#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b8t n PRO 2 N 0.00 -2.23 -3.68 2.12 -0.04 -1.26 -5.10 135.00 124.81 1b8t n PRO 2 Ca 0.00 -1.93 -0.04 0.00 -0.04 0.00 0.00 63.50 61.49 1b8t n PRO 2 Cb 0.00 -1.52 -0.01 0.00 -0.04 0.00 0.00 33.50 31.93 1b8t n PRO 2 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1b8t s ASN 3 N -5.22 -0.21 -0.01 3.54 2.47 -1.26 -5.19 114.94 109.06 1b8t s ASN 3 Ca 0.74 -0.28 -0.29 0.00 0.42 0.00 0.00 52.86 53.45 1b8t s ASN 3 Cb -0.04 0.43 0.10 0.00 -1.45 0.00 0.00 41.25 40.29 1b8t s ASN 3 CO 0.54 -0.77 0.98 0.86 -3.72 0.00 0.00 177.10 174.99 1b8t s TRP 4 N -3.16 -0.25 0.00 0.43 -0.11 -1.26 -5.19 118.94 109.40 1b8t s TRP 4 Ca 0.11 0.11 0.00 0.00 1.22 0.00 0.00 56.10 57.54 1b8t s TRP 4 Cb -0.01 0.55 0.00 0.00 -1.50 0.00 0.00 33.47 32.51 1b8t s TRP 4 CO -0.01 -0.51 0.00 0.41 -4.62 0.00 0.00 176.95 172.22 1b8t n GLY 5 N -0.27 5.19 0.00 5.86 0.00 -1.26 -5.19 105.19 109.52 1b8t n GLY 5 Ca -0.07 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 44.94 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 0.00 3.96 0.00 -0.02 0.00 -1.26 -5.19 105.19 102.68 1b8t n GLY 6 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.05 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 0.00 2.93 2.93 -0.02 0.00 -1.26 -4.87 105.19 104.89 1b8t n GLY 7 Ca 0.00 -0.68 -0.22 0.00 0.00 0.00 0.00 46.02 45.12 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 0.92 -3.77 1.61 5.02 -0.31 -4.95 118.16 116.68 1b8t n LYS 8 Ca 0.00 -2.76 -0.24 0.00 -2.02 0.00 0.00 58.31 53.29 1b8t n LYS 8 Cb 0.00 0.46 -0.17 0.00 -0.02 0.00 0.00 35.03 35.30 1b8t n LYS 8 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1b8t s LYS 9 N -3.64 0.64 -0.45 1.97 2.20 -1.26 -0.35 119.74 118.84 1b8t s LYS 9 Ca 0.16 0.03 -0.28 0.00 -0.36 0.00 0.00 55.97 55.52 1b8t s LYS 9 Cb -0.01 -1.13 0.00 0.00 -1.51 0.00 0.00 37.83 35.18 1b8t s LYS 9 CO 0.10 -0.34 1.50 0.00 -0.36 0.00 0.00 175.35 176.25 1b8t n GLY 11 N 5.23 -0.95 0.02 0.00 0.00 -1.20 -0.11 105.19 108.17 1b8t n GLY 11 Ca 0.17 -0.11 -0.01 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.78 0.29 0.14 1.61 0.31 -1.26 -4.58 118.33 114.07 1b8t n VAL 12 Ca 0.13 0.43 0.02 0.00 -0.01 0.00 0.00 64.34 64.91 1b8t n VAL 12 Cb 0.06 -1.67 0.07 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 -3.29 0.00 -4.79 0.00 -0.06 0.84 -5.07 117.38 105.02 1b8t n GLN 14 Ca 0.01 0.09 -0.30 0.00 -2.00 0.00 0.00 57.00 54.80 1b8t n GLN 14 Cb 0.71 -2.54 -0.14 0.00 -4.06 0.00 0.00 30.24 24.21 1b8t n GLN 14 CO 0.00 0.00 0.00 0.15 -0.20 0.00 0.00 177.06 177.01 1b8t s LYS 15 N -2.67 1.81 0.81 3.69 1.02 -1.07 -4.88 119.74 118.46 1b8t s LYS 15 Ca 0.00 -1.11 -0.13 0.00 0.02 0.00 0.00 55.97 54.74 1b8t s LYS 15 Cb 0.00 -2.02 0.08 0.00 -0.52 0.00 0.00 37.83 35.37 1b8t s LYS 15 CO 0.00 0.51 1.14 0.00 -0.92 0.00 0.00 175.35 176.08 1b8t n ALA 16 N 1.61 -0.23 -2.37 5.17 0.00 -1.26 0.05 120.51 123.48 1b8t n ALA 16 Ca -0.17 -0.35 -0.19 0.00 0.00 0.00 0.00 53.44 52.74 1b8t n ALA 16 Cb 0.52 -2.21 -0.10 0.00 0.00 0.00 0.00 19.45 17.66 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 -2.15 1.66 -0.04 0.00 1.01 0.53 -4.65 120.40 116.77 1b8t s VAL 17 Ca 0.72 -2.10 0.02 0.00 0.00 0.00 0.00 61.98 60.62 1b8t s VAL 17 Cb -0.29 -1.94 0.01 0.00 0.00 0.00 0.00 36.38 34.17 1b8t s VAL 17 CO 0.52 -0.54 -0.07 -0.31 0.00 0.00 0.00 175.10 174.70 1b8t s TYR 18 N -2.75 0.94 -0.80 5.22 2.02 -1.26 -1.16 117.35 119.55 1b8t s TYR 18 Ca 0.19 -0.28 -0.31 0.00 -0.37 0.00 0.00 57.07 56.31 1b8t s TYR 18 Cb -0.02 -0.74 -0.17 0.00 -0.40 0.00 0.00 41.96 40.63 1b8t s TYR 18 CO 0.06 -0.18 2.57 1.19 -1.57 0.00 0.00 175.55 177.62 1b8t n PHE 19 N 3.76 0.88 0.01 2.71 3.01 -1.26 -3.60 117.46 122.97 1b8t n PHE 19 Ca -0.23 0.33 0.00 0.00 1.01 0.00 0.00 57.45 58.56 1b8t n PHE 19 Cb 0.52 -2.45 0.00 0.00 -0.01 0.00 0.00 39.48 37.54 1b8t n PHE 19 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1b8t n ALA 20 N 11.72 0.00 -2.69 4.37 0.00 -1.26 -4.99 120.51 127.66 1b8t n ALA 20 Ca 0.56 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.92 1b8t n ALA 20 Cb 0.17 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.67 1b8t n ALA 20 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1b8t n GLU 21 N -2.22 1.15 -4.09 0.00 2.13 -1.24 -5.11 120.64 111.26 1b8t n GLU 21 Ca 0.00 -2.92 -0.31 0.00 0.66 0.00 0.00 57.16 54.59 1b8t n GLU 21 Cb 0.00 -0.98 -0.07 0.00 0.27 0.00 0.00 31.44 30.66 1b8t n GLU 21 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 1b8t s GLU 22 N -2.31 2.91 -0.16 5.31 2.12 -1.26 -2.18 118.70 123.13 1b8t s GLU 22 Ca 0.26 -0.63 0.01 0.00 0.36 0.00 0.00 54.97 54.97 1b8t s GLU 22 Cb 0.44 -2.75 0.03 0.00 0.26 0.00 0.00 34.13 32.11 1b8t s GLU 22 CO 0.01 0.60 -0.14 0.08 -0.54 0.00 0.00 175.26 175.27 1b8t s VAL 23 N -1.29 1.62 -0.11 3.70 1.01 -0.14 -4.79 120.40 120.40 1b8t s VAL 23 Ca 0.26 -0.75 -0.03 0.00 0.00 0.00 0.00 61.98 61.47 1b8t s VAL 23 Cb -0.12 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 1b8t s VAL 23 CO 0.18 0.39 -0.01 0.00 0.00 0.00 0.00 175.10 175.66 1b8t s GLN 24 N 1.45 3.22 -0.02 2.72 -2.07 -1.26 0.20 119.66 123.91 1b8t s GLN 24 Ca 0.03 -0.44 -0.04 0.00 -1.82 0.00 0.00 55.36 53.08 1b8t s GLN 24 Cb -0.14 -2.84 0.00 0.00 -1.09 0.00 0.00 33.01 28.95 1b8t s GLN 24 CO -0.10 0.54 0.10 0.00 -1.32 0.00 0.00 175.29 174.51 1b8t n GLU 26 N 2.22 0.00 0.00 0.00 0.28 -1.26 -0.52 120.64 121.36 1b8t n GLU 26 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.82 1b8t n GLU 26 Cb 0.57 -1.45 0.00 0.00 1.43 0.00 0.00 31.44 31.99 1b8t n GLU 26 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1b8t n GLY 27 N 5.07 3.23 3.79 -1.84 0.00 -1.26 -4.93 105.19 109.25 1b8t n GLY 27 Ca 0.38 -0.92 -0.03 0.00 0.00 0.00 0.00 46.02 45.45 1b8t n GLY 27 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1b8t s SER 28 N 0.00 -0.11 -0.04 1.61 0.01 0.32 -5.16 113.70 110.33 1b8t s SER 28 Ca 0.00 -0.52 0.05 0.00 1.31 0.00 0.00 55.95 56.78 1b8t s SER 28 Cb 0.00 0.50 -0.00 0.00 0.21 0.00 0.00 66.02 66.73 1b8t s SER 28 CO 0.00 -0.96 -0.18 -0.94 0.41 0.00 0.00 173.24 171.58 1b8t s SER 29 N -3.10 2.22 0.25 2.44 1.04 -1.26 -1.19 113.70 114.11 1b8t s SER 29 Ca 0.15 -0.36 0.06 0.00 0.48 0.00 0.00 55.95 56.28 1b8t s SER 29 Cb -0.02 -0.59 -0.05 0.00 0.10 0.00 0.00 66.02 65.46 1b8t s SER 29 CO 0.04 0.17 -0.07 -0.36 0.98 0.00 0.00 173.24 173.99 1b8t s PHE 30 N -0.01 1.79 0.47 5.02 0.08 0.13 -3.26 117.98 122.20 1b8t s PHE 30 Ca -0.03 -0.71 -0.25 0.00 0.12 0.00 0.00 56.93 56.07 1b8t s PHE 30 Cb -0.11 -0.97 -0.08 0.00 -0.57 0.00 0.00 43.02 41.29 1b8t s PHE 30 CO 0.02 0.24 1.40 -1.01 -0.10 0.00 0.00 175.22 175.77 1b8t s HIS 31 N -3.09 2.45 0.19 0.36 3.76 -1.26 -0.97 115.29 116.74 1b8t s HIS 31 Ca 0.27 1.30 -0.23 0.00 -0.15 0.00 0.00 55.06 56.25 1b8t s HIS 31 Cb 0.03 -3.87 0.11 0.00 1.11 0.00 0.00 32.58 29.96 1b8t s HIS 31 CO 0.09 -2.86 1.56 -0.22 -0.85 0.00 0.00 174.74 172.47 1b8t h LYS 32 N 2.16 -0.09 -0.50 1.40 3.64 -1.74 1.66 116.57 123.09 1b8t h LYS 32 Ca -0.51 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 58.84 1b8t h LYS 32 Cb 1.27 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.09 1b8t h LYS 32 CO 0.60 -0.06 0.15 1.03 -2.27 0.00 0.00 179.45 178.91 1b8t h SER 33 N -0.09 0.69 -0.36 4.20 0.87 -1.90 -2.25 113.55 114.71 1b8t h SER 33 Ca 0.25 -0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.70 1b8t h SER 33 Cb 0.55 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.32 1b8t h SER 33 CO -0.85 0.66 0.18 0.00 -0.53 0.00 0.00 176.83 176.30 1b8t s PHE 35 N -5.78 1.51 -0.01 0.00 2.19 0.48 -4.84 117.98 111.53 1b8t s PHE 35 Ca -0.13 1.52 0.02 0.00 0.33 0.00 0.00 56.93 58.67 1b8t s PHE 35 Cb 0.10 -3.62 -0.00 0.00 -1.31 0.00 0.00 43.02 38.18 1b8t s PHE 35 CO 0.73 -0.99 -0.07 -1.17 1.83 0.00 0.00 175.22 175.56 1b8t s LEU 36 N 14.31 1.99 -0.28 6.12 0.20 -1.26 -1.55 118.68 138.21 1b8t s LEU 36 Ca 0.77 -0.12 -0.36 0.00 0.69 0.00 0.00 54.13 55.11 1b8t s LEU 36 Cb -0.04 -0.35 -0.12 0.00 -0.43 0.00 0.00 46.19 45.24 1b8t s LEU 36 CO 0.15 0.08 2.05 0.00 -0.29 0.00 0.00 176.35 178.34 1b8t n MET 38 N 7.43 0.94 -0.00 0.00 2.81 -0.49 -0.21 117.12 127.59 1b8t n MET 38 Ca 0.35 0.00 -0.00 0.00 -1.81 0.00 0.00 57.70 56.23 1b8t n MET 38 Cb 0.23 -1.05 -0.00 0.00 -0.71 0.00 0.00 33.22 31.69 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 -0.45 0.09 0.12 2.03 0.31 -1.26 -4.72 118.33 114.45 1b8t n VAL 39 Ca 0.00 0.32 -0.01 0.00 -0.01 0.00 0.00 64.34 64.64 1b8t n VAL 39 Cb 0.02 -1.37 0.04 0.00 -0.91 0.00 0.00 33.84 31.62 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 -3.37 0.00 -3.78 0.00 0.00 0.70 -5.05 118.16 106.66 1b8t n LYS 41 Ca 0.01 0.14 -0.36 0.00 0.00 0.00 0.00 58.31 58.10 1b8t n LYS 41 Cb 0.76 -2.33 -0.10 0.00 0.00 0.00 0.00 35.03 33.37 1b8t n LYS 41 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1b8t s LYS 42 N -2.14 3.96 0.62 1.64 2.20 -1.18 -4.80 119.74 120.04 1b8t s LYS 42 Ca 0.00 -0.33 -0.19 0.00 -0.36 0.00 0.00 55.97 55.09 1b8t s LYS 42 Cb 0.00 -3.41 -0.02 0.00 -1.51 0.00 0.00 37.83 32.89 1b8t s LYS 42 CO 0.00 0.07 1.29 -1.71 -0.36 0.00 0.00 175.35 174.64 1b8t n ASN 43 N 4.21 2.16 -4.37 1.43 5.15 -1.26 0.10 115.26 122.68 1b8t n ASN 43 Ca -0.16 0.87 -0.19 0.00 -0.60 0.00 0.00 54.58 54.51 1b8t n ASN 43 Cb 0.52 -1.55 -0.10 0.00 -0.53 0.00 0.00 39.78 38.12 1b8t n ASN 43 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1b8t s LEU 44 N -3.93 2.37 0.00 1.20 1.43 -0.60 -4.75 118.68 114.41 1b8t s LEU 44 Ca 0.79 -1.18 0.00 0.00 -1.03 0.00 0.00 54.13 52.72 1b8t s LEU 44 Cb -0.39 -0.47 0.00 0.00 0.03 0.00 0.00 46.19 45.36 1b8t s LEU 44 CO 0.43 -0.40 0.00 0.47 0.23 0.00 0.00 176.35 177.08 1b8t n ASP 45 N -0.47 0.00 0.00 2.29 8.00 -1.26 -4.74 116.55 120.36 1b8t n ASP 45 Ca -0.06 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.44 1b8t n ASP 45 Cb 0.63 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.73 1b8t n ASP 45 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1b8t n SER 46 N -1.06 0.00 0.11 -2.24 2.88 -1.26 -4.99 113.62 107.07 1b8t n SER 46 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1b8t n SER 46 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1b8t n SER 46 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1b8t n THR 47 N 0.00 0.00 -2.70 2.46 -2.24 -1.26 -4.99 114.28 105.55 1b8t n THR 47 Ca 0.00 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.71 1b8t n THR 47 Cb 0.00 -0.07 0.05 0.00 -2.10 0.00 0.00 70.33 68.21 1b8t n THR 47 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1b8t n THR 48 N -2.98 0.85 -3.94 4.28 5.66 -1.26 -5.11 114.28 111.79 1b8t n THR 48 Ca 0.00 -2.69 -0.31 0.00 -3.05 0.00 0.00 64.05 58.00 1b8t n THR 48 Cb 0.00 0.86 -0.04 0.00 -1.55 0.00 0.00 70.33 69.60 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 -2.61 5.25 0.29 1.08 0.11 -1.26 -1.11 120.40 122.15 1b8t s VAL 49 Ca 0.25 -0.46 0.07 0.00 -2.93 0.00 0.00 61.98 58.92 1b8t s VAL 49 Cb 0.42 -3.56 -0.06 0.00 -1.53 0.00 0.00 36.38 31.65 1b8t s VAL 49 CO -0.00 0.13 -0.07 0.00 -3.33 0.00 0.00 175.10 171.82 1b8t s ALA 50 N -1.50 2.47 0.25 1.54 0.00 0.66 -4.80 121.76 120.38 1b8t s ALA 50 Ca 0.34 -1.93 0.12 0.00 0.00 0.00 0.00 51.96 50.49 1b8t s ALA 50 Cb -0.13 0.11 -0.05 0.00 0.00 0.00 0.00 23.12 23.06 1b8t s ALA 50 CO 0.27 -0.02 -0.21 0.08 0.00 0.00 0.00 175.76 175.88 1b8t s VAL 51 N -2.91 2.41 -0.25 0.00 1.01 -1.26 -1.51 120.40 117.88 1b8t s VAL 51 Ca 0.30 -2.31 -0.03 0.00 0.00 0.00 0.00 61.98 59.95 1b8t s VAL 51 Cb 0.03 -2.24 0.14 0.00 0.00 0.00 0.00 36.38 34.31 1b8t s VAL 51 CO 0.13 -0.34 0.43 -2.28 0.00 0.00 0.00 175.10 173.03 1b8t s HIS 52 N -2.33 -0.99 0.00 5.22 5.65 -0.36 -4.91 115.29 117.57 1b8t s HIS 52 Ca 0.27 1.05 0.00 0.00 0.25 0.00 0.00 55.06 56.63 1b8t s HIS 52 Cb -0.05 0.15 0.00 0.00 -1.18 0.00 0.00 32.58 31.49 1b8t s HIS 52 CO 0.13 -0.74 0.00 0.41 -0.65 0.00 0.00 174.74 173.89 1b8t n GLY 53 N 5.38 0.43 2.45 1.59 0.00 -1.26 0.24 105.19 114.02 1b8t n GLY 53 Ca -0.03 0.70 -0.19 0.00 0.00 0.00 0.00 46.02 46.49 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 5.30 3.68 -3.89 1.61 10.43 -1.26 -5.04 116.55 127.37 1b8t n ASP 54 Ca 0.00 -3.30 -0.09 0.00 2.57 0.00 0.00 54.79 53.96 1b8t n ASP 54 Cb 0.00 -0.45 -0.05 0.00 1.84 0.00 0.00 41.12 42.46 1b8t n ASP 54 CO 0.00 0.00 0.00 -0.70 -1.07 0.00 0.00 177.20 175.43 1b8t s GLU 55 N -3.50 1.37 -0.02 -1.24 2.12 0.14 -5.12 118.70 112.45 1b8t s GLU 55 Ca 0.42 -1.09 0.05 0.00 0.36 0.00 0.00 54.97 54.71 1b8t s GLU 55 Cb 0.41 0.46 -0.01 0.00 0.26 0.00 0.00 34.13 35.25 1b8t s GLU 55 CO -0.07 -0.56 -0.18 0.96 -0.54 0.00 0.00 175.26 174.88 1b8t s ILE 56 N -3.95 1.42 -0.04 -3.70 -4.36 -1.26 -1.23 121.20 108.08 1b8t s ILE 56 Ca 0.16 -0.75 -0.04 0.00 -0.26 0.00 0.00 60.65 59.76 1b8t s ILE 56 Cb 0.00 -1.19 0.01 0.00 1.25 0.00 0.00 42.46 42.53 1b8t s ILE 56 CO 0.02 0.40 0.12 -0.31 0.24 0.00 0.00 174.94 175.41 1b8t s TYR 57 N -0.26 -0.10 0.22 1.37 2.02 -0.57 -1.39 117.35 118.64 1b8t s TYR 57 Ca 0.03 0.25 -0.30 0.00 -0.37 0.00 0.00 57.07 56.69 1b8t s TYR 57 Cb -0.08 0.03 -0.09 0.00 -0.40 0.00 0.00 41.96 41.42 1b8t s TYR 57 CO 0.00 -0.09 1.15 0.00 -1.57 0.00 0.00 175.55 175.05 1b8t n LYS 59 N 1.93 -0.33 -0.25 0.00 4.76 -0.26 0.39 118.16 124.39 1b8t n LYS 59 Ca 0.02 1.38 0.01 0.00 -2.87 0.00 0.00 58.31 56.85 1b8t n LYS 59 Cb 0.45 -2.03 0.06 0.00 -1.84 0.00 0.00 35.03 31.66 1b8t n LYS 59 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1b8t n SER 60 N -4.69 -0.35 0.35 4.39 2.88 -1.26 0.17 113.62 115.10 1b8t n SER 60 Ca 0.02 1.18 -0.18 0.00 -1.33 0.00 0.00 58.87 58.56 1b8t n SER 60 Cb 0.20 -0.31 -0.09 0.00 -0.75 0.00 0.00 64.21 63.26 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 -0.96 -0.99 0.00 0.00 0.05 0.31 1.29 116.97 116.68 1b8t h TYR 62 Ca -0.08 0.08 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 1b8t h TYR 62 Cb 0.78 0.54 -0.00 0.00 1.01 0.00 0.00 36.73 39.05 1b8t h TYR 62 CO -0.10 -0.39 -0.06 0.78 -1.05 0.00 0.00 178.16 177.33 1b8t h GLY 63 N -0.12 0.00 1.58 3.88 0.00 -0.14 -1.07 103.07 107.21 1b8t h GLY 63 Ca 0.26 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.36 1b8t h GLY 63 CO -0.76 0.00 -0.97 0.50 0.00 0.00 0.00 176.54 175.31 1b8t h LYS 64 N 0.00 0.37 0.30 4.80 1.57 0.58 0.45 116.57 124.64 1b8t h LYS 64 Ca -0.00 -0.42 -0.01 0.00 -1.87 0.00 0.00 60.65 58.35 1b8t h LYS 64 Cb 0.39 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1b8t h LYS 64 CO 0.01 1.10 -0.15 -0.22 -0.57 0.00 0.00 179.45 179.62 1b8t h LYS 65 N 0.20 -0.39 -0.12 3.15 1.63 0.64 -3.36 116.57 118.32 1b8t h LYS 65 Ca -0.08 0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.73 1b8t h LYS 65 Cb 1.61 0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 33.33 1b8t h LYS 65 CO 0.16 -0.26 0.03 1.88 -3.45 0.00 0.00 179.45 177.81 1b8t h TYR 66 N -1.05 0.20 0.00 1.91 0.05 -1.35 -3.42 116.97 113.31 1b8t h TYR 66 Ca -0.04 -0.02 -0.42 0.00 0.05 0.00 0.00 58.73 58.29 1b8t h TYR 66 Cb 0.31 -0.06 -0.08 0.00 1.01 0.00 0.00 36.73 37.91 1b8t h TYR 66 CO 0.00 0.36 1.59 0.41 -1.05 0.00 0.00 178.16 179.47 1b8t n GLY 67 N -0.49 -0.43 3.76 3.88 0.00 0.16 -4.85 105.19 107.22 1b8t n GLY 67 Ca -0.06 0.86 -0.30 0.00 0.00 0.00 0.00 46.02 46.52 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 7.63 -0.59 0.31 1.61 0.04 -1.26 -4.87 135.00 137.88 1b8t s PRO 68 Ca 1.19 -0.36 0.04 0.00 0.04 0.00 0.00 61.00 61.91 1b8t s PRO 68 Cb -1.05 -1.70 -0.03 0.00 0.04 0.00 0.00 34.50 31.76 1b8t s PRO 68 CO 0.44 -3.24 0.19 0.21 0.04 0.00 0.00 177.00 174.64 1b8t s LYS 69 N -5.74 1.64 0.00 4.56 2.20 -1.26 -5.17 119.74 115.97 1b8t s LYS 69 Ca 0.74 -1.95 0.00 0.00 -0.36 0.00 0.00 55.97 54.41 1b8t s LYS 69 Cb -0.05 0.02 0.00 0.00 -1.51 0.00 0.00 37.83 36.29 1b8t s LYS 69 CO 0.55 -0.51 0.00 0.41 -0.36 0.00 0.00 175.35 175.43 1b8t n GLY 70 N -0.60 3.49 3.85 5.54 0.00 -1.26 -5.19 105.19 111.02 1b8t n GLY 70 Ca 0.02 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.70 1b8t n GLY 70 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1b8t s LYS 71 N -1.29 0.73 0.12 1.61 -2.85 -1.26 -5.19 119.74 111.60 1b8t s LYS 71 Ca 0.00 -0.45 -0.24 0.00 -1.00 0.00 0.00 55.97 54.28 1b8t s LYS 71 Cb 0.00 0.21 0.08 0.00 -2.06 0.00 0.00 37.83 36.07 1b8t s LYS 71 CO 0.00 -0.34 1.11 0.20 0.10 0.00 0.00 175.35 176.42 1b8t s GLY 72 N -3.41 -0.01 0.01 0.59 0.00 -1.26 -5.19 107.32 98.04 1b8t s GLY 72 Ca 0.22 -0.13 -0.28 0.00 0.00 0.00 0.00 44.72 44.53 1b8t s GLY 72 CO 0.01 2.82 1.25 -1.59 0.00 0.00 0.00 173.10 175.59 1b8t s LYS 73 N -2.24 0.51 0.00 2.90 0.00 -1.26 -5.19 119.74 114.46 1b8t s LYS 73 Ca 0.22 -0.32 0.00 0.00 0.00 0.00 0.00 55.97 55.87 1b8t s LYS 73 Cb -0.01 0.15 0.00 0.00 0.00 0.00 0.00 37.83 37.97 1b8t s LYS 73 CO 0.03 -0.24 0.00 0.41 0.00 0.00 0.00 175.35 175.55 1b8t n GLY 74 N -0.75 3.37 3.59 0.59 0.00 -1.26 -5.19 105.19 105.54 1b8t n GLY 74 Ca -0.01 -0.76 0.04 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.04 0.06 0.00 1.61 0.23 -1.26 -5.19 119.30 112.71 1b8t s MET 75 Ca 0.00 -0.03 0.00 0.00 -1.03 0.00 0.00 55.69 54.63 1b8t s MET 75 Cb 0.00 0.02 0.00 0.00 -1.53 0.00 0.00 34.83 33.32 1b8t s MET 75 CO 0.00 -0.03 0.00 0.41 -2.03 0.00 0.00 175.02 173.37 1b8t n GLY 76 N -0.53 2.71 3.81 3.16 0.00 -1.26 -5.19 105.19 107.89 1b8t n GLY 76 Ca -0.09 -0.94 0.03 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.42 -0.13 4.61 0.00 -1.26 -5.19 121.76 115.37 1b8t s ALA 77 Ca 0.00 0.38 -0.32 0.00 0.00 0.00 0.00 51.96 52.02 1b8t s ALA 77 Cb 0.00 0.63 0.13 0.00 0.00 0.00 0.00 23.12 23.88 1b8t s ALA 77 CO 0.00 -1.11 1.09 0.20 0.00 0.00 0.00 175.76 175.94 1b8t s GLY 78 N -3.44 -0.34 0.38 0.00 0.00 -1.26 -5.19 107.32 97.48 1b8t s GLY 78 Ca 0.23 1.47 0.04 0.00 0.00 0.00 0.00 44.72 46.46 1b8t s GLY 78 CO -0.03 0.52 0.16 -0.51 0.00 0.00 0.00 173.10 173.24 1b8t s THR 79 N -2.53 0.45 0.31 0.90 -4.23 -1.26 -5.17 115.64 104.12 1b8t s THR 79 Ca 0.07 -2.00 -0.19 0.00 -1.18 0.00 0.00 61.69 58.39 1b8t s THR 79 Cb -0.01 -2.39 0.05 0.00 1.34 0.00 0.00 72.50 71.49 1b8t s THR 79 CO -0.06 0.00 0.83 -0.76 -0.54 0.00 0.00 174.62 174.09 1b8t s LEU 80 N -3.54 -0.06 0.11 4.79 1.43 -1.26 -5.19 118.68 114.96 1b8t s LEU 80 Ca 0.28 -0.90 -0.26 0.00 -1.03 0.00 0.00 54.13 52.22 1b8t s LEU 80 Cb 0.03 2.64 0.08 0.00 0.03 0.00 0.00 46.19 48.96 1b8t s LEU 80 CO 0.17 -1.44 1.02 -0.55 0.23 0.00 0.00 176.35 175.78 1b8t s SER 81 N -3.09 -0.16 -0.05 2.29 0.15 -1.26 -5.19 113.70 106.39 1b8t s SER 81 Ca 0.15 -0.34 -0.31 0.00 0.70 0.00 0.00 55.95 56.16 1b8t s SER 81 Cb -0.05 0.42 0.11 0.00 -1.71 0.00 0.00 66.02 64.80 1b8t s SER 81 CO 0.09 -0.78 1.13 0.28 1.20 0.00 0.00 173.24 175.16 1b8t s THR 82 N -3.12 0.00 0.01 6.45 -1.32 -1.26 -5.19 115.64 111.22 1b8t s THR 82 Ca 0.12 -0.17 -0.29 0.00 -1.21 0.00 0.00 61.69 60.14 1b8t s THR 82 Cb -0.00 -1.44 0.10 0.00 -1.51 0.00 0.00 72.50 69.65 1b8t s THR 82 CO 0.01 0.00 1.09 1.51 -2.21 0.00 0.00 174.62 175.02 1b8t s ASP 83 N -2.59 -0.17 -0.04 8.08 3.84 -1.26 -5.19 116.67 119.35 1b8t s ASP 83 Ca 0.10 -0.17 -0.30 0.00 -0.00 0.00 0.00 52.55 52.18 1b8t s ASP 83 Cb 0.01 0.31 0.12 0.00 -1.38 0.00 0.00 42.92 41.97 1b8t s ASP 83 CO -0.04 -0.55 1.33 -0.75 -0.00 0.00 0.00 175.17 175.16 1b8t s LYS 84 N -2.84 0.28 0.00 2.11 2.20 -1.26 -5.19 119.74 115.04 1b8t s LYS 84 Ca 0.11 -0.17 -0.28 0.00 -0.36 0.00 0.00 55.97 55.27 1b8t s LYS 84 Cb 0.01 0.09 0.10 0.00 -1.51 0.00 0.00 37.83 36.51 1b8t s LYS 84 CO -0.03 -0.13 1.26 0.20 -0.36 0.00 0.00 175.35 176.29 1b8t s GLY 85 N -3.37 -0.16 -0.05 5.54 0.00 -1.26 -5.19 107.32 102.83 1b8t s GLY 85 Ca 0.21 0.12 -0.32 0.00 0.00 0.00 0.00 44.72 44.74 1b8t s GLY 85 CO -0.03 4.27 1.36 -1.83 0.00 0.00 0.00 173.10 176.87 1b8t s GLU 86 N -2.11 0.22 -0.28 2.90 4.04 -1.26 -5.19 118.70 117.02 1b8t s GLU 86 Ca 0.26 -0.12 -0.30 0.00 0.04 0.00 0.00 54.97 54.84 1b8t s GLU 86 Cb 0.00 0.07 0.19 0.00 0.02 0.00 0.00 34.13 34.41 1b8t s GLU 86 CO -0.01 -0.10 1.34 0.45 -1.84 0.00 0.00 175.26 175.11 1b8t s SER 87 N -2.99 -0.05 -0.01 0.83 0.15 -1.26 -5.19 113.70 105.18 1b8t s SER 87 Ca 0.15 0.05 -0.30 0.00 0.70 0.00 0.00 55.95 56.54 1b8t s SER 87 Cb 0.06 0.04 0.11 0.00 -1.71 0.00 0.00 66.02 64.53 1b8t s SER 87 CO -0.05 -0.05 1.21 -1.48 1.20 0.00 0.00 173.24 174.07 1b8t s LEU 88 N -1.16 -0.10 0.00 3.45 2.34 -1.26 -5.19 118.68 116.77 1b8t s LEU 88 Ca 0.09 -0.16 0.00 0.00 0.06 0.00 0.00 54.13 54.12 1b8t s LEU 88 Cb -0.01 1.53 0.00 0.00 -0.56 0.00 0.00 46.19 47.15 1b8t s LEU 88 CO -0.07 -0.40 0.00 0.61 -1.06 0.00 0.00 176.35 175.43 1b8t n GLY 89 N -0.43 2.82 3.38 -3.48 0.00 -1.26 -5.19 105.19 101.04 1b8t n GLY 89 Ca -0.07 -0.44 -0.21 0.00 0.00 0.00 0.00 46.02 45.30 1b8t n GLY 89 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1b8t s ILE 90 N -1.92 0.39 -0.18 -0.61 -5.25 -1.26 -5.17 121.20 107.19 1b8t s ILE 90 Ca 0.00 -2.00 -0.35 0.00 -0.99 0.00 0.00 60.65 57.31 1b8t s ILE 90 Cb 0.00 -2.48 0.14 0.00 2.95 0.00 0.00 42.46 43.08 1b8t s ILE 90 CO 0.00 0.00 1.31 -0.75 -1.79 0.00 0.00 174.94 173.71 1b8t s LYS 91 N -3.74 0.20 -0.03 0.37 2.20 -1.26 -5.19 119.74 112.29 1b8t s LYS 91 Ca 0.33 -0.09 -0.31 0.00 -0.36 0.00 0.00 55.97 55.55 1b8t s LYS 91 Cb 0.04 0.08 0.12 0.00 -1.51 0.00 0.00 37.83 36.56 1b8t s LYS 91 CO 0.18 -0.09 1.19 1.52 -0.36 0.00 0.00 175.35 177.79 1b8t s TYR 92 N -2.25 -0.10 -0.28 4.03 1.13 -1.26 -5.19 117.35 113.43 1b8t s TYR 92 Ca 0.12 -0.02 -0.35 0.00 -1.41 0.00 0.00 57.07 55.40 1b8t s TYR 92 Cb 0.01 0.55 0.17 0.00 -1.10 0.00 0.00 41.96 41.59 1b8t s TYR 92 CO -0.04 -0.36 1.36 -2.00 -2.51 0.00 0.00 175.55 172.00 1b8t s GLU 93 N -2.60 0.06 -0.15 -3.49 2.12 -1.26 -5.19 118.70 108.19 1b8t s GLU 93 Ca 0.12 -0.01 -0.34 0.00 0.36 0.00 0.00 54.97 55.09 1b8t s GLU 93 Cb 0.02 0.03 0.15 0.00 0.26 0.00 0.00 34.13 34.59 1b8t s GLU 93 CO -0.03 -0.03 1.37 -1.83 -0.54 0.00 0.00 175.26 174.20 1b8t s GLU 94 N -1.74 0.13 0.00 4.30 4.04 -1.26 -5.19 118.70 118.98 1b8t s GLU 94 Ca 0.11 -0.06 0.00 0.00 0.04 0.00 0.00 54.97 55.05 1b8t s GLU 94 Cb -0.01 0.05 0.00 0.00 0.02 0.00 0.00 34.13 34.19 1b8t s GLU 94 CO -0.04 -0.06 0.00 0.41 -1.84 0.00 0.00 175.26 173.73 1b8t n GLY 95 N -0.30 2.25 3.58 -3.83 0.00 -1.26 -5.19 105.19 100.44 1b8t n GLY 95 Ca -0.04 -0.68 0.02 0.00 0.00 0.00 0.00 46.02 45.33 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 0.09 -0.09 1.61 -2.07 -1.26 -5.19 119.66 110.75 1b8t s GLN 96 Ca 0.00 -0.05 -0.33 0.00 -1.82 0.00 0.00 55.36 53.16 1b8t s GLN 96 Cb 0.00 0.03 0.15 0.00 -1.09 0.00 0.00 33.01 32.10 1b8t s GLN 96 CO 0.00 -0.04 1.43 0.45 -1.32 0.00 0.00 175.29 175.81 1b8t s SER 97 N -2.81 -0.01 0.15 12.60 0.15 -1.26 -5.19 113.70 117.32 1b8t s SER 97 Ca 0.14 -0.02 -0.24 0.00 0.70 0.00 0.00 55.95 56.53 1b8t s SER 97 Cb 0.06 0.02 0.08 0.00 -1.71 0.00 0.00 66.02 64.46 1b8t s SER 97 CO -0.06 -0.04 1.04 -1.00 1.20 0.00 0.00 173.24 174.39 1b8t s HIS 98 N -2.05 -0.02 -0.32 3.44 3.76 -1.26 -5.14 115.29 113.69 1b8t s HIS 98 Ca 0.15 -0.30 -0.06 0.00 -0.15 0.00 0.00 55.06 54.70 1b8t s HIS 98 Cb 0.07 0.66 0.19 0.00 1.11 0.00 0.00 32.58 34.61 1b8t s HIS 98 CO -0.07 -0.80 0.95 0.50 -0.85 0.00 0.00 174.74 174.48 1b8t s ARG 99 N -2.65 0.28 1.12 1.40 3.52 -1.26 -5.17 118.95 116.20 1b8t s ARG 99 Ca 0.17 0.06 -0.19 0.00 -0.13 0.00 0.00 55.73 55.64 1b8t s ARG 99 Cb -0.01 0.07 0.27 0.00 -1.56 0.00 0.00 34.95 33.72 1b8t s ARG 99 CO 0.03 -0.46 1.24 -0.35 -0.81 0.00 0.00 175.30 174.95 1b8t n PRO 100 N 4.53 -2.24 -3.54 5.12 -0.04 -1.26 -5.10 135.00 132.47 1b8t n PRO 100 Ca 0.08 -1.94 -0.07 0.00 -0.04 0.00 0.00 63.50 61.53 1b8t n PRO 100 Cb 0.59 -1.53 -0.02 0.00 -0.04 0.00 0.00 33.50 32.50 1b8t n PRO 100 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1b8t s THR 101 N -3.50 0.00 -0.29 0.52 -1.32 -1.26 -5.17 115.64 104.61 1b8t s THR 101 Ca 0.75 -0.00 -0.17 0.00 -1.21 0.00 0.00 61.69 61.05 1b8t s THR 101 Cb -0.04 -1.01 0.15 0.00 -1.51 0.00 0.00 72.50 70.09 1b8t s THR 101 CO 0.55 0.00 1.01 0.21 -2.21 0.00 0.00 174.62 174.18 1b8t s ASN 102 N -2.36 -0.46 1.12 8.08 3.84 -1.26 -5.18 114.94 118.72 1b8t s ASN 102 Ca 0.07 0.76 -0.19 0.00 0.21 0.00 0.00 52.86 53.71 1b8t s ASN 102 Cb -0.01 1.13 0.27 0.00 -0.55 0.00 0.00 41.25 42.08 1b8t s ASN 102 CO -0.07 -0.12 1.24 -2.16 -2.79 0.00 0.00 177.10 173.19 1b8t s PRO 103 N 1.15 -0.62 0.21 0.43 0.04 -1.26 -5.10 135.00 129.85 1b8t s PRO 103 Ca -0.07 -0.37 -0.15 0.00 0.04 0.00 0.00 61.00 60.45 1b8t s PRO 103 Cb -0.04 -1.70 0.01 0.00 0.04 0.00 0.00 34.50 32.82 1b8t s PRO 103 CO -0.14 -3.26 0.49 0.54 0.04 0.00 0.00 177.00 174.67 1b8t s ASN 104 N -4.50 -0.16 0.21 6.66 4.22 -1.26 -5.18 114.94 114.93 1b8t s ASN 104 Ca 0.75 -0.69 -0.22 0.00 -2.14 0.00 0.00 52.86 50.55 1b8t s ASN 104 Cb -0.05 0.57 0.06 0.00 1.28 0.00 0.00 41.25 43.12 1b8t s ASN 104 CO 0.55 -1.08 0.93 0.00 -2.04 0.00 0.00 177.10 175.45 1b8t s ALA 105 N -3.94 -1.45 -0.05 3.54 0.00 -1.26 -5.19 121.76 113.41 1b8t s ALA 105 Ca 0.15 -0.18 -0.31 0.00 0.00 0.00 0.00 51.96 51.61 1b8t s ALA 105 Cb -0.01 0.70 0.13 0.00 0.00 0.00 0.00 23.12 23.95 1b8t s ALA 105 CO 0.02 -1.04 1.36 0.45 0.00 0.00 0.00 175.76 176.55 1b8t s SER 106 N -3.09 -0.03 0.00 0.00 0.15 -1.26 -5.19 113.70 104.28 1b8t s SER 106 Ca 0.15 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.72 1b8t s SER 106 Cb -0.03 0.09 0.00 0.00 -1.71 0.00 0.00 66.02 64.37 1b8t s SER 106 CO 0.05 -0.17 0.00 -2.11 1.20 0.00 0.00 173.24 172.21 1b8t n ARG 107 N -0.51 0.00 -3.57 5.44 -4.01 -1.26 -5.19 116.66 107.55 1b8t n ARG 107 Ca -0.09 0.00 0.03 0.00 -1.04 0.00 0.00 57.85 56.75 1b8t n ARG 107 Cb 0.63 0.00 -0.00 0.00 -3.04 0.00 0.00 32.46 30.05 1b8t n ARG 107 CO 0.00 0.00 0.00 -1.64 -3.04 0.00 0.00 177.63 172.95 1b8t s MET 108 N -2.00 0.04 -0.03 2.89 -1.94 -1.26 -5.19 119.30 111.81 1b8t s MET 108 Ca 0.00 -0.02 -0.30 0.00 -1.71 0.00 0.00 55.69 53.66 1b8t s MET 108 Cb 0.00 0.01 0.12 0.00 2.01 0.00 0.00 34.83 36.97 1b8t s MET 108 CO 0.00 -0.02 1.32 0.00 -0.01 0.00 0.00 175.02 176.31 1b8t s ALA 109 N -2.05 -2.37 -0.04 3.03 0.00 -1.26 -5.19 121.76 113.89 1b8t s ALA 109 Ca 0.14 0.53 -0.31 0.00 0.00 0.00 0.00 51.96 52.32 1b8t s ALA 109 Cb 0.06 0.51 0.13 0.00 0.00 0.00 0.00 23.12 23.82 1b8t s ALA 109 CO -0.06 -1.09 1.33 1.14 0.00 0.00 0.00 175.76 177.08 1b8t s GLN 110 N -2.22 0.30 -0.23 0.00 -2.07 -1.26 -5.19 119.66 108.99 1b8t s GLN 110 Ca 0.19 -0.17 -0.33 0.00 -1.82 0.00 0.00 55.36 53.23 1b8t s GLN 110 Cb 0.04 0.10 0.16 0.00 -1.09 0.00 0.00 33.01 32.22 1b8t s GLN 110 CO -0.03 -0.14 1.26 0.21 -1.32 0.00 0.00 175.29 175.27 1b8t s LYS 111 N -2.32 0.22 0.10 9.60 2.20 -1.26 -5.19 119.74 123.09 1b8t s LYS 111 Ca 0.14 -0.03 -0.26 0.00 -0.36 0.00 0.00 55.97 55.46 1b8t s LYS 111 Cb 0.06 0.10 0.08 0.00 -1.51 0.00 0.00 37.83 36.55 1b8t s LYS 111 CO -0.05 -0.09 0.96 0.54 -0.36 0.00 0.00 175.35 176.36 1b8t s VAL 112 N -1.80 0.00 -0.05 4.02 0.11 -1.26 -5.19 120.40 116.23 1b8t s VAL 112 Ca 0.08 -0.47 -0.31 0.00 -2.93 0.00 0.00 61.98 58.35 1b8t s VAL 112 Cb -0.01 -1.74 0.13 0.00 -1.53 0.00 0.00 36.38 33.23 1b8t s VAL 112 CO -0.05 0.00 1.35 -0.83 -3.33 0.00 0.00 175.10 172.25 1b8t s GLY 113 N -2.83 -0.40 0.00 6.54 0.00 -1.26 -5.18 107.32 104.20 1b8t s GLY 113 Ca 0.11 0.67 0.00 0.00 0.00 0.00 0.00 44.72 45.49 1b8t s GLY 113 CO -0.01 1.42 0.00 0.61 0.00 0.00 0.00 173.10 175.12 1b8t n GLY 114 N -0.59 1.31 0.00 0.20 0.00 -1.26 -5.19 105.19 99.66 1b8t n GLY 114 Ca -0.06 0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1b8t n GLY 114 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1b8t n SER 115 N 0.00 0.00 0.00 1.61 3.41 -1.26 -4.98 113.62 112.40 1b8t n SER 115 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1b8t n SER 115 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1b8t n SER 115 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1b8t n ASP 116 N 0.00 0.00 -4.22 4.04 2.03 -0.59 -5.06 116.55 112.75 1b8t n ASP 116 Ca 0.00 0.00 -0.20 0.00 0.52 0.00 0.00 54.79 55.11 1b8t n ASP 116 Cb 0.00 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.30 1b8t n ASP 116 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1b8t s GLY 117 N -0.07 2.08 -0.43 0.27 0.00 -1.26 -0.13 107.32 107.78 1b8t s GLY 117 Ca 0.00 -1.76 -0.14 0.00 0.00 0.00 0.00 44.72 42.82 1b8t s GLY 117 CO 0.00 -1.69 0.32 0.00 0.00 0.00 0.00 173.10 171.73 1b8t n PRO 119 N 5.12 0.75 0.00 0.00 -0.04 -1.25 0.32 135.00 139.90 1b8t n PRO 119 Ca -0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 1b8t n PRO 119 Cb 0.45 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 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 -0.94 0.00 0.09 0.54 3.00 -1.26 -4.61 116.66 113.48 1b8t n ARG 120 Ca 0.16 0.14 -0.04 0.00 -0.00 0.00 0.00 57.85 58.10 1b8t n ARG 120 Cb 0.07 -0.62 -0.01 0.00 0.00 0.00 0.00 32.46 31.90 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 1.00 0.96 3.53 0.00 0.00 0.15 -5.08 105.19 105.75 1b8t n GLY 122 Ca -0.00 -0.38 -0.34 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.14 3.08 0.68 1.61 -1.52 -1.12 -4.81 119.66 116.44 1b8t s GLN 123 Ca 0.00 -0.56 -0.17 0.00 -1.95 0.00 0.00 55.36 52.68 1b8t s GLN 123 Cb 0.00 -2.68 -0.06 0.00 -0.22 0.00 0.00 33.01 30.05 1b8t s GLN 123 CO 0.00 0.49 0.46 0.00 -0.25 0.00 0.00 175.29 175.99 1b8t n ALA 124 N 2.74 -1.61 -3.73 6.09 0.00 -1.26 0.26 120.51 123.00 1b8t n ALA 124 Ca -0.18 -0.19 -0.23 0.00 0.00 0.00 0.00 53.44 52.84 1b8t n ALA 124 Cb 0.53 -1.81 -0.17 0.00 0.00 0.00 0.00 19.45 18.00 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 -1.87 0.64 0.13 0.00 1.01 0.82 -4.56 120.40 116.56 1b8t s VAL 125 Ca 0.65 -0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.54 1b8t s VAL 125 Cb -0.37 -0.70 0.00 0.00 0.00 0.00 0.00 36.38 35.31 1b8t s VAL 125 CO 0.58 0.28 0.00 0.00 0.00 0.00 0.00 175.10 175.96 1b8t n TYR 126 N 4.66 -2.62 -3.86 5.22 9.36 -1.26 -1.54 117.16 127.13 1b8t n TYR 126 Ca -0.15 0.44 -0.35 0.00 3.32 0.00 0.00 57.90 61.16 1b8t n TYR 126 Cb 0.50 1.37 -0.14 0.00 -0.63 0.00 0.00 39.34 40.45 1b8t n TYR 126 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1b8t s ALA 127 N -2.00 2.92 0.39 2.98 0.00 -1.26 -4.84 121.76 119.95 1b8t s ALA 127 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 50.79 1b8t s ALA 127 Cb 0.00 -1.83 0.00 0.00 0.00 0.00 0.00 23.12 21.29 1b8t s ALA 127 CO 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 175.76 175.29 1b8t n ALA 128 N 4.83 -2.07 -2.78 0.00 0.00 -1.26 -4.84 120.51 114.39 1b8t n ALA 128 Ca -0.17 0.44 -0.10 0.00 0.00 0.00 0.00 53.44 53.60 1b8t n ALA 128 Cb 0.51 -1.38 0.05 0.00 0.00 0.00 0.00 19.45 18.63 1b8t n ALA 128 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1b8t n GLU 129 N 0.12 -2.88 -4.03 0.00 -0.58 -1.26 -5.00 120.64 107.00 1b8t n GLU 129 Ca 0.00 0.55 -0.31 0.00 -0.42 0.00 0.00 57.16 56.98 1b8t n GLU 129 Cb 0.00 -4.49 -0.16 0.00 -0.57 0.00 0.00 31.44 26.23 1b8t n GLU 129 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 1b8t s LYS 130 N -4.39 2.19 0.05 3.49 0.00 -1.26 -3.93 119.74 115.89 1b8t s LYS 130 Ca 0.15 -1.06 0.04 0.00 0.00 0.00 0.00 55.97 55.09 1b8t s LYS 130 Cb -0.02 -2.65 -0.02 0.00 0.00 0.00 0.00 37.83 35.14 1b8t s LYS 130 CO 0.47 -0.48 -0.11 0.54 0.00 0.00 0.00 175.35 175.78 1b8t s VAL 131 N 1.26 0.83 -0.17 1.79 0.11 0.50 -4.72 120.40 120.00 1b8t s VAL 131 Ca -0.04 -1.08 -0.00 0.00 -2.93 0.00 0.00 61.98 57.93 1b8t s VAL 131 Cb -0.18 -0.82 0.04 0.00 -1.53 0.00 0.00 36.38 33.89 1b8t s VAL 131 CO -0.07 -0.22 -0.06 -0.63 -3.33 0.00 0.00 175.10 170.79 1b8t s ILE 132 N -1.15 1.17 0.00 7.04 1.09 -1.26 -0.93 121.20 127.17 1b8t s ILE 132 Ca -0.04 -0.68 -0.07 0.00 -1.10 0.00 0.00 60.65 58.76 1b8t s ILE 132 Cb -0.09 -1.34 0.00 0.00 -1.06 0.00 0.00 42.46 39.97 1b8t s ILE 132 CO 0.01 0.13 0.13 -0.83 -0.10 0.00 0.00 174.94 174.29 1b8t s GLY 133 N 1.60 0.05 -1.41 6.18 0.00 0.13 -4.89 107.32 108.99 1b8t s GLY 133 Ca 0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 44.72 44.56 1b8t s GLY 133 CO -0.08 -0.28 0.51 0.00 0.00 0.00 0.00 173.10 173.25 1b8t n ALA 134 N 1.45 -1.94 -3.56 3.20 0.00 -1.26 0.23 120.51 118.63 1b8t n ALA 134 Ca -0.23 -0.22 -0.26 0.00 0.00 0.00 0.00 53.44 52.73 1b8t n ALA 134 Cb 0.55 -1.79 -0.01 0.00 0.00 0.00 0.00 19.45 18.21 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 -1.86 -0.48 3.16 0.00 0.00 -1.26 -4.71 105.19 100.04 1b8t n GLY 135 Ca -0.27 0.10 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 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 -6.22 0.88 -0.02 1.61 1.02 0.14 -5.13 119.74 112.01 1b8t s LYS 136 Ca 0.48 -1.33 0.06 0.00 0.02 0.00 0.00 55.97 55.21 1b8t s LYS 136 Cb -0.26 0.26 -0.02 0.00 -0.52 0.00 0.00 37.83 37.30 1b8t s LYS 136 CO 0.59 -0.25 -0.21 -1.54 -0.92 0.00 0.00 175.35 173.03 1b8t s SER 137 N -3.00 2.45 0.26 2.83 1.04 -1.26 0.22 113.70 116.24 1b8t s SER 137 Ca 0.18 -0.38 -0.21 0.00 0.48 0.00 0.00 55.95 56.03 1b8t s SER 137 Cb 0.07 -0.31 0.05 0.00 0.10 0.00 0.00 66.02 65.93 1b8t s SER 137 CO -0.02 0.25 0.87 -1.66 0.98 0.00 0.00 173.24 173.66 1b8t s TRP 138 N -0.45 -0.02 -0.17 5.02 -2.14 -0.10 -3.93 118.94 117.15 1b8t s TRP 138 Ca 0.07 -0.46 -0.29 0.00 2.66 0.00 0.00 56.10 58.07 1b8t s TRP 138 Cb -0.08 0.73 -0.01 0.00 -3.10 0.00 0.00 33.47 31.01 1b8t s TRP 138 CO -0.00 -1.18 1.12 -1.01 -2.66 0.00 0.00 176.95 173.22 1b8t s HIS 139 N -2.85 3.20 0.62 1.66 3.76 -1.25 -0.37 115.29 120.05 1b8t s HIS 139 Ca 0.15 1.32 0.25 0.00 -0.15 0.00 0.00 55.06 56.64 1b8t s HIS 139 Cb -0.04 -3.34 1.21 0.00 1.11 0.00 0.00 32.58 31.51 1b8t s HIS 139 CO 0.07 -0.90 1.65 -0.22 -0.85 0.00 0.00 174.74 174.49 1b8t h LYS 140 N 7.62 0.00 0.32 1.40 3.64 -1.85 1.11 116.57 128.82 1b8t h LYS 140 Ca -0.25 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.12 1b8t h LYS 140 Cb 1.10 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 1b8t h LYS 140 CO 0.95 0.00 -0.15 1.03 -2.27 0.00 0.00 179.45 179.00 1b8t h SER 141 N 0.00 -0.37 -0.41 4.20 0.87 -1.88 -3.33 113.55 112.64 1b8t h SER 141 Ca 0.21 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.77 1b8t h SER 141 Cb 1.59 0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 63.63 1b8t h SER 141 CO -0.00 -0.04 0.19 0.00 -0.53 0.00 0.00 176.83 176.44 1b8t n PHE 143 N -4.67 0.76 -4.02 0.00 7.35 0.36 -4.85 117.46 112.39 1b8t n PHE 143 Ca 0.00 0.26 -0.08 0.00 -0.76 0.00 0.00 57.45 56.87 1b8t n PHE 143 Cb 0.12 -2.28 -0.10 0.00 0.35 0.00 0.00 39.48 37.57 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 8.63 0.53 0.07 -4.13 1.70 -1.26 -1.49 118.95 122.99 1b8t s ARG 144 Ca 1.24 -0.95 -0.35 0.00 -0.47 0.00 0.00 55.73 55.20 1b8t s ARG 144 Cb -0.89 0.19 -0.15 0.00 -0.57 0.00 0.00 34.95 33.54 1b8t s ARG 144 CO 0.42 -0.11 1.55 0.00 -1.08 0.00 0.00 175.30 176.08 1b8t n ALA 146 N 3.68 4.41 0.00 0.00 0.00 -0.54 -0.17 120.51 127.90 1b8t n ALA 146 Ca 0.19 -1.35 0.00 0.00 0.00 0.00 0.00 53.44 52.28 1b8t n ALA 146 Cb 0.24 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.43 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 0.15 0.00 -0.01 0.00 5.02 -1.26 -4.87 118.16 117.18 1b8t n LYS 147 Ca 0.26 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.59 1b8t n LYS 147 Cb 0.78 -0.26 -0.08 0.00 -0.02 0.00 0.00 35.03 35.44 1b8t n LYS 147 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1b8t n GLY 149 N 1.95 0.46 3.63 0.00 0.00 0.76 -5.01 105.19 106.99 1b8t n GLY 149 Ca -0.04 -0.92 -0.42 0.00 0.00 0.00 0.00 46.02 44.64 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 -1.68 4.08 0.34 1.61 2.47 -1.24 -4.63 119.74 120.69 1b8t s LYS 150 Ca 0.00 0.86 -0.28 0.00 -1.56 0.00 0.00 55.97 54.99 1b8t s LYS 150 Cb 0.00 -3.70 -0.12 0.00 -1.46 0.00 0.00 37.83 32.55 1b8t s LYS 150 CO 0.00 -0.67 1.30 -1.13 0.16 0.00 0.00 175.35 175.01 1b8t n SER 151 N 6.28 2.80 -3.15 1.43 3.41 -1.26 -0.29 113.62 122.83 1b8t n SER 151 Ca 0.07 1.21 -0.10 0.00 -0.26 0.00 0.00 58.87 59.78 1b8t n SER 151 Cb 0.48 -1.49 0.00 0.00 -0.26 0.00 0.00 64.21 62.94 1b8t n SER 151 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1b8t n LEU 152 N 0.75 0.00 0.00 1.04 4.77 -0.55 -4.82 117.00 118.19 1b8t n LEU 152 Ca 0.05 -1.14 0.00 0.00 -0.03 0.00 0.00 56.01 54.89 1b8t n LEU 152 Cb 0.36 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 1b8t n LEU 152 CO 0.62 -0.42 -0.07 -1.84 -1.33 0.00 0.00 177.39 174.36 1b8t n GLU 153 N -1.09 0.00 0.00 3.23 0.28 -1.26 -4.82 120.64 116.98 1b8t n GLU 153 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1b8t n GLU 153 Cb 0.25 -0.08 0.00 0.00 1.43 0.00 0.00 31.44 33.04 1b8t n GLU 153 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1b8t n SER 154 N -2.55 0.00 -4.89 -1.84 2.88 -1.26 -4.88 113.62 101.07 1b8t n SER 154 Ca 0.00 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.25 1b8t n SER 154 Cb 0.07 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.54 1b8t n SER 154 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1b8t s THR 155 N 0.00 4.78 -1.72 2.46 2.01 -1.26 -3.90 115.64 118.01 1b8t s THR 155 Ca 0.00 0.42 0.00 0.00 0.31 0.00 0.00 61.69 62.42 1b8t s THR 155 Cb 0.00 -3.85 0.00 0.00 0.01 0.00 0.00 72.50 68.66 1b8t s THR 155 CO 0.00 -0.94 0.00 0.41 -0.69 0.00 0.00 174.62 173.40 1b8t n THR 156 N -2.45 -0.47 -4.98 -0.82 -1.04 -1.26 -4.97 114.28 98.29 1b8t n THR 156 Ca 0.03 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.71 1b8t n THR 156 Cb 0.55 -2.26 -0.15 0.00 -1.82 0.00 0.00 70.33 66.65 1b8t n THR 156 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1b8t s LEU 157 N -4.70 2.47 0.02 -4.42 2.96 -1.25 -1.37 118.68 112.39 1b8t s LEU 157 Ca 0.00 -0.39 -0.11 0.00 -0.22 0.00 0.00 54.13 53.41 1b8t s LEU 157 Cb 0.00 -1.51 -0.05 0.00 0.50 0.00 0.00 46.19 45.12 1b8t s LEU 157 CO 0.00 0.21 0.36 0.00 -1.32 0.00 0.00 176.35 175.61 1b8t s ALA 158 N 0.05 3.74 -0.33 5.97 0.00 0.11 -4.82 121.76 126.48 1b8t s ALA 158 Ca -0.07 -0.37 0.00 0.00 0.00 0.00 0.00 51.96 51.52 1b8t s ALA 158 Cb -0.15 -2.26 0.10 0.00 0.00 0.00 0.00 23.12 20.81 1b8t s ALA 158 CO 0.05 0.55 0.11 0.16 0.00 0.00 0.00 175.76 176.63 1b8t s ASP 159 N -1.44 4.08 -1.27 0.00 -4.77 -1.26 -0.12 116.67 111.89 1b8t s ASP 159 Ca 0.27 -1.82 -0.15 0.00 -3.30 0.00 0.00 52.55 47.55 1b8t s ASP 159 Cb -0.15 -0.98 0.12 0.00 -1.09 0.00 0.00 42.92 40.82 1b8t s ASP 159 CO 0.15 -0.39 1.65 1.17 0.70 0.00 0.00 175.17 178.45 1b8t n LYS 160 N 4.62 3.28 0.00 2.11 0.00 0.14 -4.77 118.16 123.55 1b8t n LYS 160 Ca 0.00 -3.50 0.00 0.00 0.00 0.00 0.00 58.31 54.81 1b8t n LYS 160 Cb 0.41 -3.24 0.00 0.00 0.00 0.00 0.00 35.03 32.20 1b8t n LYS 160 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1b8t n ASP 161 N 6.66 0.00 -0.02 3.14 9.92 -1.26 -1.01 116.55 133.98 1b8t n ASP 161 Ca 0.43 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.68 1b8t n ASP 161 Cb 0.43 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.88 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 0.00 -0.20 3.83 0.44 0.00 -1.26 -4.67 105.19 103.33 1b8t n GLY 162 Ca 0.00 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.16 3.48 -0.01 1.61 8.01 -0.18 -4.97 118.70 124.49 1b8t s GLU 163 Ca -0.02 0.98 0.03 0.00 0.01 0.00 0.00 54.97 55.97 1b8t s GLU 163 Cb 0.02 -2.06 -0.01 0.00 -4.31 0.00 0.00 34.13 27.77 1b8t s GLU 163 CO 0.17 -0.67 -0.09 0.96 0.01 0.00 0.00 175.26 175.65 1b8t s ILE 164 N -2.79 0.69 0.16 -1.63 -4.36 -1.26 0.29 121.20 112.30 1b8t s ILE 164 Ca 0.59 -0.37 -0.01 0.00 -0.26 0.00 0.00 60.65 60.60 1b8t s ILE 164 Cb -0.13 -0.59 0.00 0.00 1.25 0.00 0.00 42.46 43.00 1b8t s ILE 164 CO 0.43 0.20 0.23 -1.22 0.24 0.00 0.00 174.94 174.82 1b8t n TYR 165 N 2.91 -0.92 -3.95 1.37 4.01 0.82 -1.46 117.16 119.95 1b8t n TYR 165 Ca -0.14 -1.07 -0.35 0.00 -0.16 0.00 0.00 57.90 56.18 1b8t n TYR 165 Cb 0.57 0.26 -0.06 0.00 -0.31 0.00 0.00 39.34 39.80 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 4.43 0.38 -0.41 0.00 3.64 -1.54 1.62 116.57 124.69 1b8t h LYS 167 Ca -0.52 -0.02 0.10 0.00 -1.27 0.00 0.00 60.65 58.94 1b8t h LYS 167 Cb 1.21 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.92 1b8t h LYS 167 CO 0.63 0.25 0.29 0.78 -2.27 0.00 0.00 179.45 179.13 1b8t h GLY 168 N 0.40 0.15 0.10 5.01 0.00 -1.94 0.42 103.07 107.20 1b8t h GLY 168 Ca 0.68 -0.04 -0.11 0.00 0.00 0.00 0.00 47.33 47.85 1b8t h GLY 168 CO -0.57 0.03 -0.60 0.00 0.00 0.00 0.00 176.54 175.40 1b8t h TYR 170 N -0.89 0.10 0.00 0.00 3.20 -0.08 0.44 116.97 119.74 1b8t h TYR 170 Ca -0.15 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.72 1b8t h TYR 170 Cb 1.21 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.45 1b8t h TYR 170 CO 0.20 0.04 -0.27 0.00 -1.64 0.00 0.00 178.16 176.49 1b8t h ALA 171 N 1.72 0.00 -0.02 1.82 0.00 -0.28 -3.29 119.26 119.23 1b8t h ALA 171 Ca 0.27 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1b8t h ALA 171 Cb 0.93 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1b8t h ALA 171 CO -0.03 0.27 -0.05 0.87 0.00 0.00 0.00 179.25 180.32 1b8t h LYS 172 N -0.67 -0.05 -1.94 0.00 1.79 -0.88 0.45 116.57 115.26 1b8t h LYS 172 Ca 0.00 0.00 0.57 0.00 -2.18 0.00 0.00 60.65 59.04 1b8t h LYS 172 Cb 0.27 0.01 -0.08 0.00 -1.58 0.00 0.00 32.23 30.86 1b8t h LYS 172 CO 0.00 -0.04 1.39 -1.71 -1.08 0.00 0.00 179.45 178.01 1b8t n ASN 173 N -2.86 0.01 -2.82 0.86 5.15 0.15 0.14 115.26 115.90 1b8t n ASN 173 Ca -0.01 1.00 -0.30 0.00 -0.60 0.00 0.00 54.58 54.67 1b8t n ASN 173 Cb 0.04 -0.50 -0.01 0.00 -0.53 0.00 0.00 39.78 38.78 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 -3.94 3.51 -0.58 1.20 3.01 0.14 -5.00 117.46 115.80 1b8t n PHE 174 Ca 0.44 -3.24 0.00 0.00 1.01 0.00 0.00 57.45 55.66 1b8t n PHE 174 Cb 1.98 -0.50 0.00 0.00 -0.01 0.00 0.00 39.48 40.96 1b8t n PHE 174 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1b8t n GLY 175 N -0.36 2.07 3.56 1.37 0.00 0.37 -4.80 105.19 107.40 1b8t n GLY 175 Ca 0.39 -1.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.23 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 4.40 3.03 0.10 1.61 0.04 -1.26 -4.93 135.00 137.99 1b8t s PRO 176 Ca 0.00 -0.45 0.03 0.00 0.04 0.00 0.00 61.00 60.62 1b8t s PRO 176 Cb 0.00 -4.93 -0.04 0.00 0.04 0.00 0.00 34.50 29.57 1b8t s PRO 176 CO 0.00 -2.68 -0.09 -1.59 0.04 0.00 0.00 177.00 172.69 1b8t s LYS 177 N 6.09 0.83 0.00 4.56 -2.85 -1.26 -5.14 119.74 121.97 1b8t s LYS 177 Ca 0.56 -1.21 0.00 0.00 -1.00 0.00 0.00 55.97 54.32 1b8t s LYS 177 Cb -0.05 -0.39 0.00 0.00 -2.06 0.00 0.00 37.83 35.32 1b8t s LYS 177 CO 0.02 0.04 0.00 0.41 0.10 0.00 0.00 175.35 175.92 1b8t n GLY 178 N 0.36 -0.78 3.43 0.59 0.00 -1.26 -5.15 105.19 102.39 1b8t n GLY 178 Ca -0.15 -0.73 -0.33 0.00 0.00 0.00 0.00 46.02 44.81 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 -3.00 2.85 0.00 1.61 -0.71 -1.26 -5.12 117.98 112.35 1b8t s PHE 179 Ca 0.00 -0.43 0.00 0.00 -1.04 0.00 0.00 56.93 55.46 1b8t s PHE 179 Cb 0.00 -1.82 0.00 0.00 -1.21 0.00 0.00 43.02 39.99 1b8t s PHE 179 CO 0.00 -0.06 0.00 0.41 -1.34 0.00 0.00 175.22 174.23 1b8t n GLY 180 N 3.21 -1.23 1.80 1.99 0.00 -1.26 -5.07 105.19 104.63 1b8t n GLY 180 Ca -0.18 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.28 1b8t n GLY 180 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1b8t n PHE 181 N -0.42 -0.59 0.00 1.61 7.35 -1.26 -5.11 117.46 119.05 1b8t n PHE 181 Ca 0.00 0.10 0.00 0.00 -0.76 0.00 0.00 57.45 56.79 1b8t n PHE 181 Cb 0.00 0.42 0.00 0.00 0.35 0.00 0.00 39.48 40.25 1b8t n PHE 181 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1b8t n GLY 182 N 1.84 0.70 0.41 7.13 0.00 -1.26 -5.09 105.19 108.92 1b8t n GLY 182 Ca 0.00 -0.76 -0.07 0.00 0.00 0.00 0.00 46.02 45.19 1b8t n GLY 182 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1b8t n GLN 183 N 0.00 0.35 -4.14 1.61 1.13 -1.26 -5.04 117.38 110.03 1b8t n GLN 183 Ca 0.00 0.14 -0.26 0.00 -1.94 0.00 0.00 57.00 54.94 1b8t n GLN 183 Cb 0.00 -1.12 -0.06 0.00 0.11 0.00 0.00 30.24 29.17 1b8t n GLN 183 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1b8t s GLY 184 N -4.66 1.72 -0.44 1.08 0.00 -1.26 -5.08 107.32 98.69 1b8t s GLY 184 Ca -0.20 -1.29 0.05 0.00 0.00 0.00 0.00 44.72 43.29 1b8t s GLY 184 CO 0.29 -1.30 0.48 0.00 0.00 0.00 0.00 173.10 172.56 1b8t n ALA 185 N -0.24 1.56 -2.70 3.20 0.00 -1.26 -5.00 120.51 116.06 1b8t n ALA 185 Ca -0.09 -2.60 -0.05 0.00 0.00 0.00 0.00 53.44 50.70 1b8t n ALA 185 Cb 0.55 -0.95 0.05 0.00 0.00 0.00 0.00 19.45 19.10 1b8t n ALA 185 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b8t n GLY 186 N 2.62 -1.15 0.08 0.00 0.00 -1.26 -5.05 105.19 100.43 1b8t n GLY 186 Ca 0.25 0.80 -0.01 0.00 0.00 0.00 0.00 46.02 47.06 1b8t n GLY 186 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b8t h ALA 187 N 3.93 -0.10 -2.80 4.61 0.00 -2.07 -3.47 119.26 119.36 1b8t h ALA 187 Ca -0.10 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.63 1b8t h ALA 187 Cb 1.14 0.04 -0.29 0.00 0.00 0.00 0.00 17.79 18.68 1b8t h ALA 187 CO -0.02 -0.10 -0.41 -1.17 0.00 0.00 0.00 179.25 177.55 1b8t s LEU 188 N -8.13 -0.01 0.17 0.00 2.96 -1.26 -5.16 118.68 107.25 1b8t s LEU 188 Ca -0.01 0.72 0.05 0.00 -0.22 0.00 0.00 54.13 54.67 1b8t s LEU 188 Cb 0.00 1.02 -0.04 0.00 0.50 0.00 0.00 46.19 47.67 1b8t s LEU 188 CO 0.04 -0.20 0.16 -0.51 -1.32 0.00 0.00 176.35 174.53 1b8t s ILE 189 N 1.67 4.59 -0.08 6.68 2.07 -1.26 -5.12 121.20 129.75 1b8t s ILE 189 Ca -0.07 -1.06 0.00 0.00 -1.41 0.00 0.00 60.65 58.12 1b8t s ILE 189 Cb -0.10 -3.36 -0.03 0.00 0.13 0.00 0.00 42.46 39.10 1b8t s ILE 189 CO -0.11 -0.13 -0.07 -1.38 -1.91 0.00 0.00 174.94 171.35 1b8t s HIS 190 N -1.78 2.94 -0.00 3.50 -3.43 -1.26 -4.90 115.29 110.36 1b8t s HIS 190 Ca 0.32 -0.02 -0.01 0.00 -0.80 0.00 0.00 55.06 54.55 1b8t s HIS 190 Cb -0.10 -1.73 0.00 0.00 -1.43 0.00 0.00 32.58 29.32 1b8t s HIS 190 CO 0.24 0.29 0.02 0.43 -2.00 0.00 0.00 174.74 173.72 1b8t n SER 191 N 2.35 -6.38 0.00 7.38 7.64 -1.26 -5.32 113.62 118.03 1b8t n SER 191 Ca -0.18 1.22 0.00 0.00 1.01 0.00 0.00 58.87 60.92 1b8t n SER 191 Cb 0.53 -3.85 0.00 0.00 -1.01 0.00 0.00 64.21 59.88 1b8t n SER 191 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03