#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r65 s TYR 2 N 0.00 3.82 0.00 0.00 5.04 -1.26 -5.03 117.35 119.92 1r65 s TYR 2 Ca 0.00 1.40 0.01 0.00 -2.44 0.00 0.00 57.07 56.03 1r65 s TYR 2 Cb 0.00 -2.59 -0.01 0.00 0.35 0.00 0.00 41.96 39.71 1r65 s TYR 2 CO 0.00 0.54 -0.03 -0.08 -1.34 0.00 0.00 175.55 174.64 1r65 s THR 3 N -1.17 0.24 -0.96 4.34 -1.32 -1.26 -5.02 115.64 110.49 1r65 s THR 3 Ca 0.33 -0.28 0.24 0.00 -1.21 0.00 0.00 61.69 60.76 1r65 s THR 3 Cb -0.20 -0.24 0.20 0.00 -1.51 0.00 0.00 72.50 70.75 1r65 s THR 3 CO 0.22 -0.03 1.76 0.35 -2.21 0.00 0.00 174.62 174.70 1r65 n THR 4 N 2.74 0.41 -3.22 5.08 -2.24 -1.26 -4.44 114.28 111.35 1r65 n THR 4 Ca -0.14 0.07 -0.02 0.00 -2.27 0.00 0.00 64.05 61.69 1r65 n THR 4 Cb 0.58 -0.70 -0.02 0.00 -2.10 0.00 0.00 70.33 68.09 1r65 n THR 4 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1r65 s PHE 5 N -3.02 -1.54 0.12 4.78 5.36 -1.26 -4.86 117.98 117.56 1r65 s PHE 5 Ca 0.11 0.09 -0.31 0.00 -0.96 0.00 0.00 56.93 55.85 1r65 s PHE 5 Cb 0.15 0.22 -0.11 0.00 -0.34 0.00 0.00 43.02 42.94 1r65 s PHE 5 CO 0.44 -1.15 1.84 -1.13 -1.46 0.00 0.00 175.22 173.76 1r65 n SER 6 N 4.35 4.04 0.00 6.13 3.41 -1.26 -4.87 113.62 125.42 1r65 n SER 6 Ca 0.11 0.99 0.15 0.00 -0.26 0.00 0.00 58.87 59.86 1r65 n SER 6 Cb 0.55 -1.54 0.89 0.00 -0.26 0.00 0.00 64.21 63.85 1r65 n SER 6 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1r65 n GLN 7 N 5.67 1.00 -3.19 4.33 1.13 -1.26 -4.75 117.38 120.32 1r65 n GLN 7 Ca 0.18 0.00 -0.39 0.00 -1.94 0.00 0.00 57.00 54.85 1r65 n GLN 7 Cb 0.37 -1.47 -0.05 0.00 0.11 0.00 0.00 30.24 29.20 1r65 n GLN 7 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1r65 s THR 8 N -2.00 5.00 -0.35 5.09 2.01 -1.26 -5.02 115.64 119.11 1r65 s THR 8 Ca 0.45 1.24 -0.29 0.00 0.31 0.00 0.00 61.69 63.40 1r65 s THR 8 Cb 0.21 -3.94 0.02 0.00 0.01 0.00 0.00 72.50 68.80 1r65 s THR 8 CO 0.35 0.36 1.09 -0.75 -0.69 0.00 0.00 174.62 174.98 1r65 s LYS 9 N 0.21 3.99 0.25 4.92 2.20 -1.26 -5.00 119.74 125.05 1r65 s LYS 9 Ca 0.32 0.97 0.06 0.00 -0.36 0.00 0.00 55.97 56.95 1r65 s LYS 9 Cb -0.17 -3.77 -0.05 0.00 -1.51 0.00 0.00 37.83 32.32 1r65 s LYS 9 CO 0.16 -1.01 -0.06 0.54 -0.36 0.00 0.00 175.35 174.63 1r65 s ASN 10 N 1.84 2.46 -0.53 1.43 6.03 -1.26 -5.10 114.94 119.81 1r65 s ASN 10 Ca 0.46 -1.17 -0.22 0.00 -1.03 0.00 0.00 52.86 50.91 1r65 s ASN 10 Cb -0.11 -0.11 0.05 0.00 -3.03 0.00 0.00 41.25 38.05 1r65 s ASN 10 CO 0.19 -0.36 0.78 -0.62 -2.03 0.00 0.00 177.10 175.06 1r65 s ASP 11 N -3.38 6.28 0.00 3.54 -1.08 -1.26 -4.91 116.67 115.86 1r65 s ASP 11 Ca 0.28 -0.63 0.13 0.00 -0.52 0.00 0.00 52.55 51.81 1r65 s ASP 11 Cb 0.04 -2.36 0.62 0.00 -1.46 0.00 0.00 42.92 39.76 1r65 s ASP 11 CO 0.10 -1.06 1.39 0.00 0.52 0.00 0.00 175.17 176.12 1r65 n GLN 12 N 6.82 0.09 0.12 4.34 6.02 -1.26 -1.82 117.38 131.69 1r65 n GLN 12 Ca -0.02 0.22 0.12 0.00 -0.01 0.00 0.00 57.00 57.30 1r65 n GLN 12 Cb 0.46 -1.50 0.08 0.00 1.02 0.00 0.00 30.24 30.31 1r65 n GLN 12 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1r65 h LEU 13 N 0.00 0.00 -1.11 1.08 3.38 -1.96 -3.34 115.31 113.36 1r65 h LEU 13 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1r65 h LEU 13 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1r65 h LEU 13 CO 0.00 0.02 -0.41 0.29 0.09 0.00 0.00 178.44 178.43 1r65 n LYS 14 N -2.62 1.37 -2.36 1.13 5.02 -0.76 -4.80 118.16 115.15 1r65 n LYS 14 Ca 0.02 -1.10 -0.32 0.00 -2.02 0.00 0.00 58.31 54.88 1r65 n LYS 14 Cb 0.52 -1.46 -0.03 0.00 -0.02 0.00 0.00 35.03 34.04 1r65 n LYS 14 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1r65 s GLU 15 N -2.38 3.85 0.78 1.97 0.41 -1.20 -5.06 118.70 117.08 1r65 s GLU 15 Ca 0.19 1.01 -0.12 0.00 -0.41 0.00 0.00 54.97 55.65 1r65 s GLU 15 Cb 0.18 -2.12 0.06 0.00 -1.78 0.00 0.00 34.13 30.47 1r65 s GLU 15 CO 0.53 -0.36 1.15 -1.25 -0.49 0.00 0.00 175.26 174.85 1r65 s PRO 16 N -4.02 2.19 0.24 0.39 0.04 -1.26 -4.92 135.00 127.65 1r65 s PRO 16 Ca 0.60 0.22 -0.06 0.00 0.04 0.00 0.00 61.00 61.80 1r65 s PRO 16 Cb -0.11 -1.97 0.24 0.00 0.04 0.00 0.00 34.50 32.70 1r65 s PRO 16 CO 0.31 -1.46 1.88 0.52 0.04 0.00 0.00 177.00 178.29 1r65 h MET 17 N -0.96 1.26 -5.29 4.56 2.86 -1.93 -3.38 114.93 112.04 1r65 h MET 17 Ca -0.46 -0.13 -0.38 0.00 -2.06 0.00 0.00 59.70 56.67 1r65 h MET 17 Cb 1.31 -0.26 -0.15 0.00 0.06 0.00 0.00 31.60 32.56 1r65 h MET 17 CO 0.65 0.90 -0.73 -0.06 1.06 0.00 0.00 176.91 178.73 1r65 s PHE 18 N -5.89 1.45 0.00 -0.22 0.08 -1.26 -0.92 117.98 111.22 1r65 s PHE 18 Ca -0.13 -0.66 0.00 0.00 0.12 0.00 0.00 56.93 56.26 1r65 s PHE 18 Cb 0.17 -0.71 0.00 0.00 -0.57 0.00 0.00 43.02 41.91 1r65 s PHE 18 CO 0.82 0.19 0.00 1.19 -0.10 0.00 0.00 175.22 177.33 1r65 n PHE 19 N -0.18 0.00 -0.76 0.36 3.72 0.46 -4.83 117.46 116.23 1r65 n PHE 19 Ca -0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.30 1r65 n PHE 19 Cb 0.60 -1.27 0.00 0.00 -0.94 0.00 0.00 39.48 37.87 1r65 n PHE 19 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1r65 n GLY 20 N -0.85 0.72 3.74 1.37 0.00 -1.26 -5.00 105.19 103.91 1r65 n GLY 20 Ca 0.00 -1.77 -0.41 0.00 0.00 0.00 0.00 46.02 43.84 1r65 n GLY 20 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1r65 s GLN 21 N 1.48 4.43 0.59 1.61 0.74 -1.26 -4.84 119.66 122.41 1r65 s GLN 21 Ca 0.00 2.00 -0.19 0.00 0.05 0.00 0.00 55.36 57.22 1r65 s GLN 21 Cb 0.00 -3.20 -0.05 0.00 1.10 0.00 0.00 33.01 30.86 1r65 s GLN 21 CO 0.00 -0.18 0.98 -2.30 -0.55 0.00 0.00 175.29 173.24 1r65 n PRO 22 N 2.42 0.94 -2.21 1.67 -0.02 -1.26 -4.52 135.00 132.02 1r65 n PRO 22 Ca 0.05 0.36 -0.41 0.00 -2.02 0.00 0.00 63.50 61.48 1r65 n PRO 22 Cb 0.43 -2.18 -0.03 0.00 -0.02 0.00 0.00 33.50 31.70 1r65 n PRO 22 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1r65 s VAL 23 N -1.50 3.15 0.00 -1.45 1.01 -1.25 -4.51 120.40 115.85 1r65 s VAL 23 Ca 0.75 0.97 0.00 0.00 0.00 0.00 0.00 61.98 63.71 1r65 s VAL 23 Cb -0.42 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.34 1r65 s VAL 23 CO 0.47 0.16 0.00 -0.46 0.00 0.00 0.00 175.10 175.27 1r65 n ASN 24 N 2.37 0.00 -4.71 3.32 0.23 -1.26 -4.41 115.26 110.80 1r65 n ASN 24 Ca 0.05 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.68 1r65 n ASN 24 Cb 0.43 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.10 1r65 n ASN 24 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1r65 s VAL 25 N 0.00 4.01 -0.54 3.53 1.01 -1.26 -4.95 120.40 122.19 1r65 s VAL 25 Ca 0.00 1.45 -0.21 0.00 0.00 0.00 0.00 61.98 63.23 1r65 s VAL 25 Cb 0.00 -3.93 0.06 0.00 0.00 0.00 0.00 36.38 32.51 1r65 s VAL 25 CO 0.00 0.12 0.76 0.00 0.00 0.00 0.00 175.10 175.98 1r65 s ALA 26 N 0.99 3.30 0.14 5.51 0.00 -1.26 -4.85 121.76 125.59 1r65 s ALA 26 Ca 0.58 -1.65 0.07 0.00 0.00 0.00 0.00 51.96 50.96 1r65 s ALA 26 Cb -0.30 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.26 1r65 s ALA 26 CO 0.30 -2.22 -0.17 -0.98 0.00 0.00 0.00 175.76 172.68 1r65 s ARG 27 N 3.15 1.15 -0.03 0.00 1.70 -1.26 -5.06 118.95 118.60 1r65 s ARG 27 Ca 0.20 -1.30 0.04 0.00 -0.47 0.00 0.00 55.73 54.20 1r65 s ARG 27 Cb -0.18 -1.19 0.06 0.00 -0.57 0.00 0.00 34.95 33.08 1r65 s ARG 27 CO 0.13 0.24 0.91 0.66 -1.08 0.00 0.00 175.30 176.17 1r65 n TYR 28 N 0.54 0.00 0.83 5.89 4.01 -1.26 -4.69 117.16 122.47 1r65 n TYR 28 Ca -0.15 -0.28 0.13 0.00 -0.16 0.00 0.00 57.90 57.44 1r65 n TYR 28 Cb 0.56 -0.06 0.43 0.00 -0.31 0.00 0.00 39.34 39.97 1r65 n TYR 28 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1r65 n ASP 29 N -0.37 0.42 -3.63 7.72 5.75 -1.26 -4.87 116.55 120.30 1r65 n ASP 29 Ca 0.03 0.35 -0.13 0.00 -0.01 0.00 0.00 54.79 55.03 1r65 n ASP 29 Cb 0.58 -0.37 -0.06 0.00 -1.03 0.00 0.00 41.12 40.24 1r65 n ASP 29 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1r65 s GLN 30 N -3.05 0.96 -0.00 0.11 -2.07 -1.26 -5.18 119.66 109.16 1r65 s GLN 30 Ca 0.11 -0.32 -0.19 0.00 -1.82 0.00 0.00 55.36 53.15 1r65 s GLN 30 Cb 0.16 0.43 0.03 0.00 -1.09 0.00 0.00 33.01 32.55 1r65 s GLN 30 CO 0.60 -0.34 0.40 1.14 -1.32 0.00 0.00 175.29 175.78 1r65 s GLN 31 N -2.47 0.81 0.07 9.60 0.00 -1.26 -4.92 119.66 121.49 1r65 s GLN 31 Ca -0.05 -0.17 -0.17 0.00 -0.00 0.00 0.00 55.36 54.97 1r65 s GLN 31 Cb -0.01 0.37 -0.13 0.00 0.00 0.00 0.00 33.01 33.23 1r65 s GLN 31 CO -0.02 -0.25 1.33 -0.22 0.00 0.00 0.00 175.29 176.13 1r65 h LYS 32 N 3.44 0.57 -4.33 9.60 3.64 -1.87 -3.41 116.57 124.21 1r65 h LYS 32 Ca -0.30 -0.36 -0.61 0.00 -1.27 0.00 0.00 60.65 58.11 1r65 h LYS 32 Cb 1.18 0.04 -0.38 0.00 -0.41 0.00 0.00 32.23 32.66 1r65 h LYS 32 CO 0.41 0.97 -0.78 0.71 -2.27 0.00 0.00 179.45 178.49 1r65 s TYR 33 N -4.06 2.50 0.47 1.91 2.02 -1.26 -5.01 117.35 113.92 1r65 s TYR 33 Ca -0.13 -1.90 0.16 0.00 -0.37 0.00 0.00 57.07 54.83 1r65 s TYR 33 Cb 0.07 -1.74 1.14 0.00 -0.40 0.00 0.00 41.96 41.03 1r65 s TYR 33 CO 0.81 -0.81 2.02 -0.44 -1.57 0.00 0.00 175.55 175.57 1r65 h ASP 34 N 7.93 0.22 -1.00 2.29 3.45 -2.00 -3.03 116.42 124.28 1r65 h ASP 34 Ca -0.16 0.00 0.20 0.00 0.43 0.00 0.00 57.03 57.51 1r65 h ASP 34 Cb 1.06 -0.04 -0.11 0.00 -0.56 0.00 0.00 39.33 39.68 1r65 h ASP 34 CO 0.43 0.14 0.61 -0.29 -1.57 0.00 0.00 179.24 178.56 1r65 h ILE 35 N 0.25 0.67 -0.11 0.35 6.09 -1.98 -1.20 117.51 121.57 1r65 h ILE 35 Ca 0.21 -0.24 -0.12 0.00 -1.37 0.00 0.00 64.86 63.33 1r65 h ILE 35 Cb 0.49 -0.09 -0.01 0.00 0.47 0.00 0.00 36.82 37.68 1r65 h ILE 35 CO -0.04 0.13 -0.48 -0.26 -3.07 0.00 0.00 178.15 174.43 1r65 h PHE 36 N 0.69 0.34 -0.33 2.19 0.04 -1.88 0.15 116.94 118.14 1r65 h PHE 36 Ca 0.58 -0.11 -0.17 0.00 2.80 0.00 0.00 57.97 61.08 1r65 h PHE 36 Cb 1.00 -0.07 -0.00 0.00 2.20 0.00 0.00 35.95 39.08 1r65 h PHE 36 CO -0.00 0.71 -0.44 1.49 -0.60 0.00 0.00 178.31 179.47 1r65 h GLU 37 N 0.23 0.88 -0.77 1.51 4.57 -1.44 -1.29 114.58 118.27 1r65 h GLU 37 Ca 0.01 -0.51 -0.05 0.00 -1.18 0.00 0.00 59.36 57.64 1r65 h GLU 37 Cb 0.93 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.52 1r65 h GLU 37 CO 0.08 1.15 0.29 0.87 -1.18 0.00 0.00 179.01 180.22 1r65 h LYS 38 N 0.68 1.15 -0.52 1.92 6.56 -1.00 -1.43 116.57 123.92 1r65 h LYS 38 Ca 0.04 -0.21 -0.10 0.00 -1.06 0.00 0.00 60.65 59.32 1r65 h LYS 38 Cb 1.04 -0.18 -0.02 0.00 -0.57 0.00 0.00 32.23 32.50 1r65 h LYS 38 CO 0.10 0.94 -0.07 -0.07 -2.06 0.00 0.00 179.45 178.30 1r65 h LEU 39 N 1.12 0.96 -0.08 2.94 3.38 -0.81 -1.21 115.31 121.62 1r65 h LEU 39 Ca 0.25 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1r65 h LEU 39 Cb 0.23 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1r65 h LEU 39 CO -0.02 1.07 0.05 0.40 0.09 0.00 0.00 178.44 180.03 1r65 h ILE 40 N 0.83 1.03 -0.63 1.22 2.04 -0.91 -0.72 117.51 120.38 1r65 h ILE 40 Ca 0.14 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.94 1r65 h ILE 40 Cb 0.62 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 1r65 h ILE 40 CO 0.04 0.03 0.41 -0.33 0.00 0.00 0.00 178.15 178.29 1r65 h GLU 41 N 0.09 0.84 -0.43 2.37 5.08 -1.15 -1.00 114.58 120.38 1r65 h GLU 41 Ca 0.03 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1r65 h GLU 41 Cb 0.00 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 1r65 h GLU 41 CO -0.01 0.57 0.19 0.87 -1.00 0.00 0.00 179.01 179.64 1r65 h LYS 42 N 0.86 0.62 -0.61 2.33 1.79 -1.05 -1.34 116.57 119.17 1r65 h LYS 42 Ca 0.23 -0.10 -0.01 0.00 -2.18 0.00 0.00 60.65 58.59 1r65 h LYS 42 Cb -0.08 -0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 30.44 1r65 h LYS 42 CO -0.05 0.55 0.36 0.37 -1.08 0.00 0.00 179.45 179.61 1r65 h GLN 43 N 0.55 0.84 -0.73 3.15 5.75 -0.82 -1.66 115.11 122.18 1r65 h GLN 43 Ca 0.14 -0.08 -0.02 0.00 -0.15 0.00 0.00 58.65 58.54 1r65 h GLN 43 Cb 0.15 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.49 1r65 h GLN 43 CO -0.02 0.61 0.38 -0.07 -2.65 0.00 0.00 178.83 177.09 1r65 h LEU 44 N 0.83 0.91 -1.63 -2.39 3.38 -0.96 -1.82 115.31 113.63 1r65 h LEU 44 Ca 0.22 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1r65 h LEU 44 Cb -0.00 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 1r65 h LEU 44 CO -0.04 0.75 -0.15 0.77 0.09 0.00 0.00 178.44 179.86 1r65 h SER 45 N 1.02 0.00 -0.02 -0.43 4.64 -0.57 -2.75 113.55 115.44 1r65 h SER 45 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1r65 h SER 45 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1r65 h SER 45 CO -0.04 0.15 0.00 0.49 -0.87 0.00 0.00 176.83 176.56 1r65 n PHE 46 N -3.51 0.01 -1.63 4.77 3.72 -0.69 -4.97 117.46 115.17 1r65 n PHE 46 Ca -0.01 -0.01 -0.55 0.00 -0.05 0.00 0.00 57.45 56.83 1r65 n PHE 46 Cb 0.31 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.78 1r65 n PHE 46 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1r65 n PHE 47 N 0.08 1.59 -4.10 1.38 7.35 -1.04 -4.97 117.46 117.75 1r65 n PHE 47 Ca 0.19 0.69 -0.09 0.00 -0.76 0.00 0.00 57.45 57.48 1r65 n PHE 47 Cb 0.33 -2.34 -0.10 0.00 0.35 0.00 0.00 39.48 37.73 1r65 n PHE 47 CO 0.00 0.00 0.00 1.67 -0.76 0.00 0.00 176.76 177.67 1r65 s TRP 48 N 1.51 0.67 -0.13 -5.13 1.48 -1.26 -5.13 118.94 110.94 1r65 s TRP 48 Ca 0.91 -1.12 0.01 0.00 -1.06 0.00 0.00 56.10 54.84 1r65 s TRP 48 Cb -1.06 -0.40 0.02 0.00 -1.16 0.00 0.00 33.47 30.87 1r65 s TRP 48 CO 0.56 -0.47 -0.15 1.03 -4.06 0.00 0.00 176.95 173.86 1r65 s ARG 49 N -3.98 2.26 0.24 3.25 0.52 -1.26 -5.04 118.95 114.94 1r65 s ARG 49 Ca 0.16 -0.56 -0.06 0.00 -0.52 0.00 0.00 55.73 54.76 1r65 s ARG 49 Cb 0.07 -2.01 0.45 0.00 0.52 0.00 0.00 34.95 33.98 1r65 s ARG 49 CO -0.04 -0.16 1.68 -1.35 0.02 0.00 0.00 175.30 175.45 1r65 h PRO 50 N 7.79 0.23 -0.39 3.54 0.11 -1.94 -1.78 132.00 139.56 1r65 h PRO 50 Ca -0.35 -0.01 0.11 0.00 0.11 0.00 0.00 66.00 65.86 1r65 h PRO 50 Cb 1.15 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1r65 h PRO 50 CO 0.51 0.16 0.47 0.93 -0.21 0.00 0.00 178.00 179.86 1r65 h GLU 51 N 0.24 0.00 0.00 1.05 3.07 -1.96 0.27 114.58 117.25 1r65 h GLU 51 Ca 0.41 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.27 1r65 h GLU 51 Cb 0.70 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.61 1r65 h GLU 51 CO -0.52 0.00 0.00 0.39 -1.40 0.00 0.00 179.01 177.48 1r65 n GLU 52 N -3.58 0.09 -3.39 2.33 -0.58 -0.67 -4.74 120.64 110.10 1r65 n GLU 52 Ca 0.07 0.21 -0.37 0.00 -0.42 0.00 0.00 57.16 56.64 1r65 n GLU 52 Cb 0.64 -1.64 -0.06 0.00 -0.57 0.00 0.00 31.44 29.81 1r65 n GLU 52 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1r65 s VAL 53 N -3.09 5.23 -0.31 2.62 1.01 0.08 -5.04 120.40 120.90 1r65 s VAL 53 Ca 0.09 0.80 -0.29 0.00 0.00 0.00 0.00 61.98 62.58 1r65 s VAL 53 Cb 0.13 -3.75 0.01 0.00 0.00 0.00 0.00 36.38 32.77 1r65 s VAL 53 CO 0.43 0.34 1.17 -0.62 0.00 0.00 0.00 175.10 176.42 1r65 s ASP 54 N 0.63 6.82 -0.13 3.32 3.68 -1.26 -4.87 116.67 124.86 1r65 s ASP 54 Ca 0.22 1.11 0.18 0.00 2.13 0.00 0.00 52.55 56.19 1r65 s ASP 54 Cb -0.14 -2.54 0.30 0.00 -1.45 0.00 0.00 42.92 39.08 1r65 s ASP 54 CO 0.08 -0.97 1.16 1.33 0.13 0.00 0.00 175.17 176.90 1r65 n VAL 55 N 6.03 1.88 0.32 1.11 0.24 -1.26 -4.32 118.33 122.32 1r65 n VAL 55 Ca 0.13 -2.17 0.21 0.00 -2.04 0.00 0.00 64.34 60.47 1r65 n VAL 55 Cb 0.47 -0.20 1.08 0.00 -1.47 0.00 0.00 33.84 33.72 1r65 n VAL 55 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1r65 h SER 56 N 0.15 0.00 0.04 -1.34 4.64 -1.92 -2.65 113.55 112.47 1r65 h SER 56 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1r65 h SER 56 Cb 1.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 1r65 h SER 56 CO 0.02 0.01 -1.46 -1.14 -0.87 0.00 0.00 176.83 173.39 1r65 n ARG 57 N -3.20 0.33 0.27 4.77 0.63 -1.26 -4.31 116.66 113.89 1r65 n ARG 57 Ca -0.02 -0.09 0.11 0.00 -0.92 0.00 0.00 57.85 56.93 1r65 n ARG 57 Cb 0.12 -1.52 0.74 0.00 0.45 0.00 0.00 32.46 32.25 1r65 n ARG 57 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1r65 h ASP 58 N 0.00 0.00 0.42 6.15 5.19 -1.80 -2.27 116.42 124.11 1r65 h ASP 58 Ca 0.00 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 1r65 h ASP 58 Cb 0.75 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.26 1r65 h ASP 58 CO 0.00 0.05 -0.20 -0.09 -3.12 0.00 0.00 179.24 175.88 1r65 h ARG 59 N 0.00 -0.54 -0.57 3.56 9.65 -1.72 -0.64 114.38 124.12 1r65 h ARG 59 Ca -0.00 0.04 -0.10 0.00 -1.10 0.00 0.00 59.98 58.82 1r65 h ARG 59 Cb 0.11 0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.79 1r65 h ARG 59 CO 0.01 -0.34 -0.02 0.97 2.80 0.00 0.00 179.97 183.38 1r65 h ILE 60 N -0.60 1.26 -0.18 1.20 6.09 -1.76 -1.76 117.51 121.77 1r65 h ILE 60 Ca -0.06 -1.16 0.02 0.00 -1.37 0.00 0.00 64.86 62.30 1r65 h ILE 60 Cb 0.45 0.85 -0.02 0.00 0.47 0.00 0.00 36.82 38.56 1r65 h ILE 60 CO 0.09 0.42 0.04 0.44 -3.07 0.00 0.00 178.15 176.07 1r65 h ASP 61 N 0.92 0.01 -0.80 2.19 5.19 -1.33 -1.11 116.42 121.48 1r65 h ASP 61 Ca 0.16 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.60 1r65 h ASP 61 Cb 0.57 0.04 -0.04 0.00 0.18 0.00 0.00 39.33 40.08 1r65 h ASP 61 CO 0.03 0.03 0.51 0.22 -3.12 0.00 0.00 179.24 176.91 1r65 h TYR 62 N 0.11 1.04 -0.37 4.55 3.20 -0.94 -2.64 116.97 121.92 1r65 h TYR 62 Ca 0.08 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.90 1r65 h TYR 62 Cb 0.08 -0.35 -0.02 0.00 1.54 0.00 0.00 36.73 37.98 1r65 h TYR 62 CO -0.14 0.68 -0.04 1.96 -1.64 0.00 0.00 178.16 178.98 1r65 h GLN 63 N 1.10 0.60 0.00 1.82 1.08 -0.87 -2.83 115.11 116.00 1r65 h GLN 63 Ca 0.29 -0.15 0.00 0.00 -1.45 0.00 0.00 58.65 57.34 1r65 h GLN 63 Cb -0.08 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.28 1r65 h GLN 63 CO -0.06 0.65 0.00 0.00 -0.95 0.00 0.00 178.83 178.47 1r65 h ALA 64 N 1.40 1.00 -2.88 3.87 0.00 -0.87 -3.46 119.26 118.31 1r65 h ALA 64 Ca 0.11 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.49 1r65 h ALA 64 Cb 0.42 0.00 0.10 0.00 0.00 0.00 0.00 17.79 18.31 1r65 h ALA 64 CO 0.02 0.00 0.57 -0.51 0.00 0.00 0.00 179.25 179.33 1r65 s LEU 65 N -5.72 3.96 0.87 0.00 1.43 -1.06 -4.99 118.68 113.18 1r65 s LEU 65 Ca 0.06 2.59 -0.10 0.00 -1.03 0.00 0.00 54.13 55.64 1r65 s LEU 65 Cb 0.08 -4.21 0.12 0.00 0.03 0.00 0.00 46.19 42.21 1r65 s LEU 65 CO 0.59 -1.23 1.12 -2.84 0.23 0.00 0.00 176.35 174.21 1r65 s PRO 66 N -2.74 1.38 0.27 1.29 0.02 -1.26 -4.71 135.00 129.25 1r65 s PRO 66 Ca 0.67 1.34 -0.02 0.00 0.02 0.00 0.00 61.00 63.00 1r65 s PRO 66 Cb -0.36 -1.78 0.41 0.00 0.02 0.00 0.00 34.50 32.79 1r65 s PRO 66 CO 0.43 -2.31 1.91 0.93 -0.33 0.00 0.00 177.00 177.63 1r65 h GLU 67 N -1.63 1.14 0.00 5.54 4.39 -1.97 -1.58 114.58 120.47 1r65 h GLU 67 Ca -0.44 -0.07 -0.05 0.00 0.34 0.00 0.00 59.36 59.13 1r65 h GLU 67 Cb 1.26 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 29.64 1r65 h GLU 67 CO 0.46 0.76 -0.26 1.12 -1.16 0.00 0.00 179.01 179.93 1r65 h HIS 68 N 1.18 0.00 0.14 4.33 2.07 -1.90 -1.90 115.15 119.07 1r65 h HIS 68 Ca 0.40 0.00 -0.28 0.00 -2.85 0.00 0.00 60.37 57.64 1r65 h HIS 68 Cb 0.08 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.07 1r65 h HIS 68 CO -0.00 0.26 -1.26 0.93 -3.07 0.00 0.00 177.93 174.79 1r65 h GLU 69 N 0.00 0.34 -0.83 5.12 5.08 -1.72 -2.13 114.58 120.44 1r65 h GLU 69 Ca -0.00 -0.56 0.02 0.00 -1.00 0.00 0.00 59.36 57.82 1r65 h GLU 69 Cb 0.71 0.20 -0.05 0.00 0.50 0.00 0.00 28.75 30.11 1r65 h GLU 69 CO 0.03 1.25 0.54 0.87 -1.00 0.00 0.00 179.01 180.71 1r65 h LYS 70 N 0.11 1.06 -0.21 2.33 1.57 -1.04 -0.76 116.57 119.61 1r65 h LYS 70 Ca -0.15 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.57 1r65 h LYS 70 Cb 1.97 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 34.03 1r65 h LYS 70 CO 0.21 0.70 0.13 1.25 -0.57 0.00 0.00 179.45 181.17 1r65 h HIS 71 N 1.09 0.24 -0.10 -1.35 2.76 -1.29 -0.74 115.15 115.75 1r65 h HIS 71 Ca 0.32 0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.50 1r65 h HIS 71 Cb -0.07 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 28.81 1r65 h HIS 71 CO -0.02 0.14 0.04 0.82 -1.30 0.00 0.00 177.93 177.61 1r65 h ILE 72 N 0.26 0.98 -0.03 6.26 2.04 -0.85 -1.05 117.51 125.12 1r65 h ILE 72 Ca 0.08 -0.03 -0.00 0.00 1.00 0.00 0.00 64.86 65.91 1r65 h ILE 72 Cb -0.01 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 36.95 1r65 h ILE 72 CO -0.03 0.02 0.02 0.15 0.00 0.00 0.00 178.15 178.30 1r65 h PHE 73 N 0.09 0.04 -0.27 1.37 3.57 -0.98 -2.53 116.94 118.22 1r65 h PHE 73 Ca 0.04 -0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.41 1r65 h PHE 73 Cb 0.02 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 1r65 h PHE 73 CO -0.10 0.10 -0.35 0.97 -2.23 0.00 0.00 178.31 176.70 1r65 h ILE 74 N -0.03 1.29 -0.61 1.41 6.09 -1.10 -1.51 117.51 123.05 1r65 h ILE 74 Ca 0.01 -1.49 -0.08 0.00 -1.37 0.00 0.00 64.86 61.92 1r65 h ILE 74 Cb 0.08 1.46 -0.02 0.00 0.47 0.00 0.00 36.82 38.80 1r65 h ILE 74 CO -0.00 0.48 0.05 0.28 -3.07 0.00 0.00 178.15 175.89 1r65 h SER 75 N 0.51 1.00 -0.35 2.19 0.02 -1.18 -0.33 113.55 115.41 1r65 h SER 75 Ca 0.05 -0.25 -0.11 0.00 -0.84 0.00 0.00 61.79 60.64 1r65 h SER 75 Cb 0.85 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 1r65 h SER 75 CO 0.07 1.02 -0.22 -1.13 -1.14 0.00 0.00 176.83 175.43 1r65 h ASN 76 N 0.96 0.79 -0.47 3.07 -1.24 -1.33 -2.34 115.58 115.01 1r65 h ASN 76 Ca 0.18 -0.43 -0.07 0.00 0.71 0.00 0.00 56.30 56.69 1r65 h ASN 76 Cb 0.48 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.29 1r65 h ASN 76 CO 0.02 1.05 0.04 0.25 -1.29 0.00 0.00 177.43 177.50 1r65 h LEU 77 N 0.54 0.83 -0.86 0.34 5.85 -1.02 -1.58 115.31 119.41 1r65 h LEU 77 Ca 0.07 -0.19 -0.06 0.00 0.84 0.00 0.00 57.88 58.53 1r65 h LEU 77 Cb 0.77 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 1r65 h LEU 77 CO 0.06 0.87 0.13 0.11 -0.34 0.00 0.00 178.44 179.28 1r65 h LYS 78 N 0.82 0.98 -0.40 1.25 1.57 -0.95 -1.04 116.57 118.80 1r65 h LYS 78 Ca 0.16 -0.23 -0.09 0.00 -1.87 0.00 0.00 60.65 58.62 1r65 h LYS 78 Cb 0.43 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1r65 h LYS 78 CO 0.02 0.89 -0.12 -0.92 -0.57 0.00 0.00 179.45 178.75 1r65 h TYR 79 N 0.94 0.90 -0.67 -1.35 3.20 -1.03 -1.52 116.97 117.43 1r65 h TYR 79 Ca 0.20 -0.20 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1r65 h TYR 79 Cb 0.36 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.38 1r65 h TYR 79 CO 0.02 0.93 0.41 1.96 -1.64 0.00 0.00 178.16 179.85 1r65 h GLN 80 N 0.61 0.91 -0.78 1.82 4.20 -1.04 -0.98 115.11 119.85 1r65 h GLN 80 Ca 0.10 -0.08 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 1r65 h GLN 80 Cb 0.65 -0.19 -0.04 0.00 0.30 0.00 0.00 27.48 28.20 1r65 h GLN 80 CO 0.04 0.64 0.47 1.15 -0.67 0.00 0.00 178.83 180.47 1r65 h THR 81 N 0.92 1.22 0.02 -0.54 2.02 -1.03 -2.02 112.91 113.49 1r65 h THR 81 Ca 0.24 -0.47 -0.00 0.00 0.77 0.00 0.00 66.41 66.95 1r65 h THR 81 Cb -0.04 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.50 1r65 h THR 81 CO -0.05 0.23 -0.01 0.25 0.37 0.00 0.00 175.52 176.31 1r65 h LEU 82 N 1.06 -0.02 -0.53 2.58 7.12 -0.81 -1.39 115.31 123.32 1r65 h LEU 82 Ca 0.28 -0.14 0.07 0.00 0.13 0.00 0.00 57.88 58.21 1r65 h LEU 82 Cb -0.04 0.01 -0.06 0.00 -0.53 0.00 0.00 40.66 40.04 1r65 h LEU 82 CO -0.05 0.13 0.23 -0.07 -0.13 0.00 0.00 178.44 178.54 1r65 h LEU 83 N -0.17 0.27 -0.79 2.25 3.38 -0.93 -1.40 115.31 117.92 1r65 h LEU 83 Ca -0.00 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1r65 h LEU 83 Cb 0.16 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1r65 h LEU 83 CO 0.00 0.18 -0.20 0.44 0.09 0.00 0.00 178.44 178.96 1r65 h ASP 84 N 0.43 0.00 -0.31 -0.43 3.32 -1.33 -0.77 116.42 117.34 1r65 h ASP 84 Ca 0.25 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.27 1r65 h ASP 84 Cb 0.24 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1r65 h ASP 84 CO -0.22 0.20 0.09 0.28 -1.72 0.00 0.00 179.24 177.86 1r65 h SER 85 N 0.00 0.46 -0.25 6.45 0.02 -0.18 0.27 113.55 120.31 1r65 h SER 85 Ca -0.00 -0.22 -0.09 0.00 -0.84 0.00 0.00 61.79 60.64 1r65 h SER 85 Cb 0.86 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.28 1r65 h SER 85 CO 0.03 0.55 -0.21 0.40 -1.14 0.00 0.00 176.83 176.46 1r65 h ILE 86 N 0.34 1.31 0.00 3.27 2.04 -1.26 -3.20 117.51 120.01 1r65 h ILE 86 Ca 0.10 -1.36 -0.01 0.00 1.00 0.00 0.00 64.86 64.59 1r65 h ILE 86 Cb 0.27 1.63 -0.00 0.00 -0.74 0.00 0.00 36.82 37.97 1r65 h ILE 86 CO -0.00 0.43 -0.03 1.56 0.00 0.00 0.00 178.15 180.10 1r65 h GLN 87 N 0.31 0.00 0.00 2.37 1.08 -1.03 -0.14 115.11 117.69 1r65 h GLN 87 Ca 0.05 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.17 1r65 h GLN 87 Cb 0.76 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.18 1r65 h GLN 87 CO 0.05 0.03 -0.34 0.78 -0.95 0.00 0.00 178.83 178.41 1r65 h GLY 88 N 1.77 0.00 0.00 3.46 0.00 -0.93 -3.39 103.07 103.98 1r65 h GLY 88 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 1r65 h GLY 88 CO 0.00 0.00 -1.45 -0.96 0.00 0.00 0.00 176.54 174.14 1r65 n ARG 89 N -3.33 1.30 -0.21 4.80 1.85 -1.07 -4.68 116.66 115.33 1r65 n ARG 89 Ca 0.01 0.03 -0.07 0.00 -1.00 0.00 0.00 57.85 56.82 1r65 n ARG 89 Cb 0.56 -1.16 0.03 0.00 -1.05 0.00 0.00 32.46 30.84 1r65 n ARG 89 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 1r65 h SER 90 N 0.00 0.72 -0.87 2.89 0.02 -1.21 -2.22 113.55 112.88 1r65 h SER 90 Ca -0.18 -0.08 0.07 0.00 -0.84 0.00 0.00 61.79 60.76 1r65 h SER 90 Cb 1.32 -0.18 -0.06 0.00 0.14 0.00 0.00 62.40 63.61 1r65 h SER 90 CO -0.01 0.59 0.54 -0.65 -1.14 0.00 0.00 176.83 176.15 1r65 h PRO 91 N 0.79 0.94 0.51 3.45 0.11 -1.80 0.12 132.00 136.11 1r65 h PRO 91 Ca 0.21 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.24 1r65 h PRO 91 Cb 0.02 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 30.92 1r65 h PRO 91 CO -0.04 0.62 -0.24 -0.91 -0.21 0.00 0.00 178.00 177.22 1r65 h ASN 92 N 0.96 -0.58 0.04 -2.05 2.35 -1.79 0.16 115.58 114.67 1r65 h ASN 92 Ca 0.39 -0.05 -0.10 0.00 -0.55 0.00 0.00 56.30 55.99 1r65 h ASN 92 Cb 0.20 0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 1r65 h ASN 92 CO -0.18 -0.30 -0.30 0.58 -1.65 0.00 0.00 177.43 175.58 1r65 h VAL 93 N -0.84 1.27 0.14 2.81 2.07 -1.26 -2.56 116.25 117.88 1r65 h VAL 93 Ca -0.07 -1.33 -0.35 0.00 0.82 0.00 0.00 66.70 65.78 1r65 h VAL 93 Cb 0.59 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1r65 h VAL 93 CO 0.11 0.41 -1.84 0.00 0.02 0.00 0.00 177.57 176.28 1r65 h ALA 94 N 1.34 0.32 0.10 1.67 0.00 -0.80 -3.43 119.26 118.46 1r65 h ALA 94 Ca 0.05 -1.28 -0.37 0.00 0.00 0.00 0.00 54.91 53.30 1r65 h ALA 94 Cb 0.71 0.62 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 1r65 h ALA 94 CO 0.05 1.15 -2.11 1.28 0.00 0.00 0.00 179.25 179.63 1r65 n LEU 95 N -3.60 2.72 -0.33 0.00 4.77 0.54 -4.50 117.00 116.60 1r65 n LEU 95 Ca -0.29 0.13 0.15 0.00 -0.03 0.00 0.00 56.01 55.97 1r65 n LEU 95 Cb 1.03 -1.07 0.34 0.00 -2.33 0.00 0.00 43.42 41.38 1r65 n LEU 95 CO 0.44 0.88 1.11 -0.07 -1.33 0.00 0.00 177.39 178.42 1r65 h LEU 96 N 0.06 0.53 0.00 2.23 4.07 -1.41 0.02 115.31 120.80 1r65 h LEU 96 Ca -0.46 0.14 0.00 0.00 0.08 0.00 0.00 57.88 57.64 1r65 h LEU 96 Cb 2.01 0.07 0.00 0.00 1.08 0.00 0.00 40.66 43.82 1r65 h LEU 96 CO 0.05 0.07 0.00 -2.65 -1.08 0.00 0.00 178.44 174.83 1r65 n PRO 97 N -4.95 0.33 0.00 1.13 -0.02 -1.26 -3.40 135.00 126.84 1r65 n PRO 97 Ca 0.24 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1r65 n PRO 97 Cb 0.69 -1.50 -0.00 0.00 -0.02 0.00 0.00 33.50 32.67 1r65 n PRO 97 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1r65 n LEU 98 N -1.23 0.28 -4.75 2.45 4.77 -0.04 -4.98 117.00 113.51 1r65 n LEU 98 Ca 0.10 -0.62 -0.40 0.00 -0.03 0.00 0.00 56.01 55.05 1r65 n LEU 98 Cb 0.13 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.17 1r65 n LEU 98 CO 0.14 0.07 0.71 -0.63 -1.33 0.00 0.00 177.39 176.34 1r65 s ILE 99 N -0.79 3.97 -0.22 -0.08 1.01 -1.02 -0.40 121.20 123.67 1r65 s ILE 99 Ca 0.00 1.87 0.02 0.00 0.00 0.00 0.00 60.65 62.54 1r65 s ILE 99 Cb 0.00 -4.19 0.03 0.00 0.01 0.00 0.00 42.46 38.31 1r65 s ILE 99 CO 0.02 0.40 0.72 -0.24 0.00 0.00 0.00 174.94 175.83 1r65 n SER 100 N 1.81 1.48 -4.08 3.58 2.88 -0.10 -3.95 113.62 115.24 1r65 n SER 100 Ca -0.00 -1.38 -0.23 0.00 -1.33 0.00 0.00 58.87 55.93 1r65 n SER 100 Cb 0.47 -0.01 -0.16 0.00 -0.75 0.00 0.00 64.21 63.76 1r65 n SER 100 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 1r65 s ILE 101 N -0.43 1.12 0.33 2.46 -4.36 -1.26 -4.61 121.20 114.45 1r65 s ILE 101 Ca 0.03 -0.56 0.04 0.00 -0.26 0.00 0.00 60.65 59.91 1r65 s ILE 101 Cb 0.02 -0.97 0.30 0.00 1.25 0.00 0.00 42.46 43.06 1r65 s ILE 101 CO 0.03 0.33 1.90 1.55 0.24 0.00 0.00 174.94 178.98 1r65 h PRO 102 N 6.23 0.83 -0.50 0.37 0.13 -1.88 -2.78 132.00 134.40 1r65 h PRO 102 Ca -0.33 -0.05 -0.09 0.00 -0.87 0.00 0.00 66.00 64.66 1r65 h PRO 102 Cb 1.17 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 32.09 1r65 h PRO 102 CO 0.48 0.55 -0.05 1.05 -0.23 0.00 0.00 178.00 179.81 1r65 h GLU 103 N 0.86 0.87 -0.15 0.86 9.09 -1.91 -2.21 114.58 121.98 1r65 h GLU 103 Ca 0.41 -0.27 -0.19 0.00 0.05 0.00 0.00 59.36 59.36 1r65 h GLU 103 Cb 0.42 -0.08 0.00 0.00 -1.65 0.00 0.00 28.75 27.44 1r65 h GLU 103 CO -0.17 0.90 -0.69 1.25 0.05 0.00 0.00 179.01 180.34 1r65 h LEU 104 N 0.79 0.73 0.13 3.06 5.85 -1.89 -1.16 115.31 122.83 1r65 h LEU 104 Ca 0.14 -0.45 -0.00 0.00 0.84 0.00 0.00 57.88 58.41 1r65 h LEU 104 Cb 0.54 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1r65 h LEU 104 CO 0.03 1.21 -0.10 -0.08 -0.34 0.00 0.00 178.44 179.17 1r65 h GLU 105 N 0.45 -0.23 -0.13 1.25 4.81 -1.35 0.32 114.58 119.69 1r65 h GLU 105 Ca -0.03 0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.12 1r65 h GLU 105 Cb 1.28 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.70 1r65 h GLU 105 CO 0.13 -0.15 -0.34 1.15 -0.73 0.00 0.00 179.01 179.07 1r65 h THR 106 N -0.24 1.28 -0.39 0.32 2.02 -1.42 -2.13 112.91 112.35 1r65 h THR 106 Ca -0.00 -1.36 -0.04 0.00 0.77 0.00 0.00 66.41 65.78 1r65 h THR 106 Cb 0.21 1.56 -0.02 0.00 -1.74 0.00 0.00 68.15 68.17 1r65 h THR 106 CO -0.01 0.41 0.08 -0.25 0.37 0.00 0.00 175.52 176.12 1r65 h TRP 107 N 0.23 0.68 -0.88 3.16 -0.00 -0.79 -0.49 115.95 117.85 1r65 h TRP 107 Ca 0.03 -0.09 0.01 0.00 -0.00 0.00 0.00 58.89 58.85 1r65 h TRP 107 Cb 0.72 -0.19 -0.05 0.00 -0.00 0.00 0.00 29.16 29.65 1r65 h TRP 107 CO 0.01 0.66 0.58 0.28 -0.00 0.00 0.00 178.44 179.98 1r65 h VAL 108 N 0.50 1.21 -0.33 2.65 2.07 -0.61 0.26 116.25 122.00 1r65 h VAL 108 Ca 0.12 -0.41 -0.12 0.00 0.82 0.00 0.00 66.70 67.11 1r65 h VAL 108 Cb 0.33 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 1r65 h VAL 108 CO 0.00 0.22 -0.30 -0.33 0.02 0.00 0.00 177.57 177.18 1r65 h GLU 109 N 1.18 0.70 -0.26 1.57 5.08 -1.18 -1.02 114.58 120.65 1r65 h GLU 109 Ca 0.33 -0.31 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 1r65 h GLU 109 Cb -0.11 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1r65 h GLU 109 CO -0.08 0.91 -0.14 1.15 -1.00 0.00 0.00 179.01 179.86 1r65 h THR 110 N 0.60 1.30 0.02 1.13 2.02 -0.54 -0.99 112.91 116.45 1r65 h THR 110 Ca 0.07 -1.24 0.01 0.00 0.77 0.00 0.00 66.41 66.02 1r65 h THR 110 Cb 0.81 1.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.76 1r65 h THR 110 CO 0.07 0.39 -0.06 -0.25 0.37 0.00 0.00 175.52 176.03 1r65 h TRP 111 N 0.28 -0.16 -0.84 3.16 7.01 -0.40 -0.56 115.95 124.45 1r65 h TRP 111 Ca 0.06 0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.08 1r65 h TRP 111 Cb 0.66 0.07 -0.05 0.00 -2.10 0.00 0.00 29.16 27.74 1r65 h TRP 111 CO 0.06 -0.10 0.54 0.00 -2.79 0.00 0.00 178.44 176.16 1r65 h ALA 112 N 0.86 1.09 -0.33 2.65 0.00 -1.15 -2.38 119.26 119.99 1r65 h ALA 112 Ca 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1r65 h ALA 112 Cb 0.14 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1r65 h ALA 112 CO -0.05 0.41 0.22 0.35 0.00 0.00 0.00 179.25 180.17 1r65 h PHE 113 N 1.08 0.41 0.00 0.00 3.57 -0.74 -1.69 116.94 119.57 1r65 h PHE 113 Ca 0.32 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.83 1r65 h PHE 113 Cb -0.05 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 38.55 1r65 h PHE 113 CO -0.02 0.26 -0.00 0.66 -2.23 0.00 0.00 178.31 176.98 1r65 h SER 114 N 0.45 0.00 0.54 0.41 4.64 -0.62 -0.48 113.55 118.49 1r65 h SER 114 Ca 0.12 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.30 1r65 h SER 114 Cb -0.05 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.03 1r65 h SER 114 CO -0.03 0.00 -0.66 -0.33 -0.87 0.00 0.00 176.83 174.94 1r65 h GLU 115 N 0.00 0.11 0.00 4.77 4.39 -0.88 -2.80 114.58 120.16 1r65 h GLU 115 Ca -0.00 -0.08 -0.07 0.00 0.34 0.00 0.00 59.36 59.55 1r65 h GLU 115 Cb 0.00 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 1r65 h GLU 115 CO 0.00 0.73 -0.32 1.79 -1.16 0.00 0.00 179.01 180.04 1r65 h THR 116 N 0.07 0.90 -0.35 1.13 1.35 -0.81 -1.25 112.91 113.96 1r65 h THR 116 Ca -0.01 -1.26 -0.16 0.00 -0.55 0.00 0.00 66.41 64.42 1r65 h THR 116 Cb 1.18 1.75 -0.01 0.00 -1.73 0.00 0.00 68.15 69.35 1r65 h THR 116 CO 0.09 0.32 -0.42 0.40 -0.25 0.00 0.00 175.52 175.65 1r65 h ILE 117 N 0.00 1.28 -0.34 6.82 1.08 -1.30 -1.38 117.51 123.66 1r65 h ILE 117 Ca -0.00 -1.60 -0.00 0.00 -0.39 0.00 0.00 64.86 62.86 1r65 h ILE 117 Cb 0.73 1.46 -0.02 0.00 -3.07 0.00 0.00 36.82 35.92 1r65 h ILE 117 CO 0.04 0.53 0.21 0.45 -0.69 0.00 0.00 178.15 178.69 1r65 h HIS 118 N 0.71 0.45 -0.99 1.37 3.86 -1.11 -0.36 115.15 119.08 1r65 h HIS 118 Ca 0.05 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.29 1r65 h HIS 118 Cb 1.01 -0.15 -0.06 0.00 1.06 0.00 0.00 27.41 29.28 1r65 h HIS 118 CO 0.06 0.32 0.65 0.77 0.86 0.00 0.00 177.93 180.59 1r65 h SER 119 N 0.44 1.09 -0.31 2.45 0.02 -1.11 -0.25 113.55 115.88 1r65 h SER 119 Ca 0.12 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 61.00 1r65 h SER 119 Cb -0.00 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.27 1r65 h SER 119 CO -0.02 0.75 -0.01 0.03 -1.14 0.00 0.00 176.83 176.44 1r65 h ARG 120 N 1.26 0.65 -0.45 3.45 3.08 -0.73 -2.70 114.38 118.94 1r65 h ARG 120 Ca 0.39 -0.16 -0.11 0.00 0.07 0.00 0.00 59.98 60.17 1r65 h ARG 120 Cb -0.02 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 1r65 h ARG 120 CO -0.12 0.68 -0.15 0.66 -1.07 0.00 0.00 179.97 179.97 1r65 h SER 121 N 0.62 0.86 -0.37 7.04 4.64 0.60 -2.22 113.55 124.72 1r65 h SER 121 Ca 0.13 -0.29 -0.06 0.00 -0.47 0.00 0.00 61.79 61.10 1r65 h SER 121 Cb 0.40 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.24 1r65 h SER 121 CO 0.02 1.01 0.02 1.88 -0.87 0.00 0.00 176.83 178.89 1r65 h TYR 122 N 0.76 0.77 -0.55 4.77 0.05 -0.92 -1.02 116.97 120.83 1r65 h TYR 122 Ca 0.12 -0.09 -0.07 0.00 0.05 0.00 0.00 58.73 58.73 1r65 h TYR 122 Cb 0.67 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 38.18 1r65 h TYR 122 CO 0.04 0.71 0.05 1.15 -1.05 0.00 0.00 178.16 179.06 1r65 h THR 123 N 0.69 1.26 -0.69 -2.88 2.02 -1.29 0.44 112.91 112.46 1r65 h THR 123 Ca 0.14 -1.02 0.04 0.00 0.77 0.00 0.00 66.41 66.34 1r65 h THR 123 Cb 0.40 0.85 -0.05 0.00 -1.74 0.00 0.00 68.15 67.61 1r65 h THR 123 CO 0.01 0.37 0.41 -0.74 0.37 0.00 0.00 175.52 175.94 1r65 h HIS 124 N 0.81 0.76 0.38 3.16 -0.00 -0.78 -0.40 115.15 119.10 1r65 h HIS 124 Ca 0.16 0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.54 1r65 h HIS 124 Cb 0.46 -0.24 0.00 0.00 -0.00 0.00 0.00 27.41 27.63 1r65 h HIS 124 CO 0.03 0.40 -0.18 0.82 -0.00 0.00 0.00 177.93 179.00 1r65 h ILE 125 N 0.78 0.43 -0.74 6.26 2.04 -0.95 -3.15 117.51 122.18 1r65 h ILE 125 Ca 0.29 -0.64 0.13 0.00 1.00 0.00 0.00 64.86 65.64 1r65 h ILE 125 Cb 0.10 0.65 -0.09 0.00 -0.74 0.00 0.00 36.82 36.75 1r65 h ILE 125 CO -0.14 0.09 0.31 0.40 0.00 0.00 0.00 178.15 178.80 1r65 h ILE 126 N -0.97 0.70 0.00 -0.67 2.04 -0.79 -0.71 117.51 117.11 1r65 h ILE 126 Ca -0.05 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1r65 h ILE 126 Cb 0.54 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 1r65 h ILE 126 CO 0.09 0.09 0.00 0.08 0.00 0.00 0.00 178.15 178.40 1r65 h ARG 127 N 0.48 0.00 -0.65 2.37 0.11 -1.16 -2.64 114.38 112.88 1r65 h ARG 127 Ca 0.40 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.48 1r65 h ARG 127 Cb 0.57 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.65 1r65 h ARG 127 CO -0.37 0.00 0.00 0.09 0.10 0.00 0.00 179.97 179.79 1r65 n ASN 128 N -2.68 4.33 0.00 0.08 4.13 -0.28 -4.49 115.26 116.34 1r65 n ASN 128 Ca 0.02 -2.36 0.00 0.00 1.68 0.00 0.00 54.58 53.92 1r65 n ASN 128 Cb 0.28 -0.54 0.00 0.00 -1.54 0.00 0.00 39.78 37.98 1r65 n ASN 128 CO 0.00 0.00 0.00 2.30 0.28 0.00 0.00 177.26 179.84 1r65 n ILE 129 N 1.09 0.00 0.00 2.41 -5.35 -1.01 -3.99 119.36 112.51 1r65 n ILE 129 Ca 0.24 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.72 1r65 n ILE 129 Cb 0.80 0.93 0.00 0.00 -1.74 0.00 0.00 39.64 39.63 1r65 n ILE 129 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 1r65 n VAL 130 N 0.00 0.00 0.00 7.28 0.24 -1.12 -4.90 118.33 119.83 1r65 n VAL 130 Ca 0.00 -0.12 0.00 0.00 -2.04 0.00 0.00 64.34 62.18 1r65 n VAL 130 Cb 0.00 0.60 0.00 0.00 -1.47 0.00 0.00 33.84 32.97 1r65 n VAL 130 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1r65 n ASN 131 N -1.25 0.00 -3.95 -1.34 5.03 -1.26 -4.77 115.26 107.72 1r65 n ASN 131 Ca 0.00 0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.15 1r65 n ASN 131 Cb 0.00 0.00 -0.12 0.00 -1.02 0.00 0.00 39.78 38.64 1r65 n ASN 131 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1r65 s ASP 132 N 0.00 4.83 0.44 6.41 3.68 -1.26 -4.95 116.67 125.82 1r65 s ASP 132 Ca 0.00 -3.54 0.20 0.00 2.13 0.00 0.00 52.55 51.35 1r65 s ASP 132 Cb 0.00 -1.68 1.16 0.00 -1.45 0.00 0.00 42.92 40.95 1r65 s ASP 132 CO 0.00 -0.16 1.85 -0.65 0.13 0.00 0.00 175.17 176.34 1r65 h PRO 133 N 5.89 0.32 -0.82 4.34 0.11 -1.86 -2.52 132.00 137.46 1r65 h PRO 133 Ca 0.07 -0.02 0.18 0.00 0.11 0.00 0.00 66.00 66.34 1r65 h PRO 133 Cb 0.81 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 31.79 1r65 h PRO 133 CO 0.72 0.21 0.55 0.77 -0.21 0.00 0.00 178.00 180.05 1r65 h SER 134 N 0.33 0.36 -0.37 -2.05 0.02 -1.99 -0.94 113.55 108.91 1r65 h SER 134 Ca 0.48 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.44 1r65 h SER 134 Cb 1.33 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.81 1r65 h SER 134 CO -0.16 0.16 0.16 0.58 -1.14 0.00 0.00 176.83 176.43 1r65 h VAL 135 N 0.37 1.18 0.13 2.27 2.07 -1.89 -2.10 116.25 118.27 1r65 h VAL 135 Ca 0.41 -0.54 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 1r65 h VAL 135 Cb 1.05 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 1r65 h VAL 135 CO -0.13 0.20 -0.06 0.58 0.02 0.00 0.00 177.57 178.17 1r65 h VAL 136 N 0.45 0.92 -0.76 2.57 2.07 -1.35 -2.66 116.25 117.49 1r65 h VAL 136 Ca 0.12 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 1r65 h VAL 136 Cb 0.16 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 1r65 h VAL 136 CO -0.01 0.04 0.41 -0.26 0.02 0.00 0.00 177.57 177.77 1r65 h PHE 137 N -0.26 1.03 -0.49 1.57 0.04 -1.39 -2.80 116.94 114.64 1r65 h PHE 137 Ca -0.02 -0.02 -0.13 0.00 2.80 0.00 0.00 57.97 60.61 1r65 h PHE 137 Cb 0.20 -0.33 -0.01 0.00 2.20 0.00 0.00 35.95 38.01 1r65 h PHE 137 CO -0.04 0.72 -0.19 -0.44 -0.60 0.00 0.00 178.31 177.76 1r65 h ASP 138 N 1.06 1.00 0.31 2.17 3.32 -1.36 -2.65 116.42 120.27 1r65 h ASP 138 Ca 0.27 -0.37 0.00 0.00 0.02 0.00 0.00 57.03 56.95 1r65 h ASP 138 Cb 0.03 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.31 1r65 h ASP 138 CO -0.04 1.16 0.00 -0.78 -1.72 0.00 0.00 179.24 177.85 1r65 h ASP 139 N 0.86 0.00 -0.15 6.45 3.58 -1.21 -2.43 116.42 123.51 1r65 h ASP 139 Ca 0.12 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.45 1r65 h ASP 139 Cb 0.76 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.81 1r65 h ASP 139 CO 0.06 0.00 -0.37 0.40 -2.88 0.00 0.00 179.24 176.45 1r65 h ILE 140 N 0.00 1.35 -0.21 2.25 2.04 -1.34 0.92 117.51 122.52 1r65 h ILE 140 Ca 0.00 -1.63 -0.15 0.00 1.00 0.00 0.00 64.86 64.07 1r65 h ILE 140 Cb 0.15 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.23 1r65 h ILE 140 CO 0.00 0.49 -0.51 1.62 0.00 0.00 0.00 178.15 179.75 1r65 h VAL 141 N 0.15 1.31 -0.00 1.67 3.04 -1.53 -3.34 116.25 117.55 1r65 h VAL 141 Ca -0.00 -1.74 0.00 0.00 -1.01 0.00 0.00 66.70 63.95 1r65 h VAL 141 Cb 0.97 1.71 0.00 0.00 -2.01 0.00 0.00 31.29 31.96 1r65 h VAL 141 CO 0.08 0.54 -0.84 0.35 -1.01 0.00 0.00 177.57 176.70 1r65 n THR 142 N -3.98 0.00 -1.62 3.17 -2.24 -1.13 -4.83 114.28 103.65 1r65 n THR 142 Ca -0.03 -0.08 -0.45 0.00 -2.27 0.00 0.00 64.05 61.22 1r65 n THR 142 Cb 0.58 1.02 -0.04 0.00 -2.10 0.00 0.00 70.33 69.79 1r65 n THR 142 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1r65 n ASN 143 N -1.32 3.47 -0.23 3.42 5.15 0.31 -4.85 115.26 121.21 1r65 n ASN 143 Ca 0.04 0.62 -0.02 0.00 -0.60 0.00 0.00 54.58 54.62 1r65 n ASN 143 Cb 0.30 -1.47 0.10 0.00 -0.53 0.00 0.00 39.78 38.17 1r65 n ASN 143 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 1r65 h GLU 144 N 12.07 0.68 -0.20 1.20 5.08 -1.92 0.25 114.58 131.74 1r65 h GLU 144 Ca -0.44 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 57.83 1r65 h GLU 144 Cb 1.26 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1r65 h GLU 144 CO 0.96 0.45 -0.11 0.37 -1.00 0.00 0.00 179.01 179.68 1r65 h GLN 145 N 0.70 0.31 0.09 2.33 5.75 -1.98 -3.16 115.11 119.14 1r65 h GLN 145 Ca 0.30 -0.07 -0.18 0.00 -0.15 0.00 0.00 58.65 58.55 1r65 h GLN 145 Cb 0.18 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.69 1r65 h GLN 145 CO -0.18 0.43 -0.87 0.82 -2.65 0.00 0.00 178.83 176.39 1r65 h ILE 146 N 0.30 1.37 0.00 2.39 2.04 -1.77 -3.37 117.51 118.47 1r65 h ILE 146 Ca 0.06 -2.42 0.00 0.00 1.00 0.00 0.00 64.86 63.50 1r65 h ILE 146 Cb 0.38 2.99 0.00 0.00 -0.74 0.00 0.00 36.82 39.45 1r65 h ILE 146 CO 0.02 0.65 0.14 1.56 0.00 0.00 0.00 178.15 180.52 1r65 h GLN 147 N -0.55 0.00 -0.24 2.37 1.08 -0.50 -1.88 115.11 115.39 1r65 h GLN 147 Ca -0.18 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 56.97 1r65 h GLN 147 Cb 1.50 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.93 1r65 h GLN 147 CO 0.05 0.00 -0.03 1.57 -0.95 0.00 0.00 178.83 179.48 1r65 h LYS 148 N 0.00 0.45 -0.16 1.46 2.10 -1.71 -1.35 116.57 117.35 1r65 h LYS 148 Ca 0.00 -0.16 -0.03 0.00 -2.00 0.00 0.00 60.65 58.46 1r65 h LYS 148 Cb 0.28 -0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 31.57 1r65 h LYS 148 CO 0.00 0.65 -0.03 0.00 -2.00 0.00 0.00 179.45 178.07 1r65 h ARG 149 N 0.21 0.30 -0.40 0.07 -0.00 -1.58 -2.49 114.38 110.48 1r65 h ARG 149 Ca 0.07 -0.11 0.06 0.00 -0.50 0.00 0.00 59.98 59.50 1r65 h ARG 149 Cb 0.46 -0.02 -0.05 0.00 0.00 0.00 0.00 29.97 30.36 1r65 h ARG 149 CO 0.02 0.56 0.09 0.00 0.00 0.00 0.00 179.97 180.63 1r65 h ALA 150 N 0.73 0.44 -0.11 0.04 0.00 -1.54 -0.74 119.26 118.07 1r65 h ALA 150 Ca 0.04 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1r65 h ALA 150 Cb 0.44 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 1r65 h ALA 150 CO 0.01 -0.31 -0.18 1.49 0.00 0.00 0.00 179.25 180.26 1r65 h GLU 151 N 0.22 -0.22 -0.73 0.00 4.22 -1.19 0.40 114.58 117.27 1r65 h GLU 151 Ca 0.19 0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.65 1r65 h GLU 151 Cb 0.22 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 1r65 h GLU 151 CO -0.25 -0.15 0.46 0.78 -2.18 0.00 0.00 179.01 177.67 1r65 h GLY 152 N -0.23 1.04 0.30 1.92 0.00 -0.94 -0.23 103.07 104.93 1r65 h GLY 152 Ca 0.09 -0.41 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 1r65 h GLY 152 CO -0.25 0.40 -0.06 -2.22 0.00 0.00 0.00 176.54 174.41 1r65 h ILE 153 N 1.00 0.90 -0.86 2.60 2.04 -0.62 -3.25 117.51 119.32 1r65 h ILE 153 Ca 0.26 -1.24 0.18 0.00 1.00 0.00 0.00 64.86 65.06 1r65 h ILE 153 Cb -0.07 1.54 -0.06 0.00 -0.74 0.00 0.00 36.82 37.49 1r65 h ILE 153 CO -0.05 0.25 0.57 0.28 0.00 0.00 0.00 178.15 179.19 1r65 h SER 154 N -0.87 0.45 -0.05 1.72 0.02 -0.15 -2.63 113.55 112.02 1r65 h SER 154 Ca -0.02 0.04 0.02 0.00 -0.84 0.00 0.00 61.79 60.99 1r65 h SER 154 Cb 0.54 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 63.00 1r65 h SER 154 CO 0.03 0.20 -0.09 0.28 -1.14 0.00 0.00 176.83 176.11 1r65 h SER 155 N 0.46 -0.27 -0.40 3.07 0.02 -1.07 0.12 113.55 115.48 1r65 h SER 155 Ca 0.44 0.05 0.03 0.00 -0.84 0.00 0.00 61.79 61.47 1r65 h SER 155 Cb 1.00 0.13 -0.04 0.00 0.14 0.00 0.00 62.40 63.63 1r65 h SER 155 CO -0.17 -0.13 0.19 1.88 -1.14 0.00 0.00 176.83 177.47 1r65 h TYR 156 N -0.13 0.35 0.12 3.45 0.05 -1.51 0.02 116.97 119.32 1r65 h TYR 156 Ca 0.05 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.84 1r65 h TYR 156 Cb 0.20 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 37.85 1r65 h TYR 156 CO -0.18 0.17 -0.06 1.88 -1.05 0.00 0.00 178.16 178.93 1r65 h TYR 157 N 0.39 -0.15 -0.85 4.88 0.99 -1.47 -1.45 116.97 119.30 1r65 h TYR 157 Ca 0.17 -0.00 0.06 0.00 2.00 0.00 0.00 58.73 60.96 1r65 h TYR 157 Cb 0.09 0.05 -0.06 0.00 1.00 0.00 0.00 36.73 37.81 1r65 h TYR 157 CO -0.11 -0.03 0.53 -0.44 -0.00 0.00 0.00 178.16 178.11 1r65 h ASP 158 N -0.24 0.84 -0.40 3.88 3.32 -0.51 0.68 116.42 123.99 1r65 h ASP 158 Ca -0.02 0.01 -0.14 0.00 0.02 0.00 0.00 57.03 56.91 1r65 h ASP 158 Cb 0.19 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1r65 h ASP 158 CO 0.03 0.55 -0.29 -0.33 -1.72 0.00 0.00 179.24 177.47 1r65 h GLU 159 N 0.98 0.90 -0.40 3.56 5.08 -0.91 -1.54 114.58 122.26 1r65 h GLU 159 Ca 0.37 -0.44 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 1r65 h GLU 159 Cb 0.14 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1r65 h GLU 159 CO -0.16 1.09 0.02 1.25 -1.00 0.00 0.00 179.01 180.20 1r65 h LEU 160 N 0.71 0.67 -0.90 1.33 5.85 -0.79 -1.47 115.31 120.72 1r65 h LEU 160 Ca 0.08 -0.29 0.02 0.00 0.84 0.00 0.00 57.88 58.52 1r65 h LEU 160 Cb 0.87 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.68 1r65 h LEU 160 CO 0.08 0.80 0.59 0.40 -0.34 0.00 0.00 178.44 179.97 1r65 h ILE 161 N 0.52 1.20 -0.13 4.05 2.04 -0.83 0.05 117.51 124.41 1r65 h ILE 161 Ca 0.11 -0.41 -0.02 0.00 1.00 0.00 0.00 64.86 65.55 1r65 h ILE 161 Cb 0.44 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.43 1r65 h ILE 161 CO 0.02 0.22 0.02 -0.08 0.00 0.00 0.00 178.15 178.32 1r65 h GLU 162 N 1.19 0.23 -0.30 2.37 4.81 -1.04 -2.08 114.58 119.76 1r65 h GLU 162 Ca 0.34 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.45 1r65 h GLU 162 Cb -0.09 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 1r65 h GLU 162 CO -0.09 0.43 -0.07 1.98 -0.73 0.00 0.00 179.01 180.53 1r65 h MET 163 N -0.01 0.48 -0.47 1.92 4.05 -1.04 -2.43 114.93 117.43 1r65 h MET 163 Ca 0.04 -0.12 -0.04 0.00 -0.28 0.00 0.00 59.70 59.30 1r65 h MET 163 Cb 0.32 -0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 31.04 1r65 h MET 163 CO 0.00 0.56 0.13 1.15 0.23 0.00 0.00 176.91 178.98 1r65 h THR 164 N 0.45 1.23 -0.50 -0.77 2.02 -0.83 -1.50 112.91 113.00 1r65 h THR 164 Ca 0.09 -0.78 0.02 0.00 0.77 0.00 0.00 66.41 66.51 1r65 h THR 164 Cb 0.40 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.64 1r65 h THR 164 CO 0.02 0.28 0.30 0.28 0.37 0.00 0.00 175.52 176.77 1r65 h SER 165 N 0.62 0.48 -0.60 4.18 0.02 -0.99 0.73 113.55 118.00 1r65 h SER 165 Ca 0.15 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.09 1r65 h SER 165 Cb 0.29 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.71 1r65 h SER 165 CO -0.00 0.34 0.31 1.88 -1.14 0.00 0.00 176.83 178.22 1r65 h TYR 166 N 0.60 0.83 -0.57 3.45 0.05 -1.28 -0.15 116.97 119.89 1r65 h TYR 166 Ca 0.20 -0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.94 1r65 h TYR 166 Cb 0.02 -0.26 -0.03 0.00 1.01 0.00 0.00 36.73 37.47 1r65 h TYR 166 CO -0.07 0.62 0.29 2.35 -1.05 0.00 0.00 178.16 180.30 1r65 h TRP 167 N 0.81 0.81 -0.22 4.88 7.01 -0.71 0.22 115.95 128.75 1r65 h TRP 167 Ca 0.21 -0.03 -0.12 0.00 2.11 0.00 0.00 58.89 61.05 1r65 h TRP 167 Cb 0.07 -0.25 -0.01 0.00 -2.10 0.00 0.00 29.16 26.87 1r65 h TRP 167 CO -0.01 0.62 -0.39 0.45 -2.79 0.00 0.00 178.44 176.32 1r65 h HIS 168 N 0.77 0.59 0.06 2.65 3.86 -0.60 -0.61 115.15 121.87 1r65 h HIS 168 Ca 0.20 -0.16 -0.09 0.00 -1.16 0.00 0.00 60.37 59.15 1r65 h HIS 168 Cb 0.10 -0.13 0.01 0.00 1.06 0.00 0.00 27.41 28.44 1r65 h HIS 168 CO -0.01 0.82 -0.43 -0.07 0.86 0.00 0.00 177.93 179.10 1r65 h LEU 169 N 0.42 0.19 0.00 2.43 3.38 -0.76 0.32 115.31 121.28 1r65 h LEU 169 Ca 0.04 -0.95 -0.05 0.00 0.09 0.00 0.00 57.88 57.01 1r65 h LEU 169 Cb 0.87 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1r65 h LEU 169 CO 0.07 1.20 -1.90 0.18 0.09 0.00 0.00 178.44 178.08 1r65 n LEU 170 N -4.39 0.00 -0.22 1.67 4.77 0.75 -4.81 117.00 114.76 1r65 n LEU 170 Ca -0.13 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 55.88 1r65 n LEU 170 Cb 0.64 0.07 -0.01 0.00 -2.33 0.00 0.00 43.42 41.78 1r65 n LEU 170 CO 0.39 0.07 -0.06 0.61 -1.33 0.00 0.00 177.39 177.07 1r65 n GLY 171 N 1.52 -1.71 3.75 -0.72 0.00 -0.24 -4.88 105.19 102.92 1r65 n GLY 171 Ca -0.07 -1.46 -0.35 0.00 0.00 0.00 0.00 46.02 44.13 1r65 n GLY 171 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r65 s GLU 172 N -1.69 2.86 0.00 1.61 2.02 -1.26 -4.75 118.70 117.49 1r65 s GLU 172 Ca 0.00 1.75 0.00 0.00 0.02 0.00 0.00 54.97 56.74 1r65 s GLU 172 Cb 0.00 -1.92 0.00 0.00 0.10 0.00 0.00 34.13 32.31 1r65 s GLU 172 CO 0.00 -1.27 0.00 0.41 0.02 0.00 0.00 175.26 174.42 1r65 n GLY 173 N 0.34 0.81 3.32 -1.39 0.00 -0.23 -4.95 105.19 103.09 1r65 n GLY 173 Ca 0.13 -2.04 -0.36 0.00 0.00 0.00 0.00 46.02 43.75 1r65 n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1r65 s THR 174 N -1.30 3.73 0.42 2.61 2.01 -1.26 -0.37 115.64 121.48 1r65 s THR 174 Ca 0.00 -0.69 0.07 0.00 0.31 0.00 0.00 61.69 61.38 1r65 s THR 174 Cb 0.00 -2.88 -0.07 0.00 0.01 0.00 0.00 72.50 69.56 1r65 s THR 174 CO 0.00 0.16 0.05 -1.00 -0.69 0.00 0.00 174.62 173.14 1r65 s HIS 175 N 1.47 2.49 -0.06 4.92 3.76 0.11 -4.94 115.29 123.04 1r65 s HIS 175 Ca 0.03 -0.67 0.04 0.00 -0.15 0.00 0.00 55.06 54.31 1r65 s HIS 175 Cb -0.17 -1.81 -0.00 0.00 1.11 0.00 0.00 32.58 31.72 1r65 s HIS 175 CO 0.01 0.37 -0.19 0.95 -0.85 0.00 0.00 174.74 175.03 1r65 s THR 176 N -2.70 1.59 -0.18 1.30 -4.23 -1.26 0.65 115.64 110.81 1r65 s THR 176 Ca 0.34 -0.79 -0.02 0.00 -1.18 0.00 0.00 61.69 60.04 1r65 s THR 176 Cb 0.08 -1.37 0.05 0.00 1.34 0.00 0.00 72.50 72.60 1r65 s THR 176 CO 0.18 0.45 0.01 -0.69 -0.54 0.00 0.00 174.62 174.04 1r65 s VAL 177 N 0.14 0.69 -1.41 2.29 1.01 0.93 -4.86 120.40 119.20 1r65 s VAL 177 Ca -0.08 -0.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.32 1r65 s VAL 177 Cb -0.14 -1.09 0.01 0.00 0.00 0.00 0.00 36.38 35.17 1r65 s VAL 177 CO 0.04 -0.11 0.54 0.59 0.00 0.00 0.00 175.10 176.16 1r65 n ASN 178 N 5.00 -0.94 0.00 3.32 3.02 -1.26 -1.51 115.26 122.89 1r65 n ASN 178 Ca -0.09 -0.95 0.00 0.00 -0.03 0.00 0.00 54.58 53.51 1r65 n ASN 178 Cb 0.47 -3.33 0.00 0.00 -0.61 0.00 0.00 39.78 36.31 1r65 n ASN 178 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r65 n GLY 179 N -1.83 0.88 3.54 7.41 0.00 -1.26 -5.03 105.19 108.91 1r65 n GLY 179 Ca -0.27 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 1r65 n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r65 s LYS 180 N -0.04 2.04 -0.01 1.61 1.02 -0.57 -5.11 119.74 118.68 1r65 s LYS 180 Ca 0.00 -1.05 -0.21 0.00 0.02 0.00 0.00 55.97 54.73 1r65 s LYS 180 Cb 0.00 -2.25 -0.05 0.00 -0.52 0.00 0.00 37.83 35.01 1r65 s LYS 180 CO 0.00 0.51 0.61 0.99 -0.92 0.00 0.00 175.35 176.54 1r65 s THR 181 N -1.16 4.92 -0.17 2.17 2.01 -1.26 -0.05 115.64 122.10 1r65 s THR 181 Ca 0.20 1.28 0.00 0.00 0.31 0.00 0.00 61.69 63.48 1r65 s THR 181 Cb -0.11 -3.95 0.04 0.00 0.01 0.00 0.00 72.50 68.49 1r65 s THR 181 CO 0.12 0.40 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.66 1r65 s VAL 182 N -0.06 1.41 -0.22 3.82 1.01 0.21 -4.91 120.40 121.66 1r65 s VAL 182 Ca 0.32 -0.77 -0.10 0.00 0.00 0.00 0.00 61.98 61.43 1r65 s VAL 182 Cb -0.18 -1.49 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 1r65 s VAL 182 CO 0.17 0.22 0.15 -0.89 0.00 0.00 0.00 175.10 174.75 1r65 s THR 183 N 1.51 5.39 -0.25 3.92 2.01 -1.26 0.09 115.64 127.04 1r65 s THR 183 Ca 0.01 0.19 0.00 0.00 0.31 0.00 0.00 61.69 62.20 1r65 s THR 183 Cb -0.15 -3.49 0.04 0.00 0.01 0.00 0.00 72.50 68.92 1r65 s THR 183 CO -0.08 0.39 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.47 1r65 s VAL 184 N 0.69 2.55 -0.15 3.82 1.01 0.51 -5.00 120.40 123.83 1r65 s VAL 184 Ca 0.08 -1.30 0.01 0.00 0.00 0.00 0.00 61.98 60.77 1r65 s VAL 184 Cb -0.12 -2.37 0.00 0.00 0.00 0.00 0.00 36.38 33.89 1r65 s VAL 184 CO 0.01 0.10 -0.18 -0.55 0.00 0.00 0.00 175.10 174.48 1r65 s SER 185 N 1.23 3.42 0.28 3.32 0.15 -1.26 -1.07 113.70 119.76 1r65 s SER 185 Ca -0.04 -0.53 -0.01 0.00 0.70 0.00 0.00 55.95 56.08 1r65 s SER 185 Cb -0.18 -1.51 0.39 0.00 -1.71 0.00 0.00 66.02 63.01 1r65 s SER 185 CO -0.05 0.08 1.80 0.25 1.20 0.00 0.00 173.24 176.52 1r65 h LEU 186 N 7.30 0.73 -1.05 3.45 5.85 -1.98 -1.85 115.31 127.76 1r65 h LEU 186 Ca -0.32 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.23 1r65 h LEU 186 Cb 1.19 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.99 1r65 h LEU 186 CO 0.56 0.77 0.46 -0.09 -0.34 0.00 0.00 178.44 179.80 1r65 h ARG 187 N 0.73 1.12 -0.14 1.25 2.43 -1.99 0.51 114.38 118.29 1r65 h ARG 187 Ca 0.15 -0.12 -0.17 0.00 -0.81 0.00 0.00 59.98 59.04 1r65 h ARG 187 Cb 0.38 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 1r65 h ARG 187 CO 0.01 0.81 -0.61 0.93 -1.51 0.00 0.00 179.97 179.60 1r65 h GLU 188 N 1.14 0.48 -0.61 0.20 4.39 -1.89 -2.05 114.58 116.23 1r65 h GLU 188 Ca 0.29 -0.33 -0.09 0.00 0.34 0.00 0.00 59.36 59.57 1r65 h GLU 188 Cb 0.00 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 1r65 h GLU 188 CO -0.05 0.94 0.03 1.25 -1.16 0.00 0.00 179.01 180.02 1r65 h LEU 189 N 0.36 1.04 -0.94 1.33 6.46 -0.71 -0.30 115.31 122.54 1r65 h LEU 189 Ca -0.01 -0.29 -0.03 0.00 -0.12 0.00 0.00 57.88 57.42 1r65 h LEU 189 Cb 1.16 -0.28 -0.03 0.00 -0.73 0.00 0.00 40.66 40.78 1r65 h LEU 189 CO 0.11 1.08 0.33 0.11 -0.62 0.00 0.00 178.44 179.45 1r65 h LYS 190 N 0.97 1.10 -0.51 1.25 1.57 -0.78 0.03 116.57 120.21 1r65 h LYS 190 Ca 0.18 -0.17 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1r65 h LYS 190 Cb 0.53 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1r65 h LYS 190 CO 0.03 0.87 0.07 -0.22 -0.57 0.00 0.00 179.45 179.62 1r65 h LYS 191 N 1.08 0.85 -0.19 3.15 3.64 -0.93 -1.26 116.57 122.91 1r65 h LYS 191 Ca 0.26 -0.24 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 1r65 h LYS 191 Cb 0.15 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 1r65 h LYS 191 CO -0.03 0.85 0.05 -0.22 -2.27 0.00 0.00 179.45 177.83 1r65 h LYS 192 N 0.73 0.13 -0.20 1.90 1.63 -0.46 -1.04 116.57 119.25 1r65 h LYS 192 Ca 0.15 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.95 1r65 h LYS 192 Cb 0.42 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.01 1r65 h LYS 192 CO 0.01 0.08 0.13 1.25 -3.45 0.00 0.00 179.45 177.47 1r65 h LEU 193 N 0.13 0.21 -0.10 5.20 5.85 -0.82 -0.99 115.31 124.78 1r65 h LEU 193 Ca 0.08 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.83 1r65 h LEU 193 Cb 0.07 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 1r65 h LEU 193 CO -0.10 0.16 -0.11 0.22 -0.34 0.00 0.00 178.44 178.27 1r65 h TYR 194 N 0.26 -0.27 -0.21 1.25 3.20 -0.85 0.08 116.97 120.42 1r65 h TYR 194 Ca 0.08 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.92 1r65 h TYR 194 Cb -0.02 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 1r65 h TYR 194 CO -0.07 -0.17 -0.07 -0.07 -1.64 0.00 0.00 178.16 176.14 1r65 h LEU 195 N -0.14 0.31 -0.53 2.82 3.38 -1.12 -1.02 115.31 119.01 1r65 h LEU 195 Ca 0.08 -0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.86 1r65 h LEU 195 Cb 0.25 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1r65 h LEU 195 CO -0.19 0.42 -0.22 0.00 0.09 0.00 0.00 178.44 178.54 1r65 h LEU 197 N 0.82 0.99 -1.09 0.00 3.38 -0.47 -1.24 115.31 117.72 1r65 h LEU 197 Ca 0.11 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 1r65 h LEU 197 Cb 0.79 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 1r65 h LEU 197 CO 0.07 1.06 0.36 0.24 0.09 0.00 0.00 178.44 180.26 1r65 h MET 198 N 0.90 1.00 -0.41 1.13 2.86 -1.04 -0.12 114.93 119.25 1r65 h MET 198 Ca 0.16 -0.13 -0.12 0.00 -2.06 0.00 0.00 59.70 57.55 1r65 h MET 198 Cb 0.56 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 1r65 h MET 198 CO 0.03 0.76 -0.23 0.77 1.06 0.00 0.00 176.91 179.30 1r65 h SER 199 N 1.00 0.83 0.22 1.22 0.02 -0.81 -1.73 113.55 114.30 1r65 h SER 199 Ca 0.25 -0.31 -0.13 0.00 -0.84 0.00 0.00 61.79 60.77 1r65 h SER 199 Cb 0.08 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 1r65 h SER 199 CO -0.04 1.03 -0.47 0.58 -1.14 0.00 0.00 176.83 176.79 1r65 h VAL 200 N 0.71 1.33 -0.65 2.27 2.07 -0.75 -1.22 116.25 120.01 1r65 h VAL 200 Ca 0.10 -1.68 -0.09 0.00 0.82 0.00 0.00 66.70 65.85 1r65 h VAL 200 Cb 0.75 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.26 1r65 h VAL 200 CO 0.06 0.51 0.07 -1.13 0.02 0.00 0.00 177.57 177.09 1r65 h ASN 201 N 0.25 1.07 -0.33 0.57 -1.24 -0.73 0.26 115.58 115.43 1r65 h ASN 201 Ca 0.01 -0.28 -0.12 0.00 0.71 0.00 0.00 56.30 56.62 1r65 h ASN 201 Cb 0.93 -0.29 -0.01 0.00 0.73 0.00 0.00 38.32 39.68 1r65 h ASN 201 CO 0.08 1.08 -0.24 0.00 -1.29 0.00 0.00 177.43 177.06 1r65 h ALA 202 N 1.03 0.81 -0.76 1.57 0.00 -1.05 0.63 119.26 121.48 1r65 h ALA 202 Ca 0.19 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1r65 h ALA 202 Cb 0.49 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1r65 h ALA 202 CO 0.02 0.65 0.39 1.25 0.00 0.00 0.00 179.25 181.56 1r65 h LEU 203 N 0.72 0.98 0.01 0.00 6.46 -0.85 0.20 115.31 122.83 1r65 h LEU 203 Ca 0.09 -0.12 -0.00 0.00 -0.12 0.00 0.00 57.88 57.73 1r65 h LEU 203 Cb 0.78 -0.25 0.00 0.00 -0.73 0.00 0.00 40.66 40.45 1r65 h LEU 203 CO 0.06 0.82 -0.00 -0.33 -0.62 0.00 0.00 178.44 178.37 1r65 h GLU 204 N 1.07 -0.01 -0.00 1.25 4.39 -0.56 -2.32 114.58 118.40 1r65 h GLU 204 Ca 0.27 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.80 1r65 h GLU 204 Cb 0.09 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 1r65 h GLU 204 CO -0.04 0.65 -0.78 0.00 -1.16 0.00 0.00 179.01 177.68 1r65 h ALA 205 N 0.30 0.72 0.00 3.43 0.00 0.29 -3.40 119.26 120.60 1r65 h ALA 205 Ca -0.00 -0.71 -0.00 0.00 0.00 0.00 0.00 54.91 54.20 1r65 h ALA 205 Cb 0.66 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1r65 h ALA 205 CO 0.00 0.97 -0.12 -0.89 0.00 0.00 0.00 179.25 179.21 1r65 n ILE 206 N -3.62 1.17 -0.18 0.00 5.41 0.65 -4.56 119.36 118.24 1r65 n ILE 206 Ca -0.01 0.37 -0.02 0.00 1.00 0.00 0.00 62.75 64.09 1r65 n ILE 206 Cb 0.75 -1.62 0.05 0.00 -0.71 0.00 0.00 39.64 38.11 1r65 n ILE 206 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 1r65 h ARG 207 N -0.05 0.02 -0.17 0.38 3.08 -1.41 -0.96 114.38 115.26 1r65 h ARG 207 Ca -0.00 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 1r65 h ARG 207 Cb 0.12 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1r65 h ARG 207 CO -0.00 0.01 0.00 0.74 -1.07 0.00 0.00 179.97 179.65 1r65 h PHE 208 N 0.02 0.33 -0.30 3.04 0.04 -1.62 -3.01 116.94 115.45 1r65 h PHE 208 Ca 0.26 -0.06 -0.00 0.00 2.80 0.00 0.00 57.97 60.97 1r65 h PHE 208 Cb 0.40 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.45 1r65 h PHE 208 CO -0.43 0.51 0.17 1.88 -0.60 0.00 0.00 178.31 179.84 1r65 h TYR 209 N 0.06 0.38 -0.31 -0.55 -1.99 -1.64 -0.13 116.97 112.79 1r65 h TYR 209 Ca 0.05 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.67 1r65 h TYR 209 Cb 0.38 -0.13 -0.01 0.00 2.00 0.00 0.00 36.73 38.97 1r65 h TYR 209 CO 0.03 0.26 -0.27 0.28 -0.00 0.00 0.00 178.16 178.47 1r65 h VAL 210 N 0.41 1.27 -0.04 -2.88 2.07 -1.18 -2.37 116.25 113.53 1r65 h VAL 210 Ca 0.11 -1.35 -0.12 0.00 0.82 0.00 0.00 66.70 66.16 1r65 h VAL 210 Cb -0.00 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1r65 h VAL 210 CO -0.02 0.44 -0.53 0.77 0.02 0.00 0.00 177.57 178.25 1r65 h SER 211 N 0.54 0.13 -0.68 0.57 4.64 -0.96 -2.93 113.55 114.85 1r65 h SER 211 Ca 0.07 -0.06 -0.08 0.00 -0.47 0.00 0.00 61.79 61.25 1r65 h SER 211 Cb 0.74 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 62.76 1r65 h SER 211 CO 0.06 0.63 0.13 -0.26 -0.87 0.00 0.00 176.83 176.52 1r65 h PHE 212 N 0.09 1.19 -0.50 4.77 0.04 -0.64 -2.25 116.94 119.64 1r65 h PHE 212 Ca -0.00 -0.16 0.07 0.00 2.80 0.00 0.00 57.97 60.69 1r65 h PHE 212 Cb 0.96 -0.33 -0.06 0.00 2.20 0.00 0.00 35.95 38.72 1r65 h PHE 212 CO 0.01 0.98 0.16 0.00 -0.60 0.00 0.00 178.31 178.86 1r65 h ALA 213 N 1.07 0.60 -0.31 2.45 0.00 -1.25 0.61 119.26 122.43 1r65 h ALA 213 Ca 0.21 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1r65 h ALA 213 Cb 0.42 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1r65 h ALA 213 CO 0.01 -0.25 0.13 0.00 0.00 0.00 0.00 179.25 179.14 1r65 h SER 215 N 0.36 0.48 1.36 0.00 0.02 -0.83 -2.92 113.55 112.03 1r65 h SER 215 Ca 0.11 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1r65 h SER 215 Cb 0.17 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.59 1r65 h SER 215 CO -0.01 0.42 0.00 -0.26 -1.14 0.00 0.00 176.83 175.84 1r65 h PHE 216 N 0.49 0.00 -0.21 3.45 0.04 -0.83 -2.85 116.94 117.03 1r65 h PHE 216 Ca 0.14 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.86 1r65 h PHE 216 Cb 0.05 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 1r65 h PHE 216 CO -0.03 0.00 -0.09 0.00 -0.60 0.00 0.00 178.31 177.60 1r65 h ALA 217 N 2.17 1.46 -0.15 2.45 0.00 -1.10 -0.29 119.26 123.82 1r65 h ALA 217 Ca 0.00 -0.20 -0.18 0.00 0.00 0.00 0.00 54.91 54.53 1r65 h ALA 217 Cb 0.68 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.37 1r65 h ALA 217 CO 0.00 0.38 -0.60 0.74 0.00 0.00 0.00 179.25 179.77 1r65 h PHE 218 N 0.32 0.88 -0.66 0.00 0.04 -1.54 -3.19 116.94 112.79 1r65 h PHE 218 Ca 0.07 -0.38 0.04 0.00 2.80 0.00 0.00 57.97 60.50 1r65 h PHE 218 Cb 0.36 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 38.33 1r65 h PHE 218 CO 0.01 1.18 0.44 0.00 -0.60 0.00 0.00 178.31 179.33 1r65 h ALA 219 N 0.53 1.66 -0.07 2.45 0.00 -1.25 -0.88 119.26 121.71 1r65 h ALA 219 Ca -0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1r65 h ALA 219 Cb 1.23 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1r65 h ALA 219 CO 0.12 0.26 -0.02 0.93 0.00 0.00 0.00 179.25 180.54 1r65 h GLU 220 N 0.76 0.10 -0.56 0.00 4.39 -1.07 0.85 114.58 119.05 1r65 h GLU 220 Ca 0.27 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.96 1r65 h GLU 220 Cb 0.12 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1r65 h GLU 220 CO -0.08 0.13 0.00 0.54 -1.16 0.00 0.00 179.01 178.44 1r65 n ARG 221 N -4.45 2.53 -2.77 2.33 1.74 -0.44 -4.90 116.66 110.69 1r65 n ARG 221 Ca -0.02 -1.87 -0.21 0.00 -0.77 0.00 0.00 57.85 54.98 1r65 n ARG 221 Cb 0.14 -1.55 0.02 0.00 -1.02 0.00 0.00 32.46 30.05 1r65 n ARG 221 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1r65 n GLU 222 N 0.82 -3.59 -4.54 5.56 1.02 0.29 -5.00 120.64 115.20 1r65 n GLU 222 Ca 0.17 0.92 -0.31 0.00 -0.02 0.00 0.00 57.16 57.92 1r65 n GLU 222 Cb 0.54 -5.65 -0.12 0.00 -0.02 0.00 0.00 31.44 26.19 1r65 n GLU 222 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1r65 s LEU 223 N -6.20 2.76 -1.28 -4.62 1.43 -0.57 -4.67 118.68 105.53 1r65 s LEU 223 Ca 0.18 -0.39 -0.00 0.00 -1.03 0.00 0.00 54.13 52.89 1r65 s LEU 223 Cb -0.08 -1.60 -0.00 0.00 0.03 0.00 0.00 46.19 44.53 1r65 s LEU 223 CO 0.23 0.24 0.77 0.23 0.23 0.00 0.00 176.35 178.05 1r65 n MET 224 N 1.39 -5.28 0.23 1.70 2.81 -1.26 -3.27 117.12 113.42 1r65 n MET 224 Ca -0.16 0.67 0.11 0.00 -1.81 0.00 0.00 57.70 56.51 1r65 n MET 224 Cb 0.52 -5.34 0.49 0.00 -0.71 0.00 0.00 33.22 28.19 1r65 n MET 224 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1r65 h GLU 225 N -1.87 0.00 -0.16 0.03 5.08 -1.92 -1.71 114.58 114.03 1r65 h GLU 225 Ca -0.61 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 57.68 1r65 h GLU 225 Cb 1.35 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.60 1r65 h GLU 225 CO 0.55 0.20 -0.18 0.78 -1.00 0.00 0.00 179.01 179.36 1r65 h GLY 226 N 1.97 0.44 0.99 -3.84 0.00 -1.90 -2.44 103.07 98.29 1r65 h GLY 226 Ca -0.00 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 1r65 h GLY 226 CO 0.03 0.42 0.32 -0.57 0.00 0.00 0.00 176.54 176.74 1r65 h ASN 227 N 0.04 0.69 -0.86 0.19 -1.24 -1.83 -2.70 115.58 109.86 1r65 h ASN 227 Ca 0.02 -0.07 0.04 0.00 0.71 0.00 0.00 56.30 57.00 1r65 h ASN 227 Cb 0.73 -0.17 -0.05 0.00 0.73 0.00 0.00 38.32 39.55 1r65 h ASN 227 CO 0.04 0.56 0.55 0.00 -1.29 0.00 0.00 177.43 177.29 1r65 h ALA 228 N 1.15 1.14 -0.86 1.57 0.00 -1.26 0.64 119.26 121.65 1r65 h ALA 228 Ca 0.20 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1r65 h ALA 228 Cb 0.01 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 1r65 h ALA 228 CO -0.04 0.36 0.41 0.87 0.00 0.00 0.00 179.25 180.86 1r65 h LYS 229 N 1.05 1.23 -0.23 0.00 1.57 -1.17 -0.56 116.57 118.47 1r65 h LYS 229 Ca 0.35 -0.18 -0.11 0.00 -1.87 0.00 0.00 60.65 58.84 1r65 h LYS 229 Cb 0.05 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.13 1r65 h LYS 229 CO -0.13 0.94 -0.29 0.82 -0.57 0.00 0.00 179.45 180.23 1r65 h ILE 230 N 1.22 1.32 -0.30 1.86 2.04 -1.06 -2.97 117.51 119.62 1r65 h ILE 230 Ca 0.29 -1.48 -0.04 0.00 1.00 0.00 0.00 64.86 64.64 1r65 h ILE 230 Cb 0.12 1.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 1r65 h ILE 230 CO -0.04 0.46 0.02 0.40 0.00 0.00 0.00 178.15 178.99 1r65 h ILE 231 N 0.29 1.17 -0.78 -0.67 1.08 -0.63 -1.29 117.51 116.69 1r65 h ILE 231 Ca 0.03 -0.66 -0.01 0.00 -0.39 0.00 0.00 64.86 63.83 1r65 h ILE 231 Cb 0.86 0.93 -0.04 0.00 -3.07 0.00 0.00 36.82 35.50 1r65 h ILE 231 CO 0.07 0.23 0.46 -0.09 -0.69 0.00 0.00 178.15 178.13 1r65 h ARG 232 N 0.44 1.06 -0.47 2.37 2.43 -1.03 0.29 114.38 119.47 1r65 h ARG 232 Ca 0.10 -0.10 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 1r65 h ARG 232 Cb 0.26 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1r65 h ARG 232 CO 0.01 0.76 -0.09 -0.07 -1.51 0.00 0.00 179.97 179.07 1r65 h LEU 233 N 1.07 0.89 -0.54 3.80 3.38 -1.21 -1.98 115.31 120.71 1r65 h LEU 233 Ca 0.28 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 1r65 h LEU 233 Cb -0.03 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1r65 h LEU 233 CO -0.05 1.03 0.09 0.40 0.09 0.00 0.00 178.44 180.00 1r65 h ILE 234 N 0.73 1.25 -0.60 1.22 2.04 -0.83 -2.21 117.51 119.12 1r65 h ILE 234 Ca 0.12 -0.95 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 1r65 h ILE 234 Cb 0.63 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 1r65 h ILE 234 CO 0.04 0.35 0.33 0.00 0.00 0.00 0.00 178.15 178.86 1r65 h ALA 235 N 0.99 1.46 -0.47 1.87 0.00 -0.28 0.12 119.26 122.94 1r65 h ALA 235 Ca 0.17 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1r65 h ALA 235 Cb 0.40 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1r65 h ALA 235 CO 0.01 0.45 -0.05 -0.09 0.00 0.00 0.00 179.25 179.58 1r65 h ARG 236 N 0.83 0.81 -0.26 0.00 2.43 -1.03 -1.76 114.38 115.39 1r65 h ARG 236 Ca 0.21 -0.24 -0.08 0.00 -0.81 0.00 0.00 59.98 59.06 1r65 h ARG 236 Cb 0.02 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 1r65 h ARG 236 CO -0.04 0.85 -0.16 -0.44 -1.51 0.00 0.00 179.97 178.67 1r65 h ASP 237 N 0.75 0.59 -0.29 -3.80 3.32 -0.58 -3.18 116.42 113.23 1r65 h ASP 237 Ca 0.14 -0.43 0.00 0.00 0.02 0.00 0.00 57.03 56.76 1r65 h ASP 237 Cb 0.52 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1r65 h ASP 237 CO 0.03 0.89 0.19 -0.33 -1.72 0.00 0.00 179.24 178.30 1r65 h GLU 238 N 0.29 0.39 -0.72 3.56 4.39 -0.55 -1.45 114.58 120.50 1r65 h GLU 238 Ca 0.05 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 1r65 h GLU 238 Cb 0.68 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.21 1r65 h GLU 238 CO 0.04 0.26 0.43 0.00 -1.16 0.00 0.00 179.01 178.58 1r65 h ALA 239 N 1.81 1.40 -0.22 3.43 0.00 -1.30 0.18 119.26 124.56 1r65 h ALA 239 Ca 0.11 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 1r65 h ALA 239 Cb -0.04 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 1r65 h ALA 239 CO -0.02 0.51 -0.28 -0.07 0.00 0.00 0.00 179.25 179.39 1r65 h LEU 240 N 0.99 0.63 -0.76 0.00 3.38 -1.33 -2.07 115.31 116.14 1r65 h LEU 240 Ca 0.26 -0.50 0.01 0.00 0.09 0.00 0.00 57.88 57.74 1r65 h LEU 240 Cb -0.03 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 1r65 h LEU 240 CO -0.05 1.01 0.50 0.45 0.09 0.00 0.00 178.44 180.44 1r65 h HIS 241 N 0.27 0.94 -0.32 1.13 3.86 -0.73 -0.94 115.15 119.36 1r65 h HIS 241 Ca 0.03 0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.16 1r65 h HIS 241 Cb 0.86 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.99 1r65 h HIS 241 CO 0.08 0.58 -0.22 1.37 0.86 0.00 0.00 177.93 180.60 1r65 h LEU 242 N 1.00 0.62 -0.96 2.43 8.10 -0.63 -1.89 115.31 123.98 1r65 h LEU 242 Ca 0.28 -0.21 -0.01 0.00 0.11 0.00 0.00 57.88 58.06 1r65 h LEU 242 Cb -0.09 -0.17 -0.04 0.00 -0.44 0.00 0.00 40.66 39.92 1r65 h LEU 242 CO -0.07 0.83 0.55 0.74 -4.11 0.00 0.00 178.44 176.38 1r65 h THR 243 N 0.54 1.26 -0.32 0.15 2.02 -0.67 -0.99 112.91 114.90 1r65 h THR 243 Ca 0.08 -0.57 -0.03 0.00 0.77 0.00 0.00 66.41 66.65 1r65 h THR 243 Cb 0.68 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 1r65 h THR 243 CO 0.05 0.27 0.06 1.23 0.37 0.00 0.00 175.52 177.51 1r65 h GLY 244 N 1.29 0.56 1.66 2.16 0.00 -0.71 -2.18 103.07 105.85 1r65 h GLY 244 Ca 0.33 -0.36 -0.11 0.00 0.00 0.00 0.00 47.33 47.19 1r65 h GLY 244 CO -0.06 0.34 -0.37 -0.91 0.00 0.00 0.00 176.54 175.53 1r65 h THR 245 N 0.35 1.30 -0.54 4.70 1.35 -1.07 -1.92 112.91 117.09 1r65 h THR 245 Ca 0.10 -1.47 -0.09 0.00 -0.55 0.00 0.00 66.41 64.40 1r65 h THR 245 Cb 0.32 1.57 -0.02 0.00 -1.73 0.00 0.00 68.15 68.29 1r65 h THR 245 CO 0.00 0.45 -0.00 1.56 -0.25 0.00 0.00 175.52 177.29 1r65 h GLN 246 N 0.32 0.95 -0.52 4.72 4.20 -1.10 -1.64 115.11 122.05 1r65 h GLN 246 Ca 0.03 -0.30 -0.11 0.00 0.06 0.00 0.00 58.65 58.33 1r65 h GLN 246 Cb 0.80 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.48 1r65 h GLN 246 CO 0.06 0.96 -0.12 0.45 -0.67 0.00 0.00 178.83 179.51 1r65 h HIS 247 N 0.82 1.12 0.16 2.96 3.86 -1.28 -0.49 115.15 122.30 1r65 h HIS 247 Ca 0.15 -0.24 -0.00 0.00 -1.16 0.00 0.00 60.37 59.12 1r65 h HIS 247 Cb 0.53 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.72 1r65 h HIS 247 CO 0.04 1.05 -0.11 0.52 0.86 0.00 0.00 177.93 180.30 1r65 h MET 248 N 0.86 -0.26 -0.53 2.45 2.86 -1.19 0.19 114.93 119.31 1r65 h MET 248 Ca 0.13 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 1r65 h MET 248 Cb 0.69 0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.38 1r65 h MET 248 CO 0.05 -0.17 0.35 -0.07 1.06 0.00 0.00 176.91 178.13 1r65 h LEU 249 N -0.27 0.62 -0.73 1.22 3.38 -1.21 -1.44 115.31 116.88 1r65 h LEU 249 Ca -0.01 -0.02 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 1r65 h LEU 249 Cb 0.23 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1r65 h LEU 249 CO 0.00 0.45 -0.54 0.78 0.09 0.00 0.00 178.44 179.22 1r65 h ASN 250 N 0.72 0.28 -0.43 -0.43 2.35 -0.96 -2.35 115.58 114.77 1r65 h ASN 250 Ca 0.20 -0.15 -0.13 0.00 -0.55 0.00 0.00 56.30 55.67 1r65 h ASN 250 Cb -0.08 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 1r65 h ASN 250 CO -0.04 0.77 -0.22 -0.07 -1.65 0.00 0.00 177.43 176.22 1r65 h LEU 251 N 0.20 0.96 -0.99 1.61 3.38 -0.73 -1.10 115.31 118.64 1r65 h LEU 251 Ca 0.00 -0.36 -0.10 0.00 0.09 0.00 0.00 57.88 57.51 1r65 h LEU 251 Cb 1.02 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1r65 h LEU 251 CO 0.09 1.14 -0.31 -0.07 0.09 0.00 0.00 178.44 179.37 1r65 h LEU 252 N 0.81 0.34 0.00 1.67 3.38 -1.12 -3.20 115.31 117.19 1r65 h LEU 252 Ca 0.11 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1r65 h LEU 252 Cb 0.78 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1r65 h LEU 252 CO 0.07 0.65 -1.13 0.08 0.09 0.00 0.00 178.44 178.19 1r65 h ARG 253 N 0.29 0.00 0.00 1.13 0.11 -1.31 -2.39 114.38 112.21 1r65 h ARG 253 Ca 0.04 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.12 1r65 h ARG 253 Cb 0.70 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.78 1r65 h ARG 253 CO 0.05 0.12 0.00 -1.13 0.10 0.00 0.00 179.97 179.11 1r65 n SER 254 N -2.78 0.00 0.00 0.08 3.41 -0.43 -4.70 113.62 109.21 1r65 n SER 254 Ca -0.04 -0.65 0.00 0.00 -0.26 0.00 0.00 58.87 57.92 1r65 n SER 254 Cb 0.66 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 1r65 n SER 254 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1r65 n GLY 255 N 0.26 0.45 0.12 5.00 0.00 -1.25 -4.88 105.19 104.90 1r65 n GLY 255 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 1r65 n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r65 h ALA 256 N 0.00 0.19 -3.00 4.61 0.00 -1.85 -3.41 119.26 115.80 1r65 h ALA 256 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1r65 h ALA 256 Cb 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1r65 h ALA 256 CO 0.00 0.04 0.00 -3.47 0.00 0.00 0.00 179.25 175.82 1r65 n ASP 257 N -4.61 0.00 -4.40 0.00 2.03 -1.23 -4.89 116.55 103.45 1r65 n ASP 257 Ca -0.06 0.00 -0.36 0.00 0.52 0.00 0.00 54.79 54.89 1r65 n ASP 257 Cb 0.33 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 40.60 1r65 n ASP 257 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1r65 s ASP 258 N -1.15 4.90 0.26 1.67 2.15 -1.26 -4.93 116.67 118.31 1r65 s ASP 258 Ca 0.00 -0.32 -0.01 0.00 0.43 0.00 0.00 52.55 52.65 1r65 s ASP 258 Cb 0.00 -1.87 0.53 0.00 -0.30 0.00 0.00 42.92 41.28 1r65 s ASP 258 CO 0.00 -0.05 1.77 -0.65 -0.17 0.00 0.00 175.17 176.07 1r65 h PRO 259 N 8.20 0.65 0.00 4.34 0.11 -1.90 -0.27 132.00 143.12 1r65 h PRO 259 Ca -0.38 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.67 1r65 h PRO 259 Cb 1.16 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 1r65 h PRO 259 CO 0.59 0.43 -0.08 1.49 -0.21 0.00 0.00 178.00 180.22 1r65 h GLU 260 N 0.67 0.00 -0.11 1.05 4.81 -1.95 -1.89 114.58 117.16 1r65 h GLU 260 Ca 0.46 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.46 1r65 h GLU 260 Cb 0.62 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.01 1r65 h GLU 260 CO -0.34 0.08 -0.82 0.52 -0.73 0.00 0.00 179.01 177.72 1r65 h MET 261 N 0.00 0.75 -0.99 1.92 2.86 -1.33 -1.71 114.93 116.42 1r65 h MET 261 Ca -0.00 -0.66 0.03 0.00 -2.06 0.00 0.00 59.70 57.01 1r65 h MET 261 Cb 0.14 0.15 -0.06 0.00 0.06 0.00 0.00 31.60 31.90 1r65 h MET 261 CO 0.01 1.26 0.65 0.00 1.06 0.00 0.00 176.91 179.89 1r65 h ALA 262 N 0.50 1.34 -0.17 6.32 0.00 -0.90 0.23 119.26 126.58 1r65 h ALA 262 Ca -0.07 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1r65 h ALA 262 Cb 1.46 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1r65 h ALA 262 CO 0.17 0.57 0.11 1.49 0.00 0.00 0.00 179.25 181.59 1r65 h GLU 263 N 1.27 0.22 -0.33 0.00 4.81 -1.22 -2.60 114.58 116.73 1r65 h GLU 263 Ca 0.39 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.52 1r65 h GLU 263 Cb -0.03 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1r65 h GLU 263 CO -0.11 0.15 -0.15 0.82 -0.73 0.00 0.00 179.01 178.99 1r65 h ILE 264 N 0.23 1.25 -0.63 2.32 2.04 -0.32 -1.70 117.51 120.70 1r65 h ILE 264 Ca 0.06 -1.12 0.03 0.00 1.00 0.00 0.00 64.86 64.83 1r65 h ILE 264 Cb -0.03 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.17 1r65 h ILE 264 CO -0.01 0.37 0.38 0.00 0.00 0.00 0.00 178.15 178.89 1r65 h ALA 265 N 1.31 0.82 -0.27 1.87 0.00 -0.29 -2.12 119.26 120.58 1r65 h ALA 265 Ca 0.09 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.83 1r65 h ALA 265 Cb 0.56 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1r65 h ALA 265 CO 0.04 0.13 -0.47 1.49 0.00 0.00 0.00 179.25 180.43 1r65 h GLU 266 N 0.75 0.72 -0.07 0.00 4.57 -1.25 -3.16 114.58 116.14 1r65 h GLU 266 Ca 0.26 -0.42 0.02 0.00 -1.18 0.00 0.00 59.36 58.04 1r65 h GLU 266 Cb 0.03 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.63 1r65 h GLU 266 CO -0.11 1.04 -0.06 1.49 -1.18 0.00 0.00 179.01 180.19 1r65 h GLU 267 N 0.57 -0.07 -0.89 1.92 4.81 -0.69 -3.06 114.58 117.18 1r65 h GLU 267 Ca 0.03 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 58.90 1r65 h GLU 267 Cb 1.03 0.02 -0.22 0.00 0.63 0.00 0.00 28.75 30.21 1r65 h GLU 267 CO 0.10 -0.05 0.47 0.00 -0.73 0.00 0.00 179.01 178.80 1r65 h LYS 269 N 1.78 0.64 -0.32 0.00 3.64 -1.50 0.13 116.57 120.94 1r65 h LYS 269 Ca 0.45 -0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 59.64 1r65 h LYS 269 Cb 2.59 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 34.27 1r65 h LYS 269 CO 0.92 0.42 -0.40 0.37 -2.27 0.00 0.00 179.45 178.49 1r65 h GLN 270 N 0.66 0.84 -0.35 1.90 5.75 -1.86 -2.35 115.11 119.70 1r65 h GLN 270 Ca 0.51 -0.47 -0.03 0.00 -0.15 0.00 0.00 58.65 58.51 1r65 h GLN 270 Cb 0.77 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.33 1r65 h GLN 270 CO -0.38 1.11 0.11 1.49 -2.65 0.00 0.00 178.83 178.50 1r65 h GLU 271 N 0.62 0.54 -0.57 1.69 4.81 -1.59 -2.06 114.58 118.01 1r65 h GLU 271 Ca 0.04 -0.12 0.06 0.00 -0.13 0.00 0.00 59.36 59.22 1r65 h GLU 271 Cb 0.99 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 30.24 1r65 h GLU 271 CO 0.10 0.56 0.28 0.00 -0.73 0.00 0.00 179.01 179.21 1r65 h TYR 273 N 0.52 0.52 -0.14 0.00 5.03 -1.14 -1.81 116.97 119.94 1r65 h TYR 273 Ca 0.27 0.02 -0.10 0.00 2.58 0.00 0.00 58.73 61.49 1r65 h TYR 273 Cb 0.22 -0.16 -0.01 0.00 1.55 0.00 0.00 36.73 38.32 1r65 h TYR 273 CO -0.11 0.28 -0.35 -0.44 -1.32 0.00 0.00 178.16 176.21 1r65 h ASP 274 N 0.55 0.31 -0.32 -2.11 3.32 -0.78 -1.93 116.42 115.46 1r65 h ASP 274 Ca 0.21 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1r65 h ASP 274 Cb 0.06 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1r65 h ASP 274 CO -0.11 0.64 0.21 0.25 -1.72 0.00 0.00 179.24 178.51 1r65 h LEU 275 N 0.26 0.37 -0.09 1.55 6.46 -0.49 0.44 115.31 123.81 1r65 h LEU 275 Ca 0.03 -0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1r65 h LEU 275 Cb 0.75 -0.09 -0.00 0.00 -0.73 0.00 0.00 40.66 40.58 1r65 h LEU 275 CO 0.06 0.29 0.04 -0.26 -0.62 0.00 0.00 178.44 177.94 1r65 h PHE 276 N 0.43 0.13 -0.56 1.25 0.04 -1.06 -2.08 116.94 115.08 1r65 h PHE 276 Ca 0.12 -0.01 0.03 0.00 2.80 0.00 0.00 57.97 60.91 1r65 h PHE 276 Cb -0.03 -0.04 -0.04 0.00 2.20 0.00 0.00 35.95 38.04 1r65 h PHE 276 CO -0.05 0.21 0.33 0.28 -0.60 0.00 0.00 178.31 178.48 1r65 h VAL 277 N 0.00 1.04 -0.50 -0.55 2.07 -1.17 -1.08 116.25 116.06 1r65 h VAL 277 Ca 0.03 -0.22 0.08 0.00 0.82 0.00 0.00 66.70 67.41 1r65 h VAL 277 Cb 0.14 0.33 -0.06 0.00 -1.52 0.00 0.00 31.29 30.18 1r65 h VAL 277 CO -0.00 0.12 0.14 1.56 0.02 0.00 0.00 177.57 179.40 1r65 h GLN 278 N 0.65 0.28 -0.57 1.57 1.08 -0.74 0.29 115.11 117.67 1r65 h GLN 278 Ca 0.23 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.42 1r65 h GLN 278 Cb 0.05 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.39 1r65 h GLN 278 CO -0.11 0.19 0.37 0.00 -0.95 0.00 0.00 178.83 178.32 1r65 h ALA 279 N 1.36 0.72 -0.72 3.87 0.00 -0.71 0.25 119.26 124.05 1r65 h ALA 279 Ca 0.25 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1r65 h ALA 279 Cb 0.30 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1r65 h ALA 279 CO -0.29 0.17 0.38 0.00 0.00 0.00 0.00 179.25 179.51 1r65 h ALA 280 N 1.20 0.92 -0.69 0.00 0.00 -0.20 -2.13 119.26 118.35 1r65 h ALA 280 Ca 0.21 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1r65 h ALA 280 Cb -0.07 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.41 1r65 h ALA 280 CO -0.04 0.45 0.27 0.37 0.00 0.00 0.00 179.25 180.29 1r65 h GLN 281 N 0.99 1.03 -0.66 0.00 5.75 0.23 -1.34 115.11 121.10 1r65 h GLN 281 Ca 0.25 -0.18 -0.06 0.00 -0.15 0.00 0.00 58.65 58.51 1r65 h GLN 281 Cb 0.06 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.41 1r65 h GLN 281 CO -0.04 0.84 0.17 1.96 -2.65 0.00 0.00 178.83 179.11 1r65 h GLN 282 N 1.00 1.05 -0.07 1.69 4.20 -0.45 0.16 115.11 122.69 1r65 h GLN 282 Ca 0.23 -0.24 -0.10 0.00 0.06 0.00 0.00 58.65 58.60 1r65 h GLN 282 Cb 0.20 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1r65 h GLN 282 CO -0.02 0.93 -0.40 0.93 -0.67 0.00 0.00 178.83 179.60 1r65 h GLU 283 N 0.97 0.14 0.28 1.46 4.39 -1.06 -1.84 114.58 118.92 1r65 h GLU 283 Ca 0.21 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.83 1r65 h GLU 283 Cb 0.34 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1r65 h GLU 283 CO -0.00 0.53 -0.13 0.87 -1.16 0.00 0.00 179.01 179.11 1r65 h LYS 284 N 0.12 -0.36 -0.34 2.33 1.57 -0.65 -2.71 116.57 116.53 1r65 h LYS 284 Ca 0.01 0.02 0.09 0.00 -1.87 0.00 0.00 60.65 58.90 1r65 h LYS 284 Cb 0.77 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.15 1r65 h LYS 284 CO 0.06 -0.04 0.24 -0.44 -0.57 0.00 0.00 179.45 178.69 1r65 h ASP 285 N -0.70 0.06 -0.38 0.86 3.32 -0.88 -0.28 116.42 118.43 1r65 h ASP 285 Ca -0.04 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.91 1r65 h ASP 285 Cb 0.48 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 1r65 h ASP 285 CO 0.06 0.03 -0.13 -0.25 -1.72 0.00 0.00 179.24 177.24 1r65 h TRP 286 N 0.06 0.93 -0.01 4.55 2.91 -1.20 -2.14 115.95 121.05 1r65 h TRP 286 Ca 0.16 -0.18 0.00 0.00 1.13 0.00 0.00 58.89 60.00 1r65 h TRP 286 Cb 0.55 -0.23 -0.00 0.00 -0.51 0.00 0.00 29.16 28.97 1r65 h TRP 286 CO -0.00 0.91 0.08 0.00 -1.03 0.00 0.00 178.44 178.40 1r65 h ALA 287 N 1.10 1.14 0.09 2.65 0.00 -0.72 -0.57 119.26 122.95 1r65 h ALA 287 Ca 0.12 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1r65 h ALA 287 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1r65 h ALA 287 CO 0.04 -0.08 -0.04 0.22 0.00 0.00 0.00 179.25 179.39 1r65 h ASP 288 N 0.00 -0.10 -0.01 0.00 1.82 -1.39 -2.50 116.42 114.24 1r65 h ASP 288 Ca 0.00 -0.47 -0.04 0.00 -0.39 0.00 0.00 57.03 56.14 1r65 h ASP 288 Cb 0.16 0.03 -0.01 0.00 0.68 0.00 0.00 39.33 40.19 1r65 h ASP 288 CO -0.00 0.46 -0.09 0.22 -1.61 0.00 0.00 179.24 178.22 1r65 h TYR 289 N -0.73 0.24 0.08 0.28 3.20 -1.32 -2.52 116.97 116.19 1r65 h TYR 289 Ca -0.01 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 1r65 h TYR 289 Cb 0.56 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.76 1r65 h TYR 289 CO 0.11 0.33 -0.04 1.25 -1.64 0.00 0.00 178.16 178.16 1r65 h LEU 290 N 0.22 -0.10 -3.93 2.82 5.85 -1.14 -3.21 115.31 115.82 1r65 h LEU 290 Ca 0.05 -0.21 -0.60 0.00 0.84 0.00 0.00 57.88 57.96 1r65 h LEU 290 Cb 0.31 0.02 -0.30 0.00 0.37 0.00 0.00 40.66 41.07 1r65 h LEU 290 CO 0.02 0.16 0.58 0.49 -0.34 0.00 0.00 178.44 179.34 1r65 n PHE 291 N -5.03 3.00 0.07 1.25 3.72 -0.95 -4.58 117.46 114.95 1r65 n PHE 291 Ca -0.08 -2.58 -0.02 0.00 -0.05 0.00 0.00 57.45 54.71 1r65 n PHE 291 Cb 0.17 -1.16 0.23 0.00 -0.94 0.00 0.00 39.48 37.78 1r65 n PHE 291 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 176.76 176.78 1r65 h ARG 292 N 1.72 0.31 -0.44 -1.08 0.11 -1.46 -2.99 114.38 110.55 1r65 h ARG 292 Ca 0.56 -0.13 0.00 0.00 0.10 0.00 0.00 59.98 60.51 1r65 h ARG 292 Cb 1.41 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.48 1r65 h ARG 292 CO 1.31 0.62 0.00 -0.25 0.10 0.00 0.00 179.97 181.75 1r65 n ASP 293 N -4.08 3.85 0.00 0.08 10.43 -1.26 -5.06 116.55 120.50 1r65 n ASP 293 Ca -0.01 -2.41 0.00 0.00 2.57 0.00 0.00 54.79 54.94 1r65 n ASP 293 Cb 0.44 -0.44 0.00 0.00 1.84 0.00 0.00 41.12 42.96 1r65 n ASP 293 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1r65 n GLY 294 N 0.51 3.24 0.00 0.44 0.00 -1.13 -4.84 105.19 103.41 1r65 n GLY 294 Ca 0.19 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.35 1r65 n GLY 294 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1r65 n SER 295 N 0.00 0.55 -3.49 1.61 7.64 -1.26 -4.43 113.62 114.24 1r65 n SER 295 Ca 0.00 0.00 -0.07 0.00 1.01 0.00 0.00 58.87 59.81 1r65 n SER 295 Cb 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1r65 n SER 295 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1r65 s MET 296 N 2.49 1.91 0.00 1.43 0.23 -0.86 -4.89 119.30 119.62 1r65 s MET 296 Ca 0.00 -1.14 -0.30 0.00 -1.03 0.00 0.00 55.69 53.23 1r65 s MET 296 Cb 0.00 0.60 -0.08 0.00 -1.53 0.00 0.00 34.83 33.82 1r65 s MET 296 CO 0.00 -0.88 1.89 0.42 -2.03 0.00 0.00 175.02 174.42 1r65 s ILE 297 N -3.23 3.17 0.00 3.16 1.01 -1.26 -2.15 121.20 121.90 1r65 s ILE 297 Ca 0.13 0.20 0.00 0.00 0.00 0.00 0.00 60.65 60.98 1r65 s ILE 297 Cb -0.05 -3.13 0.00 0.00 0.01 0.00 0.00 42.46 39.29 1r65 s ILE 297 CO 0.08 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.61 1r65 n GLY 298 N 4.48 2.91 2.87 6.18 0.00 -1.26 -4.92 105.19 115.44 1r65 n GLY 298 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.09 1r65 n GLY 298 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r65 s LEU 299 N 0.00 1.78 0.23 0.99 1.43 -0.91 -4.95 118.68 117.24 1r65 s LEU 299 Ca 0.00 0.04 -0.23 0.00 -1.03 0.00 0.00 54.13 52.91 1r65 s LEU 299 Cb 0.00 0.04 0.04 0.00 0.03 0.00 0.00 46.19 46.29 1r65 s LEU 299 CO 0.00 -0.03 0.79 0.54 0.23 0.00 0.00 176.35 177.88 1r65 s ASN 300 N 0.20 -0.26 0.22 2.29 2.20 -1.26 -2.03 114.94 116.30 1r65 s ASN 300 Ca -0.02 -0.49 -0.14 0.00 -0.94 0.00 0.00 52.86 51.27 1r65 s ASN 300 Cb -0.02 0.64 0.25 0.00 -2.00 0.00 0.00 41.25 40.12 1r65 s ASN 300 CO -0.01 -1.17 1.60 0.11 -2.94 0.00 0.00 177.10 174.70 1r65 h LYS 301 N 2.00 -0.03 -0.29 3.55 1.57 -1.94 -1.24 116.57 120.18 1r65 h LYS 301 Ca -0.22 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.52 1r65 h LYS 301 Cb 1.25 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.55 1r65 h LYS 301 CO 0.25 -0.02 -0.01 -0.44 -0.57 0.00 0.00 179.45 178.66 1r65 h ASP 302 N -0.04 0.50 -0.30 0.86 3.32 -1.97 -0.71 116.42 118.09 1r65 h ASP 302 Ca 0.32 -0.31 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 1r65 h ASP 302 Cb 0.53 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 1r65 h ASP 302 CO -0.73 0.70 0.01 -0.29 -1.72 0.00 0.00 179.24 177.20 1r65 h ILE 303 N 0.30 1.25 -0.91 0.35 6.09 -1.89 -0.60 117.51 122.10 1r65 h ILE 303 Ca 0.08 -0.91 -0.00 0.00 -1.37 0.00 0.00 64.86 62.65 1r65 h ILE 303 Cb 0.44 1.26 -0.04 0.00 0.47 0.00 0.00 36.82 38.94 1r65 h ILE 303 CO 0.02 0.30 0.56 0.25 -3.07 0.00 0.00 178.15 176.20 1r65 h LEU 304 N 0.33 1.08 -1.03 2.19 5.85 -1.24 -0.66 115.31 121.83 1r65 h LEU 304 Ca 0.09 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 1r65 h LEU 304 Cb 0.42 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 1r65 h LEU 304 CO 0.01 0.82 0.15 0.00 -0.34 0.00 0.00 178.44 179.08 1r65 h GLN 306 N 0.82 0.59 -0.38 0.00 5.75 -0.12 -2.80 115.11 118.97 1r65 h GLN 306 Ca 0.18 -0.32 -0.09 0.00 -0.15 0.00 0.00 58.65 58.27 1r65 h GLN 306 Cb 0.28 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.83 1r65 h GLN 306 CO -0.00 0.92 -0.14 -0.92 -2.65 0.00 0.00 178.83 176.03 1r65 h TYR 307 N 0.48 0.76 -0.24 3.99 3.20 -0.75 -1.70 116.97 122.72 1r65 h TYR 307 Ca 0.03 -0.14 -0.00 0.00 3.14 0.00 0.00 58.73 61.76 1r65 h TYR 307 Cb 0.95 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 39.02 1r65 h TYR 307 CO 0.04 0.80 0.14 0.28 -1.64 0.00 0.00 178.16 177.78 1r65 h VAL 308 N 0.63 1.10 -0.63 1.81 2.07 -1.18 0.03 116.25 120.09 1r65 h VAL 308 Ca 0.10 -0.26 -0.07 0.00 0.82 0.00 0.00 66.70 67.29 1r65 h VAL 308 Cb 0.60 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 1r65 h VAL 308 CO 0.04 0.10 0.12 -0.33 0.02 0.00 0.00 177.57 177.52 1r65 h GLU 309 N 0.28 1.03 0.80 1.57 5.08 -1.36 -0.03 114.58 121.95 1r65 h GLU 309 Ca 0.08 -0.27 -0.04 0.00 -1.00 0.00 0.00 59.36 58.14 1r65 h GLU 309 Cb 0.04 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1r65 h GLU 309 CO -0.01 0.95 -0.42 -0.92 -1.00 0.00 0.00 179.01 177.61 1r65 h TYR 310 N 0.94 -1.09 -0.56 4.33 3.20 -1.04 -1.47 116.97 121.29 1r65 h TYR 310 Ca 0.19 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.06 1r65 h TYR 310 Cb 0.41 0.37 -0.03 0.00 1.54 0.00 0.00 36.73 39.01 1r65 h TYR 310 CO 0.03 -0.66 0.35 0.97 -1.64 0.00 0.00 178.16 177.21 1r65 h ILE 311 N -1.12 1.08 -0.55 1.81 6.09 -0.97 -2.67 117.51 121.19 1r65 h ILE 311 Ca -0.11 -0.24 0.03 0.00 -1.37 0.00 0.00 64.86 63.17 1r65 h ILE 311 Cb 0.87 0.33 -0.04 0.00 0.47 0.00 0.00 36.82 38.46 1r65 h ILE 311 CO 0.16 0.13 0.33 0.74 -3.07 0.00 0.00 178.15 176.43 1r65 h THR 312 N 0.69 1.05 -0.56 2.19 2.02 -0.94 -0.89 112.91 116.46 1r65 h THR 312 Ca 0.22 -0.22 0.06 0.00 0.77 0.00 0.00 66.41 67.23 1r65 h THR 312 Cb -0.01 0.34 -0.05 0.00 -1.74 0.00 0.00 68.15 66.69 1r65 h THR 312 CO -0.08 0.12 0.28 0.78 0.37 0.00 0.00 175.52 176.98 1r65 h ASN 313 N 0.65 0.38 -0.00 4.18 4.21 -0.97 -0.61 115.58 123.42 1r65 h ASN 313 Ca 0.22 0.04 -0.00 0.00 1.21 0.00 0.00 56.30 57.77 1r65 h ASN 313 Cb 0.04 -0.03 -0.00 0.00 -1.12 0.00 0.00 38.32 37.21 1r65 h ASN 313 CO -0.10 0.25 0.00 0.40 -1.29 0.00 0.00 177.43 176.69 1r65 h ILE 314 N 0.52 1.15 -0.59 2.81 2.04 -1.09 -2.51 117.51 119.85 1r65 h ILE 314 Ca 0.26 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 1r65 h ILE 314 Cb 0.19 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 1r65 h ILE 314 CO -0.19 0.12 0.34 0.03 0.00 0.00 0.00 178.15 178.44 1r65 h ARG 315 N -0.19 0.81 -0.50 2.37 2.47 -0.94 -1.65 114.38 116.75 1r65 h ARG 315 Ca 0.00 -0.08 -0.08 0.00 -1.26 0.00 0.00 59.98 58.56 1r65 h ARG 315 Cb 0.19 -0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 28.33 1r65 h ARG 315 CO -0.00 0.60 0.01 0.52 0.56 0.00 0.00 179.97 181.66 1r65 h MET 316 N 0.79 0.83 -0.14 0.04 2.86 -1.12 -2.25 114.93 115.93 1r65 h MET 316 Ca 0.21 -0.23 -0.11 0.00 -2.06 0.00 0.00 59.70 57.51 1r65 h MET 316 Cb 0.01 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 1r65 h MET 316 CO -0.04 0.83 -0.38 0.37 1.06 0.00 0.00 176.91 178.75 1r65 h GLN 317 N 0.77 0.31 0.00 1.72 4.15 -1.23 0.16 115.11 121.00 1r65 h GLN 317 Ca 0.15 -0.14 -0.01 0.00 0.77 0.00 0.00 58.65 59.42 1r65 h GLN 317 Cb 0.46 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 28.14 1r65 h GLN 317 CO 0.02 0.65 -0.06 0.00 -1.93 0.00 0.00 178.83 177.51 1r65 h ALA 318 N 1.34 1.40 -0.28 3.38 0.00 -0.70 -1.94 119.26 122.47 1r65 h ALA 318 Ca 0.03 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1r65 h ALA 318 Cb 0.80 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1r65 h ALA 318 CO 0.06 0.08 0.00 1.33 0.00 0.00 0.00 179.25 180.72 1r65 n VAL 319 N -3.74 2.34 -1.47 0.00 0.24 -0.99 -4.98 118.33 109.73 1r65 n VAL 319 Ca -0.02 -2.00 -0.05 0.00 -2.04 0.00 0.00 64.34 60.23 1r65 n VAL 319 Cb 0.16 -0.27 -0.01 0.00 -1.47 0.00 0.00 33.84 32.25 1r65 n VAL 319 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1r65 n GLY 320 N -0.61 0.56 3.87 7.63 0.00 -0.73 -4.96 105.19 110.96 1r65 n GLY 320 Ca 0.24 -0.79 -0.26 0.00 0.00 0.00 0.00 46.02 45.21 1r65 n GLY 320 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r65 s LEU 321 N -1.23 4.08 0.61 0.99 1.43 0.53 -4.99 118.68 120.09 1r65 s LEU 321 Ca 0.00 0.03 -0.16 0.00 -1.03 0.00 0.00 54.13 52.97 1r65 s LEU 321 Cb 0.00 -2.67 -0.03 0.00 0.03 0.00 0.00 46.19 43.52 1r65 s LEU 321 CO 0.00 0.07 1.09 -1.81 0.23 0.00 0.00 176.35 175.92 1r65 s ASP 322 N -3.13 5.53 0.05 2.29 1.01 -1.26 -3.79 116.67 117.37 1r65 s ASP 322 Ca 0.33 1.94 -0.30 0.00 0.71 0.00 0.00 52.55 55.23 1r65 s ASP 322 Cb -0.11 -2.55 -0.05 0.00 1.01 0.00 0.00 42.92 41.23 1r65 s ASP 322 CO 0.26 -1.34 1.09 -0.76 0.21 0.00 0.00 175.17 174.63 1r65 s LEU 323 N -4.50 4.38 0.10 1.23 1.43 -1.26 -4.84 118.68 115.22 1r65 s LEU 323 Ca 0.66 1.87 0.23 0.00 -1.03 0.00 0.00 54.13 55.86 1r65 s LEU 323 Cb -0.19 -3.58 0.12 0.00 0.03 0.00 0.00 46.19 42.58 1r65 s LEU 323 CO 0.36 -0.35 1.11 -0.81 0.23 0.00 0.00 176.35 176.89 1r65 n PRO 324 N 3.77 0.37 -4.54 1.29 -0.04 -1.26 -4.97 135.00 129.62 1r65 n PRO 324 Ca 0.07 0.04 -0.25 0.00 -0.04 0.00 0.00 63.50 63.32 1r65 n PRO 324 Cb 0.48 -1.67 -0.11 0.00 -0.04 0.00 0.00 33.50 32.17 1r65 n PRO 324 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1r65 s PHE 325 N -3.23 2.33 0.16 0.54 0.08 -1.26 -5.10 117.98 111.49 1r65 s PHE 325 Ca 0.03 -0.62 -0.31 0.00 0.12 0.00 0.00 56.93 56.16 1r65 s PHE 325 Cb 0.13 -1.45 -0.08 0.00 -0.57 0.00 0.00 43.02 41.05 1r65 s PHE 325 CO 0.78 0.45 1.35 0.54 -0.10 0.00 0.00 175.22 178.23 1r65 s ASN 326 N -3.60 6.86 0.38 1.36 2.20 -1.26 -4.97 114.94 115.92 1r65 s ASN 326 Ca 0.33 2.37 -0.26 0.00 -0.94 0.00 0.00 52.86 54.35 1r65 s ASN 326 Cb 0.05 -2.60 -0.09 0.00 -2.00 0.00 0.00 41.25 36.62 1r65 s ASN 326 CO 0.16 -0.59 1.21 -0.89 -2.94 0.00 0.00 177.10 174.06 1r65 s THR 327 N 0.58 2.99 0.16 0.54 2.01 -1.26 -4.91 115.64 115.75 1r65 s THR 327 Ca 0.60 0.87 -0.24 0.00 0.31 0.00 0.00 61.69 63.24 1r65 s THR 327 Cb -0.37 -3.51 0.06 0.00 0.01 0.00 0.00 72.50 68.70 1r65 s THR 327 CO 0.35 0.12 0.77 -0.60 -0.69 0.00 0.00 174.62 174.56 1r65 s ARG 328 N -2.16 1.33 0.76 4.92 3.52 -1.26 -5.17 118.95 120.89 1r65 s ARG 328 Ca 0.55 -0.64 -0.11 0.00 -0.13 0.00 0.00 55.73 55.41 1r65 s ARG 328 Cb -0.34 0.52 0.06 0.00 -1.56 0.00 0.00 34.95 33.63 1r65 s ARG 328 CO 0.43 -0.60 1.12 -1.54 -0.81 0.00 0.00 175.30 173.91 1r65 s SER 329 N -2.79 4.79 -0.07 -2.12 1.04 -1.26 -4.95 113.70 108.33 1r65 s SER 329 Ca 0.07 0.79 -0.34 0.00 0.48 0.00 0.00 55.95 56.96 1r65 s SER 329 Cb -0.03 -1.39 -0.12 0.00 0.10 0.00 0.00 66.02 64.59 1r65 s SER 329 CO -0.03 -1.71 1.89 -3.20 0.98 0.00 0.00 173.24 171.17 1r65 n ASN 330 N -3.16 3.52 0.24 7.02 4.05 -1.26 -4.87 115.26 120.79 1r65 n ASN 330 Ca 0.08 0.97 0.09 0.00 0.45 0.00 0.00 54.58 56.17 1r65 n ASN 330 Cb 0.60 -1.39 0.58 0.00 1.23 0.00 0.00 39.78 40.80 1r65 n ASN 330 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 177.26 173.56 1r65 h PRO 331 N 9.29 0.00 -2.06 1.20 0.11 -1.92 -3.33 132.00 135.29 1r65 h PRO 331 Ca -0.49 0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.09 1r65 h PRO 331 Cb 1.27 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 31.98 1r65 h PRO 331 CO 0.95 0.20 -1.03 0.44 -0.21 0.00 0.00 178.00 178.35 1r65 n ILE 332 N -3.71 0.32 0.30 4.15 -5.35 -1.26 -4.95 119.36 108.86 1r65 n ILE 332 Ca -0.01 -4.57 0.16 0.00 -0.27 0.00 0.00 62.75 58.06 1r65 n ILE 332 Cb 0.32 -1.23 0.83 0.00 -1.74 0.00 0.00 39.64 37.82 1r65 n ILE 332 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 1r65 h PRO 333 N 3.49 0.00 0.00 6.28 0.13 -1.98 -0.73 132.00 139.18 1r65 h PRO 333 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1r65 h PRO 333 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1r65 h PRO 333 CO 0.56 0.00 0.00 0.11 -0.23 0.00 0.00 178.00 178.44 1r65 h TRP 334 N 0.00 0.00 0.00 1.56 5.08 -1.95 -1.50 115.95 119.14 1r65 h TRP 334 Ca 0.03 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 59.94 1r65 h TRP 334 Cb 0.69 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.84 1r65 h TRP 334 CO 0.00 0.00 -0.29 0.97 -1.28 0.00 0.00 178.44 177.84 1r65 h ILE 335 N 0.00 0.86 -0.06 0.12 2.10 -1.55 -2.64 117.51 116.33 1r65 h ILE 335 Ca 0.00 -1.15 0.02 0.00 1.08 0.00 0.00 64.86 64.81 1r65 h ILE 335 Cb 0.07 1.69 -0.00 0.00 -1.09 0.00 0.00 36.82 37.49 1r65 h ILE 335 CO 0.00 0.28 0.17 0.78 -1.08 0.00 0.00 178.15 178.30 1r65 h ASN 336 N 0.00 0.00 0.05 2.19 -0.26 -1.48 0.13 115.58 116.21 1r65 h ASN 336 Ca -0.00 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.69 1r65 h ASN 336 Cb 0.67 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.92 1r65 h ASN 336 CO 0.04 0.00 -0.13 0.74 -1.06 0.00 0.00 177.43 177.02 1r65 h THR 337 N 0.00 1.16 0.00 2.81 2.02 -1.66 -3.17 112.91 114.08 1r65 h THR 337 Ca 0.03 -0.73 0.00 0.00 0.77 0.00 0.00 66.41 66.48 1r65 h THR 337 Cb 0.36 1.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 1r65 h THR 337 CO -0.00 0.22 -1.68 0.79 0.37 0.00 0.00 175.52 175.22 1r65 n TRP 338 N -4.29 0.00 0.00 3.16 7.02 0.41 -4.98 117.44 118.75 1r65 n TRP 338 Ca -0.01 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.47 1r65 n TRP 338 Cb 0.26 -0.35 0.00 0.00 -2.42 0.00 0.00 31.31 28.80 1r65 n TRP 338 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 1r65 n LEU 339 N -2.02 0.00 -0.83 -0.99 4.77 -0.94 -4.78 117.00 112.21 1r65 n LEU 339 Ca -0.02 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.09 1r65 n LEU 339 Cb 0.48 0.00 0.22 0.00 -2.33 0.00 0.00 43.42 41.79 1r65 n LEU 339 CO 0.43 0.00 0.70 0.52 -1.33 0.00 0.00 177.39 177.70