#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 3.51 0.00 0.00 5.04 -1.26 -5.05 117.35 119.59 1r65 s TYR 2 Ca 0.00 1.70 0.01 0.00 -2.44 0.00 0.00 57.07 56.34 1r65 s TYR 2 Cb 0.00 -3.21 -0.01 0.00 0.35 0.00 0.00 41.96 39.10 1r65 s TYR 2 CO 0.00 -0.49 -0.04 -0.08 -1.34 0.00 0.00 175.55 173.60 1r65 s THR 3 N -1.33 0.26 -1.10 4.34 -1.32 -1.26 -5.02 115.64 110.21 1r65 s THR 3 Ca 0.49 -0.26 0.24 0.00 -1.21 0.00 0.00 61.69 60.94 1r65 s THR 3 Cb -0.28 -0.25 0.25 0.00 -1.51 0.00 0.00 72.50 70.71 1r65 s THR 3 CO 0.36 -0.00 1.77 0.35 -2.21 0.00 0.00 174.62 174.88 1r65 n THR 4 N 2.79 0.35 -3.14 5.08 -2.24 -1.26 -4.41 114.28 111.45 1r65 n THR 4 Ca -0.14 0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 1r65 n THR 4 Cb 0.58 -0.68 -0.01 0.00 -2.10 0.00 0.00 70.33 68.12 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 -2.90 -1.72 0.24 4.78 5.36 -1.26 -4.88 117.98 117.60 1r65 s PHE 5 Ca 0.14 0.13 -0.31 0.00 -0.96 0.00 0.00 56.93 55.93 1r65 s PHE 5 Cb 0.16 0.32 -0.11 0.00 -0.34 0.00 0.00 43.02 43.05 1r65 s PHE 5 CO 0.41 -1.19 1.60 -1.54 -1.46 0.00 0.00 175.22 173.04 1r65 s SER 6 N 1.70 6.47 0.00 6.13 1.04 -1.26 -4.90 113.70 122.87 1r65 s SER 6 Ca 0.18 2.81 0.29 0.00 0.48 0.00 0.00 55.95 59.71 1r65 s SER 6 Cb -0.03 -2.61 1.28 0.00 0.10 0.00 0.00 66.02 64.75 1r65 s SER 6 CO -0.07 -0.88 1.90 0.00 0.98 0.00 0.00 173.24 175.18 1r65 n GLN 7 N 3.08 0.48 -2.80 4.02 0.00 -1.26 -4.73 117.38 116.17 1r65 n GLN 7 Ca 0.11 -0.11 -0.42 0.00 0.00 0.00 0.00 57.00 56.58 1r65 n GLN 7 Cb 0.37 -1.50 -0.03 0.00 0.00 0.00 0.00 30.24 29.08 1r65 n GLN 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1r65 s THR 8 N -2.60 4.88 -0.61 -0.39 2.01 -1.26 -4.99 115.64 112.69 1r65 s THR 8 Ca 0.26 1.87 -0.28 0.00 0.31 0.00 0.00 61.69 63.85 1r65 s THR 8 Cb 0.20 -4.24 0.02 0.00 0.01 0.00 0.00 72.50 68.49 1r65 s THR 8 CO 0.49 0.11 1.36 -0.75 -0.69 0.00 0.00 174.62 175.14 1r65 s LYS 9 N 1.44 3.29 0.21 4.92 2.20 -1.26 -4.99 119.74 125.55 1r65 s LYS 9 Ca 0.46 0.27 0.10 0.00 -0.36 0.00 0.00 55.97 56.43 1r65 s LYS 9 Cb -0.19 -4.13 -0.04 0.00 -1.51 0.00 0.00 37.83 31.96 1r65 s LYS 9 CO 0.21 -1.97 -0.12 0.54 -0.36 0.00 0.00 175.35 173.64 1r65 s ASN 10 N 4.14 4.04 -0.58 1.43 4.22 -1.26 -5.07 114.94 121.86 1r65 s ASN 10 Ca 0.47 -0.71 -0.26 0.00 -2.14 0.00 0.00 52.86 50.22 1r65 s ASN 10 Cb -0.09 -0.59 0.04 0.00 1.28 0.00 0.00 41.25 41.89 1r65 s ASN 10 CO 0.23 0.08 1.06 -0.62 -2.04 0.00 0.00 177.10 175.81 1r65 s ASP 11 N -3.04 6.36 0.60 3.54 -1.08 -1.26 -4.88 116.67 116.90 1r65 s ASP 11 Ca 0.26 -0.21 0.37 0.00 -0.52 0.00 0.00 52.55 52.46 1r65 s ASP 11 Cb -0.08 -2.49 1.82 0.00 -1.46 0.00 0.00 42.92 40.72 1r65 s ASP 11 CO 0.15 -1.38 2.16 1.56 0.52 0.00 0.00 175.17 178.18 1r65 h GLN 12 N 9.46 0.00 0.00 4.34 4.20 -1.98 -2.12 115.11 129.02 1r65 h GLN 12 Ca -0.26 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.45 1r65 h GLN 12 Cb 1.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.84 1r65 h GLN 12 CO 1.14 0.02 0.00 -0.07 -0.67 0.00 0.00 178.83 179.25 1r65 h LEU 13 N 0.00 0.00 -0.83 1.46 3.38 -1.96 -3.19 115.31 114.18 1r65 h LEU 13 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1r65 h LEU 13 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1r65 h LEU 13 CO 0.00 0.00 -0.40 0.29 0.09 0.00 0.00 178.44 178.42 1r65 n LYS 14 N -2.53 1.58 -1.91 1.13 5.02 -0.80 -4.76 118.16 115.89 1r65 n LYS 14 Ca 0.03 -0.77 -0.32 0.00 -2.02 0.00 0.00 58.31 55.23 1r65 n LYS 14 Cb 0.31 -1.31 0.01 0.00 -0.02 0.00 0.00 35.03 34.02 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 -2.07 3.38 0.77 1.97 0.41 -1.21 -5.05 118.70 116.91 1r65 s GLU 15 Ca 0.14 0.96 -0.12 0.00 -0.41 0.00 0.00 54.97 55.54 1r65 s GLU 15 Cb 0.14 -2.05 0.06 0.00 -1.78 0.00 0.00 34.13 30.50 1r65 s GLU 15 CO 0.46 -0.74 1.15 -1.25 -0.49 0.00 0.00 175.26 174.39 1r65 s PRO 16 N -4.68 2.25 0.18 0.39 0.04 -1.26 -4.93 135.00 126.99 1r65 s PRO 16 Ca 0.59 0.22 -0.13 0.00 0.04 0.00 0.00 61.00 61.72 1r65 s PRO 16 Cb -0.13 -1.98 0.08 0.00 0.04 0.00 0.00 34.50 32.51 1r65 s PRO 16 CO 0.46 -1.41 1.79 0.52 0.04 0.00 0.00 177.00 178.40 1r65 h MET 17 N -0.92 0.81 -5.68 4.56 2.86 -1.95 -3.38 114.93 111.22 1r65 h MET 17 Ca -0.46 -0.09 -0.47 0.00 -2.06 0.00 0.00 59.70 56.62 1r65 h MET 17 Cb 1.31 -0.16 -0.17 0.00 0.06 0.00 0.00 31.60 32.63 1r65 h MET 17 CO 0.65 0.61 -0.77 -0.06 1.06 0.00 0.00 176.91 178.41 1r65 s PHE 18 N -5.89 1.65 -0.24 -0.22 0.08 -1.26 -0.55 117.98 111.55 1r65 s PHE 18 Ca -0.13 -0.52 0.00 0.00 0.12 0.00 0.00 56.93 56.40 1r65 s PHE 18 Cb 0.13 -0.82 0.00 0.00 -0.57 0.00 0.00 43.02 41.75 1r65 s PHE 18 CO 0.77 0.26 0.00 1.19 -0.10 0.00 0.00 175.22 177.34 1r65 n PHE 19 N 0.26 0.00 -0.91 0.36 3.72 0.30 -4.85 117.46 116.34 1r65 n PHE 19 Ca -0.13 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.27 1r65 n PHE 19 Cb 0.58 -1.37 0.00 0.00 -0.94 0.00 0.00 39.48 37.74 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 -0.81 1.37 3.73 1.37 0.00 -1.26 -5.02 105.19 104.58 1r65 n GLY 20 Ca -0.02 -1.81 -0.41 0.00 0.00 0.00 0.00 46.02 43.77 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 2.42 4.47 0.55 1.61 0.74 -1.26 -4.85 119.66 123.34 1r65 s GLN 21 Ca 0.00 1.87 -0.21 0.00 0.05 0.00 0.00 55.36 57.08 1r65 s GLN 21 Cb 0.00 -3.26 -0.06 0.00 1.10 0.00 0.00 33.01 30.79 1r65 s GLN 21 CO 0.00 -0.14 1.06 -2.30 -0.55 0.00 0.00 175.29 173.36 1r65 n PRO 22 N 2.83 1.18 -2.12 1.67 -0.02 -1.26 -4.50 135.00 132.77 1r65 n PRO 22 Ca 0.06 0.44 -0.42 0.00 -2.02 0.00 0.00 63.50 61.56 1r65 n PRO 22 Cb 0.45 -2.22 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 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 -1.41 3.01 0.00 -1.45 1.01 -1.26 -4.54 120.40 115.77 1r65 s VAL 23 Ca 0.72 0.80 0.00 0.00 0.00 0.00 0.00 61.98 63.50 1r65 s VAL 23 Cb -0.45 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.42 1r65 s VAL 23 CO 0.50 0.11 0.00 -0.46 0.00 0.00 0.00 175.10 175.25 1r65 n ASN 24 N 2.91 0.00 -4.73 3.32 0.23 -1.26 -4.50 115.26 111.23 1r65 n ASN 24 Ca 0.08 0.00 -0.41 0.00 -0.53 0.00 0.00 54.58 53.72 1r65 n ASN 24 Cb 0.42 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 38.08 1r65 n ASN 24 CO 0.00 0.00 0.00 0.68 -0.93 0.00 0.00 177.26 177.01 1r65 s VAL 25 N 0.00 4.18 -0.53 3.53 -7.23 -1.26 -4.94 120.40 114.15 1r65 s VAL 25 Ca 0.00 1.76 -0.20 0.00 -1.81 0.00 0.00 61.98 61.72 1r65 s VAL 25 Cb 0.00 -4.12 0.06 0.00 0.56 0.00 0.00 36.38 32.88 1r65 s VAL 25 CO 0.00 0.24 0.71 0.00 -0.31 0.00 0.00 175.10 175.74 1r65 s ALA 26 N 0.23 3.33 0.11 1.32 0.00 -1.26 -4.87 121.76 120.62 1r65 s ALA 26 Ca 0.51 -1.73 0.07 0.00 0.00 0.00 0.00 51.96 50.82 1r65 s ALA 26 Cb -0.27 -3.47 -0.03 0.00 0.00 0.00 0.00 23.12 19.34 1r65 s ALA 26 CO 0.32 -2.17 -0.18 -0.98 0.00 0.00 0.00 175.76 172.75 1r65 s ARG 27 N 2.95 1.07 -0.05 0.00 1.70 -1.26 -5.06 118.95 118.31 1r65 s ARG 27 Ca 0.18 -1.16 0.07 0.00 -0.47 0.00 0.00 55.73 54.35 1r65 s ARG 27 Cb -0.19 -1.21 0.10 0.00 -0.57 0.00 0.00 34.95 33.08 1r65 s ARG 27 CO 0.12 0.27 0.99 0.66 -1.08 0.00 0.00 175.30 176.27 1r65 n TYR 28 N 0.97 0.00 0.78 5.89 4.01 -1.26 -4.71 117.16 122.84 1r65 n TYR 28 Ca -0.19 -0.40 0.13 0.00 -0.16 0.00 0.00 57.90 57.28 1r65 n TYR 28 Cb 0.54 -0.08 0.43 0.00 -0.31 0.00 0.00 39.34 39.93 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 -0.56 0.49 -3.61 7.72 5.75 -1.26 -4.86 116.55 120.22 1r65 n ASP 29 Ca 0.06 0.41 -0.13 0.00 -0.01 0.00 0.00 54.79 55.11 1r65 n ASP 29 Cb 0.61 -0.46 -0.06 0.00 -1.03 0.00 0.00 41.12 40.18 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 -3.07 1.00 -0.00 0.11 -2.07 -1.26 -5.18 119.66 109.19 1r65 s GLN 30 Ca 0.11 -0.32 -0.23 0.00 -1.82 0.00 0.00 55.36 53.10 1r65 s GLN 30 Cb 0.15 0.45 0.05 0.00 -1.09 0.00 0.00 33.01 32.57 1r65 s GLN 30 CO 0.60 -0.36 0.50 1.14 -1.32 0.00 0.00 175.29 175.86 1r65 s GLN 31 N -2.58 0.93 0.07 9.60 0.00 -1.26 -4.93 119.66 121.49 1r65 s GLN 31 Ca -0.05 -0.08 -0.16 0.00 -0.00 0.00 0.00 55.36 55.08 1r65 s GLN 31 Cb -0.01 0.43 -0.15 0.00 0.00 0.00 0.00 33.01 33.28 1r65 s GLN 31 CO -0.03 -0.30 1.30 -0.22 0.00 0.00 0.00 175.29 176.04 1r65 h LYS 32 N 3.16 0.64 -4.47 9.60 3.64 -1.87 -3.40 116.57 123.87 1r65 h LYS 32 Ca -0.29 -0.46 -0.64 0.00 -1.27 0.00 0.00 60.65 57.99 1r65 h LYS 32 Cb 1.18 0.08 -0.39 0.00 -0.41 0.00 0.00 32.23 32.69 1r65 h LYS 32 CO 0.40 1.08 -0.76 0.71 -2.27 0.00 0.00 179.45 178.62 1r65 s TYR 33 N -3.87 2.97 0.53 1.91 2.02 -1.26 -4.99 117.35 114.66 1r65 s TYR 33 Ca -0.12 -2.32 0.20 0.00 -0.37 0.00 0.00 57.07 54.46 1r65 s TYR 33 Cb 0.07 -2.15 1.41 0.00 -0.40 0.00 0.00 41.96 40.89 1r65 s TYR 33 CO 0.85 -0.87 2.17 0.22 -1.57 0.00 0.00 175.55 176.34 1r65 h ASP 34 N 7.81 0.00 -0.82 2.29 -0.00 -2.00 -2.94 116.42 120.77 1r65 h ASP 34 Ca -0.13 0.00 0.13 0.00 -0.00 0.00 0.00 57.03 57.04 1r65 h ASP 34 Cb 1.04 0.00 -0.06 0.00 -0.00 0.00 0.00 39.33 40.31 1r65 h ASP 34 CO 0.47 0.01 0.54 -0.29 -0.00 0.00 0.00 179.24 179.97 1r65 h ILE 35 N 0.00 0.85 -0.02 2.25 6.09 -1.98 -1.09 117.51 123.60 1r65 h ILE 35 Ca -0.00 -0.21 -0.15 0.00 -1.37 0.00 0.00 64.86 63.13 1r65 h ILE 35 Cb 0.02 0.19 -0.02 0.00 0.47 0.00 0.00 36.82 37.49 1r65 h ILE 35 CO 0.00 0.11 -0.67 -0.26 -3.07 0.00 0.00 178.15 174.26 1r65 h PHE 36 N 0.60 0.16 -0.25 2.19 0.04 -1.87 -1.05 116.94 116.75 1r65 h PHE 36 Ca 0.40 -0.07 -0.17 0.00 2.80 0.00 0.00 57.97 60.93 1r65 h PHE 36 Cb 0.70 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.82 1r65 h PHE 36 CO -0.00 0.75 -0.53 1.49 -0.60 0.00 0.00 178.31 179.42 1r65 h GLU 37 N 0.08 0.74 -0.63 1.51 4.57 -1.44 -1.47 114.58 117.94 1r65 h GLU 37 Ca -0.01 -0.45 -0.03 0.00 -1.18 0.00 0.00 59.36 57.68 1r65 h GLU 37 Cb 1.20 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.81 1r65 h GLU 37 CO 0.10 1.08 0.26 0.87 -1.18 0.00 0.00 179.01 180.14 1r65 h LYS 38 N 0.57 0.93 -0.57 1.92 1.79 -1.00 -1.76 116.57 118.45 1r65 h LYS 38 Ca 0.02 -0.16 -0.04 0.00 -2.18 0.00 0.00 60.65 58.28 1r65 h LYS 38 Cb 1.10 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 31.57 1r65 h LYS 38 CO 0.11 0.78 0.19 -0.07 -1.08 0.00 0.00 179.45 179.38 1r65 h LEU 39 N 0.88 0.82 -0.18 2.94 3.38 -1.05 -0.76 115.31 121.34 1r65 h LEU 39 Ca 0.21 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1r65 h LEU 39 Cb 0.19 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1r65 h LEU 39 CO -0.02 0.80 0.12 0.40 0.09 0.00 0.00 178.44 179.83 1r65 h ILE 40 N 0.80 1.06 -0.83 1.22 2.04 -1.01 -0.26 117.51 120.53 1r65 h ILE 40 Ca 0.19 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 1r65 h ILE 40 Cb 0.26 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 37.12 1r65 h ILE 40 CO -0.01 0.06 0.48 -0.33 0.00 0.00 0.00 178.15 178.35 1r65 h GLU 41 N 0.23 1.14 0.22 2.37 5.08 -1.17 -0.93 114.58 121.52 1r65 h GLU 41 Ca 0.07 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1r65 h GLU 41 Cb -0.01 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.02 1r65 h GLU 41 CO -0.01 0.82 -0.10 0.87 -1.00 0.00 0.00 179.01 179.58 1r65 h LYS 42 N 1.14 -0.28 -0.75 2.33 1.79 -0.82 -1.44 116.57 118.54 1r65 h LYS 42 Ca 0.29 0.02 0.08 0.00 -2.18 0.00 0.00 60.65 58.86 1r65 h LYS 42 Cb -0.01 0.06 -0.06 0.00 -1.58 0.00 0.00 32.23 30.64 1r65 h LYS 42 CO -0.05 -0.07 0.42 0.37 -1.08 0.00 0.00 179.45 179.04 1r65 h GLN 43 N -0.44 0.72 -0.46 3.15 5.75 -0.88 -1.10 115.11 121.86 1r65 h GLN 43 Ca -0.03 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.39 1r65 h GLN 43 Cb 0.34 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.70 1r65 h GLN 43 CO 0.05 0.48 0.13 -0.07 -2.65 0.00 0.00 178.83 176.77 1r65 h LEU 44 N 0.74 0.62 -1.13 -2.39 3.38 -1.01 -1.80 115.31 113.73 1r65 h LEU 44 Ca 0.35 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 1r65 h LEU 44 Cb 0.28 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1r65 h LEU 44 CO -0.22 0.61 -0.14 0.77 0.09 0.00 0.00 178.44 179.54 1r65 h SER 45 N 0.67 0.00 -0.14 -0.43 4.64 -0.11 -2.94 113.55 115.24 1r65 h SER 45 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1r65 h SER 45 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1r65 h SER 45 CO -0.01 0.14 0.00 0.49 -0.87 0.00 0.00 176.83 176.59 1r65 n PHE 46 N -3.27 0.17 -1.61 4.77 3.72 -0.69 -4.97 117.46 115.57 1r65 n PHE 46 Ca 0.01 -0.08 -0.52 0.00 -0.05 0.00 0.00 57.45 56.80 1r65 n PHE 46 Cb 0.40 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.88 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 0.27 1.66 -4.03 1.38 -0.00 -1.11 -4.98 117.46 110.65 1r65 n PHE 47 Ca 0.17 0.58 -0.08 0.00 -0.00 0.00 0.00 57.45 58.11 1r65 n PHE 47 Cb 0.33 -2.37 -0.10 0.00 -0.00 0.00 0.00 39.48 37.33 1r65 n PHE 47 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.76 178.43 1r65 s TRP 48 N 0.89 0.39 -0.28 -5.13 1.48 -1.26 -5.14 118.94 109.90 1r65 s TRP 48 Ca 0.85 -0.83 -0.03 0.00 -1.06 0.00 0.00 56.10 55.03 1r65 s TRP 48 Cb -0.93 -0.29 0.03 0.00 -1.16 0.00 0.00 33.47 31.12 1r65 s TRP 48 CO 0.48 -0.34 -0.00 1.03 -4.06 0.00 0.00 176.95 174.05 1r65 s ARG 49 N -3.15 2.80 0.13 3.25 1.81 -1.26 -5.03 118.95 117.50 1r65 s ARG 49 Ca -0.00 -1.02 -0.19 0.00 -1.72 0.00 0.00 55.73 52.80 1r65 s ARG 49 Cb 0.02 -3.16 -0.02 0.00 -0.45 0.00 0.00 34.95 31.35 1r65 s ARG 49 CO -0.07 -0.48 1.74 -1.00 -0.68 0.00 0.00 175.30 174.82 1r65 h PRO 50 N 8.08 0.16 0.00 3.54 0.13 -1.94 -2.31 132.00 139.65 1r65 h PRO 50 Ca -0.29 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1r65 h PRO 50 Cb 1.10 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1r65 h PRO 50 CO 0.57 0.11 0.00 0.39 -0.23 0.00 0.00 178.00 178.84 1r65 n GLU 51 N -5.06 0.00 0.12 0.86 4.71 -1.26 -0.29 120.64 119.72 1r65 n GLU 51 Ca -0.02 0.36 0.04 0.00 -0.01 0.00 0.00 57.16 57.54 1r65 n GLU 51 Cb 0.09 -1.50 0.01 0.00 -1.01 0.00 0.00 31.44 29.04 1r65 n GLU 51 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 1r65 h GLU 52 N 0.00 0.00 -6.51 3.49 5.08 -1.85 -3.45 114.58 111.33 1r65 h GLU 52 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 1r65 h GLU 52 Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 1r65 h GLU 52 CO 0.00 0.30 0.57 0.54 -1.00 0.00 0.00 179.01 179.42 1r65 s VAL 53 N -3.04 3.93 -0.28 3.13 0.11 0.60 -4.98 120.40 119.87 1r65 s VAL 53 Ca 0.02 1.42 -0.29 0.00 -2.93 0.00 0.00 61.98 60.20 1r65 s VAL 53 Cb 0.08 -3.91 0.01 0.00 -1.53 0.00 0.00 36.38 31.03 1r65 s VAL 53 CO 0.76 0.13 1.12 -0.62 -3.33 0.00 0.00 175.10 173.16 1r65 s ASP 54 N 0.91 6.93 -0.11 3.54 2.15 -1.26 -4.87 116.67 123.97 1r65 s ASP 54 Ca 0.58 1.21 0.16 0.00 0.43 0.00 0.00 52.55 54.93 1r65 s ASP 54 Cb -0.30 -2.54 0.24 0.00 -0.30 0.00 0.00 42.92 40.02 1r65 s ASP 54 CO 0.30 -0.85 1.12 1.33 -0.17 0.00 0.00 175.17 176.90 1r65 n VAL 55 N 5.75 1.65 0.18 1.11 0.24 -1.26 -4.34 118.33 121.67 1r65 n VAL 55 Ca 0.13 -1.96 0.05 0.00 -2.04 0.00 0.00 64.34 60.51 1r65 n VAL 55 Cb 0.47 -0.11 0.50 0.00 -1.47 0.00 0.00 33.84 33.22 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 0.00 0.10 1.71 -1.34 4.64 -1.93 -2.25 113.55 114.49 1r65 h SER 56 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1r65 h SER 56 Cb 0.99 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 1r65 h SER 56 CO 0.00 0.21 -0.28 -0.09 -0.87 0.00 0.00 176.83 175.80 1r65 h ARG 57 N 0.11 0.00 -0.59 4.77 2.43 -1.96 -3.30 114.38 115.84 1r65 h ARG 57 Ca 0.02 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.22 1r65 h ARG 57 Cb 0.23 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 1r65 h ARG 57 CO 0.01 0.00 0.39 -0.44 -1.51 0.00 0.00 179.97 178.42 1r65 h ASP 58 N 0.00 0.62 -0.14 -3.80 5.19 -1.75 -1.50 116.42 115.05 1r65 h ASP 58 Ca 0.00 -0.01 0.01 0.00 -0.62 0.00 0.00 57.03 56.41 1r65 h ASP 58 Cb 1.00 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 40.35 1r65 h ASP 58 CO 0.00 0.44 0.07 -0.09 -3.12 0.00 0.00 179.24 176.54 1r65 h ARG 59 N 0.73 0.14 0.03 3.56 2.43 -1.64 0.20 114.38 119.83 1r65 h ARG 59 Ca 0.23 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1r65 h ARG 59 Cb 0.02 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1r65 h ARG 59 CO -0.06 0.10 -0.03 0.82 -1.51 0.00 0.00 179.97 179.28 1r65 h ILE 60 N 0.15 0.92 0.08 1.20 1.08 -1.53 -2.26 117.51 117.14 1r65 h ILE 60 Ca 0.06 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.55 1r65 h ILE 60 Cb 0.01 0.92 -0.03 0.00 -3.07 0.00 0.00 36.82 34.65 1r65 h ILE 60 CO -0.04 0.00 -0.23 0.44 -0.69 0.00 0.00 178.15 177.63 1r65 h ASP 61 N -0.07 -0.65 -0.21 1.72 3.45 -1.08 -2.21 116.42 117.37 1r65 h ASP 61 Ca 0.01 0.08 0.06 0.00 0.43 0.00 0.00 57.03 57.60 1r65 h ASP 61 Cb 0.08 0.25 -0.06 0.00 -0.56 0.00 0.00 39.33 39.04 1r65 h ASP 61 CO -0.02 -0.31 -0.20 0.22 -1.57 0.00 0.00 179.24 177.37 1r65 h TYR 62 N -0.40 -0.52 -0.46 4.55 3.20 -0.86 -0.86 116.97 121.62 1r65 h TYR 62 Ca 0.04 0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.00 1r65 h TYR 62 Cb 0.44 0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.95 1r65 h TYR 62 CO -0.23 -0.28 0.31 0.37 -1.64 0.00 0.00 178.16 176.69 1r65 h GLN 63 N -0.21 0.36 0.00 1.82 -0.00 -1.30 -0.46 115.11 115.32 1r65 h GLN 63 Ca 0.13 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.76 1r65 h GLN 63 Cb 0.40 -0.08 0.00 0.00 0.00 0.00 0.00 27.48 27.80 1r65 h GLN 63 CO -0.34 0.23 0.00 0.00 0.00 0.00 0.00 178.83 178.73 1r65 h ALA 64 N 1.75 1.00 -2.82 3.38 0.00 -0.53 -3.45 119.26 118.60 1r65 h ALA 64 Ca 0.20 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.60 1r65 h ALA 64 Cb 0.33 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.16 1r65 h ALA 64 CO -0.05 0.00 0.54 -0.51 0.00 0.00 0.00 179.25 179.23 1r65 s LEU 65 N -4.76 4.43 0.60 0.00 1.02 -0.18 -5.01 118.68 114.78 1r65 s LEU 65 Ca 0.06 2.44 -0.18 0.00 0.02 0.00 0.00 54.13 56.47 1r65 s LEU 65 Cb 0.10 -3.72 -0.03 0.00 0.02 0.00 0.00 46.19 42.56 1r65 s LEU 65 CO 0.48 -0.39 1.17 -2.16 0.02 0.00 0.00 176.35 175.46 1r65 s PRO 66 N -1.75 2.97 0.21 1.29 0.04 -1.26 -4.71 135.00 131.79 1r65 s PRO 66 Ca 0.49 1.67 -0.17 0.00 0.04 0.00 0.00 61.00 63.03 1r65 s PRO 66 Cb -0.34 -1.95 0.21 0.00 0.04 0.00 0.00 34.50 32.46 1r65 s PRO 66 CO 0.45 -1.17 1.58 0.93 0.04 0.00 0.00 177.00 178.83 1r65 h GLU 67 N 0.71 -0.08 -0.09 4.56 4.39 -1.96 0.12 114.58 122.24 1r65 h GLU 67 Ca -0.49 0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.24 1r65 h GLU 67 Cb 1.28 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.94 1r65 h GLU 67 CO 0.55 -0.05 0.06 1.12 -1.16 0.00 0.00 179.01 179.53 1r65 h HIS 68 N -0.08 0.00 0.00 4.33 2.07 -1.91 0.13 115.15 119.69 1r65 h HIS 68 Ca 0.30 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.68 1r65 h HIS 68 Cb 0.57 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.53 1r65 h HIS 68 CO -0.68 0.00 -0.68 0.93 -3.07 0.00 0.00 177.93 174.43 1r65 h GLU 69 N 0.00 0.00 -0.35 5.12 5.08 -1.15 -1.77 114.58 121.51 1r65 h GLU 69 Ca 0.04 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.26 1r65 h GLU 69 Cb 0.16 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1r65 h GLU 69 CO -0.00 0.68 -0.33 0.87 -1.00 0.00 0.00 179.01 179.23 1r65 h LYS 70 N 0.00 0.79 -0.47 2.33 1.57 0.10 -1.21 116.57 119.67 1r65 h LYS 70 Ca -0.01 -0.38 -0.02 0.00 -1.87 0.00 0.00 60.65 58.38 1r65 h LYS 70 Cb 1.26 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.55 1r65 h LYS 70 CO 0.09 1.00 0.23 1.25 -0.57 0.00 0.00 179.45 181.45 1r65 h HIS 71 N 0.66 0.67 0.23 -1.35 2.76 -0.79 -0.17 115.15 117.16 1r65 h HIS 71 Ca 0.07 -0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.20 1r65 h HIS 71 Cb 0.88 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.63 1r65 h HIS 71 CO 0.05 0.53 -0.11 0.82 -1.30 0.00 0.00 177.93 177.92 1r65 h ILE 72 N 0.62 0.82 -0.05 6.26 2.04 -1.17 -0.89 117.51 125.14 1r65 h ILE 72 Ca 0.16 -0.22 0.01 0.00 1.00 0.00 0.00 64.86 65.81 1r65 h ILE 72 Cb 0.11 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1r65 h ILE 72 CO -0.02 0.05 -0.00 0.15 0.00 0.00 0.00 178.15 178.33 1r65 h PHE 73 N -0.41 -0.01 -0.13 1.37 3.57 -1.10 -2.32 116.94 117.91 1r65 h PHE 73 Ca -0.03 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.34 1r65 h PHE 73 Cb 0.32 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 1r65 h PHE 73 CO -0.03 -0.01 -0.51 0.97 -2.23 0.00 0.00 178.31 176.50 1r65 h ILE 74 N 0.02 1.34 -0.47 1.41 6.09 -1.05 -2.18 117.51 122.66 1r65 h ILE 74 Ca 0.02 -1.75 -0.07 0.00 -1.37 0.00 0.00 64.86 61.69 1r65 h ILE 74 Cb 0.03 1.80 -0.02 0.00 0.47 0.00 0.00 36.82 39.09 1r65 h ILE 74 CO -0.04 0.53 0.02 0.28 -3.07 0.00 0.00 178.15 175.87 1r65 h SER 75 N 0.28 0.81 -0.55 2.19 0.02 -1.08 -0.84 113.55 114.38 1r65 h SER 75 Ca 0.01 -0.30 -0.05 0.00 -0.84 0.00 0.00 61.79 60.62 1r65 h SER 75 Cb 0.99 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.29 1r65 h SER 75 CO 0.09 0.91 0.16 -1.13 -1.14 0.00 0.00 176.83 175.71 1r65 h ASN 76 N 0.68 0.82 -0.61 3.07 -1.24 -1.35 -2.49 115.58 114.46 1r65 h ASN 76 Ca 0.14 -0.22 -0.06 0.00 0.71 0.00 0.00 56.30 56.87 1r65 h ASN 76 Cb 0.48 -0.22 -0.03 0.00 0.73 0.00 0.00 38.32 39.29 1r65 h ASN 76 CO 0.02 0.82 0.15 0.25 -1.29 0.00 0.00 177.43 177.38 1r65 h LEU 77 N 0.78 0.93 -1.38 0.34 6.46 -1.21 -2.18 115.31 119.05 1r65 h LEU 77 Ca 0.18 -0.23 0.00 0.00 -0.12 0.00 0.00 57.88 57.70 1r65 h LEU 77 Cb 0.30 -0.25 -0.03 0.00 -0.73 0.00 0.00 40.66 39.96 1r65 h LEU 77 CO -0.00 0.92 0.37 0.11 -0.62 0.00 0.00 178.44 179.22 1r65 h LYS 78 N 0.90 0.78 -0.31 1.25 1.57 -0.95 -0.54 116.57 119.28 1r65 h LYS 78 Ca 0.19 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.77 1r65 h LYS 78 Cb 0.35 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.49 1r65 h LYS 78 CO 0.00 0.54 -0.36 -0.92 -0.57 0.00 0.00 179.45 178.14 1r65 h TYR 79 N 0.80 0.96 -0.76 -1.35 3.20 -1.08 -2.34 116.97 116.41 1r65 h TYR 79 Ca 0.21 -0.30 -0.03 0.00 3.14 0.00 0.00 58.73 61.75 1r65 h TYR 79 Cb -0.06 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 37.98 1r65 h TYR 79 CO 0.00 1.08 0.36 1.96 -1.64 0.00 0.00 178.16 179.92 1r65 h GLN 80 N 0.56 1.09 -0.90 1.82 4.20 -0.92 -1.05 115.11 119.92 1r65 h GLN 80 Ca 0.04 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1r65 h GLN 80 Cb 0.94 -0.19 -0.04 0.00 0.30 0.00 0.00 27.48 28.48 1r65 h GLN 80 CO 0.09 0.86 0.57 1.15 -0.67 0.00 0.00 178.83 180.83 1r65 h THR 81 N 1.07 1.24 -0.04 -0.54 2.02 -1.01 -1.61 112.91 114.04 1r65 h THR 81 Ca 0.26 -0.46 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 1r65 h THR 81 Cb 0.13 -0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 66.47 1r65 h THR 81 CO -0.03 0.24 -0.01 0.25 0.37 0.00 0.00 175.52 176.34 1r65 h LEU 82 N 1.22 0.07 -0.60 2.58 6.46 -0.85 -1.35 115.31 122.84 1r65 h LEU 82 Ca 0.33 -0.36 0.05 0.00 -0.12 0.00 0.00 57.88 57.77 1r65 h LEU 82 Cb -0.11 -0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 39.75 1r65 h LEU 82 CO -0.07 0.42 0.34 -0.07 -0.62 0.00 0.00 178.44 178.44 1r65 h LEU 83 N -0.27 0.52 -0.70 2.25 3.38 -0.89 -1.77 115.31 117.83 1r65 h LEU 83 Ca 0.01 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1r65 h LEU 83 Cb 0.38 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1r65 h LEU 83 CO 0.00 0.35 -0.35 0.44 0.09 0.00 0.00 178.44 178.97 1r65 h ASP 84 N 0.65 0.00 -0.47 -0.43 3.32 -1.31 -0.67 116.42 117.50 1r65 h ASP 84 Ca 0.26 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.24 1r65 h ASP 84 Cb 0.12 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 1r65 h ASP 84 CO -0.15 0.35 0.03 0.28 -1.72 0.00 0.00 179.24 178.03 1r65 h SER 85 N 0.00 0.79 -0.24 6.45 0.02 -0.56 -1.00 113.55 119.00 1r65 h SER 85 Ca -0.00 -0.29 -0.16 0.00 -0.84 0.00 0.00 61.79 60.50 1r65 h SER 85 Cb 0.99 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.32 1r65 h SER 85 CO 0.05 0.88 -0.46 0.40 -1.14 0.00 0.00 176.83 176.56 1r65 h ILE 86 N 0.67 1.30 0.00 3.27 2.04 -1.16 -3.19 117.51 120.45 1r65 h ILE 86 Ca 0.14 -1.67 0.00 0.00 1.00 0.00 0.00 64.86 64.33 1r65 h ILE 86 Cb 0.46 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 1r65 h ILE 86 CO 0.02 0.53 0.00 0.00 0.00 0.00 0.00 178.15 178.70 1r65 n GLN 87 N -4.14 0.07 0.06 2.37 1.13 -0.28 -0.93 117.38 115.66 1r65 n GLN 87 Ca -0.05 0.23 -0.06 0.00 -1.94 0.00 0.00 57.00 55.18 1r65 n GLN 87 Cb 0.58 -1.61 -0.10 0.00 0.11 0.00 0.00 30.24 29.21 1r65 n GLN 87 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1r65 h GLY 88 N 3.22 0.00 0.00 1.08 0.00 -1.16 -3.40 103.07 102.82 1r65 h GLY 88 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.19 1r65 h GLY 88 CO 0.00 0.00 -1.60 -0.96 0.00 0.00 0.00 176.54 173.98 1r65 n ARG 89 N -3.28 2.06 -0.02 4.80 1.85 -1.12 -4.72 116.66 116.22 1r65 n ARG 89 Ca -0.02 -0.02 -0.12 0.00 -1.00 0.00 0.00 57.85 56.69 1r65 n ARG 89 Cb 0.93 -1.24 -0.06 0.00 -1.05 0.00 0.00 32.46 31.03 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 0.15 -0.98 2.89 0.02 -1.24 -2.11 113.55 112.28 1r65 h SER 90 Ca -0.20 -0.21 0.13 0.00 -0.84 0.00 0.00 61.79 60.66 1r65 h SER 90 Cb 1.36 -0.04 -0.09 0.00 0.14 0.00 0.00 62.40 63.77 1r65 h SER 90 CO 0.01 0.32 0.61 -0.65 -1.14 0.00 0.00 176.83 175.98 1r65 h PRO 91 N -0.04 0.91 -0.16 3.45 0.11 -1.81 0.58 132.00 135.04 1r65 h PRO 91 Ca 0.03 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.04 1r65 h PRO 91 Cb 0.23 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 31.13 1r65 h PRO 91 CO -0.00 0.60 -0.07 -0.91 -0.21 0.00 0.00 178.00 177.41 1r65 h ASN 92 N 0.94 0.35 -0.20 -2.05 2.35 -1.83 -0.04 115.58 115.09 1r65 h ASN 92 Ca 0.50 -0.41 -0.18 0.00 -0.55 0.00 0.00 56.30 55.66 1r65 h ASN 92 Cb 0.52 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.80 1r65 h ASN 92 CO -0.28 0.67 -0.59 0.58 -1.65 0.00 0.00 177.43 176.16 1r65 h VAL 93 N 0.02 1.30 0.13 2.81 2.07 -1.05 -3.11 116.25 118.40 1r65 h VAL 93 Ca 0.04 -1.80 -0.32 0.00 0.82 0.00 0.00 66.70 65.43 1r65 h VAL 93 Cb 0.54 1.86 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 1r65 h VAL 93 CO 0.02 0.57 -1.65 0.00 0.02 0.00 0.00 177.57 176.53 1r65 h ALA 94 N 0.59 0.30 0.04 1.67 0.00 -0.98 -3.42 119.26 117.47 1r65 h ALA 94 Ca -0.02 -1.18 -0.38 0.00 0.00 0.00 0.00 54.91 53.34 1r65 h ALA 94 Cb 1.21 0.39 -0.05 0.00 0.00 0.00 0.00 17.79 19.34 1r65 h ALA 94 CO 0.13 1.17 -2.22 1.28 0.00 0.00 0.00 179.25 179.60 1r65 n LEU 95 N -3.46 2.59 -0.28 0.00 4.77 -0.04 -4.55 117.00 116.03 1r65 n LEU 95 Ca -0.20 0.10 0.08 0.00 -0.03 0.00 0.00 56.01 55.96 1r65 n LEU 95 Cb 1.05 -0.96 0.20 0.00 -2.33 0.00 0.00 43.42 41.38 1r65 n LEU 95 CO 0.49 0.79 0.84 0.25 -1.33 0.00 0.00 177.39 178.43 1r65 h LEU 96 N -0.25 -0.32 -0.35 2.23 5.85 -1.44 0.21 115.31 121.23 1r65 h LEU 96 Ca -0.53 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.40 1r65 h LEU 96 Cb 1.83 0.36 0.00 0.00 0.37 0.00 0.00 40.66 43.22 1r65 h LEU 96 CO -0.11 -0.20 0.00 -2.65 -0.34 0.00 0.00 178.44 175.14 1r65 n PRO 97 N -5.35 0.06 0.00 5.25 -0.02 -1.26 -2.96 135.00 130.71 1r65 n PRO 97 Ca 0.16 0.43 0.05 0.00 -2.02 0.00 0.00 63.50 62.12 1r65 n PRO 97 Cb 0.55 -1.64 -0.02 0.00 -0.02 0.00 0.00 33.50 32.38 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 -1.75 1.01 -4.75 2.45 4.77 0.70 -4.98 117.00 114.45 1r65 n LEU 98 Ca 0.01 -0.69 -0.40 0.00 -0.03 0.00 0.00 56.01 54.91 1r65 n LEU 98 Cb 0.10 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.13 1r65 n LEU 98 CO 0.09 0.21 0.64 -0.63 -1.33 0.00 0.00 177.39 176.38 1r65 s ILE 99 N -1.57 4.08 -0.02 -0.08 1.01 -1.07 -0.54 121.20 123.02 1r65 s ILE 99 Ca 0.07 2.07 0.03 0.00 0.00 0.00 0.00 60.65 62.82 1r65 s ILE 99 Cb 0.08 -4.32 0.04 0.00 0.01 0.00 0.00 42.46 38.27 1r65 s ILE 99 CO 0.31 0.50 0.94 -1.54 0.00 0.00 0.00 174.94 175.15 1r65 n SER 100 N 1.50 1.64 -3.99 3.58 3.41 0.29 -3.98 113.62 116.06 1r65 n SER 100 Ca -0.02 -1.99 -0.21 0.00 -0.26 0.00 0.00 58.87 56.39 1r65 n SER 100 Cb 0.47 -0.07 -0.16 0.00 -0.26 0.00 0.00 64.21 64.20 1r65 n SER 100 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1r65 s ILE 101 N -1.06 0.83 0.24 -1.33 -4.36 -1.26 -4.64 121.20 109.62 1r65 s ILE 101 Ca 0.05 -0.36 -0.04 0.00 -0.26 0.00 0.00 60.65 60.03 1r65 s ILE 101 Cb 0.04 -0.75 0.21 0.00 1.25 0.00 0.00 42.46 43.20 1r65 s ILE 101 CO 0.00 0.27 1.77 1.55 0.24 0.00 0.00 174.94 178.77 1r65 h PRO 102 N 6.57 0.59 -0.61 0.37 0.13 -1.90 -2.22 132.00 134.94 1r65 h PRO 102 Ca -0.34 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 64.73 1r65 h PRO 102 Cb 1.17 -0.13 -0.03 0.00 0.13 0.00 0.00 31.00 32.14 1r65 h PRO 102 CO 0.48 0.39 0.28 1.05 -0.23 0.00 0.00 178.00 179.98 1r65 h GLU 103 N 0.61 0.86 -0.07 0.86 9.09 -1.92 -1.08 114.58 122.94 1r65 h GLU 103 Ca 0.40 -0.11 -0.23 0.00 0.05 0.00 0.00 59.36 59.47 1r65 h GLU 103 Cb 0.48 -0.16 0.01 0.00 -1.65 0.00 0.00 28.75 27.43 1r65 h GLU 103 CO -0.31 0.68 -0.87 1.25 0.05 0.00 0.00 179.01 179.81 1r65 h LEU 104 N 0.86 0.76 -0.19 3.06 5.85 -1.86 -1.59 115.31 122.20 1r65 h LEU 104 Ca 0.21 -0.55 0.00 0.00 0.84 0.00 0.00 57.88 58.38 1r65 h LEU 104 Cb 0.10 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 1r65 h LEU 104 CO -0.03 1.34 0.12 -0.08 -0.34 0.00 0.00 178.44 179.46 1r65 h GLU 105 N 0.39 0.25 -0.27 1.25 4.81 -0.96 -1.17 114.58 118.88 1r65 h GLU 105 Ca -0.07 -0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.04 1r65 h GLU 105 Cb 1.49 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.80 1r65 h GLU 105 CO 0.17 0.16 -0.28 1.15 -0.73 0.00 0.00 179.01 179.48 1r65 h THR 106 N 0.26 1.28 -0.37 0.32 2.02 -1.23 -2.59 112.91 112.59 1r65 h THR 106 Ca 0.07 -1.35 -0.01 0.00 0.77 0.00 0.00 66.41 65.89 1r65 h THR 106 Cb -0.03 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 1r65 h THR 106 CO -0.02 0.43 0.19 -0.25 0.37 0.00 0.00 175.52 176.24 1r65 h TRP 107 N 0.47 0.51 -0.79 3.16 -0.00 -0.94 0.22 115.95 118.59 1r65 h TRP 107 Ca 0.06 -0.02 0.04 0.00 -0.00 0.00 0.00 58.89 58.98 1r65 h TRP 107 Cb 0.73 -0.16 -0.05 0.00 -0.00 0.00 0.00 29.16 29.68 1r65 h TRP 107 CO 0.03 0.42 0.49 0.28 -0.00 0.00 0.00 178.44 179.65 1r65 h VAL 108 N 0.46 1.08 -0.26 2.65 2.07 -1.06 0.30 116.25 121.50 1r65 h VAL 108 Ca 0.13 -0.32 -0.12 0.00 0.82 0.00 0.00 66.70 67.21 1r65 h VAL 108 Cb 0.08 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.90 1r65 h VAL 108 CO -0.02 0.17 -0.35 -0.33 0.02 0.00 0.00 177.57 177.06 1r65 h GLU 109 N 0.93 0.56 -0.31 1.57 5.08 -1.13 -0.69 114.58 120.59 1r65 h GLU 109 Ca 0.33 -0.26 -0.16 0.00 -1.00 0.00 0.00 59.36 58.27 1r65 h GLU 109 Cb 0.07 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 1r65 h GLU 109 CO -0.14 0.83 -0.42 1.15 -1.00 0.00 0.00 179.01 179.43 1r65 h THR 110 N 0.47 1.28 -0.06 1.13 2.02 -0.22 -1.11 112.91 116.43 1r65 h THR 110 Ca 0.05 -1.61 -0.00 0.00 0.77 0.00 0.00 66.41 65.62 1r65 h THR 110 Cb 0.83 1.56 -0.00 0.00 -1.74 0.00 0.00 68.15 68.79 1r65 h THR 110 CO 0.07 0.52 0.03 -0.25 0.37 0.00 0.00 175.52 176.26 1r65 h TRP 111 N 0.62 0.09 -0.87 3.16 7.01 -0.31 -1.15 115.95 124.50 1r65 h TRP 111 Ca 0.04 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.01 1r65 h TRP 111 Cb 1.02 -0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 28.01 1r65 h TRP 111 CO 0.07 0.18 0.46 0.00 -2.79 0.00 0.00 178.44 176.36 1r65 h ALA 112 N 0.90 1.16 -0.65 2.65 0.00 -1.10 -2.47 119.26 119.75 1r65 h ALA 112 Ca 0.02 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1r65 h ALA 112 Cb 0.13 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1r65 h ALA 112 CO -0.00 0.66 0.28 0.35 0.00 0.00 0.00 179.25 180.54 1r65 h PHE 113 N 1.23 0.97 0.00 0.00 3.57 -0.94 -1.80 116.94 119.97 1r65 h PHE 113 Ca 0.30 -0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.72 1r65 h PHE 113 Cb 0.06 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 38.50 1r65 h PHE 113 CO 0.01 0.75 -0.10 0.66 -2.23 0.00 0.00 178.31 177.40 1r65 h SER 114 N 0.91 0.00 0.47 0.41 4.64 -0.78 -1.29 113.55 117.91 1r65 h SER 114 Ca 0.22 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.42 1r65 h SER 114 Cb 0.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.25 1r65 h SER 114 CO -0.02 0.10 -0.54 -0.33 -0.87 0.00 0.00 176.83 175.17 1r65 h GLU 115 N 0.00 0.07 0.00 4.77 4.39 -0.90 -2.47 114.58 120.44 1r65 h GLU 115 Ca -0.00 -0.04 -0.10 0.00 0.34 0.00 0.00 59.36 59.56 1r65 h GLU 115 Cb 0.19 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 1r65 h GLU 115 CO 0.01 0.59 -0.47 1.79 -1.16 0.00 0.00 179.01 179.77 1r65 h THR 116 N 0.06 1.33 -0.40 1.13 1.35 -0.92 -1.02 112.91 114.43 1r65 h THR 116 Ca -0.00 -1.62 -0.12 0.00 -0.55 0.00 0.00 66.41 64.12 1r65 h THR 116 Cb 0.97 1.87 -0.01 0.00 -1.73 0.00 0.00 68.15 69.25 1r65 h THR 116 CO 0.07 0.46 -0.24 0.40 -0.25 0.00 0.00 175.52 175.97 1r65 h ILE 117 N 0.00 1.27 -0.62 6.82 1.08 -1.23 -0.68 117.51 124.15 1r65 h ILE 117 Ca -0.00 -1.37 -0.03 0.00 -0.39 0.00 0.00 64.86 63.07 1r65 h ILE 117 Cb 0.84 1.22 -0.03 0.00 -3.07 0.00 0.00 36.82 35.78 1r65 h ILE 117 CO 0.06 0.46 0.28 0.45 -0.69 0.00 0.00 178.15 178.71 1r65 h HIS 118 N 0.70 0.91 -0.77 1.37 3.86 -0.93 -0.69 115.15 119.60 1r65 h HIS 118 Ca 0.09 -0.05 -0.03 0.00 -1.16 0.00 0.00 60.37 59.22 1r65 h HIS 118 Cb 0.77 -0.28 -0.04 0.00 1.06 0.00 0.00 27.41 28.92 1r65 h HIS 118 CO 0.04 0.70 0.38 0.77 0.86 0.00 0.00 177.93 180.68 1r65 h SER 119 N 0.86 1.01 -0.38 2.45 0.02 -0.90 -1.80 113.55 114.81 1r65 h SER 119 Ca 0.21 -0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 61.01 1r65 h SER 119 Cb 0.14 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 1r65 h SER 119 CO -0.02 0.85 0.18 0.03 -1.14 0.00 0.00 176.83 176.73 1r65 h ARG 120 N 1.09 0.60 -0.30 3.45 3.08 -0.56 -2.46 114.38 119.28 1r65 h ARG 120 Ca 0.27 -0.08 -0.14 0.00 0.07 0.00 0.00 59.98 60.10 1r65 h ARG 120 Cb 0.11 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 1r65 h ARG 120 CO -0.03 0.49 -0.38 0.66 -1.07 0.00 0.00 179.97 179.64 1r65 h SER 121 N 0.60 0.75 -0.18 7.04 4.64 -0.32 -2.32 113.55 123.76 1r65 h SER 121 Ca 0.15 -0.33 -0.05 0.00 -0.47 0.00 0.00 61.79 61.09 1r65 h SER 121 Cb 0.11 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 61.97 1r65 h SER 121 CO -0.02 1.04 -0.04 1.88 -0.87 0.00 0.00 176.83 178.82 1r65 h TYR 122 N 0.58 0.51 -0.36 4.77 0.05 -0.95 -0.80 116.97 120.77 1r65 h TYR 122 Ca 0.05 -0.06 -0.07 0.00 0.05 0.00 0.00 58.73 58.70 1r65 h TYR 122 Cb 0.91 -0.14 -0.01 0.00 1.01 0.00 0.00 36.73 38.49 1r65 h TYR 122 CO 0.04 0.53 -0.06 1.15 -1.05 0.00 0.00 178.16 178.77 1r65 h THR 123 N 0.46 1.27 -0.99 -2.88 2.02 -1.31 0.73 112.91 112.22 1r65 h THR 123 Ca 0.10 -1.10 0.06 0.00 0.77 0.00 0.00 66.41 66.23 1r65 h THR 123 Cb 0.37 1.27 -0.06 0.00 -1.74 0.00 0.00 68.15 67.98 1r65 h THR 123 CO 0.02 0.36 0.65 -0.74 0.37 0.00 0.00 175.52 176.18 1r65 h HIS 124 N 0.47 1.20 0.25 3.16 -0.00 -0.82 0.27 115.15 119.67 1r65 h HIS 124 Ca 0.09 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.48 1r65 h HIS 124 Cb 0.55 -0.40 0.00 0.00 -0.00 0.00 0.00 27.41 27.57 1r65 h HIS 124 CO 0.05 0.65 -0.12 0.82 -0.00 0.00 0.00 177.93 179.33 1r65 h ILE 125 N 1.20 0.44 -0.39 6.26 2.04 -0.97 -3.12 117.51 122.96 1r65 h ILE 125 Ca 0.42 -0.92 0.08 0.00 1.00 0.00 0.00 64.86 65.44 1r65 h ILE 125 Cb 0.11 0.74 -0.08 0.00 -0.74 0.00 0.00 36.82 36.85 1r65 h ILE 125 CO -0.15 0.12 -0.12 0.40 0.00 0.00 0.00 178.15 178.39 1r65 h ILE 126 N -0.99 0.56 -0.00 -0.67 2.04 -0.76 -0.56 117.51 117.12 1r65 h ILE 126 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1r65 h ILE 126 Cb 0.44 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1r65 h ILE 126 CO 0.06 0.00 0.00 -0.09 0.00 0.00 0.00 178.15 178.12 1r65 h ARG 127 N -0.03 0.00 -0.03 2.37 2.43 -1.07 -2.30 114.38 115.75 1r65 h ARG 127 Ca 0.19 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 1r65 h ARG 127 Cb 0.33 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 1r65 h ARG 127 CO -0.42 0.00 -0.08 0.09 -1.51 0.00 0.00 179.97 178.05 1r65 n ASN 128 N -3.43 2.75 0.00 -3.80 4.13 -0.26 -4.49 115.26 110.16 1r65 n ASN 128 Ca -0.03 -1.87 0.00 0.00 1.68 0.00 0.00 54.58 54.36 1r65 n ASN 128 Cb 0.08 0.08 0.00 0.00 -1.54 0.00 0.00 39.78 38.40 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 1.06 0.00 -4.27 2.41 -5.35 -0.92 -4.05 119.36 108.24 1r65 n ILE 129 Ca 0.13 -0.26 -0.19 0.00 -0.27 0.00 0.00 62.75 62.16 1r65 n ILE 129 Cb 0.55 0.76 -0.11 0.00 -1.74 0.00 0.00 39.64 39.10 1r65 n ILE 129 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1r65 s VAL 130 N -1.30 1.50 0.11 7.28 1.01 -0.91 -4.85 120.40 123.24 1r65 s VAL 130 Ca 0.00 -1.78 -0.11 0.00 0.00 0.00 0.00 61.98 60.09 1r65 s VAL 130 Cb 0.00 -1.64 -0.16 0.00 0.00 0.00 0.00 36.38 34.59 1r65 s VAL 130 CO 0.00 -0.38 1.32 0.78 0.00 0.00 0.00 175.10 176.82 1r65 h ASN 131 N 3.44 0.88 -3.53 3.32 2.35 -1.90 -3.42 115.58 116.71 1r65 h ASN 131 Ca -0.41 -0.59 -0.62 0.00 -0.55 0.00 0.00 56.30 54.14 1r65 h ASN 131 Cb 1.20 -0.26 -0.40 0.00 0.05 0.00 0.00 38.32 38.91 1r65 h ASN 131 CO 0.51 1.38 -0.73 -0.62 -1.65 0.00 0.00 177.43 176.32 1r65 s ASP 132 N -7.11 4.20 0.50 5.81 2.15 -1.26 -4.98 116.67 115.98 1r65 s ASP 132 Ca -0.10 -2.17 0.22 0.00 0.43 0.00 0.00 52.55 50.94 1r65 s ASP 132 Cb 0.09 -1.22 1.29 0.00 -0.30 0.00 0.00 42.92 42.78 1r65 s ASP 132 CO 0.90 -0.35 1.97 -0.65 -0.17 0.00 0.00 175.17 176.86 1r65 h PRO 133 N 7.46 0.13 -0.25 4.34 0.11 -1.88 -1.99 132.00 139.92 1r65 h PRO 133 Ca -0.07 -0.01 0.07 0.00 0.11 0.00 0.00 66.00 66.10 1r65 h PRO 133 Cb 0.98 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 1r65 h PRO 133 CO 0.51 0.09 0.19 0.77 -0.21 0.00 0.00 178.00 179.35 1r65 h SER 134 N 0.13 0.00 -0.36 -2.05 0.02 -1.98 -0.63 113.55 108.68 1r65 h SER 134 Ca 0.30 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 61.08 1r65 h SER 134 Cb 0.99 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.52 1r65 h SER 134 CO -0.04 0.00 -0.41 0.58 -1.14 0.00 0.00 176.83 175.82 1r65 h VAL 135 N 0.00 1.27 0.18 2.27 2.07 -1.79 -0.90 116.25 119.35 1r65 h VAL 135 Ca 0.12 -1.59 -0.01 0.00 0.82 0.00 0.00 66.70 66.04 1r65 h VAL 135 Cb 0.51 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 1r65 h VAL 135 CO -0.00 0.53 -0.09 0.58 0.02 0.00 0.00 177.57 178.61 1r65 h VAL 136 N 0.75 0.92 -0.76 2.57 2.07 -1.33 -2.72 116.25 117.74 1r65 h VAL 136 Ca 0.05 -0.89 0.01 0.00 0.82 0.00 0.00 66.70 66.69 1r65 h VAL 136 Cb 1.01 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 32.16 1r65 h VAL 136 CO 0.10 0.19 0.50 -0.26 0.02 0.00 0.00 177.57 178.12 1r65 h PHE 137 N -0.71 0.96 -0.46 1.57 0.04 -1.22 -2.56 116.94 114.57 1r65 h PHE 137 Ca -0.02 0.02 -0.06 0.00 2.80 0.00 0.00 57.97 60.71 1r65 h PHE 137 Cb 0.50 -0.33 -0.02 0.00 2.20 0.00 0.00 35.95 38.30 1r65 h PHE 137 CO 0.06 0.61 0.05 -0.44 -0.60 0.00 0.00 178.31 177.99 1r65 h ASP 138 N 1.04 0.67 0.72 2.17 3.45 -1.24 -2.52 116.42 120.71 1r65 h ASP 138 Ca 0.28 -0.13 -0.03 0.00 0.43 0.00 0.00 57.03 57.58 1r65 h ASP 138 Cb -0.11 -0.18 -0.00 0.00 -0.56 0.00 0.00 39.33 38.48 1r65 h ASP 138 CO -0.06 0.71 -0.14 -0.78 -1.57 0.00 0.00 179.24 177.40 1r65 h ASP 139 N 0.68 0.00 -0.86 6.45 3.58 -1.13 -2.84 116.42 122.30 1r65 h ASP 139 Ca 0.14 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.57 1r65 h ASP 139 Cb 0.35 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.36 1r65 h ASP 139 CO 0.01 0.14 0.44 0.40 -2.88 0.00 0.00 179.24 177.35 1r65 h ILE 140 N 0.00 1.26 -0.04 2.25 2.04 -1.20 0.85 117.51 122.67 1r65 h ILE 140 Ca -0.00 -0.69 -0.08 0.00 1.00 0.00 0.00 64.86 65.09 1r65 h ILE 140 Cb 0.54 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1r65 h ILE 140 CO 0.02 0.30 -0.30 0.58 0.00 0.00 0.00 178.15 178.75 1r65 h VAL 141 N 1.21 1.46 0.11 1.67 2.07 -1.60 -3.37 116.25 117.80 1r65 h VAL 141 Ca 0.30 -1.79 -0.28 0.00 0.82 0.00 0.00 66.70 65.75 1r65 h VAL 141 Cb 0.08 2.48 -0.00 0.00 -1.52 0.00 0.00 31.29 32.32 1r65 h VAL 141 CO -0.04 0.50 -1.30 0.71 0.02 0.00 0.00 177.57 177.46 1r65 h THR 142 N -0.28 1.43 -0.75 2.57 1.35 -1.50 -3.46 112.91 112.26 1r65 h THR 142 Ca -0.03 -3.03 -0.68 0.00 -0.55 0.00 0.00 66.41 62.13 1r65 h THR 142 Cb 0.98 2.89 -0.03 0.00 -1.73 0.00 0.00 68.15 70.26 1r65 h THR 142 CO 0.06 0.88 1.42 -3.20 -0.25 0.00 0.00 175.52 174.43 1r65 n ASN 143 N -3.49 1.66 -0.00 5.36 4.05 0.29 -4.83 115.26 118.29 1r65 n ASN 143 Ca -0.10 0.43 0.02 0.00 0.45 0.00 0.00 54.58 55.38 1r65 n ASN 143 Cb 1.02 -1.16 0.35 0.00 1.23 0.00 0.00 39.78 41.23 1r65 n ASN 143 CO 0.00 0.00 0.00 1.05 -3.05 0.00 0.00 177.26 175.26 1r65 h GLU 144 N 11.77 0.53 -0.06 1.20 4.11 -1.89 -2.22 114.58 128.01 1r65 h GLU 144 Ca -0.21 -0.07 -0.14 0.00 0.07 0.00 0.00 59.36 59.00 1r65 h GLU 144 Cb 1.34 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 1r65 h GLU 144 CO 1.07 0.46 -0.60 1.96 0.07 0.00 0.00 179.01 181.97 1r65 h GLN 145 N 0.53 0.21 -0.14 1.06 1.08 -1.98 -1.29 115.11 114.57 1r65 h GLN 145 Ca 0.13 -0.15 -0.20 0.00 -1.45 0.00 0.00 58.65 56.98 1r65 h GLN 145 Cb 0.15 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.61 1r65 h GLN 145 CO -0.01 0.75 -0.71 0.82 -0.95 0.00 0.00 178.83 178.73 1r65 h ILE 146 N 0.16 1.32 0.00 2.54 2.04 -1.83 -2.60 117.51 119.13 1r65 h ILE 146 Ca -0.01 -1.98 -0.08 0.00 1.00 0.00 0.00 64.86 63.79 1r65 h ILE 146 Cb 1.10 1.96 -0.01 0.00 -0.74 0.00 0.00 36.82 39.13 1r65 h ILE 146 CO 0.09 0.62 -0.38 1.56 0.00 0.00 0.00 178.15 180.04 1r65 h GLN 147 N 0.45 0.00 -0.13 2.37 1.08 -1.31 -2.06 115.11 115.51 1r65 h GLN 147 Ca -0.03 0.00 -0.22 0.00 -1.45 0.00 0.00 58.65 56.95 1r65 h GLN 147 Cb 1.30 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.75 1r65 h GLN 147 CO 0.14 0.38 -0.79 0.87 -0.95 0.00 0.00 178.83 178.47 1r65 h LYS 148 N 0.00 0.76 -0.52 1.46 1.79 -1.18 -0.48 116.57 118.40 1r65 h LYS 148 Ca -0.00 -0.65 -0.04 0.00 -2.18 0.00 0.00 60.65 57.78 1r65 h LYS 148 Cb 0.99 0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 31.76 1r65 h LYS 148 CO 0.05 1.25 0.18 -0.09 -1.08 0.00 0.00 179.45 179.76 1r65 h ARG 149 N 0.49 0.80 -0.01 3.15 2.43 -1.34 -2.85 114.38 117.05 1r65 h ARG 149 Ca -0.06 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 58.94 1r65 h ARG 149 Cb 1.43 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.86 1r65 h ARG 149 CO 0.16 0.73 -0.06 0.00 -1.51 0.00 0.00 179.97 179.29 1r65 n ALA 150 N -2.36 2.71 -1.61 2.80 0.00 -0.79 -4.83 120.51 116.43 1r65 n ALA 150 Ca 0.02 -0.33 -0.48 0.00 0.00 0.00 0.00 53.44 52.65 1r65 n ALA 150 Cb 0.19 -1.30 -0.04 0.00 0.00 0.00 0.00 19.45 18.30 1r65 n ALA 150 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1r65 n GLU 151 N -0.55 1.46 0.00 0.00 2.13 -0.19 -2.24 120.64 121.25 1r65 n GLU 151 Ca 0.18 0.52 0.00 0.00 0.66 0.00 0.00 57.16 58.52 1r65 n GLU 151 Cb 0.27 -2.12 0.00 0.00 0.27 0.00 0.00 31.44 29.86 1r65 n GLU 151 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1r65 n GLY 152 N 2.32 2.95 0.22 8.31 0.00 -1.26 -4.97 105.19 112.76 1r65 n GLY 152 Ca 0.15 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.09 1r65 n GLY 152 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1r65 h ILE 153 N 0.00 0.00 -0.02 -0.61 2.04 -1.85 -2.34 117.51 114.74 1r65 h ILE 153 Ca 0.00 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.62 1r65 h ILE 153 Cb 0.00 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.07 1r65 h ILE 153 CO 0.00 0.00 -0.14 0.77 0.00 0.00 0.00 178.15 178.78 1r65 h SER 154 N -0.73 0.02 -0.05 1.72 4.64 -1.93 -2.71 113.55 114.51 1r65 h SER 154 Ca -0.05 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1r65 h SER 154 Cb 0.40 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1r65 h SER 154 CO 0.09 0.17 0.02 0.77 -0.87 0.00 0.00 176.83 177.01 1r65 h SER 155 N 0.02 0.03 -0.17 4.97 4.64 -1.93 0.15 113.55 121.27 1r65 h SER 155 Ca 0.00 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.35 1r65 h SER 155 Cb 0.27 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.34 1r65 h SER 155 CO 0.02 0.03 0.04 1.88 -0.87 0.00 0.00 176.83 177.93 1r65 h TYR 156 N 0.05 0.08 -0.27 4.77 -1.99 -1.10 -1.63 116.97 116.88 1r65 h TYR 156 Ca 0.02 0.01 0.02 0.00 2.00 0.00 0.00 58.73 60.78 1r65 h TYR 156 Cb 0.00 -0.01 -0.02 0.00 2.00 0.00 0.00 36.73 38.70 1r65 h TYR 156 CO -0.08 0.03 0.12 1.88 -0.00 0.00 0.00 178.16 180.11 1r65 h TYR 157 N 0.12 0.22 -0.72 4.88 0.05 -1.31 -1.63 116.97 118.59 1r65 h TYR 157 Ca 0.07 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.86 1r65 h TYR 157 Cb 0.06 -0.06 -0.03 0.00 1.01 0.00 0.00 36.73 37.70 1r65 h TYR 157 CO -0.12 0.12 0.41 -0.44 -1.05 0.00 0.00 178.16 177.07 1r65 h ASP 158 N 0.26 0.87 -0.37 3.88 3.32 -0.75 -0.11 116.42 123.51 1r65 h ASP 158 Ca 0.11 -0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.01 1r65 h ASP 158 Cb 0.05 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1r65 h ASP 158 CO -0.09 0.68 -0.16 -0.33 -1.72 0.00 0.00 179.24 177.62 1r65 h GLU 159 N 0.99 0.76 -0.24 3.56 5.08 -1.01 -1.77 114.58 121.95 1r65 h GLU 159 Ca 0.26 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1r65 h GLU 159 Cb -0.01 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1r65 h GLU 159 CO -0.05 0.94 0.11 1.25 -1.00 0.00 0.00 179.01 180.26 1r65 h LEU 160 N 0.56 0.33 -0.48 1.33 5.85 -0.85 -1.29 115.31 120.76 1r65 h LEU 160 Ca 0.08 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.68 1r65 h LEU 160 Cb 0.70 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.62 1r65 h LEU 160 CO 0.05 0.38 0.28 0.40 -0.34 0.00 0.00 178.44 179.21 1r65 h ILE 161 N 0.25 1.04 -0.33 4.05 2.04 -0.98 0.35 117.51 123.93 1r65 h ILE 161 Ca 0.08 -0.19 -0.02 0.00 1.00 0.00 0.00 64.86 65.73 1r65 h ILE 161 Cb 0.15 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.65 1r65 h ILE 161 CO -0.01 0.10 0.14 -0.08 0.00 0.00 0.00 178.15 178.30 1r65 h GLU 162 N 0.56 0.49 -0.47 2.37 4.81 -1.18 -1.39 114.58 119.76 1r65 h GLU 162 Ca 0.19 -0.09 -0.04 0.00 -0.13 0.00 0.00 59.36 59.30 1r65 h GLU 162 Cb 0.02 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 1r65 h GLU 162 CO -0.09 0.48 0.14 1.98 -0.73 0.00 0.00 179.01 180.79 1r65 h MET 163 N 0.39 0.70 -0.37 1.92 4.05 -0.94 -2.11 114.93 118.57 1r65 h MET 163 Ca 0.11 -0.12 -0.05 0.00 -0.28 0.00 0.00 59.70 59.36 1r65 h MET 163 Cb 0.17 -0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 30.84 1r65 h MET 163 CO -0.01 0.62 0.04 1.15 0.23 0.00 0.00 176.91 178.93 1r65 h THR 164 N 0.69 1.25 -0.60 -0.77 2.02 -0.61 -1.81 112.91 113.07 1r65 h THR 164 Ca 0.16 -0.91 0.00 0.00 0.77 0.00 0.00 66.41 66.43 1r65 h THR 164 Cb 0.22 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.72 1r65 h THR 164 CO -0.01 0.30 0.38 0.28 0.37 0.00 0.00 175.52 176.85 1r65 h SER 165 N 0.46 0.71 -0.67 4.18 0.02 -0.89 0.17 113.55 117.52 1r65 h SER 165 Ca 0.11 -0.04 0.04 0.00 -0.84 0.00 0.00 61.79 61.06 1r65 h SER 165 Cb 0.40 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 62.72 1r65 h SER 165 CO 0.01 0.53 0.40 1.88 -1.14 0.00 0.00 176.83 178.52 1r65 h TYR 166 N 0.81 0.74 -0.28 3.45 0.05 -1.20 -0.14 116.97 120.41 1r65 h TYR 166 Ca 0.22 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 59.01 1r65 h TYR 166 Cb -0.06 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 37.43 1r65 h TYR 166 CO -0.03 0.40 0.14 2.35 -1.05 0.00 0.00 178.16 179.97 1r65 h TRP 167 N 0.76 0.40 -0.15 4.88 7.01 -0.64 0.17 115.95 128.38 1r65 h TRP 167 Ca 0.28 -0.02 -0.08 0.00 2.11 0.00 0.00 58.89 61.19 1r65 h TRP 167 Cb 0.10 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.02 1r65 h TRP 167 CO -0.06 0.35 -0.27 0.45 -2.79 0.00 0.00 178.44 176.13 1r65 h HIS 168 N 0.33 0.32 0.08 2.65 3.86 -0.54 -0.64 115.15 121.21 1r65 h HIS 168 Ca 0.10 -0.06 -0.19 0.00 -1.16 0.00 0.00 60.37 59.06 1r65 h HIS 168 Cb 0.10 -0.08 -0.00 0.00 1.06 0.00 0.00 27.41 28.49 1r65 h HIS 168 CO -0.02 0.53 -0.93 -0.07 0.86 0.00 0.00 177.93 178.30 1r65 h LEU 169 N 0.26 0.26 0.00 2.43 3.38 -0.83 0.31 115.31 121.11 1r65 h LEU 169 Ca 0.04 -0.85 -0.27 0.00 0.09 0.00 0.00 57.88 56.89 1r65 h LEU 169 Cb 0.61 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.23 1r65 h LEU 169 CO 0.04 1.41 -2.27 0.18 0.09 0.00 0.00 178.44 177.89 1r65 n LEU 170 N -4.21 0.00 0.00 1.67 4.77 0.59 -4.80 117.00 115.03 1r65 n LEU 170 Ca -0.20 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.78 1r65 n LEU 170 Cb 0.75 0.36 0.00 0.00 -2.33 0.00 0.00 43.42 42.20 1r65 n LEU 170 CO 0.38 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.41 1r65 n GLY 171 N 1.64 -1.25 3.77 -0.72 0.00 -0.25 -4.91 105.19 103.47 1r65 n GLY 171 Ca -0.25 -1.60 -0.36 0.00 0.00 0.00 0.00 46.02 43.81 1r65 n GLY 171 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1r65 s GLU 172 N -1.48 3.53 0.00 1.61 2.12 -1.26 -4.75 118.70 118.47 1r65 s GLU 172 Ca 0.00 1.73 0.00 0.00 0.36 0.00 0.00 54.97 57.06 1r65 s GLU 172 Cb 0.00 -2.21 0.00 0.00 0.26 0.00 0.00 34.13 32.18 1r65 s GLU 172 CO 0.00 -0.73 0.00 0.41 -0.54 0.00 0.00 175.26 174.40 1r65 n GLY 173 N 0.35 0.75 3.52 -1.50 0.00 0.00 -4.96 105.19 103.35 1r65 n GLY 173 Ca 0.09 -2.09 -0.34 0.00 0.00 0.00 0.00 46.02 43.69 1r65 n GLY 173 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1r65 s THR 174 N -1.11 4.01 0.38 2.61 -4.23 -1.26 -0.15 115.64 115.88 1r65 s THR 174 Ca 0.00 -0.32 0.04 0.00 -1.18 0.00 0.00 61.69 60.24 1r65 s THR 174 Cb 0.00 -2.76 -0.06 0.00 1.34 0.00 0.00 72.50 71.02 1r65 s THR 174 CO 0.00 0.50 0.05 -1.00 -0.54 0.00 0.00 174.62 173.62 1r65 s HIS 175 N 0.29 2.10 -0.23 3.99 3.76 0.66 -4.96 115.29 120.90 1r65 s HIS 175 Ca -0.03 -0.91 0.02 0.00 -0.15 0.00 0.00 55.06 53.99 1r65 s HIS 175 Cb -0.14 -1.45 0.05 0.00 1.11 0.00 0.00 32.58 32.15 1r65 s HIS 175 CO 0.03 0.13 -0.11 0.99 -0.85 0.00 0.00 174.74 174.93 1r65 s THR 176 N -3.07 1.88 -0.22 1.30 2.01 -1.26 -0.65 115.64 115.63 1r65 s THR 176 Ca 0.32 -1.30 0.01 0.00 0.31 0.00 0.00 61.69 61.02 1r65 s THR 176 Cb 0.08 -1.98 0.03 0.00 0.01 0.00 0.00 72.50 70.64 1r65 s THR 176 CO 0.15 0.07 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.33 1r65 s VAL 177 N 1.26 2.37 -1.60 3.82 1.01 0.85 -4.70 120.40 123.41 1r65 s VAL 177 Ca -0.05 -1.12 -0.13 0.00 0.00 0.00 0.00 61.98 60.69 1r65 s VAL 177 Cb -0.18 -2.16 0.11 0.00 0.00 0.00 0.00 36.38 34.15 1r65 s VAL 177 CO -0.07 0.30 0.73 0.59 0.00 0.00 0.00 175.10 176.65 1r65 n ASN 178 N 4.59 -2.80 0.00 3.32 3.02 -1.26 -0.59 115.26 121.54 1r65 n ASN 178 Ca -0.18 -0.97 0.00 0.00 -0.03 0.00 0.00 54.58 53.40 1r65 n ASN 178 Cb 0.47 -3.03 0.00 0.00 -0.61 0.00 0.00 39.78 36.61 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 -1.60 0.87 3.59 7.41 0.00 -1.26 -5.03 105.19 109.17 1r65 n GLY 179 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.06 2.31 -0.20 1.61 1.02 0.24 -5.09 119.74 119.57 1r65 s LYS 180 Ca 0.00 -0.90 -0.23 0.00 0.02 0.00 0.00 55.97 54.85 1r65 s LYS 180 Cb 0.00 -2.39 -0.02 0.00 -0.52 0.00 0.00 37.83 34.91 1r65 s LYS 180 CO 0.00 0.54 0.75 0.99 -0.92 0.00 0.00 175.35 176.72 1r65 s THR 181 N -1.14 4.93 -0.17 2.17 2.01 -1.26 -0.11 115.64 122.07 1r65 s THR 181 Ca 0.20 1.44 0.01 0.00 0.31 0.00 0.00 61.69 63.66 1r65 s THR 181 Cb -0.11 -4.06 0.02 0.00 0.01 0.00 0.00 72.50 68.36 1r65 s THR 181 CO 0.12 0.04 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.19 1r65 s VAL 182 N 2.20 2.07 -0.17 3.82 1.01 0.17 -4.96 120.40 124.54 1r65 s VAL 182 Ca 0.34 -0.95 -0.13 0.00 0.00 0.00 0.00 61.98 61.24 1r65 s VAL 182 Cb -0.16 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.32 1r65 s VAL 182 CO 0.11 0.54 0.27 -0.89 0.00 0.00 0.00 175.10 175.13 1r65 s THR 183 N 1.17 5.32 -0.33 3.92 2.01 -1.26 -0.25 115.64 126.23 1r65 s THR 183 Ca 0.02 0.50 0.02 0.00 0.31 0.00 0.00 61.69 62.54 1r65 s THR 183 Cb -0.14 -3.61 0.09 0.00 0.01 0.00 0.00 72.50 68.85 1r65 s THR 183 CO -0.10 0.39 0.02 -0.69 -0.69 0.00 0.00 174.62 173.55 1r65 s VAL 184 N 0.52 2.43 -0.17 3.82 1.01 0.78 -5.00 120.40 123.80 1r65 s VAL 184 Ca 0.15 -2.06 -0.03 0.00 0.00 0.00 0.00 61.98 60.04 1r65 s VAL 184 Cb -0.13 -2.66 -0.02 0.00 0.00 0.00 0.00 36.38 33.57 1r65 s VAL 184 CO 0.03 -0.43 -0.05 -0.55 0.00 0.00 0.00 175.10 174.10 1r65 s SER 185 N 1.09 4.60 0.17 3.32 0.15 -1.26 -0.82 113.70 120.95 1r65 s SER 185 Ca 0.04 -0.21 -0.10 0.00 0.70 0.00 0.00 55.95 56.38 1r65 s SER 185 Cb -0.20 -1.75 0.05 0.00 -1.71 0.00 0.00 66.02 62.40 1r65 s SER 185 CO -0.06 0.13 1.62 0.25 1.20 0.00 0.00 173.24 176.37 1r65 h LEU 186 N 7.02 0.99 -0.82 3.45 5.85 -1.98 -1.55 115.31 128.27 1r65 h LEU 186 Ca -0.32 -0.31 0.03 0.00 0.84 0.00 0.00 57.88 58.12 1r65 h LEU 186 Cb 1.19 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.90 1r65 h LEU 186 CO 0.61 1.06 0.53 -0.09 -0.34 0.00 0.00 178.44 180.21 1r65 h ARG 187 N 0.89 0.99 -0.20 1.25 2.43 -1.99 0.22 114.38 117.98 1r65 h ARG 187 Ca 0.16 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.17 1r65 h ARG 187 Cb 0.56 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1r65 h ARG 187 CO 0.03 0.66 -0.29 1.49 -1.51 0.00 0.00 179.97 180.34 1r65 h GLU 188 N 1.02 0.38 -0.22 0.20 4.57 -1.91 -1.41 114.58 117.21 1r65 h GLU 188 Ca 0.33 -0.15 -0.17 0.00 -1.18 0.00 0.00 59.36 58.19 1r65 h GLU 188 Cb 0.02 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.58 1r65 h GLU 188 CO -0.12 0.65 -0.55 1.25 -1.18 0.00 0.00 179.01 179.06 1r65 h LEU 189 N 0.34 0.74 -1.01 1.64 5.85 -0.22 -1.32 115.31 121.33 1r65 h LEU 189 Ca 0.05 -0.40 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 1r65 h LEU 189 Cb 0.69 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 1r65 h LEU 189 CO 0.05 1.14 0.21 0.11 -0.34 0.00 0.00 178.44 179.61 1r65 h LYS 190 N 0.51 0.92 -0.45 1.25 1.57 -0.30 0.00 116.57 120.07 1r65 h LYS 190 Ca 0.01 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.57 1r65 h LYS 190 Cb 1.12 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 33.26 1r65 h LYS 190 CO 0.11 0.79 0.08 0.87 -0.57 0.00 0.00 179.45 180.72 1r65 h LYS 191 N 0.90 0.74 -0.37 3.15 1.57 -0.94 -0.27 116.57 121.36 1r65 h LYS 191 Ca 0.21 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1r65 h LYS 191 Cb 0.24 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 1r65 h LYS 191 CO -0.01 0.76 0.23 -0.22 -0.57 0.00 0.00 179.45 179.64 1r65 h LYS 192 N 0.61 0.49 -0.13 3.15 1.63 -0.73 -1.00 116.57 120.58 1r65 h LYS 192 Ca 0.14 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.90 1r65 h LYS 192 Cb 0.38 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 31.89 1r65 h LYS 192 CO 0.01 0.34 0.06 1.25 -3.45 0.00 0.00 179.45 177.66 1r65 h LEU 193 N 0.49 0.17 -0.44 5.20 5.85 -0.82 -1.22 115.31 124.53 1r65 h LEU 193 Ca 0.13 -0.12 0.07 0.00 0.84 0.00 0.00 57.88 58.80 1r65 h LEU 193 Cb -0.03 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 40.90 1r65 h LEU 193 CO -0.03 0.24 0.12 0.22 -0.34 0.00 0.00 178.44 178.65 1r65 h TYR 194 N 0.08 0.20 0.00 1.25 3.20 -0.82 -0.22 116.97 120.67 1r65 h TYR 194 Ca 0.04 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.87 1r65 h TYR 194 Cb 0.12 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 1r65 h TYR 194 CO -0.03 0.05 -0.32 -0.07 -1.64 0.00 0.00 178.16 176.15 1r65 h LEU 195 N 0.27 0.00 -0.33 2.82 3.38 -1.09 -1.50 115.31 118.86 1r65 h LEU 195 Ca 0.21 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.07 1r65 h LEU 195 Cb 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1r65 h LEU 195 CO -0.25 0.32 -0.22 0.00 0.09 0.00 0.00 178.44 178.37 1r65 h LEU 197 N 0.50 1.07 -1.09 0.00 3.38 -0.76 0.01 115.31 118.42 1r65 h LEU 197 Ca 0.06 -0.26 -0.07 0.00 0.09 0.00 0.00 57.88 57.70 1r65 h LEU 197 Cb 0.78 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1r65 h LEU 197 CO 0.06 1.06 -0.07 -0.03 0.09 0.00 0.00 178.44 179.56 1r65 h MET 198 N 1.03 0.57 -0.35 1.13 4.05 -1.15 0.22 114.93 120.43 1r65 h MET 198 Ca 0.20 -0.15 -0.11 0.00 -0.28 0.00 0.00 59.70 59.36 1r65 h MET 198 Cb 0.45 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.18 1r65 h MET 198 CO 0.01 0.64 -0.20 0.77 0.23 0.00 0.00 176.91 178.36 1r65 h SER 199 N 0.53 0.79 -0.69 1.39 0.02 -0.58 -1.94 113.55 113.08 1r65 h SER 199 Ca 0.10 -0.42 -0.05 0.00 -0.84 0.00 0.00 61.79 60.58 1r65 h SER 199 Cb 0.44 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.73 1r65 h SER 199 CO 0.02 1.03 0.23 0.58 -1.14 0.00 0.00 176.83 177.55 1r65 h VAL 200 N 0.54 1.25 -0.73 2.27 2.07 -0.69 -0.82 116.25 120.15 1r65 h VAL 200 Ca 0.07 -0.86 0.01 0.00 0.82 0.00 0.00 66.70 66.74 1r65 h VAL 200 Cb 0.75 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 1r65 h VAL 200 CO 0.06 0.34 0.48 -1.13 0.02 0.00 0.00 177.57 177.33 1r65 h ASN 201 N 1.04 0.82 -0.16 0.57 -0.73 -0.76 0.15 115.58 116.52 1r65 h ASN 201 Ca 0.23 -0.02 -0.10 0.00 1.87 0.00 0.00 56.30 58.28 1r65 h ASN 201 Cb 0.28 -0.20 -0.01 0.00 0.27 0.00 0.00 38.32 38.66 1r65 h ASN 201 CO -0.01 0.59 -0.23 0.00 -0.37 0.00 0.00 177.43 177.40 1r65 h ALA 202 N 1.27 1.01 -0.12 1.57 0.00 -0.89 0.26 119.26 122.36 1r65 h ALA 202 Ca 0.27 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1r65 h ALA 202 Cb -0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1r65 h ALA 202 CO -0.07 0.59 0.05 1.25 0.00 0.00 0.00 179.25 181.07 1r65 h LEU 203 N 0.53 0.17 -0.33 0.00 6.46 -0.30 0.11 115.31 121.96 1r65 h LEU 203 Ca 0.08 -0.17 -0.08 0.00 -0.12 0.00 0.00 57.88 57.58 1r65 h LEU 203 Cb 0.69 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.57 1r65 h LEU 203 CO 0.05 0.30 -0.11 -0.33 -0.62 0.00 0.00 178.44 177.73 1r65 h GLU 204 N 0.03 0.65 0.00 1.25 4.39 -0.50 -2.44 114.58 117.96 1r65 h GLU 204 Ca 0.04 -0.26 -0.07 0.00 0.34 0.00 0.00 59.36 59.40 1r65 h GLU 204 Cb 0.18 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.79 1r65 h GLU 204 CO -0.00 0.84 -0.64 0.00 -1.16 0.00 0.00 179.01 178.05 1r65 h ALA 205 N 0.79 0.72 0.00 3.43 0.00 -0.48 -3.39 119.26 120.33 1r65 h ALA 205 Ca 0.08 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1r65 h ALA 205 Cb 0.62 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1r65 h ALA 205 CO 0.04 0.40 0.00 -0.89 0.00 0.00 0.00 179.25 178.80 1r65 n ILE 206 N -3.03 1.11 -0.21 0.00 5.41 0.00 -4.58 119.36 118.07 1r65 n ILE 206 Ca -0.00 0.37 0.01 0.00 1.00 0.00 0.00 62.75 64.13 1r65 n ILE 206 Cb 0.67 -1.49 0.12 0.00 -0.71 0.00 0.00 39.64 38.22 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 0.00 0.20 -0.49 0.38 3.08 -1.34 -1.16 114.38 115.05 1r65 h ARG 207 Ca 0.00 -0.01 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 1r65 h ARG 207 Cb 0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1r65 h ARG 207 CO 0.00 0.13 -0.02 0.74 -1.07 0.00 0.00 179.97 179.75 1r65 h PHE 208 N 0.20 0.96 -0.13 3.04 0.04 -1.64 -3.01 116.94 116.40 1r65 h PHE 208 Ca 0.33 -0.18 -0.10 0.00 2.80 0.00 0.00 57.97 60.83 1r65 h PHE 208 Cb 0.53 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 38.42 1r65 h PHE 208 CO -0.29 0.91 -0.35 1.88 -0.60 0.00 0.00 178.31 179.86 1r65 h TYR 209 N 0.73 0.31 -0.61 -0.55 -1.99 -1.63 -1.10 116.97 112.14 1r65 h TYR 209 Ca 0.13 -0.08 -0.05 0.00 2.00 0.00 0.00 58.73 60.74 1r65 h TYR 209 Cb 0.55 -0.07 -0.03 0.00 2.00 0.00 0.00 36.73 39.18 1r65 h TYR 209 CO 0.04 0.60 0.17 0.28 -0.00 0.00 0.00 178.16 179.24 1r65 h VAL 210 N 0.24 1.24 -0.04 -2.88 2.07 -1.20 -2.34 116.25 113.33 1r65 h VAL 210 Ca 0.03 -0.84 -0.13 0.00 0.82 0.00 0.00 66.70 66.57 1r65 h VAL 210 Cb 0.74 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1r65 h VAL 210 CO 0.06 0.32 -0.58 0.77 0.02 0.00 0.00 177.57 178.15 1r65 h SER 211 N 0.90 0.16 -0.57 0.57 4.64 -1.30 -3.07 113.55 114.89 1r65 h SER 211 Ca 0.20 -0.09 -0.04 0.00 -0.47 0.00 0.00 61.79 61.39 1r65 h SER 211 Cb 0.30 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 1r65 h SER 211 CO -0.00 0.71 0.20 -0.26 -0.87 0.00 0.00 176.83 176.60 1r65 h PHE 212 N 0.11 0.90 -0.67 4.77 0.04 -0.71 -2.30 116.94 119.07 1r65 h PHE 212 Ca -0.00 -0.08 0.08 0.00 2.80 0.00 0.00 57.97 60.76 1r65 h PHE 212 Cb 1.06 -0.26 -0.06 0.00 2.20 0.00 0.00 35.95 38.88 1r65 h PHE 212 CO 0.01 0.74 0.34 0.00 -0.60 0.00 0.00 178.31 178.81 1r65 h ALA 213 N 1.06 0.90 -0.43 2.45 0.00 -1.34 0.11 119.26 122.01 1r65 h ALA 213 Ca 0.19 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1r65 h ALA 213 Cb 0.25 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1r65 h ALA 213 CO -0.01 -0.02 0.14 0.00 0.00 0.00 0.00 179.25 179.36 1r65 h SER 215 N 0.55 -0.03 0.76 0.00 0.02 -0.83 -2.88 113.55 111.15 1r65 h SER 215 Ca 0.14 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1r65 h SER 215 Cb 0.26 0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.80 1r65 h SER 215 CO -0.01 0.03 0.00 -0.26 -1.14 0.00 0.00 176.83 175.46 1r65 h PHE 216 N -0.10 0.00 0.00 3.45 0.04 -0.74 -2.36 116.94 117.23 1r65 h PHE 216 Ca -0.00 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.73 1r65 h PHE 216 Cb 0.09 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.23 1r65 h PHE 216 CO -0.06 0.00 -0.17 0.00 -0.60 0.00 0.00 178.31 177.48 1r65 h ALA 217 N 2.08 1.31 0.20 2.45 0.00 -1.01 -0.94 119.26 123.35 1r65 h ALA 217 Ca 0.00 -0.16 -0.32 0.00 0.00 0.00 0.00 54.91 54.43 1r65 h ALA 217 Cb 0.38 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.17 1r65 h ALA 217 CO 0.00 0.21 -1.49 0.74 0.00 0.00 0.00 179.25 178.71 1r65 h PHE 218 N 0.00 0.77 -0.20 0.00 -1.00 -1.51 -3.23 116.94 111.77 1r65 h PHE 218 Ca -0.00 -0.56 -0.02 0.00 2.81 0.00 0.00 57.97 60.19 1r65 h PHE 218 Cb 0.42 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 39.94 1r65 h PHE 218 CO 0.00 1.50 0.03 0.00 -1.61 0.00 0.00 178.31 178.23 1r65 h ALA 219 N 0.28 1.67 -0.20 2.45 0.00 -1.34 -1.55 119.26 120.57 1r65 h ALA 219 Ca -0.25 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.61 1r65 h ALA 219 Cb 2.10 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.79 1r65 h ALA 219 CO 0.23 0.25 0.14 0.93 0.00 0.00 0.00 179.25 180.81 1r65 h GLU 220 N 0.29 0.03 -0.63 0.00 4.39 -1.21 -0.61 114.58 116.83 1r65 h GLU 220 Ca 0.07 -0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.57 1r65 h GLU 220 Cb 0.15 -0.01 -0.12 0.00 -0.10 0.00 0.00 28.75 28.68 1r65 h GLU 220 CO 0.00 0.02 0.21 2.89 -1.16 0.00 0.00 179.01 180.97 1r65 n ARG 221 N -4.48 3.24 -2.28 2.33 0.00 -0.65 -4.93 116.66 109.88 1r65 n ARG 221 Ca 0.02 -3.07 -0.16 0.00 -0.00 0.00 0.00 57.85 54.64 1r65 n ARG 221 Cb 0.27 -2.10 -0.01 0.00 -0.00 0.00 0.00 32.46 30.61 1r65 n ARG 221 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1r65 n GLU 222 N -0.42 -1.31 -4.37 2.89 1.02 -0.24 -5.02 120.64 113.20 1r65 n GLU 222 Ca 0.38 0.81 -0.29 0.00 -0.02 0.00 0.00 57.16 58.05 1r65 n GLU 222 Cb 1.29 -5.22 -0.12 0.00 -0.02 0.00 0.00 31.44 27.36 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 -4.71 2.50 -1.12 -4.62 1.02 -0.79 -4.76 118.68 106.20 1r65 s LEU 223 Ca 0.00 -0.71 -0.11 0.00 0.02 0.00 0.00 54.13 53.33 1r65 s LEU 223 Cb 0.00 -1.33 -0.03 0.00 0.02 0.00 0.00 46.19 44.84 1r65 s LEU 223 CO 0.00 0.16 0.84 0.23 0.02 0.00 0.00 176.35 177.60 1r65 n MET 224 N 0.68 -2.29 0.12 1.70 2.81 -1.26 -3.09 117.12 115.79 1r65 n MET 224 Ca -0.16 0.67 -0.03 0.00 -1.81 0.00 0.00 57.70 56.37 1r65 n MET 224 Cb 0.54 -5.04 0.14 0.00 -0.71 0.00 0.00 33.22 28.15 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 -1.54 0.08 -0.05 0.03 4.39 -1.93 -2.25 114.58 113.31 1r65 h GLU 225 Ca -0.63 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 58.98 1r65 h GLU 225 Cb 1.34 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 30.00 1r65 h GLU 225 CO 0.47 0.69 -0.06 0.78 -1.16 0.00 0.00 179.01 179.73 1r65 h GLY 226 N 1.75 0.14 0.83 -3.84 0.00 -1.91 -2.40 103.07 97.64 1r65 h GLY 226 Ca -0.01 -0.15 0.04 0.00 0.00 0.00 0.00 47.33 47.21 1r65 h GLY 226 CO 0.09 0.14 0.56 -0.57 0.00 0.00 0.00 176.54 176.76 1r65 h ASN 227 N -0.36 0.92 -0.87 0.19 -0.73 -1.88 -2.00 115.58 110.86 1r65 h ASN 227 Ca 0.01 -0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.18 1r65 h ASN 227 Cb 0.60 -0.20 -0.04 0.00 0.27 0.00 0.00 38.32 38.95 1r65 h ASN 227 CO 0.02 0.62 0.55 0.00 -0.37 0.00 0.00 177.43 178.25 1r65 h ALA 228 N 1.38 1.10 -0.57 1.57 0.00 -1.36 0.22 119.26 121.60 1r65 h ALA 228 Ca 0.36 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1r65 h ALA 228 Cb 0.05 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1r65 h ALA 228 CO -0.13 0.54 0.27 0.87 0.00 0.00 0.00 179.25 180.79 1r65 h LYS 229 N 1.18 0.83 -0.04 0.00 1.79 -0.85 -1.18 116.57 118.29 1r65 h LYS 229 Ca 0.31 -0.13 -0.00 0.00 -2.18 0.00 0.00 60.65 58.65 1r65 h LYS 229 Cb -0.09 -0.15 -0.00 0.00 -1.58 0.00 0.00 32.23 30.41 1r65 h LYS 229 CO -0.06 0.68 0.01 0.82 -1.08 0.00 0.00 179.45 179.81 1r65 h ILE 230 N 0.78 1.21 -0.34 1.86 2.04 -0.77 -2.63 117.51 119.66 1r65 h ILE 230 Ca 0.20 -0.64 0.03 0.00 1.00 0.00 0.00 64.86 65.45 1r65 h ILE 230 Cb 0.13 1.57 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1r65 h ILE 230 CO -0.02 0.17 0.23 0.40 0.00 0.00 0.00 178.15 178.93 1r65 h ILE 231 N -0.18 1.01 -0.49 -0.67 1.08 -0.43 0.38 117.51 118.20 1r65 h ILE 231 Ca 0.01 -0.11 -0.07 0.00 -0.39 0.00 0.00 64.86 64.29 1r65 h ILE 231 Cb 0.27 0.65 -0.02 0.00 -3.07 0.00 0.00 36.82 34.65 1r65 h ILE 231 CO 0.00 0.06 0.02 0.03 -0.69 0.00 0.00 178.15 177.57 1r65 h ARG 232 N 0.33 0.86 -0.48 2.37 3.08 -1.04 0.21 114.38 119.71 1r65 h ARG 232 Ca 0.14 -0.26 -0.13 0.00 0.07 0.00 0.00 59.98 59.80 1r65 h ARG 232 Cb 0.14 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 1r65 h ARG 232 CO -0.03 0.89 -0.21 -0.07 -1.07 0.00 0.00 179.97 179.48 1r65 h LEU 233 N 0.72 1.01 -0.41 3.04 3.38 -0.90 -1.50 115.31 120.64 1r65 h LEU 233 Ca 0.14 -0.39 -0.04 0.00 0.09 0.00 0.00 57.88 57.68 1r65 h LEU 233 Cb 0.49 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1r65 h LEU 233 CO 0.02 1.18 0.10 0.40 0.09 0.00 0.00 178.44 180.23 1r65 h ILE 234 N 0.84 1.23 -0.43 1.22 2.04 -0.81 -2.47 117.51 119.13 1r65 h ILE 234 Ca 0.11 -0.80 -0.02 0.00 1.00 0.00 0.00 64.86 65.15 1r65 h ILE 234 Cb 0.78 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 1r65 h ILE 234 CO 0.07 0.28 0.20 0.00 0.00 0.00 0.00 178.15 178.70 1r65 h ALA 235 N 0.95 1.55 -0.53 1.87 0.00 -0.45 -0.54 119.26 122.11 1r65 h ALA 235 Ca 0.13 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1r65 h ALA 235 Cb 0.32 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1r65 h ALA 235 CO 0.00 0.36 0.09 -0.09 0.00 0.00 0.00 179.25 179.62 1r65 h ARG 236 N 0.60 0.84 -0.16 0.00 2.43 -0.88 -1.98 114.38 115.23 1r65 h ARG 236 Ca 0.15 -0.19 -0.13 0.00 -0.81 0.00 0.00 59.98 59.00 1r65 h ARG 236 Cb 0.07 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 1r65 h ARG 236 CO -0.02 0.78 -0.40 -0.44 -1.51 0.00 0.00 179.97 178.39 1r65 h ASP 237 N 0.80 0.62 -0.51 -3.80 3.32 -0.82 -3.22 116.42 112.82 1r65 h ASP 237 Ca 0.17 -0.58 0.01 0.00 0.02 0.00 0.00 57.03 56.65 1r65 h ASP 237 Cb 0.35 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 1r65 h ASP 237 CO 0.01 1.09 0.34 -0.33 -1.72 0.00 0.00 179.24 178.62 1r65 h GLU 238 N 0.19 0.66 -0.40 3.56 4.39 -0.96 -0.74 114.58 121.28 1r65 h GLU 238 Ca -0.00 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.64 1r65 h GLU 238 Cb 1.01 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.49 1r65 h GLU 238 CO 0.09 0.44 0.17 0.00 -1.16 0.00 0.00 179.01 178.54 1r65 h ALA 239 N 1.68 1.55 -0.18 3.43 0.00 -1.37 0.11 119.26 124.48 1r65 h ALA 239 Ca 0.19 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 54.82 1r65 h ALA 239 Cb -0.05 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.57 1r65 h ALA 239 CO -0.04 0.36 -0.56 -0.07 0.00 0.00 0.00 179.25 178.93 1r65 h LEU 240 N 0.56 0.81 -0.42 0.00 3.38 -1.21 -2.30 115.31 116.13 1r65 h LEU 240 Ca 0.14 -0.59 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 1r65 h LEU 240 Cb 0.10 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1r65 h LEU 240 CO -0.02 1.26 0.23 0.45 0.09 0.00 0.00 178.44 180.46 1r65 h HIS 241 N 0.40 0.58 -0.06 1.13 3.86 -0.58 -0.51 115.15 119.97 1r65 h HIS 241 Ca -0.02 -0.01 -0.10 0.00 -1.16 0.00 0.00 60.37 59.08 1r65 h HIS 241 Cb 1.18 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 29.46 1r65 h HIS 241 CO 0.09 0.44 -0.42 1.37 0.86 0.00 0.00 177.93 180.27 1r65 h LEU 242 N 0.55 0.15 -0.69 2.43 8.10 -0.84 -1.16 115.31 123.84 1r65 h LEU 242 Ca 0.15 -0.06 -0.05 0.00 0.11 0.00 0.00 57.88 58.03 1r65 h LEU 242 Cb 0.05 -0.04 -0.03 0.00 -0.44 0.00 0.00 40.66 40.20 1r65 h LEU 242 CO -0.02 0.55 0.24 0.74 -4.11 0.00 0.00 178.44 175.84 1r65 h THR 243 N 0.12 1.25 -0.36 0.15 2.02 -0.96 0.15 112.91 115.28 1r65 h THR 243 Ca 0.01 -0.84 -0.02 0.00 0.77 0.00 0.00 66.41 66.33 1r65 h THR 243 Cb 0.79 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 1r65 h THR 243 CO 0.06 0.33 0.14 1.23 0.37 0.00 0.00 175.52 177.65 1r65 h GLY 244 N 1.00 0.57 1.11 2.16 0.00 -0.37 -1.37 103.07 106.17 1r65 h GLY 244 Ca 0.23 -0.31 -0.13 0.00 0.00 0.00 0.00 47.33 47.11 1r65 h GLY 244 CO -0.01 0.29 -0.21 -0.91 0.00 0.00 0.00 176.54 175.70 1r65 h THR 245 N 0.43 1.27 -0.97 4.70 1.35 -1.00 -1.48 112.91 117.21 1r65 h THR 245 Ca 0.12 -1.38 0.01 0.00 -0.55 0.00 0.00 66.41 64.60 1r65 h THR 245 Cb 0.18 1.11 -0.05 0.00 -1.73 0.00 0.00 68.15 67.67 1r65 h THR 245 CO -0.01 0.48 0.63 1.56 -0.25 0.00 0.00 175.52 177.93 1r65 h GLN 246 N 0.87 1.29 -0.43 4.72 4.20 -0.84 -1.16 115.11 123.76 1r65 h GLN 246 Ca 0.11 -0.09 -0.13 0.00 0.06 0.00 0.00 58.65 58.61 1r65 h GLN 246 Cb 0.79 -0.29 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 1r65 h GLN 246 CO 0.07 0.87 -0.23 0.45 -0.67 0.00 0.00 178.83 179.31 1r65 h HIS 247 N 1.32 1.06 0.19 2.96 3.86 -1.06 -0.63 115.15 122.86 1r65 h HIS 247 Ca 0.35 -0.27 -0.01 0.00 -1.16 0.00 0.00 60.37 59.29 1r65 h HIS 247 Cb -0.13 -0.24 -0.00 0.00 1.06 0.00 0.00 27.41 28.10 1r65 h HIS 247 CO -0.00 1.07 -0.12 0.52 0.86 0.00 0.00 177.93 180.26 1r65 h MET 248 N 0.74 -0.28 -0.42 2.45 2.86 -0.89 0.16 114.93 119.55 1r65 h MET 248 Ca 0.09 0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1r65 h MET 248 Cb 0.80 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.51 1r65 h MET 248 CO 0.07 -0.19 0.26 -0.07 1.06 0.00 0.00 176.91 178.04 1r65 h LEU 249 N -0.29 0.50 -1.00 1.22 3.38 -1.19 -1.61 115.31 116.32 1r65 h LEU 249 Ca -0.02 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.80 1r65 h LEU 249 Cb 0.25 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1r65 h LEU 249 CO 0.02 0.40 -0.50 0.78 0.09 0.00 0.00 178.44 179.23 1r65 h ASN 250 N 0.56 0.00 -0.32 -0.43 2.35 -1.01 -1.46 115.58 115.27 1r65 h ASN 250 Ca 0.15 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.76 1r65 h ASN 250 Cb -0.01 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.35 1r65 h ASN 250 CO -0.03 0.50 -0.36 -0.07 -1.65 0.00 0.00 177.43 175.82 1r65 h LEU 251 N 0.00 0.87 -0.70 1.61 3.38 -0.70 -2.41 115.31 117.35 1r65 h LEU 251 Ca -0.00 -0.48 -0.03 0.00 0.09 0.00 0.00 57.88 57.46 1r65 h LEU 251 Cb 0.89 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 1r65 h LEU 251 CO 0.06 1.17 0.33 -0.07 0.09 0.00 0.00 178.44 180.02 1r65 h LEU 252 N 0.58 0.93 -1.39 1.67 3.38 -1.08 -2.69 115.31 116.71 1r65 h LEU 252 Ca 0.05 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 1r65 h LEU 252 Cb 0.94 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1r65 h LEU 252 CO 0.09 0.82 -0.31 -0.09 0.09 0.00 0.00 178.44 179.03 1r65 h ARG 253 N 0.99 0.00 0.00 1.13 9.65 -1.21 -3.02 114.38 121.93 1r65 h ARG 253 Ca 0.24 0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 59.09 1r65 h ARG 253 Cb 0.14 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.72 1r65 h ARG 253 CO -0.03 0.31 -0.16 0.66 2.80 0.00 0.00 179.97 183.55 1r65 h SER 254 N 0.00 0.00 0.00 -3.80 4.64 -1.08 -3.44 113.55 109.87 1r65 h SER 254 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1r65 h SER 254 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1r65 h SER 254 CO 0.04 0.16 0.00 0.61 -0.87 0.00 0.00 176.83 176.77 1r65 n GLY 255 N -0.54 1.03 0.21 -0.77 0.00 -1.18 -4.89 105.19 99.05 1r65 n GLY 255 Ca -0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.14 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 1.00 -3.00 4.61 0.00 -1.85 -3.40 119.26 116.62 1r65 h ALA 256 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1r65 h ALA 256 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1r65 h ALA 256 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 179.25 175.78 1r65 n ASP 257 N -2.91 0.00 -4.64 0.00 2.03 -1.26 -4.96 116.55 104.81 1r65 n ASP 257 Ca 0.03 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.92 1r65 n ASP 257 Cb 0.43 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.80 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 -0.94 6.44 0.56 1.67 2.15 -1.26 -4.86 116.67 120.43 1r65 s ASP 258 Ca 0.00 2.02 0.24 0.00 0.43 0.00 0.00 52.55 55.24 1r65 s ASP 258 Cb 0.00 -2.53 1.56 0.00 -0.30 0.00 0.00 42.92 41.65 1r65 s ASP 258 CO 0.00 -1.15 2.16 1.55 -0.17 0.00 0.00 175.17 177.57 1r65 h PRO 259 N 10.55 0.00 -0.14 4.34 0.13 -1.93 -1.34 132.00 143.61 1r65 h PRO 259 Ca -0.38 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.64 1r65 h PRO 259 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1r65 h PRO 259 CO 0.97 0.00 -0.38 1.49 -0.23 0.00 0.00 178.00 179.85 1r65 h GLU 260 N 0.00 0.30 -0.20 0.86 4.81 -1.95 -2.69 114.58 115.72 1r65 h GLU 260 Ca 0.04 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 59.05 1r65 h GLU 260 Cb 0.19 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1r65 h GLU 260 CO -0.00 0.65 -0.25 0.52 -0.73 0.00 0.00 179.01 179.19 1r65 h MET 261 N 0.26 0.37 -0.70 1.92 2.86 -1.54 -1.19 114.93 116.91 1r65 h MET 261 Ca 0.03 -0.13 -0.06 0.00 -2.06 0.00 0.00 59.70 57.47 1r65 h MET 261 Cb 0.79 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.40 1r65 h MET 261 CO 0.06 0.61 0.21 0.00 1.06 0.00 0.00 176.91 178.84 1r65 h ALA 262 N 1.40 1.05 -0.23 6.32 0.00 -1.35 -0.08 119.26 126.36 1r65 h ALA 262 Ca 0.05 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1r65 h ALA 262 Cb 0.63 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1r65 h ALA 262 CO 0.05 0.64 -0.03 0.93 0.00 0.00 0.00 179.25 180.83 1r65 h GLU 263 N 1.04 0.43 -0.53 0.00 5.08 -1.28 -2.68 114.58 116.65 1r65 h GLU 263 Ca 0.22 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1r65 h GLU 263 Cb 0.31 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 1r65 h GLU 263 CO -0.01 0.64 0.32 0.82 -1.00 0.00 0.00 179.01 179.78 1r65 h ILE 264 N 0.18 1.16 -0.38 3.13 2.04 -1.01 -0.76 117.51 121.87 1r65 h ILE 264 Ca 0.06 -0.37 0.04 0.00 1.00 0.00 0.00 64.86 65.60 1r65 h ILE 264 Cb 0.47 0.45 -0.04 0.00 -0.74 0.00 0.00 36.82 36.96 1r65 h ILE 264 CO 0.02 0.17 0.14 0.00 0.00 0.00 0.00 178.15 178.47 1r65 h ALA 265 N 1.15 0.45 -0.69 1.87 0.00 -0.97 0.24 119.26 121.31 1r65 h ALA 265 Ca 0.19 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 1r65 h ALA 265 Cb -0.01 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1r65 h ALA 265 CO -0.04 -0.25 0.30 1.49 0.00 0.00 0.00 179.25 180.76 1r65 h GLU 266 N 0.30 1.02 -0.07 0.00 4.57 -1.19 -2.43 114.58 116.77 1r65 h GLU 266 Ca 0.17 -0.17 -0.15 0.00 -1.18 0.00 0.00 59.36 58.04 1r65 h GLU 266 Cb 0.14 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 1r65 h GLU 266 CO -0.17 0.82 -0.61 0.93 -1.18 0.00 0.00 179.01 178.80 1r65 h GLU 267 N 0.97 0.25 -0.38 1.92 5.08 -0.57 -3.15 114.58 118.71 1r65 h GLU 267 Ca 0.23 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1r65 h GLU 267 Cb 0.17 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1r65 h GLU 267 CO -0.02 0.78 0.00 0.00 -1.00 0.00 0.00 179.01 178.77 1r65 h LYS 269 N 2.38 0.04 -0.15 0.00 3.11 -1.39 -0.06 116.57 120.49 1r65 h LYS 269 Ca 0.00 -0.00 -0.10 0.00 -2.81 0.00 0.00 60.65 57.74 1r65 h LYS 269 Cb 0.54 -0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.75 1r65 h LYS 269 CO 0.00 0.03 -0.36 0.37 -2.81 0.00 0.00 179.45 176.68 1r65 h GLN 270 N 0.04 0.31 -0.43 1.90 5.75 -1.87 -2.39 115.11 118.42 1r65 h GLN 270 Ca 0.43 -0.14 -0.13 0.00 -0.15 0.00 0.00 58.65 58.67 1r65 h GLN 270 Cb 0.75 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.28 1r65 h GLN 270 CO -0.79 0.63 -0.24 0.93 -2.65 0.00 0.00 178.83 176.71 1r65 h GLU 271 N 0.27 0.90 -0.04 1.69 4.39 -1.38 0.93 114.58 121.34 1r65 h GLU 271 Ca 0.03 -0.39 0.00 0.00 0.34 0.00 0.00 59.36 59.34 1r65 h GLU 271 Cb 0.76 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.38 1r65 h GLU 271 CO 0.06 1.04 0.02 0.00 -1.16 0.00 0.00 179.01 178.97 1r65 h TYR 273 N 0.04 0.00 -0.85 0.00 3.20 -1.21 -2.74 116.97 115.41 1r65 h TYR 273 Ca 0.01 0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.94 1r65 h TYR 273 Cb -0.00 0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.24 1r65 h TYR 273 CO -0.08 -0.02 0.56 -0.44 -1.64 0.00 0.00 178.16 176.54 1r65 h ASP 274 N 0.07 0.88 0.80 -2.11 3.32 -0.53 -1.78 116.42 117.07 1r65 h ASP 274 Ca 0.08 -0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.99 1r65 h ASP 274 Cb 0.10 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 1r65 h ASP 274 CO -0.14 0.59 -0.66 0.17 -1.72 0.00 0.00 179.24 177.48 1r65 h LEU 275 N 1.01 0.00 -0.23 1.55 8.10 -0.99 -0.52 115.31 124.23 1r65 h LEU 275 Ca 0.35 0.00 -0.12 0.00 0.11 0.00 0.00 57.88 58.22 1r65 h LEU 275 Cb 0.11 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.32 1r65 h LEU 275 CO -0.11 0.66 -0.31 -0.26 -4.11 0.00 0.00 178.44 174.31 1r65 h PHE 276 N 0.00 0.76 -0.55 0.17 0.04 -1.19 -0.06 116.94 116.11 1r65 h PHE 276 Ca -0.01 -0.25 -0.07 0.00 2.80 0.00 0.00 57.97 60.45 1r65 h PHE 276 Cb 1.24 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 39.22 1r65 h PHE 276 CO 0.00 0.98 0.07 0.28 -0.60 0.00 0.00 178.31 179.04 1r65 h VAL 277 N 0.32 1.24 -0.36 -0.55 2.07 -1.24 -0.78 116.25 116.95 1r65 h VAL 277 Ca 0.03 -0.96 -0.07 0.00 0.82 0.00 0.00 66.70 66.52 1r65 h VAL 277 Cb 0.88 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1r65 h VAL 277 CO 0.07 0.35 -0.03 1.56 0.02 0.00 0.00 177.57 179.54 1r65 h GLN 278 N 0.84 0.65 -0.81 1.57 1.08 -0.95 -1.79 115.11 115.70 1r65 h GLN 278 Ca 0.17 -0.23 -0.04 0.00 -1.45 0.00 0.00 58.65 57.11 1r65 h GLN 278 Cb 0.40 -0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 27.75 1r65 h GLN 278 CO 0.01 0.79 0.35 0.00 -0.95 0.00 0.00 178.83 179.03 1r65 h ALA 279 N 0.84 1.05 -0.57 3.87 0.00 -0.76 -1.15 119.26 122.54 1r65 h ALA 279 Ca 0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1r65 h ALA 279 Cb 0.51 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1r65 h ALA 279 CO 0.03 0.65 0.28 0.00 0.00 0.00 0.00 179.25 180.20 1r65 h ALA 280 N 1.19 0.74 -0.39 0.00 0.00 -1.00 -2.15 119.26 117.64 1r65 h ALA 280 Ca 0.27 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1r65 h ALA 280 Cb 0.18 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1r65 h ALA 280 CO -0.03 0.30 -0.07 0.37 0.00 0.00 0.00 179.25 179.83 1r65 h GLN 281 N 0.78 0.67 -0.56 0.00 5.75 -0.87 -2.12 115.11 118.76 1r65 h GLN 281 Ca 0.20 -0.19 -0.07 0.00 -0.15 0.00 0.00 58.65 58.43 1r65 h GLN 281 Cb 0.12 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.57 1r65 h GLN 281 CO -0.02 0.73 0.05 1.96 -2.65 0.00 0.00 178.83 178.89 1r65 h GLN 282 N 0.62 0.92 -0.43 1.69 4.20 -0.92 -0.17 115.11 121.02 1r65 h GLN 282 Ca 0.12 -0.24 -0.11 0.00 0.06 0.00 0.00 58.65 58.47 1r65 h GLN 282 Cb 0.49 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.14 1r65 h GLN 282 CO 0.03 0.88 -0.18 0.93 -0.67 0.00 0.00 178.83 179.82 1r65 h GLU 283 N 0.86 0.83 -0.29 1.46 4.39 -1.01 -2.50 114.58 118.32 1r65 h GLU 283 Ca 0.17 -0.32 -0.12 0.00 0.34 0.00 0.00 59.36 59.43 1r65 h GLU 283 Cb 0.44 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1r65 h GLU 283 CO 0.02 0.94 -0.30 0.87 -1.16 0.00 0.00 179.01 179.38 1r65 h LYS 284 N 0.73 0.72 0.00 2.33 1.57 -1.11 -2.93 116.57 117.89 1r65 h LYS 284 Ca 0.11 -0.39 -0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1r65 h LYS 284 Cb 0.69 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.02 1r65 h LYS 284 CO 0.05 1.00 -0.02 -0.44 -0.57 0.00 0.00 179.45 179.48 1r65 h ASP 285 N 0.47 0.00 0.16 0.86 3.45 -0.91 -1.40 116.42 119.05 1r65 h ASP 285 Ca 0.05 0.00 -0.07 0.00 0.43 0.00 0.00 57.03 57.44 1r65 h ASP 285 Cb 0.88 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.63 1r65 h ASP 285 CO 0.07 0.02 -0.25 -0.25 -1.57 0.00 0.00 179.24 177.26 1r65 h TRP 286 N 0.00 0.18 -0.93 4.55 2.91 -1.25 -3.04 115.95 118.37 1r65 h TRP 286 Ca -0.00 -0.03 0.15 0.00 1.13 0.00 0.00 58.89 60.14 1r65 h TRP 286 Cb 0.04 -0.05 -0.08 0.00 -0.51 0.00 0.00 29.16 28.56 1r65 h TRP 286 CO 0.00 0.41 0.59 0.00 -1.03 0.00 0.00 178.44 178.41 1r65 h ALA 287 N 1.60 1.78 -1.00 2.65 0.00 -1.31 -0.93 119.26 122.04 1r65 h ALA 287 Ca 0.02 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.05 1r65 h ALA 287 Cb 0.53 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 1r65 h ALA 287 CO 0.04 -0.04 0.64 -0.44 0.00 0.00 0.00 179.25 179.45 1r65 h ASP 288 N 0.74 0.99 0.15 0.00 3.32 -1.69 -1.43 116.42 118.50 1r65 h ASP 288 Ca 0.47 0.03 -0.20 0.00 0.02 0.00 0.00 57.03 57.35 1r65 h ASP 288 Cb 0.72 -0.18 0.02 0.00 0.22 0.00 0.00 39.33 40.11 1r65 h ASP 288 CO -0.23 0.59 -0.88 0.22 -1.72 0.00 0.00 179.24 177.21 1r65 h TYR 289 N 1.10 0.57 -0.76 4.55 3.20 -1.40 -3.02 116.97 121.21 1r65 h TYR 289 Ca 0.46 -0.42 0.11 0.00 3.14 0.00 0.00 58.73 62.02 1r65 h TYR 289 Cb 0.30 -0.02 -0.08 0.00 1.54 0.00 0.00 36.73 38.47 1r65 h TYR 289 CO -0.00 1.34 0.38 1.25 -1.64 0.00 0.00 178.16 179.49 1r65 h LEU 290 N -0.34 0.49 -3.62 2.82 6.46 -1.00 -2.55 115.31 117.57 1r65 h LEU 290 Ca -0.16 0.07 -0.32 0.00 -0.12 0.00 0.00 57.88 57.35 1r65 h LEU 290 Cb 1.68 -0.01 -0.19 0.00 -0.73 0.00 0.00 40.66 41.41 1r65 h LEU 290 CO 0.16 0.26 0.22 0.49 -0.62 0.00 0.00 178.44 178.96 1r65 n PHE 291 N -4.86 1.92 0.05 1.25 3.72 -0.56 -4.41 117.46 114.59 1r65 n PHE 291 Ca 0.13 -1.70 -0.01 0.00 -0.05 0.00 0.00 57.45 55.82 1r65 n PHE 291 Cb 0.32 -0.68 0.28 0.00 -0.94 0.00 0.00 39.48 38.45 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 1.03 0.38 -0.70 -1.08 0.11 -1.31 -2.61 114.38 110.19 1r65 h ARG 292 Ca 0.39 -0.12 0.00 0.00 0.10 0.00 0.00 59.98 60.36 1r65 h ARG 292 Cb 2.17 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 33.22 1r65 h ARG 292 CO 0.69 0.56 0.00 -0.25 0.10 0.00 0.00 179.97 181.07 1r65 n ASP 293 N -4.18 3.78 0.00 0.08 8.00 -1.26 -5.03 116.55 117.94 1r65 n ASP 293 Ca -0.00 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.50 1r65 n ASP 293 Cb 0.35 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 40.98 1r65 n ASP 293 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1r65 n GLY 294 N 1.62 3.51 0.00 0.44 0.00 -0.98 -4.70 105.19 105.07 1r65 n GLY 294 Ca 0.24 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.41 1r65 n GLY 294 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1r65 n SER 295 N 0.00 1.37 -4.31 1.61 3.41 -1.26 -4.50 113.62 109.94 1r65 n SER 295 Ca 0.00 -0.63 -0.17 0.00 -0.26 0.00 0.00 58.87 57.81 1r65 n SER 295 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 1r65 n SER 295 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1r65 s MET 296 N -0.66 1.25 0.05 4.33 -1.94 -0.46 -4.96 119.30 116.91 1r65 s MET 296 Ca 0.00 -1.59 -0.30 0.00 -1.71 0.00 0.00 55.69 52.09 1r65 s MET 296 Cb 0.00 -0.74 -0.08 0.00 2.01 0.00 0.00 34.83 36.02 1r65 s MET 296 CO 0.00 0.02 1.65 0.42 -0.01 0.00 0.00 175.02 177.10 1r65 s ILE 297 N -3.28 3.14 0.00 2.53 -1.09 -1.26 -1.62 121.20 119.62 1r65 s ILE 297 Ca 0.23 0.53 0.00 0.00 -2.23 0.00 0.00 60.65 59.18 1r65 s ILE 297 Cb 0.03 -3.34 0.00 0.00 -1.58 0.00 0.00 42.46 37.57 1r65 s ILE 297 CO 0.06 -0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.37 1r65 n GLY 298 N 4.01 1.20 2.61 6.18 0.00 -1.26 -4.97 105.19 112.96 1r65 n GLY 298 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 1r65 n GLY 298 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1r65 s LEU 299 N 0.00 0.28 0.35 0.99 2.96 -0.64 -4.99 118.68 117.63 1r65 s LEU 299 Ca 0.00 -1.09 -0.02 0.00 -0.22 0.00 0.00 54.13 52.80 1r65 s LEU 299 Cb 0.00 -0.07 0.01 0.00 0.50 0.00 0.00 46.19 46.63 1r65 s LEU 299 CO 0.00 -0.42 0.49 0.54 -1.32 0.00 0.00 176.35 175.64 1r65 s ASN 300 N 2.19 0.95 0.19 3.68 2.20 -1.26 -1.36 114.94 121.53 1r65 s ASN 300 Ca 0.09 -1.50 -0.12 0.00 -0.94 0.00 0.00 52.86 50.39 1r65 s ASN 300 Cb -0.15 0.68 0.22 0.00 -2.00 0.00 0.00 41.25 39.99 1r65 s ASN 300 CO -0.35 -1.32 1.71 0.50 -2.94 0.00 0.00 177.10 174.70 1r65 h LYS 301 N 2.09 0.21 -0.56 3.55 3.64 -1.97 -1.25 116.57 122.28 1r65 h LYS 301 Ca -0.28 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 1r65 h LYS 301 Cb 1.24 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.98 1r65 h LYS 301 CO 0.39 0.14 0.36 -0.44 -2.27 0.00 0.00 179.45 177.63 1r65 h ASP 302 N 0.22 0.65 -0.41 4.20 5.19 -1.99 -1.56 116.42 122.72 1r65 h ASP 302 Ca 0.27 -0.03 -0.14 0.00 -0.62 0.00 0.00 57.03 56.51 1r65 h ASP 302 Cb 0.38 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.71 1r65 h ASP 302 CO -0.36 0.48 -0.29 0.40 -3.12 0.00 0.00 179.24 176.35 1r65 h ILE 303 N 0.76 1.27 -0.75 0.35 2.04 -1.87 -1.87 117.51 117.43 1r65 h ILE 303 Ca 0.20 -1.45 -0.05 0.00 1.00 0.00 0.00 64.86 64.57 1r65 h ILE 303 Cb -0.07 1.24 -0.03 0.00 -0.74 0.00 0.00 36.82 37.22 1r65 h ILE 303 CO -0.04 0.49 0.29 0.25 0.00 0.00 0.00 178.15 179.14 1r65 h LEU 304 N 0.79 1.04 -0.60 1.44 6.46 -1.03 -0.83 115.31 122.58 1r65 h LEU 304 Ca 0.09 -0.18 -0.12 0.00 -0.12 0.00 0.00 57.88 57.55 1r65 h LEU 304 Cb 0.86 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 40.51 1r65 h LEU 304 CO 0.08 0.94 -0.17 0.00 -0.62 0.00 0.00 178.44 178.67 1r65 h GLN 306 N 0.82 0.96 -0.54 0.00 4.20 -1.04 -2.34 115.11 117.17 1r65 h GLN 306 Ca 0.12 -0.26 -0.09 0.00 0.06 0.00 0.00 58.65 58.48 1r65 h GLN 306 Cb 0.72 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.37 1r65 h GLN 306 CO 0.06 0.92 -0.01 -0.92 -0.67 0.00 0.00 178.83 178.20 1r65 h TYR 307 N 0.85 1.04 -0.64 2.96 3.20 -0.92 -1.45 116.97 122.01 1r65 h TYR 307 Ca 0.17 -0.18 0.02 0.00 3.14 0.00 0.00 58.73 61.88 1r65 h TYR 307 Cb 0.43 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 38.39 1r65 h TYR 307 CO 0.03 0.96 0.41 0.28 -1.64 0.00 0.00 178.16 178.20 1r65 h VAL 308 N 0.83 1.11 -0.40 1.81 2.07 -1.01 -0.76 116.25 119.90 1r65 h VAL 308 Ca 0.15 -0.28 -0.12 0.00 0.82 0.00 0.00 66.70 67.28 1r65 h VAL 308 Cb 0.55 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1r65 h VAL 308 CO 0.03 0.15 -0.22 -0.33 0.02 0.00 0.00 177.57 177.22 1r65 h GLU 309 N 0.81 0.80 0.52 1.57 5.08 -1.28 -1.10 114.58 120.98 1r65 h GLU 309 Ca 0.25 -0.32 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 1r65 h GLU 309 Cb -0.02 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.20 1r65 h GLU 309 CO -0.09 0.94 -0.25 -0.92 -1.00 0.00 0.00 179.01 177.70 1r65 h TYR 310 N 0.70 -0.65 -0.17 4.33 3.20 -0.71 -2.51 116.97 121.15 1r65 h TYR 310 Ca 0.10 -0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.81 1r65 h TYR 310 Cb 0.74 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 39.21 1r65 h TYR 310 CO 0.04 -0.40 -0.49 0.97 -1.64 0.00 0.00 178.16 176.64 1r65 h ILE 311 N -0.72 1.32 -0.25 1.81 6.09 -1.16 -2.96 117.51 121.64 1r65 h ILE 311 Ca -0.07 -1.71 0.00 0.00 -1.37 0.00 0.00 64.86 61.71 1r65 h ILE 311 Cb 0.55 1.72 -0.01 0.00 0.47 0.00 0.00 36.82 39.55 1r65 h ILE 311 CO 0.12 0.53 0.16 0.74 -3.07 0.00 0.00 178.15 176.63 1r65 h THR 312 N 0.37 1.08 -0.56 2.19 2.02 -1.19 0.25 112.91 117.07 1r65 h THR 312 Ca 0.02 -0.16 0.05 0.00 0.77 0.00 0.00 66.41 67.09 1r65 h THR 312 Cb 0.99 0.73 -0.05 0.00 -1.74 0.00 0.00 68.15 68.09 1r65 h THR 312 CO 0.09 0.07 0.29 0.78 0.37 0.00 0.00 175.52 177.12 1r65 h ASN 313 N 0.33 0.42 -0.26 4.18 4.21 -1.43 -0.17 115.58 122.86 1r65 h ASN 313 Ca 0.09 0.03 0.01 0.00 1.21 0.00 0.00 56.30 57.64 1r65 h ASN 313 Cb -0.02 -0.05 -0.02 0.00 -1.12 0.00 0.00 38.32 37.12 1r65 h ASN 313 CO -0.02 0.29 0.16 0.40 -1.29 0.00 0.00 177.43 176.97 1r65 h ILE 314 N 0.56 1.05 -0.47 2.81 2.04 -1.26 -1.73 117.51 120.50 1r65 h ILE 314 Ca 0.25 -0.11 -0.07 0.00 1.00 0.00 0.00 64.86 65.92 1r65 h ILE 314 Cb 0.15 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 1r65 h ILE 314 CO -0.16 0.06 0.01 0.03 0.00 0.00 0.00 178.15 178.08 1r65 h ARG 315 N 0.33 0.83 -0.36 2.37 2.47 -0.58 -2.53 114.38 116.91 1r65 h ARG 315 Ca 0.10 -0.26 -0.08 0.00 -1.26 0.00 0.00 59.98 58.48 1r65 h ARG 315 Cb -0.02 -0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 28.21 1r65 h ARG 315 CO -0.04 0.87 -0.12 0.52 0.56 0.00 0.00 179.97 181.77 1r65 h MET 316 N 0.68 0.62 -0.78 0.04 2.86 -0.98 -2.70 114.93 114.68 1r65 h MET 316 Ca 0.13 -0.19 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 1r65 h MET 316 Cb 0.50 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.06 1r65 h MET 316 CO 0.02 0.73 0.32 0.37 1.06 0.00 0.00 176.91 179.41 1r65 h GLN 317 N 0.57 1.15 0.00 1.72 5.75 -1.19 0.59 115.11 123.70 1r65 h GLN 317 Ca 0.10 -0.20 -0.01 0.00 -0.15 0.00 0.00 58.65 58.39 1r65 h GLN 317 Cb 0.54 -0.19 -0.00 0.00 1.07 0.00 0.00 27.48 28.90 1r65 h GLN 317 CO 0.03 0.93 -0.06 0.00 -2.65 0.00 0.00 178.83 177.08 1r65 h ALA 318 N 1.22 1.19 -0.28 3.38 0.00 -1.11 -2.28 119.26 121.37 1r65 h ALA 318 Ca 0.26 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1r65 h ALA 318 Cb 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1r65 h ALA 318 CO -0.02 0.08 0.00 1.33 0.00 0.00 0.00 179.25 180.63 1r65 n VAL 319 N -3.43 1.91 -1.00 0.00 0.24 -1.02 -4.98 118.33 110.04 1r65 n VAL 319 Ca -0.02 -1.63 -0.00 0.00 -2.04 0.00 0.00 64.34 60.66 1r65 n VAL 319 Cb 0.20 -0.03 -0.00 0.00 -1.47 0.00 0.00 33.84 32.53 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 -0.23 0.39 3.94 7.63 0.00 -0.86 -4.96 105.19 111.10 1r65 n GLY 320 Ca 0.18 -1.01 -0.26 0.00 0.00 0.00 0.00 46.02 44.93 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 -0.02 4.24 0.66 0.99 1.43 0.17 -5.00 118.68 121.14 1r65 s LEU 321 Ca 0.00 0.32 -0.15 0.00 -1.03 0.00 0.00 54.13 53.26 1r65 s LEU 321 Cb 0.00 -3.09 0.00 0.00 0.03 0.00 0.00 46.19 43.13 1r65 s LEU 321 CO 0.00 -0.06 1.12 -1.81 0.23 0.00 0.00 176.35 175.83 1r65 s ASP 322 N -3.40 5.05 -0.18 2.29 1.01 -1.26 -4.04 116.67 116.14 1r65 s ASP 322 Ca 0.37 2.04 -0.22 0.00 0.71 0.00 0.00 52.55 55.45 1r65 s ASP 322 Cb -0.11 -2.56 -0.02 0.00 1.01 0.00 0.00 42.92 41.25 1r65 s ASP 322 CO 0.30 -1.67 0.68 -0.76 0.21 0.00 0.00 175.17 173.93 1r65 s LEU 323 N -4.84 4.17 0.09 1.23 1.43 -1.26 -4.86 118.68 114.63 1r65 s LEU 323 Ca 0.68 0.95 -0.10 0.00 -1.03 0.00 0.00 54.13 54.62 1r65 s LEU 323 Cb -0.21 -2.99 -0.19 0.00 0.03 0.00 0.00 46.19 42.83 1r65 s LEU 323 CO 0.41 -0.29 1.22 -0.65 0.23 0.00 0.00 176.35 177.27 1r65 h PRO 324 N 7.38 0.58 -6.34 1.29 0.11 -1.94 -3.47 132.00 129.61 1r65 h PRO 324 Ca -0.32 -0.64 -0.48 0.00 0.11 0.00 0.00 66.00 64.67 1r65 h PRO 324 Cb 1.14 0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.44 1r65 h PRO 324 CO 0.79 1.25 -0.31 -0.06 -0.21 0.00 0.00 178.00 179.46 1r65 s PHE 325 N -3.26 3.48 0.47 0.65 0.08 -1.26 -5.07 117.98 113.06 1r65 s PHE 325 Ca -0.08 0.20 -0.23 0.00 0.12 0.00 0.00 56.93 56.93 1r65 s PHE 325 Cb 0.07 -1.75 -0.07 0.00 -0.57 0.00 0.00 43.02 40.70 1r65 s PHE 325 CO 0.90 0.29 1.22 1.21 -0.10 0.00 0.00 175.22 178.74 1r65 s ASN 326 N -3.88 6.00 0.50 1.36 2.47 -1.26 -4.96 114.94 115.16 1r65 s ASN 326 Ca 0.37 2.43 -0.21 0.00 0.42 0.00 0.00 52.86 55.87 1r65 s ASN 326 Cb -0.10 -2.61 -0.07 0.00 -1.45 0.00 0.00 41.25 37.02 1r65 s ASN 326 CO 0.32 -1.05 1.12 0.42 -3.72 0.00 0.00 177.10 174.19 1r65 s THR 327 N -1.47 3.28 0.18 -5.21 -4.23 -1.26 -4.92 115.64 102.02 1r65 s THR 327 Ca 0.65 0.85 -0.23 0.00 -1.18 0.00 0.00 61.69 61.78 1r65 s THR 327 Cb -0.32 -3.38 0.06 0.00 1.34 0.00 0.00 72.50 70.20 1r65 s THR 327 CO 0.39 -0.12 0.67 0.00 -0.54 0.00 0.00 174.62 175.01 1r65 s ARG 328 N -3.07 1.39 0.64 3.99 1.70 -1.26 -5.16 118.95 117.19 1r65 s ARG 328 Ca 0.68 -0.61 -0.08 0.00 -0.47 0.00 0.00 55.73 55.25 1r65 s ARG 328 Cb -0.24 0.58 0.02 0.00 -0.57 0.00 0.00 34.95 34.73 1r65 s ARG 328 CO 0.28 -0.62 0.98 -1.12 -1.08 0.00 0.00 175.30 173.74 1r65 s SER 329 N -2.79 5.47 -0.03 -2.89 0.01 -1.26 -4.96 113.70 107.25 1r65 s SER 329 Ca 0.04 0.83 -0.32 0.00 1.31 0.00 0.00 55.95 57.82 1r65 s SER 329 Cb -0.02 -1.73 -0.10 0.00 0.21 0.00 0.00 66.02 64.37 1r65 s SER 329 CO -0.07 -1.21 1.94 -3.20 0.41 0.00 0.00 173.24 171.11 1r65 n ASN 330 N -2.76 3.80 0.02 2.44 2.85 -1.26 -4.85 115.26 115.51 1r65 n ASN 330 Ca 0.06 0.93 0.11 0.00 -0.11 0.00 0.00 54.58 55.56 1r65 n ASN 330 Cb 0.58 -1.45 0.47 0.00 1.24 0.00 0.00 39.78 40.61 1r65 n ASN 330 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1r65 n PRO 331 N 7.13 0.04 -3.17 1.20 -0.04 -1.26 -3.98 135.00 134.92 1r65 n PRO 331 Ca 0.22 0.16 -0.20 0.00 -0.04 0.00 0.00 63.50 63.64 1r65 n PRO 331 Cb 0.35 -1.56 -0.04 0.00 -0.04 0.00 0.00 33.50 32.21 1r65 n PRO 331 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1r65 n ILE 332 N -1.64 -0.33 0.21 0.52 -5.35 -1.26 -4.97 119.36 106.54 1r65 n ILE 332 Ca 0.05 -4.30 0.11 0.00 -0.27 0.00 0.00 62.75 58.34 1r65 n ILE 332 Cb 0.27 -0.74 0.58 0.00 -1.74 0.00 0.00 39.64 38.01 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 3.33 0.00 0.00 6.28 0.13 -1.98 -1.67 132.00 138.09 1r65 h PRO 333 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1r65 h PRO 333 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 1r65 h PRO 333 CO 0.48 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.58 1r65 n TRP 334 N -2.35 0.84 0.16 1.56 4.27 -1.26 -2.45 117.44 118.21 1r65 n TRP 334 Ca -0.01 0.36 0.02 0.00 -3.89 0.00 0.00 57.50 53.97 1r65 n TRP 334 Cb 0.22 -1.07 0.23 0.00 -1.36 0.00 0.00 31.31 29.33 1r65 n TRP 334 CO 0.00 0.00 0.00 -0.84 -2.29 0.00 0.00 177.69 174.56 1r65 h ILE 335 N 0.00 1.21 -0.92 -1.67 3.07 -1.73 -3.26 117.51 114.21 1r65 h ILE 335 Ca 0.00 -1.88 0.18 0.00 1.55 0.00 0.00 64.86 64.70 1r65 h ILE 335 Cb 0.27 2.06 -0.10 0.00 -0.27 0.00 0.00 36.82 38.78 1r65 h ILE 335 CO 0.00 0.51 0.51 0.78 -1.05 0.00 0.00 178.15 178.90 1r65 h ASN 336 N 0.00 0.62 0.22 2.16 2.35 -1.71 0.14 115.58 119.37 1r65 h ASN 336 Ca -0.01 0.10 -0.03 0.00 -0.55 0.00 0.00 56.30 55.82 1r65 h ASN 336 Cb 1.02 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.39 1r65 h ASN 336 CO 0.07 0.22 -0.13 0.71 -1.65 0.00 0.00 177.43 176.64 1r65 h THR 337 N 0.66 0.84 0.00 2.81 1.35 -1.78 -2.69 112.91 114.10 1r65 h THR 337 Ca 0.53 -0.50 -0.19 0.00 -0.55 0.00 0.00 66.41 65.70 1r65 h THR 337 Cb 0.82 1.29 -0.03 0.00 -1.73 0.00 0.00 68.15 68.50 1r65 h THR 337 CO -0.39 0.13 -1.19 -0.50 -0.25 0.00 0.00 175.52 173.31 1r65 h TRP 338 N 0.00 0.00 -2.87 4.73 4.06 -0.93 -3.46 115.95 117.48 1r65 h TRP 338 Ca -0.00 0.00 -0.63 0.00 2.06 0.00 0.00 58.89 60.32 1r65 h TRP 338 Cb 0.28 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.39 1r65 h TRP 338 CO 0.00 0.72 -0.46 -0.51 -3.56 0.00 0.00 178.44 174.63 1r65 s LEU 339 N -6.16 4.36 0.00 -4.49 2.01 -0.62 -4.81 118.68 108.96 1r65 s LEU 339 Ca -0.01 0.38 0.00 0.00 0.01 0.00 0.00 54.13 54.51 1r65 s LEU 339 Cb 0.08 -2.75 0.00 0.00 0.01 0.00 0.00 46.19 43.54 1r65 s LEU 339 CO 0.80 0.23 0.00 0.52 1.01 0.00 0.00 176.35 178.91