#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 3.21 0.37 -1.43 -0.87 -1.26 -4.98 114.94 109.98 2hc5 s ASN 2 Ca 0.00 -0.92 0.23 0.00 -1.57 0.00 0.00 52.86 50.60 2hc5 s ASN 2 Cb 0.00 -0.82 0.29 0.00 -0.02 0.00 0.00 41.25 40.70 2hc5 s ASN 2 CO 0.00 -0.27 1.49 -0.29 -2.57 0.00 0.00 177.10 175.46 2hc5 h ILE 3 N 6.56 0.00 0.00 0.60 2.10 -1.94 -3.28 117.51 121.55 2hc5 h ILE 3 Ca -0.17 -0.96 0.00 0.00 1.08 0.00 0.00 64.86 64.80 2hc5 h ILE 3 Cb 1.10 1.85 0.00 0.00 -1.09 0.00 0.00 36.82 38.68 2hc5 h ILE 3 CO 0.37 0.00 0.00 -0.62 -1.08 0.00 0.00 178.15 176.82 2hc5 n GLU 4 N -2.95 0.08 -2.36 2.19 1.02 -1.26 -1.83 120.64 115.54 2hc5 n GLU 4 Ca 0.03 0.23 0.01 0.00 -0.02 0.00 0.00 57.16 57.41 2hc5 n GLU 4 Cb 0.53 -1.50 0.04 0.00 -0.02 0.00 0.00 31.44 30.49 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 -1.40 1.12 -2.73 3.49 1.85 -1.24 -4.28 116.66 113.48 2hc5 n ARG 5 Ca 0.04 -2.81 -0.43 0.00 -1.00 0.00 0.00 57.85 53.66 2hc5 n ARG 5 Cb 0.12 -0.91 -0.03 0.00 -1.05 0.00 0.00 32.46 30.59 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 -2.55 3.84 -0.15 2.89 2.96 -0.76 -4.77 118.68 120.13 2hc5 s LEU 6 Ca 0.27 0.21 0.16 0.00 -0.22 0.00 0.00 54.13 54.55 2hc5 s LEU 6 Cb 0.34 -3.30 0.33 0.00 0.50 0.00 0.00 46.19 44.06 2hc5 s LEU 6 CO -0.08 -1.16 1.17 1.07 -1.32 0.00 0.00 176.35 176.02 2hc5 n THR 7 N 6.58 1.94 -3.96 3.68 5.66 -1.26 -1.22 114.28 125.71 2hc5 n THR 7 Ca 0.08 -2.51 -0.12 0.00 -3.05 0.00 0.00 64.05 58.45 2hc5 n THR 7 Cb 0.49 -0.22 -0.13 0.00 -1.55 0.00 0.00 70.33 68.92 2hc5 n THR 7 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 2hc5 s THR 8 N -2.91 0.13 -0.14 1.09 -1.32 -1.26 -4.78 115.64 106.45 2hc5 s THR 8 Ca 0.33 -0.39 0.17 0.00 -1.21 0.00 0.00 61.69 60.59 2hc5 s THR 8 Cb 0.30 -0.18 0.31 0.00 -1.51 0.00 0.00 72.50 71.42 2hc5 s THR 8 CO -0.00 -0.17 1.16 0.18 -2.21 0.00 0.00 174.62 173.58 2hc5 n LEU 9 N 2.48 2.39 -0.09 9.08 4.77 -1.26 -4.85 117.00 129.53 2hc5 n LEU 9 Ca -0.17 -3.21 -0.06 0.00 -0.03 0.00 0.00 56.01 52.54 2hc5 n LEU 9 Cb 0.58 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2hc5 n LEU 9 CO 0.24 0.83 0.78 -0.61 -1.33 0.00 0.00 177.39 177.30 2hc5 h GLN 10 N 0.17 -0.04 0.00 3.23 5.75 -1.99 0.10 115.11 122.34 2hc5 h GLN 10 Ca -0.00 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.47 2hc5 h GLN 10 Cb 1.00 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.56 2hc5 h GLN 10 CO 0.00 -0.02 -0.17 -1.35 -2.65 0.00 0.00 178.83 174.63 2hc5 h PRO 11 N -0.04 0.00 -0.00 -2.39 0.11 -1.99 -2.09 132.00 125.60 2hc5 h PRO 11 Ca 0.16 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.27 2hc5 h PRO 11 Cb 0.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.40 2hc5 h PRO 11 CO -0.36 0.17 -0.03 0.28 -0.21 0.00 0.00 178.00 177.85 2hc5 h VAL 12 N 0.00 1.63 -0.83 3.15 2.07 -1.47 -2.31 116.25 118.49 2hc5 h VAL 12 Ca -0.00 -1.88 0.00 0.00 0.82 0.00 0.00 66.70 65.65 2hc5 h VAL 12 Cb 0.37 2.90 -0.04 0.00 -1.52 0.00 0.00 31.29 32.99 2hc5 h VAL 12 CO 0.02 0.49 0.53 -0.50 0.02 0.00 0.00 177.57 178.14 2hc5 h TRP 13 N -0.77 1.06 -0.73 1.57 -0.00 -0.82 0.16 115.95 116.44 2hc5 h TRP 13 Ca -0.00 0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 58.89 2hc5 h TRP 13 Cb 0.82 -0.36 -0.03 0.00 -0.00 0.00 0.00 29.16 29.59 2hc5 h TRP 13 CO 0.20 0.68 0.40 0.22 -0.00 0.00 0.00 178.44 179.95 2hc5 h ASP 14 N 1.13 0.91 -0.27 -3.49 3.58 -1.44 0.05 116.42 116.90 2hc5 h ASP 14 Ca 0.30 -0.09 -0.14 0.00 0.42 0.00 0.00 57.03 57.51 2hc5 h ASP 14 Cb -0.10 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 40.71 2hc5 h ASP 14 CO -0.06 0.74 -0.36 -0.09 -2.88 0.00 0.00 179.24 176.59 2hc5 h ARG 15 N 1.00 0.80 -0.43 0.28 2.43 -0.82 -0.36 114.38 117.28 2hc5 h ARG 15 Ca 0.26 -0.40 -0.02 0.00 -0.81 0.00 0.00 59.98 59.01 2hc5 h ARG 15 Cb 0.03 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 2hc5 h ARG 15 CO -0.04 1.03 0.18 -0.92 -1.51 0.00 0.00 179.97 178.70 2hc5 h TYR 16 N 0.66 0.65 0.00 2.20 3.20 -0.26 0.18 116.97 123.61 2hc5 h TYR 16 Ca 0.06 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 2hc5 h TYR 16 Cb 0.91 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 38.98 2hc5 h TYR 16 CO 0.05 0.56 -0.11 -0.44 -1.64 0.00 0.00 178.16 176.58 2hc5 h ASP 17 N 0.55 0.00 -0.17 -2.11 3.32 -0.91 -0.18 116.42 116.92 2hc5 h ASP 17 Ca 0.14 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.08 2hc5 h ASP 17 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 2hc5 h ASP 17 CO -0.01 0.11 -0.35 0.74 -1.72 0.00 0.00 179.24 178.00 2hc5 h THR 18 N 0.00 1.35 0.32 0.35 2.02 -0.55 -3.14 112.91 113.25 2hc5 h THR 18 Ca -0.00 -1.60 -0.02 0.00 0.77 0.00 0.00 66.41 65.56 2hc5 h THR 18 Cb 0.83 1.95 0.00 0.00 -1.74 0.00 0.00 68.15 69.19 2hc5 h THR 18 CO 0.01 0.49 -0.16 1.56 0.37 0.00 0.00 175.52 177.79 2hc5 h GLN 19 N 0.17 -0.42 -0.16 6.66 1.08 -0.31 -3.20 115.11 118.92 2hc5 h GLN 19 Ca 0.00 0.03 0.05 0.00 -1.45 0.00 0.00 58.65 57.28 2hc5 h GLN 19 Cb 0.95 0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 28.47 2hc5 h GLN 19 CO 0.08 -0.28 0.20 0.82 -0.95 0.00 0.00 178.83 178.70 2hc5 h ILE 20 N -0.44 0.41 -0.64 2.54 1.08 -1.18 -0.21 117.51 119.06 2hc5 h ILE 20 Ca -0.04 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.43 2hc5 h ILE 20 Cb 0.34 0.84 0.00 0.00 -3.07 0.00 0.00 36.82 34.93 2hc5 h ILE 20 CO 0.07 0.00 0.00 1.41 -0.69 0.00 0.00 178.15 178.94 2hc5 n HIS 21 N -3.70 0.85 0.00 1.37 8.25 -1.19 -4.65 115.22 116.16 2hc5 n HIS 21 Ca 0.01 -0.43 0.00 0.00 -0.26 0.00 0.00 57.72 57.04 2hc5 n HIS 21 Cb 0.32 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.43 2hc5 n HIS 21 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 2hc5 n ASN 22 N 1.51 0.00 -2.13 0.41 5.15 -0.10 -5.00 115.26 115.11 2hc5 n ASN 22 Ca 0.23 0.00 -0.17 0.00 -0.60 0.00 0.00 54.58 54.03 2hc5 n ASN 22 Cb 0.59 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.81 2hc5 n ASN 22 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2hc5 n GLN 23 N -0.74 -1.74 -0.17 1.20 6.02 -1.19 -4.95 117.38 115.81 2hc5 n GLN 23 Ca 0.00 0.90 0.00 0.00 -0.01 0.00 0.00 57.00 57.89 2hc5 n GLN 23 Cb 0.00 -5.44 0.00 0.00 1.02 0.00 0.00 30.24 25.82 2hc5 n GLN 23 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2hc5 n LYS 24 N -2.68 0.86 0.03 -1.09 5.02 -1.26 -4.98 118.16 114.07 2hc5 n LYS 24 Ca -0.20 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 55.97 2hc5 n LYS 24 Cb 0.63 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.56 2hc5 n LYS 24 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 2hc5 h ASP 25 N 0.00 -1.30 -3.67 4.39 5.19 -2.06 -3.36 116.42 115.62 2hc5 h ASP 25 Ca 0.00 0.15 -0.63 0.00 -0.62 0.00 0.00 57.03 55.92 2hc5 h ASP 25 Cb 0.00 0.49 -0.17 0.00 0.18 0.00 0.00 39.33 39.83 2hc5 h ASP 25 CO 0.00 -0.40 -0.55 0.20 -3.12 0.00 0.00 179.24 175.37 2hc5 s ASN 26 N -4.26 5.79 0.00 6.45 -0.87 -1.26 -5.07 114.94 115.73 2hc5 s ASN 26 Ca -0.12 -0.01 0.00 0.00 -1.57 0.00 0.00 52.86 51.16 2hc5 s ASN 26 Cb 0.05 -2.05 0.00 0.00 -0.02 0.00 0.00 41.25 39.23 2hc5 s ASN 26 CO 0.47 0.02 0.00 -0.67 -2.57 0.00 0.00 177.10 174.35 2hc5 n ASP 27 N 4.60 0.64 -4.84 -1.22 -0.08 -1.26 -4.94 116.55 109.45 2hc5 n ASP 27 Ca -0.15 -0.58 -0.30 0.00 -1.51 0.00 0.00 54.79 52.25 2hc5 n ASP 27 Cb 0.52 0.00 0.07 0.00 2.34 0.00 0.00 41.12 44.05 2hc5 n ASP 27 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 2hc5 s ASN 28 N -0.16 4.88 0.00 1.67 2.47 -1.26 -4.89 114.94 117.65 2hc5 s ASN 28 Ca 0.00 1.23 -0.01 0.00 0.42 0.00 0.00 52.86 54.51 2hc5 s ASN 28 Cb 0.00 -1.99 -0.03 0.00 -1.45 0.00 0.00 41.25 37.77 2hc5 s ASN 28 CO 0.00 -1.71 1.88 -1.84 -3.72 0.00 0.00 177.10 171.71 2hc5 n GLU 29 N -3.26 0.96 -2.14 0.43 0.28 -1.26 -4.88 120.64 110.76 2hc5 n GLU 29 Ca 0.07 -0.12 -0.42 0.00 -0.16 0.00 0.00 57.16 56.53 2hc5 n GLU 29 Cb 0.57 -1.21 -0.03 0.00 1.43 0.00 0.00 31.44 32.20 2hc5 n GLU 29 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2hc5 s VAL 30 N 0.48 3.31 -0.98 3.84 0.11 -1.26 -4.92 120.40 120.99 2hc5 s VAL 30 Ca 0.08 0.89 -0.24 0.00 -2.93 0.00 0.00 61.98 59.79 2hc5 s VAL 30 Cb 0.04 -3.57 0.00 0.00 -1.53 0.00 0.00 36.38 31.32 2hc5 s VAL 30 CO 0.00 0.05 1.70 -2.16 -3.33 0.00 0.00 175.10 171.36 2hc5 s PRO 31 N 1.51 3.09 -0.55 1.54 0.04 -1.26 -4.93 135.00 134.44 2hc5 s PRO 31 Ca 0.66 -0.75 -0.18 0.00 0.04 0.00 0.00 61.00 60.76 2hc5 s PRO 31 Cb -0.36 -5.22 0.09 0.00 0.04 0.00 0.00 34.50 29.04 2hc5 s PRO 31 CO 0.30 -2.80 0.62 0.08 0.04 0.00 0.00 177.00 175.23 2hc5 s VAL 32 N 7.50 4.94 0.01 -0.36 1.01 -1.26 -4.84 120.40 127.40 2hc5 s VAL 32 Ca 0.58 -0.95 -0.19 0.00 0.00 0.00 0.00 61.98 61.42 2hc5 s VAL 32 Cb -0.03 -4.38 0.04 0.00 0.00 0.00 0.00 36.38 32.01 2hc5 s VAL 32 CO -0.05 -0.94 0.43 -1.38 0.00 0.00 0.00 175.10 173.15 2hc5 s HIS 33 N 2.40 -0.31 -0.32 5.22 -3.43 -1.26 -5.11 115.29 112.49 2hc5 s HIS 33 Ca 0.10 0.39 -0.28 0.00 -0.80 0.00 0.00 55.06 54.48 2hc5 s HIS 33 Cb -0.24 0.21 -0.04 0.00 -1.43 0.00 0.00 32.58 31.09 2hc5 s HIS 33 CO 0.07 -0.52 2.06 -1.14 -2.00 0.00 0.00 174.74 173.21 2hc5 s GLN 34 N -1.89 3.05 -0.22 -0.38 0.74 -1.26 -4.95 119.66 114.75 2hc5 s GLN 34 Ca -0.09 1.64 -0.20 0.00 0.05 0.00 0.00 55.36 56.76 2hc5 s GLN 34 Cb -0.02 -4.33 -0.02 0.00 1.10 0.00 0.00 33.01 29.73 2hc5 s GLN 34 CO 0.02 -2.19 0.62 0.14 -0.55 0.00 0.00 175.29 173.32 2hc5 s VAL 35 N 8.28 5.02 -1.13 1.34 -7.23 -1.26 -5.01 120.40 120.42 2hc5 s VAL 35 Ca 0.90 1.14 -0.10 0.00 -1.81 0.00 0.00 61.98 62.11 2hc5 s VAL 35 Cb -0.26 -3.93 0.26 0.00 0.56 0.00 0.00 36.38 33.02 2hc5 s VAL 35 CO 0.33 0.09 1.16 -0.55 -0.31 0.00 0.00 175.10 175.81 2hc5 s SER 36 N 1.30 7.29 0.00 4.85 0.15 -1.26 -4.83 113.70 121.20 2hc5 s SER 36 Ca 0.27 -3.50 0.00 0.00 0.70 0.00 0.00 55.95 53.42 2hc5 s SER 36 Cb -0.16 -2.24 0.00 0.00 -1.71 0.00 0.00 66.02 61.92 2hc5 s SER 36 CO 0.10 -0.36 0.00 0.00 1.20 0.00 0.00 173.24 174.18 2hc5 n TYR 37 N 3.15 0.00 0.22 3.44 4.19 -1.26 -3.59 117.16 123.31 2hc5 n TYR 37 Ca 0.26 0.00 0.08 0.00 3.31 0.00 0.00 57.90 61.55 2hc5 n TYR 37 Cb 0.40 0.00 0.52 0.00 0.49 0.00 0.00 39.34 40.75 2hc5 n TYR 37 CO 0.00 0.00 0.00 1.15 0.91 0.00 0.00 176.86 178.92 2hc5 h THR 38 N 0.00 0.82 -0.82 2.97 2.02 -2.02 -2.61 112.91 113.27 2hc5 h THR 38 Ca 0.00 -0.98 -0.03 0.00 0.77 0.00 0.00 66.41 66.17 2hc5 h THR 38 Cb 0.00 1.59 -0.04 0.00 -1.74 0.00 0.00 68.15 67.96 2hc5 h THR 38 CO 0.00 0.24 0.38 0.78 0.37 0.00 0.00 175.52 177.29 2hc5 h ASN 39 N 0.00 1.09 -0.49 4.18 -0.26 -1.88 -2.36 115.58 115.86 2hc5 h ASN 39 Ca -0.00 -0.14 0.08 0.00 -0.56 0.00 0.00 56.30 55.68 2hc5 h ASN 39 Cb 0.57 -0.28 -0.06 0.00 -1.06 0.00 0.00 38.32 37.49 2hc5 h ASN 39 CO 0.03 0.93 0.13 -0.07 -1.06 0.00 0.00 177.43 177.39 2hc5 h LEU 40 N 1.18 0.08 -0.76 1.61 4.07 -1.78 0.19 115.31 119.89 2hc5 h LEU 40 Ca 0.28 0.08 -0.00 0.00 0.08 0.00 0.00 57.88 58.31 2hc5 h LEU 40 Cb 0.14 0.09 -0.04 0.00 1.08 0.00 0.00 40.66 41.93 2hc5 h LEU 40 CO -0.03 0.07 0.46 0.00 -1.08 0.00 0.00 178.44 177.85 2hc5 h ALA 41 N 1.36 0.97 -0.92 1.53 0.00 -1.53 0.58 119.26 121.24 2hc5 h ALA 41 Ca 0.24 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2hc5 h ALA 41 Cb 0.30 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2hc5 h ALA 41 CO -0.29 0.43 0.58 0.93 0.00 0.00 0.00 179.25 180.90 2hc5 h GLU 42 N 1.04 1.24 0.23 0.00 5.08 -0.84 -1.22 114.58 120.11 2hc5 h GLU 42 Ca 0.27 -0.10 -0.32 0.00 -1.00 0.00 0.00 59.36 58.22 2hc5 h GLU 42 Cb -0.04 -0.27 0.04 0.00 0.50 0.00 0.00 28.75 28.98 2hc5 h GLU 42 CO -0.05 0.85 -1.38 0.52 -1.00 0.00 0.00 179.01 177.95 2hc5 h MET 43 N 1.26 0.52 -0.90 2.33 2.86 -0.24 -3.30 114.93 117.47 2hc5 h MET 43 Ca 0.33 -0.88 -0.02 0.00 -2.06 0.00 0.00 59.70 57.08 2hc5 h MET 43 Cb -0.09 0.32 -0.04 0.00 0.06 0.00 0.00 31.60 31.85 2hc5 h MET 43 CO -0.07 1.42 0.49 0.28 1.06 0.00 0.00 176.91 180.09 2hc5 h VAL 44 N 0.09 1.26 -0.04 -2.22 2.07 0.28 -1.08 116.25 116.61 2hc5 h VAL 44 Ca -0.24 -0.66 0.03 0.00 0.82 0.00 0.00 66.70 66.66 2hc5 h VAL 44 Cb 2.09 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.86 2hc5 h VAL 44 CO 0.26 0.30 -0.21 1.23 0.02 0.00 0.00 177.57 179.17 2hc5 h GLY 45 N 1.27 -0.27 1.98 2.17 0.00 -1.31 -0.82 103.07 106.08 2hc5 h GLY 45 Ca 0.32 0.25 -0.14 0.00 0.00 0.00 0.00 47.33 47.76 2hc5 h GLY 45 CO -0.05 -0.19 -0.68 1.05 0.00 0.00 0.00 176.54 176.68 2hc5 h GLU 46 N -0.32 0.02 -0.89 4.80 4.11 -1.62 -3.03 114.58 117.66 2hc5 h GLU 46 Ca 0.07 -0.02 -0.00 0.00 0.07 0.00 0.00 59.36 59.48 2hc5 h GLU 46 Cb 0.41 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 2hc5 h GLU 46 CO -0.22 0.69 0.54 1.98 0.07 0.00 0.00 179.01 182.07 2hc5 h MET 47 N 0.02 1.20 -0.39 1.06 4.05 -0.70 -1.79 114.93 118.37 2hc5 h MET 47 Ca -0.01 -0.11 -0.08 0.00 -0.28 0.00 0.00 59.70 59.22 2hc5 h MET 47 Cb 1.20 -0.25 -0.02 0.00 -0.80 0.00 0.00 31.60 31.73 2hc5 h MET 47 CO 0.09 0.84 -0.09 -0.91 0.23 0.00 0.00 176.91 177.07 2hc5 h ASN 48 N 1.22 0.66 0.42 1.39 2.35 -1.06 -3.01 115.58 117.55 2hc5 h ASN 48 Ca 0.32 -0.18 -0.11 0.00 -0.55 0.00 0.00 56.30 55.78 2hc5 h ASN 48 Cb -0.05 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.13 2hc5 h ASN 48 CO -0.06 0.79 -0.48 0.11 -1.65 0.00 0.00 177.43 176.14 2hc5 h LYS 49 N 0.62 0.07 0.00 0.81 1.57 -1.25 -2.47 116.57 115.93 2hc5 h LYS 49 Ca 0.11 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2hc5 h LYS 49 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 2hc5 h LYS 49 CO 0.03 0.54 0.00 1.28 -0.57 0.00 0.00 179.45 180.73 2hc5 n LEU 50 N -3.97 0.43 -0.15 2.94 4.77 -0.76 -2.69 117.00 117.57 2hc5 n LEU 50 Ca -0.02 0.59 0.01 0.00 -0.03 0.00 0.00 56.01 56.57 2hc5 n LEU 50 Cb 0.51 -0.52 0.03 0.00 -2.33 0.00 0.00 43.42 41.11 2hc5 n LEU 50 CO 0.41 -0.39 0.51 0.18 -1.33 0.00 0.00 177.39 176.76 2hc5 n LEU 51 N -1.96 2.12 0.05 2.23 4.77 -0.95 -4.72 117.00 118.54 2hc5 n LEU 51 Ca 0.03 -1.90 -0.13 0.00 -0.03 0.00 0.00 56.01 53.98 2hc5 n LEU 51 Cb 0.24 -0.05 -0.09 0.00 -2.33 0.00 0.00 43.42 41.19 2hc5 n LEU 51 CO 0.19 0.53 0.67 -0.33 -1.33 0.00 0.00 177.39 177.12 2hc5 h GLU 52 N 0.48 -0.13 0.00 3.23 5.08 -1.29 -3.06 114.58 118.90 2hc5 h GLU 52 Ca 0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2hc5 h GLU 52 Cb 0.51 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2hc5 h GLU 52 CO 0.00 0.19 0.00 -0.35 -1.00 0.00 0.00 179.01 177.85 2hc5 n PRO 53 N -5.00 0.22 -2.29 2.33 -0.04 -1.26 -4.82 135.00 124.14 2hc5 n PRO 53 Ca -0.08 0.10 -0.25 0.00 -0.04 0.00 0.00 63.50 63.22 2hc5 n PRO 53 Cb 0.20 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.23 2hc5 n PRO 53 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2hc5 s SER 54 N -2.69 4.84 0.01 3.54 0.15 -1.15 -4.00 113.70 114.39 2hc5 s SER 54 Ca 0.18 0.34 -0.02 0.00 0.70 0.00 0.00 55.95 57.15 2hc5 s SER 54 Cb 0.14 -1.00 -0.27 0.00 -1.71 0.00 0.00 66.02 63.18 2hc5 s SER 54 CO 0.35 -1.55 0.87 1.56 1.20 0.00 0.00 173.24 175.67 2hc5 h GLN 55 N -0.50 0.22 -5.80 5.44 1.08 -1.41 -3.40 115.11 110.74 2hc5 h GLN 55 Ca -0.44 -0.38 -0.45 0.00 -1.45 0.00 0.00 58.65 55.93 2hc5 h GLN 55 Cb 1.31 0.14 -0.07 0.00 -0.05 0.00 0.00 27.48 28.81 2hc5 h GLN 55 CO 0.58 1.08 1.25 0.14 -0.95 0.00 0.00 178.83 180.92 2hc5 s VAL 56 N -2.62 3.71 -1.18 -0.54 -7.23 -0.35 -4.88 120.40 107.30 2hc5 s VAL 56 Ca -0.08 -0.83 -0.20 0.00 -1.81 0.00 0.00 61.98 59.06 2hc5 s VAL 56 Cb 0.07 -4.61 0.06 0.00 0.56 0.00 0.00 36.38 32.46 2hc5 s VAL 56 CO 0.85 -1.41 1.63 -1.00 -0.31 0.00 0.00 175.10 174.86 2hc5 s HIS 57 N 7.90 2.66 -0.31 2.82 3.76 -1.26 -4.87 115.29 125.98 2hc5 s HIS 57 Ca 0.60 -1.26 -0.26 0.00 -0.15 0.00 0.00 55.06 53.99 2hc5 s HIS 57 Cb -0.02 -4.72 0.01 0.00 1.11 0.00 0.00 32.58 28.96 2hc5 s HIS 57 CO 0.01 -1.85 0.94 -0.51 -0.85 0.00 0.00 174.74 172.47 2hc5 s LEU 58 N 4.70 4.02 -0.52 0.89 2.01 -1.26 -0.76 118.68 127.76 2hc5 s LEU 58 Ca 0.51 0.87 -0.20 0.00 0.01 0.00 0.00 54.13 55.33 2hc5 s LEU 58 Cb 0.02 -3.32 0.06 0.00 0.01 0.00 0.00 46.19 42.97 2hc5 s LEU 58 CO 0.01 -0.74 0.67 -0.54 1.01 0.00 0.00 176.35 176.76 2hc5 s LYS 59 N 3.30 3.13 -0.36 1.70 1.02 0.14 -4.86 119.74 123.81 2hc5 s LYS 59 Ca 0.39 -0.89 -0.26 0.00 0.02 0.00 0.00 55.97 55.23 2hc5 s LYS 59 Cb -0.13 -4.12 0.01 0.00 -0.52 0.00 0.00 37.83 33.07 2hc5 s LYS 59 CO 0.14 -1.30 0.94 -0.06 -0.92 0.00 0.00 175.35 174.15 2hc5 s PHE 60 N 2.79 3.09 -0.08 3.18 0.08 -1.26 -2.38 117.98 123.40 2hc5 s PHE 60 Ca 0.16 0.83 0.04 0.00 0.12 0.00 0.00 56.93 58.08 2hc5 s PHE 60 Cb -0.19 -3.65 -0.01 0.00 -0.57 0.00 0.00 43.02 38.60 2hc5 s PHE 60 CO 0.12 -0.82 -0.20 -1.21 -0.10 0.00 0.00 175.22 173.02 2hc5 s GLU 61 N 3.49 2.79 -0.70 0.44 0.41 -0.86 -4.94 118.70 119.33 2hc5 s GLU 61 Ca 0.39 -0.80 -0.21 0.00 -0.41 0.00 0.00 54.97 53.94 2hc5 s GLU 61 Cb -0.12 -2.34 0.10 0.00 -1.78 0.00 0.00 34.13 29.99 2hc5 s GLU 61 CO 0.18 0.37 0.93 -1.17 -0.49 0.00 0.00 175.26 175.09 2hc5 s LEU 62 N -0.11 4.84 -0.27 1.80 2.96 -1.26 -1.26 118.68 125.37 2hc5 s LEU 62 Ca -0.04 -1.37 -0.05 0.00 -0.22 0.00 0.00 54.13 52.45 2hc5 s LEU 62 Cb -0.14 -2.38 0.01 0.00 0.50 0.00 0.00 46.19 44.18 2hc5 s LEU 62 CO 0.04 -1.26 0.03 -1.00 -1.32 0.00 0.00 176.35 172.84 2hc5 s HIS 63 N 3.33 3.11 0.50 5.38 3.76 -0.34 -4.95 115.29 126.08 2hc5 s HIS 63 Ca 0.22 -1.12 -0.18 0.00 -0.15 0.00 0.00 55.06 53.83 2hc5 s HIS 63 Cb -0.16 -2.19 -0.09 0.00 1.11 0.00 0.00 32.58 31.26 2hc5 s HIS 63 CO 0.04 -0.61 0.98 0.16 -0.85 0.00 0.00 174.74 174.46 2hc5 s ASP 64 N 1.45 6.69 0.00 1.40 -4.77 -1.26 -2.43 116.67 117.75 2hc5 s ASP 64 Ca 0.02 1.60 0.00 0.00 -3.30 0.00 0.00 52.55 50.87 2hc5 s ASP 64 Cb -0.17 -2.52 0.00 0.00 -1.09 0.00 0.00 42.92 39.15 2hc5 s ASP 64 CO 0.00 -0.54 0.00 1.17 0.70 0.00 0.00 175.17 176.50 2hc5 n LYS 65 N -1.37 0.18 -0.03 2.11 3.00 0.17 -4.94 118.16 117.28 2hc5 n LYS 65 Ca 0.07 0.00 -0.17 0.00 -0.00 0.00 0.00 58.31 58.20 2hc5 n LYS 65 Cb 0.54 0.00 -0.13 0.00 0.00 0.00 0.00 35.03 35.44 2hc5 n LYS 65 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 2hc5 h LEU 66 N 0.00 0.17 0.00 3.14 5.85 -2.04 -3.43 115.31 119.00 2hc5 h LEU 66 Ca 0.00 -0.92 0.00 0.00 0.84 0.00 0.00 57.88 57.80 2hc5 h LEU 66 Cb 0.00 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 40.98 2hc5 h LEU 66 CO 0.00 1.23 -0.39 -3.20 -0.34 0.00 0.00 178.44 175.74 2hc5 n ASN 67 N -4.39 1.94 -4.96 1.25 2.85 -1.26 -5.09 115.26 105.60 2hc5 n ASN 67 Ca -0.15 0.00 -0.22 0.00 -0.11 0.00 0.00 54.58 54.10 2hc5 n ASN 67 Cb 0.64 0.37 0.04 0.00 1.24 0.00 0.00 39.78 42.07 2hc5 n ASN 67 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 2hc5 s GLU 68 N -0.84 2.48 -0.13 1.20 0.41 -1.26 -5.11 118.70 115.44 2hc5 s GLU 68 Ca 0.00 -0.72 -0.06 0.00 -0.41 0.00 0.00 54.97 53.77 2hc5 s GLU 68 Cb 0.00 -2.44 0.06 0.00 -1.78 0.00 0.00 34.13 29.96 2hc5 s GLU 68 CO 0.00 -0.80 0.31 1.52 -0.49 0.00 0.00 175.26 175.80 2hc5 s TYR 69 N -2.83 -0.46 0.16 1.61 1.13 -1.26 0.45 117.35 116.15 2hc5 s TYR 69 Ca 0.58 1.01 0.00 0.00 -1.41 0.00 0.00 57.07 57.26 2hc5 s TYR 69 Cb -0.10 0.11 -0.04 0.00 -1.10 0.00 0.00 41.96 40.83 2hc5 s TYR 69 CO 0.39 -0.30 0.03 1.52 -2.51 0.00 0.00 175.55 174.68 2hc5 s TYR 70 N 1.61 1.07 -0.29 -3.49 -0.85 -1.02 -4.06 117.35 110.31 2hc5 s TYR 70 Ca -0.07 -1.13 -0.07 0.00 -0.52 0.00 0.00 57.07 55.28 2hc5 s TYR 70 Cb -0.10 -0.60 0.01 0.00 0.38 0.00 0.00 41.96 41.64 2hc5 s TYR 70 CO -0.10 -0.37 0.08 0.08 -1.52 0.00 0.00 175.55 173.72 2hc5 s VAL 71 N -3.85 3.94 0.07 -3.49 1.01 -0.68 -1.20 120.40 116.20 2hc5 s VAL 71 Ca 0.25 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.51 2hc5 s VAL 71 Cb 0.07 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.37 2hc5 s VAL 71 CO 0.04 0.08 0.26 -1.59 0.00 0.00 0.00 175.10 173.88 2hc5 s LYS 72 N 1.49 3.50 -0.32 2.72 -2.85 -0.39 -1.58 119.74 122.31 2hc5 s LYS 72 Ca 0.02 -0.30 -0.11 0.00 -1.00 0.00 0.00 55.97 54.58 2hc5 s LYS 72 Cb -0.17 -3.00 -0.01 0.00 -2.06 0.00 0.00 37.83 32.59 2hc5 s LYS 72 CO 0.02 0.58 0.19 0.08 0.10 0.00 0.00 175.35 176.33 2hc5 s VAL 73 N -1.51 4.93 -0.21 1.79 1.01 0.12 -2.03 120.40 124.49 2hc5 s VAL 73 Ca 0.35 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 62.01 2hc5 s VAL 73 Cb -0.13 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.75 2hc5 s VAL 73 CO 0.25 0.04 -0.10 -0.63 0.00 0.00 0.00 175.10 174.66 2hc5 s ILE 74 N 1.67 2.79 -0.29 2.22 1.01 -1.00 -1.62 121.20 125.98 2hc5 s ILE 74 Ca 0.05 -0.78 -0.27 0.00 0.00 0.00 0.00 60.65 59.65 2hc5 s ILE 74 Cb -0.17 -2.28 0.01 0.00 0.01 0.00 0.00 42.46 40.03 2hc5 s ILE 74 CO 0.08 0.41 0.98 -0.70 0.00 0.00 0.00 174.94 175.72 2hc5 s GLU 75 N 1.38 4.10 0.53 2.79 2.12 -0.83 0.27 118.70 129.06 2hc5 s GLU 75 Ca 0.04 1.02 0.26 0.00 0.36 0.00 0.00 54.97 56.66 2hc5 s GLU 75 Cb -0.14 -3.71 1.50 0.00 0.26 0.00 0.00 34.13 32.04 2hc5 s GLU 75 CO -0.07 -0.76 2.12 0.22 -0.54 0.00 0.00 175.26 176.23 2hc5 h ASP 76 N 7.92 0.00 0.28 -1.70 3.58 -1.27 0.67 116.42 125.90 2hc5 h ASP 76 Ca -0.21 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.19 2hc5 h ASP 76 Cb 1.07 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.11 2hc5 h ASP 76 CO 0.98 0.09 -0.23 0.28 -2.88 0.00 0.00 179.24 177.48 2hc5 h SER 77 N 0.00 0.00 0.00 2.28 0.02 -1.90 -3.12 113.55 110.83 2hc5 h SER 77 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2hc5 h SER 77 Cb 0.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.78 2hc5 h SER 77 CO 0.01 0.23 -0.94 0.35 -1.14 0.00 0.00 176.83 175.34 2hc5 n THR 78 N -4.12 0.00 -2.00 -2.27 -2.24 -0.85 -5.01 114.28 97.80 2hc5 n THR 78 Ca -0.02 -0.18 -0.17 0.00 -2.27 0.00 0.00 64.05 61.41 2hc5 n THR 78 Cb 0.29 0.56 -0.03 0.00 -2.10 0.00 0.00 70.33 69.05 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 -1.51 -4.97 -4.48 3.42 3.02 0.23 -5.00 115.26 105.98 2hc5 n ASN 79 Ca -0.00 0.15 -0.23 0.00 -0.03 0.00 0.00 54.58 54.46 2hc5 n ASN 79 Cb 0.10 -4.02 -0.11 0.00 -0.61 0.00 0.00 39.78 35.14 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 -4.29 1.73 -0.09 3.52 -1.05 -1.21 -4.95 118.70 112.36 2hc5 s GLU 80 Ca 0.00 -1.97 -0.20 0.00 -0.15 0.00 0.00 54.97 52.65 2hc5 s GLU 80 Cb 0.00 -1.02 -0.04 0.00 -0.44 0.00 0.00 34.13 32.63 2hc5 s GLU 80 CO 0.00 -0.18 0.57 0.08 0.95 0.00 0.00 175.26 176.69 2hc5 s VAL 81 N -3.18 5.12 -0.59 1.83 1.01 -1.26 -1.97 120.40 121.37 2hc5 s VAL 81 Ca 0.35 1.16 0.07 0.00 0.00 0.00 0.00 61.98 63.56 2hc5 s VAL 81 Cb 0.09 -3.91 -0.01 0.00 0.00 0.00 0.00 36.38 32.55 2hc5 s VAL 81 CO 0.16 0.30 0.49 2.30 0.00 0.00 0.00 175.10 178.35 2hc5 n ILE 82 N 3.69 0.00 -3.62 2.22 -5.35 -0.64 -4.97 119.36 110.69 2hc5 n ILE 82 Ca -0.05 -0.43 -0.06 0.00 -0.27 0.00 0.00 62.75 61.95 2hc5 n ILE 82 Cb 0.51 1.07 -0.05 0.00 -1.74 0.00 0.00 39.64 39.44 2hc5 n ILE 82 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 2hc5 s ARG 83 N -1.08 0.30 -0.17 6.28 6.06 -1.20 -5.02 118.95 124.11 2hc5 s ARG 83 Ca 0.05 0.13 -0.00 0.00 -2.50 0.00 0.00 55.73 53.41 2hc5 s ARG 83 Cb 0.05 0.14 0.04 0.00 0.06 0.00 0.00 34.95 35.24 2hc5 s ARG 83 CO 0.17 -0.08 -0.06 -1.21 -2.50 0.00 0.00 175.30 171.62 2hc5 s GLU 84 N -0.75 1.54 -0.28 5.12 2.02 -1.26 0.11 118.70 125.20 2hc5 s GLU 84 Ca 0.04 -0.55 -0.08 0.00 0.02 0.00 0.00 54.97 54.40 2hc5 s GLU 84 Cb -0.02 -2.05 -0.02 0.00 0.10 0.00 0.00 34.13 32.15 2hc5 s GLU 84 CO -0.06 -0.42 0.10 0.42 0.02 0.00 0.00 175.26 175.33 2hc5 s ILE 85 N 1.60 4.42 0.66 -1.63 1.09 -0.62 -4.98 121.20 121.75 2hc5 s ILE 85 Ca 0.01 -0.29 -0.15 0.00 -1.10 0.00 0.00 60.65 59.12 2hc5 s ILE 85 Cb -0.15 -3.15 0.00 0.00 -1.06 0.00 0.00 42.46 38.10 2hc5 s ILE 85 CO -0.08 0.22 1.10 -2.16 -0.10 0.00 0.00 174.94 173.92 2hc5 s PRO 86 N 1.61 2.79 0.46 2.79 0.04 -1.26 -1.69 135.00 139.75 2hc5 s PRO 86 Ca 0.05 1.35 0.12 0.00 0.04 0.00 0.00 61.00 62.56 2hc5 s PRO 86 Cb -0.16 -1.95 1.07 0.00 0.04 0.00 0.00 34.50 33.50 2hc5 s PRO 86 CO 0.05 -1.25 2.08 -1.00 0.04 0.00 0.00 177.00 176.92 2hc5 h PRO 87 N -0.06 0.28 0.00 0.56 0.13 -1.96 -0.30 132.00 130.66 2hc5 h PRO 87 Ca -0.46 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2hc5 h PRO 87 Cb 1.24 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2hc5 h PRO 87 CO 0.54 0.19 0.00 0.36 -0.23 0.00 0.00 178.00 178.86 2hc5 n LYS 88 N -4.49 0.14 0.00 0.86 2.85 -1.26 -2.60 118.16 113.66 2hc5 n LYS 88 Ca 0.02 0.24 0.00 0.00 -1.05 0.00 0.00 58.31 57.52 2hc5 n LYS 88 Cb 0.14 -1.71 0.00 0.00 -0.65 0.00 0.00 35.03 32.81 2hc5 n LYS 88 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2hc5 n ARG 89 N -1.96 1.25 0.22 -1.58 1.74 -0.32 -4.63 116.66 111.38 2hc5 n ARG 89 Ca 0.04 -1.02 0.09 0.00 -0.77 0.00 0.00 57.85 56.20 2hc5 n ARG 89 Cb 0.30 -0.95 0.49 0.00 -1.02 0.00 0.00 32.46 31.27 2hc5 n ARG 89 CO 0.00 0.00 0.00 2.35 -1.52 0.00 0.00 177.63 178.46 2hc5 h TRP 90 N 0.00 0.00 0.04 -1.55 2.91 -0.86 -2.55 115.95 113.94 2hc5 h TRP 90 Ca 0.00 0.00 -0.00 0.00 1.13 0.00 0.00 58.89 60.02 2hc5 h TRP 90 Cb 0.34 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.99 2hc5 h TRP 90 CO 0.00 0.24 -0.02 -0.07 -1.03 0.00 0.00 178.44 177.56 2hc5 h LEU 91 N 0.00 -0.05 -1.20 0.65 3.38 -1.82 0.09 115.31 116.36 2hc5 h LEU 91 Ca -0.00 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.61 2hc5 h LEU 91 Cb 0.69 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.41 2hc5 h LEU 91 CO 0.03 0.35 0.54 0.44 0.09 0.00 0.00 178.44 179.90 2hc5 h ASP 92 N -0.46 0.94 0.28 -0.43 3.32 -1.86 -0.49 116.42 117.72 2hc5 h ASP 92 Ca -0.01 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 2hc5 h ASP 92 Cb 0.42 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2hc5 h ASP 92 CO 0.01 0.68 -0.14 0.15 -1.72 0.00 0.00 179.24 178.22 2hc5 h PHE 93 N 1.11 -0.35 -0.95 4.55 3.57 -1.35 -1.99 116.94 121.53 2hc5 h PHE 93 Ca 0.30 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.83 2hc5 h PHE 93 Cb -0.12 0.12 -0.05 0.00 2.79 0.00 0.00 35.95 38.68 2hc5 h PHE 93 CO -0.00 -0.12 0.62 -0.92 -2.23 0.00 0.00 178.31 175.66 2hc5 h TYR 94 N -0.52 1.16 0.18 0.41 3.20 -0.60 -1.05 116.97 119.75 2hc5 h TYR 94 Ca -0.04 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2hc5 h TYR 94 Cb 0.38 -0.39 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 2hc5 h TYR 94 CO -0.02 0.67 -0.15 0.00 -1.64 0.00 0.00 178.16 177.02 2hc5 h ALA 95 N 1.44 -0.32 -0.79 1.82 0.00 -0.98 -0.58 119.26 119.85 2hc5 h ALA 95 Ca 0.37 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.26 2hc5 h ALA 95 Cb -0.00 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 2hc5 h ALA 95 CO -0.11 -0.70 0.52 0.00 0.00 0.00 0.00 179.25 178.96 2hc5 h ALA 96 N 0.44 1.48 0.02 0.00 0.00 -0.82 -0.84 119.26 119.54 2hc5 h ALA 96 Ca -0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2hc5 h ALA 96 Cb 0.32 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2hc5 h ALA 96 CO -0.02 0.45 -0.01 0.52 0.00 0.00 0.00 179.25 180.20 2hc5 h MET 97 N 1.02 -0.02 0.00 0.00 2.07 -0.82 -2.48 114.93 114.70 2hc5 h MET 97 Ca 0.30 0.00 -0.09 0.00 -2.07 0.00 0.00 59.70 57.84 2hc5 h MET 97 Cb -0.03 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 29.69 2hc5 h MET 97 CO -0.08 0.20 -0.44 0.00 1.07 0.00 0.00 176.91 177.66 2hc5 h THR 98 N -0.23 0.99 -0.54 2.22 1.03 -0.76 0.29 112.91 115.91 2hc5 h THR 98 Ca -0.00 -1.70 -0.11 0.00 -0.01 0.00 0.00 66.41 64.58 2hc5 h THR 98 Cb 0.23 2.01 -0.02 0.00 -1.07 0.00 0.00 68.15 69.30 2hc5 h THR 98 CO 0.00 0.43 -0.10 -0.33 -0.01 0.00 0.00 175.52 175.51 2hc5 h GLU 99 N 0.00 1.02 0.00 0.00 5.08 -1.12 -2.19 114.58 117.37 2hc5 h GLU 99 Ca -0.00 -0.38 -0.02 0.00 -1.00 0.00 0.00 59.36 57.96 2hc5 h GLU 99 Cb 0.98 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.16 2hc5 h GLU 99 CO 0.06 1.06 -0.16 0.35 -1.00 0.00 0.00 179.01 179.32 2hc5 h PHE 100 N 0.91 0.00 -0.02 4.33 3.57 -1.08 -3.37 116.94 121.28 2hc5 h PHE 100 Ca 0.14 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.55 2hc5 h PHE 100 Cb 0.67 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 2hc5 h PHE 100 CO 0.04 0.36 -0.42 -0.07 -2.23 0.00 0.00 178.31 176.00 2hc5 h LEU 101 N -1.00 0.05 0.00 0.59 3.38 -0.55 -2.46 115.31 115.31 2hc5 h LEU 101 Ca -0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2hc5 h LEU 101 Cb 0.42 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2hc5 h LEU 101 CO -0.01 0.47 0.00 0.61 0.09 0.00 0.00 178.44 179.59 2hc5 n GLY 102 N -0.29 -1.10 0.08 0.83 0.00 -0.82 -1.41 105.19 102.48 2hc5 n GLY 102 Ca -0.02 -0.07 0.14 0.00 0.00 0.00 0.00 46.02 46.07 2hc5 n GLY 102 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2hc5 n LEU 103 N -1.45 0.35 -0.41 0.99 4.77 -0.93 -3.35 117.00 116.97 2hc5 n LEU 103 Ca 0.06 0.07 0.05 0.00 -0.03 0.00 0.00 56.01 56.16 2hc5 n LEU 103 Cb 0.21 -0.20 0.07 0.00 -2.33 0.00 0.00 43.42 41.16 2hc5 n LEU 103 CO 0.17 0.07 0.46 0.49 -1.33 0.00 0.00 177.39 177.25 2hc5 n PHE 104 N -1.04 0.12 -3.77 -1.77 3.01 -0.50 -4.36 117.46 109.15 2hc5 n PHE 104 Ca 0.14 -0.16 -0.36 0.00 1.01 0.00 0.00 57.45 58.08 2hc5 n PHE 104 Cb 0.27 -0.01 -0.13 0.00 -0.01 0.00 0.00 39.48 39.60 2hc5 n PHE 104 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 2hc5 s VAL 105 N -0.83 4.20 0.00 -4.37 -7.23 -1.21 -4.56 120.40 106.40 2hc5 s VAL 105 Ca 0.13 -0.21 0.00 0.00 -1.81 0.00 0.00 61.98 60.09 2hc5 s VAL 105 Cb 0.08 -2.96 0.00 0.00 0.56 0.00 0.00 36.38 34.06 2hc5 s VAL 105 CO 0.12 0.35 0.00 -0.67 -0.31 0.00 0.00 175.10 174.59 2hc5 n ASP 106 N 4.91 0.00 0.00 4.85 2.03 -1.26 -3.57 116.55 123.51 2hc5 n ASP 106 Ca -0.16 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.15 2hc5 n ASP 106 Cb 0.51 -1.04 0.00 0.00 -0.72 0.00 0.00 41.12 39.87 2hc5 n ASP 106 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 2hc5 n GLU 107 N -2.00 0.00 0.21 -0.67 2.13 -1.26 -4.57 120.64 114.48 2hc5 n GLU 107 Ca 0.00 0.00 0.11 0.00 0.66 0.00 0.00 57.16 57.93 2hc5 n GLU 107 Cb 0.00 -0.17 0.68 0.00 0.27 0.00 0.00 31.44 32.22 2hc5 n GLU 107 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 2hc5 h LYS 108 N 0.00 0.00 -0.03 5.31 1.57 -1.95 0.55 116.57 122.02 2hc5 h LYS 108 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2hc5 h LYS 108 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2hc5 h LYS 108 CO 0.00 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.51 2hc5 n LYS 109 N -4.43 1.27 0.02 3.15 4.01 -1.23 -2.66 118.16 118.28 2hc5 n LYS 109 Ca -0.00 -0.39 0.14 0.00 -0.51 0.00 0.00 58.31 57.54 2hc5 n LYS 109 Cb 0.20 -1.41 0.57 0.00 -0.51 0.00 0.00 35.03 33.88 2hc5 n LYS 109 CO 0.00 0.00 0.00 -0.11 -1.11 0.00 0.00 177.40 176.18 2hc5 n LEU 110 N -0.46 0.16 0.00 -0.35 7.94 0.19 -4.32 117.00 120.16 2hc5 n LEU 110 Ca 0.18 0.52 0.00 0.00 -1.11 0.00 0.00 56.01 55.60 2hc5 n LEU 110 Cb 0.18 -0.46 0.00 0.00 0.53 0.00 0.00 43.42 43.67 2hc5 n LEU 110 CO 0.14 -0.04 0.00 1.21 -1.11 0.00 0.00 177.39 177.59 2hc5 n GLU 111 N -1.65 0.00 -1.86 1.96 2.13 -1.09 -3.61 120.64 116.52 2hc5 n GLU 111 Ca 0.07 0.00 -0.18 0.00 0.66 0.00 0.00 57.16 57.71 2hc5 n GLU 111 Cb 0.35 -2.46 -0.05 0.00 0.27 0.00 0.00 31.44 29.55 2hc5 n GLU 111 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 2hc5 n HIS 112 N -1.87 -0.36 1.11 4.31 8.25 -1.26 -4.85 115.22 120.55 2hc5 n HIS 112 Ca 0.00 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.58 2hc5 n HIS 112 Cb 0.00 -3.27 0.29 0.00 1.12 0.00 0.00 29.99 28.13 2hc5 n HIS 112 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2hc5 n HIS 113 N -3.12 0.00 -1.19 4.41 -0.00 -1.24 -5.04 115.22 109.04 2hc5 n HIS 113 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.53 2hc5 n HIS 113 Cb 0.62 -0.19 0.00 0.00 -0.00 0.00 0.00 29.99 30.42 2hc5 n HIS 113 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2hc5 n HIS 114 N -1.12 -2.62 -2.55 1.57 8.25 -1.26 -5.01 115.22 112.48 2hc5 n HIS 114 Ca 0.08 1.49 0.11 0.00 -0.26 0.00 0.00 57.72 59.15 2hc5 n HIS 114 Cb 0.34 -2.81 -0.03 0.00 1.12 0.00 0.00 29.99 28.62 2hc5 n HIS 114 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2hc5 n HIS 115 N 0.61 -2.85 -4.18 4.41 8.25 -1.26 -5.01 115.22 115.19 2hc5 n HIS 115 Ca 0.00 0.98 -0.16 0.00 -0.26 0.00 0.00 57.72 58.28 2hc5 n HIS 115 Cb 0.00 -1.73 -0.07 0.00 1.12 0.00 0.00 29.99 29.31 2hc5 n HIS 115 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2hc5 s HIS 116 N -1.30 1.33 0.00 4.41 -0.00 -1.26 -5.07 115.29 113.40 2hc5 s HIS 116 Ca 0.00 -1.43 0.00 0.00 -0.00 0.00 0.00 55.06 53.63 2hc5 s HIS 116 Cb 0.00 -0.40 0.00 0.00 -0.00 0.00 0.00 32.58 32.18 2hc5 s HIS 116 CO 0.00 -0.95 0.23 0.72 -0.00 0.00 0.00 174.74 174.74