#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 -2.12 -0.71 0.03 -0.04 -1.26 -5.03 135.00 125.87 1b8t n PRO 2 Ca 0.00 -1.80 -0.29 0.00 -0.04 0.00 0.00 63.50 61.37 1b8t n PRO 2 Cb 0.00 -1.42 0.22 0.00 -0.04 0.00 0.00 33.50 32.26 1b8t n PRO 2 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1b8t s ASN 3 N -4.96 1.74 -0.04 3.54 0.01 -1.26 -5.05 114.94 108.92 1b8t s ASN 3 Ca 0.69 1.60 -0.30 0.00 -0.71 0.00 0.00 52.86 54.14 1b8t s ASN 3 Cb -0.04 -2.29 0.11 0.00 0.41 0.00 0.00 41.25 39.44 1b8t s ASN 3 CO 0.51 -3.74 1.00 0.26 -1.51 0.00 0.00 177.10 173.61 1b8t s TRP 4 N -2.60 -0.26 0.00 2.20 0.52 -1.26 -5.19 118.94 112.36 1b8t s TRP 4 Ca 0.67 0.13 0.00 0.00 0.02 0.00 0.00 56.10 56.92 1b8t s TRP 4 Cb -0.23 0.54 0.00 0.00 -1.15 0.00 0.00 33.47 32.63 1b8t s TRP 4 CO 0.62 -0.47 0.00 0.41 0.02 0.00 0.00 176.95 177.53 1b8t n GLY 5 N -0.23 0.82 0.00 0.98 0.00 -1.26 -5.19 105.19 100.31 1b8t n GLY 5 Ca -0.06 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.43 6.35 0.00 -0.02 0.00 -1.26 -5.18 105.19 104.65 1b8t n GLY 6 Ca 0.00 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.33 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 2.47 4.76 2.74 -0.02 0.00 -1.26 -4.88 105.19 109.01 1b8t n GLY 7 Ca 0.00 -0.93 -0.21 0.00 0.00 0.00 0.00 46.02 44.88 1b8t n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b8t s LYS 8 N 1.98 0.34 -0.27 1.61 1.02 -0.22 -4.95 119.74 119.25 1b8t s LYS 8 Ca 0.00 0.20 -0.29 0.00 0.02 0.00 0.00 55.97 55.90 1b8t s LYS 8 Cb 0.00 -0.76 -0.01 0.00 -0.52 0.00 0.00 37.83 36.54 1b8t s LYS 8 CO 0.00 -0.30 1.47 -1.59 -0.92 0.00 0.00 175.35 174.02 1b8t s LYS 9 N 1.95 3.82 -0.43 1.68 -2.85 -1.26 0.21 119.74 122.86 1b8t s LYS 9 Ca 0.04 1.43 -0.28 0.00 -1.00 0.00 0.00 55.97 56.15 1b8t s LYS 9 Cb -0.12 -3.97 -0.01 0.00 -2.06 0.00 0.00 37.83 31.66 1b8t s LYS 9 CO -0.04 -1.25 1.74 0.00 0.10 0.00 0.00 175.35 175.90 1b8t n GLY 11 N 5.44 -0.86 0.05 0.00 0.00 -1.25 -0.14 105.19 108.43 1b8t n GLY 11 Ca 0.21 -0.09 -0.04 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.55 0.80 0.11 1.61 0.31 -1.26 -4.60 118.33 114.75 1b8t n VAL 12 Ca 0.08 0.32 0.03 0.00 -0.01 0.00 0.00 64.34 64.76 1b8t n VAL 12 Cb 0.06 -1.97 -0.00 0.00 -0.91 0.00 0.00 33.84 31.01 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 -3.05 0.00 -4.46 0.00 7.27 0.80 -5.07 117.38 112.86 1b8t n GLN 14 Ca -0.02 0.04 -0.29 0.00 0.07 0.00 0.00 57.00 56.79 1b8t n GLN 14 Cb 0.74 -2.45 -0.13 0.00 2.41 0.00 0.00 30.24 30.81 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 -2.89 1.62 0.38 3.69 2.20 -1.06 -4.89 119.74 118.79 1b8t s LYS 15 Ca 0.00 -1.24 -0.26 0.00 -0.36 0.00 0.00 55.97 54.11 1b8t s LYS 15 Cb 0.00 -1.99 -0.09 0.00 -1.51 0.00 0.00 37.83 34.24 1b8t s LYS 15 CO 0.00 0.47 1.16 0.00 -0.36 0.00 0.00 175.35 176.63 1b8t s ALA 16 N -1.04 3.20 0.10 3.13 0.00 -1.26 0.19 121.76 126.08 1b8t s ALA 16 Ca 0.15 0.96 0.08 0.00 0.00 0.00 0.00 51.96 53.15 1b8t s ALA 16 Cb -0.10 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.61 1b8t s ALA 16 CO 0.07 -0.48 -0.18 0.08 0.00 0.00 0.00 175.76 175.25 1b8t s VAL 17 N -1.39 2.87 -0.29 0.00 1.01 0.13 -4.81 120.40 117.92 1b8t s VAL 17 Ca 0.55 -1.42 0.01 0.00 0.00 0.00 0.00 61.98 61.12 1b8t s VAL 17 Cb -0.31 -2.30 0.19 0.00 0.00 0.00 0.00 36.38 33.97 1b8t s VAL 17 CO 0.39 0.15 0.65 -0.47 0.00 0.00 0.00 175.10 175.82 1b8t s TYR 18 N -1.10 -1.60 0.04 5.22 5.04 -1.26 -1.05 117.35 122.62 1b8t s TYR 18 Ca 0.17 1.22 0.00 0.00 -2.44 0.00 0.00 57.07 56.03 1b8t s TYR 18 Cb -0.11 0.38 0.00 0.00 0.35 0.00 0.00 41.96 42.59 1b8t s TYR 18 CO 0.09 -0.91 0.00 1.19 -1.34 0.00 0.00 175.55 174.58 1b8t n PHE 19 N 5.40 -1.88 0.00 4.97 3.01 -1.26 -4.78 117.46 122.93 1b8t n PHE 19 Ca 0.03 0.20 0.00 0.00 1.01 0.00 0.00 57.45 58.68 1b8t n PHE 19 Cb 0.53 -0.20 0.00 0.00 -0.01 0.00 0.00 39.48 39.80 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 -0.28 0.00 -1.00 4.37 0.00 -1.26 -4.16 120.51 118.18 1b8t n ALA 20 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1b8t n ALA 20 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.52 1b8t n ALA 20 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1b8t n GLU 21 N 0.00 0.00 -2.86 0.00 -0.58 -1.26 -5.11 120.64 110.83 1b8t n GLU 21 Ca 0.00 0.00 -0.02 0.00 -0.42 0.00 0.00 57.16 56.72 1b8t n GLU 21 Cb 0.00 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 30.85 1b8t n GLU 21 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1b8t n GLU 22 N -0.99 -2.74 -3.94 3.49 2.13 -1.26 -4.94 120.64 112.39 1b8t n GLU 22 Ca 0.00 2.25 -0.36 0.00 0.66 0.00 0.00 57.16 59.71 1b8t n GLU 22 Cb 0.00 -3.13 -0.06 0.00 0.27 0.00 0.00 31.44 28.51 1b8t n GLU 22 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1b8t s VAL 23 N -0.64 5.35 0.18 6.31 1.01 -0.19 -4.96 120.40 127.47 1b8t s VAL 23 Ca -0.11 0.10 0.09 0.00 0.00 0.00 0.00 61.98 62.06 1b8t s VAL 23 Cb 0.01 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 1b8t s VAL 23 CO 0.42 0.58 -0.18 -1.58 0.00 0.00 0.00 175.10 174.34 1b8t s GLN 24 N -1.13 1.33 -0.28 2.72 0.74 -1.26 0.09 119.66 121.86 1b8t s GLN 24 Ca 0.16 -1.48 -0.16 0.00 0.05 0.00 0.00 55.36 53.94 1b8t s GLN 24 Cb -0.12 -1.35 0.11 0.00 1.10 0.00 0.00 33.01 32.75 1b8t s GLN 24 CO 0.06 0.26 0.82 0.00 -0.55 0.00 0.00 175.29 175.88 1b8t n GLU 26 N 4.07 0.00 -2.44 0.00 1.02 -1.26 0.12 120.64 122.15 1b8t n GLU 26 Ca -0.19 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 56.83 1b8t n GLU 26 Cb 0.58 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 32.04 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 0.00 4.07 3.60 0.62 0.00 -1.26 -5.06 105.19 107.16 1b8t n GLY 27 Ca 0.00 -1.87 -0.09 0.00 0.00 0.00 0.00 46.02 44.06 1b8t n GLY 27 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1b8t s SER 28 N -3.69 -0.03 -0.27 1.61 0.15 0.12 -5.18 113.70 106.41 1b8t s SER 28 Ca 0.39 -0.96 -0.22 0.00 0.70 0.00 0.00 55.95 55.86 1b8t s SER 28 Cb 0.37 0.60 0.07 0.00 -1.71 0.00 0.00 66.02 65.36 1b8t s SER 28 CO -0.00 -1.17 0.70 -0.55 1.20 0.00 0.00 173.24 173.42 1b8t s SER 29 N -3.03 -0.81 0.12 5.45 0.15 -1.26 0.08 113.70 114.40 1b8t s SER 29 Ca 0.22 1.46 -0.03 0.00 0.70 0.00 0.00 55.95 58.30 1b8t s SER 29 Cb -0.01 1.43 -0.03 0.00 -1.71 0.00 0.00 66.02 65.70 1b8t s SER 29 CO 0.10 -0.25 0.09 -0.36 1.20 0.00 0.00 173.24 174.03 1b8t s PHE 30 N 0.80 0.64 0.36 3.44 0.08 0.11 -3.76 117.98 119.67 1b8t s PHE 30 Ca -0.03 -1.06 -0.28 0.00 0.12 0.00 0.00 56.93 55.68 1b8t s PHE 30 Cb -0.05 -0.35 -0.11 0.00 -0.57 0.00 0.00 43.02 41.95 1b8t s PHE 30 CO -0.06 -0.53 1.43 -1.01 -0.10 0.00 0.00 175.22 174.94 1b8t s HIS 31 N -3.99 2.73 0.20 0.36 3.76 -1.26 -1.02 115.29 116.07 1b8t s HIS 31 Ca 0.18 1.25 -0.23 0.00 -0.15 0.00 0.00 55.06 56.11 1b8t s HIS 31 Cb 0.07 -3.91 0.11 0.00 1.11 0.00 0.00 32.58 29.96 1b8t s HIS 31 CO -0.02 -2.63 1.55 -0.22 -0.85 0.00 0.00 174.74 172.58 1b8t h LYS 32 N 3.10 -0.04 -0.81 1.40 3.11 -1.92 1.30 116.57 122.72 1b8t h LYS 32 Ca -0.50 0.00 0.13 0.00 -2.81 0.00 0.00 60.65 57.47 1b8t h LYS 32 Cb 1.24 0.01 -0.09 0.00 -1.00 0.00 0.00 32.23 32.39 1b8t h LYS 32 CO 0.64 -0.03 0.41 0.77 -2.81 0.00 0.00 179.45 178.43 1b8t h SER 33 N -0.04 0.50 -0.46 4.20 0.02 -1.90 0.73 113.55 116.60 1b8t h SER 33 Ca 0.26 0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 61.29 1b8t h SER 33 Cb 0.54 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 1b8t h SER 33 CO -0.92 0.23 0.27 0.00 -1.14 0.00 0.00 176.83 175.28 1b8t s PHE 35 N -5.96 1.71 -0.05 0.00 2.19 0.23 -4.86 117.98 111.24 1b8t s PHE 35 Ca -0.13 1.02 0.03 0.00 0.33 0.00 0.00 56.93 58.18 1b8t s PHE 35 Cb 0.11 -3.81 0.00 0.00 -1.31 0.00 0.00 43.02 38.02 1b8t s PHE 35 CO 0.74 -1.15 -0.14 -1.17 1.83 0.00 0.00 175.22 175.34 1b8t s LEU 36 N 12.61 1.78 -0.40 6.12 0.20 -1.26 -1.05 118.68 136.69 1b8t s LEU 36 Ca 0.73 -0.30 -0.39 0.00 0.69 0.00 0.00 54.13 54.85 1b8t s LEU 36 Cb -0.03 -0.84 -0.15 0.00 -0.43 0.00 0.00 46.19 44.74 1b8t s LEU 36 CO 0.13 0.09 2.12 0.00 -0.29 0.00 0.00 176.35 178.40 1b8t n MET 38 N 7.64 0.82 0.00 0.00 2.81 -0.48 -0.14 117.12 127.76 1b8t n MET 38 Ca 0.45 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.34 1b8t n MET 38 Cb 0.12 -1.32 0.00 0.00 -0.71 0.00 0.00 33.22 31.31 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 -0.82 0.00 0.23 2.03 0.31 -1.26 -4.59 118.33 114.24 1b8t n VAL 39 Ca 0.12 0.31 0.12 0.00 -0.01 0.00 0.00 64.34 64.88 1b8t n VAL 39 Cb 0.06 -1.27 0.49 0.00 -0.91 0.00 0.00 33.84 32.20 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 -3.29 0.00 -4.06 0.00 4.81 0.80 -5.04 118.16 111.38 1b8t n LYS 41 Ca 0.01 0.32 -0.35 0.00 -0.87 0.00 0.00 58.31 57.42 1b8t n LYS 41 Cb 0.41 -3.65 -0.09 0.00 0.02 0.00 0.00 35.03 31.73 1b8t n LYS 41 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1b8t s LYS 42 N -2.52 3.58 0.40 1.64 -0.14 -1.13 -4.84 119.74 116.73 1b8t s LYS 42 Ca 0.00 -0.30 -0.24 0.00 -1.36 0.00 0.00 55.97 54.08 1b8t s LYS 42 Cb 0.00 -3.10 -0.12 0.00 -1.68 0.00 0.00 37.83 32.92 1b8t s LYS 42 CO 0.00 0.52 0.72 0.09 -0.76 0.00 0.00 175.35 175.92 1b8t n ASN 43 N 2.75 -0.11 -4.28 2.83 3.02 -1.26 0.09 115.26 118.31 1b8t n ASN 43 Ca -0.18 0.97 -0.33 0.00 -0.03 0.00 0.00 54.58 55.02 1b8t n ASN 43 Cb 0.53 -1.19 -0.16 0.00 -0.61 0.00 0.00 39.78 38.36 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 1.02 2.42 -0.41 3.41 1.43 -0.21 -4.57 118.68 121.77 1b8t s LEU 44 Ca 0.63 -0.46 0.02 0.00 -1.03 0.00 0.00 54.13 53.29 1b8t s LEU 44 Cb -0.61 -1.53 0.26 0.00 0.03 0.00 0.00 46.19 44.34 1b8t s LEU 44 CO 0.58 0.13 1.07 -0.67 0.23 0.00 0.00 176.35 177.68 1b8t n ASP 45 N 3.78 -2.09 -3.55 2.29 4.64 -1.26 -4.64 116.55 115.71 1b8t n ASP 45 Ca -0.19 -2.56 -0.09 0.00 -1.38 0.00 0.00 54.79 50.58 1b8t n ASP 45 Cb 0.52 1.29 -0.02 0.00 -1.04 0.00 0.00 41.12 41.87 1b8t n ASP 45 CO 0.00 0.00 0.00 -0.55 -0.82 0.00 0.00 177.20 175.83 1b8t s SER 46 N -0.97 -0.04 -0.52 1.67 0.15 -1.26 -5.04 113.70 107.69 1b8t s SER 46 Ca 0.29 -0.91 -0.03 0.00 0.70 0.00 0.00 55.95 55.99 1b8t s SER 46 Cb 0.22 0.73 0.14 0.00 -1.71 0.00 0.00 66.02 65.40 1b8t s SER 46 CO -0.16 -1.41 2.56 1.07 1.20 0.00 0.00 173.24 176.50 1b8t n THR 47 N -0.48 3.33 -2.72 6.45 5.66 -1.26 -4.24 114.28 121.02 1b8t n THR 47 Ca -0.04 -3.10 -0.08 0.00 -3.05 0.00 0.00 64.05 57.78 1b8t n THR 47 Cb 0.60 -1.50 0.10 0.00 -1.55 0.00 0.00 70.33 67.99 1b8t n THR 47 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1b8t n THR 48 N 0.53 0.01 -4.61 1.09 -1.04 -1.26 -5.13 114.28 103.87 1b8t n THR 48 Ca 0.49 -1.57 -0.31 0.00 -2.04 0.00 0.00 64.05 60.62 1b8t n THR 48 Cb 0.50 1.21 -0.08 0.00 -1.82 0.00 0.00 70.33 70.14 1b8t n THR 48 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1b8t s VAL 49 N 0.14 1.44 0.22 12.58 0.11 -1.26 -1.14 120.40 132.50 1b8t s VAL 49 Ca 0.22 -1.93 -0.22 0.00 -2.93 0.00 0.00 61.98 57.13 1b8t s VAL 49 Cb 0.35 -2.37 0.04 0.00 -1.53 0.00 0.00 36.38 32.87 1b8t s VAL 49 CO -0.07 0.00 0.65 0.00 -3.33 0.00 0.00 175.10 172.35 1b8t s ALA 50 N -2.82 -1.35 0.12 1.54 0.00 0.38 -4.58 121.76 115.05 1b8t s ALA 50 Ca 0.16 0.04 0.11 0.00 0.00 0.00 0.00 51.96 52.26 1b8t s ALA 50 Cb 0.03 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.98 1b8t s ALA 50 CO 0.09 -0.90 -0.26 0.08 0.00 0.00 0.00 175.76 174.76 1b8t s VAL 51 N -3.84 2.20 -0.22 0.00 1.01 -1.26 -0.99 120.40 117.30 1b8t s VAL 51 Ca 0.07 -1.70 -0.33 0.00 0.00 0.00 0.00 61.98 60.02 1b8t s VAL 51 Cb -0.03 -1.95 0.16 0.00 0.00 0.00 0.00 36.38 34.56 1b8t s VAL 51 CO -0.02 0.11 1.24 -2.28 0.00 0.00 0.00 175.10 174.15 1b8t s HIS 52 N -1.03 -0.13 -1.38 5.22 5.04 -0.48 -4.94 115.29 117.59 1b8t s HIS 52 Ca 0.13 0.16 -0.08 0.00 -1.54 0.00 0.00 55.06 53.72 1b8t s HIS 52 Cb -0.10 0.50 0.01 0.00 0.04 0.00 0.00 32.58 33.02 1b8t s HIS 52 CO 0.05 -0.16 0.38 0.41 -2.34 0.00 0.00 174.74 173.09 1b8t n GLY 53 N 0.25 -0.39 4.39 1.59 0.00 -1.26 0.24 105.19 110.01 1b8t n GLY 53 Ca -0.01 0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 1b8t n GLY 53 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1b8t n ASP 54 N -2.78 -0.39 -3.29 1.61 2.03 -1.26 -4.87 116.55 107.60 1b8t n ASP 54 Ca -0.26 -1.25 -0.11 0.00 0.52 0.00 0.00 54.79 53.70 1b8t n ASP 54 Cb 0.66 -1.71 -0.02 0.00 -0.72 0.00 0.00 41.12 39.33 1b8t n ASP 54 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1b8t s GLU 55 N -7.28 1.96 -0.08 -0.67 8.01 0.14 -5.16 118.70 115.61 1b8t s GLU 55 Ca 0.37 -1.53 0.02 0.00 0.01 0.00 0.00 54.97 53.84 1b8t s GLU 55 Cb -0.21 0.52 -0.02 0.00 -4.31 0.00 0.00 34.13 30.10 1b8t s GLU 55 CO 1.00 -0.86 -0.14 0.96 0.01 0.00 0.00 175.26 176.24 1b8t s ILE 56 N -3.01 3.05 -0.02 -1.63 -4.36 -1.26 -1.38 121.20 112.59 1b8t s ILE 56 Ca 0.23 -0.70 -0.04 0.00 -0.26 0.00 0.00 60.65 59.88 1b8t s ILE 56 Cb -0.02 -2.22 0.00 0.00 1.25 0.00 0.00 42.46 41.47 1b8t s ILE 56 CO 0.15 0.57 0.09 -0.31 0.24 0.00 0.00 174.94 175.67 1b8t s TYR 57 N -0.35 -0.02 0.26 1.37 2.02 -0.16 -1.38 117.35 119.09 1b8t s TYR 57 Ca 0.03 0.07 -0.30 0.00 -0.37 0.00 0.00 57.07 56.50 1b8t s TYR 57 Cb -0.13 -0.01 -0.09 0.00 -0.40 0.00 0.00 41.96 41.33 1b8t s TYR 57 CO 0.02 -0.12 1.10 0.00 -1.57 0.00 0.00 175.55 174.98 1b8t n LYS 59 N 1.42 -0.23 -0.27 0.00 4.81 -0.29 0.88 118.16 124.48 1b8t n LYS 59 Ca -0.00 1.18 0.04 0.00 -0.87 0.00 0.00 58.31 58.65 1b8t n LYS 59 Cb 0.45 -1.74 0.09 0.00 0.02 0.00 0.00 35.03 33.85 1b8t n LYS 59 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1b8t n SER 60 N -4.20 -0.30 0.25 3.14 7.64 -1.26 0.20 113.62 119.08 1b8t n SER 60 Ca 0.01 1.27 -0.16 0.00 1.01 0.00 0.00 58.87 61.01 1b8t n SER 60 Cb 0.14 -0.37 -0.08 0.00 -1.01 0.00 0.00 64.21 62.89 1b8t n SER 60 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1b8t h TYR 62 N -0.62 -0.80 0.00 0.00 5.03 0.46 0.88 116.97 121.91 1b8t h TYR 62 Ca -0.06 0.07 -0.03 0.00 2.58 0.00 0.00 58.73 61.29 1b8t h TYR 62 Cb 0.47 0.45 -0.00 0.00 1.55 0.00 0.00 36.73 39.19 1b8t h TYR 62 CO -0.04 -0.37 -0.14 0.78 -1.32 0.00 0.00 178.16 177.08 1b8t h GLY 63 N -0.12 0.00 0.50 1.82 0.00 -0.19 0.29 103.07 105.38 1b8t h GLY 63 Ca 0.26 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.58 1b8t h GLY 63 CO -0.70 0.00 -0.12 0.50 0.00 0.00 0.00 176.54 176.22 1b8t h LYS 64 N 0.00 -0.32 -0.12 4.80 1.57 0.46 0.40 116.57 123.37 1b8t h LYS 64 Ca -0.00 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1b8t h LYS 64 Cb 0.56 0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.94 1b8t h LYS 64 CO 0.02 0.05 0.02 -0.22 -0.57 0.00 0.00 179.45 178.75 1b8t h LYS 65 N -0.84 0.19 -0.73 3.15 3.64 -0.33 -2.83 116.57 118.82 1b8t h LYS 65 Ca -0.03 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1b8t h LYS 65 Cb 0.51 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.27 1b8t h LYS 65 CO 0.06 0.37 0.45 1.88 -2.27 0.00 0.00 179.45 179.94 1b8t h TYR 66 N -0.02 0.95 0.00 1.91 -1.99 -1.01 -3.42 116.97 113.39 1b8t h TYR 66 Ca 0.04 0.01 -0.42 0.00 2.00 0.00 0.00 58.73 60.36 1b8t h TYR 66 Cb 0.27 -0.32 -0.08 0.00 2.00 0.00 0.00 36.73 38.60 1b8t h TYR 66 CO 0.01 0.62 1.59 0.41 -0.00 0.00 0.00 178.16 180.79 1b8t n GLY 67 N -1.34 -0.43 3.77 3.88 0.00 0.14 -4.85 105.19 106.36 1b8t n GLY 67 Ca 0.08 0.85 -0.30 0.00 0.00 0.00 0.00 46.02 46.65 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 7.60 -0.08 -0.04 1.61 0.04 -1.26 -5.00 135.00 137.88 1b8t s PRO 68 Ca 1.19 -0.17 -0.15 0.00 0.04 0.00 0.00 61.00 61.91 1b8t s PRO 68 Cb -1.05 -1.74 0.03 0.00 0.04 0.00 0.00 34.50 31.78 1b8t s PRO 68 CO 0.44 -2.93 0.33 0.21 0.04 0.00 0.00 177.00 175.09 1b8t s LYS 69 N -5.60 0.63 0.36 4.56 2.20 -1.26 -5.18 119.74 115.45 1b8t s LYS 69 Ca 0.71 -0.03 0.06 0.00 -0.36 0.00 0.00 55.97 56.36 1b8t s LYS 69 Cb -0.08 0.28 -0.02 0.00 -1.51 0.00 0.00 37.83 36.50 1b8t s LYS 69 CO 0.54 -0.16 0.23 0.41 -0.36 0.00 0.00 175.35 176.01 1b8t n GLY 70 N 1.61 3.05 3.80 5.54 0.00 -1.26 -5.18 105.19 112.75 1b8t n GLY 70 Ca -0.20 -1.98 -0.03 0.00 0.00 0.00 0.00 46.02 43.81 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 -3.42 1.25 0.24 1.61 0.00 -1.26 -5.19 119.74 112.96 1b8t s LYS 71 Ca 0.32 -0.75 -0.21 0.00 0.00 0.00 0.00 55.97 55.33 1b8t s LYS 71 Cb 0.02 0.39 0.06 0.00 0.00 0.00 0.00 37.83 38.29 1b8t s LYS 71 CO 0.23 -0.58 0.89 0.20 0.00 0.00 0.00 175.35 176.09 1b8t s GLY 72 N -3.14 0.01 0.48 0.59 0.00 -1.26 -5.19 107.32 98.81 1b8t s GLY 72 Ca 0.16 -0.27 0.02 0.00 0.00 0.00 0.00 44.72 44.64 1b8t s GLY 72 CO 0.04 0.48 0.02 1.25 0.00 0.00 0.00 173.10 174.89 1b8t s LYS 73 N -2.93 2.11 0.16 2.90 2.20 -1.26 -5.17 119.74 117.75 1b8t s LYS 73 Ca 0.15 -2.32 -0.03 0.00 -0.36 0.00 0.00 55.97 53.41 1b8t s LYS 73 Cb -0.03 -1.41 -0.03 0.00 -1.51 0.00 0.00 37.83 34.84 1b8t s LYS 73 CO 0.06 -0.32 0.14 0.20 -0.36 0.00 0.00 175.35 175.07 1b8t s GLY 74 N -3.81 0.95 -0.28 5.54 0.00 -1.26 -5.17 107.32 103.29 1b8t s GLY 74 Ca 0.13 -1.36 -0.37 0.00 0.00 0.00 0.00 44.72 43.12 1b8t s GLY 74 CO 0.07 -1.22 1.36 -3.16 0.00 0.00 0.00 173.10 170.15 1b8t s MET 75 N -4.05 0.07 0.00 2.90 0.23 -1.26 -5.18 119.30 112.01 1b8t s MET 75 Ca 0.25 -0.02 0.00 0.00 -1.03 0.00 0.00 55.69 54.89 1b8t s MET 75 Cb 0.06 0.03 0.00 0.00 -1.53 0.00 0.00 34.83 33.39 1b8t s MET 75 CO 0.04 -0.03 0.00 0.41 -2.03 0.00 0.00 175.02 173.41 1b8t n GLY 76 N 0.02 3.61 3.51 3.16 0.00 -1.26 -5.19 105.19 109.04 1b8t n GLY 76 Ca 0.04 -0.21 -0.08 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.08 -1.85 0.00 4.61 0.00 -1.26 -5.18 121.76 118.01 1b8t s ALA 77 Ca 0.00 1.10 0.00 0.00 0.00 0.00 0.00 51.96 53.06 1b8t s ALA 77 Cb 0.00 0.31 0.00 0.00 0.00 0.00 0.00 23.12 23.43 1b8t s ALA 77 CO 0.00 -0.66 0.00 0.41 0.00 0.00 0.00 175.76 175.51 1b8t n GLY 78 N -0.17 4.80 3.57 0.00 0.00 -1.26 -5.17 105.19 106.95 1b8t n GLY 78 Ca -0.08 -1.12 -0.15 0.00 0.00 0.00 0.00 46.02 44.67 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 -1.66 0.00 -0.19 2.61 -1.32 -1.26 -5.17 115.64 108.65 1b8t s THR 79 Ca 0.00 0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.24 1b8t s THR 79 Cb 0.00 -1.00 0.06 0.00 -1.51 0.00 0.00 72.50 70.05 1b8t s THR 79 CO 0.00 0.00 0.63 -0.22 -2.21 0.00 0.00 174.62 172.82 1b8t s LEU 80 N -0.70 -0.43 -0.30 9.08 2.96 -1.26 -5.17 118.68 122.87 1b8t s LEU 80 Ca -0.06 1.11 -0.24 0.00 -0.22 0.00 0.00 54.13 54.73 1b8t s LEU 80 Cb -0.02 2.22 0.19 0.00 0.50 0.00 0.00 46.19 49.08 1b8t s LEU 80 CO 0.05 -0.31 1.36 -0.94 -1.32 0.00 0.00 176.35 175.19 1b8t s SER 81 N -0.06 -0.11 -0.22 3.68 1.04 -1.26 -5.18 113.70 111.59 1b8t s SER 81 Ca -0.03 0.20 -0.29 0.00 0.48 0.00 0.00 55.95 56.31 1b8t s SER 81 Cb -0.04 0.34 0.15 0.00 0.10 0.00 0.00 66.02 66.58 1b8t s SER 81 CO 0.03 -0.03 1.14 0.28 0.98 0.00 0.00 173.24 175.64 1b8t s THR 82 N 0.22 0.00 0.00 2.02 -1.32 -1.26 -5.18 115.64 110.13 1b8t s THR 82 Ca 0.04 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.52 1b8t s THR 82 Cb -0.05 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.94 1b8t s THR 82 CO -0.14 0.00 0.00 -0.90 -2.21 0.00 0.00 174.62 171.37 1b8t n ASP 83 N 0.84 0.00 -3.63 8.08 5.75 -1.26 -5.18 116.55 121.16 1b8t n ASP 83 Ca -0.07 0.00 -0.05 0.00 -0.01 0.00 0.00 54.79 54.66 1b8t n ASP 83 Cb 0.58 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.62 1b8t n ASP 83 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1b8t s LYS 84 N -1.05 0.22 0.00 0.11 2.47 -1.26 -5.16 119.74 115.07 1b8t s LYS 84 Ca 0.00 0.08 0.00 0.00 -1.56 0.00 0.00 55.97 54.49 1b8t s LYS 84 Cb 0.00 0.10 0.00 0.00 -1.46 0.00 0.00 37.83 36.47 1b8t s LYS 84 CO 0.00 -0.06 0.00 0.41 0.16 0.00 0.00 175.35 175.86 1b8t n GLY 85 N 0.75 1.19 3.63 5.54 0.00 -1.26 -5.19 105.19 109.85 1b8t n GLY 85 Ca -0.04 0.50 -0.03 0.00 0.00 0.00 0.00 46.02 46.45 1b8t n GLY 85 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1b8t s GLU 86 N 0.00 0.12 0.00 1.61 -1.05 -1.26 -5.13 118.70 112.99 1b8t s GLU 86 Ca 0.00 0.01 0.00 0.00 -0.15 0.00 0.00 54.97 54.83 1b8t s GLU 86 Cb 0.00 0.06 0.00 0.00 -0.44 0.00 0.00 34.13 33.75 1b8t s GLU 86 CO 0.00 -0.04 0.00 0.45 0.95 0.00 0.00 175.26 176.62 1b8t n SER 87 N 0.38 0.00 -4.21 0.83 2.88 -1.26 -5.15 113.62 107.09 1b8t n SER 87 Ca 0.00 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.23 1b8t n SER 87 Cb 0.58 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.87 1b8t n SER 87 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1b8t s LEU 88 N 0.00 2.06 -0.29 2.46 2.01 -1.26 -5.10 118.68 118.56 1b8t s LEU 88 Ca 0.00 -0.54 -0.16 0.00 0.01 0.00 0.00 54.13 53.44 1b8t s LEU 88 Cb 0.00 -1.37 0.15 0.00 0.01 0.00 0.00 46.19 44.98 1b8t s LEU 88 CO 0.00 0.15 0.97 -0.83 1.01 0.00 0.00 176.35 177.66 1b8t s GLY 89 N 0.35 -0.02 -0.19 -3.19 0.00 -1.26 -5.17 107.32 97.83 1b8t s GLY 89 Ca -0.18 3.12 -0.27 0.00 0.00 0.00 0.00 44.72 47.39 1b8t s GLY 89 CO 0.08 2.64 0.77 -1.50 0.00 0.00 0.00 173.10 175.09 1b8t s ILE 90 N 1.43 0.00 0.06 0.90 1.10 -1.26 -5.18 121.20 118.26 1b8t s ILE 90 Ca -0.09 0.00 -0.23 0.00 -0.51 0.00 0.00 60.65 59.82 1b8t s ILE 90 Cb -0.04 -1.00 0.06 0.00 0.15 0.00 0.00 42.46 41.63 1b8t s ILE 90 CO -0.15 0.00 0.55 -0.54 -2.11 0.00 0.00 174.94 172.69 1b8t s LYS 91 N -0.26 1.09 0.10 3.50 3.01 -1.26 -5.18 119.74 120.73 1b8t s LYS 91 Ca -0.03 -0.25 0.03 0.00 -1.01 0.00 0.00 55.97 54.70 1b8t s LYS 91 Cb -0.03 0.50 -0.04 0.00 -1.01 0.00 0.00 37.83 37.25 1b8t s LYS 91 CO 0.03 -0.41 -0.08 0.71 0.51 0.00 0.00 175.35 176.11 1b8t s TYR 92 N -2.65 0.97 -0.01 3.18 1.51 -1.26 -5.16 117.35 113.93 1b8t s TYR 92 Ca -0.04 -0.77 -0.17 0.00 -1.01 0.00 0.00 57.07 55.08 1b8t s TYR 92 Cb -0.00 -0.54 0.03 0.00 -0.11 0.00 0.00 41.96 41.34 1b8t s TYR 92 CO -0.03 -0.07 0.37 -1.83 -1.11 0.00 0.00 175.55 172.88 1b8t s GLU 93 N -3.24 0.75 -0.26 -0.62 -1.05 -1.26 -5.17 118.70 107.85 1b8t s GLU 93 Ca 0.08 -0.17 -0.38 0.00 -0.15 0.00 0.00 54.97 54.35 1b8t s GLU 93 Cb 0.01 0.34 0.15 0.00 -0.44 0.00 0.00 34.13 34.19 1b8t s GLU 93 CO -0.02 -0.22 1.35 -1.83 0.95 0.00 0.00 175.26 175.49 1b8t s GLU 94 N -1.51 0.08 0.00 -4.83 -1.05 -1.26 -5.17 118.70 104.96 1b8t s GLU 94 Ca -0.12 -0.03 0.00 0.00 -0.15 0.00 0.00 54.97 54.67 1b8t s GLU 94 Cb -0.04 0.04 0.00 0.00 -0.44 0.00 0.00 34.13 33.69 1b8t s GLU 94 CO 0.04 -0.03 0.00 0.41 0.95 0.00 0.00 175.26 176.62 1b8t n GLY 95 N -0.04 0.65 3.52 -3.83 0.00 -1.26 -5.19 105.19 99.04 1b8t n GLY 95 Ca 0.04 0.55 -0.10 0.00 0.00 0.00 0.00 46.02 46.51 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 0.00 1.37 0.07 1.61 -2.07 -1.26 -5.18 119.66 114.20 1b8t s GLN 96 Ca 0.00 -0.78 -0.05 0.00 -1.82 0.00 0.00 55.36 52.70 1b8t s GLN 96 Cb 0.00 0.54 -0.02 0.00 -1.09 0.00 0.00 33.01 32.44 1b8t s GLN 96 CO 0.00 -0.59 0.09 0.45 -1.32 0.00 0.00 175.29 173.93 1b8t s SER 97 N -2.85 0.28 0.21 12.60 0.15 -1.26 -5.18 113.70 117.65 1b8t s SER 97 Ca 0.07 -0.80 -0.09 0.00 0.70 0.00 0.00 55.95 55.83 1b8t s SER 97 Cb -0.01 0.28 -0.01 0.00 -1.71 0.00 0.00 66.02 64.56 1b8t s SER 97 CO -0.05 -0.67 0.33 -1.00 1.20 0.00 0.00 173.24 173.05 1b8t s HIS 98 N -3.87 0.55 -0.34 3.44 3.76 -1.26 -5.14 115.29 112.43 1b8t s HIS 98 Ca 0.06 -0.88 0.03 0.00 -0.15 0.00 0.00 55.06 54.12 1b8t s HIS 98 Cb 0.06 -0.06 0.16 0.00 1.11 0.00 0.00 32.58 33.85 1b8t s HIS 98 CO -0.11 -0.82 0.42 0.50 -0.85 0.00 0.00 174.74 173.89 1b8t s ARG 99 N -4.03 0.55 1.04 1.40 6.06 -1.26 -5.15 118.95 117.56 1b8t s ARG 99 Ca 0.24 -0.33 -0.16 0.00 -2.50 0.00 0.00 55.73 52.98 1b8t s ARG 99 Cb 0.02 -0.43 0.22 0.00 0.06 0.00 0.00 34.95 34.82 1b8t s ARG 99 CO 0.06 -1.12 1.20 -1.25 -2.50 0.00 0.00 175.30 171.69 1b8t s PRO 100 N 2.00 0.07 0.11 5.12 0.04 -1.26 -5.08 135.00 136.00 1b8t s PRO 100 Ca 0.13 -0.11 0.08 0.00 0.04 0.00 0.00 61.00 61.14 1b8t s PRO 100 Cb -0.12 -1.75 -0.04 0.00 0.04 0.00 0.00 34.50 32.63 1b8t s PRO 100 CO -0.17 -2.85 -0.12 -0.08 0.04 0.00 0.00 177.00 173.83 1b8t s THR 101 N -3.41 3.24 -0.08 1.26 -1.32 -1.26 -5.13 115.64 108.94 1b8t s THR 101 Ca 0.70 -1.33 0.02 0.00 -1.21 0.00 0.00 61.69 59.87 1b8t s THR 101 Cb -0.09 -2.51 0.01 0.00 -1.51 0.00 0.00 72.50 68.41 1b8t s THR 101 CO 0.54 0.10 -0.12 0.21 -2.21 0.00 0.00 174.62 173.14 1b8t s ASN 102 N -2.20 1.96 0.81 8.08 3.84 -1.26 -5.14 114.94 121.03 1b8t s ASN 102 Ca 0.21 -0.32 -0.12 0.00 0.21 0.00 0.00 52.86 52.84 1b8t s ASN 102 Cb -0.11 -0.88 0.08 0.00 -0.55 0.00 0.00 41.25 39.79 1b8t s ASN 102 CO 0.13 0.01 1.10 -2.16 -2.79 0.00 0.00 177.10 173.39 1b8t s PRO 103 N 0.86 1.99 0.14 0.43 0.04 -1.26 -5.07 135.00 132.13 1b8t s PRO 103 Ca -0.11 0.60 0.07 0.00 0.04 0.00 0.00 61.00 61.61 1b8t s PRO 103 Cb -0.15 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 1b8t s PRO 103 CO 0.01 -1.68 -0.05 0.54 0.04 0.00 0.00 177.00 175.87 1b8t s ASN 104 N -3.92 4.59 0.21 6.66 4.22 -1.26 -5.13 114.94 120.31 1b8t s ASN 104 Ca 0.61 -0.40 -0.11 0.00 -2.14 0.00 0.00 52.86 50.82 1b8t s ASN 104 Cb -0.14 -0.93 -0.00 0.00 1.28 0.00 0.00 41.25 41.45 1b8t s ASN 104 CO 0.54 0.13 0.40 0.00 -2.04 0.00 0.00 177.10 176.13 1b8t s ALA 105 N -1.50 -0.15 0.12 3.54 0.00 -1.26 -5.18 121.76 117.34 1b8t s ALA 105 Ca 0.25 -0.86 -0.08 0.00 0.00 0.00 0.00 51.96 51.26 1b8t s ALA 105 Cb -0.10 1.01 -0.01 0.00 0.00 0.00 0.00 23.12 24.02 1b8t s ALA 105 CO 0.16 -0.77 0.22 -1.54 0.00 0.00 0.00 175.76 173.84 1b8t s SER 106 N -3.00 0.10 0.06 0.00 1.04 -1.26 -5.18 113.70 105.46 1b8t s SER 106 Ca 0.20 -0.77 -0.11 0.00 0.48 0.00 0.00 55.95 55.75 1b8t s SER 106 Cb 0.01 0.38 0.01 0.00 0.10 0.00 0.00 66.02 66.52 1b8t s SER 106 CO 0.05 -0.80 0.24 0.00 0.98 0.00 0.00 173.24 173.71 1b8t s ARG 107 N -3.92 0.80 0.99 4.02 1.70 -1.26 -5.15 118.95 116.13 1b8t s ARG 107 Ca 0.11 -0.69 -0.15 0.00 -0.47 0.00 0.00 55.73 54.54 1b8t s ARG 107 Cb 0.04 0.33 0.02 0.00 -0.57 0.00 0.00 34.95 34.78 1b8t s ARG 107 CO -0.06 -0.25 0.15 0.00 -1.08 0.00 0.00 175.30 174.06 1b8t n MET 108 N 0.38 -0.49 -3.90 3.89 0.00 -1.26 -4.98 117.12 110.76 1b8t n MET 108 Ca -0.18 -0.11 -0.32 0.00 0.00 0.00 0.00 57.70 57.10 1b8t n MET 108 Cb 0.60 -1.71 -0.04 0.00 0.00 0.00 0.00 33.22 32.07 1b8t n MET 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1b8t s ALA 109 N -2.31 3.98 -0.18 3.17 0.00 -1.26 -5.09 121.76 120.07 1b8t s ALA 109 Ca 0.54 -0.80 -0.08 0.00 0.00 0.00 0.00 51.96 51.62 1b8t s ALA 109 Cb -0.18 -1.86 -0.04 0.00 0.00 0.00 0.00 23.12 21.03 1b8t s ALA 109 CO 0.69 0.80 0.08 -1.14 0.00 0.00 0.00 175.76 176.19 1b8t s GLN 110 N -2.34 4.00 0.99 0.00 0.74 -1.26 -5.10 119.66 116.69 1b8t s GLN 110 Ca 0.33 -0.30 -0.14 0.00 0.05 0.00 0.00 55.36 55.30 1b8t s GLN 110 Cb -0.13 -3.26 0.18 0.00 1.10 0.00 0.00 33.01 30.90 1b8t s GLN 110 CO 0.25 0.31 1.16 0.15 -0.55 0.00 0.00 175.29 176.62 1b8t s LYS 111 N 0.28 0.52 0.11 1.67 1.02 -1.26 -5.07 119.74 117.01 1b8t s LYS 111 Ca 0.05 0.10 0.07 0.00 0.02 0.00 0.00 55.97 56.21 1b8t s LYS 111 Cb -0.12 -1.78 -0.04 0.00 -0.52 0.00 0.00 37.83 35.37 1b8t s LYS 111 CO -0.00 -2.58 -0.06 0.54 -0.92 0.00 0.00 175.35 172.32 1b8t s VAL 112 N -3.31 3.57 -0.62 3.17 0.11 -1.26 -5.09 120.40 116.96 1b8t s VAL 112 Ca 0.67 -1.22 -0.08 0.00 -2.93 0.00 0.00 61.98 58.42 1b8t s VAL 112 Cb -0.12 -2.69 0.16 0.00 -1.53 0.00 0.00 36.38 32.20 1b8t s VAL 112 CO 0.54 0.09 0.49 -0.83 -3.33 0.00 0.00 175.10 172.06 1b8t s GLY 113 N -2.32 2.39 -0.02 6.54 0.00 -1.26 -5.06 107.32 107.58 1b8t s GLY 113 Ca 0.23 -3.04 -0.19 0.00 0.00 0.00 0.00 44.72 41.72 1b8t s GLY 113 CO 0.15 1.14 0.54 -0.32 0.00 0.00 0.00 173.10 174.62 1b8t s GLY 114 N 1.70 2.55 -0.12 0.20 0.00 -1.26 -4.01 107.32 106.37 1b8t s GLY 114 Ca 0.14 -0.05 -0.07 0.00 0.00 0.00 0.00 44.72 44.74 1b8t s GLY 114 CO -0.04 0.66 0.05 1.76 0.00 0.00 0.00 173.10 175.53 1b8t h SER 115 N 5.68 0.00 0.00 1.64 0.02 -1.83 -3.48 113.55 115.58 1b8t h SER 115 Ca -0.45 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.36 1b8t h SER 115 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 1b8t h SER 115 CO 0.69 0.67 0.00 0.47 -1.14 0.00 0.00 176.83 177.52 1b8t n ASP 116 N -4.70 0.00 -4.39 3.07 8.00 -0.58 -5.06 116.55 112.88 1b8t n ASP 116 Ca -0.04 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.25 1b8t n ASP 116 Cb 0.15 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.15 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 -0.08 2.05 -0.42 0.44 0.00 -1.26 -0.10 107.32 107.95 1b8t s GLY 117 Ca 0.00 -1.95 -0.14 0.00 0.00 0.00 0.00 44.72 42.63 1b8t s GLY 117 CO 0.00 -1.77 0.31 0.00 0.00 0.00 0.00 173.10 171.64 1b8t n PRO 119 N 5.14 0.75 0.00 0.00 -0.04 -1.25 0.30 135.00 139.90 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 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 1b8t n PRO 119 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1b8t n ARG 120 N -0.97 0.00 0.13 0.54 5.12 -1.26 -4.61 116.66 115.61 1b8t n ARG 120 Ca 0.17 0.10 -0.00 0.00 -1.93 0.00 0.00 57.85 56.18 1b8t n ARG 120 Cb 0.08 -0.53 0.10 0.00 -1.16 0.00 0.00 32.46 30.95 1b8t n ARG 120 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1b8t n GLY 122 N 0.74 3.36 3.77 0.00 0.00 0.15 -5.05 105.19 108.16 1b8t n GLY 122 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.79 4.13 1.00 1.61 -0.21 -1.23 -4.42 119.66 119.76 1b8t s GLN 123 Ca 0.00 2.10 -0.11 0.00 0.02 0.00 0.00 55.36 57.37 1b8t s GLN 123 Cb 0.00 -2.86 0.18 0.00 1.00 0.00 0.00 33.01 31.33 1b8t s GLN 123 CO 0.00 -0.33 1.01 0.00 -2.12 0.00 0.00 175.29 173.84 1b8t n ALA 124 N 0.37 -1.67 -3.80 6.09 0.00 -1.26 -0.00 120.51 120.24 1b8t n ALA 124 Ca 0.02 -0.76 -0.25 0.00 0.00 0.00 0.00 53.44 52.45 1b8t n ALA 124 Cb 0.44 -2.09 -0.17 0.00 0.00 0.00 0.00 19.45 17.63 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 -2.54 0.62 0.64 0.00 1.01 0.86 -4.49 120.40 116.50 1b8t s VAL 125 Ca 0.66 -0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.47 1b8t s VAL 125 Cb -0.23 -0.85 0.10 0.00 0.00 0.00 0.00 36.38 35.40 1b8t s VAL 125 CO 0.61 0.14 0.88 -0.31 0.00 0.00 0.00 175.10 176.42 1b8t s TYR 126 N 1.85 1.60 0.05 5.22 1.51 -1.26 -1.53 117.35 124.80 1b8t s TYR 126 Ca 0.03 -0.48 -0.11 0.00 -1.01 0.00 0.00 57.07 55.51 1b8t s TYR 126 Cb -0.14 -2.61 -0.02 0.00 -0.11 0.00 0.00 41.96 39.08 1b8t s TYR 126 CO -0.07 -1.38 1.18 0.00 -1.11 0.00 0.00 175.55 174.18 1b8t h ALA 127 N -0.14 -0.19 -2.66 3.71 0.00 -1.93 -3.36 119.26 114.68 1b8t h ALA 127 Ca -0.34 0.04 -0.52 0.00 0.00 0.00 0.00 54.91 54.09 1b8t h ALA 127 Cb 1.28 1.12 0.02 0.00 0.00 0.00 0.00 17.79 20.22 1b8t h ALA 127 CO 0.41 -0.33 0.60 0.00 0.00 0.00 0.00 179.25 179.92 1b8t s ALA 128 N -4.51 3.47 -0.30 0.00 0.00 -1.26 -3.75 121.76 115.42 1b8t s ALA 128 Ca -0.04 1.01 -0.02 0.00 0.00 0.00 0.00 51.96 52.92 1b8t s ALA 128 Cb 0.04 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 1b8t s ALA 128 CO 0.21 -0.45 0.26 -1.91 0.00 0.00 0.00 175.76 173.88 1b8t n GLU 129 N 2.62 -0.63 -3.83 0.00 4.07 -1.26 -5.05 120.64 116.56 1b8t n GLU 129 Ca 0.05 0.29 -0.12 0.00 -0.06 0.00 0.00 57.16 57.32 1b8t n GLU 129 Cb 0.44 -2.75 -0.12 0.00 -0.06 0.00 0.00 31.44 28.94 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 -3.37 0.20 0.04 5.31 -2.85 -1.25 -4.43 119.74 113.39 1b8t s LYS 130 Ca 0.12 0.12 0.03 0.00 -1.00 0.00 0.00 55.97 55.25 1b8t s LYS 130 Cb -0.02 0.09 -0.02 0.00 -2.06 0.00 0.00 37.83 35.83 1b8t s LYS 130 CO 0.21 -0.03 -0.11 0.54 0.10 0.00 0.00 175.35 176.07 1b8t s VAL 131 N -0.11 0.80 -0.19 1.79 0.11 0.15 -4.59 120.40 118.35 1b8t s VAL 131 Ca -0.02 -0.97 0.01 0.00 -2.93 0.00 0.00 61.98 58.07 1b8t s VAL 131 Cb -0.02 -0.78 0.03 0.00 -1.53 0.00 0.00 36.38 34.09 1b8t s VAL 131 CO 0.00 -0.16 -0.14 -0.63 -3.33 0.00 0.00 175.10 170.84 1b8t s ILE 132 N -1.02 1.83 -0.06 7.04 1.01 -1.26 -0.92 121.20 127.82 1b8t s ILE 132 Ca -0.03 -0.99 -0.09 0.00 0.00 0.00 0.00 60.65 59.54 1b8t s ILE 132 Cb -0.08 -1.79 0.02 0.00 0.01 0.00 0.00 42.46 40.62 1b8t s ILE 132 CO 0.01 0.32 0.23 -0.83 0.00 0.00 0.00 174.94 174.67 1b8t s GLY 133 N 1.34 -0.13 -1.46 6.18 0.00 0.12 -4.88 107.32 108.49 1b8t s GLY 133 Ca 0.01 0.48 -0.07 0.00 0.00 0.00 0.00 44.72 45.15 1b8t s GLY 133 CO -0.10 0.37 0.70 0.00 0.00 0.00 0.00 173.10 174.07 1b8t n ALA 134 N 2.50 -1.70 -3.58 3.20 0.00 -1.26 0.04 120.51 119.71 1b8t n ALA 134 Ca -0.15 -0.08 -0.27 0.00 0.00 0.00 0.00 53.44 52.94 1b8t n ALA 134 Cb 0.58 -2.71 0.01 0.00 0.00 0.00 0.00 19.45 17.32 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 -1.71 -0.49 3.08 0.00 0.00 -1.26 -4.78 105.19 100.02 1b8t n GLY 135 Ca -0.15 0.14 -0.08 0.00 0.00 0.00 0.00 46.02 45.93 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 -6.26 0.56 -0.07 1.61 -0.14 0.11 -5.16 119.74 110.39 1b8t s LYS 136 Ca 0.51 -1.01 0.03 0.00 -1.36 0.00 0.00 55.97 54.14 1b8t s LYS 136 Cb -0.26 0.20 -0.02 0.00 -1.68 0.00 0.00 37.83 36.07 1b8t s LYS 136 CO 0.63 -0.11 -0.16 -1.12 -0.76 0.00 0.00 175.35 173.83 1b8t s SER 137 N -2.50 3.83 0.31 2.83 0.01 -1.26 0.16 113.70 117.08 1b8t s SER 137 Ca 0.00 -0.29 -0.18 0.00 1.31 0.00 0.00 55.95 56.80 1b8t s SER 137 Cb 0.03 -1.00 0.03 0.00 0.21 0.00 0.00 66.02 65.28 1b8t s SER 137 CO -0.07 0.29 0.71 -1.66 0.41 0.00 0.00 173.24 172.91 1b8t s TRP 138 N -0.37 0.03 0.07 2.43 -2.14 -0.10 -3.85 118.94 115.01 1b8t s TRP 138 Ca 0.04 -0.54 -0.31 0.00 2.66 0.00 0.00 56.10 57.95 1b8t s TRP 138 Cb -0.12 0.66 -0.07 0.00 -3.10 0.00 0.00 33.47 30.84 1b8t s TRP 138 CO 0.02 -1.32 1.38 -1.01 -2.66 0.00 0.00 176.95 173.36 1b8t s HIS 139 N -3.36 3.13 -0.62 1.66 3.76 -1.26 0.31 115.29 118.91 1b8t s HIS 139 Ca 0.15 0.94 -0.25 0.00 -0.15 0.00 0.00 55.06 55.75 1b8t s HIS 139 Cb -0.05 -3.65 -0.21 0.00 1.11 0.00 0.00 32.58 29.78 1b8t s HIS 139 CO 0.09 -2.30 1.84 1.17 -0.85 0.00 0.00 174.74 174.69 1b8t n LYS 140 N 4.41 1.07 0.00 1.40 4.81 -1.26 -2.16 118.16 126.42 1b8t n LYS 140 Ca 0.12 -1.68 0.00 0.00 -0.87 0.00 0.00 58.31 55.88 1b8t n LYS 140 Cb 0.43 -2.92 0.00 0.00 0.02 0.00 0.00 35.03 32.56 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 8.98 0.00 0.22 3.14 2.88 -1.26 -4.94 113.62 122.65 1b8t n SER 141 Ca 0.48 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 58.09 1b8t n SER 141 Cb 0.42 0.00 0.59 0.00 -0.75 0.00 0.00 64.21 64.47 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 -4.50 0.30 -4.06 0.00 -0.00 -1.12 -4.64 117.46 103.45 1b8t n PHE 143 Ca -0.02 0.21 -0.24 0.00 -0.00 0.00 0.00 57.45 57.40 1b8t n PHE 143 Cb 0.11 -1.37 -0.04 0.00 -0.00 0.00 0.00 39.48 38.18 1b8t n PHE 143 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 1b8t s ARG 144 N 6.06 3.07 -0.05 -4.13 0.52 -1.26 0.31 118.95 123.47 1b8t s ARG 144 Ca 0.96 -0.89 -0.30 0.00 -0.52 0.00 0.00 55.73 54.98 1b8t s ARG 144 Cb -0.83 -2.70 -0.03 0.00 0.52 0.00 0.00 34.95 31.92 1b8t s ARG 144 CO 0.36 0.45 1.14 0.00 0.02 0.00 0.00 175.30 177.27 1b8t n ALA 146 N 4.97 4.31 0.00 0.00 0.00 0.09 -0.19 120.51 129.69 1b8t n ALA 146 Ca 0.10 -1.39 0.00 0.00 0.00 0.00 0.00 53.44 52.15 1b8t n ALA 146 Cb 0.47 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.67 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 -0.01 0.00 -0.01 0.00 4.76 -1.26 -4.86 118.16 116.78 1b8t n LYS 147 Ca 0.27 0.00 0.04 0.00 -2.87 0.00 0.00 58.31 55.76 1b8t n LYS 147 Cb 0.87 -0.35 -0.08 0.00 -1.84 0.00 0.00 35.03 33.62 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 1.94 0.46 3.93 0.00 0.00 0.74 -5.02 105.19 107.24 1b8t n GLY 149 Ca -0.03 -0.81 -0.30 0.00 0.00 0.00 0.00 46.02 44.88 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 -1.49 0.86 0.11 1.61 2.20 -1.24 -4.66 119.74 117.12 1b8t s LYS 150 Ca 0.00 -0.34 -0.06 0.00 -0.36 0.00 0.00 55.97 55.21 1b8t s LYS 150 Cb 0.00 -1.87 -0.06 0.00 -1.51 0.00 0.00 37.83 34.40 1b8t s LYS 150 CO 0.00 -2.28 0.37 -1.54 -0.36 0.00 0.00 175.35 171.54 1b8t s SER 151 N -4.84 6.54 0.25 1.43 1.04 -1.26 0.09 113.70 116.94 1b8t s SER 151 Ca 0.72 0.65 0.03 0.00 0.48 0.00 0.00 55.95 57.83 1b8t s SER 151 Cb -0.05 -2.12 -0.01 0.00 0.10 0.00 0.00 66.02 63.94 1b8t s SER 151 CO 0.52 0.11 0.10 0.18 0.98 0.00 0.00 173.24 175.13 1b8t n LEU 152 N 0.45 0.00 -2.23 2.42 4.77 0.15 -4.78 117.00 117.78 1b8t n LEU 152 Ca -0.05 -1.96 -0.02 0.00 -0.03 0.00 0.00 56.01 53.95 1b8t n LEU 152 Cb 0.52 0.70 0.06 0.00 -2.33 0.00 0.00 43.42 42.36 1b8t n LEU 152 CO 0.46 -0.31 0.37 -1.84 -1.33 0.00 0.00 177.39 174.75 1b8t n GLU 153 N -0.55 1.01 0.00 3.23 0.28 -1.26 -4.53 120.64 118.82 1b8t n GLU 153 Ca -0.03 -1.76 0.00 0.00 -0.16 0.00 0.00 57.16 55.22 1b8t n GLU 153 Cb 0.38 -0.05 0.00 0.00 1.43 0.00 0.00 31.44 33.20 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 -0.80 0.00 -0.01 -1.84 2.88 -1.26 -4.47 113.62 108.12 1b8t n SER 154 Ca -0.12 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.30 1b8t n SER 154 Cb 0.85 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.25 1b8t n SER 154 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1b8t h THR 155 N 0.00 0.14 -0.50 2.46 2.02 -2.01 0.92 112.91 115.93 1b8t h THR 155 Ca 0.00 0.00 -0.30 0.00 0.77 0.00 0.00 66.41 66.88 1b8t h THR 155 Cb 0.00 0.14 -0.15 0.00 -1.74 0.00 0.00 68.15 66.40 1b8t h THR 155 CO 0.00 0.00 0.39 1.07 0.37 0.00 0.00 175.52 177.35 1b8t n THR 156 N -5.43 2.48 -4.50 3.16 5.66 -1.26 -4.87 114.28 109.51 1b8t n THR 156 Ca -0.04 -1.35 -0.34 0.00 -3.05 0.00 0.00 64.05 59.27 1b8t n THR 156 Cb 0.36 -1.03 -0.10 0.00 -1.55 0.00 0.00 70.33 68.00 1b8t n THR 156 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 1b8t s LEU 157 N -1.80 3.33 -0.21 1.09 2.96 0.31 -0.91 118.68 123.45 1b8t s LEU 157 Ca 0.31 0.02 0.02 0.00 -0.22 0.00 0.00 54.13 54.25 1b8t s LEU 157 Cb 0.25 -1.77 0.04 0.00 0.50 0.00 0.00 46.19 45.21 1b8t s LEU 157 CO 0.02 0.35 -0.14 0.00 -1.32 0.00 0.00 176.35 175.26 1b8t s ALA 158 N -0.88 2.29 -0.74 5.97 0.00 0.12 -4.77 121.76 123.74 1b8t s ALA 158 Ca 0.14 -1.36 -0.17 0.00 0.00 0.00 0.00 51.96 50.57 1b8t s ALA 158 Cb -0.11 -1.32 0.15 0.00 0.00 0.00 0.00 23.12 21.84 1b8t s ALA 158 CO 0.03 -0.73 0.80 0.16 0.00 0.00 0.00 175.76 176.02 1b8t s ASP 159 N 1.27 6.48 0.01 0.00 -4.77 -1.26 -0.06 116.67 118.35 1b8t s ASP 159 Ca -0.01 -2.05 0.04 0.00 -3.30 0.00 0.00 52.55 47.24 1b8t s ASP 159 Cb -0.16 -2.28 -0.01 0.00 -1.09 0.00 0.00 42.92 39.38 1b8t s ASP 159 CO -0.09 -0.89 -0.13 -0.54 0.70 0.00 0.00 175.17 174.22 1b8t s LYS 160 N 1.68 0.99 -1.09 2.11 -0.14 0.60 -4.83 119.74 119.07 1b8t s LYS 160 Ca 0.17 -0.57 -0.21 0.00 -1.36 0.00 0.00 55.97 54.00 1b8t s LYS 160 Cb -0.16 -0.97 0.01 0.00 -1.68 0.00 0.00 37.83 35.03 1b8t s LYS 160 CO -0.03 0.26 0.74 -0.25 -0.76 0.00 0.00 175.35 175.31 1b8t n ASP 161 N 2.42 -5.15 -3.15 2.83 8.00 -1.26 0.23 116.55 120.47 1b8t n ASP 161 Ca -0.16 -1.02 -0.17 0.00 0.71 0.00 0.00 54.79 54.16 1b8t n ASP 161 Cb 0.55 -2.86 -0.03 0.00 -0.02 0.00 0.00 41.12 38.76 1b8t n ASP 161 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1b8t n GLY 162 N -1.79 -0.42 3.18 0.44 0.00 -1.26 -4.85 105.19 100.49 1b8t n GLY 162 Ca -0.12 0.03 -0.13 0.00 0.00 0.00 0.00 46.02 45.80 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 -5.46 0.85 -0.12 1.61 2.02 0.14 -5.07 118.70 112.66 1b8t s GLU 163 Ca 0.32 -1.21 0.01 0.00 0.02 0.00 0.00 54.97 54.11 1b8t s GLU 163 Cb -0.19 -0.44 -0.01 0.00 0.10 0.00 0.00 34.13 33.59 1b8t s GLU 163 CO 0.40 0.05 -0.15 0.96 0.02 0.00 0.00 175.26 176.54 1b8t s ILE 164 N -2.79 2.88 0.25 -1.63 -4.36 -1.26 -0.29 121.20 114.01 1b8t s ILE 164 Ca 0.07 -0.73 0.04 0.00 -0.26 0.00 0.00 60.65 59.78 1b8t s ILE 164 Cb -0.01 -2.19 -0.02 0.00 1.25 0.00 0.00 42.46 41.50 1b8t s ILE 164 CO -0.01 0.53 0.15 -1.22 0.24 0.00 0.00 174.94 174.63 1b8t n TYR 165 N 3.44 -0.24 -3.81 1.37 4.01 0.91 -0.74 117.16 122.11 1b8t n TYR 165 Ca -0.18 -1.86 -0.34 0.00 -0.16 0.00 0.00 57.90 55.35 1b8t n TYR 165 Cb 0.53 0.10 -0.05 0.00 -0.31 0.00 0.00 39.34 39.61 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 4.00 0.31 -0.50 0.00 3.64 -1.33 1.64 116.57 124.33 1b8t h LYS 167 Ca -0.50 -0.02 0.11 0.00 -1.27 0.00 0.00 60.65 58.97 1b8t h LYS 167 Cb 1.20 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.92 1b8t h LYS 167 CO 0.66 0.21 0.35 0.78 -2.27 0.00 0.00 179.45 179.18 1b8t h GLY 168 N 0.32 0.29 0.37 5.01 0.00 -1.93 0.34 103.07 107.46 1b8t h GLY 168 Ca 0.65 -0.08 -0.13 0.00 0.00 0.00 0.00 47.33 47.76 1b8t h GLY 168 CO -0.60 0.05 -0.63 0.00 0.00 0.00 0.00 176.54 175.35 1b8t h TYR 170 N -0.64 0.13 0.00 0.00 3.20 0.17 0.46 116.97 120.29 1b8t h TYR 170 Ca -0.13 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.75 1b8t h TYR 170 Cb 1.40 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.63 1b8t h TYR 170 CO 0.21 0.06 -0.17 0.00 -1.64 0.00 0.00 178.16 176.63 1b8t h ALA 171 N 1.77 0.00 -0.07 1.82 0.00 -0.44 -3.29 119.26 119.06 1b8t h ALA 171 Ca 0.21 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1b8t h ALA 171 Cb 0.69 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1b8t h ALA 171 CO -0.03 0.17 -0.16 0.87 0.00 0.00 0.00 179.25 180.10 1b8t h LYS 172 N -0.44 -0.15 -1.48 0.00 1.79 -0.90 0.47 116.57 115.86 1b8t h LYS 172 Ca 0.00 0.01 0.48 0.00 -2.18 0.00 0.00 60.65 58.96 1b8t h LYS 172 Cb 0.17 0.03 -0.11 0.00 -1.58 0.00 0.00 32.23 30.74 1b8t h LYS 172 CO 0.00 -0.10 1.00 -1.71 -1.08 0.00 0.00 179.45 177.56 1b8t n ASN 173 N -3.43 0.13 -2.94 0.86 5.15 0.16 0.96 115.26 116.14 1b8t n ASN 173 Ca -0.02 1.17 -0.29 0.00 -0.60 0.00 0.00 54.58 54.85 1b8t n ASN 173 Cb 0.11 -0.58 -0.03 0.00 -0.53 0.00 0.00 39.78 38.75 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 -4.31 3.80 -4.04 1.20 3.01 0.15 -5.03 117.46 112.24 1b8t n PHE 174 Ca 0.39 -3.66 -0.08 0.00 1.01 0.00 0.00 57.45 55.11 1b8t n PHE 174 Cb 1.61 -0.52 -0.10 0.00 -0.01 0.00 0.00 39.48 40.47 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 -3.20 0.37 0.60 1.37 0.00 0.27 -4.78 107.32 101.95 1b8t s GLY 175 Ca 0.48 -0.98 -0.15 0.00 0.00 0.00 0.00 44.72 44.07 1b8t s GLY 175 CO -0.15 -1.09 1.05 2.56 0.00 0.00 0.00 173.10 175.46 1b8t s PRO 176 N -3.32 3.32 0.44 2.90 0.04 -1.26 -5.00 135.00 132.12 1b8t s PRO 176 Ca 0.01 1.13 0.08 0.00 0.04 0.00 0.00 61.00 62.26 1b8t s PRO 176 Cb 0.03 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.54 1b8t s PRO 176 CO -0.08 -0.80 0.48 0.15 0.04 0.00 0.00 177.00 176.79 1b8t s LYS 177 N -4.25 2.60 0.15 4.56 1.02 -1.26 -5.13 119.74 117.43 1b8t s LYS 177 Ca 0.62 -1.47 0.10 0.00 0.02 0.00 0.00 55.97 55.25 1b8t s LYS 177 Cb -0.15 -2.52 -0.04 0.00 -0.52 0.00 0.00 37.83 34.60 1b8t s LYS 177 CO 0.40 -0.30 -0.24 0.20 -0.92 0.00 0.00 175.35 174.49 1b8t s GLY 178 N -4.26 1.53 -0.18 -3.33 0.00 -1.26 -5.06 107.32 94.75 1b8t s GLY 178 Ca 0.51 -1.48 -0.19 0.00 0.00 0.00 0.00 44.72 43.57 1b8t s GLY 178 CO 0.30 -1.48 0.20 -2.75 0.00 0.00 0.00 173.10 169.37 1b8t h PHE 179 N 3.65 0.00 0.00 1.90 3.57 -2.08 -3.51 116.94 120.46 1b8t h PHE 179 Ca -0.48 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.02 1b8t h PHE 179 Cb 1.19 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.93 1b8t h PHE 179 CO 0.64 1.00 0.00 0.41 -2.23 0.00 0.00 178.31 178.13 1b8t n GLY 180 N 1.52 0.99 3.83 2.40 0.00 -1.26 -5.16 105.19 107.51 1b8t n GLY 180 Ca -0.21 -1.93 -0.06 0.00 0.00 0.00 0.00 46.02 43.82 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 -1.36 -0.17 0.00 1.61 -0.71 -1.26 -5.18 117.98 110.90 1b8t s PHE 181 Ca 0.00 -0.24 0.00 0.00 -1.04 0.00 0.00 56.93 55.65 1b8t s PHE 181 Cb 0.00 0.69 0.00 0.00 -1.21 0.00 0.00 43.02 42.50 1b8t s PHE 181 CO 0.00 -1.12 0.00 0.41 -1.34 0.00 0.00 175.22 173.17 1b8t n GLY 182 N -0.46 0.22 0.03 1.99 0.00 -1.26 -5.03 105.19 100.67 1b8t n GLY 182 Ca -0.05 -1.14 -0.04 0.00 0.00 0.00 0.00 46.02 44.80 1b8t n GLY 182 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b8t n GLN 183 N -0.73 2.29 -0.48 1.61 10.64 -1.26 -5.09 117.38 124.36 1b8t n GLN 183 Ca 0.00 0.01 0.00 0.00 -1.83 0.00 0.00 57.00 55.18 1b8t n GLN 183 Cb 0.00 -1.16 0.00 0.00 -0.86 0.00 0.00 30.24 28.22 1b8t n GLN 183 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1b8t n GLY 184 N 2.75 -0.54 2.75 2.61 0.00 -1.26 -5.10 105.19 106.40 1b8t n GLY 184 Ca -0.11 -0.54 -0.06 0.00 0.00 0.00 0.00 46.02 45.31 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 -0.06 -1.68 -2.46 4.61 0.00 -1.26 -5.15 120.51 114.51 1b8t n ALA 185 Ca 0.00 -1.19 -0.30 0.00 0.00 0.00 0.00 53.44 51.95 1b8t n ALA 185 Cb 0.00 -1.43 -0.12 0.00 0.00 0.00 0.00 19.45 17.90 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 -0.21 1.60 0.19 0.00 0.00 -1.26 -4.98 107.32 102.66 1b8t s GLY 186 Ca 0.31 -1.26 0.00 0.00 0.00 0.00 0.00 44.72 43.77 1b8t s GLY 186 CO -0.13 -1.18 0.00 0.00 0.00 0.00 0.00 173.10 171.78 1b8t n ALA 187 N 1.30 -2.21 -3.39 3.20 0.00 -1.26 -5.07 120.51 113.08 1b8t n ALA 187 Ca -0.16 0.40 0.02 0.00 0.00 0.00 0.00 53.44 53.69 1b8t n ALA 187 Cb 0.52 -1.29 -0.03 0.00 0.00 0.00 0.00 19.45 18.65 1b8t n ALA 187 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1b8t s LEU 188 N -0.57 -0.79 0.13 0.00 0.20 -1.26 -5.15 118.68 111.24 1b8t s LEU 188 Ca 0.00 0.91 -0.26 0.00 0.69 0.00 0.00 54.13 55.47 1b8t s LEU 188 Cb 0.00 1.83 -0.07 0.00 -0.43 0.00 0.00 46.19 47.52 1b8t s LEU 188 CO 0.00 -0.15 0.82 -0.63 -0.29 0.00 0.00 176.35 176.10 1b8t s ILE 189 N 2.67 4.47 0.19 6.68 1.09 -1.26 -4.77 121.20 130.27 1b8t s ILE 189 Ca -0.00 1.78 0.00 0.00 -1.10 0.00 0.00 60.65 61.33 1b8t s ILE 189 Cb -0.09 -4.18 0.00 0.00 -1.06 0.00 0.00 42.46 37.13 1b8t s ILE 189 CO -0.17 0.44 0.00 1.57 -0.10 0.00 0.00 174.94 176.68 1b8t n HIS 190 N 2.14 -2.83 0.17 3.97 -0.00 -1.26 -4.92 115.22 112.50 1b8t n HIS 190 Ca -0.03 1.55 -0.10 0.00 0.46 0.00 0.00 57.72 59.61 1b8t n HIS 190 Cb 0.49 -2.85 -0.05 0.00 -0.12 0.00 0.00 29.99 27.46 1b8t n HIS 190 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1b8t h SER 191 N 2.02 -0.43 0.00 0.26 0.87 -2.07 -3.55 113.55 110.65 1b8t h SER 191 Ca 0.00 -0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.49 1b8t h SER 191 Cb 0.00 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1b8t h SER 191 CO 0.00 0.01 0.00 0.00 -0.53 0.00 0.00 176.83 176.31