#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rxj h ILE 17 N 0.00 1.16 -2.44 -0.61 2.04 -1.97 -3.46 117.51 112.23 1rxj h ILE 17 Ca 0.00 -2.71 -0.57 0.00 1.00 0.00 0.00 64.86 62.57 1rxj h ILE 17 Cb 0.00 2.87 0.06 0.00 -0.74 0.00 0.00 36.82 39.01 1rxj h ILE 17 CO 0.00 0.84 0.79 0.41 0.00 0.00 0.00 178.15 180.18 1rxj n THR 18 N -3.58 0.24 -1.75 -0.27 -1.04 -1.26 -4.82 114.28 101.80 1rxj n THR 18 Ca -0.18 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 61.77 1rxj n THR 18 Cb 1.07 -1.59 0.00 0.00 -1.82 0.00 0.00 70.33 67.99 1rxj n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1rxj n GLY 19 N 3.15 -0.00 3.40 3.41 0.00 -0.31 -5.00 105.19 109.84 1rxj n GLY 19 Ca 0.15 -1.60 -0.34 0.00 0.00 0.00 0.00 46.02 44.23 1rxj n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rxj s THR 20 N -2.51 3.57 0.20 2.61 2.01 -1.26 -1.46 115.64 118.81 1rxj s THR 20 Ca 0.00 -0.45 0.10 0.00 0.31 0.00 0.00 61.69 61.65 1rxj s THR 20 Cb 0.00 -2.58 -0.04 0.00 0.01 0.00 0.00 72.50 69.88 1rxj s THR 20 CO 0.00 0.46 -0.20 0.26 -0.69 0.00 0.00 174.62 174.45 1rxj s TRP 21 N 0.90 2.07 0.01 4.92 0.52 0.24 -4.60 118.94 123.01 1rxj s TRP 21 Ca -0.01 -0.41 0.04 0.00 0.02 0.00 0.00 56.10 55.74 1rxj s TRP 21 Cb -0.15 -0.99 -0.01 0.00 -1.15 0.00 0.00 33.47 31.17 1rxj s TRP 21 CO 0.01 0.48 -0.11 0.71 0.02 0.00 0.00 176.95 178.06 1rxj s TYR 22 N -2.13 1.01 0.46 -1.98 2.02 0.51 -0.55 117.35 116.69 1rxj s TYR 22 Ca 0.21 -0.26 0.07 0.00 -0.37 0.00 0.00 57.07 56.73 1rxj s TYR 22 Cb -0.06 -0.63 0.07 0.00 -0.40 0.00 0.00 41.96 40.95 1rxj s TYR 22 CO 0.10 -0.00 0.61 0.27 -1.57 0.00 0.00 175.55 174.95 1rxj n ASN 23 N 2.41 1.71 0.29 2.29 0.23 -0.95 -1.18 115.26 120.06 1rxj n ASN 23 Ca -0.16 -2.23 0.18 0.00 -0.53 0.00 0.00 54.58 51.84 1rxj n ASN 23 Cb 0.56 -0.31 0.84 0.00 -2.08 0.00 0.00 39.78 38.78 1rxj n ASN 23 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 1rxj h GLN 24 N 0.00 0.00 -0.00 -3.83 -0.00 -1.91 -0.70 115.11 108.66 1rxj h GLN 24 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.43 1rxj h GLN 24 Cb 0.98 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.46 1rxj h GLN 24 CO 0.31 0.03 -0.15 1.28 -0.00 0.00 0.00 178.83 180.30 1rxj n LEU 25 N -3.17 0.17 0.00 0.06 4.77 -1.26 -4.89 117.00 112.68 1rxj n LEU 25 Ca -0.01 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 1rxj n LEU 25 Cb 0.24 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 1rxj n LEU 25 CO 0.26 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 1rxj n GLY 26 N 1.48 0.67 3.77 -0.72 0.00 -0.27 -5.06 105.19 105.06 1rxj n GLY 26 Ca 0.07 -0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1rxj n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rxj s SER 27 N -2.07 5.42 -0.21 1.61 0.01 -1.26 -4.81 113.70 112.39 1rxj s SER 27 Ca 0.00 2.22 -0.03 0.00 1.31 0.00 0.00 55.95 59.44 1rxj s SER 27 Cb 0.00 -2.58 -0.01 0.00 0.21 0.00 0.00 66.02 63.64 1rxj s SER 27 CO 0.00 -1.43 -0.05 -0.89 0.41 0.00 0.00 173.24 171.28 1rxj s THR 28 N -1.82 3.30 -0.35 1.44 2.01 -0.18 -2.25 115.64 117.79 1rxj s THR 28 Ca 0.73 -0.52 -0.02 0.00 0.31 0.00 0.00 61.69 62.19 1rxj s THR 28 Cb -0.25 -2.49 0.08 0.00 0.01 0.00 0.00 72.50 69.84 1rxj s THR 28 CO 0.32 0.44 0.09 0.12 -0.69 0.00 0.00 174.62 174.89 1rxj s PHE 29 N 1.39 3.44 -0.27 4.92 5.36 0.29 -1.16 117.98 131.96 1rxj s PHE 29 Ca 0.05 -2.16 -0.08 0.00 -0.96 0.00 0.00 56.93 53.78 1rxj s PHE 29 Cb -0.14 -2.65 -0.02 0.00 -0.34 0.00 0.00 43.02 39.87 1rxj s PHE 29 CO -0.03 -0.88 0.09 0.42 -1.46 0.00 0.00 175.22 173.36 1rxj s ILE 30 N 1.19 4.39 0.03 3.12 1.01 -0.26 -0.59 121.20 130.09 1rxj s ILE 30 Ca 0.02 -0.24 0.01 0.00 0.00 0.00 0.00 60.65 60.44 1rxj s ILE 30 Cb -0.21 -3.11 -0.02 0.00 0.01 0.00 0.00 42.46 39.14 1rxj s ILE 30 CO -0.03 0.27 -0.04 0.54 0.00 0.00 0.00 174.94 175.68 1rxj s VAL 31 N 1.61 0.24 -0.08 2.92 0.11 -0.53 -1.14 120.40 123.53 1rxj s VAL 31 Ca 0.06 -0.90 0.02 0.00 -2.93 0.00 0.00 61.98 58.23 1rxj s VAL 31 Cb -0.16 -0.36 0.01 0.00 -1.53 0.00 0.00 36.38 34.35 1rxj s VAL 31 CO 0.04 -0.42 -0.14 -0.89 -3.33 0.00 0.00 175.10 170.36 1rxj s THR 32 N -1.33 1.31 -0.23 5.04 2.01 -0.01 -1.16 115.64 121.27 1rxj s THR 32 Ca -0.13 -0.57 -0.08 0.00 0.31 0.00 0.00 61.69 61.22 1rxj s THR 32 Cb -0.09 -1.18 -0.04 0.00 0.01 0.00 0.00 72.50 71.20 1rxj s THR 32 CO -0.01 0.40 0.09 0.00 -0.69 0.00 0.00 174.62 174.41 1rxj s ALA 33 N 0.70 3.32 0.40 7.40 0.00 -1.26 -1.98 121.76 130.34 1rxj s ALA 33 Ca -0.13 -1.00 -0.01 0.00 0.00 0.00 0.00 51.96 50.82 1rxj s ALA 33 Cb -0.16 -2.12 -0.03 0.00 0.00 0.00 0.00 23.12 20.82 1rxj s ALA 33 CO 0.03 -0.28 0.63 0.20 0.00 0.00 0.00 175.76 176.34 1rxj s GLY 34 N 1.24 1.40 0.57 0.00 0.00 0.22 -4.88 107.32 105.87 1rxj s GLY 34 Ca 0.05 -0.81 0.33 0.00 0.00 0.00 0.00 44.72 44.29 1rxj s GLY 34 CO 0.04 -0.71 2.15 0.00 0.00 0.00 0.00 173.10 174.58 1rxj h ALA 35 N 0.56 1.17 -0.41 3.20 0.00 -1.99 -2.20 119.26 119.60 1rxj h ALA 35 Ca -0.49 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 1rxj h ALA 35 Cb 1.22 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1rxj h ALA 35 CO 0.61 0.07 0.02 -3.47 0.00 0.00 0.00 179.25 176.48 1rxj n ASP 36 N -3.41 4.61 0.00 0.00 2.03 -1.26 -4.88 116.55 113.64 1rxj n ASP 36 Ca -0.02 -3.03 0.00 0.00 0.52 0.00 0.00 54.79 52.26 1rxj n ASP 36 Cb 0.20 -0.62 0.00 0.00 -0.72 0.00 0.00 41.12 39.98 1rxj n ASP 36 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1rxj n GLY 37 N -0.09 0.72 3.75 0.27 0.00 -0.82 -4.95 105.19 104.07 1rxj n GLY 37 Ca 0.26 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.88 1rxj n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rxj s ALA 38 N -2.00 3.35 -0.11 4.61 0.00 -1.25 -0.98 121.76 125.38 1rxj s ALA 38 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 51.96 52.49 1rxj s ALA 38 Cb 0.00 -3.15 -0.02 0.00 0.00 0.00 0.00 23.12 19.95 1rxj s ALA 38 CO 0.00 0.18 -0.11 -0.51 0.00 0.00 0.00 175.76 175.32 1rxj s LEU 39 N -0.91 2.84 0.03 0.00 1.43 0.03 -0.61 118.68 121.48 1rxj s LEU 39 Ca 0.41 -0.25 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 1rxj s LEU 39 Cb -0.25 -1.63 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 1rxj s LEU 39 CO 0.30 0.21 -0.04 0.42 0.23 0.00 0.00 176.35 177.47 1rxj s THR 40 N 0.06 0.23 -4.74 5.49 -4.23 -0.84 -1.24 115.64 110.38 1rxj s THR 40 Ca -0.04 -1.16 0.00 0.00 -1.18 0.00 0.00 61.69 59.31 1rxj s THR 40 Cb -0.14 -0.63 0.00 0.00 1.34 0.00 0.00 72.50 73.07 1rxj s THR 40 CO 0.04 -0.59 0.00 0.61 -0.54 0.00 0.00 174.62 174.14 1rxj n GLY 41 N 1.22 -0.50 3.13 3.99 0.00 -1.05 -0.83 105.19 111.15 1rxj n GLY 41 Ca -0.21 -0.88 -0.12 0.00 0.00 0.00 0.00 46.02 44.80 1rxj n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rxj s THR 42 N -3.61 0.68 -0.02 2.61 -4.23 -0.29 -1.67 115.64 109.10 1rxj s THR 42 Ca 0.00 -1.58 0.03 0.00 -1.18 0.00 0.00 61.69 58.96 1rxj s THR 42 Cb 0.00 -1.24 -0.00 0.00 1.34 0.00 0.00 72.50 72.60 1rxj s THR 42 CO 0.00 -0.64 -0.11 -0.47 -0.54 0.00 0.00 174.62 172.86 1rxj s TYR 43 N -2.61 1.05 -0.16 3.99 6.14 0.06 -1.10 117.35 124.73 1rxj s TYR 43 Ca 0.03 -0.25 -0.01 0.00 0.64 0.00 0.00 57.07 57.48 1rxj s TYR 43 Cb -0.02 -0.73 0.04 0.00 0.42 0.00 0.00 41.96 41.68 1rxj s TYR 43 CO -0.02 -0.09 -0.05 -2.00 0.64 0.00 0.00 175.55 174.03 1rxj s GLU 44 N 0.06 1.38 0.06 4.97 2.12 -0.31 -0.50 118.70 126.48 1rxj s GLU 44 Ca -0.01 -0.47 0.25 0.00 0.36 0.00 0.00 54.97 55.10 1rxj s GLU 44 Cb -0.08 -1.94 0.54 0.00 0.26 0.00 0.00 34.13 32.91 1rxj s GLU 44 CO 0.00 -0.42 1.45 0.45 -0.54 0.00 0.00 175.26 176.20 1rxj n SER 45 N 4.90 0.54 -2.65 -1.70 2.88 -1.26 -1.01 113.62 115.32 1rxj n SER 45 Ca -0.12 0.05 -0.05 0.00 -1.33 0.00 0.00 58.87 57.42 1rxj n SER 45 Cb 0.48 0.07 0.01 0.00 -0.75 0.00 0.00 64.21 64.01 1rxj n SER 45 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1rxj n LYS 52 N -1.81 -2.33 -3.22 -1.46 4.76 -1.26 -4.94 118.16 107.91 1rxj n LYS 52 Ca 0.05 2.07 -0.32 0.00 -2.87 0.00 0.00 58.31 57.24 1rxj n LYS 52 Cb 0.39 -5.07 -0.05 0.00 -1.84 0.00 0.00 35.03 28.46 1rxj n LYS 52 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1rxj s ARG 53 N -2.16 3.86 0.04 1.97 0.52 -1.26 -4.99 118.95 116.94 1rxj s ARG 53 Ca 0.16 0.43 0.08 0.00 -0.52 0.00 0.00 55.73 55.89 1rxj s ARG 53 Cb -0.05 -2.52 -0.03 0.00 0.52 0.00 0.00 34.95 32.87 1rxj s ARG 53 CO 0.67 0.19 -0.24 0.71 0.02 0.00 0.00 175.30 176.66 1rxj s TYR 54 N -1.99 2.07 0.36 -0.53 1.51 0.34 -4.83 117.35 114.29 1rxj s TYR 54 Ca 0.50 -0.39 -0.28 0.00 -1.01 0.00 0.00 57.07 55.89 1rxj s TYR 54 Cb -0.11 -1.24 -0.10 0.00 -0.11 0.00 0.00 41.96 40.41 1rxj s TYR 54 CO 0.22 0.11 1.31 0.08 -1.11 0.00 0.00 175.55 176.16 1rxj s VAL 55 N -0.80 2.66 0.07 0.71 1.01 -1.26 -0.76 120.40 122.03 1rxj s VAL 55 Ca 0.10 0.63 0.06 0.00 0.00 0.00 0.00 61.98 62.77 1rxj s VAL 55 Cb -0.09 -3.39 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 1rxj s VAL 55 CO 0.02 0.13 -0.16 -1.48 0.00 0.00 0.00 175.10 173.61 1rxj s LEU 56 N -2.06 2.25 0.06 3.92 0.05 -0.67 -4.33 118.68 117.90 1rxj s LEU 56 Ca 0.52 -0.59 0.02 0.00 0.05 0.00 0.00 54.13 54.12 1rxj s LEU 56 Cb -0.39 -0.65 -0.03 0.00 -2.05 0.00 0.00 46.19 43.07 1rxj s LEU 56 CO 0.52 -0.01 -0.06 0.42 -0.55 0.00 0.00 176.35 176.66 1rxj s THR 57 N -1.13 0.54 0.00 5.48 -4.23 -1.09 -2.54 115.64 112.66 1rxj s THR 57 Ca 0.01 -1.47 0.00 0.00 -1.18 0.00 0.00 61.69 59.05 1rxj s THR 57 Cb -0.09 -1.09 0.00 0.00 1.34 0.00 0.00 72.50 72.66 1rxj s THR 57 CO 0.02 -0.64 0.00 0.61 -0.54 0.00 0.00 174.62 174.07 1rxj n GLY 58 N 0.75 1.76 3.02 3.99 0.00 -0.37 -1.20 105.19 113.14 1rxj n GLY 58 Ca -0.18 -0.82 -0.08 0.00 0.00 0.00 0.00 46.02 44.94 1rxj n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rxj s ARG 59 N -0.54 0.41 0.09 1.61 1.81 -0.45 -0.79 118.95 121.08 1rxj s ARG 59 Ca 0.00 -0.79 -0.04 0.00 -1.72 0.00 0.00 55.73 53.19 1rxj s ARG 59 Cb 0.00 0.14 -0.03 0.00 -0.45 0.00 0.00 34.95 34.62 1rxj s ARG 59 CO 0.00 -0.07 0.08 1.52 -0.68 0.00 0.00 175.30 176.14 1rxj s TYR 60 N -2.20 0.47 -0.52 -0.53 1.13 -0.15 -1.29 117.35 114.25 1rxj s TYR 60 Ca -0.09 -0.93 -0.28 0.00 -1.41 0.00 0.00 57.07 54.36 1rxj s TYR 60 Cb -0.04 -0.28 0.01 0.00 -1.10 0.00 0.00 41.96 40.54 1rxj s TYR 60 CO -0.04 -0.48 1.50 0.34 -2.51 0.00 0.00 175.55 174.37 1rxj s ASP 61 N -2.93 6.04 0.00 -0.18 2.15 -0.31 -4.48 116.67 116.96 1rxj s ASP 61 Ca 0.10 0.48 0.31 0.00 0.43 0.00 0.00 52.55 53.88 1rxj s ASP 61 Cb 0.07 -2.54 1.75 0.00 -0.30 0.00 0.00 42.92 41.90 1rxj s ASP 61 CO -0.07 -1.74 2.15 -1.54 -0.17 0.00 0.00 175.17 173.79 1rxj n SER 62 N 9.89 0.18 -3.14 -0.34 3.41 -1.26 -4.04 113.62 118.32 1rxj n SER 62 Ca 0.15 -0.95 -0.21 0.00 -0.26 0.00 0.00 58.87 57.60 1rxj n SER 62 Cb 0.49 -0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.36 1rxj n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rxj n ALA 63 N -0.91 1.74 -0.99 7.33 0.00 -1.26 -5.00 120.51 121.42 1rxj n ALA 63 Ca 0.22 -2.95 -0.30 0.00 0.00 0.00 0.00 53.44 50.41 1rxj n ALA 63 Cb 0.16 -0.91 0.16 0.00 0.00 0.00 0.00 19.45 18.85 1rxj n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1rxj s PRO 64 N -0.60 1.02 0.82 0.00 0.04 -1.26 -4.98 135.00 130.05 1rxj s PRO 64 Ca 0.34 1.05 -0.14 0.00 0.04 0.00 0.00 61.00 62.30 1rxj s PRO 64 Cb 0.15 -1.76 0.06 0.00 0.04 0.00 0.00 34.50 32.99 1rxj s PRO 64 CO -0.14 -2.47 0.98 0.00 0.04 0.00 0.00 177.00 175.41 1rxj n ALA 65 N -4.07 -0.66 -1.66 8.56 0.00 -1.26 -4.94 120.51 116.48 1rxj n ALA 65 Ca 0.08 -0.37 -0.18 0.00 0.00 0.00 0.00 53.44 52.97 1rxj n ALA 65 Cb 0.54 -2.12 0.11 0.00 0.00 0.00 0.00 19.45 17.98 1rxj n ALA 65 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1rxj n THR 66 N -3.24 2.76 -0.94 0.00 -2.24 -1.26 -4.62 114.28 104.74 1rxj n THR 66 Ca 0.12 -3.37 0.09 0.00 -2.27 0.00 0.00 64.05 58.61 1rxj n THR 66 Cb 0.51 -0.80 0.15 0.00 -2.10 0.00 0.00 70.33 68.08 1rxj n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1rxj n ASP 67 N -0.93 2.59 0.00 3.42 5.68 -1.26 -4.96 116.55 121.09 1rxj n ASP 67 Ca 0.43 -2.95 0.00 0.00 -0.50 0.00 0.00 54.79 51.77 1rxj n ASP 67 Cb 0.93 -0.40 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 1rxj n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1rxj n GLY 68 N -1.16 1.02 3.75 6.12 0.00 -1.26 -5.07 105.19 108.60 1rxj n GLY 68 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 1rxj n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rxj s SER 69 N -2.61 4.91 1.08 1.61 0.01 -1.26 -5.04 113.70 112.40 1rxj s SER 69 Ca 0.00 2.18 -0.17 0.00 1.31 0.00 0.00 55.95 59.27 1rxj s SER 69 Cb 0.00 -2.57 0.24 0.00 0.21 0.00 0.00 66.02 63.89 1rxj s SER 69 CO 0.00 -1.77 1.17 -0.83 0.41 0.00 0.00 173.24 172.21 1rxj s GLY 70 N -2.19 1.63 -0.32 3.44 0.00 -1.26 -4.81 107.32 103.82 1rxj s GLY 70 Ca 0.71 -0.91 -0.08 0.00 0.00 0.00 0.00 44.72 44.45 1rxj s GLY 70 CO 0.40 -0.12 0.11 -1.59 0.00 0.00 0.00 173.10 171.90 1rxj s THR 71 N -3.27 4.09 0.41 0.90 2.01 -0.26 -4.75 115.64 114.77 1rxj s THR 71 Ca 0.70 -0.77 -0.25 0.00 0.31 0.00 0.00 61.69 61.68 1rxj s THR 71 Cb -0.10 -3.17 -0.08 0.00 0.01 0.00 0.00 72.50 69.16 1rxj s THR 71 CO 0.55 -0.01 1.22 0.00 -0.69 0.00 0.00 174.62 175.69 1rxj s ALA 72 N 1.50 3.17 0.22 7.40 0.00 -1.26 -0.62 121.76 132.17 1rxj s ALA 72 Ca 0.02 1.08 -0.22 0.00 0.00 0.00 0.00 51.96 52.83 1rxj s ALA 72 Cb -0.18 -3.43 0.04 0.00 0.00 0.00 0.00 23.12 19.56 1rxj s ALA 72 CO 0.04 -0.68 0.69 -0.48 0.00 0.00 0.00 175.76 175.33 1rxj s LEU 73 N -2.53 -0.37 0.11 0.00 2.34 -0.47 -1.16 118.68 116.60 1rxj s LEU 73 Ca 0.58 -0.35 -0.25 0.00 0.06 0.00 0.00 54.13 54.16 1rxj s LEU 73 Cb -0.34 2.63 0.07 0.00 -0.56 0.00 0.00 46.19 47.99 1rxj s LEU 73 CO 0.43 -1.16 0.62 -0.83 -1.06 0.00 0.00 176.35 174.35 1rxj s GLY 74 N -2.84 -0.61 0.17 -3.48 0.00 -0.41 -1.22 107.32 98.94 1rxj s GLY 74 Ca 0.07 0.70 -0.15 0.00 0.00 0.00 0.00 44.72 45.34 1rxj s GLY 74 CO -0.01 0.35 0.44 0.66 0.00 0.00 0.00 173.10 174.54 1rxj s TRP 75 N -3.13 -0.00 0.00 1.90 -2.14 -0.43 -1.33 118.94 113.80 1rxj s TRP 75 Ca -0.02 -0.35 0.06 0.00 2.66 0.00 0.00 56.10 58.46 1rxj s TRP 75 Cb -0.01 0.25 -0.02 0.00 -3.10 0.00 0.00 33.47 30.60 1rxj s TRP 75 CO -0.08 -0.83 -0.19 0.99 -2.66 0.00 0.00 176.95 174.19 1rxj s THR 76 N -3.89 1.51 -0.13 0.66 2.01 -0.34 -1.03 115.64 114.43 1rxj s THR 76 Ca 0.10 -0.90 0.02 0.00 0.31 0.00 0.00 61.69 61.22 1rxj s THR 76 Cb 0.01 -1.27 0.01 0.00 0.01 0.00 0.00 72.50 71.26 1rxj s THR 76 CO -0.04 0.36 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.37 1rxj s VAL 77 N -0.54 1.81 -0.11 3.82 1.01 -0.32 -2.69 120.40 123.40 1rxj s VAL 77 Ca 0.07 -0.82 -0.19 0.00 0.00 0.00 0.00 61.98 61.04 1rxj s VAL 77 Cb -0.08 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 1rxj s VAL 77 CO -0.00 0.50 0.51 0.00 0.00 0.00 0.00 175.10 176.11 1rxj s ALA 78 N 0.99 3.46 -0.36 5.51 0.00 -1.26 -0.70 121.76 129.39 1rxj s ALA 78 Ca -0.04 -0.14 -0.05 0.00 0.00 0.00 0.00 51.96 51.72 1rxj s ALA 78 Cb -0.15 -2.69 -0.12 0.00 0.00 0.00 0.00 23.12 20.17 1rxj s ALA 78 CO -0.04 -0.01 3.20 0.91 0.00 0.00 0.00 175.76 179.83 1rxj n TRP 79 N 3.65 0.90 -4.78 0.00 7.02 -0.08 -4.74 117.44 119.41 1rxj n TRP 79 Ca -0.06 -1.85 -0.28 0.00 -1.02 0.00 0.00 57.50 54.28 1rxj n TRP 79 Cb 0.52 -1.60 -0.17 0.00 -2.42 0.00 0.00 31.31 27.64 1rxj n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1rxj s LYS 80 N -0.01 2.32 0.00 -0.99 2.20 -1.26 -1.40 119.74 120.59 1rxj s LYS 80 Ca 0.64 -0.62 0.00 0.00 -0.36 0.00 0.00 55.97 55.63 1rxj s LYS 80 Cb 0.32 -1.85 0.00 0.00 -1.51 0.00 0.00 37.83 34.80 1rxj s LYS 80 CO -0.09 0.06 0.00 0.27 -0.36 0.00 0.00 175.35 175.23 1rxj n ASN 81 N 3.80 0.49 0.08 1.43 0.23 -0.42 -4.74 115.26 116.13 1rxj n ASN 81 Ca -0.21 -0.37 0.10 0.00 -0.53 0.00 0.00 54.58 53.58 1rxj n ASN 81 Cb 0.52 0.00 0.43 0.00 -2.08 0.00 0.00 39.78 38.65 1rxj n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1rxj n ASN 82 N -0.92 0.41 -0.02 0.53 5.03 -1.26 -3.72 115.26 115.31 1rxj n ASN 82 Ca 0.00 0.59 0.00 0.00 0.87 0.00 0.00 54.58 56.04 1rxj n ASN 82 Cb 0.00 -0.68 -0.08 0.00 -1.02 0.00 0.00 39.78 38.00 1rxj n ASN 82 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1rxj n TYR 83 N -1.94 0.00 -3.76 3.10 4.01 -1.26 -5.07 117.16 112.24 1rxj n TYR 83 Ca 0.03 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.65 1rxj n TYR 83 Cb 0.23 -0.34 -0.08 0.00 -0.31 0.00 0.00 39.34 38.84 1rxj n TYR 83 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1rxj s ARG 84 N -2.46 0.75 -0.17 -0.72 0.52 -1.24 -5.14 118.95 110.49 1rxj s ARG 84 Ca -0.04 -0.40 -0.04 0.00 -0.52 0.00 0.00 55.73 54.73 1rxj s ARG 84 Cb 0.05 0.33 0.07 0.00 0.52 0.00 0.00 34.95 35.92 1rxj s ARG 84 CO 0.40 -0.23 0.16 1.21 0.02 0.00 0.00 175.30 176.86 1rxj s ASN 85 N -1.81 1.63 0.00 0.23 3.84 -1.26 -1.30 114.94 116.28 1rxj s ASN 85 Ca -0.08 -0.27 0.27 0.00 0.21 0.00 0.00 52.86 52.99 1rxj s ASN 85 Cb -0.02 0.11 0.96 0.00 -0.55 0.00 0.00 41.25 41.75 1rxj s ASN 85 CO -0.01 -0.32 1.69 0.00 -2.79 0.00 0.00 177.10 175.67 1rxj n ALA 86 N 5.30 2.76 -3.63 1.71 0.00 -0.50 -4.97 120.51 121.20 1rxj n ALA 86 Ca -0.06 -0.42 -0.28 0.00 0.00 0.00 0.00 53.44 52.68 1rxj n ALA 86 Cb 0.49 -1.16 0.04 0.00 0.00 0.00 0.00 19.45 18.82 1rxj n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1rxj n HIS 87 N -0.17 -1.99 -3.65 0.00 8.25 -1.26 -4.84 115.22 111.56 1rxj n HIS 87 Ca 0.16 0.56 -0.09 0.00 -0.26 0.00 0.00 57.72 58.10 1rxj n HIS 87 Cb 0.35 -3.65 -0.02 0.00 1.12 0.00 0.00 29.99 27.79 1rxj n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1rxj s SER 88 N -3.58 -0.38 -0.11 0.41 1.04 -1.26 -1.02 113.70 108.79 1rxj s SER 88 Ca 0.41 -0.30 -0.11 0.00 0.48 0.00 0.00 55.95 56.43 1rxj s SER 88 Cb -0.13 0.63 0.03 0.00 0.10 0.00 0.00 66.02 66.65 1rxj s SER 88 CO 0.84 -1.10 0.31 0.00 0.98 0.00 0.00 173.24 174.27 1rxj s ALA 89 N -3.73 -0.77 -0.07 5.32 0.00 -0.20 -0.91 121.76 121.40 1rxj s ALA 89 Ca 0.07 0.86 0.03 0.00 0.00 0.00 0.00 51.96 52.91 1rxj s ALA 89 Cb -0.03 -0.49 -0.02 0.00 0.00 0.00 0.00 23.12 22.57 1rxj s ALA 89 CO -0.03 -0.15 -0.14 0.99 0.00 0.00 0.00 175.76 176.43 1rxj s THR 90 N 0.11 3.05 -0.09 0.00 2.01 0.12 -0.93 115.64 119.92 1rxj s THR 90 Ca -0.00 -0.71 0.02 0.00 0.31 0.00 0.00 61.69 61.31 1rxj s THR 90 Cb -0.02 -2.22 -0.02 0.00 0.01 0.00 0.00 72.50 70.25 1rxj s THR 90 CO 0.01 0.57 -0.14 0.42 -0.69 0.00 0.00 174.62 174.79 1rxj s THR 91 N -0.43 3.04 -0.16 -0.82 -4.23 -0.39 -1.17 115.64 111.49 1rxj s THR 91 Ca 0.05 -0.70 -0.05 0.00 -1.18 0.00 0.00 61.69 59.81 1rxj s THR 91 Cb -0.12 -2.23 -0.03 0.00 1.34 0.00 0.00 72.50 71.46 1rxj s THR 91 CO 0.02 0.56 0.00 0.26 -0.54 0.00 0.00 174.62 174.92 1rxj s TRP 92 N -0.23 3.12 -0.09 3.99 0.51 -0.20 -1.34 118.94 124.71 1rxj s TRP 92 Ca 0.01 -0.11 0.03 0.00 -2.12 0.00 0.00 56.10 53.91 1rxj s TRP 92 Cb -0.13 -1.98 0.01 0.00 -0.81 0.00 0.00 33.47 30.56 1rxj s TRP 92 CO 0.03 0.09 -0.19 0.45 -0.51 0.00 0.00 176.95 176.82 1rxj s SER 93 N 0.21 2.53 0.00 2.95 0.15 0.11 -1.32 113.70 118.33 1rxj s SER 93 Ca 0.00 -0.45 0.00 0.00 0.70 0.00 0.00 55.95 56.21 1rxj s SER 93 Cb -0.13 -1.16 0.00 0.00 -1.71 0.00 0.00 66.02 63.02 1rxj s SER 93 CO 0.02 0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.17 1rxj n GLY 94 N 3.66 1.65 3.03 9.45 0.00 -0.35 -1.17 105.19 121.44 1rxj n GLY 94 Ca -0.21 -0.62 -0.12 0.00 0.00 0.00 0.00 46.02 45.08 1rxj n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1rxj s GLN 95 N 1.12 0.25 0.03 1.61 -2.07 -0.62 -1.37 119.66 118.61 1rxj s GLN 95 Ca 0.00 -0.05 -0.24 0.00 -1.82 0.00 0.00 55.36 53.25 1rxj s GLN 95 Cb 0.00 0.11 -0.05 0.00 -1.09 0.00 0.00 33.01 31.97 1rxj s GLN 95 CO 0.00 -0.05 0.74 -0.47 -1.32 0.00 0.00 175.29 174.19 1rxj s TYR 96 N -0.45 3.71 -0.22 9.60 5.04 0.21 -1.55 117.35 133.69 1rxj s TYR 96 Ca -0.05 1.41 0.02 0.00 -2.44 0.00 0.00 57.07 56.01 1rxj s TYR 96 Cb -0.03 -2.79 0.05 0.00 0.35 0.00 0.00 41.96 39.53 1rxj s TYR 96 CO 0.00 0.27 -0.12 0.08 -1.34 0.00 0.00 175.55 174.44 1rxj s VAL 97 N 0.00 1.93 0.80 3.14 1.01 0.41 -1.11 120.40 126.58 1rxj s VAL 97 Ca 0.37 -1.27 -0.08 0.00 0.00 0.00 0.00 61.98 61.01 1rxj s VAL 97 Cb -0.20 -1.98 0.17 0.00 0.00 0.00 0.00 36.38 34.37 1rxj s VAL 97 CO 0.22 0.14 1.09 0.61 0.00 0.00 0.00 175.10 177.15 1rxj n GLY 98 N 4.57 -0.43 0.00 4.51 0.00 -1.26 -1.43 105.19 111.14 1rxj n GLY 98 Ca -0.15 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.00 1rxj n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rxj n GLY 99 N -2.61 -0.27 0.25 -0.02 0.00 -1.26 -4.56 105.19 96.72 1rxj n GLY 99 Ca 0.15 -1.89 0.03 0.00 0.00 0.00 0.00 46.02 44.32 1rxj n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rxj h ALA 100 N 0.00 1.59 -2.17 4.61 0.00 -2.06 -3.08 119.26 118.14 1rxj h ALA 100 Ca 0.00 -0.15 -0.61 0.00 0.00 0.00 0.00 54.91 54.14 1rxj h ALA 100 Cb 0.00 -0.09 -0.41 0.00 0.00 0.00 0.00 17.79 17.29 1rxj h ALA 100 CO 0.00 0.30 -0.49 -1.91 0.00 0.00 0.00 179.25 177.15 1rxj n GLU 101 N -4.34 2.76 -1.94 0.00 4.07 -1.26 -5.07 120.64 114.86 1rxj n GLU 101 Ca -0.00 -4.69 -0.42 0.00 -0.06 0.00 0.00 57.16 51.99 1rxj n GLU 101 Cb 0.21 -2.28 -0.03 0.00 -0.06 0.00 0.00 31.44 29.29 1rxj n GLU 101 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1rxj s ALA 102 N -2.61 3.68 0.17 4.31 0.00 -1.17 -4.79 121.76 121.35 1rxj s ALA 102 Ca 0.40 1.20 -0.21 0.00 0.00 0.00 0.00 51.96 53.35 1rxj s ALA 102 Cb 0.15 -3.69 0.06 0.00 0.00 0.00 0.00 23.12 19.64 1rxj s ALA 102 CO -0.01 -1.10 0.57 -0.98 0.00 0.00 0.00 175.76 174.23 1rxj s ARG 103 N 2.64 1.29 -0.22 0.00 1.70 -0.52 -4.60 118.95 119.24 1rxj s ARG 103 Ca 0.74 -0.58 0.02 0.00 -0.47 0.00 0.00 55.73 55.43 1rxj s ARG 103 Cb -0.39 0.56 0.04 0.00 -0.57 0.00 0.00 34.95 34.59 1rxj s ARG 103 CO 0.32 -0.56 -0.15 0.42 -1.08 0.00 0.00 175.30 174.26 1rxj s ILE 104 N -3.78 2.05 -0.22 4.99 1.01 -0.48 -0.44 121.20 124.33 1rxj s ILE 104 Ca 0.03 -1.27 -0.13 0.00 0.00 0.00 0.00 60.65 59.27 1rxj s ILE 104 Cb -0.01 -2.03 -0.04 0.00 0.01 0.00 0.00 42.46 40.38 1rxj s ILE 104 CO -0.11 0.23 0.28 0.20 0.00 0.00 0.00 174.94 175.54 1rxj s ASN 105 N 1.22 6.27 0.13 3.58 0.01 -0.60 -0.70 114.94 124.85 1rxj s ASN 105 Ca -0.02 0.30 0.04 0.00 -0.71 0.00 0.00 52.86 52.47 1rxj s ASN 105 Cb -0.17 -2.17 -0.04 0.00 0.41 0.00 0.00 41.25 39.28 1rxj s ASN 105 CO -0.09 -0.00 -0.09 0.42 -1.51 0.00 0.00 177.10 175.83 1rxj s THR 106 N 1.19 1.01 0.17 1.60 -4.23 -0.29 -1.59 115.64 113.50 1rxj s THR 106 Ca 0.13 -1.99 0.11 0.00 -1.18 0.00 0.00 61.69 58.75 1rxj s THR 106 Cb -0.14 -1.76 -0.04 0.00 1.34 0.00 0.00 72.50 71.89 1rxj s THR 106 CO 0.06 -0.77 -0.24 -1.10 -0.54 0.00 0.00 174.62 172.03 1rxj s GLN 107 N -3.71 1.43 0.06 3.99 -0.21 -0.32 -2.18 119.66 118.73 1rxj s GLN 107 Ca 0.14 -1.44 0.01 0.00 0.02 0.00 0.00 55.36 54.10 1rxj s GLN 107 Cb 0.03 -1.77 -0.03 0.00 1.00 0.00 0.00 33.01 32.24 1rxj s GLN 107 CO -0.01 0.39 -0.06 1.67 -2.12 0.00 0.00 175.29 175.17 1rxj s TRP 108 N -1.51 0.67 -0.12 0.91 1.48 0.03 -0.71 118.94 119.69 1rxj s TRP 108 Ca 0.17 -0.79 0.00 0.00 -1.06 0.00 0.00 56.10 54.42 1rxj s TRP 108 Cb -0.08 -0.41 0.02 0.00 -1.16 0.00 0.00 33.47 31.83 1rxj s TRP 108 CO 0.08 -0.19 -0.11 -0.51 -4.06 0.00 0.00 176.95 172.16 1rxj s LEU 109 N -2.43 1.42 -0.35 -4.66 1.43 -0.45 -2.03 118.68 111.61 1rxj s LEU 109 Ca 0.01 -0.36 -0.04 0.00 -1.03 0.00 0.00 54.13 52.72 1rxj s LEU 109 Cb -0.00 -0.95 0.06 0.00 0.03 0.00 0.00 46.19 45.34 1rxj s LEU 109 CO -0.04 -0.07 0.10 -0.22 0.23 0.00 0.00 176.35 176.35 1rxj s LEU 110 N 1.45 4.45 -0.23 1.79 2.96 0.17 -1.27 118.68 128.00 1rxj s LEU 110 Ca 0.01 -1.45 -0.10 0.00 -0.22 0.00 0.00 54.13 52.38 1rxj s LEU 110 Cb -0.13 -1.80 -0.05 0.00 0.50 0.00 0.00 46.19 44.71 1rxj s LEU 110 CO -0.07 -0.37 0.14 -0.89 -1.32 0.00 0.00 176.35 173.84 1rxj s THR 111 N 1.27 5.19 0.02 3.68 2.01 -0.11 -0.89 115.64 126.82 1rxj s THR 111 Ca -0.00 0.12 -0.13 0.00 0.31 0.00 0.00 61.69 61.99 1rxj s THR 111 Cb -0.21 -3.41 -0.06 0.00 0.01 0.00 0.00 72.50 68.84 1rxj s THR 111 CO -0.01 0.36 0.40 -0.44 -0.69 0.00 0.00 174.62 174.24 1rxj s SER 112 N 1.03 6.74 0.14 3.53 0.01 0.05 -1.04 113.70 124.17 1rxj s SER 112 Ca 0.07 0.90 -0.31 0.00 1.31 0.00 0.00 55.95 57.91 1rxj s SER 112 Cb -0.14 -2.22 -0.11 0.00 0.21 0.00 0.00 66.02 63.77 1rxj s SER 112 CO 0.04 0.28 1.76 -0.83 0.41 0.00 0.00 173.24 174.90 1rxj s GLY 113 N -1.29 1.34 0.18 3.44 0.00 -0.19 -4.80 107.32 105.99 1rxj s GLY 113 Ca 0.26 1.46 0.03 0.00 0.00 0.00 0.00 44.72 46.47 1rxj s GLY 113 CO 0.14 3.00 -0.03 -0.51 0.00 0.00 0.00 173.10 175.71 1rxj s THR 114 N 2.17 0.87 0.99 0.90 -4.23 -1.26 -5.00 115.64 110.09 1rxj s THR 114 Ca 0.78 -2.01 -0.12 0.00 -1.18 0.00 0.00 61.69 59.16 1rxj s THR 114 Cb -0.46 -2.08 0.19 0.00 1.34 0.00 0.00 72.50 71.48 1rxj s THR 114 CO 0.34 -0.53 1.08 0.42 -0.54 0.00 0.00 174.62 175.40 1rxj s THR 115 N -3.52 2.24 0.29 3.99 -4.23 -1.26 -4.83 115.64 108.32 1rxj s THR 115 Ca 0.23 0.08 -0.03 0.00 -1.18 0.00 0.00 61.69 60.79 1rxj s THR 115 Cb 0.05 -2.47 0.24 0.00 1.34 0.00 0.00 72.50 71.66 1rxj s THR 115 CO 0.04 -0.10 1.93 -0.08 -0.54 0.00 0.00 174.62 175.87 1rxj h GLU 116 N -1.92 1.07 0.00 3.99 4.81 -2.01 -1.89 114.58 118.63 1rxj h GLU 116 Ca -0.54 -0.09 -0.03 0.00 -0.13 0.00 0.00 59.36 58.57 1rxj h GLU 116 Cb 1.31 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 30.46 1rxj h GLU 116 CO 0.55 0.75 -0.15 0.00 -0.73 0.00 0.00 179.01 179.43 1rxj h ALA 117 N 1.43 1.75 -0.39 2.92 0.00 -2.06 -2.52 119.26 120.39 1rxj h ALA 117 Ca 0.28 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1rxj h ALA 117 Cb -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1rxj h ALA 117 CO -0.05 0.19 0.00 0.09 0.00 0.00 0.00 179.25 179.48 1rxj n ASN 118 N -4.36 3.34 0.25 0.00 3.02 -0.83 -4.60 115.26 112.08 1rxj n ASN 118 Ca -0.03 -1.95 0.08 0.00 -0.03 0.00 0.00 54.58 52.65 1rxj n ASN 118 Cb 0.22 -0.25 0.61 0.00 -0.61 0.00 0.00 39.78 39.74 1rxj n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rxj h ALA 119 N 4.00 1.83 0.00 5.41 0.00 -0.90 -1.75 119.26 127.84 1rxj h ALA 119 Ca 0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1rxj h ALA 119 Cb 0.92 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 1rxj h ALA 119 CO 0.00 0.10 -0.02 0.11 0.00 0.00 0.00 179.25 179.44 1rxj h TRP 120 N 0.00 0.00 -0.43 0.00 5.08 -1.81 -2.21 115.95 116.58 1rxj h TRP 120 Ca -0.00 0.00 -0.19 0.00 1.08 0.00 0.00 58.89 59.78 1rxj h TRP 120 Cb 0.14 0.00 -0.11 0.00 -3.00 0.00 0.00 29.16 26.18 1rxj h TRP 120 CO 0.00 0.02 0.04 0.36 -1.28 0.00 0.00 178.44 177.58 1rxj n LYS 121 N -4.20 2.15 0.23 0.12 2.85 -0.66 -4.69 118.16 113.96 1rxj n LYS 121 Ca -0.03 -3.10 0.13 0.00 -1.05 0.00 0.00 58.31 54.26 1rxj n LYS 121 Cb 0.10 -1.88 0.40 0.00 -0.65 0.00 0.00 35.03 33.00 1rxj n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1rxj h SER 122 N 1.20 0.00 -3.19 -5.58 4.64 -1.40 -3.46 113.55 105.76 1rxj h SER 122 Ca 0.24 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 61.01 1rxj h SER 122 Cb 1.80 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 63.53 1rxj h SER 122 CO 0.46 0.09 -0.81 -0.89 -0.87 0.00 0.00 176.83 174.81 1rxj s THR 123 N -3.44 1.19 0.15 2.95 2.01 -1.26 -0.77 115.64 116.47 1rxj s THR 123 Ca 0.03 -0.40 -0.06 0.00 0.31 0.00 0.00 61.69 61.57 1rxj s THR 123 Cb 0.08 -1.16 -0.06 0.00 0.01 0.00 0.00 72.50 71.37 1rxj s THR 123 CO 0.62 0.39 0.41 -0.76 -0.69 0.00 0.00 174.62 174.60 1rxj s LEU 124 N 1.53 4.26 0.05 4.42 1.43 -0.07 -4.92 118.68 125.38 1rxj s LEU 124 Ca 0.03 0.67 0.06 0.00 -1.03 0.00 0.00 54.13 53.86 1rxj s LEU 124 Cb -0.13 -3.35 -0.03 0.00 0.03 0.00 0.00 46.19 42.72 1rxj s LEU 124 CO -0.07 0.04 -0.17 0.54 0.23 0.00 0.00 176.35 176.91 1rxj s VAL 125 N -1.66 1.40 0.00 -1.59 0.11 -1.26 -0.66 120.40 116.74 1rxj s VAL 125 Ca 0.41 -1.16 0.00 0.00 -2.93 0.00 0.00 61.98 58.30 1rxj s VAL 125 Cb -0.12 -1.25 0.00 0.00 -1.53 0.00 0.00 36.38 33.48 1rxj s VAL 125 CO 0.23 0.06 0.00 0.61 -3.33 0.00 0.00 175.10 172.67 1rxj n GLY 126 N 1.74 1.93 3.01 6.54 0.00 -0.86 -4.99 105.19 112.55 1rxj n GLY 126 Ca -0.18 -0.88 -0.13 0.00 0.00 0.00 0.00 46.02 44.83 1rxj n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1rxj s HIS 127 N -5.91 -0.25 -0.02 1.61 -3.43 -1.26 -0.79 115.29 105.24 1rxj s HIS 127 Ca 0.00 0.64 0.06 0.00 -0.80 0.00 0.00 55.06 54.95 1rxj s HIS 127 Cb 0.00 0.00 -0.01 0.00 -1.43 0.00 0.00 32.58 31.14 1rxj s HIS 127 CO 0.00 -0.19 -0.19 -0.51 -2.00 0.00 0.00 174.74 171.85 1rxj s ASP 128 N 1.06 2.31 -0.12 7.38 1.01 -0.93 -4.99 116.67 122.39 1rxj s ASP 128 Ca -0.08 -0.36 0.01 0.00 0.71 0.00 0.00 52.55 52.83 1rxj s ASP 128 Cb -0.09 -0.36 -0.01 0.00 1.01 0.00 0.00 42.92 43.46 1rxj s ASP 128 CO -0.06 0.22 -0.16 -0.89 0.21 0.00 0.00 175.17 174.49 1rxj s THR 129 N -0.34 2.80 -0.12 -1.27 2.01 -1.26 -1.14 115.64 116.32 1rxj s THR 129 Ca 0.05 -0.76 -0.03 0.00 0.31 0.00 0.00 61.69 61.26 1rxj s THR 129 Cb -0.09 -2.15 -0.03 0.00 0.01 0.00 0.00 72.50 70.24 1rxj s THR 129 CO 0.00 0.54 -0.01 -0.36 -0.69 0.00 0.00 174.62 174.09 1rxj s PHE 130 N 0.32 3.10 0.34 4.92 0.40 0.12 -3.41 117.98 123.77 1rxj s PHE 130 Ca -0.12 -0.03 0.04 0.00 -0.60 0.00 0.00 56.93 56.21 1rxj s PHE 130 Cb -0.16 -1.89 -0.04 0.00 0.51 0.00 0.00 43.02 41.45 1rxj s PHE 130 CO 0.06 0.22 0.14 0.95 0.70 0.00 0.00 175.22 177.29 1rxj s THR 131 N -0.22 0.50 -1.14 0.64 -4.23 -0.32 -1.38 115.64 109.48 1rxj s THR 131 Ca 0.05 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.84 1rxj s THR 131 Cb -0.13 -2.49 0.32 0.00 1.34 0.00 0.00 72.50 71.55 1rxj s THR 131 CO 0.02 0.00 1.93 0.29 -0.54 0.00 0.00 174.62 176.32 1rxj n LYS 132 N -0.71 0.14 -4.83 3.99 4.76 -1.26 -0.36 118.16 119.88 1rxj n LYS 132 Ca -0.01 0.02 -0.33 0.00 -2.87 0.00 0.00 58.31 55.11 1rxj n LYS 132 Cb 0.65 -1.50 -0.14 0.00 -1.84 0.00 0.00 35.03 32.20 1rxj n LYS 132 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1rxj s VAL 133 N -2.86 3.06 0.63 -0.18 1.01 -1.26 -4.82 120.40 115.99 1rxj s VAL 133 Ca 0.18 -0.69 -0.19 0.00 0.00 0.00 0.00 61.98 61.28 1rxj s VAL 133 Cb 0.19 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 34.31 1rxj s VAL 133 CO 0.49 0.56 1.31 -0.54 0.00 0.00 0.00 175.10 176.92 1rxj s LYS 134 N -0.20 2.63 0.00 2.72 1.02 -1.26 -4.70 119.74 119.96 1rxj s LYS 134 Ca 0.00 2.11 0.06 0.00 0.02 0.00 0.00 55.97 58.17 1rxj s LYS 134 Cb -0.13 -1.91 0.38 0.00 -0.52 0.00 0.00 37.83 35.64 1rxj s LYS 134 CO 0.03 -1.55 0.84 -0.35 -0.92 0.00 0.00 175.35 173.41