#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 5.25 0.00 1.45 2.20 -1.26 -4.74 114.94 117.84 2hc5 s ASN 2 Ca 0.00 1.80 0.04 0.00 -0.94 0.00 0.00 52.86 53.76 2hc5 s ASN 2 Cb 0.00 -2.52 -0.03 0.00 -2.00 0.00 0.00 41.25 36.69 2hc5 s ASN 2 CO 0.00 -1.53 0.22 0.00 -2.94 0.00 0.00 177.10 172.85 2hc5 n ILE 3 N -2.75 0.00 0.27 0.54 3.06 -1.26 -4.62 119.36 114.60 2hc5 n ILE 3 Ca 0.09 -0.42 0.14 0.00 -2.50 0.00 0.00 62.75 60.06 2hc5 n ILE 3 Cb 0.53 1.01 0.79 0.00 0.54 0.00 0.00 39.64 42.51 2hc5 n ILE 3 CO 0.00 0.00 0.00 -0.33 -2.50 0.00 0.00 176.55 173.72 2hc5 h GLU 4 N 0.11 0.00 -0.29 9.51 3.07 -1.94 -2.07 114.58 122.97 2hc5 h GLU 4 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2hc5 h GLU 4 Cb 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.01 2hc5 h GLU 4 CO 0.00 0.09 0.00 0.54 -1.40 0.00 0.00 179.01 178.24 2hc5 n ARG 5 N -3.61 2.86 -2.11 2.33 1.74 -1.26 -4.05 116.66 112.56 2hc5 n ARG 5 Ca -0.02 -2.28 -0.34 0.00 -0.77 0.00 0.00 57.85 54.44 2hc5 n ARG 5 Cb 0.20 -1.44 -0.04 0.00 -1.02 0.00 0.00 32.46 30.16 2hc5 n ARG 5 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2hc5 s LEU 6 N -1.63 3.24 0.00 0.55 2.96 -0.78 -4.74 118.68 118.28 2hc5 s LEU 6 Ca 0.28 -0.21 0.17 0.00 -0.22 0.00 0.00 54.13 54.15 2hc5 s LEU 6 Cb 0.19 -2.55 0.33 0.00 0.50 0.00 0.00 46.19 44.66 2hc5 s LEU 6 CO 0.12 -2.43 1.25 0.35 -1.32 0.00 0.00 176.35 174.32 2hc5 n THR 7 N 7.39 0.58 -3.94 3.68 -2.24 -1.26 -1.46 114.28 117.02 2hc5 n THR 7 Ca 0.27 -0.79 -0.10 0.00 -2.27 0.00 0.00 64.05 61.17 2hc5 n THR 7 Cb 0.50 0.86 -0.11 0.00 -2.10 0.00 0.00 70.33 69.48 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 -1.19 0.10 -0.12 4.28 -1.32 -1.26 -4.74 115.64 111.39 2hc5 s THR 8 Ca 0.29 -0.80 0.14 0.00 -1.21 0.00 0.00 61.69 60.12 2hc5 s THR 8 Cb 0.17 -0.30 0.30 0.00 -1.51 0.00 0.00 72.50 71.16 2hc5 s THR 8 CO 0.23 -0.44 1.15 0.18 -2.21 0.00 0.00 174.62 173.53 2hc5 n LEU 9 N 1.64 1.92 -0.09 9.08 4.77 -1.26 -4.87 117.00 128.19 2hc5 n LEU 9 Ca -0.23 -2.86 -0.06 0.00 -0.03 0.00 0.00 56.01 52.83 2hc5 n LEU 9 Cb 0.55 -0.34 0.01 0.00 -2.33 0.00 0.00 43.42 41.31 2hc5 n LEU 9 CO 0.21 0.82 0.82 -0.61 -1.33 0.00 0.00 177.39 177.29 2hc5 h GLN 10 N 0.40 0.04 0.00 3.23 5.75 -1.99 0.12 115.11 122.67 2hc5 h GLN 10 Ca -0.03 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 2hc5 h GLN 10 Cb 1.17 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.71 2hc5 h GLN 10 CO 0.01 0.03 0.00 -1.35 -2.65 0.00 0.00 178.83 174.87 2hc5 h PRO 11 N 0.04 0.00 0.05 -2.39 0.11 -1.99 0.28 132.00 128.10 2hc5 h PRO 11 Ca 0.16 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.19 2hc5 h PRO 11 Cb 0.24 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.36 2hc5 h PRO 11 CO -0.32 0.00 -0.35 0.28 -0.21 0.00 0.00 178.00 177.41 2hc5 h VAL 12 N 0.00 1.65 -0.61 3.15 2.07 -1.20 -2.87 116.25 118.45 2hc5 h VAL 12 Ca 0.00 -2.35 0.00 0.00 0.82 0.00 0.00 66.70 65.17 2hc5 h VAL 12 Cb 0.04 3.22 -0.03 0.00 -1.52 0.00 0.00 31.29 33.00 2hc5 h VAL 12 CO 0.00 0.64 0.38 -0.50 0.02 0.00 0.00 177.57 178.11 2hc5 h TRP 13 N -0.68 0.78 -0.52 1.57 4.06 -0.15 0.42 115.95 121.44 2hc5 h TRP 13 Ca -0.06 0.01 0.06 0.00 2.06 0.00 0.00 58.89 60.96 2hc5 h TRP 13 Cb 1.24 -0.26 -0.05 0.00 -1.00 0.00 0.00 29.16 29.09 2hc5 h TRP 13 CO 0.23 0.52 0.22 0.22 -3.56 0.00 0.00 178.44 176.07 2hc5 h ASP 14 N 0.82 0.26 0.33 -3.49 1.82 -0.60 -1.67 116.42 113.89 2hc5 h ASP 14 Ca 0.22 0.05 -0.24 0.00 -0.39 0.00 0.00 57.03 56.67 2hc5 h ASP 14 Cb -0.06 0.01 0.01 0.00 0.68 0.00 0.00 39.33 39.97 2hc5 h ASP 14 CO -0.04 0.18 -1.01 -0.09 -1.61 0.00 0.00 179.24 176.66 2hc5 h ARG 15 N 0.42 0.43 -0.01 0.28 2.43 -1.23 -3.09 114.38 113.61 2hc5 h ARG 15 Ca 0.25 -0.50 0.02 0.00 -0.81 0.00 0.00 59.98 58.93 2hc5 h ARG 15 Cb 0.23 0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.90 2hc5 h ARG 15 CO -0.22 1.16 -0.12 -0.92 -1.51 0.00 0.00 179.97 178.36 2hc5 h TYR 16 N 0.23 -0.31 -0.57 2.20 3.20 0.19 -1.47 116.97 120.43 2hc5 h TYR 16 Ca -0.10 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.73 2hc5 h TYR 16 Cb 1.66 0.14 -0.03 0.00 1.54 0.00 0.00 36.73 40.05 2hc5 h TYR 16 CO 0.07 -0.18 0.15 0.22 -1.64 0.00 0.00 178.16 176.77 2hc5 h ASP 17 N -0.20 0.81 0.87 -2.11 3.58 -1.39 0.18 116.42 118.16 2hc5 h ASP 17 Ca 0.05 -0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.36 2hc5 h ASP 17 Cb 0.26 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.10 2hc5 h ASP 17 CO -0.13 0.79 0.00 0.35 -2.88 0.00 0.00 179.24 177.36 2hc5 n THR 18 N -4.27 0.22 -0.10 2.25 -2.24 -0.98 -2.20 114.28 106.95 2hc5 n THR 18 Ca 0.04 0.05 -0.15 0.00 -2.27 0.00 0.00 64.05 61.73 2hc5 n THR 18 Cb 0.22 -0.61 -0.09 0.00 -2.10 0.00 0.00 70.33 67.76 2hc5 n THR 18 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2hc5 n GLN 19 N -1.49 0.48 -0.12 -0.78 6.02 -0.59 -4.42 117.38 116.47 2hc5 n GLN 19 Ca 0.07 0.12 0.09 0.00 -0.01 0.00 0.00 57.00 57.27 2hc5 n GLN 19 Cb 0.30 -1.37 0.43 0.00 1.02 0.00 0.00 30.24 30.63 2hc5 n GLN 19 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 2hc5 h ILE 20 N -0.09 0.96 -0.01 5.09 1.08 -0.69 -1.01 117.51 122.84 2hc5 h ILE 20 Ca -0.44 -0.19 0.00 0.00 -0.39 0.00 0.00 64.86 63.83 2hc5 h ILE 20 Cb 1.64 0.35 0.00 0.00 -3.07 0.00 0.00 36.82 35.74 2hc5 h ILE 20 CO -0.10 0.10 0.00 0.00 -0.69 0.00 0.00 178.15 177.46 2hc5 n HIS 21 N -4.48 0.00 -3.10 1.37 1.44 -0.94 -4.35 115.22 105.17 2hc5 n HIS 21 Ca 0.10 -0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.64 2hc5 n HIS 21 Cb 0.29 0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.35 2hc5 n HIS 21 CO 0.00 0.00 0.00 -1.71 -2.81 0.00 0.00 176.34 171.82 2hc5 n ASN 22 N -0.68 -1.78 -4.31 4.39 2.85 -0.38 -5.09 115.26 110.25 2hc5 n ASN 22 Ca 0.22 -2.64 -0.30 0.00 -0.11 0.00 0.00 54.58 51.75 2hc5 n ASN 22 Cb 0.17 0.48 -0.16 0.00 1.24 0.00 0.00 39.78 41.52 2hc5 n ASN 22 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2hc5 s GLN 23 N 0.37 1.97 0.00 1.20 -2.07 -1.24 -4.84 119.66 115.05 2hc5 s GLN 23 Ca 0.32 -0.97 0.00 0.00 -1.82 0.00 0.00 55.36 52.89 2hc5 s GLN 23 Cb 0.03 -1.98 0.00 0.00 -1.09 0.00 0.00 33.01 29.98 2hc5 s GLN 23 CO -0.14 0.53 0.00 0.36 -1.32 0.00 0.00 175.29 174.73 2hc5 n LYS 24 N 2.25 0.00 -0.11 9.60 2.85 -1.26 -5.08 118.16 126.40 2hc5 n LYS 24 Ca -0.16 0.00 -0.21 0.00 -1.05 0.00 0.00 58.31 56.89 2hc5 n LYS 24 Cb 0.51 0.00 -0.08 0.00 -0.65 0.00 0.00 35.03 34.82 2hc5 n LYS 24 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2hc5 n ASP 25 N 0.00 1.92 -4.15 -5.58 2.03 -1.26 -4.69 116.55 104.83 2hc5 n ASP 25 Ca 0.00 0.38 -0.39 0.00 0.52 0.00 0.00 54.79 55.30 2hc5 n ASP 25 Cb 0.00 -0.83 -0.07 0.00 -0.72 0.00 0.00 41.12 39.50 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 -6.80 5.75 0.00 1.67 2.47 -1.26 -4.65 114.94 112.12 2hc5 s ASN 26 Ca -0.32 -3.03 -0.00 0.00 0.42 0.00 0.00 52.86 49.93 2hc5 s ASN 26 Cb 0.09 -1.95 -0.00 0.00 -1.45 0.00 0.00 41.25 37.95 2hc5 s ASN 26 CO 0.46 -0.37 0.74 0.44 -3.72 0.00 0.00 177.10 174.66 2hc5 h ASP 27 N 6.95 -0.00 0.00 -4.21 3.32 -1.83 -3.49 116.42 117.15 2hc5 h ASP 27 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2hc5 h ASP 27 Cb 0.94 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.49 2hc5 h ASP 27 CO 0.76 -0.00 0.00 -3.20 -1.72 0.00 0.00 179.24 175.07 2hc5 n ASN 28 N -2.01 0.00 -0.63 6.45 5.15 -1.26 -4.97 115.26 117.99 2hc5 n ASN 28 Ca -0.00 0.00 0.13 0.00 -0.60 0.00 0.00 54.58 54.11 2hc5 n ASN 28 Cb 0.00 0.00 0.31 0.00 -0.53 0.00 0.00 39.78 39.56 2hc5 n ASN 28 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2hc5 n GLU 29 N 0.00 1.78 -3.57 1.20 1.02 -1.26 -4.74 120.64 115.07 2hc5 n GLU 29 Ca 0.00 -1.27 -0.11 0.00 -0.02 0.00 0.00 57.16 55.76 2hc5 n GLU 29 Cb 0.00 -1.47 -0.10 0.00 -0.02 0.00 0.00 31.44 29.84 2hc5 n GLU 29 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2hc5 s VAL 30 N -2.09 -0.55 0.49 2.62 0.11 -1.26 -5.16 120.40 114.55 2hc5 s VAL 30 Ca 0.31 0.12 -0.12 0.00 -2.93 0.00 0.00 61.98 59.36 2hc5 s VAL 30 Cb 0.20 -0.65 -0.06 0.00 -1.53 0.00 0.00 36.38 34.34 2hc5 s VAL 30 CO 0.36 0.01 0.89 -2.16 -3.33 0.00 0.00 175.10 170.87 2hc5 s PRO 31 N 2.52 3.78 -0.57 1.54 0.04 -1.26 -4.58 135.00 136.48 2hc5 s PRO 31 Ca 0.04 0.65 -0.27 0.00 0.04 0.00 0.00 61.00 61.46 2hc5 s PRO 31 Cb -0.13 -2.25 0.03 0.00 0.04 0.00 0.00 34.50 32.19 2hc5 s PRO 31 CO -0.12 -0.23 1.10 0.08 0.04 0.00 0.00 177.00 177.87 2hc5 s VAL 32 N -2.64 4.16 0.30 -0.36 1.01 -1.26 -4.94 120.40 116.67 2hc5 s VAL 32 Ca 0.54 0.68 -0.19 0.00 0.00 0.00 0.00 61.98 63.02 2hc5 s VAL 32 Cb -0.10 -4.65 0.06 0.00 0.00 0.00 0.00 36.38 31.69 2hc5 s VAL 32 CO 0.37 -1.25 0.89 -1.38 0.00 0.00 0.00 175.10 173.73 2hc5 s HIS 33 N 4.56 0.09 0.00 5.22 -3.43 -1.26 -5.07 115.29 115.41 2hc5 s HIS 33 Ca 0.38 -0.65 0.00 0.00 -0.80 0.00 0.00 55.06 54.00 2hc5 s HIS 33 Cb -0.09 0.78 0.00 0.00 -1.43 0.00 0.00 32.58 31.84 2hc5 s HIS 33 CO 0.23 -1.29 0.00 1.04 -2.00 0.00 0.00 174.74 172.72 2hc5 n GLN 34 N -0.60 0.00 -0.59 -0.38 6.02 -1.26 -5.04 117.38 115.54 2hc5 n GLN 34 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.93 2hc5 n GLN 34 Cb 0.60 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.86 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 -0.18 -1.37 -3.52 5.09 0.31 -1.26 -5.12 118.33 112.29 2hc5 n VAL 35 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.28 2hc5 n VAL 35 Cb 0.00 -1.86 0.00 0.00 -0.91 0.00 0.00 33.84 31.07 2hc5 n VAL 35 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2hc5 n SER 36 N 0.00 1.26 0.11 4.52 7.64 -1.26 -4.99 113.62 120.91 2hc5 n SER 36 Ca 0.00 -1.39 -0.13 0.00 1.01 0.00 0.00 58.87 58.37 2hc5 n SER 36 Cb 0.00 -0.02 -0.06 0.00 -1.01 0.00 0.00 64.21 63.13 2hc5 n SER 36 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2hc5 h TYR 37 N 0.48 -0.54 -0.09 1.43 3.20 -2.02 -2.64 116.97 116.78 2hc5 h TYR 37 Ca -0.07 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.69 2hc5 h TYR 37 Cb 0.26 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 2hc5 h TYR 37 CO 0.00 -0.30 -0.45 1.15 -1.64 0.00 0.00 178.16 176.92 2hc5 h THR 38 N -0.40 1.33 -0.53 1.81 2.02 -2.01 -3.11 112.91 112.01 2hc5 h THR 38 Ca 0.02 -1.62 0.01 0.00 0.77 0.00 0.00 66.41 65.59 2hc5 h THR 38 Cb 0.41 1.76 -0.03 0.00 -1.74 0.00 0.00 68.15 68.55 2hc5 h THR 38 CO -0.10 0.48 0.35 0.78 0.37 0.00 0.00 175.52 177.40 2hc5 h ASN 39 N 0.18 0.60 0.03 4.18 -0.26 -1.86 -0.64 115.58 117.82 2hc5 h ASN 39 Ca 0.01 -0.01 0.03 0.00 -0.56 0.00 0.00 56.30 55.76 2hc5 h ASN 39 Cb 0.87 -0.15 -0.04 0.00 -1.06 0.00 0.00 38.32 37.95 2hc5 h ASN 39 CO 0.07 0.43 -0.22 -0.07 -1.06 0.00 0.00 177.43 176.58 2hc5 h LEU 40 N 0.71 -0.64 -0.81 1.61 3.38 -1.44 0.47 115.31 118.59 2hc5 h LEU 40 Ca 0.19 0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.21 2hc5 h LEU 40 Cb -0.07 0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 2hc5 h LEU 40 CO -0.04 -0.29 0.35 0.00 0.09 0.00 0.00 178.44 178.55 2hc5 h ALA 41 N 0.48 1.05 -0.36 1.53 0.00 -1.46 -0.22 119.26 120.29 2hc5 h ALA 41 Ca 0.05 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.80 2hc5 h ALA 41 Cb 0.43 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2hc5 h ALA 41 CO -0.18 0.66 0.18 0.93 0.00 0.00 0.00 179.25 180.84 2hc5 h GLU 42 N 1.18 0.36 -0.00 0.00 4.39 -0.75 0.31 114.58 120.07 2hc5 h GLU 42 Ca 0.27 -0.02 -0.13 0.00 0.34 0.00 0.00 59.36 59.83 2hc5 h GLU 42 Cb 0.18 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.73 2hc5 h GLU 42 CO -0.03 0.24 -0.60 0.52 -1.16 0.00 0.00 179.01 177.99 2hc5 h MET 43 N 0.37 0.00 -0.80 2.33 2.86 -0.60 -2.11 114.93 116.98 2hc5 h MET 43 Ca 0.15 -0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.74 2hc5 h MET 43 Cb 0.05 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.68 2hc5 h MET 43 CO -0.10 0.60 0.33 0.28 1.06 0.00 0.00 176.91 179.08 2hc5 h VAL 44 N 0.00 1.26 -0.62 -2.22 2.07 -0.54 0.12 116.25 116.32 2hc5 h VAL 44 Ca -0.01 -0.80 -0.02 0.00 0.82 0.00 0.00 66.70 66.69 2hc5 h VAL 44 Cb 1.05 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 2hc5 h VAL 44 CO 0.08 0.33 0.30 1.23 0.02 0.00 0.00 177.57 179.53 2hc5 h GLY 45 N 1.17 0.95 2.00 2.17 0.00 -0.32 -1.13 103.07 107.91 2hc5 h GLY 45 Ca 0.27 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 47.13 2hc5 h GLY 45 CO -0.02 0.45 0.00 1.05 0.00 0.00 0.00 176.54 178.01 2hc5 h GLU 46 N 0.85 0.00 -0.32 4.80 4.11 -1.23 -2.68 114.58 120.11 2hc5 h GLU 46 Ca 0.21 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.55 2hc5 h GLU 46 Cb 0.11 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2hc5 h GLU 46 CO -0.03 0.00 -0.18 1.98 0.07 0.00 0.00 179.01 180.85 2hc5 h MET 47 N 0.00 0.58 -0.63 1.06 4.05 -0.20 -3.08 114.93 116.71 2hc5 h MET 47 Ca 0.00 -0.20 -0.07 0.00 -0.28 0.00 0.00 59.70 59.15 2hc5 h MET 47 Cb 0.95 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.68 2hc5 h MET 47 CO 0.00 0.73 0.11 -0.91 0.23 0.00 0.00 176.91 177.08 2hc5 h ASN 48 N 0.52 0.99 1.01 1.39 -0.26 -0.87 -2.77 115.58 115.58 2hc5 h ASN 48 Ca 0.08 -0.26 0.00 0.00 -0.56 0.00 0.00 56.30 55.57 2hc5 h ASN 48 Cb 0.61 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 37.61 2hc5 h ASN 48 CO 0.04 0.99 0.00 0.07 -1.06 0.00 0.00 177.43 177.48 2hc5 h LYS 49 N 0.95 0.00 0.00 0.81 5.09 -1.47 0.75 116.57 122.70 2hc5 h LYS 49 Ca 0.19 0.00 -0.20 0.00 0.09 0.00 0.00 60.65 60.74 2hc5 h LYS 49 Cb 0.42 0.00 -0.03 0.00 0.10 0.00 0.00 32.23 32.72 2hc5 h LYS 49 CO 0.01 0.00 -1.03 -0.07 -2.09 0.00 0.00 179.45 176.27 2hc5 h LEU 50 N 0.00 0.00 -3.15 7.07 3.38 -1.42 -3.28 115.31 117.91 2hc5 h LEU 50 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2hc5 h LEU 50 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2hc5 h LEU 50 CO 0.00 0.86 0.00 0.18 0.09 0.00 0.00 178.44 179.57 2hc5 n LEU 51 N -3.25 3.44 0.42 1.67 4.77 -0.98 -4.77 117.00 118.30 2hc5 n LEU 51 Ca -0.03 -2.81 -0.19 0.00 -0.03 0.00 0.00 56.01 52.95 2hc5 n LEU 51 Cb 0.91 -0.45 -0.09 0.00 -2.33 0.00 0.00 43.42 41.45 2hc5 n LEU 51 CO 0.45 0.68 0.60 -0.08 -1.33 0.00 0.00 177.39 177.71 2hc5 h GLU 52 N 1.53 -1.00 -0.05 3.23 4.22 -0.92 -2.89 114.58 118.70 2hc5 h GLU 52 Ca 0.00 0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.51 2hc5 h GLU 52 Cb 1.23 0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.70 2hc5 h GLU 52 CO 0.15 -0.66 0.00 -0.35 -2.18 0.00 0.00 179.01 175.96 2hc5 n PRO 53 N -5.53 1.43 -2.30 0.92 -0.05 -1.26 -4.91 135.00 123.30 2hc5 n PRO 53 Ca -0.14 -0.63 -0.32 0.00 -0.05 0.00 0.00 63.50 62.35 2hc5 n PRO 53 Cb 0.42 -1.42 -0.02 0.00 -0.05 0.00 0.00 33.50 32.43 2hc5 n PRO 53 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 175.50 175.90 2hc5 s SER 54 N -1.79 6.34 0.29 3.54 0.15 -1.09 -3.74 113.70 117.40 2hc5 s SER 54 Ca 0.36 1.67 0.23 0.00 0.70 0.00 0.00 55.95 58.92 2hc5 s SER 54 Cb 0.19 -2.52 0.27 0.00 -1.71 0.00 0.00 66.02 62.24 2hc5 s SER 54 CO 0.30 -0.78 1.39 -0.61 1.20 0.00 0.00 173.24 174.73 2hc5 h GLN 55 N 0.82 0.00 -0.63 5.44 5.75 -1.39 -3.34 115.11 121.75 2hc5 h GLN 55 Ca -0.47 0.00 0.05 0.00 -0.15 0.00 0.00 58.65 58.08 2hc5 h GLN 55 Cb 1.20 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.71 2hc5 h GLN 55 CO 0.60 0.00 0.42 -0.39 -2.65 0.00 0.00 178.83 176.81 2hc5 h VAL 56 N 0.00 1.05 -5.65 2.39 -1.51 -1.76 -3.47 116.25 107.30 2hc5 h VAL 56 Ca 0.00 -0.24 -0.10 0.00 -1.23 0.00 0.00 66.70 65.13 2hc5 h VAL 56 Cb 0.94 0.30 0.00 0.00 -2.13 0.00 0.00 31.29 30.40 2hc5 h VAL 56 CO 0.00 0.13 -0.39 1.41 -1.23 0.00 0.00 177.57 177.49 2hc5 n HIS 57 N -4.47 -2.96 -3.99 5.19 8.25 -1.26 -4.32 115.22 111.68 2hc5 n HIS 57 Ca 0.08 1.16 -0.35 0.00 -0.26 0.00 0.00 57.72 58.36 2hc5 n HIS 57 Cb 0.18 -3.73 -0.09 0.00 1.12 0.00 0.00 29.99 27.47 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 -3.67 3.91 -0.05 2.41 1.02 -1.26 -0.21 118.68 120.83 2hc5 s LEU 58 Ca 0.09 0.15 0.04 0.00 0.02 0.00 0.00 54.13 54.43 2hc5 s LEU 58 Cb -0.02 -1.98 -0.02 0.00 0.02 0.00 0.00 46.19 44.19 2hc5 s LEU 58 CO 0.79 0.21 -0.17 -0.54 0.02 0.00 0.00 176.35 176.67 2hc5 s LYS 59 N 0.13 2.51 -0.06 1.70 1.02 0.86 -4.95 119.74 120.96 2hc5 s LYS 59 Ca 0.06 -0.74 0.05 0.00 0.02 0.00 0.00 55.97 55.35 2hc5 s LYS 59 Cb -0.12 -2.33 -0.01 0.00 -0.52 0.00 0.00 37.83 34.85 2hc5 s LYS 59 CO 0.00 0.57 -0.21 -0.06 -0.92 0.00 0.00 175.35 174.73 2hc5 s PHE 60 N -0.60 2.08 -0.04 3.18 0.08 -1.26 0.02 117.98 121.45 2hc5 s PHE 60 Ca 0.09 -0.64 0.04 0.00 0.12 0.00 0.00 56.93 56.53 2hc5 s PHE 60 Cb -0.11 -1.39 -0.00 0.00 -0.57 0.00 0.00 43.02 40.95 2hc5 s PHE 60 CO 0.01 -0.22 -0.15 -1.21 -0.10 0.00 0.00 175.22 173.55 2hc5 s GLU 61 N 0.01 1.52 -0.86 0.44 2.02 -0.85 -4.96 118.70 116.02 2hc5 s GLU 61 Ca -0.06 -0.52 -0.17 0.00 0.02 0.00 0.00 54.97 54.24 2hc5 s GLU 61 Cb -0.13 -1.35 0.15 0.00 0.10 0.00 0.00 34.13 32.90 2hc5 s GLU 61 CO 0.04 0.22 0.97 -1.17 0.02 0.00 0.00 175.26 175.34 2hc5 s LEU 62 N 0.04 5.59 -0.15 1.80 2.96 -1.26 -0.67 118.68 126.99 2hc5 s LEU 62 Ca -0.03 -2.16 -0.10 0.00 -0.22 0.00 0.00 54.13 51.63 2hc5 s LEU 62 Cb -0.10 -2.33 -0.05 0.00 0.50 0.00 0.00 46.19 44.21 2hc5 s LEU 62 CO 0.01 -0.93 0.18 -1.00 -1.32 0.00 0.00 176.35 173.29 2hc5 s HIS 63 N 1.95 3.52 -0.03 5.38 3.76 -1.16 -4.93 115.29 123.79 2hc5 s HIS 63 Ca 0.26 0.50 -0.19 0.00 -0.15 0.00 0.00 55.06 55.48 2hc5 s HIS 63 Cb -0.08 -2.10 -0.05 0.00 1.11 0.00 0.00 32.58 31.45 2hc5 s HIS 63 CO -0.07 0.50 0.55 0.16 -0.85 0.00 0.00 174.74 175.02 2hc5 s ASP 64 N -0.32 6.89 0.00 1.40 -4.77 -1.26 -3.24 116.67 115.37 2hc5 s ASP 64 Ca 0.13 1.06 0.00 0.00 -3.30 0.00 0.00 52.55 50.45 2hc5 s ASP 64 Cb -0.12 -2.33 0.00 0.00 -1.09 0.00 0.00 42.92 39.37 2hc5 s ASP 64 CO 0.03 0.10 0.00 1.17 0.70 0.00 0.00 175.17 177.17 2hc5 n LYS 65 N 2.83 0.00 -0.12 2.11 4.81 0.24 -4.99 118.16 123.03 2hc5 n LYS 65 Ca -0.08 0.00 -0.26 0.00 -0.87 0.00 0.00 58.31 57.10 2hc5 n LYS 65 Cb 0.51 0.00 -0.09 0.00 0.02 0.00 0.00 35.03 35.47 2hc5 n LYS 65 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2hc5 n LEU 66 N 0.00 1.78 0.00 3.14 7.94 -1.26 -4.81 117.00 123.79 2hc5 n LEU 66 Ca 0.00 0.29 0.00 0.00 -1.11 0.00 0.00 56.01 55.19 2hc5 n LEU 66 Cb 0.00 -0.73 0.00 0.00 0.53 0.00 0.00 43.42 43.22 2hc5 n LEU 66 CO 0.00 0.53 0.12 -3.20 -1.11 0.00 0.00 177.39 173.73 2hc5 n ASN 67 N -4.07 0.00 -4.54 1.96 5.15 -1.26 -5.12 115.26 107.37 2hc5 n ASN 67 Ca -0.48 -1.00 -0.25 0.00 -0.60 0.00 0.00 54.58 52.24 2hc5 n ASN 67 Cb 0.85 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 40.00 2hc5 n ASN 67 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2hc5 s GLU 68 N 0.00 1.84 0.01 1.20 8.01 -1.26 -5.15 118.70 123.35 2hc5 s GLU 68 Ca 0.00 -1.86 0.02 0.00 0.01 0.00 0.00 54.97 53.14 2hc5 s GLU 68 Cb 0.00 -1.76 -0.01 0.00 -4.31 0.00 0.00 34.13 28.04 2hc5 s GLU 68 CO 0.00 0.19 -0.07 1.52 0.01 0.00 0.00 175.26 176.91 2hc5 s TYR 69 N -2.57 0.62 0.26 1.61 -0.85 -1.26 -0.60 117.35 114.57 2hc5 s TYR 69 Ca 0.32 -0.23 -0.18 0.00 -0.52 0.00 0.00 57.07 56.46 2hc5 s TYR 69 Cb 0.00 -0.39 0.01 0.00 0.38 0.00 0.00 41.96 41.97 2hc5 s TYR 69 CO 0.17 -0.03 0.63 1.52 -1.52 0.00 0.00 175.55 176.32 2hc5 s TYR 70 N -0.53 -0.01 -0.43 -3.49 -0.85 -1.20 -4.35 117.35 106.49 2hc5 s TYR 70 Ca -0.01 -0.41 -0.16 0.00 -0.52 0.00 0.00 57.07 55.97 2hc5 s TYR 70 Cb -0.05 0.53 0.03 0.00 0.38 0.00 0.00 41.96 42.85 2hc5 s TYR 70 CO 0.00 -1.14 0.39 0.08 -1.52 0.00 0.00 175.55 173.36 2hc5 s VAL 71 N -3.95 5.16 -0.11 -3.49 1.01 -0.01 -2.98 120.40 116.03 2hc5 s VAL 71 Ca 0.15 -0.56 -0.30 0.00 0.00 0.00 0.00 61.98 61.27 2hc5 s VAL 71 Cb -0.04 -4.03 -0.01 0.00 0.00 0.00 0.00 36.38 32.30 2hc5 s VAL 71 CO 0.07 -0.42 1.08 -0.54 0.00 0.00 0.00 175.10 175.28 2hc5 s LYS 72 N 1.93 4.37 -0.34 2.72 1.02 0.15 -0.18 119.74 129.43 2hc5 s LYS 72 Ca 0.09 1.48 -0.15 0.00 0.02 0.00 0.00 55.97 57.40 2hc5 s LYS 72 Cb -0.19 -3.57 -0.01 0.00 -0.52 0.00 0.00 37.83 33.54 2hc5 s LYS 72 CO 0.11 -0.41 0.36 0.08 -0.92 0.00 0.00 175.35 174.58 2hc5 s VAL 73 N 2.30 5.17 -0.30 3.17 1.01 0.11 -2.01 120.40 129.84 2hc5 s VAL 73 Ca 0.50 0.09 -0.04 0.00 0.00 0.00 0.00 61.98 62.53 2hc5 s VAL 73 Cb -0.20 -3.81 0.03 0.00 0.00 0.00 0.00 36.38 32.40 2hc5 s VAL 73 CO 0.17 -0.08 0.04 -0.63 0.00 0.00 0.00 175.10 174.61 2hc5 s ILE 74 N 2.03 3.43 -0.34 2.22 1.01 0.10 -1.44 121.20 128.20 2hc5 s ILE 74 Ca 0.12 -1.11 -0.29 0.00 0.00 0.00 0.00 60.65 59.38 2hc5 s ILE 74 Cb -0.16 -2.88 0.01 0.00 0.01 0.00 0.00 42.46 39.44 2hc5 s ILE 74 CO 0.12 -0.04 1.17 -0.70 0.00 0.00 0.00 174.94 175.48 2hc5 s GLU 75 N 1.36 3.94 0.55 2.79 2.12 -1.16 -0.09 118.70 128.21 2hc5 s GLU 75 Ca -0.02 1.03 0.29 0.00 0.36 0.00 0.00 54.97 56.64 2hc5 s GLU 75 Cb -0.19 -3.82 1.63 0.00 0.26 0.00 0.00 34.13 32.01 2hc5 s GLU 75 CO 0.00 -1.07 2.15 0.22 -0.54 0.00 0.00 175.26 176.02 2hc5 h ASP 76 N 8.74 0.00 0.17 -1.70 3.58 -0.80 1.24 116.42 127.67 2hc5 h ASP 76 Ca -0.23 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.18 2hc5 h ASP 76 Cb 1.07 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.12 2hc5 h ASP 76 CO 1.05 0.07 -0.18 0.28 -2.88 0.00 0.00 179.24 177.58 2hc5 h SER 77 N 0.00 0.01 0.00 2.28 0.02 -1.75 -3.13 113.55 110.98 2hc5 h SER 77 Ca -0.00 -0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 2hc5 h SER 77 Cb 0.20 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 2hc5 h SER 77 CO 0.01 0.19 -1.48 0.35 -1.14 0.00 0.00 176.83 174.76 2hc5 n THR 78 N -4.32 0.29 -3.45 -2.27 -2.24 -0.53 -5.03 114.28 96.72 2hc5 n THR 78 Ca -0.02 -0.27 -0.21 0.00 -2.27 0.00 0.00 64.05 61.28 2hc5 n THR 78 Cb 0.24 -0.28 0.07 0.00 -2.10 0.00 0.00 70.33 68.27 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 -2.06 -5.48 -4.21 3.42 3.02 0.42 -5.03 115.26 105.33 2hc5 n ASN 79 Ca -0.08 -0.49 -0.13 0.00 -0.03 0.00 0.00 54.58 53.86 2hc5 n ASN 79 Cb 0.51 -4.54 -0.10 0.00 -0.61 0.00 0.00 39.78 35.04 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 -6.06 0.98 -0.77 3.52 -1.05 -1.24 -4.99 118.70 109.09 2hc5 s GLU 80 Ca 0.46 -1.42 -0.26 0.00 -0.15 0.00 0.00 54.97 53.60 2hc5 s GLU 80 Cb -0.20 -0.36 0.03 0.00 -0.44 0.00 0.00 34.13 33.15 2hc5 s GLU 80 CO 0.65 -0.01 1.35 0.08 0.95 0.00 0.00 175.26 178.27 2hc5 s VAL 81 N -3.53 3.72 -0.15 1.83 1.01 -1.26 -3.00 120.40 119.02 2hc5 s VAL 81 Ca 0.16 0.25 0.22 0.00 0.00 0.00 0.00 61.98 62.61 2hc5 s VAL 81 Cb 0.05 -4.86 0.23 0.00 0.00 0.00 0.00 36.38 31.80 2hc5 s VAL 81 CO -0.01 -1.80 1.65 0.16 0.00 0.00 0.00 175.10 175.11 2hc5 h ILE 82 N 6.19 0.41 -2.32 2.22 3.07 -1.64 -3.47 117.51 121.97 2hc5 h ILE 82 Ca -0.22 -1.37 0.04 0.00 1.55 0.00 0.00 64.86 64.87 2hc5 h ILE 82 Cb 1.05 2.02 -0.16 0.00 -0.27 0.00 0.00 36.82 39.47 2hc5 h ILE 82 CO 1.29 0.21 0.38 0.00 -1.05 0.00 0.00 178.15 178.98 2hc5 s ARG 83 N -3.29 0.95 -0.28 0.16 1.70 -1.21 -5.03 118.95 111.96 2hc5 s ARG 83 Ca 0.04 -0.19 0.02 0.00 -0.47 0.00 0.00 55.73 55.12 2hc5 s ARG 83 Cb 0.08 0.44 0.08 0.00 -0.57 0.00 0.00 34.95 34.97 2hc5 s ARG 83 CO 0.67 -0.38 -0.01 -1.21 -1.08 0.00 0.00 175.30 173.29 2hc5 s GLU 84 N -2.69 1.52 -0.28 3.89 2.02 -1.26 0.04 118.70 121.94 2hc5 s GLU 84 Ca 0.00 -1.28 -0.23 0.00 0.02 0.00 0.00 54.97 53.48 2hc5 s GLU 84 Cb -0.01 -2.69 -0.00 0.00 0.10 0.00 0.00 34.13 31.53 2hc5 s GLU 84 CO -0.06 -0.74 0.77 0.42 0.02 0.00 0.00 175.26 175.68 2hc5 s ILE 85 N 1.27 4.83 0.49 -1.63 1.01 0.75 -4.88 121.20 123.04 2hc5 s ILE 85 Ca 0.01 1.27 -0.22 0.00 0.00 0.00 0.00 60.65 61.71 2hc5 s ILE 85 Cb -0.19 -4.11 -0.07 0.00 0.01 0.00 0.00 42.46 38.10 2hc5 s ILE 85 CO -0.09 -0.17 1.14 -2.16 0.00 0.00 0.00 174.94 173.66 2hc5 s PRO 86 N 2.86 3.64 0.61 2.79 0.04 -1.26 -0.83 135.00 142.86 2hc5 s PRO 86 Ca 0.32 1.67 0.31 0.00 0.04 0.00 0.00 61.00 63.34 2hc5 s PRO 86 Cb -0.15 -2.25 1.74 0.00 0.04 0.00 0.00 34.50 33.88 2hc5 s PRO 86 CO 0.11 -0.62 2.08 -1.00 0.04 0.00 0.00 177.00 177.60 2hc5 h PRO 87 N 1.74 0.00 -0.00 0.56 0.13 -1.97 0.96 132.00 133.43 2hc5 h PRO 87 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2hc5 h PRO 87 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2hc5 h PRO 87 CO 0.59 0.00 -0.20 0.36 -0.23 0.00 0.00 178.00 178.52 2hc5 n LYS 88 N -3.53 0.25 0.00 0.86 2.85 -1.26 -2.79 118.16 114.54 2hc5 n LYS 88 Ca 0.01 -0.09 0.05 0.00 -1.05 0.00 0.00 58.31 57.23 2hc5 n LYS 88 Cb 0.33 -1.50 0.02 0.00 -0.65 0.00 0.00 35.03 33.24 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 -1.30 1.32 -0.09 -1.58 1.74 0.27 -4.60 116.66 112.43 2hc5 n ARG 89 Ca 0.09 -0.85 -0.07 0.00 -0.77 0.00 0.00 57.85 56.25 2hc5 n ARG 89 Cb 0.32 -1.14 0.09 0.00 -1.02 0.00 0.00 32.46 30.72 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 1.55 0.87 -0.64 -1.55 2.91 -1.22 -1.40 115.95 116.48 2hc5 h TRP 90 Ca 0.00 -0.19 -0.06 0.00 1.13 0.00 0.00 58.89 59.77 2hc5 h TRP 90 Cb 0.38 -0.21 -0.03 0.00 -0.51 0.00 0.00 29.16 28.80 2hc5 h TRP 90 CO 0.00 0.91 0.17 -0.07 -1.03 0.00 0.00 178.44 178.42 2hc5 h LEU 91 N 0.68 0.95 -0.31 0.65 -0.00 -1.82 0.24 115.31 115.71 2hc5 h LEU 91 Ca 0.10 -0.22 -0.00 0.00 -0.00 0.00 0.00 57.88 57.75 2hc5 h LEU 91 Cb 0.72 -0.25 -0.01 0.00 -0.00 0.00 0.00 40.66 41.11 2hc5 h LEU 91 CO 0.06 0.93 0.17 0.44 -0.00 0.00 0.00 178.44 180.03 2hc5 h ASP 92 N 0.93 0.38 -0.73 -0.43 5.19 -1.80 -2.39 116.42 117.57 2hc5 h ASP 92 Ca 0.20 -0.08 -0.01 0.00 -0.62 0.00 0.00 57.03 56.52 2hc5 h ASP 92 Cb 0.34 -0.10 -0.03 0.00 0.18 0.00 0.00 39.33 39.71 2hc5 h ASP 92 CO -0.00 0.35 0.40 0.15 -3.12 0.00 0.00 179.24 177.01 2hc5 h PHE 93 N 0.38 1.00 -0.70 4.55 3.57 -0.81 -1.58 116.94 123.35 2hc5 h PHE 93 Ca 0.11 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.65 2hc5 h PHE 93 Cb 0.05 -0.32 -0.06 0.00 2.79 0.00 0.00 35.95 38.41 2hc5 h PHE 93 CO -0.03 0.71 0.39 -0.92 -2.23 0.00 0.00 178.31 176.22 2hc5 h TYR 94 N 1.00 0.72 0.19 0.41 3.20 -0.28 -1.02 116.97 121.19 2hc5 h TYR 94 Ca 0.26 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 2hc5 h TYR 94 Cb 0.04 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.09 2hc5 h TYR 94 CO -0.00 0.34 -0.09 0.00 -1.64 0.00 0.00 178.16 176.77 2hc5 h ALA 95 N 1.36 -0.25 -0.99 1.82 0.00 -1.08 -2.66 119.26 117.47 2hc5 h ALA 95 Ca 0.31 -0.17 0.17 0.00 0.00 0.00 0.00 54.91 55.22 2hc5 h ALA 95 Cb 0.20 0.10 -0.10 0.00 0.00 0.00 0.00 17.79 17.99 2hc5 h ALA 95 CO -0.19 -0.49 0.60 0.00 0.00 0.00 0.00 179.25 179.17 2hc5 h ALA 96 N 0.16 1.59 0.10 0.00 0.00 -0.96 -0.69 119.26 119.45 2hc5 h ALA 96 Ca -0.03 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 2hc5 h ALA 96 Cb 0.42 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2hc5 h ALA 96 CO 0.04 0.01 -0.05 1.98 0.00 0.00 0.00 179.25 181.24 2hc5 h MET 97 N 0.81 -0.12 0.00 0.00 -1.53 -1.18 -3.13 114.93 109.78 2hc5 h MET 97 Ca 0.55 0.01 -0.06 0.00 -3.44 0.00 0.00 59.70 56.76 2hc5 h MET 97 Cb 0.77 0.03 -0.01 0.00 -0.55 0.00 0.00 31.60 31.84 2hc5 h MET 97 CO -0.35 0.28 -0.27 0.00 0.14 0.00 0.00 176.91 176.71 2hc5 h THR 98 N -0.56 0.66 -0.30 -0.77 1.03 -1.04 0.46 112.91 112.39 2hc5 h THR 98 Ca -0.01 -1.25 -0.11 0.00 -0.01 0.00 0.00 66.41 65.03 2hc5 h THR 98 Cb 0.46 1.82 -0.01 0.00 -1.07 0.00 0.00 68.15 69.35 2hc5 h THR 98 CO 0.02 0.27 -0.28 -0.33 -0.01 0.00 0.00 175.52 175.19 2hc5 h GLU 99 N 0.00 0.62 0.00 0.00 5.08 -1.21 0.52 114.58 119.59 2hc5 h GLU 99 Ca -0.00 -0.26 -0.03 0.00 -1.00 0.00 0.00 59.36 58.07 2hc5 h GLU 99 Cb 0.79 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.02 2hc5 h GLU 99 CO 0.04 0.83 -0.26 0.35 -1.00 0.00 0.00 179.01 178.96 2hc5 h PHE 100 N 0.53 0.00 0.00 4.33 3.57 -1.34 -3.37 116.94 120.67 2hc5 h PHE 100 Ca 0.07 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.57 2hc5 h PHE 100 Cb 0.75 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.49 2hc5 h PHE 100 CO 0.03 0.45 0.00 1.28 -2.23 0.00 0.00 178.31 177.85 2hc5 n LEU 101 N -4.66 0.00 0.00 0.59 4.77 0.16 -1.73 117.00 116.13 2hc5 n LEU 101 Ca -0.08 0.34 0.08 0.00 -0.03 0.00 0.00 56.01 56.32 2hc5 n LEU 101 Cb 0.27 -0.34 0.49 0.00 -2.33 0.00 0.00 43.42 41.51 2hc5 n LEU 101 CO 0.13 -0.12 0.72 0.61 -1.33 0.00 0.00 177.39 177.41 2hc5 n GLY 102 N 0.40 -0.70 0.06 -0.72 0.00 0.17 -1.82 105.19 102.59 2hc5 n GLY 102 Ca 0.08 -0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.87 0.51 -1.74 0.99 4.77 -0.70 -4.15 117.00 115.81 2hc5 n LEU 103 Ca 0.12 0.12 0.07 0.00 -0.03 0.00 0.00 56.01 56.29 2hc5 n LEU 103 Cb 0.06 -0.05 0.38 0.00 -2.33 0.00 0.00 43.42 41.48 2hc5 n LEU 103 CO 0.09 -0.06 0.86 0.49 -1.33 0.00 0.00 177.39 177.44 2hc5 n PHE 104 N -2.35 1.93 -2.84 -1.77 3.01 -0.75 -4.57 117.46 110.11 2hc5 n PHE 104 Ca -0.01 -0.79 -0.40 0.00 1.01 0.00 0.00 57.45 57.26 2hc5 n PHE 104 Cb 0.53 -0.49 -0.06 0.00 -0.01 0.00 0.00 39.48 39.45 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 -2.80 4.31 -0.41 -4.37 -7.23 -1.24 -4.93 120.40 103.74 2hc5 s VAL 105 Ca 0.53 1.92 -0.10 0.00 -1.81 0.00 0.00 61.98 62.52 2hc5 s VAL 105 Cb 0.41 -4.25 0.06 0.00 0.56 0.00 0.00 36.38 33.16 2hc5 s VAL 105 CO 0.15 0.46 0.25 -0.62 -0.31 0.00 0.00 175.10 175.02 2hc5 s ASP 106 N -0.83 5.70 0.00 4.85 2.15 -1.26 -5.00 116.67 122.28 2hc5 s ASP 106 Ca 0.40 -1.31 0.00 0.00 0.43 0.00 0.00 52.55 52.07 2hc5 s ASP 106 Cb -0.24 -2.01 0.00 0.00 -0.30 0.00 0.00 42.92 40.37 2hc5 s ASP 106 CO 0.29 -0.49 0.00 1.21 -0.17 0.00 0.00 175.17 176.01 2hc5 n GLU 107 N 4.96 0.00 0.24 4.34 4.07 -1.26 0.76 120.64 133.76 2hc5 n GLU 107 Ca -0.11 0.00 0.09 0.00 -0.06 0.00 0.00 57.16 57.08 2hc5 n GLU 107 Cb 0.44 0.00 0.60 0.00 -0.06 0.00 0.00 31.44 32.42 2hc5 n GLU 107 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 2hc5 h LYS 108 N 0.00 0.00 -0.57 5.31 1.79 -2.04 -0.99 116.57 120.07 2hc5 h LYS 108 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2hc5 h LYS 108 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2hc5 h LYS 108 CO 0.00 0.19 0.00 1.63 -1.08 0.00 0.00 179.45 180.19 2hc5 n LYS 109 N -3.81 2.43 0.14 3.15 5.02 0.23 -4.03 118.16 121.29 2hc5 n LYS 109 Ca -0.02 -2.21 0.07 0.00 -2.02 0.00 0.00 58.31 54.12 2hc5 n LYS 109 Cb 0.29 -1.49 0.04 0.00 -0.02 0.00 0.00 35.03 33.85 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 3.75 0.00 1.40 -0.35 3.38 -1.04 -3.48 115.31 118.97 2hc5 h LEU 110 Ca 0.00 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.77 2hc5 h LEU 110 Cb 0.85 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.53 2hc5 h LEU 110 CO 0.00 0.27 -0.28 -1.84 0.09 0.00 0.00 178.44 176.68 2hc5 n GLU 111 N -3.02 -2.60 -2.70 1.13 0.28 -1.26 -4.85 120.64 107.63 2hc5 n GLU 111 Ca 0.00 0.22 -0.42 0.00 -0.16 0.00 0.00 57.16 56.79 2hc5 n GLU 111 Cb 0.66 -4.78 -0.03 0.00 1.43 0.00 0.00 31.44 28.71 2hc5 n GLU 111 CO 0.00 0.00 0.00 -3.38 -0.16 0.00 0.00 177.13 173.59 2hc5 s HIS 112 N -2.45 2.63 -0.57 -1.84 -3.43 -1.26 -4.79 115.29 103.58 2hc5 s HIS 112 Ca 0.19 0.08 0.24 0.00 -0.80 0.00 0.00 55.06 54.78 2hc5 s HIS 112 Cb -0.11 -4.35 0.48 0.00 -1.43 0.00 0.00 32.58 27.18 2hc5 s HIS 112 CO 0.23 -1.58 1.56 1.25 -2.00 0.00 0.00 174.74 174.19 2hc5 h HIS 113 N 9.54 0.00 -3.78 0.38 6.17 -2.01 -3.44 115.15 122.01 2hc5 h HIS 113 Ca -0.26 0.00 -0.49 0.00 0.71 0.00 0.00 60.37 60.33 2hc5 h HIS 113 Cb 1.06 0.00 -0.02 0.00 2.52 0.00 0.00 27.41 30.97 2hc5 h HIS 113 CO 1.00 0.00 0.33 -1.01 0.71 0.00 0.00 177.93 178.95 2hc5 s HIS 114 N -3.18 3.85 0.27 5.26 3.76 -1.26 -4.97 115.29 119.02 2hc5 s HIS 114 Ca 0.07 1.82 -0.04 0.00 -0.15 0.00 0.00 55.06 56.77 2hc5 s HIS 114 Cb 0.10 -2.93 0.34 0.00 1.11 0.00 0.00 32.58 31.20 2hc5 s HIS 114 CO 0.66 0.36 1.90 1.25 -0.85 0.00 0.00 174.74 178.07 2hc5 h HIS 115 N 3.73 1.10 0.00 1.40 2.76 -2.03 -3.44 115.15 118.68 2hc5 h HIS 115 Ca -0.46 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 57.70 2hc5 h HIS 115 Cb 1.20 -0.36 0.00 0.00 1.55 0.00 0.00 27.41 29.80 2hc5 h HIS 115 CO 0.62 0.75 0.00 1.58 -1.30 0.00 0.00 177.93 179.57 2hc5 n HIS 116 N -4.36 -3.99 -0.83 5.26 -0.00 -1.26 -5.12 115.22 104.93 2hc5 n HIS 116 Ca 0.09 1.21 0.00 0.00 0.46 0.00 0.00 57.72 59.48 2hc5 n HIS 116 Cb 0.08 2.95 0.00 0.00 -0.12 0.00 0.00 29.99 32.90 2hc5 n HIS 116 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38