#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ntz n ARG 2 N 0.00 0.00 -1.04 1.61 1.85 -1.26 -5.08 116.66 112.74 1ntz n ARG 2 Ca 0.00 0.00 0.14 0.00 -1.00 0.00 0.00 57.85 56.99 1ntz n ARG 2 Cb 0.00 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.37 1ntz n ARG 2 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1ntz n GLN 3 N 0.00 -2.09 -4.77 2.89 6.02 -1.26 -4.47 117.38 113.69 1ntz n GLN 3 Ca 0.00 1.38 -0.27 0.00 -0.01 0.00 0.00 57.00 58.10 1ntz n GLN 3 Cb 0.00 -2.55 -0.17 0.00 1.02 0.00 0.00 30.24 28.54 1ntz n GLN 3 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1ntz s PHE 4 N -1.83 1.78 0.00 1.08 0.40 -1.26 -4.53 117.98 113.62 1ntz s PHE 4 Ca 0.00 -0.68 0.00 0.00 -0.60 0.00 0.00 56.93 55.65 1ntz s PHE 4 Cb 0.00 -1.25 0.00 0.00 0.51 0.00 0.00 43.02 42.28 1ntz s PHE 4 CO 0.00 -0.32 0.00 0.41 0.70 0.00 0.00 175.22 176.01 1ntz n GLY 5 N 3.72 0.70 0.14 4.36 0.00 -1.26 -4.88 105.19 107.97 1ntz n GLY 5 Ca -0.22 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.84 1ntz n GLY 5 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ntz n HIS 6 N -1.07 0.00 0.00 1.61 8.25 -1.26 -4.93 115.22 117.82 1ntz n HIS 6 Ca 0.00 -0.47 -0.00 0.00 -0.26 0.00 0.00 57.72 56.99 1ntz n HIS 6 Cb 0.00 -0.08 -0.00 0.00 1.12 0.00 0.00 29.99 31.03 1ntz n HIS 6 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1ntz h LEU 7 N 0.00 -0.01 -8.12 2.41 3.38 -1.80 -3.49 115.31 107.68 1ntz h LEU 7 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1ntz h LEU 7 Cb 0.97 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.68 1ntz h LEU 7 CO 0.00 0.00 0.12 0.28 0.09 0.00 0.00 178.44 178.93 1ntz s THR 8 N -1.56 0.00 -0.22 0.22 -1.32 -1.26 -5.16 115.64 106.34 1ntz s THR 8 Ca -0.00 -1.17 -0.16 0.00 -1.21 0.00 0.00 61.69 59.15 1ntz s THR 8 Cb 0.00 -2.45 -0.04 0.00 -1.51 0.00 0.00 72.50 68.51 1ntz s THR 8 CO 0.01 0.00 0.42 -0.60 -2.21 0.00 0.00 174.62 172.24 1ntz s ARG 9 N -3.24 4.13 -0.03 7.08 3.52 -1.26 -5.04 118.95 124.10 1ntz s ARG 9 Ca 0.18 0.20 0.02 0.00 -0.13 0.00 0.00 55.73 56.00 1ntz s ARG 9 Cb -0.04 -3.58 0.01 0.00 -1.56 0.00 0.00 34.95 29.78 1ntz s ARG 9 CO 0.11 -0.14 -0.09 0.08 -0.81 0.00 0.00 175.30 174.45 1ntz s VAL 10 N 1.64 0.79 0.04 7.11 1.01 -1.26 -5.15 120.40 124.58 1ntz s VAL 10 Ca 0.19 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 61.87 1ntz s VAL 10 Cb -0.15 -0.72 -0.02 0.00 0.00 0.00 0.00 36.38 35.49 1ntz s VAL 10 CO 0.09 0.26 -0.11 -0.13 0.00 0.00 0.00 175.10 175.20 1ntz s ARG 11 N 0.38 0.73 -1.16 2.72 0.52 -1.26 -4.91 118.95 115.97 1ntz s ARG 11 Ca -0.06 -0.68 -0.07 0.00 -0.52 0.00 0.00 55.73 54.39 1ntz s ARG 11 Cb -0.11 -0.67 0.01 0.00 0.52 0.00 0.00 34.95 34.70 1ntz s ARG 11 CO 0.01 0.16 1.01 0.72 0.02 0.00 0.00 175.30 177.22 1ntz n HIS 12 N 1.90 -2.45 -3.95 -0.53 8.25 -1.26 -5.01 115.22 112.17 1ntz n HIS 12 Ca -0.19 0.87 -0.29 0.00 -0.26 0.00 0.00 57.72 57.85 1ntz n HIS 12 Cb 0.55 -4.48 -0.16 0.00 1.12 0.00 0.00 29.99 27.01 1ntz n HIS 12 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1ntz s VAL 13 N -3.28 1.33 0.09 1.59 1.01 -1.26 -5.12 120.40 114.76 1ntz s VAL 13 Ca 0.47 -0.65 -0.08 0.00 0.00 0.00 0.00 61.98 61.73 1ntz s VAL 13 Cb -0.21 -1.38 -0.06 0.00 0.00 0.00 0.00 36.38 34.73 1ntz s VAL 13 CO 0.63 0.27 0.37 -0.63 0.00 0.00 0.00 175.10 175.74 1ntz s ILE 14 N 1.56 5.15 -0.24 2.22 1.01 -1.26 -5.08 121.20 124.55 1ntz s ILE 14 Ca 0.02 0.26 -0.02 0.00 0.00 0.00 0.00 60.65 60.92 1ntz s ILE 14 Cb -0.14 -3.62 0.07 0.00 0.01 0.00 0.00 42.46 38.78 1ntz s ILE 14 CO -0.09 0.20 0.05 -0.89 0.00 0.00 0.00 174.94 174.22 1ntz s THR 15 N -1.48 0.76 0.01 2.92 2.01 -1.26 -5.11 115.64 113.48 1ntz s THR 15 Ca 0.35 -0.93 -0.25 0.00 0.31 0.00 0.00 61.69 61.17 1ntz s THR 15 Cb -0.13 -1.34 -0.05 0.00 0.01 0.00 0.00 72.50 70.99 1ntz s THR 15 CO 0.20 -0.37 0.77 -0.31 -0.69 0.00 0.00 174.62 174.22 1ntz s TYR 16 N 1.72 3.68 0.17 4.92 1.51 -1.26 -5.05 117.35 123.05 1ntz s TYR 16 Ca 0.02 1.43 0.02 0.00 -1.01 0.00 0.00 57.07 57.53 1ntz s TYR 16 Cb -0.17 -2.85 -0.05 0.00 -0.11 0.00 0.00 41.96 38.78 1ntz s TYR 16 CO -0.14 0.19 0.00 -1.12 -1.11 0.00 0.00 175.55 173.37 1ntz s SER 17 N 0.31 1.16 0.02 2.29 0.01 -1.26 -5.16 113.70 111.07 1ntz s SER 17 Ca 0.40 -1.17 0.02 0.00 1.31 0.00 0.00 55.95 56.51 1ntz s SER 17 Cb -0.20 0.13 -0.01 0.00 0.21 0.00 0.00 66.02 66.15 1ntz s SER 17 CO 0.22 -0.58 -0.08 -0.22 0.41 0.00 0.00 173.24 173.00 1ntz s LEU 18 N -3.17 2.11 0.37 2.44 2.96 -1.26 -5.13 118.68 117.00 1ntz s LEU 18 Ca 0.24 -0.29 -0.28 0.00 -0.22 0.00 0.00 54.13 53.58 1ntz s LEU 18 Cb 0.06 -0.30 -0.11 0.00 0.50 0.00 0.00 46.19 46.34 1ntz s LEU 18 CO 0.04 -0.02 1.45 -0.55 -1.32 0.00 0.00 176.35 175.96 1ntz s SER 19 N -0.71 6.38 0.65 3.68 0.15 -1.26 -4.90 113.70 117.69 1ntz s SER 19 Ca -0.02 2.99 0.44 0.00 0.70 0.00 0.00 55.95 60.06 1ntz s SER 19 Cb -0.05 -2.66 2.39 0.00 -1.71 0.00 0.00 66.02 63.98 1ntz s SER 19 CO 0.00 -0.84 2.35 1.55 1.20 0.00 0.00 173.24 177.50 1ntz h PRO 20 N 3.01 0.00 -0.12 5.44 0.13 -2.00 -0.87 132.00 137.59 1ntz h PRO 20 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1ntz h PRO 20 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1ntz h PRO 20 CO 0.64 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.60 1ntz n PHE 21 N -3.04 0.14 -0.07 1.56 3.01 -1.26 -3.74 117.46 114.06 1ntz n PHE 21 Ca -0.03 -0.07 0.00 0.00 1.01 0.00 0.00 57.45 58.36 1ntz n PHE 21 Cb 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.54 1ntz n PHE 21 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1ntz n GLU 22 N 0.24 0.51 -4.30 -1.08 1.02 -0.34 -5.04 120.64 111.64 1ntz n GLU 22 Ca 0.17 -0.84 -0.16 0.00 -0.02 0.00 0.00 57.16 56.31 1ntz n GLU 22 Cb 0.33 -0.97 -0.10 0.00 -0.02 0.00 0.00 31.44 30.68 1ntz n GLU 22 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 1ntz s GLN 23 N -0.36 1.33 0.09 3.49 -2.07 -1.21 -5.01 119.66 115.92 1ntz s GLN 23 Ca 0.00 -1.70 -0.12 0.00 -1.82 0.00 0.00 55.36 51.72 1ntz s GLN 23 Cb 0.00 -0.32 -0.06 0.00 -1.09 0.00 0.00 33.01 31.54 1ntz s GLN 23 CO 0.00 -0.23 0.45 -0.98 -1.32 0.00 0.00 175.29 173.21 1ntz s ARG 24 N -3.98 3.87 0.29 9.60 1.70 -1.26 -4.94 118.95 124.22 1ntz s ARG 24 Ca 0.33 0.33 0.11 0.00 -0.47 0.00 0.00 55.73 56.03 1ntz s ARG 24 Cb 0.07 -3.02 0.41 0.00 -0.57 0.00 0.00 34.95 31.84 1ntz s ARG 24 CO 0.11 0.56 1.64 0.00 -1.08 0.00 0.00 175.30 176.53 1ntz h ALA 25 N 3.86 1.03 -2.73 7.88 0.00 -2.01 -3.36 119.26 123.93 1ntz h ALA 25 Ca -0.49 -0.53 -0.61 0.00 0.00 0.00 0.00 54.91 53.28 1ntz h ALA 25 Cb 1.20 -0.09 -0.40 0.00 0.00 0.00 0.00 17.79 18.49 1ntz h ALA 25 CO 0.65 0.73 -0.78 -0.06 0.00 0.00 0.00 179.25 179.80 1ntz s PHE 26 N -3.68 2.29 0.00 0.00 0.40 -1.26 -5.09 117.98 110.63 1ntz s PHE 26 Ca -0.01 -2.80 0.00 0.00 -0.60 0.00 0.00 56.93 53.52 1ntz s PHE 26 Cb 0.13 -1.80 0.00 0.00 0.51 0.00 0.00 43.02 41.86 1ntz s PHE 26 CO 0.76 -0.69 0.00 -2.30 0.70 0.00 0.00 175.22 173.68 1ntz n PRO 27 N 2.48 2.79 -0.51 0.24 -0.02 -1.26 -4.25 135.00 134.48 1ntz n PRO 27 Ca 0.24 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.57 1ntz n PRO 27 Cb 0.41 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.85 1ntz n PRO 27 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1ntz n HIS 28 N 0.00 0.00 -0.09 6.00 8.25 -1.26 -4.60 115.22 123.52 1ntz n HIS 28 Ca 0.00 -0.29 -0.10 0.00 -0.26 0.00 0.00 57.72 57.07 1ntz n HIS 28 Cb 0.00 -0.54 -0.03 0.00 1.12 0.00 0.00 29.99 30.54 1ntz n HIS 28 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1ntz h TYR 29 N 7.88 0.42 0.09 4.41 5.03 -1.98 -0.19 116.97 132.64 1ntz h TYR 29 Ca 0.09 -0.03 -0.36 0.00 2.58 0.00 0.00 58.73 61.01 1ntz h TYR 29 Cb 0.36 -0.13 -0.03 0.00 1.55 0.00 0.00 36.73 38.48 1ntz h TYR 29 CO 1.16 0.41 -2.06 1.19 -1.32 0.00 0.00 178.16 177.54 1ntz n PHE 30 N -4.77 1.01 0.00 -3.82 3.72 -1.26 -2.88 117.46 109.46 1ntz n PHE 30 Ca -0.02 0.23 0.00 0.00 -0.05 0.00 0.00 57.45 57.60 1ntz n PHE 30 Cb 0.12 -1.14 0.00 0.00 -0.94 0.00 0.00 39.48 37.53 1ntz n PHE 30 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1ntz n SER 31 N -3.39 0.00 0.12 4.37 7.64 -1.21 -2.36 113.62 118.80 1ntz n SER 31 Ca -0.33 0.71 -0.02 0.00 1.01 0.00 0.00 58.87 60.24 1ntz n SER 31 Cb 1.04 -0.21 0.11 0.00 -1.01 0.00 0.00 64.21 64.14 1ntz n SER 31 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1ntz h LYS 32 N 0.00 0.00 0.12 1.43 1.57 -1.30 -3.39 116.57 115.00 1ntz h LYS 32 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ntz h LYS 32 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1ntz h LYS 32 CO 0.00 0.69 -0.15 0.78 -0.57 0.00 0.00 179.45 180.21 1ntz h GLY 33 N 2.15 -0.93 0.36 3.86 0.00 -1.26 -3.02 103.07 104.23 1ntz h GLY 33 Ca -0.01 0.42 0.11 0.00 0.00 0.00 0.00 47.33 47.85 1ntz h GLY 33 CO 0.09 -0.32 0.31 1.19 0.00 0.00 0.00 176.54 177.81 1ntz h ILE 34 N -0.27 0.78 -0.98 2.60 2.10 -1.59 -1.99 117.51 118.16 1ntz h ILE 34 Ca -0.01 -0.18 0.20 0.00 1.08 0.00 0.00 64.86 65.95 1ntz h ILE 34 Cb 0.24 0.22 -0.11 0.00 -1.09 0.00 0.00 36.82 36.08 1ntz h ILE 34 CO -0.03 0.09 0.57 -0.65 -1.08 0.00 0.00 178.15 177.05 1ntz h PRO 35 N 0.52 0.65 -0.61 2.19 0.11 -1.75 -1.04 132.00 132.06 1ntz h PRO 35 Ca 0.36 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.36 1ntz h PRO 35 Cb 0.45 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.39 1ntz h PRO 35 CO -0.31 0.43 0.12 -0.91 -0.21 0.00 0.00 178.00 177.11 1ntz h ASN 36 N 0.67 0.95 -0.07 -2.05 2.35 -1.23 -1.20 115.58 115.00 1ntz h ASN 36 Ca 0.58 -0.25 -0.12 0.00 -0.55 0.00 0.00 56.30 55.96 1ntz h ASN 36 Cb 0.97 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 39.07 1ntz h ASN 36 CO -0.42 0.96 -0.34 -0.37 -1.65 0.00 0.00 177.43 175.61 1ntz h VAL 37 N 0.91 1.29 -0.38 2.81 -1.51 -1.01 0.29 116.25 118.63 1ntz h VAL 37 Ca 0.19 -1.46 -0.05 0.00 -1.23 0.00 0.00 66.70 64.16 1ntz h VAL 37 Cb 0.40 1.45 -0.02 0.00 -2.13 0.00 0.00 31.29 31.00 1ntz h VAL 37 CO 0.01 0.46 0.06 -0.07 -1.23 0.00 0.00 177.57 176.80 1ntz h LEU 38 N 0.48 0.61 -1.10 4.19 3.38 -1.19 0.66 115.31 122.34 1ntz h LEU 38 Ca 0.05 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 1ntz h LEU 38 Cb 0.81 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 1ntz h LEU 38 CO 0.07 0.72 0.22 -0.09 0.09 0.00 0.00 178.44 179.44 1ntz h ARG 39 N 0.48 0.85 -0.10 1.13 2.43 -0.96 0.79 114.38 119.00 1ntz h ARG 39 Ca 0.12 -0.14 -0.16 0.00 -0.81 0.00 0.00 59.98 58.99 1ntz h ARG 39 Cb 0.37 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1ntz h ARG 39 CO 0.01 0.71 -0.61 0.00 -1.51 0.00 0.00 179.97 178.57 1ntz h ARG 40 N 0.84 0.35 -0.11 0.20 3.08 -0.53 -2.35 114.38 115.85 1ntz h ARG 40 Ca 0.20 -0.24 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 1ntz h ARG 40 Cb 0.19 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 1ntz h ARG 40 CO -0.02 0.85 0.00 1.15 -1.07 0.00 0.00 179.97 180.89 1ntz h THR 41 N 0.26 1.25 -0.53 2.04 2.02 -0.04 -2.86 112.91 115.04 1ntz h THR 41 Ca -0.01 -0.80 0.08 0.00 0.77 0.00 0.00 66.41 66.46 1ntz h THR 41 Cb 1.13 1.57 -0.07 0.00 -1.74 0.00 0.00 68.15 69.05 1ntz h THR 41 CO 0.10 0.23 0.16 0.03 0.37 0.00 0.00 175.52 176.41 1ntz h ARG 42 N -0.08 0.31 -0.02 6.66 3.08 -0.81 0.11 114.38 123.62 1ntz h ARG 42 Ca 0.03 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.07 1ntz h ARG 42 Cb 0.35 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.33 1ntz h ARG 42 CO 0.01 0.20 0.02 0.00 -1.07 0.00 0.00 179.97 179.13 1ntz h ALA 43 N 1.38 2.01 0.00 0.04 0.00 -1.41 -3.25 119.26 118.04 1ntz h ALA 43 Ca 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1ntz h ALA 43 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1ntz h ALA 43 CO -0.30 -0.03 -1.19 0.00 0.00 0.00 0.00 179.25 177.73 1ntz h ILE 45 N 0.00 0.45 0.00 0.00 2.04 -0.87 -0.42 117.51 118.71 1ntz h ILE 45 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1ntz h ILE 45 Cb 0.37 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1ntz h ILE 45 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 178.15 178.33 1ntz n LEU 46 N -5.37 0.17 -0.06 1.44 4.77 -1.26 -0.33 117.00 116.36 1ntz n LEU 46 Ca 0.03 0.58 -0.07 0.00 -0.03 0.00 0.00 56.01 56.53 1ntz n LEU 46 Cb 0.28 -0.60 -0.09 0.00 -2.33 0.00 0.00 43.42 40.67 1ntz n LEU 46 CO 0.11 -0.63 -0.91 0.54 -1.33 0.00 0.00 177.39 175.16 1ntz n ARG 47 N -1.73 1.83 -0.09 3.23 1.74 -0.29 -4.65 116.66 116.70 1ntz n ARG 47 Ca -0.00 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.97 1ntz n ARG 47 Cb 0.01 -1.32 -0.05 0.00 -1.02 0.00 0.00 32.46 30.09 1ntz n ARG 47 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1ntz n VAL 48 N -2.51 1.47 -0.16 1.55 0.31 -0.51 -4.74 118.33 113.74 1ntz n VAL 48 Ca -0.21 0.10 -0.10 0.00 -0.01 0.00 0.00 64.34 64.12 1ntz n VAL 48 Cb 0.89 -2.26 -0.06 0.00 -0.91 0.00 0.00 33.84 31.50 1ntz n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ntz h ALA 49 N -0.88 -0.49 -0.31 3.52 0.00 -0.90 -3.30 119.26 116.89 1ntz h ALA 49 Ca -0.14 0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.90 1ntz h ALA 49 Cb 0.86 0.99 -0.08 0.00 0.00 0.00 0.00 17.79 19.56 1ntz h ALA 49 CO -0.08 -0.90 -0.41 -1.35 0.00 0.00 0.00 179.25 176.50 1ntz h PRO 50 N -0.31 -0.36 -0.88 0.00 0.11 -1.83 -1.22 132.00 127.52 1ntz h PRO 50 Ca 0.14 0.02 0.23 0.00 0.11 0.00 0.00 66.00 66.50 1ntz h PRO 50 Cb 0.58 0.08 -0.13 0.00 0.11 0.00 0.00 31.00 31.64 1ntz h PRO 50 CO -0.63 -0.24 0.31 -1.35 -0.21 0.00 0.00 178.00 175.88 1ntz h PRO 51 N -0.37 0.28 -0.34 1.05 0.11 -1.86 -1.54 132.00 129.32 1ntz h PRO 51 Ca 0.12 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.15 1ntz h PRO 51 Cb 0.59 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 1ntz h PRO 51 CO -0.51 0.19 -0.02 0.74 -0.21 0.00 0.00 178.00 178.18 1ntz h PHE 52 N 0.29 0.68 -0.57 0.65 0.04 -1.37 -2.53 116.94 114.14 1ntz h PHE 52 Ca 0.55 -0.13 -0.05 0.00 2.80 0.00 0.00 57.97 61.15 1ntz h PHE 52 Cb 1.09 -0.17 -0.03 0.00 2.20 0.00 0.00 35.95 39.04 1ntz h PHE 52 CO -0.20 0.75 0.15 -0.39 -0.60 0.00 0.00 178.31 178.02 1ntz h VAL 53 N 0.42 1.23 -0.90 -0.55 -1.51 -0.72 0.93 116.25 115.14 1ntz h VAL 53 Ca 0.09 -0.81 0.11 0.00 -1.23 0.00 0.00 66.70 64.87 1ntz h VAL 53 Cb 0.49 0.64 -0.08 0.00 -2.13 0.00 0.00 31.29 30.21 1ntz h VAL 53 CO 0.02 0.31 0.54 0.00 -1.23 0.00 0.00 177.57 177.20 1ntz h ALA 54 N 1.33 1.34 -0.13 5.19 0.00 -1.08 0.21 119.26 126.11 1ntz h ALA 54 Ca 0.18 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1ntz h ALA 54 Cb 0.28 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ntz h ALA 54 CO -0.00 0.13 -0.03 0.35 0.00 0.00 0.00 179.25 179.69 1ntz h PHE 55 N 0.86 0.28 -0.69 0.00 3.04 -0.89 -0.95 116.94 118.58 1ntz h PHE 55 Ca 0.45 -0.06 0.14 0.00 3.98 0.00 0.00 57.97 62.48 1ntz h PHE 55 Cb 0.46 -0.07 -0.10 0.00 2.56 0.00 0.00 35.95 38.80 1ntz h PHE 55 CO -0.04 0.54 0.20 -0.92 -2.02 0.00 0.00 178.31 176.07 1ntz h TYR 56 N -0.06 0.32 0.06 0.41 5.03 0.77 0.69 116.97 124.19 1ntz h TYR 56 Ca 0.03 0.04 -0.00 0.00 2.58 0.00 0.00 58.73 61.38 1ntz h TYR 56 Cb 0.45 -0.03 0.00 0.00 1.55 0.00 0.00 36.73 38.70 1ntz h TYR 56 CO 0.05 -0.02 -0.03 -0.07 -1.32 0.00 0.00 178.16 176.77 1ntz h LEU 57 N 0.32 -0.07 -1.76 2.82 3.38 -0.66 -2.56 115.31 116.78 1ntz h LEU 57 Ca 0.38 -0.32 0.08 0.00 0.09 0.00 0.00 57.88 58.11 1ntz h LEU 57 Cb 0.60 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 1ntz h LEU 57 CO -0.44 0.29 0.31 0.58 0.09 0.00 0.00 178.44 179.27 1ntz h VAL 58 N -0.43 0.91 0.06 1.22 2.07 0.26 -1.39 116.25 118.95 1ntz h VAL 58 Ca -0.01 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 67.41 1ntz h VAL 58 Cb 0.38 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1ntz h VAL 58 CO 0.01 0.05 -0.03 0.22 0.02 0.00 0.00 177.57 177.85 1ntz h TYR 59 N 0.28 -0.07 -0.35 1.57 3.20 0.40 -0.42 116.97 121.58 1ntz h TYR 59 Ca 0.21 -0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.93 1ntz h TYR 59 Cb 0.47 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 1ntz h TYR 59 CO -0.00 0.29 -0.36 1.79 -1.64 0.00 0.00 178.16 178.24 1ntz h THR 60 N -0.45 1.28 0.14 1.81 1.35 -1.08 -1.75 112.91 114.21 1ntz h THR 60 Ca -0.01 -1.53 -0.01 0.00 -0.55 0.00 0.00 66.41 64.32 1ntz h THR 60 Cb 0.40 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 68.28 1ntz h THR 60 CO 0.01 0.50 -0.07 -0.25 -0.25 0.00 0.00 175.52 175.47 1ntz h TRP 61 N 0.65 -0.18 -0.94 4.73 7.01 -1.36 -1.90 115.95 123.97 1ntz h TRP 61 Ca 0.05 -0.00 0.17 0.00 2.11 0.00 0.00 58.89 61.22 1ntz h TRP 61 Cb 0.94 0.06 -0.08 0.00 -2.10 0.00 0.00 29.16 27.98 1ntz h TRP 61 CO 0.07 -0.03 0.60 0.78 -2.79 0.00 0.00 178.44 177.06 1ntz h GLY 62 N -0.28 1.31 0.68 2.65 0.00 -1.00 -0.04 103.07 106.39 1ntz h GLY 62 Ca -0.02 -0.30 -0.09 0.00 0.00 0.00 0.00 47.33 46.93 1ntz h GLY 62 CO 0.03 0.03 -0.29 -0.84 0.00 0.00 0.00 176.54 175.47 1ntz h THR 63 N 0.66 1.42 -0.40 4.70 2.02 -1.25 -2.99 112.91 117.06 1ntz h THR 63 Ca 0.50 -1.66 0.02 0.00 0.77 0.00 0.00 66.41 66.03 1ntz h THR 63 Cb 0.88 2.27 -0.03 0.00 -1.74 0.00 0.00 68.15 69.53 1ntz h THR 63 CO -0.25 0.48 0.23 1.56 0.37 0.00 0.00 175.52 177.90 1ntz h GLN 64 N -0.15 0.44 -0.33 6.66 4.20 -0.41 -2.01 115.11 123.51 1ntz h GLN 64 Ca -0.01 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1ntz h GLN 64 Cb 0.92 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.58 1ntz h GLN 64 CO 0.06 0.29 0.21 1.49 -0.67 0.00 0.00 178.83 180.22 1ntz h GLU 65 N 0.46 0.44 0.09 1.46 4.57 -1.14 -1.34 114.58 119.12 1ntz h GLU 65 Ca 0.16 -0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.33 1ntz h GLU 65 Cb 0.03 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.50 1ntz h GLU 65 CO -0.09 0.31 -0.21 0.35 -1.18 0.00 0.00 179.01 178.19 1ntz h PHE 66 N 0.44 -0.54 -0.26 0.92 3.57 -1.34 -0.63 116.94 119.10 1ntz h PHE 66 Ca 0.12 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.52 1ntz h PHE 66 Cb -0.03 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 1ntz h PHE 66 CO -0.05 -0.30 -0.31 0.93 -2.23 0.00 0.00 178.31 176.35 1ntz h GLU 67 N -0.38 0.54 0.00 1.11 5.08 -1.32 -2.57 114.58 117.04 1ntz h GLU 67 Ca 0.03 -0.23 -0.03 0.00 -1.00 0.00 0.00 59.36 58.13 1ntz h GLU 67 Cb 0.41 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1ntz h GLU 67 CO -0.12 0.79 -0.15 0.87 -1.00 0.00 0.00 179.01 179.39 1ntz h LYS 68 N 0.46 0.00 0.00 2.33 1.57 -1.14 -3.27 116.57 116.53 1ntz h LYS 68 Ca 0.06 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.71 1ntz h LYS 68 Cb 0.77 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.06 1ntz h LYS 68 CO 0.06 0.15 -0.62 1.03 -0.57 0.00 0.00 179.45 179.50 1ntz h SER 69 N 0.00 0.00 -0.19 0.86 0.87 -0.68 -3.23 113.55 111.18 1ntz h SER 69 Ca -0.00 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.46 1ntz h SER 69 Cb 0.84 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.75 1ntz h SER 69 CO 0.02 0.62 0.13 0.29 -0.53 0.00 0.00 176.83 177.36 1ntz n LYS 70 N -3.64 1.24 -4.32 2.24 5.02 -1.21 -4.79 118.16 112.71 1ntz n LYS 70 Ca -0.01 -0.57 -0.17 0.00 -2.02 0.00 0.00 58.31 55.54 1ntz n LYS 70 Cb 0.65 -1.22 -0.10 0.00 -0.02 0.00 0.00 35.03 34.33 1ntz n LYS 70 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1ntz s ARG 71 N -0.63 1.32 -0.28 1.97 0.52 -1.22 -5.13 118.95 115.50 1ntz s ARG 71 Ca 0.11 -1.67 -0.23 0.00 -0.52 0.00 0.00 55.73 53.43 1ntz s ARG 71 Cb 0.09 -0.57 0.12 0.00 0.52 0.00 0.00 34.95 35.11 1ntz s ARG 71 CO 0.02 -0.11 0.98 0.21 0.02 0.00 0.00 175.30 176.42 1ntz s LYS 72 N -3.87 0.51 0.00 3.54 2.47 -1.26 -5.08 119.74 116.05 1ntz s LYS 72 Ca 0.28 0.67 0.00 0.00 -1.56 0.00 0.00 55.97 55.37 1ntz s LYS 72 Cb 0.06 0.22 0.00 0.00 -1.46 0.00 0.00 37.83 36.65 1ntz s LYS 72 CO 0.08 -0.07 0.00 -1.71 0.16 0.00 0.00 175.35 173.81 1ntz n ASN 73 N 2.65 0.00 -4.11 1.43 2.85 -1.26 -5.07 115.26 111.75 1ntz n ASN 73 Ca -0.14 0.00 -0.30 0.00 -0.11 0.00 0.00 54.58 54.03 1ntz n ASN 73 Cb 0.56 0.00 0.20 0.00 1.24 0.00 0.00 39.78 41.79 1ntz n ASN 73 CO 0.00 0.00 0.00 -2.84 -2.11 0.00 0.00 177.26 172.31 1ntz s PRO 74 N 1.07 -0.22 0.00 1.20 0.02 -1.26 -5.35 135.00 130.46 1ntz s PRO 74 Ca 0.00 -0.08 0.00 0.00 0.02 0.00 0.00 61.00 60.94 1ntz s PRO 74 Cb 0.00 -1.71 0.00 0.00 0.02 0.00 0.00 34.50 32.81 1ntz s PRO 74 CO 0.00 -3.05 0.00 0.00 -0.33 0.00 0.00 177.00 173.62