#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ds1 h GLU 2 N 0.00 0.48 0.00 2.12 5.08 -2.06 -1.32 114.58 118.88 2ds1 h GLU 2 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2ds1 h GLU 2 Cb 0.00 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.14 2ds1 h GLU 2 CO 0.00 0.32 0.00 0.09 -1.00 0.00 0.00 179.01 178.42 2ds1 n ASN 3 N -4.66 0.00 -4.29 1.42 3.02 -1.26 -4.82 115.26 104.67 2ds1 n ASN 3 Ca 0.24 -0.32 -0.18 0.00 -0.03 0.00 0.00 54.58 54.29 2ds1 n ASN 3 Cb 0.76 -0.14 -0.11 0.00 -0.61 0.00 0.00 39.78 39.69 2ds1 n ASN 3 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2ds1 s PHE 4 N -2.28 1.56 -0.10 3.10 0.40 -0.50 -1.45 117.98 118.71 2ds1 s PHE 4 Ca 0.25 -0.57 -0.01 0.00 -0.60 0.00 0.00 56.93 55.99 2ds1 s PHE 4 Cb 0.14 -0.77 0.03 0.00 0.51 0.00 0.00 43.02 42.93 2ds1 s PHE 4 CO 0.27 0.24 -0.01 1.14 0.70 0.00 0.00 175.22 177.56 2ds1 s GLN 5 N -3.17 0.81 0.20 0.44 -2.07 -0.93 -4.81 119.66 110.13 2ds1 s GLN 5 Ca 0.16 -0.07 -0.31 0.00 -1.82 0.00 0.00 55.36 53.32 2ds1 s GLN 5 Cb -0.03 -1.33 -0.10 0.00 -1.09 0.00 0.00 33.01 30.47 2ds1 s GLN 5 CO 0.05 -0.36 1.47 0.15 -1.32 0.00 0.00 175.29 175.28 2ds1 s LYS 6 N 1.89 4.26 -0.24 9.60 1.02 -1.26 -1.33 119.74 133.69 2ds1 s LYS 6 Ca 0.04 2.28 -0.03 0.00 0.02 0.00 0.00 55.97 58.28 2ds1 s LYS 6 Cb -0.13 -3.15 -0.18 0.00 -0.52 0.00 0.00 37.83 33.85 2ds1 s LYS 6 CO -0.06 -0.48 -0.12 0.28 -0.92 0.00 0.00 175.35 174.04 2ds1 n VAL 7 N 3.16 1.55 -3.58 3.17 0.31 0.66 -4.92 118.33 118.67 2ds1 n VAL 7 Ca 0.10 -0.54 -0.06 0.00 -0.01 0.00 0.00 64.34 63.83 2ds1 n VAL 7 Cb 0.40 -1.57 -0.03 0.00 -0.91 0.00 0.00 33.84 31.73 2ds1 n VAL 7 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2ds1 s GLU 8 N -2.52 0.41 -0.56 5.55 -1.05 -1.08 -5.00 118.70 114.46 2ds1 s GLU 8 Ca -0.33 -0.08 -0.25 0.00 -0.15 0.00 0.00 54.97 54.16 2ds1 s GLU 8 Cb 0.09 0.19 0.04 0.00 -0.44 0.00 0.00 34.13 34.01 2ds1 s GLU 8 CO 0.61 -0.16 1.01 0.21 0.95 0.00 0.00 175.26 177.88 2ds1 s LYS 9 N -2.11 3.38 0.00 -4.83 2.20 -1.26 -0.42 119.74 116.70 2ds1 s LYS 9 Ca 0.07 -0.13 0.25 0.00 -0.36 0.00 0.00 55.97 55.80 2ds1 s LYS 9 Cb -0.01 -4.04 0.56 0.00 -1.51 0.00 0.00 37.83 32.83 2ds1 s LYS 9 CO -0.05 -1.55 1.45 0.44 -0.36 0.00 0.00 175.35 175.28 2ds1 n ILE 10 N 6.33 0.00 -0.08 5.43 -5.35 -0.64 -4.95 119.36 120.09 2ds1 n ILE 10 Ca 0.04 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.49 2ds1 n ILE 10 Cb 0.48 0.29 0.00 0.00 -1.74 0.00 0.00 39.64 38.66 2ds1 n ILE 10 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ds1 n GLY 11 N 1.46 -1.25 2.54 3.28 0.00 -1.07 -5.03 105.19 105.12 2ds1 n GLY 11 Ca 0.07 -1.03 -0.29 0.00 0.00 0.00 0.00 46.02 44.77 2ds1 n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ds1 s GLU 12 N -1.95 0.40 0.00 1.61 2.02 -1.26 -1.67 118.70 117.84 2ds1 s GLU 12 Ca 0.00 -0.90 0.00 0.00 0.02 0.00 0.00 54.97 54.09 2ds1 s GLU 12 Cb 0.00 -1.32 0.00 0.00 0.10 0.00 0.00 34.13 32.91 2ds1 s GLU 12 CO 0.00 -1.09 0.00 0.41 0.02 0.00 0.00 175.26 174.60 2ds1 n GLY 13 N 4.74 -2.88 0.20 -1.39 0.00 -0.54 -4.95 105.19 100.37 2ds1 n GLY 13 Ca 0.01 -1.37 -0.14 0.00 0.00 0.00 0.00 46.02 44.51 2ds1 n GLY 13 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2ds1 h THR 14 N -1.67 1.33 0.00 2.61 2.02 -1.99 -3.35 112.91 111.86 2ds1 h THR 14 Ca 0.00 -2.11 -0.07 0.00 0.77 0.00 0.00 66.41 65.00 2ds1 h THR 14 Cb 0.00 2.11 -0.01 0.00 -1.74 0.00 0.00 68.15 68.50 2ds1 h THR 14 CO 0.00 0.65 -1.58 -1.22 0.37 0.00 0.00 175.52 173.74 2ds1 n TYR 15 N -3.87 0.54 -4.03 3.16 4.01 -1.26 -3.26 117.16 112.45 2ds1 n TYR 15 Ca -0.06 0.17 0.04 0.00 -0.16 0.00 0.00 57.90 57.88 2ds1 n TYR 15 Cb 0.75 -0.83 0.01 0.00 -0.31 0.00 0.00 39.34 38.96 2ds1 n TYR 15 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2ds1 n GLY 16 N 1.31 0.17 3.79 2.72 0.00 -1.18 -4.54 105.19 107.46 2ds1 n GLY 16 Ca -0.07 -0.97 -0.34 0.00 0.00 0.00 0.00 46.02 44.64 2ds1 n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ds1 s VAL 17 N -2.01 3.64 -0.12 1.61 1.01 -1.25 -1.47 120.40 121.82 2ds1 s VAL 17 Ca 0.26 0.97 0.02 0.00 0.00 0.00 0.00 61.98 63.22 2ds1 s VAL 17 Cb -0.00 -3.39 0.01 0.00 0.00 0.00 0.00 36.38 33.00 2ds1 s VAL 17 CO -0.02 -0.27 -0.17 -0.69 0.00 0.00 0.00 175.10 173.94 2ds1 s VAL 18 N -2.03 1.68 0.14 2.92 1.01 -0.67 -1.52 120.40 121.93 2ds1 s VAL 18 Ca 0.68 -0.75 0.10 0.00 0.00 0.00 0.00 61.98 62.00 2ds1 s VAL 18 Cb -0.18 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 2ds1 s VAL 18 CO 0.25 0.48 -0.20 -0.31 0.00 0.00 0.00 175.10 175.32 2ds1 s TYR 19 N 0.94 2.46 -0.07 5.22 2.02 0.97 -1.62 117.35 127.25 2ds1 s TYR 19 Ca -0.07 -0.30 -0.17 0.00 -0.37 0.00 0.00 57.07 56.16 2ds1 s TYR 19 Cb -0.15 -1.29 -0.05 0.00 -0.40 0.00 0.00 41.96 40.07 2ds1 s TYR 19 CO -0.02 0.40 0.47 0.21 -1.57 0.00 0.00 175.55 175.04 2ds1 s LYS 20 N -2.25 4.23 0.15 -0.62 2.20 0.44 0.75 119.74 124.64 2ds1 s LYS 20 Ca 0.18 0.47 -0.08 0.00 -0.36 0.00 0.00 55.97 56.17 2ds1 s LYS 20 Cb -0.10 -3.37 -0.01 0.00 -1.51 0.00 0.00 37.83 32.84 2ds1 s LYS 20 CO 0.09 0.33 0.25 0.00 -0.36 0.00 0.00 175.35 175.67 2ds1 s ALA 21 N 0.05 0.03 -0.10 3.13 0.00 -0.01 -0.25 121.76 124.61 2ds1 s ALA 21 Ca 0.26 -0.89 0.01 0.00 0.00 0.00 0.00 51.96 51.34 2ds1 s ALA 21 Cb -0.16 0.80 -0.02 0.00 0.00 0.00 0.00 23.12 23.74 2ds1 s ALA 21 CO 0.12 -0.61 -0.13 0.50 0.00 0.00 0.00 175.76 175.64 2ds1 s ARG 22 N -3.96 3.10 -0.33 0.00 3.52 -0.44 -0.24 118.95 120.60 2ds1 s ARG 22 Ca 0.16 -0.68 -0.29 0.00 -0.13 0.00 0.00 55.73 54.79 2ds1 s ARG 22 Cb 0.04 -2.56 0.01 0.00 -1.56 0.00 0.00 34.95 30.88 2ds1 s ARG 22 CO -0.02 0.35 1.14 1.21 -0.81 0.00 0.00 175.30 177.18 2ds1 s ASN 23 N -0.02 6.83 0.54 -2.12 3.84 0.33 -2.19 114.94 122.14 2ds1 s ASN 23 Ca -0.03 1.02 0.29 0.00 0.21 0.00 0.00 52.86 54.34 2ds1 s ASN 23 Cb -0.14 -2.54 1.53 0.00 -0.55 0.00 0.00 41.25 39.54 2ds1 s ASN 23 CO 0.04 -0.98 2.10 0.11 -2.79 0.00 0.00 177.10 175.58 2ds1 h LYS 24 N 8.54 0.00 0.01 0.43 1.57 -1.58 0.21 116.57 125.75 2ds1 h LYS 24 Ca -0.22 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.56 2ds1 h LYS 24 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 2ds1 h LYS 24 CO 1.05 0.10 -0.00 -0.07 -0.57 0.00 0.00 179.45 179.95 2ds1 h LEU 25 N 0.00 -0.01 -0.10 2.94 3.38 -1.91 -3.38 115.31 116.24 2ds1 h LEU 25 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ds1 h LEU 25 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2ds1 h LEU 25 CO 0.01 0.00 -0.08 0.35 0.09 0.00 0.00 178.44 178.82 2ds1 n THR 26 N -2.07 0.00 -0.91 0.22 -2.24 -1.24 -4.92 114.28 103.12 2ds1 n THR 26 Ca -0.00 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2ds1 n THR 26 Cb 0.00 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 67.95 2ds1 n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ds1 n GLY 27 N 1.32 0.27 3.78 3.38 0.00 0.73 -4.97 105.19 109.70 2ds1 n GLY 27 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 2ds1 n GLY 27 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ds1 s GLU 28 N -1.00 4.56 0.18 1.61 2.56 -1.24 -4.71 118.70 120.65 2ds1 s GLU 28 Ca 0.00 1.21 -0.20 0.00 0.00 0.00 0.00 54.97 55.98 2ds1 s GLU 28 Cb 0.00 -3.05 -0.08 0.00 2.00 0.00 0.00 34.13 33.00 2ds1 s GLU 28 CO 0.00 0.44 0.68 0.14 -0.56 0.00 0.00 175.26 175.96 2ds1 s VAL 29 N -1.37 4.61 0.26 3.70 -7.23 -1.26 -0.52 120.40 118.60 2ds1 s VAL 29 Ca 0.42 1.26 -0.09 0.00 -1.81 0.00 0.00 61.98 61.77 2ds1 s VAL 29 Cb -0.21 -3.88 -0.01 0.00 0.56 0.00 0.00 36.38 32.84 2ds1 s VAL 29 CO 0.26 0.32 0.41 0.54 -0.31 0.00 0.00 175.10 176.31 2ds1 s VAL 30 N -1.39 0.00 -0.31 1.32 0.11 0.66 -4.33 120.40 116.46 2ds1 s VAL 30 Ca 0.39 -1.56 -0.08 0.00 -2.93 0.00 0.00 61.98 57.80 2ds1 s VAL 30 Cb -0.18 -2.35 0.00 0.00 -1.53 0.00 0.00 36.38 32.33 2ds1 s VAL 30 CO 0.21 0.00 0.12 0.00 -3.33 0.00 0.00 175.10 172.10 2ds1 s ALA 31 N -3.85 3.16 -0.25 1.54 0.00 0.41 -0.83 121.76 121.93 2ds1 s ALA 31 Ca 0.27 -1.45 -0.10 0.00 0.00 0.00 0.00 51.96 50.69 2ds1 s ALA 31 Cb 0.01 -2.27 -0.05 0.00 0.00 0.00 0.00 23.12 20.82 2ds1 s ALA 31 CO 0.12 -0.95 0.15 -1.17 0.00 0.00 0.00 175.76 173.90 2ds1 s LEU 32 N 1.54 3.92 -0.15 0.00 1.98 0.23 -0.63 118.68 125.58 2ds1 s LEU 32 Ca 0.03 -0.00 -0.01 0.00 -2.89 0.00 0.00 54.13 51.26 2ds1 s LEU 32 Cb -0.17 -2.06 -0.01 0.00 0.66 0.00 0.00 46.19 44.60 2ds1 s LEU 32 CO 0.04 0.01 -0.10 -0.75 -1.89 0.00 0.00 176.35 173.66 2ds1 s LYS 33 N 1.38 3.41 -0.13 1.98 2.20 0.02 -0.02 119.74 128.58 2ds1 s LYS 33 Ca 0.07 -0.65 -0.14 0.00 -0.36 0.00 0.00 55.97 54.88 2ds1 s LYS 33 Cb -0.15 -2.74 -0.05 0.00 -1.51 0.00 0.00 37.83 33.38 2ds1 s LYS 33 CO 0.07 0.13 0.32 0.15 -0.36 0.00 0.00 175.35 175.65 2ds1 s LYS 34 N 0.60 4.13 0.00 4.03 1.02 -0.58 -0.63 119.74 128.31 2ds1 s LYS 34 Ca -0.06 0.16 0.00 0.00 0.02 0.00 0.00 55.97 56.09 2ds1 s LYS 34 Cb -0.15 -3.37 0.00 0.00 -0.52 0.00 0.00 37.83 33.79 2ds1 s LYS 34 CO 0.03 0.36 0.00 -0.89 -0.92 0.00 0.00 175.35 173.93 2ds1 n ILE 35 N 3.14 0.00 -3.15 2.17 2.08 -0.45 -3.10 119.36 120.06 2ds1 n ILE 35 Ca -0.12 0.00 0.04 0.00 0.56 0.00 0.00 62.75 63.23 2ds1 n ILE 35 Cb 0.52 0.00 -0.00 0.00 -0.75 0.00 0.00 39.64 39.41 2ds1 n ILE 35 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 2ds1 s VAL 44 N 1.29 -0.85 0.43 1.39 1.01 -1.26 -4.29 120.40 118.11 2ds1 s VAL 44 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 61.98 61.73 2ds1 s VAL 44 Cb 0.00 -0.87 -0.09 0.00 0.00 0.00 0.00 36.38 35.42 2ds1 s VAL 44 CO 0.00 0.00 1.31 -0.81 0.00 0.00 0.00 175.10 175.60 2ds1 n PRO 45 N 5.37 2.01 -0.15 2.72 -0.04 -1.26 -4.90 135.00 138.74 2ds1 n PRO 45 Ca 0.05 0.71 0.09 0.00 -0.04 0.00 0.00 63.50 64.31 2ds1 n PRO 45 Cb 0.54 -2.44 0.41 0.00 -0.04 0.00 0.00 33.50 31.97 2ds1 n PRO 45 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2ds1 h SER 46 N 2.13 0.56 -0.45 3.54 4.64 -2.04 -2.64 113.55 119.28 2ds1 h SER 46 Ca -0.49 0.01 0.01 0.00 -0.47 0.00 0.00 61.79 60.85 2ds1 h SER 46 Cb 1.29 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 63.25 2ds1 h SER 46 CO 0.60 0.35 0.30 0.71 -0.87 0.00 0.00 176.83 177.91 2ds1 h THR 47 N 0.63 1.11 -0.56 2.95 1.35 -1.99 -1.51 112.91 114.88 2ds1 h THR 47 Ca 0.31 -0.21 -0.05 0.00 -0.55 0.00 0.00 66.41 65.91 2ds1 h THR 47 Cb 0.40 0.45 -0.03 0.00 -1.73 0.00 0.00 68.15 67.24 2ds1 h THR 47 CO -0.10 0.11 0.15 0.00 -0.25 0.00 0.00 175.52 175.42 2ds1 h ALA 48 N 1.17 1.21 -0.26 6.62 0.00 -1.75 -2.01 119.26 124.23 2ds1 h ALA 48 Ca 0.17 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2ds1 h ALA 48 Cb -0.06 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2ds1 h ALA 48 CO -0.04 0.55 0.13 0.82 0.00 0.00 0.00 179.25 180.71 2ds1 h ILE 49 N 0.83 1.14 -0.74 0.00 1.08 -1.27 -0.48 117.51 118.06 2ds1 h ILE 49 Ca 0.18 -0.41 -0.04 0.00 -0.39 0.00 0.00 64.86 64.21 2ds1 h ILE 49 Cb 0.28 0.93 -0.03 0.00 -3.07 0.00 0.00 36.82 34.93 2ds1 h ILE 49 CO -0.00 0.14 0.30 0.03 -0.69 0.00 0.00 178.15 177.93 2ds1 h ARG 50 N 0.30 1.11 0.12 2.37 -0.00 -1.12 -2.31 114.38 114.85 2ds1 h ARG 50 Ca 0.09 -0.20 -0.01 0.00 -0.50 0.00 0.00 59.98 59.36 2ds1 h ARG 50 Cb 0.11 -0.18 0.00 0.00 0.00 0.00 0.00 29.97 29.90 2ds1 h ARG 50 CO -0.01 0.91 -0.06 0.93 0.00 0.00 0.00 179.97 181.74 2ds1 h GLU 51 N 1.07 -0.15 -0.89 0.04 4.39 -1.12 -2.55 114.58 115.36 2ds1 h GLU 51 Ca 0.25 0.01 0.04 0.00 0.34 0.00 0.00 59.36 60.00 2ds1 h GLU 51 Cb 0.21 0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.84 2ds1 h GLU 51 CO -0.02 -0.03 0.58 0.82 -1.16 0.00 0.00 179.01 179.19 2ds1 h ILE 52 N -0.24 1.14 -0.42 3.13 1.08 -1.04 -1.91 117.51 119.25 2ds1 h ILE 52 Ca -0.02 -0.38 -0.01 0.00 -0.39 0.00 0.00 64.86 64.06 2ds1 h ILE 52 Cb 0.19 -0.07 -0.02 0.00 -3.07 0.00 0.00 36.82 33.85 2ds1 h ILE 52 CO 0.03 0.20 0.21 0.28 -0.69 0.00 0.00 178.15 178.18 2ds1 h SER 53 N 1.11 0.52 -0.20 1.72 0.02 -1.29 -0.90 113.55 114.52 2ds1 h SER 53 Ca 0.36 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.25 2ds1 h SER 53 Cb 0.02 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 2ds1 h SER 53 CO -0.12 0.44 0.07 -0.07 -1.14 0.00 0.00 176.83 176.01 2ds1 h LEU 54 N 0.59 0.34 -1.74 5.07 4.07 -0.92 -2.33 115.31 120.39 2ds1 h LEU 54 Ca 0.15 -0.04 -0.02 0.00 0.08 0.00 0.00 57.88 58.05 2ds1 h LEU 54 Cb 0.05 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 41.70 2ds1 h LEU 54 CO -0.02 0.35 -0.12 -0.07 -1.08 0.00 0.00 178.44 177.50 2ds1 h LEU 55 N 0.38 0.00 -0.77 1.67 3.38 -1.03 -2.77 115.31 116.17 2ds1 h LEU 55 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2ds1 h LEU 55 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2ds1 h LEU 55 CO -0.00 0.12 0.00 0.29 0.09 0.00 0.00 178.44 178.93 2ds1 n LYS 56 N -3.44 0.17 -0.00 1.13 5.02 -0.88 -2.99 118.16 117.17 2ds1 n LYS 56 Ca -0.01 0.45 0.08 0.00 -2.02 0.00 0.00 58.31 56.80 2ds1 n LYS 56 Cb 0.28 -1.86 -0.11 0.00 -0.02 0.00 0.00 35.03 33.33 2ds1 n LYS 56 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2ds1 n GLU 57 N -2.19 1.21 -3.00 1.97 4.71 -1.04 -4.76 120.64 117.54 2ds1 n GLU 57 Ca 0.02 -0.07 -0.44 0.00 -0.01 0.00 0.00 57.16 56.65 2ds1 n GLU 57 Cb 0.19 -1.30 -0.01 0.00 -1.01 0.00 0.00 31.44 29.31 2ds1 n GLU 57 CO 0.00 0.00 0.00 -0.48 0.09 0.00 0.00 177.13 176.74 2ds1 s LEU 58 N -3.40 5.27 -0.13 -4.62 -0.00 -1.16 -4.97 118.68 109.68 2ds1 s LEU 58 Ca 0.00 -2.67 -0.06 0.00 -0.00 0.00 0.00 54.13 51.40 2ds1 s LEU 58 Cb 0.11 -2.37 -0.04 0.00 -0.00 0.00 0.00 46.19 43.89 2ds1 s LEU 58 CO 0.65 -0.82 0.10 0.20 -0.00 0.00 0.00 176.35 176.48 2ds1 s ASN 59 N 2.96 6.02 -0.10 1.48 0.02 -1.26 -4.98 114.94 119.07 2ds1 s ASN 59 Ca 0.36 0.33 -0.27 0.00 -1.02 0.00 0.00 52.86 52.26 2ds1 s ASN 59 Cb -0.05 -1.92 0.06 0.00 0.02 0.00 0.00 41.25 39.37 2ds1 s ASN 59 CO -0.05 0.35 0.64 -2.28 0.02 0.00 0.00 177.10 175.79 2ds1 s HIS 60 N -0.70 -0.64 0.49 2.20 2.46 -1.26 -5.05 115.29 112.80 2ds1 s HIS 60 Ca 0.13 1.24 0.21 0.00 0.47 0.00 0.00 55.06 57.10 2ds1 s HIS 60 Cb -0.12 0.34 1.26 0.00 -0.13 0.00 0.00 32.58 33.93 2ds1 s HIS 60 CO 0.03 -0.52 2.00 -1.35 -2.47 0.00 0.00 174.74 172.42 2ds1 h PRO 61 N 3.67 0.14 -0.71 2.88 0.11 -1.99 -1.60 132.00 134.50 2ds1 h PRO 61 Ca -0.28 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.70 2ds1 h PRO 61 Cb 1.15 -0.03 -0.08 0.00 0.11 0.00 0.00 31.00 32.15 2ds1 h PRO 61 CO 0.30 0.09 0.16 0.09 -0.21 0.00 0.00 178.00 178.44 2ds1 n ASN 62 N -4.43 4.99 -4.02 -2.05 4.13 -1.26 -4.81 115.26 107.82 2ds1 n ASN 62 Ca 0.09 -3.04 -0.26 0.00 1.68 0.00 0.00 54.58 53.05 2ds1 n ASN 62 Cb 0.50 -0.71 -0.17 0.00 -1.54 0.00 0.00 39.78 37.86 2ds1 n ASN 62 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2ds1 s ILE 63 N -2.77 1.21 0.10 2.41 1.01 -0.60 -0.69 121.20 121.88 2ds1 s ILE 63 Ca 0.52 -0.49 -0.31 0.00 0.00 0.00 0.00 60.65 60.36 2ds1 s ILE 63 Cb 0.41 -1.13 -0.10 0.00 0.01 0.00 0.00 42.46 41.65 2ds1 s ILE 63 CO 0.14 0.38 1.87 0.52 0.00 0.00 0.00 174.94 177.84 2ds1 n VAL 64 N 4.07 0.45 -2.18 2.92 0.31 0.20 -4.57 118.33 119.52 2ds1 n VAL 64 Ca -0.20 -0.08 -0.42 0.00 -0.01 0.00 0.00 64.34 63.63 2ds1 n VAL 64 Cb 0.51 -2.16 -0.03 0.00 -0.91 0.00 0.00 33.84 31.26 2ds1 n VAL 64 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2ds1 s LYS 65 N 3.08 4.32 -0.51 5.55 2.20 -1.26 -4.90 119.74 128.22 2ds1 s LYS 65 Ca 0.83 2.05 -0.22 0.00 -0.36 0.00 0.00 55.97 58.28 2ds1 s LYS 65 Cb -0.48 -3.30 0.04 0.00 -1.51 0.00 0.00 37.83 32.59 2ds1 s LYS 65 CO 0.38 -0.45 0.78 -1.17 -0.36 0.00 0.00 175.35 174.53 2ds1 s LEU 66 N 1.29 4.46 -0.07 5.43 2.96 -1.26 -1.11 118.68 130.39 2ds1 s LEU 66 Ca 0.64 -0.51 -0.23 0.00 -0.22 0.00 0.00 54.13 53.82 2ds1 s LEU 66 Cb -0.36 -2.71 -0.18 0.00 0.50 0.00 0.00 46.19 43.44 2ds1 s LEU 66 CO 0.30 -1.02 0.90 -0.07 -1.32 0.00 0.00 176.35 175.13 2ds1 h LEU 67 N 10.29 -0.09 -7.76 -0.68 4.07 -0.92 -3.45 115.31 116.76 2ds1 h LEU 67 Ca -0.26 -0.51 -0.08 0.00 0.08 0.00 0.00 57.88 57.11 2ds1 h LEU 67 Cb 1.08 0.02 -0.13 0.00 1.08 0.00 0.00 40.66 42.72 2ds1 h LEU 67 CO 1.01 0.54 -0.28 -1.81 -1.08 0.00 0.00 178.44 176.82 2ds1 s ASP 68 N -5.69 0.01 -0.19 -0.43 1.01 -0.96 -5.02 116.67 105.41 2ds1 s ASP 68 Ca -0.14 -0.61 -0.00 0.00 0.71 0.00 0.00 52.55 52.51 2ds1 s ASP 68 Cb -0.00 0.39 0.05 0.00 1.01 0.00 0.00 42.92 44.37 2ds1 s ASP 68 CO 0.54 -0.80 -0.06 -0.69 0.21 0.00 0.00 175.17 174.38 2ds1 s VAL 69 N -3.87 1.30 -0.45 -1.27 1.01 -1.26 -1.09 120.40 114.76 2ds1 s VAL 69 Ca 0.07 -0.85 -0.10 0.00 0.00 0.00 0.00 61.98 61.09 2ds1 s VAL 69 Cb 0.04 -1.49 0.10 0.00 0.00 0.00 0.00 36.38 35.03 2ds1 s VAL 69 CO -0.09 0.06 0.32 -0.63 0.00 0.00 0.00 175.10 174.76 2ds1 s ILE 70 N 1.54 4.33 -0.71 2.22 1.01 -0.26 -5.00 121.20 124.34 2ds1 s ILE 70 Ca -0.01 -1.58 -0.12 0.00 0.00 0.00 0.00 60.65 58.93 2ds1 s ILE 70 Cb -0.16 -3.75 0.18 0.00 0.01 0.00 0.00 42.46 38.73 2ds1 s ILE 70 CO -0.07 -0.66 0.63 -2.28 0.00 0.00 0.00 174.94 172.55 2ds1 s HIS 71 N 1.42 3.58 0.01 3.97 2.46 -1.26 -1.85 115.29 123.61 2ds1 s HIS 71 Ca 0.04 -1.93 0.03 0.00 0.47 0.00 0.00 55.06 53.67 2ds1 s HIS 71 Cb -0.25 -3.70 -0.01 0.00 -0.13 0.00 0.00 32.58 28.48 2ds1 s HIS 71 CO 0.01 -0.98 -0.09 -0.08 -2.47 0.00 0.00 174.74 171.13 2ds1 s THR 72 N 0.55 0.72 -1.37 0.89 -1.32 -1.08 -4.86 115.64 109.17 2ds1 s THR 72 Ca 0.13 -0.60 -0.07 0.00 -1.21 0.00 0.00 61.69 59.94 2ds1 s THR 72 Cb -0.17 -0.65 0.00 0.00 -1.51 0.00 0.00 72.50 70.17 2ds1 s THR 72 CO -0.05 0.05 0.43 -0.62 -2.21 0.00 0.00 174.62 172.23 2ds1 n GLU 73 N 2.45 -2.23 -4.04 7.08 4.71 -1.26 -1.61 120.64 125.74 2ds1 n GLU 73 Ca -0.16 0.32 -0.28 0.00 -0.01 0.00 0.00 57.16 57.03 2ds1 n GLU 73 Cb 0.56 -4.09 -0.03 0.00 -1.01 0.00 0.00 31.44 26.88 2ds1 n GLU 73 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2ds1 n ASN 74 N -2.83 -0.97 -4.04 1.62 5.03 -1.26 -4.97 115.26 107.84 2ds1 n ASN 74 Ca -0.26 -1.02 -0.08 0.00 0.87 0.00 0.00 54.58 54.09 2ds1 n ASN 74 Cb 0.66 -2.91 -0.10 0.00 -1.02 0.00 0.00 39.78 36.41 2ds1 n ASN 74 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2ds1 s LYS 75 N -6.70 0.52 -0.13 3.52 -0.14 -0.64 -4.77 119.74 111.41 2ds1 s LYS 75 Ca 0.18 -0.98 0.01 0.00 -1.36 0.00 0.00 55.97 53.82 2ds1 s LYS 75 Cb -0.10 0.18 0.02 0.00 -1.68 0.00 0.00 37.83 36.26 2ds1 s LYS 75 CO 0.90 -0.10 -0.13 -0.51 -0.76 0.00 0.00 175.35 174.75 2ds1 s LEU 76 N -2.38 1.62 -0.09 3.17 1.43 -1.26 -2.64 118.68 118.52 2ds1 s LEU 76 Ca -0.02 -0.44 0.03 0.00 -1.03 0.00 0.00 54.13 52.67 2ds1 s LEU 76 Cb 0.01 -1.10 0.01 0.00 0.03 0.00 0.00 46.19 45.14 2ds1 s LEU 76 CO -0.07 -0.05 -0.18 -0.31 0.23 0.00 0.00 176.35 175.98 2ds1 s TYR 77 N 1.39 2.09 -0.20 0.29 2.02 -0.77 -1.34 117.35 120.83 2ds1 s TYR 77 Ca 0.02 -0.89 -0.04 0.00 -0.37 0.00 0.00 57.07 55.79 2ds1 s TYR 77 Cb -0.13 -1.45 -0.02 0.00 -0.40 0.00 0.00 41.96 39.96 2ds1 s TYR 77 CO -0.08 -0.41 -0.03 -0.51 -1.57 0.00 0.00 175.55 172.95 2ds1 s LEU 78 N 0.64 3.08 -0.33 -1.29 1.43 0.19 -1.10 118.68 121.30 2ds1 s LEU 78 Ca -0.14 -0.28 -0.14 0.00 -1.03 0.00 0.00 54.13 52.55 2ds1 s LEU 78 Cb -0.16 -1.77 -0.02 0.00 0.03 0.00 0.00 46.19 44.26 2ds1 s LEU 78 CO 0.04 0.05 0.28 -0.69 0.23 0.00 0.00 176.35 176.26 2ds1 s VAL 79 N 1.08 5.24 0.18 -1.59 1.01 -0.25 -0.80 120.40 125.28 2ds1 s VAL 79 Ca 0.02 -0.04 0.10 0.00 0.00 0.00 0.00 61.98 62.06 2ds1 s VAL 79 Cb -0.15 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 2ds1 s VAL 79 CO 0.01 0.00 -0.18 -0.36 0.00 0.00 0.00 175.10 174.56 2ds1 s PHE 80 N 1.85 2.44 0.66 5.22 0.08 0.20 -0.21 117.98 128.22 2ds1 s PHE 80 Ca 0.09 -0.30 -0.18 0.00 0.12 0.00 0.00 56.93 56.66 2ds1 s PHE 80 Cb -0.17 -1.22 -0.00 0.00 -0.57 0.00 0.00 43.02 41.06 2ds1 s PHE 80 CO 0.11 0.48 1.28 -1.83 -0.10 0.00 0.00 175.22 175.16 2ds1 s GLU 81 N -2.63 2.49 -0.08 0.44 -1.05 -0.26 -0.45 118.70 117.16 2ds1 s GLU 81 Ca 0.22 2.01 -0.12 0.00 -0.15 0.00 0.00 54.97 56.92 2ds1 s GLU 81 Cb -0.09 -1.85 -0.05 0.00 -0.44 0.00 0.00 34.13 31.71 2ds1 s GLU 81 CO 0.11 -1.63 0.30 -1.58 0.95 0.00 0.00 175.26 173.42 2ds1 s HIS 82 N -1.50 3.62 -0.07 4.83 5.65 -1.26 -4.33 115.29 122.23 2ds1 s HIS 82 Ca 0.81 0.76 0.02 0.00 0.25 0.00 0.00 55.06 56.91 2ds1 s HIS 82 Cb -0.36 -2.20 0.01 0.00 -1.18 0.00 0.00 32.58 28.85 2ds1 s HIS 82 CO 0.40 0.57 -0.14 0.08 -0.65 0.00 0.00 174.74 175.00 2ds1 s VAL 83 N -0.67 1.26 0.16 0.89 1.01 -1.26 -5.00 120.40 116.80 2ds1 s VAL 83 Ca 0.19 -0.55 -0.23 0.00 0.00 0.00 0.00 61.98 61.39 2ds1 s VAL 83 Cb -0.14 -1.14 0.06 0.00 0.00 0.00 0.00 36.38 35.15 2ds1 s VAL 83 CO 0.08 0.38 1.60 0.45 0.00 0.00 0.00 175.10 177.61 2ds1 h HIS 84 N 6.94 -0.92 -4.31 5.22 3.86 -1.99 -3.46 115.15 120.50 2ds1 h HIS 84 Ca -0.29 0.06 -0.17 0.00 -1.16 0.00 0.00 60.37 58.81 2ds1 h HIS 84 Cb 1.19 0.46 -0.14 0.00 1.06 0.00 0.00 27.41 29.98 2ds1 h HIS 84 CO 0.48 -0.39 -0.58 1.14 0.86 0.00 0.00 177.93 179.45 2ds1 s GLN 85 N -5.99 0.97 0.45 2.45 -2.07 -1.22 -5.05 119.66 109.21 2ds1 s GLN 85 Ca -0.15 -1.38 0.03 0.00 -1.82 0.00 0.00 55.36 52.04 2ds1 s GLN 85 Cb 0.13 0.27 0.01 0.00 -1.09 0.00 0.00 33.01 32.33 2ds1 s GLN 85 CO 0.68 -0.29 0.64 0.16 -1.32 0.00 0.00 175.29 175.15 2ds1 s ASP 86 N -3.03 5.70 0.23 12.60 1.47 -1.26 -0.95 116.67 131.43 2ds1 s ASP 86 Ca 0.22 0.01 -0.00 0.00 1.18 0.00 0.00 52.55 53.96 2ds1 s ASP 86 Cb 0.07 -1.18 0.24 0.00 -0.34 0.00 0.00 42.92 41.71 2ds1 s ASP 86 CO 0.01 -0.76 1.60 0.25 0.68 0.00 0.00 175.17 176.96 2ds1 h LEU 87 N 0.46 0.54 0.11 2.11 5.85 -0.59 -3.01 115.31 120.77 2ds1 h LEU 87 Ca -0.44 -0.24 0.02 0.00 0.84 0.00 0.00 57.88 58.06 2ds1 h LEU 87 Cb 1.27 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 42.11 2ds1 h LEU 87 CO 0.53 0.89 -0.27 0.50 -0.34 0.00 0.00 178.44 179.76 2ds1 h LYS 88 N 0.42 -0.46 -0.51 1.25 1.63 -1.80 0.24 116.57 117.34 2ds1 h LYS 88 Ca 0.03 0.03 0.09 0.00 -0.85 0.00 0.00 60.65 59.96 2ds1 h LYS 88 Cb 0.90 0.10 -0.07 0.00 -0.60 0.00 0.00 32.23 32.56 2ds1 h LYS 88 CO 0.08 -0.30 0.09 1.15 -3.45 0.00 0.00 179.45 177.02 2ds1 h THR 89 N -0.47 0.69 -0.79 1.00 2.02 -1.90 -0.68 112.91 112.78 2ds1 h THR 89 Ca 0.03 -0.08 -0.03 0.00 0.77 0.00 0.00 66.41 67.10 2ds1 h THR 89 Cb 0.51 0.45 -0.04 0.00 -1.74 0.00 0.00 68.15 67.33 2ds1 h THR 89 CO -0.16 0.04 0.37 0.15 0.37 0.00 0.00 175.52 176.29 2ds1 h PHE 90 N 0.23 1.14 -0.20 3.16 3.57 -1.28 -1.66 116.94 121.90 2ds1 h PHE 90 Ca 0.26 -0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 2ds1 h PHE 90 Cb 0.36 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 2ds1 h PHE 90 CO -0.24 0.83 0.03 0.52 -2.23 0.00 0.00 178.31 177.23 2ds1 h MET 91 N 1.13 0.33 -0.63 1.11 2.86 0.40 -1.29 114.93 118.84 2ds1 h MET 91 Ca 0.27 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.82 2ds1 h MET 91 Cb 0.13 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.72 2ds1 h MET 91 CO -0.03 0.48 0.37 -0.44 1.06 0.00 0.00 176.91 178.35 2ds1 h ASP 92 N 0.13 0.76 0.21 1.22 3.32 -1.04 -2.10 116.42 118.91 2ds1 h ASP 92 Ca 0.06 -0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 2ds1 h ASP 92 Cb 0.31 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2ds1 h ASP 92 CO 0.00 0.61 -0.21 0.00 -1.72 0.00 0.00 179.24 177.92 2ds1 h ALA 93 N 1.19 1.66 -0.89 3.45 0.00 -1.20 -2.51 119.26 120.95 2ds1 h ALA 93 Ca 0.22 -0.19 -0.43 0.00 0.00 0.00 0.00 54.91 54.51 2ds1 h ALA 93 Cb -0.01 -0.03 -0.26 0.00 0.00 0.00 0.00 17.79 17.49 2ds1 h ALA 93 CO -0.04 0.26 0.55 0.43 0.00 0.00 0.00 179.25 180.45 2ds1 n SER 94 N -4.29 3.88 0.07 0.00 7.64 -0.50 -4.54 113.62 115.88 2ds1 n SER 94 Ca -0.02 -3.43 -0.04 0.00 1.01 0.00 0.00 58.87 56.38 2ds1 n SER 94 Cb 0.27 -0.80 0.17 0.00 -1.01 0.00 0.00 64.21 62.83 2ds1 n SER 94 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ds1 h ALA 95 N 1.36 0.97 -0.16 -0.43 0.00 -1.14 0.38 119.26 120.25 2ds1 h ALA 95 Ca 0.53 -0.45 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2ds1 h ALA 95 Cb 2.66 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 20.36 2ds1 h ALA 95 CO 0.97 0.64 -0.09 -0.07 0.00 0.00 0.00 179.25 180.70 2ds1 h LEU 96 N 0.26 0.35 0.00 0.00 -0.00 -1.84 -3.37 115.31 110.71 2ds1 h LEU 96 Ca 0.02 -0.43 0.00 0.00 -0.00 0.00 0.00 57.88 57.47 2ds1 h LEU 96 Cb 0.92 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 41.48 2ds1 h LEU 96 CO 0.08 0.71 -1.13 1.07 -0.00 0.00 0.00 178.44 179.16 2ds1 n THR 97 N -4.61 0.00 -0.17 0.22 5.66 -1.24 -5.13 114.28 109.01 2ds1 n THR 97 Ca -0.06 -0.24 0.00 0.00 -3.05 0.00 0.00 64.05 60.71 2ds1 n THR 97 Cb 0.32 0.50 -0.00 0.00 -1.55 0.00 0.00 70.33 69.60 2ds1 n THR 97 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2ds1 n GLY 98 N 1.72 -2.90 3.69 1.09 0.00 0.13 -4.83 105.19 104.09 2ds1 n GLY 98 Ca -0.01 -1.27 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 2ds1 n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ds1 s ILE 99 N -4.02 3.38 0.39 -0.61 1.01 -1.26 -4.93 121.20 115.15 2ds1 s ILE 99 Ca 0.00 0.81 -0.26 0.00 0.00 0.00 0.00 60.65 61.20 2ds1 s ILE 99 Cb 0.00 -3.52 -0.11 0.00 0.01 0.00 0.00 42.46 38.84 2ds1 s ILE 99 CO 0.00 0.00 1.21 -0.81 0.00 0.00 0.00 174.94 175.34 2ds1 n PRO 100 N 5.39 1.83 -0.25 2.79 -0.04 -1.26 -4.72 135.00 138.73 2ds1 n PRO 100 Ca 0.14 0.65 0.06 0.00 -0.04 0.00 0.00 63.50 64.31 2ds1 n PRO 100 Cb 0.42 -2.26 0.19 0.00 -0.04 0.00 0.00 33.50 31.81 2ds1 n PRO 100 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2ds1 h LEU 101 N 2.09 -0.00 -1.22 1.53 5.85 -1.98 -1.55 115.31 120.02 2ds1 h LEU 101 Ca -0.46 0.15 0.16 0.00 0.84 0.00 0.00 57.88 58.57 2ds1 h LEU 101 Cb 1.30 0.21 -0.08 0.00 0.37 0.00 0.00 40.66 42.46 2ds1 h LEU 101 CO 0.60 -0.05 0.60 -0.65 -0.34 0.00 0.00 178.44 178.59 2ds1 h PRO 102 N 0.26 0.69 -0.03 5.25 0.11 -2.00 0.42 132.00 136.70 2ds1 h PRO 102 Ca 0.42 -0.04 -0.24 0.00 0.11 0.00 0.00 66.00 66.25 2ds1 h PRO 102 Cb 0.73 -0.16 0.01 0.00 0.11 0.00 0.00 31.00 31.70 2ds1 h PRO 102 CO -0.53 0.46 -0.96 1.25 -0.21 0.00 0.00 178.00 178.01 2ds1 h LEU 103 N 0.71 0.78 -0.25 2.35 5.85 -1.66 -2.13 115.31 120.97 2ds1 h LEU 103 Ca 0.49 -0.60 -0.00 0.00 0.84 0.00 0.00 57.88 58.60 2ds1 h LEU 103 Cb 0.79 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 2ds1 h LEU 103 CO -0.24 1.40 0.15 0.40 -0.34 0.00 0.00 178.44 179.80 2ds1 h ILE 104 N 0.36 1.09 -0.85 4.05 2.04 -0.69 0.13 117.51 123.65 2ds1 h ILE 104 Ca -0.10 -0.22 -0.03 0.00 1.00 0.00 0.00 64.86 65.52 2ds1 h ILE 104 Cb 1.60 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 38.42 2ds1 h ILE 104 CO 0.18 0.09 0.43 0.50 0.00 0.00 0.00 178.15 179.35 2ds1 h LYS 105 N 0.31 1.20 -0.34 2.37 3.64 -0.97 -1.33 116.57 121.45 2ds1 h LYS 105 Ca 0.09 -0.16 -0.03 0.00 -1.27 0.00 0.00 60.65 59.28 2ds1 h LYS 105 Cb 0.01 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.60 2ds1 h LYS 105 CO -0.02 0.91 0.10 1.03 -2.27 0.00 0.00 179.45 179.20 2ds1 h SER 106 N 1.20 0.50 -0.48 4.20 0.87 -1.00 -1.13 113.55 117.70 2ds1 h SER 106 Ca 0.29 -0.21 -0.02 0.00 -1.23 0.00 0.00 61.79 60.62 2ds1 h SER 106 Cb 0.08 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 61.89 2ds1 h SER 106 CO -0.04 0.58 0.23 1.88 -0.53 0.00 0.00 176.83 178.94 2ds1 h TYR 107 N 0.39 0.70 -0.50 2.24 0.05 -0.72 -1.67 116.97 117.47 2ds1 h TYR 107 Ca 0.11 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.85 2ds1 h TYR 107 Cb 0.26 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.76 2ds1 h TYR 107 CO 0.01 0.57 0.31 1.25 -1.05 0.00 0.00 178.16 179.25 2ds1 h LEU 108 N 0.64 0.58 -0.37 3.88 5.85 -1.13 -0.58 115.31 124.17 2ds1 h LEU 108 Ca 0.17 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.87 2ds1 h LEU 108 Cb 0.13 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 2ds1 h LEU 108 CO -0.02 0.44 0.20 0.15 -0.34 0.00 0.00 178.44 178.88 2ds1 h PHE 109 N 0.67 0.38 -0.58 1.25 3.57 -1.04 -0.69 116.94 120.49 2ds1 h PHE 109 Ca 0.18 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.60 2ds1 h PHE 109 Cb -0.04 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.56 2ds1 h PHE 109 CO -0.03 0.21 0.02 1.96 -2.23 0.00 0.00 178.31 178.24 2ds1 h GLN 110 N 0.42 1.02 -0.59 1.11 4.20 -1.07 -2.18 115.11 118.02 2ds1 h GLN 110 Ca 0.15 -0.32 -0.04 0.00 0.06 0.00 0.00 58.65 58.50 2ds1 h GLN 110 Cb 0.03 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.69 2ds1 h GLN 110 CO -0.08 1.00 0.21 -0.07 -0.67 0.00 0.00 178.83 179.22 2ds1 h LEU 111 N 0.91 0.83 -1.45 1.46 4.07 -0.86 -1.17 115.31 119.10 2ds1 h LEU 111 Ca 0.17 -0.19 -0.02 0.00 0.08 0.00 0.00 57.88 57.92 2ds1 h LEU 111 Cb 0.53 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 42.03 2ds1 h LEU 111 CO 0.03 0.80 0.18 -0.07 -1.08 0.00 0.00 178.44 178.30 2ds1 h LEU 112 N 0.82 0.49 -0.28 1.67 3.38 -0.97 0.43 115.31 120.85 2ds1 h LEU 112 Ca 0.19 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 2ds1 h LEU 112 Cb 0.24 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2ds1 h LEU 112 CO -0.01 0.43 -0.20 1.56 0.09 0.00 0.00 178.44 180.32 2ds1 h GLN 113 N 0.56 0.63 -0.91 1.13 4.20 -0.89 0.27 115.11 120.10 2ds1 h GLN 113 Ca 0.14 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.54 2ds1 h GLN 113 Cb 0.08 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 2ds1 h GLN 113 CO -0.02 0.89 0.52 0.78 -0.67 0.00 0.00 178.83 180.34 2ds1 h GLY 114 N 0.37 1.34 0.94 3.46 0.00 -0.50 -1.67 103.07 107.02 2ds1 h GLY 114 Ca 0.06 -0.59 -0.12 0.00 0.00 0.00 0.00 47.33 46.68 2ds1 h GLY 114 CO 0.05 0.57 -0.30 1.41 0.00 0.00 0.00 176.54 178.27 2ds1 h LEU 115 N 1.27 0.70 -0.88 3.11 4.07 -0.84 -2.32 115.31 120.41 2ds1 h LEU 115 Ca 0.32 -0.49 0.07 0.00 0.08 0.00 0.00 57.88 57.86 2ds1 h LEU 115 Cb -0.01 -0.20 -0.07 0.00 1.08 0.00 0.00 40.66 41.47 2ds1 h LEU 115 CO -0.06 1.05 0.54 0.00 -1.08 0.00 0.00 178.44 178.90 2ds1 h ALA 116 N 0.67 1.22 0.31 1.53 0.00 -0.64 0.24 119.26 122.59 2ds1 h ALA 116 Ca 0.03 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2ds1 h ALA 116 Cb 0.88 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2ds1 h ALA 116 CO 0.07 0.27 -0.15 0.35 0.00 0.00 0.00 179.25 179.79 2ds1 h PHE 117 N 0.97 -0.39 -0.59 0.00 3.57 -1.24 -1.56 116.94 117.70 2ds1 h PHE 117 Ca 0.39 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.91 2ds1 h PHE 117 Cb 0.22 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.05 2ds1 h PHE 117 CO -0.03 -0.13 0.37 0.00 -2.23 0.00 0.00 178.31 176.28 2ds1 h HIS 119 N 0.73 0.00 0.00 0.00 3.86 -0.54 -0.46 115.15 118.74 2ds1 h HIS 119 Ca 0.23 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.39 2ds1 h HIS 119 Cb 0.00 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 2ds1 h HIS 119 CO -0.05 0.29 -0.27 0.66 0.86 0.00 0.00 177.93 179.42 2ds1 h SER 120 N 0.00 0.00 -0.66 2.45 4.64 -0.74 -2.02 113.55 117.22 2ds1 h SER 120 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ds1 h SER 120 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 2ds1 h SER 120 CO 0.04 0.27 0.00 1.41 -0.87 0.00 0.00 176.83 177.67 2ds1 n HIS 121 N -3.74 1.53 -2.24 4.77 8.25 -0.89 -4.95 115.22 117.96 2ds1 n HIS 121 Ca -0.01 -0.61 -0.17 0.00 -0.26 0.00 0.00 57.72 56.67 2ds1 n HIS 121 Cb 0.37 -0.25 -0.01 0.00 1.12 0.00 0.00 29.99 31.22 2ds1 n HIS 121 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2ds1 n ARG 122 N 1.17 -1.34 -4.43 -0.41 1.74 -0.76 -5.01 116.66 107.63 2ds1 n ARG 122 Ca 0.26 0.85 -0.34 0.00 -0.77 0.00 0.00 57.85 57.86 2ds1 n ARG 122 Cb 0.91 -5.28 -0.12 0.00 -1.02 0.00 0.00 32.46 26.95 2ds1 n ARG 122 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2ds1 s VAL 123 N -2.83 3.87 0.19 1.55 1.01 -0.23 -5.00 120.40 118.97 2ds1 s VAL 123 Ca 0.00 -0.37 0.08 0.00 0.00 0.00 0.00 61.98 61.69 2ds1 s VAL 123 Cb 0.00 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 2ds1 s VAL 123 CO 0.00 0.50 0.01 -0.76 0.00 0.00 0.00 175.10 174.86 2ds1 s LEU 124 N 0.25 3.33 -0.16 3.92 1.43 -1.26 -3.51 118.68 122.67 2ds1 s LEU 124 Ca -0.03 -0.42 -0.24 0.00 -1.03 0.00 0.00 54.13 52.41 2ds1 s LEU 124 Cb -0.14 -1.95 -0.21 0.00 0.03 0.00 0.00 46.19 43.91 2ds1 s LEU 124 CO 0.03 0.07 0.50 -0.74 0.23 0.00 0.00 176.35 176.44 2ds1 h HIS 125 N 2.50 0.00 0.00 0.29 -0.00 -1.95 -3.29 115.15 112.70 2ds1 h HIS 125 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.90 2ds1 h HIS 125 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.62 2ds1 h HIS 125 CO 0.63 1.09 0.00 -2.13 -0.00 0.00 0.00 177.93 177.52 2ds1 n ARG 126 N -4.56 0.00 -2.84 5.26 0.00 -1.26 -4.41 116.66 108.86 2ds1 n ARG 126 Ca -0.17 0.00 -0.14 0.00 -0.00 0.00 0.00 57.85 57.54 2ds1 n ARG 126 Cb 0.52 -0.67 0.01 0.00 0.00 0.00 0.00 32.46 32.32 2ds1 n ARG 126 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 2ds1 n ASP 127 N 0.26 1.57 -4.75 6.15 2.03 -1.26 -5.00 116.55 115.55 2ds1 n ASP 127 Ca 0.00 -2.92 -0.41 0.00 0.52 0.00 0.00 54.79 51.99 2ds1 n ASP 127 Cb 0.00 -0.56 -0.03 0.00 -0.72 0.00 0.00 41.12 39.81 2ds1 n ASP 127 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2ds1 s LEU 128 N -2.93 4.46 -0.04 -2.67 1.43 -1.26 -4.94 118.68 112.72 2ds1 s LEU 128 Ca 0.34 2.46 -0.29 0.00 -1.03 0.00 0.00 54.13 55.61 2ds1 s LEU 128 Cb 0.41 -3.63 0.10 0.00 0.03 0.00 0.00 46.19 43.10 2ds1 s LEU 128 CO -0.02 -0.42 0.81 -1.59 0.23 0.00 0.00 176.35 175.36 2ds1 s LYS 129 N -1.06 0.90 0.33 1.70 -2.85 -1.26 -4.75 119.74 112.75 2ds1 s LYS 129 Ca 0.51 -0.02 0.12 0.00 -1.00 0.00 0.00 55.97 55.58 2ds1 s LYS 129 Cb -0.36 0.42 1.01 0.00 -2.06 0.00 0.00 37.83 36.83 2ds1 s LYS 129 CO 0.44 -0.33 1.68 -1.35 0.10 0.00 0.00 175.35 175.90 2ds1 h PRO 130 N 2.47 0.39 -0.78 1.78 0.11 -1.95 -1.49 132.00 132.54 2ds1 h PRO 130 Ca -0.24 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.93 2ds1 h PRO 130 Cb 1.20 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 32.17 2ds1 h PRO 130 CO 0.34 0.26 0.51 1.96 -0.21 0.00 0.00 178.00 180.86 2ds1 h GLN 131 N 0.40 0.73 -0.90 1.05 7.50 -1.96 -2.55 115.11 119.38 2ds1 h GLN 131 Ca 0.70 -0.04 -0.50 0.00 0.50 0.00 0.00 58.65 59.31 2ds1 h GLN 131 Cb 1.51 -0.16 -0.28 0.00 0.05 0.00 0.00 27.48 28.59 2ds1 h GLN 131 CO -0.57 0.48 0.56 0.27 -1.50 0.00 0.00 178.83 178.08 2ds1 n ASN 132 N -4.50 4.24 -4.23 1.46 0.23 -0.56 -4.70 115.26 107.21 2ds1 n ASN 132 Ca 0.12 -3.67 -0.34 0.00 -0.53 0.00 0.00 54.58 50.16 2ds1 n ASN 132 Cb 0.29 -0.82 -0.15 0.00 -2.08 0.00 0.00 39.78 37.01 2ds1 n ASN 132 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 2ds1 s LEU 133 N -3.39 2.55 -0.09 -4.53 1.02 -0.97 -1.00 118.68 112.27 2ds1 s LEU 133 Ca 0.56 -0.51 -0.01 0.00 0.02 0.00 0.00 54.13 54.19 2ds1 s LEU 133 Cb 0.47 -1.62 -0.03 0.00 0.02 0.00 0.00 46.19 45.03 2ds1 s LEU 133 CO 0.07 -0.01 -0.02 -0.76 0.02 0.00 0.00 176.35 175.65 2ds1 s LEU 134 N 1.38 3.44 0.04 1.79 1.43 -0.29 -0.32 118.68 126.15 2ds1 s LEU 134 Ca 0.05 0.07 0.07 0.00 -1.03 0.00 0.00 54.13 53.29 2ds1 s LEU 134 Cb -0.14 -1.78 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 2ds1 s LEU 134 CO -0.07 0.35 -0.20 0.27 0.23 0.00 0.00 176.35 176.93 2ds1 s ILE 135 N -0.72 1.61 0.52 -0.59 -4.36 -0.12 0.02 121.20 117.56 2ds1 s ILE 135 Ca 0.11 -1.18 0.04 0.00 -0.26 0.00 0.00 60.65 59.36 2ds1 s ILE 135 Cb -0.12 -1.40 0.02 0.00 1.25 0.00 0.00 42.46 42.21 2ds1 s ILE 135 CO 0.02 0.19 0.25 0.54 0.24 0.00 0.00 174.94 176.18 2ds1 s ASN 136 N -1.17 4.45 0.37 4.36 2.20 -0.86 -3.42 114.94 120.87 2ds1 s ASN 136 Ca 0.07 -1.38 0.28 0.00 -0.94 0.00 0.00 52.86 50.89 2ds1 s ASN 136 Cb -0.09 0.40 1.14 0.00 -2.00 0.00 0.00 41.25 40.70 2ds1 s ASN 136 CO 0.02 -0.99 1.82 0.71 -2.94 0.00 0.00 177.10 175.72 2ds1 h THR 137 N 1.00 0.00 -0.34 0.54 1.35 -1.97 -3.16 112.91 110.33 2ds1 h THR 137 Ca -0.40 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 2ds1 h THR 137 Cb 1.30 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 68.91 2ds1 h THR 137 CO 0.64 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 175.29 2ds1 n GLU 138 N -2.57 2.55 -0.83 4.72 1.02 -1.26 -4.59 120.64 119.68 2ds1 n GLU 138 Ca 0.02 -1.54 0.00 0.00 -0.02 0.00 0.00 57.16 55.62 2ds1 n GLU 138 Cb 0.26 -1.64 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 2ds1 n GLU 138 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ds1 n GLY 139 N 0.66 0.75 3.92 0.62 0.00 -1.19 -4.87 105.19 105.08 2ds1 n GLY 139 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 2ds1 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ds1 s ALA 140 N -2.82 3.70 0.00 4.61 0.00 -1.26 -4.89 121.76 121.10 2ds1 s ALA 140 Ca 0.00 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.23 2ds1 s ALA 140 Cb 0.00 -2.16 -0.00 0.00 0.00 0.00 0.00 23.12 20.95 2ds1 s ALA 140 CO 0.00 0.22 -0.02 -1.50 0.00 0.00 0.00 175.76 174.46 2ds1 s ILE 141 N -2.09 0.16 0.06 0.00 2.07 -1.26 -2.02 121.20 118.12 2ds1 s ILE 141 Ca 0.41 -0.14 0.03 0.00 -1.41 0.00 0.00 60.65 59.54 2ds1 s ILE 141 Cb -0.10 -0.15 -0.03 0.00 0.13 0.00 0.00 42.46 42.31 2ds1 s ILE 141 CO 0.31 0.01 -0.09 -0.54 -1.91 0.00 0.00 174.94 172.72 2ds1 s LYS 142 N -0.14 0.68 0.00 3.50 1.02 0.10 -4.61 119.74 120.29 2ds1 s LYS 142 Ca -0.00 -0.93 -0.26 0.00 0.02 0.00 0.00 55.97 54.80 2ds1 s LYS 142 Cb -0.01 -0.44 -0.04 0.00 -0.52 0.00 0.00 37.83 36.81 2ds1 s LYS 142 CO -0.00 0.08 0.82 -0.51 -0.92 0.00 0.00 175.35 174.81 2ds1 s LEU 143 N -1.92 4.39 0.17 3.17 1.43 0.13 -1.13 118.68 124.92 2ds1 s LEU 143 Ca -0.03 1.44 0.10 0.00 -1.03 0.00 0.00 54.13 54.61 2ds1 s LEU 143 Cb -0.07 -3.30 -0.04 0.00 0.03 0.00 0.00 46.19 42.81 2ds1 s LEU 143 CO 0.00 -0.11 -0.16 0.00 0.23 0.00 0.00 176.35 176.31 2ds1 s ALA 144 N 0.51 2.76 -1.21 4.21 0.00 -0.17 -0.62 121.76 127.23 2ds1 s ALA 144 Ca 0.42 -1.50 0.00 0.00 0.00 0.00 0.00 51.96 50.88 2ds1 s ALA 144 Cb -0.20 -0.59 0.00 0.00 0.00 0.00 0.00 23.12 22.34 2ds1 s ALA 144 CO 0.23 0.48 0.00 -3.47 0.00 0.00 0.00 175.76 173.00 2ds1 n ASP 145 N 0.27 -4.62 -4.71 0.00 2.03 -1.26 -4.87 116.55 103.38 2ds1 n ASP 145 Ca -0.12 0.28 -0.42 0.00 0.52 0.00 0.00 54.79 55.05 2ds1 n ASP 145 Cb 0.55 -3.13 -0.03 0.00 -0.72 0.00 0.00 41.12 37.79 2ds1 n ASP 145 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 2ds1 s PHE 146 N -2.34 2.93 0.00 -0.67 2.19 -1.26 -2.55 117.98 116.28 2ds1 s PHE 146 Ca 0.00 0.50 0.00 0.00 0.33 0.00 0.00 56.93 57.76 2ds1 s PHE 146 Cb 0.00 -3.99 0.00 0.00 -1.31 0.00 0.00 43.02 37.72 2ds1 s PHE 146 CO 0.00 -3.74 0.00 0.41 1.83 0.00 0.00 175.22 173.72 2ds1 n GLY 147 N 3.85 2.79 0.25 13.12 0.00 -1.24 -4.87 105.19 119.08 2ds1 n GLY 147 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.28 2ds1 n GLY 147 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ds1 h LEU 148 N 0.00 0.00 0.02 0.99 -0.00 -1.80 -3.21 115.31 111.32 2ds1 h LEU 148 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.89 2ds1 h LEU 148 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.65 2ds1 h LEU 148 CO 0.00 0.16 -0.04 0.00 -0.00 0.00 0.00 178.44 178.55 2ds1 h ALA 149 N 1.84 -0.06 -0.66 1.53 0.00 -1.78 0.23 119.26 120.36 2ds1 h ALA 149 Ca -0.00 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2ds1 h ALA 149 Cb 0.40 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2ds1 h ALA 149 CO 0.02 -0.54 0.13 -0.09 0.00 0.00 0.00 179.25 178.77 2ds1 h ARG 150 N -0.08 1.06 0.34 0.00 2.43 -1.87 -2.90 114.38 113.34 2ds1 h ARG 150 Ca 0.01 -0.26 -0.02 0.00 -0.81 0.00 0.00 59.98 58.91 2ds1 h ARG 150 Cb 0.10 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 2ds1 h ARG 150 CO -0.03 0.95 -0.16 0.00 -1.51 0.00 0.00 179.97 179.22 2ds1 h ALA 151 N 1.14 -0.45 -3.30 2.80 0.00 -1.58 -3.40 119.26 114.47 2ds1 h ALA 151 Ca 0.21 -0.15 -0.67 0.00 0.00 0.00 0.00 54.91 54.30 2ds1 h ALA 151 Cb 0.39 0.18 -0.33 0.00 0.00 0.00 0.00 17.79 18.02 2ds1 h ALA 151 CO 0.01 -0.67 -0.78 -0.06 0.00 0.00 0.00 179.25 177.74 2ds1 s PHE 152 N -5.44 3.02 -0.10 0.00 0.08 0.78 -4.68 117.98 111.64 2ds1 s PHE 152 Ca -0.15 -1.67 -0.34 0.00 0.12 0.00 0.00 56.93 54.90 2ds1 s PHE 152 Cb 0.03 -2.01 -0.11 0.00 -0.57 0.00 0.00 43.02 40.37 2ds1 s PHE 152 CO 0.60 -0.76 1.93 0.41 -0.10 0.00 0.00 175.22 177.30 2ds1 n GLY 153 N 4.63 1.43 3.59 4.36 0.00 -1.11 -4.03 105.19 114.06 2ds1 n GLY 153 Ca -0.17 0.86 -0.42 0.00 0.00 0.00 0.00 46.02 46.29 2ds1 n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ds1 s VAL 154 N 4.53 3.14 1.04 1.61 0.11 -1.25 -4.96 120.40 124.61 2ds1 s VAL 154 Ca 0.94 0.14 -0.15 0.00 -2.93 0.00 0.00 61.98 59.97 2ds1 s VAL 154 Cb -0.66 -3.21 0.21 0.00 -1.53 0.00 0.00 36.38 31.19 2ds1 s VAL 154 CO 0.50 -0.15 1.15 -2.16 -3.33 0.00 0.00 175.10 171.12 2ds1 s PRO 155 N 6.45 0.08 0.22 1.54 0.04 -1.26 -5.00 135.00 137.06 2ds1 s PRO 155 Ca 0.94 0.07 0.14 0.00 0.04 0.00 0.00 61.00 62.19 2ds1 s PRO 155 Cb -0.27 -1.74 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 2ds1 s PRO 155 CO 0.33 -2.87 1.31 -0.24 0.04 0.00 0.00 177.00 175.56 2ds1 h VAL 156 N -1.98 0.91 -3.96 -0.36 3.04 -1.95 -3.44 116.25 108.51 2ds1 h VAL 156 Ca -0.48 -2.33 -0.36 0.00 -1.01 0.00 0.00 66.70 62.51 2ds1 h VAL 156 Cb 1.30 2.41 -0.22 0.00 -2.01 0.00 0.00 31.29 32.77 2ds1 h VAL 156 CO 0.47 0.52 -0.76 -0.13 -1.01 0.00 0.00 177.57 176.66 2ds1 s ARG 157 N -2.92 0.71 0.92 4.17 0.52 -1.26 -1.25 118.95 119.84 2ds1 s ARG 157 Ca 0.02 -0.86 -0.15 0.00 -0.52 0.00 0.00 55.73 54.22 2ds1 s ARG 157 Cb 0.08 -0.63 0.16 0.00 0.52 0.00 0.00 34.95 35.08 2ds1 s ARG 157 CO 0.77 0.14 1.26 0.99 0.02 0.00 0.00 175.30 178.47 2ds1 s THR 158 N -1.28 1.98 0.48 0.02 2.01 0.18 -4.85 115.64 114.19 2ds1 s THR 158 Ca -0.05 0.00 0.31 0.00 0.31 0.00 0.00 61.69 62.26 2ds1 s THR 158 Cb -0.10 -2.97 0.34 0.00 0.01 0.00 0.00 72.50 69.78 2ds1 s THR 158 CO 0.01 0.00 2.16 0.10 -0.69 0.00 0.00 174.62 176.20 2ds1 h TYR 159 N -1.49 0.00 -0.02 4.92 -0.00 -1.82 0.82 116.97 119.38 2ds1 h TYR 159 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.28 2ds1 h TYR 159 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.00 2ds1 h TYR 159 CO -0.66 0.06 0.00 -2.37 -0.00 0.00 0.00 178.16 175.20 2ds1 n THR 160 N -3.59 0.00 -0.91 -0.90 5.66 -1.26 -4.93 114.28 108.35 2ds1 n THR 160 Ca -0.02 -0.25 0.00 0.00 -3.05 0.00 0.00 64.05 60.73 2ds1 n THR 160 Cb 0.18 0.50 0.00 0.00 -1.55 0.00 0.00 70.33 69.45 2ds1 n THR 160 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2ds1 n HIS 161 N 0.17 0.00 -2.27 1.09 8.25 0.28 -5.04 115.22 117.70 2ds1 n HIS 161 Ca 0.19 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.28 2ds1 n HIS 161 Cb 0.35 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.45 2ds1 n HIS 161 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2ds1 s GLU 162 N -0.09 3.87 0.02 -0.41 2.02 -1.26 -4.58 118.70 118.27 2ds1 s GLU 162 Ca 0.00 1.80 -0.30 0.00 0.02 0.00 0.00 54.97 56.48 2ds1 s GLU 162 Cb 0.00 -2.51 -0.04 0.00 0.10 0.00 0.00 34.13 31.68 2ds1 s GLU 162 CO 0.00 -0.46 1.11 0.14 0.02 0.00 0.00 175.26 176.07 2ds1 s VAL 163 N -1.50 4.39 0.14 2.63 -7.23 -1.26 -0.65 120.40 116.92 2ds1 s VAL 163 Ca 0.61 1.71 -0.31 0.00 -1.81 0.00 0.00 61.98 62.19 2ds1 s VAL 163 Cb -0.29 -4.10 -0.08 0.00 0.56 0.00 0.00 36.38 32.47 2ds1 s VAL 163 CO 0.36 0.12 1.38 -0.69 -0.31 0.00 0.00 175.10 175.96 2ds1 s VAL 164 N 1.16 3.25 0.29 1.32 1.01 -0.38 -4.92 120.40 122.12 2ds1 s VAL 164 Ca 0.56 0.92 -0.29 0.00 0.00 0.00 0.00 61.98 63.16 2ds1 s VAL 164 Cb -0.26 -3.59 -0.10 0.00 0.00 0.00 0.00 36.38 32.44 2ds1 s VAL 164 CO 0.28 0.09 1.35 0.28 0.00 0.00 0.00 175.10 177.09 2ds1 s THR 165 N 0.88 2.76 -1.77 3.92 -1.32 -1.26 -4.93 115.64 113.92 2ds1 s THR 165 Ca 0.63 0.71 0.19 0.00 -1.21 0.00 0.00 61.69 62.01 2ds1 s THR 165 Cb -0.37 -3.45 -0.01 0.00 -1.51 0.00 0.00 72.50 67.16 2ds1 s THR 165 CO 0.32 0.14 0.98 0.18 -2.21 0.00 0.00 174.62 174.03 2ds1 n LEU 166 N 1.48 1.84 -0.14 9.08 4.32 -1.26 -4.65 117.00 127.67 2ds1 n LEU 166 Ca 0.03 -0.76 0.22 0.00 -0.02 0.00 0.00 56.01 55.48 2ds1 n LEU 166 Cb 0.41 0.00 0.64 0.00 -1.62 0.00 0.00 43.42 42.85 2ds1 n LEU 166 CO 0.59 0.35 1.22 -0.50 -1.22 0.00 0.00 177.39 177.84 2ds1 h TRP 167 N 2.14 0.19 -0.45 -1.77 4.06 -1.81 -2.02 115.95 116.29 2ds1 h TRP 167 Ca 0.00 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.96 2ds1 h TRP 167 Cb 0.66 -0.06 0.00 0.00 -1.00 0.00 0.00 29.16 28.76 2ds1 h TRP 167 CO 0.00 0.06 0.00 0.66 -3.56 0.00 0.00 178.44 175.60 2ds1 n TYR 168 N -4.38 0.59 -2.55 0.49 4.01 -1.26 -4.58 117.16 109.48 2ds1 n TYR 168 Ca 0.16 -0.43 -0.42 0.00 -0.16 0.00 0.00 57.90 57.05 2ds1 n TYR 168 Cb 0.74 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.73 2ds1 n TYR 168 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 2ds1 s ARG 169 N -1.06 4.49 0.55 -0.72 3.52 -0.76 -3.82 118.95 121.15 2ds1 s ARG 169 Ca 0.33 1.62 -0.20 0.00 -0.13 0.00 0.00 55.73 57.34 2ds1 s ARG 169 Cb 0.17 -3.39 -0.05 0.00 -1.56 0.00 0.00 34.95 30.12 2ds1 s ARG 169 CO 0.23 -0.16 1.22 0.00 -0.81 0.00 0.00 175.30 175.79 2ds1 s ALA 170 N 1.00 2.69 0.41 6.12 0.00 -1.26 -4.89 121.76 125.84 2ds1 s ALA 170 Ca 0.56 1.05 0.07 0.00 0.00 0.00 0.00 51.96 53.64 2ds1 s ALA 170 Cb -0.26 -3.46 0.85 0.00 0.00 0.00 0.00 23.12 20.26 2ds1 s ALA 170 CO 0.29 -1.08 2.05 -1.00 0.00 0.00 0.00 175.76 176.02 2ds1 h PRO 171 N 1.26 0.56 -0.24 0.00 0.13 -1.95 -2.17 132.00 129.59 2ds1 h PRO 171 Ca -0.50 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 64.52 2ds1 h PRO 171 Cb 1.29 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 2ds1 h PRO 171 CO 0.57 0.37 -0.15 1.05 -0.23 0.00 0.00 178.00 179.60 2ds1 h GLU 172 N 0.58 0.42 -0.20 0.86 9.09 -1.92 0.25 114.58 123.66 2ds1 h GLU 172 Ca 0.17 -0.12 -0.06 0.00 0.05 0.00 0.00 59.36 59.40 2ds1 h GLU 172 Cb -0.01 -0.04 -0.00 0.00 -1.65 0.00 0.00 28.75 27.04 2ds1 h GLU 172 CO -0.04 0.57 -0.13 0.82 0.05 0.00 0.00 179.01 180.28 2ds1 h ILE 173 N 0.38 1.32 -0.66 -1.06 2.04 -1.67 -1.15 117.51 116.71 2ds1 h ILE 173 Ca 0.07 -1.22 0.00 0.00 1.00 0.00 0.00 64.86 64.71 2ds1 h ILE 173 Cb 0.50 1.70 -0.03 0.00 -0.74 0.00 0.00 36.82 38.24 2ds1 h ILE 173 CO 0.03 0.37 0.42 -0.07 0.00 0.00 0.00 178.15 178.90 2ds1 h LEU 174 N 0.11 0.76 -0.25 1.44 4.07 -1.04 -2.35 115.31 118.07 2ds1 h LEU 174 Ca 0.04 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.97 2ds1 h LEU 174 Cb 0.63 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 42.18 2ds1 h LEU 174 CO 0.03 0.57 0.00 0.18 -1.08 0.00 0.00 178.44 178.14 2ds1 n LEU 175 N -4.43 0.36 0.00 1.67 4.77 0.83 -4.86 117.00 115.35 2ds1 n LEU 175 Ca 0.07 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 2ds1 n LEU 175 Cb 0.05 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2ds1 n LEU 175 CO 0.36 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 2ds1 n GLY 176 N 0.77 0.70 3.69 -0.72 0.00 -0.88 -0.96 105.19 107.79 2ds1 n GLY 176 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2ds1 n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ds1 n LYS 178 N 5.80 0.55 -2.61 0.00 2.85 -1.26 -4.34 118.16 119.16 2ds1 n LYS 178 Ca 0.16 0.10 -0.31 0.00 -1.05 0.00 0.00 58.31 57.21 2ds1 n LYS 178 Cb 0.40 -1.79 -0.01 0.00 -0.65 0.00 0.00 35.03 32.99 2ds1 n LYS 178 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2ds1 n TYR 179 N -2.56 3.49 -1.59 5.58 4.01 -1.26 -5.06 117.16 119.77 2ds1 n TYR 179 Ca 0.00 -3.24 -0.33 0.00 -0.16 0.00 0.00 57.90 54.17 2ds1 n TYR 179 Cb 0.53 -0.60 0.07 0.00 -0.31 0.00 0.00 39.34 39.03 2ds1 n TYR 179 CO 0.00 0.00 0.00 1.52 -0.46 0.00 0.00 176.86 177.92 2ds1 s TYR 180 N -3.74 2.46 0.01 -0.72 1.13 -1.26 -5.05 117.35 110.19 2ds1 s TYR 180 Ca 0.47 1.57 0.00 0.00 -1.41 0.00 0.00 57.07 57.71 2ds1 s TYR 180 Cb 0.32 -3.22 0.00 0.00 -1.10 0.00 0.00 41.96 37.96 2ds1 s TYR 180 CO -0.19 -1.92 0.02 -1.13 -2.51 0.00 0.00 175.55 169.81 2ds1 n SER 181 N -2.68 0.22 0.25 -0.18 3.41 -1.26 -4.98 113.62 108.41 2ds1 n SER 181 Ca 0.11 -1.04 0.17 0.00 -0.26 0.00 0.00 58.87 57.85 2ds1 n SER 181 Cb 0.52 -0.01 0.86 0.00 -0.26 0.00 0.00 64.21 65.31 2ds1 n SER 181 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2ds1 h THR 182 N 0.09 0.00 0.00 6.66 1.35 -1.96 -2.45 112.91 116.59 2ds1 h THR 182 Ca -0.01 -0.13 -0.00 0.00 -0.55 0.00 0.00 66.41 65.72 2ds1 h THR 182 Cb 0.03 0.95 -0.00 0.00 -1.73 0.00 0.00 68.15 67.40 2ds1 h THR 182 CO 0.01 0.00 -0.02 0.00 -0.25 0.00 0.00 175.52 175.26 2ds1 h ALA 183 N 2.03 1.39 -0.10 6.62 0.00 -1.93 -2.11 119.26 125.16 2ds1 h ALA 183 Ca 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2ds1 h ALA 183 Cb 0.14 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2ds1 h ALA 183 CO 0.00 0.03 -0.16 -0.39 0.00 0.00 0.00 179.25 178.73 2ds1 h VAL 184 N 0.00 1.17 -0.02 0.00 -1.51 -1.83 -2.16 116.25 111.90 2ds1 h VAL 184 Ca -0.00 -0.77 -0.17 0.00 -1.23 0.00 0.00 66.70 64.53 2ds1 h VAL 184 Cb 0.07 1.28 -0.02 0.00 -2.13 0.00 0.00 31.29 30.49 2ds1 h VAL 184 CO 0.00 0.23 -0.75 0.44 -1.23 0.00 0.00 177.57 176.27 2ds1 h ASP 185 N 0.15 0.16 -0.40 4.19 3.32 -1.61 -2.60 116.42 119.62 2ds1 h ASP 185 Ca 0.03 -0.11 -0.11 0.00 0.02 0.00 0.00 57.03 56.86 2ds1 h ASP 185 Cb 0.38 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 2ds1 h ASP 185 CO 0.02 0.85 -0.16 0.40 -1.72 0.00 0.00 179.24 178.63 2ds1 h ILE 186 N 0.08 1.28 0.17 0.35 1.08 -1.52 -1.30 117.51 117.65 2ds1 h ILE 186 Ca -0.02 -1.28 0.01 0.00 -0.39 0.00 0.00 64.86 63.18 2ds1 h ILE 186 Cb 1.31 1.26 -0.03 0.00 -3.07 0.00 0.00 36.82 36.30 2ds1 h ILE 186 CO 0.11 0.43 -0.24 -0.25 -0.69 0.00 0.00 178.15 177.50 2ds1 h TRP 187 N 0.63 -0.65 -0.39 1.37 2.91 -1.34 -0.29 115.95 118.19 2ds1 h TRP 187 Ca 0.09 0.01 0.07 0.00 1.13 0.00 0.00 58.89 60.19 2ds1 h TRP 187 Cb 0.71 0.26 -0.06 0.00 -0.51 0.00 0.00 29.16 29.56 2ds1 h TRP 187 CO 0.05 -0.35 0.01 0.77 -1.03 0.00 0.00 178.44 177.90 2ds1 h SER 188 N -0.48 -0.13 -0.46 2.65 0.02 -1.38 -1.23 113.55 112.54 2ds1 h SER 188 Ca 0.02 0.09 -0.03 0.00 -0.84 0.00 0.00 61.79 61.03 2ds1 h SER 188 Cb 0.48 0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.14 2ds1 h SER 188 CO -0.10 -0.03 0.21 0.25 -1.14 0.00 0.00 176.83 176.01 2ds1 h LEU 189 N 0.12 0.66 -0.75 5.07 5.85 -0.96 -1.42 115.31 123.89 2ds1 h LEU 189 Ca 0.19 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 2ds1 h LEU 189 Cb 0.27 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 2ds1 h LEU 189 CO -0.31 0.60 0.33 1.23 -0.34 0.00 0.00 178.44 179.94 2ds1 h GLY 190 N 0.86 1.19 1.11 3.75 0.00 0.06 0.60 103.07 110.64 2ds1 h GLY 190 Ca 0.18 -0.62 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 2ds1 h GLY 190 CO -0.02 0.59 0.31 0.00 0.00 0.00 0.00 176.54 177.42 2ds1 h ILE 192 N 1.11 1.27 -0.04 0.00 2.04 -0.77 -2.16 117.51 118.96 2ds1 h ILE 192 Ca 0.26 -1.30 0.02 0.00 1.00 0.00 0.00 64.86 64.84 2ds1 h ILE 192 Cb 0.21 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 2ds1 h ILE 192 CO -0.02 0.45 -0.10 0.15 0.00 0.00 0.00 178.15 178.62 2ds1 h PHE 193 N 0.77 -0.26 -0.81 1.37 3.57 -0.54 -0.89 116.94 120.15 2ds1 h PHE 193 Ca 0.11 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.63 2ds1 h PHE 193 Cb 0.72 0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.54 2ds1 h PHE 193 CO 0.05 -0.16 0.54 0.00 -2.23 0.00 0.00 178.31 176.51 2ds1 h ALA 194 N 0.85 1.04 -0.52 2.41 0.00 -1.19 -2.65 119.26 119.19 2ds1 h ALA 194 Ca 0.05 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2ds1 h ALA 194 Cb 0.23 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2ds1 h ALA 194 CO -0.13 0.43 0.06 1.49 0.00 0.00 0.00 179.25 181.11 2ds1 h GLU 195 N 1.10 0.83 -0.54 0.00 4.81 -0.95 -0.87 114.58 118.95 2ds1 h GLU 195 Ca 0.30 -0.20 -0.10 0.00 -0.13 0.00 0.00 59.36 59.23 2ds1 h GLU 195 Cb -0.12 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.13 2ds1 h GLU 195 CO -0.07 0.79 -0.05 0.52 -0.73 0.00 0.00 179.01 179.47 2ds1 h MET 196 N 0.79 0.97 -0.20 1.92 2.86 -0.90 0.14 114.93 120.50 2ds1 h MET 196 Ca 0.16 -0.32 -0.13 0.00 -2.06 0.00 0.00 59.70 57.35 2ds1 h MET 196 Cb 0.38 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.96 2ds1 h MET 196 CO 0.01 0.99 -0.39 0.28 1.06 0.00 0.00 176.91 178.85 2ds1 h VAL 197 N 0.88 1.33 0.00 -2.22 2.07 -1.20 -3.34 116.25 113.76 2ds1 h VAL 197 Ca 0.15 -1.62 0.00 0.00 0.82 0.00 0.00 66.70 66.05 2ds1 h VAL 197 Cb 0.58 1.85 0.00 0.00 -1.52 0.00 0.00 31.29 32.20 2ds1 h VAL 197 CO 0.04 0.50 -1.07 0.35 0.02 0.00 0.00 177.57 177.41 2ds1 n THR 198 N -4.24 0.33 -2.03 2.57 -2.24 -0.36 -4.78 114.28 103.53 2ds1 n THR 198 Ca -0.06 -0.38 -0.11 0.00 -2.27 0.00 0.00 64.05 61.23 2ds1 n THR 198 Cb 0.53 -0.05 -0.01 0.00 -2.10 0.00 0.00 70.33 68.70 2ds1 n THR 198 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2ds1 n ARG 199 N -2.26 -0.88 -3.75 -0.78 1.74 0.47 -5.01 116.66 106.20 2ds1 n ARG 199 Ca 0.01 0.62 -0.13 0.00 -0.77 0.00 0.00 57.85 57.58 2ds1 n ARG 199 Cb 0.49 -4.72 -0.10 0.00 -1.02 0.00 0.00 32.46 27.11 2ds1 n ARG 199 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2ds1 s ARG 200 N -4.22 0.48 0.32 5.56 3.52 -1.21 -5.06 118.95 118.34 2ds1 s ARG 200 Ca 0.00 0.36 -0.29 0.00 -0.13 0.00 0.00 55.73 55.67 2ds1 s ARG 200 Cb 0.00 0.23 -0.11 0.00 -1.56 0.00 0.00 34.95 33.51 2ds1 s ARG 200 CO 0.00 -0.08 1.51 0.00 -0.81 0.00 0.00 175.30 175.92 2ds1 s ALA 201 N -0.12 3.64 -0.00 6.12 0.00 -1.26 -4.23 121.76 125.90 2ds1 s ALA 201 Ca -0.03 1.51 -0.25 0.00 0.00 0.00 0.00 51.96 53.20 2ds1 s ALA 201 Cb -0.03 -3.61 -0.19 0.00 0.00 0.00 0.00 23.12 19.30 2ds1 s ALA 201 CO 0.01 -0.95 1.30 1.25 0.00 0.00 0.00 175.76 177.37 2ds1 h LEU 202 N 4.01 -0.08 -6.62 0.00 6.46 -1.92 -3.40 115.31 113.77 2ds1 h LEU 202 Ca -0.49 -0.35 -0.60 0.00 -0.12 0.00 0.00 57.88 56.32 2ds1 h LEU 202 Cb 1.23 0.02 -0.40 0.00 -0.73 0.00 0.00 40.66 40.78 2ds1 h LEU 202 CO 0.72 0.32 -0.82 0.49 -0.62 0.00 0.00 178.44 178.53 2ds1 n PHE 203 N -4.94 0.71 -1.65 1.25 3.72 -1.26 -5.01 117.46 110.27 2ds1 n PHE 203 Ca -0.08 -3.70 -0.41 0.00 -0.05 0.00 0.00 57.45 53.21 2ds1 n PHE 203 Cb 0.22 -0.09 -0.01 0.00 -0.94 0.00 0.00 39.48 38.66 2ds1 n PHE 203 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2ds1 n PRO 204 N 2.44 3.25 -2.45 -1.08 -0.04 -1.26 -4.33 135.00 131.53 2ds1 n PRO 204 Ca 0.26 -2.57 -0.35 0.00 -0.04 0.00 0.00 63.50 60.80 2ds1 n PRO 204 Cb 0.43 -3.08 -0.02 0.00 -0.04 0.00 0.00 33.50 30.79 2ds1 n PRO 204 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2ds1 s GLY 205 N 2.59 2.61 -0.17 0.55 0.00 -1.26 -4.97 107.32 106.67 2ds1 s GLY 205 Ca 0.54 0.71 0.16 0.00 0.00 0.00 0.00 44.72 46.13 2ds1 s GLY 205 CO -0.07 1.07 1.21 2.09 0.00 0.00 0.00 173.10 177.40 2ds1 n ASP 206 N -0.85 2.28 -3.61 1.64 5.75 -1.26 -4.58 116.55 115.92 2ds1 n ASP 206 Ca 0.09 -3.39 -0.04 0.00 -0.01 0.00 0.00 54.79 51.44 2ds1 n ASP 206 Cb 0.51 -0.48 -0.02 0.00 -1.03 0.00 0.00 41.12 40.10 2ds1 n ASP 206 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2ds1 s SER 207 N -2.90 -0.10 0.25 -1.12 1.04 -1.26 -4.99 113.70 104.62 2ds1 s SER 207 Ca 0.36 0.01 -0.06 0.00 0.48 0.00 0.00 55.95 56.73 2ds1 s SER 207 Cb 0.32 0.10 0.26 0.00 0.10 0.00 0.00 66.02 66.80 2ds1 s SER 207 CO 0.00 -0.16 1.92 -0.33 0.98 0.00 0.00 173.24 175.65 2ds1 h GLU 208 N 2.01 1.27 -0.05 4.02 5.08 -1.99 0.94 114.58 125.87 2ds1 h GLU 208 Ca -0.07 -0.08 -0.18 0.00 -1.00 0.00 0.00 59.36 58.03 2ds1 h GLU 208 Cb 1.16 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 2ds1 h GLU 208 CO 0.22 0.84 -0.74 0.97 -1.00 0.00 0.00 179.01 179.30 2ds1 h ILE 209 N 1.31 1.41 -0.41 3.13 6.09 -1.96 -0.49 117.51 126.58 2ds1 h ILE 209 Ca 0.36 -2.22 -0.13 0.00 -1.37 0.00 0.00 64.86 61.50 2ds1 h ILE 209 Cb -0.13 2.18 -0.01 0.00 0.47 0.00 0.00 36.82 39.33 2ds1 h ILE 209 CO -0.09 0.66 -0.24 -0.78 -3.07 0.00 0.00 178.15 174.63 2ds1 h ASP 210 N 0.21 0.87 0.17 2.19 3.58 -1.86 0.11 116.42 121.69 2ds1 h ASP 210 Ca -0.03 -0.33 -0.01 0.00 0.42 0.00 0.00 57.03 57.08 2ds1 h ASP 210 Cb 1.32 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 42.13 2ds1 h ASP 210 CO 0.12 1.07 -0.08 -0.61 -2.88 0.00 0.00 179.24 176.86 2ds1 h GLN 211 N 0.73 -0.22 -0.63 0.28 5.75 -0.66 -0.66 115.11 119.70 2ds1 h GLN 211 Ca 0.09 0.01 0.03 0.00 -0.15 0.00 0.00 58.65 58.64 2ds1 h GLN 211 Cb 0.79 0.05 -0.04 0.00 1.07 0.00 0.00 27.48 29.34 2ds1 h GLN 211 CO 0.06 -0.06 0.39 1.25 -2.65 0.00 0.00 178.83 177.82 2ds1 h LEU 212 N -0.32 0.64 -1.15 -2.39 5.85 -0.97 -2.23 115.31 114.74 2ds1 h LEU 212 Ca -0.02 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.61 2ds1 h LEU 212 Cb 0.25 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 2ds1 h LEU 212 CO 0.04 0.45 -0.42 -0.26 -0.34 0.00 0.00 178.44 177.90 2ds1 h PHE 213 N 0.77 0.00 -0.34 1.25 -1.00 -0.58 -1.50 116.94 115.54 2ds1 h PHE 213 Ca 0.25 -0.00 -0.15 0.00 2.81 0.00 0.00 57.97 60.88 2ds1 h PHE 213 Cb 0.02 -0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.57 2ds1 h PHE 213 CO -0.05 0.43 -0.38 0.00 -1.61 0.00 0.00 178.31 176.69 2ds1 h ARG 214 N 0.00 0.83 -0.41 1.51 3.08 -0.74 -0.94 114.38 117.71 2ds1 h ARG 214 Ca -0.00 -0.43 -0.02 0.00 0.07 0.00 0.00 59.98 59.60 2ds1 h ARG 214 Cb 0.75 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.79 2ds1 h ARG 214 CO 0.06 1.06 0.16 0.82 -1.07 0.00 0.00 179.97 181.00 2ds1 h ILE 215 N 0.68 1.19 -0.56 2.04 2.04 -1.08 -2.92 117.51 118.89 2ds1 h ILE 215 Ca 0.06 -0.60 -0.00 0.00 1.00 0.00 0.00 64.86 65.32 2ds1 h ILE 215 Cb 0.95 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 2ds1 h ILE 215 CO 0.09 0.22 0.34 -0.26 0.00 0.00 0.00 178.15 178.54 2ds1 h PHE 216 N 0.51 0.74 -0.00 1.37 0.04 -1.11 -0.24 116.94 118.25 2ds1 h PHE 216 Ca 0.14 -0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.88 2ds1 h PHE 216 Cb 0.18 -0.24 -0.00 0.00 2.20 0.00 0.00 35.95 38.09 2ds1 h PHE 216 CO -0.00 0.51 -0.08 0.00 -0.60 0.00 0.00 178.31 178.14 2ds1 h ARG 217 N 0.76 0.00 0.03 1.51 3.08 -1.03 0.50 114.38 119.24 2ds1 h ARG 217 Ca 0.20 -0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.96 2ds1 h ARG 217 Cb -0.01 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 2ds1 h ARG 217 CO -0.04 0.09 -1.57 2.41 -1.07 0.00 0.00 179.97 179.79 2ds1 n THR 218 N -4.44 1.60 1.15 2.04 -1.04 -1.08 -4.48 114.28 108.03 2ds1 n THR 218 Ca -0.03 -0.22 0.12 0.00 -2.04 0.00 0.00 64.05 61.88 2ds1 n THR 218 Cb 0.16 -1.94 0.21 0.00 -1.82 0.00 0.00 70.33 66.94 2ds1 n THR 218 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2ds1 n LEU 219 N -4.16 1.94 0.00 -4.42 4.32 -0.12 -0.71 117.00 113.85 2ds1 n LEU 219 Ca -0.34 -0.65 0.00 0.00 -0.02 0.00 0.00 56.01 55.00 2ds1 n LEU 219 Cb 0.80 -0.03 0.00 0.00 -1.62 0.00 0.00 43.42 42.57 2ds1 n LEU 219 CO 0.24 0.34 0.00 0.61 -1.22 0.00 0.00 177.39 177.36 2ds1 n GLY 220 N 1.34 -0.56 3.68 -0.72 0.00 0.18 -4.58 105.19 104.54 2ds1 n GLY 220 Ca 0.13 -1.46 -0.42 0.00 0.00 0.00 0.00 46.02 44.27 2ds1 n GLY 220 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ds1 s THR 221 N -2.66 3.60 0.58 2.61 2.01 -0.89 -4.53 115.64 116.36 2ds1 s THR 221 Ca 0.00 0.97 -0.19 0.00 0.31 0.00 0.00 61.69 62.78 2ds1 s THR 221 Cb 0.00 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 2ds1 s THR 221 CO 0.00 -0.01 1.21 -2.16 -0.69 0.00 0.00 174.62 172.97 2ds1 s PRO 222 N 2.62 3.03 0.17 4.92 0.04 -1.26 -4.87 135.00 139.64 2ds1 s PRO 222 Ca 0.66 1.85 0.03 0.00 0.04 0.00 0.00 61.00 63.57 2ds1 s PRO 222 Cb -0.33 -1.97 -0.01 0.00 0.04 0.00 0.00 34.50 32.23 2ds1 s PRO 222 CO 0.27 -1.17 0.17 -0.40 0.04 0.00 0.00 177.00 175.92 2ds1 n ASP 223 N -1.50 -0.46 0.30 6.66 5.68 -1.26 -4.99 116.55 120.98 2ds1 n ASP 223 Ca 0.13 -2.08 0.18 0.00 -0.50 0.00 0.00 54.79 52.53 2ds1 n ASP 223 Cb 0.49 0.98 0.92 0.00 -1.14 0.00 0.00 41.12 42.38 2ds1 n ASP 223 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2ds1 h GLU 224 N 0.00 0.00 0.42 0.11 4.39 -1.97 -0.18 114.58 117.36 2ds1 h GLU 224 Ca -0.12 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.55 2ds1 h GLU 224 Cb 0.61 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.27 2ds1 h GLU 224 CO 0.18 0.03 -0.20 0.28 -1.16 0.00 0.00 179.01 178.14 2ds1 h VAL 225 N 0.00 0.00 0.00 3.13 2.07 -2.00 -3.17 116.25 116.28 2ds1 h VAL 225 Ca -0.00 -0.40 -0.08 0.00 0.82 0.00 0.00 66.70 67.04 2ds1 h VAL 225 Cb 0.24 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.00 2ds1 h VAL 225 CO 0.00 0.00 -0.38 -0.37 0.02 0.00 0.00 177.57 176.84 2ds1 h VAL 226 N -0.97 0.73 -2.42 2.57 -1.51 -1.96 -3.40 116.25 109.28 2ds1 h VAL 226 Ca -0.06 -1.79 -0.58 0.00 -1.23 0.00 0.00 66.70 63.05 2ds1 h VAL 226 Cb 0.43 2.18 -0.38 0.00 -2.13 0.00 0.00 31.29 31.39 2ds1 h VAL 226 CO 0.10 0.38 -0.92 0.86 -1.23 0.00 0.00 177.57 176.75 2ds1 s TRP 227 N -3.22 0.89 0.16 5.19 -0.11 -0.08 -4.31 118.94 117.46 2ds1 s TRP 227 Ca 0.03 -2.02 -0.33 0.00 1.22 0.00 0.00 56.10 55.00 2ds1 s TRP 227 Cb 0.08 -0.89 -0.12 0.00 -1.50 0.00 0.00 33.47 31.04 2ds1 s TRP 227 CO 0.71 -0.84 1.70 -0.35 -4.62 0.00 0.00 176.95 173.55 2ds1 n PRO 228 N 3.32 2.53 0.00 5.86 -0.04 -1.20 -1.63 135.00 143.83 2ds1 n PRO 228 Ca 0.23 0.91 0.00 0.00 -0.04 0.00 0.00 63.50 64.60 2ds1 n PRO 228 Cb 0.44 -2.74 0.00 0.00 -0.04 0.00 0.00 33.50 31.16 2ds1 n PRO 228 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ds1 n GLY 229 N 3.84 1.66 0.30 0.55 0.00 -1.26 -4.96 105.19 105.32 2ds1 n GLY 229 Ca 0.17 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.24 2ds1 n GLY 229 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2ds1 h VAL 230 N 0.00 0.80 0.00 1.61 3.04 -1.62 -1.23 116.25 118.85 2ds1 h VAL 230 Ca 0.00 -0.23 0.00 0.00 -1.01 0.00 0.00 66.70 65.46 2ds1 h VAL 230 Cb 0.00 0.06 0.00 0.00 -2.01 0.00 0.00 31.29 29.34 2ds1 h VAL 230 CO 0.00 0.12 0.00 0.35 -1.01 0.00 0.00 177.57 177.03 2ds1 n THR 231 N -4.83 0.92 1.22 3.17 -2.24 -1.26 -1.23 114.28 110.03 2ds1 n THR 231 Ca 0.15 0.53 0.13 0.00 -2.27 0.00 0.00 64.05 62.59 2ds1 n THR 231 Cb 0.37 -1.51 0.28 0.00 -2.10 0.00 0.00 70.33 67.37 2ds1 n THR 231 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2ds1 n SER 232 N -2.29 1.80 -4.76 3.42 7.64 -0.47 -4.86 113.62 114.10 2ds1 n SER 232 Ca -0.00 -1.44 -0.39 0.00 1.01 0.00 0.00 58.87 58.05 2ds1 n SER 232 Cb 0.12 0.14 0.02 0.00 -1.01 0.00 0.00 64.21 63.48 2ds1 n SER 232 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2ds1 s MET 233 N -2.24 3.57 0.25 1.43 -1.94 -0.37 -4.92 119.30 115.08 2ds1 s MET 233 Ca 0.28 2.31 -0.06 0.00 -1.71 0.00 0.00 55.69 56.51 2ds1 s MET 233 Cb 0.20 -2.55 0.45 0.00 2.01 0.00 0.00 34.83 34.94 2ds1 s MET 233 CO 0.43 -0.87 1.64 -1.35 -0.01 0.00 0.00 175.02 174.86 2ds1 h PRO 234 N 2.12 0.12 -0.58 2.03 0.11 -1.82 -2.43 132.00 131.56 2ds1 h PRO 234 Ca -0.51 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2ds1 h PRO 234 Cb 1.27 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2ds1 h PRO 234 CO 0.60 0.08 0.00 -0.25 -0.21 0.00 0.00 178.00 178.22 2ds1 n ASP 235 N -5.31 4.29 -4.75 -2.05 8.00 -0.13 -4.95 116.55 111.65 2ds1 n ASP 235 Ca 0.14 -2.37 -0.41 0.00 0.71 0.00 0.00 54.79 52.87 2ds1 n ASP 235 Cb 0.48 -0.51 -0.04 0.00 -0.02 0.00 0.00 41.12 41.02 2ds1 n ASP 235 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2ds1 s TYR 236 N -1.68 3.65 -0.12 1.24 5.04 -0.92 -4.94 117.35 119.62 2ds1 s TYR 236 Ca 0.46 1.70 0.02 0.00 -2.44 0.00 0.00 57.07 56.80 2ds1 s TYR 236 Cb 0.29 -3.23 0.01 0.00 0.35 0.00 0.00 41.96 39.38 2ds1 s TYR 236 CO 0.23 -0.42 -0.17 0.15 -1.34 0.00 0.00 175.55 174.00 2ds1 s LYS 237 N -0.99 2.46 0.67 4.97 -0.14 -1.26 -4.93 119.74 120.51 2ds1 s LYS 237 Ca 0.46 -0.65 0.40 0.00 -1.36 0.00 0.00 55.97 54.82 2ds1 s LYS 237 Cb -0.30 -2.06 2.18 0.00 -1.68 0.00 0.00 37.83 35.97 2ds1 s LYS 237 CO 0.37 -0.06 2.23 -1.35 -0.76 0.00 0.00 175.35 175.78 2ds1 h PRO 238 N 7.43 0.00 -0.04 -1.68 0.11 -1.95 -0.65 132.00 135.22 2ds1 h PRO 238 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2ds1 h PRO 238 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2ds1 h PRO 238 CO 0.51 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.17 2ds1 n SER 239 N -3.01 0.48 -4.78 -2.05 3.41 -1.26 -4.90 113.62 101.51 2ds1 n SER 239 Ca -0.03 -1.43 -0.41 0.00 -0.26 0.00 0.00 58.87 56.74 2ds1 n SER 239 Cb 0.17 -0.02 -0.00 0.00 -0.26 0.00 0.00 64.21 64.09 2ds1 n SER 239 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2ds1 s PHE 240 N -1.95 2.58 0.73 7.33 0.08 -0.25 -4.93 117.98 121.57 2ds1 s PHE 240 Ca 0.32 1.13 -0.15 0.00 0.12 0.00 0.00 56.93 58.36 2ds1 s PHE 240 Cb 0.16 -4.04 0.04 0.00 -0.57 0.00 0.00 43.02 38.61 2ds1 s PHE 240 CO 0.26 -3.08 1.20 -2.14 -0.10 0.00 0.00 175.22 171.36 2ds1 s PRO 241 N -2.00 2.11 -0.48 0.24 0.02 -1.26 -4.96 135.00 128.67 2ds1 s PRO 241 Ca 0.54 1.75 -0.14 0.00 0.02 0.00 0.00 61.00 63.17 2ds1 s PRO 241 Cb -0.47 -1.83 0.09 0.00 0.02 0.00 0.00 34.50 32.31 2ds1 s PRO 241 CO 0.63 -1.85 0.39 0.15 -0.33 0.00 0.00 177.00 175.98 2ds1 s LYS 242 N -3.94 2.86 0.05 5.54 1.02 -1.26 -4.81 119.74 119.20 2ds1 s LYS 242 Ca 0.74 -1.50 -0.03 0.00 0.02 0.00 0.00 55.97 55.20 2ds1 s LYS 242 Cb -0.29 -4.09 -0.04 0.00 -0.52 0.00 0.00 37.83 32.89 2ds1 s LYS 242 CO 0.46 -1.10 0.25 -1.58 -0.92 0.00 0.00 175.35 172.45 2ds1 s TRP 243 N 1.56 3.53 0.37 3.18 0.51 -1.26 -4.94 118.94 121.88 2ds1 s TRP 243 Ca 0.04 0.38 -0.17 0.00 -2.12 0.00 0.00 56.10 54.23 2ds1 s TRP 243 Cb -0.26 -1.86 -0.09 0.00 -0.81 0.00 0.00 33.47 30.45 2ds1 s TRP 243 CO 0.04 0.58 0.81 0.00 -0.51 0.00 0.00 176.95 177.87 2ds1 s ALA 244 N -1.46 3.23 0.04 0.98 0.00 -1.26 -2.10 121.76 121.17 2ds1 s ALA 244 Ca 0.33 0.15 -0.30 0.00 0.00 0.00 0.00 51.96 52.14 2ds1 s ALA 244 Cb -0.13 -2.90 -0.04 0.00 0.00 0.00 0.00 23.12 20.05 2ds1 s ALA 244 CO 0.23 0.24 1.08 0.50 0.00 0.00 0.00 175.76 177.82 2ds1 s ARG 245 N -3.12 4.51 0.69 0.00 3.52 -1.26 -4.01 118.95 119.28 2ds1 s ARG 245 Ca 0.57 1.59 -0.11 0.00 -0.13 0.00 0.00 55.73 57.65 2ds1 s ARG 245 Cb -0.10 -3.40 0.01 0.00 -1.56 0.00 0.00 34.95 29.91 2ds1 s ARG 245 CO 0.17 -0.13 1.07 -0.65 -0.81 0.00 0.00 175.30 174.95 2ds1 s GLN 246 N 0.95 2.85 0.00 5.12 -1.52 0.11 -4.90 119.66 122.28 2ds1 s GLN 246 Ca 0.55 0.40 -0.18 0.00 -1.95 0.00 0.00 55.36 54.18 2ds1 s GLN 246 Cb -0.25 -2.05 -0.06 0.00 -0.22 0.00 0.00 33.01 30.43 2ds1 s GLN 246 CO 0.29 -1.00 0.51 0.34 -0.25 0.00 0.00 175.29 175.17 2ds1 s ASP 247 N -4.36 6.90 0.52 5.90 -1.08 -1.26 -4.87 116.67 118.43 2ds1 s ASP 247 Ca 0.58 1.07 0.28 0.00 -0.52 0.00 0.00 52.55 53.96 2ds1 s ASP 247 Cb -0.11 -2.31 1.45 0.00 -1.46 0.00 0.00 42.92 40.49 2ds1 s ASP 247 CO 0.51 0.22 2.07 -0.26 0.52 0.00 0.00 175.17 178.23 2ds1 h PHE 248 N 5.15 0.00 0.00 -5.34 -1.00 -1.97 -2.05 116.94 111.73 2ds1 h PHE 248 Ca -0.48 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.29 2ds1 h PHE 248 Cb 1.21 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.77 2ds1 h PHE 248 CO 0.67 0.11 -0.05 0.66 -1.61 0.00 0.00 178.31 178.10 2ds1 h SER 249 N 0.00 0.00 1.06 2.17 4.64 -1.95 -1.26 113.55 118.21 2ds1 h SER 249 Ca -0.00 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.16 2ds1 h SER 249 Cb 0.34 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 2ds1 h SER 249 CO 0.01 0.05 -1.00 0.50 -0.87 0.00 0.00 176.83 175.52 2ds1 h LYS 250 N 0.00 0.00 0.13 4.77 3.64 -1.79 -3.32 116.57 120.00 2ds1 h LYS 250 Ca -0.00 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.20 2ds1 h LYS 250 Cb 0.08 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 31.92 2ds1 h LYS 250 CO 0.01 0.49 -0.79 0.28 -2.27 0.00 0.00 179.45 177.17 2ds1 h VAL 251 N 0.00 1.51 -1.24 2.00 2.07 -1.12 -3.40 116.25 116.08 2ds1 h VAL 251 Ca -0.08 -2.50 -0.52 0.00 0.82 0.00 0.00 66.70 64.42 2ds1 h VAL 251 Cb 1.56 3.16 -0.42 0.00 -1.52 0.00 0.00 31.29 34.08 2ds1 h VAL 251 CO 0.07 0.71 -0.86 1.33 0.02 0.00 0.00 177.57 178.84 2ds1 n VAL 252 N -4.14 2.06 -2.10 2.57 0.24 -0.72 -4.98 118.33 111.25 2ds1 n VAL 252 Ca -0.13 -4.34 -0.33 0.00 -2.04 0.00 0.00 64.34 57.50 2ds1 n VAL 252 Cb 0.81 -0.72 0.01 0.00 -1.47 0.00 0.00 33.84 32.47 2ds1 n VAL 252 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2ds1 s PRO 253 N -3.48 3.32 -0.45 7.34 0.04 -1.25 -1.11 135.00 139.41 2ds1 s PRO 253 Ca 0.43 1.30 0.01 0.00 0.04 0.00 0.00 61.00 62.78 2ds1 s PRO 253 Cb 0.41 -2.03 0.47 0.00 0.04 0.00 0.00 34.50 33.39 2ds1 s PRO 253 CO -0.10 -0.82 1.88 -0.35 0.04 0.00 0.00 177.00 177.65 2ds1 n PRO 254 N -1.85 2.19 -1.72 0.56 -0.04 -1.26 -4.69 135.00 128.19 2ds1 n PRO 254 Ca 0.09 -2.57 -0.43 0.00 -0.04 0.00 0.00 63.50 60.55 2ds1 n PRO 254 Cb 0.52 -2.01 -0.02 0.00 -0.04 0.00 0.00 33.50 31.96 2ds1 n PRO 254 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2ds1 n LEU 255 N -0.69 3.89 -4.72 1.53 7.94 -0.27 -4.96 117.00 119.72 2ds1 n LEU 255 Ca 0.50 1.16 -0.29 0.00 -1.11 0.00 0.00 56.01 56.27 2ds1 n LEU 255 Cb 1.10 -1.53 0.19 0.00 0.53 0.00 0.00 43.42 43.71 2ds1 n LEU 255 CO 0.57 -0.13 0.69 1.51 -1.11 0.00 0.00 177.39 178.92 2ds1 s ASP 256 N 0.28 2.31 0.23 1.96 1.47 -1.26 -4.68 116.67 116.98 2ds1 s ASP 256 Ca 0.63 0.76 -0.06 0.00 1.18 0.00 0.00 52.55 55.06 2ds1 s ASP 256 Cb -0.55 -1.14 0.40 0.00 -0.34 0.00 0.00 42.92 41.29 2ds1 s ASP 256 CO 0.52 -3.28 1.72 -0.08 0.68 0.00 0.00 175.17 174.73 2ds1 h GLU 257 N -2.00 0.36 -0.44 2.11 4.57 -1.99 0.35 114.58 117.55 2ds1 h GLU 257 Ca -0.48 -0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 57.62 2ds1 h GLU 257 Cb 1.30 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 29.79 2ds1 h GLU 257 CO 0.47 0.24 0.05 -0.44 -1.18 0.00 0.00 179.01 178.15 2ds1 h ASP 258 N 0.37 0.72 -0.47 1.04 3.32 -1.97 -0.02 116.42 119.41 2ds1 h ASP 258 Ca 0.38 -0.27 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 2ds1 h ASP 258 Cb 0.57 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 2ds1 h ASP 258 CO -0.41 0.81 0.26 1.23 -1.72 0.00 0.00 179.24 179.42 2ds1 h GLY 259 N 0.60 0.70 1.36 2.75 0.00 -1.74 0.45 103.07 107.19 2ds1 h GLY 259 Ca 0.13 -0.31 -0.09 0.00 0.00 0.00 0.00 47.33 47.06 2ds1 h GLY 259 CO 0.01 0.30 -0.09 3.21 0.00 0.00 0.00 176.54 179.98 2ds1 h ARG 260 N 0.62 0.76 -0.49 4.80 3.08 -0.82 -0.07 114.38 122.26 2ds1 h ARG 260 Ca 0.17 -0.24 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 2ds1 h ARG 260 Cb 0.04 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 2ds1 h ARG 260 CO -0.03 0.83 0.17 1.03 -1.07 0.00 0.00 179.97 180.90 2ds1 h SER 261 N 0.69 0.69 -0.09 7.04 0.87 -0.60 -1.30 113.55 120.84 2ds1 h SER 261 Ca 0.12 -0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 60.48 2ds1 h SER 261 Cb 0.55 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 62.33 2ds1 h SER 261 CO 0.03 0.69 0.01 0.25 -0.53 0.00 0.00 176.83 177.28 2ds1 h LEU 262 N 0.65 0.16 -0.87 2.23 5.85 -0.55 -2.73 115.31 120.04 2ds1 h LEU 262 Ca 0.16 -0.29 0.05 0.00 0.84 0.00 0.00 57.88 58.64 2ds1 h LEU 262 Cb 0.23 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.16 2ds1 h LEU 262 CO -0.01 0.41 0.55 0.25 -0.34 0.00 0.00 178.44 179.30 2ds1 h LEU 263 N -0.10 0.87 -0.90 2.25 5.85 -0.94 -1.48 115.31 120.86 2ds1 h LEU 263 Ca 0.03 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.80 2ds1 h LEU 263 Cb 0.33 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.13 2ds1 h LEU 263 CO 0.00 0.57 0.57 -1.28 -0.34 0.00 0.00 178.44 177.97 2ds1 h SER 264 N 1.01 0.94 0.74 1.25 0.87 -1.15 -0.92 113.55 116.30 2ds1 h SER 264 Ca 0.37 -0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.84 2ds1 h SER 264 Cb 0.13 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 2ds1 h SER 264 CO -0.16 0.64 -0.45 1.56 -0.53 0.00 0.00 176.83 177.89 2ds1 h GLN 265 N 1.10 0.00 0.00 2.24 4.20 -1.04 -2.78 115.11 118.83 2ds1 h GLN 265 Ca 0.37 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.07 2ds1 h GLN 265 Cb 0.05 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.83 2ds1 h GLN 265 CO -0.13 0.45 -0.03 0.52 -0.67 0.00 0.00 178.83 178.96 2ds1 h MET 266 N 0.00 0.00 -0.39 1.46 2.86 -0.42 -1.93 114.93 116.51 2ds1 h MET 266 Ca -0.00 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2ds1 h MET 266 Cb 0.94 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.60 2ds1 h MET 266 CO 0.06 0.03 0.00 1.28 1.06 0.00 0.00 176.91 179.34 2ds1 n LEU 267 N -3.11 4.67 -4.77 1.22 4.32 -0.44 -3.87 117.00 115.02 2ds1 n LEU 267 Ca 0.03 -2.99 -0.40 0.00 -0.02 0.00 0.00 56.01 52.63 2ds1 n LEU 267 Cb 0.52 -0.61 -0.01 0.00 -1.62 0.00 0.00 43.42 41.70 2ds1 n LEU 267 CO 0.34 0.66 1.01 -1.00 -1.22 0.00 0.00 177.39 177.17 2ds1 s HIS 268 N -2.81 2.80 0.10 -1.77 3.76 -1.09 -4.94 115.29 111.34 2ds1 s HIS 268 Ca 0.47 1.36 -0.18 0.00 -0.15 0.00 0.00 55.06 56.57 2ds1 s HIS 268 Cb 0.37 -3.76 -0.06 0.00 1.11 0.00 0.00 32.58 30.25 2ds1 s HIS 268 CO 0.12 -2.27 1.57 1.88 -0.85 0.00 0.00 174.74 175.19 2ds1 h TYR 269 N 2.87 0.53 -2.96 1.40 0.05 -1.92 -3.42 116.97 113.52 2ds1 h TYR 269 Ca -0.50 -0.08 -0.57 0.00 0.05 0.00 0.00 58.73 57.64 2ds1 h TYR 269 Cb 1.24 -0.14 -0.04 0.00 1.01 0.00 0.00 36.73 38.80 2ds1 h TYR 269 CO 0.53 0.60 1.03 0.34 -1.05 0.00 0.00 178.16 179.62 2ds1 s ASP 270 N -5.93 6.56 0.51 3.88 -1.08 -1.26 -4.86 116.67 114.48 2ds1 s ASP 270 Ca -0.13 1.43 0.26 0.00 -0.52 0.00 0.00 52.55 53.59 2ds1 s ASP 270 Cb 0.08 -2.54 1.36 0.00 -1.46 0.00 0.00 42.92 40.37 2ds1 s ASP 270 CO 0.75 -1.13 1.91 -0.65 0.52 0.00 0.00 175.17 176.57 2ds1 h PRO 271 N 9.84 0.09 0.00 4.34 0.11 -1.96 0.16 132.00 144.59 2ds1 h PRO 271 Ca -0.30 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2ds1 h PRO 271 Cb 1.12 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2ds1 h PRO 271 CO 1.01 0.06 -0.02 -0.91 -0.21 0.00 0.00 178.00 177.94 2ds1 h ASN 272 N 0.10 0.00 0.42 -2.05 4.21 -1.96 -3.22 115.58 113.08 2ds1 h ASN 272 Ca 0.38 -0.00 -0.24 0.00 1.21 0.00 0.00 56.30 57.65 2ds1 h ASN 272 Cb 1.37 0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 38.53 2ds1 h ASN 272 CO -0.04 0.00 -1.78 0.29 -1.29 0.00 0.00 177.43 174.61 2ds1 n LYS 273 N -2.60 0.64 -1.68 0.81 5.02 0.43 -4.93 118.16 115.85 2ds1 n LYS 273 Ca 0.05 0.16 -0.45 0.00 -2.02 0.00 0.00 58.31 56.05 2ds1 n LYS 273 Cb 0.47 -1.71 -0.03 0.00 -0.02 0.00 0.00 35.03 33.74 2ds1 n LYS 273 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2ds1 n ARG 274 N -2.86 2.23 -1.77 1.97 0.63 -0.36 -4.90 116.66 111.60 2ds1 n ARG 274 Ca -0.17 0.80 -0.39 0.00 -0.92 0.00 0.00 57.85 57.16 2ds1 n ARG 274 Cb 0.96 -2.53 0.03 0.00 0.45 0.00 0.00 32.46 31.37 2ds1 n ARG 274 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 2ds1 s ILE 275 N 0.38 2.02 0.55 5.15 2.07 -0.73 -5.00 121.20 125.64 2ds1 s ILE 275 Ca 0.72 0.02 -0.06 0.00 -1.41 0.00 0.00 60.65 59.91 2ds1 s ILE 275 Cb -0.63 -3.01 -0.01 0.00 0.13 0.00 0.00 42.46 38.94 2ds1 s ILE 275 CO 0.44 0.00 0.87 -0.94 -1.91 0.00 0.00 174.94 173.40 2ds1 s SER 276 N -0.65 5.88 0.15 4.50 1.04 -1.26 -4.87 113.70 118.48 2ds1 s SER 276 Ca 0.65 0.85 -0.16 0.00 0.48 0.00 0.00 55.95 57.77 2ds1 s SER 276 Cb -0.43 -1.96 0.02 0.00 0.10 0.00 0.00 66.02 63.75 2ds1 s SER 276 CO 0.54 -0.88 1.81 0.00 0.98 0.00 0.00 173.24 175.69 2ds1 h ALA 277 N -0.05 0.50 -0.10 5.32 0.00 -1.94 -0.55 119.26 122.45 2ds1 h ALA 277 Ca -0.46 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.46 2ds1 h ALA 277 Cb 1.23 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 2ds1 h ALA 277 CO 0.61 -0.06 -0.07 -0.22 0.00 0.00 0.00 179.25 179.52 2ds1 h LYS 278 N 0.52 -0.07 -0.01 0.00 3.64 -1.92 -1.79 116.57 116.94 2ds1 h LYS 278 Ca 0.15 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 2ds1 h LYS 278 Cb -0.04 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 2ds1 h LYS 278 CO -0.04 -0.05 -0.24 0.00 -2.27 0.00 0.00 179.45 176.85 2ds1 h ALA 279 N 1.02 1.58 -0.39 5.00 0.00 -1.91 -2.46 119.26 122.10 2ds1 h ALA 279 Ca 0.06 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2ds1 h ALA 279 Cb 0.17 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2ds1 h ALA 279 CO -0.15 0.32 -0.03 0.00 0.00 0.00 0.00 179.25 179.39 2ds1 h ALA 280 N 1.74 1.22 0.00 0.00 0.00 -0.28 -2.69 119.26 119.25 2ds1 h ALA 280 Ca 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2ds1 h ALA 280 Cb 0.44 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2ds1 h ALA 280 CO 0.03 0.51 -0.08 -0.07 0.00 0.00 0.00 179.25 179.64 2ds1 h LEU 281 N 0.60 0.00 -0.85 0.00 3.38 -0.88 -1.86 115.31 115.69 2ds1 h LEU 281 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2ds1 h LEU 281 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2ds1 h LEU 281 CO 0.02 0.08 -0.03 0.00 0.09 0.00 0.00 178.44 178.61 2ds1 n ALA 282 N -2.39 2.63 -1.77 1.53 0.00 -1.02 -4.86 120.51 114.64 2ds1 n ALA 282 Ca -0.02 -0.42 -0.41 0.00 0.00 0.00 0.00 53.44 52.58 2ds1 n ALA 282 Cb 0.17 -1.19 -0.01 0.00 0.00 0.00 0.00 19.45 18.43 2ds1 n ALA 282 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2ds1 s HIS 283 N -2.05 2.81 0.39 0.00 5.04 -0.70 -4.88 115.29 115.88 2ds1 s HIS 283 Ca 0.37 1.30 0.31 0.00 -1.54 0.00 0.00 55.06 55.50 2ds1 s HIS 283 Cb 0.21 -3.84 1.67 0.00 0.04 0.00 0.00 32.58 30.66 2ds1 s HIS 283 CO 0.36 -2.41 1.92 -1.00 -2.34 0.00 0.00 174.74 171.28 2ds1 h PRO 284 N 3.11 0.00 -0.02 2.88 0.13 -1.92 -1.87 132.00 134.31 2ds1 h PRO 284 Ca -0.50 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.64 2ds1 h PRO 284 Cb 1.24 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 2ds1 h PRO 284 CO 0.64 0.00 0.02 0.35 -0.23 0.00 0.00 178.00 178.78 2ds1 h PHE 285 N 0.00 0.00 -0.20 1.56 3.57 -1.90 -1.30 116.94 118.68 2ds1 h PHE 285 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2ds1 h PHE 285 Cb 0.29 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.03 2ds1 h PHE 285 CO 0.00 0.00 0.00 1.19 -2.23 0.00 0.00 178.31 177.27 2ds1 n PHE 286 N -4.50 0.25 -0.29 0.41 3.72 -0.70 -4.43 117.46 111.92 2ds1 n PHE 286 Ca -0.02 -0.12 0.11 0.00 -0.05 0.00 0.00 57.45 57.36 2ds1 n PHE 286 Cb 0.11 0.00 0.25 0.00 -0.94 0.00 0.00 39.48 38.90 2ds1 n PHE 286 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 2ds1 h GLN 287 N 2.89 0.21 -0.54 -1.08 5.75 -1.37 -0.51 115.11 120.46 2ds1 h GLN 287 Ca 0.00 -0.01 -0.25 0.00 -0.15 0.00 0.00 58.65 58.24 2ds1 h GLN 287 Cb 0.63 -0.05 -0.15 0.00 1.07 0.00 0.00 27.48 28.98 2ds1 h GLN 287 CO 0.00 0.14 0.15 -0.40 -2.65 0.00 0.00 178.83 176.06 2ds1 n ASP 288 N -5.22 3.16 -4.77 -0.69 3.85 -1.26 -5.03 116.55 106.59 2ds1 n ASP 288 Ca 0.19 -3.60 -0.39 0.00 -0.71 0.00 0.00 54.79 50.27 2ds1 n ASP 288 Cb 0.61 -0.69 0.00 0.00 -1.35 0.00 0.00 41.12 39.70 2ds1 n ASP 288 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 2ds1 s VAL 289 N -3.19 2.52 0.30 2.12 0.11 -0.20 -5.02 120.40 117.03 2ds1 s VAL 289 Ca 0.48 0.46 0.06 0.00 -2.93 0.00 0.00 61.98 60.06 2ds1 s VAL 289 Cb 0.42 -3.27 -0.02 0.00 -1.53 0.00 0.00 36.38 31.98 2ds1 s VAL 289 CO 0.05 0.06 0.23 0.35 -3.33 0.00 0.00 175.10 172.45 2ds1 n THR 290 N -0.04 0.00 -3.50 5.04 -2.24 -1.26 -5.10 114.28 107.18 2ds1 n THR 290 Ca 0.05 -2.11 -0.27 0.00 -2.27 0.00 0.00 64.05 59.45 2ds1 n THR 290 Cb 0.44 1.01 -0.09 0.00 -2.10 0.00 0.00 70.33 69.58 2ds1 n THR 290 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2ds1 n LYS 291 N -0.59 1.55 -1.35 -0.78 4.81 -1.26 -4.44 118.16 116.11 2ds1 n LYS 291 Ca 0.05 -4.06 -0.31 0.00 -0.87 0.00 0.00 58.31 53.12 2ds1 n LYS 291 Cb 0.53 -1.95 0.09 0.00 0.02 0.00 0.00 35.03 33.72 2ds1 n LYS 291 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2ds1 s PRO 292 N -1.49 2.25 -0.22 1.64 0.04 -1.26 -4.95 135.00 131.01 2ds1 s PRO 292 Ca 0.33 1.02 -0.13 0.00 0.04 0.00 0.00 61.00 62.26 2ds1 s PRO 292 Cb 0.08 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.67 2ds1 s PRO 292 CO -0.11 -1.61 0.27 0.14 0.04 0.00 0.00 177.00 175.74 2ds1 s VAL 293 N -2.96 5.29 0.92 -0.36 -7.23 -1.26 -4.40 120.40 110.39 2ds1 s VAL 293 Ca 0.61 0.43 -0.12 0.00 -1.81 0.00 0.00 61.98 61.09 2ds1 s VAL 293 Cb -0.16 -3.61 0.14 0.00 0.56 0.00 0.00 36.38 33.31 2ds1 s VAL 293 CO 0.56 0.30 1.09 -2.16 -0.31 0.00 0.00 175.10 174.58 2ds1 s PRO 294 N 1.15 1.08 -0.86 4.82 0.04 -1.26 -5.00 135.00 134.98 2ds1 s PRO 294 Ca 0.13 0.85 -0.04 0.00 0.04 0.00 0.00 61.00 61.98 2ds1 s PRO 294 Cb -0.14 -1.79 0.22 0.00 0.04 0.00 0.00 34.50 32.83 2ds1 s PRO 294 CO 0.06 -2.37 0.76 -1.01 0.04 0.00 0.00 177.00 174.47 2ds1 s HIS 295 N -2.89 3.83 -0.03 0.56 3.76 -1.26 -5.00 115.29 114.26 2ds1 s HIS 295 Ca 0.64 -2.81 0.06 0.00 -0.15 0.00 0.00 55.06 52.81 2ds1 s HIS 295 Cb -0.19 -3.38 -0.01 0.00 1.11 0.00 0.00 32.58 30.11 2ds1 s HIS 295 CO 0.57 -0.82 -0.22 -0.48 -0.85 0.00 0.00 174.74 172.94 2ds1 s LEU 296 N -0.91 2.03 -0.32 0.89 0.05 -1.26 -5.09 118.68 114.06 2ds1 s LEU 296 Ca 0.25 -0.43 -0.10 0.00 0.05 0.00 0.00 54.13 53.89 2ds1 s LEU 296 Cb -0.11 -1.20 -0.01 0.00 -2.05 0.00 0.00 46.19 42.83 2ds1 s LEU 296 CO -0.09 0.25 0.17 -0.60 -0.55 0.00 0.00 176.35 175.53 2ds1 s ARG 297 N -0.32 3.33 0.00 1.48 6.06 -1.26 -5.07 118.95 123.16 2ds1 s ARG 297 Ca 0.03 -0.73 0.25 0.00 -2.50 0.00 0.00 55.73 52.78 2ds1 s ARG 297 Cb -0.11 -3.62 0.51 0.00 0.06 0.00 0.00 34.95 31.79 2ds1 s ARG 297 CO 0.01 -0.44 1.44 1.28 -2.50 0.00 0.00 175.30 175.09