#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dxp n PRO 2 N 0.00 0.62 -4.36 0.00 -0.04 -1.26 -4.87 135.00 125.10 1dxp n PRO 2 Ca 0.00 0.03 -0.31 0.00 -0.04 0.00 0.00 63.50 63.19 1dxp n PRO 2 Cb 0.00 -1.74 -0.10 0.00 -0.04 0.00 0.00 33.50 31.62 1dxp n PRO 2 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1dxp s ILE 3 N -3.40 3.41 0.34 0.52 1.01 -1.26 -5.08 121.20 116.73 1dxp s ILE 3 Ca -0.03 -1.08 0.09 0.00 0.00 0.00 0.00 60.65 59.63 1dxp s ILE 3 Cb 0.11 -2.54 -0.06 0.00 0.01 0.00 0.00 42.46 39.98 1dxp s ILE 3 CO 0.83 0.23 -0.02 0.42 0.00 0.00 0.00 174.94 176.40 1dxp s THR 4 N -1.11 2.54 -0.07 2.92 -4.23 -1.26 -4.90 115.64 109.52 1dxp s THR 4 Ca 0.19 -2.04 -0.14 0.00 -1.18 0.00 0.00 61.69 58.52 1dxp s THR 4 Cb -0.11 -2.75 0.03 0.00 1.34 0.00 0.00 72.50 71.01 1dxp s THR 4 CO 0.11 -0.21 0.35 0.00 -0.54 0.00 0.00 174.62 174.33 1dxp s ALA 5 N -2.54 -0.88 0.09 3.99 0.00 -1.26 -5.07 121.76 116.09 1dxp s ALA 5 Ca 0.34 0.70 0.02 0.00 0.00 0.00 0.00 51.96 53.02 1dxp s ALA 5 Cb 0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 1dxp s ALA 5 CO 0.19 -0.22 -0.07 1.52 0.00 0.00 0.00 175.76 177.17 1dxp s TYR 6 N -0.61 0.86 0.39 0.00 -0.85 -1.26 -4.85 117.35 111.03 1dxp s TYR 6 Ca -0.07 -0.79 0.02 0.00 -0.52 0.00 0.00 57.07 55.71 1dxp s TYR 6 Cb -0.04 -0.50 -0.01 0.00 0.38 0.00 0.00 41.96 41.79 1dxp s TYR 6 CO 0.03 -0.12 0.59 -1.54 -1.52 0.00 0.00 175.55 172.99 1dxp s SER 7 N -2.64 5.99 -0.10 -0.18 1.04 -1.26 -4.94 113.70 111.61 1dxp s SER 7 Ca 0.06 0.22 -0.05 0.00 0.48 0.00 0.00 55.95 56.66 1dxp s SER 7 Cb 0.01 -1.60 0.05 0.00 0.10 0.00 0.00 66.02 64.57 1dxp s SER 7 CO -0.03 -0.53 0.23 -1.10 0.98 0.00 0.00 173.24 172.79 1dxp s GLN 8 N -4.40 0.19 0.37 4.02 -0.21 -1.26 -5.11 119.66 113.26 1dxp s GLN 8 Ca 0.45 0.51 -0.13 0.00 0.02 0.00 0.00 55.36 56.21 1dxp s GLN 8 Cb -0.10 -0.13 -0.08 0.00 1.00 0.00 0.00 33.01 33.70 1dxp s GLN 8 CO 0.36 -0.17 0.77 -1.14 -2.12 0.00 0.00 175.29 172.99 1dxp s GLN 9 N 1.28 3.90 0.00 2.91 0.74 -1.26 -5.00 119.66 122.23 1dxp s GLN 9 Ca -0.09 0.60 0.00 0.00 0.05 0.00 0.00 55.36 55.92 1dxp s GLN 9 Cb -0.11 -2.39 0.00 0.00 1.10 0.00 0.00 33.01 31.61 1dxp s GLN 9 CO -0.08 0.05 0.00 0.25 -0.55 0.00 0.00 175.29 174.95 1dxp n THR 10 N -0.85 0.00 -3.94 -0.34 -2.24 -1.26 -5.08 114.28 100.57 1dxp n THR 10 Ca 0.03 -0.16 -0.09 0.00 -2.27 0.00 0.00 64.05 61.56 1dxp n THR 10 Cb 0.54 0.64 -0.06 0.00 -2.10 0.00 0.00 70.33 69.35 1dxp n THR 10 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1dxp s ARG 11 N -1.47 1.35 0.00 -0.78 0.52 -1.26 -5.11 118.95 112.20 1dxp s ARG 11 Ca 0.00 -1.16 0.00 0.00 -0.52 0.00 0.00 55.73 54.05 1dxp s ARG 11 Cb 0.00 0.44 0.00 0.00 0.52 0.00 0.00 34.95 35.91 1dxp s ARG 11 CO 0.00 -0.54 0.00 0.41 0.02 0.00 0.00 175.30 175.19 1dxp n GLY 12 N -0.31 5.33 0.28 -3.53 0.00 -1.26 -4.95 105.19 100.75 1dxp n GLY 12 Ca -0.05 -1.61 -0.10 0.00 0.00 0.00 0.00 46.02 44.26 1dxp n GLY 12 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1dxp h LEU 13 N 0.00 -0.85 -1.00 0.99 3.38 -2.03 -0.15 115.31 115.65 1dxp h LEU 13 Ca 0.00 0.08 0.08 0.00 0.09 0.00 0.00 57.88 58.13 1dxp h LEU 13 Cb 0.00 0.29 -0.07 0.00 0.09 0.00 0.00 40.66 40.97 1dxp h LEU 13 CO 0.00 -0.35 0.64 -0.07 0.09 0.00 0.00 178.44 178.75 1dxp h LEU 14 N -0.51 1.00 -1.33 1.67 -0.00 -2.00 2.32 115.31 116.47 1dxp h LEU 14 Ca -0.02 0.02 -0.07 0.00 -0.00 0.00 0.00 57.88 57.81 1dxp h LEU 14 Cb 0.47 -0.19 -0.01 0.00 -0.00 0.00 0.00 40.66 40.93 1dxp h LEU 14 CO -0.09 0.61 -0.33 1.23 -0.00 0.00 0.00 178.44 179.85 1dxp h GLY 15 N 1.12 0.00 0.25 0.83 0.00 -1.95 -2.10 103.07 101.23 1dxp h GLY 15 Ca 0.45 -0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.77 1dxp h GLY 15 CO -0.20 0.00 -0.12 0.00 0.00 0.00 0.00 176.54 176.22 1dxp h ILE 17 N -0.64 0.55 -0.24 0.00 2.04 -1.22 0.22 117.51 118.22 1dxp h ILE 17 Ca -0.03 -0.15 -0.04 0.00 1.00 0.00 0.00 64.86 65.63 1dxp h ILE 17 Cb 0.26 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 1dxp h ILE 17 CO 0.06 0.08 -0.04 0.40 0.00 0.00 0.00 178.15 178.65 1dxp h ILE 18 N 0.44 1.17 0.00 -0.67 2.04 -1.45 -2.93 117.51 116.10 1dxp h ILE 18 Ca 0.51 -0.70 -0.14 0.00 1.00 0.00 0.00 64.86 65.53 1dxp h ILE 18 Cb 0.89 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 1dxp h ILE 18 CO -0.48 0.23 -0.99 0.74 0.00 0.00 0.00 178.15 177.65 1dxp h THR 19 N 0.36 0.72 -0.02 -0.27 2.02 0.02 -2.90 112.91 112.82 1dxp h THR 19 Ca 0.08 -2.16 -0.13 0.00 0.77 0.00 0.00 66.41 64.97 1dxp h THR 19 Cb 0.30 2.24 -0.02 0.00 -1.74 0.00 0.00 68.15 68.94 1dxp h THR 19 CO 0.01 0.41 -0.58 0.77 0.37 0.00 0.00 175.52 176.50 1dxp h SER 20 N 0.00 0.08 1.05 4.18 4.64 -1.35 0.25 113.55 122.40 1dxp h SER 20 Ca -0.08 -0.04 -0.20 0.00 -0.47 0.00 0.00 61.79 60.99 1dxp h SER 20 Cb 1.50 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 63.54 1dxp h SER 20 CO 0.06 0.64 -0.94 -0.07 -0.87 0.00 0.00 176.83 175.65 1dxp h LEU 21 N 0.05 0.00 0.00 5.97 3.38 -1.54 -3.37 115.31 119.80 1dxp h LEU 21 Ca -0.01 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.73 1dxp h LEU 21 Cb 1.04 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.75 1dxp h LEU 21 CO 0.08 0.94 -1.90 0.35 0.09 0.00 0.00 178.44 178.01 1dxp n THR 22 N -3.34 0.90 -0.68 0.22 -2.24 -1.10 -5.01 114.28 103.03 1dxp n THR 22 Ca 0.00 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1dxp n THR 22 Cb 0.92 -0.98 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 1dxp n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dxp n GLY 23 N 2.64 0.67 3.18 3.38 0.00 0.86 -4.81 105.19 111.10 1dxp n GLY 23 Ca -0.27 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 1dxp n GLY 23 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1dxp s ARG 24 N -0.32 3.07 -0.22 1.61 3.52 -1.25 -2.19 118.95 123.17 1dxp s ARG 24 Ca 0.00 -0.79 -0.00 0.00 -0.13 0.00 0.00 55.73 54.80 1dxp s ARG 24 Cb 0.00 -2.72 0.02 0.00 -1.56 0.00 0.00 34.95 30.69 1dxp s ARG 24 CO 0.00 -0.23 -0.11 0.34 -0.81 0.00 0.00 175.30 174.49 1dxp s ASP 25 N 1.34 3.94 0.00 -2.12 -1.08 0.46 -4.79 116.67 114.42 1dxp s ASP 25 Ca 0.05 -0.80 0.24 0.00 -0.52 0.00 0.00 52.55 51.51 1dxp s ASP 25 Cb -0.14 -1.60 0.30 0.00 -1.46 0.00 0.00 42.92 40.02 1dxp s ASP 25 CO -0.10 -0.08 1.27 0.29 0.52 0.00 0.00 175.17 177.07 1dxp n LYS 26 N 4.64 0.41 -1.48 4.34 5.02 -1.26 -2.85 118.16 126.98 1dxp n LYS 26 Ca -0.18 -0.29 -0.36 0.00 -2.02 0.00 0.00 58.31 55.47 1dxp n LYS 26 Cb 0.48 -1.49 0.09 0.00 -0.02 0.00 0.00 35.03 34.08 1dxp n LYS 26 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1dxp n ASN 27 N -1.04 1.42 -4.72 4.39 5.03 -1.26 -4.94 115.26 114.13 1dxp n ASN 27 Ca 0.07 0.73 -0.41 0.00 0.87 0.00 0.00 54.58 55.84 1dxp n ASN 27 Cb 0.36 -1.51 -0.04 0.00 -1.02 0.00 0.00 39.78 37.57 1dxp n ASN 27 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 1dxp s GLN 28 N -3.55 4.62 -0.20 3.52 -0.44 -1.26 -5.00 119.66 117.36 1dxp s GLN 28 Ca 0.78 1.37 -0.10 0.00 -2.50 0.00 0.00 55.36 54.91 1dxp s GLN 28 Cb -0.35 -3.41 -0.05 0.00 -1.64 0.00 0.00 33.01 27.56 1dxp s GLN 28 CO 0.45 0.13 0.14 0.08 0.50 0.00 0.00 175.29 176.59 1dxp s VAL 29 N 0.37 5.40 0.06 1.34 1.01 -1.26 -5.08 120.40 122.24 1dxp s VAL 29 Ca 0.47 0.21 -0.00 0.00 0.00 0.00 0.00 61.98 62.66 1dxp s VAL 29 Cb -0.22 -3.48 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 1dxp s VAL 29 CO 0.28 0.44 -0.04 -0.62 0.00 0.00 0.00 175.10 175.16 1dxp s ASP 30 N 0.35 0.65 0.00 3.32 2.15 -1.26 -4.02 116.67 117.86 1dxp s ASP 30 Ca 0.09 -0.98 0.00 0.00 0.43 0.00 0.00 52.55 52.09 1dxp s ASP 30 Cb -0.11 0.17 0.00 0.00 -0.30 0.00 0.00 42.92 42.68 1dxp s ASP 30 CO -0.02 -0.55 0.00 0.61 -0.17 0.00 0.00 175.17 175.04 1dxp n GLY 31 N 0.14 1.95 0.19 2.66 0.00 -1.25 -4.76 105.19 104.12 1dxp n GLY 31 Ca -0.14 -2.01 0.10 0.00 0.00 0.00 0.00 46.02 43.97 1dxp n GLY 31 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1dxp h GLU 32 N 0.00 0.00 -4.29 1.61 3.07 -1.95 0.17 114.58 113.19 1dxp h GLU 32 Ca 0.00 0.00 -0.50 0.00 -0.50 0.00 0.00 59.36 58.36 1dxp h GLU 32 Cb 0.00 0.00 -0.35 0.00 -0.84 0.00 0.00 28.75 27.56 1dxp h GLU 32 CO 0.00 0.07 -0.80 0.08 -1.40 0.00 0.00 179.01 176.96 1dxp s VAL 33 N -3.20 0.98 -0.06 3.13 1.01 -1.26 -1.55 120.40 119.45 1dxp s VAL 33 Ca 0.05 -0.32 -0.16 0.00 0.00 0.00 0.00 61.98 61.55 1dxp s VAL 33 Cb 0.06 -0.96 -0.05 0.00 0.00 0.00 0.00 36.38 35.43 1dxp s VAL 33 CO 0.71 0.34 0.42 -1.10 0.00 0.00 0.00 175.10 175.47 1dxp s GLN 34 N 1.25 4.10 -0.21 2.72 -1.52 0.13 -4.91 119.66 121.22 1dxp s GLN 34 Ca -0.04 0.39 -0.21 0.00 -1.95 0.00 0.00 55.36 53.55 1dxp s GLN 34 Cb -0.14 -3.32 -0.02 0.00 -0.22 0.00 0.00 33.01 29.31 1dxp s GLN 34 CO -0.03 0.46 0.66 0.08 -0.25 0.00 0.00 175.29 176.21 1dxp s VAL 35 N -0.33 4.99 0.06 1.09 1.01 -1.26 -0.87 120.40 125.09 1dxp s VAL 35 Ca 0.24 1.24 0.07 0.00 0.00 0.00 0.00 61.98 63.52 1dxp s VAL 35 Cb -0.16 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.22 1dxp s VAL 35 CO 0.11 0.08 -0.16 -0.76 0.00 0.00 0.00 175.10 174.37 1dxp s LEU 36 N 2.10 2.75 0.02 3.92 1.43 -0.34 -4.99 118.68 123.57 1dxp s LEU 36 Ca 0.29 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 52.98 1dxp s LEU 36 Cb -0.16 -1.60 -0.02 0.00 0.03 0.00 0.00 46.19 44.44 1dxp s LEU 36 CO 0.10 0.23 -0.03 -0.55 0.23 0.00 0.00 176.35 176.33 1dxp s SER 37 N -1.69 0.23 0.00 2.29 0.15 -1.26 -1.09 113.70 112.34 1dxp s SER 37 Ca 0.17 -0.39 0.00 0.00 0.70 0.00 0.00 55.95 56.43 1dxp s SER 37 Cb -0.11 0.07 0.00 0.00 -1.71 0.00 0.00 66.02 64.28 1dxp s SER 37 CO 0.08 -0.22 0.00 0.35 1.20 0.00 0.00 173.24 174.64 1dxp n THR 38 N 1.93 0.00 -0.12 6.45 -2.24 -0.36 -5.01 114.28 114.92 1dxp n THR 38 Ca -0.21 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.44 1dxp n THR 38 Cb 0.56 -0.02 -0.02 0.00 -2.10 0.00 0.00 70.33 68.75 1dxp n THR 38 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1dxp h ALA 39 N 0.92 0.55 0.00 6.98 0.00 -2.00 -3.34 119.26 122.37 1dxp h ALA 39 Ca 0.00 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.38 1dxp h ALA 39 Cb 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1dxp h ALA 39 CO 0.00 0.60 -1.72 0.25 0.00 0.00 0.00 179.25 178.37 1dxp n THR 40 N -4.14 0.40 -4.24 0.00 -2.24 -1.26 -5.06 114.28 97.74 1dxp n THR 40 Ca -0.02 -0.41 -0.16 0.00 -2.27 0.00 0.00 64.05 61.19 1dxp n THR 40 Cb 0.50 -0.21 -0.09 0.00 -2.10 0.00 0.00 70.33 68.43 1dxp n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1dxp s GLN 41 N -2.63 1.51 -0.03 -0.78 -2.07 -1.26 -5.16 119.66 109.24 1dxp s GLN 41 Ca -0.05 -1.84 -0.01 0.00 -1.82 0.00 0.00 55.36 51.64 1dxp s GLN 41 Cb 0.06 0.31 0.02 0.00 -1.09 0.00 0.00 33.01 32.31 1dxp s GLN 41 CO 0.53 -0.54 0.07 0.45 -1.32 0.00 0.00 175.29 174.49 1dxp s SER 42 N -3.27 -0.02 0.22 12.60 0.15 -1.26 -1.23 113.70 120.89 1dxp s SER 42 Ca 0.40 0.14 -0.11 0.00 0.70 0.00 0.00 55.95 57.07 1dxp s SER 42 Cb 0.04 0.06 0.04 0.00 -1.71 0.00 0.00 66.02 64.46 1dxp s SER 42 CO 0.20 -0.10 0.57 2.22 1.20 0.00 0.00 173.24 177.34 1dxp n PHE 43 N 3.84 -1.69 -4.33 3.44 -1.74 -0.25 -4.22 117.46 112.51 1dxp n PHE 43 Ca -0.23 -1.13 -0.22 0.00 -0.56 0.00 0.00 57.45 55.31 1dxp n PHE 43 Cb 0.54 0.56 -0.11 0.00 1.52 0.00 0.00 39.48 41.99 1dxp n PHE 43 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1dxp s LEU 44 N 0.00 2.43 0.02 5.98 1.43 0.44 -1.20 118.68 127.79 1dxp s LEU 44 Ca 0.12 -0.85 0.07 0.00 -1.03 0.00 0.00 54.13 52.43 1dxp s LEU 44 Cb -0.03 -0.83 -0.02 0.00 0.03 0.00 0.00 46.19 45.34 1dxp s LEU 44 CO 0.07 -0.03 -0.21 0.00 0.23 0.00 0.00 176.35 176.41 1dxp s ALA 45 N -2.02 1.74 -0.19 4.21 0.00 -0.04 -3.93 121.76 121.53 1dxp s ALA 45 Ca 0.15 -1.00 -0.04 0.00 0.00 0.00 0.00 51.96 51.08 1dxp s ALA 45 Cb -0.06 -0.38 -0.02 0.00 0.00 0.00 0.00 23.12 22.66 1dxp s ALA 45 CO 0.06 0.40 -0.03 0.99 0.00 0.00 0.00 175.76 177.19 1dxp s THR 46 N -0.68 3.75 -0.54 0.00 2.01 -0.70 0.18 115.64 119.66 1dxp s THR 46 Ca 0.08 -0.39 -0.27 0.00 0.31 0.00 0.00 61.69 61.42 1dxp s THR 46 Cb -0.08 -2.67 0.03 0.00 0.01 0.00 0.00 72.50 69.78 1dxp s THR 46 CO 0.01 0.45 1.07 0.00 -0.69 0.00 0.00 174.62 175.46 1dxp s VAL 48 N 4.41 2.33 -1.42 0.00 1.01 0.71 -0.52 120.40 126.93 1dxp s VAL 48 Ca 0.39 -0.90 -0.07 0.00 0.00 0.00 0.00 61.98 61.40 1dxp s VAL 48 Cb -0.09 -1.94 0.01 0.00 0.00 0.00 0.00 36.38 34.35 1dxp s VAL 48 CO 0.25 0.54 0.30 0.59 0.00 0.00 0.00 175.10 176.78 1dxp n ASN 49 N 3.87 -0.71 0.00 3.32 3.02 -0.98 -1.64 115.26 122.14 1dxp n ASN 49 Ca -0.19 -1.18 0.00 0.00 -0.03 0.00 0.00 54.58 53.18 1dxp n ASN 49 Cb 0.52 -2.19 0.00 0.00 -0.61 0.00 0.00 39.78 37.50 1dxp n ASN 49 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1dxp n GLY 50 N -2.26 0.49 3.23 7.41 0.00 -1.26 -4.98 105.19 107.82 1dxp n GLY 50 Ca -0.27 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 1dxp n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dxp s VAL 51 N -2.29 2.35 -0.30 1.61 1.01 -0.65 -1.08 120.40 121.05 1dxp s VAL 51 Ca 0.00 -0.89 -0.29 0.00 0.00 0.00 0.00 61.98 60.80 1dxp s VAL 51 Cb 0.00 -1.96 0.00 0.00 0.00 0.00 0.00 36.38 34.43 1dxp s VAL 51 CO 0.00 0.54 1.27 0.00 0.00 0.00 0.00 175.10 176.91 1dxp s TRP 53 N 4.27 2.80 0.29 0.00 0.52 -0.13 -1.48 118.94 125.20 1dxp s TRP 53 Ca 0.55 -0.26 -0.02 0.00 0.02 0.00 0.00 56.10 56.38 1dxp s TRP 53 Cb -0.16 -1.73 0.01 0.00 -1.15 0.00 0.00 33.47 30.44 1dxp s TRP 53 CO 0.22 0.09 0.40 -2.37 0.02 0.00 0.00 176.95 175.32 1dxp n THR 54 N 2.71 0.00 -3.15 2.01 5.66 0.03 -1.72 114.28 119.82 1dxp n THR 54 Ca -0.18 -1.43 -0.39 0.00 -3.05 0.00 0.00 64.05 59.01 1dxp n THR 54 Cb 0.52 0.89 -0.06 0.00 -1.55 0.00 0.00 70.33 70.14 1dxp n THR 54 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1dxp s VAL 55 N -2.73 4.84 0.34 1.08 -7.23 -1.26 -0.35 120.40 115.09 1dxp s VAL 55 Ca 0.23 1.34 0.10 0.00 -1.81 0.00 0.00 61.98 61.85 1dxp s VAL 55 Cb -0.01 -3.98 0.08 0.00 0.56 0.00 0.00 36.38 33.03 1dxp s VAL 55 CO 0.17 0.42 1.79 0.22 -0.31 0.00 0.00 175.10 177.38 1dxp h TYR 56 N 5.52 0.11 0.00 2.82 5.03 -1.30 -1.12 116.97 128.04 1dxp h TYR 56 Ca -0.45 -0.03 0.00 0.00 2.58 0.00 0.00 58.73 60.83 1dxp h TYR 56 Cb 1.20 -0.03 0.00 0.00 1.55 0.00 0.00 36.73 39.46 1dxp h TYR 56 CO 0.66 0.46 0.00 -2.39 -1.32 0.00 0.00 178.16 175.57 1dxp n HIS 57 N -4.08 0.00 -0.11 -3.82 1.44 -1.26 -1.55 115.22 105.83 1dxp n HIS 57 Ca -0.02 0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.52 1dxp n HIS 57 Cb 0.43 -0.49 -0.10 0.00 0.12 0.00 0.00 29.99 29.95 1dxp n HIS 57 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1dxp n GLY 58 N -0.81 -0.32 0.01 -1.39 0.00 -0.48 -4.73 105.19 97.47 1dxp n GLY 58 Ca 0.02 -0.14 0.11 0.00 0.00 0.00 0.00 46.02 46.00 1dxp n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dxp n ALA 59 N -3.31 3.92 -0.95 4.61 0.00 -0.87 -4.95 120.51 118.96 1dxp n ALA 59 Ca -0.40 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.50 1dxp n ALA 59 Cb 0.90 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 19.55 1dxp n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dxp n GLY 60 N 1.41 3.89 0.46 0.00 0.00 -0.60 -1.55 105.19 108.81 1dxp n GLY 60 Ca 0.01 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.11 1dxp n GLY 60 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dxp n SER 61 N 7.12 1.87 -4.84 1.61 3.41 -1.26 -4.88 113.62 116.64 1dxp n SER 61 Ca 0.00 -3.65 -0.31 0.00 -0.26 0.00 0.00 58.87 54.64 1dxp n SER 61 Cb 0.00 -0.50 0.01 0.00 -0.26 0.00 0.00 64.21 63.47 1dxp n SER 61 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1dxp s LYS 62 N -3.09 3.41 0.75 4.33 1.02 -0.59 -4.84 119.74 120.73 1dxp s LYS 62 Ca 0.36 0.93 -0.11 0.00 0.02 0.00 0.00 55.97 57.17 1dxp s LYS 62 Cb 0.34 -2.05 0.04 0.00 -0.52 0.00 0.00 37.83 35.64 1dxp s LYS 62 CO -0.04 -0.72 1.08 0.95 -0.92 0.00 0.00 175.35 175.70 1dxp s THR 63 N -2.91 3.52 -0.26 2.17 -4.23 -1.26 -4.51 115.64 108.16 1dxp s THR 63 Ca 0.58 0.49 -0.07 0.00 -1.18 0.00 0.00 61.69 61.52 1dxp s THR 63 Cb -0.13 -3.26 -0.01 0.00 1.34 0.00 0.00 72.50 70.44 1dxp s THR 63 CO 0.47 -0.64 0.05 -0.22 -0.54 0.00 0.00 174.62 173.74 1dxp s LEU 64 N -5.64 3.51 0.00 4.79 2.96 -0.82 -4.86 118.68 118.62 1dxp s LEU 64 Ca 0.59 -0.44 -0.38 0.00 -0.22 0.00 0.00 54.13 53.68 1dxp s LEU 64 Cb -0.14 -1.87 -0.17 0.00 0.50 0.00 0.00 46.19 44.51 1dxp s LEU 64 CO 0.54 -0.10 1.40 0.00 -1.32 0.00 0.00 176.35 176.87 1dxp n ALA 65 N 4.88 -1.05 -3.98 5.97 0.00 -1.26 -0.80 120.51 124.27 1dxp n ALA 65 Ca -0.16 0.50 -0.13 0.00 0.00 0.00 0.00 53.44 53.65 1dxp n ALA 65 Cb 0.50 -2.08 -0.03 0.00 0.00 0.00 0.00 19.45 17.84 1dxp n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dxp n GLY 66 N 2.77 3.71 0.19 0.00 0.00 -0.98 -4.51 105.19 106.38 1dxp n GLY 66 Ca 0.20 -2.03 -0.16 0.00 0.00 0.00 0.00 46.02 44.03 1dxp n GLY 66 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1dxp h PRO 67 N 0.00 0.64 -1.42 1.61 0.10 -1.84 1.36 132.00 132.44 1dxp h PRO 67 Ca -0.15 -0.48 -0.69 0.00 0.10 0.00 0.00 66.00 64.77 1dxp h PRO 67 Cb 0.58 0.08 -0.31 0.00 0.10 0.00 0.00 31.00 31.45 1dxp h PRO 67 CO 0.25 1.10 0.64 1.63 0.10 0.00 0.00 178.00 181.71 1dxp n LYS 68 N -4.16 2.87 -0.09 1.05 5.02 -1.26 -4.65 118.16 116.95 1dxp n LYS 68 Ca -0.07 -3.58 0.01 0.00 -2.02 0.00 0.00 58.31 52.65 1dxp n LYS 68 Cb 0.61 -2.28 -0.00 0.00 -0.02 0.00 0.00 35.03 33.34 1dxp n LYS 68 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1dxp n GLY 69 N -0.71 -1.52 3.77 0.72 0.00 -1.17 -4.97 105.19 101.32 1dxp n GLY 69 Ca 0.55 -1.50 -0.40 0.00 0.00 0.00 0.00 46.02 44.67 1dxp n GLY 69 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1dxp s PRO 70 N -1.39 4.27 -0.20 1.61 0.02 -0.93 -3.54 135.00 134.84 1dxp s PRO 70 Ca 0.00 2.08 -0.10 0.00 0.02 0.00 0.00 61.00 63.01 1dxp s PRO 70 Cb 0.00 -2.96 -0.05 0.00 0.02 0.00 0.00 34.50 31.51 1dxp s PRO 70 CO 0.00 -0.21 0.12 0.42 -0.33 0.00 0.00 177.00 177.00 1dxp s ILE 71 N -1.21 5.27 0.15 2.83 1.01 0.02 -4.88 121.20 124.39 1dxp s ILE 71 Ca 0.51 0.14 -0.29 0.00 0.00 0.00 0.00 60.65 61.01 1dxp s ILE 71 Cb -0.37 -3.41 -0.07 0.00 0.01 0.00 0.00 42.46 38.62 1dxp s ILE 71 CO 0.48 0.43 0.92 -0.89 0.00 0.00 0.00 174.94 175.88 1dxp s THR 72 N 0.48 4.37 0.39 2.92 2.01 -1.26 -1.95 115.64 122.60 1dxp s THR 72 Ca 0.07 2.01 -0.26 0.00 0.31 0.00 0.00 61.69 63.82 1dxp s THR 72 Cb -0.12 -4.29 -0.11 0.00 0.01 0.00 0.00 72.50 67.99 1dxp s THR 72 CO -0.01 0.40 1.13 0.00 -0.69 0.00 0.00 174.62 175.46 1dxp n GLN 73 N 2.26 1.65 0.00 4.92 6.02 -1.26 -4.61 117.38 126.36 1dxp n GLN 73 Ca -0.00 0.59 0.08 0.00 -0.01 0.00 0.00 57.00 57.66 1dxp n GLN 73 Cb 0.48 -2.16 0.01 0.00 1.02 0.00 0.00 30.24 29.59 1dxp n GLN 73 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1dxp n MET 74 N 0.25 1.60 -3.68 -1.09 0.00 -0.12 -4.93 117.12 109.14 1dxp n MET 74 Ca 0.08 -0.98 -0.11 0.00 0.00 0.00 0.00 57.70 56.69 1dxp n MET 74 Cb 0.38 -1.30 -0.12 0.00 0.00 0.00 0.00 33.22 32.18 1dxp n MET 74 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 175.97 175.50 1dxp s TYR 75 N -1.84 -0.55 -0.21 3.17 6.14 -0.90 -4.97 117.35 118.19 1dxp s TYR 75 Ca 0.15 1.17 -0.04 0.00 0.64 0.00 0.00 57.07 58.99 1dxp s TYR 75 Cb 0.14 0.15 0.09 0.00 0.42 0.00 0.00 41.96 42.76 1dxp s TYR 75 CO 0.37 -0.36 0.20 0.99 0.64 0.00 0.00 175.55 177.39 1dxp s THR 76 N 1.97 -0.27 -0.38 4.34 2.01 -1.26 -0.95 115.64 121.10 1dxp s THR 76 Ca -0.05 -0.21 0.02 0.00 0.31 0.00 0.00 61.69 61.76 1dxp s THR 76 Cb -0.11 -0.71 0.15 0.00 0.01 0.00 0.00 72.50 71.84 1dxp s THR 76 CO -0.11 -0.29 0.26 0.21 -0.69 0.00 0.00 174.62 174.01 1dxp s ASN 77 N 2.27 2.49 0.27 3.53 3.04 -0.08 -5.02 114.94 121.46 1dxp s ASN 77 Ca 0.06 -2.55 0.00 0.00 0.04 0.00 0.00 52.86 50.42 1dxp s ASN 77 Cb -0.16 -0.47 0.63 0.00 -1.54 0.00 0.00 41.25 39.72 1dxp s ASN 77 CO -0.15 -0.25 1.67 0.58 -3.04 0.00 0.00 177.10 175.90 1dxp h VAL 78 N 4.89 0.42 -0.15 -5.21 2.07 -1.95 -0.63 116.25 115.69 1dxp h VAL 78 Ca 0.13 -0.10 -0.06 0.00 0.82 0.00 0.00 66.70 67.50 1dxp h VAL 78 Cb 0.94 0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1dxp h VAL 78 CO 0.32 0.05 -0.13 0.44 0.02 0.00 0.00 177.57 178.27 1dxp h ASP 79 N 0.28 0.37 0.36 0.57 3.32 -1.95 -1.08 116.42 118.29 1dxp h ASP 79 Ca 0.51 -0.47 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1dxp h ASP 79 Cb 0.96 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1dxp h ASP 79 CO -0.57 0.76 0.00 0.00 -1.72 0.00 0.00 179.24 177.70 1dxp n GLN 80 N -4.58 0.17 -2.20 3.56 10.64 -0.95 -4.85 117.38 119.18 1dxp n GLN 80 Ca -0.06 0.16 -0.20 0.00 -1.83 0.00 0.00 57.00 55.07 1dxp n GLN 80 Cb 0.35 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 28.20 1dxp n GLN 80 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1dxp n ASP 81 N -1.34 -5.66 -4.42 2.61 2.03 -0.33 -4.93 116.55 104.51 1dxp n ASP 81 Ca 0.07 0.10 -0.33 0.00 0.52 0.00 0.00 54.79 55.15 1dxp n ASP 81 Cb 0.14 -4.74 -0.14 0.00 -0.72 0.00 0.00 41.12 35.67 1dxp n ASP 81 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1dxp s LEU 82 N -5.49 2.76 0.17 -2.67 2.96 -0.70 -0.89 118.68 114.81 1dxp s LEU 82 Ca 0.00 -0.26 0.03 0.00 -0.22 0.00 0.00 54.13 53.69 1dxp s LEU 82 Cb 0.00 -1.60 -0.05 0.00 0.50 0.00 0.00 46.19 45.05 1dxp s LEU 82 CO 0.00 0.25 -0.05 0.68 -1.32 0.00 0.00 176.35 175.90 1dxp s VAL 83 N -0.13 0.98 -0.09 1.68 -7.23 0.52 -0.90 120.40 115.23 1dxp s VAL 83 Ca -0.01 -2.02 -0.04 0.00 -1.81 0.00 0.00 61.98 58.10 1dxp s VAL 83 Cb -0.14 -2.01 0.05 0.00 0.56 0.00 0.00 36.38 34.84 1dxp s VAL 83 CO 0.03 -0.60 0.20 -0.83 -0.31 0.00 0.00 175.10 173.60 1dxp s GLY 84 N -3.19 -0.06 -0.01 2.32 0.00 -0.12 -0.79 107.32 105.47 1dxp s GLY 84 Ca 0.21 0.79 0.04 0.00 0.00 0.00 0.00 44.72 45.76 1dxp s GLY 84 CO 0.03 1.43 -0.12 -0.98 0.00 0.00 0.00 173.10 173.45 1dxp s TRP 85 N 1.72 2.75 -0.31 1.90 0.51 -0.55 -0.95 118.94 124.00 1dxp s TRP 85 Ca -0.04 -0.13 -0.44 0.00 -2.12 0.00 0.00 56.10 53.37 1dxp s TRP 85 Cb -0.11 -1.59 -0.19 0.00 -0.81 0.00 0.00 33.47 30.77 1dxp s TRP 85 CO -0.07 0.27 1.50 -2.30 -0.51 0.00 0.00 176.95 175.84 1dxp n PRO 86 N 1.88 0.29 -2.24 4.98 -0.02 -1.26 -1.13 135.00 137.50 1dxp n PRO 86 Ca -0.16 0.11 -0.41 0.00 -2.02 0.00 0.00 63.50 61.01 1dxp n PRO 86 Cb 0.52 -1.65 -0.03 0.00 -0.02 0.00 0.00 33.50 32.33 1dxp n PRO 86 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dxp s ALA 87 N 2.29 3.49 0.58 3.55 0.00 -0.24 -4.75 121.76 126.68 1dxp s ALA 87 Ca 0.99 1.11 -0.20 0.00 0.00 0.00 0.00 51.96 53.86 1dxp s ALA 87 Cb -1.34 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 18.30 1dxp s ALA 87 CO 0.71 -0.49 1.32 -1.25 0.00 0.00 0.00 175.76 176.05 1dxp s PRO 88 N -0.88 2.98 0.29 0.00 0.04 -1.26 -4.93 135.00 131.24 1dxp s PRO 88 Ca 0.52 2.14 -0.30 0.00 0.04 0.00 0.00 61.00 63.40 1dxp s PRO 88 Cb -0.36 -2.12 -0.11 0.00 0.04 0.00 0.00 34.50 31.94 1dxp s PRO 88 CO 0.43 -1.28 1.60 -1.25 0.04 0.00 0.00 177.00 176.54 1dxp s PRO 89 N -3.07 4.12 0.00 0.56 0.04 -1.26 -2.46 135.00 132.94 1dxp s PRO 89 Ca 0.75 2.58 0.00 0.00 0.04 0.00 0.00 61.00 64.37 1dxp s PRO 89 Cb -0.38 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.13 1dxp s PRO 89 CO 0.44 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 177.25 1dxp n GLY 90 N 2.25 0.96 3.77 0.56 0.00 -1.26 -4.29 105.19 107.17 1dxp n GLY 90 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 1dxp n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dxp s ALA 91 N -1.36 3.34 -0.41 4.61 0.00 -1.03 -3.77 121.76 123.15 1dxp s ALA 91 Ca 0.00 1.14 -0.22 0.00 0.00 0.00 0.00 51.96 52.88 1dxp s ALA 91 Cb 0.00 -3.44 0.02 0.00 0.00 0.00 0.00 23.12 19.70 1dxp s ALA 91 CO 0.00 -0.61 0.74 1.03 0.00 0.00 0.00 175.76 176.92 1dxp s ARG 92 N -1.99 3.50 -0.06 0.00 0.52 0.60 -4.83 118.95 116.69 1dxp s ARG 92 Ca 0.52 -0.04 -0.23 0.00 -0.52 0.00 0.00 55.73 55.47 1dxp s ARG 92 Cb -0.36 -3.89 -0.04 0.00 0.52 0.00 0.00 34.95 31.18 1dxp s ARG 92 CO 0.47 -0.98 0.68 0.45 0.02 0.00 0.00 175.30 175.93 1dxp s SER 93 N 2.00 6.97 0.71 0.23 0.15 -1.26 -4.12 113.70 118.38 1dxp s SER 93 Ca 0.28 1.17 0.01 0.00 0.70 0.00 0.00 55.95 58.11 1dxp s SER 93 Cb -0.13 -2.40 0.13 0.00 -1.71 0.00 0.00 66.02 61.91 1dxp s SER 93 CO 0.20 -0.08 0.98 -0.04 1.20 0.00 0.00 173.24 175.49 1dxp s MET 94 N 0.67 1.69 -0.01 5.44 1.00 0.32 -4.84 119.30 123.57 1dxp s MET 94 Ca 0.36 -1.26 0.04 0.00 0.00 0.00 0.00 55.69 54.83 1dxp s MET 94 Cb -0.18 -2.38 -0.01 0.00 0.00 0.00 0.00 34.83 32.27 1dxp s MET 94 CO 0.18 -1.42 -0.14 -0.08 0.00 0.00 0.00 175.02 173.56 1dxp s THR 95 N -3.09 1.09 0.20 2.05 -1.32 -1.26 -2.31 115.64 110.99 1dxp s THR 95 Ca 0.67 -0.58 -0.32 0.00 -1.21 0.00 0.00 61.69 60.24 1dxp s THR 95 Cb -0.05 -0.91 -0.15 0.00 -1.51 0.00 0.00 72.50 69.88 1dxp s THR 95 CO 0.44 0.31 1.22 -2.65 -2.21 0.00 0.00 174.62 171.73 1dxp n PRO 96 N 2.80 1.43 -2.12 7.08 -0.02 -1.26 -0.65 135.00 142.25 1dxp n PRO 96 Ca -0.15 0.51 -0.37 0.00 -2.02 0.00 0.00 63.50 61.47 1dxp n PRO 96 Cb 0.55 -2.04 0.01 0.00 -0.02 0.00 0.00 33.50 31.99 1dxp n PRO 96 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dxp n THR 98 N -0.74 0.00 1.07 0.00 -1.04 -1.26 -4.85 114.28 107.46 1dxp n THR 98 Ca 0.09 -0.24 0.14 0.00 -2.04 0.00 0.00 64.05 62.00 1dxp n THR 98 Cb 0.47 1.48 0.63 0.00 -1.82 0.00 0.00 70.33 71.10 1dxp n THR 98 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1dxp n GLY 100 N 1.46 0.83 3.78 0.00 0.00 -1.26 -4.94 105.19 105.07 1dxp n GLY 100 Ca 0.08 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.40 1dxp n GLY 100 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1dxp s SER 101 N -2.70 5.06 0.00 1.61 0.15 -1.26 -4.96 113.70 111.60 1dxp s SER 101 Ca 0.00 1.87 0.09 0.00 0.70 0.00 0.00 55.95 58.61 1dxp s SER 101 Cb 0.00 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 61.76 1dxp s SER 101 CO 0.00 -1.66 0.55 -1.20 1.20 0.00 0.00 173.24 172.13 1dxp n SER 102 N -2.79 0.99 -4.55 5.45 7.64 -1.26 -4.84 113.62 114.26 1dxp n SER 102 Ca 0.09 -0.99 -0.42 0.00 1.01 0.00 0.00 58.87 58.56 1dxp n SER 102 Cb 0.53 0.58 -0.03 0.00 -1.01 0.00 0.00 64.21 64.28 1dxp n SER 102 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1dxp s ASP 103 N -1.38 6.33 0.29 6.43 1.01 -1.26 0.03 116.67 128.11 1dxp s ASP 103 Ca 0.07 -0.24 0.10 0.00 0.71 0.00 0.00 52.55 53.19 1dxp s ASP 103 Cb 0.07 -2.52 -0.05 0.00 1.01 0.00 0.00 42.92 41.44 1dxp s ASP 103 CO 0.25 -1.51 -0.02 -0.76 0.21 0.00 0.00 175.17 173.34 1dxp s LEU 104 N 4.84 3.06 -0.13 1.23 1.43 0.17 -3.95 118.68 125.34 1dxp s LEU 104 Ca 0.36 -0.78 -0.00 0.00 -1.03 0.00 0.00 54.13 52.68 1dxp s LEU 104 Cb -0.10 -1.55 0.03 0.00 0.03 0.00 0.00 46.19 44.60 1dxp s LEU 104 CO 0.20 -0.06 -0.08 -0.31 0.23 0.00 0.00 176.35 176.33 1dxp s TYR 105 N -2.40 1.64 -0.08 0.29 2.02 0.71 0.28 117.35 119.81 1dxp s TYR 105 Ca 0.32 -0.90 -0.19 0.00 -0.37 0.00 0.00 57.07 55.93 1dxp s TYR 105 Cb -0.05 -1.31 -0.04 0.00 -0.40 0.00 0.00 41.96 40.16 1dxp s TYR 105 CO 0.19 -0.56 0.54 -1.17 -1.57 0.00 0.00 175.55 172.98 1dxp s LEU 106 N 1.66 4.33 -0.26 -1.29 2.96 0.20 -0.30 118.68 125.97 1dxp s LEU 106 Ca 0.04 0.97 -0.10 0.00 -0.22 0.00 0.00 54.13 54.82 1dxp s LEU 106 Cb -0.13 -2.81 -0.04 0.00 0.50 0.00 0.00 46.19 43.70 1dxp s LEU 106 CO -0.08 0.02 0.14 -0.69 -1.32 0.00 0.00 176.35 174.42 1dxp s VAL 107 N 0.39 4.94 0.34 1.68 1.01 -0.71 -0.48 120.40 127.56 1dxp s VAL 107 Ca 0.29 0.04 0.03 0.00 0.00 0.00 0.00 61.98 62.34 1dxp s VAL 107 Cb -0.16 -3.33 -0.02 0.00 0.00 0.00 0.00 36.38 32.86 1dxp s VAL 107 CO 0.13 0.29 0.51 0.42 0.00 0.00 0.00 175.10 176.45 1dxp s THR 108 N 1.64 4.74 0.44 3.92 -4.23 -0.82 -4.11 115.64 117.22 1dxp s THR 108 Ca 0.07 -0.71 0.29 0.00 -1.18 0.00 0.00 61.69 60.16 1dxp s THR 108 Cb -0.15 -3.70 0.48 0.00 1.34 0.00 0.00 72.50 70.46 1dxp s THR 108 CO 0.08 -0.38 1.65 -0.09 -0.54 0.00 0.00 174.62 175.34 1dxp h ARG 109 N 0.82 0.12 -0.02 3.99 2.43 -1.87 0.95 114.38 120.81 1dxp h ARG 109 Ca -0.49 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 1dxp h ARG 109 Cb 1.24 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 1dxp h ARG 109 CO 0.59 0.08 0.00 0.72 -1.51 0.00 0.00 179.97 179.85 1dxp n HIS 110 N -4.64 0.02 -2.46 2.20 8.25 -1.26 -4.93 115.22 112.40 1dxp n HIS 110 Ca 0.35 -0.01 -0.12 0.00 -0.26 0.00 0.00 57.72 57.68 1dxp n HIS 110 Cb 1.36 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 32.46 1dxp n HIS 110 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1dxp n ALA 111 N -0.60 -0.79 -1.69 -1.41 0.00 0.33 -4.74 120.51 111.61 1dxp n ALA 111 Ca 0.09 0.10 -0.34 0.00 0.00 0.00 0.00 53.44 53.28 1dxp n ALA 111 Cb 0.06 -1.51 0.02 0.00 0.00 0.00 0.00 19.45 18.02 1dxp n ALA 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1dxp s ASP 112 N -2.05 5.52 -0.27 0.00 1.01 -1.25 -4.42 116.67 115.21 1dxp s ASP 112 Ca 0.01 2.12 0.03 0.00 0.71 0.00 0.00 52.55 55.42 1dxp s ASP 112 Cb -0.00 -2.57 0.07 0.00 1.01 0.00 0.00 42.92 41.42 1dxp s ASP 112 CO 0.01 -1.36 -0.07 -0.69 0.21 0.00 0.00 175.17 173.27 1dxp s VAL 113 N -1.95 2.07 -0.03 -1.27 1.01 -1.26 -1.95 120.40 117.02 1dxp s VAL 113 Ca 0.71 -1.69 0.06 0.00 0.00 0.00 0.00 61.98 61.06 1dxp s VAL 113 Cb -0.23 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.87 1dxp s VAL 113 CO 0.32 -0.15 -0.22 0.27 0.00 0.00 0.00 175.10 175.32 1dxp s ILE 114 N 1.12 1.78 0.18 2.22 -4.36 0.37 -4.90 121.20 117.61 1dxp s ILE 114 Ca -0.05 -0.95 -0.30 0.00 -0.26 0.00 0.00 60.65 59.09 1dxp s ILE 114 Cb -0.20 -1.49 -0.09 0.00 1.25 0.00 0.00 42.46 41.93 1dxp s ILE 114 CO -0.06 0.50 1.33 -2.16 0.24 0.00 0.00 174.94 174.80 1dxp s PRO 115 N -0.36 4.37 0.01 0.37 0.04 -1.26 0.58 135.00 138.75 1dxp s PRO 115 Ca 0.04 2.07 0.04 0.00 0.04 0.00 0.00 61.00 63.19 1dxp s PRO 115 Cb -0.10 -3.20 -0.01 0.00 0.04 0.00 0.00 34.50 31.22 1dxp s PRO 115 CO 0.01 -0.30 -0.12 0.08 0.04 0.00 0.00 177.00 176.71 1dxp s VAL 116 N 0.34 0.91 -0.35 -0.36 1.01 0.82 -2.55 120.40 120.20 1dxp s VAL 116 Ca 0.59 -0.71 -0.17 0.00 0.00 0.00 0.00 61.98 61.69 1dxp s VAL 116 Cb -0.37 -0.80 -0.00 0.00 0.00 0.00 0.00 36.38 35.21 1dxp s VAL 116 CO 0.37 0.10 0.46 -0.60 0.00 0.00 0.00 175.10 175.43 1dxp s ARG 117 N -0.69 3.56 0.16 2.72 6.06 0.11 0.46 118.95 131.32 1dxp s ARG 117 Ca 0.02 -0.29 -0.31 0.00 -2.50 0.00 0.00 55.73 52.65 1dxp s ARG 117 Cb -0.06 -3.82 -0.11 0.00 0.06 0.00 0.00 34.95 31.02 1dxp s ARG 117 CO 0.00 -0.63 1.74 0.50 -2.50 0.00 0.00 175.30 174.42 1dxp s ARG 118 N 2.27 4.14 -0.07 5.12 6.06 0.10 -0.82 118.95 135.75 1dxp s ARG 118 Ca 0.16 2.56 0.08 0.00 -2.50 0.00 0.00 55.73 56.03 1dxp s ARG 118 Cb -0.16 -3.32 -0.11 0.00 0.06 0.00 0.00 34.95 31.42 1dxp s ARG 118 CO 0.13 -0.77 0.07 0.54 -2.50 0.00 0.00 175.30 172.76 1dxp n ARG 119 N 4.76 2.11 -0.73 5.12 1.74 0.59 -4.92 116.66 125.33 1dxp n ARG 119 Ca 0.16 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 1dxp n ARG 119 Cb 0.37 -1.22 0.00 0.00 -1.02 0.00 0.00 32.46 30.59 1dxp n ARG 119 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1dxp n GLY 120 N 2.37 2.87 0.37 -0.13 0.00 -0.70 -4.93 105.19 105.04 1dxp n GLY 120 Ca -0.11 -1.06 0.04 0.00 0.00 0.00 0.00 46.02 44.89 1dxp n GLY 120 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1dxp h ASP 121 N 0.00 0.99 0.00 1.61 3.32 -1.99 -3.26 116.42 117.10 1dxp h ASP 121 Ca 0.00 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.97 1dxp h ASP 121 Cb 0.00 -0.19 -0.20 0.00 0.22 0.00 0.00 39.33 39.16 1dxp h ASP 121 CO 0.00 0.61 -0.74 -1.54 -1.72 0.00 0.00 179.24 175.85 1dxp n SER 122 N -4.53 0.99 -3.89 6.45 3.41 -1.26 -4.46 113.62 110.34 1dxp n SER 122 Ca 0.16 -2.41 -0.11 0.00 -0.26 0.00 0.00 58.87 56.25 1dxp n SER 122 Cb 0.23 -0.33 -0.11 0.00 -0.26 0.00 0.00 64.21 63.74 1dxp n SER 122 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1dxp s ARG 123 N -0.77 0.31 -0.18 4.33 3.52 -1.23 -1.62 118.95 123.31 1dxp s ARG 123 Ca 0.27 -0.28 -0.17 0.00 -0.13 0.00 0.00 55.73 55.42 1dxp s ARG 123 Cb 0.29 0.13 0.05 0.00 -1.56 0.00 0.00 34.95 33.85 1dxp s ARG 123 CO -0.10 -0.06 0.49 0.20 -0.81 0.00 0.00 175.30 175.02 1dxp s GLY 124 N -0.93 -0.37 -0.09 8.12 0.00 -1.08 -0.30 107.32 112.68 1dxp s GLY 124 Ca -0.10 1.38 0.00 0.00 0.00 0.00 0.00 44.72 46.00 1dxp s GLY 124 CO 0.00 1.19 -0.09 -1.35 0.00 0.00 0.00 173.10 172.85 1dxp s SER 125 N 0.27 4.43 -0.01 1.64 1.04 -0.00 -0.94 113.70 120.12 1dxp s SER 125 Ca -0.00 -0.14 -0.30 0.00 0.48 0.00 0.00 55.95 56.00 1dxp s SER 125 Cb -0.03 -1.31 -0.08 0.00 0.10 0.00 0.00 66.02 64.70 1dxp s SER 125 CO 0.01 0.28 1.93 -0.76 0.98 0.00 0.00 173.24 175.68 1dxp s LEU 126 N -0.34 4.29 0.20 2.42 1.02 -0.83 0.05 118.68 125.50 1dxp s LEU 126 Ca 0.04 2.48 -0.08 0.00 0.02 0.00 0.00 54.13 56.60 1dxp s LEU 126 Cb -0.12 -3.53 0.13 0.00 0.02 0.00 0.00 46.19 42.68 1dxp s LEU 126 CO 0.02 -1.14 1.71 -0.07 0.02 0.00 0.00 176.35 176.89 1dxp h LEU 127 N 11.07 1.06 -7.93 1.79 3.38 -1.82 -3.33 115.31 119.52 1dxp h LEU 127 Ca -0.46 -0.24 -0.66 0.00 0.09 0.00 0.00 57.88 56.60 1dxp h LEU 127 Cb 1.23 -0.28 -0.36 0.00 0.09 0.00 0.00 40.66 41.33 1dxp h LEU 127 CO 0.95 1.04 -0.82 -0.94 0.09 0.00 0.00 178.44 178.75 1dxp s SER 128 N -6.50 3.85 0.52 -0.43 1.04 -1.26 -5.12 113.70 105.81 1dxp s SER 128 Ca -0.12 -1.07 -0.20 0.00 0.48 0.00 0.00 55.95 55.05 1dxp s SER 128 Cb 0.15 -1.49 -0.09 0.00 0.10 0.00 0.00 66.02 64.68 1dxp s SER 128 CO 0.85 -0.11 0.68 -2.65 0.98 0.00 0.00 173.24 172.98 1dxp n PRO 129 N 4.53 0.72 -4.38 4.02 -0.02 -1.25 -5.03 135.00 133.58 1dxp n PRO 129 Ca -0.17 0.27 -0.19 0.00 -2.02 0.00 0.00 63.50 61.39 1dxp n PRO 129 Cb 0.45 -1.80 -0.10 0.00 -0.02 0.00 0.00 33.50 32.03 1dxp n PRO 129 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1dxp s ARG 130 N -2.09 1.45 0.42 -0.52 3.00 -0.80 -4.95 118.95 115.45 1dxp s ARG 130 Ca 0.68 -1.72 -0.26 0.00 0.00 0.00 0.00 55.73 54.43 1dxp s ARG 130 Cb -0.49 -0.96 -0.09 0.00 0.00 0.00 0.00 34.95 33.42 1dxp s ARG 130 CO 0.54 0.01 1.38 -2.14 0.00 0.00 0.00 175.30 175.09 1dxp s PRO 131 N -3.77 3.88 0.40 3.54 0.02 -1.26 0.16 135.00 137.98 1dxp s PRO 131 Ca 0.28 2.32 0.13 0.00 0.02 0.00 0.00 61.00 63.76 1dxp s PRO 131 Cb 0.04 -2.75 0.84 0.00 0.02 0.00 0.00 34.50 32.65 1dxp s PRO 131 CO 0.10 -0.63 1.90 -0.24 -0.33 0.00 0.00 177.00 177.80 1dxp h VAL 132 N 2.48 1.21 0.00 3.83 3.04 -0.91 -2.66 116.25 123.24 1dxp h VAL 132 Ca -0.50 -0.99 0.00 0.00 -1.01 0.00 0.00 66.70 64.20 1dxp h VAL 132 Cb 1.25 1.53 0.00 0.00 -2.01 0.00 0.00 31.29 32.06 1dxp h VAL 132 CO 0.62 0.28 0.05 0.77 -1.01 0.00 0.00 177.57 178.28 1dxp h SER 133 N 0.01 0.00 1.53 3.17 4.64 -1.92 -0.15 113.55 120.83 1dxp h SER 133 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1dxp h SER 133 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1dxp h SER 133 CO 0.04 0.00 0.00 0.22 -0.87 0.00 0.00 176.83 176.22 1dxp h TYR 134 N 0.00 0.00 -0.00 4.77 3.20 -1.86 -3.16 116.97 119.92 1dxp h TYR 134 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1dxp h TYR 134 Cb 0.09 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.36 1dxp h TYR 134 CO 0.00 0.00 -0.55 1.28 -1.64 0.00 0.00 178.16 177.25 1dxp n LEU 135 N -2.43 1.09 -4.75 2.82 4.32 -0.09 -4.95 117.00 113.01 1dxp n LEU 135 Ca 0.05 -0.61 -0.41 0.00 -0.02 0.00 0.00 56.01 55.02 1dxp n LEU 135 Cb 0.44 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.21 1dxp n LEU 135 CO 0.30 0.23 0.96 -0.54 -1.22 0.00 0.00 177.39 177.13 1dxp s LYS 136 N -2.19 4.41 0.00 3.23 -0.14 -1.06 -2.10 119.74 121.89 1dxp s LYS 136 Ca 0.09 2.08 0.00 0.00 -1.36 0.00 0.00 55.97 56.77 1dxp s LYS 136 Cb 0.12 -3.16 0.00 0.00 -1.68 0.00 0.00 37.83 33.11 1dxp s LYS 136 CO 0.52 -0.18 0.00 0.41 -0.76 0.00 0.00 175.35 175.34 1dxp n GLY 137 N 1.77 0.76 0.45 -3.33 0.00 -1.26 -4.91 105.19 98.66 1dxp n GLY 137 Ca 0.03 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.11 1dxp n GLY 137 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1dxp n SER 138 N 0.00 1.89 -4.67 1.61 7.64 -0.89 -3.28 113.62 115.92 1dxp n SER 138 Ca 0.00 -1.45 -0.45 0.00 1.01 0.00 0.00 58.87 57.99 1dxp n SER 138 Cb 0.00 0.07 -0.03 0.00 -1.01 0.00 0.00 64.21 63.25 1dxp n SER 138 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1dxp n SER 139 N 0.54 2.81 0.00 6.43 7.64 -1.26 -1.02 113.62 128.76 1dxp n SER 139 Ca 0.07 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.09 1dxp n SER 139 Cb 0.29 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.05 1dxp n SER 139 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1dxp n GLY 140 N 2.13 1.04 3.84 0.23 0.00 0.17 0.17 105.19 112.77 1dxp n GLY 140 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 1dxp n GLY 140 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dxp s GLY 141 N -1.89 1.90 0.18 -0.02 0.00 -0.18 -3.34 107.32 103.97 1dxp s GLY 141 Ca 0.00 0.12 -0.23 0.00 0.00 0.00 0.00 44.72 44.61 1dxp s GLY 141 CO 0.00 0.41 0.75 2.56 0.00 0.00 0.00 173.10 176.82 1dxp s PRO 142 N -4.52 4.44 -0.29 2.90 0.04 -1.26 0.16 135.00 136.47 1dxp s PRO 142 Ca 0.58 1.05 -0.12 0.00 0.04 0.00 0.00 61.00 62.55 1dxp s PRO 142 Cb -0.12 -3.12 -0.04 0.00 0.04 0.00 0.00 34.50 31.26 1dxp s PRO 142 CO 0.42 0.51 0.23 -0.51 0.04 0.00 0.00 177.00 177.70 1dxp s LEU 143 N -1.43 4.12 -0.12 -3.56 1.02 0.59 -1.74 118.68 117.55 1dxp s LEU 143 Ca 0.38 -0.04 -0.07 0.00 0.02 0.00 0.00 54.13 54.42 1dxp s LEU 143 Cb -0.21 -2.18 -0.04 0.00 0.02 0.00 0.00 46.19 43.78 1dxp s LEU 143 CO 0.24 -0.11 0.13 -0.76 0.02 0.00 0.00 176.35 175.87 1dxp s LEU 144 N 1.81 4.32 0.77 1.79 1.02 0.59 -0.46 118.68 128.52 1dxp s LEU 144 Ca 0.08 0.43 -0.10 0.00 0.02 0.00 0.00 54.13 54.57 1dxp s LEU 144 Cb -0.16 -2.05 0.08 0.00 0.02 0.00 0.00 46.19 44.08 1dxp s LEU 144 CO 0.11 0.39 1.11 0.00 0.02 0.00 0.00 176.35 177.98 1dxp h PRO 146 N -0.88 0.00 -0.69 0.00 0.11 -1.91 0.84 132.00 129.47 1dxp h PRO 146 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1dxp h PRO 146 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1dxp h PRO 146 CO 0.61 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.27 1dxp n SER 147 N -2.40 3.87 0.00 -2.05 3.41 -1.26 -4.92 113.62 110.27 1dxp n SER 147 Ca 0.01 -2.07 0.00 0.00 -0.26 0.00 0.00 58.87 56.54 1dxp n SER 147 Cb 0.17 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 63.64 1dxp n SER 147 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dxp n GLY 148 N 1.52 0.95 3.91 5.00 0.00 0.29 -5.04 105.19 111.82 1dxp n GLY 148 Ca 0.23 -0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 1dxp n GLY 148 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1dxp s HIS 149 N -2.00 3.34 -0.02 1.61 3.76 -1.25 -4.77 115.29 115.95 1dxp s HIS 149 Ca 0.00 -0.00 -0.30 0.00 -0.15 0.00 0.00 55.06 54.61 1dxp s HIS 149 Cb 0.00 -1.55 -0.04 0.00 1.11 0.00 0.00 32.58 32.10 1dxp s HIS 149 CO 0.00 0.49 1.18 0.08 -0.85 0.00 0.00 174.74 175.64 1dxp s VAL 150 N -1.91 4.26 -1.33 -0.90 1.01 0.17 -1.75 120.40 119.96 1dxp s VAL 150 Ca 0.33 1.60 0.18 0.00 0.00 0.00 0.00 61.98 64.09 1dxp s VAL 150 Cb -0.09 -4.03 -0.09 0.00 0.00 0.00 0.00 36.38 32.17 1dxp s VAL 150 CO 0.27 0.04 0.86 1.33 0.00 0.00 0.00 175.10 177.60 1dxp n VAL 151 N 4.39 0.00 0.00 2.92 0.24 0.39 0.75 118.33 127.02 1dxp n VAL 151 Ca 0.10 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 1dxp n VAL 151 Cb 0.47 1.12 0.00 0.00 -1.47 0.00 0.00 33.84 33.96 1dxp n VAL 151 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1dxp n GLY 152 N 1.33 2.44 3.35 7.63 0.00 -1.23 -1.54 105.19 117.18 1dxp n GLY 152 Ca 0.06 -1.08 -0.29 0.00 0.00 0.00 0.00 46.02 44.72 1dxp n GLY 152 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1dxp s ILE 153 N -2.00 2.12 0.06 -0.61 -4.36 -0.66 -0.30 121.20 115.45 1dxp s ILE 153 Ca 0.00 -1.58 -0.31 0.00 -0.26 0.00 0.00 60.65 58.51 1dxp s ILE 153 Cb 0.00 -1.86 -0.06 0.00 1.25 0.00 0.00 42.46 41.79 1dxp s ILE 153 CO 0.00 0.17 1.30 0.12 0.24 0.00 0.00 174.94 176.77 1dxp s PHE 154 N -0.97 3.24 -0.01 1.37 5.36 0.42 -0.96 117.98 126.44 1dxp s PHE 154 Ca 0.12 1.09 -0.02 0.00 -0.96 0.00 0.00 56.93 57.16 1dxp s PHE 154 Cb -0.10 -3.55 -0.01 0.00 -0.34 0.00 0.00 43.02 39.03 1dxp s PHE 154 CO 0.04 -1.85 -0.04 -2.13 -1.46 0.00 0.00 175.22 169.78 1dxp n ARG 155 N 4.32 0.06 -3.88 10.12 0.63 -0.38 0.41 116.66 127.93 1dxp n ARG 155 Ca 0.11 0.02 -0.11 0.00 -0.92 0.00 0.00 57.85 56.95 1dxp n ARG 155 Cb 0.45 -0.45 -0.12 0.00 0.45 0.00 0.00 32.46 32.78 1dxp n ARG 155 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1dxp s ALA 156 N -2.64 -0.18 0.36 5.13 0.00 -0.87 -4.81 121.76 118.75 1dxp s ALA 156 Ca -0.03 -0.05 -0.26 0.00 0.00 0.00 0.00 51.96 51.62 1dxp s ALA 156 Cb 0.00 -0.01 -0.09 0.00 0.00 0.00 0.00 23.12 23.03 1dxp s ALA 156 CO 0.05 -0.12 1.15 0.00 0.00 0.00 0.00 175.76 176.84 1dxp s ALA 157 N -0.72 3.24 -0.19 0.00 0.00 -1.26 -0.16 121.76 122.66 1dxp s ALA 157 Ca -0.08 0.94 -0.04 0.00 0.00 0.00 0.00 51.96 52.78 1dxp s ALA 157 Cb -0.05 -3.36 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 1dxp s ALA 157 CO 0.00 -0.41 -0.02 0.54 0.00 0.00 0.00 175.76 175.87 1dxp s VAL 158 N -1.36 3.75 -0.05 0.00 0.11 0.12 -4.84 120.40 118.12 1dxp s VAL 158 Ca 0.53 -0.39 -0.02 0.00 -2.93 0.00 0.00 61.98 59.18 1dxp s VAL 158 Cb -0.31 -2.68 0.04 0.00 -1.53 0.00 0.00 36.38 31.90 1dxp s VAL 158 CO 0.39 0.44 0.10 0.00 -3.33 0.00 0.00 175.10 172.70 1dxp s THR 160 N 1.33 3.22 -1.02 0.00 2.01 -0.89 -4.79 115.64 115.49 1dxp s THR 160 Ca -0.07 -0.57 -0.01 0.00 0.31 0.00 0.00 61.69 61.36 1dxp s THR 160 Cb -0.12 -2.42 0.00 0.00 0.01 0.00 0.00 72.50 69.97 1dxp s THR 160 CO -0.05 0.47 0.08 0.54 -0.69 0.00 0.00 174.62 174.97 1dxp n ARG 161 N 4.30 -1.42 -0.18 4.92 1.74 -1.26 -3.04 116.66 121.72 1dxp n ARG 161 Ca -0.18 0.58 0.00 0.00 -0.77 0.00 0.00 57.85 57.48 1dxp n ARG 161 Cb 0.51 -4.75 0.00 0.00 -1.02 0.00 0.00 32.46 27.21 1dxp n ARG 161 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1dxp n GLY 162 N -1.06 1.03 3.59 -0.13 0.00 -1.26 -5.01 105.19 102.35 1dxp n GLY 162 Ca -0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 1dxp n GLY 162 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1dxp s VAL 163 N -2.61 3.83 -0.22 1.61 -7.23 -1.17 -0.23 120.40 114.38 1dxp s VAL 163 Ca 0.00 -0.43 -0.18 0.00 -1.81 0.00 0.00 61.98 59.56 1dxp s VAL 163 Cb 0.00 -2.58 -0.03 0.00 0.56 0.00 0.00 36.38 34.32 1dxp s VAL 163 CO 0.00 0.59 0.51 0.00 -0.31 0.00 0.00 175.10 175.89 1dxp s ALA 164 N -0.69 3.56 -0.02 1.32 0.00 0.43 -2.10 121.76 124.26 1dxp s ALA 164 Ca 0.11 -0.48 0.08 0.00 0.00 0.00 0.00 51.96 51.66 1dxp s ALA 164 Cb -0.11 -2.83 -0.12 0.00 0.00 0.00 0.00 23.12 20.06 1dxp s ALA 164 CO 0.02 -0.54 0.14 1.63 0.00 0.00 0.00 175.76 177.01 1dxp n LYS 165 N 5.05 0.72 -4.16 0.00 5.02 -0.29 -1.90 118.16 122.60 1dxp n LYS 165 Ca -0.05 -0.06 -0.15 0.00 -2.02 0.00 0.00 58.31 56.04 1dxp n LYS 165 Cb 0.50 -1.19 -0.07 0.00 -0.02 0.00 0.00 35.03 34.26 1dxp n LYS 165 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1dxp s ALA 166 N -2.48 1.05 -0.07 7.82 0.00 -1.10 -1.96 121.76 125.03 1dxp s ALA 166 Ca -0.03 -1.64 -0.04 0.00 0.00 0.00 0.00 51.96 50.25 1dxp s ALA 166 Cb 0.04 1.29 0.04 0.00 0.00 0.00 0.00 23.12 24.49 1dxp s ALA 166 CO 0.32 -0.72 0.16 0.14 0.00 0.00 0.00 175.76 175.66 1dxp s VAL 167 N -3.52 -0.04 0.40 0.00 -7.23 -0.11 0.12 120.40 110.01 1dxp s VAL 167 Ca 0.34 0.14 -0.22 0.00 -1.81 0.00 0.00 61.98 60.44 1dxp s VAL 167 Cb 0.02 -0.26 -0.11 0.00 0.56 0.00 0.00 36.38 36.60 1dxp s VAL 167 CO 0.19 0.06 0.93 -1.81 -0.31 0.00 0.00 175.10 174.16 1dxp s ASP 168 N 0.98 7.02 0.04 4.85 1.01 0.77 -2.62 116.67 128.71 1dxp s ASP 168 Ca -0.07 1.69 -0.13 0.00 0.71 0.00 0.00 52.55 54.75 1dxp s ASP 168 Cb -0.09 -2.54 0.02 0.00 1.01 0.00 0.00 42.92 41.32 1dxp s ASP 168 CO -0.05 -0.28 0.28 0.72 0.21 0.00 0.00 175.17 176.05 1dxp s PHE 169 N -2.03 -0.08 -0.34 4.23 -0.71 -0.64 -1.25 117.98 117.16 1dxp s PHE 169 Ca 0.59 -0.05 -0.17 0.00 -1.04 0.00 0.00 56.93 56.25 1dxp s PHE 169 Cb -0.11 0.07 -0.01 0.00 -1.21 0.00 0.00 43.02 41.76 1dxp s PHE 169 CO 0.16 -0.48 0.48 0.42 -1.34 0.00 0.00 175.22 174.46 1dxp s ILE 170 N -2.45 5.05 0.24 -4.49 1.01 -0.13 -4.52 121.20 115.91 1dxp s ILE 170 Ca -0.06 0.31 -0.30 0.00 0.00 0.00 0.00 60.65 60.61 1dxp s ILE 170 Cb -0.01 -3.92 -0.09 0.00 0.01 0.00 0.00 42.46 38.44 1dxp s ILE 170 CO -0.03 -0.17 1.18 -2.16 0.00 0.00 0.00 174.94 173.76 1dxp s PRO 171 N 2.31 4.53 0.58 2.79 0.04 -1.26 -1.66 135.00 142.33 1dxp s PRO 171 Ca 0.17 1.90 0.34 0.00 0.04 0.00 0.00 61.00 63.45 1dxp s PRO 171 Cb -0.16 -3.20 1.78 0.00 0.04 0.00 0.00 34.50 32.97 1dxp s PRO 171 CO 0.13 0.01 2.17 -0.24 0.04 0.00 0.00 177.00 179.11 1dxp h VAL 172 N 3.41 0.29 -1.06 -0.36 3.04 -1.61 0.14 116.25 120.09 1dxp h VAL 172 Ca -0.46 -0.31 0.28 0.00 -1.01 0.00 0.00 66.70 65.21 1dxp h VAL 172 Cb 1.21 1.23 -0.08 0.00 -2.01 0.00 0.00 31.29 31.65 1dxp h VAL 172 CO 0.70 0.05 0.71 -0.33 -1.01 0.00 0.00 177.57 177.69 1dxp h GLU 173 N 0.00 0.26 0.00 4.17 3.07 -1.90 0.12 114.58 120.30 1dxp h GLU 173 Ca -0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 1dxp h GLU 173 Cb 0.23 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 1dxp h GLU 173 CO 0.01 0.17 0.00 0.77 -1.40 0.00 0.00 179.01 178.56 1dxp h SER 174 N 0.26 0.00 -0.03 1.42 0.02 -1.07 -3.55 113.55 110.60 1dxp h SER 174 Ca 0.57 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.52 1dxp h SER 174 Cb 1.71 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.25 1dxp h SER 174 CO -0.20 0.00 0.00 0.23 -1.14 0.00 0.00 176.83 175.72