#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nf2 s TYR 2 N 0.00 3.17 0.00 2.03 2.02 -0.05 -4.47 117.35 120.04 1nf2 s TYR 2 Ca 0.00 0.17 0.00 0.00 -0.37 0.00 0.00 57.07 56.87 1nf2 s TYR 2 Cb 0.00 -1.81 0.00 0.00 -0.40 0.00 0.00 41.96 39.75 1nf2 s TYR 2 CO 0.00 0.44 0.21 0.54 -1.57 0.00 0.00 175.55 175.17 1nf2 n ARG 3 N 2.25 0.66 -4.22 -0.62 1.74 -0.16 -2.94 116.66 113.37 1nf2 n ARG 3 Ca -0.19 -0.21 -0.25 0.00 -0.77 0.00 0.00 57.85 56.44 1nf2 n ARG 3 Cb 0.54 -0.65 -0.17 0.00 -1.02 0.00 0.00 32.46 31.16 1nf2 n ARG 3 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1nf2 s VAL 4 N -0.15 0.96 -0.24 1.55 1.01 -0.44 -2.00 120.40 121.09 1nf2 s VAL 4 Ca 0.00 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 61.68 1nf2 s VAL 4 Cb 0.00 -0.94 0.06 0.00 0.00 0.00 0.00 36.38 35.49 1nf2 s VAL 4 CO 0.00 0.34 -0.10 -0.36 0.00 0.00 0.00 175.10 174.97 1nf2 s PHE 5 N 1.17 2.99 -0.20 5.22 0.08 -0.26 -1.16 117.98 125.82 1nf2 s PHE 5 Ca -0.06 -2.10 -0.08 0.00 0.12 0.00 0.00 56.93 54.81 1nf2 s PHE 5 Cb -0.14 -1.83 -0.04 0.00 -0.57 0.00 0.00 43.02 40.43 1nf2 s PHE 5 CO -0.02 -0.84 0.09 0.08 -0.10 0.00 0.00 175.22 174.43 1nf2 s VAL 6 N 1.20 4.94 -0.08 -0.44 1.01 0.68 -0.50 120.40 127.21 1nf2 s VAL 6 Ca -0.07 0.02 0.02 0.00 0.00 0.00 0.00 61.98 61.96 1nf2 s VAL 6 Cb -0.19 -3.25 0.01 0.00 0.00 0.00 0.00 36.38 32.95 1nf2 s VAL 6 CO -0.06 0.43 -0.14 -0.36 0.00 0.00 0.00 175.10 174.97 1nf2 s PHE 7 N 0.58 1.65 0.61 5.22 0.08 0.49 -0.86 117.98 125.74 1nf2 s PHE 7 Ca 0.05 -0.66 -0.13 0.00 0.12 0.00 0.00 56.93 56.32 1nf2 s PHE 7 Cb -0.13 -1.20 -0.04 0.00 -0.57 0.00 0.00 43.02 41.09 1nf2 s PHE 7 CO 0.01 -0.33 1.03 0.34 -0.10 0.00 0.00 175.22 176.16 1nf2 s ASP 8 N 0.73 6.15 0.00 1.36 3.68 -0.99 -1.35 116.67 126.25 1nf2 s ASP 8 Ca -0.13 1.52 0.00 0.00 2.13 0.00 0.00 52.55 56.07 1nf2 s ASP 8 Cb -0.16 -2.49 0.00 0.00 -1.45 0.00 0.00 42.92 38.82 1nf2 s ASP 8 CO 0.03 -0.92 0.00 0.18 0.13 0.00 0.00 175.17 174.59 1nf2 n LEU 9 N -2.48 1.35 -4.64 -1.34 4.32 -1.23 -2.57 117.00 110.41 1nf2 n LEU 9 Ca 0.07 0.02 -0.43 0.00 -0.02 0.00 0.00 56.01 55.64 1nf2 n LEU 9 Cb 0.54 -0.04 -0.01 0.00 -1.62 0.00 0.00 43.42 42.29 1nf2 n LEU 9 CO 0.54 -0.04 0.71 0.47 -1.22 0.00 0.00 177.39 177.85 1nf2 n ASP 10 N -1.11 1.87 0.00 -1.43 8.00 -1.26 -1.16 116.55 121.47 1nf2 n ASP 10 Ca 0.00 1.16 0.00 0.00 0.71 0.00 0.00 54.79 56.66 1nf2 n ASP 10 Cb 0.00 -1.38 0.00 0.00 -0.02 0.00 0.00 41.12 39.72 1nf2 n ASP 10 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nf2 n GLY 11 N 1.03 0.06 0.00 0.44 0.00 -1.24 -4.68 105.19 100.79 1nf2 n GLY 11 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1nf2 n GLY 11 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1nf2 n THR 12 N -2.04 0.00 0.07 2.61 -1.04 -0.56 -4.54 114.28 108.78 1nf2 n THR 12 Ca 0.00 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.95 1nf2 n THR 12 Cb 0.24 -0.10 -0.07 0.00 -1.82 0.00 0.00 70.33 68.57 1nf2 n THR 12 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1nf2 h LEU 13 N 0.00 0.01 -9.63 -4.42 6.46 -0.99 -3.42 115.31 103.32 1nf2 h LEU 13 Ca 0.00 -0.01 -0.60 0.00 -0.12 0.00 0.00 57.88 57.15 1nf2 h LEU 13 Cb 0.00 -0.00 -0.06 0.00 -0.73 0.00 0.00 40.66 39.87 1nf2 h LEU 13 CO 0.00 0.95 -0.16 -0.76 -0.62 0.00 0.00 178.44 177.84 1nf2 s LEU 14 N -6.87 4.46 0.00 2.25 1.43 -0.31 -4.49 118.68 115.15 1nf2 s LEU 14 Ca 0.01 1.00 -0.13 0.00 -1.03 0.00 0.00 54.13 53.98 1nf2 s LEU 14 Cb 0.10 -2.66 0.19 0.00 0.03 0.00 0.00 46.19 43.86 1nf2 s LEU 14 CO 0.81 0.27 1.15 -0.46 0.23 0.00 0.00 176.35 178.35 1nf2 n ASN 15 N 2.05 0.25 0.16 2.29 2.04 0.69 -3.68 115.26 119.06 1nf2 n ASN 15 Ca -0.12 -1.51 0.11 0.00 -0.44 0.00 0.00 54.58 52.61 1nf2 n ASN 15 Cb 0.52 -0.86 0.57 0.00 -2.53 0.00 0.00 39.78 37.48 1nf2 n ASN 15 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 1nf2 n ASP 16 N -3.65 0.55 -1.67 0.53 8.00 -1.26 -0.39 116.55 118.67 1nf2 n ASP 16 Ca 0.15 0.75 0.09 0.00 0.71 0.00 0.00 54.79 56.49 1nf2 n ASP 16 Cb 0.52 -0.83 0.37 0.00 -0.02 0.00 0.00 41.12 41.16 1nf2 n ASP 16 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1nf2 n ASN 17 N -2.24 4.99 -2.19 -2.24 3.02 -1.26 -4.93 115.26 110.41 1nf2 n ASN 17 Ca -0.01 -2.53 -0.19 0.00 -0.03 0.00 0.00 54.58 51.81 1nf2 n ASN 17 Cb 0.04 -0.60 -0.01 0.00 -0.61 0.00 0.00 39.78 38.60 1nf2 n ASN 17 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1nf2 n LEU 18 N 1.08 -1.87 -4.46 3.41 4.77 0.48 -5.01 117.00 115.40 1nf2 n LEU 18 Ca 0.27 -0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 56.00 1nf2 n LEU 18 Cb 0.95 -2.77 -0.10 0.00 -2.33 0.00 0.00 43.42 39.17 1nf2 n LEU 18 CO 0.26 -0.23 -0.49 -1.83 -1.33 0.00 0.00 177.39 173.77 1nf2 s GLU 19 N -4.92 1.64 -0.21 3.23 -1.05 -1.26 -4.80 118.70 111.33 1nf2 s GLU 19 Ca 0.00 -1.73 -0.07 0.00 -0.15 0.00 0.00 54.97 53.03 1nf2 s GLU 19 Cb 0.00 -1.75 -0.03 0.00 -0.44 0.00 0.00 34.13 31.91 1nf2 s GLU 19 CO 0.00 0.33 0.04 0.42 0.95 0.00 0.00 175.26 177.01 1nf2 s ILE 20 N -2.41 4.34 0.74 1.83 1.01 -1.26 -0.22 121.20 125.23 1nf2 s ILE 20 Ca 0.28 -0.18 -0.15 0.00 0.00 0.00 0.00 60.65 60.61 1nf2 s ILE 20 Cb -0.05 -2.99 0.04 0.00 0.01 0.00 0.00 42.46 39.48 1nf2 s ILE 20 CO 0.14 0.40 1.23 -0.94 0.00 0.00 0.00 174.94 175.78 1nf2 s SER 21 N 1.02 4.04 0.29 3.58 1.04 -1.26 -4.79 113.70 117.62 1nf2 s SER 21 Ca 0.03 2.44 -0.02 0.00 0.48 0.00 0.00 55.95 58.89 1nf2 s SER 21 Cb -0.14 -2.60 0.42 0.00 0.10 0.00 0.00 66.02 63.81 1nf2 s SER 21 CO 0.03 -2.37 1.89 -0.33 0.98 0.00 0.00 173.24 173.44 1nf2 h GLU 22 N -0.32 0.94 0.00 4.02 4.39 -1.98 -0.74 114.58 120.89 1nf2 h GLU 22 Ca -0.48 -0.13 0.01 0.00 0.34 0.00 0.00 59.36 59.11 1nf2 h GLU 22 Cb 1.31 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 29.77 1nf2 h GLU 22 CO 0.49 0.73 -0.07 -0.22 -1.16 0.00 0.00 179.01 178.78 1nf2 h LYS 23 N 0.93 -0.13 -0.75 2.33 3.64 -2.00 0.13 116.57 120.72 1nf2 h LYS 23 Ca 0.23 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.56 1nf2 h LYS 23 Cb 0.11 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 1nf2 h LYS 23 CO -0.03 -0.08 0.26 -0.44 -2.27 0.00 0.00 179.45 176.89 1nf2 h ASP 24 N -0.13 1.07 0.18 4.20 3.32 -1.85 -2.03 116.42 121.17 1nf2 h ASP 24 Ca 0.03 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 56.88 1nf2 h ASP 24 Cb 0.17 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 1nf2 h ASP 24 CO -0.08 0.97 -0.13 -0.09 -1.72 0.00 0.00 179.24 178.20 1nf2 h ARG 25 N 1.10 -0.30 -0.83 3.56 2.43 -0.72 -1.62 114.38 118.00 1nf2 h ARG 25 Ca 0.25 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.46 1nf2 h ARG 25 Cb 0.27 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.84 1nf2 h ARG 25 CO -0.01 -0.20 0.55 0.00 -1.51 0.00 0.00 179.97 178.80 1nf2 h ARG 26 N -0.31 1.04 -0.38 0.20 3.08 -0.56 -0.94 114.38 116.51 1nf2 h ARG 26 Ca -0.01 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 59.87 1nf2 h ARG 26 Cb 0.27 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1nf2 h ARG 26 CO 0.00 0.69 -0.20 -0.91 -1.07 0.00 0.00 179.97 178.48 1nf2 h ASN 27 N 1.07 0.75 -0.22 7.04 2.35 -1.15 -1.99 115.58 123.44 1nf2 h ASN 27 Ca 0.32 -0.26 -0.03 0.00 -0.55 0.00 0.00 56.30 55.77 1nf2 h ASN 27 Cb -0.04 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.11 1nf2 h ASN 27 CO -0.08 0.94 0.00 0.40 -1.65 0.00 0.00 177.43 177.04 1nf2 h ILE 28 N 0.66 1.25 -0.67 2.81 1.08 -0.74 -2.38 117.51 119.52 1nf2 h ILE 28 Ca 0.10 -0.87 0.13 0.00 -0.39 0.00 0.00 64.86 63.82 1nf2 h ILE 28 Cb 0.70 1.39 -0.09 0.00 -3.07 0.00 0.00 36.82 35.75 1nf2 h ILE 28 CO 0.05 0.27 0.18 -0.33 -0.69 0.00 0.00 178.15 177.63 1nf2 h GLU 29 N 0.16 0.29 -0.71 2.37 4.39 -0.99 0.11 114.58 120.21 1nf2 h GLU 29 Ca 0.06 -0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.71 1nf2 h GLU 29 Cb 0.39 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.95 1nf2 h GLU 29 CO 0.01 0.20 0.30 0.87 -1.16 0.00 0.00 179.01 179.22 1nf2 h LYS 30 N 0.30 1.05 -0.32 2.33 1.57 -1.18 -3.06 116.57 117.26 1nf2 h LYS 30 Ca 0.36 -0.18 -0.07 0.00 -1.87 0.00 0.00 60.65 58.89 1nf2 h LYS 30 Cb 0.57 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1nf2 h LYS 30 CO -0.43 0.85 -0.09 -0.07 -0.57 0.00 0.00 179.45 179.14 1nf2 h LEU 31 N 1.00 0.63 -1.38 2.94 3.38 -0.73 -3.04 115.31 118.11 1nf2 h LEU 31 Ca 0.24 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1nf2 h LEU 31 Cb 0.19 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1nf2 h LEU 31 CO -0.02 0.86 0.40 0.77 0.09 0.00 0.00 178.44 180.54 1nf2 h SER 32 N 0.39 0.00 -3.47 -0.43 4.64 -0.71 -2.38 113.55 111.60 1nf2 h SER 32 Ca 0.08 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.79 1nf2 h SER 32 Cb 0.59 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.57 1nf2 h SER 32 CO 0.03 0.00 0.37 -0.60 -0.87 0.00 0.00 176.83 175.77 1nf2 s ARG 33 N -3.81 3.91 0.00 4.77 6.06 -1.15 -4.01 118.95 124.72 1nf2 s ARG 33 Ca -0.02 0.50 0.00 0.00 -2.50 0.00 0.00 55.73 53.71 1nf2 s ARG 33 Cb 0.06 -3.75 0.00 0.00 0.06 0.00 0.00 34.95 31.32 1nf2 s ARG 33 CO 0.19 -0.71 0.00 1.17 -2.50 0.00 0.00 175.30 173.45 1nf2 n LYS 34 N 6.23 0.00 -4.09 5.12 4.81 -1.26 -4.47 118.16 124.50 1nf2 n LYS 34 Ca 0.03 0.00 -0.23 0.00 -0.87 0.00 0.00 58.31 57.24 1nf2 n LYS 34 Cb 0.48 -0.32 -0.06 0.00 0.02 0.00 0.00 35.03 35.15 1nf2 n LYS 34 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1nf2 s TYR 36 N -2.42 3.40 -0.10 0.00 2.02 -0.84 -4.35 117.35 115.05 1nf2 s TYR 36 Ca 0.38 0.56 0.02 0.00 -0.37 0.00 0.00 57.07 57.66 1nf2 s TYR 36 Cb -0.02 -2.43 -0.02 0.00 -0.40 0.00 0.00 41.96 39.09 1nf2 s TYR 36 CO 0.23 0.09 -0.15 0.08 -1.57 0.00 0.00 175.55 174.23 1nf2 s VAL 37 N 0.98 2.95 -0.06 0.71 1.01 -1.26 -1.10 120.40 123.62 1nf2 s VAL 37 Ca 0.17 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.46 1nf2 s VAL 37 Cb -0.14 -2.20 0.01 0.00 0.00 0.00 0.00 36.38 34.05 1nf2 s VAL 37 CO 0.06 0.55 -0.15 -0.69 0.00 0.00 0.00 175.10 174.87 1nf2 s VAL 38 N -0.02 1.34 -0.16 2.92 1.01 0.35 -3.82 120.40 122.01 1nf2 s VAL 38 Ca -0.04 -0.62 -0.05 0.00 0.00 0.00 0.00 61.98 61.27 1nf2 s VAL 38 Cb -0.14 -1.19 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 1nf2 s VAL 38 CO 0.04 0.40 -0.01 -0.36 0.00 0.00 0.00 175.10 175.17 1nf2 s PHE 39 N 0.44 3.09 -0.18 5.22 0.40 -1.13 -0.38 117.98 125.44 1nf2 s PHE 39 Ca -0.12 -0.20 0.00 0.00 -0.60 0.00 0.00 56.93 56.00 1nf2 s PHE 39 Cb -0.15 -2.00 0.04 0.00 0.51 0.00 0.00 43.02 41.43 1nf2 s PHE 39 CO 0.04 0.01 -0.07 0.00 0.70 0.00 0.00 175.22 175.90 1nf2 s ALA 40 N 0.39 1.70 0.20 5.36 0.00 -0.46 -0.11 121.76 128.84 1nf2 s ALA 40 Ca -0.02 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 50.97 1nf2 s ALA 40 Cb -0.14 -1.19 -0.05 0.00 0.00 0.00 0.00 23.12 21.74 1nf2 s ALA 40 CO 0.02 -0.81 0.01 0.45 0.00 0.00 0.00 175.76 175.43 1nf2 s SER 41 N 1.53 1.37 0.00 0.00 0.15 0.12 -3.55 113.70 113.33 1nf2 s SER 41 Ca -0.00 -1.21 0.24 0.00 0.70 0.00 0.00 55.95 55.68 1nf2 s SER 41 Cb -0.16 0.10 0.35 0.00 -1.71 0.00 0.00 66.02 64.60 1nf2 s SER 41 CO -0.08 -0.57 1.30 0.61 1.20 0.00 0.00 173.24 175.70 1nf2 n GLY 42 N -0.31 -1.04 3.78 9.45 0.00 -1.26 -1.02 105.19 114.79 1nf2 n GLY 42 Ca -0.05 -0.43 -0.29 0.00 0.00 0.00 0.00 46.02 45.25 1nf2 n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nf2 s ARG 43 N -2.90 1.26 0.97 1.61 0.52 -1.26 -3.88 118.95 115.27 1nf2 s ARG 43 Ca 0.13 0.36 -0.11 0.00 -0.52 0.00 0.00 55.73 55.59 1nf2 s ARG 43 Cb 0.17 -1.85 0.17 0.00 0.52 0.00 0.00 34.95 33.96 1nf2 s ARG 43 CO 0.71 -2.13 1.06 -1.33 0.02 0.00 0.00 175.30 173.63 1nf2 n MET 44 N -3.73 -0.83 -0.08 3.54 2.81 -1.26 -1.26 117.12 116.30 1nf2 n MET 44 Ca 0.07 -0.19 -0.11 0.00 -1.81 0.00 0.00 57.70 55.66 1nf2 n MET 44 Cb 0.59 -2.30 -0.04 0.00 -0.71 0.00 0.00 33.22 30.76 1nf2 n MET 44 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1nf2 h LEU 45 N -2.03 0.42 -0.82 4.03 6.46 -1.94 -2.31 115.31 119.12 1nf2 h LEU 45 Ca -0.47 -0.28 0.01 0.00 -0.12 0.00 0.00 57.88 57.02 1nf2 h LEU 45 Cb 1.28 -0.11 -0.04 0.00 -0.73 0.00 0.00 40.66 41.06 1nf2 h LEU 45 CO 0.42 0.59 0.53 -0.37 -0.62 0.00 0.00 178.44 178.99 1nf2 h VAL 46 N 0.23 1.21 -0.82 1.05 -1.51 -1.92 0.55 116.25 115.05 1nf2 h VAL 46 Ca 0.08 -0.40 -0.03 0.00 -1.23 0.00 0.00 66.70 65.12 1nf2 h VAL 46 Cb 0.36 0.02 -0.04 0.00 -2.13 0.00 0.00 31.29 29.50 1nf2 h VAL 46 CO 0.01 0.21 0.39 0.28 -1.23 0.00 0.00 177.57 177.23 1nf2 h SER 47 N 1.11 1.07 -0.14 4.19 0.02 -1.90 -0.68 113.55 117.22 1nf2 h SER 47 Ca 0.30 -0.13 -0.08 0.00 -0.84 0.00 0.00 61.79 61.04 1nf2 h SER 47 Cb -0.12 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 62.15 1nf2 h SER 47 CO -0.06 0.90 -0.24 0.74 -1.14 0.00 0.00 176.83 177.03 1nf2 h THR 48 N 1.17 1.36 0.00 -2.27 2.02 -0.84 -2.85 112.91 111.49 1nf2 h THR 48 Ca 0.28 -1.48 -0.05 0.00 0.77 0.00 0.00 66.41 65.94 1nf2 h THR 48 Cb 0.11 1.98 -0.01 0.00 -1.74 0.00 0.00 68.15 68.50 1nf2 h THR 48 CO -0.04 0.44 -0.22 -0.07 0.37 0.00 0.00 175.52 176.00 1nf2 h LEU 49 N 0.02 0.00 -0.82 2.58 3.38 -0.76 -2.47 115.31 117.24 1nf2 h LEU 49 Ca 0.01 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 1nf2 h LEU 49 Cb 0.82 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1nf2 h LEU 49 CO 0.05 0.22 -0.49 0.78 0.09 0.00 0.00 178.44 179.09 1nf2 h ASN 50 N 0.00 0.25 -0.26 -0.43 2.35 -1.02 -1.01 115.58 115.46 1nf2 h ASN 50 Ca -0.00 -0.12 -0.16 0.00 -0.55 0.00 0.00 56.30 55.46 1nf2 h ASN 50 Cb 0.44 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.73 1nf2 h ASN 50 CO 0.03 0.71 -0.47 0.58 -1.65 0.00 0.00 177.43 176.62 1nf2 h VAL 51 N 0.19 1.29 -0.11 2.81 2.07 -1.22 -1.73 116.25 119.56 1nf2 h VAL 51 Ca 0.01 -1.67 0.00 0.00 0.82 0.00 0.00 66.70 65.86 1nf2 h VAL 51 Cb 0.94 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 32.40 1nf2 h VAL 51 CO 0.08 0.54 0.06 -0.33 0.02 0.00 0.00 177.57 177.94 1nf2 h GLU 52 N 0.54 0.13 0.00 1.57 5.08 -1.24 -2.31 114.58 118.34 1nf2 h GLU 52 Ca 0.02 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 1nf2 h GLU 52 Cb 1.08 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 1nf2 h GLU 52 CO 0.11 0.09 -0.45 0.87 -1.00 0.00 0.00 179.01 178.62 1nf2 h LYS 53 N 0.13 0.00 -0.29 2.33 1.57 -1.01 0.69 116.57 119.99 1nf2 h LYS 53 Ca 0.04 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.75 1nf2 h LYS 53 Cb -0.01 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1nf2 h LYS 53 CO -0.01 0.45 -0.09 -0.22 -0.57 0.00 0.00 179.45 179.01 1nf2 h LYS 54 N 0.00 0.56 0.00 3.15 3.64 -0.97 -3.28 116.57 119.67 1nf2 h LYS 54 Ca -0.00 -0.22 -0.07 0.00 -1.27 0.00 0.00 60.65 59.08 1nf2 h LYS 54 Cb 0.82 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 1nf2 h LYS 54 CO 0.06 0.78 -1.38 0.66 -2.27 0.00 0.00 179.45 177.30 1nf2 n TYR 55 N -4.48 0.77 -3.88 1.91 4.01 -0.90 -4.82 117.16 109.77 1nf2 n TYR 55 Ca -0.03 0.24 -0.16 0.00 -0.16 0.00 0.00 57.90 57.79 1nf2 n TYR 55 Cb 0.33 -0.93 -0.16 0.00 -0.31 0.00 0.00 39.34 38.27 1nf2 n TYR 55 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1nf2 s PHE 56 N -3.20 0.21 -1.40 -0.72 0.40 0.23 -5.04 117.98 108.45 1nf2 s PHE 56 Ca -0.03 0.04 -0.09 0.00 -0.60 0.00 0.00 56.93 56.25 1nf2 s PHE 56 Cb 0.10 -0.32 -0.08 0.00 0.51 0.00 0.00 43.02 43.22 1nf2 s PHE 56 CO 0.82 -0.10 2.74 1.63 0.70 0.00 0.00 175.22 181.01 1nf2 n LYS 57 N 4.04 3.23 -3.90 0.44 4.01 -1.24 -2.79 118.16 121.95 1nf2 n LYS 57 Ca -0.26 -1.97 -0.00 0.00 -0.51 0.00 0.00 58.31 55.57 1nf2 n LYS 57 Cb 0.51 -2.69 0.01 0.00 -0.51 0.00 0.00 35.03 32.36 1nf2 n LYS 57 CO 0.00 0.00 0.00 -0.98 -1.11 0.00 0.00 177.40 175.31 1nf2 s ARG 58 N 2.49 0.79 0.28 1.97 1.70 -1.26 -5.01 118.95 119.91 1nf2 s ARG 58 Ca 0.61 -0.50 0.12 0.00 -0.47 0.00 0.00 55.73 55.49 1nf2 s ARG 58 Cb 0.16 0.23 -0.05 0.00 -0.57 0.00 0.00 34.95 34.72 1nf2 s ARG 58 CO -0.05 -0.37 -0.18 0.95 -1.08 0.00 0.00 175.30 174.57 1nf2 s THR 59 N -2.16 2.54 0.29 4.99 -4.23 -1.26 -3.07 115.64 112.75 1nf2 s THR 59 Ca 0.24 -2.36 0.02 0.00 -1.18 0.00 0.00 61.69 58.42 1nf2 s THR 59 Cb -0.01 -2.36 -0.05 0.00 1.34 0.00 0.00 72.50 71.41 1nf2 s THR 59 CO 0.02 -0.39 0.08 -0.36 -0.54 0.00 0.00 174.62 173.43 1nf2 s PHE 60 N -2.50 1.73 0.23 3.99 0.08 -1.26 -4.79 117.98 115.46 1nf2 s PHE 60 Ca 0.30 -1.10 -0.32 0.00 0.12 0.00 0.00 56.93 55.94 1nf2 s PHE 60 Cb -0.05 -1.07 -0.13 0.00 -0.57 0.00 0.00 43.02 41.20 1nf2 s PHE 60 CO 0.15 -0.20 1.52 -2.30 -0.10 0.00 0.00 175.22 174.30 1nf2 n PRO 61 N -0.58 2.28 -4.27 0.24 -0.02 -1.25 -4.41 135.00 127.00 1nf2 n PRO 61 Ca -0.01 0.82 -0.17 0.00 -2.02 0.00 0.00 63.50 62.11 1nf2 n PRO 61 Cb 0.66 -2.54 -0.14 0.00 -0.02 0.00 0.00 33.50 31.46 1nf2 n PRO 61 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1nf2 s THR 62 N 0.28 0.62 -0.23 3.45 2.01 0.14 -2.82 115.64 119.10 1nf2 s THR 62 Ca 0.70 -0.43 -0.03 0.00 0.31 0.00 0.00 61.69 62.24 1nf2 s THR 62 Cb -0.61 -0.54 0.00 0.00 0.01 0.00 0.00 72.50 71.37 1nf2 s THR 62 CO 0.45 0.11 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.81 1nf2 s ILE 63 N -0.32 3.16 0.41 1.82 1.01 0.84 0.04 121.20 128.16 1nf2 s ILE 63 Ca 0.02 -0.67 0.05 0.00 0.00 0.00 0.00 60.65 60.04 1nf2 s ILE 63 Cb -0.04 -2.48 -0.06 0.00 0.01 0.00 0.00 42.46 39.90 1nf2 s ILE 63 CO -0.00 0.37 0.03 0.00 0.00 0.00 0.00 174.94 175.33 1nf2 s ALA 64 N 1.43 3.16 -1.43 9.38 0.00 -0.41 0.14 121.76 134.02 1nf2 s ALA 64 Ca 0.04 -1.75 -0.13 0.00 0.00 0.00 0.00 51.96 50.13 1nf2 s ALA 64 Cb -0.15 0.31 0.10 0.00 0.00 0.00 0.00 23.12 23.38 1nf2 s ALA 64 CO -0.04 -0.16 0.64 0.66 0.00 0.00 0.00 175.76 176.86 1nf2 n TYR 65 N -0.96 -1.85 -3.58 0.00 4.01 -0.39 -1.40 117.16 112.99 1nf2 n TYR 65 Ca -0.07 0.62 -0.27 0.00 -0.16 0.00 0.00 57.90 58.02 1nf2 n TYR 65 Cb 0.67 -3.07 0.02 0.00 -0.31 0.00 0.00 39.34 36.64 1nf2 n TYR 65 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1nf2 n ASN 66 N -2.46 -4.86 0.00 7.72 5.15 -0.19 -2.80 115.26 117.82 1nf2 n ASN 66 Ca 0.02 -0.56 0.00 0.00 -0.60 0.00 0.00 54.58 53.44 1nf2 n ASN 66 Cb 0.52 -3.92 0.00 0.00 -0.53 0.00 0.00 39.78 35.85 1nf2 n ASN 66 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1nf2 n GLY 67 N -1.53 1.71 0.13 8.20 0.00 -0.49 -2.59 105.19 110.61 1nf2 n GLY 67 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1nf2 n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nf2 h ALA 68 N 0.00 0.89 -3.79 4.61 0.00 -1.37 -3.42 119.26 116.19 1nf2 h ALA 68 Ca 0.00 -0.58 -0.66 0.00 0.00 0.00 0.00 54.91 53.67 1nf2 h ALA 68 Cb 0.00 -0.10 -0.32 0.00 0.00 0.00 0.00 17.79 17.37 1nf2 h ALA 68 CO 0.00 0.79 -0.88 0.42 0.00 0.00 0.00 179.25 179.59 1nf2 s ILE 69 N -3.48 1.94 -0.15 0.00 1.01 -1.09 -0.15 121.20 119.29 1nf2 s ILE 69 Ca -0.01 -0.99 0.01 0.00 0.00 0.00 0.00 60.65 59.66 1nf2 s ILE 69 Cb 0.12 -1.66 0.02 0.00 0.01 0.00 0.00 42.46 40.95 1nf2 s ILE 69 CO 0.76 0.54 -0.16 -0.69 0.00 0.00 0.00 174.94 175.39 1nf2 s VAL 70 N 0.03 1.68 -0.00 2.92 1.01 -0.71 -1.29 120.40 124.05 1nf2 s VAL 70 Ca -0.08 -0.71 0.08 0.00 0.00 0.00 0.00 61.98 61.26 1nf2 s VAL 70 Cb -0.15 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.66 1nf2 s VAL 70 CO 0.05 0.48 -0.25 -0.47 0.00 0.00 0.00 175.10 174.91 1nf2 s TYR 71 N 1.33 2.20 -0.09 5.22 6.14 0.11 -1.10 117.35 131.15 1nf2 s TYR 71 Ca 0.02 -0.41 0.04 0.00 0.64 0.00 0.00 57.07 57.36 1nf2 s TYR 71 Cb -0.13 -1.39 0.00 0.00 0.42 0.00 0.00 41.96 40.86 1nf2 s TYR 71 CO -0.09 0.00 -0.23 -0.51 0.64 0.00 0.00 175.55 175.36 1nf2 s LEU 72 N -0.74 2.05 0.41 6.97 1.43 0.69 0.28 118.68 129.76 1nf2 s LEU 72 Ca 0.10 -0.53 0.24 0.00 -1.03 0.00 0.00 54.13 52.90 1nf2 s LEU 72 Cb -0.10 -1.35 1.27 0.00 0.03 0.00 0.00 46.19 46.05 1nf2 s LEU 72 CO -0.00 0.16 1.67 -0.65 0.23 0.00 0.00 176.35 177.75 1nf2 h PRO 73 N 6.67 0.21 0.00 1.29 0.11 -1.86 0.54 132.00 138.96 1nf2 h PRO 73 Ca -0.21 -0.01 -0.17 0.00 0.11 0.00 0.00 66.00 65.71 1nf2 h PRO 73 Cb 1.23 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 1nf2 h PRO 73 CO 0.47 0.14 -1.08 -0.85 -0.21 0.00 0.00 178.00 176.46 1nf2 n GLU 74 N -4.76 0.53 0.09 1.05 0.00 -1.26 -4.53 120.64 111.76 1nf2 n GLU 74 Ca 0.33 0.56 -0.07 0.00 0.00 0.00 0.00 57.16 57.98 1nf2 n GLU 74 Cb 1.19 -1.73 0.02 0.00 0.00 0.00 0.00 31.44 30.92 1nf2 n GLU 74 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1nf2 h GLU 75 N -1.00 0.15 0.00 3.44 4.39 -1.95 -3.50 114.58 116.11 1nf2 h GLU 75 Ca -0.26 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.29 1nf2 h GLU 75 Cb 1.09 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.78 1nf2 h GLU 75 CO -0.16 0.89 0.00 0.41 -1.16 0.00 0.00 179.01 178.99 1nf2 n GLY 76 N 0.78 0.41 3.66 -3.84 0.00 0.19 -4.86 105.19 101.52 1nf2 n GLY 76 Ca -0.03 -1.56 -0.43 0.00 0.00 0.00 0.00 46.02 44.00 1nf2 n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nf2 s VAL 77 N 0.00 4.39 -0.84 1.61 1.01 -1.26 -0.22 120.40 125.09 1nf2 s VAL 77 Ca 0.00 1.68 0.09 0.00 0.00 0.00 0.00 61.98 63.75 1nf2 s VAL 77 Cb 0.00 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.30 1nf2 s VAL 77 CO 0.00 -0.13 0.61 2.30 0.00 0.00 0.00 175.10 177.88 1nf2 n ILE 78 N 5.25 0.00 -3.68 2.22 -0.00 -0.26 -4.91 119.36 117.99 1nf2 n ILE 78 Ca 0.13 -0.42 -0.15 0.00 -0.00 0.00 0.00 62.75 62.31 1nf2 n ILE 78 Cb 0.45 1.11 -0.15 0.00 -0.00 0.00 0.00 39.64 41.06 1nf2 n ILE 78 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.55 176.33 1nf2 s LEU 79 N -1.46 -0.06 -0.43 7.28 2.96 -1.18 -4.97 118.68 120.82 1nf2 s LEU 79 Ca 0.08 0.42 0.03 0.00 -0.22 0.00 0.00 54.13 54.44 1nf2 s LEU 79 Cb 0.07 0.44 0.16 0.00 0.50 0.00 0.00 46.19 47.36 1nf2 s LEU 79 CO 0.21 -0.23 0.32 0.21 -1.32 0.00 0.00 176.35 175.54 1nf2 s ASN 80 N 2.18 2.35 0.08 3.68 3.04 -1.24 -1.73 114.94 123.30 1nf2 s ASN 80 Ca 0.01 -2.90 -0.30 0.00 0.04 0.00 0.00 52.86 49.71 1nf2 s ASN 80 Cb -0.12 -0.61 -0.05 0.00 -1.54 0.00 0.00 41.25 38.93 1nf2 s ASN 80 CO -0.07 -0.20 1.04 -1.61 -3.04 0.00 0.00 177.10 173.22 1nf2 s GLU 81 N 0.17 4.59 0.26 0.43 0.41 0.79 -5.03 118.70 120.32 1nf2 s GLU 81 Ca 0.27 1.56 -0.06 0.00 -0.41 0.00 0.00 54.97 56.33 1nf2 s GLU 81 Cb -0.06 -3.37 -0.01 0.00 -1.78 0.00 0.00 34.13 28.90 1nf2 s GLU 81 CO -0.13 0.02 0.37 -1.59 -0.49 0.00 0.00 175.26 173.44 1nf2 s LYS 82 N 0.41 1.55 -0.19 1.61 -2.85 -1.26 -4.76 119.74 114.25 1nf2 s LYS 82 Ca 0.51 -1.52 -0.27 0.00 -1.00 0.00 0.00 55.97 53.69 1nf2 s LYS 82 Cb -0.25 0.40 -0.01 0.00 -2.06 0.00 0.00 37.83 35.91 1nf2 s LYS 82 CO 0.30 -0.61 0.91 0.42 0.10 0.00 0.00 175.35 176.47 1nf2 s ILE 83 N -3.79 4.81 0.20 3.79 1.09 0.96 -4.77 121.20 123.49 1nf2 s ILE 83 Ca 0.30 1.78 -0.33 0.00 -1.10 0.00 0.00 60.65 61.31 1nf2 s ILE 83 Cb 0.02 -4.20 -0.13 0.00 -1.06 0.00 0.00 42.46 37.08 1nf2 s ILE 83 CO 0.14 -0.04 1.53 -0.81 -0.10 0.00 0.00 174.94 175.65 1nf2 n PRO 84 N 5.60 2.18 0.31 2.79 -0.04 -1.26 -3.71 135.00 140.87 1nf2 n PRO 84 Ca 0.07 0.78 0.04 0.00 -0.04 0.00 0.00 63.50 64.36 1nf2 n PRO 84 Cb 0.48 -2.52 0.24 0.00 -0.04 0.00 0.00 33.50 31.66 1nf2 n PRO 84 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 1nf2 h PRO 85 N 5.31 0.00 0.00 0.54 0.11 -1.90 0.83 132.00 136.89 1nf2 h PRO 85 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1nf2 h PRO 85 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1nf2 h PRO 85 CO 0.84 0.00 -0.02 0.93 -0.21 0.00 0.00 178.00 179.54 1nf2 h GLU 86 N 0.00 0.00 -0.39 1.05 4.39 -1.88 -1.59 114.58 116.16 1nf2 h GLU 86 Ca 0.00 0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.77 1nf2 h GLU 86 Cb 1.52 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.15 1nf2 h GLU 86 CO 0.00 0.00 0.27 0.28 -1.16 0.00 0.00 179.01 178.40 1nf2 h VAL 87 N -0.68 0.92 -0.30 3.13 2.07 -1.68 0.79 116.25 120.50 1nf2 h VAL 87 Ca 0.00 -0.08 -0.06 0.00 0.82 0.00 0.00 66.70 67.38 1nf2 h VAL 87 Cb 0.02 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1nf2 h VAL 87 CO 0.00 0.04 -0.03 0.00 0.02 0.00 0.00 177.57 177.60 1nf2 h ALA 88 N 1.79 0.41 -0.39 1.67 0.00 -0.98 -0.78 119.26 120.99 1nf2 h ALA 88 Ca 0.18 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1nf2 h ALA 88 Cb 0.40 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1nf2 h ALA 88 CO -0.03 0.19 0.15 -0.22 0.00 0.00 0.00 179.25 179.34 1nf2 h LYS 89 N 0.33 0.58 -0.87 0.00 3.64 -0.06 -1.65 116.57 118.55 1nf2 h LYS 89 Ca 0.08 -0.11 0.04 0.00 -1.27 0.00 0.00 60.65 59.39 1nf2 h LYS 89 Cb 0.49 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.16 1nf2 h LYS 89 CO 0.02 0.56 0.56 -0.44 -2.27 0.00 0.00 179.45 177.88 1nf2 h ASP 90 N 0.48 0.92 -0.38 4.20 3.45 -0.79 -0.80 116.42 123.51 1nf2 h ASP 90 Ca 0.13 -0.00 -0.07 0.00 0.43 0.00 0.00 57.03 57.51 1nf2 h ASP 90 Cb 0.19 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 38.75 1nf2 h ASP 90 CO -0.01 0.63 -0.04 0.40 -1.57 0.00 0.00 179.24 178.64 1nf2 h ILE 91 N 1.07 1.27 -0.33 0.35 2.04 -0.87 -1.84 117.51 119.20 1nf2 h ILE 91 Ca 0.35 -1.08 -0.06 0.00 1.00 0.00 0.00 64.86 65.07 1nf2 h ILE 91 Cb 0.03 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 1nf2 h ILE 91 CO -0.12 0.36 -0.02 0.40 0.00 0.00 0.00 178.15 178.77 1nf2 h ILE 92 N 0.51 1.26 0.00 -0.67 5.03 -1.01 0.23 117.51 122.87 1nf2 h ILE 92 Ca 0.10 -1.00 -0.05 0.00 -0.12 0.00 0.00 64.86 63.79 1nf2 h ILE 92 Cb 0.53 1.26 -0.01 0.00 -3.03 0.00 0.00 36.82 35.57 1nf2 h ILE 92 CO 0.03 0.33 -0.24 -0.33 -0.68 0.00 0.00 178.15 177.26 1nf2 h GLU 93 N 0.39 0.00 0.07 2.37 5.08 -1.16 -0.97 114.58 120.37 1nf2 h GLU 93 Ca 0.09 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.19 1nf2 h GLU 93 Cb 0.48 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.75 1nf2 h GLU 93 CO 0.02 0.24 -1.05 -0.92 -1.00 0.00 0.00 179.01 176.31 1nf2 h TYR 94 N 0.00 0.92 0.00 4.33 3.20 -1.07 -3.36 116.97 120.99 1nf2 h TYR 94 Ca -0.00 -0.55 -0.18 0.00 3.14 0.00 0.00 58.73 61.14 1nf2 h TYR 94 Cb 0.48 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.64 1nf2 h TYR 94 CO 0.00 1.39 -0.86 0.97 -1.64 0.00 0.00 178.16 178.02 1nf2 h ILE 95 N 0.19 1.58 -0.32 1.81 2.10 -0.64 -3.37 117.51 118.86 1nf2 h ILE 95 Ca -0.15 -2.99 -0.01 0.00 1.08 0.00 0.00 64.86 62.79 1nf2 h ILE 95 Cb 1.73 2.63 -0.02 0.00 -1.09 0.00 0.00 36.82 40.08 1nf2 h ILE 95 CO 0.20 0.84 0.17 0.11 -1.08 0.00 0.00 178.15 178.40 1nf2 h LYS 96 N 0.00 0.45 0.00 2.19 1.57 -1.33 -2.28 116.57 117.16 1nf2 h LYS 96 Ca -0.01 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1nf2 h LYS 96 Cb 1.56 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.79 1nf2 h LYS 96 CO 0.11 0.38 0.05 -1.35 -0.57 0.00 0.00 179.45 178.07 1nf2 h PRO 97 N 0.39 0.00 -0.02 3.15 0.11 -1.76 0.10 132.00 133.98 1nf2 h PRO 97 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1nf2 h PRO 97 Cb 0.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.17 1nf2 h PRO 97 CO -0.02 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.05 1nf2 n LEU 98 N -3.03 0.22 -3.19 2.35 4.32 -0.86 -4.97 117.00 111.83 1nf2 n LEU 98 Ca -0.03 -0.09 -0.27 0.00 -0.02 0.00 0.00 56.01 55.60 1nf2 n LEU 98 Cb 0.12 -0.01 0.03 0.00 -1.62 0.00 0.00 43.42 41.93 1nf2 n LEU 98 CO 0.19 0.05 -0.31 0.59 -1.22 0.00 0.00 177.39 176.69 1nf2 n ASN 99 N -0.64 -5.21 -4.27 -1.43 4.13 0.02 -5.01 115.26 102.86 1nf2 n ASN 99 Ca 0.14 -0.02 -0.24 0.00 1.68 0.00 0.00 54.58 56.14 1nf2 n ASN 99 Cb 0.10 -1.44 -0.09 0.00 -1.54 0.00 0.00 39.78 36.81 1nf2 n ASN 99 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 1nf2 s VAL 100 N -1.21 0.82 -0.43 2.41 -7.23 -1.26 -5.12 120.40 108.39 1nf2 s VAL 100 Ca 0.26 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.35 1nf2 s VAL 100 Cb -0.03 -2.53 0.09 0.00 0.56 0.00 0.00 36.38 34.48 1nf2 s VAL 100 CO 0.59 0.00 0.27 -1.00 -0.31 0.00 0.00 175.10 174.65 1nf2 s HIS 101 N -3.28 3.38 0.19 2.82 3.76 -1.26 -5.06 115.29 115.84 1nf2 s HIS 101 Ca 0.29 -1.71 0.11 0.00 -0.15 0.00 0.00 55.06 53.60 1nf2 s HIS 101 Cb 0.05 -3.09 -0.04 0.00 1.11 0.00 0.00 32.58 30.61 1nf2 s HIS 101 CO 0.14 -0.90 -0.23 1.67 -0.85 0.00 0.00 174.74 174.58 1nf2 s TRP 102 N 1.38 2.24 0.13 1.40 1.48 -1.26 -1.31 118.94 123.00 1nf2 s TRP 102 Ca 0.04 -0.37 0.03 0.00 -1.06 0.00 0.00 56.10 54.73 1nf2 s TRP 102 Cb -0.24 -1.12 -0.04 0.00 -1.16 0.00 0.00 33.47 30.91 1nf2 s TRP 102 CO 0.01 0.47 -0.06 1.14 -4.06 0.00 0.00 176.95 174.45 1nf2 s GLN 103 N -2.65 0.98 0.02 3.25 -2.07 -0.56 -3.52 119.66 115.11 1nf2 s GLN 103 Ca 0.20 -1.43 0.02 0.00 -1.82 0.00 0.00 55.36 52.33 1nf2 s GLN 103 Cb -0.08 -0.36 -0.01 0.00 -1.09 0.00 0.00 33.01 31.47 1nf2 s GLN 103 CO 0.09 -0.02 -0.07 0.00 -1.32 0.00 0.00 175.29 173.98 1nf2 s ALA 104 N -3.53 0.53 -0.48 2.60 0.00 0.09 -2.21 121.76 118.77 1nf2 s ALA 104 Ca 0.16 -0.46 -0.15 0.00 0.00 0.00 0.00 51.96 51.51 1nf2 s ALA 104 Cb 0.05 -0.06 0.08 0.00 0.00 0.00 0.00 23.12 23.18 1nf2 s ALA 104 CO -0.01 0.07 0.40 0.71 0.00 0.00 0.00 175.76 176.93 1nf2 s TYR 105 N -0.63 3.25 -0.19 0.00 2.02 -0.56 -0.74 117.35 120.49 1nf2 s TYR 105 Ca -0.02 -0.98 0.01 0.00 -0.37 0.00 0.00 57.07 55.71 1nf2 s TYR 105 Cb -0.05 -3.22 0.03 0.00 -0.40 0.00 0.00 41.96 38.33 1nf2 s TYR 105 CO 0.00 -0.82 -0.14 0.42 -1.57 0.00 0.00 175.55 173.44 1nf2 s ILE 106 N 1.63 1.85 -1.49 2.71 1.01 -0.49 -0.43 121.20 126.00 1nf2 s ILE 106 Ca 0.04 -1.03 -0.11 0.00 0.00 0.00 0.00 60.65 59.55 1nf2 s ILE 106 Cb -0.25 -1.82 0.07 0.00 0.01 0.00 0.00 42.46 40.47 1nf2 s ILE 106 CO 0.06 0.30 0.92 0.47 0.00 0.00 0.00 174.94 176.70 1nf2 n ASP 107 N 4.63 -4.06 -1.43 3.58 8.00 -1.26 -2.17 116.55 123.84 1nf2 n ASP 107 Ca -0.17 -0.79 -0.11 0.00 0.71 0.00 0.00 54.79 54.43 1nf2 n ASP 107 Cb 0.47 -3.90 0.01 0.00 -0.02 0.00 0.00 41.12 37.68 1nf2 n ASP 107 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1nf2 n ASP 108 N -2.88 -3.68 -3.83 -2.24 2.03 -1.26 -5.04 116.55 99.66 1nf2 n ASP 108 Ca -0.03 -0.08 -0.16 0.00 0.52 0.00 0.00 54.79 55.04 1nf2 n ASP 108 Cb 0.56 -2.75 -0.16 0.00 -0.72 0.00 0.00 41.12 38.05 1nf2 n ASP 108 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1nf2 s VAL 109 N -2.70 0.15 -0.16 5.18 1.01 -0.92 -4.86 120.40 118.11 1nf2 s VAL 109 Ca 0.08 0.07 -0.21 0.00 0.00 0.00 0.00 61.98 61.91 1nf2 s VAL 109 Cb -0.03 -0.23 -0.03 0.00 0.00 0.00 0.00 36.38 36.09 1nf2 s VAL 109 CO 0.10 0.12 0.65 -0.22 0.00 0.00 0.00 175.10 175.75 1nf2 s LEU 110 N 0.84 4.20 0.13 3.92 0.20 -1.26 -1.39 118.68 125.31 1nf2 s LEU 110 Ca -0.08 0.94 0.10 0.00 0.69 0.00 0.00 54.13 55.78 1nf2 s LEU 110 Cb -0.11 -2.94 -0.04 0.00 -0.43 0.00 0.00 46.19 42.67 1nf2 s LEU 110 CO -0.02 -0.22 -0.23 -0.31 -0.29 0.00 0.00 176.35 175.28 1nf2 s TYR 111 N 1.55 2.41 -0.01 5.38 2.02 0.08 -0.99 117.35 127.79 1nf2 s TYR 111 Ca 0.31 -0.33 0.01 0.00 -0.37 0.00 0.00 57.07 56.70 1nf2 s TYR 111 Cb -0.16 -1.29 0.00 0.00 -0.40 0.00 0.00 41.96 40.11 1nf2 s TYR 111 CO 0.12 0.36 -0.04 0.45 -1.57 0.00 0.00 175.55 174.88 1nf2 s SER 112 N -2.11 0.52 0.11 2.29 0.15 -0.09 -0.73 113.70 113.84 1nf2 s SER 112 Ca 0.16 -0.08 -0.18 0.00 0.70 0.00 0.00 55.95 56.56 1nf2 s SER 112 Cb -0.10 -0.09 -0.05 0.00 -1.71 0.00 0.00 66.02 64.07 1nf2 s SER 112 CO 0.08 0.03 1.62 -0.08 1.20 0.00 0.00 173.24 176.09 1nf2 h GLU 113 N 6.20 0.47 -6.10 5.44 4.81 -1.71 0.12 114.58 123.81 1nf2 h GLU 113 Ca -0.29 -0.10 -0.59 0.00 -0.13 0.00 0.00 59.36 58.25 1nf2 h GLU 113 Cb 1.19 -0.07 -0.26 0.00 0.63 0.00 0.00 28.75 30.24 1nf2 h GLU 113 CO 0.50 0.53 -0.84 0.15 -0.73 0.00 0.00 179.01 178.61 1nf2 s LYS 114 N -5.38 1.43 -1.25 1.92 1.02 -1.26 -3.44 119.74 112.79 1nf2 s LYS 114 Ca -0.13 -0.92 -0.13 0.00 0.02 0.00 0.00 55.97 54.80 1nf2 s LYS 114 Cb 0.09 -1.53 0.16 0.00 -0.52 0.00 0.00 37.83 36.02 1nf2 s LYS 114 CO 0.74 0.39 1.63 -3.47 -0.92 0.00 0.00 175.35 173.72 1nf2 n ASP 115 N 1.92 5.11 -3.63 2.83 4.64 -1.26 -4.87 116.55 121.29 1nf2 n ASP 115 Ca -0.17 -3.01 -0.12 0.00 -1.38 0.00 0.00 54.79 50.11 1nf2 n ASP 115 Cb 0.53 -1.56 0.02 0.00 -1.04 0.00 0.00 41.12 39.07 1nf2 n ASP 115 CO 0.00 0.00 0.00 -0.46 -0.82 0.00 0.00 177.20 175.92 1nf2 n ASN 116 N 5.36 1.49 0.17 1.67 6.94 -1.26 -5.02 115.26 124.61 1nf2 n ASN 116 Ca 0.39 -1.94 0.02 0.00 -0.02 0.00 0.00 54.58 53.03 1nf2 n ASN 116 Cb 0.41 -0.16 0.28 0.00 -2.36 0.00 0.00 39.78 37.95 1nf2 n ASN 116 CO 0.00 0.00 0.00 -0.33 -1.03 0.00 0.00 177.26 175.90 1nf2 h GLU 117 N 0.00 0.00 0.49 -3.83 3.07 -2.00 -2.93 114.58 109.38 1nf2 h GLU 117 Ca -0.17 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.67 1nf2 h GLU 117 Cb 0.71 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.61 1nf2 h GLU 117 CO 0.25 0.48 -0.29 0.93 -1.40 0.00 0.00 179.01 178.98 1nf2 h GLU 118 N 0.00 -0.71 -0.56 2.33 3.07 -1.96 -2.15 114.58 114.60 1nf2 h GLU 118 Ca -0.00 0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.90 1nf2 h GLU 118 Cb 0.88 0.16 -0.03 0.00 -0.84 0.00 0.00 28.75 28.93 1nf2 h GLU 118 CO 0.06 -0.48 0.32 0.97 -1.40 0.00 0.00 179.01 178.49 1nf2 h ILE 119 N -0.74 1.18 -0.23 3.13 6.09 -1.89 -2.04 117.51 123.01 1nf2 h ILE 119 Ca -0.06 -0.44 0.05 0.00 -1.37 0.00 0.00 64.86 63.05 1nf2 h ILE 119 Cb 0.60 0.45 -0.05 0.00 0.47 0.00 0.00 36.82 38.29 1nf2 h ILE 119 CO 0.06 0.19 -0.12 0.11 -3.07 0.00 0.00 178.15 175.32 1nf2 h LYS 120 N 0.76 -0.09 0.00 2.19 1.57 -1.42 -1.00 116.57 118.58 1nf2 h LYS 120 Ca 0.20 0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.91 1nf2 h LYS 120 Cb 0.02 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1nf2 h LYS 120 CO -0.03 -0.06 -0.37 1.03 -0.57 0.00 0.00 179.45 179.44 1nf2 h SER 121 N -0.10 0.00 -0.06 0.86 0.87 -1.26 -2.22 113.55 111.65 1nf2 h SER 121 Ca 0.13 0.00 -0.13 0.00 -1.23 0.00 0.00 61.79 60.55 1nf2 h SER 121 Cb 0.28 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.25 1nf2 h SER 121 CO -0.29 0.37 -0.48 0.22 -0.53 0.00 0.00 176.83 176.12 1nf2 h TYR 122 N 0.00 0.59 0.00 2.24 5.03 -0.74 -2.04 116.97 122.05 1nf2 h TYR 122 Ca -0.00 -0.28 -0.06 0.00 2.58 0.00 0.00 58.73 60.97 1nf2 h TYR 122 Cb 0.71 -0.08 -0.01 0.00 1.55 0.00 0.00 36.73 38.90 1nf2 h TYR 122 CO 0.00 1.07 -0.27 0.00 -1.32 0.00 0.00 178.16 177.64 1nf2 h ALA 123 N 0.40 1.38 0.31 1.82 0.00 -1.17 0.03 119.26 122.04 1nf2 h ALA 123 Ca -0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 1nf2 h ALA 123 Cb 1.16 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1nf2 h ALA 123 CO 0.10 0.33 -0.15 -0.09 0.00 0.00 0.00 179.25 179.44 1nf2 h ARG 124 N 0.00 -0.40 -0.43 0.00 2.43 -1.38 -0.50 114.38 114.10 1nf2 h ARG 124 Ca -0.00 0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.11 1nf2 h ARG 124 Cb 0.53 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.15 1nf2 h ARG 124 CO 0.03 -0.07 -0.08 0.45 -1.51 0.00 0.00 179.97 178.79 1nf2 h HIS 125 N -0.93 0.81 -0.64 2.20 3.86 -1.25 -2.64 115.15 116.57 1nf2 h HIS 125 Ca -0.04 -0.14 -0.20 0.00 -1.16 0.00 0.00 60.37 58.84 1nf2 h HIS 125 Cb 0.51 -0.21 -0.12 0.00 1.06 0.00 0.00 27.41 28.65 1nf2 h HIS 125 CO 0.04 0.80 0.21 -1.13 0.86 0.00 0.00 177.93 178.71 1nf2 n SER 126 N -4.18 4.39 -0.33 2.45 3.41 -0.01 -5.02 113.62 114.32 1nf2 n SER 126 Ca 0.02 -3.28 0.00 0.00 -0.26 0.00 0.00 58.87 55.34 1nf2 n SER 126 Cb 0.34 -0.71 0.00 0.00 -0.26 0.00 0.00 64.21 63.58 1nf2 n SER 126 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1nf2 n ASN 127 N -0.37 0.00 -3.68 4.04 2.04 -0.28 -4.95 115.26 112.07 1nf2 n ASN 127 Ca 0.38 0.00 -0.12 0.00 -0.44 0.00 0.00 54.58 54.40 1nf2 n ASN 127 Cb 1.29 0.00 -0.06 0.00 -2.53 0.00 0.00 39.78 38.48 1nf2 n ASN 127 CO 0.00 0.00 0.00 0.68 -0.44 0.00 0.00 177.26 177.50 1nf2 s VAL 128 N 0.00 0.06 0.19 3.53 -7.23 -0.72 -5.03 120.40 111.21 1nf2 s VAL 128 Ca 0.00 -0.53 -0.13 0.00 -1.81 0.00 0.00 61.98 59.51 1nf2 s VAL 128 Cb 0.00 -0.98 -0.07 0.00 0.56 0.00 0.00 36.38 35.89 1nf2 s VAL 128 CO 0.00 -0.29 0.58 -1.81 -0.31 0.00 0.00 175.10 173.27 1nf2 s ASP 129 N -2.13 6.78 0.18 4.85 1.11 -1.26 -4.68 116.67 121.51 1nf2 s ASP 129 Ca -0.04 1.07 0.04 0.00 0.18 0.00 0.00 52.55 53.80 1nf2 s ASP 129 Cb -0.00 -2.29 -0.05 0.00 1.07 0.00 0.00 42.92 41.65 1nf2 s ASP 129 CO -0.04 0.02 -0.06 -0.72 1.18 0.00 0.00 175.17 175.55 1nf2 s TYR 130 N -1.62 1.35 -0.02 4.23 1.13 -1.26 -4.26 117.35 116.91 1nf2 s TYR 130 Ca 0.42 -0.85 0.03 0.00 -1.41 0.00 0.00 57.07 55.27 1nf2 s TYR 130 Cb -0.14 -0.73 -0.01 0.00 -1.10 0.00 0.00 41.96 39.99 1nf2 s TYR 130 CO 0.20 0.00 -0.12 1.03 -2.51 0.00 0.00 175.55 174.15 1nf2 s ARG 131 N -3.81 1.04 -0.19 -3.49 0.52 -0.16 -5.01 118.95 107.86 1nf2 s ARG 131 Ca 0.21 -0.41 -0.23 0.00 -0.52 0.00 0.00 55.73 54.78 1nf2 s ARG 131 Cb 0.04 -0.99 -0.02 0.00 0.52 0.00 0.00 34.95 34.51 1nf2 s ARG 131 CO 0.03 0.22 0.75 0.14 0.02 0.00 0.00 175.30 176.46 1nf2 s VAL 132 N -0.12 4.93 -0.33 3.52 -7.23 -1.26 -0.91 120.40 119.00 1nf2 s VAL 132 Ca 0.02 1.44 -0.01 0.00 -1.81 0.00 0.00 61.98 61.62 1nf2 s VAL 132 Cb -0.06 -4.06 0.11 0.00 0.56 0.00 0.00 36.38 32.93 1nf2 s VAL 132 CO 0.00 0.05 0.15 -0.70 -0.31 0.00 0.00 175.10 174.29 1nf2 s GLU 133 N 2.14 0.58 0.55 4.82 2.56 0.40 -4.92 118.70 124.82 1nf2 s GLU 133 Ca 0.34 -1.08 0.23 0.00 0.00 0.00 0.00 54.97 54.47 1nf2 s GLU 133 Cb -0.16 -1.60 1.46 0.00 2.00 0.00 0.00 34.13 35.83 1nf2 s GLU 133 CO 0.11 -1.07 2.10 -1.00 -0.56 0.00 0.00 175.26 174.84 1nf2 h PRO 134 N 7.77 0.00 -1.02 4.30 0.13 -1.78 -1.22 132.00 140.17 1nf2 h PRO 134 Ca -0.10 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.55 1nf2 h PRO 134 Cb 0.99 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 31.85 1nf2 h PRO 134 CO 0.41 0.00 0.61 -1.71 -0.23 0.00 0.00 178.00 177.09 1nf2 n ASN 135 N -4.23 4.33 -0.09 1.44 5.15 -1.26 -4.58 115.26 116.01 1nf2 n ASN 135 Ca 0.02 -3.45 0.10 0.00 -0.60 0.00 0.00 54.58 50.65 1nf2 n ASN 135 Cb 0.31 -0.83 0.46 0.00 -0.53 0.00 0.00 39.78 39.19 1nf2 n ASN 135 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 1nf2 h LEU 136 N 1.20 0.44 -1.06 1.20 5.85 -1.59 -1.70 115.31 119.65 1nf2 h LEU 136 Ca 0.56 0.01 0.11 0.00 0.84 0.00 0.00 57.88 59.39 1nf2 h LEU 136 Cb 2.33 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 43.19 1nf2 h LEU 136 CO 1.05 0.28 0.62 0.77 -0.34 0.00 0.00 178.44 180.82 1nf2 h SER 137 N 0.50 0.91 -0.12 1.25 4.64 -1.86 -0.27 113.55 118.60 1nf2 h SER 137 Ca 0.27 0.04 -0.22 0.00 -0.47 0.00 0.00 61.79 61.40 1nf2 h SER 137 Cb 0.41 -0.15 0.01 0.00 -0.31 0.00 0.00 62.40 62.36 1nf2 h SER 137 CO -0.08 0.51 -0.79 -0.08 -0.87 0.00 0.00 176.83 175.52 1nf2 h GLU 138 N 0.99 0.75 0.02 4.77 4.81 -1.69 -1.50 114.58 122.74 1nf2 h GLU 138 Ca 0.47 -0.65 0.03 0.00 -0.13 0.00 0.00 59.36 59.08 1nf2 h GLU 138 Cb 0.44 0.15 -0.04 0.00 0.63 0.00 0.00 28.75 29.92 1nf2 h GLU 138 CO -0.23 1.25 -0.22 1.25 -0.73 0.00 0.00 179.01 180.33 1nf2 h LEU 139 N 0.47 -0.64 0.35 1.64 5.85 -1.11 -2.18 115.31 119.69 1nf2 h LEU 139 Ca -0.07 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 1nf2 h LEU 139 Cb 1.43 0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.73 1nf2 h LEU 139 CO 0.16 -0.29 -0.17 0.58 -0.34 0.00 0.00 178.44 178.38 1nf2 h VAL 140 N -0.36 0.60 -0.08 1.05 2.07 -1.15 0.41 116.25 118.79 1nf2 h VAL 140 Ca 0.05 -0.57 0.02 0.00 0.82 0.00 0.00 66.70 67.03 1nf2 h VAL 140 Cb 0.43 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1nf2 h VAL 140 CO -0.18 0.10 0.51 0.28 0.02 0.00 0.00 177.57 178.29 1nf2 h SER 141 N -0.82 0.00 -0.00 0.57 0.02 -1.23 0.65 113.55 112.73 1nf2 h SER 141 Ca -0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1nf2 h SER 141 Cb 0.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.07 1nf2 h SER 141 CO 0.08 0.00 -0.02 1.17 -1.14 0.00 0.00 176.83 176.92 1nf2 n LYS 142 N -2.91 5.00 0.00 3.45 4.81 -0.83 -4.77 118.16 122.91 1nf2 n LYS 142 Ca 0.00 -0.13 0.00 0.00 -0.87 0.00 0.00 58.31 57.32 1nf2 n LYS 142 Cb 0.57 -0.64 0.00 0.00 0.02 0.00 0.00 35.03 34.97 1nf2 n LYS 142 CO 0.00 0.00 0.00 -0.12 1.17 0.00 0.00 177.40 178.45 1nf2 n MET 143 N -0.77 3.45 0.00 1.64 1.56 0.13 -5.07 117.12 118.06 1nf2 n MET 143 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1nf2 n MET 143 Cb 0.01 -0.73 0.00 0.00 2.15 0.00 0.00 33.22 34.65 1nf2 n MET 143 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1nf2 n GLY 144 N 1.69 -1.99 3.05 -5.12 0.00 0.12 -4.98 105.19 97.95 1nf2 n GLY 144 Ca 0.00 -1.51 -0.11 0.00 0.00 0.00 0.00 46.02 44.40 1nf2 n GLY 144 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1nf2 s THR 145 N -2.87 0.08 0.12 2.61 -1.32 -1.24 -4.76 115.64 108.26 1nf2 s THR 145 Ca 0.00 -0.67 -0.10 0.00 -1.21 0.00 0.00 61.69 59.71 1nf2 s THR 145 Cb 0.00 -0.34 -0.15 0.00 -1.51 0.00 0.00 72.50 70.50 1nf2 s THR 145 CO 0.00 -0.37 1.33 0.74 -2.21 0.00 0.00 174.62 174.11 1nf2 h THR 146 N 4.49 1.30 -2.15 5.08 2.02 -1.04 0.27 112.91 122.89 1nf2 h THR 146 Ca -0.30 -2.03 0.15 0.00 0.77 0.00 0.00 66.41 64.99 1nf2 h THR 146 Cb 1.20 2.04 -0.15 0.00 -1.74 0.00 0.00 68.15 69.50 1nf2 h THR 146 CO 0.41 0.64 0.55 -1.59 0.37 0.00 0.00 175.52 175.90 1nf2 s LYS 147 N -3.69 0.78 0.13 6.66 -2.85 -1.25 -4.20 119.74 115.33 1nf2 s LYS 147 Ca -0.09 -0.32 0.10 0.00 -1.00 0.00 0.00 55.97 54.66 1nf2 s LYS 147 Cb 0.09 0.34 -0.04 0.00 -2.06 0.00 0.00 37.83 36.16 1nf2 s LYS 147 CO 0.89 -0.35 -0.23 -0.51 0.10 0.00 0.00 175.35 175.26 1nf2 s LEU 148 N -2.52 2.50 -0.04 2.77 1.43 -0.53 -1.49 118.68 120.81 1nf2 s LEU 148 Ca 0.07 -0.68 -0.01 0.00 -1.03 0.00 0.00 54.13 52.47 1nf2 s LEU 148 Cb -0.01 -1.36 0.03 0.00 0.03 0.00 0.00 46.19 44.88 1nf2 s LEU 148 CO -0.07 0.17 0.08 -0.22 0.23 0.00 0.00 176.35 176.54 1nf2 s LEU 149 N -2.19 1.09 -0.05 1.79 0.20 -0.94 -0.77 118.68 117.82 1nf2 s LEU 149 Ca 0.17 0.15 0.01 0.00 0.69 0.00 0.00 54.13 55.15 1nf2 s LEU 149 Cb -0.10 0.14 -0.03 0.00 -0.43 0.00 0.00 46.19 45.77 1nf2 s LEU 149 CO 0.08 -0.11 -0.06 -0.76 -0.29 0.00 0.00 176.35 175.21 1nf2 s LEU 150 N 0.89 3.22 -0.15 -0.68 1.02 0.57 -1.49 118.68 122.06 1nf2 s LEU 150 Ca -0.07 -0.03 0.00 0.00 0.02 0.00 0.00 54.13 54.05 1nf2 s LEU 150 Cb -0.10 -1.74 0.02 0.00 0.02 0.00 0.00 46.19 44.40 1nf2 s LEU 150 CO -0.03 0.34 -0.14 -0.51 0.02 0.00 0.00 176.35 176.03 1nf2 s ILE 151 N -0.87 1.55 0.38 -0.59 1.10 -0.43 -1.14 121.20 121.20 1nf2 s ILE 151 Ca 0.14 -0.62 -0.13 0.00 -0.51 0.00 0.00 60.65 59.53 1nf2 s ILE 151 Cb -0.11 -1.46 0.04 0.00 0.15 0.00 0.00 42.46 41.08 1nf2 s ILE 151 CO 0.03 0.45 0.72 -0.62 -2.11 0.00 0.00 174.94 173.41 1nf2 s ASP 152 N 1.50 0.21 0.61 4.50 -1.08 -1.20 -4.32 116.67 116.89 1nf2 s ASP 152 Ca 0.05 -1.22 -0.19 0.00 -0.52 0.00 0.00 52.55 50.67 1nf2 s ASP 152 Cb -0.13 0.81 -0.03 0.00 -1.46 0.00 0.00 42.92 42.12 1nf2 s ASP 152 CO -0.11 -1.60 1.28 0.42 0.52 0.00 0.00 175.17 175.68 1nf2 s THR 153 N -2.48 2.22 0.58 1.71 -4.23 -1.26 -4.48 115.64 107.70 1nf2 s THR 153 Ca 0.19 0.14 0.29 0.00 -1.18 0.00 0.00 61.69 61.13 1nf2 s THR 153 Cb -0.04 -3.06 0.39 0.00 1.34 0.00 0.00 72.50 71.12 1nf2 s THR 153 CO 0.13 -0.02 1.91 -0.65 -0.54 0.00 0.00 174.62 175.45 1nf2 h PRO 154 N 0.87 0.00 0.00 3.99 0.11 -1.94 -0.27 132.00 134.76 1nf2 h PRO 154 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1nf2 h PRO 154 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1nf2 h PRO 154 CO 0.55 0.00 0.00 -1.91 -0.21 0.00 0.00 178.00 176.43 1nf2 n GLU 155 N -3.78 0.00 0.25 1.05 4.07 -1.26 -2.21 120.64 118.75 1nf2 n GLU 155 Ca 0.09 0.45 0.08 0.00 -0.06 0.00 0.00 57.16 57.71 1nf2 n GLU 155 Cb 0.66 -1.30 0.62 0.00 -0.06 0.00 0.00 31.44 31.35 1nf2 n GLU 155 CO 0.00 0.00 0.00 -0.09 -0.06 0.00 0.00 177.13 176.98 1nf2 h ARG 156 N 0.00 0.00 -0.17 5.31 2.43 -1.86 -1.95 114.38 118.14 1nf2 h ARG 156 Ca 0.00 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 1nf2 h ARG 156 Cb 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1nf2 h ARG 156 CO 0.00 0.08 -0.38 1.25 -1.51 0.00 0.00 179.97 179.41 1nf2 h LEU 157 N 0.00 0.39 -1.35 3.80 5.85 -1.14 0.45 115.31 123.32 1nf2 h LEU 157 Ca -0.00 -0.16 -0.07 0.00 0.84 0.00 0.00 57.88 58.49 1nf2 h LEU 157 Cb 0.14 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1nf2 h LEU 157 CO 0.01 0.74 -0.33 0.44 -0.34 0.00 0.00 178.44 178.96 1nf2 h ASP 158 N 0.32 0.00 0.08 1.25 3.45 -0.87 0.02 116.42 120.66 1nf2 h ASP 158 Ca 0.03 0.00 -0.14 0.00 0.43 0.00 0.00 57.03 57.35 1nf2 h ASP 158 Cb 0.81 0.00 0.02 0.00 -0.56 0.00 0.00 39.33 39.60 1nf2 h ASP 158 CO 0.07 0.33 -0.60 -0.33 -1.57 0.00 0.00 179.24 177.13 1nf2 h GLU 159 N 0.00 0.27 -0.84 3.56 5.08 -1.29 -2.96 114.58 118.39 1nf2 h GLU 159 Ca -0.00 -0.39 0.03 0.00 -1.00 0.00 0.00 59.36 57.99 1nf2 h GLU 159 Cb 0.59 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.93 1nf2 h GLU 159 CO 0.04 1.15 0.55 -0.07 -1.00 0.00 0.00 179.01 179.68 1nf2 h LEU 160 N -0.42 0.92 -0.25 1.33 3.38 -0.73 -1.82 115.31 117.72 1nf2 h LEU 160 Ca -0.10 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 57.91 1nf2 h LEU 160 Cb 1.42 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.91 1nf2 h LEU 160 CO 0.11 0.64 -0.08 0.50 0.09 0.00 0.00 178.44 179.71 1nf2 h LYS 161 N 1.08 -0.02 -0.08 1.13 3.11 -1.06 -1.16 116.57 119.56 1nf2 h LYS 161 Ca 0.33 0.00 0.04 0.00 -2.81 0.00 0.00 60.65 58.21 1nf2 h LYS 161 Cb -0.03 0.00 -0.06 0.00 -1.00 0.00 0.00 32.23 31.15 1nf2 h LYS 161 CO -0.10 -0.01 -0.29 1.49 -2.81 0.00 0.00 179.45 177.72 1nf2 h GLU 162 N -0.02 -0.38 -0.12 1.90 4.81 -1.17 -0.63 114.58 118.97 1nf2 h GLU 162 Ca 0.12 0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 59.23 1nf2 h GLU 162 Cb 0.21 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1nf2 h GLU 162 CO -0.27 -0.25 -0.56 -0.84 -0.73 0.00 0.00 179.01 176.35 1nf2 h ILE 163 N -0.40 1.35 -0.03 2.32 3.07 -1.25 -2.49 117.51 120.09 1nf2 h ILE 163 Ca 0.08 -1.86 -0.15 0.00 1.55 0.00 0.00 64.86 64.48 1nf2 h ILE 163 Cb 0.52 1.88 -0.01 0.00 -0.27 0.00 0.00 36.82 38.94 1nf2 h ILE 163 CO -0.30 0.56 -0.69 -0.07 -1.05 0.00 0.00 178.15 176.60 1nf2 h LEU 164 N 0.27 0.16 0.02 0.16 3.38 -1.05 -2.10 115.31 116.15 1nf2 h LEU 164 Ca 0.00 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 1nf2 h LEU 164 Cb 1.07 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1nf2 h LEU 164 CO 0.09 0.80 -0.01 -1.28 0.09 0.00 0.00 178.44 178.13 1nf2 h SER 165 N 0.10 -0.02 -0.93 -0.43 0.87 -1.08 0.75 113.55 112.80 1nf2 h SER 165 Ca -0.01 -0.51 0.09 0.00 -1.23 0.00 0.00 61.79 60.13 1nf2 h SER 165 Cb 1.22 0.01 -0.07 0.00 -0.44 0.00 0.00 62.40 63.11 1nf2 h SER 165 CO 0.10 0.50 0.58 -0.33 -0.53 0.00 0.00 176.83 177.15 1nf2 h GLU 166 N -0.56 0.94 0.12 2.24 4.39 -1.47 0.60 114.58 120.85 1nf2 h GLU 166 Ca -0.00 -0.06 -0.27 0.00 0.34 0.00 0.00 59.36 59.37 1nf2 h GLU 166 Cb 0.53 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1nf2 h GLU 166 CO 0.00 0.62 -1.23 -0.09 -1.16 0.00 0.00 179.01 177.16 1nf2 h ARG 167 N 0.97 0.27 0.00 2.33 9.65 -1.36 -3.39 114.38 122.84 1nf2 h ARG 167 Ca 0.44 -0.45 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 1nf2 h ARG 167 Cb 0.34 0.17 0.00 0.00 -1.39 0.00 0.00 29.97 29.09 1nf2 h ARG 167 CO -0.23 1.21 0.00 1.19 2.80 0.00 0.00 179.97 184.94 1nf2 n PHE 168 N -3.53 0.00 -0.38 2.20 3.72 0.25 -4.75 117.46 114.96 1nf2 n PHE 168 Ca -0.08 -0.24 0.33 0.00 -0.05 0.00 0.00 57.45 57.41 1nf2 n PHE 168 Cb 1.02 -0.02 0.65 0.00 -0.94 0.00 0.00 39.48 40.18 1nf2 n PHE 168 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1nf2 h LYS 169 N 0.00 0.16 0.00 -1.08 3.64 0.08 -1.22 116.57 118.14 1nf2 h LYS 169 Ca 0.00 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.28 1nf2 h LYS 169 Cb 0.28 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1nf2 h LYS 169 CO 0.00 0.10 -0.41 -0.44 -2.27 0.00 0.00 179.45 176.43 1nf2 h ASP 170 N 0.16 0.00 0.00 4.20 3.45 -1.85 -3.34 116.42 119.04 1nf2 h ASP 170 Ca 0.67 0.00 0.00 0.00 0.43 0.00 0.00 57.03 58.13 1nf2 h ASP 170 Cb 2.20 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.97 1nf2 h ASP 170 CO -0.21 0.41 0.00 1.33 -1.57 0.00 0.00 179.24 179.20 1nf2 n VAL 171 N -3.89 0.41 -3.45 -1.35 0.24 -0.54 -5.07 118.33 104.69 1nf2 n VAL 171 Ca -0.01 -0.59 -0.12 0.00 -2.04 0.00 0.00 64.34 61.57 1nf2 n VAL 171 Cb 0.46 0.90 -0.02 0.00 -1.47 0.00 0.00 33.84 33.71 1nf2 n VAL 171 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1nf2 s VAL 172 N -0.41 0.01 -0.21 3.34 0.11 -0.76 -4.42 120.40 118.06 1nf2 s VAL 172 Ca 0.00 -0.07 -0.10 0.00 -2.93 0.00 0.00 61.98 58.88 1nf2 s VAL 172 Cb 0.00 -1.02 -0.05 0.00 -1.53 0.00 0.00 36.38 33.78 1nf2 s VAL 172 CO 0.00 -0.04 0.14 -0.75 -3.33 0.00 0.00 175.10 171.12 1nf2 s LYS 173 N -3.65 4.13 -0.11 1.54 2.47 -0.11 -4.27 119.74 119.73 1nf2 s LYS 173 Ca 0.01 -0.25 0.01 0.00 -1.56 0.00 0.00 55.97 54.18 1nf2 s LYS 173 Cb -0.01 -3.45 0.02 0.00 -1.46 0.00 0.00 37.83 32.93 1nf2 s LYS 173 CO -0.12 0.21 -0.14 0.14 0.16 0.00 0.00 175.35 175.61 1nf2 s VAL 174 N 0.61 1.41 0.09 4.02 -7.23 -1.26 -0.76 120.40 117.28 1nf2 s VAL 174 Ca 0.08 -0.58 -0.21 0.00 -1.81 0.00 0.00 61.98 59.46 1nf2 s VAL 174 Cb -0.12 -1.31 0.05 0.00 0.56 0.00 0.00 36.38 35.56 1nf2 s VAL 174 CO 0.00 0.43 0.52 0.72 -0.31 0.00 0.00 175.10 176.46 1nf2 s PHE 175 N 1.15 -0.41 -0.06 2.82 -0.71 -0.32 -4.96 117.98 115.49 1nf2 s PHE 175 Ca -0.03 0.33 -0.26 0.00 -1.04 0.00 0.00 56.93 55.93 1nf2 s PHE 175 Cb -0.14 0.38 -0.03 0.00 -1.21 0.00 0.00 43.02 42.01 1nf2 s PHE 175 CO -0.04 -0.71 0.81 0.15 -1.34 0.00 0.00 175.22 174.10 1nf2 s LYS 176 N -3.02 4.46 -0.06 1.99 -0.14 -1.26 0.04 119.74 121.75 1nf2 s LYS 176 Ca -0.02 1.08 0.12 0.00 -1.36 0.00 0.00 55.97 55.79 1nf2 s LYS 176 Cb -0.00 -3.47 -0.23 0.00 -1.68 0.00 0.00 37.83 32.45 1nf2 s LYS 176 CO -0.06 -0.02 0.59 -1.13 -0.76 0.00 0.00 175.35 173.97 1nf2 n SER 177 N 3.99 0.85 -3.70 2.83 3.41 0.15 -4.93 113.62 116.22 1nf2 n SER 177 Ca 0.02 0.37 -0.09 0.00 -0.26 0.00 0.00 58.87 58.90 1nf2 n SER 177 Cb 0.51 -0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 1nf2 n SER 177 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1nf2 s PHE 178 N -2.59 -0.26 0.45 7.33 0.08 -1.19 -4.99 117.98 116.82 1nf2 s PHE 178 Ca -0.06 -0.09 0.33 0.00 0.12 0.00 0.00 56.93 57.23 1nf2 s PHE 178 Cb 0.08 0.56 1.48 0.00 -0.57 0.00 0.00 43.02 44.58 1nf2 s PHE 178 CO 0.82 -1.03 1.60 -1.35 -0.10 0.00 0.00 175.22 175.17 1nf2 h PRO 179 N 2.06 0.04 -0.23 0.24 0.11 -1.98 -0.02 132.00 132.22 1nf2 h PRO 179 Ca -0.26 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1nf2 h PRO 179 Cb 1.27 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1nf2 h PRO 179 CO 0.32 0.03 0.00 0.25 -0.21 0.00 0.00 178.00 178.38 1nf2 n THR 180 N -4.65 1.02 -4.23 -1.15 -2.24 -1.26 -3.61 114.28 98.15 1nf2 n THR 180 Ca 0.39 -1.02 -0.29 0.00 -2.27 0.00 0.00 64.05 60.87 1nf2 n THR 180 Cb 1.54 0.49 -0.17 0.00 -2.10 0.00 0.00 70.33 70.09 1nf2 n THR 180 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1nf2 s TYR 181 N -1.04 1.95 -0.16 4.78 2.02 -0.02 -3.21 117.35 121.68 1nf2 s TYR 181 Ca 0.16 -0.99 -0.01 0.00 -0.37 0.00 0.00 57.07 55.86 1nf2 s TYR 181 Cb 0.08 -1.44 -0.01 0.00 -0.40 0.00 0.00 41.96 40.19 1nf2 s TYR 181 CO 0.10 -0.54 -0.11 -1.17 -1.57 0.00 0.00 175.55 172.26 1nf2 s LEU 182 N 1.25 2.74 0.03 -1.29 0.20 -0.29 -0.68 118.68 120.64 1nf2 s LEU 182 Ca -0.01 -0.35 0.07 0.00 0.69 0.00 0.00 54.13 54.52 1nf2 s LEU 182 Cb -0.14 -1.64 -0.03 0.00 -0.43 0.00 0.00 46.19 43.95 1nf2 s LEU 182 CO -0.05 0.11 -0.17 -1.61 -0.29 0.00 0.00 176.35 174.33 1nf2 s GLU 183 N 0.67 2.14 -0.16 1.98 2.02 0.11 -0.32 118.70 125.14 1nf2 s GLU 183 Ca -0.06 -0.94 0.00 0.00 0.02 0.00 0.00 54.97 54.00 1nf2 s GLU 183 Cb -0.15 -2.22 0.03 0.00 0.10 0.00 0.00 34.13 31.89 1nf2 s GLU 183 CO 0.02 0.55 -0.13 0.42 0.02 0.00 0.00 175.26 176.14 1nf2 s ILE 184 N -0.90 1.58 0.20 -1.63 1.09 0.05 -1.17 121.20 120.42 1nf2 s ILE 184 Ca 0.14 -0.71 0.02 0.00 -1.10 0.00 0.00 60.65 59.00 1nf2 s ILE 184 Cb -0.11 -1.52 -0.05 0.00 -1.06 0.00 0.00 42.46 39.72 1nf2 s ILE 184 CO 0.05 0.39 0.01 0.68 -0.10 0.00 0.00 174.94 175.96 1nf2 s VAL 185 N 1.47 0.82 0.29 2.92 -7.23 0.06 -1.45 120.40 117.28 1nf2 s VAL 185 Ca 0.04 -2.01 -0.29 0.00 -1.81 0.00 0.00 61.98 57.92 1nf2 s VAL 185 Cb -0.14 -2.24 -0.14 0.00 0.56 0.00 0.00 36.38 34.42 1nf2 s VAL 185 CO -0.10 -0.38 1.09 -2.65 -0.31 0.00 0.00 175.10 172.75 1nf2 n PRO 186 N -0.33 1.52 0.00 4.82 -0.02 -1.26 -0.94 135.00 138.79 1nf2 n PRO 186 Ca -0.05 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 1nf2 n PRO 186 Cb 0.64 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 1nf2 n PRO 186 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1nf2 n LYS 187 N 0.83 0.00 -2.30 -0.52 3.00 -1.26 -4.02 118.16 113.89 1nf2 n LYS 187 Ca 0.09 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.97 1nf2 n LYS 187 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.35 1nf2 n LYS 187 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 1nf2 n ASN 188 N 0.00 4.77 -4.15 3.14 2.04 -1.26 -4.68 115.26 115.11 1nf2 n ASN 188 Ca 0.00 -3.00 -0.25 0.00 -0.44 0.00 0.00 54.58 50.89 1nf2 n ASN 188 Cb 0.00 -1.57 -0.16 0.00 -2.53 0.00 0.00 39.78 35.52 1nf2 n ASN 188 CO 0.00 0.00 0.00 0.68 -0.44 0.00 0.00 177.26 177.50 1nf2 s VAL 189 N 1.73 1.39 0.25 3.53 -7.23 -1.26 -5.05 120.40 113.76 1nf2 s VAL 189 Ca 0.44 -0.73 -0.22 0.00 -1.81 0.00 0.00 61.98 59.65 1nf2 s VAL 189 Cb 0.08 -1.17 0.03 0.00 0.56 0.00 0.00 36.38 35.88 1nf2 s VAL 189 CO -0.01 0.40 0.74 1.51 -0.31 0.00 0.00 175.10 177.43 1nf2 s ASP 190 N -0.26 -0.28 0.44 4.85 1.47 -1.25 -4.92 116.67 116.73 1nf2 s ASP 190 Ca 0.03 -0.51 0.11 0.00 1.18 0.00 0.00 52.55 53.36 1nf2 s ASP 190 Cb -0.08 0.68 1.00 0.00 -0.34 0.00 0.00 42.92 44.17 1nf2 s ASP 190 CO 0.00 -1.24 2.07 0.11 0.68 0.00 0.00 175.17 176.79 1nf2 h LYS 191 N 2.00 0.38 -0.13 2.11 1.57 -1.70 -2.22 116.57 118.58 1nf2 h LYS 191 Ca -0.21 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.52 1nf2 h LYS 191 Cb 1.25 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.47 1nf2 h LYS 191 CO 0.25 0.25 -0.01 0.78 -0.57 0.00 0.00 179.45 180.15 1nf2 h GLY 192 N 0.39 0.25 1.16 3.86 0.00 -1.83 -0.42 103.07 106.48 1nf2 h GLY 192 Ca 0.14 -0.19 -0.04 0.00 0.00 0.00 0.00 47.33 47.24 1nf2 h GLY 192 CO -0.03 0.17 0.32 0.50 0.00 0.00 0.00 176.54 177.50 1nf2 h LYS 193 N -0.05 1.08 -0.57 4.80 1.57 -1.80 0.16 116.57 121.75 1nf2 h LYS 193 Ca 0.04 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.59 1nf2 h LYS 193 Cb 0.39 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 1nf2 h LYS 193 CO 0.01 0.86 0.14 0.00 -0.57 0.00 0.00 179.45 179.89 1nf2 h ALA 194 N 1.29 0.75 -0.45 3.86 0.00 -1.29 -1.31 119.26 122.11 1nf2 h ALA 194 Ca 0.25 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 1nf2 h ALA 194 Cb 0.16 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1nf2 h ALA 194 CO -0.03 0.45 -0.20 1.25 0.00 0.00 0.00 179.25 180.73 1nf2 h LEU 195 N 0.82 0.91 -0.82 0.00 5.85 -0.54 -1.23 115.31 120.29 1nf2 h LEU 195 Ca 0.18 -0.33 -0.05 0.00 0.84 0.00 0.00 57.88 58.53 1nf2 h LEU 195 Cb 0.34 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 1nf2 h LEU 195 CO 0.00 1.08 0.31 -0.09 -0.34 0.00 0.00 178.44 179.40 1nf2 h ARG 196 N 0.78 1.18 -0.35 1.25 2.43 -0.82 -0.35 114.38 118.50 1nf2 h ARG 196 Ca 0.11 -0.21 -0.03 0.00 -0.81 0.00 0.00 59.98 59.04 1nf2 h ARG 196 Cb 0.74 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1nf2 h ARG 196 CO 0.06 0.95 0.11 0.35 -1.51 0.00 0.00 179.97 179.93 1nf2 h PHE 197 N 1.15 0.55 -0.89 2.20 3.57 -0.99 -1.86 116.94 120.67 1nf2 h PHE 197 Ca 0.26 -0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.70 1nf2 h PHE 197 Cb 0.22 -0.16 -0.04 0.00 2.79 0.00 0.00 35.95 38.75 1nf2 h PHE 197 CO 0.02 0.54 0.54 1.25 -2.23 0.00 0.00 178.31 178.44 1nf2 h LEU 198 N 0.41 1.07 -0.32 0.59 5.85 -0.91 -1.63 115.31 120.36 1nf2 h LEU 198 Ca 0.11 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1nf2 h LEU 198 Cb 0.24 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1nf2 h LEU 198 CO -0.00 0.82 0.21 -0.09 -0.34 0.00 0.00 178.44 179.03 1nf2 h ARG 199 N 1.23 0.41 -0.62 1.25 2.43 -0.75 0.97 114.38 119.30 1nf2 h ARG 199 Ca 0.32 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.45 1nf2 h ARG 199 Cb -0.06 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.37 1nf2 h ARG 199 CO -0.06 0.27 0.32 0.93 -1.51 0.00 0.00 179.97 179.92 1nf2 h GLU 200 N 0.43 0.89 0.19 0.20 4.39 -1.03 0.49 114.58 120.13 1nf2 h GLU 200 Ca 0.12 -0.12 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1nf2 h GLU 200 Cb -0.04 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.44 1nf2 h GLU 200 CO -0.03 0.70 -0.09 -0.09 -1.16 0.00 0.00 179.01 178.34 1nf2 h ARG 201 N 0.85 -0.24 0.00 2.33 1.12 -0.92 -3.16 114.38 114.36 1nf2 h ARG 201 Ca 0.22 0.02 0.00 0.00 -1.11 0.00 0.00 59.98 59.10 1nf2 h ARG 201 Cb 0.09 0.06 0.00 0.00 -0.01 0.00 0.00 29.97 30.11 1nf2 h ARG 201 CO -0.03 -0.08 -0.17 -1.33 -3.11 0.00 0.00 179.97 175.25 1nf2 n MET 202 N -5.15 0.17 -2.66 0.20 2.81 0.30 -4.95 117.12 107.85 1nf2 n MET 202 Ca -0.09 0.11 -0.09 0.00 -1.81 0.00 0.00 57.70 55.82 1nf2 n MET 202 Cb 0.16 -1.67 0.02 0.00 -0.71 0.00 0.00 33.22 31.02 1nf2 n MET 202 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1nf2 n ASN 203 N -1.96 -3.49 -4.82 7.83 4.05 0.16 -5.03 115.26 112.00 1nf2 n ASN 203 Ca 0.05 -0.14 -0.31 0.00 0.45 0.00 0.00 54.58 54.63 1nf2 n ASN 203 Cb 0.40 -2.31 0.04 0.00 1.23 0.00 0.00 39.78 39.14 1nf2 n ASN 203 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 1nf2 s TRP 204 N -2.87 3.14 0.08 1.20 0.23 -0.43 -5.02 118.94 115.26 1nf2 s TRP 204 Ca 0.15 1.42 0.10 0.00 -2.03 0.00 0.00 56.10 55.74 1nf2 s TRP 204 Cb -0.07 -2.88 -0.03 0.00 0.03 0.00 0.00 33.47 30.52 1nf2 s TRP 204 CO 0.19 -1.16 -0.26 -1.59 0.96 0.00 0.00 176.95 175.08 1nf2 s LYS 205 N -4.93 1.65 0.29 4.98 -2.85 -1.26 -4.77 119.74 112.85 1nf2 s LYS 205 Ca 0.58 -1.20 0.03 0.00 -1.00 0.00 0.00 55.97 54.39 1nf2 s LYS 205 Cb -0.14 -1.95 0.63 0.00 -2.06 0.00 0.00 37.83 34.31 1nf2 s LYS 205 CO 0.52 0.49 1.82 0.87 0.10 0.00 0.00 175.35 179.15 1nf2 h LYS 206 N 4.43 0.88 -0.06 1.78 1.57 -1.97 -2.85 116.57 120.36 1nf2 h LYS 206 Ca -0.48 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.26 1nf2 h LYS 206 Cb 1.15 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 33.26 1nf2 h LYS 206 CO 0.42 0.58 0.11 0.93 -0.57 0.00 0.00 179.45 180.92 1nf2 h GLU 207 N 0.90 0.00 -0.60 3.15 5.08 -1.92 0.87 114.58 122.06 1nf2 h GLU 207 Ca 0.52 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.88 1nf2 h GLU 207 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1nf2 h GLU 207 CO -0.30 0.00 0.00 -0.85 -1.00 0.00 0.00 179.01 176.86 1nf2 n GLU 208 N -3.45 3.20 -4.65 2.33 0.28 -1.07 -4.71 120.64 112.57 1nf2 n GLU 208 Ca -0.01 -2.66 -0.33 0.00 -0.16 0.00 0.00 57.16 53.99 1nf2 n GLU 208 Cb 0.19 -1.67 -0.13 0.00 1.43 0.00 0.00 31.44 31.27 1nf2 n GLU 208 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1nf2 s ILE 209 N -1.47 3.46 -0.02 3.84 1.01 -0.76 -0.99 121.20 126.27 1nf2 s ILE 209 Ca 0.45 -0.54 0.08 0.00 0.00 0.00 0.00 60.65 60.64 1nf2 s ILE 209 Cb 0.27 -2.45 -0.02 0.00 0.01 0.00 0.00 42.46 40.27 1nf2 s ILE 209 CO 0.25 0.55 -0.25 -0.69 0.00 0.00 0.00 174.94 174.80 1nf2 s VAL 210 N -0.14 1.98 -0.03 2.92 1.01 -0.31 -0.99 120.40 124.84 1nf2 s VAL 210 Ca 0.01 -1.07 0.04 0.00 0.00 0.00 0.00 61.98 60.96 1nf2 s VAL 210 Cb -0.13 -1.64 -0.00 0.00 0.00 0.00 0.00 36.38 34.60 1nf2 s VAL 210 CO 0.03 0.56 -0.15 0.68 0.00 0.00 0.00 175.10 176.22 1nf2 s VAL 211 N -0.57 1.23 -0.14 2.92 -7.23 -0.95 -0.23 120.40 115.43 1nf2 s VAL 211 Ca 0.09 -0.62 -0.01 0.00 -1.81 0.00 0.00 61.98 59.63 1nf2 s VAL 211 Cb -0.10 -1.06 -0.02 0.00 0.56 0.00 0.00 36.38 35.77 1nf2 s VAL 211 CO -0.01 0.36 -0.09 -0.36 -0.31 0.00 0.00 175.10 174.69 1nf2 s PHE 212 N 0.00 2.89 0.35 2.82 0.08 -0.04 -1.72 117.98 122.37 1nf2 s PHE 212 Ca -0.02 -0.49 -0.09 0.00 0.12 0.00 0.00 56.93 56.45 1nf2 s PHE 212 Cb -0.10 -1.88 0.02 0.00 -0.57 0.00 0.00 43.02 40.49 1nf2 s PHE 212 CO 0.01 -0.13 0.60 0.20 -0.10 0.00 0.00 175.22 175.81 1nf2 s GLY 213 N 0.32 0.94 0.00 4.36 0.00 -0.83 -2.34 107.32 109.78 1nf2 s GLY 213 Ca -0.08 -1.14 0.00 0.00 0.00 0.00 0.00 44.72 43.50 1nf2 s GLY 213 CO 0.05 -0.68 0.00 2.09 0.00 0.00 0.00 173.10 174.56 1nf2 n ASP 214 N -1.31 0.00 -4.98 1.64 3.85 -1.26 -1.47 116.55 113.02 1nf2 n ASP 214 Ca -0.03 0.00 -0.20 0.00 -0.71 0.00 0.00 54.79 53.85 1nf2 n ASP 214 Cb 0.61 0.00 0.01 0.00 -1.35 0.00 0.00 41.12 40.39 1nf2 n ASP 214 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.20 176.39 1nf2 s ASN 215 N 0.00 5.80 0.10 -1.12 0.02 -1.26 -2.99 114.94 115.49 1nf2 s ASN 215 Ca 0.00 -0.10 -0.14 0.00 -1.02 0.00 0.00 52.86 51.61 1nf2 s ASN 215 Cb 0.00 -1.16 -0.13 0.00 0.02 0.00 0.00 41.25 39.98 1nf2 s ASN 215 CO 0.00 -0.64 1.34 -0.08 0.02 0.00 0.00 177.10 177.74 1nf2 h GLU 216 N 0.63 0.77 -0.72 -0.60 4.22 -2.00 -1.81 114.58 115.08 1nf2 h GLU 216 Ca -0.44 -0.55 0.04 0.00 0.08 0.00 0.00 59.36 58.48 1nf2 h GLU 216 Cb 1.26 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.56 1nf2 h GLU 216 CO 0.52 1.17 0.47 -0.91 -2.18 0.00 0.00 179.01 178.09 1nf2 h ASN 217 N 0.50 0.74 1.41 1.04 -0.26 -2.02 -2.56 115.58 114.42 1nf2 h ASN 217 Ca -0.02 -0.01 -0.12 0.00 -0.56 0.00 0.00 56.30 55.60 1nf2 h ASN 217 Cb 1.22 -0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 38.30 1nf2 h ASN 217 CO 0.13 0.50 -0.55 0.44 -1.06 0.00 0.00 177.43 176.89 1nf2 h ASP 218 N 0.85 0.00 -0.91 5.81 3.45 -1.88 -3.26 116.42 120.48 1nf2 h ASP 218 Ca 0.29 0.00 0.23 0.00 0.43 0.00 0.00 57.03 57.98 1nf2 h ASP 218 Cb 0.08 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 38.80 1nf2 h ASP 218 CO -0.08 0.55 0.62 0.25 -1.57 0.00 0.00 179.24 179.01 1nf2 h LEU 219 N 0.00 0.26 -1.27 1.55 5.85 -0.90 0.26 115.31 121.06 1nf2 h LEU 219 Ca -0.01 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 1nf2 h LEU 219 Cb 1.40 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.40 1nf2 h LEU 219 CO 0.07 0.09 -0.08 -0.26 -0.34 0.00 0.00 178.44 177.93 1nf2 h PHE 220 N 0.25 0.42 0.00 1.25 0.04 -1.67 -2.70 116.94 114.53 1nf2 h PHE 220 Ca 0.47 -0.05 -0.12 0.00 2.80 0.00 0.00 57.97 61.07 1nf2 h PHE 220 Cb 1.41 -0.12 -0.02 0.00 2.20 0.00 0.00 35.95 39.42 1nf2 h PHE 220 CO -0.00 0.48 -0.58 0.52 -0.60 0.00 0.00 178.31 178.13 1nf2 h MET 221 N 0.38 0.00 -0.98 1.51 2.86 -0.69 -3.22 114.93 114.79 1nf2 h MET 221 Ca 0.08 0.00 0.16 0.00 -2.06 0.00 0.00 59.70 57.88 1nf2 h MET 221 Cb 0.38 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 31.95 1nf2 h MET 221 CO 0.02 0.58 0.61 0.74 1.06 0.00 0.00 176.91 179.92 1nf2 h PHE 222 N 0.00 1.02 0.00 -0.22 0.05 -1.33 0.29 116.94 116.75 1nf2 h PHE 222 Ca -0.01 0.03 0.00 0.00 3.82 0.00 0.00 57.97 61.82 1nf2 h PHE 222 Cb 1.02 -0.32 0.00 0.00 2.00 0.00 0.00 35.95 38.66 1nf2 h PHE 222 CO 0.00 0.32 0.00 0.93 -0.18 0.00 0.00 178.31 179.38 1nf2 h GLU 223 N 0.82 0.00 -0.60 1.51 4.39 -1.67 -2.44 114.58 116.59 1nf2 h GLU 223 Ca 0.52 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.22 1nf2 h GLU 223 Cb 0.74 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.39 1nf2 h GLU 223 CO -0.30 0.00 0.00 0.39 -1.16 0.00 0.00 179.01 177.94 1nf2 n GLU 224 N -2.96 3.12 -4.32 2.33 -0.58 0.08 -5.00 120.64 113.32 1nf2 n GLU 224 Ca -0.01 -2.63 -0.22 0.00 -0.42 0.00 0.00 57.16 53.88 1nf2 n GLU 224 Cb 0.18 -1.64 -0.11 0.00 -0.57 0.00 0.00 31.44 29.31 1nf2 n GLU 224 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1nf2 s ALA 225 N -1.39 1.96 -0.01 0.62 0.00 -0.92 -4.73 121.76 117.29 1nf2 s ALA 225 Ca 0.44 -1.46 0.11 0.00 0.00 0.00 0.00 51.96 51.05 1nf2 s ALA 225 Cb 0.26 -0.18 -0.13 0.00 0.00 0.00 0.00 23.12 23.07 1nf2 s ALA 225 CO 0.25 0.23 1.17 0.78 0.00 0.00 0.00 175.76 178.20 1nf2 h GLY 226 N 3.32 0.00 -5.75 0.00 0.00 0.93 -3.45 103.07 98.12 1nf2 h GLY 226 Ca -0.42 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.42 1nf2 h GLY 226 CO 0.50 0.00 -0.80 -2.27 0.00 0.00 0.00 176.54 173.97 1nf2 s LEU 227 N -6.43 1.67 -0.20 3.11 2.96 -0.78 -4.98 118.68 114.03 1nf2 s LEU 227 Ca 0.00 -0.25 0.00 0.00 -0.22 0.00 0.00 54.13 53.66 1nf2 s LEU 227 Cb 0.09 -0.73 0.02 0.00 0.50 0.00 0.00 46.19 46.07 1nf2 s LEU 227 CO 0.80 0.05 -0.16 -0.13 -1.32 0.00 0.00 176.35 175.58 1nf2 s ARG 228 N 0.50 3.00 -0.19 1.98 0.52 -1.26 -2.25 118.95 121.24 1nf2 s ARG 228 Ca -0.10 -0.84 -0.01 0.00 -0.52 0.00 0.00 55.73 54.26 1nf2 s ARG 228 Cb -0.13 -2.68 0.00 0.00 0.52 0.00 0.00 34.95 32.66 1nf2 s ARG 228 CO 0.02 -0.24 -0.12 0.08 0.02 0.00 0.00 175.30 175.06 1nf2 s VAL 229 N 1.31 2.77 -0.11 3.52 1.01 -0.70 0.91 120.40 129.11 1nf2 s VAL 229 Ca 0.04 -0.71 -0.07 0.00 0.00 0.00 0.00 61.98 61.25 1nf2 s VAL 229 Cb -0.14 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 1nf2 s VAL 229 CO -0.10 0.48 0.14 0.00 0.00 0.00 0.00 175.10 175.62 1nf2 s ALA 230 N 1.25 3.86 0.58 5.51 0.00 -0.12 -1.96 121.76 130.88 1nf2 s ALA 230 Ca 0.03 -0.65 -0.16 0.00 0.00 0.00 0.00 51.96 51.17 1nf2 s ALA 230 Cb -0.14 -1.95 -0.04 0.00 0.00 0.00 0.00 23.12 20.99 1nf2 s ALA 230 CO -0.06 0.63 1.06 -1.64 0.00 0.00 0.00 175.76 175.75 1nf2 s MET 231 N -1.08 3.38 0.52 0.00 -1.94 -0.54 -1.63 119.30 118.01 1nf2 s MET 231 Ca 0.16 1.24 0.23 0.00 -1.71 0.00 0.00 55.69 55.60 1nf2 s MET 231 Cb -0.12 -2.04 1.42 0.00 2.01 0.00 0.00 34.83 36.10 1nf2 s MET 231 CO 0.05 -0.77 2.12 1.49 -0.01 0.00 0.00 175.02 177.90 1nf2 h GLU 232 N 0.60 0.00 -0.06 2.03 4.81 -1.23 -1.08 114.58 119.66 1nf2 h GLU 232 Ca -0.47 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1nf2 h GLU 232 Cb 1.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1nf2 h GLU 232 CO 0.58 0.09 0.00 0.27 -0.73 0.00 0.00 179.01 179.21 1nf2 n ASN 233 N -4.00 0.82 -4.74 1.04 6.94 -1.26 -4.93 115.26 109.14 1nf2 n ASN 233 Ca -0.02 -1.45 -0.34 0.00 -0.02 0.00 0.00 54.58 52.75 1nf2 n ASN 233 Cb 0.17 -0.03 0.08 0.00 -2.36 0.00 0.00 39.78 37.64 1nf2 n ASN 233 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1nf2 s ALA 234 N -1.93 2.19 0.74 -2.53 0.00 -0.41 -4.98 121.76 114.84 1nf2 s ALA 234 Ca 0.35 0.74 -0.12 0.00 0.00 0.00 0.00 51.96 52.92 1nf2 s ALA 234 Cb 0.17 -3.41 0.04 0.00 0.00 0.00 0.00 23.12 19.92 1nf2 s ALA 234 CO 0.28 -1.74 1.11 0.96 0.00 0.00 0.00 175.76 176.37 1nf2 s ILE 235 N -2.17 3.11 0.24 0.00 -0.00 -1.16 -4.81 121.20 116.41 1nf2 s ILE 235 Ca 0.71 0.43 -0.06 0.00 -0.00 0.00 0.00 60.65 61.73 1nf2 s ILE 235 Cb -0.26 -2.89 0.24 0.00 -0.00 0.00 0.00 42.46 39.55 1nf2 s ILE 235 CO 0.45 -0.40 1.67 1.05 -0.00 0.00 0.00 174.94 177.71 1nf2 h GLU 236 N -0.69 0.20 -0.96 0.37 9.09 -1.94 -1.73 114.58 118.92 1nf2 h GLU 236 Ca -0.45 -0.01 0.07 0.00 0.05 0.00 0.00 59.36 59.02 1nf2 h GLU 236 Cb 1.24 -0.04 -0.07 0.00 -1.65 0.00 0.00 28.75 28.23 1nf2 h GLU 236 CO 0.51 0.13 0.61 -0.22 0.05 0.00 0.00 179.01 180.09 1nf2 h LYS 237 N 0.21 1.05 -0.45 1.06 3.64 -1.99 -2.10 116.57 117.98 1nf2 h LYS 237 Ca 0.40 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 59.61 1nf2 h LYS 237 Cb 0.70 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1nf2 h LYS 237 CO -0.55 0.69 -0.17 0.28 -2.27 0.00 0.00 179.45 177.44 1nf2 h VAL 238 N 1.08 1.27 -0.72 2.00 2.07 -1.66 -2.94 116.25 117.36 1nf2 h VAL 238 Ca 0.43 -1.31 -0.05 0.00 0.82 0.00 0.00 66.70 66.58 1nf2 h VAL 238 Cb 0.22 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 1nf2 h VAL 238 CO -0.19 0.45 0.24 0.11 0.02 0.00 0.00 177.57 178.19 1nf2 h LYS 239 N 0.75 1.10 0.00 1.57 1.57 -1.21 -1.94 116.57 118.42 1nf2 h LYS 239 Ca 0.11 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1nf2 h LYS 239 Cb 0.73 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1nf2 h LYS 239 CO 0.06 0.93 0.00 0.93 -0.57 0.00 0.00 179.45 180.79 1nf2 h GLU 240 N 1.06 0.00 -0.00 3.15 5.08 -1.32 -2.42 114.58 120.12 1nf2 h GLU 240 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1nf2 h GLU 240 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1nf2 h GLU 240 CO -0.01 0.00 -0.85 0.00 -1.00 0.00 0.00 179.01 177.15 1nf2 n ALA 241 N -1.94 4.41 -1.94 3.43 0.00 -0.89 -4.98 120.51 118.60 1nf2 n ALA 241 Ca 0.01 -0.60 -0.27 0.00 0.00 0.00 0.00 53.44 52.58 1nf2 n ALA 241 Cb 0.26 -0.76 0.12 0.00 0.00 0.00 0.00 19.45 19.07 1nf2 n ALA 241 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nf2 s SER 242 N -2.82 4.11 -0.25 0.00 1.04 -0.78 -4.95 113.70 110.05 1nf2 s SER 242 Ca 0.10 0.27 0.02 0.00 0.48 0.00 0.00 55.95 56.83 1nf2 s SER 242 Cb 0.16 -0.64 -0.18 0.00 0.10 0.00 0.00 66.02 65.46 1nf2 s SER 242 CO 0.78 -2.07 -0.18 0.47 0.98 0.00 0.00 173.24 173.21 1nf2 n ASP 243 N -3.24 1.88 -3.98 7.02 8.00 0.26 -4.97 116.55 121.52 1nf2 n ASP 243 Ca 0.12 -0.11 -0.15 0.00 0.71 0.00 0.00 54.79 55.35 1nf2 n ASP 243 Cb 0.60 -0.36 -0.14 0.00 -0.02 0.00 0.00 41.12 41.21 1nf2 n ASP 243 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1nf2 s ILE 244 N -2.52 0.45 -0.31 0.53 -1.09 -0.81 -5.04 121.20 112.40 1nf2 s ILE 244 Ca -0.33 -0.39 -0.02 0.00 -2.23 0.00 0.00 60.65 57.68 1nf2 s ILE 244 Cb 0.09 -0.41 0.06 0.00 -1.58 0.00 0.00 42.46 40.62 1nf2 s ILE 244 CO 0.62 0.02 0.02 0.54 -1.23 0.00 0.00 174.94 174.91 1nf2 s VAL 245 N -0.37 3.00 0.00 2.92 0.11 -1.26 -0.94 120.40 123.86 1nf2 s VAL 245 Ca -0.00 -1.45 0.00 0.00 -2.93 0.00 0.00 61.98 57.59 1nf2 s VAL 245 Cb -0.04 -2.76 0.00 0.00 -1.53 0.00 0.00 36.38 32.05 1nf2 s VAL 245 CO -0.00 -0.16 0.00 1.07 -3.33 0.00 0.00 175.10 172.68 1nf2 n THR 246 N 4.61 0.00 -1.29 5.04 5.66 -0.65 -4.87 114.28 122.79 1nf2 n THR 246 Ca -0.12 0.00 -0.18 0.00 -3.05 0.00 0.00 64.05 60.71 1nf2 n THR 246 Cb 0.43 -1.81 0.13 0.00 -1.55 0.00 0.00 70.33 67.53 1nf2 n THR 246 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1nf2 n LEU 247 N 0.00 0.00 -4.83 1.09 4.77 -1.26 -2.87 117.00 113.90 1nf2 n LEU 247 Ca 0.00 -0.80 -0.30 0.00 -0.03 0.00 0.00 56.01 54.87 1nf2 n LEU 247 Cb 0.00 -0.60 0.06 0.00 -2.33 0.00 0.00 43.42 40.55 1nf2 n LEU 247 CO 0.00 -1.29 0.72 -0.89 -1.33 0.00 0.00 177.39 174.60 1nf2 s THR 248 N -2.53 3.51 -0.61 -5.08 2.01 -1.26 -1.89 115.64 109.78 1nf2 s THR 248 Ca 0.44 0.49 0.25 0.00 0.31 0.00 0.00 61.69 63.18 1nf2 s THR 248 Cb -0.02 -3.32 0.27 0.00 0.01 0.00 0.00 72.50 69.44 1nf2 s THR 248 CO 0.32 -0.64 1.75 -0.46 -0.69 0.00 0.00 174.62 174.90 1nf2 n ASN 249 N -3.21 0.75 0.21 3.53 2.04 -1.26 -1.71 115.26 115.61 1nf2 n ASN 249 Ca 0.07 0.62 0.11 0.00 -0.44 0.00 0.00 54.58 54.94 1nf2 n ASN 249 Cb 0.56 -0.80 0.15 0.00 -2.53 0.00 0.00 39.78 37.15 1nf2 n ASN 249 CO 0.00 0.00 0.00 0.78 -0.44 0.00 0.00 177.26 177.60 1nf2 h ASN 250 N 0.00 0.00 0.00 0.53 -0.26 -1.89 -3.32 115.58 110.63 1nf2 h ASN 250 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1nf2 h ASN 250 Cb 0.56 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.82 1nf2 h ASN 250 CO 0.00 0.03 0.00 0.47 -1.06 0.00 0.00 177.43 176.87 1nf2 n ASP 251 N -3.07 0.00 -3.10 5.81 8.00 -1.05 -4.98 116.55 118.16 1nf2 n ASP 251 Ca 0.04 0.00 -0.20 0.00 0.71 0.00 0.00 54.79 55.34 1nf2 n ASP 251 Cb 0.54 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.61 1nf2 n ASP 251 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1nf2 n SER 252 N 0.00 1.69 -0.30 -2.24 7.64 -1.25 -4.87 113.62 114.30 1nf2 n SER 252 Ca 0.00 -3.15 0.16 0.00 1.01 0.00 0.00 58.87 56.89 1nf2 n SER 252 Cb 0.00 -0.60 0.41 0.00 -1.01 0.00 0.00 64.21 63.01 1nf2 n SER 252 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1nf2 h GLY 253 N 2.99 1.31 0.92 0.23 0.00 -1.54 -1.53 103.07 105.46 1nf2 h GLY 253 Ca 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 1nf2 h GLY 253 CO 0.57 -0.02 -0.12 -2.08 0.00 0.00 0.00 176.54 174.89 1nf2 h VAL 254 N 0.60 0.77 -0.71 4.60 2.07 -1.85 -3.06 116.25 118.68 1nf2 h VAL 254 Ca 0.52 -0.16 0.04 0.00 0.82 0.00 0.00 66.70 67.92 1nf2 h VAL 254 Cb 1.01 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 31.60 1nf2 h VAL 254 CO -0.27 0.04 0.43 0.28 0.02 0.00 0.00 177.57 178.07 1nf2 h SER 255 N -0.42 0.68 -1.01 0.57 0.02 -1.70 0.14 113.55 111.83 1nf2 h SER 255 Ca -0.04 0.01 0.23 0.00 -0.84 0.00 0.00 61.79 61.15 1nf2 h SER 255 Cb 0.32 -0.13 -0.11 0.00 0.14 0.00 0.00 62.40 62.63 1nf2 h SER 255 CO 0.06 0.46 0.62 0.22 -1.14 0.00 0.00 176.83 177.05 1nf2 h TYR 256 N 0.82 0.90 0.02 3.45 5.03 -1.21 -0.66 116.97 125.32 1nf2 h TYR 256 Ca 0.30 0.03 -0.37 0.00 2.58 0.00 0.00 58.73 61.27 1nf2 h TYR 256 Cb 0.09 -0.27 -0.06 0.00 1.55 0.00 0.00 36.73 38.05 1nf2 h TYR 256 CO -0.05 0.13 -2.30 0.28 -1.32 0.00 0.00 178.16 174.90 1nf2 n VAL 257 N -4.74 1.53 -0.34 1.81 0.31 -1.07 -4.39 118.33 111.44 1nf2 n VAL 257 Ca 0.25 -0.67 0.08 0.00 -0.01 0.00 0.00 64.34 63.99 1nf2 n VAL 257 Cb 0.72 -1.23 0.27 0.00 -0.91 0.00 0.00 33.84 32.68 1nf2 n VAL 257 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1nf2 h LEU 258 N 0.01 0.87 -1.22 7.52 5.85 -0.25 -0.58 115.31 127.52 1nf2 h LEU 258 Ca -0.52 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.25 1nf2 h LEU 258 Cb 2.01 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.92 1nf2 h LEU 258 CO -0.01 0.46 0.00 -0.33 -0.34 0.00 0.00 178.44 178.21 1nf2 h GLU 259 N 0.93 0.00 0.00 1.25 5.08 -1.34 -3.14 114.58 117.36 1nf2 h GLU 259 Ca 0.49 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.85 1nf2 h GLU 259 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1nf2 h GLU 259 CO -0.26 0.00 -1.05 0.54 -1.00 0.00 0.00 179.01 177.24 1nf2 n ARG 260 N -2.74 0.50 -2.43 2.33 5.12 -0.25 -4.99 116.66 114.20 1nf2 n ARG 260 Ca 0.01 -0.02 -0.41 0.00 -1.93 0.00 0.00 57.85 55.50 1nf2 n ARG 260 Cb 0.26 -1.44 -0.04 0.00 -1.16 0.00 0.00 32.46 30.09 1nf2 n ARG 260 CO 0.00 0.00 0.00 -1.50 -1.93 0.00 0.00 177.63 174.20 1nf2 s ILE 261 N -2.93 3.47 -0.24 0.55 2.07 -1.03 -4.95 121.20 118.13 1nf2 s ILE 261 Ca 0.06 1.40 -0.29 0.00 -1.41 0.00 0.00 60.65 60.41 1nf2 s ILE 261 Cb 0.15 -3.89 -0.03 0.00 0.13 0.00 0.00 42.46 38.81 1nf2 s ILE 261 CO 0.81 0.30 1.81 -0.44 -1.91 0.00 0.00 174.94 175.52 1nf2 s SER 262 N -0.56 6.06 0.03 4.50 0.01 -1.26 -4.96 113.70 117.51 1nf2 s SER 262 Ca 0.47 1.64 0.01 0.00 1.31 0.00 0.00 55.95 59.39 1nf2 s SER 262 Cb -0.33 -2.53 -0.02 0.00 0.21 0.00 0.00 66.02 63.36 1nf2 s SER 262 CO 0.41 -1.52 -0.06 0.28 0.41 0.00 0.00 173.24 172.76 1nf2 s THR 263 N 6.25 0.36 0.00 1.44 -1.32 -1.26 -0.87 115.64 120.24 1nf2 s THR 263 Ca 0.81 -0.94 0.00 0.00 -1.21 0.00 0.00 61.69 60.35 1nf2 s THR 263 Cb -0.27 -0.45 0.00 0.00 -1.51 0.00 0.00 72.50 70.27 1nf2 s THR 263 CO 0.33 -0.39 0.00 0.47 -2.21 0.00 0.00 174.62 172.82 1nf2 n ASP 264 N 1.64 0.00 -0.61 8.08 9.92 -1.15 -4.86 116.55 129.56 1nf2 n ASP 264 Ca -0.22 0.00 0.04 0.00 -0.53 0.00 0.00 54.79 54.07 1nf2 n ASP 264 Cb 0.55 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 41.02 1nf2 n ASP 264 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1nf2 n LEU 266 N -2.23 0.61 0.00 0.00 4.77 -1.26 -5.10 117.00 113.80 1nf2 n LEU 266 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1nf2 n LEU 266 Cb 0.54 -1.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.27 1nf2 n LEU 266 CO 0.01 -0.47 0.00 0.47 -1.33 0.00 0.00 177.39 176.06