#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bpa s PHE 2 N 0.00 3.13 -0.02 2.03 0.08 -1.26 -5.00 117.98 116.94 2bpa s PHE 2 Ca 0.00 1.44 -0.18 0.00 0.12 0.00 0.00 56.93 58.31 2bpa s PHE 2 Cb 0.00 -2.90 -0.05 0.00 -0.57 0.00 0.00 43.02 39.49 2bpa s PHE 2 CO 0.00 -1.11 0.51 -1.14 -0.10 0.00 0.00 175.22 173.38 2bpa s GLN 3 N -4.71 4.19 0.04 0.44 2.00 -1.26 -5.03 119.66 115.33 2bpa s GLN 3 Ca 0.59 0.57 -0.30 0.00 -2.00 0.00 0.00 55.36 54.22 2bpa s GLN 3 Cb -0.14 -3.31 -0.07 0.00 0.80 0.00 0.00 33.01 30.29 2bpa s GLN 3 CO 0.48 0.45 1.51 0.99 -0.50 0.00 0.00 175.29 178.23 2bpa s THR 4 N -0.40 3.39 -0.14 -0.34 2.01 -1.26 -4.91 115.64 114.00 2bpa s THR 4 Ca 0.27 0.82 0.18 0.00 0.31 0.00 0.00 61.69 63.28 2bpa s THR 4 Cb -0.17 -3.53 0.33 0.00 0.01 0.00 0.00 72.50 69.14 2bpa s THR 4 CO 0.15 0.00 1.20 0.49 -0.69 0.00 0.00 174.62 175.77 2bpa n PHE 5 N 5.40 0.18 -4.98 4.92 3.72 -1.26 -5.00 117.46 120.44 2bpa n PHE 5 Ca 0.14 -0.97 -0.28 0.00 -0.05 0.00 0.00 57.45 56.29 2bpa n PHE 5 Cb 0.42 -0.18 -0.16 0.00 -0.94 0.00 0.00 39.48 38.62 2bpa n PHE 5 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2bpa s ILE 6 N -2.83 1.65 0.07 4.37 1.09 -1.26 -5.11 121.20 119.18 2bpa s ILE 6 Ca 0.33 -0.83 0.02 0.00 -1.10 0.00 0.00 60.65 59.08 2bpa s ILE 6 Cb 0.29 -1.42 -0.03 0.00 -1.06 0.00 0.00 42.46 40.24 2bpa s ILE 6 CO 0.04 0.47 -0.07 -0.55 -0.10 0.00 0.00 174.94 174.73 2bpa s SER 7 N 0.09 0.98 0.15 3.58 0.15 -1.26 -5.01 113.70 112.38 2bpa s SER 7 Ca -0.07 -0.74 0.24 0.00 0.70 0.00 0.00 55.95 56.08 2bpa s SER 7 Cb -0.13 0.06 0.34 0.00 -1.71 0.00 0.00 66.02 64.57 2bpa s SER 7 CO 0.04 -0.31 1.33 0.03 1.20 0.00 0.00 173.24 175.53 2bpa h ARG 8 N 3.86 0.00 -3.03 5.44 3.08 -1.96 -3.45 114.38 118.33 2bpa h ARG 8 Ca -0.36 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.44 2bpa h ARG 8 Cb 1.19 0.00 -0.34 0.00 0.08 0.00 0.00 29.97 30.90 2bpa h ARG 8 CO 0.51 0.00 -0.58 -1.58 -1.07 0.00 0.00 179.97 177.24 2bpa s HIS 9 N -3.19 -0.27 -0.39 3.04 2.46 -1.26 -4.36 115.29 111.32 2bpa s HIS 9 Ca 0.06 0.73 -0.05 0.00 0.47 0.00 0.00 55.06 56.26 2bpa s HIS 9 Cb 0.12 -0.14 0.08 0.00 -0.13 0.00 0.00 32.58 32.52 2bpa s HIS 9 CO 0.72 -0.28 0.19 -0.80 -2.47 0.00 0.00 174.74 172.09 2bpa s ASN 10 N 2.11 5.34 0.54 9.88 0.02 -1.26 -5.03 114.94 126.54 2bpa s ASN 10 Ca -0.00 -1.66 -0.19 0.00 -1.02 0.00 0.00 52.86 49.99 2bpa s ASN 10 Cb -0.12 -1.87 -0.06 0.00 0.02 0.00 0.00 41.25 39.22 2bpa s ASN 10 CO -0.07 -0.48 1.11 -0.44 0.02 0.00 0.00 177.10 177.23 2bpa s SER 11 N 1.83 5.81 0.41 -1.22 0.01 -1.26 -4.85 113.70 114.44 2bpa s SER 11 Ca 0.03 2.10 -0.26 0.00 1.31 0.00 0.00 55.95 59.14 2bpa s SER 11 Cb -0.22 -2.57 -0.09 0.00 0.21 0.00 0.00 66.02 63.35 2bpa s SER 11 CO -0.01 -1.15 1.31 0.21 0.41 0.00 0.00 173.24 174.00 2bpa s ASN 12 N -1.90 6.26 0.59 2.44 3.04 -1.26 -4.93 114.94 119.18 2bpa s ASN 12 Ca 0.71 2.66 0.29 0.00 0.04 0.00 0.00 52.86 56.56 2bpa s ASN 12 Cb -0.22 -2.64 1.69 0.00 -1.54 0.00 0.00 41.25 38.54 2bpa s ASN 12 CO 0.27 -0.89 2.13 -0.26 -3.04 0.00 0.00 177.10 175.31 2bpa h PHE 13 N 2.61 0.00 -3.98 0.43 0.04 -2.00 -3.41 116.94 110.64 2bpa h PHE 13 Ca -0.50 0.00 -0.69 0.00 2.80 0.00 0.00 57.97 59.59 2bpa h PHE 13 Cb 1.25 0.00 -0.30 0.00 2.20 0.00 0.00 35.95 39.10 2bpa h PHE 13 CO 0.53 0.00 -0.86 -0.06 -0.60 0.00 0.00 178.31 177.32 2bpa s PHE 14 N -4.64 2.51 0.24 -0.55 0.40 -1.26 -5.14 117.98 109.54 2bpa s PHE 14 Ca -0.05 -0.62 0.09 0.00 -0.60 0.00 0.00 56.93 55.75 2bpa s PHE 14 Cb 0.15 -1.62 -0.04 0.00 0.51 0.00 0.00 43.02 42.02 2bpa s PHE 14 CO 0.55 -0.15 0.01 -1.54 0.70 0.00 0.00 175.22 174.79 2bpa s SER 15 N -0.22 4.66 0.03 1.36 1.04 -1.26 -4.35 113.70 114.96 2bpa s SER 15 Ca -0.01 -0.55 0.08 0.00 0.48 0.00 0.00 55.95 55.95 2bpa s SER 15 Cb -0.13 -0.92 -0.03 0.00 0.10 0.00 0.00 66.02 65.04 2bpa s SER 15 CO 0.03 0.03 -0.24 -1.81 0.98 0.00 0.00 173.24 172.23 2bpa s ASP 16 N -3.45 2.85 0.28 7.02 1.01 0.30 -4.97 116.67 119.71 2bpa s ASP 16 Ca 0.30 -0.53 -0.28 0.00 0.71 0.00 0.00 52.55 52.75 2bpa s ASP 16 Cb -0.07 -0.26 -0.09 0.00 1.01 0.00 0.00 42.92 43.50 2bpa s ASP 16 CO 0.20 0.23 0.93 -0.54 0.21 0.00 0.00 175.17 176.20 2bpa s LYS 17 N -1.08 4.70 -0.13 8.23 3.01 -1.26 -1.06 119.74 132.15 2bpa s LYS 17 Ca 0.10 1.39 -0.29 0.00 -1.01 0.00 0.00 55.97 56.15 2bpa s LYS 17 Cb -0.09 -3.03 -0.02 0.00 -1.01 0.00 0.00 37.83 33.68 2bpa s LYS 17 CO 0.01 0.40 1.26 -1.17 0.51 0.00 0.00 175.35 176.36 2bpa s LEU 18 N -1.64 4.21 0.40 3.17 2.96 -0.60 -4.87 118.68 122.32 2bpa s LEU 18 Ca 0.46 1.75 0.24 0.00 -0.22 0.00 0.00 54.13 56.35 2bpa s LEU 18 Cb -0.22 -3.54 0.45 0.00 0.50 0.00 0.00 46.19 43.38 2bpa s LEU 18 CO 0.27 -0.71 1.65 1.62 -1.32 0.00 0.00 176.35 177.86 2bpa h VAL 19 N 5.34 0.00 -4.15 1.68 3.04 -1.91 -3.46 116.25 116.78 2bpa h VAL 19 Ca -0.29 -0.89 -0.49 0.00 -1.01 0.00 0.00 66.70 64.02 2bpa h VAL 19 Cb 1.12 1.89 0.14 0.00 -2.01 0.00 0.00 31.29 32.43 2bpa h VAL 19 CO 0.94 0.00 0.27 -0.22 -1.01 0.00 0.00 177.57 177.56 2bpa s LEU 20 N -5.90 2.48 0.00 3.16 2.96 -1.26 -5.03 118.68 115.08 2bpa s LEU 20 Ca 0.07 1.55 0.00 0.00 -0.22 0.00 0.00 54.13 55.54 2bpa s LEU 20 Cb 0.06 -4.06 0.00 0.00 0.50 0.00 0.00 46.19 42.70 2bpa s LEU 20 CO 0.65 -2.43 0.03 0.35 -1.32 0.00 0.00 176.35 173.63 2bpa n THR 21 N -3.75 0.00 -3.67 3.68 -2.24 -1.26 -4.95 114.28 102.08 2bpa n THR 21 Ca 0.07 -0.09 -0.14 0.00 -2.27 0.00 0.00 64.05 61.63 2bpa n THR 21 Cb 0.55 1.30 -0.07 0.00 -2.10 0.00 0.00 70.33 70.01 2bpa n THR 21 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2bpa s SER 22 N -0.11 -0.31 0.02 3.42 1.04 -1.25 -0.33 113.70 116.17 2bpa s SER 22 Ca 0.00 0.12 0.01 0.00 0.48 0.00 0.00 55.95 56.56 2bpa s SER 22 Cb 0.00 0.40 -0.01 0.00 0.10 0.00 0.00 66.02 66.51 2bpa s SER 22 CO 0.00 -0.59 -0.03 -0.69 0.98 0.00 0.00 173.24 172.91 2bpa s VAL 23 N -1.95 0.18 -0.27 5.02 1.01 0.24 -4.88 120.40 119.75 2bpa s VAL 23 Ca -0.09 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.32 2bpa s VAL 23 Cb -0.02 -0.25 0.07 0.00 0.00 0.00 0.00 36.38 36.18 2bpa s VAL 23 CO 0.01 -0.27 -0.03 0.28 0.00 0.00 0.00 175.10 175.09 2bpa s THR 24 N -0.87 1.79 0.47 3.92 -1.32 -1.26 0.67 115.64 119.03 2bpa s THR 24 Ca -0.08 -1.58 -0.22 0.00 -1.21 0.00 0.00 61.69 58.60 2bpa s THR 24 Cb -0.06 -2.10 -0.10 0.00 -1.51 0.00 0.00 72.50 68.73 2bpa s THR 24 CO -0.00 -0.24 0.75 -2.65 -2.21 0.00 0.00 174.62 170.27 2bpa n PRO 25 N 4.54 0.87 -3.77 7.08 -0.02 -1.26 -4.77 135.00 137.67 2bpa n PRO 25 Ca -0.08 0.32 -0.06 0.00 -2.02 0.00 0.00 63.50 61.66 2bpa n PRO 25 Cb 0.43 -1.80 -0.02 0.00 -0.02 0.00 0.00 33.50 32.09 2bpa n PRO 25 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bpa s ALA 26 N -1.45 -1.47 0.23 3.55 0.00 -1.07 -3.89 121.76 117.66 2bpa s ALA 26 Ca 0.66 -0.01 -0.08 0.00 0.00 0.00 0.00 51.96 52.54 2bpa s ALA 26 Cb -0.54 0.73 0.21 0.00 0.00 0.00 0.00 23.12 23.52 2bpa s ALA 26 CO 0.56 -1.01 1.88 0.77 0.00 0.00 0.00 175.76 177.96 2bpa h SER 27 N 2.00 1.07 -1.19 0.00 0.02 -1.86 0.10 113.55 113.69 2bpa h SER 27 Ca -0.22 -0.06 -0.75 0.00 -0.84 0.00 0.00 61.79 59.92 2bpa h SER 27 Cb 1.24 -0.27 -0.13 0.00 0.14 0.00 0.00 62.40 63.38 2bpa h SER 27 CO 0.25 0.81 2.32 -1.20 -1.14 0.00 0.00 176.83 177.87 2bpa n SER 28 N -4.41 6.70 -4.47 3.07 7.64 -1.26 -4.80 113.62 116.09 2bpa n SER 28 Ca 0.10 -3.10 -0.59 0.00 1.01 0.00 0.00 58.87 56.29 2bpa n SER 28 Cb 0.05 -1.43 -0.10 0.00 -1.01 0.00 0.00 64.21 61.73 2bpa n SER 28 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2bpa n ALA 29 N 2.81 0.05 -1.77 -0.43 0.00 -0.80 -4.30 120.51 116.07 2bpa n ALA 29 Ca 0.53 0.23 -0.40 0.00 0.00 0.00 0.00 53.44 53.80 2bpa n ALA 29 Cb 0.30 -2.18 -0.00 0.00 0.00 0.00 0.00 19.45 17.56 2bpa n ALA 29 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2bpa s PRO 30 N 5.05 3.98 -0.41 0.00 0.04 -1.25 0.15 135.00 142.56 2bpa s PRO 30 Ca 1.11 2.27 -0.26 0.00 0.04 0.00 0.00 61.00 64.16 2bpa s PRO 30 Cb -1.28 -2.81 0.02 0.00 0.04 0.00 0.00 34.50 30.48 2bpa s PRO 30 CO 0.65 -0.52 0.97 0.08 0.04 0.00 0.00 177.00 178.22 2bpa s VAL 31 N -1.21 4.49 0.27 -0.36 1.01 0.29 -2.44 120.40 122.45 2bpa s VAL 31 Ca 0.56 1.10 0.00 0.00 0.00 0.00 0.00 61.98 63.65 2bpa s VAL 31 Cb -0.41 -4.41 0.26 0.00 0.00 0.00 0.00 36.38 31.82 2bpa s VAL 31 CO 0.53 -0.69 1.75 -0.07 0.00 0.00 0.00 175.10 176.62 2bpa h LEU 32 N 10.40 0.53 -7.73 3.92 3.38 -1.25 -3.44 115.31 121.12 2bpa h LEU 32 Ca -0.23 0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.70 2bpa h LEU 32 Cb 1.07 0.02 -0.20 0.00 0.09 0.00 0.00 40.66 41.64 2bpa h LEU 32 CO 1.02 0.20 -0.47 -1.58 0.09 0.00 0.00 178.44 177.70 2bpa s GLN 33 N -5.95 0.51 0.21 1.13 0.74 -1.26 -4.77 119.66 110.27 2bpa s GLN 33 Ca -0.12 -0.39 -0.32 0.00 0.05 0.00 0.00 55.36 54.58 2bpa s GLN 33 Cb 0.23 0.21 -0.13 0.00 1.10 0.00 0.00 33.01 34.42 2bpa s GLN 33 CO 0.78 -0.12 1.58 0.25 -0.55 0.00 0.00 175.29 177.23 2bpa n THR 34 N 1.40 0.39 -1.82 -0.34 -2.24 -1.26 -4.75 114.28 105.67 2bpa n THR 34 Ca -0.23 -0.10 -0.39 0.00 -2.27 0.00 0.00 64.05 61.07 2bpa n THR 34 Cb 0.56 -1.72 0.03 0.00 -2.10 0.00 0.00 70.33 67.09 2bpa n THR 34 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2bpa s PRO 35 N 0.43 3.46 0.52 -0.78 0.02 -1.26 -5.05 135.00 132.34 2bpa s PRO 35 Ca 0.73 2.31 0.09 0.00 0.02 0.00 0.00 61.00 64.15 2bpa s PRO 35 Cb -0.59 -2.48 0.06 0.00 0.02 0.00 0.00 34.50 31.50 2bpa s PRO 35 CO 0.41 -0.96 0.68 0.15 -0.33 0.00 0.00 177.00 176.95 2bpa s LYS 36 N -2.65 2.47 -0.18 5.54 1.02 -1.26 -4.83 119.74 119.85 2bpa s LYS 36 Ca 0.65 -1.54 -0.24 0.00 0.02 0.00 0.00 55.97 54.86 2bpa s LYS 36 Cb -0.42 -2.63 -0.21 0.00 -0.52 0.00 0.00 37.83 34.05 2bpa s LYS 36 CO 0.52 -0.63 0.40 0.00 -0.92 0.00 0.00 175.35 174.71 2bpa h ALA 37 N 0.40 0.18 0.00 5.17 0.00 -1.95 1.32 119.26 124.38 2bpa h ALA 37 Ca -0.34 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 53.59 2bpa h ALA 37 Cb 1.29 0.50 0.00 0.00 0.00 0.00 0.00 17.79 19.58 2bpa h ALA 37 CO 0.44 0.48 -0.90 2.41 0.00 0.00 0.00 179.25 181.68 2bpa n THR 38 N -4.48 0.00 -3.62 0.00 -1.04 -1.25 -2.87 114.28 101.02 2bpa n THR 38 Ca -0.25 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.64 2bpa n THR 38 Cb 0.62 -0.13 -0.07 0.00 -1.82 0.00 0.00 70.33 68.93 2bpa n THR 38 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2bpa s SER 39 N -2.23 -0.59 -0.19 8.00 0.15 -1.26 -0.37 113.70 117.20 2bpa s SER 39 Ca 0.00 1.09 -0.24 0.00 0.70 0.00 0.00 55.95 57.50 2bpa s SER 39 Cb 0.00 1.08 0.06 0.00 -1.71 0.00 0.00 66.02 65.45 2bpa s SER 39 CO 0.00 -0.24 0.63 -0.94 1.20 0.00 0.00 173.24 173.89 2bpa s SER 40 N 0.11 -0.64 -0.20 5.45 1.04 -0.80 -4.97 113.70 113.69 2bpa s SER 40 Ca 0.00 1.11 0.01 0.00 0.48 0.00 0.00 55.95 57.55 2bpa s SER 40 Cb -0.04 1.10 0.04 0.00 0.10 0.00 0.00 66.02 67.22 2bpa s SER 40 CO -0.01 -0.32 -0.10 0.28 0.98 0.00 0.00 173.24 174.07 2bpa s THR 41 N -0.08 1.61 -0.18 2.02 -1.32 -1.26 -1.48 115.64 114.96 2bpa s THR 41 Ca -0.03 -1.01 -0.07 0.00 -1.21 0.00 0.00 61.69 59.37 2bpa s THR 41 Cb -0.04 -1.71 -0.04 0.00 -1.51 0.00 0.00 72.50 69.21 2bpa s THR 41 CO 0.03 0.15 0.04 -0.22 -2.21 0.00 0.00 174.62 172.41 2bpa s LEU 42 N 1.40 3.70 0.02 9.08 2.96 -0.20 0.11 118.68 135.76 2bpa s LEU 42 Ca -0.02 0.04 0.04 0.00 -0.22 0.00 0.00 54.13 53.97 2bpa s LEU 42 Cb -0.16 -1.93 -0.02 0.00 0.50 0.00 0.00 46.19 44.58 2bpa s LEU 42 CO -0.08 0.18 -0.11 -0.72 -1.32 0.00 0.00 176.35 174.30 2bpa s TYR 43 N 0.35 0.95 -0.09 5.38 1.13 -0.23 -0.28 117.35 124.57 2bpa s TYR 43 Ca 0.02 -0.31 -0.03 0.00 -1.41 0.00 0.00 57.07 55.34 2bpa s TYR 43 Cb -0.13 -0.58 0.05 0.00 -1.10 0.00 0.00 41.96 40.20 2bpa s TYR 43 CO 0.01 -0.00 0.10 -0.59 -2.51 0.00 0.00 175.55 172.56 2bpa s PHE 44 N -0.72 0.01 -2.14 -3.49 -0.71 0.52 -1.55 117.98 109.89 2bpa s PHE 44 Ca -0.00 0.22 0.20 0.00 -1.04 0.00 0.00 56.93 56.31 2bpa s PHE 44 Cb -0.07 -0.46 0.92 0.00 -1.21 0.00 0.00 43.02 42.20 2bpa s PHE 44 CO 0.01 -0.31 1.63 -0.40 -1.34 0.00 0.00 175.22 174.80 2bpa n ASP 45 N 5.30 0.86 -3.15 1.98 5.75 -1.26 -0.91 116.55 125.11 2bpa n ASP 45 Ca -0.04 -1.57 0.06 0.00 -0.01 0.00 0.00 54.79 53.22 2bpa n ASP 45 Cb 0.50 -0.05 -0.02 0.00 -1.03 0.00 0.00 41.12 40.51 2bpa n ASP 45 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2bpa s SER 46 N -1.58 -0.23 -0.05 -1.12 0.15 -1.23 -4.62 113.70 105.02 2bpa s SER 46 Ca 0.30 0.15 0.03 0.00 0.70 0.00 0.00 55.95 57.14 2bpa s SER 46 Cb 0.15 1.19 0.00 0.00 -1.71 0.00 0.00 66.02 65.66 2bpa s SER 46 CO 0.24 -0.04 -0.16 -0.22 1.20 0.00 0.00 173.24 174.26 2bpa s LEU 47 N 2.93 1.83 -0.24 3.45 2.96 0.20 -4.90 118.68 124.92 2bpa s LEU 47 Ca -0.06 -0.34 -0.08 0.00 -0.22 0.00 0.00 54.13 53.43 2bpa s LEU 47 Cb -0.09 -0.93 -0.03 0.00 0.50 0.00 0.00 46.19 45.64 2bpa s LEU 47 CO -0.09 0.11 0.08 0.42 -1.32 0.00 0.00 176.35 175.55 2bpa s THR 48 N 0.29 4.50 -0.37 3.68 -4.23 0.55 -0.06 115.64 119.99 2bpa s THR 48 Ca -0.09 -0.11 -0.17 0.00 -1.18 0.00 0.00 61.69 60.14 2bpa s THR 48 Cb -0.13 -3.09 0.00 0.00 1.34 0.00 0.00 72.50 70.62 2bpa s THR 48 CO 0.03 0.35 0.44 -0.69 -0.54 0.00 0.00 174.62 174.22 2bpa s VAL 49 N 1.38 5.08 0.46 2.29 1.01 0.14 0.81 120.40 131.57 2bpa s VAL 49 Ca 0.05 0.01 -0.19 0.00 0.00 0.00 0.00 61.98 61.85 2bpa s VAL 49 Cb -0.15 -3.95 -0.10 0.00 0.00 0.00 0.00 36.38 32.18 2bpa s VAL 49 CO 0.04 -0.26 0.96 0.20 0.00 0.00 0.00 175.10 176.04 2bpa s ASN 50 N 1.78 6.82 0.31 3.32 0.02 0.21 0.22 114.94 127.63 2bpa s ASN 50 Ca 0.14 1.64 -0.29 0.00 -1.02 0.00 0.00 52.86 53.33 2bpa s ASN 50 Cb -0.16 -2.52 -0.13 0.00 0.02 0.00 0.00 41.25 38.46 2bpa s ASN 50 CO 0.13 -0.44 1.29 0.00 0.02 0.00 0.00 177.10 178.11 2bpa n ALA 51 N -0.97 1.12 -3.59 0.60 0.00 -1.26 -4.11 120.51 112.31 2bpa n ALA 51 Ca 0.07 0.37 -0.08 0.00 0.00 0.00 0.00 53.44 53.80 2bpa n ALA 51 Cb 0.54 -2.24 -0.04 0.00 0.00 0.00 0.00 19.45 17.71 2bpa n ALA 51 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2bpa s GLY 52 N -0.20 -0.19 -0.45 0.00 0.00 -0.38 -4.66 107.32 101.45 2bpa s GLY 52 Ca 0.58 2.14 0.04 0.00 0.00 0.00 0.00 44.72 47.48 2bpa s GLY 52 CO 0.59 0.98 0.18 0.21 0.00 0.00 0.00 173.10 175.06 2bpa s ASN 53 N -1.23 4.42 0.00 1.64 3.04 -1.25 0.17 114.94 121.73 2bpa s ASN 53 Ca 0.02 -2.67 0.00 0.00 0.04 0.00 0.00 52.86 50.25 2bpa s ASN 53 Cb -0.01 -1.58 0.00 0.00 -1.54 0.00 0.00 41.25 38.12 2bpa s ASN 53 CO -0.02 -0.29 0.00 0.61 -3.04 0.00 0.00 177.10 174.36 2bpa n GLY 54 N 3.56 -0.62 1.28 1.21 0.00 -0.94 -3.85 105.19 105.83 2bpa n GLY 54 Ca 0.05 -0.58 -0.07 0.00 0.00 0.00 0.00 46.02 45.42 2bpa n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bpa n GLY 55 N 0.00 3.45 3.07 -0.02 0.00 0.29 -1.91 105.19 110.07 2bpa n GLY 55 Ca 0.00 -1.71 -0.08 0.00 0.00 0.00 0.00 46.02 44.23 2bpa n GLY 55 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2bpa s PHE 56 N -2.79 0.32 0.18 1.61 -0.71 -0.77 -2.61 117.98 113.21 2bpa s PHE 56 Ca 0.15 -0.69 -0.11 0.00 -1.04 0.00 0.00 56.93 55.24 2bpa s PHE 56 Cb 0.01 -0.23 -0.00 0.00 -1.21 0.00 0.00 43.02 41.58 2bpa s PHE 56 CO 0.11 -0.32 0.36 -0.48 -1.34 0.00 0.00 175.22 173.54 2bpa s LEU 57 N -2.21 0.69 -0.12 -1.99 0.05 -1.02 -1.54 118.68 112.55 2bpa s LEU 57 Ca -0.04 -0.82 0.01 0.00 0.05 0.00 0.00 54.13 53.33 2bpa s LEU 57 Cb -0.01 1.44 0.02 0.00 -2.05 0.00 0.00 46.19 45.60 2bpa s LEU 57 CO -0.05 -0.96 -0.14 -2.28 -0.55 0.00 0.00 176.35 172.36 2bpa s HIS 58 N -3.96 1.97 0.22 3.48 5.65 -0.54 -0.73 115.29 121.38 2bpa s HIS 58 Ca 0.17 -0.98 0.07 0.00 0.25 0.00 0.00 55.06 54.58 2bpa s HIS 58 Cb 0.02 -1.44 -0.04 0.00 -1.18 0.00 0.00 32.58 29.94 2bpa s HIS 58 CO 0.01 -0.52 0.11 0.00 -0.65 0.00 0.00 174.74 173.68 2bpa s ILE 60 N -2.03 1.03 -0.21 0.00 -4.36 -0.46 -4.30 121.20 110.86 2bpa s ILE 60 Ca 0.31 -1.29 -0.20 0.00 -0.26 0.00 0.00 60.65 59.21 2bpa s ILE 60 Cb -0.08 -1.02 -0.03 0.00 1.25 0.00 0.00 42.46 42.59 2bpa s ILE 60 CO 0.22 -0.26 0.60 -1.58 0.24 0.00 0.00 174.94 174.16 2bpa s GLN 61 N -1.75 4.19 0.39 0.37 0.74 0.45 -2.23 119.66 121.82 2bpa s GLN 61 Ca -0.03 0.55 -0.28 0.00 0.05 0.00 0.00 55.36 55.65 2bpa s GLN 61 Cb -0.10 -3.59 -0.11 0.00 1.10 0.00 0.00 33.01 30.32 2bpa s GLN 61 CO 0.02 -0.25 1.48 -1.33 -0.55 0.00 0.00 175.29 174.67 2bpa n MET 62 N 5.09 2.63 -2.77 1.67 2.81 -0.51 -3.90 117.12 122.14 2bpa n MET 62 Ca -0.02 0.92 -0.43 0.00 -1.81 0.00 0.00 57.70 56.36 2bpa n MET 62 Cb 0.50 -2.67 -0.04 0.00 -0.71 0.00 0.00 33.22 30.30 2bpa n MET 62 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2bpa s ASP 63 N -0.17 6.59 -0.77 7.83 -1.08 -1.26 -4.76 116.67 123.04 2bpa s ASP 63 Ca 0.54 0.35 -0.02 0.00 -0.52 0.00 0.00 52.55 52.91 2bpa s ASP 63 Cb -0.47 -2.47 0.39 0.00 -1.46 0.00 0.00 42.92 38.90 2bpa s ASP 63 CO 0.63 -1.02 2.00 0.35 0.52 0.00 0.00 175.17 177.65 2bpa n THR 64 N 6.33 3.57 0.31 1.71 -2.24 -1.26 -4.51 114.28 118.18 2bpa n THR 64 Ca 0.08 -3.86 0.10 0.00 -2.27 0.00 0.00 64.05 58.09 2bpa n THR 64 Cb 0.48 -1.21 -0.14 0.00 -2.10 0.00 0.00 70.33 67.36 2bpa n THR 64 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2bpa n SER 65 N -0.67 0.64 -4.59 3.42 3.41 -1.26 -4.78 113.62 109.78 2bpa n SER 65 Ca 0.56 -0.33 -0.37 0.00 -0.26 0.00 0.00 58.87 58.47 2bpa n SER 65 Cb 0.39 1.59 -0.11 0.00 -0.26 0.00 0.00 64.21 65.82 2bpa n SER 65 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2bpa s VAL 66 N -3.17 5.16 -1.17 -3.33 1.01 -1.26 -4.99 120.40 112.65 2bpa s VAL 66 Ca -0.02 0.12 -0.20 0.00 0.00 0.00 0.00 61.98 61.87 2bpa s VAL 66 Cb 0.13 -3.43 0.06 0.00 0.00 0.00 0.00 36.38 33.13 2bpa s VAL 66 CO 0.81 0.30 1.63 0.21 0.00 0.00 0.00 175.10 178.05 2bpa s ASN 67 N 1.48 6.62 -0.24 3.32 3.04 -1.26 -4.77 114.94 123.12 2bpa s ASN 67 Ca 0.07 -1.98 -0.03 0.00 0.04 0.00 0.00 52.86 50.96 2bpa s ASN 67 Cb -0.15 -2.58 0.10 0.00 -1.54 0.00 0.00 41.25 37.09 2bpa s ASN 67 CO 0.08 -1.39 0.20 0.00 -3.04 0.00 0.00 177.10 172.95 2bpa s ALA 68 N 4.84 -0.04 0.18 1.71 0.00 -1.26 -5.06 121.76 122.13 2bpa s ALA 68 Ca 0.51 -0.26 -0.14 0.00 0.00 0.00 0.00 51.96 52.07 2bpa s ALA 68 Cb 0.02 -1.43 0.18 0.00 0.00 0.00 0.00 23.12 21.89 2bpa s ALA 68 CO 0.01 -1.43 1.69 0.00 0.00 0.00 0.00 175.76 176.02 2bpa h ALA 69 N 8.33 0.47 -3.11 0.00 0.00 -1.95 -3.41 119.26 119.58 2bpa h ALA 69 Ca -0.16 0.14 -0.64 0.00 0.00 0.00 0.00 54.91 54.25 2bpa h ALA 69 Cb 1.10 0.23 -0.21 0.00 0.00 0.00 0.00 17.79 18.91 2bpa h ALA 69 CO 0.33 -0.38 -0.63 -0.80 0.00 0.00 0.00 179.25 177.78 2bpa s ASN 70 N -5.26 5.11 0.16 0.00 0.02 -1.26 -1.40 114.94 112.31 2bpa s ASN 70 Ca -0.13 -0.13 0.05 0.00 -1.02 0.00 0.00 52.86 51.62 2bpa s ASN 70 Cb 0.16 -1.89 -0.04 0.00 0.02 0.00 0.00 41.25 39.50 2bpa s ASN 70 CO 0.72 0.07 -0.10 -1.10 0.02 0.00 0.00 177.10 176.71 2bpa s GLN 71 N 1.01 1.10 -0.07 -0.60 -0.21 -0.33 -4.94 119.66 115.61 2bpa s GLN 71 Ca 0.03 -1.47 -0.20 0.00 0.02 0.00 0.00 55.36 53.74 2bpa s GLN 71 Cb -0.14 -0.67 -0.04 0.00 1.00 0.00 0.00 33.01 33.15 2bpa s GLN 71 CO 0.02 0.08 0.56 0.08 -2.12 0.00 0.00 175.29 173.91 2bpa s VAL 72 N -3.30 5.07 -0.16 1.09 1.01 -1.26 -0.68 120.40 122.17 2bpa s VAL 72 Ca 0.18 1.14 0.01 0.00 0.00 0.00 0.00 61.98 63.31 2bpa s VAL 72 Cb 0.02 -3.89 0.01 0.00 0.00 0.00 0.00 36.38 32.52 2bpa s VAL 72 CO 0.01 0.34 -0.19 -0.69 0.00 0.00 0.00 175.10 174.58 2bpa s VAL 73 N 0.37 2.23 0.16 2.92 1.01 0.26 0.40 120.40 127.75 2bpa s VAL 73 Ca 0.30 -0.90 0.06 0.00 0.00 0.00 0.00 61.98 61.43 2bpa s VAL 73 Cb -0.17 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 2bpa s VAL 73 CO 0.14 0.53 0.10 -0.94 0.00 0.00 0.00 175.10 174.93 2bpa s SER 74 N 1.04 5.33 -0.01 3.32 1.04 0.98 -0.57 113.70 124.82 2bpa s SER 74 Ca -0.01 -0.19 0.02 0.00 0.48 0.00 0.00 55.95 56.24 2bpa s SER 74 Cb -0.14 -1.33 0.00 0.00 0.10 0.00 0.00 66.02 64.64 2bpa s SER 74 CO -0.06 0.08 -0.07 0.54 0.98 0.00 0.00 173.24 174.71 2bpa s VAL 75 N -1.73 0.58 -0.11 5.02 0.11 0.58 -0.78 120.40 124.07 2bpa s VAL 75 Ca 0.30 -0.28 -0.01 0.00 -2.93 0.00 0.00 61.98 59.07 2bpa s VAL 75 Cb -0.10 -0.51 0.03 0.00 -1.53 0.00 0.00 36.38 34.27 2bpa s VAL 75 CO 0.22 0.18 -0.05 -0.83 -3.33 0.00 0.00 175.10 171.29 2bpa s GLY 76 N 0.07 0.74 -0.14 6.54 0.00 0.10 -1.06 107.32 113.57 2bpa s GLY 76 Ca -0.01 -0.46 -0.19 0.00 0.00 0.00 0.00 44.72 44.07 2bpa s GLY 76 CO -0.00 0.91 0.49 0.00 0.00 0.00 0.00 173.10 174.51 2bpa s ALA 77 N 1.78 -1.23 -0.22 3.20 0.00 -0.20 0.13 121.76 125.22 2bpa s ALA 77 Ca 0.05 1.22 -0.02 0.00 0.00 0.00 0.00 51.96 53.21 2bpa s ALA 77 Cb -0.13 -0.56 0.07 0.00 0.00 0.00 0.00 23.12 22.50 2bpa s ALA 77 CO -0.07 -0.26 0.02 0.34 0.00 0.00 0.00 175.76 175.79 2bpa s ASP 78 N -0.19 3.33 0.05 0.00 2.15 -0.80 -1.12 116.67 120.09 2bpa s ASP 78 Ca -0.04 -1.04 0.05 0.00 0.43 0.00 0.00 52.55 51.96 2bpa s ASP 78 Cb -0.03 -0.80 -0.02 0.00 -0.30 0.00 0.00 42.92 41.77 2bpa s ASP 78 CO 0.02 -0.30 -0.15 0.27 -0.17 0.00 0.00 175.17 174.84 2bpa s ILE 79 N 1.69 1.19 -0.17 4.11 -4.36 0.16 -2.01 121.20 121.81 2bpa s ILE 79 Ca -0.01 -1.08 -0.01 0.00 -0.26 0.00 0.00 60.65 59.29 2bpa s ILE 79 Cb -0.18 -1.08 0.05 0.00 1.25 0.00 0.00 42.46 42.50 2bpa s ILE 79 CO -0.10 -0.01 -0.03 0.00 0.24 0.00 0.00 174.94 175.05 2bpa s ALA 80 N -0.91 1.37 0.08 2.27 0.00 0.59 0.16 121.76 125.32 2bpa s ALA 80 Ca 0.02 -0.81 -0.16 0.00 0.00 0.00 0.00 51.96 51.01 2bpa s ALA 80 Cb -0.08 -1.15 -0.06 0.00 0.00 0.00 0.00 23.12 21.83 2bpa s ALA 80 CO 0.02 -0.90 0.51 -0.06 0.00 0.00 0.00 175.76 175.33 2bpa s PHE 81 N 1.68 3.70 0.34 0.00 0.40 0.24 -1.64 117.98 122.70 2bpa s PHE 81 Ca -0.00 1.09 0.04 0.00 -0.60 0.00 0.00 56.93 57.46 2bpa s PHE 81 Cb -0.16 -2.37 0.62 0.00 0.51 0.00 0.00 43.02 41.62 2bpa s PHE 81 CO -0.07 0.54 1.91 -0.44 0.70 0.00 0.00 175.22 177.85 2bpa h ASP 82 N 4.15 0.54 -2.11 1.36 3.32 -0.74 -3.44 116.42 119.50 2bpa h ASP 82 Ca -0.50 -0.08 -0.59 0.00 0.02 0.00 0.00 57.03 55.88 2bpa h ASP 82 Cb 1.21 -0.14 -0.13 0.00 0.22 0.00 0.00 39.33 40.48 2bpa h ASP 82 CO 0.64 0.55 -0.64 0.00 -1.72 0.00 0.00 179.24 178.07 2bpa s ALA 83 N -5.14 2.90 -0.53 3.45 0.00 -1.26 -5.03 121.76 116.15 2bpa s ALA 83 Ca -0.08 -2.16 -0.15 0.00 0.00 0.00 0.00 51.96 49.57 2bpa s ALA 83 Cb 0.16 0.16 0.12 0.00 0.00 0.00 0.00 23.12 23.57 2bpa s ALA 83 CO 0.76 -0.07 0.47 0.34 0.00 0.00 0.00 175.76 177.27 2bpa s ASP 84 N -3.62 6.14 0.00 0.00 2.15 -1.26 -4.62 116.67 115.46 2bpa s ASP 84 Ca 0.34 -1.75 0.09 0.00 0.43 0.00 0.00 52.55 51.65 2bpa s ASP 84 Cb 0.07 -2.19 0.43 0.00 -0.30 0.00 0.00 42.92 40.92 2bpa s ASP 84 CO 0.16 -0.82 1.22 -2.65 -0.17 0.00 0.00 175.17 172.91 2bpa n PRO 85 N 5.21 0.07 -3.85 4.34 -0.02 -1.26 -4.87 135.00 134.62 2bpa n PRO 85 Ca -0.13 0.26 -0.25 0.00 -2.02 0.00 0.00 63.50 61.36 2bpa n PRO 85 Cb 0.40 -1.50 0.01 0.00 -0.02 0.00 0.00 33.50 32.40 2bpa n PRO 85 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2bpa n LYS 86 N -1.38 -4.59 -3.55 -0.52 5.02 -1.26 -4.55 118.16 107.33 2bpa n LYS 86 Ca 0.03 0.55 -0.21 0.00 -2.02 0.00 0.00 58.31 56.66 2bpa n LYS 86 Cb 0.09 -5.10 -0.01 0.00 -0.02 0.00 0.00 35.03 29.98 2bpa n LYS 86 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 2bpa s PHE 87 N -3.62 3.33 -0.06 2.13 -0.12 -1.26 -4.81 117.98 113.56 2bpa s PHE 87 Ca 0.22 0.03 -0.00 0.00 -0.05 0.00 0.00 56.93 57.13 2bpa s PHE 87 Cb -0.11 -1.88 -0.03 0.00 -0.63 0.00 0.00 43.02 40.37 2bpa s PHE 87 CO 0.84 0.12 -0.02 -0.59 -0.05 0.00 0.00 175.22 175.52 2bpa s PHE 88 N -2.19 3.08 0.22 3.49 -0.12 -0.72 -4.96 117.98 116.78 2bpa s PHE 88 Ca 0.41 0.12 0.09 0.00 -0.05 0.00 0.00 56.93 57.49 2bpa s PHE 88 Cb -0.09 -1.74 -0.04 0.00 -0.63 0.00 0.00 43.02 40.52 2bpa s PHE 88 CO 0.32 0.43 -0.01 0.00 -0.05 0.00 0.00 175.22 175.91 2bpa s ALA 89 N -0.91 3.16 0.16 1.99 0.00 -1.26 -2.13 121.76 122.76 2bpa s ALA 89 Ca 0.14 -1.52 -0.24 0.00 0.00 0.00 0.00 51.96 50.34 2bpa s ALA 89 Cb -0.11 -0.86 0.08 0.00 0.00 0.00 0.00 23.12 22.22 2bpa s ALA 89 CO 0.04 0.37 1.03 0.00 0.00 0.00 0.00 175.76 177.19 2bpa s LEU 91 N -3.23 3.76 0.04 0.00 1.43 -0.21 -1.37 118.68 119.10 2bpa s LEU 91 Ca 0.18 0.19 0.09 0.00 -1.03 0.00 0.00 54.13 53.56 2bpa s LEU 91 Cb -0.02 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.23 2bpa s LEU 91 CO 0.04 0.36 -0.26 -0.69 0.23 0.00 0.00 176.35 176.03 2bpa s VAL 92 N -0.97 2.09 -0.11 -1.59 1.01 0.97 -1.27 120.40 120.53 2bpa s VAL 92 Ca 0.15 -1.34 0.01 0.00 0.00 0.00 0.00 61.98 60.81 2bpa s VAL 92 Cb -0.12 -1.78 0.02 0.00 0.00 0.00 0.00 36.38 34.50 2bpa s VAL 92 CO 0.05 0.38 -0.13 -0.60 0.00 0.00 0.00 175.10 174.80 2bpa s ARG 93 N -1.16 1.99 0.07 2.72 3.52 -0.39 0.73 118.95 126.43 2bpa s ARG 93 Ca 0.11 -0.47 -0.12 0.00 -0.13 0.00 0.00 55.73 55.12 2bpa s ARG 93 Cb -0.10 -1.77 0.01 0.00 -1.56 0.00 0.00 34.95 31.54 2bpa s ARG 93 CO 0.02 -0.11 0.28 -0.59 -0.81 0.00 0.00 175.30 174.08 2bpa s PHE 94 N 1.14 -0.04 0.26 5.12 -0.71 0.46 -0.74 117.98 123.48 2bpa s PHE 94 Ca -0.04 -0.20 0.12 0.00 -1.04 0.00 0.00 56.93 55.76 2bpa s PHE 94 Cb -0.14 0.07 -0.05 0.00 -1.21 0.00 0.00 43.02 41.69 2bpa s PHE 94 CO -0.03 -0.53 -0.20 -1.83 -1.34 0.00 0.00 175.22 171.28 2bpa s GLU 95 N -3.05 1.64 -0.28 1.99 -1.05 -1.26 0.31 118.70 117.00 2bpa s GLU 95 Ca -0.01 -1.72 -0.20 0.00 -0.15 0.00 0.00 54.97 52.89 2bpa s GLU 95 Cb 0.01 -1.76 0.08 0.00 -0.44 0.00 0.00 34.13 32.03 2bpa s GLU 95 CO -0.06 0.34 0.74 0.45 0.95 0.00 0.00 175.26 177.68 2bpa s SER 96 N -3.35 -0.81 -0.07 0.83 0.15 0.20 -4.88 113.70 105.76 2bpa s SER 96 Ca 0.28 1.40 0.04 0.00 0.70 0.00 0.00 55.95 58.37 2bpa s SER 96 Cb -0.05 1.37 0.26 0.00 -1.71 0.00 0.00 66.02 65.88 2bpa s SER 96 CO 0.14 -0.23 0.90 -1.54 1.20 0.00 0.00 173.24 173.71 2bpa n SER 97 N 3.57 2.46 -3.55 5.45 3.41 -1.26 -1.34 113.62 122.36 2bpa n SER 97 Ca -0.17 -2.29 -0.13 0.00 -0.26 0.00 0.00 58.87 56.03 2bpa n SER 97 Cb 0.57 -0.55 -0.04 0.00 -0.26 0.00 0.00 64.21 63.93 2bpa n SER 97 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2bpa s SER 98 N -0.26 -0.42 -0.11 4.04 1.04 -1.26 -4.91 113.70 111.82 2bpa s SER 98 Ca 0.17 0.01 -0.34 0.00 0.48 0.00 0.00 55.95 56.27 2bpa s SER 98 Cb 0.13 0.51 -0.12 0.00 0.10 0.00 0.00 66.02 66.65 2bpa s SER 98 CO 0.05 -0.82 1.90 0.52 0.98 0.00 0.00 173.24 175.88 2bpa n VAL 99 N 0.05 0.55 -2.38 5.02 0.31 -1.26 -4.90 118.33 115.72 2bpa n VAL 99 Ca -0.17 -0.12 -0.34 0.00 -0.01 0.00 0.00 64.34 63.69 2bpa n VAL 99 Cb 0.62 -1.86 -0.02 0.00 -0.91 0.00 0.00 33.84 31.68 2bpa n VAL 99 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2bpa s PRO 100 N 4.24 3.57 0.00 5.55 0.04 -1.26 -4.95 135.00 142.19 2bpa s PRO 100 Ca 0.94 1.44 0.00 0.00 0.04 0.00 0.00 61.00 63.42 2bpa s PRO 100 Cb -0.71 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 31.78 2bpa s PRO 100 CO 0.52 -0.64 0.00 0.25 0.04 0.00 0.00 177.00 177.17 2bpa n THR 101 N -1.21 0.00 -3.78 1.26 -2.24 -1.26 -4.83 114.28 102.21 2bpa n THR 101 Ca 0.10 -0.21 -0.11 0.00 -2.27 0.00 0.00 64.05 61.56 2bpa n THR 101 Cb 0.52 0.75 -0.08 0.00 -2.10 0.00 0.00 70.33 69.42 2bpa n THR 101 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2bpa s THR 102 N -0.90 0.09 0.22 4.28 -4.23 -1.26 -0.55 115.64 113.29 2bpa s THR 102 Ca 0.00 -0.70 -0.32 0.00 -1.18 0.00 0.00 61.69 59.49 2bpa s THR 102 Cb 0.00 -0.88 -0.12 0.00 1.34 0.00 0.00 72.50 72.84 2bpa s THR 102 CO 0.00 -0.39 1.71 -0.11 -0.54 0.00 0.00 174.62 175.29 2bpa n LEU 103 N 0.72 4.03 -4.61 4.79 7.94 0.38 -4.87 117.00 125.39 2bpa n LEU 103 Ca -0.19 1.07 -0.29 0.00 -1.11 0.00 0.00 56.01 55.49 2bpa n LEU 103 Cb 0.59 -1.58 0.22 0.00 0.53 0.00 0.00 43.42 43.18 2bpa n LEU 103 CO 0.21 0.18 0.61 -2.16 -1.11 0.00 0.00 177.39 175.12 2bpa s PRO 104 N 0.98 -0.55 0.43 1.96 0.04 -1.26 -4.45 135.00 132.14 2bpa s PRO 104 Ca 0.74 0.29 0.18 0.00 0.04 0.00 0.00 61.00 62.25 2bpa s PRO 104 Cb -0.51 -1.64 0.96 0.00 0.04 0.00 0.00 34.50 33.35 2bpa s PRO 104 CO 0.34 -3.34 1.91 1.15 0.04 0.00 0.00 177.00 177.10 2bpa h THR 105 N -2.32 1.00 -3.48 1.26 2.02 -1.96 -3.42 112.91 106.01 2bpa h THR 105 Ca -0.52 -1.00 -0.67 0.00 0.77 0.00 0.00 66.41 65.00 2bpa h THR 105 Cb 1.32 1.57 -0.27 0.00 -1.74 0.00 0.00 68.15 69.03 2bpa h THR 105 CO 0.47 0.27 -0.78 0.00 0.37 0.00 0.00 175.52 175.85 2bpa s ALA 106 N -4.19 2.58 0.09 6.16 0.00 -1.26 -5.11 121.76 120.03 2bpa s ALA 106 Ca -0.03 -0.92 -0.26 0.00 0.00 0.00 0.00 51.96 50.75 2bpa s ALA 106 Cb 0.14 -1.12 0.08 0.00 0.00 0.00 0.00 23.12 22.22 2bpa s ALA 106 CO 0.68 0.32 0.87 1.52 0.00 0.00 0.00 175.76 179.14 2bpa s TYR 107 N 0.13 -0.28 0.20 0.00 -0.85 -1.26 -4.54 117.35 110.74 2bpa s TYR 107 Ca -0.07 0.06 0.11 0.00 -0.52 0.00 0.00 57.07 56.64 2bpa s TYR 107 Cb -0.15 0.59 -0.04 0.00 0.38 0.00 0.00 41.96 42.73 2bpa s TYR 107 CO 0.05 -0.72 -0.21 -0.51 -1.52 0.00 0.00 175.55 172.64 2bpa s ASP 108 N -2.70 3.22 0.14 -0.18 1.01 0.08 -4.96 116.67 113.29 2bpa s ASP 108 Ca 0.07 -0.90 0.09 0.00 0.71 0.00 0.00 52.55 52.53 2bpa s ASP 108 Cb -0.01 -0.23 -0.04 0.00 1.01 0.00 0.00 42.92 43.65 2bpa s ASP 108 CO -0.05 0.05 -0.21 0.68 0.21 0.00 0.00 175.17 175.85 2bpa s VAL 109 N -1.96 1.93 -0.03 -1.27 -7.23 -1.26 -1.26 120.40 109.32 2bpa s VAL 109 Ca 0.21 -1.78 -0.01 0.00 -1.81 0.00 0.00 61.98 58.58 2bpa s VAL 109 Cb -0.07 -1.81 0.02 0.00 0.56 0.00 0.00 36.38 35.09 2bpa s VAL 109 CO 0.10 -0.14 0.06 -0.31 -0.31 0.00 0.00 175.10 174.50 2bpa s TYR 110 N -1.54 -0.05 0.30 2.82 2.02 -0.40 -4.97 117.35 115.54 2bpa s TYR 110 Ca 0.13 0.20 -0.28 0.00 -0.37 0.00 0.00 57.07 56.75 2bpa s TYR 110 Cb -0.08 -0.07 -0.09 0.00 -0.40 0.00 0.00 41.96 41.32 2bpa s TYR 110 CO 0.06 -0.07 1.01 -1.25 -1.57 0.00 0.00 175.55 173.73 2bpa s PRO 111 N 0.51 4.60 0.53 -1.71 0.04 -1.26 -1.04 135.00 136.67 2bpa s PRO 111 Ca -0.04 1.55 0.08 0.00 0.04 0.00 0.00 61.00 62.62 2bpa s PRO 111 Cb -0.06 -3.00 0.05 0.00 0.04 0.00 0.00 34.50 31.54 2bpa s PRO 111 CO -0.02 0.25 0.59 -0.51 0.04 0.00 0.00 177.00 177.35 2bpa s LEU 112 N -1.75 3.05 -0.58 -3.56 1.43 -1.26 -4.92 118.68 111.09 2bpa s LEU 112 Ca 0.47 -0.93 0.04 0.00 -1.03 0.00 0.00 54.13 52.68 2bpa s LEU 112 Cb -0.25 -1.62 0.36 0.00 0.03 0.00 0.00 46.19 44.71 2bpa s LEU 112 CO 0.32 -1.12 1.10 -3.20 0.23 0.00 0.00 176.35 173.68 2bpa n ASN 113 N -1.96 4.89 -2.10 2.29 4.05 -1.26 -5.03 115.26 116.14 2bpa n ASN 113 Ca 0.08 -3.70 0.00 0.00 0.45 0.00 0.00 54.58 51.40 2bpa n ASN 113 Cb 0.62 -0.59 0.00 0.00 1.23 0.00 0.00 39.78 41.04 2bpa n ASN 113 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2bpa n GLY 114 N -0.32 -0.51 2.89 8.20 0.00 -1.26 -4.79 105.19 109.40 2bpa n GLY 114 Ca 0.35 -1.74 -0.16 0.00 0.00 0.00 0.00 46.02 44.48 2bpa n GLY 114 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2bpa s ARG 115 N -2.07 0.07 -0.14 1.61 3.03 -0.59 -5.01 118.95 115.85 2bpa s ARG 115 Ca 0.00 0.55 -0.14 0.00 2.03 0.00 0.00 55.73 58.17 2bpa s ARG 115 Cb 0.00 -0.22 -0.05 0.00 -1.03 0.00 0.00 34.95 33.66 2bpa s ARG 115 CO 0.00 -0.27 0.31 -1.01 -1.13 0.00 0.00 175.30 173.20 2bpa s HIS 116 N 2.05 3.50 -0.31 5.89 3.76 -1.26 -2.32 115.29 126.60 2bpa s HIS 116 Ca -0.00 0.66 -0.00 0.00 -0.15 0.00 0.00 55.06 55.56 2bpa s HIS 116 Cb -0.12 -2.33 0.13 0.00 1.11 0.00 0.00 32.58 31.38 2bpa s HIS 116 CO -0.06 0.31 0.28 0.34 -0.85 0.00 0.00 174.74 174.75 2bpa s ASP 117 N 0.22 1.95 1.85 1.40 -1.08 -0.45 -5.01 116.67 115.55 2bpa s ASP 117 Ca 0.18 -1.11 0.00 0.00 -0.52 0.00 0.00 52.55 51.10 2bpa s ASP 117 Cb -0.13 0.32 0.00 0.00 -1.46 0.00 0.00 42.92 41.65 2bpa s ASP 117 CO 0.05 -0.36 0.00 0.61 0.52 0.00 0.00 175.17 175.99 2bpa n GLY 118 N 4.99 3.80 1.19 2.66 0.00 -1.26 -0.06 105.19 116.52 2bpa n GLY 118 Ca 0.01 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.13 2bpa n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bpa n GLY 119 N 0.00 1.94 3.86 -0.02 0.00 -1.26 -4.75 105.19 104.95 2bpa n GLY 119 Ca 0.00 -0.73 -0.35 0.00 0.00 0.00 0.00 46.02 44.94 2bpa n GLY 119 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bpa s TYR 120 N -1.27 3.61 -0.16 1.61 2.02 0.91 -0.60 117.35 123.48 2bpa s TYR 120 Ca 0.43 0.86 -0.07 0.00 -0.37 0.00 0.00 57.07 57.92 2bpa s TYR 120 Cb 0.23 -2.20 0.07 0.00 -0.40 0.00 0.00 41.96 39.66 2bpa s TYR 120 CO 0.31 0.54 0.35 -0.47 -1.57 0.00 0.00 175.55 174.70 2bpa s TYR 121 N -1.34 -0.58 0.02 2.71 5.04 0.12 -1.34 117.35 121.99 2bpa s TYR 121 Ca 0.31 1.20 0.03 0.00 -2.44 0.00 0.00 57.07 56.18 2bpa s TYR 121 Cb -0.15 0.16 -0.01 0.00 0.35 0.00 0.00 41.96 42.31 2bpa s TYR 121 CO 0.17 -0.38 -0.10 -0.08 -1.34 0.00 0.00 175.55 173.82 2bpa s THR 122 N 2.08 0.77 0.01 4.34 -1.32 -0.98 0.38 115.64 120.91 2bpa s THR 122 Ca -0.04 -0.70 -0.15 0.00 -1.21 0.00 0.00 61.69 59.60 2bpa s THR 122 Cb -0.11 -0.70 0.02 0.00 -1.51 0.00 0.00 72.50 70.20 2bpa s THR 122 CO -0.11 0.01 0.32 0.54 -2.21 0.00 0.00 174.62 173.18 2bpa s VAL 123 N -0.63 0.06 -0.42 5.08 0.11 -0.27 -1.54 120.40 122.79 2bpa s VAL 123 Ca 0.00 -0.54 0.05 0.00 -2.93 0.00 0.00 61.98 58.57 2bpa s VAL 123 Cb -0.06 -0.75 0.17 0.00 -1.53 0.00 0.00 36.38 34.21 2bpa s VAL 123 CO 0.00 -0.29 0.50 -0.75 -3.33 0.00 0.00 175.10 171.23 2bpa s LYS 124 N -1.80 0.82 0.20 1.54 2.20 -1.24 -1.03 119.74 120.44 2bpa s LYS 124 Ca -0.10 -1.03 -0.03 0.00 -0.36 0.00 0.00 55.97 54.44 2bpa s LYS 124 Cb -0.03 -0.54 -0.03 0.00 -1.51 0.00 0.00 37.83 35.71 2bpa s LYS 124 CO 0.01 -1.26 0.18 0.34 -0.36 0.00 0.00 175.35 174.27 2bpa s ASP 125 N 1.12 0.12 0.09 1.43 2.15 -0.22 -4.87 116.67 116.50 2bpa s ASP 125 Ca 0.23 -1.29 0.00 0.00 0.43 0.00 0.00 52.55 51.93 2bpa s ASP 125 Cb -0.06 0.41 -0.04 0.00 -0.30 0.00 0.00 42.92 42.92 2bpa s ASP 125 CO -0.07 -0.88 -0.03 0.00 -0.17 0.00 0.00 175.17 174.02 2bpa s VAL 127 N -3.78 0.01 -0.12 0.00 1.01 0.26 -4.95 120.40 112.83 2bpa s VAL 127 Ca 0.13 -0.05 -0.16 0.00 0.00 0.00 0.00 61.98 61.90 2bpa s VAL 127 Cb 0.07 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 36.03 2bpa s VAL 127 CO -0.05 -0.03 0.41 0.28 0.00 0.00 0.00 175.10 175.71 2bpa s THR 128 N 0.00 5.22 0.16 3.92 -1.32 -1.26 -0.58 115.64 121.78 2bpa s THR 128 Ca -0.01 0.80 0.10 0.00 -1.21 0.00 0.00 61.69 61.37 2bpa s THR 128 Cb -0.02 -3.74 -0.04 0.00 -1.51 0.00 0.00 72.50 67.18 2bpa s THR 128 CO 0.01 0.37 -0.21 -0.63 -2.21 0.00 0.00 174.62 171.94 2bpa s ILE 129 N 0.43 2.01 -0.77 5.08 -1.09 0.14 -4.94 121.20 122.06 2bpa s ILE 129 Ca 0.22 -1.89 -0.24 0.00 -2.23 0.00 0.00 60.65 56.51 2bpa s ILE 129 Cb -0.14 -1.90 0.06 0.00 -1.58 0.00 0.00 42.46 38.89 2bpa s ILE 129 CO 0.08 -0.19 1.18 1.51 -1.23 0.00 0.00 174.94 176.29 2bpa s ASP 130 N -2.52 6.25 0.00 3.58 -4.77 -1.26 -1.19 116.67 116.76 2bpa s ASP 130 Ca 0.16 -0.93 0.29 0.00 -3.30 0.00 0.00 52.55 48.77 2bpa s ASP 130 Cb -0.07 -2.50 1.49 0.00 -1.09 0.00 0.00 42.92 40.75 2bpa s ASP 130 CO 0.07 -1.58 2.02 1.33 0.70 0.00 0.00 175.17 177.71 2bpa n VAL 131 N 6.21 0.04 -3.90 2.11 0.24 -0.49 -4.86 118.33 117.67 2bpa n VAL 131 Ca 0.07 0.01 -0.28 0.00 -2.04 0.00 0.00 64.34 62.09 2bpa n VAL 131 Cb 0.48 -0.53 -0.03 0.00 -1.47 0.00 0.00 33.84 32.28 2bpa n VAL 131 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2bpa s LEU 132 N -2.52 4.33 0.23 1.34 1.43 -1.26 -4.75 118.68 117.47 2bpa s LEU 132 Ca 0.29 0.24 -0.32 0.00 -1.03 0.00 0.00 54.13 53.32 2bpa s LEU 132 Cb 0.20 -2.97 -0.13 0.00 0.03 0.00 0.00 46.19 43.32 2bpa s LEU 132 CO 0.43 0.09 1.53 -0.81 0.23 0.00 0.00 176.35 177.82 2bpa n PRO 133 N -0.23 2.29 0.18 1.29 -0.04 -1.26 -4.84 135.00 132.39 2bpa n PRO 133 Ca -0.06 0.82 0.12 0.00 -0.04 0.00 0.00 63.50 64.34 2bpa n PRO 133 Cb 0.53 -2.55 0.25 0.00 -0.04 0.00 0.00 33.50 31.69 2bpa n PRO 133 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bpa h ARG 134 N 5.08 0.00 -5.16 0.54 3.08 -1.94 -3.42 114.38 112.57 2bpa h ARG 134 Ca -0.45 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 58.98 2bpa h ARG 134 Cb 1.25 0.00 -0.33 0.00 0.08 0.00 0.00 29.97 30.97 2bpa h ARG 134 CO 0.82 0.00 -0.86 0.99 -1.07 0.00 0.00 179.97 179.86 2bpa s THR 135 N -3.17 1.70 0.31 2.04 2.01 -1.26 -5.06 115.64 112.21 2bpa s THR 135 Ca 0.08 -0.82 0.08 0.00 0.31 0.00 0.00 61.69 61.34 2bpa s THR 135 Cb 0.08 -1.48 0.30 0.00 0.01 0.00 0.00 72.50 71.41 2bpa s THR 135 CO 0.64 0.48 1.70 -0.65 -0.69 0.00 0.00 174.62 176.10 2bpa h PRO 136 N 6.67 0.43 0.00 4.92 0.11 -2.01 -2.74 132.00 139.37 2bpa h PRO 136 Ca -0.26 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2bpa h PRO 136 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2bpa h PRO 136 CO 0.47 0.28 -0.79 0.78 -0.21 0.00 0.00 178.00 178.53 2bpa h GLY 137 N 0.44 0.00 -0.84 -0.55 0.00 -1.97 -3.49 103.07 96.67 2bpa h GLY 137 Ca 0.62 0.00 -0.44 0.00 0.00 0.00 0.00 47.33 47.51 2bpa h GLY 137 CO -0.53 0.00 0.23 -1.31 0.00 0.00 0.00 176.54 174.93 2bpa s ASN 138 N -4.83 2.40 -0.05 0.19 0.01 -1.04 -4.77 114.94 106.86 2bpa s ASN 138 Ca 0.03 0.87 0.05 0.00 -0.71 0.00 0.00 52.86 53.10 2bpa s ASN 138 Cb 0.11 -1.33 -0.02 0.00 0.41 0.00 0.00 41.25 40.43 2bpa s ASN 138 CO 0.75 -3.23 -0.19 0.20 -1.51 0.00 0.00 177.10 173.12 2bpa s ASN 139 N -3.88 3.60 0.01 -1.22 0.01 -0.45 -4.72 114.94 108.29 2bpa s ASN 139 Ca 0.67 -0.33 -0.05 0.00 -0.71 0.00 0.00 52.86 52.44 2bpa s ASN 139 Cb -0.14 -0.75 -0.05 0.00 0.41 0.00 0.00 41.25 40.73 2bpa s ASN 139 CO 0.55 0.31 0.25 0.54 -1.51 0.00 0.00 177.10 177.24 2bpa s VAL 140 N -0.54 5.34 -0.02 1.60 0.11 -1.26 -0.63 120.40 125.00 2bpa s VAL 140 Ca 0.07 0.03 0.04 0.00 -2.93 0.00 0.00 61.98 59.19 2bpa s VAL 140 Cb -0.11 -3.56 -0.01 0.00 -1.53 0.00 0.00 36.38 31.17 2bpa s VAL 140 CO 0.01 0.32 -0.14 -0.31 -3.33 0.00 0.00 175.10 171.65 2bpa s TYR 141 N -1.34 1.34 -0.06 1.54 1.51 0.15 -1.43 117.35 119.07 2bpa s TYR 141 Ca 0.29 -0.31 0.04 0.00 -1.01 0.00 0.00 57.07 56.08 2bpa s TYR 141 Cb -0.13 -0.89 0.00 0.00 -0.11 0.00 0.00 41.96 40.83 2bpa s TYR 141 CO 0.18 -0.08 -0.18 0.08 -1.11 0.00 0.00 175.55 174.45 2bpa s VAL 142 N -0.13 1.52 0.24 0.71 1.01 -0.95 -0.40 120.40 122.40 2bpa s VAL 142 Ca 0.01 -0.74 -0.06 0.00 0.00 0.00 0.00 61.98 61.19 2bpa s VAL 142 Cb -0.08 -1.32 -0.02 0.00 0.00 0.00 0.00 36.38 34.97 2bpa s VAL 142 CO 0.00 0.44 0.32 -0.83 0.00 0.00 0.00 175.10 175.03 2bpa s GLY 143 N 0.20 1.10 -0.28 4.51 0.00 0.22 -1.36 107.32 111.71 2bpa s GLY 143 Ca -0.08 -1.35 -0.12 0.00 0.00 0.00 0.00 44.72 43.17 2bpa s GLY 143 CO 0.04 -1.04 0.23 -0.12 0.00 0.00 0.00 173.10 172.21 2bpa s PHE 144 N -3.96 3.23 -0.02 1.90 5.36 0.26 -0.02 117.98 124.73 2bpa s PHE 144 Ca 0.31 0.18 0.07 0.00 -0.96 0.00 0.00 56.93 56.53 2bpa s PHE 144 Cb 0.03 -2.42 -0.02 0.00 -0.34 0.00 0.00 43.02 40.27 2bpa s PHE 144 CO 0.12 -0.17 -0.23 1.41 -1.46 0.00 0.00 175.22 174.89 2bpa s MET 145 N 1.82 1.93 -0.09 10.12 -2.45 -0.47 -1.47 119.30 128.70 2bpa s MET 145 Ca 0.09 -0.83 0.02 0.00 -1.25 0.00 0.00 55.69 53.71 2bpa s MET 145 Cb -0.16 -1.84 -0.02 0.00 1.25 0.00 0.00 34.83 34.06 2bpa s MET 145 CO 0.11 0.48 -0.13 0.14 1.05 0.00 0.00 175.02 176.66 2bpa s VAL 146 N -0.49 3.08 -0.03 10.11 -7.23 -0.59 -1.67 120.40 123.57 2bpa s VAL 146 Ca 0.07 -0.69 -0.01 0.00 -1.81 0.00 0.00 61.98 59.55 2bpa s VAL 146 Cb -0.09 -2.25 0.03 0.00 0.56 0.00 0.00 36.38 34.63 2bpa s VAL 146 CO -0.00 0.56 0.06 0.86 -0.31 0.00 0.00 175.10 176.26 2bpa s TRP 147 N -0.22 -0.00 0.16 2.82 -0.11 -0.91 -1.84 118.94 118.84 2bpa s TRP 147 Ca 0.01 0.23 -0.17 0.00 1.22 0.00 0.00 56.10 57.39 2bpa s TRP 147 Cb -0.13 -0.26 0.06 0.00 -1.50 0.00 0.00 33.47 31.64 2bpa s TRP 147 CO 0.03 -0.13 0.82 0.45 -4.62 0.00 0.00 176.95 173.50 2bpa n SER 148 N 4.46 -1.44 -4.37 5.86 2.88 -0.80 -1.76 113.62 118.45 2bpa n SER 148 Ca -0.22 -1.78 -0.45 0.00 -1.33 0.00 0.00 58.87 55.09 2bpa n SER 148 Cb 0.50 2.35 -0.01 0.00 -0.75 0.00 0.00 64.21 66.31 2bpa n SER 148 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2bpa s ASN 149 N -2.96 7.14 0.49 -3.46 3.04 -1.26 -2.21 114.94 115.72 2bpa s ASN 149 Ca 0.18 -3.23 -0.23 0.00 0.04 0.00 0.00 52.86 49.62 2bpa s ASN 149 Cb -0.02 -2.25 -0.06 0.00 -1.54 0.00 0.00 41.25 37.37 2bpa s ASN 149 CO 0.05 -0.47 1.29 -0.36 -3.04 0.00 0.00 177.10 174.57 2bpa s PHE 150 N -0.27 2.56 0.09 0.43 0.08 0.45 -4.89 117.98 116.44 2bpa s PHE 150 Ca 0.31 1.43 0.09 0.00 0.12 0.00 0.00 56.93 58.87 2bpa s PHE 150 Cb -0.08 -3.64 -0.04 0.00 -0.57 0.00 0.00 43.02 38.69 2bpa s PHE 150 CO -0.07 -2.32 -0.21 0.99 -0.10 0.00 0.00 175.22 173.52 2bpa s THR 151 N -1.38 2.64 0.26 0.64 2.01 -1.26 -1.24 115.64 117.31 2bpa s THR 151 Ca 0.66 -1.46 -0.30 0.00 0.31 0.00 0.00 61.69 60.90 2bpa s THR 151 Cb -0.36 -2.16 -0.13 0.00 0.01 0.00 0.00 72.50 69.85 2bpa s THR 151 CO 0.44 0.19 1.29 0.00 -0.69 0.00 0.00 174.62 175.84 2bpa n ALA 152 N 1.12 0.72 -3.68 7.40 0.00 -1.26 -4.32 120.51 120.49 2bpa n ALA 152 Ca -0.16 0.40 0.05 0.00 0.00 0.00 0.00 53.44 53.73 2bpa n ALA 152 Cb 0.53 -2.20 0.02 0.00 0.00 0.00 0.00 19.45 17.79 2bpa n ALA 152 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2bpa n THR 153 N 1.22 0.00 -4.20 0.00 5.66 0.13 -4.89 114.28 112.20 2bpa n THR 153 Ca 0.10 -0.48 -0.18 0.00 -3.05 0.00 0.00 64.05 60.43 2bpa n THR 153 Cb 0.32 0.62 -0.12 0.00 -1.55 0.00 0.00 70.33 69.60 2bpa n THR 153 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2bpa s LYS 154 N -2.04 0.89 0.03 1.09 1.02 -1.26 0.27 119.74 119.74 2bpa s LYS 154 Ca 0.17 -1.05 -0.07 0.00 0.02 0.00 0.00 55.97 55.04 2bpa s LYS 154 Cb -0.02 -0.87 -0.00 0.00 -0.52 0.00 0.00 37.83 36.41 2bpa s LYS 154 CO 0.05 0.19 0.13 0.00 -0.92 0.00 0.00 175.35 174.80 2bpa s ARG 156 N -2.30 1.34 0.00 0.00 0.52 -0.65 0.61 118.95 118.48 2bpa s ARG 156 Ca -0.07 -0.88 0.00 0.00 -0.52 0.00 0.00 55.73 54.26 2bpa s ARG 156 Cb -0.03 -1.42 0.00 0.00 0.52 0.00 0.00 34.95 34.02 2bpa s ARG 156 CO -0.03 0.36 0.00 0.41 0.02 0.00 0.00 175.30 176.07 2bpa n GLY 157 N 1.96 0.36 3.01 -3.53 0.00 -0.09 -0.30 105.19 106.60 2bpa n GLY 157 Ca -0.17 -1.80 -0.13 0.00 0.00 0.00 0.00 46.02 43.92 2bpa n GLY 157 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2bpa s LEU 158 N 0.00 2.16 -0.06 0.99 2.34 -0.85 -0.35 118.68 122.90 2bpa s LEU 158 Ca 0.00 -0.36 -0.00 0.00 0.06 0.00 0.00 54.13 53.83 2bpa s LEU 158 Cb 0.00 -0.16 0.03 0.00 -0.56 0.00 0.00 46.19 45.49 2bpa s LEU 158 CO 0.00 -0.11 -0.02 0.54 -1.06 0.00 0.00 176.35 175.70 2bpa s VAL 159 N -0.89 0.43 -0.15 1.48 0.11 0.62 -1.91 120.40 120.09 2bpa s VAL 159 Ca -0.06 0.02 0.01 0.00 -2.93 0.00 0.00 61.98 59.02 2bpa s VAL 159 Cb -0.07 -0.53 0.00 0.00 -1.53 0.00 0.00 36.38 34.25 2bpa s VAL 159 CO 0.00 0.24 -0.18 -0.55 -3.33 0.00 0.00 175.10 171.28 2bpa s SER 160 N 1.50 3.41 0.03 3.54 0.15 0.36 -1.04 113.70 121.65 2bpa s SER 160 Ca -0.02 -0.54 0.08 0.00 0.70 0.00 0.00 55.95 56.18 2bpa s SER 160 Cb -0.13 -1.51 -0.03 0.00 -1.71 0.00 0.00 66.02 62.64 2bpa s SER 160 CO -0.03 0.08 -0.24 -0.76 1.20 0.00 0.00 173.24 173.48 2bpa s LEU 161 N 0.86 2.14 -0.07 3.45 1.43 -0.55 0.00 118.68 125.95 2bpa s LEU 161 Ca -0.05 -0.54 -0.03 0.00 -1.03 0.00 0.00 54.13 52.48 2bpa s LEU 161 Cb -0.15 -1.18 0.04 0.00 0.03 0.00 0.00 46.19 44.93 2bpa s LEU 161 CO -0.02 0.23 0.15 0.21 0.23 0.00 0.00 176.35 177.16 2bpa s ASN 162 N -1.09 -0.12 -0.42 2.29 3.84 0.04 -1.90 114.94 117.58 2bpa s ASN 162 Ca 0.10 0.31 -0.18 0.00 0.21 0.00 0.00 52.86 53.29 2bpa s ASN 162 Cb -0.09 0.21 0.02 0.00 -0.55 0.00 0.00 41.25 40.83 2bpa s ASN 162 CO 0.01 -0.14 0.50 -1.58 -2.79 0.00 0.00 177.10 173.11 2bpa s GLN 163 N 1.02 3.20 -0.99 0.43 0.74 0.50 -0.02 119.66 124.55 2bpa s GLN 163 Ca -0.08 -0.59 -0.21 0.00 0.05 0.00 0.00 55.36 54.53 2bpa s GLN 163 Cb -0.10 -3.95 -0.10 0.00 1.10 0.00 0.00 33.01 29.96 2bpa s GLN 163 CO -0.05 -0.87 1.96 0.28 -0.55 0.00 0.00 175.29 176.05 2bpa n VAL 164 N 5.55 2.20 1.09 1.34 0.31 0.16 -4.42 118.33 124.57 2bpa n VAL 164 Ca -0.05 -2.04 0.12 0.00 -0.01 0.00 0.00 64.34 62.36 2bpa n VAL 164 Cb 0.48 -2.33 0.20 0.00 -0.91 0.00 0.00 33.84 31.27 2bpa n VAL 164 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2bpa n ILE 165 N 6.28 0.00 -3.44 2.52 3.06 -1.26 -4.54 119.36 121.98 2bpa n ILE 165 Ca 0.49 -0.09 -0.13 0.00 -2.50 0.00 0.00 62.75 60.52 2bpa n ILE 165 Cb 0.42 0.59 -0.03 0.00 0.54 0.00 0.00 39.64 41.16 2bpa n ILE 165 CO 0.00 0.00 0.00 -1.59 -2.50 0.00 0.00 176.55 172.46 2bpa s LYS 166 N -2.72 1.21 0.60 9.51 -2.85 -1.26 -5.10 119.74 119.12 2bpa s LYS 166 Ca 0.17 -0.34 0.05 0.00 -1.00 0.00 0.00 55.97 54.85 2bpa s LYS 166 Cb 0.18 0.56 0.08 0.00 -2.06 0.00 0.00 37.83 36.59 2bpa s LYS 166 CO 0.64 -0.51 0.82 -1.21 0.10 0.00 0.00 175.35 175.19 2bpa s GLU 167 N -3.28 2.20 -0.24 1.78 0.41 -1.26 -5.09 118.70 113.23 2bpa s GLU 167 Ca -0.01 -1.33 0.00 0.00 -0.41 0.00 0.00 54.97 53.23 2bpa s GLU 167 Cb -0.01 -2.55 0.04 0.00 -1.78 0.00 0.00 34.13 29.83 2bpa s GLU 167 CO -0.09 -0.95 -0.11 0.42 -0.49 0.00 0.00 175.26 174.05 2bpa s ILE 168 N -2.78 2.47 0.62 -1.63 1.01 -1.26 -5.13 121.20 114.49 2bpa s ILE 168 Ca 0.62 -1.22 -0.10 0.00 0.00 0.00 0.00 60.65 59.96 2bpa s ILE 168 Cb -0.07 -2.28 -0.02 0.00 0.01 0.00 0.00 42.46 40.11 2bpa s ILE 168 CO 0.40 0.19 0.99 0.27 0.00 0.00 0.00 174.94 176.79 2bpa s ILE 169 N 1.24 4.22 0.08 2.92 -0.00 -1.26 -5.08 121.20 123.33 2bpa s ILE 169 Ca -0.02 0.53 -0.09 0.00 -0.00 0.00 0.00 60.65 61.07 2bpa s ILE 169 Cb -0.17 -3.69 0.00 0.00 -0.00 0.00 0.00 42.46 38.60 2bpa s ILE 169 CO -0.06 -0.85 0.20 0.00 -0.00 0.00 0.00 174.94 174.23 2bpa s LEU 171 N -2.75 4.28 -0.39 0.00 2.96 -1.26 -4.97 118.68 116.55 2bpa s LEU 171 Ca 0.03 2.43 0.02 0.00 -0.22 0.00 0.00 54.13 56.39 2bpa s LEU 171 Cb 0.04 -3.89 0.12 0.00 0.50 0.00 0.00 46.19 42.95 2bpa s LEU 171 CO -0.10 -0.60 0.16 -1.10 -1.32 0.00 0.00 176.35 173.39 2bpa s GLN 172 N -2.09 1.27 0.61 1.98 -0.21 -1.26 -5.01 119.66 114.95 2bpa s GLN 172 Ca 0.54 -1.81 0.26 0.00 0.02 0.00 0.00 55.36 54.36 2bpa s GLN 172 Cb -0.33 -2.57 1.10 0.00 1.00 0.00 0.00 33.01 32.21 2bpa s GLN 172 CO 0.42 -1.06 1.54 -1.35 -2.12 0.00 0.00 175.29 172.72 2bpa h PRO 173 N 7.26 0.00 -0.65 2.91 0.11 -2.03 -1.36 132.00 138.25 2bpa h PRO 173 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2bpa h PRO 173 Cb 0.97 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.08 2bpa h PRO 173 CO 0.52 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.59 2bpa n LEU 174 N -3.31 4.57 -0.27 2.35 4.32 -1.26 -5.30 117.00 118.10 2bpa n LEU 174 Ca 0.14 -2.32 0.03 0.00 -0.02 0.00 0.00 56.01 53.85 2bpa n LEU 174 Cb 1.09 -0.60 0.03 0.00 -1.62 0.00 0.00 43.42 42.32 2bpa n LEU 174 CO 0.22 0.62 0.36 0.29 -1.22 0.00 0.00 177.39 177.66