#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 -0.41 0.00 2.12 0.04 -1.26 -5.10 135.00 130.40 1b8t s PRO 2 Ca 0.00 -0.30 0.00 0.00 0.04 0.00 0.00 61.00 60.74 1b8t s PRO 2 Cb 0.00 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.83 1b8t s PRO 2 CO 0.00 -3.13 0.00 -1.71 0.04 0.00 0.00 177.00 172.20 1b8t n ASN 3 N -4.30 0.00 -3.63 6.66 5.15 -1.26 -5.19 115.26 112.70 1b8t n ASN 3 Ca 0.15 0.00 -0.01 0.00 -0.60 0.00 0.00 54.58 54.12 1b8t n ASN 3 Cb 0.59 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.83 1b8t n ASN 3 CO 0.00 0.00 0.00 0.86 1.40 0.00 0.00 177.26 179.52 1b8t s TRP 4 N -0.10 -0.00 0.00 1.20 -0.00 -1.26 -5.19 118.94 113.59 1b8t s TRP 4 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.10 56.10 1b8t s TRP 4 Cb 0.00 0.50 0.00 0.00 -0.00 0.00 0.00 33.47 33.97 1b8t s TRP 4 CO 0.00 -0.01 0.00 0.41 -0.00 0.00 0.00 176.95 177.35 1b8t n GLY 5 N -0.11 4.04 0.00 5.86 0.00 -1.26 -5.20 105.19 108.52 1b8t n GLY 5 Ca 0.02 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.08 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 -1.49 2.35 0.00 -0.02 0.00 -1.26 -5.19 105.19 99.58 1b8t n GLY 6 Ca 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.96 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 -1.02 3.77 3.86 -0.02 0.00 -1.26 -4.99 105.19 105.53 1b8t n GLY 7 Ca 0.00 -1.16 -0.26 0.00 0.00 0.00 0.00 46.02 44.60 1b8t n GLY 7 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1b8t n LYS 8 N -1.47 0.66 -3.89 1.61 3.00 -0.35 -4.94 118.16 112.78 1b8t n LYS 8 Ca 0.00 -3.48 -0.23 0.00 -0.00 0.00 0.00 58.31 54.60 1b8t n LYS 8 Cb 0.00 0.35 -0.17 0.00 0.00 0.00 0.00 35.03 35.21 1b8t n LYS 8 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1b8t s LYS 9 N -4.30 0.89 -0.53 1.64 1.02 -1.26 -0.41 119.74 116.79 1b8t s LYS 9 Ca 0.32 -0.03 -0.27 0.00 0.02 0.00 0.00 55.97 56.02 1b8t s LYS 9 Cb -0.03 -1.10 0.03 0.00 -0.52 0.00 0.00 37.83 36.21 1b8t s LYS 9 CO 0.21 -0.25 1.09 0.00 -0.92 0.00 0.00 175.35 175.48 1b8t n GLY 11 N 5.00 -0.95 0.02 0.00 0.00 -1.24 -0.07 105.19 107.94 1b8t n GLY 11 Ca 0.08 -0.10 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.77 0.33 0.17 1.61 0.31 -1.26 -4.56 118.33 114.16 1b8t n VAL 12 Ca 0.12 0.43 0.06 0.00 -0.01 0.00 0.00 64.34 64.94 1b8t n VAL 12 Cb 0.06 -1.70 0.10 0.00 -0.91 0.00 0.00 33.84 31.39 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 -3.19 0.00 -4.74 0.00 0.00 0.89 -5.06 117.38 105.28 1b8t n GLN 14 Ca 0.03 0.11 -0.30 0.00 -0.00 0.00 0.00 57.00 56.84 1b8t n GLN 14 Cb 0.65 -3.04 -0.14 0.00 0.00 0.00 0.00 30.24 27.71 1b8t n GLN 14 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 1b8t s LYS 15 N -3.04 1.69 0.71 3.69 1.02 -1.06 -4.88 119.74 117.88 1b8t s LYS 15 Ca 0.00 -1.18 -0.16 0.00 0.02 0.00 0.00 55.97 54.65 1b8t s LYS 15 Cb 0.00 -1.96 0.03 0.00 -0.52 0.00 0.00 37.83 35.37 1b8t s LYS 15 CO 0.00 0.49 1.23 0.00 -0.92 0.00 0.00 175.35 176.16 1b8t s ALA 16 N -0.89 2.16 0.22 5.17 0.00 -1.26 -0.21 121.76 126.96 1b8t s ALA 16 Ca 0.13 0.98 0.12 0.00 0.00 0.00 0.00 51.96 53.18 1b8t s ALA 16 Cb -0.10 -3.50 -0.05 0.00 0.00 0.00 0.00 23.12 19.47 1b8t s ALA 16 CO 0.03 -1.85 -0.22 0.08 0.00 0.00 0.00 175.76 173.81 1b8t s VAL 17 N -1.82 2.42 -0.18 0.00 1.01 0.45 -4.70 120.40 117.58 1b8t s VAL 17 Ca 0.77 -2.16 0.01 0.00 0.00 0.00 0.00 61.98 60.60 1b8t s VAL 17 Cb -0.32 -2.20 0.03 0.00 0.00 0.00 0.00 36.38 33.89 1b8t s VAL 17 CO 0.44 -0.22 -0.17 -0.31 0.00 0.00 0.00 175.10 174.84 1b8t s TYR 18 N -1.97 2.63 -0.68 5.22 1.51 -1.26 -1.21 117.35 121.58 1b8t s TYR 18 Ca 0.24 -1.59 -0.32 0.00 -1.01 0.00 0.00 57.07 54.39 1b8t s TYR 18 Cb -0.07 -1.81 -0.18 0.00 -0.11 0.00 0.00 41.96 39.79 1b8t s TYR 18 CO 0.12 -0.77 2.16 1.97 -1.11 0.00 0.00 175.55 177.91 1b8t n PHE 19 N 4.65 0.73 0.00 2.71 -1.74 -1.26 -3.64 117.46 118.91 1b8t n PHE 19 Ca -0.19 0.49 0.00 0.00 -0.56 0.00 0.00 57.45 57.19 1b8t n PHE 19 Cb 0.49 -2.06 0.00 0.00 1.52 0.00 0.00 39.48 39.43 1b8t n PHE 19 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1b8t n ALA 20 N 8.07 0.00 0.27 1.98 0.00 -1.26 -4.93 120.51 124.64 1b8t n ALA 20 Ca 0.54 0.00 0.05 0.00 0.00 0.00 0.00 53.44 54.02 1b8t n ALA 20 Cb -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1b8t n ALA 20 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1b8t n GLU 21 N 0.00 2.53 -1.39 0.00 0.28 -1.24 -5.03 120.64 115.80 1b8t n GLU 21 Ca 0.00 -0.03 -0.52 0.00 -0.16 0.00 0.00 57.16 56.44 1b8t n GLU 21 Cb 0.00 -1.05 -0.06 0.00 1.43 0.00 0.00 31.44 31.76 1b8t n GLU 21 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 1b8t n GLU 22 N -1.45 0.00 -4.00 3.44 0.28 -1.26 -3.59 120.64 114.06 1b8t n GLU 22 Ca 0.00 0.00 -0.34 0.00 -0.16 0.00 0.00 57.16 56.66 1b8t n GLU 22 Cb 0.19 -1.26 -0.15 0.00 1.43 0.00 0.00 31.44 31.64 1b8t n GLU 22 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1b8t s VAL 23 N -0.32 2.71 0.52 3.84 1.01 0.41 -4.86 120.40 123.71 1b8t s VAL 23 Ca 0.78 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 61.81 1b8t s VAL 23 Cb -1.10 -2.30 0.01 0.00 0.00 0.00 0.00 36.38 32.99 1b8t s VAL 23 CO 0.54 0.32 0.77 -1.58 0.00 0.00 0.00 175.10 175.15 1b8t s GLN 24 N 1.33 2.90 -0.06 2.72 2.00 -1.26 0.03 119.66 127.33 1b8t s GLN 24 Ca 0.02 -0.38 -0.12 0.00 -2.00 0.00 0.00 55.36 52.88 1b8t s GLN 24 Cb -0.15 -2.44 0.02 0.00 0.80 0.00 0.00 33.01 31.24 1b8t s GLN 24 CO -0.07 -0.51 0.30 0.00 -0.50 0.00 0.00 175.29 174.51 1b8t n GLU 26 N 2.03 -0.17 -2.51 0.00 1.02 -1.26 -1.31 120.64 118.45 1b8t n GLU 26 Ca -0.18 1.36 -0.20 0.00 -0.02 0.00 0.00 57.16 58.12 1b8t n GLU 26 Cb 0.57 -2.02 0.01 0.00 -0.02 0.00 0.00 31.44 29.98 1b8t n GLU 26 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1b8t n GLY 27 N -1.46 4.52 0.00 0.62 0.00 -1.26 -5.06 105.19 102.55 1b8t n GLY 27 Ca 0.11 -2.25 0.00 0.00 0.00 0.00 0.00 46.02 43.88 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 -0.38 0.00 0.00 1.61 7.64 -0.42 -5.11 113.62 116.96 1b8t n SER 28 Ca 0.29 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.17 1b8t n SER 28 Cb 0.74 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.94 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 0.53 0.00 -4.14 6.43 3.41 -1.26 0.26 113.62 118.85 1b8t n SER 29 Ca 0.00 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.44 1b8t n SER 29 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 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 0.00 1.55 1.35 7.33 0.08 0.11 -3.69 117.98 124.70 1b8t s PHE 30 Ca 0.00 -1.29 -0.20 0.00 0.12 0.00 0.00 56.93 55.56 1b8t s PHE 30 Cb 0.00 -0.86 0.34 0.00 -0.57 0.00 0.00 43.02 41.93 1b8t s PHE 30 CO 0.00 -0.45 0.87 0.72 -0.10 0.00 0.00 175.22 176.26 1b8t n HIS 31 N -0.52 -2.78 0.10 0.36 8.25 -1.26 -0.45 115.22 118.92 1b8t n HIS 31 Ca 0.01 -0.52 -0.11 0.00 -0.26 0.00 0.00 57.72 56.84 1b8t n HIS 31 Cb 0.66 -1.48 -0.07 0.00 1.12 0.00 0.00 29.99 30.22 1b8t n HIS 31 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 1b8t h LYS 32 N -3.24 -0.30 -0.43 -0.41 3.64 -1.89 -2.30 116.57 111.64 1b8t h LYS 32 Ca -0.49 0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 58.83 1b8t h LYS 32 Cb 1.32 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 33.19 1b8t h LYS 32 CO 0.34 0.06 -0.09 0.77 -2.27 0.00 0.00 179.45 178.26 1b8t h SER 33 N -0.90 0.73 -0.99 4.20 0.02 -1.92 -2.35 113.55 112.34 1b8t h SER 33 Ca -0.03 -0.21 0.08 0.00 -0.84 0.00 0.00 61.79 60.79 1b8t h SER 33 Cb 0.50 -0.20 -0.07 0.00 0.14 0.00 0.00 62.40 62.77 1b8t h SER 33 CO 0.05 0.86 0.64 0.00 -1.14 0.00 0.00 176.83 177.24 1b8t n PHE 35 N -4.53 2.00 -3.91 0.00 -0.00 -0.86 -4.82 117.46 105.33 1b8t n PHE 35 Ca 0.16 -1.11 -0.15 0.00 -0.00 0.00 0.00 57.45 56.35 1b8t n PHE 35 Cb 0.23 -2.40 -0.15 0.00 -0.00 0.00 0.00 39.48 37.16 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 10.89 1.53 -0.40 -2.13 0.20 -1.25 -1.56 118.68 125.97 1b8t s LEU 36 Ca 0.71 -0.02 -0.42 0.00 0.69 0.00 0.00 54.13 55.10 1b8t s LEU 36 Cb 0.01 -0.13 -0.17 0.00 -0.43 0.00 0.00 46.19 45.47 1b8t s LEU 36 CO 0.16 -0.05 1.90 0.00 -0.29 0.00 0.00 176.35 178.07 1b8t n MET 38 N 6.18 0.94 0.00 0.00 1.56 -0.44 -0.40 117.12 124.97 1b8t n MET 38 Ca 0.37 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.80 1b8t n MET 38 Cb 0.07 -1.16 0.00 0.00 2.15 0.00 0.00 33.22 34.28 1b8t n MET 38 CO 0.00 0.00 0.00 0.28 -0.73 0.00 0.00 175.97 175.52 1b8t n VAL 39 N -0.33 0.00 0.19 1.12 0.31 -1.26 -4.72 118.33 113.64 1b8t n VAL 39 Ca 0.00 0.23 0.07 0.00 -0.01 0.00 0.00 64.34 64.64 1b8t n VAL 39 Cb 0.08 -1.23 0.22 0.00 -0.91 0.00 0.00 33.84 32.00 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 -3.25 0.00 -3.87 0.00 4.81 0.46 -5.03 118.16 111.27 1b8t n LYS 41 Ca 0.02 0.26 -0.35 0.00 -0.87 0.00 0.00 58.31 57.36 1b8t n LYS 41 Cb 0.58 -3.51 -0.10 0.00 0.02 0.00 0.00 35.03 32.02 1b8t n LYS 41 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1b8t s LYS 42 N -2.71 3.91 0.44 1.64 2.36 -1.20 -4.81 119.74 119.38 1b8t s LYS 42 Ca 0.00 -0.36 -0.22 0.00 -2.55 0.00 0.00 55.97 52.84 1b8t s LYS 42 Cb 0.00 -3.32 -0.12 0.00 -1.05 0.00 0.00 37.83 33.35 1b8t s LYS 42 CO 0.00 0.11 0.60 0.09 1.55 0.00 0.00 175.35 177.69 1b8t n ASN 43 N 4.07 -0.66 -4.42 1.43 3.02 -1.26 -0.58 115.26 116.86 1b8t n ASN 43 Ca -0.16 0.90 -0.25 0.00 -0.03 0.00 0.00 54.58 55.03 1b8t n ASN 43 Cb 0.52 -1.15 -0.11 0.00 -0.61 0.00 0.00 39.78 38.43 1b8t n ASN 43 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1b8t s LEU 44 N 1.33 2.46 0.31 3.41 1.43 -0.60 -4.65 118.68 122.38 1b8t s LEU 44 Ca 0.64 -0.90 -0.04 0.00 -1.03 0.00 0.00 54.13 52.80 1b8t s LEU 44 Cb -0.57 -1.10 -0.00 0.00 0.03 0.00 0.00 46.19 44.55 1b8t s LEU 44 CO 0.57 0.08 0.44 -0.62 0.23 0.00 0.00 176.35 177.05 1b8t s ASP 45 N -2.82 0.66 -0.64 2.29 -1.08 -1.26 -4.74 116.67 109.08 1b8t s ASP 45 Ca 0.21 -1.37 -0.26 0.00 -0.52 0.00 0.00 52.55 50.61 1b8t s ASP 45 Cb -0.07 0.62 -0.07 0.00 -1.46 0.00 0.00 42.92 41.94 1b8t s ASP 45 CO 0.10 -1.22 2.21 -0.94 0.52 0.00 0.00 175.17 175.84 1b8t s SER 46 N -3.19 4.61 0.01 -0.34 1.04 -1.26 -3.89 113.70 110.69 1b8t s SER 46 Ca 0.30 0.44 0.00 0.00 0.48 0.00 0.00 55.95 57.17 1b8t s SER 46 Cb 0.00 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.60 1b8t s SER 46 CO 0.17 -2.96 0.00 1.07 0.98 0.00 0.00 173.24 172.50 1b8t n THR 47 N 7.96 0.00 -2.56 2.02 5.66 -1.26 -5.01 114.28 121.09 1b8t n THR 47 Ca 0.35 0.00 -0.01 0.00 -3.05 0.00 0.00 64.05 61.34 1b8t n THR 47 Cb 0.51 0.00 0.06 0.00 -1.55 0.00 0.00 70.33 69.35 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 -2.44 0.00 -3.12 1.09 5.66 -1.25 -5.13 114.28 109.09 1b8t n THR 48 Ca 0.00 -0.48 -0.35 0.00 -3.05 0.00 0.00 64.05 60.17 1b8t n THR 48 Cb 0.00 0.73 -0.06 0.00 -1.55 0.00 0.00 70.33 69.45 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 0.06 4.62 0.26 1.08 0.11 -1.26 -1.16 120.40 124.12 1b8t s VAL 49 Ca 0.04 1.13 0.06 0.00 -2.93 0.00 0.00 61.98 60.28 1b8t s VAL 49 Cb 0.22 -3.75 -0.06 0.00 -1.53 0.00 0.00 36.38 31.26 1b8t s VAL 49 CO -0.06 0.04 -0.04 0.00 -3.33 0.00 0.00 175.10 171.71 1b8t s ALA 50 N -1.71 2.18 0.10 1.54 0.00 0.11 -4.83 121.76 119.15 1b8t s ALA 50 Ca 0.48 -1.86 0.10 0.00 0.00 0.00 0.00 51.96 50.68 1b8t s ALA 50 Cb -0.14 0.27 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 1b8t s ALA 50 CO 0.19 -0.12 -0.26 0.08 0.00 0.00 0.00 175.76 175.65 1b8t s VAL 51 N -3.13 2.17 -0.16 0.00 1.01 -1.26 -0.93 120.40 118.09 1b8t s VAL 51 Ca 0.29 -1.61 -0.12 0.00 0.00 0.00 0.00 61.98 60.54 1b8t s VAL 51 Cb 0.04 -1.90 0.05 0.00 0.00 0.00 0.00 36.38 34.57 1b8t s VAL 51 CO 0.11 0.17 0.41 -2.28 0.00 0.00 0.00 175.10 173.51 1b8t s HIS 52 N -0.98 -0.53 0.00 5.22 5.65 -0.49 -4.92 115.29 119.25 1b8t s HIS 52 Ca 0.13 1.19 0.00 0.00 0.25 0.00 0.00 55.06 56.63 1b8t s HIS 52 Cb -0.10 0.21 0.00 0.00 -1.18 0.00 0.00 32.58 31.51 1b8t s HIS 52 CO 0.05 -0.28 0.00 0.41 -0.65 0.00 0.00 174.74 174.26 1b8t n GLY 53 N 3.58 1.17 2.56 1.59 0.00 -1.26 -0.27 105.19 112.57 1b8t n GLY 53 Ca -0.18 0.69 -0.19 0.00 0.00 0.00 0.00 46.02 46.34 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 4.73 2.79 -3.72 1.61 8.00 -1.26 -5.06 116.55 123.64 1b8t n ASP 54 Ca 0.00 -3.23 -0.04 0.00 0.71 0.00 0.00 54.79 52.23 1b8t n ASP 54 Cb 0.00 -0.53 -0.01 0.00 -0.02 0.00 0.00 41.12 40.55 1b8t n ASP 54 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1b8t s GLU 55 N -3.16 1.09 0.08 -1.24 2.02 0.63 -5.10 118.70 113.02 1b8t s GLU 55 Ca 0.40 -0.59 0.04 0.00 0.02 0.00 0.00 54.97 54.84 1b8t s GLU 55 Cb 0.39 0.38 -0.04 0.00 0.10 0.00 0.00 34.13 34.96 1b8t s GLU 55 CO -0.08 -0.50 0.02 0.96 0.02 0.00 0.00 175.26 175.68 1b8t s ILE 56 N -3.20 4.18 -0.10 -1.63 -4.36 -1.26 -1.40 121.20 113.43 1b8t s ILE 56 Ca 0.12 -0.88 -0.07 0.00 -0.26 0.00 0.00 60.65 59.55 1b8t s ILE 56 Cb -0.01 -2.98 0.03 0.00 1.25 0.00 0.00 42.46 40.75 1b8t s ILE 56 CO 0.01 0.15 0.25 -0.31 0.24 0.00 0.00 174.94 175.28 1b8t s TYR 57 N -1.31 -0.30 0.19 1.37 1.51 -0.11 -1.33 117.35 117.38 1b8t s TYR 57 Ca 0.26 0.73 -0.30 0.00 -1.01 0.00 0.00 57.07 56.75 1b8t s TYR 57 Cb -0.12 0.08 -0.08 0.00 -0.11 0.00 0.00 41.96 41.73 1b8t s TYR 57 CO 0.18 -0.17 1.15 0.00 -1.11 0.00 0.00 175.55 175.60 1b8t n LYS 59 N 2.32 -0.28 -0.26 0.00 5.02 -0.31 0.11 118.16 124.77 1b8t n LYS 59 Ca 0.03 1.19 0.04 0.00 -2.02 0.00 0.00 58.31 57.55 1b8t n LYS 59 Cb 0.45 -1.76 0.09 0.00 -0.02 0.00 0.00 35.03 33.79 1b8t n LYS 59 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1b8t n SER 60 N -4.50 -0.28 0.41 4.39 2.88 -1.26 0.15 113.62 115.41 1b8t n SER 60 Ca 0.01 1.22 -0.18 0.00 -1.33 0.00 0.00 58.87 58.59 1b8t n SER 60 Cb 0.17 -0.36 -0.09 0.00 -0.75 0.00 0.00 64.21 63.18 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 -1.11 -0.77 0.00 0.00 3.20 0.29 1.69 116.97 120.27 1b8t h TYR 62 Ca -0.11 0.09 -0.05 0.00 3.14 0.00 0.00 58.73 61.80 1b8t h TYR 62 Cb 0.81 0.48 -0.01 0.00 1.54 0.00 0.00 36.73 39.54 1b8t h TYR 62 CO -0.01 -0.40 -0.26 0.78 -1.64 0.00 0.00 178.16 176.64 1b8t h GLY 63 N -0.02 0.00 0.54 1.82 0.00 -0.29 0.05 103.07 105.16 1b8t h GLY 63 Ca 0.38 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.69 1b8t h GLY 63 CO -0.93 0.00 -0.21 0.50 0.00 0.00 0.00 176.54 175.91 1b8t h LYS 64 N 0.00 -0.56 -0.32 4.80 1.57 0.60 0.43 116.57 123.09 1b8t h LYS 64 Ca -0.00 0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1b8t h LYS 64 Cb 0.69 0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.11 1b8t h LYS 64 CO 0.03 -0.27 0.19 1.57 -0.57 0.00 0.00 179.45 180.40 1b8t h LYS 65 N -1.04 0.44 -0.86 3.15 2.10 -0.21 -2.44 116.57 117.71 1b8t h LYS 65 Ca -0.06 -0.05 -0.01 0.00 -2.00 0.00 0.00 60.65 58.54 1b8t h LYS 65 Cb 0.54 -0.09 -0.04 0.00 -0.90 0.00 0.00 32.23 31.74 1b8t h LYS 65 CO 0.10 0.35 0.49 1.88 -2.00 0.00 0.00 179.45 180.27 1b8t h TYR 66 N 0.41 1.15 0.00 0.07 -1.99 -1.04 -3.42 116.97 112.15 1b8t h TYR 66 Ca 0.12 -0.01 -0.42 0.00 2.00 0.00 0.00 58.73 60.41 1b8t h TYR 66 Cb 0.03 -0.37 -0.08 0.00 2.00 0.00 0.00 36.73 38.30 1b8t h TYR 66 CO -0.04 0.78 1.59 0.41 -0.00 0.00 0.00 178.16 180.90 1b8t n GLY 67 N -1.21 -0.43 3.74 3.88 0.00 0.15 -4.85 105.19 106.46 1b8t n GLY 67 Ca 0.09 0.86 -0.30 0.00 0.00 0.00 0.00 46.02 46.67 1b8t n GLY 67 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1b8t n PRO 68 N 7.06 -2.23 -3.59 1.61 -0.04 -1.26 -5.00 135.00 131.55 1b8t n PRO 68 Ca 0.58 -1.94 -0.05 0.00 -0.04 0.00 0.00 63.50 62.06 1b8t n PRO 68 Cb 0.04 -1.52 -0.03 0.00 -0.04 0.00 0.00 33.50 31.95 1b8t n PRO 68 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1b8t s LYS 69 N -5.74 0.33 0.08 0.54 -2.85 -1.26 -5.19 119.74 105.65 1b8t s LYS 69 Ca 0.74 -0.08 -0.16 0.00 -1.00 0.00 0.00 55.97 55.48 1b8t s LYS 69 Cb -0.04 0.15 0.05 0.00 -2.06 0.00 0.00 37.83 35.93 1b8t s LYS 69 CO 0.54 -0.14 0.73 0.41 0.10 0.00 0.00 175.35 177.00 1b8t n GLY 70 N 0.06 0.69 3.65 0.59 0.00 -1.26 -5.19 105.19 103.74 1b8t n GLY 70 Ca -0.01 -1.04 0.01 0.00 0.00 0.00 0.00 46.02 44.97 1b8t n GLY 70 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1b8t s LYS 71 N -2.03 0.52 0.33 1.61 2.20 -1.26 -5.19 119.74 115.92 1b8t s LYS 71 Ca 0.17 -0.29 -0.17 0.00 -0.36 0.00 0.00 55.97 55.31 1b8t s LYS 71 Cb -0.01 0.17 0.06 0.00 -1.51 0.00 0.00 37.83 36.54 1b8t s LYS 71 CO 0.02 -0.24 0.87 0.20 -0.36 0.00 0.00 175.35 175.85 1b8t s GLY 72 N -3.01 0.31 -0.04 5.54 0.00 -1.26 -5.19 107.32 103.67 1b8t s GLY 72 Ca 0.15 -0.64 -0.30 0.00 0.00 0.00 0.00 44.72 43.92 1b8t s GLY 72 CO -0.03 0.57 1.32 1.25 0.00 0.00 0.00 173.10 176.22 1b8t s LYS 73 N -2.20 0.30 -0.07 2.90 2.47 -1.26 -5.19 119.74 116.69 1b8t s LYS 73 Ca 0.18 -0.18 -0.31 0.00 -1.56 0.00 0.00 55.97 54.10 1b8t s LYS 73 Cb -0.04 0.09 0.12 0.00 -1.46 0.00 0.00 37.83 36.54 1b8t s LYS 73 CO 0.10 -0.14 1.37 0.20 0.16 0.00 0.00 175.35 177.03 1b8t s GLY 74 N -3.27 -0.32 -0.11 5.54 0.00 -1.26 -5.19 107.32 102.71 1b8t s GLY 74 Ca 0.20 0.46 -0.33 0.00 0.00 0.00 0.00 44.72 45.04 1b8t s GLY 74 CO -0.04 3.63 1.42 -3.16 0.00 0.00 0.00 173.10 174.96 1b8t s MET 75 N -2.07 0.05 0.00 2.90 0.23 -1.26 -5.19 119.30 113.96 1b8t s MET 75 Ca 0.24 -0.03 0.00 0.00 -1.03 0.00 0.00 55.69 54.87 1b8t s MET 75 Cb 0.03 0.02 0.00 0.00 -1.53 0.00 0.00 34.83 33.35 1b8t s MET 75 CO -0.04 -0.02 0.00 0.41 -2.03 0.00 0.00 175.02 173.34 1b8t n GLY 76 N -0.45 0.83 3.83 3.16 0.00 -1.26 -5.19 105.19 106.11 1b8t n GLY 76 Ca -0.08 -0.91 0.02 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.00 -2.40 0.00 4.61 0.00 -1.26 -5.19 121.76 115.52 1b8t s ALA 77 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.30 1b8t s ALA 77 Cb 0.00 0.65 0.00 0.00 0.00 0.00 0.00 23.12 23.77 1b8t s ALA 77 CO 0.00 -1.11 0.00 0.41 0.00 0.00 0.00 175.76 175.06 1b8t n GLY 78 N -0.73 1.44 3.61 0.00 0.00 -1.26 -5.19 105.19 103.05 1b8t n GLY 78 Ca -0.02 -0.83 -0.04 0.00 0.00 0.00 0.00 46.02 45.13 1b8t n GLY 78 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1b8t s THR 79 N -2.00 0.00 -0.02 2.61 -1.32 -1.26 -5.19 115.64 108.46 1b8t s THR 79 Ca 0.00 -0.16 -0.30 0.00 -1.21 0.00 0.00 61.69 60.02 1b8t s THR 79 Cb 0.00 -1.41 0.11 0.00 -1.51 0.00 0.00 72.50 69.70 1b8t s THR 79 CO 0.00 0.00 1.21 -1.48 -2.21 0.00 0.00 174.62 172.14 1b8t s LEU 80 N -2.57 -0.10 0.00 9.08 2.34 -1.26 -5.19 118.68 120.98 1b8t s LEU 80 Ca 0.10 -0.15 0.00 0.00 0.06 0.00 0.00 54.13 54.14 1b8t s LEU 80 Cb 0.00 1.52 0.00 0.00 -0.56 0.00 0.00 46.19 47.16 1b8t s LEU 80 CO -0.04 -0.39 0.00 -1.54 -1.06 0.00 0.00 176.35 173.32 1b8t n SER 81 N -0.41 0.00 -3.62 1.48 3.41 -1.26 -5.19 113.62 108.03 1b8t n SER 81 Ca -0.07 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.51 1b8t n SER 81 Cb 0.62 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.55 1b8t n SER 81 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1b8t s THR 82 N -2.00 0.00 0.00 6.66 -1.32 -1.26 -5.19 115.64 112.53 1b8t s THR 82 Ca 0.00 -0.20 0.00 0.00 -1.21 0.00 0.00 61.69 60.28 1b8t s THR 82 Cb 0.00 -1.50 0.00 0.00 -1.51 0.00 0.00 72.50 69.49 1b8t s THR 82 CO 0.00 0.00 0.00 -0.90 -2.21 0.00 0.00 174.62 171.51 1b8t n ASP 83 N -0.32 0.00 -3.76 8.08 5.68 -1.26 -5.19 116.55 119.78 1b8t n ASP 83 Ca -0.05 0.00 0.03 0.00 -0.50 0.00 0.00 54.79 54.26 1b8t n ASP 83 Cb 0.61 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.60 1b8t n ASP 83 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1b8t s LYS 84 N -2.00 0.35 0.00 0.11 1.02 -1.26 -5.19 119.74 112.77 1b8t s LYS 84 Ca 0.00 -0.22 0.00 0.00 0.02 0.00 0.00 55.97 55.77 1b8t s LYS 84 Cb 0.00 0.10 0.00 0.00 -0.52 0.00 0.00 37.83 37.41 1b8t s LYS 84 CO 0.00 -0.16 0.00 0.41 -0.92 0.00 0.00 175.35 174.68 1b8t n GLY 85 N -0.78 0.71 0.00 -3.33 0.00 -1.26 -5.19 105.19 95.34 1b8t n GLY 85 Ca -0.00 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.05 1b8t n GLY 85 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b8t n GLU 86 N -0.40 -0.29 0.00 1.61 1.02 -1.26 -5.19 120.64 116.13 1b8t n GLU 86 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1b8t n GLU 86 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1b8t n GLU 86 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1b8t n SER 87 N 0.00 0.00 -3.77 1.62 7.64 -1.26 -5.19 113.62 112.66 1b8t n SER 87 Ca 0.00 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.91 1b8t n SER 87 Cb 0.00 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.21 1b8t n SER 87 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1b8t s LEU 88 N 0.00 -0.01 0.00 -3.43 2.96 -1.26 -5.19 118.68 111.75 1b8t s LEU 88 Ca 0.00 -0.15 0.00 0.00 -0.22 0.00 0.00 54.13 53.76 1b8t s LEU 88 Cb 0.00 1.28 0.00 0.00 0.50 0.00 0.00 46.19 47.97 1b8t s LEU 88 CO 0.00 -0.24 0.00 0.61 -1.32 0.00 0.00 176.35 175.40 1b8t n GLY 89 N -0.78 2.12 3.66 7.98 0.00 -1.26 -5.19 105.19 111.72 1b8t n GLY 89 Ca -0.00 -0.80 -0.00 0.00 0.00 0.00 0.00 46.02 45.21 1b8t n GLY 89 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1b8t s ILE 90 N -2.00 0.00 -0.05 -0.61 2.07 -1.26 -5.19 121.20 114.16 1b8t s ILE 90 Ca 0.00 -0.36 -0.31 0.00 -1.41 0.00 0.00 60.65 58.56 1b8t s ILE 90 Cb 0.00 -1.95 0.12 0.00 0.13 0.00 0.00 42.46 40.76 1b8t s ILE 90 CO 0.00 0.00 1.27 -1.59 -1.91 0.00 0.00 174.94 172.71 1b8t s LYS 91 N -2.73 0.38 -0.01 3.50 -2.85 -1.26 -5.19 119.74 111.58 1b8t s LYS 91 Ca 0.13 -0.20 -0.30 0.00 -1.00 0.00 0.00 55.97 54.60 1b8t s LYS 91 Cb 0.02 0.14 0.11 0.00 -2.06 0.00 0.00 37.83 36.04 1b8t s LYS 91 CO -0.02 -0.17 1.17 -0.47 0.10 0.00 0.00 175.35 175.96 1b8t s TYR 92 N -2.42 -0.10 -0.12 1.78 5.04 -1.26 -5.19 117.35 115.08 1b8t s TYR 92 Ca 0.13 -0.04 -0.33 0.00 -2.44 0.00 0.00 57.07 54.39 1b8t s TYR 92 Cb 0.04 0.56 0.14 0.00 0.35 0.00 0.00 41.96 43.05 1b8t s TYR 92 CO -0.04 -0.40 1.38 -1.83 -1.34 0.00 0.00 175.55 173.32 1b8t s GLU 93 N -2.66 0.13 0.00 4.97 -1.05 -1.26 -5.19 118.70 113.63 1b8t s GLU 93 Ca 0.12 -0.07 0.00 0.00 -0.15 0.00 0.00 54.97 54.87 1b8t s GLU 93 Cb 0.02 0.05 0.00 0.00 -0.44 0.00 0.00 34.13 33.76 1b8t s GLU 93 CO -0.03 -0.06 0.00 0.39 0.95 0.00 0.00 175.26 176.51 1b8t n GLU 94 N -0.38 -0.10 0.00 -4.83 1.02 -1.26 -5.19 120.64 109.89 1b8t n GLU 94 Ca -0.06 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 1b8t n GLU 94 Cb 0.62 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.04 1b8t n GLU 94 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1b8t n GLY 95 N -0.02 2.87 3.59 0.62 0.00 -1.26 -5.19 105.19 105.80 1b8t n GLY 95 Ca 0.00 -0.72 0.01 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.00 0.12 0.00 1.61 0.00 -1.26 -5.19 119.66 112.94 1b8t s GLN 96 Ca 0.00 -0.06 0.00 0.00 -0.00 0.00 0.00 55.36 55.30 1b8t s GLN 96 Cb 0.00 0.05 0.00 0.00 0.00 0.00 0.00 33.01 33.06 1b8t s GLN 96 CO 0.00 -0.06 0.00 0.43 0.00 0.00 0.00 175.29 175.66 1b8t n SER 97 N -0.33 0.00 -3.58 12.60 7.64 -1.26 -5.19 113.62 123.49 1b8t n SER 97 Ca -0.05 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.86 1b8t n SER 97 Cb 0.61 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.81 1b8t n SER 97 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 1b8t s HIS 98 N -2.00 -0.02 0.00 1.43 2.46 -1.26 -5.14 115.29 110.76 1b8t s HIS 98 Ca 0.00 -0.02 0.00 0.00 0.47 0.00 0.00 55.06 55.51 1b8t s HIS 98 Cb 0.00 0.52 0.00 0.00 -0.13 0.00 0.00 32.58 32.97 1b8t s HIS 98 CO 0.00 -0.11 0.00 -2.13 -2.47 0.00 0.00 174.74 170.03 1b8t n ARG 99 N -0.50 0.00 -1.53 2.88 0.63 -1.26 -5.18 116.66 111.71 1b8t n ARG 99 Ca -0.09 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.55 1b8t n ARG 99 Cb 0.63 0.00 0.17 0.00 0.45 0.00 0.00 32.46 33.71 1b8t n ARG 99 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1b8t s PRO 100 N 0.00 0.52 0.39 -0.14 0.04 -1.26 -5.10 135.00 129.45 1b8t s PRO 100 Ca 0.00 0.06 0.04 0.00 0.04 0.00 0.00 61.00 61.14 1b8t s PRO 100 Cb 0.00 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 32.73 1b8t s PRO 100 CO 0.00 -2.57 0.16 0.95 0.04 0.00 0.00 177.00 175.57 1b8t s THR 101 N -3.35 0.48 0.00 1.26 -4.23 -1.26 -5.14 115.64 103.40 1b8t s THR 101 Ca 0.68 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.19 1b8t s THR 101 Cb -0.11 -2.39 0.00 0.00 1.34 0.00 0.00 72.50 71.34 1b8t s THR 101 CO 0.54 0.00 0.00 0.59 -0.54 0.00 0.00 174.62 175.21 1b8t n ASN 102 N -1.31 0.00 -3.88 3.99 4.13 -1.26 -5.18 115.26 111.76 1b8t n ASN 102 Ca -0.03 0.00 -0.30 0.00 1.68 0.00 0.00 54.58 55.93 1b8t n ASN 102 Cb 0.65 0.00 0.22 0.00 -1.54 0.00 0.00 39.78 39.11 1b8t n ASN 102 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1b8t s PRO 103 N 0.00 -0.45 0.00 3.52 0.04 -1.26 -5.10 135.00 131.75 1b8t s PRO 103 Ca 0.00 -0.31 0.00 0.00 0.04 0.00 0.00 61.00 60.73 1b8t s PRO 103 Cb 0.00 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.83 1b8t s PRO 103 CO 0.00 -3.16 0.00 0.27 0.04 0.00 0.00 177.00 174.15 1b8t n ASN 104 N -4.32 0.00 -3.61 6.66 0.23 -1.26 -5.19 115.26 107.78 1b8t n ASN 104 Ca 0.15 0.00 -0.02 0.00 -0.53 0.00 0.00 54.58 54.19 1b8t n ASN 104 Cb 0.59 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 38.28 1b8t n ASN 104 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1b8t s ALA 105 N -2.00 -2.18 0.00 -2.53 0.00 -1.26 -5.19 121.76 108.60 1b8t s ALA 105 Ca 0.00 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.25 1b8t s ALA 105 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.15 1b8t s ALA 105 CO 0.00 -0.78 0.00 -1.13 0.00 0.00 0.00 175.76 173.85 1b8t n SER 106 N -0.24 0.00 -3.64 0.00 3.41 -1.26 -5.19 113.62 106.70 1b8t n SER 106 Ca -0.03 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.56 1b8t n SER 106 Cb 0.60 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.53 1b8t n SER 106 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1b8t s ARG 107 N -2.00 0.05 -0.27 4.33 3.52 -1.26 -5.19 118.95 118.13 1b8t s ARG 107 Ca 0.00 -0.02 -0.38 0.00 -0.13 0.00 0.00 55.73 55.21 1b8t s ARG 107 Cb 0.00 0.02 0.15 0.00 -1.56 0.00 0.00 34.95 33.57 1b8t s ARG 107 CO 0.00 -0.02 1.35 1.41 -0.81 0.00 0.00 175.30 177.23 1b8t s MET 108 N -1.96 0.08 -0.17 5.12 1.75 -1.26 -5.19 119.30 117.67 1b8t s MET 108 Ca 0.11 -0.03 -0.35 0.00 -1.25 0.00 0.00 55.69 54.18 1b8t s MET 108 Cb -0.01 0.04 0.14 0.00 2.84 0.00 0.00 34.83 37.84 1b8t s MET 108 CO -0.03 -0.03 1.28 0.00 -0.65 0.00 0.00 175.02 175.59 1b8t s ALA 109 N -2.09 -2.17 -0.13 4.11 0.00 -1.26 -5.19 121.76 115.03 1b8t s ALA 109 Ca 0.11 1.44 -0.34 0.00 0.00 0.00 0.00 51.96 53.18 1b8t s ALA 109 Cb -0.01 -0.06 0.13 0.00 0.00 0.00 0.00 23.12 23.19 1b8t s ALA 109 CO -0.03 -0.71 1.28 1.14 0.00 0.00 0.00 175.76 177.44 1b8t s GLN 110 N -2.30 0.29 -0.26 0.00 -2.07 -1.26 -5.19 119.66 108.87 1b8t s GLN 110 Ca 0.11 -0.13 -0.29 0.00 -1.82 0.00 0.00 55.36 53.23 1b8t s GLN 110 Cb 0.01 0.11 0.18 0.00 -1.09 0.00 0.00 33.01 32.22 1b8t s GLN 110 CO -0.04 -0.13 1.30 0.21 -1.32 0.00 0.00 175.29 175.31 1b8t s LYS 111 N -2.34 0.15 -0.08 9.60 2.47 -1.26 -5.18 119.74 123.09 1b8t s LYS 111 Ca 0.12 0.04 -0.30 0.00 -1.56 0.00 0.00 55.97 54.27 1b8t s LYS 111 Cb 0.02 0.07 0.10 0.00 -1.46 0.00 0.00 37.83 36.57 1b8t s LYS 111 CO -0.04 -0.05 0.87 0.54 0.16 0.00 0.00 175.35 176.84 1b8t s VAL 112 N -1.00 0.00 0.00 4.02 0.11 -1.26 -5.18 120.40 117.09 1b8t s VAL 112 Ca 0.07 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.12 1b8t s VAL 112 Cb -0.01 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.84 1b8t s VAL 112 CO -0.06 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.32 1b8t n GLY 113 N 0.52 0.41 0.00 6.54 0.00 -1.26 -5.19 105.19 106.21 1b8t n GLY 113 Ca -0.12 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.12 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 -0.01 1.39 3.63 -0.02 0.00 -1.26 -5.18 105.19 103.74 1b8t n GLY 114 Ca 0.00 -0.68 -0.05 0.00 0.00 0.00 0.00 46.02 45.29 1b8t n GLY 114 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1b8t s SER 115 N 0.00 -0.17 0.00 1.61 0.01 -1.26 -4.77 113.70 109.12 1b8t s SER 115 Ca 0.00 0.28 0.00 0.00 1.31 0.00 0.00 55.95 57.54 1b8t s SER 115 Cb 0.00 0.26 0.00 0.00 0.21 0.00 0.00 66.02 66.49 1b8t s SER 115 CO 0.00 -0.10 0.00 0.47 0.41 0.00 0.00 173.24 174.02 1b8t n ASP 116 N 1.30 0.00 -4.41 2.44 8.00 -0.57 -5.06 116.55 118.25 1b8t n ASP 116 Ca -0.08 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.19 1b8t n ASP 116 Cb 0.57 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.57 1b8t n ASP 116 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1b8t s GLY 117 N -0.20 2.25 -0.43 0.44 0.00 -1.26 -0.03 107.32 108.10 1b8t s GLY 117 Ca 0.00 -1.82 -0.14 0.00 0.00 0.00 0.00 44.72 42.75 1b8t s GLY 117 CO 0.00 -1.85 0.32 0.00 0.00 0.00 0.00 173.10 171.56 1b8t n PRO 119 N 5.14 0.75 0.00 0.00 -0.04 -1.25 0.32 135.00 139.92 1b8t n PRO 119 Ca -0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 1b8t n PRO 119 Cb 0.46 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 1b8t n PRO 119 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1b8t n ARG 120 N -0.98 0.00 0.08 0.54 3.00 -1.26 -4.64 116.66 113.40 1b8t n ARG 120 Ca 0.17 0.13 -0.10 0.00 -0.00 0.00 0.00 57.85 58.04 1b8t n ARG 120 Cb 0.08 -0.60 -0.06 0.00 0.00 0.00 0.00 32.46 31.88 1b8t n ARG 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1b8t n GLY 122 N 1.10 2.70 3.77 0.00 0.00 0.15 -5.06 105.19 107.84 1b8t n GLY 122 Ca -0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 1b8t n GLY 122 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b8t s GLN 123 N -0.41 4.19 0.97 1.61 -0.21 -1.24 -4.37 119.66 120.20 1b8t s GLN 123 Ca 0.00 2.26 -0.11 0.00 0.02 0.00 0.00 55.36 57.53 1b8t s GLN 123 Cb 0.00 -2.96 0.16 0.00 1.00 0.00 0.00 33.01 31.21 1b8t s GLN 123 CO 0.00 -0.34 1.02 0.00 -2.12 0.00 0.00 175.29 173.84 1b8t n ALA 124 N 0.53 -1.43 -3.72 6.09 0.00 -1.26 -0.26 120.51 120.45 1b8t n ALA 124 Ca 0.01 -0.68 -0.22 0.00 0.00 0.00 0.00 53.44 52.55 1b8t n ALA 124 Cb 0.42 -2.11 -0.17 0.00 0.00 0.00 0.00 19.45 17.59 1b8t n ALA 124 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1b8t s VAL 125 N -2.57 0.52 -0.30 0.00 1.01 0.96 -4.53 120.40 115.50 1b8t s VAL 125 Ca 0.66 -0.03 -0.17 0.00 0.00 0.00 0.00 61.98 62.44 1b8t s VAL 125 Cb -0.23 -0.61 0.18 0.00 0.00 0.00 0.00 36.38 35.72 1b8t s VAL 125 CO 0.60 0.26 1.15 -0.72 0.00 0.00 0.00 175.10 176.39 1b8t s TYR 126 N 1.50 -0.36 0.05 5.22 1.13 -1.26 -1.52 117.35 122.11 1b8t s TYR 126 Ca -0.02 0.63 0.00 0.00 -1.41 0.00 0.00 57.07 56.28 1b8t s TYR 126 Cb -0.13 0.22 0.00 0.00 -1.10 0.00 0.00 41.96 40.95 1b8t s TYR 126 CO -0.03 -0.18 0.00 0.00 -2.51 0.00 0.00 175.55 172.83 1b8t n ALA 127 N 4.75 -2.36 -1.59 9.51 0.00 -1.26 -4.95 120.51 124.60 1b8t n ALA 127 Ca -0.08 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1b8t n ALA 127 Cb 0.54 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.98 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 1.22 -2.05 -2.99 0.00 0.00 -1.26 -4.83 120.51 110.59 1b8t n ALA 128 Ca 0.00 0.43 -0.12 0.00 0.00 0.00 0.00 53.44 53.75 1b8t n ALA 128 Cb 0.00 -1.35 0.06 0.00 0.00 0.00 0.00 19.45 18.16 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 -0.15 -4.53 -4.11 0.00 2.13 -1.26 -5.00 120.64 107.72 1b8t n GLU 129 Ca 0.00 0.60 -0.28 0.00 0.66 0.00 0.00 57.16 58.14 1b8t n GLU 129 Cb 0.00 -4.86 -0.17 0.00 0.27 0.00 0.00 31.44 26.69 1b8t n GLU 129 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1b8t s LYS 130 N -4.91 1.90 0.05 5.31 2.36 -1.26 -3.62 119.74 119.56 1b8t s LYS 130 Ca 0.01 -0.42 0.06 0.00 -2.55 0.00 0.00 55.97 53.07 1b8t s LYS 130 Cb -0.00 -1.78 -0.02 0.00 -1.05 0.00 0.00 37.83 34.98 1b8t s LYS 130 CO 0.51 -0.19 -0.16 0.54 1.55 0.00 0.00 175.35 177.61 1b8t s VAL 131 N 1.40 1.24 -0.19 4.02 0.11 0.12 -4.60 120.40 122.51 1b8t s VAL 131 Ca 0.01 -1.11 0.01 0.00 -2.93 0.00 0.00 61.98 57.96 1b8t s VAL 131 Cb -0.13 -1.13 0.04 0.00 -1.53 0.00 0.00 36.38 33.63 1b8t s VAL 131 CO -0.07 0.01 -0.12 -0.63 -3.33 0.00 0.00 175.10 170.96 1b8t s ILE 132 N -0.91 1.66 -0.05 7.04 1.09 -1.26 -1.02 121.20 127.74 1b8t s ILE 132 Ca 0.02 -0.93 -0.06 0.00 -1.10 0.00 0.00 60.65 58.59 1b8t s ILE 132 Cb -0.08 -1.68 0.01 0.00 -1.06 0.00 0.00 42.46 39.65 1b8t s ILE 132 CO 0.02 0.25 0.15 -0.83 -0.10 0.00 0.00 174.94 174.43 1b8t s GLY 133 N 1.41 -0.10 -1.24 6.18 0.00 0.15 -4.90 107.32 108.81 1b8t s GLY 133 Ca 0.00 0.38 -0.15 0.00 0.00 0.00 0.00 44.72 44.96 1b8t s GLY 133 CO -0.09 0.31 0.65 0.00 0.00 0.00 0.00 173.10 173.97 1b8t n ALA 134 N 2.84 -2.36 -3.67 3.20 0.00 -1.26 0.08 120.51 119.35 1b8t n ALA 134 Ca -0.13 -0.28 -0.27 0.00 0.00 0.00 0.00 53.44 52.76 1b8t n ALA 134 Cb 0.59 -3.02 -0.03 0.00 0.00 0.00 0.00 19.45 16.99 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 -1.83 -0.46 3.13 0.00 0.00 -1.26 -4.90 105.19 99.88 1b8t n GLY 135 Ca -0.18 0.08 -0.09 0.00 0.00 0.00 0.00 46.02 45.83 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 -6.31 0.81 0.10 1.61 1.02 0.11 -5.17 119.74 111.92 1b8t s LYS 136 Ca 0.50 -1.36 0.10 0.00 0.02 0.00 0.00 55.97 55.23 1b8t s LYS 136 Cb -0.28 0.19 -0.04 0.00 -0.52 0.00 0.00 37.83 37.18 1b8t s LYS 136 CO 0.62 -0.19 -0.25 -1.12 -0.92 0.00 0.00 175.35 173.49 1b8t s SER 137 N -3.01 3.02 0.17 2.83 0.01 -1.26 0.32 113.70 115.78 1b8t s SER 137 Ca 0.17 -0.69 -0.24 0.00 1.31 0.00 0.00 55.95 56.50 1b8t s SER 137 Cb 0.08 -0.21 0.06 0.00 0.21 0.00 0.00 66.02 66.16 1b8t s SER 137 CO -0.03 0.16 0.96 0.26 0.41 0.00 0.00 173.24 175.00 1b8t s TRP 138 N -1.03 -0.08 -0.03 2.43 0.52 -0.19 -3.85 118.94 116.71 1b8t s TRP 138 Ca 0.11 -0.26 -0.30 0.00 0.02 0.00 0.00 56.10 55.67 1b8t s TRP 138 Cb -0.10 0.66 -0.05 0.00 -1.15 0.00 0.00 33.47 32.83 1b8t s TRP 138 CO 0.05 -0.89 1.40 -1.01 0.02 0.00 0.00 176.95 176.51 1b8t s HIS 139 N -3.06 2.78 -0.76 -1.98 3.76 -1.26 0.14 115.29 114.91 1b8t s HIS 139 Ca 0.14 0.80 -0.24 0.00 -0.15 0.00 0.00 55.06 55.61 1b8t s HIS 139 Cb -0.02 -3.65 -0.19 0.00 1.11 0.00 0.00 32.58 29.83 1b8t s HIS 139 CO 0.03 -2.42 1.88 1.17 -0.85 0.00 0.00 174.74 174.56 1b8t n LYS 140 N 5.71 1.10 0.00 1.40 4.81 -1.24 -1.20 118.16 128.74 1b8t n LYS 140 Ca 0.13 -1.83 0.00 0.00 -0.87 0.00 0.00 58.31 55.74 1b8t n LYS 140 Cb 0.44 -3.15 0.00 0.00 0.02 0.00 0.00 35.03 32.34 1b8t n LYS 140 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1b8t n SER 141 N 10.83 0.00 0.09 3.14 2.88 -1.26 -4.89 113.62 124.40 1b8t n SER 141 Ca 0.47 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.98 1b8t n SER 141 Cb 0.43 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.82 1b8t n SER 141 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1b8t n PHE 143 N -3.28 0.44 -4.14 0.00 -0.00 -1.05 -4.46 117.46 104.96 1b8t n PHE 143 Ca -0.00 0.29 -0.26 0.00 -0.00 0.00 0.00 57.45 57.48 1b8t n PHE 143 Cb 0.86 -1.68 -0.06 0.00 -0.00 0.00 0.00 39.48 38.60 1b8t n PHE 143 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.76 175.78 1b8t s ARG 144 N 6.19 2.69 -0.03 -4.13 1.04 -1.26 0.23 118.95 123.68 1b8t s ARG 144 Ca 0.95 -1.00 -0.30 0.00 -1.04 0.00 0.00 55.73 54.35 1b8t s ARG 144 Cb -0.91 -2.51 -0.04 0.00 -2.04 0.00 0.00 34.95 29.46 1b8t s ARG 144 CO 0.36 0.46 1.18 0.00 -0.04 0.00 0.00 175.30 177.26 1b8t n ALA 146 N 4.82 4.37 0.00 0.00 0.00 -0.33 -0.22 120.51 129.15 1b8t n ALA 146 Ca 0.10 -1.41 0.00 0.00 0.00 0.00 0.00 53.44 52.13 1b8t n ALA 146 Cb 0.47 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.65 1b8t n ALA 146 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1b8t n LYS 147 N 0.02 0.00 -0.01 0.00 4.76 -1.26 -4.87 118.16 116.80 1b8t n LYS 147 Ca 0.28 0.00 0.04 0.00 -2.87 0.00 0.00 58.31 55.76 1b8t n LYS 147 Cb 0.85 -0.32 -0.08 0.00 -1.84 0.00 0.00 35.03 33.63 1b8t n LYS 147 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1b8t n GLY 149 N 1.95 0.43 3.72 0.00 0.00 0.69 -5.01 105.19 106.97 1b8t n GLY 149 Ca -0.04 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.69 1b8t n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b8t s LYS 150 N -1.61 4.61 -0.12 1.61 1.02 -1.25 -4.66 119.74 119.35 1b8t s LYS 150 Ca 0.00 1.53 -0.29 0.00 0.02 0.00 0.00 55.97 57.22 1b8t s LYS 150 Cb 0.00 -3.38 -0.03 0.00 -0.52 0.00 0.00 37.83 33.90 1b8t s LYS 150 CO 0.00 0.07 1.37 0.45 -0.92 0.00 0.00 175.35 176.31 1b8t s SER 151 N 0.36 6.88 0.45 2.83 0.15 -1.26 -0.16 113.70 122.95 1b8t s SER 151 Ca 0.50 1.87 0.01 0.00 0.70 0.00 0.00 55.95 59.03 1b8t s SER 151 Cb -0.24 -2.54 0.06 0.00 -1.71 0.00 0.00 66.02 61.58 1b8t s SER 151 CO 0.30 -0.79 0.41 0.18 1.20 0.00 0.00 173.24 174.55 1b8t n LEU 152 N 6.52 0.00 0.12 3.45 4.77 0.14 -4.95 117.00 127.05 1b8t n LEU 152 Ca 0.14 -0.98 0.00 0.00 -0.03 0.00 0.00 56.01 55.14 1b8t n LEU 152 Cb 0.44 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1b8t n LEU 152 CO 0.58 -0.68 0.00 1.21 -1.33 0.00 0.00 177.39 177.17 1b8t n GLU 153 N -1.74 0.00 -1.63 3.23 4.07 -1.26 -4.46 120.64 118.85 1b8t n GLU 153 Ca 0.07 0.00 -0.29 0.00 -0.06 0.00 0.00 57.16 56.88 1b8t n GLU 153 Cb 0.26 0.00 0.17 0.00 -0.06 0.00 0.00 31.44 31.81 1b8t n GLU 153 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 1b8t s SER 154 N -1.71 3.00 -1.02 4.31 1.04 -1.26 -4.48 113.70 113.58 1b8t s SER 154 Ca 0.00 0.63 -0.09 0.00 0.48 0.00 0.00 55.95 56.98 1b8t s SER 154 Cb 0.00 -0.95 -0.07 0.00 0.10 0.00 0.00 66.02 65.10 1b8t s SER 154 CO 0.00 -2.83 2.21 0.41 0.98 0.00 0.00 173.24 174.01 1b8t n THR 155 N -3.90 2.67 -1.78 2.02 -1.04 -1.26 -4.21 114.28 106.78 1b8t n THR 155 Ca 0.11 -1.69 0.03 0.00 -2.04 0.00 0.00 64.05 60.46 1b8t n THR 155 Cb 0.60 -2.24 0.16 0.00 -1.82 0.00 0.00 70.33 67.03 1b8t n THR 155 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1b8t n THR 156 N 4.37 1.93 -3.35 12.58 -1.04 -1.26 -5.05 114.28 122.47 1b8t n THR 156 Ca 0.50 -3.04 -0.18 0.00 -2.04 0.00 0.00 64.05 59.29 1b8t n THR 156 Cb 0.19 -0.13 -0.00 0.00 -1.82 0.00 0.00 70.33 68.56 1b8t n THR 156 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 1b8t s LEU 157 N -2.85 3.89 -0.13 -4.42 0.05 -1.26 -0.74 118.68 113.22 1b8t s LEU 157 Ca 0.39 -0.24 -0.01 0.00 0.05 0.00 0.00 54.13 54.31 1b8t s LEU 157 Cb 0.38 -2.73 0.03 0.00 -2.05 0.00 0.00 46.19 41.82 1b8t s LEU 157 CO -0.07 -0.52 -0.05 0.00 -0.55 0.00 0.00 176.35 175.16 1b8t s ALA 158 N -2.22 1.26 -0.89 1.48 0.00 0.14 -4.69 121.76 116.83 1b8t s ALA 158 Ca 0.48 -0.59 -0.16 0.00 0.00 0.00 0.00 51.96 51.69 1b8t s ALA 158 Cb -0.10 -0.98 0.18 0.00 0.00 0.00 0.00 23.12 22.23 1b8t s ALA 158 CO 0.32 -0.61 0.95 0.16 0.00 0.00 0.00 175.76 176.58 1b8t s ASP 159 N 1.74 6.74 -0.02 0.00 -4.77 -1.25 -0.61 116.67 118.49 1b8t s ASP 159 Ca 0.03 -2.48 0.06 0.00 -3.30 0.00 0.00 52.55 46.87 1b8t s ASP 159 Cb -0.14 -2.29 -0.01 0.00 -1.09 0.00 0.00 42.92 39.39 1b8t s ASP 159 CO -0.08 -0.76 -0.20 -0.75 0.70 0.00 0.00 175.17 174.08 1b8t s LYS 160 N 1.17 1.64 -1.11 2.11 2.47 0.62 -4.79 119.74 121.85 1b8t s LYS 160 Ca 0.25 -0.71 -0.22 0.00 -1.56 0.00 0.00 55.97 53.73 1b8t s LYS 160 Cb -0.08 -1.57 0.01 0.00 -1.46 0.00 0.00 37.83 34.73 1b8t s LYS 160 CO -0.09 0.42 0.74 -3.47 0.16 0.00 0.00 175.35 173.10 1b8t n ASP 161 N 2.63 -5.05 -3.69 1.43 4.64 -1.26 0.25 116.55 115.50 1b8t n ASP 161 Ca -0.15 -1.06 -0.26 0.00 -1.38 0.00 0.00 54.79 51.94 1b8t n ASP 161 Cb 0.53 -2.76 -0.05 0.00 -1.04 0.00 0.00 41.12 37.81 1b8t n ASP 161 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1b8t n GLY 162 N -1.81 -0.42 3.11 0.27 0.00 -1.26 -4.87 105.19 100.21 1b8t n GLY 162 Ca -0.12 0.04 -0.14 0.00 0.00 0.00 0.00 46.02 45.81 1b8t n GLY 162 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1b8t s GLU 163 N -6.18 0.66 -0.13 1.61 0.41 0.14 -5.11 118.70 110.09 1b8t s GLU 163 Ca 0.51 -0.92 -0.01 0.00 -0.41 0.00 0.00 54.97 54.15 1b8t s GLU 163 Cb -0.30 -0.39 -0.02 0.00 -1.78 0.00 0.00 34.13 31.64 1b8t s GLU 163 CO 0.63 0.07 -0.10 0.96 -0.49 0.00 0.00 175.26 176.32 1b8t s ILE 164 N -1.80 3.33 0.26 -1.63 -4.36 -1.25 -0.28 121.20 115.47 1b8t s ILE 164 Ca -0.04 -0.57 0.05 0.00 -0.26 0.00 0.00 60.65 59.83 1b8t s ILE 164 Cb -0.07 -2.41 -0.02 0.00 1.25 0.00 0.00 42.46 41.21 1b8t s ILE 164 CO -0.00 0.52 0.18 -1.22 0.24 0.00 0.00 174.94 174.66 1b8t n TYR 165 N 3.40 -0.40 -3.70 1.37 4.01 0.22 -1.18 117.16 120.87 1b8t n TYR 165 Ca -0.18 -2.02 -0.33 0.00 -0.16 0.00 0.00 57.90 55.22 1b8t n TYR 165 Cb 0.53 0.16 -0.05 0.00 -0.31 0.00 0.00 39.34 39.66 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 3.30 0.37 -0.25 0.00 5.09 -1.21 1.58 116.57 125.44 1b8t h LYS 167 Ca -0.47 -0.02 0.05 0.00 0.09 0.00 0.00 60.65 60.30 1b8t h LYS 167 Cb 1.18 -0.08 -0.01 0.00 0.10 0.00 0.00 32.23 33.41 1b8t h LYS 167 CO 0.70 0.24 0.18 0.78 -2.09 0.00 0.00 179.45 179.26 1b8t h GLY 168 N 0.38 0.13 0.32 0.07 0.00 -1.93 0.43 103.07 102.48 1b8t h GLY 168 Ca 0.64 -0.04 -0.11 0.00 0.00 0.00 0.00 47.33 47.82 1b8t h GLY 168 CO -0.57 0.04 -0.49 0.00 0.00 0.00 0.00 176.54 175.52 1b8t h TYR 170 N -0.69 0.33 0.00 0.00 3.20 0.01 0.44 116.97 120.26 1b8t h TYR 170 Ca -0.10 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.78 1b8t h TYR 170 Cb 1.33 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 39.49 1b8t h TYR 170 CO 0.23 0.18 -0.01 0.00 -1.64 0.00 0.00 178.16 176.92 1b8t h ALA 171 N 1.78 0.00 -0.23 1.82 0.00 -0.23 -3.21 119.26 119.19 1b8t h ALA 171 Ca 0.17 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.10 1b8t h ALA 171 Cb 0.26 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 1b8t h ALA 171 CO -0.04 0.01 -0.50 0.87 0.00 0.00 0.00 179.25 179.59 1b8t h LYS 172 N -0.73 -0.44 -1.08 0.00 1.79 -1.07 0.54 116.57 115.58 1b8t h LYS 172 Ca 0.00 0.03 0.43 0.00 -2.18 0.00 0.00 60.65 58.93 1b8t h LYS 172 Cb 0.01 0.10 -0.17 0.00 -1.58 0.00 0.00 32.23 30.60 1b8t h LYS 172 CO 0.00 -0.29 0.62 0.09 -1.08 0.00 0.00 179.45 178.79 1b8t n ASN 173 N -5.15 0.31 -2.89 0.86 4.13 0.15 0.00 115.26 112.67 1b8t n ASN 173 Ca -0.05 1.56 -0.25 0.00 1.68 0.00 0.00 54.58 57.52 1b8t n ASN 173 Cb 0.33 -0.76 -0.03 0.00 -1.54 0.00 0.00 39.78 37.78 1b8t n ASN 173 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1b8t n PHE 174 N -5.07 3.33 0.00 3.10 3.72 0.15 -4.93 117.46 117.75 1b8t n PHE 174 Ca 0.38 -3.80 0.00 0.00 -0.05 0.00 0.00 57.45 53.98 1b8t n PHE 174 Cb 1.34 -0.41 0.00 0.00 -0.94 0.00 0.00 39.48 39.47 1b8t n PHE 174 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b8t n GLY 175 N -0.21 -1.34 3.77 1.37 0.00 0.10 -4.81 105.19 104.07 1b8t n GLY 175 Ca 0.31 0.99 -0.30 0.00 0.00 0.00 0.00 46.02 47.02 1b8t n GLY 175 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1b8t s PRO 176 N 0.00 -0.22 0.22 1.61 0.04 -1.26 -4.46 135.00 130.93 1b8t s PRO 176 Ca 0.00 -0.22 -0.15 0.00 0.04 0.00 0.00 61.00 60.67 1b8t s PRO 176 Cb 0.00 -1.73 0.01 0.00 0.04 0.00 0.00 34.50 32.82 1b8t s PRO 176 CO 0.00 -3.02 0.49 -1.59 0.04 0.00 0.00 177.00 172.92 1b8t s LYS 177 N -5.64 1.47 0.00 4.56 0.00 -1.26 -5.10 119.74 113.77 1b8t s LYS 177 Ca 0.72 -1.09 0.00 0.00 0.00 0.00 0.00 55.97 55.60 1b8t s LYS 177 Cb -0.07 0.49 0.00 0.00 0.00 0.00 0.00 37.83 38.25 1b8t s LYS 177 CO 0.54 -0.62 0.00 0.41 0.00 0.00 0.00 175.35 175.69 1b8t n GLY 178 N -0.36 3.32 3.61 0.59 0.00 -1.26 -5.20 105.19 105.90 1b8t n GLY 178 Ca -0.05 -0.31 -0.01 0.00 0.00 0.00 0.00 46.02 45.64 1b8t n GLY 178 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1b8t s PHE 179 N 0.00 -0.09 0.05 1.61 5.36 -1.26 -5.17 117.98 118.49 1b8t s PHE 179 Ca 0.00 0.00 0.00 0.00 -0.96 0.00 0.00 56.93 55.97 1b8t s PHE 179 Cb 0.00 0.53 0.00 0.00 -0.34 0.00 0.00 43.02 43.21 1b8t s PHE 179 CO 0.00 -0.25 0.00 0.41 -1.46 0.00 0.00 175.22 173.92 1b8t n GLY 180 N -0.30 -1.93 3.56 13.12 0.00 -1.26 -5.00 105.19 113.37 1b8t n GLY 180 Ca -0.04 -1.46 -0.23 0.00 0.00 0.00 0.00 46.02 44.28 1b8t n GLY 180 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1b8t s PHE 181 N -2.01 2.49 0.06 1.61 -0.12 -1.26 -5.07 117.98 113.69 1b8t s PHE 181 Ca 0.00 -0.28 0.00 0.00 -0.05 0.00 0.00 56.93 56.60 1b8t s PHE 181 Cb 0.00 -1.09 0.00 0.00 -0.63 0.00 0.00 43.02 41.30 1b8t s PHE 181 CO 0.00 0.67 0.00 0.41 -0.05 0.00 0.00 175.22 176.25 1b8t n GLY 182 N -0.75 -0.10 3.64 1.99 0.00 -1.26 -5.08 105.19 103.63 1b8t n GLY 182 Ca -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 1b8t n GLY 182 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1b8t n GLN 183 N -2.82 1.63 0.00 1.61 7.27 -1.26 -4.90 117.38 118.92 1b8t n GLN 183 Ca 0.00 0.58 0.00 0.00 0.07 0.00 0.00 57.00 57.65 1b8t n GLN 183 Cb 0.00 -2.11 0.00 0.00 2.41 0.00 0.00 30.24 30.54 1b8t n GLN 183 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1b8t n GLY 184 N 1.04 2.31 1.80 1.69 0.00 -1.26 -5.15 105.19 105.61 1b8t n GLY 184 Ca 0.08 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1b8t n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b8t n ALA 185 N -3.00 -2.11 -2.16 4.61 0.00 -1.26 -5.03 120.51 111.55 1b8t n ALA 185 Ca 0.00 0.44 -0.22 0.00 0.00 0.00 0.00 53.44 53.66 1b8t n ALA 185 Cb 0.00 -1.39 0.04 0.00 0.00 0.00 0.00 19.45 18.10 1b8t n ALA 185 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1b8t s GLY 186 N -1.50 1.94 -0.22 0.00 0.00 -1.26 -5.14 107.32 101.14 1b8t s GLY 186 Ca 0.00 -1.85 -0.21 0.00 0.00 0.00 0.00 44.72 42.66 1b8t s GLY 186 CO 0.00 -1.78 0.60 0.00 0.00 0.00 0.00 173.10 171.92 1b8t s ALA 187 N -2.71 -1.47 0.25 3.20 0.00 -1.26 -5.17 121.76 114.60 1b8t s ALA 187 Ca 0.52 1.68 0.07 0.00 0.00 0.00 0.00 51.96 54.24 1b8t s ALA 187 Cb -0.04 -0.98 -0.04 0.00 0.00 0.00 0.00 23.12 22.06 1b8t s ALA 187 CO 0.33 -0.28 0.17 -0.48 0.00 0.00 0.00 175.76 175.50 1b8t s LEU 188 N 0.31 3.73 0.25 0.00 2.34 -1.26 -5.11 118.68 118.94 1b8t s LEU 188 Ca -0.00 -0.31 -0.14 0.00 0.06 0.00 0.00 54.13 53.74 1b8t s LEU 188 Cb -0.04 -2.26 -0.08 0.00 -0.56 0.00 0.00 46.19 43.25 1b8t s LEU 188 CO 0.01 -0.04 0.65 -0.51 -1.06 0.00 0.00 176.35 175.40 1b8t s ILE 189 N -2.16 4.77 -0.23 1.48 2.07 -1.26 -5.07 121.20 120.79 1b8t s ILE 189 Ca 0.33 0.84 -0.03 0.00 -1.41 0.00 0.00 60.65 60.38 1b8t s ILE 189 Cb -0.08 -3.67 0.01 0.00 0.13 0.00 0.00 42.46 38.85 1b8t s ILE 189 CO 0.24 -0.01 -0.06 -2.28 -1.91 0.00 0.00 174.94 170.92 1b8t s HIS 190 N -1.77 3.00 -0.20 3.50 2.46 -1.26 -5.08 115.29 115.94 1b8t s HIS 190 Ca 0.48 -1.27 -0.27 0.00 0.47 0.00 0.00 55.06 54.47 1b8t s HIS 190 Cb -0.12 -2.08 -0.00 0.00 -0.13 0.00 0.00 32.58 30.24 1b8t s HIS 190 CO 0.19 -0.65 0.92 -1.12 -2.47 0.00 0.00 174.74 171.61 1b8t s SER 191 N 1.40 7.01 0.00 9.88 0.01 -1.26 -5.37 113.70 125.36 1b8t s SER 191 Ca 0.03 1.25 0.24 0.00 1.31 0.00 0.00 55.95 58.78 1b8t s SER 191 Cb -0.15 -2.49 0.19 0.00 0.21 0.00 0.00 66.02 63.77 1b8t s SER 191 CO -0.04 -0.51 1.25 1.67 0.41 0.00 0.00 173.24 176.01