#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l27 s ASN 2 N 0.00 0.25 0.27 6.12 2.20 -1.26 -5.04 114.94 117.48 1l27 s ASN 2 Ca 0.00 -1.20 0.00 0.00 -0.94 0.00 0.00 52.86 50.72 1l27 s ASN 2 Cb 0.00 0.56 0.56 0.00 -2.00 0.00 0.00 41.25 40.36 1l27 s ASN 2 CO 0.00 -1.11 1.78 -0.29 -2.94 0.00 0.00 177.10 174.54 1l27 h ILE 3 N 2.31 0.76 -0.19 0.54 6.09 -1.99 -1.17 117.51 123.87 1l27 h ILE 3 Ca -0.29 -0.24 -0.02 0.00 -1.37 0.00 0.00 64.86 62.94 1l27 h ILE 3 Cb 1.25 -0.01 -0.01 0.00 0.47 0.00 0.00 36.82 38.52 1l27 h ILE 3 CO 0.41 0.13 0.05 -0.26 -3.07 0.00 0.00 178.15 175.41 1l27 h PHE 4 N 0.71 0.32 -0.70 2.19 -1.00 -1.99 -0.60 116.94 115.87 1l27 h PHE 4 Ca 0.48 -0.04 -0.04 0.00 2.81 0.00 0.00 57.97 61.18 1l27 h PHE 4 Cb 0.65 -0.09 -0.03 0.00 3.61 0.00 0.00 35.95 40.09 1l27 h PHE 4 CO -0.06 0.42 0.26 0.93 -1.61 0.00 0.00 178.31 178.25 1l27 h GLU 5 N 0.13 1.06 0.22 1.51 5.08 -1.88 -0.62 114.58 120.08 1l27 h GLU 5 Ca 0.06 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1l27 h GLU 5 Cb 0.26 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 1l27 h GLU 5 CO -0.00 0.89 -0.13 1.98 -1.00 0.00 0.00 179.01 180.75 1l27 h MET 6 N 1.01 -0.32 -0.04 2.33 4.05 -1.13 -1.85 114.93 118.98 1l27 h MET 6 Ca 0.23 0.02 -0.08 0.00 -0.28 0.00 0.00 59.70 59.60 1l27 h MET 6 Cb 0.24 0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.10 1l27 h MET 6 CO -0.02 -0.21 -0.35 -0.07 0.23 0.00 0.00 176.91 176.49 1l27 h LEU 7 N -0.33 0.07 -1.14 3.39 3.38 -0.98 -2.21 115.31 117.49 1l27 h LEU 7 Ca -0.02 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1l27 h LEU 7 Cb 0.28 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1l27 h LEU 7 CO 0.02 0.42 -0.16 -0.09 0.09 0.00 0.00 178.44 178.72 1l27 h ARG 8 N 0.06 0.41 -0.21 1.13 9.65 -0.90 -0.55 114.38 123.97 1l27 h ARG 8 Ca 0.01 -0.12 -0.09 0.00 -1.10 0.00 0.00 59.98 58.67 1l27 h ARG 8 Cb 0.65 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 29.18 1l27 h ARG 8 CO 0.05 0.57 -0.23 0.82 2.80 0.00 0.00 179.97 183.98 1l27 h ILE 9 N 0.38 1.33 -0.14 1.20 2.04 -0.89 -2.03 117.51 119.39 1l27 h ILE 9 Ca 0.07 -1.41 -0.15 0.00 1.00 0.00 0.00 64.86 64.38 1l27 h ILE 9 Cb 0.51 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 38.35 1l27 h ILE 9 CO 0.03 0.43 -0.53 0.44 0.00 0.00 0.00 178.15 178.52 1l27 h ASP 10 N 0.19 0.46 0.07 1.72 3.32 -1.15 -3.34 116.42 117.69 1l27 h ASP 10 Ca 0.03 -0.24 -0.34 0.00 0.02 0.00 0.00 57.03 56.51 1l27 h ASP 10 Cb 0.79 -0.13 -0.06 0.00 0.22 0.00 0.00 39.33 40.14 1l27 h ASP 10 CO 0.06 0.90 -2.27 -0.62 -1.72 0.00 0.00 179.24 175.59 1l27 n GLU 11 N -3.95 0.68 0.00 3.56 -0.58 -0.24 -5.06 120.64 115.05 1l27 n GLU 11 Ca -0.03 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 1l27 n GLU 11 Cb 0.58 -1.56 0.00 0.00 -0.57 0.00 0.00 31.44 29.89 1l27 n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1l27 n GLY 12 N 1.69 -2.39 2.83 0.62 0.00 -0.76 -4.49 105.19 102.68 1l27 n GLY 12 Ca -0.29 -1.58 -0.22 0.00 0.00 0.00 0.00 46.02 43.93 1l27 n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1l27 s LEU 13 N 0.00 0.93 -0.06 0.99 2.96 -1.26 -4.31 118.68 117.93 1l27 s LEU 13 Ca 0.00 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 53.78 1l27 s LEU 13 Cb 0.00 -0.49 0.02 0.00 0.50 0.00 0.00 46.19 46.22 1l27 s LEU 13 CO 0.00 -0.13 -0.03 -0.13 -1.32 0.00 0.00 176.35 174.73 1l27 s ARG 14 N 1.55 0.86 0.00 1.98 0.52 -0.70 -4.99 118.95 118.18 1l27 s ARG 14 Ca -0.01 -0.06 0.28 0.00 -0.52 0.00 0.00 55.73 55.42 1l27 s ARG 14 Cb -0.13 -0.99 1.03 0.00 0.52 0.00 0.00 34.95 35.37 1l27 s ARG 14 CO -0.04 -0.18 1.73 1.28 0.02 0.00 0.00 175.30 178.12 1l27 n LEU 15 N 4.53 1.43 -4.31 2.53 4.77 -1.26 -0.03 117.00 124.65 1l27 n LEU 15 Ca -0.17 -0.47 -0.27 0.00 -0.03 0.00 0.00 56.01 55.07 1l27 n LEU 15 Cb 0.50 -0.01 -0.14 0.00 -2.33 0.00 0.00 43.42 41.44 1l27 n LEU 15 CO 0.18 0.24 -0.54 -0.75 -1.33 0.00 0.00 177.39 175.19 1l27 s LYS 16 N -2.06 1.45 0.25 3.23 2.47 -1.26 -1.43 119.74 122.39 1l27 s LYS 16 Ca 0.37 -1.11 -0.30 0.00 -1.56 0.00 0.00 55.97 53.37 1l27 s LYS 16 Cb 0.21 -1.69 -0.14 0.00 -1.46 0.00 0.00 37.83 34.74 1l27 s LYS 16 CO 0.36 0.42 1.09 -0.89 0.16 0.00 0.00 175.35 176.49 1l27 n ILE 17 N 1.50 1.55 -4.14 5.43 5.41 -0.90 -4.75 119.36 123.45 1l27 n ILE 17 Ca -0.18 -0.39 -0.11 0.00 1.00 0.00 0.00 62.75 63.08 1l27 n ILE 17 Cb 0.53 -0.99 -0.09 0.00 -0.71 0.00 0.00 39.64 38.38 1l27 n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 1l27 s TYR 18 N -0.69 0.94 -0.14 1.39 -0.85 0.56 -4.96 117.35 113.60 1l27 s TYR 18 Ca 0.64 -1.20 -0.07 0.00 -0.52 0.00 0.00 57.07 55.91 1l27 s TYR 18 Cb -0.75 -0.37 -0.04 0.00 0.38 0.00 0.00 41.96 41.18 1l27 s TYR 18 CO 0.56 -0.71 0.11 0.15 -1.52 0.00 0.00 175.55 174.15 1l27 s LYS 19 N -4.11 3.64 0.25 -3.49 1.02 -1.26 -0.70 119.74 115.09 1l27 s LYS 19 Ca 0.33 -0.21 -0.04 0.00 0.02 0.00 0.00 55.97 56.08 1l27 s LYS 19 Cb 0.05 -3.21 0.06 0.00 -0.52 0.00 0.00 37.83 34.22 1l27 s LYS 19 CO 0.10 0.60 0.32 -0.40 -0.92 0.00 0.00 175.35 175.05 1l27 n ASP 20 N 2.55 -0.16 0.24 2.83 3.85 0.96 -4.81 116.55 122.01 1l27 n ASP 20 Ca -0.18 -1.06 0.08 0.00 -0.71 0.00 0.00 54.79 52.91 1l27 n ASP 20 Cb 0.54 -0.25 0.58 0.00 -1.35 0.00 0.00 41.12 40.64 1l27 n ASP 20 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.20 176.90 1l27 h THR 21 N -1.28 0.97 -0.01 2.12 1.35 -1.99 -0.65 112.91 113.42 1l27 h THR 21 Ca -0.11 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.23 1l27 h THR 21 Cb 0.30 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.01 1l27 h THR 21 CO 0.07 0.14 -0.07 -0.62 -0.25 0.00 0.00 175.52 174.80 1l27 n GLU 22 N -4.18 1.09 -0.53 4.72 -0.58 -1.26 -4.90 120.64 115.00 1l27 n GLU 22 Ca -0.02 -0.45 0.00 0.00 -0.42 0.00 0.00 57.16 56.26 1l27 n GLU 22 Cb 0.22 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.60 1l27 n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1l27 n GLY 23 N 1.20 0.71 3.89 0.62 0.00 -0.25 -5.07 105.19 106.29 1l27 n GLY 23 Ca 0.18 -0.23 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 1l27 n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1l27 s TYR 24 N -2.00 3.47 -0.01 1.61 4.12 -1.26 -4.63 117.35 118.65 1l27 s TYR 24 Ca 0.00 0.60 -0.30 0.00 0.02 0.00 0.00 57.07 57.39 1l27 s TYR 24 Cb 0.00 -2.04 -0.06 0.00 -1.52 0.00 0.00 41.96 38.33 1l27 s TYR 24 CO 0.00 0.40 1.58 0.71 0.02 0.00 0.00 175.55 178.26 1l27 s TYR 25 N -1.70 2.36 0.11 2.71 4.12 -1.22 -0.03 117.35 123.71 1l27 s TYR 25 Ca 0.42 0.42 -0.00 0.00 0.02 0.00 0.00 57.07 57.93 1l27 s TYR 25 Cb -0.12 -3.85 -0.04 0.00 -1.52 0.00 0.00 41.96 36.43 1l27 s TYR 25 CO 0.24 -3.43 0.01 0.99 0.02 0.00 0.00 175.55 173.38 1l27 s THR 26 N 3.18 0.32 0.14 -0.71 2.01 0.13 0.00 115.64 120.71 1l27 s THR 26 Ca 0.70 -1.90 -0.16 0.00 0.31 0.00 0.00 61.69 60.65 1l27 s THR 26 Cb -0.34 -1.87 0.03 0.00 0.01 0.00 0.00 72.50 70.32 1l27 s THR 26 CO 0.29 -0.66 0.41 -0.51 -0.69 0.00 0.00 174.62 173.46 1l27 s ILE 27 N -3.88 0.06 0.00 1.82 2.07 -0.99 -0.32 121.20 119.96 1l27 s ILE 27 Ca 0.18 -0.70 0.00 0.00 -1.41 0.00 0.00 60.65 58.72 1l27 s ILE 27 Cb 0.07 -1.32 0.00 0.00 0.13 0.00 0.00 42.46 41.35 1l27 s ILE 27 CO -0.02 -0.28 0.00 0.61 -1.91 0.00 0.00 174.94 173.34 1l27 n GLY 28 N -0.25 1.80 3.12 1.50 0.00 0.95 -1.83 105.19 110.48 1l27 n GLY 28 Ca -0.14 -0.48 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 1l27 n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1l27 n ILE 29 N 0.00 4.98 -2.04 -0.61 5.41 -1.26 -1.71 119.36 124.13 1l27 n ILE 29 Ca 0.00 -5.72 -0.14 0.00 1.00 0.00 0.00 62.75 57.89 1l27 n ILE 29 Cb 0.00 -2.27 -0.02 0.00 -0.71 0.00 0.00 39.64 36.64 1l27 n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1l27 n GLY 30 N 1.82 0.25 3.50 7.39 0.00 -1.25 -4.91 105.19 111.98 1l27 n GLY 30 Ca 0.25 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 1l27 n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1l27 s HIS 31 N -2.66 2.52 0.20 1.61 5.04 -0.76 -4.94 115.29 116.29 1l27 s HIS 31 Ca 0.00 -0.30 -0.32 0.00 -1.54 0.00 0.00 55.06 52.90 1l27 s HIS 31 Cb 0.00 -4.42 -0.12 0.00 0.04 0.00 0.00 32.58 28.08 1l27 s HIS 31 CO 0.00 -1.80 1.72 -0.11 -2.34 0.00 0.00 174.74 172.21 1l27 n LEU 32 N 8.38 3.92 -0.11 8.88 7.94 -1.26 -2.35 117.00 142.40 1l27 n LEU 32 Ca -0.01 1.06 -0.25 0.00 -1.11 0.00 0.00 56.01 55.70 1l27 n LEU 32 Cb 0.47 -1.56 -0.11 0.00 0.53 0.00 0.00 43.42 42.75 1l27 n LEU 32 CO 0.67 0.14 -0.93 0.18 -1.11 0.00 0.00 177.39 176.34 1l27 n LEU 33 N 4.08 1.98 -3.53 -1.96 4.77 0.10 -4.95 117.00 117.49 1l27 n LEU 33 Ca 0.16 0.36 -0.18 0.00 -0.03 0.00 0.00 56.01 56.32 1l27 n LEU 33 Cb 0.34 -0.92 -0.06 0.00 -2.33 0.00 0.00 43.42 40.46 1l27 n LEU 33 CO 0.64 0.45 0.43 0.28 -1.33 0.00 0.00 177.39 177.86 1l27 s THR 34 N -2.44 0.00 -2.17 -5.08 -1.32 -1.17 -4.94 115.64 98.52 1l27 s THR 34 Ca -0.33 -0.02 0.28 0.00 -1.21 0.00 0.00 61.69 60.42 1l27 s THR 34 Cb 0.10 -0.99 0.49 0.00 -1.51 0.00 0.00 72.50 70.59 1l27 s THR 34 CO 0.56 -0.01 1.75 0.29 -2.21 0.00 0.00 174.62 175.00 1l27 n LYS 35 N 0.90 1.29 -2.47 7.08 5.02 -1.26 -3.44 118.16 125.28 1l27 n LYS 35 Ca -0.19 -0.69 -0.37 0.00 -2.02 0.00 0.00 58.31 55.04 1l27 n LYS 35 Cb 0.57 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 34.06 1l27 n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1l27 s SER 36 N -2.18 6.70 0.00 4.39 0.15 -1.26 -4.94 113.70 116.56 1l27 s SER 36 Ca 0.34 2.13 0.23 0.00 0.70 0.00 0.00 55.95 59.35 1l27 s SER 36 Cb 0.20 -2.59 1.06 0.00 -1.71 0.00 0.00 66.02 62.98 1l27 s SER 36 CO 0.40 -0.54 1.74 -2.65 1.20 0.00 0.00 173.24 173.40 1l27 n PRO 37 N 0.01 0.16 -3.05 5.44 -0.02 -1.26 -4.73 135.00 131.55 1l27 n PRO 37 Ca 0.05 0.09 -0.41 0.00 -2.02 0.00 0.00 63.50 61.21 1l27 n PRO 37 Cb 0.49 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.41 1l27 n PRO 37 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1l27 s SER 38 N -2.79 6.66 0.62 2.55 0.15 -1.26 -4.86 113.70 114.77 1l27 s SER 38 Ca 0.16 0.81 0.38 0.00 0.70 0.00 0.00 55.95 58.01 1l27 s SER 38 Cb 0.15 -2.36 2.10 0.00 -1.71 0.00 0.00 66.02 64.19 1l27 s SER 38 CO 0.38 -0.39 2.28 0.25 1.20 0.00 0.00 173.24 176.96 1l27 h LEU 39 N 8.89 0.00 -0.04 3.45 5.85 -1.99 -0.91 115.31 130.57 1l27 h LEU 39 Ca -0.26 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.32 1l27 h LEU 39 Cb 1.12 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.16 1l27 h LEU 39 CO 0.80 0.01 -0.52 0.78 -0.34 0.00 0.00 178.44 179.17 1l27 h ASN 40 N 0.00 0.52 -0.56 1.25 2.35 -1.96 0.29 115.58 117.47 1l27 h ASN 40 Ca -0.00 -0.71 0.03 0.00 -0.55 0.00 0.00 56.30 55.07 1l27 h ASN 40 Cb 0.08 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.26 1l27 h ASN 40 CO 0.00 1.16 0.37 0.00 -1.65 0.00 0.00 177.43 177.31 1l27 h ALA 41 N 0.37 1.69 -0.27 -0.83 0.00 -1.59 -2.06 119.26 116.58 1l27 h ALA 41 Ca -0.05 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1l27 h ALA 41 Cb 1.20 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 1l27 h ALA 41 CO 0.10 0.25 -0.25 0.00 0.00 0.00 0.00 179.25 179.36 1l27 h ALA 42 N 1.67 0.39 -0.02 0.00 0.00 -1.06 -1.99 119.26 118.25 1l27 h ALA 42 Ca 0.22 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1l27 h ALA 42 Cb 0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1l27 h ALA 42 CO -0.06 0.37 -0.28 0.87 0.00 0.00 0.00 179.25 180.16 1l27 h LYS 43 N 0.37 0.03 -0.13 0.00 1.57 -0.50 -1.45 116.57 116.46 1l27 h LYS 43 Ca 0.05 -0.01 -0.15 0.00 -1.87 0.00 0.00 60.65 58.66 1l27 h LYS 43 Cb 0.80 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.12 1l27 h LYS 43 CO 0.06 0.31 -0.51 1.03 -0.57 0.00 0.00 179.45 179.77 1l27 h SER 44 N 0.03 0.68 -0.83 0.86 0.87 -1.26 -2.18 113.55 111.72 1l27 h SER 44 Ca 0.00 -0.62 -0.03 0.00 -1.23 0.00 0.00 61.79 59.92 1l27 h SER 44 Cb 0.51 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.23 1l27 h SER 44 CO 0.04 1.18 0.40 -0.33 -0.53 0.00 0.00 176.83 177.59 1l27 h GLU 45 N 0.22 1.19 -0.22 2.24 4.39 -1.20 -2.06 114.58 119.13 1l27 h GLU 45 Ca -0.03 -0.17 0.01 0.00 0.34 0.00 0.00 59.36 59.51 1l27 h GLU 45 Cb 1.14 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 29.56 1l27 h GLU 45 CO 0.11 0.91 0.11 1.25 -1.16 0.00 0.00 179.01 180.23 1l27 h LEU 46 N 1.18 0.17 -1.11 1.33 5.85 -1.20 0.54 115.31 122.07 1l27 h LEU 46 Ca 0.29 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.97 1l27 h LEU 46 Cb 0.11 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1l27 h LEU 46 CO -0.04 0.13 0.10 0.44 -0.34 0.00 0.00 178.44 178.74 1l27 h ASP 47 N 0.24 0.68 -0.63 1.25 3.32 -1.25 -0.98 116.42 119.05 1l27 h ASP 47 Ca 0.09 -0.12 -0.08 0.00 0.02 0.00 0.00 57.03 56.94 1l27 h ASP 47 Cb 0.02 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 1l27 h ASP 47 CO -0.06 0.68 0.08 0.50 -1.72 0.00 0.00 179.24 178.72 1l27 h LYS 48 N 0.70 1.07 -0.23 3.56 3.64 -1.08 0.12 116.57 124.36 1l27 h LYS 48 Ca 0.16 -0.29 -0.16 0.00 -1.27 0.00 0.00 60.65 59.08 1l27 h LYS 48 Cb 0.29 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 1l27 h LYS 48 CO 0.00 0.99 -0.51 0.00 -2.27 0.00 0.00 179.45 177.66 1l27 h ALA 49 N 1.08 0.68 0.00 5.00 0.00 -0.13 -3.30 119.26 122.59 1l27 h ALA 49 Ca 0.19 -0.50 -0.24 0.00 0.00 0.00 0.00 54.91 54.37 1l27 h ALA 49 Cb 0.46 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1l27 h ALA 49 CO 0.02 0.68 -1.74 -0.89 0.00 0.00 0.00 179.25 177.31 1l27 n ILE 50 N -3.99 1.31 -0.64 0.00 2.08 -0.45 -4.99 119.36 112.69 1l27 n ILE 50 Ca -0.03 -0.75 0.00 0.00 0.56 0.00 0.00 62.75 62.53 1l27 n ILE 50 Cb 0.59 -0.75 0.00 0.00 -0.75 0.00 0.00 39.64 38.73 1l27 n ILE 50 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1l27 n GLY 51 N 1.51 0.61 3.53 7.39 0.00 0.41 -5.05 105.19 113.60 1l27 n GLY 51 Ca -0.16 -0.67 -0.10 0.00 0.00 0.00 0.00 46.02 45.09 1l27 n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1l27 s ARG 52 N -1.23 1.55 -0.53 1.61 1.70 -1.14 -5.05 118.95 115.85 1l27 s ARG 52 Ca 0.00 -1.35 -0.26 0.00 -0.47 0.00 0.00 55.73 53.65 1l27 s ARG 52 Cb 0.00 0.45 0.03 0.00 -0.57 0.00 0.00 34.95 34.86 1l27 s ARG 52 CO 0.00 -0.63 1.00 -0.80 -1.08 0.00 0.00 175.30 173.79 1l27 s ASN 53 N -3.06 6.43 -0.06 -2.89 -0.87 -1.26 -4.37 114.94 108.86 1l27 s ASN 53 Ca 0.25 -0.06 0.18 0.00 -1.57 0.00 0.00 52.86 51.66 1l27 s ASN 53 Cb 0.00 -2.47 -0.23 0.00 -0.02 0.00 0.00 41.25 38.53 1l27 s ASN 53 CO 0.11 -1.23 0.46 0.00 -2.57 0.00 0.00 177.10 173.86 1l27 n ASN 55 N -2.73 -4.81 0.00 0.00 5.15 -1.26 -2.24 115.26 109.37 1l27 n ASN 55 Ca -0.18 -0.53 0.00 0.00 -0.60 0.00 0.00 54.58 53.27 1l27 n ASN 55 Cb 0.93 -4.81 0.00 0.00 -0.53 0.00 0.00 39.78 35.37 1l27 n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1l27 n GLY 56 N -1.67 0.55 3.04 8.20 0.00 -1.26 -4.99 105.19 109.06 1l27 n GLY 56 Ca -0.08 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.77 1l27 n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1l27 s VAL 57 N -2.49 0.69 0.21 1.61 1.01 -0.95 -2.12 120.40 118.36 1l27 s VAL 57 Ca 0.00 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.38 1l27 s VAL 57 Cb 0.00 -0.63 -0.05 0.00 0.00 0.00 0.00 36.38 35.70 1l27 s VAL 57 CO 0.00 0.01 0.01 0.27 0.00 0.00 0.00 175.10 175.39 1l27 s ILE 58 N -0.58 0.86 0.55 2.22 -4.36 -0.52 -4.73 121.20 114.63 1l27 s ILE 58 Ca -0.00 -2.01 -0.01 0.00 -0.26 0.00 0.00 60.65 58.37 1l27 s ILE 58 Cb -0.05 -2.30 0.02 0.00 1.25 0.00 0.00 42.46 41.38 1l27 s ILE 58 CO 0.00 -0.34 0.79 0.42 0.24 0.00 0.00 174.94 176.05 1l27 s THR 59 N -3.54 3.06 0.17 8.37 -4.23 -1.26 -4.77 115.64 113.44 1l27 s THR 59 Ca 0.28 -0.52 -0.15 0.00 -1.18 0.00 0.00 61.69 60.13 1l27 s THR 59 Cb 0.06 -3.17 0.05 0.00 1.34 0.00 0.00 72.50 70.79 1l27 s THR 59 CO 0.08 -0.13 1.75 0.50 -0.54 0.00 0.00 174.62 176.28 1l27 h LYS 60 N 0.06 0.30 -0.63 3.99 3.64 -1.99 -1.41 116.57 120.52 1l27 h LYS 60 Ca -0.44 -0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.04 1l27 h LYS 60 Cb 1.28 -0.07 -0.08 0.00 -0.41 0.00 0.00 32.23 32.95 1l27 h LYS 60 CO 0.55 0.20 0.20 -0.44 -2.27 0.00 0.00 179.45 177.69 1l27 h ASP 61 N 0.31 0.15 -0.20 4.20 3.32 -1.99 -0.51 116.42 121.71 1l27 h ASP 61 Ca 0.20 0.10 -0.10 0.00 0.02 0.00 0.00 57.03 57.24 1l27 h ASP 61 Cb 0.18 0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 1l27 h ASP 61 CO -0.20 0.08 -0.22 -0.33 -1.72 0.00 0.00 179.24 176.84 1l27 h GLU 62 N 0.35 0.65 -0.44 3.56 5.08 -1.77 -1.40 114.58 120.61 1l27 h GLU 62 Ca 0.33 -0.25 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 1l27 h GLU 62 Cb 0.47 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1l27 h GLU 62 CO -0.37 0.82 0.09 0.00 -1.00 0.00 0.00 179.01 178.56 1l27 h ALA 63 N 1.18 0.58 -0.12 3.43 0.00 -0.47 -2.24 119.26 121.62 1l27 h ALA 63 Ca 0.08 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 1l27 h ALA 63 Cb 0.69 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1l27 h ALA 63 CO 0.05 0.28 -0.36 0.93 0.00 0.00 0.00 179.25 180.15 1l27 h GLU 64 N 0.58 0.26 -0.04 0.00 5.08 -1.02 -1.31 114.58 118.13 1l27 h GLU 64 Ca 0.14 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1l27 h GLU 64 Cb 0.34 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1l27 h GLU 64 CO 0.00 0.59 0.01 -0.22 -1.00 0.00 0.00 179.01 178.40 1l27 h LYS 65 N 0.22 0.07 -0.96 2.33 3.64 -0.97 -0.52 116.57 120.37 1l27 h LYS 65 Ca 0.03 -0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.49 1l27 h LYS 65 Cb 0.75 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.48 1l27 h LYS 65 CO 0.06 0.26 0.60 -0.07 -2.27 0.00 0.00 179.45 178.02 1l27 h LEU 66 N -0.14 0.90 -0.24 5.20 3.38 -1.34 -1.37 115.31 121.71 1l27 h LEU 66 Ca 0.01 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1l27 h LEU 66 Cb 0.22 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1l27 h LEU 66 CO -0.00 0.51 0.12 0.15 0.09 0.00 0.00 178.44 179.31 1l27 h PHE 67 N 0.99 0.34 -0.41 1.13 -0.00 -0.97 0.11 116.94 118.14 1l27 h PHE 67 Ca 0.46 -0.01 0.05 0.00 -0.00 0.00 0.00 57.97 58.47 1l27 h PHE 67 Cb 0.39 -0.11 -0.05 0.00 -0.00 0.00 0.00 35.95 36.19 1l27 h PHE 67 CO -0.02 0.32 0.14 -0.91 -0.00 0.00 0.00 178.31 177.84 1l27 h ASN 68 N 0.26 0.13 -0.69 0.41 -0.26 -0.39 -1.54 115.58 113.51 1l27 h ASN 68 Ca 0.08 0.05 0.02 0.00 -0.56 0.00 0.00 56.30 55.89 1l27 h ASN 68 Cb 0.11 0.04 -0.04 0.00 -1.06 0.00 0.00 38.32 37.37 1l27 h ASN 68 CO -0.01 0.11 0.44 1.56 -1.06 0.00 0.00 177.43 178.47 1l27 h GLN 69 N 0.29 0.86 -0.60 0.81 4.20 -0.94 -2.04 115.11 117.70 1l27 h GLN 69 Ca 0.19 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.77 1l27 h GLN 69 Cb 0.18 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.75 1l27 h GLN 69 CO -0.20 0.57 0.04 -0.44 -0.67 0.00 0.00 178.83 178.13 1l27 h ASP 70 N 0.88 0.97 -0.22 1.46 3.32 -0.50 -1.22 116.42 121.12 1l27 h ASP 70 Ca 0.27 -0.25 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 1l27 h ASP 70 Cb -0.04 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.25 1l27 h ASP 70 CO -0.08 1.00 -0.02 0.58 -1.72 0.00 0.00 179.24 178.99 1l27 h VAL 71 N 0.93 1.27 -0.24 -1.35 2.07 -1.19 0.08 116.25 117.83 1l27 h VAL 71 Ca 0.18 -0.96 0.05 0.00 0.82 0.00 0.00 66.70 66.79 1l27 h VAL 71 Cb 0.48 1.46 -0.05 0.00 -1.52 0.00 0.00 31.29 31.65 1l27 h VAL 71 CO 0.02 0.29 -0.10 -0.78 0.02 0.00 0.00 177.57 177.02 1l27 h ASP 72 N 0.16 -0.35 -0.77 0.57 1.82 -1.34 -0.93 116.42 115.58 1l27 h ASP 72 Ca 0.06 0.09 -0.03 0.00 -0.39 0.00 0.00 57.03 56.76 1l27 h ASP 72 Cb 0.45 0.20 -0.04 0.00 0.68 0.00 0.00 39.33 40.62 1l27 h ASP 72 CO 0.02 -0.13 0.38 0.00 -1.61 0.00 0.00 179.24 177.89 1l27 h ALA 73 N 1.14 1.21 0.28 -0.78 0.00 -1.15 -0.83 119.26 119.13 1l27 h ALA 73 Ca 0.13 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1l27 h ALA 73 Cb 0.26 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1l27 h ALA 73 CO -0.29 0.61 -0.14 0.00 0.00 0.00 0.00 179.25 179.43 1l27 h ALA 74 N 1.32 -0.39 -0.17 0.00 0.00 -0.19 0.51 119.26 120.34 1l27 h ALA 74 Ca 0.27 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.14 1l27 h ALA 74 Cb 0.10 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 1l27 h ALA 74 CO -0.04 -0.72 -0.08 0.28 0.00 0.00 0.00 179.25 178.69 1l27 h VAL 75 N -0.39 0.74 -0.69 0.00 2.07 -1.01 -1.58 116.25 115.39 1l27 h VAL 75 Ca -0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1l27 h VAL 75 Cb 0.31 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 1l27 h VAL 75 CO 0.05 0.00 0.43 0.03 0.02 0.00 0.00 177.57 178.11 1l27 h ARG 76 N -0.06 0.92 -0.50 1.57 3.08 -1.09 -1.57 114.38 116.73 1l27 h ARG 76 Ca 0.09 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 1l27 h ARG 76 Cb 0.20 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1l27 h ARG 76 CO -0.21 0.63 0.02 0.78 -1.07 0.00 0.00 179.97 180.12 1l27 h GLY 77 N 0.96 0.94 0.94 0.04 0.00 -0.54 -1.82 103.07 103.59 1l27 h GLY 77 Ca 0.25 -0.67 0.02 0.00 0.00 0.00 0.00 47.33 46.92 1l27 h GLY 77 CO -0.05 0.62 0.39 -2.22 0.00 0.00 0.00 176.54 175.28 1l27 h ILE 78 N 0.73 1.12 0.00 2.60 2.04 -0.58 -2.46 117.51 120.96 1l27 h ILE 78 Ca 0.14 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 1l27 h ILE 78 Cb 0.49 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 1l27 h ILE 78 CO 0.02 0.14 -0.03 -0.07 0.00 0.00 0.00 178.15 178.22 1l27 h LEU 79 N 0.78 0.00 0.00 1.44 3.38 -0.93 -2.48 115.31 117.49 1l27 h LEU 79 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1l27 h LEU 79 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1l27 h LEU 79 CO -0.07 0.03 -0.95 0.54 0.09 0.00 0.00 178.44 178.07 1l27 n ARG 80 N -3.14 0.23 -3.56 1.13 1.74 -0.72 -4.81 116.66 107.53 1l27 n ARG 80 Ca 0.00 -0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.70 1l27 n ARG 80 Cb 0.30 -1.57 -0.10 0.00 -1.02 0.00 0.00 32.46 30.06 1l27 n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1l27 s ASN 81 N -3.73 6.09 0.14 0.55 3.84 -0.94 -5.00 114.94 115.89 1l27 s ASN 81 Ca 0.05 0.08 -0.30 0.00 0.21 0.00 0.00 52.86 52.90 1l27 s ASN 81 Cb 0.15 -2.14 -0.06 0.00 -0.55 0.00 0.00 41.25 38.65 1l27 s ASN 81 CO 0.79 -0.06 1.56 0.00 -2.79 0.00 0.00 177.10 176.60 1l27 h ALA 82 N 8.18 -0.63 -0.16 1.71 0.00 -1.88 0.43 119.26 126.90 1l27 h ALA 82 Ca -0.35 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.62 1l27 h ALA 82 Cb 1.18 1.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.99 1l27 h ALA 82 CO 0.59 -0.98 0.01 0.87 0.00 0.00 0.00 179.25 179.75 1l27 h LYS 83 N -0.36 0.07 0.17 0.00 1.57 -1.94 -2.56 116.57 113.52 1l27 h LYS 83 Ca 0.10 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 1l27 h LYS 83 Cb 0.59 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.89 1l27 h LYS 83 CO -0.60 0.05 -0.08 -0.07 -0.57 0.00 0.00 179.45 178.17 1l27 h LEU 84 N 0.08 -0.19 -0.81 2.94 3.38 -1.73 -3.04 115.31 115.94 1l27 h LEU 84 Ca 0.07 -0.04 0.13 0.00 0.09 0.00 0.00 57.88 58.13 1l27 h LEU 84 Cb 0.08 0.05 -0.09 0.00 0.09 0.00 0.00 40.66 40.79 1l27 h LEU 84 CO -0.11 -0.08 0.40 0.50 0.09 0.00 0.00 178.44 179.24 1l27 h LYS 85 N -0.29 0.59 -0.75 1.13 3.64 -0.55 -0.13 116.57 120.21 1l27 h LYS 85 Ca -0.02 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.29 1l27 h LYS 85 Cb 0.22 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 1l27 h LYS 85 CO 0.04 0.39 0.35 -0.44 -2.27 0.00 0.00 179.45 177.52 1l27 h ASP 86 N 0.61 1.00 -0.07 4.20 3.32 -1.39 -0.52 116.42 123.56 1l27 h ASP 86 Ca 0.43 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.33 1l27 h ASP 86 Cb 0.57 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.86 1l27 h ASP 86 CO -0.34 0.86 0.01 0.58 -1.72 0.00 0.00 179.24 178.63 1l27 h VAL 87 N 1.07 1.23 -0.35 -1.35 2.07 -1.25 -2.91 116.25 114.76 1l27 h VAL 87 Ca 0.26 -0.72 0.07 0.00 0.82 0.00 0.00 66.70 67.14 1l27 h VAL 87 Cb 0.14 1.58 -0.07 0.00 -1.52 0.00 0.00 31.29 31.41 1l27 h VAL 87 CO -0.03 0.20 -0.14 0.22 0.02 0.00 0.00 177.57 177.84 1l27 h TYR 88 N -0.14 -0.33 0.00 1.57 5.03 -0.87 -1.18 116.97 121.06 1l27 h TYR 88 Ca 0.02 0.04 -0.01 0.00 2.58 0.00 0.00 58.73 61.36 1l27 h TYR 88 Cb 0.31 0.20 -0.00 0.00 1.55 0.00 0.00 36.73 38.79 1l27 h TYR 88 CO 0.02 -0.21 -0.04 -0.44 -1.32 0.00 0.00 178.16 176.17 1l27 h ASP 89 N -0.07 0.00 1.60 -2.11 3.45 -1.13 -1.48 116.42 116.67 1l27 h ASP 89 Ca 0.17 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.63 1l27 h ASP 89 Cb 0.34 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.11 1l27 h ASP 89 CO -0.40 0.04 0.00 0.77 -1.57 0.00 0.00 179.24 178.09 1l27 h SER 90 N 0.00 0.00 -3.31 6.45 4.64 -1.02 -3.47 113.55 116.85 1l27 h SER 90 Ca -0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 1l27 h SER 90 Cb 0.08 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.19 1l27 h SER 90 CO 0.01 0.00 -0.02 -0.76 -0.87 0.00 0.00 176.83 175.19 1l27 s LEU 91 N -4.93 3.84 0.98 5.97 1.43 -0.56 -5.06 118.68 120.34 1l27 s LEU 91 Ca 0.10 0.78 -0.13 0.00 -1.03 0.00 0.00 54.13 53.85 1l27 s LEU 91 Cb 0.11 -3.68 0.18 0.00 0.03 0.00 0.00 46.19 42.82 1l27 s LEU 91 CO 0.61 -0.41 1.13 1.51 0.23 0.00 0.00 176.35 179.42 1l27 s ASP 92 N -3.79 2.88 0.19 2.29 1.47 -1.26 -4.78 116.67 113.67 1l27 s ASP 92 Ca 0.45 0.98 -0.12 0.00 1.18 0.00 0.00 52.55 55.04 1l27 s ASP 92 Cb -0.10 -1.54 0.13 0.00 -0.34 0.00 0.00 42.92 41.07 1l27 s ASP 92 CO 0.38 -2.94 1.84 0.00 0.68 0.00 0.00 175.17 175.12 1l27 h ALA 93 N -1.77 0.78 -0.15 2.11 0.00 -1.97 -1.14 119.26 117.12 1l27 h ALA 93 Ca -0.52 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 1l27 h ALA 93 Cb 1.33 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1l27 h ALA 93 CO 0.57 0.13 0.03 0.28 0.00 0.00 0.00 179.25 180.26 1l27 h VAL 94 N 0.75 1.21 -0.22 0.00 2.07 -1.94 -2.95 116.25 115.17 1l27 h VAL 94 Ca 0.24 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 1l27 h VAL 94 Cb -0.01 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1l27 h VAL 94 CO -0.09 0.20 0.04 0.03 0.02 0.00 0.00 177.57 177.77 1l27 h ARG 95 N 0.04 0.31 -0.93 1.57 3.08 -1.82 -1.17 114.38 115.46 1l27 h ARG 95 Ca 0.05 -0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.10 1l27 h ARG 95 Cb 0.28 -0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.21 1l27 h ARG 95 CO 0.00 0.30 0.60 0.00 -1.07 0.00 0.00 179.97 179.80 1l27 h ARG 96 N 0.31 1.11 -0.94 0.04 3.08 -1.04 -1.78 114.38 115.16 1l27 h ARG 96 Ca 0.08 -0.07 0.02 0.00 0.07 0.00 0.00 59.98 60.08 1l27 h ARG 96 Cb 0.14 -0.25 -0.05 0.00 0.08 0.00 0.00 29.97 29.90 1l27 h ARG 96 CO -0.00 0.73 0.62 0.00 -1.07 0.00 0.00 179.97 180.25 1l27 h ALA 98 N 1.43 0.95 -0.34 0.00 0.00 -1.15 -1.24 119.26 118.91 1l27 h ALA 98 Ca 0.36 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 55.01 1l27 h ALA 98 Cb -0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 1l27 h ALA 98 CO -0.09 0.48 -0.32 1.25 0.00 0.00 0.00 179.25 180.57 1l27 h LEU 99 N 1.03 0.77 -0.67 0.00 5.85 -0.99 -2.31 115.31 118.99 1l27 h LEU 99 Ca 0.26 -0.32 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 1l27 h LEU 99 Cb 0.06 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 1l27 h LEU 99 CO -0.04 1.03 0.29 0.40 -0.34 0.00 0.00 178.44 179.79 1l27 h ILE 100 N 0.62 1.23 -0.25 4.05 2.04 -0.89 -2.22 117.51 122.10 1l27 h ILE 100 Ca 0.07 -0.69 0.03 0.00 1.00 0.00 0.00 64.86 65.27 1l27 h ILE 100 Cb 0.85 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.35 1l27 h ILE 100 CO 0.07 0.28 0.05 -1.13 0.00 0.00 0.00 178.15 177.43 1l27 h ASN 101 N 0.93 0.02 -0.49 1.72 -0.73 -1.03 0.59 115.58 116.59 1l27 h ASN 101 Ca 0.23 0.04 0.05 0.00 1.87 0.00 0.00 56.30 58.48 1l27 h ASN 101 Cb 0.16 0.05 -0.05 0.00 0.27 0.00 0.00 38.32 38.75 1l27 h ASN 101 CO -0.02 0.04 0.23 0.24 -0.37 0.00 0.00 177.43 177.55 1l27 h MET 102 N 0.15 0.43 -0.75 6.67 2.86 -1.21 -1.85 114.93 121.24 1l27 h MET 102 Ca 0.11 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.68 1l27 h MET 102 Cb 0.11 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 1l27 h MET 102 CO -0.15 0.29 0.28 0.28 1.06 0.00 0.00 176.91 178.67 1l27 h VAL 103 N 0.45 1.26 -0.72 -2.22 2.07 -0.90 0.16 116.25 116.34 1l27 h VAL 103 Ca 0.22 -0.84 -0.04 0.00 0.82 0.00 0.00 66.70 66.86 1l27 h VAL 103 Cb 0.16 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 1l27 h VAL 103 CO -0.18 0.34 0.28 0.15 0.02 0.00 0.00 177.57 178.18 1l27 h PHE 104 N 1.10 1.11 -0.04 1.57 3.04 -0.42 0.12 116.94 123.43 1l27 h PHE 104 Ca 0.25 -0.09 -0.04 0.00 3.98 0.00 0.00 57.97 62.07 1l27 h PHE 104 Cb 0.25 -0.33 0.00 0.00 2.56 0.00 0.00 35.95 38.43 1l27 h PHE 104 CO 0.02 0.85 -0.14 0.37 -2.02 0.00 0.00 178.31 177.39 1l27 h GLN 105 N 1.04 0.16 -0.06 1.11 4.15 -1.02 -3.39 115.11 117.10 1l27 h GLN 105 Ca 0.24 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 59.53 1l27 h GLN 105 Cb 0.22 0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.93 1l27 h GLN 105 CO -0.02 0.77 0.00 0.00 -1.93 0.00 0.00 178.83 177.65 1l27 n MET 106 N -4.61 0.69 -0.14 1.69 0.00 0.52 -5.11 117.12 110.16 1l27 n MET 106 Ca -0.09 -1.13 0.00 0.00 0.00 0.00 0.00 57.70 56.48 1l27 n MET 106 Cb 0.40 -1.13 -0.00 0.00 0.00 0.00 0.00 33.22 32.48 1l27 n MET 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1l27 n GLY 107 N 0.30 -2.85 0.21 3.17 0.00 0.03 -3.91 105.19 102.14 1l27 n GLY 107 Ca 0.05 -1.30 -0.02 0.00 0.00 0.00 0.00 46.02 44.74 1l27 n GLY 107 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1l27 h GLU 108 N -0.02 0.31 -0.11 1.61 4.81 -1.92 -1.87 114.58 117.39 1l27 h GLU 108 Ca -0.00 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1l27 h GLU 108 Cb 0.10 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 1l27 h GLU 108 CO 0.00 0.21 0.05 1.15 -0.73 0.00 0.00 179.01 179.69 1l27 h THR 109 N 0.32 1.12 -0.46 0.32 2.02 -1.97 0.93 112.91 115.20 1l27 h THR 109 Ca 0.26 -0.36 0.06 0.00 0.77 0.00 0.00 66.41 67.14 1l27 h THR 109 Cb 0.31 1.15 -0.05 0.00 -1.74 0.00 0.00 68.15 67.83 1l27 h THR 109 CO -0.29 0.11 0.17 1.23 0.37 0.00 0.00 175.52 177.11 1l27 h GLY 110 N 0.05 0.61 1.20 2.16 0.00 -1.57 -2.33 103.07 103.19 1l27 h GLY 110 Ca 0.04 -0.10 -0.15 0.00 0.00 0.00 0.00 47.33 47.12 1l27 h GLY 110 CO -0.00 0.03 -0.36 -2.08 0.00 0.00 0.00 176.54 174.12 1l27 h VAL 111 N 0.35 1.28 -0.01 4.60 2.07 -1.18 -2.61 116.25 120.74 1l27 h VAL 111 Ca 0.21 -1.53 0.00 0.00 0.82 0.00 0.00 66.70 66.20 1l27 h VAL 111 Cb 0.20 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.34 1l27 h VAL 111 CO -0.21 0.51 0.02 0.00 0.02 0.00 0.00 177.57 177.92 1l27 h ALA 112 N 0.85 1.37 0.00 1.67 0.00 -0.49 0.65 119.26 123.31 1l27 h ALA 112 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1l27 h ALA 112 Cb 0.94 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1l27 h ALA 112 CO 0.09 -0.03 0.00 0.41 0.00 0.00 0.00 179.25 179.72 1l27 n GLY 113 N -1.24 -1.31 2.12 0.00 0.00 -0.91 -3.85 105.19 100.00 1l27 n GLY 113 Ca -0.03 0.07 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 1l27 n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1l27 n PHE 114 N -2.22 0.50 -0.39 1.61 0.99 0.22 -4.76 117.46 113.41 1l27 n PHE 114 Ca 0.02 -1.71 -0.07 0.00 -0.00 0.00 0.00 57.45 55.69 1l27 n PHE 114 Cb 0.24 -1.63 -0.05 0.00 -1.00 0.00 0.00 39.48 37.05 1l27 n PHE 114 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.76 179.17 1l27 n THR 115 N 2.27 -0.61 -0.16 4.37 -1.04 -1.25 -1.40 114.28 116.46 1l27 n THR 115 Ca 0.47 2.31 -0.08 0.00 -2.04 0.00 0.00 64.05 64.71 1l27 n THR 115 Cb 0.79 -2.92 0.01 0.00 -1.82 0.00 0.00 70.33 66.40 1l27 n THR 115 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1l27 h ASN 116 N 0.00 0.62 -0.55 8.00 2.35 -1.95 -2.63 115.58 121.42 1l27 h ASN 116 Ca 0.21 -0.12 -0.03 0.00 -0.55 0.00 0.00 56.30 55.82 1l27 h ASN 116 Cb 0.46 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 1l27 h ASN 116 CO -0.92 0.57 0.25 0.28 -1.65 0.00 0.00 177.43 175.95 1l27 h SER 117 N 0.63 0.74 -0.76 5.81 0.02 -1.81 -2.08 113.55 116.10 1l27 h SER 117 Ca 0.16 -0.15 0.04 0.00 -0.84 0.00 0.00 61.79 61.01 1l27 h SER 117 Cb 0.11 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 62.41 1l27 h SER 117 CO -0.02 0.68 0.47 -0.07 -1.14 0.00 0.00 176.83 176.75 1l27 h LEU 118 N 0.74 0.76 -0.31 5.07 3.38 -1.08 -0.82 115.31 123.06 1l27 h LEU 118 Ca 0.19 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 1l27 h LEU 118 Cb 0.15 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1l27 h LEU 118 CO -0.02 0.52 0.10 -0.09 0.09 0.00 0.00 178.44 179.03 1l27 h ARG 119 N 0.90 0.49 -0.43 1.13 2.43 -1.38 -0.61 114.38 116.91 1l27 h ARG 119 Ca 0.31 -0.11 -0.01 0.00 -0.81 0.00 0.00 59.98 59.36 1l27 h ARG 119 Cb 0.06 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1l27 h ARG 119 CO -0.13 0.54 0.23 0.52 -1.51 0.00 0.00 179.97 179.61 1l27 h MET 120 N 0.35 0.60 -0.54 0.20 2.86 -1.20 -0.91 114.93 116.29 1l27 h MET 120 Ca 0.10 -0.08 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1l27 h MET 120 Cb 0.25 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.77 1l27 h MET 120 CO -0.00 0.50 0.35 -0.07 1.06 0.00 0.00 176.91 178.74 1l27 h LEU 121 N 0.56 0.62 -1.31 1.22 3.38 -0.93 -1.48 115.31 117.37 1l27 h LEU 121 Ca 0.15 -0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.15 1l27 h LEU 121 Cb 0.08 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.62 1l27 h LEU 121 CO -0.02 0.46 0.50 -0.61 0.09 0.00 0.00 178.44 178.86 1l27 h GLN 122 N 0.73 0.82 -0.02 1.13 4.15 -0.77 0.21 115.11 121.36 1l27 h GLN 122 Ca 0.20 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.57 1l27 h GLN 122 Cb -0.07 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 27.44 1l27 h GLN 122 CO -0.04 0.54 0.00 1.04 -1.93 0.00 0.00 178.83 178.44 1l27 n GLN 123 N -4.48 1.17 -2.92 1.69 6.02 -0.38 -4.90 117.38 113.58 1l27 n GLN 123 Ca 0.11 -0.24 -0.22 0.00 -0.01 0.00 0.00 57.00 56.63 1l27 n GLN 123 Cb 0.20 -1.42 0.03 0.00 1.02 0.00 0.00 30.24 30.07 1l27 n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1l27 n LYS 124 N -0.63 -4.36 -3.25 -1.09 5.02 0.72 -4.94 118.16 109.63 1l27 n LYS 124 Ca 0.19 0.93 -0.45 0.00 -2.02 0.00 0.00 58.31 56.96 1l27 n LYS 124 Cb 0.15 -5.76 0.00 0.00 -0.02 0.00 0.00 35.03 29.40 1l27 n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1l27 n ARG 125 N -3.87 3.54 -0.03 1.97 1.74 -0.65 -4.90 116.66 114.46 1l27 n ARG 125 Ca -0.14 -4.34 -0.09 0.00 -0.77 0.00 0.00 57.85 52.52 1l27 n ARG 125 Cb 0.63 -2.64 -0.03 0.00 -1.02 0.00 0.00 32.46 29.40 1l27 n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 1l27 h TRP 126 N 6.69 -0.15 -0.49 -1.55 -0.00 -1.90 0.23 115.95 118.78 1l27 h TRP 126 Ca 0.21 0.02 -0.09 0.00 -0.00 0.00 0.00 58.89 59.03 1l27 h TRP 126 Cb 0.86 0.09 -0.02 0.00 -0.00 0.00 0.00 29.16 30.10 1l27 h TRP 126 CO 0.83 -0.11 -0.03 -0.44 -0.00 0.00 0.00 178.44 178.69 1l27 h ASP 127 N -0.03 0.88 -0.45 -3.49 5.19 -1.90 -2.15 116.42 114.47 1l27 h ASP 127 Ca 0.09 -0.32 -0.07 0.00 -0.62 0.00 0.00 57.03 56.11 1l27 h ASP 127 Cb 0.17 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 39.43 1l27 h ASP 127 CO -0.21 0.99 0.01 -0.33 -3.12 0.00 0.00 179.24 176.59 1l27 h GLU 128 N 0.75 0.78 -0.44 3.56 3.07 -1.92 -2.62 114.58 117.76 1l27 h GLU 128 Ca 0.14 -0.24 -0.05 0.00 -0.50 0.00 0.00 59.36 58.70 1l27 h GLU 128 Cb 0.56 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.38 1l27 h GLU 128 CO 0.03 0.84 0.06 0.00 -1.40 0.00 0.00 179.01 178.54 1l27 h ALA 129 N 0.91 1.29 -0.62 3.43 0.00 -0.82 -2.08 119.26 121.38 1l27 h ALA 129 Ca 0.13 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1l27 h ALA 129 Cb 0.48 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1l27 h ALA 129 CO 0.02 0.49 0.33 0.00 0.00 0.00 0.00 179.25 180.09 1l27 h ALA 130 N 1.42 0.79 -0.33 0.00 0.00 -1.14 0.21 119.26 120.21 1l27 h ALA 130 Ca 0.14 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1l27 h ALA 130 Cb 0.32 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1l27 h ALA 130 CO 0.01 0.32 0.06 0.28 0.00 0.00 0.00 179.25 179.91 1l27 h VAL 131 N 0.84 1.23 -0.66 0.00 2.07 -1.36 -2.97 116.25 115.40 1l27 h VAL 131 Ca 0.22 -0.80 -0.06 0.00 0.82 0.00 0.00 66.70 66.88 1l27 h VAL 131 Cb 0.06 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1l27 h VAL 131 CO -0.03 0.27 0.19 -1.13 0.02 0.00 0.00 177.57 176.88 1l27 h ASN 132 N 0.37 0.97 -0.01 0.57 -0.73 -1.11 -2.98 115.58 112.66 1l27 h ASN 132 Ca 0.10 -0.22 -0.03 0.00 1.87 0.00 0.00 56.30 58.03 1l27 h ASN 132 Cb 0.34 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 38.66 1l27 h ASN 132 CO 0.01 0.93 -0.05 -0.07 -0.37 0.00 0.00 177.43 177.88 1l27 h LEU 133 N 0.96 0.16 -1.52 0.34 3.38 -0.93 -2.68 115.31 115.03 1l27 h LEU 133 Ca 0.21 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1l27 h LEU 133 Cb 0.32 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1l27 h LEU 133 CO -0.00 0.24 0.00 0.00 0.09 0.00 0.00 178.44 178.76 1l27 h ALA 134 N 1.79 1.00 -0.65 1.53 0.00 -1.36 -3.34 119.26 118.22 1l27 h ALA 134 Ca 0.04 0.00 -0.74 0.00 0.00 0.00 0.00 54.91 54.21 1l27 h ALA 134 Cb 0.20 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 17.88 1l27 h ALA 134 CO 0.01 0.00 2.44 1.63 0.00 0.00 0.00 179.25 183.33 1l27 n LYS 135 N -2.94 4.10 -3.75 0.00 5.02 -1.01 -4.66 118.16 114.92 1l27 n LYS 135 Ca 0.00 -3.34 -0.11 0.00 -2.02 0.00 0.00 58.31 52.85 1l27 n LYS 135 Cb 0.26 -2.78 -0.07 0.00 -0.02 0.00 0.00 35.03 32.42 1l27 n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1l27 s SER 136 N 0.81 -0.11 0.22 4.39 1.04 -1.26 -5.03 113.70 113.77 1l27 s SER 136 Ca 0.50 -0.24 -0.08 0.00 0.48 0.00 0.00 55.95 56.61 1l27 s SER 136 Cb 0.15 0.36 0.29 0.00 0.10 0.00 0.00 66.02 66.92 1l27 s SER 136 CO -0.06 -0.64 1.79 -0.09 0.98 0.00 0.00 173.24 175.23 1l27 h ARG 137 N 3.13 0.63 -0.74 4.02 2.43 -1.93 -2.31 114.38 119.60 1l27 h ARG 137 Ca -0.32 -0.04 0.12 0.00 -0.81 0.00 0.00 59.98 58.93 1l27 h ARG 137 Cb 1.20 -0.14 -0.13 0.00 -0.42 0.00 0.00 29.97 30.48 1l27 h ARG 137 CO 0.47 0.42 -0.38 2.35 -1.51 0.00 0.00 179.97 181.32 1l27 h TRP 138 N 0.65 -1.07 -0.46 2.20 7.01 -1.95 0.30 115.95 122.62 1l27 h TRP 138 Ca 0.33 0.09 -0.05 0.00 2.11 0.00 0.00 58.89 61.36 1l27 h TRP 138 Cb 0.28 0.58 -0.02 0.00 -2.10 0.00 0.00 29.16 27.90 1l27 h TRP 138 CO -0.09 -0.40 0.08 -0.92 -2.79 0.00 0.00 178.44 174.32 1l27 h TYR 139 N -0.11 0.82 -0.12 2.65 3.20 -1.75 -1.50 116.97 120.16 1l27 h TYR 139 Ca 0.26 -0.11 -0.09 0.00 3.14 0.00 0.00 58.73 61.93 1l27 h TYR 139 Cb 0.56 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 1l27 h TYR 139 CO -0.74 0.76 -0.32 -0.91 -1.64 0.00 0.00 178.16 175.31 1l27 h ASN 140 N 0.63 0.23 0.21 -2.11 4.21 -0.69 -2.35 115.58 115.72 1l27 h ASN 140 Ca 0.14 -0.08 -0.29 0.00 1.21 0.00 0.00 56.30 57.28 1l27 h ASN 140 Cb 0.38 -0.06 0.03 0.00 -1.12 0.00 0.00 38.32 37.55 1l27 h ASN 140 CO 0.01 0.55 -1.30 1.56 -1.29 0.00 0.00 177.43 176.95 1l27 h GLN 141 N 0.20 0.44 -2.09 0.81 1.08 -0.35 -3.39 115.11 111.82 1l27 h GLN 141 Ca 0.03 -0.76 -0.57 0.00 -1.45 0.00 0.00 58.65 55.90 1l27 h GLN 141 Cb 0.67 0.28 -0.40 0.00 -0.05 0.00 0.00 27.48 27.98 1l27 h GLN 141 CO 0.05 1.36 -0.89 0.25 -0.95 0.00 0.00 178.83 178.65 1l27 n THR 142 N -3.84 0.72 -0.37 -0.54 -2.24 -0.58 -4.99 114.28 102.44 1l27 n THR 142 Ca -0.17 -4.60 -0.01 0.00 -2.27 0.00 0.00 64.05 57.00 1l27 n THR 142 Cb 1.01 -1.88 0.13 0.00 -2.10 0.00 0.00 70.33 67.49 1l27 n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1l27 h PRO 143 N 3.95 1.25 -0.26 -0.78 0.13 -1.63 -1.19 132.00 133.48 1l27 h PRO 143 Ca 0.13 -0.08 -0.07 0.00 -0.87 0.00 0.00 66.00 65.11 1l27 h PRO 143 Cb 0.78 -0.28 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 1l27 h PRO 143 CO 0.63 0.83 -0.11 -0.91 -0.23 0.00 0.00 178.00 178.21 1l27 h ASN 144 N 1.29 0.54 -0.09 1.44 -0.26 -1.94 0.04 115.58 116.60 1l27 h ASN 144 Ca 0.39 -0.40 -0.01 0.00 -0.56 0.00 0.00 56.30 55.72 1l27 h ASN 144 Cb -0.05 -0.15 -0.00 0.00 -1.06 0.00 0.00 38.32 37.06 1l27 h ASN 144 CO -0.11 0.82 0.03 -0.09 -1.06 0.00 0.00 177.43 177.02 1l27 h ARG 145 N 0.26 0.13 -0.69 0.81 2.43 -1.97 -2.31 114.38 113.04 1l27 h ARG 145 Ca 0.06 -0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.29 1l27 h ARG 145 Cb 0.61 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 30.07 1l27 h ARG 145 CO 0.03 0.26 0.35 0.00 -1.51 0.00 0.00 179.97 179.11 1l27 h ALA 146 N 0.87 0.94 -0.95 2.80 0.00 -1.14 -1.79 119.26 119.99 1l27 h ALA 146 Ca 0.03 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1l27 h ALA 146 Cb 0.18 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 1l27 h ALA 146 CO -0.00 -0.02 0.60 0.87 0.00 0.00 0.00 179.25 180.69 1l27 h LYS 147 N 0.62 1.28 -0.26 0.00 1.57 -0.93 0.88 116.57 119.73 1l27 h LYS 147 Ca 0.33 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1l27 h LYS 147 Cb 0.31 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1l27 h LYS 147 CO -0.24 0.87 0.17 0.00 -0.57 0.00 0.00 179.45 179.68 1l27 h ARG 148 N 1.31 0.35 -0.41 3.15 3.08 -0.81 -0.52 114.38 120.53 1l27 h ARG 148 Ca 0.35 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.35 1l27 h ARG 148 Cb -0.10 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 1l27 h ARG 148 CO -0.07 0.25 0.17 0.28 -1.07 0.00 0.00 179.97 179.53 1l27 h VAL 149 N 0.34 1.19 -0.39 2.04 2.07 -0.92 -2.24 116.25 118.34 1l27 h VAL 149 Ca 0.09 -0.58 0.03 0.00 0.82 0.00 0.00 66.70 67.07 1l27 h VAL 149 Cb -0.01 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 1l27 h VAL 149 CO -0.02 0.21 0.19 0.40 0.02 0.00 0.00 177.57 178.37 1l27 h ILE 150 N 0.51 0.97 -0.70 4.57 2.04 -0.78 -1.07 117.51 123.06 1l27 h ILE 150 Ca 0.14 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1l27 h ILE 150 Cb 0.17 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 1l27 h ILE 150 CO -0.01 0.07 0.42 0.74 0.00 0.00 0.00 178.15 179.36 1l27 h THR 151 N 0.39 1.20 -0.78 -0.27 2.02 -0.97 0.13 112.91 114.62 1l27 h THR 151 Ca 0.17 -0.43 -0.05 0.00 0.77 0.00 0.00 66.41 66.87 1l27 h THR 151 Cb 0.08 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 66.68 1l27 h THR 151 CO -0.12 0.21 0.31 0.74 0.37 0.00 0.00 175.52 177.02 1l27 h THR 152 N 0.96 1.26 -0.11 3.16 2.02 -0.75 0.02 112.91 119.47 1l27 h THR 152 Ca 0.25 -0.82 -0.20 0.00 0.77 0.00 0.00 66.41 66.41 1l27 h THR 152 Cb -0.04 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 66.71 1l27 h THR 152 CO -0.05 0.33 -0.74 -0.26 0.37 0.00 0.00 175.52 175.17 1l27 h PHE 153 N 1.13 0.74 0.13 3.16 0.05 -0.46 -0.16 116.94 121.53 1l27 h PHE 153 Ca 0.26 -0.33 -0.01 0.00 3.82 0.00 0.00 57.97 61.72 1l27 h PHE 153 Cb 0.22 -0.11 0.00 0.00 2.00 0.00 0.00 35.95 38.06 1l27 h PHE 153 CO 0.02 1.11 -0.06 -0.09 -0.18 0.00 0.00 178.31 179.11 1l27 h ARG 154 N 0.38 -0.16 0.00 1.51 2.43 -0.54 -3.37 114.38 114.63 1l27 h ARG 154 Ca -0.04 0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 59.01 1l27 h ARG 154 Cb 1.34 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.90 1l27 h ARG 154 CO 0.14 -0.03 -1.79 0.25 -1.51 0.00 0.00 179.97 177.03 1l27 n THR 155 N -5.12 0.75 -1.64 0.20 -2.24 -0.03 -4.79 114.28 101.41 1l27 n THR 155 Ca -0.08 -0.64 -0.11 0.00 -2.27 0.00 0.00 64.05 60.94 1l27 n THR 155 Cb 0.13 -0.37 -0.03 0.00 -2.10 0.00 0.00 70.33 67.96 1l27 n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l27 n GLY 156 N 1.40 0.78 3.47 3.38 0.00 -0.07 -5.00 105.19 109.15 1l27 n GLY 156 Ca -0.12 -0.47 -0.23 0.00 0.00 0.00 0.00 46.02 45.20 1l27 n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1l27 s THR 157 N -2.47 0.78 -0.62 2.61 -4.23 -1.26 -4.80 115.64 105.65 1l27 s THR 157 Ca 0.00 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 58.66 1l27 s THR 157 Cb 0.00 -2.53 0.77 0.00 1.34 0.00 0.00 72.50 72.07 1l27 s THR 157 CO 0.00 0.00 1.68 0.79 -0.54 0.00 0.00 174.62 176.55 1l27 n TRP 158 N -0.78 1.82 -0.28 3.99 7.02 -1.26 -4.60 117.44 123.35 1l27 n TRP 158 Ca -0.04 -0.66 0.20 0.00 -1.02 0.00 0.00 57.50 55.98 1l27 n TRP 158 Cb 0.66 -0.40 0.49 0.00 -2.42 0.00 0.00 31.31 29.64 1l27 n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1l27 h ASP 159 N 3.94 0.46 0.79 -0.99 3.45 -1.96 -1.69 116.42 120.41 1l27 h ASP 159 Ca 0.00 0.06 -0.00 0.00 0.43 0.00 0.00 57.03 57.52 1l27 h ASP 159 Cb 1.75 -0.02 -0.00 0.00 -0.56 0.00 0.00 39.33 40.49 1l27 h ASP 159 CO 0.38 0.16 -0.00 0.00 -1.57 0.00 0.00 179.24 178.21 1l27 h ALA 160 N 1.61 1.00 -0.01 3.45 0.00 -1.89 -2.78 119.26 120.65 1l27 h ALA 160 Ca 0.52 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.43 1l27 h ALA 160 Cb 1.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1l27 h ALA 160 CO -0.23 0.00 -0.32 0.66 0.00 0.00 0.00 179.25 179.36 1l27 n TYR 161 N -3.09 0.00 1.48 0.00 4.01 -0.66 -4.55 117.16 114.35 1l27 n TYR 161 Ca -0.00 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.87 1l27 n TYR 161 Cb 0.25 0.00 0.52 0.00 -0.31 0.00 0.00 39.34 39.80 1l27 n TYR 161 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1l27 n LYS 162 N -0.26 1.62 0.03 -0.72 5.02 -1.05 -3.16 118.16 119.64 1l27 n LYS 162 Ca 0.06 -0.90 -0.06 0.00 -2.02 0.00 0.00 58.31 55.38 1l27 n LYS 162 Cb 0.29 -1.46 -0.04 0.00 -0.02 0.00 0.00 35.03 33.80 1l27 n LYS 162 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 1l27 h ASN 163 N 2.10 -0.16 0.00 4.39 4.21 -1.80 -3.52 115.58 120.80 1l27 h ASN 163 Ca 0.00 -0.18 0.00 0.00 1.21 0.00 0.00 56.30 57.33 1l27 h ASN 163 Cb 0.45 0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.69 1l27 h ASN 163 CO 0.00 0.39 0.00 0.18 -1.29 0.00 0.00 177.43 176.71