#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l99 s ASN 2 N 0.00 1.49 0.31 6.12 2.20 -1.26 -5.05 114.94 118.75 1l99 s ASN 2 Ca 0.00 -1.37 0.05 0.00 -0.94 0.00 0.00 52.86 50.60 1l99 s ASN 2 Cb 0.00 0.10 0.67 0.00 -2.00 0.00 0.00 41.25 40.02 1l99 s ASN 2 CO 0.00 -0.68 1.84 -0.29 -2.94 0.00 0.00 177.10 175.02 1l99 h ILE 3 N 2.34 0.85 -0.37 0.54 6.09 -1.98 -0.65 117.51 124.34 1l99 h ILE 3 Ca -0.39 -0.30 -0.12 0.00 -1.37 0.00 0.00 64.86 62.68 1l99 h ILE 3 Cb 1.24 -0.08 -0.01 0.00 0.47 0.00 0.00 36.82 38.44 1l99 h ILE 3 CO 0.63 0.16 -0.26 -0.26 -3.07 0.00 0.00 178.15 175.35 1l99 h PHE 4 N 0.86 0.96 -0.12 2.19 0.04 -1.99 -1.94 116.94 116.94 1l99 h PHE 4 Ca 0.50 -0.26 -0.11 0.00 2.80 0.00 0.00 57.97 60.89 1l99 h PHE 4 Cb 0.64 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.56 1l99 h PHE 4 CO -0.00 1.04 -0.42 0.93 -0.60 0.00 0.00 178.31 179.25 1l99 h GLU 5 N 0.61 0.27 -0.56 1.51 5.08 -1.83 -2.09 114.58 117.57 1l99 h GLU 5 Ca 0.07 -0.13 -0.10 0.00 -1.00 0.00 0.00 59.36 58.20 1l99 h GLU 5 Cb 0.82 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.05 1l99 h GLU 5 CO 0.07 0.65 -0.03 1.98 -1.00 0.00 0.00 179.01 180.68 1l99 h MET 6 N 0.23 1.02 0.03 2.33 4.05 -1.01 -2.45 114.93 119.13 1l99 h MET 6 Ca 0.02 -0.34 -0.23 0.00 -0.28 0.00 0.00 59.70 58.87 1l99 h MET 6 Cb 0.84 -0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.56 1l99 h MET 6 CO 0.07 1.02 -1.00 -0.07 0.23 0.00 0.00 176.91 177.16 1l99 h LEU 7 N 0.90 0.50 -1.33 3.39 3.38 -1.32 -2.17 115.31 118.65 1l99 h LEU 7 Ca 0.16 -0.42 0.06 0.00 0.09 0.00 0.00 57.88 57.76 1l99 h LEU 7 Cb 0.58 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 1l99 h LEU 7 CO 0.03 1.24 0.49 -0.09 0.09 0.00 0.00 178.44 180.20 1l99 h ARG 8 N 0.19 0.80 -0.30 1.13 9.65 -1.33 0.08 114.38 124.60 1l99 h ARG 8 Ca -0.09 -0.05 -0.14 0.00 -1.10 0.00 0.00 59.98 58.61 1l99 h ARG 8 Cb 1.65 -0.18 -0.00 0.00 -1.39 0.00 0.00 29.97 30.05 1l99 h ARG 8 CO 0.17 0.53 -0.35 0.82 2.80 0.00 0.00 179.97 183.94 1l99 h ILE 9 N 0.82 1.30 0.00 1.20 2.04 -1.33 -2.14 117.51 119.40 1l99 h ILE 9 Ca 0.32 -1.53 -0.05 0.00 1.00 0.00 0.00 64.86 64.60 1l99 h ILE 9 Cb 0.21 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 1l99 h ILE 9 CO -0.10 0.49 -0.27 0.44 0.00 0.00 0.00 178.15 178.70 1l99 h ASP 10 N 0.51 0.00 0.00 1.72 3.32 -0.58 -3.35 116.42 118.04 1l99 h ASP 10 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1l99 h ASP 10 Cb 0.93 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.48 1l99 h ASP 10 CO 0.08 0.23 -1.18 -0.62 -1.72 0.00 0.00 179.24 176.02 1l99 n GLU 11 N -3.14 1.19 -0.64 3.56 -0.58 -0.10 -5.01 120.64 115.93 1l99 n GLU 11 Ca 0.03 -0.06 0.09 0.00 -0.42 0.00 0.00 57.16 56.79 1l99 n GLU 11 Cb 0.62 -1.15 -0.02 0.00 -0.57 0.00 0.00 31.44 30.32 1l99 n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1l99 n GLY 12 N 1.79 -2.07 2.94 0.62 0.00 -0.80 -4.35 105.19 103.31 1l99 n GLY 12 Ca -0.01 -1.35 -0.28 0.00 0.00 0.00 0.00 46.02 44.38 1l99 n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1l99 s LEU 13 N 0.00 1.42 -0.09 0.99 2.96 -1.26 -4.21 118.68 118.49 1l99 s LEU 13 Ca 0.00 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 53.50 1l99 s LEU 13 Cb 0.00 -0.96 0.02 0.00 0.50 0.00 0.00 46.19 45.75 1l99 s LEU 13 CO 0.00 -0.11 -0.09 -0.13 -1.32 0.00 0.00 176.35 174.70 1l99 s ARG 14 N 1.63 1.52 0.00 1.98 0.52 -0.74 -5.00 118.95 118.85 1l99 s ARG 14 Ca 0.04 -0.30 0.31 0.00 -0.52 0.00 0.00 55.73 55.26 1l99 s ARG 14 Cb -0.13 -1.43 1.71 0.00 0.52 0.00 0.00 34.95 35.62 1l99 s ARG 14 CO -0.09 -0.13 2.12 1.28 0.02 0.00 0.00 175.30 178.50 1l99 n LEU 15 N 4.40 0.34 -4.10 2.53 4.77 -1.26 -0.47 117.00 123.21 1l99 n LEU 15 Ca -0.18 -0.11 -0.15 0.00 -0.03 0.00 0.00 56.01 55.54 1l99 n LEU 15 Cb 0.51 -0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.48 1l99 n LEU 15 CO 0.21 0.06 -0.42 -0.54 -1.33 0.00 0.00 177.39 175.36 1l99 s LYS 16 N -2.00 0.63 0.22 3.23 1.02 -1.25 -1.03 119.74 120.56 1l99 s LYS 16 Ca 0.46 -0.81 -0.30 0.00 0.02 0.00 0.00 55.97 55.34 1l99 s LYS 16 Cb 0.22 -0.49 -0.15 0.00 -0.52 0.00 0.00 37.83 36.89 1l99 s LYS 16 CO 0.36 0.10 0.96 -0.89 -0.92 0.00 0.00 175.35 174.96 1l99 n ILE 17 N 1.45 1.58 -4.06 2.17 5.41 0.12 -4.75 119.36 121.28 1l99 n ILE 17 Ca -0.22 -0.40 -0.12 0.00 1.00 0.00 0.00 62.75 63.01 1l99 n ILE 17 Cb 0.55 -0.71 -0.05 0.00 -0.71 0.00 0.00 39.64 38.71 1l99 n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 1l99 s TYR 18 N -0.74 0.79 -0.12 1.39 1.13 0.16 -4.95 117.35 115.01 1l99 s TYR 18 Ca 0.65 -1.08 -0.03 0.00 -1.41 0.00 0.00 57.07 55.20 1l99 s TYR 18 Cb -0.81 -0.02 -0.03 0.00 -1.10 0.00 0.00 41.96 40.00 1l99 s TYR 18 CO 0.57 -1.04 0.00 0.15 -2.51 0.00 0.00 175.55 172.72 1l99 s LYS 19 N -3.52 3.31 0.68 -3.49 1.02 -1.26 0.30 119.74 116.78 1l99 s LYS 19 Ca 0.28 -0.42 -0.09 0.00 0.02 0.00 0.00 55.97 55.77 1l99 s LYS 19 Cb 0.00 -2.89 0.03 0.00 -0.52 0.00 0.00 37.83 34.45 1l99 s LYS 19 CO 0.15 0.53 1.03 0.16 -0.92 0.00 0.00 175.35 176.30 1l99 s ASP 20 N -0.40 5.23 0.48 2.83 1.47 0.17 -4.92 116.67 121.52 1l99 s ASP 20 Ca 0.08 0.80 0.34 0.00 1.18 0.00 0.00 52.55 54.95 1l99 s ASP 20 Cb -0.12 -1.59 1.48 0.00 -0.34 0.00 0.00 42.92 42.35 1l99 s ASP 20 CO 0.02 -1.38 1.66 0.71 0.68 0.00 0.00 175.17 176.85 1l99 h THR 21 N -0.54 0.18 -0.51 2.11 1.35 -1.99 -0.85 112.91 112.66 1l99 h THR 21 Ca -0.45 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1l99 h THR 21 Cb 1.28 0.09 0.00 0.00 -1.73 0.00 0.00 68.15 67.79 1l99 h THR 21 CO 0.62 0.02 0.00 -0.62 -0.25 0.00 0.00 175.52 175.29 1l99 n GLU 22 N -4.44 2.24 0.00 4.72 -0.58 -1.26 -4.92 120.64 116.40 1l99 n GLU 22 Ca 0.36 -1.85 0.00 0.00 -0.42 0.00 0.00 57.16 55.25 1l99 n GLU 22 Cb 1.48 -1.42 0.00 0.00 -0.57 0.00 0.00 31.44 30.92 1l99 n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1l99 n GLY 23 N 1.28 2.34 3.77 0.62 0.00 -0.32 -5.03 105.19 107.84 1l99 n GLY 23 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1l99 n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1l99 s TYR 24 N -2.26 3.65 -0.16 1.61 2.02 -1.26 -4.59 117.35 116.37 1l99 s TYR 24 Ca 0.00 1.77 -0.29 0.00 -0.37 0.00 0.00 57.07 58.18 1l99 s TYR 24 Cb 0.00 -3.03 -0.04 0.00 -0.40 0.00 0.00 41.96 38.49 1l99 s TYR 24 CO 0.00 -0.02 1.70 0.71 -1.57 0.00 0.00 175.55 176.37 1l99 s TYR 25 N -1.47 1.93 0.19 2.71 2.02 -1.22 0.42 117.35 121.94 1l99 s TYR 25 Ca 0.49 0.38 0.02 0.00 -0.37 0.00 0.00 57.07 57.58 1l99 s TYR 25 Cb -0.23 -3.98 -0.05 0.00 -0.40 0.00 0.00 41.96 37.31 1l99 s TYR 25 CO 0.29 -3.48 0.02 0.99 -1.57 0.00 0.00 175.55 171.80 1l99 s THR 26 N 5.09 0.68 0.11 -0.71 2.01 0.15 -0.23 115.64 122.74 1l99 s THR 26 Ca 0.76 -1.99 -0.14 0.00 0.31 0.00 0.00 61.69 60.63 1l99 s THR 26 Cb -0.29 -2.23 0.03 0.00 0.01 0.00 0.00 72.50 70.01 1l99 s THR 26 CO 0.31 -0.38 0.35 -0.51 -0.69 0.00 0.00 174.62 173.70 1l99 s ILE 27 N -3.66 0.09 0.00 1.82 2.07 -1.08 0.35 121.20 120.79 1l99 s ILE 27 Ca 0.27 -0.72 0.00 0.00 -1.41 0.00 0.00 60.65 58.79 1l99 s ILE 27 Cb 0.06 -1.20 0.00 0.00 0.13 0.00 0.00 42.46 41.45 1l99 s ILE 27 CO 0.06 -0.40 0.00 0.61 -1.91 0.00 0.00 174.94 173.30 1l99 n GLY 28 N -0.16 3.28 3.30 1.50 0.00 0.38 -1.39 105.19 112.10 1l99 n GLY 28 Ca -0.16 0.21 -0.44 0.00 0.00 0.00 0.00 46.02 45.63 1l99 n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1l99 n ILE 29 N 0.00 4.57 -1.26 -0.61 5.41 -1.26 -1.80 119.36 124.42 1l99 n ILE 29 Ca 0.00 -5.21 -0.09 0.00 1.00 0.00 0.00 62.75 58.45 1l99 n ILE 29 Cb 0.00 -2.48 -0.04 0.00 -0.71 0.00 0.00 39.64 36.41 1l99 n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1l99 n GLY 30 N 2.90 1.04 3.50 7.39 0.00 -1.23 -4.90 105.19 113.90 1l99 n GLY 30 Ca 0.29 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 1l99 n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1l99 s HIS 31 N -2.26 2.68 -0.06 1.61 5.04 -0.49 -4.95 115.29 116.86 1l99 s HIS 31 Ca 0.00 -0.77 -0.35 0.00 -1.54 0.00 0.00 55.06 52.40 1l99 s HIS 31 Cb 0.00 -4.46 -0.13 0.00 0.04 0.00 0.00 32.58 28.03 1l99 s HIS 31 CO 0.00 -1.77 1.80 -0.11 -2.34 0.00 0.00 174.74 172.32 1l99 n LEU 32 N 8.02 3.20 -0.01 8.88 7.94 -1.26 -2.63 117.00 141.13 1l99 n LEU 32 Ca 0.15 1.01 -0.22 0.00 -1.11 0.00 0.00 56.01 55.84 1l99 n LEU 32 Cb 0.49 -1.35 -0.14 0.00 0.53 0.00 0.00 43.42 42.96 1l99 n LEU 32 CO 0.62 -0.17 -0.74 -0.07 -1.11 0.00 0.00 177.39 175.92 1l99 h LEU 33 N 8.26 0.35 -7.00 -1.96 3.38 -0.96 -3.48 115.31 113.90 1l99 h LEU 33 Ca -0.48 -0.87 0.02 0.00 0.09 0.00 0.00 57.88 56.64 1l99 h LEU 33 Cb 1.28 -0.11 -0.24 0.00 0.09 0.00 0.00 40.66 41.68 1l99 h LEU 33 CO 0.93 1.79 0.33 0.28 0.09 0.00 0.00 178.44 181.87 1l99 s THR 34 N -2.52 0.00 -0.75 0.22 -1.32 -1.13 -4.92 115.64 105.21 1l99 s THR 34 Ca -0.23 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 60.34 1l99 s THR 34 Cb 0.06 -1.00 0.48 0.00 -1.51 0.00 0.00 72.50 70.53 1l99 s THR 34 CO 0.74 0.00 1.25 0.29 -2.21 0.00 0.00 174.62 174.69 1l99 n LYS 35 N 2.17 3.15 -4.64 7.08 5.02 -1.26 -3.38 118.16 126.29 1l99 n LYS 35 Ca -0.13 -1.84 -0.32 0.00 -2.02 0.00 0.00 58.31 54.00 1l99 n LYS 35 Cb 0.56 -1.87 -0.12 0.00 -0.02 0.00 0.00 35.03 33.58 1l99 n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1l99 s SER 36 N -0.54 4.33 0.00 4.39 0.15 -1.26 -4.99 113.70 115.78 1l99 s SER 36 Ca 0.32 -0.19 0.15 0.00 0.70 0.00 0.00 55.95 56.94 1l99 s SER 36 Cb 0.23 -0.95 0.84 0.00 -1.71 0.00 0.00 66.02 64.44 1l99 s SER 36 CO 0.11 0.31 1.39 -2.65 1.20 0.00 0.00 173.24 173.60 1l99 n PRO 37 N 1.86 0.34 -2.64 5.44 -0.02 -1.26 -4.63 135.00 134.09 1l99 n PRO 37 Ca -0.16 0.08 -0.43 0.00 -2.02 0.00 0.00 63.50 60.97 1l99 n PRO 37 Cb 0.52 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.48 1l99 n PRO 37 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1l99 s SER 38 N -2.32 7.17 0.28 2.55 0.15 -1.26 -4.70 113.70 115.57 1l99 s SER 38 Ca 0.19 1.55 0.24 0.00 0.70 0.00 0.00 55.95 58.62 1l99 s SER 38 Cb 0.10 -2.55 1.01 0.00 -1.71 0.00 0.00 66.02 62.88 1l99 s SER 38 CO 0.21 -0.53 1.72 -0.11 1.20 0.00 0.00 173.24 175.73 1l99 n LEU 39 N 5.38 0.69 0.07 3.45 7.94 -1.26 -0.89 117.00 132.38 1l99 n LEU 39 Ca 0.10 0.68 0.07 0.00 -1.11 0.00 0.00 56.01 55.75 1l99 n LEU 39 Cb 0.48 -0.60 -0.05 0.00 0.53 0.00 0.00 43.42 43.78 1l99 n LEU 39 CO 0.53 -0.61 -0.18 -3.20 -1.11 0.00 0.00 177.39 172.82 1l99 n ASN 40 N -2.27 0.77 -0.04 1.96 2.85 -1.26 -1.35 115.26 115.91 1l99 n ASN 40 Ca 0.02 0.31 -0.14 0.00 -0.11 0.00 0.00 54.58 54.66 1l99 n ASN 40 Cb 0.22 0.48 -0.08 0.00 1.24 0.00 0.00 39.78 41.63 1l99 n ASN 40 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1l99 h ALA 41 N 1.78 0.17 -0.80 5.20 0.00 -1.36 -3.15 119.26 121.09 1l99 h ALA 41 Ca -0.07 -0.37 0.03 0.00 0.00 0.00 0.00 54.91 54.50 1l99 h ALA 41 Cb 1.23 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 1l99 h ALA 41 CO 0.02 0.12 0.53 0.00 0.00 0.00 0.00 179.25 179.91 1l99 h ALA 42 N 0.53 1.49 0.00 0.00 0.00 -1.12 -1.73 119.26 118.42 1l99 h ALA 42 Ca 0.01 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1l99 h ALA 42 Cb 0.78 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1l99 h ALA 42 CO 0.05 0.45 -0.20 0.87 0.00 0.00 0.00 179.25 180.41 1l99 h LYS 43 N 1.02 0.00 0.01 0.00 1.57 -1.25 -0.57 116.57 117.34 1l99 h LYS 43 Ca 0.31 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 59.03 1l99 h LYS 43 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1l99 h LYS 43 CO -0.08 0.20 -0.22 1.03 -0.57 0.00 0.00 179.45 179.80 1l99 h SER 44 N 0.00 0.18 -0.65 0.86 0.87 -1.37 -2.33 113.55 111.11 1l99 h SER 44 Ca -0.00 -0.82 0.05 0.00 -1.23 0.00 0.00 61.79 59.79 1l99 h SER 44 Cb 0.69 -0.06 -0.05 0.00 -0.44 0.00 0.00 62.40 62.54 1l99 h SER 44 CO 0.03 0.98 0.36 -0.33 -0.53 0.00 0.00 176.83 177.34 1l99 h GLU 45 N -0.59 0.66 -0.58 2.24 4.39 -1.22 -1.42 114.58 118.06 1l99 h GLU 45 Ca -0.03 -0.04 0.04 0.00 0.34 0.00 0.00 59.36 59.67 1l99 h GLU 45 Cb 1.02 -0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 29.48 1l99 h GLU 45 CO 0.04 0.44 0.34 1.25 -1.16 0.00 0.00 179.01 179.92 1l99 h LEU 46 N 0.68 0.52 -0.72 1.33 5.85 -1.10 -0.44 115.31 121.43 1l99 h LEU 46 Ca 0.28 0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.92 1l99 h LEU 46 Cb 0.15 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1l99 h LEU 46 CO -0.17 0.36 -0.10 0.44 -0.34 0.00 0.00 178.44 178.63 1l99 h ASP 47 N 0.65 0.86 -0.20 1.25 3.32 -0.83 -1.50 116.42 119.97 1l99 h ASP 47 Ca 0.24 -0.27 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 1l99 h ASP 47 Cb 0.08 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 1l99 h ASP 47 CO -0.13 0.98 0.12 0.50 -1.72 0.00 0.00 179.24 179.00 1l99 h LYS 48 N 0.78 0.28 -0.64 3.56 3.64 -0.87 0.23 116.57 123.55 1l99 h LYS 48 Ca 0.13 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 1l99 h LYS 48 Cb 0.62 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.35 1l99 h LYS 48 CO 0.04 0.23 0.26 0.00 -2.27 0.00 0.00 179.45 177.71 1l99 h ALA 49 N 1.03 0.84 0.00 5.00 0.00 -0.82 -3.19 119.26 122.12 1l99 h ALA 49 Ca 0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1l99 h ALA 49 Cb 0.02 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 1l99 h ALA 49 CO -0.01 0.45 -0.84 0.82 0.00 0.00 0.00 179.25 179.67 1l99 h ILE 50 N 0.91 0.03 -2.56 0.00 1.08 -1.17 -3.48 117.51 112.31 1l99 h ILE 50 Ca 0.22 -1.06 -0.18 0.00 -0.39 0.00 0.00 64.86 63.44 1l99 h ILE 50 Cb 0.20 1.62 0.04 0.00 -3.07 0.00 0.00 36.82 35.61 1l99 h ILE 50 CO -0.02 0.02 -0.29 0.61 -0.69 0.00 0.00 178.15 177.78 1l99 n GLY 51 N 1.18 0.17 3.72 5.37 0.00 0.80 -5.01 105.19 111.42 1l99 n GLY 51 Ca 0.00 -0.33 -0.03 0.00 0.00 0.00 0.00 46.02 45.66 1l99 n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1l99 s ARG 52 N -5.21 1.06 -0.30 1.61 1.70 -1.10 -5.06 118.95 111.65 1l99 s ARG 52 Ca 0.17 -0.57 -0.24 0.00 -0.47 0.00 0.00 55.73 54.63 1l99 s ARG 52 Cb -0.08 0.37 0.00 0.00 -0.57 0.00 0.00 34.95 34.67 1l99 s ARG 52 CO 0.22 -0.48 0.81 -0.80 -1.08 0.00 0.00 175.30 173.96 1l99 s ASN 53 N -2.90 6.70 -0.04 -2.89 -0.87 -1.26 -4.41 114.94 109.26 1l99 s ASN 53 Ca 0.12 0.73 -0.00 0.00 -1.57 0.00 0.00 52.86 52.14 1l99 s ASN 53 Cb -0.01 -2.42 -0.03 0.00 -0.02 0.00 0.00 41.25 38.78 1l99 s ASN 53 CO 0.00 -0.62 -0.04 0.00 -2.57 0.00 0.00 177.10 173.88 1l99 n ASN 55 N -2.72 0.00 0.00 0.00 3.02 -1.26 -3.11 115.26 111.19 1l99 n ASN 55 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.47 1l99 n ASN 55 Cb 0.58 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.75 1l99 n ASN 55 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1l99 n GLY 56 N 0.00 0.00 2.85 7.41 0.00 -1.26 -4.71 105.19 109.48 1l99 n GLY 56 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1l99 n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1l99 s VAL 57 N 0.00 0.84 0.28 1.61 1.01 -1.18 0.16 120.40 123.12 1l99 s VAL 57 Ca 0.00 -0.34 0.09 0.00 0.00 0.00 0.00 61.98 61.74 1l99 s VAL 57 Cb 0.00 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.32 1l99 s VAL 57 CO 0.00 0.20 -0.13 0.27 0.00 0.00 0.00 175.10 175.44 1l99 s ILE 58 N 1.76 2.09 0.57 2.22 -4.36 -0.20 -4.78 121.20 118.50 1l99 s ILE 58 Ca 0.03 -2.26 -0.12 0.00 -0.26 0.00 0.00 60.65 58.04 1l99 s ILE 58 Cb -0.14 -2.37 -0.05 0.00 1.25 0.00 0.00 42.46 41.15 1l99 s ILE 58 CO -0.07 -0.37 0.99 0.42 0.24 0.00 0.00 174.94 176.15 1l99 s THR 59 N -2.74 4.68 0.31 8.37 -4.23 -1.26 -4.72 115.64 116.05 1l99 s THR 59 Ca 0.29 0.91 0.05 0.00 -1.18 0.00 0.00 61.69 61.76 1l99 s THR 59 Cb -0.00 -3.82 0.30 0.00 1.34 0.00 0.00 72.50 70.31 1l99 s THR 59 CO 0.13 -0.98 1.84 0.50 -0.54 0.00 0.00 174.62 175.57 1l99 h LYS 60 N 0.13 0.82 -0.34 3.99 3.64 -1.99 0.13 116.57 122.95 1l99 h LYS 60 Ca -0.45 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 58.85 1l99 h LYS 60 Cb 1.19 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.81 1l99 h LYS 60 CO 0.62 0.54 0.07 -0.44 -2.27 0.00 0.00 179.45 177.97 1l99 h ASP 61 N 0.85 0.46 -0.53 4.20 3.32 -1.99 -1.87 116.42 120.85 1l99 h ASP 61 Ca 0.49 -0.06 -0.12 0.00 0.02 0.00 0.00 57.03 57.36 1l99 h ASP 61 Cb 0.65 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.06 1l99 h ASP 61 CO -0.26 0.48 -0.12 -0.33 -1.72 0.00 0.00 179.24 177.28 1l99 h GLU 62 N 0.49 1.03 0.00 3.56 5.08 -1.13 -2.56 114.58 121.05 1l99 h GLU 62 Ca 0.11 -0.39 -0.08 0.00 -1.00 0.00 0.00 59.36 58.00 1l99 h GLU 62 Cb 0.22 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1l99 h GLU 62 CO -0.00 1.08 -0.40 0.00 -1.00 0.00 0.00 179.01 178.69 1l99 h ALA 63 N 0.94 0.99 0.02 3.43 0.00 -1.20 -0.98 119.26 122.45 1l99 h ALA 63 Ca 0.14 -0.36 -0.25 0.00 0.00 0.00 0.00 54.91 54.44 1l99 h ALA 63 Cb 0.69 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1l99 h ALA 63 CO 0.05 0.50 -1.27 0.93 0.00 0.00 0.00 179.25 179.46 1l99 h GLU 64 N 0.00 0.05 -0.58 0.00 5.08 -1.29 -1.72 114.58 116.12 1l99 h GLU 64 Ca -0.00 -0.08 -0.11 0.00 -1.00 0.00 0.00 59.36 58.16 1l99 h GLU 64 Cb 0.93 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.19 1l99 h GLU 64 CO 0.05 0.89 -0.06 -0.22 -1.00 0.00 0.00 179.01 178.68 1l99 h LYS 65 N 0.01 1.06 -0.38 2.33 3.64 -1.13 0.14 116.57 122.24 1l99 h LYS 65 Ca -0.12 -0.37 -0.03 0.00 -1.27 0.00 0.00 60.65 58.86 1l99 h LYS 65 Cb 1.88 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.60 1l99 h LYS 65 CO 0.12 1.07 0.13 -0.07 -2.27 0.00 0.00 179.45 178.44 1l99 h LEU 66 N 0.96 0.55 0.38 5.20 3.38 -1.11 -2.57 115.31 122.09 1l99 h LEU 66 Ca 0.16 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1l99 h LEU 66 Cb 0.63 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 1l99 h LEU 66 CO 0.04 0.59 -0.23 0.15 0.09 0.00 0.00 178.44 179.09 1l99 h PHE 67 N 0.47 -0.59 -0.66 1.13 3.57 -1.00 -0.07 116.94 119.79 1l99 h PHE 67 Ca 0.12 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.74 1l99 h PHE 67 Cb 0.23 0.21 -0.09 0.00 2.79 0.00 0.00 35.95 39.09 1l99 h PHE 67 CO 0.01 -0.35 0.18 -0.91 -2.23 0.00 0.00 178.31 175.00 1l99 h ASN 68 N -0.58 0.07 -0.40 0.41 2.35 -0.70 -0.66 115.58 116.07 1l99 h ASN 68 Ca -0.04 0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.81 1l99 h ASN 68 Cb 0.47 0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.96 1l99 h ASN 68 CO 0.05 0.03 0.19 1.56 -1.65 0.00 0.00 177.43 177.61 1l99 h GLN 69 N 0.31 0.58 -0.66 0.81 4.20 -0.98 -2.26 115.11 117.11 1l99 h GLN 69 Ca 0.35 -0.09 -0.02 0.00 0.06 0.00 0.00 58.65 58.95 1l99 h GLN 69 Cb 0.53 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 1l99 h GLN 69 CO -0.42 0.51 0.33 -0.44 -0.67 0.00 0.00 178.83 178.15 1l99 h ASP 70 N 0.51 0.85 -0.33 1.46 3.32 -0.25 0.02 116.42 121.99 1l99 h ASP 70 Ca 0.14 -0.12 -0.09 0.00 0.02 0.00 0.00 57.03 56.98 1l99 h ASP 70 Cb 0.12 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1l99 h ASP 70 CO -0.02 0.73 -0.15 0.58 -1.72 0.00 0.00 179.24 178.66 1l99 h VAL 71 N 0.91 1.29 -0.23 -1.35 2.07 -1.14 -1.22 116.25 116.58 1l99 h VAL 71 Ca 0.23 -1.25 0.02 0.00 0.82 0.00 0.00 66.70 66.51 1l99 h VAL 71 Cb 0.09 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1l99 h VAL 71 CO -0.03 0.41 0.10 -0.78 0.02 0.00 0.00 177.57 177.28 1l99 h ASP 72 N 0.47 0.13 -0.61 0.57 3.58 -1.30 -0.46 116.42 118.80 1l99 h ASP 72 Ca 0.08 0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.52 1l99 h ASP 72 Cb 0.68 -0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.69 1l99 h ASP 72 CO 0.05 0.11 0.31 0.00 -2.88 0.00 0.00 179.24 176.82 1l99 h ALA 73 N 1.13 1.35 0.30 -0.78 0.00 -0.93 -0.32 119.26 120.01 1l99 h ALA 73 Ca 0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1l99 h ALA 73 Cb 0.04 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1l99 h ALA 73 CO -0.08 0.51 -0.15 0.00 0.00 0.00 0.00 179.25 179.54 1l99 h ALA 74 N 1.44 -0.41 -0.27 0.00 0.00 -0.33 -1.10 119.26 118.59 1l99 h ALA 74 Ca 0.22 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 55.04 1l99 h ALA 74 Cb 0.09 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.97 1l99 h ALA 74 CO -0.03 -0.62 -0.12 0.28 0.00 0.00 0.00 179.25 178.75 1l99 h VAL 75 N -0.62 0.61 -0.18 0.00 2.07 -0.92 -1.21 116.25 116.01 1l99 h VAL 75 Ca -0.04 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.44 1l99 h VAL 75 Cb 0.44 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1l99 h VAL 75 CO 0.07 0.00 -0.08 0.03 0.02 0.00 0.00 177.57 177.61 1l99 h ARG 76 N -0.08 0.27 -0.37 1.57 3.08 -1.05 -1.86 114.38 115.94 1l99 h ARG 76 Ca 0.14 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 60.02 1l99 h ARG 76 Cb 0.29 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1l99 h ARG 76 CO -0.33 0.36 -0.22 0.78 -1.07 0.00 0.00 179.97 179.49 1l99 h GLY 77 N 0.67 0.87 1.00 0.04 0.00 -0.68 -2.33 103.07 102.64 1l99 h GLY 77 Ca 0.06 -0.81 0.00 0.00 0.00 0.00 0.00 47.33 46.58 1l99 h GLY 77 CO 0.01 0.74 0.26 -2.22 0.00 0.00 0.00 176.54 175.34 1l99 h ILE 78 N 0.60 1.11 0.00 2.60 2.04 -0.81 -1.69 117.51 121.36 1l99 h ILE 78 Ca 0.08 -0.21 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 1l99 h ILE 78 Cb 0.78 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 37.39 1l99 h ILE 78 CO 0.06 0.11 -0.02 -0.07 0.00 0.00 0.00 178.15 178.23 1l99 h LEU 79 N 0.54 0.00 0.00 1.44 3.38 -1.28 -2.72 115.31 116.67 1l99 h LEU 79 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1l99 h LEU 79 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1l99 h LEU 79 CO -0.03 0.02 -1.15 0.54 0.09 0.00 0.00 178.44 177.91 1l99 n ARG 80 N -3.13 0.48 -3.04 1.13 1.74 -0.89 -4.86 116.66 108.09 1l99 n ARG 80 Ca 0.01 0.02 -0.40 0.00 -0.77 0.00 0.00 57.85 56.71 1l99 n ARG 80 Cb 0.32 -1.68 -0.05 0.00 -1.02 0.00 0.00 32.46 30.03 1l99 n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1l99 s ASN 81 N -4.61 6.89 0.54 0.55 3.84 -0.65 -4.95 114.94 116.55 1l99 s ASN 81 Ca 0.00 1.08 0.29 0.00 0.21 0.00 0.00 52.86 54.45 1l99 s ASN 81 Cb 0.12 -2.40 1.57 0.00 -0.55 0.00 0.00 41.25 39.99 1l99 s ASN 81 CO 0.81 -0.20 2.12 0.00 -2.79 0.00 0.00 177.10 177.03 1l99 h ALA 82 N 7.04 1.29 0.14 1.71 0.00 -1.91 -0.29 119.26 127.24 1l99 h ALA 82 Ca -0.36 -0.08 -0.36 0.00 0.00 0.00 0.00 54.91 54.11 1l99 h ALA 82 Cb 1.17 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1l99 h ALA 82 CO 0.77 0.11 -1.90 0.87 0.00 0.00 0.00 179.25 179.10 1l99 h LYS 83 N 0.00 0.30 0.07 0.00 6.56 -1.92 -3.41 116.57 118.17 1l99 h LYS 83 Ca -0.00 -0.52 -0.10 0.00 -1.06 0.00 0.00 60.65 58.97 1l99 h LYS 83 Cb 0.27 0.19 0.01 0.00 -0.57 0.00 0.00 32.23 32.13 1l99 h LYS 83 CO 0.01 1.23 -0.41 -0.07 -2.06 0.00 0.00 179.45 178.15 1l99 h LEU 84 N 0.08 0.25 -0.28 2.94 3.38 -1.78 -3.38 115.31 116.53 1l99 h LEU 84 Ca -0.39 -0.96 0.06 0.00 0.09 0.00 0.00 57.88 56.68 1l99 h LEU 84 Cb 2.06 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 42.65 1l99 h LEU 84 CO 0.12 1.19 -0.34 0.50 0.09 0.00 0.00 178.44 180.00 1l99 h LYS 85 N -0.65 -0.32 0.00 1.13 3.64 -0.75 -1.42 116.57 118.20 1l99 h LYS 85 Ca -0.07 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1l99 h LYS 85 Cb 1.31 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 33.20 1l99 h LYS 85 CO 0.08 -0.21 -0.01 -1.00 -2.27 0.00 0.00 179.45 176.04 1l99 h PRO 86 N -0.33 0.00 -0.11 1.90 0.13 -1.79 -0.68 132.00 131.12 1l99 h PRO 86 Ca 0.13 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.12 1l99 h PRO 86 Cb 0.55 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.68 1l99 h PRO 86 CO -0.46 0.01 -0.50 0.28 -0.23 0.00 0.00 178.00 177.10 1l99 h VAL 87 N 0.00 1.36 -0.15 1.56 2.07 -1.49 -2.68 116.25 116.93 1l99 h VAL 87 Ca -0.00 -1.81 0.01 0.00 0.82 0.00 0.00 66.70 65.72 1l99 h VAL 87 Cb 0.01 2.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 1l99 h VAL 87 CO 0.00 0.55 0.08 0.22 0.02 0.00 0.00 177.57 178.43 1l99 h TYR 88 N 0.14 0.14 -0.72 1.57 3.20 -0.78 -2.49 116.97 118.03 1l99 h TYR 88 Ca -0.03 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1l99 h TYR 88 Cb 1.14 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 39.33 1l99 h TYR 88 CO 0.11 0.08 0.46 -0.44 -1.64 0.00 0.00 178.16 176.74 1l99 h ASP 89 N 0.16 0.84 0.78 -2.11 3.32 -1.19 -0.79 116.42 117.43 1l99 h ASP 89 Ca 0.06 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1l99 h ASP 89 Cb 0.01 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.35 1l99 h ASP 89 CO -0.04 0.62 0.00 0.77 -1.72 0.00 0.00 179.24 178.87 1l99 h SER 90 N 0.98 0.00 -2.64 6.45 4.64 -1.09 -3.46 113.55 118.43 1l99 h SER 90 Ca 0.26 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 61.11 1l99 h SER 90 Cb -0.09 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.00 1l99 h SER 90 CO -0.05 0.00 -0.25 -0.76 -0.87 0.00 0.00 176.83 174.90 1l99 s LEU 91 N -5.28 4.07 0.91 5.97 1.43 -0.30 -5.08 118.68 120.39 1l99 s LEU 91 Ca 0.02 0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 53.34 1l99 s LEU 91 Cb 0.09 -3.19 0.14 0.00 0.03 0.00 0.00 46.19 43.26 1l99 s LEU 91 CO 0.45 -0.26 1.12 1.51 0.23 0.00 0.00 176.35 179.39 1l99 s ASP 92 N -4.03 3.50 0.30 2.29 -4.77 -1.26 -4.76 116.67 107.93 1l99 s ASP 92 Ca 0.39 1.12 -0.00 0.00 -3.30 0.00 0.00 52.55 50.76 1l99 s ASP 92 Cb -0.09 -1.75 0.50 0.00 -1.09 0.00 0.00 42.92 40.49 1l99 s ASP 92 CO 0.34 -2.57 1.92 0.00 0.70 0.00 0.00 175.17 175.56 1l99 h ALA 93 N -1.51 1.49 0.18 2.11 0.00 -1.98 -1.66 119.26 117.89 1l99 h ALA 93 Ca -0.51 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 1l99 h ALA 93 Cb 1.32 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1l99 h ALA 93 CO 0.60 0.39 -0.09 0.28 0.00 0.00 0.00 179.25 180.43 1l99 h VAL 94 N 1.06 0.92 -0.76 0.00 2.07 -1.93 -2.77 116.25 114.84 1l99 h VAL 94 Ca 0.38 -0.62 0.06 0.00 0.82 0.00 0.00 66.70 67.34 1l99 h VAL 94 Cb 0.14 1.29 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 1l99 h VAL 94 CO -0.13 0.14 0.50 0.03 0.02 0.00 0.00 177.57 178.13 1l99 h ARG 95 N -0.56 0.81 -0.09 1.57 3.08 -1.82 0.26 114.38 117.63 1l99 h ARG 95 Ca -0.03 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 1l99 h ARG 95 Cb 0.42 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1l99 h ARG 95 CO 0.04 0.53 0.00 0.00 -1.07 0.00 0.00 179.97 179.48 1l99 h ARG 96 N 0.83 0.12 -0.31 0.04 3.08 -1.23 -0.96 114.38 115.94 1l99 h ARG 96 Ca 0.32 -0.01 -0.14 0.00 0.07 0.00 0.00 59.98 60.23 1l99 h ARG 96 Cb 0.21 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1l99 h ARG 96 CO -0.11 0.13 -0.36 0.00 -1.07 0.00 0.00 179.97 178.57 1l99 h ALA 98 N 1.01 1.47 -0.15 0.00 0.00 -0.40 -1.54 119.26 119.65 1l99 h ALA 98 Ca 0.06 -0.15 -0.20 0.00 0.00 0.00 0.00 54.91 54.61 1l99 h ALA 98 Cb 0.88 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1l99 h ALA 98 CO 0.08 0.39 -0.73 1.25 0.00 0.00 0.00 179.25 180.24 1l99 h LEU 99 N 0.50 0.80 -0.68 0.00 5.85 -1.37 -2.95 115.31 117.46 1l99 h LEU 99 Ca 0.12 -0.51 -0.01 0.00 0.84 0.00 0.00 57.88 58.32 1l99 h LEU 99 Cb 0.22 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1l99 h LEU 99 CO -0.00 1.29 0.40 0.40 -0.34 0.00 0.00 178.44 180.19 1l99 h ILE 100 N 0.48 1.20 0.22 4.05 2.04 -1.07 -0.47 117.51 123.96 1l99 h ILE 100 Ca -0.04 -0.46 0.01 0.00 1.00 0.00 0.00 64.86 65.36 1l99 h ILE 100 Cb 1.33 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 37.65 1l99 h ILE 100 CO 0.14 0.21 -0.52 -1.13 0.00 0.00 0.00 178.15 176.85 1l99 h ASN 101 N 0.93 -1.54 -0.47 1.72 -0.73 -1.30 0.35 115.58 114.54 1l99 h ASN 101 Ca 0.24 0.15 0.09 0.00 1.87 0.00 0.00 56.30 58.66 1l99 h ASN 101 Cb -0.01 0.55 -0.09 0.00 0.27 0.00 0.00 38.32 39.05 1l99 h ASN 101 CO -0.04 -0.59 -0.10 0.24 -0.37 0.00 0.00 177.43 176.57 1l99 h MET 102 N -0.82 0.02 -0.56 6.67 2.86 -1.43 -1.75 114.93 119.91 1l99 h MET 102 Ca -0.02 -0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.56 1l99 h MET 102 Cb 0.79 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.42 1l99 h MET 102 CO -0.23 0.01 0.12 0.28 1.06 0.00 0.00 176.91 178.15 1l99 h VAL 103 N 0.02 1.25 -0.88 -2.22 2.07 -0.46 0.80 116.25 116.83 1l99 h VAL 103 Ca 0.23 -0.92 0.02 0.00 0.82 0.00 0.00 66.70 66.85 1l99 h VAL 103 Cb 0.35 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 30.83 1l99 h VAL 103 CO -0.47 0.34 0.57 0.15 0.02 0.00 0.00 177.57 178.18 1l99 h PHE 104 N 0.81 1.08 0.04 1.57 3.04 0.06 0.87 116.94 124.42 1l99 h PHE 104 Ca 0.17 0.03 -0.28 0.00 3.98 0.00 0.00 57.97 61.87 1l99 h PHE 104 Cb 0.37 -0.36 -0.03 0.00 2.56 0.00 0.00 35.95 38.49 1l99 h PHE 104 CO 0.03 0.65 -1.47 0.78 -2.02 0.00 0.00 178.31 176.28 1l99 h GLY 105 N 1.15 0.11 -0.74 2.40 0.00 -1.09 -3.39 103.07 101.50 1l99 h GLY 105 Ca 0.33 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1l99 h GLY 105 CO -0.09 0.24 -0.07 1.15 0.00 0.00 0.00 176.54 177.76 1l99 n MET 106 N -3.28 1.05 -0.40 4.80 0.00 0.25 -5.10 117.12 114.44 1l99 n MET 106 Ca -0.13 -0.97 0.04 0.00 0.00 0.00 0.00 57.70 56.64 1l99 n MET 106 Cb 1.02 -1.17 -0.02 0.00 0.00 0.00 0.00 33.22 33.05 1l99 n MET 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1l99 n GLY 107 N 0.72 -2.91 0.26 3.17 0.00 0.30 -3.81 105.19 102.91 1l99 n GLY 107 Ca 0.06 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.78 1l99 n GLY 107 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1l99 h GLU 108 N -0.29 0.57 -0.54 1.61 4.81 -1.92 -2.07 114.58 116.74 1l99 h GLU 108 Ca -0.04 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.10 1l99 h GLU 108 Cb 0.35 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1l99 h GLU 108 CO 0.02 0.38 0.12 1.15 -0.73 0.00 0.00 179.01 179.95 1l99 h THR 109 N 0.59 1.25 -0.01 0.32 2.02 -1.95 -1.88 112.91 113.24 1l99 h THR 109 Ca 0.33 -0.89 -0.00 0.00 0.77 0.00 0.00 66.41 66.61 1l99 h THR 109 Cb 0.32 0.78 -0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1l99 h THR 109 CO -0.25 0.33 0.00 1.23 0.37 0.00 0.00 175.52 177.20 1l99 h GLY 110 N 0.78 0.02 1.02 2.16 0.00 -1.54 -3.00 103.07 102.51 1l99 h GLY 110 Ca 0.17 -0.01 -0.04 0.00 0.00 0.00 0.00 47.33 47.45 1l99 h GLY 110 CO 0.00 0.01 0.31 -2.08 0.00 0.00 0.00 176.54 174.79 1l99 h VAL 111 N -0.19 1.24 0.00 4.60 2.07 -1.34 -0.74 116.25 121.90 1l99 h VAL 111 Ca 0.00 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.79 1l99 h VAL 111 Cb 0.22 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1l99 h VAL 111 CO -0.00 0.30 0.00 0.00 0.02 0.00 0.00 177.57 177.89 1l99 h ALA 112 N 1.15 1.00 0.00 1.67 0.00 -1.33 0.10 119.26 121.85 1l99 h ALA 112 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1l99 h ALA 112 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1l99 h ALA 112 CO -0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.64 1l99 n GLY 113 N -1.07 -1.49 2.10 0.00 0.00 -0.28 -3.92 105.19 100.54 1l99 n GLY 113 Ca -0.02 -0.10 -0.16 0.00 0.00 0.00 0.00 46.02 45.73 1l99 n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1l99 n PHE 114 N -1.49 0.72 -0.26 1.61 3.01 0.35 -4.80 117.46 116.60 1l99 n PHE 114 Ca 0.07 -1.65 -0.05 0.00 1.01 0.00 0.00 57.45 56.84 1l99 n PHE 114 Cb 0.34 -1.33 -0.03 0.00 -0.01 0.00 0.00 39.48 38.44 1l99 n PHE 114 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 1l99 n THR 115 N 1.58 -0.41 -0.05 4.37 -1.04 -1.25 -1.20 114.28 116.27 1l99 n THR 115 Ca 0.39 1.55 -0.07 0.00 -2.04 0.00 0.00 64.05 63.88 1l99 n THR 115 Cb 0.71 -1.96 0.11 0.00 -1.82 0.00 0.00 70.33 67.37 1l99 n THR 115 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1l99 h ASN 116 N 0.00 0.70 -0.51 8.00 2.35 -1.96 -2.30 115.58 121.86 1l99 h ASN 116 Ca 0.15 -0.26 -0.04 0.00 -0.55 0.00 0.00 56.30 55.60 1l99 h ASN 116 Cb 0.31 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 1l99 h ASN 116 CO -0.62 0.93 0.16 0.28 -1.65 0.00 0.00 177.43 176.52 1l99 h SER 117 N 0.60 0.75 -0.84 5.81 0.02 -1.53 -2.14 113.55 116.22 1l99 h SER 117 Ca 0.08 -0.21 0.01 0.00 -0.84 0.00 0.00 61.79 60.84 1l99 h SER 117 Cb 0.74 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 63.04 1l99 h SER 117 CO 0.06 0.76 0.55 -0.07 -1.14 0.00 0.00 176.83 176.99 1l99 h LEU 118 N 0.70 0.95 -0.64 5.07 3.38 -1.27 -0.63 115.31 122.86 1l99 h LEU 118 Ca 0.17 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 58.00 1l99 h LEU 118 Cb 0.28 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1l99 h LEU 118 CO -0.00 0.68 -0.19 -0.09 0.09 0.00 0.00 178.44 178.93 1l99 h ARG 119 N 1.12 0.87 -0.47 1.13 2.43 -1.19 -1.27 114.38 117.01 1l99 h ARG 119 Ca 0.32 -0.34 -0.12 0.00 -0.81 0.00 0.00 59.98 59.03 1l99 h ARG 119 Cb -0.10 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 1l99 h ARG 119 CO -0.08 0.98 -0.17 0.52 -1.51 0.00 0.00 179.97 179.71 1l99 h MET 120 N 0.76 0.94 -0.47 0.20 2.86 -1.18 -1.34 114.93 116.69 1l99 h MET 120 Ca 0.11 -0.39 -0.09 0.00 -2.06 0.00 0.00 59.70 57.27 1l99 h MET 120 Cb 0.72 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.32 1l99 h MET 120 CO 0.06 1.05 -0.09 -0.07 1.06 0.00 0.00 176.91 178.92 1l99 h LEU 121 N 0.78 0.83 -1.60 1.22 3.38 -0.95 -0.53 115.31 118.45 1l99 h LEU 121 Ca 0.11 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 1l99 h LEU 121 Cb 0.74 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1l99 h LEU 121 CO 0.06 0.95 -0.14 -0.61 0.09 0.00 0.00 178.44 178.78 1l99 h GLN 122 N 0.77 0.07 -0.13 1.13 4.15 -1.01 -1.51 115.11 118.59 1l99 h GLN 122 Ca 0.13 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.54 1l99 h GLN 122 Cb 0.59 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.26 1l99 h GLN 122 CO 0.04 0.22 0.00 1.04 -1.93 0.00 0.00 178.83 178.20 1l99 n GLN 123 N -4.33 1.59 -2.03 1.69 6.02 -0.52 -4.90 117.38 114.89 1l99 n GLN 123 Ca -0.02 -0.88 -0.18 0.00 -0.01 0.00 0.00 57.00 55.91 1l99 n GLN 123 Cb 0.23 -1.38 -0.03 0.00 1.02 0.00 0.00 30.24 30.08 1l99 n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1l99 n LYS 124 N 0.10 -1.34 -2.55 -1.09 5.02 -0.57 -4.93 118.16 112.80 1l99 n LYS 124 Ca 0.16 0.95 -0.42 0.00 -2.02 0.00 0.00 58.31 56.98 1l99 n LYS 124 Cb 0.28 -5.35 0.01 0.00 -0.02 0.00 0.00 35.03 29.95 1l99 n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1l99 n ARG 125 N -2.62 4.04 -0.18 1.97 1.74 -0.28 -4.90 116.66 116.42 1l99 n ARG 125 Ca -0.20 -3.91 -0.10 0.00 -0.77 0.00 0.00 57.85 52.87 1l99 n ARG 125 Cb 0.63 -2.75 -0.05 0.00 -1.02 0.00 0.00 32.46 29.27 1l99 n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 1l99 h TRP 126 N 5.52 -1.37 -0.81 -1.55 4.06 -1.88 -0.78 115.95 119.14 1l99 h TRP 126 Ca 0.35 0.08 -0.04 0.00 2.06 0.00 0.00 58.89 61.34 1l99 h TRP 126 Cb 0.59 0.67 -0.04 0.00 -1.00 0.00 0.00 29.16 29.39 1l99 h TRP 126 CO 1.19 -0.44 0.37 -0.44 -3.56 0.00 0.00 178.44 175.56 1l99 h ASP 127 N -0.27 1.08 -0.29 -3.49 5.19 -1.90 -2.01 116.42 114.73 1l99 h ASP 127 Ca 0.15 -0.15 -0.08 0.00 -0.62 0.00 0.00 57.03 56.33 1l99 h ASP 127 Cb 0.57 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.79 1l99 h ASP 127 CO -0.66 0.93 -0.13 -0.33 -3.12 0.00 0.00 179.24 175.94 1l99 h GLU 128 N 1.16 0.59 -0.91 3.56 5.08 -1.82 -2.61 114.58 119.64 1l99 h GLU 128 Ca 0.28 -0.26 0.05 0.00 -1.00 0.00 0.00 59.36 58.43 1l99 h GLU 128 Cb 0.16 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.33 1l99 h GLU 128 CO -0.03 0.83 0.58 0.00 -1.00 0.00 0.00 179.01 179.38 1l99 h ALA 129 N 0.75 1.23 -0.82 3.43 0.00 -1.08 -1.80 119.26 120.97 1l99 h ALA 129 Ca 0.06 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1l99 h ALA 129 Cb 0.64 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1l99 h ALA 129 CO 0.04 0.37 0.45 0.00 0.00 0.00 0.00 179.25 180.11 1l99 h ALA 130 N 1.41 1.25 -0.16 0.00 0.00 -1.14 -0.62 119.26 119.99 1l99 h ALA 130 Ca 0.38 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 1l99 h ALA 130 Cb 0.12 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1l99 h ALA 130 CO -0.16 0.61 -0.07 0.28 0.00 0.00 0.00 179.25 179.92 1l99 h VAL 131 N 1.14 1.31 -0.67 0.00 2.07 -1.11 -2.87 116.25 116.11 1l99 h VAL 131 Ca 0.29 -1.09 -0.06 0.00 0.82 0.00 0.00 66.70 66.67 1l99 h VAL 131 Cb 0.02 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 1l99 h VAL 131 CO -0.05 0.32 0.20 -1.13 0.02 0.00 0.00 177.57 176.93 1l99 h ASN 132 N 0.01 0.97 -0.12 0.57 -0.73 -1.08 -2.70 115.58 112.50 1l99 h ASN 132 Ca 0.04 -0.18 -0.04 0.00 1.87 0.00 0.00 56.30 57.99 1l99 h ASN 132 Cb 0.53 -0.25 -0.01 0.00 0.27 0.00 0.00 38.32 38.85 1l99 h ASN 132 CO 0.02 0.91 -0.02 -0.07 -0.37 0.00 0.00 177.43 177.90 1l99 h LEU 133 N 1.00 0.32 -0.28 0.34 3.38 -1.13 -2.63 115.31 116.31 1l99 h LEU 133 Ca 0.22 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1l99 h LEU 133 Cb 0.30 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1l99 h LEU 133 CO -0.01 0.40 0.00 0.00 0.09 0.00 0.00 178.44 178.93 1l99 n ALA 134 N -2.49 1.90 -1.63 1.53 0.00 -1.02 -3.76 120.51 115.04 1l99 n ALA 134 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.14 1l99 n ALA 134 Cb 0.22 -1.39 -0.05 0.00 0.00 0.00 0.00 19.45 18.24 1l99 n ALA 134 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1l99 n LYS 135 N -1.98 3.24 -4.11 0.00 5.02 -0.99 -4.68 118.16 114.66 1l99 n LYS 135 Ca 0.04 -2.65 -0.09 0.00 -2.02 0.00 0.00 58.31 53.60 1l99 n LYS 135 Cb 0.28 -2.34 -0.10 0.00 -0.02 0.00 0.00 35.03 32.85 1l99 n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1l99 s SER 136 N 0.57 0.73 0.25 4.39 1.04 -1.25 -5.01 113.70 114.43 1l99 s SER 136 Ca 0.58 -0.96 -0.05 0.00 0.48 0.00 0.00 55.95 56.00 1l99 s SER 136 Cb 0.30 0.15 0.33 0.00 0.10 0.00 0.00 66.02 66.90 1l99 s SER 136 CO -0.15 -0.52 1.87 -0.09 0.98 0.00 0.00 173.24 175.33 1l99 h ARG 137 N 3.20 1.03 -0.47 4.02 2.43 -1.93 -2.46 114.38 120.20 1l99 h ARG 137 Ca -0.34 -0.06 0.09 0.00 -0.81 0.00 0.00 59.98 58.86 1l99 h ARG 137 Cb 1.15 -0.23 -0.09 0.00 -0.42 0.00 0.00 29.97 30.38 1l99 h ARG 137 CO 0.63 0.68 -0.11 2.35 -1.51 0.00 0.00 179.97 182.02 1l99 h TRP 138 N 1.06 -0.23 -0.41 2.20 7.01 -1.94 0.28 115.95 123.92 1l99 h TRP 138 Ca 0.38 0.04 -0.07 0.00 2.11 0.00 0.00 58.89 61.36 1l99 h TRP 138 Cb 0.12 0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 27.34 1l99 h TRP 138 CO -0.02 -0.19 -0.00 -0.92 -2.79 0.00 0.00 178.44 174.51 1l99 h TYR 139 N 0.01 0.79 -0.20 2.65 3.20 -1.77 -2.22 116.97 119.44 1l99 h TYR 139 Ca 0.23 -0.14 -0.08 0.00 3.14 0.00 0.00 58.73 61.88 1l99 h TYR 139 Cb 0.35 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 1l99 h TYR 139 CO -0.40 0.80 -0.23 -0.91 -1.64 0.00 0.00 178.16 175.78 1l99 h ASN 140 N 0.56 0.35 0.00 -2.11 2.35 -1.00 -1.77 115.58 113.96 1l99 h ASN 140 Ca 0.12 -0.11 -0.13 0.00 -0.55 0.00 0.00 56.30 55.63 1l99 h ASN 140 Cb 0.49 -0.09 0.01 0.00 0.05 0.00 0.00 38.32 38.77 1l99 h ASN 140 CO 0.02 0.59 -0.50 1.56 -1.65 0.00 0.00 177.43 177.45 1l99 h GLN 141 N 0.32 0.34 -2.65 0.81 1.08 -0.37 -3.40 115.11 111.24 1l99 h GLN 141 Ca 0.05 -0.37 -0.60 0.00 -1.45 0.00 0.00 58.65 56.28 1l99 h GLN 141 Cb 0.59 0.10 -0.40 0.00 -0.05 0.00 0.00 27.48 27.73 1l99 h GLN 141 CO 0.04 1.06 -0.81 0.25 -0.95 0.00 0.00 178.83 178.41 1l99 n THR 142 N -4.30 -0.05 -0.26 -0.54 -2.24 -0.84 -4.99 114.28 101.06 1l99 n THR 142 Ca -0.10 -4.02 -0.05 0.00 -2.27 0.00 0.00 64.05 57.61 1l99 n THR 142 Cb 0.63 -1.87 0.06 0.00 -2.10 0.00 0.00 70.33 67.04 1l99 n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1l99 h PRO 143 N 5.52 0.98 -0.45 -0.78 0.13 -1.54 -1.59 132.00 134.26 1l99 h PRO 143 Ca 0.22 -0.09 -0.06 0.00 -0.87 0.00 0.00 66.00 65.20 1l99 h PRO 143 Cb 0.84 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 31.75 1l99 h PRO 143 CO 0.51 0.70 0.04 -0.91 -0.23 0.00 0.00 178.00 178.11 1l99 h ASN 144 N 0.98 0.74 -0.14 1.44 -0.26 -1.94 0.06 115.58 116.47 1l99 h ASN 144 Ca 0.26 -0.28 -0.10 0.00 -0.56 0.00 0.00 56.30 55.62 1l99 h ASN 144 Cb -0.03 -0.20 0.00 0.00 -1.06 0.00 0.00 38.32 37.03 1l99 h ASN 144 CO -0.05 0.84 -0.29 -0.09 -1.06 0.00 0.00 177.43 176.78 1l99 h ARG 145 N 0.62 0.44 -0.74 0.81 2.43 -1.95 -2.54 114.38 113.45 1l99 h ARG 145 Ca 0.13 -0.29 0.08 0.00 -0.81 0.00 0.00 59.98 59.09 1l99 h ARG 145 Cb 0.43 0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 29.95 1l99 h ARG 145 CO 0.01 0.90 0.41 0.00 -1.51 0.00 0.00 179.97 179.78 1l99 h ALA 146 N 0.54 1.02 -0.70 2.80 0.00 -1.28 -0.98 119.26 120.66 1l99 h ALA 146 Ca 0.00 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1l99 h ALA 146 Cb 0.89 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 1l99 h ALA 146 CO 0.06 0.05 0.33 0.87 0.00 0.00 0.00 179.25 180.57 1l99 h LYS 147 N 0.71 0.99 0.05 0.00 1.57 -0.96 0.98 116.57 119.91 1l99 h LYS 147 Ca 0.35 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1l99 h LYS 147 Cb 0.29 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1l99 h LYS 147 CO -0.23 0.77 -0.02 0.00 -0.57 0.00 0.00 179.45 179.40 1l99 h ARG 148 N 0.99 -0.07 -0.23 3.15 3.08 -0.93 -0.84 114.38 119.53 1l99 h ARG 148 Ca 0.24 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.30 1l99 h ARG 148 Cb 0.10 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1l99 h ARG 148 CO -0.03 -0.04 0.14 0.28 -1.07 0.00 0.00 179.97 179.25 1l99 h VAL 149 N -0.07 1.08 -0.21 2.04 2.07 -0.77 -2.14 116.25 118.25 1l99 h VAL 149 Ca -0.01 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.30 1l99 h VAL 149 Cb 0.06 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1l99 h VAL 149 CO 0.01 0.08 0.02 0.40 0.02 0.00 0.00 177.57 178.11 1l99 h ILE 150 N 0.29 1.12 -0.07 4.57 2.04 -0.77 -0.97 117.51 123.72 1l99 h ILE 150 Ca 0.08 -0.44 -0.20 0.00 1.00 0.00 0.00 64.86 65.30 1l99 h ILE 150 Cb 0.01 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 37.03 1l99 h ILE 150 CO -0.02 0.15 -0.78 0.74 0.00 0.00 0.00 178.15 178.24 1l99 h THR 151 N 0.29 1.37 -0.75 -0.27 2.02 -0.85 -1.31 112.91 113.41 1l99 h THR 151 Ca 0.07 -2.18 -0.03 0.00 0.77 0.00 0.00 66.41 65.04 1l99 h THR 151 Cb 0.16 2.16 -0.03 0.00 -1.74 0.00 0.00 68.15 68.69 1l99 h THR 151 CO 0.00 0.66 0.35 0.74 0.37 0.00 0.00 175.52 177.64 1l99 h THR 152 N 0.31 1.24 -0.23 3.16 2.02 -0.62 -1.69 112.91 117.11 1l99 h THR 152 Ca -0.04 -0.69 -0.03 0.00 0.77 0.00 0.00 66.41 66.42 1l99 h THR 152 Cb 1.38 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 1l99 h THR 152 CO 0.14 0.29 0.03 -0.26 0.37 0.00 0.00 175.52 176.09 1l99 h PHE 153 N 1.05 0.41 -0.63 3.16 0.04 -1.08 0.10 116.94 120.00 1l99 h PHE 153 Ca 0.26 -0.06 -0.00 0.00 2.80 0.00 0.00 57.97 60.96 1l99 h PHE 153 Cb 0.13 -0.11 -0.03 0.00 2.20 0.00 0.00 35.95 38.14 1l99 h PHE 153 CO 0.01 0.52 0.38 -0.09 -0.60 0.00 0.00 178.31 178.54 1l99 h ARG 154 N 0.18 0.85 0.00 1.51 2.43 -0.97 -3.35 114.38 115.04 1l99 h ARG 154 Ca 0.07 -0.07 -0.35 0.00 -0.81 0.00 0.00 59.98 58.81 1l99 h ARG 154 Cb 0.34 -0.18 -0.07 0.00 -0.42 0.00 0.00 29.97 29.64 1l99 h ARG 154 CO 0.01 0.60 -2.24 0.25 -1.51 0.00 0.00 179.97 177.07 1l99 n THR 155 N -4.60 1.45 -1.01 0.20 -2.24 -0.66 -4.68 114.28 102.74 1l99 n THR 155 Ca 0.05 -0.83 -0.00 0.00 -2.27 0.00 0.00 64.05 60.99 1l99 n THR 155 Cb 0.05 -0.64 -0.00 0.00 -2.10 0.00 0.00 70.33 67.64 1l99 n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l99 n GLY 156 N 1.73 0.42 3.55 3.38 0.00 0.36 -5.01 105.19 109.63 1l99 n GLY 156 Ca -0.30 -0.05 -0.25 0.00 0.00 0.00 0.00 46.02 45.41 1l99 n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1l99 s THR 157 N -1.83 1.72 -0.37 2.61 -4.23 -1.26 -4.75 115.64 107.53 1l99 s THR 157 Ca 0.00 -2.01 0.06 0.00 -1.18 0.00 0.00 61.69 58.55 1l99 s THR 157 Cb 0.00 -2.89 0.54 0.00 1.34 0.00 0.00 72.50 71.49 1l99 s THR 157 CO 0.00 -0.02 1.59 0.79 -0.54 0.00 0.00 174.62 176.44 1l99 n TRP 158 N -0.85 2.03 -0.24 3.99 7.02 -1.26 -4.58 117.44 123.55 1l99 n TRP 158 Ca -0.04 -1.17 0.04 0.00 -1.02 0.00 0.00 57.50 55.31 1l99 n TRP 158 Cb 0.67 -0.64 0.17 0.00 -2.42 0.00 0.00 31.31 29.08 1l99 n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1l99 h ASP 159 N 1.51 0.15 0.25 -0.99 3.32 -1.95 -2.51 116.42 116.20 1l99 h ASP 159 Ca 0.31 0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.47 1l99 h ASP 159 Cb 2.12 0.13 -0.00 0.00 0.22 0.00 0.00 39.33 41.80 1l99 h ASP 159 CO 0.67 0.04 -0.05 0.00 -1.72 0.00 0.00 179.24 178.18 1l99 h ALA 160 N 1.55 1.26 0.00 3.45 0.00 -1.89 -2.22 119.26 121.41 1l99 h ALA 160 Ca 0.39 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1l99 h ALA 160 Cb 0.62 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1l99 h ALA 160 CO -0.43 0.06 -1.40 0.66 0.00 0.00 0.00 179.25 178.14 1l99 n TYR 161 N -3.52 0.02 0.26 0.00 4.01 -1.00 -4.16 117.16 112.77 1l99 n TYR 161 Ca -0.02 0.01 0.14 0.00 -0.16 0.00 0.00 57.90 57.86 1l99 n TYR 161 Cb 0.17 -0.23 0.71 0.00 -0.31 0.00 0.00 39.34 39.68 1l99 n TYR 161 CO 0.00 0.00 0.00 1.57 -0.46 0.00 0.00 176.86 177.97 1l99 h LYS 162 N 0.00 0.00 0.00 -0.72 2.10 -0.98 -3.35 116.57 113.62 1l99 h LYS 162 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1l99 h LYS 162 Cb 0.72 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.05 1l99 h LYS 162 CO 0.00 0.12 0.00 0.09 -2.00 0.00 0.00 179.45 177.66 1l99 n ASN 163 N -3.49 0.00 0.00 7.07 3.02 -1.25 -5.13 115.26 115.49 1l99 n ASN 163 Ca -0.01 0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.66 1l99 n ASN 163 Cb 0.27 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 1l99 n ASN 163 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82