#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bb2 s ASN -1 N 0.00 2.32 0.72 1.96 0.02 -1.26 -5.13 114.94 113.57 2bb2 s ASN -1 Ca 0.00 -0.95 -0.11 0.00 -1.02 0.00 0.00 52.86 50.78 2bb2 s ASN -1 Cb 0.00 -0.10 0.02 0.00 0.02 0.00 0.00 41.25 41.19 2bb2 s ASN -1 CO 0.00 -0.17 1.08 -2.16 0.02 0.00 0.00 177.10 175.87 2bb2 s PRO 1 N -3.31 2.74 -0.19 -0.60 0.04 -1.26 -4.86 135.00 127.55 2bb2 s PRO 1 Ca 0.17 0.66 -0.08 0.00 0.04 0.00 0.00 61.00 61.80 2bb2 s PRO 1 Cb -0.02 -1.99 0.08 0.00 0.04 0.00 0.00 34.50 32.61 2bb2 s PRO 1 CO 0.05 -1.17 0.42 0.21 0.04 0.00 0.00 177.00 176.55 2bb2 s LYS 2 N -5.20 0.35 0.01 4.56 2.20 0.03 -4.33 119.74 117.37 2bb2 s LYS 2 Ca 0.58 0.96 0.00 0.00 -0.36 0.00 0.00 55.97 57.16 2bb2 s LYS 2 Cb -0.13 0.22 -0.01 0.00 -1.51 0.00 0.00 37.83 36.40 2bb2 s LYS 2 CO 0.54 -0.22 -0.02 -1.50 -0.36 0.00 0.00 175.35 173.78 2bb2 s ILE 3 N 2.22 0.12 -0.11 5.43 2.07 -1.07 -1.01 121.20 128.85 2bb2 s ILE 3 Ca -0.04 -0.57 0.02 0.00 -1.41 0.00 0.00 60.65 58.65 2bb2 s ILE 3 Cb -0.11 -0.20 0.01 0.00 0.13 0.00 0.00 42.46 42.30 2bb2 s ILE 3 CO -0.13 -0.29 -0.17 -0.63 -1.91 0.00 0.00 174.94 171.82 2bb2 s ILE 4 N -0.88 1.60 -0.09 2.00 1.01 0.11 -1.44 121.20 123.53 2bb2 s ILE 4 Ca -0.09 -0.71 -0.11 0.00 0.00 0.00 0.00 60.65 59.74 2bb2 s ILE 4 Cb -0.06 -1.45 -0.05 0.00 0.01 0.00 0.00 42.46 40.91 2bb2 s ILE 4 CO -0.01 0.46 0.25 0.27 0.00 0.00 0.00 174.94 175.91 2bb2 s ILE 5 N 0.89 5.32 0.03 2.92 -4.36 -0.65 0.38 121.20 125.73 2bb2 s ILE 5 Ca -0.08 0.46 0.08 0.00 -0.26 0.00 0.00 60.65 60.84 2bb2 s ILE 5 Cb -0.15 -3.53 -0.02 0.00 1.25 0.00 0.00 42.46 40.00 2bb2 s ILE 5 CO -0.00 0.57 -0.23 -0.36 0.24 0.00 0.00 174.94 175.15 2bb2 s PHE 6 N -0.80 2.04 0.38 1.37 0.40 0.29 -1.28 117.98 120.38 2bb2 s PHE 6 Ca 0.18 -0.39 0.16 0.00 -0.60 0.00 0.00 56.93 56.28 2bb2 s PHE 6 Cb -0.14 -1.25 0.90 0.00 0.51 0.00 0.00 43.02 43.04 2bb2 s PHE 6 CO 0.07 0.07 1.89 1.49 0.70 0.00 0.00 175.22 179.44 2bb2 h GLU 7 N 5.05 0.00 -6.38 0.44 4.81 -0.68 -1.29 114.58 116.52 2bb2 h GLU 7 Ca -0.43 0.00 -0.62 0.00 -0.13 0.00 0.00 59.36 58.18 2bb2 h GLU 7 Cb 1.15 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 30.38 2bb2 h GLU 7 CO 0.45 0.29 -0.76 -0.65 -0.73 0.00 0.00 179.01 177.61 2bb2 s GLN 8 N -4.24 1.78 0.97 1.92 -0.21 -0.18 -3.64 119.66 116.05 2bb2 s GLN 8 Ca -0.03 -1.56 -0.11 0.00 0.02 0.00 0.00 55.36 53.69 2bb2 s GLN 8 Cb 0.14 -1.92 0.17 0.00 1.00 0.00 0.00 33.01 32.41 2bb2 s GLN 8 CO 0.69 0.38 1.10 -1.83 -2.12 0.00 0.00 175.29 173.51 2bb2 s GLU 9 N -3.14 0.61 -1.83 2.91 -1.05 -1.25 -2.16 118.70 112.79 2bb2 s GLU 9 Ca 0.26 1.25 0.00 0.00 -0.15 0.00 0.00 54.97 56.33 2bb2 s GLU 9 Cb -0.07 -1.70 0.00 0.00 -0.44 0.00 0.00 34.13 31.92 2bb2 s GLU 9 CO 0.14 -2.81 0.00 0.09 0.95 0.00 0.00 175.26 173.63 2bb2 n ASN 10 N -4.33 -5.22 -2.91 0.83 3.02 -0.90 -2.17 115.26 103.58 2bb2 n ASN 10 Ca 0.09 0.26 -0.15 0.00 -0.03 0.00 0.00 54.58 54.75 2bb2 n ASN 10 Cb 0.53 -4.51 0.07 0.00 -0.61 0.00 0.00 39.78 35.26 2bb2 n ASN 10 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2bb2 n PHE 11 N -3.02 -1.86 -4.32 3.10 3.72 -1.07 -5.01 117.46 109.00 2bb2 n PHE 11 Ca -0.21 0.75 -0.26 0.00 -0.05 0.00 0.00 57.45 57.68 2bb2 n PHE 11 Cb 0.65 -4.36 -0.10 0.00 -0.94 0.00 0.00 39.48 34.73 2bb2 n PHE 11 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 2bb2 s GLN 12 N -5.31 1.98 1.20 -1.08 2.00 -0.92 -5.01 119.66 112.52 2bb2 s GLN 12 Ca 0.11 -1.33 0.00 0.00 -2.00 0.00 0.00 55.36 52.14 2bb2 s GLN 12 Cb -0.05 -2.10 0.00 0.00 0.80 0.00 0.00 33.01 31.66 2bb2 s GLN 12 CO 0.57 0.42 0.00 0.41 -0.50 0.00 0.00 175.29 176.19 2bb2 n GLY 13 N -0.00 -1.74 3.71 2.59 0.00 -1.26 -1.01 105.19 107.48 2bb2 n GLY 13 Ca -0.11 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 2bb2 n GLY 13 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2bb2 s HIS 14 N 0.00 2.69 0.11 1.61 5.65 -1.26 -4.68 115.29 119.40 2bb2 s HIS 14 Ca 0.00 0.25 0.07 0.00 0.25 0.00 0.00 55.06 55.63 2bb2 s HIS 14 Cb 0.00 -4.14 -0.04 0.00 -1.18 0.00 0.00 32.58 27.22 2bb2 s HIS 14 CO 0.00 -4.44 -0.10 -1.54 -0.65 0.00 0.00 174.74 168.01 2bb2 s SER 15 N 1.63 4.39 -0.16 9.88 1.04 -1.26 -0.29 113.70 128.92 2bb2 s SER 15 Ca 0.76 -0.40 -0.08 0.00 0.48 0.00 0.00 55.95 56.72 2bb2 s SER 15 Cb -0.48 -0.83 0.06 0.00 0.10 0.00 0.00 66.02 64.87 2bb2 s SER 15 CO 0.33 0.17 0.38 -2.28 0.98 0.00 0.00 173.24 172.83 2bb2 s HIS 16 N -1.23 -0.58 -0.08 5.02 2.46 -0.41 -4.98 115.29 115.49 2bb2 s HIS 16 Ca 0.21 1.23 -0.17 0.00 0.47 0.00 0.00 55.06 56.81 2bb2 s HIS 16 Cb -0.11 0.22 -0.05 0.00 -0.13 0.00 0.00 32.58 32.52 2bb2 s HIS 16 CO 0.14 -0.35 0.44 -2.00 -2.47 0.00 0.00 174.74 170.50 2bb2 s GLU 17 N 1.61 4.20 0.05 2.88 2.12 -1.26 -1.63 118.70 126.67 2bb2 s GLU 17 Ca -0.08 0.42 0.09 0.00 0.36 0.00 0.00 54.97 55.76 2bb2 s GLU 17 Cb -0.09 -3.36 -0.03 0.00 0.26 0.00 0.00 34.13 30.91 2bb2 s GLU 17 CO -0.12 0.35 -0.25 -0.51 -0.54 0.00 0.00 175.26 174.19 2bb2 s LEU 18 N 0.02 2.25 0.00 2.70 1.43 -0.52 -4.99 118.68 119.56 2bb2 s LEU 18 Ca 0.24 -0.57 0.00 0.00 -1.03 0.00 0.00 54.13 52.78 2bb2 s LEU 18 Cb -0.16 -1.32 0.00 0.00 0.03 0.00 0.00 46.19 44.74 2bb2 s LEU 18 CO 0.11 0.26 0.77 0.59 0.23 0.00 0.00 176.35 178.31 2bb2 n ASN 19 N 1.72 1.23 -2.14 2.29 3.02 -1.26 -2.58 115.26 117.54 2bb2 n ASN 19 Ca -0.17 -1.58 -0.03 0.00 -0.03 0.00 0.00 54.58 52.78 2bb2 n ASN 19 Cb 0.52 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.70 2bb2 n ASN 19 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bb2 n GLY 20 N -0.29 1.09 3.76 7.41 0.00 -1.26 -4.22 105.19 111.69 2bb2 n GLY 20 Ca 0.00 -1.07 -0.39 0.00 0.00 0.00 0.00 46.02 44.56 2bb2 n GLY 20 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bb2 s PRO 21 N -2.03 3.71 -0.37 1.61 0.04 -1.26 -4.75 135.00 131.95 2bb2 s PRO 21 Ca 0.11 2.18 0.01 0.00 0.04 0.00 0.00 61.00 63.34 2bb2 s PRO 21 Cb -0.02 -2.59 0.12 0.00 0.04 0.00 0.00 34.50 32.05 2bb2 s PRO 21 CO 0.04 -0.71 0.17 0.00 0.04 0.00 0.00 177.00 176.53 2bb2 h PRO 23 N 7.39 0.00 -1.64 0.00 0.10 -1.86 -2.00 132.00 133.98 2bb2 h PRO 23 Ca -0.06 0.00 -0.24 0.00 0.10 0.00 0.00 66.00 65.80 2bb2 h PRO 23 Cb 0.97 0.00 -0.27 0.00 0.10 0.00 0.00 31.00 31.80 2bb2 h PRO 23 CO 0.47 0.00 -0.58 1.21 0.10 0.00 0.00 178.00 179.19 2bb2 s ASN 24 N -4.88 0.27 0.66 -2.05 3.84 -1.25 -0.85 114.94 110.69 2bb2 s ASN 24 Ca -0.04 -1.03 0.30 0.00 0.21 0.00 0.00 52.86 52.31 2bb2 s ASN 24 Cb 0.11 1.07 1.63 0.00 -0.55 0.00 0.00 41.25 43.51 2bb2 s ASN 24 CO 0.36 -0.27 1.92 -0.07 -2.79 0.00 0.00 177.10 176.26 2bb2 h LEU 25 N 7.38 0.00 -1.90 3.21 4.07 -1.52 -2.11 115.31 124.45 2bb2 h LEU 25 Ca 0.01 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.94 2bb2 h LEU 25 Cb 1.10 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.84 2bb2 h LEU 25 CO 0.20 0.00 -0.12 0.07 -1.08 0.00 0.00 178.44 177.50 2bb2 h LYS 26 N 0.00 0.00 -0.00 1.13 2.10 -1.84 -1.49 116.57 116.46 2bb2 h LYS 26 Ca 0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.66 2bb2 h LYS 26 Cb 0.68 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.01 2bb2 h LYS 26 CO -0.00 0.12 0.06 0.93 -2.00 0.00 0.00 179.45 178.56 2bb2 h GLU 27 N 0.00 0.00 -0.14 0.07 4.39 -1.74 0.40 114.58 117.56 2bb2 h GLU 27 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2bb2 h GLU 27 Cb 0.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 2bb2 h GLU 27 CO 0.02 0.00 0.00 0.25 -1.16 0.00 0.00 179.01 178.12 2bb2 n THR 28 N -3.10 0.18 0.00 1.13 -2.24 -0.56 -4.92 114.28 104.77 2bb2 n THR 28 Ca -0.03 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 2bb2 n THR 28 Cb 0.13 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 68.95 2bb2 n THR 28 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bb2 n GLY 28 N 1.22 2.99 3.58 3.38 0.00 0.13 -4.91 105.19 111.59 2bb2 n GLY 28 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2bb2 n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bb2 s VAL 29 N -1.64 4.67 0.16 1.61 1.01 -1.26 -4.92 120.40 120.02 2bb2 s VAL 29 Ca 0.00 0.91 -0.23 0.00 0.00 0.00 0.00 61.98 62.66 2bb2 s VAL 29 Cb 0.00 -4.26 0.05 0.00 0.00 0.00 0.00 36.38 32.17 2bb2 s VAL 29 CO 0.00 -0.51 1.61 -0.08 0.00 0.00 0.00 175.10 176.12 2bb2 h GLU 30 N 8.56 -0.24 -2.20 2.72 4.81 -1.90 -3.42 114.58 122.92 2bb2 h GLU 30 Ca -0.24 0.02 -0.20 0.00 -0.13 0.00 0.00 59.36 58.80 2bb2 h GLU 30 Cb 1.09 0.06 -0.32 0.00 0.63 0.00 0.00 28.75 30.21 2bb2 h GLU 30 CO 0.94 -0.16 -0.52 0.21 -0.73 0.00 0.00 179.01 178.75 2bb2 s LYS 31 N -6.04 0.28 0.15 1.92 2.20 -1.26 -4.95 119.74 112.04 2bb2 s LYS 31 Ca -0.15 0.48 -0.34 0.00 -0.36 0.00 0.00 55.97 55.60 2bb2 s LYS 31 Cb 0.13 -0.63 -0.15 0.00 -1.51 0.00 0.00 37.83 35.67 2bb2 s LYS 31 CO 0.68 -0.60 1.39 0.00 -0.36 0.00 0.00 175.35 176.46 2bb2 n ALA 32 N 5.35 0.07 -0.06 3.13 0.00 -1.26 -4.72 120.51 123.01 2bb2 n ALA 32 Ca -0.05 0.47 -0.05 0.00 0.00 0.00 0.00 53.44 53.82 2bb2 n ALA 32 Cb 0.50 -2.18 -0.10 0.00 0.00 0.00 0.00 19.45 17.67 2bb2 n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bb2 n GLY 33 N 2.65 -0.64 3.48 0.00 0.00 -0.50 -4.86 105.19 105.32 2bb2 n GLY 33 Ca 0.16 -0.23 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 2bb2 n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bb2 s SER 34 N -4.50 -0.59 -0.00 1.61 1.04 -1.10 -3.84 113.70 106.31 2bb2 s SER 34 Ca -0.06 0.62 0.02 0.00 0.48 0.00 0.00 55.95 57.00 2bb2 s SER 34 Cb 0.04 0.51 -0.01 0.00 0.10 0.00 0.00 66.02 66.67 2bb2 s SER 34 CO 0.54 -0.60 -0.07 -0.69 0.98 0.00 0.00 173.24 173.40 2bb2 s VAL 35 N -1.27 0.52 -0.14 5.02 1.01 -0.97 -0.55 120.40 124.02 2bb2 s VAL 35 Ca -0.11 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.54 2bb2 s VAL 35 Cb -0.01 -0.45 0.02 0.00 0.00 0.00 0.00 36.38 35.95 2bb2 s VAL 35 CO 0.09 0.11 -0.14 -0.22 0.00 0.00 0.00 175.10 174.94 2bb2 s LEU 36 N -0.25 1.66 -0.26 3.92 2.96 0.16 -2.05 118.68 124.82 2bb2 s LEU 36 Ca 0.02 -0.46 -0.08 0.00 -0.22 0.00 0.00 54.13 53.38 2bb2 s LEU 36 Cb -0.03 -1.14 -0.03 0.00 0.50 0.00 0.00 46.19 45.48 2bb2 s LEU 36 CO -0.00 -0.05 0.10 -0.69 -1.32 0.00 0.00 176.35 174.40 2bb2 s VAL 37 N 1.40 4.60 -0.08 1.68 1.01 -0.79 0.10 120.40 128.32 2bb2 s VAL 37 Ca 0.03 -0.07 0.12 0.00 0.00 0.00 0.00 61.98 62.06 2bb2 s VAL 37 Cb -0.13 -3.16 -0.18 0.00 0.00 0.00 0.00 36.38 32.90 2bb2 s VAL 37 CO -0.09 0.32 0.15 0.00 0.00 0.00 0.00 175.10 175.48 2bb2 n GLN 38 N 4.94 1.28 -3.51 2.72 6.02 -0.18 -1.54 117.38 127.11 2bb2 n GLN 38 Ca -0.16 -0.06 -0.14 0.00 -0.01 0.00 0.00 57.00 56.64 2bb2 n GLN 38 Cb 0.52 -1.33 -0.12 0.00 1.02 0.00 0.00 30.24 30.33 2bb2 n GLN 38 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2bb2 s ALA 39 N -2.58 -0.59 0.00 -1.58 0.00 -0.82 -4.90 121.76 111.29 2bb2 s ALA 39 Ca -0.06 0.65 0.00 0.00 0.00 0.00 0.00 51.96 52.55 2bb2 s ALA 39 Cb 0.06 -1.33 0.00 0.00 0.00 0.00 0.00 23.12 21.85 2bb2 s ALA 39 CO 0.55 -1.06 0.00 0.41 0.00 0.00 0.00 175.76 175.66 2bb2 n GLY 40 N 5.34 5.48 3.92 0.00 0.00 -1.26 -0.78 105.19 117.89 2bb2 n GLY 40 Ca -0.05 -1.39 -0.27 0.00 0.00 0.00 0.00 46.02 44.31 2bb2 n GLY 40 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bb2 s PRO 41 N 1.46 2.00 0.16 1.61 0.04 -1.26 -4.95 135.00 134.05 2bb2 s PRO 41 Ca 0.00 -0.17 0.06 0.00 0.04 0.00 0.00 61.00 60.93 2bb2 s PRO 41 Cb 0.00 -2.08 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 2bb2 s PRO 41 CO 0.00 -1.45 -0.13 -1.58 0.04 0.00 0.00 177.00 173.89 2bb2 s TRP 42 N -3.40 1.43 -0.12 0.56 0.52 -0.18 -0.98 118.94 116.78 2bb2 s TRP 42 Ca 0.62 -0.64 0.03 0.00 0.02 0.00 0.00 56.10 56.13 2bb2 s TRP 42 Cb -0.10 -0.71 0.00 0.00 -1.15 0.00 0.00 33.47 31.51 2bb2 s TRP 42 CO 0.47 0.18 -0.23 0.54 0.02 0.00 0.00 176.95 177.93 2bb2 s VAL 43 N -2.86 2.12 0.18 4.03 0.11 -0.77 -0.83 120.40 122.37 2bb2 s VAL 43 Ca 0.16 -0.98 0.07 0.00 -2.93 0.00 0.00 61.98 58.29 2bb2 s VAL 43 Cb -0.01 -1.83 -0.04 0.00 -1.53 0.00 0.00 36.38 32.98 2bb2 s VAL 43 CO 0.03 0.55 0.04 -0.83 -3.33 0.00 0.00 175.10 171.57 2bb2 s GLY 44 N 0.52 1.72 0.11 6.54 0.00 0.68 -2.10 107.32 114.79 2bb2 s GLY 44 Ca -0.14 -1.33 0.08 0.00 0.00 0.00 0.00 44.72 43.33 2bb2 s GLY 44 CO 0.05 -1.35 -0.21 -0.19 0.00 0.00 0.00 173.10 171.40 2bb2 s TYR 45 N -1.76 1.80 0.18 1.90 1.51 0.42 -1.30 117.35 120.11 2bb2 s TYR 45 Ca 0.29 -0.42 -0.12 0.00 -1.01 0.00 0.00 57.07 55.81 2bb2 s TYR 45 Cb -0.09 -0.98 0.09 0.00 -0.11 0.00 0.00 41.96 40.86 2bb2 s TYR 45 CO 0.20 0.21 1.77 1.49 -1.11 0.00 0.00 175.55 178.12 2bb2 h GLU 46 N 4.04 0.89 -5.81 -0.62 4.81 -0.46 0.61 114.58 118.03 2bb2 h GLU 46 Ca -0.46 -0.12 -0.59 0.00 -0.13 0.00 0.00 59.36 58.06 2bb2 h GLU 46 Cb 1.18 -0.16 -0.10 0.00 0.63 0.00 0.00 28.75 30.30 2bb2 h GLU 46 CO 0.40 0.70 -0.52 -0.65 -0.73 0.00 0.00 179.01 178.21 2bb2 s GLN 47 N -5.74 2.15 0.89 1.92 -0.21 0.42 -3.75 119.66 115.34 2bb2 s GLN 47 Ca -0.13 -1.94 -0.10 0.00 0.02 0.00 0.00 55.36 53.20 2bb2 s GLN 47 Cb 0.13 -1.87 0.13 0.00 1.00 0.00 0.00 33.01 32.40 2bb2 s GLN 47 CO 0.79 -0.12 1.12 0.00 -2.12 0.00 0.00 175.29 174.96 2bb2 s ALA 48 N -2.64 1.55 -1.46 6.09 0.00 -1.26 -3.01 121.76 121.02 2bb2 s ALA 48 Ca 0.38 0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.75 2bb2 s ALA 48 Cb 0.05 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.80 2bb2 s ALA 48 CO 0.21 -2.55 0.00 0.09 0.00 0.00 0.00 175.76 173.51 2bb2 n ASN 49 N -4.07 -4.66 -2.59 0.00 3.02 -0.03 -3.21 115.26 103.71 2bb2 n ASN 49 Ca 0.10 0.24 -0.12 0.00 -0.03 0.00 0.00 54.58 54.77 2bb2 n ASN 49 Cb 0.53 -3.57 0.06 0.00 -0.61 0.00 0.00 39.78 36.19 2bb2 n ASN 49 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bb2 s LYS 51 N -5.11 1.23 1.96 0.00 3.01 -1.19 -5.02 119.74 114.63 2bb2 s LYS 51 Ca 0.08 -1.51 0.00 0.00 -1.01 0.00 0.00 55.97 53.54 2bb2 s LYS 51 Cb -0.04 -1.00 0.00 0.00 -1.01 0.00 0.00 37.83 35.78 2bb2 s LYS 51 CO 0.48 0.17 0.00 0.41 0.51 0.00 0.00 175.35 176.92 2bb2 n GLY 52 N -0.20 -0.76 3.72 -3.33 0.00 -1.26 0.16 105.19 103.51 2bb2 n GLY 52 Ca -0.10 -1.37 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 2bb2 n GLY 52 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2bb2 n GLU 53 N 0.00 2.22 -4.02 1.61 2.13 -1.26 -4.59 120.64 116.73 2bb2 n GLU 53 Ca 0.00 0.78 -0.33 0.00 0.66 0.00 0.00 57.16 58.27 2bb2 n GLU 53 Cb 0.00 -2.42 -0.06 0.00 0.27 0.00 0.00 31.44 29.23 2bb2 n GLU 53 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 2bb2 s GLN 54 N -2.00 3.21 -0.06 5.31 -0.21 -1.26 -0.13 119.66 124.52 2bb2 s GLN 54 Ca 0.56 -0.41 -0.03 0.00 0.02 0.00 0.00 55.36 55.51 2bb2 s GLN 54 Cb -0.53 -2.96 0.04 0.00 1.00 0.00 0.00 33.01 30.55 2bb2 s GLN 54 CO 0.62 0.67 0.10 -0.06 -2.12 0.00 0.00 175.29 174.49 2bb2 s PHE 55 N -1.22 -0.02 -0.11 0.91 0.08 -0.42 -4.98 117.98 112.21 2bb2 s PHE 55 Ca 0.24 0.38 -0.14 0.00 0.12 0.00 0.00 56.93 57.52 2bb2 s PHE 55 Cb -0.12 -0.41 -0.05 0.00 -0.57 0.00 0.00 43.02 41.88 2bb2 s PHE 55 CO 0.15 -0.23 0.33 0.08 -0.10 0.00 0.00 175.22 175.45 2bb2 s VAL 56 N 2.21 5.25 -0.20 -0.44 1.01 -1.26 -0.23 120.40 126.74 2bb2 s VAL 56 Ca 0.04 0.64 -0.04 0.00 0.00 0.00 0.00 61.98 62.62 2bb2 s VAL 56 Cb -0.12 -3.65 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 2bb2 s VAL 56 CO -0.04 0.44 -0.04 -0.36 0.00 0.00 0.00 175.10 175.10 2bb2 s PHE 57 N 0.01 2.97 0.22 5.22 0.40 -0.01 -4.98 117.98 121.80 2bb2 s PHE 57 Ca 0.19 -0.72 0.07 0.00 -0.60 0.00 0.00 56.93 55.87 2bb2 s PHE 57 Cb -0.14 -2.06 -0.04 0.00 0.51 0.00 0.00 43.02 41.29 2bb2 s PHE 57 CO 0.07 -0.39 0.16 -1.21 0.70 0.00 0.00 175.22 174.55 2bb2 s GLU 58 N 1.16 2.87 -0.21 0.44 2.02 -1.26 -1.01 118.70 122.70 2bb2 s GLU 58 Ca 0.02 -1.01 -0.39 0.00 0.02 0.00 0.00 54.97 53.61 2bb2 s GLU 58 Cb -0.14 -2.57 -0.15 0.00 0.10 0.00 0.00 34.13 31.37 2bb2 s GLU 58 CO -0.00 0.43 1.70 1.17 0.02 0.00 0.00 175.26 178.58 2bb2 n LYS 59 N -0.87 1.24 -3.25 1.61 4.81 -1.26 -4.72 118.16 115.72 2bb2 n LYS 59 Ca -0.08 0.45 0.00 0.00 -0.87 0.00 0.00 58.31 57.81 2bb2 n LYS 59 Cb 0.57 -2.15 0.00 0.00 0.02 0.00 0.00 35.03 33.47 2bb2 n LYS 59 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2bb2 n GLY 60 N 3.99 -0.98 3.43 3.14 0.00 -0.59 -4.98 105.19 109.20 2bb2 n GLY 60 Ca 0.25 -1.36 -0.33 0.00 0.00 0.00 0.00 46.02 44.58 2bb2 n GLY 60 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bb2 s GLU 61 N -1.99 3.05 -0.78 1.61 2.02 -1.26 -1.88 118.70 119.47 2bb2 s GLU 61 Ca 0.00 -0.67 0.03 0.00 0.02 0.00 0.00 54.97 54.35 2bb2 s GLU 61 Cb 0.00 -2.56 0.19 0.00 0.10 0.00 0.00 34.13 31.87 2bb2 s GLU 61 CO 0.00 0.39 0.63 0.66 0.02 0.00 0.00 175.26 176.96 2bb2 n TYR 62 N 3.00 3.61 0.74 1.61 4.02 -0.87 -5.01 117.16 124.26 2bb2 n TYR 62 Ca -0.18 -4.22 0.07 0.00 -0.01 0.00 0.00 57.90 53.56 2bb2 n TYR 62 Cb 0.53 -0.80 0.37 0.00 -0.02 0.00 0.00 39.34 39.41 2bb2 n TYR 62 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 2bb2 n PRO 63 N 1.97 0.32 -3.53 -0.72 -0.04 -1.26 -2.28 135.00 129.45 2bb2 n PRO 63 Ca 0.21 0.07 -0.11 0.00 -0.04 0.00 0.00 63.50 63.64 2bb2 n PRO 63 Cb 0.36 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.30 2bb2 n PRO 63 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2bb2 s ARG 64 N -2.25 1.40 0.41 0.54 0.52 -1.25 -2.12 118.95 116.19 2bb2 s ARG 64 Ca 0.17 -0.60 0.09 0.00 -0.52 0.00 0.00 55.73 54.87 2bb2 s ARG 64 Cb 0.09 0.59 0.90 0.00 0.52 0.00 0.00 34.95 37.05 2bb2 s ARG 64 CO 0.17 -0.62 2.01 0.11 0.02 0.00 0.00 175.30 176.99 2bb2 h TRP 65 N 2.00 0.53 0.00 -0.53 5.08 -1.88 -1.69 115.95 119.46 2bb2 h TRP 65 Ca -0.30 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.68 2bb2 h TRP 65 Cb 1.29 -0.18 0.00 0.00 -3.00 0.00 0.00 29.16 27.28 2bb2 h TRP 65 CO 0.28 0.30 0.00 -0.40 -1.28 0.00 0.00 178.44 177.34 2bb2 n ASP 66 N -4.47 0.09 0.07 0.11 5.68 -1.26 -1.57 116.55 115.19 2bb2 n ASP 66 Ca 0.07 0.52 0.12 0.00 -0.50 0.00 0.00 54.79 54.99 2bb2 n ASP 66 Cb 0.21 -0.54 0.45 0.00 -1.14 0.00 0.00 41.12 40.10 2bb2 n ASP 66 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2bb2 n SER 67 N -1.59 0.44 0.00 -1.12 3.41 -0.64 -4.10 113.62 110.02 2bb2 n SER 67 Ca 0.04 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.23 2bb2 n SER 67 Cb 0.22 -0.68 0.00 0.00 -0.26 0.00 0.00 64.21 63.49 2bb2 n SER 67 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 2bb2 n TRP 68 N -1.94 0.00 -3.57 7.33 2.14 -0.61 -5.01 117.44 115.77 2bb2 n TRP 68 Ca 0.04 0.00 -0.19 0.00 2.07 0.00 0.00 57.50 59.42 2bb2 n TRP 68 Cb 0.29 0.00 -0.01 0.00 -0.81 0.00 0.00 31.31 30.78 2bb2 n TRP 68 CO 0.00 0.00 0.00 0.95 2.07 0.00 0.00 177.69 180.71 2bb2 s THR 69 N -1.18 4.30 0.00 -1.67 -4.23 -1.04 -4.79 115.64 107.02 2bb2 s THR 69 Ca 0.00 -1.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.51 2bb2 s THR 69 Cb 0.00 -3.50 0.00 0.00 1.34 0.00 0.00 72.50 70.34 2bb2 s THR 69 CO 0.00 -0.19 0.00 -0.24 -0.54 0.00 0.00 174.62 173.65 2bb2 n SER 70 N -1.59 0.00 0.00 3.99 2.88 -1.26 -4.89 113.62 112.75 2bb2 n SER 70 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 2bb2 n SER 70 Cb 0.58 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.04 2bb2 n SER 70 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2bb2 n ARG 71 N 6.52 0.00 -4.48 -1.46 0.63 -1.26 -5.19 116.66 111.42 2bb2 n ARG 71 Ca 0.00 0.00 -0.25 0.00 -0.92 0.00 0.00 57.85 56.68 2bb2 n ARG 71 Cb 0.00 0.00 -0.13 0.00 0.45 0.00 0.00 32.46 32.78 2bb2 n ARG 71 CO 0.00 0.00 0.00 -0.08 -2.51 0.00 0.00 177.63 175.04 2bb2 s THR 72 N 0.00 1.76 -2.14 5.15 -1.32 -1.26 -5.10 115.64 112.72 2bb2 s THR 72 Ca 0.00 -1.40 0.18 0.00 -1.21 0.00 0.00 61.69 59.25 2bb2 s THR 72 Cb 0.00 -1.56 0.18 0.00 -1.51 0.00 0.00 72.50 69.61 2bb2 s THR 72 CO 0.00 0.09 1.10 -0.90 -2.21 0.00 0.00 174.62 172.69 2bb2 n ASP 73 N 1.43 2.58 -4.71 8.08 5.75 -1.26 -4.90 116.55 123.52 2bb2 n ASP 73 Ca -0.18 -1.77 -0.42 0.00 -0.01 0.00 0.00 54.79 52.41 2bb2 n ASP 73 Cb 0.53 -0.04 -0.03 0.00 -1.03 0.00 0.00 41.12 40.56 2bb2 n ASP 73 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2bb2 s SER 74 N -1.43 6.85 -0.27 -1.12 0.01 -1.26 -4.89 113.70 111.60 2bb2 s SER 74 Ca 0.22 2.27 -0.02 0.00 1.31 0.00 0.00 55.95 59.73 2bb2 s SER 74 Cb 0.15 -2.58 0.09 0.00 0.21 0.00 0.00 66.02 63.89 2bb2 s SER 74 CO 0.22 -0.64 0.09 -0.22 0.41 0.00 0.00 173.24 173.10 2bb2 s LEU 75 N 1.27 1.36 -0.00 2.44 2.96 -1.26 -4.41 118.68 121.04 2bb2 s LEU 75 Ca 0.64 -1.29 0.03 0.00 -0.22 0.00 0.00 54.13 53.29 2bb2 s LEU 75 Cb -0.35 -0.61 -0.03 0.00 0.50 0.00 0.00 46.19 45.70 2bb2 s LEU 75 CO 0.30 -0.39 0.09 -1.20 -1.32 0.00 0.00 176.35 173.82 2bb2 n SER 76 N 5.04 1.32 -3.90 3.68 7.64 0.19 -4.55 113.62 123.04 2bb2 n SER 76 Ca -0.05 -0.40 -0.11 0.00 1.01 0.00 0.00 58.87 59.32 2bb2 n SER 76 Cb 0.44 1.03 -0.10 0.00 -1.01 0.00 0.00 64.21 64.57 2bb2 n SER 76 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2bb2 s SER 77 N -1.53 0.09 0.02 6.43 1.04 -1.14 -1.82 113.70 116.78 2bb2 s SER 77 Ca 0.00 -0.30 -0.03 0.00 0.48 0.00 0.00 55.95 56.10 2bb2 s SER 77 Cb 0.02 0.17 -0.01 0.00 0.10 0.00 0.00 66.02 66.30 2bb2 s SER 77 CO 0.10 -0.35 0.05 -0.76 0.98 0.00 0.00 173.24 173.26 2bb2 s LEU 78 N -1.41 1.95 -0.12 2.42 1.43 -0.75 -0.43 118.68 121.76 2bb2 s LEU 78 Ca -0.15 -0.43 -0.22 0.00 -1.03 0.00 0.00 54.13 52.30 2bb2 s LEU 78 Cb -0.08 0.38 0.05 0.00 0.03 0.00 0.00 46.19 46.57 2bb2 s LEU 78 CO 0.01 -0.37 0.55 0.00 0.23 0.00 0.00 176.35 176.76 2bb2 s ARG 79 N -1.74 0.78 0.71 1.70 1.70 -0.89 -0.68 118.95 120.54 2bb2 s ARG 79 Ca -0.13 0.42 -0.11 0.00 -0.47 0.00 0.00 55.73 55.45 2bb2 s ARG 79 Cb -0.07 0.37 0.02 0.00 -0.57 0.00 0.00 34.95 34.70 2bb2 s ARG 79 CO -0.01 -0.18 1.07 -2.14 -1.08 0.00 0.00 175.30 172.96 2bb2 s PRO 80 N -0.49 2.83 -0.18 3.89 0.02 -1.26 -1.85 135.00 137.97 2bb2 s PRO 80 Ca -0.06 0.86 -0.08 0.00 0.02 0.00 0.00 61.00 61.74 2bb2 s PRO 80 Cb -0.03 -1.99 -0.04 0.00 0.02 0.00 0.00 34.50 32.46 2bb2 s PRO 80 CO 0.04 -1.15 0.08 0.42 -0.33 0.00 0.00 177.00 176.07 2bb2 s ILE 81 N -3.09 4.98 -0.59 2.83 1.01 -0.15 -4.78 121.20 121.40 2bb2 s ILE 81 Ca 0.58 0.03 -0.23 0.00 0.00 0.00 0.00 60.65 61.03 2bb2 s ILE 81 Cb -0.14 -3.24 0.05 0.00 0.01 0.00 0.00 42.46 39.15 2bb2 s ILE 81 CO 0.55 0.47 0.94 -0.54 0.00 0.00 0.00 174.94 176.35 2bb2 s LYS 82 N 0.23 3.23 0.16 2.79 -0.14 -1.26 -4.62 119.74 120.13 2bb2 s LYS 82 Ca 0.05 -0.52 -0.30 0.00 -1.36 0.00 0.00 55.97 53.84 2bb2 s LYS 82 Cb -0.12 -4.12 -0.08 0.00 -1.68 0.00 0.00 37.83 31.83 2bb2 s LYS 82 CO -0.00 -1.61 1.26 0.08 -0.76 0.00 0.00 175.35 174.32 2bb2 s VAL 83 N 3.95 3.49 -0.55 3.17 1.01 -1.26 -4.99 120.40 125.23 2bb2 s VAL 83 Ca 0.26 1.19 -0.20 0.00 0.00 0.00 0.00 61.98 63.24 2bb2 s VAL 83 Cb -0.14 -3.76 0.07 0.00 0.00 0.00 0.00 36.38 32.55 2bb2 s VAL 83 CO 0.15 0.16 0.69 -0.62 0.00 0.00 0.00 175.10 175.48 2bb2 s ASP 84 N 0.48 6.21 -0.35 3.32 2.15 -1.26 -4.97 116.67 122.25 2bb2 s ASP 84 Ca 0.57 -1.05 0.00 0.00 0.43 0.00 0.00 52.55 52.50 2bb2 s ASP 84 Cb -0.34 -2.31 0.14 0.00 -0.30 0.00 0.00 42.92 40.11 2bb2 s ASP 84 CO 0.35 -1.02 0.24 -0.55 -0.17 0.00 0.00 175.17 174.02 2bb2 s SER 85 N 3.06 2.62 -0.54 -0.34 0.15 -1.26 -5.11 113.70 112.28 2bb2 s SER 85 Ca 0.15 -1.98 -0.27 0.00 0.70 0.00 0.00 55.95 54.56 2bb2 s SER 85 Cb -0.20 -0.18 -0.03 0.00 -1.71 0.00 0.00 66.02 63.90 2bb2 s SER 85 CO 0.10 -0.31 1.92 -1.10 1.20 0.00 0.00 173.24 175.06 2bb2 s GLN 86 N 1.24 2.68 0.38 5.44 -0.21 -1.26 -5.09 119.66 122.85 2bb2 s GLN 86 Ca 0.17 0.87 0.08 0.00 0.02 0.00 0.00 55.36 56.49 2bb2 s GLN 86 Cb -0.21 -4.38 -0.02 0.00 1.00 0.00 0.00 33.01 29.40 2bb2 s GLN 86 CO -0.03 -2.65 0.38 -1.21 -2.12 0.00 0.00 175.29 169.66 2bb2 s GLU 87 N 6.95 2.67 -0.27 2.91 2.02 -1.26 -5.08 118.70 126.65 2bb2 s GLU 87 Ca 0.74 -1.39 -0.08 0.00 0.02 0.00 0.00 54.97 54.26 2bb2 s GLU 87 Cb -0.15 -2.48 -0.02 0.00 0.10 0.00 0.00 34.13 31.57 2bb2 s GLU 87 CO 0.24 -0.09 0.10 -1.01 0.02 0.00 0.00 175.26 174.51 2bb2 s HIS 88 N -2.38 3.12 0.01 1.61 3.76 -1.26 -4.81 115.29 115.33 2bb2 s HIS 88 Ca 0.46 -0.48 0.02 0.00 -0.15 0.00 0.00 55.06 54.91 2bb2 s HIS 88 Cb -0.05 -2.27 -0.01 0.00 1.11 0.00 0.00 32.58 31.36 2bb2 s HIS 88 CO 0.28 -0.39 -0.06 0.21 -0.85 0.00 0.00 174.74 173.93 2bb2 s LYS 89 N 1.61 0.47 -0.02 1.40 2.20 -1.09 -0.10 119.74 124.21 2bb2 s LYS 89 Ca 0.06 -0.31 0.02 0.00 -0.36 0.00 0.00 55.97 55.37 2bb2 s LYS 89 Cb -0.16 -0.42 0.00 0.00 -1.51 0.00 0.00 37.83 35.75 2bb2 s LYS 89 CO 0.04 0.11 -0.07 -1.50 -0.36 0.00 0.00 175.35 173.57 2bb2 s ILE 90 N -0.38 0.61 -0.12 5.43 2.07 -0.70 -2.15 121.20 125.97 2bb2 s ILE 90 Ca -0.00 -0.27 0.03 0.00 -1.41 0.00 0.00 60.65 59.00 2bb2 s ILE 90 Cb -0.04 -0.55 0.01 0.00 0.13 0.00 0.00 42.46 42.01 2bb2 s ILE 90 CO -0.00 0.20 -0.23 -0.89 -1.91 0.00 0.00 174.94 172.11 2bb2 s THR 91 N 0.18 2.05 -0.10 4.00 2.01 -1.03 -1.24 115.64 121.50 2bb2 s THR 91 Ca -0.02 -0.99 -0.02 0.00 0.31 0.00 0.00 61.69 60.97 2bb2 s THR 91 Cb -0.07 -1.79 -0.03 0.00 0.01 0.00 0.00 72.50 70.62 2bb2 s THR 91 CO 0.00 0.55 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.70 2bb2 s LEU 92 N 0.60 3.41 0.08 4.42 1.02 0.60 -1.46 118.68 127.35 2bb2 s LEU 92 Ca -0.12 0.05 0.09 0.00 0.02 0.00 0.00 54.13 54.16 2bb2 s LEU 92 Cb -0.17 -1.78 -0.03 0.00 0.02 0.00 0.00 46.19 44.23 2bb2 s LEU 92 CO 0.03 0.33 -0.25 -0.31 0.02 0.00 0.00 176.35 176.17 2bb2 s TYR 93 N -0.60 2.13 0.10 0.29 1.51 -0.16 -0.39 117.35 120.24 2bb2 s TYR 93 Ca 0.09 -0.40 -0.20 0.00 -1.01 0.00 0.00 57.07 55.56 2bb2 s TYR 93 Cb -0.12 -1.22 -0.09 0.00 -0.11 0.00 0.00 41.96 40.42 2bb2 s TYR 93 CO 0.02 0.20 1.68 1.49 -1.11 0.00 0.00 175.55 177.83 2bb2 h GLU 94 N 4.42 0.26 -6.17 -0.62 4.81 0.10 -0.67 114.58 116.71 2bb2 h GLU 94 Ca -0.47 -0.04 -0.51 0.00 -0.13 0.00 0.00 59.36 58.22 2bb2 h GLU 94 Cb 1.16 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.44 2bb2 h GLU 94 CO 0.42 0.28 -0.47 -0.80 -0.73 0.00 0.00 179.01 177.70 2bb2 s ASN 95 N -5.50 5.14 0.96 1.04 0.01 0.54 -2.90 114.94 114.23 2bb2 s ASN 95 Ca -0.13 -0.56 -0.11 0.00 -0.71 0.00 0.00 52.86 51.34 2bb2 s ASN 95 Cb 0.07 -0.92 0.17 0.00 0.41 0.00 0.00 41.25 40.98 2bb2 s ASN 95 CO 0.70 -0.34 1.10 -2.84 -1.51 0.00 0.00 177.10 174.21 2bb2 s PRO 96 N -3.96 0.73 -1.45 -0.60 0.02 -1.26 -3.06 135.00 125.42 2bb2 s PRO 96 Ca 0.40 1.18 -0.03 0.00 0.02 0.00 0.00 61.00 62.57 2bb2 s PRO 96 Cb -0.05 -1.72 0.00 0.00 0.02 0.00 0.00 34.50 32.75 2bb2 s PRO 96 CO 0.26 -2.71 0.37 -1.71 -0.33 0.00 0.00 177.00 172.88 2bb2 n ASN 97 N -4.25 -5.55 -2.28 2.53 5.15 0.32 -3.04 115.26 108.13 2bb2 n ASN 97 Ca 0.08 -0.18 -0.17 0.00 -0.60 0.00 0.00 54.58 53.71 2bb2 n ASN 97 Cb 0.53 -4.45 0.02 0.00 -0.53 0.00 0.00 39.78 35.35 2bb2 n ASN 97 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2bb2 n PHE 98 N -4.27 -1.34 -4.58 1.20 3.72 -1.23 -5.00 117.46 105.97 2bb2 n PHE 98 Ca -0.14 0.30 -0.26 0.00 -0.05 0.00 0.00 57.45 57.29 2bb2 n PHE 98 Cb 0.63 -3.68 -0.10 0.00 -0.94 0.00 0.00 39.48 35.39 2bb2 n PHE 98 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2bb2 s THR 99 N -2.98 1.41 0.00 4.37 -4.23 -1.17 -5.01 115.64 108.02 2bb2 s THR 99 Ca 0.17 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.68 2bb2 s THR 99 Cb -0.08 -2.70 0.00 0.00 1.34 0.00 0.00 72.50 71.06 2bb2 s THR 99 CO 0.21 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.90 2bb2 n GLY 100 N -0.92 -0.73 3.76 3.99 0.00 -1.26 -0.34 105.19 109.69 2bb2 n GLY 100 Ca -0.07 -1.29 -0.36 0.00 0.00 0.00 0.00 46.02 44.30 2bb2 n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bb2 s LYS 101 N 0.00 3.06 0.17 1.61 1.02 -1.26 -4.64 119.74 119.70 2bb2 s LYS 101 Ca 0.00 1.79 0.04 0.00 0.02 0.00 0.00 55.97 57.82 2bb2 s LYS 101 Cb 0.00 -1.95 -0.05 0.00 -0.52 0.00 0.00 37.83 35.31 2bb2 s LYS 101 CO 0.00 -1.13 -0.08 -1.59 -0.92 0.00 0.00 175.35 171.64 2bb2 s LYS 102 N -3.31 1.16 -0.08 1.68 -2.85 -1.26 0.13 119.74 115.21 2bb2 s LYS 102 Ca 0.76 -1.52 -0.03 0.00 -1.00 0.00 0.00 55.97 54.18 2bb2 s LYS 102 Cb -0.29 -0.66 0.04 0.00 -2.06 0.00 0.00 37.83 34.86 2bb2 s LYS 102 CO 0.32 0.04 0.15 1.41 0.10 0.00 0.00 175.35 177.36 2bb2 s MET 103 N -3.77 0.03 -0.07 1.78 1.75 0.48 -4.95 119.30 114.54 2bb2 s MET 103 Ca 0.20 0.52 -0.03 0.00 -1.25 0.00 0.00 55.69 55.13 2bb2 s MET 103 Cb 0.03 -0.28 -0.04 0.00 2.84 0.00 0.00 34.83 37.38 2bb2 s MET 103 CO 0.03 -0.29 0.09 -1.21 -0.65 0.00 0.00 175.02 172.99 2bb2 s GLU 104 N 2.12 3.20 -0.13 4.11 2.02 -1.26 -0.30 118.70 128.48 2bb2 s GLU 104 Ca 0.02 -0.32 0.00 0.00 0.02 0.00 0.00 54.97 54.68 2bb2 s GLU 104 Cb -0.12 -2.98 0.02 0.00 0.10 0.00 0.00 34.13 31.16 2bb2 s GLU 104 CO -0.05 0.71 -0.12 0.08 0.02 0.00 0.00 175.26 175.90 2bb2 s VAL 105 N -1.06 1.34 -0.29 2.63 1.01 -0.37 -5.01 120.40 118.65 2bb2 s VAL 105 Ca 0.18 -0.50 -0.07 0.00 0.00 0.00 0.00 61.98 61.59 2bb2 s VAL 105 Cb -0.12 -1.28 0.01 0.00 0.00 0.00 0.00 36.38 34.99 2bb2 s VAL 105 CO 0.07 0.42 0.08 -0.63 0.00 0.00 0.00 175.10 175.04 2bb2 s ILE 106 N 1.46 3.93 0.00 2.22 -1.09 -1.26 -1.72 121.20 124.75 2bb2 s ILE 106 Ca 0.03 -0.71 0.00 0.00 -2.23 0.00 0.00 60.65 57.74 2bb2 s ILE 106 Cb -0.13 -3.03 0.00 0.00 -1.58 0.00 0.00 42.46 37.72 2bb2 s ILE 106 CO -0.08 0.08 0.00 0.47 -1.23 0.00 0.00 174.94 174.18 2bb2 n ASP 106 N 4.86 0.00 -4.93 3.58 8.00 0.86 -4.91 116.55 124.01 2bb2 n ASP 106 Ca -0.15 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.10 2bb2 n ASP 106 Cb 0.48 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.64 2bb2 n ASP 106 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2bb2 s ASP 107 N 0.00 5.04 0.39 -2.24 1.01 -1.26 -4.78 116.67 114.83 2bb2 s ASP 107 Ca 0.00 0.51 -0.17 0.00 0.71 0.00 0.00 52.55 53.60 2bb2 s ASP 107 Cb 0.00 -1.26 -0.09 0.00 1.01 0.00 0.00 42.92 42.58 2bb2 s ASP 107 CO 0.00 -1.44 0.84 -1.81 0.21 0.00 0.00 175.17 172.98 2bb2 s ASP 108 N -4.46 6.80 -0.25 0.27 1.11 -1.26 -4.62 116.67 114.26 2bb2 s ASP 108 Ca 0.58 1.45 -0.02 0.00 0.18 0.00 0.00 52.55 54.74 2bb2 s ASP 108 Cb -0.11 -2.44 0.08 0.00 1.07 0.00 0.00 42.92 41.52 2bb2 s ASP 108 CO 0.45 -0.32 0.06 -0.69 1.18 0.00 0.00 175.17 175.85 2bb2 s VAL 109 N -2.16 0.69 -0.82 -1.27 1.01 -0.24 -4.99 120.40 112.62 2bb2 s VAL 109 Ca 0.57 -0.94 0.24 0.00 0.00 0.00 0.00 61.98 61.85 2bb2 s VAL 109 Cb -0.10 -1.33 0.23 0.00 0.00 0.00 0.00 36.38 35.18 2bb2 s VAL 109 CO 0.18 -0.42 1.74 -0.81 0.00 0.00 0.00 175.10 175.79 2bb2 n PRO 110 N 4.96 0.11 -3.61 2.72 -0.04 -1.26 -1.57 135.00 136.30 2bb2 n PRO 110 Ca -0.06 0.20 -0.06 0.00 -0.04 0.00 0.00 63.50 63.54 2bb2 n PRO 110 Cb 0.45 -1.66 -0.07 0.00 -0.04 0.00 0.00 33.50 32.18 2bb2 n PRO 110 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2bb2 s SER 111 N -3.65 -0.51 0.12 3.54 0.15 -1.25 0.80 113.70 112.89 2bb2 s SER 111 Ca 0.09 1.08 -0.11 0.00 0.70 0.00 0.00 55.95 57.72 2bb2 s SER 111 Cb 0.13 1.63 -0.11 0.00 -1.71 0.00 0.00 66.02 65.96 2bb2 s SER 111 CO 0.46 -0.24 1.35 -0.26 1.20 0.00 0.00 173.24 175.75 2bb2 h PHE 112 N 8.12 1.02 -0.22 3.44 -1.00 -1.63 -3.12 116.94 123.54 2bb2 h PHE 112 Ca -0.17 -0.43 -0.03 0.00 2.81 0.00 0.00 57.97 60.15 2bb2 h PHE 112 Cb 1.11 -0.17 -0.01 0.00 3.61 0.00 0.00 35.95 40.49 2bb2 h PHE 112 CO 0.23 1.25 0.01 0.45 -1.61 0.00 0.00 178.31 178.64 2bb2 h HIS 113 N 0.55 0.32 0.00 -0.55 3.86 -1.75 0.31 115.15 117.89 2bb2 h HIS 113 Ca -0.03 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 2bb2 h HIS 113 Cb 1.33 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.70 2bb2 h HIS 113 CO 0.08 0.33 0.00 0.00 0.86 0.00 0.00 177.93 179.20 2bb2 n ALA 114 N -2.49 1.64 0.90 2.45 0.00 -1.18 -1.79 120.51 120.04 2bb2 n ALA 114 Ca 0.00 -0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.50 2bb2 n ALA 114 Cb 0.19 -1.20 0.04 0.00 0.00 0.00 0.00 19.45 18.47 2bb2 n ALA 114 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2bb2 n HIS 116 N -1.41 0.00 -0.37 0.00 -0.00 0.98 -4.91 115.22 109.50 2bb2 n HIS 116 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.76 2bb2 n HIS 116 Cb 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.12 2bb2 n HIS 116 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2bb2 n GLY 117 N 1.28 0.76 3.59 -1.41 0.00 -0.74 -5.03 105.19 103.64 2bb2 n GLY 117 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 2bb2 n GLY 117 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2bb2 s TYR 118 N -2.31 3.23 -0.03 1.61 6.14 -0.50 -4.86 117.35 120.64 2bb2 s TYR 118 Ca 0.00 0.38 0.04 0.00 0.64 0.00 0.00 57.07 58.13 2bb2 s TYR 118 Cb 0.00 -2.71 0.06 0.00 0.42 0.00 0.00 41.96 39.73 2bb2 s TYR 118 CO 0.00 -0.34 0.98 1.04 0.64 0.00 0.00 175.55 177.87 2bb2 n GLN 118 N 5.50 0.35 -2.30 4.97 6.02 -1.26 -2.36 117.38 128.30 2bb2 n GLN 118 Ca -0.06 -1.27 -0.25 0.00 -0.01 0.00 0.00 57.00 55.40 2bb2 n GLN 118 Cb 0.50 -0.71 0.09 0.00 1.02 0.00 0.00 30.24 31.14 2bb2 n GLN 118 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2bb2 s GLU 119 N -0.60 1.88 0.95 -1.09 0.41 -1.26 -5.08 118.70 113.90 2bb2 s GLU 119 Ca 0.06 -0.53 -0.15 0.00 -0.41 0.00 0.00 54.97 53.94 2bb2 s GLU 119 Cb 0.06 -2.19 0.17 0.00 -1.78 0.00 0.00 34.13 30.39 2bb2 s GLU 119 CO 0.01 -1.41 1.25 -1.59 -0.49 0.00 0.00 175.26 173.03 2bb2 s LYS 120 N -5.27 0.81 -0.19 1.61 -2.85 -1.26 -4.89 119.74 107.69 2bb2 s LYS 120 Ca 0.63 -0.19 0.00 0.00 -1.00 0.00 0.00 55.97 55.42 2bb2 s LYS 120 Cb -0.08 -1.84 0.05 0.00 -2.06 0.00 0.00 37.83 33.89 2bb2 s LYS 120 CO 0.45 -2.33 -0.08 0.08 0.10 0.00 0.00 175.35 173.57 2bb2 s VAL 121 N -3.67 1.44 -0.13 1.79 1.01 0.42 -4.13 120.40 117.13 2bb2 s VAL 121 Ca 0.70 -0.92 0.12 0.00 0.00 0.00 0.00 61.98 61.88 2bb2 s VAL 121 Cb -0.07 -1.59 -0.17 0.00 0.00 0.00 0.00 36.38 34.55 2bb2 s VAL 121 CO 0.52 0.10 0.06 -1.20 0.00 0.00 0.00 175.10 174.59 2bb2 n SER 122 N 4.75 1.62 -4.00 3.32 7.64 -0.27 -3.60 113.62 123.08 2bb2 n SER 122 Ca -0.13 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.66 2bb2 n SER 122 Cb 0.46 0.88 -0.10 0.00 -1.01 0.00 0.00 64.21 64.45 2bb2 n SER 122 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2bb2 s SER 123 N -4.63 0.30 0.00 6.43 1.04 -1.18 0.05 113.70 115.72 2bb2 s SER 123 Ca -0.07 -0.66 0.01 0.00 0.48 0.00 0.00 55.95 55.71 2bb2 s SER 123 Cb 0.04 0.16 -0.00 0.00 0.10 0.00 0.00 66.02 66.32 2bb2 s SER 123 CO 0.56 -0.44 -0.02 -0.69 0.98 0.00 0.00 173.24 173.63 2bb2 s VAL 124 N -2.49 0.14 -0.33 5.02 1.01 0.12 -0.99 120.40 122.89 2bb2 s VAL 124 Ca -0.06 -0.16 -0.03 0.00 0.00 0.00 0.00 61.98 61.72 2bb2 s VAL 124 Cb -0.02 -0.14 0.06 0.00 0.00 0.00 0.00 36.38 36.27 2bb2 s VAL 124 CO -0.05 -0.02 0.07 -0.60 0.00 0.00 0.00 175.10 174.51 2bb2 s ARG 125 N -0.19 2.42 -0.28 2.72 3.52 -0.53 -0.09 118.95 126.50 2bb2 s ARG 125 Ca -0.01 -1.34 -0.11 0.00 -0.13 0.00 0.00 55.73 54.14 2bb2 s ARG 125 Cb -0.02 -3.34 -0.05 0.00 -1.56 0.00 0.00 34.95 29.99 2bb2 s ARG 125 CO -0.00 -0.71 0.19 0.08 -0.81 0.00 0.00 175.30 174.04 2bb2 s VAL 126 N 1.28 5.27 -0.02 7.11 1.01 0.39 -2.47 120.40 132.96 2bb2 s VAL 126 Ca -0.02 0.13 0.12 0.00 0.00 0.00 0.00 61.98 62.21 2bb2 s VAL 126 Cb -0.20 -3.52 -0.17 0.00 0.00 0.00 0.00 36.38 32.49 2bb2 s VAL 126 CO -0.00 0.24 1.00 -0.61 0.00 0.00 0.00 175.10 175.72 2bb2 h GLN 127 N 8.37 0.00 -1.87 2.72 4.15 -1.70 0.17 115.11 126.97 2bb2 h GLN 127 Ca -0.35 0.00 0.14 0.00 0.77 0.00 0.00 58.65 59.21 2bb2 h GLN 127 Cb 1.19 0.00 -0.19 0.00 0.21 0.00 0.00 27.48 28.69 2bb2 h GLN 127 CO 0.56 0.63 0.59 -1.54 -1.93 0.00 0.00 178.83 177.14 2bb2 s SER 128 N -6.29 -0.31 0.00 -0.69 1.04 -1.15 -4.89 113.70 101.41 2bb2 s SER 128 Ca -0.01 0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.53 2bb2 s SER 128 Cb 0.09 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.51 2bb2 s SER 128 CO 0.81 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 175.20 2bb2 n GLY 129 N 0.09 -0.24 3.19 7.32 0.00 -1.26 -2.68 105.19 111.61 2bb2 n GLY 129 Ca -0.07 -1.75 -0.34 0.00 0.00 0.00 0.00 46.02 43.85 2bb2 n GLY 129 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bb2 s THR 130 N -2.06 2.82 0.23 2.61 2.01 -1.26 -3.84 115.64 116.16 2bb2 s THR 130 Ca 0.00 -1.09 0.07 0.00 0.31 0.00 0.00 61.69 60.98 2bb2 s THR 130 Cb 0.00 -2.46 -0.05 0.00 0.01 0.00 0.00 72.50 70.00 2bb2 s THR 130 CO 0.00 0.17 -0.11 0.26 -0.69 0.00 0.00 174.62 174.25 2bb2 s TRP 131 N 1.30 1.79 -0.17 4.92 0.52 -0.34 -0.22 118.94 126.75 2bb2 s TRP 131 Ca -0.01 -0.63 -0.00 0.00 0.02 0.00 0.00 56.10 55.48 2bb2 s TRP 131 Cb -0.17 -0.91 0.04 0.00 -1.15 0.00 0.00 33.47 31.28 2bb2 s TRP 131 CO -0.04 0.31 -0.05 0.08 0.02 0.00 0.00 176.95 177.27 2bb2 s VAL 132 N -3.01 1.14 0.05 4.03 1.01 -0.67 -0.20 120.40 122.75 2bb2 s VAL 132 Ca 0.25 -0.66 -0.06 0.00 0.00 0.00 0.00 61.98 61.51 2bb2 s VAL 132 Cb 0.01 -1.31 -0.05 0.00 0.00 0.00 0.00 36.38 35.03 2bb2 s VAL 132 CO 0.09 0.12 0.30 -0.83 0.00 0.00 0.00 175.10 174.78 2bb2 s GLY 133 N 1.62 2.25 0.10 4.51 0.00 -0.53 -0.75 107.32 114.53 2bb2 s GLY 133 Ca 0.00 -0.58 0.05 0.00 0.00 0.00 0.00 44.72 44.20 2bb2 s GLY 133 CO -0.08 -0.42 -0.12 -0.19 0.00 0.00 0.00 173.10 172.29 2bb2 s TYR 134 N -1.39 1.20 0.20 1.90 1.51 -0.30 -0.15 117.35 120.31 2bb2 s TYR 134 Ca 0.31 -0.58 -0.06 0.00 -1.01 0.00 0.00 57.07 55.73 2bb2 s TYR 134 Cb -0.13 -0.65 0.13 0.00 -0.11 0.00 0.00 41.96 41.20 2bb2 s TYR 134 CO 0.19 0.06 1.62 1.96 -1.11 0.00 0.00 175.55 178.27 2bb2 h GLN 135 N 3.69 0.87 -5.38 -0.62 4.20 -1.23 -1.33 115.11 115.32 2bb2 h GLN 135 Ca -0.39 -0.34 -0.65 0.00 0.06 0.00 0.00 58.65 57.33 2bb2 h GLN 135 Cb 1.19 -0.05 -0.13 0.00 0.30 0.00 0.00 27.48 28.80 2bb2 h GLN 135 CO 0.50 0.98 -0.55 0.71 -0.67 0.00 0.00 178.83 179.80 2bb2 s TYR 136 N -4.69 2.13 0.84 2.96 2.02 0.39 -3.13 117.35 117.86 2bb2 s TYR 136 Ca -0.10 -0.85 -0.11 0.00 -0.37 0.00 0.00 57.07 55.64 2bb2 s TYR 136 Cb 0.13 -1.65 0.10 0.00 -0.40 0.00 0.00 41.96 40.14 2bb2 s TYR 136 CO 0.85 0.29 1.13 -2.14 -1.57 0.00 0.00 175.55 174.11 2bb2 s PRO 137 N -3.80 1.62 -1.05 -1.71 0.02 -1.26 -3.34 135.00 125.47 2bb2 s PRO 137 Ca 0.19 1.44 0.00 0.00 0.02 0.00 0.00 61.00 62.65 2bb2 s PRO 137 Cb 0.05 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.77 2bb2 s PRO 137 CO 0.10 -2.16 0.00 0.41 -0.33 0.00 0.00 177.00 175.02 2bb2 n GLY 138 N -0.28 0.90 3.52 0.52 0.00 0.24 -3.50 105.19 106.58 2bb2 n GLY 138 Ca 0.11 -0.53 -0.20 0.00 0.00 0.00 0.00 46.02 45.39 2bb2 n GLY 138 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bb2 n TYR 139 N -3.00 -2.46 -4.34 1.61 4.01 -1.24 -5.03 117.16 106.71 2bb2 n TYR 139 Ca -0.11 0.97 -0.24 0.00 -0.16 0.00 0.00 57.90 58.35 2bb2 n TYR 139 Cb 0.40 -5.02 -0.09 0.00 -0.31 0.00 0.00 39.34 34.32 2bb2 n TYR 139 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2bb2 s ARG 140 N -5.79 2.05 1.49 -0.72 0.52 -1.21 -5.00 118.95 110.29 2bb2 s ARG 140 Ca 0.25 -1.46 0.00 0.00 -0.52 0.00 0.00 55.73 54.00 2bb2 s ARG 140 Cb -0.11 -2.06 0.00 0.00 0.52 0.00 0.00 34.95 33.30 2bb2 s ARG 140 CO 0.74 0.38 0.00 0.41 0.02 0.00 0.00 175.30 176.84 2bb2 n GLY 141 N -0.50 -1.20 3.73 -3.53 0.00 -1.26 -0.46 105.19 101.97 2bb2 n GLY 141 Ca -0.08 -1.50 -0.39 0.00 0.00 0.00 0.00 46.02 44.05 2bb2 n GLY 141 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bb2 n LEU 142 N 0.00 5.08 -4.54 0.99 4.77 -1.26 -4.69 117.00 117.35 2bb2 n LEU 142 Ca 0.00 1.01 -0.32 0.00 -0.03 0.00 0.00 56.01 56.68 2bb2 n LEU 142 Cb 0.00 -1.56 -0.11 0.00 -2.33 0.00 0.00 43.42 39.42 2bb2 n LEU 142 CO 0.00 -0.60 -0.42 -1.10 -1.33 0.00 0.00 177.39 173.94 2bb2 s GLN 143 N -2.68 2.42 -0.10 3.23 -0.21 -1.26 -2.25 119.66 118.81 2bb2 s GLN 143 Ca 0.68 -0.78 0.00 0.00 0.02 0.00 0.00 55.36 55.28 2bb2 s GLN 143 Cb -0.44 -2.40 0.02 0.00 1.00 0.00 0.00 33.01 31.19 2bb2 s GLN 143 CO 0.52 0.59 -0.09 0.71 -2.12 0.00 0.00 175.29 174.90 2bb2 s TYR 144 N -0.93 1.52 -0.08 0.91 2.02 0.79 -4.96 117.35 116.61 2bb2 s TYR 144 Ca 0.15 -0.71 -0.30 0.00 -0.37 0.00 0.00 57.07 55.85 2bb2 s TYR 144 Cb -0.11 -1.21 -0.02 0.00 -0.40 0.00 0.00 41.96 40.23 2bb2 s TYR 144 CO 0.06 -0.46 1.02 -1.17 -1.57 0.00 0.00 175.55 173.43 2bb2 s LEU 145 N 1.40 4.27 -0.35 -1.29 2.96 -1.26 -1.45 118.68 122.96 2bb2 s LEU 145 Ca -0.01 1.58 -0.01 0.00 -0.22 0.00 0.00 54.13 55.48 2bb2 s LEU 145 Cb -0.13 -3.56 0.08 0.00 0.50 0.00 0.00 46.19 43.08 2bb2 s LEU 145 CO -0.05 -0.43 0.09 -0.76 -1.32 0.00 0.00 176.35 173.87 2bb2 s LEU 146 N 1.86 4.58 0.39 -0.68 1.43 0.73 -4.99 118.68 122.01 2bb2 s LEU 146 Ca 0.50 -1.75 0.08 0.00 -1.03 0.00 0.00 54.13 51.92 2bb2 s LEU 146 Cb -0.19 -1.74 -0.02 0.00 0.03 0.00 0.00 46.19 44.27 2bb2 s LEU 146 CO 0.20 -0.39 0.37 -1.61 0.23 0.00 0.00 176.35 175.14 2bb2 s GLU 147 N 1.13 2.61 -0.09 1.70 2.02 -1.26 -1.20 118.70 123.61 2bb2 s GLU 147 Ca 0.03 -1.45 -0.40 0.00 0.02 0.00 0.00 54.97 53.17 2bb2 s GLU 147 Cb -0.21 -2.43 -0.19 0.00 0.10 0.00 0.00 34.13 31.40 2bb2 s GLU 147 CO -0.04 -0.12 1.31 1.63 0.02 0.00 0.00 175.26 178.06 2bb2 n LYS 148 N -1.52 0.47 0.00 1.61 5.02 -1.25 -4.55 118.16 117.94 2bb2 n LYS 148 Ca 0.02 0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 2bb2 n LYS 148 Cb 0.61 -1.73 0.00 0.00 -0.02 0.00 0.00 35.03 33.89 2bb2 n LYS 148 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bb2 n GLY 149 N 2.52 1.30 3.52 0.72 0.00 0.61 -4.89 105.19 108.97 2bb2 n GLY 149 Ca 0.22 -1.50 -0.34 0.00 0.00 0.00 0.00 46.02 44.41 2bb2 n GLY 149 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bb2 s ASP 150 N 0.00 4.69 -0.32 1.61 1.01 -1.26 0.15 116.67 122.55 2bb2 s ASP 150 Ca 0.00 -0.10 0.03 0.00 0.71 0.00 0.00 52.55 53.19 2bb2 s ASP 150 Cb 0.00 -1.55 0.10 0.00 1.01 0.00 0.00 42.92 42.47 2bb2 s ASP 150 CO 0.00 0.24 0.05 -0.31 0.21 0.00 0.00 175.17 175.36 2bb2 s TYR 151 N -0.09 3.13 0.19 4.23 1.51 0.87 -4.98 117.35 122.21 2bb2 s TYR 151 Ca 0.01 -2.57 0.27 0.00 -1.01 0.00 0.00 57.07 53.77 2bb2 s TYR 151 Cb -0.13 -2.49 1.16 0.00 -0.11 0.00 0.00 41.96 40.39 2bb2 s TYR 151 CO 0.03 -0.92 1.92 0.87 -1.11 0.00 0.00 175.55 176.34 2bb2 h LYS 152 N 7.76 0.00 -3.66 -0.62 1.57 -1.88 0.37 116.57 120.11 2bb2 h LYS 152 Ca -0.08 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.58 2bb2 h LYS 152 Cb 1.02 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 33.15 2bb2 h LYS 152 CO 0.50 0.15 -0.47 0.34 -0.57 0.00 0.00 179.45 179.40 2bb2 s ASP 153 N -6.04 0.10 0.46 0.86 2.15 -1.24 0.12 116.67 113.07 2bb2 s ASP 153 Ca -0.00 -0.41 0.15 0.00 0.43 0.00 0.00 52.55 52.72 2bb2 s ASP 153 Cb 0.11 0.25 1.10 0.00 -0.30 0.00 0.00 42.92 44.07 2bb2 s ASP 153 CO 0.60 -0.50 2.02 0.77 -0.17 0.00 0.00 175.17 177.89 2bb2 h SER 154 N 3.70 0.27 -0.09 -0.34 4.64 -0.68 -1.79 113.55 119.26 2bb2 h SER 154 Ca -0.32 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.95 2bb2 h SER 154 Cb 1.19 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.21 2bb2 h SER 154 CO 0.48 0.17 -0.10 1.23 -0.87 0.00 0.00 176.83 177.74 2bb2 h GLY 155 N 0.31 0.41 2.00 -0.77 0.00 -1.87 0.49 103.07 103.64 2bb2 h GLY 155 Ca 0.21 -0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.26 2bb2 h GLY 155 CO -0.05 0.24 -0.11 -0.55 0.00 0.00 0.00 176.54 176.07 2bb2 h ASP 156 N 0.36 0.00 -0.25 0.19 3.32 -1.67 -1.07 116.42 117.31 2bb2 h ASP 156 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 2bb2 h ASP 156 Cb 0.40 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.95 2bb2 h ASP 156 CO 0.02 0.11 0.00 2.22 -1.72 0.00 0.00 179.24 179.87 2bb2 n PHE 157 N -3.61 0.31 -0.67 4.55 1.16 -0.68 -4.94 117.46 113.58 2bb2 n PHE 157 Ca -0.02 -0.19 0.00 0.00 -1.87 0.00 0.00 57.45 55.38 2bb2 n PHE 157 Cb 0.24 -0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.10 2bb2 n PHE 157 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2bb2 n GLY 158 N 1.21 0.64 3.76 4.97 0.00 -0.40 -4.74 105.19 110.62 2bb2 n GLY 158 Ca 0.15 -0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 2bb2 n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bb2 s ALA 159 N -2.00 3.41 -0.51 4.61 0.00 0.16 -4.91 121.76 122.53 2bb2 s ALA 159 Ca 0.00 0.36 0.26 0.00 0.00 0.00 0.00 51.96 52.58 2bb2 s ALA 159 Cb 0.00 -3.00 0.76 0.00 0.00 0.00 0.00 23.12 20.88 2bb2 s ALA 159 CO 0.00 0.20 1.74 -1.00 0.00 0.00 0.00 175.76 176.70 2bb2 h PRO 160 N 4.82 0.00 -3.17 0.00 0.13 -1.96 -3.34 132.00 128.48 2bb2 h PRO 160 Ca -0.46 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.53 2bb2 h PRO 160 Cb 1.21 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.12 2bb2 h PRO 160 CO 0.68 0.00 -0.37 -0.65 -0.23 0.00 0.00 178.00 177.43 2bb2 s GLN 161 N -3.23 0.50 -1.13 0.86 -0.21 -1.26 -5.06 119.66 110.12 2bb2 s GLN 161 Ca 0.07 -0.04 -0.13 0.00 0.02 0.00 0.00 55.36 55.29 2bb2 s GLN 161 Cb 0.09 0.22 -0.07 0.00 1.00 0.00 0.00 33.01 34.25 2bb2 s GLN 161 CO 0.58 -0.11 2.26 -0.35 -2.12 0.00 0.00 175.29 175.54 2bb2 n PRO 162 N 1.92 2.41 -3.83 2.91 -0.04 -1.26 -4.80 135.00 132.30 2bb2 n PRO 162 Ca -0.19 -1.95 -0.27 0.00 -0.04 0.00 0.00 63.50 61.06 2bb2 n PRO 162 Cb 0.57 -2.82 -0.17 0.00 -0.04 0.00 0.00 33.50 31.04 2bb2 n PRO 162 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2bb2 s GLN 163 N 3.55 1.11 -0.04 0.54 0.74 -1.24 -0.43 119.66 123.89 2bb2 s GLN 163 Ca 0.52 -0.36 -0.01 0.00 0.05 0.00 0.00 55.36 55.56 2bb2 s GLN 163 Cb 0.14 -1.81 0.03 0.00 1.10 0.00 0.00 33.01 32.47 2bb2 s GLN 163 CO -0.01 -0.44 0.02 0.08 -0.55 0.00 0.00 175.29 174.38 2bb2 s VAL 164 N 1.75 0.15 0.00 1.34 1.01 -1.26 -4.35 120.40 119.03 2bb2 s VAL 164 Ca 0.01 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.19 2bb2 s VAL 164 Cb -0.15 -0.31 0.00 0.00 0.00 0.00 0.00 36.38 35.92 2bb2 s VAL 164 CO -0.07 0.18 0.38 0.00 0.00 0.00 0.00 175.10 175.59 2bb2 n GLN 165 N 4.73 -0.34 -3.59 2.72 6.02 -0.50 -4.80 117.38 121.61 2bb2 n GLN 165 Ca -0.15 -0.38 -0.15 0.00 -0.01 0.00 0.00 57.00 56.32 2bb2 n GLN 165 Cb 0.50 -0.87 -0.06 0.00 1.02 0.00 0.00 30.24 30.83 2bb2 n GLN 165 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2bb2 s SER 166 N -0.06 -0.44 -0.04 1.08 1.04 -1.22 -1.83 113.70 112.23 2bb2 s SER 166 Ca 0.00 0.27 -0.07 0.00 0.48 0.00 0.00 55.95 56.63 2bb2 s SER 166 Cb 0.00 0.47 0.01 0.00 0.10 0.00 0.00 66.02 66.61 2bb2 s SER 166 CO 0.00 -0.66 0.18 0.54 0.98 0.00 0.00 173.24 174.28 2bb2 s VAL 167 N -2.03 0.03 0.07 5.02 0.11 -0.61 -1.15 120.40 121.85 2bb2 s VAL 167 Ca -0.08 -0.28 0.03 0.00 -2.93 0.00 0.00 61.98 58.73 2bb2 s VAL 167 Cb -0.01 -0.35 -0.03 0.00 -1.53 0.00 0.00 36.38 34.46 2bb2 s VAL 167 CO 0.02 -0.15 -0.10 0.00 -3.33 0.00 0.00 175.10 171.54 2bb2 s ARG 168 N -0.51 0.74 -0.05 1.54 1.70 0.07 -1.08 118.95 121.36 2bb2 s ARG 168 Ca -0.06 -1.01 -0.05 0.00 -0.47 0.00 0.00 55.73 54.14 2bb2 s ARG 168 Cb -0.04 -0.47 -0.04 0.00 -0.57 0.00 0.00 34.95 33.83 2bb2 s ARG 168 CO 0.01 0.08 0.19 0.50 -1.08 0.00 0.00 175.30 175.00 2bb2 s ARG 169 N -2.30 3.48 -0.36 3.89 3.52 -1.26 -1.67 118.95 124.24 2bb2 s ARG 169 Ca -0.00 -0.19 -0.22 0.00 -0.13 0.00 0.00 55.73 55.19 2bb2 s ARG 169 Cb -0.06 -3.13 0.01 0.00 -1.56 0.00 0.00 34.95 30.21 2bb2 s ARG 169 CO 0.00 0.71 0.73 0.42 -0.81 0.00 0.00 175.30 176.35 2bb2 s ILE 170 N -1.21 4.79 -0.05 4.11 -1.09 0.70 -4.94 121.20 123.52 2bb2 s ILE 170 Ca 0.23 0.75 0.22 0.00 -2.23 0.00 0.00 60.65 59.62 2bb2 s ILE 170 Cb -0.13 -4.16 -0.34 0.00 -1.58 0.00 0.00 42.46 36.26 2bb2 s ILE 170 CO 0.13 -0.39 0.48 0.54 -1.23 0.00 0.00 174.94 174.47 2bb2 n ARG 171 N 6.28 0.64 -4.34 2.79 1.74 -1.26 -4.56 116.66 117.95 2bb2 n ARG 171 Ca 0.01 -0.20 -0.23 0.00 -0.77 0.00 0.00 57.85 56.67 2bb2 n ARG 171 Cb 0.48 -1.52 -0.12 0.00 -1.02 0.00 0.00 32.46 30.29 2bb2 n ARG 171 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2bb2 s ASP 172 N -4.48 2.80 -0.01 0.55 1.01 -1.26 -5.14 116.67 110.15 2bb2 s ASP 172 Ca -0.08 -0.83 0.04 0.00 0.71 0.00 0.00 52.55 52.40 2bb2 s ASP 172 Cb 0.14 -0.17 -0.01 0.00 1.01 0.00 0.00 42.92 43.89 2bb2 s ASP 172 CO 0.90 0.02 -0.13 -0.32 0.21 0.00 0.00 175.17 175.85 2bb2 s MET 173 N -2.58 1.05 -0.30 8.23 1.75 -1.26 -5.06 119.30 121.13 2bb2 s MET 173 Ca 0.15 -0.45 0.10 0.00 -1.25 0.00 0.00 55.69 54.23 2bb2 s MET 173 Cb -0.07 -1.01 0.58 0.00 2.84 0.00 0.00 34.83 37.17 2bb2 s MET 173 CO 0.07 0.27 1.59 1.04 -0.65 0.00 0.00 175.02 177.33 2bb2 n GLN 174 N 2.79 2.44 0.00 4.11 3.00 -1.26 -5.33 117.38 123.13 2bb2 n GLN 174 Ca -0.14 -3.07 0.00 0.00 -0.01 0.00 0.00 57.00 53.78 2bb2 n GLN 174 Cb 0.55 -1.95 0.00 0.00 0.00 0.00 0.00 30.24 28.84 2bb2 n GLN 174 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.06 174.39