#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1itv s ASP 2 N 0.00 6.27 0.56 1.67 3.68 -1.26 -4.18 116.67 123.41 1itv s ASP 2 Ca 0.00 0.30 0.26 0.00 2.13 0.00 0.00 52.55 55.25 1itv s ASP 2 Cb 0.00 -2.17 1.48 0.00 -1.45 0.00 0.00 42.92 40.79 1itv s ASP 2 CO 0.00 -0.02 2.03 0.00 0.13 0.00 0.00 175.17 177.31 1itv h ALA 3 N 7.50 2.18 0.00 3.66 0.00 -1.95 0.08 119.26 130.73 1itv h ALA 3 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1itv h ALA 3 Cb 1.17 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1itv h ALA 3 CO 0.68 -0.49 0.00 0.00 0.00 0.00 0.00 179.25 179.44 1itv n ASN 5 N -2.52 1.39 -4.73 0.00 3.02 0.01 -4.90 115.26 107.54 1itv n ASN 5 Ca 0.02 -1.11 -0.41 0.00 -0.03 0.00 0.00 54.58 53.05 1itv n ASN 5 Cb 0.26 0.38 -0.04 0.00 -0.61 0.00 0.00 39.78 39.76 1itv n ASN 5 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1itv s VAL 6 N -2.59 4.50 -0.18 2.41 1.01 -1.04 -4.96 120.40 119.54 1itv s VAL 6 Ca 0.19 2.02 -0.14 0.00 0.00 0.00 0.00 61.98 64.05 1itv s VAL 6 Cb 0.18 -4.29 -0.21 0.00 0.00 0.00 0.00 36.38 32.06 1itv s VAL 6 CO 0.59 0.28 0.20 0.59 0.00 0.00 0.00 175.10 176.76 1itv n ASN 7 N 2.98 1.98 -3.84 3.32 5.03 -1.26 -4.85 115.26 118.62 1itv n ASN 7 Ca 0.03 0.30 -0.29 0.00 0.87 0.00 0.00 54.58 55.49 1itv n ASN 7 Cb 0.49 -0.88 -0.16 0.00 -1.02 0.00 0.00 39.78 38.21 1itv n ASN 7 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1itv s ILE 8 N -2.46 1.10 0.28 2.41 1.01 -1.26 -3.89 121.20 118.38 1itv s ILE 8 Ca -0.28 -1.07 -0.29 0.00 0.00 0.00 0.00 60.65 59.01 1itv s ILE 8 Cb 0.07 -1.55 -0.09 0.00 0.01 0.00 0.00 42.46 40.90 1itv s ILE 8 CO 0.65 -0.26 1.02 -0.36 0.00 0.00 0.00 174.94 175.98 1itv s PHE 9 N 1.57 3.74 0.23 3.97 0.40 -1.26 -4.94 117.98 121.69 1itv s PHE 9 Ca -0.01 1.80 -0.08 0.00 -0.60 0.00 0.00 56.93 58.04 1itv s PHE 9 Cb -0.18 -3.11 0.21 0.00 0.51 0.00 0.00 43.02 40.44 1itv s PHE 9 CO -0.10 -0.06 1.90 -0.44 0.70 0.00 0.00 175.22 177.21 1itv h ASP 10 N 3.80 1.02 -5.01 1.36 3.32 -0.60 -3.45 116.42 116.86 1itv h ASP 10 Ca -0.46 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 56.51 1itv h ASP 10 Cb 1.21 -0.26 -0.15 0.00 0.22 0.00 0.00 39.33 40.35 1itv h ASP 10 CO 0.67 0.75 0.10 0.00 -1.72 0.00 0.00 179.24 179.03 1itv s ALA 11 N -6.10 -1.45 -0.00 3.45 0.00 -1.13 -4.43 121.76 112.09 1itv s ALA 11 Ca -0.13 0.66 0.00 0.00 0.00 0.00 0.00 51.96 52.49 1itv s ALA 11 Cb 0.16 0.45 0.00 0.00 0.00 0.00 0.00 23.12 23.74 1itv s ALA 11 CO 0.80 -0.55 -0.01 0.42 0.00 0.00 0.00 175.76 176.42 1itv s ILE 12 N -2.61 0.11 -0.11 0.00 1.01 -1.26 -0.74 121.20 117.58 1itv s ILE 12 Ca -0.04 -0.03 -0.29 0.00 0.00 0.00 0.00 60.65 60.28 1itv s ILE 12 Cb -0.01 -0.11 0.07 0.00 0.01 0.00 0.00 42.46 42.42 1itv s ILE 12 CO -0.03 0.04 0.70 0.00 0.00 0.00 0.00 174.94 175.66 1itv s ALA 13 N 0.12 -1.78 -0.19 9.38 0.00 -0.61 -4.63 121.76 124.05 1itv s ALA 13 Ca -0.01 1.52 -0.15 0.00 0.00 0.00 0.00 51.96 53.32 1itv s ALA 13 Cb -0.02 -0.35 -0.04 0.00 0.00 0.00 0.00 23.12 22.70 1itv s ALA 13 CO -0.00 -0.36 0.38 -1.83 0.00 0.00 0.00 175.76 173.94 1itv s GLU 14 N -0.75 4.20 -0.18 0.00 -1.05 -1.26 0.03 118.70 119.70 1itv s GLU 14 Ca -0.08 0.19 0.01 0.00 -0.15 0.00 0.00 54.97 54.94 1itv s GLU 14 Cb -0.01 -3.50 0.02 0.00 -0.44 0.00 0.00 34.13 30.20 1itv s GLU 14 CO 0.07 0.04 -0.17 0.42 0.95 0.00 0.00 175.26 176.57 1itv s ILE 15 N 1.07 1.90 0.00 1.83 1.01 0.26 -4.43 121.20 122.83 1itv s ILE 15 Ca 0.19 -0.89 0.00 0.00 0.00 0.00 0.00 60.65 59.95 1itv s ILE 15 Cb -0.14 -1.76 0.00 0.00 0.01 0.00 0.00 42.46 40.57 1itv s ILE 15 CO 0.07 0.47 0.00 0.61 0.00 0.00 0.00 174.94 176.09 1itv n GLY 16 N 4.66 3.20 1.56 6.18 0.00 -1.26 -2.01 105.19 117.53 1itv n GLY 16 Ca -0.19 -0.15 -0.13 0.00 0.00 0.00 0.00 46.02 45.55 1itv n GLY 16 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1itv n ASN 17 N 7.29 3.50 -4.01 1.61 4.13 -1.26 -4.98 115.26 121.53 1itv n ASN 17 Ca 0.00 -3.77 -0.08 0.00 1.68 0.00 0.00 54.58 52.41 1itv n ASN 17 Cb 0.00 -0.67 -0.10 0.00 -1.54 0.00 0.00 39.78 37.47 1itv n ASN 17 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1itv s GLN 18 N -3.37 0.60 -0.21 3.52 -0.21 -0.85 -4.85 119.66 114.30 1itv s GLN 18 Ca 0.50 -1.02 -0.07 0.00 0.02 0.00 0.00 55.36 54.79 1itv s GLN 18 Cb 0.43 0.22 -0.03 0.00 1.00 0.00 0.00 33.01 34.63 1itv s GLN 18 CO 0.02 -0.13 0.04 -1.17 -2.12 0.00 0.00 175.29 171.93 1itv s LEU 19 N -2.58 3.51 -0.14 2.90 1.98 -0.30 -0.58 118.68 123.48 1itv s LEU 19 Ca 0.02 -0.10 -0.07 0.00 -2.89 0.00 0.00 54.13 51.08 1itv s LEU 19 Cb 0.04 -1.90 -0.04 0.00 0.66 0.00 0.00 46.19 44.94 1itv s LEU 19 CO -0.08 0.08 0.12 -0.31 -1.89 0.00 0.00 176.35 174.27 1itv s TYR 20 N 0.95 3.50 -0.09 5.38 2.02 0.10 -0.59 117.35 128.62 1itv s TYR 20 Ca 0.03 0.43 0.04 0.00 -0.37 0.00 0.00 57.07 57.20 1itv s TYR 20 Cb -0.14 -1.99 -0.00 0.00 -0.40 0.00 0.00 41.96 39.43 1itv s TYR 20 CO 0.02 0.57 -0.24 -0.51 -1.57 0.00 0.00 175.55 173.82 1itv s LEU 21 N -0.59 2.09 0.00 -1.29 2.01 -0.61 -1.57 118.68 118.72 1itv s LEU 21 Ca 0.12 -0.55 0.08 0.00 0.01 0.00 0.00 54.13 53.79 1itv s LEU 21 Cb -0.12 -1.40 -0.02 0.00 0.01 0.00 0.00 46.19 44.65 1itv s LEU 21 CO 0.02 0.17 -0.23 -0.36 1.01 0.00 0.00 176.35 176.96 1itv s PHE 22 N 0.26 2.41 -0.30 0.29 0.40 0.08 -0.09 117.98 121.03 1itv s PHE 22 Ca -0.17 -0.37 -0.12 0.00 -0.60 0.00 0.00 56.93 55.67 1itv s PHE 22 Cb -0.17 -1.48 0.14 0.00 0.51 0.00 0.00 43.02 42.01 1itv s PHE 22 CO 0.08 0.07 0.77 0.21 0.70 0.00 0.00 175.22 177.06 1itv s LYS 23 N -0.90 0.48 -1.06 0.44 2.47 0.62 0.12 119.74 121.92 1itv s LYS 23 Ca 0.11 1.19 -0.20 0.00 -1.56 0.00 0.00 55.97 55.51 1itv s LYS 23 Cb -0.10 0.68 0.02 0.00 -1.46 0.00 0.00 37.83 36.97 1itv s LYS 23 CO 0.01 -0.16 0.69 -0.25 0.16 0.00 0.00 175.35 175.80 1itv n ASP 24 N 5.20 -4.87 -1.45 1.43 8.00 -1.26 -0.98 116.55 122.63 1itv n ASP 24 Ca -0.11 -1.06 -0.19 0.00 0.71 0.00 0.00 54.79 54.14 1itv n ASP 24 Cb 0.51 -2.31 -0.08 0.00 -0.02 0.00 0.00 41.12 39.22 1itv n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1itv n GLY 25 N -1.85 1.72 3.23 0.44 0.00 0.40 -4.97 105.19 104.15 1itv n GLY 25 Ca -0.16 -0.13 -0.16 0.00 0.00 0.00 0.00 46.02 45.58 1itv n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1itv s LYS 26 N -3.63 1.00 0.06 1.61 -0.14 -0.15 -2.08 119.74 116.40 1itv s LYS 26 Ca 0.00 -1.30 -0.13 0.00 -1.36 0.00 0.00 55.97 53.18 1itv s LYS 26 Cb 0.00 -0.71 0.02 0.00 -1.68 0.00 0.00 37.83 35.45 1itv s LYS 26 CO 0.00 0.12 0.30 1.52 -0.76 0.00 0.00 175.35 176.53 1itv s TYR 27 N -2.65 -0.09 0.26 3.18 -0.85 0.25 -0.28 117.35 117.18 1itv s TYR 27 Ca 0.11 -0.11 0.06 0.00 -0.52 0.00 0.00 57.07 56.61 1itv s TYR 27 Cb -0.02 0.10 -0.06 0.00 0.38 0.00 0.00 41.96 42.36 1itv s TYR 27 CO 0.02 -0.54 -0.05 -1.58 -1.52 0.00 0.00 175.55 171.88 1itv s TRP 28 N -2.88 1.83 -0.09 -3.49 0.51 0.87 -0.50 118.94 115.19 1itv s TRP 28 Ca -0.03 -0.76 0.01 0.00 -2.12 0.00 0.00 56.10 53.21 1itv s TRP 28 Cb 0.00 -1.04 0.02 0.00 -0.81 0.00 0.00 33.47 31.64 1itv s TRP 28 CO -0.05 0.19 -0.10 1.03 -0.51 0.00 0.00 176.95 177.51 1itv s ARG 29 N -3.76 1.61 -0.07 4.98 0.52 -0.23 -1.57 118.95 120.42 1itv s ARG 29 Ca 0.29 -0.34 0.05 0.00 -0.52 0.00 0.00 55.73 55.20 1itv s ARG 29 Cb 0.04 -1.47 -0.00 0.00 0.52 0.00 0.00 34.95 34.04 1itv s ARG 29 CO 0.11 -0.10 -0.22 0.12 0.02 0.00 0.00 175.30 175.23 1itv s PHE 30 N 1.10 2.22 -0.11 -0.53 2.19 0.25 -0.61 117.98 122.49 1itv s PHE 30 Ca -0.06 -0.78 0.01 0.00 0.33 0.00 0.00 56.93 56.43 1itv s PHE 30 Cb -0.14 -1.49 0.02 0.00 -1.31 0.00 0.00 43.02 40.10 1itv s PHE 30 CO -0.01 -0.29 -0.13 -1.12 1.83 0.00 0.00 175.22 175.50 1itv s SER 31 N 0.16 2.31 1.06 6.13 0.01 -1.26 -1.15 113.70 120.96 1itv s SER 31 Ca -0.11 -0.39 -0.17 0.00 1.31 0.00 0.00 55.95 56.60 1itv s SER 31 Cb -0.15 -1.01 0.08 0.00 0.21 0.00 0.00 66.02 65.15 1itv s SER 31 CO 0.05 -0.02 0.14 1.21 0.41 0.00 0.00 173.24 175.03 1itv n GLU 32 N 4.39 -1.11 0.00 12.44 2.13 -1.26 -4.69 120.64 132.54 1itv n GLU 32 Ca -0.18 -0.30 0.00 0.00 0.66 0.00 0.00 57.16 57.34 1itv n GLU 32 Cb 0.51 -1.75 0.00 0.00 0.27 0.00 0.00 31.44 30.47 1itv n GLU 32 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1itv n GLY 33 N 1.85 2.53 3.45 8.31 0.00 -1.26 -4.82 105.19 115.24 1itv n GLY 33 Ca 0.03 -1.62 -0.44 0.00 0.00 0.00 0.00 46.02 43.99 1itv n GLY 33 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1itv s ARG 34 N -1.86 3.79 0.00 1.61 6.06 -1.26 -3.85 118.95 123.44 1itv s ARG 34 Ca 0.00 -2.12 0.00 0.00 -2.50 0.00 0.00 55.73 51.11 1itv s ARG 34 Cb 0.00 -4.94 0.00 0.00 0.06 0.00 0.00 34.95 30.07 1itv s ARG 34 CO 0.00 -1.74 0.00 0.41 -2.50 0.00 0.00 175.30 171.47 1itv n GLY 35 N 4.87 0.89 3.65 8.12 0.00 -1.26 -5.08 105.19 116.38 1itv n GLY 35 Ca 0.28 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.87 1itv n GLY 35 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1itv s SER 36 N -1.00 6.75 0.34 1.61 0.15 -1.25 -5.02 113.70 115.27 1itv s SER 36 Ca 0.00 1.56 0.03 0.00 0.70 0.00 0.00 55.95 58.24 1itv s SER 36 Cb 0.00 -2.54 -0.02 0.00 -1.71 0.00 0.00 66.02 61.75 1itv s SER 36 CO 0.00 -0.95 0.50 -0.13 1.20 0.00 0.00 173.24 173.86 1itv s ARG 37 N 3.94 3.28 -0.17 5.44 1.81 -1.26 -4.83 118.95 127.15 1itv s ARG 37 Ca 0.59 -0.67 -0.29 0.00 -1.72 0.00 0.00 55.73 53.64 1itv s ARG 37 Cb -0.21 -2.75 -0.04 0.00 -0.45 0.00 0.00 34.95 31.50 1itv s ARG 37 CO 0.21 0.12 1.70 -1.25 -0.68 0.00 0.00 175.30 175.39 1itv s PRO 38 N -4.23 3.83 0.25 3.54 0.04 -1.26 -4.72 135.00 132.44 1itv s PRO 38 Ca 0.41 1.85 -0.30 0.00 0.04 0.00 0.00 61.00 63.01 1itv s PRO 38 Cb -0.09 -4.07 -0.09 0.00 0.04 0.00 0.00 34.50 30.29 1itv s PRO 38 CO 0.33 -1.27 1.03 -0.65 0.04 0.00 0.00 177.00 176.48 1itv s GLN 39 N 4.70 4.73 0.00 4.56 -0.21 0.22 -4.86 119.66 128.80 1itv s GLN 39 Ca 0.75 1.66 0.00 0.00 0.02 0.00 0.00 55.36 57.80 1itv s GLN 39 Cb -0.28 -3.24 0.00 0.00 1.00 0.00 0.00 33.01 30.49 1itv s GLN 39 CO 0.31 0.33 0.00 0.41 -2.12 0.00 0.00 175.29 174.22 1itv n GLY 40 N 1.40 0.91 3.85 3.09 0.00 -1.26 -1.06 105.19 112.11 1itv n GLY 40 Ca -0.01 -1.95 -0.32 0.00 0.00 0.00 0.00 46.02 43.75 1itv n GLY 40 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1itv s PRO 41 N -1.71 3.92 0.18 1.61 0.04 -1.26 -5.02 135.00 132.76 1itv s PRO 41 Ca 0.00 0.76 0.11 0.00 0.04 0.00 0.00 61.00 61.91 1itv s PRO 41 Cb 0.00 -2.27 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 1itv s PRO 41 CO 0.00 -0.11 -0.22 -0.06 0.04 0.00 0.00 177.00 176.65 1itv s PHE 42 N -2.42 2.36 -0.07 0.56 0.40 0.34 -4.91 117.98 114.25 1itv s PHE 42 Ca 0.56 -0.34 -0.26 0.00 -0.60 0.00 0.00 56.93 56.29 1itv s PHE 42 Cb -0.10 -1.18 -0.03 0.00 0.51 0.00 0.00 43.02 42.22 1itv s PHE 42 CO 0.28 0.49 0.82 -0.51 0.70 0.00 0.00 175.22 177.00 1itv s LEU 43 N -2.64 4.30 0.37 -0.37 2.01 -1.26 -0.58 118.68 120.51 1itv s LEU 43 Ca 0.21 1.34 0.06 0.00 0.01 0.00 0.00 54.13 55.75 1itv s LEU 43 Cb -0.08 -3.28 0.71 0.00 0.01 0.00 0.00 46.19 43.55 1itv s LEU 43 CO 0.10 -0.23 1.93 0.40 1.01 0.00 0.00 176.35 179.56 1itv h ILE 44 N 4.87 1.17 -0.32 -0.59 2.04 -1.74 -2.22 117.51 120.72 1itv h ILE 44 Ca -0.38 -0.64 -0.00 0.00 1.00 0.00 0.00 64.86 64.84 1itv h ILE 44 Cb 1.19 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 1itv h ILE 44 CO 0.77 0.22 0.19 0.00 0.00 0.00 0.00 178.15 179.33 1itv h ALA 45 N 1.59 1.72 0.14 1.87 0.00 -1.80 0.14 119.26 122.92 1itv h ALA 45 Ca 0.10 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1itv h ALA 45 Cb 0.25 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1itv h ALA 45 CO 0.00 0.25 -0.07 -0.44 0.00 0.00 0.00 179.25 178.99 1itv h ASP 46 N 0.45 -0.16 0.19 0.00 3.32 -1.80 -2.33 116.42 116.09 1itv h ASP 46 Ca 0.12 -0.11 -0.33 0.00 0.02 0.00 0.00 57.03 56.72 1itv h ASP 46 Cb 0.00 0.04 0.01 0.00 0.22 0.00 0.00 39.33 39.61 1itv h ASP 46 CO -0.02 0.01 -1.62 0.50 -1.72 0.00 0.00 179.24 176.39 1itv h LYS 47 N -0.34 0.40 -2.36 3.56 3.64 -1.60 -3.41 116.57 116.47 1itv h LYS 47 Ca -0.02 -0.68 -0.59 0.00 -1.27 0.00 0.00 60.65 58.09 1itv h LYS 47 Cb 0.27 0.25 -0.41 0.00 -0.41 0.00 0.00 32.23 31.93 1itv h LYS 47 CO 0.03 1.33 -0.76 0.91 -2.27 0.00 0.00 179.45 178.69 1itv n TRP 48 N -3.69 2.05 0.03 1.91 8.01 0.47 -4.97 117.44 121.25 1itv n TRP 48 Ca -0.23 -3.95 0.02 0.00 -1.31 0.00 0.00 57.50 52.03 1itv n TRP 48 Cb 1.05 -0.42 0.08 0.00 -2.01 0.00 0.00 31.31 30.01 1itv n TRP 48 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.69 176.33 1itv n PRO 49 N 1.46 0.02 0.07 -0.99 -0.04 -0.88 -1.76 135.00 132.90 1itv n PRO 49 Ca 0.26 0.44 0.10 0.00 -0.04 0.00 0.00 63.50 64.26 1itv n PRO 49 Cb 0.43 -1.67 -0.04 0.00 -0.04 0.00 0.00 33.50 32.18 1itv n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1itv n ALA 50 N -1.45 2.51 -1.77 0.55 0.00 -1.26 -4.96 120.51 114.14 1itv n ALA 50 Ca -0.00 -0.33 -0.35 0.00 0.00 0.00 0.00 53.44 52.76 1itv n ALA 50 Cb 0.11 -1.01 -0.00 0.00 0.00 0.00 0.00 19.45 18.54 1itv n ALA 50 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1itv s LEU 51 N -5.23 3.75 1.00 0.00 1.43 -0.72 -5.01 118.68 113.90 1itv s LEU 51 Ca -0.02 2.10 -0.16 0.00 -1.03 0.00 0.00 54.13 55.02 1itv s LEU 51 Cb 0.10 -4.57 0.20 0.00 0.03 0.00 0.00 46.19 41.95 1itv s LEU 51 CO 0.82 -1.13 1.24 -2.16 0.23 0.00 0.00 176.35 175.35 1itv s PRO 52 N -3.32 0.39 0.01 1.29 0.04 -1.26 -4.89 135.00 127.26 1itv s PRO 52 Ca 0.71 -0.19 -0.20 0.00 0.04 0.00 0.00 61.00 61.36 1itv s PRO 52 Cb -0.22 -1.80 -0.20 0.00 0.04 0.00 0.00 34.50 32.33 1itv s PRO 52 CO 0.26 -2.61 1.18 -0.09 0.04 0.00 0.00 177.00 175.77 1itv h ARG 53 N -1.79 0.39 -5.05 4.56 2.43 -1.96 -3.44 114.38 109.52 1itv h ARG 53 Ca -0.45 -0.33 -0.63 0.00 -0.81 0.00 0.00 59.98 57.75 1itv h ARG 53 Cb 1.27 0.07 -0.18 0.00 -0.42 0.00 0.00 29.97 30.71 1itv h ARG 53 CO 0.43 0.98 -0.57 0.21 -1.51 0.00 0.00 179.97 179.51 1itv s LYS 54 N -3.57 3.87 0.24 0.20 2.20 -1.26 -0.46 119.74 120.96 1itv s LYS 54 Ca -0.14 -0.38 0.08 0.00 -0.36 0.00 0.00 55.97 55.18 1itv s LYS 54 Cb 0.04 -3.40 -0.04 0.00 -1.51 0.00 0.00 37.83 32.92 1itv s LYS 54 CO 0.79 -0.03 0.06 -0.51 -0.36 0.00 0.00 175.35 175.30 1itv s LEU 55 N 1.24 3.41 -0.23 5.43 1.43 -1.26 -4.82 118.68 123.88 1itv s LEU 55 Ca 0.06 -0.47 0.08 0.00 -1.03 0.00 0.00 54.13 52.76 1itv s LEU 55 Cb -0.14 -1.96 -0.19 0.00 0.03 0.00 0.00 46.19 43.92 1itv s LEU 55 CO 0.05 0.01 -0.11 0.47 0.23 0.00 0.00 176.35 176.99 1itv n ASP 56 N -0.80 1.41 -3.60 2.29 10.43 0.25 -4.42 116.55 122.10 1itv n ASP 56 Ca -0.08 -0.08 -0.03 0.00 2.57 0.00 0.00 54.79 57.17 1itv n ASP 56 Cb 0.58 0.11 -0.01 0.00 1.84 0.00 0.00 41.12 43.64 1itv n ASP 56 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 1itv s SER 57 N -6.01 -0.14 -0.07 -2.24 1.04 -1.19 -4.64 113.70 100.45 1itv s SER 57 Ca -0.24 -0.07 -0.24 0.00 0.48 0.00 0.00 55.95 55.88 1itv s SER 57 Cb 0.07 0.20 0.05 0.00 0.10 0.00 0.00 66.02 66.44 1itv s SER 57 CO 0.65 -0.33 0.54 0.54 0.98 0.00 0.00 173.24 175.62 1itv s VAL 58 N -2.55 0.02 -0.00 5.02 0.11 -1.26 -0.99 120.40 120.75 1itv s VAL 58 Ca 0.11 -0.15 -0.18 0.00 -2.93 0.00 0.00 61.98 58.82 1itv s VAL 58 Cb 0.01 -0.84 0.03 0.00 -1.53 0.00 0.00 36.38 34.05 1itv s VAL 58 CO -0.04 -0.08 0.40 0.72 -3.33 0.00 0.00 175.10 172.76 1itv s PHE 59 N -0.97 -0.28 -0.29 1.54 -0.12 -0.74 -4.54 117.98 112.58 1itv s PHE 59 Ca -0.10 0.39 -0.14 0.00 -0.05 0.00 0.00 56.93 57.03 1itv s PHE 59 Cb -0.02 0.18 -0.03 0.00 -0.63 0.00 0.00 43.02 42.51 1itv s PHE 59 CO 0.07 -0.48 0.33 -2.00 -0.05 0.00 0.00 175.22 173.09 1itv s GLU 60 N -1.66 3.88 -0.12 1.99 2.12 -1.26 -0.97 118.70 122.69 1itv s GLU 60 Ca -0.11 -0.15 -0.29 0.00 0.36 0.00 0.00 54.97 54.78 1itv s GLU 60 Cb -0.03 -3.70 -0.05 0.00 0.26 0.00 0.00 34.13 30.62 1itv s GLU 60 CO 0.03 -0.32 1.70 -2.00 -0.54 0.00 0.00 175.26 174.13 1itv s GLU 61 N 2.00 3.97 0.26 4.30 -6.30 -0.26 -4.90 118.70 117.76 1itv s GLU 61 Ca 0.13 2.02 -0.04 0.00 -2.50 0.00 0.00 54.97 54.58 1itv s GLU 61 Cb -0.16 -4.04 0.55 0.00 0.00 0.00 0.00 34.13 30.47 1itv s GLU 61 CO 0.11 -1.10 1.63 -1.35 0.02 0.00 0.00 175.26 174.56 1itv h PRO 62 N 10.42 0.12 0.28 4.30 0.11 -1.96 0.47 132.00 145.75 1itv h PRO 62 Ca -0.38 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.71 1itv h PRO 62 Cb 1.18 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1itv h PRO 62 CO 0.97 0.08 -0.13 1.25 -0.21 0.00 0.00 178.00 179.96 1itv h LEU 63 N 0.13 -0.32 0.00 2.35 5.85 -1.99 -3.38 115.31 117.96 1itv h LEU 63 Ca 0.47 -0.12 -0.10 0.00 0.84 0.00 0.00 57.88 58.98 1itv h LEU 63 Cb 0.88 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.98 1itv h LEU 63 CO -0.69 0.17 -0.80 0.77 -0.34 0.00 0.00 178.44 177.55 1itv h SER 64 N -1.03 0.00 -0.14 1.25 4.64 -1.98 -3.47 113.55 112.81 1itv h SER 64 Ca -0.04 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.22 1itv h SER 64 Cb 0.42 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 1itv h SER 64 CO 0.06 0.38 -0.05 0.29 -0.87 0.00 0.00 176.83 176.64 1itv n LYS 65 N -3.02 -0.46 -1.50 4.77 4.76 0.16 -5.02 118.16 117.85 1itv n LYS 65 Ca -0.02 0.43 -0.31 0.00 -2.87 0.00 0.00 58.31 55.54 1itv n LYS 65 Cb 0.71 -4.01 0.06 0.00 -1.84 0.00 0.00 35.03 29.96 1itv n LYS 65 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1itv s LYS 66 N -1.55 2.66 -0.17 1.97 1.02 -1.25 -4.69 119.74 117.73 1itv s LYS 66 Ca 0.00 1.13 -0.02 0.00 0.02 0.00 0.00 55.97 57.09 1itv s LYS 66 Cb 0.00 -1.95 -0.02 0.00 -0.52 0.00 0.00 37.83 35.35 1itv s LYS 66 CO 0.00 -1.33 -0.07 -0.51 -0.92 0.00 0.00 175.35 172.52 1itv s LEU 67 N -5.52 2.93 -0.25 3.17 1.43 -0.13 -1.11 118.68 119.21 1itv s LEU 67 Ca 0.61 -0.29 -0.10 0.00 -1.03 0.00 0.00 54.13 53.32 1itv s LEU 67 Cb -0.16 -1.70 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 1itv s LEU 67 CO 0.52 0.10 0.16 -0.36 0.23 0.00 0.00 176.35 177.00 1itv s PHE 68 N 0.73 3.26 -0.11 0.29 0.08 -0.14 -0.33 117.98 121.76 1itv s PHE 68 Ca -0.03 0.13 0.01 0.00 0.12 0.00 0.00 56.93 57.16 1itv s PHE 68 Cb -0.15 -2.29 -0.02 0.00 -0.57 0.00 0.00 43.02 40.00 1itv s PHE 68 CO 0.02 -0.03 -0.15 -0.06 -0.10 0.00 0.00 175.22 174.90 1itv s PHE 69 N 1.28 2.75 -0.03 0.36 0.40 0.80 -1.80 117.98 121.74 1itv s PHE 69 Ca 0.07 -0.58 0.07 0.00 -0.60 0.00 0.00 56.93 55.89 1itv s PHE 69 Cb -0.14 -1.78 -0.02 0.00 0.51 0.00 0.00 43.02 41.59 1itv s PHE 69 CO 0.06 -0.15 -0.26 -0.06 0.70 0.00 0.00 175.22 175.52 1itv s PHE 70 N 0.11 2.35 -0.25 0.36 0.40 -0.16 -0.39 117.98 120.41 1itv s PHE 70 Ca -0.07 -0.53 -0.04 0.00 -0.60 0.00 0.00 56.93 55.69 1itv s PHE 70 Cb -0.15 -1.52 0.14 0.00 0.51 0.00 0.00 43.02 41.99 1itv s PHE 70 CO 0.05 -0.10 0.46 0.45 0.70 0.00 0.00 175.22 176.79 1itv s SER 71 N -0.47 -0.38 1.22 1.36 0.15 -0.64 -0.58 113.70 114.37 1itv s SER 71 Ca 0.06 0.69 0.00 0.00 0.70 0.00 0.00 55.95 57.39 1itv s SER 71 Cb -0.11 1.52 0.00 0.00 -1.71 0.00 0.00 66.02 65.72 1itv s SER 71 CO 0.00 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.79 1itv n GLY 72 N 5.39 3.03 1.41 9.45 0.00 -1.26 -1.71 105.19 121.50 1itv n GLY 72 Ca -0.05 -0.32 -0.02 0.00 0.00 0.00 0.00 46.02 45.63 1itv n GLY 72 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1itv n ARG 73 N 13.89 2.69 -4.30 1.61 1.74 -1.23 -4.24 116.66 126.82 1itv n ARG 73 Ca 0.00 -1.72 -0.24 0.00 -0.77 0.00 0.00 57.85 55.12 1itv n ARG 73 Cb 0.00 -1.84 -0.12 0.00 -1.02 0.00 0.00 32.46 29.48 1itv n ARG 73 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1itv s GLN 74 N -1.93 1.15 0.01 5.56 -0.21 -0.70 -1.65 119.66 121.89 1itv s GLN 74 Ca 0.31 -1.21 0.01 0.00 0.02 0.00 0.00 55.36 54.49 1itv s GLN 74 Cb 0.24 -1.38 -0.01 0.00 1.00 0.00 0.00 33.01 32.86 1itv s GLN 74 CO 0.08 0.32 -0.05 0.54 -2.12 0.00 0.00 175.29 174.06 1itv s VAL 75 N -1.31 0.34 -0.06 1.09 0.11 -0.19 -1.61 120.40 118.76 1itv s VAL 75 Ca 0.08 -0.36 0.05 0.00 -2.93 0.00 0.00 61.98 58.81 1itv s VAL 75 Cb -0.09 -0.32 -0.00 0.00 -1.53 0.00 0.00 36.38 34.43 1itv s VAL 75 CO 0.05 -0.02 -0.21 0.26 -3.33 0.00 0.00 175.10 171.84 1itv s TRP 76 N -0.39 2.10 -0.23 1.54 0.51 0.48 -2.23 118.94 120.73 1itv s TRP 76 Ca -0.01 -0.67 -0.00 0.00 -2.12 0.00 0.00 56.10 53.29 1itv s TRP 76 Cb -0.03 -1.40 0.03 0.00 -0.81 0.00 0.00 33.47 31.25 1itv s TRP 76 CO -0.00 -0.23 -0.11 0.08 -0.51 0.00 0.00 176.95 176.18 1itv s VAL 77 N 0.05 2.57 -0.17 4.03 1.01 -0.07 -0.14 120.40 127.68 1itv s VAL 77 Ca -0.07 -1.05 -0.07 0.00 0.00 0.00 0.00 61.98 60.79 1itv s VAL 77 Cb -0.14 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 1itv s VAL 77 CO 0.04 0.28 0.04 -0.31 0.00 0.00 0.00 175.10 175.15 1itv s TYR 78 N 1.29 3.22 -0.57 5.22 1.51 0.55 -0.18 117.35 128.38 1itv s TYR 78 Ca 0.01 0.02 0.04 0.00 -1.01 0.00 0.00 57.07 56.13 1itv s TYR 78 Cb -0.16 -2.04 0.14 0.00 -0.11 0.00 0.00 41.96 39.79 1itv s TYR 78 CO -0.07 0.15 0.33 0.95 -1.11 0.00 0.00 175.55 175.80 1itv s THR 79 N 0.29 2.61 0.00 -0.71 -4.23 0.13 -0.95 115.64 112.78 1itv s THR 79 Ca 0.02 -3.59 0.00 0.00 -1.18 0.00 0.00 61.69 56.95 1itv s THR 79 Cb -0.13 -2.78 0.00 0.00 1.34 0.00 0.00 72.50 70.94 1itv s THR 79 CO 0.01 -0.87 0.00 0.61 -0.54 0.00 0.00 174.62 173.82 1itv n GLY 80 N 2.76 2.50 0.08 3.99 0.00 -1.26 -1.77 105.19 111.50 1itv n GLY 80 Ca 0.10 -0.31 0.12 0.00 0.00 0.00 0.00 46.02 45.93 1itv n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1itv h ALA 81 N -0.44 0.63 -2.61 4.61 0.00 -1.95 -3.46 119.26 116.04 1itv h ALA 81 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.39 1itv h ALA 81 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1itv h ALA 81 CO 0.00 0.00 0.45 -1.12 0.00 0.00 0.00 179.25 178.58 1itv s SER 82 N -4.54 7.31 -0.03 0.00 0.01 -0.73 -5.04 113.70 110.68 1itv s SER 82 Ca 0.06 1.99 0.07 0.00 1.31 0.00 0.00 55.95 59.38 1itv s SER 82 Cb 0.12 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.74 1itv s SER 82 CO 0.72 -0.21 -0.25 0.54 0.41 0.00 0.00 173.24 174.45 1itv s VAL 83 N -0.00 2.12 -0.25 3.43 0.11 -1.26 -0.69 120.40 123.86 1itv s VAL 83 Ca 0.50 -1.07 0.02 0.00 -2.93 0.00 0.00 61.98 58.50 1itv s VAL 83 Cb -0.28 -1.75 0.05 0.00 -1.53 0.00 0.00 36.38 32.88 1itv s VAL 83 CO 0.33 0.58 -0.11 -0.22 -3.33 0.00 0.00 175.10 172.34 1itv s LEU 84 N -0.48 3.27 0.00 2.54 1.98 0.74 -4.99 118.68 121.75 1itv s LEU 84 Ca 0.06 -1.24 0.00 0.00 -2.89 0.00 0.00 54.13 50.06 1itv s LEU 84 Cb -0.11 -1.56 0.00 0.00 0.66 0.00 0.00 46.19 45.18 1itv s LEU 84 CO 0.01 -0.16 0.00 0.61 -1.89 0.00 0.00 176.35 174.91 1itv n GLY 85 N 4.49 0.63 3.78 7.98 0.00 -1.26 -0.89 105.19 119.92 1itv n GLY 85 Ca -0.15 -2.12 -0.33 0.00 0.00 0.00 0.00 46.02 43.42 1itv n GLY 85 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1itv s PRO 86 N -0.97 3.03 0.09 1.61 0.04 -1.26 -5.02 135.00 132.52 1itv s PRO 86 Ca 0.00 1.36 0.03 0.00 0.04 0.00 0.00 61.00 62.42 1itv s PRO 86 Cb 0.00 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.52 1itv s PRO 86 CO 0.00 -1.06 -0.08 1.03 0.04 0.00 0.00 177.00 176.93 1itv s ARG 87 N -3.99 0.80 0.58 4.56 0.52 -0.94 -4.96 118.95 115.51 1itv s ARG 87 Ca 0.67 -1.19 -0.15 0.00 -0.52 0.00 0.00 55.73 54.54 1itv s ARG 87 Cb -0.19 -0.34 -0.05 0.00 0.52 0.00 0.00 34.95 34.89 1itv s ARG 87 CO 0.38 0.03 1.03 1.03 0.02 0.00 0.00 175.30 177.79 1itv s ARG 88 N -3.13 3.53 0.65 3.54 3.00 -1.26 -1.02 118.95 124.26 1itv s ARG 88 Ca 0.06 1.04 0.42 0.00 0.00 0.00 0.00 55.73 57.26 1itv s ARG 88 Cb 0.00 -2.07 2.28 0.00 0.00 0.00 0.00 34.95 35.17 1itv s ARG 88 CO -0.02 -0.63 2.34 -0.07 0.00 0.00 0.00 175.30 176.92 1itv h LEU 89 N 0.41 0.00 -2.38 2.53 3.38 -1.65 -1.26 115.31 116.34 1itv h LEU 89 Ca -0.46 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.50 1itv h LEU 89 Cb 1.20 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 1itv h LEU 89 CO 0.59 0.00 -0.03 -2.24 0.09 0.00 0.00 178.44 176.86 1itv h ASP 90 N 0.00 0.00 0.79 -0.43 3.04 -1.87 -1.21 116.42 116.74 1itv h ASP 90 Ca -0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1itv h ASP 90 Cb 0.04 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.33 1itv h ASP 90 CO 0.00 0.03 0.00 0.11 -2.04 0.00 0.00 179.24 177.34 1itv h LYS 91 N 0.00 0.00 -0.38 4.15 1.79 -1.53 -1.73 116.57 118.87 1itv h LYS 91 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1itv h LYS 91 Cb 0.18 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.83 1itv h LYS 91 CO 0.00 0.00 0.00 1.28 -1.08 0.00 0.00 179.45 179.65 1itv n LEU 92 N -3.07 3.31 0.00 2.94 4.32 -0.47 -4.93 117.00 119.11 1itv n LEU 92 Ca -0.00 -1.42 0.00 0.00 -0.02 0.00 0.00 56.01 54.56 1itv n LEU 92 Cb 0.25 -0.24 0.00 0.00 -1.62 0.00 0.00 43.42 41.81 1itv n LEU 92 CO 0.25 0.71 0.00 0.61 -1.22 0.00 0.00 177.39 177.75 1itv n GLY 93 N 1.48 0.75 3.77 -0.72 0.00 -0.65 -0.44 105.19 109.38 1itv n GLY 93 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 1itv n GLY 93 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1itv s LEU 94 N 0.00 4.39 0.85 0.99 1.43 -1.16 -4.40 118.68 120.78 1itv s LEU 94 Ca 0.00 2.45 -0.10 0.00 -1.03 0.00 0.00 54.13 55.44 1itv s LEU 94 Cb 0.00 -3.77 0.11 0.00 0.03 0.00 0.00 46.19 42.56 1itv s LEU 94 CO 0.00 -0.46 1.12 -0.83 0.23 0.00 0.00 176.35 176.41 1itv s GLY 95 N -0.82 1.68 0.09 -3.19 0.00 -1.26 -3.98 107.32 99.83 1itv s GLY 95 Ca 0.50 0.43 0.14 0.00 0.00 0.00 0.00 44.72 45.79 1itv s GLY 95 CO 0.44 0.82 1.42 0.00 0.00 0.00 0.00 173.10 175.79 1itv n ALA 96 N -3.92 1.44 0.19 3.20 0.00 -1.26 -2.07 120.51 118.09 1itv n ALA 96 Ca 0.10 0.02 0.07 0.00 0.00 0.00 0.00 53.44 53.63 1itv n ALA 96 Cb 0.53 -1.22 0.24 0.00 0.00 0.00 0.00 19.45 18.99 1itv n ALA 96 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1itv n ASP 97 N -1.73 3.16 -4.49 0.00 3.85 -1.26 -4.81 116.55 111.27 1itv n ASP 97 Ca 0.02 -2.20 -0.43 0.00 -0.71 0.00 0.00 54.79 51.47 1itv n ASP 97 Cb 0.13 -0.43 -0.09 0.00 -1.35 0.00 0.00 41.12 39.38 1itv n ASP 97 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 1itv s VAL 98 N -1.61 5.11 0.20 2.12 1.01 -0.88 -4.93 120.40 121.42 1itv s VAL 98 Ca 0.34 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 62.01 1itv s VAL 98 Cb 0.21 -4.01 -0.08 0.00 0.00 0.00 0.00 36.38 32.49 1itv s VAL 98 CO 0.19 -0.39 1.48 0.00 0.00 0.00 0.00 175.10 176.38 1itv h ALA 99 N 8.70 0.70 -2.03 5.51 0.00 -1.90 -3.46 119.26 126.79 1itv h ALA 99 Ca -0.27 -0.60 0.23 0.00 0.00 0.00 0.00 54.91 54.28 1itv h ALA 99 Cb 1.11 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.74 1itv h ALA 99 CO 0.78 0.78 0.62 1.14 0.00 0.00 0.00 179.25 182.57 1itv s GLN 100 N -3.60 0.90 -0.26 0.00 0.00 -1.26 -3.56 119.66 111.89 1itv s GLN 100 Ca -0.04 -0.51 -0.04 0.00 -0.00 0.00 0.00 55.36 54.77 1itv s GLN 100 Cb 0.11 0.30 0.01 0.00 0.00 0.00 0.00 33.01 33.44 1itv s GLN 100 CO 0.82 -0.41 -0.02 0.08 0.00 0.00 0.00 175.29 175.76 1itv s VAL 101 N -2.88 3.30 -2.46 3.63 1.01 -1.26 -4.46 120.40 117.27 1itv s VAL 101 Ca 0.14 -0.81 0.26 0.00 0.00 0.00 0.00 61.98 61.57 1itv s VAL 101 Cb 0.01 -2.64 0.35 0.00 0.00 0.00 0.00 36.38 34.09 1itv s VAL 101 CO 0.00 0.21 1.52 0.35 0.00 0.00 0.00 175.10 177.18 1itv n THR 102 N 4.75 0.00 -1.57 3.92 -2.24 0.11 -3.81 114.28 115.45 1itv n THR 102 Ca -0.16 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 1itv n THR 102 Cb 0.48 0.83 0.00 0.00 -2.10 0.00 0.00 70.33 69.54 1itv n THR 102 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1itv n GLY 103 N 1.28 -2.13 3.50 3.38 0.00 -1.22 -1.42 105.19 108.58 1itv n GLY 103 Ca 0.15 -1.23 -0.13 0.00 0.00 0.00 0.00 46.02 44.81 1itv n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1itv s ALA 104 N -1.59 -1.77 -0.00 4.61 0.00 -0.88 -0.58 121.76 121.56 1itv s ALA 104 Ca 0.00 1.10 -0.10 0.00 0.00 0.00 0.00 51.96 52.96 1itv s ALA 104 Cb 0.00 0.17 0.01 0.00 0.00 0.00 0.00 23.12 23.30 1itv s ALA 104 CO 0.00 -0.52 0.19 -0.51 0.00 0.00 0.00 175.76 174.92 1itv s LEU 105 N -1.83 1.32 0.41 0.00 1.43 -0.73 -4.10 118.68 115.18 1itv s LEU 105 Ca -0.03 -0.11 -0.25 0.00 -1.03 0.00 0.00 54.13 52.71 1itv s LEU 105 Cb -0.01 0.87 -0.08 0.00 0.03 0.00 0.00 46.19 47.00 1itv s LEU 105 CO -0.01 -0.39 1.20 -0.13 0.23 0.00 0.00 176.35 177.25 1itv s ARG 106 N -1.36 4.01 0.00 1.70 0.52 -1.26 -0.39 118.95 122.17 1itv s ARG 106 Ca -0.14 1.92 0.00 0.00 -0.52 0.00 0.00 55.73 56.99 1itv s ARG 106 Cb -0.07 -2.68 0.00 0.00 0.52 0.00 0.00 34.95 32.72 1itv s ARG 106 CO 0.02 -0.38 0.00 0.45 0.02 0.00 0.00 175.30 175.41 1itv n SER 107 N 0.05 0.00 -3.12 0.23 2.88 -0.48 -4.77 113.62 108.41 1itv n SER 107 Ca 0.04 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.41 1itv n SER 107 Cb 0.46 0.00 0.14 0.00 -0.75 0.00 0.00 64.21 64.06 1itv n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1itv n GLY 108 N 5.00 -2.43 3.66 0.46 0.00 -1.26 -4.79 105.19 105.83 1itv n GLY 108 Ca 0.00 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.09 1itv n GLY 108 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1itv s ARG 109 N -4.49 4.15 0.00 1.61 6.06 -1.26 -1.30 118.95 123.72 1itv s ARG 109 Ca 0.42 2.49 0.00 0.00 -2.50 0.00 0.00 55.73 56.14 1itv s ARG 109 Cb -0.04 -4.04 0.00 0.00 0.06 0.00 0.00 34.95 30.93 1itv s ARG 109 CO 0.32 -0.91 0.00 0.41 -2.50 0.00 0.00 175.30 172.62 1itv n GLY 110 N 4.39 0.62 3.52 8.12 0.00 -1.26 -5.01 105.19 115.57 1itv n GLY 110 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 1itv n GLY 110 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1itv s LYS 111 N -0.19 1.98 0.06 1.61 -0.14 -0.42 -1.88 119.74 120.76 1itv s LYS 111 Ca 0.00 -1.08 0.03 0.00 -1.36 0.00 0.00 55.97 53.56 1itv s LYS 111 Cb 0.00 -2.21 -0.03 0.00 -1.68 0.00 0.00 37.83 33.91 1itv s LYS 111 CO 0.00 0.50 -0.08 1.41 -0.76 0.00 0.00 175.35 176.42 1itv s MET 112 N -2.06 0.62 -0.15 1.68 1.75 0.53 -1.39 119.30 120.29 1itv s MET 112 Ca 0.19 -0.89 -0.03 0.00 -1.25 0.00 0.00 55.69 53.71 1itv s MET 112 Cb -0.11 -0.35 -0.03 0.00 2.84 0.00 0.00 34.83 37.18 1itv s MET 112 CO 0.11 0.06 -0.05 -0.51 -0.65 0.00 0.00 175.02 173.97 1itv s LEU 113 N -1.86 3.17 -0.12 4.11 1.02 0.48 0.32 118.68 125.79 1itv s LEU 113 Ca -0.05 -0.15 -0.00 0.00 0.02 0.00 0.00 54.13 53.95 1itv s LEU 113 Cb -0.07 -1.75 -0.02 0.00 0.02 0.00 0.00 46.19 44.37 1itv s LEU 113 CO -0.00 0.18 -0.11 -0.76 0.02 0.00 0.00 176.35 175.68 1itv s LEU 114 N 0.28 2.83 0.10 1.79 1.43 -0.14 -1.77 118.68 123.20 1itv s LEU 114 Ca -0.04 -0.26 0.05 0.00 -1.03 0.00 0.00 54.13 52.85 1itv s LEU 114 Cb -0.14 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 1itv s LEU 114 CO 0.03 0.21 -0.00 -0.36 0.23 0.00 0.00 176.35 176.46 1itv s PHE 115 N 0.12 2.97 -0.44 0.29 0.40 0.26 -0.90 117.98 120.67 1itv s PHE 115 Ca -0.05 -0.04 0.05 0.00 -0.60 0.00 0.00 56.93 56.29 1itv s PHE 115 Cb -0.15 -1.52 0.17 0.00 0.51 0.00 0.00 43.02 42.04 1itv s PHE 115 CO 0.04 0.48 0.49 0.45 0.70 0.00 0.00 175.22 177.39 1itv s SER 116 N -2.39 0.27 1.66 1.36 0.15 -0.35 0.10 113.70 114.50 1itv s SER 116 Ca 0.26 -2.21 0.00 0.00 0.70 0.00 0.00 55.95 54.70 1itv s SER 116 Cb -0.11 0.67 0.00 0.00 -1.71 0.00 0.00 66.02 64.87 1itv s SER 116 CO 0.18 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.09 1itv n GLY 117 N 3.23 2.86 0.19 9.45 0.00 -1.26 -2.10 105.19 117.56 1itv n GLY 117 Ca 0.21 0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.38 1itv n GLY 117 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1itv h ARG 118 N 0.00 0.00 -6.31 1.61 3.08 -1.91 -3.42 114.38 107.42 1itv h ARG 118 Ca 0.00 0.00 -0.45 0.00 0.07 0.00 0.00 59.98 59.60 1itv h ARG 118 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1itv h ARG 118 CO 0.00 0.00 -0.35 1.03 -1.07 0.00 0.00 179.97 179.58 1itv s ARG 119 N -3.20 3.01 0.15 0.04 0.52 -0.89 -0.55 118.95 118.03 1itv s ARG 119 Ca 0.08 -1.10 -0.20 0.00 -0.52 0.00 0.00 55.73 53.99 1itv s ARG 119 Cb 0.07 -2.75 0.06 0.00 0.52 0.00 0.00 34.95 32.84 1itv s ARG 119 CO 0.65 0.02 0.52 -0.48 0.02 0.00 0.00 175.30 176.03 1itv s LEU 120 N -4.17 -0.19 0.10 2.53 0.05 -0.24 -1.21 118.68 115.55 1itv s LEU 120 Ca 0.46 -0.13 -0.05 0.00 0.05 0.00 0.00 54.13 54.45 1itv s LEU 120 Cb -0.09 2.30 -0.02 0.00 -2.05 0.00 0.00 46.19 46.33 1itv s LEU 120 CO 0.31 -0.93 0.11 0.26 -0.55 0.00 0.00 176.35 175.55 1itv s TRP 121 N -3.77 0.44 -0.11 3.48 0.51 -0.08 -1.32 118.94 118.09 1itv s TRP 121 Ca 0.02 -0.89 -0.19 0.00 -2.12 0.00 0.00 56.10 52.93 1itv s TRP 121 Cb 0.00 -0.24 -0.04 0.00 -0.81 0.00 0.00 33.47 32.38 1itv s TRP 121 CO -0.12 -0.52 0.49 1.03 -0.51 0.00 0.00 176.95 177.32 1itv s ARG 122 N -3.93 4.35 -0.14 4.98 0.52 -1.26 -0.97 118.95 122.50 1itv s ARG 122 Ca 0.11 0.48 0.02 0.00 -0.52 0.00 0.00 55.73 55.83 1itv s ARG 122 Cb 0.06 -3.44 0.01 0.00 0.52 0.00 0.00 34.95 32.11 1itv s ARG 122 CO -0.06 0.15 -0.21 0.12 0.02 0.00 0.00 175.30 175.32 1itv s PHE 123 N 0.63 2.59 -0.27 -0.53 5.36 0.15 -4.03 117.98 121.88 1itv s PHE 123 Ca 0.27 -1.32 -0.19 0.00 -0.96 0.00 0.00 56.93 54.73 1itv s PHE 123 Cb -0.15 -1.78 -0.02 0.00 -0.34 0.00 0.00 43.02 40.73 1itv s PHE 123 CO 0.11 -0.62 0.55 0.34 -1.46 0.00 0.00 175.22 174.14 1itv s ASP 124 N 0.88 6.45 0.10 6.13 2.15 -0.54 -0.35 116.67 131.49 1itv s ASP 124 Ca -0.06 0.50 -0.17 0.00 0.43 0.00 0.00 52.55 53.25 1itv s ASP 124 Cb -0.15 -2.29 -0.07 0.00 -0.30 0.00 0.00 42.92 40.11 1itv s ASP 124 CO -0.03 -0.34 1.49 1.62 -0.17 0.00 0.00 175.17 177.75 1itv h VAL 125 N 5.44 1.28 -0.21 1.11 3.04 -1.70 0.38 116.25 125.58 1itv h VAL 125 Ca -0.28 -1.11 0.04 0.00 -1.01 0.00 0.00 66.70 64.34 1itv h VAL 125 Cb 1.13 1.39 -0.04 0.00 -2.01 0.00 0.00 31.29 31.76 1itv h VAL 125 CO 0.74 0.35 -0.04 0.50 -1.01 0.00 0.00 177.57 178.12 1itv h LYS 126 N 0.34 0.02 0.00 4.17 3.64 -1.94 -2.50 116.57 120.30 1itv h LYS 126 Ca 0.08 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1itv h LYS 126 Cb 0.56 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1itv h LYS 126 CO 0.03 0.01 -0.46 0.00 -2.27 0.00 0.00 179.45 176.76 1itv n ALA 127 N -2.40 3.19 -3.74 5.00 0.00 -1.23 -4.95 120.51 116.39 1itv n ALA 127 Ca -0.02 -0.28 -0.26 0.00 0.00 0.00 0.00 53.44 52.88 1itv n ALA 127 Cb 0.13 -1.19 0.05 0.00 0.00 0.00 0.00 19.45 18.44 1itv n ALA 127 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1itv n GLN 128 N -1.68 -6.35 -4.14 0.00 1.13 0.13 -4.98 117.38 101.48 1itv n GLN 128 Ca 0.05 0.70 -0.17 0.00 -1.94 0.00 0.00 57.00 55.64 1itv n GLN 128 Cb 0.37 -5.61 -0.12 0.00 0.11 0.00 0.00 30.24 24.99 1itv n GLN 128 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 1itv s MET 129 N -6.33 0.74 -0.07 -1.09 -1.94 -0.96 -4.55 119.30 105.10 1itv s MET 129 Ca 0.49 -0.90 0.05 0.00 -1.71 0.00 0.00 55.69 53.62 1itv s MET 129 Cb -0.23 -0.68 -0.00 0.00 2.01 0.00 0.00 34.83 35.93 1itv s MET 129 CO 0.79 0.15 -0.23 0.08 -0.01 0.00 0.00 175.02 175.79 1itv s VAL 130 N -1.32 1.97 -0.28 -6.03 1.01 0.42 -1.47 120.40 114.70 1itv s VAL 130 Ca -0.04 -1.00 -0.16 0.00 0.00 0.00 0.00 61.98 60.78 1itv s VAL 130 Cb -0.10 -1.69 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 1itv s VAL 130 CO 0.02 0.55 0.41 -0.62 0.00 0.00 0.00 175.10 175.45 1itv s ASP 131 N 0.09 6.28 0.33 3.32 -1.08 -1.26 -4.46 116.67 119.89 1itv s ASP 131 Ca -0.10 0.24 0.17 0.00 -0.52 0.00 0.00 52.55 52.34 1itv s ASP 131 Cb -0.15 -2.23 0.93 0.00 -1.46 0.00 0.00 42.92 40.01 1itv s ASP 131 CO 0.06 -0.25 1.46 -0.81 0.52 0.00 0.00 175.17 176.15 1itv n PRO 132 N 5.41 0.11 0.04 4.34 -0.04 -1.26 -0.38 135.00 143.22 1itv n PRO 132 Ca -0.07 0.60 0.13 0.00 -0.04 0.00 0.00 63.50 64.12 1itv n PRO 132 Cb 0.50 -2.05 0.48 0.00 -0.04 0.00 0.00 33.50 32.39 1itv n PRO 132 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1itv n ARG 133 N -2.15 0.10 -0.07 0.54 1.74 -1.26 -3.18 116.66 112.38 1itv n ARG 133 Ca -0.01 0.07 0.06 0.00 -0.77 0.00 0.00 57.85 57.21 1itv n ARG 133 Cb 0.20 -1.61 0.27 0.00 -1.02 0.00 0.00 32.46 30.31 1itv n ARG 133 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1itv n SER 134 N -1.78 0.91 -4.65 0.55 3.41 0.48 -4.92 113.62 107.63 1itv n SER 134 Ca 0.06 -1.78 -0.47 0.00 -0.26 0.00 0.00 58.87 56.42 1itv n SER 134 Cb 0.38 -0.09 -0.04 0.00 -0.26 0.00 0.00 64.21 64.20 1itv n SER 134 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1itv n ALA 135 N -0.09 0.75 -2.39 7.33 0.00 -1.19 -4.28 120.51 120.64 1itv n ALA 135 Ca 0.11 0.45 -0.08 0.00 0.00 0.00 0.00 53.44 53.91 1itv n ALA 135 Cb 0.18 -2.26 -0.09 0.00 0.00 0.00 0.00 19.45 17.28 1itv n ALA 135 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1itv s SER 136 N 0.60 0.30 -0.20 0.00 0.15 -0.43 -5.00 113.70 109.11 1itv s SER 136 Ca 0.76 -0.78 -0.11 0.00 0.70 0.00 0.00 55.95 56.52 1itv s SER 136 Cb -0.73 0.25 -0.05 0.00 -1.71 0.00 0.00 66.02 63.78 1itv s SER 136 CO 0.44 -0.62 0.18 -1.61 1.20 0.00 0.00 173.24 172.83 1itv s GLU 137 N -3.58 4.18 0.43 5.44 2.02 -1.26 -1.08 118.70 124.85 1itv s GLU 137 Ca 0.03 -0.15 0.12 0.00 0.02 0.00 0.00 54.97 54.99 1itv s GLU 137 Cb 0.05 -3.45 0.98 0.00 0.10 0.00 0.00 34.13 31.81 1itv s GLU 137 CO -0.09 0.22 2.02 0.28 0.02 0.00 0.00 175.26 177.71 1itv h VAL 138 N 4.77 0.98 -0.77 2.63 2.07 -1.11 -2.10 116.25 122.72 1itv h VAL 138 Ca -0.40 -0.15 0.08 0.00 0.82 0.00 0.00 66.70 67.05 1itv h VAL 138 Cb 1.16 0.50 -0.07 0.00 -1.52 0.00 0.00 31.29 31.36 1itv h VAL 138 CO 0.74 0.08 0.43 -0.78 0.02 0.00 0.00 177.57 178.06 1itv h ASP 139 N 0.44 0.62 0.52 0.57 3.58 -1.84 0.35 116.42 120.67 1itv h ASP 139 Ca 0.21 0.04 -0.29 0.00 0.42 0.00 0.00 57.03 57.41 1itv h ASP 139 Cb 0.29 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.26 1itv h ASP 139 CO -0.06 0.37 -1.46 0.08 -2.88 0.00 0.00 179.24 175.29 1itv h ARG 140 N 0.75 0.21 0.07 0.28 0.11 -1.78 -3.28 114.38 110.74 1itv h ARG 140 Ca 0.36 -0.36 -0.24 0.00 0.10 0.00 0.00 59.98 59.83 1itv h ARG 140 Cb 0.30 0.14 -0.00 0.00 1.11 0.00 0.00 29.97 31.51 1itv h ARG 140 CO -0.23 1.08 -1.10 1.98 0.10 0.00 0.00 179.97 181.80 1itv h MET 141 N 0.06 0.23 -2.29 0.08 4.05 -1.26 -3.38 114.93 112.42 1itv h MET 141 Ca -0.21 -0.35 -0.60 0.00 -0.28 0.00 0.00 59.70 58.27 1itv h MET 141 Cb 1.99 0.12 -0.41 0.00 -0.80 0.00 0.00 31.60 32.49 1itv h MET 141 CO 0.16 1.12 -0.67 1.19 0.23 0.00 0.00 176.91 178.94 1itv n PHE 142 N -3.56 2.96 -1.98 1.39 3.01 0.12 -4.51 117.46 114.90 1itv n PHE 142 Ca -0.06 -4.08 -0.37 0.00 1.01 0.00 0.00 57.45 53.95 1itv n PHE 142 Cb 0.95 -0.52 0.03 0.00 -0.01 0.00 0.00 39.48 39.92 1itv n PHE 142 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1itv s PRO 143 N -2.11 3.21 0.00 -1.08 0.04 -1.24 -2.92 135.00 130.90 1itv s PRO 143 Ca 0.37 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.39 1itv s PRO 143 Cb 0.12 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.50 1itv s PRO 143 CO -0.05 -1.05 0.00 0.41 0.04 0.00 0.00 177.00 176.34 1itv n GLY 144 N 0.60 0.76 3.91 0.56 0.00 -1.26 -4.33 105.19 105.42 1itv n GLY 144 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 1itv n GLY 144 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1itv s VAL 145 N -2.40 5.35 0.59 1.61 1.01 -1.15 -4.91 120.40 120.51 1itv s VAL 145 Ca 0.00 -0.23 -0.20 0.00 0.00 0.00 0.00 61.98 61.55 1itv s VAL 145 Cb 0.00 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.74 1itv s VAL 145 CO 0.00 0.16 1.29 -2.16 0.00 0.00 0.00 175.10 174.40 1itv s PRO 146 N -2.40 2.90 0.14 2.72 0.04 -1.26 -4.94 135.00 132.20 1itv s PRO 146 Ca 0.34 2.07 -0.17 0.00 0.04 0.00 0.00 61.00 63.28 1itv s PRO 146 Cb -0.13 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.39 1itv s PRO 146 CO 0.25 -1.33 1.77 -0.07 0.04 0.00 0.00 177.00 177.66 1itv h LEU 147 N 1.01 0.23 -7.61 -3.56 3.38 -1.98 -3.37 115.31 103.40 1itv h LEU 147 Ca -0.51 0.02 -0.69 0.00 0.09 0.00 0.00 57.88 56.79 1itv h LEU 147 Cb 1.31 -0.03 -0.35 0.00 0.09 0.00 0.00 40.66 41.68 1itv h LEU 147 CO 0.55 0.17 -0.42 -1.81 0.09 0.00 0.00 178.44 177.02 1itv s ASP 148 N -5.40 5.18 -0.10 -0.43 1.01 -1.26 -4.25 116.67 111.42 1itv s ASP 148 Ca -0.13 -2.67 -0.08 0.00 0.71 0.00 0.00 52.55 50.38 1itv s ASP 148 Cb 0.11 -1.83 -0.04 0.00 1.01 0.00 0.00 42.92 42.16 1itv s ASP 148 CO 0.71 -0.40 0.18 0.42 0.21 0.00 0.00 175.17 176.28 1itv s THR 149 N 0.20 5.45 -2.03 -1.27 -4.23 -1.26 -4.82 115.64 107.67 1itv s THR 149 Ca 0.15 0.29 0.24 0.00 -1.18 0.00 0.00 61.69 61.19 1itv s THR 149 Cb -0.21 -3.44 0.11 0.00 1.34 0.00 0.00 72.50 70.30 1itv s THR 149 CO -0.03 0.61 1.27 0.00 -0.54 0.00 0.00 174.62 175.93 1itv n HIS 150 N 1.96 0.00 -3.63 3.99 1.44 -0.23 -4.44 115.22 114.29 1itv n HIS 150 Ca -0.19 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.40 1itv n HIS 150 Cb 0.55 -0.04 -0.07 0.00 0.12 0.00 0.00 29.99 30.55 1itv n HIS 150 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1itv s ASP 151 N -2.44 -0.69 -0.05 4.39 3.68 -1.23 -4.84 116.67 115.49 1itv s ASP 151 Ca 0.22 1.29 -0.01 0.00 2.13 0.00 0.00 52.55 56.17 1itv s ASP 151 Cb 0.19 1.30 0.03 0.00 -1.45 0.00 0.00 42.92 42.99 1itv s ASP 151 CO 0.53 -0.22 0.03 -0.69 0.13 0.00 0.00 175.17 174.95 1itv s VAL 152 N 0.56 0.12 0.14 1.11 1.01 -0.51 0.05 120.40 122.88 1itv s VAL 152 Ca -0.01 0.24 -0.13 0.00 0.00 0.00 0.00 61.98 62.08 1itv s VAL 152 Cb -0.05 -0.30 0.01 0.00 0.00 0.00 0.00 36.38 36.04 1itv s VAL 152 CO -0.04 0.20 0.34 0.72 0.00 0.00 0.00 175.10 176.31 1itv s PHE 153 N 1.80 0.05 0.01 5.22 -0.71 -0.55 -2.06 117.98 121.74 1itv s PHE 153 Ca 0.01 -0.41 -0.01 0.00 -1.04 0.00 0.00 56.93 55.48 1itv s PHE 153 Cb -0.12 0.13 -0.04 0.00 -1.21 0.00 0.00 43.02 41.77 1itv s PHE 153 CO -0.03 -0.71 0.17 -1.14 -1.34 0.00 0.00 175.22 172.17 1itv s GLN 154 N -3.87 3.34 -0.27 1.99 0.74 -1.26 -0.49 119.66 119.85 1itv s GLN 154 Ca 0.08 -0.40 -0.11 0.00 0.05 0.00 0.00 55.36 54.98 1itv s GLN 154 Cb 0.02 -3.02 0.11 0.00 1.10 0.00 0.00 33.01 31.22 1itv s GLN 154 CO -0.07 0.65 0.60 0.12 -0.55 0.00 0.00 175.29 176.04 1itv s PHE 155 N -1.35 -1.15 -1.35 1.67 5.36 0.78 -4.30 117.98 117.64 1itv s PHE 155 Ca 0.29 2.10 -0.06 0.00 -0.96 0.00 0.00 56.93 58.29 1itv s PHE 155 Cb -0.13 0.66 0.02 0.00 -0.34 0.00 0.00 43.02 43.23 1itv s PHE 155 CO 0.20 -0.59 1.00 0.54 -1.46 0.00 0.00 175.22 174.92 1itv n ARG 156 N 5.14 -6.51 -1.52 10.12 1.74 -1.26 -1.19 116.66 123.17 1itv n ARG 156 Ca -0.14 0.74 -0.18 0.00 -0.77 0.00 0.00 57.85 57.50 1itv n ARG 156 Cb 0.52 -5.66 -0.08 0.00 -1.02 0.00 0.00 32.46 26.22 1itv n ARG 156 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1itv n GLU 157 N -4.59 -1.33 -4.30 5.56 4.71 -1.26 -4.98 120.64 114.45 1itv n GLU 157 Ca -0.11 1.13 -0.24 0.00 -0.01 0.00 0.00 57.16 57.93 1itv n GLU 157 Cb 0.60 -5.43 -0.12 0.00 -1.01 0.00 0.00 31.44 25.48 1itv n GLU 157 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 1itv s LYS 158 N -3.51 1.17 -0.18 3.49 1.02 -0.33 -4.91 119.74 116.50 1itv s LYS 158 Ca 0.00 -1.22 -0.10 0.00 0.02 0.00 0.00 55.97 54.67 1itv s LYS 158 Cb 0.00 -1.42 -0.05 0.00 -0.52 0.00 0.00 37.83 35.84 1itv s LYS 158 CO 0.00 0.32 0.16 0.00 -0.92 0.00 0.00 175.35 174.92 1itv s ALA 159 N -1.31 3.70 -0.16 5.17 0.00 -0.87 -0.15 121.76 128.14 1itv s ALA 159 Ca 0.09 -0.64 0.02 0.00 0.00 0.00 0.00 51.96 51.43 1itv s ALA 159 Cb -0.09 -2.18 0.02 0.00 0.00 0.00 0.00 23.12 20.86 1itv s ALA 159 CO 0.05 0.22 -0.21 0.71 0.00 0.00 0.00 175.76 176.53 1itv s TYR 160 N 0.15 2.72 -0.20 0.00 1.51 0.36 -0.22 117.35 121.67 1itv s TYR 160 Ca 0.11 -1.51 -0.05 0.00 -1.01 0.00 0.00 57.07 54.61 1itv s TYR 160 Cb -0.12 -1.86 -0.03 0.00 -0.11 0.00 0.00 41.96 39.84 1itv s TYR 160 CO 0.00 -0.72 0.01 -0.06 -1.11 0.00 0.00 175.55 173.67 1itv s PHE 161 N 1.09 3.07 0.00 2.71 0.40 -0.63 -1.48 117.98 123.14 1itv s PHE 161 Ca -0.00 -0.36 0.03 0.00 -0.60 0.00 0.00 56.93 56.00 1itv s PHE 161 Cb -0.14 -2.08 -0.03 0.00 0.51 0.00 0.00 43.02 41.28 1itv s PHE 161 CO -0.08 -0.16 -0.06 0.00 0.70 0.00 0.00 175.22 175.61 1itv s GLN 163 N -1.42 0.29 4.74 0.00 0.74 -0.84 -1.07 119.66 122.09 1itv s GLN 163 Ca 0.17 0.46 0.00 0.00 0.05 0.00 0.00 55.36 56.05 1itv s GLN 163 Cb -0.11 0.05 0.00 0.00 1.10 0.00 0.00 33.01 34.05 1itv s GLN 163 CO 0.08 -0.09 0.00 -3.47 -0.55 0.00 0.00 175.29 171.26 1itv n ASP 164 N 3.46 0.00 -1.27 6.67 2.03 -1.26 -1.04 116.55 125.13 1itv n ASP 164 Ca -0.18 0.00 0.12 0.00 0.52 0.00 0.00 54.79 55.25 1itv n ASP 164 Cb 0.56 0.00 0.29 0.00 -0.72 0.00 0.00 41.12 41.25 1itv n ASP 164 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 1itv n ARG 165 N 14.00 2.61 -3.46 -0.67 1.85 -1.25 -4.62 116.66 125.12 1itv n ARG 165 Ca 0.00 -2.49 -0.20 0.00 -1.00 0.00 0.00 57.85 54.16 1itv n ARG 165 Cb 0.00 -1.54 -0.02 0.00 -1.05 0.00 0.00 32.46 29.85 1itv n ARG 165 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1itv s PHE 166 N -1.18 2.58 0.03 2.89 0.40 -0.21 -2.47 117.98 120.02 1itv s PHE 166 Ca 0.45 -0.51 0.01 0.00 -0.60 0.00 0.00 56.93 56.28 1itv s PHE 166 Cb 0.24 -2.19 -0.02 0.00 0.51 0.00 0.00 43.02 41.56 1itv s PHE 166 CO 0.32 -0.26 -0.05 1.52 0.70 0.00 0.00 175.22 177.46 1itv s TYR 167 N -2.48 0.40 -0.27 0.36 -0.85 -0.47 -1.99 117.35 112.05 1itv s TYR 167 Ca 0.49 -0.50 0.03 0.00 -0.52 0.00 0.00 57.07 56.57 1itv s TYR 167 Cb -0.04 -0.26 0.06 0.00 0.38 0.00 0.00 41.96 42.09 1itv s TYR 167 CO 0.29 -0.15 -0.10 -1.58 -1.52 0.00 0.00 175.55 172.50 1itv s TRP 168 N -1.38 3.28 0.14 -3.49 0.51 0.12 -2.63 118.94 115.48 1itv s TRP 168 Ca -0.13 -2.31 -0.20 0.00 -2.12 0.00 0.00 56.10 51.34 1itv s TRP 168 Cb -0.10 -1.97 -0.07 0.00 -0.81 0.00 0.00 33.47 30.52 1itv s TRP 168 CO -0.00 -0.88 0.65 0.50 -0.51 0.00 0.00 176.95 176.71 1itv s ARG 169 N 1.11 4.27 -0.03 4.98 3.52 0.76 -1.60 118.95 131.96 1itv s ARG 169 Ca -0.08 0.84 0.01 0.00 -0.13 0.00 0.00 55.73 56.37 1itv s ARG 169 Cb -0.20 -3.13 0.01 0.00 -1.56 0.00 0.00 34.95 30.08 1itv s ARG 169 CO -0.05 0.55 -0.05 0.08 -0.81 0.00 0.00 175.30 175.02 1itv s VAL 170 N -1.25 0.56 0.13 7.11 1.01 0.69 -1.54 120.40 127.11 1itv s VAL 170 Ca 0.35 -0.18 0.10 0.00 0.00 0.00 0.00 61.98 62.24 1itv s VAL 170 Cb -0.19 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.60 1itv s VAL 170 CO 0.21 0.21 -0.20 -0.44 0.00 0.00 0.00 175.10 174.88 1itv s SER 171 N 0.61 3.72 0.03 3.32 0.01 -1.21 -2.04 113.70 118.14 1itv s SER 171 Ca -0.08 -0.65 -0.16 0.00 1.31 0.00 0.00 55.95 56.37 1itv s SER 171 Cb -0.12 -0.44 -0.06 0.00 0.21 0.00 0.00 66.02 65.61 1itv s SER 171 CO 0.00 0.17 0.46 -0.94 0.41 0.00 0.00 173.24 173.33 1itv s SER 172 N -2.24 6.87 -0.29 2.44 1.04 -1.26 -3.89 113.70 116.37 1itv s SER 172 Ca 0.18 1.04 -0.25 0.00 0.48 0.00 0.00 55.95 57.40 1itv s SER 172 Cb -0.10 -2.28 0.16 0.00 0.10 0.00 0.00 66.02 63.90 1itv s SER 172 CO 0.09 0.30 1.27 0.00 0.98 0.00 0.00 173.24 175.88 1itv s ARG 173 N -1.16 0.24 -1.37 4.02 1.70 -1.26 -4.95 118.95 116.19 1itv s ARG 173 Ca 0.26 0.27 0.00 0.00 -0.47 0.00 0.00 55.73 55.79 1itv s ARG 173 Cb -0.17 0.12 0.00 0.00 -0.57 0.00 0.00 34.95 34.33 1itv s ARG 173 CO 0.15 -0.03 0.00 0.43 -1.08 0.00 0.00 175.30 174.77 1itv n SER 174 N 1.76 -4.40 0.00 -2.89 7.64 -1.26 -0.78 113.62 113.69 1itv n SER 174 Ca -0.11 0.19 0.00 0.00 1.01 0.00 0.00 58.87 59.96 1itv n SER 174 Cb 0.57 -3.79 0.00 0.00 -1.01 0.00 0.00 64.21 59.98 1itv n SER 174 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1itv n GLU 175 N -2.65 -1.45 -3.93 1.43 -0.58 -1.26 -4.91 120.64 107.30 1itv n GLU 175 Ca -0.17 0.33 -0.35 0.00 -0.42 0.00 0.00 57.16 56.55 1itv n GLU 175 Cb 0.60 -4.59 -0.14 0.00 -0.57 0.00 0.00 31.44 26.74 1itv n GLU 175 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1itv s LEU 176 N 0.00 3.06 0.29 -4.62 1.43 0.04 -5.10 118.68 113.79 1itv s LEU 176 Ca 0.00 -0.64 -0.28 0.00 -1.03 0.00 0.00 54.13 52.18 1itv s LEU 176 Cb 0.00 -1.71 -0.09 0.00 0.03 0.00 0.00 46.19 44.42 1itv s LEU 176 CO 0.00 -0.08 1.04 0.20 0.23 0.00 0.00 176.35 177.74 1itv s ASN 177 N 1.41 7.28 -0.07 2.29 0.02 -1.26 -3.99 114.94 120.62 1itv s ASN 177 Ca 0.03 2.13 -0.13 0.00 -1.02 0.00 0.00 52.86 53.88 1itv s ASN 177 Cb -0.15 -2.61 0.03 0.00 0.02 0.00 0.00 41.25 38.53 1itv s ASN 177 CO -0.04 -0.12 0.31 -1.58 0.02 0.00 0.00 177.10 175.69 1itv s GLN 178 N -1.59 0.51 -0.18 -0.60 0.74 -1.25 -4.55 119.66 112.74 1itv s GLN 178 Ca 0.46 0.15 -0.29 0.00 0.05 0.00 0.00 55.36 55.73 1itv s GLN 178 Cb -0.28 0.23 -0.00 0.00 1.10 0.00 0.00 33.01 34.06 1itv s GLN 178 CO 0.36 -0.11 1.10 0.08 -0.55 0.00 0.00 175.29 176.17 1itv s VAL 179 N -0.51 4.57 -0.93 1.34 1.01 -1.26 -3.35 120.40 121.25 1itv s VAL 179 Ca -0.06 1.88 0.09 0.00 0.00 0.00 0.00 61.98 63.88 1itv s VAL 179 Cb -0.04 -4.21 0.14 0.00 0.00 0.00 0.00 36.38 32.27 1itv s VAL 179 CO 0.02 -0.12 0.95 -0.90 0.00 0.00 0.00 175.10 175.05 1itv n ASP 180 N 6.05 2.14 -3.63 3.32 3.85 -0.59 -5.01 116.55 122.68 1itv n ASP 180 Ca 0.12 -1.63 -0.08 0.00 -0.71 0.00 0.00 54.79 52.49 1itv n ASP 180 Cb 0.46 -0.08 -0.07 0.00 -1.35 0.00 0.00 41.12 40.09 1itv n ASP 180 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.20 174.61 1itv s GLN 181 N -0.84 0.45 -0.05 0.11 0.74 -1.24 -5.01 119.66 113.81 1itv s GLN 181 Ca 0.13 0.43 -0.03 0.00 0.05 0.00 0.00 55.36 55.95 1itv s GLN 181 Cb 0.08 0.22 0.03 0.00 1.10 0.00 0.00 33.01 34.44 1itv s GLN 181 CO 0.11 -0.07 0.11 0.08 -0.55 0.00 0.00 175.29 174.97 1itv s VAL 182 N -0.07 -0.04 0.00 1.34 1.01 -1.26 -0.17 120.40 121.21 1itv s VAL 182 Ca 0.03 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.14 1itv s VAL 182 Cb -0.04 -0.19 0.00 0.00 0.00 0.00 0.00 36.38 36.15 1itv s VAL 182 CO -0.06 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.70 1itv n GLY 183 N 3.85 1.25 3.75 4.51 0.00 -1.08 -4.99 105.19 112.48 1itv n GLY 183 Ca -0.23 -0.86 -0.40 0.00 0.00 0.00 0.00 46.02 44.54 1itv n GLY 183 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1itv s TYR 184 N -4.84 3.75 0.32 1.61 1.51 -1.26 -1.37 117.35 117.07 1itv s TYR 184 Ca 0.00 1.45 0.05 0.00 -1.01 0.00 0.00 57.07 57.56 1itv s TYR 184 Cb 0.00 -2.78 0.56 0.00 -0.11 0.00 0.00 41.96 39.63 1itv s TYR 184 CO 0.00 0.32 1.82 0.28 -1.11 0.00 0.00 175.55 176.86 1itv h VAL 185 N 4.02 1.22 0.09 0.71 2.07 -1.79 -1.26 116.25 121.32 1itv h VAL 185 Ca -0.45 -0.98 -0.00 0.00 0.82 0.00 0.00 66.70 66.09 1itv h VAL 185 Cb 1.20 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 32.13 1itv h VAL 185 CO 0.70 0.32 -0.04 0.71 0.02 0.00 0.00 177.57 179.28 1itv h THR 186 N 0.42 1.13 0.49 2.57 1.35 -1.82 -2.58 112.91 114.47 1itv h THR 186 Ca 0.08 -1.34 -0.02 0.00 -0.55 0.00 0.00 66.41 64.57 1itv h THR 186 Cb 0.47 1.92 0.00 0.00 -1.73 0.00 0.00 68.15 68.82 1itv h THR 186 CO 0.03 0.30 -0.23 1.88 -0.25 0.00 0.00 175.52 177.25 1itv h TYR 187 N -0.80 -0.60 0.25 4.73 0.99 -1.74 0.20 116.97 120.00 1itv h TYR 187 Ca -0.01 -0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.69 1itv h TYR 187 Cb 0.59 0.20 0.00 0.00 1.00 0.00 0.00 36.73 38.52 1itv h TYR 187 CO 0.12 -0.28 -0.12 -0.44 -0.00 0.00 0.00 178.16 177.43 1itv h ASP 188 N -0.90 -0.29 -3.75 3.88 3.45 -1.41 -3.20 116.42 114.20 1itv h ASP 188 Ca -0.07 0.01 -0.49 0.00 0.43 0.00 0.00 57.03 56.91 1itv h ASP 188 Cb 0.59 0.07 -0.01 0.00 -0.56 0.00 0.00 39.33 39.43 1itv h ASP 188 CO 0.11 -0.12 0.13 -0.63 -1.57 0.00 0.00 179.24 177.16 1itv s ILE 189 N -3.00 4.72 0.00 0.35 1.01 -0.97 -3.57 121.20 119.74 1itv s ILE 189 Ca -0.05 0.80 0.00 0.00 0.00 0.00 0.00 60.65 61.40 1itv s ILE 189 Cb 0.00 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.80 1itv s ILE 189 CO 0.15 -0.39 0.00 0.18 0.00 0.00 0.00 174.94 174.88 1itv n LEU 190 N -0.93 0.00 -3.16 2.97 4.32 -1.25 -3.73 117.00 115.22 1itv n LEU 190 Ca 0.03 0.00 -0.23 0.00 -0.02 0.00 0.00 56.01 55.79 1itv n LEU 190 Cb 0.54 0.00 0.03 0.00 -1.62 0.00 0.00 43.42 42.37 1itv n LEU 190 CO 0.45 0.00 0.02 0.00 -1.22 0.00 0.00 177.39 176.63 1itv n GLN 191 N -1.40 -4.94 -2.16 3.23 6.02 -1.06 -4.69 117.38 112.37 1itv n GLN 191 Ca 0.00 0.82 -0.37 0.00 -0.01 0.00 0.00 57.00 57.44 1itv n GLN 191 Cb 0.00 -5.68 0.00 0.00 1.02 0.00 0.00 30.24 25.59 1itv n GLN 191 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1itv s PRO 193 N -2.77 4.32 0.70 0.00 0.04 -1.26 -4.34 135.00 131.69 1itv s PRO 193 Ca 0.66 2.25 -0.14 0.00 0.04 0.00 0.00 61.00 63.80 1itv s PRO 193 Cb -0.31 -3.08 0.02 0.00 0.04 0.00 0.00 34.50 31.18 1itv s PRO 193 CO 0.37 -0.26 1.14 -1.21 0.04 0.00 0.00 177.00 177.08 1itv s GLU 194 N -1.46 2.50 0.00 4.56 2.02 -1.26 -4.95 118.70 120.11 1itv s GLU 194 Ca 0.52 1.49 0.00 0.00 0.02 0.00 0.00 54.97 56.99 1itv s GLU 194 Cb -0.40 -1.90 0.00 0.00 0.10 0.00 0.00 34.13 31.92 1itv s GLU 194 CO 0.51 -1.50 0.00 -0.25 0.02 0.00 0.00 175.26 174.04