#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uxd s LYS 2 N 0.00 3.53 0.14 2.12 -0.14 -1.26 -4.98 119.74 119.15 1uxd s LYS 2 Ca 0.00 -0.21 -0.18 0.00 -1.36 0.00 0.00 55.97 54.22 1uxd s LYS 2 Cb 0.00 -2.66 -0.01 0.00 -1.68 0.00 0.00 37.83 33.48 1uxd s LYS 2 CO 0.00 0.17 1.77 1.25 -0.76 0.00 0.00 175.35 177.78 1uxd h LEU 3 N 1.07 0.21 -1.39 3.17 6.46 -1.99 -1.80 115.31 121.05 1uxd h LEU 3 Ca -0.49 0.01 0.01 0.00 -0.12 0.00 0.00 57.88 57.29 1uxd h LEU 3 Cb 1.21 -0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 41.08 1uxd h LEU 3 CO 0.63 0.16 0.41 -0.78 -0.62 0.00 0.00 178.44 178.25 1uxd h ASP 4 N 0.30 0.71 -0.15 1.25 3.58 -1.94 -1.40 116.42 118.77 1uxd h ASP 4 Ca 0.12 -0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.51 1uxd h ASP 4 Cb 0.03 -0.18 -0.00 0.00 1.72 0.00 0.00 39.33 40.90 1uxd h ASP 4 CO -0.08 0.52 -0.04 1.05 -2.88 0.00 0.00 179.24 177.81 1uxd h GLU 5 N 0.84 0.29 -0.12 0.28 4.11 -1.81 -1.95 114.58 116.22 1uxd h GLU 5 Ca 0.23 -0.11 -0.02 0.00 0.07 0.00 0.00 59.36 59.53 1uxd h GLU 5 Cb -0.09 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1uxd h GLU 5 CO -0.05 0.57 -0.02 0.82 0.07 0.00 0.00 179.01 180.40 1uxd h ILE 6 N -0.01 1.10 -0.17 -1.06 2.04 -1.00 0.49 117.51 118.90 1uxd h ILE 6 Ca 0.04 -0.39 -0.14 0.00 1.00 0.00 0.00 64.86 65.36 1uxd h ILE 6 Cb 0.46 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 1uxd h ILE 6 CO 0.01 0.13 -0.46 0.00 0.00 0.00 0.00 178.15 177.83 1uxd h ALA 7 N 1.81 0.28 -0.41 1.87 0.00 -1.06 0.70 119.26 122.45 1uxd h ALA 7 Ca 0.04 -0.48 -0.14 0.00 0.00 0.00 0.00 54.91 54.33 1uxd h ALA 7 Cb 0.16 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1uxd h ALA 7 CO 0.01 0.43 -0.30 0.00 0.00 0.00 0.00 179.25 179.38 1uxd h ARG 8 N 0.27 0.91 -0.23 0.00 3.08 -0.82 0.44 114.38 118.04 1uxd h ARG 8 Ca -0.01 -0.43 -0.11 0.00 0.07 0.00 0.00 59.98 59.50 1uxd h ARG 8 Cb 1.07 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.11 1uxd h ARG 8 CO 0.10 1.09 -0.29 -0.07 -1.07 0.00 0.00 179.97 179.73 1uxd h LEU 9 N 0.77 0.64 -0.11 3.04 3.38 -0.92 -3.27 115.31 118.85 1uxd h LEU 9 Ca 0.08 -0.50 -0.14 0.00 0.09 0.00 0.00 57.88 57.41 1uxd h LEU 9 Cb 0.88 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 41.45 1uxd h LEU 9 CO 0.08 1.01 -0.49 0.00 0.09 0.00 0.00 178.44 179.14 1uxd h ALA 10 N 0.65 0.20 0.00 1.53 0.00 -0.82 -3.49 119.26 117.33 1uxd h ALA 10 Ca 0.03 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1uxd h ALA 10 Cb 0.86 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1uxd h ALA 10 CO 0.07 0.38 0.00 0.41 0.00 0.00 0.00 179.25 180.11 1uxd n GLY 11 N 0.68 0.87 0.00 0.00 0.00 0.13 -4.66 105.19 102.21 1uxd n GLY 11 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1uxd n GLY 11 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1uxd n VAL 12 N 0.00 0.00 -3.87 1.61 0.24 0.46 -5.02 118.33 111.76 1uxd n VAL 12 Ca 0.00 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 62.08 1uxd n VAL 12 Cb 0.00 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.32 1uxd n VAL 12 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1uxd s SER 13 N 1.08 4.86 0.31 -1.34 0.15 -1.26 -4.47 113.70 113.03 1uxd s SER 13 Ca 0.00 -0.78 0.07 0.00 0.70 0.00 0.00 55.95 55.93 1uxd s SER 13 Cb 0.00 -0.66 0.81 0.00 -1.71 0.00 0.00 66.02 64.46 1uxd s SER 13 CO 0.00 -0.49 1.71 -0.09 1.20 0.00 0.00 173.24 175.58 1uxd h ARG 14 N 1.29 0.49 0.09 5.44 1.12 -1.89 -0.44 114.38 120.47 1uxd h ARG 14 Ca -0.43 -0.03 -0.36 0.00 -1.11 0.00 0.00 59.98 58.05 1uxd h ARG 14 Cb 1.26 -0.11 -0.03 0.00 -0.01 0.00 0.00 29.97 31.08 1uxd h ARG 14 CO 0.62 0.32 -2.05 0.25 -3.11 0.00 0.00 179.97 176.00 1uxd n THR 15 N -4.96 1.71 -0.18 0.20 -2.24 -1.26 -3.31 114.28 104.24 1uxd n THR 15 Ca 0.25 -0.66 0.08 0.00 -2.27 0.00 0.00 64.05 61.44 1uxd n THR 15 Cb 0.70 -1.58 0.37 0.00 -2.10 0.00 0.00 70.33 67.73 1uxd n THR 15 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1uxd h THR 16 N 0.05 0.99 -0.22 4.28 2.02 -1.84 0.18 112.91 118.37 1uxd h THR 16 Ca -0.44 -0.25 -0.12 0.00 0.77 0.00 0.00 66.41 66.38 1uxd h THR 16 Cb 2.02 0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 68.64 1uxd h THR 16 CO 0.06 0.13 -0.34 0.00 0.37 0.00 0.00 175.52 175.74 1uxd h ALA 17 N 1.61 0.34 -0.98 6.16 0.00 -1.25 -2.80 119.26 122.34 1uxd h ALA 17 Ca 0.32 -0.43 0.21 0.00 0.00 0.00 0.00 54.91 55.01 1uxd h ALA 17 Cb 0.33 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 17.97 1uxd h ALA 17 CO -0.11 0.39 0.62 1.03 0.00 0.00 0.00 179.25 181.18 1uxd h SER 18 N 0.31 0.62 -0.47 0.00 0.87 -0.75 0.97 113.55 115.10 1uxd h SER 18 Ca 0.02 0.08 0.09 0.00 -1.23 0.00 0.00 61.79 60.75 1uxd h SER 18 Cb 0.93 -0.03 -0.08 0.00 -0.44 0.00 0.00 62.40 62.77 1uxd h SER 18 CO 0.08 0.21 -0.05 1.88 -0.53 0.00 0.00 176.83 178.42 1uxd h TYR 19 N 0.60 -0.13 -0.17 2.24 0.05 -0.69 0.87 116.97 119.74 1uxd h TYR 19 Ca 0.55 0.04 -0.20 0.00 0.05 0.00 0.00 58.73 59.17 1uxd h TYR 19 Cb 1.08 0.13 0.00 0.00 1.01 0.00 0.00 36.73 38.96 1uxd h TYR 19 CO -0.00 -0.15 -0.69 0.28 -1.05 0.00 0.00 178.16 176.54 1uxd h VAL 20 N 0.06 1.31 0.11 -2.88 2.07 -0.93 0.70 116.25 116.68 1uxd h VAL 20 Ca 0.23 -1.94 -0.01 0.00 0.82 0.00 0.00 66.70 65.81 1uxd h VAL 20 Cb 0.36 1.91 0.00 0.00 -1.52 0.00 0.00 31.29 32.04 1uxd h VAL 20 CO -0.44 0.61 -0.05 0.40 0.02 0.00 0.00 177.57 178.11 1uxd h ILE 21 N 0.49 0.99 -0.00 4.57 2.04 0.01 -3.03 117.51 122.58 1uxd h ILE 21 Ca -0.03 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.48 1uxd h ILE 21 Cb 1.29 1.22 0.00 0.00 -0.74 0.00 0.00 36.82 38.59 1uxd h ILE 21 CO 0.14 0.09 -0.02 -0.46 0.00 0.00 0.00 178.15 177.89 1uxd n ASN 22 N -5.08 0.19 -1.26 1.72 0.23 0.19 -4.39 115.26 106.87 1uxd n ASN 22 Ca -0.08 -0.69 -0.06 0.00 -0.53 0.00 0.00 54.58 53.22 1uxd n ASN 22 Cb 0.15 -0.10 0.02 0.00 -2.08 0.00 0.00 39.78 37.76 1uxd n ASN 22 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1uxd n GLY 23 N 1.15 0.58 0.09 4.83 0.00 -1.04 -4.97 105.19 105.84 1uxd n GLY 23 Ca 0.19 -0.45 0.01 0.00 0.00 0.00 0.00 46.02 45.77 1uxd n GLY 23 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1uxd n LYS 24 N -1.60 0.08 -0.32 1.61 5.02 0.23 -4.84 118.16 118.33 1uxd n LYS 24 Ca 0.00 -0.83 -0.06 0.00 -2.02 0.00 0.00 58.31 55.40 1uxd n LYS 24 Cb 0.52 -1.04 -0.01 0.00 -0.02 0.00 0.00 35.03 34.47 1uxd n LYS 24 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1uxd h ALA 25 N 0.41 -0.15 -0.53 7.82 0.00 -1.36 0.12 119.26 125.57 1uxd h ALA 25 Ca 0.00 0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.14 1uxd h ALA 25 Cb 0.19 1.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 1uxd h ALA 25 CO 0.00 -0.76 0.36 0.87 0.00 0.00 0.00 179.25 179.71 1uxd h LYS 26 N -0.08 0.54 -0.70 0.00 6.56 -1.87 -2.31 116.57 118.72 1uxd h LYS 26 Ca 0.25 -0.03 -0.04 0.00 -1.06 0.00 0.00 60.65 59.77 1uxd h LYS 26 Cb 0.55 -0.12 -0.03 0.00 -0.57 0.00 0.00 32.23 32.05 1uxd h LYS 26 CO -0.87 0.36 0.29 1.96 -2.06 0.00 0.00 179.45 179.13 1uxd h GLN 27 N 0.56 1.04 0.00 3.15 4.20 -1.13 -3.41 115.11 119.52 1uxd h GLN 27 Ca 0.22 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1uxd h GLN 27 Cb 0.19 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.80 1uxd h GLN 27 CO -0.06 0.86 0.00 0.66 -0.67 0.00 0.00 178.83 179.62 1uxd n TYR 28 N -4.38 0.00 -2.57 2.96 4.01 -0.91 -5.02 117.16 111.25 1uxd n TYR 28 Ca 0.05 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.77 1uxd n TYR 28 Cb 0.17 0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.30 1uxd n TYR 28 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1uxd n ARG 29 N 0.00 1.07 -2.73 -0.72 1.74 -1.12 -4.98 116.66 109.93 1uxd n ARG 29 Ca 0.00 -1.05 -0.19 0.00 -0.77 0.00 0.00 57.85 55.84 1uxd n ARG 29 Cb 0.00 0.40 0.00 0.00 -1.02 0.00 0.00 32.46 31.84 1uxd n ARG 29 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1uxd n VAL 30 N -1.22 1.53 -0.45 1.55 0.24 -0.95 -4.94 118.33 114.09 1uxd n VAL 30 Ca -0.17 -4.25 0.37 0.00 -2.04 0.00 0.00 64.34 58.25 1uxd n VAL 30 Cb 0.82 -0.38 0.66 0.00 -1.47 0.00 0.00 33.84 33.47 1uxd n VAL 30 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 1uxd h SER 31 N 2.86 0.21 0.00 -1.34 0.87 -1.87 -3.35 113.55 110.93 1uxd h SER 31 Ca 0.09 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 1uxd h SER 31 Cb 0.97 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.01 1uxd h SER 31 CO 0.66 -0.09 0.00 -0.67 -0.53 0.00 0.00 176.83 176.19 1uxd n ASP 32 N -4.52 0.00 -0.30 6.23 -0.08 -1.26 -4.78 116.55 111.84 1uxd n ASP 32 Ca 0.35 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 53.52 1uxd n ASP 32 Cb 1.40 0.06 -0.08 0.00 2.34 0.00 0.00 41.12 44.84 1uxd n ASP 32 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1uxd h LYS 33 N 0.00 -0.15 0.00 -0.67 1.57 -1.95 -0.23 116.57 115.14 1uxd h LYS 33 Ca 0.00 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1uxd h LYS 33 Cb 0.00 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 1uxd h LYS 33 CO 0.00 -0.10 -0.39 1.15 -0.57 0.00 0.00 179.45 179.54 1uxd h THR 34 N -0.15 0.21 0.00 -0.16 2.02 -1.94 -3.23 112.91 109.65 1uxd h THR 34 Ca 0.15 -1.31 0.00 0.00 0.77 0.00 0.00 66.41 66.02 1uxd h THR 34 Cb 0.50 1.99 0.00 0.00 -1.74 0.00 0.00 68.15 68.90 1uxd h THR 34 CO -0.81 0.12 0.00 0.52 0.37 0.00 0.00 175.52 175.72 1uxd n VAL 35 N -3.03 0.00 -0.11 3.16 0.31 -0.13 0.14 118.33 118.66 1uxd n VAL 35 Ca 0.02 1.46 0.09 0.00 -0.01 0.00 0.00 64.34 65.90 1uxd n VAL 35 Cb 0.60 -2.30 0.44 0.00 -0.91 0.00 0.00 33.84 31.66 1uxd n VAL 35 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 1uxd h GLU 36 N 0.00 0.53 0.18 5.55 4.11 -1.64 0.88 114.58 124.18 1uxd h GLU 36 Ca 0.00 -0.03 -0.01 0.00 0.07 0.00 0.00 59.36 59.39 1uxd h GLU 36 Cb 0.00 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.13 1uxd h GLU 36 CO 0.00 0.35 -0.08 -0.22 0.07 0.00 0.00 179.01 179.13 1uxd h LYS 37 N 0.55 -0.23 0.10 1.06 3.64 -1.46 -3.09 116.57 117.14 1uxd h LYS 37 Ca 0.28 0.02 -0.35 0.00 -1.27 0.00 0.00 60.65 59.33 1uxd h LYS 37 Cb 0.39 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 1uxd h LYS 37 CO -0.09 0.04 -1.91 0.28 -2.27 0.00 0.00 179.45 175.50 1uxd h VAL 38 N -0.48 0.70 -0.90 2.00 2.07 0.13 -3.39 116.25 116.38 1uxd h VAL 38 Ca -0.02 -2.45 -0.01 0.00 0.82 0.00 0.00 66.70 65.04 1uxd h VAL 38 Cb 0.37 2.50 -0.04 0.00 -1.52 0.00 0.00 31.29 32.60 1uxd h VAL 38 CO 0.04 0.80 0.51 0.24 0.02 0.00 0.00 177.57 179.18 1uxd h MET 39 N 0.06 1.24 -0.69 1.57 2.86 0.73 -1.82 114.93 118.88 1uxd h MET 39 Ca -0.38 -0.13 0.14 0.00 -2.06 0.00 0.00 59.70 57.27 1uxd h MET 39 Cb 2.03 -0.25 -0.04 0.00 0.06 0.00 0.00 31.60 33.40 1uxd h MET 39 CO 0.09 0.89 0.47 0.00 1.06 0.00 0.00 176.91 179.42 1uxd h ALA 40 N 1.28 2.16 0.15 6.32 0.00 -1.68 0.19 119.26 127.68 1uxd h ALA 40 Ca 0.32 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.94 1uxd h ALA 40 Cb -0.00 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.75 1uxd h ALA 40 CO -0.05 -0.35 -1.39 -0.24 0.00 0.00 0.00 179.25 177.21 1uxd h VAL 41 N 0.34 1.11 -0.64 0.00 3.04 -1.60 -1.87 116.25 116.63 1uxd h VAL 41 Ca 0.33 -2.47 0.01 0.00 -1.01 0.00 0.00 66.70 63.57 1uxd h VAL 41 Cb 0.83 2.83 -0.03 0.00 -2.01 0.00 0.00 31.29 32.90 1uxd h VAL 41 CO -0.09 0.75 0.41 0.58 -1.01 0.00 0.00 177.57 178.21 1uxd h VAL 42 N -0.19 1.13 0.00 1.51 2.07 -0.70 -1.93 116.25 118.14 1uxd h VAL 42 Ca -0.28 -0.29 -0.04 0.00 0.82 0.00 0.00 66.70 66.91 1uxd h VAL 42 Cb 1.84 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 1uxd h VAL 42 CO 0.12 0.15 -0.23 0.08 0.02 0.00 0.00 177.57 177.71 1uxd h ARG 43 N 0.83 0.00 -0.10 1.57 0.11 -1.11 0.11 114.38 115.79 1uxd h ARG 43 Ca 0.24 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.29 1uxd h ARG 43 Cb -0.06 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.02 1uxd h ARG 43 CO -0.07 0.18 -0.07 1.49 0.10 0.00 0.00 179.97 181.61 1uxd h GLU 44 N 0.00 0.22 0.00 0.08 4.57 -0.81 -3.13 114.58 115.51 1uxd h GLU 44 Ca -0.00 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 58.07 1uxd h GLU 44 Cb 1.15 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.73 1uxd h GLU 44 CO 0.02 0.60 -0.66 0.45 -1.18 0.00 0.00 179.01 178.25 1uxd h HIS 45 N -0.17 0.00 -3.93 0.92 3.86 -1.45 -3.48 115.15 110.91 1uxd h HIS 45 Ca 0.02 0.00 -0.24 0.00 -1.16 0.00 0.00 60.37 58.99 1uxd h HIS 45 Cb 0.54 0.00 0.08 0.00 1.06 0.00 0.00 27.41 29.10 1uxd h HIS 45 CO 0.08 0.00 -0.41 -1.71 0.86 0.00 0.00 177.93 176.74 1uxd n ASN 46 N -2.60 -4.67 -4.71 2.45 2.85 0.18 -4.97 115.26 103.79 1uxd n ASN 46 Ca 0.02 -0.33 -0.42 0.00 -0.11 0.00 0.00 54.58 53.74 1uxd n ASN 46 Cb 0.51 -3.25 -0.03 0.00 1.24 0.00 0.00 39.78 38.25 1uxd n ASN 46 CO 0.00 0.00 0.00 -0.47 -2.11 0.00 0.00 177.26 174.68 1uxd s TYR 47 N -3.19 3.11 0.36 1.20 5.04 -0.11 -5.00 117.35 118.76 1uxd s TYR 47 Ca 0.36 0.91 -0.23 0.00 -2.44 0.00 0.00 57.07 55.66 1uxd s TYR 47 Cb -0.16 -3.68 -0.10 0.00 0.35 0.00 0.00 41.96 38.38 1uxd s TYR 47 CO 0.44 -2.41 0.92 -1.01 -1.34 0.00 0.00 175.55 172.15 1uxd s HIS 48 N 1.51 3.53 0.43 4.97 3.76 -1.26 -4.87 115.29 123.36 1uxd s HIS 48 Ca 0.65 1.67 -0.23 0.00 -0.15 0.00 0.00 55.06 56.99 1uxd s HIS 48 Cb -0.35 -2.86 -0.08 0.00 1.11 0.00 0.00 32.58 30.40 1uxd s HIS 48 CO 0.29 0.09 1.09 -1.25 -0.85 0.00 0.00 174.74 174.12 1uxd s PRO 49 N -2.52 4.00 0.57 8.40 0.04 -1.26 -5.00 135.00 139.23 1uxd s PRO 49 Ca 0.54 1.60 -0.20 0.00 0.04 0.00 0.00 61.00 62.98 1uxd s PRO 49 Cb -0.14 -2.47 -0.04 0.00 0.04 0.00 0.00 34.50 31.89 1uxd s PRO 49 CO 0.19 -0.31 1.26 1.21 0.04 0.00 0.00 177.00 179.40 1uxd s ASN 50 N -1.51 5.25 1.03 6.66 3.84 -1.26 -4.99 114.94 123.96 1uxd s ASN 50 Ca 0.60 2.53 -0.11 0.00 0.21 0.00 0.00 52.86 56.09 1uxd s ASN 50 Cb -0.24 -2.61 0.20 0.00 -0.55 0.00 0.00 41.25 38.05 1uxd s ASN 50 CO 0.30 -1.56 1.06 0.00 -2.79 0.00 0.00 177.10 174.11 1uxd n ALA 51 N -1.32 -1.77 -2.01 1.71 0.00 -1.26 -4.75 120.51 111.11 1uxd n ALA 51 Ca 0.12 -0.83 -0.01 0.00 0.00 0.00 0.00 53.44 52.72 1uxd n ALA 51 Cb 0.48 -2.10 -0.01 0.00 0.00 0.00 0.00 19.45 17.82 1uxd n ALA 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1uxd n VAL 52 N -4.55-10.05 -0.68 0.00 0.31 -1.26 -5.08 118.33 97.02 1uxd n VAL 52 Ca 0.08 2.18 0.00 0.00 -0.01 0.00 0.00 64.34 66.59 1uxd n VAL 52 Cb 0.53 -5.28 0.00 0.00 -0.91 0.00 0.00 33.84 28.18 1uxd n VAL 52 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1uxd n ALA 53 N 1.27 0.00 0.41 3.52 0.00 -1.26 -5.01 120.51 119.44 1uxd n ALA 53 Ca -0.06 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.22 1uxd n ALA 53 Cb 0.09 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.47 1uxd n ALA 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uxd h ALA 54 N -1.60 -1.21 -3.00 0.00 0.00 -1.98 -3.48 119.26 107.99 1uxd h ALA 54 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1uxd h ALA 54 Cb 0.00 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1uxd h ALA 54 CO 0.00 -1.13 0.00 0.41 0.00 0.00 0.00 179.25 178.53 1uxd n GLY 55 N -1.32 1.19 0.00 0.00 0.00 -1.26 -4.95 105.19 98.85 1uxd n GLY 55 Ca -0.13 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1uxd n GLY 55 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1uxd n LEU 56 N 0.00 0.98 -3.61 0.99 0.00 -1.26 -4.97 117.00 109.13 1uxd n LEU 56 Ca 0.00 0.07 -0.28 0.00 0.00 0.00 0.00 56.01 55.80 1uxd n LEU 56 Cb 0.00 -0.15 -0.16 0.00 0.00 0.00 0.00 43.42 43.11 1uxd n LEU 56 CO 0.00 -0.15 -0.33 -0.13 0.00 0.00 0.00 177.39 176.78 1uxd s ARG 57 N -0.29 0.24 -0.35 1.96 0.52 -1.26 -4.95 118.95 114.81 1uxd s ARG 57 Ca 0.00 -0.38 -0.06 0.00 -0.52 0.00 0.00 55.73 54.78 1uxd s ARG 57 Cb 0.00 -1.62 0.01 0.00 0.52 0.00 0.00 34.95 33.85 1uxd s ARG 57 CO 0.00 -0.83 0.21 -0.11 0.02 0.00 0.00 175.30 174.60 1uxd n LEU 58 N 5.20 -7.99 0.00 2.53 0.00 -1.26 -5.13 117.00 110.36 1uxd n LEU 58 Ca -0.06 1.12 0.00 0.00 0.00 0.00 0.00 56.01 57.06 1uxd n LEU 58 Cb 0.46 -3.36 0.00 0.00 0.00 0.00 0.00 43.42 40.51 1uxd n LEU 58 CO 0.08 -2.91 0.00 1.67 0.00 0.00 0.00 177.39 176.23