#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r2s s ARG 4 N 0.00 4.37 0.24 4.33 0.52 -1.26 -5.03 118.95 122.12 1r2s s ARG 4 Ca 0.00 0.73 -0.31 0.00 -0.52 0.00 0.00 55.73 55.63 1r2s s ARG 4 Cb 0.00 -3.47 -0.11 0.00 0.52 0.00 0.00 34.95 31.88 1r2s s ARG 4 CO 0.00 0.02 1.62 0.21 0.02 0.00 0.00 175.30 177.17 1r2s s LYS 5 N 1.02 4.14 0.13 3.54 2.20 -1.26 -4.94 119.74 124.57 1r2s s LYS 5 Ca 0.33 2.54 -0.31 0.00 -0.36 0.00 0.00 55.97 58.17 1r2s s LYS 5 Cb -0.17 -3.06 -0.09 0.00 -1.51 0.00 0.00 37.83 33.00 1r2s s LYS 5 CO 0.15 -0.66 1.57 0.12 -0.36 0.00 0.00 175.35 176.17 1r2s s PHE 6 N 0.55 2.92 -0.17 4.03 5.36 -1.07 -4.86 117.98 124.74 1r2s s PHE 6 Ca 0.68 0.59 -0.00 0.00 -0.96 0.00 0.00 56.93 57.23 1r2s s PHE 6 Cb -0.48 -3.90 -0.00 0.00 -0.34 0.00 0.00 43.02 38.30 1r2s s PHE 6 CO 0.40 -3.39 -0.14 0.12 -1.46 0.00 0.00 175.22 170.75 1r2s s PHE 7 N 1.54 2.82 -0.20 10.12 5.36 -0.61 -0.01 117.98 136.99 1r2s s PHE 7 Ca 0.70 -1.04 -0.00 0.00 -0.96 0.00 0.00 56.93 55.63 1r2s s PHE 7 Cb -0.42 -1.92 0.05 0.00 -0.34 0.00 0.00 43.02 40.39 1r2s s PHE 7 CO 0.31 -0.49 -0.05 0.08 -1.46 0.00 0.00 175.22 173.61 1r2s s VAL 8 N 0.92 1.27 -0.11 3.12 1.01 0.12 -0.81 120.40 125.92 1r2s s VAL 8 Ca -0.03 -0.90 -0.03 0.00 0.00 0.00 0.00 61.98 61.03 1r2s s VAL 8 Cb -0.15 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 1r2s s VAL 8 CO -0.01 0.01 -0.01 -0.83 0.00 0.00 0.00 175.10 174.25 1r2s s GLY 9 N 1.54 1.80 -0.32 4.51 0.00 0.29 -1.34 107.32 113.80 1r2s s GLY 9 Ca -0.02 -0.81 -0.04 0.00 0.00 0.00 0.00 44.72 43.84 1r2s s GLY 9 CO -0.07 -0.38 0.05 -0.32 0.00 0.00 0.00 173.10 172.39 1r2s s GLY 10 N -0.39 1.79 -0.50 0.20 0.00 0.83 -0.12 107.32 109.13 1r2s s GLY 10 Ca 0.07 -1.71 -0.19 0.00 0.00 0.00 0.00 44.72 42.89 1r2s s GLY 10 CO 0.02 0.72 0.62 0.21 0.00 0.00 0.00 173.10 174.67 1r2s s ASN 11 N 1.35 6.23 0.30 1.64 2.47 0.48 -0.61 114.94 126.80 1r2s s ASN 11 Ca -0.03 -0.89 0.25 0.00 0.42 0.00 0.00 52.86 52.62 1r2s s ASN 11 Cb -0.19 -2.29 1.01 0.00 -1.45 0.00 0.00 41.25 38.33 1r2s s ASN 11 CO 0.01 -0.88 1.75 -0.50 -3.72 0.00 0.00 177.10 173.76 1r2s h TRP 12 N 8.98 0.00 0.00 0.43 6.55 -1.56 -3.41 115.95 126.94 1r2s h TRP 12 Ca -0.27 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.57 1r2s h TRP 12 Cb 1.10 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.40 1r2s h TRP 12 CO 0.75 0.00 0.00 1.63 -1.05 0.00 0.00 178.44 179.77 1r2s n LYS 13 N -2.37 0.00 -2.74 0.49 5.02 -1.26 -3.39 118.16 113.91 1r2s n LYS 13 Ca 0.02 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.89 1r2s n LYS 13 Cb 0.26 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.28 1r2s n LYS 13 CO 0.00 0.00 0.00 -0.12 -0.52 0.00 0.00 177.40 176.76 1r2s n MET 14 N 10.47 4.43 -3.88 1.97 0.00 -1.26 -3.97 117.12 124.88 1r2s n MET 14 Ca 0.00 -4.27 -0.12 0.00 0.00 0.00 0.00 57.70 53.31 1r2s n MET 14 Cb 0.00 -2.61 -0.13 0.00 0.00 0.00 0.00 33.22 30.48 1r2s n MET 14 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 175.97 175.17 1r2s s ASN 15 N -1.03 0.00 0.00 6.12 0.01 -1.22 -5.12 114.94 113.71 1r2s s ASN 15 Ca 0.35 -0.02 0.00 0.00 -0.71 0.00 0.00 52.86 52.48 1r2s s ASN 15 Cb 0.09 0.08 0.00 0.00 0.41 0.00 0.00 41.25 41.83 1r2s s ASN 15 CO 0.04 -0.07 0.00 0.61 -1.51 0.00 0.00 177.10 176.18 1r2s n GLY 16 N 2.79 2.61 3.63 0.66 0.00 -1.26 -4.71 105.19 108.93 1r2s n GLY 16 Ca -0.14 -1.77 -0.29 0.00 0.00 0.00 0.00 46.02 43.82 1r2s n GLY 16 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1r2s s ARG 17 N -3.86 1.99 0.47 1.61 1.81 -1.26 -5.00 118.95 114.71 1r2s s ARG 17 Ca 0.00 -2.18 0.18 0.00 -1.72 0.00 0.00 55.73 52.01 1r2s s ARG 17 Cb 0.00 -1.43 1.18 0.00 -0.45 0.00 0.00 34.95 34.26 1r2s s ARG 17 CO 0.00 -0.20 1.99 0.87 -0.68 0.00 0.00 175.30 177.28 1r2s h LYS 18 N 1.69 0.22 0.40 3.54 1.57 -1.99 -2.03 116.57 119.98 1r2s h LYS 18 Ca -0.43 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.32 1r2s h LYS 18 Cb 1.27 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1r2s h LYS 18 CO 0.76 0.15 -0.19 -0.22 -0.57 0.00 0.00 179.45 179.37 1r2s h LYS 19 N 0.23 -0.52 0.00 3.15 3.64 -2.00 -2.74 116.57 118.33 1r2s h LYS 19 Ca 0.26 0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.66 1r2s h LYS 19 Cb 0.73 0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.67 1r2s h LYS 19 CO -0.05 -0.33 -0.11 -2.95 -2.27 0.00 0.00 179.45 173.73 1r2s h ASN 20 N -1.14 0.00 0.79 4.20 -1.07 -1.96 -2.80 115.58 113.61 1r2s h ASN 20 Ca -0.06 0.00 -0.18 0.00 0.07 0.00 0.00 56.30 56.14 1r2s h ASN 20 Cb 0.43 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 36.66 1r2s h ASN 20 CO 0.09 0.11 -0.84 -0.07 0.07 0.00 0.00 177.43 176.79 1r2s h LEU 21 N 0.00 0.05 -1.21 6.14 3.38 -1.49 -2.43 115.31 119.75 1r2s h LEU 21 Ca -0.00 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 1r2s h LEU 21 Cb 0.70 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1r2s h LEU 21 CO 0.01 0.87 -0.37 1.23 0.09 0.00 0.00 178.44 180.27 1r2s h GLY 22 N 2.38 0.05 0.43 0.83 0.00 -1.21 -0.12 103.07 105.43 1r2s h GLY 22 Ca -0.02 -0.05 -0.06 0.00 0.00 0.00 0.00 47.33 47.21 1r2s h GLY 22 CO 0.11 0.04 -0.25 0.83 0.00 0.00 0.00 176.54 177.28 1r2s h GLU 23 N 0.04 0.16 -1.00 4.80 5.08 -1.53 -2.21 114.58 119.92 1r2s h GLU 23 Ca 0.00 -0.18 0.14 0.00 -1.00 0.00 0.00 59.36 58.32 1r2s h GLU 23 Cb 0.67 0.05 -0.09 0.00 0.50 0.00 0.00 28.75 29.88 1r2s h GLU 23 CO 0.05 0.93 0.63 1.25 -1.00 0.00 0.00 179.01 180.87 1r2s h LEU 24 N -0.53 0.89 -0.64 1.33 5.85 -1.29 -1.72 115.31 119.20 1r2s h LEU 24 Ca -0.03 0.06 -0.12 0.00 0.84 0.00 0.00 57.88 58.63 1r2s h LEU 24 Cb 1.02 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.92 1r2s h LEU 24 CO 0.05 0.44 -0.19 0.40 -0.34 0.00 0.00 178.44 178.80 1r2s h ILE 25 N 0.93 1.27 -0.65 4.05 2.04 -0.98 -2.31 117.51 121.86 1r2s h ILE 25 Ca 0.52 -1.32 -0.05 0.00 1.00 0.00 0.00 64.86 65.01 1r2s h ILE 25 Cb 0.59 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.78 1r2s h ILE 25 CO -0.29 0.45 0.22 0.74 0.00 0.00 0.00 178.15 179.27 1r2s h THR 26 N 0.76 1.24 -0.05 -0.27 2.02 -0.75 -0.01 112.91 115.85 1r2s h THR 26 Ca 0.11 -0.80 -0.00 0.00 0.77 0.00 0.00 66.41 66.49 1r2s h THR 26 Cb 0.72 0.50 -0.00 0.00 -1.74 0.00 0.00 68.15 67.63 1r2s h THR 26 CO 0.06 0.31 0.02 0.74 0.37 0.00 0.00 175.52 177.02 1r2s h THR 27 N 0.95 1.12 -0.60 3.16 2.02 -1.18 -2.92 112.91 115.47 1r2s h THR 27 Ca 0.22 -0.36 -0.03 0.00 0.77 0.00 0.00 66.41 67.00 1r2s h THR 27 Cb 0.24 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.90 1r2s h THR 27 CO -0.01 0.10 0.24 -0.07 0.37 0.00 0.00 175.52 176.15 1r2s h LEU 28 N -0.06 0.83 -1.88 2.58 3.38 -1.23 -2.79 115.31 116.14 1r2s h LEU 28 Ca 0.02 -0.17 0.10 0.00 0.09 0.00 0.00 57.88 57.92 1r2s h LEU 28 Cb 0.14 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1r2s h LEU 28 CO -0.00 0.77 0.31 0.78 0.09 0.00 0.00 178.44 180.39 1r2s h ASN 29 N 0.83 0.12 0.50 -0.43 4.21 -0.98 -1.97 115.58 117.86 1r2s h ASN 29 Ca 0.20 0.00 -0.24 0.00 1.21 0.00 0.00 56.30 57.47 1r2s h ASN 29 Cb 0.20 -0.02 0.00 0.00 -1.12 0.00 0.00 38.32 37.38 1r2s h ASN 29 CO -0.02 0.07 -1.06 0.00 -1.29 0.00 0.00 177.43 175.14 1r2s h ALA 30 N 1.78 0.28 -2.92 -0.83 0.00 -1.30 -3.47 119.26 112.80 1r2s h ALA 30 Ca 0.21 -0.78 -0.54 0.00 0.00 0.00 0.00 54.91 53.80 1r2s h ALA 30 Cb 0.65 -0.02 0.10 0.00 0.00 0.00 0.00 17.79 18.53 1r2s h ALA 30 CO -0.03 0.90 0.78 0.00 0.00 0.00 0.00 179.25 180.90 1r2s s ALA 31 N -3.00 3.59 -0.18 0.00 0.00 -0.74 -4.98 121.76 116.44 1r2s s ALA 31 Ca -0.05 1.55 -0.23 0.00 0.00 0.00 0.00 51.96 53.24 1r2s s ALA 31 Cb 0.08 -3.60 -0.02 0.00 0.00 0.00 0.00 23.12 19.58 1r2s s ALA 31 CO 0.87 -1.01 0.71 0.21 0.00 0.00 0.00 175.76 176.53 1r2s s LYS 32 N -1.88 4.26 -0.33 0.00 2.20 -1.26 -5.03 119.74 117.70 1r2s s LYS 32 Ca 0.54 0.78 -0.17 0.00 -0.36 0.00 0.00 55.97 56.75 1r2s s LYS 32 Cb -0.46 -3.57 -0.01 0.00 -1.51 0.00 0.00 37.83 32.28 1r2s s LYS 32 CO 0.61 -0.25 0.47 0.08 -0.36 0.00 0.00 175.35 175.90 1r2s s VAL 33 N 1.91 5.06 0.49 4.02 1.01 -1.26 -5.01 120.40 126.63 1r2s s VAL 33 Ca 0.33 0.41 -0.21 0.00 0.00 0.00 0.00 61.98 62.51 1r2s s VAL 33 Cb -0.16 -3.89 -0.10 0.00 0.00 0.00 0.00 36.38 32.22 1r2s s VAL 33 CO 0.12 -0.11 0.61 -2.65 0.00 0.00 0.00 175.10 173.06 1r2s n PRO 34 N 5.61 0.66 -0.12 2.72 -0.02 -1.26 -4.91 135.00 137.68 1r2s n PRO 34 Ca -0.06 0.25 -0.05 0.00 -2.02 0.00 0.00 63.50 61.62 1r2s n PRO 34 Cb 0.49 -1.68 0.01 0.00 -0.02 0.00 0.00 33.50 32.31 1r2s n PRO 34 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1r2s h ALA 35 N 0.66 0.19 -1.01 3.55 0.00 -2.01 -2.76 119.26 117.87 1r2s h ALA 35 Ca -0.43 0.15 -0.76 0.00 0.00 0.00 0.00 54.91 53.86 1r2s h ALA 35 Cb 1.39 0.39 -0.27 0.00 0.00 0.00 0.00 17.79 19.30 1r2s h ALA 35 CO 0.50 -0.51 1.04 -0.25 0.00 0.00 0.00 179.25 180.04 1r2s n ASP 36 N -5.35 7.52 -3.84 0.00 8.00 -1.26 -4.92 116.55 116.71 1r2s n ASP 36 Ca 0.02 -3.84 -0.18 0.00 0.71 0.00 0.00 54.79 51.51 1r2s n ASP 36 Cb 0.26 -1.06 -0.16 0.00 -0.02 0.00 0.00 41.12 40.14 1r2s n ASP 36 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1r2s s THR 37 N -5.07 0.28 -0.28 -3.53 2.01 -1.04 -2.60 115.64 105.40 1r2s s THR 37 Ca 0.53 0.03 -0.09 0.00 0.31 0.00 0.00 61.69 62.46 1r2s s THR 37 Cb 0.44 -0.35 -0.03 0.00 0.01 0.00 0.00 72.50 72.57 1r2s s THR 37 CO -0.39 0.17 0.14 -0.70 -0.69 0.00 0.00 174.62 173.15 1r2s s GLU 38 N 1.01 3.71 -0.18 4.92 2.12 0.98 -4.85 118.70 126.42 1r2s s GLU 38 Ca -0.10 -0.46 -0.03 0.00 0.36 0.00 0.00 54.97 54.74 1r2s s GLU 38 Cb -0.14 -3.52 -0.01 0.00 0.26 0.00 0.00 34.13 30.71 1r2s s GLU 38 CO -0.01 -0.24 -0.07 0.08 -0.54 0.00 0.00 175.26 174.48 1r2s s VAL 39 N 1.68 3.36 -0.05 3.70 1.01 -1.26 -0.70 120.40 128.13 1r2s s VAL 39 Ca 0.06 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.55 1r2s s VAL 39 Cb -0.16 -2.48 0.00 0.00 0.00 0.00 0.00 36.38 33.75 1r2s s VAL 39 CO 0.07 0.47 -0.13 -0.69 0.00 0.00 0.00 175.10 174.83 1r2s s VAL 40 N 0.88 1.13 -0.04 2.92 1.01 -0.45 -1.23 120.40 124.63 1r2s s VAL 40 Ca -0.02 -0.53 0.04 0.00 0.00 0.00 0.00 61.98 61.48 1r2s s VAL 40 Cb -0.15 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.20 1r2s s VAL 40 CO 0.01 0.34 -0.15 0.00 0.00 0.00 0.00 175.10 175.30 1r2s s ALA 42 N -0.74 2.77 0.59 0.00 0.00 0.22 -0.66 121.76 123.94 1r2s s ALA 42 Ca 0.12 -2.68 -0.12 0.00 0.00 0.00 0.00 51.96 49.28 1r2s s ALA 42 Cb -0.11 -1.98 -0.05 0.00 0.00 0.00 0.00 23.12 20.99 1r2s s ALA 42 CO 0.01 -1.84 1.00 -1.25 0.00 0.00 0.00 175.76 173.68 1r2s s PRO 43 N 0.54 3.67 0.67 0.00 0.04 -1.25 -1.56 135.00 137.11 1r2s s PRO 43 Ca 0.14 0.76 -0.17 0.00 0.04 0.00 0.00 61.00 61.77 1r2s s PRO 43 Cb -0.22 -2.11 -0.05 0.00 0.04 0.00 0.00 34.50 32.16 1r2s s PRO 43 CO -0.07 -0.48 0.59 -2.30 0.04 0.00 0.00 177.00 174.78 1r2s n PRO 44 N -2.46 0.42 -0.30 0.56 -0.02 -1.25 -4.56 135.00 127.39 1r2s n PRO 44 Ca 0.06 0.18 -0.01 0.00 -2.02 0.00 0.00 63.50 61.70 1r2s n PRO 44 Cb 0.54 -1.84 0.11 0.00 -0.02 0.00 0.00 33.50 32.29 1r2s n PRO 44 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1r2s h THR 45 N -0.13 1.10 -0.30 3.45 2.02 -1.95 -0.54 112.91 116.57 1r2s h THR 45 Ca -0.46 -0.34 0.09 0.00 0.77 0.00 0.00 66.41 66.46 1r2s h THR 45 Cb 1.36 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 1r2s h THR 45 CO 0.45 0.18 0.43 0.00 0.37 0.00 0.00 175.52 176.95 1r2s h ALA 46 N 1.36 1.90 -0.20 6.16 0.00 -2.02 -2.88 119.26 123.58 1r2s h ALA 46 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1r2s h ALA 46 Cb 0.05 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1r2s h ALA 46 CO -0.13 -0.58 0.00 0.66 0.00 0.00 0.00 179.25 179.20 1r2s n TYR 47 N -3.46 0.26 -0.14 0.00 4.01 -0.22 -4.66 117.16 112.95 1r2s n TYR 47 Ca 0.05 -0.32 -0.05 0.00 -0.16 0.00 0.00 57.90 57.42 1r2s n TYR 47 Cb 0.57 -0.02 0.02 0.00 -0.31 0.00 0.00 39.34 39.60 1r2s n TYR 47 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 1r2s h ILE 48 N 1.81 0.36 0.22 -0.72 2.04 -1.46 0.49 117.51 120.24 1r2s h ILE 48 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1r2s h ILE 48 Cb 0.60 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1r2s h ILE 48 CO 0.00 0.00 -0.21 -0.78 0.00 0.00 0.00 178.15 177.16 1r2s h ASP 49 N -0.12 -0.57 -0.85 1.72 3.58 -1.84 -2.11 116.42 116.24 1r2s h ASP 49 Ca 0.22 0.05 0.09 0.00 0.42 0.00 0.00 57.03 57.81 1r2s h ASP 49 Cb 0.46 0.20 -0.07 0.00 1.72 0.00 0.00 39.33 41.63 1r2s h ASP 49 CO -0.54 -0.32 0.50 0.15 -2.88 0.00 0.00 179.24 176.15 1r2s h PHE 50 N -0.46 0.91 -0.34 0.28 3.57 -1.78 -2.66 116.94 116.46 1r2s h PHE 50 Ca -0.00 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 1r2s h PHE 50 Cb 0.43 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 1r2s h PHE 50 CO -0.15 0.39 0.12 0.00 -2.23 0.00 0.00 178.31 176.43 1r2s h ALA 51 N 1.45 0.45 -0.15 2.41 0.00 -0.64 -2.91 119.26 119.87 1r2s h ALA 51 Ca 0.40 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 1r2s h ALA 51 Cb 0.34 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1r2s h ALA 51 CO -0.23 0.07 -0.24 -0.09 0.00 0.00 0.00 179.25 178.76 1r2s h ARG 52 N 0.40 0.27 -0.14 0.00 9.65 -1.06 -1.25 114.38 122.26 1r2s h ARG 52 Ca 0.11 -0.09 -0.15 0.00 -1.10 0.00 0.00 59.98 58.76 1r2s h ARG 52 Cb 0.23 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.78 1r2s h ARG 52 CO -0.01 0.50 -0.54 1.96 2.80 0.00 0.00 179.97 184.69 1r2s h GLN 53 N 0.25 0.40 0.00 0.20 4.20 -1.40 -3.31 115.11 115.45 1r2s h GLN 53 Ca 0.04 -0.25 -0.17 0.00 0.06 0.00 0.00 58.65 58.34 1r2s h GLN 53 Cb 0.56 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.34 1r2s h GLN 53 CO 0.04 0.84 -1.59 1.63 -0.67 0.00 0.00 178.83 179.08 1r2s n LYS 54 N -3.94 0.63 -2.79 1.46 4.76 -1.11 -4.93 118.16 112.25 1r2s n LYS 54 Ca -0.03 0.14 -0.41 0.00 -2.87 0.00 0.00 58.31 55.15 1r2s n LYS 54 Cb 0.59 -1.74 -0.05 0.00 -1.84 0.00 0.00 35.03 31.99 1r2s n LYS 54 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1r2s s LEU 55 N -5.58 4.51 0.27 -0.35 1.43 -0.48 -4.94 118.68 113.53 1r2s s LEU 55 Ca -0.04 1.73 -0.29 0.00 -1.03 0.00 0.00 54.13 54.50 1r2s s LEU 55 Cb 0.09 -3.51 -0.14 0.00 0.03 0.00 0.00 46.19 42.66 1r2s s LEU 55 CO 0.82 -0.02 1.14 -0.67 0.23 0.00 0.00 176.35 177.86 1r2s n ASP 56 N 2.63 1.75 0.28 2.29 -0.08 -1.26 -4.87 116.55 117.28 1r2s n ASP 56 Ca 0.01 1.17 0.15 0.00 -1.51 0.00 0.00 54.79 54.60 1r2s n ASP 56 Cb 0.49 -1.33 0.78 0.00 2.34 0.00 0.00 41.12 43.41 1r2s n ASP 56 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1r2s h PRO 57 N 2.67 0.00 0.00 -0.67 0.11 -1.95 -1.52 132.00 130.64 1r2s h PRO 57 Ca -0.42 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.69 1r2s h PRO 57 Cb 1.32 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.43 1r2s h PRO 57 CO 0.65 0.00 -0.01 1.57 -0.21 0.00 0.00 178.00 180.00 1r2s h LYS 58 N 0.00 0.00 -5.76 1.05 2.10 -1.99 -3.42 116.57 108.55 1r2s h LYS 58 Ca 0.00 0.00 -0.67 0.00 -2.00 0.00 0.00 60.65 57.98 1r2s h LYS 58 Cb 0.42 0.00 -0.20 0.00 -0.90 0.00 0.00 32.23 31.55 1r2s h LYS 58 CO 0.00 0.01 -0.68 0.42 -2.00 0.00 0.00 179.45 177.20 1r2s s ILE 59 N -3.89 3.79 0.38 0.07 1.01 -0.57 -4.69 121.20 117.30 1r2s s ILE 59 Ca -0.01 -0.42 -0.07 0.00 0.00 0.00 0.00 60.65 60.14 1r2s s ILE 59 Cb 0.11 -2.60 -0.05 0.00 0.01 0.00 0.00 42.46 39.93 1r2s s ILE 59 CO 0.49 0.56 0.69 0.00 0.00 0.00 0.00 174.94 176.68 1r2s s ALA 60 N -0.31 3.47 -0.08 9.38 0.00 -0.36 -4.85 121.76 129.00 1r2s s ALA 60 Ca 0.05 -0.42 0.02 0.00 0.00 0.00 0.00 51.96 51.61 1r2s s ALA 60 Cb -0.12 -2.51 -0.02 0.00 0.00 0.00 0.00 23.12 20.46 1r2s s ALA 60 CO 0.02 0.01 -0.14 0.08 0.00 0.00 0.00 175.76 175.74 1r2s s VAL 61 N -2.34 3.05 0.15 0.00 1.01 -1.26 -1.02 120.40 120.00 1r2s s VAL 61 Ca 0.47 -0.70 0.11 0.00 0.00 0.00 0.00 61.98 61.87 1r2s s VAL 61 Cb -0.10 -2.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 1r2s s VAL 61 CO 0.34 0.56 -0.26 0.00 0.00 0.00 0.00 175.10 175.74 1r2s s ALA 62 N -0.26 2.43 0.44 5.51 0.00 0.16 -1.90 121.76 128.14 1r2s s ALA 62 Ca 0.02 -1.52 -0.09 0.00 0.00 0.00 0.00 51.96 50.36 1r2s s ALA 62 Cb -0.13 -0.36 -0.06 0.00 0.00 0.00 0.00 23.12 22.57 1r2s s ALA 62 CO 0.03 0.51 0.79 0.00 0.00 0.00 0.00 175.76 177.09 1r2s s ALA 63 N -1.25 3.34 -1.57 0.00 0.00 -0.82 -3.95 121.76 117.51 1r2s s ALA 63 Ca 0.16 -0.26 0.27 0.00 0.00 0.00 0.00 51.96 52.13 1r2s s ALA 63 Cb -0.09 -2.71 0.88 0.00 0.00 0.00 0.00 23.12 21.20 1r2s s ALA 63 CO 0.07 -0.14 1.65 1.04 0.00 0.00 0.00 175.76 178.37 1r2s n GLN 64 N -1.64 0.63 -3.61 0.00 6.02 -1.26 -1.05 117.38 116.47 1r2s n GLN 64 Ca 0.02 -0.32 -0.00 0.00 -0.01 0.00 0.00 57.00 56.69 1r2s n GLN 64 Cb 0.54 -1.49 -0.01 0.00 1.02 0.00 0.00 30.24 30.30 1r2s n GLN 64 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1r2s s ASN 65 N -2.59 -0.02 0.31 1.08 2.47 -1.23 -4.59 114.94 110.37 1r2s s ASN 65 Ca 0.23 -0.01 -0.19 0.00 0.42 0.00 0.00 52.86 53.31 1r2s s ASN 65 Cb 0.19 0.03 0.04 0.00 -1.45 0.00 0.00 41.25 40.07 1r2s s ASN 65 CO 0.53 -0.05 0.80 0.00 -3.72 0.00 0.00 177.10 174.66 1r2s n TYR 67 N -0.51 -2.83 -0.02 0.00 9.36 -0.30 -4.97 117.16 117.89 1r2s n TYR 67 Ca -0.06 -0.54 0.03 0.00 3.32 0.00 0.00 57.90 60.65 1r2s n TYR 67 Cb 0.60 -0.14 0.07 0.00 -0.63 0.00 0.00 39.34 39.23 1r2s n TYR 67 CO 0.00 0.00 0.00 0.36 0.22 0.00 0.00 176.86 177.44 1r2s n LYS 68 N -1.32 2.28 -4.25 2.98 2.85 -1.26 -4.58 118.16 114.85 1r2s n LYS 68 Ca 0.04 -1.59 -0.14 0.00 -1.05 0.00 0.00 58.31 55.57 1r2s n LYS 68 Cb 0.15 -1.14 -0.10 0.00 -0.65 0.00 0.00 35.03 33.29 1r2s n LYS 68 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 177.40 177.49 1r2s s VAL 69 N -0.89 0.62 -0.02 0.58 -7.23 -1.26 -4.82 120.40 107.38 1r2s s VAL 69 Ca 0.11 -1.98 0.11 0.00 -1.81 0.00 0.00 61.98 58.41 1r2s s VAL 69 Cb 0.06 -2.23 -0.08 0.00 0.56 0.00 0.00 36.38 34.69 1r2s s VAL 69 CO 0.08 -0.37 1.33 0.00 -0.31 0.00 0.00 175.10 175.84 1r2s h THR 70 N 2.63 1.27 -3.13 5.32 1.03 -1.99 -3.44 112.91 114.60 1r2s h THR 70 Ca -0.37 -2.82 -0.02 0.00 -0.01 0.00 0.00 66.41 63.19 1r2s h THR 70 Cb 1.21 2.62 -0.11 0.00 -1.07 0.00 0.00 68.15 70.80 1r2s h THR 70 CO 0.62 0.73 0.12 0.20 -0.01 0.00 0.00 175.52 177.18 1r2s s ASN 71 N -6.56 -0.43 0.00 0.00 0.01 -1.26 -4.77 114.94 101.93 1r2s s ASN 71 Ca 0.02 -0.18 0.00 0.00 -0.71 0.00 0.00 52.86 51.99 1r2s s ASN 71 Cb 0.09 0.58 0.00 0.00 0.41 0.00 0.00 41.25 42.32 1r2s s ASN 71 CO 0.78 -0.98 0.00 0.61 -1.51 0.00 0.00 177.10 176.01 1r2s n GLY 72 N -0.34 -0.20 2.83 0.66 0.00 -1.26 -5.01 105.19 101.87 1r2s n GLY 72 Ca -0.15 -1.63 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 1r2s n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r2s n ALA 73 N -0.56 5.40 -3.30 4.61 0.00 -1.26 -4.70 120.51 120.70 1r2s n ALA 73 Ca 0.00 -4.17 -0.25 0.00 0.00 0.00 0.00 53.44 49.01 1r2s n ALA 73 Cb 0.00 -3.17 -0.08 0.00 0.00 0.00 0.00 19.45 16.20 1r2s n ALA 73 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1r2s n PHE 74 N 4.63 0.17 -1.73 0.00 3.72 -1.26 -5.11 117.46 117.88 1r2s n PHE 74 Ca 0.44 -3.61 -0.42 0.00 -0.05 0.00 0.00 57.45 53.81 1r2s n PHE 74 Cb 0.37 -0.24 -0.02 0.00 -0.94 0.00 0.00 39.48 38.65 1r2s n PHE 74 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1r2s n THR 75 N 1.71 0.91 -0.34 4.37 -2.24 -1.26 -1.83 114.28 115.59 1r2s n THR 75 Ca 0.24 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1r2s n THR 75 Cb 0.49 -1.91 0.00 0.00 -2.10 0.00 0.00 70.33 66.81 1r2s n THR 75 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r2s n GLY 76 N 2.35 0.82 3.91 3.38 0.00 -1.26 -5.07 105.19 109.32 1r2s n GLY 76 Ca 0.10 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.92 1r2s n GLY 76 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r2s s GLU 77 N -0.58 2.74 0.06 1.61 0.41 -0.76 -5.13 118.70 117.05 1r2s s GLU 77 Ca 0.00 -1.32 0.02 0.00 -0.41 0.00 0.00 54.97 53.26 1r2s s GLU 77 Cb 0.00 -2.55 -0.03 0.00 -1.78 0.00 0.00 34.13 29.77 1r2s s GLU 77 CO 0.00 -0.07 -0.08 0.96 -0.49 0.00 0.00 175.26 175.58 1r2s s ILE 78 N -2.35 0.63 0.25 -1.63 -4.36 -1.26 -5.03 121.20 107.45 1r2s s ILE 78 Ca 0.47 -1.39 0.07 0.00 -0.26 0.00 0.00 60.65 59.53 1r2s s ILE 78 Cb -0.06 -1.01 -0.03 0.00 1.25 0.00 0.00 42.46 42.60 1r2s s ILE 78 CO 0.29 -0.54 0.23 -0.94 0.24 0.00 0.00 174.94 174.22 1r2s s SER 79 N -2.10 5.71 0.27 4.36 1.04 -1.26 -1.15 113.70 120.57 1r2s s SER 79 Ca -0.02 -0.17 -0.00 0.00 0.48 0.00 0.00 55.95 56.24 1r2s s SER 79 Cb -0.05 -1.51 0.53 0.00 0.10 0.00 0.00 66.02 65.09 1r2s s SER 79 CO -0.01 -0.04 1.81 -0.65 0.98 0.00 0.00 173.24 175.32 1r2s h PRO 80 N 1.43 0.81 -0.57 4.02 0.11 -1.84 -0.74 132.00 135.22 1r2s h PRO 80 Ca -0.49 -0.05 0.14 0.00 0.11 0.00 0.00 66.00 65.71 1r2s h PRO 80 Cb 1.24 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.13 1r2s h PRO 80 CO 0.61 0.54 0.40 0.78 -0.21 0.00 0.00 178.00 180.12 1r2s h GLY 81 N 0.84 0.23 1.56 -0.55 0.00 -1.92 -0.01 103.07 103.21 1r2s h GLY 81 Ca 0.47 -0.06 -0.23 0.00 0.00 0.00 0.00 47.33 47.51 1r2s h GLY 81 CO -0.29 0.03 -0.97 -0.33 0.00 0.00 0.00 176.54 174.97 1r2s h MET 82 N 0.14 0.39 0.04 4.80 2.86 -1.48 -2.30 114.93 119.38 1r2s h MET 82 Ca 0.27 -0.44 -0.00 0.00 -2.06 0.00 0.00 59.70 57.47 1r2s h MET 82 Cb 0.89 0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.68 1r2s h MET 82 CO -0.04 1.12 -0.02 0.82 1.06 0.00 0.00 176.91 179.85 1r2s h ILE 83 N 0.21 1.20 -0.64 -1.22 2.04 -0.91 -2.65 117.51 115.54 1r2s h ILE 83 Ca -0.09 -0.78 0.09 0.00 1.00 0.00 0.00 64.86 65.08 1r2s h ILE 83 Cb 1.62 1.73 -0.07 0.00 -0.74 0.00 0.00 36.82 39.36 1r2s h ILE 83 CO 0.17 0.20 0.28 0.50 0.00 0.00 0.00 178.15 179.29 1r2s h LYS 84 N -0.39 0.47 -0.53 2.37 3.64 -1.12 -2.00 116.57 119.01 1r2s h LYS 84 Ca -0.01 -0.03 0.12 0.00 -1.27 0.00 0.00 60.65 59.46 1r2s h LYS 84 Cb 0.36 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.05 1r2s h LYS 84 CO 0.01 0.31 0.36 0.22 -2.27 0.00 0.00 179.45 178.08 1r2s h ASP 85 N 0.49 0.18 0.17 4.20 3.58 -1.25 -0.82 116.42 122.96 1r2s h ASP 85 Ca 0.32 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.77 1r2s h ASP 85 Cb 0.36 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.38 1r2s h ASP 85 CO -0.28 0.10 -0.09 0.00 -2.88 0.00 0.00 179.24 176.09 1r2s n GLY 87 N 1.22 0.82 3.88 0.00 0.00 -0.31 -4.72 105.19 106.08 1r2s n GLY 87 Ca 0.17 -0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 1r2s n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r2s s ALA 88 N -2.00 3.37 0.00 4.61 0.00 -0.91 -4.75 121.76 122.09 1r2s s ALA 88 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 51.96 51.72 1r2s s ALA 88 Cb 0.00 -2.66 0.00 0.00 0.00 0.00 0.00 23.12 20.46 1r2s s ALA 88 CO 0.00 0.01 0.00 0.25 0.00 0.00 0.00 175.76 176.02 1r2s n THR 89 N -1.29 0.00 -4.45 0.00 -2.24 -0.80 -4.03 114.28 101.47 1r2s n THR 89 Ca 0.02 -0.28 -0.23 0.00 -2.27 0.00 0.00 64.05 61.29 1r2s n THR 89 Cb 0.54 0.85 -0.10 0.00 -2.10 0.00 0.00 70.33 69.52 1r2s n THR 89 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1r2s s TRP 90 N -0.90 2.19 0.00 4.78 0.52 -1.17 0.12 118.94 124.47 1r2s s TRP 90 Ca 0.00 -0.41 -0.01 0.00 0.02 0.00 0.00 56.10 55.71 1r2s s TRP 90 Cb 0.00 -1.01 -0.00 0.00 -1.15 0.00 0.00 33.47 31.31 1r2s s TRP 90 CO 0.00 0.62 0.01 0.54 0.02 0.00 0.00 176.95 178.14 1r2s s VAL 91 N -2.62 0.02 -0.27 4.03 0.11 0.21 -1.94 120.40 119.95 1r2s s VAL 91 Ca 0.29 -0.21 -0.18 0.00 -2.93 0.00 0.00 61.98 58.95 1r2s s VAL 91 Cb -0.03 -0.09 -0.02 0.00 -1.53 0.00 0.00 36.38 34.71 1r2s s VAL 91 CO 0.14 -0.11 0.54 -0.69 -3.33 0.00 0.00 175.10 171.65 1r2s s VAL 92 N -0.33 5.04 0.06 2.04 1.01 -0.21 -0.89 120.40 127.13 1r2s s VAL 92 Ca -0.04 0.89 0.08 0.00 0.00 0.00 0.00 61.98 62.91 1r2s s VAL 92 Cb -0.02 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 1r2s s VAL 92 CO -0.00 0.04 -0.22 -0.76 0.00 0.00 0.00 175.10 174.16 1r2s s LEU 93 N 2.37 2.46 -1.11 3.92 1.43 -0.22 -3.53 118.68 124.00 1r2s s LEU 93 Ca 0.22 -0.53 0.00 0.00 -1.03 0.00 0.00 54.13 52.79 1r2s s LEU 93 Cb -0.16 -1.42 0.00 0.00 0.03 0.00 0.00 46.19 44.65 1r2s s LEU 93 CO 0.09 0.24 0.00 0.61 0.23 0.00 0.00 176.35 177.52 1r2s n GLY 94 N 1.44 1.04 3.55 -3.19 0.00 -1.26 -1.74 105.19 105.03 1r2s n GLY 94 Ca -0.17 -0.53 -0.40 0.00 0.00 0.00 0.00 46.02 44.93 1r2s n GLY 94 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1r2s n HIS 95 N -2.86 0.35 -0.26 1.61 -0.00 -1.26 -4.30 115.22 108.50 1r2s n HIS 95 Ca -0.11 0.50 0.18 0.00 0.46 0.00 0.00 57.72 58.75 1r2s n HIS 95 Cb 0.38 -2.10 0.48 0.00 -0.12 0.00 0.00 29.99 28.64 1r2s n HIS 95 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1r2s h SER 96 N 0.81 0.47 -0.16 0.26 4.64 -1.95 -1.03 113.55 116.59 1r2s h SER 96 Ca -0.45 0.05 -0.13 0.00 -0.47 0.00 0.00 61.79 60.79 1r2s h SER 96 Cb 1.37 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.41 1r2s h SER 96 CO 0.52 0.19 -0.33 -0.33 -0.87 0.00 0.00 176.83 176.01 1r2s h GLU 97 N 0.47 0.66 -0.22 4.77 5.08 -1.97 0.24 114.58 123.60 1r2s h GLU 97 Ca 0.48 -0.31 -0.18 0.00 -1.00 0.00 0.00 59.36 58.35 1r2s h GLU 97 Cb 1.11 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.35 1r2s h GLU 97 CO -0.20 0.90 -0.59 0.00 -1.00 0.00 0.00 179.01 178.12 1r2s h ARG 98 N 0.56 0.74 -0.02 2.33 2.47 -1.62 -1.74 114.38 117.09 1r2s h ARG 98 Ca 0.06 -0.49 -0.00 0.00 -1.26 0.00 0.00 59.98 58.29 1r2s h ARG 98 Cb 0.83 0.07 -0.00 0.00 -1.65 0.00 0.00 29.97 29.22 1r2s h ARG 98 CO 0.07 1.12 0.00 0.00 0.56 0.00 0.00 179.97 181.72 1r2s h ARG 99 N 0.55 0.03 0.00 0.04 3.08 -0.92 -0.72 114.38 116.44 1r2s h ARG 99 Ca 0.00 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.00 1r2s h ARG 99 Cb 1.18 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.22 1r2s h ARG 99 CO 0.12 0.26 -1.78 0.72 -1.07 0.00 0.00 179.97 178.22 1r2s n HIS 100 N -4.96 0.00 -0.08 3.04 8.25 0.81 -2.58 115.22 119.71 1r2s n HIS 100 Ca -0.07 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.17 1r2s n HIS 100 Cb 0.14 -0.43 -0.12 0.00 1.12 0.00 0.00 29.99 30.70 1r2s n HIS 100 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1r2s n VAL 101 N -2.14 1.58 0.81 1.59 0.31 -0.68 -4.53 118.33 115.27 1r2s n VAL 101 Ca -0.06 -0.16 0.11 0.00 -0.01 0.00 0.00 64.34 64.21 1r2s n VAL 101 Cb 0.51 -1.98 0.11 0.00 -0.91 0.00 0.00 33.84 31.57 1r2s n VAL 101 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1r2s n PHE 102 N -4.24 0.07 -3.63 3.52 3.72 -1.08 -5.00 117.46 110.82 1r2s n PHE 102 Ca -0.33 -0.04 -0.24 0.00 -0.05 0.00 0.00 57.45 56.79 1r2s n PHE 102 Cb 0.76 -0.00 0.07 0.00 -0.94 0.00 0.00 39.48 39.38 1r2s n PHE 102 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1r2s n GLY 103 N 1.24 -0.53 3.71 1.37 0.00 -0.64 -4.95 105.19 105.38 1r2s n GLY 103 Ca 0.13 0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.98 1r2s n GLY 103 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r2s s GLU 104 N -6.31 4.35 0.53 1.61 2.02 -0.37 -4.98 118.70 115.56 1r2s s GLU 104 Ca 0.57 1.91 -0.11 0.00 0.02 0.00 0.00 54.97 57.36 1r2s s GLU 104 Cb -0.25 -3.38 -0.05 0.00 0.10 0.00 0.00 34.13 30.54 1r2s s GLU 104 CO 0.74 -0.40 0.92 -1.54 0.02 0.00 0.00 175.26 175.00 1r2s s SER 105 N 1.30 6.36 0.15 -0.19 1.04 -1.26 -4.52 113.70 116.57 1r2s s SER 105 Ca 0.62 1.28 -0.18 0.00 0.48 0.00 0.00 55.95 58.15 1r2s s SER 105 Cb -0.32 -2.40 0.05 0.00 0.10 0.00 0.00 66.02 63.45 1r2s s SER 105 CO 0.28 -0.67 1.70 0.44 0.98 0.00 0.00 173.24 175.97 1r2s h ASP 106 N 0.29 -0.16 -0.55 7.02 3.32 -1.99 0.45 116.42 124.81 1r2s h ASP 106 Ca -0.46 0.08 0.11 0.00 0.02 0.00 0.00 57.03 56.78 1r2s h ASP 106 Cb 1.19 0.14 -0.09 0.00 0.22 0.00 0.00 39.33 40.79 1r2s h ASP 106 CO 0.62 -0.04 -0.01 -0.08 -1.72 0.00 0.00 179.24 178.01 1r2s h GLU 107 N 0.08 0.10 -0.51 3.56 4.81 -1.97 -1.10 114.58 119.55 1r2s h GLU 107 Ca 0.15 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.29 1r2s h GLU 107 Cb 0.21 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1r2s h GLU 107 CO -0.27 0.07 -0.02 1.25 -0.73 0.00 0.00 179.01 179.31 1r2s h LEU 108 N 0.11 0.84 -0.60 1.64 5.85 -1.67 -2.40 115.31 119.08 1r2s h LEU 108 Ca 0.28 -0.22 -0.07 0.00 0.84 0.00 0.00 57.88 58.71 1r2s h LEU 108 Cb 0.44 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 1r2s h LEU 108 CO -0.47 0.92 0.10 0.40 -0.34 0.00 0.00 178.44 179.05 1r2s h ILE 109 N 0.80 1.26 -0.77 4.05 2.04 -0.32 -1.75 117.51 122.82 1r2s h ILE 109 Ca 0.15 -0.99 -0.01 0.00 1.00 0.00 0.00 64.86 65.01 1r2s h ILE 109 Cb 0.51 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.29 1r2s h ILE 109 CO 0.03 0.37 0.45 1.23 0.00 0.00 0.00 178.15 180.23 1r2s h GLY 110 N 0.90 1.13 1.25 5.37 0.00 -1.05 0.48 103.07 111.15 1r2s h GLY 110 Ca 0.18 -0.48 -0.07 0.00 0.00 0.00 0.00 47.33 46.96 1r2s h GLY 110 CO 0.01 0.46 0.06 1.46 0.00 0.00 0.00 176.54 178.53 1r2s h GLN 111 N 1.06 0.91 -0.64 4.80 4.20 -1.20 -1.63 115.11 122.61 1r2s h GLN 111 Ca 0.27 -0.24 -0.09 0.00 0.06 0.00 0.00 58.65 58.66 1r2s h GLN 111 Cb -0.02 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.63 1r2s h GLN 111 CO -0.05 0.87 0.04 0.87 -0.67 0.00 0.00 178.83 179.89 1r2s h LYS 112 N 0.86 1.10 0.05 1.46 1.57 -0.81 -2.11 116.57 118.68 1r2s h LYS 112 Ca 0.17 -0.33 -0.00 0.00 -1.87 0.00 0.00 60.65 58.62 1r2s h LYS 112 Cb 0.43 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1r2s h LYS 112 CO 0.01 1.04 -0.03 0.28 -0.57 0.00 0.00 179.45 180.19 1r2s h VAL 113 N 1.01 0.95 -0.64 0.50 2.07 -0.50 -1.77 116.25 117.86 1r2s h VAL 113 Ca 0.19 -0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.65 1r2s h VAL 113 Cb 0.52 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 1r2s h VAL 113 CO 0.03 0.00 0.20 0.00 0.02 0.00 0.00 177.57 177.81 1r2s h ALA 114 N 0.87 1.14 -0.17 1.67 0.00 -1.26 -2.30 119.26 119.21 1r2s h ALA 114 Ca -0.01 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 1r2s h ALA 114 Cb 0.06 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1r2s h ALA 114 CO 0.01 0.59 -0.30 1.25 0.00 0.00 0.00 179.25 180.81 1r2s h HIS 115 N 0.94 0.63 -0.68 0.00 6.17 -1.22 -1.90 115.15 119.10 1r2s h HIS 115 Ca 0.21 -0.22 -0.02 0.00 0.71 0.00 0.00 60.37 61.05 1r2s h HIS 115 Cb 0.27 -0.12 -0.03 0.00 2.52 0.00 0.00 27.41 30.05 1r2s h HIS 115 CO 0.02 0.93 0.34 0.00 0.71 0.00 0.00 177.93 179.94 1r2s h ALA 116 N 0.58 1.33 -0.08 5.26 0.00 -1.24 -2.44 119.26 122.68 1r2s h ALA 116 Ca 0.01 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1r2s h ALA 116 Cb 0.88 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1r2s h ALA 116 CO 0.07 0.53 -0.08 -0.07 0.00 0.00 0.00 179.25 179.70 1r2s h LEU 117 N 0.95 0.20 -2.04 0.00 3.38 -1.42 -2.24 115.31 114.14 1r2s h LEU 117 Ca 0.24 -0.49 0.07 0.00 0.09 0.00 0.00 57.88 57.78 1r2s h LEU 117 Cb 0.07 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1r2s h LEU 117 CO -0.03 0.65 0.36 -1.28 0.09 0.00 0.00 178.44 178.23 1r2s h SER 118 N -0.25 0.00 -0.16 -0.43 0.87 -1.20 -1.27 113.55 111.11 1r2s h SER 118 Ca 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1r2s h SER 118 Cb 0.60 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 1r2s h SER 118 CO 0.02 0.00 0.00 -0.62 -0.53 0.00 0.00 176.83 175.70 1r2s n GLU 119 N -3.44 2.12 -0.11 2.24 -0.58 -0.93 -4.94 120.64 115.00 1r2s n GLU 119 Ca 0.03 -1.66 0.00 0.00 -0.42 0.00 0.00 57.16 55.11 1r2s n GLU 119 Cb 0.48 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.89 1r2s n GLU 119 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1r2s n GLY 120 N 1.31 0.65 3.85 0.62 0.00 -0.48 -4.94 105.19 106.21 1r2s n GLY 120 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1r2s n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r2s s LEU 121 N 0.00 3.79 0.31 0.99 1.43 -0.86 -5.03 118.68 119.31 1r2s s LEU 121 Ca 0.00 1.40 -0.16 0.00 -1.03 0.00 0.00 54.13 54.33 1r2s s LEU 121 Cb 0.00 -4.29 -0.09 0.00 0.03 0.00 0.00 46.19 41.84 1r2s s LEU 121 CO 0.00 -0.45 0.75 -0.83 0.23 0.00 0.00 176.35 176.05 1r2s s GLY 122 N -2.89 2.39 -0.11 -3.19 0.00 0.12 -4.38 107.32 99.26 1r2s s GLY 122 Ca 0.56 0.09 0.04 0.00 0.00 0.00 0.00 44.72 45.41 1r2s s GLY 122 CO 0.27 0.33 -0.23 0.14 0.00 0.00 0.00 173.10 173.62 1r2s s VAL 123 N -1.91 2.01 -0.37 1.40 1.01 -0.51 -0.62 120.40 121.40 1r2s s VAL 123 Ca 0.53 -0.98 -0.11 0.00 0.00 0.00 0.00 61.98 61.41 1r2s s VAL 123 Cb -0.11 -1.75 0.02 0.00 0.00 0.00 0.00 36.38 34.54 1r2s s VAL 123 CO 0.18 0.55 0.21 -0.63 0.00 0.00 0.00 175.10 175.41 1r2s s ILE 124 N 0.49 4.66 -0.30 2.22 1.01 -0.07 -1.37 121.20 127.84 1r2s s ILE 124 Ca -0.16 -0.80 -0.09 0.00 0.00 0.00 0.00 60.65 59.60 1r2s s ILE 124 Cb -0.17 -3.59 -0.01 0.00 0.01 0.00 0.00 42.46 38.70 1r2s s ILE 124 CO 0.06 -0.22 0.14 0.00 0.00 0.00 0.00 174.94 174.91 1r2s s ALA 125 N 1.57 3.23 -0.02 9.38 0.00 0.58 -1.06 121.76 135.45 1r2s s ALA 125 Ca 0.03 -1.38 -0.16 0.00 0.00 0.00 0.00 51.96 50.45 1r2s s ALA 125 Cb -0.19 -2.32 -0.06 0.00 0.00 0.00 0.00 23.12 20.55 1r2s s ALA 125 CO 0.07 -0.88 0.43 0.00 0.00 0.00 0.00 175.76 175.38 1r2s s ILE 127 N -0.79 0.30 0.00 0.00 -4.36 -0.35 -4.64 121.20 111.35 1r2s s ILE 127 Ca 0.24 -1.98 0.00 0.00 -0.26 0.00 0.00 60.65 58.66 1r2s s ILE 127 Cb -0.17 -2.37 0.00 0.00 1.25 0.00 0.00 42.46 41.17 1r2s s ILE 127 CO 0.13 -0.18 0.00 0.61 0.24 0.00 0.00 174.94 175.74 1r2s n GLY 128 N -0.28 3.74 3.78 6.27 0.00 -1.26 0.00 105.19 117.44 1r2s n GLY 128 Ca -0.02 -1.13 -0.31 0.00 0.00 0.00 0.00 46.02 44.57 1r2s n GLY 128 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1r2s s GLU 129 N -2.48 2.95 0.66 1.61 1.03 -1.25 -4.82 118.70 116.41 1r2s s GLU 129 Ca 0.00 -0.62 -0.02 0.00 0.03 0.00 0.00 54.97 54.35 1r2s s GLU 129 Cb 0.00 -2.77 0.08 0.00 -0.80 0.00 0.00 34.13 30.63 1r2s s GLU 129 CO 0.00 0.59 0.93 -1.59 -1.33 0.00 0.00 175.26 173.87 1r2s s LYS 130 N -2.19 2.10 0.09 -4.83 -2.85 -1.26 -2.14 119.74 108.67 1r2s s LYS 130 Ca 0.27 -0.70 -0.18 0.00 -1.00 0.00 0.00 55.97 54.36 1r2s s LYS 130 Cb -0.12 -2.32 -0.07 0.00 -2.06 0.00 0.00 37.83 33.26 1r2s s LYS 130 CO 0.20 -1.16 1.53 1.25 0.10 0.00 0.00 175.35 177.26 1r2s h LEU 131 N -0.38 0.47 -0.90 2.77 5.85 -1.84 -1.22 115.31 120.05 1r2s h LEU 131 Ca -0.41 -0.31 0.17 0.00 0.84 0.00 0.00 57.88 58.17 1r2s h LEU 131 Cb 1.29 -0.13 -0.10 0.00 0.37 0.00 0.00 40.66 42.09 1r2s h LEU 131 CO 0.50 0.66 0.48 -2.24 -0.34 0.00 0.00 178.44 177.51 1r2s h ASP 132 N 0.26 0.57 -0.04 1.25 3.04 -1.96 -0.00 116.42 119.54 1r2s h ASP 132 Ca 0.08 0.10 -0.22 0.00 -3.24 0.00 0.00 57.03 53.75 1r2s h ASP 132 Cb 0.42 0.01 0.01 0.00 -1.04 0.00 0.00 39.33 38.74 1r2s h ASP 132 CO 0.01 0.20 -0.80 -0.33 -2.04 0.00 0.00 179.24 176.29 1r2s h GLU 133 N 0.63 0.70 -0.28 4.15 5.08 -1.78 -2.75 114.58 120.33 1r2s h GLU 133 Ca 0.51 -0.59 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1r2s h GLU 133 Cb 0.80 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 1r2s h GLU 133 CO -0.40 1.20 0.06 -0.09 -1.00 0.00 0.00 179.01 178.78 1r2s h ARG 134 N 0.47 0.45 0.00 2.33 2.43 -0.76 -2.40 114.38 116.90 1r2s h ARG 134 Ca -0.06 -0.11 -0.01 0.00 -0.81 0.00 0.00 59.98 58.99 1r2s h ARG 134 Cb 1.42 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.91 1r2s h ARG 134 CO 0.16 0.55 -0.07 0.93 -1.51 0.00 0.00 179.97 180.03 1r2s h GLU 135 N 0.27 0.00 0.00 0.20 5.08 -1.02 -0.66 114.58 118.46 1r2s h GLU 135 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1r2s h GLU 135 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1r2s h GLU 135 CO 0.00 0.07 0.00 0.00 -1.00 0.00 0.00 179.01 178.08 1r2s n ALA 136 N -2.30 2.36 -0.83 3.43 0.00 -1.04 -4.93 120.51 117.20 1r2s n ALA 136 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1r2s n ALA 136 Cb 0.17 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.16 1r2s n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r2s n GLY 137 N 1.31 0.50 1.16 0.00 0.00 -0.26 -4.99 105.19 102.92 1r2s n GLY 137 Ca 0.10 -0.78 -0.04 0.00 0.00 0.00 0.00 46.02 45.30 1r2s n GLY 137 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1r2s n ILE 138 N -2.83 2.55 -0.12 -0.61 -5.35 -0.91 -4.75 119.36 107.35 1r2s n ILE 138 Ca 0.00 -2.72 -0.06 0.00 -0.27 0.00 0.00 62.75 59.70 1r2s n ILE 138 Cb 0.00 -0.32 0.01 0.00 -1.74 0.00 0.00 39.64 37.59 1r2s n ILE 138 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1r2s h THR 139 N 1.03 0.37 -0.11 7.28 2.02 -1.86 -1.96 112.91 119.67 1r2s h THR 139 Ca 0.22 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.43 1r2s h THR 139 Cb 1.66 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 68.41 1r2s h THR 139 CO 0.39 0.00 -0.08 -0.08 0.37 0.00 0.00 175.52 176.12 1r2s h GLU 140 N -0.15 -0.08 -0.38 6.66 4.81 -1.96 -0.31 114.58 123.16 1r2s h GLU 140 Ca 0.19 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 1r2s h GLU 140 Cb 0.45 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 1r2s h GLU 140 CO -0.49 -0.06 0.24 0.87 -0.73 0.00 0.00 179.01 178.84 1r2s h LYS 141 N -0.09 0.51 -0.06 1.92 1.57 -1.87 -1.62 116.57 116.94 1r2s h LYS 141 Ca 0.07 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1r2s h LYS 141 Cb 0.19 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 1r2s h LYS 141 CO -0.16 0.36 -0.02 0.28 -0.57 0.00 0.00 179.45 179.34 1r2s h VAL 142 N 0.51 1.30 -0.42 0.50 2.07 -1.07 -1.99 116.25 117.15 1r2s h VAL 142 Ca 0.14 -0.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.69 1r2s h VAL 142 Cb -0.03 1.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 1r2s h VAL 142 CO -0.03 0.26 0.14 -0.37 0.02 0.00 0.00 177.57 177.59 1r2s h VAL 143 N -0.24 1.21 -0.80 2.57 -1.51 -1.08 -2.39 116.25 114.02 1r2s h VAL 143 Ca 0.01 -0.70 0.01 0.00 -1.23 0.00 0.00 66.70 64.79 1r2s h VAL 143 Cb 0.42 0.88 -0.04 0.00 -2.13 0.00 0.00 31.29 30.42 1r2s h VAL 143 CO 0.01 0.25 0.52 -0.26 -1.23 0.00 0.00 177.57 176.86 1r2s h PHE 144 N 0.53 1.02 -0.74 5.19 0.04 -1.32 -0.82 116.94 120.83 1r2s h PHE 144 Ca 0.14 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.89 1r2s h PHE 144 Cb 0.25 -0.34 -0.03 0.00 2.20 0.00 0.00 35.95 38.02 1r2s h PHE 144 CO 0.01 0.65 0.33 1.49 -0.60 0.00 0.00 178.31 180.19 1r2s h GLU 145 N 1.09 1.08 -0.09 1.51 4.57 -1.32 0.13 114.58 121.55 1r2s h GLU 145 Ca 0.29 -0.17 -0.00 0.00 -1.18 0.00 0.00 59.36 58.31 1r2s h GLU 145 Cb -0.11 -0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 28.28 1r2s h GLU 145 CO -0.06 0.85 0.06 1.96 -1.18 0.00 0.00 179.01 180.64 1r2s h GLN 146 N 1.07 0.13 -0.04 1.92 4.20 -0.85 -2.98 115.11 118.55 1r2s h GLN 146 Ca 0.25 -0.01 -0.12 0.00 0.06 0.00 0.00 58.65 58.84 1r2s h GLN 146 Cb 0.15 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1r2s h GLN 146 CO -0.03 0.12 -0.52 1.79 -0.67 0.00 0.00 178.83 179.52 1r2s h THR 147 N 0.10 1.37 -0.34 -0.54 1.35 -0.58 -2.84 112.91 111.43 1r2s h THR 147 Ca 0.03 -1.79 0.03 0.00 -0.55 0.00 0.00 66.41 64.14 1r2s h THR 147 Cb 0.02 1.92 -0.03 0.00 -1.73 0.00 0.00 68.15 68.33 1r2s h THR 147 CO -0.01 0.52 0.16 0.50 -0.25 0.00 0.00 175.52 176.44 1r2s h LYS 148 N 0.09 0.33 -0.92 4.72 3.64 -0.62 0.40 116.57 124.21 1r2s h LYS 148 Ca 0.00 -0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.44 1r2s h LYS 148 Cb 0.95 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 32.63 1r2s h LYS 148 CO 0.07 0.22 0.60 0.28 -2.27 0.00 0.00 179.45 178.35 1r2s h VAL 149 N 0.34 1.03 0.31 2.00 2.07 -1.37 0.16 116.25 120.79 1r2s h VAL 149 Ca 0.15 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1r2s h VAL 149 Cb 0.07 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 29.78 1r2s h VAL 149 CO -0.11 0.18 -0.15 0.40 0.02 0.00 0.00 177.57 177.91 1r2s h ILE 150 N 1.00 0.57 -0.88 4.57 2.04 -1.17 -3.31 117.51 120.33 1r2s h ILE 150 Ca 0.41 -0.74 0.21 0.00 1.00 0.00 0.00 64.86 65.74 1r2s h ILE 150 Cb 0.28 0.88 -0.12 0.00 -0.74 0.00 0.00 36.82 37.12 1r2s h ILE 150 CO -0.17 0.12 0.38 0.00 0.00 0.00 0.00 178.15 178.49 1r2s h ALA 151 N -0.49 1.39 0.00 1.87 0.00 0.02 0.47 119.26 122.52 1r2s h ALA 151 Ca -0.04 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1r2s h ALA 151 Cb 0.52 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1r2s h ALA 151 CO 0.07 -0.32 0.00 -0.25 0.00 0.00 0.00 179.25 178.75 1r2s n ASP 152 N -5.04 0.00 0.00 0.00 9.92 0.54 -1.98 116.55 120.00 1r2s n ASP 152 Ca 0.21 0.40 0.00 0.00 -0.53 0.00 0.00 54.79 54.87 1r2s n ASP 152 Cb 0.62 -0.41 0.00 0.00 -0.64 0.00 0.00 41.12 40.70 1r2s n ASP 152 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1r2s n ASN 153 N -1.41 0.79 -4.72 -2.24 3.02 0.13 -4.99 115.26 105.84 1r2s n ASN 153 Ca 0.00 -0.99 -0.35 0.00 -0.03 0.00 0.00 54.58 53.21 1r2s n ASN 153 Cb 0.01 0.02 -0.08 0.00 -0.61 0.00 0.00 39.78 39.11 1r2s n ASN 153 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1r2s s VAL 154 N -0.02 5.39 -0.22 2.41 1.01 -0.84 -4.18 120.40 123.96 1r2s s VAL 154 Ca 0.00 0.22 -0.06 0.00 0.00 0.00 0.00 61.98 62.13 1r2s s VAL 154 Cb 0.00 -3.49 -0.19 0.00 0.00 0.00 0.00 36.38 32.71 1r2s s VAL 154 CO 0.00 0.42 -0.04 1.17 0.00 0.00 0.00 175.10 176.65 1r2s n LYS 155 N 3.66 0.66 -3.87 2.72 4.81 -1.26 -4.91 118.16 119.97 1r2s n LYS 155 Ca -0.15 0.25 -0.30 0.00 -0.87 0.00 0.00 58.31 57.24 1r2s n LYS 155 Cb 0.52 -1.59 -0.15 0.00 0.02 0.00 0.00 35.03 33.83 1r2s n LYS 155 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1r2s s ASP 156 N -6.90 4.13 0.00 3.14 2.15 -1.26 -5.01 116.67 112.92 1r2s s ASP 156 Ca -0.32 -1.62 0.16 0.00 0.43 0.00 0.00 52.55 51.20 1r2s s ASP 156 Cb 0.09 -1.15 0.76 0.00 -0.30 0.00 0.00 42.92 42.33 1r2s s ASP 156 CO 0.62 -0.35 1.48 0.79 -0.17 0.00 0.00 175.17 177.54 1r2s n TRP 157 N 4.65 0.00 0.36 -5.34 7.02 -1.26 -3.44 117.44 119.43 1r2s n TRP 157 Ca -0.03 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.59 1r2s n TRP 157 Cb 0.43 -0.36 0.56 0.00 -2.42 0.00 0.00 31.31 29.52 1r2s n TRP 157 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1r2s h SER 158 N 0.00 0.00 -0.23 -0.99 4.64 -1.98 -2.76 113.55 112.23 1r2s h SER 158 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1r2s h SER 158 Cb 0.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1r2s h SER 158 CO 0.00 0.00 -0.00 0.29 -0.87 0.00 0.00 176.83 176.25 1r2s n LYS 159 N -2.61 2.61 -5.18 4.77 5.02 -1.22 -4.98 118.16 116.57 1r2s n LYS 159 Ca 0.02 -2.84 -0.32 0.00 -2.02 0.00 0.00 58.31 53.15 1r2s n LYS 159 Cb 0.28 -1.80 -0.16 0.00 -0.02 0.00 0.00 35.03 33.33 1r2s n LYS 159 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1r2s s VAL 160 N -2.87 2.21 -0.09 -0.18 1.01 -1.04 -1.43 120.40 118.00 1r2s s VAL 160 Ca 0.41 -0.99 0.04 0.00 0.00 0.00 0.00 61.98 61.44 1r2s s VAL 160 Cb 0.34 -1.84 0.00 0.00 0.00 0.00 0.00 36.38 34.89 1r2s s VAL 160 CO 0.07 0.56 -0.22 -0.69 0.00 0.00 0.00 175.10 174.83 1r2s s VAL 161 N 0.11 1.88 -0.13 2.92 1.01 -0.47 -4.49 120.40 121.22 1r2s s VAL 161 Ca -0.11 -0.92 -0.16 0.00 0.00 0.00 0.00 61.98 60.79 1r2s s VAL 161 Cb -0.16 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 1r2s s VAL 161 CO 0.06 0.52 0.40 -0.76 0.00 0.00 0.00 175.10 175.32 1r2s s LEU 162 N 0.37 4.26 -0.19 3.92 1.43 -0.79 -0.31 118.68 127.37 1r2s s LEU 162 Ca -0.17 0.69 -0.03 0.00 -1.03 0.00 0.00 54.13 53.58 1r2s s LEU 162 Cb -0.17 -2.56 -0.01 0.00 0.03 0.00 0.00 46.19 43.48 1r2s s LEU 162 CO 0.08 0.05 -0.07 0.00 0.23 0.00 0.00 176.35 176.64 1r2s s ALA 163 N 0.54 2.77 -0.22 4.21 0.00 -0.56 -0.67 121.76 127.82 1r2s s ALA 163 Ca 0.22 -1.07 -0.18 0.00 0.00 0.00 0.00 51.96 50.93 1r2s s ALA 163 Cb -0.14 -1.56 -0.03 0.00 0.00 0.00 0.00 23.12 21.39 1r2s s ALA 163 CO 0.08 -0.20 0.52 -0.47 0.00 0.00 0.00 175.76 175.68 1r2s s TYR 164 N 1.09 3.33 -0.29 0.00 5.04 -0.09 -1.21 117.35 125.22 1r2s s TYR 164 Ca 0.01 0.72 -0.05 0.00 -2.44 0.00 0.00 57.07 55.31 1r2s s TYR 164 Cb -0.15 -2.70 0.02 0.00 0.35 0.00 0.00 41.96 39.49 1r2s s TYR 164 CO -0.01 -0.18 0.04 -1.21 -1.34 0.00 0.00 175.55 172.86 1r2s s GLU 165 N 1.92 2.97 -1.35 4.97 2.02 0.10 -0.89 118.70 128.44 1r2s s GLU 165 Ca 0.23 -0.93 -0.16 0.00 0.02 0.00 0.00 54.97 54.13 1r2s s GLU 165 Cb -0.15 -3.28 0.07 0.00 0.10 0.00 0.00 34.13 30.87 1r2s s GLU 165 CO 0.09 -0.46 1.91 -0.35 0.02 0.00 0.00 175.26 176.47 1r2s n PRO 166 N 4.80 3.10 -0.07 0.39 -0.04 -1.26 -3.82 135.00 138.10 1r2s n PRO 166 Ca -0.15 -3.07 0.16 0.00 -0.04 0.00 0.00 63.50 60.40 1r2s n PRO 166 Cb 0.47 -3.37 0.57 0.00 -0.04 0.00 0.00 33.50 31.13 1r2s n PRO 166 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1r2s h VAL 167 N 4.87 0.81 0.00 0.52 2.07 -1.84 0.16 116.25 122.84 1r2s h VAL 167 Ca 0.48 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.91 1r2s h VAL 167 Cb 0.78 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 1r2s h VAL 167 CO 1.61 0.05 0.00 4.11 0.02 0.00 0.00 177.57 183.36 1r2s h TRP 168 N 0.26 0.00 -0.36 1.57 5.08 -1.69 -2.31 115.95 118.51 1r2s h TRP 168 Ca 0.29 0.00 -0.25 0.00 1.08 0.00 0.00 58.89 60.01 1r2s h TRP 168 Cb 0.78 0.00 -0.19 0.00 -3.00 0.00 0.00 29.16 26.75 1r2s h TRP 168 CO -0.00 0.00 -0.57 0.00 -1.28 0.00 0.00 178.44 176.59 1r2s n ALA 169 N -1.99 4.33 -4.03 0.11 0.00 0.56 -4.71 120.51 114.79 1r2s n ALA 169 Ca -0.02 -3.50 -0.31 0.00 0.00 0.00 0.00 53.44 49.61 1r2s n ALA 169 Cb 0.07 -0.40 -0.16 0.00 0.00 0.00 0.00 19.45 18.96 1r2s n ALA 169 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1r2s s ILE 170 N -3.83 1.80 -1.46 0.00 1.01 -0.87 -4.71 121.20 113.13 1r2s s ILE 170 Ca 0.44 -1.09 -0.08 0.00 0.00 0.00 0.00 60.65 59.92 1r2s s ILE 170 Cb 0.39 -1.83 0.02 0.00 0.01 0.00 0.00 42.46 41.06 1r2s s ILE 170 CO -0.02 0.21 0.88 0.61 0.00 0.00 0.00 174.94 176.62 1r2s n GLY 171 N 4.63 -0.53 0.00 6.18 0.00 -1.26 -4.87 105.19 109.35 1r2s n GLY 171 Ca -0.16 0.19 0.03 0.00 0.00 0.00 0.00 46.02 46.08 1r2s n GLY 171 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1r2s n THR 172 N -4.69 0.01 -2.78 2.61 -1.04 -1.26 -5.00 114.28 102.13 1r2s n THR 172 Ca -0.03 -0.16 -0.09 0.00 -2.04 0.00 0.00 64.05 61.73 1r2s n THR 172 Cb 0.58 0.31 0.04 0.00 -1.82 0.00 0.00 70.33 69.43 1r2s n THR 172 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1r2s n GLY 173 N 2.13 0.18 2.61 3.41 0.00 -1.26 -5.05 105.19 107.21 1r2s n GLY 173 Ca -0.02 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.55 1r2s n GLY 173 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r2s s LYS 174 N -5.03 0.73 0.36 1.61 1.02 -1.26 -5.15 119.74 112.02 1r2s s LYS 174 Ca 0.11 -1.30 -0.27 0.00 0.02 0.00 0.00 55.97 54.54 1r2s s LYS 174 Cb -0.05 -0.95 -0.09 0.00 -0.52 0.00 0.00 37.83 36.22 1r2s s LYS 174 CO 0.32 -1.26 1.17 0.95 -0.92 0.00 0.00 175.35 175.61 1r2s s THR 175 N 0.94 3.17 0.10 2.17 -4.23 -1.26 -4.33 115.64 112.20 1r2s s THR 175 Ca 0.23 1.05 -0.25 0.00 -1.18 0.00 0.00 61.69 61.54 1r2s s THR 175 Cb -0.11 -3.62 -0.07 0.00 1.34 0.00 0.00 72.50 70.05 1r2s s THR 175 CO -0.06 0.15 0.77 0.00 -0.54 0.00 0.00 174.62 174.94 1r2s s ALA 176 N -1.33 3.41 0.51 3.99 0.00 -1.26 -5.07 121.76 122.02 1r2s s ALA 176 Ca 0.53 0.31 -0.15 0.00 0.00 0.00 0.00 51.96 52.65 1r2s s ALA 176 Cb -0.32 -2.97 -0.07 0.00 0.00 0.00 0.00 23.12 19.75 1r2s s ALA 176 CO 0.41 0.17 0.97 0.95 0.00 0.00 0.00 175.76 178.26 1r2s s THR 177 N -0.55 4.57 0.29 0.00 -4.23 -1.26 -4.94 115.64 109.52 1r2s s THR 177 Ca 0.37 1.13 0.03 0.00 -1.18 0.00 0.00 61.69 62.04 1r2s s THR 177 Cb -0.22 -3.73 0.28 0.00 1.34 0.00 0.00 72.50 70.18 1r2s s THR 177 CO 0.24 -0.71 1.70 -0.65 -0.54 0.00 0.00 174.62 174.66 1r2s h PRO 178 N 0.86 0.38 -0.92 3.99 0.11 -1.98 -1.03 132.00 133.42 1r2s h PRO 178 Ca -0.47 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.66 1r2s h PRO 178 Cb 1.19 -0.09 -0.06 0.00 0.11 0.00 0.00 31.00 32.15 1r2s h PRO 178 CO 0.62 0.25 0.59 1.96 -0.21 0.00 0.00 178.00 181.21 1r2s h GLN 179 N 0.40 1.09 -0.51 1.05 1.08 -1.97 -0.13 115.11 116.12 1r2s h GLN 179 Ca 0.55 -0.07 -0.12 0.00 -1.45 0.00 0.00 58.65 57.56 1r2s h GLN 179 Cb 1.03 -0.25 -0.02 0.00 -0.05 0.00 0.00 27.48 28.20 1r2s h GLN 179 CO -0.53 0.72 -0.15 1.96 -0.95 0.00 0.00 178.83 179.89 1r2s h GLN 180 N 1.13 0.99 0.28 1.46 4.20 -1.59 0.08 115.11 121.66 1r2s h GLN 180 Ca 0.37 -0.38 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 1r2s h GLN 180 Cb 0.05 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 1r2s h GLN 180 CO -0.13 1.06 -0.18 0.00 -0.67 0.00 0.00 178.83 178.91 1r2s h ALA 181 N 0.94 -0.43 -0.79 3.87 0.00 -0.95 -3.04 119.26 118.86 1r2s h ALA 181 Ca 0.13 -0.08 0.13 0.00 0.00 0.00 0.00 54.91 55.09 1r2s h ALA 181 Cb 0.71 0.22 -0.09 0.00 0.00 0.00 0.00 17.79 18.64 1r2s h ALA 181 CO 0.05 -0.75 0.38 0.37 0.00 0.00 0.00 179.25 179.30 1r2s h GLN 182 N -0.44 0.54 -0.76 0.00 5.75 -0.74 -0.20 115.11 119.26 1r2s h GLN 182 Ca -0.03 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.44 1r2s h GLN 182 Cb 0.37 -0.12 -0.04 0.00 1.07 0.00 0.00 27.48 28.76 1r2s h GLN 182 CO 0.02 0.36 0.48 1.49 -2.65 0.00 0.00 178.83 178.53 1r2s h GLU 183 N 0.56 1.02 0.12 1.69 4.81 -0.89 -1.21 114.58 120.68 1r2s h GLU 183 Ca 0.43 -0.08 -0.29 0.00 -0.13 0.00 0.00 59.36 59.29 1r2s h GLU 183 Cb 0.59 -0.22 0.03 0.00 0.63 0.00 0.00 28.75 29.77 1r2s h GLU 183 CO -0.36 0.70 -1.24 0.28 -0.73 0.00 0.00 179.01 177.66 1r2s h VAL 184 N 1.04 1.31 -0.86 0.32 2.07 -1.04 -2.92 116.25 116.17 1r2s h VAL 184 Ca 0.28 -2.52 -0.01 0.00 0.82 0.00 0.00 66.70 65.26 1r2s h VAL 184 Cb -0.08 2.71 -0.04 0.00 -1.52 0.00 0.00 31.29 32.36 1r2s h VAL 184 CO -0.06 0.76 0.48 0.45 0.02 0.00 0.00 177.57 179.23 1r2s h HIS 185 N 0.25 1.17 -0.52 1.57 3.86 -0.76 -1.76 115.15 118.96 1r2s h HIS 185 Ca -0.18 -0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 58.93 1r2s h HIS 185 Cb 1.91 -0.38 -0.02 0.00 1.06 0.00 0.00 27.41 29.98 1r2s h HIS 185 CO 0.11 0.80 0.02 1.49 0.86 0.00 0.00 177.93 181.21 1r2s h GLU 186 N 1.20 0.86 -0.03 2.45 4.81 -1.25 -0.68 114.58 121.95 1r2s h GLU 186 Ca 0.30 -0.23 -0.21 0.00 -0.13 0.00 0.00 59.36 59.09 1r2s h GLU 186 Cb 0.01 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.29 1r2s h GLU 186 CO -0.05 0.85 -0.86 0.87 -0.73 0.00 0.00 179.01 179.09 1r2s h LYS 187 N 0.80 0.41 0.07 1.92 1.57 -1.29 -1.06 116.57 118.99 1r2s h LYS 187 Ca 0.16 -0.40 -0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1r2s h LYS 187 Cb 0.45 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1r2s h LYS 187 CO 0.02 1.06 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.85 1r2s h LEU 188 N 0.25 -0.08 -1.05 2.94 3.38 -1.14 -1.27 115.31 118.34 1r2s h LEU 188 Ca -0.06 -0.16 0.08 0.00 0.09 0.00 0.00 57.88 57.83 1r2s h LEU 188 Cb 1.48 0.02 -0.07 0.00 0.09 0.00 0.00 40.66 42.18 1r2s h LEU 188 CO 0.15 0.11 0.63 -0.09 0.09 0.00 0.00 178.44 179.33 1r2s h ARG 189 N -0.27 1.06 -0.36 1.13 2.43 -1.10 -0.92 114.38 116.35 1r2s h ARG 189 Ca -0.01 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.07 1r2s h ARG 189 Cb 0.24 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 1r2s h ARG 189 CO 0.02 0.70 0.11 0.78 -1.51 0.00 0.00 179.97 180.07 1r2s h GLY 190 N 1.09 0.55 1.31 2.80 0.00 -1.05 -1.07 103.07 106.71 1r2s h GLY 190 Ca 0.44 -0.27 -0.15 0.00 0.00 0.00 0.00 47.33 47.35 1r2s h GLY 190 CO -0.19 0.26 -0.43 -0.25 0.00 0.00 0.00 176.54 175.92 1r2s h TRP 191 N 0.51 0.90 -0.40 5.60 7.01 0.03 -2.62 115.95 126.98 1r2s h TRP 191 Ca 0.12 -0.28 -0.16 0.00 2.11 0.00 0.00 58.89 60.69 1r2s h TRP 191 Cb 0.16 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 27.02 1r2s h TRP 191 CO 0.01 1.05 -0.36 -0.07 -2.79 0.00 0.00 178.44 176.27 1r2s h LEU 192 N 0.60 1.01 -0.28 0.65 3.38 -0.90 -0.60 115.31 119.17 1r2s h LEU 192 Ca 0.04 -0.45 0.05 0.00 0.09 0.00 0.00 57.88 57.61 1r2s h LEU 192 Cb 0.99 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.41 1r2s h LEU 192 CO 0.09 1.26 0.00 0.50 0.09 0.00 0.00 178.44 180.38 1r2s h LYS 193 N 0.78 0.08 0.00 1.13 3.64 -1.08 -0.19 116.57 120.93 1r2s h LYS 193 Ca 0.07 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1r2s h LYS 193 Cb 0.95 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 1r2s h LYS 193 CO 0.09 0.06 -1.08 -1.13 -2.27 0.00 0.00 179.45 175.11 1r2s n SER 194 N -5.16 0.72 -0.01 4.20 3.41 -1.00 -3.49 113.62 112.31 1r2s n SER 194 Ca -0.00 0.23 0.09 0.00 -0.26 0.00 0.00 58.87 58.93 1r2s n SER 194 Cb 0.15 0.62 -0.13 0.00 -0.26 0.00 0.00 64.21 64.58 1r2s n SER 194 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1r2s n ASN 195 N -2.52 0.83 0.00 4.04 3.02 -0.24 -4.86 115.26 115.52 1r2s n ASN 195 Ca -0.00 -0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.40 1r2s n ASN 195 Cb 0.53 1.70 0.00 0.00 -0.61 0.00 0.00 39.78 41.40 1r2s n ASN 195 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1r2s n VAL 196 N -2.02 0.00 -3.62 2.41 0.31 -0.16 -5.04 118.33 110.21 1r2s n VAL 196 Ca -0.02 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.29 1r2s n VAL 196 Cb 0.44 -0.57 -0.01 0.00 -0.91 0.00 0.00 33.84 32.79 1r2s n VAL 196 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1r2s s SER 197 N 0.70 -0.12 0.07 4.52 1.04 -0.73 -5.01 113.70 114.17 1r2s s SER 197 Ca 0.00 -0.11 -0.24 0.00 0.48 0.00 0.00 55.95 56.08 1r2s s SER 197 Cb 0.00 0.21 -0.16 0.00 0.10 0.00 0.00 66.02 66.17 1r2s s SER 197 CO 0.00 -0.36 1.66 0.44 0.98 0.00 0.00 173.24 175.96 1r2s h ASP 198 N 2.00 -0.08 -0.71 7.02 3.32 -1.84 -2.14 116.42 123.99 1r2s h ASP 198 Ca -0.21 -0.06 0.06 0.00 0.02 0.00 0.00 57.03 56.83 1r2s h ASP 198 Cb 1.20 0.02 -0.05 0.00 0.22 0.00 0.00 39.33 40.71 1r2s h ASP 198 CO 0.26 0.01 0.41 0.00 -1.72 0.00 0.00 179.24 178.21 1r2s h ALA 199 N 0.77 0.95 -0.41 3.45 0.00 -1.96 -0.81 119.26 121.25 1r2s h ALA 199 Ca -0.01 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1r2s h ALA 199 Cb 0.13 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1r2s h ALA 199 CO 0.01 0.11 -0.02 0.28 0.00 0.00 0.00 179.25 179.64 1r2s h VAL 200 N 0.76 1.26 -0.85 0.00 2.07 -1.91 -2.32 116.25 115.26 1r2s h VAL 200 Ca 0.31 -1.06 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 1r2s h VAL 200 Cb 0.16 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 1r2s h VAL 200 CO -0.17 0.36 0.47 0.00 0.02 0.00 0.00 177.57 178.25 1r2s h ALA 201 N 0.88 1.09 0.00 1.67 0.00 -0.94 -0.80 119.26 121.16 1r2s h ALA 201 Ca 0.11 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1r2s h ALA 201 Cb 0.51 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1r2s h ALA 201 CO 0.03 0.59 -0.07 1.96 0.00 0.00 0.00 179.25 181.76 1r2s h GLN 202 N 1.18 0.00 0.00 0.00 4.20 -1.05 -3.34 115.11 116.10 1r2s h GLN 202 Ca 0.30 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.01 1r2s h GLN 202 Cb 0.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.81 1r2s h GLN 202 CO -0.05 0.07 -0.87 -1.13 -0.67 0.00 0.00 178.83 176.18 1r2s n SER 203 N -3.13 1.65 -4.72 1.46 3.41 -0.89 -4.77 113.62 106.64 1r2s n SER 203 Ca 0.03 -0.36 -0.41 0.00 -0.26 0.00 0.00 58.87 57.86 1r2s n SER 203 Cb 0.51 1.19 -0.04 0.00 -0.26 0.00 0.00 64.21 65.61 1r2s n SER 203 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1r2s s THR 204 N -2.18 4.55 -0.14 6.66 2.01 -0.32 -4.92 115.64 121.30 1r2s s THR 204 Ca 0.00 2.02 -0.19 0.00 0.31 0.00 0.00 61.69 63.83 1r2s s THR 204 Cb 0.06 -4.29 -0.04 0.00 0.01 0.00 0.00 72.50 68.24 1r2s s THR 204 CO 0.35 0.26 0.53 -0.13 -0.69 0.00 0.00 174.62 174.94 1r2s s ARG 205 N 0.30 4.30 -0.28 4.92 0.52 -1.26 -4.97 118.95 122.48 1r2s s ARG 205 Ca 0.49 0.50 -0.05 0.00 -0.52 0.00 0.00 55.73 56.16 1r2s s ARG 205 Cb -0.23 -3.48 0.02 0.00 0.52 0.00 0.00 34.95 31.77 1r2s s ARG 205 CO 0.30 0.04 0.03 0.42 0.02 0.00 0.00 175.30 176.10 1r2s s ILE 206 N 1.01 3.54 0.08 1.52 1.01 -1.26 -1.89 121.20 125.21 1r2s s ILE 206 Ca 0.27 -0.86 0.03 0.00 0.00 0.00 0.00 60.65 60.10 1r2s s ILE 206 Cb -0.16 -2.84 -0.04 0.00 0.01 0.00 0.00 42.46 39.44 1r2s s ILE 206 CO 0.11 0.10 0.07 0.27 0.00 0.00 0.00 174.94 175.49 1r2s s ILE 207 N 1.42 4.45 -0.21 2.92 -4.36 0.16 -1.12 121.20 124.47 1r2s s ILE 207 Ca 0.01 -0.81 -0.14 0.00 -0.26 0.00 0.00 60.65 59.45 1r2s s ILE 207 Cb -0.17 -3.15 -0.04 0.00 1.25 0.00 0.00 42.46 40.35 1r2s s ILE 207 CO -0.00 0.12 0.31 -0.47 0.24 0.00 0.00 174.94 175.14 1r2s s TYR 208 N -1.39 3.36 -0.24 1.37 5.04 -0.36 -0.92 117.35 124.22 1r2s s TYR 208 Ca 0.29 0.49 0.12 0.00 -2.44 0.00 0.00 57.07 55.54 1r2s s TYR 208 Cb -0.12 -2.43 0.49 0.00 0.35 0.00 0.00 41.96 40.26 1r2s s TYR 208 CO 0.21 0.04 1.42 0.41 -1.34 0.00 0.00 175.55 176.29 1r2s n GLY 209 N 3.97 4.62 0.59 8.97 0.00 -0.07 -1.70 105.19 121.58 1r2s n GLY 209 Ca -0.11 -1.16 -0.04 0.00 0.00 0.00 0.00 46.02 44.71 1r2s n GLY 209 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r2s n GLY 210 N -0.95 -0.33 3.64 -0.02 0.00 -1.26 -4.70 105.19 101.56 1r2s n GLY 210 Ca 0.28 -1.80 -0.43 0.00 0.00 0.00 0.00 46.02 44.07 1r2s n GLY 210 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1r2s s SER 211 N -1.69 6.60 -0.04 1.61 0.15 -1.26 -4.80 113.70 114.27 1r2s s SER 211 Ca 0.11 1.70 0.04 0.00 0.70 0.00 0.00 55.95 58.50 1r2s s SER 211 Cb -0.00 -2.53 -0.00 0.00 -1.71 0.00 0.00 66.02 61.77 1r2s s SER 211 CO 0.07 -1.06 -0.17 0.68 1.20 0.00 0.00 173.24 173.96 1r2s s VAL 212 N 4.49 1.41 0.41 4.45 -7.23 -1.26 -5.04 120.40 117.63 1r2s s VAL 212 Ca 0.66 -0.71 0.07 0.00 -1.81 0.00 0.00 61.98 60.19 1r2s s VAL 212 Cb -0.25 -1.22 -0.08 0.00 0.56 0.00 0.00 36.38 35.40 1r2s s VAL 212 CO 0.25 0.41 0.01 0.42 -0.31 0.00 0.00 175.10 175.88 1r2s s THR 213 N 0.03 1.90 0.58 5.32 -4.23 -1.26 -4.72 115.64 113.27 1r2s s THR 213 Ca -0.04 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.76 1r2s s THR 213 Cb -0.11 -2.95 0.37 0.00 1.34 0.00 0.00 72.50 71.15 1r2s s THR 213 CO 0.02 0.00 2.00 1.23 -0.54 0.00 0.00 174.62 177.33 1r2s h GLY 214 N 1.78 0.00 1.37 3.99 0.00 -1.98 -1.66 103.07 106.58 1r2s h GLY 214 Ca -0.44 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.60 1r2s h GLY 214 CO 0.80 0.00 -1.43 0.00 0.00 0.00 0.00 176.54 175.91 1r2s h ALA 215 N 1.63 0.22 0.00 3.60 0.00 -1.96 -3.39 119.26 119.36 1r2s h ALA 215 Ca 0.15 -1.04 -0.14 0.00 0.00 0.00 0.00 54.91 53.89 1r2s h ALA 215 Cb 0.82 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1r2s h ALA 215 CO -0.00 1.09 -1.42 0.25 0.00 0.00 0.00 179.25 179.17 1r2s n THR 216 N -3.47 1.02 -0.27 0.00 -2.24 -0.97 -4.59 114.28 103.78 1r2s n THR 216 Ca -0.13 -0.66 0.09 0.00 -2.27 0.00 0.00 64.05 61.07 1r2s n THR 216 Cb 1.04 -0.61 0.33 0.00 -2.10 0.00 0.00 70.33 68.99 1r2s n THR 216 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1r2s h LYS 218 N 0.80 0.88 -0.12 0.00 1.57 -1.81 -1.00 116.57 116.90 1r2s h LYS 218 Ca 0.41 -0.06 -0.15 0.00 -1.87 0.00 0.00 60.65 58.98 1r2s h LYS 218 Cb 0.49 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1r2s h LYS 218 CO -0.18 0.60 -0.56 1.49 -0.57 0.00 0.00 179.45 180.23 1r2s h GLU 219 N 0.90 0.35 -0.04 3.15 4.81 -1.80 -2.96 114.58 118.99 1r2s h GLU 219 Ca 0.24 -0.22 -0.17 0.00 -0.13 0.00 0.00 59.36 59.07 1r2s h GLU 219 Cb -0.08 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 1r2s h GLU 219 CO -0.05 0.82 -0.74 -0.07 -0.73 0.00 0.00 179.01 178.24 1r2s h LEU 220 N 0.27 0.31 -0.35 1.64 3.38 -1.44 -3.14 115.31 115.98 1r2s h LEU 220 Ca 0.00 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1r2s h LEU 220 Cb 1.07 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1r2s h LEU 220 CO 0.09 0.94 0.00 0.00 0.09 0.00 0.00 178.44 179.56 1r2s h ALA 221 N 1.05 1.00 -0.04 1.53 0.00 -1.11 -3.00 119.26 118.70 1r2s h ALA 221 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1r2s h ALA 221 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1r2s h ALA 221 CO 0.12 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.24 1r2s n SER 222 N -2.48 1.19 -4.75 0.00 3.41 -1.13 -4.86 113.62 105.00 1r2s n SER 222 Ca 0.04 -1.44 -0.41 0.00 -0.26 0.00 0.00 58.87 56.80 1r2s n SER 222 Cb 0.38 -0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.27 1r2s n SER 222 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1r2s s GLN 223 N -1.96 4.62 0.34 4.33 -1.52 -1.13 -4.96 119.66 119.38 1r2s s GLN 223 Ca 0.38 1.79 0.01 0.00 -1.95 0.00 0.00 55.36 55.59 1r2s s GLN 223 Cb 0.20 -3.21 0.60 0.00 -0.22 0.00 0.00 33.01 30.37 1r2s s GLN 223 CO 0.32 0.16 2.00 -1.35 -0.25 0.00 0.00 175.29 176.18 1r2s h PRO 224 N 4.23 0.89 -0.50 2.91 0.11 -1.91 -2.98 132.00 134.76 1r2s h PRO 224 Ca -0.46 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1r2s h PRO 224 Cb 1.21 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1r2s h PRO 224 CO 0.69 0.59 0.00 -0.25 -0.21 0.00 0.00 178.00 178.82 1r2s n ASP 225 N -4.43 4.01 -4.60 -2.05 8.00 -1.26 -4.87 116.55 111.34 1r2s n ASP 225 Ca 0.07 -2.38 -0.38 0.00 0.71 0.00 0.00 54.79 52.81 1r2s n ASP 225 Cb 0.04 -0.47 -0.11 0.00 -0.02 0.00 0.00 41.12 40.57 1r2s n ASP 225 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1r2s s VAL 226 N -1.71 5.30 -1.32 2.53 1.01 -1.13 -4.69 120.40 120.39 1r2s s VAL 226 Ca 0.41 0.22 0.16 0.00 0.00 0.00 0.00 61.98 62.77 1r2s s VAL 226 Cb 0.27 -3.55 0.46 0.00 0.00 0.00 0.00 36.38 33.55 1r2s s VAL 226 CO 0.20 0.25 1.38 0.47 0.00 0.00 0.00 175.10 177.40 1r2s n ASP 227 N 5.02 3.42 0.00 3.32 8.00 -0.27 -4.80 116.55 131.23 1r2s n ASP 227 Ca -0.13 -2.04 0.00 0.00 0.71 0.00 0.00 54.79 53.33 1r2s n ASP 227 Cb 0.52 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 41.27 1r2s n ASP 227 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1r2s n GLY 228 N 0.95 0.89 2.98 0.44 0.00 -1.26 -1.57 105.19 107.62 1r2s n GLY 228 Ca 0.17 -1.84 -0.12 0.00 0.00 0.00 0.00 46.02 44.23 1r2s n GLY 228 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r2s s PHE 229 N -2.93 0.39 -0.35 1.61 0.40 0.01 -1.23 117.98 115.88 1r2s s PHE 229 Ca 0.00 -0.32 -0.07 0.00 -0.60 0.00 0.00 56.93 55.94 1r2s s PHE 229 Cb 0.00 -0.25 0.04 0.00 0.51 0.00 0.00 43.02 43.33 1r2s s PHE 229 CO 0.00 -0.08 0.13 -1.17 0.70 0.00 0.00 175.22 174.80 1r2s s LEU 230 N -0.93 4.48 -0.13 -0.37 2.96 -0.69 -0.55 118.68 123.45 1r2s s LEU 230 Ca -0.07 -1.19 -0.13 0.00 -0.22 0.00 0.00 54.13 52.51 1r2s s LEU 230 Cb -0.06 -1.90 -0.05 0.00 0.50 0.00 0.00 46.19 44.68 1r2s s LEU 230 CO -0.00 -0.36 0.29 -0.69 -1.32 0.00 0.00 176.35 174.27 1r2s s VAL 231 N 1.41 5.29 0.00 1.68 1.01 0.82 -4.34 120.40 126.27 1r2s s VAL 231 Ca -0.01 0.56 0.00 0.00 0.00 0.00 0.00 61.98 62.53 1r2s s VAL 231 Cb -0.20 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.56 1r2s s VAL 231 CO 0.03 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.18 1r2s n GLY 232 N 3.03 1.16 0.40 4.51 0.00 -1.26 -0.39 105.19 112.64 1r2s n GLY 232 Ca -0.13 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.08 1r2s n GLY 232 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1r2s h GLY 233 N 0.00 0.68 2.00 -0.02 0.00 -1.94 -2.25 103.07 101.54 1r2s h GLY 233 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.17 1r2s h GLY 233 CO 0.00 0.02 0.00 0.00 0.00 0.00 0.00 176.54 176.56 1r2s n ALA 234 N -2.54 1.45 0.34 3.60 0.00 -1.26 -3.17 120.51 118.92 1r2s n ALA 234 Ca 0.17 0.12 0.23 0.00 0.00 0.00 0.00 53.44 53.95 1r2s n ALA 234 Cb 0.67 -1.35 1.21 0.00 0.00 0.00 0.00 19.45 19.98 1r2s n ALA 234 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1r2s h SER 235 N 0.00 0.00 0.04 0.00 0.02 -1.67 -2.78 113.55 109.16 1r2s h SER 235 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1r2s h SER 235 Cb 0.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.78 1r2s h SER 235 CO 0.00 0.00 -0.54 0.18 -1.14 0.00 0.00 176.83 175.33 1r2s n LEU 236 N -3.07 1.68 -4.72 5.07 4.77 -1.19 -4.89 117.00 114.65 1r2s n LEU 236 Ca -0.03 -0.63 -0.24 0.00 -0.03 0.00 0.00 56.01 55.09 1r2s n LEU 236 Cb 0.07 -0.02 -0.07 0.00 -2.33 0.00 0.00 43.42 41.07 1r2s n LEU 236 CO 0.20 0.32 -0.21 -0.54 -1.33 0.00 0.00 177.39 175.84 1r2s s LYS 237 N -2.59 2.30 0.58 3.23 1.02 -1.05 -4.98 119.74 118.25 1r2s s LYS 237 Ca 0.17 -1.63 0.38 0.00 0.02 0.00 0.00 55.97 54.91 1r2s s LYS 237 Cb 0.18 -2.10 1.87 0.00 -0.52 0.00 0.00 37.83 37.26 1r2s s LYS 237 CO 0.62 0.07 2.15 -1.35 -0.92 0.00 0.00 175.35 175.92 1r2s h PRO 238 N 1.56 0.00 -1.83 -1.68 0.11 -1.92 -2.57 132.00 125.67 1r2s h PRO 238 Ca -0.43 0.00 0.53 0.00 0.11 0.00 0.00 66.00 66.21 1r2s h PRO 238 Cb 1.25 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.28 1r2s h PRO 238 CO 0.65 0.00 1.31 0.93 -0.21 0.00 0.00 178.00 180.68 1r2s h GLU 239 N 0.00 0.00 -0.96 1.05 5.08 -1.96 -0.46 114.58 117.33 1r2s h GLU 239 Ca 0.00 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1r2s h GLU 239 Cb 0.22 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.41 1r2s h GLU 239 CO 0.00 0.00 0.63 0.35 -1.00 0.00 0.00 179.01 178.99 1r2s h PHE 240 N 0.00 1.18 -0.66 4.33 3.57 -1.53 -2.51 116.94 121.32 1r2s h PHE 240 Ca 0.88 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 62.41 1r2s h PHE 240 Cb 3.50 -0.39 -0.03 0.00 2.79 0.00 0.00 35.95 41.81 1r2s h PHE 240 CO -0.00 0.68 0.39 0.28 -2.23 0.00 0.00 178.31 177.43 1r2s h VAL 241 N 1.22 1.19 -0.52 1.41 2.07 -1.32 -1.35 116.25 118.94 1r2s h VAL 241 Ca 0.38 -0.42 -0.03 0.00 0.82 0.00 0.00 66.70 67.45 1r2s h VAL 241 Cb -0.01 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 1r2s h VAL 241 CO -0.12 0.20 0.22 0.44 0.02 0.00 0.00 177.57 178.33 1r2s h ASP 242 N 0.90 0.71 -0.76 0.57 3.32 -1.57 -2.98 116.42 116.61 1r2s h ASP 242 Ca 0.24 -0.16 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 1r2s h ASP 242 Cb -0.03 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.30 1r2s h ASP 242 CO -0.04 0.68 0.35 0.40 -1.72 0.00 0.00 179.24 178.90 1r2s h ILE 243 N 0.71 1.25 -0.46 0.35 2.04 -1.09 -1.39 117.51 118.91 1r2s h ILE 243 Ca 0.18 -0.72 0.08 0.00 1.00 0.00 0.00 64.86 65.39 1r2s h ILE 243 Cb 0.18 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 1r2s h ILE 243 CO -0.02 0.30 0.32 0.40 0.00 0.00 0.00 178.15 179.15 1r2s h ILE 244 N 1.10 0.92 -0.52 -0.67 2.04 -1.17 -1.94 117.51 117.26 1r2s h ILE 244 Ca 0.26 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 66.00 1r2s h ILE 244 Cb 0.14 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 1r2s h ILE 244 CO -0.03 0.05 0.02 0.59 0.00 0.00 0.00 178.15 178.79 1r2s n ASN 245 N -4.47 5.12 0.25 1.72 3.02 -0.55 -4.69 115.26 115.67 1r2s n ASN 245 Ca 0.07 -2.85 0.09 0.00 -0.03 0.00 0.00 54.58 51.86 1r2s n ASN 245 Cb 0.32 -0.67 0.63 0.00 -0.61 0.00 0.00 39.78 39.44 1r2s n ASN 245 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1r2s h ALA 246 N 3.66 1.62 -0.47 5.41 0.00 -1.07 -3.09 119.26 125.32 1r2s h ALA 246 Ca 0.02 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1r2s h ALA 246 Cb 1.85 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.59 1r2s h ALA 246 CO 0.46 0.15 0.05 1.17 0.00 0.00 0.00 179.25 181.08 1r2s n LYS 247 N -4.14 3.76 0.00 0.00 4.81 -1.26 -4.60 118.16 116.74 1r2s n LYS 247 Ca -0.02 -2.38 0.00 0.00 -0.87 0.00 0.00 58.31 55.03 1r2s n LYS 247 Cb 0.20 -2.07 0.00 0.00 0.02 0.00 0.00 35.03 33.18 1r2s n LYS 247 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61