#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hi8 s PHE 2 N 0.00 2.32 -0.71 2.03 0.40 -1.21 -3.82 117.98 116.99 3hi8 s PHE 2 Ca 0.00 -2.29 -0.26 0.00 -0.60 0.00 0.00 56.93 53.78 3hi8 s PHE 2 Cb 0.00 -2.10 0.04 0.00 0.51 0.00 0.00 43.02 41.47 3hi8 s PHE 2 CO 0.00 -0.86 1.18 0.15 0.70 0.00 0.00 175.22 176.39 3hi8 s LYS 3 N 1.00 3.18 -0.07 0.44 -0.14 -1.23 -3.81 119.74 119.11 3hi8 s LYS 3 Ca 0.13 -0.39 -0.03 0.00 -1.36 0.00 0.00 55.97 54.31 3hi8 s LYS 3 Cb -0.20 -4.19 0.04 0.00 -1.68 0.00 0.00 37.83 31.80 3hi8 s LYS 3 CO -0.13 -2.03 0.15 0.00 -0.76 0.00 0.00 175.35 172.58 3hi8 s ALA 4 N 5.21 -0.26 -0.72 5.17 0.00 -1.23 -1.30 121.76 128.63 3hi8 s ALA 4 Ca 0.32 0.67 -0.20 0.00 0.00 0.00 0.00 51.96 52.75 3hi8 s ALA 4 Cb -0.11 -0.50 0.10 0.00 0.00 0.00 0.00 23.12 22.62 3hi8 s ALA 4 CO 0.14 -0.20 0.93 0.42 0.00 0.00 0.00 175.76 177.05 3hi8 s ILE 5 N 1.29 4.63 -0.15 0.00 1.01 -0.90 -1.74 121.20 125.34 3hi8 s ILE 5 Ca -0.08 -0.96 -0.06 0.00 0.00 0.00 0.00 60.65 59.54 3hi8 s ILE 5 Cb -0.12 -4.65 -0.04 0.00 0.01 0.00 0.00 42.46 37.67 3hi8 s ILE 5 CO -0.06 -1.36 0.07 -0.69 0.00 0.00 0.00 174.94 172.89 3hi8 s VAL 6 N 3.14 4.86 0.09 2.92 1.01 0.95 -2.02 120.40 131.34 3hi8 s VAL 6 Ca 0.22 -0.02 -0.35 0.00 0.00 0.00 0.00 61.98 61.83 3hi8 s VAL 6 Cb -0.15 -3.15 -0.14 0.00 0.00 0.00 0.00 36.38 32.94 3hi8 s VAL 6 CO 0.03 0.52 1.56 -0.24 0.00 0.00 0.00 175.10 176.97 3hi8 n SER 7 N 2.93 2.73 -0.42 3.32 2.88 -1.25 0.93 113.62 124.73 3hi8 n SER 7 Ca -0.18 1.08 0.34 0.00 -1.33 0.00 0.00 58.87 58.78 3hi8 n SER 7 Cb 0.53 -1.34 0.62 0.00 -0.75 0.00 0.00 64.21 63.27 3hi8 n SER 7 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hi8 h ALA 8 N 6.06 2.65 0.00 -1.46 0.00 2.93 0.45 119.26 129.89 3hi8 h ALA 8 Ca -0.46 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3hi8 h ALA 8 Cb 1.28 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.24 3hi8 h ALA 8 CO 0.87 -1.23 0.00 0.00 0.00 0.00 0.00 179.25 178.89 3hi8 h ALA 9 N 1.60 1.00 -0.01 0.00 0.00 -1.55 -1.20 119.26 119.10 3hi8 h ALA 9 Ca 0.77 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.68 3hi8 h ALA 9 Cb 2.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.16 3hi8 h ALA 9 CO -0.39 0.00 -0.04 2.41 0.00 0.00 0.00 179.25 181.23 3hi8 n THR 10 N -2.53 0.00 -0.07 0.00 -1.04 0.16 -4.26 114.28 106.53 3hi8 n THR 10 Ca 0.00 -0.20 -0.12 0.00 -2.04 0.00 0.00 64.05 61.69 3hi8 n THR 10 Cb 0.18 0.36 -0.10 0.00 -1.82 0.00 0.00 70.33 68.96 3hi8 n THR 10 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3hi8 h LEU 11 N 1.90 0.00 -0.84 -4.42 5.85 -1.32 -3.22 115.31 113.27 3hi8 h LEU 11 Ca 0.00 -0.73 -0.12 0.00 0.84 0.00 0.00 57.88 57.88 3hi8 h LEU 11 Cb 0.45 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 3hi8 h LEU 11 CO 0.00 0.96 -0.57 0.03 -0.34 0.00 0.00 178.44 178.52 3hi8 h ARG 12 N -1.00 0.00 -0.13 1.25 3.08 -1.76 -2.82 114.38 113.00 3hi8 h ARG 12 Ca -0.04 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 3hi8 h ARG 12 Cb 0.84 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.88 3hi8 h ARG 12 CO -0.03 0.57 0.05 0.38 -1.07 0.00 0.00 179.97 179.88 3hi8 h ASP 13 N 0.00 0.17 -0.11 7.04 -0.00 -1.74 -2.65 116.42 119.12 3hi8 h ASP 13 Ca -0.01 -0.15 -0.02 0.00 -0.00 0.00 0.00 57.03 56.85 3hi8 h ASP 13 Cb 1.03 -0.04 -0.00 0.00 -0.00 0.00 0.00 39.33 40.31 3hi8 h ASP 13 CO 0.07 0.28 -0.02 0.00 -0.00 0.00 0.00 179.24 179.57 3hi8 h ALA 14 N 0.90 0.16 -0.00 4.15 0.00 -1.55 -3.26 119.26 119.65 3hi8 h ALA 14 Ca 0.04 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3hi8 h ALA 14 Cb 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3hi8 h ALA 14 CO -0.00 -0.11 -0.22 1.28 0.00 0.00 0.00 179.25 180.19 3hi8 n LEU 15 N -4.76 0.63 -0.05 0.00 4.77 -1.07 -4.06 117.00 112.46 3hi8 n LEU 15 Ca -0.06 -0.05 -0.13 0.00 -0.03 0.00 0.00 56.01 55.74 3hi8 n LEU 15 Cb 0.24 -0.20 -0.14 0.00 -2.33 0.00 0.00 43.42 40.98 3hi8 n LEU 15 CO 0.36 0.12 -0.84 0.47 -1.33 0.00 0.00 177.39 176.17 3hi8 n ASP 16 N -0.99 1.09 0.18 -1.43 9.92 -1.00 -4.18 116.55 120.14 3hi8 n ASP 16 Ca 0.11 0.20 -0.15 0.00 -0.53 0.00 0.00 54.79 54.43 3hi8 n ASP 16 Cb 0.32 -0.04 -0.09 0.00 -0.64 0.00 0.00 41.12 40.67 3hi8 n ASP 16 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 3hi8 h SER 17 N 0.02 -1.30 0.30 -2.24 0.02 -1.70 -2.17 113.55 106.47 3hi8 h SER 17 Ca -0.42 0.12 -0.05 0.00 -0.84 0.00 0.00 61.79 60.61 3hi8 h SER 17 Cb 2.06 0.46 -0.01 0.00 0.14 0.00 0.00 62.40 65.05 3hi8 h SER 17 CO 0.05 -0.53 -0.22 -0.37 -1.14 0.00 0.00 176.83 174.62 3hi8 h VAL 18 N -0.77 1.00 -0.94 2.27 -1.51 -1.80 -3.24 116.25 111.26 3hi8 h VAL 18 Ca -0.03 -0.78 0.15 0.00 -1.23 0.00 0.00 66.70 64.81 3hi8 h VAL 18 Cb 0.71 1.44 -0.15 0.00 -2.13 0.00 0.00 31.29 31.16 3hi8 h VAL 18 CO -0.15 0.21 -0.36 -1.54 -1.23 0.00 0.00 177.57 174.50 3hi8 n SER 19 N -4.05 -0.59 -0.48 4.19 3.41 -0.82 0.20 113.62 115.47 3hi8 n SER 19 Ca -0.02 1.64 0.42 0.00 -0.26 0.00 0.00 58.87 60.65 3hi8 n SER 19 Cb 0.29 -0.38 0.77 0.00 -0.26 0.00 0.00 64.21 64.62 3hi8 n SER 19 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3hi8 h VAL 20 N 0.00 0.24 0.00 -3.33 2.07 -1.58 -3.14 116.25 110.51 3hi8 h VAL 20 Ca 0.34 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.84 3hi8 h VAL 20 Cb 0.57 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.55 3hi8 h VAL 20 CO -0.94 0.00 -1.03 0.18 0.02 0.00 0.00 177.57 175.81 3hi8 n LEU 21 N -4.14 1.90 -4.36 2.57 4.77 0.53 -5.04 117.00 113.23 3hi8 n LEU 21 Ca 0.34 -0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 56.13 3hi8 n LEU 21 Cb 1.55 -0.01 -0.10 0.00 -2.33 0.00 0.00 43.42 42.53 3hi8 n LEU 21 CO 0.40 0.33 -0.43 0.68 -1.33 0.00 0.00 177.39 177.04 3hi8 s VAL 22 N -2.01 1.73 -0.20 4.08 -7.23 0.51 -4.27 120.40 113.01 3hi8 s VAL 22 Ca -0.01 -2.21 0.06 0.00 -1.81 0.00 0.00 61.98 58.02 3hi8 s VAL 22 Cb 0.00 -2.10 -0.17 0.00 0.56 0.00 0.00 36.38 34.68 3hi8 s VAL 22 CO 0.01 -0.56 -0.11 0.47 -0.31 0.00 0.00 175.10 174.61 3hi8 n ASP 23 N -0.41 1.75 -4.67 4.85 8.00 -1.26 -3.60 116.55 121.20 3hi8 n ASP 23 Ca -0.08 -0.08 -0.36 0.00 0.71 0.00 0.00 54.79 54.98 3hi8 n ASP 23 Cb 0.61 0.08 -0.09 0.00 -0.02 0.00 0.00 41.12 41.70 3hi8 n ASP 23 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3hi8 s GLU 24 N -2.44 4.11 -0.27 -1.24 2.02 -1.26 -1.98 118.70 117.64 3hi8 s GLU 24 Ca -0.23 -0.20 -0.09 0.00 0.02 0.00 0.00 54.97 54.48 3hi8 s GLU 24 Cb 0.07 -3.52 -0.03 0.00 0.10 0.00 0.00 34.13 30.75 3hi8 s GLU 24 CO 0.58 0.09 0.12 0.00 0.02 0.00 0.00 175.26 176.07 3hi8 s LYS 26 N 1.66 4.30 -0.10 0.00 1.02 -1.26 0.46 119.74 125.81 3hi8 s LYS 26 Ca 0.06 1.16 -0.00 0.00 0.02 0.00 0.00 55.97 57.21 3hi8 s LYS 26 Cb -0.16 -3.59 -0.02 0.00 -0.52 0.00 0.00 37.83 33.54 3hi8 s LYS 26 CO 0.06 -0.41 -0.09 0.42 -0.92 0.00 0.00 175.35 174.41 3hi8 s ILE 27 N 2.42 3.47 -0.25 2.17 1.01 10.71 -4.62 121.20 136.11 3hi8 s ILE 27 Ca 0.41 -0.54 -0.03 0.00 0.00 0.00 0.00 60.65 60.50 3hi8 s ILE 27 Cb -0.16 -2.45 0.02 0.00 0.01 0.00 0.00 42.46 39.88 3hi8 s ILE 27 CO 0.12 0.55 -0.04 -0.60 0.00 0.00 0.00 174.94 174.96 3hi8 s ARG 28 N -0.18 2.94 -0.38 2.79 3.52 -1.12 -0.12 118.95 126.39 3hi8 s ARG 28 Ca 0.01 -0.92 -0.04 0.00 -0.13 0.00 0.00 55.73 54.66 3hi8 s ARG 28 Cb -0.13 -3.03 0.08 0.00 -1.56 0.00 0.00 34.95 30.31 3hi8 s ARG 28 CO 0.03 -0.38 0.16 -0.51 -0.81 0.00 0.00 175.30 173.79 3hi8 s LEU 29 N 1.37 4.84 0.36 -0.88 1.02 -1.25 0.01 118.68 124.14 3hi8 s LEU 29 Ca 0.01 -1.68 0.07 0.00 0.02 0.00 0.00 54.13 52.56 3hi8 s LEU 29 Cb -0.16 -1.83 -0.02 0.00 0.02 0.00 0.00 46.19 44.20 3hi8 s LEU 29 CO -0.04 -0.46 0.38 0.20 0.02 0.00 0.00 176.35 176.46 3hi8 s ASN 30 N 1.71 5.44 0.27 2.29 0.01 -0.34 -4.33 114.94 119.99 3hi8 s ASN 30 Ca 0.03 -0.46 0.21 0.00 -0.71 0.00 0.00 52.86 51.93 3hi8 s ASN 30 Cb -0.22 -0.92 1.03 0.00 0.41 0.00 0.00 41.25 41.55 3hi8 s ASN 30 CO -0.02 -0.48 1.64 -0.62 -1.51 0.00 0.00 177.10 176.12 3hi8 n GLU 31 N -1.52 0.15 -0.10 -0.60 4.71 -1.26 -2.55 120.64 119.47 3hi8 n GLU 31 Ca 0.01 0.54 -0.12 0.00 -0.01 0.00 0.00 57.16 57.58 3hi8 n GLU 31 Cb 0.60 -1.89 -0.15 0.00 -1.01 0.00 0.00 31.44 28.99 3hi8 n GLU 31 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 3hi8 n GLU 32 N -2.19 0.68 -3.93 3.49 4.71 -1.26 -4.98 120.64 117.16 3hi8 n GLU 32 Ca 0.00 0.05 -0.02 0.00 -0.01 0.00 0.00 57.16 57.19 3hi8 n GLU 32 Cb 0.11 -1.54 0.02 0.00 -1.01 0.00 0.00 31.44 29.02 3hi8 n GLU 32 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 3hi8 s SER 33 N -5.81 0.01 -0.13 1.62 0.01 -1.06 -3.85 113.70 104.50 3hi8 s SER 33 Ca -0.16 -0.56 0.01 0.00 1.31 0.00 0.00 55.95 56.55 3hi8 s SER 33 Cb 0.07 0.40 -0.01 0.00 0.21 0.00 0.00 66.02 66.69 3hi8 s SER 33 CO 0.77 -0.80 -0.16 -1.48 0.41 0.00 0.00 173.24 171.97 3hi8 s LEU 34 N -3.55 2.51 0.55 2.44 2.34 -1.25 -1.20 118.68 120.51 3hi8 s LEU 34 Ca 0.25 -0.41 0.04 0.00 0.06 0.00 0.00 54.13 54.07 3hi8 s LEU 34 Cb -0.02 -1.55 0.03 0.00 -0.56 0.00 0.00 46.19 44.09 3hi8 s LEU 34 CO 0.04 0.15 0.30 -0.94 -1.06 0.00 0.00 176.35 174.85 3hi8 s SER 35 N 0.41 4.49 0.05 1.48 1.04 0.10 -2.75 113.70 118.52 3hi8 s SER 35 Ca -0.12 -1.39 -0.17 0.00 0.48 0.00 0.00 55.95 54.75 3hi8 s SER 35 Cb -0.16 0.55 0.03 0.00 0.10 0.00 0.00 66.02 66.54 3hi8 s SER 35 CO 0.06 -1.09 0.38 -0.63 0.98 0.00 0.00 173.24 172.94 3hi8 s ILE 36 N -2.82 0.07 0.00 -1.02 -1.09 0.23 -2.80 121.20 113.77 3hi8 s ILE 36 Ca 0.25 -0.54 0.00 0.00 -2.23 0.00 0.00 60.65 58.13 3hi8 s ILE 36 Cb -0.02 -0.98 0.00 0.00 -1.58 0.00 0.00 42.46 39.89 3hi8 s ILE 36 CO 0.15 -0.30 0.00 -1.14 -1.23 0.00 0.00 174.94 172.43 3hi8 n ARG 37 N 0.44 0.00 -3.78 2.79 0.63 -1.26 0.11 116.66 115.58 3hi8 n ARG 37 Ca -0.18 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 56.65 3hi8 n ARG 37 Cb 0.60 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.45 3hi8 n ARG 37 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3hi8 s ALA 38 N 0.00 -0.51 -0.22 5.13 0.00 -1.26 -4.51 121.76 120.39 3hi8 s ALA 38 Ca 0.00 -0.42 -0.13 0.00 0.00 0.00 0.00 51.96 51.40 3hi8 s ALA 38 Cb 0.00 0.66 -0.04 0.00 0.00 0.00 0.00 23.12 23.73 3hi8 s ALA 38 CO 0.00 -0.61 0.28 0.08 0.00 0.00 0.00 175.76 175.52 3hi8 s VAL 39 N -3.86 5.27 0.97 0.00 1.01 -1.26 -4.11 120.40 118.42 3hi8 s VAL 39 Ca 0.07 0.45 -0.12 0.00 0.00 0.00 0.00 61.98 62.38 3hi8 s VAL 39 Cb 0.03 -3.62 0.11 0.00 0.00 0.00 0.00 36.38 32.90 3hi8 s VAL 39 CO -0.09 0.29 0.71 -0.90 0.00 0.00 0.00 175.10 175.12 3hi8 n ASP 40 N 4.41 -1.15 -0.23 3.32 5.75 -1.03 -4.71 116.55 122.91 3hi8 n ASP 40 Ca -0.12 0.28 0.03 0.00 -0.01 0.00 0.00 54.79 54.98 3hi8 n ASP 40 Cb 0.51 -1.30 0.14 0.00 -1.03 0.00 0.00 41.12 39.45 3hi8 n ASP 40 CO 0.00 0.00 0.00 -0.65 -0.11 0.00 0.00 177.20 176.44 3hi8 h PRO 41 N -1.84 0.33 0.00 0.11 0.11 -1.95 0.84 132.00 129.60 3hi8 h PRO 41 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3hi8 h PRO 41 Cb 1.29 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3hi8 h PRO 41 CO 0.38 0.22 0.00 0.00 -0.21 0.00 0.00 178.00 178.39 3hi8 n ALA 42 N -2.57 2.17 -2.73 -0.75 0.00 -1.26 -4.82 120.51 110.54 3hi8 n ALA 42 Ca 0.11 -0.09 -0.21 0.00 0.00 0.00 0.00 53.44 53.26 3hi8 n ALA 42 Cb 0.37 -1.24 0.01 0.00 0.00 0.00 0.00 19.45 18.59 3hi8 n ALA 42 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3hi8 n ASN 43 N -0.90 -5.54 -2.38 0.00 5.03 0.29 -4.89 115.26 106.86 3hi8 n ASN 43 Ca 0.11 -0.12 -0.26 0.00 0.87 0.00 0.00 54.58 55.18 3hi8 n ASN 43 Cb 0.05 -4.56 0.00 0.00 -1.02 0.00 0.00 39.78 34.25 3hi8 n ASN 43 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 3hi8 n VAL 44 N -4.12 2.38 0.00 2.41 0.31 -1.26 -4.90 118.33 113.16 3hi8 n VAL 44 Ca -0.16 -4.75 0.00 0.00 -0.01 0.00 0.00 64.34 59.42 3hi8 n VAL 44 Cb 0.64 -1.21 0.00 0.00 -0.91 0.00 0.00 33.84 32.36 3hi8 n VAL 44 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3hi8 n GLY 45 N -0.52 1.20 2.69 2.92 0.00 -1.25 -4.52 105.19 105.71 3hi8 n GLY 45 Ca 0.40 0.53 -0.22 0.00 0.00 0.00 0.00 46.02 46.73 3hi8 n GLY 45 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3hi8 s MET 46 N 0.00 0.14 -0.36 1.61 1.75 -0.94 -2.48 119.30 119.02 3hi8 s MET 46 Ca 0.00 0.23 0.02 0.00 -1.25 0.00 0.00 55.69 54.69 3hi8 s MET 46 Cb 0.00 -0.83 0.10 0.00 2.84 0.00 0.00 34.83 36.95 3hi8 s MET 46 CO 0.00 -0.37 0.10 0.54 -0.65 0.00 0.00 175.02 174.64 3hi8 s VAL 47 N 2.10 2.64 -0.29 10.11 0.11 -1.02 -0.22 120.40 133.83 3hi8 s VAL 47 Ca 0.04 -2.23 -0.29 0.00 -2.93 0.00 0.00 61.98 56.57 3hi8 s VAL 47 Cb -0.13 -2.88 0.01 0.00 -1.53 0.00 0.00 36.38 31.85 3hi8 s VAL 47 CO -0.04 -0.62 1.14 -1.81 -3.33 0.00 0.00 175.10 170.44 3hi8 s ASP 48 N 1.23 6.90 -0.16 3.54 -0.00 -0.11 -4.36 116.67 123.72 3hi8 s ASP 48 Ca 0.10 1.20 -0.04 0.00 -0.00 0.00 0.00 52.55 53.80 3hi8 s ASP 48 Cb -0.20 -2.54 -0.03 0.00 -0.00 0.00 0.00 42.92 40.15 3hi8 s ASP 48 CO -0.07 -0.89 -0.02 -0.76 -0.00 0.00 0.00 175.17 173.44 3hi8 s LEU 49 N 3.74 3.35 -0.19 1.23 1.43 0.30 -2.53 118.68 126.01 3hi8 s LEU 49 Ca 0.49 -0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.51 3hi8 s LEU 49 Cb -0.15 -1.81 0.05 0.00 0.03 0.00 0.00 46.19 44.31 3hi8 s LEU 49 CO 0.16 0.18 -0.07 -0.89 0.23 0.00 0.00 176.35 175.95 3hi8 s THR 50 N 0.30 1.42 0.10 5.49 2.01 -1.26 0.77 115.64 124.47 3hi8 s THR 50 Ca -0.02 -0.91 -0.25 0.00 0.31 0.00 0.00 61.69 60.81 3hi8 s THR 50 Cb -0.14 -1.57 -0.06 0.00 0.01 0.00 0.00 72.50 70.73 3hi8 s THR 50 CO 0.02 0.10 0.79 -0.76 -0.69 0.00 0.00 174.62 174.08 3hi8 s LEU 51 N 1.48 4.51 0.50 4.42 1.43 -1.11 -3.87 118.68 126.05 3hi8 s LEU 51 Ca -0.01 1.55 0.08 0.00 -1.03 0.00 0.00 54.13 54.71 3hi8 s LEU 51 Cb -0.16 -3.28 0.03 0.00 0.03 0.00 0.00 46.19 42.81 3hi8 s LEU 51 CO -0.08 0.08 0.55 -1.81 0.23 0.00 0.00 176.35 175.32 3hi8 s ASP 52 N -0.46 5.04 0.23 2.29 1.01 -1.26 -3.83 116.67 119.69 3hi8 s ASP 52 Ca 0.38 -0.87 -0.32 0.00 0.71 0.00 0.00 52.55 52.46 3hi8 s ASP 52 Cb -0.22 -0.03 -0.13 0.00 1.01 0.00 0.00 42.92 43.55 3hi8 s ASP 52 CO 0.25 -1.02 1.46 0.00 0.21 0.00 0.00 175.17 176.08 3hi8 n ALA 53 N -1.88 1.35 -2.32 5.23 0.00 -1.25 -3.10 120.51 118.55 3hi8 n ALA 53 Ca 0.07 0.41 -0.20 0.00 0.00 0.00 0.00 53.44 53.72 3hi8 n ALA 53 Cb 0.62 -2.31 -0.02 0.00 0.00 0.00 0.00 19.45 17.74 3hi8 n ALA 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hi8 n ALA 54 N 2.23 -0.61 1.05 0.00 0.00 -1.26 -4.87 120.51 117.05 3hi8 n ALA 54 Ca 0.12 0.18 0.14 0.00 0.00 0.00 0.00 53.44 53.88 3hi8 n ALA 54 Cb 0.32 -2.09 0.63 0.00 0.00 0.00 0.00 19.45 18.31 3hi8 n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hi8 n ALA 55 N -1.70 2.36 -2.44 0.00 0.00 -1.18 -4.70 120.51 112.86 3hi8 n ALA 55 Ca -0.23 -0.11 -0.22 0.00 0.00 0.00 0.00 53.44 52.89 3hi8 n ALA 55 Cb 0.68 -1.47 -0.10 0.00 0.00 0.00 0.00 19.45 18.55 3hi8 n ALA 55 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3hi8 s PHE 56 N -2.95 1.99 0.23 0.00 -0.12 -1.26 -3.96 117.98 111.91 3hi8 s PHE 56 Ca 0.16 -0.69 0.24 0.00 -0.05 0.00 0.00 56.93 56.58 3hi8 s PHE 56 Cb 0.19 -1.14 1.05 0.00 -0.63 0.00 0.00 43.02 42.48 3hi8 s PHE 56 CO 0.52 0.29 1.89 0.93 -0.05 0.00 0.00 175.22 178.81 3hi8 h GLU 57 N 2.25 0.00 -2.45 1.99 3.07 -1.69 -3.46 114.58 114.29 3hi8 h GLU 57 Ca -0.40 0.00 0.14 0.00 -0.50 0.00 0.00 59.36 58.60 3hi8 h GLU 57 Cb 1.24 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 29.05 3hi8 h GLU 57 CO 0.68 0.22 0.44 -1.54 -1.40 0.00 0.00 179.01 177.40 3hi8 s SER 58 N -6.23 -0.25 0.00 1.42 1.04 -1.26 -5.00 113.70 103.42 3hi8 s SER 58 Ca -0.01 -0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.10 3hi8 s SER 58 Cb 0.11 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.74 3hi8 s SER 58 CO 0.63 -0.90 0.00 0.00 0.98 0.00 0.00 173.24 173.95 3hi8 n TYR 59 N -0.42 0.00 -4.24 5.02 -0.00 -0.42 -3.50 117.16 113.60 3hi8 n TYR 59 Ca -0.07 0.00 -0.17 0.00 -0.00 0.00 0.00 57.90 57.66 3hi8 n TYR 59 Cb 0.61 0.00 -0.14 0.00 -0.00 0.00 0.00 39.34 39.81 3hi8 n TYR 59 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.86 175.65 3hi8 s GLU 60 N -1.81 0.57 0.21 -3.48 0.41 -1.26 -4.84 118.70 108.49 3hi8 s GLU 60 Ca 0.00 -0.30 -0.22 0.00 -0.41 0.00 0.00 54.97 54.04 3hi8 s GLU 60 Cb 0.00 -0.54 0.05 0.00 -1.78 0.00 0.00 34.13 31.86 3hi8 s GLU 60 CO 0.00 0.14 0.67 0.00 -0.49 0.00 0.00 175.26 175.58 3hi8 s ALA 61 N -0.27 -1.44 -0.30 5.21 0.00 -1.25 -3.36 121.76 120.35 3hi8 s ALA 61 Ca 0.02 0.14 -0.05 0.00 0.00 0.00 0.00 51.96 52.08 3hi8 s ALA 61 Cb -0.03 0.86 0.19 0.00 0.00 0.00 0.00 23.12 24.13 3hi8 s ALA 61 CO -0.00 -0.89 0.79 -1.58 0.00 0.00 0.00 175.76 174.07 3hi8 s HIS 62 N -3.80 -1.19 0.00 0.00 2.46 -1.26 -4.87 115.29 106.62 3hi8 s HIS 62 Ca 0.06 1.07 0.00 0.00 0.47 0.00 0.00 55.06 56.65 3hi8 s HIS 62 Cb -0.03 0.34 0.00 0.00 -0.13 0.00 0.00 32.58 32.76 3hi8 s HIS 62 CO -0.04 -0.67 0.00 0.41 -2.47 0.00 0.00 174.74 171.97 3hi8 n GLY 63 N 5.40 3.17 1.61 1.59 0.00 -1.26 -4.97 105.19 110.73 3hi8 n GLY 63 Ca -0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 46.02 45.84 3hi8 n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hi8 n GLY 64 N 0.00 -0.70 3.68 -0.02 0.00 -1.26 -4.58 105.19 102.32 3hi8 n GLY 64 Ca 0.00 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 3hi8 n GLY 64 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hi8 s VAL 65 N -1.33 4.20 0.00 1.61 0.11 -1.26 -3.97 120.40 119.76 3hi8 s VAL 65 Ca 0.02 -0.52 0.04 0.00 -2.93 0.00 0.00 61.98 58.59 3hi8 s VAL 65 Cb -0.00 -2.85 -0.01 0.00 -1.53 0.00 0.00 36.38 31.98 3hi8 s VAL 65 CO 0.06 0.43 -0.13 -0.63 -3.33 0.00 0.00 175.10 171.50 3hi8 s ILE 66 N -1.04 1.02 -0.22 7.04 1.01 0.82 -4.71 121.20 125.12 3hi8 s ILE 66 Ca 0.18 -0.64 -0.08 0.00 0.00 0.00 0.00 60.65 60.12 3hi8 s ILE 66 Cb -0.11 -0.87 -0.04 0.00 0.01 0.00 0.00 42.46 41.45 3hi8 s ILE 66 CO 0.09 0.22 0.08 -0.83 0.00 0.00 0.00 174.94 174.49 3hi8 s GLY 67 N -0.48 1.86 0.05 6.18 0.00 -1.18 1.25 107.32 115.00 3hi8 s GLY 67 Ca 0.04 -0.92 0.04 0.00 0.00 0.00 0.00 44.72 43.88 3hi8 s GLY 67 CO -0.00 0.29 -0.04 0.14 0.00 0.00 0.00 173.10 173.49 3hi8 s VAL 68 N 0.97 3.82 -0.64 1.40 1.01 1.62 -3.11 120.40 125.47 3hi8 s VAL 68 Ca 0.04 -0.88 -0.06 0.00 0.00 0.00 0.00 61.98 61.08 3hi8 s VAL 68 Cb -0.14 -2.74 -0.05 0.00 0.00 0.00 0.00 36.38 33.45 3hi8 s VAL 68 CO 0.03 0.26 1.79 0.59 0.00 0.00 0.00 175.10 177.77 3hi8 n ASN 69 N 1.08 3.36 -0.43 3.32 4.13 -1.26 -2.39 115.26 123.07 3hi8 n ASN 69 Ca -0.13 -2.27 0.36 0.00 1.68 0.00 0.00 54.58 54.21 3hi8 n ASN 69 Cb 0.52 -0.93 0.67 0.00 -1.54 0.00 0.00 39.78 38.50 3hi8 n ASN 69 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 3hi8 h LEU 70 N 9.42 0.20 -1.38 3.41 7.12 -1.87 0.73 115.31 132.94 3hi8 h LEU 70 Ca 0.35 0.07 -0.02 0.00 0.13 0.00 0.00 57.88 58.42 3hi8 h LEU 70 Cb 0.17 0.05 -0.00 0.00 -0.53 0.00 0.00 40.66 40.35 3hi8 h LEU 70 CO 1.38 -0.05 -0.10 0.77 -0.13 0.00 0.00 178.44 180.31 3hi8 h SER 71 N 0.13 0.00 0.03 1.25 4.64 -1.65 -2.41 113.55 115.53 3hi8 h SER 71 Ca 0.73 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 61.67 3hi8 h SER 71 Cb 2.44 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 64.48 3hi8 h SER 71 CO -0.24 0.10 -2.22 0.54 -0.87 0.00 0.00 176.83 174.14 3hi8 n ARG 72 N -3.26 0.65 0.11 4.77 1.74 0.24 -4.42 116.66 116.49 3hi8 n ARG 72 Ca 0.00 0.27 0.07 0.00 -0.77 0.00 0.00 57.85 57.42 3hi8 n ARG 72 Cb 0.35 -1.59 0.54 0.00 -1.02 0.00 0.00 32.46 30.74 3hi8 n ARG 72 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3hi8 h LEU 73 N -0.39 0.23 -0.91 0.55 6.46 -1.29 -3.13 115.31 116.82 3hi8 h LEU 73 Ca -0.55 -0.00 0.24 0.00 -0.12 0.00 0.00 57.88 57.44 3hi8 h LEU 73 Cb 1.77 -0.05 -0.16 0.00 -0.73 0.00 0.00 40.66 41.48 3hi8 h LEU 73 CO -0.16 0.16 0.03 -0.08 -0.62 0.00 0.00 178.44 177.77 3hi8 h GLU 74 N 0.27 0.06 0.00 1.25 4.57 -1.64 0.67 114.58 119.75 3hi8 h GLU 74 Ca 0.10 -0.00 -0.29 0.00 -1.18 0.00 0.00 59.36 57.99 3hi8 h GLU 74 Cb 0.08 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.60 3hi8 h GLU 74 CO -0.02 0.04 -2.08 0.39 -1.18 0.00 0.00 179.01 176.15 3hi8 n GLU 75 N -5.43 0.67 -0.13 1.92 4.71 -1.18 -3.53 120.64 117.66 3hi8 n GLU 75 Ca 0.20 0.07 -0.13 0.00 -0.01 0.00 0.00 57.16 57.29 3hi8 n GLU 75 Cb 0.66 -1.62 -0.01 0.00 -1.01 0.00 0.00 31.44 29.46 3hi8 n GLU 75 CO 0.00 0.00 0.00 -0.24 0.09 0.00 0.00 177.13 176.98 3hi8 h VAL 76 N 0.00 1.27 0.00 2.62 3.04 -1.47 -2.51 116.25 119.19 3hi8 h VAL 76 Ca -0.39 -1.50 -0.01 0.00 -1.01 0.00 0.00 66.70 63.78 3hi8 h VAL 76 Cb 2.00 1.29 -0.00 0.00 -2.01 0.00 0.00 31.29 32.57 3hi8 h VAL 76 CO 0.04 0.51 -0.06 0.00 -1.01 0.00 0.00 177.57 177.05 3hi8 h ALA 77 N 0.81 0.99 -0.01 3.17 0.00 0.17 -2.91 119.26 121.47 3hi8 h ALA 77 Ca 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3hi8 h ALA 77 Cb 0.92 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3hi8 h ALA 77 CO 0.09 0.07 -0.17 0.41 0.00 0.00 0.00 179.25 179.64 3hi8 n GLY 78 N 0.43 -0.53 0.02 0.00 0.00 -0.98 -3.47 105.19 100.66 3hi8 n GLY 78 Ca 0.02 -0.39 0.12 0.00 0.00 0.00 0.00 46.02 45.77 3hi8 n GLY 78 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3hi8 n MET 79 N -0.51 0.03 -3.34 1.61 1.56 -0.98 -4.79 117.12 110.69 3hi8 n MET 79 Ca 0.14 0.09 -0.20 0.00 -0.27 0.00 0.00 57.70 57.46 3hi8 n MET 79 Cb 0.34 -1.54 0.00 0.00 2.15 0.00 0.00 33.22 34.16 3hi8 n MET 79 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 3hi8 s ALA 80 N -3.02 4.09 0.44 -5.12 0.00 -1.23 -5.14 121.76 111.79 3hi8 s ALA 80 Ca 0.12 -1.34 0.07 0.00 0.00 0.00 0.00 51.96 50.81 3hi8 s ALA 80 Cb 0.16 -1.81 -0.03 0.00 0.00 0.00 0.00 23.12 21.44 3hi8 s ALA 80 CO 0.48 -0.13 0.26 0.20 0.00 0.00 0.00 175.76 176.57 3hi8 s GLY 81 N -4.18 2.34 0.01 0.00 0.00 -1.26 -5.04 107.32 99.18 3hi8 s GLY 81 Ca 0.46 -1.81 -0.23 0.00 0.00 0.00 0.00 44.72 43.14 3hi8 s GLY 81 CO 0.33 -1.88 1.33 0.00 0.00 0.00 0.00 173.10 172.88 3hi8 h ALA 82 N 1.20 0.09 0.00 3.20 0.00 -1.95 -3.29 119.26 118.50 3hi8 h ALA 82 Ca -0.41 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.24 3hi8 h ALA 82 Cb 1.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3hi8 h ALA 82 CO 0.65 -0.13 0.00 0.41 0.00 0.00 0.00 179.25 180.18 3hi8 n GLY 83 N 0.12 0.00 3.61 0.00 0.00 -1.26 -1.31 105.19 106.35 3hi8 n GLY 83 Ca -0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.70 3hi8 n GLY 83 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hi8 s ASP 84 N -1.51 4.41 -0.03 1.61 -0.00 -1.24 -4.87 116.67 115.04 3hi8 s ASP 84 Ca 0.00 -0.60 -0.01 0.00 -0.00 0.00 0.00 52.55 51.93 3hi8 s ASP 84 Cb 0.00 -0.79 -0.04 0.00 -0.00 0.00 0.00 42.92 42.09 3hi8 s ASP 84 CO 0.00 0.05 0.06 -0.76 -0.00 0.00 0.00 175.17 174.53 3hi8 s LEU 85 N -3.24 3.85 0.12 1.23 1.43 -1.26 0.76 118.68 121.57 3hi8 s LEU 85 Ca 0.28 0.16 0.10 0.00 -1.03 0.00 0.00 54.13 53.64 3hi8 s LEU 85 Cb -0.08 -2.15 -0.04 0.00 0.03 0.00 0.00 46.19 43.95 3hi8 s LEU 85 CO 0.18 0.30 -0.23 -0.63 0.23 0.00 0.00 176.35 176.20 3hi8 s ILE 86 N -1.12 2.50 -0.11 -0.59 1.01 0.26 -4.74 121.20 118.42 3hi8 s ILE 86 Ca 0.20 -1.62 0.03 0.00 0.00 0.00 0.00 60.65 59.26 3hi8 s ILE 86 Cb -0.12 -2.12 -0.00 0.00 0.01 0.00 0.00 42.46 40.23 3hi8 s ILE 86 CO 0.11 0.12 -0.21 -1.00 0.00 0.00 0.00 174.94 173.96 3hi8 s HIS 87 N -1.07 2.64 -0.36 3.97 3.76 -1.07 0.32 115.29 123.47 3hi8 s HIS 87 Ca 0.15 -0.95 -0.05 0.00 -0.15 0.00 0.00 55.06 54.06 3hi8 s HIS 87 Cb -0.10 -1.76 0.06 0.00 1.11 0.00 0.00 32.58 31.89 3hi8 s HIS 87 CO 0.07 -0.37 0.14 -0.51 -0.85 0.00 0.00 174.74 173.22 3hi8 s LEU 88 N 0.38 4.59 -0.29 0.89 1.43 -0.71 -3.31 118.68 121.66 3hi8 s LEU 88 Ca -0.16 -1.41 0.01 0.00 -1.03 0.00 0.00 54.13 51.54 3hi8 s LEU 88 Cb -0.17 -1.86 0.09 0.00 0.03 0.00 0.00 46.19 44.28 3hi8 s LEU 88 CO 0.07 -0.40 0.04 0.42 0.23 0.00 0.00 176.35 176.71 3hi8 s THR 89 N 1.33 1.41 -0.24 5.49 -4.23 -1.11 -3.53 115.64 114.75 3hi8 s THR 89 Ca 0.00 -1.53 0.19 0.00 -1.18 0.00 0.00 61.69 59.17 3hi8 s THR 89 Cb -0.21 -1.92 0.49 0.00 1.34 0.00 0.00 72.50 72.20 3hi8 s THR 89 CO 0.01 -0.45 1.14 0.18 -0.54 0.00 0.00 174.62 174.95 3hi8 n LEU 90 N 4.66 2.31 0.00 4.79 4.77 -1.26 -2.66 117.00 129.61 3hi8 n LEU 90 Ca -0.04 -3.35 -0.06 0.00 -0.03 0.00 0.00 56.01 52.53 3hi8 n LEU 90 Cb 0.43 0.22 -0.12 0.00 -2.33 0.00 0.00 43.42 41.62 3hi8 n LEU 90 CO 0.16 1.24 -0.39 -0.78 -1.33 0.00 0.00 177.39 176.29 3hi8 h ASP 91 N 2.32 0.00 -0.42 -1.43 -0.00 -1.94 -3.39 116.42 111.56 3hi8 h ASP 91 Ca -0.03 0.00 0.03 0.00 -0.00 0.00 0.00 57.03 57.03 3hi8 h ASP 91 Cb 1.38 0.00 -0.03 0.00 -0.00 0.00 0.00 39.33 40.68 3hi8 h ASP 91 CO 0.30 0.90 0.22 1.05 -0.00 0.00 0.00 179.24 181.71 3hi8 h GLU 92 N 0.00 0.44 -2.57 0.28 9.09 -1.96 -3.46 114.58 116.40 3hi8 h GLU 92 Ca -0.23 -0.03 0.14 0.00 0.05 0.00 0.00 59.36 59.29 3hi8 h GLU 92 Cb 1.88 -0.10 -0.04 0.00 -1.65 0.00 0.00 28.75 28.85 3hi8 h GLU 92 CO 0.08 0.29 0.51 -1.21 0.05 0.00 0.00 179.01 178.73 3hi8 s GLU 93 N -6.15 1.44 0.00 1.06 0.41 -1.26 -5.02 118.70 109.18 3hi8 s GLU 93 Ca -0.13 -0.90 0.23 0.00 -0.41 0.00 0.00 54.97 53.75 3hi8 s GLU 93 Cb 0.12 0.42 0.29 0.00 -1.78 0.00 0.00 34.13 33.18 3hi8 s GLU 93 CO 0.72 -0.67 1.30 2.41 -0.49 0.00 0.00 175.26 178.53 3hi8 n THR 94 N -0.62 0.25 0.82 3.63 -1.04 -1.26 -4.25 114.28 111.81 3hi8 n THR 94 Ca -0.04 -0.63 0.13 0.00 -2.04 0.00 0.00 64.05 61.47 3hi8 n THR 94 Cb 0.60 1.23 0.36 0.00 -1.82 0.00 0.00 70.33 70.70 3hi8 n THR 94 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 3hi8 n ARG 95 N 1.37 0.12 -4.34 -2.82 3.00 -1.26 -3.49 116.66 109.25 3hi8 n ARG 95 Ca 0.16 0.06 -0.18 0.00 -0.00 0.00 0.00 57.85 57.89 3hi8 n ARG 95 Cb 0.58 -1.60 -0.10 0.00 0.00 0.00 0.00 32.46 31.34 3hi8 n ARG 95 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 3hi8 s LYS 96 N -3.06 1.30 -0.22 -0.14 -0.14 -1.12 0.25 119.74 116.62 3hi8 s LYS 96 Ca 0.11 -1.59 -0.02 0.00 -1.36 0.00 0.00 55.97 53.11 3hi8 s LYS 96 Cb 0.16 -1.01 0.06 0.00 -1.68 0.00 0.00 37.83 35.37 3hi8 s LYS 96 CO 0.64 0.13 0.03 -1.17 -0.76 0.00 0.00 175.35 174.22 3hi8 s LEU 97 N -3.30 1.58 -0.19 3.17 0.20 0.84 -4.65 118.68 116.32 3hi8 s LEU 97 Ca 0.22 -0.99 -0.07 0.00 0.69 0.00 0.00 54.13 53.98 3hi8 s LEU 97 Cb 0.01 -0.74 -0.04 0.00 -0.43 0.00 0.00 46.19 44.99 3hi8 s LEU 97 CO 0.06 -0.31 0.05 0.20 -0.29 0.00 0.00 176.35 176.07 3hi8 s ASN 98 N 1.74 5.45 0.04 3.68 0.01 -1.09 -1.73 114.94 123.04 3hi8 s ASN 98 Ca -0.01 0.01 0.03 0.00 -0.71 0.00 0.00 52.86 52.18 3hi8 s ASN 98 Cb -0.17 -1.94 -0.02 0.00 0.41 0.00 0.00 41.25 39.53 3hi8 s ASN 98 CO -0.10 0.14 -0.09 -0.51 -1.51 0.00 0.00 177.10 175.03 3hi8 s ILE 99 N 0.59 0.64 -0.14 0.60 2.07 -1.14 -2.76 121.20 121.06 3hi8 s ILE 99 Ca 0.03 -1.04 0.03 0.00 -1.41 0.00 0.00 60.65 58.25 3hi8 s ILE 99 Cb -0.13 -0.67 0.01 0.00 0.13 0.00 0.00 42.46 41.79 3hi8 s ILE 99 CO 0.01 -0.30 -0.22 -0.13 -1.91 0.00 0.00 174.94 172.39 3hi8 s ARG 100 N -1.47 3.03 -0.22 3.50 1.81 -1.21 -2.39 118.95 121.99 3hi8 s ARG 100 Ca -0.07 -0.86 -0.04 0.00 -1.72 0.00 0.00 55.73 53.04 3hi8 s ARG 100 Cb -0.09 -2.43 0.11 0.00 -0.45 0.00 0.00 34.95 32.09 3hi8 s ARG 100 CO 0.01 0.00 0.38 0.96 -0.68 0.00 0.00 175.30 175.97 3hi8 s ILE 101 N 0.77 -0.61 -1.40 1.52 -5.25 -1.11 -3.26 121.20 111.87 3hi8 s ILE 101 Ca -0.08 0.05 -0.10 0.00 -0.99 0.00 0.00 60.65 59.53 3hi8 s ILE 101 Cb -0.16 -0.73 0.03 0.00 2.95 0.00 0.00 42.46 44.55 3hi8 s ILE 101 CO -0.01 -0.03 1.14 0.47 -1.79 0.00 0.00 174.94 174.72 3hi8 n ASP 102 N 5.37 -5.98 0.00 4.36 9.92 -1.26 -2.10 116.55 126.86 3hi8 n ASP 102 Ca -0.06 -0.59 0.00 0.00 -0.53 0.00 0.00 54.79 53.61 3hi8 n ASP 102 Cb 0.50 -4.79 0.00 0.00 -0.64 0.00 0.00 41.12 36.19 3hi8 n ASP 102 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3hi8 n GLY 103 N -1.93 2.14 3.59 0.44 0.00 -1.26 -5.00 105.19 103.16 3hi8 n GLY 103 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 3hi8 n GLY 103 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hi8 s LEU 104 N 0.00 4.18 -0.14 0.99 1.98 -0.89 -5.06 118.68 119.73 3hi8 s LEU 104 Ca 0.00 0.23 -0.08 0.00 -2.89 0.00 0.00 54.13 51.39 3hi8 s LEU 104 Cb 0.00 -2.57 -0.04 0.00 0.66 0.00 0.00 46.19 44.24 3hi8 s LEU 104 CO 0.00 -0.34 0.13 -0.94 -1.89 0.00 0.00 176.35 173.30 3hi8 s SER 105 N 1.66 6.24 0.12 3.68 1.04 -1.26 -2.74 113.70 122.43 3hi8 s SER 105 Ca 0.18 0.37 0.09 0.00 0.48 0.00 0.00 55.95 57.07 3hi8 s SER 105 Cb -0.16 -2.04 -0.04 0.00 0.10 0.00 0.00 66.02 63.89 3hi8 s SER 105 CO 0.11 0.34 -0.19 -0.47 0.98 0.00 0.00 173.24 174.01 3hi8 s TYR 106 N -0.58 2.52 -0.17 5.02 5.04 -1.01 -4.96 117.35 123.22 3hi8 s TYR 106 Ca 0.12 -0.27 -0.04 0.00 -2.44 0.00 0.00 57.07 54.44 3hi8 s TYR 106 Cb -0.12 -1.34 0.07 0.00 0.35 0.00 0.00 41.96 40.92 3hi8 s TYR 106 CO 0.02 0.38 0.16 -0.08 -1.34 0.00 0.00 175.55 174.69 3hi8 s THR 107 N -1.13 -0.22 -0.06 4.34 -1.32 -1.18 -2.88 115.64 113.19 3hi8 s THR 107 Ca 0.18 -0.05 0.06 0.00 -1.21 0.00 0.00 61.69 60.67 3hi8 s THR 107 Cb -0.11 -0.57 -0.01 0.00 -1.51 0.00 0.00 72.50 70.31 3hi8 s THR 107 CO 0.10 -0.17 -0.24 -0.22 -2.21 0.00 0.00 174.62 171.87 3hi8 s LEU 108 N 2.25 2.12 -0.23 9.08 0.20 -0.71 -4.78 118.68 126.61 3hi8 s LEU 108 Ca 0.04 -0.49 -0.29 0.00 0.69 0.00 0.00 54.13 54.09 3hi8 s LEU 108 Cb -0.15 -1.39 0.01 0.00 -0.43 0.00 0.00 46.19 44.23 3hi8 s LEU 108 CO -0.10 0.25 1.08 0.00 -0.29 0.00 0.00 176.35 177.29 3hi8 s ALA 109 N -0.19 3.67 0.09 5.97 0.00 -1.00 0.29 121.76 130.60 3hi8 s ALA 109 Ca -0.03 0.20 0.02 0.00 0.00 0.00 0.00 51.96 52.15 3hi8 s ALA 109 Cb -0.14 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.37 3hi8 s ALA 109 CO 0.03 -1.11 0.19 -0.51 0.00 0.00 0.00 175.76 174.37 3hi8 s LEU 110 N 3.29 4.18 0.31 0.00 1.43 0.69 -4.73 118.68 123.85 3hi8 s LEU 110 Ca 0.46 0.16 -0.11 0.00 -1.03 0.00 0.00 54.13 53.60 3hi8 s LEU 110 Cb -0.16 -2.80 -0.07 0.00 0.03 0.00 0.00 46.19 43.19 3hi8 s LEU 110 CO 0.08 0.14 0.67 -0.63 0.23 0.00 0.00 176.35 176.84 3hi8 s ILE 111 N -1.54 4.81 -0.05 -0.59 1.01 -1.18 -4.28 121.20 119.38 3hi8 s ILE 111 Ca 0.33 0.64 -0.29 0.00 0.00 0.00 0.00 60.65 61.33 3hi8 s ILE 111 Cb -0.12 -3.65 -0.02 0.00 0.01 0.00 0.00 42.46 38.67 3hi8 s ILE 111 CO 0.26 -0.24 0.95 -0.62 0.00 0.00 0.00 174.94 175.30 3hi8 s ASP 112 N -2.59 7.27 0.50 3.58 3.68 -1.26 -3.09 116.67 124.76 3hi8 s ASP 112 Ca 0.50 1.54 0.29 0.00 2.13 0.00 0.00 52.55 57.01 3hi8 s ASP 112 Cb -0.11 -2.54 1.38 0.00 -1.45 0.00 0.00 42.92 40.20 3hi8 s ASP 112 CO 0.23 -0.32 1.84 -0.65 0.13 0.00 0.00 175.17 176.40 3hi8 h PRO 113 N 6.93 0.12 0.00 4.34 0.11 -1.90 -2.34 132.00 139.26 3hi8 h PRO 113 Ca -0.37 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.74 3hi8 h PRO 113 Cb 1.19 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3hi8 h PRO 113 CO 0.79 0.08 0.00 -0.25 -0.21 0.00 0.00 178.00 178.41 3hi8 n ASP 114 N -4.34 0.00 -0.37 -2.05 9.92 -1.26 -3.52 116.55 114.93 3hi8 n ASP 114 Ca 0.22 0.33 0.05 0.00 -0.53 0.00 0.00 54.79 54.86 3hi8 n ASP 114 Cb 0.99 -0.42 0.12 0.00 -0.64 0.00 0.00 41.12 41.17 3hi8 n ASP 114 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 3hi8 n SER 115 N -1.42 2.68 0.00 -2.24 7.64 -0.88 -4.89 113.62 114.51 3hi8 n SER 115 Ca 0.05 -2.37 0.00 0.00 1.01 0.00 0.00 58.87 57.57 3hi8 n SER 115 Cb 0.16 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 3hi8 n SER 115 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3hi8 n ILE 116 N -0.35 0.00 -3.76 0.44 5.41 -1.23 -5.09 119.36 114.78 3hi8 n ILE 116 Ca 0.10 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.76 3hi8 n ILE 116 Cb 0.48 -0.47 -0.06 0.00 -0.71 0.00 0.00 39.64 38.89 3hi8 n ILE 116 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 3hi8 s ARG 117 N 0.00 0.98 0.40 0.38 6.06 -1.26 -5.12 118.95 120.39 3hi8 s ARG 117 Ca 0.00 -0.86 -0.26 0.00 -2.50 0.00 0.00 55.73 52.11 3hi8 s ARG 117 Cb 0.00 0.41 -0.09 0.00 0.06 0.00 0.00 34.95 35.33 3hi8 s ARG 117 CO 0.00 -0.35 1.33 -0.65 -2.50 0.00 0.00 175.30 173.13 3hi8 s GLN 118 N -3.84 3.98 -0.21 5.12 -1.52 -1.26 -4.93 119.66 117.00 3hi8 s GLN 118 Ca 0.05 2.22 -0.14 0.00 -1.95 0.00 0.00 55.36 55.53 3hi8 s GLN 118 Cb 0.03 -2.79 -0.04 0.00 -0.22 0.00 0.00 33.01 29.99 3hi8 s GLN 118 CO -0.11 -0.50 0.33 -2.00 -0.25 0.00 0.00 175.29 172.77 3hi8 s GLU 119 N -2.21 4.14 1.36 2.91 2.12 -1.26 -4.84 118.70 120.92 3hi8 s GLU 119 Ca 0.56 0.07 -0.21 0.00 0.36 0.00 0.00 54.97 55.75 3hi8 s GLU 119 Cb -0.39 -3.54 0.34 0.00 0.26 0.00 0.00 34.13 30.79 3hi8 s GLU 119 CO 0.51 -0.02 0.80 -2.30 -0.54 0.00 0.00 175.26 173.71 3hi8 n PRO 120 N 4.45 -4.07 -4.17 4.30 -0.02 -1.26 -5.08 135.00 129.15 3hi8 n PRO 120 Ca -0.10 -1.20 -0.10 0.00 -2.02 0.00 0.00 63.50 60.07 3hi8 n PRO 120 Cb 0.51 -1.90 -0.10 0.00 -0.02 0.00 0.00 33.50 31.99 3hi8 n PRO 120 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 3hi8 s ASP 121 N -2.77 0.80 -0.48 2.55 -4.77 -1.26 -5.06 116.67 105.67 3hi8 s ASP 121 Ca 0.63 -1.11 -0.27 0.00 -3.30 0.00 0.00 52.55 48.50 3hi8 s ASP 121 Cb -0.14 0.18 -0.03 0.00 -1.09 0.00 0.00 42.92 41.84 3hi8 s ASP 121 CO 0.55 -0.60 1.96 -0.63 0.70 0.00 0.00 175.17 177.16 3hi8 s ILE 122 N -3.81 3.31 0.06 2.11 1.01 -1.26 -4.95 121.20 117.66 3hi8 s ILE 122 Ca 0.18 0.24 -0.35 0.00 0.00 0.00 0.00 60.65 60.72 3hi8 s ILE 122 Cb 0.07 -3.63 -0.14 0.00 0.01 0.00 0.00 42.46 38.77 3hi8 s ILE 122 CO -0.01 -0.54 1.62 -0.81 0.00 0.00 0.00 174.94 175.20 3hi8 n PRO 123 N 8.89 1.90 -2.91 2.79 -0.04 -1.26 -4.84 135.00 139.53 3hi8 n PRO 123 Ca 0.25 0.69 -0.44 0.00 -0.04 0.00 0.00 63.50 63.96 3hi8 n PRO 123 Cb 0.51 -2.45 -0.03 0.00 -0.04 0.00 0.00 33.50 31.49 3hi8 n PRO 123 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3hi8 s ASP 124 N 1.77 6.53 0.03 3.54 1.11 -1.26 -4.99 116.67 123.40 3hi8 s ASP 124 Ca 0.85 -1.82 0.01 0.00 0.18 0.00 0.00 52.55 51.77 3hi8 s ASP 124 Cb -0.76 -2.40 -0.02 0.00 1.07 0.00 0.00 42.92 40.80 3hi8 s ASP 124 CO 0.45 -1.14 -0.06 -0.76 1.18 0.00 0.00 175.17 174.84 3hi8 s LEU 125 N 2.99 2.23 -0.25 1.23 1.43 -1.26 -5.12 118.68 119.92 3hi8 s LEU 125 Ca 0.30 -0.48 -0.00 0.00 -1.03 0.00 0.00 54.13 52.92 3hi8 s LEU 125 Cb -0.07 -0.08 0.07 0.00 0.03 0.00 0.00 46.19 46.14 3hi8 s LEU 125 CO -0.06 -0.21 0.01 -0.62 0.23 0.00 0.00 176.35 175.70 3hi8 s ASP 126 N -1.39 3.73 0.37 2.29 3.68 -1.26 -5.14 116.67 118.95 3hi8 s ASP 126 Ca -0.11 -1.26 0.07 0.00 2.13 0.00 0.00 52.55 53.38 3hi8 s ASP 126 Cb -0.09 -1.00 -0.00 0.00 -1.45 0.00 0.00 42.92 40.37 3hi8 s ASP 126 CO -0.00 -0.30 0.51 -0.76 0.13 0.00 0.00 175.17 174.75 3hi8 s LEU 127 N 1.52 3.86 0.49 -1.34 1.43 -1.26 -5.11 118.68 118.26 3hi8 s LEU 127 Ca -0.00 -0.27 0.06 0.00 -1.03 0.00 0.00 54.13 52.89 3hi8 s LEU 127 Cb -0.18 -2.72 0.01 0.00 0.03 0.00 0.00 46.19 43.33 3hi8 s LEU 127 CO -0.11 -0.56 0.36 0.00 0.23 0.00 0.00 176.35 176.28 3hi8 s ALA 128 N -2.24 4.19 -1.19 4.21 0.00 -0.99 -4.71 121.76 121.03 3hi8 s ALA 128 Ca 0.49 -1.58 -0.06 0.00 0.00 0.00 0.00 51.96 50.81 3hi8 s ALA 128 Cb -0.10 -0.75 0.01 0.00 0.00 0.00 0.00 23.12 22.28 3hi8 s ALA 128 CO 0.32 -0.34 0.80 0.00 0.00 0.00 0.00 175.76 176.54 3hi8 n ALA 129 N -1.62 -0.98 -2.21 0.00 0.00 -1.23 -3.41 120.51 111.06 3hi8 n ALA 129 Ca -0.00 0.30 -0.42 0.00 0.00 0.00 0.00 53.44 53.32 3hi8 n ALA 129 Cb 0.64 -4.17 -0.03 0.00 0.00 0.00 0.00 19.45 15.88 3hi8 n ALA 129 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3hi8 s ASN 130 N -3.07 6.89 0.28 0.00 0.01 -1.23 -3.32 114.94 114.50 3hi8 s ASN 130 Ca 0.40 2.26 0.09 0.00 -0.71 0.00 0.00 52.86 54.90 3hi8 s ASN 130 Cb -0.18 -2.59 -0.04 0.00 0.41 0.00 0.00 41.25 38.85 3hi8 s ASN 130 CO 0.49 -0.60 0.02 -0.63 -1.51 0.00 0.00 177.10 174.88 3hi8 s ILE 131 N 1.01 3.32 0.01 0.60 1.09 -0.65 -1.95 121.20 124.61 3hi8 s ILE 131 Ca 0.63 -1.88 -0.01 0.00 -1.10 0.00 0.00 60.65 58.28 3hi8 s ILE 131 Cb -0.35 -2.87 -0.01 0.00 -1.06 0.00 0.00 42.46 38.18 3hi8 s ILE 131 CO 0.31 -0.33 0.01 -0.69 -0.10 0.00 0.00 174.94 174.14 3hi8 s VAL 132 N -2.36 0.06 0.07 2.92 1.01 -1.25 -1.18 120.40 119.67 3hi8 s VAL 132 Ca 0.33 -0.49 -0.26 0.00 0.00 0.00 0.00 61.98 61.55 3hi8 s VAL 132 Cb -0.05 -0.18 0.09 0.00 0.00 0.00 0.00 36.38 36.23 3hi8 s VAL 132 CO 0.20 -0.27 0.76 -0.22 0.00 0.00 0.00 175.10 175.58 3hi8 s LEU 133 N -0.81 -0.45 0.25 3.92 0.20 0.24 -4.62 118.68 117.41 3hi8 s LEU 133 Ca -0.09 -0.01 -0.29 0.00 0.69 0.00 0.00 54.13 54.43 3hi8 s LEU 133 Cb -0.06 2.28 -0.09 0.00 -0.43 0.00 0.00 46.19 47.90 3hi8 s LEU 133 CO -0.00 -0.78 0.93 -1.61 -0.29 0.00 0.00 176.35 174.59 3hi8 s GLU 134 N -3.40 4.79 0.53 1.98 2.02 -1.26 0.42 118.70 123.78 3hi8 s GLU 134 Ca 0.03 1.44 0.37 0.00 0.02 0.00 0.00 54.97 56.82 3hi8 s GLU 134 Cb -0.01 -3.21 1.53 0.00 0.10 0.00 0.00 34.13 32.54 3hi8 s GLU 134 CO -0.10 0.49 1.77 0.78 0.02 0.00 0.00 175.26 178.22 3hi8 h GLY 135 N 4.02 0.13 1.78 -1.39 0.00 2.22 -1.06 103.07 108.79 3hi8 h GLY 135 Ca -0.45 -0.02 -0.10 0.00 0.00 0.00 0.00 47.33 46.75 3hi8 h GLY 135 CO 0.67 -0.02 -0.40 0.00 0.00 0.00 0.00 176.54 176.80 3hi8 h THR 136 N 0.03 1.30 0.00 4.70 1.03 -1.70 0.70 112.91 118.98 3hi8 h THR 136 Ca 0.61 -1.48 -0.18 0.00 -0.01 0.00 0.00 66.41 65.35 3hi8 h THR 136 Cb 2.37 1.66 -0.03 0.00 -1.07 0.00 0.00 68.15 71.07 3hi8 h THR 136 CO -0.04 0.44 -1.51 1.41 -0.01 0.00 0.00 175.52 175.81 3hi8 n HIS 137 N -4.04 0.90 -0.13 0.00 8.25 -0.44 -2.85 115.22 116.91 3hi8 n HIS 137 Ca -0.01 0.30 -0.11 0.00 -0.26 0.00 0.00 57.72 57.64 3hi8 n HIS 137 Cb 0.47 -1.07 -0.02 0.00 1.12 0.00 0.00 29.99 30.48 3hi8 n HIS 137 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3hi8 h LEU 138 N 0.00 0.79 -0.43 2.41 7.12 -1.29 0.47 115.31 124.39 3hi8 h LEU 138 Ca -0.19 -0.38 -0.18 0.00 0.13 0.00 0.00 57.88 57.26 3hi8 h LEU 138 Cb 1.64 -0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 41.54 3hi8 h LEU 138 CO 0.05 0.99 -0.77 -2.24 -0.13 0.00 0.00 178.44 176.34 3hi8 h ASP 139 N 0.59 0.27 0.75 1.25 -0.00 -1.00 -2.03 116.42 116.25 3hi8 h ASP 139 Ca 0.09 -0.19 -0.05 0.00 -0.00 0.00 0.00 57.03 56.88 3hi8 h ASP 139 Cb 0.66 -0.08 -0.01 0.00 -0.00 0.00 0.00 39.33 39.91 3hi8 h ASP 139 CO 0.05 0.94 -0.21 0.03 -0.00 0.00 0.00 179.24 180.04 3hi8 h ARG 140 N 0.14 0.00 0.00 4.15 3.08 -1.36 0.29 114.38 120.69 3hi8 h ARG 140 Ca -0.03 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.77 3hi8 h ARG 140 Cb 1.35 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.41 3hi8 h ARG 140 CO 0.12 0.21 -1.01 0.78 -1.07 0.00 0.00 179.97 179.00 3hi8 h GLY 141 N 1.71 0.66 1.06 0.04 0.00 -0.73 -3.13 103.07 102.67 3hi8 h GLY 141 Ca -0.00 -1.16 -0.07 0.00 0.00 0.00 0.00 47.33 46.10 3hi8 h GLY 141 CO 0.03 1.02 0.14 -2.22 0.00 0.00 0.00 176.54 175.51 3hi8 h ILE 142 N 0.33 1.26 0.00 2.60 1.08 -0.34 -2.58 117.51 119.86 3hi8 h ILE 142 Ca -0.11 -0.99 -0.00 0.00 -0.39 0.00 0.00 64.86 63.36 3hi8 h ILE 142 Cb 1.66 0.62 -0.00 0.00 -3.07 0.00 0.00 36.82 36.02 3hi8 h ILE 142 CO 0.19 0.38 -0.02 0.11 -0.69 0.00 0.00 178.15 178.12 3hi8 h LYS 143 N 1.01 0.00 0.00 2.37 1.57 -0.50 -0.23 116.57 120.79 3hi8 h LYS 143 Ca 0.21 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.88 3hi8 h LYS 143 Cb 0.40 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.70 3hi8 h LYS 143 CO 0.01 0.02 -0.93 0.00 -0.57 0.00 0.00 179.45 177.98 3hi8 h ALA 144 N 1.98 0.66 -0.00 3.86 0.00 -1.41 -3.29 119.26 121.06 3hi8 h ALA 144 Ca -0.00 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3hi8 h ALA 144 Cb 0.10 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3hi8 h ALA 144 CO 0.00 0.57 -0.92 0.00 0.00 0.00 0.00 179.25 178.90 3hi8 n ALA 145 N -2.28 4.59 0.09 0.00 0.00 -0.60 -4.43 120.51 117.89 3hi8 n ALA 145 Ca -0.03 -0.59 0.01 0.00 0.00 0.00 0.00 53.44 52.83 3hi8 n ALA 145 Cb 0.73 -0.79 0.04 0.00 0.00 0.00 0.00 19.45 19.43 3hi8 n ALA 145 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3hi8 n ASP 146 N -1.36 0.00 0.00 0.00 9.92 -0.20 -3.47 116.55 121.44 3hi8 n ASP 146 Ca 0.05 0.05 0.00 0.00 -0.53 0.00 0.00 54.79 54.35 3hi8 n ASP 146 Cb 0.34 -0.09 0.00 0.00 -0.64 0.00 0.00 41.12 40.74 3hi8 n ASP 146 CO 0.00 0.00 0.00 0.23 0.13 0.00 0.00 177.20 177.56 3hi8 n MET 147 N -1.09 0.17 -0.13 -1.24 2.81 -1.26 -4.96 117.12 111.42 3hi8 n MET 147 Ca 0.01 0.00 -0.21 0.00 -1.81 0.00 0.00 57.70 55.69 3hi8 n MET 147 Cb 0.01 -0.01 -0.12 0.00 -0.71 0.00 0.00 33.22 32.39 3hi8 n MET 147 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3hi8 n VAL 148 N 0.00 1.51 -4.31 2.03 0.31 -1.23 -4.95 118.33 111.70 3hi8 n VAL 148 Ca 0.00 -0.52 -0.18 0.00 -0.01 0.00 0.00 64.34 63.63 3hi8 n VAL 148 Cb 0.00 -1.56 -0.10 0.00 -0.91 0.00 0.00 33.84 31.27 3hi8 n VAL 148 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3hi8 s SER 149 N -6.79 2.34 -0.06 4.52 0.15 -1.24 -4.16 113.70 108.46 3hi8 s SER 149 Ca -0.36 -0.94 -0.17 0.00 0.70 0.00 0.00 55.95 55.18 3hi8 s SER 149 Cb 0.10 -0.11 -0.31 0.00 -1.71 0.00 0.00 66.02 64.00 3hi8 s SER 149 CO 0.58 -0.17 0.76 0.44 1.20 0.00 0.00 173.24 176.05 3hi8 h ASP 150 N 2.93 0.52 -3.16 5.45 3.32 -1.87 -3.40 116.42 120.20 3hi8 h ASP 150 Ca -0.39 -0.91 -0.63 0.00 0.02 0.00 0.00 57.03 55.12 3hi8 h ASP 150 Cb 1.21 -0.17 -0.11 0.00 0.22 0.00 0.00 39.33 40.48 3hi8 h ASP 150 CO 0.58 1.58 -0.64 -1.38 -1.72 0.00 0.00 179.24 177.65 3hi8 s HIS 151 N -2.49 3.00 -0.15 4.55 -3.43 -1.26 -1.55 115.29 113.96 3hi8 s HIS 151 Ca -0.15 -0.03 -0.12 0.00 -0.80 0.00 0.00 55.06 53.95 3hi8 s HIS 151 Cb 0.03 -1.51 -0.05 0.00 -1.43 0.00 0.00 32.58 29.62 3hi8 s HIS 151 CO 0.83 0.50 0.24 0.42 -2.00 0.00 0.00 174.74 174.72 3hi8 s ILE 152 N -1.45 5.34 0.10 -5.38 1.01 0.96 -4.65 121.20 117.12 3hi8 s ILE 152 Ca 0.27 0.43 -0.19 0.00 0.00 0.00 0.00 60.65 61.16 3hi8 s ILE 152 Cb -0.11 -3.57 -0.07 0.00 0.01 0.00 0.00 42.46 38.72 3hi8 s ILE 152 CO 0.19 0.45 0.59 -0.13 0.00 0.00 0.00 174.94 176.04 3hi8 s ARG 153 N 0.13 4.19 -0.21 2.79 0.52 -1.03 -1.47 118.95 123.87 3hi8 s ARG 153 Ca 0.15 0.73 0.13 0.00 -0.52 0.00 0.00 55.73 56.21 3hi8 s ARG 153 Cb -0.13 -3.16 0.44 0.00 0.52 0.00 0.00 34.95 32.62 3hi8 s ARG 153 CO 0.03 0.59 1.32 1.28 0.02 0.00 0.00 175.30 178.54 3hi8 n LEU 154 N 1.47 3.28 -1.13 2.53 4.77 0.14 -3.15 117.00 124.92 3hi8 n LEU 154 Ca -0.09 -3.55 -0.16 0.00 -0.03 0.00 0.00 56.01 52.18 3hi8 n LEU 154 Cb 0.51 -0.55 -0.03 0.00 -2.33 0.00 0.00 43.42 41.03 3hi8 n LEU 154 CO 0.42 1.09 0.32 -1.14 -1.33 0.00 0.00 177.39 176.75 3hi8 n ARG 155 N -1.10 0.00 -4.22 3.23 0.63 -0.41 -4.26 116.66 110.53 3hi8 n ARG 155 Ca 0.23 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.88 3hi8 n ARG 155 Cb 0.83 -0.37 -0.09 0.00 0.45 0.00 0.00 32.46 33.28 3hi8 n ARG 155 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 3hi8 s VAL 156 N 0.94 3.46 -0.46 5.15 1.01 -1.18 -0.88 120.40 128.45 3hi8 s VAL 156 Ca 0.27 -1.33 -0.05 0.00 0.00 0.00 0.00 61.98 60.87 3hi8 s VAL 156 Cb -0.37 -2.66 0.01 0.00 0.00 0.00 0.00 36.38 33.36 3hi8 s VAL 156 CO 0.19 0.04 0.49 -0.90 0.00 0.00 0.00 175.10 174.92 3hi8 n ASP 157 N 0.44 -6.38 -4.27 3.32 5.75 0.36 -4.16 116.55 111.62 3hi8 n ASP 157 Ca -0.12 0.12 -0.43 0.00 -0.01 0.00 0.00 54.79 54.35 3hi8 n ASP 157 Cb 0.53 -4.25 -0.03 0.00 -1.03 0.00 0.00 41.12 36.35 3hi8 n ASP 157 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 3hi8 s GLY 158 N -2.54 3.02 -0.06 6.12 0.00 -1.26 -4.45 107.32 108.16 3hi8 s GLY 158 Ca 0.07 -3.69 -0.00 0.00 0.00 0.00 0.00 44.72 41.10 3hi8 s GLY 158 CO 0.56 1.27 0.05 0.00 0.00 0.00 0.00 173.10 174.98 3hi8 n ALA 159 N 2.95 -0.30 0.00 3.20 0.00 -1.26 -4.62 120.51 120.48 3hi8 n ALA 159 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 3hi8 n ALA 159 Cb 0.40 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 19.19 3hi8 n ALA 159 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3hi8 n GLU 160 N -1.33 0.00 -3.38 0.00 1.02 -1.26 -4.93 120.64 110.77 3hi8 n GLU 160 Ca -0.01 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.74 3hi8 n GLU 160 Cb 0.51 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.85 3hi8 n GLU 160 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 3hi8 s GLU 161 N 0.00 4.13 -0.09 3.49 -1.05 -1.26 -3.72 118.70 120.20 3hi8 s GLU 161 Ca 0.00 0.18 -0.32 0.00 -0.15 0.00 0.00 54.97 54.68 3hi8 s GLU 161 Cb 0.00 -3.57 0.12 0.00 -0.44 0.00 0.00 34.13 30.24 3hi8 s GLU 161 CO 0.00 -0.11 1.09 0.99 0.95 0.00 0.00 175.26 178.18 3hi8 s THR 162 N 1.55 0.00 0.09 1.83 2.01 -1.26 -4.60 115.64 115.26 3hi8 s THR 162 Ca 0.18 -0.07 0.04 0.00 0.31 0.00 0.00 61.69 62.15 3hi8 s THR 162 Cb -0.15 -1.17 -0.03 0.00 0.01 0.00 0.00 72.50 71.15 3hi8 s THR 162 CO 0.08 0.00 -0.11 0.12 -0.69 0.00 0.00 174.62 174.03 3hi8 s PHE 163 N -2.72 1.07 -0.28 4.92 5.36 -1.25 0.14 117.98 125.22 3hi8 s PHE 163 Ca 0.09 -0.60 -0.15 0.00 -0.96 0.00 0.00 56.93 55.30 3hi8 s PHE 163 Cb -0.00 -0.59 0.10 0.00 -0.34 0.00 0.00 43.02 42.19 3hi8 s PHE 163 CO -0.06 0.01 0.76 -1.01 -1.46 0.00 0.00 175.22 173.47 3hi8 s HIS 164 N -2.14 -0.97 -0.79 10.12 3.76 -0.06 -3.49 115.29 121.73 3hi8 s HIS 164 Ca 0.03 1.91 -0.05 0.00 -0.15 0.00 0.00 55.06 56.80 3hi8 s HIS 164 Cb -0.05 0.58 0.20 0.00 1.11 0.00 0.00 32.58 34.42 3hi8 s HIS 164 CO 0.01 -0.48 0.66 0.42 -0.85 0.00 0.00 174.74 174.50 3hi8 s ILE 165 N 1.73 4.40 0.30 0.60 1.01 -1.19 -1.29 121.20 126.76 3hi8 s ILE 165 Ca -0.09 -3.26 0.10 0.00 0.00 0.00 0.00 60.65 57.39 3hi8 s ILE 165 Cb -0.05 -3.77 -0.05 0.00 0.01 0.00 0.00 42.46 38.60 3hi8 s ILE 165 CO -0.19 -1.00 -0.03 -1.83 0.00 0.00 0.00 174.94 171.90 3hi8 s GLU 166 N -0.60 2.11 -0.14 2.79 -1.05 -1.23 -3.22 118.70 117.37 3hi8 s GLU 166 Ca 0.22 -1.60 -0.04 0.00 -0.15 0.00 0.00 54.97 53.40 3hi8 s GLU 166 Cb -0.13 -2.01 0.06 0.00 -0.44 0.00 0.00 34.13 31.61 3hi8 s GLU 166 CO -0.08 0.27 0.17 0.00 0.95 0.00 0.00 175.26 176.56 3hi8 s ALA 167 N -2.43 -0.08 -0.01 -0.84 0.00 -0.73 -2.45 121.76 115.23 3hi8 s ALA 167 Ca 0.33 0.28 -0.15 0.00 0.00 0.00 0.00 51.96 52.42 3hi8 s ALA 167 Cb -0.04 -1.03 -0.06 0.00 0.00 0.00 0.00 23.12 22.00 3hi8 s ALA 167 CO 0.19 -0.90 0.40 -1.21 0.00 0.00 0.00 175.76 174.24 3hi8 s GLU 168 N 2.27 3.91 0.15 0.00 0.41 -1.26 -3.20 118.70 120.99 3hi8 s GLU 168 Ca 0.04 0.40 -0.16 0.00 -0.41 0.00 0.00 54.97 54.84 3hi8 s GLU 168 Cb -0.14 -3.22 0.03 0.00 -1.78 0.00 0.00 34.13 29.02 3hi8 s GLU 168 CO -0.08 0.68 0.44 0.20 -0.49 0.00 0.00 175.26 176.01 3hi8 s GLY 169 N -1.04 -0.19 -0.12 -1.39 0.00 -0.98 -4.64 107.32 98.96 3hi8 s GLY 169 Ca 0.23 -0.13 -0.39 0.00 0.00 0.00 0.00 44.72 44.44 3hi8 s GLY 169 CO 0.13 -0.30 1.57 1.34 0.00 0.00 0.00 173.10 175.84 3hi8 n ASP 170 N -0.27 2.06 -2.30 1.64 2.03 -1.26 -2.18 116.55 116.27 3hi8 n ASP 170 Ca -0.14 1.09 -0.14 0.00 0.52 0.00 0.00 54.79 56.13 3hi8 n ASP 170 Cb 0.63 -1.16 -0.01 0.00 -0.72 0.00 0.00 41.12 39.86 3hi8 n ASP 170 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 3hi8 n THR 171 N 3.70 -0.56 -3.64 5.18 5.66 -1.26 -4.92 114.28 118.44 3hi8 n THR 171 Ca 0.23 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 61.16 3hi8 n THR 171 Cb 0.15 -1.86 -0.07 0.00 -1.55 0.00 0.00 70.33 67.00 3hi8 n THR 171 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 3hi8 s ASP 172 N -2.05 -0.30 0.00 1.09 1.11 -0.93 -5.17 116.67 110.43 3hi8 s ASP 172 Ca 0.00 0.57 0.00 0.00 0.18 0.00 0.00 52.55 53.30 3hi8 s ASP 172 Cb 0.00 0.59 0.00 0.00 1.07 0.00 0.00 42.92 44.58 3hi8 s ASP 172 CO 0.00 -0.10 0.00 0.47 1.18 0.00 0.00 175.17 176.72 3hi8 n ASP 173 N 1.99 0.00 -3.62 0.27 8.00 -1.26 -2.32 116.55 119.60 3hi8 n ASP 173 Ca -0.12 -0.93 -0.07 0.00 0.71 0.00 0.00 54.79 54.39 3hi8 n ASP 173 Cb 0.56 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.60 3hi8 n ASP 173 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3hi8 s VAL 174 N -1.95 0.00 -0.03 2.53 0.11 -1.19 -4.98 120.40 114.88 3hi8 s VAL 174 Ca 0.00 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.04 3hi8 s VAL 174 Cb 0.00 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.87 3hi8 s VAL 174 CO 0.00 0.00 0.06 -0.62 -3.33 0.00 0.00 175.10 171.21 3hi8 s ASP 175 N -0.43 -0.02 -0.21 3.54 2.15 -1.26 -1.77 116.67 118.67 3hi8 s ASP 175 Ca 0.04 0.11 -0.04 0.00 0.43 0.00 0.00 52.55 53.10 3hi8 s ASP 175 Cb -0.03 0.06 -0.01 0.00 -0.30 0.00 0.00 42.92 42.64 3hi8 s ASP 175 CO -0.07 -0.08 -0.05 -0.76 -0.17 0.00 0.00 175.17 174.05 3hi8 s LEU 176 N 0.60 2.89 -0.25 -1.34 2.01 -1.20 -4.96 118.68 116.44 3hi8 s LEU 176 Ca -0.05 -0.38 -0.12 0.00 0.01 0.00 0.00 54.13 53.59 3hi8 s LEU 176 Cb -0.07 -1.73 -0.05 0.00 0.01 0.00 0.00 46.19 44.35 3hi8 s LEU 176 CO -0.02 -0.01 0.21 -0.94 1.01 0.00 0.00 176.35 176.61 3hi8 s SER 177 N 1.41 6.15 -0.34 2.29 1.04 -1.26 -3.19 113.70 119.80 3hi8 s SER 177 Ca 0.05 0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.63 3hi8 s SER 177 Cb -0.14 -2.13 0.11 0.00 0.10 0.00 0.00 66.02 63.95 3hi8 s SER 177 CO -0.03 0.00 0.12 -0.76 0.98 0.00 0.00 173.24 173.56 3hi8 s LEU 178 N 1.31 2.48 0.00 2.42 1.43 -1.23 -5.08 118.68 120.02 3hi8 s LEU 178 Ca 0.10 -1.89 -0.11 0.00 -1.03 0.00 0.00 54.13 51.20 3hi8 s LEU 178 Cb -0.14 -0.94 0.17 0.00 0.03 0.00 0.00 46.19 45.30 3hi8 s LEU 178 CO 0.07 -0.38 0.50 -2.65 0.23 0.00 0.00 176.35 174.11 3hi8 n PRO 179 N 4.53 -2.59 0.00 1.29 -0.02 -1.26 -3.97 135.00 132.98 3hi8 n PRO 179 Ca 0.01 -0.81 0.00 0.00 -2.02 0.00 0.00 63.50 60.68 3hi8 n PRO 179 Cb 0.40 -0.86 0.00 0.00 -0.02 0.00 0.00 33.50 33.03 3hi8 n PRO 179 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3hi8 n PRO 180 N -3.44 0.00 -0.27 0.52 -0.02 -1.26 -4.70 135.00 125.84 3hi8 n PRO 180 Ca 0.07 0.03 -0.11 0.00 -2.02 0.00 0.00 63.50 61.48 3hi8 n PRO 180 Cb 0.29 -0.61 -0.02 0.00 -0.02 0.00 0.00 33.50 33.15 3hi8 n PRO 180 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hi8 n ALA 181 N -2.47 -0.19 -3.18 3.55 0.00 -1.26 -2.05 120.51 114.91 3hi8 n ALA 181 Ca 0.00 0.08 -0.14 0.00 0.00 0.00 0.00 53.44 53.37 3hi8 n ALA 181 Cb 0.00 -0.31 0.07 0.00 0.00 0.00 0.00 19.45 19.21 3hi8 n ALA 181 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3hi8 n ASP 182 N 0.68 -5.33 -2.79 0.00 2.03 -1.26 -4.96 116.55 104.91 3hi8 n ASP 182 Ca 0.05 -0.64 -0.10 0.00 0.52 0.00 0.00 54.79 54.62 3hi8 n ASP 182 Cb -0.01 -4.87 0.06 0.00 -0.72 0.00 0.00 41.12 35.58 3hi8 n ASP 182 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 3hi8 n LEU 183 N -3.30 -0.68 0.00 -2.67 7.94 -0.87 -5.07 117.00 112.36 3hi8 n LEU 183 Ca -0.11 -3.88 0.00 0.00 -1.11 0.00 0.00 56.01 50.90 3hi8 n LEU 183 Cb 0.62 0.49 0.00 0.00 0.53 0.00 0.00 43.42 45.06 3hi8 n LEU 183 CO 0.55 1.94 0.00 -0.38 -1.11 0.00 0.00 177.39 178.39 3hi8 n ILE 184 N -0.06 0.00 -3.43 1.96 5.41 -1.26 -4.37 119.36 117.61 3hi8 n ILE 184 Ca 0.08 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.70 3hi8 n ILE 184 Cb 0.77 0.00 -0.02 0.00 -0.71 0.00 0.00 39.64 39.68 3hi8 n ILE 184 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 3hi8 s SER 185 N 0.00 -0.56 0.09 4.38 0.15 -1.26 -5.10 113.70 111.39 3hi8 s SER 185 Ca 0.00 0.05 -0.05 0.00 0.70 0.00 0.00 55.95 56.65 3hi8 s SER 185 Cb 0.00 0.58 -0.02 0.00 -1.71 0.00 0.00 66.02 64.87 3hi8 s SER 185 CO 0.00 -0.92 0.10 -0.63 1.20 0.00 0.00 173.24 172.99 3hi8 s ILE 186 N -3.52 0.16 -0.26 6.45 1.01 -1.26 -3.81 121.20 119.97 3hi8 s ILE 186 Ca 0.00 -1.51 -0.04 0.00 0.00 0.00 0.00 60.65 59.10 3hi8 s ILE 186 Cb -0.01 -1.53 0.09 0.00 0.01 0.00 0.00 42.46 41.02 3hi8 s ILE 186 CO -0.11 -0.73 0.12 -0.70 0.00 0.00 0.00 174.94 173.52 3hi8 s GLU 187 N -3.91 0.24 -0.83 2.79 -6.30 -0.82 -5.02 118.70 104.84 3hi8 s GLU 187 Ca 0.09 -0.49 -0.20 0.00 -2.50 0.00 0.00 54.97 51.86 3hi8 s GLU 187 Cb 0.06 -1.41 0.10 0.00 0.00 0.00 0.00 34.13 32.89 3hi8 s GLU 187 CO -0.08 -0.93 1.07 0.00 0.02 0.00 0.00 175.26 175.33 3hi8 s ALA 188 N 2.05 3.24 0.00 6.30 0.00 -1.26 -3.54 121.76 128.55 3hi8 s ALA 188 Ca 0.07 -2.39 0.00 0.00 0.00 0.00 0.00 51.96 49.64 3hi8 s ALA 188 Cb -0.16 -3.99 0.00 0.00 0.00 0.00 0.00 23.12 18.97 3hi8 s ALA 188 CO -0.29 -2.92 0.00 0.41 0.00 0.00 0.00 175.76 172.96 3hi8 n GLY 189 N 5.50 6.35 0.00 0.00 0.00 -1.26 -4.91 105.19 110.88 3hi8 n GLY 189 Ca 0.13 -2.09 0.07 0.00 0.00 0.00 0.00 46.02 44.14 3hi8 n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hi8 n ALA 190 N -3.00 2.96 -1.79 4.61 0.00 -1.26 -4.42 120.51 117.60 3hi8 n ALA 190 Ca 0.00 -0.38 -0.35 0.00 0.00 0.00 0.00 53.44 52.71 3hi8 n ALA 190 Cb 0.00 -0.53 -0.04 0.00 0.00 0.00 0.00 19.45 18.88 3hi8 n ALA 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hi8 s ALA 191 N -2.87 2.98 -0.00 0.00 0.00 -1.26 -4.63 121.76 115.97 3hi8 s ALA 191 Ca -0.02 0.65 0.01 0.00 0.00 0.00 0.00 51.96 52.59 3hi8 s ALA 191 Cb 0.10 -3.26 -0.00 0.00 0.00 0.00 0.00 23.12 19.96 3hi8 s ALA 191 CO 0.63 -0.25 -0.02 0.16 0.00 0.00 0.00 175.76 176.27 3hi8 s ASP 192 N -1.78 0.28 0.05 0.00 -4.77 -0.98 -3.10 116.67 106.38 3hi8 s ASP 192 Ca 0.63 -0.06 -0.02 0.00 -3.30 0.00 0.00 52.55 49.80 3hi8 s ASP 192 Cb -0.19 -0.03 -0.03 0.00 -1.09 0.00 0.00 42.92 41.58 3hi8 s ASP 192 CO 0.23 0.02 -0.00 -0.44 0.70 0.00 0.00 175.17 175.68 3hi8 s SER 193 N -0.10 0.44 0.14 2.11 0.01 -1.25 -3.29 113.70 111.75 3hi8 s SER 193 Ca 0.00 -0.94 0.03 0.00 1.31 0.00 0.00 55.95 56.36 3hi8 s SER 193 Cb -0.01 0.21 -0.04 0.00 0.21 0.00 0.00 66.02 66.39 3hi8 s SER 193 CO -0.00 -0.60 0.18 -0.76 0.41 0.00 0.00 173.24 172.47 3hi8 s LEU 194 N -2.84 4.03 0.17 2.44 2.01 -1.26 -0.68 118.68 122.54 3hi8 s LEU 194 Ca 0.06 0.02 -0.14 0.00 0.01 0.00 0.00 54.13 54.07 3hi8 s LEU 194 Cb 0.07 -2.63 0.02 0.00 0.01 0.00 0.00 46.19 43.65 3hi8 s LEU 194 CO -0.10 0.09 0.41 -0.36 1.01 0.00 0.00 176.35 177.40 3hi8 s PHE 195 N -1.68 0.04 -0.28 0.29 0.40 -0.54 -3.57 117.98 112.64 3hi8 s PHE 195 Ca 0.32 -0.39 -0.21 0.00 -0.60 0.00 0.00 56.93 56.05 3hi8 s PHE 195 Cb -0.11 0.21 -0.01 0.00 0.51 0.00 0.00 43.02 43.62 3hi8 s PHE 195 CO 0.25 -0.80 0.64 0.45 0.70 0.00 0.00 175.22 176.46 3hi8 s SER 196 N -2.89 6.55 0.48 1.36 0.15 -1.26 -0.03 113.70 118.06 3hi8 s SER 196 Ca 0.10 0.59 0.16 0.00 0.70 0.00 0.00 55.95 57.50 3hi8 s SER 196 Cb 0.01 -2.34 1.16 0.00 -1.71 0.00 0.00 66.02 63.14 3hi8 s SER 196 CO -0.04 -0.44 2.05 0.17 1.20 0.00 0.00 173.24 176.19 3hi8 h LEU 197 N 9.07 0.18 0.37 3.45 -0.00 -1.55 -2.89 115.31 123.94 3hi8 h LEU 197 Ca -0.26 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.60 3hi8 h LEU 197 Cb 1.12 -0.04 0.00 0.00 -0.00 0.00 0.00 40.66 41.74 3hi8 h LEU 197 CO 0.79 0.12 -0.18 -0.78 -0.00 0.00 0.00 178.44 178.39 3hi8 h ASP 198 N 0.21 -0.42 0.00 0.17 1.82 -1.93 0.14 116.42 116.41 3hi8 h ASP 198 Ca 0.16 -0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.76 3hi8 h ASP 198 Cb 0.36 0.11 0.00 0.00 0.68 0.00 0.00 39.33 40.48 3hi8 h ASP 198 CO -0.03 -0.23 0.00 -1.22 -1.61 0.00 0.00 179.24 176.16 3hi8 n TYR 199 N -5.27 0.00 -0.09 0.28 4.02 -1.10 0.80 117.16 115.81 3hi8 n TYR 199 Ca -0.11 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.69 3hi8 n TYR 199 Cb 0.24 0.00 -0.13 0.00 -0.02 0.00 0.00 39.34 39.43 3hi8 n TYR 199 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3hi8 n LEU 200 N -0.83 0.44 0.25 7.72 4.77 -0.58 -4.48 117.00 124.29 3hi8 n LEU 200 Ca 0.06 -0.02 -0.18 0.00 -0.03 0.00 0.00 56.01 55.84 3hi8 n LEU 200 Cb 0.03 0.25 -0.10 0.00 -2.33 0.00 0.00 43.42 41.27 3hi8 n LEU 200 CO 0.04 0.49 0.53 0.11 -1.33 0.00 0.00 177.39 177.24 3hi8 h LYS 201 N 0.00 -0.91 -0.11 3.23 1.57 0.31 0.59 116.57 121.25 3hi8 h LYS 201 Ca -0.47 0.06 0.03 0.00 -1.87 0.00 0.00 60.65 58.40 3hi8 h LYS 201 Cb 2.02 0.21 -0.00 0.00 0.08 0.00 0.00 32.23 34.54 3hi8 h LYS 201 CO 0.01 -0.61 0.12 -0.44 -0.57 0.00 0.00 179.45 177.96 3hi8 h ASP 202 N -0.95 0.00 0.09 0.86 3.32 -1.78 0.47 116.42 118.43 3hi8 h ASP 202 Ca -0.05 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.88 3hi8 h ASP 202 Cb 0.85 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.41 3hi8 h ASP 202 CO -0.11 0.00 -0.57 0.24 -1.72 0.00 0.00 179.24 177.08 3hi8 h MET 203 N 0.00 0.18 -0.48 3.56 2.86 -1.66 -3.34 114.93 116.05 3hi8 h MET 203 Ca 0.05 -0.31 0.00 0.00 -2.06 0.00 0.00 59.70 57.38 3hi8 h MET 203 Cb 0.29 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.07 3hi8 h MET 203 CO -0.00 1.15 0.00 0.09 1.06 0.00 0.00 176.91 179.21 3hi8 n ASN 204 N -4.29 4.11 0.18 1.22 4.13 0.15 -4.02 115.26 116.73 3hi8 n ASN 204 Ca -0.14 -2.48 0.14 0.00 1.68 0.00 0.00 54.58 53.78 3hi8 n ASN 204 Cb 0.70 -0.48 0.49 0.00 -1.54 0.00 0.00 39.78 38.95 3hi8 n ASN 204 CO 0.00 0.00 0.00 0.50 0.28 0.00 0.00 177.26 178.04 3hi8 h LYS 205 N 3.01 0.00 -0.03 3.52 3.64 -0.18 -2.79 116.57 123.75 3hi8 h LYS 205 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3hi8 h LYS 205 Cb 1.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 3hi8 h LYS 205 CO 0.17 0.00 -0.04 0.00 -2.27 0.00 0.00 179.45 177.32 3hi8 n ALA 206 N -1.90 2.55 -3.79 5.00 0.00 -1.26 -4.79 120.51 116.32 3hi8 n ALA 206 Ca 0.03 -0.67 -0.34 0.00 0.00 0.00 0.00 53.44 52.46 3hi8 n ALA 206 Cb 0.33 -0.73 -0.11 0.00 0.00 0.00 0.00 19.45 18.94 3hi8 n ALA 206 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3hi8 s ILE 207 N -1.85 3.38 0.00 0.00 1.09 -1.05 -5.02 121.20 117.76 3hi8 s ILE 207 Ca 0.24 -3.21 0.00 0.00 -1.10 0.00 0.00 60.65 56.58 3hi8 s ILE 207 Cb 0.18 -3.23 0.00 0.00 -1.06 0.00 0.00 42.46 38.35 3hi8 s ILE 207 CO 0.29 -0.88 0.00 -2.65 -0.10 0.00 0.00 174.94 171.60 3hi8 n PRO 208 N 3.20 0.00 -4.13 2.79 -0.02 -1.26 -4.56 135.00 131.01 3hi8 n PRO 208 Ca 0.09 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.43 3hi8 n PRO 208 Cb 0.36 -0.16 -0.11 0.00 -0.02 0.00 0.00 33.50 33.57 3hi8 n PRO 208 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3hi8 s THR 209 N 0.00 0.74 -0.30 3.45 -4.23 -1.26 -2.41 115.64 111.63 3hi8 s THR 209 Ca 0.00 -1.48 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 3hi8 s THR 209 Cb 0.00 -1.14 0.00 0.00 1.34 0.00 0.00 72.50 72.70 3hi8 s THR 209 CO 0.00 -0.55 0.00 0.47 -0.54 0.00 0.00 174.62 174.00 3hi8 n ASP 210 N 0.80 -2.77 -4.25 3.99 8.00 -1.26 -4.77 116.55 116.29 3hi8 n ASP 210 Ca -0.18 0.05 -0.34 0.00 0.71 0.00 0.00 54.79 55.02 3hi8 n ASP 210 Cb 0.57 -1.15 -0.15 0.00 -0.02 0.00 0.00 41.12 40.38 3hi8 n ASP 210 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hi8 s ALA 211 N -2.13 2.66 0.09 2.24 0.00 -1.26 -4.84 121.76 118.53 3hi8 s ALA 211 Ca 0.00 -1.18 -0.31 0.00 0.00 0.00 0.00 51.96 50.47 3hi8 s ALA 211 Cb 0.00 -1.54 -0.09 0.00 0.00 0.00 0.00 23.12 21.49 3hi8 s ALA 211 CO 0.00 -0.40 1.70 -1.21 0.00 0.00 0.00 175.76 175.85 3hi8 s GLU 212 N 1.42 4.18 -0.16 0.00 2.02 -1.26 0.69 118.70 125.58 3hi8 s GLU 212 Ca 0.06 2.41 -0.05 0.00 0.02 0.00 0.00 54.97 57.40 3hi8 s GLU 212 Cb -0.14 -3.58 -0.03 0.00 0.10 0.00 0.00 34.13 30.47 3hi8 s GLU 212 CO -0.06 -0.76 0.02 0.08 0.02 0.00 0.00 175.26 174.55 3hi8 s VAL 213 N 2.63 4.38 -0.19 2.63 1.01 1.43 -4.49 120.40 127.79 3hi8 s VAL 213 Ca 0.76 -0.19 -0.01 0.00 0.00 0.00 0.00 61.98 62.54 3hi8 s VAL 213 Cb -0.42 -2.94 0.00 0.00 0.00 0.00 0.00 36.38 33.03 3hi8 s VAL 213 CO 0.33 0.49 -0.13 0.42 0.00 0.00 0.00 175.10 176.21 3hi8 s THR 214 N 0.26 2.70 -0.32 3.92 -4.23 -1.10 -0.59 115.64 116.29 3hi8 s THR 214 Ca 0.01 -0.73 -0.05 0.00 -1.18 0.00 0.00 61.69 59.74 3hi8 s THR 214 Cb -0.13 -2.18 0.04 0.00 1.34 0.00 0.00 72.50 71.57 3hi8 s THR 214 CO 0.01 0.49 0.06 -0.69 -0.54 0.00 0.00 174.62 173.96 3hi8 s VAL 215 N 1.26 3.55 -0.53 2.29 1.01 -0.33 -1.84 120.40 125.81 3hi8 s VAL 215 Ca 0.03 -1.12 -0.28 0.00 0.00 0.00 0.00 61.98 60.61 3hi8 s VAL 215 Cb -0.14 -2.97 -0.00 0.00 0.00 0.00 0.00 36.38 33.26 3hi8 s VAL 215 CO -0.07 -0.09 1.63 -1.61 0.00 0.00 0.00 175.10 174.96 3hi8 s GLU 216 N 1.37 3.09 -0.09 2.72 2.02 0.52 -1.64 118.70 126.70 3hi8 s GLU 216 Ca -0.02 0.69 -0.14 0.00 0.02 0.00 0.00 54.97 55.52 3hi8 s GLU 216 Cb -0.19 -4.22 -0.05 0.00 0.10 0.00 0.00 34.13 29.77 3hi8 s GLU 216 CO 0.01 -2.17 0.35 -1.17 0.02 0.00 0.00 175.26 172.30 3hi8 s LEU 217 N 7.17 4.35 0.00 1.80 1.98 -1.21 -3.95 118.68 128.82 3hi8 s LEU 217 Ca 0.62 0.72 0.00 0.00 -2.89 0.00 0.00 54.13 52.58 3hi8 s LEU 217 Cb -0.14 -2.47 0.00 0.00 0.66 0.00 0.00 46.19 44.25 3hi8 s LEU 217 CO 0.25 0.20 0.00 0.61 -1.89 0.00 0.00 176.35 175.53 3hi8 n GLY 218 N 2.62 4.05 3.47 7.98 0.00 -1.23 -2.33 105.19 119.74 3hi8 n GLY 218 Ca -0.13 -1.59 -0.37 0.00 0.00 0.00 0.00 46.02 43.92 3hi8 n GLY 218 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hi8 s GLU 219 N -1.64 3.62 -1.30 1.61 2.02 -1.26 -2.31 118.70 119.44 3hi8 s GLU 219 Ca 0.00 -0.52 -0.10 0.00 0.02 0.00 0.00 54.97 54.37 3hi8 s GLU 219 Cb 0.00 -3.47 0.00 0.00 0.10 0.00 0.00 34.13 30.76 3hi8 s GLU 219 CO 0.00 -0.26 0.56 -1.91 0.02 0.00 0.00 175.26 173.67 3hi8 n GLU 220 N 4.97 -2.24 -4.16 1.61 2.13 -1.21 -4.99 120.64 116.76 3hi8 n GLU 220 Ca -0.15 0.38 -0.10 0.00 0.66 0.00 0.00 57.16 57.95 3hi8 n GLU 220 Cb 0.51 -4.17 -0.10 0.00 0.27 0.00 0.00 31.44 27.95 3hi8 n GLU 220 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 3hi8 s PHE 221 N -3.77 0.92 -0.20 4.31 2.99 -1.26 -4.91 117.98 116.07 3hi8 s PHE 221 Ca 0.21 -1.24 -0.35 0.00 0.00 0.00 0.00 56.93 55.55 3hi8 s PHE 221 Cb -0.08 -0.51 -0.11 0.00 0.00 0.00 0.00 43.02 42.32 3hi8 s PHE 221 CO 0.89 -0.51 1.99 -2.30 -0.00 0.00 0.00 175.22 175.28 3hi8 n PRO 222 N -0.13 1.72 -2.56 0.24 -0.02 -1.26 -4.72 135.00 128.27 3hi8 n PRO 222 Ca -0.05 0.58 -0.40 0.00 -2.02 0.00 0.00 63.50 61.61 3hi8 n PRO 222 Cb 0.64 -2.59 -0.05 0.00 -0.02 0.00 0.00 33.50 31.48 3hi8 n PRO 222 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3hi8 s VAL 223 N 5.37 3.80 -0.23 -1.45 0.11 -1.26 -4.90 120.40 121.85 3hi8 s VAL 223 Ca 0.99 1.70 -0.11 0.00 -2.93 0.00 0.00 61.98 61.63 3hi8 s VAL 223 Cb -0.75 -4.08 -0.05 0.00 -1.53 0.00 0.00 36.38 29.97 3hi8 s VAL 223 CO 0.51 0.36 0.19 -0.54 -3.33 0.00 0.00 175.10 172.30 3hi8 s LYS 224 N -0.94 4.11 -0.29 1.54 1.02 -1.25 -3.97 119.74 119.95 3hi8 s LYS 224 Ca 0.45 -0.18 -0.05 0.00 0.02 0.00 0.00 55.97 56.21 3hi8 s LYS 224 Cb -0.29 -3.52 0.02 0.00 -0.52 0.00 0.00 37.83 33.52 3hi8 s LYS 224 CO 0.36 0.09 0.05 -0.51 -0.92 0.00 0.00 175.35 174.42 3hi8 s LEU 225 N 0.96 3.74 -0.20 3.17 1.43 -1.12 -0.35 118.68 126.31 3hi8 s LEU 225 Ca 0.10 -0.80 -0.12 0.00 -1.03 0.00 0.00 54.13 52.28 3hi8 s LEU 225 Cb -0.13 -1.83 -0.05 0.00 0.03 0.00 0.00 46.19 44.21 3hi8 s LEU 225 CO 0.04 -0.19 0.23 -1.00 0.23 0.00 0.00 176.35 175.66 3hi8 s HIS 226 N 1.44 3.40 0.05 0.29 3.76 -0.77 -2.86 115.29 120.61 3hi8 s HIS 226 Ca 0.01 0.43 0.00 0.00 -0.15 0.00 0.00 55.06 55.36 3hi8 s HIS 226 Cb -0.17 -2.30 -0.03 0.00 1.11 0.00 0.00 32.58 31.19 3hi8 s HIS 226 CO 0.01 0.18 -0.05 0.71 -0.85 0.00 0.00 174.74 174.74 3hi8 s TYR 227 N 0.69 0.57 -0.41 1.40 1.51 -1.25 -2.69 117.35 117.16 3hi8 s TYR 227 Ca 0.12 -0.80 0.07 0.00 -1.01 0.00 0.00 57.07 55.45 3hi8 s TYR 227 Cb -0.13 -0.37 0.23 0.00 -0.11 0.00 0.00 41.96 41.58 3hi8 s TYR 227 CO 0.03 -0.23 0.52 1.04 -1.11 0.00 0.00 175.55 175.81 3hi8 n GLN 228 N 0.69 0.57 -0.34 -0.62 6.02 -0.98 -2.96 117.38 119.76 3hi8 n GLN 228 Ca -0.18 -2.99 0.16 0.00 -0.01 0.00 0.00 57.00 53.98 3hi8 n GLN 228 Cb 0.58 -1.37 0.38 0.00 1.02 0.00 0.00 30.24 30.85 3hi8 n GLN 228 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 3hi8 h ILE 229 N 2.93 0.65 0.00 5.09 1.08 -1.92 -3.37 117.51 121.97 3hi8 h ILE 229 Ca 0.10 -0.22 0.00 0.00 -0.39 0.00 0.00 64.86 64.34 3hi8 h ILE 229 Cb 0.92 -0.06 0.00 0.00 -3.07 0.00 0.00 36.82 34.61 3hi8 h ILE 229 CO 0.40 0.12 0.00 0.00 -0.69 0.00 0.00 178.15 177.98 3hi8 n ALA 230 N -2.36 0.00 1.81 1.87 0.00 -1.26 -4.83 120.51 115.74 3hi8 n ALA 230 Ca 0.24 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.80 3hi8 n ALA 230 Cb 0.66 0.00 0.62 0.00 0.00 0.00 0.00 19.45 20.73 3hi8 n ALA 230 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3hi8 n GLU 231 N 0.00 1.20 0.00 0.00 1.02 -1.26 -4.62 120.64 116.98 3hi8 n GLU 231 Ca 0.00 -0.30 0.00 0.00 -0.02 0.00 0.00 57.16 56.84 3hi8 n GLU 231 Cb 0.00 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 3hi8 n GLU 231 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hi8 n GLY 232 N 0.95 1.82 1.11 0.62 0.00 -1.26 -5.07 105.19 103.35 3hi8 n GLY 232 Ca 0.17 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.16 3hi8 n GLY 232 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 3hi8 n MET 233 N -0.16 1.91 -3.62 1.61 0.00 -1.26 -4.97 117.12 110.62 3hi8 n MET 233 Ca 0.00 -3.30 -0.06 0.00 0.00 0.00 0.00 57.70 54.34 3hi8 n MET 233 Cb 0.00 -1.81 -0.02 0.00 0.00 0.00 0.00 33.22 31.39 3hi8 n MET 233 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 3hi8 s GLY 234 N -2.79 -0.36 0.12 3.17 0.00 -1.26 -4.57 107.32 101.63 3hi8 s GLY 234 Ca 0.44 0.54 0.07 0.00 0.00 0.00 0.00 44.72 45.77 3hi8 s GLY 234 CO -0.02 0.16 -0.17 -1.59 0.00 0.00 0.00 173.10 171.48 3hi8 s THR 235 N -3.24 1.53 -0.22 0.90 2.01 -1.16 -2.31 115.64 113.15 3hi8 s THR 235 Ca 0.08 -1.66 -0.04 0.00 0.31 0.00 0.00 61.69 60.39 3hi8 s THR 235 Cb -0.01 -1.55 0.10 0.00 0.01 0.00 0.00 72.50 71.05 3hi8 s THR 235 CO -0.04 -0.26 0.22 0.27 -0.69 0.00 0.00 174.62 174.13 3hi8 s ILE 236 N -1.70 -0.31 -0.34 1.82 -4.36 -1.23 -4.14 121.20 110.94 3hi8 s ILE 236 Ca 0.08 -0.21 -0.14 0.00 -0.26 0.00 0.00 60.65 60.12 3hi8 s ILE 236 Cb -0.07 -0.74 -0.01 0.00 1.25 0.00 0.00 42.46 42.89 3hi8 s ILE 236 CO 0.04 -0.28 0.32 -0.89 0.24 0.00 0.00 174.94 174.38 3hi8 s THR 237 N 2.31 5.21 -0.20 8.37 2.01 -1.05 -3.97 115.64 128.31 3hi8 s THR 237 Ca 0.07 -0.05 -0.03 0.00 0.31 0.00 0.00 61.69 61.99 3hi8 s THR 237 Cb -0.16 -3.79 -0.01 0.00 0.01 0.00 0.00 72.50 68.56 3hi8 s THR 237 CO -0.16 -0.07 -0.07 -0.31 -0.69 0.00 0.00 174.62 173.31 3hi8 s TYR 238 N 1.92 2.92 -0.21 4.92 1.51 -1.13 -0.93 117.35 126.34 3hi8 s TYR 238 Ca 0.10 -0.96 -0.05 0.00 -1.01 0.00 0.00 57.07 55.15 3hi8 s TYR 238 Cb -0.17 -2.05 -0.02 0.00 -0.11 0.00 0.00 41.96 39.62 3hi8 s TYR 238 CO 0.11 -0.52 -0.02 1.41 -1.11 0.00 0.00 175.55 175.43 3hi8 s MET 239 N 1.29 3.50 0.05 -0.62 1.75 0.69 -2.78 119.30 123.18 3hi8 s MET 239 Ca 0.03 -0.57 0.04 0.00 -1.25 0.00 0.00 55.69 53.95 3hi8 s MET 239 Cb -0.14 -3.06 -0.04 0.00 2.84 0.00 0.00 34.83 34.43 3hi8 s MET 239 CO -0.03 -0.10 -0.05 -1.17 -0.65 0.00 0.00 175.02 173.02 3hi8 s LEU 240 N 1.27 3.25 0.10 4.11 0.20 -1.26 -2.22 118.68 124.13 3hi8 s LEU 240 Ca 0.03 -0.20 -0.32 0.00 0.69 0.00 0.00 54.13 54.33 3hi8 s LEU 240 Cb -0.14 -1.95 -0.11 0.00 -0.43 0.00 0.00 46.19 43.55 3hi8 s LEU 240 CO -0.00 0.23 1.80 0.00 -0.29 0.00 0.00 176.35 178.08 3hi8 n ALA 241 N 1.06 1.86 -0.52 5.97 0.00 -1.26 -4.16 120.51 123.46 3hi8 n ALA 241 Ca -0.14 0.33 -0.11 0.00 0.00 0.00 0.00 53.44 53.53 3hi8 n ALA 241 Cb 0.52 -2.54 0.18 0.00 0.00 0.00 0.00 19.45 17.62 3hi8 n ALA 241 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3hi8 n PRO 242 N 5.37 -3.39 -3.64 0.00 -0.02 -1.26 -4.12 135.00 127.93 3hi8 n PRO 242 Ca 0.18 -0.88 -0.14 0.00 -2.02 0.00 0.00 63.50 60.65 3hi8 n PRO 242 Cb 0.35 -1.21 -0.06 0.00 -0.02 0.00 0.00 33.50 32.55 3hi8 n PRO 242 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3hi8 s ARG 243 N -4.09 0.92 0.25 -0.52 1.81 -1.23 -4.84 118.95 111.25 3hi8 s ARG 243 Ca 0.40 -0.23 -0.31 0.00 -1.72 0.00 0.00 55.73 53.87 3hi8 s ARG 243 Cb -0.07 0.41 -0.11 0.00 -0.45 0.00 0.00 34.95 34.73 3hi8 s ARG 243 CO 0.34 -0.31 1.61 0.42 -0.68 0.00 0.00 175.30 176.69 3hi8 s ILE 244 N -2.12 2.16 -0.35 1.52 -1.09 -1.26 -4.52 121.20 115.54 3hi8 s ILE 244 Ca -0.07 0.13 0.03 0.00 -2.23 0.00 0.00 60.65 58.50 3hi8 s ILE 244 Cb -0.01 -3.08 0.28 0.00 -1.58 0.00 0.00 42.46 38.06 3hi8 s ILE 244 CO 0.00 0.02 1.23 1.67 -1.23 0.00 0.00 174.94 176.63 3hi8 n GLN 245 N 2.87 1.82 -2.88 2.79 7.27 -1.26 -4.92 117.38 123.08 3hi8 n GLN 245 Ca 0.11 -1.17 -0.42 0.00 0.07 0.00 0.00 57.00 55.58 3hi8 n GLN 245 Cb 0.37 -1.57 -0.04 0.00 2.41 0.00 0.00 30.24 31.41 3hi8 n GLN 245 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 3hi8 s SER 246 N -0.02 6.63 0.00 1.69 1.04 -1.26 -5.08 113.70 116.71 3hi8 s SER 246 Ca 0.21 0.51 0.00 0.00 0.48 0.00 0.00 55.95 57.15 3hi8 s SER 246 Cb 0.18 -2.43 0.00 0.00 0.10 0.00 0.00 66.02 63.86 3hi8 s SER 246 CO 0.05 -0.78 0.00 0.47 0.98 0.00 0.00 173.24 173.96