#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hc5 s ASN 2 N 0.00 1.10 0.03 1.96 3.84 -1.26 -5.02 114.94 115.59 2hc5 s ASN 2 Ca 0.00 -0.17 0.24 0.00 0.21 0.00 0.00 52.86 53.14 2hc5 s ASN 2 Cb 0.00 -0.39 0.27 0.00 -0.55 0.00 0.00 41.25 40.58 2hc5 s ASN 2 CO 0.00 0.02 1.23 0.00 -2.79 0.00 0.00 177.10 175.56 2hc5 n ILE 3 N 3.58 0.10 1.39 -5.21 3.06 -1.26 -3.78 119.36 117.23 2hc5 n ILE 3 Ca -0.21 -0.11 0.14 0.00 -2.50 0.00 0.00 62.75 60.07 2hc5 n ILE 3 Cb 0.53 0.27 0.72 0.00 0.54 0.00 0.00 39.64 41.70 2hc5 n ILE 3 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 2hc5 n GLU 4 N -1.71 0.49 -0.11 9.51 1.02 -1.24 -1.97 120.64 126.62 2hc5 n GLU 4 Ca 0.04 0.02 0.04 0.00 -0.02 0.00 0.00 57.16 57.24 2hc5 n GLU 4 Cb 0.38 -1.50 0.10 0.00 -0.02 0.00 0.00 31.44 30.39 2hc5 n GLU 4 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 2hc5 n ARG 5 N -1.23 2.88 -2.49 3.49 1.85 -1.25 -4.57 116.66 115.34 2hc5 n ARG 5 Ca 0.15 -1.88 -0.41 0.00 -1.00 0.00 0.00 57.85 54.71 2hc5 n ARG 5 Cb 0.19 -1.19 -0.03 0.00 -1.05 0.00 0.00 32.46 30.38 2hc5 n ARG 5 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 2hc5 s LEU 6 N -1.14 3.21 -0.17 2.89 2.96 -0.83 -4.82 118.68 120.78 2hc5 s LEU 6 Ca 0.15 -0.46 -0.04 0.00 -0.22 0.00 0.00 54.13 53.57 2hc5 s LEU 6 Cb 0.09 -2.56 -0.23 0.00 0.50 0.00 0.00 46.19 43.99 2hc5 s LEU 6 CO 0.09 -1.88 0.15 0.35 -1.32 0.00 0.00 176.35 173.74 2hc5 n THR 7 N 6.54 1.68 -4.15 3.68 -2.24 -1.26 -0.10 114.28 118.44 2hc5 n THR 7 Ca 0.08 -0.63 -0.10 0.00 -2.27 0.00 0.00 64.05 61.14 2hc5 n THR 7 Cb 0.50 -1.62 -0.10 0.00 -2.10 0.00 0.00 70.33 67.01 2hc5 n THR 7 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2hc5 s THR 8 N -2.54 0.10 -0.34 4.28 -1.32 -1.26 -3.71 115.64 110.84 2hc5 s THR 8 Ca -0.27 -1.91 0.07 0.00 -1.21 0.00 0.00 61.69 58.38 2hc5 s THR 8 Cb 0.07 -2.05 0.57 0.00 -1.51 0.00 0.00 72.50 69.58 2hc5 s THR 8 CO 0.71 -0.45 1.62 0.18 -2.21 0.00 0.00 174.62 174.47 2hc5 n LEU 9 N -0.10 5.03 -0.14 9.08 7.99 -1.26 -4.77 117.00 132.83 2hc5 n LEU 9 Ca -0.05 -3.69 -0.04 0.00 -0.01 0.00 0.00 56.01 52.21 2hc5 n LEU 9 Cb 0.64 -0.70 0.03 0.00 -0.11 0.00 0.00 43.42 43.27 2hc5 n LEU 9 CO 0.31 1.17 0.75 -0.61 -1.51 0.00 0.00 177.39 177.50 2hc5 h GLN 10 N 1.08 -0.04 -0.12 3.23 5.75 -1.99 0.15 115.11 123.17 2hc5 h GLN 10 Ca 0.35 0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.89 2hc5 h GLN 10 Cb 2.07 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 30.63 2hc5 h GLN 10 CO 0.63 -0.03 0.13 -1.35 -2.65 0.00 0.00 178.83 175.56 2hc5 h PRO 11 N -0.04 0.00 0.14 -2.39 0.11 -2.00 -0.96 132.00 126.86 2hc5 h PRO 11 Ca 0.22 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 66.07 2hc5 h PRO 11 Cb 0.38 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.52 2hc5 h PRO 11 CO -0.50 0.00 -1.12 0.28 -0.21 0.00 0.00 178.00 176.45 2hc5 h VAL 12 N 0.00 1.35 -0.60 3.15 2.07 -1.14 -3.01 116.25 118.08 2hc5 h VAL 12 Ca 0.06 -2.48 -0.00 0.00 0.82 0.00 0.00 66.70 65.09 2hc5 h VAL 12 Cb 0.31 2.88 -0.03 0.00 -1.52 0.00 0.00 31.29 32.93 2hc5 h VAL 12 CO -0.00 0.74 0.36 -0.50 0.02 0.00 0.00 177.57 178.18 2hc5 h TRP 13 N 0.05 0.78 -0.06 1.57 -0.00 0.10 0.19 115.95 118.58 2hc5 h TRP 13 Ca -0.18 0.00 0.02 0.00 -0.00 0.00 0.00 58.89 58.74 2hc5 h TRP 13 Cb 1.84 -0.26 -0.03 0.00 -0.00 0.00 0.00 29.16 30.71 2hc5 h TRP 13 CO 0.14 0.52 -0.08 -0.44 -0.00 0.00 0.00 178.44 178.58 2hc5 h ASP 14 N 0.82 -0.25 0.81 -3.49 3.32 -1.25 -2.53 116.42 113.84 2hc5 h ASP 14 Ca 0.21 0.05 -0.08 0.00 0.02 0.00 0.00 57.03 57.23 2hc5 h ASP 14 Cb -0.03 0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2hc5 h ASP 14 CO -0.04 -0.12 -0.38 0.03 -1.72 0.00 0.00 179.24 177.01 2hc5 h ARG 15 N -0.12 0.00 0.17 3.56 3.08 -1.18 -2.09 114.38 117.80 2hc5 h ARG 15 Ca 0.05 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2hc5 h ARG 15 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.24 2hc5 h ARG 15 CO -0.13 0.38 -0.08 -0.92 -1.07 0.00 0.00 179.97 178.15 2hc5 h TYR 16 N 0.00 -0.21 -0.71 3.04 3.20 -0.36 0.39 116.97 122.32 2hc5 h TYR 16 Ca -0.00 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.80 2hc5 h TYR 16 Cb 0.88 0.07 -0.03 0.00 1.54 0.00 0.00 36.73 39.19 2hc5 h TYR 16 CO 0.00 -0.00 0.21 0.22 -1.64 0.00 0.00 178.16 176.95 2hc5 h ASP 17 N -0.39 1.04 -0.80 -2.11 3.58 -1.42 -1.04 116.42 115.28 2hc5 h ASP 17 Ca -0.02 -0.20 -0.03 0.00 0.42 0.00 0.00 57.03 57.20 2hc5 h ASP 17 Cb 0.30 -0.27 -0.04 0.00 1.72 0.00 0.00 39.33 41.05 2hc5 h ASP 17 CO 0.04 0.97 0.38 0.74 -2.88 0.00 0.00 179.24 178.49 2hc5 h THR 18 N 1.06 1.25 -0.02 2.25 2.02 -1.12 0.26 112.91 118.62 2hc5 h THR 18 Ca 0.23 -0.70 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 2hc5 h THR 18 Cb 0.31 0.24 -0.00 0.00 -1.74 0.00 0.00 68.15 66.96 2hc5 h THR 18 CO -0.01 0.30 0.00 1.56 0.37 0.00 0.00 175.52 177.75 2hc5 h GLN 19 N 1.13 0.03 -0.28 6.66 1.08 0.00 -1.68 115.11 122.05 2hc5 h GLN 19 Ca 0.27 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.47 2hc5 h GLN 19 Cb 0.12 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.53 2hc5 h GLN 19 CO -0.03 0.29 0.18 0.82 -0.95 0.00 0.00 178.83 179.14 2hc5 h ILE 20 N -0.24 1.08 0.00 2.54 2.04 -0.82 -2.98 117.51 119.14 2hc5 h ILE 20 Ca 0.00 -0.17 -0.07 0.00 1.00 0.00 0.00 64.86 65.63 2hc5 h ILE 20 Cb 0.28 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 2hc5 h ILE 20 CO 0.00 0.08 -0.39 1.12 0.00 0.00 0.00 178.15 178.96 2hc5 h HIS 21 N 0.37 0.00 -2.97 1.37 2.07 -0.55 -3.35 115.15 112.09 2hc5 h HIS 21 Ca 0.10 0.00 -0.66 0.00 -2.85 0.00 0.00 60.37 56.97 2hc5 h HIS 21 Cb -0.02 0.00 -0.39 0.00 2.57 0.00 0.00 27.41 29.57 2hc5 h HIS 21 CO -0.05 0.30 -0.33 0.09 -3.07 0.00 0.00 177.93 174.88 2hc5 n ASN 22 N -3.14 3.80 -4.52 3.10 5.03 -0.63 -5.02 115.26 113.88 2hc5 n ASN 22 Ca 0.02 -3.25 -0.42 0.00 0.87 0.00 0.00 54.58 51.80 2hc5 n ASN 22 Cb 0.66 -0.87 -0.02 0.00 -1.02 0.00 0.00 39.78 38.52 2hc5 n ASN 22 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 2hc5 s GLN 23 N -1.73 3.66 0.00 3.52 2.00 -1.20 -4.67 119.66 121.23 2hc5 s GLN 23 Ca 0.29 -1.51 0.19 0.00 -2.00 0.00 0.00 55.36 52.33 2hc5 s GLN 23 Cb -0.01 -5.20 0.92 0.00 0.80 0.00 0.00 33.01 29.52 2hc5 s GLN 23 CO -0.11 -2.03 1.62 1.63 -0.50 0.00 0.00 175.29 175.90 2hc5 n LYS 24 N 7.83 1.36 -2.45 1.67 4.76 -1.26 -4.97 118.16 125.10 2hc5 n LYS 24 Ca 0.32 -0.55 -0.01 0.00 -2.87 0.00 0.00 58.31 55.20 2hc5 n LYS 24 Cb 0.49 -1.34 -0.01 0.00 -1.84 0.00 0.00 35.03 32.34 2hc5 n LYS 24 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2hc5 n ASP 25 N -0.23 -5.88 -4.52 4.39 2.03 -1.26 -4.98 116.55 106.09 2hc5 n ASP 25 Ca 0.15 1.13 -0.41 0.00 0.52 0.00 0.00 54.79 56.18 2hc5 n ASP 25 Cb 0.20 -4.43 -0.10 0.00 -0.72 0.00 0.00 41.12 36.06 2hc5 n ASP 25 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2hc5 s ASN 26 N -1.18 6.07 -0.12 1.67 2.47 -1.26 -5.05 114.94 117.54 2hc5 s ASN 26 Ca -0.03 -0.45 -0.13 0.00 0.42 0.00 0.00 52.86 52.66 2hc5 s ASN 26 Cb 0.00 -2.14 0.03 0.00 -1.45 0.00 0.00 41.25 37.69 2hc5 s ASN 26 CO 0.62 -0.26 0.36 -0.62 -3.72 0.00 0.00 177.10 173.48 2hc5 s ASP 27 N 1.72 -0.36 -0.17 -4.21 2.15 -1.26 -5.04 116.67 109.50 2hc5 s ASP 27 Ca 0.06 0.66 0.17 0.00 0.43 0.00 0.00 52.55 53.87 2hc5 s ASP 27 Cb -0.17 0.69 0.45 0.00 -0.30 0.00 0.00 42.92 43.58 2hc5 s ASP 27 CO 0.11 -0.16 1.18 0.59 -0.17 0.00 0.00 175.17 176.71 2hc5 n ASN 28 N 2.70 2.06 -2.55 -0.34 3.02 -1.26 -4.94 115.26 113.95 2hc5 n ASN 28 Ca -0.14 -2.93 -0.16 0.00 -0.03 0.00 0.00 54.58 51.32 2hc5 n ASN 28 Cb 0.57 -0.41 0.05 0.00 -0.61 0.00 0.00 39.78 39.38 2hc5 n ASN 28 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2hc5 n GLU 29 N -0.44 -5.20 -3.68 3.52 1.02 -1.26 -5.01 120.64 109.58 2hc5 n GLU 29 Ca 0.17 0.57 -0.37 0.00 -0.02 0.00 0.00 57.16 57.52 2hc5 n GLU 29 Cb 0.91 -4.82 -0.06 0.00 -0.02 0.00 0.00 31.44 27.44 2hc5 n GLU 29 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2hc5 s VAL 30 N -3.19 5.30 -0.09 2.62 1.01 -1.26 -4.97 120.40 119.82 2hc5 s VAL 30 Ca 0.38 0.49 -0.04 0.00 0.00 0.00 0.00 61.98 62.80 2hc5 s VAL 30 Cb -0.17 -3.55 -0.16 0.00 0.00 0.00 0.00 36.38 32.50 2hc5 s VAL 30 CO 0.47 0.56 2.42 -2.65 0.00 0.00 0.00 175.10 175.89 2hc5 n PRO 31 N 2.27 1.33 -3.51 2.72 -0.02 -1.26 -4.65 135.00 131.88 2hc5 n PRO 31 Ca -0.16 -0.70 -0.08 0.00 -2.02 0.00 0.00 63.50 60.54 2hc5 n PRO 31 Cb 0.53 -1.87 -0.08 0.00 -0.02 0.00 0.00 33.50 32.06 2hc5 n PRO 31 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2hc5 s VAL 32 N 1.89 -0.67 0.00 -1.45 0.11 -1.26 -4.87 120.40 114.15 2hc5 s VAL 32 Ca 0.42 0.07 0.00 0.00 -2.93 0.00 0.00 61.98 59.53 2hc5 s VAL 32 Cb 0.19 -0.75 0.00 0.00 -1.53 0.00 0.00 36.38 34.29 2hc5 s VAL 32 CO -0.00 -0.01 0.00 0.00 -3.33 0.00 0.00 175.10 171.76 2hc5 n HIS 33 N 5.39 0.00 -0.01 1.54 1.44 -1.26 -4.88 115.22 117.44 2hc5 n HIS 33 Ca -0.06 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.67 2hc5 n HIS 33 Cb 0.50 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.55 2hc5 n HIS 33 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 2hc5 n GLN 34 N -0.50 0.79 -0.68 -1.40 6.02 -1.26 -4.68 117.38 115.65 2hc5 n GLN 34 Ca 0.00 -0.06 0.00 0.00 -0.01 0.00 0.00 57.00 56.93 2hc5 n GLN 34 Cb 0.00 -1.19 0.00 0.00 1.02 0.00 0.00 30.24 30.07 2hc5 n GLN 34 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2hc5 n VAL 35 N -1.88 -2.41 -4.07 5.09 0.31 -1.26 -4.61 118.33 109.50 2hc5 n VAL 35 Ca -0.04 0.93 -0.24 0.00 -0.01 0.00 0.00 64.34 64.98 2hc5 n VAL 35 Cb 0.32 -1.32 -0.07 0.00 -0.91 0.00 0.00 33.84 31.86 2hc5 n VAL 35 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2hc5 s SER 36 N -3.01 4.54 0.12 4.52 0.15 -1.26 -5.02 113.70 113.73 2hc5 s SER 36 Ca 0.00 -0.96 -0.21 0.00 0.70 0.00 0.00 55.95 55.48 2hc5 s SER 36 Cb 0.00 -0.55 -0.06 0.00 -1.71 0.00 0.00 66.02 63.70 2hc5 s SER 36 CO 0.00 -0.47 1.72 0.22 1.20 0.00 0.00 173.24 175.91 2hc5 h TYR 37 N 1.44 -0.05 -0.68 3.44 3.20 -1.99 -2.14 116.97 120.19 2hc5 h TYR 37 Ca -0.43 0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.51 2hc5 h TYR 37 Cb 1.25 0.04 -0.05 0.00 1.54 0.00 0.00 36.73 39.51 2hc5 h TYR 37 CO 0.62 -0.05 0.38 1.15 -1.64 0.00 0.00 178.16 178.63 2hc5 h THR 38 N 0.02 0.98 -0.08 1.81 2.02 -1.98 -0.04 112.91 115.64 2hc5 h THR 38 Ca 0.07 -0.24 0.01 0.00 0.77 0.00 0.00 66.41 67.02 2hc5 h THR 38 Cb 0.10 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.71 2hc5 h THR 38 CO -0.14 0.13 0.01 -1.13 0.37 0.00 0.00 175.52 174.76 2hc5 h ASN 39 N 0.70 0.00 -0.39 4.18 -0.00 -1.87 0.62 115.58 118.83 2hc5 h ASN 39 Ca 0.30 0.01 -0.04 0.00 -0.00 0.00 0.00 56.30 56.58 2hc5 h ASN 39 Cb 0.18 0.02 -0.02 0.00 -0.00 0.00 0.00 38.32 38.50 2hc5 h ASN 39 CO -0.18 0.01 0.10 -0.07 -0.00 0.00 0.00 177.43 177.29 2hc5 h LEU 40 N 0.05 0.60 -0.96 0.34 3.38 -1.05 -0.54 115.31 117.12 2hc5 h LEU 40 Ca 0.04 -0.23 0.07 0.00 0.09 0.00 0.00 57.88 57.85 2hc5 h LEU 40 Cb 0.03 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.56 2hc5 h LEU 40 CO -0.05 0.67 0.61 0.00 0.09 0.00 0.00 178.44 179.76 2hc5 h ALA 41 N 0.95 1.34 0.04 1.53 0.00 -0.70 0.34 119.26 122.75 2hc5 h ALA 41 Ca 0.12 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2hc5 h ALA 41 Cb 0.31 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2hc5 h ALA 41 CO 0.00 0.37 -0.02 0.93 0.00 0.00 0.00 179.25 180.53 2hc5 h GLU 42 N 1.09 -0.05 0.00 0.00 4.39 -0.61 -1.23 114.58 118.17 2hc5 h GLU 42 Ca 0.42 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 60.03 2hc5 h GLU 42 Cb 0.20 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 2hc5 h GLU 42 CO -0.18 0.31 -0.45 0.52 -1.16 0.00 0.00 179.01 178.04 2hc5 h MET 43 N -0.42 0.00 -0.40 2.33 2.86 -0.68 -1.79 114.93 116.83 2hc5 h MET 43 Ca -0.01 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.49 2hc5 h MET 43 Cb 0.38 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 2hc5 h MET 43 CO 0.01 0.45 -0.32 0.28 1.06 0.00 0.00 176.91 178.39 2hc5 h VAL 44 N 0.00 1.27 -0.38 -2.22 2.07 -0.34 -2.65 116.25 114.01 2hc5 h VAL 44 Ca -0.00 -1.48 0.00 0.00 0.82 0.00 0.00 66.70 66.04 2hc5 h VAL 44 Cb 0.80 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 2hc5 h VAL 44 CO 0.06 0.50 0.25 1.23 0.02 0.00 0.00 177.57 179.63 2hc5 h GLY 45 N 0.87 0.54 1.31 2.17 0.00 -0.42 -2.38 103.07 105.15 2hc5 h GLY 45 Ca 0.08 -0.21 -0.12 0.00 0.00 0.00 0.00 47.33 47.08 2hc5 h GLY 45 CO 0.08 0.20 -0.24 1.05 0.00 0.00 0.00 176.54 177.63 2hc5 h GLU 46 N 0.52 0.79 -0.89 4.80 4.11 -1.37 -3.01 114.58 119.52 2hc5 h GLU 46 Ca 0.14 -0.33 -0.01 0.00 0.07 0.00 0.00 59.36 59.23 2hc5 h GLU 46 Cb -0.05 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.13 2hc5 h GLU 46 CO -0.03 0.95 0.52 0.52 0.07 0.00 0.00 179.01 181.05 2hc5 h MET 47 N 0.69 1.21 0.00 1.06 2.86 -1.24 0.26 114.93 119.78 2hc5 h MET 47 Ca 0.09 -0.12 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 2hc5 h MET 47 Cb 0.76 -0.25 -0.00 0.00 0.06 0.00 0.00 31.60 32.17 2hc5 h MET 47 CO 0.06 0.86 -0.05 -0.91 1.06 0.00 0.00 176.91 177.93 2hc5 h ASN 48 N 1.23 0.00 -0.23 1.22 2.35 -1.30 -2.06 115.58 116.78 2hc5 h ASN 48 Ca 0.32 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.07 2hc5 h ASN 48 Cb -0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.34 2hc5 h ASN 48 CO -0.06 0.05 0.00 0.29 -1.65 0.00 0.00 177.43 176.07 2hc5 n LYS 49 N -3.47 1.98 -0.05 0.81 5.02 -0.07 -4.29 118.16 118.08 2hc5 n LYS 49 Ca -0.02 -1.87 -0.05 0.00 -2.02 0.00 0.00 58.31 54.34 2hc5 n LYS 49 Cb 0.18 -1.37 -0.14 0.00 -0.02 0.00 0.00 35.03 33.67 2hc5 n LYS 49 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2hc5 n LEU 50 N 1.03 0.37 -0.95 -0.35 4.77 -0.31 -4.45 117.00 117.11 2hc5 n LEU 50 Ca 0.13 0.17 0.01 0.00 -0.03 0.00 0.00 56.01 56.29 2hc5 n LEU 50 Cb 0.47 0.29 0.21 0.00 -2.33 0.00 0.00 43.42 42.06 2hc5 n LEU 50 CO 0.11 0.35 0.66 0.18 -1.33 0.00 0.00 177.39 177.37 2hc5 n LEU 51 N -2.79 3.79 0.17 2.23 4.32 -1.19 -4.76 117.00 118.77 2hc5 n LEU 51 Ca -0.22 -3.53 -0.14 0.00 -0.02 0.00 0.00 56.01 52.10 2hc5 n LEU 51 Cb 1.01 -0.59 -0.07 0.00 -1.62 0.00 0.00 43.42 42.15 2hc5 n LEU 51 CO 0.44 1.07 0.74 -0.33 -1.22 0.00 0.00 177.39 178.09 2hc5 h GLU 52 N 1.10 -0.43 -0.58 3.23 5.08 -1.78 -2.68 114.58 118.53 2hc5 h GLU 52 Ca 0.13 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2hc5 h GLU 52 Cb 1.49 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.84 2hc5 h GLU 52 CO 0.28 -0.28 0.00 -0.35 -1.00 0.00 0.00 179.01 177.66 2hc5 n PRO 53 N -5.31 1.75 -2.73 2.33 -0.04 -1.26 -4.88 135.00 124.86 2hc5 n PRO 53 Ca -0.09 -0.76 -0.23 0.00 -0.04 0.00 0.00 63.50 62.38 2hc5 n PRO 53 Cb 0.22 -1.45 0.03 0.00 -0.04 0.00 0.00 33.50 32.26 2hc5 n PRO 53 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2hc5 s SER 54 N -0.56 5.54 0.00 3.54 0.01 -1.01 -3.73 113.70 117.49 2hc5 s SER 54 Ca 0.13 0.26 0.22 0.00 1.31 0.00 0.00 55.95 57.87 2hc5 s SER 54 Cb 0.09 -1.30 0.52 0.00 0.21 0.00 0.00 66.02 65.53 2hc5 s SER 54 CO 0.06 -0.97 1.44 0.00 0.41 0.00 0.00 173.24 174.19 2hc5 n GLN 55 N -2.30 2.35 -0.01 12.44 6.02 0.86 -4.43 117.38 132.32 2hc5 n GLN 55 Ca 0.04 -2.05 -0.13 0.00 -0.01 0.00 0.00 57.00 54.85 2hc5 n GLN 55 Cb 0.59 -1.48 -0.10 0.00 1.02 0.00 0.00 30.24 30.26 2hc5 n GLN 55 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2hc5 h VAL 56 N 3.85 1.34 -4.73 5.09 2.07 -1.61 -3.45 116.25 118.82 2hc5 h VAL 56 Ca 0.00 -1.43 -0.02 0.00 0.82 0.00 0.00 66.70 66.07 2hc5 h VAL 56 Cb 0.86 2.26 0.01 0.00 -1.52 0.00 0.00 31.29 32.90 2hc5 h VAL 56 CO 0.00 0.35 -0.06 1.41 0.02 0.00 0.00 177.57 179.29 2hc5 n HIS 57 N -4.81 -2.13 -3.44 1.57 8.25 -1.26 -4.44 115.22 108.95 2hc5 n HIS 57 Ca -0.09 0.81 -0.38 0.00 -0.26 0.00 0.00 57.72 57.80 2hc5 n HIS 57 Cb 0.31 -3.43 -0.08 0.00 1.12 0.00 0.00 29.99 27.90 2hc5 n HIS 57 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2hc5 s LEU 58 N -3.58 4.12 -0.40 2.41 1.43 -1.26 -0.56 118.68 120.83 2hc5 s LEU 58 Ca 0.03 0.38 -0.09 0.00 -1.03 0.00 0.00 54.13 53.43 2hc5 s LEU 58 Cb -0.00 -2.42 0.07 0.00 0.03 0.00 0.00 46.19 43.87 2hc5 s LEU 58 CO 0.54 -0.08 0.23 -0.54 0.23 0.00 0.00 176.35 176.74 2hc5 s LYS 59 N 1.45 2.64 -0.19 1.70 1.02 0.23 -4.92 119.74 121.67 2hc5 s LYS 59 Ca 0.16 -1.37 -0.14 0.00 0.02 0.00 0.00 55.97 54.64 2hc5 s LYS 59 Cb -0.15 -3.73 -0.04 0.00 -0.52 0.00 0.00 37.83 33.38 2hc5 s LYS 59 CO 0.08 -0.88 0.33 -0.06 -0.92 0.00 0.00 175.35 173.89 2hc5 s PHE 60 N 1.44 3.41 -0.06 3.18 0.08 -1.25 -1.17 117.98 123.60 2hc5 s PHE 60 Ca 0.02 0.56 0.05 0.00 0.12 0.00 0.00 56.93 57.69 2hc5 s PHE 60 Cb -0.22 -2.42 -0.01 0.00 -0.57 0.00 0.00 43.02 39.80 2hc5 s PHE 60 CO 0.03 0.11 -0.23 -1.21 -0.10 0.00 0.00 175.22 173.81 2hc5 s GLU 61 N 0.91 2.61 -0.45 0.44 2.02 -0.51 -4.94 118.70 118.77 2hc5 s GLU 61 Ca 0.17 -0.87 -0.12 0.00 0.02 0.00 0.00 54.97 54.16 2hc5 s GLU 61 Cb -0.14 -2.22 0.08 0.00 0.10 0.00 0.00 34.13 31.96 2hc5 s GLU 61 CO 0.06 0.39 0.33 -1.17 0.02 0.00 0.00 175.26 174.89 2hc5 s LEU 62 N -0.18 5.42 -0.07 1.80 2.96 -1.26 -0.06 118.68 127.29 2hc5 s LEU 62 Ca -0.03 -1.45 0.02 0.00 -0.22 0.00 0.00 54.13 52.46 2hc5 s LEU 62 Cb -0.14 -2.08 -0.02 0.00 0.50 0.00 0.00 46.19 44.45 2hc5 s LEU 62 CO 0.04 -0.60 -0.13 -1.00 -1.32 0.00 0.00 176.35 173.33 2hc5 s HIS 63 N 1.53 2.75 0.20 5.38 3.76 -0.94 -4.95 115.29 123.00 2hc5 s HIS 63 Ca 0.04 -0.25 0.06 0.00 -0.15 0.00 0.00 55.06 54.75 2hc5 s HIS 63 Cb -0.24 -1.69 -0.04 0.00 1.11 0.00 0.00 32.58 31.73 2hc5 s HIS 63 CO 0.04 0.11 0.12 0.16 -0.85 0.00 0.00 174.74 174.32 2hc5 s ASP 64 N -0.48 5.32 -0.18 1.40 -4.77 -1.26 -1.44 116.67 115.26 2hc5 s ASP 64 Ca 0.06 -0.25 -0.05 0.00 -3.30 0.00 0.00 52.55 49.01 2hc5 s ASP 64 Cb -0.12 -1.31 0.09 0.00 -1.09 0.00 0.00 42.92 40.49 2hc5 s ASP 64 CO 0.02 0.04 0.35 -1.59 0.70 0.00 0.00 175.17 174.68 2hc5 s LYS 65 N -3.33 0.25 0.00 2.11 -2.85 0.13 -4.97 119.74 111.08 2hc5 s LYS 65 Ca 0.31 0.83 0.00 0.00 -1.00 0.00 0.00 55.97 56.11 2hc5 s LYS 65 Cb -0.09 0.02 0.00 0.00 -2.06 0.00 0.00 37.83 35.70 2hc5 s LYS 65 CO 0.23 -0.33 0.00 -0.11 0.10 0.00 0.00 175.35 175.24 2hc5 n LEU 66 N 5.37 0.00 0.00 2.77 0.00 -1.26 -1.29 117.00 122.59 2hc5 n LEU 66 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.94 2hc5 n LEU 66 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.92 2hc5 n LEU 66 CO 0.02 0.00 -0.31 -3.20 0.00 0.00 0.00 177.39 173.90 2hc5 n ASN 67 N 1.77 3.06 -4.56 1.96 5.15 -1.26 -5.09 115.26 116.28 2hc5 n ASN 67 Ca 0.00 0.00 -0.25 0.00 -0.60 0.00 0.00 54.58 53.73 2hc5 n ASN 67 Cb 0.00 0.44 -0.09 0.00 -0.53 0.00 0.00 39.78 39.60 2hc5 n ASN 67 CO 0.00 0.00 0.00 -1.83 1.40 0.00 0.00 177.26 176.83 2hc5 s GLU 68 N -1.45 2.01 0.02 1.20 1.03 -0.41 -5.12 118.70 115.98 2hc5 s GLU 68 Ca 0.00 -1.40 0.04 0.00 0.03 0.00 0.00 54.97 53.65 2hc5 s GLU 68 Cb 0.00 -2.07 -0.02 0.00 -0.80 0.00 0.00 34.13 31.24 2hc5 s GLU 68 CO 0.00 0.40 -0.14 1.52 -1.33 0.00 0.00 175.26 175.71 2hc5 s TYR 69 N -1.96 1.21 0.08 4.83 -0.85 -1.26 0.22 117.35 119.62 2hc5 s TYR 69 Ca 0.27 -0.29 0.01 0.00 -0.52 0.00 0.00 57.07 56.54 2hc5 s TYR 69 Cb -0.08 -0.75 -0.04 0.00 0.38 0.00 0.00 41.96 41.48 2hc5 s TYR 69 CO 0.16 0.01 -0.06 1.52 -1.52 0.00 0.00 175.55 175.66 2hc5 s TYR 70 N -0.60 0.79 -0.28 -3.49 -0.85 -0.52 -3.90 117.35 108.49 2hc5 s TYR 70 Ca 0.03 -0.87 -0.10 0.00 -0.52 0.00 0.00 57.07 55.61 2hc5 s TYR 70 Cb -0.07 -0.47 -0.03 0.00 0.38 0.00 0.00 41.96 41.77 2hc5 s TYR 70 CO 0.00 -0.18 0.15 0.08 -1.52 0.00 0.00 175.55 174.09 2hc5 s VAL 71 N -3.31 4.90 -0.20 -3.49 1.01 -0.06 -2.22 120.40 117.03 2hc5 s VAL 71 Ca 0.07 -0.06 -0.20 0.00 0.00 0.00 0.00 61.98 61.79 2hc5 s VAL 71 Cb 0.03 -3.37 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 2hc5 s VAL 71 CO -0.05 0.22 0.62 -0.54 0.00 0.00 0.00 175.10 175.35 2hc5 s LYS 72 N 1.69 4.20 -0.36 2.72 1.02 0.91 -0.77 119.74 129.15 2hc5 s LYS 72 Ca 0.06 0.58 -0.13 0.00 0.02 0.00 0.00 55.97 56.51 2hc5 s LYS 72 Cb -0.16 -3.58 -0.00 0.00 -0.52 0.00 0.00 37.83 33.56 2hc5 s LYS 72 CO 0.08 -0.25 0.24 0.08 -0.92 0.00 0.00 175.35 174.58 2hc5 s VAL 73 N 1.94 5.12 -0.12 3.17 1.01 0.13 -1.43 120.40 130.22 2hc5 s VAL 73 Ca 0.28 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.86 2hc5 s VAL 73 Cb -0.16 -3.71 -0.00 0.00 0.00 0.00 0.00 36.38 32.51 2hc5 s VAL 73 CO 0.10 -0.10 -0.20 -0.63 0.00 0.00 0.00 175.10 174.27 2hc5 s ILE 74 N 1.68 2.39 -0.26 2.22 1.01 -0.32 -1.44 121.20 126.48 2hc5 s ILE 74 Ca 0.05 -0.89 -0.21 0.00 0.00 0.00 0.00 60.65 59.60 2hc5 s ILE 74 Cb -0.18 -1.96 -0.01 0.00 0.01 0.00 0.00 42.46 40.32 2hc5 s ILE 74 CO 0.09 0.54 0.68 -0.70 0.00 0.00 0.00 174.94 175.56 2hc5 s GLU 75 N 0.47 4.10 0.45 2.79 2.12 -1.05 0.76 118.70 128.34 2hc5 s GLU 75 Ca -0.14 0.60 0.21 0.00 0.36 0.00 0.00 54.97 56.01 2hc5 s GLU 75 Cb -0.17 -3.66 1.06 0.00 0.26 0.00 0.00 34.13 31.63 2hc5 s GLU 75 CO 0.06 -0.46 1.93 0.22 -0.54 0.00 0.00 175.26 176.46 2hc5 h ASP 76 N 7.89 0.00 -0.37 -1.70 3.58 -1.05 0.75 116.42 125.54 2hc5 h ASP 76 Ca -0.26 0.00 -0.10 0.00 0.42 0.00 0.00 57.03 57.10 2hc5 h ASP 76 Cb 1.11 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.15 2hc5 h ASP 76 CO 0.80 0.24 -0.11 0.28 -2.88 0.00 0.00 179.24 177.57 2hc5 h SER 77 N 0.00 0.80 0.00 2.28 0.02 -1.81 -3.22 113.55 111.62 2hc5 h SER 77 Ca -0.00 -0.24 -0.13 0.00 -0.84 0.00 0.00 61.79 60.58 2hc5 h SER 77 Cb 0.54 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.84 2hc5 h SER 77 CO 0.03 0.93 -1.98 0.35 -1.14 0.00 0.00 176.83 175.02 2hc5 n THR 78 N -4.16 0.47 -2.09 -2.27 -2.24 -1.06 -5.00 114.28 97.93 2hc5 n THR 78 Ca 0.01 -0.55 -0.14 0.00 -2.27 0.00 0.00 64.05 61.10 2hc5 n THR 78 Cb 0.37 -0.17 -0.02 0.00 -2.10 0.00 0.00 70.33 68.41 2hc5 n THR 78 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2hc5 n ASN 79 N -2.34 -4.47 -4.61 3.42 3.02 0.26 -5.02 115.26 105.52 2hc5 n ASN 79 Ca -0.13 0.07 -0.25 0.00 -0.03 0.00 0.00 54.58 54.24 2hc5 n ASN 79 Cb 0.71 -3.54 -0.08 0.00 -0.61 0.00 0.00 39.78 36.26 2hc5 n ASN 79 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 2hc5 s GLU 80 N -4.39 2.18 -0.75 3.52 -1.05 -1.23 -4.96 118.70 112.02 2hc5 s GLU 80 Ca 0.00 -1.36 -0.24 0.00 -0.15 0.00 0.00 54.97 53.22 2hc5 s GLU 80 Cb 0.00 -2.15 0.06 0.00 -0.44 0.00 0.00 34.13 31.60 2hc5 s GLU 80 CO 0.00 0.39 1.15 0.08 0.95 0.00 0.00 175.26 177.84 2hc5 s VAL 81 N -2.07 4.07 0.11 1.83 1.01 -1.26 -2.52 120.40 121.57 2hc5 s VAL 81 Ca 0.29 -0.19 -0.09 0.00 0.00 0.00 0.00 61.98 61.99 2hc5 s VAL 81 Cb -0.07 -4.82 -0.19 0.00 0.00 0.00 0.00 36.38 31.29 2hc5 s VAL 81 CO 0.18 -1.67 1.27 0.16 0.00 0.00 0.00 175.10 175.04 2hc5 h ILE 82 N 6.07 1.34 -3.80 2.22 3.07 -1.62 -3.46 117.51 121.33 2hc5 h ILE 82 Ca -0.20 -2.30 -0.20 0.00 1.55 0.00 0.00 64.86 63.71 2hc5 h ILE 82 Cb 1.05 2.33 -0.25 0.00 -0.27 0.00 0.00 36.82 39.69 2hc5 h ILE 82 CO 1.24 0.70 -0.69 -0.13 -1.05 0.00 0.00 178.15 178.22 2hc5 s ARG 83 N -3.36 0.16 -0.23 0.16 3.00 -1.02 -5.04 118.95 112.62 2hc5 s ARG 83 Ca -0.08 -0.26 -0.00 0.00 0.00 0.00 0.00 55.73 55.39 2hc5 s ARG 83 Cb 0.08 0.06 0.06 0.00 0.00 0.00 0.00 34.95 35.16 2hc5 s ARG 83 CO 0.89 -0.03 -0.02 -1.21 0.00 0.00 0.00 175.30 174.93 2hc5 s GLU 84 N -0.67 1.33 -0.29 3.54 2.02 -1.26 0.19 118.70 123.57 2hc5 s GLU 84 Ca -0.07 -0.86 -0.10 0.00 0.02 0.00 0.00 54.97 53.95 2hc5 s GLU 84 Cb -0.05 -2.46 -0.04 0.00 0.10 0.00 0.00 34.13 31.69 2hc5 s GLU 84 CO -0.00 -0.63 0.17 0.42 0.02 0.00 0.00 175.26 175.24 2hc5 s ILE 85 N 1.52 5.05 0.70 -1.63 1.09 0.05 -4.94 121.20 123.03 2hc5 s ILE 85 Ca -0.04 -0.02 -0.11 0.00 -1.10 0.00 0.00 60.65 59.38 2hc5 s ILE 85 Cb -0.18 -3.45 0.01 0.00 -1.06 0.00 0.00 42.46 37.78 2hc5 s ILE 85 CO -0.07 0.20 1.06 -2.16 -0.10 0.00 0.00 174.94 173.87 2hc5 s PRO 86 N 1.71 2.85 0.25 2.79 0.04 -1.26 -0.88 135.00 140.51 2hc5 s PRO 86 Ca 0.06 1.00 -0.03 0.00 0.04 0.00 0.00 61.00 62.08 2hc5 s PRO 86 Cb -0.16 -1.98 0.48 0.00 0.04 0.00 0.00 34.50 32.88 2hc5 s PRO 86 CO 0.09 -1.17 1.76 -1.00 0.04 0.00 0.00 177.00 176.73 2hc5 h PRO 87 N -0.71 0.59 0.00 0.56 0.13 -1.89 -0.39 132.00 130.29 2hc5 h PRO 87 Ca -0.44 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2hc5 h PRO 87 Cb 1.21 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2hc5 h PRO 87 CO 0.56 0.39 0.00 1.57 -0.23 0.00 0.00 178.00 180.29 2hc5 h LYS 88 N 0.61 0.00 -0.00 0.86 2.10 -1.83 -2.78 116.57 115.53 2hc5 h LYS 88 Ca 0.43 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.08 2hc5 h LYS 88 Cb 0.58 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.91 2hc5 h LYS 88 CO -0.34 0.00 -0.64 0.54 -2.00 0.00 0.00 179.45 177.00 2hc5 n ARG 89 N -2.71 0.38 0.22 0.07 5.12 -0.30 -3.93 116.66 115.51 2hc5 n ARG 89 Ca 0.04 -0.29 0.07 0.00 -1.93 0.00 0.00 57.85 55.74 2hc5 n ARG 89 Cb 0.44 -1.49 0.52 0.00 -1.16 0.00 0.00 32.46 30.77 2hc5 n ARG 89 CO 0.00 0.00 0.00 2.35 -1.93 0.00 0.00 177.63 178.05 2hc5 h TRP 90 N 0.70 0.00 -0.53 -1.55 2.91 -0.86 -2.62 115.95 114.00 2hc5 h TRP 90 Ca 0.00 0.00 -0.05 0.00 1.13 0.00 0.00 58.89 59.97 2hc5 h TRP 90 Cb 0.55 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.18 2hc5 h TRP 90 CO 0.00 0.23 0.15 -0.07 -1.03 0.00 0.00 178.44 177.72 2hc5 h LEU 91 N 0.00 0.79 -0.54 0.65 3.38 -1.70 0.51 115.31 118.41 2hc5 h LEU 91 Ca -0.00 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 2hc5 h LEU 91 Cb 0.47 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2hc5 h LEU 91 CO 0.03 0.81 0.28 0.44 0.09 0.00 0.00 178.44 180.08 2hc5 h ASP 92 N 0.74 0.69 -0.06 -0.43 3.32 -1.71 -2.70 116.42 116.27 2hc5 h ASP 92 Ca 0.17 -0.11 -0.05 0.00 0.02 0.00 0.00 57.03 57.06 2hc5 h ASP 92 Cb 0.31 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.68 2hc5 h ASP 92 CO -0.00 0.60 -0.17 0.15 -1.72 0.00 0.00 179.24 178.09 2hc5 h PHE 93 N 0.72 0.29 -0.87 4.55 3.57 -1.20 -3.01 116.94 121.00 2hc5 h PHE 93 Ca 0.19 -0.12 0.03 0.00 3.53 0.00 0.00 57.97 61.60 2hc5 h PHE 93 Cb 0.08 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 38.72 2hc5 h PHE 93 CO -0.01 0.79 0.56 -0.92 -2.23 0.00 0.00 178.31 176.50 2hc5 h TYR 94 N -0.28 1.06 -0.27 0.41 3.20 0.03 0.23 116.97 121.34 2hc5 h TYR 94 Ca -0.00 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.85 2hc5 h TYR 94 Cb 0.79 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 2hc5 h TYR 94 CO 0.12 0.62 0.02 0.00 -1.64 0.00 0.00 178.16 177.28 2hc5 h ALA 95 N 1.36 0.37 -0.52 1.82 0.00 -1.56 -1.70 119.26 119.03 2hc5 h ALA 95 Ca 0.34 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 2hc5 h ALA 95 Cb -0.01 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2hc5 h ALA 95 CO -0.11 0.08 -0.06 0.00 0.00 0.00 0.00 179.25 179.17 2hc5 h ALA 96 N 0.84 0.70 -0.37 0.00 0.00 -1.27 -3.10 119.26 116.07 2hc5 h ALA 96 Ca 0.08 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.51 2hc5 h ALA 96 Cb 0.39 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2hc5 h ALA 96 CO 0.01 0.57 -0.39 1.98 0.00 0.00 0.00 179.25 181.42 2hc5 h MET 97 N 0.82 0.89 -0.50 0.00 -1.53 -0.51 -3.08 114.93 111.01 2hc5 h MET 97 Ca 0.14 -0.46 -0.12 0.00 -3.44 0.00 0.00 59.70 55.82 2hc5 h MET 97 Cb 0.60 0.01 -0.02 0.00 -0.55 0.00 0.00 31.60 31.65 2hc5 h MET 97 CO 0.04 1.11 -0.16 1.79 0.14 0.00 0.00 176.91 179.83 2hc5 h THR 98 N 0.72 1.27 -0.43 -0.77 1.35 -1.30 0.45 112.91 114.20 2hc5 h THR 98 Ca 0.06 -1.31 -0.03 0.00 -0.55 0.00 0.00 66.41 64.58 2hc5 h THR 98 Cb 0.97 1.04 -0.02 0.00 -1.73 0.00 0.00 68.15 68.41 2hc5 h THR 98 CO 0.09 0.46 0.12 -0.33 -0.25 0.00 0.00 175.52 175.61 2hc5 h GLU 99 N 0.86 0.62 0.00 4.72 5.08 -1.56 0.11 114.58 124.40 2hc5 h GLU 99 Ca 0.12 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2hc5 h GLU 99 Cb 0.72 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 2hc5 h GLU 99 CO 0.06 0.55 -0.11 0.35 -1.00 0.00 0.00 179.01 178.85 2hc5 h PHE 100 N 0.61 0.00 -0.21 4.33 3.57 -1.34 -3.35 116.94 120.55 2hc5 h PHE 100 Ca 0.14 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.51 2hc5 h PHE 100 Cb 0.20 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 2hc5 h PHE 100 CO 0.01 0.28 -0.42 1.25 -2.23 0.00 0.00 178.31 177.19 2hc5 h LEU 101 N -1.00 0.55 -0.71 0.59 7.12 -0.18 -2.68 115.31 119.00 2hc5 h LEU 101 Ca -0.01 -0.25 0.00 0.00 0.13 0.00 0.00 57.88 57.75 2hc5 h LEU 101 Cb 0.33 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 40.31 2hc5 h LEU 101 CO -0.01 0.90 0.00 0.61 -0.13 0.00 0.00 178.44 179.82 2hc5 n GLY 102 N -0.00 -0.98 0.13 3.75 0.00 0.37 -0.44 105.19 108.02 2hc5 n GLY 102 Ca -0.02 0.09 0.01 0.00 0.00 0.00 0.00 46.02 46.09 2hc5 n GLY 102 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2hc5 h LEU 103 N 0.00 0.00 0.08 0.99 3.38 -1.60 -3.35 115.31 114.81 2hc5 h LEU 103 Ca 0.00 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.73 2hc5 h LEU 103 Cb 0.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2hc5 h LEU 103 CO 0.00 0.60 -1.27 -0.26 0.09 0.00 0.00 178.44 177.60 2hc5 h PHE 104 N 0.00 0.30 -2.96 1.13 0.04 -0.88 -3.46 116.94 111.11 2hc5 h PHE 104 Ca -0.01 -0.22 -0.53 0.00 2.80 0.00 0.00 57.97 60.01 2hc5 h PHE 104 Cb 1.31 -0.01 0.07 0.00 2.20 0.00 0.00 35.95 39.52 2hc5 h PHE 104 CO 0.00 1.50 0.94 1.33 -0.60 0.00 0.00 178.31 181.47 2hc5 n VAL 105 N -4.08 0.54 -3.01 -0.55 0.24 -0.93 -4.87 118.33 105.66 2hc5 n VAL 105 Ca -0.25 -0.13 -0.44 0.00 -2.04 0.00 0.00 64.34 61.47 2hc5 n VAL 105 Cb 0.82 -1.96 -0.01 0.00 -1.47 0.00 0.00 33.84 31.22 2hc5 n VAL 105 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2hc5 s ASP 106 N 0.81 6.89 0.00 -1.34 2.15 -1.26 -4.86 116.67 119.05 2hc5 s ASP 106 Ca 0.69 -2.63 0.00 0.00 0.43 0.00 0.00 52.55 51.04 2hc5 s ASP 106 Cb -0.51 -2.36 0.00 0.00 -0.30 0.00 0.00 42.92 39.75 2hc5 s ASP 106 CO 0.41 -0.82 0.00 1.21 -0.17 0.00 0.00 175.17 175.80 2hc5 n GLU 107 N 5.58 0.00 0.25 4.34 2.13 -1.26 -3.39 120.64 128.29 2hc5 n GLU 107 Ca 0.28 0.00 0.13 0.00 0.66 0.00 0.00 57.16 58.23 2hc5 n GLU 107 Cb 0.45 0.00 0.63 0.00 0.27 0.00 0.00 31.44 32.79 2hc5 n GLU 107 CO 0.00 0.00 0.00 1.57 -0.41 0.00 0.00 177.13 178.29 2hc5 h LYS 108 N 0.00 0.00 -0.04 5.31 5.09 -1.94 -0.03 116.57 124.97 2hc5 h LYS 108 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 2hc5 h LYS 108 Cb 0.00 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.33 2hc5 h LYS 108 CO 0.00 0.14 0.00 1.63 -2.09 0.00 0.00 179.45 179.13 2hc5 n LYS 109 N -3.39 1.37 0.09 0.07 5.02 -1.22 -2.76 118.16 117.34 2hc5 n LYS 109 Ca -0.01 -0.54 0.12 0.00 -2.02 0.00 0.00 58.31 55.86 2hc5 n LYS 109 Cb 0.33 -1.44 0.17 0.00 -0.02 0.00 0.00 35.03 34.07 2hc5 n LYS 109 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2hc5 h LEU 110 N 1.23 0.00 2.06 -0.35 3.38 -1.28 -3.48 115.31 116.88 2hc5 h LEU 110 Ca 0.00 -0.12 -0.36 0.00 0.09 0.00 0.00 57.88 57.49 2hc5 h LEU 110 Cb 0.26 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.94 2hc5 h LEU 110 CO 0.00 0.06 -0.40 -0.62 0.09 0.00 0.00 178.44 177.56 2hc5 n GLU 111 N -2.35 -1.67 -1.54 1.13 1.02 -1.11 -4.98 120.64 111.13 2hc5 n GLU 111 Ca 0.03 0.94 -0.17 0.00 -0.02 0.00 0.00 57.16 57.94 2hc5 n GLU 111 Cb 0.47 -5.45 0.11 0.00 -0.02 0.00 0.00 31.44 26.54 2hc5 n GLU 111 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2hc5 n HIS 112 N -3.10 -3.59 0.18 -0.32 8.25 -1.26 -5.02 115.22 110.36 2hc5 n HIS 112 Ca -0.20 -0.95 -0.14 0.00 -0.26 0.00 0.00 57.72 56.18 2hc5 n HIS 112 Cb 0.63 -0.58 -0.08 0.00 1.12 0.00 0.00 29.99 31.07 2hc5 n HIS 112 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2hc5 h HIS 113 N -1.06 -0.43 0.00 4.41 2.76 -1.93 -3.49 115.15 115.41 2hc5 h HIS 113 Ca -0.25 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 57.91 2hc5 h HIS 113 Cb 0.79 0.14 0.00 0.00 1.55 0.00 0.00 27.41 29.89 2hc5 h HIS 113 CO 0.00 -0.11 0.00 -2.39 -1.30 0.00 0.00 177.93 174.13 2hc5 n HIS 114 N -5.17 0.00 0.00 5.26 1.44 -1.26 -5.06 115.22 110.43 2hc5 n HIS 114 Ca -0.10 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.61 2hc5 n HIS 114 Cb 0.27 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.38 2hc5 n HIS 114 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2hc5 n HIS 115 N -0.88 -0.01 -0.03 -1.40 8.25 -1.26 -4.95 115.22 114.94 2hc5 n HIS 115 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2hc5 n HIS 115 Cb 0.00 0.16 0.00 0.00 1.12 0.00 0.00 29.99 31.27 2hc5 n HIS 115 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2hc5 n HIS 116 N -2.85 0.00 1.73 4.41 -0.00 -1.26 -5.26 115.22 112.00 2hc5 n HIS 116 Ca 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 57.72 57.87 2hc5 n HIS 116 Cb 0.33 0.00 0.72 0.00 -0.00 0.00 0.00 29.99 31.04 2hc5 n HIS 116 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92