#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l16 s ASN 2 N 0.00 1.49 0.28 6.12 2.20 -1.26 -5.03 114.94 118.74 1l16 s ASN 2 Ca 0.00 -1.60 0.02 0.00 -0.94 0.00 0.00 52.86 50.34 1l16 s ASN 2 Cb 0.00 0.44 0.61 0.00 -2.00 0.00 0.00 41.25 40.30 1l16 s ASN 2 CO 0.00 -0.93 1.78 -0.29 -2.94 0.00 0.00 177.10 174.72 1l16 h ILE 3 N 2.21 0.77 -0.50 0.54 6.09 -1.99 -0.62 117.51 124.02 1l16 h ILE 3 Ca -0.32 -0.26 -0.08 0.00 -1.37 0.00 0.00 64.86 62.83 1l16 h ILE 3 Cb 1.25 -0.06 -0.02 0.00 0.47 0.00 0.00 36.82 38.46 1l16 h ILE 3 CO 0.48 0.14 -0.02 -0.26 -3.07 0.00 0.00 178.15 175.42 1l16 h PHE 4 N 0.76 0.98 -0.46 2.19 -1.00 -1.98 -0.50 116.94 116.92 1l16 h PHE 4 Ca 0.51 -0.18 -0.14 0.00 2.81 0.00 0.00 57.97 60.98 1l16 h PHE 4 Cb 0.70 -0.25 -0.01 0.00 3.61 0.00 0.00 35.95 39.99 1l16 h PHE 4 CO -0.04 0.92 -0.25 0.93 -1.61 0.00 0.00 178.31 178.27 1l16 h GLU 5 N 0.76 0.98 0.33 1.51 5.08 -1.83 -1.46 114.58 119.94 1l16 h GLU 5 Ca 0.14 -0.43 -0.02 0.00 -1.00 0.00 0.00 59.36 58.05 1l16 h GLU 5 Cb 0.54 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1l16 h GLU 5 CO 0.03 1.10 -0.16 1.98 -1.00 0.00 0.00 179.01 180.96 1l16 h MET 6 N 0.83 -0.43 0.00 2.33 4.05 -0.97 -2.65 114.93 118.10 1l16 h MET 6 Ca 0.10 0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.52 1l16 h MET 6 Cb 0.83 0.10 -0.00 0.00 -0.80 0.00 0.00 31.60 31.72 1l16 h MET 6 CO 0.07 -0.23 -0.13 -0.07 0.23 0.00 0.00 176.91 176.78 1l16 h LEU 7 N -0.53 0.00 -0.31 3.39 3.38 -1.06 -2.18 115.31 118.00 1l16 h LEU 7 Ca -0.05 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1l16 h LEU 7 Cb 0.40 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1l16 h LEU 7 CO 0.07 0.13 -0.20 0.08 0.09 0.00 0.00 178.44 178.61 1l16 h ARG 8 N 0.00 0.00 -0.12 1.13 0.11 -0.97 -0.35 114.38 114.18 1l16 h ARG 8 Ca -0.00 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 60.00 1l16 h ARG 8 Cb 0.31 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.39 1l16 h ARG 8 CO 0.02 0.20 -0.23 0.82 0.10 0.00 0.00 179.97 180.88 1l16 h ILE 9 N 0.00 1.38 -0.08 0.08 2.04 -1.07 -0.74 117.51 119.11 1l16 h ILE 9 Ca -0.00 -1.50 -0.13 0.00 1.00 0.00 0.00 64.86 64.22 1l16 h ILE 9 Cb 1.04 2.07 -0.01 0.00 -0.74 0.00 0.00 36.82 39.18 1l16 h ILE 9 CO 0.03 0.44 -0.52 0.44 0.00 0.00 0.00 178.15 178.53 1l16 h ASP 10 N -0.06 0.26 0.00 1.72 3.32 -1.28 -3.34 116.42 117.03 1l16 h ASP 10 Ca 0.00 -0.13 -0.37 0.00 0.02 0.00 0.00 57.03 56.55 1l16 h ASP 10 Cb 0.82 -0.07 -0.07 0.00 0.22 0.00 0.00 39.33 40.23 1l16 h ASP 10 CO 0.05 0.74 -2.41 -0.62 -1.72 0.00 0.00 179.24 175.28 1l16 n GLU 11 N -3.93 0.70 -0.12 3.56 -0.58 -0.16 -5.07 120.64 115.03 1l16 n GLU 11 Ca -0.02 0.05 0.02 0.00 -0.42 0.00 0.00 57.16 56.79 1l16 n GLU 11 Cb 0.56 -1.51 -0.00 0.00 -0.57 0.00 0.00 31.44 29.91 1l16 n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1l16 n GLY 12 N 1.98 -2.11 2.83 0.62 0.00 -0.29 -4.53 105.19 103.70 1l16 n GLY 12 Ca -0.38 -1.44 -0.20 0.00 0.00 0.00 0.00 46.02 44.00 1l16 n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1l16 s LEU 13 N 0.00 1.03 -0.04 0.99 2.96 -1.26 -4.24 118.68 118.12 1l16 s LEU 13 Ca 0.00 -0.09 0.00 0.00 -0.22 0.00 0.00 54.13 53.82 1l16 s LEU 13 Cb 0.00 -0.40 0.03 0.00 0.50 0.00 0.00 46.19 46.32 1l16 s LEU 13 CO 0.00 -0.11 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.78 1l16 s ARG 14 N 1.31 0.48 0.00 1.98 0.52 -0.91 -5.00 118.95 117.34 1l16 s ARG 14 Ca -0.05 0.04 0.27 0.00 -0.52 0.00 0.00 55.73 55.47 1l16 s ARG 14 Cb -0.13 -0.66 0.84 0.00 0.52 0.00 0.00 34.95 35.52 1l16 s ARG 14 CO -0.02 -0.15 1.63 1.28 0.02 0.00 0.00 175.30 178.05 1l16 n LEU 15 N 4.31 1.86 -4.27 2.53 4.77 -1.26 0.11 117.00 125.05 1l16 n LEU 15 Ca -0.22 -0.64 -0.26 0.00 -0.03 0.00 0.00 56.01 54.86 1l16 n LEU 15 Cb 0.50 -0.01 -0.14 0.00 -2.33 0.00 0.00 43.42 41.44 1l16 n LEU 15 CO 0.20 0.32 -0.53 -0.75 -1.33 0.00 0.00 177.39 175.30 1l16 s LYS 16 N -1.97 1.44 0.28 3.23 2.47 -1.26 -1.68 119.74 122.25 1l16 s LYS 16 Ca 0.36 -0.97 -0.29 0.00 -1.56 0.00 0.00 55.97 53.50 1l16 s LYS 16 Cb 0.21 -1.57 -0.14 0.00 -1.46 0.00 0.00 37.83 34.87 1l16 s LYS 16 CO 0.32 0.40 1.16 -0.89 0.16 0.00 0.00 175.35 176.50 1l16 n ILE 17 N 1.82 1.70 -4.10 5.43 5.41 -1.03 -4.75 119.36 123.83 1l16 n ILE 17 Ca -0.17 -0.43 -0.11 0.00 1.00 0.00 0.00 62.75 63.04 1l16 n ILE 17 Cb 0.53 -1.19 -0.07 0.00 -0.71 0.00 0.00 39.64 38.20 1l16 n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 1l16 s TYR 18 N -0.81 0.84 -0.14 1.39 -0.85 0.25 -4.97 117.35 113.06 1l16 s TYR 18 Ca 0.61 -1.10 -0.06 0.00 -0.52 0.00 0.00 57.07 55.99 1l16 s TYR 18 Cb -0.68 -0.19 -0.04 0.00 0.38 0.00 0.00 41.96 41.43 1l16 s TYR 18 CO 0.58 -0.86 0.09 0.15 -1.52 0.00 0.00 175.55 173.99 1l16 s LYS 19 N -3.93 3.55 1.18 -3.49 1.02 -1.26 0.02 119.74 116.84 1l16 s LYS 19 Ca 0.31 -0.25 -0.17 0.00 0.02 0.00 0.00 55.97 55.88 1l16 s LYS 19 Cb 0.03 -3.14 0.22 0.00 -0.52 0.00 0.00 37.83 34.42 1l16 s LYS 19 CO 0.12 0.59 0.48 -0.25 -0.92 0.00 0.00 175.35 175.38 1l16 n ASP 20 N 2.54 -2.49 0.24 2.83 8.00 0.36 -4.80 116.55 123.23 1l16 n ASP 20 Ca -0.18 -0.28 0.10 0.00 0.71 0.00 0.00 54.79 55.14 1l16 n ASP 20 Cb 0.54 -1.04 0.61 0.00 -0.02 0.00 0.00 41.12 41.21 1l16 n ASP 20 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1l16 h THR 21 N -2.57 0.74 -0.00 -3.53 2.02 -2.00 -1.62 112.91 105.96 1l16 h THR 21 Ca -0.53 -0.74 0.00 0.00 0.77 0.00 0.00 66.41 65.91 1l16 h THR 21 Cb 1.29 1.45 0.00 0.00 -1.74 0.00 0.00 68.15 69.15 1l16 h THR 21 CO 0.39 0.18 -0.10 -0.62 0.37 0.00 0.00 175.52 175.73 1l16 n GLU 22 N -3.76 0.27 -0.42 6.66 1.02 -1.26 -4.93 120.64 118.21 1l16 n GLU 22 Ca -0.02 -0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 1l16 n GLU 22 Cb 0.29 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.21 1l16 n GLU 22 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1l16 n GLY 23 N 1.40 0.76 3.87 0.62 0.00 -0.61 -5.06 105.19 106.17 1l16 n GLY 23 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 1l16 n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1l16 s TYR 24 N -2.34 3.44 -0.04 1.61 4.12 -1.26 -4.56 117.35 118.32 1l16 s TYR 24 Ca 0.00 0.88 -0.30 0.00 0.02 0.00 0.00 57.07 57.67 1l16 s TYR 24 Cb 0.00 -2.26 -0.06 0.00 -1.52 0.00 0.00 41.96 38.12 1l16 s TYR 24 CO 0.00 0.29 1.64 0.71 0.02 0.00 0.00 175.55 178.20 1l16 s TYR 25 N -1.79 2.07 0.13 2.71 4.12 -1.22 0.14 117.35 123.51 1l16 s TYR 25 Ca 0.46 0.24 -0.01 0.00 0.02 0.00 0.00 57.07 57.79 1l16 s TYR 25 Cb -0.11 -3.91 -0.04 0.00 -1.52 0.00 0.00 41.96 36.38 1l16 s TYR 25 CO 0.21 -3.77 0.06 0.99 0.02 0.00 0.00 175.55 173.06 1l16 s THR 26 N 3.79 0.10 0.16 -0.71 2.01 0.10 0.35 115.64 121.45 1l16 s THR 26 Ca 0.73 -1.91 -0.15 0.00 0.31 0.00 0.00 61.69 60.67 1l16 s THR 26 Cb -0.34 -2.05 0.02 0.00 0.01 0.00 0.00 72.50 70.14 1l16 s THR 26 CO 0.30 -0.46 0.41 -0.51 -0.69 0.00 0.00 174.62 173.67 1l16 s ILE 27 N -4.05 0.05 0.00 1.82 2.07 -0.86 -0.59 121.20 119.64 1l16 s ILE 27 Ca 0.24 -0.90 0.00 0.00 -1.41 0.00 0.00 60.65 58.59 1l16 s ILE 27 Cb 0.07 -1.52 0.00 0.00 0.13 0.00 0.00 42.46 41.14 1l16 s ILE 27 CO 0.02 -0.24 0.00 0.61 -1.91 0.00 0.00 174.94 173.42 1l16 n GLY 28 N -0.26 2.47 3.12 1.50 0.00 0.12 -1.94 105.19 110.19 1l16 n GLY 28 Ca -0.11 -0.32 -0.44 0.00 0.00 0.00 0.00 46.02 45.15 1l16 n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1l16 n ILE 29 N 0.00 5.09 -1.48 -0.61 5.41 -1.26 -2.14 119.36 124.36 1l16 n ILE 29 Ca 0.00 -5.75 -0.12 0.00 1.00 0.00 0.00 62.75 57.89 1l16 n ILE 29 Cb 0.00 -2.25 -0.04 0.00 -0.71 0.00 0.00 39.64 36.64 1l16 n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1l16 n GLY 30 N 1.78 1.04 3.54 7.39 0.00 -1.25 -4.89 105.19 112.80 1l16 n GLY 30 Ca 0.25 -0.48 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 1l16 n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1l16 s HIS 31 N -2.45 2.35 0.16 1.61 5.04 -0.82 -4.92 115.29 116.25 1l16 s HIS 31 Ca 0.00 -0.14 -0.31 0.00 -1.54 0.00 0.00 55.06 53.06 1l16 s HIS 31 Cb 0.00 -4.58 -0.10 0.00 0.04 0.00 0.00 32.58 27.94 1l16 s HIS 31 CO 0.00 -2.01 1.65 -1.17 -2.34 0.00 0.00 174.74 170.87 1l16 s LEU 32 N 5.46 4.37 -0.22 8.88 2.96 -1.26 -2.04 118.68 136.84 1l16 s LEU 32 Ca 0.33 2.69 -0.16 0.00 -0.22 0.00 0.00 54.13 56.76 1l16 s LEU 32 Cb -0.09 -3.59 -0.18 0.00 0.50 0.00 0.00 46.19 42.83 1l16 s LEU 32 CO 0.14 -0.90 0.06 0.18 -1.32 0.00 0.00 176.35 174.51 1l16 n LEU 33 N 4.40 2.05 -3.48 -0.68 4.77 0.16 -4.96 117.00 119.26 1l16 n LEU 33 Ca 0.15 0.34 -0.15 0.00 -0.03 0.00 0.00 56.01 56.32 1l16 n LEU 33 Cb 0.38 -0.95 -0.04 0.00 -2.33 0.00 0.00 43.42 40.48 1l16 n LEU 33 CO 0.63 0.47 0.43 0.28 -1.33 0.00 0.00 177.39 177.87 1l16 s THR 34 N -2.44 0.00 -1.52 -5.08 -1.32 -1.17 -4.95 115.64 99.16 1l16 s THR 34 Ca -0.31 0.00 0.25 0.00 -1.21 0.00 0.00 61.69 60.42 1l16 s THR 34 Cb 0.09 -1.00 0.09 0.00 -1.51 0.00 0.00 72.50 70.16 1l16 s THR 34 CO 0.59 0.00 1.35 0.29 -2.21 0.00 0.00 174.62 174.64 1l16 n LYS 35 N 0.37 0.59 -2.14 7.08 5.02 -1.26 -3.43 118.16 124.40 1l16 n LYS 35 Ca -0.18 -0.40 -0.38 0.00 -2.02 0.00 0.00 58.31 55.32 1l16 n LYS 35 Cb 0.60 -1.49 -0.00 0.00 -0.02 0.00 0.00 35.03 34.12 1l16 n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1l16 s SER 36 N -2.68 6.20 0.00 4.39 0.15 -1.26 -4.93 113.70 115.57 1l16 s SER 36 Ca 0.18 2.50 0.22 0.00 0.70 0.00 0.00 55.95 59.55 1l16 s SER 36 Cb 0.18 -2.62 1.01 0.00 -1.71 0.00 0.00 66.02 62.88 1l16 s SER 36 CO 0.62 -0.91 1.72 -2.65 1.20 0.00 0.00 173.24 173.22 1l16 n PRO 37 N -0.19 0.10 -3.22 5.44 -0.02 -1.26 -4.75 135.00 131.11 1l16 n PRO 37 Ca 0.06 0.10 -0.39 0.00 -2.02 0.00 0.00 63.50 61.25 1l16 n PRO 37 Cb 0.46 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.37 1l16 n PRO 37 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1l16 s SER 38 N -2.87 6.65 0.53 2.55 0.01 -1.26 -4.89 113.70 114.42 1l16 s SER 38 Ca 0.14 0.79 0.18 0.00 1.31 0.00 0.00 55.95 58.37 1l16 s SER 38 Cb 0.15 -2.31 1.35 0.00 0.21 0.00 0.00 66.02 65.42 1l16 s SER 38 CO 0.39 -0.15 2.16 0.25 0.41 0.00 0.00 173.24 176.30 1l16 h LEU 39 N 7.58 0.00 -0.29 2.44 6.46 -1.99 -0.59 115.31 128.92 1l16 h LEU 39 Ca -0.36 0.00 -0.19 0.00 -0.12 0.00 0.00 57.88 57.22 1l16 h LEU 39 Cb 1.16 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.09 1l16 h LEU 39 CO 0.75 0.00 -0.55 0.78 -0.62 0.00 0.00 178.44 178.80 1l16 h ASN 40 N 0.00 0.99 -0.23 1.25 2.35 -1.97 -0.98 115.58 116.99 1l16 h ASN 40 Ca -0.00 -0.53 -0.04 0.00 -0.55 0.00 0.00 56.30 55.17 1l16 h ASN 40 Cb 0.00 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.07 1l16 h ASN 40 CO 0.00 1.34 0.02 0.00 -1.65 0.00 0.00 177.43 177.14 1l16 h ALA 41 N 0.68 1.43 -0.37 -0.83 0.00 -1.54 -1.28 119.26 117.35 1l16 h ALA 41 Ca 0.01 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.59 1l16 h ALA 41 Cb 1.16 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1l16 h ALA 41 CO 0.12 0.41 -0.37 0.00 0.00 0.00 0.00 179.25 179.41 1l16 h ALA 42 N 1.55 0.64 -0.47 0.00 0.00 -1.12 -2.25 119.26 117.61 1l16 h ALA 42 Ca 0.11 -0.45 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 1l16 h ALA 42 Cb 0.28 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1l16 h ALA 42 CO 0.01 0.67 0.05 0.87 0.00 0.00 0.00 179.25 180.84 1l16 h LYS 43 N 0.72 0.75 -0.28 0.00 6.56 -0.67 -0.82 116.57 122.82 1l16 h LYS 43 Ca 0.06 -0.17 -0.10 0.00 -1.06 0.00 0.00 60.65 59.38 1l16 h LYS 43 Cb 0.95 -0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 32.50 1l16 h LYS 43 CO 0.09 0.73 -0.21 1.03 -2.06 0.00 0.00 179.45 179.03 1l16 h SER 44 N 0.71 0.67 -0.81 0.86 0.87 -1.09 -2.26 113.55 112.49 1l16 h SER 44 Ca 0.15 -0.44 -0.02 0.00 -1.23 0.00 0.00 61.79 60.25 1l16 h SER 44 Cb 0.37 -0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 62.10 1l16 h SER 44 CO 0.01 0.97 0.45 -0.33 -0.53 0.00 0.00 176.83 177.40 1l16 h GLU 45 N 0.37 1.14 0.06 2.24 4.39 -1.21 -2.01 114.58 119.57 1l16 h GLU 45 Ca 0.05 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.62 1l16 h GLU 45 Cb 0.76 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 29.18 1l16 h GLU 45 CO 0.06 0.84 -0.06 1.25 -1.16 0.00 0.00 179.01 179.94 1l16 h LEU 46 N 1.13 -0.15 -1.32 1.33 5.85 -0.94 -0.07 115.31 121.14 1l16 h LEU 46 Ca 0.29 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 59.00 1l16 h LEU 46 Cb 0.03 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1l16 h LEU 46 CO -0.05 -0.09 0.22 0.44 -0.34 0.00 0.00 178.44 178.62 1l16 h ASP 47 N -0.13 0.61 -0.38 1.25 3.32 -1.30 -0.72 116.42 119.08 1l16 h ASP 47 Ca 0.00 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 56.97 1l16 h ASP 47 Cb 0.13 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 1l16 h ASP 47 CO -0.01 0.54 0.14 0.50 -1.72 0.00 0.00 179.24 178.69 1l16 h LYS 48 N 0.68 0.57 -0.57 3.56 3.64 -0.92 0.14 116.57 123.67 1l16 h LYS 48 Ca 0.17 -0.11 -0.07 0.00 -1.27 0.00 0.00 60.65 59.37 1l16 h LYS 48 Cb 0.10 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 1l16 h LYS 48 CO -0.02 0.55 0.08 0.00 -2.27 0.00 0.00 179.45 177.79 1l16 h ALA 49 N 0.99 1.06 0.00 5.00 0.00 -0.27 -3.27 119.26 122.76 1l16 h ALA 49 Ca 0.12 -0.25 -0.30 0.00 0.00 0.00 0.00 54.91 54.49 1l16 h ALA 49 Cb 0.20 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 1l16 h ALA 49 CO -0.01 0.60 -1.91 -0.89 0.00 0.00 0.00 179.25 177.04 1l16 n ILE 50 N -4.23 1.45 -1.90 0.00 2.08 -0.34 -5.00 119.36 111.42 1l16 n ILE 50 Ca 0.04 -0.80 0.00 0.00 0.56 0.00 0.00 62.75 62.55 1l16 n ILE 50 Cb 0.28 -0.79 0.00 0.00 -0.75 0.00 0.00 39.64 38.38 1l16 n ILE 50 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1l16 n GLY 51 N 1.60 0.67 3.78 7.39 0.00 0.47 -5.05 105.19 114.05 1l16 n GLY 51 Ca -0.21 -0.74 -0.08 0.00 0.00 0.00 0.00 46.02 44.99 1l16 n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1l16 s ARG 52 N -3.88 1.84 -0.48 1.61 1.70 -1.14 -5.06 118.95 113.53 1l16 s ARG 52 Ca 0.00 -1.16 -0.22 0.00 -0.47 0.00 0.00 55.73 53.88 1l16 s ARG 52 Cb 0.00 0.58 0.03 0.00 -0.57 0.00 0.00 34.95 34.99 1l16 s ARG 52 CO 0.00 -0.83 0.78 -0.80 -1.08 0.00 0.00 175.30 173.37 1l16 s ASN 53 N -2.98 6.35 -0.18 -2.89 -0.87 -1.26 -4.40 114.94 108.71 1l16 s ASN 53 Ca 0.15 -0.33 0.16 0.00 -1.57 0.00 0.00 52.86 51.27 1l16 s ASN 53 Cb -0.05 -2.37 -0.24 0.00 -0.02 0.00 0.00 41.25 38.57 1l16 s ASN 53 CO 0.09 -0.97 0.15 0.00 -2.57 0.00 0.00 177.10 173.80 1l16 n ASN 55 N -2.82 -5.23 0.00 0.00 5.15 -1.26 -2.22 115.26 108.88 1l16 n ASN 55 Ca -0.31 -0.34 0.00 0.00 -0.60 0.00 0.00 54.58 53.33 1l16 n ASN 55 Cb 1.13 -3.92 0.00 0.00 -0.53 0.00 0.00 39.78 36.46 1l16 n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1l16 n GLY 56 N -1.53 0.54 2.96 8.20 0.00 -1.26 -5.02 105.19 109.08 1l16 n GLY 56 Ca -0.03 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.81 1l16 n GLY 56 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l16 s VAL 57 N -2.27 0.59 0.33 1.61 0.11 -0.94 -2.47 120.40 117.35 1l16 s VAL 57 Ca 0.00 -0.26 0.06 0.00 -2.93 0.00 0.00 61.98 58.85 1l16 s VAL 57 Cb 0.00 -0.54 -0.06 0.00 -1.53 0.00 0.00 36.38 34.25 1l16 s VAL 57 CO 0.00 0.19 -0.02 0.27 -3.33 0.00 0.00 175.10 172.21 1l16 s ILE 58 N 0.21 1.70 0.52 7.04 -4.36 -0.68 -4.72 121.20 120.90 1l16 s ILE 58 Ca -0.03 -2.08 0.01 0.00 -0.26 0.00 0.00 60.65 58.29 1l16 s ILE 58 Cb -0.07 -2.67 0.02 0.00 1.25 0.00 0.00 42.46 40.98 1l16 s ILE 58 CO 0.00 -0.15 0.74 0.42 0.24 0.00 0.00 174.94 176.19 1l16 s THR 59 N -2.96 3.18 0.30 8.37 -4.23 -1.26 -4.78 115.64 114.26 1l16 s THR 59 Ca 0.33 -0.58 -0.00 0.00 -1.18 0.00 0.00 61.69 60.26 1l16 s THR 59 Cb 0.06 -3.19 0.27 0.00 1.34 0.00 0.00 72.50 70.98 1l16 s THR 59 CO 0.15 -0.14 1.94 0.50 -0.54 0.00 0.00 174.62 176.53 1l16 h LYS 60 N 0.17 1.03 -0.36 3.99 3.64 -1.99 -1.62 116.57 121.44 1l16 h LYS 60 Ca -0.44 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 58.89 1l16 h LYS 60 Cb 1.28 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.85 1l16 h LYS 60 CO 0.54 0.68 0.23 0.22 -2.27 0.00 0.00 179.45 178.86 1l16 h ASP 61 N 1.07 0.39 -0.47 4.20 1.82 -1.98 -0.51 116.42 120.93 1l16 h ASP 61 Ca 0.35 -0.01 -0.12 0.00 -0.39 0.00 0.00 57.03 56.86 1l16 h ASP 61 Cb 0.04 -0.09 -0.01 0.00 0.68 0.00 0.00 39.33 39.95 1l16 h ASP 61 CO -0.10 0.28 -0.18 -0.33 -1.61 0.00 0.00 179.24 177.29 1l16 h GLU 62 N 0.47 0.97 -0.55 0.28 5.08 -1.84 -1.26 114.58 117.73 1l16 h GLU 62 Ca 0.14 -0.40 0.01 0.00 -1.00 0.00 0.00 59.36 58.11 1l16 h GLU 62 Cb -0.03 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1l16 h GLU 62 CO -0.04 1.07 0.36 0.00 -1.00 0.00 0.00 179.01 179.40 1l16 h ALA 63 N 0.93 0.70 0.00 3.43 0.00 -0.95 -1.11 119.26 122.26 1l16 h ALA 63 Ca 0.12 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1l16 h ALA 63 Cb 0.75 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1l16 h ALA 63 CO 0.06 0.13 -0.33 0.93 0.00 0.00 0.00 179.25 180.04 1l16 h GLU 64 N 0.74 0.00 -0.19 0.00 5.08 -0.97 -1.35 114.58 117.89 1l16 h GLU 64 Ca 0.21 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.48 1l16 h GLU 64 Cb -0.07 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.18 1l16 h GLU 64 CO -0.05 0.33 -0.20 -0.22 -1.00 0.00 0.00 179.01 177.86 1l16 h LYS 65 N 0.00 0.47 -0.72 2.33 3.64 -0.46 -1.14 116.57 120.68 1l16 h LYS 65 Ca -0.00 -0.25 -0.03 0.00 -1.27 0.00 0.00 60.65 59.09 1l16 h LYS 65 Cb 0.83 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.62 1l16 h LYS 65 CO 0.04 0.83 0.31 -0.07 -2.27 0.00 0.00 179.45 178.30 1l16 h LEU 66 N 0.13 0.96 -0.25 5.20 3.38 -1.08 -2.01 115.31 121.64 1l16 h LEU 66 Ca 0.03 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1l16 h LEU 66 Cb 0.75 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1l16 h LEU 66 CO 0.05 0.84 0.10 0.15 0.09 0.00 0.00 178.44 179.67 1l16 h PHE 67 N 1.04 0.37 -0.94 1.13 -0.00 -1.10 -0.28 116.94 117.16 1l16 h PHE 67 Ca 0.25 -0.03 0.04 0.00 -0.00 0.00 0.00 57.97 58.23 1l16 h PHE 67 Cb 0.16 -0.11 -0.05 0.00 -0.00 0.00 0.00 35.95 35.94 1l16 h PHE 67 CO 0.01 0.38 0.62 -0.91 -0.00 0.00 0.00 178.31 178.42 1l16 h ASN 68 N 0.25 1.02 -0.57 0.41 -0.26 -0.88 -1.04 115.58 114.52 1l16 h ASN 68 Ca 0.08 -0.01 -0.09 0.00 -0.56 0.00 0.00 56.30 55.72 1l16 h ASN 68 Cb 0.17 -0.24 -0.02 0.00 -1.06 0.00 0.00 38.32 37.17 1l16 h ASN 68 CO -0.01 0.70 0.00 1.56 -1.06 0.00 0.00 177.43 178.63 1l16 h GLN 69 N 1.19 1.00 -0.42 0.81 4.20 -0.98 -1.87 115.11 119.03 1l16 h GLN 69 Ca 0.37 -0.32 -0.12 0.00 0.06 0.00 0.00 58.65 58.65 1l16 h GLN 69 Cb 0.01 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 1l16 h GLN 69 CO -0.11 1.00 -0.22 -0.44 -0.67 0.00 0.00 178.83 178.38 1l16 h ASP 70 N 0.89 0.87 -0.02 1.46 3.32 -0.48 -0.75 116.42 121.71 1l16 h ASP 70 Ca 0.16 -0.32 -0.00 0.00 0.02 0.00 0.00 57.03 56.89 1l16 h ASP 70 Cb 0.54 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.85 1l16 h ASP 70 CO 0.03 1.06 0.00 0.58 -1.72 0.00 0.00 179.24 179.19 1l16 h VAL 71 N 0.74 1.24 -0.45 -1.35 2.07 -1.16 -1.15 116.25 116.20 1l16 h VAL 71 Ca 0.10 -0.72 0.09 0.00 0.82 0.00 0.00 66.70 66.99 1l16 h VAL 71 Cb 0.76 1.70 -0.08 0.00 -1.52 0.00 0.00 31.29 32.15 1l16 h VAL 71 CO 0.06 0.19 -0.05 -0.78 0.02 0.00 0.00 177.57 177.01 1l16 h ASP 72 N -0.26 -0.30 -0.58 0.57 1.82 -1.34 -1.07 116.42 115.26 1l16 h ASP 72 Ca 0.01 0.12 -0.05 0.00 -0.39 0.00 0.00 57.03 56.71 1l16 h ASP 72 Cb 0.31 0.23 -0.03 0.00 0.68 0.00 0.00 39.33 40.52 1l16 h ASP 72 CO 0.00 -0.10 0.16 0.00 -1.61 0.00 0.00 179.24 177.69 1l16 h ALA 73 N 1.43 1.13 0.13 -0.78 0.00 -1.01 -2.12 119.26 118.03 1l16 h ALA 73 Ca 0.22 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1l16 h ALA 73 Cb 0.34 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1l16 h ALA 73 CO -0.42 0.59 -0.06 0.00 0.00 0.00 0.00 179.25 179.36 1l16 h ALA 74 N 1.26 -0.18 -0.25 0.00 0.00 -0.32 0.14 119.26 119.91 1l16 h ALA 74 Ca 0.20 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.10 1l16 h ALA 74 Cb 0.31 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 1l16 h ALA 74 CO -0.00 -0.58 -0.06 0.28 0.00 0.00 0.00 179.25 178.89 1l16 h VAL 75 N -0.21 0.76 -0.82 0.00 2.07 -1.08 -0.89 116.25 116.08 1l16 h VAL 75 Ca -0.02 -0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 1l16 h VAL 75 Cb 0.17 0.75 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 1l16 h VAL 75 CO 0.03 0.00 0.38 0.03 0.02 0.00 0.00 177.57 178.03 1l16 h ARG 76 N 0.01 1.19 -0.41 1.57 3.08 -1.32 -0.69 114.38 117.81 1l16 h ARG 76 Ca 0.12 -0.18 -0.10 0.00 0.07 0.00 0.00 59.98 59.88 1l16 h ARG 76 Cb 0.18 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1l16 h ARG 76 CO -0.25 0.93 -0.15 0.78 -1.07 0.00 0.00 179.97 180.21 1l16 h GLY 77 N 1.17 0.82 0.51 0.04 0.00 -0.35 -1.51 103.07 103.75 1l16 h GLY 77 Ca 0.28 -0.64 0.05 0.00 0.00 0.00 0.00 47.33 47.02 1l16 h GLY 77 CO -0.03 0.59 -0.02 -2.22 0.00 0.00 0.00 176.54 174.86 1l16 h ILE 78 N 0.68 0.77 0.00 2.60 2.04 -0.21 -2.13 117.51 121.25 1l16 h ILE 78 Ca 0.11 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.93 1l16 h ILE 78 Cb 0.63 0.70 -0.00 0.00 -0.74 0.00 0.00 36.82 37.41 1l16 h ILE 78 CO 0.04 0.01 -0.06 -0.07 0.00 0.00 0.00 178.15 178.08 1l16 h LEU 79 N 0.07 0.00 0.00 1.44 3.38 -0.76 -2.20 115.31 117.24 1l16 h LEU 79 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1l16 h LEU 79 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1l16 h LEU 79 CO -0.25 0.06 -0.83 0.54 0.09 0.00 0.00 178.44 178.05 1l16 n ARG 80 N -4.27 0.29 -3.10 1.13 1.74 -0.60 -4.79 116.66 107.05 1l16 n ARG 80 Ca -0.03 0.04 -0.40 0.00 -0.77 0.00 0.00 57.85 56.69 1l16 n ARG 80 Cb 0.14 -1.64 -0.06 0.00 -1.02 0.00 0.00 32.46 29.89 1l16 n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1l16 s ASN 81 N -4.08 6.74 0.55 0.55 3.84 -0.83 -4.93 114.94 116.78 1l16 s ASN 81 Ca 0.05 0.89 0.28 0.00 0.21 0.00 0.00 52.86 54.29 1l16 s ASN 81 Cb 0.14 -2.36 1.59 0.00 -0.55 0.00 0.00 41.25 40.07 1l16 s ASN 81 CO 0.76 -0.25 2.14 0.00 -2.79 0.00 0.00 177.10 176.96 1l16 h ALA 82 N 7.36 1.38 0.00 1.71 0.00 -1.90 0.16 119.26 127.96 1l16 h ALA 82 Ca -0.33 -0.07 -0.30 0.00 0.00 0.00 0.00 54.91 54.21 1l16 h ALA 82 Cb 1.15 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.87 1l16 h ALA 82 CO 0.78 0.09 -1.80 1.63 0.00 0.00 0.00 179.25 179.95 1l16 n LYS 83 N -3.72 0.64 0.05 0.00 4.01 -1.26 -4.49 118.16 113.40 1l16 n LYS 83 Ca -0.02 0.26 -0.22 0.00 -0.51 0.00 0.00 58.31 57.81 1l16 n LYS 83 Cb 0.18 -1.76 -0.15 0.00 -0.51 0.00 0.00 35.03 32.79 1l16 n LYS 83 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1l16 h LEU 84 N 0.00 0.55 -0.60 -0.35 3.38 -1.69 -3.39 115.31 113.21 1l16 h LEU 84 Ca -0.32 -0.91 0.11 0.00 0.09 0.00 0.00 57.88 56.85 1l16 h LEU 84 Cb 2.04 -0.18 -0.12 0.00 0.09 0.00 0.00 40.66 42.50 1l16 h LEU 84 CO 0.07 1.70 -0.29 0.50 0.09 0.00 0.00 178.44 180.51 1l16 h LYS 85 N -0.07 -0.12 -0.38 1.13 3.64 -0.67 -1.33 116.57 118.77 1l16 h LYS 85 Ca -0.31 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.06 1l16 h LYS 85 Cb 1.95 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.78 1l16 h LYS 85 CO 0.14 -0.08 0.16 -1.35 -2.27 0.00 0.00 179.45 176.06 1l16 h PRO 86 N -0.13 0.53 0.04 1.90 0.10 -1.80 -0.78 132.00 131.87 1l16 h PRO 86 Ca 0.25 -0.06 -0.00 0.00 0.10 0.00 0.00 66.00 66.29 1l16 h PRO 86 Cb 0.54 -0.10 0.00 0.00 0.10 0.00 0.00 31.00 31.53 1l16 h PRO 86 CO -0.67 0.43 -0.02 0.28 0.10 0.00 0.00 178.00 178.12 1l16 h VAL 87 N 0.53 1.27 -0.50 3.15 2.07 -1.53 -2.53 116.25 118.71 1l16 h VAL 87 Ca 0.13 -1.04 0.08 0.00 0.82 0.00 0.00 66.70 66.70 1l16 h VAL 87 Cb 0.09 1.95 -0.07 0.00 -1.52 0.00 0.00 31.29 31.74 1l16 h VAL 87 CO -0.02 0.26 0.11 0.22 0.02 0.00 0.00 177.57 178.16 1l16 h TYR 88 N -0.52 0.18 -0.07 1.57 5.03 -1.07 -0.67 116.97 121.42 1l16 h TYR 88 Ca -0.01 0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.30 1l16 h TYR 88 Cb 0.47 -0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.74 1l16 h TYR 88 CO 0.08 0.01 -0.11 -0.44 -1.32 0.00 0.00 178.16 176.38 1l16 h ASP 89 N 0.25 0.10 1.68 -2.11 3.45 -1.18 -2.27 116.42 116.33 1l16 h ASP 89 Ca 0.25 -0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.70 1l16 h ASP 89 Cb 0.33 -0.03 0.00 0.00 -0.56 0.00 0.00 39.33 39.07 1l16 h ASP 89 CO -0.32 0.22 0.00 0.77 -1.57 0.00 0.00 179.24 178.34 1l16 h SER 90 N 0.10 0.00 -3.37 6.45 4.64 -0.68 -3.46 113.55 117.23 1l16 h SER 90 Ca 0.02 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.83 1l16 h SER 90 Cb 0.26 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 1l16 h SER 90 CO 0.02 0.00 -0.07 -0.76 -0.87 0.00 0.00 176.83 175.14 1l16 s LEU 91 N -6.08 4.03 0.85 5.97 1.43 -0.85 -5.08 118.68 118.94 1l16 s LEU 91 Ca 0.05 0.86 -0.13 0.00 -1.03 0.00 0.00 54.13 53.88 1l16 s LEU 91 Cb 0.07 -3.68 0.11 0.00 0.03 0.00 0.00 46.19 42.72 1l16 s LEU 91 CO 0.63 -0.22 1.21 1.51 0.23 0.00 0.00 176.35 179.71 1l16 s ASP 92 N -2.99 4.13 0.15 2.29 1.47 -1.26 -4.77 116.67 115.68 1l16 s ASP 92 Ca 0.46 0.67 -0.23 0.00 1.18 0.00 0.00 52.55 54.64 1l16 s ASP 92 Cb -0.11 -1.07 0.02 0.00 -0.34 0.00 0.00 42.92 41.43 1l16 s ASP 92 CO 0.28 -2.13 1.63 0.00 0.68 0.00 0.00 175.17 175.63 1l16 h ALA 93 N -1.22 -0.14 -0.38 2.11 0.00 -1.99 -0.94 119.26 116.70 1l16 h ALA 93 Ca -0.46 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.55 1l16 h ALA 93 Cb 1.31 0.50 -0.03 0.00 0.00 0.00 0.00 17.79 19.57 1l16 h ALA 93 CO 0.59 -0.67 0.21 0.28 0.00 0.00 0.00 179.25 179.66 1l16 h VAL 94 N -0.25 1.01 -0.06 0.00 2.07 -1.94 -2.34 116.25 114.73 1l16 h VAL 94 Ca 0.13 -0.14 -0.07 0.00 0.82 0.00 0.00 66.70 67.44 1l16 h VAL 94 Cb 0.46 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1l16 h VAL 94 CO -0.37 0.08 -0.29 0.03 0.02 0.00 0.00 177.57 177.04 1l16 h ARG 95 N 0.42 0.10 -0.55 1.57 3.08 -1.82 -1.58 114.38 115.60 1l16 h ARG 95 Ca 0.16 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 60.12 1l16 h ARG 95 Cb 0.04 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 1l16 h ARG 95 CO -0.09 0.38 0.11 0.00 -1.07 0.00 0.00 179.97 179.30 1l16 h ARG 96 N 0.09 0.86 -0.98 0.04 3.08 -0.68 -2.07 114.38 114.72 1l16 h ARG 96 Ca 0.01 -0.19 0.01 0.00 0.07 0.00 0.00 59.98 59.88 1l16 h ARG 96 Cb 0.56 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.44 1l16 h ARG 96 CO 0.04 0.79 0.65 0.00 -1.07 0.00 0.00 179.97 180.38 1l16 h ALA 98 N 1.39 1.27 -0.21 0.00 0.00 -1.07 -1.23 119.26 119.40 1l16 h ALA 98 Ca 0.36 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 1l16 h ALA 98 Cb -0.15 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.44 1l16 h ALA 98 CO -0.08 0.51 -0.48 1.25 0.00 0.00 0.00 179.25 180.45 1l16 h LEU 99 N 0.74 0.79 -0.62 0.00 5.85 -0.83 -2.70 115.31 118.54 1l16 h LEU 99 Ca 0.16 -0.56 0.07 0.00 0.84 0.00 0.00 57.88 58.40 1l16 h LEU 99 Cb 0.28 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.02 1l16 h LEU 99 CO -0.00 1.21 0.30 0.40 -0.34 0.00 0.00 178.44 180.00 1l16 h ILE 100 N 0.41 0.89 -0.32 4.05 2.04 -1.02 -1.31 117.51 122.26 1l16 h ILE 100 Ca 0.00 -0.19 0.05 0.00 1.00 0.00 0.00 64.86 65.72 1l16 h ILE 100 Cb 1.09 0.29 -0.04 0.00 -0.74 0.00 0.00 36.82 37.42 1l16 h ILE 100 CO 0.11 0.10 0.04 -1.13 0.00 0.00 0.00 178.15 177.27 1l16 h ASN 101 N 0.55 -0.03 -0.58 1.72 -0.00 -1.14 0.12 115.58 116.21 1l16 h ASN 101 Ca 0.29 0.06 0.03 0.00 -0.00 0.00 0.00 56.30 56.68 1l16 h ASN 101 Cb 0.26 0.09 -0.04 0.00 -0.00 0.00 0.00 38.32 38.63 1l16 h ASN 101 CO -0.23 0.02 0.35 0.24 -0.00 0.00 0.00 177.43 177.81 1l16 h MET 102 N 0.15 0.67 -0.54 6.67 2.86 -1.07 -2.09 114.93 121.58 1l16 h MET 102 Ca 0.15 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.72 1l16 h MET 102 Cb 0.18 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.66 1l16 h MET 102 CO -0.22 0.44 0.22 0.28 1.06 0.00 0.00 176.91 178.69 1l16 h VAL 103 N 0.69 1.22 -0.43 -2.22 2.07 -0.57 -0.03 116.25 116.97 1l16 h VAL 103 Ca 0.24 -0.68 0.05 0.00 0.82 0.00 0.00 66.70 67.13 1l16 h VAL 103 Cb 0.04 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 1l16 h VAL 103 CO -0.11 0.26 0.17 0.15 0.02 0.00 0.00 177.57 178.06 1l16 h PHE 104 N 0.73 0.31 -0.07 1.57 3.04 -0.41 0.27 116.94 122.39 1l16 h PHE 104 Ca 0.18 0.02 -0.23 0.00 3.98 0.00 0.00 57.97 61.92 1l16 h PHE 104 Cb 0.20 -0.08 0.01 0.00 2.56 0.00 0.00 35.95 38.64 1l16 h PHE 104 CO 0.01 0.13 -0.88 0.37 -2.02 0.00 0.00 178.31 175.92 1l16 h GLN 105 N 0.36 0.62 -0.00 1.11 4.15 -1.16 -3.37 115.11 116.81 1l16 h GLN 105 Ca 0.20 -0.58 0.00 0.00 0.77 0.00 0.00 58.65 59.03 1l16 h GLN 105 Cb 0.16 0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.99 1l16 h GLN 105 CO -0.18 1.20 -0.07 0.00 -1.93 0.00 0.00 178.83 177.85 1l16 n MET 106 N -3.86 2.34 -0.04 1.69 0.00 -0.04 -5.11 117.12 112.10 1l16 n MET 106 Ca -0.08 -0.40 0.00 0.00 0.00 0.00 0.00 57.70 57.23 1l16 n MET 106 Cb 0.80 -0.88 -0.00 0.00 0.00 0.00 0.00 33.22 33.13 1l16 n MET 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1l16 n GLY 107 N 0.59 -2.71 0.25 3.17 0.00 0.94 -3.80 105.19 103.62 1l16 n GLY 107 Ca 0.01 -1.39 -0.06 0.00 0.00 0.00 0.00 46.02 44.59 1l16 n GLY 107 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1l16 h GLU 108 N -0.02 -0.13 -0.02 1.61 5.08 -1.92 -1.70 114.58 117.48 1l16 h GLU 108 Ca -0.00 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1l16 h GLU 108 Cb 0.03 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1l16 h GLU 108 CO 0.00 -0.09 -0.04 1.15 -1.00 0.00 0.00 179.01 179.04 1l16 h THR 109 N -0.14 0.90 -0.01 1.13 2.02 -1.96 0.95 112.91 115.79 1l16 h THR 109 Ca 0.19 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.40 1l16 h THR 109 Cb 0.43 0.90 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 1l16 h THR 109 CO -0.47 0.00 -0.20 1.23 0.37 0.00 0.00 175.52 176.45 1l16 h GLY 110 N -0.06 -0.27 1.05 2.16 0.00 -1.48 -2.66 103.07 101.82 1l16 h GLY 110 Ca 0.02 0.24 -0.08 0.00 0.00 0.00 0.00 47.33 47.51 1l16 h GLY 110 CO -0.05 -0.18 0.07 -2.08 0.00 0.00 0.00 176.54 174.30 1l16 h VAL 111 N -0.31 1.26 0.00 4.60 2.07 -1.17 -2.53 116.25 120.17 1l16 h VAL 111 Ca 0.06 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.53 1l16 h VAL 111 Cb 0.40 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1l16 h VAL 111 CO -0.19 0.39 0.09 0.00 0.02 0.00 0.00 177.57 177.88 1l16 h ALA 112 N 1.01 1.09 0.00 1.67 0.00 -0.48 0.24 119.26 122.78 1l16 h ALA 112 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1l16 h ALA 112 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1l16 h ALA 112 CO 0.02 -0.09 0.00 0.41 0.00 0.00 0.00 179.25 179.59 1l16 n GLY 113 N -1.17 -1.55 2.33 0.00 0.00 -0.95 -3.98 105.19 99.87 1l16 n GLY 113 Ca -0.02 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 1l16 n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1l16 n PHE 114 N -1.97 1.74 -0.30 1.61 0.99 0.84 -4.72 117.46 115.65 1l16 n PHE 114 Ca 0.05 -2.40 -0.06 0.00 -0.00 0.00 0.00 57.45 55.05 1l16 n PHE 114 Cb 0.36 -1.86 -0.01 0.00 -1.00 0.00 0.00 39.48 36.97 1l16 n PHE 114 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.76 177.91 1l16 h THR 115 N 2.44 0.05 -0.46 4.37 2.02 -1.81 -1.24 112.91 118.28 1l16 h THR 115 Ca 0.57 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.71 1l16 h THR 115 Cb 0.66 0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 1l16 h THR 115 CO 1.15 0.00 0.13 0.78 0.37 0.00 0.00 175.52 177.95 1l16 h ASN 116 N -0.10 0.69 -0.09 4.18 2.35 -1.95 -2.10 115.58 118.56 1l16 h ASN 116 Ca 0.25 -0.22 -0.09 0.00 -0.55 0.00 0.00 56.30 55.69 1l16 h ASN 116 Cb 0.55 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.73 1l16 h ASN 116 CO -0.83 0.73 -0.22 0.28 -1.65 0.00 0.00 177.43 175.73 1l16 h SER 117 N 0.62 0.50 -0.51 5.81 0.02 -1.82 -1.43 113.55 116.74 1l16 h SER 117 Ca 0.15 -0.16 -0.05 0.00 -0.84 0.00 0.00 61.79 60.89 1l16 h SER 117 Cb 0.29 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 1l16 h SER 117 CO -0.00 0.72 0.11 -0.07 -1.14 0.00 0.00 176.83 176.45 1l16 h LEU 118 N 0.45 0.78 -0.34 5.07 3.38 -1.04 -0.52 115.31 123.09 1l16 h LEU 118 Ca 0.07 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 57.81 1l16 h LEU 118 Cb 0.63 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1l16 h LEU 118 CO 0.04 0.82 0.20 -0.09 0.09 0.00 0.00 178.44 179.51 1l16 h ARG 119 N 0.71 0.41 -0.40 1.13 1.12 -1.18 0.43 114.38 116.59 1l16 h ARG 119 Ca 0.16 -0.02 -0.07 0.00 -1.11 0.00 0.00 59.98 58.93 1l16 h ARG 119 Cb 0.36 -0.09 -0.02 0.00 -0.01 0.00 0.00 29.97 30.21 1l16 h ARG 119 CO 0.00 0.27 -0.04 0.52 -3.11 0.00 0.00 179.97 177.61 1l16 h MET 120 N 0.42 0.67 -0.45 0.20 2.86 -1.01 -1.26 114.93 116.36 1l16 h MET 120 Ca 0.13 -0.18 -0.14 0.00 -2.06 0.00 0.00 59.70 57.45 1l16 h MET 120 Cb -0.02 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 1l16 h MET 120 CO -0.05 0.72 -0.26 -0.07 1.06 0.00 0.00 176.91 178.31 1l16 h LEU 121 N 0.63 1.00 -1.43 1.22 3.38 -0.50 -1.66 115.31 117.94 1l16 h LEU 121 Ca 0.12 -0.42 0.04 0.00 0.09 0.00 0.00 57.88 57.72 1l16 h LEU 121 Cb 0.45 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 1l16 h LEU 121 CO 0.02 1.20 0.43 1.56 0.09 0.00 0.00 178.44 181.74 1l16 h GLN 122 N 0.80 0.71 -0.00 1.13 4.20 -0.45 -0.39 115.11 121.10 1l16 h GLN 122 Ca 0.09 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1l16 h GLN 122 Cb 0.84 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.46 1l16 h GLN 122 CO 0.07 0.47 -0.05 1.04 -0.67 0.00 0.00 178.83 179.69 1l16 n GLN 123 N -4.47 0.68 -3.03 1.46 6.02 -0.52 -4.92 117.38 112.61 1l16 n GLN 123 Ca 0.08 -0.15 -0.18 0.00 -0.01 0.00 0.00 57.00 56.75 1l16 n GLN 123 Cb 0.16 -1.50 0.04 0.00 1.02 0.00 0.00 30.24 29.97 1l16 n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1l16 n LYS 124 N -1.03 -4.69 -3.29 -1.09 5.02 -0.16 -4.96 118.16 107.96 1l16 n LYS 124 Ca 0.16 0.68 -0.43 0.00 -2.02 0.00 0.00 58.31 56.69 1l16 n LYS 124 Cb 0.24 -5.12 -0.01 0.00 -0.02 0.00 0.00 35.03 30.13 1l16 n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1l16 n ARG 125 N -3.54 3.66 -0.05 1.97 1.74 -0.67 -4.92 116.66 114.86 1l16 n ARG 125 Ca -0.05 -4.49 -0.08 0.00 -0.77 0.00 0.00 57.85 52.46 1l16 n ARG 125 Cb 0.58 -2.52 -0.02 0.00 -1.02 0.00 0.00 32.46 29.47 1l16 n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 1l16 h TRP 126 N 6.26 -0.02 -0.51 -1.55 4.06 -1.91 0.20 115.95 122.48 1l16 h TRP 126 Ca 0.18 0.02 -0.07 0.00 2.06 0.00 0.00 58.89 61.08 1l16 h TRP 126 Cb 0.80 0.04 -0.02 0.00 -1.00 0.00 0.00 29.16 28.99 1l16 h TRP 126 CO 0.81 -0.04 0.06 -0.44 -3.56 0.00 0.00 178.44 175.27 1l16 h ASP 127 N 0.06 0.84 -0.38 -3.49 5.19 -1.91 -1.77 116.42 114.95 1l16 h ASP 127 Ca 0.10 -0.28 -0.05 0.00 -0.62 0.00 0.00 57.03 56.19 1l16 h ASP 127 Cb 0.13 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.40 1l16 h ASP 127 CO -0.18 0.90 0.05 -0.33 -3.12 0.00 0.00 179.24 176.56 1l16 h GLU 128 N 0.75 0.64 -0.61 3.56 3.07 -1.93 -2.62 114.58 117.44 1l16 h GLU 128 Ca 0.15 -0.18 -0.05 0.00 -0.50 0.00 0.00 59.36 58.78 1l16 h GLU 128 Cb 0.44 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.25 1l16 h GLU 128 CO 0.01 0.71 0.17 0.00 -1.40 0.00 0.00 179.01 178.51 1l16 h ALA 129 N 0.91 1.16 -0.81 3.43 0.00 -0.83 -2.40 119.26 120.72 1l16 h ALA 129 Ca 0.11 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1l16 h ALA 129 Cb 0.39 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1l16 h ALA 129 CO 0.01 0.58 0.42 0.00 0.00 0.00 0.00 179.25 180.26 1l16 h ALA 130 N 1.29 1.23 -0.12 0.00 0.00 -1.11 -1.37 119.26 119.18 1l16 h ALA 130 Ca 0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1l16 h ALA 130 Cb 0.28 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1l16 h ALA 130 CO -0.01 0.61 0.03 0.28 0.00 0.00 0.00 179.25 180.17 1l16 h VAL 131 N 1.13 1.19 -0.77 0.00 2.07 -1.27 -3.03 116.25 115.57 1l16 h VAL 131 Ca 0.28 -0.58 -0.03 0.00 0.82 0.00 0.00 66.70 67.19 1l16 h VAL 131 Cb 0.05 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 1l16 h VAL 131 CO -0.04 0.17 0.36 -1.13 0.02 0.00 0.00 177.57 176.95 1l16 h ASN 132 N -0.01 1.02 -0.74 0.57 -0.73 -1.25 -2.85 115.58 111.59 1l16 h ASN 132 Ca 0.04 -0.14 0.02 0.00 1.87 0.00 0.00 56.30 58.08 1l16 h ASN 132 Cb 0.24 -0.26 -0.04 0.00 0.27 0.00 0.00 38.32 38.53 1l16 h ASN 132 CO -0.00 0.88 0.49 -0.07 -0.37 0.00 0.00 177.43 178.36 1l16 h LEU 133 N 1.10 0.83 -1.16 0.34 3.38 -1.30 -2.24 115.31 116.25 1l16 h LEU 133 Ca 0.26 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1l16 h LEU 133 Cb 0.13 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1l16 h LEU 133 CO -0.03 0.59 0.00 0.00 0.09 0.00 0.00 178.44 179.09 1l16 h ALA 134 N 1.55 1.00 -0.58 1.53 0.00 -1.37 -3.32 119.26 118.06 1l16 h ALA 134 Ca 0.28 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 54.45 1l16 h ALA 134 Cb -0.06 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 17.62 1l16 h ALA 134 CO -0.07 0.00 2.53 1.63 0.00 0.00 0.00 179.25 183.35 1l16 n LYS 135 N -2.83 3.78 -3.72 0.00 4.01 -0.84 -4.70 118.16 113.85 1l16 n LYS 135 Ca 0.01 -3.20 -0.10 0.00 -0.51 0.00 0.00 58.31 54.51 1l16 n LYS 135 Cb 0.29 -2.89 -0.05 0.00 -0.51 0.00 0.00 35.03 31.88 1l16 n LYS 135 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1l16 s SER 136 N 1.24 -0.17 0.20 4.39 1.04 -1.25 -5.01 113.70 114.15 1l16 s SER 136 Ca 0.48 -0.46 -0.10 0.00 0.48 0.00 0.00 55.95 56.35 1l16 s SER 136 Cb 0.14 0.48 0.19 0.00 0.10 0.00 0.00 66.02 66.92 1l16 s SER 136 CO -0.05 -0.89 1.83 -0.09 0.98 0.00 0.00 173.24 175.03 1l16 h ARG 137 N 2.39 0.75 -0.63 4.02 2.43 -1.92 -2.48 114.38 118.95 1l16 h ARG 137 Ca -0.33 -0.04 0.11 0.00 -0.81 0.00 0.00 59.98 58.91 1l16 h ARG 137 Cb 1.25 -0.17 -0.12 0.00 -0.42 0.00 0.00 29.97 30.51 1l16 h ARG 137 CO 0.46 0.49 -0.30 2.35 -1.51 0.00 0.00 179.97 181.46 1l16 h TRP 138 N 0.77 -0.82 -0.49 2.20 7.01 -1.95 0.32 115.95 123.00 1l16 h TRP 138 Ca 0.27 0.07 -0.12 0.00 2.11 0.00 0.00 58.89 61.23 1l16 h TRP 138 Cb 0.07 0.45 -0.02 0.00 -2.10 0.00 0.00 29.16 27.57 1l16 h TRP 138 CO -0.06 -0.37 -0.15 -0.92 -2.79 0.00 0.00 178.44 174.15 1l16 h TYR 139 N -0.12 1.06 -0.27 2.65 3.20 -1.75 -1.58 116.97 120.16 1l16 h TYR 139 Ca 0.26 -0.23 -0.12 0.00 3.14 0.00 0.00 58.73 61.78 1l16 h TYR 139 Cb 0.55 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 1l16 h TYR 139 CO -0.63 1.02 -0.34 -0.91 -1.64 0.00 0.00 178.16 175.66 1l16 h ASN 140 N 0.83 0.60 0.50 -2.11 4.21 -0.82 -1.84 115.58 116.95 1l16 h ASN 140 Ca 0.12 -0.24 -0.30 0.00 1.21 0.00 0.00 56.30 57.09 1l16 h ASN 140 Cb 0.70 -0.17 0.01 0.00 -1.12 0.00 0.00 38.32 37.74 1l16 h ASN 140 CO 0.05 0.89 -1.40 1.56 -1.29 0.00 0.00 177.43 177.25 1l16 h GLN 141 N 0.49 0.31 -2.03 0.81 7.50 -0.34 -3.39 115.11 118.44 1l16 h GLN 141 Ca 0.05 -0.52 -0.53 0.00 0.50 0.00 0.00 58.65 58.15 1l16 h GLN 141 Cb 0.82 0.19 -0.40 0.00 0.05 0.00 0.00 27.48 28.15 1l16 h GLN 141 CO 0.07 1.22 -1.07 0.25 -1.50 0.00 0.00 178.83 177.79 1l16 n THR 142 N -3.53 -0.00 -0.23 -0.54 -2.24 -0.60 -4.99 114.28 102.14 1l16 n THR 142 Ca -0.13 -4.43 0.00 0.00 -2.27 0.00 0.00 64.05 57.22 1l16 n THR 142 Cb 1.04 -1.29 0.12 0.00 -2.10 0.00 0.00 70.33 68.11 1l16 n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1l16 h PRO 143 N 3.57 0.58 -0.48 -0.78 0.13 -1.53 0.01 132.00 133.50 1l16 h PRO 143 Ca 0.10 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 65.12 1l16 h PRO 143 Cb 0.87 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.85 1l16 h PRO 143 CO 0.53 0.38 0.04 -0.91 -0.23 0.00 0.00 178.00 177.82 1l16 h ASN 144 N 0.60 0.80 -0.11 1.44 -0.26 -1.94 0.66 115.58 116.77 1l16 h ASN 144 Ca 0.33 -0.28 -0.02 0.00 -0.56 0.00 0.00 56.30 55.77 1l16 h ASN 144 Cb 0.32 -0.21 -0.00 0.00 -1.06 0.00 0.00 38.32 37.36 1l16 h ASN 144 CO -0.25 0.88 -0.01 -0.09 -1.06 0.00 0.00 177.43 176.91 1l16 h ARG 145 N 0.69 0.20 -0.77 0.81 2.43 -1.95 -2.19 114.38 113.59 1l16 h ARG 145 Ca 0.14 -0.07 0.08 0.00 -0.81 0.00 0.00 59.98 59.33 1l16 h ARG 145 Cb 0.45 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 29.91 1l16 h ARG 145 CO 0.02 0.47 0.43 0.00 -1.51 0.00 0.00 179.97 179.38 1l16 h ALA 146 N 0.73 1.08 -0.87 2.80 0.00 -0.85 -1.80 119.26 120.35 1l16 h ALA 146 Ca 0.03 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1l16 h ALA 146 Cb 0.38 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1l16 h ALA 146 CO 0.01 0.08 0.52 1.57 0.00 0.00 0.00 179.25 181.43 1l16 h LYS 147 N 0.75 1.19 -0.29 0.00 2.10 -0.78 0.50 116.57 120.04 1l16 h LYS 147 Ca 0.36 -0.11 -0.01 0.00 -2.00 0.00 0.00 60.65 58.89 1l16 h LYS 147 Cb 0.30 -0.25 -0.01 0.00 -0.90 0.00 0.00 32.23 31.37 1l16 h LYS 147 CO -0.23 0.83 0.13 0.00 -2.00 0.00 0.00 179.45 178.18 1l16 h ARG 148 N 1.20 0.42 -0.27 0.07 3.08 -0.70 -0.59 114.38 117.60 1l16 h ARG 148 Ca 0.31 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.29 1l16 h ARG 148 Cb -0.04 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1l16 h ARG 148 CO -0.06 0.42 0.14 0.28 -1.07 0.00 0.00 179.97 179.68 1l16 h VAL 149 N 0.32 1.14 -0.90 2.04 2.07 -1.02 -1.28 116.25 118.62 1l16 h VAL 149 Ca 0.10 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1l16 h VAL 149 Cb 0.15 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 1l16 h VAL 149 CO -0.01 0.14 0.56 0.40 0.02 0.00 0.00 177.57 178.68 1l16 h ILE 150 N 0.31 1.24 -0.68 4.57 2.04 -0.86 -1.90 117.51 122.23 1l16 h ILE 150 Ca 0.09 -0.49 -0.07 0.00 1.00 0.00 0.00 64.86 65.39 1l16 h ILE 150 Cb 0.10 -0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.11 1l16 h ILE 150 CO -0.01 0.25 0.15 0.74 0.00 0.00 0.00 178.15 179.27 1l16 h THR 151 N 1.23 1.26 -0.29 -0.27 2.02 -0.72 0.15 112.91 116.29 1l16 h THR 151 Ca 0.32 -0.98 -0.00 0.00 0.77 0.00 0.00 66.41 66.52 1l16 h THR 151 Cb -0.09 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 66.88 1l16 h THR 151 CO -0.06 0.37 0.17 0.74 0.37 0.00 0.00 175.52 177.11 1l16 h THR 152 N 1.04 1.11 -0.55 3.16 2.02 -0.61 -0.31 112.91 118.78 1l16 h THR 152 Ca 0.21 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 67.10 1l16 h THR 152 Cb 0.38 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 1l16 h THR 152 CO 0.00 0.11 0.30 -0.26 0.37 0.00 0.00 175.52 176.05 1l16 h PHE 153 N 0.36 0.75 -0.19 3.16 0.05 -1.08 0.67 116.94 120.66 1l16 h PHE 153 Ca 0.10 -0.02 -0.00 0.00 3.82 0.00 0.00 57.97 61.88 1l16 h PHE 153 Cb 0.03 -0.24 -0.01 0.00 2.00 0.00 0.00 35.95 37.74 1l16 h PHE 153 CO -0.04 0.55 0.12 -0.09 -0.18 0.00 0.00 178.31 178.66 1l16 h ARG 154 N 0.73 0.25 0.00 1.51 2.43 -0.72 -3.36 114.38 115.23 1l16 h ARG 154 Ca 0.19 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.30 1l16 h ARG 154 Cb 0.04 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1l16 h ARG 154 CO -0.03 0.20 -1.81 0.25 -1.51 0.00 0.00 179.97 177.07 1l16 n THR 155 N -4.94 0.29 -1.32 0.20 -2.24 -0.15 -4.84 114.28 101.28 1l16 n THR 155 Ca -0.04 -0.55 -0.11 0.00 -2.27 0.00 0.00 64.05 61.08 1l16 n THR 155 Cb 0.04 -0.14 -0.05 0.00 -2.10 0.00 0.00 70.33 68.09 1l16 n THR 155 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1l16 n ASP 156 N -2.41 -4.61 -4.44 3.42 4.64 0.22 -4.98 116.55 108.39 1l16 n ASP 156 Ca -0.06 0.28 -0.22 0.00 -1.38 0.00 0.00 54.79 53.41 1l16 n ASP 156 Cb 0.63 -3.10 -0.10 0.00 -1.04 0.00 0.00 41.12 37.51 1l16 n ASP 156 CO 0.00 0.00 0.00 0.42 -0.82 0.00 0.00 177.20 176.80 1l16 s THR 157 N -2.33 1.16 -0.95 5.18 -4.23 -1.26 -4.93 115.64 108.29 1l16 s THR 157 Ca 0.00 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.67 1l16 s THR 157 Cb 0.00 -2.76 0.71 0.00 1.34 0.00 0.00 72.50 71.78 1l16 s THR 157 CO 0.00 0.00 1.60 0.79 -0.54 0.00 0.00 174.62 176.47 1l16 n TRP 158 N -0.72 1.56 -0.04 3.99 7.02 -1.26 -4.57 117.44 123.42 1l16 n TRP 158 Ca -0.03 -0.59 0.17 0.00 -1.02 0.00 0.00 57.50 56.03 1l16 n TRP 158 Cb 0.66 -0.30 0.61 0.00 -2.42 0.00 0.00 31.31 29.87 1l16 n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1l16 h ASP 159 N 3.84 0.15 0.47 -0.99 3.45 -1.96 -1.84 116.42 119.54 1l16 h ASP 159 Ca 0.00 0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.44 1l16 h ASP 159 Cb 1.52 -0.02 -0.00 0.00 -0.56 0.00 0.00 39.33 40.26 1l16 h ASP 159 CO 0.28 0.08 -0.12 0.00 -1.57 0.00 0.00 179.24 177.92 1l16 h ALA 160 N 1.72 1.20 -0.02 3.45 0.00 -1.89 -1.34 119.26 122.39 1l16 h ALA 160 Ca 0.27 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1l16 h ALA 160 Cb 0.85 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1l16 h ALA 160 CO -0.04 0.15 -0.36 0.66 0.00 0.00 0.00 179.25 179.65 1l16 n TYR 161 N -3.52 0.00 -0.04 0.00 4.01 -0.74 -4.18 117.16 112.69 1l16 n TYR 161 Ca -0.01 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.60 1l16 n TYR 161 Cb 0.26 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.22 1l16 n TYR 161 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1l16 h LYS 162 N 2.62 0.23 -0.24 -0.72 6.56 -0.69 -3.03 116.57 121.30 1l16 h LYS 162 Ca 0.00 -0.09 -0.01 0.00 -1.06 0.00 0.00 60.65 59.49 1l16 h LYS 162 Cb 0.74 -0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 32.38 1l16 h LYS 162 CO 0.00 0.55 0.13 -0.91 -2.06 0.00 0.00 179.45 177.15 1l16 h ASN 163 N -0.10 0.30 -0.01 0.86 2.35 -1.71 -3.51 115.58 113.77 1l16 h ASN 163 Ca 0.03 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 1l16 h ASN 163 Cb 0.47 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.76 1l16 h ASN 163 CO 0.01 0.31 0.00 0.18 -1.65 0.00 0.00 177.43 176.28