0.00 -3.65 0.23 -0.08 -1.26 -5.04 116.55 109.70 1bbs n ASP 158 Ca 0.17 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.44 1bbs n ASP 158 Cb 0.39 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.84 1bbs n ASP 158 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1bbs s SER 159 N -0.72 -0.12 0.00 1.67 0.01 -1.26 -4.99 113.70 108.29 1bbs s SER 159 Ca 0.00 -0.18 0.00 0.00 1.31 0.00 0.00 55.95 57.08 1bbs s SER 159 Cb 0.00 0.27 0.00 0.00 0.21 0.00 0.00 66.02 66.50 1bbs s SER 159 CO 0.00 -0.48 0.00 -0.62 0.41 0.00 0.00 173.24 172.55 1bbs n GLU 160 N -0.42 0.00 -1.58 12.44 1.02 -1.26 -5.09 120.64 125.75 1bbs n GLU 160 Ca -0.07 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.64 1bbs n GLU 160 Cb 0.62 0.00 -0.00 0.00 -0.02 0.00 0.00 31.44 32.03 1bbs n GLU 160 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 1bbs n LEU 161 N 0.00 1.85 0.21 -4.62 -0.00 -1.26 -5.37 117.00 107.81 1bbs n LEU 161 Ca 0.00 1.09 -0.15 0.00 -0.00 0.00 0.00 56.01 56.95 1bbs n LEU 161 Cb 0.00 -1.29 -0.08 0.00 -0.00 0.00 0.00 43.42 42.05 1bbs n LEU 161 CO 0.00 -1.64 0.69 1.23 -0.00 0.00 0.00 177.39 177.66 1bbs h GLY 162 N 1.65 -0.51 0.00 1.47 0.00 -1.93 -3.45 103.07 100.30 1bbs h GLY 162 Ca -0.41 0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1bbs h GLY 162 CO 0.58 -0.19 0.00 0.61 0.00 0.00 0.00 176.54 177.54 1bbs n GLY 163 N -1.01 -0.87 3.64 4.60 0.00 -1.09 -2.01 105.19 108.45 1bbs n GLY 163 Ca -0.10 -1.02 -0.09 0.00 0.00 0.00 0.00 46.02 44.81 1bbs n GLY 163 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1bbs s GLN 164 N -2.00 0.46 -0.17 1.61 0.74 -0.25 -1.25 119.66 118.81 1bbs s GLN 164 Ca 0.00 0.54 -0.06 0.00 0.05 0.00 0.00 55.36 55.90 1bbs s GLN 164 Cb 0.00 0.23 -0.04 0.00 1.10 0.00 0.00 33.01 34.30 1bbs s GLN 164 CO 0.00 -0.06 0.03 0.42 -0.55 0.00 0.00 175.29 175.13 1bbs s ILE 165 N 0.19 4.49 -0.24 -2.34 1.01 -0.49 -1.26 121.20 122.56 1bbs s ILE 165 Ca 0.04 -0.15 0.02 0.00 0.00 0.00 0.00 60.65 60.56 1bbs s ILE 165 Cb -0.05 -2.99 0.05 0.00 0.01 0.00 0.00 42.46 39.48 1bbs s ILE 165 CO -0.07 0.49 -0.13 -0.69 0.00 0.00 0.00 174.94 174.54 1bbs s VAL 166 N 0.24 2.10 -0.21 2.92 1.01 -0.88 -0.06 120.40 125.52 1bbs s VAL 166 Ca 0.02 -1.45 -0.27 0.00 0.00 0.00 0.00 61.98 60.27 1bbs s VAL 166 Cb -0.13 -2.15 0.00 0.00 0.00 0.00 0.00 36.38 34.11 1bbs s VAL 166 CO 0.01 0.09 0.95 -0.76 0.00 0.00 0.00 175.10 175.40 1bbs s LEU 167 N 1.17 4.12 0.00 3.92 1.43 0.22 -2.60 118.68 126.93 1bbs s LEU 167 Ca -0.06 1.28 0.00 0.00 -1.03 0.00 0.00 54.13 54.32 1bbs s LEU 167 Cb -0.18 -3.41 0.00 0.00 0.03 0.00 0.00 46.19 42.63 1bbs s LEU 167 CO -0.07 -0.57 0.00 0.61 0.23 0.00 0.00 176.35 176.55 1bbs n GLY 168 N 3.43 0.86 0.00 -3.19 0.00 0.40 -1.13 105.19 105.55 1bbs n GLY 168 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1bbs n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bbs n GLY 169 N -1.44 -0.51 3.33 -0.02 0.00 -1.24 -3.37 105.19 101.94 1bbs n GLY 169 Ca 0.00 -0.97 -0.18 0.00 0.00 0.00 0.00 46.02 44.88 1bbs n GLY 169 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bbs s SER 170 N -4.00 2.34 -0.32 1.61 0.01 -1.26 -3.70 113.70 108.38 1bbs s SER 170 Ca 0.00 -1.05 -0.03 0.00 1.31 0.00 0.00 55.95 56.17 1bbs s SER 170 Cb 0.00 -0.10 0.05 0.00 0.21 0.00 0.00 66.02 66.19 1bbs s SER 170 CO 0.00 -0.26 0.04 -0.62 0.41 0.00 0.00 173.24 172.81 1bbs s ASP 171 N -3.29 5.03 0.00 2.44 -1.08 -1.26 -4.94 116.67 113.57 1bbs s ASP 171 Ca 0.22 -1.29 0.02 0.00 -0.52 0.00 0.00 52.55 50.98 1bbs s ASP 171 Cb 0.01 -1.76 0.11 0.00 -1.46 0.00 0.00 42.92 39.82 1bbs s ASP 171 CO 0.06 -0.30 0.40 -2.65 0.52 0.00 0.00 175.17 173.20 1bbs n PRO 172 N 4.67 0.22 0.10 4.34 -0.02 -1.26 -1.74 135.00 141.32 1bbs n PRO 172 Ca -0.12 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.48 1bbs n PRO 172 Cb 0.44 -1.13 0.06 0.00 -0.02 0.00 0.00 33.50 32.85 1bbs n PRO 172 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1bbs h GLN 173 N 0.00 0.00 -0.37 -0.52 1.08 -1.98 -3.33 115.11 109.99 1bbs h GLN 173 Ca 0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 1bbs h GLN 173 Cb 0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 1bbs h GLN 173 CO 0.00 0.00 0.01 0.72 -0.95 0.00 0.00 178.83 178.61 1bbs n HIS 174 N -2.55 1.35 -3.66 2.96 8.25 -0.71 -4.74 115.22 116.12 1bbs n HIS 174 Ca 0.01 -0.86 -0.12 0.00 -0.26 0.00 0.00 57.72 56.49 1bbs n HIS 174 Cb 0.52 -0.39 -0.06 0.00 1.12 0.00 0.00 29.99 31.17 1bbs n HIS 174 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 1bbs s TYR 175 N -2.83 -0.25 0.02 4.41 -0.85 -1.25 -1.72 117.35 114.87 1bbs s TYR 175 Ca 0.47 0.17 0.00 0.00 -0.52 0.00 0.00 57.07 57.18 1bbs s TYR 175 Cb 0.37 0.23 -0.02 0.00 0.38 0.00 0.00 41.96 42.92 1bbs s TYR 175 CO 0.11 -0.59 -0.03 -1.83 -1.52 0.00 0.00 175.55 171.69 1bbs s GLU 176 N -2.71 0.30 1.75 -3.49 -1.05 0.05 -4.85 118.70 108.69 1bbs s GLU 176 Ca -0.04 -0.56 0.00 0.00 -0.15 0.00 0.00 54.97 54.22 1bbs s GLU 176 Cb -0.00 0.07 0.00 0.00 -0.44 0.00 0.00 34.13 33.76 1bbs s GLU 176 CO -0.04 -0.04 0.00 0.41 0.95 0.00 0.00 175.26 176.54 1bbs n GLY 177 N 1.73 -0.30 3.71 -3.83 0.00 -1.26 -3.68 105.19 101.57 1bbs n GLY 177 Ca -0.23 -1.41 -0.33 0.00 0.00 0.00 0.00 46.02 44.05 1bbs n GLY 177 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1bbs s ASN 178 N -4.00 5.32 0.63 1.61 0.02 -1.26 -5.03 114.94 112.23 1bbs s ASN 178 Ca 0.00 0.06 -0.15 0.00 -1.02 0.00 0.00 52.86 51.75 1bbs s ASN 178 Cb 0.00 -1.45 -0.01 0.00 0.02 0.00 0.00 41.25 39.81 1bbs s ASN 178 CO 0.00 0.29 1.08 -0.36 0.02 0.00 0.00 177.10 178.13 1bbs s PHE 179 N -1.10 2.80 -0.13 2.20 0.08 -1.26 -4.74 117.98 115.85 1bbs s PHE 179 Ca 0.20 1.53 -0.04 0.00 0.12 0.00 0.00 56.93 58.74 1bbs s PHE 179 Cb -0.12 -3.08 0.05 0.00 -0.57 0.00 0.00 43.02 39.30 1bbs s PHE 179 CO 0.10 -1.42 0.07 -1.01 -0.10 0.00 0.00 175.22 172.86 1bbs s HIS 180 N -2.43 0.30 0.39 0.36 3.76 -1.00 -4.94 115.29 111.72 1bbs s HIS 180 Ca 0.65 -0.19 -0.21 0.00 -0.15 0.00 0.00 55.06 55.16 1bbs s HIS 180 Cb -0.18 -0.68 -0.10 0.00 1.11 0.00 0.00 32.58 32.73 1bbs s HIS 180 CO 0.40 -0.41 0.91 0.71 -0.85 0.00 0.00 174.74 175.50 1bbs s TYR 181 N 2.10 3.40 -0.09 1.40 2.02 -1.26 -2.09 117.35 122.83 1bbs s TYR 181 Ca 0.03 1.58 -0.01 0.00 -0.37 0.00 0.00 57.07 58.30 1bbs s TYR 181 Cb -0.15 -2.81 0.03 0.00 -0.40 0.00 0.00 41.96 38.63 1bbs s TYR 181 CO -0.07 -0.01 -0.04 0.42 -1.57 0.00 0.00 175.55 174.28 1bbs s ILE 182 N -2.03 0.71 0.44 2.71 1.01 0.61 -4.90 121.20 119.75 1bbs s ILE 182 Ca 0.58 -0.10 -0.23 0.00 0.00 0.00 0.00 60.65 60.90 1bbs s ILE 182 Cb -0.11 -0.78 -0.08 0.00 0.01 0.00 0.00 42.46 41.49 1bbs s ILE 182 CO 0.16 0.31 1.10 0.20 0.00 0.00 0.00 174.94 176.70 1bbs s ASN 183 N 1.72 6.44 0.24 3.58 -0.87 -1.26 -1.78 114.94 123.01 1bbs s ASN 183 Ca 0.03 2.13 -0.30 0.00 -1.57 0.00 0.00 52.86 53.15 1bbs s ASN 183 Cb -0.13 -2.59 -0.11 0.00 -0.02 0.00 0.00 41.25 38.41 1bbs s ASN 183 CO -0.06 -0.72 1.53 -0.76 -2.57 0.00 0.00 177.10 174.52 1bbs s LEU 184 N -2.94 4.37 0.01 0.60 1.43 -1.03 -4.65 118.68 116.48 1bbs s LEU 184 Ca 0.62 2.75 -0.26 0.00 -1.03 0.00 0.00 54.13 56.21 1bbs s LEU 184 Cb -0.24 -3.62 -0.15 0.00 0.03 0.00 0.00 46.19 42.21 1bbs s LEU 184 CO 0.29 -0.80 1.12 0.40 0.23 0.00 0.00 176.35 177.59 1bbs h ILE 185 N 3.61 0.14 -1.93 -0.59 2.04 -1.79 -3.45 117.51 115.56 1bbs h ILE 185 Ca -0.45 -0.36 -0.50 0.00 1.00 0.00 0.00 64.86 64.55 1bbs h ILE 185 Cb 1.21 0.20 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 1bbs h ILE 185 CO 0.82 0.02 -0.47 -0.75 0.00 0.00 0.00 178.15 177.77 1bbs s LYS 186 N -4.65 2.74 0.02 2.37 2.47 -1.26 -5.11 119.74 116.32 1bbs s LYS 186 Ca -0.14 -1.26 0.01 0.00 -1.56 0.00 0.00 55.97 53.02 1bbs s LYS 186 Cb 0.02 -2.48 -0.04 0.00 -1.46 0.00 0.00 37.83 33.87 1bbs s LYS 186 CO 0.44 0.16 0.07 0.99 0.16 0.00 0.00 175.35 177.17 1bbs s THR 187 N -2.28 4.57 0.00 3.43 2.01 -1.26 -4.29 115.64 117.82 1bbs s THR 187 Ca 0.39 -0.53 0.00 0.00 0.31 0.00 0.00 61.69 61.86 1bbs s THR 187 Cb -0.06 -3.11 0.00 0.00 0.01 0.00 0.00 72.50 69.34 1bbs s THR 187 CO 0.26 0.30 0.00 0.61 -0.69 0.00 0.00 174.62 175.10 1bbs n GLY 188 N 1.06 1.10 3.54 4.40 0.00 -1.26 -5.07 105.19 108.97 1bbs n GLY 188 Ca -0.12 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.83 1bbs n GLY 188 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bbs s VAL 189 N -2.00 -0.14 -1.17 1.61 1.01 -1.26 -4.43 120.40 114.02 1bbs s VAL 189 Ca 0.00 0.03 -0.18 0.00 0.00 0.00 0.00 61.98 61.83 1bbs s VAL 189 Cb 0.00 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 1bbs s VAL 189 CO 0.00 0.01 2.08 0.79 0.00 0.00 0.00 175.10 177.98 1bbs n TRP 190 N 4.47 2.91 -4.64 5.22 7.02 -1.26 -4.78 117.44 126.38 1bbs n TRP 190 Ca -0.19 -2.47 -0.23 0.00 -1.02 0.00 0.00 57.50 53.59 1bbs n TRP 190 Cb 0.57 -2.23 -0.15 0.00 -2.42 0.00 0.00 31.31 27.08 1bbs n TRP 190 CO 0.00 0.00 0.00 -1.14 -2.02 0.00 0.00 177.69 174.53 1bbs s GLN 191 N 4.05 1.22 0.14 -0.99 0.74 -1.26 -1.90 119.66 121.66 1bbs s GLN 191 Ca 0.52 -0.68 0.02 0.00 0.05 0.00 0.00 55.36 55.27 1bbs s GLN 191 Cb 0.13 -1.22 -0.04 0.00 1.10 0.00 0.00 33.01 32.98 1bbs s GLN 191 CO 0.01 0.32 -0.03 0.96 -0.55 0.00 0.00 175.29 176.00 1bbs s ILE 192 N -0.56 0.70 0.23 -2.34 -4.36 0.43 -2.27 121.20 113.03 1bbs s ILE 192 Ca 0.05 -1.97 -0.16 0.00 -0.26 0.00 0.00 60.65 58.31 1bbs s ILE 192 Cb -0.07 -1.95 -0.08 0.00 1.25 0.00 0.00 42.46 41.61 1bbs s ILE 192 CO 0.00 -0.63 0.66 -1.10 0.24 0.00 0.00 174.94 174.12 1bbs s GLN 193 N -3.88 4.07 -0.17 0.37 -0.21 -1.26 0.08 119.66 118.66 1bbs s GLN 193 Ca 0.19 0.66 0.00 0.00 0.02 0.00 0.00 55.36 56.23 1bbs s GLN 193 Cb 0.06 -2.76 0.01 0.00 1.00 0.00 0.00 33.01 31.32 1bbs s GLN 193 CO 0.01 0.35 -0.16 -1.64 -2.12 0.00 0.00 175.29 171.73 1bbs s MET 194 N -2.31 3.15 -0.73 2.91 -1.94 0.64 -4.62 119.30 116.40 1bbs s MET 194 Ca 0.45 -0.77 -0.00 0.00 -1.71 0.00 0.00 55.69 53.65 1bbs s MET 194 Cb -0.14 -2.64 0.38 0.00 2.01 0.00 0.00 34.83 34.44 1bbs s MET 194 CO 0.20 -0.09 1.85 1.63 -0.01 0.00 0.00 175.02 178.60 1bbs n LYS 195 N 4.34 2.89 0.00 2.03 5.02 -1.06 -0.88 118.16 130.49 1bbs n LYS 195 Ca -0.20 -3.67 0.00 0.00 -2.02 0.00 0.00 58.31 52.42 1bbs n LYS 195 Cb 0.51 -2.27 0.00 0.00 -0.02 0.00 0.00 35.03 33.25 1bbs n LYS 195 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bbs n GLY 196 N -0.60 2.75 3.41 0.72 0.00 -1.22 -4.69 105.19 105.56 1bbs n GLY 196 Ca 0.53 -1.89 -0.33 0.00 0.00 0.00 0.00 46.02 44.32 1bbs n GLY 196 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bbs s VAL 197 N -2.74 3.39 -0.26 1.61 1.01 4.61 -1.95 120.40 126.07 1bbs s VAL 197 Ca 0.00 -0.53 -0.06 0.00 0.00 0.00 0.00 61.98 61.38 1bbs s VAL 197 Cb 0.00 -2.46 -0.01 0.00 0.00 0.00 0.00 36.38 33.91 1bbs s VAL 197 CO 0.00 0.50 0.05 -0.44 0.00 0.00 0.00 175.10 175.22 1bbs s SER 198 N 0.46 4.97 -0.60 3.32 0.01 0.42 -0.48 113.70 121.80 1bbs s SER 198 Ca -0.07 -0.45 -0.20 0.00 1.31 0.00 0.00 55.95 56.55 1bbs s SER 198 Cb -0.15 -1.87 0.09 0.00 0.21 0.00 0.00 66.02 64.30 1bbs s SER 198 CO 0.04 -0.10 0.74 -0.69 0.41 0.00 0.00 173.24 173.64 1bbs s VAL 199 N 1.54 4.74 0.00 3.43 1.01 -0.36 -1.37 120.40 129.39 1bbs s VAL 199 Ca 0.05 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.17 1bbs s VAL 199 Cb -0.16 -4.51 0.00 0.00 0.00 0.00 0.00 36.38 31.71 1bbs s VAL 199 CO 0.02 -1.16 0.00 0.61 0.00 0.00 0.00 175.10 174.57 1bbs n GLY 200 N 5.28 0.88 0.00 4.51 0.00 -1.08 -1.80 105.19 112.99 1bbs n GLY 200 Ca -0.08 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1bbs n GLY 200 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1bbs n SER 201 N 8.33 1.45 -4.22 1.61 7.64 -1.26 -4.91 113.62 122.25 1bbs n SER 201 Ca 0.00 -1.48 -0.34 0.00 1.01 0.00 0.00 58.87 58.06 1bbs n SER 201 Cb 0.00 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.05 1bbs n SER 201 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1bbs s SER 202 N -0.48 4.12 -0.21 6.43 0.15 -0.74 -4.97 113.70 117.99 1bbs s SER 202 Ca 0.00 -0.71 -0.05 0.00 0.70 0.00 0.00 55.95 55.89 1bbs s SER 202 Cb 0.00 -1.65 -0.16 0.00 -1.71 0.00 0.00 66.02 62.49 1bbs s SER 202 CO 0.00 -0.08 2.62 1.07 1.20 0.00 0.00 173.24 178.06 1bbs n THR 203 N 4.69 2.27 0.50 6.45 5.66 -1.26 -1.22 114.28 131.36 1bbs n THR 203 Ca -0.18 -1.19 0.02 0.00 -3.05 0.00 0.00 64.05 59.65 1bbs n THR 203 Cb 0.48 -1.93 0.09 0.00 -1.55 0.00 0.00 70.33 67.43 1bbs n THR 203 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1bbs n LEU 204 N 2.91 0.00 -3.66 1.09 -0.00 -1.23 -4.49 117.00 111.61 1bbs n LEU 204 Ca 0.35 0.00 -0.08 0.00 -0.00 0.00 0.00 56.01 56.28 1bbs n LEU 204 Cb 0.55 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.88 1bbs n LEU 204 CO 0.27 0.00 0.09 -0.76 -0.00 0.00 0.00 177.39 176.99 1bbs s LEU 205 N -1.40 -0.59 0.00 1.47 1.43 0.36 -4.92 118.68 115.03 1bbs s LEU 205 Ca 0.05 1.09 0.00 0.00 -1.03 0.00 0.00 54.13 54.23 1bbs s LEU 205 Cb 0.02 1.56 0.00 0.00 0.03 0.00 0.00 46.19 47.80 1bbs s LEU 205 CO 0.04 -0.22 0.00 0.00 0.23 0.00 0.00 176.35 176.40 1bbs s GLU 207 N -0.14 3.45 0.00 0.00 2.02 -1.26 -2.20 118.70 120.57 1bbs s GLU 207 Ca 0.00 1.35 0.00 0.00 0.02 0.00 0.00 54.97 56.34 1bbs s GLU 207 Cb 0.00 -4.14 0.00 0.00 0.10 0.00 0.00 34.13 30.09 1bbs s GLU 207 CO 0.00 -1.72 0.00 -0.25 0.02 0.00 0.00 175.26 173.31 1bbs n ASP 208 N 9.72 0.00 0.00 -0.19 8.00 -1.26 -4.95 116.55 127.87 1bbs n ASP 208 Ca 0.21 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.71 1bbs n ASP 208 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.57 1bbs n ASP 208 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bbs n GLY 209 N -1.27 2.88 1.27 0.44 0.00 -0.93 -5.07 105.19 102.51 1bbs n GLY 209 Ca 0.00 -1.67 -0.08 0.00 0.00 0.00 0.00 46.02 44.27 1bbs n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bbs s LEU 211 N 0.00 3.52 -0.07 0.00 1.43 -1.26 -0.26 118.68 122.03 1bbs s LEU 211 Ca 0.15 -0.29 -0.03 0.00 -1.03 0.00 0.00 54.13 52.93 1bbs s LEU 211 Cb 0.01 -2.15 0.04 0.00 0.03 0.00 0.00 46.19 44.12 1bbs s LEU 211 CO 0.10 0.08 0.10 0.00 0.23 0.00 0.00 176.35 176.87 1bbs s ALA 212 N -1.74 0.09 -0.33 4.21 0.00 0.11 -2.03 121.76 122.06 1bbs s ALA 212 Ca 0.29 0.28 -0.17 0.00 0.00 0.00 0.00 51.96 52.35 1bbs s ALA 212 Cb -0.10 -0.75 -0.01 0.00 0.00 0.00 0.00 23.12 22.26 1bbs s ALA 212 CO 0.21 -0.61 0.48 -1.17 0.00 0.00 0.00 175.76 174.67 1bbs s LEU 213 N 2.22 4.31 -0.80 0.00 0.20 0.09 -0.43 118.68 124.27 1bbs s LEU 213 Ca 0.04 0.01 -0.22 0.00 0.69 0.00 0.00 54.13 54.65 1bbs s LEU 213 Cb -0.13 -2.54 0.08 0.00 -0.43 0.00 0.00 46.19 43.17 1bbs s LEU 213 CO -0.05 -0.42 1.14 -0.69 -0.29 0.00 0.00 176.35 176.04 1bbs s VAL 214 N 2.30 4.27 -0.57 1.68 1.01 -0.80 0.28 120.40 128.56 1bbs s VAL 214 Ca 0.17 -0.62 -0.19 0.00 0.00 0.00 0.00 61.98 61.35 1bbs s VAL 214 Cb -0.16 -4.81 0.09 0.00 0.00 0.00 0.00 36.38 31.51 1bbs s VAL 214 CO 0.12 -1.61 0.68 -0.62 0.00 0.00 0.00 175.10 173.67 1bbs s ASP 215 N 3.89 6.19 0.00 3.32 -1.08 0.23 -4.78 116.67 124.44 1bbs s ASP 215 Ca 0.31 -1.31 0.23 0.00 -0.52 0.00 0.00 52.55 51.25 1bbs s ASP 215 Cb -0.10 -2.30 1.24 0.00 -1.46 0.00 0.00 42.92 40.30 1bbs s ASP 215 CO 0.03 -1.05 1.74 0.35 0.52 0.00 0.00 175.17 176.75 1bbs n THR 216 N 5.56 0.18 -1.06 1.71 -2.24 -1.26 -3.03 114.28 114.14 1bbs n THR 216 Ca -0.09 0.04 0.05 0.00 -2.27 0.00 0.00 64.05 61.78 1bbs n THR 216 Cb 0.43 -0.68 0.27 0.00 -2.10 0.00 0.00 70.33 68.26 1bbs n THR 216 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bbs n GLY 217 N 0.55 4.00 3.29 3.38 0.00 -1.26 -4.74 105.19 110.40 1bbs n GLY 217 Ca 0.13 -1.05 -0.33 0.00 0.00 0.00 0.00 46.02 44.78 1bbs n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bbs s ALA 218 N -2.91 2.41 -0.29 4.61 0.00 -1.17 -5.00 121.76 119.40 1bbs s ALA 218 Ca 0.46 -0.94 0.21 0.00 0.00 0.00 0.00 51.96 51.69 1bbs s ALA 218 Cb 0.37 -1.03 0.13 0.00 0.00 0.00 0.00 23.12 22.60 1bbs s ALA 218 CO 0.09 0.25 1.32 0.77 0.00 0.00 0.00 175.76 178.19 1bbs h SER 219 N 6.75 0.00 -2.75 0.00 0.02 -1.89 0.26 113.55 115.94 1bbs h SER 219 Ca -0.23 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.19 1bbs h SER 219 Cb 1.22 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.63 1bbs h SER 219 CO 0.52 0.14 -0.58 -0.31 -1.14 0.00 0.00 176.83 175.46 1bbs s TYR 220 N -3.19 1.99 0.02 3.45 2.02 -1.26 -3.44 117.35 116.94 1bbs s TYR 220 Ca 0.03 -0.99 -0.25 0.00 -0.37 0.00 0.00 57.07 55.49 1bbs s TYR 220 Cb 0.07 -1.35 -0.05 0.00 -0.40 0.00 0.00 41.96 40.23 1bbs s TYR 220 CO 0.74 0.02 0.77 0.42 -1.57 0.00 0.00 175.55 175.93 1bbs s ILE 221 N -3.16 4.81 0.06 2.71 1.01 -0.42 -3.38 121.20 122.83 1bbs s ILE 221 Ca 0.31 1.63 0.01 0.00 0.00 0.00 0.00 60.65 62.59 1bbs s ILE 221 Cb 0.07 -4.12 -0.03 0.00 0.01 0.00 0.00 42.46 38.39 1bbs s ILE 221 CO 0.14 0.32 -0.05 -0.94 0.00 0.00 0.00 174.94 174.42 1bbs s SER 222 N 0.21 0.77 0.27 3.58 1.04 -0.72 -1.12 113.70 117.72 1bbs s SER 222 Ca 0.39 -0.84 -0.03 0.00 0.48 0.00 0.00 55.95 55.96 1bbs s SER 222 Cb -0.20 0.11 0.01 0.00 0.10 0.00 0.00 66.02 66.05 1bbs s SER 222 CO 0.22 -0.43 0.40 0.61 0.98 0.00 0.00 173.24 175.02 1bbs n GLY 223 N 0.54 2.21 3.56 7.32 0.00 -0.84 0.42 105.19 118.40 1bbs n GLY 223 Ca -0.17 -1.51 -0.38 0.00 0.00 0.00 0.00 46.02 43.96 1bbs n GLY 223 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1bbs n SER 224 N -1.70 0.15 -0.17 1.61 3.41 -1.26 -0.15 113.62 115.51 1bbs n SER 224 Ca -0.00 0.81 -0.03 0.00 -0.26 0.00 0.00 58.87 59.38 1bbs n SER 224 Cb 0.44 -1.30 0.06 0.00 -0.26 0.00 0.00 64.21 63.15 1bbs n SER 224 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1bbs h THR 225 N 0.51 0.88 0.34 6.66 2.02 -1.88 -0.41 112.91 121.03 1bbs h THR 225 Ca -0.47 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 66.55 1bbs h THR 225 Cb 1.37 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 68.21 1bbs h THR 225 CO 0.50 0.08 -0.16 0.28 0.37 0.00 0.00 175.52 176.59 1bbs h SER 226 N 0.42 -0.38 0.13 4.18 0.02 -1.98 0.45 113.55 116.38 1bbs h SER 226 Ca 0.24 -0.05 0.01 0.00 -0.84 0.00 0.00 61.79 61.15 1bbs h SER 226 Cb 0.21 0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.81 1bbs h SER 226 CO -0.21 -0.20 -0.47 -1.28 -1.14 0.00 0.00 176.83 173.53 1bbs h SER 227 N -0.55 -1.41 -0.78 3.07 0.87 -1.84 -0.44 113.55 112.47 1bbs h SER 227 Ca -0.05 0.15 0.13 0.00 -1.23 0.00 0.00 61.79 60.79 1bbs h SER 227 Cb 0.41 0.52 -0.05 0.00 -0.44 0.00 0.00 62.40 62.83 1bbs h SER 227 CO 0.08 -0.51 0.51 0.40 -0.53 0.00 0.00 176.83 176.79 1bbs h ILE 228 N -0.69 0.85 -0.01 2.23 1.08 -1.09 -1.39 117.51 118.49 1bbs h ILE 228 Ca -0.01 -0.19 -0.00 0.00 -0.39 0.00 0.00 64.86 64.27 1bbs h ILE 228 Cb 0.68 0.25 -0.00 0.00 -3.07 0.00 0.00 36.82 34.68 1bbs h ILE 228 CO -0.24 0.10 0.01 -0.08 -0.69 0.00 0.00 178.15 177.24 1bbs h GLU 229 N 0.55 0.01 -0.58 2.37 4.81 0.15 0.24 114.58 122.14 1bbs h GLU 229 Ca 0.38 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.59 1bbs h GLU 229 Cb 0.70 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.05 1bbs h GLU 229 CO -0.14 0.06 0.30 0.87 -0.73 0.00 0.00 179.01 179.37 1bbs h LYS 230 N -0.04 0.82 -0.07 1.92 1.57 -0.38 -2.68 116.57 117.71 1bbs h LYS 230 Ca 0.00 -0.10 0.04 0.00 -1.87 0.00 0.00 60.65 58.72 1bbs h LYS 230 Cb 0.05 -0.16 -0.06 0.00 0.08 0.00 0.00 32.23 32.15 1bbs h LYS 230 CO -0.00 0.64 -0.35 1.25 -0.57 0.00 0.00 179.45 180.42 1bbs h LEU 231 N 0.78 -1.08 -0.49 2.94 5.85 -0.79 -2.21 115.31 120.31 1bbs h LEU 231 Ca 0.20 0.15 0.03 0.00 0.84 0.00 0.00 57.88 59.10 1bbs h LEU 231 Cb 0.07 0.44 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 1bbs h LEU 231 CO -0.03 -0.39 0.27 0.24 -0.34 0.00 0.00 178.44 178.19 1bbs h MET 232 N -0.46 0.52 -0.99 1.25 2.86 -0.36 -1.44 114.93 116.30 1bbs h MET 232 Ca 0.08 -0.03 0.37 0.00 -2.06 0.00 0.00 59.70 58.05 1bbs h MET 232 Cb 0.58 -0.12 -0.18 0.00 0.06 0.00 0.00 31.60 31.95 1bbs h MET 232 CO -0.33 0.34 0.43 1.49 1.06 0.00 0.00 176.91 179.90 1bbs h GLU 233 N 0.53 0.05 0.03 1.72 4.81 -1.08 0.62 114.58 121.26 1bbs h GLU 233 Ca 0.21 -0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 59.19 1bbs h GLU 233 Cb 0.07 -0.01 0.02 0.00 0.63 0.00 0.00 28.75 29.46 1bbs h GLU 233 CO -0.12 0.03 -0.96 0.00 -0.73 0.00 0.00 179.01 177.24 1bbs h ALA 234 N 1.97 0.08 0.00 2.92 0.00 -0.80 -3.20 119.26 120.24 1bbs h ALA 234 Ca 0.77 -0.68 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1bbs h ALA 234 Cb 1.93 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.77 1bbs h ALA 234 CO -0.78 0.59 -0.42 -0.07 0.00 0.00 0.00 179.25 178.57 1bbs h LEU 235 N 0.22 0.00 -2.94 0.00 3.38 -0.12 -3.48 115.31 112.36 1bbs h LEU 235 Ca -0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1bbs h LEU 235 Cb 1.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.39 1bbs h LEU 235 CO 0.19 0.42 -0.03 0.61 0.09 0.00 0.00 178.44 179.71 1bbs n GLY 236 N 1.18 -0.63 3.41 0.83 0.00 0.18 -4.97 105.19 105.19 1bbs n GLY 236 Ca 0.02 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 1bbs n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bbs s ALA 237 N -1.78 2.44 -0.08 4.61 0.00 -1.11 -4.90 121.76 120.94 1bbs s ALA 237 Ca 0.02 -1.32 -0.04 0.00 0.00 0.00 0.00 51.96 50.62 1bbs s ALA 237 Cb -0.00 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.54 1bbs s ALA 237 CO 0.07 0.55 0.09 0.15 0.00 0.00 0.00 175.76 176.62 1bbs s LYS 238 N -1.65 3.23 0.19 0.00 3.01 -0.74 -4.77 119.74 119.01 1bbs s LYS 238 Ca 0.14 -0.29 -0.23 0.00 -1.01 0.00 0.00 55.97 54.58 1bbs s LYS 238 Cb -0.10 -3.00 -0.08 0.00 -1.01 0.00 0.00 37.83 33.64 1bbs s LYS 238 CO 0.05 0.73 0.76 0.15 0.51 0.00 0.00 175.35 177.55 1bbs s LYS 239 N -1.15 4.43 0.00 1.68 -0.14 -1.26 -0.71 119.74 122.59 1bbs s LYS 239 Ca 0.16 1.04 0.00 0.00 -1.36 0.00 0.00 55.97 55.81 1bbs s LYS 239 Cb -0.12 -3.08 0.00 0.00 -1.68 0.00 0.00 37.83 32.95 1bbs s LYS 239 CO 0.06 0.49 0.00 2.89 -0.76 0.00 0.00 175.35 178.03 1bbs n ARG 240 N 1.20 1.96 0.00 1.68 1.85 -0.02 -4.97 116.66 118.36 1bbs n ARG 240 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.81 1bbs n ARG 240 Cb 0.50 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.91 1bbs n ARG 240 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 1bbs n LEU 242 N 0.00 0.00 -3.16 2.89 7.94 -1.26 -3.92 117.00 119.49 1bbs n LEU 242 Ca 0.00 0.40 -0.20 0.00 -1.11 0.00 0.00 56.01 55.10 1bbs n LEU 242 Cb 0.00 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 43.91 1bbs n LEU 242 CO 0.00 0.00 -0.19 0.49 -1.11 0.00 0.00 177.39 176.58 1bbs n PHE 243 N -0.84 0.64 -3.64 1.96 3.72 -1.26 -5.07 117.46 112.97 1bbs n PHE 243 Ca 0.00 -3.82 -0.10 0.00 -0.05 0.00 0.00 57.45 53.48 1bbs n PHE 243 Cb 0.00 -0.42 -0.03 0.00 -0.94 0.00 0.00 39.48 38.08 1bbs n PHE 243 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1bbs s ASP 244 N -2.45 -0.35 0.12 4.37 2.15 -1.25 -5.02 116.67 114.25 1bbs s ASP 244 Ca 0.41 -0.33 0.09 0.00 0.43 0.00 0.00 52.55 53.14 1bbs s ASP 244 Cb 0.32 0.59 -0.04 0.00 -0.30 0.00 0.00 42.92 43.49 1bbs s ASP 244 CO -0.09 -1.03 -0.21 -0.31 -0.17 0.00 0.00 175.17 173.36 1bbs s TYR 245 N -3.83 1.86 0.28 -5.34 2.02 -1.26 -0.84 117.35 110.23 1bbs s TYR 245 Ca 0.06 -0.42 -0.09 0.00 -0.37 0.00 0.00 57.07 56.25 1bbs s TYR 245 Cb -0.01 -0.99 -0.00 0.00 -0.40 0.00 0.00 41.96 40.55 1bbs s TYR 245 CO -0.06 0.26 0.45 0.14 -1.57 0.00 0.00 175.55 174.77 1bbs s VAL 246 N -1.38 0.00 0.04 0.71 -7.23 0.12 -2.07 120.40 110.60 1bbs s VAL 246 Ca 0.10 -1.51 -0.17 0.00 -1.81 0.00 0.00 61.98 58.59 1bbs s VAL 246 Cb -0.09 -2.40 0.03 0.00 0.56 0.00 0.00 36.38 34.49 1bbs s VAL 246 CO 0.05 0.00 0.39 -0.69 -0.31 0.00 0.00 175.10 174.54 1bbs s VAL 247 N -3.67 0.06 -0.17 1.32 1.01 -0.67 -1.79 120.40 116.49 1bbs s VAL 247 Ca 0.26 -0.51 -0.29 0.00 0.00 0.00 0.00 61.98 61.44 1bbs s VAL 247 Cb 0.00 -0.95 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 1bbs s VAL 247 CO 0.13 -0.28 1.44 -1.59 0.00 0.00 0.00 175.10 174.79 1bbs s LYS 248 N -2.50 4.08 0.55 2.72 0.00 -1.26 -1.37 119.74 121.96 1bbs s LYS 248 Ca -0.05 1.72 0.49 0.00 0.00 0.00 0.00 55.97 58.13 1bbs s LYS 248 Cb -0.01 -3.89 1.72 0.00 0.00 0.00 0.00 37.83 35.65 1bbs s LYS 248 CO -0.03 -0.93 1.56 0.00 0.00 0.00 0.00 175.35 175.96 1bbs h ASN 250 N 0.00 -1.52 0.89 0.00 7.08 -1.83 -2.61 115.58 117.58 1bbs h ASN 250 Ca 0.94 0.15 0.00 0.00 -3.08 0.00 0.00 56.30 54.31 1bbs h ASN 250 Cb 3.73 0.55 0.00 0.00 -2.08 0.00 0.00 38.32 40.52 1bbs h ASN 250 CO -0.04 -0.59 -0.20 -1.84 -2.08 0.00 0.00 177.43 172.68 1bbs n GLU 251 N -5.51 0.05 -0.22 4.14 0.28 0.54 -4.45 120.64 115.47 1bbs n GLU 251 Ca -0.09 0.03 -0.11 0.00 -0.16 0.00 0.00 57.16 56.82 1bbs n GLU 251 Cb 0.43 -1.55 -0.09 0.00 1.43 0.00 0.00 31.44 31.66 1bbs n GLU 251 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 1bbs h GLY 252 N 4.91 -1.11 0.20 -1.84 0.00 -0.96 0.41 103.07 104.68 1bbs h GLY 252 Ca 0.00 0.78 0.00 0.00 0.00 0.00 0.00 47.33 48.11 1bbs h GLY 252 CO 0.00 -0.15 0.00 -1.55 0.00 0.00 0.00 176.54 174.84 1bbs n PRO 253 N -5.00 0.00 -0.00 4.80 -0.04 -1.26 -1.42 135.00 132.07 1bbs n PRO 253 Ca -0.01 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.49 1bbs n PRO 253 Cb 0.27 -1.11 -0.05 0.00 -0.04 0.00 0.00 33.50 32.57 1bbs n PRO 253 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1bbs n THR 254 N -0.59 0.00 -0.86 0.52 -1.04 0.14 -5.02 114.28 107.45 1bbs n THR 254 Ca 0.00 -0.25 -0.34 0.00 -2.04 0.00 0.00 64.05 61.43 1bbs n THR 254 Cb 0.00 0.65 0.11 0.00 -1.82 0.00 0.00 70.33 69.27 1bbs n THR 254 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1bbs n LEU 255 N -1.48 -0.90 -4.92 -4.42 4.77 -0.51 -4.98 117.00 104.56 1bbs n LEU 255 Ca -0.00 0.33 -0.27 0.00 -0.03 0.00 0.00 56.01 56.04 1bbs n LEU 255 Cb 0.16 -1.15 0.03 0.00 -2.33 0.00 0.00 43.42 40.13 1bbs n LEU 255 CO 0.15 -3.91 0.54 -2.16 -1.33 0.00 0.00 177.39 170.68 1bbs s PRO 256 N -3.36 2.88 0.33 3.23 0.04 -1.26 -4.70 135.00 132.16 1bbs s PRO 256 Ca 0.55 -0.02 -0.28 0.00 0.04 0.00 0.00 61.00 61.29 1bbs s PRO 256 Cb -0.22 -2.27 -0.10 0.00 0.04 0.00 0.00 34.50 31.96 1bbs s PRO 256 CO 0.69 -0.73 1.18 -0.51 0.04 0.00 0.00 177.00 177.67 1bbs s ASP 257 N -4.32 6.91 -0.16 6.66 1.01 -1.26 -4.56 116.67 120.96 1bbs s ASP 257 Ca 0.54 2.42 -0.04 0.00 0.71 0.00 0.00 52.55 56.17 1bbs s ASP 257 Cb -0.11 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 41.16 1bbs s ASP 257 CO 0.45 -0.41 -0.01 -0.63 0.21 0.00 0.00 175.17 174.78 1bbs s ILE 258 N -1.23 4.15 -0.05 0.77 1.01 0.06 -2.62 121.20 123.29 1bbs s ILE 258 Ca 0.49 -0.27 0.06 0.00 0.00 0.00 0.00 60.65 60.94 1bbs s ILE 258 Cb -0.34 -2.82 -0.01 0.00 0.01 0.00 0.00 42.46 39.30 1bbs s ILE 258 CO 0.44 0.49 -0.25 -0.55 0.00 0.00 0.00 174.94 175.08 1bbs s SER 259 N 0.26 2.99 -0.22 3.58 0.15 -0.47 0.40 113.70 120.40 1bbs s SER 259 Ca -0.01 -0.49 -0.03 0.00 0.70 0.00 0.00 55.95 56.12 1bbs s SER 259 Cb -0.13 -0.75 -0.00 0.00 -1.71 0.00 0.00 66.02 63.42 1bbs s SER 259 CO 0.02 0.25 -0.07 -0.36 1.20 0.00 0.00 173.24 174.28 1bbs s PHE 260 N -0.21 2.94 -0.59 3.44 0.08 0.45 -0.43 117.98 123.66 1bbs s PHE 260 Ca -0.02 -1.08 -0.24 0.00 0.12 0.00 0.00 56.93 55.71 1bbs s PHE 260 Cb -0.13 -2.08 0.04 0.00 -0.57 0.00 0.00 43.02 40.29 1bbs s PHE 260 CO 0.03 -0.60 1.00 -1.01 -0.10 0.00 0.00 175.22 174.54 1bbs s HIS 261 N 1.44 2.71 -0.08 0.36 3.76 -0.82 -0.52 115.29 122.14 1bbs s HIS 261 Ca 0.05 -0.08 0.03 0.00 -0.15 0.00 0.00 55.06 54.92 1bbs s HIS 261 Cb -0.14 -4.20 0.00 0.00 1.11 0.00 0.00 32.58 29.35 1bbs s HIS 261 CO -0.05 -1.49 -0.19 -0.51 -0.85 0.00 0.00 174.74 171.66 1bbs s LEU 262 N 4.21 1.90 -1.34 0.89 1.43 -0.31 -2.55 118.68 122.90 1bbs s LEU 262 Ca 0.30 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.97 1bbs s LEU 262 Cb -0.12 -1.14 0.00 0.00 0.03 0.00 0.00 46.19 44.96 1bbs s LEU 262 CO 0.18 0.12 0.00 0.61 0.23 0.00 0.00 176.35 177.48 1bbs n GLY 263 N 3.56 0.06 0.00 -3.19 0.00 -1.26 -1.63 105.19 102.73 1bbs n GLY 263 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1bbs n GLY 263 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bbs n GLY 264 N -0.69 2.96 3.91 -0.02 0.00 -1.26 -5.03 105.19 105.06 1bbs n GLY 264 Ca -0.17 -0.60 -0.27 0.00 0.00 0.00 0.00 46.02 44.99 1bbs n GLY 264 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bbs s LYS 265 N 0.00 3.41 -0.13 1.61 2.20 -0.64 -5.07 119.74 121.12 1bbs s LYS 265 Ca 0.00 0.15 0.01 0.00 -0.36 0.00 0.00 55.97 55.76 1bbs s LYS 265 Cb 0.00 -2.36 0.02 0.00 -1.51 0.00 0.00 37.83 33.98 1bbs s LYS 265 CO 0.00 -0.30 -0.14 -1.83 -0.36 0.00 0.00 175.35 172.72 1bbs s GLU 266 N -4.79 2.15 -0.56 4.03 -1.05 -1.26 -1.16 118.70 116.06 1bbs s GLU 266 Ca 0.49 -0.51 -0.25 0.00 -0.15 0.00 0.00 54.97 54.54 1bbs s GLU 266 Cb -0.10 -1.95 0.04 0.00 -0.44 0.00 0.00 34.13 31.67 1bbs s GLU 266 CO 0.45 -0.18 1.02 0.71 0.95 0.00 0.00 175.26 178.21 1bbs s TYR 267 N 1.35 2.73 0.17 4.83 2.02 0.32 -4.85 117.35 123.92 1bbs s TYR 267 Ca 0.01 0.12 -0.08 0.00 -0.37 0.00 0.00 57.07 56.75 1bbs s TYR 267 Cb -0.13 -4.21 -0.06 0.00 -0.40 0.00 0.00 41.96 37.15 1bbs s TYR 267 CO -0.07 -1.43 0.45 0.99 -1.57 0.00 0.00 175.55 173.92 1bbs s THR 268 N 4.27 5.05 -0.13 -0.71 2.01 -1.26 -0.41 115.64 124.46 1bbs s THR 268 Ca 0.34 0.29 0.01 0.00 0.31 0.00 0.00 61.69 62.65 1bbs s THR 268 Cb -0.11 -3.63 0.02 0.00 0.01 0.00 0.00 72.50 68.79 1bbs s THR 268 CO 0.21 0.04 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.25 1bbs s LEU 269 N -2.58 1.84 0.90 4.42 1.43 0.16 -4.98 118.68 119.87 1bbs s LEU 269 Ca 0.42 -0.51 -0.12 0.00 -1.03 0.00 0.00 54.13 52.89 1bbs s LEU 269 Cb -0.12 -1.24 0.13 0.00 0.03 0.00 0.00 46.19 44.99 1bbs s LEU 269 CO 0.22 0.01 1.15 -0.89 0.23 0.00 0.00 176.35 177.07 1bbs s THR 270 N 1.12 1.99 -1.78 5.49 2.01 -1.26 -0.76 115.64 122.45 1bbs s THR 270 Ca -0.02 0.00 0.24 0.00 0.31 0.00 0.00 61.69 62.21 1bbs s THR 270 Cb -0.14 -2.80 0.58 0.00 0.01 0.00 0.00 72.50 70.15 1bbs s THR 270 CO -0.05 0.00 1.79 -1.54 -0.69 0.00 0.00 174.62 174.13 1bbs n SER 271 N -3.69 0.00 0.00 3.53 3.41 -1.26 -2.13 113.62 113.47 1bbs n SER 271 Ca 0.07 -0.48 -0.12 0.00 -0.26 0.00 0.00 58.87 58.08 1bbs n SER 271 Cb 0.60 -0.11 -0.14 0.00 -0.26 0.00 0.00 64.21 64.30 1bbs n SER 271 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bbs h ALA 272 N 3.35 0.61 0.00 7.33 0.00 -1.91 -2.80 119.26 125.85 1bbs h ALA 272 Ca 0.00 -1.37 -0.06 0.00 0.00 0.00 0.00 54.91 53.48 1bbs h ALA 272 Cb 0.08 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1bbs h ALA 272 CO 0.00 1.45 -0.27 -0.44 0.00 0.00 0.00 179.25 179.99 1bbs h ASP 273 N 0.02 0.00 0.00 0.00 3.32 -1.79 -3.34 116.42 114.64 1bbs h ASP 273 Ca -0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.76 1bbs h ASP 273 Cb 2.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.55 1bbs h ASP 273 CO 0.10 0.27 0.00 0.00 -1.72 0.00 0.00 179.24 177.89 1bbs n TYR 274 N -3.28 0.00 -4.61 4.55 0.18 -1.18 -4.88 117.16 107.94 1bbs n TYR 274 Ca 0.01 0.00 -0.34 0.00 1.88 0.00 0.00 57.90 59.46 1bbs n TYR 274 Cb 0.54 0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 39.38 1bbs n TYR 274 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 1bbs s VAL 275 N -0.22 3.59 -0.80 -3.48 1.01 -1.05 -1.57 120.40 117.88 1bbs s VAL 275 Ca 0.00 -0.50 -0.23 0.00 0.00 0.00 0.00 61.98 61.25 1bbs s VAL 275 Cb 0.00 -2.50 0.06 0.00 0.00 0.00 0.00 36.38 33.94 1bbs s VAL 275 CO 0.00 0.55 1.18 -0.36 0.00 0.00 0.00 175.10 176.47 1bbs s PHE 276 N -0.24 2.60 -1.36 5.22 0.08 -0.44 -4.81 117.98 119.04 1bbs s PHE 276 Ca 0.03 -0.60 -0.14 0.00 0.12 0.00 0.00 56.93 56.34 1bbs s PHE 276 Cb -0.13 -4.47 0.08 0.00 -0.57 0.00 0.00 43.02 37.93 1bbs s PHE 276 CO 0.03 -1.81 1.95 0.94 -0.10 0.00 0.00 175.22 176.23 1bbs n GLN 277 N 8.24 3.14 -0.20 0.44 -0.06 -1.26 -4.37 117.38 123.31 1bbs n GLN 277 Ca 0.10 -3.08 0.03 0.00 -2.00 0.00 0.00 57.00 52.05 1bbs n GLN 277 Cb 0.48 -3.26 0.11 0.00 -4.06 0.00 0.00 30.24 23.52 1bbs n GLN 277 CO 0.00 0.00 0.00 -0.85 -0.20 0.00 0.00 177.06 176.01 1bbs n GLU 278 N 6.29 1.86 -3.49 3.69 0.28 -1.26 -4.94 120.64 123.07 1bbs n GLU 278 Ca 0.47 -0.89 0.00 0.00 -0.16 0.00 0.00 57.16 56.59 1bbs n GLU 278 Cb 0.41 -1.46 0.00 0.00 1.43 0.00 0.00 31.44 31.82 1bbs n GLU 278 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1bbs n SER 279 N 0.18 0.00 -2.97 -1.84 3.41 -1.26 -5.14 113.62 106.00 1bbs n SER 279 Ca 0.08 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.54 1bbs n SER 279 Cb 0.37 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 1bbs n SER 279 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1bbs n TYR 279 N 4.42 -1.72 0.00 7.33 4.02 -1.26 -4.71 117.16 125.24 1bbs n TYR 279 Ca 0.00 -2.74 0.00 0.00 -0.01 0.00 0.00 57.90 55.15 1bbs n TYR 279 Cb 0.00 0.61 0.00 0.00 -0.02 0.00 0.00 39.34 39.93 1bbs n TYR 279 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1bbs n SER 279 N 1.19 0.36 0.06 7.72 7.64 -1.26 -3.26 113.62 126.08 1bbs n SER 279 Ca 0.15 -0.06 -0.04 0.00 1.01 0.00 0.00 58.87 59.93 1bbs n SER 279 Cb 0.61 0.20 -0.08 0.00 -1.01 0.00 0.00 64.21 63.92 1bbs n SER 279 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1bbs h LYS 279 N 0.00 0.00 -6.21 1.43 6.56 -2.02 -3.47 116.57 112.86 1bbs h LYS 279 Ca 0.00 0.00 -0.64 0.00 -1.06 0.00 0.00 60.65 58.95 1bbs h LYS 279 Cb 0.00 0.00 -0.09 0.00 -0.57 0.00 0.00 32.23 31.57 1bbs h LYS 279 CO 0.00 0.66 -0.61 0.15 -2.06 0.00 0.00 179.45 177.60 1bbs s LYS 280 N -2.78 2.83 -0.07 3.15 1.02 -1.26 -5.12 119.74 117.52 1bbs s LYS 280 Ca -0.00 -0.73 0.01 0.00 0.02 0.00 0.00 55.97 55.27 1bbs s LYS 280 Cb 0.09 -2.69 -0.03 0.00 -0.52 0.00 0.00 37.83 34.67 1bbs s LYS 280 CO 0.80 0.56 -0.08 -0.51 -0.92 0.00 0.00 175.35 175.20 1bbs s LEU 281 N -2.43 3.12 -0.09 3.17 1.02 -1.26 -3.34 118.68 118.87 1bbs s LEU 281 Ca 0.29 -0.04 -0.02 0.00 0.02 0.00 0.00 54.13 54.38 1bbs s LEU 281 Cb -0.12 -1.68 -0.03 0.00 0.02 0.00 0.00 46.19 44.38 1bbs s LEU 281 CO 0.22 0.36 -0.00 0.00 0.02 0.00 0.00 176.35 176.94 1bbs s THR 283 N -0.72 4.47 0.53 0.00 2.01 -1.26 -1.66 115.64 119.00 1bbs s THR 283 Ca 0.11 1.70 -0.06 0.00 0.31 0.00 0.00 61.69 63.75 1bbs s THR 283 Cb -0.12 -4.14 -0.02 0.00 0.01 0.00 0.00 72.50 68.23 1bbs s THR 283 CO 0.02 0.47 0.84 -0.76 -0.69 0.00 0.00 174.62 174.50 1bbs s LEU 284 N -0.81 3.48 -0.57 4.42 1.43 -0.88 -1.32 118.68 124.43 1bbs s LEU 284 Ca 0.37 0.90 0.01 0.00 -1.03 0.00 0.00 54.13 54.38 1bbs s LEU 284 Cb -0.22 -3.82 0.44 0.00 0.03 0.00 0.00 46.19 42.61 1bbs s LEU 284 CO 0.26 -0.75 1.77 0.00 0.23 0.00 0.00 176.35 177.86 1bbs n ALA 285 N -2.40 5.95 -3.72 4.21 0.00 -0.61 -4.77 120.51 119.16 1bbs n ALA 285 Ca 0.02 -3.65 -0.23 0.00 0.00 0.00 0.00 53.44 49.59 1bbs n ALA 285 Cb 0.56 -1.34 -0.18 0.00 0.00 0.00 0.00 19.45 18.49 1bbs n ALA 285 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1bbs s ILE 286 N -4.81 0.21 0.20 0.00 1.01 -1.26 -1.30 121.20 115.26 1bbs s ILE 286 Ca 0.59 0.12 0.10 0.00 0.00 0.00 0.00 60.65 61.47 1bbs s ILE 286 Cb 0.47 -0.47 -0.04 0.00 0.01 0.00 0.00 42.46 42.43 1bbs s ILE 286 CO -0.03 0.15 -0.14 -1.00 0.00 0.00 0.00 174.94 173.91 1bbs s HIS 287 N 2.03 2.50 -0.27 3.97 3.76 -0.27 -4.71 115.29 122.30 1bbs s HIS 287 Ca 0.04 -0.28 -0.13 0.00 -0.15 0.00 0.00 55.06 54.54 1bbs s HIS 287 Cb -0.13 -1.20 -0.04 0.00 1.11 0.00 0.00 32.58 32.31 1bbs s HIS 287 CO -0.05 0.54 0.30 0.00 -0.85 0.00 0.00 174.74 174.68 1bbs s ALA 288 N -1.82 3.55 -0.15 -1.40 0.00 -1.26 -1.98 121.76 118.70 1bbs s ALA 288 Ca 0.25 -0.91 -0.06 0.00 0.00 0.00 0.00 51.96 51.24 1bbs s ALA 288 Cb -0.08 -2.62 0.07 0.00 0.00 0.00 0.00 23.12 20.50 1bbs s ALA 288 CO 0.14 -0.60 0.32 1.41 0.00 0.00 0.00 175.76 177.02 1bbs s MET 289 N 1.92 0.21 -0.45 0.00 0.00 0.79 -4.84 119.30 116.94 1bbs s MET 289 Ca 0.12 0.85 -0.22 0.00 0.00 0.00 0.00 55.69 56.43 1bbs s MET 289 Cb -0.16 0.09 0.03 0.00 0.00 0.00 0.00 34.83 34.79 1bbs s MET 289 CO 0.10 -0.27 0.73 -0.51 0.00 0.00 0.00 175.02 175.08 1bbs s ASP 290 N 2.44 6.37 -0.48 1.11 1.01 -1.26 -4.15 116.67 121.72 1bbs s ASP 290 Ca -0.00 -0.21 -0.18 0.00 0.71 0.00 0.00 52.55 52.87 1bbs s ASP 290 Cb -0.12 -2.36 0.06 0.00 1.01 0.00 0.00 42.92 41.51 1bbs s ASP 290 CO -0.10 -0.87 0.51 -0.63 0.21 0.00 0.00 175.17 174.29 1bbs s ILE 291 N 3.11 5.04 0.57 0.77 1.01 -1.26 -5.08 121.20 125.36 1bbs s ILE 291 Ca 0.27 -0.66 -0.17 0.00 0.00 0.00 0.00 60.65 60.08 1bbs s ILE 291 Cb -0.13 -4.19 -0.05 0.00 0.01 0.00 0.00 42.46 38.10 1bbs s ILE 291 CO 0.21 -0.66 1.07 -2.16 0.00 0.00 0.00 174.94 173.40 1bbs s PRO 292 N 2.20 3.39 1.20 2.79 0.05 -1.26 -3.35 135.00 140.01 1bbs s PRO 292 Ca 0.11 1.33 -0.17 0.00 0.05 0.00 0.00 61.00 62.31 1bbs s PRO 292 Cb -0.21 -2.03 0.23 0.00 0.05 0.00 0.00 34.50 32.54 1bbs s PRO 292 CO 0.10 -0.77 0.50 -2.30 0.05 0.00 0.00 177.00 174.59 1bbs n PRO 293 N -1.69 -2.64 0.22 0.56 -0.02 -1.17 -1.88 135.00 128.38 1bbs n PRO 293 Ca 0.09 -0.76 0.09 0.00 -2.02 0.00 0.00 63.50 60.91 1bbs n PRO 293 Cb 0.52 -1.84 0.44 0.00 -0.02 0.00 0.00 33.50 32.60 1bbs n PRO 293 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1bbs h PRO 294 N -2.67 0.00 0.58 0.52 0.11 -2.03 -3.42 132.00 125.10 1bbs h PRO 294 Ca -0.50 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 1bbs h PRO 294 Cb 1.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 1bbs h PRO 294 CO 0.36 0.25 -0.43 1.15 -0.21 0.00 0.00 178.00 179.11 1bbs h THR 295 N 0.00 0.13 -2.99 -1.15 2.02 -1.92 -3.43 112.91 105.57 1bbs h THR 295 Ca -0.00 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.12 1bbs h THR 295 Cb 0.77 0.13 0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1bbs h THR 295 CO 0.03 0.00 0.03 0.61 0.37 0.00 0.00 175.52 176.56 1bbs n GLY 296 N -1.55 -0.03 3.77 2.16 0.00 -0.79 -4.55 105.19 104.20 1bbs n GLY 296 Ca -0.12 -1.85 -0.39 0.00 0.00 0.00 0.00 46.02 43.66 1bbs n GLY 296 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1bbs s PRO 297 N -2.97 4.23 0.04 1.61 0.02 -1.21 -3.06 135.00 133.66 1bbs s PRO 297 Ca 0.08 1.95 -0.14 0.00 0.02 0.00 0.00 61.00 62.92 1bbs s PRO 297 Cb -0.00 -2.88 0.02 0.00 0.02 0.00 0.00 34.50 31.66 1bbs s PRO 297 CO 0.06 -0.20 0.30 0.99 -0.33 0.00 0.00 177.00 177.82 1bbs s THR 298 N -1.29 0.08 0.32 0.99 2.01 -1.26 -4.68 115.64 111.81 1bbs s THR 298 Ca 0.53 -0.66 -0.12 0.00 0.31 0.00 0.00 61.69 61.74 1bbs s THR 298 Cb -0.34 -0.90 -0.08 0.00 0.01 0.00 0.00 72.50 71.19 1bbs s THR 298 CO 0.43 -0.37 0.70 0.26 -0.69 0.00 0.00 174.62 174.96 1bbs s TRP 299 N -2.41 3.41 -0.24 4.92 0.52 -0.86 -4.48 118.94 119.79 1bbs s TRP 299 Ca -0.06 1.08 0.02 0.00 0.02 0.00 0.00 56.10 57.17 1bbs s TRP 299 Cb -0.01 -2.44 0.06 0.00 -1.15 0.00 0.00 33.47 29.92 1bbs s TRP 299 CO -0.02 0.09 -0.11 0.00 0.02 0.00 0.00 176.95 176.92 1bbs s ALA 300 N -2.04 2.42 -0.50 0.98 0.00 0.17 -0.73 121.76 122.05 1bbs s ALA 300 Ca 0.52 -1.62 -0.22 0.00 0.00 0.00 0.00 51.96 50.63 1bbs s ALA 300 Cb -0.10 -1.51 0.04 0.00 0.00 0.00 0.00 23.12 21.55 1bbs s ALA 300 CO 0.22 -1.10 0.79 -0.51 0.00 0.00 0.00 175.76 175.16 1bbs s LEU 301 N 1.18 4.38 0.00 0.00 1.43 0.14 -1.75 118.68 124.06 1bbs s LEU 301 Ca -0.07 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.64 1bbs s LEU 301 Cb -0.19 -2.78 0.00 0.00 0.03 0.00 0.00 46.19 43.25 1bbs s LEU 301 CO -0.06 -1.01 0.00 0.61 0.23 0.00 0.00 176.35 176.12 1bbs n GLY 302 N 5.08 3.91 0.24 -3.19 0.00 -1.22 -0.60 105.19 109.41 1bbs n GLY 302 Ca -0.00 -1.75 -0.05 0.00 0.00 0.00 0.00 46.02 44.22 1bbs n GLY 302 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bbs n ALA 303 N -3.00 -0.30 -0.31 4.61 0.00 0.92 -1.78 120.51 120.66 1bbs n ALA 303 Ca 0.00 0.53 0.08 0.00 0.00 0.00 0.00 53.44 54.06 1bbs n ALA 303 Cb 0.00 -0.13 0.25 0.00 0.00 0.00 0.00 19.45 19.56 1bbs n ALA 303 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1bbs h THR 304 N 0.00 0.72 0.00 0.00 2.02 -1.83 -2.73 112.91 111.09 1bbs h THR 304 Ca 0.13 -0.22 -0.04 0.00 0.77 0.00 0.00 66.41 67.05 1bbs h THR 304 Cb 0.28 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.69 1bbs h THR 304 CO -0.57 0.12 -0.25 0.15 0.37 0.00 0.00 175.52 175.34 1bbs h PHE 305 N 0.64 0.00 0.00 3.16 3.04 -1.75 -3.36 116.94 118.67 1bbs h PHE 305 Ca 0.49 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.44 1bbs h PHE 305 Cb 0.71 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.22 1bbs h PHE 305 CO -0.08 0.73 0.06 0.82 -2.02 0.00 0.00 178.31 177.82 1bbs h ILE 306 N -1.00 0.00 -0.05 1.41 2.04 -1.28 -1.34 117.51 117.28 1bbs h ILE 306 Ca -0.06 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.66 1bbs h ILE 306 Cb 0.74 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 1bbs h ILE 306 CO -0.03 0.00 -0.62 0.03 0.00 0.00 0.00 178.15 177.53 1bbs h ARG 307 N 0.00 0.20 0.03 2.37 3.08 -1.64 -3.28 114.38 115.14 1bbs h ARG 307 Ca 0.00 -0.14 -0.31 0.00 0.07 0.00 0.00 59.98 59.60 1bbs h ARG 307 Cb 0.11 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.14 1bbs h ARG 307 CO 0.00 0.75 -1.83 1.17 -1.07 0.00 0.00 179.97 179.00 1bbs n LYS 308 N -3.85 0.66 -4.00 0.04 4.81 -0.55 -4.74 118.16 110.54 1bbs n LYS 308 Ca -0.02 0.27 -0.31 0.00 -0.87 0.00 0.00 58.31 57.38 1bbs n LYS 308 Cb 0.63 -1.75 -0.15 0.00 0.02 0.00 0.00 35.03 33.77 1bbs n LYS 308 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 1bbs s PHE 309 N -2.58 2.94 0.23 5.64 0.08 -0.96 -0.58 117.98 122.74 1bbs s PHE 309 Ca -0.09 -2.17 -0.31 0.00 0.12 0.00 0.00 56.93 54.48 1bbs s PHE 309 Cb 0.08 -1.91 -0.14 0.00 -0.57 0.00 0.00 43.02 40.48 1bbs s PHE 309 CO 0.81 -0.85 1.19 0.98 -0.10 0.00 0.00 175.22 177.26 1bbs n TYR 310 N 4.52 1.58 -5.22 0.36 9.36 0.17 -4.54 117.16 123.38 1bbs n TYR 310 Ca -0.11 0.61 -0.31 0.00 3.32 0.00 0.00 57.90 61.41 1bbs n TYR 310 Cb 0.43 -2.33 -0.17 0.00 -0.63 0.00 0.00 39.34 36.64 1bbs n TYR 310 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 1bbs s THR 311 N -0.45 2.02 -0.16 2.97 2.01 -0.95 -2.19 115.64 118.89 1bbs s THR 311 Ca 0.67 -1.02 -0.01 0.00 0.31 0.00 0.00 61.69 61.63 1bbs s THR 311 Cb -0.74 -1.73 -0.01 0.00 0.01 0.00 0.00 72.50 70.03 1bbs s THR 311 CO 0.54 0.56 -0.10 -0.70 -0.69 0.00 0.00 174.62 174.22 1bbs s GLU 312 N 0.09 3.38 -0.73 4.92 2.12 -0.37 -0.88 118.70 127.23 1bbs s GLU 312 Ca -0.11 -0.66 -0.14 0.00 0.36 0.00 0.00 54.97 54.42 1bbs s GLU 312 Cb -0.16 -2.75 0.19 0.00 0.26 0.00 0.00 34.13 31.67 1bbs s GLU 312 CO 0.06 0.08 0.67 -0.06 -0.54 0.00 0.00 175.26 175.46 1bbs s PHE 313 N 0.72 3.60 -0.07 5.30 0.40 0.90 -1.35 117.98 127.47 1bbs s PHE 313 Ca -0.05 -1.84 -0.30 0.00 -0.60 0.00 0.00 56.93 54.15 1bbs s PHE 313 Cb -0.15 -3.77 -0.05 0.00 0.51 0.00 0.00 43.02 39.56 1bbs s PHE 313 CO 0.02 -0.99 1.61 0.34 0.70 0.00 0.00 175.22 176.90 1bbs s ASP 314 N 2.49 6.68 0.00 1.36 -1.08 -0.15 -3.36 116.67 122.62 1bbs s ASP 314 Ca 0.13 2.15 0.15 0.00 -0.52 0.00 0.00 52.55 54.47 1bbs s ASP 314 Cb -0.17 -2.53 -0.04 0.00 -1.46 0.00 0.00 42.92 38.72 1bbs s ASP 314 CO -0.05 -0.92 0.77 0.54 0.52 0.00 0.00 175.17 176.03 1bbs n ARG 315 N 7.10 1.86 0.02 4.34 1.74 -0.28 -2.61 116.66 128.83 1bbs n ARG 315 Ca 0.17 -0.59 -0.22 0.00 -0.77 0.00 0.00 57.85 56.44 1bbs n ARG 315 Cb 0.43 -1.23 -0.14 0.00 -1.02 0.00 0.00 32.46 30.50 1bbs n ARG 315 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1bbs h ARG 316 N 1.28 0.28 -0.09 5.56 2.43 -1.87 -3.35 114.38 118.62 1bbs h ARG 316 Ca 0.00 -0.47 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 1bbs h ARG 316 Cb 0.47 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1bbs h ARG 316 CO 0.00 1.23 0.00 0.09 -1.51 0.00 0.00 179.97 179.78 1bbs n ASN 317 N -3.87 2.53 -3.75 -3.80 3.02 -1.26 -4.99 115.26 103.14 1bbs n ASN 317 Ca -0.24 -1.83 -0.24 0.00 -0.03 0.00 0.00 54.58 52.24 1bbs n ASN 317 Cb 0.93 -0.04 0.03 0.00 -0.61 0.00 0.00 39.78 40.09 1bbs n ASN 317 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1bbs n ASN 318 N 0.95 -2.36 -4.08 6.41 3.02 -1.17 -4.88 115.26 113.15 1bbs n ASN 318 Ca 0.16 -0.79 -0.14 0.00 -0.03 0.00 0.00 54.58 53.78 1bbs n ASN 318 Cb 0.51 -4.08 -0.10 0.00 -0.61 0.00 0.00 39.78 35.50 1bbs n ASN 318 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1bbs s ARG 319 N -6.15 1.32 -0.09 3.52 1.70 -1.07 -2.46 118.95 115.72 1bbs s ARG 319 Ca 0.20 -1.71 0.02 0.00 -0.47 0.00 0.00 55.73 53.77 1bbs s ARG 319 Cb -0.10 0.22 -0.02 0.00 -0.57 0.00 0.00 34.95 34.48 1bbs s ARG 319 CO 0.81 -0.42 -0.14 0.42 -1.08 0.00 0.00 175.30 174.88 1bbs s ILE 320 N -3.99 2.99 -0.05 4.99 1.01 -0.73 -0.98 121.20 124.44 1bbs s ILE 320 Ca 0.39 -0.71 0.04 0.00 0.00 0.00 0.00 60.65 60.37 1bbs s ILE 320 Cb 0.06 -2.21 -0.00 0.00 0.01 0.00 0.00 42.46 40.32 1bbs s ILE 320 CO 0.15 0.56 -0.18 -0.83 0.00 0.00 0.00 174.94 174.63 1bbs s GLY 321 N -0.16 0.98 0.10 6.18 0.00 -0.46 -0.28 107.32 113.68 1bbs s GLY 321 Ca -0.01 -0.73 0.07 0.00 0.00 0.00 0.00 44.72 44.05 1bbs s GLY 321 CO 0.03 -0.36 -0.08 -1.36 0.00 0.00 0.00 173.10 171.33 1bbs s PHE 322 N 0.06 2.78 -0.01 1.90 0.08 -0.89 -1.23 117.98 120.68 1bbs s PHE 322 Ca -0.05 -0.13 -0.23 0.00 0.12 0.00 0.00 56.93 56.63 1bbs s PHE 322 Cb -0.12 -1.45 0.05 0.00 -0.57 0.00 0.00 43.02 40.93 1bbs s PHE 322 CO 0.03 0.44 0.52 0.00 -0.10 0.00 0.00 175.22 176.11 1bbs s ALA 323 N -1.24 -1.34 0.19 5.36 0.00 -0.93 -2.39 121.76 121.41 1bbs s ALA 323 Ca 0.22 0.78 -0.32 0.00 0.00 0.00 0.00 51.96 52.64 1bbs s ALA 323 Cb -0.11 0.16 -0.15 0.00 0.00 0.00 0.00 23.12 23.01 1bbs s ALA 323 CO 0.15 -0.39 1.19 1.28 0.00 0.00 0.00 175.76 177.99 1bbs n LEU 324 N 0.82 1.76 -4.94 0.00 4.77 -1.24 0.42 117.00 118.59 1bbs n LEU 324 Ca -0.19 1.14 -0.24 0.00 -0.03 0.00 0.00 56.01 56.69 1bbs n LEU 324 Cb 0.58 -1.25 0.03 0.00 -2.33 0.00 0.00 43.42 40.45 1bbs n LEU 324 CO 0.22 -1.19 0.42 0.00 -1.33 0.00 0.00 177.39 175.51 1bbs s ALA 325 N -0.22 3.55 0.00 -1.18 0.00 0.25 -0.77 121.76 123.39 1bbs s ALA 325 Ca 0.72 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 51.71 1bbs s ALA 325 Cb -0.81 -2.34 0.00 0.00 0.00 0.00 0.00 23.12 19.96 1bbs s ALA 325 CO 0.52 -0.70 0.36 0.54 0.00 0.00 0.00 175.76 176.48