#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 -0.59 -0.08 0.03 0.04 -1.26 -5.10 135.00 128.04 1b8t s PRO 2 Ca 0.00 -0.37 -0.15 0.00 0.04 0.00 0.00 61.00 60.52 1b8t s PRO 2 Cb 0.00 -1.70 0.03 0.00 0.04 0.00 0.00 34.50 32.87 1b8t s PRO 2 CO 0.00 -3.24 0.36 1.21 0.04 0.00 0.00 177.00 175.37 1b8t s ASN 3 N -4.50 -0.31 -0.25 6.66 3.84 -1.26 -5.16 114.94 113.95 1b8t s ASN 3 Ca 0.75 0.46 -0.37 0.00 0.21 0.00 0.00 52.86 53.90 1b8t s ASN 3 Cb -0.05 0.56 0.15 0.00 -0.55 0.00 0.00 41.25 41.36 1b8t s ASN 3 CO 0.55 -0.29 1.38 0.86 -2.79 0.00 0.00 177.10 176.81 1b8t s TRP 4 N -0.54 -0.02 0.00 0.43 -0.00 -1.26 -5.19 118.94 112.37 1b8t s TRP 4 Ca -0.06 0.01 0.00 0.00 -0.00 0.00 0.00 56.10 56.04 1b8t s TRP 4 Cb -0.04 0.50 0.00 0.00 -0.00 0.00 0.00 33.47 33.94 1b8t s TRP 4 CO 0.03 -0.03 0.00 0.41 -0.00 0.00 0.00 176.95 177.35 1b8t n GLY 5 N -0.10 3.53 0.00 5.86 0.00 -1.26 -5.19 105.19 108.03 1b8t n GLY 5 Ca 0.03 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.05 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 -1.25 2.97 0.00 -0.02 0.00 -1.26 -5.15 105.19 100.48 1b8t n GLY 6 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.11 4.01 3.59 -0.02 0.00 -1.26 -4.59 105.19 105.81 1b8t n GLY 7 Ca 0.00 -1.57 -0.23 0.00 0.00 0.00 0.00 46.02 44.22 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 -1.54 0.70 -4.05 1.61 4.76 0.06 -4.93 118.16 114.78 1b8t n LYS 8 Ca 0.00 -3.14 -0.29 0.00 -2.87 0.00 0.00 58.31 52.01 1b8t n LYS 8 Cb 0.00 0.19 -0.17 0.00 -1.84 0.00 0.00 35.03 33.21 1b8t n LYS 8 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1b8t s LYS 9 N -4.21 2.17 -0.47 1.97 2.20 -1.26 0.08 119.74 120.21 1b8t s LYS 9 Ca 0.37 -0.51 -0.28 0.00 -0.36 0.00 0.00 55.97 55.19 1b8t s LYS 9 Cb -0.03 -2.00 0.01 0.00 -1.51 0.00 0.00 37.83 34.30 1b8t s LYS 9 CO 0.23 -0.22 1.45 0.00 -0.36 0.00 0.00 175.35 176.46 1b8t n GLY 11 N 5.20 -0.90 0.00 0.00 0.00 -1.23 -0.09 105.19 108.17 1b8t n GLY 11 Ca 0.16 -0.12 -0.00 0.00 0.00 0.00 0.00 46.02 46.05 1b8t n GLY 11 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1b8t n VAL 12 N -0.83 0.08 0.17 1.61 0.31 -1.26 -4.56 118.33 113.85 1b8t n VAL 12 Ca 0.14 0.48 0.05 0.00 -0.01 0.00 0.00 64.34 65.01 1b8t n VAL 12 Cb 0.06 -1.55 0.18 0.00 -0.91 0.00 0.00 33.84 31.62 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 -4.78 0.00 -0.06 0.88 -5.06 117.38 105.06 1b8t n GLN 14 Ca 0.01 0.12 -0.30 0.00 -2.00 0.00 0.00 57.00 54.83 1b8t n GLN 14 Cb 0.62 -2.86 -0.14 0.00 -4.06 0.00 0.00 30.24 23.81 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 -2.80 1.95 0.24 3.69 1.02 -1.08 -4.88 119.74 117.89 1b8t s LYS 15 Ca 0.00 -1.04 -0.30 0.00 0.02 0.00 0.00 55.97 54.65 1b8t s LYS 15 Cb 0.00 -2.09 -0.09 0.00 -0.52 0.00 0.00 37.83 35.12 1b8t s LYS 15 CO 0.00 0.53 1.31 0.00 -0.92 0.00 0.00 175.35 176.27 1b8t s ALA 16 N -0.87 3.52 -0.25 5.17 0.00 -1.26 -0.20 121.76 127.87 1b8t s ALA 16 Ca 0.13 1.15 -0.09 0.00 0.00 0.00 0.00 51.96 53.16 1b8t s ALA 16 Cb -0.10 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.50 1b8t s ALA 16 CO 0.04 -0.55 0.12 0.08 0.00 0.00 0.00 175.76 175.44 1b8t s VAL 17 N -0.31 4.74 -0.04 0.00 1.01 0.11 -4.83 120.40 121.09 1b8t s VAL 17 Ca 0.54 -0.03 -0.30 0.00 0.00 0.00 0.00 61.98 62.19 1b8t s VAL 17 Cb -0.38 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 1b8t s VAL 17 CO 0.43 0.32 1.29 -0.72 0.00 0.00 0.00 175.10 176.42 1b8t s TYR 18 N 1.55 3.01 -0.62 5.22 1.13 -1.26 -0.76 117.35 125.63 1b8t s TYR 18 Ca 0.06 1.02 -0.39 0.00 -1.41 0.00 0.00 57.07 56.35 1b8t s TYR 18 Cb -0.15 -3.54 -0.19 0.00 -1.10 0.00 0.00 41.96 36.98 1b8t s TYR 18 CO 0.06 -1.85 2.21 0.34 -2.51 0.00 0.00 175.55 173.80 1b8t n PHE 19 N 5.38 0.96 0.04 -3.49 7.35 -1.26 -3.98 117.46 122.46 1b8t n PHE 19 Ca 0.12 0.64 0.00 0.00 -0.76 0.00 0.00 57.45 57.45 1b8t n PHE 19 Cb 0.45 -2.23 0.00 0.00 0.35 0.00 0.00 39.48 38.05 1b8t n PHE 19 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1b8t n ALA 20 N 8.04 0.00 -0.64 3.13 0.00 -1.26 -5.03 120.51 124.75 1b8t n ALA 20 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 53.44 54.00 1b8t n ALA 20 Cb -0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.43 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 -2.98 0.00 -3.12 0.00 4.07 -1.26 -5.08 120.64 112.27 1b8t n GLU 21 Ca 0.00 0.00 -0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1b8t n GLU 21 Cb 0.00 -0.06 -0.00 0.00 -0.06 0.00 0.00 31.44 31.31 1b8t n GLU 21 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 1b8t n GLU 22 N -1.66 -0.80 -2.13 5.31 2.13 -1.26 -4.74 120.64 117.49 1b8t n GLU 22 Ca 0.00 1.07 -0.43 0.00 0.66 0.00 0.00 57.16 58.46 1b8t n GLU 22 Cb 0.00 -1.35 -0.03 0.00 0.27 0.00 0.00 31.44 30.34 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 -0.83 3.75 0.48 6.31 1.01 0.13 -4.84 120.40 126.41 1b8t s VAL 23 Ca -0.01 0.87 -0.04 0.00 0.00 0.00 0.00 61.98 62.81 1b8t s VAL 23 Cb 0.00 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 1b8t s VAL 23 CO 0.07 -0.20 0.76 -1.58 0.00 0.00 0.00 175.10 174.15 1b8t s GLN 24 N 4.31 3.34 -0.47 2.72 2.00 -1.26 0.06 119.66 130.37 1b8t s GLN 24 Ca 0.69 -0.01 0.06 0.00 -2.00 0.00 0.00 55.36 54.11 1b8t s GLN 24 Cb -0.27 -2.42 0.23 0.00 0.80 0.00 0.00 33.01 31.35 1b8t s GLN 24 CO 0.27 -0.27 0.75 0.00 -0.50 0.00 0.00 175.29 175.54 1b8t n GLU 26 N 1.90 0.00 -0.02 0.00 4.71 -1.26 -1.03 120.64 124.94 1b8t n GLU 26 Ca 0.14 0.00 -0.00 0.00 -0.01 0.00 0.00 57.16 57.29 1b8t n GLU 26 Cb 0.59 0.00 -0.05 0.00 -1.01 0.00 0.00 31.44 30.97 1b8t n GLU 26 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1b8t n GLY 27 N 0.00 -0.29 3.96 0.62 0.00 -1.26 -5.04 105.19 103.18 1b8t n GLY 27 Ca 0.00 -0.12 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.28 4.60 -0.29 1.61 0.01 -0.20 -5.11 113.70 111.03 1b8t s SER 28 Ca -0.03 0.08 -0.16 0.00 1.31 0.00 0.00 55.95 57.15 1b8t s SER 28 Cb 0.03 -0.64 0.15 0.00 0.21 0.00 0.00 66.02 65.77 1b8t s SER 28 CO 0.25 -1.69 0.99 -0.55 0.41 0.00 0.00 173.24 172.65 1b8t s SER 29 N -4.60 -0.50 0.23 2.44 0.15 -1.26 -0.15 113.70 110.00 1b8t s SER 29 Ca 0.63 0.79 -0.05 0.00 0.70 0.00 0.00 55.95 58.01 1b8t s SER 29 Cb -0.08 1.26 -0.02 0.00 -1.71 0.00 0.00 66.02 65.47 1b8t s SER 29 CO 0.44 -0.12 0.28 -0.36 1.20 0.00 0.00 173.24 174.68 1b8t s PHE 30 N 1.48 0.86 0.81 3.44 0.08 0.11 -3.56 117.98 121.20 1b8t s PHE 30 Ca -0.08 -1.13 -0.12 0.00 0.12 0.00 0.00 56.93 55.72 1b8t s PHE 30 Cb -0.04 -0.26 0.08 0.00 -0.57 0.00 0.00 43.02 42.24 1b8t s PHE 30 CO -0.15 -0.80 1.15 -1.01 -0.10 0.00 0.00 175.22 174.31 1b8t s HIS 31 N -4.05 2.02 0.33 0.36 3.76 -1.26 0.18 115.29 116.63 1b8t s HIS 31 Ca 0.32 1.67 0.07 0.00 -0.15 0.00 0.00 55.06 56.97 1b8t s HIS 31 Cb 0.04 -3.31 0.75 0.00 1.11 0.00 0.00 32.58 31.17 1b8t s HIS 31 CO 0.11 -2.45 1.83 1.57 -0.85 0.00 0.00 174.74 174.95 1b8t h LYS 32 N -1.11 0.74 -1.00 1.40 5.09 -1.95 0.61 116.57 120.36 1b8t h LYS 32 Ca -0.45 -0.04 -0.31 0.00 0.09 0.00 0.00 60.65 59.94 1b8t h LYS 32 Cb 1.27 -0.17 -0.18 0.00 0.10 0.00 0.00 32.23 33.25 1b8t h LYS 32 CO 0.47 0.49 0.39 0.45 -2.09 0.00 0.00 179.45 179.16 1b8t n SER 33 N -4.63 3.45 -0.59 7.07 2.88 -1.26 -3.58 113.62 116.97 1b8t n SER 33 Ca 0.20 -2.95 0.04 0.00 -1.33 0.00 0.00 58.87 54.83 1b8t n SER 33 Cb 0.49 -0.70 0.07 0.00 -0.75 0.00 0.00 64.21 63.32 1b8t n SER 33 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1b8t n PHE 35 N -0.45 1.87 -3.83 0.00 -0.00 -1.23 -4.70 117.46 109.12 1b8t n PHE 35 Ca 0.08 -3.94 -0.14 0.00 -0.00 0.00 0.00 57.45 53.45 1b8t n PHE 35 Cb 0.77 -0.36 -0.15 0.00 -0.00 0.00 0.00 39.48 39.74 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 -1.31 1.48 -0.37 -2.13 0.20 -1.26 -1.47 118.68 113.82 1b8t s LEU 36 Ca 0.32 0.02 -0.38 0.00 0.69 0.00 0.00 54.13 54.77 1b8t s LEU 36 Cb 0.05 -0.05 -0.14 0.00 -0.43 0.00 0.00 46.19 45.61 1b8t s LEU 36 CO -0.13 -0.07 2.08 0.00 -0.29 0.00 0.00 176.35 177.93 1b8t n MET 38 N 7.39 0.96 -0.01 0.00 2.81 -0.10 -0.19 117.12 127.99 1b8t n MET 38 Ca 0.41 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 56.29 1b8t n MET 38 Cb 0.14 -1.09 -0.00 0.00 -0.71 0.00 0.00 33.22 31.56 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 -0.59 0.20 0.17 2.03 0.31 -1.26 -4.65 118.33 114.53 1b8t n VAL 39 Ca 0.04 0.40 0.05 0.00 -0.01 0.00 0.00 64.34 64.82 1b8t n VAL 39 Cb 0.02 -1.54 0.12 0.00 -0.91 0.00 0.00 33.84 31.53 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 -3.24 0.00 -3.94 0.00 4.81 0.74 -5.04 118.16 111.48 1b8t n LYS 41 Ca 0.02 0.24 -0.35 0.00 -0.87 0.00 0.00 58.31 57.35 1b8t n LYS 41 Cb 0.65 -2.90 -0.10 0.00 0.02 0.00 0.00 35.03 32.70 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 -2.17 3.94 0.50 1.64 2.47 -1.13 -4.82 119.74 120.16 1b8t s LYS 42 Ca 0.00 -0.36 -0.21 0.00 -1.56 0.00 0.00 55.97 53.84 1b8t s LYS 42 Cb 0.00 -3.27 -0.09 0.00 -1.46 0.00 0.00 37.83 33.02 1b8t s LYS 42 CO 0.00 0.18 0.88 0.27 0.16 0.00 0.00 175.35 176.84 1b8t n ASN 43 N 3.82 0.56 -4.03 1.43 0.23 -1.26 0.27 115.26 116.28 1b8t n ASN 43 Ca -0.16 0.91 -0.31 0.00 -0.53 0.00 0.00 54.58 54.48 1b8t n ASN 43 Cb 0.52 -1.31 -0.15 0.00 -2.08 0.00 0.00 39.78 36.76 1b8t n ASN 43 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1b8t s LEU 44 N -0.56 3.94 -0.43 -4.53 1.43 -0.54 -4.64 118.68 113.34 1b8t s LEU 44 Ca 0.68 -1.74 0.10 0.00 -1.03 0.00 0.00 54.13 52.14 1b8t s LEU 44 Cb -0.50 -1.53 0.38 0.00 0.03 0.00 0.00 46.19 44.56 1b8t s LEU 44 CO 0.54 -0.29 0.89 0.47 0.23 0.00 0.00 176.35 178.19 1b8t n ASP 45 N 4.38 2.62 -3.60 2.29 9.92 -1.26 -4.69 116.55 126.21 1b8t n ASP 45 Ca -0.05 -3.26 0.02 0.00 -0.53 0.00 0.00 54.79 50.96 1b8t n ASP 45 Cb 0.42 -0.56 -0.00 0.00 -0.64 0.00 0.00 41.12 40.34 1b8t n ASP 45 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1b8t s SER 46 N -3.04 -0.04 0.91 -2.24 1.04 -1.26 -5.17 113.70 103.90 1b8t s SER 46 Ca 0.41 -0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.77 1b8t s SER 46 Cb 0.36 0.10 0.00 0.00 0.10 0.00 0.00 66.02 66.58 1b8t s SER 46 CO -0.09 -0.19 0.00 1.07 0.98 0.00 0.00 173.24 175.01 1b8t n THR 47 N -0.45 0.00 -1.11 2.02 5.66 -1.26 -3.84 114.28 115.30 1b8t n THR 47 Ca -0.08 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 60.88 1b8t n THR 47 Cb 0.63 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.39 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 -2.87 0.00 -3.55 1.09 -1.04 -1.26 -4.95 114.28 101.70 1b8t n THR 48 Ca 0.00 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.67 1b8t n THR 48 Cb 0.00 -1.02 -0.05 0.00 -1.82 0.00 0.00 70.33 67.44 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 -1.48 5.07 0.29 12.58 0.11 -1.25 -0.81 120.40 134.90 1b8t s VAL 49 Ca 0.00 0.43 0.06 0.00 -2.93 0.00 0.00 61.98 59.54 1b8t s VAL 49 Cb 0.00 -3.65 -0.06 0.00 -1.53 0.00 0.00 36.38 31.14 1b8t s VAL 49 CO 0.00 0.21 -0.04 0.00 -3.33 0.00 0.00 175.10 171.94 1b8t s ALA 50 N -1.48 2.38 0.46 1.54 0.00 0.09 -4.82 121.76 119.92 1b8t s ALA 50 Ca 0.36 -1.93 0.04 0.00 0.00 0.00 0.00 51.96 50.43 1b8t s ALA 50 Cb -0.13 0.23 -0.05 0.00 0.00 0.00 0.00 23.12 23.17 1b8t s ALA 50 CO 0.19 -0.10 0.01 0.08 0.00 0.00 0.00 175.76 175.94 1b8t s VAL 51 N -3.03 1.60 -0.30 0.00 1.01 -1.26 -1.20 120.40 117.22 1b8t s VAL 51 Ca 0.30 -2.00 -0.07 0.00 0.00 0.00 0.00 61.98 60.22 1b8t s VAL 51 Cb 0.04 -2.60 0.19 0.00 0.00 0.00 0.00 36.38 34.01 1b8t s VAL 51 CO 0.12 0.00 0.92 -2.28 0.00 0.00 0.00 175.10 173.86 1b8t s HIS 52 N -2.79 -0.86 0.00 5.22 5.04 0.14 -4.73 115.29 117.30 1b8t s HIS 52 Ca 0.21 0.56 0.00 0.00 -1.54 0.00 0.00 55.06 54.29 1b8t s HIS 52 Cb 0.06 0.17 0.00 0.00 0.04 0.00 0.00 32.58 32.85 1b8t s HIS 52 CO 0.11 -0.50 0.00 0.41 -2.34 0.00 0.00 174.74 172.42 1b8t n GLY 53 N 5.24 1.18 2.24 1.59 0.00 -1.26 0.23 105.19 114.41 1b8t n GLY 53 Ca 0.06 0.56 -0.28 0.00 0.00 0.00 0.00 46.02 46.36 1b8t n GLY 53 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1b8t n ASP 54 N 8.07 5.73 -3.56 1.61 5.68 -1.26 -4.99 116.55 127.83 1b8t n ASP 54 Ca 0.00 -3.76 -0.12 0.00 -0.50 0.00 0.00 54.79 50.41 1b8t n ASP 54 Cb 0.00 -0.56 -0.04 0.00 -1.14 0.00 0.00 41.12 39.38 1b8t n ASP 54 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1b8t s GLU 55 N -3.68 1.12 -0.01 0.11 2.02 0.14 -4.89 118.70 113.51 1b8t s GLU 55 Ca 0.54 -0.52 0.08 0.00 0.02 0.00 0.00 54.97 55.08 1b8t s GLU 55 Cb 0.43 0.50 -0.02 0.00 0.10 0.00 0.00 34.13 35.15 1b8t s GLU 55 CO -0.04 -0.45 -0.24 0.96 0.02 0.00 0.00 175.26 175.51 1b8t s ILE 56 N -3.44 1.93 -0.02 -1.63 -4.36 -1.26 0.25 121.20 112.68 1b8t s ILE 56 Ca 0.00 -1.08 -0.01 0.00 -0.26 0.00 0.00 60.65 59.30 1b8t s ILE 56 Cb 0.00 -1.61 0.02 0.00 1.25 0.00 0.00 42.46 42.12 1b8t s ILE 56 CO -0.10 0.51 0.04 -0.31 0.24 0.00 0.00 174.94 175.32 1b8t s TYR 57 N -0.61 -0.02 0.63 1.37 2.02 -0.34 -0.93 117.35 119.48 1b8t s TYR 57 Ca 0.10 0.13 -0.18 0.00 -0.37 0.00 0.00 57.07 56.75 1b8t s TYR 57 Cb -0.09 -0.11 -0.02 0.00 -0.40 0.00 0.00 41.96 41.34 1b8t s TYR 57 CO -0.01 -0.06 1.19 0.00 -1.57 0.00 0.00 175.55 175.10 1b8t n LYS 59 N -1.91 0.00 -0.02 0.00 4.81 0.01 -0.18 118.16 120.87 1b8t n LYS 59 Ca 0.13 0.85 -0.01 0.00 -0.87 0.00 0.00 58.31 58.42 1b8t n LYS 59 Cb 0.50 -1.33 -0.00 0.00 0.02 0.00 0.00 35.03 34.22 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 -2.56 -0.05 -0.34 3.14 7.64 -1.26 0.11 113.62 120.30 1b8t n SER 60 Ca 0.00 0.63 -0.10 0.00 1.01 0.00 0.00 58.87 60.41 1b8t n SER 60 Cb 0.00 -0.28 -0.07 0.00 -1.01 0.00 0.00 64.21 62.84 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 -0.10 -0.52 0.00 0.00 3.20 0.42 1.65 116.97 121.62 1b8t h TYR 62 Ca 0.17 0.07 -0.01 0.00 3.14 0.00 0.00 58.73 62.11 1b8t h TYR 62 Cb 0.49 0.35 -0.00 0.00 1.54 0.00 0.00 36.73 39.11 1b8t h TYR 62 CO -0.91 -0.35 -0.04 0.78 -1.64 0.00 0.00 178.16 176.00 1b8t h GLY 63 N -0.02 0.00 0.16 1.82 0.00 0.38 -0.47 103.07 104.95 1b8t h GLY 63 Ca 0.35 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.68 1b8t h GLY 63 CO -0.80 0.00 -0.02 1.70 0.00 0.00 0.00 176.54 177.42 1b8t h LYS 64 N 0.00 -0.05 -0.56 4.80 3.64 0.68 0.38 116.57 125.46 1b8t h LYS 64 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1b8t h LYS 64 Cb 0.36 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.17 1b8t h LYS 64 CO 0.00 0.61 0.36 1.57 -2.27 0.00 0.00 179.45 179.73 1b8t h LYS 65 N -0.89 0.75 0.02 1.90 2.10 -0.26 -2.98 116.57 117.21 1b8t h LYS 65 Ca -0.01 -0.05 -0.00 0.00 -2.00 0.00 0.00 60.65 58.59 1b8t h LYS 65 Cb 0.68 -0.17 0.00 0.00 -0.90 0.00 0.00 32.23 31.85 1b8t h LYS 65 CO 0.01 0.51 -0.01 1.88 -2.00 0.00 0.00 179.45 179.84 1b8t h TYR 66 N 0.76 -0.02 -3.56 0.07 0.05 -1.18 -3.50 116.97 109.59 1b8t h TYR 66 Ca 0.21 -0.00 0.30 0.00 0.05 0.00 0.00 58.73 59.29 1b8t h TYR 66 Cb -0.07 0.01 -0.17 0.00 1.01 0.00 0.00 36.73 37.51 1b8t h TYR 66 CO -0.03 0.45 -1.24 0.41 -1.05 0.00 0.00 178.16 176.70 1b8t n GLY 67 N 0.21 -3.39 3.76 3.88 0.00 0.13 -4.93 105.19 104.85 1b8t n GLY 67 Ca -0.08 -0.97 -0.30 0.00 0.00 0.00 0.00 46.02 44.66 1b8t n GLY 67 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1b8t s PRO 68 N -4.52 -0.65 0.24 1.61 0.04 -1.26 -5.02 135.00 125.44 1b8t s PRO 68 Ca 0.00 -0.39 -0.06 0.00 0.04 0.00 0.00 61.00 60.59 1b8t s PRO 68 Cb 0.00 -1.69 -0.02 0.00 0.04 0.00 0.00 34.50 32.83 1b8t s PRO 68 CO 0.00 -3.28 0.32 -1.59 0.04 0.00 0.00 177.00 172.49 1b8t s LYS 69 N -5.76 1.43 0.00 4.56 0.00 -1.26 -5.18 119.74 113.54 1b8t s LYS 69 Ca 0.75 -1.48 0.00 0.00 0.00 0.00 0.00 55.97 55.24 1b8t s LYS 69 Cb -0.04 0.38 0.00 0.00 0.00 0.00 0.00 37.83 38.16 1b8t s LYS 69 CO 0.55 -0.55 0.00 0.41 0.00 0.00 0.00 175.35 175.76 1b8t n GLY 70 N -0.35 1.13 3.85 0.59 0.00 -1.26 -5.19 105.19 103.95 1b8t n GLY 70 Ca 0.00 -0.89 -0.03 0.00 0.00 0.00 0.00 46.02 45.11 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 -1.96 1.19 0.11 1.61 -2.85 -1.26 -5.19 119.74 111.38 1b8t s LYS 71 Ca 0.00 -0.74 -0.26 0.00 -1.00 0.00 0.00 55.97 53.96 1b8t s LYS 71 Cb 0.00 0.35 0.08 0.00 -2.06 0.00 0.00 37.83 36.19 1b8t s LYS 71 CO 0.00 -0.56 0.95 0.20 0.10 0.00 0.00 175.35 176.05 1b8t s GLY 72 N -3.31 -0.30 0.31 0.59 0.00 -1.26 -5.19 107.32 98.16 1b8t s GLY 72 Ca 0.20 0.37 -0.19 0.00 0.00 0.00 0.00 44.72 45.10 1b8t s GLY 72 CO 0.04 0.09 0.75 -1.59 0.00 0.00 0.00 173.10 172.39 1b8t s LYS 73 N -3.21 1.92 0.00 2.90 0.00 -1.26 -5.19 119.74 114.90 1b8t s LYS 73 Ca 0.10 -1.13 0.00 0.00 0.00 0.00 0.00 55.97 54.95 1b8t s LYS 73 Cb -0.01 0.61 0.00 0.00 0.00 0.00 0.00 37.83 38.43 1b8t s LYS 73 CO -0.01 -0.89 0.00 0.41 0.00 0.00 0.00 175.35 174.86 1b8t n GLY 74 N -0.48 1.68 3.62 0.59 0.00 -1.26 -5.19 105.19 104.14 1b8t n GLY 74 Ca -0.05 -0.58 -0.01 0.00 0.00 0.00 0.00 46.02 45.38 1b8t n GLY 74 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1b8t s MET 75 N -2.00 0.06 -0.29 1.61 1.75 -1.26 -5.19 119.30 113.98 1b8t s MET 75 Ca 0.00 -0.03 -0.33 0.00 -1.25 0.00 0.00 55.69 54.08 1b8t s MET 75 Cb 0.00 0.03 0.18 0.00 2.84 0.00 0.00 34.83 37.88 1b8t s MET 75 CO 0.00 -0.03 1.38 0.20 -0.65 0.00 0.00 175.02 175.92 1b8t s GLY 76 N -2.33 -0.03 0.06 2.11 0.00 -1.26 -5.19 107.32 100.68 1b8t s GLY 76 Ca 0.13 2.45 -0.28 0.00 0.00 0.00 0.00 44.72 47.02 1b8t s GLY 76 CO -0.04 0.90 1.00 0.00 0.00 0.00 0.00 173.10 174.96 1b8t s ALA 77 N -1.47 -1.81 0.26 3.20 0.00 -1.26 -5.19 121.76 115.49 1b8t s ALA 77 Ca 0.10 0.57 -0.19 0.00 0.00 0.00 0.00 51.96 52.45 1b8t s ALA 77 Cb -0.01 0.49 0.01 0.00 0.00 0.00 0.00 23.12 23.61 1b8t s ALA 77 CO -0.06 -0.91 0.64 0.20 0.00 0.00 0.00 175.76 175.64 1b8t s GLY 78 N -2.75 0.07 0.19 0.00 0.00 -1.26 -5.19 107.32 98.37 1b8t s GLY 78 Ca 0.10 -0.44 -0.17 0.00 0.00 0.00 0.00 44.72 44.21 1b8t s GLY 78 CO -0.03 -0.24 0.49 -1.08 0.00 0.00 0.00 173.10 172.24 1b8t s THR 79 N -3.94 0.03 0.06 0.90 -1.32 -1.26 -5.18 115.64 104.93 1b8t s THR 79 Ca 0.14 -0.82 -0.27 0.00 -1.21 0.00 0.00 61.69 59.53 1b8t s THR 79 Cb -0.04 -1.57 0.09 0.00 -1.51 0.00 0.00 72.50 69.46 1b8t s THR 79 CO 0.07 -0.15 0.84 -1.48 -2.21 0.00 0.00 174.62 171.69 1b8t s LEU 80 N -2.88 -0.36 -0.10 9.08 2.34 -1.26 -5.19 118.68 120.31 1b8t s LEU 80 Ca 0.09 -0.10 -0.32 0.00 0.06 0.00 0.00 54.13 53.87 1b8t s LEU 80 Cb -0.00 2.18 0.12 0.00 -0.56 0.00 0.00 46.19 47.93 1b8t s LEU 80 CO -0.03 -0.76 1.08 -0.55 -1.06 0.00 0.00 176.35 175.03 1b8t s SER 81 N -2.63 -0.22 0.10 1.48 0.15 -1.26 -5.19 113.70 106.14 1b8t s SER 81 Ca 0.06 -0.02 -0.12 0.00 0.70 0.00 0.00 55.95 56.57 1b8t s SER 81 Cb -0.01 0.24 0.01 0.00 -1.71 0.00 0.00 66.02 64.56 1b8t s SER 81 CO -0.07 -0.40 0.28 0.28 1.20 0.00 0.00 173.24 174.53 1b8t s THR 82 N -2.71 0.11 -0.05 6.45 -1.32 -1.26 -5.18 115.64 111.69 1b8t s THR 82 Ca 0.08 -0.91 -0.30 0.00 -1.21 0.00 0.00 61.69 59.35 1b8t s THR 82 Cb -0.01 -1.26 0.11 0.00 -1.51 0.00 0.00 72.50 69.83 1b8t s THR 82 CO -0.06 -0.50 0.94 1.51 -2.21 0.00 0.00 174.62 174.30 1b8t s ASP 83 N -2.83 -0.34 0.00 8.08 -4.77 -1.26 -5.19 116.67 110.36 1b8t s ASP 83 Ca 0.04 0.07 -0.29 0.00 -3.30 0.00 0.00 52.55 49.07 1b8t s ASP 83 Cb 0.03 0.34 0.10 0.00 -1.09 0.00 0.00 42.92 42.31 1b8t s ASP 83 CO -0.11 -0.53 1.02 -0.75 0.70 0.00 0.00 175.17 175.50 1b8t s LYS 84 N -2.69 0.76 0.00 2.11 2.47 -1.26 -5.19 119.74 115.95 1b8t s LYS 84 Ca 0.04 -0.35 0.00 0.00 -1.56 0.00 0.00 55.97 54.10 1b8t s LYS 84 Cb -0.01 0.31 0.00 0.00 -1.46 0.00 0.00 37.83 36.67 1b8t s LYS 84 CO -0.07 -0.34 0.00 0.41 0.16 0.00 0.00 175.35 175.51 1b8t n GLY 85 N -0.31 3.04 3.56 5.54 0.00 -1.26 -5.19 105.19 110.58 1b8t n GLY 85 Ca -0.06 -1.01 -0.07 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.09 0.54 0.11 1.61 -1.05 -1.26 -5.19 118.70 111.38 1b8t s GLU 86 Ca 0.00 -0.13 -0.24 0.00 -0.15 0.00 0.00 54.97 54.45 1b8t s GLU 86 Cb 0.00 0.25 0.07 0.00 -0.44 0.00 0.00 34.13 34.01 1b8t s GLU 86 CO 0.00 -0.22 0.60 -1.12 0.95 0.00 0.00 175.26 175.47 1b8t s SER 87 N -2.03 -0.56 0.17 0.83 0.01 -1.26 -5.18 113.70 105.67 1b8t s SER 87 Ca 0.06 0.14 -0.19 0.00 1.31 0.00 0.00 55.95 57.26 1b8t s SER 87 Cb -0.01 0.58 0.04 0.00 0.21 0.00 0.00 66.02 66.84 1b8t s SER 87 CO -0.05 -0.88 0.52 -0.22 0.41 0.00 0.00 173.24 173.02 1b8t s LEU 88 N -2.40 -0.04 0.00 2.44 2.96 -1.26 -5.17 118.68 115.21 1b8t s LEU 88 Ca -0.02 -0.30 0.00 0.00 -0.22 0.00 0.00 54.13 53.60 1b8t s LEU 88 Cb -0.01 2.22 0.00 0.00 0.50 0.00 0.00 46.19 48.91 1b8t s LEU 88 CO -0.08 -0.99 0.00 0.61 -1.32 0.00 0.00 176.35 174.58 1b8t n GLY 89 N -0.33 4.03 3.62 7.98 0.00 -1.26 -5.18 105.19 114.05 1b8t n GLY 89 Ca -0.14 -0.30 -0.07 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.04 0.00 -0.23 -0.61 1.10 -1.26 -5.18 121.20 113.98 1b8t s ILE 90 Ca 0.00 0.00 -0.28 0.00 -0.51 0.00 0.00 60.65 59.86 1b8t s ILE 90 Cb 0.00 -1.00 0.13 0.00 0.15 0.00 0.00 42.46 41.74 1b8t s ILE 90 CO 0.00 0.00 1.07 -0.54 -2.11 0.00 0.00 174.94 173.36 1b8t s LYS 91 N -0.59 0.48 -0.12 3.50 1.02 -1.26 -5.18 119.74 117.59 1b8t s LYS 91 Ca 0.03 0.31 -0.30 0.00 0.02 0.00 0.00 55.97 56.03 1b8t s LYS 91 Cb -0.02 0.23 0.12 0.00 -0.52 0.00 0.00 37.83 37.64 1b8t s LYS 91 CO -0.05 -0.11 0.98 0.71 -0.92 0.00 0.00 175.35 175.95 1b8t s TYR 92 N -0.50 -0.35 -0.30 3.18 2.02 -1.26 -5.17 117.35 114.97 1b8t s TYR 92 Ca 0.01 0.50 -0.22 0.00 -0.37 0.00 0.00 57.07 57.00 1b8t s TYR 92 Cb -0.03 0.47 0.20 0.00 -0.40 0.00 0.00 41.96 42.21 1b8t s TYR 92 CO -0.03 -0.39 1.41 -2.00 -1.57 0.00 0.00 175.55 172.97 1b8t s GLU 93 N -1.67 0.02 0.00 -0.62 -6.30 -1.26 -5.19 118.70 103.68 1b8t s GLU 93 Ca 0.00 0.02 0.00 0.00 -2.50 0.00 0.00 54.97 52.50 1b8t s GLU 93 Cb -0.01 0.01 0.00 0.00 0.00 0.00 0.00 34.13 34.13 1b8t s GLU 93 CO -0.01 -0.00 0.00 0.39 0.02 0.00 0.00 175.26 175.66 1b8t n GLU 94 N 2.08 0.00 0.00 4.30 1.02 -1.26 -5.19 120.64 121.59 1b8t n GLU 94 Ca -0.13 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 1b8t n GLU 94 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.99 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 -0.04 0.97 3.63 0.62 0.00 -1.26 -5.19 105.19 103.93 1b8t n GLY 95 Ca 0.00 -0.60 -0.03 0.00 0.00 0.00 0.00 46.02 45.39 1b8t n GLY 95 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1b8t s GLN 96 N -2.00 0.14 0.07 1.61 0.74 -1.26 -5.19 119.66 113.77 1b8t s GLN 96 Ca 0.00 -0.03 -0.26 0.00 0.05 0.00 0.00 55.36 55.12 1b8t s GLN 96 Cb 0.00 0.06 0.09 0.00 1.10 0.00 0.00 33.01 34.26 1b8t s GLN 96 CO 0.00 -0.06 0.77 -1.12 -0.55 0.00 0.00 175.29 174.33 1b8t s SER 97 N -1.80 -0.45 0.08 6.67 0.01 -1.26 -5.19 113.70 111.76 1b8t s SER 97 Ca 0.10 -0.01 -0.27 0.00 1.31 0.00 0.00 55.95 57.08 1b8t s SER 97 Cb -0.01 0.48 0.08 0.00 0.21 0.00 0.00 66.02 66.78 1b8t s SER 97 CO -0.04 -0.77 0.97 -1.00 0.41 0.00 0.00 173.24 172.80 1b8t s HIS 98 N -3.39 -0.20 -0.40 2.43 3.76 -1.26 -5.13 115.29 111.10 1b8t s HIS 98 Ca 0.03 -0.03 0.01 0.00 -0.15 0.00 0.00 55.06 54.93 1b8t s HIS 98 Cb -0.01 0.59 0.19 0.00 1.11 0.00 0.00 32.58 34.46 1b8t s HIS 98 CO -0.11 -0.67 0.83 1.03 -0.85 0.00 0.00 174.74 174.97 1b8t s ARG 99 N -3.14 0.63 0.95 1.40 0.52 -1.26 -5.17 118.95 112.89 1b8t s ARG 99 Ca 0.10 -0.40 -0.14 0.00 -0.52 0.00 0.00 55.73 54.78 1b8t s ARG 99 Cb -0.01 0.03 0.16 0.00 0.52 0.00 0.00 34.95 35.65 1b8t s ARG 99 CO -0.02 -0.85 1.16 -1.25 0.02 0.00 0.00 175.30 174.36 1b8t s PRO 100 N 1.50 0.80 -0.14 3.54 0.04 -1.26 -5.09 135.00 134.40 1b8t s PRO 100 Ca 0.20 0.16 -0.32 0.00 0.04 0.00 0.00 61.00 61.07 1b8t s PRO 100 Cb 0.01 -1.81 0.13 0.00 0.04 0.00 0.00 34.50 32.87 1b8t s PRO 100 CO -0.09 -2.40 1.10 -0.08 0.04 0.00 0.00 177.00 175.57 1b8t s THR 101 N -3.33 0.00 0.00 1.26 -1.32 -1.26 -5.15 115.64 105.85 1b8t s THR 101 Ca 0.66 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 61.14 1b8t s THR 101 Cb -0.13 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.86 1b8t s THR 101 CO 0.54 0.00 0.00 -3.20 -2.21 0.00 0.00 174.62 169.75 1b8t n ASN 102 N -0.02 0.00 -3.65 8.08 5.15 -1.26 -5.18 115.26 118.38 1b8t n ASN 102 Ca -0.03 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 53.67 1b8t n ASN 102 Cb 0.59 0.00 0.22 0.00 -0.53 0.00 0.00 39.78 40.06 1b8t n ASN 102 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1b8t n PRO 103 N 0.00 -2.12 0.00 1.20 -0.04 -1.26 -5.10 135.00 127.69 1b8t n PRO 103 Ca 0.00 -1.80 0.00 0.00 -0.04 0.00 0.00 63.50 61.66 1b8t n PRO 103 Cb 0.00 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.04 1b8t n PRO 103 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1b8t n ASN 104 N -4.28 0.00 -3.62 3.54 5.15 -1.26 -5.19 115.26 109.60 1b8t n ASN 104 Ca 0.15 0.00 -0.04 0.00 -0.60 0.00 0.00 54.58 54.09 1b8t n ASN 104 Cb 0.55 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.77 1b8t n ASN 104 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1b8t s ALA 105 N -2.00 -2.11 0.05 5.20 0.00 -1.26 -5.19 121.76 116.45 1b8t s ALA 105 Ca 0.00 1.76 -0.27 0.00 0.00 0.00 0.00 51.96 53.45 1b8t s ALA 105 Cb 0.00 -0.56 0.08 0.00 0.00 0.00 0.00 23.12 22.64 1b8t s ALA 105 CO 0.00 -0.48 0.70 -1.12 0.00 0.00 0.00 175.76 174.86 1b8t s SER 106 N -1.80 -0.55 0.00 0.00 0.01 -1.26 -5.18 113.70 104.92 1b8t s SER 106 Ca 0.09 0.22 0.00 0.00 1.31 0.00 0.00 55.95 57.57 1b8t s SER 106 Cb -0.01 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.75 1b8t s SER 106 CO -0.04 -0.77 0.00 0.54 0.41 0.00 0.00 173.24 173.38 1b8t n ARG 107 N 0.07 0.00 -3.65 12.44 1.74 -1.26 -5.18 116.66 120.82 1b8t n ARG 107 Ca -0.16 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 56.91 1b8t n ARG 107 Cb 0.62 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.99 1b8t n ARG 107 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 1b8t s MET 108 N -1.21 0.02 -0.27 5.56 1.75 -1.26 -5.18 119.30 118.71 1b8t s MET 108 Ca 0.00 0.03 -0.28 0.00 -1.25 0.00 0.00 55.69 54.18 1b8t s MET 108 Cb 0.00 0.01 0.18 0.00 2.84 0.00 0.00 34.83 37.86 1b8t s MET 108 CO 0.00 -0.00 1.31 0.00 -0.65 0.00 0.00 175.02 175.68 1b8t s ALA 109 N 0.26 -2.11 0.00 4.11 0.00 -1.26 -5.19 121.76 117.57 1b8t s ALA 109 Ca 0.04 1.81 0.00 0.00 0.00 0.00 0.00 51.96 53.81 1b8t s ALA 109 Cb -0.04 -1.45 0.00 0.00 0.00 0.00 0.00 23.12 21.63 1b8t s ALA 109 CO -0.15 -0.22 0.00 1.04 0.00 0.00 0.00 175.76 176.43 1b8t n GLN 110 N 0.81 0.00 -3.58 0.00 1.13 -1.26 -5.19 117.38 109.29 1b8t n GLN 110 Ca -0.04 0.00 -0.05 0.00 -1.94 0.00 0.00 57.00 54.97 1b8t n GLN 110 Cb 0.58 0.00 -0.02 0.00 0.11 0.00 0.00 30.24 30.91 1b8t n GLN 110 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 1b8t s LYS 111 N -2.00 0.40 0.02 -1.09 0.00 -1.26 -5.17 119.74 110.63 1b8t s LYS 111 Ca 0.00 -0.11 0.03 0.00 0.00 0.00 0.00 55.97 55.89 1b8t s LYS 111 Cb 0.00 0.18 -0.01 0.00 0.00 0.00 0.00 37.83 38.00 1b8t s LYS 111 CO 0.00 -0.17 -0.09 0.54 0.00 0.00 0.00 175.35 175.63 1b8t s VAL 112 N -2.30 0.68 0.00 1.79 0.11 -1.26 -5.15 120.40 114.28 1b8t s VAL 112 Ca 0.08 -0.67 0.00 0.00 -2.93 0.00 0.00 61.98 58.45 1b8t s VAL 112 Cb -0.01 -0.63 0.00 0.00 -1.53 0.00 0.00 36.38 34.21 1b8t s VAL 112 CO -0.05 -0.02 0.00 0.61 -3.33 0.00 0.00 175.10 172.31 1b8t n GLY 113 N 2.28 1.75 0.86 6.54 0.00 -1.26 -5.07 105.19 110.30 1b8t n GLY 113 Ca -0.17 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.11 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 5.00 -1.62 3.60 -0.02 0.00 -1.26 -5.08 105.19 105.82 1b8t n GLY 114 Ca 0.00 -0.59 0.03 0.00 0.00 0.00 0.00 46.02 45.47 1b8t n GLY 114 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b8t s SER 115 N 0.00 -0.02 0.00 1.61 1.04 -1.26 -4.70 113.70 110.37 1b8t s SER 115 Ca 0.00 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.38 1b8t s SER 115 Cb 0.00 0.06 0.00 0.00 0.10 0.00 0.00 66.02 66.18 1b8t s SER 115 CO 0.00 -0.11 0.00 0.47 0.98 0.00 0.00 173.24 174.58 1b8t n ASP 116 N -0.53 0.00 -4.97 7.02 9.92 -0.68 -5.07 116.55 122.24 1b8t n ASP 116 Ca -0.09 0.00 -0.21 0.00 -0.53 0.00 0.00 54.79 53.97 1b8t n ASP 116 Cb 0.63 0.00 0.03 0.00 -0.64 0.00 0.00 41.12 41.15 1b8t n ASP 116 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1b8t s GLY 117 N 0.00 1.83 -0.41 0.44 0.00 -1.26 0.41 107.32 108.32 1b8t s GLY 117 Ca 0.00 -1.34 -0.16 0.00 0.00 0.00 0.00 44.72 43.22 1b8t s GLY 117 CO 0.00 -1.06 0.39 0.00 0.00 0.00 0.00 173.10 172.43 1b8t n PRO 119 N 5.47 0.75 0.00 0.00 -0.04 -1.25 0.35 135.00 140.27 1b8t n PRO 119 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 1b8t n PRO 119 Cb 0.47 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 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 -0.93 0.00 0.09 0.54 3.00 -1.26 -4.66 116.66 113.44 1b8t n ARG 120 Ca 0.15 0.05 -0.05 0.00 -0.00 0.00 0.00 57.85 58.00 1b8t n ARG 120 Cb 0.07 -0.47 -0.00 0.00 0.00 0.00 0.00 32.46 32.06 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 0.90 3.07 3.76 0.00 0.00 0.16 -5.06 105.19 108.02 1b8t n GLY 122 Ca -0.01 0.00 -0.39 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 -0.55 3.68 0.65 1.61 1.11 -1.24 -4.28 119.66 120.64 1b8t s GLN 123 Ca 0.00 2.18 -0.17 0.00 0.01 0.00 0.00 55.36 57.38 1b8t s GLN 123 Cb 0.00 -2.57 -0.00 0.00 -1.01 0.00 0.00 33.01 29.43 1b8t s GLN 123 CO 0.00 -0.74 1.18 0.00 0.01 0.00 0.00 175.29 175.75 1b8t s ALA 124 N -1.30 2.38 -0.18 6.09 0.00 -1.26 0.23 121.76 127.73 1b8t s ALA 124 Ca 0.62 0.86 0.00 0.00 0.00 0.00 0.00 51.96 53.44 1b8t s ALA 124 Cb -0.38 -3.43 0.04 0.00 0.00 0.00 0.00 23.12 19.35 1b8t s ALA 124 CO 0.48 -1.42 -0.10 0.08 0.00 0.00 0.00 175.76 174.80 1b8t s VAL 125 N -1.90 1.47 0.00 0.00 1.01 0.16 -4.66 120.40 116.48 1b8t s VAL 125 Ca 0.74 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.91 1b8t s VAL 125 Cb -0.27 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.57 1b8t s VAL 125 CO 0.39 0.23 0.00 0.00 0.00 0.00 0.00 175.10 175.72 1b8t n TYR 126 N 4.76 0.00 -1.42 5.22 4.11 -1.26 -1.68 117.16 126.88 1b8t n TYR 126 Ca -0.14 0.00 -0.52 0.00 -0.00 0.00 0.00 57.90 57.24 1b8t n TYR 126 Cb 0.48 0.00 -0.05 0.00 -0.00 0.00 0.00 39.34 39.77 1b8t n TYR 126 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1b8t n ALA 127 N -3.00 -3.17 -1.17 -3.48 0.00 -1.26 -4.36 120.51 104.06 1b8t n ALA 127 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1b8t n ALA 127 Cb 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 19.45 17.80 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 0.62 -2.21 -2.26 0.00 0.00 -1.26 -4.91 120.51 110.50 1b8t n ALA 128 Ca 0.19 0.31 -0.06 0.00 0.00 0.00 0.00 53.44 53.87 1b8t n ALA 128 Cb 0.18 -1.12 0.03 0.00 0.00 0.00 0.00 19.45 18.54 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 -0.17 -1.20 -4.28 0.00 2.13 -1.26 -5.04 120.64 110.81 1b8t n GLU 129 Ca 0.00 0.34 -0.18 0.00 0.66 0.00 0.00 57.16 57.98 1b8t n GLU 129 Cb 0.00 -3.32 -0.15 0.00 0.27 0.00 0.00 31.44 28.25 1b8t n GLU 129 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1b8t s LYS 130 N -3.73 0.66 0.01 5.31 1.02 -1.26 -3.93 119.74 117.83 1b8t s LYS 130 Ca 0.15 -0.26 0.02 0.00 0.02 0.00 0.00 55.97 55.90 1b8t s LYS 130 Cb -0.02 -0.64 -0.01 0.00 -0.52 0.00 0.00 37.83 36.64 1b8t s LYS 130 CO 0.29 0.13 -0.06 0.54 -0.92 0.00 0.00 175.35 175.33 1b8t s VAL 131 N -0.03 0.43 -0.19 3.17 0.11 0.72 -4.43 120.40 120.17 1b8t s VAL 131 Ca 0.01 -0.53 0.01 0.00 -2.93 0.00 0.00 61.98 58.54 1b8t s VAL 131 Cb -0.05 -0.42 0.04 0.00 -1.53 0.00 0.00 36.38 34.42 1b8t s VAL 131 CO -0.00 -0.08 -0.12 -0.63 -3.33 0.00 0.00 175.10 170.94 1b8t s ILE 132 N -0.59 1.72 -0.08 7.04 1.09 -1.26 -1.09 121.20 128.04 1b8t s ILE 132 Ca -0.03 -0.98 -0.10 0.00 -1.10 0.00 0.00 60.65 58.44 1b8t s ILE 132 Cb -0.05 -1.74 0.02 0.00 -1.06 0.00 0.00 42.46 39.64 1b8t s ILE 132 CO -0.00 0.26 0.27 -0.83 -0.10 0.00 0.00 174.94 174.54 1b8t s GLY 133 N 1.38 -0.17 -1.40 6.18 0.00 0.13 -4.90 107.32 108.54 1b8t s GLY 133 Ca 0.00 0.61 -0.02 0.00 0.00 0.00 0.00 44.72 45.31 1b8t s GLY 133 CO -0.09 0.48 0.59 0.00 0.00 0.00 0.00 173.10 174.08 1b8t n ALA 134 N 2.49 -1.90 -3.54 3.20 0.00 -1.26 -0.02 120.51 119.47 1b8t n ALA 134 Ca -0.15 -0.18 -0.26 0.00 0.00 0.00 0.00 53.44 52.85 1b8t n ALA 134 Cb 0.57 -2.03 -0.00 0.00 0.00 0.00 0.00 19.45 17.99 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 -1.78 -0.48 3.14 0.00 0.00 -1.26 -4.05 105.19 100.75 1b8t n GLY 135 Ca -0.25 0.11 -0.08 0.00 0.00 0.00 0.00 46.02 45.79 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 -6.21 0.75 0.08 1.61 3.01 0.97 -5.03 119.74 114.93 1b8t s LYS 136 Ca 0.48 -1.24 0.09 0.00 -1.01 0.00 0.00 55.97 54.29 1b8t s LYS 136 Cb -0.25 0.25 -0.04 0.00 -1.01 0.00 0.00 37.83 36.78 1b8t s LYS 136 CO 0.59 -0.19 -0.21 -1.54 0.51 0.00 0.00 175.35 174.51 1b8t s SER 137 N -2.95 3.63 0.27 2.83 1.04 -1.26 0.18 113.70 117.44 1b8t s SER 137 Ca 0.12 -0.55 -0.21 0.00 0.48 0.00 0.00 55.95 55.79 1b8t s SER 137 Cb 0.07 -0.47 0.04 0.00 0.10 0.00 0.00 66.02 65.77 1b8t s SER 137 CO -0.07 0.22 0.82 0.26 0.98 0.00 0.00 173.24 175.46 1b8t s TRP 138 N -0.99 -0.07 -0.09 5.02 0.52 -0.25 -3.90 118.94 119.18 1b8t s TRP 138 Ca 0.15 -0.40 -0.30 0.00 0.02 0.00 0.00 56.10 55.57 1b8t s TRP 138 Cb -0.10 0.73 -0.04 0.00 -1.15 0.00 0.00 33.47 32.90 1b8t s TRP 138 CO 0.06 -1.20 1.50 -1.01 0.02 0.00 0.00 176.95 176.32 1b8t s HIS 139 N -3.21 2.35 -0.92 -1.98 3.76 -1.26 -0.20 115.29 113.83 1b8t s HIS 139 Ca 0.13 0.53 -0.25 0.00 -0.15 0.00 0.00 55.06 55.32 1b8t s HIS 139 Cb -0.04 -3.75 -0.18 0.00 1.11 0.00 0.00 32.58 29.71 1b8t s HIS 139 CO 0.07 -2.98 1.93 1.17 -0.85 0.00 0.00 174.74 174.08 1b8t n LYS 140 N 6.81 0.98 0.00 1.40 4.81 -1.25 -0.51 118.16 130.40 1b8t n LYS 140 Ca 0.16 -1.96 0.00 0.00 -0.87 0.00 0.00 58.31 55.64 1b8t n LYS 140 Cb 0.44 -3.46 0.00 0.00 0.02 0.00 0.00 35.03 32.02 1b8t n LYS 140 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1b8t n SER 141 N 13.79 0.00 0.03 3.14 7.64 -1.26 -4.85 113.62 132.11 1b8t n SER 141 Ca 0.45 0.00 0.02 0.00 1.01 0.00 0.00 58.87 60.35 1b8t n SER 141 Cb 0.45 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.57 1b8t n SER 141 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1b8t n PHE 143 N -2.82 0.44 -4.26 0.00 -0.00 -1.03 -4.64 117.46 105.15 1b8t n PHE 143 Ca -0.09 0.30 -0.35 0.00 -0.00 0.00 0.00 57.45 57.31 1b8t n PHE 143 Cb 0.80 -1.72 -0.10 0.00 -0.00 0.00 0.00 39.48 38.47 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 6.33 3.32 0.14 -4.13 1.81 -1.26 0.25 118.95 125.40 1b8t s ARG 144 Ca 0.97 -0.38 -0.31 0.00 -1.72 0.00 0.00 55.73 54.29 1b8t s ARG 144 Cb -0.93 -2.93 -0.09 0.00 -0.45 0.00 0.00 34.95 30.55 1b8t s ARG 144 CO 0.37 0.56 1.59 0.00 -0.68 0.00 0.00 175.30 177.14 1b8t n ALA 146 N 4.45 4.54 0.00 0.00 0.00 -0.56 -0.24 120.51 128.69 1b8t n ALA 146 Ca 0.14 -1.44 0.00 0.00 0.00 0.00 0.00 53.44 52.14 1b8t n ALA 146 Cb 0.39 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.56 1b8t n ALA 146 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1b8t n LYS 147 N 0.13 0.00 -0.00 0.00 3.00 -1.26 -4.87 118.16 115.15 1b8t n LYS 147 Ca 0.28 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.64 1b8t n LYS 147 Cb 0.77 -0.25 -0.08 0.00 0.00 0.00 0.00 35.03 35.47 1b8t n LYS 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1b8t n GLY 149 N 1.83 0.56 3.81 0.00 0.00 0.66 -5.01 105.19 107.05 1b8t n GLY 149 Ca -0.02 -0.58 -0.29 0.00 0.00 0.00 0.00 46.02 45.13 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 -1.58 1.22 -0.04 1.61 2.20 -1.25 -4.65 119.74 117.26 1b8t s LYS 150 Ca 0.00 0.22 -0.11 0.00 -0.36 0.00 0.00 55.97 55.72 1b8t s LYS 150 Cb 0.00 -1.85 -0.05 0.00 -1.51 0.00 0.00 37.83 34.42 1b8t s LYS 150 CO 0.00 -2.13 0.30 -1.54 -0.36 0.00 0.00 175.35 171.62 1b8t s SER 151 N -4.16 6.62 0.18 1.43 1.04 -1.26 -0.89 113.70 116.67 1b8t s SER 151 Ca 0.64 0.74 0.00 0.00 0.48 0.00 0.00 55.95 57.82 1b8t s SER 151 Cb -0.14 -2.17 -0.00 0.00 0.10 0.00 0.00 66.02 63.81 1b8t s SER 151 CO 0.53 0.34 0.02 0.18 0.98 0.00 0.00 173.24 175.28 1b8t n LEU 152 N 1.76 0.00 0.00 2.42 4.77 0.14 -4.90 117.00 121.18 1b8t n LEU 152 Ca -0.15 -1.21 0.00 0.00 -0.03 0.00 0.00 56.01 54.62 1b8t n LEU 152 Cb 0.53 0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.84 1b8t n LEU 152 CO 0.36 -0.18 0.00 -1.84 -1.33 0.00 0.00 177.39 174.40 1b8t n GLU 153 N -0.44 0.00 0.00 3.23 0.00 -1.26 -4.44 120.64 117.72 1b8t n GLU 153 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.10 1b8t n GLU 153 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.68 1b8t n GLU 153 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1b8t n SER 154 N -1.78 0.00 0.00 -1.84 7.64 -1.26 -4.19 113.62 112.19 1b8t n SER 154 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1b8t n SER 154 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1b8t n SER 154 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1b8t n THR 155 N 0.00 0.00 -2.99 0.44 5.66 -1.26 -5.00 114.28 111.14 1b8t n THR 155 Ca 0.00 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 60.84 1b8t n THR 155 Cb 0.00 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 68.77 1b8t n THR 155 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1b8t n THR 156 N -1.97 0.42 -3.54 1.09 -2.24 -1.26 -5.08 114.28 101.71 1b8t n THR 156 Ca 0.00 -4.14 -0.38 0.00 -2.27 0.00 0.00 64.05 57.27 1b8t n THR 156 Cb 0.00 -0.03 -0.09 0.00 -2.10 0.00 0.00 70.33 68.11 1b8t n THR 156 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1b8t s LEU 157 N -2.73 4.10 0.35 3.22 2.96 -1.26 -0.79 118.68 124.53 1b8t s LEU 157 Ca 0.36 0.24 -0.12 0.00 -0.22 0.00 0.00 54.13 54.39 1b8t s LEU 157 Cb 0.38 -2.27 -0.07 0.00 0.50 0.00 0.00 46.19 44.73 1b8t s LEU 157 CO -0.05 -0.03 0.73 0.00 -1.32 0.00 0.00 176.35 175.69 1b8t s ALA 158 N 1.37 3.37 -0.25 5.97 0.00 0.65 -4.88 121.76 127.97 1b8t s ALA 158 Ca 0.12 -0.13 -0.03 0.00 0.00 0.00 0.00 51.96 51.92 1b8t s ALA 158 Cb -0.14 -2.69 0.08 0.00 0.00 0.00 0.00 23.12 20.37 1b8t s ALA 158 CO 0.07 0.18 0.08 0.16 0.00 0.00 0.00 175.76 176.26 1b8t s ASP 159 N -2.73 3.38 -0.82 0.00 1.47 -1.26 -1.01 116.67 115.71 1b8t s ASP 159 Ca 0.52 -1.18 -0.15 0.00 1.18 0.00 0.00 52.55 52.91 1b8t s ASP 159 Cb -0.10 -0.59 0.20 0.00 -0.34 0.00 0.00 42.92 42.08 1b8t s ASP 159 CO 0.25 -0.38 0.80 -0.75 0.68 0.00 0.00 175.17 175.77 1b8t s LYS 160 N 1.86 3.55 -0.53 2.11 2.20 0.12 -4.71 119.74 124.34 1b8t s LYS 160 Ca 0.05 -2.27 -0.26 0.00 -0.36 0.00 0.00 55.97 53.14 1b8t s LYS 160 Cb -0.17 -4.49 0.04 0.00 -1.51 0.00 0.00 37.83 31.70 1b8t s LYS 160 CO -0.21 -1.38 0.61 -0.25 -0.36 0.00 0.00 175.35 173.76 1b8t n ASP 161 N 4.54 -4.92 0.00 1.43 9.92 -1.26 -0.45 116.55 125.81 1b8t n ASP 161 Ca 0.13 -0.40 0.00 0.00 -0.53 0.00 0.00 54.79 53.98 1b8t n ASP 161 Cb 0.47 -1.49 0.00 0.00 -0.64 0.00 0.00 41.12 39.46 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 -0.62 1.86 3.70 0.44 0.00 -1.26 -4.97 105.19 104.34 1b8t n GLY 162 Ca -0.16 -0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.27 1b8t n GLY 162 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b8t n GLU 163 N 0.00 0.73 -4.49 1.61 -0.58 0.41 -4.75 120.64 113.55 1b8t n GLU 163 Ca 0.00 0.31 -0.22 0.00 -0.42 0.00 0.00 57.16 56.83 1b8t n GLU 163 Cb 0.00 -2.45 -0.16 0.00 -0.57 0.00 0.00 31.44 28.27 1b8t n GLU 163 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 1b8t s ILE 164 N -1.68 0.94 0.21 -3.67 -4.36 -1.26 0.15 121.20 111.53 1b8t s ILE 164 Ca 0.78 -0.44 0.00 0.00 -0.26 0.00 0.00 60.65 60.73 1b8t s ILE 164 Cb -0.35 -0.82 -0.00 0.00 1.25 0.00 0.00 42.46 42.54 1b8t s ILE 164 CO 0.45 0.29 0.27 -1.22 0.24 0.00 0.00 174.94 174.97 1b8t n TYR 165 N 3.26 -0.92 -3.65 1.37 4.01 -0.18 -1.50 117.16 119.55 1b8t n TYR 165 Ca -0.18 -1.51 -0.36 0.00 -0.16 0.00 0.00 57.90 55.69 1b8t n TYR 165 Cb 0.54 0.30 -0.06 0.00 -0.31 0.00 0.00 39.34 39.81 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 4.29 0.41 -0.19 0.00 1.57 -1.30 1.65 116.57 123.00 1b8t h LYS 167 Ca -0.51 -0.02 0.04 0.00 -1.87 0.00 0.00 60.65 58.28 1b8t h LYS 167 Cb 1.21 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 1b8t h LYS 167 CO 0.63 0.27 0.13 0.78 -0.57 0.00 0.00 179.45 180.69 1b8t h GLY 168 N 0.42 0.09 0.29 3.86 0.00 -1.93 0.43 103.07 106.23 1b8t h GLY 168 Ca 0.69 -0.03 -0.09 0.00 0.00 0.00 0.00 47.33 47.90 1b8t h GLY 168 CO -0.52 0.03 -0.43 0.00 0.00 0.00 0.00 176.54 175.62 1b8t h TYR 170 N -0.72 0.31 0.00 0.00 3.20 -0.28 0.48 116.97 119.95 1b8t h TYR 170 Ca -0.08 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.80 1b8t h TYR 170 Cb 1.30 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 39.46 1b8t h TYR 170 CO 0.23 0.18 -0.09 0.00 -1.64 0.00 0.00 178.16 176.85 1b8t h ALA 171 N 1.80 0.00 -0.17 1.82 0.00 -0.24 -3.25 119.26 119.23 1b8t h ALA 171 Ca 0.15 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1b8t h ALA 171 Cb 0.21 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.04 1b8t h ALA 171 CO -0.03 0.09 -0.37 0.87 0.00 0.00 0.00 179.25 179.81 1b8t h LYS 172 N -0.57 -0.33 -1.17 0.00 1.57 -0.91 0.51 116.57 115.67 1b8t h LYS 172 Ca 0.00 0.02 0.43 0.00 -1.87 0.00 0.00 60.65 59.23 1b8t h LYS 172 Cb 0.09 0.07 -0.14 0.00 0.08 0.00 0.00 32.23 32.33 1b8t h LYS 172 CO 0.00 -0.22 0.72 -1.71 -0.57 0.00 0.00 179.45 177.67 1b8t n ASN 173 N -4.48 0.24 -2.89 0.86 2.85 0.17 0.41 115.26 112.41 1b8t n ASN 173 Ca -0.03 1.38 -0.26 0.00 -0.11 0.00 0.00 54.58 55.56 1b8t n ASN 173 Cb 0.24 -0.67 -0.03 0.00 1.24 0.00 0.00 39.78 40.56 1b8t n ASN 173 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 1b8t n PHE 174 N -4.75 3.55 0.00 1.20 3.72 0.15 -4.86 117.46 116.47 1b8t n PHE 174 Ca 0.37 -3.84 0.00 0.00 -0.05 0.00 0.00 57.45 53.93 1b8t n PHE 174 Cb 1.38 -0.42 0.00 0.00 -0.94 0.00 0.00 39.48 39.49 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 -0.23 -1.81 3.73 1.37 0.00 0.17 -4.79 105.19 103.63 1b8t n GLY 175 Ca 0.31 0.90 -0.41 0.00 0.00 0.00 0.00 46.02 46.82 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 4.53 0.09 1.61 0.04 -1.25 -4.43 135.00 135.59 1b8t s PRO 176 Ca 0.00 1.74 -0.22 0.00 0.04 0.00 0.00 61.00 62.56 1b8t s PRO 176 Cb 0.00 -3.30 -0.07 0.00 0.04 0.00 0.00 34.50 31.17 1b8t s PRO 176 CO 0.00 -0.04 0.66 0.15 0.04 0.00 0.00 177.00 177.81 1b8t s LYS 177 N 0.09 4.37 0.00 4.56 1.02 -1.26 -4.99 119.74 123.53 1b8t s LYS 177 Ca 0.52 0.91 0.00 0.00 0.02 0.00 0.00 55.97 57.42 1b8t s LYS 177 Cb -0.29 -3.27 0.00 0.00 -0.52 0.00 0.00 37.83 33.74 1b8t s LYS 177 CO 0.33 0.54 0.00 0.41 -0.92 0.00 0.00 175.35 175.72 1b8t n GLY 178 N 1.85 0.32 1.15 -3.33 0.00 -1.26 -5.14 105.19 98.77 1b8t n GLY 178 Ca -0.08 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.07 1b8t n GLY 178 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1b8t n PHE 179 N -0.75 -2.59 0.00 1.61 3.72 -1.26 -5.05 117.46 113.13 1b8t n PHE 179 Ca 0.00 1.35 0.00 0.00 -0.05 0.00 0.00 57.45 58.75 1b8t n PHE 179 Cb 0.00 -2.36 0.00 0.00 -0.94 0.00 0.00 39.48 36.18 1b8t n PHE 179 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b8t n GLY 180 N -3.54 3.12 3.38 1.37 0.00 -1.26 -5.17 105.19 103.09 1b8t n GLY 180 Ca -0.02 -0.42 0.02 0.00 0.00 0.00 0.00 46.02 45.60 1b8t n GLY 180 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1b8t s PHE 181 N -1.78 -0.25 -0.35 1.61 2.19 -1.26 -5.13 117.98 113.01 1b8t s PHE 181 Ca 0.00 0.45 0.06 0.00 0.33 0.00 0.00 56.93 57.77 1b8t s PHE 181 Cb 0.00 0.15 0.18 0.00 -1.31 0.00 0.00 43.02 42.04 1b8t s PHE 181 CO 0.00 -0.12 0.57 0.20 1.83 0.00 0.00 175.22 177.70 1b8t s GLY 182 N 1.83 -1.10 -0.43 13.12 0.00 -1.26 -5.12 107.32 114.36 1b8t s GLY 182 Ca -0.03 0.43 -0.20 0.00 0.00 0.00 0.00 44.72 44.92 1b8t s GLY 182 CO -0.15 3.54 0.57 1.62 0.00 0.00 0.00 173.10 178.69 1b8t s GLN 183 N 2.24 3.24 -0.15 2.90 0.74 -1.26 -5.01 119.66 122.36 1b8t s GLN 183 Ca 0.13 -0.48 -0.04 0.00 0.05 0.00 0.00 55.36 55.02 1b8t s GLN 183 Cb -0.08 -3.95 0.08 0.00 1.10 0.00 0.00 33.01 30.16 1b8t s GLN 183 CO -0.16 -0.95 0.24 0.20 -0.55 0.00 0.00 175.29 174.07 1b8t s GLY 184 N 1.93 -0.06 0.13 2.59 0.00 -1.26 -5.02 107.32 105.63 1b8t s GLY 184 Ca 0.19 0.62 0.00 0.00 0.00 0.00 0.00 44.72 45.53 1b8t s GLY 184 CO 0.17 2.02 0.00 0.00 0.00 0.00 0.00 173.10 175.29 1b8t n ALA 185 N 5.34 3.00 0.00 3.20 0.00 -1.26 -5.10 120.51 125.68 1b8t n ALA 185 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1b8t n ALA 185 Cb 0.50 0.17 0.00 0.00 0.00 0.00 0.00 19.45 20.12 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 3.06 -0.60 3.67 0.00 0.00 -1.26 -5.13 105.19 104.92 1b8t n GLY 186 Ca 0.00 0.78 -0.43 0.00 0.00 0.00 0.00 46.02 46.38 1b8t n GLY 186 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b8t s ALA 187 N 0.00 3.62 -0.59 4.61 0.00 -1.26 -4.89 121.76 123.24 1b8t s ALA 187 Ca 0.00 0.46 -0.31 0.00 0.00 0.00 0.00 51.96 52.11 1b8t s ALA 187 Cb 0.00 -3.58 -0.13 0.00 0.00 0.00 0.00 23.12 19.40 1b8t s ALA 187 CO 0.00 -1.04 2.41 -0.11 0.00 0.00 0.00 175.76 177.02 1b8t n LEU 188 N 6.18 1.58 -4.81 0.00 7.94 -1.26 -4.88 117.00 121.76 1b8t n LEU 188 Ca 0.13 0.06 -0.34 0.00 -1.11 0.00 0.00 56.01 54.75 1b8t n LEU 188 Cb 0.45 -1.25 -0.06 0.00 0.53 0.00 0.00 43.42 43.10 1b8t n LEU 188 CO 0.55 -0.99 0.67 -0.51 -1.11 0.00 0.00 177.39 176.00 1b8t s ILE 189 N 9.31 4.19 -0.03 1.96 2.07 -1.26 -5.05 121.20 132.39 1b8t s ILE 189 Ca 1.14 1.45 -0.05 0.00 -1.41 0.00 0.00 60.65 61.78 1b8t s ILE 189 Cb -0.79 -3.63 -0.04 0.00 0.13 0.00 0.00 42.46 38.13 1b8t s ILE 189 CO 0.42 -0.22 0.20 -2.28 -1.91 0.00 0.00 174.94 171.16 1b8t s HIS 190 N -2.02 3.57 -0.20 3.50 2.46 -1.26 -4.78 115.29 116.56 1b8t s HIS 190 Ca 0.61 0.46 -0.08 0.00 0.47 0.00 0.00 55.06 56.52 1b8t s HIS 190 Cb -0.13 -1.90 0.03 0.00 -0.13 0.00 0.00 32.58 30.45 1b8t s HIS 190 CO 0.17 0.66 0.17 0.43 -2.47 0.00 0.00 174.74 173.70 1b8t n SER 191 N 1.26 -2.35 -0.93 9.88 7.64 -1.26 -5.32 113.62 122.55 1b8t n SER 191 Ca -0.13 1.25 0.12 0.00 1.01 0.00 0.00 58.87 61.12 1b8t n SER 191 Cb 0.53 -4.92 0.10 0.00 -1.01 0.00 0.00 64.21 58.91 1b8t n SER 191 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03