#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b8t s PRO 2 N 0.00 0.70 -0.20 2.12 0.04 -1.26 -5.09 135.00 131.30 1b8t s PRO 2 Ca 0.00 0.12 -0.12 0.00 0.04 0.00 0.00 61.00 61.04 1b8t s PRO 2 Cb 0.00 -1.80 0.06 0.00 0.04 0.00 0.00 34.50 32.80 1b8t s PRO 2 CO 0.00 -2.46 0.51 1.21 0.04 0.00 0.00 177.00 176.29 1b8t s ASN 3 N -4.15 -0.64 -0.28 6.66 2.47 -1.26 -5.16 114.94 112.59 1b8t s ASN 3 Ca 0.67 1.09 -0.27 0.00 0.42 0.00 0.00 52.86 54.77 1b8t s ASN 3 Cb -0.12 0.99 0.18 0.00 -1.45 0.00 0.00 41.25 40.85 1b8t s ASN 3 CO 0.54 -0.20 1.33 0.86 -3.72 0.00 0.00 177.10 175.90 1b8t s TRP 4 N 1.31 -0.12 0.00 0.43 -0.00 -1.26 -5.19 118.94 114.11 1b8t s TRP 4 Ca -0.08 0.25 0.00 0.00 -0.00 0.00 0.00 56.10 56.26 1b8t s TRP 4 Cb -0.07 0.47 0.00 0.00 -0.00 0.00 0.00 33.47 33.88 1b8t s TRP 4 CO -0.13 -0.08 0.00 0.41 -0.00 0.00 0.00 176.95 177.15 1b8t n GLY 5 N 1.13 3.22 0.00 5.86 0.00 -1.26 -5.19 105.19 108.95 1b8t n GLY 5 Ca -0.06 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.78 1b8t n GLY 5 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b8t n GLY 6 N -1.35 4.01 0.00 -0.02 0.00 -1.26 -5.12 105.19 101.45 1b8t n GLY 6 Ca 0.00 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1b8t n GLY 6 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b8t n GLY 7 N -1.96 0.66 3.81 -0.02 0.00 -1.26 -5.10 105.19 101.32 1b8t n GLY 7 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1b8t n GLY 7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1b8t n LYS 8 N 0.00 0.65 -3.79 1.61 5.02 -0.41 -4.91 118.16 116.32 1b8t n LYS 8 Ca 0.00 -3.26 -0.25 0.00 -2.02 0.00 0.00 58.31 52.78 1b8t n LYS 8 Cb 0.00 0.08 -0.17 0.00 -0.02 0.00 0.00 35.03 34.92 1b8t n LYS 8 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1b8t s LYS 9 N -4.41 0.84 -0.53 1.97 -2.85 -1.26 -0.23 119.74 113.27 1b8t s LYS 9 Ca 0.45 -0.13 -0.28 0.00 -1.00 0.00 0.00 55.97 55.00 1b8t s LYS 9 Cb -0.04 -1.44 0.02 0.00 -2.06 0.00 0.00 37.83 34.32 1b8t s LYS 9 CO 0.28 -0.39 1.26 0.00 0.10 0.00 0.00 175.35 176.60 1b8t n GLY 11 N 5.06 -1.00 0.03 0.00 0.00 -1.17 -0.14 105.19 107.97 1b8t n GLY 11 Ca 0.11 -0.05 -0.03 0.00 0.00 0.00 0.00 46.02 46.05 1b8t n GLY 11 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1b8t n VAL 12 N -0.63 0.55 0.14 1.61 0.31 -1.26 -4.61 118.33 114.44 1b8t n VAL 12 Ca 0.06 0.37 0.05 0.00 -0.01 0.00 0.00 64.34 64.81 1b8t n VAL 12 Cb 0.03 -1.82 0.04 0.00 -0.91 0.00 0.00 33.84 31.18 1b8t n VAL 12 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1b8t n GLN 14 N -3.11 0.00 -4.42 0.00 7.27 0.80 -5.07 117.38 112.86 1b8t n GLN 14 Ca 0.01 0.05 -0.29 0.00 0.07 0.00 0.00 57.00 56.84 1b8t n GLN 14 Cb 0.69 -2.77 -0.13 0.00 2.41 0.00 0.00 30.24 30.44 1b8t n GLN 14 CO 0.00 0.00 0.00 0.21 0.07 0.00 0.00 177.06 177.34 1b8t s LYS 15 N -3.09 1.46 0.75 3.69 2.20 -1.09 -4.88 119.74 118.78 1b8t s LYS 15 Ca 0.00 -1.32 -0.15 0.00 -0.36 0.00 0.00 55.97 54.14 1b8t s LYS 15 Cb 0.00 -1.92 0.03 0.00 -1.51 0.00 0.00 37.83 34.43 1b8t s LYS 15 CO 0.00 0.46 1.09 0.00 -0.36 0.00 0.00 175.35 176.53 1b8t n ALA 16 N 0.96 -0.02 -2.51 3.13 0.00 -1.26 0.05 120.51 120.86 1b8t n ALA 16 Ca -0.18 -0.22 -0.25 0.00 0.00 0.00 0.00 53.44 52.79 1b8t n ALA 16 Cb 0.53 -2.19 -0.10 0.00 0.00 0.00 0.00 19.45 17.69 1b8t n ALA 16 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1b8t s VAL 17 N -1.88 2.75 0.28 0.00 1.01 0.68 -4.64 120.40 118.61 1b8t s VAL 17 Ca 0.74 -2.06 -0.19 0.00 0.00 0.00 0.00 61.98 60.48 1b8t s VAL 17 Cb -0.33 -2.40 0.07 0.00 0.00 0.00 0.00 36.38 33.72 1b8t s VAL 17 CO 0.49 -0.25 0.94 -0.47 0.00 0.00 0.00 175.10 175.81 1b8t s TYR 18 N -2.06 0.12 0.36 5.22 5.04 -1.26 -1.29 117.35 123.48 1b8t s TYR 18 Ca 0.26 -0.66 0.00 0.00 -2.44 0.00 0.00 57.07 54.23 1b8t s TYR 18 Cb -0.07 0.77 0.00 0.00 0.35 0.00 0.00 41.96 43.02 1b8t s TYR 18 CO 0.14 -1.24 0.00 1.19 -1.34 0.00 0.00 175.55 174.31 1b8t n PHE 19 N -0.65 -3.59 0.35 4.97 3.01 -1.26 -3.00 117.46 117.29 1b8t n PHE 19 Ca -0.05 1.81 0.14 0.00 1.01 0.00 0.00 57.45 60.36 1b8t n PHE 19 Cb 0.60 -3.26 0.55 0.00 -0.01 0.00 0.00 39.48 37.36 1b8t n PHE 19 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1b8t h ALA 20 N -1.33 1.00 -0.54 4.37 0.00 -2.06 -2.81 119.26 117.89 1b8t h ALA 20 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.00 1b8t h ALA 20 Cb 1.31 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 1b8t h ALA 20 CO 0.02 0.00 0.36 1.05 0.00 0.00 0.00 179.25 180.68 1b8t h GLU 21 N 0.00 0.37 -6.00 0.00 4.11 -2.01 -3.43 114.58 107.61 1b8t h GLU 21 Ca 0.00 -0.02 -0.83 0.00 0.07 0.00 0.00 59.36 58.58 1b8t h GLU 21 Cb 0.50 -0.08 0.03 0.00 0.50 0.00 0.00 28.75 29.70 1b8t h GLU 21 CO 0.00 0.24 0.36 -0.85 0.07 0.00 0.00 179.01 178.84 1b8t n GLU 22 N -4.47 0.02 -3.82 1.06 -0.00 -1.07 -3.67 120.64 108.69 1b8t n GLU 22 Ca 0.08 0.01 -0.36 0.00 -0.00 0.00 0.00 57.16 56.89 1b8t n GLU 22 Cb 0.33 -1.51 -0.13 0.00 -0.00 0.00 0.00 31.44 30.13 1b8t n GLU 22 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1b8t s VAL 23 N 1.44 3.72 0.36 3.84 1.01 -0.13 -4.93 120.40 125.71 1b8t s VAL 23 Ca 0.98 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 62.41 1b8t s VAL 23 Cb -1.37 -2.84 -0.01 0.00 0.00 0.00 0.00 36.38 32.16 1b8t s VAL 23 CO 0.69 0.21 0.48 0.00 0.00 0.00 0.00 175.10 176.48 1b8t s GLN 24 N 1.49 3.01 -0.08 2.72 -2.07 -1.26 0.17 119.66 123.64 1b8t s GLN 24 Ca 0.04 -1.10 -0.31 0.00 -1.82 0.00 0.00 55.36 52.17 1b8t s GLN 24 Cb -0.16 -2.78 0.12 0.00 -1.09 0.00 0.00 33.01 29.10 1b8t s GLN 24 CO 0.00 -0.02 1.01 0.00 -1.32 0.00 0.00 175.29 174.96 1b8t n GLU 26 N -0.11 0.17 -4.27 0.00 -0.58 -1.26 0.12 120.64 114.71 1b8t n GLU 26 Ca -0.06 0.06 -0.34 0.00 -0.42 0.00 0.00 57.16 56.41 1b8t n GLU 26 Cb 0.60 -1.61 -0.08 0.00 -0.57 0.00 0.00 31.44 29.79 1b8t n GLU 26 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1b8t n GLY 27 N 5.01 -0.25 0.00 0.62 0.00 -1.26 -4.86 105.19 104.46 1b8t n GLY 27 Ca 0.37 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.60 1b8t n GLY 27 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1b8t n SER 28 N -2.76 0.00 0.00 1.61 7.64 0.12 -5.11 113.62 115.13 1b8t n SER 28 Ca -0.29 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.59 1b8t n SER 28 Cb 0.67 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.87 1b8t n SER 28 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1b8t n SER 29 N 0.00 0.00 -3.62 6.43 3.41 -1.26 0.23 113.62 118.81 1b8t n SER 29 Ca 0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.38 1b8t n SER 29 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 1b8t n SER 29 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1b8t s PHE 30 N -0.25 1.79 0.76 7.33 0.08 0.13 -3.07 117.98 124.74 1b8t s PHE 30 Ca 0.00 -1.54 -0.11 0.00 0.12 0.00 0.00 56.93 55.40 1b8t s PHE 30 Cb 0.00 -0.90 0.05 0.00 -0.57 0.00 0.00 43.02 41.59 1b8t s PHE 30 CO 0.00 -0.66 1.08 -1.01 -0.10 0.00 0.00 175.22 174.53 1b8t s HIS 31 N -3.31 2.78 0.16 0.36 3.76 -1.26 -0.96 115.29 116.81 1b8t s HIS 31 Ca 0.33 1.44 -0.16 0.00 -0.15 0.00 0.00 55.06 56.52 1b8t s HIS 31 Cb 0.02 -3.00 0.02 0.00 1.11 0.00 0.00 32.58 30.73 1b8t s HIS 31 CO 0.23 -1.64 1.81 1.57 -0.85 0.00 0.00 174.74 175.86 1b8t h LYS 32 N -1.01 0.53 -0.08 1.40 2.10 -1.92 0.18 116.57 117.77 1b8t h LYS 32 Ca -0.44 -0.03 -0.10 0.00 -2.00 0.00 0.00 60.65 58.07 1b8t h LYS 32 Cb 1.23 -0.12 -0.01 0.00 -0.90 0.00 0.00 32.23 32.43 1b8t h LYS 32 CO 0.54 0.35 -0.41 0.77 -2.00 0.00 0.00 179.45 178.70 1b8t h SER 33 N 0.54 0.17 0.24 7.07 0.02 -1.92 -3.03 113.55 116.64 1b8t h SER 33 Ca 0.15 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1b8t h SER 33 Cb -0.05 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.45 1b8t h SER 33 CO -0.04 0.57 -0.11 0.00 -1.14 0.00 0.00 176.83 176.10 1b8t n PHE 35 N -5.14 0.49 -3.59 0.00 -0.00 0.56 -4.82 117.46 104.96 1b8t n PHE 35 Ca -0.09 0.33 -0.16 0.00 -0.00 0.00 0.00 57.45 57.53 1b8t n PHE 35 Cb 0.22 -2.13 -0.07 0.00 -0.00 0.00 0.00 39.48 37.49 1b8t n PHE 35 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 1b8t s LEU 36 N 7.88 -0.36 -0.20 -2.13 0.20 -1.26 -1.37 118.68 121.44 1b8t s LEU 36 Ca 1.32 0.76 -0.29 0.00 0.69 0.00 0.00 54.13 56.61 1b8t s LEU 36 Cb -1.19 2.25 -0.04 0.00 -0.43 0.00 0.00 46.19 46.78 1b8t s LEU 36 CO 0.48 -0.49 1.76 0.00 -0.29 0.00 0.00 176.35 177.81 1b8t n MET 38 N 7.87 0.98 -0.02 0.00 2.81 -0.54 -0.13 117.12 128.09 1b8t n MET 38 Ca 0.21 0.00 -0.02 0.00 -1.81 0.00 0.00 57.70 56.08 1b8t n MET 38 Cb 0.45 -1.11 -0.01 0.00 -0.71 0.00 0.00 33.22 31.84 1b8t n MET 38 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1b8t n VAL 39 N -0.61 0.34 0.17 2.03 0.31 -1.26 -4.64 118.33 114.68 1b8t n VAL 39 Ca 0.05 0.39 0.06 0.00 -0.01 0.00 0.00 64.34 64.83 1b8t n VAL 39 Cb 0.02 -1.65 0.10 0.00 -0.91 0.00 0.00 33.84 31.41 1b8t n VAL 39 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1b8t n LYS 41 N -3.19 0.00 -3.78 0.00 3.00 0.81 -5.03 118.16 109.97 1b8t n LYS 41 Ca 0.02 0.28 -0.35 0.00 -0.00 0.00 0.00 58.31 58.27 1b8t n LYS 41 Cb 0.65 -3.61 -0.08 0.00 0.00 0.00 0.00 35.03 31.99 1b8t n LYS 41 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1b8t s LYS 42 N -2.68 4.15 0.47 1.64 1.02 -1.17 -4.84 119.74 118.33 1b8t s LYS 42 Ca 0.00 -0.24 -0.19 0.00 0.02 0.00 0.00 55.97 55.55 1b8t s LYS 42 Cb 0.00 -3.39 -0.15 0.00 -0.52 0.00 0.00 37.83 33.78 1b8t s LYS 42 CO 0.00 0.29 0.04 0.09 -0.92 0.00 0.00 175.35 174.85 1b8t n ASN 43 N 3.55 -3.00 -4.50 2.83 4.13 -1.26 -0.61 115.26 116.40 1b8t n ASN 43 Ca -0.16 0.73 -0.31 0.00 1.68 0.00 0.00 54.58 56.52 1b8t n ASN 43 Cb 0.52 -0.90 -0.12 0.00 -1.54 0.00 0.00 39.78 37.74 1b8t n ASN 43 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1b8t s LEU 44 N 4.23 2.79 0.00 3.41 1.43 -0.47 -4.50 118.68 125.57 1b8t s LEU 44 Ca 0.59 -0.31 0.00 0.00 -1.03 0.00 0.00 54.13 53.39 1b8t s LEU 44 Cb -0.55 -1.61 0.00 0.00 0.03 0.00 0.00 46.19 44.06 1b8t s LEU 44 CO 0.63 0.28 0.00 -0.67 0.23 0.00 0.00 176.35 176.82 1b8t n ASP 45 N 1.69 0.00 -4.11 2.29 -0.08 -1.26 -4.61 116.55 110.46 1b8t n ASP 45 Ca -0.16 0.00 -0.36 0.00 -1.51 0.00 0.00 54.79 52.76 1b8t n ASP 45 Cb 0.52 0.00 0.08 0.00 2.34 0.00 0.00 41.12 44.07 1b8t n ASP 45 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1b8t n SER 46 N 0.00 -3.05 -3.69 1.67 3.41 -1.26 -4.72 113.62 105.97 1b8t n SER 46 Ca 0.00 -0.01 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 1b8t n SER 46 Cb 0.00 -0.71 -0.00 0.00 -0.26 0.00 0.00 64.21 63.23 1b8t n SER 46 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1b8t n THR 47 N -3.72 3.95 -2.64 6.66 5.66 -1.26 -4.02 114.28 118.92 1b8t n THR 47 Ca -0.01 -3.44 -0.03 0.00 -3.05 0.00 0.00 64.05 57.52 1b8t n THR 47 Cb 0.68 -2.50 -0.00 0.00 -1.55 0.00 0.00 70.33 66.96 1b8t n THR 47 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 1b8t n THR 48 N 4.15 0.00 -3.75 1.09 5.66 -1.26 -5.09 114.28 115.08 1b8t n THR 48 Ca 0.53 -0.59 -0.24 0.00 -3.05 0.00 0.00 64.05 60.70 1b8t n THR 48 Cb 0.35 0.59 -0.02 0.00 -1.55 0.00 0.00 70.33 69.70 1b8t n THR 48 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1b8t s VAL 49 N 0.03 2.15 0.09 1.08 0.11 -1.26 0.08 120.40 122.68 1b8t s VAL 49 Ca 0.04 -1.43 -0.26 0.00 -2.93 0.00 0.00 61.98 57.39 1b8t s VAL 49 Cb 0.07 -2.58 0.08 0.00 -1.53 0.00 0.00 36.38 32.42 1b8t s VAL 49 CO -0.02 0.00 0.86 0.00 -3.33 0.00 0.00 175.10 172.61 1b8t s ALA 50 N -2.63 -1.70 0.29 1.54 0.00 0.63 -4.33 121.76 115.56 1b8t s ALA 50 Ca 0.42 0.57 0.10 0.00 0.00 0.00 0.00 51.96 53.04 1b8t s ALA 50 Cb -0.02 0.58 -0.06 0.00 0.00 0.00 0.00 23.12 23.63 1b8t s ALA 50 CO 0.25 -0.84 -0.13 0.08 0.00 0.00 0.00 175.76 175.12 1b8t s VAL 51 N -3.31 2.17 -0.07 0.00 1.01 -1.26 -1.31 120.40 117.63 1b8t s VAL 51 Ca 0.07 -2.27 -0.10 0.00 0.00 0.00 0.00 61.98 59.69 1b8t s VAL 51 Cb -0.01 -2.42 0.02 0.00 0.00 0.00 0.00 36.38 33.97 1b8t s VAL 51 CO -0.05 -0.34 0.25 -2.28 0.00 0.00 0.00 175.10 172.69 1b8t s HIS 52 N -2.68 -0.21 -0.48 5.22 2.46 0.90 -4.80 115.29 115.69 1b8t s HIS 52 Ca 0.30 0.48 -0.26 0.00 0.47 0.00 0.00 55.06 56.05 1b8t s HIS 52 Cb -0.00 0.07 -0.25 0.00 -0.13 0.00 0.00 32.58 32.27 1b8t s HIS 52 CO 0.14 -0.21 1.79 0.41 -2.47 0.00 0.00 174.74 174.40 1b8t n GLY 53 N 2.36 1.49 0.00 1.59 0.00 -1.26 -0.79 105.19 108.59 1b8t n GLY 53 Ca -0.16 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.82 1b8t n GLY 53 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1b8t n ASP 54 N 9.05 0.00 -3.44 1.61 9.92 -1.26 -5.14 116.55 127.29 1b8t n ASP 54 Ca 0.48 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.74 1b8t n ASP 54 Cb 0.42 0.00 0.02 0.00 -0.64 0.00 0.00 41.12 40.91 1b8t n ASP 54 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1b8t n GLU 55 N 0.00 0.38 -4.30 -1.24 4.71 0.03 -5.16 120.64 115.06 1b8t n GLU 55 Ca 0.00 -1.04 -0.33 0.00 -0.01 0.00 0.00 57.16 55.78 1b8t n GLU 55 Cb 0.00 1.53 -0.09 0.00 -1.01 0.00 0.00 31.44 31.87 1b8t n GLU 55 CO 0.00 0.00 0.00 -1.50 0.09 0.00 0.00 177.13 175.72 1b8t s ILE 56 N -2.05 4.19 0.22 -3.67 2.07 -1.26 -0.07 121.20 120.62 1b8t s ILE 56 Ca 0.25 -0.52 0.00 0.00 -1.41 0.00 0.00 60.65 58.97 1b8t s ILE 56 Cb -0.02 -2.85 -0.04 0.00 0.13 0.00 0.00 42.46 39.69 1b8t s ILE 56 CO 0.02 0.43 0.15 -0.31 -1.91 0.00 0.00 174.94 173.32 1b8t s TYR 57 N -1.04 1.24 0.06 3.50 2.02 -0.43 -1.47 117.35 121.24 1b8t s TYR 57 Ca 0.18 -1.41 0.03 0.00 -0.37 0.00 0.00 57.07 55.50 1b8t s TYR 57 Cb -0.11 -0.58 -0.04 0.00 -0.40 0.00 0.00 41.96 40.82 1b8t s TYR 57 CO 0.09 -0.67 0.03 0.00 -1.57 0.00 0.00 175.55 173.43 1b8t n LYS 59 N 0.73 -0.12 0.00 0.00 4.81 0.11 -0.93 118.16 122.77 1b8t n LYS 59 Ca -0.11 1.00 0.00 0.00 -0.87 0.00 0.00 58.31 58.33 1b8t n LYS 59 Cb 0.52 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 34.08 1b8t n LYS 59 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1b8t n SER 60 N -3.55 0.00 -0.28 3.14 2.88 -1.26 0.18 113.62 114.73 1b8t n SER 60 Ca 0.01 0.48 -0.05 0.00 -1.33 0.00 0.00 58.87 57.98 1b8t n SER 60 Cb 0.07 -0.22 0.00 0.00 -0.75 0.00 0.00 64.21 63.31 1b8t n SER 60 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1b8t h TYR 62 N -0.11 -1.20 0.00 0.00 5.03 0.38 1.31 116.97 122.38 1b8t h TYR 62 Ca 0.26 0.08 0.00 0.00 2.58 0.00 0.00 58.73 61.65 1b8t h TYR 62 Cb 0.56 0.61 0.00 0.00 1.55 0.00 0.00 36.73 39.46 1b8t h TYR 62 CO -0.76 -0.41 0.00 0.78 -1.32 0.00 0.00 178.16 176.44 1b8t h GLY 63 N -0.19 0.00 0.13 1.82 0.00 0.28 0.16 103.07 105.28 1b8t h GLY 63 Ca 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.53 1b8t h GLY 63 CO -0.72 0.00 -0.03 1.70 0.00 0.00 0.00 176.54 177.49 1b8t h LYS 64 N 0.00 -0.07 -0.12 4.80 3.11 0.56 0.36 116.57 125.21 1b8t h LYS 64 Ca 0.00 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.83 1b8t h LYS 64 Cb 0.23 0.02 -0.00 0.00 -1.00 0.00 0.00 32.23 31.48 1b8t h LYS 64 CO 0.00 0.45 0.03 -0.22 -2.81 0.00 0.00 179.45 176.90 1b8t h LYS 65 N -0.95 0.19 -0.07 1.90 3.64 -0.09 -3.18 116.57 118.01 1b8t h LYS 65 Ca -0.01 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1b8t h LYS 65 Cb 0.56 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1b8t h LYS 65 CO 0.01 0.36 -0.00 1.88 -2.27 0.00 0.00 179.45 179.43 1b8t h TYR 66 N -0.02 0.14 -2.96 1.91 -1.99 -0.82 -3.45 116.97 109.78 1b8t h TYR 66 Ca 0.04 -0.03 -0.44 0.00 2.00 0.00 0.00 58.73 60.30 1b8t h TYR 66 Cb 0.26 -0.04 0.22 0.00 2.00 0.00 0.00 36.73 39.17 1b8t h TYR 66 CO 0.01 0.41 -0.29 0.41 -0.00 0.00 0.00 178.16 178.69 1b8t n GLY 67 N -0.24 -2.19 3.81 3.88 0.00 0.13 -4.98 105.19 105.60 1b8t n GLY 67 Ca -0.07 -1.09 -0.30 0.00 0.00 0.00 0.00 46.02 44.56 1b8t n GLY 67 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1b8t s PRO 68 N -4.15 2.36 0.31 1.61 0.04 -1.26 -4.85 135.00 129.06 1b8t s PRO 68 Ca 0.65 0.74 0.05 0.00 0.04 0.00 0.00 61.00 62.48 1b8t s PRO 68 Cb -0.22 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 1b8t s PRO 68 CO 0.66 -1.45 0.22 -1.59 0.04 0.00 0.00 177.00 174.87 1b8t s LYS 69 N -5.12 1.66 0.71 4.56 0.00 -1.26 -5.01 119.74 115.28 1b8t s LYS 69 Ca 0.60 -1.96 -0.02 0.00 0.00 0.00 0.00 55.97 54.59 1b8t s LYS 69 Cb -0.14 0.13 0.11 0.00 0.00 0.00 0.00 37.83 37.93 1b8t s LYS 69 CO 0.54 -0.55 0.98 0.20 0.00 0.00 0.00 175.35 176.52 1b8t s GLY 70 N -3.37 1.77 -0.02 0.59 0.00 -1.26 -5.12 107.32 99.90 1b8t s GLY 70 Ca 0.38 -1.55 -0.23 0.00 0.00 0.00 0.00 44.72 43.32 1b8t s GLY 70 CO 0.22 -1.03 0.51 1.25 0.00 0.00 0.00 173.10 174.05 1b8t s LYS 71 N -5.14 0.89 -0.06 2.90 2.20 -1.26 -5.17 119.74 114.10 1b8t s LYS 71 Ca 0.65 0.01 -0.12 0.00 -0.36 0.00 0.00 55.97 56.15 1b8t s LYS 71 Cb -0.07 0.41 0.02 0.00 -1.51 0.00 0.00 37.83 36.69 1b8t s LYS 71 CO 0.44 -0.27 0.29 0.20 -0.36 0.00 0.00 175.35 175.64 1b8t s GLY 72 N -1.34 -0.16 0.26 5.54 0.00 -1.26 -5.17 107.32 105.18 1b8t s GLY 72 Ca -0.11 0.52 0.02 0.00 0.00 0.00 0.00 44.72 45.14 1b8t s GLY 72 CO 0.06 0.36 0.07 1.25 0.00 0.00 0.00 173.10 174.84 1b8t s LYS 73 N -0.64 1.42 0.00 2.90 2.36 -1.26 -5.16 119.74 119.36 1b8t s LYS 73 Ca -0.07 -1.76 0.00 0.00 -2.55 0.00 0.00 55.97 51.59 1b8t s LYS 73 Cb -0.04 -0.39 0.00 0.00 -1.05 0.00 0.00 37.83 36.35 1b8t s LYS 73 CO 0.02 -0.24 0.00 0.41 1.55 0.00 0.00 175.35 177.09 1b8t n GLY 74 N -0.48 2.46 3.64 5.54 0.00 -1.26 -5.19 105.19 109.91 1b8t n GLY 74 Ca -0.01 -0.12 0.02 0.00 0.00 0.00 0.00 46.02 45.90 1b8t n GLY 74 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1b8t s MET 75 N 3.53 0.40 0.00 1.61 0.23 -1.26 -5.17 119.30 118.63 1b8t s MET 75 Ca 0.00 -0.22 0.00 0.00 -1.03 0.00 0.00 55.69 54.44 1b8t s MET 75 Cb 0.00 0.13 0.00 0.00 -1.53 0.00 0.00 34.83 33.43 1b8t s MET 75 CO 0.00 -0.18 0.00 0.41 -2.03 0.00 0.00 175.02 173.22 1b8t n GLY 76 N -0.52 3.98 3.60 3.16 0.00 -1.26 -5.19 105.19 108.96 1b8t n GLY 76 Ca -0.08 -0.56 0.01 0.00 0.00 0.00 0.00 46.02 45.39 1b8t n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b8t s ALA 77 N 0.00 -2.29 -0.17 4.61 0.00 -1.26 -5.18 121.76 117.47 1b8t s ALA 77 Ca 0.00 1.01 -0.28 0.00 0.00 0.00 0.00 51.96 52.69 1b8t s ALA 77 Cb 0.00 0.18 0.09 0.00 0.00 0.00 0.00 23.12 23.39 1b8t s ALA 77 CO 0.00 -0.94 0.79 0.20 0.00 0.00 0.00 175.76 175.81 1b8t s GLY 78 N -2.78 -0.46 -0.26 0.00 0.00 -1.26 -5.17 107.32 97.39 1b8t s GLY 78 Ca 0.13 1.85 -0.26 0.00 0.00 0.00 0.00 44.72 46.44 1b8t s GLY 78 CO -0.05 1.35 1.16 -1.08 0.00 0.00 0.00 173.10 174.49 1b8t s THR 79 N -0.46 0.00 -0.01 0.90 -1.32 -1.26 -5.18 115.64 108.31 1b8t s THR 79 Ca -0.04 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 60.16 1b8t s THR 79 Cb -0.02 -1.00 0.09 0.00 -1.51 0.00 0.00 72.50 70.06 1b8t s THR 79 CO 0.03 0.00 0.78 -0.76 -2.21 0.00 0.00 174.62 172.47 1b8t s LEU 80 N -0.20 -0.50 0.11 9.08 1.43 -1.26 -5.18 118.68 122.16 1b8t s LEU 80 Ca 0.04 0.29 -0.02 0.00 -1.03 0.00 0.00 54.13 53.41 1b8t s LEU 80 Cb -0.04 2.28 -0.03 0.00 0.03 0.00 0.00 46.19 48.43 1b8t s LEU 80 CO -0.07 -0.64 0.06 -0.94 0.23 0.00 0.00 176.35 174.98 1b8t s SER 81 N -1.89 0.32 -0.15 2.29 1.04 -1.26 -5.17 113.70 108.89 1b8t s SER 81 Ca -0.02 -1.08 -0.29 0.00 0.48 0.00 0.00 55.95 55.04 1b8t s SER 81 Cb -0.01 0.28 0.10 0.00 0.10 0.00 0.00 66.02 66.49 1b8t s SER 81 CO -0.02 -0.71 0.84 0.28 0.98 0.00 0.00 173.24 174.61 1b8t s THR 82 N -3.99 0.00 -0.00 2.02 -1.32 -1.26 -5.18 115.64 105.91 1b8t s THR 82 Ca 0.17 0.00 -0.21 0.00 -1.21 0.00 0.00 61.69 60.45 1b8t s THR 82 Cb 0.07 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 70.10 1b8t s THR 82 CO -0.03 0.00 0.45 -1.81 -2.21 0.00 0.00 174.62 171.02 1b8t s ASP 83 N -0.72 -0.36 0.03 8.08 1.11 -1.26 -5.18 116.67 118.37 1b8t s ASP 83 Ca -0.04 0.24 -0.09 0.00 0.18 0.00 0.00 52.55 52.83 1b8t s ASP 83 Cb -0.02 0.41 0.00 0.00 1.07 0.00 0.00 42.92 44.39 1b8t s ASP 83 CO 0.04 -0.57 0.18 -0.75 1.18 0.00 0.00 175.17 175.25 1b8t s LYS 84 N -1.67 0.64 0.30 8.23 2.47 -1.26 -5.18 119.74 123.27 1b8t s LYS 84 Ca -0.10 -0.57 0.07 0.00 -1.56 0.00 0.00 55.97 53.80 1b8t s LYS 84 Cb -0.02 0.26 -0.03 0.00 -1.46 0.00 0.00 37.83 36.58 1b8t s LYS 84 CO 0.04 -0.18 0.25 0.41 0.16 0.00 0.00 175.35 176.03 1b8t n GLY 85 N 0.88 3.03 3.75 5.54 0.00 -1.26 -5.18 105.19 111.95 1b8t n GLY 85 Ca -0.20 -1.88 -0.03 0.00 0.00 0.00 0.00 46.02 43.92 1b8t n GLY 85 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1b8t s GLU 86 N -3.23 1.10 0.11 1.61 2.12 -1.26 -5.18 118.70 113.98 1b8t s GLU 86 Ca 0.35 -0.62 0.04 0.00 0.36 0.00 0.00 54.97 55.10 1b8t s GLU 86 Cb 0.02 0.37 -0.04 0.00 0.26 0.00 0.00 34.13 34.73 1b8t s GLU 86 CO 0.25 -0.51 -0.10 -1.54 -0.54 0.00 0.00 175.26 172.82 1b8t s SER 87 N -3.01 1.60 0.02 -1.70 1.04 -1.26 -5.16 113.70 105.23 1b8t s SER 87 Ca 0.14 -0.88 0.02 0.00 0.48 0.00 0.00 55.95 55.70 1b8t s SER 87 Cb -0.01 -0.00 -0.01 0.00 0.10 0.00 0.00 66.02 66.10 1b8t s SER 87 CO 0.02 -0.28 -0.06 -0.22 0.98 0.00 0.00 173.24 173.68 1b8t s LEU 88 N -2.70 2.12 0.52 2.42 1.98 -1.26 -5.16 118.68 116.60 1b8t s LEU 88 Ca 0.10 -0.30 0.04 0.00 -2.89 0.00 0.00 54.13 51.07 1b8t s LEU 88 Cb -0.01 -0.20 0.01 0.00 0.66 0.00 0.00 46.19 46.65 1b8t s LEU 88 CO 0.00 -0.06 0.21 -0.83 -1.89 0.00 0.00 176.35 173.78 1b8t s GLY 89 N -0.78 2.67 0.15 7.98 0.00 -1.26 -5.16 107.32 110.92 1b8t s GLY 89 Ca -0.04 -0.90 -0.07 0.00 0.00 0.00 0.00 44.72 43.72 1b8t s GLY 89 CO 0.00 -2.06 0.21 -0.26 0.00 0.00 0.00 173.10 170.99 1b8t s ILE 90 N -2.81 0.08 -0.00 0.90 -4.36 -1.26 -5.18 121.20 108.57 1b8t s ILE 90 Ca 0.21 -1.53 -0.30 0.00 -0.26 0.00 0.00 60.65 58.77 1b8t s ILE 90 Cb -0.00 -1.87 0.11 0.00 1.25 0.00 0.00 42.46 41.95 1b8t s ILE 90 CO 0.13 -0.38 1.18 -1.59 0.24 0.00 0.00 174.94 174.52 1b8t s LYS 91 N -3.98 0.59 0.23 0.37 0.00 -1.26 -5.19 119.74 110.50 1b8t s LYS 91 Ca 0.18 -0.31 -0.22 0.00 0.00 0.00 0.00 55.97 55.63 1b8t s LYS 91 Cb 0.05 0.21 0.06 0.00 0.00 0.00 0.00 37.83 38.15 1b8t s LYS 91 CO -0.00 -0.27 0.90 0.71 0.00 0.00 0.00 175.35 176.69 1b8t s TYR 92 N -2.66 -0.03 -0.02 1.78 2.02 -1.26 -5.19 117.35 111.99 1b8t s TYR 92 Ca 0.12 -0.41 -0.30 0.00 -0.37 0.00 0.00 57.07 56.12 1b8t s TYR 92 Cb 0.02 0.71 0.11 0.00 -0.40 0.00 0.00 41.96 42.40 1b8t s TYR 92 CO -0.03 -1.09 1.08 -1.21 -1.57 0.00 0.00 175.55 172.73 1b8t s GLU 93 N -2.89 0.68 -0.13 -0.62 2.02 -1.26 -5.19 118.70 111.30 1b8t s GLU 93 Ca 0.15 -0.32 -0.34 0.00 0.02 0.00 0.00 54.97 54.49 1b8t s GLU 93 Cb -0.03 0.27 0.14 0.00 0.10 0.00 0.00 34.13 34.61 1b8t s GLU 93 CO 0.06 -0.30 1.34 -1.21 0.02 0.00 0.00 175.26 175.17 1b8t s GLU 94 N -2.82 0.19 0.00 1.61 0.41 -1.26 -5.18 118.70 111.65 1b8t s GLU 94 Ca 0.10 -0.09 0.00 0.00 -0.41 0.00 0.00 54.97 54.57 1b8t s GLU 94 Cb 0.00 0.07 0.00 0.00 -1.78 0.00 0.00 34.13 32.42 1b8t s GLU 94 CO -0.04 -0.08 0.00 0.41 -0.49 0.00 0.00 175.26 175.06 1b8t n GLY 95 N -0.31 2.35 3.64 -1.39 0.00 -1.26 -5.19 105.19 103.03 1b8t n GLY 95 Ca -0.04 -0.08 -0.03 0.00 0.00 0.00 0.00 46.02 45.86 1b8t n GLY 95 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1b8t s GLN 96 N -1.11 0.12 -0.25 1.61 -2.07 -1.26 -5.18 119.66 111.52 1b8t s GLN 96 Ca 0.00 0.05 -0.28 0.00 -1.82 0.00 0.00 55.36 53.31 1b8t s GLN 96 Cb 0.00 0.06 0.16 0.00 -1.09 0.00 0.00 33.01 32.14 1b8t s GLN 96 CO 0.00 -0.03 1.22 0.45 -1.32 0.00 0.00 175.29 175.61 1b8t s SER 97 N -0.84 -0.20 -0.21 12.60 0.15 -1.26 -5.19 113.70 118.76 1b8t s SER 97 Ca 0.07 0.29 -0.34 0.00 0.70 0.00 0.00 55.95 56.67 1b8t s SER 97 Cb -0.02 0.26 0.15 0.00 -1.71 0.00 0.00 66.02 64.70 1b8t s SER 97 CO -0.08 -0.14 1.23 -2.28 1.20 0.00 0.00 173.24 173.17 1b8t s HIS 98 N -0.60 -0.12 -0.05 3.44 5.04 -1.26 -5.19 115.29 116.54 1b8t s HIS 98 Ca 0.05 0.10 -0.23 0.00 -1.54 0.00 0.00 55.06 53.44 1b8t s HIS 98 Cb -0.02 0.51 0.05 0.00 0.04 0.00 0.00 32.58 33.15 1b8t s HIS 98 CO -0.07 -0.18 0.51 -0.98 -2.34 0.00 0.00 174.74 171.69 1b8t s ARG 99 N -2.14 0.85 0.84 2.88 1.70 -1.26 -5.17 118.95 116.65 1b8t s ARG 99 Ca 0.09 0.14 -0.12 0.00 -0.47 0.00 0.00 55.73 55.37 1b8t s ARG 99 Cb -0.01 0.39 0.09 0.00 -0.57 0.00 0.00 34.95 34.86 1b8t s ARG 99 CO -0.04 -0.24 1.11 -1.25 -1.08 0.00 0.00 175.30 173.80 1b8t s PRO 100 N -1.07 1.75 0.36 3.89 0.04 -1.26 -5.09 135.00 133.63 1b8t s PRO 100 Ca -0.11 0.51 0.06 0.00 0.04 0.00 0.00 61.00 61.50 1b8t s PRO 100 Cb -0.03 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 32.55 1b8t s PRO 100 CO 0.07 -1.83 0.01 0.95 0.04 0.00 0.00 177.00 176.24 1b8t s THR 101 N -3.20 1.71 -0.29 1.26 -4.23 -1.26 -5.13 115.64 104.49 1b8t s THR 101 Ca 0.62 -2.03 -0.02 0.00 -1.18 0.00 0.00 61.69 59.08 1b8t s THR 101 Cb -0.14 -2.85 0.19 0.00 1.34 0.00 0.00 72.50 71.03 1b8t s THR 101 CO 0.54 -0.04 0.81 0.21 -0.54 0.00 0.00 174.62 175.59 1b8t s ASN 102 N -3.60 -1.06 1.11 3.99 3.84 -1.26 -5.17 114.94 112.80 1b8t s ASN 102 Ca 0.35 0.11 -0.18 0.00 0.21 0.00 0.00 52.86 53.35 1b8t s ASN 102 Cb 0.08 1.66 0.25 0.00 -0.55 0.00 0.00 41.25 42.70 1b8t s ASN 102 CO 0.16 -0.19 1.16 -0.81 -2.79 0.00 0.00 177.10 174.63 1b8t n PRO 103 N 5.25 -2.11 -3.85 0.43 -0.04 -1.26 -5.10 135.00 128.32 1b8t n PRO 103 Ca 0.07 -1.81 -0.10 0.00 -0.04 0.00 0.00 63.50 61.62 1b8t n PRO 103 Cb 0.56 -1.42 -0.05 0.00 -0.04 0.00 0.00 33.50 32.54 1b8t n PRO 103 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1b8t s ASN 104 N -4.99 -0.11 -0.29 3.54 2.47 -1.26 -5.17 114.94 109.13 1b8t s ASN 104 Ca 0.70 -0.67 -0.25 0.00 0.42 0.00 0.00 52.86 53.06 1b8t s ASN 104 Cb -0.04 0.51 0.14 0.00 -1.45 0.00 0.00 41.25 40.41 1b8t s ASN 104 CO 0.51 -0.98 1.14 0.00 -3.72 0.00 0.00 177.10 174.05 1b8t s ALA 105 N -3.92 -2.05 0.05 1.71 0.00 -1.26 -5.18 121.76 111.11 1b8t s ALA 105 Ca 0.13 1.83 -0.17 0.00 0.00 0.00 0.00 51.96 53.76 1b8t s ALA 105 Cb 0.01 -1.53 0.03 0.00 0.00 0.00 0.00 23.12 21.63 1b8t s ALA 105 CO -0.01 -0.20 0.38 0.45 0.00 0.00 0.00 175.76 176.37 1b8t s SER 106 N 0.20 -0.23 -0.30 0.00 0.15 -1.26 -5.17 113.70 107.10 1b8t s SER 106 Ca 0.04 -0.08 -0.27 0.00 0.70 0.00 0.00 55.95 56.34 1b8t s SER 106 Cb -0.05 0.41 0.20 0.00 -1.71 0.00 0.00 66.02 64.86 1b8t s SER 106 CO -0.09 -0.66 1.43 -0.60 1.20 0.00 0.00 173.24 174.52 1b8t s ARG 107 N -2.57 0.03 -0.29 5.44 3.52 -1.26 -5.19 118.95 118.63 1b8t s ARG 107 Ca -0.05 0.02 -0.30 0.00 -0.13 0.00 0.00 55.73 55.27 1b8t s ARG 107 Cb -0.01 0.01 0.19 0.00 -1.56 0.00 0.00 34.95 33.59 1b8t s ARG 107 CO -0.03 -0.01 1.38 0.00 -0.81 0.00 0.00 175.30 175.83 1b8t s MET 108 N -0.52 0.03 -0.19 5.12 0.23 -1.26 -5.19 119.30 117.52 1b8t s MET 108 Ca 0.09 0.01 -0.36 0.00 -1.03 0.00 0.00 55.69 54.40 1b8t s MET 108 Cb -0.03 0.01 0.14 0.00 -1.53 0.00 0.00 34.83 33.43 1b8t s MET 108 CO -0.12 -0.01 1.30 0.00 -2.03 0.00 0.00 175.02 174.15 1b8t s ALA 109 N -1.12 -2.17 0.00 3.16 0.00 -1.26 -5.19 121.76 115.18 1b8t s ALA 109 Ca 0.10 1.54 0.00 0.00 0.00 0.00 0.00 51.96 53.60 1b8t s ALA 109 Cb -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 22.99 1b8t s ALA 109 CO -0.08 -0.68 0.00 0.94 0.00 0.00 0.00 175.76 175.95 1b8t n GLN 110 N -0.15 0.00 -3.61 0.00 7.27 -1.26 -5.19 117.38 114.44 1b8t n GLN 110 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 57.00 57.04 1b8t n GLN 110 Cb 0.59 0.00 -0.01 0.00 2.41 0.00 0.00 30.24 33.22 1b8t n GLN 110 CO 0.00 0.00 0.00 -1.59 0.07 0.00 0.00 177.06 175.54 1b8t s LYS 111 N -2.00 0.62 0.17 3.69 -2.85 -1.26 -5.19 119.74 112.93 1b8t s LYS 111 Ca 0.00 -0.29 -0.01 0.00 -1.00 0.00 0.00 55.97 54.66 1b8t s LYS 111 Cb 0.00 0.25 -0.04 0.00 -2.06 0.00 0.00 37.83 35.98 1b8t s LYS 111 CO 0.00 -0.28 0.10 0.54 0.10 0.00 0.00 175.35 175.81 1b8t s VAL 112 N -2.75 0.05 0.12 1.79 0.11 -1.26 -5.17 120.40 113.28 1b8t s VAL 112 Ca 0.10 -1.96 -0.04 0.00 -2.93 0.00 0.00 61.98 57.15 1b8t s VAL 112 Cb 0.01 -2.30 0.02 0.00 -1.53 0.00 0.00 36.38 32.58 1b8t s VAL 112 CO -0.04 -0.21 0.23 0.61 -3.33 0.00 0.00 175.10 172.37 1b8t n GLY 113 N -0.19 1.73 0.00 6.54 0.00 -1.26 -5.18 105.19 106.83 1b8t n GLY 113 Ca -0.01 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.91 1b8t n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b8t n GLY 114 N -0.16 1.53 1.44 -0.02 0.00 -1.26 -5.16 105.19 101.56 1b8t n GLY 114 Ca -0.03 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 43.88 1b8t n GLY 114 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1b8t n SER 115 N 0.00 -7.80 0.00 1.61 2.88 -1.26 -5.09 113.62 103.96 1b8t n SER 115 Ca 0.00 1.38 0.00 0.00 -1.33 0.00 0.00 58.87 58.92 1b8t n SER 115 Cb 0.00 -4.38 0.00 0.00 -0.75 0.00 0.00 64.21 59.08 1b8t n SER 115 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1b8t n ASP 116 N -1.61 0.00 -4.38 -3.46 9.92 -0.56 -5.06 116.55 111.41 1b8t n ASP 116 Ca 0.00 0.00 -0.21 0.00 -0.53 0.00 0.00 54.79 54.05 1b8t n ASP 116 Cb 0.19 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.57 1b8t n ASP 116 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1b8t s GLY 117 N 0.00 2.11 -0.44 0.44 0.00 -1.26 -0.04 107.32 108.13 1b8t s GLY 117 Ca 0.00 -1.88 -0.16 0.00 0.00 0.00 0.00 44.72 42.67 1b8t s GLY 117 CO 0.00 -1.78 0.41 0.00 0.00 0.00 0.00 173.10 171.73 1b8t n PRO 119 N 5.45 0.48 -0.03 0.00 -0.04 -1.26 0.28 135.00 139.88 1b8t n PRO 119 Ca -0.09 0.05 -0.01 0.00 -0.04 0.00 0.00 63.50 63.40 1b8t n PRO 119 Cb 0.46 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.42 1b8t n PRO 119 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1b8t h ARG 120 N 0.00 0.00 0.18 0.54 1.12 -1.90 -3.41 114.38 110.90 1b8t h ARG 120 Ca 0.00 0.00 -0.27 0.00 -1.11 0.00 0.00 59.98 58.60 1b8t h ARG 120 Cb 0.13 0.00 0.02 0.00 -0.01 0.00 0.00 29.97 30.11 1b8t h ARG 120 CO 0.00 0.00 -1.24 0.00 -3.11 0.00 0.00 179.97 175.62 1b8t n GLY 122 N 1.72 1.34 1.22 0.00 0.00 0.14 -5.09 105.19 104.52 1b8t n GLY 122 Ca -0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 1b8t n GLY 122 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1b8t n GLN 123 N 0.00 -2.56 -3.84 1.61 6.02 -1.23 -4.47 117.38 112.91 1b8t n GLN 123 Ca 0.00 -0.51 -0.20 0.00 -0.01 0.00 0.00 57.00 56.28 1b8t n GLN 123 Cb 0.00 -0.70 -0.02 0.00 1.02 0.00 0.00 30.24 30.54 1b8t n GLN 123 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1b8t s ALA 124 N -2.04 4.01 -0.12 -1.58 0.00 -1.26 0.03 121.76 120.80 1b8t s ALA 124 Ca 0.23 -1.30 -0.01 0.00 0.00 0.00 0.00 51.96 50.88 1b8t s ALA 124 Cb -0.04 -1.70 0.04 0.00 0.00 0.00 0.00 23.12 21.41 1b8t s ALA 124 CO 0.19 0.16 -0.01 0.08 0.00 0.00 0.00 175.76 176.19 1b8t s VAL 125 N -2.04 0.63 -0.28 0.00 1.01 0.94 -4.47 120.40 116.18 1b8t s VAL 125 Ca 0.37 -0.22 -0.15 0.00 0.00 0.00 0.00 61.98 61.98 1b8t s VAL 125 Cb -0.09 -0.85 0.09 0.00 0.00 0.00 0.00 36.38 35.53 1b8t s VAL 125 CO 0.29 0.15 0.70 -0.72 0.00 0.00 0.00 175.10 175.52 1b8t s TYR 126 N 1.85 -1.07 0.00 5.22 1.13 -1.26 -1.49 117.35 121.73 1b8t s TYR 126 Ca 0.03 2.11 0.00 0.00 -1.41 0.00 0.00 57.07 57.80 1b8t s TYR 126 Cb -0.14 0.64 0.00 0.00 -1.10 0.00 0.00 41.96 41.36 1b8t s TYR 126 CO -0.07 -0.53 0.00 0.00 -2.51 0.00 0.00 175.55 172.44 1b8t n ALA 127 N 4.41 0.00 -1.46 9.51 0.00 -1.26 -4.82 120.51 126.89 1b8t n ALA 127 Ca -0.19 0.00 -0.54 0.00 0.00 0.00 0.00 53.44 52.71 1b8t n ALA 127 Cb 0.58 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.97 1b8t n ALA 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1b8t n ALA 128 N 3.49 -3.32 -1.76 0.00 0.00 -1.26 -3.05 120.51 114.61 1b8t n ALA 128 Ca 0.00 0.53 -0.02 0.00 0.00 0.00 0.00 53.44 53.95 1b8t n ALA 128 Cb 0.00 -1.70 0.01 0.00 0.00 0.00 0.00 19.45 17.76 1b8t n ALA 128 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1b8t n GLU 129 N 1.29 -0.32 -3.36 0.00 4.07 -1.26 -5.06 120.64 116.00 1b8t n GLU 129 Ca 0.19 0.19 -0.15 0.00 -0.06 0.00 0.00 57.16 57.33 1b8t n GLU 129 Cb 0.15 -2.15 -0.08 0.00 -0.06 0.00 0.00 31.44 29.30 1b8t n GLU 129 CO 0.00 0.00 0.00 -1.59 -0.06 0.00 0.00 177.13 175.48 1b8t s LYS 130 N -3.19 0.50 0.18 5.31 0.00 -1.17 -4.52 119.74 116.86 1b8t s LYS 130 Ca 0.06 -0.42 -0.12 0.00 0.00 0.00 0.00 55.97 55.49 1b8t s LYS 130 Cb -0.01 -0.59 -0.07 0.00 0.00 0.00 0.00 37.83 37.16 1b8t s LYS 130 CO 0.11 -1.11 0.54 0.54 0.00 0.00 0.00 175.35 175.43 1b8t s VAL 131 N 1.96 4.91 -0.17 1.79 0.11 0.11 -4.89 120.40 124.21 1b8t s VAL 131 Ca 0.13 0.64 0.00 0.00 -2.93 0.00 0.00 61.98 59.82 1b8t s VAL 131 Cb -0.14 -3.67 0.04 0.00 -1.53 0.00 0.00 36.38 31.07 1b8t s VAL 131 CO -0.18 0.10 -0.10 -0.63 -3.33 0.00 0.00 175.10 170.96 1b8t s ILE 132 N -1.62 1.46 0.05 7.04 1.01 -1.26 -0.95 121.20 126.93 1b8t s ILE 132 Ca 0.42 -0.77 -0.15 0.00 0.00 0.00 0.00 60.65 60.15 1b8t s ILE 132 Cb -0.13 -1.50 0.02 0.00 0.01 0.00 0.00 42.46 40.86 1b8t s ILE 132 CO 0.20 0.25 0.33 -0.83 0.00 0.00 0.00 174.94 174.89 1b8t s GLY 133 N 1.50 -0.16 -1.45 6.18 0.00 0.30 -4.91 107.32 108.77 1b8t s GLY 133 Ca 0.01 0.04 -0.02 0.00 0.00 0.00 0.00 44.72 44.75 1b8t s GLY 133 CO -0.09 -0.19 0.42 0.00 0.00 0.00 0.00 173.10 173.24 1b8t n ALA 134 N 0.44 -1.93 -4.21 3.20 0.00 -1.26 0.24 120.51 116.98 1b8t n ALA 134 Ca -0.18 -0.25 -0.35 0.00 0.00 0.00 0.00 53.44 52.65 1b8t n ALA 134 Cb 0.60 -1.63 -0.03 0.00 0.00 0.00 0.00 19.45 18.39 1b8t n ALA 134 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b8t n GLY 135 N -1.98 -0.40 3.48 0.00 0.00 -1.26 -4.49 105.19 100.54 1b8t n GLY 135 Ca -0.27 0.13 -0.10 0.00 0.00 0.00 0.00 46.02 45.78 1b8t n GLY 135 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b8t s LYS 136 N -6.92 1.46 -0.02 1.61 1.02 0.14 -5.06 119.74 111.97 1b8t s LYS 136 Ca 0.62 -1.36 0.05 0.00 0.02 0.00 0.00 55.97 55.30 1b8t s LYS 136 Cb -0.34 0.42 -0.01 0.00 -0.52 0.00 0.00 37.83 37.37 1b8t s LYS 136 CO 0.93 -0.58 -0.17 -1.12 -0.92 0.00 0.00 175.35 173.49 1b8t s SER 137 N -3.06 2.04 0.30 2.83 0.01 -1.26 -0.54 113.70 114.01 1b8t s SER 137 Ca 0.27 -0.32 -0.20 0.00 1.31 0.00 0.00 55.95 57.02 1b8t s SER 137 Cb 0.01 -0.32 0.02 0.00 0.21 0.00 0.00 66.02 65.95 1b8t s SER 137 CO 0.10 0.19 0.72 -1.66 0.41 0.00 0.00 173.24 173.00 1b8t s TRP 138 N -0.28 -0.11 0.04 2.43 -2.14 -0.12 -4.11 118.94 114.65 1b8t s TRP 138 Ca 0.04 -0.38 -0.30 0.00 2.66 0.00 0.00 56.10 58.11 1b8t s TRP 138 Cb -0.08 0.70 -0.05 0.00 -3.10 0.00 0.00 33.47 30.94 1b8t s TRP 138 CO 0.00 -1.28 1.26 -1.01 -2.66 0.00 0.00 176.95 173.26 1b8t s HIS 139 N -3.66 3.26 0.27 1.66 3.76 -1.26 0.05 115.29 119.37 1b8t s HIS 139 Ca 0.12 1.15 0.27 0.00 -0.15 0.00 0.00 55.06 56.45 1b8t s HIS 139 Cb -0.06 -3.50 1.45 0.00 1.11 0.00 0.00 32.58 31.59 1b8t s HIS 139 CO 0.08 -1.64 1.79 -0.22 -0.85 0.00 0.00 174.74 173.90 1b8t h LYS 140 N 7.10 0.00 0.00 1.40 3.64 -1.89 0.66 116.57 127.48 1b8t h LYS 140 Ca -0.40 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 58.94 1b8t h LYS 140 Cb 1.20 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 1b8t h LYS 140 CO 0.85 0.00 -0.24 0.77 -2.27 0.00 0.00 179.45 178.56 1b8t h SER 141 N 0.00 0.00 0.50 4.20 0.02 -1.89 -3.39 113.55 112.99 1b8t h SER 141 Ca 0.00 -0.78 -0.02 0.00 -0.84 0.00 0.00 61.79 60.15 1b8t h SER 141 Cb 0.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1b8t h SER 141 CO 0.00 1.03 -0.24 0.00 -1.14 0.00 0.00 176.83 176.48 1b8t n PHE 143 N -5.24 0.21 -3.93 0.00 7.35 0.21 -4.83 117.46 111.23 1b8t n PHE 143 Ca -0.09 0.14 -0.10 0.00 -0.76 0.00 0.00 57.45 56.64 1b8t n PHE 143 Cb 0.29 -0.96 -0.12 0.00 0.35 0.00 0.00 39.48 39.05 1b8t n PHE 143 CO 0.00 0.00 0.00 -0.98 -0.76 0.00 0.00 176.76 175.02 1b8t s ARG 144 N 4.36 0.26 -0.09 -4.13 1.70 -1.26 -1.45 118.95 118.34 1b8t s ARG 144 Ca 0.70 -0.41 -0.39 0.00 -0.47 0.00 0.00 55.73 55.16 1b8t s ARG 144 Cb -0.59 0.10 -0.17 0.00 -0.57 0.00 0.00 34.95 33.71 1b8t s ARG 144 CO 0.26 -0.05 1.44 0.00 -1.08 0.00 0.00 175.30 175.87 1b8t n ALA 146 N 3.31 4.24 0.00 0.00 0.00 -0.55 -0.13 120.51 127.37 1b8t n ALA 146 Ca 0.22 -1.30 0.00 0.00 0.00 0.00 0.00 53.44 52.36 1b8t n ALA 146 Cb 0.13 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.34 1b8t n ALA 146 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1b8t n LYS 147 N 0.07 0.00 -0.02 0.00 3.00 -1.26 -4.87 118.16 115.07 1b8t n LYS 147 Ca 0.26 0.00 0.02 0.00 -0.00 0.00 0.00 58.31 58.58 1b8t n LYS 147 Cb 0.83 -0.33 -0.08 0.00 0.00 0.00 0.00 35.03 35.45 1b8t n LYS 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1b8t n GLY 149 N 2.06 0.53 3.56 0.00 0.00 0.81 -5.01 105.19 107.14 1b8t n GLY 149 Ca -0.07 -0.87 -0.43 0.00 0.00 0.00 0.00 46.02 44.66 1b8t n GLY 149 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1b8t s LYS 150 N -2.09 3.57 0.24 1.61 2.36 -1.24 -4.67 119.74 119.51 1b8t s LYS 150 Ca 0.00 0.12 -0.31 0.00 -2.55 0.00 0.00 55.97 53.23 1b8t s LYS 150 Cb 0.00 -3.88 -0.14 0.00 -1.05 0.00 0.00 37.83 32.76 1b8t s LYS 150 CO 0.00 -1.04 1.33 0.43 1.55 0.00 0.00 175.35 177.62 1b8t n SER 151 N 6.71 2.39 -3.68 1.43 7.64 -1.26 -1.26 113.62 125.58 1b8t n SER 151 Ca 0.04 1.15 -0.14 0.00 1.01 0.00 0.00 58.87 60.92 1b8t n SER 151 Cb 0.48 -1.38 0.01 0.00 -1.01 0.00 0.00 64.21 62.32 1b8t n SER 151 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1b8t n LEU 152 N 1.98 0.00 0.00 -3.43 4.32 -0.53 -4.85 117.00 114.49 1b8t n LEU 152 Ca 0.12 -1.61 0.00 0.00 -0.02 0.00 0.00 56.01 54.50 1b8t n LEU 152 Cb 0.30 -0.10 0.00 0.00 -1.62 0.00 0.00 43.42 42.00 1b8t n LEU 152 CO 0.62 -0.51 0.00 1.21 -1.22 0.00 0.00 177.39 177.49 1b8t n GLU 153 N -1.43 0.00 0.00 3.23 0.00 -1.26 -4.83 120.64 116.35 1b8t n GLU 153 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.19 1b8t n GLU 153 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.80 1b8t n GLU 153 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 1b8t n SER 154 N 0.00 0.00 0.00 4.31 3.41 -1.26 -5.01 113.62 115.07 1b8t n SER 154 Ca 0.00 0.82 0.00 0.00 -0.26 0.00 0.00 58.87 59.43 1b8t n SER 154 Cb 0.00 -0.32 0.00 0.00 -0.26 0.00 0.00 64.21 63.63 1b8t n SER 154 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1b8t n THR 155 N -1.82 0.00 -4.13 6.66 5.66 -1.26 -5.03 114.28 114.36 1b8t n THR 155 Ca 0.00 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.66 1b8t n THR 155 Cb 0.00 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 68.74 1b8t n THR 155 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1b8t n THR 156 N 0.00 -2.30 -5.22 1.09 -2.24 -1.26 -4.89 114.28 99.46 1b8t n THR 156 Ca 0.00 -0.57 -0.32 0.00 -2.27 0.00 0.00 64.05 60.90 1b8t n THR 156 Cb 0.00 -1.97 -0.17 0.00 -2.10 0.00 0.00 70.33 66.09 1b8t n THR 156 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1b8t s LEU 157 N -7.25 2.07 0.14 3.22 2.96 -1.26 -1.30 118.68 117.26 1b8t s LEU 157 Ca 0.17 -0.54 -0.04 0.00 -0.22 0.00 0.00 54.13 53.50 1b8t s LEU 157 Cb -0.09 -1.38 -0.05 0.00 0.50 0.00 0.00 46.19 45.17 1b8t s LEU 157 CO 0.96 0.18 0.36 0.00 -1.32 0.00 0.00 176.35 176.54 1b8t s ALA 158 N 0.18 3.81 -0.32 5.97 0.00 0.10 -4.87 121.76 126.64 1b8t s ALA 158 Ca -0.14 -0.59 -0.00 0.00 0.00 0.00 0.00 51.96 51.23 1b8t s ALA 158 Cb -0.17 -2.10 0.10 0.00 0.00 0.00 0.00 23.12 20.96 1b8t s ALA 158 CO 0.07 0.68 0.10 0.16 0.00 0.00 0.00 175.76 176.78 1b8t s ASP 159 N -2.45 4.08 -0.89 0.00 1.47 -1.26 -0.71 116.67 116.92 1b8t s ASP 159 Ca 0.41 -1.76 -0.15 0.00 1.18 0.00 0.00 52.55 52.22 1b8t s ASP 159 Cb -0.12 -0.95 0.19 0.00 -0.34 0.00 0.00 42.92 41.70 1b8t s ASP 159 CO 0.25 -0.40 0.92 -0.75 0.68 0.00 0.00 175.17 175.87 1b8t s LYS 160 N 1.46 3.64 -0.43 2.11 2.47 0.13 -4.71 119.74 124.42 1b8t s LYS 160 Ca 0.10 -2.27 -0.36 0.00 -1.56 0.00 0.00 55.97 51.89 1b8t s LYS 160 Cb -0.18 -4.62 0.05 0.00 -1.46 0.00 0.00 37.83 31.63 1b8t s LYS 160 CO -0.22 -1.46 0.61 -0.25 0.16 0.00 0.00 175.35 174.19 1b8t n ASP 161 N 4.82 -5.00 0.00 1.43 9.92 -1.26 -0.51 116.55 125.95 1b8t n ASP 161 Ca 0.18 -0.18 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1b8t n ASP 161 Cb 0.47 -1.46 0.00 0.00 -0.64 0.00 0.00 41.12 39.49 1b8t n ASP 161 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1b8t n GLY 162 N -0.22 1.73 3.74 0.44 0.00 -1.26 -4.97 105.19 104.65 1b8t n GLY 162 Ca -0.09 -0.18 -0.38 0.00 0.00 0.00 0.00 46.02 45.38 1b8t n GLY 162 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b8t n GLU 163 N 0.00 1.38 -4.37 1.61 1.02 0.34 -4.89 120.64 115.73 1b8t n GLU 163 Ca 0.00 0.52 -0.22 0.00 -0.02 0.00 0.00 57.16 57.45 1b8t n GLU 163 Cb 0.00 -2.56 -0.16 0.00 -0.02 0.00 0.00 31.44 28.69 1b8t n GLU 163 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1b8t s ILE 164 N -1.34 0.81 0.23 -3.67 -4.36 -1.26 0.21 121.20 111.82 1b8t s ILE 164 Ca 0.78 -0.31 0.04 0.00 -0.26 0.00 0.00 60.65 60.91 1b8t s ILE 164 Cb -0.40 -0.76 -0.02 0.00 1.25 0.00 0.00 42.46 42.54 1b8t s ILE 164 CO 0.44 0.27 0.22 -1.22 0.24 0.00 0.00 174.94 174.89 1b8t n TYR 165 N 3.76 -0.65 -3.94 1.37 4.01 0.11 -1.49 117.16 120.34 1b8t n TYR 165 Ca -0.23 -1.92 -0.33 0.00 -0.16 0.00 0.00 57.90 55.26 1b8t n TYR 165 Cb 0.52 0.23 -0.05 0.00 -0.31 0.00 0.00 39.34 39.73 1b8t n TYR 165 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1b8t h LYS 167 N 3.94 0.21 -0.63 0.00 3.11 -1.53 1.76 116.57 123.43 1b8t h LYS 167 Ca -0.49 -0.01 0.13 0.00 -2.81 0.00 0.00 60.65 57.46 1b8t h LYS 167 Cb 1.19 -0.05 -0.04 0.00 -1.00 0.00 0.00 32.23 32.33 1b8t h LYS 167 CO 0.67 0.14 0.43 0.78 -2.81 0.00 0.00 179.45 178.66 1b8t h GLY 168 N 0.22 0.49 0.21 5.01 0.00 -1.94 0.42 103.07 107.48 1b8t h GLY 168 Ca 0.62 -0.13 -0.10 0.00 0.00 0.00 0.00 47.33 47.72 1b8t h GLY 168 CO -0.67 0.06 -0.50 0.00 0.00 0.00 0.00 176.54 175.43 1b8t h TYR 170 N -0.79 0.03 0.00 0.00 3.20 0.36 0.24 116.97 120.00 1b8t h TYR 170 Ca -0.11 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.76 1b8t h TYR 170 Cb 1.26 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.52 1b8t h TYR 170 CO 0.22 0.01 -0.20 0.00 -1.64 0.00 0.00 178.16 176.55 1b8t h ALA 171 N 1.73 0.00 -0.23 1.82 0.00 -0.28 -3.23 119.26 119.08 1b8t h ALA 171 Ca 0.25 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1b8t h ALA 171 Cb 0.99 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1b8t h ALA 171 CO -0.01 0.20 0.00 1.63 0.00 0.00 0.00 179.25 181.07 1b8t n LYS 172 N -4.63 0.00 -0.69 0.00 4.01 -0.48 0.28 118.16 116.64 1b8t n LYS 172 Ca -0.03 0.77 0.53 0.00 -0.51 0.00 0.00 58.31 59.06 1b8t n LYS 172 Cb 0.10 -1.46 0.81 0.00 -0.51 0.00 0.00 35.03 33.97 1b8t n LYS 172 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 1b8t n ASN 173 N -2.47 0.00 -2.91 4.39 5.15 0.81 0.12 115.26 120.36 1b8t n ASN 173 Ca 0.00 0.98 -0.31 0.00 -0.60 0.00 0.00 54.58 54.65 1b8t n ASN 173 Cb 0.00 -0.49 -0.01 0.00 -0.53 0.00 0.00 39.78 38.76 1b8t n ASN 173 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1b8t n PHE 174 N -3.89 3.49 -4.16 1.20 3.01 0.14 -5.02 117.46 112.24 1b8t n PHE 174 Ca 0.44 -3.24 -0.12 0.00 1.01 0.00 0.00 57.45 55.54 1b8t n PHE 174 Cb 2.01 -0.58 -0.10 0.00 -0.01 0.00 0.00 39.48 40.79 1b8t n PHE 174 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1b8t s GLY 175 N -2.79 0.76 0.70 1.37 0.00 0.33 -4.79 107.32 102.91 1b8t s GLY 175 Ca 0.47 -1.23 -0.11 0.00 0.00 0.00 0.00 44.72 43.86 1b8t s GLY 175 CO -0.19 -1.32 1.06 2.56 0.00 0.00 0.00 173.10 175.21 1b8t s PRO 176 N -3.23 2.91 0.05 2.90 0.04 -1.26 -5.02 135.00 131.39 1b8t s PRO 176 Ca 0.07 0.94 -0.01 0.00 0.04 0.00 0.00 61.00 62.04 1b8t s PRO 176 Cb 0.01 -1.99 -0.00 0.00 0.04 0.00 0.00 34.50 32.56 1b8t s PRO 176 CO -0.02 -1.12 -0.02 1.63 0.04 0.00 0.00 177.00 177.50 1b8t n LYS 177 N -3.14 0.04 0.00 4.56 5.02 -1.26 -5.16 118.16 118.22 1b8t n LYS 177 Ca 0.07 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.38 1b8t n LYS 177 Cb 0.54 -0.44 0.00 0.00 -0.02 0.00 0.00 35.03 35.11 1b8t n LYS 177 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1b8t n GLY 178 N 3.30 -0.16 3.63 0.72 0.00 -1.26 -5.12 105.19 106.30 1b8t n GLY 178 Ca -0.01 -1.70 -0.00 0.00 0.00 0.00 0.00 46.02 44.30 1b8t n GLY 178 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1b8t s PHE 179 N -2.70 -0.07 0.00 1.61 -0.71 -1.26 -5.17 117.98 109.68 1b8t s PHE 179 Ca 0.00 -0.05 0.00 0.00 -1.04 0.00 0.00 56.93 55.84 1b8t s PHE 179 Cb 0.00 0.56 0.00 0.00 -1.21 0.00 0.00 43.02 42.37 1b8t s PHE 179 CO 0.00 -0.36 0.00 0.41 -1.34 0.00 0.00 175.22 173.93 1b8t n GLY 180 N -0.43 1.40 3.39 1.99 0.00 -1.26 -5.19 105.19 105.10 1b8t n GLY 180 Ca -0.07 0.49 -0.19 0.00 0.00 0.00 0.00 46.02 46.25 1b8t n GLY 180 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1b8t s PHE 181 N 0.00 1.78 -0.30 1.61 5.36 -1.26 -5.15 117.98 120.03 1b8t s PHE 181 Ca 0.00 -0.89 -0.15 0.00 -0.96 0.00 0.00 56.93 54.93 1b8t s PHE 181 Cb 0.00 -1.08 0.18 0.00 -0.34 0.00 0.00 43.02 41.78 1b8t s PHE 181 CO 0.00 0.04 1.10 0.20 -1.46 0.00 0.00 175.22 175.10 1b8t s GLY 182 N -3.40 -0.17 -0.28 13.12 0.00 -1.26 -5.17 107.32 110.17 1b8t s GLY 182 Ca 0.32 3.04 -0.27 0.00 0.00 0.00 0.00 44.72 47.80 1b8t s GLY 182 CO 0.12 3.64 1.32 1.62 0.00 0.00 0.00 173.10 179.80 1b8t s GLN 183 N 2.69 0.17 0.00 2.90 2.00 -1.26 -5.19 119.66 120.97 1b8t s GLN 183 Ca -0.02 0.11 0.00 0.00 -2.00 0.00 0.00 55.36 53.45 1b8t s GLN 183 Cb -0.07 0.08 0.00 0.00 0.80 0.00 0.00 33.01 33.82 1b8t s GLN 183 CO -0.13 -0.04 0.00 0.41 -0.50 0.00 0.00 175.29 175.04 1b8t n GLY 184 N 1.17 0.94 3.60 2.59 0.00 -1.26 -5.19 105.19 107.05 1b8t n GLY 184 Ca -0.07 -0.77 -0.03 0.00 0.00 0.00 0.00 46.02 45.16 1b8t n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b8t s ALA 185 N -2.00 -2.11 0.00 4.61 0.00 -1.26 -5.19 121.76 115.81 1b8t s ALA 185 Ca 0.00 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1b8t s ALA 185 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.19 1b8t s ALA 185 CO 0.00 -0.76 0.00 0.41 0.00 0.00 0.00 175.76 175.41 1b8t n GLY 186 N -0.23 -1.12 3.65 0.00 0.00 -1.26 -5.18 105.19 101.05 1b8t n GLY 186 Ca -0.03 -1.17 -0.01 0.00 0.00 0.00 0.00 46.02 44.81 1b8t n GLY 186 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b8t s ALA 187 N -1.00 -2.01 -0.05 4.61 0.00 -1.26 -5.18 121.76 116.87 1b8t s ALA 187 Ca 0.00 0.67 -0.07 0.00 0.00 0.00 0.00 51.96 52.56 1b8t s ALA 187 Cb 0.00 0.38 0.01 0.00 0.00 0.00 0.00 23.12 23.52 1b8t s ALA 187 CO 0.00 -0.96 0.18 -1.17 0.00 0.00 0.00 175.76 173.81 1b8t s LEU 188 N -2.83 1.33 0.07 0.00 0.20 -1.26 -5.16 118.68 111.03 1b8t s LEU 188 Ca 0.12 0.21 0.08 0.00 0.69 0.00 0.00 54.13 55.23 1b8t s LEU 188 Cb 0.02 0.69 -0.03 0.00 -0.43 0.00 0.00 46.19 46.44 1b8t s LEU 188 CO -0.03 -0.17 -0.21 0.27 -0.29 0.00 0.00 176.35 175.93 1b8t s ILE 189 N -0.37 1.69 0.06 6.68 -5.25 -1.26 -5.14 121.20 117.60 1b8t s ILE 189 Ca -0.05 -1.33 0.07 0.00 -0.99 0.00 0.00 60.65 58.35 1b8t s ILE 189 Cb -0.03 -1.49 -0.04 0.00 2.95 0.00 0.00 42.46 43.85 1b8t s ILE 189 CO 0.01 0.11 -0.14 -1.38 -1.79 0.00 0.00 174.94 171.75 1b8t s HIS 190 N -0.94 2.67 -0.37 1.37 -3.43 -1.26 -5.09 115.29 108.25 1b8t s HIS 190 Ca 0.07 -0.19 0.03 0.00 -0.80 0.00 0.00 55.06 54.18 1b8t s HIS 190 Cb -0.09 -1.46 0.19 0.00 -1.43 0.00 0.00 32.58 29.78 1b8t s HIS 190 CO 0.03 0.35 0.72 0.45 -2.00 0.00 0.00 174.74 174.29 1b8t s SER 191 N -1.77 -1.28 0.00 7.38 0.15 -1.26 -5.38 113.70 111.54 1b8t s SER 191 Ca 0.18 -0.45 0.00 0.00 0.70 0.00 0.00 55.95 56.37 1b8t s SER 191 Cb -0.11 1.66 0.00 0.00 -1.71 0.00 0.00 66.02 65.87 1b8t s SER 191 CO 0.09 -0.16 0.46 1.67 1.20 0.00 0.00 173.24 176.50