#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x6m s HIS 2 N 0.00 -0.00 -0.19 1.61 5.65 -1.26 -5.13 115.29 115.97 1x6m s HIS 2 Ca 0.00 0.01 0.05 0.00 0.25 0.00 0.00 55.06 55.37 1x6m s HIS 2 Cb 0.00 0.50 -0.15 0.00 -1.18 0.00 0.00 32.58 31.75 1x6m s HIS 2 CO 0.00 -0.00 -0.11 -1.33 -0.65 0.00 0.00 174.74 172.65 1x6m n MET 3 N 1.18 0.78 -5.04 2.88 2.00 -1.26 -4.97 117.12 112.69 1x6m n MET 3 Ca -0.06 0.08 -0.32 0.00 0.00 0.00 0.00 57.70 57.39 1x6m n MET 3 Cb 0.58 -1.40 -0.15 0.00 0.00 0.00 0.00 33.22 32.25 1x6m n MET 3 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 1x6m s VAL 4 N -2.40 2.63 -0.14 2.03 1.01 -1.26 -5.10 120.40 117.17 1x6m s VAL 4 Ca -0.21 -0.87 -0.29 0.00 0.00 0.00 0.00 61.98 60.60 1x6m s VAL 4 Cb 0.06 -2.01 -0.01 0.00 0.00 0.00 0.00 36.38 34.43 1x6m s VAL 4 CO 0.52 0.58 1.02 -0.62 0.00 0.00 0.00 175.10 176.60 1x6m s ASP 5 N -0.44 7.20 0.00 3.32 2.15 -1.26 -4.90 116.67 122.73 1x6m s ASP 5 Ca 0.05 1.49 0.00 0.00 0.43 0.00 0.00 52.55 54.52 1x6m s ASP 5 Cb -0.12 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 39.95 1x6m s ASP 5 CO 0.02 -0.52 0.62 0.41 -0.17 0.00 0.00 175.17 175.53 1x6m n THR 6 N 4.80 0.28 -2.31 1.71 -1.04 -1.26 -4.75 114.28 111.70 1x6m n THR 6 Ca 0.10 -0.62 -0.38 0.00 -2.04 0.00 0.00 64.05 61.11 1x6m n THR 6 Cb 0.48 0.89 -0.02 0.00 -1.82 0.00 0.00 70.33 69.85 1x6m n THR 6 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1x6m s SER 7 N -0.28 6.59 0.00 8.00 1.04 -1.26 -2.64 113.70 125.15 1x6m s SER 7 Ca 0.00 2.33 0.00 0.00 0.48 0.00 0.00 55.95 58.76 1x6m s SER 7 Cb 0.00 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.51 1x6m s SER 7 CO 0.00 -0.63 0.00 0.61 0.98 0.00 0.00 173.24 174.20 1x6m n GLY 8 N 0.65 2.99 3.63 7.32 0.00 -1.26 -5.01 105.19 113.51 1x6m n GLY 8 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 1x6m n GLY 8 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x6m s VAL 9 N -2.30 3.88 -0.16 1.61 1.01 -1.08 -5.01 120.40 118.34 1x6m s VAL 9 Ca 0.00 0.99 -0.05 0.00 0.00 0.00 0.00 61.98 62.92 1x6m s VAL 9 Cb 0.00 -3.88 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 1x6m s VAL 9 CO 0.00 -0.35 0.01 -0.54 0.00 0.00 0.00 175.10 174.22 1x6m s LYS 10 N 4.44 3.75 -0.02 2.72 -0.14 -1.26 -5.03 119.74 124.19 1x6m s LYS 10 Ca 0.65 -0.43 -0.03 0.00 -1.36 0.00 0.00 55.97 54.80 1x6m s LYS 10 Cb -0.22 -3.04 -0.01 0.00 -1.68 0.00 0.00 37.83 32.89 1x6m s LYS 10 CO 0.26 0.30 -0.06 -0.89 -0.76 0.00 0.00 175.35 174.21 1x6m n ILE 11 N 3.39 0.32 -3.68 2.17 2.08 -1.26 -4.60 119.36 117.77 1x6m n ILE 11 Ca -0.17 0.34 -0.11 0.00 0.56 0.00 0.00 62.75 63.37 1x6m n ILE 11 Cb 0.52 -1.55 -0.09 0.00 -0.75 0.00 0.00 39.64 37.77 1x6m n ILE 11 CO 0.00 0.00 0.00 -2.28 0.56 0.00 0.00 176.55 174.83 1x6m s HIS 12 N -1.37 -0.69 0.53 1.39 2.46 -1.26 -1.76 115.29 114.59 1x6m s HIS 12 Ca -0.05 1.54 0.39 0.00 0.47 0.00 0.00 55.06 57.40 1x6m s HIS 12 Cb 0.01 0.31 1.57 0.00 -0.13 0.00 0.00 32.58 34.33 1x6m s HIS 12 CO 0.07 -0.35 1.73 -1.00 -2.47 0.00 0.00 174.74 172.72 1x6m h PRO 13 N 6.18 0.03 0.00 2.88 0.13 -1.97 0.12 132.00 139.38 1x6m h PRO 13 Ca -0.31 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1x6m h PRO 13 Cb 1.19 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1x6m h PRO 13 CO 0.20 0.02 0.00 0.00 -0.23 0.00 0.00 178.00 177.99 1x6m n ALA 14 N -2.77 2.15 0.04 -0.56 0.00 -1.26 -3.53 120.51 114.58 1x6m n ALA 14 Ca 0.31 -0.03 0.01 0.00 0.00 0.00 0.00 53.44 53.73 1x6m n ALA 14 Cb 1.44 -1.44 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1x6m n ALA 14 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1x6m n VAL 15 N -2.01 0.00 0.05 0.00 0.24 0.27 -4.41 118.33 112.47 1x6m n VAL 15 Ca 0.05 -0.35 -0.10 0.00 -2.04 0.00 0.00 64.34 61.90 1x6m n VAL 15 Cb 0.36 0.86 0.03 0.00 -1.47 0.00 0.00 33.84 33.61 1x6m n VAL 15 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1x6m h ASP 16 N 0.00 0.48 -1.46 -1.34 3.32 -1.15 -3.34 116.42 112.94 1x6m h ASP 16 Ca 0.00 -0.31 -0.50 0.00 0.02 0.00 0.00 57.03 56.24 1x6m h ASP 16 Cb 0.04 -0.14 -0.41 0.00 0.22 0.00 0.00 39.33 39.03 1x6m h ASP 16 CO 0.00 1.05 -0.93 0.59 -1.72 0.00 0.00 179.24 178.23 1x6m n ASN 17 N -3.84 3.18 0.00 6.45 4.13 -1.26 -5.03 115.26 118.89 1x6m n ASN 17 Ca -0.04 -3.29 0.00 0.00 1.68 0.00 0.00 54.58 52.92 1x6m n ASN 17 Cb 0.70 -0.51 0.00 0.00 -1.54 0.00 0.00 39.78 38.44 1x6m n ASN 17 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1x6m n GLY 18 N -0.24 2.58 3.31 7.41 0.00 -1.25 -5.02 105.19 111.98 1x6m n GLY 18 Ca 0.26 -1.51 -0.38 0.00 0.00 0.00 0.00 46.02 44.40 1x6m n GLY 18 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x6m s ILE 19 N -0.76 3.89 0.20 -0.61 1.01 -1.26 -4.20 121.20 119.47 1x6m s ILE 19 Ca 0.00 -0.92 -0.31 0.00 0.00 0.00 0.00 60.65 59.42 1x6m s ILE 19 Cb 0.00 -3.11 -0.11 0.00 0.01 0.00 0.00 42.46 39.26 1x6m s ILE 19 CO 0.00 -0.06 1.60 -0.54 0.00 0.00 0.00 174.94 175.94 1x6m s LYS 20 N 1.45 4.18 0.66 2.79 1.02 -1.26 -5.01 119.74 123.57 1x6m s LYS 20 Ca 0.00 2.45 -0.09 0.00 0.02 0.00 0.00 55.97 58.35 1x6m s LYS 20 Cb -0.18 -3.11 0.01 0.00 -0.52 0.00 0.00 37.83 34.02 1x6m s LYS 20 CO 0.03 -0.63 1.02 -1.25 -0.92 0.00 0.00 175.35 173.59 1x6m s PRO 21 N 0.80 2.94 0.76 -1.68 0.04 -1.26 -4.59 135.00 132.00 1x6m s PRO 21 Ca 0.69 0.31 -0.15 0.00 0.04 0.00 0.00 61.00 61.89 1x6m s PRO 21 Cb -0.46 -2.12 0.01 0.00 0.04 0.00 0.00 34.50 31.97 1x6m s PRO 21 CO 0.35 -0.87 0.84 0.00 0.04 0.00 0.00 177.00 177.35 1x6m n ALA 22 N -2.83 -0.75 -2.66 8.56 0.00 -1.19 -3.95 120.51 117.69 1x6m n ALA 22 Ca 0.06 -0.26 -0.20 0.00 0.00 0.00 0.00 53.44 53.04 1x6m n ALA 22 Cb 0.57 -2.04 -0.13 0.00 0.00 0.00 0.00 19.45 17.86 1x6m n ALA 22 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1x6m s GLN 23 N -3.34 0.92 0.45 0.00 -1.52 -1.03 -4.88 119.66 110.27 1x6m s GLN 23 Ca 0.70 -0.92 -0.23 0.00 -1.95 0.00 0.00 55.36 52.96 1x6m s GLN 23 Cb -0.33 -0.97 -0.08 0.00 -0.22 0.00 0.00 33.01 31.42 1x6m s GLN 23 CO 0.54 0.23 1.10 -1.25 -0.25 0.00 0.00 175.29 175.65 1x6m s PRO 24 N -1.56 3.88 -1.09 2.91 0.04 -1.26 -2.45 135.00 135.48 1x6m s PRO 24 Ca 0.01 1.60 0.00 0.00 0.04 0.00 0.00 61.00 62.64 1x6m s PRO 24 Cb -0.09 -2.37 0.00 0.00 0.04 0.00 0.00 34.50 32.07 1x6m s PRO 24 CO 0.02 -0.40 0.00 0.41 0.04 0.00 0.00 177.00 177.07 1x6m n GLY 25 N 0.27 -0.38 3.68 0.56 0.00 -1.26 -4.92 105.19 103.14 1x6m n GLY 25 Ca 0.07 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.64 1x6m n GLY 25 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1x6m n PHE 26 N -3.29 2.32 0.01 1.61 -0.00 -1.02 -4.89 117.46 112.20 1x6m n PHE 26 Ca -0.15 0.28 0.01 0.00 -0.00 0.00 0.00 57.45 57.60 1x6m n PHE 26 Cb 0.60 -2.54 0.02 0.00 -0.00 0.00 0.00 39.48 37.56 1x6m n PHE 26 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1x6m n ALA 27 N 3.09 2.20 0.00 3.13 0.00 -1.26 -4.23 120.51 123.45 1x6m n ALA 27 Ca 0.15 -0.84 0.00 0.00 0.00 0.00 0.00 53.44 52.75 1x6m n ALA 27 Cb 0.30 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.67 1x6m n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x6m n GLY 28 N -0.14 0.11 0.00 0.00 0.00 -1.25 -2.72 105.19 101.19 1x6m n GLY 28 Ca 0.02 -2.27 0.00 0.00 0.00 0.00 0.00 46.02 43.77 1x6m n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x6m n GLY 29 N 0.00 -0.73 3.02 -0.02 0.00 0.16 -4.95 105.19 102.67 1x6m n GLY 29 Ca 0.00 -0.40 -0.23 0.00 0.00 0.00 0.00 46.02 45.39 1x6m n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x6m s THR 30 N -3.83 1.02 -0.14 2.61 2.01 -1.26 0.10 115.64 116.14 1x6m s THR 30 Ca 0.00 -0.44 -0.11 0.00 0.31 0.00 0.00 61.69 61.45 1x6m s THR 30 Cb 0.00 -0.92 -0.05 0.00 0.01 0.00 0.00 72.50 71.54 1x6m s THR 30 CO 0.00 0.32 0.21 -0.76 -0.69 0.00 0.00 174.62 173.71 1x6m s LEU 31 N 0.49 4.30 0.04 4.42 1.02 0.21 -4.15 118.68 125.01 1x6m s LEU 31 Ca -0.10 0.47 0.09 0.00 0.02 0.00 0.00 54.13 54.61 1x6m s LEU 31 Cb -0.13 -2.23 -0.03 0.00 0.02 0.00 0.00 46.19 43.82 1x6m s LEU 31 CO 0.02 0.24 -0.25 -1.00 0.02 0.00 0.00 176.35 175.38 1x6m s HIS 32 N -0.18 2.19 0.51 0.29 3.76 -0.51 -0.82 115.29 120.53 1x6m s HIS 32 Ca 0.14 -0.40 -0.09 0.00 -0.15 0.00 0.00 55.06 54.56 1x6m s HIS 32 Cb -0.13 -1.32 0.13 0.00 1.11 0.00 0.00 32.58 32.37 1x6m s HIS 32 CO 0.03 0.10 0.51 0.00 -0.85 0.00 0.00 174.74 174.53 1x6m n LYS 34 N -2.79 2.77 -2.01 0.00 5.02 -1.26 -4.86 118.16 115.03 1x6m n LYS 34 Ca 0.07 -2.69 -0.42 0.00 -2.02 0.00 0.00 58.31 53.25 1x6m n LYS 34 Cb 0.26 -1.59 -0.03 0.00 -0.02 0.00 0.00 35.03 33.65 1x6m n LYS 34 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1x6m h SER 36 N 7.45 0.00 -3.77 0.00 4.64 -2.02 -3.37 113.55 116.48 1x6m h SER 36 Ca -0.42 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.71 1x6m h SER 36 Cb 1.20 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 63.02 1x6m h SER 36 CO 0.91 0.11 -0.54 0.42 -0.87 0.00 0.00 176.83 176.86 1x6m s THR 37 N -3.92 -0.00 -1.29 2.95 -4.23 -1.26 -4.87 115.64 103.01 1x6m s THR 37 Ca -0.01 0.01 -0.04 0.00 -1.18 0.00 0.00 61.69 60.46 1x6m s THR 37 Cb 0.11 -0.23 0.01 0.00 1.34 0.00 0.00 72.50 73.73 1x6m s THR 37 CO 0.57 0.00 1.05 0.59 -0.54 0.00 0.00 174.62 176.29 1x6m n ASN 38 N 3.06 -3.84 -4.73 3.99 4.13 -1.26 -4.98 115.26 111.63 1x6m n ASN 38 Ca -0.13 -0.62 -0.36 0.00 1.68 0.00 0.00 54.58 55.15 1x6m n ASN 38 Cb 0.59 -4.93 0.07 0.00 -1.54 0.00 0.00 39.78 33.97 1x6m n ASN 38 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1x6m s PRO 39 N -5.86 2.46 0.22 3.52 0.04 -1.26 -4.85 135.00 129.26 1x6m s PRO 39 Ca 0.27 1.96 -0.32 0.00 0.04 0.00 0.00 61.00 62.95 1x6m s PRO 39 Cb -0.12 -1.85 -0.13 0.00 0.04 0.00 0.00 34.50 32.44 1x6m s PRO 39 CO 0.74 -1.64 1.57 0.28 0.04 0.00 0.00 177.00 177.99 1x6m n VAL 40 N -2.12 0.43 -5.14 -0.36 0.31 -1.26 -4.52 118.33 105.68 1x6m n VAL 40 Ca 0.15 -0.11 -0.31 0.00 -0.01 0.00 0.00 64.34 64.06 1x6m n VAL 40 Cb 0.49 -1.69 -0.17 0.00 -0.91 0.00 0.00 33.84 31.56 1x6m n VAL 40 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1x6m s ARG 41 N 0.36 2.83 -0.09 5.55 0.52 -1.01 -1.27 118.95 125.85 1x6m s ARG 41 Ca 0.73 -0.82 0.04 0.00 -0.52 0.00 0.00 55.73 55.15 1x6m s ARG 41 Cb -0.60 -2.17 0.00 0.00 0.52 0.00 0.00 34.95 32.70 1x6m s ARG 41 CO 0.42 0.17 -0.21 0.14 0.02 0.00 0.00 175.30 175.84 1x6m s VAL 42 N 0.35 1.78 0.09 3.52 -7.23 -0.00 -0.01 120.40 118.90 1x6m s VAL 42 Ca -0.17 -0.86 -0.28 0.00 -1.81 0.00 0.00 61.98 58.85 1x6m s VAL 42 Cb -0.17 -1.55 -0.06 0.00 0.56 0.00 0.00 36.38 35.15 1x6m s VAL 42 CO 0.08 0.50 0.90 0.00 -0.31 0.00 0.00 175.10 176.27 1x6m s ALA 43 N 0.41 3.28 -0.31 1.32 0.00 0.16 0.66 121.76 127.28 1x6m s ALA 43 Ca -0.17 0.49 0.03 0.00 0.00 0.00 0.00 51.96 52.31 1x6m s ALA 43 Cb -0.17 -3.19 0.08 0.00 0.00 0.00 0.00 23.12 19.84 1x6m s ALA 43 CO 0.07 -0.00 -0.01 0.08 0.00 0.00 0.00 175.76 175.90 1x6m s VAL 44 N -0.01 2.20 -0.51 0.00 1.01 0.28 -1.59 120.40 121.78 1x6m s VAL 44 Ca 0.44 -2.04 0.01 0.00 0.00 0.00 0.00 61.98 60.40 1x6m s VAL 44 Cb -0.22 -2.50 0.54 0.00 0.00 0.00 0.00 36.38 34.20 1x6m s VAL 44 CO 0.28 -0.37 1.94 0.54 0.00 0.00 0.00 175.10 177.49 1x6m n ARG 45 N 4.34 2.36 -3.92 2.72 1.74 0.12 0.36 116.66 124.38 1x6m n ARG 45 Ca -0.03 -2.96 -0.09 0.00 -0.77 0.00 0.00 57.85 54.00 1x6m n ARG 45 Cb 0.42 -2.16 -0.04 0.00 -1.02 0.00 0.00 32.46 29.66 1x6m n ARG 45 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1x6m s ALA 46 N -3.33 -0.58 0.28 7.54 0.00 -1.10 -4.76 121.76 119.81 1x6m s ALA 46 Ca 0.57 -0.63 -0.27 0.00 0.00 0.00 0.00 51.96 51.62 1x6m s ALA 46 Cb 0.47 0.97 -0.09 0.00 0.00 0.00 0.00 23.12 24.46 1x6m s ALA 46 CO 0.05 -0.88 0.93 -1.14 0.00 0.00 0.00 175.76 174.72 1x6m s GLN 47 N -3.97 4.68 0.87 0.00 2.00 -1.26 -3.78 119.66 118.20 1x6m s GLN 47 Ca 0.17 1.37 -0.13 0.00 -2.00 0.00 0.00 55.36 54.77 1x6m s GLN 47 Cb -0.02 -3.01 0.13 0.00 0.80 0.00 0.00 33.01 30.91 1x6m s GLN 47 CO 0.06 0.39 1.23 0.95 -0.50 0.00 0.00 175.29 177.42 1x6m s THR 48 N -1.42 2.01 0.11 -0.34 -4.23 -1.26 -4.92 115.64 105.60 1x6m s THR 48 Ca 0.46 -0.02 0.01 0.00 -1.18 0.00 0.00 61.69 60.96 1x6m s THR 48 Cb -0.22 -2.99 -0.04 0.00 1.34 0.00 0.00 72.50 70.59 1x6m s THR 48 CO 0.27 0.00 -0.03 0.00 -0.54 0.00 0.00 174.62 174.32 1x6m s ALA 49 N -3.69 0.96 -1.38 3.99 0.00 -0.02 -4.61 121.76 117.01 1x6m s ALA 49 Ca 0.67 -1.40 -0.06 0.00 0.00 0.00 0.00 51.96 51.17 1x6m s ALA 49 Cb -0.08 0.37 0.03 0.00 0.00 0.00 0.00 23.12 23.44 1x6m s ALA 49 CO 0.50 -0.32 0.90 0.72 0.00 0.00 0.00 175.76 177.57 1x6m n HIS 50 N -0.07 -2.21 -2.52 0.00 8.25 -1.26 -1.66 115.22 115.75 1x6m n HIS 50 Ca -0.10 0.90 -0.40 0.00 -0.26 0.00 0.00 57.72 57.86 1x6m n HIS 50 Cb 0.62 -4.44 -0.05 0.00 1.12 0.00 0.00 29.99 27.24 1x6m n HIS 50 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1x6m s ASN 51 N -3.87 7.31 0.17 0.41 2.47 -1.26 -4.40 114.94 115.76 1x6m s ASN 51 Ca 0.30 2.22 -0.19 0.00 0.42 0.00 0.00 52.86 55.60 1x6m s ASN 51 Cb -0.15 -2.62 0.04 0.00 -1.45 0.00 0.00 41.25 37.08 1x6m s ASN 51 CO 0.80 -0.11 0.53 -1.38 -3.72 0.00 0.00 177.10 173.22 1x6m s HIS 52 N -1.18 -0.30 0.18 0.43 -3.43 -0.95 -0.22 115.29 109.82 1x6m s HIS 52 Ca 0.44 0.00 -0.03 0.00 -0.80 0.00 0.00 55.06 54.68 1x6m s HIS 52 Cb -0.31 0.44 -0.05 0.00 -1.43 0.00 0.00 32.58 31.23 1x6m s HIS 52 CO 0.39 -0.86 0.40 0.14 -2.00 0.00 0.00 174.74 172.81 1x6m s VAL 53 N -3.81 5.17 -0.05 -5.38 -7.23 -0.56 -1.66 120.40 106.87 1x6m s VAL 53 Ca 0.05 -0.15 -0.02 0.00 -1.81 0.00 0.00 61.98 60.04 1x6m s VAL 53 Cb -0.01 -3.68 0.03 0.00 0.56 0.00 0.00 36.38 33.28 1x6m s VAL 53 CO -0.08 -0.09 0.12 0.00 -0.31 0.00 0.00 175.10 174.74 1x6m n GLY 55 N 4.05 -0.51 3.52 0.00 0.00 0.41 -1.21 105.19 111.46 1x6m n GLY 55 Ca -0.25 -0.46 -0.31 0.00 0.00 0.00 0.00 46.02 45.00 1x6m n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x6m h THR 57 N -1.91 0.00 0.00 0.00 1.35 -1.94 -3.33 112.91 107.08 1x6m h THR 57 Ca -0.47 -0.67 -0.03 0.00 -0.55 0.00 0.00 66.41 64.70 1x6m h THR 57 Cb 1.29 1.36 -0.00 0.00 -1.73 0.00 0.00 68.15 69.06 1x6m h THR 57 CO 0.40 0.00 -0.62 0.11 -0.25 0.00 0.00 175.52 175.16 1x6m h LYS 58 N 0.00 0.00 -6.76 4.72 1.79 -1.99 -3.48 116.57 110.85 1x6m h LYS 58 Ca 0.00 0.00 -0.49 0.00 -2.18 0.00 0.00 60.65 57.98 1x6m h LYS 58 Cb 0.83 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.46 1x6m h LYS 58 CO 0.00 0.08 0.21 0.00 -1.08 0.00 0.00 179.45 178.66 1x6m s TRP 60 N -1.71 3.35 -0.01 0.00 -0.00 -1.26 -4.85 118.94 114.45 1x6m s TRP 60 Ca 0.50 1.60 0.01 0.00 -0.00 0.00 0.00 56.10 58.20 1x6m s TRP 60 Cb -0.15 -3.41 0.01 0.00 -0.00 0.00 0.00 33.47 29.92 1x6m s TRP 60 CO 0.20 -1.04 -0.01 0.15 -0.00 0.00 0.00 176.95 176.25 1x6m s LYS 61 N -1.69 0.25 0.65 5.86 1.02 -1.26 -4.45 119.74 120.12 1x6m s LYS 61 Ca 0.48 -0.01 -0.17 0.00 0.02 0.00 0.00 55.97 56.28 1x6m s LYS 61 Cb -0.34 -0.33 -0.00 0.00 -0.52 0.00 0.00 37.83 36.63 1x6m s LYS 61 CO 0.44 -0.03 1.21 -1.25 -0.92 0.00 0.00 175.35 174.79 1x6m s PRO 62 N 0.45 2.62 -0.06 -1.68 0.04 -1.26 -4.86 135.00 130.25 1x6m s PRO 62 Ca -0.04 1.79 -0.39 0.00 0.04 0.00 0.00 61.00 62.40 1x6m s PRO 62 Cb -0.07 -1.89 -0.17 0.00 0.04 0.00 0.00 34.50 32.41 1x6m s PRO 62 CO -0.01 -1.47 1.40 0.39 0.04 0.00 0.00 177.00 177.35 1x6m n GLU 63 N -2.09 0.84 0.00 4.56 -0.58 -1.26 -0.96 120.64 121.15 1x6m n GLU 63 Ca 0.13 0.31 0.00 0.00 -0.42 0.00 0.00 57.16 57.18 1x6m n GLU 63 Cb 0.50 -1.92 0.00 0.00 -0.57 0.00 0.00 31.44 29.45 1x6m n GLU 63 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1x6m n GLY 64 N 2.83 3.11 3.77 0.62 0.00 -1.26 -5.05 105.19 109.21 1x6m n GLY 64 Ca 0.22 -0.81 -0.39 0.00 0.00 0.00 0.00 46.02 45.04 1x6m n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x6m s ALA 65 N -1.16 3.27 -0.14 4.61 0.00 -0.14 -4.96 121.76 123.25 1x6m s ALA 65 Ca 0.00 1.13 0.21 0.00 0.00 0.00 0.00 51.96 53.29 1x6m s ALA 65 Cb 0.00 -3.44 -0.16 0.00 0.00 0.00 0.00 23.12 19.52 1x6m s ALA 65 CO 0.00 -0.66 0.72 -0.89 0.00 0.00 0.00 175.76 174.93 1x6m n ILE 66 N 0.28 0.64 -4.37 0.00 5.41 -1.07 -4.84 119.36 115.41 1x6m n ILE 66 Ca 0.03 -0.60 -0.25 0.00 1.00 0.00 0.00 62.75 62.93 1x6m n ILE 66 Cb 0.44 -0.34 -0.10 0.00 -0.71 0.00 0.00 39.64 38.93 1x6m n ILE 66 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1x6m s PHE 67 N -3.22 2.47 0.32 1.39 0.40 -0.72 -4.78 117.98 113.83 1x6m s PHE 67 Ca -0.04 -0.29 0.04 0.00 -0.60 0.00 0.00 56.93 56.04 1x6m s PHE 67 Cb 0.10 -1.15 -0.02 0.00 0.51 0.00 0.00 43.02 42.46 1x6m s PHE 67 CO 0.84 0.59 0.47 -1.54 0.70 0.00 0.00 175.22 176.27 1x6m s SER 68 N -3.14 6.13 -0.17 1.36 1.04 -0.35 -4.69 113.70 113.88 1x6m s SER 68 Ca 0.26 0.07 -0.00 0.00 0.48 0.00 0.00 55.95 56.76 1x6m s SER 68 Cb -0.07 -1.62 0.00 0.00 0.10 0.00 0.00 66.02 64.43 1x6m s SER 68 CO 0.15 -0.32 -0.14 -1.58 0.98 0.00 0.00 173.24 172.32 1x6m s GLN 69 N -4.18 3.19 -0.02 4.02 0.74 -1.26 -1.19 119.66 120.95 1x6m s GLN 69 Ca 0.41 -0.75 -0.02 0.00 0.05 0.00 0.00 55.36 55.05 1x6m s GLN 69 Cb -0.09 -2.68 0.00 0.00 1.10 0.00 0.00 33.01 31.34 1x6m s GLN 69 CO 0.32 -0.08 0.05 0.54 -0.55 0.00 0.00 175.29 175.57 1x6m s VAL 70 N 1.06 0.00 0.38 1.34 0.11 -0.67 -4.49 120.40 118.13 1x6m s VAL 70 Ca -0.01 -0.01 0.03 0.00 -2.93 0.00 0.00 61.98 59.07 1x6m s VAL 70 Cb -0.15 -0.08 -0.04 0.00 -1.53 0.00 0.00 36.38 34.58 1x6m s VAL 70 CO -0.04 -0.00 0.10 0.00 -3.33 0.00 0.00 175.10 171.82 1x6m s ALA 71 N 0.01 2.71 -0.02 1.54 0.00 -0.28 -2.24 121.76 123.47 1x6m s ALA 71 Ca -0.00 -1.52 0.04 0.00 0.00 0.00 0.00 51.96 50.48 1x6m s ALA 71 Cb -0.00 0.71 -0.01 0.00 0.00 0.00 0.00 23.12 23.82 1x6m s ALA 71 CO 0.00 -0.32 -0.15 0.54 0.00 0.00 0.00 175.76 175.83 1x6m s VAL 72 N -3.26 1.19 0.02 0.00 0.11 -0.66 -1.30 120.40 116.50 1x6m s VAL 72 Ca 0.28 -0.61 0.01 0.00 -2.93 0.00 0.00 61.98 58.73 1x6m s VAL 72 Cb 0.05 -1.01 -0.01 0.00 -1.53 0.00 0.00 36.38 33.87 1x6m s VAL 72 CO 0.14 0.34 -0.03 0.54 -3.33 0.00 0.00 175.10 172.76 1x6m s VAL 73 N -0.11 0.19 0.20 2.04 0.11 0.38 -0.84 120.40 122.36 1x6m s VAL 73 Ca 0.01 -0.64 -0.32 0.00 -2.93 0.00 0.00 61.98 58.10 1x6m s VAL 73 Cb -0.08 -0.27 -0.15 0.00 -1.53 0.00 0.00 36.38 34.35 1x6m s VAL 73 CO 0.01 -0.29 1.16 0.61 -3.33 0.00 0.00 175.10 173.26 1x6m n GLY 74 N 2.08 0.07 0.22 6.54 0.00 -1.26 0.75 105.19 113.59 1x6m n GLY 74 Ca -0.20 0.50 0.05 0.00 0.00 0.00 0.00 46.02 46.37 1x6m n GLY 74 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1x6m h ARG 75 N 3.24 0.02 -0.72 1.61 0.11 -1.14 -1.64 114.38 115.87 1x6m h ARG 75 Ca -0.43 -0.01 0.21 0.00 0.10 0.00 0.00 59.98 59.86 1x6m h ARG 75 Cb 1.34 -0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.38 1x6m h ARG 75 CO 0.69 0.22 0.85 0.38 0.10 0.00 0.00 179.97 182.22 1x6m h ASP 76 N 0.02 0.00 -0.43 0.08 3.04 -1.90 -2.33 116.42 114.91 1x6m h ASP 76 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1x6m h ASP 76 Cb 0.37 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.66 1x6m h ASP 76 CO 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 179.24 177.23 1x6m n ALA 77 N -2.27 2.35 -3.28 4.15 0.00 -0.61 -4.95 120.51 115.90 1x6m n ALA 77 Ca 0.15 -1.07 -0.32 0.00 0.00 0.00 0.00 53.44 52.20 1x6m n ALA 77 Cb 1.09 -0.72 -0.17 0.00 0.00 0.00 0.00 19.45 19.65 1x6m n ALA 77 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1x6m s LEU 78 N -1.18 2.15 -0.08 0.00 1.98 -0.88 -0.70 118.68 119.96 1x6m s LEU 78 Ca 0.35 -0.55 -0.03 0.00 -2.89 0.00 0.00 54.13 51.00 1x6m s LEU 78 Cb 0.19 -1.43 0.04 0.00 0.66 0.00 0.00 46.19 45.65 1x6m s LEU 78 CO 0.26 0.15 0.17 -0.70 -1.89 0.00 0.00 176.35 174.34 1x6m s GLU 79 N 0.42 0.10 -0.17 1.98 2.12 -0.62 -5.00 118.70 117.53 1x6m s GLU 79 Ca -0.16 0.45 -0.29 0.00 0.36 0.00 0.00 54.97 55.33 1x6m s GLU 79 Cb -0.17 -0.18 -0.00 0.00 0.26 0.00 0.00 34.13 34.03 1x6m s GLU 79 CO 0.07 -0.19 0.99 0.08 -0.54 0.00 0.00 175.26 175.67 1x6m s VAL 80 N 1.43 4.75 -0.24 3.70 1.01 -1.26 -0.66 120.40 129.12 1x6m s VAL 80 Ca -0.07 1.97 -0.05 0.00 0.00 0.00 0.00 61.98 63.84 1x6m s VAL 80 Cb -0.11 -4.28 -0.17 0.00 0.00 0.00 0.00 36.38 31.81 1x6m s VAL 80 CO -0.07 -0.08 -0.16 0.18 0.00 0.00 0.00 175.10 174.98 1x6m n LEU 81 N 5.65 2.61 -4.07 3.92 4.77 0.98 -4.95 117.00 125.92 1x6m n LEU 81 Ca 0.10 0.06 -0.13 0.00 -0.03 0.00 0.00 56.01 56.00 1x6m n LEU 81 Cb 0.47 -0.92 -0.11 0.00 -2.33 0.00 0.00 43.42 40.53 1x6m n LEU 81 CO 0.51 0.80 -0.41 -1.61 -1.33 0.00 0.00 177.39 175.36 1x6m s GLU 82 N -2.51 0.54 -0.34 3.23 2.02 -1.07 -4.94 118.70 115.63 1x6m s GLU 82 Ca -0.34 -0.77 -0.00 0.00 0.02 0.00 0.00 54.97 53.88 1x6m s GLU 82 Cb 0.10 -0.32 0.00 0.00 0.10 0.00 0.00 34.13 34.01 1x6m s GLU 82 CO 0.59 0.06 0.00 0.41 0.02 0.00 0.00 175.26 176.35 1x6m n GLY 83 N 1.46 0.22 0.33 -1.39 0.00 -1.26 -2.39 105.19 102.15 1x6m n GLY 83 Ca -0.23 -0.72 0.11 0.00 0.00 0.00 0.00 46.02 45.19 1x6m n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x6m h ALA 84 N 0.19 2.04 0.00 4.61 0.00 -1.92 -2.16 119.26 122.02 1x6m h ALA 84 Ca -0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1x6m h ALA 84 Cb 1.07 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1x6m h ALA 84 CO 0.11 -0.13 0.00 1.05 0.00 0.00 0.00 179.25 180.28 1x6m h GLU 85 N 0.28 0.00 -0.00 0.00 9.09 -2.03 -2.72 114.58 119.20 1x6m h GLU 85 Ca 0.20 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.61 1x6m h GLU 85 Cb 0.41 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.51 1x6m h GLU 85 CO -0.04 0.00 -0.31 1.63 0.05 0.00 0.00 179.01 180.34 1x6m n LYS 86 N -2.83 0.37 -3.16 1.06 5.02 -0.81 -4.89 118.16 112.91 1x6m n LYS 86 Ca 0.01 -0.19 -0.35 0.00 -2.02 0.00 0.00 58.31 55.77 1x6m n LYS 86 Cb 0.28 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.74 1x6m n LYS 86 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1x6m s LEU 87 N -2.76 4.25 0.02 -0.35 1.43 -1.03 0.41 118.68 120.65 1x6m s LEU 87 Ca 0.18 1.32 0.01 0.00 -1.03 0.00 0.00 54.13 54.61 1x6m s LEU 87 Cb 0.19 -3.70 -0.02 0.00 0.03 0.00 0.00 46.19 42.69 1x6m s LEU 87 CO 0.59 -0.03 -0.04 -1.83 0.23 0.00 0.00 176.35 175.27 1x6m s GLU 88 N -2.30 0.35 -0.04 1.70 -1.05 -0.68 -4.84 118.70 111.83 1x6m s GLU 88 Ca 0.46 -0.55 -0.30 0.00 -0.15 0.00 0.00 54.97 54.42 1x6m s GLU 88 Cb -0.14 -0.05 -0.03 0.00 -0.44 0.00 0.00 34.13 33.46 1x6m s GLU 88 CO 0.20 -0.00 1.12 0.42 0.95 0.00 0.00 175.26 177.94 1x6m s ILE 89 N -1.18 4.45 0.06 1.83 1.01 -1.26 -1.32 121.20 124.79 1x6m s ILE 89 Ca -0.11 1.76 -0.26 0.00 0.00 0.00 0.00 60.65 62.03 1x6m s ILE 89 Cb -0.08 -4.13 -0.17 0.00 0.01 0.00 0.00 42.46 38.09 1x6m s ILE 89 CO -0.00 0.05 1.58 0.58 0.00 0.00 0.00 174.94 177.14 1x6m h VAL 90 N 4.92 0.84 -2.37 2.92 2.07 -1.37 -3.42 116.25 119.84 1x6m h VAL 90 Ca -0.36 -0.23 -0.32 0.00 0.82 0.00 0.00 66.70 66.61 1x6m h VAL 90 Cb 1.18 0.98 -0.35 0.00 -1.52 0.00 0.00 31.29 31.58 1x6m h VAL 90 CO 0.84 0.05 -0.63 0.21 0.02 0.00 0.00 177.57 178.07 1x6m s ASN 91 N -5.05 1.53 0.00 0.57 3.04 -1.26 -5.01 114.94 108.76 1x6m s ASN 91 Ca -0.15 -0.43 0.21 0.00 0.04 0.00 0.00 52.86 52.53 1x6m s ASN 91 Cb 0.04 0.43 0.95 0.00 -1.54 0.00 0.00 41.25 41.13 1x6m s ASN 91 CO 0.63 -0.35 1.66 0.00 -3.04 0.00 0.00 177.10 176.00 1x6m n ALA 92 N 5.32 2.00 0.97 1.71 0.00 -1.26 -2.51 120.51 126.73 1x6m n ALA 92 Ca -0.04 -0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.43 1x6m n ALA 92 Cb 0.48 -1.34 0.16 0.00 0.00 0.00 0.00 19.45 18.76 1x6m n ALA 92 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1x6m n GLU 93 N -1.41 0.02 -1.76 0.00 4.07 -1.26 -4.95 120.64 115.35 1x6m n GLU 93 Ca 0.07 0.00 -0.34 0.00 -0.06 0.00 0.00 57.16 56.84 1x6m n GLU 93 Cb 0.21 -1.51 0.05 0.00 -0.06 0.00 0.00 31.44 30.13 1x6m n GLU 93 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1x6m s ALA 94 N -3.01 2.42 0.34 4.31 0.00 -1.04 -4.94 121.76 119.82 1x6m s ALA 94 Ca 0.10 0.67 0.02 0.00 0.00 0.00 0.00 51.96 52.75 1x6m s ALA 94 Cb 0.17 -3.36 0.60 0.00 0.00 0.00 0.00 23.12 20.53 1x6m s ALA 94 CO 0.74 -1.34 1.98 -1.35 0.00 0.00 0.00 175.76 175.79 1x6m h PRO 95 N 0.14 0.89 -4.65 0.00 0.11 -1.92 -3.37 132.00 123.19 1x6m h PRO 95 Ca -0.48 -0.05 -0.69 0.00 0.11 0.00 0.00 66.00 64.89 1x6m h PRO 95 Cb 1.26 -0.20 -0.21 0.00 0.11 0.00 0.00 31.00 31.96 1x6m h PRO 95 CO 0.53 0.59 -0.49 0.42 -0.21 0.00 0.00 178.00 178.84 1x6m s ILE 96 N -5.78 4.98 -0.25 4.15 1.01 -1.26 -4.09 121.20 119.96 1x6m s ILE 96 Ca -0.10 -0.50 -0.25 0.00 0.00 0.00 0.00 60.65 59.80 1x6m s ILE 96 Cb 0.18 -3.65 -0.00 0.00 0.01 0.00 0.00 42.46 39.00 1x6m s ILE 96 CO 0.78 -0.11 0.84 -1.10 0.00 0.00 0.00 174.94 175.35 1x6m s GLN 97 N 1.65 4.18 -0.22 2.79 -0.21 0.39 -4.82 119.66 123.42 1x6m s GLN 97 Ca 0.05 0.94 -0.10 0.00 0.02 0.00 0.00 55.36 56.27 1x6m s GLN 97 Cb -0.18 -3.65 -0.05 0.00 1.00 0.00 0.00 33.01 30.13 1x6m s GLN 97 CO 0.09 -0.53 0.13 1.03 -2.12 0.00 0.00 175.29 173.89 1x6m s ARG 98 N 2.86 4.05 -0.28 2.91 0.52 -1.26 -0.48 118.95 127.27 1x6m s ARG 98 Ca 0.35 -0.29 -0.10 0.00 -0.52 0.00 0.00 55.73 55.17 1x6m s ARG 98 Cb -0.15 -3.44 -0.03 0.00 0.52 0.00 0.00 34.95 31.84 1x6m s ARG 98 CO 0.07 0.13 0.16 -1.01 0.02 0.00 0.00 175.30 174.68 1x6m s HIS 99 N 0.82 3.18 -0.01 -0.53 3.76 -0.20 -0.83 115.29 121.48 1x6m s HIS 99 Ca 0.07 -0.16 0.06 0.00 -0.15 0.00 0.00 55.06 54.88 1x6m s HIS 99 Cb -0.13 -2.35 -0.02 0.00 1.11 0.00 0.00 32.58 31.19 1x6m s HIS 99 CO 0.02 -0.28 -0.19 0.50 -0.85 0.00 0.00 174.74 173.95 1x6m s ARG 100 N 1.70 1.49 -0.07 1.40 3.52 -0.44 0.39 118.95 126.95 1x6m s ARG 100 Ca 0.06 -0.68 -0.30 0.00 -0.13 0.00 0.00 55.73 54.69 1x6m s ARG 100 Cb -0.16 -1.45 -0.05 0.00 -1.56 0.00 0.00 34.95 31.73 1x6m s ARG 100 CO 0.08 0.40 1.65 0.00 -0.81 0.00 0.00 175.30 176.62 1x6m h ARG 102 N 9.62 0.00 0.08 0.00 0.11 -0.37 -0.53 114.38 123.29 1x6m h ARG 102 Ca -0.39 0.00 -0.35 0.00 0.10 0.00 0.00 59.98 59.34 1x6m h ARG 102 Cb 1.18 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.23 1x6m h ARG 102 CO 0.96 0.00 -1.97 -0.25 0.10 0.00 0.00 179.97 178.81 1x6m n ASP 103 N -2.90 2.06 -0.01 0.08 8.00 -1.26 -4.61 116.55 117.91 1x6m n ASP 103 Ca -0.02 0.20 0.07 0.00 0.71 0.00 0.00 54.79 55.75 1x6m n ASP 103 Cb 0.25 -0.82 -0.11 0.00 -0.02 0.00 0.00 41.12 40.43 1x6m n ASP 103 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1x6m n GLY 105 N 1.57 0.32 3.73 0.00 0.00 -0.21 -4.96 105.19 105.64 1x6m n GLY 105 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1x6m n GLY 105 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x6m s VAL 106 N -2.00 4.31 -0.18 1.61 1.01 -1.26 -4.66 120.40 119.24 1x6m s VAL 106 Ca 0.00 1.84 -0.27 0.00 0.00 0.00 0.00 61.98 63.55 1x6m s VAL 106 Cb 0.00 -4.17 -0.01 0.00 0.00 0.00 0.00 36.38 32.20 1x6m s VAL 106 CO 0.00 0.24 0.92 -1.00 0.00 0.00 0.00 175.10 175.26 1x6m s HIS 107 N 0.29 3.41 -0.04 5.22 0.09 -1.26 0.44 115.29 123.44 1x6m s HIS 107 Ca 0.50 1.36 0.13 0.00 -0.00 0.00 0.00 55.06 57.06 1x6m s HIS 107 Cb -0.26 -3.12 -0.22 0.00 -0.00 0.00 0.00 32.58 28.99 1x6m s HIS 107 CO 0.31 -0.31 0.72 0.52 -0.00 0.00 0.00 174.74 175.98 1x6m h MET 108 N 7.35 0.00 -2.45 1.40 2.86 -0.41 -3.43 114.93 120.24 1x6m h MET 108 Ca -0.26 0.00 0.09 0.00 -2.06 0.00 0.00 59.70 57.46 1x6m h MET 108 Cb 1.11 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 32.64 1x6m h MET 108 CO 0.88 0.50 0.43 1.52 1.06 0.00 0.00 176.91 181.30 1x6m s TYR 109 N -2.64 -0.36 -0.08 -0.22 -0.85 -1.21 -4.71 117.35 107.28 1x6m s TYR 109 Ca -0.04 0.19 0.04 0.00 -0.52 0.00 0.00 57.07 56.74 1x6m s TYR 109 Cb 0.08 0.56 0.00 0.00 0.38 0.00 0.00 41.96 42.98 1x6m s TYR 109 CO 0.82 -0.65 -0.20 0.20 -1.52 0.00 0.00 175.55 174.20 1x6m s GLY 110 N -2.59 1.15 -0.04 5.49 0.00 0.56 -1.03 107.32 110.86 1x6m s GLY 110 Ca 0.05 -0.80 0.04 0.00 0.00 0.00 0.00 44.72 44.00 1x6m s GLY 110 CO -0.09 -0.25 -0.16 -1.60 0.00 0.00 0.00 173.10 171.01 1x6m s ARG 111 N 0.34 1.60 -0.29 2.90 3.52 0.37 -0.76 118.95 126.62 1x6m s ARG 111 Ca -0.15 -0.55 -0.17 0.00 -0.13 0.00 0.00 55.73 54.73 1x6m s ARG 111 Cb -0.16 -1.41 -0.02 0.00 -1.56 0.00 0.00 34.95 31.80 1x6m s ARG 111 CO 0.06 0.23 0.49 0.42 -0.81 0.00 0.00 175.30 175.69 1x6m s ILE 112 N 0.04 5.07 -0.29 4.11 1.01 -1.26 -0.46 121.20 129.41 1x6m s ILE 112 Ca -0.03 0.65 0.22 0.00 0.00 0.00 0.00 60.65 61.49 1x6m s ILE 112 Cb -0.11 -3.86 -0.15 0.00 0.01 0.00 0.00 42.46 38.36 1x6m s ILE 112 CO 0.02 -0.01 0.85 -0.62 0.00 0.00 0.00 174.94 175.17 1x6m n GLU 113 N 5.58 0.52 -2.36 2.79 -0.58 -1.26 -4.61 120.64 120.73 1x6m n GLU 113 Ca -0.05 -0.02 -0.43 0.00 -0.42 0.00 0.00 57.16 56.24 1x6m n GLU 113 Cb 0.50 -1.65 -0.02 0.00 -0.57 0.00 0.00 31.44 29.69 1x6m n GLU 113 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1x6m s ASN 114 N -4.61 6.58 0.46 1.62 3.04 -1.26 -4.93 114.94 115.83 1x6m s ASN 114 Ca -0.02 1.22 0.31 0.00 0.04 0.00 0.00 52.86 54.41 1x6m s ASN 114 Cb 0.13 -2.54 1.58 0.00 -1.54 0.00 0.00 41.25 38.88 1x6m s ASN 114 CO 0.84 -1.16 1.95 0.03 -3.04 0.00 0.00 177.10 175.72 1x6m h ARG 115 N 9.72 0.00 0.00 0.43 3.08 -2.01 -2.62 114.38 122.99 1x6m h ARG 115 Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.78 1x6m h ARG 115 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.16 1x6m h ARG 115 CO 1.04 0.00 -0.73 -0.25 -1.07 0.00 0.00 179.97 178.95 1x6m n ASP 116 N -2.64 0.71 -4.77 7.04 8.00 -1.26 -4.89 116.55 118.73 1x6m n ASP 116 Ca -0.01 -0.55 -0.40 0.00 0.71 0.00 0.00 54.79 54.54 1x6m n ASP 116 Cb 0.12 0.58 -0.01 0.00 -0.02 0.00 0.00 41.12 41.79 1x6m n ASP 116 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 1x6m s HIS 117 N -3.01 2.92 0.52 1.24 2.46 -0.99 -4.92 115.29 113.51 1x6m s HIS 117 Ca 0.09 1.38 0.27 0.00 0.47 0.00 0.00 55.06 57.27 1x6m s HIS 117 Cb 0.17 -3.73 1.39 0.00 -0.13 0.00 0.00 32.58 30.28 1x6m s HIS 117 CO 0.77 -2.08 1.93 -1.35 -2.47 0.00 0.00 174.74 171.55 1x6m h PRO 118 N 3.12 0.05 -0.53 2.88 0.11 -1.93 -1.95 132.00 133.76 1x6m h PRO 118 Ca -0.49 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1x6m h PRO 118 Cb 1.23 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1x6m h PRO 118 CO 0.64 0.04 0.00 1.19 -0.21 0.00 0.00 178.00 179.66 1x6m n PHE 119 N -4.35 0.85 -1.67 0.65 3.72 -1.26 -5.02 117.46 110.39 1x6m n PHE 119 Ca 0.15 -0.54 -0.45 0.00 -0.05 0.00 0.00 57.45 56.55 1x6m n PHE 119 Cb 0.76 -0.07 -0.03 0.00 -0.94 0.00 0.00 39.48 39.20 1x6m n PHE 119 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 1x6m n TYR 120 N 0.97 2.16 -0.15 1.38 4.19 -0.73 -2.14 117.16 122.83 1x6m n TYR 120 Ca 0.19 0.40 0.00 0.00 3.31 0.00 0.00 57.90 61.81 1x6m n TYR 120 Cb 0.61 -2.47 0.00 0.00 0.49 0.00 0.00 39.34 37.96 1x6m n TYR 120 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1x6m n GLY 121 N 2.47 0.59 3.24 2.98 0.00 -1.26 -5.05 105.19 108.15 1x6m n GLY 121 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 1x6m n GLY 121 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x6m s LEU 122 N 0.00 2.48 0.30 0.99 2.01 -0.91 -0.55 118.68 123.01 1x6m s LEU 122 Ca 0.00 -0.50 -0.07 0.00 0.01 0.00 0.00 54.13 53.57 1x6m s LEU 122 Cb 0.00 -1.58 -0.06 0.00 0.01 0.00 0.00 46.19 44.56 1x6m s LEU 122 CO 0.00 0.04 0.60 -1.81 1.01 0.00 0.00 176.35 176.18 1x6m s ASP 123 N 1.10 6.50 -0.15 2.29 1.01 0.23 -4.32 116.67 123.33 1x6m s ASP 123 Ca 0.00 0.85 -0.07 0.00 0.71 0.00 0.00 52.55 54.04 1x6m s ASP 123 Cb -0.14 -2.20 -0.04 0.00 1.01 0.00 0.00 42.92 41.55 1x6m s ASP 123 CO -0.04 -0.21 0.07 -0.36 0.21 0.00 0.00 175.17 174.84 1x6m s PHE 124 N -2.09 3.32 -0.04 4.23 0.40 0.06 -0.47 117.98 123.40 1x6m s PHE 124 Ca 0.46 0.22 -0.04 0.00 -0.60 0.00 0.00 56.93 56.97 1x6m s PHE 124 Cb -0.11 -2.00 0.01 0.00 0.51 0.00 0.00 43.02 41.43 1x6m s PHE 124 CO 0.28 0.35 0.11 0.14 0.70 0.00 0.00 175.22 176.81 1x6m s VAL 125 N -0.17 0.01 -0.83 -0.44 -7.23 -0.42 -0.32 120.40 110.99 1x6m s VAL 125 Ca 0.08 -0.06 -0.17 0.00 -1.81 0.00 0.00 61.98 60.03 1x6m s VAL 125 Cb -0.12 -0.18 0.16 0.00 0.56 0.00 0.00 36.38 36.81 1x6m s VAL 125 CO 0.01 -0.03 0.91 -1.00 -0.31 0.00 0.00 175.10 174.68 1x6m s HIS 126 N -0.05 3.37 -1.15 2.82 3.76 -1.26 -1.13 115.29 121.65 1x6m s HIS 126 Ca -0.01 -1.58 0.09 0.00 -0.15 0.00 0.00 55.06 53.41 1x6m s HIS 126 Cb -0.01 -4.05 0.42 0.00 1.11 0.00 0.00 32.58 30.04 1x6m s HIS 126 CO 0.00 -1.25 1.25 0.25 -0.85 0.00 0.00 174.74 174.14 1x6m n THR 127 N 4.87 1.17 0.30 1.30 -2.24 -1.26 -0.93 114.28 117.49 1x6m n THR 127 Ca 0.14 0.29 0.15 0.00 -2.27 0.00 0.00 64.05 62.37 1x6m n THR 127 Cb 0.47 -1.14 0.70 0.00 -2.10 0.00 0.00 70.33 68.26 1x6m n THR 127 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1x6m h GLU 128 N 0.00 0.00 0.00 -0.78 4.11 -1.91 -1.43 114.58 114.57 1x6m h GLU 128 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1x6m h GLU 128 Cb 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1x6m h GLU 128 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 179.01 180.36 1x6m n LEU 129 N -2.60 0.00 -4.84 3.06 4.77 -0.11 -4.74 117.00 112.54 1x6m n LEU 129 Ca -0.00 0.05 -0.37 0.00 -0.03 0.00 0.00 56.01 55.66 1x6m n LEU 129 Cb 0.17 -0.05 -0.06 0.00 -2.33 0.00 0.00 43.42 41.15 1x6m n LEU 129 CO 0.19 -0.00 -0.05 -0.55 -1.33 0.00 0.00 177.39 175.64 1x6m s SER 130 N -2.10 6.54 0.00 -1.43 0.15 -0.54 -1.43 113.70 114.90 1x6m s SER 130 Ca 0.40 0.65 0.28 0.00 0.70 0.00 0.00 55.95 57.98 1x6m s SER 130 Cb 0.20 -2.15 1.02 0.00 -1.71 0.00 0.00 66.02 63.38 1x6m s SER 130 CO 0.35 0.34 1.74 0.47 1.20 0.00 0.00 173.24 177.33 1x6m n ASP 131 N 2.15 0.57 -4.80 5.45 8.00 -1.26 -4.84 116.55 121.82 1x6m n ASP 131 Ca -0.17 -0.52 -0.37 0.00 0.71 0.00 0.00 54.79 54.44 1x6m n ASP 131 Cb 0.54 -0.02 -0.06 0.00 -0.02 0.00 0.00 41.12 41.56 1x6m n ASP 131 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1x6m s GLU 132 N -2.59 4.38 0.23 -1.24 8.01 -1.26 -5.11 118.70 121.13 1x6m s GLU 132 Ca 0.24 1.02 0.02 0.00 0.01 0.00 0.00 54.97 56.27 1x6m s GLU 132 Cb 0.19 -2.94 -0.04 0.00 -4.31 0.00 0.00 34.13 27.04 1x6m s GLU 132 CO 0.52 0.41 0.39 -0.51 0.01 0.00 0.00 175.26 176.08 1x6m s ASP 133 N -1.54 6.34 0.00 -0.19 1.01 -1.26 -4.70 116.67 116.32 1x6m s ASP 133 Ca 0.43 0.26 0.00 0.00 0.71 0.00 0.00 52.55 53.95 1x6m s ASP 133 Cb -0.18 -1.95 0.00 0.00 1.01 0.00 0.00 42.92 41.80 1x6m s ASP 133 CO 0.23 -0.08 0.00 0.61 0.21 0.00 0.00 175.17 176.13 1x6m n GLY 134 N -1.10 0.99 3.74 0.21 0.00 -1.25 -4.90 105.19 102.89 1x6m n GLY 134 Ca -0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 1x6m n GLY 134 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1x6m s TRP 135 N -1.51 2.29 0.18 1.61 0.52 -1.26 -2.45 118.94 118.32 1x6m s TRP 135 Ca 0.00 1.54 -0.33 0.00 0.02 0.00 0.00 56.10 57.33 1x6m s TRP 135 Cb 0.00 -3.46 -0.15 0.00 -1.15 0.00 0.00 33.47 28.71 1x6m s TRP 135 CO 0.00 -2.32 1.31 0.43 0.02 0.00 0.00 176.95 176.38 1x6m n SER 136 N -2.02 2.02 -4.81 2.95 7.64 -1.26 -3.17 113.62 114.97 1x6m n SER 136 Ca 0.13 1.13 -0.33 0.00 1.01 0.00 0.00 58.87 60.81 1x6m n SER 136 Cb 0.50 -1.30 -0.05 0.00 -1.01 0.00 0.00 64.21 62.34 1x6m n SER 136 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x6m s ALA 137 N 0.05 2.98 0.54 -0.43 0.00 -1.26 -4.78 121.76 118.85 1x6m s ALA 137 Ca 0.73 0.46 -0.22 0.00 0.00 0.00 0.00 51.96 52.93 1x6m s ALA 137 Cb -0.78 -3.18 -0.05 0.00 0.00 0.00 0.00 23.12 19.10 1x6m s ALA 137 CO 0.49 -0.07 1.37 -1.25 0.00 0.00 0.00 175.76 176.31 1x6m s PRO 138 N -3.28 3.20 -0.02 0.00 0.04 -1.26 -4.42 135.00 129.26 1x6m s PRO 138 Ca 0.64 2.27 0.03 0.00 0.04 0.00 0.00 61.00 63.98 1x6m s PRO 138 Cb -0.12 -2.31 -0.05 0.00 0.04 0.00 0.00 34.50 32.07 1x6m s PRO 138 CO 0.17 -1.16 0.05 0.39 0.04 0.00 0.00 177.00 176.49 1x6m n GLU 139 N -0.93 1.57 -2.52 4.56 1.02 0.70 -4.87 120.64 120.17 1x6m n GLU 139 Ca 0.10 -0.02 -0.04 0.00 -0.02 0.00 0.00 57.16 57.17 1x6m n GLU 139 Cb 0.44 -1.09 0.02 0.00 -0.02 0.00 0.00 31.44 30.79 1x6m n GLU 139 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 1x6m n PHE 140 N -1.84 -1.66 -5.09 -0.32 1.16 -1.26 -4.35 117.46 104.09 1x6m n PHE 140 Ca -0.03 -0.97 -0.30 0.00 -1.87 0.00 0.00 57.45 54.28 1x6m n PHE 140 Cb 0.32 0.48 -0.17 0.00 -1.61 0.00 0.00 39.48 38.50 1x6m n PHE 140 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1x6m s ALA 141 N -1.58 1.98 0.22 1.98 0.00 -0.45 -1.50 121.76 122.41 1x6m s ALA 141 Ca 0.09 -0.87 0.11 0.00 0.00 0.00 0.00 51.96 51.29 1x6m s ALA 141 Cb -0.03 -0.74 -0.05 0.00 0.00 0.00 0.00 23.12 22.31 1x6m s ALA 141 CO 0.06 0.27 -0.19 0.00 0.00 0.00 0.00 175.76 175.91 1x6m s ALA 142 N 0.34 2.72 -1.44 0.00 0.00 0.44 -1.33 121.76 122.49 1x6m s ALA 142 Ca -0.16 -1.69 -0.07 0.00 0.00 0.00 0.00 51.96 50.04 1x6m s ALA 142 Cb -0.17 -0.41 0.04 0.00 0.00 0.00 0.00 23.12 22.59 1x6m s ALA 142 CO 0.07 0.38 0.76 1.19 0.00 0.00 0.00 175.76 178.16 1x6m n PHE 143 N -0.14 -1.99 -0.07 0.00 3.72 -0.49 -0.45 117.46 118.03 1x6m n PHE 143 Ca -0.09 0.84 -0.10 0.00 -0.05 0.00 0.00 57.45 58.05 1x6m n PHE 143 Cb 0.57 -4.01 -0.03 0.00 -0.94 0.00 0.00 39.48 35.07 1x6m n PHE 143 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1x6m h VAL 144 N -1.92 1.15 0.00 -4.37 2.07 -1.50 -2.58 116.25 109.10 1x6m h VAL 144 Ca -0.60 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 1x6m h VAL 144 Cb 1.37 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 32.12 1x6m h VAL 144 CO 0.63 0.15 -0.03 0.77 0.02 0.00 0.00 177.57 179.11 1x6m h SER 145 N 0.26 0.00 0.39 0.57 4.64 -1.85 -2.81 113.55 114.75 1x6m h SER 145 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1x6m h SER 145 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1x6m h SER 145 CO -0.01 0.03 0.00 -1.20 -0.87 0.00 0.00 176.83 174.78 1x6m n SER 146 N -3.26 0.44 0.24 4.97 7.64 -0.97 -1.84 113.62 120.84 1x6m n SER 146 Ca -0.02 0.65 0.12 0.00 1.01 0.00 0.00 58.87 60.63 1x6m n SER 146 Cb 0.17 -0.73 0.55 0.00 -1.01 0.00 0.00 64.21 63.19 1x6m n SER 146 CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 1x6m h ILE 147 N 0.00 0.42 -0.76 0.44 3.07 -1.52 -1.89 117.51 117.26 1x6m h ILE 147 Ca 0.00 -0.91 -0.01 0.00 1.55 0.00 0.00 64.86 65.50 1x6m h ILE 147 Cb 0.20 1.66 -0.04 0.00 -0.27 0.00 0.00 36.82 38.36 1x6m h ILE 147 CO 0.00 0.16 0.45 0.40 -1.05 0.00 0.00 178.15 178.11 1x6m h ILE 148 N 0.00 1.21 0.00 0.16 2.04 -1.57 -2.56 117.51 116.79 1x6m h ILE 148 Ca -0.00 -0.48 -0.00 0.00 1.00 0.00 0.00 64.86 65.38 1x6m h ILE 148 Cb 0.64 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1x6m h ILE 148 CO 0.02 0.23 -0.00 -0.33 0.00 0.00 0.00 178.15 178.06 1x6m h GLU 149 N 1.05 0.00 -0.36 2.37 5.08 -1.53 -0.23 114.58 120.95 1x6m h GLU 149 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1x6m h GLU 149 Cb -0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1x6m h GLU 149 CO -0.05 0.00 0.00 0.43 -1.00 0.00 0.00 179.01 178.39 1x6m n SER 150 N -3.12 2.89 0.00 1.42 7.64 -0.98 -4.97 113.62 116.50 1x6m n SER 150 Ca -0.02 -1.92 0.00 0.00 1.01 0.00 0.00 58.87 57.94 1x6m n SER 150 Cb 0.11 -0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.07 1x6m n SER 150 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x6m n GLY 151 N 1.38 0.59 3.70 0.23 0.00 -0.10 -5.07 105.19 105.93 1x6m n GLY 151 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1x6m n GLY 151 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x6m s VAL 152 N -2.00 2.45 0.19 1.61 1.01 -1.13 -4.97 120.40 117.57 1x6m s VAL 152 Ca 0.00 0.16 -0.31 0.00 0.00 0.00 0.00 61.98 61.83 1x6m s VAL 152 Cb 0.00 -3.10 -0.10 0.00 0.00 0.00 0.00 36.38 33.17 1x6m s VAL 152 CO 0.00 0.01 1.56 -0.62 0.00 0.00 0.00 175.10 176.05 1x6m s ASP 153 N 1.91 6.56 0.63 3.32 2.15 -1.26 -4.38 116.67 125.60 1x6m s ASP 153 Ca 0.76 2.67 0.34 0.00 0.43 0.00 0.00 52.55 56.75 1x6m s ASP 153 Cb -0.46 -2.60 1.84 0.00 -0.30 0.00 0.00 42.92 41.40 1x6m s ASP 153 CO 0.34 -0.82 2.03 1.55 -0.17 0.00 0.00 175.17 178.09 1x6m h PRO 154 N 6.34 0.00 0.00 4.34 0.13 -1.94 0.59 132.00 141.46 1x6m h PRO 154 Ca -0.44 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1x6m h PRO 154 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 1x6m h PRO 154 CO 0.88 0.00 -0.01 0.66 -0.23 0.00 0.00 178.00 179.31 1x6m h SER 155 N 0.00 0.00 1.59 1.44 4.64 -2.03 -2.77 113.55 116.42 1x6m h SER 155 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1x6m h SER 155 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1x6m h SER 155 CO 0.00 0.01 -0.03 0.03 -0.87 0.00 0.00 176.83 175.96 1x6m h ARG 156 N 0.00 0.00 -0.92 4.77 3.08 -1.24 -3.39 114.38 116.68 1x6m h ARG 156 Ca -0.00 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.14 1x6m h ARG 156 Cb 0.30 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.28 1x6m h ARG 156 CO 0.00 0.00 0.57 0.52 -1.07 0.00 0.00 179.97 179.99 1x6m h MET 157 N 0.00 0.94 -0.44 0.04 2.86 -1.63 -1.86 114.93 114.83 1x6m h MET 157 Ca 0.00 -0.06 -0.09 0.00 -2.06 0.00 0.00 59.70 57.49 1x6m h MET 157 Cb 0.81 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.25 1x6m h MET 157 CO 0.00 0.62 -0.09 1.49 1.06 0.00 0.00 176.91 179.99 1x6m h GLU 158 N 0.97 0.84 -0.22 1.72 4.81 -1.82 0.21 114.58 121.10 1x6m h GLU 158 Ca 0.43 -0.31 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 1x6m h GLU 158 Cb 0.31 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1x6m h GLU 158 CO -0.22 0.94 -0.07 0.00 -0.73 0.00 0.00 179.01 178.94 1x6m h ALA 159 N 0.87 0.30 -0.46 2.92 0.00 -1.75 -1.77 119.26 119.37 1x6m h ALA 159 Ca 0.11 -0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.82 1x6m h ALA 159 Cb 0.62 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 1x6m h ALA 159 CO 0.04 0.10 0.14 0.82 0.00 0.00 0.00 179.25 180.35 1x6m h ILE 160 N 0.15 0.82 -0.24 0.00 2.04 -1.27 -1.16 117.51 117.84 1x6m h ILE 160 Ca 0.05 -0.10 -0.10 0.00 1.00 0.00 0.00 64.86 65.71 1x6m h ILE 160 Cb 0.53 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1x6m h ILE 160 CO 0.02 0.05 -0.27 0.03 0.00 0.00 0.00 178.15 177.99 1x6m h ARG 161 N 0.30 0.46 -0.39 2.37 3.08 -0.54 -2.04 114.38 117.62 1x6m h ARG 161 Ca 0.22 -0.18 -0.12 0.00 0.07 0.00 0.00 59.98 59.98 1x6m h ARG 161 Cb 0.25 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 1x6m h ARG 161 CO -0.25 0.69 -0.22 0.00 -1.07 0.00 0.00 179.97 179.12 1x6m h ALA 162 N 1.31 0.55 -0.42 0.04 0.00 -1.13 -2.46 119.26 117.17 1x6m h ALA 162 Ca 0.06 -0.38 -0.14 0.00 0.00 0.00 0.00 54.91 54.45 1x6m h ALA 162 Cb 0.68 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1x6m h ALA 162 CO 0.05 0.53 -0.29 -0.09 0.00 0.00 0.00 179.25 179.45 1x6m h ARG 163 N 0.65 0.91 -0.07 0.00 9.65 -1.11 -2.07 114.38 122.32 1x6m h ARG 163 Ca 0.08 -0.42 0.02 0.00 -1.10 0.00 0.00 59.98 58.57 1x6m h ARG 163 Cb 0.79 -0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 29.32 1x6m h ARG 163 CO 0.06 1.07 -0.08 -0.07 2.80 0.00 0.00 179.97 183.76 1x6m h LEU 164 N 0.77 -0.24 -1.86 3.80 3.38 -1.34 -2.40 115.31 117.41 1x6m h LEU 164 Ca 0.09 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.16 1x6m h LEU 164 Cb 0.86 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 1x6m h LEU 164 CO 0.08 -0.11 0.21 0.03 0.09 0.00 0.00 178.44 178.73 1x6m h ARG 165 N -0.10 0.17 -0.10 1.13 3.08 -1.19 -0.96 114.38 116.40 1x6m h ARG 165 Ca 0.06 -0.01 -0.09 0.00 0.07 0.00 0.00 59.98 60.01 1x6m h ARG 165 Cb 0.19 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1x6m h ARG 165 CO -0.14 0.11 -0.32 0.93 -1.07 0.00 0.00 179.97 179.48 1x6m h GLU 166 N 0.18 0.20 -0.00 0.04 5.08 -1.11 -2.77 114.58 116.20 1x6m h GLU 166 Ca 0.14 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1x6m h GLU 166 Cb 0.32 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1x6m h GLU 166 CO -0.02 0.51 -0.00 1.28 -1.00 0.00 0.00 179.01 179.77 1x6m n LEU 167 N -4.11 0.00 0.00 1.33 4.77 -0.50 -4.93 117.00 113.57 1x6m n LEU 167 Ca -0.01 0.49 0.00 0.00 -0.03 0.00 0.00 56.01 56.46 1x6m n LEU 167 Cb 0.41 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1x6m n LEU 167 CO 0.40 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 1x6m n GLY 168 N 1.50 0.55 3.25 -0.72 0.00 -0.94 -5.00 105.19 103.82 1x6m n GLY 168 Ca 0.07 -0.69 -0.43 0.00 0.00 0.00 0.00 46.02 44.97 1x6m n GLY 168 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x6m s LEU 169 N 0.00 6.17 0.06 0.99 1.43 -0.49 -4.64 118.68 122.20 1x6m s LEU 169 Ca 0.00 -3.10 -0.34 0.00 -1.03 0.00 0.00 54.13 49.66 1x6m s LEU 169 Cb 0.00 -2.09 -0.13 0.00 0.03 0.00 0.00 46.19 44.00 1x6m s LEU 169 CO 0.00 -0.40 1.70 1.21 0.23 0.00 0.00 176.35 179.09 1x6m n GLU 170 N 3.32 2.15 -2.87 1.70 4.07 -1.26 -3.95 120.64 123.80 1x6m n GLU 170 Ca 0.16 0.78 -0.41 0.00 -0.06 0.00 0.00 57.16 57.64 1x6m n GLU 170 Cb 0.42 -2.58 -0.04 0.00 -0.06 0.00 0.00 31.44 29.17 1x6m n GLU 170 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 1x6m s PRO 171 N 2.23 4.56 0.09 5.31 0.04 -1.26 -1.34 135.00 144.64 1x6m s PRO 171 Ca 0.85 1.22 0.06 0.00 0.04 0.00 0.00 61.00 63.16 1x6m s PRO 171 Cb -0.69 -3.39 -0.03 0.00 0.04 0.00 0.00 34.50 30.43 1x6m s PRO 171 CO 0.44 0.19 -0.15 0.71 0.04 0.00 0.00 177.00 178.22 1x6m s TYR 172 N 0.22 1.37 -1.82 0.56 2.02 -0.44 -4.97 117.35 114.29 1x6m s TYR 172 Ca 0.43 -0.48 0.27 0.00 -0.37 0.00 0.00 57.07 56.92 1x6m s TYR 172 Cb -0.21 -0.75 0.91 0.00 -0.40 0.00 0.00 41.96 41.51 1x6m s TYR 172 CO 0.25 0.11 1.66 -0.25 -1.57 0.00 0.00 175.55 175.75 1x6m n ASP 173 N 1.01 0.94 0.00 2.29 8.00 -1.26 -1.62 116.55 125.91 1x6m n ASP 173 Ca -0.19 -0.89 0.00 0.00 0.71 0.00 0.00 54.79 54.42 1x6m n ASP 173 Cb 0.55 0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.72 1x6m n ASP 173 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1x6m n ALA 174 N -0.62 0.00 -1.81 2.24 0.00 -1.26 -3.88 120.51 115.18 1x6m n ALA 174 Ca 0.14 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.50 1x6m n ALA 174 Cb 0.33 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.84 1x6m n ALA 174 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1x6m n LEU 175 N 0.00 0.00 -4.85 0.00 4.77 -1.26 -1.40 117.00 114.26 1x6m n LEU 175 Ca 0.00 -0.63 -0.31 0.00 -0.03 0.00 0.00 56.01 55.04 1x6m n LEU 175 Cb 0.00 -0.30 0.03 0.00 -2.33 0.00 0.00 43.42 40.82 1x6m n LEU 175 CO 0.00 -0.76 0.72 -0.94 -1.33 0.00 0.00 177.39 175.08 1x6m s SER 176 N -2.61 5.75 0.23 -1.43 1.04 -1.26 -4.77 113.70 110.66 1x6m s SER 176 Ca 0.25 1.45 -0.06 0.00 0.48 0.00 0.00 55.95 58.07 1x6m s SER 176 Cb -0.01 -2.39 0.32 0.00 0.10 0.00 0.00 66.02 64.04 1x6m s SER 176 CO 0.17 -1.18 1.84 -0.65 0.98 0.00 0.00 173.24 174.40 1x6m h PRO 177 N -0.54 0.86 -0.72 4.02 0.11 -1.98 0.15 132.00 133.90 1x6m h PRO 177 Ca -0.44 -0.05 0.05 0.00 0.11 0.00 0.00 66.00 65.67 1x6m h PRO 177 Cb 1.21 -0.19 -0.05 0.00 0.11 0.00 0.00 31.00 32.07 1x6m h PRO 177 CO 0.60 0.57 0.43 -1.35 -0.21 0.00 0.00 178.00 178.04 1x6m h PRO 178 N 0.88 0.78 -0.31 1.05 0.11 -1.99 0.18 132.00 132.70 1x6m h PRO 178 Ca 0.36 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 66.31 1x6m h PRO 178 Cb 0.20 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.12 1x6m h PRO 178 CO -0.18 0.51 -0.27 -0.07 -0.21 0.00 0.00 178.00 177.78 1x6m h LEU 179 N 0.80 0.65 -0.47 2.35 3.38 -1.78 -0.62 115.31 119.62 1x6m h LEU 179 Ca 0.31 -0.24 -0.15 0.00 0.09 0.00 0.00 57.88 57.89 1x6m h LEU 179 Cb 0.13 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1x6m h LEU 179 CO -0.16 0.89 -0.32 0.24 0.09 0.00 0.00 178.44 179.18 1x6m h MET 180 N 0.55 0.91 -0.20 1.13 2.86 0.04 -1.08 114.93 119.15 1x6m h MET 180 Ca 0.07 -0.44 -0.12 0.00 -2.06 0.00 0.00 59.70 57.15 1x6m h MET 180 Cb 0.75 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.39 1x6m h MET 180 CO 0.06 1.10 -0.39 -0.44 1.06 0.00 0.00 176.91 178.30 1x6m h ASP 181 N 0.76 0.47 -0.61 1.22 5.19 -0.52 -2.32 116.42 120.63 1x6m h ASP 181 Ca 0.08 -0.20 -0.07 0.00 -0.62 0.00 0.00 57.03 56.22 1x6m h ASP 181 Cb 0.90 -0.13 -0.03 0.00 0.18 0.00 0.00 39.33 40.25 1x6m h ASP 181 CO 0.08 0.82 0.13 0.00 -3.12 0.00 0.00 179.24 177.15 1x6m h ALA 182 N 1.21 1.03 -0.28 3.45 0.00 -0.95 0.17 119.26 123.89 1x6m h ALA 182 Ca 0.04 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.55 1x6m h ALA 182 Cb 0.85 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1x6m h ALA 182 CO 0.07 0.63 -0.43 0.82 0.00 0.00 0.00 179.25 180.33 1x6m h ILE 183 N 0.96 1.29 -0.06 0.00 2.04 -1.08 -1.87 117.51 118.80 1x6m h ILE 183 Ca 0.20 -1.62 -0.01 0.00 1.00 0.00 0.00 64.86 64.43 1x6m h ILE 183 Cb 0.38 1.54 -0.00 0.00 -0.74 0.00 0.00 36.82 38.00 1x6m h ILE 183 CO 0.01 0.52 -0.01 0.00 0.00 0.00 0.00 178.15 178.66 1x6m h ALA 184 N 0.95 0.08 -0.19 1.87 0.00 -1.28 -1.68 119.26 119.01 1x6m h ALA 184 Ca 0.04 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.80 1x6m h ALA 184 Cb 0.98 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.70 1x6m h ALA 184 CO 0.09 -0.22 -0.15 1.15 0.00 0.00 0.00 179.25 180.12 1x6m h THR 185 N -0.23 0.58 -0.51 0.00 2.02 -0.90 0.63 112.91 114.49 1x6m h THR 185 Ca 0.01 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.25 1x6m h THR 185 Cb 0.39 0.58 -0.08 0.00 -1.74 0.00 0.00 68.15 67.30 1x6m h THR 185 CO 0.00 0.00 -0.48 -0.74 0.37 0.00 0.00 175.52 174.68 1x6m h HIS 186 N -0.16 -1.49 -0.90 3.16 6.17 -1.35 -1.79 115.15 118.79 1x6m h HIS 186 Ca 0.12 0.08 0.07 0.00 0.71 0.00 0.00 60.37 61.35 1x6m h HIS 186 Cb 0.33 0.72 -0.06 0.00 2.52 0.00 0.00 27.41 30.92 1x6m h HIS 186 CO -0.30 -0.38 0.58 0.82 0.71 0.00 0.00 177.93 179.37 1x6m h ILE 187 N -0.22 1.04 0.13 6.26 2.04 -0.66 -2.75 117.51 123.35 1x6m h ILE 187 Ca 0.09 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 1x6m h ILE 187 Cb 0.45 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 1x6m h ILE 187 CO -0.60 0.18 -0.06 0.00 0.00 0.00 0.00 178.15 177.67 1x6m h ALA 188 N 1.52 -0.17 -0.96 1.87 0.00 -0.67 -2.41 119.26 118.45 1x6m h ALA 188 Ca 0.39 -0.21 0.23 0.00 0.00 0.00 0.00 54.91 55.32 1x6m h ALA 188 Cb 0.25 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 1x6m h ALA 188 CO -0.15 -0.38 0.63 0.87 0.00 0.00 0.00 179.25 180.22 1x6m h LYS 189 N -0.61 0.38 -0.01 0.00 1.57 -1.15 -0.91 116.57 115.85 1x6m h LYS 189 Ca -0.02 -0.02 -0.22 0.00 -1.87 0.00 0.00 60.65 58.52 1x6m h LYS 189 Cb 0.47 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.70 1x6m h LYS 189 CO 0.03 0.25 -0.91 0.00 -0.57 0.00 0.00 179.45 178.25 1x6m h ARG 190 N 0.39 0.37 -0.00 3.15 3.08 -1.52 -3.35 114.38 116.50 1x6m h ARG 190 Ca 0.51 -0.39 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1x6m h ARG 190 Cb 1.30 0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.46 1x6m h ARG 190 CO -0.21 1.07 -0.28 -1.13 -1.07 0.00 0.00 179.97 178.35 1x6m n SER 191 N -3.74 0.59 0.00 7.04 3.41 -0.38 -4.91 113.62 115.63 1x6m n SER 191 Ca -0.06 -0.43 0.00 0.00 -0.26 0.00 0.00 58.87 58.13 1x6m n SER 191 Cb 0.82 0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.83 1x6m n SER 191 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x6m n GLY 192 N 1.40 3.13 0.45 5.00 0.00 -0.98 -4.96 105.19 109.23 1x6m n GLY 192 Ca 0.10 -0.85 0.19 0.00 0.00 0.00 0.00 46.02 45.46 1x6m n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x6m h ALA 193 N 0.00 2.52 -3.77 4.61 0.00 -1.81 -3.39 119.26 117.43 1x6m h ALA 193 Ca 0.00 -0.02 -0.41 0.00 0.00 0.00 0.00 54.91 54.48 1x6m h ALA 193 Cb 0.00 0.05 -0.31 0.00 0.00 0.00 0.00 17.79 17.53 1x6m h ALA 193 CO 0.00 -1.34 -0.78 -1.17 0.00 0.00 0.00 179.25 175.96 1x6m s LEU 194 N -6.19 1.74 0.56 0.00 2.96 -1.14 -4.94 118.68 111.67 1x6m s LEU 194 Ca -0.02 -0.16 -0.21 0.00 -0.22 0.00 0.00 54.13 53.52 1x6m s LEU 194 Cb 0.10 -0.48 -0.04 0.00 0.50 0.00 0.00 46.19 46.27 1x6m s LEU 194 CO 0.35 0.04 1.34 0.00 -1.32 0.00 0.00 176.35 176.77 1x6m s ALA 195 N 0.26 2.74 0.00 5.97 0.00 -1.26 -4.08 121.76 125.40 1x6m s ALA 195 Ca -0.04 1.30 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1x6m s ALA 195 Cb -0.09 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.48 1x6m s ALA 195 CO 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 175.76 174.37