#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pn2 s VAL 6 N 0.00 4.03 -0.21 -1.45 1.01 -1.26 -2.37 120.40 120.14 1pn2 s VAL 6 Ca 0.00 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1pn2 s VAL 6 Cb 0.00 -2.77 0.03 0.00 0.00 0.00 0.00 36.38 33.64 1pn2 s VAL 6 CO 0.00 0.49 -0.15 0.86 0.00 0.00 0.00 175.10 176.30 1pn2 s TRP 7 N 0.34 2.95 -0.26 5.22 -0.00 -0.36 -4.90 118.94 121.93 1pn2 s TRP 7 Ca -0.03 -1.77 -0.10 0.00 -0.00 0.00 0.00 56.10 54.19 1pn2 s TRP 7 Cb -0.14 -1.95 -0.05 0.00 -0.00 0.00 0.00 33.47 31.33 1pn2 s TRP 7 CO 0.03 -0.80 0.16 0.50 -0.00 0.00 0.00 176.95 176.83 1pn2 s ARG 8 N 1.26 3.97 0.15 5.86 3.52 -1.26 -1.02 118.95 131.43 1pn2 s ARG 8 Ca 0.01 -0.32 0.05 0.00 -0.13 0.00 0.00 55.73 55.34 1pn2 s ARG 8 Cb -0.15 -3.57 -0.04 0.00 -1.56 0.00 0.00 34.95 29.63 1pn2 s ARG 8 CO -0.09 -0.07 -0.10 -0.59 -0.81 0.00 0.00 175.30 173.63 1pn2 s PHE 9 N 1.43 1.29 0.14 5.12 -0.71 0.17 -5.01 117.98 120.41 1pn2 s PHE 9 Ca 0.07 -0.75 -0.00 0.00 -1.04 0.00 0.00 56.93 55.21 1pn2 s PHE 9 Cb -0.15 -0.65 0.00 0.00 -1.21 0.00 0.00 43.02 41.01 1pn2 s PHE 9 CO 0.07 0.10 0.18 -0.40 -1.34 0.00 0.00 175.22 173.83 1pn2 n ASP 10 N -0.20 -0.49 0.29 1.98 5.68 -1.26 -1.05 116.55 121.51 1pn2 n ASP 10 Ca -0.10 -1.76 0.16 0.00 -0.50 0.00 0.00 54.79 52.59 1pn2 n ASP 10 Cb 0.61 0.93 0.87 0.00 -1.14 0.00 0.00 41.12 42.38 1pn2 n ASP 10 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 1pn2 h ASP 11 N 0.77 0.00 -0.38 -1.12 3.04 -1.99 -1.72 116.42 115.02 1pn2 h ASP 11 Ca -0.10 0.00 -0.14 0.00 -3.24 0.00 0.00 57.03 53.54 1pn2 h ASP 11 Cb 0.46 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.75 1pn2 h ASP 11 CO 0.14 0.06 -0.32 -0.09 -2.04 0.00 0.00 179.24 176.99 1pn2 h ARG 12 N 0.00 0.89 -0.51 4.15 2.43 -1.96 0.79 114.38 120.16 1pn2 h ARG 12 Ca -0.00 -0.45 -0.01 0.00 -0.81 0.00 0.00 59.98 58.71 1pn2 h ARG 12 Cb 0.23 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.76 1pn2 h ARG 12 CO 0.01 1.10 0.29 -0.44 -1.51 0.00 0.00 179.97 179.41 1pn2 h ASP 13 N 0.70 0.63 0.03 -3.80 3.32 -1.71 -1.04 116.42 114.55 1pn2 h ASP 13 Ca 0.07 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1pn2 h ASP 13 Cb 0.90 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.29 1pn2 h ASP 13 CO 0.08 0.53 -0.02 0.58 -1.72 0.00 0.00 179.24 178.69 1pn2 h VAL 14 N 0.68 1.04 -0.31 -1.35 2.07 -1.29 -1.83 116.25 115.26 1pn2 h VAL 14 Ca 0.18 -0.22 -0.16 0.00 0.82 0.00 0.00 66.70 67.31 1pn2 h VAL 14 Cb 0.03 1.19 -0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1pn2 h VAL 14 CO -0.03 0.06 -0.44 0.40 0.02 0.00 0.00 177.57 177.58 1pn2 h ILE 15 N -0.14 1.28 -0.71 4.57 2.04 -0.83 -0.80 117.51 122.92 1pn2 h ILE 15 Ca -0.00 -1.62 0.06 0.00 1.00 0.00 0.00 64.86 64.29 1pn2 h ILE 15 Cb 0.13 1.57 -0.06 0.00 -0.74 0.00 0.00 36.82 37.72 1pn2 h ILE 15 CO 0.01 0.53 0.41 0.25 0.00 0.00 0.00 178.15 179.35 1pn2 h LEU 16 N 0.63 0.63 0.01 1.44 5.85 -1.18 -1.11 115.31 121.58 1pn2 h LEU 16 Ca 0.03 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 1pn2 h LEU 16 Cb 1.04 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.97 1pn2 h LEU 16 CO 0.10 0.40 -0.01 0.22 -0.34 0.00 0.00 178.44 178.82 1pn2 h TYR 17 N 0.76 -0.02 -0.67 1.25 3.20 -1.15 -2.43 116.97 117.92 1pn2 h TYR 17 Ca 0.32 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.25 1pn2 h TYR 17 Cb 0.18 0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.39 1pn2 h TYR 17 CO -0.07 0.31 0.36 -0.91 -1.64 0.00 0.00 178.16 176.21 1pn2 h ASN 18 N -0.34 0.51 -0.62 -2.11 2.35 -0.92 -2.04 115.58 112.42 1pn2 h ASN 18 Ca -0.00 0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.76 1pn2 h ASN 18 Cb 0.33 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.61 1pn2 h ASN 18 CO 0.00 0.33 0.28 0.40 -1.65 0.00 0.00 177.43 176.79 1pn2 h ILE 19 N 0.65 1.22 0.00 2.81 2.04 -1.23 -1.12 117.51 121.88 1pn2 h ILE 19 Ca 0.30 -0.65 -0.00 0.00 1.00 0.00 0.00 64.86 65.51 1pn2 h ILE 19 Cb 0.22 0.51 -0.00 0.00 -0.74 0.00 0.00 36.82 36.81 1pn2 h ILE 19 CO -0.20 0.26 -0.01 0.00 0.00 0.00 0.00 178.15 178.20 1pn2 h ALA 20 N 1.11 1.52 -0.33 1.87 0.00 -0.87 -0.78 119.26 121.79 1pn2 h ALA 20 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1pn2 h ALA 20 Cb 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1pn2 h ALA 20 CO -0.02 0.01 0.00 1.28 0.00 0.00 0.00 179.25 180.52 1pn2 n LEU 21 N -3.84 2.57 0.00 0.00 4.77 -0.70 -4.92 117.00 114.88 1pn2 n LEU 21 Ca -0.03 -1.14 0.00 0.00 -0.03 0.00 0.00 56.01 54.81 1pn2 n LEU 21 Cb 0.09 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1pn2 n LEU 21 CO 0.28 0.57 0.00 0.61 -1.33 0.00 0.00 177.39 177.52 1pn2 n GLY 22 N 1.31 1.11 3.72 -0.72 0.00 -0.30 -4.67 105.19 105.65 1pn2 n GLY 22 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1pn2 n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pn2 s ALA 23 N -2.00 3.83 0.42 4.61 0.00 -0.51 -4.98 121.76 123.13 1pn2 s ALA 23 Ca 0.00 1.46 0.08 0.00 0.00 0.00 0.00 51.96 53.50 1pn2 s ALA 23 Cb 0.00 -3.65 -0.02 0.00 0.00 0.00 0.00 23.12 19.45 1pn2 s ALA 23 CO 0.00 -0.84 0.35 0.95 0.00 0.00 0.00 175.76 176.21 1pn2 s THR 24 N 1.00 2.57 0.33 0.00 -4.23 -1.26 -4.53 115.64 109.52 1pn2 s THR 24 Ca 0.71 -1.40 0.32 0.00 -1.18 0.00 0.00 61.69 60.13 1pn2 s THR 24 Cb -0.46 -2.98 0.35 0.00 1.34 0.00 0.00 72.50 70.75 1pn2 s THR 24 CO 0.33 0.00 2.07 0.74 -0.54 0.00 0.00 174.62 177.22 1pn2 h THR 25 N 1.08 0.28 -0.62 3.99 2.02 -1.99 -1.15 112.91 116.52 1pn2 h THR 25 Ca -0.41 -0.50 -0.01 0.00 0.77 0.00 0.00 66.41 66.26 1pn2 h THR 25 Cb 1.26 1.39 -0.03 0.00 -1.74 0.00 0.00 68.15 69.03 1pn2 h THR 25 CO 0.59 0.07 0.36 0.11 0.37 0.00 0.00 175.52 177.02 1pn2 h LYS 26 N 0.00 0.84 -3.88 6.66 1.57 -2.01 -3.29 116.57 116.47 1pn2 h LYS 26 Ca -0.00 -0.08 -0.77 0.00 -1.87 0.00 0.00 60.65 57.93 1pn2 h LYS 26 Cb 0.38 -0.18 -0.22 0.00 0.08 0.00 0.00 32.23 32.30 1pn2 h LYS 26 CO 0.01 0.60 1.12 1.04 -0.57 0.00 0.00 179.45 181.65 1pn2 n GLN 27 N -4.40 3.65 0.28 3.15 6.02 -0.43 -4.81 117.38 120.83 1pn2 n GLN 27 Ca 0.06 -4.09 0.13 0.00 -0.01 0.00 0.00 57.00 53.09 1pn2 n GLN 27 Cb 0.08 -2.79 0.82 0.00 1.02 0.00 0.00 30.24 29.37 1pn2 n GLN 27 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1pn2 h LEU 28 N 7.78 0.00 -2.10 1.08 3.38 -1.73 -1.54 115.31 122.18 1pn2 h LEU 28 Ca 0.27 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.31 1pn2 h LEU 28 Cb 0.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1pn2 h LEU 28 CO 1.26 0.04 0.21 0.07 0.09 0.00 0.00 178.44 180.11 1pn2 h LYS 29 N 0.00 0.00 0.00 1.13 2.10 -1.85 -0.92 116.57 117.03 1pn2 h LYS 29 Ca -0.00 0.00 -0.30 0.00 -2.00 0.00 0.00 60.65 58.35 1pn2 h LYS 29 Cb 0.11 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 31.38 1pn2 h LYS 29 CO 0.01 0.00 -1.98 0.66 -2.00 0.00 0.00 179.45 176.14 1pn2 n TYR 30 N -4.17 0.55 0.21 0.07 4.01 -0.59 -0.91 117.16 116.33 1pn2 n TYR 30 Ca 0.03 0.20 0.03 0.00 -0.16 0.00 0.00 57.90 57.99 1pn2 n TYR 30 Cb 0.36 -1.08 0.02 0.00 -0.31 0.00 0.00 39.34 38.33 1pn2 n TYR 30 CO 0.00 0.00 0.00 1.33 -0.46 0.00 0.00 176.86 177.73 1pn2 n VAL 31 N -2.88 0.00 -3.72 -0.72 0.24 -1.04 -4.55 118.33 105.66 1pn2 n VAL 31 Ca -0.23 -0.49 -0.27 0.00 -2.04 0.00 0.00 64.34 61.31 1pn2 n VAL 31 Cb 1.06 1.10 -0.17 0.00 -1.47 0.00 0.00 33.84 34.37 1pn2 n VAL 31 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1pn2 s TYR 32 N -0.47 0.89 0.60 6.34 5.04 -0.38 -5.00 117.35 124.37 1pn2 s TYR 32 Ca 0.06 -0.76 0.30 0.00 -2.44 0.00 0.00 57.07 54.23 1pn2 s TYR 32 Cb 0.04 -0.97 1.77 0.00 0.35 0.00 0.00 41.96 43.15 1pn2 s TYR 32 CO 0.07 -0.59 2.16 1.05 -1.34 0.00 0.00 175.55 176.90 1pn2 h GLU 33 N 8.27 0.00 -0.14 4.97 9.09 -1.92 -1.85 114.58 133.00 1pn2 h GLU 33 Ca -0.16 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.25 1pn2 h GLU 33 Cb 1.12 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.22 1pn2 h GLU 33 CO 0.33 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.48 1pn2 n ASN 34 N -3.71 2.34 -4.77 3.06 3.02 -1.26 -4.85 115.26 109.10 1pn2 n ASN 34 Ca -0.00 -1.79 -0.40 0.00 -0.03 0.00 0.00 54.58 52.36 1pn2 n ASN 34 Cb 0.24 -0.08 -0.00 0.00 -0.61 0.00 0.00 39.78 39.32 1pn2 n ASN 34 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1pn2 s ASP 35 N -1.78 6.33 0.57 6.41 2.15 -0.70 -4.88 116.67 124.77 1pn2 s ASP 35 Ca 0.34 2.72 0.27 0.00 0.43 0.00 0.00 52.55 56.31 1pn2 s ASP 35 Cb 0.20 -2.64 1.53 0.00 -0.30 0.00 0.00 42.92 41.71 1pn2 s ASP 35 CO 0.30 -0.84 2.05 0.28 -0.17 0.00 0.00 175.17 176.78 1pn2 h SER 36 N 2.76 0.00 -0.38 -0.34 0.02 -1.92 -1.75 113.55 111.95 1pn2 h SER 36 Ca -0.50 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.27 1pn2 h SER 36 Cb 1.24 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.68 1pn2 h SER 36 CO 0.63 0.00 -0.04 0.47 -1.14 0.00 0.00 176.83 176.75 1pn2 n ASP 37 N -4.00 2.63 -4.66 3.07 8.00 -1.26 -5.04 116.55 115.30 1pn2 n ASP 37 Ca 0.04 -3.72 -0.47 0.00 0.71 0.00 0.00 54.79 51.36 1pn2 n ASP 37 Cb 0.43 -0.64 -0.04 0.00 -0.02 0.00 0.00 41.12 40.85 1pn2 n ASP 37 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1pn2 n PHE 38 N -1.08 2.12 -3.60 1.24 7.35 -0.66 -4.75 117.46 118.08 1pn2 n PHE 38 Ca 0.34 0.36 -0.15 0.00 -0.76 0.00 0.00 57.45 57.23 1pn2 n PHE 38 Cb 1.06 -2.49 -0.06 0.00 0.35 0.00 0.00 39.48 38.33 1pn2 n PHE 38 CO 0.00 0.00 0.00 1.14 -0.76 0.00 0.00 176.76 177.14 1pn2 s GLN 39 N 0.65 0.96 -0.11 -4.13 -2.07 -0.09 -4.99 119.66 109.88 1pn2 s GLN 39 Ca 0.78 -0.06 -0.05 0.00 -1.82 0.00 0.00 55.36 54.21 1pn2 s GLN 39 Cb -0.72 0.44 -0.04 0.00 -1.09 0.00 0.00 33.01 31.60 1pn2 s GLN 39 CO 0.41 -0.31 0.09 0.54 -1.32 0.00 0.00 175.29 174.69 1pn2 s VAL 40 N -1.78 5.05 -0.03 3.63 0.11 -1.26 -4.52 120.40 121.59 1pn2 s VAL 40 Ca -0.09 0.03 -0.30 0.00 -2.93 0.00 0.00 61.98 58.70 1pn2 s VAL 40 Cb -0.01 -3.18 -0.06 0.00 -1.53 0.00 0.00 36.38 31.60 1pn2 s VAL 40 CO 0.04 0.61 1.61 -0.63 -3.33 0.00 0.00 175.10 173.40 1pn2 s ILE 41 N -0.91 3.53 0.46 7.04 1.01 -1.26 -4.89 121.20 126.18 1pn2 s ILE 41 Ca 0.14 0.74 0.40 0.00 0.00 0.00 0.00 60.65 61.93 1pn2 s ILE 41 Cb -0.12 -3.48 0.41 0.00 0.01 0.00 0.00 42.46 39.29 1pn2 s ILE 41 CO 0.03 -0.05 2.23 1.55 0.00 0.00 0.00 174.94 178.70 1pn2 h PRO 42 N 9.11 0.00 0.00 2.79 0.13 -1.98 -1.92 132.00 140.13 1pn2 h PRO 42 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1pn2 h PRO 42 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1pn2 h PRO 42 CO 0.94 0.00 0.00 1.79 -0.23 0.00 0.00 178.00 180.50 1pn2 h THR 43 N 0.00 0.00 -1.40 1.56 1.35 -1.95 -2.50 112.91 109.96 1pn2 h THR 43 Ca 0.00 -0.05 0.46 0.00 -0.55 0.00 0.00 66.41 66.28 1pn2 h THR 43 Cb 0.11 0.97 -0.13 0.00 -1.73 0.00 0.00 68.15 67.37 1pn2 h THR 43 CO 0.00 0.00 0.92 0.15 -0.25 0.00 0.00 175.52 176.34 1pn2 h PHE 44 N 0.00 0.46 -0.09 4.73 3.04 -1.73 -1.79 116.94 121.56 1pn2 h PHE 44 Ca 0.00 0.02 0.03 0.00 3.98 0.00 0.00 57.97 62.00 1pn2 h PHE 44 Cb 0.05 -0.11 -0.00 0.00 2.56 0.00 0.00 35.95 38.44 1pn2 h PHE 44 CO 0.00 -0.21 0.19 0.78 -2.02 0.00 0.00 178.31 177.05 1pn2 h GLY 45 N 0.05 0.00 2.00 2.40 0.00 -1.71 -2.23 103.07 103.58 1pn2 h GLY 45 Ca 0.85 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 48.17 1pn2 h GLY 45 CO -0.39 0.00 -0.05 1.12 0.00 0.00 0.00 176.54 177.22 1pn2 h HIS 46 N 0.00 0.00 0.00 5.60 2.07 -1.59 -3.31 115.15 117.92 1pn2 h HIS 46 Ca 0.04 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.56 1pn2 h HIS 46 Cb 0.42 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.40 1pn2 h HIS 46 CO 0.00 0.05 0.00 1.28 -3.07 0.00 0.00 177.93 176.19 1pn2 n LEU 47 N -3.17 0.01 0.09 6.12 4.77 -0.84 -2.09 117.00 121.89 1pn2 n LEU 47 Ca 0.00 0.50 0.19 0.00 -0.03 0.00 0.00 56.01 56.68 1pn2 n LEU 47 Cb 0.33 -0.50 0.75 0.00 -2.33 0.00 0.00 43.42 41.67 1pn2 n LEU 47 CO 0.29 -0.42 1.17 0.16 -1.33 0.00 0.00 177.39 177.26 1pn2 h ILE 48 N 0.00 0.53 -0.89 -0.08 -0.00 -1.81 -1.48 117.51 113.78 1pn2 h ILE 48 Ca 0.00 0.00 0.24 0.00 -0.00 0.00 0.00 64.86 65.10 1pn2 h ILE 48 Cb 0.09 0.73 -0.15 0.00 -0.00 0.00 0.00 36.82 37.49 1pn2 h ILE 48 CO 0.00 0.00 0.22 0.74 -0.00 0.00 0.00 178.15 179.11 1pn2 h THR 49 N 0.00 0.27 -0.02 0.16 2.02 -1.74 -1.21 112.91 112.39 1pn2 h THR 49 Ca 0.19 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.30 1pn2 h THR 49 Cb 0.90 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 1pn2 h THR 49 CO -0.00 0.03 -0.17 0.49 0.37 0.00 0.00 175.52 176.24 1pn2 n PHE 50 N -5.26 0.00 -1.20 3.16 3.72 -0.56 -4.22 117.46 113.11 1pn2 n PHE 50 Ca 0.22 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.69 1pn2 n PHE 50 Cb 0.71 0.00 0.10 0.00 -0.94 0.00 0.00 39.48 39.35 1pn2 n PHE 50 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1pn2 n ASN 51 N 0.85 1.78 -2.38 4.37 3.02 -0.99 -4.70 115.26 117.21 1pn2 n ASN 51 Ca 0.12 -2.74 -0.26 0.00 -0.03 0.00 0.00 54.58 51.67 1pn2 n ASN 51 Cb 0.55 -0.34 0.00 0.00 -0.61 0.00 0.00 39.78 39.38 1pn2 n ASN 51 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1pn2 n SER 52 N -1.04 4.72 -0.10 6.41 7.64 -0.49 -4.30 113.62 126.46 1pn2 n SER 52 Ca 0.11 -3.71 0.00 0.00 1.01 0.00 0.00 58.87 56.28 1pn2 n SER 52 Cb 0.62 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 1pn2 n SER 52 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pn2 n GLY 53 N -0.53 0.00 0.00 0.23 0.00 -1.26 -2.54 105.19 101.09 1pn2 n GLY 53 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1pn2 n GLY 53 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1pn2 n LYS 54 N 0.04 0.00 -0.31 1.61 4.81 -1.26 -4.96 118.16 118.10 1pn2 n LYS 54 Ca 0.00 0.00 0.24 0.00 -0.87 0.00 0.00 58.31 57.68 1pn2 n LYS 54 Cb 0.00 0.00 0.55 0.00 0.02 0.00 0.00 35.03 35.60 1pn2 n LYS 54 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1pn2 h SER 55 N 0.24 0.36 -0.83 3.14 4.64 -1.92 -2.92 113.55 116.26 1pn2 h SER 55 Ca 0.00 0.06 0.22 0.00 -0.47 0.00 0.00 61.79 61.60 1pn2 h SER 55 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 1pn2 h SER 55 CO 0.00 0.08 0.58 -0.61 -0.87 0.00 0.00 176.83 176.01 1pn2 h GLN 56 N 0.33 0.15 -0.83 4.77 5.75 -1.86 -2.13 115.11 121.29 1pn2 h GLN 56 Ca 0.57 -0.01 -0.11 0.00 -0.15 0.00 0.00 58.65 58.95 1pn2 h GLN 56 Cb 1.57 -0.03 -0.07 0.00 1.07 0.00 0.00 27.48 30.02 1pn2 h GLN 56 CO -0.23 0.10 0.14 0.09 -2.65 0.00 0.00 178.83 176.28 1pn2 n ASN 57 N -4.38 3.77 0.24 -0.69 3.02 -1.10 -4.60 115.26 111.51 1pn2 n ASN 57 Ca 0.17 -2.72 0.16 0.00 -0.03 0.00 0.00 54.58 52.17 1pn2 n ASN 57 Cb 0.79 -0.65 0.72 0.00 -0.61 0.00 0.00 39.78 40.03 1pn2 n ASN 57 CO 0.00 0.00 0.00 -1.28 -2.62 0.00 0.00 177.26 173.36 1pn2 h SER 58 N 1.83 0.00 0.78 6.41 0.87 -1.60 -2.55 113.55 119.28 1pn2 h SER 58 Ca 0.13 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.65 1pn2 h SER 58 Cb 1.67 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.62 1pn2 h SER 58 CO 0.43 0.00 -0.21 2.19 -0.53 0.00 0.00 176.83 178.72 1pn2 h PHE 59 N 0.00 0.00 0.00 2.24 -0.00 -1.87 -3.32 116.94 114.00 1pn2 h PHE 59 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.97 57.97 1pn2 h PHE 59 Cb 0.33 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.28 1pn2 h PHE 59 CO 0.00 0.21 -0.01 0.00 -0.00 0.00 0.00 178.31 178.51 1pn2 h ALA 60 N 1.79 1.72 0.00 12.09 0.00 -1.84 -1.66 119.26 131.35 1pn2 h ALA 60 Ca -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1pn2 h ALA 60 Cb 0.65 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1pn2 h ALA 60 CO 0.03 0.01 -0.04 0.87 0.00 0.00 0.00 179.25 180.12 1pn2 h LYS 61 N 0.00 0.00 0.00 0.00 1.57 -1.80 -2.19 116.57 114.15 1pn2 h LYS 61 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1pn2 h LYS 61 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1pn2 h LYS 61 CO 0.00 0.04 -0.80 -0.07 -0.57 0.00 0.00 179.45 178.05 1pn2 h LEU 62 N 0.00 0.00-10.14 2.94 4.07 -1.56 -3.47 115.31 107.15 1pn2 h LEU 62 Ca -0.00 -0.17 -0.51 0.00 0.08 0.00 0.00 57.88 57.28 1pn2 h LEU 62 Cb 0.30 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.04 1pn2 h LEU 62 CO 0.01 0.09 -0.16 -0.76 -1.08 0.00 0.00 178.44 176.53 1pn2 s LEU 63 N -4.54 4.05 0.09 1.67 1.43 -0.82 -4.40 118.68 116.15 1pn2 s LEU 63 Ca 0.04 0.62 0.07 0.00 -1.03 0.00 0.00 54.13 53.83 1pn2 s LEU 63 Cb 0.12 -3.45 -0.03 0.00 0.03 0.00 0.00 46.19 42.86 1pn2 s LEU 63 CO 0.75 -0.22 -0.17 -0.13 0.23 0.00 0.00 176.35 176.82 1pn2 s ARG 64 N -3.76 0.98 -1.43 1.70 0.52 -0.75 -4.80 118.95 111.41 1pn2 s ARG 64 Ca 0.42 -1.09 -0.07 0.00 -0.52 0.00 0.00 55.73 54.47 1pn2 s ARG 64 Cb -0.10 -1.07 0.04 0.00 0.52 0.00 0.00 34.95 34.33 1pn2 s ARG 64 CO 0.32 0.24 0.61 0.09 0.02 0.00 0.00 175.30 176.58 1pn2 n ASN 65 N 1.05 -5.04 -4.64 0.23 4.13 -1.26 -2.36 115.26 107.37 1pn2 n ASN 65 Ca -0.19 -0.37 -0.43 0.00 1.68 0.00 0.00 54.58 55.26 1pn2 n ASN 65 Cb 0.54 -4.10 -0.02 0.00 -1.54 0.00 0.00 39.78 34.67 1pn2 n ASN 65 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1pn2 s PHE 66 N -3.09 2.90 -0.25 3.10 5.36 -1.26 -4.55 117.98 120.19 1pn2 s PHE 66 Ca 0.38 1.02 -0.04 0.00 -0.96 0.00 0.00 56.93 57.34 1pn2 s PHE 66 Cb -0.19 -3.76 0.01 0.00 -0.34 0.00 0.00 43.02 38.74 1pn2 s PHE 66 CO 0.47 -1.32 -0.02 1.21 -1.46 0.00 0.00 175.22 174.11 1pn2 s ASN 67 N 2.21 4.53 0.00 6.13 3.84 -1.26 -5.11 114.94 125.28 1pn2 s ASN 67 Ca 0.52 -0.64 -0.01 0.00 0.21 0.00 0.00 52.86 52.94 1pn2 s ASN 67 Cb -0.15 -1.75 -0.03 0.00 -0.55 0.00 0.00 41.25 38.76 1pn2 s ASN 67 CO 0.19 -0.10 0.97 -0.81 -2.79 0.00 0.00 177.10 174.55 1pn2 n PRO 68 N 4.77 0.44 0.00 0.43 -0.04 -1.26 -3.68 135.00 135.67 1pn2 n PRO 68 Ca -0.17 -0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.17 1pn2 n PRO 68 Cb 0.49 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 1pn2 n PRO 68 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1pn2 n LEU 70 N 2.22 0.00 -4.77 1.53 4.77 -1.26 -4.87 117.00 114.62 1pn2 n LEU 70 Ca 0.05 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.64 1pn2 n LEU 70 Cb 0.21 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.24 1pn2 n LEU 70 CO 0.08 0.00 0.41 -0.22 -1.33 0.00 0.00 177.39 176.33 1pn2 s LEU 71 N 0.00 4.52 -0.06 2.23 0.20 -1.24 -2.21 118.68 122.11 1pn2 s LEU 71 Ca 0.00 1.45 0.03 0.00 0.69 0.00 0.00 54.13 56.30 1pn2 s LEU 71 Cb 0.00 -3.15 0.01 0.00 -0.43 0.00 0.00 46.19 42.62 1pn2 s LEU 71 CO 0.00 0.15 -0.14 -0.76 -0.29 0.00 0.00 176.35 175.31 1pn2 s LEU 72 N -0.70 1.79 -0.72 -0.68 1.43 0.59 -4.98 118.68 115.40 1pn2 s LEU 72 Ca 0.35 -0.33 -0.27 0.00 -1.03 0.00 0.00 54.13 52.85 1pn2 s LEU 72 Cb -0.21 -0.89 0.03 0.00 0.03 0.00 0.00 46.19 45.15 1pn2 s LEU 72 CO 0.23 0.09 1.28 -2.28 0.23 0.00 0.00 176.35 175.89 1pn2 s HIS 73 N 0.38 2.31 -0.13 0.29 5.65 -1.26 -0.16 115.29 122.37 1pn2 s HIS 73 Ca -0.10 0.01 0.08 0.00 0.25 0.00 0.00 55.06 55.30 1pn2 s HIS 73 Cb -0.14 -4.61 -0.23 0.00 -1.18 0.00 0.00 32.58 26.42 1pn2 s HIS 73 CO 0.03 -2.02 0.32 0.41 -0.65 0.00 0.00 174.74 172.83 1pn2 n GLY 74 N 5.34 -0.80 3.05 1.59 0.00 -0.48 -4.70 105.19 109.19 1pn2 n GLY 74 Ca 0.04 -0.19 -0.10 0.00 0.00 0.00 0.00 46.02 45.77 1pn2 n GLY 74 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pn2 s GLU 75 N -2.55 0.42 -0.01 1.61 2.02 -1.14 -0.69 118.70 118.36 1pn2 s GLU 75 Ca -0.15 -0.57 -0.01 0.00 0.02 0.00 0.00 54.97 54.26 1pn2 s GLU 75 Cb 0.07 0.16 0.01 0.00 0.10 0.00 0.00 34.13 34.47 1pn2 s GLU 75 CO 0.78 -0.09 0.03 -1.58 0.02 0.00 0.00 175.26 174.42 1pn2 s HIS 76 N -1.67 -0.02 -0.04 1.61 2.46 -0.72 -1.07 115.29 115.85 1pn2 s HIS 76 Ca -0.13 0.09 0.02 0.00 0.47 0.00 0.00 55.06 55.51 1pn2 s HIS 76 Cb -0.07 -0.03 0.01 0.00 -0.13 0.00 0.00 32.58 32.35 1pn2 s HIS 76 CO -0.01 -0.03 -0.10 -0.47 -2.47 0.00 0.00 174.74 171.66 1pn2 s TYR 77 N 0.22 1.16 -0.01 3.88 5.04 -0.09 -1.14 117.35 126.42 1pn2 s TYR 77 Ca -0.02 -0.35 0.01 0.00 -2.44 0.00 0.00 57.07 54.28 1pn2 s TYR 77 Cb -0.03 -0.85 0.00 0.00 0.35 0.00 0.00 41.96 41.44 1pn2 s TYR 77 CO -0.01 -0.17 -0.04 -1.17 -1.34 0.00 0.00 175.55 172.83 1pn2 s LEU 78 N 0.41 1.83 -0.02 6.97 0.20 0.08 -0.67 118.68 127.49 1pn2 s LEU 78 Ca -0.08 -0.07 0.04 0.00 0.69 0.00 0.00 54.13 54.71 1pn2 s LEU 78 Cb -0.12 -0.24 -0.01 0.00 -0.43 0.00 0.00 46.19 45.40 1pn2 s LEU 78 CO 0.02 0.02 -0.15 -0.75 -0.29 0.00 0.00 176.35 175.20 1pn2 s LYS 79 N 0.15 1.31 -0.26 1.98 2.20 0.26 -1.41 119.74 123.97 1pn2 s LYS 79 Ca -0.01 -0.52 -0.09 0.00 -0.36 0.00 0.00 55.97 54.99 1pn2 s LYS 79 Cb -0.04 -1.23 -0.04 0.00 -1.51 0.00 0.00 37.83 35.01 1pn2 s LYS 79 CO -0.00 0.28 0.13 0.08 -0.36 0.00 0.00 175.35 175.47 1pn2 s VAL 80 N -0.19 4.85 -0.71 4.02 1.01 0.32 -0.63 120.40 129.08 1pn2 s VAL 80 Ca 0.02 0.01 0.19 0.00 0.00 0.00 0.00 61.98 62.20 1pn2 s VAL 80 Cb -0.07 -3.28 -0.23 0.00 0.00 0.00 0.00 36.38 32.80 1pn2 s VAL 80 CO 0.00 0.31 0.73 1.41 0.00 0.00 0.00 175.10 177.55 1pn2 n HIS 81 N 4.81 0.00 -3.85 5.22 -0.00 0.08 -4.83 115.22 116.64 1pn2 n HIS 81 Ca -0.15 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.28 1pn2 n HIS 81 Cb 0.52 -0.10 -0.16 0.00 -0.00 0.00 0.00 29.99 30.25 1pn2 n HIS 81 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1pn2 s SER 82 N -3.13 3.53 -0.19 0.41 0.15 -1.24 -4.94 113.70 108.30 1pn2 s SER 82 Ca 0.04 -1.10 -0.06 0.00 0.70 0.00 0.00 55.95 55.53 1pn2 s SER 82 Cb 0.14 -0.94 -0.04 0.00 -1.71 0.00 0.00 66.02 63.47 1pn2 s SER 82 CO 0.79 -0.28 0.04 0.86 1.20 0.00 0.00 173.24 175.85 1pn2 s TRP 83 N 1.58 3.16 0.50 3.44 -0.11 -1.26 -2.90 118.94 123.35 1pn2 s TRP 83 Ca -0.02 -0.11 -0.08 0.00 1.22 0.00 0.00 56.10 57.11 1pn2 s TRP 83 Cb -0.18 -2.08 -0.04 0.00 -1.50 0.00 0.00 33.47 29.67 1pn2 s TRP 83 CO -0.08 0.01 0.84 -1.25 -4.62 0.00 0.00 176.95 171.85 1pn2 s PRO 84 N 0.60 3.61 0.67 5.86 0.04 -1.26 -5.12 135.00 139.39 1pn2 s PRO 84 Ca 0.02 0.39 -0.16 0.00 0.04 0.00 0.00 61.00 61.29 1pn2 s PRO 84 Cb -0.13 -2.31 0.01 0.00 0.04 0.00 0.00 34.50 32.11 1pn2 s PRO 84 CO 0.02 -0.26 1.17 -1.25 0.04 0.00 0.00 177.00 176.72 1pn2 s PRO 85 N -4.66 2.60 0.46 0.56 0.04 -1.14 -4.96 135.00 127.89 1pn2 s PRO 85 Ca 0.50 1.63 -0.21 0.00 0.04 0.00 0.00 61.00 62.96 1pn2 s PRO 85 Cb -0.10 -1.90 -0.10 0.00 0.04 0.00 0.00 34.50 32.43 1pn2 s PRO 85 CO 0.44 -1.45 0.99 -1.25 0.04 0.00 0.00 177.00 175.78 1pn2 s PRO 86 N -3.83 4.02 0.00 0.56 0.04 -1.26 -4.71 135.00 129.82 1pn2 s PRO 86 Ca 0.72 1.24 0.18 0.00 0.04 0.00 0.00 61.00 63.18 1pn2 s PRO 86 Cb -0.26 -2.15 -0.01 0.00 0.04 0.00 0.00 34.50 32.13 1pn2 s PRO 86 CO 0.40 -0.22 0.92 0.25 0.04 0.00 0.00 177.00 178.38 1pn2 n THR 87 N -0.78 0.00 -3.63 1.26 -2.24 -1.26 -4.83 114.28 102.79 1pn2 n THR 87 Ca 0.08 -0.32 -0.12 0.00 -2.27 0.00 0.00 64.05 61.42 1pn2 n THR 87 Cb 0.53 1.21 -0.05 0.00 -2.10 0.00 0.00 70.33 69.92 1pn2 n THR 87 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1pn2 s GLU 88 N -2.04 1.00 0.00 -0.78 -1.05 -1.26 -3.60 118.70 110.97 1pn2 s GLU 88 Ca 0.15 -0.48 0.00 0.00 -0.15 0.00 0.00 54.97 54.49 1pn2 s GLU 88 Cb 0.14 0.45 0.00 0.00 -0.44 0.00 0.00 34.13 34.28 1pn2 s GLU 88 CO 0.45 -0.37 0.00 0.41 0.95 0.00 0.00 175.26 176.70 1pn2 n GLY 89 N 0.19 0.70 2.91 -3.83 0.00 -0.21 -4.98 105.19 99.97 1pn2 n GLY 89 Ca -0.17 -1.76 -0.27 0.00 0.00 0.00 0.00 46.02 43.82 1pn2 n GLY 89 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1pn2 s GLU 90 N -2.00 1.53 0.00 1.61 2.12 -1.26 -0.66 118.70 120.04 1pn2 s GLU 90 Ca 0.00 -0.25 0.07 0.00 0.36 0.00 0.00 54.97 55.14 1pn2 s GLU 90 Cb 0.00 -1.58 -0.02 0.00 0.26 0.00 0.00 34.13 32.79 1pn2 s GLU 90 CO 0.00 -0.26 -0.21 0.96 -0.54 0.00 0.00 175.26 175.21 1pn2 s ILE 91 N 1.69 1.64 -0.20 -3.70 -4.36 -0.19 -1.54 121.20 114.54 1pn2 s ILE 91 Ca 0.05 -0.97 -0.06 0.00 -0.26 0.00 0.00 60.65 59.40 1pn2 s ILE 91 Cb -0.13 -1.38 -0.03 0.00 1.25 0.00 0.00 42.46 42.17 1pn2 s ILE 91 CO -0.08 0.39 0.03 -0.75 0.24 0.00 0.00 174.94 174.77 1pn2 s LYS 92 N -0.68 3.77 -0.14 0.37 2.20 0.21 -1.22 119.74 124.26 1pn2 s LYS 92 Ca 0.08 -0.44 -0.02 0.00 -0.36 0.00 0.00 55.97 55.22 1pn2 s LYS 92 Cb -0.08 -3.16 -0.02 0.00 -1.51 0.00 0.00 37.83 33.05 1pn2 s LYS 92 CO -0.00 0.11 -0.06 0.99 -0.36 0.00 0.00 175.35 176.02 1pn2 s THR 93 N 0.79 3.65 -0.18 3.43 2.01 -1.00 -0.78 115.64 123.56 1pn2 s THR 93 Ca 0.02 -0.45 -0.05 0.00 0.31 0.00 0.00 61.69 61.52 1pn2 s THR 93 Cb -0.14 -2.58 -0.03 0.00 0.01 0.00 0.00 72.50 69.77 1pn2 s THR 93 CO 0.02 0.51 -0.01 -0.89 -0.69 0.00 0.00 174.62 173.56 1pn2 s THR 94 N 0.25 4.00 -0.12 -0.82 2.01 -0.07 -4.41 115.64 116.48 1pn2 s THR 94 Ca -0.05 -0.31 -0.05 0.00 0.31 0.00 0.00 61.69 61.60 1pn2 s THR 94 Cb -0.14 -2.79 -0.04 0.00 0.01 0.00 0.00 72.50 69.54 1pn2 s THR 94 CO 0.04 0.45 0.06 -0.36 -0.69 0.00 0.00 174.62 174.12 1pn2 s PHE 95 N 0.72 3.32 -0.15 4.92 0.08 -1.26 -1.18 117.98 124.42 1pn2 s PHE 95 Ca -0.00 0.27 -0.07 0.00 0.12 0.00 0.00 56.93 57.24 1pn2 s PHE 95 Cb -0.14 -1.90 0.06 0.00 -0.57 0.00 0.00 43.02 40.47 1pn2 s PHE 95 CO 0.02 0.49 0.36 -1.21 -0.10 0.00 0.00 175.22 174.77 1pn2 s GLU 96 N -0.65 0.31 0.46 0.44 0.41 -0.29 -5.01 118.70 114.36 1pn2 s GLU 96 Ca 0.11 0.76 -0.24 0.00 -0.41 0.00 0.00 54.97 55.20 1pn2 s GLU 96 Cb -0.12 0.01 -0.09 0.00 -1.78 0.00 0.00 34.13 32.16 1pn2 s GLU 96 CO 0.02 -0.19 1.27 -2.30 -0.49 0.00 0.00 175.26 173.58 1pn2 n PRO 97 N 4.56 1.84 -0.08 0.39 -0.02 -1.26 -1.09 135.00 139.34 1pn2 n PRO 97 Ca -0.19 0.66 -0.10 0.00 -2.02 0.00 0.00 63.50 61.84 1pn2 n PRO 97 Cb 0.53 -2.41 -0.07 0.00 -0.02 0.00 0.00 33.50 31.53 1pn2 n PRO 97 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1pn2 n ILE 98 N -0.46 0.86 -3.56 4.25 5.41 -0.25 -4.61 119.36 121.00 1pn2 n ILE 98 Ca 0.08 -0.33 -0.15 0.00 1.00 0.00 0.00 62.75 63.34 1pn2 n ILE 98 Cb 0.41 -1.03 -0.06 0.00 -0.71 0.00 0.00 39.64 38.25 1pn2 n ILE 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1pn2 s ALA 99 N -2.30 -1.81 -0.05 -1.39 0.00 -1.04 -1.18 121.76 113.98 1pn2 s ALA 99 Ca -0.20 1.54 0.02 0.00 0.00 0.00 0.00 51.96 53.31 1pn2 s ALA 99 Cb 0.05 -0.43 0.02 0.00 0.00 0.00 0.00 23.12 22.76 1pn2 s ALA 99 CO 0.35 -0.35 -0.08 0.95 0.00 0.00 0.00 175.76 176.63 1pn2 s THR 100 N -0.79 0.83 -0.30 0.00 -4.23 0.20 -1.37 115.64 109.98 1pn2 s THR 100 Ca -0.06 -0.30 -0.01 0.00 -1.18 0.00 0.00 61.69 60.14 1pn2 s THR 100 Cb -0.01 -0.79 0.10 0.00 1.34 0.00 0.00 72.50 73.13 1pn2 s THR 100 CO 0.06 0.29 0.09 -0.89 -0.54 0.00 0.00 174.62 173.63 1pn2 s THR 101 N 0.78 0.84 0.22 3.99 2.01 -0.48 -1.12 115.64 121.88 1pn2 s THR 101 Ca -0.13 -1.32 -0.31 0.00 0.31 0.00 0.00 61.69 60.23 1pn2 s THR 101 Cb -0.15 -1.61 -0.12 0.00 0.01 0.00 0.00 72.50 70.63 1pn2 s THR 101 CO 0.02 -0.63 1.67 -2.84 -0.69 0.00 0.00 174.62 172.14 1pn2 s PRO 102 N 1.64 4.14 -0.31 4.92 0.02 -1.26 -1.68 135.00 142.47 1pn2 s PRO 102 Ca 0.09 2.56 -0.03 0.00 0.02 0.00 0.00 61.00 63.64 1pn2 s PRO 102 Cb -0.17 -3.07 0.11 0.00 0.02 0.00 0.00 34.50 31.38 1pn2 s PRO 102 CO -0.24 -0.70 0.14 0.15 -0.33 0.00 0.00 177.00 176.02 1pn2 s LYS 103 N 0.73 0.37 7.36 5.54 1.02 -0.45 -4.95 119.74 129.36 1pn2 s LYS 103 Ca 0.71 -0.80 0.00 0.00 0.02 0.00 0.00 55.97 55.90 1pn2 s LYS 103 Cb -0.48 -1.36 0.00 0.00 -0.52 0.00 0.00 37.83 35.47 1pn2 s LYS 103 CO 0.36 -1.05 0.00 0.41 -0.92 0.00 0.00 175.35 174.15 1pn2 n GLY 104 N 4.92 4.19 0.65 -3.33 0.00 -1.26 -1.34 105.19 109.03 1pn2 n GLY 104 Ca -0.02 0.16 0.12 0.00 0.00 0.00 0.00 46.02 46.28 1pn2 n GLY 104 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1pn2 n THR 105 N 0.00 0.15 -4.46 2.61 -2.24 -1.26 -4.95 114.28 104.14 1pn2 n THR 105 Ca 0.00 -0.38 -0.29 0.00 -2.27 0.00 0.00 64.05 61.11 1pn2 n THR 105 Cb 0.00 0.62 -0.07 0.00 -2.10 0.00 0.00 70.33 68.78 1pn2 n THR 105 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1pn2 s ASN 106 N -1.75 4.22 0.00 3.42 0.01 -0.45 -1.07 114.94 119.32 1pn2 s ASN 106 Ca 0.34 -1.41 0.01 0.00 -0.71 0.00 0.00 52.86 51.09 1pn2 s ASN 106 Cb 0.20 0.10 -0.00 0.00 0.41 0.00 0.00 41.25 41.95 1pn2 s ASN 106 CO 0.30 -0.74 -0.03 0.54 -1.51 0.00 0.00 177.10 175.66 1pn2 s VAL 107 N -2.77 0.19 -0.31 1.60 0.11 -0.53 -1.34 120.40 117.36 1pn2 s VAL 107 Ca 0.24 -0.20 -0.09 0.00 -2.93 0.00 0.00 61.98 59.00 1pn2 s VAL 107 Cb 0.03 -0.19 -0.01 0.00 -1.53 0.00 0.00 36.38 34.69 1pn2 s VAL 107 CO 0.13 -0.01 0.14 -0.69 -3.33 0.00 0.00 175.10 171.34 1pn2 s VAL 108 N -0.22 4.50 -0.13 2.04 1.01 -0.68 -0.82 120.40 126.10 1pn2 s VAL 108 Ca -0.01 -0.45 -0.02 0.00 0.00 0.00 0.00 61.98 61.50 1pn2 s VAL 108 Cb -0.02 -3.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.05 1pn2 s VAL 108 CO -0.00 0.08 -0.07 -0.51 0.00 0.00 0.00 175.10 174.60 1pn2 s ILE 109 N 1.60 3.64 -0.32 2.22 2.07 0.08 -1.39 121.20 129.10 1pn2 s ILE 109 Ca 0.04 -0.46 -0.11 0.00 -1.41 0.00 0.00 60.65 58.72 1pn2 s ILE 109 Cb -0.17 -2.56 -0.01 0.00 0.13 0.00 0.00 42.46 39.84 1pn2 s ILE 109 CO 0.06 0.52 0.18 -0.69 -1.91 0.00 0.00 174.94 173.10 1pn2 s VAL 110 N 0.17 4.89 -0.20 4.00 1.01 -0.47 0.03 120.40 129.83 1pn2 s VAL 110 Ca -0.03 -0.30 -0.03 0.00 0.00 0.00 0.00 61.98 61.61 1pn2 s VAL 110 Cb -0.14 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 32.74 1pn2 s VAL 110 CO 0.03 0.06 -0.05 -2.28 0.00 0.00 0.00 175.10 172.86 1pn2 s HIS 111 N 1.66 2.95 0.11 5.22 2.46 0.76 -1.10 115.29 127.35 1pn2 s HIS 111 Ca 0.05 -0.82 0.03 0.00 0.47 0.00 0.00 55.06 54.80 1pn2 s HIS 111 Cb -0.17 -2.06 -0.04 0.00 -0.13 0.00 0.00 32.58 30.18 1pn2 s HIS 111 CO 0.08 -0.45 0.12 0.20 -2.47 0.00 0.00 174.74 172.22 1pn2 s GLY 112 N 1.22 1.92 0.03 1.59 0.00 -0.25 -1.22 107.32 110.62 1pn2 s GLY 112 Ca 0.03 -1.06 -0.02 0.00 0.00 0.00 0.00 44.72 43.67 1pn2 s GLY 112 CO -0.01 -1.05 0.01 -1.35 0.00 0.00 0.00 173.10 170.69 1pn2 s SER 113 N -2.66 0.30 -0.08 1.64 1.04 0.65 -1.14 113.70 113.45 1pn2 s SER 113 Ca 0.31 -0.67 0.00 0.00 0.48 0.00 0.00 55.95 56.07 1pn2 s SER 113 Cb -0.12 0.17 0.02 0.00 0.10 0.00 0.00 66.02 66.20 1pn2 s SER 113 CO 0.23 -0.46 -0.06 -0.54 0.98 0.00 0.00 173.24 173.39 1pn2 s LYS 114 N -2.61 1.19 -0.20 4.02 1.02 -0.33 -1.09 119.74 121.74 1pn2 s LYS 114 Ca -0.05 -0.17 -0.03 0.00 0.02 0.00 0.00 55.97 55.73 1pn2 s LYS 114 Cb -0.01 -1.22 -0.01 0.00 -0.52 0.00 0.00 37.83 36.07 1pn2 s LYS 114 CO -0.05 -0.16 -0.06 -1.12 -0.92 0.00 0.00 175.35 173.04 1pn2 s SER 115 N 1.33 4.22 0.30 2.83 0.01 0.02 -0.89 113.70 121.52 1pn2 s SER 115 Ca -0.04 -0.38 0.11 0.00 1.31 0.00 0.00 55.95 56.95 1pn2 s SER 115 Cb -0.14 -1.71 -0.05 0.00 0.21 0.00 0.00 66.02 64.33 1pn2 s SER 115 CO -0.03 0.01 -0.12 0.68 0.41 0.00 0.00 173.24 174.20 1pn2 s VAL 116 N 1.26 2.58 -0.09 3.43 -7.23 0.03 -1.07 120.40 119.32 1pn2 s VAL 116 Ca 0.03 -2.23 -0.30 0.00 -1.81 0.00 0.00 61.98 57.67 1pn2 s VAL 116 Cb -0.14 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.23 1pn2 s VAL 116 CO -0.02 -0.32 1.45 -0.62 -0.31 0.00 0.00 175.10 175.27 1pn2 s ASP 117 N -3.59 6.82 0.54 4.85 2.15 0.36 -0.62 116.67 127.18 1pn2 s ASP 117 Ca 0.31 1.99 0.30 0.00 0.43 0.00 0.00 52.55 55.59 1pn2 s ASP 117 Cb -0.03 -2.54 1.52 0.00 -0.30 0.00 0.00 42.92 41.57 1pn2 s ASP 117 CO 0.17 -0.82 2.08 -1.13 -0.17 0.00 0.00 175.17 175.29 1pn2 h ASN 118 N 8.68 0.00 -0.32 -0.34 -1.24 -1.61 0.48 115.58 121.23 1pn2 h ASN 118 Ca -0.34 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.67 1pn2 h ASN 118 Cb 1.15 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.20 1pn2 h ASN 118 CO 0.95 0.09 0.00 1.17 -1.29 0.00 0.00 177.43 178.35 1pn2 n LYS 119 N -3.46 2.20 0.00 6.67 4.81 -1.26 -4.62 118.16 122.50 1pn2 n LYS 119 Ca -0.01 -1.99 0.00 0.00 -0.87 0.00 0.00 58.31 55.43 1pn2 n LYS 119 Cb 0.24 -1.37 0.00 0.00 0.02 0.00 0.00 35.03 33.92 1pn2 n LYS 119 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1pn2 n SER 120 N 1.01 0.00 0.00 3.14 3.41 -1.08 -5.04 113.62 115.06 1pn2 n SER 120 Ca 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1pn2 n SER 120 Cb 0.48 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 1pn2 n SER 120 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pn2 n GLY 121 N 0.00 0.86 3.68 5.00 0.00 0.16 -4.99 105.19 109.91 1pn2 n GLY 121 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1pn2 n GLY 121 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1pn2 s GLU 122 N -0.16 4.18 0.02 1.61 2.12 -1.26 -4.56 118.70 120.65 1pn2 s GLU 122 Ca 0.00 2.40 -0.30 0.00 0.36 0.00 0.00 54.97 57.43 1pn2 s GLU 122 Cb 0.00 -3.70 -0.08 0.00 0.26 0.00 0.00 34.13 30.61 1pn2 s GLU 122 CO 0.00 -0.79 1.89 -1.17 -0.54 0.00 0.00 175.26 174.65 1pn2 s LEU 123 N 2.99 4.41 -0.07 2.70 2.96 -1.26 -0.49 118.68 129.93 1pn2 s LEU 123 Ca 0.77 2.59 -0.08 0.00 -0.22 0.00 0.00 54.13 57.19 1pn2 s LEU 123 Cb -0.41 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 42.72 1pn2 s LEU 123 CO 0.34 -1.02 -0.15 -0.38 -1.32 0.00 0.00 176.35 173.81 1pn2 n ILE 124 N 5.48 0.80 -4.36 6.68 2.08 -0.23 -3.82 119.36 125.98 1pn2 n ILE 124 Ca 0.19 0.29 -0.27 0.00 0.56 0.00 0.00 62.75 63.52 1pn2 n ILE 124 Cb 0.41 -1.83 -0.10 0.00 -0.75 0.00 0.00 39.64 37.37 1pn2 n ILE 124 CO 0.00 0.00 0.00 -0.31 0.56 0.00 0.00 176.55 176.80 1pn2 s TYR 125 N -1.95 2.46 0.04 1.39 2.02 -0.94 -0.74 117.35 119.63 1pn2 s TYR 125 Ca -0.13 -0.29 0.05 0.00 -0.37 0.00 0.00 57.07 56.34 1pn2 s TYR 125 Cb 0.02 -1.20 -0.02 0.00 -0.40 0.00 0.00 41.96 40.35 1pn2 s TYR 125 CO 0.19 0.51 -0.15 -1.54 -1.57 0.00 0.00 175.55 172.99 1pn2 s SER 126 N -2.78 1.82 0.03 2.29 1.04 0.20 -0.80 113.70 115.50 1pn2 s SER 126 Ca 0.23 -0.46 0.06 0.00 0.48 0.00 0.00 55.95 56.26 1pn2 s SER 126 Cb -0.08 -0.13 -0.02 0.00 0.10 0.00 0.00 66.02 65.89 1pn2 s SER 126 CO 0.13 0.06 -0.18 0.20 0.98 0.00 0.00 173.24 174.43 1pn2 s ASN 127 N -1.12 2.10 -0.19 7.02 0.01 -0.25 -0.58 114.94 121.93 1pn2 s ASN 127 Ca 0.03 -0.47 -0.01 0.00 -0.71 0.00 0.00 52.86 51.71 1pn2 s ASN 127 Cb -0.08 -0.17 0.05 0.00 0.41 0.00 0.00 41.25 41.46 1pn2 s ASN 127 CO 0.01 0.12 -0.03 -1.61 -1.51 0.00 0.00 177.10 174.08 1pn2 s GLU 128 N -1.05 1.29 -0.16 -0.60 2.02 0.16 -0.25 118.70 120.12 1pn2 s GLU 128 Ca 0.05 -0.60 -0.07 0.00 0.02 0.00 0.00 54.97 54.37 1pn2 s GLU 128 Cb -0.08 -2.14 -0.04 0.00 0.10 0.00 0.00 34.13 31.96 1pn2 s GLU 128 CO 0.01 -0.51 0.09 0.00 0.02 0.00 0.00 175.26 174.87 1pn2 s ALA 129 N 1.63 3.58 -0.23 5.21 0.00 -0.36 -0.91 121.76 130.68 1pn2 s ALA 129 Ca -0.01 -0.71 -0.08 0.00 0.00 0.00 0.00 51.96 51.16 1pn2 s ALA 129 Cb -0.16 -1.93 -0.04 0.00 0.00 0.00 0.00 23.12 20.99 1pn2 s ALA 129 CO -0.07 0.35 0.09 0.99 0.00 0.00 0.00 175.76 177.11 1pn2 s THR 130 N -0.17 4.64 -0.07 0.00 2.01 -0.23 -0.17 115.64 121.64 1pn2 s THR 130 Ca 0.09 -0.07 0.03 0.00 0.31 0.00 0.00 61.69 62.04 1pn2 s THR 130 Cb -0.12 -3.15 -0.02 0.00 0.01 0.00 0.00 72.50 69.22 1pn2 s THR 130 CO 0.01 0.37 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.85 1pn2 s TYR 131 N 1.19 2.72 -0.25 4.92 2.02 0.11 -1.38 117.35 126.68 1pn2 s TYR 131 Ca 0.05 -0.29 -0.05 0.00 -0.37 0.00 0.00 57.07 56.40 1pn2 s TYR 131 Cb -0.14 -1.68 -0.01 0.00 -0.40 0.00 0.00 41.96 39.72 1pn2 s TYR 131 CO 0.04 0.08 0.02 0.12 -1.57 0.00 0.00 175.55 174.24 1pn2 s PHE 132 N -0.45 3.04 -0.19 2.71 5.36 0.77 -0.74 117.98 128.48 1pn2 s PHE 132 Ca 0.06 -0.79 0.01 0.00 -0.96 0.00 0.00 56.93 55.24 1pn2 s PHE 132 Cb -0.12 -2.18 0.03 0.00 -0.34 0.00 0.00 43.02 40.42 1pn2 s PHE 132 CO 0.02 -0.50 -0.15 0.42 -1.46 0.00 0.00 175.22 173.56 1pn2 s ILE 133 N 1.52 1.85 0.37 3.12 1.01 -0.00 -0.30 121.20 128.78 1pn2 s ILE 133 Ca 0.05 -1.01 -0.25 0.00 0.00 0.00 0.00 60.65 59.44 1pn2 s ILE 133 Cb -0.15 -1.81 -0.09 0.00 0.01 0.00 0.00 42.46 40.42 1pn2 s ILE 133 CO 0.00 0.33 1.07 -0.13 0.00 0.00 0.00 174.94 176.21 1pn2 s ARG 134 N 1.33 4.26 -1.22 2.79 1.81 -0.94 -1.46 118.95 125.53 1pn2 s ARG 134 Ca 0.01 1.62 -0.05 0.00 -1.72 0.00 0.00 55.73 55.59 1pn2 s ARG 134 Cb -0.15 -2.71 -0.01 0.00 -0.45 0.00 0.00 34.95 31.63 1pn2 s ARG 134 CO -0.10 -0.08 0.79 0.09 -0.68 0.00 0.00 175.30 175.32 1pn2 n ASN 135 N 0.24 -2.96 -3.94 0.23 3.02 -0.91 -4.78 115.26 106.15 1pn2 n ASN 135 Ca 0.03 -0.81 -0.10 0.00 -0.03 0.00 0.00 54.58 53.68 1pn2 n ASN 135 Cb 0.48 -4.28 -0.12 0.00 -0.61 0.00 0.00 39.78 35.25 1pn2 n ASN 135 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pn2 s GLN 137 N -0.99 1.78 0.18 0.00 1.11 -0.99 -3.64 119.66 117.11 1pn2 s GLN 137 Ca -0.11 -1.33 -0.24 0.00 0.01 0.00 0.00 55.36 53.70 1pn2 s GLN 137 Cb -0.07 -2.04 0.05 0.00 -1.01 0.00 0.00 33.01 29.95 1pn2 s GLN 137 CO -0.01 0.44 0.78 0.00 0.01 0.00 0.00 175.29 176.51 1pn2 s ALA 138 N -1.51 -1.51 0.44 6.09 0.00 -1.26 -1.82 121.76 122.19 1pn2 s ALA 138 Ca 0.21 0.18 -0.23 0.00 0.00 0.00 0.00 51.96 52.13 1pn2 s ALA 138 Cb -0.09 0.74 -0.08 0.00 0.00 0.00 0.00 23.12 23.69 1pn2 s ALA 138 CO 0.12 -0.93 1.08 -0.51 0.00 0.00 0.00 175.76 175.52 1pn2 s ASP 139 N -2.82 6.46 -0.99 0.00 1.01 -1.26 -4.59 116.67 114.48 1pn2 s ASP 139 Ca 0.08 2.08 -0.23 0.00 0.71 0.00 0.00 52.55 55.19 1pn2 s ASP 139 Cb -0.03 -2.58 0.06 0.00 1.01 0.00 0.00 42.92 41.38 1pn2 s ASP 139 CO -0.01 -0.70 1.39 0.21 0.21 0.00 0.00 175.17 176.27 1pn2 s ASN 140 N -1.63 6.50 0.05 0.27 2.47 -1.26 -4.36 114.94 116.97 1pn2 s ASN 140 Ca 0.62 -1.48 0.03 0.00 0.42 0.00 0.00 52.86 52.44 1pn2 s ASN 140 Cb -0.22 -2.54 -0.02 0.00 -1.45 0.00 0.00 41.25 37.01 1pn2 s ASN 140 CO 0.27 -1.46 -0.09 -0.54 -3.72 0.00 0.00 177.10 171.56 1pn2 s LYS 141 N 4.67 0.57 -0.23 0.43 1.02 -0.27 -5.02 119.74 120.92 1pn2 s LYS 141 Ca 0.43 -0.79 0.01 0.00 0.02 0.00 0.00 55.97 55.64 1pn2 s LYS 141 Cb -0.01 -0.37 0.06 0.00 -0.52 0.00 0.00 37.83 36.98 1pn2 s LYS 141 CO -0.09 0.07 -0.06 0.08 -0.92 0.00 0.00 175.35 174.44 1pn2 s VAL 142 N -1.37 1.50 -0.05 3.17 1.01 -1.26 -0.63 120.40 122.77 1pn2 s VAL 142 Ca -0.09 -1.16 0.13 0.00 0.00 0.00 0.00 61.98 60.86 1pn2 s VAL 142 Cb -0.10 -1.75 -0.23 0.00 0.00 0.00 0.00 36.38 34.30 1pn2 s VAL 142 CO 0.01 -0.06 0.65 -1.22 0.00 0.00 0.00 175.10 174.47 1pn2 n TYR 143 N 4.69 0.98 -3.75 5.22 4.01 -0.33 -4.97 117.16 123.01 1pn2 n TYR 143 Ca -0.12 0.36 -0.12 0.00 -0.16 0.00 0.00 57.90 57.85 1pn2 n TYR 143 Cb 0.44 -1.18 -0.08 0.00 -0.31 0.00 0.00 39.34 38.21 1pn2 n TYR 143 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1pn2 s ALA 144 N -2.60 -0.73 0.63 -0.72 0.00 -0.96 -5.00 121.76 112.38 1pn2 s ALA 144 Ca -0.05 0.15 -0.15 0.00 0.00 0.00 0.00 51.96 51.91 1pn2 s ALA 144 Cb 0.08 0.22 -0.02 0.00 0.00 0.00 0.00 23.12 23.40 1pn2 s ALA 144 CO 0.83 -0.35 1.07 -0.51 0.00 0.00 0.00 175.76 176.80 1pn2 s ASP 145 N -1.76 5.50 0.04 0.00 1.01 -1.26 -4.81 116.67 115.38 1pn2 s ASP 145 Ca -0.09 1.85 0.08 0.00 0.71 0.00 0.00 52.55 55.11 1pn2 s ASP 145 Cb -0.03 -2.53 -0.03 0.00 1.01 0.00 0.00 42.92 41.34 1pn2 s ASP 145 CO -0.00 -1.36 -0.24 -0.13 0.21 0.00 0.00 175.17 173.65 1pn2 s ARG 146 N -4.21 1.91 0.47 8.23 0.52 -1.26 -5.12 118.95 119.49 1pn2 s ARG 146 Ca 0.64 -1.06 -0.24 0.00 -0.52 0.00 0.00 55.73 54.55 1pn2 s ARG 146 Cb -0.17 -2.05 -0.08 0.00 0.52 0.00 0.00 34.95 33.17 1pn2 s ARG 146 CO 0.41 0.53 1.27 -2.30 0.02 0.00 0.00 175.30 175.22 1pn2 n PRO 147 N 1.77 1.80 -0.33 3.54 -0.02 -1.26 -4.91 135.00 135.60 1pn2 n PRO 147 Ca -0.17 0.65 0.04 0.00 -2.02 0.00 0.00 63.50 62.00 1pn2 n PRO 147 Cb 0.52 -2.42 0.19 0.00 -0.02 0.00 0.00 33.50 31.77 1pn2 n PRO 147 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pn2 h ALA 148 N 1.81 1.33 -0.54 3.55 0.00 -2.00 -1.87 119.26 121.54 1pn2 h ALA 148 Ca -0.49 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.46 1pn2 h ALA 148 Cb 1.30 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1pn2 h ALA 148 CO 0.58 0.20 0.36 0.35 0.00 0.00 0.00 179.25 180.75 1pn2 h PHE 149 N 0.93 0.65 0.00 0.00 3.57 -1.96 -0.45 116.94 119.69 1pn2 h PHE 149 Ca 0.44 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.88 1pn2 h PHE 149 Cb 0.37 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 1pn2 h PHE 149 CO -0.03 0.39 -0.36 0.00 -2.23 0.00 0.00 178.31 176.09 1pn2 h ALA 150 N 1.67 1.36 -0.01 2.41 0.00 -1.70 -3.29 119.26 119.71 1pn2 h ALA 150 Ca 0.21 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1pn2 h ALA 150 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1pn2 h ALA 150 CO -0.05 0.45 -0.21 0.25 0.00 0.00 0.00 179.25 179.69 1pn2 n THR 151 N -4.04 0.00 -1.77 0.00 -2.24 -0.94 -4.97 114.28 100.31 1pn2 n THR 151 Ca -0.02 -0.40 -0.42 0.00 -2.27 0.00 0.00 64.05 60.95 1pn2 n THR 151 Cb 0.40 1.10 -0.03 0.00 -2.10 0.00 0.00 70.33 69.71 1pn2 n THR 151 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1pn2 s ASN 152 N -1.33 6.40 0.15 3.42 3.84 -0.22 -4.91 114.94 122.29 1pn2 s ASN 152 Ca 0.07 2.87 0.27 0.00 0.21 0.00 0.00 52.86 56.28 1pn2 s ASN 152 Cb 0.07 -2.61 0.92 0.00 -0.55 0.00 0.00 41.25 39.08 1pn2 s ASN 152 CO 0.24 -0.93 1.81 0.00 -2.79 0.00 0.00 177.10 175.43 1pn2 n GLN 153 N 3.35 0.19 -4.18 0.43 1.13 -1.26 -4.86 117.38 112.17 1pn2 n GLN 153 Ca 0.13 0.15 -0.30 0.00 -1.94 0.00 0.00 57.00 55.04 1pn2 n GLN 153 Cb 0.36 -1.71 -0.07 0.00 0.11 0.00 0.00 30.24 28.93 1pn2 n GLN 153 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1pn2 n PHE 154 N -2.04 -1.40 -1.94 1.08 3.72 -1.26 -4.32 117.46 111.29 1pn2 n PHE 154 Ca 0.06 0.63 -0.42 0.00 -0.05 0.00 0.00 57.45 57.67 1pn2 n PHE 154 Cb 0.40 -3.12 -0.03 0.00 -0.94 0.00 0.00 39.48 35.79 1pn2 n PHE 154 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1pn2 s LEU 155 N -7.24 4.37 0.10 4.37 1.43 -1.26 -4.05 118.68 116.40 1pn2 s LEU 155 Ca 0.03 2.58 -0.31 0.00 -1.03 0.00 0.00 54.13 55.40 1pn2 s LEU 155 Cb -0.01 -3.59 -0.10 0.00 0.03 0.00 0.00 46.19 42.52 1pn2 s LEU 155 CO 0.96 -0.83 1.79 0.00 0.23 0.00 0.00 176.35 178.50 1pn2 s ALA 156 N 1.48 3.73 0.79 4.21 0.00 -1.26 -4.94 121.76 125.78 1pn2 s ALA 156 Ca 0.71 1.38 -0.12 0.00 0.00 0.00 0.00 51.96 53.92 1pn2 s ALA 156 Cb -0.43 -3.75 0.07 0.00 0.00 0.00 0.00 23.12 19.02 1pn2 s ALA 156 CO 0.31 -1.21 1.15 -1.25 0.00 0.00 0.00 175.76 174.76 1pn2 s PRO 157 N 2.80 1.86 -1.39 0.00 0.04 -1.26 -4.87 135.00 132.18 1pn2 s PRO 157 Ca 0.79 1.51 -0.10 0.00 0.04 0.00 0.00 61.00 63.24 1pn2 s PRO 157 Cb -0.44 -1.83 0.09 0.00 0.04 0.00 0.00 34.50 32.36 1pn2 s PRO 157 CO 0.35 -2.00 2.20 1.63 0.04 0.00 0.00 177.00 179.22 1pn2 n LYS 158 N -3.38 3.53 -4.01 4.56 5.02 -1.26 -4.83 118.16 117.80 1pn2 n LYS 158 Ca 0.12 -3.06 -0.10 0.00 -2.02 0.00 0.00 58.31 53.24 1pn2 n LYS 158 Cb 0.52 -2.98 -0.04 0.00 -0.02 0.00 0.00 35.03 32.50 1pn2 n LYS 158 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1pn2 s ARG 159 N 1.26 1.69 0.42 1.97 1.70 -1.26 -5.15 118.95 119.58 1pn2 s ARG 159 Ca 0.48 -1.40 -0.26 0.00 -0.47 0.00 0.00 55.73 54.08 1pn2 s ARG 159 Cb 0.13 0.47 -0.09 0.00 -0.57 0.00 0.00 34.95 34.90 1pn2 s ARG 159 CO -0.05 -0.71 1.37 0.00 -1.08 0.00 0.00 175.30 174.83 1pn2 s ALA 160 N -3.63 3.28 0.35 7.88 0.00 -1.26 -4.96 121.76 123.42 1pn2 s ALA 160 Ca 0.24 1.36 -0.28 0.00 0.00 0.00 0.00 51.96 53.27 1pn2 s ALA 160 Cb -0.01 -3.54 -0.12 0.00 0.00 0.00 0.00 23.12 19.46 1pn2 s ALA 160 CO 0.12 -0.99 1.44 -2.30 0.00 0.00 0.00 175.76 174.03 1pn2 n PRO 161 N 0.04 2.49 0.20 0.00 -0.02 -1.26 -4.90 135.00 131.54 1pn2 n PRO 161 Ca 0.04 0.87 0.07 0.00 -2.02 0.00 0.00 63.50 62.47 1pn2 n PRO 161 Cb 0.42 -2.56 0.37 0.00 -0.02 0.00 0.00 33.50 31.71 1pn2 n PRO 161 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1pn2 h ASP 162 N 3.15 0.00 -4.60 2.55 3.32 -0.93 -3.46 116.42 116.45 1pn2 h ASP 162 Ca -0.49 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.42 1pn2 h ASP 162 Cb 1.25 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.58 1pn2 h ASP 162 CO 0.66 0.32 -0.43 -0.47 -1.72 0.00 0.00 179.24 177.60 1pn2 s TYR 163 N -3.58 -0.10 -0.07 4.55 5.04 -0.46 -5.01 117.35 117.70 1pn2 s TYR 163 Ca 0.01 0.20 -0.03 0.00 -2.44 0.00 0.00 57.07 54.80 1pn2 s TYR 163 Cb 0.10 0.03 0.04 0.00 0.35 0.00 0.00 41.96 42.48 1pn2 s TYR 163 CO 0.67 -0.26 0.16 -1.14 -1.34 0.00 0.00 175.55 173.65 1pn2 s GLN 164 N -0.88 0.10 -0.03 4.97 -0.44 -1.26 -0.71 119.66 121.41 1pn2 s GLN 164 Ca -0.10 0.42 -0.02 0.00 -2.50 0.00 0.00 55.36 53.17 1pn2 s GLN 164 Cb -0.05 -0.18 0.01 0.00 -1.64 0.00 0.00 33.01 31.15 1pn2 s GLN 164 CO 0.02 -0.18 0.07 0.54 0.50 0.00 0.00 175.29 176.23 1pn2 s VAL 165 N 1.34 -0.01 -0.09 1.34 0.11 -0.76 -5.01 120.40 117.32 1pn2 s VAL 165 Ca -0.08 0.02 -0.12 0.00 -2.93 0.00 0.00 61.98 58.88 1pn2 s VAL 165 Cb -0.11 -0.11 -0.05 0.00 -1.53 0.00 0.00 36.38 34.58 1pn2 s VAL 165 CO -0.06 0.01 0.29 -1.81 -3.33 0.00 0.00 175.10 170.20 1pn2 s ASP 166 N 0.17 6.56 -0.35 3.54 1.11 -1.26 -0.90 116.67 125.53 1pn2 s ASP 166 Ca -0.01 0.66 0.01 0.00 0.18 0.00 0.00 52.55 53.39 1pn2 s ASP 166 Cb -0.02 -2.18 0.11 0.00 1.07 0.00 0.00 42.92 41.90 1pn2 s ASP 166 CO -0.00 0.26 0.13 -0.69 1.18 0.00 0.00 175.17 176.04 1pn2 s VAL 167 N -0.48 1.35 0.31 -1.27 1.01 0.45 -4.98 120.40 116.79 1pn2 s VAL 167 Ca 0.19 -1.94 -0.30 0.00 0.00 0.00 0.00 61.98 59.93 1pn2 s VAL 167 Cb -0.14 -1.99 -0.11 0.00 0.00 0.00 0.00 36.38 34.13 1pn2 s VAL 167 CO 0.07 -0.72 1.58 -2.65 0.00 0.00 0.00 175.10 173.38 1pn2 n PRO 168 N 4.35 2.71 -3.66 2.72 -0.02 -1.26 -1.59 135.00 138.24 1pn2 n PRO 168 Ca 0.02 0.96 -0.38 0.00 -2.02 0.00 0.00 63.50 62.08 1pn2 n PRO 168 Cb 0.40 -2.74 -0.12 0.00 -0.02 0.00 0.00 33.50 31.02 1pn2 n PRO 168 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1pn2 s VAL 169 N -0.24 4.67 0.38 -1.45 1.01 0.81 -4.92 120.40 120.66 1pn2 s VAL 169 Ca 0.62 -0.25 -0.26 0.00 0.00 0.00 0.00 61.98 62.08 1pn2 s VAL 169 Cb -0.49 -3.31 -0.11 0.00 0.00 0.00 0.00 36.38 32.47 1pn2 s VAL 169 CO 0.52 0.16 1.17 -0.24 0.00 0.00 0.00 175.10 176.71 1pn2 n SER 170 N 4.99 2.09 0.27 3.32 2.88 -1.26 -1.04 113.62 124.86 1pn2 n SER 170 Ca -0.14 1.13 0.18 0.00 -1.33 0.00 0.00 58.87 58.70 1pn2 n SER 170 Cb 0.50 -1.43 0.89 0.00 -0.75 0.00 0.00 64.21 63.42 1pn2 n SER 170 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1pn2 h GLU 171 N 2.05 0.00 -0.38 -1.46 4.57 -1.87 -2.29 114.58 115.19 1pn2 h GLU 171 Ca -0.45 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 1pn2 h GLU 171 Cb 1.31 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.90 1pn2 h GLU 171 CO 0.60 0.00 0.00 -0.25 -1.18 0.00 0.00 179.01 178.18 1pn2 n ASP 172 N -3.26 3.24 -0.21 1.04 8.00 -1.26 -4.59 116.55 119.52 1pn2 n ASP 172 Ca -0.00 -2.16 -0.09 0.00 0.71 0.00 0.00 54.79 53.24 1pn2 n ASP 172 Cb 0.34 -0.31 0.03 0.00 -0.02 0.00 0.00 41.12 41.16 1pn2 n ASP 172 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1pn2 h LEU 173 N 2.29 1.05 -1.50 0.64 5.85 -1.77 -2.29 115.31 119.57 1pn2 h LEU 173 Ca 0.00 -0.31 0.08 0.00 0.84 0.00 0.00 57.88 58.49 1pn2 h LEU 173 Cb 0.89 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.60 1pn2 h LEU 173 CO 0.04 1.10 0.43 0.00 -0.34 0.00 0.00 178.44 179.68 1pn2 h ALA 174 N 1.00 1.84 -0.26 1.25 0.00 -1.84 0.19 119.26 121.44 1pn2 h ALA 174 Ca 0.17 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1pn2 h ALA 174 Cb 0.58 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1pn2 h ALA 174 CO 0.03 0.04 -0.08 0.00 0.00 0.00 0.00 179.25 179.25 1pn2 h ALA 175 N 1.66 1.39 0.04 0.00 0.00 -1.68 -1.58 119.26 119.08 1pn2 h ALA 175 Ca 0.29 -0.22 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 1pn2 h ALA 175 Cb 0.36 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1pn2 h ALA 175 CO -0.09 0.42 -0.76 1.25 0.00 0.00 0.00 179.25 180.07 1pn2 h LEU 176 N 0.39 0.13 -0.85 0.00 5.85 -1.26 -3.39 115.31 116.18 1pn2 h LEU 176 Ca 0.08 -0.82 0.08 0.00 0.84 0.00 0.00 57.88 58.06 1pn2 h LEU 176 Cb 0.39 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.31 1pn2 h LEU 176 CO 0.02 1.32 0.51 0.22 -0.34 0.00 0.00 178.44 180.17 1pn2 h TYR 177 N -0.78 0.93 0.00 1.25 3.20 -0.52 -1.78 116.97 119.27 1pn2 h TYR 177 Ca -0.18 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.72 1pn2 h TYR 177 Cb 1.32 -0.29 -0.00 0.00 1.54 0.00 0.00 36.73 39.30 1pn2 h TYR 177 CO 0.18 0.43 -0.00 0.07 -1.64 0.00 0.00 178.16 177.21 1pn2 h ARG 178 N 0.89 0.00 0.00 1.82 0.11 -1.48 0.19 114.38 115.91 1pn2 h ARG 178 Ca 0.39 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.47 1pn2 h ARG 178 Cb 0.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.34 1pn2 h ARG 178 CO -0.21 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.14 1pn2 n LEU 179 N -3.36 0.28 0.00 0.08 4.77 -0.67 -1.58 117.00 116.52 1pn2 n LEU 179 Ca -0.03 0.59 0.14 0.00 -0.03 0.00 0.00 56.01 56.67 1pn2 n LEU 179 Cb 0.08 -0.57 0.60 0.00 -2.33 0.00 0.00 43.42 41.20 1pn2 n LEU 179 CO 0.23 -0.50 0.95 -1.20 -1.33 0.00 0.00 177.39 175.54 1pn2 n SER 180 N -1.83 0.01 0.00 -1.43 7.64 0.05 -4.91 113.62 113.15 1pn2 n SER 180 Ca 0.02 0.50 0.00 0.00 1.01 0.00 0.00 58.87 60.40 1pn2 n SER 180 Cb 0.13 -0.50 0.00 0.00 -1.01 0.00 0.00 64.21 62.83 1pn2 n SER 180 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pn2 n GLY 181 N 1.43 1.96 3.44 0.23 0.00 -0.61 -5.01 105.19 106.63 1pn2 n GLY 181 Ca 0.07 -0.19 -0.43 0.00 0.00 0.00 0.00 46.02 45.46 1pn2 n GLY 181 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1pn2 s ASP 182 N 0.00 6.19 0.00 1.61 -1.08 -1.18 -4.87 116.67 117.34 1pn2 s ASP 182 Ca 0.00 -1.12 0.14 0.00 -0.52 0.00 0.00 52.55 51.05 1pn2 s ASP 182 Cb 0.00 -2.40 0.46 0.00 -1.46 0.00 0.00 42.92 39.53 1pn2 s ASP 182 CO 0.00 -1.37 1.36 0.54 0.52 0.00 0.00 175.17 176.22 1pn2 n ARG 183 N 7.40 1.76 -1.66 4.34 5.12 -1.26 -4.52 116.66 127.84 1pn2 n ARG 183 Ca -0.04 -1.17 -0.58 0.00 -1.93 0.00 0.00 57.85 54.14 1pn2 n ARG 183 Cb 0.45 -1.31 -0.07 0.00 -1.16 0.00 0.00 32.46 30.37 1pn2 n ARG 183 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1pn2 n ASN 184 N 0.42 1.77 0.12 0.55 2.85 -1.26 -4.80 115.26 114.91 1pn2 n ASN 184 Ca 0.13 1.11 0.10 0.00 -0.11 0.00 0.00 54.58 55.82 1pn2 n ASN 184 Cb 0.30 -1.10 0.48 0.00 1.24 0.00 0.00 39.78 40.70 1pn2 n ASN 184 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1pn2 n PRO 185 N 3.98 0.14 0.29 1.20 -0.04 -1.26 -2.12 135.00 137.19 1pn2 n PRO 185 Ca 0.24 0.50 0.15 0.00 -0.04 0.00 0.00 63.50 64.35 1pn2 n PRO 185 Cb 0.11 -1.85 0.90 0.00 -0.04 0.00 0.00 33.50 32.63 1pn2 n PRO 185 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1pn2 h LEU 186 N 0.00 0.00 -1.37 1.53 5.85 -1.87 0.30 115.31 119.75 1pn2 h LEU 186 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1pn2 h LEU 186 Cb 0.18 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.21 1pn2 h LEU 186 CO 0.00 0.00 -0.03 1.41 -0.34 0.00 0.00 178.44 179.48 1pn2 n HIS 187 N -3.88 0.00 0.00 1.25 8.25 -0.90 -1.88 115.22 118.05 1pn2 n HIS 187 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 1pn2 n HIS 187 Cb 0.10 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.20 1pn2 n HIS 187 CO 0.00 0.00 0.00 1.51 0.64 0.00 0.00 176.34 178.49 1pn2 n ILE 188 N 0.64 0.00 -3.43 1.59 0.13 -0.92 -4.66 119.36 112.72 1pn2 n ILE 188 Ca 0.16 0.00 -0.44 0.00 -1.10 0.00 0.00 62.75 61.38 1pn2 n ILE 188 Cb 0.47 0.00 -0.08 0.00 -0.84 0.00 0.00 39.64 39.18 1pn2 n ILE 188 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 1pn2 s ASP 189 N -1.52 6.08 0.46 9.51 -1.08 0.05 -4.96 116.67 125.21 1pn2 s ASP 189 Ca 0.00 -1.24 0.15 0.00 -0.52 0.00 0.00 52.55 50.94 1pn2 s ASP 189 Cb 0.00 -2.16 1.11 0.00 -1.46 0.00 0.00 42.92 40.41 1pn2 s ASP 189 CO 0.00 -0.59 2.03 -0.65 0.52 0.00 0.00 175.17 176.49 1pn2 h PRO 190 N 8.69 0.27 -0.30 4.34 0.11 -1.94 -1.26 132.00 141.91 1pn2 h PRO 190 Ca -0.28 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 1pn2 h PRO 190 Cb 1.11 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1pn2 h PRO 190 CO 0.83 0.18 0.05 -0.91 -0.21 0.00 0.00 178.00 177.94 1pn2 h ASN 191 N 0.28 0.48 -0.30 -2.05 2.35 -1.94 -0.24 115.58 114.15 1pn2 h ASN 191 Ca 0.19 -0.26 -0.02 0.00 -0.55 0.00 0.00 56.30 55.66 1pn2 h ASN 191 Cb 0.39 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 1pn2 h ASN 191 CO -0.04 0.61 0.11 0.15 -1.65 0.00 0.00 177.43 176.62 1pn2 h PHE 192 N 0.33 0.47 -0.18 1.19 3.57 -1.69 -0.15 116.94 120.49 1pn2 h PHE 192 Ca 0.09 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 1pn2 h PHE 192 Cb 0.33 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1pn2 h PHE 192 CO 0.02 0.47 0.05 0.00 -2.23 0.00 0.00 178.31 176.62 1pn2 h ALA 193 N 0.95 0.24 -0.22 2.41 0.00 -1.17 -0.50 119.26 120.96 1pn2 h ALA 193 Ca 0.10 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.70 1pn2 h ALA 193 Cb 0.21 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1pn2 h ALA 193 CO -0.01 -0.14 -0.56 0.87 0.00 0.00 0.00 179.25 179.41 1pn2 h LYS 194 N 0.11 0.67 -0.73 0.00 1.57 -1.03 -1.18 116.57 115.98 1pn2 h LYS 194 Ca 0.06 -0.43 0.15 0.00 -1.87 0.00 0.00 60.65 58.56 1pn2 h LYS 194 Cb 0.24 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.56 1pn2 h LYS 194 CO -0.00 1.05 0.49 0.78 -0.57 0.00 0.00 179.45 181.20 1pn2 h GLY 195 N 0.92 0.59 -1.62 3.86 0.00 -0.89 -0.29 103.07 105.64 1pn2 h GLY 195 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1pn2 h GLY 195 CO 0.11 0.05 0.00 0.00 0.00 0.00 0.00 176.54 176.70 1pn2 n ALA 196 N -2.54 2.75 -1.09 3.60 0.00 -0.21 -4.90 120.51 118.12 1pn2 n ALA 196 Ca 0.14 -0.70 -0.03 0.00 0.00 0.00 0.00 53.44 52.85 1pn2 n ALA 196 Cb 0.55 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.98 1pn2 n ALA 196 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1pn2 n LYS 197 N 0.38 -0.50 -3.34 0.00 4.76 -0.12 -5.01 118.16 114.32 1pn2 n LYS 197 Ca 0.12 0.42 -0.35 0.00 -2.87 0.00 0.00 58.31 55.63 1pn2 n LYS 197 Cb 0.45 -4.02 -0.06 0.00 -1.84 0.00 0.00 35.03 29.57 1pn2 n LYS 197 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1pn2 s PHE 198 N -1.96 3.60 0.44 2.13 0.08 -0.49 -5.00 117.98 116.78 1pn2 s PHE 198 Ca 0.00 1.08 0.10 0.00 0.12 0.00 0.00 56.93 58.23 1pn2 s PHE 198 Cb 0.00 -2.38 0.96 0.00 -0.57 0.00 0.00 43.02 41.03 1pn2 s PHE 198 CO 0.00 0.41 2.06 -1.35 -0.10 0.00 0.00 175.22 176.25 1pn2 h PRO 199 N 3.50 0.34 -2.31 0.24 0.11 -1.92 -3.20 132.00 128.77 1pn2 h PRO 199 Ca -0.48 -0.03 0.23 0.00 0.11 0.00 0.00 66.00 65.82 1pn2 h PRO 199 Cb 1.19 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 32.17 1pn2 h PRO 199 CO 0.66 0.26 0.68 -1.59 -0.21 0.00 0.00 178.00 177.80 1pn2 s LYS 200 N -5.25 0.98 0.40 1.05 -2.85 -1.26 -4.84 119.74 107.96 1pn2 s LYS 200 Ca -0.07 -0.62 -0.27 0.00 -1.00 0.00 0.00 55.97 54.01 1pn2 s LYS 200 Cb 0.17 0.28 -0.10 0.00 -2.06 0.00 0.00 37.83 36.12 1pn2 s LYS 200 CO 0.71 -0.46 1.46 -2.14 0.10 0.00 0.00 175.35 175.03 1pn2 s PRO 201 N -2.25 3.99 0.16 1.78 0.02 -1.26 -4.82 135.00 132.62 1pn2 s PRO 201 Ca 0.22 2.51 0.03 0.00 0.02 0.00 0.00 61.00 63.78 1pn2 s PRO 201 Cb -0.01 -2.88 -0.04 0.00 0.02 0.00 0.00 34.50 31.60 1pn2 s PRO 201 CO 0.03 -0.61 0.26 0.96 -0.33 0.00 0.00 177.00 177.31 1pn2 s ILE 202 N -1.15 5.16 0.38 2.83 -4.36 -0.79 -4.44 121.20 118.82 1pn2 s ILE 202 Ca 0.55 -0.78 -0.26 0.00 -0.26 0.00 0.00 60.65 59.90 1pn2 s ILE 202 Cb -0.45 -3.66 -0.09 0.00 1.25 0.00 0.00 42.46 39.51 1pn2 s ILE 202 CO 0.61 -0.11 1.12 -0.22 0.24 0.00 0.00 174.94 176.58 1pn2 s LEU 203 N -3.26 4.25 0.15 0.37 2.96 0.98 -4.03 118.68 120.11 1pn2 s LEU 203 Ca 0.34 2.25 -0.34 0.00 -0.22 0.00 0.00 54.13 56.15 1pn2 s LEU 203 Cb -0.11 -3.99 -0.14 0.00 0.50 0.00 0.00 46.19 42.45 1pn2 s LEU 203 CO 0.28 -0.52 1.56 1.41 -1.32 0.00 0.00 176.35 177.76 1pn2 n HIS 204 N 0.25 2.21 0.00 5.38 8.25 -1.26 -4.63 115.22 125.43 1pn2 n HIS 204 Ca 0.03 0.30 0.00 0.00 -0.26 0.00 0.00 57.72 57.79 1pn2 n HIS 204 Cb 0.47 -2.53 0.00 0.00 1.12 0.00 0.00 29.99 29.05 1pn2 n HIS 204 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1pn2 n GLY 205 N 3.36 0.05 1.96 -1.41 0.00 -1.26 -2.28 105.19 105.61 1pn2 n GLY 205 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1pn2 n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pn2 h THR 208 N 0.00 0.87 -0.05 0.00 2.02 -1.81 0.18 112.91 114.12 1pn2 h THR 208 Ca 0.00 -0.23 -0.09 0.00 0.77 0.00 0.00 66.41 66.85 1pn2 h THR 208 Cb 0.00 0.13 0.01 0.00 -1.74 0.00 0.00 68.15 66.54 1pn2 h THR 208 CO 0.00 0.12 -0.34 0.22 0.37 0.00 0.00 175.52 175.90 1pn2 h TYR 209 N 0.68 0.44 -0.42 3.16 5.03 -1.67 -0.88 116.97 123.31 1pn2 h TYR 209 Ca 0.41 -0.20 -0.03 0.00 2.58 0.00 0.00 58.73 61.49 1pn2 h TYR 209 Cb 0.63 -0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.83 1pn2 h TYR 209 CO -0.00 0.95 0.13 0.78 -1.32 0.00 0.00 178.16 178.70 1pn2 h GLY 210 N -0.20 0.71 0.97 1.82 0.00 -1.73 0.12 103.07 104.75 1pn2 h GLY 210 Ca -0.03 -0.42 0.01 0.00 0.00 0.00 0.00 47.33 46.89 1pn2 h GLY 210 CO 0.07 0.39 0.49 1.41 0.00 0.00 0.00 176.54 178.90 1pn2 h LEU 211 N 0.54 0.83 0.08 3.11 3.38 -0.50 0.19 115.31 122.93 1pn2 h LEU 211 Ca 0.14 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1pn2 h LEU 211 Cb 0.27 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1pn2 h LEU 211 CO -0.00 0.59 -0.04 0.28 0.09 0.00 0.00 178.44 179.36 1pn2 h SER 212 N 0.98 -0.09 -0.77 -0.43 0.02 -0.98 -1.72 113.55 110.57 1pn2 h SER 212 Ca 0.28 -0.05 0.09 0.00 -0.84 0.00 0.00 61.79 61.27 1pn2 h SER 212 Cb -0.08 0.02 -0.07 0.00 0.14 0.00 0.00 62.40 62.41 1pn2 h SER 212 CO -0.07 -0.01 0.42 0.00 -1.14 0.00 0.00 176.83 176.02 1pn2 h ALA 213 N 0.77 1.08 -0.30 3.77 0.00 0.09 -0.81 119.26 123.86 1pn2 h ALA 213 Ca -0.01 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1pn2 h ALA 213 Cb 0.13 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1pn2 h ALA 213 CO 0.02 0.03 -0.12 -0.22 0.00 0.00 0.00 179.25 178.96 1pn2 h LYS 214 N 0.70 0.61 -0.51 0.00 3.11 -0.53 -1.24 116.57 118.72 1pn2 h LYS 214 Ca 0.37 -0.26 -0.02 0.00 -2.81 0.00 0.00 60.65 57.93 1pn2 h LYS 214 Cb 0.36 -0.02 -0.02 0.00 -1.00 0.00 0.00 32.23 31.54 1pn2 h LYS 214 CO -0.25 0.83 0.23 0.00 -2.81 0.00 0.00 179.45 177.44 1pn2 h ALA 215 N 0.76 0.66 -0.76 5.00 0.00 -0.92 -1.75 119.26 122.26 1pn2 h ALA 215 Ca 0.07 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1pn2 h ALA 215 Cb 0.63 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1pn2 h ALA 215 CO 0.04 0.24 0.29 -0.07 0.00 0.00 0.00 179.25 179.74 1pn2 h LEU 216 N 0.68 1.05 -0.78 0.00 3.38 -0.99 -2.92 115.31 115.73 1pn2 h LEU 216 Ca 0.17 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1pn2 h LEU 216 Cb 0.15 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1pn2 h LEU 216 CO -0.02 0.94 0.30 0.40 0.09 0.00 0.00 178.44 180.15 1pn2 h ILE 217 N 1.11 1.26 -0.73 1.22 2.04 -0.77 0.12 117.51 121.76 1pn2 h ILE 217 Ca 0.25 -0.83 0.10 0.00 1.00 0.00 0.00 64.86 65.38 1pn2 h ILE 217 Cb 0.23 0.35 -0.05 0.00 -0.74 0.00 0.00 36.82 36.61 1pn2 h ILE 217 CO -0.02 0.34 0.48 0.44 0.00 0.00 0.00 178.15 179.39 1pn2 h ASP 218 N 1.13 0.55 0.06 1.72 3.32 -1.14 0.15 116.42 122.21 1pn2 h ASP 218 Ca 0.26 0.01 -0.31 0.00 0.02 0.00 0.00 57.03 57.01 1pn2 h ASP 218 Cb 0.23 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 1pn2 h ASP 218 CO -0.02 0.33 -1.70 1.17 -1.72 0.00 0.00 179.24 177.30 1pn2 n LYS 219 N -4.49 0.66 0.00 3.56 3.00 -1.10 -4.71 118.16 115.08 1pn2 n LYS 219 Ca 0.12 0.41 0.06 0.00 -0.00 0.00 0.00 58.31 58.89 1pn2 n LYS 219 Cb 0.35 -1.71 -0.03 0.00 0.00 0.00 0.00 35.03 33.64 1pn2 n LYS 219 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1pn2 n PHE 220 N -3.96 0.00 -0.96 5.64 3.72 0.42 -5.13 117.46 117.19 1pn2 n PHE 220 Ca -0.34 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.06 1pn2 n PHE 220 Cb 0.87 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.41 1pn2 n PHE 220 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pn2 n GLY 221 N 1.10 0.62 3.58 1.37 0.00 0.51 -4.98 105.19 107.39 1pn2 n GLY 221 Ca 0.04 -1.09 -0.09 0.00 0.00 0.00 0.00 46.02 44.88 1pn2 n GLY 221 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1pn2 s PHE 223 N 0.00 -0.31 -0.68 1.61 -0.12 -1.26 -4.28 117.98 112.95 1pn2 s PHE 223 Ca 0.00 0.49 0.06 0.00 -0.05 0.00 0.00 56.93 57.42 1pn2 s PHE 223 Cb 0.00 0.47 0.05 0.00 -0.63 0.00 0.00 43.02 42.91 1pn2 s PHE 223 CO 0.00 -0.30 0.70 0.27 -0.05 0.00 0.00 175.22 175.83 1pn2 n ASN 224 N 0.58 1.51 -3.82 1.98 0.23 -0.55 -4.80 115.26 110.39 1pn2 n ASN 224 Ca -0.08 -1.27 -0.12 0.00 -0.53 0.00 0.00 54.58 52.58 1pn2 n ASN 224 Cb 0.58 -0.01 -0.13 0.00 -2.08 0.00 0.00 39.78 38.15 1pn2 n ASN 224 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 1pn2 s GLU 225 N -0.49 0.15 -0.11 -3.83 2.02 -1.23 -0.52 118.70 114.69 1pn2 s GLU 225 Ca 0.07 0.19 -0.10 0.00 0.02 0.00 0.00 54.97 55.15 1pn2 s GLU 225 Cb 0.05 0.06 0.03 0.00 0.10 0.00 0.00 34.13 34.36 1pn2 s GLU 225 CO 0.07 -0.03 0.28 -1.50 0.02 0.00 0.00 175.26 174.11 1pn2 s ILE 226 N 0.13 -0.00 -0.05 -1.63 2.07 -0.50 -0.65 121.20 120.56 1pn2 s ILE 226 Ca -0.01 0.01 -0.04 0.00 -1.41 0.00 0.00 60.65 59.20 1pn2 s ILE 226 Cb -0.01 -0.40 0.02 0.00 0.13 0.00 0.00 42.46 42.19 1pn2 s ILE 226 CO -0.00 0.00 0.13 -0.75 -1.91 0.00 0.00 174.94 172.41 1pn2 s LYS 227 N 0.23 0.13 0.06 3.50 2.36 -0.62 -0.74 119.74 124.66 1pn2 s LYS 227 Ca -0.01 0.22 -0.19 0.00 -2.55 0.00 0.00 55.97 53.44 1pn2 s LYS 227 Cb -0.03 0.02 0.04 0.00 -1.05 0.00 0.00 37.83 36.81 1pn2 s LYS 227 CO -0.00 -0.05 0.45 0.00 1.55 0.00 0.00 175.35 177.30 1pn2 s ALA 228 N 0.30 -1.11 -0.11 3.13 0.00 -0.29 -1.29 121.76 122.38 1pn2 s ALA 228 Ca -0.02 0.37 -0.02 0.00 0.00 0.00 0.00 51.96 52.29 1pn2 s ALA 228 Cb -0.03 0.41 -0.03 0.00 0.00 0.00 0.00 23.12 23.47 1pn2 s ALA 228 CO -0.01 -0.50 -0.03 0.50 0.00 0.00 0.00 175.76 175.72 1pn2 s ARG 229 N -2.64 3.25 -0.29 0.00 3.52 -0.04 -1.75 118.95 121.00 1pn2 s ARG 229 Ca -0.04 -0.48 -0.22 0.00 -0.13 0.00 0.00 55.73 54.86 1pn2 s ARG 229 Cb -0.00 -2.82 -0.01 0.00 -1.56 0.00 0.00 34.95 30.56 1pn2 s ARG 229 CO -0.03 0.50 0.73 -0.06 -0.81 0.00 0.00 175.30 175.63 1pn2 s PHE 230 N -0.33 3.23 0.00 5.12 0.08 0.13 -1.42 117.98 124.79 1pn2 s PHE 230 Ca 0.06 0.80 0.00 0.00 0.12 0.00 0.00 56.93 57.91 1pn2 s PHE 230 Cb -0.12 -3.09 0.00 0.00 -0.57 0.00 0.00 43.02 39.24 1pn2 s PHE 230 CO 0.02 -0.49 0.34 0.25 -0.10 0.00 0.00 175.22 175.25 1pn2 n THR 231 N 5.42 0.00 -3.59 0.64 -2.24 -0.79 -4.85 114.28 108.86 1pn2 n THR 231 Ca 0.02 -0.46 -0.06 0.00 -2.27 0.00 0.00 64.05 61.28 1pn2 n THR 231 Cb 0.48 1.06 -0.04 0.00 -2.10 0.00 0.00 70.33 69.74 1pn2 n THR 231 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1pn2 s GLY 232 N -0.24 -0.22 0.58 3.38 0.00 -1.07 -4.80 107.32 104.96 1pn2 s GLY 232 Ca 0.00 1.95 -0.14 0.00 0.00 0.00 0.00 44.72 46.53 1pn2 s GLY 232 CO 0.00 0.80 1.02 -0.26 0.00 0.00 0.00 173.10 174.66 1pn2 s ILE 233 N -1.75 4.41 -0.02 0.90 -4.36 -1.26 -4.42 121.20 114.69 1pn2 s ILE 233 Ca 0.05 1.00 0.03 0.00 -0.26 0.00 0.00 60.65 61.47 1pn2 s ILE 233 Cb -0.01 -3.67 -0.00 0.00 1.25 0.00 0.00 42.46 40.03 1pn2 s ILE 233 CO -0.04 -0.81 -0.11 -0.69 0.24 0.00 0.00 174.94 173.53 1pn2 s VAL 234 N -2.80 0.91 -0.06 8.37 1.01 -1.26 -4.81 120.40 121.75 1pn2 s VAL 234 Ca 0.58 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 62.08 1pn2 s VAL 234 Cb -0.12 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.45 1pn2 s VAL 234 CO 0.41 0.27 0.03 -0.36 0.00 0.00 0.00 175.10 175.45 1pn2 s PHE 235 N -0.08 3.21 0.49 5.22 0.08 -1.26 -0.01 117.98 125.63 1pn2 s PHE 235 Ca 0.01 0.21 -0.24 0.00 0.12 0.00 0.00 56.93 57.04 1pn2 s PHE 235 Cb -0.06 -1.78 -0.07 0.00 -0.57 0.00 0.00 43.02 40.54 1pn2 s PHE 235 CO 0.00 0.51 1.41 -2.14 -0.10 0.00 0.00 175.22 174.90 1pn2 s PRO 236 N -1.14 3.43 0.00 0.24 0.02 -1.26 -1.85 135.00 134.45 1pn2 s PRO 236 Ca 0.16 2.37 0.00 0.00 0.02 0.00 0.00 61.00 63.55 1pn2 s PRO 236 Cb -0.12 -2.49 0.00 0.00 0.02 0.00 0.00 34.50 31.92 1pn2 s PRO 236 CO 0.06 -1.00 0.00 0.41 -0.33 0.00 0.00 177.00 176.13 1pn2 n GLY 237 N 0.64 2.70 3.89 0.52 0.00 -0.21 -4.68 105.19 108.06 1pn2 n GLY 237 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 1pn2 n GLY 237 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pn2 s GLU 238 N -0.86 2.37 -0.16 1.61 2.02 -0.77 -4.69 118.70 118.22 1pn2 s GLU 238 Ca 0.00 0.25 -0.02 0.00 0.02 0.00 0.00 54.97 55.23 1pn2 s GLU 238 Cb 0.00 -1.99 -0.01 0.00 0.10 0.00 0.00 34.13 32.23 1pn2 s GLU 238 CO 0.00 -1.33 -0.09 0.99 0.02 0.00 0.00 175.26 174.84 1pn2 s THR 239 N -3.47 3.23 0.11 3.63 2.01 -1.26 -0.13 115.64 119.75 1pn2 s THR 239 Ca 0.60 -0.58 -0.14 0.00 0.31 0.00 0.00 61.69 61.88 1pn2 s THR 239 Cb -0.11 -2.40 -0.07 0.00 0.01 0.00 0.00 72.50 69.93 1pn2 s THR 239 CO 0.50 0.49 0.51 -0.76 -0.69 0.00 0.00 174.62 174.67 1pn2 s LEU 240 N 0.71 4.39 -0.21 4.42 1.43 -0.62 -1.40 118.68 127.39 1pn2 s LEU 240 Ca -0.05 1.05 0.01 0.00 -1.03 0.00 0.00 54.13 54.11 1pn2 s LEU 240 Cb -0.15 -3.08 0.05 0.00 0.03 0.00 0.00 46.19 43.04 1pn2 s LEU 240 CO 0.02 0.17 -0.09 -0.60 0.23 0.00 0.00 176.35 176.07 1pn2 s ARG 241 N -1.71 1.96 -0.26 1.70 3.52 0.54 -0.42 118.95 124.29 1pn2 s ARG 241 Ca 0.34 -0.89 -0.20 0.00 -0.13 0.00 0.00 55.73 54.84 1pn2 s ARG 241 Cb -0.16 -2.47 -0.02 0.00 -1.56 0.00 0.00 34.95 30.75 1pn2 s ARG 241 CO 0.18 -0.47 0.63 0.08 -0.81 0.00 0.00 175.30 174.92 1pn2 s VAL 242 N 1.38 4.98 -0.14 7.11 1.01 -0.08 -0.26 120.40 134.40 1pn2 s VAL 242 Ca -0.02 1.13 -0.05 0.00 0.00 0.00 0.00 61.98 63.03 1pn2 s VAL 242 Cb -0.17 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 1pn2 s VAL 242 CO -0.08 0.02 0.04 -0.76 0.00 0.00 0.00 175.10 174.33 1pn2 s LEU 243 N 2.51 3.76 -0.01 3.92 1.43 -0.29 -1.83 118.68 128.17 1pn2 s LEU 243 Ca 0.26 0.13 0.01 0.00 -1.03 0.00 0.00 54.13 53.50 1pn2 s LEU 243 Cb -0.15 -1.91 0.00 0.00 0.03 0.00 0.00 46.19 44.16 1pn2 s LEU 243 CO 0.09 0.27 -0.02 0.00 0.23 0.00 0.00 176.35 176.91 1pn2 s ALA 244 N -0.19 0.22 -0.12 4.21 0.00 0.11 -1.13 121.76 124.86 1pn2 s ALA 244 Ca 0.07 -0.05 0.02 0.00 0.00 0.00 0.00 51.96 51.99 1pn2 s ALA 244 Cb -0.12 -0.10 0.01 0.00 0.00 0.00 0.00 23.12 22.91 1pn2 s ALA 244 CO 0.02 0.03 -0.17 -1.58 0.00 0.00 0.00 175.76 174.05 1pn2 s TRP 245 N 0.14 2.23 -0.64 0.00 0.51 -0.09 -0.16 118.94 120.93 1pn2 s TRP 245 Ca -0.01 -1.11 -0.27 0.00 -2.12 0.00 0.00 56.10 52.59 1pn2 s TRP 245 Cb -0.03 -1.58 0.01 0.00 -0.81 0.00 0.00 33.47 31.06 1pn2 s TRP 245 CO -0.00 -0.55 1.44 0.21 -0.51 0.00 0.00 176.95 177.53 1pn2 s LYS 246 N 1.00 3.15 -0.01 4.98 2.20 -1.26 -1.07 119.74 128.73 1pn2 s LYS 246 Ca -0.05 0.22 0.20 0.00 -0.36 0.00 0.00 55.97 55.98 1pn2 s LYS 246 Cb -0.15 -4.19 -0.25 0.00 -1.51 0.00 0.00 37.83 31.74 1pn2 s LYS 246 CO -0.03 -2.15 0.70 0.39 -0.36 0.00 0.00 175.35 173.90 1pn2 n GLU 247 N 9.01 0.54 -3.37 4.03 -0.58 -0.19 -4.97 120.64 125.10 1pn2 n GLU 247 Ca 0.10 -0.06 -0.09 0.00 -0.42 0.00 0.00 57.16 56.68 1pn2 n GLU 247 Cb 0.50 -1.45 -0.00 0.00 -0.57 0.00 0.00 31.44 29.92 1pn2 n GLU 247 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1pn2 n SER 248 N -1.72 -1.49 0.22 1.62 2.88 -1.11 -4.91 113.62 109.11 1pn2 n SER 248 Ca 0.01 -2.41 0.15 0.00 -1.33 0.00 0.00 58.87 55.30 1pn2 n SER 248 Cb 0.38 2.59 0.74 0.00 -0.75 0.00 0.00 64.21 67.18 1pn2 n SER 248 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1pn2 h ASP 249 N 1.60 0.00 0.00 -3.46 3.32 -2.03 -3.23 116.42 112.61 1pn2 h ASP 249 Ca -0.25 0.00 -0.37 0.00 0.02 0.00 0.00 57.03 56.43 1pn2 h ASP 249 Cb 0.98 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.46 1pn2 h ASP 249 CO 0.32 0.00 -2.39 0.47 -1.72 0.00 0.00 179.24 175.92 1pn2 n ASP 250 N -2.61 0.24 -3.85 6.45 8.00 -1.26 -4.88 116.55 118.64 1pn2 n ASP 250 Ca -0.01 -0.02 -0.24 0.00 0.71 0.00 0.00 54.79 55.24 1pn2 n ASP 250 Cb 0.14 0.84 -0.17 0.00 -0.02 0.00 0.00 41.12 41.91 1pn2 n ASP 250 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1pn2 s THR 251 N -2.49 0.67 -0.34 -3.53 2.01 -1.22 -0.28 115.64 110.46 1pn2 s THR 251 Ca -0.13 -0.09 -0.10 0.00 0.31 0.00 0.00 61.69 61.69 1pn2 s THR 251 Cb 0.06 -0.74 0.01 0.00 0.01 0.00 0.00 72.50 71.84 1pn2 s THR 251 CO 0.80 0.30 0.17 -0.63 -0.69 0.00 0.00 174.62 174.56 1pn2 s ILE 252 N 1.66 4.49 0.10 1.82 -1.09 -0.29 -1.02 121.20 126.88 1pn2 s ILE 252 Ca 0.02 -0.66 -0.22 0.00 -2.23 0.00 0.00 60.65 57.55 1pn2 s ILE 252 Cb -0.13 -3.39 -0.07 0.00 -1.58 0.00 0.00 42.46 37.29 1pn2 s ILE 252 CO -0.05 -0.07 0.66 -0.69 -1.23 0.00 0.00 174.94 173.57 1pn2 s VAL 253 N 1.57 4.60 0.19 2.92 1.01 -0.23 -1.11 120.40 129.35 1pn2 s VAL 253 Ca 0.03 1.44 -0.05 0.00 0.00 0.00 0.00 61.98 63.39 1pn2 s VAL 253 Cb -0.18 -4.01 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 1pn2 s VAL 253 CO 0.06 0.52 0.22 0.72 0.00 0.00 0.00 175.10 176.63 1pn2 s PHE 254 N -1.00 0.75 0.04 5.22 -0.71 -0.21 -0.92 117.98 121.16 1pn2 s PHE 254 Ca 0.32 -1.07 0.02 0.00 -1.04 0.00 0.00 56.93 55.16 1pn2 s PHE 254 Cb -0.21 -0.27 -0.02 0.00 -1.21 0.00 0.00 43.02 41.31 1pn2 s PHE 254 CO 0.22 -0.71 -0.07 -0.65 -1.34 0.00 0.00 175.22 172.67 1pn2 s GLN 255 N -4.06 0.48 -0.24 1.99 -0.21 -0.28 -3.74 119.66 113.59 1pn2 s GLN 255 Ca 0.27 -0.71 -0.01 0.00 0.02 0.00 0.00 55.36 54.94 1pn2 s GLN 255 Cb 0.05 -0.22 0.03 0.00 1.00 0.00 0.00 33.01 33.87 1pn2 s GLN 255 CO 0.07 0.03 -0.08 0.99 -2.12 0.00 0.00 175.29 174.18 1pn2 s THR 256 N -1.34 2.68 0.11 -0.19 2.01 0.22 -1.14 115.64 117.98 1pn2 s THR 256 Ca -0.11 -1.12 0.01 0.00 0.31 0.00 0.00 61.69 60.79 1pn2 s THR 256 Cb -0.10 -2.37 -0.04 0.00 0.01 0.00 0.00 72.50 70.00 1pn2 s THR 256 CO 0.00 0.20 0.25 -1.00 -0.69 0.00 0.00 174.62 173.37 1pn2 s HIS 257 N 1.29 3.49 -0.37 4.92 3.76 0.64 -0.55 115.29 128.47 1pn2 s HIS 257 Ca -0.01 0.17 -0.07 0.00 -0.15 0.00 0.00 55.06 55.00 1pn2 s HIS 257 Cb -0.17 -1.71 0.05 0.00 1.11 0.00 0.00 32.58 31.87 1pn2 s HIS 257 CO -0.05 0.55 0.17 0.08 -0.85 0.00 0.00 174.74 174.63 1pn2 s VAL 258 N -1.63 3.97 0.16 -0.90 1.01 -0.49 -0.34 120.40 122.18 1pn2 s VAL 258 Ca 0.35 -1.24 -0.15 0.00 0.00 0.00 0.00 61.98 60.93 1pn2 s VAL 258 Cb -0.12 -3.33 0.04 0.00 0.00 0.00 0.00 36.38 32.97 1pn2 s VAL 258 CO 0.28 -0.31 1.76 0.58 0.00 0.00 0.00 175.10 177.41 1pn2 h VAL 259 N 6.13 0.93 -0.61 2.92 2.07 -1.52 -0.53 116.25 125.62 1pn2 h VAL 259 Ca -0.23 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 1pn2 h VAL 259 Cb 1.08 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 1pn2 h VAL 259 CO 0.66 0.06 0.20 0.44 0.02 0.00 0.00 177.57 178.96 1pn2 h ASP 260 N 0.35 0.85 -0.01 0.57 5.19 -1.95 -3.11 116.42 118.32 1pn2 h ASP 260 Ca 0.18 -0.13 0.00 0.00 -0.62 0.00 0.00 57.03 56.45 1pn2 h ASP 260 Cb 0.12 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 39.41 1pn2 h ASP 260 CO -0.15 0.79 -0.23 0.54 -3.12 0.00 0.00 179.24 177.07 1pn2 n ARG 261 N -4.29 1.80 -2.03 3.56 1.74 -1.23 -5.01 116.66 111.21 1pn2 n ARG 261 Ca 0.05 -0.75 -0.08 0.00 -0.77 0.00 0.00 57.85 56.30 1pn2 n ARG 261 Cb 0.20 -1.17 -0.01 0.00 -1.02 0.00 0.00 32.46 30.47 1pn2 n ARG 261 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1pn2 n GLY 262 N 0.96 0.16 3.07 -0.13 0.00 -0.22 -5.02 105.19 104.01 1pn2 n GLY 262 Ca 0.05 -0.56 -0.19 0.00 0.00 0.00 0.00 46.02 45.32 1pn2 n GLY 262 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1pn2 n THR 263 N -3.84 0.00 -3.99 2.61 -2.24 -1.12 -4.95 114.28 100.75 1pn2 n THR 263 Ca -0.10 -1.67 -0.29 0.00 -2.27 0.00 0.00 64.05 59.72 1pn2 n THR 263 Cb 0.53 -0.30 -0.17 0.00 -2.10 0.00 0.00 70.33 68.30 1pn2 n THR 263 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1pn2 s ILE 264 N -2.07 1.45 -0.10 2.28 1.01 -1.26 -1.39 121.20 121.11 1pn2 s ILE 264 Ca 0.34 -0.59 -0.08 0.00 0.00 0.00 0.00 60.65 60.32 1pn2 s ILE 264 Cb -0.03 -1.40 -0.27 0.00 0.01 0.00 0.00 42.46 40.78 1pn2 s ILE 264 CO 0.21 0.41 0.43 0.00 0.00 0.00 0.00 174.94 175.99 1pn2 h ALA 265 N 8.08 0.37 -3.37 9.38 0.00 -1.04 -2.83 119.26 129.84 1pn2 h ALA 265 Ca -0.35 -1.34 -0.54 0.00 0.00 0.00 0.00 54.91 52.68 1pn2 h ALA 265 Cb 1.13 0.66 -0.34 0.00 0.00 0.00 0.00 17.79 19.24 1pn2 h ALA 265 CO 0.50 1.25 -0.82 0.42 0.00 0.00 0.00 179.25 180.59 1pn2 s ILE 266 N -2.56 1.26 0.23 0.00 -1.09 -0.75 -1.88 121.20 116.41 1pn2 s ILE 266 Ca -0.21 -0.54 0.00 0.00 -2.23 0.00 0.00 60.65 57.67 1pn2 s ILE 266 Cb 0.06 -1.15 -0.04 0.00 -1.58 0.00 0.00 42.46 39.76 1pn2 s ILE 266 CO 0.79 0.39 0.18 0.21 -1.23 0.00 0.00 174.94 175.27 1pn2 s ASN 267 N 0.75 0.44 -1.31 3.58 3.84 -0.51 -0.61 114.94 121.13 1pn2 s ASN 267 Ca -0.13 -1.44 -0.04 0.00 0.21 0.00 0.00 52.86 51.46 1pn2 s ASN 267 Cb -0.16 0.43 -0.00 0.00 -0.55 0.00 0.00 41.25 40.97 1pn2 s ASN 267 CO 0.03 -0.90 0.61 0.59 -2.79 0.00 0.00 177.10 174.64 1pn2 n ASN 268 N -0.54 -1.75 -4.10 -4.21 4.13 -1.26 -0.86 115.26 106.67 1pn2 n ASN 268 Ca 0.03 -0.93 -0.15 0.00 1.68 0.00 0.00 54.58 55.22 1pn2 n ASN 268 Cb 0.65 -3.57 -0.12 0.00 -1.54 0.00 0.00 39.78 35.21 1pn2 n ASN 268 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1pn2 s ALA 269 N -3.74 0.78 0.14 5.41 0.00 -1.25 -3.81 121.76 119.30 1pn2 s ALA 269 Ca 0.10 -0.86 -0.24 0.00 0.00 0.00 0.00 51.96 50.96 1pn2 s ALA 269 Cb -0.03 0.00 0.07 0.00 0.00 0.00 0.00 23.12 23.16 1pn2 s ALA 269 CO 0.85 0.03 0.70 0.00 0.00 0.00 0.00 175.76 177.34 1pn2 s ALA 270 N -1.43 -1.60 0.14 0.00 0.00 -0.41 -1.04 121.76 117.42 1pn2 s ALA 270 Ca -0.07 0.47 0.09 0.00 0.00 0.00 0.00 51.96 52.46 1pn2 s ALA 270 Cb -0.09 0.76 -0.04 0.00 0.00 0.00 0.00 23.12 23.75 1pn2 s ALA 270 CO 0.01 -0.81 -0.21 0.96 0.00 0.00 0.00 175.76 175.71 1pn2 s ILE 271 N -3.60 1.91 -0.23 0.00 -4.36 -0.26 -1.59 121.20 113.06 1pn2 s ILE 271 Ca 0.04 -1.79 -0.04 0.00 -0.26 0.00 0.00 60.65 58.60 1pn2 s ILE 271 Cb -0.02 -1.80 -0.00 0.00 1.25 0.00 0.00 42.46 41.88 1pn2 s ILE 271 CO -0.08 -0.15 -0.02 -0.75 0.24 0.00 0.00 174.94 174.18 1pn2 s LYS 272 N -2.39 3.32 0.41 0.37 2.20 0.17 -1.13 119.74 122.69 1pn2 s LYS 272 Ca 0.13 -0.67 -0.24 0.00 -0.36 0.00 0.00 55.97 54.83 1pn2 s LYS 272 Cb -0.08 -3.08 -0.08 0.00 -1.51 0.00 0.00 37.83 33.07 1pn2 s LYS 272 CO 0.06 -0.25 1.11 -0.51 -0.36 0.00 0.00 175.35 175.41 1pn2 s LEU 273 N 1.48 4.14 0.00 5.43 1.43 0.62 -1.49 118.68 130.29 1pn2 s LEU 273 Ca 0.05 2.20 0.10 0.00 -1.03 0.00 0.00 54.13 55.44 1pn2 s LEU 273 Cb -0.15 -4.13 0.59 0.00 0.03 0.00 0.00 46.19 42.52 1pn2 s LEU 273 CO -0.02 -0.64 1.03 1.33 0.23 0.00 0.00 176.35 178.28