#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1in0 s SER 3 N 0.00 -0.10 0.13 3.54 1.04 -0.43 -1.40 113.70 116.48 1in0 s SER 3 Ca 0.00 -0.88 -0.08 0.00 0.48 0.00 0.00 55.95 55.46 1in0 s SER 3 Cb 0.00 0.58 -0.01 0.00 0.10 0.00 0.00 66.02 66.69 1in0 s SER 3 CO 0.00 -1.12 0.23 0.72 0.98 0.00 0.00 173.24 174.05 1in0 s PHE 4 N -4.00 0.29 -0.07 5.02 -0.12 -0.83 -0.33 117.98 117.94 1in0 s PHE 4 Ca 0.21 -0.69 0.02 0.00 -0.05 0.00 0.00 56.93 56.42 1in0 s PHE 4 Cb -0.00 -0.07 -0.02 0.00 -0.63 0.00 0.00 43.02 42.29 1in0 s PHE 4 CO 0.07 -0.63 -0.13 -0.51 -0.05 0.00 0.00 175.22 173.98 1in0 s ASP 5 N -2.92 4.11 -0.33 1.98 1.01 0.19 -1.72 116.67 118.99 1in0 s ASP 5 Ca 0.11 -0.21 -0.12 0.00 0.71 0.00 0.00 52.55 53.05 1in0 s ASP 5 Cb 0.04 -1.08 -0.02 0.00 1.01 0.00 0.00 42.92 42.87 1in0 s ASP 5 CO -0.05 0.30 0.22 -0.63 0.21 0.00 0.00 175.17 175.21 1in0 s ILE 6 N -0.46 5.11 0.38 0.77 1.01 0.14 -0.73 121.20 127.42 1in0 s ILE 6 Ca 0.06 -0.25 0.04 0.00 0.00 0.00 0.00 60.65 60.50 1in0 s ILE 6 Cb -0.12 -3.61 -0.06 0.00 0.01 0.00 0.00 42.46 38.68 1in0 s ILE 6 CO 0.02 0.02 0.04 0.68 0.00 0.00 0.00 174.94 175.71 1in0 s VAL 7 N 1.70 1.38 -0.33 2.92 -7.23 0.17 -1.24 120.40 117.76 1in0 s VAL 7 Ca 0.06 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.21 1in0 s VAL 7 Cb -0.17 -2.74 0.12 0.00 0.56 0.00 0.00 36.38 34.15 1in0 s VAL 7 CO 0.09 0.00 0.16 -0.55 -0.31 0.00 0.00 175.10 174.50 1in0 s SER 8 N -3.62 3.49 -0.10 4.85 0.15 -1.26 0.92 113.70 118.13 1in0 s SER 8 Ca 0.31 -1.82 -0.00 0.00 0.70 0.00 0.00 55.95 55.14 1in0 s SER 8 Cb 0.08 -0.57 -0.03 0.00 -1.71 0.00 0.00 66.02 63.79 1in0 s SER 8 CO 0.15 -0.37 -0.07 -1.61 1.20 0.00 0.00 173.24 172.53 1in0 s GLU 9 N 1.45 3.08 -0.18 5.44 2.02 -1.26 0.10 118.70 129.35 1in0 s GLU 9 Ca 0.13 -0.57 -0.05 0.00 0.02 0.00 0.00 54.97 54.51 1in0 s GLU 9 Cb -0.20 -2.67 -0.03 0.00 0.10 0.00 0.00 34.13 31.34 1in0 s GLU 9 CO -0.18 0.48 -0.01 0.42 0.02 0.00 0.00 175.26 175.99 1in0 s ILE 10 N -0.31 3.96 -0.83 -1.63 -1.09 -1.26 -4.99 121.20 115.05 1in0 s ILE 10 Ca 0.04 -0.32 -0.25 0.00 -2.23 0.00 0.00 60.65 57.89 1in0 s ILE 10 Cb -0.13 -2.77 0.02 0.00 -1.58 0.00 0.00 42.46 38.01 1in0 s ILE 10 CO 0.02 0.45 1.46 -0.89 -1.23 0.00 0.00 174.94 174.76 1in0 s THR 11 N 0.75 3.72 -0.11 2.92 2.01 -1.26 -4.85 115.64 118.81 1in0 s THR 11 Ca -0.00 -0.06 0.08 0.00 0.31 0.00 0.00 61.69 62.01 1in0 s THR 11 Cb -0.14 -4.77 0.08 0.00 0.01 0.00 0.00 72.50 67.68 1in0 s THR 11 CO 0.02 -1.70 1.09 -0.11 -0.69 0.00 0.00 174.62 173.24 1in0 n LEU 12 N 10.01 0.21 0.02 4.42 -0.00 -1.26 -0.35 117.00 130.06 1in0 n LEU 12 Ca 0.18 0.44 -0.22 0.00 -0.00 0.00 0.00 56.01 56.41 1in0 n LEU 12 Cb 0.50 -0.39 -0.14 0.00 -0.00 0.00 0.00 43.42 43.39 1in0 n LEU 12 CO 0.68 -0.51 -0.61 0.45 -0.00 0.00 0.00 177.39 177.40 1in0 h HIS 13 N 0.00 0.54 0.00 1.96 3.86 -2.00 -3.10 115.15 116.41 1in0 h HIS 13 Ca 0.00 -0.39 -0.04 0.00 -1.16 0.00 0.00 60.37 58.77 1in0 h HIS 13 Cb 0.65 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 29.09 1in0 h HIS 13 CO 0.00 1.68 -0.21 0.93 0.86 0.00 0.00 177.93 181.19 1in0 h GLU 14 N -0.06 0.00 -0.14 2.45 5.08 -1.07 -2.65 114.58 118.19 1in0 h GLU 14 Ca -0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 1in0 h GLU 14 Cb 1.96 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.20 1in0 h GLU 14 CO 0.10 0.21 0.09 0.28 -1.00 0.00 0.00 179.01 178.69 1in0 h VAL 15 N 0.00 1.04 -0.56 3.13 2.07 -1.54 -1.26 116.25 119.14 1in0 h VAL 15 Ca -0.00 -0.08 0.02 0.00 0.82 0.00 0.00 66.70 67.45 1in0 h VAL 15 Cb 0.85 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1in0 h VAL 15 CO 0.03 0.04 0.37 0.03 0.02 0.00 0.00 177.57 178.06 1in0 h ARG 16 N 0.18 0.68 -0.10 1.57 2.47 -1.41 0.43 114.38 118.21 1in0 h ARG 16 Ca 0.05 -0.04 -0.19 0.00 -1.26 0.00 0.00 59.98 58.54 1in0 h ARG 16 Cb -0.01 -0.15 0.01 0.00 -1.65 0.00 0.00 29.97 28.16 1in0 h ARG 16 CO -0.01 0.45 -0.67 -0.91 0.56 0.00 0.00 179.97 179.39 1in0 h ASN 17 N 0.71 0.76 -0.80 7.04 2.35 -1.09 -2.78 115.58 121.77 1in0 h ASN 17 Ca 0.21 -0.66 -0.01 0.00 -0.55 0.00 0.00 56.30 55.29 1in0 h ASN 17 Cb -0.01 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.09 1in0 h ASN 17 CO -0.05 1.30 0.46 0.00 -1.65 0.00 0.00 177.43 177.49 1in0 h ALA 18 N 0.47 1.30 0.68 -0.83 0.00 -0.85 0.12 119.26 120.15 1in0 h ALA 18 Ca -0.06 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1in0 h ALA 18 Cb 1.32 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 18.79 1in0 h ALA 18 CO 0.14 0.59 -0.33 0.28 0.00 0.00 0.00 179.25 179.93 1in0 h VAL 19 N 1.12 0.05 -0.50 0.00 2.07 -0.88 -0.74 116.25 117.37 1in0 h VAL 19 Ca 0.29 -0.32 0.08 0.00 0.82 0.00 0.00 66.70 67.57 1in0 h VAL 19 Cb -0.01 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 29.80 1in0 h VAL 19 CO -0.05 0.01 0.34 1.05 0.02 0.00 0.00 177.57 178.93 1in0 h GLU 20 N -1.22 0.31 0.27 1.57 9.09 -1.32 -0.30 114.58 122.98 1in0 h GLU 20 Ca -0.09 -0.02 -0.01 0.00 0.05 0.00 0.00 59.36 59.28 1in0 h GLU 20 Cb 0.71 -0.07 0.00 0.00 -1.65 0.00 0.00 28.75 27.74 1in0 h GLU 20 CO 0.15 0.21 -0.13 -0.97 0.05 0.00 0.00 179.01 178.32 1in0 h ASN 21 N 0.32 -0.31 -0.72 3.06 -1.24 -0.71 -0.85 115.58 115.15 1in0 h ASN 21 Ca 0.23 -0.04 0.13 0.00 0.71 0.00 0.00 56.30 57.33 1in0 h ASN 21 Cb 0.47 0.08 -0.05 0.00 0.73 0.00 0.00 38.32 39.56 1in0 h ASN 21 CO -0.05 -0.16 0.48 0.00 -1.29 0.00 0.00 177.43 176.40 1in0 h ALA 22 N 0.29 2.04 0.00 1.57 0.00 0.45 0.17 119.26 123.78 1in0 h ALA 22 Ca -0.04 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 1in0 h ALA 22 Cb 0.32 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1in0 h ALA 22 CO 0.06 -0.22 -0.61 -0.91 0.00 0.00 0.00 179.25 177.57 1in0 h ASN 23 N 0.45 0.00 0.38 0.00 2.35 -0.19 -1.51 115.58 117.07 1in0 h ASN 23 Ca 0.34 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.07 1in0 h ASN 23 Cb 0.71 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.08 1in0 h ASN 23 CO -0.11 0.61 -0.18 -0.09 -1.65 0.00 0.00 177.43 176.01 1in0 h ARG 24 N 0.00 -0.50 -0.28 0.81 9.65 0.47 -1.61 114.38 122.92 1in0 h ARG 24 Ca -0.01 0.03 0.04 0.00 -1.10 0.00 0.00 59.98 58.95 1in0 h ARG 24 Cb 1.14 0.11 -0.07 0.00 -1.39 0.00 0.00 29.97 29.76 1in0 h ARG 24 CO 0.08 -0.20 -0.54 0.28 2.80 0.00 0.00 179.97 182.40 1in0 h VAL 25 N -0.79 0.02 -0.74 0.20 2.07 -0.67 -2.19 116.25 114.15 1in0 h VAL 25 Ca -0.05 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.63 1in0 h VAL 25 Cb 0.53 0.02 -0.11 0.00 -1.52 0.00 0.00 31.29 30.20 1in0 h VAL 25 CO 0.09 0.00 0.14 0.25 0.02 0.00 0.00 177.57 178.07 1in0 h LEU 26 N -0.48 -0.07 -2.39 2.57 5.85 -1.21 -1.02 115.31 118.58 1in0 h LEU 26 Ca 0.06 0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.94 1in0 h LEU 26 Cb 0.63 0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.90 1in0 h LEU 26 CO -0.52 -0.08 0.00 0.28 -0.34 0.00 0.00 178.44 177.78 1in0 h SER 27 N 0.22 0.00 0.09 1.25 0.02 -0.63 -1.52 113.55 112.99 1in0 h SER 27 Ca 0.42 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.37 1in0 h SER 27 Cb 0.73 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.27 1in0 h SER 27 CO -0.55 0.00 -0.10 0.35 -1.14 0.00 0.00 176.83 175.39 1in0 n THR 28 N -2.95 0.00 -3.03 -2.27 -2.24 -0.39 -4.85 114.28 98.56 1in0 n THR 28 Ca -0.02 -0.19 -0.42 0.00 -2.27 0.00 0.00 64.05 61.15 1in0 n THR 28 Cb 0.12 0.43 -0.06 0.00 -2.10 0.00 0.00 70.33 68.73 1in0 n THR 28 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1in0 s ARG 29 N -2.21 3.68 0.48 -0.78 1.81 -0.57 -4.92 118.95 116.44 1in0 s ARG 29 Ca 0.33 0.14 0.27 0.00 -1.72 0.00 0.00 55.73 54.75 1in0 s ARG 29 Cb 0.20 -3.82 1.15 0.00 -0.45 0.00 0.00 34.95 32.03 1in0 s ARG 29 CO 0.41 -0.82 1.92 -0.92 -0.68 0.00 0.00 175.30 175.21 1in0 h TYR 30 N 8.52 0.00 0.00 -0.53 3.20 -1.88 -1.95 116.97 124.32 1in0 h TYR 30 Ca -0.25 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.62 1in0 h TYR 30 Cb 1.10 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.37 1in0 h TYR 30 CO 0.77 0.17 0.00 -0.40 -1.64 0.00 0.00 178.16 177.06 1in0 n ASP 31 N -3.41 0.34 -0.71 -2.11 5.75 -1.26 -0.31 116.55 114.85 1in0 n ASP 31 Ca -0.00 0.60 0.07 0.00 -0.01 0.00 0.00 54.79 55.44 1in0 n ASP 31 Cb 0.36 -0.67 0.15 0.00 -1.03 0.00 0.00 41.12 39.92 1in0 n ASP 31 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 1in0 n PHE 32 N -1.90 0.39 -1.87 2.11 3.72 -0.73 -4.85 117.46 114.33 1in0 n PHE 32 Ca 0.02 -0.34 -0.42 0.00 -0.05 0.00 0.00 57.45 56.66 1in0 n PHE 32 Cb 0.16 -0.01 -0.02 0.00 -0.94 0.00 0.00 39.48 38.66 1in0 n PHE 32 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 1in0 s ARG 33 N -1.04 4.18 0.00 -1.08 3.52 0.58 -0.49 118.95 124.62 1in0 s ARG 33 Ca 0.24 2.46 0.00 0.00 -0.13 0.00 0.00 55.73 58.30 1in0 s ARG 33 Cb 0.14 -3.08 0.00 0.00 -1.56 0.00 0.00 34.95 30.45 1in0 s ARG 33 CO 0.19 -0.58 0.00 0.41 -0.81 0.00 0.00 175.30 174.51 1in0 n GLY 34 N 2.71 1.04 3.77 8.12 0.00 -1.26 -4.98 105.19 114.58 1in0 n GLY 34 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 1in0 n GLY 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1in0 s VAL 35 N -2.71 5.19 0.18 1.61 1.01 0.36 -5.03 120.40 121.01 1in0 s VAL 35 Ca 0.00 0.74 -0.31 0.00 0.00 0.00 0.00 61.98 62.41 1in0 s VAL 35 Cb 0.00 -3.70 -0.10 0.00 0.00 0.00 0.00 36.38 32.58 1in0 s VAL 35 CO 0.00 0.45 1.50 -0.70 0.00 0.00 0.00 175.10 176.35 1in0 s GLU 36 N -0.09 4.25 -0.29 2.72 2.12 -1.26 -4.96 118.70 121.19 1in0 s GLU 36 Ca 0.22 2.30 0.04 0.00 0.36 0.00 0.00 54.97 57.89 1in0 s GLU 36 Cb -0.15 -3.16 0.20 0.00 0.26 0.00 0.00 34.13 31.29 1in0 s GLU 36 CO 0.09 -0.53 0.63 0.00 -0.54 0.00 0.00 175.26 174.91 1in0 s ALA 37 N 0.81 -2.54 -0.12 6.30 0.00 -1.25 -3.45 121.76 121.51 1in0 s ALA 37 Ca 0.66 1.10 -0.02 0.00 0.00 0.00 0.00 51.96 53.71 1in0 s ALA 37 Cb -0.42 -2.56 -0.03 0.00 0.00 0.00 0.00 23.12 20.11 1in0 s ALA 37 CO 0.34 -1.84 -0.05 0.08 0.00 0.00 0.00 175.76 174.29 1in0 s VAL 38 N 2.84 3.78 -0.31 0.00 1.01 0.34 -4.98 120.40 123.08 1in0 s VAL 38 Ca 0.12 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.69 1in0 s VAL 38 Cb -0.09 -2.61 0.10 0.00 0.00 0.00 0.00 36.38 33.77 1in0 s VAL 38 CO -0.26 0.54 0.06 -0.63 0.00 0.00 0.00 175.10 174.82 1in0 s ILE 39 N -0.13 1.49 -0.03 2.22 1.01 -1.26 -0.77 121.20 123.73 1in0 s ILE 39 Ca 0.02 -1.75 0.03 0.00 0.00 0.00 0.00 60.65 58.95 1in0 s ILE 39 Cb -0.13 -2.08 -0.00 0.00 0.01 0.00 0.00 42.46 40.26 1in0 s ILE 39 CO 0.03 -0.59 -0.12 -1.83 0.00 0.00 0.00 174.94 172.43 1in0 s GLU 40 N 1.31 1.21 -0.35 2.79 -1.05 -0.51 -4.93 118.70 117.18 1in0 s GLU 40 Ca 0.09 -0.41 -0.17 0.00 -0.15 0.00 0.00 54.97 54.32 1in0 s GLU 40 Cb -0.18 -1.10 -0.01 0.00 -0.44 0.00 0.00 34.13 32.40 1in0 s GLU 40 CO -0.16 0.17 0.47 -1.17 0.95 0.00 0.00 175.26 175.52 1in0 s LEU 41 N 0.09 4.38 -0.85 1.83 2.96 -1.26 -0.93 118.68 124.90 1in0 s LEU 41 Ca -0.02 -0.09 -0.15 0.00 -0.22 0.00 0.00 54.13 53.64 1in0 s LEU 41 Cb -0.09 -2.52 0.19 0.00 0.50 0.00 0.00 46.19 44.27 1in0 s LEU 41 CO 0.01 -0.44 0.86 0.21 -1.32 0.00 0.00 176.35 175.67 1in0 s ASN 42 N 1.75 6.71 0.58 3.68 3.84 -0.13 -4.90 114.94 126.48 1in0 s ASN 42 Ca 0.17 -2.47 0.28 0.00 0.21 0.00 0.00 52.86 51.05 1in0 s ASN 42 Cb -0.16 -2.26 1.71 0.00 -0.55 0.00 0.00 41.25 39.99 1in0 s ASN 42 CO 0.13 -0.73 2.18 -0.33 -2.79 0.00 0.00 177.10 175.56 1in0 h GLU 43 N 8.12 0.00 0.19 0.43 5.08 -1.96 0.44 114.58 126.88 1in0 h GLU 43 Ca 0.11 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 1in0 h GLU 43 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1in0 h GLU 43 CO 0.86 0.00 -0.09 0.87 -1.00 0.00 0.00 179.01 179.65 1in0 h LYS 44 N 0.00 -0.24 0.00 2.33 1.57 -1.95 -3.27 116.57 115.01 1in0 h LYS 44 Ca 0.04 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1in0 h LYS 44 Cb 0.22 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1in0 h LYS 44 CO -0.00 0.12 0.00 0.09 -0.57 0.00 0.00 179.45 179.08 1in0 n ASN 45 N -4.94 0.00 -2.77 0.86 4.13 -0.98 -4.92 115.26 106.64 1in0 n ASN 45 Ca -0.07 0.01 -0.18 0.00 1.68 0.00 0.00 54.58 56.02 1in0 n ASN 45 Cb 0.24 -0.32 0.06 0.00 -1.54 0.00 0.00 39.78 38.21 1in0 n ASN 45 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1in0 n GLU 46 N -1.32 -5.78 -4.23 3.52 1.02 0.11 -4.91 120.64 109.05 1in0 n GLU 46 Ca 0.12 0.63 -0.13 0.00 -0.02 0.00 0.00 57.16 57.75 1in0 n GLU 46 Cb 0.23 -5.04 -0.10 0.00 -0.02 0.00 0.00 31.44 26.51 1in0 n GLU 46 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1in0 s THR 47 N -3.22 0.64 -0.20 2.62 -4.23 -1.11 -1.09 115.64 109.05 1in0 s THR 47 Ca 0.42 -1.97 0.01 0.00 -1.18 0.00 0.00 61.69 58.97 1in0 s THR 47 Cb -0.19 -2.10 0.03 0.00 1.34 0.00 0.00 72.50 71.58 1in0 s THR 47 CO 0.52 -0.49 -0.18 -0.63 -0.54 0.00 0.00 174.62 173.31 1in0 s ILE 48 N -3.68 2.09 -0.21 2.99 1.01 0.24 -0.95 121.20 122.69 1in0 s ILE 48 Ca 0.24 -1.10 -0.11 0.00 0.00 0.00 0.00 60.65 59.67 1in0 s ILE 48 Cb 0.06 -1.96 -0.05 0.00 0.01 0.00 0.00 42.46 40.52 1in0 s ILE 48 CO 0.04 0.41 0.20 -0.75 0.00 0.00 0.00 174.94 174.83 1in0 s LYS 49 N 1.25 4.15 -0.14 2.79 2.20 -0.10 0.10 119.74 129.99 1in0 s LYS 49 Ca 0.02 -0.14 -0.02 0.00 -0.36 0.00 0.00 55.97 55.46 1in0 s LYS 49 Cb -0.15 -3.48 -0.02 0.00 -1.51 0.00 0.00 37.83 32.66 1in0 s LYS 49 CO -0.11 0.15 -0.06 0.96 -0.36 0.00 0.00 175.35 175.92 1in0 s ILE 50 N 0.78 3.66 -0.00 5.43 -4.36 -0.26 -1.42 121.20 125.03 1in0 s ILE 50 Ca 0.10 -0.45 0.02 0.00 -0.26 0.00 0.00 60.65 60.06 1in0 s ILE 50 Cb -0.13 -2.58 -0.01 0.00 1.25 0.00 0.00 42.46 41.00 1in0 s ILE 50 CO 0.03 0.51 -0.05 -0.89 0.24 0.00 0.00 174.94 174.78 1in0 s THR 51 N 0.20 0.40 0.00 8.37 2.01 0.05 -1.66 115.64 125.00 1in0 s THR 51 Ca -0.04 -0.27 0.00 0.00 0.31 0.00 0.00 61.69 61.69 1in0 s THR 51 Cb -0.14 -0.35 0.00 0.00 0.01 0.00 0.00 72.50 72.02 1in0 s THR 51 CO 0.03 0.07 0.00 1.07 -0.69 0.00 0.00 174.62 175.11 1in0 n THR 52 N 2.85 0.00 -0.23 -0.82 5.66 -0.62 -0.51 114.28 120.61 1in0 n THR 52 Ca -0.14 0.00 0.10 0.00 -3.05 0.00 0.00 64.05 60.96 1in0 n THR 52 Cb 0.58 0.00 0.26 0.00 -1.55 0.00 0.00 70.33 69.62 1in0 n THR 52 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1in0 n GLU 53 N 0.00 2.70 -3.54 1.09 1.02 -1.22 -0.84 120.64 119.85 1in0 n GLU 53 Ca 0.00 -2.42 -0.09 0.00 -0.02 0.00 0.00 57.16 54.62 1in0 n GLU 53 Cb 0.00 -1.47 -0.02 0.00 -0.02 0.00 0.00 31.44 29.93 1in0 n GLU 53 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1in0 s SER 54 N -1.05 -0.42 0.32 1.62 1.04 -1.26 -4.83 113.70 109.13 1in0 s SER 54 Ca 0.40 -0.12 0.01 0.00 0.48 0.00 0.00 55.95 56.73 1in0 s SER 54 Cb 0.21 0.53 0.57 0.00 0.10 0.00 0.00 66.02 67.43 1in0 s SER 54 CO 0.28 -0.88 1.95 0.44 0.98 0.00 0.00 173.24 176.00 1in0 h ASP 55 N 2.00 0.83 -0.20 7.02 3.32 -1.96 -2.22 116.42 125.20 1in0 h ASP 55 Ca -0.27 -0.01 -0.20 0.00 0.02 0.00 0.00 57.03 56.57 1in0 h ASP 55 Cb 1.27 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1in0 h ASP 55 CO 0.32 0.56 -0.65 0.15 -1.72 0.00 0.00 179.24 177.91 1in0 h PHE 56 N 0.96 1.07 -0.17 4.55 3.57 -2.00 -2.23 116.94 122.69 1in0 h PHE 56 Ca 0.33 -0.42 -0.07 0.00 3.53 0.00 0.00 57.97 61.34 1in0 h PHE 56 Cb 0.09 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.64 1in0 h PHE 56 CO -0.00 1.25 -0.21 1.96 -2.23 0.00 0.00 178.31 179.08 1in0 h GLN 57 N 0.60 0.30 -0.71 1.11 4.20 -1.92 -1.03 115.11 117.67 1in0 h GLN 57 Ca -0.02 -0.09 -0.04 0.00 0.06 0.00 0.00 58.65 58.56 1in0 h GLN 57 Cb 1.27 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.98 1in0 h GLN 57 CO 0.14 0.50 0.27 1.25 -0.67 0.00 0.00 178.83 180.32 1in0 h LEU 58 N 0.28 0.97 -0.59 1.46 5.85 -1.01 -1.51 115.31 120.75 1in0 h LEU 58 Ca 0.05 -0.15 -0.13 0.00 0.84 0.00 0.00 57.88 58.49 1in0 h LEU 58 Cb 0.53 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1in0 h LEU 58 CO 0.04 0.87 -0.33 -0.33 -0.34 0.00 0.00 178.44 178.34 1in0 h GLU 59 N 1.02 0.76 -0.63 1.25 5.08 -0.85 -1.59 114.58 119.63 1in0 h GLU 59 Ca 0.24 -0.36 0.06 0.00 -1.00 0.00 0.00 59.36 58.29 1in0 h GLU 59 Cb 0.21 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.40 1in0 h GLU 59 CO -0.02 0.98 0.33 1.96 -1.00 0.00 0.00 179.01 181.27 1in0 h GLN 60 N 0.64 0.60 -0.26 2.33 4.20 -0.71 -0.76 115.11 121.14 1in0 h GLN 60 Ca 0.07 -0.04 -0.15 0.00 0.06 0.00 0.00 58.65 58.59 1in0 h GLN 60 Cb 0.87 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.51 1in0 h GLN 60 CO 0.08 0.40 -0.44 -0.07 -0.67 0.00 0.00 178.83 178.12 1in0 h LEU 61 N 0.62 0.84 -1.08 1.46 3.38 -1.14 0.82 115.31 120.21 1in0 h LEU 61 Ca 0.28 -0.52 -0.05 0.00 0.09 0.00 0.00 57.88 57.68 1in0 h LEU 61 Cb 0.19 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1in0 h LEU 61 CO -0.19 1.21 0.11 0.40 0.09 0.00 0.00 178.44 180.06 1in0 h ILE 62 N 0.51 1.22 -0.50 1.22 2.04 -1.15 0.13 117.51 120.97 1in0 h ILE 62 Ca 0.02 -0.79 -0.05 0.00 1.00 0.00 0.00 64.86 65.03 1in0 h ILE 62 Cb 1.04 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 1in0 h ILE 62 CO 0.10 0.29 0.10 -0.08 0.00 0.00 0.00 178.15 178.56 1in0 h GLU 63 N 0.74 0.82 -0.48 2.37 4.81 -0.84 0.57 114.58 122.57 1in0 h GLU 63 Ca 0.16 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1in0 h GLU 63 Cb 0.29 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1in0 h GLU 63 CO -0.00 0.80 0.31 0.82 -0.73 0.00 0.00 179.01 180.21 1in0 h ILE 64 N 0.70 1.13 -0.47 2.32 2.04 -0.33 -1.14 117.51 121.76 1in0 h ILE 64 Ca 0.15 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 1in0 h ILE 64 Cb 0.37 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 1in0 h ILE 64 CO 0.01 0.13 0.27 0.17 0.00 0.00 0.00 178.15 178.72 1in0 h LEU 65 N 0.65 0.58 -0.90 1.44 8.10 -0.22 -0.17 115.31 124.80 1in0 h LEU 65 Ca 0.18 -0.08 0.01 0.00 0.11 0.00 0.00 57.88 58.10 1in0 h LEU 65 Cb -0.05 -0.15 -0.05 0.00 -0.44 0.00 0.00 40.66 39.97 1in0 h LEU 65 CO -0.04 0.49 0.59 0.40 -4.11 0.00 0.00 178.44 175.78 1in0 h ILE 66 N 0.62 1.22 0.11 0.15 2.04 -0.48 -1.86 117.51 119.31 1in0 h ILE 66 Ca 0.17 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 1in0 h ILE 66 Cb 0.03 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.02 1in0 h ILE 66 CO -0.03 0.22 -0.05 1.23 0.00 0.00 0.00 178.15 179.52 1in0 h GLY 67 N 1.20 -0.15 -0.12 5.37 0.00 -0.59 -0.51 103.07 108.28 1in0 h GLY 67 Ca 0.33 0.06 0.10 0.00 0.00 0.00 0.00 47.33 47.82 1in0 h GLY 67 CO -0.08 -0.06 -0.21 1.76 0.00 0.00 0.00 176.54 177.95 1in0 h SER 68 N -0.21 -0.74 0.30 0.19 0.02 -0.56 -0.45 113.55 112.10 1in0 h SER 68 Ca -0.01 0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1in0 h SER 68 Cb 0.17 0.40 -0.03 0.00 0.14 0.00 0.00 62.40 63.08 1in0 h SER 68 CO 0.02 -0.24 -0.47 0.00 -1.14 0.00 0.00 176.83 175.00 1in0 h ILE 70 N -0.81 0.68 0.00 0.00 2.04 -0.61 0.43 117.51 119.23 1in0 h ILE 70 Ca -0.03 -0.04 -0.06 0.00 1.00 0.00 0.00 64.86 65.73 1in0 h ILE 70 Cb 0.75 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 1in0 h ILE 70 CO -0.15 0.02 -0.29 0.11 0.00 0.00 0.00 178.15 177.84 1in0 h LYS 71 N 0.10 0.00 -0.29 2.37 1.57 -0.50 -3.17 116.57 116.66 1in0 h LYS 71 Ca 0.35 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.09 1in0 h LYS 71 Cb 1.24 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.53 1in0 h LYS 71 CO -0.04 0.29 0.00 -2.13 -0.57 0.00 0.00 179.45 177.00 1in0 n ARG 72 N -3.34 2.70 0.00 3.15 0.63 0.15 -4.99 116.66 114.96 1in0 n ARG 72 Ca 0.01 -2.90 0.00 0.00 -0.92 0.00 0.00 57.85 54.03 1in0 n ARG 72 Cb 0.52 -1.85 0.00 0.00 0.45 0.00 0.00 32.46 31.58 1in0 n ARG 72 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1in0 n GLY 73 N -0.64 2.87 3.56 5.14 0.00 -0.88 -4.97 105.19 110.27 1in0 n GLY 73 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 1in0 n GLY 73 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1in0 s ILE 74 N -0.97 3.50 0.96 -0.61 1.01 -0.88 -4.90 121.20 119.32 1in0 s ILE 74 Ca 0.00 -0.29 -0.11 0.00 0.00 0.00 0.00 60.65 60.25 1in0 s ILE 74 Cb 0.00 -4.17 0.17 0.00 0.01 0.00 0.00 42.46 38.47 1in0 s ILE 74 CO 0.00 -1.11 1.11 -0.70 0.00 0.00 0.00 174.94 174.25 1in0 s GLU 75 N 6.70 0.66 0.15 2.79 2.56 -1.26 -3.47 118.70 126.82 1in0 s GLU 75 Ca 0.65 1.34 -0.19 0.00 0.00 0.00 0.00 54.97 56.77 1in0 s GLU 75 Cb -0.07 -1.70 0.05 0.00 2.00 0.00 0.00 34.13 34.41 1in0 s GLU 75 CO 0.02 -2.81 1.67 1.25 -0.56 0.00 0.00 175.26 174.83 1in0 h HIS 76 N -1.99 -0.29 -0.36 5.30 6.17 -1.92 -2.16 115.15 119.91 1in0 h HIS 76 Ca -0.48 0.03 0.10 0.00 0.71 0.00 0.00 60.37 60.74 1in0 h HIS 76 Cb 1.28 0.17 -0.01 0.00 2.52 0.00 0.00 27.41 31.37 1in0 h HIS 76 CO 0.45 -0.19 0.52 0.77 0.71 0.00 0.00 177.93 180.19 1in0 h SER 77 N -0.07 0.00 0.52 3.26 0.02 -1.91 0.60 113.55 115.98 1in0 h SER 77 Ca 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1in0 h SER 77 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1in0 h SER 77 CO -0.35 0.00 0.00 -1.20 -1.14 0.00 0.00 176.83 174.14 1in0 n SER 78 N -3.42 0.00 -4.58 3.07 7.64 -0.81 -4.49 113.62 111.03 1in0 n SER 78 Ca 0.06 -0.18 -0.35 0.00 1.01 0.00 0.00 58.87 59.41 1in0 n SER 78 Cb 0.67 -0.27 -0.11 0.00 -1.01 0.00 0.00 64.21 63.49 1in0 n SER 78 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1in0 s LEU 79 N -2.54 3.72 -0.79 -3.43 1.43 0.21 0.35 118.68 117.62 1in0 s LEU 79 Ca 0.29 -0.00 -0.09 0.00 -1.03 0.00 0.00 54.13 53.29 1in0 s LEU 79 Cb 0.20 -1.96 0.21 0.00 0.03 0.00 0.00 46.19 44.66 1in0 s LEU 79 CO 0.44 0.11 0.69 -0.62 0.23 0.00 0.00 176.35 177.20 1in0 s ASP 80 N 0.78 6.26 -0.21 2.29 2.15 0.00 -4.98 116.67 122.95 1in0 s ASP 80 Ca 0.04 -2.91 -0.19 0.00 0.43 0.00 0.00 52.55 49.92 1in0 s ASP 80 Cb -0.13 -2.07 -0.03 0.00 -0.30 0.00 0.00 42.92 40.39 1in0 s ASP 80 CO 0.02 -0.45 0.53 -0.63 -0.17 0.00 0.00 175.17 174.48 1in0 s ILE 81 N -0.17 5.08 0.42 4.11 1.01 -1.26 -1.43 121.20 128.97 1in0 s ILE 81 Ca 0.20 0.97 -0.26 0.00 0.00 0.00 0.00 60.65 61.56 1in0 s ILE 81 Cb -0.13 -3.85 -0.09 0.00 0.01 0.00 0.00 42.46 38.40 1in0 s ILE 81 CO -0.07 0.14 1.37 -2.84 0.00 0.00 0.00 174.94 173.55 1in0 s PRO 82 N 1.85 3.88 0.19 2.79 0.02 -1.26 -4.90 135.00 137.56 1in0 s PRO 82 Ca 0.24 2.31 -0.02 0.00 0.02 0.00 0.00 61.00 63.55 1in0 s PRO 82 Cb -0.15 -2.75 0.10 0.00 0.02 0.00 0.00 34.50 31.72 1in0 s PRO 82 CO 0.09 -0.62 1.49 0.00 -0.33 0.00 0.00 177.00 177.63 1in0 h ALA 83 N 2.59 0.67 -4.00 -1.55 0.00 -1.99 -3.45 119.26 111.53 1in0 h ALA 83 Ca -0.50 -0.54 -0.69 0.00 0.00 0.00 0.00 54.91 53.18 1in0 h ALA 83 Cb 1.25 -0.07 -0.22 0.00 0.00 0.00 0.00 17.79 18.74 1in0 h ALA 83 CO 0.62 0.71 -0.80 -2.00 0.00 0.00 0.00 179.25 177.78 1in0 s GLU 84 N -3.88 2.13 0.27 0.00 2.12 -1.26 -5.14 118.70 112.94 1in0 s GLU 84 Ca -0.07 -0.94 -0.06 0.00 0.36 0.00 0.00 54.97 54.26 1in0 s GLU 84 Cb 0.11 -2.21 -0.06 0.00 0.26 0.00 0.00 34.13 32.23 1in0 s GLU 84 CO 0.84 0.55 0.54 -1.54 -0.54 0.00 0.00 175.26 175.11 1in0 s SER 85 N -1.32 6.49 0.05 -1.70 1.04 -1.26 -4.85 113.70 112.14 1in0 s SER 85 Ca 0.14 0.75 -0.18 0.00 0.48 0.00 0.00 55.95 57.15 1in0 s SER 85 Cb -0.10 -2.16 -0.06 0.00 0.10 0.00 0.00 66.02 63.79 1in0 s SER 85 CO 0.04 -0.16 0.51 -1.61 0.98 0.00 0.00 173.24 173.01 1in0 s GLU 86 N -3.34 4.10 -0.29 4.02 0.41 0.17 -4.87 118.70 118.89 1in0 s GLU 86 Ca 0.45 0.62 0.03 0.00 -0.41 0.00 0.00 54.97 55.65 1in0 s GLU 86 Cb -0.11 -3.22 0.08 0.00 -1.78 0.00 0.00 34.13 29.09 1in0 s GLU 86 CO 0.28 0.65 -0.04 -1.58 -0.49 0.00 0.00 175.26 174.08 1in0 s HIS 87 N -1.11 3.35 -0.21 1.61 5.65 -1.26 -0.28 115.29 123.04 1in0 s HIS 87 Ca 0.27 -2.53 0.00 0.00 0.25 0.00 0.00 55.06 53.06 1in0 s HIS 87 Cb -0.18 -2.29 0.05 0.00 -1.18 0.00 0.00 32.58 28.98 1in0 s HIS 87 CO 0.17 -0.90 -0.07 -3.38 -0.65 0.00 0.00 174.74 169.92 1in0 s HIS 88 N 1.06 2.26 0.00 3.88 -3.43 -0.70 -5.01 115.29 113.35 1in0 s HIS 88 Ca -0.00 -1.58 0.00 0.00 -0.80 0.00 0.00 55.06 52.68 1in0 s HIS 88 Cb -0.19 -1.54 0.00 0.00 -1.43 0.00 0.00 32.58 29.41 1in0 s HIS 88 CO -0.07 -0.74 0.00 0.41 -2.00 0.00 0.00 174.74 172.35 1in0 n GLY 89 N 4.72 1.95 0.71 -1.38 0.00 -1.26 -2.12 105.19 107.80 1in0 n GLY 89 Ca -0.13 -0.42 0.13 0.00 0.00 0.00 0.00 46.02 45.60 1in0 n GLY 89 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1in0 n LYS 90 N 13.01 1.97 -3.94 1.61 5.02 -1.26 -4.97 118.16 129.61 1in0 n LYS 90 Ca 0.00 -1.42 -0.35 0.00 -2.02 0.00 0.00 58.31 54.53 1in0 n LYS 90 Cb 0.00 -1.46 -0.06 0.00 -0.02 0.00 0.00 35.03 33.49 1in0 n LYS 90 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1in0 s LEU 91 N -1.88 4.29 -0.08 -0.35 1.43 -0.90 -4.61 118.68 116.58 1in0 s LEU 91 Ca 0.34 0.36 0.04 0.00 -1.03 0.00 0.00 54.13 53.84 1in0 s LEU 91 Cb 0.20 -2.36 -0.01 0.00 0.03 0.00 0.00 46.19 44.05 1in0 s LEU 91 CO 0.31 0.32 -0.22 -0.31 0.23 0.00 0.00 176.35 176.68 1in0 s TYR 92 N -1.19 2.55 0.13 0.29 1.51 -0.02 -1.73 117.35 118.89 1in0 s TYR 92 Ca 0.22 -0.77 -0.10 0.00 -1.01 0.00 0.00 57.07 55.41 1in0 s TYR 92 Cb -0.12 -1.67 -0.00 0.00 -0.11 0.00 0.00 41.96 40.06 1in0 s TYR 92 CO 0.13 -0.25 0.26 -1.54 -1.11 0.00 0.00 175.55 173.04 1in0 s SER 93 N 0.02 0.04 -0.02 2.29 1.04 0.62 -1.59 113.70 116.11 1in0 s SER 93 Ca -0.08 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 55.61 1in0 s SER 93 Cb -0.15 0.41 0.03 0.00 0.10 0.00 0.00 66.02 66.41 1in0 s SER 93 CO 0.05 -0.84 0.02 -0.54 0.98 0.00 0.00 173.24 172.92 1in0 s LYS 94 N -3.91 0.03 -0.37 4.02 1.02 -0.67 0.45 119.74 120.32 1in0 s LYS 94 Ca 0.11 0.17 -0.17 0.00 0.02 0.00 0.00 55.97 56.10 1in0 s LYS 94 Cb 0.04 -0.30 0.00 0.00 -0.52 0.00 0.00 37.83 37.05 1in0 s LYS 94 CO -0.05 -0.16 0.47 -1.21 -0.92 0.00 0.00 175.35 173.48 1in0 s GLU 95 N 1.07 3.47 -0.16 1.68 2.02 -1.26 -1.11 118.70 124.42 1in0 s GLU 95 Ca -0.09 -0.37 -0.19 0.00 0.02 0.00 0.00 54.97 54.35 1in0 s GLU 95 Cb -0.13 -3.85 -0.04 0.00 0.10 0.00 0.00 34.13 30.21 1in0 s GLU 95 CO -0.03 -0.68 0.51 0.42 0.02 0.00 0.00 175.26 175.50 1in0 s ILE 96 N 2.28 5.14 -0.07 -1.63 1.01 0.28 -4.44 121.20 123.78 1in0 s ILE 96 Ca 0.16 0.98 -0.26 0.00 0.00 0.00 0.00 60.65 61.53 1in0 s ILE 96 Cb -0.16 -3.84 -0.03 0.00 0.01 0.00 0.00 42.46 38.44 1in0 s ILE 96 CO 0.13 0.25 0.80 -0.54 0.00 0.00 0.00 174.94 175.58 1in0 s LYS 97 N 1.13 4.44 0.21 2.79 1.02 -0.51 -0.59 119.74 128.23 1in0 s LYS 97 Ca 0.26 1.05 -0.30 0.00 0.02 0.00 0.00 55.97 57.00 1in0 s LYS 97 Cb -0.15 -3.48 -0.08 0.00 -0.52 0.00 0.00 37.83 33.60 1in0 s LYS 97 CO 0.10 -0.05 1.11 -0.51 -0.92 0.00 0.00 175.35 175.08 1in0 s LEU 98 N 1.15 4.51 -1.25 3.17 1.43 -0.25 -0.82 118.68 126.62 1in0 s LEU 98 Ca 0.41 2.15 -0.11 0.00 -1.03 0.00 0.00 54.13 55.56 1in0 s LEU 98 Cb -0.18 -3.61 0.17 0.00 0.03 0.00 0.00 46.19 42.60 1in0 s LEU 98 CO 0.19 -0.20 1.69 0.29 0.23 0.00 0.00 176.35 178.55 1in0 n LYS 99 N 2.01 3.55 -3.05 1.70 5.02 0.16 -4.89 118.16 122.66 1in0 n LYS 99 Ca 0.02 -3.69 -0.43 0.00 -2.02 0.00 0.00 58.31 52.18 1in0 n LYS 99 Cb 0.46 -2.95 -0.06 0.00 -0.02 0.00 0.00 35.03 32.46 1in0 n LYS 99 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1in0 s GLN 100 N 0.71 3.26 0.00 1.97 0.74 -1.26 -4.57 119.66 120.51 1in0 s GLN 100 Ca 0.40 -0.47 0.00 0.00 0.05 0.00 0.00 55.36 55.35 1in0 s GLN 100 Cb 0.05 -4.01 0.00 0.00 1.10 0.00 0.00 33.01 30.14 1in0 s GLN 100 CO 0.01 -1.18 0.00 0.41 -0.55 0.00 0.00 175.29 173.97 1in0 n GLY 101 N 5.09 2.09 3.41 2.59 0.00 0.29 -4.92 105.19 113.74 1in0 n GLY 101 Ca -0.02 -1.95 -0.41 0.00 0.00 0.00 0.00 46.02 43.65 1in0 n GLY 101 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1in0 s ILE 102 N -2.68 4.74 0.76 -0.61 1.01 0.10 -4.74 121.20 119.78 1in0 s ILE 102 Ca 0.00 -0.71 -0.12 0.00 0.00 0.00 0.00 60.65 59.82 1in0 s ILE 102 Cb 0.00 -3.59 0.05 0.00 0.01 0.00 0.00 42.46 38.92 1in0 s ILE 102 CO 0.00 -0.18 1.12 -1.61 0.00 0.00 0.00 174.94 174.26 1in0 s GLU 103 N 1.60 2.42 0.21 2.79 2.02 -1.26 -4.39 118.70 122.08 1in0 s GLU 103 Ca 0.03 0.41 -0.17 0.00 0.02 0.00 0.00 54.97 55.27 1in0 s GLU 103 Cb -0.19 -1.98 0.22 0.00 0.10 0.00 0.00 34.13 32.28 1in0 s GLU 103 CO 0.07 -1.34 1.59 1.15 0.02 0.00 0.00 175.26 176.75 1in0 h THR 104 N -0.87 0.17 -0.99 3.63 2.02 -1.98 0.11 112.91 115.01 1in0 h THR 104 Ca -0.46 0.00 0.09 0.00 0.77 0.00 0.00 66.41 66.81 1in0 h THR 104 Cb 1.28 0.17 -0.07 0.00 -1.74 0.00 0.00 68.15 67.79 1in0 h THR 104 CO 0.63 0.00 0.63 -0.08 0.37 0.00 0.00 175.52 177.07 1in0 h GLU 105 N -0.08 1.05 -0.33 6.66 4.81 -1.99 0.11 114.58 124.81 1in0 h GLU 105 Ca 0.30 -0.06 -0.17 0.00 -0.13 0.00 0.00 59.36 59.30 1in0 h GLU 105 Cb 0.56 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 1in0 h GLU 105 CO -0.76 0.70 -0.45 1.98 -0.73 0.00 0.00 179.01 179.74 1in0 h MET 106 N 1.09 0.88 -0.77 1.92 4.05 -1.21 -2.20 114.93 118.67 1in0 h MET 106 Ca 0.45 -0.50 -0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1in0 h MET 106 Cb 0.30 0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 31.09 1in0 h MET 106 CO -0.21 1.14 0.47 0.00 0.23 0.00 0.00 176.91 178.53 1in0 h ALA 107 N 0.78 0.99 -0.59 0.39 0.00 -0.07 -1.67 119.26 119.08 1in0 h ALA 107 Ca 0.04 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1in0 h ALA 107 Cb 1.04 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1in0 h ALA 107 CO 0.10 0.46 0.07 0.87 0.00 0.00 0.00 179.25 180.75 1in0 h LYS 108 N 1.06 0.98 -0.60 0.00 1.57 -0.72 0.01 116.57 118.87 1in0 h LYS 108 Ca 0.28 -0.26 0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1in0 h LYS 108 Cb -0.04 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.12 1in0 h LYS 108 CO -0.05 0.93 0.36 0.87 -0.57 0.00 0.00 179.45 180.99 1in0 h LYS 109 N 0.92 0.69 -0.06 3.15 1.57 -0.72 -0.77 116.57 121.36 1in0 h LYS 109 Ca 0.18 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 1in0 h LYS 109 Cb 0.44 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.60 1in0 h LYS 109 CO 0.02 0.46 0.01 0.82 -0.57 0.00 0.00 179.45 180.18 1in0 h ILE 110 N 0.71 1.21 -0.65 1.86 2.04 -0.50 -2.17 117.51 120.02 1in0 h ILE 110 Ca 0.24 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.46 1in0 h ILE 110 Cb 0.03 1.54 -0.03 0.00 -0.74 0.00 0.00 36.82 37.61 1in0 h ILE 110 CO -0.11 0.18 0.41 0.71 0.00 0.00 0.00 178.15 179.35 1in0 h THR 111 N -0.15 1.17 -0.04 -0.27 1.35 -0.87 -0.10 112.91 114.00 1in0 h THR 111 Ca 0.02 -0.34 -0.00 0.00 -0.55 0.00 0.00 66.41 65.54 1in0 h THR 111 Cb 0.27 0.23 -0.00 0.00 -1.73 0.00 0.00 68.15 66.93 1in0 h THR 111 CO 0.00 0.17 0.02 0.50 -0.25 0.00 0.00 175.52 175.96 1in0 h LYS 112 N 0.88 0.06 -0.09 4.72 1.63 -1.16 -0.61 116.57 122.00 1in0 h LYS 112 Ca 0.24 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 60.03 1in0 h LYS 112 Cb -0.08 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 31.54 1in0 h LYS 112 CO -0.05 0.16 0.06 1.25 -3.45 0.00 0.00 179.45 177.42 1in0 h LEU 113 N -0.06 0.11 -0.25 5.20 5.85 -0.75 -1.90 115.31 123.51 1in0 h LEU 113 Ca 0.01 -0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.73 1in0 h LEU 113 Cb 0.12 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.07 1in0 h LEU 113 CO -0.00 0.13 -0.08 0.58 -0.34 0.00 0.00 178.44 178.73 1in0 h VAL 114 N 0.08 0.70 -0.21 1.05 2.07 -0.92 -2.58 116.25 116.45 1in0 h VAL 114 Ca 0.03 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.61 1in0 h VAL 114 Cb 0.04 0.70 -0.07 0.00 -1.52 0.00 0.00 31.29 30.44 1in0 h VAL 114 CO -0.01 0.00 -0.40 0.11 0.02 0.00 0.00 177.57 177.30 1in0 h LYS 115 N -0.03 -0.41 -0.05 1.57 1.57 -0.87 -1.57 116.57 116.78 1in0 h LYS 115 Ca 0.13 0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1in0 h LYS 115 Cb 0.23 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 1in0 h LYS 115 CO -0.28 -0.27 0.07 -0.44 -0.57 0.00 0.00 179.45 177.96 1in0 h ASP 116 N -0.42 0.00 1.18 0.86 3.32 -1.13 -2.38 116.42 117.86 1in0 h ASP 116 Ca 0.10 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 1in0 h ASP 116 Cb 0.60 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.15 1in0 h ASP 116 CO -0.44 0.00 -0.05 0.77 -1.72 0.00 0.00 179.24 177.80 1in0 h SER 117 N 0.00 0.00 0.00 6.45 4.64 -0.88 -3.46 113.55 120.30 1in0 h SER 117 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1in0 h SER 117 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1in0 h SER 117 CO -0.00 0.05 0.00 0.29 -0.87 0.00 0.00 176.83 176.30 1in0 n LYS 118 N -3.16 -0.00 -1.76 4.77 4.76 -0.90 -5.01 118.16 116.87 1in0 n LYS 118 Ca 0.01 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.07 1in0 n LYS 118 Cb 0.38 -2.98 0.05 0.00 -1.84 0.00 0.00 35.03 30.64 1in0 n LYS 118 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1in0 s ILE 119 N -3.28 2.03 -1.31 -0.18 1.01 -1.26 -4.86 121.20 113.35 1in0 s ILE 119 Ca 0.00 0.02 -0.12 0.00 0.00 0.00 0.00 60.65 60.55 1in0 s ILE 119 Cb 0.00 -3.01 0.13 0.00 0.01 0.00 0.00 42.46 39.59 1in0 s ILE 119 CO 0.00 -0.00 1.87 0.29 0.00 0.00 0.00 174.94 177.09 1in0 n LYS 120 N -1.22 3.34 -4.17 2.79 5.02 -1.26 -4.88 118.16 117.78 1in0 n LYS 120 Ca 0.12 -3.33 -0.11 0.00 -2.02 0.00 0.00 58.31 52.96 1in0 n LYS 120 Cb 0.45 -3.10 -0.10 0.00 -0.02 0.00 0.00 35.03 32.26 1in0 n LYS 120 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1in0 s VAL 121 N 1.72 0.72 0.07 -0.18 -7.23 -1.26 -4.45 120.40 109.79 1in0 s VAL 121 Ca 0.44 -1.87 0.07 0.00 -1.81 0.00 0.00 61.98 58.80 1in0 s VAL 121 Cb 0.08 -1.61 -0.04 0.00 0.56 0.00 0.00 36.38 35.37 1in0 s VAL 121 CO -0.01 -0.82 -0.13 0.00 -0.31 0.00 0.00 175.10 173.83 1in0 s GLN 122 N -3.64 2.14 -0.05 4.82 1.03 0.84 -4.94 119.66 119.86 1in0 s GLN 122 Ca 0.10 -0.98 0.05 0.00 0.04 0.00 0.00 55.36 54.57 1in0 s GLN 122 Cb 0.04 -2.28 -0.02 0.00 0.03 0.00 0.00 33.01 30.78 1in0 s GLN 122 CO -0.04 0.53 -0.19 0.95 -2.54 0.00 0.00 175.29 174.00 1in0 s THR 123 N -1.09 2.61 -0.16 3.63 -4.23 -1.26 -0.69 115.64 114.45 1in0 s THR 123 Ca 0.18 -0.89 0.01 0.00 -1.18 0.00 0.00 61.69 59.82 1in0 s THR 123 Cb -0.11 -1.99 0.01 0.00 1.34 0.00 0.00 72.50 71.76 1in0 s THR 123 CO 0.10 0.58 -0.20 -1.10 -0.54 0.00 0.00 174.62 173.46 1in0 s GLN 124 N -0.55 3.02 -0.53 3.99 -0.21 0.53 -4.96 119.66 120.95 1in0 s GLN 124 Ca 0.08 -0.83 -0.27 0.00 0.02 0.00 0.00 55.36 54.36 1in0 s GLN 124 Cb -0.11 -2.53 0.03 0.00 1.00 0.00 0.00 33.01 31.40 1in0 s GLN 124 CO 0.01 -0.12 1.08 0.42 -2.12 0.00 0.00 175.29 174.56 1in0 s ILE 125 N 1.08 4.22 -0.33 1.08 1.01 -1.26 0.11 121.20 127.11 1in0 s ILE 125 Ca -0.00 0.81 -0.01 0.00 0.00 0.00 0.00 60.65 61.45 1in0 s ILE 125 Cb -0.14 -4.61 0.07 0.00 0.01 0.00 0.00 42.46 37.80 1in0 s ILE 125 CO -0.08 -1.13 0.05 -1.10 0.00 0.00 0.00 174.94 172.69 1in0 s GLN 126 N 4.40 2.17 7.95 2.79 -0.21 -0.44 -4.98 119.66 131.34 1in0 s GLN 126 Ca 0.40 -1.50 0.00 0.00 0.02 0.00 0.00 55.36 54.28 1in0 s GLN 126 Cb -0.09 -3.27 0.00 0.00 1.00 0.00 0.00 33.01 30.65 1in0 s GLN 126 CO 0.26 -0.78 0.00 0.41 -2.12 0.00 0.00 175.29 173.05 1in0 n GLY 127 N 4.55 3.92 1.33 3.09 0.00 -1.26 -2.25 105.19 114.57 1in0 n GLY 127 Ca -0.08 0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.87 1in0 n GLY 127 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1in0 n GLU 128 N 13.68 2.38 -4.19 1.61 1.02 -1.26 -4.87 120.64 129.01 1in0 n GLU 128 Ca 0.00 -3.56 -0.11 0.00 -0.02 0.00 0.00 57.16 53.47 1in0 n GLU 128 Cb 0.00 -1.93 -0.10 0.00 -0.02 0.00 0.00 31.44 29.39 1in0 n GLU 128 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1in0 s GLN 129 N -3.40 0.89 -0.17 3.49 -0.21 -0.95 0.03 119.66 119.33 1in0 s GLN 129 Ca 0.46 -1.37 0.01 0.00 0.02 0.00 0.00 55.36 54.48 1in0 s GLN 129 Cb 0.40 -0.28 0.02 0.00 1.00 0.00 0.00 33.01 34.15 1in0 s GLN 129 CO -0.01 -0.01 -0.20 0.08 -2.12 0.00 0.00 175.29 173.03 1in0 s VAL 130 N -3.58 2.07 -0.19 1.09 1.01 -0.37 -1.33 120.40 119.10 1in0 s VAL 130 Ca 0.14 -0.94 -0.15 0.00 0.00 0.00 0.00 61.98 61.02 1in0 s VAL 130 Cb 0.05 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 1in0 s VAL 130 CO -0.03 0.54 0.37 -0.60 0.00 0.00 0.00 175.10 175.38 1in0 s ARG 131 N 1.20 4.19 -0.22 2.72 3.52 0.30 -0.69 118.95 129.98 1in0 s ARG 131 Ca 0.03 0.16 -0.06 0.00 -0.13 0.00 0.00 55.73 55.73 1in0 s ARG 131 Cb -0.13 -3.51 -0.03 0.00 -1.56 0.00 0.00 34.95 29.71 1in0 s ARG 131 CO -0.11 0.03 0.03 0.08 -0.81 0.00 0.00 175.30 174.52 1in0 s VAL 132 N 1.11 4.21 0.00 7.11 1.01 -0.70 -0.35 120.40 132.79 1in0 s VAL 132 Ca 0.18 -0.22 0.04 0.00 0.00 0.00 0.00 61.98 61.98 1in0 s VAL 132 Cb -0.14 -2.93 -0.01 0.00 0.00 0.00 0.00 36.38 33.30 1in0 s VAL 132 CO 0.07 0.40 -0.14 -0.89 0.00 0.00 0.00 175.10 174.54 1in0 s THR 133 N 1.14 1.11 0.24 3.92 2.01 0.13 -1.97 115.64 122.21 1in0 s THR 133 Ca 0.03 -0.68 -0.22 0.00 0.31 0.00 0.00 61.69 61.13 1in0 s THR 133 Cb -0.14 -0.94 0.04 0.00 0.01 0.00 0.00 72.50 71.46 1in0 s THR 133 CO 0.02 0.25 0.74 -0.83 -0.69 0.00 0.00 174.62 174.11 1in0 s GLY 134 N -0.50 -0.20 0.09 4.40 0.00 -0.49 -0.11 107.32 110.50 1in0 s GLY 134 Ca 0.05 -0.09 -0.07 0.00 0.00 0.00 0.00 44.72 44.61 1in0 s GLY 134 CO -0.00 -0.03 1.19 0.50 0.00 0.00 0.00 173.10 174.77 1in0 h LYS 135 N 2.00 0.40 -5.36 2.90 1.57 -1.84 0.14 116.57 116.39 1in0 h LYS 135 Ca -0.22 -0.54 -0.60 0.00 -1.87 0.00 0.00 60.65 57.42 1in0 h LYS 135 Cb 1.26 0.18 -0.11 0.00 0.08 0.00 0.00 32.23 33.64 1in0 h LYS 135 CO 0.26 1.21 -0.42 0.45 -0.57 0.00 0.00 179.45 180.38 1in0 s SER 136 N -7.20 6.30 0.42 0.86 0.15 -1.26 -4.36 113.70 108.61 1in0 s SER 136 Ca -0.06 0.34 0.19 0.00 0.70 0.00 0.00 55.95 57.12 1in0 s SER 136 Cb 0.07 -2.13 0.91 0.00 -1.71 0.00 0.00 66.02 63.17 1in0 s SER 136 CO 0.89 0.15 1.86 -0.09 1.20 0.00 0.00 173.24 177.25 1in0 h ARG 137 N 6.68 0.00 -0.29 5.44 2.43 -1.95 -2.00 114.38 124.70 1in0 h ARG 137 Ca -0.41 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 58.77 1in0 h ARG 137 Cb 1.16 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.69 1in0 h ARG 137 CO 0.76 0.30 0.18 -0.44 -1.51 0.00 0.00 179.97 179.26 1in0 h ASP 138 N 0.00 0.31 -0.06 -3.80 3.32 -2.00 -0.16 116.42 114.03 1in0 h ASP 138 Ca -0.00 -0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 1in0 h ASP 138 Cb 0.65 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 1in0 h ASP 138 CO 0.04 0.22 -0.06 0.44 -1.72 0.00 0.00 179.24 178.16 1in0 h ASP 139 N 0.37 0.28 -0.50 6.45 3.32 -1.79 -0.16 116.42 124.39 1in0 h ASP 139 Ca 0.11 -0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.08 1in0 h ASP 139 Cb -0.03 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 1in0 h ASP 139 CO -0.04 0.38 0.18 -0.07 -1.72 0.00 0.00 179.24 177.97 1in0 h LEU 140 N 0.29 0.71 -0.32 1.55 3.38 -0.91 -0.91 115.31 119.10 1in0 h LEU 140 Ca 0.06 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1in0 h LEU 140 Cb 0.30 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1in0 h LEU 140 CO 0.01 0.71 0.11 1.56 0.09 0.00 0.00 178.44 180.92 1in0 h GLN 141 N 0.67 0.49 -0.77 1.13 1.08 -0.21 -2.07 115.11 115.43 1in0 h GLN 141 Ca 0.16 -0.10 0.05 0.00 -1.45 0.00 0.00 58.65 57.31 1in0 h GLN 141 Cb 0.24 -0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 27.55 1in0 h GLN 141 CO -0.01 0.52 0.51 0.00 -0.95 0.00 0.00 178.83 178.90 1in0 h ALA 142 N 0.95 1.60 -0.50 3.87 0.00 -0.78 -2.44 119.26 121.95 1in0 h ALA 142 Ca 0.10 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1in0 h ALA 142 Cb 0.23 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1in0 h ALA 142 CO -0.00 0.30 0.27 0.28 0.00 0.00 0.00 179.25 180.09 1in0 h VAL 143 N 0.88 1.18 -0.36 0.00 2.07 -0.48 -1.55 116.25 117.98 1in0 h VAL 143 Ca 0.32 -0.45 0.04 0.00 0.82 0.00 0.00 66.70 67.42 1in0 h VAL 143 Cb 0.15 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 30.45 1in0 h VAL 143 CO -0.10 0.19 0.15 0.40 0.02 0.00 0.00 177.57 178.23 1in0 h ILE 144 N 0.66 0.93 -0.93 4.57 2.04 -1.05 0.28 117.51 124.01 1in0 h ILE 144 Ca 0.18 -0.11 -0.00 0.00 1.00 0.00 0.00 64.86 65.92 1in0 h ILE 144 Cb 0.06 0.59 -0.05 0.00 -0.74 0.00 0.00 36.82 36.68 1in0 h ILE 144 CO -0.03 0.06 0.58 1.56 0.00 0.00 0.00 178.15 180.32 1in0 h GLN 145 N 0.32 1.25 0.23 2.37 1.08 -1.39 0.19 115.11 119.16 1in0 h GLN 145 Ca 0.16 -0.10 -0.01 0.00 -1.45 0.00 0.00 58.65 57.25 1in0 h GLN 145 Cb 0.11 -0.27 0.00 0.00 -0.05 0.00 0.00 27.48 27.27 1in0 h GLN 145 CO -0.14 0.86 -0.11 1.25 -0.95 0.00 0.00 178.83 179.74 1in0 h LEU 146 N 1.28 -0.26 -1.09 1.46 5.85 -0.46 -0.03 115.31 122.05 1in0 h LEU 146 Ca 0.34 -0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.91 1in0 h LEU 146 Cb -0.08 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1in0 h LEU 146 CO -0.07 -0.07 0.07 0.58 -0.34 0.00 0.00 178.44 178.62 1in0 h VAL 147 N -0.45 1.22 -0.03 1.05 2.07 -0.18 -2.31 116.25 117.62 1in0 h VAL 147 Ca -0.03 -0.82 -0.04 0.00 0.82 0.00 0.00 66.70 66.62 1in0 h VAL 147 Cb 0.34 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 1in0 h VAL 147 CO 0.05 0.30 -0.19 0.11 0.02 0.00 0.00 177.57 177.86 1in0 h LYS 148 N 0.69 0.05 0.00 1.57 1.57 -0.41 -2.82 116.57 117.23 1in0 h LYS 148 Ca 0.15 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1in0 h LYS 148 Cb 0.32 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.62 1in0 h LYS 148 CO 0.00 0.24 -1.03 -1.13 -0.57 0.00 0.00 179.45 176.96 1in0 n SER 149 N -4.29 0.67 -4.42 0.86 3.41 -0.04 -4.86 113.62 104.95 1in0 n SER 149 Ca -0.02 0.10 -0.29 0.00 -0.26 0.00 0.00 58.87 58.40 1in0 n SER 149 Cb 0.26 0.64 0.16 0.00 -0.26 0.00 0.00 64.21 65.01 1in0 n SER 149 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1in0 s ALA 150 N -3.29 1.93 -0.54 7.33 0.00 -0.91 -5.02 121.76 121.26 1in0 s ALA 150 Ca 0.01 -0.86 0.07 0.00 0.00 0.00 0.00 51.96 51.18 1in0 s ALA 150 Cb 0.12 -2.90 0.24 0.00 0.00 0.00 0.00 23.12 20.58 1in0 s ALA 150 CO 0.79 -2.43 0.63 0.39 0.00 0.00 0.00 175.76 175.14 1in0 n GLU 151 N -3.83 1.69 0.15 0.00 -0.58 -1.26 -4.96 120.64 111.84 1in0 n GLU 151 Ca 0.11 -4.04 0.13 0.00 -0.42 0.00 0.00 57.16 52.94 1in0 n GLU 151 Cb 0.60 -1.83 0.51 0.00 -0.57 0.00 0.00 31.44 30.15 1in0 n GLU 151 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1in0 h LEU 152 N 4.25 0.00 0.00 -4.62 3.38 -1.95 -3.47 115.31 112.90 1in0 h LEU 152 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1in0 h LEU 152 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1in0 h LEU 152 CO 0.66 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.80 1in0 n GLY 153 N 0.05 1.02 3.58 0.83 0.00 -1.26 -5.04 105.19 104.37 1in0 n GLY 153 Ca 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 1in0 n GLY 153 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1in0 s GLN 154 N -0.24 0.82 0.53 1.61 -2.07 -1.26 -4.82 119.66 114.23 1in0 s GLN 154 Ca 0.00 0.48 -0.20 0.00 -1.82 0.00 0.00 55.36 53.82 1in0 s GLN 154 Cb 0.00 0.39 -0.06 0.00 -1.09 0.00 0.00 33.01 32.25 1in0 s GLN 154 CO 0.00 -0.20 1.15 -1.25 -1.32 0.00 0.00 175.29 173.67 1in0 s PRO 155 N -0.55 3.42 0.04 9.60 0.04 -1.26 -5.04 135.00 141.25 1in0 s PRO 155 Ca -0.04 1.68 0.06 0.00 0.04 0.00 0.00 61.00 62.74 1in0 s PRO 155 Cb -0.02 -2.10 -0.02 0.00 0.04 0.00 0.00 34.50 32.40 1in0 s PRO 155 CO 0.03 -0.81 -0.17 -0.06 0.04 0.00 0.00 177.00 176.04 1in0 s PHE 156 N -1.69 1.44 0.25 0.56 0.08 -1.26 -4.57 117.98 112.78 1in0 s PHE 156 Ca 0.71 -0.36 0.10 0.00 0.12 0.00 0.00 56.93 57.50 1in0 s PHE 156 Cb -0.26 -0.85 -0.04 0.00 -0.57 0.00 0.00 43.02 41.30 1in0 s PHE 156 CO 0.30 0.06 -0.09 -0.65 -0.10 0.00 0.00 175.22 174.73 1in0 s GLN 157 N -1.19 2.02 -0.18 0.44 1.11 0.26 -4.94 119.66 117.18 1in0 s GLN 157 Ca 0.04 -1.50 0.01 0.00 0.01 0.00 0.00 55.36 53.92 1in0 s GLN 157 Cb -0.08 -2.03 0.04 0.00 -1.01 0.00 0.00 33.01 29.93 1in0 s GLN 157 CO 0.02 0.37 -0.11 -0.06 0.01 0.00 0.00 175.29 175.52 1in0 s PHE 158 N -2.22 2.32 0.00 0.91 0.08 -1.26 0.46 117.98 118.27 1in0 s PHE 158 Ca 0.29 -1.47 0.00 0.00 0.12 0.00 0.00 56.93 55.87 1in0 s PHE 158 Cb -0.07 -1.61 0.00 0.00 -0.57 0.00 0.00 43.02 40.77 1in0 s PHE 158 CO 0.17 -0.72 0.00 0.27 -0.10 0.00 0.00 175.22 174.84 1in0 n ASN 159 N 4.72 0.00 -4.08 1.36 0.23 0.09 -4.94 115.26 112.64 1in0 n ASN 159 Ca -0.15 0.00 -0.28 0.00 -0.53 0.00 0.00 54.58 53.62 1in0 n ASN 159 Cb 0.47 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 38.13 1in0 n ASN 159 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1in0 n ASN 160 N 0.00 -0.04 -4.72 0.53 5.15 -1.26 0.53 115.26 115.44 1in0 n ASN 160 Ca 0.00 -1.11 -0.42 0.00 -0.60 0.00 0.00 54.58 52.45 1in0 n ASN 160 Cb 0.00 -2.50 -0.03 0.00 -0.53 0.00 0.00 39.78 36.72 1in0 n ASN 160 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1in0 s PHE 161 N -4.10 3.20 0.02 1.20 0.08 -1.26 -4.04 117.98 113.09 1in0 s PHE 161 Ca 0.02 0.96 0.02 0.00 0.12 0.00 0.00 56.93 58.06 1in0 s PHE 161 Cb -0.01 -3.72 -0.01 0.00 -0.57 0.00 0.00 43.02 38.71 1in0 s PHE 161 CO 0.93 -2.47 -0.07 1.03 -0.10 0.00 0.00 175.22 174.55 1in0 s ARG 162 N 0.73 0.49 0.00 0.44 0.52 0.55 -4.98 118.95 116.69 1in0 s ARG 162 Ca 0.63 -0.46 0.00 0.00 -0.52 0.00 0.00 55.73 55.38 1in0 s ARG 162 Cb -0.38 -0.37 0.00 0.00 0.52 0.00 0.00 34.95 34.71 1in0 s ARG 162 CO 0.33 0.09 0.43 -0.25 0.02 0.00 0.00 175.30 175.92