#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l49 s ASN 2 N 0.00 0.51 0.28 6.12 2.20 -1.26 -5.04 114.94 117.75 1l49 s ASN 2 Ca 0.00 -1.37 0.03 0.00 -0.94 0.00 0.00 52.86 50.57 1l49 s ASN 2 Cb 0.00 0.30 0.68 0.00 -2.00 0.00 0.00 41.25 40.23 1l49 s ASN 2 CO 0.00 -0.79 1.73 -0.29 -2.94 0.00 0.00 177.10 174.81 1l49 h ILE 3 N 2.56 0.59 -0.32 0.54 6.09 -1.98 -0.67 117.51 124.32 1l49 h ILE 3 Ca -0.37 -0.18 -0.04 0.00 -1.37 0.00 0.00 64.86 62.90 1l49 h ILE 3 Cb 1.25 0.01 -0.01 0.00 0.47 0.00 0.00 36.82 38.54 1l49 h ILE 3 CO 0.56 0.10 0.03 -0.26 -3.07 0.00 0.00 178.15 175.51 1l49 h PHE 4 N 0.53 0.59 -0.61 2.19 -1.00 -1.98 0.01 116.94 116.68 1l49 h PHE 4 Ca 0.54 -0.09 -0.09 0.00 2.81 0.00 0.00 57.97 61.14 1l49 h PHE 4 Cb 0.92 -0.16 -0.02 0.00 3.61 0.00 0.00 35.95 40.30 1l49 h PHE 4 CO -0.09 0.64 0.04 0.93 -1.61 0.00 0.00 178.31 178.22 1l49 h GLU 5 N 0.37 1.04 -0.19 1.51 5.08 -1.82 0.20 114.58 120.77 1l49 h GLU 5 Ca 0.10 -0.31 -0.01 0.00 -1.00 0.00 0.00 59.36 58.14 1l49 h GLU 5 Cb 0.39 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1l49 h GLU 5 CO 0.01 1.00 0.09 1.98 -1.00 0.00 0.00 179.01 181.09 1l49 h MET 6 N 0.94 0.28 0.00 2.33 4.05 -1.04 -1.92 114.93 119.58 1l49 h MET 6 Ca 0.18 -0.04 -0.11 0.00 -0.28 0.00 0.00 59.70 59.44 1l49 h MET 6 Cb 0.50 -0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 31.24 1l49 h MET 6 CO 0.02 0.32 -0.53 -0.07 0.23 0.00 0.00 176.91 176.89 1l49 h LEU 7 N 0.17 0.00 -1.43 3.39 3.38 -0.84 -1.91 115.31 118.08 1l49 h LEU 7 Ca 0.06 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1l49 h LEU 7 Cb 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1l49 h LEU 7 CO -0.01 0.53 -0.15 -0.09 0.09 0.00 0.00 178.44 178.81 1l49 h ARG 8 N 0.00 0.19 -0.18 1.13 9.65 -0.24 0.29 114.38 125.22 1l49 h ARG 8 Ca -0.01 -0.04 -0.08 0.00 -1.10 0.00 0.00 59.98 58.75 1l49 h ARG 8 Cb 0.95 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 29.50 1l49 h ARG 8 CO 0.07 0.35 -0.20 0.82 2.80 0.00 0.00 179.97 183.80 1l49 h ILE 9 N 0.18 1.34 -0.06 1.20 2.04 -0.75 -1.63 117.51 119.83 1l49 h ILE 9 Ca 0.04 -1.39 -0.17 0.00 1.00 0.00 0.00 64.86 64.34 1l49 h ILE 9 Cb 0.38 1.84 -0.01 0.00 -0.74 0.00 0.00 36.82 38.29 1l49 h ILE 9 CO 0.02 0.42 -0.70 0.44 0.00 0.00 0.00 178.15 178.33 1l49 h ASP 10 N 0.10 0.34 0.08 1.72 3.32 -1.02 -3.34 116.42 117.61 1l49 h ASP 10 Ca 0.02 -0.22 -0.12 0.00 0.02 0.00 0.00 57.03 56.74 1l49 h ASP 10 Cb 0.76 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 1l49 h ASP 10 CO 0.05 0.93 -2.05 -0.62 -1.72 0.00 0.00 179.24 175.83 1l49 n GLU 11 N -3.82 0.66 -0.19 3.56 -0.58 0.06 -5.07 120.64 115.26 1l49 n GLU 11 Ca -0.03 -0.11 0.03 0.00 -0.42 0.00 0.00 57.16 56.63 1l49 n GLU 11 Cb 0.68 -1.55 -0.01 0.00 -0.57 0.00 0.00 31.44 30.00 1l49 n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1l49 n GLY 12 N 1.41 -2.19 2.95 0.62 0.00 -0.62 -4.50 105.19 102.87 1l49 n GLY 12 Ca -0.13 -1.47 -0.23 0.00 0.00 0.00 0.00 46.02 44.19 1l49 n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1l49 s LEU 13 N 0.00 1.44 -0.04 0.99 2.96 -1.26 -4.28 118.68 118.49 1l49 s LEU 13 Ca 0.00 -0.22 -0.01 0.00 -0.22 0.00 0.00 54.13 53.68 1l49 s LEU 13 Cb 0.00 -0.65 0.03 0.00 0.50 0.00 0.00 46.19 46.06 1l49 s LEU 13 CO 0.00 -0.02 0.03 -0.13 -1.32 0.00 0.00 176.35 174.90 1l49 s ARG 14 N 0.89 0.20 0.00 1.98 0.52 -0.79 -4.98 118.95 116.76 1l49 s ARG 14 Ca -0.11 0.21 0.24 0.00 -0.52 0.00 0.00 55.73 55.56 1l49 s ARG 14 Cb -0.15 -0.59 0.73 0.00 0.52 0.00 0.00 34.95 35.46 1l49 s ARG 14 CO 0.01 -0.26 1.55 1.28 0.02 0.00 0.00 175.30 177.91 1l49 n LEU 15 N 4.85 2.05 -4.27 2.53 4.77 -1.26 -0.10 117.00 125.56 1l49 n LEU 15 Ca -0.13 -0.78 -0.26 0.00 -0.03 0.00 0.00 56.01 54.82 1l49 n LEU 15 Cb 0.50 -0.07 -0.14 0.00 -2.33 0.00 0.00 43.42 41.38 1l49 n LEU 15 CO 0.13 0.39 -0.53 -0.75 -1.33 0.00 0.00 177.39 175.30 1l49 s LYS 16 N -1.86 1.38 0.28 3.23 2.47 -1.26 -0.67 119.74 123.31 1l49 s LYS 16 Ca 0.35 -1.02 -0.29 0.00 -1.56 0.00 0.00 55.97 53.44 1l49 s LYS 16 Cb 0.20 -1.55 -0.14 0.00 -1.46 0.00 0.00 37.83 34.88 1l49 s LYS 16 CO 0.30 0.39 1.23 -0.89 0.16 0.00 0.00 175.35 176.54 1l49 n ILE 17 N 1.64 1.56 -4.15 5.43 5.41 -0.72 -4.74 119.36 123.79 1l49 n ILE 17 Ca -0.18 -0.39 -0.12 0.00 1.00 0.00 0.00 62.75 63.06 1l49 n ILE 17 Cb 0.53 -1.29 -0.08 0.00 -0.71 0.00 0.00 39.64 38.09 1l49 n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 1l49 s TYR 18 N -0.68 1.02 -0.16 1.39 -0.85 0.23 -4.96 117.35 113.35 1l49 s TYR 18 Ca 0.62 -1.25 -0.10 0.00 -0.52 0.00 0.00 57.07 55.82 1l49 s TYR 18 Cb -0.66 -0.37 -0.05 0.00 0.38 0.00 0.00 41.96 41.26 1l49 s TYR 18 CO 0.57 -0.77 0.17 0.15 -1.52 0.00 0.00 175.55 174.15 1l49 s LYS 19 N -4.00 3.93 0.00 -3.49 1.02 -1.26 0.13 119.74 116.07 1l49 s LYS 19 Ca 0.35 -0.11 0.00 0.00 0.02 0.00 0.00 55.97 56.23 1l49 s LYS 19 Cb 0.04 -3.33 0.00 0.00 -0.52 0.00 0.00 37.83 34.02 1l49 s LYS 19 CO 0.13 0.47 0.00 -0.40 -0.92 0.00 0.00 175.35 174.64 1l49 n ASP 20 N 2.92 -0.21 0.22 2.83 3.85 0.22 -4.82 116.55 121.56 1l49 n ASP 20 Ca -0.17 -0.82 0.06 0.00 -0.71 0.00 0.00 54.79 53.15 1l49 n ASP 20 Cb 0.53 0.00 0.51 0.00 -1.35 0.00 0.00 41.12 40.81 1l49 n ASP 20 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1l49 h THR 21 N -1.04 1.10 -0.17 2.12 1.03 -1.98 -1.90 112.91 112.08 1l49 h THR 21 Ca 0.00 -0.63 0.00 0.00 -0.01 0.00 0.00 66.41 65.77 1l49 h THR 21 Cb 0.00 1.34 0.00 0.00 -1.07 0.00 0.00 68.15 68.42 1l49 h THR 21 CO 0.00 0.18 0.00 -0.62 -0.01 0.00 0.00 175.52 175.07 1l49 n GLU 22 N -4.28 1.75 -0.56 0.00 -0.58 -1.26 -4.91 120.64 110.79 1l49 n GLU 22 Ca -0.02 -1.13 0.00 0.00 -0.42 0.00 0.00 57.16 55.59 1l49 n GLU 22 Cb 0.25 -1.40 0.00 0.00 -0.57 0.00 0.00 31.44 29.72 1l49 n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1l49 n GLY 23 N 1.14 0.75 3.86 0.62 0.00 -0.71 -5.06 105.19 105.79 1l49 n GLY 23 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1l49 n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1l49 s TYR 24 N -2.56 3.41 -0.05 1.61 4.12 -1.26 -4.54 117.35 118.09 1l49 s TYR 24 Ca 0.00 1.10 -0.30 0.00 0.02 0.00 0.00 57.07 57.89 1l49 s TYR 24 Cb 0.00 -2.46 -0.05 0.00 -1.52 0.00 0.00 41.96 37.93 1l49 s TYR 24 CO 0.00 0.05 1.56 0.71 0.02 0.00 0.00 175.55 177.90 1l49 s TYR 25 N -2.09 2.26 0.12 2.71 4.12 -1.17 0.71 117.35 124.01 1l49 s TYR 25 Ca 0.52 0.41 0.02 0.00 0.02 0.00 0.00 57.07 58.04 1l49 s TYR 25 Cb -0.10 -3.82 -0.04 0.00 -1.52 0.00 0.00 41.96 36.47 1l49 s TYR 25 CO 0.23 -3.34 -0.05 0.99 0.02 0.00 0.00 175.55 173.40 1l49 s THR 26 N 3.63 0.72 0.11 -0.71 2.01 0.12 -0.20 115.64 121.32 1l49 s THR 26 Ca 0.69 -1.96 -0.13 0.00 0.31 0.00 0.00 61.69 60.60 1l49 s THR 26 Cb -0.32 -1.82 0.02 0.00 0.01 0.00 0.00 72.50 70.39 1l49 s THR 26 CO 0.27 -0.75 0.32 -0.51 -0.69 0.00 0.00 174.62 173.26 1l49 s ILE 27 N -3.61 0.10 0.00 1.82 2.07 -0.76 -0.60 121.20 120.21 1l49 s ILE 27 Ca 0.16 -0.80 0.00 0.00 -1.41 0.00 0.00 60.65 58.60 1l49 s ILE 27 Cb 0.05 -1.22 0.00 0.00 0.13 0.00 0.00 42.46 41.42 1l49 s ILE 27 CO -0.02 -0.44 0.00 0.61 -1.91 0.00 0.00 174.94 173.18 1l49 n GLY 28 N -0.13 4.08 3.27 1.50 0.00 0.85 -1.19 105.19 113.57 1l49 n GLY 28 Ca -0.16 0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 1l49 n GLY 28 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1l49 s ILE 29 N 0.00 5.41 -1.96 -0.61 1.01 -1.26 -1.88 121.20 121.91 1l49 s ILE 29 Ca 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 60.65 57.37 1l49 s ILE 29 Cb 0.00 -4.30 0.00 0.00 0.01 0.00 0.00 42.46 38.17 1l49 s ILE 29 CO 0.00 -1.11 0.00 0.61 0.00 0.00 0.00 174.94 174.44 1l49 n GLY 30 N 2.95 0.75 3.56 6.18 0.00 -1.24 -4.89 105.19 112.50 1l49 n GLY 30 Ca 0.20 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1l49 n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1l49 s HIS 31 N -2.89 2.48 0.22 1.61 5.04 -0.34 -4.91 115.29 116.50 1l49 s HIS 31 Ca 0.00 0.14 -0.31 0.00 -1.54 0.00 0.00 55.06 53.35 1l49 s HIS 31 Cb 0.00 -4.53 -0.11 0.00 0.04 0.00 0.00 32.58 27.98 1l49 s HIS 31 CO 0.00 -1.79 1.56 -1.17 -2.34 0.00 0.00 174.74 170.99 1l49 s LEU 32 N 5.21 4.37 -0.27 8.88 2.96 -1.26 -1.82 118.68 136.75 1l49 s LEU 32 Ca 0.38 2.72 -0.15 0.00 -0.22 0.00 0.00 54.13 56.85 1l49 s LEU 32 Cb -0.08 -3.61 -0.14 0.00 0.50 0.00 0.00 46.19 42.86 1l49 s LEU 32 CO 0.20 -0.82 -0.24 0.18 -1.32 0.00 0.00 176.35 174.34 1l49 n LEU 33 N 3.20 1.95 -3.56 -0.68 4.77 0.73 -4.95 117.00 118.46 1l49 n LEU 33 Ca 0.11 0.35 -0.17 0.00 -0.03 0.00 0.00 56.01 56.27 1l49 n LEU 33 Cb 0.38 -0.85 -0.06 0.00 -2.33 0.00 0.00 43.42 40.56 1l49 n LEU 33 CO 0.62 0.52 0.38 0.28 -1.33 0.00 0.00 177.39 177.87 1l49 s THR 34 N -2.48 0.01 -1.00 -5.08 -1.32 -1.17 -4.94 115.64 99.66 1l49 s THR 34 Ca -0.37 -0.05 0.26 0.00 -1.21 0.00 0.00 61.69 60.32 1l49 s THR 34 Cb 0.13 -0.95 0.09 0.00 -1.51 0.00 0.00 72.50 70.26 1l49 s THR 34 CO 0.51 -0.03 1.60 0.29 -2.21 0.00 0.00 174.62 174.79 1l49 n LYS 35 N 1.13 0.00 -2.02 7.08 5.02 -1.26 -3.02 118.16 125.10 1l49 n LYS 35 Ca -0.19 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.70 1l49 n LYS 35 Cb 0.57 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 34.07 1l49 n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1l49 s SER 36 N -3.01 6.35 0.00 4.39 0.15 -1.26 -4.90 113.70 115.42 1l49 s SER 36 Ca 0.12 2.72 0.16 0.00 0.70 0.00 0.00 55.95 59.65 1l49 s SER 36 Cb 0.18 -2.64 0.71 0.00 -1.71 0.00 0.00 66.02 62.56 1l49 s SER 36 CO 0.64 -0.83 1.49 -2.65 1.20 0.00 0.00 173.24 173.09 1l49 n PRO 37 N 0.25 0.08 -3.20 5.44 -0.02 -1.26 -4.69 135.00 131.59 1l49 n PRO 37 Ca 0.03 0.20 -0.41 0.00 -2.02 0.00 0.00 63.50 61.30 1l49 n PRO 37 Cb 0.43 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 32.33 1l49 n PRO 37 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1l49 s SER 38 N -2.85 6.38 0.51 2.55 0.15 -1.26 -4.89 113.70 114.28 1l49 s SER 38 Ca 0.10 0.14 0.18 0.00 0.70 0.00 0.00 55.95 57.07 1l49 s SER 38 Cb 0.10 -2.29 1.25 0.00 -1.71 0.00 0.00 66.02 63.38 1l49 s SER 38 CO 0.27 -0.47 2.09 0.25 1.20 0.00 0.00 173.24 176.58 1l49 h LEU 39 N 9.11 0.07 -0.16 3.45 5.85 -1.99 0.28 115.31 131.92 1l49 h LEU 39 Ca -0.28 -0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.24 1l49 h LEU 39 Cb 1.12 -0.01 0.01 0.00 0.37 0.00 0.00 40.66 42.15 1l49 h LEU 39 CO 0.78 0.04 -0.71 0.78 -0.34 0.00 0.00 178.44 179.00 1l49 h ASN 40 N 0.08 0.90 -0.80 1.25 2.35 -1.97 -1.15 115.58 116.24 1l49 h ASN 40 Ca 0.10 -0.62 0.09 0.00 -0.55 0.00 0.00 56.30 55.32 1l49 h ASN 40 Cb 0.30 -0.26 -0.07 0.00 0.05 0.00 0.00 38.32 38.34 1l49 h ASN 40 CO -0.01 1.37 0.44 0.00 -1.65 0.00 0.00 177.43 177.58 1l49 h ALA 41 N 0.55 1.13 -0.32 -0.83 0.00 -0.94 -1.58 119.26 117.26 1l49 h ALA 41 Ca -0.04 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1l49 h ALA 41 Cb 1.34 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 1l49 h ALA 41 CO 0.15 0.06 0.20 0.00 0.00 0.00 0.00 179.25 179.66 1l49 h ALA 42 N 1.45 0.41 0.00 0.00 0.00 -0.64 -1.27 119.26 119.20 1l49 h ALA 42 Ca 0.39 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.21 1l49 h ALA 42 Cb 0.36 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1l49 h ALA 42 CO -0.25 -0.09 -0.18 0.87 0.00 0.00 0.00 179.25 179.60 1l49 h LYS 43 N 0.42 0.00 -0.08 0.00 1.57 -0.88 -0.22 116.57 117.38 1l49 h LYS 43 Ca 0.12 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.85 1l49 h LYS 43 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1l49 h LYS 43 CO -0.02 0.18 -0.12 1.03 -0.57 0.00 0.00 179.45 179.95 1l49 h SER 44 N 0.00 0.24 -0.72 0.86 0.87 -0.79 -2.00 113.55 112.01 1l49 h SER 44 Ca -0.00 -0.53 -0.07 0.00 -1.23 0.00 0.00 61.79 59.96 1l49 h SER 44 Cb 0.37 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.23 1l49 h SER 44 CO 0.02 0.73 0.20 -0.33 -0.53 0.00 0.00 176.83 176.92 1l49 h GLU 45 N -0.24 1.14 0.04 2.24 4.39 -0.89 -1.81 114.58 119.45 1l49 h GLU 45 Ca 0.01 -0.26 0.01 0.00 0.34 0.00 0.00 59.36 59.45 1l49 h GLU 45 Cb 0.68 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 1l49 h GLU 45 CO 0.03 0.99 -0.06 1.25 -1.16 0.00 0.00 179.01 180.05 1l49 h LEU 46 N 1.09 -0.17 -1.26 1.33 5.85 -0.99 0.10 115.31 121.25 1l49 h LEU 46 Ca 0.23 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 1l49 h LEU 46 Cb 0.34 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 1l49 h LEU 46 CO -0.00 -0.10 0.26 0.44 -0.34 0.00 0.00 178.44 178.70 1l49 h ASP 47 N -0.13 0.69 -0.52 1.25 3.32 -1.16 0.03 116.42 119.91 1l49 h ASP 47 Ca 0.01 -0.06 -0.10 0.00 0.02 0.00 0.00 57.03 56.90 1l49 h ASP 47 Cb 0.14 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 1l49 h ASP 47 CO -0.04 0.59 -0.07 0.50 -1.72 0.00 0.00 179.24 178.50 1l49 h LYS 48 N 0.77 0.96 -0.06 3.56 3.64 -1.13 0.21 116.57 124.52 1l49 h LYS 48 Ca 0.19 -0.34 -0.11 0.00 -1.27 0.00 0.00 60.65 59.12 1l49 h LYS 48 Cb 0.09 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 1l49 h LYS 48 CO -0.03 1.01 -0.48 0.00 -2.27 0.00 0.00 179.45 177.68 1l49 h ALA 49 N 0.92 1.08 0.00 5.00 0.00 0.54 -3.28 119.26 123.52 1l49 h ALA 49 Ca 0.14 -0.45 -0.32 0.00 0.00 0.00 0.00 54.91 54.27 1l49 h ALA 49 Cb 0.62 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 1l49 h ALA 49 CO 0.04 0.63 -1.99 -0.89 0.00 0.00 0.00 179.25 177.04 1l49 n ILE 50 N -3.97 1.49 -0.72 0.00 2.08 -0.13 -4.99 119.36 113.12 1l49 n ILE 50 Ca -0.02 -0.82 0.00 0.00 0.56 0.00 0.00 62.75 62.48 1l49 n ILE 50 Cb 0.52 -0.77 0.00 0.00 -0.75 0.00 0.00 39.64 38.63 1l49 n ILE 50 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1l49 n GLY 51 N 1.63 0.71 3.61 7.39 0.00 0.71 -5.05 105.19 114.19 1l49 n GLY 51 Ca -0.23 -0.64 -0.09 0.00 0.00 0.00 0.00 46.02 45.06 1l49 n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1l49 s ARG 52 N -1.53 1.55 -0.50 1.61 1.70 -1.00 -5.04 118.95 115.75 1l49 s ARG 52 Ca 0.00 -1.19 -0.25 0.00 -0.47 0.00 0.00 55.73 53.82 1l49 s ARG 52 Cb 0.00 0.49 0.03 0.00 -0.57 0.00 0.00 34.95 34.90 1l49 s ARG 52 CO 0.00 -0.65 0.95 -0.80 -1.08 0.00 0.00 175.30 173.72 1l49 s ASN 53 N -2.99 6.44 -0.05 -2.89 -0.87 -1.26 -4.30 114.94 109.01 1l49 s ASN 53 Ca 0.20 -0.05 0.20 0.00 -1.57 0.00 0.00 52.86 51.64 1l49 s ASN 53 Cb -0.01 -2.45 -0.31 0.00 -0.02 0.00 0.00 41.25 38.46 1l49 s ASN 53 CO 0.08 -1.14 0.40 0.00 -2.57 0.00 0.00 177.10 173.86 1l49 n ASN 55 N -2.29 -3.02 0.00 0.00 5.15 -1.26 -1.25 115.26 112.59 1l49 n ASN 55 Ca -0.08 -0.80 0.00 0.00 -0.60 0.00 0.00 54.58 53.10 1l49 n ASN 55 Cb 0.63 -3.96 0.00 0.00 -0.53 0.00 0.00 39.78 35.92 1l49 n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1l49 n GLY 56 N -1.66 0.41 3.02 8.20 0.00 -1.26 -4.99 105.19 108.90 1l49 n GLY 56 Ca -0.13 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.71 1l49 n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1l49 s VAL 57 N -1.94 0.70 0.31 1.61 1.01 -0.38 -1.76 120.40 119.96 1l49 s VAL 57 Ca 0.00 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.64 1l49 s VAL 57 Cb 0.00 -0.60 -0.06 0.00 0.00 0.00 0.00 36.38 35.72 1l49 s VAL 57 CO 0.00 0.20 0.06 0.27 0.00 0.00 0.00 175.10 175.63 1l49 s ILE 58 N -0.15 1.11 0.49 2.22 -4.36 0.16 -4.75 121.20 115.93 1l49 s ILE 58 Ca 0.02 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.43 1l49 s ILE 58 Cb -0.04 -2.76 0.01 0.00 1.25 0.00 0.00 42.46 40.92 1l49 s ILE 58 CO -0.00 -0.01 0.70 0.42 0.24 0.00 0.00 174.94 176.29 1l49 s THR 59 N -3.35 3.37 0.15 8.37 -4.23 -1.26 -4.77 115.64 113.91 1l49 s THR 59 Ca 0.37 -0.61 -0.17 0.00 -1.18 0.00 0.00 61.69 60.10 1l49 s THR 59 Cb 0.09 -3.24 -0.00 0.00 1.34 0.00 0.00 72.50 70.68 1l49 s THR 59 CO 0.15 -0.17 1.80 0.50 -0.54 0.00 0.00 174.62 176.36 1l49 h LYS 60 N 0.28 0.43 -0.61 3.99 3.64 -1.99 -0.43 116.57 121.88 1l49 h LYS 60 Ca -0.44 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 58.98 1l49 h LYS 60 Cb 1.27 -0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 32.94 1l49 h LYS 60 CO 0.54 0.28 0.30 -0.44 -2.27 0.00 0.00 179.45 177.86 1l49 h ASP 61 N 0.44 0.40 -0.60 4.20 3.32 -1.99 -0.40 116.42 121.80 1l49 h ASP 61 Ca 0.14 0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.18 1l49 h ASP 61 Cb -0.01 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 1l49 h ASP 61 CO -0.05 0.26 0.15 -0.33 -1.72 0.00 0.00 179.24 177.54 1l49 h GLU 62 N 0.55 0.95 -0.81 3.56 5.08 -1.84 -0.47 114.58 121.60 1l49 h GLU 62 Ca 0.28 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 1l49 h GLU 62 Cb 0.24 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.33 1l49 h GLU 62 CO -0.22 0.87 0.49 0.00 -1.00 0.00 0.00 179.01 179.15 1l49 h ALA 63 N 1.04 1.33 -0.02 3.43 0.00 -0.43 -2.15 119.26 122.46 1l49 h ALA 63 Ca 0.19 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.86 1l49 h ALA 63 Cb 0.34 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1l49 h ALA 63 CO 0.00 0.58 -0.66 0.93 0.00 0.00 0.00 179.25 180.10 1l49 h GLU 64 N 1.12 0.08 -0.26 0.00 5.08 -0.73 -1.06 114.58 118.81 1l49 h GLU 64 Ca 0.29 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.53 1l49 h GLU 64 Cb -0.04 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1l49 h GLU 64 CO -0.05 0.71 -0.06 -0.22 -1.00 0.00 0.00 179.01 178.39 1l49 h LYS 65 N 0.06 0.50 -0.72 2.33 3.64 -0.60 0.13 116.57 121.91 1l49 h LYS 65 Ca -0.01 -0.19 0.01 0.00 -1.27 0.00 0.00 60.65 59.19 1l49 h LYS 65 Cb 1.18 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.93 1l49 h LYS 65 CO 0.09 0.72 0.48 -0.07 -2.27 0.00 0.00 179.45 178.39 1l49 h LEU 66 N 0.25 0.81 -0.26 5.20 3.38 -1.28 -0.34 115.31 123.07 1l49 h LEU 66 Ca 0.07 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1l49 h LEU 66 Cb 0.53 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1l49 h LEU 66 CO 0.03 0.59 0.07 0.15 0.09 0.00 0.00 178.44 179.36 1l49 h PHE 67 N 0.96 0.43 -0.59 1.13 -0.00 -0.78 0.51 116.94 118.61 1l49 h PHE 67 Ca 0.27 -0.05 0.06 0.00 -0.00 0.00 0.00 57.97 58.25 1l49 h PHE 67 Cb -0.09 -0.12 -0.05 0.00 -0.00 0.00 0.00 35.95 35.69 1l49 h PHE 67 CO -0.00 0.49 0.29 -0.91 -0.00 0.00 0.00 178.31 178.19 1l49 h ASN 68 N 0.25 0.41 -0.67 0.41 -0.26 -0.15 -1.14 115.58 114.43 1l49 h ASN 68 Ca 0.08 0.04 -0.02 0.00 -0.56 0.00 0.00 56.30 55.84 1l49 h ASN 68 Cb 0.27 -0.04 -0.03 0.00 -1.06 0.00 0.00 38.32 37.47 1l49 h ASN 68 CO 0.00 0.27 0.33 1.56 -1.06 0.00 0.00 177.43 178.52 1l49 h GLN 69 N 0.55 0.95 -0.62 0.81 4.20 -0.74 -1.98 115.11 118.28 1l49 h GLN 69 Ca 0.27 -0.14 -0.06 0.00 0.06 0.00 0.00 58.65 58.78 1l49 h GLN 69 Cb 0.20 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 1l49 h GLN 69 CO -0.20 0.75 0.16 -0.44 -0.67 0.00 0.00 178.83 178.43 1l49 h ASP 70 N 0.92 0.93 -0.23 1.46 3.32 -0.22 -0.06 116.42 122.54 1l49 h ASP 70 Ca 0.23 -0.23 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 1l49 h ASP 70 Cb 0.11 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1l49 h ASP 70 CO -0.03 0.92 -0.05 0.58 -1.72 0.00 0.00 179.24 178.94 1l49 h VAL 71 N 0.90 1.28 0.08 -1.35 2.07 -1.11 0.21 116.25 118.34 1l49 h VAL 71 Ca 0.20 -1.03 0.01 0.00 0.82 0.00 0.00 66.70 66.70 1l49 h VAL 71 Cb 0.35 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 1l49 h VAL 71 CO 0.00 0.32 -0.16 -0.78 0.02 0.00 0.00 177.57 176.97 1l49 h ASP 72 N 0.18 -0.46 -0.60 0.57 1.82 -1.31 -0.72 116.42 115.91 1l49 h ASP 72 Ca 0.06 0.06 0.06 0.00 -0.39 0.00 0.00 57.03 56.82 1l49 h ASP 72 Cb 0.50 0.18 -0.04 0.00 0.68 0.00 0.00 39.33 40.65 1l49 h ASP 72 CO 0.02 -0.24 0.40 0.00 -1.61 0.00 0.00 179.24 177.81 1l49 h ALA 73 N 0.55 1.82 -0.21 -0.78 0.00 -0.90 -0.31 119.26 119.43 1l49 h ALA 73 Ca 0.03 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1l49 h ALA 73 Cb 0.34 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1l49 h ALA 73 CO -0.10 0.08 -0.02 0.00 0.00 0.00 0.00 179.25 179.21 1l49 h ALA 74 N 1.67 0.29 -0.20 0.00 0.00 0.05 0.15 119.26 121.22 1l49 h ALA 74 Ca 0.26 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1l49 h ALA 74 Cb 0.28 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1l49 h ALA 74 CO -0.08 0.04 0.12 0.28 0.00 0.00 0.00 179.25 179.61 1l49 h VAL 75 N 0.14 1.10 -0.83 0.00 2.07 -0.66 -1.53 116.25 116.54 1l49 h VAL 75 Ca 0.06 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 1l49 h VAL 75 Cb 0.44 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 1l49 h VAL 75 CO 0.02 0.09 0.51 0.03 0.02 0.00 0.00 177.57 178.23 1l49 h ARG 76 N 0.24 1.12 -0.43 1.57 3.08 -1.04 -0.44 114.38 118.48 1l49 h ARG 76 Ca 0.07 -0.10 0.03 0.00 0.07 0.00 0.00 59.98 60.05 1l49 h ARG 76 Cb 0.05 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 29.83 1l49 h ARG 76 CO -0.01 0.78 0.23 0.78 -1.07 0.00 0.00 179.97 180.68 1l49 h GLY 77 N 1.14 0.59 0.87 0.04 0.00 -0.33 -1.01 103.07 104.37 1l49 h GLY 77 Ca 0.30 -0.17 0.03 0.00 0.00 0.00 0.00 47.33 47.49 1l49 h GLY 77 CO -0.06 0.13 0.37 -2.22 0.00 0.00 0.00 176.54 174.77 1l49 h ILE 78 N 0.46 1.07 0.00 2.60 2.04 -0.63 -2.17 117.51 120.89 1l49 h ILE 78 Ca 0.18 -0.25 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1l49 h ILE 78 Cb 0.05 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 36.40 1l49 h ILE 78 CO -0.11 0.13 -0.14 -0.07 0.00 0.00 0.00 178.15 177.97 1l49 h LEU 79 N 0.74 0.00 -0.25 1.44 3.38 -0.21 -2.49 115.31 117.92 1l49 h LEU 79 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1l49 h LEU 79 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1l49 h LEU 79 CO -0.10 0.14 -0.71 0.54 0.09 0.00 0.00 178.44 178.40 1l49 n ARG 80 N -3.48 0.33 -3.55 1.13 1.74 -0.47 -4.80 116.66 107.57 1l49 n ARG 80 Ca -0.01 -0.25 -0.37 0.00 -0.77 0.00 0.00 57.85 56.45 1l49 n ARG 80 Cb 0.30 -1.49 -0.08 0.00 -1.02 0.00 0.00 32.46 30.16 1l49 n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1l49 s ASN 81 N -2.85 6.27 0.64 0.55 3.84 -0.85 -4.95 114.94 117.60 1l49 s ASN 81 Ca 0.12 0.30 0.41 0.00 0.21 0.00 0.00 52.86 53.90 1l49 s ASN 81 Cb 0.17 -2.16 2.19 0.00 -0.55 0.00 0.00 41.25 40.90 1l49 s ASN 81 CO 0.74 0.02 2.30 0.00 -2.79 0.00 0.00 177.10 177.37 1l49 h ALA 82 N 7.33 1.09 0.00 1.71 0.00 -1.90 -0.93 119.26 126.57 1l49 h ALA 82 Ca -0.38 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.23 1l49 h ALA 82 Cb 1.16 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 1l49 h ALA 82 CO 0.69 0.01 -1.87 1.63 0.00 0.00 0.00 179.25 179.71 1l49 n LYS 83 N -3.22 0.65 0.00 0.00 4.01 -1.26 -4.50 118.16 113.84 1l49 n LYS 83 Ca -0.03 0.19 -0.21 0.00 -0.51 0.00 0.00 58.31 57.76 1l49 n LYS 83 Cb 0.11 -1.71 -0.14 0.00 -0.51 0.00 0.00 35.03 32.77 1l49 n LYS 83 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1l49 h LEU 84 N 0.00 0.36 -0.75 -0.35 3.38 -1.71 -3.38 115.31 112.85 1l49 h LEU 84 Ca -0.34 -0.85 0.15 0.00 0.09 0.00 0.00 57.88 56.93 1l49 h LEU 84 Cb 2.01 -0.12 -0.14 0.00 0.09 0.00 0.00 40.66 42.50 1l49 h LEU 84 CO 0.06 1.60 -0.22 0.50 0.09 0.00 0.00 178.44 180.47 1l49 h LYS 85 N -0.35 -0.02 -0.03 1.13 3.64 -0.90 0.45 116.57 120.49 1l49 h LYS 85 Ca -0.30 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.01 1l49 h LYS 85 Cb 1.72 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.54 1l49 h LYS 85 CO 0.05 -0.01 -0.35 -1.00 -2.27 0.00 0.00 179.45 175.86 1l49 h PRO 86 N -0.02 0.06 -0.14 1.90 0.13 -1.81 0.97 132.00 133.09 1l49 h PRO 86 Ca 0.35 -0.02 -0.06 0.00 -0.87 0.00 0.00 66.00 65.40 1l49 h PRO 86 Cb 0.56 -0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.68 1l49 h PRO 86 CO -0.78 0.41 -0.13 0.28 -0.23 0.00 0.00 178.00 177.54 1l49 h VAL 87 N 0.05 1.35 -0.30 1.56 2.07 -1.15 -2.48 116.25 117.35 1l49 h VAL 87 Ca 0.00 -1.28 0.01 0.00 0.82 0.00 0.00 66.70 66.25 1l49 h VAL 87 Cb 0.65 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 32.28 1l49 h VAL 87 CO 0.05 0.37 0.18 0.22 0.02 0.00 0.00 177.57 178.41 1l49 h TYR 88 N -0.04 0.33 0.00 1.57 5.03 -0.80 -1.73 116.97 121.33 1l49 h TYR 88 Ca 0.02 0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.33 1l49 h TYR 88 Cb 0.66 -0.11 -0.00 0.00 1.55 0.00 0.00 36.73 38.83 1l49 h TYR 88 CO 0.08 0.20 -0.06 -0.44 -1.32 0.00 0.00 178.16 176.62 1l49 h ASP 89 N 0.37 0.00 1.30 -2.11 3.45 -0.83 -1.02 116.42 117.56 1l49 h ASP 89 Ca 0.12 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.58 1l49 h ASP 89 Cb -0.01 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.76 1l49 h ASP 89 CO -0.05 0.06 -0.15 -1.54 -1.57 0.00 0.00 179.24 175.99 1l49 n SER 90 N -4.18 0.75 -4.92 6.45 3.41 -0.69 -4.90 113.62 109.54 1l49 n SER 90 Ca -0.03 0.45 -0.26 0.00 -0.26 0.00 0.00 58.87 58.78 1l49 n SER 90 Cb 0.15 -0.54 -0.00 0.00 -0.26 0.00 0.00 64.21 63.55 1l49 n SER 90 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1l49 s LEU 91 N -4.36 3.77 0.97 1.04 1.43 -0.39 -5.06 118.68 116.08 1l49 s LEU 91 Ca 0.10 0.75 -0.14 0.00 -1.03 0.00 0.00 54.13 53.80 1l49 s LEU 91 Cb 0.13 -3.67 0.18 0.00 0.03 0.00 0.00 46.19 42.86 1l49 s LEU 91 CO 0.62 -0.47 1.18 1.51 0.23 0.00 0.00 176.35 179.42 1l49 s ASP 92 N -4.08 2.98 0.18 2.29 1.47 -1.26 -4.76 116.67 113.49 1l49 s ASP 92 Ca 0.45 0.73 -0.13 0.00 1.18 0.00 0.00 52.55 54.78 1l49 s ASP 92 Cb -0.10 -1.12 0.13 0.00 -0.34 0.00 0.00 42.92 41.49 1l49 s ASP 92 CO 0.42 -2.85 1.79 0.00 0.68 0.00 0.00 175.17 175.20 1l49 h ALA 93 N -1.71 0.64 0.17 2.11 0.00 -1.97 -1.31 119.26 117.19 1l49 h ALA 93 Ca -0.48 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1l49 h ALA 93 Cb 1.30 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1l49 h ALA 93 CO 0.52 -0.08 -0.08 0.28 0.00 0.00 0.00 179.25 179.88 1l49 h VAL 94 N 0.51 0.93 -0.12 0.00 2.07 -1.94 -2.77 116.25 114.92 1l49 h VAL 94 Ca 0.22 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1l49 h VAL 94 Cb 0.12 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1l49 h VAL 94 CO -0.15 0.12 0.08 0.03 0.02 0.00 0.00 177.57 177.67 1l49 h ARG 95 N -0.48 0.15 -0.66 1.57 3.08 -1.85 -0.39 114.38 115.81 1l49 h ARG 95 Ca -0.02 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1l49 h ARG 95 Cb 0.37 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 1l49 h ARG 95 CO 0.04 0.10 0.33 0.00 -1.07 0.00 0.00 179.97 179.37 1l49 h ARG 96 N 0.15 0.94 -0.85 0.04 3.08 -1.11 -1.75 114.38 114.88 1l49 h ARG 96 Ca 0.05 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1l49 h ARG 96 Cb 0.00 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 29.84 1l49 h ARG 96 CO -0.01 0.74 0.49 0.00 -1.07 0.00 0.00 179.97 180.12 1l49 h VAL 98 N 1.18 1.21 -0.74 0.00 2.07 -0.66 -0.56 116.25 118.75 1l49 h VAL 98 Ca 0.30 -0.52 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 1l49 h VAL 98 Cb -0.01 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.06 1l49 h VAL 98 CO -0.05 0.23 0.36 0.25 0.02 0.00 0.00 177.57 178.38 1l49 h LEU 99 N 0.91 0.94 -0.74 2.57 5.85 -1.02 -2.11 115.31 121.71 1l49 h LEU 99 Ca 0.23 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 1l49 h LEU 99 Cb 0.04 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 1l49 h LEU 99 CO -0.04 0.79 0.25 0.40 -0.34 0.00 0.00 178.44 179.50 1l49 h ILE 100 N 1.04 1.26 -0.02 4.05 2.04 -0.51 -1.89 117.51 123.49 1l49 h ILE 100 Ca 0.26 -0.88 0.02 0.00 1.00 0.00 0.00 64.86 65.26 1l49 h ILE 100 Cb 0.09 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 1l49 h ILE 100 CO -0.03 0.35 -0.10 -1.13 0.00 0.00 0.00 178.15 177.23 1l49 h ASN 101 N 1.10 -0.30 -0.49 1.72 -0.00 -0.47 -0.58 115.58 116.55 1l49 h ASN 101 Ca 0.24 0.05 0.08 0.00 -0.00 0.00 0.00 56.30 56.67 1l49 h ASN 101 Cb 0.28 0.13 -0.07 0.00 -0.00 0.00 0.00 38.32 38.67 1l49 h ASN 101 CO -0.01 -0.15 0.10 0.24 -0.00 0.00 0.00 177.43 177.62 1l49 h MET 102 N -0.17 0.23 -0.29 6.67 2.86 -1.16 -2.11 114.93 120.96 1l49 h MET 102 Ca 0.04 -0.01 -0.07 0.00 -2.06 0.00 0.00 59.70 57.60 1l49 h MET 102 Cb 0.23 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.82 1l49 h MET 102 CO -0.12 0.15 -0.12 0.28 1.06 0.00 0.00 176.91 178.17 1l49 h VAL 103 N 0.24 1.23 -0.45 -2.22 2.07 -0.69 0.65 116.25 117.08 1l49 h VAL 103 Ca 0.24 -1.01 -0.03 0.00 0.82 0.00 0.00 66.70 66.72 1l49 h VAL 103 Cb 0.32 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 1l49 h VAL 103 CO -0.31 0.33 0.18 0.15 0.02 0.00 0.00 177.57 177.93 1l49 h PHE 104 N 0.46 0.70 -0.02 1.57 3.04 -0.62 -0.19 116.94 121.88 1l49 h PHE 104 Ca 0.09 -0.06 -0.02 0.00 3.98 0.00 0.00 57.97 61.96 1l49 h PHE 104 Cb 0.49 -0.21 0.00 0.00 2.56 0.00 0.00 35.95 38.79 1l49 h PHE 104 CO 0.02 0.60 -0.06 0.37 -2.02 0.00 0.00 178.31 177.22 1l49 h GLN 105 N 0.59 0.08 -0.13 1.11 4.15 -1.10 -3.38 115.11 116.43 1l49 h GLN 105 Ca 0.15 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.52 1l49 h GLN 105 Cb 0.20 0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.90 1l49 h GLN 105 CO -0.01 0.66 0.00 0.00 -1.93 0.00 0.00 178.83 177.55 1l49 n MET 106 N -4.73 1.44 -0.48 1.69 0.00 0.20 -5.10 117.12 110.14 1l49 n MET 106 Ca -0.08 -1.44 0.01 0.00 0.00 0.00 0.00 57.70 56.19 1l49 n MET 106 Cb 0.33 -1.19 -0.01 0.00 0.00 0.00 0.00 33.22 32.36 1l49 n MET 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1l49 n GLY 107 N 0.41 -3.11 0.39 3.17 0.00 -0.08 -3.59 105.19 102.38 1l49 n GLY 107 Ca 0.07 -1.20 -0.10 0.00 0.00 0.00 0.00 46.02 44.79 1l49 n GLY 107 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1l49 h GLU 108 N -0.07 -0.34 -0.61 1.61 4.81 -1.92 -1.54 114.58 116.52 1l49 h GLU 108 Ca -0.02 0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.31 1l49 h GLU 108 Cb 0.33 0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.73 1l49 h GLU 108 CO 0.01 -0.22 0.28 1.15 -0.73 0.00 0.00 179.01 179.49 1l49 h THR 109 N -0.35 0.86 -0.29 0.32 2.02 -1.96 0.26 112.91 113.77 1l49 h THR 109 Ca 0.13 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.14 1l49 h THR 109 Cb 0.59 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 1l49 h THR 109 CO -0.53 0.09 0.19 1.23 0.37 0.00 0.00 175.52 176.87 1l49 h GLY 110 N 0.50 0.41 1.18 2.16 0.00 -1.40 -2.61 103.07 103.32 1l49 h GLY 110 Ca 0.29 -0.15 -0.17 0.00 0.00 0.00 0.00 47.33 47.30 1l49 h GLY 110 CO -0.24 0.15 -0.45 -2.08 0.00 0.00 0.00 176.54 173.92 1l49 h VAL 111 N 0.39 1.28 -0.01 4.60 2.07 -0.76 -2.79 116.25 121.03 1l49 h VAL 111 Ca 0.11 -1.63 0.00 0.00 0.82 0.00 0.00 66.70 66.00 1l49 h VAL 111 Cb -0.04 1.49 -0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1l49 h VAL 111 CO -0.02 0.54 0.11 0.00 0.02 0.00 0.00 177.57 178.21 1l49 h ALA 112 N 0.78 1.14 0.00 1.67 0.00 -0.34 0.21 119.26 122.71 1l49 h ALA 112 Ca 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1l49 h ALA 112 Cb 1.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1l49 h ALA 112 CO 0.10 -0.11 0.00 0.78 0.00 0.00 0.00 179.25 180.02 1l49 h GLY 113 N 0.00 0.00 -5.07 0.00 0.00 -1.17 -3.35 103.07 93.48 1l49 h GLY 113 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 1l49 h GLY 113 CO -0.00 0.00 2.09 0.69 0.00 0.00 0.00 176.54 179.32 1l49 n PHE 114 N -2.30 2.05 -0.32 5.60 0.99 0.74 -4.75 117.46 119.47 1l49 n PHE 114 Ca 0.03 -2.57 -0.10 0.00 -0.00 0.00 0.00 57.45 54.81 1l49 n PHE 114 Cb 0.31 -1.90 -0.07 0.00 -1.00 0.00 0.00 39.48 36.82 1l49 n PHE 114 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.76 177.91 1l49 h THR 115 N 2.52 0.01 -0.74 4.37 2.02 -1.82 -0.10 112.91 119.17 1l49 h THR 115 Ca 0.63 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.76 1l49 h THR 115 Cb 0.52 0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.91 1l49 h THR 115 CO 1.30 0.00 0.25 0.78 0.37 0.00 0.00 175.52 178.21 1l49 h ASN 116 N -0.12 1.07 -0.36 4.18 2.35 -1.96 -2.13 115.58 118.60 1l49 h ASN 116 Ca 0.17 -0.20 -0.05 0.00 -0.55 0.00 0.00 56.30 55.68 1l49 h ASN 116 Cb 0.50 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 1l49 h ASN 116 CO -0.83 0.98 0.05 0.28 -1.65 0.00 0.00 177.43 176.25 1l49 h SER 117 N 1.09 0.59 -0.83 5.81 0.02 -1.74 -1.79 113.55 116.70 1l49 h SER 117 Ca 0.24 -0.27 0.05 0.00 -0.84 0.00 0.00 61.79 60.97 1l49 h SER 117 Cb 0.29 -0.16 -0.06 0.00 0.14 0.00 0.00 62.40 62.61 1l49 h SER 117 CO -0.01 0.71 0.52 -0.07 -1.14 0.00 0.00 176.83 176.84 1l49 h LEU 118 N 0.44 0.82 -0.22 5.07 3.38 -0.79 -0.57 115.31 123.45 1l49 h LEU 118 Ca 0.11 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1l49 h LEU 118 Cb 0.38 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1l49 h LEU 118 CO 0.01 0.54 0.10 -0.09 0.09 0.00 0.00 178.44 179.09 1l49 h ARG 119 N 0.96 0.33 -0.70 1.13 2.43 -1.25 -1.38 114.38 115.90 1l49 h ARG 119 Ca 0.35 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.45 1l49 h ARG 119 Cb 0.12 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 1l49 h ARG 119 CO -0.15 0.36 0.37 0.52 -1.51 0.00 0.00 179.97 179.55 1l49 h MET 120 N 0.22 0.97 -0.36 0.20 2.86 -0.91 -0.55 114.93 117.37 1l49 h MET 120 Ca 0.08 -0.11 -0.14 0.00 -2.06 0.00 0.00 59.70 57.46 1l49 h MET 120 Cb 0.15 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 1l49 h MET 120 CO -0.01 0.73 -0.35 -0.07 1.06 0.00 0.00 176.91 178.27 1l49 h LEU 121 N 0.98 0.87 -1.02 1.22 3.38 -0.79 -0.03 115.31 119.92 1l49 h LEU 121 Ca 0.25 -0.38 0.04 0.00 0.09 0.00 0.00 57.88 57.88 1l49 h LEU 121 Cb 0.05 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.50 1l49 h LEU 121 CO -0.04 1.13 0.66 -0.61 0.09 0.00 0.00 178.44 179.67 1l49 h GLN 122 N 0.68 1.22 -0.00 1.13 4.15 -0.67 0.31 115.11 121.93 1l49 h GLN 122 Ca 0.07 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1l49 h GLN 122 Cb 0.91 -0.28 0.00 0.00 0.21 0.00 0.00 27.48 28.32 1l49 h GLN 122 CO 0.08 0.81 -0.02 1.04 -1.93 0.00 0.00 178.83 178.81 1l49 n GLN 123 N -4.45 0.87 -2.36 1.69 6.02 -0.27 -4.91 117.38 113.98 1l49 n GLN 123 Ca 0.14 -0.13 -0.17 0.00 -0.01 0.00 0.00 57.00 56.82 1l49 n GLN 123 Cb 0.11 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 29.86 1l49 n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1l49 n LYS 124 N -0.95 -1.51 -2.95 -1.09 5.02 0.11 -4.92 118.16 111.86 1l49 n LYS 124 Ca 0.19 0.84 -0.44 0.00 -2.02 0.00 0.00 58.31 56.89 1l49 n LYS 124 Cb 0.19 -5.32 0.00 0.00 -0.02 0.00 0.00 35.03 29.89 1l49 n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1l49 n ARG 125 N -2.71 3.76 -0.08 1.97 1.74 -0.25 -4.89 116.66 116.22 1l49 n ARG 125 Ca -0.20 -4.14 -0.07 0.00 -0.77 0.00 0.00 57.85 52.67 1l49 n ARG 125 Cb 0.66 -2.74 -0.00 0.00 -1.02 0.00 0.00 32.46 29.35 1l49 n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 1l49 h TRP 126 N 6.26 -0.46 -0.70 -1.55 -0.00 -1.89 0.25 115.95 117.86 1l49 h TRP 126 Ca 0.26 0.04 -0.07 0.00 -0.00 0.00 0.00 58.89 59.12 1l49 h TRP 126 Cb 0.75 0.25 -0.03 0.00 -0.00 0.00 0.00 29.16 30.14 1l49 h TRP 126 CO 1.01 -0.26 0.16 -0.44 -0.00 0.00 0.00 178.44 178.91 1l49 h ASP 127 N -0.15 1.06 -0.33 -3.49 3.45 -1.90 -1.72 116.42 113.34 1l49 h ASP 127 Ca 0.16 -0.23 -0.11 0.00 0.43 0.00 0.00 57.03 57.27 1l49 h ASP 127 Cb 0.39 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.87 1l49 h ASP 127 CO -0.39 1.02 -0.24 -0.33 -1.57 0.00 0.00 179.24 177.73 1l49 h GLU 128 N 1.06 0.75 -0.38 3.56 3.07 -1.89 -2.60 114.58 118.14 1l49 h GLU 128 Ca 0.22 -0.36 -0.04 0.00 -0.50 0.00 0.00 59.36 58.68 1l49 h GLU 128 Cb 0.38 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.27 1l49 h GLU 128 CO 0.00 0.98 0.06 0.00 -1.40 0.00 0.00 179.01 178.65 1l49 h ALA 129 N 0.75 1.39 -0.49 3.43 0.00 -0.78 -2.11 119.26 121.46 1l49 h ALA 129 Ca 0.06 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1l49 h ALA 129 Cb 0.80 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1l49 h ALA 129 CO 0.06 0.43 0.13 0.00 0.00 0.00 0.00 179.25 179.87 1l49 h ALA 130 N 1.51 0.64 -0.46 0.00 0.00 -1.01 0.15 119.26 120.09 1l49 h ALA 130 Ca 0.13 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1l49 h ALA 130 Cb 0.27 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1l49 h ALA 130 CO 0.00 0.33 -0.07 0.28 0.00 0.00 0.00 179.25 179.79 1l49 h VAL 131 N 0.67 1.25 -0.33 0.00 2.07 -1.37 -2.69 116.25 115.86 1l49 h VAL 131 Ca 0.15 -1.12 -0.16 0.00 0.82 0.00 0.00 66.70 66.40 1l49 h VAL 131 Cb 0.32 0.97 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1l49 h VAL 131 CO 0.00 0.39 -0.40 -1.13 0.02 0.00 0.00 177.57 176.45 1l49 h ASN 132 N 0.74 0.92 -0.45 0.57 -0.73 -0.92 -3.14 115.58 112.57 1l49 h ASN 132 Ca 0.13 -0.49 -0.02 0.00 1.87 0.00 0.00 56.30 57.79 1l49 h ASN 132 Cb 0.55 -0.26 -0.02 0.00 0.27 0.00 0.00 38.32 38.85 1l49 h ASN 132 CO 0.03 1.23 0.22 -0.07 -0.37 0.00 0.00 177.43 178.47 1l49 h LEU 133 N 0.64 0.62 -1.61 0.34 3.38 -0.89 -2.37 115.31 115.43 1l49 h LEU 133 Ca 0.04 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1l49 h LEU 133 Cb 1.00 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1l49 h LEU 133 CO 0.10 0.55 0.00 0.00 0.09 0.00 0.00 178.44 179.17 1l49 h ALA 134 N 1.55 1.00 -1.13 1.53 0.00 -1.43 -3.32 119.26 117.47 1l49 h ALA 134 Ca 0.17 0.00 -0.77 0.00 0.00 0.00 0.00 54.91 54.31 1l49 h ALA 134 Cb 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 17.79 17.70 1l49 h ALA 134 CO -0.02 0.00 1.72 1.63 0.00 0.00 0.00 179.25 182.58 1l49 n LYS 135 N -2.67 4.18 -3.61 0.00 5.02 -0.89 -4.69 118.16 115.50 1l49 n LYS 135 Ca -0.00 -3.86 -0.11 0.00 -2.02 0.00 0.00 58.31 52.32 1l49 n LYS 135 Cb 0.17 -2.73 -0.05 0.00 -0.02 0.00 0.00 35.03 32.41 1l49 n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1l49 s SER 136 N -0.09 -0.28 0.19 4.39 1.04 -1.25 -5.02 113.70 112.68 1l49 s SER 136 Ca 0.40 -0.23 -0.11 0.00 0.48 0.00 0.00 55.95 56.49 1l49 s SER 136 Cb 0.11 0.48 0.11 0.00 0.10 0.00 0.00 66.02 66.82 1l49 s SER 136 CO -0.00 -0.84 1.77 -0.09 0.98 0.00 0.00 173.24 175.06 1l49 h ARG 137 N 2.41 0.96 -0.67 4.02 2.43 -1.92 -2.44 114.38 119.17 1l49 h ARG 137 Ca -0.34 -0.14 0.13 0.00 -0.81 0.00 0.00 59.98 58.82 1l49 h ARG 137 Cb 1.25 -0.17 -0.13 0.00 -0.42 0.00 0.00 29.97 30.50 1l49 h ARG 137 CO 0.45 0.76 -0.23 2.35 -1.51 0.00 0.00 179.97 181.80 1l49 h TRP 138 N 0.92 -0.55 -0.09 2.20 7.01 -1.95 0.11 115.95 123.60 1l49 h TRP 138 Ca 0.23 0.07 -0.01 0.00 2.11 0.00 0.00 58.89 61.28 1l49 h TRP 138 Cb 0.12 0.34 -0.00 0.00 -2.10 0.00 0.00 29.16 27.52 1l49 h TRP 138 CO 0.00 -0.33 0.01 -0.92 -2.79 0.00 0.00 178.44 174.41 1l49 h TYR 139 N -0.05 0.16 -0.45 2.65 3.20 -1.76 -1.69 116.97 119.02 1l49 h TYR 139 Ca 0.31 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 1l49 h TYR 139 Cb 0.53 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.73 1l49 h TYR 139 CO -0.59 0.37 0.22 -0.91 -1.64 0.00 0.00 178.16 175.61 1l49 h ASN 140 N -0.10 0.55 0.23 -2.11 4.21 -0.89 -1.57 115.58 115.90 1l49 h ASN 140 Ca 0.03 -0.04 -0.32 0.00 1.21 0.00 0.00 56.30 57.17 1l49 h ASN 140 Cb 0.30 -0.14 0.04 0.00 -1.12 0.00 0.00 38.32 37.39 1l49 h ASN 140 CO 0.00 0.47 -1.40 1.56 -1.29 0.00 0.00 177.43 176.77 1l49 h GLN 141 N 0.62 0.56 -2.07 0.81 1.08 -0.76 -3.39 115.11 111.96 1l49 h GLN 141 Ca 0.16 -0.89 -0.55 0.00 -1.45 0.00 0.00 58.65 55.92 1l49 h GLN 141 Cb 0.05 0.32 -0.40 0.00 -0.05 0.00 0.00 27.48 27.40 1l49 h GLN 141 CO -0.02 1.42 -0.97 0.25 -0.95 0.00 0.00 178.83 178.56 1l49 n THR 142 N -3.74 0.53 -0.35 -0.54 -2.24 -0.64 -4.98 114.28 102.32 1l49 n THR 142 Ca -0.16 -4.60 -0.01 0.00 -2.27 0.00 0.00 64.05 57.02 1l49 n THR 142 Cb 1.07 -1.49 0.15 0.00 -2.10 0.00 0.00 70.33 67.96 1l49 n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1l49 h PRO 143 N 3.65 1.23 -0.33 -0.78 0.13 -1.50 -0.31 132.00 134.10 1l49 h PRO 143 Ca 0.11 -0.07 -0.08 0.00 -0.87 0.00 0.00 66.00 65.09 1l49 h PRO 143 Cb 0.81 -0.28 -0.01 0.00 0.13 0.00 0.00 31.00 31.65 1l49 h PRO 143 CO 0.59 0.82 -0.10 -0.91 -0.23 0.00 0.00 178.00 178.17 1l49 h ASN 144 N 1.27 0.66 -0.03 1.44 -0.26 -1.94 0.38 115.58 117.10 1l49 h ASN 144 Ca 0.37 -0.38 -0.00 0.00 -0.56 0.00 0.00 56.30 55.73 1l49 h ASN 144 Cb -0.08 -0.18 -0.00 0.00 -1.06 0.00 0.00 38.32 37.00 1l49 h ASN 144 CO -0.10 0.89 0.01 -0.09 -1.06 0.00 0.00 177.43 177.08 1l49 h ARG 145 N 0.43 0.04 -0.60 0.81 2.43 -1.95 -2.34 114.38 113.20 1l49 h ARG 145 Ca 0.08 -0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.32 1l49 h ARG 145 Cb 0.61 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.09 1l49 h ARG 145 CO 0.04 0.26 0.25 0.00 -1.51 0.00 0.00 179.97 179.00 1l49 h ALA 146 N 0.78 0.78 -0.78 2.80 0.00 -0.97 -1.21 119.26 120.67 1l49 h ALA 146 Ca 0.01 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1l49 h ALA 146 Cb 0.24 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1l49 h ALA 146 CO 0.00 -0.15 0.51 0.87 0.00 0.00 0.00 179.25 180.48 1l49 h LYS 147 N 0.45 0.94 -0.23 0.00 1.57 -0.85 0.12 116.57 118.58 1l49 h LYS 147 Ca 0.29 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 59.00 1l49 h LYS 147 Cb 0.33 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1l49 h LYS 147 CO -0.27 0.62 0.08 0.00 -0.57 0.00 0.00 179.45 179.32 1l49 h ARG 148 N 0.97 0.34 0.01 3.15 3.08 -0.70 -1.03 114.38 120.22 1l49 h ARG 148 Ca 0.31 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.29 1l49 h ARG 148 Cb 0.02 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.02 1l49 h ARG 148 CO -0.09 0.40 -0.01 0.28 -1.07 0.00 0.00 179.97 179.49 1l49 h VAL 149 N 0.21 1.03 -0.73 2.04 2.07 -0.70 -1.55 116.25 118.62 1l49 h VAL 149 Ca 0.07 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 67.49 1l49 h VAL 149 Cb 0.19 1.11 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 1l49 h VAL 149 CO -0.01 0.03 0.48 0.40 0.02 0.00 0.00 177.57 178.50 1l49 h ILE 150 N -0.07 1.17 -0.55 4.57 2.04 -0.76 -1.27 117.51 122.63 1l49 h ILE 150 Ca -0.00 -0.33 -0.05 0.00 1.00 0.00 0.00 64.86 65.47 1l49 h ILE 150 Cb 0.06 0.11 -0.03 0.00 -0.74 0.00 0.00 36.82 36.23 1l49 h ILE 150 CO 0.00 0.18 0.14 0.74 0.00 0.00 0.00 178.15 179.21 1l49 h THR 151 N 0.97 1.23 -0.74 -0.27 2.02 -0.98 -0.07 112.91 115.06 1l49 h THR 151 Ca 0.27 -0.82 -0.06 0.00 0.77 0.00 0.00 66.41 66.57 1l49 h THR 151 Cb -0.09 0.66 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 1l49 h THR 151 CO -0.07 0.31 0.21 0.28 0.37 0.00 0.00 175.52 176.62 1l49 h SER 152 N 0.82 1.09 0.37 4.18 0.02 -0.60 0.38 113.55 119.81 1l49 h SER 152 Ca 0.18 -0.22 -0.15 0.00 -0.84 0.00 0.00 61.79 60.76 1l49 h SER 152 Cb 0.29 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1l49 h SER 152 CO -0.00 1.02 -0.63 -0.26 -1.14 0.00 0.00 176.83 175.81 1l49 h PHE 153 N 1.10 0.32 -0.46 3.45 0.05 -0.79 0.10 116.94 120.73 1l49 h PHE 153 Ca 0.24 -0.13 -0.06 0.00 3.82 0.00 0.00 57.97 61.83 1l49 h PHE 153 Cb 0.33 -0.06 -0.02 0.00 2.00 0.00 0.00 35.95 38.21 1l49 h PHE 153 CO 0.03 0.81 0.04 -0.09 -0.18 0.00 0.00 178.31 178.91 1l49 h ARG 154 N 0.18 0.78 0.00 1.51 2.43 -0.27 -3.35 114.38 115.67 1l49 h ARG 154 Ca -0.01 -0.23 -0.05 0.00 -0.81 0.00 0.00 59.98 58.88 1l49 h ARG 154 Cb 1.15 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.61 1l49 h ARG 154 CO 0.10 0.82 -1.78 0.25 -1.51 0.00 0.00 179.97 177.85 1l49 n THR 155 N -4.41 0.19 -1.30 0.20 -2.24 0.05 -4.82 114.28 101.96 1l49 n THR 155 Ca 0.00 -0.41 -0.07 0.00 -2.27 0.00 0.00 64.05 61.30 1l49 n THR 155 Cb 0.28 -0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.47 1l49 n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l49 n GLY 156 N 1.70 0.84 3.51 3.38 0.00 0.36 -5.01 105.19 109.97 1l49 n GLY 156 Ca -0.07 -0.71 -0.25 0.00 0.00 0.00 0.00 46.02 44.99 1l49 n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1l49 s THR 157 N -2.27 1.00 -1.24 2.61 -4.23 -1.25 -4.77 115.64 105.48 1l49 s THR 157 Ca 0.00 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 58.66 1l49 s THR 157 Cb 0.00 -2.57 0.58 0.00 1.34 0.00 0.00 72.50 71.85 1l49 s THR 157 CO 0.00 0.00 1.46 0.79 -0.54 0.00 0.00 174.62 176.33 1l49 n TRP 158 N -0.84 1.20 -0.34 3.99 7.02 -1.26 -4.64 117.44 122.57 1l49 n TRP 158 Ca -0.06 -0.48 0.18 0.00 -1.02 0.00 0.00 57.50 56.13 1l49 n TRP 158 Cb 0.66 -0.20 0.41 0.00 -2.42 0.00 0.00 31.31 29.75 1l49 n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1l49 h ASP 159 N 3.30 0.63 0.58 -0.99 3.45 -1.97 -0.85 116.42 120.58 1l49 h ASP 159 Ca 0.00 0.13 0.00 0.00 0.43 0.00 0.00 57.03 57.59 1l49 h ASP 159 Cb 1.21 0.03 0.00 0.00 -0.56 0.00 0.00 39.33 40.01 1l49 h ASP 159 CO 0.19 0.10 0.00 0.00 -1.57 0.00 0.00 179.24 177.96 1l49 h ALA 160 N 1.71 1.00 -0.01 3.45 0.00 -1.90 -1.99 119.26 121.51 1l49 h ALA 160 Ca 0.64 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.55 1l49 h ALA 160 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1l49 h ALA 160 CO -0.44 0.00 -0.31 0.66 0.00 0.00 0.00 179.25 179.16 1l49 n TYR 161 N -2.69 0.00 1.43 0.00 4.01 -0.35 -4.50 117.16 115.06 1l49 n TYR 161 Ca 0.00 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.88 1l49 n TYR 161 Cb 0.19 0.00 0.61 0.00 -0.31 0.00 0.00 39.34 39.84 1l49 n TYR 161 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1l49 n LYS 162 N -0.15 0.76 0.09 -0.72 5.02 -0.75 -3.51 118.16 118.90 1l49 n LYS 162 Ca 0.06 -0.27 -0.04 0.00 -2.02 0.00 0.00 58.31 56.04 1l49 n LYS 162 Cb 0.31 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.81 1l49 n LYS 162 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 1l49 h ASN 163 N 0.66 -0.22 0.00 4.39 4.21 -1.79 -3.52 115.58 119.31 1l49 h ASN 163 Ca 0.00 0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.52 1l49 h ASN 163 Cb 0.35 0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.61 1l49 h ASN 163 CO 0.00 -0.05 0.00 0.18 -1.29 0.00 0.00 177.43 176.27