#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ihp s GLN 2 N 0.00 3.01 0.25 3.17 -2.07 -1.26 -1.08 119.66 121.69 3ihp s GLN 2 Ca 0.00 -0.47 0.02 0.00 -1.82 0.00 0.00 55.36 53.10 3ihp s GLN 2 Cb 0.00 -2.83 -0.05 0.00 -1.09 0.00 0.00 33.01 29.04 3ihp s GLN 2 CO 0.00 0.67 0.05 0.96 -1.32 0.00 0.00 175.29 175.65 3ihp s ILE 3 N -1.09 0.80 0.12 3.63 -4.36 -0.96 0.88 121.20 120.22 3ihp s ILE 3 Ca 0.19 -2.01 0.10 0.00 -0.26 0.00 0.00 60.65 58.67 3ihp s ILE 3 Cb -0.12 -2.52 -0.04 0.00 1.25 0.00 0.00 42.46 41.03 3ihp s ILE 3 CO 0.10 -0.15 -0.21 -0.36 0.24 0.00 0.00 174.94 174.56 3ihp s PHE 4 N -3.58 2.46 -0.06 1.37 0.40 -0.32 -1.50 117.98 116.75 3ihp s PHE 4 Ca 0.33 -0.30 -0.00 0.00 -0.60 0.00 0.00 56.93 56.36 3ihp s PHE 4 Cb 0.07 -1.31 0.03 0.00 0.51 0.00 0.00 43.02 42.31 3ihp s PHE 4 CO 0.11 0.37 -0.01 0.08 0.70 0.00 0.00 175.22 176.47 3ihp s VAL 5 N -1.12 0.40 -0.32 -0.44 1.01 0.43 -0.94 120.40 119.43 3ihp s VAL 5 Ca 0.17 0.05 -0.23 0.00 0.00 0.00 0.00 61.98 61.97 3ihp s VAL 5 Cb -0.10 -0.51 -0.00 0.00 0.00 0.00 0.00 36.38 35.76 3ihp s VAL 5 CO 0.09 0.24 0.75 -0.75 0.00 0.00 0.00 175.10 175.43 3ihp s LYS 6 N 1.58 3.91 0.75 2.72 2.20 -0.22 -0.89 119.74 129.79 3ihp s LYS 6 Ca -0.01 0.48 -0.12 0.00 -0.36 0.00 0.00 55.97 55.96 3ihp s LYS 6 Cb -0.13 -3.74 0.04 0.00 -1.51 0.00 0.00 37.83 32.49 3ihp s LYS 6 CO -0.03 -0.68 1.10 0.99 -0.36 0.00 0.00 175.35 176.36 3ihp s THR 7 N 2.90 3.23 0.03 3.43 2.01 0.30 -2.14 115.64 125.40 3ihp s THR 7 Ca 0.31 0.40 0.32 0.00 0.31 0.00 0.00 61.69 63.03 3ihp s THR 7 Cb -0.14 -3.31 0.38 0.00 0.01 0.00 0.00 72.50 69.45 3ihp s THR 7 CO 0.13 -0.52 1.93 -0.07 -0.69 0.00 0.00 174.62 175.40 3ihp h LEU 8 N -0.84 0.00 -1.90 4.42 3.38 -1.85 -1.48 115.31 117.04 3ihp h LEU 8 Ca -0.46 0.00 0.11 0.00 0.09 0.00 0.00 57.88 57.63 3ihp h LEU 8 Cb 1.26 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 3ihp h LEU 8 CO 0.62 0.00 0.33 0.74 0.09 0.00 0.00 178.44 180.22 3ihp h THR 9 N 0.00 0.82 0.00 0.22 2.02 -1.99 -3.45 112.91 110.53 3ihp h THR 9 Ca -0.00 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.14 3ihp h THR 9 Cb 0.58 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 3ihp h THR 9 CO 0.00 0.02 0.00 0.61 0.37 0.00 0.00 175.52 176.52 3ihp n GLY 10 N -1.59 2.14 3.64 2.16 0.00 -0.56 -5.08 105.19 105.91 3ihp n GLY 10 Ca 0.08 -0.17 -0.47 0.00 0.00 0.00 0.00 46.02 45.45 3ihp n GLY 10 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3ihp n LYS 11 N 0.00 1.81 -3.82 1.61 4.81 -1.26 -4.52 118.16 116.79 3ihp n LYS 11 Ca 0.00 0.65 -0.35 0.00 -0.87 0.00 0.00 58.31 57.74 3ihp n LYS 11 Cb 0.00 -2.35 -0.09 0.00 0.02 0.00 0.00 35.03 32.61 3ihp n LYS 11 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 3ihp s THR 12 N 0.54 5.07 0.29 3.15 2.01 -1.26 -0.54 115.64 124.90 3ihp s THR 12 Ca 0.78 0.07 0.11 0.00 0.31 0.00 0.00 61.69 62.96 3ihp s THR 12 Cb -0.75 -3.32 -0.05 0.00 0.01 0.00 0.00 72.50 68.38 3ihp s THR 12 CO 0.43 0.41 -0.10 0.27 -0.69 0.00 0.00 174.62 174.94 3ihp s ILE 13 N 0.68 2.79 0.07 1.82 -4.36 -0.07 -4.92 121.20 117.21 3ihp s ILE 13 Ca 0.06 -2.17 0.03 0.00 -0.26 0.00 0.00 60.65 58.30 3ihp s ILE 13 Cb -0.13 -2.57 -0.04 0.00 1.25 0.00 0.00 42.46 40.97 3ihp s ILE 13 CO 0.01 -0.35 0.07 0.42 0.24 0.00 0.00 174.94 175.34 3ihp s THR 14 N -2.46 4.53 0.15 8.37 -4.23 -1.26 -0.43 115.64 120.31 3ihp s THR 14 Ca 0.31 -0.72 0.06 0.00 -1.18 0.00 0.00 61.69 60.17 3ihp s THR 14 Cb -0.04 -3.16 -0.04 0.00 1.34 0.00 0.00 72.50 70.60 3ihp s THR 14 CO 0.17 0.16 -0.14 -0.76 -0.54 0.00 0.00 174.62 173.51 3ihp s LEU 15 N -2.27 2.46 -0.29 4.79 1.43 -0.56 -4.96 118.68 119.27 3ihp s LEU 15 Ca 0.28 -0.89 -0.09 0.00 -1.03 0.00 0.00 54.13 52.39 3ihp s LEU 15 Cb -0.12 -0.59 -0.02 0.00 0.03 0.00 0.00 46.19 45.49 3ihp s LEU 15 CO 0.20 -0.16 0.14 -0.70 0.23 0.00 0.00 176.35 176.07 3ihp s GLU 16 N -3.05 3.49 0.11 1.70 2.12 -1.26 -2.27 118.70 119.53 3ihp s GLU 16 Ca 0.14 -0.61 -0.05 0.00 0.36 0.00 0.00 54.97 54.81 3ihp s GLU 16 Cb -0.03 -3.53 -0.02 0.00 0.26 0.00 0.00 34.13 30.81 3ihp s GLU 16 CO 0.04 -0.34 0.13 0.14 -0.54 0.00 0.00 175.26 174.70 3ihp s VAL 17 N 1.64 0.13 0.14 3.70 -7.23 -0.24 -4.97 120.40 113.57 3ihp s VAL 17 Ca 0.05 -1.53 0.11 0.00 -1.81 0.00 0.00 61.98 58.80 3ihp s VAL 17 Cb -0.16 -1.65 -0.04 0.00 0.56 0.00 0.00 36.38 35.09 3ihp s VAL 17 CO 0.06 -0.61 -0.26 -1.61 -0.31 0.00 0.00 175.10 172.38 3ihp s GLU 18 N -3.94 1.38 0.47 4.82 0.41 -1.26 -0.64 118.70 119.93 3ihp s GLU 18 Ca 0.12 -1.35 0.20 0.00 -0.41 0.00 0.00 54.97 53.53 3ihp s GLU 18 Cb 0.06 -1.81 1.19 0.00 -1.78 0.00 0.00 34.13 31.79 3ihp s GLU 18 CO -0.06 0.42 1.94 -1.35 -0.49 0.00 0.00 175.26 175.73 3ihp h PRO 19 N 3.80 0.25 0.00 0.39 0.11 -1.96 -0.10 132.00 134.49 3ihp h PRO 19 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3ihp h PRO 19 Cb 1.18 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3ihp h PRO 19 CO 0.41 0.17 0.00 -1.13 -0.21 0.00 0.00 178.00 177.23 3ihp n SER 20 N -4.43 0.00 -4.76 -2.05 3.41 -1.26 -0.78 113.62 103.74 3ihp n SER 20 Ca 0.13 0.24 -0.41 0.00 -0.26 0.00 0.00 58.87 58.57 3ihp n SER 20 Cb 0.59 -0.39 -0.02 0.00 -0.26 0.00 0.00 64.21 64.13 3ihp n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3ihp s ASP 21 N -2.79 6.59 0.64 4.04 1.01 -0.05 -4.77 116.67 121.34 3ihp s ASP 21 Ca 0.15 2.79 -0.11 0.00 0.71 0.00 0.00 52.55 56.09 3ihp s ASP 21 Cb 0.14 -2.64 -0.03 0.00 1.01 0.00 0.00 42.92 41.40 3ihp s ASP 21 CO 0.36 -0.71 1.04 0.42 0.21 0.00 0.00 175.17 176.49 3ihp s THR 22 N -0.58 4.48 0.07 -1.27 -4.23 -1.26 -1.51 115.64 111.34 3ihp s THR 22 Ca 0.55 0.80 -0.23 0.00 -1.18 0.00 0.00 61.69 61.64 3ihp s THR 22 Cb -0.43 -3.76 -0.15 0.00 1.34 0.00 0.00 72.50 69.50 3ihp s THR 22 CO 0.51 -1.05 1.63 0.40 -0.54 0.00 0.00 174.62 175.56 3ihp h ILE 23 N -0.41 1.11 -0.91 2.99 5.03 -1.51 0.15 117.51 123.95 3ihp h ILE 23 Ca -0.44 -0.32 0.17 0.00 -0.12 0.00 0.00 64.86 64.15 3ihp h ILE 23 Cb 1.20 1.25 -0.17 0.00 -3.03 0.00 0.00 36.82 36.07 3ihp h ILE 23 CO 0.62 0.09 -0.26 1.21 -0.68 0.00 0.00 178.15 179.12 3ihp n GLU 24 N -4.99 -0.12 -0.09 2.37 2.13 -1.24 -0.25 120.64 118.44 3ihp n GLU 24 Ca -0.07 1.41 -0.10 0.00 0.66 0.00 0.00 57.16 59.07 3ihp n GLU 24 Cb 0.09 -2.11 -0.02 0.00 0.27 0.00 0.00 31.44 29.67 3ihp n GLU 24 CO 0.00 0.00 0.00 -0.97 -0.41 0.00 0.00 177.13 175.75 3ihp h ASN 25 N 0.00 0.40 -0.66 4.31 -0.73 -1.44 -2.54 115.58 114.91 3ihp h ASN 25 Ca 0.40 -0.13 -0.01 0.00 1.87 0.00 0.00 56.30 58.43 3ihp h ASN 25 Cb 0.63 -0.10 -0.03 0.00 0.27 0.00 0.00 38.32 39.09 3ihp h ASN 25 CO -0.93 0.42 0.37 0.58 -0.37 0.00 0.00 177.43 177.50 3ihp h VAL 26 N 0.35 1.21 -0.89 2.57 2.07 0.80 -2.71 116.25 119.65 3ihp h VAL 26 Ca 0.10 -0.51 0.07 0.00 0.82 0.00 0.00 66.70 67.19 3ihp h VAL 26 Cb 0.13 0.33 -0.06 0.00 -1.52 0.00 0.00 31.29 30.17 3ihp h VAL 26 CO -0.01 0.22 0.58 0.11 0.02 0.00 0.00 177.57 178.49 3ihp h LYS 27 N 0.91 0.94 -0.05 1.57 1.57 -0.50 0.16 116.57 121.16 3ihp h LYS 27 Ca 0.23 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.91 3ihp h LYS 27 Cb 0.03 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 3ihp h LYS 27 CO -0.04 0.62 -0.18 0.00 -0.57 0.00 0.00 179.45 179.28 3ihp h ALA 28 N 1.53 1.61 0.07 3.86 0.00 -1.15 -1.79 119.26 123.40 3ihp h ALA 28 Ca 0.39 -0.19 -0.24 0.00 0.00 0.00 0.00 54.91 54.87 3ihp h ALA 28 Cb 0.27 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3ihp h ALA 28 CO -0.15 0.29 -1.11 0.87 0.00 0.00 0.00 179.25 179.14 3ihp h LYS 29 N 0.08 0.21 -0.55 0.00 1.57 -0.80 -1.96 116.57 115.11 3ihp h LYS 29 Ca 0.01 -0.32 -0.07 0.00 -1.87 0.00 0.00 60.65 58.40 3ihp h LYS 29 Cb 0.36 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 3ihp h LYS 29 CO 0.02 1.12 0.06 0.82 -0.57 0.00 0.00 179.45 180.91 3ihp h ILE 30 N 0.07 1.25 -0.24 1.86 2.04 -1.04 -2.12 117.51 119.33 3ihp h ILE 30 Ca -0.09 -0.98 0.01 0.00 1.00 0.00 0.00 64.86 64.79 3ihp h ILE 30 Cb 1.83 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 38.65 3ihp h ILE 30 CO 0.17 0.36 0.14 -0.61 0.00 0.00 0.00 178.15 178.22 3ihp h GLN 31 N 0.85 0.29 -0.46 2.37 4.15 -1.22 0.39 115.11 121.49 3ihp h GLN 31 Ca 0.17 -0.02 0.05 0.00 0.77 0.00 0.00 58.65 59.62 3ihp h GLN 31 Cb 0.42 -0.07 -0.05 0.00 0.21 0.00 0.00 27.48 28.00 3ihp h GLN 31 CO 0.01 0.19 0.19 -0.44 -1.93 0.00 0.00 178.83 176.86 3ihp h ASP 32 N 0.30 0.24 0.01 -0.69 3.32 -1.09 0.53 116.42 119.04 3ihp h ASP 32 Ca 0.09 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.15 3ihp h ASP 32 Cb -0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3ihp h ASP 32 CO -0.04 0.18 -0.15 0.50 -1.72 0.00 0.00 179.24 178.01 3ihp h LYS 33 N 0.39 0.08 0.00 3.56 3.64 -1.20 -3.39 116.57 119.65 3ihp h LYS 33 Ca 0.21 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 3ihp h LYS 33 Cb 0.17 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 3ihp h LYS 33 CO -0.18 0.94 -1.32 0.39 -2.27 0.00 0.00 179.45 177.01 3ihp n GLU 34 N -4.56 1.02 0.00 1.90 -0.58 0.14 -5.01 120.64 113.55 3ihp n GLU 34 Ca -0.10 -0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.55 3ihp n GLU 34 Cb 0.50 -1.34 0.00 0.00 -0.57 0.00 0.00 31.44 30.03 3ihp n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ihp n GLY 35 N 1.48 2.14 3.63 0.62 0.00 0.18 -4.99 105.19 108.25 3ihp n GLY 35 Ca -0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3ihp n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ihp s ILE 36 N -2.41 3.27 0.17 -0.61 1.01 -1.26 -4.89 121.20 116.48 3ihp s ILE 36 Ca 0.00 0.30 -0.33 0.00 0.00 0.00 0.00 60.65 60.62 3ihp s ILE 36 Cb 0.00 -3.28 -0.13 0.00 0.01 0.00 0.00 42.46 39.06 3ihp s ILE 36 CO 0.00 -0.12 1.66 -2.65 0.00 0.00 0.00 174.94 173.83 3ihp n PRO 37 N 7.99 2.43 0.00 2.79 -0.02 -1.26 -3.93 135.00 143.00 3ihp n PRO 37 Ca 0.23 0.88 0.21 0.00 -2.02 0.00 0.00 63.50 62.79 3ihp n PRO 37 Cb 0.44 -2.69 0.71 0.00 -0.02 0.00 0.00 33.50 31.94 3ihp n PRO 37 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3ihp h PRO 38 N 6.50 0.00 0.00 0.52 0.11 -1.92 0.12 132.00 137.34 3ihp h PRO 38 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3ihp h PRO 38 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3ihp h PRO 38 CO 0.92 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.31 3ihp n ASP 39 N -4.26 0.00 -0.38 -2.05 3.85 -1.26 -1.86 116.55 110.59 3ihp n ASP 39 Ca 0.10 0.32 0.10 0.00 -0.71 0.00 0.00 54.79 54.60 3ihp n ASP 39 Cb 0.63 -0.43 -0.02 0.00 -1.35 0.00 0.00 41.12 39.95 3ihp n ASP 39 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3ihp n GLN 40 N -1.43 1.22 -3.19 0.11 1.13 0.43 -4.98 117.38 110.67 3ihp n GLN 40 Ca 0.07 -0.78 -0.39 0.00 -1.94 0.00 0.00 57.00 53.96 3ihp n GLN 40 Cb 0.24 -1.42 -0.05 0.00 0.11 0.00 0.00 30.24 29.12 3ihp n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 3ihp s GLN 41 N -2.40 4.34 -0.15 -1.09 -0.21 -0.78 -4.96 119.66 114.40 3ihp s GLN 41 Ca 0.15 0.73 -0.01 0.00 0.02 0.00 0.00 55.36 56.24 3ihp s GLN 41 Cb 0.16 -3.37 0.04 0.00 1.00 0.00 0.00 33.01 30.85 3ihp s GLN 41 CO 0.57 0.30 -0.01 0.50 -2.12 0.00 0.00 175.29 174.53 3ihp s ARG 42 N 0.05 0.97 -0.17 2.91 3.52 -1.26 -5.02 118.95 119.95 3ihp s ARG 42 Ca 0.31 -0.33 -0.08 0.00 -0.13 0.00 0.00 55.73 55.50 3ihp s ARG 42 Cb -0.18 -1.79 -0.04 0.00 -1.56 0.00 0.00 34.95 31.38 3ihp s ARG 42 CO 0.17 -0.47 0.11 -0.51 -0.81 0.00 0.00 175.30 173.78 3ihp s LEU 43 N 1.79 4.10 -0.12 -0.88 1.43 -1.26 -1.46 118.68 122.28 3ihp s LEU 43 Ca 0.01 0.23 -0.01 0.00 -1.03 0.00 0.00 54.13 53.34 3ihp s LEU 43 Cb -0.15 -2.03 -0.02 0.00 0.03 0.00 0.00 46.19 44.01 3ihp s LEU 43 CO -0.07 0.24 -0.10 -0.63 0.23 0.00 0.00 176.35 176.02 3ihp s ILE 44 N 0.01 3.36 -0.10 -0.59 -1.09 0.67 -0.94 121.20 122.52 3ihp s ILE 44 Ca 0.08 -0.56 0.01 0.00 -2.23 0.00 0.00 60.65 57.95 3ihp s ILE 44 Cb -0.12 -2.41 0.02 0.00 -1.58 0.00 0.00 42.46 38.37 3ihp s ILE 44 CO 0.00 0.53 -0.12 0.12 -1.23 0.00 0.00 174.94 174.24 3ihp s PHE 45 N 0.11 1.69 -1.40 3.97 5.36 0.29 -0.90 117.98 127.09 3ihp s PHE 45 Ca -0.04 -0.77 -0.02 0.00 -0.96 0.00 0.00 56.93 55.14 3ihp s PHE 45 Cb -0.14 -1.27 0.01 0.00 -0.34 0.00 0.00 43.02 41.28 3ihp s PHE 45 CO 0.04 -0.44 0.53 0.00 -1.46 0.00 0.00 175.22 173.89 3ihp n ALA 46 N 4.33 -1.94 -1.12 11.12 0.00 -1.26 -1.59 120.51 130.04 3ihp n ALA 46 Ca -0.18 -0.21 -0.04 0.00 0.00 0.00 0.00 53.44 53.00 3ihp n ALA 46 Cb 0.51 -1.82 -0.02 0.00 0.00 0.00 0.00 19.45 18.12 3ihp n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ihp n GLY 47 N -1.84 0.70 2.94 0.00 0.00 -1.26 -5.03 105.19 100.70 3ihp n GLY 47 Ca -0.27 -0.55 -0.11 0.00 0.00 0.00 0.00 46.02 45.09 3ihp n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ihp s LYS 48 N -1.93 0.23 0.27 1.61 -2.85 -0.62 -5.14 119.74 111.31 3ihp s LYS 48 Ca 0.00 -0.35 -0.29 0.00 -1.00 0.00 0.00 55.97 54.33 3ihp s LYS 48 Cb 0.00 -0.03 -0.09 0.00 -2.06 0.00 0.00 37.83 35.64 3ihp s LYS 48 CO 0.00 -0.00 1.19 -1.14 0.10 0.00 0.00 175.35 175.50 3ihp s GLN 49 N -0.77 4.52 -0.10 1.78 0.74 -1.26 -0.55 119.66 124.02 3ihp s GLN 49 Ca -0.07 1.94 -0.11 0.00 0.05 0.00 0.00 55.36 57.17 3ihp s GLN 49 Cb -0.05 -3.17 -0.05 0.00 1.10 0.00 0.00 33.01 30.84 3ihp s GLN 49 CO -0.00 0.02 0.25 -0.51 -0.55 0.00 0.00 175.29 174.49 3ihp s LEU 50 N -1.18 4.37 0.09 3.68 1.43 -0.11 -4.90 118.68 122.05 3ihp s LEU 50 Ca 0.48 0.59 0.06 0.00 -1.03 0.00 0.00 54.13 54.24 3ihp s LEU 50 Cb -0.34 -2.28 -0.04 0.00 0.03 0.00 0.00 46.19 43.56 3ihp s LEU 50 CO 0.43 0.30 -0.09 -1.61 0.23 0.00 0.00 176.35 175.61 3ihp s GLU 51 N -0.60 2.21 0.27 1.70 2.02 -1.26 -4.63 118.70 118.41 3ihp s GLU 51 Ca 0.17 -0.97 -0.01 0.00 0.02 0.00 0.00 54.97 54.18 3ihp s GLU 51 Cb -0.13 -2.34 0.46 0.00 0.10 0.00 0.00 34.13 32.21 3ihp s GLU 51 CO 0.06 0.52 1.84 -0.44 0.02 0.00 0.00 175.26 177.27 3ihp h ASP 52 N 3.76 0.90 -0.91 -0.19 3.45 -1.98 -2.19 116.42 119.25 3ihp h ASP 52 Ca -0.49 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.01 3ihp h ASP 52 Cb 1.17 -0.15 -0.04 0.00 -0.56 0.00 0.00 39.33 39.74 3ihp h ASP 52 CO 0.53 0.52 0.58 1.23 -1.57 0.00 0.00 179.24 180.54 3ihp h GLY 53 N 1.01 1.30 -0.82 2.75 0.00 -1.99 -3.30 103.07 102.01 3ihp h GLY 53 Ca 0.45 -0.51 -0.48 0.00 0.00 0.00 0.00 47.33 46.79 3ihp h GLY 53 CO -0.23 0.50 0.39 0.50 0.00 0.00 0.00 176.54 177.70 3ihp s ARG 54 N -6.06 2.21 0.46 4.80 1.81 -0.83 -4.85 118.95 116.50 3ihp s ARG 54 Ca -0.13 0.31 0.08 0.00 -1.72 0.00 0.00 55.73 54.27 3ihp s ARG 54 Cb 0.17 -1.96 0.01 0.00 -0.45 0.00 0.00 34.95 32.72 3ihp s ARG 54 CO 0.81 -1.46 0.48 0.95 -0.68 0.00 0.00 175.30 175.40 3ihp s THR 55 N -3.42 2.46 0.20 0.02 -4.23 -1.26 -1.94 115.64 107.46 3ihp s THR 55 Ca 0.61 -1.26 -0.10 0.00 -1.18 0.00 0.00 61.69 59.76 3ihp s THR 55 Cb -0.12 -2.71 0.15 0.00 1.34 0.00 0.00 72.50 71.15 3ihp s THR 55 CO 0.51 0.00 1.81 -0.07 -0.54 0.00 0.00 174.62 176.33 3ihp h LEU 56 N 0.78 0.96 -1.38 4.79 3.38 -1.12 -2.67 115.31 120.06 3ihp h LEU 56 Ca -0.38 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.43 3ihp h LEU 56 Cb 1.28 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 3ihp h LEU 56 CO 0.53 0.80 -0.07 0.77 0.09 0.00 0.00 178.44 180.55 3ihp h SER 57 N 1.05 0.31 -0.81 -0.43 4.64 -1.23 -1.19 113.55 115.88 3ihp h SER 57 Ca 0.26 -0.06 0.10 0.00 -0.47 0.00 0.00 61.79 61.62 3ihp h SER 57 Cb 0.07 -0.08 -0.07 0.00 -0.31 0.00 0.00 62.40 62.00 3ihp h SER 57 CO -0.04 0.42 0.45 0.44 -0.87 0.00 0.00 176.83 177.23 3ihp h ASP 58 N 0.32 0.63 -0.05 4.97 3.45 -1.75 -0.23 116.42 123.76 3ihp h ASP 58 Ca 0.07 0.05 0.00 0.00 0.43 0.00 0.00 57.03 57.58 3ihp h ASP 58 Cb 0.33 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.03 3ihp h ASP 58 CO 0.02 0.36 0.00 -1.22 -1.57 0.00 0.00 179.24 176.82 3ihp n TYR 59 N -4.77 0.06 -3.62 4.55 4.02 -0.86 -4.91 117.16 111.62 3ihp n TYR 59 Ca 0.13 -0.03 -0.22 0.00 -0.01 0.00 0.00 57.90 57.78 3ihp n TYR 59 Cb 0.28 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.65 3ihp n TYR 59 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3ihp n ASN 60 N -0.20 -2.54 -4.59 7.72 4.05 -0.10 -4.96 115.26 114.65 3ihp n ASN 60 Ca 0.18 -0.82 -0.41 0.00 0.45 0.00 0.00 54.58 53.98 3ihp n ASN 60 Cb 0.25 -4.16 -0.06 0.00 1.23 0.00 0.00 39.78 37.03 3ihp n ASN 60 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 3ihp s ILE 61 N -3.58 4.92 0.43 -1.44 1.01 -0.51 -5.02 121.20 117.01 3ihp s ILE 61 Ca 0.13 0.80 0.08 0.00 0.00 0.00 0.00 60.65 61.66 3ihp s ILE 61 Cb -0.03 -4.02 -0.01 0.00 0.01 0.00 0.00 42.46 38.41 3ihp s ILE 61 CO 0.81 -0.18 0.44 -1.10 0.00 0.00 0.00 174.94 174.90 3ihp s GLN 62 N 2.64 2.59 0.20 2.79 -0.21 -1.26 -4.69 119.66 121.72 3ihp s GLN 62 Ca 0.25 -1.48 -0.31 0.00 0.02 0.00 0.00 55.36 53.84 3ihp s GLN 62 Cb -0.15 -2.47 -0.16 0.00 1.00 0.00 0.00 33.01 31.24 3ihp s GLN 62 CO 0.12 -0.25 1.00 0.36 -2.12 0.00 0.00 175.29 174.41 3ihp n LYS 63 N -1.65 0.94 -1.11 2.91 2.85 -1.26 -2.16 118.16 118.68 3ihp n LYS 63 Ca 0.05 0.33 -0.04 0.00 -1.05 0.00 0.00 58.31 57.60 3ihp n LYS 63 Cb 0.61 -1.71 -0.02 0.00 -0.65 0.00 0.00 35.03 33.27 3ihp n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3ihp n GLU 64 N 1.33 -0.64 -2.87 -1.58 1.02 0.25 -4.99 120.64 113.16 3ihp n GLU 64 Ca 0.14 0.46 -0.33 0.00 -0.02 0.00 0.00 57.16 57.42 3ihp n GLU 64 Cb 0.26 -4.14 -0.06 0.00 -0.02 0.00 0.00 31.44 27.47 3ihp n GLU 64 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3ihp s SER 65 N -2.44 6.84 -0.19 1.62 1.04 -0.92 -4.72 113.70 114.93 3ihp s SER 65 Ca 0.00 1.54 -0.08 0.00 0.48 0.00 0.00 55.95 57.89 3ihp s SER 65 Cb 0.00 -2.48 -0.04 0.00 0.10 0.00 0.00 66.02 63.60 3ihp s SER 65 CO 0.00 -0.34 0.09 -0.89 0.98 0.00 0.00 173.24 173.07 3ihp s THR 66 N -2.18 4.95 0.10 2.02 2.01 -1.26 -1.18 115.64 120.10 3ihp s THR 66 Ca 0.59 0.03 0.03 0.00 0.31 0.00 0.00 61.69 62.65 3ihp s THR 66 Cb -0.09 -3.25 -0.04 0.00 0.01 0.00 0.00 72.50 69.13 3ihp s THR 66 CO 0.17 0.44 0.13 -0.76 -0.69 0.00 0.00 174.62 173.91 3ihp s LEU 67 N 0.49 3.94 -0.06 4.42 1.43 -0.11 -4.72 118.68 124.08 3ihp s LEU 67 Ca 0.05 0.03 0.03 0.00 -1.03 0.00 0.00 54.13 53.21 3ihp s LEU 67 Cb -0.12 -2.59 -0.02 0.00 0.03 0.00 0.00 46.19 43.49 3ihp s LEU 67 CO 0.00 0.14 -0.15 -1.00 0.23 0.00 0.00 176.35 175.57 3ihp s HIS 68 N -1.52 2.68 -0.00 0.29 3.76 -0.08 -1.05 115.29 119.37 3ihp s HIS 68 Ca 0.31 -0.26 -0.15 0.00 -0.15 0.00 0.00 55.06 54.81 3ihp s HIS 68 Cb -0.12 -1.65 -0.06 0.00 1.11 0.00 0.00 32.58 31.87 3ihp s HIS 68 CO 0.24 0.11 0.43 -1.17 -0.85 0.00 0.00 174.74 173.49 3ihp s LEU 69 N -0.56 4.47 0.08 0.89 2.96 -0.91 -0.24 118.68 125.37 3ihp s LEU 69 Ca 0.08 0.98 -0.00 0.00 -0.22 0.00 0.00 54.13 54.96 3ihp s LEU 69 Cb -0.11 -2.62 -0.04 0.00 0.50 0.00 0.00 46.19 43.92 3ihp s LEU 69 CO 0.01 0.30 -0.02 0.68 -1.32 0.00 0.00 176.35 176.00 3ihp s VAL 70 N -0.95 0.33 0.31 1.68 -7.23 -0.54 -4.71 120.40 109.30 3ihp s VAL 70 Ca 0.24 -1.87 0.10 0.00 -1.81 0.00 0.00 61.98 58.64 3ihp s VAL 70 Cb -0.17 -1.70 -0.06 0.00 0.56 0.00 0.00 36.38 35.01 3ihp s VAL 70 CO 0.14 -0.83 -0.13 -0.76 -0.31 0.00 0.00 175.10 173.20 3ihp s LEU 71 N -2.99 2.65 0.15 1.32 1.43 -1.26 -4.10 118.68 115.88 3ihp s LEU 71 Ca 0.13 -1.13 -0.14 0.00 -1.03 0.00 0.00 54.13 51.96 3ihp s LEU 71 Cb 0.07 -0.98 -0.07 0.00 0.03 0.00 0.00 46.19 45.24 3ihp s LEU 71 CO -0.06 -0.13 0.54 -0.13 0.23 0.00 0.00 176.35 176.80 3ihp s ARG 72 N -3.59 3.95 -0.83 1.70 0.52 -1.26 -5.01 118.95 114.43 3ihp s ARG 72 Ca 0.31 0.45 0.00 0.00 -0.52 0.00 0.00 55.73 55.97 3ihp s ARG 72 Cb -0.00 -2.91 0.20 0.00 0.52 0.00 0.00 34.95 32.76 3ihp s ARG 72 CO 0.15 0.47 0.69 -0.51 0.02 0.00 0.00 175.30 176.12 3ihp s LEU 73 N -2.02 5.32 0.28 2.53 1.43 -1.26 -5.09 118.68 119.87 3ihp s LEU 73 Ca 0.38 -3.76 -0.30 0.00 -1.03 0.00 0.00 54.13 49.42 3ihp s LEU 73 Cb -0.15 -1.82 -0.13 0.00 0.03 0.00 0.00 46.19 44.12 3ihp s LEU 73 CO 0.19 -0.15 1.36 0.54 0.23 0.00 0.00 176.35 178.52 3ihp n ARG 74 N 2.22 2.08 0.00 1.70 1.74 -1.26 -5.38 116.66 117.77 3ihp n ARG 74 Ca 0.21 0.74 0.00 0.00 -0.77 0.00 0.00 57.85 58.02 3ihp n ARG 74 Cb 0.36 -2.36 0.00 0.00 -1.02 0.00 0.00 32.46 29.44 3ihp n ARG 74 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52